NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
387492 | 1mhi | 1585 | cing | 4-filtered-FRED | STAR | entry | full | 350 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1mhi # This FRED archive file contains, for PDB entry <1mhi>: # # - 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_1mhi _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1mhi _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 5800.56 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 $INSULIN A . 1 1 2 . 2 $INSULIN_2 B . 1 1 stop_ save_ save_INSULIN _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name INSULIN _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GIVEQCCTSICSLYQLENYCN _Entity.Number_of_monomers 21 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 GLY . 1 1 2 ILE . 1 1 3 VAL . 1 1 4 GLU . 1 1 5 GLN . 1 1 6 CYS . 1 1 7 CYS . 1 1 8 THR . 1 1 9 SER . 1 1 10 ILE . 1 1 11 CYS . 1 1 12 SER . 1 1 13 LEU . 1 1 14 TYR . 1 1 15 GLN . 1 1 16 LEU . 1 1 17 GLU . 1 1 18 ASN . 1 1 19 TYR . 1 1 20 CYS . 1 1 21 ASN . 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 GLY 1 1 1 1 ILE 2 2 1 1 VAL 3 3 1 1 GLU 4 4 1 1 GLN 5 5 1 1 CYS 6 6 1 1 CYS 7 7 1 1 THR 8 8 1 1 SER 9 9 1 1 ILE 10 10 1 1 CYS 11 11 1 1 SER 12 12 1 1 LEU 13 13 1 1 TYR 14 14 1 1 GLN 15 15 1 1 LEU 16 16 1 1 GLU 17 17 1 1 ASN 18 18 1 1 TYR 19 19 1 1 CYS 20 20 1 1 ASN 21 21 1 1 stop_ save_ save_INSULIN_2 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "INSULIN 2" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code FVNQHLCGDHLVEALYLVCGERGFFYTPKT _Entity.Number_of_monomers 30 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 PHE . 1 2 2 VAL . 1 2 3 ASN . 1 2 4 GLN . 1 2 5 HIS . 1 2 6 LEU . 1 2 7 CYS . 1 2 8 GLY . 1 2 9 ASP . 1 2 10 HIS . 1 2 11 LEU . 1 2 12 VAL . 1 2 13 GLU . 1 2 14 ALA . 1 2 15 LEU . 1 2 16 TYR . 1 2 17 LEU . 1 2 18 VAL . 1 2 19 CYS . 1 2 20 GLY . 1 2 21 GLU . 1 2 22 ARG . 1 2 23 GLY . 1 2 24 PHE . 1 2 25 PHE . 1 2 26 TYR . 1 2 27 THR . 1 2 28 PRO . 1 2 29 LYS . 1 2 30 THR . 1 2 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 PHE 1 1 1 2 VAL 2 2 1 2 ASN 3 3 1 2 GLN 4 4 1 2 HIS 5 5 1 2 LEU 6 6 1 2 CYS 7 7 1 2 GLY 8 8 1 2 ASP 9 9 1 2 HIS 10 10 1 2 LEU 11 11 1 2 VAL 12 12 1 2 GLU 13 13 1 2 ALA 14 14 1 2 LEU 15 15 1 2 TYR 16 16 1 2 LEU 17 17 1 2 VAL 18 18 1 2 CYS 19 19 1 2 GLY 20 20 1 2 GLU 21 21 1 2 ARG 22 22 1 2 GLY 23 23 1 2 PHE 24 24 1 2 PHE 25 25 1 2 TYR 26 26 1 2 THR 27 27 1 2 PRO 28 28 1 2 LYS 29 29 1 2 THR 30 30 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_2_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 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 2 ILE HA acha 2 . HA 1 1 1 1 2 1 1 2 ILE MD acha 2 . HD* 1 1 2 1 1 1 1 2 ILE HA acha 2 . HA 1 1 2 1 2 1 1 2 ILE QG acha 2 . HG* 1 1 2 1 2 1 1 2 ILE MG acha 2 . HG* 1 1 3 1 1 1 1 2 ILE MD acha 2 . HD* 1 1 3 1 2 1 1 2 ILE QG acha 2 . HG* 1 1 3 1 2 1 1 2 ILE MG acha 2 . HG* 1 1 4 1 1 1 1 2 ILE MD acha 2 . HD* 1 1 4 1 2 1 1 3 VAL QG acha 3 . HG* 1 1 5 1 1 1 1 2 ILE MD acha 2 . HD* 1 1 5 1 2 1 1 19 TYR QD acha 19 . HD* 1 1 6 1 1 1 1 2 ILE MD acha 2 . HD* 1 1 6 1 2 1 1 20 CYS H acha 20 . HN 1 1 7 1 1 1 1 2 ILE MD acha 2 . HD* 1 1 7 1 2 2 2 12 VAL HB bcha 12 . HB 1 1 8 1 1 1 1 2 ILE MD acha 2 . HD* 1 1 8 1 2 2 2 15 LEU H bcha 15 . HN 1 1 9 1 1 1 1 2 ILE MD acha 2 . HD* 1 1 9 1 2 2 2 26 TYR QD bcha 26 . HD* 1 1 10 1 1 1 1 2 ILE MD acha 2 . HD* 1 1 10 1 2 2 2 26 TYR QE bcha 26 . HE* 1 1 11 1 1 1 1 2 ILE QG acha 2 . HG* 1 1 11 1 1 1 1 2 ILE MG acha 2 . HG* 1 1 11 1 2 1 1 3 VAL H acha 3 . HN 1 1 12 1 1 1 1 2 ILE QG acha 2 . HG* 1 1 12 1 1 1 1 2 ILE MG acha 2 . HG* 1 1 12 1 2 1 1 19 TYR H acha 19 . HN 1 1 13 1 1 1 1 2 ILE QG acha 2 . HG* 1 1 13 1 1 1 1 2 ILE MG acha 2 . HG* 1 1 13 1 2 1 1 20 CYS H acha 20 . HN 1 1 14 1 1 1 1 2 ILE QG acha 2 . HG* 1 1 14 1 1 1 1 2 ILE MG acha 2 . HG* 1 1 14 1 2 2 2 11 LEU HA bcha 11 . HA 1 1 15 1 1 1 1 3 VAL HA acha 3 . HA 1 1 15 1 2 1 1 7 CYS QB acha 7 . HB* 1 1 16 1 1 1 1 3 VAL HB acha 3 . HB 1 1 16 1 2 1 1 3 VAL QG acha 3 . HG* 1 1 17 1 1 1 1 3 VAL QG acha 3 . HG* 1 1 17 1 2 1 1 4 GLU H acha 4 . HN 1 1 18 1 1 1 1 3 VAL QG acha 3 . HG* 1 1 18 1 2 1 1 4 GLU HA acha 4 . HA 1 1 19 1 1 1 1 3 VAL QG acha 3 . HG* 1 1 19 1 2 1 1 7 CYS H acha 7 . HN 1 1 20 1 1 1 1 3 VAL QG acha 3 . HG* 1 1 20 1 2 1 1 7 CYS QB acha 7 . HB* 1 1 21 1 1 1 1 3 VAL QG acha 3 . HG* 1 1 21 1 2 1 1 19 TYR QB acha 19 . HB* 1 1 22 1 1 1 1 3 VAL QG acha 3 . HG* 1 1 22 1 2 2 2 26 TYR QE bcha 26 . HE* 1 1 23 1 1 1 1 3 VAL QG acha 3 . HG* 1 1 23 1 2 2 2 28 PRO HA bcha 28 . HA 1 1 24 1 1 1 1 4 GLU HA acha 4 . HA 1 1 24 1 2 1 1 4 GLU QB acha 4 . HB* 1 1 25 1 1 1 1 4 GLU HA acha 4 . HA 1 1 25 1 2 1 1 8 THR HA acha 8 . HA 1 1 26 1 1 1 1 4 GLU HA acha 4 . HA 1 1 26 1 2 1 1 8 THR HB acha 8 . HB 1 1 27 1 1 1 1 4 GLU HA acha 4 . HA 1 1 27 1 2 1 1 8 THR HG1 acha 8 . HG* 1 1 27 1 2 1 1 8 THR MG acha 8 . HG* 1 1 28 1 1 1 1 4 GLU QG acha 4 . HG* 1 1 28 1 2 1 1 8 THR HG1 acha 8 . HG* 1 1 28 1 2 1 1 8 THR MG acha 8 . HG* 1 1 29 1 1 1 1 5 GLN H acha 5 . HN 1 1 29 1 2 1 1 5 GLN QB acha 5 . HB* 1 1 30 1 1 1 1 5 GLN HA acha 5 . HA 1 1 30 1 2 1 1 5 GLN QB acha 5 . HB* 1 1 31 1 1 1 1 5 GLN QB acha 5 . HB* 1 1 31 1 2 1 1 19 TYR QE acha 19 . HE* 1 1 32 1 1 1 1 5 GLN QG acha 5 . HG* 1 1 32 1 2 1 1 6 CYS H acha 6 . HN 1 1 33 1 1 1 1 5 GLN QG acha 5 . HG* 1 1 33 1 2 1 1 19 TYR QE acha 19 . HE* 1 1 34 1 1 1 1 6 CYS H acha 6 . HN 1 1 34 1 2 1 1 6 CYS QB acha 6 . HB* 1 1 35 1 1 1 1 6 CYS HA acha 6 . HA 1 1 35 1 2 2 2 5 HIS HA bcha 5 . HA 1 1 36 1 1 1 1 7 CYS H acha 7 . HN 1 1 36 1 2 1 1 8 THR H acha 8 . HN 1 1 37 1 1 1 1 7 CYS H acha 7 . HN 1 1 37 1 2 1 1 8 THR HG1 acha 8 . HG* 1 1 37 1 2 1 1 8 THR MG acha 8 . HG* 1 1 38 1 1 1 1 7 CYS HA acha 7 . HA 1 1 38 1 2 2 2 5 HIS QB bcha 5 . HB* 1 1 39 1 1 1 1 7 CYS HA acha 7 . HA 1 1 39 1 2 2 2 6 LEU H bcha 6 . HN 1 1 40 1 1 1 1 7 CYS HA acha 7 . HA 1 1 40 1 2 2 2 7 CYS HA bcha 7 . HA 1 1 41 1 1 1 1 7 CYS QB acha 7 . HB* 1 1 41 1 2 1 1 16 LEU QD acha 16 . HD* 1 1 42 1 1 1 1 7 CYS QB acha 7 . HB* 1 1 42 1 2 2 2 7 CYS HA bcha 7 . HA 1 1 43 1 1 1 1 8 THR H acha 8 . HN 1 1 43 1 2 1 1 10 ILE QG acha 10 . HG* 1 1 43 1 2 1 1 10 ILE MG acha 10 . HG* 1 1 44 1 1 1 1 8 THR HA acha 8 . HA 1 1 44 1 2 1 1 8 THR HG1 acha 8 . HG* 1 1 44 1 2 1 1 8 THR MG acha 8 . HG* 1 1 45 1 1 1 1 8 THR HB acha 8 . HB 1 1 45 1 2 1 1 8 THR HG1 acha 8 . HG* 1 1 45 1 2 1 1 8 THR MG acha 8 . HG* 1 1 46 1 1 1 1 9 SER HA acha 9 . HA 1 1 46 1 2 2 2 5 HIS HE1 bcha 5 . HE1 1 1 47 1 1 1 1 10 ILE H acha 10 . HN 1 1 47 1 2 1 1 10 ILE HB acha 10 . HB 1 1 48 1 1 1 1 10 ILE H acha 10 . HN 1 1 48 1 2 2 2 5 HIS HE1 bcha 5 . HE1 1 1 49 1 1 1 1 10 ILE HA acha 10 . HA 1 1 49 1 2 1 1 10 ILE MD acha 10 . HD* 1 1 50 1 1 1 1 10 ILE HA acha 10 . HA 1 1 50 1 2 1 1 10 ILE QG acha 10 . HG* 1 1 50 1 2 1 1 10 ILE MG acha 10 . HG* 1 1 51 1 1 1 1 10 ILE HB acha 10 . HB 1 1 51 1 2 1 1 10 ILE QG acha 10 . HG* 1 1 51 1 2 1 1 10 ILE MG acha 10 . HG* 1 1 52 1 1 1 1 10 ILE HB acha 10 . HB 1 1 52 1 2 2 2 5 HIS HE1 bcha 5 . HE1 1 1 53 1 1 1 1 10 ILE MD acha 10 . HD* 1 1 53 1 2 1 1 10 ILE QG acha 10 . HG* 1 1 53 1 2 1 1 10 ILE MG acha 10 . HG* 1 1 54 1 1 1 1 10 ILE MD acha 10 . HD* 1 1 54 1 2 2 2 4 GLN NE2 bcha 4 . NE2 1 1 55 1 1 1 1 10 ILE MD acha 10 . HD* 1 1 55 1 2 2 2 5 HIS HE1 bcha 5 . HE1 1 1 56 1 1 1 1 10 ILE QG acha 10 . HG* 1 1 56 1 1 1 1 10 ILE MG acha 10 . HG* 1 1 56 1 2 1 1 12 SER H acha 12 . HN 1 1 57 1 1 1 1 10 ILE QG acha 10 . HG* 1 1 57 1 1 1 1 10 ILE MG acha 10 . HG* 1 1 57 1 2 2 2 3 ASN HA bcha 3 . HA 1 1 58 1 1 1 1 10 ILE QG acha 10 . HG* 1 1 58 1 1 1 1 10 ILE MG acha 10 . HG* 1 1 58 1 2 2 2 3 ASN QB bcha 3 . HB* 1 1 59 1 1 1 1 10 ILE QG acha 10 . HG* 1 1 59 1 1 1 1 10 ILE MG acha 10 . HG* 1 1 59 1 2 2 2 4 GLN H bcha 4 . HN 1 1 60 1 1 1 1 10 ILE QG acha 10 . HG* 1 1 60 1 1 1 1 10 ILE MG acha 10 . HG* 1 1 60 1 2 2 2 4 GLN HA bcha 4 . HA 1 1 61 1 1 1 1 10 ILE QG acha 10 . HG* 1 1 61 1 1 1 1 10 ILE MG acha 10 . HG* 1 1 61 1 2 2 2 4 GLN QB bcha 4 . HB* 1 1 62 1 1 1 1 10 ILE QG acha 10 . HG* 1 1 62 1 1 1 1 10 ILE MG acha 10 . HG* 1 1 62 1 2 2 2 4 GLN NE2 bcha 4 . NE2 1 1 63 1 1 1 1 10 ILE QG acha 10 . HG* 1 1 63 1 1 1 1 10 ILE MG acha 10 . HG* 1 1 63 1 2 2 2 5 HIS HD1 bcha 5 . HD1 1 1 64 1 1 1 1 10 ILE QG acha 10 . HG* 1 1 64 1 1 1 1 10 ILE MG acha 10 . HG* 1 1 64 1 2 2 2 5 HIS HE1 bcha 5 . HE1 1 1 65 1 1 1 1 11 CYS QB acha 11 . HB* 1 1 65 1 2 1 1 12 SER H acha 12 . HN 1 1 66 1 1 1 1 12 SER H acha 12 . HN 1 1 66 1 2 1 1 14 TYR QD acha 14 . HD* 1 1 67 1 1 1 1 12 SER H acha 12 . HN 1 1 67 1 2 1 1 14 TYR QE acha 14 . HE* 1 1 68 1 1 1 1 12 SER H acha 12 . HN 1 1 68 1 2 1 1 15 GLN H acha 15 . HN 1 1 69 1 1 1 1 12 SER H acha 12 . HN 1 1 69 1 2 1 1 15 GLN QB acha 15 . HB* 1 1 70 1 1 1 1 12 SER HA acha 12 . HA 1 1 70 1 2 1 1 12 SER QB acha 12 . HB* 1 1 71 1 1 1 1 12 SER HA acha 12 . HA 1 1 71 1 2 1 1 13 LEU H acha 13 . HN 1 1 72 1 1 1 1 12 SER HA acha 12 . HA 1 1 72 1 2 1 1 13 LEU QB acha 13 . HB* 1 1 73 1 1 1 1 12 SER HA acha 12 . HA 1 1 73 1 2 1 1 15 GLN H acha 15 . HN 1 1 74 1 1 1 1 12 SER QB acha 12 . HB* 1 1 74 1 2 1 1 15 GLN H acha 15 . HN 1 1 75 1 1 1 1 13 LEU H acha 13 . HN 1 1 75 1 2 1 1 14 TYR H acha 14 . HN 1 1 76 1 1 1 1 13 LEU HA acha 13 . HA 1 1 76 1 2 1 1 13 LEU QB acha 13 . HB* 1 1 77 1 1 1 1 13 LEU HA acha 13 . HA 1 1 77 1 2 1 1 13 LEU QD acha 13 . HD* 1 1 78 1 1 1 1 13 LEU HA acha 13 . HA 1 1 78 1 2 1 1 16 LEU QB acha 16 . HB* 1 1 79 1 1 1 1 13 LEU HA acha 13 . HA 1 1 79 1 2 2 2 18 VAL QG bcha 18 . HG* 1 1 80 1 1 1 1 13 LEU QB acha 13 . HB* 1 1 80 1 2 1 1 14 TYR H acha 14 . HN 1 1 81 1 1 1 1 13 LEU QD acha 13 . HD* 1 1 81 1 2 1 1 14 TYR H acha 14 . HN 1 1 82 1 1 1 1 13 LEU QD acha 13 . HD* 1 1 82 1 2 1 1 14 TYR QE acha 14 . HE* 1 1 83 1 1 1 1 13 LEU QD acha 13 . HD* 1 1 83 1 2 1 1 17 GLU H acha 17 . HN 1 1 84 1 1 1 1 13 LEU QD acha 13 . HD* 1 1 84 1 2 1 1 17 GLU QG acha 17 . HG* 1 1 85 1 1 1 1 13 LEU QD acha 13 . HD* 1 1 85 1 2 2 2 1 PHE QB bcha 1 . HB* 1 1 86 1 1 1 1 13 LEU QD acha 13 . HD* 1 1 86 1 2 2 2 1 PHE QD bcha 1 . HD* 1 1 87 1 1 1 1 13 LEU QD acha 13 . HD* 1 1 87 1 2 2 2 1 PHE QE bcha 1 . HE* 1 1 88 1 1 1 1 13 LEU QD acha 13 . HD* 1 1 88 1 2 2 2 18 VAL H bcha 18 . HN 1 1 89 1 1 1 1 13 LEU QD acha 13 . HD* 1 1 89 1 2 2 2 18 VAL HA bcha 18 . HA 1 1 90 1 1 1 1 13 LEU QD acha 13 . HD* 1 1 90 1 2 2 2 18 VAL HB bcha 18 . HB 1 1 91 1 1 1 1 13 LEU QD acha 13 . HD* 1 1 91 1 2 2 2 18 VAL QG bcha 18 . HG* 1 1 92 1 1 1 1 13 LEU HG acha 13 . HG 1 1 92 1 2 1 1 14 TYR HA acha 14 . HA 1 1 93 1 1 1 1 14 TYR H acha 14 . HN 1 1 93 1 2 1 1 14 TYR QB acha 14 . HB* 1 1 94 1 1 1 1 14 TYR HA acha 14 . HA 1 1 94 1 2 1 1 14 TYR QB acha 14 . HB* 1 1 95 1 1 1 1 14 TYR HA acha 14 . HA 1 1 95 1 2 1 1 17 GLU QB acha 17 . HB* 1 1 96 1 1 1 1 14 TYR QB acha 14 . HB* 1 1 96 1 2 1 1 15 GLN HA acha 15 . HA 1 1 97 1 1 1 1 14 TYR QB acha 14 . HB* 1 1 97 1 2 1 1 15 GLN QB acha 15 . HB* 1 1 98 1 1 1 1 14 TYR QB acha 14 . HB* 1 1 98 1 2 1 1 18 ASN QB acha 18 . HB* 1 1 99 1 1 1 1 14 TYR QD acha 14 . HD* 1 1 99 1 2 1 1 15 GLN QG acha 15 . HG* 1 1 100 1 1 1 1 14 TYR QD acha 14 . HD* 1 1 100 1 2 1 1 17 GLU QG acha 17 . HG* 1 1 101 1 1 1 1 14 TYR QE acha 14 . HE* 1 1 101 1 2 1 1 15 GLN HA acha 15 . HA 1 1 102 1 1 1 1 15 GLN H acha 15 . HN 1 1 102 1 2 1 1 15 GLN QB acha 15 . HB* 1 1 103 1 1 1 1 15 GLN HA acha 15 . HA 1 1 103 1 2 1 1 15 GLN QB acha 15 . HB* 1 1 104 1 1 1 1 15 GLN HA acha 15 . HA 1 1 104 1 2 1 1 16 LEU H acha 16 . HN 1 1 105 1 1 1 1 15 GLN HA acha 15 . HA 1 1 105 1 2 1 1 18 ASN QB acha 18 . HB* 1 1 106 1 1 1 1 15 GLN QB acha 15 . HB* 1 1 106 1 2 1 1 16 LEU H acha 16 . HN 1 1 107 1 1 1 1 15 GLN QB acha 15 . HB* 1 1 107 1 2 1 1 18 ASN OD1 acha 18 . OD1 1 1 108 1 1 1 1 15 GLN QG acha 15 . HG* 1 1 108 1 2 1 1 16 LEU QD acha 16 . HD* 1 1 109 1 1 1 1 16 LEU H acha 16 . HN 1 1 109 1 2 1 1 16 LEU HA acha 16 . HA 1 1 110 1 1 1 1 16 LEU H acha 16 . HN 1 1 110 1 2 1 1 16 LEU QB acha 16 . HB* 1 1 111 1 1 1 1 16 LEU H acha 16 . HN 1 1 111 1 2 1 1 16 LEU HG acha 16 . HG 1 1 112 1 1 1 1 16 LEU HA acha 16 . HA 1 1 112 1 2 1 1 16 LEU QB acha 16 . HB* 1 1 113 1 1 1 1 16 LEU HA acha 16 . HA 1 1 113 1 2 1 1 16 LEU QD acha 16 . HD* 1 1 114 1 1 1 1 16 LEU HA acha 16 . HA 1 1 114 1 2 1 1 19 TYR QB acha 19 . HB* 1 1 115 1 1 1 1 16 LEU HA acha 16 . HA 1 1 115 1 2 2 2 11 LEU QD bcha 11 . HD* 1 1 116 1 1 1 1 16 LEU HA acha 16 . HA 1 1 116 1 2 2 2 15 LEU QD bcha 15 . HD* 1 1 117 1 1 1 1 16 LEU QB acha 16 . HB* 1 1 117 1 2 1 1 17 GLU H acha 17 . HN 1 1 118 1 1 1 1 16 LEU QB acha 16 . HB* 1 1 118 1 2 1 1 19 TYR QE acha 19 . HE* 1 1 119 1 1 1 1 16 LEU QB acha 16 . HB* 1 1 119 1 2 2 2 18 VAL HA bcha 18 . HA 1 1 120 1 1 1 1 16 LEU QD acha 16 . HD* 1 1 120 1 2 1 1 17 GLU H acha 17 . HN 1 1 121 1 1 1 1 16 LEU QD acha 16 . HD* 1 1 121 1 2 1 1 17 GLU HA acha 17 . HA 1 1 122 1 1 1 1 16 LEU QD acha 16 . HD* 1 1 122 1 2 1 1 17 GLU QG acha 17 . HG* 1 1 123 1 1 1 1 16 LEU QD acha 16 . HD* 1 1 123 1 2 2 2 14 ALA MB bcha 14 . HB* 1 1 124 1 1 1 1 16 LEU QD acha 16 . HD* 1 1 124 1 2 2 2 18 VAL QG bcha 18 . HG* 1 1 125 1 1 1 1 16 LEU HG acha 16 . HG 1 1 125 1 2 1 1 17 GLU H acha 17 . HN 1 1 126 1 1 1 1 16 LEU HG acha 16 . HG 1 1 126 1 2 2 2 15 LEU QD bcha 15 . HD* 1 1 127 1 1 1 1 17 GLU H acha 17 . HN 1 1 127 1 2 1 1 17 GLU QB acha 17 . HB* 1 1 128 1 1 1 1 17 GLU H acha 17 . HN 1 1 128 1 2 1 1 17 GLU QG acha 17 . HG* 1 1 129 1 1 1 1 17 GLU H acha 17 . HN 1 1 129 1 2 1 1 18 ASN QB acha 18 . HB* 1 1 130 1 1 1 1 17 GLU H acha 17 . HN 1 1 130 1 2 2 2 18 VAL QG bcha 18 . HG* 1 1 131 1 1 1 1 17 GLU HA acha 17 . HA 1 1 131 1 2 1 1 17 GLU QB acha 17 . HB* 1 1 132 1 1 1 1 17 GLU HA acha 17 . HA 1 1 132 1 2 1 1 18 ASN QB acha 18 . HB* 1 1 133 1 1 1 1 17 GLU HA acha 17 . HA 1 1 133 1 2 1 1 20 CYS QB acha 20 . HB* 1 1 134 1 1 1 1 17 GLU QB acha 17 . HB* 1 1 134 1 2 1 1 18 ASN H acha 18 . HN 1 1 135 1 1 1 1 17 GLU QG acha 17 . HG* 1 1 135 1 2 1 1 19 TYR QE acha 19 . HE* 1 1 136 1 1 1 1 17 GLU QG acha 17 . HG* 1 1 136 1 2 2 2 18 VAL QG bcha 18 . HG* 1 1 137 1 1 1 1 18 ASN H acha 18 . HN 1 1 137 1 2 1 1 18 ASN QB acha 18 . HB* 1 1 138 1 1 1 1 18 ASN H acha 18 . HN 1 1 138 1 2 1 1 19 TYR H acha 19 . HN 1 1 139 1 1 1 1 18 ASN HA acha 18 . HA 1 1 139 1 2 1 1 18 ASN QB acha 18 . HB* 1 1 140 1 1 1 1 18 ASN HA acha 18 . HA 1 1 140 1 2 1 1 19 TYR H acha 19 . HN 1 1 141 1 1 1 1 18 ASN QB acha 18 . HB* 1 1 141 1 2 1 1 19 TYR H acha 19 . HN 1 1 142 1 1 1 1 18 ASN QB acha 18 . HB* 1 1 142 1 2 1 1 19 TYR QB acha 19 . HB* 1 1 143 1 1 1 1 18 ASN QB acha 18 . HB* 1 1 143 1 2 1 1 20 CYS H acha 20 . HN 1 1 144 1 1 1 1 19 TYR H acha 19 . HN 1 1 144 1 2 1 1 19 TYR QB acha 19 . HB* 1 1 145 1 1 1 1 19 TYR HA acha 19 . HA 1 1 145 1 2 1 1 19 TYR QB acha 19 . HB* 1 1 146 1 1 1 1 19 TYR QB acha 19 . HB* 1 1 146 1 2 2 2 15 LEU QD bcha 15 . HD* 1 1 147 1 1 1 1 19 TYR QD acha 19 . HD* 1 1 147 1 2 2 2 15 LEU QD bcha 15 . HD* 1 1 148 1 1 1 1 19 TYR QD acha 19 . HD* 1 1 148 1 2 2 2 15 LEU HG bcha 15 . HG 1 1 149 1 1 1 1 19 TYR QE acha 19 . HE* 1 1 149 1 2 1 1 20 CYS QB acha 20 . HB* 1 1 150 1 1 1 1 20 CYS H acha 20 . HN 1 1 150 1 2 1 1 20 CYS QB acha 20 . HB* 1 1 151 1 1 1 1 20 CYS H acha 20 . HN 1 1 151 1 2 2 2 25 PHE H bcha 25 . HN 1 1 152 1 1 1 1 20 CYS HA acha 20 . HA 1 1 152 1 2 1 1 21 ASN H acha 21 . HN 1 1 153 1 1 1 1 20 CYS HA acha 20 . HA 1 1 153 1 2 2 2 19 CYS H bcha 19 . HN 1 1 154 1 1 1 1 20 CYS QB acha 20 . HB* 1 1 154 1 2 1 1 21 ASN H acha 21 . HN 1 1 155 1 1 1 1 20 CYS QB acha 20 . HB* 1 1 155 1 2 2 2 15 LEU H bcha 15 . HN 1 1 156 1 1 1 1 21 ASN CG acha 21 . CG 1 1 156 1 2 1 1 21 ASN H acha 21 . HN 1 1 157 1 1 1 1 21 ASN H acha 21 . HN 1 1 157 1 2 1 1 21 ASN QB acha 21 . HB* 1 1 158 1 1 1 1 21 ASN H acha 21 . HN 1 1 158 1 2 2 2 22 ARG QB bcha 22 . HB* 1 1 159 1 1 1 1 21 ASN H acha 21 . HN 1 1 159 1 2 2 2 24 PHE H bcha 24 . HN 1 1 160 1 1 1 1 21 ASN H acha 21 . HN 1 1 160 1 2 2 2 24 PHE HA bcha 24 . HA 1 1 161 1 1 1 1 21 ASN H acha 21 . HN 1 1 161 1 2 2 2 25 PHE H bcha 25 . HN 1 1 162 1 1 1 1 21 ASN QB acha 21 . HB* 1 1 162 1 2 1 1 21 ASN OD1 acha 21 . OD1 1 1 163 1 1 1 1 21 ASN OD1 acha 21 . OD1 1 1 163 1 2 2 2 22 ARG H bcha 22 . HN 1 1 164 1 1 1 1 21 ASN OD1 acha 21 . OD1 1 1 164 1 2 2 2 25 PHE QE bcha 25 . HE* 1 1 165 1 1 2 2 1 PHE HA bcha 1 . HA 1 1 165 1 2 2 2 2 VAL H bcha 2 . HN 1 1 166 1 1 2 2 1 PHE HA bcha 1 . HA 1 1 166 1 2 2 2 2 VAL QG bcha 2 . HG* 1 1 167 1 1 2 2 1 PHE QB bcha 1 . HB* 1 1 167 1 2 2 2 1 PHE QD bcha 1 . HD* 1 1 168 1 1 2 2 1 PHE QB bcha 1 . HB* 1 1 168 1 2 2 2 2 VAL H bcha 2 . HN 1 1 169 1 1 2 2 1 PHE QD bcha 1 . HD* 1 1 169 1 2 2 2 2 VAL H bcha 2 . HN 1 1 170 1 1 2 2 1 PHE QD bcha 1 . HD* 1 1 170 1 2 2 2 2 VAL QG bcha 2 . HG* 1 1 171 1 1 2 2 1 PHE QE bcha 1 . HE* 1 1 171 1 2 2 2 2 VAL QG bcha 2 . HG* 1 1 172 1 1 2 2 2 VAL H bcha 2 . HN 1 1 172 1 2 2 2 2 VAL HA bcha 2 . HA 1 1 173 1 1 2 2 2 VAL H bcha 2 . HN 1 1 173 1 2 2 2 3 ASN ND2 bcha 3 . ND2 1 1 174 1 1 2 2 2 VAL HA bcha 2 . HA 1 1 174 1 2 2 2 2 VAL QG bcha 2 . HG* 1 1 175 1 1 2 2 2 VAL HA bcha 2 . HA 1 1 175 1 2 2 2 3 ASN H bcha 3 . HN 1 1 176 1 1 2 2 2 VAL HA bcha 2 . HA 1 1 176 1 2 2 2 3 ASN QB bcha 3 . HB* 1 1 177 1 1 2 2 2 VAL HB bcha 2 . HB 1 1 177 1 2 2 2 2 VAL QG bcha 2 . HG* 1 1 178 1 1 2 2 2 VAL HB bcha 2 . HB 1 1 178 1 2 2 2 4 GLN NE2 bcha 4 . NE2 1 1 179 1 1 2 2 2 VAL QG bcha 2 . HG* 1 1 179 1 2 2 2 3 ASN QB bcha 3 . HB* 1 1 180 1 1 2 2 2 VAL QG bcha 2 . HG* 1 1 180 1 2 2 2 4 GLN H bcha 4 . HN 1 1 181 1 1 2 2 3 ASN HA bcha 3 . HA 1 1 181 1 2 2 2 4 GLN H bcha 4 . HN 1 1 182 1 1 2 2 3 ASN QB bcha 3 . HB* 1 1 182 1 2 2 2 4 GLN H bcha 4 . HN 1 1 183 1 1 2 2 3 ASN QB bcha 3 . HB* 1 1 183 1 2 2 2 6 LEU QD bcha 6 . HD* 1 1 184 1 1 2 2 4 GLN H bcha 4 . HN 1 1 184 1 2 2 2 4 GLN QB bcha 4 . HB* 1 1 185 1 1 2 2 4 GLN HA bcha 4 . HA 1 1 185 1 2 2 2 4 GLN QB bcha 4 . HB* 1 1 186 1 1 2 2 4 GLN QB bcha 4 . HB* 1 1 186 1 2 2 2 6 LEU QB bcha 6 . HB* 1 1 187 1 1 2 2 4 GLN QB bcha 4 . HB* 1 1 187 1 2 2 2 6 LEU QD bcha 6 . HD* 1 1 188 1 1 2 2 4 GLN QG bcha 4 . HG* 1 1 188 1 2 2 2 5 HIS H bcha 5 . HN 1 1 189 1 1 2 2 4 GLN QG bcha 4 . HG* 1 1 189 1 2 2 2 6 LEU QD bcha 6 . HD* 1 1 190 1 1 2 2 5 HIS H bcha 5 . HN 1 1 190 1 2 2 2 5 HIS QB bcha 5 . HB* 1 1 191 1 1 2 2 5 HIS HA bcha 5 . HA 1 1 191 1 2 2 2 5 HIS QB bcha 5 . HB* 1 1 192 1 1 2 2 5 HIS HA bcha 5 . HA 1 1 192 1 2 2 2 6 LEU H bcha 6 . HN 1 1 193 1 1 2 2 5 HIS QB bcha 5 . HB* 1 1 193 1 2 2 2 6 LEU H bcha 6 . HN 1 1 194 1 1 2 2 6 LEU HA bcha 6 . HA 1 1 194 1 2 2 2 6 LEU QB bcha 6 . HB* 1 1 195 1 1 2 2 6 LEU HA bcha 6 . HA 1 1 195 1 2 2 2 6 LEU QD bcha 6 . HD* 1 1 196 1 1 2 2 6 LEU HA bcha 6 . HA 1 1 196 1 2 2 2 7 CYS QB bcha 7 . HB* 1 1 197 1 1 2 2 6 LEU HA bcha 6 . HA 1 1 197 1 2 2 2 10 HIS QB bcha 10 . HB* 1 1 198 1 1 2 2 6 LEU QB bcha 6 . HB* 1 1 198 1 2 2 2 6 LEU QD bcha 6 . HD* 1 1 199 1 1 2 2 6 LEU QB bcha 6 . HB* 1 1 199 1 2 2 2 11 LEU HA bcha 11 . HA 1 1 200 1 1 2 2 6 LEU QB bcha 6 . HB* 1 1 200 1 2 2 2 11 LEU QD bcha 11 . HD* 1 1 201 1 1 2 2 6 LEU QD bcha 6 . HD* 1 1 201 1 2 2 2 10 HIS HA bcha 10 . HA 1 1 202 1 1 2 2 6 LEU QD bcha 6 . HD* 1 1 202 1 2 2 2 10 HIS QB bcha 10 . HB* 1 1 203 1 1 2 2 6 LEU QD bcha 6 . HD* 1 1 203 1 2 2 2 11 LEU HA bcha 11 . HA 1 1 204 1 1 2 2 6 LEU QD bcha 6 . HD* 1 1 204 1 2 2 2 14 ALA H bcha 14 . HN 1 1 205 1 1 2 2 6 LEU QD bcha 6 . HD* 1 1 205 1 2 2 2 14 ALA MB bcha 14 . HB* 1 1 206 1 1 2 2 6 LEU HG bcha 6 . HG 1 1 206 1 2 2 2 7 CYS H bcha 7 . HN 1 1 207 1 1 2 2 6 LEU HG bcha 6 . HG 1 1 207 1 2 2 2 11 LEU HA bcha 11 . HA 1 1 208 1 1 2 2 7 CYS H bcha 7 . HN 1 1 208 1 2 2 2 7 CYS QB bcha 7 . HB* 1 1 209 1 1 2 2 7 CYS H bcha 7 . HN 1 1 209 1 2 2 2 10 HIS H bcha 10 . HN 1 1 210 1 1 2 2 7 CYS H bcha 7 . HN 1 1 210 1 2 2 2 10 HIS QB bcha 10 . HB* 1 1 211 1 1 2 2 7 CYS QB bcha 7 . HB* 1 1 211 1 2 2 2 8 GLY H bcha 8 . HN 1 1 212 1 1 2 2 7 CYS QB bcha 7 . HB* 1 1 212 1 2 2 2 8 GLY QA bcha 8 . HA* 1 1 213 1 1 2 2 8 GLY H bcha 8 . HN 1 1 213 1 2 2 2 8 GLY QA bcha 8 . HA* 1 1 214 1 1 2 2 8 GLY QA bcha 8 . HA* 1 1 214 1 2 2 2 9 ASP QB bcha 9 . HB* 1 1 215 1 1 2 2 8 GLY QA bcha 8 . HA* 1 1 215 1 2 2 2 10 HIS H bcha 10 . HN 1 1 216 1 1 2 2 8 GLY QA bcha 8 . HA* 1 1 216 1 2 2 2 12 VAL H bcha 12 . HN 1 1 217 1 1 2 2 9 ASP H bcha 9 . HN 1 1 217 1 2 2 2 9 ASP QB bcha 9 . HB* 1 1 218 1 1 2 2 9 ASP HA bcha 9 . HA 1 1 218 1 2 2 2 9 ASP QB bcha 9 . HB* 1 1 219 1 1 2 2 10 HIS H bcha 10 . HN 1 1 219 1 2 2 2 10 HIS QB bcha 10 . HB* 1 1 220 1 1 2 2 10 HIS HA bcha 10 . HA 1 1 220 1 2 2 2 10 HIS QB bcha 10 . HB* 1 1 221 1 1 2 2 10 HIS HA bcha 10 . HA 1 1 221 1 2 2 2 13 GLU QB bcha 13 . HB* 1 1 222 1 1 2 2 10 HIS HA bcha 10 . HA 1 1 222 1 2 2 2 13 GLU QG bcha 13 . HG* 1 1 223 1 1 2 2 10 HIS QB bcha 10 . HB* 1 1 223 1 2 2 2 12 VAL QG bcha 12 . HG* 1 1 224 1 1 2 2 11 LEU HA bcha 11 . HA 1 1 224 1 2 2 2 14 ALA MB bcha 14 . HB* 1 1 225 1 1 2 2 11 LEU QD bcha 11 . HD* 1 1 225 1 2 2 2 12 VAL HA bcha 12 . HA 1 1 226 1 1 2 2 11 LEU QD bcha 11 . HD* 1 1 226 1 2 2 2 14 ALA MB bcha 14 . HB* 1 1 227 1 1 2 2 11 LEU QD bcha 11 . HD* 1 1 227 1 2 2 2 15 LEU HG bcha 15 . HG 1 1 228 1 1 2 2 11 LEU QD bcha 11 . HD* 1 1 228 1 2 2 2 26 TYR QE bcha 26 . HE* 1 1 229 1 1 2 2 11 LEU HG bcha 11 . HG 1 1 229 1 2 2 2 12 VAL HA bcha 12 . HA 1 1 230 1 1 2 2 11 LEU HG bcha 11 . HG 1 1 230 1 2 2 2 26 TYR QE bcha 26 . HE* 1 1 231 1 1 2 2 12 VAL HA bcha 12 . HA 1 1 231 1 2 2 2 12 VAL QG bcha 12 . HG* 1 1 232 1 1 2 2 12 VAL HA bcha 12 . HA 1 1 232 1 2 2 2 15 LEU QB bcha 15 . HB* 1 1 233 1 1 2 2 12 VAL HA bcha 12 . HA 1 1 233 1 2 2 2 15 LEU QD bcha 15 . HD* 1 1 234 1 1 2 2 12 VAL HA bcha 12 . HA 1 1 234 1 2 2 2 15 LEU HG bcha 15 . HG 1 1 235 1 1 2 2 12 VAL HB bcha 12 . HB 1 1 235 1 2 2 2 24 PHE QD bcha 24 . HD* 1 1 236 1 1 2 2 12 VAL HB bcha 12 . HB 1 1 236 1 2 2 2 24 PHE QE bcha 24 . HE* 1 1 237 1 1 2 2 12 VAL QG bcha 12 . HG* 1 1 237 1 2 2 2 13 GLU H bcha 13 . HN 1 1 238 1 1 2 2 12 VAL QG bcha 12 . HG* 1 1 238 1 2 2 2 14 ALA H bcha 14 . HN 1 1 239 1 1 2 2 12 VAL QG bcha 12 . HG* 1 1 239 1 2 2 2 14 ALA HA bcha 14 . HA 1 1 240 1 1 2 2 12 VAL QG bcha 12 . HG* 1 1 240 1 2 2 2 15 LEU H bcha 15 . HN 1 1 241 1 1 2 2 13 GLU H bcha 13 . HN 1 1 241 1 2 2 2 13 GLU QB bcha 13 . HB* 1 1 242 1 1 2 2 13 GLU H bcha 13 . HN 1 1 242 1 2 2 2 13 GLU QG bcha 13 . HG* 1 1 243 1 1 2 2 13 GLU H bcha 13 . HN 1 1 243 1 2 2 2 14 ALA MB bcha 14 . HB* 1 1 244 1 1 2 2 13 GLU H bcha 13 . HN 1 1 244 1 2 2 2 16 TYR QD bcha 16 . HD* 1 1 245 1 1 2 2 13 GLU HA bcha 13 . HA 1 1 245 1 2 2 2 13 GLU QG bcha 13 . HG* 1 1 246 1 1 2 2 13 GLU HA bcha 13 . HA 1 1 246 1 2 2 2 16 TYR QB bcha 16 . HB* 1 1 247 1 1 2 2 13 GLU HA bcha 13 . HA 1 1 247 1 2 2 2 16 TYR QD bcha 16 . HD* 1 1 248 1 1 2 2 13 GLU QB bcha 13 . HB* 1 1 248 1 2 2 2 14 ALA H bcha 14 . HN 1 1 249 1 1 2 2 14 ALA H bcha 14 . HN 1 1 249 1 2 2 2 14 ALA MB bcha 14 . HB* 1 1 250 1 1 2 2 14 ALA H bcha 14 . HN 1 1 250 1 2 2 2 15 LEU H bcha 15 . HN 1 1 251 1 1 2 2 14 ALA H bcha 14 . HN 1 1 251 1 2 2 2 15 LEU QB bcha 15 . HB* 1 1 252 1 1 2 2 14 ALA H bcha 14 . HN 1 1 252 1 2 2 2 15 LEU HG bcha 15 . HG 1 1 253 1 1 2 2 14 ALA HA bcha 14 . HA 1 1 253 1 2 2 2 14 ALA MB bcha 14 . HB* 1 1 254 1 1 2 2 14 ALA HA bcha 14 . HA 1 1 254 1 2 2 2 17 LEU QB bcha 17 . HB* 1 1 255 1 1 2 2 14 ALA HA bcha 14 . HA 1 1 255 1 2 2 2 17 LEU QD bcha 17 . HD* 1 1 256 1 1 2 2 14 ALA HA bcha 14 . HA 1 1 256 1 2 2 2 18 VAL QG bcha 18 . HG* 1 1 257 1 1 2 2 14 ALA MB bcha 14 . HB* 1 1 257 1 2 2 2 15 LEU HA bcha 15 . HA 1 1 258 1 1 2 2 14 ALA MB bcha 14 . HB* 1 1 258 1 2 2 2 15 LEU QB bcha 15 . HB* 1 1 259 1 1 2 2 14 ALA MB bcha 14 . HB* 1 1 259 1 2 2 2 18 VAL QG bcha 18 . HG* 1 1 260 1 1 2 2 15 LEU H bcha 15 . HN 1 1 260 1 2 2 2 15 LEU QD bcha 15 . HD* 1 1 261 1 1 2 2 15 LEU HA bcha 15 . HA 1 1 261 1 2 2 2 15 LEU QB bcha 15 . HB* 1 1 262 1 1 2 2 15 LEU HA bcha 15 . HA 1 1 262 1 2 2 2 15 LEU QD bcha 15 . HD* 1 1 263 1 1 2 2 15 LEU HA bcha 15 . HA 1 1 263 1 2 2 2 15 LEU HG bcha 15 . HG 1 1 264 1 1 2 2 15 LEU HA bcha 15 . HA 1 1 264 1 2 2 2 18 VAL HB bcha 18 . HB 1 1 265 1 1 2 2 15 LEU HA bcha 15 . HA 1 1 265 1 2 2 2 18 VAL QG bcha 18 . HG* 1 1 266 1 1 2 2 15 LEU QB bcha 15 . HB* 1 1 266 1 2 2 2 15 LEU QD bcha 15 . HD* 1 1 267 1 1 2 2 15 LEU QB bcha 15 . HB* 1 1 267 1 2 2 2 15 LEU HG bcha 15 . HG 1 1 268 1 1 2 2 15 LEU QB bcha 15 . HB* 1 1 268 1 2 2 2 18 VAL QG bcha 18 . HG* 1 1 269 1 1 2 2 15 LEU QB bcha 15 . HB* 1 1 269 1 2 2 2 19 CYS QB bcha 19 . HB* 1 1 270 1 1 2 2 15 LEU QB bcha 15 . HB* 1 1 270 1 2 2 2 24 PHE QD bcha 24 . HD* 1 1 271 1 1 2 2 15 LEU QB bcha 15 . HB* 1 1 271 1 2 2 2 24 PHE QE bcha 24 . HE* 1 1 272 1 1 2 2 15 LEU QD bcha 15 . HD* 1 1 272 1 2 2 2 15 LEU HG bcha 15 . HG 1 1 273 1 1 2 2 15 LEU QD bcha 15 . HD* 1 1 273 1 2 2 2 24 PHE QD bcha 24 . HD* 1 1 274 1 1 2 2 15 LEU QD bcha 15 . HD* 1 1 274 1 2 2 2 24 PHE QE bcha 24 . HE* 1 1 275 1 1 2 2 16 TYR H bcha 16 . HN 1 1 275 1 2 2 2 16 TYR QB bcha 16 . HB* 1 1 276 1 1 2 2 16 TYR H bcha 16 . HN 1 1 276 1 2 2 2 17 LEU QD bcha 17 . HD* 1 1 277 1 1 2 2 16 TYR HA bcha 16 . HA 1 1 277 1 2 2 2 16 TYR QB bcha 16 . HB* 1 1 278 1 1 2 2 16 TYR HA bcha 16 . HA 1 1 278 1 2 2 2 24 PHE QE bcha 24 . HE* 1 1 279 1 1 2 2 16 TYR QB bcha 16 . HB* 1 1 279 1 2 2 2 16 TYR QD bcha 16 . HD* 1 1 280 1 1 2 2 16 TYR QB bcha 16 . HB* 1 1 280 1 2 2 2 17 LEU H bcha 17 . HN 1 1 281 1 1 2 2 16 TYR QB bcha 16 . HB* 1 1 281 1 2 2 2 24 PHE QE bcha 24 . HE* 1 1 282 1 1 2 2 17 LEU H bcha 17 . HN 1 1 282 1 2 2 2 17 LEU QB bcha 17 . HB* 1 1 283 1 1 2 2 17 LEU HA bcha 17 . HA 1 1 283 1 2 2 2 17 LEU QB bcha 17 . HB* 1 1 284 1 1 2 2 17 LEU QB bcha 17 . HB* 1 1 284 1 2 2 2 17 LEU QD bcha 17 . HD* 1 1 285 1 1 2 2 17 LEU QB bcha 17 . HB* 1 1 285 1 2 2 2 18 VAL QG bcha 18 . HG* 1 1 286 1 1 2 2 17 LEU QD bcha 17 . HD* 1 1 286 1 2 2 2 18 VAL HA bcha 18 . HA 1 1 287 1 1 2 2 18 VAL HA bcha 18 . HA 1 1 287 1 2 2 2 18 VAL QG bcha 18 . HG* 1 1 288 1 1 2 2 18 VAL HB bcha 18 . HB 1 1 288 1 2 2 2 19 CYS H bcha 19 . HN 1 1 289 1 1 2 2 18 VAL QG bcha 18 . HG* 1 1 289 1 2 2 2 20 GLY QA bcha 20 . HA* 1 1 290 1 1 2 2 18 VAL QG bcha 18 . HG* 1 1 290 1 2 2 2 21 GLU QG bcha 21 . HG* 1 1 291 1 1 2 2 19 CYS QB bcha 19 . HB* 1 1 291 1 2 2 2 22 ARG QD bcha 22 . HD* 1 1 292 1 1 2 2 20 GLY H bcha 20 . HN 1 1 292 1 2 2 2 20 GLY QA bcha 20 . HA* 1 1 293 1 1 2 2 20 GLY QA bcha 20 . HA* 1 1 293 1 2 2 2 21 GLU QG bcha 21 . HG* 1 1 294 1 1 2 2 20 GLY QA bcha 20 . HA* 1 1 294 1 2 2 2 22 ARG H bcha 22 . HN 1 1 295 1 1 2 2 21 GLU H bcha 21 . HN 1 1 295 1 2 2 2 21 GLU QB bcha 21 . HB* 1 1 296 1 1 2 2 21 GLU H bcha 21 . HN 1 1 296 1 2 2 2 22 ARG H bcha 22 . HN 1 1 297 1 1 2 2 21 GLU HA bcha 21 . HA 1 1 297 1 2 2 2 21 GLU QB bcha 21 . HB* 1 1 298 1 1 2 2 21 GLU HA bcha 21 . HA 1 1 298 1 2 2 2 21 GLU QG bcha 21 . HG* 1 1 299 1 1 2 2 21 GLU QB bcha 21 . HB* 1 1 299 1 2 2 2 22 ARG QD bcha 22 . HD* 1 1 300 1 1 2 2 22 ARG H bcha 22 . HN 1 1 300 1 2 2 2 22 ARG HA bcha 22 . HA 1 1 301 1 1 2 2 22 ARG HA bcha 22 . HA 1 1 301 1 2 2 2 22 ARG QB bcha 22 . HB* 1 1 302 1 1 2 2 22 ARG HA bcha 22 . HA 1 1 302 1 2 2 2 23 GLY H bcha 23 . HN 1 1 303 1 1 2 2 22 ARG QB bcha 22 . HB* 1 1 303 1 2 2 2 22 ARG NE bcha 22 . NE 1 1 304 1 1 2 2 22 ARG QB bcha 22 . HB* 1 1 304 1 2 2 2 23 GLY H bcha 23 . HN 1 1 305 1 1 2 2 22 ARG QB bcha 22 . HB* 1 1 305 1 2 2 2 24 PHE QD bcha 24 . HD* 1 1 306 1 1 2 2 23 GLY H bcha 23 . HN 1 1 306 1 2 2 2 23 GLY QA bcha 23 . HA* 1 1 307 1 1 2 2 23 GLY QA bcha 23 . HA* 1 1 307 1 2 2 2 24 PHE H bcha 24 . HN 1 1 308 1 1 2 2 24 PHE HA bcha 24 . HA 1 1 308 1 2 2 2 24 PHE QD bcha 24 . HD* 1 1 309 1 1 2 2 24 PHE QB bcha 24 . HB* 1 1 309 1 2 2 2 24 PHE QD bcha 24 . HD* 1 1 310 1 1 2 2 24 PHE QB bcha 24 . HB* 1 1 310 1 2 2 2 25 PHE H bcha 25 . HN 1 1 311 1 1 2 2 24 PHE QD bcha 24 . HD* 1 1 311 1 2 2 2 25 PHE H bcha 25 . HN 1 1 312 1 1 2 2 24 PHE QD bcha 24 . HD* 1 1 312 1 2 2 2 26 TYR H bcha 26 . HN 1 1 313 1 1 2 2 24 PHE QD bcha 24 . HD* 1 1 313 1 2 2 2 26 TYR QB bcha 26 . HB* 1 1 314 1 1 2 2 25 PHE HA bcha 25 . HA 1 1 314 1 2 2 2 25 PHE QD bcha 25 . HD* 1 1 315 1 1 2 2 25 PHE QD bcha 25 . HD* 1 1 315 1 2 2 2 26 TYR QB bcha 26 . HB* 1 1 316 1 1 2 2 26 TYR HA bcha 26 . HA 1 1 316 1 2 2 2 26 TYR QE bcha 26 . HE* 1 1 317 1 1 2 2 26 TYR QD bcha 26 . HD* 1 1 317 1 2 2 2 28 PRO QB bcha 28 . HB* 1 1 318 1 1 2 2 27 THR H bcha 27 . HN 1 1 318 1 2 2 2 29 LYS QB bcha 29 . HB* 1 1 319 1 1 2 2 27 THR HA bcha 27 . HA 1 1 319 1 2 2 2 27 THR HG1 bcha 27 . HG* 1 1 319 1 2 2 2 27 THR MG bcha 27 . HG* 1 1 320 1 1 2 2 27 THR HA bcha 27 . HA 1 1 320 1 2 2 2 28 PRO QD bcha 28 . HD* 1 1 321 1 1 2 2 27 THR HG1 bcha 27 . HG* 1 1 321 1 1 2 2 27 THR MG bcha 27 . HG* 1 1 321 1 2 2 2 28 PRO QD bcha 28 . HD* 1 1 322 1 1 2 2 27 THR HG1 bcha 27 . HG* 1 1 322 1 1 2 2 27 THR MG bcha 27 . HG* 1 1 322 1 2 2 2 29 LYS H bcha 29 . HN 1 1 323 1 1 2 2 27 THR HG1 bcha 27 . HG* 1 1 323 1 1 2 2 27 THR MG bcha 27 . HG* 1 1 323 1 2 2 2 29 LYS QE bcha 29 . HE* 1 1 324 1 1 2 2 28 PRO HA bcha 28 . HA 1 1 324 1 2 2 2 28 PRO QB bcha 28 . HB* 1 1 325 1 1 2 2 28 PRO HA bcha 28 . HA 1 1 325 1 2 2 2 28 PRO QD bcha 28 . HD* 1 1 326 1 1 2 2 28 PRO HA bcha 28 . HA 1 1 326 1 2 2 2 28 PRO QG bcha 28 . HG* 1 1 327 1 1 2 2 28 PRO HA bcha 28 . HA 1 1 327 1 2 2 2 29 LYS H bcha 29 . HN 1 1 328 1 1 2 2 28 PRO QD bcha 28 . HD* 1 1 328 1 2 2 2 29 LYS H bcha 29 . HN 1 1 329 1 1 2 2 29 LYS H bcha 29 . HN 1 1 329 1 2 2 2 29 LYS QB bcha 29 . HB* 1 1 330 1 1 2 2 29 LYS HA bcha 29 . HA 1 1 330 1 2 2 2 29 LYS QB bcha 29 . HB* 1 1 331 1 1 2 2 29 LYS HA bcha 29 . HA 1 1 331 1 2 2 2 30 THR H bcha 30 . HN 1 1 332 1 1 2 2 29 LYS QB bcha 29 . HB* 1 1 332 1 2 2 2 30 THR H bcha 30 . HN 1 1 333 1 1 2 2 30 THR HA bcha 30 . HA 1 1 333 1 2 2 2 30 THR HG1 bcha 30 . HG* 1 1 333 1 2 2 2 30 THR MG bcha 30 . HG* 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 . . . . . 3.38 2.0 5.88 1 1 2 1 . . . . . 1.35 2.0 3.85 1 1 3 1 . . . . . 4.05 2.0 6.55 1 1 4 1 . . . . . 5.84 2.0 8.34 1 1 5 1 . . . . . 6.66 2.0 9.16 1 1 6 1 . . . . . 4.53 2.0 7.03 1 1 7 1 . . . . . 3.53 2.0 6.03 1 1 8 1 . . . . . 3.53 2.0 6.03 1 1 9 1 . . . . . 5.66 2.0 8.16 1 1 10 1 . . . . . 5.66 2.0 8.16 1 1 11 1 . . . . . 4.81 2.0 7.31 1 1 12 1 . . . . . 4.81 2.0 7.31 1 1 13 1 . . . . . 4.81 2.0 7.31 1 1 14 1 . . . . . 4.81 2.0 7.31 1 1 15 1 . . . . . 3.38 2.0 5.88 1 1 16 1 . . . . . 1.46 2.0 3.96 1 1 17 1 . . . . . 4.81 2.0 7.31 1 1 18 1 . . . . . 4.81 2.0 7.31 1 1 19 1 . . . . . 4.81 2.0 7.31 1 1 20 1 . . . . . 5.69 2.0 8.19 1 1 21 1 . . . . . 5.69 2.0 8.19 1 1 22 1 . . . . . 6.94 2.0 9.44 1 1 23 1 . . . . . 4.81 2.0 7.31 1 1 24 1 . . . . . 1.91 2.0 4.41 1 1 25 1 . . . . . 2.5 2.0 5.0 1 1 26 1 . . . . . 2.5 2.0 5.0 1 1 27 1 . . . . . 3.53 2.0 6.03 1 1 28 1 . . . . . 4.41 2.0 6.91 1 1 29 1 . . . . . 1.32 2.0 3.82 1 1 30 1 . . . . . 1.91 2.0 4.41 1 1 31 1 . . . . . 6.51 2.0 9.01 1 1 32 1 . . . . . 3.38 2.0 5.88 1 1 33 1 . . . . . 6.51 2.0 9.01 1 1 34 1 . . . . . 1.32 2.0 3.82 1 1 35 1 . . . . . 2.5 2.0 5.0 1 1 36 1 . . . . . 0.2 2.0 2.7 1 1 37 1 . . . . . 3.53 2.0 6.03 1 1 38 1 . . . . . 3.38 2.0 5.88 1 1 39 1 . . . . . 2.5 2.0 5.0 1 1 40 1 . . . . . 2.5 2.0 5.0 1 1 41 1 . . . . . 5.69 2.0 8.19 1 1 42 1 . . . . . 3.38 2.0 5.88 1 1 43 1 . . . . . 5.38 2.0 7.88 1 1 44 1 . . . . . 1.38 2.0 3.88 1 1 45 1 . . . . . 0.88 2.0 3.38 1 1 46 1 . . . . . 2.5 2.0 5.0 1 1 47 1 . . . . . 1.7 2.0 4.2 1 1 48 1 . . . . . 2.5 2.0 5.0 1 1 49 1 . . . . . 2.68 2.0 5.18 1 1 50 1 . . . . . 2.39 2.0 4.85 1 1 51 1 . . . . . . 2.0 3.85 1 1 52 1 . . . . . 2.5 2.0 5.0 1 1 53 1 . . . . . . 2.0 3.2 1 1 54 1 . . . . . 3.53 2.0 6.03 1 1 55 1 . . . . . 3.53 2.0 6.03 1 1 56 1 . . . . . 4.56 2.0 6.03 1 1 57 1 . . . . . 5.53 2.0 8.03 1 1 58 1 . . . . . 6.41 2.0 8.76 1 1 59 1 . . . . . 3.53 2.0 6.03 1 1 60 1 . . . . . 3.38 2.0 5.88 1 1 61 1 . . . . . 3.38 2.0 5.88 1 1 62 1 . . . . . 3.38 2.0 5.88 1 1 63 1 . . . . . 3.38 2.0 5.88 1 1 64 1 . . . . . 3.38 2.0 5.03 1 1 65 1 . . . . . 2.36 2.0 4.86 1 1 66 1 . . . . . 4.81 2.0 7.31 1 1 67 1 . . . . . 4.81 2.0 7.31 1 1 68 1 . . . . . 2.5 2.0 5.0 1 1 69 1 . . . . . 3.38 2.0 5.88 1 1 70 1 . . . . . 1.91 2.0 4.41 1 1 71 1 . . . . . 0.2 2.0 2.7 1 1 72 1 . . . . . 3.38 2.0 5.88 1 1 73 1 . . . . . 2.5 2.0 4.0 1 1 74 1 . . . . . 3.38 2.0 5.88 1 1 75 1 . . . . . 0.2 2.0 2.7 1 1 76 1 . . . . . 0.91 2.0 3.41 1 1 77 1 . . . . . 2.38 2.0 4.88 1 1 78 1 . . . . . 2.38 2.0 4.88 1 1 79 1 . . . . . 4.81 2.0 7.31 1 1 80 1 . . . . . 2.36 2.0 4.86 1 1 81 1 . . . . . 4.81 2.0 7.31 1 1 82 1 . . . . . 4.94 2.0 7.44 1 1 83 1 . . . . . 4.81 2.0 7.31 1 1 84 1 . . . . . 5.69 2.0 8.19 1 1 85 1 . . . . . 5.69 2.0 8.19 1 1 86 1 . . . . . 6.94 2.0 9.44 1 1 87 1 . . . . . 6.94 2.0 9.44 1 1 88 1 . . . . . 4.81 2.0 7.31 1 1 89 1 . . . . . 4.81 2.0 7.31 1 1 90 1 . . . . . 4.81 2.0 7.31 1 1 91 1 . . . . . 7.12 2.0 9.62 1 1 92 1 . . . . . 2.5 2.0 5.0 1 1 93 1 . . . . . 1.32 2.0 3.82 1 1 94 1 . . . . . 0.91 2.0 3.41 1 1 95 1 . . . . . 2.38 2.0 4.88 1 1 96 1 . . . . . 3.38 2.0 5.88 1 1 97 1 . . . . . 4.26 2.0 6.76 1 1 98 1 . . . . . 4.26 2.0 6.76 1 1 99 1 . . . . . 5.51 2.0 8.01 1 1 100 1 . . . . . 5.51 2.0 8.01 1 1 101 1 . . . . . 4.63 2.0 7.13 1 1 102 1 . . . . . 1.32 2.0 3.82 1 1 103 1 . . . . . 0.41 2.0 2.91 1 1 104 1 . . . . . 0.7 2.0 3.2 1 1 105 1 . . . . . 3.38 2.0 5.88 1 1 106 1 . . . . . 2.38 2.0 4.88 1 1 107 1 . . . . . 3.38 2.0 5.88 1 1 108 1 . . . . . 5.69 2.0 8.19 1 1 109 1 . . . . . 0.2 2.0 2.7 1 1 110 1 . . . . . 2.32 2.0 4.82 1 1 111 1 . . . . . 1.7 2.0 4.2 1 1 112 1 . . . . . 0.41 2.0 2.91 1 1 113 1 . . . . . 3.38 2.0 5.88 1 1 114 1 . . . . . 2.38 2.0 4.88 1 1 115 1 . . . . . 4.81 2.0 7.31 1 1 116 1 . . . . . 4.81 2.0 7.31 1 1 117 1 . . . . . 2.38 2.0 4.88 1 1 118 1 . . . . . 6.51 2.0 9.01 1 1 119 1 . . . . . 3.38 2.0 5.88 1 1 120 1 . . . . . 4.81 2.0 7.31 1 1 121 1 . . . . . 4.81 2.0 7.31 1 1 122 1 . . . . . 5.69 2.0 8.19 1 1 123 1 . . . . . 5.84 2.0 8.34 1 1 124 1 . . . . . 7.12 2.0 9.62 1 1 125 1 . . . . . 2.5 2.0 5.0 1 1 126 1 . . . . . 4.81 2.0 7.31 1 1 127 1 . . . . . 0.82 2.0 3.32 1 1 128 1 . . . . . 2.57 2.0 5.07 1 1 129 1 . . . . . 3.38 2.0 5.88 1 1 130 1 . . . . . 4.81 2.0 7.31 1 1 131 1 . . . . . 1.91 2.0 4.41 1 1 132 1 . . . . . 3.38 2.0 5.88 1 1 133 1 . . . . . 3.38 2.0 5.88 1 1 134 1 . . . . . 2.38 2.0 4.88 1 1 135 1 . . . . . 5.51 2.0 8.01 1 1 136 1 . . . . . 5.69 2.0 8.19 1 1 137 1 . . . . . 0.82 2.0 3.32 1 1 138 1 . . . . . 2.1 2.0 4.6 1 1 139 1 . . . . . 1.91 2.0 4.41 1 1 140 1 . . . . . 2.1 2.0 4.6 1 1 141 1 . . . . . 2.36 2.0 4.86 1 1 142 1 . . . . . 4.26 2.0 6.76 1 1 143 1 . . . . . 3.38 2.0 5.88 1 1 144 1 . . . . . 1.32 2.0 3.82 1 1 145 1 . . . . . 1.91 2.0 4.41 1 1 146 1 . . . . . 5.69 2.0 8.01 1 1 147 1 . . . . . 7.14 2.0 9.64 1 1 148 1 . . . . . 4.81 2.0 7.31 1 1 149 1 . . . . . 5.61 2.0 8.11 1 1 150 1 . . . . . 1.32 2.0 3.82 1 1 151 1 . . . . . 2.5 2.0 5.0 1 1 152 1 . . . . . 0.7 2.0 3.2 1 1 153 1 . . . . . 2.5 2.0 5.0 1 1 154 1 . . . . . 2.58 2.0 5.08 1 1 155 1 . . . . . 3.38 2.0 5.88 1 1 156 1 . . . . . 0.7 2.0 3.2 1 1 157 1 . . . . . 2.35 2.0 4.85 1 1 158 1 . . . . . 3.38 2.0 5.88 1 1 159 1 . . . . . 2.5 2.0 5.0 1 1 160 1 . . . . . 2.5 2.0 5.0 1 1 161 1 . . . . . 4.5 2.0 7.0 1 1 162 1 . . . . . 2.58 2.0 5.08 1 1 163 1 . . . . . 5.5 2.0 8.0 1 1 164 1 . . . . . 4.63 2.0 7.13 1 1 165 1 . . . . . 0.2 2.0 2.7 1 1 166 1 . . . . . 4.81 2.0 7.31 1 1 167 1 . . . . . 3.21 2.0 5.71 1 1 168 1 . . . . . 2.36 2.0 4.86 1 1 169 1 . . . . . 4.81 2.0 7.31 1 1 170 1 . . . . . 6.94 2.0 9.44 1 1 171 1 . . . . . 6.94 2.0 9.44 1 1 172 1 . . . . . 0.2 2.0 2.7 1 1 173 1 . . . . . 2.5 2.0 5.0 1 1 174 1 . . . . . 0.7 2.0 3.2 1 1 175 1 . . . . . 0.2 2.0 2.7 1 1 176 1 . . . . . 3.38 2.0 5.88 1 1 177 1 . . . . . 3.01 2.0 5.51 1 1 178 1 . . . . . 2.5 2.0 5.0 1 1 179 1 . . . . . 5.69 2.0 8.19 1 1 180 1 . . . . . 4.81 2.0 7.31 1 1 181 1 . . . . . 0.7 2.0 3.2 1 1 182 1 . . . . . 2.36 2.0 4.86 1 1 183 1 . . . . . 5.69 2.0 8.19 1 1 184 1 . . . . . 1.32 2.0 3.82 1 1 185 1 . . . . . 0.91 2.0 3.41 1 1 186 1 . . . . . 6.26 2.0 8.76 1 1 187 1 . . . . . 5.69 2.0 8.19 1 1 188 1 . . . . . 3.38 2.0 5.88 1 1 189 1 . . . . . 7.49 2.0 9.99 1 1 190 1 . . . . . 2.32 2.0 4.82 1 1 191 1 . . . . . 1.91 2.0 4.41 1 1 192 1 . . . . . 0.2 2.0 2.7 1 1 193 1 . . . . . 2.36 2.0 4.86 1 1 194 1 . . . . . 1.91 2.0 4.41 1 1 195 1 . . . . . 3.01 2.0 5.51 1 1 196 1 . . . . . 3.38 2.0 5.88 1 1 197 1 . . . . . 3.38 2.0 5.88 1 1 198 1 . . . . . 3.89 2.0 6.39 1 1 199 1 . . . . . 3.38 2.0 5.88 1 1 200 1 . . . . . 5.69 2.0 8.19 1 1 201 1 . . . . . 6.81 2.0 9.31 1 1 202 1 . . . . . 5.69 2.0 8.19 1 1 203 1 . . . . . 4.81 2.0 7.31 1 1 204 1 . . . . . 4.81 2.0 7.31 1 1 205 1 . . . . . 5.69 2.0 8.19 1 1 206 1 . . . . . 2.5 2.0 5.0 1 1 207 1 . . . . . 2.5 2.0 5.0 1 1 208 1 . . . . . 2.32 2.0 4.82 1 1 209 1 . . . . . 2.5 2.0 5.0 1 1 210 1 . . . . . 3.38 2.0 5.88 1 1 211 1 . . . . . 2.36 2.0 4.86 1 1 212 1 . . . . . 4.18 2.0 6.68 1 1 213 1 . . . . . 0.87 2.0 3.37 1 1 214 1 . . . . . 4.18 2.0 6.68 1 1 215 1 . . . . . 2.14 2.0 4.64 1 1 216 1 . . . . . 2.14 2.0 4.64 1 1 217 1 . . . . . 0.82 2.0 3.32 1 1 218 1 . . . . . 0.91 2.0 3.41 1 1 219 1 . . . . . 1.32 2.0 3.82 1 1 220 1 . . . . . 1.91 2.0 4.41 1 1 221 1 . . . . . 3.38 2.0 5.88 1 1 222 1 . . . . . 3.38 2.0 5.88 1 1 223 1 . . . . . 5.61 2.0 8.11 1 1 224 1 . . . . . 3.53 2.0 6.03 1 1 225 1 . . . . . 4.81 2.0 7.31 1 1 226 1 . . . . . 3.51 2.0 6.01 1 1 227 1 . . . . . 4.81 2.0 7.31 1 1 228 1 . . . . . 7.12 2.0 9.62 1 1 229 1 . . . . . 2.5 2.0 5.0 1 1 230 1 . . . . . 4.81 2.0 7.31 1 1 231 1 . . . . . 3.01 2.0 5.51 1 1 232 1 . . . . . 3.38 2.0 5.88 1 1 233 1 . . . . . 6.81 2.0 9.31 1 1 234 1 . . . . . 4.5 2.0 7.0 1 1 235 1 . . . . . 4.81 2.0 7.31 1 1 236 1 . . . . . 4.81 2.0 7.31 1 1 237 1 . . . . . 4.81 2.0 7.31 1 1 238 1 . . . . . 4.81 2.0 7.31 1 1 239 1 . . . . . 4.81 2.0 7.31 1 1 240 1 . . . . . 4.81 2.0 7.31 1 1 241 1 . . . . . 2.32 2.0 4.82 1 1 242 1 . . . . . 1.57 2.0 4.07 1 1 243 1 . . . . . 3.53 2.0 6.03 1 1 244 1 . . . . . 4.81 2.0 7.31 1 1 245 1 . . . . . 2.35 2.0 4.85 1 1 246 1 . . . . . 3.38 2.0 5.88 1 1 247 1 . . . . . 4.81 2.0 7.31 1 1 248 1 . . . . . 2.36 2.0 4.86 1 1 249 1 . . . . . 0.89 2.0 3.39 1 1 250 1 . . . . . 0.2 2.0 2.7 1 1 251 1 . . . . . 3.38 2.0 5.88 1 1 252 1 . . . . . 2.5 2.0 5.0 1 1 253 1 . . . . . 0.41 2.0 2.91 1 1 254 1 . . . . . 3.38 2.0 5.88 1 1 255 1 . . . . . 4.81 2.0 7.31 1 1 256 1 . . . . . 4.81 2.0 7.31 1 1 257 1 . . . . . 3.53 2.0 6.03 1 1 258 1 . . . . . 4.41 2.0 6.91 1 1 259 1 . . . . . 5.84 2.0 8.34 1 1 260 1 . . . . . 4.01 2.0 6.51 1 1 261 1 . . . . . 0.91 2.0 3.41 1 1 262 1 . . . . . 2.38 2.0 4.88 1 1 263 1 . . . . . 1.7 2.0 4.2 1 1 264 1 . . . . . 2.5 2.0 5.0 1 1 265 1 . . . . . 4.81 2.0 7.31 1 1 266 1 . . . . . 3.39 2.0 5.89 1 1 267 1 . . . . . 1.58 2.0 4.08 1 1 268 1 . . . . . 5.69 2.0 8.19 1 1 269 1 . . . . . 4.26 2.0 6.76 1 1 270 1 . . . . . 5.51 2.0 8.01 1 1 271 1 . . . . . 5.51 2.0 8.01 1 1 272 1 . . . . . 0.7 2.0 3.2 1 1 273 1 . . . . . 7.12 2.0 9.62 1 1 274 1 . . . . . 7.12 2.0 9.62 1 1 275 1 . . . . . 1.32 2.0 3.82 1 1 276 1 . . . . . 4.81 2.0 7.31 1 1 277 1 . . . . . 1.91 2.0 4.41 1 1 278 1 . . . . . 4.63 2.0 7.13 1 1 279 1 . . . . . 3.71 2.0 6.21 1 1 280 1 . . . . . 2.36 2.0 4.86 1 1 281 1 . . . . . 5.51 2.0 8.01 1 1 282 1 . . . . . 1.32 2.0 3.82 1 1 283 1 . . . . . 0.41 2.0 2.91 1 1 284 1 . . . . . 3.89 2.0 6.39 1 1 285 1 . . . . . 5.69 2.0 8.19 1 1 286 1 . . . . . 4.81 2.0 7.31 1 1 287 1 . . . . . . 2.0 3.96 1 1 288 1 . . . . . 2.56 2.0 5.06 1 1 289 1 . . . . . 5.61 2.0 8.11 1 1 290 1 . . . . . 7.49 2.0 9.99 1 1 291 1 . . . . . 2.5 2.0 5.0 1 1 292 1 . . . . . 0.7 2.0 3.2 1 1 293 1 . . . . . 4.38 2.0 6.88 1 1 294 1 . . . . . 2.3 2.0 4.8 1 1 295 1 . . . . . 1.7 2.0 4.2 1 1 296 1 . . . . . 0.2 2.0 2.7 1 1 297 1 . . . . . 0.91 2.0 3.41 1 1 298 1 . . . . . 2.35 2.0 4.85 1 1 299 1 . . . . . 4.26 2.0 6.76 1 1 300 1 . . . . . 0.2 2.0 2.7 1 1 301 1 . . . . . 0.41 2.0 2.91 1 1 302 1 . . . . . 0.7 2.0 3.2 1 1 303 1 . . . . . 2.58 2.0 5.08 1 1 304 1 . . . . . 2.36 2.0 4.86 1 1 305 1 . . . . . 5.51 2.0 8.01 1 1 306 1 . . . . . 1.87 2.0 4.37 1 1 307 1 . . . . . 2.02 2.0 4.52 1 1 308 1 . . . . . 3.63 2.0 6.13 1 1 309 1 . . . . . 3.71 2.0 6.21 1 1 310 1 . . . . . 2.56 2.0 5.06 1 1 311 1 . . . . . 4.63 2.0 7.13 1 1 312 1 . . . . . 4.81 2.0 7.31 1 1 313 1 . . . . . 5.51 2.0 8.01 1 1 314 1 . . . . . 3.63 2.0 6.13 1 1 315 1 . . . . . 5.51 2.0 8.01 1 1 316 1 . . . . . 3.63 2.0 6.13 1 1 317 1 . . . . . 7.49 2.0 9.99 1 1 318 1 . . . . . 3.38 2.0 5.88 1 1 319 1 . . . . . 2.38 2.0 4.88 1 1 320 1 . . . . . 2.38 2.0 4.88 1 1 321 1 . . . . . 4.56 2.0 7.06 1 1 322 1 . . . . . 3.53 2.0 6.03 1 1 323 1 . . . . . 4.41 2.0 6.91 1 1 324 1 . . . . . 0.41 2.0 2.91 1 1 325 1 . . . . . 2.55 2.0 5.05 1 1 326 1 . . . . . 1.35 2.0 3.85 1 1 327 1 . . . . . 0.7 2.0 3.2 1 1 328 1 . . . . . 2.38 2.0 4.88 1 1 329 1 . . . . . 2.32 2.0 4.82 1 1 330 1 . . . . . 0.41 2.0 2.91 1 1 331 1 . . . . . 0.7 2.0 3.2 1 1 332 1 . . . . . 2.36 2.0 4.86 1 1 333 1 . . . . . 2.38 2.0 4.88 1 1 stop_ save_ save_CNS/XPLOR_dihedral_4 _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 VAL N 1 1 3 VAL H 1 1 3 VAL HA 1 1 3 VAL CA -115.00001 -15.0 acha 3 . N acha 3 . HN acha 3 . HA acha 3 . CA 1 1 2 . 1 1 10 ILE N 1 1 10 ILE H 1 1 10 ILE HA 1 1 10 ILE CA -200.0 -40.0 acha 10 . N acha 10 . HN acha 10 . HA acha 10 . CA 1 1 3 . 1 1 12 SER N 1 1 12 SER H 1 1 12 SER HA 1 1 12 SER CA -170.0 -70.0 acha 12 . N acha 12 . HN acha 12 . HA acha 12 . CA 1 1 4 . 1 1 14 TYR N 1 1 14 TYR H 1 1 14 TYR HA 1 1 14 TYR CA -115.00001 -15.0 acha 14 . N acha 14 . HN acha 14 . HA acha 14 . CA 1 1 5 . 1 1 15 GLN N 1 1 15 GLN H 1 1 15 GLN HA 1 1 15 GLN CA -200.0 -40.0 acha 15 . N acha 15 . HN acha 15 . HA acha 15 . CA 1 1 6 . 1 1 17 GLU N 1 1 17 GLU H 1 1 17 GLU HA 1 1 17 GLU CA -170.0 -70.0 acha 17 . N acha 17 . HN acha 17 . HA acha 17 . CA 1 1 7 . 1 1 18 ASN N 1 1 18 ASN H 1 1 18 ASN HA 1 1 18 ASN CA -170.0 -70.0 acha 18 . N acha 18 . HN acha 18 . HA acha 18 . CA 1 1 8 . 1 1 19 TYR N 1 1 19 TYR H 1 1 19 TYR HA 1 1 19 TYR CA -200.0 -40.0 acha 19 . N acha 19 . HN acha 19 . HA acha 19 . CA 1 1 9 . 1 1 20 CYS N 1 1 20 CYS H 1 1 20 CYS HA 1 1 20 CYS CA -170.0 -70.0 acha 20 . N acha 20 . HN acha 20 . HA acha 20 . CA 1 1 10 . 2 2 2 VAL N 2 2 2 VAL H 2 2 2 VAL HA 2 2 2 VAL CA -170.0 -70.0 bcha 2 . N bcha 2 . HN bcha 2 . HA bcha 2 . CA 1 1 11 . 2 2 5 HIS N 2 2 5 HIS H 2 2 5 HIS HA 2 2 5 HIS CA -170.0 -70.0 bcha 5 . N bcha 5 . HN bcha 5 . HA bcha 5 . CA 1 1 12 . 2 2 6 LEU N 2 2 6 LEU H 2 2 6 LEU HA 2 2 6 LEU CA -170.0 -70.0 bcha 6 . N bcha 6 . HN bcha 6 . HA bcha 6 . CA 1 1 13 . 2 2 7 CYS N 2 2 7 CYS H 2 2 7 CYS HA 2 2 7 CYS CA -200.0 -40.0 bcha 7 . N bcha 7 . HN bcha 7 . HA bcha 7 . CA 1 1 14 . 2 2 13 GLU N 2 2 13 GLU H 2 2 13 GLU HA 2 2 13 GLU CA -115.00001 -15.0 bcha 13 . N bcha 13 . HN bcha 13 . HA bcha 13 . CA 1 1 15 . 2 2 18 VAL N 2 2 18 VAL H 2 2 18 VAL HA 2 2 18 VAL CA -200.0 -40.0 bcha 18 . N bcha 18 . HN bcha 18 . HA bcha 18 . CA 1 1 16 . 2 2 19 CYS N 2 2 19 CYS H 2 2 19 CYS HA 2 2 19 CYS CA -195.0 -55.0 bcha 19 . N bcha 19 . HN bcha 19 . HA bcha 19 . CA 1 1 17 . 2 2 22 ARG N 2 2 22 ARG H 2 2 22 ARG HA 2 2 22 ARG CA -170.0 -70.0 bcha 22 . N bcha 22 . HN bcha 22 . HA bcha 22 . 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 GLY C C 0.170 -5.495 -4.717 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -0.813 -6.430 -5.419 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY HA2 H -0.688 -6.279 -6.482 1.00 . A A . 1 GLY HA2 1 1 1 4 1 1 1 GLY HA3 H -1.810 -6.121 -5.143 1.00 . A A . 1 GLY HA3 1 1 1 5 1 1 1 GLY N N -0.616 -7.888 -5.083 1.00 . A A . 1 GLY N 1 1 1 6 1 1 1 GLY O O 0.757 -4.617 -5.311 1.00 . A A . 1 GLY O 1 1 1 7 1 1 2 ILE C C 2.499 -5.544 -2.068 1.00 . A A . 2 ILE C 1 1 1 8 1 1 2 ILE CA C 1.299 -4.807 -2.683 1.00 . A A . 2 ILE CA 1 1 1 9 1 1 2 ILE CB C 0.455 -4.021 -1.562 1.00 . A A . 2 ILE CB 1 1 1 10 1 1 2 ILE CD1 C -0.943 -4.100 0.592 1.00 . A A . 2 ILE CD1 1 1 1 11 1 1 2 ILE CG1 C -0.064 -4.916 -0.390 1.00 . A A . 2 ILE CG1 1 1 1 12 1 1 2 ILE CG2 C -0.778 -3.420 -2.250 1.00 . A A . 2 ILE CG2 1 1 1 13 1 1 2 ILE H H -0.155 -6.423 -3.028 1.00 . A A . 2 ILE H 1 1 1 14 1 1 2 ILE HA H 1.737 -4.090 -3.358 1.00 . A A . 2 ILE HA 1 1 1 15 1 1 2 ILE HB H 1.067 -3.223 -1.155 1.00 . A A . 2 ILE HB 1 1 1 16 1 1 2 ILE HD11 H -0.398 -3.243 0.967 1.00 . A A . 2 ILE HD11 1 1 1 17 1 1 2 ILE HD12 H -1.838 -3.743 0.106 1.00 . A A . 2 ILE HD12 1 1 1 18 1 1 2 ILE HD13 H -1.244 -4.703 1.437 1.00 . A A . 2 ILE HD13 1 1 1 19 1 1 2 ILE HG12 H -0.622 -5.760 -0.772 1.00 . A A . 2 ILE HG12 1 1 1 20 1 1 2 ILE HG13 H 0.767 -5.273 0.198 1.00 . A A . 2 ILE HG13 1 1 1 21 1 1 2 ILE HG21 H -0.471 -2.804 -3.070 1.00 . A A . 2 ILE HG21 1 1 1 22 1 1 2 ILE HG22 H -1.423 -4.192 -2.641 1.00 . A A . 2 ILE HG22 1 1 1 23 1 1 2 ILE HG23 H -1.347 -2.807 -1.576 1.00 . A A . 2 ILE HG23 1 1 1 24 1 1 2 ILE N N 0.343 -5.696 -3.443 1.00 . A A . 2 ILE N 1 1 1 25 1 1 2 ILE O O 3.631 -5.351 -2.441 1.00 . A A . 2 ILE O 1 1 1 26 1 1 3 VAL C C 4.638 -7.532 -1.053 1.00 . A A . 3 VAL C 1 1 1 27 1 1 3 VAL CA C 3.250 -7.198 -0.408 1.00 . A A . 3 VAL CA 1 1 1 28 1 1 3 VAL CB C 2.422 -8.461 0.029 1.00 . A A . 3 VAL CB 1 1 1 29 1 1 3 VAL CG1 C 1.296 -8.029 1.011 1.00 . A A . 3 VAL CG1 1 1 1 30 1 1 3 VAL CG2 C 1.665 -9.087 -1.182 1.00 . A A . 3 VAL CG2 1 1 1 31 1 1 3 VAL H H 1.293 -6.513 -0.904 1.00 . A A . 3 VAL H 1 1 1 32 1 1 3 VAL HA H 3.542 -6.604 0.439 1.00 . A A . 3 VAL HA 1 1 1 33 1 1 3 VAL HB H 3.069 -9.183 0.516 1.00 . A A . 3 VAL HB 1 1 1 34 1 1 3 VAL HG11 H 1.721 -7.543 1.877 1.00 . A A . 3 VAL HG11 1 1 1 35 1 1 3 VAL HG12 H 0.581 -7.364 0.556 1.00 . A A . 3 VAL HG12 1 1 1 36 1 1 3 VAL HG13 H 0.763 -8.909 1.341 1.00 . A A . 3 VAL HG13 1 1 1 37 1 1 3 VAL HG21 H 2.351 -9.403 -1.951 1.00 . A A . 3 VAL HG21 1 1 1 38 1 1 3 VAL HG22 H 1.127 -9.963 -0.847 1.00 . A A . 3 VAL HG22 1 1 1 39 1 1 3 VAL HG23 H 0.954 -8.404 -1.621 1.00 . A A . 3 VAL HG23 1 1 1 40 1 1 3 VAL N N 2.226 -6.387 -1.138 1.00 . A A . 3 VAL N 1 1 1 41 1 1 3 VAL O O 5.517 -6.682 -1.011 1.00 . A A . 3 VAL O 1 1 1 42 1 1 4 GLU C C 6.579 -8.299 -3.563 1.00 . A A . 4 GLU C 1 1 1 43 1 1 4 GLU CA C 6.189 -9.017 -2.251 1.00 . A A . 4 GLU CA 1 1 1 44 1 1 4 GLU CB C 6.184 -10.562 -2.420 1.00 . A A . 4 GLU CB 1 1 1 45 1 1 4 GLU CD C 5.231 -10.712 -0.029 1.00 . A A . 4 GLU CD 1 1 1 46 1 1 4 GLU CG C 6.251 -11.268 -1.006 1.00 . A A . 4 GLU CG 1 1 1 47 1 1 4 GLU H H 4.138 -9.356 -1.629 1.00 . A A . 4 GLU H 1 1 1 48 1 1 4 GLU HA H 6.948 -8.743 -1.543 1.00 . A A . 4 GLU HA 1 1 1 49 1 1 4 GLU HB2 H 5.277 -10.870 -2.922 1.00 . A A . 4 GLU HB2 1 1 1 50 1 1 4 GLU HB3 H 7.028 -10.873 -3.023 1.00 . A A . 4 GLU HB3 1 1 1 51 1 1 4 GLU HG2 H 6.035 -12.320 -1.101 1.00 . A A . 4 GLU HG2 1 1 1 52 1 1 4 GLU HG3 H 7.223 -11.165 -0.555 1.00 . A A . 4 GLU HG3 1 1 1 53 1 1 4 GLU N N 4.850 -8.681 -1.628 1.00 . A A . 4 GLU N 1 1 1 54 1 1 4 GLU O O 7.232 -8.796 -4.459 1.00 . A A . 4 GLU O 1 1 1 55 1 1 4 GLU OE1 O 4.102 -11.140 -0.154 1.00 . A A . 4 GLU OE1 1 1 1 56 1 1 4 GLU OE2 O 5.658 -9.882 0.755 1.00 . A A . 4 GLU OE2 1 1 1 57 1 1 5 GLN C C 6.696 -4.763 -4.262 1.00 . A A . 5 GLN C 1 1 1 58 1 1 5 GLN CA C 6.378 -6.165 -4.784 1.00 . A A . 5 GLN CA 1 1 1 59 1 1 5 GLN CB C 5.100 -6.204 -5.674 1.00 . A A . 5 GLN CB 1 1 1 60 1 1 5 GLN CD C 6.119 -7.711 -7.482 1.00 . A A . 5 GLN CD 1 1 1 61 1 1 5 GLN CG C 5.026 -7.584 -6.424 1.00 . A A . 5 GLN CG 1 1 1 62 1 1 5 GLN H H 5.607 -6.778 -2.873 1.00 . A A . 5 GLN H 1 1 1 63 1 1 5 GLN HA H 7.272 -6.445 -5.339 1.00 . A A . 5 GLN HA 1 1 1 64 1 1 5 GLN HB2 H 4.217 -6.061 -5.063 1.00 . A A . 5 GLN HB2 1 1 1 65 1 1 5 GLN HB3 H 5.132 -5.412 -6.411 1.00 . A A . 5 GLN HB3 1 1 1 66 1 1 5 GLN HE21 H 7.377 -8.667 -6.319 1.00 . A A . 5 GLN HE21 1 1 1 67 1 1 5 GLN HE22 H 7.885 -8.364 -7.926 1.00 . A A . 5 GLN HE22 1 1 1 68 1 1 5 GLN HG2 H 5.122 -8.419 -5.749 1.00 . A A . 5 GLN HG2 1 1 1 69 1 1 5 GLN HG3 H 4.085 -7.670 -6.944 1.00 . A A . 5 GLN HG3 1 1 1 70 1 1 5 GLN N N 6.136 -7.085 -3.631 1.00 . A A . 5 GLN N 1 1 1 71 1 1 5 GLN NE2 N 7.224 -8.302 -7.213 1.00 . A A . 5 GLN NE2 1 1 1 72 1 1 5 GLN O O 7.572 -4.123 -4.799 1.00 . A A . 5 GLN O 1 1 1 73 1 1 5 GLN OE1 O 5.999 -7.265 -8.596 1.00 . A A . 5 GLN OE1 1 1 1 74 1 1 6 CYS C C 6.693 -2.927 -1.179 1.00 . A A . 6 CYS C 1 1 1 75 1 1 6 CYS CA C 6.224 -2.970 -2.661 1.00 . A A . 6 CYS CA 1 1 1 76 1 1 6 CYS CB C 4.885 -2.292 -2.942 1.00 . A A . 6 CYS CB 1 1 1 77 1 1 6 CYS H H 5.305 -4.904 -2.845 1.00 . A A . 6 CYS H 1 1 1 78 1 1 6 CYS HA H 6.995 -2.473 -3.219 1.00 . A A . 6 CYS HA 1 1 1 79 1 1 6 CYS HB2 H 4.151 -2.600 -2.214 1.00 . A A . 6 CYS HB2 1 1 1 80 1 1 6 CYS HB3 H 5.003 -1.223 -2.860 1.00 . A A . 6 CYS HB3 1 1 1 81 1 1 6 CYS HG H 3.605 -3.375 -4.528 1.00 . A A . 6 CYS HG 1 1 1 82 1 1 6 CYS N N 6.000 -4.335 -3.244 1.00 . A A . 6 CYS N 1 1 1 83 1 1 6 CYS O O 7.151 -1.917 -0.682 1.00 . A A . 6 CYS O 1 1 1 84 1 1 6 CYS SG S 4.227 -2.647 -4.592 1.00 . A A . 6 CYS SG 1 1 1 85 1 1 7 CYS C C 8.261 -5.009 0.856 1.00 . A A . 7 CYS C 1 1 1 86 1 1 7 CYS CA C 6.980 -4.161 0.916 1.00 . A A . 7 CYS CA 1 1 1 87 1 1 7 CYS CB C 5.832 -4.863 1.673 1.00 . A A . 7 CYS CB 1 1 1 88 1 1 7 CYS H H 6.188 -4.838 -0.946 1.00 . A A . 7 CYS H 1 1 1 89 1 1 7 CYS HA H 7.224 -3.192 1.333 1.00 . A A . 7 CYS HA 1 1 1 90 1 1 7 CYS HB2 H 5.144 -4.084 1.966 1.00 . A A . 7 CYS HB2 1 1 1 91 1 1 7 CYS HB3 H 5.298 -5.511 0.999 1.00 . A A . 7 CYS HB3 1 1 1 92 1 1 7 CYS HG H 6.640 -6.649 2.832 1.00 . A A . 7 CYS HG 1 1 1 93 1 1 7 CYS N N 6.563 -4.042 -0.517 1.00 . A A . 7 CYS N 1 1 1 94 1 1 7 CYS O O 9.359 -4.574 1.143 1.00 . A A . 7 CYS O 1 1 1 95 1 1 7 CYS SG S 6.260 -5.824 3.150 1.00 . A A . 7 CYS SG 1 1 1 96 1 1 8 THR C C 9.532 -7.175 -1.209 1.00 . A A . 8 THR C 1 1 1 97 1 1 8 THR CA C 9.183 -7.219 0.284 1.00 . A A . 8 THR CA 1 1 1 98 1 1 8 THR CB C 8.670 -8.624 0.705 1.00 . A A . 8 THR CB 1 1 1 99 1 1 8 THR CG2 C 9.746 -9.399 1.400 1.00 . A A . 8 THR CG2 1 1 1 100 1 1 8 THR H H 7.150 -6.462 0.176 1.00 . A A . 8 THR H 1 1 1 101 1 1 8 THR HA H 10.041 -6.922 0.867 1.00 . A A . 8 THR HA 1 1 1 102 1 1 8 THR HB H 8.164 -9.210 -0.051 1.00 . A A . 8 THR HB 1 1 1 103 1 1 8 THR HG1 H 7.023 -8.881 1.607 1.00 . A A . 8 THR HG1 1 1 1 104 1 1 8 THR HG21 H 10.058 -8.871 2.289 1.00 . A A . 8 THR HG21 1 1 1 105 1 1 8 THR HG22 H 9.334 -10.355 1.686 1.00 . A A . 8 THR HG22 1 1 1 106 1 1 8 THR HG23 H 10.585 -9.547 0.741 1.00 . A A . 8 THR HG23 1 1 1 107 1 1 8 THR N N 8.064 -6.216 0.422 1.00 . A A . 8 THR N 1 1 1 108 1 1 8 THR O O 9.484 -8.128 -1.955 1.00 . A A . 8 THR O 1 1 1 109 1 1 8 THR OG1 O 7.840 -8.391 1.828 1.00 . A A . 8 THR OG1 1 1 1 110 1 1 9 SER C C 9.789 -3.997 -3.018 1.00 . A A . 9 SER C 1 1 1 111 1 1 9 SER CA C 10.298 -5.467 -2.934 1.00 . A A . 9 SER CA 1 1 1 112 1 1 9 SER CB C 9.647 -6.330 -4.029 1.00 . A A . 9 SER CB 1 1 1 113 1 1 9 SER H H 9.872 -5.310 -0.833 1.00 . A A . 9 SER H 1 1 1 114 1 1 9 SER HA H 11.370 -5.466 -3.044 1.00 . A A . 9 SER HA 1 1 1 115 1 1 9 SER HB2 H 10.136 -7.295 -4.096 1.00 . A A . 9 SER HB2 1 1 1 116 1 1 9 SER HB3 H 8.604 -6.486 -3.822 1.00 . A A . 9 SER HB3 1 1 1 117 1 1 9 SER HG H 9.061 -5.125 -5.484 1.00 . A A . 9 SER HG 1 1 1 118 1 1 9 SER N N 9.885 -5.969 -1.561 1.00 . A A . 9 SER N 1 1 1 119 1 1 9 SER O O 9.270 -3.523 -2.026 1.00 . A A . 9 SER O 1 1 1 120 1 1 9 SER OG O 9.876 -5.595 -5.232 1.00 . A A . 9 SER OG 1 1 1 121 1 1 10 ILE C C 8.703 -1.319 -5.475 1.00 . A A . 10 ILE C 1 1 1 122 1 1 10 ILE CA C 9.443 -1.869 -4.209 1.00 . A A . 10 ILE CA 1 1 1 123 1 1 10 ILE CB C 10.663 -0.911 -3.954 1.00 . A A . 10 ILE CB 1 1 1 124 1 1 10 ILE CD1 C 12.522 -0.226 -2.333 1.00 . A A . 10 ILE CD1 1 1 1 125 1 1 10 ILE CG1 C 11.279 -1.149 -2.538 1.00 . A A . 10 ILE CG1 1 1 1 126 1 1 10 ILE CG2 C 10.117 0.547 -3.947 1.00 . A A . 10 ILE CG2 1 1 1 127 1 1 10 ILE H H 10.319 -3.731 -4.886 1.00 . A A . 10 ILE H 1 1 1 128 1 1 10 ILE HA H 8.873 -1.634 -3.324 1.00 . A A . 10 ILE HA 1 1 1 129 1 1 10 ILE HB H 11.407 -1.046 -4.730 1.00 . A A . 10 ILE HB 1 1 1 130 1 1 10 ILE HD11 H 12.276 0.820 -2.410 1.00 . A A . 10 ILE HD11 1 1 1 131 1 1 10 ILE HD12 H 12.942 -0.390 -1.356 1.00 . A A . 10 ILE HD12 1 1 1 132 1 1 10 ILE HD13 H 13.276 -0.456 -3.071 1.00 . A A . 10 ILE HD13 1 1 1 133 1 1 10 ILE HG12 H 10.544 -0.991 -1.755 1.00 . A A . 10 ILE HG12 1 1 1 134 1 1 10 ILE HG13 H 11.596 -2.177 -2.453 1.00 . A A . 10 ILE HG13 1 1 1 135 1 1 10 ILE HG21 H 9.641 0.814 -4.877 1.00 . A A . 10 ILE HG21 1 1 1 136 1 1 10 ILE HG22 H 9.394 0.663 -3.148 1.00 . A A . 10 ILE HG22 1 1 1 137 1 1 10 ILE HG23 H 10.922 1.247 -3.806 1.00 . A A . 10 ILE HG23 1 1 1 138 1 1 10 ILE N N 9.916 -3.301 -4.115 1.00 . A A . 10 ILE N 1 1 1 139 1 1 10 ILE O O 9.193 -1.304 -6.586 1.00 . A A . 10 ILE O 1 1 1 140 1 1 11 CYS C C 5.589 0.763 -5.519 1.00 . A A . 11 CYS C 1 1 1 141 1 1 11 CYS CA C 6.552 -0.269 -6.209 1.00 . A A . 11 CYS CA 1 1 1 142 1 1 11 CYS CB C 5.745 -1.412 -6.891 1.00 . A A . 11 CYS CB 1 1 1 143 1 1 11 CYS H H 7.288 -1.014 -4.271 1.00 . A A . 11 CYS H 1 1 1 144 1 1 11 CYS HA H 7.133 0.263 -6.945 1.00 . A A . 11 CYS HA 1 1 1 145 1 1 11 CYS HB2 H 4.756 -1.042 -7.113 1.00 . A A . 11 CYS HB2 1 1 1 146 1 1 11 CYS HB3 H 6.228 -1.676 -7.812 1.00 . A A . 11 CYS HB3 1 1 1 147 1 1 11 CYS HG H 6.216 -3.531 -6.184 1.00 . A A . 11 CYS HG 1 1 1 148 1 1 11 CYS N N 7.513 -0.888 -5.207 1.00 . A A . 11 CYS N 1 1 1 149 1 1 11 CYS O O 4.675 1.357 -6.059 1.00 . A A . 11 CYS O 1 1 1 150 1 1 11 CYS SG S 5.444 -2.976 -6.053 1.00 . A A . 11 CYS SG 1 1 1 151 1 1 12 SER C C 4.642 3.250 -3.494 1.00 . A A . 12 SER C 1 1 1 152 1 1 12 SER CA C 5.172 1.802 -3.264 1.00 . A A . 12 SER CA 1 1 1 153 1 1 12 SER CB C 6.096 1.807 -2.078 1.00 . A A . 12 SER CB 1 1 1 154 1 1 12 SER H H 6.622 0.435 -3.903 1.00 . A A . 12 SER H 1 1 1 155 1 1 12 SER HA H 4.302 1.242 -2.972 1.00 . A A . 12 SER HA 1 1 1 156 1 1 12 SER HB2 H 7.026 2.284 -2.342 1.00 . A A . 12 SER HB2 1 1 1 157 1 1 12 SER HB3 H 5.633 2.274 -1.220 1.00 . A A . 12 SER HB3 1 1 1 158 1 1 12 SER HG H 7.049 0.242 -1.287 1.00 . A A . 12 SER HG 1 1 1 159 1 1 12 SER N N 5.862 0.922 -4.270 1.00 . A A . 12 SER N 1 1 1 160 1 1 12 SER O O 5.388 4.176 -3.690 1.00 . A A . 12 SER O 1 1 1 161 1 1 12 SER OG O 6.285 0.405 -1.874 1.00 . A A . 12 SER OG 1 1 1 162 1 1 13 LEU C C 1.664 4.311 -4.917 1.00 . A A . 13 LEU C 1 1 1 163 1 1 13 LEU CA C 2.312 4.421 -3.590 1.00 . A A . 13 LEU CA 1 1 1 164 1 1 13 LEU CB C 2.767 5.942 -3.636 1.00 . A A . 13 LEU CB 1 1 1 165 1 1 13 LEU CD1 C 3.771 7.875 -2.579 1.00 . A A . 13 LEU CD1 1 1 1 166 1 1 13 LEU CD2 C 3.783 5.705 -1.374 1.00 . A A . 13 LEU CD2 1 1 1 167 1 1 13 LEU CG C 3.866 6.364 -2.757 1.00 . A A . 13 LEU CG 1 1 1 168 1 1 13 LEU H H 2.954 2.433 -3.328 1.00 . A A . 13 LEU H 1 1 1 169 1 1 13 LEU HA H 1.532 4.302 -2.862 1.00 . A A . 13 LEU HA 1 1 1 170 1 1 13 LEU HB2 H 3.044 6.245 -4.639 1.00 . A A . 13 LEU HB2 1 1 1 171 1 1 13 LEU HB3 H 1.892 6.526 -3.380 1.00 . A A . 13 LEU HB3 1 1 1 172 1 1 13 LEU HD11 H 3.846 8.377 -3.533 1.00 . A A . 13 LEU HD11 1 1 1 173 1 1 13 LEU HD12 H 2.828 8.144 -2.124 1.00 . A A . 13 LEU HD12 1 1 1 174 1 1 13 LEU HD13 H 4.571 8.229 -1.946 1.00 . A A . 13 LEU HD13 1 1 1 175 1 1 13 LEU HD21 H 2.851 5.966 -0.893 1.00 . A A . 13 LEU HD21 1 1 1 176 1 1 13 LEU HD22 H 3.837 4.631 -1.444 1.00 . A A . 13 LEU HD22 1 1 1 177 1 1 13 LEU HD23 H 4.600 6.043 -0.755 1.00 . A A . 13 LEU HD23 1 1 1 178 1 1 13 LEU HG H 4.709 6.139 -3.396 1.00 . A A . 13 LEU HG 1 1 1 179 1 1 13 LEU N N 3.336 3.305 -3.455 1.00 . A A . 13 LEU N 1 1 1 180 1 1 13 LEU O O 0.463 4.239 -5.057 1.00 . A A . 13 LEU O 1 1 1 181 1 1 14 TYR C C 1.216 3.016 -7.348 1.00 . A A . 14 TYR C 1 1 1 182 1 1 14 TYR CA C 2.162 4.183 -7.269 1.00 . A A . 14 TYR CA 1 1 1 183 1 1 14 TYR CB C 3.305 3.863 -8.305 1.00 . A A . 14 TYR CB 1 1 1 184 1 1 14 TYR CD1 C 5.244 4.473 -6.720 1.00 . A A . 14 TYR CD1 1 1 1 185 1 1 14 TYR CD2 C 5.535 2.750 -8.312 1.00 . A A . 14 TYR CD2 1 1 1 186 1 1 14 TYR CE1 C 6.528 4.252 -6.262 1.00 . A A . 14 TYR CE1 1 1 1 187 1 1 14 TYR CE2 C 6.817 2.541 -7.848 1.00 . A A . 14 TYR CE2 1 1 1 188 1 1 14 TYR CG C 4.731 3.717 -7.752 1.00 . A A . 14 TYR CG 1 1 1 189 1 1 14 TYR CZ C 7.324 3.288 -6.816 1.00 . A A . 14 TYR CZ 1 1 1 190 1 1 14 TYR H H 3.492 4.244 -5.489 1.00 . A A . 14 TYR H 1 1 1 191 1 1 14 TYR HA H 1.645 5.111 -7.441 1.00 . A A . 14 TYR HA 1 1 1 192 1 1 14 TYR HB2 H 3.045 2.928 -8.798 1.00 . A A . 14 TYR HB2 1 1 1 193 1 1 14 TYR HB3 H 3.282 4.618 -9.072 1.00 . A A . 14 TYR HB3 1 1 1 194 1 1 14 TYR HD1 H 4.660 5.257 -6.266 1.00 . A A . 14 TYR HD1 1 1 1 195 1 1 14 TYR HD2 H 5.159 2.148 -9.126 1.00 . A A . 14 TYR HD2 1 1 1 196 1 1 14 TYR HE1 H 6.903 4.844 -5.449 1.00 . A A . 14 TYR HE1 1 1 1 197 1 1 14 TYR HE2 H 7.430 1.781 -8.303 1.00 . A A . 14 TYR HE2 1 1 1 198 1 1 14 TYR HH H 8.670 3.269 -5.412 1.00 . A A . 14 TYR HH 1 1 1 199 1 1 14 TYR N N 2.577 4.263 -5.838 1.00 . A A . 14 TYR N 1 1 1 200 1 1 14 TYR O O 0.113 3.055 -7.851 1.00 . A A . 14 TYR O 1 1 1 201 1 1 14 TYR OH O 8.600 3.054 -6.352 1.00 . A A . 14 TYR OH 1 1 1 202 1 1 15 GLN C C -0.196 0.832 -5.821 1.00 . A A . 15 GLN C 1 1 1 203 1 1 15 GLN CA C 0.962 0.736 -6.791 1.00 . A A . 15 GLN CA 1 1 1 204 1 1 15 GLN CB C 1.961 -0.411 -6.482 1.00 . A A . 15 GLN CB 1 1 1 205 1 1 15 GLN CD C 2.113 -0.800 -3.926 1.00 . A A . 15 GLN CD 1 1 1 206 1 1 15 GLN CG C 2.703 -0.171 -5.146 1.00 . A A . 15 GLN CG 1 1 1 207 1 1 15 GLN H H 2.672 1.997 -6.444 1.00 . A A . 15 GLN H 1 1 1 208 1 1 15 GLN HA H 0.515 0.648 -7.732 1.00 . A A . 15 GLN HA 1 1 1 209 1 1 15 GLN HB2 H 1.454 -1.362 -6.469 1.00 . A A . 15 GLN HB2 1 1 1 210 1 1 15 GLN HB3 H 2.675 -0.451 -7.293 1.00 . A A . 15 GLN HB3 1 1 1 211 1 1 15 GLN HE21 H 1.253 -2.356 -4.805 1.00 . A A . 15 GLN HE21 1 1 1 212 1 1 15 GLN HE22 H 1.124 -2.215 -3.109 1.00 . A A . 15 GLN HE22 1 1 1 213 1 1 15 GLN HG2 H 3.685 -0.578 -5.240 1.00 . A A . 15 GLN HG2 1 1 1 214 1 1 15 GLN HG3 H 2.808 0.875 -4.928 1.00 . A A . 15 GLN HG3 1 1 1 215 1 1 15 GLN N N 1.756 1.965 -6.808 1.00 . A A . 15 GLN N 1 1 1 216 1 1 15 GLN NE2 N 1.441 -1.883 -3.965 1.00 . A A . 15 GLN NE2 1 1 1 217 1 1 15 GLN O O -1.320 0.687 -6.239 1.00 . A A . 15 GLN O 1 1 1 218 1 1 15 GLN OE1 O 2.279 -0.278 -2.856 1.00 . A A . 15 GLN OE1 1 1 1 219 1 1 16 LEU C C -2.320 1.473 -4.045 1.00 . A A . 16 LEU C 1 1 1 220 1 1 16 LEU CA C -0.934 1.190 -3.466 1.00 . A A . 16 LEU CA 1 1 1 221 1 1 16 LEU CB C -0.530 2.331 -2.463 1.00 . A A . 16 LEU CB 1 1 1 222 1 1 16 LEU CD1 C 0.980 3.013 -0.582 1.00 . A A . 16 LEU CD1 1 1 1 223 1 1 16 LEU CD2 C 0.471 0.665 -0.825 1.00 . A A . 16 LEU CD2 1 1 1 224 1 1 16 LEU CG C 0.717 1.942 -1.635 1.00 . A A . 16 LEU CG 1 1 1 225 1 1 16 LEU H H 1.054 1.153 -4.456 1.00 . A A . 16 LEU H 1 1 1 226 1 1 16 LEU HA H -1.018 0.237 -2.967 1.00 . A A . 16 LEU HA 1 1 1 227 1 1 16 LEU HB2 H -0.353 3.241 -3.016 1.00 . A A . 16 LEU HB2 1 1 1 228 1 1 16 LEU HB3 H -1.355 2.520 -1.789 1.00 . A A . 16 LEU HB3 1 1 1 229 1 1 16 LEU HD11 H 1.161 3.988 -0.997 1.00 . A A . 16 LEU HD11 1 1 1 230 1 1 16 LEU HD12 H 0.135 3.087 0.089 1.00 . A A . 16 LEU HD12 1 1 1 231 1 1 16 LEU HD13 H 1.848 2.730 -0.004 1.00 . A A . 16 LEU HD13 1 1 1 232 1 1 16 LEU HD21 H 0.239 -0.179 -1.453 1.00 . A A . 16 LEU HD21 1 1 1 233 1 1 16 LEU HD22 H 1.370 0.415 -0.279 1.00 . A A . 16 LEU HD22 1 1 1 234 1 1 16 LEU HD23 H -0.324 0.803 -0.108 1.00 . A A . 16 LEU HD23 1 1 1 235 1 1 16 LEU HG H 1.581 1.816 -2.268 1.00 . A A . 16 LEU HG 1 1 1 236 1 1 16 LEU N N 0.101 1.066 -4.575 1.00 . A A . 16 LEU N 1 1 1 237 1 1 16 LEU O O -3.271 0.779 -3.742 1.00 . A A . 16 LEU O 1 1 1 238 1 1 17 GLU C C -4.449 1.697 -6.001 1.00 . A A . 17 GLU C 1 1 1 239 1 1 17 GLU CA C -3.624 2.912 -5.560 1.00 . A A . 17 GLU CA 1 1 1 240 1 1 17 GLU CB C -3.185 3.768 -6.746 1.00 . A A . 17 GLU CB 1 1 1 241 1 1 17 GLU CD C -4.526 5.799 -5.923 1.00 . A A . 17 GLU CD 1 1 1 242 1 1 17 GLU CG C -3.131 5.185 -6.204 1.00 . A A . 17 GLU CG 1 1 1 243 1 1 17 GLU H H -1.520 2.966 -5.067 1.00 . A A . 17 GLU H 1 1 1 244 1 1 17 GLU HA H -4.245 3.461 -4.884 1.00 . A A . 17 GLU HA 1 1 1 245 1 1 17 GLU HB2 H -2.198 3.483 -7.096 1.00 . A A . 17 GLU HB2 1 1 1 246 1 1 17 GLU HB3 H -3.873 3.719 -7.578 1.00 . A A . 17 GLU HB3 1 1 1 247 1 1 17 GLU HG2 H -2.560 5.133 -5.294 1.00 . A A . 17 GLU HG2 1 1 1 248 1 1 17 GLU HG3 H -2.607 5.766 -6.933 1.00 . A A . 17 GLU HG3 1 1 1 249 1 1 17 GLU N N -2.356 2.482 -4.870 1.00 . A A . 17 GLU N 1 1 1 250 1 1 17 GLU O O -5.512 1.371 -5.500 1.00 . A A . 17 GLU O 1 1 1 251 1 1 17 GLU OE1 O -5.493 5.279 -6.451 1.00 . A A . 17 GLU OE1 1 1 1 252 1 1 17 GLU OE2 O -4.639 6.769 -5.195 1.00 . A A . 17 GLU OE2 1 1 1 253 1 1 18 ASN C C -5.041 -1.197 -6.733 1.00 . A A . 18 ASN C 1 1 1 254 1 1 18 ASN CA C -4.292 -0.163 -7.655 1.00 . A A . 18 ASN CA 1 1 1 255 1 1 18 ASN CB C -2.938 -0.628 -8.347 1.00 . A A . 18 ASN CB 1 1 1 256 1 1 18 ASN CG C -3.006 -1.923 -9.121 1.00 . A A . 18 ASN CG 1 1 1 257 1 1 18 ASN H H -2.960 1.444 -7.187 1.00 . A A . 18 ASN H 1 1 1 258 1 1 18 ASN HA H -5.038 0.136 -8.371 1.00 . A A . 18 ASN HA 1 1 1 259 1 1 18 ASN HB2 H -2.582 0.136 -9.031 1.00 . A A . 18 ASN HB2 1 1 1 260 1 1 18 ASN HB3 H -2.142 -0.734 -7.633 1.00 . A A . 18 ASN HB3 1 1 1 261 1 1 18 ASN HD21 H -4.948 -2.254 -8.944 1.00 . A A . 18 ASN HD21 1 1 1 262 1 1 18 ASN HD22 H -4.037 -3.382 -9.838 1.00 . A A . 18 ASN HD22 1 1 1 263 1 1 18 ASN N N -3.831 1.066 -6.948 1.00 . A A . 18 ASN N 1 1 1 264 1 1 18 ASN ND2 N -4.098 -2.566 -9.311 1.00 . A A . 18 ASN ND2 1 1 1 265 1 1 18 ASN O O -5.789 -2.010 -7.239 1.00 . A A . 18 ASN O 1 1 1 266 1 1 18 ASN OD1 O -2.009 -2.411 -9.596 1.00 . A A . 18 ASN OD1 1 1 1 267 1 1 19 TYR C C -6.314 -1.301 -3.394 1.00 . A A . 19 TYR C 1 1 1 268 1 1 19 TYR CA C -5.512 -2.099 -4.459 1.00 . A A . 19 TYR CA 1 1 1 269 1 1 19 TYR CB C -4.373 -3.016 -3.787 1.00 . A A . 19 TYR CB 1 1 1 270 1 1 19 TYR CD1 C -3.209 -3.683 -5.928 1.00 . A A . 19 TYR CD1 1 1 1 271 1 1 19 TYR CD2 C -2.217 -2.089 -4.497 1.00 . A A . 19 TYR CD2 1 1 1 272 1 1 19 TYR CE1 C -2.161 -3.522 -6.805 1.00 . A A . 19 TYR CE1 1 1 1 273 1 1 19 TYR CE2 C -1.185 -1.943 -5.374 1.00 . A A . 19 TYR CE2 1 1 1 274 1 1 19 TYR CG C -3.229 -2.953 -4.768 1.00 . A A . 19 TYR CG 1 1 1 275 1 1 19 TYR CZ C -1.147 -2.655 -6.536 1.00 . A A . 19 TYR CZ 1 1 1 276 1 1 19 TYR H H -4.220 -0.457 -5.114 1.00 . A A . 19 TYR H 1 1 1 277 1 1 19 TYR HA H -6.224 -2.720 -4.985 1.00 . A A . 19 TYR HA 1 1 1 278 1 1 19 TYR HB2 H -4.025 -2.653 -2.827 1.00 . A A . 19 TYR HB2 1 1 1 279 1 1 19 TYR HB3 H -4.659 -4.053 -3.672 1.00 . A A . 19 TYR HB3 1 1 1 280 1 1 19 TYR HD1 H -4.011 -4.373 -6.148 1.00 . A A . 19 TYR HD1 1 1 1 281 1 1 19 TYR HD2 H -2.240 -1.515 -3.584 1.00 . A A . 19 TYR HD2 1 1 1 282 1 1 19 TYR HE1 H -2.127 -4.056 -7.731 1.00 . A A . 19 TYR HE1 1 1 1 283 1 1 19 TYR HE2 H -0.406 -1.251 -5.135 1.00 . A A . 19 TYR HE2 1 1 1 284 1 1 19 TYR HH H -0.537 -2.613 -8.312 1.00 . A A . 19 TYR HH 1 1 1 285 1 1 19 TYR N N -4.837 -1.145 -5.441 1.00 . A A . 19 TYR N 1 1 1 286 1 1 19 TYR O O -7.429 -1.636 -3.056 1.00 . A A . 19 TYR O 1 1 1 287 1 1 19 TYR OH O -0.126 -2.507 -7.442 1.00 . A A . 19 TYR OH 1 1 1 288 1 1 20 CYS C C -7.834 1.062 -2.292 1.00 . A A . 20 CYS C 1 1 1 289 1 1 20 CYS CA C -6.443 0.582 -1.841 1.00 . A A . 20 CYS CA 1 1 1 290 1 1 20 CYS CB C -5.494 1.741 -1.505 1.00 . A A . 20 CYS CB 1 1 1 291 1 1 20 CYS H H -4.845 0.000 -3.183 1.00 . A A . 20 CYS H 1 1 1 292 1 1 20 CYS HA H -6.606 0.033 -0.958 1.00 . A A . 20 CYS HA 1 1 1 293 1 1 20 CYS HB2 H -5.918 2.314 -0.696 1.00 . A A . 20 CYS HB2 1 1 1 294 1 1 20 CYS HB3 H -4.567 1.316 -1.149 1.00 . A A . 20 CYS HB3 1 1 1 295 1 1 20 CYS HG H -4.284 2.549 -3.272 1.00 . A A . 20 CYS HG 1 1 1 296 1 1 20 CYS N N -5.740 -0.249 -2.877 1.00 . A A . 20 CYS N 1 1 1 297 1 1 20 CYS O O -8.809 0.964 -1.580 1.00 . A A . 20 CYS O 1 1 1 298 1 1 20 CYS SG S -5.044 2.903 -2.805 1.00 . A A . 20 CYS SG 1 1 1 299 1 1 21 ASN C C -10.474 1.533 -3.632 1.00 . A A . 21 ASN C 1 1 1 300 1 1 21 ASN CA C -9.115 2.107 -4.126 1.00 . A A . 21 ASN CA 1 1 1 301 1 1 21 ASN CB C -8.955 1.898 -5.670 1.00 . A A . 21 ASN CB 1 1 1 302 1 1 21 ASN CG C -8.215 3.096 -6.227 1.00 . A A . 21 ASN CG 1 1 1 303 1 1 21 ASN H H -6.981 1.558 -3.902 1.00 . A A . 21 ASN H 1 1 1 304 1 1 21 ASN HA H -9.165 3.165 -3.925 1.00 . A A . 21 ASN HA 1 1 1 305 1 1 21 ASN HB2 H -8.381 1.012 -5.889 1.00 . A A . 21 ASN HB2 1 1 1 306 1 1 21 ASN HB3 H -9.910 1.848 -6.168 1.00 . A A . 21 ASN HB3 1 1 1 307 1 1 21 ASN HD21 H -6.634 2.111 -6.839 1.00 . A A . 21 ASN HD21 1 1 1 308 1 1 21 ASN HD22 H -6.610 3.802 -7.036 1.00 . A A . 21 ASN HD22 1 1 1 309 1 1 21 ASN N N -7.858 1.571 -3.476 1.00 . A A . 21 ASN N 1 1 1 310 1 1 21 ASN ND2 N -7.058 2.979 -6.745 1.00 . A A . 21 ASN ND2 1 1 1 311 1 1 21 ASN O O -11.478 2.219 -3.622 1.00 . A A . 21 ASN O 1 1 1 312 1 1 21 ASN OD1 O -8.687 4.205 -6.197 1.00 . A A . 21 ASN OD1 1 1 1 313 2 2 1 PHE C C 6.566 8.612 0.317 1.00 . B B . 1 PHE C 1 1 1 314 2 2 1 PHE CA C 5.610 9.800 0.629 1.00 . B B . 1 PHE CA 1 1 1 315 2 2 1 PHE CB C 4.270 9.304 1.232 1.00 . B B . 1 PHE CB 1 1 1 316 2 2 1 PHE CD1 C 3.975 11.075 3.009 1.00 . B B . 1 PHE CD1 1 1 1 317 2 2 1 PHE CD2 C 2.408 11.018 1.225 1.00 . B B . 1 PHE CD2 1 1 1 318 2 2 1 PHE CE1 C 3.316 12.154 3.558 1.00 . B B . 1 PHE CE1 1 1 1 319 2 2 1 PHE CE2 C 1.746 12.097 1.770 1.00 . B B . 1 PHE CE2 1 1 1 320 2 2 1 PHE CG C 3.527 10.498 1.839 1.00 . B B . 1 PHE CG 1 1 1 321 2 2 1 PHE CZ C 2.200 12.666 2.938 1.00 . B B . 1 PHE CZ 1 1 1 322 2 2 1 PHE HA H 6.121 10.431 1.341 1.00 . B B . 1 PHE HA 1 1 1 323 2 2 1 PHE HB2 H 3.658 8.871 0.453 1.00 . B B . 1 PHE HB2 1 1 1 324 2 2 1 PHE HB3 H 4.419 8.563 2.002 1.00 . B B . 1 PHE HB3 1 1 1 325 2 2 1 PHE HD1 H 4.848 10.680 3.505 1.00 . B B . 1 PHE HD1 1 1 1 326 2 2 1 PHE HD2 H 2.045 10.576 0.308 1.00 . B B . 1 PHE HD2 1 1 1 327 2 2 1 PHE HE1 H 3.673 12.601 4.477 1.00 . B B . 1 PHE HE1 1 1 1 328 2 2 1 PHE HE2 H 0.868 12.500 1.283 1.00 . B B . 1 PHE HE2 1 1 1 329 2 2 1 PHE HZ H 1.682 13.512 3.367 1.00 . B B . 1 PHE HZ 1 1 1 330 2 2 1 PHE N N 5.244 10.655 -0.548 1.00 . B B . 1 PHE N 1 1 1 331 2 2 1 PHE O O 6.817 8.275 -0.816 1.00 . B B . 1 PHE O 1 1 1 332 2 2 2 VAL C C 7.832 5.635 0.490 1.00 . B B . 2 VAL C 1 1 1 333 2 2 2 VAL CA C 8.031 6.854 1.432 1.00 . B B . 2 VAL CA 1 1 1 334 2 2 2 VAL CB C 8.026 6.487 2.917 1.00 . B B . 2 VAL CB 1 1 1 335 2 2 2 VAL CG1 C 6.612 6.118 3.407 1.00 . B B . 2 VAL CG1 1 1 1 336 2 2 2 VAL CG2 C 8.951 5.345 3.305 1.00 . B B . 2 VAL CG2 1 1 1 337 2 2 2 VAL H H 6.790 8.410 2.222 1.00 . B B . 2 VAL H 1 1 1 338 2 2 2 VAL HA H 9.009 7.235 1.186 1.00 . B B . 2 VAL HA 1 1 1 339 2 2 2 VAL HB H 8.412 7.386 3.346 1.00 . B B . 2 VAL HB 1 1 1 340 2 2 2 VAL HG11 H 5.907 6.925 3.293 1.00 . B B . 2 VAL HG11 1 1 1 341 2 2 2 VAL HG12 H 6.239 5.256 2.868 1.00 . B B . 2 VAL HG12 1 1 1 342 2 2 2 VAL HG13 H 6.650 5.855 4.455 1.00 . B B . 2 VAL HG13 1 1 1 343 2 2 2 VAL HG21 H 9.976 5.525 3.018 1.00 . B B . 2 VAL HG21 1 1 1 344 2 2 2 VAL HG22 H 8.923 5.196 4.377 1.00 . B B . 2 VAL HG22 1 1 1 345 2 2 2 VAL HG23 H 8.602 4.434 2.861 1.00 . B B . 2 VAL HG23 1 1 1 346 2 2 2 VAL N N 7.071 8.034 1.375 1.00 . B B . 2 VAL N 1 1 1 347 2 2 2 VAL O O 7.636 4.483 0.817 1.00 . B B . 2 VAL O 1 1 1 348 2 2 3 ASN C C 8.797 3.991 -2.181 1.00 . B B . 3 ASN C 1 1 1 349 2 2 3 ASN CA C 7.826 5.207 -1.981 1.00 . B B . 3 ASN CA 1 1 1 350 2 2 3 ASN CB C 7.960 6.264 -3.100 1.00 . B B . 3 ASN CB 1 1 1 351 2 2 3 ASN CG C 9.164 7.127 -2.785 1.00 . B B . 3 ASN CG 1 1 1 352 2 2 3 ASN H H 8.124 6.991 -0.758 1.00 . B B . 3 ASN H 1 1 1 353 2 2 3 ASN HA H 6.827 4.801 -2.016 1.00 . B B . 3 ASN HA 1 1 1 354 2 2 3 ASN HB2 H 8.139 5.803 -4.056 1.00 . B B . 3 ASN HB2 1 1 1 355 2 2 3 ASN HB3 H 7.087 6.894 -3.157 1.00 . B B . 3 ASN HB3 1 1 1 356 2 2 3 ASN HD21 H 8.093 8.655 -2.172 1.00 . B B . 3 ASN HD21 1 1 1 357 2 2 3 ASN HD22 H 9.795 8.839 -2.153 1.00 . B B . 3 ASN HD22 1 1 1 358 2 2 3 ASN N N 7.943 6.031 -0.721 1.00 . B B . 3 ASN N 1 1 1 359 2 2 3 ASN ND2 N 8.995 8.313 -2.328 1.00 . B B . 3 ASN ND2 1 1 1 360 2 2 3 ASN O O 9.020 3.554 -3.294 1.00 . B B . 3 ASN O 1 1 1 361 2 2 3 ASN OD1 O 10.299 6.750 -2.927 1.00 . B B . 3 ASN OD1 1 1 1 362 2 2 4 GLN C C 9.763 1.042 -0.262 1.00 . B B . 4 GLN C 1 1 1 363 2 2 4 GLN CA C 10.267 2.321 -1.053 1.00 . B B . 4 GLN CA 1 1 1 364 2 2 4 GLN CB C 11.589 2.969 -0.491 1.00 . B B . 4 GLN CB 1 1 1 365 2 2 4 GLN CD C 10.783 2.796 1.883 1.00 . B B . 4 GLN CD 1 1 1 366 2 2 4 GLN CG C 11.303 3.751 0.845 1.00 . B B . 4 GLN CG 1 1 1 367 2 2 4 GLN H H 9.034 3.895 -0.255 1.00 . B B . 4 GLN H 1 1 1 368 2 2 4 GLN HA H 10.463 2.010 -2.058 1.00 . B B . 4 GLN HA 1 1 1 369 2 2 4 GLN HB2 H 12.353 2.216 -0.339 1.00 . B B . 4 GLN HB2 1 1 1 370 2 2 4 GLN HB3 H 11.963 3.666 -1.232 1.00 . B B . 4 GLN HB3 1 1 1 371 2 2 4 GLN HE21 H 8.848 3.099 1.527 1.00 . B B . 4 GLN HE21 1 1 1 372 2 2 4 GLN HE22 H 9.270 1.969 2.727 1.00 . B B . 4 GLN HE22 1 1 1 373 2 2 4 GLN HG2 H 12.219 4.170 1.234 1.00 . B B . 4 GLN HG2 1 1 1 374 2 2 4 GLN HG3 H 10.589 4.547 0.721 1.00 . B B . 4 GLN HG3 1 1 1 375 2 2 4 GLN N N 9.307 3.483 -1.092 1.00 . B B . 4 GLN N 1 1 1 376 2 2 4 GLN NE2 N 9.524 2.620 2.044 1.00 . B B . 4 GLN NE2 1 1 1 377 2 2 4 GLN O O 8.645 0.622 -0.466 1.00 . B B . 4 GLN O 1 1 1 378 2 2 4 GLN OE1 O 11.528 2.154 2.576 1.00 . B B . 4 GLN OE1 1 1 1 379 2 2 5 HIS C C 9.237 -0.533 2.634 1.00 . B B . 5 HIS C 1 1 1 380 2 2 5 HIS CA C 10.181 -0.757 1.410 1.00 . B B . 5 HIS CA 1 1 1 381 2 2 5 HIS CB C 11.493 -1.434 1.918 1.00 . B B . 5 HIS CB 1 1 1 382 2 2 5 HIS CD2 C 13.425 -2.088 0.254 1.00 . B B . 5 HIS CD2 1 1 1 383 2 2 5 HIS CE1 C 12.453 -3.645 -0.696 1.00 . B B . 5 HIS CE1 1 1 1 384 2 2 5 HIS CG C 12.178 -2.208 0.818 1.00 . B B . 5 HIS CG 1 1 1 385 2 2 5 HIS H H 11.444 0.851 0.745 1.00 . B B . 5 HIS H 1 1 1 386 2 2 5 HIS HA H 9.663 -1.446 0.754 1.00 . B B . 5 HIS HA 1 1 1 387 2 2 5 HIS HB2 H 12.173 -0.683 2.292 1.00 . B B . 5 HIS HB2 1 1 1 388 2 2 5 HIS HB3 H 11.278 -2.124 2.722 1.00 . B B . 5 HIS HB3 1 1 1 389 2 2 5 HIS HD1 H 10.721 -3.512 0.406 1.00 . B B . 5 HIS HD1 1 1 1 390 2 2 5 HIS HD2 H 14.164 -1.361 0.546 1.00 . B B . 5 HIS HD2 1 1 1 391 2 2 5 HIS HE1 H 12.242 -4.457 -1.372 1.00 . B B . 5 HIS HE1 1 1 1 392 2 2 5 HIS N N 10.560 0.468 0.604 1.00 . B B . 5 HIS N 1 1 1 393 2 2 5 HIS ND1 N 11.629 -3.184 0.194 1.00 . B B . 5 HIS ND1 1 1 1 394 2 2 5 HIS NE2 N 13.586 -2.991 -0.691 1.00 . B B . 5 HIS NE2 1 1 1 395 2 2 5 HIS O O 9.656 -0.504 3.777 1.00 . B B . 5 HIS O 1 1 1 396 2 2 6 LEU C C 6.170 -1.464 3.754 1.00 . B B . 6 LEU C 1 1 1 397 2 2 6 LEU CA C 7.009 -0.164 3.546 1.00 . B B . 6 LEU CA 1 1 1 398 2 2 6 LEU CB C 6.120 1.090 3.204 1.00 . B B . 6 LEU CB 1 1 1 399 2 2 6 LEU CD1 C 4.292 2.187 1.965 1.00 . B B . 6 LEU CD1 1 1 1 400 2 2 6 LEU CD2 C 5.536 0.386 0.865 1.00 . B B . 6 LEU CD2 1 1 1 401 2 2 6 LEU CG C 4.990 0.852 2.194 1.00 . B B . 6 LEU CG 1 1 1 402 2 2 6 LEU H H 7.687 -0.406 1.451 1.00 . B B . 6 LEU H 1 1 1 403 2 2 6 LEU HA H 7.558 0.024 4.456 1.00 . B B . 6 LEU HA 1 1 1 404 2 2 6 LEU HB2 H 5.666 1.460 4.111 1.00 . B B . 6 LEU HB2 1 1 1 405 2 2 6 LEU HB3 H 6.764 1.872 2.825 1.00 . B B . 6 LEU HB3 1 1 1 406 2 2 6 LEU HD11 H 3.894 2.561 2.898 1.00 . B B . 6 LEU HD11 1 1 1 407 2 2 6 LEU HD12 H 4.987 2.914 1.567 1.00 . B B . 6 LEU HD12 1 1 1 408 2 2 6 LEU HD13 H 3.481 2.060 1.266 1.00 . B B . 6 LEU HD13 1 1 1 409 2 2 6 LEU HD21 H 6.265 1.088 0.494 1.00 . B B . 6 LEU HD21 1 1 1 410 2 2 6 LEU HD22 H 5.998 -0.584 0.955 1.00 . B B . 6 LEU HD22 1 1 1 411 2 2 6 LEU HD23 H 4.742 0.287 0.140 1.00 . B B . 6 LEU HD23 1 1 1 412 2 2 6 LEU HG H 4.291 0.122 2.583 1.00 . B B . 6 LEU HG 1 1 1 413 2 2 6 LEU N N 7.970 -0.376 2.391 1.00 . B B . 6 LEU N 1 1 1 414 2 2 6 LEU O O 5.565 -1.980 2.839 1.00 . B B . 6 LEU O 1 1 1 415 2 2 7 CYS C C 4.107 -3.214 6.131 1.00 . B B . 7 CYS C 1 1 1 416 2 2 7 CYS CA C 5.335 -3.261 5.175 1.00 . B B . 7 CYS CA 1 1 1 417 2 2 7 CYS CB C 6.377 -4.304 5.634 1.00 . B B . 7 CYS CB 1 1 1 418 2 2 7 CYS H H 6.613 -1.562 5.681 1.00 . B B . 7 CYS H 1 1 1 419 2 2 7 CYS HA H 4.945 -3.608 4.229 1.00 . B B . 7 CYS HA 1 1 1 420 2 2 7 CYS HB2 H 7.320 -4.086 5.148 1.00 . B B . 7 CYS HB2 1 1 1 421 2 2 7 CYS HB3 H 6.536 -4.215 6.700 1.00 . B B . 7 CYS HB3 1 1 1 422 2 2 7 CYS HG H 5.563 -6.426 6.029 1.00 . B B . 7 CYS HG 1 1 1 423 2 2 7 CYS N N 6.129 -1.994 4.950 1.00 . B B . 7 CYS N 1 1 1 424 2 2 7 CYS O O 3.750 -2.191 6.662 1.00 . B B . 7 CYS O 1 1 1 425 2 2 7 CYS SG S 5.991 -6.035 5.264 1.00 . B B . 7 CYS SG 1 1 1 426 2 2 8 GLY C C 1.365 -3.468 7.686 1.00 . B B . 8 GLY C 1 1 1 427 2 2 8 GLY CA C 2.275 -4.585 7.178 1.00 . B B . 8 GLY CA 1 1 1 428 2 2 8 GLY H H 3.892 -5.111 5.812 1.00 . B B . 8 GLY H 1 1 1 429 2 2 8 GLY HA2 H 1.616 -5.265 6.679 1.00 . B B . 8 GLY HA2 1 1 1 430 2 2 8 GLY HA3 H 2.634 -5.027 8.094 1.00 . B B . 8 GLY HA3 1 1 1 431 2 2 8 GLY N N 3.503 -4.357 6.300 1.00 . B B . 8 GLY N 1 1 1 432 2 2 8 GLY O O 0.240 -3.332 7.235 1.00 . B B . 8 GLY O 1 1 1 433 2 2 9 ASP C C 1.464 -0.272 8.480 1.00 . B B . 9 ASP C 1 1 1 434 2 2 9 ASP CA C 1.228 -1.589 9.263 1.00 . B B . 9 ASP CA 1 1 1 435 2 2 9 ASP CB C 1.816 -1.583 10.716 1.00 . B B . 9 ASP CB 1 1 1 436 2 2 9 ASP CG C 3.344 -1.544 10.818 1.00 . B B . 9 ASP CG 1 1 1 437 2 2 9 ASP H H 2.817 -2.938 8.877 1.00 . B B . 9 ASP H 1 1 1 438 2 2 9 ASP HA H 0.162 -1.767 9.298 1.00 . B B . 9 ASP HA 1 1 1 439 2 2 9 ASP HB2 H 1.456 -0.716 11.245 1.00 . B B . 9 ASP HB2 1 1 1 440 2 2 9 ASP HB3 H 1.504 -2.460 11.254 1.00 . B B . 9 ASP HB3 1 1 1 441 2 2 9 ASP N N 1.900 -2.735 8.597 1.00 . B B . 9 ASP N 1 1 1 442 2 2 9 ASP O O 0.554 0.440 8.101 1.00 . B B . 9 ASP O 1 1 1 443 2 2 9 ASP OD1 O 4.021 -1.852 9.852 1.00 . B B . 9 ASP OD1 1 1 1 444 2 2 9 ASP OD2 O 3.741 -1.201 11.906 1.00 . B B . 9 ASP OD2 1 1 1 445 2 2 10 HIS C C 2.450 1.144 6.080 1.00 . B B . 10 HIS C 1 1 1 446 2 2 10 HIS CA C 3.108 1.229 7.481 1.00 . B B . 10 HIS CA 1 1 1 447 2 2 10 HIS CB C 4.640 1.181 7.509 1.00 . B B . 10 HIS CB 1 1 1 448 2 2 10 HIS CD2 C 6.416 2.637 6.226 1.00 . B B . 10 HIS CD2 1 1 1 449 2 2 10 HIS CE1 C 5.576 4.499 6.532 1.00 . B B . 10 HIS CE1 1 1 1 450 2 2 10 HIS CG C 5.264 2.454 6.961 1.00 . B B . 10 HIS CG 1 1 1 451 2 2 10 HIS H H 3.338 -0.692 8.550 1.00 . B B . 10 HIS H 1 1 1 452 2 2 10 HIS HA H 2.717 2.102 7.990 1.00 . B B . 10 HIS HA 1 1 1 453 2 2 10 HIS HB2 H 4.948 1.066 8.539 1.00 . B B . 10 HIS HB2 1 1 1 454 2 2 10 HIS HB3 H 4.986 0.330 6.945 1.00 . B B . 10 HIS HB3 1 1 1 455 2 2 10 HIS HD1 H 3.958 3.885 7.600 1.00 . B B . 10 HIS HD1 1 1 1 456 2 2 10 HIS HD2 H 7.079 1.849 5.912 1.00 . B B . 10 HIS HD2 1 1 1 457 2 2 10 HIS HE1 H 5.398 5.567 6.520 1.00 . B B . 10 HIS HE1 1 1 1 458 2 2 10 HIS N N 2.702 -0.012 8.229 1.00 . B B . 10 HIS N 1 1 1 459 2 2 10 HIS ND1 N 4.796 3.643 7.113 1.00 . B B . 10 HIS ND1 1 1 1 460 2 2 10 HIS NE2 N 6.599 3.914 5.965 1.00 . B B . 10 HIS NE2 1 1 1 461 2 2 10 HIS O O 1.971 2.076 5.468 1.00 . B B . 10 HIS O 1 1 1 462 2 2 11 LEU C C 0.337 -0.108 4.340 1.00 . B B . 11 LEU C 1 1 1 463 2 2 11 LEU CA C 1.854 -0.388 4.268 1.00 . B B . 11 LEU CA 1 1 1 464 2 2 11 LEU CB C 2.188 -1.858 4.000 1.00 . B B . 11 LEU CB 1 1 1 465 2 2 11 LEU CD1 C 2.341 -1.516 1.520 1.00 . B B . 11 LEU CD1 1 1 1 466 2 2 11 LEU CD2 C 2.068 -3.758 2.481 1.00 . B B . 11 LEU CD2 1 1 1 467 2 2 11 LEU CG C 1.657 -2.309 2.643 1.00 . B B . 11 LEU CG 1 1 1 468 2 2 11 LEU H H 2.854 -0.742 6.162 1.00 . B B . 11 LEU H 1 1 1 469 2 2 11 LEU HA H 2.266 0.262 3.511 1.00 . B B . 11 LEU HA 1 1 1 470 2 2 11 LEU HB2 H 3.264 -1.953 3.999 1.00 . B B . 11 LEU HB2 1 1 1 471 2 2 11 LEU HB3 H 1.784 -2.476 4.788 1.00 . B B . 11 LEU HB3 1 1 1 472 2 2 11 LEU HD11 H 3.413 -1.655 1.547 1.00 . B B . 11 LEU HD11 1 1 1 473 2 2 11 LEU HD12 H 1.986 -1.836 0.553 1.00 . B B . 11 LEU HD12 1 1 1 474 2 2 11 LEU HD13 H 2.139 -0.459 1.608 1.00 . B B . 11 LEU HD13 1 1 1 475 2 2 11 LEU HD21 H 3.143 -3.839 2.528 1.00 . B B . 11 LEU HD21 1 1 1 476 2 2 11 LEU HD22 H 1.629 -4.370 3.254 1.00 . B B . 11 LEU HD22 1 1 1 477 2 2 11 LEU HD23 H 1.745 -4.114 1.519 1.00 . B B . 11 LEU HD23 1 1 1 478 2 2 11 LEU HG H 0.580 -2.192 2.593 1.00 . B B . 11 LEU HG 1 1 1 479 2 2 11 LEU N N 2.445 -0.060 5.598 1.00 . B B . 11 LEU N 1 1 1 480 2 2 11 LEU O O -0.186 0.592 3.500 1.00 . B B . 11 LEU O 1 1 1 481 2 2 12 VAL C C -2.037 1.227 5.476 1.00 . B B . 12 VAL C 1 1 1 482 2 2 12 VAL CA C -1.856 -0.297 5.321 1.00 . B B . 12 VAL CA 1 1 1 483 2 2 12 VAL CB C -2.562 -1.021 6.483 1.00 . B B . 12 VAL CB 1 1 1 484 2 2 12 VAL CG1 C -1.951 -0.735 7.831 1.00 . B B . 12 VAL CG1 1 1 1 485 2 2 12 VAL CG2 C -3.992 -0.515 6.521 1.00 . B B . 12 VAL CG2 1 1 1 486 2 2 12 VAL H H 0.035 -1.208 5.982 1.00 . B B . 12 VAL H 1 1 1 487 2 2 12 VAL HA H -2.295 -0.572 4.376 1.00 . B B . 12 VAL HA 1 1 1 488 2 2 12 VAL HB H -2.508 -2.078 6.299 1.00 . B B . 12 VAL HB 1 1 1 489 2 2 12 VAL HG11 H -1.952 0.315 8.087 1.00 . B B . 12 VAL HG11 1 1 1 490 2 2 12 VAL HG12 H -2.457 -1.272 8.614 1.00 . B B . 12 VAL HG12 1 1 1 491 2 2 12 VAL HG13 H -0.937 -1.085 7.785 1.00 . B B . 12 VAL HG13 1 1 1 492 2 2 12 VAL HG21 H -4.450 -0.716 5.563 1.00 . B B . 12 VAL HG21 1 1 1 493 2 2 12 VAL HG22 H -4.546 -1.004 7.302 1.00 . B B . 12 VAL HG22 1 1 1 494 2 2 12 VAL HG23 H -4.029 0.553 6.695 1.00 . B B . 12 VAL HG23 1 1 1 495 2 2 12 VAL N N -0.380 -0.628 5.306 1.00 . B B . 12 VAL N 1 1 1 496 2 2 12 VAL O O -2.774 1.848 4.733 1.00 . B B . 12 VAL O 1 1 1 497 2 2 13 GLU C C -1.295 3.949 5.408 1.00 . B B . 13 GLU C 1 1 1 498 2 2 13 GLU CA C -1.378 3.230 6.766 1.00 . B B . 13 GLU CA 1 1 1 499 2 2 13 GLU CB C -0.171 3.365 7.690 1.00 . B B . 13 GLU CB 1 1 1 500 2 2 13 GLU CD C 1.366 4.972 8.866 1.00 . B B . 13 GLU CD 1 1 1 501 2 2 13 GLU CG C 0.103 4.824 8.023 1.00 . B B . 13 GLU CG 1 1 1 502 2 2 13 GLU H H -0.793 1.260 7.030 1.00 . B B . 13 GLU H 1 1 1 503 2 2 13 GLU HA H -2.299 3.511 7.253 1.00 . B B . 13 GLU HA 1 1 1 504 2 2 13 GLU HB2 H -0.331 2.814 8.609 1.00 . B B . 13 GLU HB2 1 1 1 505 2 2 13 GLU HB3 H 0.708 2.952 7.218 1.00 . B B . 13 GLU HB3 1 1 1 506 2 2 13 GLU HG2 H 0.259 5.378 7.116 1.00 . B B . 13 GLU HG2 1 1 1 507 2 2 13 GLU HG3 H -0.726 5.226 8.578 1.00 . B B . 13 GLU HG3 1 1 1 508 2 2 13 GLU N N -1.366 1.783 6.446 1.00 . B B . 13 GLU N 1 1 1 509 2 2 13 GLU O O -2.043 4.849 5.072 1.00 . B B . 13 GLU O 1 1 1 510 2 2 13 GLU OE1 O 2.397 4.572 8.353 1.00 . B B . 13 GLU OE1 1 1 1 511 2 2 13 GLU OE2 O 1.220 5.472 9.962 1.00 . B B . 13 GLU OE2 1 1 1 512 2 2 14 ALA C C -1.361 3.764 2.392 1.00 . B B . 14 ALA C 1 1 1 513 2 2 14 ALA CA C -0.133 4.031 3.294 1.00 . B B . 14 ALA CA 1 1 1 514 2 2 14 ALA CB C 1.184 3.377 2.797 1.00 . B B . 14 ALA CB 1 1 1 515 2 2 14 ALA H H 0.201 2.735 4.947 1.00 . B B . 14 ALA H 1 1 1 516 2 2 14 ALA HA H -0.075 5.082 3.453 1.00 . B B . 14 ALA HA 1 1 1 517 2 2 14 ALA HB1 H 1.973 3.592 3.505 1.00 . B B . 14 ALA HB1 1 1 1 518 2 2 14 ALA HB2 H 1.089 2.303 2.727 1.00 . B B . 14 ALA HB2 1 1 1 519 2 2 14 ALA HB3 H 1.472 3.762 1.834 1.00 . B B . 14 ALA HB3 1 1 1 520 2 2 14 ALA N N -0.359 3.471 4.634 1.00 . B B . 14 ALA N 1 1 1 521 2 2 14 ALA O O -1.907 4.686 1.822 1.00 . B B . 14 ALA O 1 1 1 522 2 2 15 LEU C C -4.102 3.226 1.677 1.00 . B B . 15 LEU C 1 1 1 523 2 2 15 LEU CA C -2.981 2.207 1.407 1.00 . B B . 15 LEU CA 1 1 1 524 2 2 15 LEU CB C -3.529 0.807 1.730 1.00 . B B . 15 LEU CB 1 1 1 525 2 2 15 LEU CD1 C -3.169 -1.581 1.783 1.00 . B B . 15 LEU CD1 1 1 1 526 2 2 15 LEU CD2 C -2.659 -0.385 -0.268 1.00 . B B . 15 LEU CD2 1 1 1 527 2 2 15 LEU CG C -2.588 -0.286 1.261 1.00 . B B . 15 LEU CG 1 1 1 528 2 2 15 LEU H H -1.262 1.849 2.757 1.00 . B B . 15 LEU H 1 1 1 529 2 2 15 LEU HA H -2.713 2.310 0.367 1.00 . B B . 15 LEU HA 1 1 1 530 2 2 15 LEU HB2 H -3.672 0.736 2.799 1.00 . B B . 15 LEU HB2 1 1 1 531 2 2 15 LEU HB3 H -4.496 0.688 1.258 1.00 . B B . 15 LEU HB3 1 1 1 532 2 2 15 LEU HD11 H -3.247 -1.549 2.858 1.00 . B B . 15 LEU HD11 1 1 1 533 2 2 15 LEU HD12 H -4.153 -1.756 1.375 1.00 . B B . 15 LEU HD12 1 1 1 534 2 2 15 LEU HD13 H -2.525 -2.400 1.518 1.00 . B B . 15 LEU HD13 1 1 1 535 2 2 15 LEU HD21 H -2.384 0.546 -0.739 1.00 . B B . 15 LEU HD21 1 1 1 536 2 2 15 LEU HD22 H -1.972 -1.143 -0.602 1.00 . B B . 15 LEU HD22 1 1 1 537 2 2 15 LEU HD23 H -3.653 -0.651 -0.598 1.00 . B B . 15 LEU HD23 1 1 1 538 2 2 15 LEU HG H -1.574 -0.129 1.617 1.00 . B B . 15 LEU HG 1 1 1 539 2 2 15 LEU N N -1.773 2.531 2.267 1.00 . B B . 15 LEU N 1 1 1 540 2 2 15 LEU O O -4.752 3.721 0.779 1.00 . B B . 15 LEU O 1 1 1 541 2 2 16 TYR C C -4.884 5.871 2.914 1.00 . B B . 16 TYR C 1 1 1 542 2 2 16 TYR CA C -5.318 4.457 3.386 1.00 . B B . 16 TYR CA 1 1 1 543 2 2 16 TYR CB C -5.422 4.334 4.929 1.00 . B B . 16 TYR CB 1 1 1 544 2 2 16 TYR CD1 C -6.947 6.297 5.323 1.00 . B B . 16 TYR CD1 1 1 1 545 2 2 16 TYR CD2 C -7.869 4.105 5.396 1.00 . B B . 16 TYR CD2 1 1 1 546 2 2 16 TYR CE1 C -8.206 6.825 5.552 1.00 . B B . 16 TYR CE1 1 1 1 547 2 2 16 TYR CE2 C -9.121 4.642 5.622 1.00 . B B . 16 TYR CE2 1 1 1 548 2 2 16 TYR CG C -6.781 4.934 5.242 1.00 . B B . 16 TYR CG 1 1 1 549 2 2 16 TYR CZ C -9.289 5.997 5.697 1.00 . B B . 16 TYR CZ 1 1 1 550 2 2 16 TYR H H -3.704 3.016 3.585 1.00 . B B . 16 TYR H 1 1 1 551 2 2 16 TYR HA H -6.257 4.230 2.898 1.00 . B B . 16 TYR HA 1 1 1 552 2 2 16 TYR HB2 H -5.391 3.304 5.252 1.00 . B B . 16 TYR HB2 1 1 1 553 2 2 16 TYR HB3 H -4.646 4.892 5.436 1.00 . B B . 16 TYR HB3 1 1 1 554 2 2 16 TYR HD1 H -6.082 6.939 5.211 1.00 . B B . 16 TYR HD1 1 1 1 555 2 2 16 TYR HD2 H -7.733 3.031 5.343 1.00 . B B . 16 TYR HD2 1 1 1 556 2 2 16 TYR HE1 H -8.362 7.891 5.620 1.00 . B B . 16 TYR HE1 1 1 1 557 2 2 16 TYR HE2 H -9.985 4.006 5.744 1.00 . B B . 16 TYR HE2 1 1 1 558 2 2 16 TYR HH H -10.893 6.541 4.986 1.00 . B B . 16 TYR HH 1 1 1 559 2 2 16 TYR N N -4.279 3.487 2.942 1.00 . B B . 16 TYR N 1 1 1 560 2 2 16 TYR O O -5.631 6.532 2.226 1.00 . B B . 16 TYR O 1 1 1 561 2 2 16 TYR OH O -10.541 6.522 5.888 1.00 . B B . 16 TYR OH 1 1 1 562 2 2 17 LEU C C -3.505 7.903 1.382 1.00 . B B . 17 LEU C 1 1 1 563 2 2 17 LEU CA C -3.169 7.654 2.886 1.00 . B B . 17 LEU CA 1 1 1 564 2 2 17 LEU CB C -1.633 7.595 3.192 1.00 . B B . 17 LEU CB 1 1 1 565 2 2 17 LEU CD1 C 0.468 8.843 3.656 1.00 . B B . 17 LEU CD1 1 1 1 566 2 2 17 LEU CD2 C -0.670 9.260 1.541 1.00 . B B . 17 LEU CD2 1 1 1 567 2 2 17 LEU CG C -0.921 8.959 3.021 1.00 . B B . 17 LEU CG 1 1 1 568 2 2 17 LEU H H -3.165 5.723 3.867 1.00 . B B . 17 LEU H 1 1 1 569 2 2 17 LEU HA H -3.653 8.432 3.457 1.00 . B B . 17 LEU HA 1 1 1 570 2 2 17 LEU HB2 H -1.495 7.240 4.205 1.00 . B B . 17 LEU HB2 1 1 1 571 2 2 17 LEU HB3 H -1.178 6.871 2.534 1.00 . B B . 17 LEU HB3 1 1 1 572 2 2 17 LEU HD11 H 1.047 8.068 3.175 1.00 . B B . 17 LEU HD11 1 1 1 573 2 2 17 LEU HD12 H 0.999 9.780 3.559 1.00 . B B . 17 LEU HD12 1 1 1 574 2 2 17 LEU HD13 H 0.384 8.605 4.707 1.00 . B B . 17 LEU HD13 1 1 1 575 2 2 17 LEU HD21 H -0.064 8.491 1.088 1.00 . B B . 17 LEU HD21 1 1 1 576 2 2 17 LEU HD22 H -1.591 9.345 0.988 1.00 . B B . 17 LEU HD22 1 1 1 577 2 2 17 LEU HD23 H -0.155 10.204 1.454 1.00 . B B . 17 LEU HD23 1 1 1 578 2 2 17 LEU HG H -1.491 9.758 3.482 1.00 . B B . 17 LEU HG 1 1 1 579 2 2 17 LEU N N -3.710 6.302 3.295 1.00 . B B . 17 LEU N 1 1 1 580 2 2 17 LEU O O -3.915 8.970 0.974 1.00 . B B . 17 LEU O 1 1 1 581 2 2 18 VAL C C -5.048 6.752 -1.251 1.00 . B B . 18 VAL C 1 1 1 582 2 2 18 VAL CA C -3.542 6.825 -0.848 1.00 . B B . 18 VAL CA 1 1 1 583 2 2 18 VAL CB C -2.735 5.611 -1.363 1.00 . B B . 18 VAL CB 1 1 1 584 2 2 18 VAL CG1 C -2.908 5.472 -2.863 1.00 . B B . 18 VAL CG1 1 1 1 585 2 2 18 VAL CG2 C -1.241 5.859 -1.116 1.00 . B B . 18 VAL CG2 1 1 1 586 2 2 18 VAL H H -2.941 6.064 1.078 1.00 . B B . 18 VAL H 1 1 1 587 2 2 18 VAL HA H -3.156 7.731 -1.292 1.00 . B B . 18 VAL HA 1 1 1 588 2 2 18 VAL HB H -3.060 4.712 -0.852 1.00 . B B . 18 VAL HB 1 1 1 589 2 2 18 VAL HG11 H -2.569 6.362 -3.377 1.00 . B B . 18 VAL HG11 1 1 1 590 2 2 18 VAL HG12 H -2.347 4.630 -3.236 1.00 . B B . 18 VAL HG12 1 1 1 591 2 2 18 VAL HG13 H -3.945 5.329 -3.126 1.00 . B B . 18 VAL HG13 1 1 1 592 2 2 18 VAL HG21 H -0.926 6.754 -1.633 1.00 . B B . 18 VAL HG21 1 1 1 593 2 2 18 VAL HG22 H -1.053 5.985 -0.059 1.00 . B B . 18 VAL HG22 1 1 1 594 2 2 18 VAL HG23 H -0.669 5.024 -1.477 1.00 . B B . 18 VAL HG23 1 1 1 595 2 2 18 VAL N N -3.295 6.859 0.631 1.00 . B B . 18 VAL N 1 1 1 596 2 2 18 VAL O O -5.524 7.690 -1.857 1.00 . B B . 18 VAL O 1 1 1 597 2 2 19 CYS C C -8.202 5.483 -0.132 1.00 . B B . 19 CYS C 1 1 1 598 2 2 19 CYS CA C -7.232 5.665 -1.343 1.00 . B B . 19 CYS CA 1 1 1 599 2 2 19 CYS CB C -7.417 4.523 -2.349 1.00 . B B . 19 CYS CB 1 1 1 600 2 2 19 CYS H H -5.379 4.942 -0.456 1.00 . B B . 19 CYS H 1 1 1 601 2 2 19 CYS HA H -7.485 6.591 -1.824 1.00 . B B . 19 CYS HA 1 1 1 602 2 2 19 CYS HB2 H -7.556 3.596 -1.821 1.00 . B B . 19 CYS HB2 1 1 1 603 2 2 19 CYS HB3 H -8.329 4.743 -2.877 1.00 . B B . 19 CYS HB3 1 1 1 604 2 2 19 CYS HG H -6.378 4.861 -4.386 1.00 . B B . 19 CYS HG 1 1 1 605 2 2 19 CYS N N -5.775 5.698 -0.941 1.00 . B B . 19 CYS N 1 1 1 606 2 2 19 CYS O O -9.212 4.801 -0.206 1.00 . B B . 19 CYS O 1 1 1 607 2 2 19 CYS SG S -6.172 4.295 -3.638 1.00 . B B . 19 CYS SG 1 1 1 608 2 2 20 GLY C C -10.012 6.726 2.225 1.00 . B B . 20 GLY C 1 1 1 609 2 2 20 GLY CA C -8.608 6.114 2.263 1.00 . B B . 20 GLY CA 1 1 1 610 2 2 20 GLY H H -7.009 6.644 0.882 1.00 . B B . 20 GLY H 1 1 1 611 2 2 20 GLY HA2 H -8.701 5.099 2.617 1.00 . B B . 20 GLY HA2 1 1 1 612 2 2 20 GLY HA3 H -8.039 6.680 2.981 1.00 . B B . 20 GLY HA3 1 1 1 613 2 2 20 GLY N N -7.843 6.124 0.947 1.00 . B B . 20 GLY N 1 1 1 614 2 2 20 GLY O O -10.825 6.514 3.102 1.00 . B B . 20 GLY O 1 1 1 615 2 2 21 GLU C C -12.227 7.549 -0.327 1.00 . B B . 21 GLU C 1 1 1 616 2 2 21 GLU CA C -11.474 8.217 0.861 1.00 . B B . 21 GLU CA 1 1 1 617 2 2 21 GLU CB C -11.083 9.696 0.520 1.00 . B B . 21 GLU CB 1 1 1 618 2 2 21 GLU CD C -9.317 9.071 -1.376 1.00 . B B . 21 GLU CD 1 1 1 619 2 2 21 GLU CG C -9.624 9.872 -0.124 1.00 . B B . 21 GLU CG 1 1 1 620 2 2 21 GLU H H -9.451 7.577 0.588 1.00 . B B . 21 GLU H 1 1 1 621 2 2 21 GLU HA H -12.144 8.192 1.708 1.00 . B B . 21 GLU HA 1 1 1 622 2 2 21 GLU HB2 H -11.815 10.090 -0.175 1.00 . B B . 21 GLU HB2 1 1 1 623 2 2 21 GLU HB3 H -11.141 10.280 1.427 1.00 . B B . 21 GLU HB3 1 1 1 624 2 2 21 GLU HG2 H -9.484 10.907 -0.393 1.00 . B B . 21 GLU HG2 1 1 1 625 2 2 21 GLU HG3 H -8.864 9.621 0.597 1.00 . B B . 21 GLU HG3 1 1 1 626 2 2 21 GLU N N -10.209 7.479 1.197 1.00 . B B . 21 GLU N 1 1 1 627 2 2 21 GLU O O -13.352 7.879 -0.648 1.00 . B B . 21 GLU O 1 1 1 628 2 2 21 GLU OE1 O -9.249 7.874 -1.256 1.00 . B B . 21 GLU OE1 1 1 1 629 2 2 21 GLU OE2 O -9.142 9.625 -2.436 1.00 . B B . 21 GLU OE2 1 1 1 630 2 2 22 ARG C C -12.854 4.569 -1.727 1.00 . B B . 22 ARG C 1 1 1 631 2 2 22 ARG CA C -12.019 5.817 -2.083 1.00 . B B . 22 ARG CA 1 1 1 632 2 2 22 ARG CB C -10.757 5.408 -2.866 1.00 . B B . 22 ARG CB 1 1 1 633 2 2 22 ARG CD C -10.326 6.914 -4.902 1.00 . B B . 22 ARG CD 1 1 1 634 2 2 22 ARG CG C -10.874 5.555 -4.398 1.00 . B B . 22 ARG CG 1 1 1 635 2 2 22 ARG CZ C -7.938 7.276 -4.316 1.00 . B B . 22 ARG CZ 1 1 1 636 2 2 22 ARG H H -10.661 6.449 -0.591 1.00 . B B . 22 ARG H 1 1 1 637 2 2 22 ARG HA H -12.623 6.462 -2.644 1.00 . B B . 22 ARG HA 1 1 1 638 2 2 22 ARG HB2 H -9.932 5.978 -2.480 1.00 . B B . 22 ARG HB2 1 1 1 639 2 2 22 ARG HB3 H -10.529 4.374 -2.661 1.00 . B B . 22 ARG HB3 1 1 1 640 2 2 22 ARG HD2 H -10.009 6.831 -5.936 1.00 . B B . 22 ARG HD2 1 1 1 641 2 2 22 ARG HD3 H -11.109 7.659 -4.825 1.00 . B B . 22 ARG HD3 1 1 1 642 2 2 22 ARG HE H -9.334 7.735 -3.140 1.00 . B B . 22 ARG HE 1 1 1 643 2 2 22 ARG HG2 H -10.364 4.740 -4.880 1.00 . B B . 22 ARG HG2 1 1 1 644 2 2 22 ARG HG3 H -11.917 5.476 -4.676 1.00 . B B . 22 ARG HG3 1 1 1 645 2 2 22 ARG HH11 H -8.110 5.816 -5.593 1.00 . B B . 22 ARG HH11 1 1 1 646 2 2 22 ARG HH12 H -6.531 6.440 -5.353 1.00 . B B . 22 ARG HH12 1 1 1 647 2 2 22 ARG HH21 H -7.549 8.723 -3.098 1.00 . B B . 22 ARG HH21 1 1 1 648 2 2 22 ARG HH22 H -6.188 7.970 -3.904 1.00 . B B . 22 ARG HH22 1 1 1 649 2 2 22 ARG N N -11.550 6.615 -0.925 1.00 . B B . 22 ARG N 1 1 1 650 2 2 22 ARG NE N -9.170 7.343 -4.034 1.00 . B B . 22 ARG NE 1 1 1 651 2 2 22 ARG NH1 N -7.508 6.455 -5.143 1.00 . B B . 22 ARG NH1 1 1 1 652 2 2 22 ARG NH2 N -7.167 8.051 -3.730 1.00 . B B . 22 ARG NH2 1 1 1 653 2 2 22 ARG O O -14.020 4.420 -2.033 1.00 . B B . 22 ARG O 1 1 1 654 2 2 23 GLY C C -11.892 1.784 0.569 1.00 . B B . 23 GLY C 1 1 1 655 2 2 23 GLY CA C -12.688 2.379 -0.587 1.00 . B B . 23 GLY CA 1 1 1 656 2 2 23 GLY H H -11.230 4.020 -0.909 1.00 . B B . 23 GLY H 1 1 1 657 2 2 23 GLY HA2 H -13.702 2.519 -0.242 1.00 . B B . 23 GLY HA2 1 1 1 658 2 2 23 GLY HA3 H -12.696 1.671 -1.402 1.00 . B B . 23 GLY HA3 1 1 1 659 2 2 23 GLY N N -12.143 3.707 -1.068 1.00 . B B . 23 GLY N 1 1 1 660 2 2 23 GLY O O -12.389 1.716 1.670 1.00 . B B . 23 GLY O 1 1 1 661 2 2 24 PHE C C -9.630 -0.821 1.127 1.00 . B B . 24 PHE C 1 1 1 662 2 2 24 PHE CA C -9.653 0.745 1.168 1.00 . B B . 24 PHE CA 1 1 1 663 2 2 24 PHE CB C -9.918 1.265 2.627 1.00 . B B . 24 PHE CB 1 1 1 664 2 2 24 PHE CD1 C -7.539 1.160 3.550 1.00 . B B . 24 PHE CD1 1 1 1 665 2 2 24 PHE CD2 C -9.278 -0.004 4.675 1.00 . B B . 24 PHE CD2 1 1 1 666 2 2 24 PHE CE1 C -6.638 0.720 4.499 1.00 . B B . 24 PHE CE1 1 1 1 667 2 2 24 PHE CE2 C -8.390 -0.444 5.621 1.00 . B B . 24 PHE CE2 1 1 1 668 2 2 24 PHE CG C -8.867 0.798 3.636 1.00 . B B . 24 PHE CG 1 1 1 669 2 2 24 PHE CZ C -7.072 -0.082 5.534 1.00 . B B . 24 PHE CZ 1 1 1 670 2 2 24 PHE H H -10.437 1.493 -0.690 1.00 . B B . 24 PHE H 1 1 1 671 2 2 24 PHE HA H -8.678 1.071 0.823 1.00 . B B . 24 PHE HA 1 1 1 672 2 2 24 PHE HB2 H -9.967 2.343 2.647 1.00 . B B . 24 PHE HB2 1 1 1 673 2 2 24 PHE HB3 H -10.868 0.882 2.969 1.00 . B B . 24 PHE HB3 1 1 1 674 2 2 24 PHE HD1 H -7.205 1.790 2.739 1.00 . B B . 24 PHE HD1 1 1 1 675 2 2 24 PHE HD2 H -10.318 -0.293 4.742 1.00 . B B . 24 PHE HD2 1 1 1 676 2 2 24 PHE HE1 H -5.596 1.006 4.432 1.00 . B B . 24 PHE HE1 1 1 1 677 2 2 24 PHE HE2 H -8.734 -1.073 6.430 1.00 . B B . 24 PHE HE2 1 1 1 678 2 2 24 PHE HZ H -6.390 -0.431 6.290 1.00 . B B . 24 PHE HZ 1 1 1 679 2 2 24 PHE N N -10.688 1.376 0.247 1.00 . B B . 24 PHE N 1 1 1 680 2 2 24 PHE O O -9.845 -1.511 2.105 1.00 . B B . 24 PHE O 1 1 1 681 2 2 25 PHE C C -7.952 -3.500 0.349 1.00 . B B . 25 PHE C 1 1 1 682 2 2 25 PHE CA C -9.317 -2.900 -0.104 1.00 . B B . 25 PHE CA 1 1 1 683 2 2 25 PHE CB C -9.644 -3.287 -1.584 1.00 . B B . 25 PHE CB 1 1 1 684 2 2 25 PHE CD1 C -11.880 -2.062 -1.447 1.00 . B B . 25 PHE CD1 1 1 1 685 2 2 25 PHE CD2 C -10.648 -1.946 -3.473 1.00 . B B . 25 PHE CD2 1 1 1 686 2 2 25 PHE CE1 C -12.868 -1.275 -2.001 1.00 . B B . 25 PHE CE1 1 1 1 687 2 2 25 PHE CE2 C -11.634 -1.159 -4.032 1.00 . B B . 25 PHE CE2 1 1 1 688 2 2 25 PHE CG C -10.760 -2.405 -2.177 1.00 . B B . 25 PHE CG 1 1 1 689 2 2 25 PHE CZ C -12.746 -0.823 -3.295 1.00 . B B . 25 PHE CZ 1 1 1 690 2 2 25 PHE H H -9.163 -0.827 -0.794 1.00 . B B . 25 PHE H 1 1 1 691 2 2 25 PHE HA H -10.076 -3.315 0.545 1.00 . B B . 25 PHE HA 1 1 1 692 2 2 25 PHE HB2 H -8.764 -3.196 -2.199 1.00 . B B . 25 PHE HB2 1 1 1 693 2 2 25 PHE HB3 H -9.973 -4.314 -1.637 1.00 . B B . 25 PHE HB3 1 1 1 694 2 2 25 PHE HD1 H -11.985 -2.413 -0.432 1.00 . B B . 25 PHE HD1 1 1 1 695 2 2 25 PHE HD2 H -9.774 -2.209 -4.053 1.00 . B B . 25 PHE HD2 1 1 1 696 2 2 25 PHE HE1 H -13.741 -1.012 -1.418 1.00 . B B . 25 PHE HE1 1 1 1 697 2 2 25 PHE HE2 H -11.537 -0.809 -5.051 1.00 . B B . 25 PHE HE2 1 1 1 698 2 2 25 PHE HZ H -13.521 -0.204 -3.729 1.00 . B B . 25 PHE HZ 1 1 1 699 2 2 25 PHE N N -9.346 -1.390 -0.012 1.00 . B B . 25 PHE N 1 1 1 700 2 2 25 PHE O O -7.229 -4.159 -0.374 1.00 . B B . 25 PHE O 1 1 1 701 2 2 26 TYR C C -6.276 -5.323 2.481 1.00 . B B . 26 TYR C 1 1 1 702 2 2 26 TYR CA C -6.335 -3.772 2.179 1.00 . B B . 26 TYR CA 1 1 1 703 2 2 26 TYR CB C -6.123 -2.873 3.452 1.00 . B B . 26 TYR CB 1 1 1 704 2 2 26 TYR CD1 C -3.826 -3.917 3.801 1.00 . B B . 26 TYR CD1 1 1 1 705 2 2 26 TYR CD2 C -5.146 -3.402 5.708 1.00 . B B . 26 TYR CD2 1 1 1 706 2 2 26 TYR CE1 C -2.840 -4.418 4.618 1.00 . B B . 26 TYR CE1 1 1 1 707 2 2 26 TYR CE2 C -4.152 -3.906 6.521 1.00 . B B . 26 TYR CE2 1 1 1 708 2 2 26 TYR CG C -4.990 -3.406 4.340 1.00 . B B . 26 TYR CG 1 1 1 709 2 2 26 TYR CZ C -3.009 -4.414 5.969 1.00 . B B . 26 TYR CZ 1 1 1 710 2 2 26 TYR H H -8.265 -2.734 2.125 1.00 . B B . 26 TYR H 1 1 1 711 2 2 26 TYR HA H -5.544 -3.573 1.471 1.00 . B B . 26 TYR HA 1 1 1 712 2 2 26 TYR HB2 H -5.880 -1.860 3.158 1.00 . B B . 26 TYR HB2 1 1 1 713 2 2 26 TYR HB3 H -7.036 -2.836 4.030 1.00 . B B . 26 TYR HB3 1 1 1 714 2 2 26 TYR HD1 H -3.686 -3.925 2.730 1.00 . B B . 26 TYR HD1 1 1 1 715 2 2 26 TYR HD2 H -6.052 -2.995 6.138 1.00 . B B . 26 TYR HD2 1 1 1 716 2 2 26 TYR HE1 H -1.926 -4.815 4.201 1.00 . B B . 26 TYR HE1 1 1 1 717 2 2 26 TYR HE2 H -4.260 -3.901 7.596 1.00 . B B . 26 TYR HE2 1 1 1 718 2 2 26 TYR HH H -1.352 -4.286 6.912 1.00 . B B . 26 TYR HH 1 1 1 719 2 2 26 TYR N N -7.629 -3.263 1.589 1.00 . B B . 26 TYR N 1 1 1 720 2 2 26 TYR O O -5.852 -5.794 3.526 1.00 . B B . 26 TYR O 1 1 1 721 2 2 26 TYR OH O -2.041 -4.960 6.764 1.00 . B B . 26 TYR OH 1 1 1 722 2 2 27 THR C C -6.271 -8.472 0.496 1.00 . B B . 27 THR C 1 1 1 723 2 2 27 THR CA C -6.684 -7.618 1.731 1.00 . B B . 27 THR CA 1 1 1 724 2 2 27 THR CB C -8.087 -8.032 2.250 1.00 . B B . 27 THR CB 1 1 1 725 2 2 27 THR CG2 C -9.239 -7.767 1.315 1.00 . B B . 27 THR CG2 1 1 1 726 2 2 27 THR H H -7.030 -5.713 0.706 1.00 . B B . 27 THR H 1 1 1 727 2 2 27 THR HA H -6.010 -7.858 2.519 1.00 . B B . 27 THR HA 1 1 1 728 2 2 27 THR HB H -8.279 -7.636 3.241 1.00 . B B . 27 THR HB 1 1 1 729 2 2 27 THR HG1 H -8.181 -9.746 1.393 1.00 . B B . 27 THR HG1 1 1 1 730 2 2 27 THR HG21 H -9.137 -8.298 0.383 1.00 . B B . 27 THR HG21 1 1 1 731 2 2 27 THR HG22 H -10.147 -8.093 1.799 1.00 . B B . 27 THR HG22 1 1 1 732 2 2 27 THR HG23 H -9.306 -6.710 1.114 1.00 . B B . 27 THR HG23 1 1 1 733 2 2 27 THR N N -6.702 -6.114 1.539 1.00 . B B . 27 THR N 1 1 1 734 2 2 27 THR O O -7.105 -9.023 -0.192 1.00 . B B . 27 THR O 1 1 1 735 2 2 27 THR OG1 O -8.025 -9.441 2.301 1.00 . B B . 27 THR OG1 1 1 1 736 2 2 28 PRO C C -4.036 -8.985 2.692 1.00 . B B . 28 PRO C 1 1 1 737 2 2 28 PRO CA C -3.827 -8.784 1.154 1.00 . B B . 28 PRO CA 1 1 1 738 2 2 28 PRO CB C -2.944 -7.567 0.794 1.00 . B B . 28 PRO CB 1 1 1 739 2 2 28 PRO CD C -4.642 -7.668 -0.923 1.00 . B B . 28 PRO CD 1 1 1 740 2 2 28 PRO CG C -3.122 -7.496 -0.744 1.00 . B B . 28 PRO CG 1 1 1 741 2 2 28 PRO HA H -3.304 -9.673 0.826 1.00 . B B . 28 PRO HA 1 1 1 742 2 2 28 PRO HB2 H -3.302 -6.671 1.283 1.00 . B B . 28 PRO HB2 1 1 1 743 2 2 28 PRO HB3 H -1.914 -7.748 1.073 1.00 . B B . 28 PRO HB3 1 1 1 744 2 2 28 PRO HD2 H -5.165 -6.722 -0.833 1.00 . B B . 28 PRO HD2 1 1 1 745 2 2 28 PRO HD3 H -4.896 -8.139 -1.865 1.00 . B B . 28 PRO HD3 1 1 1 746 2 2 28 PRO HG2 H -2.796 -6.545 -1.142 1.00 . B B . 28 PRO HG2 1 1 1 747 2 2 28 PRO HG3 H -2.596 -8.300 -1.243 1.00 . B B . 28 PRO HG3 1 1 1 748 2 2 28 PRO N N -4.992 -8.587 0.205 1.00 . B B . 28 PRO N 1 1 1 749 2 2 28 PRO O O -3.485 -8.283 3.524 1.00 . B B . 28 PRO O 1 1 1 750 2 2 29 LYS C C -5.337 -11.773 4.718 1.00 . B B . 29 LYS C 1 1 1 751 2 2 29 LYS CA C -5.129 -10.241 4.499 1.00 . B B . 29 LYS CA 1 1 1 752 2 2 29 LYS CB C -6.382 -9.381 4.870 1.00 . B B . 29 LYS CB 1 1 1 753 2 2 29 LYS CD C -5.450 -8.508 7.115 1.00 . B B . 29 LYS CD 1 1 1 754 2 2 29 LYS CE C -5.300 -7.039 6.675 1.00 . B B . 29 LYS CE 1 1 1 755 2 2 29 LYS CG C -6.627 -9.249 6.392 1.00 . B B . 29 LYS CG 1 1 1 756 2 2 29 LYS H H -5.285 -10.479 2.354 1.00 . B B . 29 LYS H 1 1 1 757 2 2 29 LYS HA H -4.265 -9.975 5.087 1.00 . B B . 29 LYS HA 1 1 1 758 2 2 29 LYS HB2 H -6.298 -8.400 4.432 1.00 . B B . 29 LYS HB2 1 1 1 759 2 2 29 LYS HB3 H -7.249 -9.855 4.423 1.00 . B B . 29 LYS HB3 1 1 1 760 2 2 29 LYS HD2 H -5.651 -8.515 8.178 1.00 . B B . 29 LYS HD2 1 1 1 761 2 2 29 LYS HD3 H -4.516 -9.032 6.972 1.00 . B B . 29 LYS HD3 1 1 1 762 2 2 29 LYS HE2 H -6.263 -6.683 6.307 1.00 . B B . 29 LYS HE2 1 1 1 763 2 2 29 LYS HE3 H -5.017 -6.417 7.517 1.00 . B B . 29 LYS HE3 1 1 1 764 2 2 29 LYS HG2 H -7.540 -8.679 6.531 1.00 . B B . 29 LYS HG2 1 1 1 765 2 2 29 LYS HG3 H -6.815 -10.212 6.847 1.00 . B B . 29 LYS HG3 1 1 1 766 2 2 29 LYS HZ1 H -3.943 -7.850 5.239 1.00 . B B . 29 LYS HZ1 1 1 1 767 2 2 29 LYS HZ2 H -4.726 -6.466 4.759 1.00 . B B . 29 LYS HZ2 1 1 1 768 2 2 29 LYS HZ3 H -3.471 -6.371 5.894 1.00 . B B . 29 LYS HZ3 1 1 1 769 2 2 29 LYS N N -4.847 -9.939 3.049 1.00 . B B . 29 LYS N 1 1 1 770 2 2 29 LYS NZ N -4.290 -6.934 5.585 1.00 . B B . 29 LYS NZ 1 1 1 771 2 2 29 LYS O O -5.233 -12.555 3.798 1.00 . B B . 29 LYS O 1 1 1 772 2 2 30 THR C C -7.329 -13.990 6.465 1.00 . B B . 30 THR C 1 1 1 773 2 2 30 THR CA C -5.849 -13.632 6.262 1.00 . B B . 30 THR CA 1 1 1 774 2 2 30 THR CB C -5.106 -13.976 7.553 1.00 . B B . 30 THR CB 1 1 1 775 2 2 30 THR CG2 C -3.644 -13.606 7.507 1.00 . B B . 30 THR CG2 1 1 1 776 2 2 30 THR H H -5.690 -11.526 6.652 1.00 . B B . 30 THR H 1 1 1 777 2 2 30 THR HA H -5.473 -14.258 5.467 1.00 . B B . 30 THR HA 1 1 1 778 2 2 30 THR HB H -5.304 -14.978 7.925 1.00 . B B . 30 THR HB 1 1 1 779 2 2 30 THR HG1 H -5.941 -13.419 9.217 1.00 . B B . 30 THR HG1 1 1 1 780 2 2 30 THR HG21 H -3.147 -14.130 6.707 1.00 . B B . 30 THR HG21 1 1 1 781 2 2 30 THR HG22 H -3.530 -12.544 7.356 1.00 . B B . 30 THR HG22 1 1 1 782 2 2 30 THR HG23 H -3.178 -13.867 8.445 1.00 . B B . 30 THR HG23 1 1 1 783 2 2 30 THR N N -5.623 -12.171 5.924 1.00 . B B . 30 THR N 1 1 1 784 2 2 30 THR O O -7.668 -15.015 7.031 1.00 . B B . 30 THR O 1 1 1 785 2 2 30 THR OG1 O -5.574 -12.974 8.443 1.00 . B B . 30 THR OG1 1 1 2 786 1 1 1 GLY C C -0.783 -6.556 -2.882 1.00 . A A . 1 GLY C 1 1 2 787 1 1 1 GLY CA C -1.348 -7.039 -4.226 1.00 . A A . 1 GLY CA 1 1 2 788 1 1 1 GLY HA2 H -2.396 -6.788 -4.252 1.00 . A A . 1 GLY HA2 1 1 2 789 1 1 1 GLY HA3 H -1.242 -8.111 -4.262 1.00 . A A . 1 GLY HA3 1 1 2 790 1 1 1 GLY N N -0.675 -6.448 -5.436 1.00 . A A . 1 GLY N 1 1 2 791 1 1 1 GLY O O -0.655 -7.325 -1.945 1.00 . A A . 1 GLY O 1 1 2 792 1 1 2 ILE C C 1.252 -5.120 -0.917 1.00 . A A . 2 ILE C 1 1 2 793 1 1 2 ILE CA C 0.078 -4.498 -1.713 1.00 . A A . 2 ILE CA 1 1 2 794 1 1 2 ILE CB C -1.152 -4.122 -0.733 1.00 . A A . 2 ILE CB 1 1 2 795 1 1 2 ILE CD1 C -1.686 -2.645 1.374 1.00 . A A . 2 ILE CD1 1 1 2 796 1 1 2 ILE CG1 C -0.642 -3.032 0.264 1.00 . A A . 2 ILE CG1 1 1 2 797 1 1 2 ILE CG2 C -1.756 -5.297 0.080 1.00 . A A . 2 ILE CG2 1 1 2 798 1 1 2 ILE H H -0.646 -4.807 -3.708 1.00 . A A . 2 ILE H 1 1 2 799 1 1 2 ILE HA H 0.472 -3.579 -2.117 1.00 . A A . 2 ILE HA 1 1 2 800 1 1 2 ILE HB H -1.944 -3.714 -1.337 1.00 . A A . 2 ILE HB 1 1 2 801 1 1 2 ILE HD11 H -2.609 -2.277 0.950 1.00 . A A . 2 ILE HD11 1 1 2 802 1 1 2 ILE HD12 H -1.920 -3.484 2.017 1.00 . A A . 2 ILE HD12 1 1 2 803 1 1 2 ILE HD13 H -1.280 -1.871 2.012 1.00 . A A . 2 ILE HD13 1 1 2 804 1 1 2 ILE HG12 H 0.267 -3.381 0.731 1.00 . A A . 2 ILE HG12 1 1 2 805 1 1 2 ILE HG13 H -0.387 -2.143 -0.297 1.00 . A A . 2 ILE HG13 1 1 2 806 1 1 2 ILE HG21 H -2.081 -6.096 -0.566 1.00 . A A . 2 ILE HG21 1 1 2 807 1 1 2 ILE HG22 H -1.065 -5.667 0.817 1.00 . A A . 2 ILE HG22 1 1 2 808 1 1 2 ILE HG23 H -2.624 -4.942 0.617 1.00 . A A . 2 ILE HG23 1 1 2 809 1 1 2 ILE N N -0.492 -5.290 -2.869 1.00 . A A . 2 ILE N 1 1 2 810 1 1 2 ILE O O 2.364 -4.648 -1.043 1.00 . A A . 2 ILE O 1 1 2 811 1 1 3 VAL C C 3.401 -7.072 -0.230 1.00 . A A . 3 VAL C 1 1 2 812 1 1 3 VAL CA C 2.164 -6.752 0.650 1.00 . A A . 3 VAL CA 1 1 2 813 1 1 3 VAL CB C 1.579 -8.023 1.374 1.00 . A A . 3 VAL CB 1 1 2 814 1 1 3 VAL CG1 C 0.683 -7.509 2.527 1.00 . A A . 3 VAL CG1 1 1 2 815 1 1 3 VAL CG2 C 0.621 -8.836 0.488 1.00 . A A . 3 VAL CG2 1 1 2 816 1 1 3 VAL H H 0.126 -6.489 -0.101 1.00 . A A . 3 VAL H 1 1 2 817 1 1 3 VAL HA H 2.493 -6.033 1.389 1.00 . A A . 3 VAL HA 1 1 2 818 1 1 3 VAL HB H 2.384 -8.638 1.764 1.00 . A A . 3 VAL HB 1 1 2 819 1 1 3 VAL HG11 H -0.116 -6.882 2.162 1.00 . A A . 3 VAL HG11 1 1 2 820 1 1 3 VAL HG12 H 0.240 -8.326 3.076 1.00 . A A . 3 VAL HG12 1 1 2 821 1 1 3 VAL HG13 H 1.255 -6.912 3.227 1.00 . A A . 3 VAL HG13 1 1 2 822 1 1 3 VAL HG21 H 1.096 -9.159 -0.421 1.00 . A A . 3 VAL HG21 1 1 2 823 1 1 3 VAL HG22 H 0.320 -9.705 1.052 1.00 . A A . 3 VAL HG22 1 1 2 824 1 1 3 VAL HG23 H -0.253 -8.253 0.232 1.00 . A A . 3 VAL HG23 1 1 2 825 1 1 3 VAL N N 1.034 -6.139 -0.140 1.00 . A A . 3 VAL N 1 1 2 826 1 1 3 VAL O O 4.361 -6.325 -0.187 1.00 . A A . 3 VAL O 1 1 2 827 1 1 4 GLU C C 4.613 -7.260 -2.898 1.00 . A A . 4 GLU C 1 1 2 828 1 1 4 GLU CA C 4.603 -8.397 -1.852 1.00 . A A . 4 GLU CA 1 1 2 829 1 1 4 GLU CB C 4.470 -9.782 -2.545 1.00 . A A . 4 GLU CB 1 1 2 830 1 1 4 GLU CD C 7.040 -9.823 -2.810 1.00 . A A . 4 GLU CD 1 1 2 831 1 1 4 GLU CG C 5.715 -9.965 -3.528 1.00 . A A . 4 GLU CG 1 1 2 832 1 1 4 GLU H H 2.629 -8.715 -1.039 1.00 . A A . 4 GLU H 1 1 2 833 1 1 4 GLU HA H 5.489 -8.316 -1.228 1.00 . A A . 4 GLU HA 1 1 2 834 1 1 4 GLU HB2 H 4.491 -10.564 -1.798 1.00 . A A . 4 GLU HB2 1 1 2 835 1 1 4 GLU HB3 H 3.546 -9.846 -3.101 1.00 . A A . 4 GLU HB3 1 1 2 836 1 1 4 GLU HG2 H 5.713 -10.952 -3.959 1.00 . A A . 4 GLU HG2 1 1 2 837 1 1 4 GLU HG3 H 5.699 -9.241 -4.329 1.00 . A A . 4 GLU HG3 1 1 2 838 1 1 4 GLU N N 3.393 -8.123 -1.005 1.00 . A A . 4 GLU N 1 1 2 839 1 1 4 GLU O O 3.711 -7.169 -3.711 1.00 . A A . 4 GLU O 1 1 2 840 1 1 4 GLU OE1 O 7.154 -10.394 -1.749 1.00 . A A . 4 GLU OE1 1 1 2 841 1 1 4 GLU OE2 O 7.909 -9.134 -3.306 1.00 . A A . 4 GLU OE2 1 1 2 842 1 1 5 GLN C C 6.115 -4.019 -2.625 1.00 . A A . 5 GLN C 1 1 2 843 1 1 5 GLN CA C 6.036 -5.252 -3.556 1.00 . A A . 5 GLN CA 1 1 2 844 1 1 5 GLN CB C 5.013 -4.979 -4.725 1.00 . A A . 5 GLN CB 1 1 2 845 1 1 5 GLN CD C 2.594 -4.664 -5.387 1.00 . A A . 5 GLN CD 1 1 2 846 1 1 5 GLN CG C 3.592 -4.471 -4.258 1.00 . A A . 5 GLN CG 1 1 2 847 1 1 5 GLN H H 6.243 -6.768 -2.050 1.00 . A A . 5 GLN H 1 1 2 848 1 1 5 GLN HA H 7.033 -5.403 -3.940 1.00 . A A . 5 GLN HA 1 1 2 849 1 1 5 GLN HB2 H 5.465 -4.258 -5.393 1.00 . A A . 5 GLN HB2 1 1 2 850 1 1 5 GLN HB3 H 4.913 -5.906 -5.276 1.00 . A A . 5 GLN HB3 1 1 2 851 1 1 5 GLN HE21 H 2.325 -6.492 -4.861 1.00 . A A . 5 GLN HE21 1 1 2 852 1 1 5 GLN HE22 H 1.357 -5.953 -6.180 1.00 . A A . 5 GLN HE22 1 1 2 853 1 1 5 GLN HG2 H 3.219 -5.003 -3.399 1.00 . A A . 5 GLN HG2 1 1 2 854 1 1 5 GLN HG3 H 3.594 -3.420 -4.030 1.00 . A A . 5 GLN HG3 1 1 2 855 1 1 5 GLN N N 5.647 -6.476 -2.766 1.00 . A A . 5 GLN N 1 1 2 856 1 1 5 GLN NE2 N 2.032 -5.807 -5.494 1.00 . A A . 5 GLN NE2 1 1 2 857 1 1 5 GLN O O 7.066 -3.272 -2.678 1.00 . A A . 5 GLN O 1 1 2 858 1 1 5 GLN OE1 O 2.313 -3.805 -6.186 1.00 . A A . 5 GLN OE1 1 1 2 859 1 1 6 CYS C C 5.995 -2.947 0.433 1.00 . A A . 6 CYS C 1 1 2 860 1 1 6 CYS CA C 5.276 -2.568 -0.872 1.00 . A A . 6 CYS CA 1 1 2 861 1 1 6 CYS CB C 3.860 -2.065 -0.611 1.00 . A A . 6 CYS CB 1 1 2 862 1 1 6 CYS H H 4.376 -4.363 -1.694 1.00 . A A . 6 CYS H 1 1 2 863 1 1 6 CYS HA H 5.873 -1.800 -1.345 1.00 . A A . 6 CYS HA 1 1 2 864 1 1 6 CYS HB2 H 3.312 -2.804 -0.046 1.00 . A A . 6 CYS HB2 1 1 2 865 1 1 6 CYS HB3 H 3.928 -1.182 0.008 1.00 . A A . 6 CYS HB3 1 1 2 866 1 1 6 CYS HG H 2.460 -2.428 -2.394 1.00 . A A . 6 CYS HG 1 1 2 867 1 1 6 CYS N N 5.162 -3.778 -1.766 1.00 . A A . 6 CYS N 1 1 2 868 1 1 6 CYS O O 6.811 -2.219 0.954 1.00 . A A . 6 CYS O 1 1 2 869 1 1 6 CYS SG S 2.909 -1.636 -2.089 1.00 . A A . 6 CYS SG 1 1 2 870 1 1 7 CYS C C 7.669 -5.227 1.882 1.00 . A A . 7 CYS C 1 1 2 871 1 1 7 CYS CA C 6.293 -4.612 2.184 1.00 . A A . 7 CYS CA 1 1 2 872 1 1 7 CYS CB C 5.266 -5.605 2.736 1.00 . A A . 7 CYS CB 1 1 2 873 1 1 7 CYS H H 5.032 -4.666 0.434 1.00 . A A . 7 CYS H 1 1 2 874 1 1 7 CYS HA H 6.466 -3.796 2.864 1.00 . A A . 7 CYS HA 1 1 2 875 1 1 7 CYS HB2 H 4.397 -5.008 2.997 1.00 . A A . 7 CYS HB2 1 1 2 876 1 1 7 CYS HB3 H 4.960 -6.251 1.935 1.00 . A A . 7 CYS HB3 1 1 2 877 1 1 7 CYS HG H 6.106 -7.464 3.801 1.00 . A A . 7 CYS HG 1 1 2 878 1 1 7 CYS N N 5.679 -4.107 0.915 1.00 . A A . 7 CYS N 1 1 2 879 1 1 7 CYS O O 8.605 -5.157 2.650 1.00 . A A . 7 CYS O 1 1 2 880 1 1 7 CYS SG S 5.707 -6.659 4.142 1.00 . A A . 7 CYS SG 1 1 2 881 1 1 8 THR C C 9.739 -5.826 -0.948 1.00 . A A . 8 THR C 1 1 2 882 1 1 8 THR CA C 8.988 -6.490 0.238 1.00 . A A . 8 THR CA 1 1 2 883 1 1 8 THR CB C 8.622 -7.907 -0.151 1.00 . A A . 8 THR CB 1 1 2 884 1 1 8 THR CG2 C 7.922 -8.669 0.949 1.00 . A A . 8 THR CG2 1 1 2 885 1 1 8 THR H H 6.920 -5.840 0.184 1.00 . A A . 8 THR H 1 1 2 886 1 1 8 THR HA H 9.674 -6.581 1.052 1.00 . A A . 8 THR HA 1 1 2 887 1 1 8 THR HB H 9.385 -8.468 -0.686 1.00 . A A . 8 THR HB 1 1 2 888 1 1 8 THR HG1 H 7.421 -8.498 -1.433 1.00 . A A . 8 THR HG1 1 1 2 889 1 1 8 THR HG21 H 8.557 -8.745 1.818 1.00 . A A . 8 THR HG21 1 1 2 890 1 1 8 THR HG22 H 6.997 -8.185 1.222 1.00 . A A . 8 THR HG22 1 1 2 891 1 1 8 THR HG23 H 7.694 -9.663 0.588 1.00 . A A . 8 THR HG23 1 1 2 892 1 1 8 THR N N 7.729 -5.821 0.733 1.00 . A A . 8 THR N 1 1 2 893 1 1 8 THR O O 10.612 -5.005 -0.737 1.00 . A A . 8 THR O 1 1 2 894 1 1 8 THR OG1 O 7.516 -7.639 -0.982 1.00 . A A . 8 THR OG1 1 1 2 895 1 1 9 SER C C 9.386 -4.346 -4.002 1.00 . A A . 9 SER C 1 1 2 896 1 1 9 SER CA C 10.030 -5.617 -3.415 1.00 . A A . 9 SER CA 1 1 2 897 1 1 9 SER CB C 9.988 -6.693 -4.480 1.00 . A A . 9 SER CB 1 1 2 898 1 1 9 SER H H 8.654 -6.819 -2.217 1.00 . A A . 9 SER H 1 1 2 899 1 1 9 SER HA H 11.068 -5.400 -3.212 1.00 . A A . 9 SER HA 1 1 2 900 1 1 9 SER HB2 H 8.972 -6.830 -4.829 1.00 . A A . 9 SER HB2 1 1 2 901 1 1 9 SER HB3 H 10.636 -6.421 -5.302 1.00 . A A . 9 SER HB3 1 1 2 902 1 1 9 SER HG H 9.662 -8.410 -3.660 1.00 . A A . 9 SER HG 1 1 2 903 1 1 9 SER N N 9.383 -6.164 -2.155 1.00 . A A . 9 SER N 1 1 2 904 1 1 9 SER O O 8.679 -4.414 -4.982 1.00 . A A . 9 SER O 1 1 2 905 1 1 9 SER OG O 10.459 -7.864 -3.821 1.00 . A A . 9 SER OG 1 1 2 906 1 1 10 ILE C C 8.219 -1.664 -4.888 1.00 . A A . 10 ILE C 1 1 2 907 1 1 10 ILE CA C 9.172 -1.866 -3.720 1.00 . A A . 10 ILE CA 1 1 2 908 1 1 10 ILE CB C 10.359 -0.872 -3.965 1.00 . A A . 10 ILE CB 1 1 2 909 1 1 10 ILE CD1 C 12.356 0.101 -2.778 1.00 . A A . 10 ILE CD1 1 1 2 910 1 1 10 ILE CG1 C 10.987 -0.605 -2.605 1.00 . A A . 10 ILE CG1 1 1 2 911 1 1 10 ILE CG2 C 9.769 0.522 -4.491 1.00 . A A . 10 ILE CG2 1 1 2 912 1 1 10 ILE H H 10.250 -3.337 -2.610 1.00 . A A . 10 ILE H 1 1 2 913 1 1 10 ILE HA H 8.628 -1.544 -2.847 1.00 . A A . 10 ILE HA 1 1 2 914 1 1 10 ILE HB H 11.071 -1.292 -4.667 1.00 . A A . 10 ILE HB 1 1 2 915 1 1 10 ILE HD11 H 13.021 -0.504 -3.377 1.00 . A A . 10 ILE HD11 1 1 2 916 1 1 10 ILE HD12 H 12.221 1.055 -3.269 1.00 . A A . 10 ILE HD12 1 1 2 917 1 1 10 ILE HD13 H 12.817 0.277 -1.816 1.00 . A A . 10 ILE HD13 1 1 2 918 1 1 10 ILE HG12 H 10.291 0.054 -2.106 1.00 . A A . 10 ILE HG12 1 1 2 919 1 1 10 ILE HG13 H 11.061 -1.514 -2.026 1.00 . A A . 10 ILE HG13 1 1 2 920 1 1 10 ILE HG21 H 9.050 0.930 -3.789 1.00 . A A . 10 ILE HG21 1 1 2 921 1 1 10 ILE HG22 H 10.539 1.259 -4.640 1.00 . A A . 10 ILE HG22 1 1 2 922 1 1 10 ILE HG23 H 9.250 0.416 -5.437 1.00 . A A . 10 ILE HG23 1 1 2 923 1 1 10 ILE N N 9.671 -3.248 -3.368 1.00 . A A . 10 ILE N 1 1 2 924 1 1 10 ILE O O 8.348 -2.077 -6.024 1.00 . A A . 10 ILE O 1 1 2 925 1 1 11 CYS C C 6.047 0.999 -5.573 1.00 . A A . 11 CYS C 1 1 2 926 1 1 11 CYS CA C 6.135 -0.544 -5.360 1.00 . A A . 11 CYS CA 1 1 2 927 1 1 11 CYS CB C 4.904 -1.175 -4.678 1.00 . A A . 11 CYS CB 1 1 2 928 1 1 11 CYS H H 7.282 -0.651 -3.543 1.00 . A A . 11 CYS H 1 1 2 929 1 1 11 CYS HA H 6.286 -0.989 -6.335 1.00 . A A . 11 CYS HA 1 1 2 930 1 1 11 CYS HB2 H 4.083 -1.294 -5.368 1.00 . A A . 11 CYS HB2 1 1 2 931 1 1 11 CYS HB3 H 5.216 -2.175 -4.414 1.00 . A A . 11 CYS HB3 1 1 2 932 1 1 11 CYS HG H 4.907 -0.705 -2.431 1.00 . A A . 11 CYS HG 1 1 2 933 1 1 11 CYS N N 7.244 -0.933 -4.477 1.00 . A A . 11 CYS N 1 1 2 934 1 1 11 CYS O O 6.950 1.795 -5.427 1.00 . A A . 11 CYS O 1 1 2 935 1 1 11 CYS SG S 4.323 -0.423 -3.137 1.00 . A A . 11 CYS SG 1 1 2 936 1 1 12 SER C C 3.361 3.428 -5.333 1.00 . A A . 12 SER C 1 1 2 937 1 1 12 SER CA C 4.433 2.780 -6.222 1.00 . A A . 12 SER CA 1 1 2 938 1 1 12 SER CB C 3.967 2.823 -7.696 1.00 . A A . 12 SER CB 1 1 2 939 1 1 12 SER H H 4.304 0.570 -5.955 1.00 . A A . 12 SER H 1 1 2 940 1 1 12 SER HA H 5.244 3.460 -6.198 1.00 . A A . 12 SER HA 1 1 2 941 1 1 12 SER HB2 H 4.813 2.682 -8.360 1.00 . A A . 12 SER HB2 1 1 2 942 1 1 12 SER HB3 H 3.206 2.089 -7.928 1.00 . A A . 12 SER HB3 1 1 2 943 1 1 12 SER HG H 3.832 4.561 -8.616 1.00 . A A . 12 SER HG 1 1 2 944 1 1 12 SER N N 4.865 1.354 -5.924 1.00 . A A . 12 SER N 1 1 2 945 1 1 12 SER O O 2.610 2.771 -4.646 1.00 . A A . 12 SER O 1 1 2 946 1 1 12 SER OG O 3.443 4.140 -7.830 1.00 . A A . 12 SER OG 1 1 2 947 1 1 13 LEU C C 0.989 5.264 -5.229 1.00 . A A . 13 LEU C 1 1 2 948 1 1 13 LEU CA C 2.368 5.565 -4.631 1.00 . A A . 13 LEU CA 1 1 2 949 1 1 13 LEU CB C 2.841 7.011 -4.846 1.00 . A A . 13 LEU CB 1 1 2 950 1 1 13 LEU CD1 C 2.287 7.982 -2.657 1.00 . A A . 13 LEU CD1 1 1 2 951 1 1 13 LEU CD2 C 2.310 9.402 -4.673 1.00 . A A . 13 LEU CD2 1 1 2 952 1 1 13 LEU CG C 1.954 8.022 -4.137 1.00 . A A . 13 LEU CG 1 1 2 953 1 1 13 LEU H H 3.996 5.136 -5.996 1.00 . A A . 13 LEU H 1 1 2 954 1 1 13 LEU HA H 2.307 5.251 -3.597 1.00 . A A . 13 LEU HA 1 1 2 955 1 1 13 LEU HB2 H 3.852 7.095 -4.473 1.00 . A A . 13 LEU HB2 1 1 2 956 1 1 13 LEU HB3 H 2.858 7.230 -5.902 1.00 . A A . 13 LEU HB3 1 1 2 957 1 1 13 LEU HD11 H 3.330 8.219 -2.494 1.00 . A A . 13 LEU HD11 1 1 2 958 1 1 13 LEU HD12 H 1.683 8.703 -2.125 1.00 . A A . 13 LEU HD12 1 1 2 959 1 1 13 LEU HD13 H 2.093 7.001 -2.251 1.00 . A A . 13 LEU HD13 1 1 2 960 1 1 13 LEU HD21 H 3.347 9.637 -4.484 1.00 . A A . 13 LEU HD21 1 1 2 961 1 1 13 LEU HD22 H 2.131 9.451 -5.739 1.00 . A A . 13 LEU HD22 1 1 2 962 1 1 13 LEU HD23 H 1.696 10.150 -4.193 1.00 . A A . 13 LEU HD23 1 1 2 963 1 1 13 LEU HG H 0.897 7.814 -4.298 1.00 . A A . 13 LEU HG 1 1 2 964 1 1 13 LEU N N 3.334 4.723 -5.400 1.00 . A A . 13 LEU N 1 1 2 965 1 1 13 LEU O O 0.116 4.757 -4.552 1.00 . A A . 13 LEU O 1 1 2 966 1 1 14 TYR C C -0.798 3.790 -6.981 1.00 . A A . 14 TYR C 1 1 2 967 1 1 14 TYR CA C -0.471 5.290 -7.142 1.00 . A A . 14 TYR CA 1 1 2 968 1 1 14 TYR CB C -0.429 5.710 -8.658 1.00 . A A . 14 TYR CB 1 1 2 969 1 1 14 TYR CD1 C 1.793 6.788 -9.089 1.00 . A A . 14 TYR CD1 1 1 2 970 1 1 14 TYR CD2 C 1.408 4.618 -9.986 1.00 . A A . 14 TYR CD2 1 1 2 971 1 1 14 TYR CE1 C 3.062 6.790 -9.628 1.00 . A A . 14 TYR CE1 1 1 2 972 1 1 14 TYR CE2 C 2.679 4.632 -10.519 1.00 . A A . 14 TYR CE2 1 1 2 973 1 1 14 TYR CG C 0.965 5.700 -9.267 1.00 . A A . 14 TYR CG 1 1 2 974 1 1 14 TYR CZ C 3.503 5.708 -10.342 1.00 . A A . 14 TYR CZ 1 1 2 975 1 1 14 TYR H H 1.601 5.937 -6.985 1.00 . A A . 14 TYR H 1 1 2 976 1 1 14 TYR HA H -1.238 5.856 -6.636 1.00 . A A . 14 TYR HA 1 1 2 977 1 1 14 TYR HB2 H -1.074 5.058 -9.231 1.00 . A A . 14 TYR HB2 1 1 2 978 1 1 14 TYR HB3 H -0.841 6.708 -8.735 1.00 . A A . 14 TYR HB3 1 1 2 979 1 1 14 TYR HD1 H 1.436 7.639 -8.524 1.00 . A A . 14 TYR HD1 1 1 2 980 1 1 14 TYR HD2 H 0.762 3.763 -10.132 1.00 . A A . 14 TYR HD2 1 1 2 981 1 1 14 TYR HE1 H 3.707 7.644 -9.492 1.00 . A A . 14 TYR HE1 1 1 2 982 1 1 14 TYR HE2 H 3.050 3.795 -11.085 1.00 . A A . 14 TYR HE2 1 1 2 983 1 1 14 TYR HH H 5.157 6.534 -10.832 1.00 . A A . 14 TYR HH 1 1 2 984 1 1 14 TYR N N 0.848 5.561 -6.492 1.00 . A A . 14 TYR N 1 1 2 985 1 1 14 TYR O O -1.956 3.421 -6.930 1.00 . A A . 14 TYR O 1 1 2 986 1 1 14 TYR OH O 4.762 5.653 -10.874 1.00 . A A . 14 TYR OH 1 1 2 987 1 1 15 GLN C C -0.710 1.237 -5.253 1.00 . A A . 15 GLN C 1 1 2 988 1 1 15 GLN CA C -0.344 1.489 -6.726 1.00 . A A . 15 GLN CA 1 1 2 989 1 1 15 GLN CB C 0.736 0.482 -7.316 1.00 . A A . 15 GLN CB 1 1 2 990 1 1 15 GLN CD C 1.679 -0.469 -5.193 1.00 . A A . 15 GLN CD 1 1 2 991 1 1 15 GLN CG C 1.997 0.273 -6.462 1.00 . A A . 15 GLN CG 1 1 2 992 1 1 15 GLN H H 1.142 3.162 -6.934 1.00 . A A . 15 GLN H 1 1 2 993 1 1 15 GLN HA H -1.290 1.407 -7.192 1.00 . A A . 15 GLN HA 1 1 2 994 1 1 15 GLN HB2 H 0.245 -0.478 -7.441 1.00 . A A . 15 GLN HB2 1 1 2 995 1 1 15 GLN HB3 H 1.011 0.819 -8.306 1.00 . A A . 15 GLN HB3 1 1 2 996 1 1 15 GLN HE21 H 2.090 1.058 -4.069 1.00 . A A . 15 GLN HE21 1 1 2 997 1 1 15 GLN HE22 H 1.608 -0.367 -3.259 1.00 . A A . 15 GLN HE22 1 1 2 998 1 1 15 GLN HG2 H 2.711 -0.328 -7.004 1.00 . A A . 15 GLN HG2 1 1 2 999 1 1 15 GLN HG3 H 2.427 1.210 -6.194 1.00 . A A . 15 GLN HG3 1 1 2 1000 1 1 15 GLN N N 0.180 2.900 -6.891 1.00 . A A . 15 GLN N 1 1 2 1001 1 1 15 GLN NE2 N 1.804 0.126 -4.074 1.00 . A A . 15 GLN NE2 1 1 2 1002 1 1 15 GLN O O -1.583 0.457 -4.934 1.00 . A A . 15 GLN O 1 1 2 1003 1 1 15 GLN OE1 O 1.304 -1.608 -5.187 1.00 . A A . 15 GLN OE1 1 1 2 1004 1 1 16 LEU C C -1.798 2.192 -2.714 1.00 . A A . 16 LEU C 1 1 2 1005 1 1 16 LEU CA C -0.333 1.761 -2.921 1.00 . A A . 16 LEU CA 1 1 2 1006 1 1 16 LEU CB C 0.633 2.659 -2.052 1.00 . A A . 16 LEU CB 1 1 2 1007 1 1 16 LEU CD1 C 2.698 2.724 -0.633 1.00 . A A . 16 LEU CD1 1 1 2 1008 1 1 16 LEU CD2 C 1.337 0.701 -0.575 1.00 . A A . 16 LEU CD2 1 1 2 1009 1 1 16 LEU CG C 1.833 1.829 -1.503 1.00 . A A . 16 LEU CG 1 1 2 1010 1 1 16 LEU H H 0.632 2.513 -4.707 1.00 . A A . 16 LEU H 1 1 2 1011 1 1 16 LEU HA H -0.248 0.720 -2.718 1.00 . A A . 16 LEU HA 1 1 2 1012 1 1 16 LEU HB2 H 0.995 3.485 -2.651 1.00 . A A . 16 LEU HB2 1 1 2 1013 1 1 16 LEU HB3 H 0.087 3.094 -1.222 1.00 . A A . 16 LEU HB3 1 1 2 1014 1 1 16 LEU HD11 H 2.123 3.110 0.197 1.00 . A A . 16 LEU HD11 1 1 2 1015 1 1 16 LEU HD12 H 3.529 2.156 -0.238 1.00 . A A . 16 LEU HD12 1 1 2 1016 1 1 16 LEU HD13 H 3.081 3.550 -1.212 1.00 . A A . 16 LEU HD13 1 1 2 1017 1 1 16 LEU HD21 H 0.787 1.103 0.264 1.00 . A A . 16 LEU HD21 1 1 2 1018 1 1 16 LEU HD22 H 0.700 -0.005 -1.085 1.00 . A A . 16 LEU HD22 1 1 2 1019 1 1 16 LEU HD23 H 2.181 0.152 -0.180 1.00 . A A . 16 LEU HD23 1 1 2 1020 1 1 16 LEU HG H 2.445 1.443 -2.304 1.00 . A A . 16 LEU HG 1 1 2 1021 1 1 16 LEU N N -0.043 1.919 -4.373 1.00 . A A . 16 LEU N 1 1 2 1022 1 1 16 LEU O O -2.574 1.542 -2.030 1.00 . A A . 16 LEU O 1 1 2 1023 1 1 17 GLU C C -4.504 2.679 -3.740 1.00 . A A . 17 GLU C 1 1 2 1024 1 1 17 GLU CA C -3.574 3.731 -3.141 1.00 . A A . 17 GLU CA 1 1 2 1025 1 1 17 GLU CB C -3.817 5.122 -3.794 1.00 . A A . 17 GLU CB 1 1 2 1026 1 1 17 GLU CD C -4.084 6.507 -5.867 1.00 . A A . 17 GLU CD 1 1 2 1027 1 1 17 GLU CG C -3.660 5.148 -5.314 1.00 . A A . 17 GLU CG 1 1 2 1028 1 1 17 GLU H H -1.480 3.786 -3.868 1.00 . A A . 17 GLU H 1 1 2 1029 1 1 17 GLU HA H -3.814 3.753 -2.096 1.00 . A A . 17 GLU HA 1 1 2 1030 1 1 17 GLU HB2 H -4.813 5.465 -3.548 1.00 . A A . 17 GLU HB2 1 1 2 1031 1 1 17 GLU HB3 H -3.134 5.849 -3.389 1.00 . A A . 17 GLU HB3 1 1 2 1032 1 1 17 GLU HG2 H -2.623 5.011 -5.534 1.00 . A A . 17 GLU HG2 1 1 2 1033 1 1 17 GLU HG3 H -4.244 4.400 -5.821 1.00 . A A . 17 GLU HG3 1 1 2 1034 1 1 17 GLU N N -2.150 3.296 -3.324 1.00 . A A . 17 GLU N 1 1 2 1035 1 1 17 GLU O O -5.465 2.353 -3.083 1.00 . A A . 17 GLU O 1 1 2 1036 1 1 17 GLU OE1 O -5.233 6.826 -5.625 1.00 . A A . 17 GLU OE1 1 1 2 1037 1 1 17 GLU OE2 O -3.241 7.126 -6.487 1.00 . A A . 17 GLU OE2 1 1 2 1038 1 1 18 ASN C C -5.745 0.135 -4.414 1.00 . A A . 18 ASN C 1 1 2 1039 1 1 18 ASN CA C -5.153 1.088 -5.519 1.00 . A A . 18 ASN CA 1 1 2 1040 1 1 18 ASN CB C -4.282 0.335 -6.573 1.00 . A A . 18 ASN CB 1 1 2 1041 1 1 18 ASN CG C -5.092 -0.593 -7.463 1.00 . A A . 18 ASN CG 1 1 2 1042 1 1 18 ASN H H -3.452 2.443 -5.388 1.00 . A A . 18 ASN H 1 1 2 1043 1 1 18 ASN HA H -6.024 1.587 -5.916 1.00 . A A . 18 ASN HA 1 1 2 1044 1 1 18 ASN HB2 H -3.787 1.044 -7.219 1.00 . A A . 18 ASN HB2 1 1 2 1045 1 1 18 ASN HB3 H -3.532 -0.271 -6.091 1.00 . A A . 18 ASN HB3 1 1 2 1046 1 1 18 ASN HD21 H -6.768 -0.588 -6.407 1.00 . A A . 18 ASN HD21 1 1 2 1047 1 1 18 ASN HD22 H -6.736 -1.519 -7.833 1.00 . A A . 18 ASN HD22 1 1 2 1048 1 1 18 ASN N N -4.252 2.150 -4.907 1.00 . A A . 18 ASN N 1 1 2 1049 1 1 18 ASN ND2 N -6.305 -0.920 -7.199 1.00 . A A . 18 ASN ND2 1 1 2 1050 1 1 18 ASN O O -6.869 -0.312 -4.524 1.00 . A A . 18 ASN O 1 1 2 1051 1 1 18 ASN OD1 O -4.629 -1.073 -8.468 1.00 . A A . 18 ASN OD1 1 1 2 1052 1 1 19 TYR C C -6.220 -0.143 -1.266 1.00 . A A . 19 TYR C 1 1 2 1053 1 1 19 TYR CA C -5.445 -1.038 -2.256 1.00 . A A . 19 TYR CA 1 1 2 1054 1 1 19 TYR CB C -4.219 -1.657 -1.553 1.00 . A A . 19 TYR CB 1 1 2 1055 1 1 19 TYR CD1 C -3.675 -3.118 -3.512 1.00 . A A . 19 TYR CD1 1 1 2 1056 1 1 19 TYR CD2 C -2.012 -1.654 -2.656 1.00 . A A . 19 TYR CD2 1 1 2 1057 1 1 19 TYR CE1 C -2.780 -3.570 -4.452 1.00 . A A . 19 TYR CE1 1 1 2 1058 1 1 19 TYR CE2 C -1.130 -2.111 -3.594 1.00 . A A . 19 TYR CE2 1 1 2 1059 1 1 19 TYR CG C -3.281 -2.159 -2.612 1.00 . A A . 19 TYR CG 1 1 2 1060 1 1 19 TYR CZ C -1.507 -3.075 -4.498 1.00 . A A . 19 TYR CZ 1 1 2 1061 1 1 19 TYR H H -4.081 0.240 -3.384 1.00 . A A . 19 TYR H 1 1 2 1062 1 1 19 TYR HA H -6.127 -1.791 -2.629 1.00 . A A . 19 TYR HA 1 1 2 1063 1 1 19 TYR HB2 H -3.687 -0.955 -0.929 1.00 . A A . 19 TYR HB2 1 1 2 1064 1 1 19 TYR HB3 H -4.478 -2.509 -0.943 1.00 . A A . 19 TYR HB3 1 1 2 1065 1 1 19 TYR HD1 H -4.683 -3.511 -3.482 1.00 . A A . 19 TYR HD1 1 1 2 1066 1 1 19 TYR HD2 H -1.710 -0.893 -1.950 1.00 . A A . 19 TYR HD2 1 1 2 1067 1 1 19 TYR HE1 H -3.081 -4.311 -5.172 1.00 . A A . 19 TYR HE1 1 1 2 1068 1 1 19 TYR HE2 H -0.144 -1.693 -3.608 1.00 . A A . 19 TYR HE2 1 1 2 1069 1 1 19 TYR HH H 0.116 -2.963 -5.463 1.00 . A A . 19 TYR HH 1 1 2 1070 1 1 19 TYR N N -4.980 -0.145 -3.387 1.00 . A A . 19 TYR N 1 1 2 1071 1 1 19 TYR O O -7.307 -0.472 -0.841 1.00 . A A . 19 TYR O 1 1 2 1072 1 1 19 TYR OH O -0.629 -3.587 -5.422 1.00 . A A . 19 TYR OH 1 1 2 1073 1 1 20 CYS C C -7.762 2.197 -0.393 1.00 . A A . 20 CYS C 1 1 2 1074 1 1 20 CYS CA C -6.277 1.954 0.032 1.00 . A A . 20 CYS CA 1 1 2 1075 1 1 20 CYS CB C -5.462 3.204 -0.030 1.00 . A A . 20 CYS CB 1 1 2 1076 1 1 20 CYS H H -4.757 1.161 -1.314 1.00 . A A . 20 CYS H 1 1 2 1077 1 1 20 CYS HA H -6.252 1.673 1.053 1.00 . A A . 20 CYS HA 1 1 2 1078 1 1 20 CYS HB2 H -4.417 2.951 0.094 1.00 . A A . 20 CYS HB2 1 1 2 1079 1 1 20 CYS HB3 H -5.575 3.678 -0.995 1.00 . A A . 20 CYS HB3 1 1 2 1080 1 1 20 CYS HG H -5.424 4.115 2.054 1.00 . A A . 20 CYS HG 1 1 2 1081 1 1 20 CYS N N -5.633 0.971 -0.918 1.00 . A A . 20 CYS N 1 1 2 1082 1 1 20 CYS O O -8.717 2.118 0.357 1.00 . A A . 20 CYS O 1 1 2 1083 1 1 20 CYS SG S -5.961 4.331 1.289 1.00 . A A . 20 CYS SG 1 1 2 1084 1 1 21 ASN C C -10.141 1.858 -2.597 1.00 . A A . 21 ASN C 1 1 2 1085 1 1 21 ASN CA C -8.926 2.810 -2.559 1.00 . A A . 21 ASN CA 1 1 2 1086 1 1 21 ASN CB C -8.272 2.967 -3.954 1.00 . A A . 21 ASN CB 1 1 2 1087 1 1 21 ASN CG C -7.453 4.242 -3.977 1.00 . A A . 21 ASN CG 1 1 2 1088 1 1 21 ASN H H -6.894 2.510 -2.036 1.00 . A A . 21 ASN H 1 1 2 1089 1 1 21 ASN HA H -9.286 3.766 -2.255 1.00 . A A . 21 ASN HA 1 1 2 1090 1 1 21 ASN HB2 H -7.601 2.152 -4.158 1.00 . A A . 21 ASN HB2 1 1 2 1091 1 1 21 ASN HB3 H -8.997 3.013 -4.749 1.00 . A A . 21 ASN HB3 1 1 2 1092 1 1 21 ASN HD21 H -7.717 4.549 -5.895 1.00 . A A . 21 ASN HD21 1 1 2 1093 1 1 21 ASN HD22 H -6.691 5.656 -5.107 1.00 . A A . 21 ASN HD22 1 1 2 1094 1 1 21 ASN N N -7.782 2.494 -1.650 1.00 . A A . 21 ASN N 1 1 2 1095 1 1 21 ASN ND2 N -7.273 4.866 -5.078 1.00 . A A . 21 ASN ND2 1 1 2 1096 1 1 21 ASN O O -10.472 1.241 -1.607 1.00 . A A . 21 ASN O 1 1 2 1097 1 1 21 ASN OD1 O -6.959 4.692 -2.964 1.00 . A A . 21 ASN OD1 1 1 2 1098 2 2 1 PHE C C 6.337 6.909 -5.660 1.00 . B B . 1 PHE C 1 1 2 1099 2 2 1 PHE CA C 5.905 8.349 -6.055 1.00 . B B . 1 PHE CA 1 1 2 1100 2 2 1 PHE CB C 5.111 8.357 -7.387 1.00 . B B . 1 PHE CB 1 1 2 1101 2 2 1 PHE CD1 C 6.466 6.933 -8.982 1.00 . B B . 1 PHE CD1 1 1 2 1102 2 2 1 PHE CD2 C 6.546 9.289 -9.247 1.00 . B B . 1 PHE CD2 1 1 2 1103 2 2 1 PHE CE1 C 7.331 6.781 -10.045 1.00 . B B . 1 PHE CE1 1 1 2 1104 2 2 1 PHE CE2 C 7.410 9.144 -10.311 1.00 . B B . 1 PHE CE2 1 1 2 1105 2 2 1 PHE CG C 6.067 8.185 -8.574 1.00 . B B . 1 PHE CG 1 1 2 1106 2 2 1 PHE CZ C 7.803 7.888 -10.711 1.00 . B B . 1 PHE CZ 1 1 2 1107 2 2 1 PHE HA H 5.290 8.717 -5.250 1.00 . B B . 1 PHE HA 1 1 2 1108 2 2 1 PHE HB2 H 4.404 7.542 -7.400 1.00 . B B . 1 PHE HB2 1 1 2 1109 2 2 1 PHE HB3 H 4.576 9.288 -7.499 1.00 . B B . 1 PHE HB3 1 1 2 1110 2 2 1 PHE HD1 H 6.102 6.055 -8.467 1.00 . B B . 1 PHE HD1 1 1 2 1111 2 2 1 PHE HD2 H 6.242 10.279 -8.937 1.00 . B B . 1 PHE HD2 1 1 2 1112 2 2 1 PHE HE1 H 7.636 5.789 -10.353 1.00 . B B . 1 PHE HE1 1 1 2 1113 2 2 1 PHE HE2 H 7.781 10.016 -10.834 1.00 . B B . 1 PHE HE2 1 1 2 1114 2 2 1 PHE HZ H 8.483 7.768 -11.545 1.00 . B B . 1 PHE HZ 1 1 2 1115 2 2 1 PHE N N 7.050 9.304 -6.234 1.00 . B B . 1 PHE N 1 1 2 1116 2 2 1 PHE O O 5.818 5.911 -6.128 1.00 . B B . 1 PHE O 1 1 2 1117 2 2 2 VAL C C 7.430 5.567 -2.726 1.00 . B B . 2 VAL C 1 1 2 1118 2 2 2 VAL CA C 7.891 5.682 -4.192 1.00 . B B . 2 VAL CA 1 1 2 1119 2 2 2 VAL CB C 9.445 5.876 -4.359 1.00 . B B . 2 VAL CB 1 1 2 1120 2 2 2 VAL CG1 C 9.943 7.058 -3.487 1.00 . B B . 2 VAL CG1 1 1 2 1121 2 2 2 VAL CG2 C 10.234 4.644 -3.922 1.00 . B B . 2 VAL CG2 1 1 2 1122 2 2 2 VAL H H 7.628 7.666 -4.380 1.00 . B B . 2 VAL H 1 1 2 1123 2 2 2 VAL HA H 7.536 4.849 -4.745 1.00 . B B . 2 VAL HA 1 1 2 1124 2 2 2 VAL HB H 9.667 6.075 -5.401 1.00 . B B . 2 VAL HB 1 1 2 1125 2 2 2 VAL HG11 H 9.734 6.885 -2.438 1.00 . B B . 2 VAL HG11 1 1 2 1126 2 2 2 VAL HG12 H 11.012 7.183 -3.598 1.00 . B B . 2 VAL HG12 1 1 2 1127 2 2 2 VAL HG13 H 9.468 7.985 -3.777 1.00 . B B . 2 VAL HG13 1 1 2 1128 2 2 2 VAL HG21 H 9.927 3.762 -4.467 1.00 . B B . 2 VAL HG21 1 1 2 1129 2 2 2 VAL HG22 H 11.291 4.787 -4.095 1.00 . B B . 2 VAL HG22 1 1 2 1130 2 2 2 VAL HG23 H 10.101 4.463 -2.872 1.00 . B B . 2 VAL HG23 1 1 2 1131 2 2 2 VAL N N 7.272 6.875 -4.760 1.00 . B B . 2 VAL N 1 1 2 1132 2 2 2 VAL O O 6.685 6.367 -2.198 1.00 . B B . 2 VAL O 1 1 2 1133 2 2 3 ASN C C 8.787 3.590 0.084 1.00 . B B . 3 ASN C 1 1 2 1134 2 2 3 ASN CA C 7.601 4.191 -0.699 1.00 . B B . 3 ASN CA 1 1 2 1135 2 2 3 ASN CB C 6.330 3.254 -0.778 1.00 . B B . 3 ASN CB 1 1 2 1136 2 2 3 ASN CG C 6.353 2.471 -2.072 1.00 . B B . 3 ASN CG 1 1 2 1137 2 2 3 ASN H H 8.473 3.995 -2.702 1.00 . B B . 3 ASN H 1 1 2 1138 2 2 3 ASN HA H 7.342 5.073 -0.157 1.00 . B B . 3 ASN HA 1 1 2 1139 2 2 3 ASN HB2 H 6.308 2.547 0.038 1.00 . B B . 3 ASN HB2 1 1 2 1140 2 2 3 ASN HB3 H 5.428 3.841 -0.758 1.00 . B B . 3 ASN HB3 1 1 2 1141 2 2 3 ASN HD21 H 5.572 3.968 -3.091 1.00 . B B . 3 ASN HD21 1 1 2 1142 2 2 3 ASN HD22 H 5.966 2.552 -3.965 1.00 . B B . 3 ASN HD22 1 1 2 1143 2 2 3 ASN N N 7.900 4.534 -2.131 1.00 . B B . 3 ASN N 1 1 2 1144 2 2 3 ASN ND2 N 5.922 3.059 -3.134 1.00 . B B . 3 ASN ND2 1 1 2 1145 2 2 3 ASN O O 9.496 4.294 0.771 1.00 . B B . 3 ASN O 1 1 2 1146 2 2 3 ASN OD1 O 6.765 1.338 -2.155 1.00 . B B . 3 ASN OD1 1 1 2 1147 2 2 4 GLN C C 9.207 0.325 1.375 1.00 . B B . 4 GLN C 1 1 2 1148 2 2 4 GLN CA C 9.900 1.348 0.462 1.00 . B B . 4 GLN CA 1 1 2 1149 2 2 4 GLN CB C 11.021 2.077 1.279 1.00 . B B . 4 GLN CB 1 1 2 1150 2 2 4 GLN CD C 11.660 3.344 -0.932 1.00 . B B . 4 GLN CD 1 1 2 1151 2 2 4 GLN CG C 12.157 2.636 0.326 1.00 . B B . 4 GLN CG 1 1 2 1152 2 2 4 GLN H H 8.234 1.934 -0.691 1.00 . B B . 4 GLN H 1 1 2 1153 2 2 4 GLN HA H 10.352 0.803 -0.346 1.00 . B B . 4 GLN HA 1 1 2 1154 2 2 4 GLN HB2 H 10.599 2.840 1.913 1.00 . B B . 4 GLN HB2 1 1 2 1155 2 2 4 GLN HB3 H 11.476 1.346 1.930 1.00 . B B . 4 GLN HB3 1 1 2 1156 2 2 4 GLN HE21 H 12.281 5.127 -0.400 1.00 . B B . 4 GLN HE21 1 1 2 1157 2 2 4 GLN HE22 H 11.522 5.008 -1.919 1.00 . B B . 4 GLN HE22 1 1 2 1158 2 2 4 GLN HG2 H 12.771 3.337 0.869 1.00 . B B . 4 GLN HG2 1 1 2 1159 2 2 4 GLN HG3 H 12.788 1.827 -0.007 1.00 . B B . 4 GLN HG3 1 1 2 1160 2 2 4 GLN N N 8.902 2.311 -0.101 1.00 . B B . 4 GLN N 1 1 2 1161 2 2 4 GLN NE2 N 11.841 4.606 -1.093 1.00 . B B . 4 GLN NE2 1 1 2 1162 2 2 4 GLN O O 8.101 0.491 1.833 1.00 . B B . 4 GLN O 1 1 2 1163 2 2 4 GLN OE1 O 11.086 2.760 -1.819 1.00 . B B . 4 GLN OE1 1 1 2 1164 2 2 5 HIS C C 8.742 -1.682 3.713 1.00 . B B . 5 HIS C 1 1 2 1165 2 2 5 HIS CA C 9.616 -1.917 2.418 1.00 . B B . 5 HIS CA 1 1 2 1166 2 2 5 HIS CB C 11.002 -2.590 2.758 1.00 . B B . 5 HIS CB 1 1 2 1167 2 2 5 HIS CD2 C 13.057 -1.445 1.581 1.00 . B B . 5 HIS CD2 1 1 2 1168 2 2 5 HIS CE1 C 13.028 -2.455 -0.220 1.00 . B B . 5 HIS CE1 1 1 2 1169 2 2 5 HIS CG C 12.011 -2.343 1.632 1.00 . B B . 5 HIS CG 1 1 2 1170 2 2 5 HIS H H 10.823 -0.666 1.154 1.00 . B B . 5 HIS H 1 1 2 1171 2 2 5 HIS HA H 8.976 -2.541 1.824 1.00 . B B . 5 HIS HA 1 1 2 1172 2 2 5 HIS HB2 H 11.401 -2.199 3.681 1.00 . B B . 5 HIS HB2 1 1 2 1173 2 2 5 HIS HB3 H 10.866 -3.657 2.868 1.00 . B B . 5 HIS HB3 1 1 2 1174 2 2 5 HIS HD1 H 11.445 -3.652 0.190 1.00 . B B . 5 HIS HD1 1 1 2 1175 2 2 5 HIS HD2 H 13.329 -0.774 2.381 1.00 . B B . 5 HIS HD2 1 1 2 1176 2 2 5 HIS HE1 H 13.284 -2.778 -1.221 1.00 . B B . 5 HIS HE1 1 1 2 1177 2 2 5 HIS N N 9.952 -0.703 1.577 1.00 . B B . 5 HIS N 1 1 2 1178 2 2 5 HIS ND1 N 12.052 -2.933 0.489 1.00 . B B . 5 HIS ND1 1 1 2 1179 2 2 5 HIS NE2 N 13.680 -1.524 0.424 1.00 . B B . 5 HIS NE2 1 1 2 1180 2 2 5 HIS O O 9.208 -1.770 4.835 1.00 . B B . 5 HIS O 1 1 2 1181 2 2 6 LEU C C 5.559 -2.349 4.756 1.00 . B B . 6 LEU C 1 1 2 1182 2 2 6 LEU CA C 6.553 -1.150 4.702 1.00 . B B . 6 LEU CA 1 1 2 1183 2 2 6 LEU CB C 5.860 0.252 4.481 1.00 . B B . 6 LEU CB 1 1 2 1184 2 2 6 LEU CD1 C 4.150 1.762 3.605 1.00 . B B . 6 LEU CD1 1 1 2 1185 2 2 6 LEU CD2 C 5.216 0.329 2.037 1.00 . B B . 6 LEU CD2 1 1 2 1186 2 2 6 LEU CG C 4.713 0.359 3.455 1.00 . B B . 6 LEU CG 1 1 2 1187 2 2 6 LEU H H 7.171 -1.323 2.609 1.00 . B B . 6 LEU H 1 1 2 1188 2 2 6 LEU HA H 7.121 -1.140 5.621 1.00 . B B . 6 LEU HA 1 1 2 1189 2 2 6 LEU HB2 H 5.465 0.578 5.425 1.00 . B B . 6 LEU HB2 1 1 2 1190 2 2 6 LEU HB3 H 6.628 0.958 4.189 1.00 . B B . 6 LEU HB3 1 1 2 1191 2 2 6 LEU HD11 H 3.793 1.928 4.610 1.00 . B B . 6 LEU HD11 1 1 2 1192 2 2 6 LEU HD12 H 4.916 2.495 3.398 1.00 . B B . 6 LEU HD12 1 1 2 1193 2 2 6 LEU HD13 H 3.335 1.904 2.913 1.00 . B B . 6 LEU HD13 1 1 2 1194 2 2 6 LEU HD21 H 5.915 1.132 1.867 1.00 . B B . 6 LEU HD21 1 1 2 1195 2 2 6 LEU HD22 H 5.709 -0.601 1.854 1.00 . B B . 6 LEU HD22 1 1 2 1196 2 2 6 LEU HD23 H 4.395 0.430 1.346 1.00 . B B . 6 LEU HD23 1 1 2 1197 2 2 6 LEU HG H 3.966 -0.406 3.615 1.00 . B B . 6 LEU HG 1 1 2 1198 2 2 6 LEU N N 7.483 -1.386 3.537 1.00 . B B . 6 LEU N 1 1 2 1199 2 2 6 LEU O O 4.808 -2.610 3.840 1.00 . B B . 6 LEU O 1 1 2 1200 2 2 7 CYS C C 3.240 -4.231 6.635 1.00 . B B . 7 CYS C 1 1 2 1201 2 2 7 CYS CA C 4.646 -4.262 5.977 1.00 . B B . 7 CYS CA 1 1 2 1202 2 2 7 CYS CB C 5.516 -5.349 6.648 1.00 . B B . 7 CYS CB 1 1 2 1203 2 2 7 CYS H H 6.170 -2.811 6.574 1.00 . B B . 7 CYS H 1 1 2 1204 2 2 7 CYS HA H 4.446 -4.618 4.979 1.00 . B B . 7 CYS HA 1 1 2 1205 2 2 7 CYS HB2 H 6.552 -5.183 6.381 1.00 . B B . 7 CYS HB2 1 1 2 1206 2 2 7 CYS HB3 H 5.439 -5.281 7.724 1.00 . B B . 7 CYS HB3 1 1 2 1207 2 2 7 CYS HG H 4.425 -7.374 6.745 1.00 . B B . 7 CYS HG 1 1 2 1208 2 2 7 CYS N N 5.562 -3.065 5.854 1.00 . B B . 7 CYS N 1 1 2 1209 2 2 7 CYS O O 2.296 -4.606 5.975 1.00 . B B . 7 CYS O 1 1 2 1210 2 2 7 CYS SG S 5.119 -7.049 6.167 1.00 . B B . 7 CYS SG 1 1 2 1211 2 2 8 GLY C C 1.158 -2.433 8.775 1.00 . B B . 8 GLY C 1 1 2 1212 2 2 8 GLY CA C 1.663 -3.817 8.451 1.00 . B B . 8 GLY CA 1 1 2 1213 2 2 8 GLY H H 3.833 -3.518 8.400 1.00 . B B . 8 GLY H 1 1 2 1214 2 2 8 GLY HA2 H 0.952 -4.253 7.768 1.00 . B B . 8 GLY HA2 1 1 2 1215 2 2 8 GLY HA3 H 1.665 -4.376 9.372 1.00 . B B . 8 GLY HA3 1 1 2 1216 2 2 8 GLY N N 3.069 -3.820 7.864 1.00 . B B . 8 GLY N 1 1 2 1217 2 2 8 GLY O O 0.497 -1.785 7.997 1.00 . B B . 8 GLY O 1 1 2 1218 2 2 9 ASP C C 1.593 0.428 9.509 1.00 . B B . 9 ASP C 1 1 2 1219 2 2 9 ASP CA C 1.147 -0.697 10.500 1.00 . B B . 9 ASP CA 1 1 2 1220 2 2 9 ASP CB C 1.884 -0.724 11.867 1.00 . B B . 9 ASP CB 1 1 2 1221 2 2 9 ASP CG C 3.391 -0.833 11.611 1.00 . B B . 9 ASP CG 1 1 2 1222 2 2 9 ASP H H 2.054 -2.600 10.510 1.00 . B B . 9 ASP H 1 1 2 1223 2 2 9 ASP HA H 0.057 -0.640 10.546 1.00 . B B . 9 ASP HA 1 1 2 1224 2 2 9 ASP HB2 H 1.713 0.186 12.421 1.00 . B B . 9 ASP HB2 1 1 2 1225 2 2 9 ASP HB3 H 1.601 -1.569 12.470 1.00 . B B . 9 ASP HB3 1 1 2 1226 2 2 9 ASP N N 1.505 -2.022 9.938 1.00 . B B . 9 ASP N 1 1 2 1227 2 2 9 ASP O O 0.829 1.233 9.015 1.00 . B B . 9 ASP O 1 1 2 1228 2 2 9 ASP OD1 O 3.798 -1.819 11.013 1.00 . B B . 9 ASP OD1 1 1 2 1229 2 2 9 ASP OD2 O 4.060 0.091 12.000 1.00 . B B . 9 ASP OD2 1 1 2 1230 2 2 10 HIS C C 2.647 1.380 6.961 1.00 . B B . 10 HIS C 1 1 2 1231 2 2 10 HIS CA C 3.431 1.450 8.298 1.00 . B B . 10 HIS CA 1 1 2 1232 2 2 10 HIS CB C 4.915 1.092 8.170 1.00 . B B . 10 HIS CB 1 1 2 1233 2 2 10 HIS CD2 C 5.236 3.291 6.721 1.00 . B B . 10 HIS CD2 1 1 2 1234 2 2 10 HIS CE1 C 7.208 2.991 6.175 1.00 . B B . 10 HIS CE1 1 1 2 1235 2 2 10 HIS CG C 5.646 2.102 7.292 1.00 . B B . 10 HIS CG 1 1 2 1236 2 2 10 HIS H H 3.405 -0.254 9.671 1.00 . B B . 10 HIS H 1 1 2 1237 2 2 10 HIS HA H 3.290 2.439 8.720 1.00 . B B . 10 HIS HA 1 1 2 1238 2 2 10 HIS HB2 H 5.349 1.102 9.160 1.00 . B B . 10 HIS HB2 1 1 2 1239 2 2 10 HIS HB3 H 5.013 0.105 7.746 1.00 . B B . 10 HIS HB3 1 1 2 1240 2 2 10 HIS HD1 H 7.460 1.233 7.158 1.00 . B B . 10 HIS HD1 1 1 2 1241 2 2 10 HIS HD2 H 4.251 3.722 6.826 1.00 . B B . 10 HIS HD2 1 1 2 1242 2 2 10 HIS HE1 H 8.181 3.138 5.719 1.00 . B B . 10 HIS HE1 1 1 2 1243 2 2 10 HIS N N 2.859 0.436 9.233 1.00 . B B . 10 HIS N 1 1 2 1244 2 2 10 HIS ND1 N 6.872 1.980 6.916 1.00 . B B . 10 HIS ND1 1 1 2 1245 2 2 10 HIS NE2 N 6.217 3.831 6.029 1.00 . B B . 10 HIS NE2 1 1 2 1246 2 2 10 HIS O O 2.250 2.369 6.381 1.00 . B B . 10 HIS O 1 1 2 1247 2 2 11 LEU C C 0.268 0.584 5.326 1.00 . B B . 11 LEU C 1 1 2 1248 2 2 11 LEU CA C 1.685 -0.031 5.227 1.00 . B B . 11 LEU CA 1 1 2 1249 2 2 11 LEU CB C 1.669 -1.552 4.981 1.00 . B B . 11 LEU CB 1 1 2 1250 2 2 11 LEU CD1 C 1.624 -1.291 2.485 1.00 . B B . 11 LEU CD1 1 1 2 1251 2 2 11 LEU CD2 C 0.938 -3.402 3.574 1.00 . B B . 11 LEU CD2 1 1 2 1252 2 2 11 LEU CG C 0.900 -1.891 3.702 1.00 . B B . 11 LEU CG 1 1 2 1253 2 2 11 LEU H H 2.768 -0.575 7.029 1.00 . B B . 11 LEU H 1 1 2 1254 2 2 11 LEU HA H 2.187 0.487 4.429 1.00 . B B . 11 LEU HA 1 1 2 1255 2 2 11 LEU HB2 H 2.682 -1.911 4.875 1.00 . B B . 11 LEU HB2 1 1 2 1256 2 2 11 LEU HB3 H 1.217 -2.067 5.815 1.00 . B B . 11 LEU HB3 1 1 2 1257 2 2 11 LEU HD11 H 2.629 -1.685 2.421 1.00 . B B . 11 LEU HD11 1 1 2 1258 2 2 11 LEU HD12 H 1.101 -1.538 1.577 1.00 . B B . 11 LEU HD12 1 1 2 1259 2 2 11 LEU HD13 H 1.678 -0.214 2.554 1.00 . B B . 11 LEU HD13 1 1 2 1260 2 2 11 LEU HD21 H 0.492 -3.856 4.447 1.00 . B B . 11 LEU HD21 1 1 2 1261 2 2 11 LEU HD22 H 0.399 -3.737 2.707 1.00 . B B . 11 LEU HD22 1 1 2 1262 2 2 11 LEU HD23 H 1.962 -3.743 3.501 1.00 . B B . 11 LEU HD23 1 1 2 1263 2 2 11 LEU HG H -0.122 -1.535 3.770 1.00 . B B . 11 LEU HG 1 1 2 1264 2 2 11 LEU N N 2.435 0.178 6.507 1.00 . B B . 11 LEU N 1 1 2 1265 2 2 11 LEU O O -0.115 1.414 4.528 1.00 . B B . 11 LEU O 1 1 2 1266 2 2 12 VAL C C -1.803 2.309 6.553 1.00 . B B . 12 VAL C 1 1 2 1267 2 2 12 VAL CA C -1.881 0.780 6.407 1.00 . B B . 12 VAL CA 1 1 2 1268 2 2 12 VAL CB C -2.611 0.182 7.616 1.00 . B B . 12 VAL CB 1 1 2 1269 2 2 12 VAL CG1 C -1.852 0.463 8.894 1.00 . B B . 12 VAL CG1 1 1 2 1270 2 2 12 VAL CG2 C -3.965 0.909 7.703 1.00 . B B . 12 VAL CG2 1 1 2 1271 2 2 12 VAL H H -0.177 -0.484 6.919 1.00 . B B . 12 VAL H 1 1 2 1272 2 2 12 VAL HA H -2.429 0.576 5.502 1.00 . B B . 12 VAL HA 1 1 2 1273 2 2 12 VAL HB H -2.681 -0.892 7.479 1.00 . B B . 12 VAL HB 1 1 2 1274 2 2 12 VAL HG11 H -1.695 1.521 9.070 1.00 . B B . 12 VAL HG11 1 1 2 1275 2 2 12 VAL HG12 H -2.347 0.046 9.749 1.00 . B B . 12 VAL HG12 1 1 2 1276 2 2 12 VAL HG13 H -0.894 -0.013 8.788 1.00 . B B . 12 VAL HG13 1 1 2 1277 2 2 12 VAL HG21 H -4.503 0.790 6.773 1.00 . B B . 12 VAL HG21 1 1 2 1278 2 2 12 VAL HG22 H -4.551 0.526 8.519 1.00 . B B . 12 VAL HG22 1 1 2 1279 2 2 12 VAL HG23 H -3.808 1.970 7.865 1.00 . B B . 12 VAL HG23 1 1 2 1280 2 2 12 VAL N N -0.508 0.188 6.292 1.00 . B B . 12 VAL N 1 1 2 1281 2 2 12 VAL O O -2.573 3.004 5.926 1.00 . B B . 12 VAL O 1 1 2 1282 2 2 13 GLU C C -0.586 4.853 6.168 1.00 . B B . 13 GLU C 1 1 2 1283 2 2 13 GLU CA C -0.735 4.259 7.584 1.00 . B B . 13 GLU CA 1 1 2 1284 2 2 13 GLU CB C 0.494 4.313 8.485 1.00 . B B . 13 GLU CB 1 1 2 1285 2 2 13 GLU CD C 0.055 6.672 9.375 1.00 . B B . 13 GLU CD 1 1 2 1286 2 2 13 GLU CG C 1.009 5.741 8.629 1.00 . B B . 13 GLU CG 1 1 2 1287 2 2 13 GLU H H -0.309 2.225 7.887 1.00 . B B . 13 GLU H 1 1 2 1288 2 2 13 GLU HA H -1.604 4.701 8.053 1.00 . B B . 13 GLU HA 1 1 2 1289 2 2 13 GLU HB2 H 0.223 3.937 9.463 1.00 . B B . 13 GLU HB2 1 1 2 1290 2 2 13 GLU HB3 H 1.279 3.683 8.098 1.00 . B B . 13 GLU HB3 1 1 2 1291 2 2 13 GLU HG2 H 1.938 5.705 9.169 1.00 . B B . 13 GLU HG2 1 1 2 1292 2 2 13 GLU HG3 H 1.161 6.155 7.649 1.00 . B B . 13 GLU HG3 1 1 2 1293 2 2 13 GLU N N -0.912 2.796 7.371 1.00 . B B . 13 GLU N 1 1 2 1294 2 2 13 GLU O O -1.238 5.786 5.727 1.00 . B B . 13 GLU O 1 1 2 1295 2 2 13 GLU OE1 O -0.978 6.965 8.802 1.00 . B B . 13 GLU OE1 1 1 2 1296 2 2 13 GLU OE2 O 0.434 7.023 10.476 1.00 . B B . 13 GLU OE2 1 1 2 1297 2 2 14 ALA C C -0.788 4.701 3.308 1.00 . B B . 14 ALA C 1 1 2 1298 2 2 14 ALA CA C 0.550 4.705 4.061 1.00 . B B . 14 ALA CA 1 1 2 1299 2 2 14 ALA CB C 1.609 3.765 3.432 1.00 . B B . 14 ALA CB 1 1 2 1300 2 2 14 ALA H H 0.818 3.494 5.814 1.00 . B B . 14 ALA H 1 1 2 1301 2 2 14 ALA HA H 0.817 5.719 4.198 1.00 . B B . 14 ALA HA 1 1 2 1302 2 2 14 ALA HB1 H 2.512 3.804 4.023 1.00 . B B . 14 ALA HB1 1 1 2 1303 2 2 14 ALA HB2 H 1.261 2.745 3.411 1.00 . B B . 14 ALA HB2 1 1 2 1304 2 2 14 ALA HB3 H 1.834 4.071 2.422 1.00 . B B . 14 ALA HB3 1 1 2 1305 2 2 14 ALA N N 0.314 4.240 5.440 1.00 . B B . 14 ALA N 1 1 2 1306 2 2 14 ALA O O -1.129 5.644 2.621 1.00 . B B . 14 ALA O 1 1 2 1307 2 2 15 LEU C C -3.629 4.850 3.213 1.00 . B B . 15 LEU C 1 1 2 1308 2 2 15 LEU CA C -2.843 3.580 2.754 1.00 . B B . 15 LEU CA 1 1 2 1309 2 2 15 LEU CB C -3.617 2.273 3.148 1.00 . B B . 15 LEU CB 1 1 2 1310 2 2 15 LEU CD1 C -3.751 -0.188 3.121 1.00 . B B . 15 LEU CD1 1 1 2 1311 2 2 15 LEU CD2 C -2.735 0.941 1.191 1.00 . B B . 15 LEU CD2 1 1 2 1312 2 2 15 LEU CG C -2.873 0.997 2.716 1.00 . B B . 15 LEU CG 1 1 2 1313 2 2 15 LEU H H -1.153 2.906 3.998 1.00 . B B . 15 LEU H 1 1 2 1314 2 2 15 LEU HA H -2.692 3.634 1.692 1.00 . B B . 15 LEU HA 1 1 2 1315 2 2 15 LEU HB2 H -3.775 2.243 4.215 1.00 . B B . 15 LEU HB2 1 1 2 1316 2 2 15 LEU HB3 H -4.587 2.289 2.677 1.00 . B B . 15 LEU HB3 1 1 2 1317 2 2 15 LEU HD11 H -3.926 -0.188 4.186 1.00 . B B . 15 LEU HD11 1 1 2 1318 2 2 15 LEU HD12 H -4.705 -0.148 2.618 1.00 . B B . 15 LEU HD12 1 1 2 1319 2 2 15 LEU HD13 H -3.269 -1.118 2.864 1.00 . B B . 15 LEU HD13 1 1 2 1320 2 2 15 LEU HD21 H -3.702 0.941 0.715 1.00 . B B . 15 LEU HD21 1 1 2 1321 2 2 15 LEU HD22 H -2.167 1.781 0.818 1.00 . B B . 15 LEU HD22 1 1 2 1322 2 2 15 LEU HD23 H -2.213 0.041 0.903 1.00 . B B . 15 LEU HD23 1 1 2 1323 2 2 15 LEU HG H -1.899 0.936 3.188 1.00 . B B . 15 LEU HG 1 1 2 1324 2 2 15 LEU N N -1.518 3.631 3.447 1.00 . B B . 15 LEU N 1 1 2 1325 2 2 15 LEU O O -3.991 5.654 2.386 1.00 . B B . 15 LEU O 1 1 2 1326 2 2 16 TYR C C -4.349 7.503 4.318 1.00 . B B . 16 TYR C 1 1 2 1327 2 2 16 TYR CA C -4.606 6.174 5.075 1.00 . B B . 16 TYR CA 1 1 2 1328 2 2 16 TYR CB C -4.196 6.289 6.586 1.00 . B B . 16 TYR CB 1 1 2 1329 2 2 16 TYR CD1 C -4.578 8.753 7.021 1.00 . B B . 16 TYR CD1 1 1 2 1330 2 2 16 TYR CD2 C -6.080 7.214 8.025 1.00 . B B . 16 TYR CD2 1 1 2 1331 2 2 16 TYR CE1 C -5.277 9.804 7.583 1.00 . B B . 16 TYR CE1 1 1 2 1332 2 2 16 TYR CE2 C -6.776 8.274 8.585 1.00 . B B . 16 TYR CE2 1 1 2 1333 2 2 16 TYR CG C -4.973 7.448 7.236 1.00 . B B . 16 TYR CG 1 1 2 1334 2 2 16 TYR CZ C -6.376 9.564 8.363 1.00 . B B . 16 TYR CZ 1 1 2 1335 2 2 16 TYR H H -3.497 4.297 5.070 1.00 . B B . 16 TYR H 1 1 2 1336 2 2 16 TYR HA H -5.667 5.990 5.008 1.00 . B B . 16 TYR HA 1 1 2 1337 2 2 16 TYR HB2 H -4.404 5.374 7.120 1.00 . B B . 16 TYR HB2 1 1 2 1338 2 2 16 TYR HB3 H -3.141 6.500 6.698 1.00 . B B . 16 TYR HB3 1 1 2 1339 2 2 16 TYR HD1 H -3.707 8.945 6.411 1.00 . B B . 16 TYR HD1 1 1 2 1340 2 2 16 TYR HD2 H -6.399 6.200 8.208 1.00 . B B . 16 TYR HD2 1 1 2 1341 2 2 16 TYR HE1 H -4.962 10.820 7.414 1.00 . B B . 16 TYR HE1 1 1 2 1342 2 2 16 TYR HE2 H -7.641 8.107 9.205 1.00 . B B . 16 TYR HE2 1 1 2 1343 2 2 16 TYR HH H -7.341 11.157 8.167 1.00 . B B . 16 TYR HH 1 1 2 1344 2 2 16 TYR N N -3.858 4.996 4.491 1.00 . B B . 16 TYR N 1 1 2 1345 2 2 16 TYR O O -5.270 8.192 3.927 1.00 . B B . 16 TYR O 1 1 2 1346 2 2 16 TYR OH O -7.076 10.611 8.909 1.00 . B B . 16 TYR OH 1 1 2 1347 2 2 17 LEU C C -2.672 8.966 1.865 1.00 . B B . 17 LEU C 1 1 2 1348 2 2 17 LEU CA C -2.711 9.073 3.420 1.00 . B B . 17 LEU CA 1 1 2 1349 2 2 17 LEU CB C -1.341 9.510 4.052 1.00 . B B . 17 LEU CB 1 1 2 1350 2 2 17 LEU CD1 C 0.507 8.628 2.568 1.00 . B B . 17 LEU CD1 1 1 2 1351 2 2 17 LEU CD2 C 0.800 8.726 5.020 1.00 . B B . 17 LEU CD2 1 1 2 1352 2 2 17 LEU CG C -0.212 8.471 3.909 1.00 . B B . 17 LEU CG 1 1 2 1353 2 2 17 LEU H H -2.431 7.184 4.510 1.00 . B B . 17 LEU H 1 1 2 1354 2 2 17 LEU HA H -3.449 9.832 3.638 1.00 . B B . 17 LEU HA 1 1 2 1355 2 2 17 LEU HB2 H -1.033 10.445 3.606 1.00 . B B . 17 LEU HB2 1 1 2 1356 2 2 17 LEU HB3 H -1.514 9.688 5.104 1.00 . B B . 17 LEU HB3 1 1 2 1357 2 2 17 LEU HD11 H 0.939 9.614 2.490 1.00 . B B . 17 LEU HD11 1 1 2 1358 2 2 17 LEU HD12 H 1.296 7.896 2.496 1.00 . B B . 17 LEU HD12 1 1 2 1359 2 2 17 LEU HD13 H -0.165 8.482 1.739 1.00 . B B . 17 LEU HD13 1 1 2 1360 2 2 17 LEU HD21 H 1.196 9.728 4.963 1.00 . B B . 17 LEU HD21 1 1 2 1361 2 2 17 LEU HD22 H 0.324 8.594 5.985 1.00 . B B . 17 LEU HD22 1 1 2 1362 2 2 17 LEU HD23 H 1.615 8.022 4.962 1.00 . B B . 17 LEU HD23 1 1 2 1363 2 2 17 LEU HG H -0.609 7.469 4.017 1.00 . B B . 17 LEU HG 1 1 2 1364 2 2 17 LEU N N -3.095 7.809 4.142 1.00 . B B . 17 LEU N 1 1 2 1365 2 2 17 LEU O O -2.898 9.950 1.188 1.00 . B B . 17 LEU O 1 1 2 1366 2 2 18 VAL C C -3.838 7.603 -0.748 1.00 . B B . 18 VAL C 1 1 2 1367 2 2 18 VAL CA C -2.357 7.683 -0.200 1.00 . B B . 18 VAL CA 1 1 2 1368 2 2 18 VAL CB C -1.508 6.414 -0.512 1.00 . B B . 18 VAL CB 1 1 2 1369 2 2 18 VAL CG1 C -2.367 5.179 -0.516 1.00 . B B . 18 VAL CG1 1 1 2 1370 2 2 18 VAL CG2 C -0.841 6.565 -1.881 1.00 . B B . 18 VAL CG2 1 1 2 1371 2 2 18 VAL H H -2.180 7.049 1.887 1.00 . B B . 18 VAL H 1 1 2 1372 2 2 18 VAL HA H -1.884 8.541 -0.650 1.00 . B B . 18 VAL HA 1 1 2 1373 2 2 18 VAL HB H -0.743 6.316 0.253 1.00 . B B . 18 VAL HB 1 1 2 1374 2 2 18 VAL HG11 H -2.857 5.087 0.434 1.00 . B B . 18 VAL HG11 1 1 2 1375 2 2 18 VAL HG12 H -3.116 5.313 -1.276 1.00 . B B . 18 VAL HG12 1 1 2 1376 2 2 18 VAL HG13 H -1.792 4.291 -0.722 1.00 . B B . 18 VAL HG13 1 1 2 1377 2 2 18 VAL HG21 H -1.574 6.737 -2.656 1.00 . B B . 18 VAL HG21 1 1 2 1378 2 2 18 VAL HG22 H -0.181 7.418 -1.873 1.00 . B B . 18 VAL HG22 1 1 2 1379 2 2 18 VAL HG23 H -0.275 5.684 -2.141 1.00 . B B . 18 VAL HG23 1 1 2 1380 2 2 18 VAL N N -2.388 7.816 1.310 1.00 . B B . 18 VAL N 1 1 2 1381 2 2 18 VAL O O -4.167 8.126 -1.789 1.00 . B B . 18 VAL O 1 1 2 1382 2 2 19 CYS C C -7.107 7.269 -1.377 1.00 . B B . 19 CYS C 1 1 2 1383 2 2 19 CYS CA C -6.162 6.693 -0.260 1.00 . B B . 19 CYS CA 1 1 2 1384 2 2 19 CYS CB C -6.749 6.975 1.167 1.00 . B B . 19 CYS CB 1 1 2 1385 2 2 19 CYS H H -4.402 6.514 0.826 1.00 . B B . 19 CYS H 1 1 2 1386 2 2 19 CYS HA H -6.182 5.677 -0.592 1.00 . B B . 19 CYS HA 1 1 2 1387 2 2 19 CYS HB2 H -6.103 7.727 1.593 1.00 . B B . 19 CYS HB2 1 1 2 1388 2 2 19 CYS HB3 H -7.713 7.437 1.102 1.00 . B B . 19 CYS HB3 1 1 2 1389 2 2 19 CYS HG H -6.014 5.832 3.003 1.00 . B B . 19 CYS HG 1 1 2 1390 2 2 19 CYS N N -4.687 6.933 -0.013 1.00 . B B . 19 CYS N 1 1 2 1391 2 2 19 CYS O O -8.283 7.395 -1.092 1.00 . B B . 19 CYS O 1 1 2 1392 2 2 19 CYS SG S -6.790 5.703 2.453 1.00 . B B . 19 CYS SG 1 1 2 1393 2 2 20 GLY C C -9.143 7.827 -3.535 1.00 . B B . 20 GLY C 1 1 2 1394 2 2 20 GLY CA C -7.621 8.142 -3.645 1.00 . B B . 20 GLY CA 1 1 2 1395 2 2 20 GLY H H -5.722 7.482 -2.765 1.00 . B B . 20 GLY H 1 1 2 1396 2 2 20 GLY HA2 H -7.525 9.215 -3.674 1.00 . B B . 20 GLY HA2 1 1 2 1397 2 2 20 GLY HA3 H -7.297 7.762 -4.605 1.00 . B B . 20 GLY HA3 1 1 2 1398 2 2 20 GLY N N -6.681 7.593 -2.567 1.00 . B B . 20 GLY N 1 1 2 1399 2 2 20 GLY O O -9.984 8.701 -3.579 1.00 . B B . 20 GLY O 1 1 2 1400 2 2 21 GLU C C -10.998 5.173 -1.954 1.00 . B B . 21 GLU C 1 1 2 1401 2 2 21 GLU CA C -10.830 5.981 -3.265 1.00 . B B . 21 GLU CA 1 1 2 1402 2 2 21 GLU CB C -11.061 4.994 -4.339 1.00 . B B . 21 GLU CB 1 1 2 1403 2 2 21 GLU CD C -10.425 4.221 -6.648 1.00 . B B . 21 GLU CD 1 1 2 1404 2 2 21 GLU CG C -10.594 5.446 -5.758 1.00 . B B . 21 GLU CG 1 1 2 1405 2 2 21 GLU H H -8.645 5.977 -3.361 1.00 . B B . 21 GLU H 1 1 2 1406 2 2 21 GLU HA H -11.571 6.768 -3.291 1.00 . B B . 21 GLU HA 1 1 2 1407 2 2 21 GLU HB2 H -10.499 4.125 -4.033 1.00 . B B . 21 GLU HB2 1 1 2 1408 2 2 21 GLU HB3 H -12.098 4.704 -4.276 1.00 . B B . 21 GLU HB3 1 1 2 1409 2 2 21 GLU HG2 H -11.334 6.068 -6.231 1.00 . B B . 21 GLU HG2 1 1 2 1410 2 2 21 GLU HG3 H -9.654 5.975 -5.740 1.00 . B B . 21 GLU HG3 1 1 2 1411 2 2 21 GLU N N -9.424 6.563 -3.389 1.00 . B B . 21 GLU N 1 1 2 1412 2 2 21 GLU O O -11.699 4.181 -1.886 1.00 . B B . 21 GLU O 1 1 2 1413 2 2 21 GLU OE1 O -11.437 3.651 -6.995 1.00 . B B . 21 GLU OE1 1 1 2 1414 2 2 21 GLU OE2 O -9.272 3.935 -6.912 1.00 . B B . 21 GLU OE2 1 1 2 1415 2 2 22 ARG C C -11.664 3.949 0.868 1.00 . B B . 22 ARG C 1 1 2 1416 2 2 22 ARG CA C -10.455 4.837 0.376 1.00 . B B . 22 ARG CA 1 1 2 1417 2 2 22 ARG CB C -10.070 5.875 1.437 1.00 . B B . 22 ARG CB 1 1 2 1418 2 2 22 ARG CD C -9.513 3.859 2.851 1.00 . B B . 22 ARG CD 1 1 2 1419 2 2 22 ARG CG C -10.136 5.268 2.861 1.00 . B B . 22 ARG CG 1 1 2 1420 2 2 22 ARG CZ C -10.881 2.293 4.013 1.00 . B B . 22 ARG CZ 1 1 2 1421 2 2 22 ARG H H -9.860 6.406 -0.956 1.00 . B B . 22 ARG H 1 1 2 1422 2 2 22 ARG HA H -9.730 4.078 0.215 1.00 . B B . 22 ARG HA 1 1 2 1423 2 2 22 ARG HB2 H -9.054 6.132 1.207 1.00 . B B . 22 ARG HB2 1 1 2 1424 2 2 22 ARG HB3 H -10.687 6.755 1.330 1.00 . B B . 22 ARG HB3 1 1 2 1425 2 2 22 ARG HD2 H -9.799 3.254 1.995 1.00 . B B . 22 ARG HD2 1 1 2 1426 2 2 22 ARG HD3 H -8.435 3.918 2.787 1.00 . B B . 22 ARG HD3 1 1 2 1427 2 2 22 ARG HE H -9.757 3.516 5.005 1.00 . B B . 22 ARG HE 1 1 2 1428 2 2 22 ARG HG2 H -9.566 5.902 3.528 1.00 . B B . 22 ARG HG2 1 1 2 1429 2 2 22 ARG HG3 H -11.156 5.257 3.220 1.00 . B B . 22 ARG HG3 1 1 2 1430 2 2 22 ARG HH11 H -12.194 3.493 3.247 1.00 . B B . 22 ARG HH11 1 1 2 1431 2 2 22 ARG HH12 H -12.676 1.835 3.440 1.00 . B B . 22 ARG HH12 1 1 2 1432 2 2 22 ARG HH21 H -9.682 0.962 4.760 1.00 . B B . 22 ARG HH21 1 1 2 1433 2 2 22 ARG HH22 H -11.245 0.414 4.267 1.00 . B B . 22 ARG HH22 1 1 2 1434 2 2 22 ARG N N -10.369 5.583 -0.921 1.00 . B B . 22 ARG N 1 1 2 1435 2 2 22 ARG NE N -10.035 3.230 4.114 1.00 . B B . 22 ARG NE 1 1 2 1436 2 2 22 ARG NH1 N -12.004 2.556 3.534 1.00 . B B . 22 ARG NH1 1 1 2 1437 2 2 22 ARG NH2 N -10.579 1.145 4.379 1.00 . B B . 22 ARG NH2 1 1 2 1438 2 2 22 ARG O O -12.581 4.318 1.577 1.00 . B B . 22 ARG O 1 1 2 1439 2 2 23 GLY C C -11.753 0.423 1.464 1.00 . B B . 23 GLY C 1 1 2 1440 2 2 23 GLY CA C -12.496 1.578 0.726 1.00 . B B . 23 GLY CA 1 1 2 1441 2 2 23 GLY H H -10.743 2.551 -0.117 1.00 . B B . 23 GLY H 1 1 2 1442 2 2 23 GLY HA2 H -13.325 1.916 1.328 1.00 . B B . 23 GLY HA2 1 1 2 1443 2 2 23 GLY HA3 H -12.872 1.189 -0.209 1.00 . B B . 23 GLY HA3 1 1 2 1444 2 2 23 GLY N N -11.537 2.718 0.442 1.00 . B B . 23 GLY N 1 1 2 1445 2 2 23 GLY O O -12.097 0.081 2.582 1.00 . B B . 23 GLY O 1 1 2 1446 2 2 24 PHE C C -9.921 -2.311 -0.054 1.00 . B B . 24 PHE C 1 1 2 1447 2 2 24 PHE CA C -9.755 -1.171 0.989 1.00 . B B . 24 PHE CA 1 1 2 1448 2 2 24 PHE CB C -9.873 -1.759 2.455 1.00 . B B . 24 PHE CB 1 1 2 1449 2 2 24 PHE CD1 C -8.243 0.145 3.174 1.00 . B B . 24 PHE CD1 1 1 2 1450 2 2 24 PHE CD2 C -9.134 -1.305 4.824 1.00 . B B . 24 PHE CD2 1 1 2 1451 2 2 24 PHE CE1 C -7.540 0.830 4.146 1.00 . B B . 24 PHE CE1 1 1 2 1452 2 2 24 PHE CE2 C -8.433 -0.623 5.798 1.00 . B B . 24 PHE CE2 1 1 2 1453 2 2 24 PHE CG C -9.057 -0.940 3.495 1.00 . B B . 24 PHE CG 1 1 2 1454 2 2 24 PHE CZ C -7.636 0.445 5.462 1.00 . B B . 24 PHE CZ 1 1 2 1455 2 2 24 PHE H H -10.689 0.395 -0.101 1.00 . B B . 24 PHE H 1 1 2 1456 2 2 24 PHE HA H -8.768 -0.781 0.823 1.00 . B B . 24 PHE HA 1 1 2 1457 2 2 24 PHE HB2 H -10.903 -1.816 2.765 1.00 . B B . 24 PHE HB2 1 1 2 1458 2 2 24 PHE HB3 H -9.491 -2.772 2.464 1.00 . B B . 24 PHE HB3 1 1 2 1459 2 2 24 PHE HD1 H -8.143 0.476 2.152 1.00 . B B . 24 PHE HD1 1 1 2 1460 2 2 24 PHE HD2 H -9.746 -2.151 5.110 1.00 . B B . 24 PHE HD2 1 1 2 1461 2 2 24 PHE HE1 H -6.911 1.669 3.870 1.00 . B B . 24 PHE HE1 1 1 2 1462 2 2 24 PHE HE2 H -8.512 -0.935 6.834 1.00 . B B . 24 PHE HE2 1 1 2 1463 2 2 24 PHE HZ H -7.084 0.975 6.228 1.00 . B B . 24 PHE HZ 1 1 2 1464 2 2 24 PHE N N -10.770 -0.063 0.753 1.00 . B B . 24 PHE N 1 1 2 1465 2 2 24 PHE O O -10.448 -3.375 0.197 1.00 . B B . 24 PHE O 1 1 2 1466 2 2 25 PHE C C -8.335 -4.044 -2.416 1.00 . B B . 25 PHE C 1 1 2 1467 2 2 25 PHE CA C -9.513 -3.025 -2.372 1.00 . B B . 25 PHE CA 1 1 2 1468 2 2 25 PHE CB C -9.565 -2.220 -3.711 1.00 . B B . 25 PHE CB 1 1 2 1469 2 2 25 PHE CD1 C -11.864 -1.292 -3.043 1.00 . B B . 25 PHE CD1 1 1 2 1470 2 2 25 PHE CD2 C -10.625 -0.195 -4.747 1.00 . B B . 25 PHE CD2 1 1 2 1471 2 2 25 PHE CE1 C -12.880 -0.369 -3.192 1.00 . B B . 25 PHE CE1 1 1 2 1472 2 2 25 PHE CE2 C -11.637 0.731 -4.899 1.00 . B B . 25 PHE CE2 1 1 2 1473 2 2 25 PHE CG C -10.725 -1.215 -3.820 1.00 . B B . 25 PHE CG 1 1 2 1474 2 2 25 PHE CZ C -12.766 0.642 -4.121 1.00 . B B . 25 PHE CZ 1 1 2 1475 2 2 25 PHE H H -9.006 -1.167 -1.363 1.00 . B B . 25 PHE H 1 1 2 1476 2 2 25 PHE HA H -10.417 -3.610 -2.274 1.00 . B B . 25 PHE HA 1 1 2 1477 2 2 25 PHE HB2 H -8.642 -1.670 -3.817 1.00 . B B . 25 PHE HB2 1 1 2 1478 2 2 25 PHE HB3 H -9.634 -2.902 -4.546 1.00 . B B . 25 PHE HB3 1 1 2 1479 2 2 25 PHE HD1 H -11.965 -2.081 -2.313 1.00 . B B . 25 PHE HD1 1 1 2 1480 2 2 25 PHE HD2 H -9.742 -0.114 -5.364 1.00 . B B . 25 PHE HD2 1 1 2 1481 2 2 25 PHE HE1 H -13.767 -0.436 -2.577 1.00 . B B . 25 PHE HE1 1 1 2 1482 2 2 25 PHE HE2 H -11.543 1.527 -5.635 1.00 . B B . 25 PHE HE2 1 1 2 1483 2 2 25 PHE HZ H -13.555 1.371 -4.244 1.00 . B B . 25 PHE HZ 1 1 2 1484 2 2 25 PHE N N -9.434 -2.039 -1.234 1.00 . B B . 25 PHE N 1 1 2 1485 2 2 25 PHE O O -7.595 -4.145 -3.378 1.00 . B B . 25 PHE O 1 1 2 1486 2 2 26 TYR C C -7.459 -7.173 -0.681 1.00 . B B . 26 TYR C 1 1 2 1487 2 2 26 TYR CA C -7.064 -5.808 -1.308 1.00 . B B . 26 TYR CA 1 1 2 1488 2 2 26 TYR CB C -5.882 -5.138 -0.544 1.00 . B B . 26 TYR CB 1 1 2 1489 2 2 26 TYR CD1 C -6.573 -5.586 1.872 1.00 . B B . 26 TYR CD1 1 1 2 1490 2 2 26 TYR CD2 C -6.264 -3.334 1.188 1.00 . B B . 26 TYR CD2 1 1 2 1491 2 2 26 TYR CE1 C -6.888 -5.145 3.145 1.00 . B B . 26 TYR CE1 1 1 2 1492 2 2 26 TYR CE2 C -6.579 -2.906 2.463 1.00 . B B . 26 TYR CE2 1 1 2 1493 2 2 26 TYR CG C -6.256 -4.679 0.878 1.00 . B B . 26 TYR CG 1 1 2 1494 2 2 26 TYR CZ C -6.891 -3.813 3.443 1.00 . B B . 26 TYR CZ 1 1 2 1495 2 2 26 TYR H H -8.787 -4.663 -0.600 1.00 . B B . 26 TYR H 1 1 2 1496 2 2 26 TYR HA H -6.751 -6.026 -2.320 1.00 . B B . 26 TYR HA 1 1 2 1497 2 2 26 TYR HB2 H -5.042 -5.811 -0.471 1.00 . B B . 26 TYR HB2 1 1 2 1498 2 2 26 TYR HB3 H -5.569 -4.277 -1.114 1.00 . B B . 26 TYR HB3 1 1 2 1499 2 2 26 TYR HD1 H -6.580 -6.647 1.664 1.00 . B B . 26 TYR HD1 1 1 2 1500 2 2 26 TYR HD2 H -6.029 -2.605 0.428 1.00 . B B . 26 TYR HD2 1 1 2 1501 2 2 26 TYR HE1 H -7.142 -5.841 3.929 1.00 . B B . 26 TYR HE1 1 1 2 1502 2 2 26 TYR HE2 H -6.582 -1.856 2.699 1.00 . B B . 26 TYR HE2 1 1 2 1503 2 2 26 TYR HH H -7.166 -2.441 4.714 1.00 . B B . 26 TYR HH 1 1 2 1504 2 2 26 TYR N N -8.172 -4.787 -1.357 1.00 . B B . 26 TYR N 1 1 2 1505 2 2 26 TYR O O -8.480 -7.307 -0.043 1.00 . B B . 26 TYR O 1 1 2 1506 2 2 26 TYR OH O -7.197 -3.402 4.718 1.00 . B B . 26 TYR OH 1 1 2 1507 2 2 27 THR C C -5.797 -10.201 0.497 1.00 . B B . 27 THR C 1 1 2 1508 2 2 27 THR CA C -6.953 -9.542 -0.295 1.00 . B B . 27 THR CA 1 1 2 1509 2 2 27 THR CB C -7.386 -10.502 -1.438 1.00 . B B . 27 THR CB 1 1 2 1510 2 2 27 THR CG2 C -6.315 -10.782 -2.461 1.00 . B B . 27 THR CG2 1 1 2 1511 2 2 27 THR H H -5.836 -8.023 -1.402 1.00 . B B . 27 THR H 1 1 2 1512 2 2 27 THR HA H -7.795 -9.451 0.369 1.00 . B B . 27 THR HA 1 1 2 1513 2 2 27 THR HB H -8.334 -10.206 -1.877 1.00 . B B . 27 THR HB 1 1 2 1514 2 2 27 THR HG1 H -8.265 -12.216 -1.168 1.00 . B B . 27 THR HG1 1 1 2 1515 2 2 27 THR HG21 H -5.468 -11.246 -1.989 1.00 . B B . 27 THR HG21 1 1 2 1516 2 2 27 THR HG22 H -6.709 -11.459 -3.204 1.00 . B B . 27 THR HG22 1 1 2 1517 2 2 27 THR HG23 H -6.006 -9.870 -2.949 1.00 . B B . 27 THR HG23 1 1 2 1518 2 2 27 THR N N -6.644 -8.174 -0.877 1.00 . B B . 27 THR N 1 1 2 1519 2 2 27 THR O O -4.647 -10.135 0.086 1.00 . B B . 27 THR O 1 1 2 1520 2 2 27 THR OG1 O -7.470 -11.783 -0.836 1.00 . B B . 27 THR OG1 1 1 2 1521 2 2 28 PRO C C -3.941 -12.253 1.564 1.00 . B B . 28 PRO C 1 1 2 1522 2 2 28 PRO CA C -5.150 -11.703 2.338 1.00 . B B . 28 PRO CA 1 1 2 1523 2 2 28 PRO CB C -6.065 -12.800 2.917 1.00 . B B . 28 PRO CB 1 1 2 1524 2 2 28 PRO CD C -7.511 -11.046 2.164 1.00 . B B . 28 PRO CD 1 1 2 1525 2 2 28 PRO CG C -7.275 -11.970 3.365 1.00 . B B . 28 PRO CG 1 1 2 1526 2 2 28 PRO HA H -4.724 -11.156 3.141 1.00 . B B . 28 PRO HA 1 1 2 1527 2 2 28 PRO HB2 H -6.352 -13.529 2.171 1.00 . B B . 28 PRO HB2 1 1 2 1528 2 2 28 PRO HB3 H -5.600 -13.303 3.754 1.00 . B B . 28 PRO HB3 1 1 2 1529 2 2 28 PRO HD2 H -8.136 -11.520 1.418 1.00 . B B . 28 PRO HD2 1 1 2 1530 2 2 28 PRO HD3 H -7.954 -10.106 2.473 1.00 . B B . 28 PRO HD3 1 1 2 1531 2 2 28 PRO HG2 H -8.138 -12.597 3.537 1.00 . B B . 28 PRO HG2 1 1 2 1532 2 2 28 PRO HG3 H -7.059 -11.398 4.258 1.00 . B B . 28 PRO HG3 1 1 2 1533 2 2 28 PRO N N -6.130 -10.811 1.620 1.00 . B B . 28 PRO N 1 1 2 1534 2 2 28 PRO O O -2.795 -11.935 1.814 1.00 . B B . 28 PRO O 1 1 2 1535 2 2 29 LYS C C -1.878 -13.975 0.380 1.00 . B B . 29 LYS C 1 1 2 1536 2 2 29 LYS CA C -3.273 -13.737 -0.299 1.00 . B B . 29 LYS CA 1 1 2 1537 2 2 29 LYS CB C -3.293 -12.808 -1.580 1.00 . B B . 29 LYS CB 1 1 2 1538 2 2 29 LYS CD C -0.903 -11.807 -2.178 1.00 . B B . 29 LYS CD 1 1 2 1539 2 2 29 LYS CE C -1.404 -10.458 -1.630 1.00 . B B . 29 LYS CE 1 1 2 1540 2 2 29 LYS CG C -2.056 -12.839 -2.541 1.00 . B B . 29 LYS CG 1 1 2 1541 2 2 29 LYS H H -5.245 -13.145 0.532 1.00 . B B . 29 LYS H 1 1 2 1542 2 2 29 LYS HA H -3.659 -14.712 -0.566 1.00 . B B . 29 LYS HA 1 1 2 1543 2 2 29 LYS HB2 H -4.135 -13.154 -2.167 1.00 . B B . 29 LYS HB2 1 1 2 1544 2 2 29 LYS HB3 H -3.547 -11.802 -1.297 1.00 . B B . 29 LYS HB3 1 1 2 1545 2 2 29 LYS HD2 H -0.156 -12.235 -1.528 1.00 . B B . 29 LYS HD2 1 1 2 1546 2 2 29 LYS HD3 H -0.384 -11.591 -3.101 1.00 . B B . 29 LYS HD3 1 1 2 1547 2 2 29 LYS HE2 H -0.604 -9.726 -1.671 1.00 . B B . 29 LYS HE2 1 1 2 1548 2 2 29 LYS HE3 H -2.216 -10.097 -2.253 1.00 . B B . 29 LYS HE3 1 1 2 1549 2 2 29 LYS HG2 H -1.636 -13.838 -2.546 1.00 . B B . 29 LYS HG2 1 1 2 1550 2 2 29 LYS HG3 H -2.396 -12.645 -3.552 1.00 . B B . 29 LYS HG3 1 1 2 1551 2 2 29 LYS HZ1 H -1.757 -11.656 0.074 1.00 . B B . 29 LYS HZ1 1 1 2 1552 2 2 29 LYS HZ2 H -1.360 -10.104 0.480 1.00 . B B . 29 LYS HZ2 1 1 2 1553 2 2 29 LYS HZ3 H -2.886 -10.459 -0.100 1.00 . B B . 29 LYS HZ3 1 1 2 1554 2 2 29 LYS N N -4.275 -13.054 0.605 1.00 . B B . 29 LYS N 1 1 2 1555 2 2 29 LYS NZ N -1.871 -10.661 -0.222 1.00 . B B . 29 LYS NZ 1 1 2 1556 2 2 29 LYS O O -0.923 -13.258 0.181 1.00 . B B . 29 LYS O 1 1 2 1557 2 2 30 THR C C 0.041 -16.721 1.520 1.00 . B B . 30 THR C 1 1 2 1558 2 2 30 THR CA C -0.563 -15.376 1.942 1.00 . B B . 30 THR CA 1 1 2 1559 2 2 30 THR CB C -0.870 -15.451 3.438 1.00 . B B . 30 THR CB 1 1 2 1560 2 2 30 THR CG2 C -1.563 -14.213 3.959 1.00 . B B . 30 THR CG2 1 1 2 1561 2 2 30 THR H H -2.628 -15.530 1.342 1.00 . B B . 30 THR H 1 1 2 1562 2 2 30 THR HA H 0.202 -14.630 1.791 1.00 . B B . 30 THR HA 1 1 2 1563 2 2 30 THR HB H -0.034 -15.792 4.045 1.00 . B B . 30 THR HB 1 1 2 1564 2 2 30 THR HG1 H -1.788 -17.002 4.167 1.00 . B B . 30 THR HG1 1 1 2 1565 2 2 30 THR HG21 H -0.947 -13.339 3.805 1.00 . B B . 30 THR HG21 1 1 2 1566 2 2 30 THR HG22 H -2.501 -14.067 3.447 1.00 . B B . 30 THR HG22 1 1 2 1567 2 2 30 THR HG23 H -1.761 -14.324 5.012 1.00 . B B . 30 THR HG23 1 1 2 1568 2 2 30 THR N N -1.825 -14.990 1.192 1.00 . B B . 30 THR N 1 1 2 1569 2 2 30 THR O O 1.044 -17.161 2.049 1.00 . B B . 30 THR O 1 1 2 1570 2 2 30 THR OG1 O -1.963 -16.356 3.475 1.00 . B B . 30 THR OG1 1 1 3 1571 1 1 1 GLY C C -1.651 -5.724 -2.049 1.00 . A A . 1 GLY C 1 1 3 1572 1 1 1 GLY CA C -2.824 -5.801 -3.007 1.00 . A A . 1 GLY CA 1 1 3 1573 1 1 1 GLY HA2 H -3.184 -6.817 -3.021 1.00 . A A . 1 GLY HA2 1 1 3 1574 1 1 1 GLY HA3 H -2.476 -5.531 -3.990 1.00 . A A . 1 GLY HA3 1 1 3 1575 1 1 1 GLY N N -3.914 -4.879 -2.559 1.00 . A A . 1 GLY N 1 1 3 1576 1 1 1 GLY O O -1.289 -6.727 -1.484 1.00 . A A . 1 GLY O 1 1 3 1577 1 1 2 ILE C C 1.009 -5.179 -0.306 1.00 . A A . 2 ILE C 1 1 3 1578 1 1 2 ILE CA C 0.054 -4.164 -1.022 1.00 . A A . 2 ILE CA 1 1 3 1579 1 1 2 ILE CB C -0.496 -3.194 0.081 1.00 . A A . 2 ILE CB 1 1 3 1580 1 1 2 ILE CD1 C -2.230 -2.990 1.935 1.00 . A A . 2 ILE CD1 1 1 3 1581 1 1 2 ILE CG1 C -1.850 -3.711 0.618 1.00 . A A . 2 ILE CG1 1 1 3 1582 1 1 2 ILE CG2 C -0.643 -1.783 -0.487 1.00 . A A . 2 ILE CG2 1 1 3 1583 1 1 2 ILE H H -1.556 -3.838 -2.440 1.00 . A A . 2 ILE H 1 1 3 1584 1 1 2 ILE HA H 0.713 -3.578 -1.637 1.00 . A A . 2 ILE HA 1 1 3 1585 1 1 2 ILE HB H 0.187 -3.149 0.917 1.00 . A A . 2 ILE HB 1 1 3 1586 1 1 2 ILE HD11 H -2.285 -1.921 1.806 1.00 . A A . 2 ILE HD11 1 1 3 1587 1 1 2 ILE HD12 H -3.187 -3.338 2.295 1.00 . A A . 2 ILE HD12 1 1 3 1588 1 1 2 ILE HD13 H -1.492 -3.195 2.697 1.00 . A A . 2 ILE HD13 1 1 3 1589 1 1 2 ILE HG12 H -2.618 -3.549 -0.124 1.00 . A A . 2 ILE HG12 1 1 3 1590 1 1 2 ILE HG13 H -1.770 -4.774 0.806 1.00 . A A . 2 ILE HG13 1 1 3 1591 1 1 2 ILE HG21 H 0.304 -1.426 -0.859 1.00 . A A . 2 ILE HG21 1 1 3 1592 1 1 2 ILE HG22 H -1.371 -1.758 -1.279 1.00 . A A . 2 ILE HG22 1 1 3 1593 1 1 2 ILE HG23 H -0.952 -1.119 0.305 1.00 . A A . 2 ILE HG23 1 1 3 1594 1 1 2 ILE N N -1.127 -4.540 -1.910 1.00 . A A . 2 ILE N 1 1 3 1595 1 1 2 ILE O O 1.665 -4.825 0.652 1.00 . A A . 2 ILE O 1 1 3 1596 1 1 3 VAL C C 3.484 -7.336 -0.573 1.00 . A A . 3 VAL C 1 1 3 1597 1 1 3 VAL CA C 2.037 -7.356 -0.050 1.00 . A A . 3 VAL CA 1 1 3 1598 1 1 3 VAL CB C 1.365 -8.760 -0.182 1.00 . A A . 3 VAL CB 1 1 3 1599 1 1 3 VAL CG1 C 0.051 -8.743 0.624 1.00 . A A . 3 VAL CG1 1 1 3 1600 1 1 3 VAL CG2 C 0.992 -9.066 -1.654 1.00 . A A . 3 VAL CG2 1 1 3 1601 1 1 3 VAL H H 0.556 -6.668 -1.495 1.00 . A A . 3 VAL H 1 1 3 1602 1 1 3 VAL HA H 2.079 -7.092 0.996 1.00 . A A . 3 VAL HA 1 1 3 1603 1 1 3 VAL HB H 2.023 -9.519 0.223 1.00 . A A . 3 VAL HB 1 1 3 1604 1 1 3 VAL HG11 H -0.615 -7.976 0.261 1.00 . A A . 3 VAL HG11 1 1 3 1605 1 1 3 VAL HG12 H -0.461 -9.687 0.549 1.00 . A A . 3 VAL HG12 1 1 3 1606 1 1 3 VAL HG13 H 0.251 -8.539 1.667 1.00 . A A . 3 VAL HG13 1 1 3 1607 1 1 3 VAL HG21 H 1.866 -9.047 -2.289 1.00 . A A . 3 VAL HG21 1 1 3 1608 1 1 3 VAL HG22 H 0.556 -10.050 -1.726 1.00 . A A . 3 VAL HG22 1 1 3 1609 1 1 3 VAL HG23 H 0.275 -8.364 -2.044 1.00 . A A . 3 VAL HG23 1 1 3 1610 1 1 3 VAL N N 1.113 -6.394 -0.744 1.00 . A A . 3 VAL N 1 1 3 1611 1 1 3 VAL O O 4.080 -6.279 -0.496 1.00 . A A . 3 VAL O 1 1 3 1612 1 1 4 GLU C C 5.658 -7.567 -2.865 1.00 . A A . 4 GLU C 1 1 3 1613 1 1 4 GLU CA C 5.441 -8.448 -1.597 1.00 . A A . 4 GLU CA 1 1 3 1614 1 1 4 GLU CB C 5.779 -9.956 -1.860 1.00 . A A . 4 GLU CB 1 1 3 1615 1 1 4 GLU CD C 3.469 -11.229 -1.939 1.00 . A A . 4 GLU CD 1 1 3 1616 1 1 4 GLU CG C 4.658 -10.697 -2.714 1.00 . A A . 4 GLU CG 1 1 3 1617 1 1 4 GLU H H 3.504 -9.239 -1.102 1.00 . A A . 4 GLU H 1 1 3 1618 1 1 4 GLU HA H 6.097 -8.029 -0.837 1.00 . A A . 4 GLU HA 1 1 3 1619 1 1 4 GLU HB2 H 6.719 -10.017 -2.394 1.00 . A A . 4 GLU HB2 1 1 3 1620 1 1 4 GLU HB3 H 5.902 -10.460 -0.911 1.00 . A A . 4 GLU HB3 1 1 3 1621 1 1 4 GLU HG2 H 4.271 -10.043 -3.479 1.00 . A A . 4 GLU HG2 1 1 3 1622 1 1 4 GLU HG3 H 5.096 -11.546 -3.213 1.00 . A A . 4 GLU HG3 1 1 3 1623 1 1 4 GLU N N 4.028 -8.412 -1.069 1.00 . A A . 4 GLU N 1 1 3 1624 1 1 4 GLU O O 5.845 -7.954 -3.999 1.00 . A A . 4 GLU O 1 1 3 1625 1 1 4 GLU OE1 O 3.449 -11.167 -0.724 1.00 . A A . 4 GLU OE1 1 1 3 1626 1 1 4 GLU OE2 O 2.559 -11.711 -2.579 1.00 . A A . 4 GLU OE2 1 1 3 1627 1 1 5 GLN C C 5.737 -3.873 -2.566 1.00 . A A . 5 GLN C 1 1 3 1628 1 1 5 GLN CA C 5.766 -5.154 -3.438 1.00 . A A . 5 GLN CA 1 1 3 1629 1 1 5 GLN CB C 4.610 -5.154 -4.498 1.00 . A A . 5 GLN CB 1 1 3 1630 1 1 5 GLN CD C 2.220 -4.503 -4.967 1.00 . A A . 5 GLN CD 1 1 3 1631 1 1 5 GLN CG C 3.197 -4.912 -3.878 1.00 . A A . 5 GLN CG 1 1 3 1632 1 1 5 GLN H H 5.473 -6.169 -1.586 1.00 . A A . 5 GLN H 1 1 3 1633 1 1 5 GLN HA H 6.712 -5.202 -3.948 1.00 . A A . 5 GLN HA 1 1 3 1634 1 1 5 GLN HB2 H 4.826 -4.408 -5.251 1.00 . A A . 5 GLN HB2 1 1 3 1635 1 1 5 GLN HB3 H 4.618 -6.118 -4.995 1.00 . A A . 5 GLN HB3 1 1 3 1636 1 1 5 GLN HE21 H 1.050 -6.072 -4.772 1.00 . A A . 5 GLN HE21 1 1 3 1637 1 1 5 GLN HE22 H 0.590 -4.897 -5.923 1.00 . A A . 5 GLN HE22 1 1 3 1638 1 1 5 GLN HG2 H 2.829 -5.809 -3.407 1.00 . A A . 5 GLN HG2 1 1 3 1639 1 1 5 GLN HG3 H 3.212 -4.112 -3.162 1.00 . A A . 5 GLN HG3 1 1 3 1640 1 1 5 GLN N N 5.611 -6.320 -2.533 1.00 . A A . 5 GLN N 1 1 3 1641 1 1 5 GLN NE2 N 1.203 -5.231 -5.233 1.00 . A A . 5 GLN NE2 1 1 3 1642 1 1 5 GLN O O 6.467 -2.951 -2.829 1.00 . A A . 5 GLN O 1 1 3 1643 1 1 5 GLN OE1 O 2.367 -3.489 -5.610 1.00 . A A . 5 GLN OE1 1 1 3 1644 1 1 6 CYS C C 5.358 -2.954 0.753 1.00 . A A . 6 CYS C 1 1 3 1645 1 1 6 CYS CA C 4.800 -2.637 -0.641 1.00 . A A . 6 CYS CA 1 1 3 1646 1 1 6 CYS CB C 3.319 -2.256 -0.545 1.00 . A A . 6 CYS CB 1 1 3 1647 1 1 6 CYS H H 4.349 -4.635 -1.364 1.00 . A A . 6 CYS H 1 1 3 1648 1 1 6 CYS HA H 5.391 -1.816 -1.029 1.00 . A A . 6 CYS HA 1 1 3 1649 1 1 6 CYS HB2 H 2.795 -3.019 0.003 1.00 . A A . 6 CYS HB2 1 1 3 1650 1 1 6 CYS HB3 H 3.257 -1.349 0.042 1.00 . A A . 6 CYS HB3 1 1 3 1651 1 1 6 CYS HG H 2.150 -2.785 -2.461 1.00 . A A . 6 CYS HG 1 1 3 1652 1 1 6 CYS N N 4.909 -3.845 -1.550 1.00 . A A . 6 CYS N 1 1 3 1653 1 1 6 CYS O O 5.884 -2.141 1.479 1.00 . A A . 6 CYS O 1 1 3 1654 1 1 6 CYS SG S 2.440 -1.947 -2.096 1.00 . A A . 6 CYS SG 1 1 3 1655 1 1 7 CYS C C 6.737 -5.838 2.061 1.00 . A A . 7 CYS C 1 1 3 1656 1 1 7 CYS CA C 5.646 -4.774 2.362 1.00 . A A . 7 CYS CA 1 1 3 1657 1 1 7 CYS CB C 4.338 -5.274 2.940 1.00 . A A . 7 CYS CB 1 1 3 1658 1 1 7 CYS H H 4.760 -4.792 0.433 1.00 . A A . 7 CYS H 1 1 3 1659 1 1 7 CYS HA H 6.079 -4.010 2.992 1.00 . A A . 7 CYS HA 1 1 3 1660 1 1 7 CYS HB2 H 3.789 -4.367 3.166 1.00 . A A . 7 CYS HB2 1 1 3 1661 1 1 7 CYS HB3 H 3.779 -5.756 2.150 1.00 . A A . 7 CYS HB3 1 1 3 1662 1 1 7 CYS HG H 4.509 -7.235 4.121 1.00 . A A . 7 CYS HG 1 1 3 1663 1 1 7 CYS N N 5.198 -4.197 1.070 1.00 . A A . 7 CYS N 1 1 3 1664 1 1 7 CYS O O 6.783 -6.916 2.615 1.00 . A A . 7 CYS O 1 1 3 1665 1 1 7 CYS SG S 4.381 -6.329 4.412 1.00 . A A . 7 CYS SG 1 1 3 1666 1 1 8 THR C C 8.922 -5.739 -0.957 1.00 . A A . 8 THR C 1 1 3 1667 1 1 8 THR CA C 8.785 -6.094 0.542 1.00 . A A . 8 THR CA 1 1 3 1668 1 1 8 THR CB C 8.675 -7.635 0.675 1.00 . A A . 8 THR CB 1 1 3 1669 1 1 8 THR CG2 C 9.772 -8.385 -0.034 1.00 . A A . 8 THR CG2 1 1 3 1670 1 1 8 THR H H 7.334 -4.510 0.826 1.00 . A A . 8 THR H 1 1 3 1671 1 1 8 THR HA H 9.678 -5.768 1.055 1.00 . A A . 8 THR HA 1 1 3 1672 1 1 8 THR HB H 7.681 -8.038 0.518 1.00 . A A . 8 THR HB 1 1 3 1673 1 1 8 THR HG1 H 8.314 -7.954 2.542 1.00 . A A . 8 THR HG1 1 1 3 1674 1 1 8 THR HG21 H 10.733 -8.098 0.366 1.00 . A A . 8 THR HG21 1 1 3 1675 1 1 8 THR HG22 H 9.627 -9.441 0.139 1.00 . A A . 8 THR HG22 1 1 3 1676 1 1 8 THR HG23 H 9.748 -8.197 -1.095 1.00 . A A . 8 THR HG23 1 1 3 1677 1 1 8 THR N N 7.566 -5.400 1.148 1.00 . A A . 8 THR N 1 1 3 1678 1 1 8 THR O O 8.261 -6.308 -1.800 1.00 . A A . 8 THR O 1 1 3 1679 1 1 8 THR OG1 O 9.110 -7.852 2.001 1.00 . A A . 8 THR OG1 1 1 3 1680 1 1 9 SER C C 9.666 -2.728 -2.587 1.00 . A A . 9 SER C 1 1 3 1681 1 1 9 SER CA C 10.143 -4.202 -2.586 1.00 . A A . 9 SER CA 1 1 3 1682 1 1 9 SER CB C 9.443 -4.906 -3.762 1.00 . A A . 9 SER CB 1 1 3 1683 1 1 9 SER H H 10.260 -4.390 -0.460 1.00 . A A . 9 SER H 1 1 3 1684 1 1 9 SER HA H 11.212 -4.201 -2.719 1.00 . A A . 9 SER HA 1 1 3 1685 1 1 9 SER HB2 H 9.502 -5.987 -3.708 1.00 . A A . 9 SER HB2 1 1 3 1686 1 1 9 SER HB3 H 8.422 -4.579 -3.787 1.00 . A A . 9 SER HB3 1 1 3 1687 1 1 9 SER HG H 10.441 -5.132 -5.458 1.00 . A A . 9 SER HG 1 1 3 1688 1 1 9 SER N N 9.782 -4.787 -1.220 1.00 . A A . 9 SER N 1 1 3 1689 1 1 9 SER O O 9.425 -2.205 -1.521 1.00 . A A . 9 SER O 1 1 3 1690 1 1 9 SER OG O 10.133 -4.398 -4.908 1.00 . A A . 9 SER OG 1 1 3 1691 1 1 10 ILE C C 7.893 -0.158 -4.587 1.00 . A A . 10 ILE C 1 1 3 1692 1 1 10 ILE CA C 9.065 -0.627 -3.668 1.00 . A A . 10 ILE CA 1 1 3 1693 1 1 10 ILE CB C 10.321 0.289 -3.904 1.00 . A A . 10 ILE CB 1 1 3 1694 1 1 10 ILE CD1 C 10.997 -1.000 -6.036 1.00 . A A . 10 ILE CD1 1 1 3 1695 1 1 10 ILE CG1 C 10.822 0.388 -5.364 1.00 . A A . 10 ILE CG1 1 1 3 1696 1 1 10 ILE CG2 C 11.464 -0.194 -3.004 1.00 . A A . 10 ILE CG2 1 1 3 1697 1 1 10 ILE H H 9.741 -2.576 -4.526 1.00 . A A . 10 ILE H 1 1 3 1698 1 1 10 ILE HA H 8.770 -0.424 -2.656 1.00 . A A . 10 ILE HA 1 1 3 1699 1 1 10 ILE HB H 10.052 1.282 -3.573 1.00 . A A . 10 ILE HB 1 1 3 1700 1 1 10 ILE HD11 H 11.694 -1.611 -5.481 1.00 . A A . 10 ILE HD11 1 1 3 1701 1 1 10 ILE HD12 H 10.050 -1.513 -6.095 1.00 . A A . 10 ILE HD12 1 1 3 1702 1 1 10 ILE HD13 H 11.373 -0.878 -7.042 1.00 . A A . 10 ILE HD13 1 1 3 1703 1 1 10 ILE HG12 H 10.129 0.998 -5.928 1.00 . A A . 10 ILE HG12 1 1 3 1704 1 1 10 ILE HG13 H 11.764 0.918 -5.349 1.00 . A A . 10 ILE HG13 1 1 3 1705 1 1 10 ILE HG21 H 11.116 -0.229 -1.984 1.00 . A A . 10 ILE HG21 1 1 3 1706 1 1 10 ILE HG22 H 11.769 -1.189 -3.274 1.00 . A A . 10 ILE HG22 1 1 3 1707 1 1 10 ILE HG23 H 12.311 0.469 -3.069 1.00 . A A . 10 ILE HG23 1 1 3 1708 1 1 10 ILE N N 9.532 -2.075 -3.711 1.00 . A A . 10 ILE N 1 1 3 1709 1 1 10 ILE O O 7.972 0.693 -5.452 1.00 . A A . 10 ILE O 1 1 3 1710 1 1 11 CYS C C 5.075 1.025 -5.049 1.00 . A A . 11 CYS C 1 1 3 1711 1 1 11 CYS CA C 5.516 -0.459 -5.110 1.00 . A A . 11 CYS CA 1 1 3 1712 1 1 11 CYS CB C 4.424 -1.345 -4.539 1.00 . A A . 11 CYS CB 1 1 3 1713 1 1 11 CYS H H 6.753 -1.415 -3.657 1.00 . A A . 11 CYS H 1 1 3 1714 1 1 11 CYS HA H 5.697 -0.705 -6.142 1.00 . A A . 11 CYS HA 1 1 3 1715 1 1 11 CYS HB2 H 3.562 -1.346 -5.184 1.00 . A A . 11 CYS HB2 1 1 3 1716 1 1 11 CYS HB3 H 4.787 -2.357 -4.485 1.00 . A A . 11 CYS HB3 1 1 3 1717 1 1 11 CYS HG H 3.323 -0.072 -2.992 1.00 . A A . 11 CYS HG 1 1 3 1718 1 1 11 CYS N N 6.769 -0.749 -4.357 1.00 . A A . 11 CYS N 1 1 3 1719 1 1 11 CYS O O 4.376 1.463 -4.162 1.00 . A A . 11 CYS O 1 1 3 1720 1 1 11 CYS SG S 3.872 -0.855 -2.893 1.00 . A A . 11 CYS SG 1 1 3 1721 1 1 12 SER C C 3.788 3.762 -5.754 1.00 . A A . 12 SER C 1 1 3 1722 1 1 12 SER CA C 5.201 3.250 -6.116 1.00 . A A . 12 SER CA 1 1 3 1723 1 1 12 SER CB C 5.548 3.673 -7.540 1.00 . A A . 12 SER CB 1 1 3 1724 1 1 12 SER H H 6.114 1.295 -6.638 1.00 . A A . 12 SER H 1 1 3 1725 1 1 12 SER HA H 5.741 3.781 -5.395 1.00 . A A . 12 SER HA 1 1 3 1726 1 1 12 SER HB2 H 6.555 3.367 -7.799 1.00 . A A . 12 SER HB2 1 1 3 1727 1 1 12 SER HB3 H 4.844 3.236 -8.235 1.00 . A A . 12 SER HB3 1 1 3 1728 1 1 12 SER HG H 5.911 5.418 -8.321 1.00 . A A . 12 SER HG 1 1 3 1729 1 1 12 SER N N 5.534 1.767 -6.001 1.00 . A A . 12 SER N 1 1 3 1730 1 1 12 SER O O 2.868 3.024 -5.476 1.00 . A A . 12 SER O 1 1 3 1731 1 1 12 SER OG O 5.450 5.099 -7.524 1.00 . A A . 12 SER OG 1 1 3 1732 1 1 13 LEU C C 1.201 5.031 -6.252 1.00 . A A . 13 LEU C 1 1 3 1733 1 1 13 LEU CA C 2.307 5.693 -5.434 1.00 . A A . 13 LEU CA 1 1 3 1734 1 1 13 LEU CB C 2.447 7.206 -5.738 1.00 . A A . 13 LEU CB 1 1 3 1735 1 1 13 LEU CD1 C 0.593 7.775 -4.128 1.00 . A A . 13 LEU CD1 1 1 3 1736 1 1 13 LEU CD2 C 1.333 9.412 -5.814 1.00 . A A . 13 LEU CD2 1 1 3 1737 1 1 13 LEU CG C 1.097 7.930 -5.565 1.00 . A A . 13 LEU CG 1 1 3 1738 1 1 13 LEU H H 4.399 5.590 -6.037 1.00 . A A . 13 LEU H 1 1 3 1739 1 1 13 LEU HA H 2.076 5.505 -4.395 1.00 . A A . 13 LEU HA 1 1 3 1740 1 1 13 LEU HB2 H 3.177 7.639 -5.067 1.00 . A A . 13 LEU HB2 1 1 3 1741 1 1 13 LEU HB3 H 2.802 7.345 -6.749 1.00 . A A . 13 LEU HB3 1 1 3 1742 1 1 13 LEU HD11 H 1.305 8.176 -3.421 1.00 . A A . 13 LEU HD11 1 1 3 1743 1 1 13 LEU HD12 H -0.345 8.301 -4.017 1.00 . A A . 13 LEU HD12 1 1 3 1744 1 1 13 LEU HD13 H 0.412 6.735 -3.898 1.00 . A A . 13 LEU HD13 1 1 3 1745 1 1 13 LEU HD21 H 1.705 9.570 -6.816 1.00 . A A . 13 LEU HD21 1 1 3 1746 1 1 13 LEU HD22 H 0.402 9.950 -5.711 1.00 . A A . 13 LEU HD22 1 1 3 1747 1 1 13 LEU HD23 H 2.048 9.814 -5.110 1.00 . A A . 13 LEU HD23 1 1 3 1748 1 1 13 LEU HG H 0.353 7.552 -6.265 1.00 . A A . 13 LEU HG 1 1 3 1749 1 1 13 LEU N N 3.624 5.056 -5.770 1.00 . A A . 13 LEU N 1 1 3 1750 1 1 13 LEU O O 0.218 4.548 -5.726 1.00 . A A . 13 LEU O 1 1 3 1751 1 1 14 TYR C C 0.206 2.938 -8.045 1.00 . A A . 14 TYR C 1 1 3 1752 1 1 14 TYR CA C 0.434 4.393 -8.457 1.00 . A A . 14 TYR CA 1 1 3 1753 1 1 14 TYR CB C 0.895 4.453 -9.962 1.00 . A A . 14 TYR CB 1 1 3 1754 1 1 14 TYR CD1 C 2.773 6.052 -9.788 1.00 . A A . 14 TYR CD1 1 1 3 1755 1 1 14 TYR CD2 C 3.272 3.821 -10.438 1.00 . A A . 14 TYR CD2 1 1 3 1756 1 1 14 TYR CE1 C 4.101 6.372 -9.853 1.00 . A A . 14 TYR CE1 1 1 3 1757 1 1 14 TYR CE2 C 4.606 4.146 -10.503 1.00 . A A . 14 TYR CE2 1 1 3 1758 1 1 14 TYR CG C 2.362 4.776 -10.078 1.00 . A A . 14 TYR CG 1 1 3 1759 1 1 14 TYR CZ C 5.019 5.422 -10.208 1.00 . A A . 14 TYR CZ 1 1 3 1760 1 1 14 TYR H H 2.295 5.404 -7.821 1.00 . A A . 14 TYR H 1 1 3 1761 1 1 14 TYR HA H -0.498 4.916 -8.344 1.00 . A A . 14 TYR HA 1 1 3 1762 1 1 14 TYR HB2 H 0.676 3.522 -10.464 1.00 . A A . 14 TYR HB2 1 1 3 1763 1 1 14 TYR HB3 H 0.316 5.226 -10.453 1.00 . A A . 14 TYR HB3 1 1 3 1764 1 1 14 TYR HD1 H 2.035 6.796 -9.512 1.00 . A A . 14 TYR HD1 1 1 3 1765 1 1 14 TYR HD2 H 2.937 2.820 -10.670 1.00 . A A . 14 TYR HD2 1 1 3 1766 1 1 14 TYR HE1 H 4.422 7.371 -9.614 1.00 . A A . 14 TYR HE1 1 1 3 1767 1 1 14 TYR HE2 H 5.324 3.391 -10.779 1.00 . A A . 14 TYR HE2 1 1 3 1768 1 1 14 TYR HH H 6.529 6.043 -11.139 1.00 . A A . 14 TYR HH 1 1 3 1769 1 1 14 TYR N N 1.446 5.016 -7.532 1.00 . A A . 14 TYR N 1 1 3 1770 1 1 14 TYR O O -0.785 2.329 -8.404 1.00 . A A . 14 TYR O 1 1 3 1771 1 1 14 TYR OH O 6.348 5.759 -10.237 1.00 . A A . 14 TYR OH 1 1 3 1772 1 1 15 GLN C C -0.044 0.962 -5.661 1.00 . A A . 15 GLN C 1 1 3 1773 1 1 15 GLN CA C 0.794 0.934 -6.929 1.00 . A A . 15 GLN CA 1 1 3 1774 1 1 15 GLN CB C 2.082 0.139 -6.726 1.00 . A A . 15 GLN CB 1 1 3 1775 1 1 15 GLN CD C 4.084 -0.721 -8.022 1.00 . A A . 15 GLN CD 1 1 3 1776 1 1 15 GLN CG C 2.817 0.092 -8.095 1.00 . A A . 15 GLN CG 1 1 3 1777 1 1 15 GLN H H 1.954 2.808 -7.007 1.00 . A A . 15 GLN H 1 1 3 1778 1 1 15 GLN HA H 0.150 0.554 -7.658 1.00 . A A . 15 GLN HA 1 1 3 1779 1 1 15 GLN HB2 H 2.676 0.598 -5.949 1.00 . A A . 15 GLN HB2 1 1 3 1780 1 1 15 GLN HB3 H 1.803 -0.864 -6.416 1.00 . A A . 15 GLN HB3 1 1 3 1781 1 1 15 GLN HE21 H 3.273 -2.364 -7.242 1.00 . A A . 15 GLN HE21 1 1 3 1782 1 1 15 GLN HE22 H 4.937 -2.400 -7.596 1.00 . A A . 15 GLN HE22 1 1 3 1783 1 1 15 GLN HG2 H 2.193 -0.358 -8.852 1.00 . A A . 15 GLN HG2 1 1 3 1784 1 1 15 GLN HG3 H 3.091 1.083 -8.421 1.00 . A A . 15 GLN HG3 1 1 3 1785 1 1 15 GLN N N 1.118 2.349 -7.298 1.00 . A A . 15 GLN N 1 1 3 1786 1 1 15 GLN NE2 N 4.084 -1.928 -7.580 1.00 . A A . 15 GLN NE2 1 1 3 1787 1 1 15 GLN O O -1.063 0.318 -5.519 1.00 . A A . 15 GLN O 1 1 3 1788 1 1 15 GLN OE1 O 5.145 -0.263 -8.370 1.00 . A A . 15 GLN OE1 1 1 3 1789 1 1 16 LEU C C -1.810 2.220 -3.755 1.00 . A A . 16 LEU C 1 1 3 1790 1 1 16 LEU CA C -0.320 1.861 -3.461 1.00 . A A . 16 LEU CA 1 1 3 1791 1 1 16 LEU CB C 0.435 2.937 -2.598 1.00 . A A . 16 LEU CB 1 1 3 1792 1 1 16 LEU CD1 C 2.575 3.337 -1.319 1.00 . A A . 16 LEU CD1 1 1 3 1793 1 1 16 LEU CD2 C 1.670 1.078 -1.296 1.00 . A A . 16 LEU CD2 1 1 3 1794 1 1 16 LEU CG C 1.824 2.339 -2.177 1.00 . A A . 16 LEU CG 1 1 3 1795 1 1 16 LEU H H 1.237 2.186 -4.954 1.00 . A A . 16 LEU H 1 1 3 1796 1 1 16 LEU HA H -0.299 0.897 -3.005 1.00 . A A . 16 LEU HA 1 1 3 1797 1 1 16 LEU HB2 H 0.571 3.841 -3.180 1.00 . A A . 16 LEU HB2 1 1 3 1798 1 1 16 LEU HB3 H -0.146 3.201 -1.723 1.00 . A A . 16 LEU HB3 1 1 3 1799 1 1 16 LEU HD11 H 2.008 3.565 -0.429 1.00 . A A . 16 LEU HD11 1 1 3 1800 1 1 16 LEU HD12 H 3.525 2.911 -1.026 1.00 . A A . 16 LEU HD12 1 1 3 1801 1 1 16 LEU HD13 H 2.757 4.243 -1.875 1.00 . A A . 16 LEU HD13 1 1 3 1802 1 1 16 LEU HD21 H 1.111 1.288 -0.396 1.00 . A A . 16 LEU HD21 1 1 3 1803 1 1 16 LEU HD22 H 1.177 0.280 -1.829 1.00 . A A . 16 LEU HD22 1 1 3 1804 1 1 16 LEU HD23 H 2.645 0.712 -1.005 1.00 . A A . 16 LEU HD23 1 1 3 1805 1 1 16 LEU HG H 2.410 2.105 -3.061 1.00 . A A . 16 LEU HG 1 1 3 1806 1 1 16 LEU N N 0.412 1.731 -4.741 1.00 . A A . 16 LEU N 1 1 3 1807 1 1 16 LEU O O -2.693 1.662 -3.135 1.00 . A A . 16 LEU O 1 1 3 1808 1 1 17 GLU C C -4.294 2.226 -5.529 1.00 . A A . 17 GLU C 1 1 3 1809 1 1 17 GLU CA C -3.520 3.472 -5.000 1.00 . A A . 17 GLU CA 1 1 3 1810 1 1 17 GLU CB C -3.508 4.635 -6.031 1.00 . A A . 17 GLU CB 1 1 3 1811 1 1 17 GLU CD C -2.762 5.328 -8.411 1.00 . A A . 17 GLU CD 1 1 3 1812 1 1 17 GLU CG C -2.904 4.196 -7.384 1.00 . A A . 17 GLU CG 1 1 3 1813 1 1 17 GLU H H -1.317 3.500 -5.184 1.00 . A A . 17 GLU H 1 1 3 1814 1 1 17 GLU HA H -4.017 3.815 -4.110 1.00 . A A . 17 GLU HA 1 1 3 1815 1 1 17 GLU HB2 H -4.515 4.998 -6.199 1.00 . A A . 17 GLU HB2 1 1 3 1816 1 1 17 GLU HB3 H -2.927 5.464 -5.647 1.00 . A A . 17 GLU HB3 1 1 3 1817 1 1 17 GLU HG2 H -1.915 3.840 -7.193 1.00 . A A . 17 GLU HG2 1 1 3 1818 1 1 17 GLU HG3 H -3.475 3.419 -7.858 1.00 . A A . 17 GLU HG3 1 1 3 1819 1 1 17 GLU N N -2.074 3.101 -4.689 1.00 . A A . 17 GLU N 1 1 3 1820 1 1 17 GLU O O -5.421 1.946 -5.159 1.00 . A A . 17 GLU O 1 1 3 1821 1 1 17 GLU OE1 O -2.779 6.481 -8.024 1.00 . A A . 17 GLU OE1 1 1 3 1822 1 1 17 GLU OE2 O -2.622 4.936 -9.554 1.00 . A A . 17 GLU OE2 1 1 3 1823 1 1 18 ASN C C -5.071 -0.582 -5.874 1.00 . A A . 18 ASN C 1 1 3 1824 1 1 18 ASN CA C -4.298 0.221 -6.982 1.00 . A A . 18 ASN CA 1 1 3 1825 1 1 18 ASN CB C -3.107 -0.559 -7.606 1.00 . A A . 18 ASN CB 1 1 3 1826 1 1 18 ASN CG C -3.433 -1.920 -8.159 1.00 . A A . 18 ASN CG 1 1 3 1827 1 1 18 ASN H H -2.776 1.752 -6.668 1.00 . A A . 18 ASN H 1 1 3 1828 1 1 18 ASN HA H -5.040 0.521 -7.707 1.00 . A A . 18 ASN HA 1 1 3 1829 1 1 18 ASN HB2 H -2.663 0.022 -8.401 1.00 . A A . 18 ASN HB2 1 1 3 1830 1 1 18 ASN HB3 H -2.354 -0.735 -6.864 1.00 . A A . 18 ASN HB3 1 1 3 1831 1 1 18 ASN HD21 H -5.390 -1.835 -7.898 1.00 . A A . 18 ASN HD21 1 1 3 1832 1 1 18 ASN HD22 H -4.756 -3.250 -8.610 1.00 . A A . 18 ASN HD22 1 1 3 1833 1 1 18 ASN N N -3.677 1.473 -6.398 1.00 . A A . 18 ASN N 1 1 3 1834 1 1 18 ASN ND2 N -4.636 -2.364 -8.224 1.00 . A A . 18 ASN ND2 1 1 3 1835 1 1 18 ASN O O -6.102 -1.181 -6.110 1.00 . A A . 18 ASN O 1 1 3 1836 1 1 18 ASN OD1 O -2.558 -2.651 -8.559 1.00 . A A . 18 ASN OD1 1 1 3 1837 1 1 19 TYR C C -5.823 -0.162 -2.610 1.00 . A A . 19 TYR C 1 1 3 1838 1 1 19 TYR CA C -5.040 -1.226 -3.460 1.00 . A A . 19 TYR CA 1 1 3 1839 1 1 19 TYR CB C -3.749 -1.830 -2.790 1.00 . A A . 19 TYR CB 1 1 3 1840 1 1 19 TYR CD1 C -3.491 -3.312 -4.836 1.00 . A A . 19 TYR CD1 1 1 3 1841 1 1 19 TYR CD2 C -1.562 -2.173 -4.056 1.00 . A A . 19 TYR CD2 1 1 3 1842 1 1 19 TYR CE1 C -2.751 -3.861 -5.859 1.00 . A A . 19 TYR CE1 1 1 3 1843 1 1 19 TYR CE2 C -0.828 -2.730 -5.088 1.00 . A A . 19 TYR CE2 1 1 3 1844 1 1 19 TYR CG C -2.905 -2.461 -3.921 1.00 . A A . 19 TYR CG 1 1 3 1845 1 1 19 TYR CZ C -1.423 -3.573 -5.988 1.00 . A A . 19 TYR CZ 1 1 3 1846 1 1 19 TYR H H -3.667 -0.035 -4.663 1.00 . A A . 19 TYR H 1 1 3 1847 1 1 19 TYR HA H -5.742 -2.002 -3.735 1.00 . A A . 19 TYR HA 1 1 3 1848 1 1 19 TYR HB2 H -3.159 -1.074 -2.296 1.00 . A A . 19 TYR HB2 1 1 3 1849 1 1 19 TYR HB3 H -3.995 -2.606 -2.076 1.00 . A A . 19 TYR HB3 1 1 3 1850 1 1 19 TYR HD1 H -4.542 -3.551 -4.752 1.00 . A A . 19 TYR HD1 1 1 3 1851 1 1 19 TYR HD2 H -1.077 -1.504 -3.362 1.00 . A A . 19 TYR HD2 1 1 3 1852 1 1 19 TYR HE1 H -3.208 -4.525 -6.576 1.00 . A A . 19 TYR HE1 1 1 3 1853 1 1 19 TYR HE2 H 0.222 -2.504 -5.201 1.00 . A A . 19 TYR HE2 1 1 3 1854 1 1 19 TYR HH H -1.157 -3.721 -7.789 1.00 . A A . 19 TYR HH 1 1 3 1855 1 1 19 TYR N N -4.505 -0.543 -4.702 1.00 . A A . 19 TYR N 1 1 3 1856 1 1 19 TYR O O -6.836 -0.409 -1.974 1.00 . A A . 19 TYR O 1 1 3 1857 1 1 19 TYR OH O -0.716 -4.126 -7.024 1.00 . A A . 19 TYR OH 1 1 3 1858 1 1 20 CYS C C -6.613 3.035 -3.021 1.00 . A A . 20 CYS C 1 1 3 1859 1 1 20 CYS CA C -5.838 2.228 -1.941 1.00 . A A . 20 CYS CA 1 1 3 1860 1 1 20 CYS CB C -4.660 2.995 -1.389 1.00 . A A . 20 CYS CB 1 1 3 1861 1 1 20 CYS H H -4.470 1.124 -3.159 1.00 . A A . 20 CYS H 1 1 3 1862 1 1 20 CYS HA H -6.509 1.989 -1.136 1.00 . A A . 20 CYS HA 1 1 3 1863 1 1 20 CYS HB2 H -4.144 2.338 -0.722 1.00 . A A . 20 CYS HB2 1 1 3 1864 1 1 20 CYS HB3 H -3.985 3.248 -2.189 1.00 . A A . 20 CYS HB3 1 1 3 1865 1 1 20 CYS HG H -4.896 5.253 -1.117 1.00 . A A . 20 CYS HG 1 1 3 1866 1 1 20 CYS N N -5.293 1.021 -2.642 1.00 . A A . 20 CYS N 1 1 3 1867 1 1 20 CYS O O -6.259 4.116 -3.443 1.00 . A A . 20 CYS O 1 1 3 1868 1 1 20 CYS SG S -5.041 4.523 -0.509 1.00 . A A . 20 CYS SG 1 1 3 1869 1 1 21 ASN C C -8.848 4.500 -4.512 1.00 . A A . 21 ASN C 1 1 3 1870 1 1 21 ASN CA C -8.610 2.957 -4.467 1.00 . A A . 21 ASN CA 1 1 3 1871 1 1 21 ASN CB C -9.913 2.159 -4.251 1.00 . A A . 21 ASN CB 1 1 3 1872 1 1 21 ASN CG C -9.626 0.665 -4.260 1.00 . A A . 21 ASN CG 1 1 3 1873 1 1 21 ASN H H -7.847 1.540 -3.007 1.00 . A A . 21 ASN H 1 1 3 1874 1 1 21 ASN HA H -8.199 2.715 -5.440 1.00 . A A . 21 ASN HA 1 1 3 1875 1 1 21 ASN HB2 H -10.374 2.413 -3.311 1.00 . A A . 21 ASN HB2 1 1 3 1876 1 1 21 ASN HB3 H -10.619 2.363 -5.040 1.00 . A A . 21 ASN HB3 1 1 3 1877 1 1 21 ASN HD21 H -7.755 0.770 -4.934 1.00 . A A . 21 ASN HD21 1 1 3 1878 1 1 21 ASN HD22 H -8.399 -0.778 -4.653 1.00 . A A . 21 ASN HD22 1 1 3 1879 1 1 21 ASN N N -7.672 2.409 -3.424 1.00 . A A . 21 ASN N 1 1 3 1880 1 1 21 ASN ND2 N -8.492 0.193 -4.651 1.00 . A A . 21 ASN ND2 1 1 3 1881 1 1 21 ASN O O -8.957 5.076 -5.584 1.00 . A A . 21 ASN O 1 1 3 1882 1 1 21 ASN OD1 O -10.443 -0.143 -3.897 1.00 . A A . 21 ASN OD1 1 1 3 1883 2 2 1 PHE C C 9.423 6.045 -4.733 1.00 . B B . 1 PHE C 1 1 3 1884 2 2 1 PHE CA C 9.052 7.489 -4.304 1.00 . B B . 1 PHE CA 1 1 3 1885 2 2 1 PHE CB C 7.615 7.847 -4.784 1.00 . B B . 1 PHE CB 1 1 3 1886 2 2 1 PHE CD1 C 7.565 10.356 -5.053 1.00 . B B . 1 PHE CD1 1 1 3 1887 2 2 1 PHE CD2 C 6.565 9.421 -3.113 1.00 . B B . 1 PHE CD2 1 1 3 1888 2 2 1 PHE CE1 C 7.233 11.621 -4.620 1.00 . B B . 1 PHE CE1 1 1 3 1889 2 2 1 PHE CE2 C 6.229 10.685 -2.674 1.00 . B B . 1 PHE CE2 1 1 3 1890 2 2 1 PHE CG C 7.233 9.249 -4.303 1.00 . B B . 1 PHE CG 1 1 3 1891 2 2 1 PHE CZ C 6.564 11.786 -3.428 1.00 . B B . 1 PHE CZ 1 1 3 1892 2 2 1 PHE HA H 9.080 7.511 -3.225 1.00 . B B . 1 PHE HA 1 1 3 1893 2 2 1 PHE HB2 H 7.568 7.821 -5.862 1.00 . B B . 1 PHE HB2 1 1 3 1894 2 2 1 PHE HB3 H 6.901 7.135 -4.396 1.00 . B B . 1 PHE HB3 1 1 3 1895 2 2 1 PHE HD1 H 8.087 10.225 -5.990 1.00 . B B . 1 PHE HD1 1 1 3 1896 2 2 1 PHE HD2 H 6.301 8.559 -2.519 1.00 . B B . 1 PHE HD2 1 1 3 1897 2 2 1 PHE HE1 H 7.496 12.486 -5.214 1.00 . B B . 1 PHE HE1 1 1 3 1898 2 2 1 PHE HE2 H 5.702 10.813 -1.738 1.00 . B B . 1 PHE HE2 1 1 3 1899 2 2 1 PHE HZ H 6.301 12.778 -3.084 1.00 . B B . 1 PHE HZ 1 1 3 1900 2 2 1 PHE N N 9.986 8.535 -4.839 1.00 . B B . 1 PHE N 1 1 3 1901 2 2 1 PHE O O 8.607 5.291 -5.224 1.00 . B B . 1 PHE O 1 1 3 1902 2 2 2 VAL C C 11.838 3.519 -3.742 1.00 . B B . 2 VAL C 1 1 3 1903 2 2 2 VAL CA C 11.194 4.351 -4.893 1.00 . B B . 2 VAL CA 1 1 3 1904 2 2 2 VAL CB C 12.211 4.517 -6.000 1.00 . B B . 2 VAL CB 1 1 3 1905 2 2 2 VAL CG1 C 11.579 5.149 -7.251 1.00 . B B . 2 VAL CG1 1 1 3 1906 2 2 2 VAL CG2 C 13.405 5.396 -5.570 1.00 . B B . 2 VAL CG2 1 1 3 1907 2 2 2 VAL H H 11.281 6.341 -4.206 1.00 . B B . 2 VAL H 1 1 3 1908 2 2 2 VAL HA H 10.388 3.825 -5.324 1.00 . B B . 2 VAL HA 1 1 3 1909 2 2 2 VAL HB H 12.493 3.490 -6.159 1.00 . B B . 2 VAL HB 1 1 3 1910 2 2 2 VAL HG11 H 10.776 4.530 -7.623 1.00 . B B . 2 VAL HG11 1 1 3 1911 2 2 2 VAL HG12 H 11.177 6.128 -7.027 1.00 . B B . 2 VAL HG12 1 1 3 1912 2 2 2 VAL HG13 H 12.318 5.253 -8.032 1.00 . B B . 2 VAL HG13 1 1 3 1913 2 2 2 VAL HG21 H 13.083 6.389 -5.298 1.00 . B B . 2 VAL HG21 1 1 3 1914 2 2 2 VAL HG22 H 13.922 4.950 -4.733 1.00 . B B . 2 VAL HG22 1 1 3 1915 2 2 2 VAL HG23 H 14.107 5.480 -6.387 1.00 . B B . 2 VAL HG23 1 1 3 1916 2 2 2 VAL N N 10.667 5.699 -4.548 1.00 . B B . 2 VAL N 1 1 3 1917 2 2 2 VAL O O 12.875 2.896 -3.851 1.00 . B B . 2 VAL O 1 1 3 1918 2 2 3 ASN C C 10.590 1.873 -0.711 1.00 . B B . 3 ASN C 1 1 3 1919 2 2 3 ASN CA C 11.619 2.806 -1.395 1.00 . B B . 3 ASN CA 1 1 3 1920 2 2 3 ASN CB C 12.119 3.894 -0.409 1.00 . B B . 3 ASN CB 1 1 3 1921 2 2 3 ASN CG C 11.003 4.873 -0.118 1.00 . B B . 3 ASN CG 1 1 3 1922 2 2 3 ASN H H 10.357 4.071 -2.697 1.00 . B B . 3 ASN H 1 1 3 1923 2 2 3 ASN HA H 12.431 2.158 -1.657 1.00 . B B . 3 ASN HA 1 1 3 1924 2 2 3 ASN HB2 H 12.418 3.453 0.528 1.00 . B B . 3 ASN HB2 1 1 3 1925 2 2 3 ASN HB3 H 12.950 4.433 -0.830 1.00 . B B . 3 ASN HB3 1 1 3 1926 2 2 3 ASN HD21 H 11.961 6.467 -0.768 1.00 . B B . 3 ASN HD21 1 1 3 1927 2 2 3 ASN HD22 H 10.378 6.689 -0.165 1.00 . B B . 3 ASN HD22 1 1 3 1928 2 2 3 ASN N N 11.171 3.541 -2.639 1.00 . B B . 3 ASN N 1 1 3 1929 2 2 3 ASN ND2 N 11.140 6.119 -0.379 1.00 . B B . 3 ASN ND2 1 1 3 1930 2 2 3 ASN O O 10.919 0.892 -0.085 1.00 . B B . 3 ASN O 1 1 3 1931 2 2 3 ASN OD1 O 9.954 4.528 0.363 1.00 . B B . 3 ASN OD1 1 1 3 1932 2 2 4 GLN C C 8.189 0.166 0.414 1.00 . B B . 4 GLN C 1 1 3 1933 2 2 4 GLN CA C 8.159 1.561 -0.316 1.00 . B B . 4 GLN CA 1 1 3 1934 2 2 4 GLN CB C 7.099 1.456 -1.437 1.00 . B B . 4 GLN CB 1 1 3 1935 2 2 4 GLN CD C 7.748 3.402 -2.995 1.00 . B B . 4 GLN CD 1 1 3 1936 2 2 4 GLN CG C 6.676 2.810 -2.102 1.00 . B B . 4 GLN CG 1 1 3 1937 2 2 4 GLN H H 9.297 3.070 -1.387 1.00 . B B . 4 GLN H 1 1 3 1938 2 2 4 GLN HA H 7.779 2.242 0.402 1.00 . B B . 4 GLN HA 1 1 3 1939 2 2 4 GLN HB2 H 7.438 0.755 -2.164 1.00 . B B . 4 GLN HB2 1 1 3 1940 2 2 4 GLN HB3 H 6.231 1.022 -0.958 1.00 . B B . 4 GLN HB3 1 1 3 1941 2 2 4 GLN HE21 H 7.294 2.324 -4.585 1.00 . B B . 4 GLN HE21 1 1 3 1942 2 2 4 GLN HE22 H 8.537 3.462 -4.762 1.00 . B B . 4 GLN HE22 1 1 3 1943 2 2 4 GLN HG2 H 5.792 2.670 -2.703 1.00 . B B . 4 GLN HG2 1 1 3 1944 2 2 4 GLN HG3 H 6.454 3.545 -1.346 1.00 . B B . 4 GLN HG3 1 1 3 1945 2 2 4 GLN N N 9.372 2.253 -0.866 1.00 . B B . 4 GLN N 1 1 3 1946 2 2 4 GLN NE2 N 7.862 3.025 -4.212 1.00 . B B . 4 GLN NE2 1 1 3 1947 2 2 4 GLN O O 7.593 -0.802 -0.007 1.00 . B B . 4 GLN O 1 1 3 1948 2 2 4 GLN OE1 O 8.531 4.236 -2.604 1.00 . B B . 4 GLN OE1 1 1 3 1949 2 2 5 HIS C C 8.250 -0.879 3.707 1.00 . B B . 5 HIS C 1 1 3 1950 2 2 5 HIS CA C 9.041 -1.097 2.380 1.00 . B B . 5 HIS CA 1 1 3 1951 2 2 5 HIS CB C 10.554 -1.336 2.695 1.00 . B B . 5 HIS CB 1 1 3 1952 2 2 5 HIS CD2 C 11.678 -3.478 1.628 1.00 . B B . 5 HIS CD2 1 1 3 1953 2 2 5 HIS CE1 C 11.986 -2.713 -0.271 1.00 . B B . 5 HIS CE1 1 1 3 1954 2 2 5 HIS CG C 11.201 -2.185 1.617 1.00 . B B . 5 HIS CG 1 1 3 1955 2 2 5 HIS H H 9.311 0.985 1.708 1.00 . B B . 5 HIS H 1 1 3 1956 2 2 5 HIS HA H 8.611 -1.955 1.880 1.00 . B B . 5 HIS HA 1 1 3 1957 2 2 5 HIS HB2 H 11.076 -0.393 2.734 1.00 . B B . 5 HIS HB2 1 1 3 1958 2 2 5 HIS HB3 H 10.680 -1.836 3.644 1.00 . B B . 5 HIS HB3 1 1 3 1959 2 2 5 HIS HD1 H 11.172 -0.874 0.129 1.00 . B B . 5 HIS HD1 1 1 3 1960 2 2 5 HIS HD2 H 11.656 -4.134 2.483 1.00 . B B . 5 HIS HD2 1 1 3 1961 2 2 5 HIS HE1 H 12.272 -2.605 -1.310 1.00 . B B . 5 HIS HE1 1 1 3 1962 2 2 5 HIS N N 8.886 0.136 1.507 1.00 . B B . 5 HIS N 1 1 3 1963 2 2 5 HIS ND1 N 11.422 -1.780 0.427 1.00 . B B . 5 HIS ND1 1 1 3 1964 2 2 5 HIS NE2 N 12.165 -3.794 0.445 1.00 . B B . 5 HIS NE2 1 1 3 1965 2 2 5 HIS O O 8.766 -0.790 4.805 1.00 . B B . 5 HIS O 1 1 3 1966 2 2 6 LEU C C 5.216 -1.905 4.908 1.00 . B B . 6 LEU C 1 1 3 1967 2 2 6 LEU CA C 5.996 -0.588 4.677 1.00 . B B . 6 LEU CA 1 1 3 1968 2 2 6 LEU CB C 5.067 0.568 4.256 1.00 . B B . 6 LEU CB 1 1 3 1969 2 2 6 LEU CD1 C 7.086 2.043 3.597 1.00 . B B . 6 LEU CD1 1 1 3 1970 2 2 6 LEU CD2 C 4.833 2.921 3.472 1.00 . B B . 6 LEU CD2 1 1 3 1971 2 2 6 LEU CG C 5.725 1.984 4.280 1.00 . B B . 6 LEU CG 1 1 3 1972 2 2 6 LEU H H 6.624 -0.914 2.638 1.00 . B B . 6 LEU H 1 1 3 1973 2 2 6 LEU HA H 6.529 -0.336 5.585 1.00 . B B . 6 LEU HA 1 1 3 1974 2 2 6 LEU HB2 H 4.705 0.343 3.262 1.00 . B B . 6 LEU HB2 1 1 3 1975 2 2 6 LEU HB3 H 4.216 0.571 4.921 1.00 . B B . 6 LEU HB3 1 1 3 1976 2 2 6 LEU HD11 H 7.018 1.687 2.581 1.00 . B B . 6 LEU HD11 1 1 3 1977 2 2 6 LEU HD12 H 7.453 3.060 3.589 1.00 . B B . 6 LEU HD12 1 1 3 1978 2 2 6 LEU HD13 H 7.802 1.449 4.142 1.00 . B B . 6 LEU HD13 1 1 3 1979 2 2 6 LEU HD21 H 3.845 2.971 3.900 1.00 . B B . 6 LEU HD21 1 1 3 1980 2 2 6 LEU HD22 H 5.247 3.919 3.462 1.00 . B B . 6 LEU HD22 1 1 3 1981 2 2 6 LEU HD23 H 4.745 2.575 2.453 1.00 . B B . 6 LEU HD23 1 1 3 1982 2 2 6 LEU HG H 5.820 2.337 5.299 1.00 . B B . 6 LEU HG 1 1 3 1983 2 2 6 LEU N N 6.966 -0.805 3.551 1.00 . B B . 6 LEU N 1 1 3 1984 2 2 6 LEU O O 4.355 -2.277 4.142 1.00 . B B . 6 LEU O 1 1 3 1985 2 2 7 CYS C C 3.883 -3.903 7.498 1.00 . B B . 7 CYS C 1 1 3 1986 2 2 7 CYS CA C 4.819 -3.888 6.258 1.00 . B B . 7 CYS CA 1 1 3 1987 2 2 7 CYS CB C 5.952 -4.946 6.356 1.00 . B B . 7 CYS CB 1 1 3 1988 2 2 7 CYS H H 6.209 -2.225 6.560 1.00 . B B . 7 CYS H 1 1 3 1989 2 2 7 CYS HA H 4.190 -4.152 5.422 1.00 . B B . 7 CYS HA 1 1 3 1990 2 2 7 CYS HB2 H 6.663 -4.749 5.568 1.00 . B B . 7 CYS HB2 1 1 3 1991 2 2 7 CYS HB3 H 6.455 -4.840 7.305 1.00 . B B . 7 CYS HB3 1 1 3 1992 2 2 7 CYS HG H 6.008 -7.061 5.467 1.00 . B B . 7 CYS HG 1 1 3 1993 2 2 7 CYS N N 5.522 -2.587 5.969 1.00 . B B . 7 CYS N 1 1 3 1994 2 2 7 CYS O O 4.151 -4.510 8.513 1.00 . B B . 7 CYS O 1 1 3 1995 2 2 7 CYS SG S 5.502 -6.692 6.197 1.00 . B B . 7 CYS SG 1 1 3 1996 2 2 8 GLY C C 1.166 -1.739 8.726 1.00 . B B . 8 GLY C 1 1 3 1997 2 2 8 GLY CA C 1.755 -3.119 8.467 1.00 . B B . 8 GLY CA 1 1 3 1998 2 2 8 GLY H H 2.638 -2.741 6.523 1.00 . B B . 8 GLY H 1 1 3 1999 2 2 8 GLY HA2 H 0.930 -3.773 8.244 1.00 . B B . 8 GLY HA2 1 1 3 2000 2 2 8 GLY HA3 H 2.208 -3.438 9.397 1.00 . B B . 8 GLY HA3 1 1 3 2001 2 2 8 GLY N N 2.783 -3.211 7.363 1.00 . B B . 8 GLY N 1 1 3 2002 2 2 8 GLY O O 0.436 -1.197 7.924 1.00 . B B . 8 GLY O 1 1 3 2003 2 2 9 ASP C C 1.244 1.258 9.211 1.00 . B B . 9 ASP C 1 1 3 2004 2 2 9 ASP CA C 1.037 0.147 10.281 1.00 . B B . 9 ASP CA 1 1 3 2005 2 2 9 ASP CB C 1.825 0.401 11.588 1.00 . B B . 9 ASP CB 1 1 3 2006 2 2 9 ASP CG C 3.286 0.594 11.226 1.00 . B B . 9 ASP CG 1 1 3 2007 2 2 9 ASP H H 2.142 -1.677 10.412 1.00 . B B . 9 ASP H 1 1 3 2008 2 2 9 ASP HA H -0.038 0.086 10.443 1.00 . B B . 9 ASP HA 1 1 3 2009 2 2 9 ASP HB2 H 1.487 1.294 12.088 1.00 . B B . 9 ASP HB2 1 1 3 2010 2 2 9 ASP HB3 H 1.772 -0.432 12.267 1.00 . B B . 9 ASP HB3 1 1 3 2011 2 2 9 ASP N N 1.513 -1.196 9.835 1.00 . B B . 9 ASP N 1 1 3 2012 2 2 9 ASP O O 0.340 1.943 8.772 1.00 . B B . 9 ASP O 1 1 3 2013 2 2 9 ASP OD1 O 3.835 -0.351 10.691 1.00 . B B . 9 ASP OD1 1 1 3 2014 2 2 9 ASP OD2 O 3.752 1.679 11.479 1.00 . B B . 9 ASP OD2 1 1 3 2015 2 2 10 HIS C C 2.176 2.056 6.373 1.00 . B B . 10 HIS C 1 1 3 2016 2 2 10 HIS CA C 2.723 2.452 7.757 1.00 . B B . 10 HIS CA 1 1 3 2017 2 2 10 HIS CB C 4.241 2.671 7.782 1.00 . B B . 10 HIS CB 1 1 3 2018 2 2 10 HIS CD2 C 5.094 4.876 6.548 1.00 . B B . 10 HIS CD2 1 1 3 2019 2 2 10 HIS CE1 C 4.353 6.235 7.927 1.00 . B B . 10 HIS CE1 1 1 3 2020 2 2 10 HIS CG C 4.470 4.157 7.543 1.00 . B B . 10 HIS CG 1 1 3 2021 2 2 10 HIS H H 3.150 0.799 9.143 1.00 . B B . 10 HIS H 1 1 3 2022 2 2 10 HIS HA H 2.204 3.355 8.047 1.00 . B B . 10 HIS HA 1 1 3 2023 2 2 10 HIS HB2 H 4.633 2.415 8.758 1.00 . B B . 10 HIS HB2 1 1 3 2024 2 2 10 HIS HB3 H 4.737 2.090 7.025 1.00 . B B . 10 HIS HB3 1 1 3 2025 2 2 10 HIS HD1 H 3.545 4.830 9.180 1.00 . B B . 10 HIS HD1 1 1 3 2026 2 2 10 HIS HD2 H 5.579 4.451 5.687 1.00 . B B . 10 HIS HD2 1 1 3 2027 2 2 10 HIS HE1 H 4.104 7.165 8.421 1.00 . B B . 10 HIS HE1 1 1 3 2028 2 2 10 HIS N N 2.455 1.398 8.777 1.00 . B B . 10 HIS N 1 1 3 2029 2 2 10 HIS ND1 N 4.038 5.052 8.357 1.00 . B B . 10 HIS ND1 1 1 3 2030 2 2 10 HIS NE2 N 5.013 6.168 6.799 1.00 . B B . 10 HIS NE2 1 1 3 2031 2 2 10 HIS O O 2.215 2.814 5.430 1.00 . B B . 10 HIS O 1 1 3 2032 2 2 11 LEU C C -0.413 0.758 5.068 1.00 . B B . 11 LEU C 1 1 3 2033 2 2 11 LEU CA C 1.078 0.366 4.985 1.00 . B B . 11 LEU CA 1 1 3 2034 2 2 11 LEU CB C 1.310 -1.156 4.943 1.00 . B B . 11 LEU CB 1 1 3 2035 2 2 11 LEU CD1 C 1.718 -1.249 2.474 1.00 . B B . 11 LEU CD1 1 1 3 2036 2 2 11 LEU CD2 C 1.011 -3.262 3.733 1.00 . B B . 11 LEU CD2 1 1 3 2037 2 2 11 LEU CG C 0.830 -1.752 3.621 1.00 . B B . 11 LEU CG 1 1 3 2038 2 2 11 LEU H H 1.645 0.311 7.085 1.00 . B B . 11 LEU H 1 1 3 2039 2 2 11 LEU HA H 1.521 0.885 4.147 1.00 . B B . 11 LEU HA 1 1 3 2040 2 2 11 LEU HB2 H 2.367 -1.343 5.050 1.00 . B B . 11 LEU HB2 1 1 3 2041 2 2 11 LEU HB3 H 0.789 -1.646 5.749 1.00 . B B . 11 LEU HB3 1 1 3 2042 2 2 11 LEU HD11 H 2.747 -1.536 2.635 1.00 . B B . 11 LEU HD11 1 1 3 2043 2 2 11 LEU HD12 H 1.398 -1.673 1.539 1.00 . B B . 11 LEU HD12 1 1 3 2044 2 2 11 LEU HD13 H 1.672 -0.176 2.377 1.00 . B B . 11 LEU HD13 1 1 3 2045 2 2 11 LEU HD21 H 2.048 -3.498 3.911 1.00 . B B . 11 LEU HD21 1 1 3 2046 2 2 11 LEU HD22 H 0.421 -3.665 4.543 1.00 . B B . 11 LEU HD22 1 1 3 2047 2 2 11 LEU HD23 H 0.713 -3.754 2.821 1.00 . B B . 11 LEU HD23 1 1 3 2048 2 2 11 LEU HG H -0.210 -1.500 3.436 1.00 . B B . 11 LEU HG 1 1 3 2049 2 2 11 LEU N N 1.654 0.866 6.279 1.00 . B B . 11 LEU N 1 1 3 2050 2 2 11 LEU O O -0.953 1.393 4.184 1.00 . B B . 11 LEU O 1 1 3 2051 2 2 12 VAL C C -2.625 2.272 6.136 1.00 . B B . 12 VAL C 1 1 3 2052 2 2 12 VAL CA C -2.512 0.739 6.290 1.00 . B B . 12 VAL CA 1 1 3 2053 2 2 12 VAL CB C -3.031 0.308 7.697 1.00 . B B . 12 VAL CB 1 1 3 2054 2 2 12 VAL CG1 C -2.174 0.855 8.820 1.00 . B B . 12 VAL CG1 1 1 3 2055 2 2 12 VAL CG2 C -4.415 0.947 7.858 1.00 . B B . 12 VAL CG2 1 1 3 2056 2 2 12 VAL H H -0.584 -0.144 6.809 1.00 . B B . 12 VAL H 1 1 3 2057 2 2 12 VAL HA H -3.095 0.286 5.502 1.00 . B B . 12 VAL HA 1 1 3 2058 2 2 12 VAL HB H -3.027 -0.769 7.811 1.00 . B B . 12 VAL HB 1 1 3 2059 2 2 12 VAL HG11 H -1.184 0.462 8.671 1.00 . B B . 12 VAL HG11 1 1 3 2060 2 2 12 VAL HG12 H -2.129 1.935 8.852 1.00 . B B . 12 VAL HG12 1 1 3 2061 2 2 12 VAL HG13 H -2.526 0.524 9.781 1.00 . B B . 12 VAL HG13 1 1 3 2062 2 2 12 VAL HG21 H -5.060 0.631 7.052 1.00 . B B . 12 VAL HG21 1 1 3 2063 2 2 12 VAL HG22 H -4.854 0.681 8.803 1.00 . B B . 12 VAL HG22 1 1 3 2064 2 2 12 VAL HG23 H -4.340 2.029 7.816 1.00 . B B . 12 VAL HG23 1 1 3 2065 2 2 12 VAL N N -1.061 0.376 6.133 1.00 . B B . 12 VAL N 1 1 3 2066 2 2 12 VAL O O -3.413 2.772 5.355 1.00 . B B . 12 VAL O 1 1 3 2067 2 2 13 GLU C C -1.457 4.868 5.469 1.00 . B B . 13 GLU C 1 1 3 2068 2 2 13 GLU CA C -1.755 4.426 6.904 1.00 . B B . 13 GLU CA 1 1 3 2069 2 2 13 GLU CB C -0.671 4.734 7.923 1.00 . B B . 13 GLU CB 1 1 3 2070 2 2 13 GLU CD C -1.706 7.015 8.305 1.00 . B B . 13 GLU CD 1 1 3 2071 2 2 13 GLU CG C -0.445 6.239 7.944 1.00 . B B . 13 GLU CG 1 1 3 2072 2 2 13 GLU H H -1.177 2.535 7.514 1.00 . B B . 13 GLU H 1 1 3 2073 2 2 13 GLU HA H -2.703 4.848 7.207 1.00 . B B . 13 GLU HA 1 1 3 2074 2 2 13 GLU HB2 H -0.994 4.411 8.905 1.00 . B B . 13 GLU HB2 1 1 3 2075 2 2 13 GLU HB3 H 0.247 4.221 7.676 1.00 . B B . 13 GLU HB3 1 1 3 2076 2 2 13 GLU HG2 H 0.292 6.459 8.691 1.00 . B B . 13 GLU HG2 1 1 3 2077 2 2 13 GLU HG3 H -0.109 6.560 6.974 1.00 . B B . 13 GLU HG3 1 1 3 2078 2 2 13 GLU N N -1.810 2.954 6.899 1.00 . B B . 13 GLU N 1 1 3 2079 2 2 13 GLU O O -2.039 5.783 4.913 1.00 . B B . 13 GLU O 1 1 3 2080 2 2 13 GLU OE1 O -2.127 6.850 9.433 1.00 . B B . 13 GLU OE1 1 1 3 2081 2 2 13 GLU OE2 O -2.165 7.713 7.422 1.00 . B B . 13 GLU OE2 1 1 3 2082 2 2 14 ALA C C -1.533 4.583 2.659 1.00 . B B . 14 ALA C 1 1 3 2083 2 2 14 ALA CA C -0.224 4.569 3.462 1.00 . B B . 14 ALA CA 1 1 3 2084 2 2 14 ALA CB C 0.807 3.576 2.857 1.00 . B B . 14 ALA CB 1 1 3 2085 2 2 14 ALA H H -0.091 3.431 5.293 1.00 . B B . 14 ALA H 1 1 3 2086 2 2 14 ALA HA H 0.106 5.570 3.584 1.00 . B B . 14 ALA HA 1 1 3 2087 2 2 14 ALA HB1 H 0.437 2.564 2.858 1.00 . B B . 14 ALA HB1 1 1 3 2088 2 2 14 ALA HB2 H 1.030 3.857 1.838 1.00 . B B . 14 ALA HB2 1 1 3 2089 2 2 14 ALA HB3 H 1.725 3.617 3.420 1.00 . B B . 14 ALA HB3 1 1 3 2090 2 2 14 ALA N N -0.535 4.174 4.848 1.00 . B B . 14 ALA N 1 1 3 2091 2 2 14 ALA O O -1.852 5.538 1.977 1.00 . B B . 14 ALA O 1 1 3 2092 2 2 15 LEU C C -4.731 4.180 2.809 1.00 . B B . 15 LEU C 1 1 3 2093 2 2 15 LEU CA C -3.569 3.454 2.047 1.00 . B B . 15 LEU CA 1 1 3 2094 2 2 15 LEU CB C -3.954 1.977 1.823 1.00 . B B . 15 LEU CB 1 1 3 2095 2 2 15 LEU CD1 C -3.588 -0.090 0.546 1.00 . B B . 15 LEU CD1 1 1 3 2096 2 2 15 LEU CD2 C -1.836 1.711 0.312 1.00 . B B . 15 LEU CD2 1 1 3 2097 2 2 15 LEU CG C -2.846 1.044 1.271 1.00 . B B . 15 LEU CG 1 1 3 2098 2 2 15 LEU H H -1.943 2.805 3.373 1.00 . B B . 15 LEU H 1 1 3 2099 2 2 15 LEU HA H -3.444 3.942 1.095 1.00 . B B . 15 LEU HA 1 1 3 2100 2 2 15 LEU HB2 H -4.233 1.594 2.787 1.00 . B B . 15 LEU HB2 1 1 3 2101 2 2 15 LEU HB3 H -4.833 1.962 1.193 1.00 . B B . 15 LEU HB3 1 1 3 2102 2 2 15 LEU HD11 H -4.207 0.301 -0.246 1.00 . B B . 15 LEU HD11 1 1 3 2103 2 2 15 LEU HD12 H -2.900 -0.787 0.105 1.00 . B B . 15 LEU HD12 1 1 3 2104 2 2 15 LEU HD13 H -4.213 -0.630 1.243 1.00 . B B . 15 LEU HD13 1 1 3 2105 2 2 15 LEU HD21 H -1.318 2.512 0.815 1.00 . B B . 15 LEU HD21 1 1 3 2106 2 2 15 LEU HD22 H -1.098 0.985 0.013 1.00 . B B . 15 LEU HD22 1 1 3 2107 2 2 15 LEU HD23 H -2.276 2.107 -0.585 1.00 . B B . 15 LEU HD23 1 1 3 2108 2 2 15 LEU HG H -2.298 0.634 2.115 1.00 . B B . 15 LEU HG 1 1 3 2109 2 2 15 LEU N N -2.274 3.523 2.790 1.00 . B B . 15 LEU N 1 1 3 2110 2 2 15 LEU O O -5.890 3.810 2.740 1.00 . B B . 15 LEU O 1 1 3 2111 2 2 16 TYR C C -5.025 7.485 3.783 1.00 . B B . 16 TYR C 1 1 3 2112 2 2 16 TYR CA C -5.296 6.066 4.334 1.00 . B B . 16 TYR CA 1 1 3 2113 2 2 16 TYR CB C -4.925 5.953 5.831 1.00 . B B . 16 TYR CB 1 1 3 2114 2 2 16 TYR CD1 C -7.021 7.368 6.350 1.00 . B B . 16 TYR CD1 1 1 3 2115 2 2 16 TYR CD2 C -5.328 7.125 7.993 1.00 . B B . 16 TYR CD2 1 1 3 2116 2 2 16 TYR CE1 C -7.743 8.162 7.226 1.00 . B B . 16 TYR CE1 1 1 3 2117 2 2 16 TYR CE2 C -6.053 7.915 8.858 1.00 . B B . 16 TYR CE2 1 1 3 2118 2 2 16 TYR CG C -5.799 6.841 6.732 1.00 . B B . 16 TYR CG 1 1 3 2119 2 2 16 TYR CZ C -7.260 8.435 8.477 1.00 . B B . 16 TYR CZ 1 1 3 2120 2 2 16 TYR H H -3.406 5.404 3.551 1.00 . B B . 16 TYR H 1 1 3 2121 2 2 16 TYR HA H -6.326 5.814 4.129 1.00 . B B . 16 TYR HA 1 1 3 2122 2 2 16 TYR HB2 H -5.001 4.930 6.168 1.00 . B B . 16 TYR HB2 1 1 3 2123 2 2 16 TYR HB3 H -3.906 6.279 5.990 1.00 . B B . 16 TYR HB3 1 1 3 2124 2 2 16 TYR HD1 H -7.418 7.170 5.367 1.00 . B B . 16 TYR HD1 1 1 3 2125 2 2 16 TYR HD2 H -4.370 6.728 8.311 1.00 . B B . 16 TYR HD2 1 1 3 2126 2 2 16 TYR HE1 H -8.696 8.578 6.939 1.00 . B B . 16 TYR HE1 1 1 3 2127 2 2 16 TYR HE2 H -5.657 8.119 9.840 1.00 . B B . 16 TYR HE2 1 1 3 2128 2 2 16 TYR HH H -7.298 9.695 9.840 1.00 . B B . 16 TYR HH 1 1 3 2129 2 2 16 TYR N N -4.364 5.198 3.527 1.00 . B B . 16 TYR N 1 1 3 2130 2 2 16 TYR O O -5.920 8.215 3.407 1.00 . B B . 16 TYR O 1 1 3 2131 2 2 16 TYR OH O -7.972 9.229 9.342 1.00 . B B . 16 TYR OH 1 1 3 2132 2 2 17 LEU C C -3.340 9.106 1.720 1.00 . B B . 17 LEU C 1 1 3 2133 2 2 17 LEU CA C -3.219 9.093 3.272 1.00 . B B . 17 LEU CA 1 1 3 2134 2 2 17 LEU CB C -1.762 9.150 3.817 1.00 . B B . 17 LEU CB 1 1 3 2135 2 2 17 LEU CD1 C 0.205 10.517 4.418 1.00 . B B . 17 LEU CD1 1 1 3 2136 2 2 17 LEU CD2 C -0.637 10.671 2.126 1.00 . B B . 17 LEU CD2 1 1 3 2137 2 2 17 LEU CG C -1.077 10.514 3.586 1.00 . B B . 17 LEU CG 1 1 3 2138 2 2 17 LEU H H -3.136 7.117 4.129 1.00 . B B . 17 LEU H 1 1 3 2139 2 2 17 LEU HA H -3.819 9.906 3.661 1.00 . B B . 17 LEU HA 1 1 3 2140 2 2 17 LEU HB2 H -1.806 8.951 4.885 1.00 . B B . 17 LEU HB2 1 1 3 2141 2 2 17 LEU HB3 H -1.177 8.356 3.374 1.00 . B B . 17 LEU HB3 1 1 3 2142 2 2 17 LEU HD11 H 0.854 9.706 4.121 1.00 . B B . 17 LEU HD11 1 1 3 2143 2 2 17 LEU HD12 H 0.734 11.450 4.301 1.00 . B B . 17 LEU HD12 1 1 3 2144 2 2 17 LEU HD13 H -0.041 10.386 5.464 1.00 . B B . 17 LEU HD13 1 1 3 2145 2 2 17 LEU HD21 H 0.036 9.877 1.841 1.00 . B B . 17 LEU HD21 1 1 3 2146 2 2 17 LEU HD22 H -1.484 10.664 1.457 1.00 . B B . 17 LEU HD22 1 1 3 2147 2 2 17 LEU HD23 H -0.131 11.617 1.999 1.00 . B B . 17 LEU HD23 1 1 3 2148 2 2 17 LEU HG H -1.735 11.324 3.883 1.00 . B B . 17 LEU HG 1 1 3 2149 2 2 17 LEU N N -3.756 7.788 3.770 1.00 . B B . 17 LEU N 1 1 3 2150 2 2 17 LEU O O -3.867 10.046 1.162 1.00 . B B . 17 LEU O 1 1 3 2151 2 2 18 VAL C C -4.375 8.325 -0.922 1.00 . B B . 18 VAL C 1 1 3 2152 2 2 18 VAL CA C -2.935 8.000 -0.462 1.00 . B B . 18 VAL CA 1 1 3 2153 2 2 18 VAL CB C -2.529 6.562 -0.859 1.00 . B B . 18 VAL CB 1 1 3 2154 2 2 18 VAL CG1 C -2.918 6.266 -2.324 1.00 . B B . 18 VAL CG1 1 1 3 2155 2 2 18 VAL CG2 C -1.026 6.443 -0.746 1.00 . B B . 18 VAL CG2 1 1 3 2156 2 2 18 VAL H H -2.429 7.352 1.539 1.00 . B B . 18 VAL H 1 1 3 2157 2 2 18 VAL HA H -2.257 8.698 -0.925 1.00 . B B . 18 VAL HA 1 1 3 2158 2 2 18 VAL HB H -2.984 5.851 -0.183 1.00 . B B . 18 VAL HB 1 1 3 2159 2 2 18 VAL HG11 H -2.453 6.966 -3.001 1.00 . B B . 18 VAL HG11 1 1 3 2160 2 2 18 VAL HG12 H -2.626 5.265 -2.601 1.00 . B B . 18 VAL HG12 1 1 3 2161 2 2 18 VAL HG13 H -3.990 6.342 -2.465 1.00 . B B . 18 VAL HG13 1 1 3 2162 2 2 18 VAL HG21 H -0.726 6.660 0.271 1.00 . B B . 18 VAL HG21 1 1 3 2163 2 2 18 VAL HG22 H -0.721 5.438 -0.992 1.00 . B B . 18 VAL HG22 1 1 3 2164 2 2 18 VAL HG23 H -0.546 7.143 -1.412 1.00 . B B . 18 VAL HG23 1 1 3 2165 2 2 18 VAL N N -2.853 8.086 1.052 1.00 . B B . 18 VAL N 1 1 3 2166 2 2 18 VAL O O -4.688 9.295 -1.583 1.00 . B B . 18 VAL O 1 1 3 2167 2 2 19 CYS C C -7.315 7.193 0.572 1.00 . B B . 19 CYS C 1 1 3 2168 2 2 19 CYS CA C -6.665 7.435 -0.804 1.00 . B B . 19 CYS CA 1 1 3 2169 2 2 19 CYS CB C -6.990 6.306 -1.729 1.00 . B B . 19 CYS CB 1 1 3 2170 2 2 19 CYS H H -4.840 6.643 -0.042 1.00 . B B . 19 CYS H 1 1 3 2171 2 2 19 CYS HA H -6.962 8.383 -1.230 1.00 . B B . 19 CYS HA 1 1 3 2172 2 2 19 CYS HB2 H -7.968 6.430 -2.167 1.00 . B B . 19 CYS HB2 1 1 3 2173 2 2 19 CYS HB3 H -6.259 6.272 -2.522 1.00 . B B . 19 CYS HB3 1 1 3 2174 2 2 19 CYS HG H -7.879 4.485 -0.700 1.00 . B B . 19 CYS HG 1 1 3 2175 2 2 19 CYS N N -5.204 7.407 -0.532 1.00 . B B . 19 CYS N 1 1 3 2176 2 2 19 CYS O O -6.850 6.340 1.313 1.00 . B B . 19 CYS O 1 1 3 2177 2 2 19 CYS SG S -6.970 4.692 -0.921 1.00 . B B . 19 CYS SG 1 1 3 2178 2 2 20 GLY C C -10.510 7.611 2.168 1.00 . B B . 20 GLY C 1 1 3 2179 2 2 20 GLY CA C -8.986 7.654 2.257 1.00 . B B . 20 GLY CA 1 1 3 2180 2 2 20 GLY H H -8.685 8.570 0.286 1.00 . B B . 20 GLY H 1 1 3 2181 2 2 20 GLY HA2 H -8.660 6.684 2.610 1.00 . B B . 20 GLY HA2 1 1 3 2182 2 2 20 GLY HA3 H -8.658 8.415 2.939 1.00 . B B . 20 GLY HA3 1 1 3 2183 2 2 20 GLY N N -8.347 7.897 0.911 1.00 . B B . 20 GLY N 1 1 3 2184 2 2 20 GLY O O -11.234 8.188 2.948 1.00 . B B . 20 GLY O 1 1 3 2185 2 2 21 GLU C C -12.860 5.160 0.889 1.00 . B B . 21 GLU C 1 1 3 2186 2 2 21 GLU CA C -12.306 6.615 0.753 1.00 . B B . 21 GLU CA 1 1 3 2187 2 2 21 GLU CB C -12.413 7.112 -0.727 1.00 . B B . 21 GLU CB 1 1 3 2188 2 2 21 GLU CD C -10.514 5.453 -1.537 1.00 . B B . 21 GLU CD 1 1 3 2189 2 2 21 GLU CG C -11.093 6.850 -1.603 1.00 . B B . 21 GLU CG 1 1 3 2190 2 2 21 GLU H H -10.182 6.505 0.634 1.00 . B B . 21 GLU H 1 1 3 2191 2 2 21 GLU HA H -12.961 7.227 1.359 1.00 . B B . 21 GLU HA 1 1 3 2192 2 2 21 GLU HB2 H -13.248 6.616 -1.207 1.00 . B B . 21 GLU HB2 1 1 3 2193 2 2 21 GLU HB3 H -12.628 8.172 -0.716 1.00 . B B . 21 GLU HB3 1 1 3 2194 2 2 21 GLU HG2 H -11.319 7.031 -2.643 1.00 . B B . 21 GLU HG2 1 1 3 2195 2 2 21 GLU HG3 H -10.310 7.533 -1.320 1.00 . B B . 21 GLU HG3 1 1 3 2196 2 2 21 GLU N N -10.895 6.892 1.168 1.00 . B B . 21 GLU N 1 1 3 2197 2 2 21 GLU O O -13.986 4.977 1.311 1.00 . B B . 21 GLU O 1 1 3 2198 2 2 21 GLU OE1 O -9.744 5.240 -0.625 1.00 . B B . 21 GLU OE1 1 1 3 2199 2 2 21 GLU OE2 O -10.837 4.644 -2.368 1.00 . B B . 21 GLU OE2 1 1 3 2200 2 2 22 ARG C C -12.069 1.979 1.878 1.00 . B B . 22 ARG C 1 1 3 2201 2 2 22 ARG CA C -12.570 2.754 0.647 1.00 . B B . 22 ARG CA 1 1 3 2202 2 2 22 ARG CB C -12.142 2.041 -0.690 1.00 . B B . 22 ARG CB 1 1 3 2203 2 2 22 ARG CD C -9.546 2.213 -0.391 1.00 . B B . 22 ARG CD 1 1 3 2204 2 2 22 ARG CG C -10.749 1.280 -0.643 1.00 . B B . 22 ARG CG 1 1 3 2205 2 2 22 ARG CZ C -8.609 3.096 1.699 1.00 . B B . 22 ARG CZ 1 1 3 2206 2 2 22 ARG H H -11.217 4.282 0.215 1.00 . B B . 22 ARG H 1 1 3 2207 2 2 22 ARG HA H -13.628 2.814 0.691 1.00 . B B . 22 ARG HA 1 1 3 2208 2 2 22 ARG HB2 H -12.922 1.359 -1.000 1.00 . B B . 22 ARG HB2 1 1 3 2209 2 2 22 ARG HB3 H -12.090 2.803 -1.459 1.00 . B B . 22 ARG HB3 1 1 3 2210 2 2 22 ARG HD2 H -8.619 1.666 -0.523 1.00 . B B . 22 ARG HD2 1 1 3 2211 2 2 22 ARG HD3 H -9.564 2.990 -1.154 1.00 . B B . 22 ARG HD3 1 1 3 2212 2 2 22 ARG HE H -10.451 3.102 1.429 1.00 . B B . 22 ARG HE 1 1 3 2213 2 2 22 ARG HG2 H -10.769 0.446 0.035 1.00 . B B . 22 ARG HG2 1 1 3 2214 2 2 22 ARG HG3 H -10.613 0.853 -1.628 1.00 . B B . 22 ARG HG3 1 1 3 2215 2 2 22 ARG HH11 H -8.580 4.664 0.681 1.00 . B B . 22 ARG HH11 1 1 3 2216 2 2 22 ARG HH12 H -7.295 4.570 1.837 1.00 . B B . 22 ARG HH12 1 1 3 2217 2 2 22 ARG HH21 H -8.580 1.502 2.873 1.00 . B B . 22 ARG HH21 1 1 3 2218 2 2 22 ARG HH22 H -7.329 2.683 3.042 1.00 . B B . 22 ARG HH22 1 1 3 2219 2 2 22 ARG N N -12.102 4.148 0.550 1.00 . B B . 22 ARG N 1 1 3 2220 2 2 22 ARG NE N -9.618 2.836 0.993 1.00 . B B . 22 ARG NE 1 1 3 2221 2 2 22 ARG NH1 N -8.103 4.182 1.408 1.00 . B B . 22 ARG NH1 1 1 3 2222 2 2 22 ARG NH2 N -8.160 2.355 2.599 1.00 . B B . 22 ARG NH2 1 1 3 2223 2 2 22 ARG O O -11.538 2.503 2.835 1.00 . B B . 22 ARG O 1 1 3 2224 2 2 23 GLY C C -10.579 -1.091 2.561 1.00 . B B . 23 GLY C 1 1 3 2225 2 2 23 GLY CA C -11.820 -0.249 2.865 1.00 . B B . 23 GLY CA 1 1 3 2226 2 2 23 GLY H H -12.644 0.460 0.920 1.00 . B B . 23 GLY H 1 1 3 2227 2 2 23 GLY HA2 H -11.628 0.289 3.783 1.00 . B B . 23 GLY HA2 1 1 3 2228 2 2 23 GLY HA3 H -12.627 -0.943 3.057 1.00 . B B . 23 GLY HA3 1 1 3 2229 2 2 23 GLY N N -12.237 0.708 1.772 1.00 . B B . 23 GLY N 1 1 3 2230 2 2 23 GLY O O -10.518 -2.216 2.995 1.00 . B B . 23 GLY O 1 1 3 2231 2 2 24 PHE C C -8.566 -2.572 0.594 1.00 . B B . 24 PHE C 1 1 3 2232 2 2 24 PHE CA C -8.354 -1.311 1.499 1.00 . B B . 24 PHE CA 1 1 3 2233 2 2 24 PHE CB C -7.674 -1.728 2.850 1.00 . B B . 24 PHE CB 1 1 3 2234 2 2 24 PHE CD1 C -6.387 0.290 3.678 1.00 . B B . 24 PHE CD1 1 1 3 2235 2 2 24 PHE CD2 C -8.456 -0.218 4.714 1.00 . B B . 24 PHE CD2 1 1 3 2236 2 2 24 PHE CE1 C -6.243 1.385 4.511 1.00 . B B . 24 PHE CE1 1 1 3 2237 2 2 24 PHE CE2 C -8.318 0.871 5.545 1.00 . B B . 24 PHE CE2 1 1 3 2238 2 2 24 PHE CG C -7.495 -0.518 3.773 1.00 . B B . 24 PHE CG 1 1 3 2239 2 2 24 PHE CZ C -7.208 1.674 5.443 1.00 . B B . 24 PHE CZ 1 1 3 2240 2 2 24 PHE H H -9.757 0.372 1.516 1.00 . B B . 24 PHE H 1 1 3 2241 2 2 24 PHE HA H -7.683 -0.656 0.963 1.00 . B B . 24 PHE HA 1 1 3 2242 2 2 24 PHE HB2 H -8.272 -2.471 3.362 1.00 . B B . 24 PHE HB2 1 1 3 2243 2 2 24 PHE HB3 H -6.702 -2.162 2.669 1.00 . B B . 24 PHE HB3 1 1 3 2244 2 2 24 PHE HD1 H -5.626 0.057 2.949 1.00 . B B . 24 PHE HD1 1 1 3 2245 2 2 24 PHE HD2 H -9.327 -0.852 4.805 1.00 . B B . 24 PHE HD2 1 1 3 2246 2 2 24 PHE HE1 H -5.371 2.023 4.444 1.00 . B B . 24 PHE HE1 1 1 3 2247 2 2 24 PHE HE2 H -9.080 1.094 6.280 1.00 . B B . 24 PHE HE2 1 1 3 2248 2 2 24 PHE HZ H -7.091 2.530 6.095 1.00 . B B . 24 PHE HZ 1 1 3 2249 2 2 24 PHE N N -9.626 -0.544 1.839 1.00 . B B . 24 PHE N 1 1 3 2250 2 2 24 PHE O O -8.875 -3.641 1.074 1.00 . B B . 24 PHE O 1 1 3 2251 2 2 25 PHE C C -7.295 -4.536 -1.639 1.00 . B B . 25 PHE C 1 1 3 2252 2 2 25 PHE CA C -8.597 -3.693 -1.559 1.00 . B B . 25 PHE CA 1 1 3 2253 2 2 25 PHE CB C -9.060 -3.189 -2.959 1.00 . B B . 25 PHE CB 1 1 3 2254 2 2 25 PHE CD1 C -10.354 -5.303 -3.491 1.00 . B B . 25 PHE CD1 1 1 3 2255 2 2 25 PHE CD2 C -8.697 -4.595 -5.035 1.00 . B B . 25 PHE CD2 1 1 3 2256 2 2 25 PHE CE1 C -10.642 -6.389 -4.290 1.00 . B B . 25 PHE CE1 1 1 3 2257 2 2 25 PHE CE2 C -8.981 -5.682 -5.839 1.00 . B B . 25 PHE CE2 1 1 3 2258 2 2 25 PHE CG C -9.380 -4.397 -3.855 1.00 . B B . 25 PHE CG 1 1 3 2259 2 2 25 PHE CZ C -9.955 -6.581 -5.466 1.00 . B B . 25 PHE CZ 1 1 3 2260 2 2 25 PHE H H -8.098 -1.626 -1.104 1.00 . B B . 25 PHE H 1 1 3 2261 2 2 25 PHE HA H -9.362 -4.323 -1.126 1.00 . B B . 25 PHE HA 1 1 3 2262 2 2 25 PHE HB2 H -9.947 -2.577 -2.880 1.00 . B B . 25 PHE HB2 1 1 3 2263 2 2 25 PHE HB3 H -8.278 -2.609 -3.423 1.00 . B B . 25 PHE HB3 1 1 3 2264 2 2 25 PHE HD1 H -10.899 -5.159 -2.570 1.00 . B B . 25 PHE HD1 1 1 3 2265 2 2 25 PHE HD2 H -7.933 -3.892 -5.332 1.00 . B B . 25 PHE HD2 1 1 3 2266 2 2 25 PHE HE1 H -11.407 -7.093 -3.991 1.00 . B B . 25 PHE HE1 1 1 3 2267 2 2 25 PHE HE2 H -8.439 -5.826 -6.763 1.00 . B B . 25 PHE HE2 1 1 3 2268 2 2 25 PHE HZ H -10.178 -7.432 -6.094 1.00 . B B . 25 PHE HZ 1 1 3 2269 2 2 25 PHE N N -8.384 -2.470 -0.695 1.00 . B B . 25 PHE N 1 1 3 2270 2 2 25 PHE O O -6.590 -4.559 -2.633 1.00 . B B . 25 PHE O 1 1 3 2271 2 2 26 TYR C C -5.933 -7.524 0.061 1.00 . B B . 26 TYR C 1 1 3 2272 2 2 26 TYR CA C -5.766 -6.071 -0.476 1.00 . B B . 26 TYR CA 1 1 3 2273 2 2 26 TYR CB C -4.727 -5.277 0.381 1.00 . B B . 26 TYR CB 1 1 3 2274 2 2 26 TYR CD1 C -6.159 -4.905 2.456 1.00 . B B . 26 TYR CD1 1 1 3 2275 2 2 26 TYR CD2 C -4.052 -5.955 2.718 1.00 . B B . 26 TYR CD2 1 1 3 2276 2 2 26 TYR CE1 C -6.378 -5.004 3.817 1.00 . B B . 26 TYR CE1 1 1 3 2277 2 2 26 TYR CE2 C -4.278 -6.050 4.079 1.00 . B B . 26 TYR CE2 1 1 3 2278 2 2 26 TYR CG C -4.995 -5.379 1.892 1.00 . B B . 26 TYR CG 1 1 3 2279 2 2 26 TYR CZ C -5.438 -5.577 4.629 1.00 . B B . 26 TYR CZ 1 1 3 2280 2 2 26 TYR H H -7.622 -5.133 0.205 1.00 . B B . 26 TYR H 1 1 3 2281 2 2 26 TYR HA H -5.386 -6.200 -1.477 1.00 . B B . 26 TYR HA 1 1 3 2282 2 2 26 TYR HB2 H -3.729 -5.632 0.175 1.00 . B B . 26 TYR HB2 1 1 3 2283 2 2 26 TYR HB3 H -4.772 -4.232 0.105 1.00 . B B . 26 TYR HB3 1 1 3 2284 2 2 26 TYR HD1 H -6.912 -4.451 1.835 1.00 . B B . 26 TYR HD1 1 1 3 2285 2 2 26 TYR HD2 H -3.130 -6.335 2.302 1.00 . B B . 26 TYR HD2 1 1 3 2286 2 2 26 TYR HE1 H -7.296 -4.629 4.245 1.00 . B B . 26 TYR HE1 1 1 3 2287 2 2 26 TYR HE2 H -3.548 -6.499 4.735 1.00 . B B . 26 TYR HE2 1 1 3 2288 2 2 26 TYR HH H -6.581 -5.516 6.121 1.00 . B B . 26 TYR HH 1 1 3 2289 2 2 26 TYR N N -7.003 -5.208 -0.554 1.00 . B B . 26 TYR N 1 1 3 2290 2 2 26 TYR O O -7.021 -7.972 0.343 1.00 . B B . 26 TYR O 1 1 3 2291 2 2 26 TYR OH O -5.647 -5.680 5.983 1.00 . B B . 26 TYR OH 1 1 3 2292 2 2 27 THR C C -3.635 -10.412 -0.231 1.00 . B B . 27 THR C 1 1 3 2293 2 2 27 THR CA C -4.604 -9.609 0.660 1.00 . B B . 27 THR CA 1 1 3 2294 2 2 27 THR CB C -5.976 -10.418 0.738 1.00 . B B . 27 THR CB 1 1 3 2295 2 2 27 THR CG2 C -6.697 -10.730 -0.569 1.00 . B B . 27 THR CG2 1 1 3 2296 2 2 27 THR H H -3.998 -7.686 -0.077 1.00 . B B . 27 THR H 1 1 3 2297 2 2 27 THR HA H -4.180 -9.592 1.651 1.00 . B B . 27 THR HA 1 1 3 2298 2 2 27 THR HB H -6.640 -10.007 1.493 1.00 . B B . 27 THR HB 1 1 3 2299 2 2 27 THR HG1 H -6.435 -12.243 1.066 1.00 . B B . 27 THR HG1 1 1 3 2300 2 2 27 THR HG21 H -6.923 -9.820 -1.100 1.00 . B B . 27 THR HG21 1 1 3 2301 2 2 27 THR HG22 H -6.126 -11.379 -1.208 1.00 . B B . 27 THR HG22 1 1 3 2302 2 2 27 THR HG23 H -7.627 -11.227 -0.339 1.00 . B B . 27 THR HG23 1 1 3 2303 2 2 27 THR N N -4.801 -8.179 0.175 1.00 . B B . 27 THR N 1 1 3 2304 2 2 27 THR O O -2.553 -10.747 0.212 1.00 . B B . 27 THR O 1 1 3 2305 2 2 27 THR OG1 O -5.597 -11.745 1.075 1.00 . B B . 27 THR OG1 1 1 3 2306 2 2 28 PRO C C -2.893 -13.045 -1.225 1.00 . B B . 28 PRO C 1 1 3 2307 2 2 28 PRO CA C -3.594 -11.981 -2.129 1.00 . B B . 28 PRO CA 1 1 3 2308 2 2 28 PRO CB C -2.735 -11.482 -3.305 1.00 . B B . 28 PRO CB 1 1 3 2309 2 2 28 PRO CD C -3.758 -9.521 -2.369 1.00 . B B . 28 PRO CD 1 1 3 2310 2 2 28 PRO CG C -3.492 -10.204 -3.717 1.00 . B B . 28 PRO CG 1 1 3 2311 2 2 28 PRO HA H -4.482 -12.457 -2.521 1.00 . B B . 28 PRO HA 1 1 3 2312 2 2 28 PRO HB2 H -1.724 -11.267 -2.985 1.00 . B B . 28 PRO HB2 1 1 3 2313 2 2 28 PRO HB3 H -2.711 -12.212 -4.104 1.00 . B B . 28 PRO HB3 1 1 3 2314 2 2 28 PRO HD2 H -2.897 -8.947 -2.044 1.00 . B B . 28 PRO HD2 1 1 3 2315 2 2 28 PRO HD3 H -4.642 -8.897 -2.407 1.00 . B B . 28 PRO HD3 1 1 3 2316 2 2 28 PRO HG2 H -2.888 -9.581 -4.361 1.00 . B B . 28 PRO HG2 1 1 3 2317 2 2 28 PRO HG3 H -4.423 -10.443 -4.216 1.00 . B B . 28 PRO HG3 1 1 3 2318 2 2 28 PRO N N -4.001 -10.685 -1.463 1.00 . B B . 28 PRO N 1 1 3 2319 2 2 28 PRO O O -1.877 -13.625 -1.565 1.00 . B B . 28 PRO O 1 1 3 2320 2 2 29 LYS C C -4.047 -15.135 1.545 1.00 . B B . 29 LYS C 1 1 3 2321 2 2 29 LYS CA C -2.956 -14.235 0.932 1.00 . B B . 29 LYS CA 1 1 3 2322 2 2 29 LYS CB C -2.208 -13.384 2.009 1.00 . B B . 29 LYS CB 1 1 3 2323 2 2 29 LYS CD C 0.088 -13.964 0.972 1.00 . B B . 29 LYS CD 1 1 3 2324 2 2 29 LYS CE C 0.191 -12.587 0.313 1.00 . B B . 29 LYS CE 1 1 3 2325 2 2 29 LYS CG C -0.787 -13.954 2.281 1.00 . B B . 29 LYS CG 1 1 3 2326 2 2 29 LYS H H -4.277 -12.724 0.140 1.00 . B B . 29 LYS H 1 1 3 2327 2 2 29 LYS HA H -2.324 -14.927 0.432 1.00 . B B . 29 LYS HA 1 1 3 2328 2 2 29 LYS HB2 H -2.150 -12.352 1.699 1.00 . B B . 29 LYS HB2 1 1 3 2329 2 2 29 LYS HB3 H -2.776 -13.387 2.930 1.00 . B B . 29 LYS HB3 1 1 3 2330 2 2 29 LYS HD2 H 1.088 -14.286 1.226 1.00 . B B . 29 LYS HD2 1 1 3 2331 2 2 29 LYS HD3 H -0.311 -14.660 0.248 1.00 . B B . 29 LYS HD3 1 1 3 2332 2 2 29 LYS HE2 H -0.782 -12.233 -0.005 1.00 . B B . 29 LYS HE2 1 1 3 2333 2 2 29 LYS HE3 H 0.607 -11.857 1.001 1.00 . B B . 29 LYS HE3 1 1 3 2334 2 2 29 LYS HG2 H -0.305 -13.361 3.050 1.00 . B B . 29 LYS HG2 1 1 3 2335 2 2 29 LYS HG3 H -0.878 -14.965 2.664 1.00 . B B . 29 LYS HG3 1 1 3 2336 2 2 29 LYS HZ1 H 1.455 -13.717 -0.989 1.00 . B B . 29 LYS HZ1 1 1 3 2337 2 2 29 LYS HZ2 H 0.685 -12.463 -1.767 1.00 . B B . 29 LYS HZ2 1 1 3 2338 2 2 29 LYS HZ3 H 1.920 -12.144 -0.791 1.00 . B B . 29 LYS HZ3 1 1 3 2339 2 2 29 LYS N N -3.477 -13.248 -0.074 1.00 . B B . 29 LYS N 1 1 3 2340 2 2 29 LYS NZ N 1.084 -12.766 -0.856 1.00 . B B . 29 LYS NZ 1 1 3 2341 2 2 29 LYS O O -3.937 -16.334 1.674 1.00 . B B . 29 LYS O 1 1 3 2342 2 2 30 THR C C -7.628 -14.636 1.899 1.00 . B B . 30 THR C 1 1 3 2343 2 2 30 THR CA C -6.310 -15.103 2.542 1.00 . B B . 30 THR CA 1 1 3 2344 2 2 30 THR CB C -6.340 -14.768 4.041 1.00 . B B . 30 THR CB 1 1 3 2345 2 2 30 THR CG2 C -6.641 -13.312 4.333 1.00 . B B . 30 THR CG2 1 1 3 2346 2 2 30 THR H H -5.032 -13.508 1.725 1.00 . B B . 30 THR H 1 1 3 2347 2 2 30 THR HA H -6.264 -16.176 2.428 1.00 . B B . 30 THR HA 1 1 3 2348 2 2 30 THR HB H -5.485 -15.163 4.581 1.00 . B B . 30 THR HB 1 1 3 2349 2 2 30 THR HG1 H -7.401 -15.819 5.304 1.00 . B B . 30 THR HG1 1 1 3 2350 2 2 30 THR HG21 H -5.897 -12.672 3.884 1.00 . B B . 30 THR HG21 1 1 3 2351 2 2 30 THR HG22 H -7.611 -13.037 3.947 1.00 . B B . 30 THR HG22 1 1 3 2352 2 2 30 THR HG23 H -6.645 -13.150 5.400 1.00 . B B . 30 THR HG23 1 1 3 2353 2 2 30 THR N N -5.088 -14.466 1.908 1.00 . B B . 30 THR N 1 1 3 2354 2 2 30 THR O O -7.655 -13.596 1.263 1.00 . B B . 30 THR O 1 1 3 2355 2 2 30 THR OG1 O -7.554 -15.351 4.477 1.00 . B B . 30 THR OG1 1 1 4 2356 1 1 1 GLY C C -1.402 -5.926 -1.482 1.00 . A A . 1 GLY C 1 1 4 2357 1 1 1 GLY CA C -2.528 -6.706 -2.142 1.00 . A A . 1 GLY CA 1 1 4 2358 1 1 1 GLY HA2 H -3.418 -6.107 -2.069 1.00 . A A . 1 GLY HA2 1 1 4 2359 1 1 1 GLY HA3 H -2.676 -7.595 -1.546 1.00 . A A . 1 GLY HA3 1 1 4 2360 1 1 1 GLY N N -2.259 -7.110 -3.574 1.00 . A A . 1 GLY N 1 1 4 2361 1 1 1 GLY O O -1.231 -6.005 -0.286 1.00 . A A . 1 GLY O 1 1 4 2362 1 1 2 ILE C C 1.703 -5.278 -1.344 1.00 . A A . 2 ILE C 1 1 4 2363 1 1 2 ILE CA C 0.502 -4.350 -1.747 1.00 . A A . 2 ILE CA 1 1 4 2364 1 1 2 ILE CB C 0.053 -3.512 -0.474 1.00 . A A . 2 ILE CB 1 1 4 2365 1 1 2 ILE CD1 C -1.844 -2.856 0.977 1.00 . A A . 2 ILE CD1 1 1 4 2366 1 1 2 ILE CG1 C -1.400 -2.993 -0.504 1.00 . A A . 2 ILE CG1 1 1 4 2367 1 1 2 ILE CG2 C 0.908 -2.252 -0.416 1.00 . A A . 2 ILE CG2 1 1 4 2368 1 1 2 ILE H H -0.903 -5.184 -3.211 1.00 . A A . 2 ILE H 1 1 4 2369 1 1 2 ILE HA H 0.863 -3.698 -2.530 1.00 . A A . 2 ILE HA 1 1 4 2370 1 1 2 ILE HB H 0.206 -4.088 0.430 1.00 . A A . 2 ILE HB 1 1 4 2371 1 1 2 ILE HD11 H -1.207 -2.165 1.518 1.00 . A A . 2 ILE HD11 1 1 4 2372 1 1 2 ILE HD12 H -2.865 -2.516 1.025 1.00 . A A . 2 ILE HD12 1 1 4 2373 1 1 2 ILE HD13 H -1.789 -3.810 1.479 1.00 . A A . 2 ILE HD13 1 1 4 2374 1 1 2 ILE HG12 H -1.443 -2.031 -1.000 1.00 . A A . 2 ILE HG12 1 1 4 2375 1 1 2 ILE HG13 H -2.066 -3.661 -1.025 1.00 . A A . 2 ILE HG13 1 1 4 2376 1 1 2 ILE HG21 H 0.794 -1.679 -1.324 1.00 . A A . 2 ILE HG21 1 1 4 2377 1 1 2 ILE HG22 H 0.606 -1.630 0.413 1.00 . A A . 2 ILE HG22 1 1 4 2378 1 1 2 ILE HG23 H 1.943 -2.498 -0.294 1.00 . A A . 2 ILE HG23 1 1 4 2379 1 1 2 ILE N N -0.664 -5.185 -2.264 1.00 . A A . 2 ILE N 1 1 4 2380 1 1 2 ILE O O 2.770 -5.331 -1.924 1.00 . A A . 2 ILE O 1 1 4 2381 1 1 3 VAL C C 3.759 -7.394 -0.195 1.00 . A A . 3 VAL C 1 1 4 2382 1 1 3 VAL CA C 2.364 -7.003 0.352 1.00 . A A . 3 VAL CA 1 1 4 2383 1 1 3 VAL CB C 1.473 -8.286 0.558 1.00 . A A . 3 VAL CB 1 1 4 2384 1 1 3 VAL CG1 C 0.399 -8.014 1.604 1.00 . A A . 3 VAL CG1 1 1 4 2385 1 1 3 VAL CG2 C 0.723 -8.602 -0.771 1.00 . A A . 3 VAL CG2 1 1 4 2386 1 1 3 VAL H H 0.555 -5.892 0.081 1.00 . A A . 3 VAL H 1 1 4 2387 1 1 3 VAL HA H 2.627 -6.556 1.293 1.00 . A A . 3 VAL HA 1 1 4 2388 1 1 3 VAL HB H 2.089 -9.113 0.889 1.00 . A A . 3 VAL HB 1 1 4 2389 1 1 3 VAL HG11 H -0.223 -7.201 1.283 1.00 . A A . 3 VAL HG11 1 1 4 2390 1 1 3 VAL HG12 H -0.245 -8.866 1.751 1.00 . A A . 3 VAL HG12 1 1 4 2391 1 1 3 VAL HG13 H 0.827 -7.748 2.559 1.00 . A A . 3 VAL HG13 1 1 4 2392 1 1 3 VAL HG21 H 0.113 -7.775 -1.082 1.00 . A A . 3 VAL HG21 1 1 4 2393 1 1 3 VAL HG22 H 1.418 -8.808 -1.573 1.00 . A A . 3 VAL HG22 1 1 4 2394 1 1 3 VAL HG23 H 0.059 -9.441 -0.680 1.00 . A A . 3 VAL HG23 1 1 4 2395 1 1 3 VAL N N 1.446 -6.008 -0.305 1.00 . A A . 3 VAL N 1 1 4 2396 1 1 3 VAL O O 4.647 -6.563 -0.202 1.00 . A A . 3 VAL O 1 1 4 2397 1 1 4 GLU C C 5.939 -8.323 -2.334 1.00 . A A . 4 GLU C 1 1 4 2398 1 1 4 GLU CA C 5.255 -9.096 -1.173 1.00 . A A . 4 GLU CA 1 1 4 2399 1 1 4 GLU CB C 5.015 -10.600 -1.539 1.00 . A A . 4 GLU CB 1 1 4 2400 1 1 4 GLU CD C 3.008 -11.368 0.004 1.00 . A A . 4 GLU CD 1 1 4 2401 1 1 4 GLU CG C 4.500 -11.421 -0.263 1.00 . A A . 4 GLU CG 1 1 4 2402 1 1 4 GLU H H 3.192 -9.247 -0.626 1.00 . A A . 4 GLU H 1 1 4 2403 1 1 4 GLU HA H 5.965 -9.024 -0.360 1.00 . A A . 4 GLU HA 1 1 4 2404 1 1 4 GLU HB2 H 4.285 -10.664 -2.338 1.00 . A A . 4 GLU HB2 1 1 4 2405 1 1 4 GLU HB3 H 5.934 -11.037 -1.904 1.00 . A A . 4 GLU HB3 1 1 4 2406 1 1 4 GLU HG2 H 4.746 -12.464 -0.381 1.00 . A A . 4 GLU HG2 1 1 4 2407 1 1 4 GLU HG3 H 4.986 -11.068 0.632 1.00 . A A . 4 GLU HG3 1 1 4 2408 1 1 4 GLU N N 3.937 -8.610 -0.636 1.00 . A A . 4 GLU N 1 1 4 2409 1 1 4 GLU O O 6.896 -8.774 -2.939 1.00 . A A . 4 GLU O 1 1 4 2410 1 1 4 GLU OE1 O 2.248 -11.025 -0.876 1.00 . A A . 4 GLU OE1 1 1 4 2411 1 1 4 GLU OE2 O 2.611 -11.678 1.108 1.00 . A A . 4 GLU OE2 1 1 4 2412 1 1 5 GLN C C 6.289 -4.900 -3.025 1.00 . A A . 5 GLN C 1 1 4 2413 1 1 5 GLN CA C 5.963 -6.271 -3.681 1.00 . A A . 5 GLN CA 1 1 4 2414 1 1 5 GLN CB C 4.866 -6.194 -4.766 1.00 . A A . 5 GLN CB 1 1 4 2415 1 1 5 GLN CD C 6.584 -6.175 -6.712 1.00 . A A . 5 GLN CD 1 1 4 2416 1 1 5 GLN CG C 5.418 -5.458 -6.043 1.00 . A A . 5 GLN CG 1 1 4 2417 1 1 5 GLN H H 4.658 -6.867 -2.092 1.00 . A A . 5 GLN H 1 1 4 2418 1 1 5 GLN HA H 6.894 -6.647 -4.087 1.00 . A A . 5 GLN HA 1 1 4 2419 1 1 5 GLN HB2 H 4.562 -7.202 -5.018 1.00 . A A . 5 GLN HB2 1 1 4 2420 1 1 5 GLN HB3 H 4.005 -5.672 -4.370 1.00 . A A . 5 GLN HB3 1 1 4 2421 1 1 5 GLN HE21 H 5.491 -7.055 -8.093 1.00 . A A . 5 GLN HE21 1 1 4 2422 1 1 5 GLN HE22 H 7.172 -7.359 -8.113 1.00 . A A . 5 GLN HE22 1 1 4 2423 1 1 5 GLN HG2 H 4.647 -5.302 -6.781 1.00 . A A . 5 GLN HG2 1 1 4 2424 1 1 5 GLN HG3 H 5.810 -4.505 -5.749 1.00 . A A . 5 GLN HG3 1 1 4 2425 1 1 5 GLN N N 5.430 -7.162 -2.610 1.00 . A A . 5 GLN N 1 1 4 2426 1 1 5 GLN NE2 N 6.386 -6.927 -7.730 1.00 . A A . 5 GLN NE2 1 1 4 2427 1 1 5 GLN O O 7.296 -4.291 -3.321 1.00 . A A . 5 GLN O 1 1 4 2428 1 1 5 GLN OE1 O 7.724 -6.073 -6.329 1.00 . A A . 5 GLN OE1 1 1 4 2429 1 1 6 CYS C C 6.323 -3.204 -0.045 1.00 . A A . 6 CYS C 1 1 4 2430 1 1 6 CYS CA C 5.641 -3.132 -1.438 1.00 . A A . 6 CYS CA 1 1 4 2431 1 1 6 CYS CB C 4.259 -2.522 -1.327 1.00 . A A . 6 CYS CB 1 1 4 2432 1 1 6 CYS H H 4.628 -4.977 -1.913 1.00 . A A . 6 CYS H 1 1 4 2433 1 1 6 CYS HA H 6.261 -2.485 -2.044 1.00 . A A . 6 CYS HA 1 1 4 2434 1 1 6 CYS HB2 H 3.718 -3.148 -0.638 1.00 . A A . 6 CYS HB2 1 1 4 2435 1 1 6 CYS HB3 H 4.354 -1.540 -0.882 1.00 . A A . 6 CYS HB3 1 1 4 2436 1 1 6 CYS HG H 3.280 -1.401 -3.053 1.00 . A A . 6 CYS HG 1 1 4 2437 1 1 6 CYS N N 5.438 -4.454 -2.138 1.00 . A A . 6 CYS N 1 1 4 2438 1 1 6 CYS O O 6.964 -2.271 0.396 1.00 . A A . 6 CYS O 1 1 4 2439 1 1 6 CYS SG S 3.259 -2.334 -2.827 1.00 . A A . 6 CYS SG 1 1 4 2440 1 1 7 CYS C C 7.982 -5.501 1.983 1.00 . A A . 7 CYS C 1 1 4 2441 1 1 7 CYS CA C 6.751 -4.550 1.972 1.00 . A A . 7 CYS CA 1 1 4 2442 1 1 7 CYS CB C 5.549 -5.069 2.786 1.00 . A A . 7 CYS CB 1 1 4 2443 1 1 7 CYS H H 5.641 -5.042 0.190 1.00 . A A . 7 CYS H 1 1 4 2444 1 1 7 CYS HA H 7.086 -3.609 2.387 1.00 . A A . 7 CYS HA 1 1 4 2445 1 1 7 CYS HB2 H 4.885 -4.221 2.901 1.00 . A A . 7 CYS HB2 1 1 4 2446 1 1 7 CYS HB3 H 5.003 -5.775 2.179 1.00 . A A . 7 CYS HB3 1 1 4 2447 1 1 7 CYS HG H 6.138 -6.700 4.297 1.00 . A A . 7 CYS HG 1 1 4 2448 1 1 7 CYS N N 6.162 -4.322 0.605 1.00 . A A . 7 CYS N 1 1 4 2449 1 1 7 CYS O O 8.521 -5.863 3.008 1.00 . A A . 7 CYS O 1 1 4 2450 1 1 7 CYS SG S 5.851 -5.791 4.422 1.00 . A A . 7 CYS SG 1 1 4 2451 1 1 8 THR C C 10.473 -6.288 -0.567 1.00 . A A . 8 THR C 1 1 4 2452 1 1 8 THR CA C 9.553 -6.792 0.549 1.00 . A A . 8 THR CA 1 1 4 2453 1 1 8 THR CB C 9.056 -8.164 0.140 1.00 . A A . 8 THR CB 1 1 4 2454 1 1 8 THR CG2 C 8.083 -8.749 1.132 1.00 . A A . 8 THR CG2 1 1 4 2455 1 1 8 THR H H 7.862 -5.518 0.046 1.00 . A A . 8 THR H 1 1 4 2456 1 1 8 THR HA H 10.140 -6.885 1.446 1.00 . A A . 8 THR HA 1 1 4 2457 1 1 8 THR HB H 9.838 -8.844 -0.186 1.00 . A A . 8 THR HB 1 1 4 2458 1 1 8 THR HG1 H 8.191 -8.507 -1.599 1.00 . A A . 8 THR HG1 1 1 4 2459 1 1 8 THR HG21 H 8.550 -8.842 2.101 1.00 . A A . 8 THR HG21 1 1 4 2460 1 1 8 THR HG22 H 7.219 -8.110 1.230 1.00 . A A . 8 THR HG22 1 1 4 2461 1 1 8 THR HG23 H 7.757 -9.725 0.803 1.00 . A A . 8 THR HG23 1 1 4 2462 1 1 8 THR N N 8.372 -5.867 0.801 1.00 . A A . 8 THR N 1 1 4 2463 1 1 8 THR O O 11.682 -6.309 -0.479 1.00 . A A . 8 THR O 1 1 4 2464 1 1 8 THR OG1 O 8.174 -7.821 -0.912 1.00 . A A . 8 THR OG1 1 1 4 2465 1 1 9 SER C C 10.235 -3.769 -2.988 1.00 . A A . 9 SER C 1 1 4 2466 1 1 9 SER CA C 10.447 -5.309 -2.856 1.00 . A A . 9 SER CA 1 1 4 2467 1 1 9 SER CB C 9.813 -6.143 -3.994 1.00 . A A . 9 SER CB 1 1 4 2468 1 1 9 SER H H 8.840 -5.931 -1.529 1.00 . A A . 9 SER H 1 1 4 2469 1 1 9 SER HA H 11.513 -5.480 -2.837 1.00 . A A . 9 SER HA 1 1 4 2470 1 1 9 SER HB2 H 10.090 -7.184 -3.887 1.00 . A A . 9 SER HB2 1 1 4 2471 1 1 9 SER HB3 H 8.741 -6.062 -3.935 1.00 . A A . 9 SER HB3 1 1 4 2472 1 1 9 SER HG H 9.478 -5.741 -5.823 1.00 . A A . 9 SER HG 1 1 4 2473 1 1 9 SER N N 9.813 -5.862 -1.604 1.00 . A A . 9 SER N 1 1 4 2474 1 1 9 SER O O 10.383 -3.069 -2.005 1.00 . A A . 9 SER O 1 1 4 2475 1 1 9 SER OG O 10.264 -5.656 -5.255 1.00 . A A . 9 SER OG 1 1 4 2476 1 1 10 ILE C C 8.368 -1.410 -5.061 1.00 . A A . 10 ILE C 1 1 4 2477 1 1 10 ILE CA C 9.698 -1.777 -4.361 1.00 . A A . 10 ILE CA 1 1 4 2478 1 1 10 ILE CB C 10.900 -1.204 -5.183 1.00 . A A . 10 ILE CB 1 1 4 2479 1 1 10 ILE CD1 C 13.436 -1.038 -5.211 1.00 . A A . 10 ILE CD1 1 1 4 2480 1 1 10 ILE CG1 C 12.189 -1.372 -4.350 1.00 . A A . 10 ILE CG1 1 1 4 2481 1 1 10 ILE CG2 C 10.651 0.322 -5.389 1.00 . A A . 10 ILE CG2 1 1 4 2482 1 1 10 ILE H H 9.825 -3.931 -4.860 1.00 . A A . 10 ILE H 1 1 4 2483 1 1 10 ILE HA H 9.696 -1.286 -3.401 1.00 . A A . 10 ILE HA 1 1 4 2484 1 1 10 ILE HB H 10.975 -1.728 -6.129 1.00 . A A . 10 ILE HB 1 1 4 2485 1 1 10 ILE HD11 H 13.483 -1.704 -6.062 1.00 . A A . 10 ILE HD11 1 1 4 2486 1 1 10 ILE HD12 H 13.412 -0.022 -5.573 1.00 . A A . 10 ILE HD12 1 1 4 2487 1 1 10 ILE HD13 H 14.335 -1.170 -4.626 1.00 . A A . 10 ILE HD13 1 1 4 2488 1 1 10 ILE HG12 H 12.142 -0.733 -3.478 1.00 . A A . 10 ILE HG12 1 1 4 2489 1 1 10 ILE HG13 H 12.253 -2.392 -3.994 1.00 . A A . 10 ILE HG13 1 1 4 2490 1 1 10 ILE HG21 H 10.537 0.798 -4.429 1.00 . A A . 10 ILE HG21 1 1 4 2491 1 1 10 ILE HG22 H 11.471 0.780 -5.919 1.00 . A A . 10 ILE HG22 1 1 4 2492 1 1 10 ILE HG23 H 9.748 0.492 -5.959 1.00 . A A . 10 ILE HG23 1 1 4 2493 1 1 10 ILE N N 9.917 -3.266 -4.148 1.00 . A A . 10 ILE N 1 1 4 2494 1 1 10 ILE O O 8.253 -1.343 -6.269 1.00 . A A . 10 ILE O 1 1 4 2495 1 1 11 CYS C C 5.281 0.226 -3.911 1.00 . A A . 11 CYS C 1 1 4 2496 1 1 11 CYS CA C 6.022 -0.810 -4.789 1.00 . A A . 11 CYS CA 1 1 4 2497 1 1 11 CYS CB C 5.351 -2.175 -4.918 1.00 . A A . 11 CYS CB 1 1 4 2498 1 1 11 CYS H H 7.541 -1.235 -3.301 1.00 . A A . 11 CYS H 1 1 4 2499 1 1 11 CYS HA H 6.134 -0.380 -5.773 1.00 . A A . 11 CYS HA 1 1 4 2500 1 1 11 CYS HB2 H 5.725 -2.561 -5.854 1.00 . A A . 11 CYS HB2 1 1 4 2501 1 1 11 CYS HB3 H 5.725 -2.807 -4.136 1.00 . A A . 11 CYS HB3 1 1 4 2502 1 1 11 CYS HG H 3.267 -2.332 -5.854 1.00 . A A . 11 CYS HG 1 1 4 2503 1 1 11 CYS N N 7.376 -1.173 -4.262 1.00 . A A . 11 CYS N 1 1 4 2504 1 1 11 CYS O O 4.856 -0.070 -2.817 1.00 . A A . 11 CYS O 1 1 4 2505 1 1 11 CYS SG S 3.561 -2.394 -4.941 1.00 . A A . 11 CYS SG 1 1 4 2506 1 1 12 SER C C 3.039 3.027 -3.875 1.00 . A A . 12 SER C 1 1 4 2507 1 1 12 SER CA C 4.424 2.466 -3.542 1.00 . A A . 12 SER CA 1 1 4 2508 1 1 12 SER CB C 5.484 3.577 -3.358 1.00 . A A . 12 SER CB 1 1 4 2509 1 1 12 SER H H 5.521 1.664 -5.251 1.00 . A A . 12 SER H 1 1 4 2510 1 1 12 SER HA H 4.206 2.085 -2.580 1.00 . A A . 12 SER HA 1 1 4 2511 1 1 12 SER HB2 H 5.320 4.104 -2.428 1.00 . A A . 12 SER HB2 1 1 4 2512 1 1 12 SER HB3 H 6.451 3.093 -3.329 1.00 . A A . 12 SER HB3 1 1 4 2513 1 1 12 SER HG H 5.914 4.040 -5.207 1.00 . A A . 12 SER HG 1 1 4 2514 1 1 12 SER N N 5.143 1.436 -4.381 1.00 . A A . 12 SER N 1 1 4 2515 1 1 12 SER O O 2.151 2.287 -4.207 1.00 . A A . 12 SER O 1 1 4 2516 1 1 12 SER OG O 5.424 4.461 -4.475 1.00 . A A . 12 SER OG 1 1 4 2517 1 1 13 LEU C C 0.629 4.379 -4.892 1.00 . A A . 13 LEU C 1 1 4 2518 1 1 13 LEU CA C 1.629 5.099 -4.008 1.00 . A A . 13 LEU CA 1 1 4 2519 1 1 13 LEU CB C 2.133 6.454 -4.598 1.00 . A A . 13 LEU CB 1 1 4 2520 1 1 13 LEU CD1 C -0.045 7.631 -4.165 1.00 . A A . 13 LEU CD1 1 1 4 2521 1 1 13 LEU CD2 C 1.618 8.616 -5.678 1.00 . A A . 13 LEU CD2 1 1 4 2522 1 1 13 LEU CG C 1.005 7.298 -5.219 1.00 . A A . 13 LEU CG 1 1 4 2523 1 1 13 LEU H H 3.707 4.726 -3.540 1.00 . A A . 13 LEU H 1 1 4 2524 1 1 13 LEU HA H 1.112 5.241 -3.070 1.00 . A A . 13 LEU HA 1 1 4 2525 1 1 13 LEU HB2 H 2.595 7.025 -3.805 1.00 . A A . 13 LEU HB2 1 1 4 2526 1 1 13 LEU HB3 H 2.890 6.266 -5.346 1.00 . A A . 13 LEU HB3 1 1 4 2527 1 1 13 LEU HD11 H 0.395 8.184 -3.347 1.00 . A A . 13 LEU HD11 1 1 4 2528 1 1 13 LEU HD12 H -0.824 8.236 -4.607 1.00 . A A . 13 LEU HD12 1 1 4 2529 1 1 13 LEU HD13 H -0.499 6.732 -3.778 1.00 . A A . 13 LEU HD13 1 1 4 2530 1 1 13 LEU HD21 H 2.392 8.446 -6.413 1.00 . A A . 13 LEU HD21 1 1 4 2531 1 1 13 LEU HD22 H 0.859 9.245 -6.122 1.00 . A A . 13 LEU HD22 1 1 4 2532 1 1 13 LEU HD23 H 2.052 9.147 -4.842 1.00 . A A . 13 LEU HD23 1 1 4 2533 1 1 13 LEU HG H 0.547 6.788 -6.061 1.00 . A A . 13 LEU HG 1 1 4 2534 1 1 13 LEU N N 2.883 4.305 -3.766 1.00 . A A . 13 LEU N 1 1 4 2535 1 1 13 LEU O O -0.516 4.110 -4.580 1.00 . A A . 13 LEU O 1 1 4 2536 1 1 14 TYR C C -0.125 2.019 -6.512 1.00 . A A . 14 TYR C 1 1 4 2537 1 1 14 TYR CA C 0.417 3.347 -7.059 1.00 . A A . 14 TYR CA 1 1 4 2538 1 1 14 TYR CB C 1.329 3.130 -8.317 1.00 . A A . 14 TYR CB 1 1 4 2539 1 1 14 TYR CD1 C 3.480 4.287 -7.751 1.00 . A A . 14 TYR CD1 1 1 4 2540 1 1 14 TYR CD2 C 3.420 1.916 -7.665 1.00 . A A . 14 TYR CD2 1 1 4 2541 1 1 14 TYR CE1 C 4.793 4.268 -7.344 1.00 . A A . 14 TYR CE1 1 1 4 2542 1 1 14 TYR CE2 C 4.730 1.902 -7.262 1.00 . A A . 14 TYR CE2 1 1 4 2543 1 1 14 TYR CG C 2.791 3.104 -7.909 1.00 . A A . 14 TYR CG 1 1 4 2544 1 1 14 TYR CZ C 5.411 3.073 -7.099 1.00 . A A . 14 TYR CZ 1 1 4 2545 1 1 14 TYR H H 2.162 4.322 -6.000 1.00 . A A . 14 TYR H 1 1 4 2546 1 1 14 TYR HA H -0.449 3.941 -7.327 1.00 . A A . 14 TYR HA 1 1 4 2547 1 1 14 TYR HB2 H 1.071 2.186 -8.780 1.00 . A A . 14 TYR HB2 1 1 4 2548 1 1 14 TYR HB3 H 1.161 3.917 -9.036 1.00 . A A . 14 TYR HB3 1 1 4 2549 1 1 14 TYR HD1 H 2.985 5.228 -7.953 1.00 . A A . 14 TYR HD1 1 1 4 2550 1 1 14 TYR HD2 H 2.884 0.991 -7.794 1.00 . A A . 14 TYR HD2 1 1 4 2551 1 1 14 TYR HE1 H 5.346 5.188 -7.215 1.00 . A A . 14 TYR HE1 1 1 4 2552 1 1 14 TYR HE2 H 5.230 0.964 -7.084 1.00 . A A . 14 TYR HE2 1 1 4 2553 1 1 14 TYR HH H 7.195 3.532 -7.346 1.00 . A A . 14 TYR HH 1 1 4 2554 1 1 14 TYR N N 1.206 4.066 -5.997 1.00 . A A . 14 TYR N 1 1 4 2555 1 1 14 TYR O O -1.295 1.742 -6.657 1.00 . A A . 14 TYR O 1 1 4 2556 1 1 14 TYR OH O 6.705 3.056 -6.660 1.00 . A A . 14 TYR OH 1 1 4 2557 1 1 15 GLN C C -0.478 -0.003 -3.931 1.00 . A A . 15 GLN C 1 1 4 2558 1 1 15 GLN CA C 0.044 -0.069 -5.367 1.00 . A A . 15 GLN CA 1 1 4 2559 1 1 15 GLN CB C 1.086 -1.187 -5.529 1.00 . A A . 15 GLN CB 1 1 4 2560 1 1 15 GLN CD C 1.422 -1.165 -8.079 1.00 . A A . 15 GLN CD 1 1 4 2561 1 1 15 GLN CG C 0.874 -1.932 -6.896 1.00 . A A . 15 GLN CG 1 1 4 2562 1 1 15 GLN H H 1.606 1.421 -5.696 1.00 . A A . 15 GLN H 1 1 4 2563 1 1 15 GLN HA H -0.852 -0.257 -5.938 1.00 . A A . 15 GLN HA 1 1 4 2564 1 1 15 GLN HB2 H 2.058 -0.715 -5.510 1.00 . A A . 15 GLN HB2 1 1 4 2565 1 1 15 GLN HB3 H 1.033 -1.889 -4.706 1.00 . A A . 15 GLN HB3 1 1 4 2566 1 1 15 GLN HE21 H -0.329 -0.527 -8.707 1.00 . A A . 15 GLN HE21 1 1 4 2567 1 1 15 GLN HE22 H 1.039 -0.062 -9.621 1.00 . A A . 15 GLN HE22 1 1 4 2568 1 1 15 GLN HG2 H 1.387 -2.880 -6.881 1.00 . A A . 15 GLN HG2 1 1 4 2569 1 1 15 GLN HG3 H -0.172 -2.115 -7.086 1.00 . A A . 15 GLN HG3 1 1 4 2570 1 1 15 GLN N N 0.659 1.202 -5.865 1.00 . A A . 15 GLN N 1 1 4 2571 1 1 15 GLN NE2 N 0.637 -0.531 -8.869 1.00 . A A . 15 GLN NE2 1 1 4 2572 1 1 15 GLN O O -0.507 -0.955 -3.184 1.00 . A A . 15 GLN O 1 1 4 2573 1 1 15 GLN OE1 O 2.603 -1.126 -8.317 1.00 . A A . 15 GLN OE1 1 1 4 2574 1 1 16 LEU C C -2.893 1.918 -2.694 1.00 . A A . 16 LEU C 1 1 4 2575 1 1 16 LEU CA C -1.464 1.485 -2.284 1.00 . A A . 16 LEU CA 1 1 4 2576 1 1 16 LEU CB C -0.572 2.593 -1.604 1.00 . A A . 16 LEU CB 1 1 4 2577 1 1 16 LEU CD1 C 1.502 1.043 -1.380 1.00 . A A . 16 LEU CD1 1 1 4 2578 1 1 16 LEU CD2 C 1.104 2.762 0.316 1.00 . A A . 16 LEU CD2 1 1 4 2579 1 1 16 LEU CG C 0.408 1.821 -0.648 1.00 . A A . 16 LEU CG 1 1 4 2580 1 1 16 LEU H H -0.818 1.902 -4.207 1.00 . A A . 16 LEU H 1 1 4 2581 1 1 16 LEU HA H -1.523 0.574 -1.752 1.00 . A A . 16 LEU HA 1 1 4 2582 1 1 16 LEU HB2 H -0.023 3.160 -2.341 1.00 . A A . 16 LEU HB2 1 1 4 2583 1 1 16 LEU HB3 H -1.189 3.286 -1.042 1.00 . A A . 16 LEU HB3 1 1 4 2584 1 1 16 LEU HD11 H 1.091 0.295 -2.034 1.00 . A A . 16 LEU HD11 1 1 4 2585 1 1 16 LEU HD12 H 2.120 1.698 -1.959 1.00 . A A . 16 LEU HD12 1 1 4 2586 1 1 16 LEU HD13 H 2.138 0.527 -0.673 1.00 . A A . 16 LEU HD13 1 1 4 2587 1 1 16 LEU HD21 H 0.379 3.265 0.932 1.00 . A A . 16 LEU HD21 1 1 4 2588 1 1 16 LEU HD22 H 1.760 2.192 0.961 1.00 . A A . 16 LEU HD22 1 1 4 2589 1 1 16 LEU HD23 H 1.696 3.490 -0.216 1.00 . A A . 16 LEU HD23 1 1 4 2590 1 1 16 LEU HG H -0.171 1.095 -0.094 1.00 . A A . 16 LEU HG 1 1 4 2591 1 1 16 LEU N N -0.893 1.173 -3.591 1.00 . A A . 16 LEU N 1 1 4 2592 1 1 16 LEU O O -3.868 1.426 -2.155 1.00 . A A . 16 LEU O 1 1 4 2593 1 1 17 GLU C C -5.168 1.988 -4.528 1.00 . A A . 17 GLU C 1 1 4 2594 1 1 17 GLU CA C -4.374 3.253 -4.101 1.00 . A A . 17 GLU CA 1 1 4 2595 1 1 17 GLU CB C -4.176 4.304 -5.263 1.00 . A A . 17 GLU CB 1 1 4 2596 1 1 17 GLU CD C -4.974 3.437 -7.576 1.00 . A A . 17 GLU CD 1 1 4 2597 1 1 17 GLU CG C -3.777 3.697 -6.662 1.00 . A A . 17 GLU CG 1 1 4 2598 1 1 17 GLU H H -2.182 3.154 -4.082 1.00 . A A . 17 GLU H 1 1 4 2599 1 1 17 GLU HA H -4.886 3.683 -3.268 1.00 . A A . 17 GLU HA 1 1 4 2600 1 1 17 GLU HB2 H -5.108 4.838 -5.392 1.00 . A A . 17 GLU HB2 1 1 4 2601 1 1 17 GLU HB3 H -3.425 5.026 -4.978 1.00 . A A . 17 GLU HB3 1 1 4 2602 1 1 17 GLU HG2 H -3.130 4.377 -7.184 1.00 . A A . 17 GLU HG2 1 1 4 2603 1 1 17 GLU HG3 H -3.250 2.772 -6.585 1.00 . A A . 17 GLU HG3 1 1 4 2604 1 1 17 GLU N N -2.999 2.803 -3.657 1.00 . A A . 17 GLU N 1 1 4 2605 1 1 17 GLU O O -6.297 1.734 -4.147 1.00 . A A . 17 GLU O 1 1 4 2606 1 1 17 GLU OE1 O -5.834 2.683 -7.165 1.00 . A A . 17 GLU OE1 1 1 4 2607 1 1 17 GLU OE2 O -4.945 4.007 -8.643 1.00 . A A . 17 GLU OE2 1 1 4 2608 1 1 18 ASN C C -5.730 -0.997 -4.854 1.00 . A A . 18 ASN C 1 1 4 2609 1 1 18 ASN CA C -4.988 -0.082 -5.881 1.00 . A A . 18 ASN CA 1 1 4 2610 1 1 18 ASN CB C -3.732 -0.763 -6.475 1.00 . A A . 18 ASN CB 1 1 4 2611 1 1 18 ASN CG C -3.177 -0.085 -7.713 1.00 . A A . 18 ASN CG 1 1 4 2612 1 1 18 ASN H H -3.598 1.521 -5.563 1.00 . A A . 18 ASN H 1 1 4 2613 1 1 18 ASN HA H -5.712 0.146 -6.653 1.00 . A A . 18 ASN HA 1 1 4 2614 1 1 18 ASN HB2 H -2.948 -0.709 -5.740 1.00 . A A . 18 ASN HB2 1 1 4 2615 1 1 18 ASN HB3 H -3.925 -1.785 -6.727 1.00 . A A . 18 ASN HB3 1 1 4 2616 1 1 18 ASN HD21 H -4.557 1.326 -7.840 1.00 . A A . 18 ASN HD21 1 1 4 2617 1 1 18 ASN HD22 H -3.357 1.356 -9.021 1.00 . A A . 18 ASN HD22 1 1 4 2618 1 1 18 ASN N N -4.490 1.211 -5.319 1.00 . A A . 18 ASN N 1 1 4 2619 1 1 18 ASN ND2 N -3.741 0.941 -8.230 1.00 . A A . 18 ASN ND2 1 1 4 2620 1 1 18 ASN O O -6.442 -1.908 -5.220 1.00 . A A . 18 ASN O 1 1 4 2621 1 1 18 ASN OD1 O -2.174 -0.511 -8.242 1.00 . A A . 18 ASN OD1 1 1 4 2622 1 1 19 TYR C C -7.054 -0.609 -1.601 1.00 . A A . 19 TYR C 1 1 4 2623 1 1 19 TYR CA C -6.149 -1.497 -2.463 1.00 . A A . 19 TYR CA 1 1 4 2624 1 1 19 TYR CB C -4.994 -2.110 -1.640 1.00 . A A . 19 TYR CB 1 1 4 2625 1 1 19 TYR CD1 C -4.601 -4.059 -3.131 1.00 . A A . 19 TYR CD1 1 1 4 2626 1 1 19 TYR CD2 C -3.010 -2.309 -3.152 1.00 . A A . 19 TYR CD2 1 1 4 2627 1 1 19 TYR CE1 C -3.872 -4.725 -4.085 1.00 . A A . 19 TYR CE1 1 1 4 2628 1 1 19 TYR CE2 C -2.280 -2.985 -4.111 1.00 . A A . 19 TYR CE2 1 1 4 2629 1 1 19 TYR CG C -4.168 -2.851 -2.667 1.00 . A A . 19 TYR CG 1 1 4 2630 1 1 19 TYR CZ C -2.712 -4.197 -4.577 1.00 . A A . 19 TYR CZ 1 1 4 2631 1 1 19 TYR H H -4.925 0.034 -3.404 1.00 . A A . 19 TYR H 1 1 4 2632 1 1 19 TYR HA H -6.775 -2.280 -2.866 1.00 . A A . 19 TYR HA 1 1 4 2633 1 1 19 TYR HB2 H -4.380 -1.364 -1.156 1.00 . A A . 19 TYR HB2 1 1 4 2634 1 1 19 TYR HB3 H -5.349 -2.820 -0.906 1.00 . A A . 19 TYR HB3 1 1 4 2635 1 1 19 TYR HD1 H -5.517 -4.475 -2.732 1.00 . A A . 19 TYR HD1 1 1 4 2636 1 1 19 TYR HD2 H -2.681 -1.352 -2.767 1.00 . A A . 19 TYR HD2 1 1 4 2637 1 1 19 TYR HE1 H -4.220 -5.669 -4.456 1.00 . A A . 19 TYR HE1 1 1 4 2638 1 1 19 TYR HE2 H -1.368 -2.552 -4.494 1.00 . A A . 19 TYR HE2 1 1 4 2639 1 1 19 TYR HH H -2.165 -4.466 -6.355 1.00 . A A . 19 TYR HH 1 1 4 2640 1 1 19 TYR N N -5.518 -0.720 -3.595 1.00 . A A . 19 TYR N 1 1 4 2641 1 1 19 TYR O O -8.070 -1.046 -1.106 1.00 . A A . 19 TYR O 1 1 4 2642 1 1 19 TYR OH O -1.992 -4.899 -5.512 1.00 . A A . 19 TYR OH 1 1 4 2643 1 1 20 CYS C C -7.533 2.728 -1.844 1.00 . A A . 20 CYS C 1 1 4 2644 1 1 20 CYS CA C -7.201 1.731 -0.706 1.00 . A A . 20 CYS CA 1 1 4 2645 1 1 20 CYS CB C -6.117 2.140 0.273 1.00 . A A . 20 CYS CB 1 1 4 2646 1 1 20 CYS H H -5.734 0.784 -1.899 1.00 . A A . 20 CYS H 1 1 4 2647 1 1 20 CYS HA H -8.092 1.514 -0.161 1.00 . A A . 20 CYS HA 1 1 4 2648 1 1 20 CYS HB2 H -5.550 1.257 0.535 1.00 . A A . 20 CYS HB2 1 1 4 2649 1 1 20 CYS HB3 H -5.435 2.823 -0.217 1.00 . A A . 20 CYS HB3 1 1 4 2650 1 1 20 CYS HG H -6.312 3.757 1.874 1.00 . A A . 20 CYS HG 1 1 4 2651 1 1 20 CYS N N -6.589 0.597 -1.464 1.00 . A A . 20 CYS N 1 1 4 2652 1 1 20 CYS O O -6.763 3.592 -2.204 1.00 . A A . 20 CYS O 1 1 4 2653 1 1 20 CYS SG S -6.718 2.890 1.805 1.00 . A A . 20 CYS SG 1 1 4 2654 1 1 21 ASN C C -9.531 4.854 -3.016 1.00 . A A . 21 ASN C 1 1 4 2655 1 1 21 ASN CA C -9.156 3.460 -3.516 1.00 . A A . 21 ASN CA 1 1 4 2656 1 1 21 ASN CB C -10.370 2.793 -4.181 1.00 . A A . 21 ASN CB 1 1 4 2657 1 1 21 ASN CG C -10.177 1.316 -4.430 1.00 . A A . 21 ASN CG 1 1 4 2658 1 1 21 ASN H H -9.304 1.890 -2.010 1.00 . A A . 21 ASN H 1 1 4 2659 1 1 21 ASN HA H -8.344 3.571 -4.227 1.00 . A A . 21 ASN HA 1 1 4 2660 1 1 21 ASN HB2 H -11.254 2.899 -3.575 1.00 . A A . 21 ASN HB2 1 1 4 2661 1 1 21 ASN HB3 H -10.565 3.243 -5.141 1.00 . A A . 21 ASN HB3 1 1 4 2662 1 1 21 ASN HD21 H -8.179 1.239 -4.349 1.00 . A A . 21 ASN HD21 1 1 4 2663 1 1 21 ASN HD22 H -9.016 -0.205 -4.640 1.00 . A A . 21 ASN HD22 1 1 4 2664 1 1 21 ASN N N -8.709 2.577 -2.380 1.00 . A A . 21 ASN N 1 1 4 2665 1 1 21 ASN ND2 N -9.021 0.754 -4.473 1.00 . A A . 21 ASN ND2 1 1 4 2666 1 1 21 ASN O O -9.897 4.960 -1.866 1.00 . A A . 21 ASN O 1 1 4 2667 1 1 21 ASN OD1 O -11.137 0.611 -4.605 1.00 . A A . 21 ASN OD1 1 1 4 2668 2 2 1 PHE C C 9.150 7.535 -3.767 1.00 . B B . 1 PHE C 1 1 4 2669 2 2 1 PHE CA C 8.014 8.310 -4.494 1.00 . B B . 1 PHE CA 1 1 4 2670 2 2 1 PHE CB C 7.061 7.346 -5.278 1.00 . B B . 1 PHE CB 1 1 4 2671 2 2 1 PHE CD1 C 7.898 7.412 -7.663 1.00 . B B . 1 PHE CD1 1 1 4 2672 2 2 1 PHE CD2 C 8.332 5.462 -6.381 1.00 . B B . 1 PHE CD2 1 1 4 2673 2 2 1 PHE CE1 C 8.554 6.855 -8.738 1.00 . B B . 1 PHE CE1 1 1 4 2674 2 2 1 PHE CE2 C 8.990 4.898 -7.453 1.00 . B B . 1 PHE CE2 1 1 4 2675 2 2 1 PHE CG C 7.783 6.720 -6.477 1.00 . B B . 1 PHE CG 1 1 4 2676 2 2 1 PHE CZ C 9.102 5.595 -8.634 1.00 . B B . 1 PHE CZ 1 1 4 2677 2 2 1 PHE HA H 7.452 8.831 -3.734 1.00 . B B . 1 PHE HA 1 1 4 2678 2 2 1 PHE HB2 H 6.703 6.553 -4.641 1.00 . B B . 1 PHE HB2 1 1 4 2679 2 2 1 PHE HB3 H 6.208 7.897 -5.647 1.00 . B B . 1 PHE HB3 1 1 4 2680 2 2 1 PHE HD1 H 7.468 8.399 -7.749 1.00 . B B . 1 PHE HD1 1 1 4 2681 2 2 1 PHE HD2 H 8.243 4.917 -5.450 1.00 . B B . 1 PHE HD2 1 1 4 2682 2 2 1 PHE HE1 H 8.637 7.410 -9.662 1.00 . B B . 1 PHE HE1 1 1 4 2683 2 2 1 PHE HE2 H 9.420 3.910 -7.365 1.00 . B B . 1 PHE HE2 1 1 4 2684 2 2 1 PHE HZ H 9.618 5.159 -9.479 1.00 . B B . 1 PHE HZ 1 1 4 2685 2 2 1 PHE N N 8.518 9.317 -5.484 1.00 . B B . 1 PHE N 1 1 4 2686 2 2 1 PHE O O 9.211 6.320 -3.724 1.00 . B B . 1 PHE O 1 1 4 2687 2 2 2 VAL C C 10.821 7.103 -1.046 1.00 . B B . 2 VAL C 1 1 4 2688 2 2 2 VAL CA C 11.190 7.626 -2.454 1.00 . B B . 2 VAL CA 1 1 4 2689 2 2 2 VAL CB C 12.316 8.660 -2.438 1.00 . B B . 2 VAL CB 1 1 4 2690 2 2 2 VAL CG1 C 11.924 9.993 -1.770 1.00 . B B . 2 VAL CG1 1 1 4 2691 2 2 2 VAL CG2 C 13.557 8.102 -1.720 1.00 . B B . 2 VAL CG2 1 1 4 2692 2 2 2 VAL H H 10.016 9.223 -3.221 1.00 . B B . 2 VAL H 1 1 4 2693 2 2 2 VAL HA H 11.513 6.826 -3.070 1.00 . B B . 2 VAL HA 1 1 4 2694 2 2 2 VAL HB H 12.517 8.735 -3.494 1.00 . B B . 2 VAL HB 1 1 4 2695 2 2 2 VAL HG11 H 11.101 10.471 -2.275 1.00 . B B . 2 VAL HG11 1 1 4 2696 2 2 2 VAL HG12 H 11.646 9.823 -0.738 1.00 . B B . 2 VAL HG12 1 1 4 2697 2 2 2 VAL HG13 H 12.767 10.669 -1.780 1.00 . B B . 2 VAL HG13 1 1 4 2698 2 2 2 VAL HG21 H 13.905 7.202 -2.210 1.00 . B B . 2 VAL HG21 1 1 4 2699 2 2 2 VAL HG22 H 14.356 8.829 -1.728 1.00 . B B . 2 VAL HG22 1 1 4 2700 2 2 2 VAL HG23 H 13.331 7.861 -0.690 1.00 . B B . 2 VAL HG23 1 1 4 2701 2 2 2 VAL N N 10.057 8.263 -3.182 1.00 . B B . 2 VAL N 1 1 4 2702 2 2 2 VAL O O 11.009 7.667 0.012 1.00 . B B . 2 VAL O 1 1 4 2703 2 2 3 ASN C C 10.167 3.628 -0.062 1.00 . B B . 3 ASN C 1 1 4 2704 2 2 3 ASN CA C 9.739 5.123 -0.027 1.00 . B B . 3 ASN CA 1 1 4 2705 2 2 3 ASN CB C 8.194 5.339 -0.049 1.00 . B B . 3 ASN CB 1 1 4 2706 2 2 3 ASN CG C 7.643 5.061 -1.425 1.00 . B B . 3 ASN CG 1 1 4 2707 2 2 3 ASN H H 10.180 5.674 -2.111 1.00 . B B . 3 ASN H 1 1 4 2708 2 2 3 ASN HA H 10.181 5.488 0.871 1.00 . B B . 3 ASN HA 1 1 4 2709 2 2 3 ASN HB2 H 7.696 4.680 0.639 1.00 . B B . 3 ASN HB2 1 1 4 2710 2 2 3 ASN HB3 H 7.967 6.360 0.212 1.00 . B B . 3 ASN HB3 1 1 4 2711 2 2 3 ASN HD21 H 6.666 6.765 -1.650 1.00 . B B . 3 ASN HD21 1 1 4 2712 2 2 3 ASN HD22 H 6.571 5.607 -2.917 1.00 . B B . 3 ASN HD22 1 1 4 2713 2 2 3 ASN N N 10.246 5.952 -1.173 1.00 . B B . 3 ASN N 1 1 4 2714 2 2 3 ASN ND2 N 6.892 5.901 -2.040 1.00 . B B . 3 ASN ND2 1 1 4 2715 2 2 3 ASN O O 10.518 3.020 0.926 1.00 . B B . 3 ASN O 1 1 4 2716 2 2 3 ASN OD1 O 7.877 4.036 -2.012 1.00 . B B . 3 ASN OD1 1 1 4 2717 2 2 4 GLN C C 10.022 0.485 -0.769 1.00 . B B . 4 GLN C 1 1 4 2718 2 2 4 GLN CA C 10.458 1.709 -1.635 1.00 . B B . 4 GLN CA 1 1 4 2719 2 2 4 GLN CB C 12.015 1.709 -1.827 1.00 . B B . 4 GLN CB 1 1 4 2720 2 2 4 GLN CD C 11.787 3.828 -3.267 1.00 . B B . 4 GLN CD 1 1 4 2721 2 2 4 GLN CG C 12.447 2.467 -3.148 1.00 . B B . 4 GLN CG 1 1 4 2722 2 2 4 GLN H H 9.803 3.774 -1.904 1.00 . B B . 4 GLN H 1 1 4 2723 2 2 4 GLN HA H 9.994 1.530 -2.592 1.00 . B B . 4 GLN HA 1 1 4 2724 2 2 4 GLN HB2 H 12.462 2.201 -0.972 1.00 . B B . 4 GLN HB2 1 1 4 2725 2 2 4 GLN HB3 H 12.387 0.691 -1.836 1.00 . B B . 4 GLN HB3 1 1 4 2726 2 2 4 GLN HE21 H 10.542 3.309 -4.699 1.00 . B B . 4 GLN HE21 1 1 4 2727 2 2 4 GLN HE22 H 10.414 4.904 -4.128 1.00 . B B . 4 GLN HE22 1 1 4 2728 2 2 4 GLN HG2 H 13.510 2.646 -3.113 1.00 . B B . 4 GLN HG2 1 1 4 2729 2 2 4 GLN HG3 H 12.235 1.899 -4.035 1.00 . B B . 4 GLN HG3 1 1 4 2730 2 2 4 GLN N N 10.110 3.123 -1.248 1.00 . B B . 4 GLN N 1 1 4 2731 2 2 4 GLN NE2 N 10.835 4.022 -4.105 1.00 . B B . 4 GLN NE2 1 1 4 2732 2 2 4 GLN O O 9.328 -0.376 -1.275 1.00 . B B . 4 GLN O 1 1 4 2733 2 2 4 GLN OE1 O 12.109 4.766 -2.588 1.00 . B B . 4 GLN OE1 1 1 4 2734 2 2 5 HIS C C 9.126 -0.326 2.568 1.00 . B B . 5 HIS C 1 1 4 2735 2 2 5 HIS CA C 10.054 -0.712 1.377 1.00 . B B . 5 HIS CA 1 1 4 2736 2 2 5 HIS CB C 11.400 -1.305 1.873 1.00 . B B . 5 HIS CB 1 1 4 2737 2 2 5 HIS CD2 C 13.731 -0.826 0.754 1.00 . B B . 5 HIS CD2 1 1 4 2738 2 2 5 HIS CE1 C 13.383 -1.655 -1.105 1.00 . B B . 5 HIS CE1 1 1 4 2739 2 2 5 HIS CG C 12.444 -1.319 0.760 1.00 . B B . 5 HIS CG 1 1 4 2740 2 2 5 HIS H H 10.953 1.183 0.804 1.00 . B B . 5 HIS H 1 1 4 2741 2 2 5 HIS HA H 9.532 -1.470 0.805 1.00 . B B . 5 HIS HA 1 1 4 2742 2 2 5 HIS HB2 H 11.785 -0.716 2.692 1.00 . B B . 5 HIS HB2 1 1 4 2743 2 2 5 HIS HB3 H 11.260 -2.320 2.212 1.00 . B B . 5 HIS HB3 1 1 4 2744 2 2 5 HIS HD1 H 11.472 -2.252 -0.761 1.00 . B B . 5 HIS HD1 1 1 4 2745 2 2 5 HIS HD2 H 14.201 -0.332 1.588 1.00 . B B . 5 HIS HD2 1 1 4 2746 2 2 5 HIS HE1 H 13.526 -1.988 -2.123 1.00 . B B . 5 HIS HE1 1 1 4 2747 2 2 5 HIS N N 10.415 0.438 0.470 1.00 . B B . 5 HIS N 1 1 4 2748 2 2 5 HIS ND1 N 12.293 -1.817 -0.418 1.00 . B B . 5 HIS ND1 1 1 4 2749 2 2 5 HIS NE2 N 14.306 -1.041 -0.411 1.00 . B B . 5 HIS NE2 1 1 4 2750 2 2 5 HIS O O 9.565 0.044 3.643 1.00 . B B . 5 HIS O 1 1 4 2751 2 2 6 LEU C C 6.096 -1.365 3.882 1.00 . B B . 6 LEU C 1 1 4 2752 2 2 6 LEU CA C 6.828 -0.090 3.405 1.00 . B B . 6 LEU CA 1 1 4 2753 2 2 6 LEU CB C 5.834 0.936 2.787 1.00 . B B . 6 LEU CB 1 1 4 2754 2 2 6 LEU CD1 C 7.678 2.598 2.245 1.00 . B B . 6 LEU CD1 1 1 4 2755 2 2 6 LEU CD2 C 5.316 3.296 2.223 1.00 . B B . 6 LEU CD2 1 1 4 2756 2 2 6 LEU CG C 6.326 2.393 2.923 1.00 . B B . 6 LEU CG 1 1 4 2757 2 2 6 LEU H H 7.556 -0.767 1.475 1.00 . B B . 6 LEU H 1 1 4 2758 2 2 6 LEU HA H 7.320 0.356 4.257 1.00 . B B . 6 LEU HA 1 1 4 2759 2 2 6 LEU HB2 H 5.692 0.696 1.742 1.00 . B B . 6 LEU HB2 1 1 4 2760 2 2 6 LEU HB3 H 4.875 0.850 3.278 1.00 . B B . 6 LEU HB3 1 1 4 2761 2 2 6 LEU HD11 H 7.640 2.338 1.197 1.00 . B B . 6 LEU HD11 1 1 4 2762 2 2 6 LEU HD12 H 7.990 3.623 2.350 1.00 . B B . 6 LEU HD12 1 1 4 2763 2 2 6 LEU HD13 H 8.436 1.997 2.718 1.00 . B B . 6 LEU HD13 1 1 4 2764 2 2 6 LEU HD21 H 5.235 3.026 1.181 1.00 . B B . 6 LEU HD21 1 1 4 2765 2 2 6 LEU HD22 H 4.348 3.188 2.691 1.00 . B B . 6 LEU HD22 1 1 4 2766 2 2 6 LEU HD23 H 5.623 4.329 2.303 1.00 . B B . 6 LEU HD23 1 1 4 2767 2 2 6 LEU HG H 6.392 2.664 3.971 1.00 . B B . 6 LEU HG 1 1 4 2768 2 2 6 LEU N N 7.848 -0.433 2.351 1.00 . B B . 6 LEU N 1 1 4 2769 2 2 6 LEU O O 5.447 -2.038 3.110 1.00 . B B . 6 LEU O 1 1 4 2770 2 2 7 CYS C C 4.340 -2.644 6.635 1.00 . B B . 7 CYS C 1 1 4 2771 2 2 7 CYS CA C 5.509 -2.918 5.659 1.00 . B B . 7 CYS CA 1 1 4 2772 2 2 7 CYS CB C 6.607 -3.784 6.307 1.00 . B B . 7 CYS CB 1 1 4 2773 2 2 7 CYS H H 6.722 -1.113 5.735 1.00 . B B . 7 CYS H 1 1 4 2774 2 2 7 CYS HA H 5.073 -3.459 4.836 1.00 . B B . 7 CYS HA 1 1 4 2775 2 2 7 CYS HB2 H 7.489 -3.744 5.683 1.00 . B B . 7 CYS HB2 1 1 4 2776 2 2 7 CYS HB3 H 6.866 -3.380 7.276 1.00 . B B . 7 CYS HB3 1 1 4 2777 2 2 7 CYS HG H 5.853 -5.660 7.411 1.00 . B B . 7 CYS HG 1 1 4 2778 2 2 7 CYS N N 6.199 -1.683 5.144 1.00 . B B . 7 CYS N 1 1 4 2779 2 2 7 CYS O O 4.064 -1.512 6.955 1.00 . B B . 7 CYS O 1 1 4 2780 2 2 7 CYS SG S 6.196 -5.534 6.522 1.00 . B B . 7 CYS SG 1 1 4 2781 2 2 8 GLY C C 1.844 -2.322 8.269 1.00 . B B . 8 GLY C 1 1 4 2782 2 2 8 GLY CA C 2.529 -3.657 8.017 1.00 . B B . 8 GLY CA 1 1 4 2783 2 2 8 GLY H H 4.033 -4.559 6.757 1.00 . B B . 8 GLY H 1 1 4 2784 2 2 8 GLY HA2 H 1.760 -4.317 7.673 1.00 . B B . 8 GLY HA2 1 1 4 2785 2 2 8 GLY HA3 H 2.882 -3.984 8.985 1.00 . B B . 8 GLY HA3 1 1 4 2786 2 2 8 GLY N N 3.707 -3.699 7.068 1.00 . B B . 8 GLY N 1 1 4 2787 2 2 8 GLY O O 1.093 -1.803 7.470 1.00 . B B . 8 GLY O 1 1 4 2788 2 2 9 ASP C C 1.968 0.636 8.992 1.00 . B B . 9 ASP C 1 1 4 2789 2 2 9 ASP CA C 1.665 -0.551 9.956 1.00 . B B . 9 ASP CA 1 1 4 2790 2 2 9 ASP CB C 2.366 -0.467 11.354 1.00 . B B . 9 ASP CB 1 1 4 2791 2 2 9 ASP CG C 3.846 -0.815 11.235 1.00 . B B . 9 ASP CG 1 1 4 2792 2 2 9 ASP H H 2.793 -2.368 9.948 1.00 . B B . 9 ASP H 1 1 4 2793 2 2 9 ASP HA H 0.583 -0.612 10.030 1.00 . B B . 9 ASP HA 1 1 4 2794 2 2 9 ASP HB2 H 2.301 0.536 11.750 1.00 . B B . 9 ASP HB2 1 1 4 2795 2 2 9 ASP HB3 H 1.930 -1.153 12.058 1.00 . B B . 9 ASP HB3 1 1 4 2796 2 2 9 ASP N N 2.165 -1.841 9.411 1.00 . B B . 9 ASP N 1 1 4 2797 2 2 9 ASP O O 1.102 1.295 8.447 1.00 . B B . 9 ASP O 1 1 4 2798 2 2 9 ASP OD1 O 4.108 -2.003 11.256 1.00 . B B . 9 ASP OD1 1 1 4 2799 2 2 9 ASP OD2 O 4.621 0.108 11.112 1.00 . B B . 9 ASP OD2 1 1 4 2800 2 2 10 HIS C C 2.917 1.941 6.562 1.00 . B B . 10 HIS C 1 1 4 2801 2 2 10 HIS CA C 3.707 1.957 7.904 1.00 . B B . 10 HIS CA 1 1 4 2802 2 2 10 HIS CB C 5.214 1.713 7.727 1.00 . B B . 10 HIS CB 1 1 4 2803 2 2 10 HIS CD2 C 5.370 4.023 6.425 1.00 . B B . 10 HIS CD2 1 1 4 2804 2 2 10 HIS CE1 C 7.379 3.942 5.936 1.00 . B B . 10 HIS CE1 1 1 4 2805 2 2 10 HIS CG C 5.870 2.841 6.935 1.00 . B B . 10 HIS CG 1 1 4 2806 2 2 10 HIS H H 3.828 0.239 9.290 1.00 . B B . 10 HIS H 1 1 4 2807 2 2 10 HIS HA H 3.510 2.905 8.390 1.00 . B B . 10 HIS HA 1 1 4 2808 2 2 10 HIS HB2 H 5.662 1.657 8.709 1.00 . B B . 10 HIS HB2 1 1 4 2809 2 2 10 HIS HB3 H 5.366 0.775 7.216 1.00 . B B . 10 HIS HB3 1 1 4 2810 2 2 10 HIS HD1 H 7.752 2.149 6.815 1.00 . B B . 10 HIS HD1 1 1 4 2811 2 2 10 HIS HD2 H 4.346 4.352 6.521 1.00 . B B . 10 HIS HD2 1 1 4 2812 2 2 10 HIS HE1 H 8.350 4.206 5.533 1.00 . B B . 10 HIS HE1 1 1 4 2813 2 2 10 HIS N N 3.228 0.853 8.803 1.00 . B B . 10 HIS N 1 1 4 2814 2 2 10 HIS ND1 N 7.111 2.856 6.598 1.00 . B B . 10 HIS ND1 1 1 4 2815 2 2 10 HIS NE2 N 6.319 4.696 5.807 1.00 . B B . 10 HIS NE2 1 1 4 2816 2 2 10 HIS O O 2.431 2.923 6.034 1.00 . B B . 10 HIS O 1 1 4 2817 2 2 11 LEU C C 0.604 0.825 4.917 1.00 . B B . 11 LEU C 1 1 4 2818 2 2 11 LEU CA C 2.103 0.485 4.769 1.00 . B B . 11 LEU CA 1 1 4 2819 2 2 11 LEU CB C 2.349 -0.996 4.443 1.00 . B B . 11 LEU CB 1 1 4 2820 2 2 11 LEU CD1 C 2.710 -0.609 2.013 1.00 . B B . 11 LEU CD1 1 1 4 2821 2 2 11 LEU CD2 C 2.040 -2.840 2.860 1.00 . B B . 11 LEU CD2 1 1 4 2822 2 2 11 LEU CG C 1.837 -1.344 3.046 1.00 . B B . 11 LEU CG 1 1 4 2823 2 2 11 LEU H H 3.231 0.022 6.548 1.00 . B B . 11 LEU H 1 1 4 2824 2 2 11 LEU HA H 2.503 1.139 4.011 1.00 . B B . 11 LEU HA 1 1 4 2825 2 2 11 LEU HB2 H 3.409 -1.190 4.491 1.00 . B B . 11 LEU HB2 1 1 4 2826 2 2 11 LEU HB3 H 1.862 -1.613 5.185 1.00 . B B . 11 LEU HB3 1 1 4 2827 2 2 11 LEU HD11 H 3.743 -0.899 2.120 1.00 . B B . 11 LEU HD11 1 1 4 2828 2 2 11 LEU HD12 H 2.410 -0.846 1.010 1.00 . B B . 11 LEU HD12 1 1 4 2829 2 2 11 LEU HD13 H 2.643 0.460 2.127 1.00 . B B . 11 LEU HD13 1 1 4 2830 2 2 11 LEU HD21 H 1.501 -3.393 3.615 1.00 . B B . 11 LEU HD21 1 1 4 2831 2 2 11 LEU HD22 H 1.688 -3.151 1.891 1.00 . B B . 11 LEU HD22 1 1 4 2832 2 2 11 LEU HD23 H 3.090 -3.074 2.936 1.00 . B B . 11 LEU HD23 1 1 4 2833 2 2 11 LEU HG H 0.791 -1.082 2.931 1.00 . B B . 11 LEU HG 1 1 4 2834 2 2 11 LEU N N 2.815 0.752 6.050 1.00 . B B . 11 LEU N 1 1 4 2835 2 2 11 LEU O O 0.081 1.597 4.137 1.00 . B B . 11 LEU O 1 1 4 2836 2 2 12 VAL C C -1.680 2.137 6.158 1.00 . B B . 12 VAL C 1 1 4 2837 2 2 12 VAL CA C -1.536 0.618 6.017 1.00 . B B . 12 VAL CA 1 1 4 2838 2 2 12 VAL CB C -2.206 -0.050 7.263 1.00 . B B . 12 VAL CB 1 1 4 2839 2 2 12 VAL CG1 C -1.447 0.237 8.532 1.00 . B B . 12 VAL CG1 1 1 4 2840 2 2 12 VAL CG2 C -3.601 0.596 7.431 1.00 . B B . 12 VAL CG2 1 1 4 2841 2 2 12 VAL H H 0.360 -0.370 6.491 1.00 . B B . 12 VAL H 1 1 4 2842 2 2 12 VAL HA H -2.065 0.317 5.131 1.00 . B B . 12 VAL HA 1 1 4 2843 2 2 12 VAL HB H -2.257 -1.121 7.130 1.00 . B B . 12 VAL HB 1 1 4 2844 2 2 12 VAL HG11 H -1.355 1.293 8.753 1.00 . B B . 12 VAL HG11 1 1 4 2845 2 2 12 VAL HG12 H -1.896 -0.238 9.385 1.00 . B B . 12 VAL HG12 1 1 4 2846 2 2 12 VAL HG13 H -0.465 -0.173 8.388 1.00 . B B . 12 VAL HG13 1 1 4 2847 2 2 12 VAL HG21 H -4.176 0.476 6.523 1.00 . B B . 12 VAL HG21 1 1 4 2848 2 2 12 VAL HG22 H -4.131 0.154 8.256 1.00 . B B . 12 VAL HG22 1 1 4 2849 2 2 12 VAL HG23 H -3.511 1.660 7.623 1.00 . B B . 12 VAL HG23 1 1 4 2850 2 2 12 VAL N N -0.078 0.263 5.883 1.00 . B B . 12 VAL N 1 1 4 2851 2 2 12 VAL O O -2.438 2.735 5.429 1.00 . B B . 12 VAL O 1 1 4 2852 2 2 13 GLU C C -0.910 4.906 5.862 1.00 . B B . 13 GLU C 1 1 4 2853 2 2 13 GLU CA C -1.099 4.232 7.220 1.00 . B B . 13 GLU CA 1 1 4 2854 2 2 13 GLU CB C -0.041 4.696 8.228 1.00 . B B . 13 GLU CB 1 1 4 2855 2 2 13 GLU CD C 0.313 5.011 10.740 1.00 . B B . 13 GLU CD 1 1 4 2856 2 2 13 GLU CG C -0.560 4.372 9.668 1.00 . B B . 13 GLU CG 1 1 4 2857 2 2 13 GLU H H -0.352 2.245 7.631 1.00 . B B . 13 GLU H 1 1 4 2858 2 2 13 GLU HA H -2.088 4.482 7.577 1.00 . B B . 13 GLU HA 1 1 4 2859 2 2 13 GLU HB2 H 0.897 4.178 8.067 1.00 . B B . 13 GLU HB2 1 1 4 2860 2 2 13 GLU HB3 H 0.138 5.760 8.146 1.00 . B B . 13 GLU HB3 1 1 4 2861 2 2 13 GLU HG2 H -1.553 4.751 9.832 1.00 . B B . 13 GLU HG2 1 1 4 2862 2 2 13 GLU HG3 H -0.551 3.309 9.847 1.00 . B B . 13 GLU HG3 1 1 4 2863 2 2 13 GLU N N -0.975 2.750 7.063 1.00 . B B . 13 GLU N 1 1 4 2864 2 2 13 GLU O O -1.622 5.817 5.471 1.00 . B B . 13 GLU O 1 1 4 2865 2 2 13 GLU OE1 O 0.473 6.214 10.645 1.00 . B B . 13 GLU OE1 1 1 4 2866 2 2 13 GLU OE2 O 0.754 4.260 11.586 1.00 . B B . 13 GLU OE2 1 1 4 2867 2 2 14 ALA C C -0.851 4.810 2.882 1.00 . B B . 14 ALA C 1 1 4 2868 2 2 14 ALA CA C 0.336 4.976 3.821 1.00 . B B . 14 ALA CA 1 1 4 2869 2 2 14 ALA CB C 1.634 4.284 3.312 1.00 . B B . 14 ALA CB 1 1 4 2870 2 2 14 ALA H H 0.579 3.645 5.465 1.00 . B B . 14 ALA H 1 1 4 2871 2 2 14 ALA HA H 0.405 6.021 4.014 1.00 . B B . 14 ALA HA 1 1 4 2872 2 2 14 ALA HB1 H 1.497 3.213 3.259 1.00 . B B . 14 ALA HB1 1 1 4 2873 2 2 14 ALA HB2 H 1.905 4.651 2.335 1.00 . B B . 14 ALA HB2 1 1 4 2874 2 2 14 ALA HB3 H 2.448 4.481 3.997 1.00 . B B . 14 ALA HB3 1 1 4 2875 2 2 14 ALA N N 0.054 4.403 5.142 1.00 . B B . 14 ALA N 1 1 4 2876 2 2 14 ALA O O -1.311 5.772 2.288 1.00 . B B . 14 ALA O 1 1 4 2877 2 2 15 LEU C C -3.737 4.190 2.429 1.00 . B B . 15 LEU C 1 1 4 2878 2 2 15 LEU CA C -2.504 3.496 1.835 1.00 . B B . 15 LEU CA 1 1 4 2879 2 2 15 LEU CB C -2.752 1.997 1.519 1.00 . B B . 15 LEU CB 1 1 4 2880 2 2 15 LEU CD1 C -4.248 1.174 3.454 1.00 . B B . 15 LEU CD1 1 1 4 2881 2 2 15 LEU CD2 C -3.161 -0.305 1.919 1.00 . B B . 15 LEU CD2 1 1 4 2882 2 2 15 LEU CG C -2.969 0.985 2.635 1.00 . B B . 15 LEU CG 1 1 4 2883 2 2 15 LEU H H -0.934 2.864 3.260 1.00 . B B . 15 LEU H 1 1 4 2884 2 2 15 LEU HA H -2.270 4.011 0.914 1.00 . B B . 15 LEU HA 1 1 4 2885 2 2 15 LEU HB2 H -3.580 1.953 0.834 1.00 . B B . 15 LEU HB2 1 1 4 2886 2 2 15 LEU HB3 H -1.872 1.680 0.983 1.00 . B B . 15 LEU HB3 1 1 4 2887 2 2 15 LEU HD11 H -5.125 1.142 2.824 1.00 . B B . 15 LEU HD11 1 1 4 2888 2 2 15 LEU HD12 H -4.332 0.376 4.177 1.00 . B B . 15 LEU HD12 1 1 4 2889 2 2 15 LEU HD13 H -4.255 2.095 4.003 1.00 . B B . 15 LEU HD13 1 1 4 2890 2 2 15 LEU HD21 H -2.283 -0.483 1.322 1.00 . B B . 15 LEU HD21 1 1 4 2891 2 2 15 LEU HD22 H -3.288 -1.111 2.626 1.00 . B B . 15 LEU HD22 1 1 4 2892 2 2 15 LEU HD23 H -4.018 -0.260 1.265 1.00 . B B . 15 LEU HD23 1 1 4 2893 2 2 15 LEU HG H -2.071 0.904 3.224 1.00 . B B . 15 LEU HG 1 1 4 2894 2 2 15 LEU N N -1.341 3.611 2.756 1.00 . B B . 15 LEU N 1 1 4 2895 2 2 15 LEU O O -4.526 4.688 1.668 1.00 . B B . 15 LEU O 1 1 4 2896 2 2 16 TYR C C -5.041 6.401 3.881 1.00 . B B . 16 TYR C 1 1 4 2897 2 2 16 TYR CA C -5.105 4.925 4.336 1.00 . B B . 16 TYR CA 1 1 4 2898 2 2 16 TYR CB C -5.003 4.785 5.872 1.00 . B B . 16 TYR CB 1 1 4 2899 2 2 16 TYR CD1 C -6.254 6.833 6.682 1.00 . B B . 16 TYR CD1 1 1 4 2900 2 2 16 TYR CD2 C -7.360 4.732 6.780 1.00 . B B . 16 TYR CD2 1 1 4 2901 2 2 16 TYR CE1 C -7.382 7.444 7.196 1.00 . B B . 16 TYR CE1 1 1 4 2902 2 2 16 TYR CE2 C -8.484 5.354 7.294 1.00 . B B . 16 TYR CE2 1 1 4 2903 2 2 16 TYR CG C -6.238 5.469 6.469 1.00 . B B . 16 TYR CG 1 1 4 2904 2 2 16 TYR CZ C -8.494 6.707 7.500 1.00 . B B . 16 TYR CZ 1 1 4 2905 2 2 16 TYR H H -3.249 3.804 4.283 1.00 . B B . 16 TYR H 1 1 4 2906 2 2 16 TYR HA H -6.017 4.495 3.949 1.00 . B B . 16 TYR HA 1 1 4 2907 2 2 16 TYR HB2 H -4.987 3.742 6.157 1.00 . B B . 16 TYR HB2 1 1 4 2908 2 2 16 TYR HB3 H -4.107 5.263 6.247 1.00 . B B . 16 TYR HB3 1 1 4 2909 2 2 16 TYR HD1 H -5.379 7.422 6.444 1.00 . B B . 16 TYR HD1 1 1 4 2910 2 2 16 TYR HD2 H -7.357 3.662 6.617 1.00 . B B . 16 TYR HD2 1 1 4 2911 2 2 16 TYR HE1 H -7.407 8.510 7.367 1.00 . B B . 16 TYR HE1 1 1 4 2912 2 2 16 TYR HE2 H -9.368 4.786 7.539 1.00 . B B . 16 TYR HE2 1 1 4 2913 2 2 16 TYR HH H -9.620 7.132 8.944 1.00 . B B . 16 TYR HH 1 1 4 2914 2 2 16 TYR N N -3.914 4.239 3.720 1.00 . B B . 16 TYR N 1 1 4 2915 2 2 16 TYR O O -6.030 7.022 3.532 1.00 . B B . 16 TYR O 1 1 4 2916 2 2 16 TYR OH O -9.610 7.324 8.003 1.00 . B B . 16 TYR OH 1 1 4 2917 2 2 17 LEU C C -4.092 8.353 1.991 1.00 . B B . 17 LEU C 1 1 4 2918 2 2 17 LEU CA C -3.640 8.346 3.488 1.00 . B B . 17 LEU CA 1 1 4 2919 2 2 17 LEU CB C -2.126 8.625 3.715 1.00 . B B . 17 LEU CB 1 1 4 2920 2 2 17 LEU CD1 C -2.373 11.059 4.266 1.00 . B B . 17 LEU CD1 1 1 4 2921 2 2 17 LEU CD2 C -0.209 10.161 3.515 1.00 . B B . 17 LEU CD2 1 1 4 2922 2 2 17 LEU CG C -1.719 10.051 3.322 1.00 . B B . 17 LEU CG 1 1 4 2923 2 2 17 LEU H H -3.096 6.400 4.258 1.00 . B B . 17 LEU H 1 1 4 2924 2 2 17 LEU HA H -4.281 9.011 4.048 1.00 . B B . 17 LEU HA 1 1 4 2925 2 2 17 LEU HB2 H -1.897 8.458 4.760 1.00 . B B . 17 LEU HB2 1 1 4 2926 2 2 17 LEU HB3 H -1.539 7.920 3.146 1.00 . B B . 17 LEU HB3 1 1 4 2927 2 2 17 LEU HD11 H -2.076 10.869 5.288 1.00 . B B . 17 LEU HD11 1 1 4 2928 2 2 17 LEU HD12 H -2.064 12.060 4.004 1.00 . B B . 17 LEU HD12 1 1 4 2929 2 2 17 LEU HD13 H -3.447 11.008 4.202 1.00 . B B . 17 LEU HD13 1 1 4 2930 2 2 17 LEU HD21 H 0.304 9.443 2.892 1.00 . B B . 17 LEU HD21 1 1 4 2931 2 2 17 LEU HD22 H 0.135 11.150 3.248 1.00 . B B . 17 LEU HD22 1 1 4 2932 2 2 17 LEU HD23 H 0.058 9.972 4.546 1.00 . B B . 17 LEU HD23 1 1 4 2933 2 2 17 LEU HG H -1.985 10.256 2.289 1.00 . B B . 17 LEU HG 1 1 4 2934 2 2 17 LEU N N -3.851 6.933 3.924 1.00 . B B . 17 LEU N 1 1 4 2935 2 2 17 LEU O O -5.080 8.984 1.644 1.00 . B B . 17 LEU O 1 1 4 2936 2 2 18 VAL C C -5.188 7.397 -0.623 1.00 . B B . 18 VAL C 1 1 4 2937 2 2 18 VAL CA C -3.691 7.534 -0.307 1.00 . B B . 18 VAL CA 1 1 4 2938 2 2 18 VAL CB C -2.959 6.330 -0.935 1.00 . B B . 18 VAL CB 1 1 4 2939 2 2 18 VAL CG1 C -3.425 6.157 -2.412 1.00 . B B . 18 VAL CG1 1 1 4 2940 2 2 18 VAL CG2 C -1.485 6.678 -0.991 1.00 . B B . 18 VAL CG2 1 1 4 2941 2 2 18 VAL H H -2.602 7.128 1.551 1.00 . B B . 18 VAL H 1 1 4 2942 2 2 18 VAL HA H -3.338 8.418 -0.808 1.00 . B B . 18 VAL HA 1 1 4 2943 2 2 18 VAL HB H -3.141 5.432 -0.359 1.00 . B B . 18 VAL HB 1 1 4 2944 2 2 18 VAL HG11 H -3.243 7.060 -2.982 1.00 . B B . 18 VAL HG11 1 1 4 2945 2 2 18 VAL HG12 H -2.901 5.342 -2.886 1.00 . B B . 18 VAL HG12 1 1 4 2946 2 2 18 VAL HG13 H -4.485 5.942 -2.476 1.00 . B B . 18 VAL HG13 1 1 4 2947 2 2 18 VAL HG21 H -1.120 6.874 0.007 1.00 . B B . 18 VAL HG21 1 1 4 2948 2 2 18 VAL HG22 H -0.927 5.866 -1.426 1.00 . B B . 18 VAL HG22 1 1 4 2949 2 2 18 VAL HG23 H -1.351 7.566 -1.592 1.00 . B B . 18 VAL HG23 1 1 4 2950 2 2 18 VAL N N -3.366 7.626 1.173 1.00 . B B . 18 VAL N 1 1 4 2951 2 2 18 VAL O O -5.745 8.210 -1.326 1.00 . B B . 18 VAL O 1 1 4 2952 2 2 19 CYS C C -8.115 6.895 -0.845 1.00 . B B . 19 CYS C 1 1 4 2953 2 2 19 CYS CA C -7.169 5.912 -0.164 1.00 . B B . 19 CYS CA 1 1 4 2954 2 2 19 CYS CB C -7.522 5.574 1.302 1.00 . B B . 19 CYS CB 1 1 4 2955 2 2 19 CYS H H -5.252 5.756 0.498 1.00 . B B . 19 CYS H 1 1 4 2956 2 2 19 CYS HA H -7.191 5.095 -0.836 1.00 . B B . 19 CYS HA 1 1 4 2957 2 2 19 CYS HB2 H -6.615 5.474 1.865 1.00 . B B . 19 CYS HB2 1 1 4 2958 2 2 19 CYS HB3 H -7.992 6.428 1.742 1.00 . B B . 19 CYS HB3 1 1 4 2959 2 2 19 CYS HG H -9.421 4.325 1.632 1.00 . B B . 19 CYS HG 1 1 4 2960 2 2 19 CYS N N -5.753 6.354 -0.075 1.00 . B B . 19 CYS N 1 1 4 2961 2 2 19 CYS O O -9.031 7.382 -0.228 1.00 . B B . 19 CYS O 1 1 4 2962 2 2 19 CYS SG S -8.493 4.081 1.629 1.00 . B B . 19 CYS SG 1 1 4 2963 2 2 20 GLY C C -10.072 7.800 -2.938 1.00 . B B . 20 GLY C 1 1 4 2964 2 2 20 GLY CA C -8.590 8.060 -3.004 1.00 . B B . 20 GLY CA 1 1 4 2965 2 2 20 GLY H H -7.026 6.665 -2.435 1.00 . B B . 20 GLY H 1 1 4 2966 2 2 20 GLY HA2 H -8.434 9.083 -2.689 1.00 . B B . 20 GLY HA2 1 1 4 2967 2 2 20 GLY HA3 H -8.282 7.938 -4.028 1.00 . B B . 20 GLY HA3 1 1 4 2968 2 2 20 GLY N N -7.816 7.131 -2.098 1.00 . B B . 20 GLY N 1 1 4 2969 2 2 20 GLY O O -10.647 7.238 -3.849 1.00 . B B . 20 GLY O 1 1 4 2970 2 2 21 GLU C C -12.302 6.620 -1.384 1.00 . B B . 21 GLU C 1 1 4 2971 2 2 21 GLU CA C -11.994 8.137 -1.432 1.00 . B B . 21 GLU CA 1 1 4 2972 2 2 21 GLU CB C -12.581 9.143 -2.462 1.00 . B B . 21 GLU CB 1 1 4 2973 2 2 21 GLU CD C -11.061 10.651 -0.773 1.00 . B B . 21 GLU CD 1 1 4 2974 2 2 21 GLU CG C -11.603 10.486 -2.225 1.00 . B B . 21 GLU CG 1 1 4 2975 2 2 21 GLU H H -9.957 8.666 -1.214 1.00 . B B . 21 GLU H 1 1 4 2976 2 2 21 GLU HA H -12.147 8.547 -0.453 1.00 . B B . 21 GLU HA 1 1 4 2977 2 2 21 GLU HB2 H -12.529 8.732 -3.462 1.00 . B B . 21 GLU HB2 1 1 4 2978 2 2 21 GLU HB3 H -13.608 9.355 -2.203 1.00 . B B . 21 GLU HB3 1 1 4 2979 2 2 21 GLU HG2 H -10.718 10.370 -2.840 1.00 . B B . 21 GLU HG2 1 1 4 2980 2 2 21 GLU HG3 H -12.071 11.408 -2.497 1.00 . B B . 21 GLU HG3 1 1 4 2981 2 2 21 GLU N N -10.576 8.230 -1.832 1.00 . B B . 21 GLU N 1 1 4 2982 2 2 21 GLU O O -12.929 5.908 -2.145 1.00 . B B . 21 GLU O 1 1 4 2983 2 2 21 GLU OE1 O -11.824 10.829 0.153 1.00 . B B . 21 GLU OE1 1 1 4 2984 2 2 21 GLU OE2 O -9.854 10.568 -0.612 1.00 . B B . 21 GLU OE2 1 1 4 2985 2 2 22 ARG C C -12.267 3.721 0.355 1.00 . B B . 22 ARG C 1 1 4 2986 2 2 22 ARG CA C -11.483 5.036 0.521 1.00 . B B . 22 ARG CA 1 1 4 2987 2 2 22 ARG CB C -11.521 5.421 2.028 1.00 . B B . 22 ARG CB 1 1 4 2988 2 2 22 ARG CD C -11.171 8.033 2.203 1.00 . B B . 22 ARG CD 1 1 4 2989 2 2 22 ARG CG C -10.559 6.605 2.358 1.00 . B B . 22 ARG CG 1 1 4 2990 2 2 22 ARG CZ C -8.829 8.901 1.992 1.00 . B B . 22 ARG CZ 1 1 4 2991 2 2 22 ARG H H -11.308 7.054 0.190 1.00 . B B . 22 ARG H 1 1 4 2992 2 2 22 ARG HA H -10.581 4.671 0.107 1.00 . B B . 22 ARG HA 1 1 4 2993 2 2 22 ARG HB2 H -12.551 5.606 2.275 1.00 . B B . 22 ARG HB2 1 1 4 2994 2 2 22 ARG HB3 H -11.190 4.525 2.541 1.00 . B B . 22 ARG HB3 1 1 4 2995 2 2 22 ARG HD2 H -11.977 8.055 1.481 1.00 . B B . 22 ARG HD2 1 1 4 2996 2 2 22 ARG HD3 H -11.602 8.334 3.151 1.00 . B B . 22 ARG HD3 1 1 4 2997 2 2 22 ARG HE H -10.350 9.888 1.343 1.00 . B B . 22 ARG HE 1 1 4 2998 2 2 22 ARG HG2 H -10.112 6.454 3.330 1.00 . B B . 22 ARG HG2 1 1 4 2999 2 2 22 ARG HG3 H -9.802 6.541 1.611 1.00 . B B . 22 ARG HG3 1 1 4 3000 2 2 22 ARG HH11 H -9.143 8.064 3.663 1.00 . B B . 22 ARG HH11 1 1 4 3001 2 2 22 ARG HH12 H -7.473 8.113 3.182 1.00 . B B . 22 ARG HH12 1 1 4 3002 2 2 22 ARG HH21 H -8.470 9.788 0.360 1.00 . B B . 22 ARG HH21 1 1 4 3003 2 2 22 ARG HH22 H -7.041 9.263 1.221 1.00 . B B . 22 ARG HH22 1 1 4 3004 2 2 22 ARG N N -11.696 6.304 -0.273 1.00 . B B . 22 ARG N 1 1 4 3005 2 2 22 ARG NE N -10.088 9.041 1.808 1.00 . B B . 22 ARG NE 1 1 4 3006 2 2 22 ARG NH1 N -8.435 8.315 3.024 1.00 . B B . 22 ARG NH1 1 1 4 3007 2 2 22 ARG NH2 N -8.029 9.345 1.140 1.00 . B B . 22 ARG NH2 1 1 4 3008 2 2 22 ARG O O -13.077 3.292 1.150 1.00 . B B . 22 ARG O 1 1 4 3009 2 2 23 GLY C C -11.372 0.877 -0.698 1.00 . B B . 23 GLY C 1 1 4 3010 2 2 23 GLY CA C -12.530 1.782 -1.131 1.00 . B B . 23 GLY CA 1 1 4 3011 2 2 23 GLY H H -11.278 3.570 -1.299 1.00 . B B . 23 GLY H 1 1 4 3012 2 2 23 GLY HA2 H -13.428 1.554 -0.576 1.00 . B B . 23 GLY HA2 1 1 4 3013 2 2 23 GLY HA3 H -12.675 1.711 -2.199 1.00 . B B . 23 GLY HA3 1 1 4 3014 2 2 23 GLY N N -11.938 3.105 -0.736 1.00 . B B . 23 GLY N 1 1 4 3015 2 2 23 GLY O O -10.508 0.580 -1.492 1.00 . B B . 23 GLY O 1 1 4 3016 2 2 24 PHE C C -10.544 -1.920 1.224 1.00 . B B . 24 PHE C 1 1 4 3017 2 2 24 PHE CA C -10.223 -0.412 1.036 1.00 . B B . 24 PHE CA 1 1 4 3018 2 2 24 PHE CB C -9.699 0.206 2.375 1.00 . B B . 24 PHE CB 1 1 4 3019 2 2 24 PHE CD1 C -7.377 -0.838 2.102 1.00 . B B . 24 PHE CD1 1 1 4 3020 2 2 24 PHE CD2 C -8.422 -0.996 4.220 1.00 . B B . 24 PHE CD2 1 1 4 3021 2 2 24 PHE CE1 C -6.282 -1.522 2.586 1.00 . B B . 24 PHE CE1 1 1 4 3022 2 2 24 PHE CE2 C -7.328 -1.680 4.710 1.00 . B B . 24 PHE CE2 1 1 4 3023 2 2 24 PHE CG C -8.465 -0.565 2.910 1.00 . B B . 24 PHE CG 1 1 4 3024 2 2 24 PHE CZ C -6.255 -1.944 3.893 1.00 . B B . 24 PHE CZ 1 1 4 3025 2 2 24 PHE H H -12.070 0.766 1.142 1.00 . B B . 24 PHE H 1 1 4 3026 2 2 24 PHE HA H -9.419 -0.344 0.334 1.00 . B B . 24 PHE HA 1 1 4 3027 2 2 24 PHE HB2 H -9.418 1.238 2.225 1.00 . B B . 24 PHE HB2 1 1 4 3028 2 2 24 PHE HB3 H -10.482 0.163 3.120 1.00 . B B . 24 PHE HB3 1 1 4 3029 2 2 24 PHE HD1 H -7.374 -0.510 1.076 1.00 . B B . 24 PHE HD1 1 1 4 3030 2 2 24 PHE HD2 H -9.252 -0.799 4.880 1.00 . B B . 24 PHE HD2 1 1 4 3031 2 2 24 PHE HE1 H -5.444 -1.730 1.938 1.00 . B B . 24 PHE HE1 1 1 4 3032 2 2 24 PHE HE2 H -7.316 -2.007 5.741 1.00 . B B . 24 PHE HE2 1 1 4 3033 2 2 24 PHE HZ H -5.397 -2.478 4.279 1.00 . B B . 24 PHE HZ 1 1 4 3034 2 2 24 PHE N N -11.348 0.475 0.545 1.00 . B B . 24 PHE N 1 1 4 3035 2 2 24 PHE O O -11.297 -2.315 2.090 1.00 . B B . 24 PHE O 1 1 4 3036 2 2 25 PHE C C -8.883 -5.097 0.610 1.00 . B B . 25 PHE C 1 1 4 3037 2 2 25 PHE CA C -10.169 -4.224 0.453 1.00 . B B . 25 PHE CA 1 1 4 3038 2 2 25 PHE CB C -10.930 -4.631 -0.836 1.00 . B B . 25 PHE CB 1 1 4 3039 2 2 25 PHE CD1 C -9.791 -3.252 -2.639 1.00 . B B . 25 PHE CD1 1 1 4 3040 2 2 25 PHE CD2 C -9.364 -5.589 -2.567 1.00 . B B . 25 PHE CD2 1 1 4 3041 2 2 25 PHE CE1 C -8.947 -3.138 -3.721 1.00 . B B . 25 PHE CE1 1 1 4 3042 2 2 25 PHE CE2 C -8.519 -5.476 -3.650 1.00 . B B . 25 PHE CE2 1 1 4 3043 2 2 25 PHE CG C -10.005 -4.480 -2.052 1.00 . B B . 25 PHE CG 1 1 4 3044 2 2 25 PHE CZ C -8.311 -4.245 -4.227 1.00 . B B . 25 PHE CZ 1 1 4 3045 2 2 25 PHE H H -9.353 -2.299 -0.279 1.00 . B B . 25 PHE H 1 1 4 3046 2 2 25 PHE HA H -10.795 -4.457 1.303 1.00 . B B . 25 PHE HA 1 1 4 3047 2 2 25 PHE HB2 H -11.265 -5.658 -0.772 1.00 . B B . 25 PHE HB2 1 1 4 3048 2 2 25 PHE HB3 H -11.791 -3.994 -0.980 1.00 . B B . 25 PHE HB3 1 1 4 3049 2 2 25 PHE HD1 H -10.285 -2.368 -2.256 1.00 . B B . 25 PHE HD1 1 1 4 3050 2 2 25 PHE HD2 H -9.530 -6.554 -2.109 1.00 . B B . 25 PHE HD2 1 1 4 3051 2 2 25 PHE HE1 H -8.783 -2.173 -4.181 1.00 . B B . 25 PHE HE1 1 1 4 3052 2 2 25 PHE HE2 H -8.022 -6.348 -4.048 1.00 . B B . 25 PHE HE2 1 1 4 3053 2 2 25 PHE HZ H -7.651 -4.135 -5.078 1.00 . B B . 25 PHE HZ 1 1 4 3054 2 2 25 PHE N N -9.946 -2.723 0.385 1.00 . B B . 25 PHE N 1 1 4 3055 2 2 25 PHE O O -8.899 -6.280 0.334 1.00 . B B . 25 PHE O 1 1 4 3056 2 2 26 TYR C C -6.141 -6.549 0.588 1.00 . B B . 26 TYR C 1 1 4 3057 2 2 26 TYR CA C -6.479 -5.177 1.289 1.00 . B B . 26 TYR CA 1 1 4 3058 2 2 26 TYR CB C -6.306 -5.334 2.832 1.00 . B B . 26 TYR CB 1 1 4 3059 2 2 26 TYR CD1 C -3.838 -5.865 2.363 1.00 . B B . 26 TYR CD1 1 1 4 3060 2 2 26 TYR CD2 C -4.810 -6.694 4.359 1.00 . B B . 26 TYR CD2 1 1 4 3061 2 2 26 TYR CE1 C -2.643 -6.454 2.706 1.00 . B B . 26 TYR CE1 1 1 4 3062 2 2 26 TYR CE2 C -3.600 -7.283 4.693 1.00 . B B . 26 TYR CE2 1 1 4 3063 2 2 26 TYR CG C -4.944 -5.977 3.188 1.00 . B B . 26 TYR CG 1 1 4 3064 2 2 26 TYR CZ C -2.514 -7.163 3.862 1.00 . B B . 26 TYR CZ 1 1 4 3065 2 2 26 TYR H H -7.929 -3.550 1.294 1.00 . B B . 26 TYR H 1 1 4 3066 2 2 26 TYR HA H -5.726 -4.488 0.936 1.00 . B B . 26 TYR HA 1 1 4 3067 2 2 26 TYR HB2 H -6.368 -4.374 3.317 1.00 . B B . 26 TYR HB2 1 1 4 3068 2 2 26 TYR HB3 H -7.095 -5.959 3.225 1.00 . B B . 26 TYR HB3 1 1 4 3069 2 2 26 TYR HD1 H -3.885 -5.317 1.434 1.00 . B B . 26 TYR HD1 1 1 4 3070 2 2 26 TYR HD2 H -5.659 -6.796 5.021 1.00 . B B . 26 TYR HD2 1 1 4 3071 2 2 26 TYR HE1 H -1.796 -6.356 2.053 1.00 . B B . 26 TYR HE1 1 1 4 3072 2 2 26 TYR HE2 H -3.503 -7.844 5.608 1.00 . B B . 26 TYR HE2 1 1 4 3073 2 2 26 TYR HH H -1.261 -7.747 5.134 1.00 . B B . 26 TYR HH 1 1 4 3074 2 2 26 TYR N N -7.821 -4.499 1.075 1.00 . B B . 26 TYR N 1 1 4 3075 2 2 26 TYR O O -5.323 -6.575 -0.303 1.00 . B B . 26 TYR O 1 1 4 3076 2 2 26 TYR OH O -1.306 -7.744 4.178 1.00 . B B . 26 TYR OH 1 1 4 3077 2 2 27 THR C C -5.394 -9.498 -0.358 1.00 . B B . 27 THR C 1 1 4 3078 2 2 27 THR CA C -6.615 -9.035 0.495 1.00 . B B . 27 THR CA 1 1 4 3079 2 2 27 THR CB C -7.892 -9.393 -0.294 1.00 . B B . 27 THR CB 1 1 4 3080 2 2 27 THR CG2 C -8.116 -10.886 -0.369 1.00 . B B . 27 THR CG2 1 1 4 3081 2 2 27 THR H H -7.427 -7.450 1.719 1.00 . B B . 27 THR H 1 1 4 3082 2 2 27 THR HA H -6.609 -9.678 1.362 1.00 . B B . 27 THR HA 1 1 4 3083 2 2 27 THR HB H -8.012 -8.869 -1.235 1.00 . B B . 27 THR HB 1 1 4 3084 2 2 27 THR HG1 H -9.053 -8.117 0.499 1.00 . B B . 27 THR HG1 1 1 4 3085 2 2 27 THR HG21 H -8.222 -11.293 0.626 1.00 . B B . 27 THR HG21 1 1 4 3086 2 2 27 THR HG22 H -9.027 -11.077 -0.910 1.00 . B B . 27 THR HG22 1 1 4 3087 2 2 27 THR HG23 H -7.300 -11.379 -0.868 1.00 . B B . 27 THR HG23 1 1 4 3088 2 2 27 THR N N -6.778 -7.605 1.007 1.00 . B B . 27 THR N 1 1 4 3089 2 2 27 THR O O -4.338 -9.741 0.195 1.00 . B B . 27 THR O 1 1 4 3090 2 2 27 THR OG1 O -8.934 -9.071 0.601 1.00 . B B . 27 THR OG1 1 1 4 3091 2 2 28 PRO C C -3.861 -11.657 -1.625 1.00 . B B . 28 PRO C 1 1 4 3092 2 2 28 PRO CA C -4.791 -10.694 -2.427 1.00 . B B . 28 PRO CA 1 1 4 3093 2 2 28 PRO CB C -4.059 -9.880 -3.508 1.00 . B B . 28 PRO CB 1 1 4 3094 2 2 28 PRO CD C -5.561 -8.357 -2.474 1.00 . B B . 28 PRO CD 1 1 4 3095 2 2 28 PRO CG C -5.129 -8.836 -3.861 1.00 . B B . 28 PRO CG 1 1 4 3096 2 2 28 PRO HA H -5.507 -11.328 -2.916 1.00 . B B . 28 PRO HA 1 1 4 3097 2 2 28 PRO HB2 H -3.162 -9.426 -3.108 1.00 . B B . 28 PRO HB2 1 1 4 3098 2 2 28 PRO HB3 H -3.796 -10.500 -4.354 1.00 . B B . 28 PRO HB3 1 1 4 3099 2 2 28 PRO HD2 H -4.826 -7.669 -2.096 1.00 . B B . 28 PRO HD2 1 1 4 3100 2 2 28 PRO HD3 H -6.539 -7.896 -2.465 1.00 . B B . 28 PRO HD3 1 1 4 3101 2 2 28 PRO HG2 H -4.705 -8.026 -4.438 1.00 . B B . 28 PRO HG2 1 1 4 3102 2 2 28 PRO HG3 H -5.958 -9.275 -4.398 1.00 . B B . 28 PRO HG3 1 1 4 3103 2 2 28 PRO N N -5.548 -9.620 -1.666 1.00 . B B . 28 PRO N 1 1 4 3104 2 2 28 PRO O O -2.653 -11.692 -1.765 1.00 . B B . 28 PRO O 1 1 4 3105 2 2 29 LYS C C -4.288 -14.874 0.010 1.00 . B B . 29 LYS C 1 1 4 3106 2 2 29 LYS CA C -3.740 -13.419 0.072 1.00 . B B . 29 LYS CA 1 1 4 3107 2 2 29 LYS CB C -3.788 -12.811 1.504 1.00 . B B . 29 LYS CB 1 1 4 3108 2 2 29 LYS CD C -1.228 -12.951 1.679 1.00 . B B . 29 LYS CD 1 1 4 3109 2 2 29 LYS CE C -1.166 -11.526 1.102 1.00 . B B . 29 LYS CE 1 1 4 3110 2 2 29 LYS CG C -2.593 -13.271 2.386 1.00 . B B . 29 LYS CG 1 1 4 3111 2 2 29 LYS H H -5.457 -12.360 -0.714 1.00 . B B . 29 LYS H 1 1 4 3112 2 2 29 LYS HA H -2.727 -13.481 -0.293 1.00 . B B . 29 LYS HA 1 1 4 3113 2 2 29 LYS HB2 H -3.818 -11.730 1.444 1.00 . B B . 29 LYS HB2 1 1 4 3114 2 2 29 LYS HB3 H -4.716 -13.114 1.975 1.00 . B B . 29 LYS HB3 1 1 4 3115 2 2 29 LYS HD2 H -0.429 -13.050 2.402 1.00 . B B . 29 LYS HD2 1 1 4 3116 2 2 29 LYS HD3 H -1.032 -13.659 0.886 1.00 . B B . 29 LYS HD3 1 1 4 3117 2 2 29 LYS HE2 H -1.940 -11.348 0.362 1.00 . B B . 29 LYS HE2 1 1 4 3118 2 2 29 LYS HE3 H -1.295 -10.792 1.893 1.00 . B B . 29 LYS HE3 1 1 4 3119 2 2 29 LYS HG2 H -2.636 -12.755 3.339 1.00 . B B . 29 LYS HG2 1 1 4 3120 2 2 29 LYS HG3 H -2.667 -14.332 2.600 1.00 . B B . 29 LYS HG3 1 1 4 3121 2 2 29 LYS HZ1 H 0.808 -12.247 0.648 1.00 . B B . 29 LYS HZ1 1 1 4 3122 2 2 29 LYS HZ2 H 0.221 -11.279 -0.540 1.00 . B B . 29 LYS HZ2 1 1 4 3123 2 2 29 LYS HZ3 H 0.803 -10.677 0.866 1.00 . B B . 29 LYS HZ3 1 1 4 3124 2 2 29 LYS N N -4.486 -12.434 -0.780 1.00 . B B . 29 LYS N 1 1 4 3125 2 2 29 LYS NZ N 0.184 -11.427 0.490 1.00 . B B . 29 LYS NZ 1 1 4 3126 2 2 29 LYS O O -5.349 -15.131 -0.517 1.00 . B B . 29 LYS O 1 1 4 3127 2 2 30 THR C C -5.231 -17.722 0.147 1.00 . B B . 30 THR C 1 1 4 3128 2 2 30 THR CA C -3.842 -17.259 0.637 1.00 . B B . 30 THR CA 1 1 4 3129 2 2 30 THR CB C -3.645 -17.694 2.100 1.00 . B B . 30 THR CB 1 1 4 3130 2 2 30 THR CG2 C -3.288 -19.170 2.223 1.00 . B B . 30 THR CG2 1 1 4 3131 2 2 30 THR H H -2.692 -15.483 0.981 1.00 . B B . 30 THR H 1 1 4 3132 2 2 30 THR HA H -3.118 -17.786 0.036 1.00 . B B . 30 THR HA 1 1 4 3133 2 2 30 THR HB H -4.428 -17.356 2.771 1.00 . B B . 30 THR HB 1 1 4 3134 2 2 30 THR HG1 H -1.853 -17.795 2.867 1.00 . B B . 30 THR HG1 1 1 4 3135 2 2 30 THR HG21 H -2.379 -19.394 1.684 1.00 . B B . 30 THR HG21 1 1 4 3136 2 2 30 THR HG22 H -3.160 -19.436 3.262 1.00 . B B . 30 THR HG22 1 1 4 3137 2 2 30 THR HG23 H -4.082 -19.778 1.814 1.00 . B B . 30 THR HG23 1 1 4 3138 2 2 30 THR N N -3.529 -15.774 0.566 1.00 . B B . 30 THR N 1 1 4 3139 2 2 30 THR O O -5.580 -18.886 0.228 1.00 . B B . 30 THR O 1 1 4 3140 2 2 30 THR OG1 O -2.388 -17.122 2.433 1.00 . B B . 30 THR OG1 1 1 5 3141 1 1 1 GLY C C -0.917 -6.454 -0.954 1.00 . A A . 1 GLY C 1 1 5 3142 1 1 1 GLY CA C -1.346 -6.693 -2.398 1.00 . A A . 1 GLY CA 1 1 5 3143 1 1 1 GLY HA2 H -1.907 -7.592 -2.417 1.00 . A A . 1 GLY HA2 1 1 5 3144 1 1 1 GLY HA3 H -0.457 -6.887 -2.967 1.00 . A A . 1 GLY HA3 1 1 5 3145 1 1 1 GLY N N -2.186 -5.603 -3.029 1.00 . A A . 1 GLY N 1 1 5 3146 1 1 1 GLY O O -1.021 -7.321 -0.112 1.00 . A A . 1 GLY O 1 1 5 3147 1 1 2 ILE C C 1.250 -5.355 1.224 1.00 . A A . 2 ILE C 1 1 5 3148 1 1 2 ILE CA C 0.074 -4.672 0.542 1.00 . A A . 2 ILE CA 1 1 5 3149 1 1 2 ILE CB C -1.152 -4.527 1.574 1.00 . A A . 2 ILE CB 1 1 5 3150 1 1 2 ILE CD1 C -1.951 -3.184 3.612 1.00 . A A . 2 ILE CD1 1 1 5 3151 1 1 2 ILE CG1 C -0.741 -3.531 2.698 1.00 . A A . 2 ILE CG1 1 1 5 3152 1 1 2 ILE CG2 C -1.545 -5.830 2.290 1.00 . A A . 2 ILE CG2 1 1 5 3153 1 1 2 ILE H H -0.428 -4.702 -1.567 1.00 . A A . 2 ILE H 1 1 5 3154 1 1 2 ILE HA H 0.490 -3.708 0.338 1.00 . A A . 2 ILE HA 1 1 5 3155 1 1 2 ILE HB H -2.004 -4.132 1.037 1.00 . A A . 2 ILE HB 1 1 5 3156 1 1 2 ILE HD11 H -2.770 -2.806 3.019 1.00 . A A . 2 ILE HD11 1 1 5 3157 1 1 2 ILE HD12 H -2.292 -4.046 4.160 1.00 . A A . 2 ILE HD12 1 1 5 3158 1 1 2 ILE HD13 H -1.658 -2.430 4.330 1.00 . A A . 2 ILE HD13 1 1 5 3159 1 1 2 ILE HG12 H 0.020 -3.998 3.305 1.00 . A A . 2 ILE HG12 1 1 5 3160 1 1 2 ILE HG13 H -0.309 -2.627 2.289 1.00 . A A . 2 ILE HG13 1 1 5 3161 1 1 2 ILE HG21 H -0.710 -6.216 2.853 1.00 . A A . 2 ILE HG21 1 1 5 3162 1 1 2 ILE HG22 H -2.349 -5.623 2.968 1.00 . A A . 2 ILE HG22 1 1 5 3163 1 1 2 ILE HG23 H -1.907 -6.585 1.623 1.00 . A A . 2 ILE HG23 1 1 5 3164 1 1 2 ILE N N -0.443 -5.257 -0.760 1.00 . A A . 2 ILE N 1 1 5 3165 1 1 2 ILE O O 2.097 -4.645 1.733 1.00 . A A . 2 ILE O 1 1 5 3166 1 1 3 VAL C C 3.729 -7.337 1.007 1.00 . A A . 3 VAL C 1 1 5 3167 1 1 3 VAL CA C 2.519 -7.232 1.938 1.00 . A A . 3 VAL CA 1 1 5 3168 1 1 3 VAL CB C 2.098 -8.638 2.526 1.00 . A A . 3 VAL CB 1 1 5 3169 1 1 3 VAL CG1 C 1.323 -8.381 3.830 1.00 . A A . 3 VAL CG1 1 1 5 3170 1 1 3 VAL CG2 C 1.093 -9.385 1.616 1.00 . A A . 3 VAL CG2 1 1 5 3171 1 1 3 VAL H H 0.620 -7.185 0.841 1.00 . A A . 3 VAL H 1 1 5 3172 1 1 3 VAL HA H 2.809 -6.577 2.747 1.00 . A A . 3 VAL HA 1 1 5 3173 1 1 3 VAL HB H 2.978 -9.244 2.716 1.00 . A A . 3 VAL HB 1 1 5 3174 1 1 3 VAL HG11 H 1.938 -7.845 4.536 1.00 . A A . 3 VAL HG11 1 1 5 3175 1 1 3 VAL HG12 H 0.442 -7.789 3.637 1.00 . A A . 3 VAL HG12 1 1 5 3176 1 1 3 VAL HG13 H 1.012 -9.312 4.282 1.00 . A A . 3 VAL HG13 1 1 5 3177 1 1 3 VAL HG21 H 1.483 -9.528 0.620 1.00 . A A . 3 VAL HG21 1 1 5 3178 1 1 3 VAL HG22 H 0.857 -10.353 2.033 1.00 . A A . 3 VAL HG22 1 1 5 3179 1 1 3 VAL HG23 H 0.171 -8.829 1.528 1.00 . A A . 3 VAL HG23 1 1 5 3180 1 1 3 VAL N N 1.331 -6.648 1.251 1.00 . A A . 3 VAL N 1 1 5 3181 1 1 3 VAL O O 4.533 -6.428 1.008 1.00 . A A . 3 VAL O 1 1 5 3182 1 1 4 GLU C C 5.473 -7.139 -1.377 1.00 . A A . 4 GLU C 1 1 5 3183 1 1 4 GLU CA C 5.063 -8.464 -0.675 1.00 . A A . 4 GLU CA 1 1 5 3184 1 1 4 GLU CB C 4.744 -9.597 -1.726 1.00 . A A . 4 GLU CB 1 1 5 3185 1 1 4 GLU CD C 2.367 -8.618 -2.296 1.00 . A A . 4 GLU CD 1 1 5 3186 1 1 4 GLU CG C 3.183 -9.850 -1.929 1.00 . A A . 4 GLU CG 1 1 5 3187 1 1 4 GLU H H 3.193 -9.059 0.230 1.00 . A A . 4 GLU H 1 1 5 3188 1 1 4 GLU HA H 5.902 -8.733 -0.054 1.00 . A A . 4 GLU HA 1 1 5 3189 1 1 4 GLU HB2 H 5.179 -9.346 -2.684 1.00 . A A . 4 GLU HB2 1 1 5 3190 1 1 4 GLU HB3 H 5.203 -10.518 -1.393 1.00 . A A . 4 GLU HB3 1 1 5 3191 1 1 4 GLU HG2 H 3.061 -10.545 -2.742 1.00 . A A . 4 GLU HG2 1 1 5 3192 1 1 4 GLU HG3 H 2.751 -10.294 -1.049 1.00 . A A . 4 GLU HG3 1 1 5 3193 1 1 4 GLU N N 3.876 -8.363 0.232 1.00 . A A . 4 GLU N 1 1 5 3194 1 1 4 GLU O O 6.493 -6.533 -1.110 1.00 . A A . 4 GLU O 1 1 5 3195 1 1 4 GLU OE1 O 2.501 -8.204 -3.427 1.00 . A A . 4 GLU OE1 1 1 5 3196 1 1 4 GLU OE2 O 1.660 -8.141 -1.434 1.00 . A A . 4 GLU OE2 1 1 5 3197 1 1 5 GLN C C 5.297 -4.175 -2.218 1.00 . A A . 5 GLN C 1 1 5 3198 1 1 5 GLN CA C 4.905 -5.444 -3.045 1.00 . A A . 5 GLN CA 1 1 5 3199 1 1 5 GLN CB C 3.606 -5.291 -3.874 1.00 . A A . 5 GLN CB 1 1 5 3200 1 1 5 GLN CD C 1.068 -5.147 -3.722 1.00 . A A . 5 GLN CD 1 1 5 3201 1 1 5 GLN CG C 2.362 -5.032 -2.939 1.00 . A A . 5 GLN CG 1 1 5 3202 1 1 5 GLN H H 3.859 -7.234 -2.449 1.00 . A A . 5 GLN H 1 1 5 3203 1 1 5 GLN HA H 5.726 -5.612 -3.728 1.00 . A A . 5 GLN HA 1 1 5 3204 1 1 5 GLN HB2 H 3.701 -4.533 -4.632 1.00 . A A . 5 GLN HB2 1 1 5 3205 1 1 5 GLN HB3 H 3.463 -6.224 -4.402 1.00 . A A . 5 GLN HB3 1 1 5 3206 1 1 5 GLN HE21 H 1.630 -6.774 -4.632 1.00 . A A . 5 GLN HE21 1 1 5 3207 1 1 5 GLN HE22 H 0.122 -6.133 -5.122 1.00 . A A . 5 GLN HE22 1 1 5 3208 1 1 5 GLN HG2 H 2.306 -5.763 -2.147 1.00 . A A . 5 GLN HG2 1 1 5 3209 1 1 5 GLN HG3 H 2.392 -4.045 -2.514 1.00 . A A . 5 GLN HG3 1 1 5 3210 1 1 5 GLN N N 4.664 -6.701 -2.277 1.00 . A A . 5 GLN N 1 1 5 3211 1 1 5 GLN NE2 N 0.922 -6.097 -4.569 1.00 . A A . 5 GLN NE2 1 1 5 3212 1 1 5 GLN O O 6.027 -3.343 -2.720 1.00 . A A . 5 GLN O 1 1 5 3213 1 1 5 GLN OE1 O 0.141 -4.382 -3.581 1.00 . A A . 5 GLN OE1 1 1 5 3214 1 1 6 CYS C C 6.131 -3.064 1.024 1.00 . A A . 6 CYS C 1 1 5 3215 1 1 6 CYS CA C 5.186 -2.826 -0.165 1.00 . A A . 6 CYS CA 1 1 5 3216 1 1 6 CYS CB C 3.823 -2.283 0.247 1.00 . A A . 6 CYS CB 1 1 5 3217 1 1 6 CYS H H 4.264 -4.751 -0.605 1.00 . A A . 6 CYS H 1 1 5 3218 1 1 6 CYS HA H 5.668 -2.047 -0.744 1.00 . A A . 6 CYS HA 1 1 5 3219 1 1 6 CYS HB2 H 3.311 -3.053 0.793 1.00 . A A . 6 CYS HB2 1 1 5 3220 1 1 6 CYS HB3 H 3.929 -1.422 0.883 1.00 . A A . 6 CYS HB3 1 1 5 3221 1 1 6 CYS HG H 2.260 -2.582 -1.411 1.00 . A A . 6 CYS HG 1 1 5 3222 1 1 6 CYS N N 4.839 -4.045 -0.997 1.00 . A A . 6 CYS N 1 1 5 3223 1 1 6 CYS O O 6.892 -2.203 1.423 1.00 . A A . 6 CYS O 1 1 5 3224 1 1 6 CYS SG S 2.750 -1.807 -1.126 1.00 . A A . 6 CYS SG 1 1 5 3225 1 1 7 CYS C C 7.996 -5.678 2.356 1.00 . A A . 7 CYS C 1 1 5 3226 1 1 7 CYS CA C 6.927 -4.591 2.717 1.00 . A A . 7 CYS CA 1 1 5 3227 1 1 7 CYS CB C 5.863 -4.978 3.738 1.00 . A A . 7 CYS CB 1 1 5 3228 1 1 7 CYS H H 5.466 -4.917 1.203 1.00 . A A . 7 CYS H 1 1 5 3229 1 1 7 CYS HA H 7.440 -3.701 3.071 1.00 . A A . 7 CYS HA 1 1 5 3230 1 1 7 CYS HB2 H 5.326 -4.057 3.940 1.00 . A A . 7 CYS HB2 1 1 5 3231 1 1 7 CYS HB3 H 5.134 -5.612 3.251 1.00 . A A . 7 CYS HB3 1 1 5 3232 1 1 7 CYS HG H 6.503 -6.661 5.157 1.00 . A A . 7 CYS HG 1 1 5 3233 1 1 7 CYS N N 6.073 -4.236 1.556 1.00 . A A . 7 CYS N 1 1 5 3234 1 1 7 CYS O O 8.605 -6.308 3.197 1.00 . A A . 7 CYS O 1 1 5 3235 1 1 7 CYS SG S 6.383 -5.721 5.308 1.00 . A A . 7 CYS SG 1 1 5 3236 1 1 8 THR C C 9.910 -6.406 -0.744 1.00 . A A . 8 THR C 1 1 5 3237 1 1 8 THR CA C 9.199 -6.895 0.542 1.00 . A A . 8 THR CA 1 1 5 3238 1 1 8 THR CB C 8.506 -8.233 0.205 1.00 . A A . 8 THR CB 1 1 5 3239 1 1 8 THR CG2 C 9.469 -9.382 0.147 1.00 . A A . 8 THR CG2 1 1 5 3240 1 1 8 THR H H 7.643 -5.352 0.464 1.00 . A A . 8 THR H 1 1 5 3241 1 1 8 THR HA H 9.968 -7.064 1.281 1.00 . A A . 8 THR HA 1 1 5 3242 1 1 8 THR HB H 7.856 -8.208 -0.656 1.00 . A A . 8 THR HB 1 1 5 3243 1 1 8 THR HG1 H 8.012 -8.004 2.088 1.00 . A A . 8 THR HG1 1 1 5 3244 1 1 8 THR HG21 H 10.218 -9.218 -0.611 1.00 . A A . 8 THR HG21 1 1 5 3245 1 1 8 THR HG22 H 9.950 -9.511 1.105 1.00 . A A . 8 THR HG22 1 1 5 3246 1 1 8 THR HG23 H 8.920 -10.284 -0.082 1.00 . A A . 8 THR HG23 1 1 5 3247 1 1 8 THR N N 8.190 -5.882 1.079 1.00 . A A . 8 THR N 1 1 5 3248 1 1 8 THR O O 11.112 -6.463 -0.885 1.00 . A A . 8 THR O 1 1 5 3249 1 1 8 THR OG1 O 7.807 -8.624 1.371 1.00 . A A . 8 THR OG1 1 1 5 3250 1 1 9 SER C C 9.100 -3.921 -3.165 1.00 . A A . 9 SER C 1 1 5 3251 1 1 9 SER CA C 9.548 -5.403 -3.011 1.00 . A A . 9 SER CA 1 1 5 3252 1 1 9 SER CB C 8.918 -6.290 -4.102 1.00 . A A . 9 SER CB 1 1 5 3253 1 1 9 SER H H 8.159 -5.959 -1.438 1.00 . A A . 9 SER H 1 1 5 3254 1 1 9 SER HA H 10.625 -5.421 -3.086 1.00 . A A . 9 SER HA 1 1 5 3255 1 1 9 SER HB2 H 9.156 -7.333 -3.936 1.00 . A A . 9 SER HB2 1 1 5 3256 1 1 9 SER HB3 H 7.843 -6.164 -4.130 1.00 . A A . 9 SER HB3 1 1 5 3257 1 1 9 SER HG H 10.045 -6.496 -5.739 1.00 . A A . 9 SER HG 1 1 5 3258 1 1 9 SER N N 9.108 -5.944 -1.663 1.00 . A A . 9 SER N 1 1 5 3259 1 1 9 SER O O 8.903 -3.283 -2.153 1.00 . A A . 9 SER O 1 1 5 3260 1 1 9 SER OG O 9.499 -5.817 -5.319 1.00 . A A . 9 SER OG 1 1 5 3261 1 1 10 ILE C C 7.229 -1.684 -5.373 1.00 . A A . 10 ILE C 1 1 5 3262 1 1 10 ILE CA C 8.517 -1.961 -4.536 1.00 . A A . 10 ILE CA 1 1 5 3263 1 1 10 ILE CB C 9.745 -1.151 -5.118 1.00 . A A . 10 ILE CB 1 1 5 3264 1 1 10 ILE CD1 C 12.252 -0.696 -4.764 1.00 . A A . 10 ILE CD1 1 1 5 3265 1 1 10 ILE CG1 C 10.969 -1.334 -4.157 1.00 . A A . 10 ILE CG1 1 1 5 3266 1 1 10 ILE CG2 C 9.383 0.370 -5.053 1.00 . A A . 10 ILE CG2 1 1 5 3267 1 1 10 ILE H H 9.119 -3.986 -5.119 1.00 . A A . 10 ILE H 1 1 5 3268 1 1 10 ILE HA H 8.314 -1.575 -3.576 1.00 . A A . 10 ILE HA 1 1 5 3269 1 1 10 ILE HB H 9.970 -1.469 -6.130 1.00 . A A . 10 ILE HB 1 1 5 3270 1 1 10 ILE HD11 H 12.475 -1.141 -5.724 1.00 . A A . 10 ILE HD11 1 1 5 3271 1 1 10 ILE HD12 H 12.127 0.369 -4.895 1.00 . A A . 10 ILE HD12 1 1 5 3272 1 1 10 ILE HD13 H 13.095 -0.857 -4.108 1.00 . A A . 10 ILE HD13 1 1 5 3273 1 1 10 ILE HG12 H 10.757 -0.860 -3.207 1.00 . A A . 10 ILE HG12 1 1 5 3274 1 1 10 ILE HG13 H 11.148 -2.382 -3.956 1.00 . A A . 10 ILE HG13 1 1 5 3275 1 1 10 ILE HG21 H 9.198 0.673 -4.031 1.00 . A A . 10 ILE HG21 1 1 5 3276 1 1 10 ILE HG22 H 10.195 0.969 -5.433 1.00 . A A . 10 ILE HG22 1 1 5 3277 1 1 10 ILE HG23 H 8.506 0.587 -5.642 1.00 . A A . 10 ILE HG23 1 1 5 3278 1 1 10 ILE N N 8.949 -3.401 -4.360 1.00 . A A . 10 ILE N 1 1 5 3279 1 1 10 ILE O O 7.135 -1.799 -6.578 1.00 . A A . 10 ILE O 1 1 5 3280 1 1 11 CYS C C 4.470 0.577 -4.960 1.00 . A A . 11 CYS C 1 1 5 3281 1 1 11 CYS CA C 4.842 -0.947 -5.043 1.00 . A A . 11 CYS CA 1 1 5 3282 1 1 11 CYS CB C 3.979 -1.765 -4.122 1.00 . A A . 11 CYS CB 1 1 5 3283 1 1 11 CYS H H 6.488 -1.270 -3.663 1.00 . A A . 11 CYS H 1 1 5 3284 1 1 11 CYS HA H 4.697 -1.270 -6.062 1.00 . A A . 11 CYS HA 1 1 5 3285 1 1 11 CYS HB2 H 2.926 -1.717 -4.317 1.00 . A A . 11 CYS HB2 1 1 5 3286 1 1 11 CYS HB3 H 4.298 -2.787 -4.148 1.00 . A A . 11 CYS HB3 1 1 5 3287 1 1 11 CYS HG H 5.078 -1.119 -2.247 1.00 . A A . 11 CYS HG 1 1 5 3288 1 1 11 CYS N N 6.247 -1.303 -4.610 1.00 . A A . 11 CYS N 1 1 5 3289 1 1 11 CYS O O 3.320 0.958 -4.983 1.00 . A A . 11 CYS O 1 1 5 3290 1 1 11 CYS SG S 4.141 -1.247 -2.408 1.00 . A A . 11 CYS SG 1 1 5 3291 1 1 12 SER C C 3.952 3.779 -5.310 1.00 . A A . 12 SER C 1 1 5 3292 1 1 12 SER CA C 5.141 2.940 -4.776 1.00 . A A . 12 SER CA 1 1 5 3293 1 1 12 SER CB C 6.403 3.713 -5.253 1.00 . A A . 12 SER CB 1 1 5 3294 1 1 12 SER H H 6.350 1.153 -4.897 1.00 . A A . 12 SER H 1 1 5 3295 1 1 12 SER HA H 4.881 2.997 -3.748 1.00 . A A . 12 SER HA 1 1 5 3296 1 1 12 SER HB2 H 6.378 3.915 -6.312 1.00 . A A . 12 SER HB2 1 1 5 3297 1 1 12 SER HB3 H 6.482 4.659 -4.729 1.00 . A A . 12 SER HB3 1 1 5 3298 1 1 12 SER HG H 8.291 3.439 -4.978 1.00 . A A . 12 SER HG 1 1 5 3299 1 1 12 SER N N 5.416 1.451 -4.881 1.00 . A A . 12 SER N 1 1 5 3300 1 1 12 SER O O 4.008 4.487 -6.287 1.00 . A A . 12 SER O 1 1 5 3301 1 1 12 SER OG O 7.507 2.872 -4.914 1.00 . A A . 12 SER OG 1 1 5 3302 1 1 13 LEU C C 0.758 3.365 -5.615 1.00 . A A . 13 LEU C 1 1 5 3303 1 1 13 LEU CA C 1.509 4.199 -4.669 1.00 . A A . 13 LEU CA 1 1 5 3304 1 1 13 LEU CB C 1.364 5.646 -5.266 1.00 . A A . 13 LEU CB 1 1 5 3305 1 1 13 LEU CD1 C 1.927 8.002 -5.160 1.00 . A A . 13 LEU CD1 1 1 5 3306 1 1 13 LEU CD2 C 2.823 6.485 -3.408 1.00 . A A . 13 LEU CD2 1 1 5 3307 1 1 13 LEU CG C 2.437 6.591 -4.894 1.00 . A A . 13 LEU CG 1 1 5 3308 1 1 13 LEU H H 3.022 2.957 -3.906 1.00 . A A . 13 LEU H 1 1 5 3309 1 1 13 LEU HA H 1.024 4.158 -3.708 1.00 . A A . 13 LEU HA 1 1 5 3310 1 1 13 LEU HB2 H 1.332 5.619 -6.348 1.00 . A A . 13 LEU HB2 1 1 5 3311 1 1 13 LEU HB3 H 0.415 6.046 -4.936 1.00 . A A . 13 LEU HB3 1 1 5 3312 1 1 13 LEU HD11 H 1.680 8.123 -6.205 1.00 . A A . 13 LEU HD11 1 1 5 3313 1 1 13 LEU HD12 H 1.043 8.204 -4.569 1.00 . A A . 13 LEU HD12 1 1 5 3314 1 1 13 LEU HD13 H 2.684 8.726 -4.899 1.00 . A A . 13 LEU HD13 1 1 5 3315 1 1 13 LEU HD21 H 1.964 6.693 -2.786 1.00 . A A . 13 LEU HD21 1 1 5 3316 1 1 13 LEU HD22 H 3.196 5.505 -3.159 1.00 . A A . 13 LEU HD22 1 1 5 3317 1 1 13 LEU HD23 H 3.595 7.203 -3.176 1.00 . A A . 13 LEU HD23 1 1 5 3318 1 1 13 LEU HG H 3.193 6.334 -5.623 1.00 . A A . 13 LEU HG 1 1 5 3319 1 1 13 LEU N N 2.887 3.605 -4.588 1.00 . A A . 13 LEU N 1 1 5 3320 1 1 13 LEU O O -0.308 2.863 -5.339 1.00 . A A . 13 LEU O 1 1 5 3321 1 1 14 TYR C C 0.378 1.113 -7.343 1.00 . A A . 14 TYR C 1 1 5 3322 1 1 14 TYR CA C 0.862 2.461 -7.817 1.00 . A A . 14 TYR CA 1 1 5 3323 1 1 14 TYR CB C 1.868 2.255 -8.992 1.00 . A A . 14 TYR CB 1 1 5 3324 1 1 14 TYR CD1 C 3.894 0.986 -8.109 1.00 . A A . 14 TYR CD1 1 1 5 3325 1 1 14 TYR CD2 C 4.127 3.244 -8.785 1.00 . A A . 14 TYR CD2 1 1 5 3326 1 1 14 TYR CE1 C 5.242 0.957 -7.787 1.00 . A A . 14 TYR CE1 1 1 5 3327 1 1 14 TYR CE2 C 5.459 3.204 -8.463 1.00 . A A . 14 TYR CE2 1 1 5 3328 1 1 14 TYR CG C 3.335 2.139 -8.610 1.00 . A A . 14 TYR CG 1 1 5 3329 1 1 14 TYR CZ C 6.025 2.066 -7.962 1.00 . A A . 14 TYR CZ 1 1 5 3330 1 1 14 TYR H H 2.328 3.665 -6.679 1.00 . A A . 14 TYR H 1 1 5 3331 1 1 14 TYR HA H 0.034 3.079 -8.120 1.00 . A A . 14 TYR HA 1 1 5 3332 1 1 14 TYR HB2 H 1.585 1.344 -9.506 1.00 . A A . 14 TYR HB2 1 1 5 3333 1 1 14 TYR HB3 H 1.742 3.064 -9.693 1.00 . A A . 14 TYR HB3 1 1 5 3334 1 1 14 TYR HD1 H 3.281 0.106 -7.967 1.00 . A A . 14 TYR HD1 1 1 5 3335 1 1 14 TYR HD2 H 3.702 4.158 -9.177 1.00 . A A . 14 TYR HD2 1 1 5 3336 1 1 14 TYR HE1 H 5.697 0.059 -7.400 1.00 . A A . 14 TYR HE1 1 1 5 3337 1 1 14 TYR HE2 H 6.060 4.083 -8.607 1.00 . A A . 14 TYR HE2 1 1 5 3338 1 1 14 TYR HH H 7.397 2.202 -6.670 1.00 . A A . 14 TYR HH 1 1 5 3339 1 1 14 TYR N N 1.442 3.241 -6.707 1.00 . A A . 14 TYR N 1 1 5 3340 1 1 14 TYR O O -0.565 0.575 -7.872 1.00 . A A . 14 TYR O 1 1 5 3341 1 1 14 TYR OH O 7.359 2.061 -7.625 1.00 . A A . 14 TYR OH 1 1 5 3342 1 1 15 GLN C C 0.353 -0.761 -4.361 1.00 . A A . 15 GLN C 1 1 5 3343 1 1 15 GLN CA C 0.567 -0.760 -5.874 1.00 . A A . 15 GLN CA 1 1 5 3344 1 1 15 GLN CB C 1.580 -1.821 -6.360 1.00 . A A . 15 GLN CB 1 1 5 3345 1 1 15 GLN CD C 0.044 -2.730 -8.213 1.00 . A A . 15 GLN CD 1 1 5 3346 1 1 15 GLN CG C 1.354 -2.009 -7.890 1.00 . A A . 15 GLN CG 1 1 5 3347 1 1 15 GLN H H 1.853 1.021 -5.970 1.00 . A A . 15 GLN H 1 1 5 3348 1 1 15 GLN HA H -0.390 -0.980 -6.313 1.00 . A A . 15 GLN HA 1 1 5 3349 1 1 15 GLN HB2 H 2.585 -1.483 -6.208 1.00 . A A . 15 GLN HB2 1 1 5 3350 1 1 15 GLN HB3 H 1.412 -2.757 -5.833 1.00 . A A . 15 GLN HB3 1 1 5 3351 1 1 15 GLN HE21 H -1.059 -1.105 -8.486 1.00 . A A . 15 GLN HE21 1 1 5 3352 1 1 15 GLN HE22 H -1.818 -2.608 -8.718 1.00 . A A . 15 GLN HE22 1 1 5 3353 1 1 15 GLN HG2 H 1.335 -1.052 -8.383 1.00 . A A . 15 GLN HG2 1 1 5 3354 1 1 15 GLN HG3 H 2.158 -2.600 -8.293 1.00 . A A . 15 GLN HG3 1 1 5 3355 1 1 15 GLN N N 1.050 0.571 -6.364 1.00 . A A . 15 GLN N 1 1 5 3356 1 1 15 GLN NE2 N -1.029 -2.085 -8.495 1.00 . A A . 15 GLN NE2 1 1 5 3357 1 1 15 GLN O O 0.711 -1.639 -3.610 1.00 . A A . 15 GLN O 1 1 5 3358 1 1 15 GLN OE1 O -0.044 -3.932 -8.210 1.00 . A A . 15 GLN OE1 1 1 5 3359 1 1 16 LEU C C -2.108 1.067 -2.787 1.00 . A A . 16 LEU C 1 1 5 3360 1 1 16 LEU CA C -0.655 0.669 -2.630 1.00 . A A . 16 LEU CA 1 1 5 3361 1 1 16 LEU CB C 0.277 1.821 -2.088 1.00 . A A . 16 LEU CB 1 1 5 3362 1 1 16 LEU CD1 C 2.746 1.267 -1.988 1.00 . A A . 16 LEU CD1 1 1 5 3363 1 1 16 LEU CD2 C 1.590 1.781 0.100 1.00 . A A . 16 LEU CD2 1 1 5 3364 1 1 16 LEU CG C 1.427 1.174 -1.287 1.00 . A A . 16 LEU CG 1 1 5 3365 1 1 16 LEU H H -0.476 0.959 -4.689 1.00 . A A . 16 LEU H 1 1 5 3366 1 1 16 LEU HA H -0.693 -0.242 -2.101 1.00 . A A . 16 LEU HA 1 1 5 3367 1 1 16 LEU HB2 H 0.678 2.360 -2.925 1.00 . A A . 16 LEU HB2 1 1 5 3368 1 1 16 LEU HB3 H -0.274 2.501 -1.458 1.00 . A A . 16 LEU HB3 1 1 5 3369 1 1 16 LEU HD11 H 3.033 2.285 -2.171 1.00 . A A . 16 LEU HD11 1 1 5 3370 1 1 16 LEU HD12 H 3.498 0.798 -1.369 1.00 . A A . 16 LEU HD12 1 1 5 3371 1 1 16 LEU HD13 H 2.669 0.714 -2.908 1.00 . A A . 16 LEU HD13 1 1 5 3372 1 1 16 LEU HD21 H 1.820 2.832 0.053 1.00 . A A . 16 LEU HD21 1 1 5 3373 1 1 16 LEU HD22 H 0.684 1.628 0.669 1.00 . A A . 16 LEU HD22 1 1 5 3374 1 1 16 LEU HD23 H 2.384 1.266 0.623 1.00 . A A . 16 LEU HD23 1 1 5 3375 1 1 16 LEU HG H 1.197 0.126 -1.185 1.00 . A A . 16 LEU HG 1 1 5 3376 1 1 16 LEU N N -0.259 0.322 -4.001 1.00 . A A . 16 LEU N 1 1 5 3377 1 1 16 LEU O O -2.955 0.601 -2.060 1.00 . A A . 16 LEU O 1 1 5 3378 1 1 17 GLU C C -4.590 1.013 -4.140 1.00 . A A . 17 GLU C 1 1 5 3379 1 1 17 GLU CA C -3.797 2.348 -3.984 1.00 . A A . 17 GLU CA 1 1 5 3380 1 1 17 GLU CB C -3.715 3.240 -5.255 1.00 . A A . 17 GLU CB 1 1 5 3381 1 1 17 GLU CD C -4.190 1.477 -7.130 1.00 . A A . 17 GLU CD 1 1 5 3382 1 1 17 GLU CG C -3.182 2.447 -6.513 1.00 . A A . 17 GLU CG 1 1 5 3383 1 1 17 GLU H H -1.678 2.260 -4.305 1.00 . A A . 17 GLU H 1 1 5 3384 1 1 17 GLU HA H -4.186 2.880 -3.134 1.00 . A A . 17 GLU HA 1 1 5 3385 1 1 17 GLU HB2 H -4.691 3.639 -5.495 1.00 . A A . 17 GLU HB2 1 1 5 3386 1 1 17 GLU HB3 H -3.059 4.081 -5.076 1.00 . A A . 17 GLU HB3 1 1 5 3387 1 1 17 GLU HG2 H -2.890 3.122 -7.292 1.00 . A A . 17 GLU HG2 1 1 5 3388 1 1 17 GLU HG3 H -2.315 1.865 -6.245 1.00 . A A . 17 GLU HG3 1 1 5 3389 1 1 17 GLU N N -2.390 1.910 -3.735 1.00 . A A . 17 GLU N 1 1 5 3390 1 1 17 GLU O O -5.615 0.798 -3.524 1.00 . A A . 17 GLU O 1 1 5 3391 1 1 17 GLU OE1 O -5.375 1.724 -6.999 1.00 . A A . 17 GLU OE1 1 1 5 3392 1 1 17 GLU OE2 O -3.674 0.529 -7.686 1.00 . A A . 17 GLU OE2 1 1 5 3393 1 1 18 ASN C C -5.159 -1.934 -4.190 1.00 . A A . 18 ASN C 1 1 5 3394 1 1 18 ASN CA C -4.471 -1.199 -5.341 1.00 . A A . 18 ASN CA 1 1 5 3395 1 1 18 ASN CB C -3.205 -1.962 -5.873 1.00 . A A . 18 ASN CB 1 1 5 3396 1 1 18 ASN CG C -3.510 -3.443 -5.957 1.00 . A A . 18 ASN CG 1 1 5 3397 1 1 18 ASN H H -3.171 0.485 -5.352 1.00 . A A . 18 ASN H 1 1 5 3398 1 1 18 ASN HA H -5.253 -1.065 -6.071 1.00 . A A . 18 ASN HA 1 1 5 3399 1 1 18 ASN HB2 H -2.953 -1.605 -6.862 1.00 . A A . 18 ASN HB2 1 1 5 3400 1 1 18 ASN HB3 H -2.344 -1.817 -5.240 1.00 . A A . 18 ASN HB3 1 1 5 3401 1 1 18 ASN HD21 H -3.882 -3.352 -7.865 1.00 . A A . 18 ASN HD21 1 1 5 3402 1 1 18 ASN HD22 H -4.070 -4.891 -7.164 1.00 . A A . 18 ASN HD22 1 1 5 3403 1 1 18 ASN N N -4.007 0.177 -4.955 1.00 . A A . 18 ASN N 1 1 5 3404 1 1 18 ASN ND2 N -3.849 -3.941 -7.088 1.00 . A A . 18 ASN ND2 1 1 5 3405 1 1 18 ASN O O -6.117 -2.667 -4.365 1.00 . A A . 18 ASN O 1 1 5 3406 1 1 18 ASN OD1 O -3.460 -4.179 -4.992 1.00 . A A . 18 ASN OD1 1 1 5 3407 1 1 19 TYR C C -5.828 -1.346 -0.869 1.00 . A A . 19 TYR C 1 1 5 3408 1 1 19 TYR CA C -5.208 -2.371 -1.828 1.00 . A A . 19 TYR CA 1 1 5 3409 1 1 19 TYR CB C -4.048 -3.206 -1.264 1.00 . A A . 19 TYR CB 1 1 5 3410 1 1 19 TYR CD1 C -2.821 -1.668 0.313 1.00 . A A . 19 TYR CD1 1 1 5 3411 1 1 19 TYR CD2 C -1.639 -2.727 -1.443 1.00 . A A . 19 TYR CD2 1 1 5 3412 1 1 19 TYR CE1 C -1.637 -1.109 0.743 1.00 . A A . 19 TYR CE1 1 1 5 3413 1 1 19 TYR CE2 C -0.474 -2.165 -1.002 1.00 . A A . 19 TYR CE2 1 1 5 3414 1 1 19 TYR CG C -2.815 -2.488 -0.784 1.00 . A A . 19 TYR CG 1 1 5 3415 1 1 19 TYR CZ C -0.474 -1.357 0.102 1.00 . A A . 19 TYR CZ 1 1 5 3416 1 1 19 TYR H H -3.859 -1.118 -2.945 1.00 . A A . 19 TYR H 1 1 5 3417 1 1 19 TYR HA H -6.020 -2.996 -2.144 1.00 . A A . 19 TYR HA 1 1 5 3418 1 1 19 TYR HB2 H -4.382 -3.803 -0.435 1.00 . A A . 19 TYR HB2 1 1 5 3419 1 1 19 TYR HB3 H -3.707 -3.865 -2.046 1.00 . A A . 19 TYR HB3 1 1 5 3420 1 1 19 TYR HD1 H -3.744 -1.466 0.833 1.00 . A A . 19 TYR HD1 1 1 5 3421 1 1 19 TYR HD2 H -1.622 -3.356 -2.322 1.00 . A A . 19 TYR HD2 1 1 5 3422 1 1 19 TYR HE1 H -1.578 -0.447 1.584 1.00 . A A . 19 TYR HE1 1 1 5 3423 1 1 19 TYR HE2 H 0.437 -2.358 -1.541 1.00 . A A . 19 TYR HE2 1 1 5 3424 1 1 19 TYR HH H 1.345 -1.503 0.540 1.00 . A A . 19 TYR HH 1 1 5 3425 1 1 19 TYR N N -4.632 -1.719 -3.022 1.00 . A A . 19 TYR N 1 1 5 3426 1 1 19 TYR O O -6.806 -1.604 -0.206 1.00 . A A . 19 TYR O 1 1 5 3427 1 1 19 TYR OH O 0.672 -0.822 0.625 1.00 . A A . 19 TYR OH 1 1 5 3428 1 1 20 CYS C C -7.251 1.206 -0.263 1.00 . A A . 20 CYS C 1 1 5 3429 1 1 20 CYS CA C -5.763 0.899 0.073 1.00 . A A . 20 CYS CA 1 1 5 3430 1 1 20 CYS CB C -4.804 2.044 -0.177 1.00 . A A . 20 CYS CB 1 1 5 3431 1 1 20 CYS H H -4.452 -0.039 -1.337 1.00 . A A . 20 CYS H 1 1 5 3432 1 1 20 CYS HA H -5.729 0.651 1.094 1.00 . A A . 20 CYS HA 1 1 5 3433 1 1 20 CYS HB2 H -3.811 1.705 0.093 1.00 . A A . 20 CYS HB2 1 1 5 3434 1 1 20 CYS HB3 H -4.775 2.253 -1.234 1.00 . A A . 20 CYS HB3 1 1 5 3435 1 1 20 CYS HG H -4.365 3.769 1.307 1.00 . A A . 20 CYS HG 1 1 5 3436 1 1 20 CYS N N -5.251 -0.194 -0.802 1.00 . A A . 20 CYS N 1 1 5 3437 1 1 20 CYS O O -8.094 1.431 0.578 1.00 . A A . 20 CYS O 1 1 5 3438 1 1 20 CYS SG S -5.106 3.573 0.733 1.00 . A A . 20 CYS SG 1 1 5 3439 1 1 21 ASN C C -9.939 0.413 -1.788 1.00 . A A . 21 ASN C 1 1 5 3440 1 1 21 ASN CA C -8.837 1.438 -2.164 1.00 . A A . 21 ASN CA 1 1 5 3441 1 1 21 ASN CB C -8.624 1.479 -3.718 1.00 . A A . 21 ASN CB 1 1 5 3442 1 1 21 ASN CG C -7.980 2.789 -4.145 1.00 . A A . 21 ASN CG 1 1 5 3443 1 1 21 ASN H H -6.716 0.962 -2.065 1.00 . A A . 21 ASN H 1 1 5 3444 1 1 21 ASN HA H -9.183 2.405 -1.844 1.00 . A A . 21 ASN HA 1 1 5 3445 1 1 21 ASN HB2 H -7.969 0.683 -4.035 1.00 . A A . 21 ASN HB2 1 1 5 3446 1 1 21 ASN HB3 H -9.556 1.393 -4.253 1.00 . A A . 21 ASN HB3 1 1 5 3447 1 1 21 ASN HD21 H -6.637 2.024 -5.422 1.00 . A A . 21 ASN HD21 1 1 5 3448 1 1 21 ASN HD22 H -6.652 3.690 -5.238 1.00 . A A . 21 ASN HD22 1 1 5 3449 1 1 21 ASN N N -7.496 1.179 -1.532 1.00 . A A . 21 ASN N 1 1 5 3450 1 1 21 ASN ND2 N -7.022 2.824 -4.996 1.00 . A A . 21 ASN ND2 1 1 5 3451 1 1 21 ASN O O -10.520 0.479 -0.716 1.00 . A A . 21 ASN O 1 1 5 3452 1 1 21 ASN OD1 O -8.350 3.856 -3.706 1.00 . A A . 21 ASN OD1 1 1 5 3453 2 2 1 PHE C C 9.958 4.840 -6.761 1.00 . B B . 1 PHE C 1 1 5 3454 2 2 1 PHE CA C 9.265 5.269 -8.083 1.00 . B B . 1 PHE CA 1 1 5 3455 2 2 1 PHE CB C 7.947 6.069 -7.804 1.00 . B B . 1 PHE CB 1 1 5 3456 2 2 1 PHE CD1 C 7.127 6.107 -10.219 1.00 . B B . 1 PHE CD1 1 1 5 3457 2 2 1 PHE CD2 C 7.353 8.170 -9.072 1.00 . B B . 1 PHE CD2 1 1 5 3458 2 2 1 PHE CE1 C 6.693 6.776 -11.344 1.00 . B B . 1 PHE CE1 1 1 5 3459 2 2 1 PHE CE2 C 6.919 8.844 -10.196 1.00 . B B . 1 PHE CE2 1 1 5 3460 2 2 1 PHE CG C 7.461 6.795 -9.071 1.00 . B B . 1 PHE CG 1 1 5 3461 2 2 1 PHE CZ C 6.589 8.147 -11.335 1.00 . B B . 1 PHE CZ 1 1 5 3462 2 2 1 PHE HA H 9.952 5.900 -8.630 1.00 . B B . 1 PHE HA 1 1 5 3463 2 2 1 PHE HB2 H 7.163 5.410 -7.480 1.00 . B B . 1 PHE HB2 1 1 5 3464 2 2 1 PHE HB3 H 8.105 6.799 -7.022 1.00 . B B . 1 PHE HB3 1 1 5 3465 2 2 1 PHE HD1 H 7.205 5.031 -10.245 1.00 . B B . 1 PHE HD1 1 1 5 3466 2 2 1 PHE HD2 H 7.608 8.725 -8.182 1.00 . B B . 1 PHE HD2 1 1 5 3467 2 2 1 PHE HE1 H 6.434 6.219 -12.235 1.00 . B B . 1 PHE HE1 1 1 5 3468 2 2 1 PHE HE2 H 6.839 9.923 -10.182 1.00 . B B . 1 PHE HE2 1 1 5 3469 2 2 1 PHE HZ H 6.249 8.672 -12.217 1.00 . B B . 1 PHE HZ 1 1 5 3470 2 2 1 PHE N N 8.913 4.091 -8.942 1.00 . B B . 1 PHE N 1 1 5 3471 2 2 1 PHE O O 9.343 4.708 -5.721 1.00 . B B . 1 PHE O 1 1 5 3472 2 2 2 VAL C C 11.962 5.072 -4.365 1.00 . B B . 2 VAL C 1 1 5 3473 2 2 2 VAL CA C 12.055 4.185 -5.645 1.00 . B B . 2 VAL CA 1 1 5 3474 2 2 2 VAL CB C 13.532 4.079 -6.094 1.00 . B B . 2 VAL CB 1 1 5 3475 2 2 2 VAL CG1 C 13.692 2.939 -7.113 1.00 . B B . 2 VAL CG1 1 1 5 3476 2 2 2 VAL CG2 C 14.019 5.376 -6.778 1.00 . B B . 2 VAL CG2 1 1 5 3477 2 2 2 VAL H H 11.685 4.693 -7.691 1.00 . B B . 2 VAL H 1 1 5 3478 2 2 2 VAL HA H 11.728 3.198 -5.374 1.00 . B B . 2 VAL HA 1 1 5 3479 2 2 2 VAL HB H 14.102 3.878 -5.192 1.00 . B B . 2 VAL HB 1 1 5 3480 2 2 2 VAL HG11 H 13.396 1.995 -6.675 1.00 . B B . 2 VAL HG11 1 1 5 3481 2 2 2 VAL HG12 H 13.090 3.109 -7.994 1.00 . B B . 2 VAL HG12 1 1 5 3482 2 2 2 VAL HG13 H 14.726 2.859 -7.419 1.00 . B B . 2 VAL HG13 1 1 5 3483 2 2 2 VAL HG21 H 13.444 5.607 -7.660 1.00 . B B . 2 VAL HG21 1 1 5 3484 2 2 2 VAL HG22 H 13.955 6.211 -6.095 1.00 . B B . 2 VAL HG22 1 1 5 3485 2 2 2 VAL HG23 H 15.054 5.265 -7.069 1.00 . B B . 2 VAL HG23 1 1 5 3486 2 2 2 VAL N N 11.236 4.604 -6.835 1.00 . B B . 2 VAL N 1 1 5 3487 2 2 2 VAL O O 12.832 5.844 -4.017 1.00 . B B . 2 VAL O 1 1 5 3488 2 2 3 ASN C C 10.601 4.744 -1.221 1.00 . B B . 3 ASN C 1 1 5 3489 2 2 3 ASN CA C 10.592 5.697 -2.413 1.00 . B B . 3 ASN CA 1 1 5 3490 2 2 3 ASN CB C 9.217 6.387 -2.591 1.00 . B B . 3 ASN CB 1 1 5 3491 2 2 3 ASN CG C 9.222 7.268 -3.828 1.00 . B B . 3 ASN CG 1 1 5 3492 2 2 3 ASN H H 10.239 4.293 -4.053 1.00 . B B . 3 ASN H 1 1 5 3493 2 2 3 ASN HA H 11.374 6.398 -2.221 1.00 . B B . 3 ASN HA 1 1 5 3494 2 2 3 ASN HB2 H 8.416 5.671 -2.686 1.00 . B B . 3 ASN HB2 1 1 5 3495 2 2 3 ASN HB3 H 8.999 7.009 -1.735 1.00 . B B . 3 ASN HB3 1 1 5 3496 2 2 3 ASN HD21 H 11.180 7.297 -4.084 1.00 . B B . 3 ASN HD21 1 1 5 3497 2 2 3 ASN HD22 H 10.234 8.179 -5.197 1.00 . B B . 3 ASN HD22 1 1 5 3498 2 2 3 ASN N N 10.873 4.932 -3.684 1.00 . B B . 3 ASN N 1 1 5 3499 2 2 3 ASN ND2 N 10.314 7.606 -4.415 1.00 . B B . 3 ASN ND2 1 1 5 3500 2 2 3 ASN O O 11.225 4.971 -0.205 1.00 . B B . 3 ASN O 1 1 5 3501 2 2 3 ASN OD1 O 8.205 7.693 -4.317 1.00 . B B . 3 ASN OD1 1 1 5 3502 2 2 4 GLN C C 8.264 2.785 0.109 1.00 . B B . 4 GLN C 1 1 5 3503 2 2 4 GLN CA C 9.571 2.533 -0.663 1.00 . B B . 4 GLN CA 1 1 5 3504 2 2 4 GLN CB C 10.807 2.245 0.265 1.00 . B B . 4 GLN CB 1 1 5 3505 2 2 4 GLN CD C 12.398 2.624 -1.822 1.00 . B B . 4 GLN CD 1 1 5 3506 2 2 4 GLN CG C 12.077 1.772 -0.592 1.00 . B B . 4 GLN CG 1 1 5 3507 2 2 4 GLN H H 9.450 3.723 -2.354 1.00 . B B . 4 GLN H 1 1 5 3508 2 2 4 GLN HA H 9.400 1.690 -1.318 1.00 . B B . 4 GLN HA 1 1 5 3509 2 2 4 GLN HB2 H 11.034 3.090 0.890 1.00 . B B . 4 GLN HB2 1 1 5 3510 2 2 4 GLN HB3 H 10.532 1.423 0.912 1.00 . B B . 4 GLN HB3 1 1 5 3511 2 2 4 GLN HE21 H 13.712 3.770 -0.915 1.00 . B B . 4 GLN HE21 1 1 5 3512 2 2 4 GLN HE22 H 13.437 4.089 -2.564 1.00 . B B . 4 GLN HE22 1 1 5 3513 2 2 4 GLN HG2 H 12.957 1.767 0.031 1.00 . B B . 4 GLN HG2 1 1 5 3514 2 2 4 GLN HG3 H 11.916 0.767 -0.951 1.00 . B B . 4 GLN HG3 1 1 5 3515 2 2 4 GLN N N 9.865 3.714 -1.490 1.00 . B B . 4 GLN N 1 1 5 3516 2 2 4 GLN NE2 N 13.259 3.574 -1.754 1.00 . B B . 4 GLN NE2 1 1 5 3517 2 2 4 GLN O O 7.657 3.836 0.113 1.00 . B B . 4 GLN O 1 1 5 3518 2 2 4 GLN OE1 O 11.864 2.455 -2.896 1.00 . B B . 4 GLN OE1 1 1 5 3519 2 2 5 HIS C C 6.963 1.222 3.013 1.00 . B B . 5 HIS C 1 1 5 3520 2 2 5 HIS CA C 6.659 1.604 1.554 1.00 . B B . 5 HIS CA 1 1 5 3521 2 2 5 HIS CB C 5.706 0.545 0.821 1.00 . B B . 5 HIS CB 1 1 5 3522 2 2 5 HIS CD2 C 6.306 0.682 -1.761 1.00 . B B . 5 HIS CD2 1 1 5 3523 2 2 5 HIS CE1 C 7.962 -0.557 -1.611 1.00 . B B . 5 HIS CE1 1 1 5 3524 2 2 5 HIS CG C 6.417 0.253 -0.467 1.00 . B B . 5 HIS CG 1 1 5 3525 2 2 5 HIS H H 8.455 0.971 0.599 1.00 . B B . 5 HIS H 1 1 5 3526 2 2 5 HIS HA H 6.103 2.517 1.519 1.00 . B B . 5 HIS HA 1 1 5 3527 2 2 5 HIS HB2 H 5.613 -0.363 1.393 1.00 . B B . 5 HIS HB2 1 1 5 3528 2 2 5 HIS HB3 H 4.731 0.952 0.602 1.00 . B B . 5 HIS HB3 1 1 5 3529 2 2 5 HIS HD1 H 7.751 -0.982 0.368 1.00 . B B . 5 HIS HD1 1 1 5 3530 2 2 5 HIS HD2 H 5.539 1.339 -2.137 1.00 . B B . 5 HIS HD2 1 1 5 3531 2 2 5 HIS HE1 H 8.856 -1.121 -1.835 1.00 . B B . 5 HIS HE1 1 1 5 3532 2 2 5 HIS N N 7.885 1.733 0.722 1.00 . B B . 5 HIS N 1 1 5 3533 2 2 5 HIS ND1 N 7.444 -0.504 -0.442 1.00 . B B . 5 HIS ND1 1 1 5 3534 2 2 5 HIS NE2 N 7.286 0.166 -2.471 1.00 . B B . 5 HIS NE2 1 1 5 3535 2 2 5 HIS O O 8.064 1.287 3.516 1.00 . B B . 5 HIS O 1 1 5 3536 2 2 6 LEU C C 5.509 -1.119 5.259 1.00 . B B . 6 LEU C 1 1 5 3537 2 2 6 LEU CA C 5.866 0.386 5.050 1.00 . B B . 6 LEU CA 1 1 5 3538 2 2 6 LEU CB C 4.838 1.357 5.708 1.00 . B B . 6 LEU CB 1 1 5 3539 2 2 6 LEU CD1 C 6.681 3.173 5.932 1.00 . B B . 6 LEU CD1 1 1 5 3540 2 2 6 LEU CD2 C 4.831 3.527 4.297 1.00 . B B . 6 LEU CD2 1 1 5 3541 2 2 6 LEU CG C 5.203 2.890 5.645 1.00 . B B . 6 LEU CG 1 1 5 3542 2 2 6 LEU H H 5.128 0.797 3.041 1.00 . B B . 6 LEU H 1 1 5 3543 2 2 6 LEU HA H 6.834 0.569 5.498 1.00 . B B . 6 LEU HA 1 1 5 3544 2 2 6 LEU HB2 H 3.926 1.243 5.147 1.00 . B B . 6 LEU HB2 1 1 5 3545 2 2 6 LEU HB3 H 4.608 1.072 6.720 1.00 . B B . 6 LEU HB3 1 1 5 3546 2 2 6 LEU HD11 H 6.971 2.841 6.915 1.00 . B B . 6 LEU HD11 1 1 5 3547 2 2 6 LEU HD12 H 7.321 2.698 5.204 1.00 . B B . 6 LEU HD12 1 1 5 3548 2 2 6 LEU HD13 H 6.863 4.237 5.870 1.00 . B B . 6 LEU HD13 1 1 5 3549 2 2 6 LEU HD21 H 3.774 3.421 4.112 1.00 . B B . 6 LEU HD21 1 1 5 3550 2 2 6 LEU HD22 H 5.067 4.583 4.315 1.00 . B B . 6 LEU HD22 1 1 5 3551 2 2 6 LEU HD23 H 5.371 3.091 3.476 1.00 . B B . 6 LEU HD23 1 1 5 3552 2 2 6 LEU HG H 4.622 3.405 6.399 1.00 . B B . 6 LEU HG 1 1 5 3553 2 2 6 LEU N N 5.906 0.813 3.617 1.00 . B B . 6 LEU N 1 1 5 3554 2 2 6 LEU O O 5.218 -1.805 4.303 1.00 . B B . 6 LEU O 1 1 5 3555 2 2 7 CYS C C 4.017 -3.300 7.773 1.00 . B B . 7 CYS C 1 1 5 3556 2 2 7 CYS CA C 5.209 -3.035 6.792 1.00 . B B . 7 CYS CA 1 1 5 3557 2 2 7 CYS CB C 6.512 -3.658 7.324 1.00 . B B . 7 CYS CB 1 1 5 3558 2 2 7 CYS H H 5.782 -1.005 7.220 1.00 . B B . 7 CYS H 1 1 5 3559 2 2 7 CYS HA H 4.947 -3.550 5.881 1.00 . B B . 7 CYS HA 1 1 5 3560 2 2 7 CYS HB2 H 7.318 -3.368 6.662 1.00 . B B . 7 CYS HB2 1 1 5 3561 2 2 7 CYS HB3 H 6.738 -3.267 8.305 1.00 . B B . 7 CYS HB3 1 1 5 3562 2 2 7 CYS HG H 6.172 -5.728 8.269 1.00 . B B . 7 CYS HG 1 1 5 3563 2 2 7 CYS N N 5.537 -1.591 6.483 1.00 . B B . 7 CYS N 1 1 5 3564 2 2 7 CYS O O 3.170 -4.127 7.507 1.00 . B B . 7 CYS O 1 1 5 3565 2 2 7 CYS SG S 6.532 -5.466 7.419 1.00 . B B . 7 CYS SG 1 1 5 3566 2 2 8 GLY C C 1.975 -1.583 10.102 1.00 . B B . 8 GLY C 1 1 5 3567 2 2 8 GLY CA C 2.826 -2.825 9.885 1.00 . B B . 8 GLY CA 1 1 5 3568 2 2 8 GLY H H 4.677 -1.960 9.054 1.00 . B B . 8 GLY H 1 1 5 3569 2 2 8 GLY HA2 H 2.157 -3.596 9.539 1.00 . B B . 8 GLY HA2 1 1 5 3570 2 2 8 GLY HA3 H 3.236 -3.101 10.844 1.00 . B B . 8 GLY HA3 1 1 5 3571 2 2 8 GLY N N 3.964 -2.612 8.886 1.00 . B B . 8 GLY N 1 1 5 3572 2 2 8 GLY O O 1.278 -1.136 9.218 1.00 . B B . 8 GLY O 1 1 5 3573 2 2 9 ASP C C 1.493 1.222 10.480 1.00 . B B . 9 ASP C 1 1 5 3574 2 2 9 ASP CA C 1.264 0.188 11.638 1.00 . B B . 9 ASP CA 1 1 5 3575 2 2 9 ASP CB C 1.862 0.571 13.030 1.00 . B B . 9 ASP CB 1 1 5 3576 2 2 9 ASP CG C 3.370 0.616 12.927 1.00 . B B . 9 ASP CG 1 1 5 3577 2 2 9 ASP H H 2.603 -1.443 11.968 1.00 . B B . 9 ASP H 1 1 5 3578 2 2 9 ASP HA H 0.201 -0.037 11.666 1.00 . B B . 9 ASP HA 1 1 5 3579 2 2 9 ASP HB2 H 1.522 1.547 13.340 1.00 . B B . 9 ASP HB2 1 1 5 3580 2 2 9 ASP HB3 H 1.609 -0.154 13.786 1.00 . B B . 9 ASP HB3 1 1 5 3581 2 2 9 ASP N N 2.033 -1.046 11.276 1.00 . B B . 9 ASP N 1 1 5 3582 2 2 9 ASP O O 0.626 1.650 9.750 1.00 . B B . 9 ASP O 1 1 5 3583 2 2 9 ASP OD1 O 3.960 -0.442 12.930 1.00 . B B . 9 ASP OD1 1 1 5 3584 2 2 9 ASP OD2 O 3.889 1.699 12.811 1.00 . B B . 9 ASP OD2 1 1 5 3585 2 2 10 HIS C C 2.531 2.183 7.850 1.00 . B B . 10 HIS C 1 1 5 3586 2 2 10 HIS CA C 3.106 2.558 9.260 1.00 . B B . 10 HIS CA 1 1 5 3587 2 2 10 HIS CB C 4.658 2.609 9.371 1.00 . B B . 10 HIS CB 1 1 5 3588 2 2 10 HIS CD2 C 6.128 0.533 8.641 1.00 . B B . 10 HIS CD2 1 1 5 3589 2 2 10 HIS CE1 C 5.994 -0.592 10.365 1.00 . B B . 10 HIS CE1 1 1 5 3590 2 2 10 HIS CG C 5.350 1.246 9.524 1.00 . B B . 10 HIS CG 1 1 5 3591 2 2 10 HIS H H 3.374 1.216 10.931 1.00 . B B . 10 HIS H 1 1 5 3592 2 2 10 HIS HA H 2.683 3.523 9.514 1.00 . B B . 10 HIS HA 1 1 5 3593 2 2 10 HIS HB2 H 5.058 3.127 8.518 1.00 . B B . 10 HIS HB2 1 1 5 3594 2 2 10 HIS HB3 H 4.866 3.176 10.266 1.00 . B B . 10 HIS HB3 1 1 5 3595 2 2 10 HIS HD1 H 4.860 0.695 11.439 1.00 . B B . 10 HIS HD1 1 1 5 3596 2 2 10 HIS HD2 H 6.394 0.873 7.657 1.00 . B B . 10 HIS HD2 1 1 5 3597 2 2 10 HIS HE1 H 6.109 -1.379 11.104 1.00 . B B . 10 HIS HE1 1 1 5 3598 2 2 10 HIS N N 2.716 1.594 10.320 1.00 . B B . 10 HIS N 1 1 5 3599 2 2 10 HIS ND1 N 5.313 0.491 10.571 1.00 . B B . 10 HIS ND1 1 1 5 3600 2 2 10 HIS NE2 N 6.520 -0.607 9.171 1.00 . B B . 10 HIS NE2 1 1 5 3601 2 2 10 HIS O O 2.417 3.005 6.961 1.00 . B B . 10 HIS O 1 1 5 3602 2 2 11 LEU C C 0.082 0.731 6.470 1.00 . B B . 11 LEU C 1 1 5 3603 2 2 11 LEU CA C 1.593 0.448 6.372 1.00 . B B . 11 LEU CA 1 1 5 3604 2 2 11 LEU CB C 1.941 -1.065 6.248 1.00 . B B . 11 LEU CB 1 1 5 3605 2 2 11 LEU CD1 C 1.983 -0.858 3.716 1.00 . B B . 11 LEU CD1 1 1 5 3606 2 2 11 LEU CD2 C 2.133 -3.042 4.792 1.00 . B B . 11 LEU CD2 1 1 5 3607 2 2 11 LEU CG C 1.475 -1.673 4.908 1.00 . B B . 11 LEU CG 1 1 5 3608 2 2 11 LEU H H 2.279 0.328 8.430 1.00 . B B . 11 LEU H 1 1 5 3609 2 2 11 LEU HA H 1.960 1.017 5.536 1.00 . B B . 11 LEU HA 1 1 5 3610 2 2 11 LEU HB2 H 3.008 -1.184 6.341 1.00 . B B . 11 LEU HB2 1 1 5 3611 2 2 11 LEU HB3 H 1.474 -1.628 7.041 1.00 . B B . 11 LEU HB3 1 1 5 3612 2 2 11 LEU HD11 H 3.062 -0.806 3.725 1.00 . B B . 11 LEU HD11 1 1 5 3613 2 2 11 LEU HD12 H 1.673 -1.338 2.801 1.00 . B B . 11 LEU HD12 1 1 5 3614 2 2 11 LEU HD13 H 1.573 0.140 3.717 1.00 . B B . 11 LEU HD13 1 1 5 3615 2 2 11 LEU HD21 H 3.206 -2.952 4.828 1.00 . B B . 11 LEU HD21 1 1 5 3616 2 2 11 LEU HD22 H 1.817 -3.690 5.597 1.00 . B B . 11 LEU HD22 1 1 5 3617 2 2 11 LEU HD23 H 1.886 -3.516 3.856 1.00 . B B . 11 LEU HD23 1 1 5 3618 2 2 11 LEU HG H 0.395 -1.782 4.882 1.00 . B B . 11 LEU HG 1 1 5 3619 2 2 11 LEU N N 2.170 0.938 7.673 1.00 . B B . 11 LEU N 1 1 5 3620 2 2 11 LEU O O -0.490 1.300 5.559 1.00 . B B . 11 LEU O 1 1 5 3621 2 2 12 VAL C C -2.217 2.175 7.422 1.00 . B B . 12 VAL C 1 1 5 3622 2 2 12 VAL CA C -2.039 0.658 7.623 1.00 . B B . 12 VAL CA 1 1 5 3623 2 2 12 VAL CB C -2.686 0.281 9.012 1.00 . B B . 12 VAL CB 1 1 5 3624 2 2 12 VAL CG1 C -1.822 0.708 10.154 1.00 . B B . 12 VAL CG1 1 1 5 3625 2 2 12 VAL CG2 C -3.983 1.112 9.180 1.00 . B B . 12 VAL CG2 1 1 5 3626 2 2 12 VAL H H -0.050 -0.117 8.244 1.00 . B B . 12 VAL H 1 1 5 3627 2 2 12 VAL HA H -2.546 0.162 6.819 1.00 . B B . 12 VAL HA 1 1 5 3628 2 2 12 VAL HB H -2.870 -0.780 9.092 1.00 . B B . 12 VAL HB 1 1 5 3629 2 2 12 VAL HG11 H -1.636 1.777 10.152 1.00 . B B . 12 VAL HG11 1 1 5 3630 2 2 12 VAL HG12 H -2.249 0.462 11.108 1.00 . B B . 12 VAL HG12 1 1 5 3631 2 2 12 VAL HG13 H -0.893 0.182 10.039 1.00 . B B . 12 VAL HG13 1 1 5 3632 2 2 12 VAL HG21 H -4.642 0.966 8.338 1.00 . B B . 12 VAL HG21 1 1 5 3633 2 2 12 VAL HG22 H -4.486 0.861 10.095 1.00 . B B . 12 VAL HG22 1 1 5 3634 2 2 12 VAL HG23 H -3.743 2.173 9.230 1.00 . B B . 12 VAL HG23 1 1 5 3635 2 2 12 VAL N N -0.559 0.349 7.545 1.00 . B B . 12 VAL N 1 1 5 3636 2 2 12 VAL O O -3.042 2.598 6.639 1.00 . B B . 12 VAL O 1 1 5 3637 2 2 13 GLU C C -1.550 4.816 6.549 1.00 . B B . 13 GLU C 1 1 5 3638 2 2 13 GLU CA C -1.508 4.426 8.035 1.00 . B B . 13 GLU CA 1 1 5 3639 2 2 13 GLU CB C -0.261 5.005 8.746 1.00 . B B . 13 GLU CB 1 1 5 3640 2 2 13 GLU CD C -1.564 5.166 10.944 1.00 . B B . 13 GLU CD 1 1 5 3641 2 2 13 GLU CG C -0.298 4.658 10.282 1.00 . B B . 13 GLU CG 1 1 5 3642 2 2 13 GLU H H -0.800 2.522 8.755 1.00 . B B . 13 GLU H 1 1 5 3643 2 2 13 GLU HA H -2.419 4.771 8.497 1.00 . B B . 13 GLU HA 1 1 5 3644 2 2 13 GLU HB2 H 0.640 4.609 8.300 1.00 . B B . 13 GLU HB2 1 1 5 3645 2 2 13 GLU HB3 H -0.262 6.082 8.630 1.00 . B B . 13 GLU HB3 1 1 5 3646 2 2 13 GLU HG2 H -0.271 3.600 10.457 1.00 . B B . 13 GLU HG2 1 1 5 3647 2 2 13 GLU HG3 H 0.529 5.107 10.803 1.00 . B B . 13 GLU HG3 1 1 5 3648 2 2 13 GLU N N -1.440 2.936 8.140 1.00 . B B . 13 GLU N 1 1 5 3649 2 2 13 GLU O O -2.344 5.593 6.048 1.00 . B B . 13 GLU O 1 1 5 3650 2 2 13 GLU OE1 O -1.505 6.312 11.342 1.00 . B B . 13 GLU OE1 1 1 5 3651 2 2 13 GLU OE2 O -2.507 4.399 10.999 1.00 . B B . 13 GLU OE2 1 1 5 3652 2 2 14 ALA C C -1.965 4.311 3.691 1.00 . B B . 14 ALA C 1 1 5 3653 2 2 14 ALA CA C -0.588 4.503 4.377 1.00 . B B . 14 ALA CA 1 1 5 3654 2 2 14 ALA CB C 0.515 3.591 3.776 1.00 . B B . 14 ALA CB 1 1 5 3655 2 2 14 ALA H H -0.048 3.573 6.262 1.00 . B B . 14 ALA H 1 1 5 3656 2 2 14 ALA HA H -0.373 5.541 4.368 1.00 . B B . 14 ALA HA 1 1 5 3657 2 2 14 ALA HB1 H 1.455 3.775 4.276 1.00 . B B . 14 ALA HB1 1 1 5 3658 2 2 14 ALA HB2 H 0.261 2.549 3.892 1.00 . B B . 14 ALA HB2 1 1 5 3659 2 2 14 ALA HB3 H 0.632 3.793 2.721 1.00 . B B . 14 ALA HB3 1 1 5 3660 2 2 14 ALA N N -0.650 4.209 5.826 1.00 . B B . 14 ALA N 1 1 5 3661 2 2 14 ALA O O -2.356 5.029 2.787 1.00 . B B . 14 ALA O 1 1 5 3662 2 2 15 LEU C C -5.062 4.183 3.696 1.00 . B B . 15 LEU C 1 1 5 3663 2 2 15 LEU CA C -4.032 3.011 3.610 1.00 . B B . 15 LEU CA 1 1 5 3664 2 2 15 LEU CB C -4.624 1.796 4.354 1.00 . B B . 15 LEU CB 1 1 5 3665 2 2 15 LEU CD1 C -4.278 -0.522 5.184 1.00 . B B . 15 LEU CD1 1 1 5 3666 2 2 15 LEU CD2 C -3.562 0.072 2.962 1.00 . B B . 15 LEU CD2 1 1 5 3667 2 2 15 LEU CG C -3.670 0.607 4.362 1.00 . B B . 15 LEU CG 1 1 5 3668 2 2 15 LEU H H -2.269 2.803 4.890 1.00 . B B . 15 LEU H 1 1 5 3669 2 2 15 LEU HA H -3.882 2.789 2.564 1.00 . B B . 15 LEU HA 1 1 5 3670 2 2 15 LEU HB2 H -4.836 2.113 5.360 1.00 . B B . 15 LEU HB2 1 1 5 3671 2 2 15 LEU HB3 H -5.551 1.520 3.870 1.00 . B B . 15 LEU HB3 1 1 5 3672 2 2 15 LEU HD11 H -4.498 -0.184 6.186 1.00 . B B . 15 LEU HD11 1 1 5 3673 2 2 15 LEU HD12 H -5.183 -0.890 4.733 1.00 . B B . 15 LEU HD12 1 1 5 3674 2 2 15 LEU HD13 H -3.576 -1.341 5.243 1.00 . B B . 15 LEU HD13 1 1 5 3675 2 2 15 LEU HD21 H -4.520 -0.253 2.590 1.00 . B B . 15 LEU HD21 1 1 5 3676 2 2 15 LEU HD22 H -3.145 0.809 2.292 1.00 . B B . 15 LEU HD22 1 1 5 3677 2 2 15 LEU HD23 H -2.899 -0.774 2.994 1.00 . B B . 15 LEU HD23 1 1 5 3678 2 2 15 LEU HG H -2.693 0.886 4.744 1.00 . B B . 15 LEU HG 1 1 5 3679 2 2 15 LEU N N -2.672 3.327 4.161 1.00 . B B . 15 LEU N 1 1 5 3680 2 2 15 LEU O O -6.185 4.033 3.237 1.00 . B B . 15 LEU O 1 1 5 3681 2 2 16 TYR C C -4.938 7.705 3.726 1.00 . B B . 16 TYR C 1 1 5 3682 2 2 16 TYR CA C -5.608 6.475 4.406 1.00 . B B . 16 TYR CA 1 1 5 3683 2 2 16 TYR CB C -5.913 6.736 5.933 1.00 . B B . 16 TYR CB 1 1 5 3684 2 2 16 TYR CD1 C -3.931 8.301 6.525 1.00 . B B . 16 TYR CD1 1 1 5 3685 2 2 16 TYR CD2 C -4.514 6.556 8.015 1.00 . B B . 16 TYR CD2 1 1 5 3686 2 2 16 TYR CE1 C -2.921 8.689 7.391 1.00 . B B . 16 TYR CE1 1 1 5 3687 2 2 16 TYR CE2 C -3.505 6.956 8.870 1.00 . B B . 16 TYR CE2 1 1 5 3688 2 2 16 TYR CG C -4.747 7.220 6.829 1.00 . B B . 16 TYR CG 1 1 5 3689 2 2 16 TYR CZ C -2.705 8.020 8.563 1.00 . B B . 16 TYR CZ 1 1 5 3690 2 2 16 TYR H H -3.798 5.329 4.713 1.00 . B B . 16 TYR H 1 1 5 3691 2 2 16 TYR HA H -6.528 6.291 3.870 1.00 . B B . 16 TYR HA 1 1 5 3692 2 2 16 TYR HB2 H -6.690 7.483 6.003 1.00 . B B . 16 TYR HB2 1 1 5 3693 2 2 16 TYR HB3 H -6.299 5.824 6.359 1.00 . B B . 16 TYR HB3 1 1 5 3694 2 2 16 TYR HD1 H -4.072 8.860 5.615 1.00 . B B . 16 TYR HD1 1 1 5 3695 2 2 16 TYR HD2 H -5.119 5.706 8.291 1.00 . B B . 16 TYR HD2 1 1 5 3696 2 2 16 TYR HE1 H -2.282 9.525 7.164 1.00 . B B . 16 TYR HE1 1 1 5 3697 2 2 16 TYR HE2 H -3.344 6.426 9.796 1.00 . B B . 16 TYR HE2 1 1 5 3698 2 2 16 TYR HH H -1.630 7.740 10.097 1.00 . B B . 16 TYR HH 1 1 5 3699 2 2 16 TYR N N -4.691 5.283 4.300 1.00 . B B . 16 TYR N 1 1 5 3700 2 2 16 TYR O O -5.451 8.803 3.733 1.00 . B B . 16 TYR O 1 1 5 3701 2 2 16 TYR OH O -1.696 8.426 9.405 1.00 . B B . 16 TYR OH 1 1 5 3702 2 2 17 LEU C C -2.866 8.255 0.895 1.00 . B B . 17 LEU C 1 1 5 3703 2 2 17 LEU CA C -2.957 8.474 2.434 1.00 . B B . 17 LEU CA 1 1 5 3704 2 2 17 LEU CB C -1.566 8.414 3.125 1.00 . B B . 17 LEU CB 1 1 5 3705 2 2 17 LEU CD1 C -0.994 10.812 2.647 1.00 . B B . 17 LEU CD1 1 1 5 3706 2 2 17 LEU CD2 C 0.792 9.193 3.170 1.00 . B B . 17 LEU CD2 1 1 5 3707 2 2 17 LEU CG C -0.549 9.362 2.461 1.00 . B B . 17 LEU CG 1 1 5 3708 2 2 17 LEU H H -3.471 6.529 3.201 1.00 . B B . 17 LEU H 1 1 5 3709 2 2 17 LEU HA H -3.399 9.450 2.578 1.00 . B B . 17 LEU HA 1 1 5 3710 2 2 17 LEU HB2 H -1.688 8.681 4.165 1.00 . B B . 17 LEU HB2 1 1 5 3711 2 2 17 LEU HB3 H -1.196 7.399 3.090 1.00 . B B . 17 LEU HB3 1 1 5 3712 2 2 17 LEU HD11 H -1.090 11.050 3.696 1.00 . B B . 17 LEU HD11 1 1 5 3713 2 2 17 LEU HD12 H -0.273 11.484 2.202 1.00 . B B . 17 LEU HD12 1 1 5 3714 2 2 17 LEU HD13 H -1.947 10.981 2.165 1.00 . B B . 17 LEU HD13 1 1 5 3715 2 2 17 LEU HD21 H 0.696 9.436 4.218 1.00 . B B . 17 LEU HD21 1 1 5 3716 2 2 17 LEU HD22 H 1.143 8.175 3.084 1.00 . B B . 17 LEU HD22 1 1 5 3717 2 2 17 LEU HD23 H 1.530 9.848 2.732 1.00 . B B . 17 LEU HD23 1 1 5 3718 2 2 17 LEU HG H -0.450 9.135 1.404 1.00 . B B . 17 LEU HG 1 1 5 3719 2 2 17 LEU N N -3.795 7.448 3.151 1.00 . B B . 17 LEU N 1 1 5 3720 2 2 17 LEU O O -2.922 9.188 0.125 1.00 . B B . 17 LEU O 1 1 5 3721 2 2 18 VAL C C -3.941 6.526 -1.775 1.00 . B B . 18 VAL C 1 1 5 3722 2 2 18 VAL CA C -2.610 6.686 -0.982 1.00 . B B . 18 VAL CA 1 1 5 3723 2 2 18 VAL CB C -1.793 5.374 -1.100 1.00 . B B . 18 VAL CB 1 1 5 3724 2 2 18 VAL CG1 C -2.583 4.208 -0.523 1.00 . B B . 18 VAL CG1 1 1 5 3725 2 2 18 VAL CG2 C -1.578 5.084 -2.598 1.00 . B B . 18 VAL CG2 1 1 5 3726 2 2 18 VAL H H -2.644 6.332 1.173 1.00 . B B . 18 VAL H 1 1 5 3727 2 2 18 VAL HA H -2.073 7.484 -1.477 1.00 . B B . 18 VAL HA 1 1 5 3728 2 2 18 VAL HB H -0.878 5.449 -0.528 1.00 . B B . 18 VAL HB 1 1 5 3729 2 2 18 VAL HG11 H -2.837 4.423 0.505 1.00 . B B . 18 VAL HG11 1 1 5 3730 2 2 18 VAL HG12 H -3.488 4.050 -1.090 1.00 . B B . 18 VAL HG12 1 1 5 3731 2 2 18 VAL HG13 H -2.013 3.295 -0.545 1.00 . B B . 18 VAL HG13 1 1 5 3732 2 2 18 VAL HG21 H -1.054 5.911 -3.058 1.00 . B B . 18 VAL HG21 1 1 5 3733 2 2 18 VAL HG22 H -1.022 4.176 -2.749 1.00 . B B . 18 VAL HG22 1 1 5 3734 2 2 18 VAL HG23 H -2.529 4.984 -3.107 1.00 . B B . 18 VAL HG23 1 1 5 3735 2 2 18 VAL N N -2.711 7.024 0.489 1.00 . B B . 18 VAL N 1 1 5 3736 2 2 18 VAL O O -4.081 7.007 -2.882 1.00 . B B . 18 VAL O 1 1 5 3737 2 2 19 CYS C C -7.205 6.798 -1.866 1.00 . B B . 19 CYS C 1 1 5 3738 2 2 19 CYS CA C -6.199 5.629 -1.903 1.00 . B B . 19 CYS CA 1 1 5 3739 2 2 19 CYS CB C -6.782 4.415 -1.269 1.00 . B B . 19 CYS CB 1 1 5 3740 2 2 19 CYS H H -4.734 5.449 -0.319 1.00 . B B . 19 CYS H 1 1 5 3741 2 2 19 CYS HA H -6.004 5.433 -2.950 1.00 . B B . 19 CYS HA 1 1 5 3742 2 2 19 CYS HB2 H -7.790 4.272 -1.605 1.00 . B B . 19 CYS HB2 1 1 5 3743 2 2 19 CYS HB3 H -6.223 3.552 -1.580 1.00 . B B . 19 CYS HB3 1 1 5 3744 2 2 19 CYS HG H -7.496 5.103 0.804 1.00 . B B . 19 CYS HG 1 1 5 3745 2 2 19 CYS N N -4.887 5.838 -1.206 1.00 . B B . 19 CYS N 1 1 5 3746 2 2 19 CYS O O -7.007 7.829 -1.261 1.00 . B B . 19 CYS O 1 1 5 3747 2 2 19 CYS SG S -6.795 4.508 0.538 1.00 . B B . 19 CYS SG 1 1 5 3748 2 2 20 GLY C C -10.605 7.396 -1.671 1.00 . B B . 20 GLY C 1 1 5 3749 2 2 20 GLY CA C -9.398 7.600 -2.600 1.00 . B B . 20 GLY CA 1 1 5 3750 2 2 20 GLY H H -8.388 5.689 -2.968 1.00 . B B . 20 GLY H 1 1 5 3751 2 2 20 GLY HA2 H -8.971 8.570 -2.382 1.00 . B B . 20 GLY HA2 1 1 5 3752 2 2 20 GLY HA3 H -9.766 7.618 -3.612 1.00 . B B . 20 GLY HA3 1 1 5 3753 2 2 20 GLY N N -8.305 6.563 -2.524 1.00 . B B . 20 GLY N 1 1 5 3754 2 2 20 GLY O O -11.586 6.810 -2.067 1.00 . B B . 20 GLY O 1 1 5 3755 2 2 21 GLU C C -12.538 6.728 0.538 1.00 . B B . 21 GLU C 1 1 5 3756 2 2 21 GLU CA C -11.467 7.843 0.663 1.00 . B B . 21 GLU CA 1 1 5 3757 2 2 21 GLU CB C -12.010 9.273 0.685 1.00 . B B . 21 GLU CB 1 1 5 3758 2 2 21 GLU CD C -11.152 11.659 1.128 1.00 . B B . 21 GLU CD 1 1 5 3759 2 2 21 GLU CG C -10.741 10.216 0.875 1.00 . B B . 21 GLU CG 1 1 5 3760 2 2 21 GLU H H -9.610 8.313 -0.275 1.00 . B B . 21 GLU H 1 1 5 3761 2 2 21 GLU HA H -10.951 7.687 1.599 1.00 . B B . 21 GLU HA 1 1 5 3762 2 2 21 GLU HB2 H -12.524 9.513 -0.235 1.00 . B B . 21 GLU HB2 1 1 5 3763 2 2 21 GLU HB3 H -12.700 9.418 1.507 1.00 . B B . 21 GLU HB3 1 1 5 3764 2 2 21 GLU HG2 H -10.127 9.914 1.710 1.00 . B B . 21 GLU HG2 1 1 5 3765 2 2 21 GLU HG3 H -10.115 10.223 -0.005 1.00 . B B . 21 GLU HG3 1 1 5 3766 2 2 21 GLU N N -10.457 7.883 -0.468 1.00 . B B . 21 GLU N 1 1 5 3767 2 2 21 GLU O O -13.745 6.799 0.615 1.00 . B B . 21 GLU O 1 1 5 3768 2 2 21 GLU OE1 O -11.706 11.860 2.192 1.00 . B B . 21 GLU OE1 1 1 5 3769 2 2 21 GLU OE2 O -10.881 12.447 0.243 1.00 . B B . 21 GLU OE2 1 1 5 3770 2 2 22 ARG C C -12.530 3.308 1.321 1.00 . B B . 22 ARG C 1 1 5 3771 2 2 22 ARG CA C -12.150 4.257 0.138 1.00 . B B . 22 ARG CA 1 1 5 3772 2 2 22 ARG CB C -10.923 3.772 -0.614 1.00 . B B . 22 ARG CB 1 1 5 3773 2 2 22 ARG CD C -9.689 4.392 1.699 1.00 . B B . 22 ARG CD 1 1 5 3774 2 2 22 ARG CG C -9.616 4.264 0.132 1.00 . B B . 22 ARG CG 1 1 5 3775 2 2 22 ARG CZ C -9.654 2.648 3.404 1.00 . B B . 22 ARG CZ 1 1 5 3776 2 2 22 ARG H H -10.882 5.869 0.309 1.00 . B B . 22 ARG H 1 1 5 3777 2 2 22 ARG HA H -12.987 4.263 -0.534 1.00 . B B . 22 ARG HA 1 1 5 3778 2 2 22 ARG HB2 H -10.903 2.710 -0.761 1.00 . B B . 22 ARG HB2 1 1 5 3779 2 2 22 ARG HB3 H -10.948 4.232 -1.597 1.00 . B B . 22 ARG HB3 1 1 5 3780 2 2 22 ARG HD2 H -8.877 5.016 2.066 1.00 . B B . 22 ARG HD2 1 1 5 3781 2 2 22 ARG HD3 H -10.616 4.822 2.069 1.00 . B B . 22 ARG HD3 1 1 5 3782 2 2 22 ARG HE H -9.282 2.275 1.591 1.00 . B B . 22 ARG HE 1 1 5 3783 2 2 22 ARG HG2 H -8.869 3.517 -0.072 1.00 . B B . 22 ARG HG2 1 1 5 3784 2 2 22 ARG HG3 H -9.274 5.196 -0.301 1.00 . B B . 22 ARG HG3 1 1 5 3785 2 2 22 ARG HH11 H -11.574 2.535 3.286 1.00 . B B . 22 ARG HH11 1 1 5 3786 2 2 22 ARG HH12 H -10.888 2.023 4.787 1.00 . B B . 22 ARG HH12 1 1 5 3787 2 2 22 ARG HH21 H -7.769 2.909 3.602 1.00 . B B . 22 ARG HH21 1 1 5 3788 2 2 22 ARG HH22 H -8.605 2.241 4.981 1.00 . B B . 22 ARG HH22 1 1 5 3789 2 2 22 ARG N N -11.824 5.677 0.343 1.00 . B B . 22 ARG N 1 1 5 3790 2 2 22 ARG NE N -9.523 3.001 2.204 1.00 . B B . 22 ARG NE 1 1 5 3791 2 2 22 ARG NH1 N -10.781 2.380 3.868 1.00 . B B . 22 ARG NH1 1 1 5 3792 2 2 22 ARG NH2 N -8.599 2.591 4.055 1.00 . B B . 22 ARG NH2 1 1 5 3793 2 2 22 ARG O O -12.849 3.662 2.436 1.00 . B B . 22 ARG O 1 1 5 3794 2 2 23 GLY C C -11.628 0.066 2.627 1.00 . B B . 23 GLY C 1 1 5 3795 2 2 23 GLY CA C -12.734 0.887 1.924 1.00 . B B . 23 GLY CA 1 1 5 3796 2 2 23 GLY H H -12.101 1.920 0.084 1.00 . B B . 23 GLY H 1 1 5 3797 2 2 23 GLY HA2 H -13.395 1.239 2.706 1.00 . B B . 23 GLY HA2 1 1 5 3798 2 2 23 GLY HA3 H -13.303 0.165 1.358 1.00 . B B . 23 GLY HA3 1 1 5 3799 2 2 23 GLY N N -12.419 2.052 0.997 1.00 . B B . 23 GLY N 1 1 5 3800 2 2 23 GLY O O -11.790 -0.111 3.809 1.00 . B B . 23 GLY O 1 1 5 3801 2 2 24 PHE C C -9.296 -2.574 1.679 1.00 . B B . 24 PHE C 1 1 5 3802 2 2 24 PHE CA C -9.419 -1.209 2.470 1.00 . B B . 24 PHE CA 1 1 5 3803 2 2 24 PHE CB C -9.557 -1.590 4.029 1.00 . B B . 24 PHE CB 1 1 5 3804 2 2 24 PHE CD1 C -7.824 -0.081 5.132 1.00 . B B . 24 PHE CD1 1 1 5 3805 2 2 24 PHE CD2 C -10.038 0.044 5.945 1.00 . B B . 24 PHE CD2 1 1 5 3806 2 2 24 PHE CE1 C -7.433 0.861 6.066 1.00 . B B . 24 PHE CE1 1 1 5 3807 2 2 24 PHE CE2 C -9.656 0.986 6.877 1.00 . B B . 24 PHE CE2 1 1 5 3808 2 2 24 PHE CG C -9.133 -0.507 5.058 1.00 . B B . 24 PHE CG 1 1 5 3809 2 2 24 PHE CZ C -8.349 1.398 6.940 1.00 . B B . 24 PHE CZ 1 1 5 3810 2 2 24 PHE H H -10.594 -0.125 0.993 1.00 . B B . 24 PHE H 1 1 5 3811 2 2 24 PHE HA H -8.502 -0.665 2.301 1.00 . B B . 24 PHE HA 1 1 5 3812 2 2 24 PHE HB2 H -10.566 -1.907 4.247 1.00 . B B . 24 PHE HB2 1 1 5 3813 2 2 24 PHE HB3 H -8.934 -2.451 4.226 1.00 . B B . 24 PHE HB3 1 1 5 3814 2 2 24 PHE HD1 H -7.097 -0.497 4.451 1.00 . B B . 24 PHE HD1 1 1 5 3815 2 2 24 PHE HD2 H -11.067 -0.282 5.914 1.00 . B B . 24 PHE HD2 1 1 5 3816 2 2 24 PHE HE1 H -6.402 1.176 6.123 1.00 . B B . 24 PHE HE1 1 1 5 3817 2 2 24 PHE HE2 H -10.388 1.395 7.563 1.00 . B B . 24 PHE HE2 1 1 5 3818 2 2 24 PHE HZ H -8.038 2.133 7.674 1.00 . B B . 24 PHE HZ 1 1 5 3819 2 2 24 PHE N N -10.600 -0.373 1.942 1.00 . B B . 24 PHE N 1 1 5 3820 2 2 24 PHE O O -9.426 -3.661 2.209 1.00 . B B . 24 PHE O 1 1 5 3821 2 2 25 PHE C C -7.577 -4.581 -0.247 1.00 . B B . 25 PHE C 1 1 5 3822 2 2 25 PHE CA C -8.889 -3.746 -0.458 1.00 . B B . 25 PHE CA 1 1 5 3823 2 2 25 PHE CB C -8.998 -3.278 -1.941 1.00 . B B . 25 PHE CB 1 1 5 3824 2 2 25 PHE CD1 C -11.373 -2.433 -1.410 1.00 . B B . 25 PHE CD1 1 1 5 3825 2 2 25 PHE CD2 C -10.432 -2.008 -3.549 1.00 . B B . 25 PHE CD2 1 1 5 3826 2 2 25 PHE CE1 C -12.523 -1.773 -1.786 1.00 . B B . 25 PHE CE1 1 1 5 3827 2 2 25 PHE CE2 C -11.582 -1.348 -3.928 1.00 . B B . 25 PHE CE2 1 1 5 3828 2 2 25 PHE CG C -10.312 -2.558 -2.289 1.00 . B B . 25 PHE CG 1 1 5 3829 2 2 25 PHE CZ C -12.630 -1.229 -3.046 1.00 . B B . 25 PHE CZ 1 1 5 3830 2 2 25 PHE H H -8.897 -1.622 0.009 1.00 . B B . 25 PHE H 1 1 5 3831 2 2 25 PHE HA H -9.712 -4.414 -0.240 1.00 . B B . 25 PHE HA 1 1 5 3832 2 2 25 PHE HB2 H -8.183 -2.607 -2.167 1.00 . B B . 25 PHE HB2 1 1 5 3833 2 2 25 PHE HB3 H -8.917 -4.136 -2.590 1.00 . B B . 25 PHE HB3 1 1 5 3834 2 2 25 PHE HD1 H -11.310 -2.856 -0.418 1.00 . B B . 25 PHE HD1 1 1 5 3835 2 2 25 PHE HD2 H -9.612 -2.099 -4.249 1.00 . B B . 25 PHE HD2 1 1 5 3836 2 2 25 PHE HE1 H -13.346 -1.685 -1.090 1.00 . B B . 25 PHE HE1 1 1 5 3837 2 2 25 PHE HE2 H -11.661 -0.924 -4.920 1.00 . B B . 25 PHE HE2 1 1 5 3838 2 2 25 PHE HZ H -13.535 -0.714 -3.342 1.00 . B B . 25 PHE HZ 1 1 5 3839 2 2 25 PHE N N -9.024 -2.506 0.407 1.00 . B B . 25 PHE N 1 1 5 3840 2 2 25 PHE O O -6.736 -4.697 -1.115 1.00 . B B . 25 PHE O 1 1 5 3841 2 2 26 TYR C C -5.617 -7.038 0.259 1.00 . B B . 26 TYR C 1 1 5 3842 2 2 26 TYR CA C -6.232 -5.987 1.304 1.00 . B B . 26 TYR CA 1 1 5 3843 2 2 26 TYR CB C -6.705 -6.639 2.656 1.00 . B B . 26 TYR CB 1 1 5 3844 2 2 26 TYR CD1 C -4.664 -6.283 4.089 1.00 . B B . 26 TYR CD1 1 1 5 3845 2 2 26 TYR CD2 C -5.260 -8.521 3.556 1.00 . B B . 26 TYR CD2 1 1 5 3846 2 2 26 TYR CE1 C -3.570 -6.746 4.802 1.00 . B B . 26 TYR CE1 1 1 5 3847 2 2 26 TYR CE2 C -4.165 -8.970 4.270 1.00 . B B . 26 TYR CE2 1 1 5 3848 2 2 26 TYR CG C -5.515 -7.169 3.460 1.00 . B B . 26 TYR CG 1 1 5 3849 2 2 26 TYR CZ C -3.323 -8.090 4.889 1.00 . B B . 26 TYR CZ 1 1 5 3850 2 2 26 TYR H H -8.161 -4.983 1.558 1.00 . B B . 26 TYR H 1 1 5 3851 2 2 26 TYR HA H -5.424 -5.304 1.524 1.00 . B B . 26 TYR HA 1 1 5 3852 2 2 26 TYR HB2 H -7.221 -5.907 3.263 1.00 . B B . 26 TYR HB2 1 1 5 3853 2 2 26 TYR HB3 H -7.393 -7.450 2.460 1.00 . B B . 26 TYR HB3 1 1 5 3854 2 2 26 TYR HD1 H -4.857 -5.220 4.025 1.00 . B B . 26 TYR HD1 1 1 5 3855 2 2 26 TYR HD2 H -5.921 -9.232 3.078 1.00 . B B . 26 TYR HD2 1 1 5 3856 2 2 26 TYR HE1 H -2.903 -6.053 5.294 1.00 . B B . 26 TYR HE1 1 1 5 3857 2 2 26 TYR HE2 H -3.944 -10.022 4.360 1.00 . B B . 26 TYR HE2 1 1 5 3858 2 2 26 TYR HH H -1.846 -7.858 6.076 1.00 . B B . 26 TYR HH 1 1 5 3859 2 2 26 TYR N N -7.432 -5.142 0.917 1.00 . B B . 26 TYR N 1 1 5 3860 2 2 26 TYR O O -5.953 -7.075 -0.905 1.00 . B B . 26 TYR O 1 1 5 3861 2 2 26 TYR OH O -2.240 -8.577 5.577 1.00 . B B . 26 TYR OH 1 1 5 3862 2 2 27 THR C C -3.550 -8.934 -1.467 1.00 . B B . 27 THR C 1 1 5 3863 2 2 27 THR CA C -3.949 -8.977 0.037 1.00 . B B . 27 THR CA 1 1 5 3864 2 2 27 THR CB C -4.740 -10.315 0.296 1.00 . B B . 27 THR CB 1 1 5 3865 2 2 27 THR CG2 C -6.221 -10.207 -0.008 1.00 . B B . 27 THR CG2 1 1 5 3866 2 2 27 THR H H -4.541 -7.742 1.688 1.00 . B B . 27 THR H 1 1 5 3867 2 2 27 THR HA H -3.017 -9.074 0.567 1.00 . B B . 27 THR HA 1 1 5 3868 2 2 27 THR HB H -4.551 -10.693 1.296 1.00 . B B . 27 THR HB 1 1 5 3869 2 2 27 THR HG1 H -5.137 -11.690 -1.035 1.00 . B B . 27 THR HG1 1 1 5 3870 2 2 27 THR HG21 H -6.373 -9.920 -1.035 1.00 . B B . 27 THR HG21 1 1 5 3871 2 2 27 THR HG22 H -6.712 -11.152 0.175 1.00 . B B . 27 THR HG22 1 1 5 3872 2 2 27 THR HG23 H -6.676 -9.460 0.624 1.00 . B B . 27 THR HG23 1 1 5 3873 2 2 27 THR N N -4.726 -7.863 0.749 1.00 . B B . 27 THR N 1 1 5 3874 2 2 27 THR O O -4.169 -8.262 -2.268 1.00 . B B . 27 THR O 1 1 5 3875 2 2 27 THR OG1 O -4.347 -11.277 -0.670 1.00 . B B . 27 THR OG1 1 1 5 3876 2 2 28 PRO C C -3.210 -9.915 -4.321 1.00 . B B . 28 PRO C 1 1 5 3877 2 2 28 PRO CA C -2.126 -9.977 -3.238 1.00 . B B . 28 PRO CA 1 1 5 3878 2 2 28 PRO CB C -1.462 -11.348 -3.104 1.00 . B B . 28 PRO CB 1 1 5 3879 2 2 28 PRO CD C -1.500 -10.359 -0.907 1.00 . B B . 28 PRO CD 1 1 5 3880 2 2 28 PRO CG C -0.560 -11.081 -1.888 1.00 . B B . 28 PRO CG 1 1 5 3881 2 2 28 PRO HA H -1.383 -9.273 -3.556 1.00 . B B . 28 PRO HA 1 1 5 3882 2 2 28 PRO HB2 H -2.192 -12.121 -2.907 1.00 . B B . 28 PRO HB2 1 1 5 3883 2 2 28 PRO HB3 H -0.884 -11.591 -3.986 1.00 . B B . 28 PRO HB3 1 1 5 3884 2 2 28 PRO HD2 H -2.005 -11.056 -0.253 1.00 . B B . 28 PRO HD2 1 1 5 3885 2 2 28 PRO HD3 H -0.944 -9.633 -0.328 1.00 . B B . 28 PRO HD3 1 1 5 3886 2 2 28 PRO HG2 H -0.182 -11.998 -1.463 1.00 . B B . 28 PRO HG2 1 1 5 3887 2 2 28 PRO HG3 H 0.274 -10.435 -2.144 1.00 . B B . 28 PRO HG3 1 1 5 3888 2 2 28 PRO N N -2.488 -9.661 -1.800 1.00 . B B . 28 PRO N 1 1 5 3889 2 2 28 PRO O O -2.976 -9.511 -5.438 1.00 . B B . 28 PRO O 1 1 5 3890 2 2 29 LYS C C -5.698 -10.353 -6.229 1.00 . B B . 29 LYS C 1 1 5 3891 2 2 29 LYS CA C -5.658 -10.415 -4.663 1.00 . B B . 29 LYS CA 1 1 5 3892 2 2 29 LYS CB C -6.541 -9.294 -4.012 1.00 . B B . 29 LYS CB 1 1 5 3893 2 2 29 LYS CD C -7.016 -6.845 -3.891 1.00 . B B . 29 LYS CD 1 1 5 3894 2 2 29 LYS CE C -6.302 -5.513 -3.896 1.00 . B B . 29 LYS CE 1 1 5 3895 2 2 29 LYS CG C -6.166 -7.914 -4.592 1.00 . B B . 29 LYS CG 1 1 5 3896 2 2 29 LYS H H -4.309 -10.596 -2.953 1.00 . B B . 29 LYS H 1 1 5 3897 2 2 29 LYS HA H -6.091 -11.362 -4.452 1.00 . B B . 29 LYS HA 1 1 5 3898 2 2 29 LYS HB2 H -7.596 -9.502 -4.091 1.00 . B B . 29 LYS HB2 1 1 5 3899 2 2 29 LYS HB3 H -6.302 -9.253 -2.953 1.00 . B B . 29 LYS HB3 1 1 5 3900 2 2 29 LYS HD2 H -7.963 -6.736 -4.401 1.00 . B B . 29 LYS HD2 1 1 5 3901 2 2 29 LYS HD3 H -7.223 -7.122 -2.867 1.00 . B B . 29 LYS HD3 1 1 5 3902 2 2 29 LYS HE2 H -6.018 -5.232 -4.907 1.00 . B B . 29 LYS HE2 1 1 5 3903 2 2 29 LYS HE3 H -6.938 -4.732 -3.494 1.00 . B B . 29 LYS HE3 1 1 5 3904 2 2 29 LYS HG2 H -5.102 -7.735 -4.486 1.00 . B B . 29 LYS HG2 1 1 5 3905 2 2 29 LYS HG3 H -6.412 -7.877 -5.645 1.00 . B B . 29 LYS HG3 1 1 5 3906 2 2 29 LYS HZ1 H -4.963 -6.701 -2.766 1.00 . B B . 29 LYS HZ1 1 1 5 3907 2 2 29 LYS HZ2 H -4.234 -5.363 -3.543 1.00 . B B . 29 LYS HZ2 1 1 5 3908 2 2 29 LYS HZ3 H -5.276 -5.196 -2.173 1.00 . B B . 29 LYS HZ3 1 1 5 3909 2 2 29 LYS N N -4.358 -10.330 -3.891 1.00 . B B . 29 LYS N 1 1 5 3910 2 2 29 LYS NZ N -5.092 -5.704 -3.056 1.00 . B B . 29 LYS NZ 1 1 5 3911 2 2 29 LYS O O -6.308 -11.180 -6.872 1.00 . B B . 29 LYS O 1 1 5 3912 2 2 30 THR C C -5.151 -7.506 -8.511 1.00 . B B . 30 THR C 1 1 5 3913 2 2 30 THR CA C -4.862 -8.988 -8.209 1.00 . B B . 30 THR CA 1 1 5 3914 2 2 30 THR CB C -5.792 -9.813 -9.155 1.00 . B B . 30 THR CB 1 1 5 3915 2 2 30 THR CG2 C -7.267 -9.422 -9.084 1.00 . B B . 30 THR CG2 1 1 5 3916 2 2 30 THR H H -4.625 -8.842 -6.031 1.00 . B B . 30 THR H 1 1 5 3917 2 2 30 THR HA H -3.839 -9.174 -8.495 1.00 . B B . 30 THR HA 1 1 5 3918 2 2 30 THR HB H -5.603 -10.881 -9.111 1.00 . B B . 30 THR HB 1 1 5 3919 2 2 30 THR HG1 H -6.242 -9.470 -11.014 1.00 . B B . 30 THR HG1 1 1 5 3920 2 2 30 THR HG21 H -7.633 -9.568 -8.079 1.00 . B B . 30 THR HG21 1 1 5 3921 2 2 30 THR HG22 H -7.427 -8.393 -9.367 1.00 . B B . 30 THR HG22 1 1 5 3922 2 2 30 THR HG23 H -7.839 -10.058 -9.740 1.00 . B B . 30 THR HG23 1 1 5 3923 2 2 30 THR N N -5.040 -9.365 -6.741 1.00 . B B . 30 THR N 1 1 5 3924 2 2 30 THR O O -4.902 -6.603 -7.726 1.00 . B B . 30 THR O 1 1 5 3925 2 2 30 THR OG1 O -5.492 -9.291 -10.438 1.00 . B B . 30 THR OG1 1 1 6 3926 1 1 1 GLY C C -0.480 -6.192 -3.552 1.00 . A A . 1 GLY C 1 1 6 3927 1 1 1 GLY CA C -1.373 -6.969 -4.521 1.00 . A A . 1 GLY CA 1 1 6 3928 1 1 1 GLY HA2 H -2.326 -6.471 -4.571 1.00 . A A . 1 GLY HA2 1 1 6 3929 1 1 1 GLY HA3 H -1.523 -7.947 -4.092 1.00 . A A . 1 GLY HA3 1 1 6 3930 1 1 1 GLY N N -0.799 -7.141 -5.908 1.00 . A A . 1 GLY N 1 1 6 3931 1 1 1 GLY O O -0.432 -6.495 -2.379 1.00 . A A . 1 GLY O 1 1 6 3932 1 1 2 ILE C C 2.427 -5.076 -2.885 1.00 . A A . 2 ILE C 1 1 6 3933 1 1 2 ILE CA C 1.138 -4.328 -3.262 1.00 . A A . 2 ILE CA 1 1 6 3934 1 1 2 ILE CB C 0.454 -3.821 -1.925 1.00 . A A . 2 ILE CB 1 1 6 3935 1 1 2 ILE CD1 C -1.595 -2.728 -0.972 1.00 . A A . 2 ILE CD1 1 1 6 3936 1 1 2 ILE CG1 C -0.881 -3.175 -2.245 1.00 . A A . 2 ILE CG1 1 1 6 3937 1 1 2 ILE CG2 C 1.382 -2.760 -1.289 1.00 . A A . 2 ILE CG2 1 1 6 3938 1 1 2 ILE H H 0.086 -5.050 -5.022 1.00 . A A . 2 ILE H 1 1 6 3939 1 1 2 ILE HA H 1.436 -3.485 -3.868 1.00 . A A . 2 ILE HA 1 1 6 3940 1 1 2 ILE HB H 0.301 -4.631 -1.225 1.00 . A A . 2 ILE HB 1 1 6 3941 1 1 2 ILE HD11 H -1.688 -3.538 -0.268 1.00 . A A . 2 ILE HD11 1 1 6 3942 1 1 2 ILE HD12 H -1.028 -1.938 -0.518 1.00 . A A . 2 ILE HD12 1 1 6 3943 1 1 2 ILE HD13 H -2.573 -2.334 -1.186 1.00 . A A . 2 ILE HD13 1 1 6 3944 1 1 2 ILE HG12 H -0.672 -2.301 -2.840 1.00 . A A . 2 ILE HG12 1 1 6 3945 1 1 2 ILE HG13 H -1.497 -3.859 -2.808 1.00 . A A . 2 ILE HG13 1 1 6 3946 1 1 2 ILE HG21 H 1.568 -1.957 -1.986 1.00 . A A . 2 ILE HG21 1 1 6 3947 1 1 2 ILE HG22 H 0.953 -2.333 -0.400 1.00 . A A . 2 ILE HG22 1 1 6 3948 1 1 2 ILE HG23 H 2.321 -3.210 -1.004 1.00 . A A . 2 ILE HG23 1 1 6 3949 1 1 2 ILE N N 0.200 -5.210 -4.065 1.00 . A A . 2 ILE N 1 1 6 3950 1 1 2 ILE O O 3.482 -4.771 -3.391 1.00 . A A . 2 ILE O 1 1 6 3951 1 1 3 VAL C C 4.810 -6.796 -2.066 1.00 . A A . 3 VAL C 1 1 6 3952 1 1 3 VAL CA C 3.378 -6.913 -1.472 1.00 . A A . 3 VAL CA 1 1 6 3953 1 1 3 VAL CB C 2.814 -8.377 -1.573 1.00 . A A . 3 VAL CB 1 1 6 3954 1 1 3 VAL CG1 C 1.579 -8.509 -0.648 1.00 . A A . 3 VAL CG1 1 1 6 3955 1 1 3 VAL CG2 C 2.314 -8.654 -3.007 1.00 . A A . 3 VAL CG2 1 1 6 3956 1 1 3 VAL H H 1.358 -6.176 -1.700 1.00 . A A . 3 VAL H 1 1 6 3957 1 1 3 VAL HA H 3.519 -6.629 -0.445 1.00 . A A . 3 VAL HA 1 1 6 3958 1 1 3 VAL HB H 3.567 -9.109 -1.287 1.00 . A A . 3 VAL HB 1 1 6 3959 1 1 3 VAL HG11 H 1.848 -8.299 0.377 1.00 . A A . 3 VAL HG11 1 1 6 3960 1 1 3 VAL HG12 H 0.791 -7.830 -0.939 1.00 . A A . 3 VAL HG12 1 1 6 3961 1 1 3 VAL HG13 H 1.189 -9.514 -0.702 1.00 . A A . 3 VAL HG13 1 1 6 3962 1 1 3 VAL HG21 H 3.120 -8.542 -3.715 1.00 . A A . 3 VAL HG21 1 1 6 3963 1 1 3 VAL HG22 H 1.941 -9.666 -3.077 1.00 . A A . 3 VAL HG22 1 1 6 3964 1 1 3 VAL HG23 H 1.518 -7.978 -3.283 1.00 . A A . 3 VAL HG23 1 1 6 3965 1 1 3 VAL N N 2.274 -6.030 -2.012 1.00 . A A . 3 VAL N 1 1 6 3966 1 1 3 VAL O O 5.345 -5.709 -2.068 1.00 . A A . 3 VAL O 1 1 6 3967 1 1 4 GLU C C 7.270 -6.320 -3.609 1.00 . A A . 4 GLU C 1 1 6 3968 1 1 4 GLU CA C 6.839 -7.716 -3.108 1.00 . A A . 4 GLU CA 1 1 6 3969 1 1 4 GLU CB C 6.900 -8.800 -4.219 1.00 . A A . 4 GLU CB 1 1 6 3970 1 1 4 GLU CD C 6.741 -10.360 -2.156 1.00 . A A . 4 GLU CD 1 1 6 3971 1 1 4 GLU CG C 7.362 -10.146 -3.534 1.00 . A A . 4 GLU CG 1 1 6 3972 1 1 4 GLU H H 5.029 -8.724 -2.495 1.00 . A A . 4 GLU H 1 1 6 3973 1 1 4 GLU HA H 7.539 -7.979 -2.327 1.00 . A A . 4 GLU HA 1 1 6 3974 1 1 4 GLU HB2 H 5.919 -8.948 -4.652 1.00 . A A . 4 GLU HB2 1 1 6 3975 1 1 4 GLU HB3 H 7.591 -8.530 -5.002 1.00 . A A . 4 GLU HB3 1 1 6 3976 1 1 4 GLU HG2 H 7.053 -10.993 -4.125 1.00 . A A . 4 GLU HG2 1 1 6 3977 1 1 4 GLU HG3 H 8.432 -10.194 -3.419 1.00 . A A . 4 GLU HG3 1 1 6 3978 1 1 4 GLU N N 5.449 -7.832 -2.527 1.00 . A A . 4 GLU N 1 1 6 3979 1 1 4 GLU O O 8.194 -5.736 -3.083 1.00 . A A . 4 GLU O 1 1 6 3980 1 1 4 GLU OE1 O 5.542 -10.561 -2.130 1.00 . A A . 4 GLU OE1 1 1 6 3981 1 1 4 GLU OE2 O 7.525 -10.285 -1.228 1.00 . A A . 4 GLU OE2 1 1 6 3982 1 1 5 GLN C C 6.830 -3.293 -4.109 1.00 . A A . 5 GLN C 1 1 6 3983 1 1 5 GLN CA C 6.933 -4.454 -5.151 1.00 . A A . 5 GLN CA 1 1 6 3984 1 1 5 GLN CB C 5.987 -4.241 -6.394 1.00 . A A . 5 GLN CB 1 1 6 3985 1 1 5 GLN CD C 3.492 -4.104 -7.161 1.00 . A A . 5 GLN CD 1 1 6 3986 1 1 5 GLN CG C 4.458 -4.284 -5.989 1.00 . A A . 5 GLN CG 1 1 6 3987 1 1 5 GLN H H 5.853 -6.344 -4.949 1.00 . A A . 5 GLN H 1 1 6 3988 1 1 5 GLN HA H 7.970 -4.450 -5.476 1.00 . A A . 5 GLN HA 1 1 6 3989 1 1 5 GLN HB2 H 6.233 -3.298 -6.864 1.00 . A A . 5 GLN HB2 1 1 6 3990 1 1 5 GLN HB3 H 6.199 -5.024 -7.109 1.00 . A A . 5 GLN HB3 1 1 6 3991 1 1 5 GLN HE21 H 4.871 -3.825 -8.544 1.00 . A A . 5 GLN HE21 1 1 6 3992 1 1 5 GLN HE22 H 3.242 -3.781 -9.045 1.00 . A A . 5 GLN HE22 1 1 6 3993 1 1 5 GLN HG2 H 4.209 -5.230 -5.537 1.00 . A A . 5 GLN HG2 1 1 6 3994 1 1 5 GLN HG3 H 4.230 -3.505 -5.278 1.00 . A A . 5 GLN HG3 1 1 6 3995 1 1 5 GLN N N 6.592 -5.810 -4.595 1.00 . A A . 5 GLN N 1 1 6 3996 1 1 5 GLN NE2 N 3.919 -3.885 -8.350 1.00 . A A . 5 GLN NE2 1 1 6 3997 1 1 5 GLN O O 7.579 -2.344 -4.188 1.00 . A A . 5 GLN O 1 1 6 3998 1 1 5 GLN OE1 O 2.291 -4.155 -7.039 1.00 . A A . 5 GLN OE1 1 1 6 3999 1 1 6 CYS C C 6.096 -2.700 -0.665 1.00 . A A . 6 CYS C 1 1 6 4000 1 1 6 CYS CA C 5.783 -2.271 -2.137 1.00 . A A . 6 CYS CA 1 1 6 4001 1 1 6 CYS CB C 4.347 -1.787 -2.307 1.00 . A A . 6 CYS CB 1 1 6 4002 1 1 6 CYS H H 5.321 -4.145 -3.121 1.00 . A A . 6 CYS H 1 1 6 4003 1 1 6 CYS HA H 6.487 -1.484 -2.350 1.00 . A A . 6 CYS HA 1 1 6 4004 1 1 6 CYS HB2 H 3.755 -2.679 -2.232 1.00 . A A . 6 CYS HB2 1 1 6 4005 1 1 6 CYS HB3 H 4.100 -1.146 -1.480 1.00 . A A . 6 CYS HB3 1 1 6 4006 1 1 6 CYS HG H 3.510 -0.105 -3.648 1.00 . A A . 6 CYS HG 1 1 6 4007 1 1 6 CYS N N 5.928 -3.366 -3.168 1.00 . A A . 6 CYS N 1 1 6 4008 1 1 6 CYS O O 5.951 -1.937 0.276 1.00 . A A . 6 CYS O 1 1 6 4009 1 1 6 CYS SG S 3.802 -1.000 -3.844 1.00 . A A . 6 CYS SG 1 1 6 4010 1 1 7 CYS C C 8.270 -5.266 0.848 1.00 . A A . 7 CYS C 1 1 6 4011 1 1 7 CYS CA C 6.871 -4.575 0.757 1.00 . A A . 7 CYS CA 1 1 6 4012 1 1 7 CYS CB C 5.720 -5.559 1.031 1.00 . A A . 7 CYS CB 1 1 6 4013 1 1 7 CYS H H 6.571 -4.436 -1.384 1.00 . A A . 7 CYS H 1 1 6 4014 1 1 7 CYS HA H 6.870 -3.820 1.531 1.00 . A A . 7 CYS HA 1 1 6 4015 1 1 7 CYS HB2 H 4.811 -4.968 1.080 1.00 . A A . 7 CYS HB2 1 1 6 4016 1 1 7 CYS HB3 H 5.628 -6.185 0.168 1.00 . A A . 7 CYS HB3 1 1 6 4017 1 1 7 CYS HG H 6.292 -7.422 2.242 1.00 . A A . 7 CYS HG 1 1 6 4018 1 1 7 CYS N N 6.510 -3.928 -0.551 1.00 . A A . 7 CYS N 1 1 6 4019 1 1 7 CYS O O 8.857 -5.315 1.908 1.00 . A A . 7 CYS O 1 1 6 4020 1 1 7 CYS SG S 5.795 -6.638 2.487 1.00 . A A . 7 CYS SG 1 1 6 4021 1 1 8 THR C C 11.188 -5.654 -1.015 1.00 . A A . 8 THR C 1 1 6 4022 1 1 8 THR CA C 10.139 -6.477 -0.239 1.00 . A A . 8 THR CA 1 1 6 4023 1 1 8 THR CB C 9.960 -7.904 -0.868 1.00 . A A . 8 THR CB 1 1 6 4024 1 1 8 THR CG2 C 10.327 -8.054 -2.333 1.00 . A A . 8 THR CG2 1 1 6 4025 1 1 8 THR H H 8.264 -5.694 -1.075 1.00 . A A . 8 THR H 1 1 6 4026 1 1 8 THR HA H 10.507 -6.584 0.771 1.00 . A A . 8 THR HA 1 1 6 4027 1 1 8 THR HB H 9.019 -8.379 -0.602 1.00 . A A . 8 THR HB 1 1 6 4028 1 1 8 THR HG1 H 10.686 -9.507 -0.162 1.00 . A A . 8 THR HG1 1 1 6 4029 1 1 8 THR HG21 H 9.736 -7.418 -2.964 1.00 . A A . 8 THR HG21 1 1 6 4030 1 1 8 THR HG22 H 11.375 -7.835 -2.479 1.00 . A A . 8 THR HG22 1 1 6 4031 1 1 8 THR HG23 H 10.149 -9.082 -2.613 1.00 . A A . 8 THR HG23 1 1 6 4032 1 1 8 THR N N 8.779 -5.778 -0.246 1.00 . A A . 8 THR N 1 1 6 4033 1 1 8 THR O O 12.332 -5.493 -0.644 1.00 . A A . 8 THR O 1 1 6 4034 1 1 8 THR OG1 O 11.059 -8.642 -0.372 1.00 . A A . 8 THR OG1 1 1 6 4035 1 1 9 SER C C 10.776 -2.945 -3.176 1.00 . A A . 9 SER C 1 1 6 4036 1 1 9 SER CA C 11.539 -4.286 -3.062 1.00 . A A . 9 SER CA 1 1 6 4037 1 1 9 SER CB C 11.617 -4.996 -4.419 1.00 . A A . 9 SER CB 1 1 6 4038 1 1 9 SER H H 9.804 -5.323 -2.338 1.00 . A A . 9 SER H 1 1 6 4039 1 1 9 SER HA H 12.519 -4.084 -2.656 1.00 . A A . 9 SER HA 1 1 6 4040 1 1 9 SER HB2 H 12.039 -5.988 -4.306 1.00 . A A . 9 SER HB2 1 1 6 4041 1 1 9 SER HB3 H 10.636 -5.066 -4.876 1.00 . A A . 9 SER HB3 1 1 6 4042 1 1 9 SER HG H 13.237 -4.646 -5.512 1.00 . A A . 9 SER HG 1 1 6 4043 1 1 9 SER N N 10.735 -5.140 -2.118 1.00 . A A . 9 SER N 1 1 6 4044 1 1 9 SER O O 10.079 -2.583 -2.252 1.00 . A A . 9 SER O 1 1 6 4045 1 1 9 SER OG O 12.468 -4.153 -5.197 1.00 . A A . 9 SER OG 1 1 6 4046 1 1 10 ILE C C 9.407 -0.782 -5.718 1.00 . A A . 10 ILE C 1 1 6 4047 1 1 10 ILE CA C 10.187 -0.939 -4.412 1.00 . A A . 10 ILE CA 1 1 6 4048 1 1 10 ILE CB C 11.222 0.245 -4.242 1.00 . A A . 10 ILE CB 1 1 6 4049 1 1 10 ILE CD1 C 12.165 1.722 -2.354 1.00 . A A . 10 ILE CD1 1 1 6 4050 1 1 10 ILE CG1 C 11.233 0.540 -2.725 1.00 . A A . 10 ILE CG1 1 1 6 4051 1 1 10 ILE CG2 C 10.780 1.531 -5.010 1.00 . A A . 10 ILE CG2 1 1 6 4052 1 1 10 ILE H H 11.472 -2.526 -4.975 1.00 . A A . 10 ILE H 1 1 6 4053 1 1 10 ILE HA H 9.481 -0.860 -3.601 1.00 . A A . 10 ILE HA 1 1 6 4054 1 1 10 ILE HB H 12.202 -0.078 -4.572 1.00 . A A . 10 ILE HB 1 1 6 4055 1 1 10 ILE HD11 H 13.176 1.516 -2.672 1.00 . A A . 10 ILE HD11 1 1 6 4056 1 1 10 ILE HD12 H 11.829 2.637 -2.823 1.00 . A A . 10 ILE HD12 1 1 6 4057 1 1 10 ILE HD13 H 12.162 1.868 -1.284 1.00 . A A . 10 ILE HD13 1 1 6 4058 1 1 10 ILE HG12 H 10.223 0.772 -2.426 1.00 . A A . 10 ILE HG12 1 1 6 4059 1 1 10 ILE HG13 H 11.508 -0.370 -2.213 1.00 . A A . 10 ILE HG13 1 1 6 4060 1 1 10 ILE HG21 H 10.677 1.337 -6.069 1.00 . A A . 10 ILE HG21 1 1 6 4061 1 1 10 ILE HG22 H 9.832 1.895 -4.644 1.00 . A A . 10 ILE HG22 1 1 6 4062 1 1 10 ILE HG23 H 11.505 2.320 -4.896 1.00 . A A . 10 ILE HG23 1 1 6 4063 1 1 10 ILE N N 10.905 -2.227 -4.255 1.00 . A A . 10 ILE N 1 1 6 4064 1 1 10 ILE O O 9.681 -1.274 -6.795 1.00 . A A . 10 ILE O 1 1 6 4065 1 1 11 CYS C C 7.157 1.940 -6.278 1.00 . A A . 11 CYS C 1 1 6 4066 1 1 11 CYS CA C 7.369 0.406 -6.410 1.00 . A A . 11 CYS CA 1 1 6 4067 1 1 11 CYS CB C 6.142 -0.395 -6.041 1.00 . A A . 11 CYS CB 1 1 6 4068 1 1 11 CYS H H 8.382 0.239 -4.535 1.00 . A A . 11 CYS H 1 1 6 4069 1 1 11 CYS HA H 7.694 0.195 -7.421 1.00 . A A . 11 CYS HA 1 1 6 4070 1 1 11 CYS HB2 H 5.390 -0.319 -6.804 1.00 . A A . 11 CYS HB2 1 1 6 4071 1 1 11 CYS HB3 H 6.428 -1.431 -5.964 1.00 . A A . 11 CYS HB3 1 1 6 4072 1 1 11 CYS HG H 5.941 -0.404 -3.768 1.00 . A A . 11 CYS HG 1 1 6 4073 1 1 11 CYS N N 8.404 -0.030 -5.461 1.00 . A A . 11 CYS N 1 1 6 4074 1 1 11 CYS O O 7.981 2.715 -5.841 1.00 . A A . 11 CYS O 1 1 6 4075 1 1 11 CYS SG S 5.432 0.050 -4.442 1.00 . A A . 11 CYS SG 1 1 6 4076 1 1 12 SER C C 4.242 4.101 -5.902 1.00 . A A . 12 SER C 1 1 6 4077 1 1 12 SER CA C 5.531 3.755 -6.671 1.00 . A A . 12 SER CA 1 1 6 4078 1 1 12 SER CB C 5.336 4.189 -8.098 1.00 . A A . 12 SER CB 1 1 6 4079 1 1 12 SER H H 5.449 1.595 -7.022 1.00 . A A . 12 SER H 1 1 6 4080 1 1 12 SER HA H 6.312 4.387 -6.338 1.00 . A A . 12 SER HA 1 1 6 4081 1 1 12 SER HB2 H 5.091 5.241 -8.179 1.00 . A A . 12 SER HB2 1 1 6 4082 1 1 12 SER HB3 H 6.205 3.963 -8.706 1.00 . A A . 12 SER HB3 1 1 6 4083 1 1 12 SER HG H 4.430 2.876 -9.261 1.00 . A A . 12 SER HG 1 1 6 4084 1 1 12 SER N N 5.997 2.320 -6.686 1.00 . A A . 12 SER N 1 1 6 4085 1 1 12 SER O O 3.512 3.234 -5.467 1.00 . A A . 12 SER O 1 1 6 4086 1 1 12 SER OG O 4.225 3.373 -8.456 1.00 . A A . 12 SER OG 1 1 6 4087 1 1 13 LEU C C 1.573 5.190 -5.772 1.00 . A A . 13 LEU C 1 1 6 4088 1 1 13 LEU CA C 2.735 5.832 -5.033 1.00 . A A . 13 LEU CA 1 1 6 4089 1 1 13 LEU CB C 2.715 7.376 -5.103 1.00 . A A . 13 LEU CB 1 1 6 4090 1 1 13 LEU CD1 C 1.110 7.652 -3.188 1.00 . A A . 13 LEU CD1 1 1 6 4091 1 1 13 LEU CD2 C 1.389 9.439 -4.872 1.00 . A A . 13 LEU CD2 1 1 6 4092 1 1 13 LEU CG C 1.348 7.935 -4.671 1.00 . A A . 13 LEU CG 1 1 6 4093 1 1 13 LEU H H 4.616 6.031 -6.098 1.00 . A A . 13 LEU H 1 1 6 4094 1 1 13 LEU HA H 2.650 5.403 -4.044 1.00 . A A . 13 LEU HA 1 1 6 4095 1 1 13 LEU HB2 H 3.491 7.768 -4.458 1.00 . A A . 13 LEU HB2 1 1 6 4096 1 1 13 LEU HB3 H 2.931 7.700 -6.111 1.00 . A A . 13 LEU HB3 1 1 6 4097 1 1 13 LEU HD11 H 1.877 8.112 -2.583 1.00 . A A . 13 LEU HD11 1 1 6 4098 1 1 13 LEU HD12 H 0.149 8.050 -2.893 1.00 . A A . 13 LEU HD12 1 1 6 4099 1 1 13 LEU HD13 H 1.106 6.589 -3.000 1.00 . A A . 13 LEU HD13 1 1 6 4100 1 1 13 LEU HD21 H 2.174 9.885 -4.279 1.00 . A A . 13 LEU HD21 1 1 6 4101 1 1 13 LEU HD22 H 1.566 9.672 -5.912 1.00 . A A . 13 LEU HD22 1 1 6 4102 1 1 13 LEU HD23 H 0.444 9.877 -4.582 1.00 . A A . 13 LEU HD23 1 1 6 4103 1 1 13 LEU HG H 0.545 7.513 -5.269 1.00 . A A . 13 LEU HG 1 1 6 4104 1 1 13 LEU N N 3.981 5.373 -5.747 1.00 . A A . 13 LEU N 1 1 6 4105 1 1 13 LEU O O 0.706 4.589 -5.174 1.00 . A A . 13 LEU O 1 1 6 4106 1 1 14 TYR C C 0.544 3.172 -7.507 1.00 . A A . 14 TYR C 1 1 6 4107 1 1 14 TYR CA C 0.461 4.690 -7.820 1.00 . A A . 14 TYR CA 1 1 6 4108 1 1 14 TYR CB C 0.598 5.009 -9.367 1.00 . A A . 14 TYR CB 1 1 6 4109 1 1 14 TYR CD1 C 2.295 6.828 -9.381 1.00 . A A . 14 TYR CD1 1 1 6 4110 1 1 14 TYR CD2 C 2.883 4.768 -10.403 1.00 . A A . 14 TYR CD2 1 1 6 4111 1 1 14 TYR CE1 C 3.538 7.334 -9.678 1.00 . A A . 14 TYR CE1 1 1 6 4112 1 1 14 TYR CE2 C 4.129 5.282 -10.700 1.00 . A A . 14 TYR CE2 1 1 6 4113 1 1 14 TYR CG C 1.969 5.543 -9.740 1.00 . A A . 14 TYR CG 1 1 6 4114 1 1 14 TYR CZ C 4.455 6.561 -10.336 1.00 . A A . 14 TYR CZ 1 1 6 4115 1 1 14 TYR H H 2.302 5.807 -7.503 1.00 . A A . 14 TYR H 1 1 6 4116 1 1 14 TYR HA H -0.463 5.079 -7.427 1.00 . A A . 14 TYR HA 1 1 6 4117 1 1 14 TYR HB2 H 0.368 4.132 -9.954 1.00 . A A . 14 TYR HB2 1 1 6 4118 1 1 14 TYR HB3 H -0.145 5.756 -9.622 1.00 . A A . 14 TYR HB3 1 1 6 4119 1 1 14 TYR HD1 H 1.556 7.430 -8.866 1.00 . A A . 14 TYR HD1 1 1 6 4120 1 1 14 TYR HD2 H 2.617 3.759 -10.688 1.00 . A A . 14 TYR HD2 1 1 6 4121 1 1 14 TYR HE1 H 3.792 8.341 -9.394 1.00 . A A . 14 TYR HE1 1 1 6 4122 1 1 14 TYR HE2 H 4.858 4.681 -11.218 1.00 . A A . 14 TYR HE2 1 1 6 4123 1 1 14 TYR HH H 5.589 7.688 -11.334 1.00 . A A . 14 TYR HH 1 1 6 4124 1 1 14 TYR N N 1.581 5.319 -7.065 1.00 . A A . 14 TYR N 1 1 6 4125 1 1 14 TYR O O -0.450 2.484 -7.419 1.00 . A A . 14 TYR O 1 1 6 4126 1 1 14 TYR OH O 5.699 7.060 -10.613 1.00 . A A . 14 TYR OH 1 1 6 4127 1 1 15 GLN C C 0.854 0.832 -5.689 1.00 . A A . 15 GLN C 1 1 6 4128 1 1 15 GLN CA C 1.624 1.127 -7.007 1.00 . A A . 15 GLN CA 1 1 6 4129 1 1 15 GLN CB C 3.041 0.566 -6.937 1.00 . A A . 15 GLN CB 1 1 6 4130 1 1 15 GLN CD C 3.065 -1.194 -8.755 1.00 . A A . 15 GLN CD 1 1 6 4131 1 1 15 GLN CG C 2.942 -0.968 -7.258 1.00 . A A . 15 GLN CG 1 1 6 4132 1 1 15 GLN H H 2.570 3.075 -7.372 1.00 . A A . 15 GLN H 1 1 6 4133 1 1 15 GLN HA H 0.962 0.733 -7.744 1.00 . A A . 15 GLN HA 1 1 6 4134 1 1 15 GLN HB2 H 3.654 1.078 -7.665 1.00 . A A . 15 GLN HB2 1 1 6 4135 1 1 15 GLN HB3 H 3.449 0.745 -5.951 1.00 . A A . 15 GLN HB3 1 1 6 4136 1 1 15 GLN HE21 H 1.187 -1.761 -9.100 1.00 . A A . 15 GLN HE21 1 1 6 4137 1 1 15 GLN HE22 H 2.249 -1.709 -10.423 1.00 . A A . 15 GLN HE22 1 1 6 4138 1 1 15 GLN HG2 H 3.728 -1.522 -6.778 1.00 . A A . 15 GLN HG2 1 1 6 4139 1 1 15 GLN HG3 H 2.000 -1.389 -6.944 1.00 . A A . 15 GLN HG3 1 1 6 4140 1 1 15 GLN N N 1.705 2.595 -7.312 1.00 . A A . 15 GLN N 1 1 6 4141 1 1 15 GLN NE2 N 2.076 -1.588 -9.473 1.00 . A A . 15 GLN NE2 1 1 6 4142 1 1 15 GLN O O 0.434 -0.273 -5.408 1.00 . A A . 15 GLN O 1 1 6 4143 1 1 15 GLN OE1 O 4.110 -1.007 -9.333 1.00 . A A . 15 GLN OE1 1 1 6 4144 1 1 16 LEU C C -1.471 2.187 -3.885 1.00 . A A . 16 LEU C 1 1 6 4145 1 1 16 LEU CA C -0.020 1.795 -3.628 1.00 . A A . 16 LEU CA 1 1 6 4146 1 1 16 LEU CB C 0.648 2.762 -2.626 1.00 . A A . 16 LEU CB 1 1 6 4147 1 1 16 LEU CD1 C 2.741 3.205 -1.409 1.00 . A A . 16 LEU CD1 1 1 6 4148 1 1 16 LEU CD2 C 2.127 0.879 -1.877 1.00 . A A . 16 LEU CD2 1 1 6 4149 1 1 16 LEU CG C 2.098 2.308 -2.425 1.00 . A A . 16 LEU CG 1 1 6 4150 1 1 16 LEU H H 1.079 2.693 -5.186 1.00 . A A . 16 LEU H 1 1 6 4151 1 1 16 LEU HA H -0.005 0.784 -3.324 1.00 . A A . 16 LEU HA 1 1 6 4152 1 1 16 LEU HB2 H 0.612 3.778 -3.000 1.00 . A A . 16 LEU HB2 1 1 6 4153 1 1 16 LEU HB3 H 0.106 2.758 -1.687 1.00 . A A . 16 LEU HB3 1 1 6 4154 1 1 16 LEU HD11 H 2.200 3.149 -0.476 1.00 . A A . 16 LEU HD11 1 1 6 4155 1 1 16 LEU HD12 H 3.765 2.901 -1.259 1.00 . A A . 16 LEU HD12 1 1 6 4156 1 1 16 LEU HD13 H 2.723 4.221 -1.775 1.00 . A A . 16 LEU HD13 1 1 6 4157 1 1 16 LEU HD21 H 1.561 0.798 -0.961 1.00 . A A . 16 LEU HD21 1 1 6 4158 1 1 16 LEU HD22 H 1.721 0.178 -2.591 1.00 . A A . 16 LEU HD22 1 1 6 4159 1 1 16 LEU HD23 H 3.147 0.597 -1.687 1.00 . A A . 16 LEU HD23 1 1 6 4160 1 1 16 LEU HG H 2.643 2.365 -3.363 1.00 . A A . 16 LEU HG 1 1 6 4161 1 1 16 LEU N N 0.697 1.857 -4.914 1.00 . A A . 16 LEU N 1 1 6 4162 1 1 16 LEU O O -2.384 1.621 -3.312 1.00 . A A . 16 LEU O 1 1 6 4163 1 1 17 GLU C C -3.746 2.320 -5.703 1.00 . A A . 17 GLU C 1 1 6 4164 1 1 17 GLU CA C -3.081 3.567 -5.048 1.00 . A A . 17 GLU CA 1 1 6 4165 1 1 17 GLU CB C -3.046 4.821 -5.977 1.00 . A A . 17 GLU CB 1 1 6 4166 1 1 17 GLU CD C -2.595 5.514 -8.437 1.00 . A A . 17 GLU CD 1 1 6 4167 1 1 17 GLU CG C -2.826 4.398 -7.428 1.00 . A A . 17 GLU CG 1 1 6 4168 1 1 17 GLU H H -0.834 3.517 -5.184 1.00 . A A . 17 GLU H 1 1 6 4169 1 1 17 GLU HA H -3.613 3.786 -4.141 1.00 . A A . 17 GLU HA 1 1 6 4170 1 1 17 GLU HB2 H -3.981 5.365 -5.914 1.00 . A A . 17 GLU HB2 1 1 6 4171 1 1 17 GLU HB3 H -2.256 5.497 -5.676 1.00 . A A . 17 GLU HB3 1 1 6 4172 1 1 17 GLU HG2 H -1.956 3.805 -7.444 1.00 . A A . 17 GLU HG2 1 1 6 4173 1 1 17 GLU HG3 H -3.633 3.786 -7.777 1.00 . A A . 17 GLU HG3 1 1 6 4174 1 1 17 GLU N N -1.653 3.141 -4.756 1.00 . A A . 17 GLU N 1 1 6 4175 1 1 17 GLU O O -4.864 1.960 -5.429 1.00 . A A . 17 GLU O 1 1 6 4176 1 1 17 GLU OE1 O -2.452 6.652 -8.032 1.00 . A A . 17 GLU OE1 1 1 6 4177 1 1 17 GLU OE2 O -2.559 5.104 -9.579 1.00 . A A . 17 GLU OE2 1 1 6 4178 1 1 18 ASN C C -4.235 -0.621 -6.485 1.00 . A A . 18 ASN C 1 1 6 4179 1 1 18 ASN CA C -3.401 0.432 -7.312 1.00 . A A . 18 ASN CA 1 1 6 4180 1 1 18 ASN CB C -2.001 -0.025 -7.820 1.00 . A A . 18 ASN CB 1 1 6 4181 1 1 18 ASN CG C -1.812 -1.400 -8.408 1.00 . A A . 18 ASN CG 1 1 6 4182 1 1 18 ASN H H -2.118 2.036 -6.720 1.00 . A A . 18 ASN H 1 1 6 4183 1 1 18 ASN HA H -4.059 0.736 -8.110 1.00 . A A . 18 ASN HA 1 1 6 4184 1 1 18 ASN HB2 H -1.668 0.677 -8.568 1.00 . A A . 18 ASN HB2 1 1 6 4185 1 1 18 ASN HB3 H -1.309 0.035 -6.998 1.00 . A A . 18 ASN HB3 1 1 6 4186 1 1 18 ASN HD21 H -3.679 -2.051 -8.298 1.00 . A A . 18 ASN HD21 1 1 6 4187 1 1 18 ASN HD22 H -2.496 -3.110 -8.929 1.00 . A A . 18 ASN HD22 1 1 6 4188 1 1 18 ASN N N -3.012 1.676 -6.555 1.00 . A A . 18 ASN N 1 1 6 4189 1 1 18 ASN ND2 N -2.759 -2.250 -8.552 1.00 . A A . 18 ASN ND2 1 1 6 4190 1 1 18 ASN O O -4.948 -1.428 -7.049 1.00 . A A . 18 ASN O 1 1 6 4191 1 1 18 ASN OD1 O -0.709 -1.740 -8.765 1.00 . A A . 18 ASN OD1 1 1 6 4192 1 1 19 TYR C C -5.770 -0.840 -3.182 1.00 . A A . 19 TYR C 1 1 6 4193 1 1 19 TYR CA C -4.865 -1.547 -4.261 1.00 . A A . 19 TYR CA 1 1 6 4194 1 1 19 TYR CB C -3.758 -2.388 -3.633 1.00 . A A . 19 TYR CB 1 1 6 4195 1 1 19 TYR CD1 C -3.266 -4.126 -5.383 1.00 . A A . 19 TYR CD1 1 1 6 4196 1 1 19 TYR CD2 C -1.669 -2.415 -5.031 1.00 . A A . 19 TYR CD2 1 1 6 4197 1 1 19 TYR CE1 C -2.444 -4.676 -6.342 1.00 . A A . 19 TYR CE1 1 1 6 4198 1 1 19 TYR CE2 C -0.851 -2.969 -5.989 1.00 . A A . 19 TYR CE2 1 1 6 4199 1 1 19 TYR CG C -2.879 -2.995 -4.722 1.00 . A A . 19 TYR CG 1 1 6 4200 1 1 19 TYR CZ C -1.238 -4.105 -6.645 1.00 . A A . 19 TYR CZ 1 1 6 4201 1 1 19 TYR H H -3.525 0.095 -4.808 1.00 . A A . 19 TYR H 1 1 6 4202 1 1 19 TYR HA H -5.515 -2.167 -4.854 1.00 . A A . 19 TYR HA 1 1 6 4203 1 1 19 TYR HB2 H -3.126 -1.764 -3.021 1.00 . A A . 19 TYR HB2 1 1 6 4204 1 1 19 TYR HB3 H -4.145 -3.195 -3.026 1.00 . A A . 19 TYR HB3 1 1 6 4205 1 1 19 TYR HD1 H -4.216 -4.575 -5.143 1.00 . A A . 19 TYR HD1 1 1 6 4206 1 1 19 TYR HD2 H -1.362 -1.510 -4.522 1.00 . A A . 19 TYR HD2 1 1 6 4207 1 1 19 TYR HE1 H -2.744 -5.561 -6.877 1.00 . A A . 19 TYR HE1 1 1 6 4208 1 1 19 TYR HE2 H 0.092 -2.498 -6.224 1.00 . A A . 19 TYR HE2 1 1 6 4209 1 1 19 TYR HH H 0.472 -4.398 -7.425 1.00 . A A . 19 TYR HH 1 1 6 4210 1 1 19 TYR N N -4.121 -0.587 -5.182 1.00 . A A . 19 TYR N 1 1 6 4211 1 1 19 TYR O O -6.372 -1.421 -2.287 1.00 . A A . 19 TYR O 1 1 6 4212 1 1 19 TYR OH O -0.434 -4.707 -7.579 1.00 . A A . 19 TYR OH 1 1 6 4213 1 1 20 CYS C C -7.479 2.127 -3.681 1.00 . A A . 20 CYS C 1 1 6 4214 1 1 20 CYS CA C -6.463 1.530 -2.682 1.00 . A A . 20 CYS CA 1 1 6 4215 1 1 20 CYS CB C -5.255 2.354 -2.288 1.00 . A A . 20 CYS CB 1 1 6 4216 1 1 20 CYS H H -5.313 0.785 -4.148 1.00 . A A . 20 CYS H 1 1 6 4217 1 1 20 CYS HA H -6.956 1.242 -1.777 1.00 . A A . 20 CYS HA 1 1 6 4218 1 1 20 CYS HB2 H -4.699 1.783 -1.567 1.00 . A A . 20 CYS HB2 1 1 6 4219 1 1 20 CYS HB3 H -4.618 2.432 -3.149 1.00 . A A . 20 CYS HB3 1 1 6 4220 1 1 20 CYS HG H -4.829 4.586 -2.063 1.00 . A A . 20 CYS HG 1 1 6 4221 1 1 20 CYS N N -5.795 0.435 -3.391 1.00 . A A . 20 CYS N 1 1 6 4222 1 1 20 CYS O O -7.389 1.990 -4.883 1.00 . A A . 20 CYS O 1 1 6 4223 1 1 20 CYS SG S -5.440 4.006 -1.604 1.00 . A A . 20 CYS SG 1 1 6 4224 1 1 21 ASN C C -10.605 4.255 -3.221 1.00 . A A . 21 ASN C 1 1 6 4225 1 1 21 ASN CA C -9.539 3.407 -3.973 1.00 . A A . 21 ASN CA 1 1 6 4226 1 1 21 ASN CB C -10.205 2.217 -4.809 1.00 . A A . 21 ASN CB 1 1 6 4227 1 1 21 ASN CG C -10.139 0.863 -4.103 1.00 . A A . 21 ASN CG 1 1 6 4228 1 1 21 ASN H H -8.402 2.792 -2.180 1.00 . A A . 21 ASN H 1 1 6 4229 1 1 21 ASN HA H -9.069 4.091 -4.668 1.00 . A A . 21 ASN HA 1 1 6 4230 1 1 21 ASN HB2 H -11.244 2.425 -5.009 1.00 . A A . 21 ASN HB2 1 1 6 4231 1 1 21 ASN HB3 H -9.695 2.117 -5.754 1.00 . A A . 21 ASN HB3 1 1 6 4232 1 1 21 ASN HD21 H -8.470 0.380 -5.002 1.00 . A A . 21 ASN HD21 1 1 6 4233 1 1 21 ASN HD22 H -9.095 -0.786 -3.938 1.00 . A A . 21 ASN HD22 1 1 6 4234 1 1 21 ASN N N -8.451 2.767 -3.146 1.00 . A A . 21 ASN N 1 1 6 4235 1 1 21 ASN ND2 N -9.156 0.081 -4.366 1.00 . A A . 21 ASN ND2 1 1 6 4236 1 1 21 ASN O O -11.775 4.205 -3.565 1.00 . A A . 21 ASN O 1 1 6 4237 1 1 21 ASN OD1 O -10.949 0.454 -3.299 1.00 . A A . 21 ASN OD1 1 1 6 4238 2 2 1 PHE C C 8.993 6.589 -4.455 1.00 . B B . 1 PHE C 1 1 6 4239 2 2 1 PHE CA C 7.907 6.183 -5.475 1.00 . B B . 1 PHE CA 1 1 6 4240 2 2 1 PHE CB C 7.901 7.124 -6.736 1.00 . B B . 1 PHE CB 1 1 6 4241 2 2 1 PHE CD1 C 7.149 9.186 -5.456 1.00 . B B . 1 PHE CD1 1 1 6 4242 2 2 1 PHE CD2 C 5.911 8.551 -7.379 1.00 . B B . 1 PHE CD2 1 1 6 4243 2 2 1 PHE CE1 C 6.297 10.252 -5.259 1.00 . B B . 1 PHE CE1 1 1 6 4244 2 2 1 PHE CE2 C 5.056 9.618 -7.186 1.00 . B B . 1 PHE CE2 1 1 6 4245 2 2 1 PHE CG C 6.964 8.326 -6.515 1.00 . B B . 1 PHE CG 1 1 6 4246 2 2 1 PHE CZ C 5.249 10.469 -6.124 1.00 . B B . 1 PHE CZ 1 1 6 4247 2 2 1 PHE HA H 8.171 5.169 -5.717 1.00 . B B . 1 PHE HA 1 1 6 4248 2 2 1 PHE HB2 H 8.894 7.511 -6.920 1.00 . B B . 1 PHE HB2 1 1 6 4249 2 2 1 PHE HB3 H 7.581 6.584 -7.614 1.00 . B B . 1 PHE HB3 1 1 6 4250 2 2 1 PHE HD1 H 7.973 9.021 -4.775 1.00 . B B . 1 PHE HD1 1 1 6 4251 2 2 1 PHE HD2 H 5.767 7.882 -8.213 1.00 . B B . 1 PHE HD2 1 1 6 4252 2 2 1 PHE HE1 H 6.453 10.920 -4.423 1.00 . B B . 1 PHE HE1 1 1 6 4253 2 2 1 PHE HE2 H 4.233 9.794 -7.864 1.00 . B B . 1 PHE HE2 1 1 6 4254 2 2 1 PHE HZ H 4.582 11.307 -5.970 1.00 . B B . 1 PHE HZ 1 1 6 4255 2 2 1 PHE N N 6.492 6.167 -4.956 1.00 . B B . 1 PHE N 1 1 6 4256 2 2 1 PHE O O 10.023 7.154 -4.759 1.00 . B B . 1 PHE O 1 1 6 4257 2 2 2 VAL C C 9.827 5.139 -1.418 1.00 . B B . 2 VAL C 1 1 6 4258 2 2 2 VAL CA C 9.526 6.516 -2.061 1.00 . B B . 2 VAL CA 1 1 6 4259 2 2 2 VAL CB C 8.670 7.517 -1.194 1.00 . B B . 2 VAL CB 1 1 6 4260 2 2 2 VAL CG1 C 7.391 6.845 -0.652 1.00 . B B . 2 VAL CG1 1 1 6 4261 2 2 2 VAL CG2 C 9.425 8.140 0.010 1.00 . B B . 2 VAL CG2 1 1 6 4262 2 2 2 VAL H H 7.858 5.850 -3.042 1.00 . B B . 2 VAL H 1 1 6 4263 2 2 2 VAL HA H 10.383 7.048 -2.380 1.00 . B B . 2 VAL HA 1 1 6 4264 2 2 2 VAL HB H 8.380 8.316 -1.879 1.00 . B B . 2 VAL HB 1 1 6 4265 2 2 2 VAL HG11 H 7.629 5.993 -0.042 1.00 . B B . 2 VAL HG11 1 1 6 4266 2 2 2 VAL HG12 H 6.830 7.547 -0.049 1.00 . B B . 2 VAL HG12 1 1 6 4267 2 2 2 VAL HG13 H 6.756 6.522 -1.465 1.00 . B B . 2 VAL HG13 1 1 6 4268 2 2 2 VAL HG21 H 10.314 8.660 -0.321 1.00 . B B . 2 VAL HG21 1 1 6 4269 2 2 2 VAL HG22 H 8.780 8.865 0.489 1.00 . B B . 2 VAL HG22 1 1 6 4270 2 2 2 VAL HG23 H 9.703 7.437 0.778 1.00 . B B . 2 VAL HG23 1 1 6 4271 2 2 2 VAL N N 8.694 6.268 -3.237 1.00 . B B . 2 VAL N 1 1 6 4272 2 2 2 VAL O O 9.675 4.091 -2.006 1.00 . B B . 2 VAL O 1 1 6 4273 2 2 3 ASN C C 9.394 2.879 0.577 1.00 . B B . 3 ASN C 1 1 6 4274 2 2 3 ASN CA C 10.586 3.907 0.572 1.00 . B B . 3 ASN CA 1 1 6 4275 2 2 3 ASN CB C 10.950 4.404 1.992 1.00 . B B . 3 ASN CB 1 1 6 4276 2 2 3 ASN CG C 9.896 5.373 2.507 1.00 . B B . 3 ASN CG 1 1 6 4277 2 2 3 ASN H H 10.363 6.052 0.154 1.00 . B B . 3 ASN H 1 1 6 4278 2 2 3 ASN HA H 11.436 3.414 0.120 1.00 . B B . 3 ASN HA 1 1 6 4279 2 2 3 ASN HB2 H 10.992 3.583 2.691 1.00 . B B . 3 ASN HB2 1 1 6 4280 2 2 3 ASN HB3 H 11.897 4.918 2.005 1.00 . B B . 3 ASN HB3 1 1 6 4281 2 2 3 ASN HD21 H 8.493 4.909 1.207 1.00 . B B . 3 ASN HD21 1 1 6 4282 2 2 3 ASN HD22 H 8.132 6.138 2.344 1.00 . B B . 3 ASN HD22 1 1 6 4283 2 2 3 ASN N N 10.260 5.159 -0.210 1.00 . B B . 3 ASN N 1 1 6 4284 2 2 3 ASN ND2 N 8.736 5.475 1.959 1.00 . B B . 3 ASN ND2 1 1 6 4285 2 2 3 ASN O O 8.622 2.841 1.514 1.00 . B B . 3 ASN O 1 1 6 4286 2 2 3 ASN OD1 O 10.103 6.091 3.448 1.00 . B B . 3 ASN OD1 1 1 6 4287 2 2 4 GLN C C 8.374 -0.241 0.324 1.00 . B B . 4 GLN C 1 1 6 4288 2 2 4 GLN CA C 8.044 1.102 -0.358 1.00 . B B . 4 GLN CA 1 1 6 4289 2 2 4 GLN CB C 7.539 0.879 -1.792 1.00 . B B . 4 GLN CB 1 1 6 4290 2 2 4 GLN CD C 6.922 3.469 -2.114 1.00 . B B . 4 GLN CD 1 1 6 4291 2 2 4 GLN CG C 7.520 2.185 -2.700 1.00 . B B . 4 GLN CG 1 1 6 4292 2 2 4 GLN H H 9.818 2.099 -1.188 1.00 . B B . 4 GLN H 1 1 6 4293 2 2 4 GLN HA H 7.237 1.497 0.237 1.00 . B B . 4 GLN HA 1 1 6 4294 2 2 4 GLN HB2 H 8.144 0.100 -2.235 1.00 . B B . 4 GLN HB2 1 1 6 4295 2 2 4 GLN HB3 H 6.532 0.496 -1.692 1.00 . B B . 4 GLN HB3 1 1 6 4296 2 2 4 GLN HE21 H 7.016 3.049 -0.192 1.00 . B B . 4 GLN HE21 1 1 6 4297 2 2 4 GLN HE22 H 6.333 4.540 -0.633 1.00 . B B . 4 GLN HE22 1 1 6 4298 2 2 4 GLN HG2 H 8.518 2.426 -3.024 1.00 . B B . 4 GLN HG2 1 1 6 4299 2 2 4 GLN HG3 H 6.948 1.984 -3.591 1.00 . B B . 4 GLN HG3 1 1 6 4300 2 2 4 GLN N N 9.209 2.065 -0.420 1.00 . B B . 4 GLN N 1 1 6 4301 2 2 4 GLN NE2 N 6.748 3.691 -0.864 1.00 . B B . 4 GLN NE2 1 1 6 4302 2 2 4 GLN O O 8.498 -1.298 -0.250 1.00 . B B . 4 GLN O 1 1 6 4303 2 2 4 GLN OE1 O 6.578 4.388 -2.815 1.00 . B B . 4 GLN OE1 1 1 6 4304 2 2 5 HIS C C 7.726 -1.392 3.609 1.00 . B B . 5 HIS C 1 1 6 4305 2 2 5 HIS CA C 8.837 -1.203 2.530 1.00 . B B . 5 HIS CA 1 1 6 4306 2 2 5 HIS CB C 10.199 -0.875 3.180 1.00 . B B . 5 HIS CB 1 1 6 4307 2 2 5 HIS CD2 C 12.110 0.657 2.227 1.00 . B B . 5 HIS CD2 1 1 6 4308 2 2 5 HIS CE1 C 12.347 -0.236 0.382 1.00 . B B . 5 HIS CE1 1 1 6 4309 2 2 5 HIS CG C 11.210 -0.383 2.152 1.00 . B B . 5 HIS CG 1 1 6 4310 2 2 5 HIS H H 8.438 0.849 1.911 1.00 . B B . 5 HIS H 1 1 6 4311 2 2 5 HIS HA H 8.956 -2.121 1.967 1.00 . B B . 5 HIS HA 1 1 6 4312 2 2 5 HIS HB2 H 10.075 -0.112 3.934 1.00 . B B . 5 HIS HB2 1 1 6 4313 2 2 5 HIS HB3 H 10.601 -1.761 3.651 1.00 . B B . 5 HIS HB3 1 1 6 4314 2 2 5 HIS HD1 H 10.902 -1.660 0.616 1.00 . B B . 5 HIS HD1 1 1 6 4315 2 2 5 HIS HD2 H 12.223 1.309 3.078 1.00 . B B . 5 HIS HD2 1 1 6 4316 2 2 5 HIS HE1 H 12.720 -0.461 -0.608 1.00 . B B . 5 HIS HE1 1 1 6 4317 2 2 5 HIS N N 8.519 -0.072 1.599 1.00 . B B . 5 HIS N 1 1 6 4318 2 2 5 HIS ND1 N 11.405 -0.894 0.987 1.00 . B B . 5 HIS ND1 1 1 6 4319 2 2 5 HIS NE2 N 12.813 0.739 1.118 1.00 . B B . 5 HIS NE2 1 1 6 4320 2 2 5 HIS O O 7.994 -1.439 4.795 1.00 . B B . 5 HIS O 1 1 6 4321 2 2 6 LEU C C 4.769 -3.079 3.878 1.00 . B B . 6 LEU C 1 1 6 4322 2 2 6 LEU CA C 5.351 -1.678 4.132 1.00 . B B . 6 LEU CA 1 1 6 4323 2 2 6 LEU CB C 4.317 -0.569 3.843 1.00 . B B . 6 LEU CB 1 1 6 4324 2 2 6 LEU CD1 C 3.939 1.859 3.509 1.00 . B B . 6 LEU CD1 1 1 6 4325 2 2 6 LEU CD2 C 5.182 1.111 5.485 1.00 . B B . 6 LEU CD2 1 1 6 4326 2 2 6 LEU CG C 4.944 0.822 4.002 1.00 . B B . 6 LEU CG 1 1 6 4327 2 2 6 LEU H H 6.339 -1.461 2.206 1.00 . B B . 6 LEU H 1 1 6 4328 2 2 6 LEU HA H 5.690 -1.613 5.156 1.00 . B B . 6 LEU HA 1 1 6 4329 2 2 6 LEU HB2 H 3.924 -0.697 2.844 1.00 . B B . 6 LEU HB2 1 1 6 4330 2 2 6 LEU HB3 H 3.510 -0.666 4.550 1.00 . B B . 6 LEU HB3 1 1 6 4331 2 2 6 LEU HD11 H 3.698 1.685 2.471 1.00 . B B . 6 LEU HD11 1 1 6 4332 2 2 6 LEU HD12 H 3.036 1.800 4.097 1.00 . B B . 6 LEU HD12 1 1 6 4333 2 2 6 LEU HD13 H 4.356 2.850 3.611 1.00 . B B . 6 LEU HD13 1 1 6 4334 2 2 6 LEU HD21 H 4.258 1.064 6.047 1.00 . B B . 6 LEU HD21 1 1 6 4335 2 2 6 LEU HD22 H 5.869 0.395 5.911 1.00 . B B . 6 LEU HD22 1 1 6 4336 2 2 6 LEU HD23 H 5.606 2.095 5.619 1.00 . B B . 6 LEU HD23 1 1 6 4337 2 2 6 LEU HG H 5.876 0.871 3.458 1.00 . B B . 6 LEU HG 1 1 6 4338 2 2 6 LEU N N 6.504 -1.494 3.174 1.00 . B B . 6 LEU N 1 1 6 4339 2 2 6 LEU O O 4.882 -3.562 2.777 1.00 . B B . 6 LEU O 1 1 6 4340 2 2 7 CYS C C 2.167 -5.486 5.017 1.00 . B B . 7 CYS C 1 1 6 4341 2 2 7 CYS CA C 3.603 -5.105 4.549 1.00 . B B . 7 CYS CA 1 1 6 4342 2 2 7 CYS CB C 4.665 -6.071 5.122 1.00 . B B . 7 CYS CB 1 1 6 4343 2 2 7 CYS H H 4.092 -3.260 5.697 1.00 . B B . 7 CYS H 1 1 6 4344 2 2 7 CYS HA H 3.657 -5.310 3.489 1.00 . B B . 7 CYS HA 1 1 6 4345 2 2 7 CYS HB2 H 5.623 -5.566 5.107 1.00 . B B . 7 CYS HB2 1 1 6 4346 2 2 7 CYS HB3 H 4.442 -6.330 6.144 1.00 . B B . 7 CYS HB3 1 1 6 4347 2 2 7 CYS HG H 4.277 -8.259 4.520 1.00 . B B . 7 CYS HG 1 1 6 4348 2 2 7 CYS N N 4.158 -3.717 4.835 1.00 . B B . 7 CYS N 1 1 6 4349 2 2 7 CYS O O 1.324 -5.929 4.261 1.00 . B B . 7 CYS O 1 1 6 4350 2 2 7 CYS SG S 4.895 -7.604 4.186 1.00 . B B . 7 CYS SG 1 1 6 4351 2 2 8 GLY C C -0.296 -4.430 7.229 1.00 . B B . 8 GLY C 1 1 6 4352 2 2 8 GLY CA C 0.519 -5.650 6.839 1.00 . B B . 8 GLY CA 1 1 6 4353 2 2 8 GLY H H 2.602 -4.933 6.840 1.00 . B B . 8 GLY H 1 1 6 4354 2 2 8 GLY HA2 H -0.045 -6.208 6.120 1.00 . B B . 8 GLY HA2 1 1 6 4355 2 2 8 GLY HA3 H 0.635 -6.254 7.723 1.00 . B B . 8 GLY HA3 1 1 6 4356 2 2 8 GLY N N 1.892 -5.304 6.280 1.00 . B B . 8 GLY N 1 1 6 4357 2 2 8 GLY O O -0.635 -3.600 6.412 1.00 . B B . 8 GLY O 1 1 6 4358 2 2 9 ASP C C -0.599 -1.947 8.591 1.00 . B B . 9 ASP C 1 1 6 4359 2 2 9 ASP CA C -1.400 -3.210 9.038 1.00 . B B . 9 ASP CA 1 1 6 4360 2 2 9 ASP CB C -1.441 -3.626 10.517 1.00 . B B . 9 ASP CB 1 1 6 4361 2 2 9 ASP CG C -2.177 -4.950 10.488 1.00 . B B . 9 ASP CG 1 1 6 4362 2 2 9 ASP H H -0.346 -5.063 9.105 1.00 . B B . 9 ASP H 1 1 6 4363 2 2 9 ASP HA H -2.392 -3.188 8.618 1.00 . B B . 9 ASP HA 1 1 6 4364 2 2 9 ASP HB2 H -0.474 -3.779 10.967 1.00 . B B . 9 ASP HB2 1 1 6 4365 2 2 9 ASP HB3 H -2.022 -2.940 11.113 1.00 . B B . 9 ASP HB3 1 1 6 4366 2 2 9 ASP N N -0.612 -4.352 8.479 1.00 . B B . 9 ASP N 1 1 6 4367 2 2 9 ASP O O -1.089 -1.015 7.980 1.00 . B B . 9 ASP O 1 1 6 4368 2 2 9 ASP OD1 O -3.386 -4.885 10.448 1.00 . B B . 9 ASP OD1 1 1 6 4369 2 2 9 ASP OD2 O -1.476 -5.944 10.467 1.00 . B B . 9 ASP OD2 1 1 6 4370 2 2 10 HIS C C 1.957 -1.221 7.055 1.00 . B B . 10 HIS C 1 1 6 4371 2 2 10 HIS CA C 1.608 -0.917 8.548 1.00 . B B . 10 HIS CA 1 1 6 4372 2 2 10 HIS CB C 2.782 -1.045 9.487 1.00 . B B . 10 HIS CB 1 1 6 4373 2 2 10 HIS CD2 C 5.127 -0.053 8.759 1.00 . B B . 10 HIS CD2 1 1 6 4374 2 2 10 HIS CE1 C 4.613 1.950 8.789 1.00 . B B . 10 HIS CE1 1 1 6 4375 2 2 10 HIS CG C 3.802 0.028 9.133 1.00 . B B . 10 HIS CG 1 1 6 4376 2 2 10 HIS H H 0.948 -2.803 9.393 1.00 . B B . 10 HIS H 1 1 6 4377 2 2 10 HIS HA H 1.132 0.054 8.628 1.00 . B B . 10 HIS HA 1 1 6 4378 2 2 10 HIS HB2 H 2.420 -0.871 10.491 1.00 . B B . 10 HIS HB2 1 1 6 4379 2 2 10 HIS HB3 H 3.228 -2.021 9.402 1.00 . B B . 10 HIS HB3 1 1 6 4380 2 2 10 HIS HD1 H 2.670 1.689 9.357 1.00 . B B . 10 HIS HD1 1 1 6 4381 2 2 10 HIS HD2 H 5.683 -0.969 8.650 1.00 . B B . 10 HIS HD2 1 1 6 4382 2 2 10 HIS HE1 H 4.662 3.029 8.711 1.00 . B B . 10 HIS HE1 1 1 6 4383 2 2 10 HIS N N 0.659 -2.010 8.905 1.00 . B B . 10 HIS N 1 1 6 4384 2 2 10 HIS ND1 N 3.552 1.288 9.133 1.00 . B B . 10 HIS ND1 1 1 6 4385 2 2 10 HIS NE2 N 5.620 1.150 8.548 1.00 . B B . 10 HIS NE2 1 1 6 4386 2 2 10 HIS O O 2.939 -1.840 6.679 1.00 . B B . 10 HIS O 1 1 6 4387 2 2 11 LEU C C -0.593 -0.439 4.548 1.00 . B B . 11 LEU C 1 1 6 4388 2 2 11 LEU CA C 0.879 -0.779 4.801 1.00 . B B . 11 LEU CA 1 1 6 4389 2 2 11 LEU CB C 1.201 -2.190 4.243 1.00 . B B . 11 LEU CB 1 1 6 4390 2 2 11 LEU CD1 C 1.636 -3.517 2.203 1.00 . B B . 11 LEU CD1 1 1 6 4391 2 2 11 LEU CD2 C -0.371 -2.198 2.251 1.00 . B B . 11 LEU CD2 1 1 6 4392 2 2 11 LEU CG C 1.085 -2.210 2.705 1.00 . B B . 11 LEU CG 1 1 6 4393 2 2 11 LEU H H 0.304 -0.302 6.821 1.00 . B B . 11 LEU H 1 1 6 4394 2 2 11 LEU HA H 1.484 -0.006 4.349 1.00 . B B . 11 LEU HA 1 1 6 4395 2 2 11 LEU HB2 H 2.204 -2.457 4.524 1.00 . B B . 11 LEU HB2 1 1 6 4396 2 2 11 LEU HB3 H 0.536 -2.933 4.646 1.00 . B B . 11 LEU HB3 1 1 6 4397 2 2 11 LEU HD11 H 1.085 -4.342 2.622 1.00 . B B . 11 LEU HD11 1 1 6 4398 2 2 11 LEU HD12 H 1.571 -3.572 1.131 1.00 . B B . 11 LEU HD12 1 1 6 4399 2 2 11 LEU HD13 H 2.671 -3.603 2.474 1.00 . B B . 11 LEU HD13 1 1 6 4400 2 2 11 LEU HD21 H -0.933 -2.999 2.708 1.00 . B B . 11 LEU HD21 1 1 6 4401 2 2 11 LEU HD22 H -0.872 -1.265 2.433 1.00 . B B . 11 LEU HD22 1 1 6 4402 2 2 11 LEU HD23 H -0.377 -2.343 1.195 1.00 . B B . 11 LEU HD23 1 1 6 4403 2 2 11 LEU HG H 1.623 -1.378 2.266 1.00 . B B . 11 LEU HG 1 1 6 4404 2 2 11 LEU N N 1.012 -0.741 6.300 1.00 . B B . 11 LEU N 1 1 6 4405 2 2 11 LEU O O -0.876 0.567 3.929 1.00 . B B . 11 LEU O 1 1 6 4406 2 2 12 VAL C C -3.123 0.645 5.197 1.00 . B B . 12 VAL C 1 1 6 4407 2 2 12 VAL CA C -2.975 -0.815 4.714 1.00 . B B . 12 VAL CA 1 1 6 4408 2 2 12 VAL CB C -3.965 -1.725 5.473 1.00 . B B . 12 VAL CB 1 1 6 4409 2 2 12 VAL CG1 C -3.548 -1.875 6.915 1.00 . B B . 12 VAL CG1 1 1 6 4410 2 2 12 VAL CG2 C -5.329 -1.030 5.485 1.00 . B B . 12 VAL CG2 1 1 6 4411 2 2 12 VAL H H -1.286 -2.061 5.463 1.00 . B B . 12 VAL H 1 1 6 4412 2 2 12 VAL HA H -3.159 -0.825 3.652 1.00 . B B . 12 VAL HA 1 1 6 4413 2 2 12 VAL HB H -4.003 -2.680 4.970 1.00 . B B . 12 VAL HB 1 1 6 4414 2 2 12 VAL HG11 H -2.560 -2.300 6.901 1.00 . B B . 12 VAL HG11 1 1 6 4415 2 2 12 VAL HG12 H -3.504 -0.931 7.442 1.00 . B B . 12 VAL HG12 1 1 6 4416 2 2 12 VAL HG13 H -4.202 -2.531 7.463 1.00 . B B . 12 VAL HG13 1 1 6 4417 2 2 12 VAL HG21 H -5.639 -0.821 4.471 1.00 . B B . 12 VAL HG21 1 1 6 4418 2 2 12 VAL HG22 H -6.069 -1.641 5.971 1.00 . B B . 12 VAL HG22 1 1 6 4419 2 2 12 VAL HG23 H -5.278 -0.085 6.013 1.00 . B B . 12 VAL HG23 1 1 6 4420 2 2 12 VAL N N -1.537 -1.233 4.987 1.00 . B B . 12 VAL N 1 1 6 4421 2 2 12 VAL O O -3.711 1.488 4.551 1.00 . B B . 12 VAL O 1 1 6 4422 2 2 13 GLU C C -2.234 3.261 5.955 1.00 . B B . 13 GLU C 1 1 6 4423 2 2 13 GLU CA C -2.540 2.194 7.039 1.00 . B B . 13 GLU CA 1 1 6 4424 2 2 13 GLU CB C -1.478 1.926 8.088 1.00 . B B . 13 GLU CB 1 1 6 4425 2 2 13 GLU CD C -0.096 2.790 9.948 1.00 . B B . 13 GLU CD 1 1 6 4426 2 2 13 GLU CG C -1.124 3.157 8.886 1.00 . B B . 13 GLU CG 1 1 6 4427 2 2 13 GLU H H -2.116 0.157 6.839 1.00 . B B . 13 GLU H 1 1 6 4428 2 2 13 GLU HA H -3.498 2.418 7.485 1.00 . B B . 13 GLU HA 1 1 6 4429 2 2 13 GLU HB2 H -1.834 1.174 8.782 1.00 . B B . 13 GLU HB2 1 1 6 4430 2 2 13 GLU HB3 H -0.575 1.546 7.631 1.00 . B B . 13 GLU HB3 1 1 6 4431 2 2 13 GLU HG2 H -0.688 3.906 8.252 1.00 . B B . 13 GLU HG2 1 1 6 4432 2 2 13 GLU HG3 H -1.998 3.541 9.381 1.00 . B B . 13 GLU HG3 1 1 6 4433 2 2 13 GLU N N -2.565 0.876 6.353 1.00 . B B . 13 GLU N 1 1 6 4434 2 2 13 GLU O O -2.820 4.321 5.846 1.00 . B B . 13 GLU O 1 1 6 4435 2 2 13 GLU OE1 O 0.985 2.408 9.539 1.00 . B B . 13 GLU OE1 1 1 6 4436 2 2 13 GLU OE2 O -0.453 2.905 11.099 1.00 . B B . 13 GLU OE2 1 1 6 4437 2 2 14 ALA C C -1.930 3.830 2.957 1.00 . B B . 14 ALA C 1 1 6 4438 2 2 14 ALA CA C -0.823 3.735 4.024 1.00 . B B . 14 ALA CA 1 1 6 4439 2 2 14 ALA CB C 0.496 3.095 3.470 1.00 . B B . 14 ALA CB 1 1 6 4440 2 2 14 ALA H H -0.886 2.003 5.310 1.00 . B B . 14 ALA H 1 1 6 4441 2 2 14 ALA HA H -0.728 4.717 4.430 1.00 . B B . 14 ALA HA 1 1 6 4442 2 2 14 ALA HB1 H 1.219 2.992 4.265 1.00 . B B . 14 ALA HB1 1 1 6 4443 2 2 14 ALA HB2 H 0.322 2.117 3.047 1.00 . B B . 14 ALA HB2 1 1 6 4444 2 2 14 ALA HB3 H 0.917 3.706 2.687 1.00 . B B . 14 ALA HB3 1 1 6 4445 2 2 14 ALA N N -1.282 2.879 5.146 1.00 . B B . 14 ALA N 1 1 6 4446 2 2 14 ALA O O -2.289 4.904 2.522 1.00 . B B . 14 ALA O 1 1 6 4447 2 2 15 LEU C C -4.658 3.735 1.946 1.00 . B B . 15 LEU C 1 1 6 4448 2 2 15 LEU CA C -3.551 2.734 1.503 1.00 . B B . 15 LEU CA 1 1 6 4449 2 2 15 LEU CB C -4.140 1.311 1.370 1.00 . B B . 15 LEU CB 1 1 6 4450 2 2 15 LEU CD1 C -3.773 -1.060 0.975 1.00 . B B . 15 LEU CD1 1 1 6 4451 2 2 15 LEU CD2 C -2.547 0.562 -0.418 1.00 . B B . 15 LEU CD2 1 1 6 4452 2 2 15 LEU CG C -3.065 0.285 0.999 1.00 . B B . 15 LEU CG 1 1 6 4453 2 2 15 LEU H H -2.095 1.891 2.933 1.00 . B B . 15 LEU H 1 1 6 4454 2 2 15 LEU HA H -3.162 3.095 0.562 1.00 . B B . 15 LEU HA 1 1 6 4455 2 2 15 LEU HB2 H -4.600 1.032 2.309 1.00 . B B . 15 LEU HB2 1 1 6 4456 2 2 15 LEU HB3 H -4.910 1.322 0.616 1.00 . B B . 15 LEU HB3 1 1 6 4457 2 2 15 LEU HD11 H -4.255 -1.248 1.923 1.00 . B B . 15 LEU HD11 1 1 6 4458 2 2 15 LEU HD12 H -4.523 -1.084 0.199 1.00 . B B . 15 LEU HD12 1 1 6 4459 2 2 15 LEU HD13 H -3.059 -1.847 0.806 1.00 . B B . 15 LEU HD13 1 1 6 4460 2 2 15 LEU HD21 H -2.162 1.566 -0.502 1.00 . B B . 15 LEU HD21 1 1 6 4461 2 2 15 LEU HD22 H -1.743 -0.106 -0.662 1.00 . B B . 15 LEU HD22 1 1 6 4462 2 2 15 LEU HD23 H -3.319 0.430 -1.157 1.00 . B B . 15 LEU HD23 1 1 6 4463 2 2 15 LEU HG H -2.241 0.271 1.699 1.00 . B B . 15 LEU HG 1 1 6 4464 2 2 15 LEU N N -2.451 2.715 2.539 1.00 . B B . 15 LEU N 1 1 6 4465 2 2 15 LEU O O -5.122 4.552 1.182 1.00 . B B . 15 LEU O 1 1 6 4466 2 2 16 TYR C C -5.782 5.979 3.727 1.00 . B B . 16 TYR C 1 1 6 4467 2 2 16 TYR CA C -6.066 4.457 3.873 1.00 . B B . 16 TYR CA 1 1 6 4468 2 2 16 TYR CB C -6.079 4.002 5.359 1.00 . B B . 16 TYR CB 1 1 6 4469 2 2 16 TYR CD1 C -8.414 5.090 5.551 1.00 . B B . 16 TYR CD1 1 1 6 4470 2 2 16 TYR CD2 C -7.496 3.967 7.429 1.00 . B B . 16 TYR CD2 1 1 6 4471 2 2 16 TYR CE1 C -9.546 5.384 6.287 1.00 . B B . 16 TYR CE1 1 1 6 4472 2 2 16 TYR CE2 C -8.633 4.267 8.156 1.00 . B B . 16 TYR CE2 1 1 6 4473 2 2 16 TYR CG C -7.372 4.374 6.117 1.00 . B B . 16 TYR CG 1 1 6 4474 2 2 16 TYR CZ C -9.655 4.974 7.586 1.00 . B B . 16 TYR CZ 1 1 6 4475 2 2 16 TYR H H -4.551 2.912 3.697 1.00 . B B . 16 TYR H 1 1 6 4476 2 2 16 TYR HA H -7.016 4.273 3.392 1.00 . B B . 16 TYR HA 1 1 6 4477 2 2 16 TYR HB2 H -5.930 2.935 5.423 1.00 . B B . 16 TYR HB2 1 1 6 4478 2 2 16 TYR HB3 H -5.252 4.475 5.871 1.00 . B B . 16 TYR HB3 1 1 6 4479 2 2 16 TYR HD1 H -8.356 5.430 4.528 1.00 . B B . 16 TYR HD1 1 1 6 4480 2 2 16 TYR HD2 H -6.693 3.409 7.891 1.00 . B B . 16 TYR HD2 1 1 6 4481 2 2 16 TYR HE1 H -10.357 5.940 5.843 1.00 . B B . 16 TYR HE1 1 1 6 4482 2 2 16 TYR HE2 H -8.738 3.951 9.182 1.00 . B B . 16 TYR HE2 1 1 6 4483 2 2 16 TYR HH H -10.848 6.225 8.329 1.00 . B B . 16 TYR HH 1 1 6 4484 2 2 16 TYR N N -5.017 3.610 3.195 1.00 . B B . 16 TYR N 1 1 6 4485 2 2 16 TYR O O -6.663 6.815 3.758 1.00 . B B . 16 TYR O 1 1 6 4486 2 2 16 TYR OH O -10.780 5.268 8.316 1.00 . B B . 16 TYR OH 1 1 6 4487 2 2 17 LEU C C -4.068 7.952 1.901 1.00 . B B . 17 LEU C 1 1 6 4488 2 2 17 LEU CA C -4.012 7.660 3.421 1.00 . B B . 17 LEU CA 1 1 6 4489 2 2 17 LEU CB C -2.585 7.639 4.036 1.00 . B B . 17 LEU CB 1 1 6 4490 2 2 17 LEU CD1 C -0.704 8.873 5.024 1.00 . B B . 17 LEU CD1 1 1 6 4491 2 2 17 LEU CD2 C -1.552 9.598 2.845 1.00 . B B . 17 LEU CD2 1 1 6 4492 2 2 17 LEU CG C -1.980 9.040 4.203 1.00 . B B . 17 LEU CG 1 1 6 4493 2 2 17 LEU H H -3.897 5.510 3.586 1.00 . B B . 17 LEU H 1 1 6 4494 2 2 17 LEU HA H -4.667 8.359 3.922 1.00 . B B . 17 LEU HA 1 1 6 4495 2 2 17 LEU HB2 H -2.644 7.152 5.001 1.00 . B B . 17 LEU HB2 1 1 6 4496 2 2 17 LEU HB3 H -1.935 7.045 3.412 1.00 . B B . 17 LEU HB3 1 1 6 4497 2 2 17 LEU HD11 H -0.013 8.216 4.518 1.00 . B B . 17 LEU HD11 1 1 6 4498 2 2 17 LEU HD12 H -0.228 9.830 5.175 1.00 . B B . 17 LEU HD12 1 1 6 4499 2 2 17 LEU HD13 H -0.939 8.447 5.989 1.00 . B B . 17 LEU HD13 1 1 6 4500 2 2 17 LEU HD21 H -0.844 8.937 2.366 1.00 . B B . 17 LEU HD21 1 1 6 4501 2 2 17 LEU HD22 H -2.401 9.722 2.190 1.00 . B B . 17 LEU HD22 1 1 6 4502 2 2 17 LEU HD23 H -1.094 10.567 2.974 1.00 . B B . 17 LEU HD23 1 1 6 4503 2 2 17 LEU HG H -2.680 9.707 4.696 1.00 . B B . 17 LEU HG 1 1 6 4504 2 2 17 LEU N N -4.521 6.261 3.583 1.00 . B B . 17 LEU N 1 1 6 4505 2 2 17 LEU O O -4.600 8.961 1.484 1.00 . B B . 17 LEU O 1 1 6 4506 2 2 18 VAL C C -4.934 7.550 -0.908 1.00 . B B . 18 VAL C 1 1 6 4507 2 2 18 VAL CA C -3.509 7.227 -0.384 1.00 . B B . 18 VAL CA 1 1 6 4508 2 2 18 VAL CB C -3.020 5.935 -1.026 1.00 . B B . 18 VAL CB 1 1 6 4509 2 2 18 VAL CG1 C -3.166 6.077 -2.555 1.00 . B B . 18 VAL CG1 1 1 6 4510 2 2 18 VAL CG2 C -1.563 5.751 -0.711 1.00 . B B . 18 VAL CG2 1 1 6 4511 2 2 18 VAL H H -3.083 6.298 1.557 1.00 . B B . 18 VAL H 1 1 6 4512 2 2 18 VAL HA H -2.836 8.013 -0.685 1.00 . B B . 18 VAL HA 1 1 6 4513 2 2 18 VAL HB H -3.584 5.100 -0.631 1.00 . B B . 18 VAL HB 1 1 6 4514 2 2 18 VAL HG11 H -2.640 6.948 -2.917 1.00 . B B . 18 VAL HG11 1 1 6 4515 2 2 18 VAL HG12 H -2.778 5.208 -3.051 1.00 . B B . 18 VAL HG12 1 1 6 4516 2 2 18 VAL HG13 H -4.207 6.193 -2.836 1.00 . B B . 18 VAL HG13 1 1 6 4517 2 2 18 VAL HG21 H -1.000 6.591 -1.088 1.00 . B B . 18 VAL HG21 1 1 6 4518 2 2 18 VAL HG22 H -1.442 5.688 0.362 1.00 . B B . 18 VAL HG22 1 1 6 4519 2 2 18 VAL HG23 H -1.212 4.839 -1.165 1.00 . B B . 18 VAL HG23 1 1 6 4520 2 2 18 VAL N N -3.507 7.066 1.121 1.00 . B B . 18 VAL N 1 1 6 4521 2 2 18 VAL O O -5.166 8.555 -1.552 1.00 . B B . 18 VAL O 1 1 6 4522 2 2 19 CYS C C -8.014 6.804 0.348 1.00 . B B . 19 CYS C 1 1 6 4523 2 2 19 CYS CA C -7.254 6.757 -1.003 1.00 . B B . 19 CYS CA 1 1 6 4524 2 2 19 CYS CB C -7.643 5.520 -1.840 1.00 . B B . 19 CYS CB 1 1 6 4525 2 2 19 CYS H H -5.557 5.843 -0.096 1.00 . B B . 19 CYS H 1 1 6 4526 2 2 19 CYS HA H -7.421 7.680 -1.538 1.00 . B B . 19 CYS HA 1 1 6 4527 2 2 19 CYS HB2 H -7.810 4.688 -1.175 1.00 . B B . 19 CYS HB2 1 1 6 4528 2 2 19 CYS HB3 H -8.584 5.735 -2.316 1.00 . B B . 19 CYS HB3 1 1 6 4529 2 2 19 CYS HG H -6.752 5.503 -3.958 1.00 . B B . 19 CYS HG 1 1 6 4530 2 2 19 CYS N N -5.823 6.642 -0.606 1.00 . B B . 19 CYS N 1 1 6 4531 2 2 19 CYS O O -8.320 5.799 0.972 1.00 . B B . 19 CYS O 1 1 6 4532 2 2 19 CYS SG S -6.515 5.020 -3.164 1.00 . B B . 19 CYS SG 1 1 6 4533 2 2 20 GLY C C -10.455 8.694 1.915 1.00 . B B . 20 GLY C 1 1 6 4534 2 2 20 GLY CA C -9.011 8.218 2.075 1.00 . B B . 20 GLY CA 1 1 6 4535 2 2 20 GLY H H -7.999 8.746 0.201 1.00 . B B . 20 GLY H 1 1 6 4536 2 2 20 GLY HA2 H -9.014 7.291 2.628 1.00 . B B . 20 GLY HA2 1 1 6 4537 2 2 20 GLY HA3 H -8.464 8.952 2.643 1.00 . B B . 20 GLY HA3 1 1 6 4538 2 2 20 GLY N N -8.285 8.004 0.773 1.00 . B B . 20 GLY N 1 1 6 4539 2 2 20 GLY O O -10.922 9.590 2.589 1.00 . B B . 20 GLY O 1 1 6 4540 2 2 21 GLU C C -13.449 7.065 0.925 1.00 . B B . 21 GLU C 1 1 6 4541 2 2 21 GLU CA C -12.545 8.284 0.629 1.00 . B B . 21 GLU CA 1 1 6 4542 2 2 21 GLU CB C -12.577 8.644 -0.907 1.00 . B B . 21 GLU CB 1 1 6 4543 2 2 21 GLU CD C -10.582 7.125 -1.577 1.00 . B B . 21 GLU CD 1 1 6 4544 2 2 21 GLU CG C -11.962 7.563 -1.914 1.00 . B B . 21 GLU CG 1 1 6 4545 2 2 21 GLU H H -10.583 7.346 0.546 1.00 . B B . 21 GLU H 1 1 6 4546 2 2 21 GLU HA H -12.934 9.110 1.209 1.00 . B B . 21 GLU HA 1 1 6 4547 2 2 21 GLU HB2 H -13.606 8.792 -1.201 1.00 . B B . 21 GLU HB2 1 1 6 4548 2 2 21 GLU HB3 H -12.027 9.557 -1.056 1.00 . B B . 21 GLU HB3 1 1 6 4549 2 2 21 GLU HG2 H -12.547 6.671 -2.023 1.00 . B B . 21 GLU HG2 1 1 6 4550 2 2 21 GLU HG3 H -11.850 8.002 -2.894 1.00 . B B . 21 GLU HG3 1 1 6 4551 2 2 21 GLU N N -11.104 8.038 1.007 1.00 . B B . 21 GLU N 1 1 6 4552 2 2 21 GLU O O -14.455 7.089 1.604 1.00 . B B . 21 GLU O 1 1 6 4553 2 2 21 GLU OE1 O -9.705 7.857 -1.955 1.00 . B B . 21 GLU OE1 1 1 6 4554 2 2 21 GLU OE2 O -10.518 6.084 -0.952 1.00 . B B . 21 GLU OE2 1 1 6 4555 2 2 22 ARG C C -12.575 3.656 1.060 1.00 . B B . 22 ARG C 1 1 6 4556 2 2 22 ARG CA C -13.487 4.648 0.339 1.00 . B B . 22 ARG CA 1 1 6 4557 2 2 22 ARG CB C -13.637 4.334 -1.103 1.00 . B B . 22 ARG CB 1 1 6 4558 2 2 22 ARG CD C -12.901 2.137 -1.675 1.00 . B B . 22 ARG CD 1 1 6 4559 2 2 22 ARG CG C -14.131 2.919 -1.317 1.00 . B B . 22 ARG CG 1 1 6 4560 2 2 22 ARG CZ C -12.644 -0.084 -0.783 1.00 . B B . 22 ARG CZ 1 1 6 4561 2 2 22 ARG H H -12.170 6.191 -0.151 1.00 . B B . 22 ARG H 1 1 6 4562 2 2 22 ARG HA H -14.395 4.701 0.858 1.00 . B B . 22 ARG HA 1 1 6 4563 2 2 22 ARG HB2 H -14.242 5.068 -1.588 1.00 . B B . 22 ARG HB2 1 1 6 4564 2 2 22 ARG HB3 H -12.621 4.440 -1.478 1.00 . B B . 22 ARG HB3 1 1 6 4565 2 2 22 ARG HD2 H -12.654 2.348 -2.715 1.00 . B B . 22 ARG HD2 1 1 6 4566 2 2 22 ARG HD3 H -12.038 2.428 -1.074 1.00 . B B . 22 ARG HD3 1 1 6 4567 2 2 22 ARG HE H -14.137 0.379 -1.883 1.00 . B B . 22 ARG HE 1 1 6 4568 2 2 22 ARG HG2 H -14.619 2.527 -0.434 1.00 . B B . 22 ARG HG2 1 1 6 4569 2 2 22 ARG HG3 H -14.836 2.905 -2.138 1.00 . B B . 22 ARG HG3 1 1 6 4570 2 2 22 ARG HH11 H -13.046 0.822 0.883 1.00 . B B . 22 ARG HH11 1 1 6 4571 2 2 22 ARG HH12 H -12.061 -0.624 0.982 1.00 . B B . 22 ARG HH12 1 1 6 4572 2 2 22 ARG HH21 H -12.138 -0.892 -2.415 1.00 . B B . 22 ARG HH21 1 1 6 4573 2 2 22 ARG HH22 H -11.594 -1.711 -0.962 1.00 . B B . 22 ARG HH22 1 1 6 4574 2 2 22 ARG N N -12.970 6.023 0.345 1.00 . B B . 22 ARG N 1 1 6 4575 2 2 22 ARG NE N -13.316 0.720 -1.476 1.00 . B B . 22 ARG NE 1 1 6 4576 2 2 22 ARG NH1 N -12.578 0.045 0.460 1.00 . B B . 22 ARG NH1 1 1 6 4577 2 2 22 ARG NH2 N -12.073 -0.982 -1.425 1.00 . B B . 22 ARG NH2 1 1 6 4578 2 2 22 ARG O O -12.958 2.673 1.675 1.00 . B B . 22 ARG O 1 1 6 4579 2 2 23 GLY C C -9.438 2.299 0.520 1.00 . B B . 23 GLY C 1 1 6 4580 2 2 23 GLY CA C -10.212 3.199 1.462 1.00 . B B . 23 GLY CA 1 1 6 4581 2 2 23 GLY H H -11.157 4.755 0.322 1.00 . B B . 23 GLY H 1 1 6 4582 2 2 23 GLY HA2 H -9.494 3.913 1.840 1.00 . B B . 23 GLY HA2 1 1 6 4583 2 2 23 GLY HA3 H -10.556 2.614 2.303 1.00 . B B . 23 GLY HA3 1 1 6 4584 2 2 23 GLY N N -11.338 3.969 0.879 1.00 . B B . 23 GLY N 1 1 6 4585 2 2 23 GLY O O -8.709 2.700 -0.359 1.00 . B B . 23 GLY O 1 1 6 4586 2 2 24 PHE C C -9.467 -1.425 -0.076 1.00 . B B . 24 PHE C 1 1 6 4587 2 2 24 PHE CA C -8.900 0.014 -0.132 1.00 . B B . 24 PHE CA 1 1 6 4588 2 2 24 PHE CB C -7.457 0.105 0.408 1.00 . B B . 24 PHE CB 1 1 6 4589 2 2 24 PHE CD1 C -8.018 -1.068 2.572 1.00 . B B . 24 PHE CD1 1 1 6 4590 2 2 24 PHE CD2 C -7.550 1.263 2.658 1.00 . B B . 24 PHE CD2 1 1 6 4591 2 2 24 PHE CE1 C -8.251 -1.081 3.928 1.00 . B B . 24 PHE CE1 1 1 6 4592 2 2 24 PHE CE2 C -7.783 1.254 4.016 1.00 . B B . 24 PHE CE2 1 1 6 4593 2 2 24 PHE CG C -7.668 0.095 1.932 1.00 . B B . 24 PHE CG 1 1 6 4594 2 2 24 PHE CZ C -8.133 0.084 4.651 1.00 . B B . 24 PHE CZ 1 1 6 4595 2 2 24 PHE H H -10.252 0.776 1.418 1.00 . B B . 24 PHE H 1 1 6 4596 2 2 24 PHE HA H -8.931 0.329 -1.166 1.00 . B B . 24 PHE HA 1 1 6 4597 2 2 24 PHE HB2 H -6.822 -0.715 0.115 1.00 . B B . 24 PHE HB2 1 1 6 4598 2 2 24 PHE HB3 H -6.989 1.043 0.152 1.00 . B B . 24 PHE HB3 1 1 6 4599 2 2 24 PHE HD1 H -8.128 -1.967 1.990 1.00 . B B . 24 PHE HD1 1 1 6 4600 2 2 24 PHE HD2 H -7.295 2.193 2.151 1.00 . B B . 24 PHE HD2 1 1 6 4601 2 2 24 PHE HE1 H -8.526 -2.000 4.429 1.00 . B B . 24 PHE HE1 1 1 6 4602 2 2 24 PHE HE2 H -7.699 2.167 4.586 1.00 . B B . 24 PHE HE2 1 1 6 4603 2 2 24 PHE HZ H -8.315 0.084 5.718 1.00 . B B . 24 PHE HZ 1 1 6 4604 2 2 24 PHE N N -9.632 1.035 0.712 1.00 . B B . 24 PHE N 1 1 6 4605 2 2 24 PHE O O -10.504 -1.666 0.514 1.00 . B B . 24 PHE O 1 1 6 4606 2 2 25 PHE C C -8.059 -4.728 -0.278 1.00 . B B . 25 PHE C 1 1 6 4607 2 2 25 PHE CA C -9.226 -3.790 -0.700 1.00 . B B . 25 PHE CA 1 1 6 4608 2 2 25 PHE CB C -9.777 -4.168 -2.128 1.00 . B B . 25 PHE CB 1 1 6 4609 2 2 25 PHE CD1 C -7.741 -5.055 -3.361 1.00 . B B . 25 PHE CD1 1 1 6 4610 2 2 25 PHE CD2 C -8.853 -3.151 -4.234 1.00 . B B . 25 PHE CD2 1 1 6 4611 2 2 25 PHE CE1 C -6.838 -5.008 -4.400 1.00 . B B . 25 PHE CE1 1 1 6 4612 2 2 25 PHE CE2 C -7.952 -3.098 -5.276 1.00 . B B . 25 PHE CE2 1 1 6 4613 2 2 25 PHE CG C -8.756 -4.126 -3.270 1.00 . B B . 25 PHE CG 1 1 6 4614 2 2 25 PHE CZ C -6.944 -4.028 -5.359 1.00 . B B . 25 PHE CZ 1 1 6 4615 2 2 25 PHE H H -7.969 -2.065 -1.186 1.00 . B B . 25 PHE H 1 1 6 4616 2 2 25 PHE HA H -10.005 -3.941 0.038 1.00 . B B . 25 PHE HA 1 1 6 4617 2 2 25 PHE HB2 H -10.163 -5.178 -2.086 1.00 . B B . 25 PHE HB2 1 1 6 4618 2 2 25 PHE HB3 H -10.600 -3.522 -2.387 1.00 . B B . 25 PHE HB3 1 1 6 4619 2 2 25 PHE HD1 H -7.656 -5.834 -2.618 1.00 . B B . 25 PHE HD1 1 1 6 4620 2 2 25 PHE HD2 H -9.649 -2.427 -4.181 1.00 . B B . 25 PHE HD2 1 1 6 4621 2 2 25 PHE HE1 H -6.049 -5.746 -4.461 1.00 . B B . 25 PHE HE1 1 1 6 4622 2 2 25 PHE HE2 H -8.032 -2.328 -6.034 1.00 . B B . 25 PHE HE2 1 1 6 4623 2 2 25 PHE HZ H -6.241 -3.981 -6.182 1.00 . B B . 25 PHE HZ 1 1 6 4624 2 2 25 PHE N N -8.781 -2.343 -0.704 1.00 . B B . 25 PHE N 1 1 6 4625 2 2 25 PHE O O -8.245 -5.674 0.457 1.00 . B B . 25 PHE O 1 1 6 4626 2 2 26 TYR C C -5.737 -6.543 0.408 1.00 . B B . 26 TYR C 1 1 6 4627 2 2 26 TYR CA C -5.631 -5.229 -0.448 1.00 . B B . 26 TYR CA 1 1 6 4628 2 2 26 TYR CB C -4.654 -4.148 0.173 1.00 . B B . 26 TYR CB 1 1 6 4629 2 2 26 TYR CD1 C -2.605 -5.378 1.074 1.00 . B B . 26 TYR CD1 1 1 6 4630 2 2 26 TYR CD2 C -4.126 -4.417 2.625 1.00 . B B . 26 TYR CD2 1 1 6 4631 2 2 26 TYR CE1 C -1.832 -5.837 2.130 1.00 . B B . 26 TYR CE1 1 1 6 4632 2 2 26 TYR CE2 C -3.349 -4.880 3.668 1.00 . B B . 26 TYR CE2 1 1 6 4633 2 2 26 TYR CG C -3.761 -4.664 1.316 1.00 . B B . 26 TYR CG 1 1 6 4634 2 2 26 TYR CZ C -2.207 -5.587 3.425 1.00 . B B . 26 TYR CZ 1 1 6 4635 2 2 26 TYR H H -6.815 -3.642 -1.336 1.00 . B B . 26 TYR H 1 1 6 4636 2 2 26 TYR HA H -5.216 -5.553 -1.393 1.00 . B B . 26 TYR HA 1 1 6 4637 2 2 26 TYR HB2 H -4.011 -3.784 -0.612 1.00 . B B . 26 TYR HB2 1 1 6 4638 2 2 26 TYR HB3 H -5.221 -3.307 0.542 1.00 . B B . 26 TYR HB3 1 1 6 4639 2 2 26 TYR HD1 H -2.298 -5.585 0.057 1.00 . B B . 26 TYR HD1 1 1 6 4640 2 2 26 TYR HD2 H -5.024 -3.853 2.837 1.00 . B B . 26 TYR HD2 1 1 6 4641 2 2 26 TYR HE1 H -0.925 -6.391 1.942 1.00 . B B . 26 TYR HE1 1 1 6 4642 2 2 26 TYR HE2 H -3.625 -4.694 4.692 1.00 . B B . 26 TYR HE2 1 1 6 4643 2 2 26 TYR HH H -0.538 -6.002 4.190 1.00 . B B . 26 TYR HH 1 1 6 4644 2 2 26 TYR N N -6.879 -4.427 -0.753 1.00 . B B . 26 TYR N 1 1 6 4645 2 2 26 TYR O O -5.643 -7.614 -0.149 1.00 . B B . 26 TYR O 1 1 6 4646 2 2 26 TYR OH O -1.466 -6.036 4.489 1.00 . B B . 26 TYR OH 1 1 6 4647 2 2 27 THR C C -4.738 -8.103 3.307 1.00 . B B . 27 THR C 1 1 6 4648 2 2 27 THR CA C -6.046 -7.533 2.716 1.00 . B B . 27 THR CA 1 1 6 4649 2 2 27 THR CB C -6.853 -8.726 2.149 1.00 . B B . 27 THR CB 1 1 6 4650 2 2 27 THR CG2 C -7.175 -9.709 3.267 1.00 . B B . 27 THR CG2 1 1 6 4651 2 2 27 THR H H -5.977 -5.507 2.035 1.00 . B B . 27 THR H 1 1 6 4652 2 2 27 THR HA H -6.619 -7.156 3.549 1.00 . B B . 27 THR HA 1 1 6 4653 2 2 27 THR HB H -6.496 -9.182 1.232 1.00 . B B . 27 THR HB 1 1 6 4654 2 2 27 THR HG1 H -8.132 -7.372 1.469 1.00 . B B . 27 THR HG1 1 1 6 4655 2 2 27 THR HG21 H -7.752 -9.212 4.035 1.00 . B B . 27 THR HG21 1 1 6 4656 2 2 27 THR HG22 H -7.767 -10.514 2.865 1.00 . B B . 27 THR HG22 1 1 6 4657 2 2 27 THR HG23 H -6.280 -10.113 3.708 1.00 . B B . 27 THR HG23 1 1 6 4658 2 2 27 THR N N -5.917 -6.416 1.697 1.00 . B B . 27 THR N 1 1 6 4659 2 2 27 THR O O -4.410 -7.664 4.392 1.00 . B B . 27 THR O 1 1 6 4660 2 2 27 THR OG1 O -8.154 -8.184 1.999 1.00 . B B . 27 THR OG1 1 1 6 4661 2 2 28 PRO C C -2.831 -9.657 4.905 1.00 . B B . 28 PRO C 1 1 6 4662 2 2 28 PRO CA C -2.924 -9.798 3.363 1.00 . B B . 28 PRO CA 1 1 6 4663 2 2 28 PRO CB C -1.664 -9.350 2.617 1.00 . B B . 28 PRO CB 1 1 6 4664 2 2 28 PRO CD C -3.566 -8.737 1.255 1.00 . B B . 28 PRO CD 1 1 6 4665 2 2 28 PRO CG C -2.168 -9.381 1.168 1.00 . B B . 28 PRO CG 1 1 6 4666 2 2 28 PRO HA H -3.079 -10.849 3.161 1.00 . B B . 28 PRO HA 1 1 6 4667 2 2 28 PRO HB2 H -1.365 -8.359 2.933 1.00 . B B . 28 PRO HB2 1 1 6 4668 2 2 28 PRO HB3 H -0.845 -10.038 2.773 1.00 . B B . 28 PRO HB3 1 1 6 4669 2 2 28 PRO HD2 H -3.526 -7.677 1.062 1.00 . B B . 28 PRO HD2 1 1 6 4670 2 2 28 PRO HD3 H -4.241 -9.218 0.560 1.00 . B B . 28 PRO HD3 1 1 6 4671 2 2 28 PRO HG2 H -1.524 -8.804 0.517 1.00 . B B . 28 PRO HG2 1 1 6 4672 2 2 28 PRO HG3 H -2.235 -10.394 0.796 1.00 . B B . 28 PRO HG3 1 1 6 4673 2 2 28 PRO N N -4.014 -9.008 2.658 1.00 . B B . 28 PRO N 1 1 6 4674 2 2 28 PRO O O -1.910 -9.108 5.484 1.00 . B B . 28 PRO O 1 1 6 4675 2 2 29 LYS C C -4.223 -11.525 7.636 1.00 . B B . 29 LYS C 1 1 6 4676 2 2 29 LYS CA C -3.929 -10.118 7.041 1.00 . B B . 29 LYS CA 1 1 6 4677 2 2 29 LYS CB C -5.032 -9.065 7.309 1.00 . B B . 29 LYS CB 1 1 6 4678 2 2 29 LYS CD C -3.591 -7.578 8.846 1.00 . B B . 29 LYS CD 1 1 6 4679 2 2 29 LYS CE C -3.557 -6.454 7.790 1.00 . B B . 29 LYS CE 1 1 6 4680 2 2 29 LYS CG C -4.889 -8.459 8.722 1.00 . B B . 29 LYS CG 1 1 6 4681 2 2 29 LYS H H -4.550 -10.590 5.026 1.00 . B B . 29 LYS H 1 1 6 4682 2 2 29 LYS HA H -2.978 -9.815 7.453 1.00 . B B . 29 LYS HA 1 1 6 4683 2 2 29 LYS HB2 H -4.999 -8.290 6.555 1.00 . B B . 29 LYS HB2 1 1 6 4684 2 2 29 LYS HB3 H -6.004 -9.531 7.201 1.00 . B B . 29 LYS HB3 1 1 6 4685 2 2 29 LYS HD2 H -3.617 -7.113 9.823 1.00 . B B . 29 LYS HD2 1 1 6 4686 2 2 29 LYS HD3 H -2.680 -8.155 8.821 1.00 . B B . 29 LYS HD3 1 1 6 4687 2 2 29 LYS HE2 H -4.575 -6.164 7.536 1.00 . B B . 29 LYS HE2 1 1 6 4688 2 2 29 LYS HE3 H -3.046 -5.579 8.169 1.00 . B B . 29 LYS HE3 1 1 6 4689 2 2 29 LYS HG2 H -5.751 -7.836 8.936 1.00 . B B . 29 LYS HG2 1 1 6 4690 2 2 29 LYS HG3 H -4.875 -9.229 9.482 1.00 . B B . 29 LYS HG3 1 1 6 4691 2 2 29 LYS HZ1 H -2.455 -7.928 6.751 1.00 . B B . 29 LYS HZ1 1 1 6 4692 2 2 29 LYS HZ2 H -3.487 -7.117 5.769 1.00 . B B . 29 LYS HZ2 1 1 6 4693 2 2 29 LYS HZ3 H -2.092 -6.397 6.195 1.00 . B B . 29 LYS HZ3 1 1 6 4694 2 2 29 LYS N N -3.840 -10.165 5.546 1.00 . B B . 29 LYS N 1 1 6 4695 2 2 29 LYS NZ N -2.856 -6.989 6.579 1.00 . B B . 29 LYS NZ 1 1 6 4696 2 2 29 LYS O O -4.504 -12.446 6.900 1.00 . B B . 29 LYS O 1 1 6 4697 2 2 30 THR C C -5.670 -13.036 10.505 1.00 . B B . 30 THR C 1 1 6 4698 2 2 30 THR CA C -4.427 -13.001 9.606 1.00 . B B . 30 THR CA 1 1 6 4699 2 2 30 THR CB C -3.239 -13.400 10.484 1.00 . B B . 30 THR CB 1 1 6 4700 2 2 30 THR CG2 C -1.927 -13.413 9.721 1.00 . B B . 30 THR CG2 1 1 6 4701 2 2 30 THR H H -3.927 -10.896 9.492 1.00 . B B . 30 THR H 1 1 6 4702 2 2 30 THR HA H -4.567 -13.770 8.859 1.00 . B B . 30 THR HA 1 1 6 4703 2 2 30 THR HB H -3.420 -14.286 11.089 1.00 . B B . 30 THR HB 1 1 6 4704 2 2 30 THR HG1 H -2.118 -12.059 11.360 1.00 . B B . 30 THR HG1 1 1 6 4705 2 2 30 THR HG21 H -1.709 -12.438 9.315 1.00 . B B . 30 THR HG21 1 1 6 4706 2 2 30 THR HG22 H -1.123 -13.712 10.377 1.00 . B B . 30 THR HG22 1 1 6 4707 2 2 30 THR HG23 H -1.988 -14.119 8.907 1.00 . B B . 30 THR HG23 1 1 6 4708 2 2 30 THR N N -4.158 -11.663 8.931 1.00 . B B . 30 THR N 1 1 6 4709 2 2 30 THR O O -6.189 -14.089 10.823 1.00 . B B . 30 THR O 1 1 6 4710 2 2 30 THR OG1 O -3.060 -12.250 11.291 1.00 . B B . 30 THR OG1 1 1 7 4711 1 1 1 GLY C C -1.269 -7.027 -2.579 1.00 . A A . 1 GLY C 1 1 7 4712 1 1 1 GLY CA C -1.360 -8.433 -3.140 1.00 . A A . 1 GLY CA 1 1 7 4713 1 1 1 GLY HA2 H -0.734 -8.492 -4.018 1.00 . A A . 1 GLY HA2 1 1 7 4714 1 1 1 GLY HA3 H -2.386 -8.619 -3.418 1.00 . A A . 1 GLY HA3 1 1 7 4715 1 1 1 GLY N N -0.895 -9.435 -2.114 1.00 . A A . 1 GLY N 1 1 7 4716 1 1 1 GLY O O -2.273 -6.380 -2.377 1.00 . A A . 1 GLY O 1 1 7 4717 1 1 2 ILE C C 1.648 -5.608 -0.930 1.00 . A A . 2 ILE C 1 1 7 4718 1 1 2 ILE CA C 0.427 -5.324 -1.801 1.00 . A A . 2 ILE CA 1 1 7 4719 1 1 2 ILE CB C -0.663 -4.641 -0.892 1.00 . A A . 2 ILE CB 1 1 7 4720 1 1 2 ILE CD1 C -1.024 -2.654 0.714 1.00 . A A . 2 ILE CD1 1 1 7 4721 1 1 2 ILE CG1 C -0.046 -3.348 -0.271 1.00 . A A . 2 ILE CG1 1 1 7 4722 1 1 2 ILE CG2 C -1.175 -5.554 0.272 1.00 . A A . 2 ILE CG2 1 1 7 4723 1 1 2 ILE H H 0.629 -7.326 -2.595 1.00 . A A . 2 ILE H 1 1 7 4724 1 1 2 ILE HA H 0.743 -4.674 -2.605 1.00 . A A . 2 ILE HA 1 1 7 4725 1 1 2 ILE HB H -1.478 -4.393 -1.541 1.00 . A A . 2 ILE HB 1 1 7 4726 1 1 2 ILE HD11 H -1.946 -2.360 0.229 1.00 . A A . 2 ILE HD11 1 1 7 4727 1 1 2 ILE HD12 H -1.273 -3.298 1.540 1.00 . A A . 2 ILE HD12 1 1 7 4728 1 1 2 ILE HD13 H -0.569 -1.772 1.141 1.00 . A A . 2 ILE HD13 1 1 7 4729 1 1 2 ILE HG12 H 0.861 -3.595 0.264 1.00 . A A . 2 ILE HG12 1 1 7 4730 1 1 2 ILE HG13 H 0.232 -2.664 -1.060 1.00 . A A . 2 ILE HG13 1 1 7 4731 1 1 2 ILE HG21 H -1.559 -6.491 -0.100 1.00 . A A . 2 ILE HG21 1 1 7 4732 1 1 2 ILE HG22 H -0.399 -5.743 0.996 1.00 . A A . 2 ILE HG22 1 1 7 4733 1 1 2 ILE HG23 H -1.990 -5.060 0.779 1.00 . A A . 2 ILE HG23 1 1 7 4734 1 1 2 ILE N N -0.046 -6.651 -2.363 1.00 . A A . 2 ILE N 1 1 7 4735 1 1 2 ILE O O 2.678 -4.960 -0.977 1.00 . A A . 2 ILE O 1 1 7 4736 1 1 3 VAL C C 3.817 -7.232 0.161 1.00 . A A . 3 VAL C 1 1 7 4737 1 1 3 VAL CA C 2.445 -7.112 0.830 1.00 . A A . 3 VAL CA 1 1 7 4738 1 1 3 VAL CB C 1.892 -8.460 1.349 1.00 . A A . 3 VAL CB 1 1 7 4739 1 1 3 VAL CG1 C 2.836 -9.035 2.391 1.00 . A A . 3 VAL CG1 1 1 7 4740 1 1 3 VAL CG2 C 0.533 -8.228 2.039 1.00 . A A . 3 VAL CG2 1 1 7 4741 1 1 3 VAL H H 0.561 -7.036 -0.204 1.00 . A A . 3 VAL H 1 1 7 4742 1 1 3 VAL HA H 2.558 -6.385 1.617 1.00 . A A . 3 VAL HA 1 1 7 4743 1 1 3 VAL HB H 1.781 -9.153 0.518 1.00 . A A . 3 VAL HB 1 1 7 4744 1 1 3 VAL HG11 H 2.947 -8.356 3.224 1.00 . A A . 3 VAL HG11 1 1 7 4745 1 1 3 VAL HG12 H 2.450 -9.976 2.751 1.00 . A A . 3 VAL HG12 1 1 7 4746 1 1 3 VAL HG13 H 3.808 -9.211 1.951 1.00 . A A . 3 VAL HG13 1 1 7 4747 1 1 3 VAL HG21 H 0.626 -7.522 2.852 1.00 . A A . 3 VAL HG21 1 1 7 4748 1 1 3 VAL HG22 H -0.194 -7.849 1.338 1.00 . A A . 3 VAL HG22 1 1 7 4749 1 1 3 VAL HG23 H 0.158 -9.163 2.431 1.00 . A A . 3 VAL HG23 1 1 7 4750 1 1 3 VAL N N 1.434 -6.609 -0.136 1.00 . A A . 3 VAL N 1 1 7 4751 1 1 3 VAL O O 4.707 -6.462 0.441 1.00 . A A . 3 VAL O 1 1 7 4752 1 1 4 GLU C C 5.759 -6.959 -2.020 1.00 . A A . 4 GLU C 1 1 7 4753 1 1 4 GLU CA C 5.304 -8.312 -1.388 1.00 . A A . 4 GLU CA 1 1 7 4754 1 1 4 GLU CB C 5.101 -9.480 -2.406 1.00 . A A . 4 GLU CB 1 1 7 4755 1 1 4 GLU CD C 2.669 -8.706 -3.031 1.00 . A A . 4 GLU CD 1 1 7 4756 1 1 4 GLU CG C 4.039 -9.150 -3.529 1.00 . A A . 4 GLU CG 1 1 7 4757 1 1 4 GLU H H 3.245 -8.776 -0.931 1.00 . A A . 4 GLU H 1 1 7 4758 1 1 4 GLU HA H 6.030 -8.543 -0.623 1.00 . A A . 4 GLU HA 1 1 7 4759 1 1 4 GLU HB2 H 6.052 -9.727 -2.857 1.00 . A A . 4 GLU HB2 1 1 7 4760 1 1 4 GLU HB3 H 4.764 -10.349 -1.854 1.00 . A A . 4 GLU HB3 1 1 7 4761 1 1 4 GLU HG2 H 4.428 -8.391 -4.186 1.00 . A A . 4 GLU HG2 1 1 7 4762 1 1 4 GLU HG3 H 3.872 -10.039 -4.113 1.00 . A A . 4 GLU HG3 1 1 7 4763 1 1 4 GLU N N 3.983 -8.169 -0.712 1.00 . A A . 4 GLU N 1 1 7 4764 1 1 4 GLU O O 6.850 -6.483 -1.772 1.00 . A A . 4 GLU O 1 1 7 4765 1 1 4 GLU OE1 O 1.980 -9.445 -2.366 1.00 . A A . 4 GLU OE1 1 1 7 4766 1 1 4 GLU OE2 O 2.337 -7.590 -3.342 1.00 . A A . 4 GLU OE2 1 1 7 4767 1 1 5 GLN C C 5.899 -3.992 -2.512 1.00 . A A . 5 GLN C 1 1 7 4768 1 1 5 GLN CA C 5.274 -5.037 -3.473 1.00 . A A . 5 GLN CA 1 1 7 4769 1 1 5 GLN CB C 3.961 -4.526 -4.113 1.00 . A A . 5 GLN CB 1 1 7 4770 1 1 5 GLN CD C 2.170 -5.211 -5.785 1.00 . A A . 5 GLN CD 1 1 7 4771 1 1 5 GLN CG C 3.577 -5.484 -5.295 1.00 . A A . 5 GLN CG 1 1 7 4772 1 1 5 GLN H H 4.067 -6.792 -2.976 1.00 . A A . 5 GLN H 1 1 7 4773 1 1 5 GLN HA H 6.038 -5.195 -4.227 1.00 . A A . 5 GLN HA 1 1 7 4774 1 1 5 GLN HB2 H 3.177 -4.532 -3.366 1.00 . A A . 5 GLN HB2 1 1 7 4775 1 1 5 GLN HB3 H 4.087 -3.515 -4.476 1.00 . A A . 5 GLN HB3 1 1 7 4776 1 1 5 GLN HE21 H 1.398 -6.395 -4.475 1.00 . A A . 5 GLN HE21 1 1 7 4777 1 1 5 GLN HE22 H 0.274 -5.606 -5.505 1.00 . A A . 5 GLN HE22 1 1 7 4778 1 1 5 GLN HG2 H 4.237 -5.330 -6.132 1.00 . A A . 5 GLN HG2 1 1 7 4779 1 1 5 GLN HG3 H 3.632 -6.522 -5.016 1.00 . A A . 5 GLN HG3 1 1 7 4780 1 1 5 GLN N N 4.931 -6.354 -2.819 1.00 . A A . 5 GLN N 1 1 7 4781 1 1 5 GLN NE2 N 1.183 -5.785 -5.208 1.00 . A A . 5 GLN NE2 1 1 7 4782 1 1 5 GLN O O 6.934 -3.454 -2.831 1.00 . A A . 5 GLN O 1 1 7 4783 1 1 5 GLN OE1 O 1.926 -4.464 -6.699 1.00 . A A . 5 GLN OE1 1 1 7 4784 1 1 6 CYS C C 6.446 -3.230 0.906 1.00 . A A . 6 CYS C 1 1 7 4785 1 1 6 CYS CA C 5.904 -2.695 -0.435 1.00 . A A . 6 CYS CA 1 1 7 4786 1 1 6 CYS CB C 4.843 -1.622 -0.147 1.00 . A A . 6 CYS CB 1 1 7 4787 1 1 6 CYS H H 4.457 -4.187 -1.179 1.00 . A A . 6 CYS H 1 1 7 4788 1 1 6 CYS HA H 6.744 -2.203 -0.909 1.00 . A A . 6 CYS HA 1 1 7 4789 1 1 6 CYS HB2 H 3.916 -2.110 0.117 1.00 . A A . 6 CYS HB2 1 1 7 4790 1 1 6 CYS HB3 H 5.163 -1.047 0.712 1.00 . A A . 6 CYS HB3 1 1 7 4791 1 1 6 CYS HG H 5.214 0.199 -1.477 1.00 . A A . 6 CYS HG 1 1 7 4792 1 1 6 CYS N N 5.301 -3.717 -1.385 1.00 . A A . 6 CYS N 1 1 7 4793 1 1 6 CYS O O 7.298 -2.631 1.521 1.00 . A A . 6 CYS O 1 1 7 4794 1 1 6 CYS SG S 4.501 -0.446 -1.475 1.00 . A A . 6 CYS SG 1 1 7 4795 1 1 7 CYS C C 7.462 -6.088 2.423 1.00 . A A . 7 CYS C 1 1 7 4796 1 1 7 CYS CA C 6.411 -4.963 2.628 1.00 . A A . 7 CYS CA 1 1 7 4797 1 1 7 CYS CB C 5.086 -5.417 3.283 1.00 . A A . 7 CYS CB 1 1 7 4798 1 1 7 CYS H H 5.298 -4.815 0.779 1.00 . A A . 7 CYS H 1 1 7 4799 1 1 7 CYS HA H 6.877 -4.208 3.245 1.00 . A A . 7 CYS HA 1 1 7 4800 1 1 7 CYS HB2 H 4.526 -4.504 3.451 1.00 . A A . 7 CYS HB2 1 1 7 4801 1 1 7 CYS HB3 H 4.514 -5.971 2.562 1.00 . A A . 7 CYS HB3 1 1 7 4802 1 1 7 CYS HG H 5.338 -7.286 4.587 1.00 . A A . 7 CYS HG 1 1 7 4803 1 1 7 CYS N N 5.962 -4.354 1.329 1.00 . A A . 7 CYS N 1 1 7 4804 1 1 7 CYS O O 7.675 -6.976 3.223 1.00 . A A . 7 CYS O 1 1 7 4805 1 1 7 CYS SG S 5.141 -6.375 4.821 1.00 . A A . 7 CYS SG 1 1 7 4806 1 1 8 THR C C 10.071 -6.209 -0.183 1.00 . A A . 8 THR C 1 1 7 4807 1 1 8 THR CA C 9.190 -6.941 0.837 1.00 . A A . 8 THR CA 1 1 7 4808 1 1 8 THR CB C 8.605 -8.195 0.147 1.00 . A A . 8 THR CB 1 1 7 4809 1 1 8 THR CG2 C 9.628 -9.287 -0.006 1.00 . A A . 8 THR CG2 1 1 7 4810 1 1 8 THR H H 7.828 -5.231 0.735 1.00 . A A . 8 THR H 1 1 7 4811 1 1 8 THR HA H 9.814 -7.221 1.672 1.00 . A A . 8 THR HA 1 1 7 4812 1 1 8 THR HB H 8.077 -8.005 -0.775 1.00 . A A . 8 THR HB 1 1 7 4813 1 1 8 THR HG1 H 7.763 -8.361 1.928 1.00 . A A . 8 THR HG1 1 1 7 4814 1 1 8 THR HG21 H 9.993 -9.594 0.963 1.00 . A A . 8 THR HG21 1 1 7 4815 1 1 8 THR HG22 H 9.156 -10.138 -0.475 1.00 . A A . 8 THR HG22 1 1 7 4816 1 1 8 THR HG23 H 10.455 -8.958 -0.615 1.00 . A A . 8 THR HG23 1 1 7 4817 1 1 8 THR N N 8.100 -5.986 1.295 1.00 . A A . 8 THR N 1 1 7 4818 1 1 8 THR O O 11.275 -6.141 -0.091 1.00 . A A . 8 THR O 1 1 7 4819 1 1 8 THR OG1 O 7.767 -8.841 1.084 1.00 . A A . 8 THR OG1 1 1 7 4820 1 1 9 SER C C 9.605 -3.384 -2.128 1.00 . A A . 9 SER C 1 1 7 4821 1 1 9 SER CA C 9.968 -4.887 -2.299 1.00 . A A . 9 SER CA 1 1 7 4822 1 1 9 SER CB C 9.368 -5.492 -3.603 1.00 . A A . 9 SER CB 1 1 7 4823 1 1 9 SER H H 8.419 -5.804 -1.137 1.00 . A A . 9 SER H 1 1 7 4824 1 1 9 SER HA H 11.046 -4.970 -2.308 1.00 . A A . 9 SER HA 1 1 7 4825 1 1 9 SER HB2 H 9.572 -6.554 -3.647 1.00 . A A . 9 SER HB2 1 1 7 4826 1 1 9 SER HB3 H 8.297 -5.334 -3.635 1.00 . A A . 9 SER HB3 1 1 7 4827 1 1 9 SER HG H 9.358 -4.469 -5.318 1.00 . A A . 9 SER HG 1 1 7 4828 1 1 9 SER N N 9.387 -5.674 -1.152 1.00 . A A . 9 SER N 1 1 7 4829 1 1 9 SER O O 9.499 -2.894 -1.019 1.00 . A A . 9 SER O 1 1 7 4830 1 1 9 SER OG O 10.009 -4.831 -4.696 1.00 . A A . 9 SER OG 1 1 7 4831 1 1 10 ILE C C 7.933 -1.216 -4.358 1.00 . A A . 10 ILE C 1 1 7 4832 1 1 10 ILE CA C 9.092 -1.279 -3.340 1.00 . A A . 10 ILE CA 1 1 7 4833 1 1 10 ILE CB C 10.318 -0.476 -3.874 1.00 . A A . 10 ILE CB 1 1 7 4834 1 1 10 ILE CD1 C 10.975 1.803 -4.913 1.00 . A A . 10 ILE CD1 1 1 7 4835 1 1 10 ILE CG1 C 9.923 1.037 -4.060 1.00 . A A . 10 ILE CG1 1 1 7 4836 1 1 10 ILE CG2 C 10.760 -1.090 -5.215 1.00 . A A . 10 ILE CG2 1 1 7 4837 1 1 10 ILE H H 9.557 -3.171 -4.057 1.00 . A A . 10 ILE H 1 1 7 4838 1 1 10 ILE HA H 8.809 -0.891 -2.376 1.00 . A A . 10 ILE HA 1 1 7 4839 1 1 10 ILE HB H 11.129 -0.547 -3.159 1.00 . A A . 10 ILE HB 1 1 7 4840 1 1 10 ILE HD11 H 11.953 1.740 -4.456 1.00 . A A . 10 ILE HD11 1 1 7 4841 1 1 10 ILE HD12 H 11.039 1.380 -5.905 1.00 . A A . 10 ILE HD12 1 1 7 4842 1 1 10 ILE HD13 H 10.696 2.840 -5.020 1.00 . A A . 10 ILE HD13 1 1 7 4843 1 1 10 ILE HG12 H 8.951 1.140 -4.523 1.00 . A A . 10 ILE HG12 1 1 7 4844 1 1 10 ILE HG13 H 9.855 1.498 -3.083 1.00 . A A . 10 ILE HG13 1 1 7 4845 1 1 10 ILE HG21 H 10.999 -2.133 -5.078 1.00 . A A . 10 ILE HG21 1 1 7 4846 1 1 10 ILE HG22 H 9.971 -1.005 -5.949 1.00 . A A . 10 ILE HG22 1 1 7 4847 1 1 10 ILE HG23 H 11.639 -0.586 -5.582 1.00 . A A . 10 ILE HG23 1 1 7 4848 1 1 10 ILE N N 9.444 -2.711 -3.222 1.00 . A A . 10 ILE N 1 1 7 4849 1 1 10 ILE O O 7.822 -2.005 -5.282 1.00 . A A . 10 ILE O 1 1 7 4850 1 1 11 CYS C C 5.582 1.534 -5.082 1.00 . A A . 11 CYS C 1 1 7 4851 1 1 11 CYS CA C 5.922 0.005 -4.969 1.00 . A A . 11 CYS CA 1 1 7 4852 1 1 11 CYS CB C 4.767 -0.819 -4.353 1.00 . A A . 11 CYS CB 1 1 7 4853 1 1 11 CYS H H 7.305 0.261 -3.362 1.00 . A A . 11 CYS H 1 1 7 4854 1 1 11 CYS HA H 6.127 -0.350 -5.972 1.00 . A A . 11 CYS HA 1 1 7 4855 1 1 11 CYS HB2 H 4.187 -1.289 -5.126 1.00 . A A . 11 CYS HB2 1 1 7 4856 1 1 11 CYS HB3 H 5.224 -1.626 -3.795 1.00 . A A . 11 CYS HB3 1 1 7 4857 1 1 11 CYS HG H 2.988 0.486 -3.723 1.00 . A A . 11 CYS HG 1 1 7 4858 1 1 11 CYS N N 7.101 -0.265 -4.132 1.00 . A A . 11 CYS N 1 1 7 4859 1 1 11 CYS O O 6.056 2.445 -4.429 1.00 . A A . 11 CYS O 1 1 7 4860 1 1 11 CYS SG S 3.645 0.011 -3.206 1.00 . A A . 11 CYS SG 1 1 7 4861 1 1 12 SER C C 2.781 3.498 -5.746 1.00 . A A . 12 SER C 1 1 7 4862 1 1 12 SER CA C 4.077 3.023 -6.414 1.00 . A A . 12 SER CA 1 1 7 4863 1 1 12 SER CB C 3.852 2.949 -7.926 1.00 . A A . 12 SER CB 1 1 7 4864 1 1 12 SER H H 4.477 0.835 -6.347 1.00 . A A . 12 SER H 1 1 7 4865 1 1 12 SER HA H 4.737 3.834 -6.276 1.00 . A A . 12 SER HA 1 1 7 4866 1 1 12 SER HB2 H 4.777 2.726 -8.447 1.00 . A A . 12 SER HB2 1 1 7 4867 1 1 12 SER HB3 H 3.101 2.215 -8.193 1.00 . A A . 12 SER HB3 1 1 7 4868 1 1 12 SER HG H 3.840 4.587 -9.030 1.00 . A A . 12 SER HG 1 1 7 4869 1 1 12 SER N N 4.689 1.704 -5.981 1.00 . A A . 12 SER N 1 1 7 4870 1 1 12 SER O O 2.075 2.753 -5.107 1.00 . A A . 12 SER O 1 1 7 4871 1 1 12 SER OG O 3.405 4.269 -8.219 1.00 . A A . 12 SER OG 1 1 7 4872 1 1 13 LEU C C 0.100 4.803 -6.067 1.00 . A A . 13 LEU C 1 1 7 4873 1 1 13 LEU CA C 1.299 5.443 -5.393 1.00 . A A . 13 LEU CA 1 1 7 4874 1 1 13 LEU CB C 1.475 6.948 -5.736 1.00 . A A . 13 LEU CB 1 1 7 4875 1 1 13 LEU CD1 C -0.034 7.817 -3.978 1.00 . A A . 13 LEU CD1 1 1 7 4876 1 1 13 LEU CD2 C 0.440 9.187 -5.946 1.00 . A A . 13 LEU CD2 1 1 7 4877 1 1 13 LEU CG C 0.202 7.759 -5.472 1.00 . A A . 13 LEU CG 1 1 7 4878 1 1 13 LEU H H 3.140 5.248 -6.510 1.00 . A A . 13 LEU H 1 1 7 4879 1 1 13 LEU HA H 1.187 5.234 -4.337 1.00 . A A . 13 LEU HA 1 1 7 4880 1 1 13 LEU HB2 H 2.267 7.341 -5.121 1.00 . A A . 13 LEU HB2 1 1 7 4881 1 1 13 LEU HB3 H 1.773 7.062 -6.768 1.00 . A A . 13 LEU HB3 1 1 7 4882 1 1 13 LEU HD11 H -0.155 6.817 -3.592 1.00 . A A . 13 LEU HD11 1 1 7 4883 1 1 13 LEU HD12 H 0.786 8.295 -3.463 1.00 . A A . 13 LEU HD12 1 1 7 4884 1 1 13 LEU HD13 H -0.943 8.366 -3.766 1.00 . A A . 13 LEU HD13 1 1 7 4885 1 1 13 LEU HD21 H 0.671 9.214 -7.001 1.00 . A A . 13 LEU HD21 1 1 7 4886 1 1 13 LEU HD22 H -0.452 9.775 -5.775 1.00 . A A . 13 LEU HD22 1 1 7 4887 1 1 13 LEU HD23 H 1.252 9.639 -5.395 1.00 . A A . 13 LEU HD23 1 1 7 4888 1 1 13 LEU HG H -0.668 7.335 -5.966 1.00 . A A . 13 LEU HG 1 1 7 4889 1 1 13 LEU N N 2.509 4.756 -5.946 1.00 . A A . 13 LEU N 1 1 7 4890 1 1 13 LEU O O -0.685 4.115 -5.446 1.00 . A A . 13 LEU O 1 1 7 4891 1 1 14 TYR C C -1.168 2.947 -7.875 1.00 . A A . 14 TYR C 1 1 7 4892 1 1 14 TYR CA C -1.123 4.449 -8.113 1.00 . A A . 14 TYR CA 1 1 7 4893 1 1 14 TYR CB C -0.992 4.730 -9.645 1.00 . A A . 14 TYR CB 1 1 7 4894 1 1 14 TYR CD1 C 1.083 6.107 -9.907 1.00 . A A . 14 TYR CD1 1 1 7 4895 1 1 14 TYR CD2 C 1.149 3.845 -10.641 1.00 . A A . 14 TYR CD2 1 1 7 4896 1 1 14 TYR CE1 C 2.398 6.267 -10.283 1.00 . A A . 14 TYR CE1 1 1 7 4897 1 1 14 TYR CE2 C 2.467 4.015 -11.016 1.00 . A A . 14 TYR CE2 1 1 7 4898 1 1 14 TYR CG C 0.456 4.893 -10.084 1.00 . A A . 14 TYR CG 1 1 7 4899 1 1 14 TYR CZ C 3.084 5.222 -10.833 1.00 . A A . 14 TYR CZ 1 1 7 4900 1 1 14 TYR H H 0.725 5.568 -7.763 1.00 . A A . 14 TYR H 1 1 7 4901 1 1 14 TYR HA H -2.052 4.849 -7.725 1.00 . A A . 14 TYR HA 1 1 7 4902 1 1 14 TYR HB2 H -1.435 3.903 -10.190 1.00 . A A . 14 TYR HB2 1 1 7 4903 1 1 14 TYR HB3 H -1.548 5.620 -9.892 1.00 . A A . 14 TYR HB3 1 1 7 4904 1 1 14 TYR HD1 H 0.535 6.933 -9.474 1.00 . A A . 14 TYR HD1 1 1 7 4905 1 1 14 TYR HD2 H 0.662 2.890 -10.784 1.00 . A A . 14 TYR HD2 1 1 7 4906 1 1 14 TYR HE1 H 2.903 7.213 -10.150 1.00 . A A . 14 TYR HE1 1 1 7 4907 1 1 14 TYR HE2 H 3.027 3.203 -11.456 1.00 . A A . 14 TYR HE2 1 1 7 4908 1 1 14 TYR HH H 4.403 5.711 -12.079 1.00 . A A . 14 TYR HH 1 1 7 4909 1 1 14 TYR N N 0.021 5.033 -7.348 1.00 . A A . 14 TYR N 1 1 7 4910 1 1 14 TYR O O -2.225 2.369 -8.042 1.00 . A A . 14 TYR O 1 1 7 4911 1 1 14 TYR OH O 4.400 5.377 -11.178 1.00 . A A . 14 TYR OH 1 1 7 4912 1 1 15 GLN C C -0.825 0.644 -5.882 1.00 . A A . 15 GLN C 1 1 7 4913 1 1 15 GLN CA C -0.292 0.852 -7.302 1.00 . A A . 15 GLN CA 1 1 7 4914 1 1 15 GLN CB C 1.054 0.159 -7.690 1.00 . A A . 15 GLN CB 1 1 7 4915 1 1 15 GLN CD C 3.247 -0.800 -7.256 1.00 . A A . 15 GLN CD 1 1 7 4916 1 1 15 GLN CG C 2.110 -0.035 -6.604 1.00 . A A . 15 GLN CG 1 1 7 4917 1 1 15 GLN H H 0.814 2.769 -7.371 1.00 . A A . 15 GLN H 1 1 7 4918 1 1 15 GLN HA H -1.086 0.507 -7.891 1.00 . A A . 15 GLN HA 1 1 7 4919 1 1 15 GLN HB2 H 0.779 -0.811 -8.085 1.00 . A A . 15 GLN HB2 1 1 7 4920 1 1 15 GLN HB3 H 1.478 0.706 -8.519 1.00 . A A . 15 GLN HB3 1 1 7 4921 1 1 15 GLN HE21 H 2.439 -2.529 -6.910 1.00 . A A . 15 GLN HE21 1 1 7 4922 1 1 15 GLN HE22 H 3.960 -2.562 -7.692 1.00 . A A . 15 GLN HE22 1 1 7 4923 1 1 15 GLN HG2 H 2.489 0.895 -6.240 1.00 . A A . 15 GLN HG2 1 1 7 4924 1 1 15 GLN HG3 H 1.741 -0.617 -5.776 1.00 . A A . 15 GLN HG3 1 1 7 4925 1 1 15 GLN N N -0.068 2.315 -7.502 1.00 . A A . 15 GLN N 1 1 7 4926 1 1 15 GLN NE2 N 3.218 -2.076 -7.291 1.00 . A A . 15 GLN NE2 1 1 7 4927 1 1 15 GLN O O -1.799 -0.058 -5.717 1.00 . A A . 15 GLN O 1 1 7 4928 1 1 15 GLN OE1 O 4.194 -0.244 -7.757 1.00 . A A . 15 GLN OE1 1 1 7 4929 1 1 16 LEU C C -2.275 1.240 -3.538 1.00 . A A . 16 LEU C 1 1 7 4930 1 1 16 LEU CA C -0.736 1.086 -3.477 1.00 . A A . 16 LEU CA 1 1 7 4931 1 1 16 LEU CB C -0.101 2.181 -2.525 1.00 . A A . 16 LEU CB 1 1 7 4932 1 1 16 LEU CD1 C 1.731 2.691 -0.859 1.00 . A A . 16 LEU CD1 1 1 7 4933 1 1 16 LEU CD2 C 1.202 0.341 -1.243 1.00 . A A . 16 LEU CD2 1 1 7 4934 1 1 16 LEU CG C 1.279 1.722 -1.950 1.00 . A A . 16 LEU CG 1 1 7 4935 1 1 16 LEU H H 0.526 1.755 -5.146 1.00 . A A . 16 LEU H 1 1 7 4936 1 1 16 LEU HA H -0.534 0.093 -3.156 1.00 . A A . 16 LEU HA 1 1 7 4937 1 1 16 LEU HB2 H 0.034 3.097 -3.089 1.00 . A A . 16 LEU HB2 1 1 7 4938 1 1 16 LEU HB3 H -0.779 2.406 -1.712 1.00 . A A . 16 LEU HB3 1 1 7 4939 1 1 16 LEU HD11 H 1.848 3.690 -1.248 1.00 . A A . 16 LEU HD11 1 1 7 4940 1 1 16 LEU HD12 H 1.017 2.711 -0.048 1.00 . A A . 16 LEU HD12 1 1 7 4941 1 1 16 LEU HD13 H 2.683 2.373 -0.453 1.00 . A A . 16 LEU HD13 1 1 7 4942 1 1 16 LEU HD21 H 0.490 0.366 -0.432 1.00 . A A . 16 LEU HD21 1 1 7 4943 1 1 16 LEU HD22 H 0.926 -0.453 -1.917 1.00 . A A . 16 LEU HD22 1 1 7 4944 1 1 16 LEU HD23 H 2.161 0.083 -0.817 1.00 . A A . 16 LEU HD23 1 1 7 4945 1 1 16 LEU HG H 2.003 1.728 -2.754 1.00 . A A . 16 LEU HG 1 1 7 4946 1 1 16 LEU N N -0.234 1.234 -4.893 1.00 . A A . 16 LEU N 1 1 7 4947 1 1 16 LEU O O -3.000 0.482 -2.924 1.00 . A A . 16 LEU O 1 1 7 4948 1 1 17 GLU C C -4.955 1.190 -4.691 1.00 . A A . 17 GLU C 1 1 7 4949 1 1 17 GLU CA C -4.184 2.506 -4.471 1.00 . A A . 17 GLU CA 1 1 7 4950 1 1 17 GLU CB C -4.359 3.407 -5.688 1.00 . A A . 17 GLU CB 1 1 7 4951 1 1 17 GLU CD C -4.742 5.651 -4.477 1.00 . A A . 17 GLU CD 1 1 7 4952 1 1 17 GLU CG C -3.813 4.805 -5.355 1.00 . A A . 17 GLU CG 1 1 7 4953 1 1 17 GLU H H -2.040 2.809 -4.726 1.00 . A A . 17 GLU H 1 1 7 4954 1 1 17 GLU HA H -4.582 2.958 -3.581 1.00 . A A . 17 GLU HA 1 1 7 4955 1 1 17 GLU HB2 H -3.844 2.997 -6.542 1.00 . A A . 17 GLU HB2 1 1 7 4956 1 1 17 GLU HB3 H -5.411 3.495 -5.929 1.00 . A A . 17 GLU HB3 1 1 7 4957 1 1 17 GLU HG2 H -2.882 4.704 -4.821 1.00 . A A . 17 GLU HG2 1 1 7 4958 1 1 17 GLU HG3 H -3.625 5.348 -6.262 1.00 . A A . 17 GLU HG3 1 1 7 4959 1 1 17 GLU N N -2.706 2.230 -4.282 1.00 . A A . 17 GLU N 1 1 7 4960 1 1 17 GLU O O -5.874 0.831 -3.982 1.00 . A A . 17 GLU O 1 1 7 4961 1 1 17 GLU OE1 O -5.682 5.132 -3.901 1.00 . A A . 17 GLU OE1 1 1 7 4962 1 1 17 GLU OE2 O -4.440 6.820 -4.425 1.00 . A A . 17 GLU OE2 1 1 7 4963 1 1 18 ASN C C -5.394 -1.714 -4.864 1.00 . A A . 18 ASN C 1 1 7 4964 1 1 18 ASN CA C -5.116 -0.822 -6.115 1.00 . A A . 18 ASN CA 1 1 7 4965 1 1 18 ASN CB C -4.083 -1.415 -7.127 1.00 . A A . 18 ASN CB 1 1 7 4966 1 1 18 ASN CG C -4.451 -2.771 -7.697 1.00 . A A . 18 ASN CG 1 1 7 4967 1 1 18 ASN H H -3.774 0.884 -6.211 1.00 . A A . 18 ASN H 1 1 7 4968 1 1 18 ASN HA H -6.071 -0.644 -6.590 1.00 . A A . 18 ASN HA 1 1 7 4969 1 1 18 ASN HB2 H -3.957 -0.738 -7.961 1.00 . A A . 18 ASN HB2 1 1 7 4970 1 1 18 ASN HB3 H -3.120 -1.525 -6.664 1.00 . A A . 18 ASN HB3 1 1 7 4971 1 1 18 ASN HD21 H -6.087 -3.090 -6.625 1.00 . A A . 18 ASN HD21 1 1 7 4972 1 1 18 ASN HD22 H -5.635 -4.286 -7.752 1.00 . A A . 18 ASN HD22 1 1 7 4973 1 1 18 ASN N N -4.525 0.499 -5.711 1.00 . A A . 18 ASN N 1 1 7 4974 1 1 18 ASN ND2 N -5.485 -3.429 -7.315 1.00 . A A . 18 ASN ND2 1 1 7 4975 1 1 18 ASN O O -6.347 -2.467 -4.837 1.00 . A A . 18 ASN O 1 1 7 4976 1 1 18 ASN OD1 O -3.779 -3.303 -8.545 1.00 . A A . 18 ASN OD1 1 1 7 4977 1 1 19 TYR C C -4.761 -1.475 -1.326 1.00 . A A . 19 TYR C 1 1 7 4978 1 1 19 TYR CA C -4.669 -2.384 -2.594 1.00 . A A . 19 TYR CA 1 1 7 4979 1 1 19 TYR CB C -3.432 -3.352 -2.490 1.00 . A A . 19 TYR CB 1 1 7 4980 1 1 19 TYR CD1 C -2.513 -3.639 -4.822 1.00 . A A . 19 TYR CD1 1 1 7 4981 1 1 19 TYR CD2 C -1.291 -2.296 -3.294 1.00 . A A . 19 TYR CD2 1 1 7 4982 1 1 19 TYR CE1 C -1.559 -3.397 -5.791 1.00 . A A . 19 TYR CE1 1 1 7 4983 1 1 19 TYR CE2 C -0.341 -2.061 -4.268 1.00 . A A . 19 TYR CE2 1 1 7 4984 1 1 19 TYR CG C -2.378 -3.087 -3.567 1.00 . A A . 19 TYR CG 1 1 7 4985 1 1 19 TYR CZ C -0.476 -2.611 -5.509 1.00 . A A . 19 TYR CZ 1 1 7 4986 1 1 19 TYR H H -3.802 -0.967 -4.007 1.00 . A A . 19 TYR H 1 1 7 4987 1 1 19 TYR HA H -5.576 -2.970 -2.620 1.00 . A A . 19 TYR HA 1 1 7 4988 1 1 19 TYR HB2 H -2.958 -3.196 -1.532 1.00 . A A . 19 TYR HB2 1 1 7 4989 1 1 19 TYR HB3 H -3.705 -4.396 -2.538 1.00 . A A . 19 TYR HB3 1 1 7 4990 1 1 19 TYR HD1 H -3.370 -4.260 -5.037 1.00 . A A . 19 TYR HD1 1 1 7 4991 1 1 19 TYR HD2 H -1.197 -1.857 -2.312 1.00 . A A . 19 TYR HD2 1 1 7 4992 1 1 19 TYR HE1 H -1.667 -3.808 -6.783 1.00 . A A . 19 TYR HE1 1 1 7 4993 1 1 19 TYR HE2 H 0.514 -1.435 -4.070 1.00 . A A . 19 TYR HE2 1 1 7 4994 1 1 19 TYR HH H 0.599 -3.226 -6.908 1.00 . A A . 19 TYR HH 1 1 7 4995 1 1 19 TYR N N -4.545 -1.598 -3.881 1.00 . A A . 19 TYR N 1 1 7 4996 1 1 19 TYR O O -4.405 -1.866 -0.232 1.00 . A A . 19 TYR O 1 1 7 4997 1 1 19 TYR OH O 0.479 -2.378 -6.463 1.00 . A A . 19 TYR OH 1 1 7 4998 1 1 20 CYS C C -6.868 0.738 0.113 1.00 . A A . 20 CYS C 1 1 7 4999 1 1 20 CYS CA C -5.427 0.722 -0.421 1.00 . A A . 20 CYS CA 1 1 7 5000 1 1 20 CYS CB C -4.982 2.067 -1.013 1.00 . A A . 20 CYS CB 1 1 7 5001 1 1 20 CYS H H -5.534 -0.057 -2.426 1.00 . A A . 20 CYS H 1 1 7 5002 1 1 20 CYS HA H -4.778 0.558 0.404 1.00 . A A . 20 CYS HA 1 1 7 5003 1 1 20 CYS HB2 H -3.926 2.000 -1.236 1.00 . A A . 20 CYS HB2 1 1 7 5004 1 1 20 CYS HB3 H -5.516 2.295 -1.911 1.00 . A A . 20 CYS HB3 1 1 7 5005 1 1 20 CYS HG H -4.208 3.749 0.308 1.00 . A A . 20 CYS HG 1 1 7 5006 1 1 20 CYS N N -5.262 -0.288 -1.517 1.00 . A A . 20 CYS N 1 1 7 5007 1 1 20 CYS O O -7.385 -0.303 0.467 1.00 . A A . 20 CYS O 1 1 7 5008 1 1 20 CYS SG S -5.096 3.524 0.027 1.00 . A A . 20 CYS SG 1 1 7 5009 1 1 21 ASN C C -9.701 2.601 -0.408 1.00 . A A . 21 ASN C 1 1 7 5010 1 1 21 ASN CA C -8.898 1.911 0.694 1.00 . A A . 21 ASN CA 1 1 7 5011 1 1 21 ASN CB C -8.799 2.685 2.061 1.00 . A A . 21 ASN CB 1 1 7 5012 1 1 21 ASN CG C -7.704 2.056 2.913 1.00 . A A . 21 ASN CG 1 1 7 5013 1 1 21 ASN H H -7.107 2.712 -0.102 1.00 . A A . 21 ASN H 1 1 7 5014 1 1 21 ASN HA H -9.298 0.915 0.781 1.00 . A A . 21 ASN HA 1 1 7 5015 1 1 21 ASN HB2 H -8.537 3.713 1.890 1.00 . A A . 21 ASN HB2 1 1 7 5016 1 1 21 ASN HB3 H -9.697 2.650 2.644 1.00 . A A . 21 ASN HB3 1 1 7 5017 1 1 21 ASN HD21 H -6.967 3.741 3.645 1.00 . A A . 21 ASN HD21 1 1 7 5018 1 1 21 ASN HD22 H -6.230 2.283 4.129 1.00 . A A . 21 ASN HD22 1 1 7 5019 1 1 21 ASN N N -7.509 1.866 0.183 1.00 . A A . 21 ASN N 1 1 7 5020 1 1 21 ASN ND2 N -6.906 2.769 3.618 1.00 . A A . 21 ASN ND2 1 1 7 5021 1 1 21 ASN O O -9.231 3.603 -0.904 1.00 . A A . 21 ASN O 1 1 7 5022 1 1 21 ASN OD1 O -7.536 0.866 2.967 1.00 . A A . 21 ASN OD1 1 1 7 5023 2 2 1 PHE C C 6.380 7.044 -4.107 1.00 . B B . 1 PHE C 1 1 7 5024 2 2 1 PHE CA C 5.828 8.478 -3.881 1.00 . B B . 1 PHE CA 1 1 7 5025 2 2 1 PHE CB C 4.318 8.558 -4.188 1.00 . B B . 1 PHE CB 1 1 7 5026 2 2 1 PHE CD1 C 3.604 9.949 -2.211 1.00 . B B . 1 PHE CD1 1 1 7 5027 2 2 1 PHE CD2 C 3.370 10.899 -4.375 1.00 . B B . 1 PHE CD2 1 1 7 5028 2 2 1 PHE CE1 C 3.094 11.097 -1.645 1.00 . B B . 1 PHE CE1 1 1 7 5029 2 2 1 PHE CE2 C 2.858 12.050 -3.813 1.00 . B B . 1 PHE CE2 1 1 7 5030 2 2 1 PHE CG C 3.745 9.841 -3.579 1.00 . B B . 1 PHE CG 1 1 7 5031 2 2 1 PHE CZ C 2.721 12.150 -2.446 1.00 . B B . 1 PHE CZ 1 1 7 5032 2 2 1 PHE HA H 5.986 8.701 -2.836 1.00 . B B . 1 PHE HA 1 1 7 5033 2 2 1 PHE HB2 H 4.152 8.559 -5.255 1.00 . B B . 1 PHE HB2 1 1 7 5034 2 2 1 PHE HB3 H 3.806 7.714 -3.749 1.00 . B B . 1 PHE HB3 1 1 7 5035 2 2 1 PHE HD1 H 3.894 9.125 -1.574 1.00 . B B . 1 PHE HD1 1 1 7 5036 2 2 1 PHE HD2 H 3.476 10.828 -5.447 1.00 . B B . 1 PHE HD2 1 1 7 5037 2 2 1 PHE HE1 H 2.987 11.173 -0.570 1.00 . B B . 1 PHE HE1 1 1 7 5038 2 2 1 PHE HE2 H 2.564 12.879 -4.444 1.00 . B B . 1 PHE HE2 1 1 7 5039 2 2 1 PHE HZ H 2.319 13.051 -2.005 1.00 . B B . 1 PHE HZ 1 1 7 5040 2 2 1 PHE N N 6.481 9.555 -4.693 1.00 . B B . 1 PHE N 1 1 7 5041 2 2 1 PHE O O 5.701 6.127 -4.534 1.00 . B B . 1 PHE O 1 1 7 5042 2 2 2 VAL C C 8.347 4.902 -2.550 1.00 . B B . 2 VAL C 1 1 7 5043 2 2 2 VAL CA C 8.389 5.641 -3.911 1.00 . B B . 2 VAL CA 1 1 7 5044 2 2 2 VAL CB C 9.850 5.981 -4.361 1.00 . B B . 2 VAL CB 1 1 7 5045 2 2 2 VAL CG1 C 9.802 6.536 -5.793 1.00 . B B . 2 VAL CG1 1 1 7 5046 2 2 2 VAL CG2 C 10.497 7.085 -3.492 1.00 . B B . 2 VAL CG2 1 1 7 5047 2 2 2 VAL H H 8.116 7.676 -3.469 1.00 . B B . 2 VAL H 1 1 7 5048 2 2 2 VAL HA H 7.887 5.073 -4.650 1.00 . B B . 2 VAL HA 1 1 7 5049 2 2 2 VAL HB H 10.441 5.075 -4.333 1.00 . B B . 2 VAL HB 1 1 7 5050 2 2 2 VAL HG11 H 9.196 7.429 -5.841 1.00 . B B . 2 VAL HG11 1 1 7 5051 2 2 2 VAL HG12 H 10.797 6.784 -6.134 1.00 . B B . 2 VAL HG12 1 1 7 5052 2 2 2 VAL HG13 H 9.383 5.806 -6.471 1.00 . B B . 2 VAL HG13 1 1 7 5053 2 2 2 VAL HG21 H 10.540 6.788 -2.455 1.00 . B B . 2 VAL HG21 1 1 7 5054 2 2 2 VAL HG22 H 11.508 7.271 -3.828 1.00 . B B . 2 VAL HG22 1 1 7 5055 2 2 2 VAL HG23 H 9.952 8.015 -3.562 1.00 . B B . 2 VAL HG23 1 1 7 5056 2 2 2 VAL N N 7.635 6.912 -3.791 1.00 . B B . 2 VAL N 1 1 7 5057 2 2 2 VAL O O 9.165 5.052 -1.662 1.00 . B B . 2 VAL O 1 1 7 5058 2 2 3 ASN C C 8.015 2.028 -1.114 1.00 . B B . 3 ASN C 1 1 7 5059 2 2 3 ASN CA C 7.092 3.266 -1.209 1.00 . B B . 3 ASN CA 1 1 7 5060 2 2 3 ASN CB C 5.595 2.880 -1.282 1.00 . B B . 3 ASN CB 1 1 7 5061 2 2 3 ASN CG C 4.768 4.098 -1.622 1.00 . B B . 3 ASN CG 1 1 7 5062 2 2 3 ASN H H 6.750 3.978 -3.211 1.00 . B B . 3 ASN H 1 1 7 5063 2 2 3 ASN HA H 7.268 3.878 -0.334 1.00 . B B . 3 ASN HA 1 1 7 5064 2 2 3 ASN HB2 H 5.430 2.140 -2.046 1.00 . B B . 3 ASN HB2 1 1 7 5065 2 2 3 ASN HB3 H 5.241 2.497 -0.341 1.00 . B B . 3 ASN HB3 1 1 7 5066 2 2 3 ASN HD21 H 4.787 3.690 -3.537 1.00 . B B . 3 ASN HD21 1 1 7 5067 2 2 3 ASN HD22 H 3.934 5.089 -3.064 1.00 . B B . 3 ASN HD22 1 1 7 5068 2 2 3 ASN N N 7.350 4.081 -2.443 1.00 . B B . 3 ASN N 1 1 7 5069 2 2 3 ASN ND2 N 4.471 4.306 -2.850 1.00 . B B . 3 ASN ND2 1 1 7 5070 2 2 3 ASN O O 7.797 1.064 -1.815 1.00 . B B . 3 ASN O 1 1 7 5071 2 2 3 ASN OD1 O 4.379 4.892 -0.801 1.00 . B B . 3 ASN OD1 1 1 7 5072 2 2 4 GLN C C 9.392 -0.009 0.989 1.00 . B B . 4 GLN C 1 1 7 5073 2 2 4 GLN CA C 9.951 0.941 -0.105 1.00 . B B . 4 GLN CA 1 1 7 5074 2 2 4 GLN CB C 11.349 1.491 0.342 1.00 . B B . 4 GLN CB 1 1 7 5075 2 2 4 GLN CD C 12.001 2.798 -1.761 1.00 . B B . 4 GLN CD 1 1 7 5076 2 2 4 GLN CG C 11.751 2.875 -0.275 1.00 . B B . 4 GLN CG 1 1 7 5077 2 2 4 GLN H H 9.170 2.849 0.277 1.00 . B B . 4 GLN H 1 1 7 5078 2 2 4 GLN HA H 10.030 0.375 -1.022 1.00 . B B . 4 GLN HA 1 1 7 5079 2 2 4 GLN HB2 H 11.396 1.551 1.420 1.00 . B B . 4 GLN HB2 1 1 7 5080 2 2 4 GLN HB3 H 12.095 0.771 0.017 1.00 . B B . 4 GLN HB3 1 1 7 5081 2 2 4 GLN HE21 H 10.813 4.303 -2.194 1.00 . B B . 4 GLN HE21 1 1 7 5082 2 2 4 GLN HE22 H 11.624 3.532 -3.493 1.00 . B B . 4 GLN HE22 1 1 7 5083 2 2 4 GLN HG2 H 10.996 3.626 -0.109 1.00 . B B . 4 GLN HG2 1 1 7 5084 2 2 4 GLN HG3 H 12.673 3.217 0.168 1.00 . B B . 4 GLN HG3 1 1 7 5085 2 2 4 GLN N N 9.009 2.075 -0.271 1.00 . B B . 4 GLN N 1 1 7 5086 2 2 4 GLN NE2 N 11.421 3.624 -2.545 1.00 . B B . 4 GLN NE2 1 1 7 5087 2 2 4 GLN O O 8.250 0.038 1.387 1.00 . B B . 4 GLN O 1 1 7 5088 2 2 4 GLN OE1 O 12.741 1.985 -2.255 1.00 . B B . 4 GLN OE1 1 1 7 5089 2 2 5 HIS C C 9.351 -1.547 3.786 1.00 . B B . 5 HIS C 1 1 7 5090 2 2 5 HIS CA C 10.118 -1.901 2.458 1.00 . B B . 5 HIS CA 1 1 7 5091 2 2 5 HIS CB C 11.568 -2.421 2.748 1.00 . B B . 5 HIS CB 1 1 7 5092 2 2 5 HIS CD2 C 13.730 -2.183 1.244 1.00 . B B . 5 HIS CD2 1 1 7 5093 2 2 5 HIS CE1 C 12.863 -2.570 -0.596 1.00 . B B . 5 HIS CE1 1 1 7 5094 2 2 5 HIS CG C 12.392 -2.421 1.462 1.00 . B B . 5 HIS CG 1 1 7 5095 2 2 5 HIS H H 11.149 -0.702 0.969 1.00 . B B . 5 HIS H 1 1 7 5096 2 2 5 HIS HA H 9.555 -2.708 2.013 1.00 . B B . 5 HIS HA 1 1 7 5097 2 2 5 HIS HB2 H 12.056 -1.782 3.471 1.00 . B B . 5 HIS HB2 1 1 7 5098 2 2 5 HIS HB3 H 11.542 -3.428 3.140 1.00 . B B . 5 HIS HB3 1 1 7 5099 2 2 5 HIS HD1 H 10.969 -2.860 0.096 1.00 . B B . 5 HIS HD1 1 1 7 5100 2 2 5 HIS HD2 H 14.448 -1.954 2.015 1.00 . B B . 5 HIS HD2 1 1 7 5101 2 2 5 HIS HE1 H 12.737 -2.718 -1.662 1.00 . B B . 5 HIS HE1 1 1 7 5102 2 2 5 HIS N N 10.288 -0.831 1.407 1.00 . B B . 5 HIS N 1 1 7 5103 2 2 5 HIS ND1 N 11.916 -2.653 0.289 1.00 . B B . 5 HIS ND1 1 1 7 5104 2 2 5 HIS NE2 N 14.011 -2.278 -0.040 1.00 . B B . 5 HIS NE2 1 1 7 5105 2 2 5 HIS O O 9.907 -1.540 4.869 1.00 . B B . 5 HIS O 1 1 7 5106 2 2 6 LEU C C 6.129 -2.024 5.026 1.00 . B B . 6 LEU C 1 1 7 5107 2 2 6 LEU CA C 7.209 -0.912 4.844 1.00 . B B . 6 LEU CA 1 1 7 5108 2 2 6 LEU CB C 6.638 0.519 4.523 1.00 . B B . 6 LEU CB 1 1 7 5109 2 2 6 LEU CD1 C 4.402 0.434 3.427 1.00 . B B . 6 LEU CD1 1 1 7 5110 2 2 6 LEU CD2 C 6.075 2.020 2.627 1.00 . B B . 6 LEU CD2 1 1 7 5111 2 2 6 LEU CG C 5.879 0.615 3.186 1.00 . B B . 6 LEU CG 1 1 7 5112 2 2 6 LEU H H 7.723 -1.291 2.761 1.00 . B B . 6 LEU H 1 1 7 5113 2 2 6 LEU HA H 7.809 -0.859 5.742 1.00 . B B . 6 LEU HA 1 1 7 5114 2 2 6 LEU HB2 H 5.969 0.827 5.310 1.00 . B B . 6 LEU HB2 1 1 7 5115 2 2 6 LEU HB3 H 7.469 1.210 4.512 1.00 . B B . 6 LEU HB3 1 1 7 5116 2 2 6 LEU HD11 H 4.040 1.201 4.099 1.00 . B B . 6 LEU HD11 1 1 7 5117 2 2 6 LEU HD12 H 3.866 0.505 2.493 1.00 . B B . 6 LEU HD12 1 1 7 5118 2 2 6 LEU HD13 H 4.214 -0.535 3.862 1.00 . B B . 6 LEU HD13 1 1 7 5119 2 2 6 LEU HD21 H 5.712 2.761 3.325 1.00 . B B . 6 LEU HD21 1 1 7 5120 2 2 6 LEU HD22 H 7.125 2.192 2.442 1.00 . B B . 6 LEU HD22 1 1 7 5121 2 2 6 LEU HD23 H 5.538 2.121 1.699 1.00 . B B . 6 LEU HD23 1 1 7 5122 2 2 6 LEU HG H 6.228 -0.128 2.478 1.00 . B B . 6 LEU HG 1 1 7 5123 2 2 6 LEU N N 8.087 -1.265 3.672 1.00 . B B . 6 LEU N 1 1 7 5124 2 2 6 LEU O O 5.518 -2.475 4.077 1.00 . B B . 6 LEU O 1 1 7 5125 2 2 7 CYS C C 3.541 -3.281 7.234 1.00 . B B . 7 CYS C 1 1 7 5126 2 2 7 CYS CA C 4.862 -3.553 6.451 1.00 . B B . 7 CYS CA 1 1 7 5127 2 2 7 CYS CB C 5.665 -4.711 7.085 1.00 . B B . 7 CYS CB 1 1 7 5128 2 2 7 CYS H H 6.382 -2.064 6.981 1.00 . B B . 7 CYS H 1 1 7 5129 2 2 7 CYS HA H 4.532 -3.901 5.484 1.00 . B B . 7 CYS HA 1 1 7 5130 2 2 7 CYS HB2 H 6.633 -4.754 6.602 1.00 . B B . 7 CYS HB2 1 1 7 5131 2 2 7 CYS HB3 H 5.837 -4.504 8.131 1.00 . B B . 7 CYS HB3 1 1 7 5132 2 2 7 CYS HG H 4.454 -6.553 7.755 1.00 . B B . 7 CYS HG 1 1 7 5133 2 2 7 CYS N N 5.889 -2.460 6.240 1.00 . B B . 7 CYS N 1 1 7 5134 2 2 7 CYS O O 3.311 -2.222 7.775 1.00 . B B . 7 CYS O 1 1 7 5135 2 2 7 CYS SG S 4.945 -6.367 6.951 1.00 . B B . 7 CYS SG 1 1 7 5136 2 2 8 GLY C C 0.657 -3.061 8.258 1.00 . B B . 8 GLY C 1 1 7 5137 2 2 8 GLY CA C 1.361 -4.366 7.916 1.00 . B B . 8 GLY CA 1 1 7 5138 2 2 8 GLY H H 3.043 -5.103 6.801 1.00 . B B . 8 GLY H 1 1 7 5139 2 2 8 GLY HA2 H 0.684 -4.915 7.281 1.00 . B B . 8 GLY HA2 1 1 7 5140 2 2 8 GLY HA3 H 1.453 -4.905 8.849 1.00 . B B . 8 GLY HA3 1 1 7 5141 2 2 8 GLY N N 2.727 -4.305 7.254 1.00 . B B . 8 GLY N 1 1 7 5142 2 2 8 GLY O O -0.050 -2.482 7.456 1.00 . B B . 8 GLY O 1 1 7 5143 2 2 9 ASP C C 0.853 -0.163 9.171 1.00 . B B . 9 ASP C 1 1 7 5144 2 2 9 ASP CA C 0.273 -1.369 9.952 1.00 . B B . 9 ASP CA 1 1 7 5145 2 2 9 ASP CB C 0.606 -1.413 11.459 1.00 . B B . 9 ASP CB 1 1 7 5146 2 2 9 ASP CG C 0.258 -2.791 11.974 1.00 . B B . 9 ASP CG 1 1 7 5147 2 2 9 ASP H H 1.470 -3.164 10.023 1.00 . B B . 9 ASP H 1 1 7 5148 2 2 9 ASP HA H -0.801 -1.398 9.753 1.00 . B B . 9 ASP HA 1 1 7 5149 2 2 9 ASP HB2 H 1.648 -1.235 11.664 1.00 . B B . 9 ASP HB2 1 1 7 5150 2 2 9 ASP HB3 H 0.006 -0.710 12.011 1.00 . B B . 9 ASP HB3 1 1 7 5151 2 2 9 ASP N N 0.884 -2.632 9.441 1.00 . B B . 9 ASP N 1 1 7 5152 2 2 9 ASP O O 0.151 0.646 8.609 1.00 . B B . 9 ASP O 1 1 7 5153 2 2 9 ASP OD1 O -0.902 -2.975 12.272 1.00 . B B . 9 ASP OD1 1 1 7 5154 2 2 9 ASP OD2 O 1.207 -3.554 12.004 1.00 . B B . 9 ASP OD2 1 1 7 5155 2 2 10 HIS C C 2.323 1.018 6.904 1.00 . B B . 10 HIS C 1 1 7 5156 2 2 10 HIS CA C 2.814 1.064 8.392 1.00 . B B . 10 HIS CA 1 1 7 5157 2 2 10 HIS CB C 4.310 0.805 8.605 1.00 . B B . 10 HIS CB 1 1 7 5158 2 2 10 HIS CD2 C 6.392 1.985 7.500 1.00 . B B . 10 HIS CD2 1 1 7 5159 2 2 10 HIS CE1 C 5.836 3.950 7.802 1.00 . B B . 10 HIS CE1 1 1 7 5160 2 2 10 HIS CG C 5.173 1.972 8.142 1.00 . B B . 10 HIS CG 1 1 7 5161 2 2 10 HIS H H 2.640 -0.777 9.594 1.00 . B B . 10 HIS H 1 1 7 5162 2 2 10 HIS HA H 2.503 2.013 8.813 1.00 . B B . 10 HIS HA 1 1 7 5163 2 2 10 HIS HB2 H 4.479 0.663 9.661 1.00 . B B . 10 HIS HB2 1 1 7 5164 2 2 10 HIS HB3 H 4.596 -0.083 8.066 1.00 . B B . 10 HIS HB3 1 1 7 5165 2 2 10 HIS HD1 H 4.068 3.584 8.731 1.00 . B B . 10 HIS HD1 1 1 7 5166 2 2 10 HIS HD2 H 6.946 1.109 7.211 1.00 . B B . 10 HIS HD2 1 1 7 5167 2 2 10 HIS HE1 H 5.830 5.033 7.808 1.00 . B B . 10 HIS HE1 1 1 7 5168 2 2 10 HIS N N 2.145 -0.072 9.131 1.00 . B B . 10 HIS N 1 1 7 5169 2 2 10 HIS ND1 N 4.888 3.217 8.298 1.00 . B B . 10 HIS ND1 1 1 7 5170 2 2 10 HIS NE2 N 6.794 3.223 7.294 1.00 . B B . 10 HIS NE2 1 1 7 5171 2 2 10 HIS O O 2.140 1.989 6.199 1.00 . B B . 10 HIS O 1 1 7 5172 2 2 11 LEU C C 0.197 0.203 4.966 1.00 . B B . 11 LEU C 1 1 7 5173 2 2 11 LEU CA C 1.614 -0.397 5.050 1.00 . B B . 11 LEU CA 1 1 7 5174 2 2 11 LEU CB C 1.666 -1.925 4.793 1.00 . B B . 11 LEU CB 1 1 7 5175 2 2 11 LEU CD1 C 1.976 -1.626 2.325 1.00 . B B . 11 LEU CD1 1 1 7 5176 2 2 11 LEU CD2 C 1.270 -3.800 3.263 1.00 . B B . 11 LEU CD2 1 1 7 5177 2 2 11 LEU CG C 1.121 -2.292 3.410 1.00 . B B . 11 LEU CG 1 1 7 5178 2 2 11 LEU H H 2.264 -0.922 7.063 1.00 . B B . 11 LEU H 1 1 7 5179 2 2 11 LEU HA H 2.223 0.163 4.365 1.00 . B B . 11 LEU HA 1 1 7 5180 2 2 11 LEU HB2 H 2.697 -2.243 4.855 1.00 . B B . 11 LEU HB2 1 1 7 5181 2 2 11 LEU HB3 H 1.101 -2.452 5.542 1.00 . B B . 11 LEU HB3 1 1 7 5182 2 2 11 LEU HD11 H 3.013 -1.922 2.422 1.00 . B B . 11 LEU HD11 1 1 7 5183 2 2 11 LEU HD12 H 1.632 -1.902 1.342 1.00 . B B . 11 LEU HD12 1 1 7 5184 2 2 11 LEU HD13 H 1.918 -0.551 2.403 1.00 . B B . 11 LEU HD13 1 1 7 5185 2 2 11 LEU HD21 H 0.722 -4.304 4.045 1.00 . B B . 11 LEU HD21 1 1 7 5186 2 2 11 LEU HD22 H 0.887 -4.122 2.309 1.00 . B B . 11 LEU HD22 1 1 7 5187 2 2 11 LEU HD23 H 2.311 -4.079 3.330 1.00 . B B . 11 LEU HD23 1 1 7 5188 2 2 11 LEU HG H 0.079 -1.997 3.323 1.00 . B B . 11 LEU HG 1 1 7 5189 2 2 11 LEU N N 2.100 -0.183 6.449 1.00 . B B . 11 LEU N 1 1 7 5190 2 2 11 LEU O O -0.045 1.068 4.144 1.00 . B B . 11 LEU O 1 1 7 5191 2 2 12 VAL C C -1.923 1.916 5.869 1.00 . B B . 12 VAL C 1 1 7 5192 2 2 12 VAL CA C -2.092 0.404 5.668 1.00 . B B . 12 VAL CA 1 1 7 5193 2 2 12 VAL CB C -3.093 -0.121 6.733 1.00 . B B . 12 VAL CB 1 1 7 5194 2 2 12 VAL CG1 C -2.513 0.039 8.121 1.00 . B B . 12 VAL CG1 1 1 7 5195 2 2 12 VAL CG2 C -4.349 0.776 6.649 1.00 . B B . 12 VAL CG2 1 1 7 5196 2 2 12 VAL H H -0.528 -0.943 6.423 1.00 . B B . 12 VAL H 1 1 7 5197 2 2 12 VAL HA H -2.471 0.259 4.675 1.00 . B B . 12 VAL HA 1 1 7 5198 2 2 12 VAL HB H -3.340 -1.158 6.539 1.00 . B B . 12 VAL HB 1 1 7 5199 2 2 12 VAL HG11 H -2.259 1.065 8.355 1.00 . B B . 12 VAL HG11 1 1 7 5200 2 2 12 VAL HG12 H -3.175 -0.328 8.884 1.00 . B B . 12 VAL HG12 1 1 7 5201 2 2 12 VAL HG13 H -1.611 -0.547 8.142 1.00 . B B . 12 VAL HG13 1 1 7 5202 2 2 12 VAL HG21 H -4.744 0.748 5.642 1.00 . B B . 12 VAL HG21 1 1 7 5203 2 2 12 VAL HG22 H -5.101 0.446 7.343 1.00 . B B . 12 VAL HG22 1 1 7 5204 2 2 12 VAL HG23 H -4.104 1.805 6.881 1.00 . B B . 12 VAL HG23 1 1 7 5205 2 2 12 VAL N N -0.731 -0.232 5.781 1.00 . B B . 12 VAL N 1 1 7 5206 2 2 12 VAL O O -2.545 2.670 5.162 1.00 . B B . 12 VAL O 1 1 7 5207 2 2 13 GLU C C -0.646 4.444 5.708 1.00 . B B . 13 GLU C 1 1 7 5208 2 2 13 GLU CA C -0.878 3.780 7.085 1.00 . B B . 13 GLU CA 1 1 7 5209 2 2 13 GLU CB C 0.343 3.794 8.000 1.00 . B B . 13 GLU CB 1 1 7 5210 2 2 13 GLU CD C 1.732 5.326 9.524 1.00 . B B . 13 GLU CD 1 1 7 5211 2 2 13 GLU CG C 0.448 5.146 8.710 1.00 . B B . 13 GLU CG 1 1 7 5212 2 2 13 GLU H H -0.660 1.710 7.392 1.00 . B B . 13 GLU H 1 1 7 5213 2 2 13 GLU HA H -1.736 4.240 7.550 1.00 . B B . 13 GLU HA 1 1 7 5214 2 2 13 GLU HB2 H 0.281 3.016 8.748 1.00 . B B . 13 GLU HB2 1 1 7 5215 2 2 13 GLU HB3 H 1.250 3.644 7.435 1.00 . B B . 13 GLU HB3 1 1 7 5216 2 2 13 GLU HG2 H 0.416 5.941 7.989 1.00 . B B . 13 GLU HG2 1 1 7 5217 2 2 13 GLU HG3 H -0.376 5.243 9.396 1.00 . B B . 13 GLU HG3 1 1 7 5218 2 2 13 GLU N N -1.129 2.337 6.813 1.00 . B B . 13 GLU N 1 1 7 5219 2 2 13 GLU O O -1.259 5.425 5.323 1.00 . B B . 13 GLU O 1 1 7 5220 2 2 13 GLU OE1 O 2.600 4.470 9.451 1.00 . B B . 13 GLU OE1 1 1 7 5221 2 2 13 GLU OE2 O 1.753 6.349 10.178 1.00 . B B . 13 GLU OE2 1 1 7 5222 2 2 14 ALA C C -0.705 4.404 2.794 1.00 . B B . 14 ALA C 1 1 7 5223 2 2 14 ALA CA C 0.570 4.368 3.622 1.00 . B B . 14 ALA CA 1 1 7 5224 2 2 14 ALA CB C 1.685 3.441 3.038 1.00 . B B . 14 ALA CB 1 1 7 5225 2 2 14 ALA H H 0.702 3.045 5.308 1.00 . B B . 14 ALA H 1 1 7 5226 2 2 14 ALA HA H 0.799 5.393 3.781 1.00 . B B . 14 ALA HA 1 1 7 5227 2 2 14 ALA HB1 H 2.544 3.447 3.694 1.00 . B B . 14 ALA HB1 1 1 7 5228 2 2 14 ALA HB2 H 1.337 2.422 2.955 1.00 . B B . 14 ALA HB2 1 1 7 5229 2 2 14 ALA HB3 H 1.991 3.778 2.058 1.00 . B B . 14 ALA HB3 1 1 7 5230 2 2 14 ALA N N 0.249 3.843 4.967 1.00 . B B . 14 ALA N 1 1 7 5231 2 2 14 ALA O O -1.055 5.426 2.237 1.00 . B B . 14 ALA O 1 1 7 5232 2 2 15 LEU C C -3.462 4.475 2.400 1.00 . B B . 15 LEU C 1 1 7 5233 2 2 15 LEU CA C -2.642 3.237 1.948 1.00 . B B . 15 LEU CA 1 1 7 5234 2 2 15 LEU CB C -3.354 1.905 2.287 1.00 . B B . 15 LEU CB 1 1 7 5235 2 2 15 LEU CD1 C -3.239 -0.570 2.294 1.00 . B B . 15 LEU CD1 1 1 7 5236 2 2 15 LEU CD2 C -2.057 0.668 0.482 1.00 . B B . 15 LEU CD2 1 1 7 5237 2 2 15 LEU CG C -2.459 0.698 1.964 1.00 . B B . 15 LEU CG 1 1 7 5238 2 2 15 LEU H H -1.014 2.504 3.174 1.00 . B B . 15 LEU H 1 1 7 5239 2 2 15 LEU HA H -2.435 3.342 0.892 1.00 . B B . 15 LEU HA 1 1 7 5240 2 2 15 LEU HB2 H -3.588 1.874 3.339 1.00 . B B . 15 LEU HB2 1 1 7 5241 2 2 15 LEU HB3 H -4.288 1.849 1.761 1.00 . B B . 15 LEU HB3 1 1 7 5242 2 2 15 LEU HD11 H -3.551 -0.604 3.324 1.00 . B B . 15 LEU HD11 1 1 7 5243 2 2 15 LEU HD12 H -4.123 -0.686 1.696 1.00 . B B . 15 LEU HD12 1 1 7 5244 2 2 15 LEU HD13 H -2.607 -1.419 2.116 1.00 . B B . 15 LEU HD13 1 1 7 5245 2 2 15 LEU HD21 H -1.507 1.556 0.219 1.00 . B B . 15 LEU HD21 1 1 7 5246 2 2 15 LEU HD22 H -1.425 -0.177 0.289 1.00 . B B . 15 LEU HD22 1 1 7 5247 2 2 15 LEU HD23 H -2.901 0.576 -0.177 1.00 . B B . 15 LEU HD23 1 1 7 5248 2 2 15 LEU HG H -1.559 0.713 2.560 1.00 . B B . 15 LEU HG 1 1 7 5249 2 2 15 LEU N N -1.371 3.289 2.718 1.00 . B B . 15 LEU N 1 1 7 5250 2 2 15 LEU O O -3.821 5.292 1.596 1.00 . B B . 15 LEU O 1 1 7 5251 2 2 16 TYR C C -4.095 7.096 3.611 1.00 . B B . 16 TYR C 1 1 7 5252 2 2 16 TYR CA C -4.507 5.740 4.247 1.00 . B B . 16 TYR CA 1 1 7 5253 2 2 16 TYR CB C -4.263 5.725 5.780 1.00 . B B . 16 TYR CB 1 1 7 5254 2 2 16 TYR CD1 C -6.188 7.327 6.144 1.00 . B B . 16 TYR CD1 1 1 7 5255 2 2 16 TYR CD2 C -6.144 5.319 7.415 1.00 . B B . 16 TYR CD2 1 1 7 5256 2 2 16 TYR CE1 C -7.370 7.685 6.757 1.00 . B B . 16 TYR CE1 1 1 7 5257 2 2 16 TYR CE2 C -7.330 5.688 8.024 1.00 . B B . 16 TYR CE2 1 1 7 5258 2 2 16 TYR CG C -5.567 6.139 6.469 1.00 . B B . 16 TYR CG 1 1 7 5259 2 2 16 TYR CZ C -7.937 6.869 7.691 1.00 . B B . 16 TYR CZ 1 1 7 5260 2 2 16 TYR H H -3.371 3.896 4.240 1.00 . B B . 16 TYR H 1 1 7 5261 2 2 16 TYR HA H -5.552 5.604 4.016 1.00 . B B . 16 TYR HA 1 1 7 5262 2 2 16 TYR HB2 H -3.966 4.740 6.111 1.00 . B B . 16 TYR HB2 1 1 7 5263 2 2 16 TYR HB3 H -3.483 6.421 6.059 1.00 . B B . 16 TYR HB3 1 1 7 5264 2 2 16 TYR HD1 H -5.747 7.986 5.407 1.00 . B B . 16 TYR HD1 1 1 7 5265 2 2 16 TYR HD2 H -5.662 4.386 7.680 1.00 . B B . 16 TYR HD2 1 1 7 5266 2 2 16 TYR HE1 H -7.852 8.618 6.501 1.00 . B B . 16 TYR HE1 1 1 7 5267 2 2 16 TYR HE2 H -7.785 5.051 8.769 1.00 . B B . 16 TYR HE2 1 1 7 5268 2 2 16 TYR HH H -8.845 7.605 9.136 1.00 . B B . 16 TYR HH 1 1 7 5269 2 2 16 TYR N N -3.727 4.595 3.667 1.00 . B B . 16 TYR N 1 1 7 5270 2 2 16 TYR O O -4.939 7.832 3.142 1.00 . B B . 16 TYR O 1 1 7 5271 2 2 16 TYR OH O -9.118 7.238 8.282 1.00 . B B . 16 TYR OH 1 1 7 5272 2 2 17 LEU C C -2.516 8.704 1.522 1.00 . B B . 17 LEU C 1 1 7 5273 2 2 17 LEU CA C -2.254 8.634 3.055 1.00 . B B . 17 LEU CA 1 1 7 5274 2 2 17 LEU CB C -0.720 8.662 3.368 1.00 . B B . 17 LEU CB 1 1 7 5275 2 2 17 LEU CD1 C -0.729 10.778 4.748 1.00 . B B . 17 LEU CD1 1 1 7 5276 2 2 17 LEU CD2 C -1.121 8.623 5.878 1.00 . B B . 17 LEU CD2 1 1 7 5277 2 2 17 LEU CG C -0.358 9.294 4.742 1.00 . B B . 17 LEU CG 1 1 7 5278 2 2 17 LEU H H -2.234 6.703 4.076 1.00 . B B . 17 LEU H 1 1 7 5279 2 2 17 LEU HA H -2.769 9.479 3.485 1.00 . B B . 17 LEU HA 1 1 7 5280 2 2 17 LEU HB2 H -0.353 7.646 3.349 1.00 . B B . 17 LEU HB2 1 1 7 5281 2 2 17 LEU HB3 H -0.212 9.209 2.587 1.00 . B B . 17 LEU HB3 1 1 7 5282 2 2 17 LEU HD11 H -0.202 11.299 3.962 1.00 . B B . 17 LEU HD11 1 1 7 5283 2 2 17 LEU HD12 H -1.789 10.916 4.598 1.00 . B B . 17 LEU HD12 1 1 7 5284 2 2 17 LEU HD13 H -0.460 11.222 5.695 1.00 . B B . 17 LEU HD13 1 1 7 5285 2 2 17 LEU HD21 H -2.188 8.715 5.742 1.00 . B B . 17 LEU HD21 1 1 7 5286 2 2 17 LEU HD22 H -0.867 7.576 5.926 1.00 . B B . 17 LEU HD22 1 1 7 5287 2 2 17 LEU HD23 H -0.856 9.067 6.826 1.00 . B B . 17 LEU HD23 1 1 7 5288 2 2 17 LEU HG H 0.707 9.183 4.914 1.00 . B B . 17 LEU HG 1 1 7 5289 2 2 17 LEU N N -2.818 7.363 3.643 1.00 . B B . 17 LEU N 1 1 7 5290 2 2 17 LEU O O -2.715 9.761 0.959 1.00 . B B . 17 LEU O 1 1 7 5291 2 2 18 VAL C C -4.217 7.308 -1.030 1.00 . B B . 18 VAL C 1 1 7 5292 2 2 18 VAL CA C -2.714 7.369 -0.563 1.00 . B B . 18 VAL CA 1 1 7 5293 2 2 18 VAL CB C -1.932 6.068 -0.935 1.00 . B B . 18 VAL CB 1 1 7 5294 2 2 18 VAL CG1 C -2.257 5.602 -2.359 1.00 . B B . 18 VAL CG1 1 1 7 5295 2 2 18 VAL CG2 C -0.422 6.318 -0.831 1.00 . B B . 18 VAL CG2 1 1 7 5296 2 2 18 VAL H H -2.265 6.773 1.490 1.00 . B B . 18 VAL H 1 1 7 5297 2 2 18 VAL HA H -2.270 8.191 -1.102 1.00 . B B . 18 VAL HA 1 1 7 5298 2 2 18 VAL HB H -2.209 5.294 -0.233 1.00 . B B . 18 VAL HB 1 1 7 5299 2 2 18 VAL HG11 H -2.098 6.390 -3.078 1.00 . B B . 18 VAL HG11 1 1 7 5300 2 2 18 VAL HG12 H -1.675 4.742 -2.647 1.00 . B B . 18 VAL HG12 1 1 7 5301 2 2 18 VAL HG13 H -3.302 5.330 -2.432 1.00 . B B . 18 VAL HG13 1 1 7 5302 2 2 18 VAL HG21 H -0.130 7.128 -1.481 1.00 . B B . 18 VAL HG21 1 1 7 5303 2 2 18 VAL HG22 H -0.163 6.585 0.184 1.00 . B B . 18 VAL HG22 1 1 7 5304 2 2 18 VAL HG23 H 0.127 5.429 -1.106 1.00 . B B . 18 VAL HG23 1 1 7 5305 2 2 18 VAL N N -2.479 7.548 0.923 1.00 . B B . 18 VAL N 1 1 7 5306 2 2 18 VAL O O -4.706 8.187 -1.709 1.00 . B B . 18 VAL O 1 1 7 5307 2 2 19 CYS C C -7.302 6.967 -1.617 1.00 . B B . 19 CYS C 1 1 7 5308 2 2 19 CYS CA C -6.337 5.957 -0.922 1.00 . B B . 19 CYS CA 1 1 7 5309 2 2 19 CYS CB C -6.975 5.512 0.412 1.00 . B B . 19 CYS CB 1 1 7 5310 2 2 19 CYS H H -4.444 5.645 -0.029 1.00 . B B . 19 CYS H 1 1 7 5311 2 2 19 CYS HA H -6.293 5.192 -1.672 1.00 . B B . 19 CYS HA 1 1 7 5312 2 2 19 CYS HB2 H -7.022 6.396 1.022 1.00 . B B . 19 CYS HB2 1 1 7 5313 2 2 19 CYS HB3 H -7.963 5.184 0.158 1.00 . B B . 19 CYS HB3 1 1 7 5314 2 2 19 CYS HG H -5.687 4.633 2.086 1.00 . B B . 19 CYS HG 1 1 7 5315 2 2 19 CYS N N -4.891 6.273 -0.618 1.00 . B B . 19 CYS N 1 1 7 5316 2 2 19 CYS O O -8.309 7.332 -1.033 1.00 . B B . 19 CYS O 1 1 7 5317 2 2 19 CYS SG S -6.246 4.214 1.429 1.00 . B B . 19 CYS SG 1 1 7 5318 2 2 20 GLY C C -9.447 7.949 -3.420 1.00 . B B . 20 GLY C 1 1 7 5319 2 2 20 GLY CA C -7.959 8.377 -3.523 1.00 . B B . 20 GLY CA 1 1 7 5320 2 2 20 GLY H H -6.184 7.081 -3.235 1.00 . B B . 20 GLY H 1 1 7 5321 2 2 20 GLY HA2 H -7.862 9.357 -3.083 1.00 . B B . 20 GLY HA2 1 1 7 5322 2 2 20 GLY HA3 H -7.702 8.421 -4.570 1.00 . B B . 20 GLY HA3 1 1 7 5323 2 2 20 GLY N N -7.024 7.403 -2.814 1.00 . B B . 20 GLY N 1 1 7 5324 2 2 20 GLY O O -10.356 8.747 -3.322 1.00 . B B . 20 GLY O 1 1 7 5325 2 2 21 GLU C C -11.116 5.324 -1.924 1.00 . B B . 21 GLU C 1 1 7 5326 2 2 21 GLU CA C -10.847 5.845 -3.349 1.00 . B B . 21 GLU CA 1 1 7 5327 2 2 21 GLU CB C -10.695 4.644 -4.190 1.00 . B B . 21 GLU CB 1 1 7 5328 2 2 21 GLU CD C -11.556 5.723 -6.379 1.00 . B B . 21 GLU CD 1 1 7 5329 2 2 21 GLU CG C -10.419 4.970 -5.702 1.00 . B B . 21 GLU CG 1 1 7 5330 2 2 21 GLU H H -8.728 6.170 -3.480 1.00 . B B . 21 GLU H 1 1 7 5331 2 2 21 GLU HA H -11.689 6.437 -3.685 1.00 . B B . 21 GLU HA 1 1 7 5332 2 2 21 GLU HB2 H -9.868 4.116 -3.712 1.00 . B B . 21 GLU HB2 1 1 7 5333 2 2 21 GLU HB3 H -11.593 4.067 -4.028 1.00 . B B . 21 GLU HB3 1 1 7 5334 2 2 21 GLU HG2 H -9.528 5.567 -5.809 1.00 . B B . 21 GLU HG2 1 1 7 5335 2 2 21 GLU HG3 H -10.288 4.061 -6.262 1.00 . B B . 21 GLU HG3 1 1 7 5336 2 2 21 GLU N N -9.570 6.654 -3.424 1.00 . B B . 21 GLU N 1 1 7 5337 2 2 21 GLU O O -11.753 4.310 -1.710 1.00 . B B . 21 GLU O 1 1 7 5338 2 2 21 GLU OE1 O -12.635 5.160 -6.390 1.00 . B B . 21 GLU OE1 1 1 7 5339 2 2 21 GLU OE2 O -11.262 6.808 -6.846 1.00 . B B . 21 GLU OE2 1 1 7 5340 2 2 22 ARG C C -11.910 4.824 1.192 1.00 . B B . 22 ARG C 1 1 7 5341 2 2 22 ARG CA C -10.758 5.697 0.499 1.00 . B B . 22 ARG CA 1 1 7 5342 2 2 22 ARG CB C -10.544 7.119 1.126 1.00 . B B . 22 ARG CB 1 1 7 5343 2 2 22 ARG CD C -9.901 5.977 3.231 1.00 . B B . 22 ARG CD 1 1 7 5344 2 2 22 ARG CG C -10.705 7.157 2.649 1.00 . B B . 22 ARG CG 1 1 7 5345 2 2 22 ARG CZ C -11.218 6.300 5.321 1.00 . B B . 22 ARG CZ 1 1 7 5346 2 2 22 ARG H H -10.187 6.870 -1.226 1.00 . B B . 22 ARG H 1 1 7 5347 2 2 22 ARG HA H -9.963 5.012 0.641 1.00 . B B . 22 ARG HA 1 1 7 5348 2 2 22 ARG HB2 H -9.532 7.416 0.877 1.00 . B B . 22 ARG HB2 1 1 7 5349 2 2 22 ARG HB3 H -11.214 7.812 0.641 1.00 . B B . 22 ARG HB3 1 1 7 5350 2 2 22 ARG HD2 H -10.154 5.064 2.697 1.00 . B B . 22 ARG HD2 1 1 7 5351 2 2 22 ARG HD3 H -8.853 6.156 2.993 1.00 . B B . 22 ARG HD3 1 1 7 5352 2 2 22 ARG HE H -9.609 5.281 5.300 1.00 . B B . 22 ARG HE 1 1 7 5353 2 2 22 ARG HG2 H -10.275 8.085 3.007 1.00 . B B . 22 ARG HG2 1 1 7 5354 2 2 22 ARG HG3 H -11.757 7.184 2.880 1.00 . B B . 22 ARG HG3 1 1 7 5355 2 2 22 ARG HH11 H -12.382 5.721 3.908 1.00 . B B . 22 ARG HH11 1 1 7 5356 2 2 22 ARG HH12 H -13.174 6.521 5.214 1.00 . B B . 22 ARG HH12 1 1 7 5357 2 2 22 ARG HH21 H -10.202 6.982 6.869 1.00 . B B . 22 ARG HH21 1 1 7 5358 2 2 22 ARG HH22 H -11.878 7.279 6.866 1.00 . B B . 22 ARG HH22 1 1 7 5359 2 2 22 ARG N N -10.634 6.036 -0.971 1.00 . B B . 22 ARG N 1 1 7 5360 2 2 22 ARG NE N -10.205 5.803 4.722 1.00 . B B . 22 ARG NE 1 1 7 5361 2 2 22 ARG NH1 N -12.348 6.180 4.793 1.00 . B B . 22 ARG NH1 1 1 7 5362 2 2 22 ARG NH2 N -11.087 6.889 6.420 1.00 . B B . 22 ARG NH2 1 1 7 5363 2 2 22 ARG O O -12.513 5.168 2.191 1.00 . B B . 22 ARG O 1 1 7 5364 2 2 23 GLY C C -12.512 1.259 1.383 1.00 . B B . 23 GLY C 1 1 7 5365 2 2 23 GLY CA C -13.170 2.642 1.120 1.00 . B B . 23 GLY CA 1 1 7 5366 2 2 23 GLY H H -11.627 3.456 -0.157 1.00 . B B . 23 GLY H 1 1 7 5367 2 2 23 GLY HA2 H -13.655 2.970 2.027 1.00 . B B . 23 GLY HA2 1 1 7 5368 2 2 23 GLY HA3 H -13.920 2.499 0.353 1.00 . B B . 23 GLY HA3 1 1 7 5369 2 2 23 GLY N N -12.148 3.662 0.644 1.00 . B B . 23 GLY N 1 1 7 5370 2 2 23 GLY O O -12.906 0.279 0.803 1.00 . B B . 23 GLY O 1 1 7 5371 2 2 24 PHE C C -10.805 -1.326 1.855 1.00 . B B . 24 PHE C 1 1 7 5372 2 2 24 PHE CA C -10.733 0.008 2.665 1.00 . B B . 24 PHE CA 1 1 7 5373 2 2 24 PHE CB C -11.096 -0.258 4.153 1.00 . B B . 24 PHE CB 1 1 7 5374 2 2 24 PHE CD1 C -9.050 0.721 5.327 1.00 . B B . 24 PHE CD1 1 1 7 5375 2 2 24 PHE CD2 C -11.122 1.846 5.551 1.00 . B B . 24 PHE CD2 1 1 7 5376 2 2 24 PHE CE1 C -8.447 1.684 6.111 1.00 . B B . 24 PHE CE1 1 1 7 5377 2 2 24 PHE CE2 C -10.528 2.811 6.337 1.00 . B B . 24 PHE CE2 1 1 7 5378 2 2 24 PHE CG C -10.400 0.795 5.037 1.00 . B B . 24 PHE CG 1 1 7 5379 2 2 24 PHE CZ C -9.184 2.729 6.617 1.00 . B B . 24 PHE CZ 1 1 7 5380 2 2 24 PHE H H -11.312 2.103 2.647 1.00 . B B . 24 PHE H 1 1 7 5381 2 2 24 PHE HA H -9.691 0.266 2.673 1.00 . B B . 24 PHE HA 1 1 7 5382 2 2 24 PHE HB2 H -12.165 -0.211 4.296 1.00 . B B . 24 PHE HB2 1 1 7 5383 2 2 24 PHE HB3 H -10.759 -1.240 4.459 1.00 . B B . 24 PHE HB3 1 1 7 5384 2 2 24 PHE HD1 H -8.443 -0.095 4.943 1.00 . B B . 24 PHE HD1 1 1 7 5385 2 2 24 PHE HD2 H -12.173 1.900 5.334 1.00 . B B . 24 PHE HD2 1 1 7 5386 2 2 24 PHE HE1 H -7.391 1.608 6.331 1.00 . B B . 24 PHE HE1 1 1 7 5387 2 2 24 PHE HE2 H -11.119 3.623 6.737 1.00 . B B . 24 PHE HE2 1 1 7 5388 2 2 24 PHE HZ H -8.703 3.473 7.235 1.00 . B B . 24 PHE HZ 1 1 7 5389 2 2 24 PHE N N -11.531 1.244 2.250 1.00 . B B . 24 PHE N 1 1 7 5390 2 2 24 PHE O O -11.733 -2.101 1.943 1.00 . B B . 24 PHE O 1 1 7 5391 2 2 25 PHE C C -8.563 -3.722 0.827 1.00 . B B . 25 PHE C 1 1 7 5392 2 2 25 PHE CA C -9.631 -2.769 0.222 1.00 . B B . 25 PHE CA 1 1 7 5393 2 2 25 PHE CB C -9.193 -2.330 -1.211 1.00 . B B . 25 PHE CB 1 1 7 5394 2 2 25 PHE CD1 C -11.214 -0.787 -1.458 1.00 . B B . 25 PHE CD1 1 1 7 5395 2 2 25 PHE CD2 C -9.157 -0.128 -2.445 1.00 . B B . 25 PHE CD2 1 1 7 5396 2 2 25 PHE CE1 C -11.808 0.363 -1.933 1.00 . B B . 25 PHE CE1 1 1 7 5397 2 2 25 PHE CE2 C -9.749 1.024 -2.921 1.00 . B B . 25 PHE CE2 1 1 7 5398 2 2 25 PHE CG C -9.883 -1.047 -1.709 1.00 . B B . 25 PHE CG 1 1 7 5399 2 2 25 PHE CZ C -11.079 1.270 -2.664 1.00 . B B . 25 PHE CZ 1 1 7 5400 2 2 25 PHE H H -9.037 -0.898 1.063 1.00 . B B . 25 PHE H 1 1 7 5401 2 2 25 PHE HA H -10.569 -3.310 0.197 1.00 . B B . 25 PHE HA 1 1 7 5402 2 2 25 PHE HB2 H -8.126 -2.164 -1.238 1.00 . B B . 25 PHE HB2 1 1 7 5403 2 2 25 PHE HB3 H -9.430 -3.116 -1.912 1.00 . B B . 25 PHE HB3 1 1 7 5404 2 2 25 PHE HD1 H -11.802 -1.490 -0.882 1.00 . B B . 25 PHE HD1 1 1 7 5405 2 2 25 PHE HD2 H -8.113 -0.308 -2.654 1.00 . B B . 25 PHE HD2 1 1 7 5406 2 2 25 PHE HE1 H -12.855 0.549 -1.725 1.00 . B B . 25 PHE HE1 1 1 7 5407 2 2 25 PHE HE2 H -9.171 1.736 -3.501 1.00 . B B . 25 PHE HE2 1 1 7 5408 2 2 25 PHE HZ H -11.547 2.171 -3.040 1.00 . B B . 25 PHE HZ 1 1 7 5409 2 2 25 PHE N N -9.767 -1.546 1.088 1.00 . B B . 25 PHE N 1 1 7 5410 2 2 25 PHE O O -8.745 -4.920 0.902 1.00 . B B . 25 PHE O 1 1 7 5411 2 2 26 TYR C C -6.306 -5.329 2.129 1.00 . B B . 26 TYR C 1 1 7 5412 2 2 26 TYR CA C -6.260 -3.783 1.848 1.00 . B B . 26 TYR CA 1 1 7 5413 2 2 26 TYR CB C -6.013 -2.943 3.138 1.00 . B B . 26 TYR CB 1 1 7 5414 2 2 26 TYR CD1 C -3.538 -3.508 3.244 1.00 . B B . 26 TYR CD1 1 1 7 5415 2 2 26 TYR CD2 C -4.784 -3.580 5.262 1.00 . B B . 26 TYR CD2 1 1 7 5416 2 2 26 TYR CE1 C -2.399 -3.862 3.947 1.00 . B B . 26 TYR CE1 1 1 7 5417 2 2 26 TYR CE2 C -3.637 -3.933 5.954 1.00 . B B . 26 TYR CE2 1 1 7 5418 2 2 26 TYR CG C -4.741 -3.362 3.898 1.00 . B B . 26 TYR CG 1 1 7 5419 2 2 26 TYR CZ C -2.447 -4.071 5.293 1.00 . B B . 26 TYR CZ 1 1 7 5420 2 2 26 TYR H H -7.454 -2.147 1.077 1.00 . B B . 26 TYR H 1 1 7 5421 2 2 26 TYR HA H -5.422 -3.626 1.183 1.00 . B B . 26 TYR HA 1 1 7 5422 2 2 26 TYR HB2 H -5.922 -1.896 2.884 1.00 . B B . 26 TYR HB2 1 1 7 5423 2 2 26 TYR HB3 H -6.862 -3.056 3.796 1.00 . B B . 26 TYR HB3 1 1 7 5424 2 2 26 TYR HD1 H -3.490 -3.343 2.178 1.00 . B B . 26 TYR HD1 1 1 7 5425 2 2 26 TYR HD2 H -5.723 -3.473 5.786 1.00 . B B . 26 TYR HD2 1 1 7 5426 2 2 26 TYR HE1 H -1.453 -3.982 3.451 1.00 . B B . 26 TYR HE1 1 1 7 5427 2 2 26 TYR HE2 H -3.665 -4.106 7.019 1.00 . B B . 26 TYR HE2 1 1 7 5428 2 2 26 TYR HH H -1.116 -3.641 6.527 1.00 . B B . 26 TYR HH 1 1 7 5429 2 2 26 TYR N N -7.470 -3.119 1.217 1.00 . B B . 26 TYR N 1 1 7 5430 2 2 26 TYR O O -6.174 -5.806 3.239 1.00 . B B . 26 TYR O 1 1 7 5431 2 2 26 TYR OH O -1.299 -4.408 5.967 1.00 . B B . 26 TYR OH 1 1 7 5432 2 2 27 THR C C -5.396 -8.371 0.536 1.00 . B B . 27 THR C 1 1 7 5433 2 2 27 THR CA C -6.554 -7.595 1.215 1.00 . B B . 27 THR CA 1 1 7 5434 2 2 27 THR CB C -7.947 -8.047 0.658 1.00 . B B . 27 THR CB 1 1 7 5435 2 2 27 THR CG2 C -8.190 -7.787 -0.815 1.00 . B B . 27 THR CG2 1 1 7 5436 2 2 27 THR H H -6.590 -5.651 0.223 1.00 . B B . 27 THR H 1 1 7 5437 2 2 27 THR HA H -6.576 -7.874 2.254 1.00 . B B . 27 THR HA 1 1 7 5438 2 2 27 THR HB H -8.742 -7.617 1.265 1.00 . B B . 27 THR HB 1 1 7 5439 2 2 27 THR HG1 H -8.645 -9.675 1.371 1.00 . B B . 27 THR HG1 1 1 7 5440 2 2 27 THR HG21 H -7.481 -8.289 -1.449 1.00 . B B . 27 THR HG21 1 1 7 5441 2 2 27 THR HG22 H -9.182 -8.122 -1.072 1.00 . B B . 27 THR HG22 1 1 7 5442 2 2 27 THR HG23 H -8.133 -6.725 -1.000 1.00 . B B . 27 THR HG23 1 1 7 5443 2 2 27 THR N N -6.487 -6.091 1.090 1.00 . B B . 27 THR N 1 1 7 5444 2 2 27 THR O O -5.514 -8.838 -0.582 1.00 . B B . 27 THR O 1 1 7 5445 2 2 27 THR OG1 O -7.965 -9.471 0.711 1.00 . B B . 27 THR OG1 1 1 7 5446 2 2 28 PRO C C -3.614 -10.586 -0.182 1.00 . B B . 28 PRO C 1 1 7 5447 2 2 28 PRO CA C -3.241 -9.532 0.898 1.00 . B B . 28 PRO CA 1 1 7 5448 2 2 28 PRO CB C -2.935 -10.102 2.285 1.00 . B B . 28 PRO CB 1 1 7 5449 2 2 28 PRO CD C -4.019 -7.952 2.609 1.00 . B B . 28 PRO CD 1 1 7 5450 2 2 28 PRO CG C -2.834 -8.799 3.111 1.00 . B B . 28 PRO CG 1 1 7 5451 2 2 28 PRO HA H -2.355 -9.030 0.534 1.00 . B B . 28 PRO HA 1 1 7 5452 2 2 28 PRO HB2 H -3.739 -10.738 2.634 1.00 . B B . 28 PRO HB2 1 1 7 5453 2 2 28 PRO HB3 H -2.007 -10.660 2.290 1.00 . B B . 28 PRO HB3 1 1 7 5454 2 2 28 PRO HD2 H -4.879 -8.088 3.247 1.00 . B B . 28 PRO HD2 1 1 7 5455 2 2 28 PRO HD3 H -3.764 -6.902 2.543 1.00 . B B . 28 PRO HD3 1 1 7 5456 2 2 28 PRO HG2 H -2.939 -9.002 4.169 1.00 . B B . 28 PRO HG2 1 1 7 5457 2 2 28 PRO HG3 H -1.902 -8.280 2.942 1.00 . B B . 28 PRO HG3 1 1 7 5458 2 2 28 PRO N N -4.278 -8.482 1.231 1.00 . B B . 28 PRO N 1 1 7 5459 2 2 28 PRO O O -4.088 -11.678 0.075 1.00 . B B . 28 PRO O 1 1 7 5460 2 2 29 LYS C C -2.409 -11.396 -3.399 1.00 . B B . 29 LYS C 1 1 7 5461 2 2 29 LYS CA C -3.712 -11.090 -2.586 1.00 . B B . 29 LYS CA 1 1 7 5462 2 2 29 LYS CB C -4.790 -10.331 -3.435 1.00 . B B . 29 LYS CB 1 1 7 5463 2 2 29 LYS CD C -7.234 -11.177 -3.346 1.00 . B B . 29 LYS CD 1 1 7 5464 2 2 29 LYS CE C -7.370 -11.799 -1.942 1.00 . B B . 29 LYS CE 1 1 7 5465 2 2 29 LYS CG C -5.829 -11.323 -4.037 1.00 . B B . 29 LYS CG 1 1 7 5466 2 2 29 LYS H H -3.044 -9.299 -1.515 1.00 . B B . 29 LYS H 1 1 7 5467 2 2 29 LYS HA H -4.087 -12.046 -2.249 1.00 . B B . 29 LYS HA 1 1 7 5468 2 2 29 LYS HB2 H -5.251 -9.521 -2.888 1.00 . B B . 29 LYS HB2 1 1 7 5469 2 2 29 LYS HB3 H -4.282 -9.858 -4.267 1.00 . B B . 29 LYS HB3 1 1 7 5470 2 2 29 LYS HD2 H -7.486 -10.127 -3.276 1.00 . B B . 29 LYS HD2 1 1 7 5471 2 2 29 LYS HD3 H -7.977 -11.635 -3.988 1.00 . B B . 29 LYS HD3 1 1 7 5472 2 2 29 LYS HE2 H -8.400 -11.716 -1.603 1.00 . B B . 29 LYS HE2 1 1 7 5473 2 2 29 LYS HE3 H -7.114 -12.855 -1.983 1.00 . B B . 29 LYS HE3 1 1 7 5474 2 2 29 LYS HG2 H -5.936 -11.092 -5.091 1.00 . B B . 29 LYS HG2 1 1 7 5475 2 2 29 LYS HG3 H -5.471 -12.345 -3.983 1.00 . B B . 29 LYS HG3 1 1 7 5476 2 2 29 LYS HZ1 H -5.897 -10.368 -1.501 1.00 . B B . 29 LYS HZ1 1 1 7 5477 2 2 29 LYS HZ2 H -6.989 -10.513 -0.308 1.00 . B B . 29 LYS HZ2 1 1 7 5478 2 2 29 LYS HZ3 H -5.797 -11.699 -0.502 1.00 . B B . 29 LYS HZ3 1 1 7 5479 2 2 29 LYS N N -3.409 -10.205 -1.404 1.00 . B B . 29 LYS N 1 1 7 5480 2 2 29 LYS NZ N -6.465 -11.084 -1.010 1.00 . B B . 29 LYS NZ 1 1 7 5481 2 2 29 LYS O O -2.304 -11.043 -4.555 1.00 . B B . 29 LYS O 1 1 7 5482 2 2 30 THR C C 0.967 -12.070 -2.201 1.00 . B B . 30 THR C 1 1 7 5483 2 2 30 THR CA C -0.112 -12.486 -3.206 1.00 . B B . 30 THR CA 1 1 7 5484 2 2 30 THR CB C 0.303 -11.851 -4.562 1.00 . B B . 30 THR CB 1 1 7 5485 2 2 30 THR CG2 C 1.668 -12.297 -5.040 1.00 . B B . 30 THR CG2 1 1 7 5486 2 2 30 THR H H -1.724 -12.248 -1.791 1.00 . B B . 30 THR H 1 1 7 5487 2 2 30 THR HA H -0.087 -13.560 -3.302 1.00 . B B . 30 THR HA 1 1 7 5488 2 2 30 THR HB H 0.133 -10.780 -4.635 1.00 . B B . 30 THR HB 1 1 7 5489 2 2 30 THR HG1 H -1.225 -12.018 -5.708 1.00 . B B . 30 THR HG1 1 1 7 5490 2 2 30 THR HG21 H 1.680 -13.368 -5.177 1.00 . B B . 30 THR HG21 1 1 7 5491 2 2 30 THR HG22 H 1.870 -11.831 -5.991 1.00 . B B . 30 THR HG22 1 1 7 5492 2 2 30 THR HG23 H 2.443 -12.013 -4.345 1.00 . B B . 30 THR HG23 1 1 7 5493 2 2 30 THR N N -1.494 -12.039 -2.718 1.00 . B B . 30 THR N 1 1 7 5494 2 2 30 THR O O 0.749 -12.153 -1.004 1.00 . B B . 30 THR O 1 1 7 5495 2 2 30 THR OG1 O -0.464 -12.579 -5.500 1.00 . B B . 30 THR OG1 1 1 8 5496 1 1 1 GLY C C -2.648 -4.607 0.804 1.00 . A A . 1 GLY C 1 1 8 5497 1 1 1 GLY CA C -3.374 -4.594 2.144 1.00 . A A . 1 GLY CA 1 1 8 5498 1 1 1 GLY HA2 H -4.331 -5.077 2.018 1.00 . A A . 1 GLY HA2 1 1 8 5499 1 1 1 GLY HA3 H -3.541 -3.565 2.421 1.00 . A A . 1 GLY HA3 1 1 8 5500 1 1 1 GLY N N -2.597 -5.278 3.237 1.00 . A A . 1 GLY N 1 1 8 5501 1 1 1 GLY O O -3.172 -4.912 -0.245 1.00 . A A . 1 GLY O 1 1 8 5502 1 1 2 ILE C C 0.727 -5.074 -0.071 1.00 . A A . 2 ILE C 1 1 8 5503 1 1 2 ILE CA C -0.491 -4.200 -0.302 1.00 . A A . 2 ILE CA 1 1 8 5504 1 1 2 ILE CB C -0.110 -2.687 -0.543 1.00 . A A . 2 ILE CB 1 1 8 5505 1 1 2 ILE CD1 C -1.022 -1.485 1.489 1.00 . A A . 2 ILE CD1 1 1 8 5506 1 1 2 ILE CG1 C -1.212 -1.781 -0.005 1.00 . A A . 2 ILE CG1 1 1 8 5507 1 1 2 ILE CG2 C -0.149 -2.446 -2.060 1.00 . A A . 2 ILE CG2 1 1 8 5508 1 1 2 ILE H H -1.101 -4.033 1.790 1.00 . A A . 2 ILE H 1 1 8 5509 1 1 2 ILE HA H -0.923 -4.602 -1.197 1.00 . A A . 2 ILE HA 1 1 8 5510 1 1 2 ILE HB H 0.852 -2.436 -0.124 1.00 . A A . 2 ILE HB 1 1 8 5511 1 1 2 ILE HD11 H -0.918 -2.358 2.106 1.00 . A A . 2 ILE HD11 1 1 8 5512 1 1 2 ILE HD12 H -0.162 -0.853 1.646 1.00 . A A . 2 ILE HD12 1 1 8 5513 1 1 2 ILE HD13 H -1.901 -0.968 1.820 1.00 . A A . 2 ILE HD13 1 1 8 5514 1 1 2 ILE HG12 H -1.280 -0.858 -0.563 1.00 . A A . 2 ILE HG12 1 1 8 5515 1 1 2 ILE HG13 H -2.134 -2.315 -0.143 1.00 . A A . 2 ILE HG13 1 1 8 5516 1 1 2 ILE HG21 H -1.133 -2.651 -2.456 1.00 . A A . 2 ILE HG21 1 1 8 5517 1 1 2 ILE HG22 H 0.097 -1.422 -2.282 1.00 . A A . 2 ILE HG22 1 1 8 5518 1 1 2 ILE HG23 H 0.563 -3.075 -2.555 1.00 . A A . 2 ILE HG23 1 1 8 5519 1 1 2 ILE N N -1.409 -4.261 0.894 1.00 . A A . 2 ILE N 1 1 8 5520 1 1 2 ILE O O 1.599 -5.137 -0.902 1.00 . A A . 2 ILE O 1 1 8 5521 1 1 3 VAL C C 2.962 -6.883 0.553 1.00 . A A . 3 VAL C 1 1 8 5522 1 1 3 VAL CA C 1.795 -6.660 1.530 1.00 . A A . 3 VAL CA 1 1 8 5523 1 1 3 VAL CB C 1.059 -8.013 1.900 1.00 . A A . 3 VAL CB 1 1 8 5524 1 1 3 VAL CG1 C 0.012 -7.761 3.002 1.00 . A A . 3 VAL CG1 1 1 8 5525 1 1 3 VAL CG2 C 0.219 -8.533 0.698 1.00 . A A . 3 VAL CG2 1 1 8 5526 1 1 3 VAL H H -0.067 -5.596 1.632 1.00 . A A . 3 VAL H 1 1 8 5527 1 1 3 VAL HA H 2.270 -6.177 2.363 1.00 . A A . 3 VAL HA 1 1 8 5528 1 1 3 VAL HB H 1.766 -8.768 2.233 1.00 . A A . 3 VAL HB 1 1 8 5529 1 1 3 VAL HG11 H 0.472 -7.369 3.894 1.00 . A A . 3 VAL HG11 1 1 8 5530 1 1 3 VAL HG12 H -0.755 -7.070 2.679 1.00 . A A . 3 VAL HG12 1 1 8 5531 1 1 3 VAL HG13 H -0.479 -8.692 3.254 1.00 . A A . 3 VAL HG13 1 1 8 5532 1 1 3 VAL HG21 H 0.781 -8.706 -0.206 1.00 . A A . 3 VAL HG21 1 1 8 5533 1 1 3 VAL HG22 H -0.259 -9.463 0.973 1.00 . A A . 3 VAL HG22 1 1 8 5534 1 1 3 VAL HG23 H -0.545 -7.812 0.472 1.00 . A A . 3 VAL HG23 1 1 8 5535 1 1 3 VAL N N 0.711 -5.726 1.058 1.00 . A A . 3 VAL N 1 1 8 5536 1 1 3 VAL O O 3.734 -5.968 0.348 1.00 . A A . 3 VAL O 1 1 8 5537 1 1 4 GLU C C 4.459 -7.102 -1.814 1.00 . A A . 4 GLU C 1 1 8 5538 1 1 4 GLU CA C 4.170 -8.393 -0.972 1.00 . A A . 4 GLU CA 1 1 8 5539 1 1 4 GLU CB C 3.602 -9.597 -1.769 1.00 . A A . 4 GLU CB 1 1 8 5540 1 1 4 GLU CD C 5.286 -9.251 -3.654 1.00 . A A . 4 GLU CD 1 1 8 5541 1 1 4 GLU CG C 4.696 -10.235 -2.674 1.00 . A A . 4 GLU CG 1 1 8 5542 1 1 4 GLU H H 2.445 -8.758 0.257 1.00 . A A . 4 GLU H 1 1 8 5543 1 1 4 GLU HA H 5.066 -8.663 -0.438 1.00 . A A . 4 GLU HA 1 1 8 5544 1 1 4 GLU HB2 H 3.234 -10.350 -1.086 1.00 . A A . 4 GLU HB2 1 1 8 5545 1 1 4 GLU HB3 H 2.781 -9.280 -2.399 1.00 . A A . 4 GLU HB3 1 1 8 5546 1 1 4 GLU HG2 H 5.502 -10.643 -2.084 1.00 . A A . 4 GLU HG2 1 1 8 5547 1 1 4 GLU HG3 H 4.276 -11.029 -3.269 1.00 . A A . 4 GLU HG3 1 1 8 5548 1 1 4 GLU N N 3.080 -8.064 0.008 1.00 . A A . 4 GLU N 1 1 8 5549 1 1 4 GLU O O 5.491 -6.479 -1.713 1.00 . A A . 4 GLU O 1 1 8 5550 1 1 4 GLU OE1 O 4.503 -8.680 -4.384 1.00 . A A . 4 GLU OE1 1 1 8 5551 1 1 4 GLU OE2 O 6.490 -9.138 -3.590 1.00 . A A . 4 GLU OE2 1 1 8 5552 1 1 5 GLN C C 4.320 -4.277 -2.830 1.00 . A A . 5 GLN C 1 1 8 5553 1 1 5 GLN CA C 3.634 -5.498 -3.485 1.00 . A A . 5 GLN CA 1 1 8 5554 1 1 5 GLN CB C 2.186 -5.037 -3.944 1.00 . A A . 5 GLN CB 1 1 8 5555 1 1 5 GLN CD C -0.316 -5.664 -4.244 1.00 . A A . 5 GLN CD 1 1 8 5556 1 1 5 GLN CG C 1.082 -6.162 -3.873 1.00 . A A . 5 GLN CG 1 1 8 5557 1 1 5 GLN H H 2.733 -7.288 -2.656 1.00 . A A . 5 GLN H 1 1 8 5558 1 1 5 GLN HA H 4.359 -5.718 -4.279 1.00 . A A . 5 GLN HA 1 1 8 5559 1 1 5 GLN HB2 H 1.877 -4.248 -3.273 1.00 . A A . 5 GLN HB2 1 1 8 5560 1 1 5 GLN HB3 H 2.230 -4.624 -4.941 1.00 . A A . 5 GLN HB3 1 1 8 5561 1 1 5 GLN HE21 H 0.210 -3.817 -4.674 1.00 . A A . 5 GLN HE21 1 1 8 5562 1 1 5 GLN HE22 H -1.443 -4.198 -4.842 1.00 . A A . 5 GLN HE22 1 1 8 5563 1 1 5 GLN HG2 H 1.325 -6.985 -4.526 1.00 . A A . 5 GLN HG2 1 1 8 5564 1 1 5 GLN HG3 H 1.004 -6.531 -2.863 1.00 . A A . 5 GLN HG3 1 1 8 5565 1 1 5 GLN N N 3.522 -6.724 -2.620 1.00 . A A . 5 GLN N 1 1 8 5566 1 1 5 GLN NE2 N -0.527 -4.452 -4.618 1.00 . A A . 5 GLN NE2 1 1 8 5567 1 1 5 GLN O O 5.210 -3.704 -3.412 1.00 . A A . 5 GLN O 1 1 8 5568 1 1 5 GLN OE1 O -1.287 -6.384 -4.198 1.00 . A A . 5 GLN OE1 1 1 8 5569 1 1 6 CYS C C 5.693 -2.867 0.017 1.00 . A A . 6 CYS C 1 1 8 5570 1 1 6 CYS CA C 4.649 -2.649 -1.090 1.00 . A A . 6 CYS CA 1 1 8 5571 1 1 6 CYS CB C 3.529 -1.735 -0.672 1.00 . A A . 6 CYS CB 1 1 8 5572 1 1 6 CYS H H 3.199 -4.343 -1.185 1.00 . A A . 6 CYS H 1 1 8 5573 1 1 6 CYS HA H 5.177 -2.121 -1.868 1.00 . A A . 6 CYS HA 1 1 8 5574 1 1 6 CYS HB2 H 2.871 -2.306 -0.047 1.00 . A A . 6 CYS HB2 1 1 8 5575 1 1 6 CYS HB3 H 3.930 -0.901 -0.117 1.00 . A A . 6 CYS HB3 1 1 8 5576 1 1 6 CYS HG H 3.033 -0.277 -2.344 1.00 . A A . 6 CYS HG 1 1 8 5577 1 1 6 CYS N N 3.933 -3.861 -1.657 1.00 . A A . 6 CYS N 1 1 8 5578 1 1 6 CYS O O 6.386 -1.960 0.434 1.00 . A A . 6 CYS O 1 1 8 5579 1 1 6 CYS SG S 2.571 -1.067 -2.049 1.00 . A A . 6 CYS SG 1 1 8 5580 1 1 7 CYS C C 7.870 -5.260 0.789 1.00 . A A . 7 CYS C 1 1 8 5581 1 1 7 CYS CA C 6.751 -4.466 1.520 1.00 . A A . 7 CYS CA 1 1 8 5582 1 1 7 CYS CB C 5.882 -5.253 2.517 1.00 . A A . 7 CYS CB 1 1 8 5583 1 1 7 CYS H H 5.194 -4.768 0.074 1.00 . A A . 7 CYS H 1 1 8 5584 1 1 7 CYS HA H 7.194 -3.592 1.975 1.00 . A A . 7 CYS HA 1 1 8 5585 1 1 7 CYS HB2 H 5.116 -4.552 2.831 1.00 . A A . 7 CYS HB2 1 1 8 5586 1 1 7 CYS HB3 H 5.378 -6.035 1.973 1.00 . A A . 7 CYS HB3 1 1 8 5587 1 1 7 CYS HG H 7.011 -6.813 3.747 1.00 . A A . 7 CYS HG 1 1 8 5588 1 1 7 CYS N N 5.783 -4.080 0.452 1.00 . A A . 7 CYS N 1 1 8 5589 1 1 7 CYS O O 9.048 -5.137 1.056 1.00 . A A . 7 CYS O 1 1 8 5590 1 1 7 CYS SG S 6.637 -5.966 4.002 1.00 . A A . 7 CYS SG 1 1 8 5591 1 1 8 THR C C 8.451 -6.478 -2.505 1.00 . A A . 8 THR C 1 1 8 5592 1 1 8 THR CA C 8.322 -6.926 -1.013 1.00 . A A . 8 THR CA 1 1 8 5593 1 1 8 THR CB C 7.763 -8.343 -0.968 1.00 . A A . 8 THR CB 1 1 8 5594 1 1 8 THR CG2 C 8.765 -9.340 -1.468 1.00 . A A . 8 THR CG2 1 1 8 5595 1 1 8 THR H H 6.473 -6.055 -0.281 1.00 . A A . 8 THR H 1 1 8 5596 1 1 8 THR HA H 9.317 -6.939 -0.597 1.00 . A A . 8 THR HA 1 1 8 5597 1 1 8 THR HB H 6.791 -8.438 -1.425 1.00 . A A . 8 THR HB 1 1 8 5598 1 1 8 THR HG1 H 8.095 -9.546 0.514 1.00 . A A . 8 THR HG1 1 1 8 5599 1 1 8 THR HG21 H 9.667 -9.305 -0.879 1.00 . A A . 8 THR HG21 1 1 8 5600 1 1 8 THR HG22 H 8.322 -10.321 -1.434 1.00 . A A . 8 THR HG22 1 1 8 5601 1 1 8 THR HG23 H 8.989 -9.104 -2.499 1.00 . A A . 8 THR HG23 1 1 8 5602 1 1 8 THR N N 7.436 -6.045 -0.149 1.00 . A A . 8 THR N 1 1 8 5603 1 1 8 THR O O 9.477 -5.928 -2.852 1.00 . A A . 8 THR O 1 1 8 5604 1 1 8 THR OG1 O 7.719 -8.670 0.410 1.00 . A A . 8 THR OG1 1 1 8 5605 1 1 9 SER C C 7.182 -4.766 -5.092 1.00 . A A . 9 SER C 1 1 8 5606 1 1 9 SER CA C 7.647 -6.220 -4.832 1.00 . A A . 9 SER CA 1 1 8 5607 1 1 9 SER CB C 6.853 -7.142 -5.758 1.00 . A A . 9 SER CB 1 1 8 5608 1 1 9 SER H H 6.665 -7.122 -3.096 1.00 . A A . 9 SER H 1 1 8 5609 1 1 9 SER HA H 8.683 -6.283 -5.128 1.00 . A A . 9 SER HA 1 1 8 5610 1 1 9 SER HB2 H 7.159 -8.171 -5.637 1.00 . A A . 9 SER HB2 1 1 8 5611 1 1 9 SER HB3 H 5.791 -7.047 -5.586 1.00 . A A . 9 SER HB3 1 1 8 5612 1 1 9 SER HG H 6.700 -5.853 -7.200 1.00 . A A . 9 SER HG 1 1 8 5613 1 1 9 SER N N 7.492 -6.670 -3.380 1.00 . A A . 9 SER N 1 1 8 5614 1 1 9 SER O O 6.401 -4.423 -5.959 1.00 . A A . 9 SER O 1 1 8 5615 1 1 9 SER OG O 7.221 -6.659 -7.056 1.00 . A A . 9 SER OG 1 1 8 5616 1 1 10 ILE C C 6.732 -1.740 -5.094 1.00 . A A . 10 ILE C 1 1 8 5617 1 1 10 ILE CA C 7.642 -2.491 -4.077 1.00 . A A . 10 ILE CA 1 1 8 5618 1 1 10 ILE CB C 9.098 -1.923 -4.101 1.00 . A A . 10 ILE CB 1 1 8 5619 1 1 10 ILE CD1 C 11.309 -1.966 -2.812 1.00 . A A . 10 ILE CD1 1 1 8 5620 1 1 10 ILE CG1 C 9.856 -2.492 -2.864 1.00 . A A . 10 ILE CG1 1 1 8 5621 1 1 10 ILE CG2 C 9.032 -0.377 -3.950 1.00 . A A . 10 ILE CG2 1 1 8 5622 1 1 10 ILE H H 8.303 -4.516 -3.633 1.00 . A A . 10 ILE H 1 1 8 5623 1 1 10 ILE HA H 7.204 -2.307 -3.112 1.00 . A A . 10 ILE HA 1 1 8 5624 1 1 10 ILE HB H 9.589 -2.205 -5.025 1.00 . A A . 10 ILE HB 1 1 8 5625 1 1 10 ILE HD11 H 11.355 -0.899 -2.815 1.00 . A A . 10 ILE HD11 1 1 8 5626 1 1 10 ILE HD12 H 11.774 -2.299 -1.901 1.00 . A A . 10 ILE HD12 1 1 8 5627 1 1 10 ILE HD13 H 11.874 -2.329 -3.654 1.00 . A A . 10 ILE HD13 1 1 8 5628 1 1 10 ILE HG12 H 9.334 -2.257 -1.948 1.00 . A A . 10 ILE HG12 1 1 8 5629 1 1 10 ILE HG13 H 9.907 -3.570 -2.928 1.00 . A A . 10 ILE HG13 1 1 8 5630 1 1 10 ILE HG21 H 8.451 0.068 -4.742 1.00 . A A . 10 ILE HG21 1 1 8 5631 1 1 10 ILE HG22 H 8.588 -0.107 -3.003 1.00 . A A . 10 ILE HG22 1 1 8 5632 1 1 10 ILE HG23 H 10.020 0.051 -4.006 1.00 . A A . 10 ILE HG23 1 1 8 5633 1 1 10 ILE N N 7.757 -3.995 -4.231 1.00 . A A . 10 ILE N 1 1 8 5634 1 1 10 ILE O O 7.043 -1.465 -6.236 1.00 . A A . 10 ILE O 1 1 8 5635 1 1 11 CYS C C 4.328 0.770 -4.806 1.00 . A A . 11 CYS C 1 1 8 5636 1 1 11 CYS CA C 4.494 -0.711 -5.239 1.00 . A A . 11 CYS CA 1 1 8 5637 1 1 11 CYS CB C 3.219 -1.556 -4.949 1.00 . A A . 11 CYS CB 1 1 8 5638 1 1 11 CYS H H 5.462 -1.672 -3.640 1.00 . A A . 11 CYS H 1 1 8 5639 1 1 11 CYS HA H 4.694 -0.738 -6.299 1.00 . A A . 11 CYS HA 1 1 8 5640 1 1 11 CYS HB2 H 2.836 -1.958 -5.868 1.00 . A A . 11 CYS HB2 1 1 8 5641 1 1 11 CYS HB3 H 3.527 -2.394 -4.343 1.00 . A A . 11 CYS HB3 1 1 8 5642 1 1 11 CYS HG H 1.363 -0.234 -4.619 1.00 . A A . 11 CYS HG 1 1 8 5643 1 1 11 CYS N N 5.595 -1.421 -4.558 1.00 . A A . 11 CYS N 1 1 8 5644 1 1 11 CYS O O 4.044 1.096 -3.674 1.00 . A A . 11 CYS O 1 1 8 5645 1 1 11 CYS SG S 1.848 -0.813 -4.029 1.00 . A A . 11 CYS SG 1 1 8 5646 1 1 12 SER C C 3.227 3.657 -4.864 1.00 . A A . 12 SER C 1 1 8 5647 1 1 12 SER CA C 4.434 3.124 -5.648 1.00 . A A . 12 SER CA 1 1 8 5648 1 1 12 SER CB C 4.412 3.730 -7.069 1.00 . A A . 12 SER CB 1 1 8 5649 1 1 12 SER H H 4.778 1.137 -6.594 1.00 . A A . 12 SER H 1 1 8 5650 1 1 12 SER HA H 5.264 3.490 -5.107 1.00 . A A . 12 SER HA 1 1 8 5651 1 1 12 SER HB2 H 5.406 3.722 -7.501 1.00 . A A . 12 SER HB2 1 1 8 5652 1 1 12 SER HB3 H 3.747 3.171 -7.712 1.00 . A A . 12 SER HB3 1 1 8 5653 1 1 12 SER HG H 4.678 5.693 -6.955 1.00 . A A . 12 SER HG 1 1 8 5654 1 1 12 SER N N 4.539 1.607 -5.771 1.00 . A A . 12 SER N 1 1 8 5655 1 1 12 SER O O 2.244 2.970 -4.732 1.00 . A A . 12 SER O 1 1 8 5656 1 1 12 SER OG O 3.934 5.072 -6.907 1.00 . A A . 12 SER OG 1 1 8 5657 1 1 13 LEU C C 0.814 5.245 -4.405 1.00 . A A . 13 LEU C 1 1 8 5658 1 1 13 LEU CA C 2.088 5.394 -3.589 1.00 . A A . 13 LEU CA 1 1 8 5659 1 1 13 LEU CB C 2.310 6.913 -3.217 1.00 . A A . 13 LEU CB 1 1 8 5660 1 1 13 LEU CD1 C 2.810 7.838 -5.576 1.00 . A A . 13 LEU CD1 1 1 8 5661 1 1 13 LEU CD2 C 0.499 8.194 -4.617 1.00 . A A . 13 LEU CD2 1 1 8 5662 1 1 13 LEU CG C 1.997 8.011 -4.296 1.00 . A A . 13 LEU CG 1 1 8 5663 1 1 13 LEU H H 4.085 5.385 -4.506 1.00 . A A . 13 LEU H 1 1 8 5664 1 1 13 LEU HA H 1.922 4.795 -2.706 1.00 . A A . 13 LEU HA 1 1 8 5665 1 1 13 LEU HB2 H 1.696 7.124 -2.351 1.00 . A A . 13 LEU HB2 1 1 8 5666 1 1 13 LEU HB3 H 3.339 7.028 -2.911 1.00 . A A . 13 LEU HB3 1 1 8 5667 1 1 13 LEU HD11 H 3.865 7.887 -5.355 1.00 . A A . 13 LEU HD11 1 1 8 5668 1 1 13 LEU HD12 H 2.617 6.903 -6.063 1.00 . A A . 13 LEU HD12 1 1 8 5669 1 1 13 LEU HD13 H 2.569 8.626 -6.274 1.00 . A A . 13 LEU HD13 1 1 8 5670 1 1 13 LEU HD21 H -0.047 8.444 -3.718 1.00 . A A . 13 LEU HD21 1 1 8 5671 1 1 13 LEU HD22 H 0.369 9.001 -5.322 1.00 . A A . 13 LEU HD22 1 1 8 5672 1 1 13 LEU HD23 H 0.024 7.335 -5.048 1.00 . A A . 13 LEU HD23 1 1 8 5673 1 1 13 LEU HG H 2.272 8.952 -3.856 1.00 . A A . 13 LEU HG 1 1 8 5674 1 1 13 LEU N N 3.272 4.862 -4.360 1.00 . A A . 13 LEU N 1 1 8 5675 1 1 13 LEU O O -0.266 5.049 -3.887 1.00 . A A . 13 LEU O 1 1 8 5676 1 1 14 TYR C C -0.594 3.672 -6.545 1.00 . A A . 14 TYR C 1 1 8 5677 1 1 14 TYR CA C -0.277 5.183 -6.511 1.00 . A A . 14 TYR CA 1 1 8 5678 1 1 14 TYR CB C -0.004 5.783 -7.921 1.00 . A A . 14 TYR CB 1 1 8 5679 1 1 14 TYR CD1 C -0.572 3.859 -9.429 1.00 . A A . 14 TYR CD1 1 1 8 5680 1 1 14 TYR CD2 C 1.676 4.632 -9.401 1.00 . A A . 14 TYR CD2 1 1 8 5681 1 1 14 TYR CE1 C -0.229 2.901 -10.358 1.00 . A A . 14 TYR CE1 1 1 8 5682 1 1 14 TYR CE2 C 2.014 3.669 -10.334 1.00 . A A . 14 TYR CE2 1 1 8 5683 1 1 14 TYR CG C 0.385 4.728 -8.949 1.00 . A A . 14 TYR CG 1 1 8 5684 1 1 14 TYR CZ C 1.061 2.802 -10.813 1.00 . A A . 14 TYR CZ 1 1 8 5685 1 1 14 TYR H H 1.857 5.423 -6.069 1.00 . A A . 14 TYR H 1 1 8 5686 1 1 14 TYR HA H -1.061 5.731 -6.002 1.00 . A A . 14 TYR HA 1 1 8 5687 1 1 14 TYR HB2 H -0.911 6.260 -8.266 1.00 . A A . 14 TYR HB2 1 1 8 5688 1 1 14 TYR HB3 H 0.774 6.528 -7.866 1.00 . A A . 14 TYR HB3 1 1 8 5689 1 1 14 TYR HD1 H -1.594 3.937 -9.068 1.00 . A A . 14 TYR HD1 1 1 8 5690 1 1 14 TYR HD2 H 2.416 5.318 -9.013 1.00 . A A . 14 TYR HD2 1 1 8 5691 1 1 14 TYR HE1 H -0.978 2.220 -10.730 1.00 . A A . 14 TYR HE1 1 1 8 5692 1 1 14 TYR HE2 H 3.027 3.591 -10.695 1.00 . A A . 14 TYR HE2 1 1 8 5693 1 1 14 TYR HH H 0.760 1.936 -12.453 1.00 . A A . 14 TYR HH 1 1 8 5694 1 1 14 TYR N N 0.958 5.314 -5.696 1.00 . A A . 14 TYR N 1 1 8 5695 1 1 14 TYR O O -1.731 3.253 -6.611 1.00 . A A . 14 TYR O 1 1 8 5696 1 1 14 TYR OH O 1.388 1.834 -11.733 1.00 . A A . 14 TYR OH 1 1 8 5697 1 1 15 GLN C C -0.560 1.050 -5.188 1.00 . A A . 15 GLN C 1 1 8 5698 1 1 15 GLN CA C 0.120 1.376 -6.521 1.00 . A A . 15 GLN CA 1 1 8 5699 1 1 15 GLN CB C 1.476 0.679 -6.811 1.00 . A A . 15 GLN CB 1 1 8 5700 1 1 15 GLN CD C 3.166 0.660 -8.825 1.00 . A A . 15 GLN CD 1 1 8 5701 1 1 15 GLN CG C 1.861 1.182 -8.260 1.00 . A A . 15 GLN CG 1 1 8 5702 1 1 15 GLN H H 1.351 3.189 -6.426 1.00 . A A . 15 GLN H 1 1 8 5703 1 1 15 GLN HA H -0.631 1.205 -7.247 1.00 . A A . 15 GLN HA 1 1 8 5704 1 1 15 GLN HB2 H 2.209 0.977 -6.080 1.00 . A A . 15 GLN HB2 1 1 8 5705 1 1 15 GLN HB3 H 1.370 -0.397 -6.793 1.00 . A A . 15 GLN HB3 1 1 8 5706 1 1 15 GLN HE21 H 2.584 0.777 -10.696 1.00 . A A . 15 GLN HE21 1 1 8 5707 1 1 15 GLN HE22 H 4.142 0.128 -10.408 1.00 . A A . 15 GLN HE22 1 1 8 5708 1 1 15 GLN HG2 H 1.089 0.888 -8.956 1.00 . A A . 15 GLN HG2 1 1 8 5709 1 1 15 GLN HG3 H 1.925 2.254 -8.269 1.00 . A A . 15 GLN HG3 1 1 8 5710 1 1 15 GLN N N 0.422 2.845 -6.494 1.00 . A A . 15 GLN N 1 1 8 5711 1 1 15 GLN NE2 N 3.304 0.509 -10.088 1.00 . A A . 15 GLN NE2 1 1 8 5712 1 1 15 GLN O O -1.469 0.249 -5.114 1.00 . A A . 15 GLN O 1 1 8 5713 1 1 15 GLN OE1 O 4.111 0.385 -8.134 1.00 . A A . 15 GLN OE1 1 1 8 5714 1 1 16 LEU C C -2.123 1.728 -3.004 1.00 . A A . 16 LEU C 1 1 8 5715 1 1 16 LEU CA C -0.640 1.541 -2.783 1.00 . A A . 16 LEU CA 1 1 8 5716 1 1 16 LEU CB C -0.162 2.680 -1.788 1.00 . A A . 16 LEU CB 1 1 8 5717 1 1 16 LEU CD1 C 0.671 1.070 -0.061 1.00 . A A . 16 LEU CD1 1 1 8 5718 1 1 16 LEU CD2 C 2.198 1.969 -1.750 1.00 . A A . 16 LEU CD2 1 1 8 5719 1 1 16 LEU CG C 1.010 2.292 -0.898 1.00 . A A . 16 LEU CG 1 1 8 5720 1 1 16 LEU H H 0.658 2.265 -4.355 1.00 . A A . 16 LEU H 1 1 8 5721 1 1 16 LEU HA H -0.485 0.533 -2.481 1.00 . A A . 16 LEU HA 1 1 8 5722 1 1 16 LEU HB2 H 0.121 3.556 -2.349 1.00 . A A . 16 LEU HB2 1 1 8 5723 1 1 16 LEU HB3 H -0.983 3.012 -1.162 1.00 . A A . 16 LEU HB3 1 1 8 5724 1 1 16 LEU HD11 H -0.198 1.254 0.551 1.00 . A A . 16 LEU HD11 1 1 8 5725 1 1 16 LEU HD12 H 0.489 0.211 -0.684 1.00 . A A . 16 LEU HD12 1 1 8 5726 1 1 16 LEU HD13 H 1.502 0.837 0.585 1.00 . A A . 16 LEU HD13 1 1 8 5727 1 1 16 LEU HD21 H 1.942 1.200 -2.459 1.00 . A A . 16 LEU HD21 1 1 8 5728 1 1 16 LEU HD22 H 2.519 2.826 -2.313 1.00 . A A . 16 LEU HD22 1 1 8 5729 1 1 16 LEU HD23 H 3.027 1.624 -1.150 1.00 . A A . 16 LEU HD23 1 1 8 5730 1 1 16 LEU HG H 1.249 3.132 -0.261 1.00 . A A . 16 LEU HG 1 1 8 5731 1 1 16 LEU N N -0.088 1.693 -4.164 1.00 . A A . 16 LEU N 1 1 8 5732 1 1 16 LEU O O -2.977 0.966 -2.597 1.00 . A A . 16 LEU O 1 1 8 5733 1 1 17 GLU C C -4.489 2.004 -4.790 1.00 . A A . 17 GLU C 1 1 8 5734 1 1 17 GLU CA C -3.795 3.087 -3.972 1.00 . A A . 17 GLU CA 1 1 8 5735 1 1 17 GLU CB C -3.946 4.373 -4.706 1.00 . A A . 17 GLU CB 1 1 8 5736 1 1 17 GLU CD C -6.026 5.799 -5.029 1.00 . A A . 17 GLU CD 1 1 8 5737 1 1 17 GLU CG C -5.341 4.758 -4.179 1.00 . A A . 17 GLU CG 1 1 8 5738 1 1 17 GLU H H -1.643 3.383 -3.994 1.00 . A A . 17 GLU H 1 1 8 5739 1 1 17 GLU HA H -4.295 3.115 -3.021 1.00 . A A . 17 GLU HA 1 1 8 5740 1 1 17 GLU HB2 H -3.188 5.084 -4.433 1.00 . A A . 17 GLU HB2 1 1 8 5741 1 1 17 GLU HB3 H -3.954 4.262 -5.785 1.00 . A A . 17 GLU HB3 1 1 8 5742 1 1 17 GLU HG2 H -5.975 3.888 -4.103 1.00 . A A . 17 GLU HG2 1 1 8 5743 1 1 17 GLU HG3 H -5.196 5.138 -3.182 1.00 . A A . 17 GLU HG3 1 1 8 5744 1 1 17 GLU N N -2.379 2.801 -3.691 1.00 . A A . 17 GLU N 1 1 8 5745 1 1 17 GLU O O -5.546 1.574 -4.384 1.00 . A A . 17 GLU O 1 1 8 5746 1 1 17 GLU OE1 O -5.593 6.923 -4.955 1.00 . A A . 17 GLU OE1 1 1 8 5747 1 1 17 GLU OE2 O -6.948 5.385 -5.692 1.00 . A A . 17 GLU OE2 1 1 8 5748 1 1 18 ASN C C -5.216 -0.564 -5.917 1.00 . A A . 18 ASN C 1 1 8 5749 1 1 18 ASN CA C -4.491 0.516 -6.784 1.00 . A A . 18 ASN CA 1 1 8 5750 1 1 18 ASN CB C -3.289 -0.021 -7.616 1.00 . A A . 18 ASN CB 1 1 8 5751 1 1 18 ASN CG C -3.700 -1.009 -8.689 1.00 . A A . 18 ASN CG 1 1 8 5752 1 1 18 ASN H H -3.060 2.014 -6.116 1.00 . A A . 18 ASN H 1 1 8 5753 1 1 18 ASN HA H -5.292 0.955 -7.356 1.00 . A A . 18 ASN HA 1 1 8 5754 1 1 18 ASN HB2 H -2.800 0.804 -8.112 1.00 . A A . 18 ASN HB2 1 1 8 5755 1 1 18 ASN HB3 H -2.568 -0.510 -6.985 1.00 . A A . 18 ASN HB3 1 1 8 5756 1 1 18 ASN HD21 H -5.625 -1.135 -8.221 1.00 . A A . 18 ASN HD21 1 1 8 5757 1 1 18 ASN HD22 H -5.073 -2.061 -9.540 1.00 . A A . 18 ASN HD22 1 1 8 5758 1 1 18 ASN N N -3.910 1.596 -5.888 1.00 . A A . 18 ASN N 1 1 8 5759 1 1 18 ASN ND2 N -4.907 -1.429 -8.817 1.00 . A A . 18 ASN ND2 1 1 8 5760 1 1 18 ASN O O -6.129 -1.225 -6.368 1.00 . A A . 18 ASN O 1 1 8 5761 1 1 18 ASN OD1 O -2.892 -1.441 -9.474 1.00 . A A . 18 ASN OD1 1 1 8 5762 1 1 19 TYR C C -6.246 -0.836 -2.718 1.00 . A A . 19 TYR C 1 1 8 5763 1 1 19 TYR CA C -5.375 -1.688 -3.755 1.00 . A A . 19 TYR CA 1 1 8 5764 1 1 19 TYR CB C -4.210 -2.503 -3.038 1.00 . A A . 19 TYR CB 1 1 8 5765 1 1 19 TYR CD1 C -4.113 -1.422 -0.800 1.00 . A A . 19 TYR CD1 1 1 8 5766 1 1 19 TYR CD2 C -5.353 -3.413 -0.996 1.00 . A A . 19 TYR CD2 1 1 8 5767 1 1 19 TYR CE1 C -4.456 -1.319 0.515 1.00 . A A . 19 TYR CE1 1 1 8 5768 1 1 19 TYR CE2 C -5.696 -3.306 0.329 1.00 . A A . 19 TYR CE2 1 1 8 5769 1 1 19 TYR CG C -4.559 -2.463 -1.563 1.00 . A A . 19 TYR CG 1 1 8 5770 1 1 19 TYR CZ C -5.255 -2.263 1.097 1.00 . A A . 19 TYR CZ 1 1 8 5771 1 1 19 TYR H H -3.974 -0.180 -4.434 1.00 . A A . 19 TYR H 1 1 8 5772 1 1 19 TYR HA H -6.052 -2.343 -4.285 1.00 . A A . 19 TYR HA 1 1 8 5773 1 1 19 TYR HB2 H -4.171 -3.535 -3.357 1.00 . A A . 19 TYR HB2 1 1 8 5774 1 1 19 TYR HB3 H -3.237 -2.054 -3.180 1.00 . A A . 19 TYR HB3 1 1 8 5775 1 1 19 TYR HD1 H -3.477 -0.675 -1.242 1.00 . A A . 19 TYR HD1 1 1 8 5776 1 1 19 TYR HD2 H -5.703 -4.240 -1.592 1.00 . A A . 19 TYR HD2 1 1 8 5777 1 1 19 TYR HE1 H -4.080 -0.478 1.062 1.00 . A A . 19 TYR HE1 1 1 8 5778 1 1 19 TYR HE2 H -6.322 -4.055 0.761 1.00 . A A . 19 TYR HE2 1 1 8 5779 1 1 19 TYR HH H -6.024 -1.316 2.556 1.00 . A A . 19 TYR HH 1 1 8 5780 1 1 19 TYR N N -4.755 -0.717 -4.703 1.00 . A A . 19 TYR N 1 1 8 5781 1 1 19 TYR O O -7.379 -1.149 -2.407 1.00 . A A . 19 TYR O 1 1 8 5782 1 1 19 TYR OH O -5.608 -2.175 2.422 1.00 . A A . 19 TYR OH 1 1 8 5783 1 1 20 CYS C C -7.687 1.779 -1.667 1.00 . A A . 20 CYS C 1 1 8 5784 1 1 20 CYS CA C -6.371 1.113 -1.198 1.00 . A A . 20 CYS CA 1 1 8 5785 1 1 20 CYS CB C -5.310 2.129 -0.753 1.00 . A A . 20 CYS CB 1 1 8 5786 1 1 20 CYS H H -4.762 0.416 -2.470 1.00 . A A . 20 CYS H 1 1 8 5787 1 1 20 CYS HA H -6.562 0.661 -0.266 1.00 . A A . 20 CYS HA 1 1 8 5788 1 1 20 CYS HB2 H -4.324 1.680 -0.712 1.00 . A A . 20 CYS HB2 1 1 8 5789 1 1 20 CYS HB3 H -5.251 3.006 -1.368 1.00 . A A . 20 CYS HB3 1 1 8 5790 1 1 20 CYS HG H -5.264 2.074 1.518 1.00 . A A . 20 CYS HG 1 1 8 5791 1 1 20 CYS N N -5.678 0.220 -2.191 1.00 . A A . 20 CYS N 1 1 8 5792 1 1 20 CYS O O -8.699 1.680 -1.005 1.00 . A A . 20 CYS O 1 1 8 5793 1 1 20 CYS SG S -5.693 2.683 0.918 1.00 . A A . 20 CYS SG 1 1 8 5794 1 1 21 ASN C C -10.052 3.076 -3.292 1.00 . A A . 21 ASN C 1 1 8 5795 1 1 21 ASN CA C -8.542 3.187 -3.615 1.00 . A A . 21 ASN CA 1 1 8 5796 1 1 21 ASN CB C -8.303 2.794 -5.102 1.00 . A A . 21 ASN CB 1 1 8 5797 1 1 21 ASN CG C -8.551 1.336 -5.404 1.00 . A A . 21 ASN CG 1 1 8 5798 1 1 21 ASN H H -6.626 2.305 -3.094 1.00 . A A . 21 ASN H 1 1 8 5799 1 1 21 ASN HA H -8.295 4.237 -3.543 1.00 . A A . 21 ASN HA 1 1 8 5800 1 1 21 ASN HB2 H -8.933 3.379 -5.752 1.00 . A A . 21 ASN HB2 1 1 8 5801 1 1 21 ASN HB3 H -7.286 2.994 -5.392 1.00 . A A . 21 ASN HB3 1 1 8 5802 1 1 21 ASN HD21 H -9.087 0.799 -3.587 1.00 . A A . 21 ASN HD21 1 1 8 5803 1 1 21 ASN HD22 H -9.056 -0.419 -4.787 1.00 . A A . 21 ASN HD22 1 1 8 5804 1 1 21 ASN N N -7.539 2.402 -2.788 1.00 . A A . 21 ASN N 1 1 8 5805 1 1 21 ASN ND2 N -8.932 0.506 -4.504 1.00 . A A . 21 ASN ND2 1 1 8 5806 1 1 21 ASN O O -10.518 2.048 -2.837 1.00 . A A . 21 ASN O 1 1 8 5807 1 1 21 ASN OD1 O -8.401 0.895 -6.515 1.00 . A A . 21 ASN OD1 1 1 8 5808 2 2 1 PHE C C 8.503 8.276 -0.373 1.00 . B B . 1 PHE C 1 1 8 5809 2 2 1 PHE CA C 7.739 9.604 -0.111 1.00 . B B . 1 PHE CA 1 1 8 5810 2 2 1 PHE CB C 7.401 10.338 -1.438 1.00 . B B . 1 PHE CB 1 1 8 5811 2 2 1 PHE CD1 C 5.311 11.538 -0.650 1.00 . B B . 1 PHE CD1 1 1 8 5812 2 2 1 PHE CD2 C 7.151 12.849 -1.384 1.00 . B B . 1 PHE CD2 1 1 8 5813 2 2 1 PHE CE1 C 4.594 12.686 -0.386 1.00 . B B . 1 PHE CE1 1 1 8 5814 2 2 1 PHE CE2 C 6.439 14.000 -1.122 1.00 . B B . 1 PHE CE2 1 1 8 5815 2 2 1 PHE CG C 6.594 11.610 -1.149 1.00 . B B . 1 PHE CG 1 1 8 5816 2 2 1 PHE CZ C 5.159 13.920 -0.624 1.00 . B B . 1 PHE CZ 1 1 8 5817 2 2 1 PHE HA H 6.830 9.348 0.411 1.00 . B B . 1 PHE HA 1 1 8 5818 2 2 1 PHE HB2 H 8.315 10.610 -1.948 1.00 . B B . 1 PHE HB2 1 1 8 5819 2 2 1 PHE HB3 H 6.824 9.703 -2.094 1.00 . B B . 1 PHE HB3 1 1 8 5820 2 2 1 PHE HD1 H 4.862 10.574 -0.464 1.00 . B B . 1 PHE HD1 1 1 8 5821 2 2 1 PHE HD2 H 8.154 12.919 -1.776 1.00 . B B . 1 PHE HD2 1 1 8 5822 2 2 1 PHE HE1 H 3.588 12.624 0.006 1.00 . B B . 1 PHE HE1 1 1 8 5823 2 2 1 PHE HE2 H 6.883 14.968 -1.309 1.00 . B B . 1 PHE HE2 1 1 8 5824 2 2 1 PHE HZ H 4.600 14.822 -0.418 1.00 . B B . 1 PHE HZ 1 1 8 5825 2 2 1 PHE N N 8.515 10.573 0.730 1.00 . B B . 1 PHE N 1 1 8 5826 2 2 1 PHE O O 8.559 7.769 -1.474 1.00 . B B . 1 PHE O 1 1 8 5827 2 2 2 VAL C C 9.214 5.187 -0.118 1.00 . B B . 2 VAL C 1 1 8 5828 2 2 2 VAL CA C 9.858 6.441 0.569 1.00 . B B . 2 VAL CA 1 1 8 5829 2 2 2 VAL CB C 10.287 6.057 1.998 1.00 . B B . 2 VAL CB 1 1 8 5830 2 2 2 VAL CG1 C 11.258 7.107 2.567 1.00 . B B . 2 VAL CG1 1 1 8 5831 2 2 2 VAL CG2 C 9.083 5.971 2.960 1.00 . B B . 2 VAL CG2 1 1 8 5832 2 2 2 VAL H H 9.010 8.185 1.512 1.00 . B B . 2 VAL H 1 1 8 5833 2 2 2 VAL HA H 10.754 6.669 0.021 1.00 . B B . 2 VAL HA 1 1 8 5834 2 2 2 VAL HB H 10.768 5.093 1.892 1.00 . B B . 2 VAL HB 1 1 8 5835 2 2 2 VAL HG11 H 12.147 7.178 1.957 1.00 . B B . 2 VAL HG11 1 1 8 5836 2 2 2 VAL HG12 H 10.798 8.083 2.615 1.00 . B B . 2 VAL HG12 1 1 8 5837 2 2 2 VAL HG13 H 11.560 6.827 3.568 1.00 . B B . 2 VAL HG13 1 1 8 5838 2 2 2 VAL HG21 H 8.375 5.224 2.630 1.00 . B B . 2 VAL HG21 1 1 8 5839 2 2 2 VAL HG22 H 9.418 5.687 3.948 1.00 . B B . 2 VAL HG22 1 1 8 5840 2 2 2 VAL HG23 H 8.566 6.916 3.044 1.00 . B B . 2 VAL HG23 1 1 8 5841 2 2 2 VAL N N 9.081 7.729 0.654 1.00 . B B . 2 VAL N 1 1 8 5842 2 2 2 VAL O O 8.882 4.188 0.493 1.00 . B B . 2 VAL O 1 1 8 5843 2 2 3 ASN C C 9.421 2.900 -2.366 1.00 . B B . 3 ASN C 1 1 8 5844 2 2 3 ASN CA C 8.456 4.112 -2.189 1.00 . B B . 3 ASN CA 1 1 8 5845 2 2 3 ASN CB C 8.005 4.676 -3.587 1.00 . B B . 3 ASN CB 1 1 8 5846 2 2 3 ASN CG C 6.794 5.584 -3.487 1.00 . B B . 3 ASN CG 1 1 8 5847 2 2 3 ASN H H 9.374 6.082 -1.818 1.00 . B B . 3 ASN H 1 1 8 5848 2 2 3 ASN HA H 7.588 3.737 -1.659 1.00 . B B . 3 ASN HA 1 1 8 5849 2 2 3 ASN HB2 H 8.800 5.247 -4.040 1.00 . B B . 3 ASN HB2 1 1 8 5850 2 2 3 ASN HB3 H 7.751 3.867 -4.254 1.00 . B B . 3 ASN HB3 1 1 8 5851 2 2 3 ASN HD21 H 7.249 6.337 -1.738 1.00 . B B . 3 ASN HD21 1 1 8 5852 2 2 3 ASN HD22 H 5.799 6.879 -2.458 1.00 . B B . 3 ASN HD22 1 1 8 5853 2 2 3 ASN N N 9.065 5.253 -1.404 1.00 . B B . 3 ASN N 1 1 8 5854 2 2 3 ASN ND2 N 6.602 6.330 -2.467 1.00 . B B . 3 ASN ND2 1 1 8 5855 2 2 3 ASN O O 9.857 2.572 -3.449 1.00 . B B . 3 ASN O 1 1 8 5856 2 2 3 ASN OD1 O 5.957 5.651 -4.357 1.00 . B B . 3 ASN OD1 1 1 8 5857 2 2 4 GLN C C 9.996 -0.132 -0.424 1.00 . B B . 4 GLN C 1 1 8 5858 2 2 4 GLN CA C 10.633 1.087 -1.210 1.00 . B B . 4 GLN CA 1 1 8 5859 2 2 4 GLN CB C 11.994 1.634 -0.600 1.00 . B B . 4 GLN CB 1 1 8 5860 2 2 4 GLN CD C 11.085 1.569 1.729 1.00 . B B . 4 GLN CD 1 1 8 5861 2 2 4 GLN CG C 11.762 2.450 0.721 1.00 . B B . 4 GLN CG 1 1 8 5862 2 2 4 GLN H H 9.321 2.627 -0.439 1.00 . B B . 4 GLN H 1 1 8 5863 2 2 4 GLN HA H 10.803 0.769 -2.221 1.00 . B B . 4 GLN HA 1 1 8 5864 2 2 4 GLN HB2 H 12.671 0.808 -0.417 1.00 . B B . 4 GLN HB2 1 1 8 5865 2 2 4 GLN HB3 H 12.459 2.274 -1.340 1.00 . B B . 4 GLN HB3 1 1 8 5866 2 2 4 GLN HE21 H 9.300 2.302 1.376 1.00 . B B . 4 GLN HE21 1 1 8 5867 2 2 4 GLN HE22 H 9.398 1.017 2.499 1.00 . B B . 4 GLN HE22 1 1 8 5868 2 2 4 GLN HG2 H 12.703 2.755 1.154 1.00 . B B . 4 GLN HG2 1 1 8 5869 2 2 4 GLN HG3 H 11.151 3.320 0.562 1.00 . B B . 4 GLN HG3 1 1 8 5870 2 2 4 GLN N N 9.721 2.281 -1.259 1.00 . B B . 4 GLN N 1 1 8 5871 2 2 4 GLN NE2 N 9.815 1.641 1.874 1.00 . B B . 4 GLN NE2 1 1 8 5872 2 2 4 GLN O O 8.858 -0.466 -0.668 1.00 . B B . 4 GLN O 1 1 8 5873 2 2 4 GLN OE1 O 11.704 0.779 2.393 1.00 . B B . 4 GLN OE1 1 1 8 5874 2 2 5 HIS C C 9.397 -1.505 2.585 1.00 . B B . 5 HIS C 1 1 8 5875 2 2 5 HIS CA C 10.155 -1.927 1.283 1.00 . B B . 5 HIS CA 1 1 8 5876 2 2 5 HIS CB C 11.364 -2.847 1.646 1.00 . B B . 5 HIS CB 1 1 8 5877 2 2 5 HIS CD2 C 13.169 -3.396 -0.215 1.00 . B B . 5 HIS CD2 1 1 8 5878 2 2 5 HIS CE1 C 12.020 -4.732 -1.308 1.00 . B B . 5 HIS CE1 1 1 8 5879 2 2 5 HIS CG C 11.946 -3.502 0.409 1.00 . B B . 5 HIS CG 1 1 8 5880 2 2 5 HIS H H 11.597 -0.456 0.678 1.00 . B B . 5 HIS H 1 1 8 5881 2 2 5 HIS HA H 9.453 -2.481 0.673 1.00 . B B . 5 HIS HA 1 1 8 5882 2 2 5 HIS HB2 H 12.135 -2.272 2.136 1.00 . B B . 5 HIS HB2 1 1 8 5883 2 2 5 HIS HB3 H 11.043 -3.632 2.317 1.00 . B B . 5 HIS HB3 1 1 8 5884 2 2 5 HIS HD1 H 10.378 -4.620 -0.082 1.00 . B B . 5 HIS HD1 1 1 8 5885 2 2 5 HIS HD2 H 13.980 -2.773 0.125 1.00 . B B . 5 HIS HD2 1 1 8 5886 2 2 5 HIS HE1 H 11.693 -5.426 -2.071 1.00 . B B . 5 HIS HE1 1 1 8 5887 2 2 5 HIS N N 10.691 -0.757 0.489 1.00 . B B . 5 HIS N 1 1 8 5888 2 2 5 HIS ND1 N 11.293 -4.336 -0.309 1.00 . B B . 5 HIS ND1 1 1 8 5889 2 2 5 HIS NE2 N 13.202 -4.167 -1.285 1.00 . B B . 5 HIS NE2 1 1 8 5890 2 2 5 HIS O O 9.931 -1.537 3.677 1.00 . B B . 5 HIS O 1 1 8 5891 2 2 6 LEU C C 6.327 -1.777 4.111 1.00 . B B . 6 LEU C 1 1 8 5892 2 2 6 LEU CA C 7.371 -0.699 3.690 1.00 . B B . 6 LEU CA 1 1 8 5893 2 2 6 LEU CB C 6.662 0.689 3.399 1.00 . B B . 6 LEU CB 1 1 8 5894 2 2 6 LEU CD1 C 4.808 1.883 2.276 1.00 . B B . 6 LEU CD1 1 1 8 5895 2 2 6 LEU CD2 C 6.666 1.141 0.937 1.00 . B B . 6 LEU CD2 1 1 8 5896 2 2 6 LEU CG C 5.794 0.721 2.123 1.00 . B B . 6 LEU CG 1 1 8 5897 2 2 6 LEU H H 7.732 -1.125 1.580 1.00 . B B . 6 LEU H 1 1 8 5898 2 2 6 LEU HA H 8.048 -0.567 4.521 1.00 . B B . 6 LEU HA 1 1 8 5899 2 2 6 LEU HB2 H 6.029 0.932 4.241 1.00 . B B . 6 LEU HB2 1 1 8 5900 2 2 6 LEU HB3 H 7.412 1.464 3.339 1.00 . B B . 6 LEU HB3 1 1 8 5901 2 2 6 LEU HD11 H 4.200 1.752 3.158 1.00 . B B . 6 LEU HD11 1 1 8 5902 2 2 6 LEU HD12 H 5.336 2.818 2.384 1.00 . B B . 6 LEU HD12 1 1 8 5903 2 2 6 LEU HD13 H 4.160 1.942 1.414 1.00 . B B . 6 LEU HD13 1 1 8 5904 2 2 6 LEU HD21 H 7.473 0.448 0.801 1.00 . B B . 6 LEU HD21 1 1 8 5905 2 2 6 LEU HD22 H 6.077 1.150 0.032 1.00 . B B . 6 LEU HD22 1 1 8 5906 2 2 6 LEU HD23 H 7.081 2.126 1.094 1.00 . B B . 6 LEU HD23 1 1 8 5907 2 2 6 LEU HG H 5.294 -0.226 1.940 1.00 . B B . 6 LEU HG 1 1 8 5908 2 2 6 LEU N N 8.153 -1.120 2.467 1.00 . B B . 6 LEU N 1 1 8 5909 2 2 6 LEU O O 5.520 -2.246 3.333 1.00 . B B . 6 LEU O 1 1 8 5910 2 2 7 CYS C C 4.364 -2.707 6.933 1.00 . B B . 7 CYS C 1 1 8 5911 2 2 7 CYS CA C 5.414 -3.196 5.891 1.00 . B B . 7 CYS CA 1 1 8 5912 2 2 7 CYS CB C 6.317 -4.326 6.452 1.00 . B B . 7 CYS CB 1 1 8 5913 2 2 7 CYS H H 7.026 -1.734 5.949 1.00 . B B . 7 CYS H 1 1 8 5914 2 2 7 CYS HA H 4.847 -3.602 5.064 1.00 . B B . 7 CYS HA 1 1 8 5915 2 2 7 CYS HB2 H 7.327 -4.179 6.089 1.00 . B B . 7 CYS HB2 1 1 8 5916 2 2 7 CYS HB3 H 6.358 -4.268 7.532 1.00 . B B . 7 CYS HB3 1 1 8 5917 2 2 7 CYS HG H 5.291 -6.376 6.680 1.00 . B B . 7 CYS HG 1 1 8 5918 2 2 7 CYS N N 6.366 -2.151 5.364 1.00 . B B . 7 CYS N 1 1 8 5919 2 2 7 CYS O O 4.279 -1.541 7.241 1.00 . B B . 7 CYS O 1 1 8 5920 2 2 7 CYS SG S 5.858 -6.016 5.994 1.00 . B B . 7 CYS SG 1 1 8 5921 2 2 8 GLY C C 1.980 -1.982 8.671 1.00 . B B . 8 GLY C 1 1 8 5922 2 2 8 GLY CA C 2.506 -3.396 8.468 1.00 . B B . 8 GLY CA 1 1 8 5923 2 2 8 GLY H H 3.768 -4.544 7.159 1.00 . B B . 8 GLY H 1 1 8 5924 2 2 8 GLY HA2 H 1.649 -3.991 8.222 1.00 . B B . 8 GLY HA2 1 1 8 5925 2 2 8 GLY HA3 H 2.885 -3.702 9.433 1.00 . B B . 8 GLY HA3 1 1 8 5926 2 2 8 GLY N N 3.603 -3.635 7.449 1.00 . B B . 8 GLY N 1 1 8 5927 2 2 8 GLY O O 1.218 -1.443 7.896 1.00 . B B . 8 GLY O 1 1 8 5928 2 2 9 ASP C C 2.468 0.988 9.076 1.00 . B B . 9 ASP C 1 1 8 5929 2 2 9 ASP CA C 2.069 -0.054 10.163 1.00 . B B . 9 ASP CA 1 1 8 5930 2 2 9 ASP CB C 2.803 0.108 11.531 1.00 . B B . 9 ASP CB 1 1 8 5931 2 2 9 ASP CG C 4.250 -0.344 11.406 1.00 . B B . 9 ASP CG 1 1 8 5932 2 2 9 ASP H H 3.057 -1.971 10.266 1.00 . B B . 9 ASP H 1 1 8 5933 2 2 9 ASP HA H 0.987 -0.004 10.259 1.00 . B B . 9 ASP HA 1 1 8 5934 2 2 9 ASP HB2 H 2.814 1.139 11.847 1.00 . B B . 9 ASP HB2 1 1 8 5935 2 2 9 ASP HB3 H 2.348 -0.493 12.299 1.00 . B B . 9 ASP HB3 1 1 8 5936 2 2 9 ASP N N 2.433 -1.434 9.733 1.00 . B B . 9 ASP N 1 1 8 5937 2 2 9 ASP O O 1.657 1.702 8.519 1.00 . B B . 9 ASP O 1 1 8 5938 2 2 9 ASP OD1 O 4.443 -1.541 11.490 1.00 . B B . 9 ASP OD1 1 1 8 5939 2 2 9 ASP OD2 O 5.062 0.532 11.215 1.00 . B B . 9 ASP OD2 1 1 8 5940 2 2 10 HIS C C 3.532 1.780 6.405 1.00 . B B . 10 HIS C 1 1 8 5941 2 2 10 HIS CA C 4.273 1.976 7.763 1.00 . B B . 10 HIS CA 1 1 8 5942 2 2 10 HIS CB C 5.761 1.658 7.739 1.00 . B B . 10 HIS CB 1 1 8 5943 2 2 10 HIS CD2 C 7.592 2.276 5.948 1.00 . B B . 10 HIS CD2 1 1 8 5944 2 2 10 HIS CE1 C 7.129 4.273 5.697 1.00 . B B . 10 HIS CE1 1 1 8 5945 2 2 10 HIS CG C 6.525 2.558 6.776 1.00 . B B . 10 HIS CG 1 1 8 5946 2 2 10 HIS H H 4.292 0.397 9.301 1.00 . B B . 10 HIS H 1 1 8 5947 2 2 10 HIS HA H 4.098 2.996 8.087 1.00 . B B . 10 HIS HA 1 1 8 5948 2 2 10 HIS HB2 H 6.137 1.807 8.741 1.00 . B B . 10 HIS HB2 1 1 8 5949 2 2 10 HIS HB3 H 5.886 0.626 7.458 1.00 . B B . 10 HIS HB3 1 1 8 5950 2 2 10 HIS HD1 H 5.576 4.346 7.014 1.00 . B B . 10 HIS HD1 1 1 8 5951 2 2 10 HIS HD2 H 8.061 1.313 5.861 1.00 . B B . 10 HIS HD2 1 1 8 5952 2 2 10 HIS HE1 H 7.137 5.300 5.357 1.00 . B B . 10 HIS HE1 1 1 8 5953 2 2 10 HIS N N 3.727 1.026 8.795 1.00 . B B . 10 HIS N 1 1 8 5954 2 2 10 HIS ND1 N 6.292 3.807 6.572 1.00 . B B . 10 HIS ND1 1 1 8 5955 2 2 10 HIS NE2 N 7.958 3.351 5.281 1.00 . B B . 10 HIS NE2 1 1 8 5956 2 2 10 HIS O O 3.372 2.648 5.567 1.00 . B B . 10 HIS O 1 1 8 5957 2 2 11 LEU C C 0.901 0.793 5.096 1.00 . B B . 11 LEU C 1 1 8 5958 2 2 11 LEU CA C 2.330 0.228 4.972 1.00 . B B . 11 LEU CA 1 1 8 5959 2 2 11 LEU CB C 2.371 -1.313 4.836 1.00 . B B . 11 LEU CB 1 1 8 5960 2 2 11 LEU CD1 C 2.323 -1.120 2.351 1.00 . B B . 11 LEU CD1 1 1 8 5961 2 2 11 LEU CD2 C 1.841 -3.260 3.415 1.00 . B B . 11 LEU CD2 1 1 8 5962 2 2 11 LEU CG C 1.645 -1.760 3.565 1.00 . B B . 11 LEU CG 1 1 8 5963 2 2 11 LEU H H 3.232 -0.078 6.923 1.00 . B B . 11 LEU H 1 1 8 5964 2 2 11 LEU HA H 2.798 0.720 4.139 1.00 . B B . 11 LEU HA 1 1 8 5965 2 2 11 LEU HB2 H 3.408 -1.605 4.767 1.00 . B B . 11 LEU HB2 1 1 8 5966 2 2 11 LEU HB3 H 1.933 -1.779 5.704 1.00 . B B . 11 LEU HB3 1 1 8 5967 2 2 11 LEU HD11 H 3.365 -1.406 2.302 1.00 . B B . 11 LEU HD11 1 1 8 5968 2 2 11 LEU HD12 H 1.837 -1.437 1.447 1.00 . B B . 11 LEU HD12 1 1 8 5969 2 2 11 LEU HD13 H 2.272 -0.044 2.387 1.00 . B B . 11 LEU HD13 1 1 8 5970 2 2 11 LEU HD21 H 1.438 -3.778 4.271 1.00 . B B . 11 LEU HD21 1 1 8 5971 2 2 11 LEU HD22 H 1.346 -3.605 2.522 1.00 . B B . 11 LEU HD22 1 1 8 5972 2 2 11 LEU HD23 H 2.897 -3.482 3.331 1.00 . B B . 11 LEU HD23 1 1 8 5973 2 2 11 LEU HG H 0.594 -1.505 3.625 1.00 . B B . 11 LEU HG 1 1 8 5974 2 2 11 LEU N N 3.070 0.578 6.217 1.00 . B B . 11 LEU N 1 1 8 5975 2 2 11 LEU O O 0.435 1.455 4.186 1.00 . B B . 11 LEU O 1 1 8 5976 2 2 12 VAL C C -1.038 2.658 6.145 1.00 . B B . 12 VAL C 1 1 8 5977 2 2 12 VAL CA C -1.179 1.128 6.269 1.00 . B B . 12 VAL CA 1 1 8 5978 2 2 12 VAL CB C -1.893 0.797 7.621 1.00 . B B . 12 VAL CB 1 1 8 5979 2 2 12 VAL CG1 C -1.037 1.150 8.812 1.00 . B B . 12 VAL CG1 1 1 8 5980 2 2 12 VAL CG2 C -3.158 1.678 7.694 1.00 . B B . 12 VAL CG2 1 1 8 5981 2 2 12 VAL H H 0.591 -0.017 6.883 1.00 . B B . 12 VAL H 1 1 8 5982 2 2 12 VAL HA H -1.757 0.761 5.455 1.00 . B B . 12 VAL HA 1 1 8 5983 2 2 12 VAL HB H -2.150 -0.255 7.652 1.00 . B B . 12 VAL HB 1 1 8 5984 2 2 12 VAL HG11 H -0.747 2.191 8.833 1.00 . B B . 12 VAL HG11 1 1 8 5985 2 2 12 VAL HG12 H -1.530 0.917 9.739 1.00 . B B . 12 VAL HG12 1 1 8 5986 2 2 12 VAL HG13 H -0.152 0.544 8.734 1.00 . B B . 12 VAL HG13 1 1 8 5987 2 2 12 VAL HG21 H -3.785 1.488 6.834 1.00 . B B . 12 VAL HG21 1 1 8 5988 2 2 12 VAL HG22 H -3.709 1.474 8.596 1.00 . B B . 12 VAL HG22 1 1 8 5989 2 2 12 VAL HG23 H -2.896 2.729 7.691 1.00 . B B . 12 VAL HG23 1 1 8 5990 2 2 12 VAL N N 0.204 0.542 6.178 1.00 . B B . 12 VAL N 1 1 8 5991 2 2 12 VAL O O -1.763 3.294 5.411 1.00 . B B . 12 VAL O 1 1 8 5992 2 2 13 GLU C C 0.108 5.157 5.407 1.00 . B B . 13 GLU C 1 1 8 5993 2 2 13 GLU CA C 0.178 4.660 6.872 1.00 . B B . 13 GLU CA 1 1 8 5994 2 2 13 GLU CB C 1.547 4.710 7.540 1.00 . B B . 13 GLU CB 1 1 8 5995 2 2 13 GLU CD C 3.444 6.222 8.216 1.00 . B B . 13 GLU CD 1 1 8 5996 2 2 13 GLU CG C 2.067 6.135 7.565 1.00 . B B . 13 GLU CG 1 1 8 5997 2 2 13 GLU H H 0.455 2.670 7.457 1.00 . B B . 13 GLU H 1 1 8 5998 2 2 13 GLU HA H -0.560 5.197 7.449 1.00 . B B . 13 GLU HA 1 1 8 5999 2 2 13 GLU HB2 H 1.498 4.326 8.552 1.00 . B B . 13 GLU HB2 1 1 8 6000 2 2 13 GLU HB3 H 2.252 4.100 6.995 1.00 . B B . 13 GLU HB3 1 1 8 6001 2 2 13 GLU HG2 H 2.164 6.495 6.558 1.00 . B B . 13 GLU HG2 1 1 8 6002 2 2 13 GLU HG3 H 1.385 6.748 8.127 1.00 . B B . 13 GLU HG3 1 1 8 6003 2 2 13 GLU N N -0.111 3.207 6.872 1.00 . B B . 13 GLU N 1 1 8 6004 2 2 13 GLU O O -0.552 6.114 5.042 1.00 . B B . 13 GLU O 1 1 8 6005 2 2 13 GLU OE1 O 4.314 5.525 7.721 1.00 . B B . 13 GLU OE1 1 1 8 6006 2 2 13 GLU OE2 O 3.533 6.980 9.159 1.00 . B B . 13 GLU OE2 1 1 8 6007 2 2 14 ALA C C -0.415 4.417 2.353 1.00 . B B . 14 ALA C 1 1 8 6008 2 2 14 ALA CA C 0.866 4.726 3.139 1.00 . B B . 14 ALA CA 1 1 8 6009 2 2 14 ALA CB C 2.100 3.940 2.630 1.00 . B B . 14 ALA CB 1 1 8 6010 2 2 14 ALA H H 1.278 3.640 4.939 1.00 . B B . 14 ALA H 1 1 8 6011 2 2 14 ALA HA H 0.944 5.790 3.093 1.00 . B B . 14 ALA HA 1 1 8 6012 2 2 14 ALA HB1 H 2.982 4.253 3.176 1.00 . B B . 14 ALA HB1 1 1 8 6013 2 2 14 ALA HB2 H 1.964 2.881 2.809 1.00 . B B . 14 ALA HB2 1 1 8 6014 2 2 14 ALA HB3 H 2.265 4.093 1.574 1.00 . B B . 14 ALA HB3 1 1 8 6015 2 2 14 ALA N N 0.798 4.416 4.585 1.00 . B B . 14 ALA N 1 1 8 6016 2 2 14 ALA O O -0.906 5.246 1.610 1.00 . B B . 14 ALA O 1 1 8 6017 2 2 15 LEU C C -3.241 4.002 2.120 1.00 . B B . 15 LEU C 1 1 8 6018 2 2 15 LEU CA C -2.200 2.945 1.744 1.00 . B B . 15 LEU CA 1 1 8 6019 2 2 15 LEU CB C -2.643 1.496 2.089 1.00 . B B . 15 LEU CB 1 1 8 6020 2 2 15 LEU CD1 C -4.740 1.579 3.544 1.00 . B B . 15 LEU CD1 1 1 8 6021 2 2 15 LEU CD2 C -3.169 -0.232 3.841 1.00 . B B . 15 LEU CD2 1 1 8 6022 2 2 15 LEU CG C -3.272 1.256 3.473 1.00 . B B . 15 LEU CG 1 1 8 6023 2 2 15 LEU H H -0.522 2.609 3.109 1.00 . B B . 15 LEU H 1 1 8 6024 2 2 15 LEU HA H -2.009 3.049 0.687 1.00 . B B . 15 LEU HA 1 1 8 6025 2 2 15 LEU HB2 H -3.306 1.200 1.301 1.00 . B B . 15 LEU HB2 1 1 8 6026 2 2 15 LEU HB3 H -1.736 0.920 2.028 1.00 . B B . 15 LEU HB3 1 1 8 6027 2 2 15 LEU HD11 H -4.957 2.608 3.315 1.00 . B B . 15 LEU HD11 1 1 8 6028 2 2 15 LEU HD12 H -5.320 0.942 2.895 1.00 . B B . 15 LEU HD12 1 1 8 6029 2 2 15 LEU HD13 H -5.061 1.404 4.557 1.00 . B B . 15 LEU HD13 1 1 8 6030 2 2 15 LEU HD21 H -2.137 -0.546 3.872 1.00 . B B . 15 LEU HD21 1 1 8 6031 2 2 15 LEU HD22 H -3.602 -0.408 4.816 1.00 . B B . 15 LEU HD22 1 1 8 6032 2 2 15 LEU HD23 H -3.695 -0.855 3.134 1.00 . B B . 15 LEU HD23 1 1 8 6033 2 2 15 LEU HG H -2.772 1.881 4.182 1.00 . B B . 15 LEU HG 1 1 8 6034 2 2 15 LEU N N -0.953 3.243 2.505 1.00 . B B . 15 LEU N 1 1 8 6035 2 2 15 LEU O O -3.904 4.508 1.248 1.00 . B B . 15 LEU O 1 1 8 6036 2 2 16 TYR C C -3.955 6.690 3.116 1.00 . B B . 16 TYR C 1 1 8 6037 2 2 16 TYR CA C -4.358 5.363 3.794 1.00 . B B . 16 TYR CA 1 1 8 6038 2 2 16 TYR CB C -4.337 5.476 5.343 1.00 . B B . 16 TYR CB 1 1 8 6039 2 2 16 TYR CD1 C -6.354 7.028 5.305 1.00 . B B . 16 TYR CD1 1 1 8 6040 2 2 16 TYR CD2 C -6.449 5.090 6.673 1.00 . B B . 16 TYR CD2 1 1 8 6041 2 2 16 TYR CE1 C -7.635 7.367 5.698 1.00 . B B . 16 TYR CE1 1 1 8 6042 2 2 16 TYR CE2 C -7.731 5.437 7.063 1.00 . B B . 16 TYR CE2 1 1 8 6043 2 2 16 TYR CG C -5.751 5.884 5.788 1.00 . B B . 16 TYR CG 1 1 8 6044 2 2 16 TYR CZ C -8.321 6.574 6.575 1.00 . B B . 16 TYR CZ 1 1 8 6045 2 2 16 TYR H H -2.780 3.907 4.039 1.00 . B B . 16 TYR H 1 1 8 6046 2 2 16 TYR HA H -5.336 5.091 3.420 1.00 . B B . 16 TYR HA 1 1 8 6047 2 2 16 TYR HB2 H -4.074 4.526 5.786 1.00 . B B . 16 TYR HB2 1 1 8 6048 2 2 16 TYR HB3 H -3.628 6.221 5.677 1.00 . B B . 16 TYR HB3 1 1 8 6049 2 2 16 TYR HD1 H -5.819 7.666 4.612 1.00 . B B . 16 TYR HD1 1 1 8 6050 2 2 16 TYR HD2 H -5.981 4.195 7.061 1.00 . B B . 16 TYR HD2 1 1 8 6051 2 2 16 TYR HE1 H -8.098 8.265 5.315 1.00 . B B . 16 TYR HE1 1 1 8 6052 2 2 16 TYR HE2 H -8.273 4.817 7.760 1.00 . B B . 16 TYR HE2 1 1 8 6053 2 2 16 TYR HH H -9.487 7.724 7.471 1.00 . B B . 16 TYR HH 1 1 8 6054 2 2 16 TYR N N -3.358 4.333 3.377 1.00 . B B . 16 TYR N 1 1 8 6055 2 2 16 TYR O O -4.785 7.305 2.482 1.00 . B B . 16 TYR O 1 1 8 6056 2 2 16 TYR OH O -9.597 6.911 6.957 1.00 . B B . 16 TYR OH 1 1 8 6057 2 2 17 LEU C C -2.755 8.553 1.233 1.00 . B B . 17 LEU C 1 1 8 6058 2 2 17 LEU CA C -2.190 8.356 2.665 1.00 . B B . 17 LEU CA 1 1 8 6059 2 2 17 LEU CB C -0.635 8.250 2.684 1.00 . B B . 17 LEU CB 1 1 8 6060 2 2 17 LEU CD1 C -0.286 10.737 2.835 1.00 . B B . 17 LEU CD1 1 1 8 6061 2 2 17 LEU CD2 C 1.549 9.261 2.111 1.00 . B B . 17 LEU CD2 1 1 8 6062 2 2 17 LEU CG C 0.039 9.475 2.037 1.00 . B B . 17 LEU CG 1 1 8 6063 2 2 17 LEU H H -2.109 6.544 3.834 1.00 . B B . 17 LEU H 1 1 8 6064 2 2 17 LEU HA H -2.530 9.194 3.254 1.00 . B B . 17 LEU HA 1 1 8 6065 2 2 17 LEU HB2 H -0.302 8.146 3.708 1.00 . B B . 17 LEU HB2 1 1 8 6066 2 2 17 LEU HB3 H -0.338 7.366 2.146 1.00 . B B . 17 LEU HB3 1 1 8 6067 2 2 17 LEU HD11 H 0.049 10.639 3.856 1.00 . B B . 17 LEU HD11 1 1 8 6068 2 2 17 LEU HD12 H 0.202 11.591 2.390 1.00 . B B . 17 LEU HD12 1 1 8 6069 2 2 17 LEU HD13 H -1.350 10.923 2.833 1.00 . B B . 17 LEU HD13 1 1 8 6070 2 2 17 LEU HD21 H 1.864 9.160 3.142 1.00 . B B . 17 LEU HD21 1 1 8 6071 2 2 17 LEU HD22 H 1.825 8.363 1.577 1.00 . B B . 17 LEU HD22 1 1 8 6072 2 2 17 LEU HD23 H 2.065 10.102 1.672 1.00 . B B . 17 LEU HD23 1 1 8 6073 2 2 17 LEU HG H -0.284 9.586 1.006 1.00 . B B . 17 LEU HG 1 1 8 6074 2 2 17 LEU N N -2.714 7.086 3.285 1.00 . B B . 17 LEU N 1 1 8 6075 2 2 17 LEU O O -3.190 9.631 0.881 1.00 . B B . 17 LEU O 1 1 8 6076 2 2 18 VAL C C -4.744 7.157 -1.188 1.00 . B B . 18 VAL C 1 1 8 6077 2 2 18 VAL CA C -3.249 7.595 -0.952 1.00 . B B . 18 VAL CA 1 1 8 6078 2 2 18 VAL CB C -2.318 6.778 -1.861 1.00 . B B . 18 VAL CB 1 1 8 6079 2 2 18 VAL CG1 C -2.559 5.278 -1.676 1.00 . B B . 18 VAL CG1 1 1 8 6080 2 2 18 VAL CG2 C -2.654 7.191 -3.309 1.00 . B B . 18 VAL CG2 1 1 8 6081 2 2 18 VAL H H -2.293 6.684 0.813 1.00 . B B . 18 VAL H 1 1 8 6082 2 2 18 VAL HA H -3.153 8.599 -1.301 1.00 . B B . 18 VAL HA 1 1 8 6083 2 2 18 VAL HB H -1.289 7.023 -1.632 1.00 . B B . 18 VAL HB 1 1 8 6084 2 2 18 VAL HG11 H -2.402 4.991 -0.648 1.00 . B B . 18 VAL HG11 1 1 8 6085 2 2 18 VAL HG12 H -3.566 5.023 -1.964 1.00 . B B . 18 VAL HG12 1 1 8 6086 2 2 18 VAL HG13 H -1.891 4.733 -2.315 1.00 . B B . 18 VAL HG13 1 1 8 6087 2 2 18 VAL HG21 H -2.543 8.256 -3.450 1.00 . B B . 18 VAL HG21 1 1 8 6088 2 2 18 VAL HG22 H -2.033 6.685 -4.025 1.00 . B B . 18 VAL HG22 1 1 8 6089 2 2 18 VAL HG23 H -3.688 6.960 -3.538 1.00 . B B . 18 VAL HG23 1 1 8 6090 2 2 18 VAL N N -2.708 7.501 0.455 1.00 . B B . 18 VAL N 1 1 8 6091 2 2 18 VAL O O -5.478 7.843 -1.863 1.00 . B B . 18 VAL O 1 1 8 6092 2 2 19 CYS C C -7.767 6.146 -1.500 1.00 . B B . 19 CYS C 1 1 8 6093 2 2 19 CYS CA C -6.566 5.482 -0.756 1.00 . B B . 19 CYS CA 1 1 8 6094 2 2 19 CYS CB C -6.924 5.152 0.712 1.00 . B B . 19 CYS CB 1 1 8 6095 2 2 19 CYS H H -4.644 5.494 -0.048 1.00 . B B . 19 CYS H 1 1 8 6096 2 2 19 CYS HA H -6.428 4.649 -1.414 1.00 . B B . 19 CYS HA 1 1 8 6097 2 2 19 CYS HB2 H -6.054 5.310 1.330 1.00 . B B . 19 CYS HB2 1 1 8 6098 2 2 19 CYS HB3 H -7.645 5.869 1.070 1.00 . B B . 19 CYS HB3 1 1 8 6099 2 2 19 CYS HG H -8.394 3.378 0.697 1.00 . B B . 19 CYS HG 1 1 8 6100 2 2 19 CYS N N -5.182 6.053 -0.636 1.00 . B B . 19 CYS N 1 1 8 6101 2 2 19 CYS O O -8.841 6.240 -0.935 1.00 . B B . 19 CYS O 1 1 8 6102 2 2 19 CYS SG S -7.500 3.468 1.030 1.00 . B B . 19 CYS SG 1 1 8 6103 2 2 20 GLY C C -9.974 6.506 -3.431 1.00 . B B . 20 GLY C 1 1 8 6104 2 2 20 GLY CA C -8.626 7.216 -3.578 1.00 . B B . 20 GLY CA 1 1 8 6105 2 2 20 GLY H H -6.658 6.495 -3.094 1.00 . B B . 20 GLY H 1 1 8 6106 2 2 20 GLY HA2 H -8.748 8.254 -3.306 1.00 . B B . 20 GLY HA2 1 1 8 6107 2 2 20 GLY HA3 H -8.333 7.158 -4.617 1.00 . B B . 20 GLY HA3 1 1 8 6108 2 2 20 GLY N N -7.560 6.574 -2.715 1.00 . B B . 20 GLY N 1 1 8 6109 2 2 20 GLY O O -10.301 5.576 -4.142 1.00 . B B . 20 GLY O 1 1 8 6110 2 2 21 GLU C C -12.073 4.940 -1.741 1.00 . B B . 21 GLU C 1 1 8 6111 2 2 21 GLU CA C -12.072 6.453 -2.128 1.00 . B B . 21 GLU CA 1 1 8 6112 2 2 21 GLU CB C -12.935 6.808 -3.332 1.00 . B B . 21 GLU CB 1 1 8 6113 2 2 21 GLU CD C -12.634 9.256 -2.559 1.00 . B B . 21 GLU CD 1 1 8 6114 2 2 21 GLU CG C -12.542 8.305 -3.753 1.00 . B B . 21 GLU CG 1 1 8 6115 2 2 21 GLU H H -10.334 7.732 -1.980 1.00 . B B . 21 GLU H 1 1 8 6116 2 2 21 GLU HA H -12.449 7.011 -1.282 1.00 . B B . 21 GLU HA 1 1 8 6117 2 2 21 GLU HB2 H -12.767 6.073 -4.099 1.00 . B B . 21 GLU HB2 1 1 8 6118 2 2 21 GLU HB3 H -13.957 6.773 -2.978 1.00 . B B . 21 GLU HB3 1 1 8 6119 2 2 21 GLU HG2 H -11.524 8.354 -4.120 1.00 . B B . 21 GLU HG2 1 1 8 6120 2 2 21 GLU HG3 H -13.178 8.690 -4.522 1.00 . B B . 21 GLU HG3 1 1 8 6121 2 2 21 GLU N N -10.709 6.976 -2.479 1.00 . B B . 21 GLU N 1 1 8 6122 2 2 21 GLU O O -12.717 4.022 -2.207 1.00 . B B . 21 GLU O 1 1 8 6123 2 2 21 GLU OE1 O -13.750 9.575 -2.200 1.00 . B B . 21 GLU OE1 1 1 8 6124 2 2 21 GLU OE2 O -11.561 9.585 -2.081 1.00 . B B . 21 GLU OE2 1 1 8 6125 2 2 22 ARG C C -11.360 2.475 0.570 1.00 . B B . 22 ARG C 1 1 8 6126 2 2 22 ARG CA C -10.669 3.793 0.105 1.00 . B B . 22 ARG CA 1 1 8 6127 2 2 22 ARG CB C -10.212 4.594 1.296 1.00 . B B . 22 ARG CB 1 1 8 6128 2 2 22 ARG CD C -11.201 6.122 3.023 1.00 . B B . 22 ARG CD 1 1 8 6129 2 2 22 ARG CG C -11.504 5.298 1.838 1.00 . B B . 22 ARG CG 1 1 8 6130 2 2 22 ARG CZ C -11.081 4.442 4.798 1.00 . B B . 22 ARG CZ 1 1 8 6131 2 2 22 ARG H H -10.825 5.725 -0.566 1.00 . B B . 22 ARG H 1 1 8 6132 2 2 22 ARG HA H -9.901 3.388 -0.507 1.00 . B B . 22 ARG HA 1 1 8 6133 2 2 22 ARG HB2 H -9.747 3.935 2.010 1.00 . B B . 22 ARG HB2 1 1 8 6134 2 2 22 ARG HB3 H -9.494 5.322 0.965 1.00 . B B . 22 ARG HB3 1 1 8 6135 2 2 22 ARG HD2 H -10.578 6.947 2.672 1.00 . B B . 22 ARG HD2 1 1 8 6136 2 2 22 ARG HD3 H -12.136 6.523 3.407 1.00 . B B . 22 ARG HD3 1 1 8 6137 2 2 22 ARG HE H -9.499 5.147 3.995 1.00 . B B . 22 ARG HE 1 1 8 6138 2 2 22 ARG HG2 H -11.910 5.968 1.090 1.00 . B B . 22 ARG HG2 1 1 8 6139 2 2 22 ARG HG3 H -12.285 4.586 2.068 1.00 . B B . 22 ARG HG3 1 1 8 6140 2 2 22 ARG HH11 H -11.608 3.208 3.384 1.00 . B B . 22 ARG HH11 1 1 8 6141 2 2 22 ARG HH12 H -12.123 2.780 4.963 1.00 . B B . 22 ARG HH12 1 1 8 6142 2 2 22 ARG HH21 H -10.593 5.598 6.262 1.00 . B B . 22 ARG HH21 1 1 8 6143 2 2 22 ARG HH22 H -11.542 4.219 6.688 1.00 . B B . 22 ARG HH22 1 1 8 6144 2 2 22 ARG N N -11.217 4.870 -0.784 1.00 . B B . 22 ARG N 1 1 8 6145 2 2 22 ARG NE N -10.479 5.195 3.980 1.00 . B B . 22 ARG NE 1 1 8 6146 2 2 22 ARG NH1 N -11.646 3.406 4.366 1.00 . B B . 22 ARG NH1 1 1 8 6147 2 2 22 ARG NH2 N -11.080 4.764 6.007 1.00 . B B . 22 ARG NH2 1 1 8 6148 2 2 22 ARG O O -11.770 2.379 1.716 1.00 . B B . 22 ARG O 1 1 8 6149 2 2 23 GLY C C -11.064 -0.862 0.539 1.00 . B B . 23 GLY C 1 1 8 6150 2 2 23 GLY CA C -12.083 0.179 0.028 1.00 . B B . 23 GLY CA 1 1 8 6151 2 2 23 GLY H H -11.077 1.714 -1.183 1.00 . B B . 23 GLY H 1 1 8 6152 2 2 23 GLY HA2 H -12.836 0.298 0.793 1.00 . B B . 23 GLY HA2 1 1 8 6153 2 2 23 GLY HA3 H -12.547 -0.229 -0.856 1.00 . B B . 23 GLY HA3 1 1 8 6154 2 2 23 GLY N N -11.445 1.516 -0.297 1.00 . B B . 23 GLY N 1 1 8 6155 2 2 23 GLY O O -11.446 -1.904 1.020 1.00 . B B . 23 GLY O 1 1 8 6156 2 2 24 PHE C C -8.822 -2.948 0.316 1.00 . B B . 24 PHE C 1 1 8 6157 2 2 24 PHE CA C -8.686 -1.485 0.882 1.00 . B B . 24 PHE CA 1 1 8 6158 2 2 24 PHE CB C -8.682 -1.568 2.466 1.00 . B B . 24 PHE CB 1 1 8 6159 2 2 24 PHE CD1 C -8.516 0.962 2.892 1.00 . B B . 24 PHE CD1 1 1 8 6160 2 2 24 PHE CD2 C -7.612 -0.525 4.502 1.00 . B B . 24 PHE CD2 1 1 8 6161 2 2 24 PHE CE1 C -8.148 2.035 3.681 1.00 . B B . 24 PHE CE1 1 1 8 6162 2 2 24 PHE CE2 C -7.245 0.544 5.291 1.00 . B B . 24 PHE CE2 1 1 8 6163 2 2 24 PHE CG C -8.257 -0.331 3.289 1.00 . B B . 24 PHE CG 1 1 8 6164 2 2 24 PHE CZ C -7.514 1.828 4.881 1.00 . B B . 24 PHE CZ 1 1 8 6165 2 2 24 PHE H H -9.592 0.309 0.006 1.00 . B B . 24 PHE H 1 1 8 6166 2 2 24 PHE HA H -7.754 -1.082 0.497 1.00 . B B . 24 PHE HA 1 1 8 6167 2 2 24 PHE HB2 H -9.684 -1.829 2.778 1.00 . B B . 24 PHE HB2 1 1 8 6168 2 2 24 PHE HB3 H -8.047 -2.390 2.761 1.00 . B B . 24 PHE HB3 1 1 8 6169 2 2 24 PHE HD1 H -9.008 1.138 1.953 1.00 . B B . 24 PHE HD1 1 1 8 6170 2 2 24 PHE HD2 H -7.383 -1.527 4.848 1.00 . B B . 24 PHE HD2 1 1 8 6171 2 2 24 PHE HE1 H -8.354 3.042 3.357 1.00 . B B . 24 PHE HE1 1 1 8 6172 2 2 24 PHE HE2 H -6.745 0.370 6.236 1.00 . B B . 24 PHE HE2 1 1 8 6173 2 2 24 PHE HZ H -7.226 2.667 5.497 1.00 . B B . 24 PHE HZ 1 1 8 6174 2 2 24 PHE N N -9.798 -0.555 0.420 1.00 . B B . 24 PHE N 1 1 8 6175 2 2 24 PHE O O -9.025 -3.898 1.046 1.00 . B B . 24 PHE O 1 1 8 6176 2 2 25 PHE C C -7.955 -5.661 -1.101 1.00 . B B . 25 PHE C 1 1 8 6177 2 2 25 PHE CA C -8.807 -4.456 -1.648 1.00 . B B . 25 PHE CA 1 1 8 6178 2 2 25 PHE CB C -8.508 -4.183 -3.153 1.00 . B B . 25 PHE CB 1 1 8 6179 2 2 25 PHE CD1 C -10.112 -2.222 -3.516 1.00 . B B . 25 PHE CD1 1 1 8 6180 2 2 25 PHE CD2 C -10.457 -4.214 -4.757 1.00 . B B . 25 PHE CD2 1 1 8 6181 2 2 25 PHE CE1 C -11.204 -1.645 -4.126 1.00 . B B . 25 PHE CE1 1 1 8 6182 2 2 25 PHE CE2 C -11.552 -3.642 -5.371 1.00 . B B . 25 PHE CE2 1 1 8 6183 2 2 25 PHE CG C -9.724 -3.513 -3.823 1.00 . B B . 25 PHE CG 1 1 8 6184 2 2 25 PHE CZ C -11.926 -2.356 -5.055 1.00 . B B . 25 PHE CZ 1 1 8 6185 2 2 25 PHE H H -8.505 -2.314 -1.505 1.00 . B B . 25 PHE H 1 1 8 6186 2 2 25 PHE HA H -9.840 -4.768 -1.567 1.00 . B B . 25 PHE HA 1 1 8 6187 2 2 25 PHE HB2 H -7.670 -3.510 -3.249 1.00 . B B . 25 PHE HB2 1 1 8 6188 2 2 25 PHE HB3 H -8.275 -5.095 -3.683 1.00 . B B . 25 PHE HB3 1 1 8 6189 2 2 25 PHE HD1 H -9.564 -1.644 -2.793 1.00 . B B . 25 PHE HD1 1 1 8 6190 2 2 25 PHE HD2 H -10.171 -5.223 -5.013 1.00 . B B . 25 PHE HD2 1 1 8 6191 2 2 25 PHE HE1 H -11.492 -0.631 -3.876 1.00 . B B . 25 PHE HE1 1 1 8 6192 2 2 25 PHE HE2 H -12.117 -4.202 -6.103 1.00 . B B . 25 PHE HE2 1 1 8 6193 2 2 25 PHE HZ H -12.781 -1.902 -5.534 1.00 . B B . 25 PHE HZ 1 1 8 6194 2 2 25 PHE N N -8.694 -3.110 -0.968 1.00 . B B . 25 PHE N 1 1 8 6195 2 2 25 PHE O O -7.017 -6.138 -1.719 1.00 . B B . 25 PHE O 1 1 8 6196 2 2 26 TYR C C -7.800 -8.700 0.075 1.00 . B B . 26 TYR C 1 1 8 6197 2 2 26 TYR CA C -7.615 -7.290 0.743 1.00 . B B . 26 TYR CA 1 1 8 6198 2 2 26 TYR CB C -8.135 -7.248 2.217 1.00 . B B . 26 TYR CB 1 1 8 6199 2 2 26 TYR CD1 C -6.122 -7.621 3.684 1.00 . B B . 26 TYR CD1 1 1 8 6200 2 2 26 TYR CD2 C -6.948 -5.404 3.494 1.00 . B B . 26 TYR CD2 1 1 8 6201 2 2 26 TYR CE1 C -5.127 -7.177 4.535 1.00 . B B . 26 TYR CE1 1 1 8 6202 2 2 26 TYR CE2 C -5.948 -4.966 4.348 1.00 . B B . 26 TYR CE2 1 1 8 6203 2 2 26 TYR CG C -7.039 -6.738 3.158 1.00 . B B . 26 TYR CG 1 1 8 6204 2 2 26 TYR CZ C -5.041 -5.852 4.867 1.00 . B B . 26 TYR CZ 1 1 8 6205 2 2 26 TYR H H -9.071 -5.696 0.497 1.00 . B B . 26 TYR H 1 1 8 6206 2 2 26 TYR HA H -6.552 -7.092 0.742 1.00 . B B . 26 TYR HA 1 1 8 6207 2 2 26 TYR HB2 H -8.989 -6.592 2.309 1.00 . B B . 26 TYR HB2 1 1 8 6208 2 2 26 TYR HB3 H -8.440 -8.229 2.551 1.00 . B B . 26 TYR HB3 1 1 8 6209 2 2 26 TYR HD1 H -6.184 -8.670 3.430 1.00 . B B . 26 TYR HD1 1 1 8 6210 2 2 26 TYR HD2 H -7.661 -4.700 3.087 1.00 . B B . 26 TYR HD2 1 1 8 6211 2 2 26 TYR HE1 H -4.409 -7.873 4.940 1.00 . B B . 26 TYR HE1 1 1 8 6212 2 2 26 TYR HE2 H -5.868 -3.922 4.611 1.00 . B B . 26 TYR HE2 1 1 8 6213 2 2 26 TYR HH H -4.236 -5.854 6.561 1.00 . B B . 26 TYR HH 1 1 8 6214 2 2 26 TYR N N -8.311 -6.136 0.058 1.00 . B B . 26 TYR N 1 1 8 6215 2 2 26 TYR O O -8.282 -9.650 0.654 1.00 . B B . 26 TYR O 1 1 8 6216 2 2 26 TYR OH O -4.050 -5.423 5.720 1.00 . B B . 26 TYR OH 1 1 8 6217 2 2 27 THR C C -6.076 -10.435 -2.515 1.00 . B B . 27 THR C 1 1 8 6218 2 2 27 THR CA C -7.482 -10.062 -1.981 1.00 . B B . 27 THR CA 1 1 8 6219 2 2 27 THR CB C -8.486 -9.787 -3.120 1.00 . B B . 27 THR CB 1 1 8 6220 2 2 27 THR CG2 C -7.965 -8.824 -4.164 1.00 . B B . 27 THR CG2 1 1 8 6221 2 2 27 THR H H -7.016 -7.978 -1.561 1.00 . B B . 27 THR H 1 1 8 6222 2 2 27 THR HA H -7.836 -10.884 -1.376 1.00 . B B . 27 THR HA 1 1 8 6223 2 2 27 THR HB H -9.467 -9.518 -2.740 1.00 . B B . 27 THR HB 1 1 8 6224 2 2 27 THR HG1 H -9.458 -11.221 -4.008 1.00 . B B . 27 THR HG1 1 1 8 6225 2 2 27 THR HG21 H -7.727 -7.872 -3.714 1.00 . B B . 27 THR HG21 1 1 8 6226 2 2 27 THR HG22 H -7.081 -9.225 -4.635 1.00 . B B . 27 THR HG22 1 1 8 6227 2 2 27 THR HG23 H -8.719 -8.682 -4.922 1.00 . B B . 27 THR HG23 1 1 8 6228 2 2 27 THR N N -7.393 -8.785 -1.159 1.00 . B B . 27 THR N 1 1 8 6229 2 2 27 THR O O -5.304 -9.538 -2.806 1.00 . B B . 27 THR O 1 1 8 6230 2 2 27 THR OG1 O -8.535 -10.969 -3.895 1.00 . B B . 27 THR OG1 1 1 8 6231 2 2 28 PRO C C -3.481 -11.141 -1.524 1.00 . B B . 28 PRO C 1 1 8 6232 2 2 28 PRO CA C -4.321 -12.136 -2.357 1.00 . B B . 28 PRO CA 1 1 8 6233 2 2 28 PRO CB C -3.772 -12.426 -3.764 1.00 . B B . 28 PRO CB 1 1 8 6234 2 2 28 PRO CD C -6.165 -12.238 -3.990 1.00 . B B . 28 PRO CD 1 1 8 6235 2 2 28 PRO CG C -4.981 -13.129 -4.406 1.00 . B B . 28 PRO CG 1 1 8 6236 2 2 28 PRO HA H -4.334 -13.041 -1.772 1.00 . B B . 28 PRO HA 1 1 8 6237 2 2 28 PRO HB2 H -3.521 -11.515 -4.290 1.00 . B B . 28 PRO HB2 1 1 8 6238 2 2 28 PRO HB3 H -2.908 -13.077 -3.731 1.00 . B B . 28 PRO HB3 1 1 8 6239 2 2 28 PRO HD2 H -6.328 -11.440 -4.706 1.00 . B B . 28 PRO HD2 1 1 8 6240 2 2 28 PRO HD3 H -7.075 -12.816 -3.882 1.00 . B B . 28 PRO HD3 1 1 8 6241 2 2 28 PRO HG2 H -4.889 -13.161 -5.483 1.00 . B B . 28 PRO HG2 1 1 8 6242 2 2 28 PRO HG3 H -5.108 -14.135 -4.030 1.00 . B B . 28 PRO HG3 1 1 8 6243 2 2 28 PRO N N -5.743 -11.703 -2.650 1.00 . B B . 28 PRO N 1 1 8 6244 2 2 28 PRO O O -2.539 -10.503 -1.965 1.00 . B B . 28 PRO O 1 1 8 6245 2 2 29 LYS C C -2.916 -10.769 2.086 1.00 . B B . 29 LYS C 1 1 8 6246 2 2 29 LYS CA C -3.254 -10.147 0.700 1.00 . B B . 29 LYS CA 1 1 8 6247 2 2 29 LYS CB C -4.214 -8.929 0.779 1.00 . B B . 29 LYS CB 1 1 8 6248 2 2 29 LYS CD C -2.663 -7.574 -0.746 1.00 . B B . 29 LYS CD 1 1 8 6249 2 2 29 LYS CE C -3.587 -7.241 -1.906 1.00 . B B . 29 LYS CE 1 1 8 6250 2 2 29 LYS CG C -3.402 -7.635 0.648 1.00 . B B . 29 LYS CG 1 1 8 6251 2 2 29 LYS H H -4.686 -11.587 -0.039 1.00 . B B . 29 LYS H 1 1 8 6252 2 2 29 LYS HA H -2.291 -9.857 0.319 1.00 . B B . 29 LYS HA 1 1 8 6253 2 2 29 LYS HB2 H -4.966 -8.986 0.004 1.00 . B B . 29 LYS HB2 1 1 8 6254 2 2 29 LYS HB3 H -4.727 -8.933 1.732 1.00 . B B . 29 LYS HB3 1 1 8 6255 2 2 29 LYS HD2 H -1.937 -6.778 -0.705 1.00 . B B . 29 LYS HD2 1 1 8 6256 2 2 29 LYS HD3 H -2.112 -8.470 -0.959 1.00 . B B . 29 LYS HD3 1 1 8 6257 2 2 29 LYS HE2 H -4.620 -7.474 -1.658 1.00 . B B . 29 LYS HE2 1 1 8 6258 2 2 29 LYS HE3 H -3.532 -6.183 -2.148 1.00 . B B . 29 LYS HE3 1 1 8 6259 2 2 29 LYS HG2 H -4.096 -6.812 0.741 1.00 . B B . 29 LYS HG2 1 1 8 6260 2 2 29 LYS HG3 H -2.698 -7.556 1.468 1.00 . B B . 29 LYS HG3 1 1 8 6261 2 2 29 LYS HZ1 H -2.431 -8.786 -2.727 1.00 . B B . 29 LYS HZ1 1 1 8 6262 2 2 29 LYS HZ2 H -3.919 -8.615 -3.418 1.00 . B B . 29 LYS HZ2 1 1 8 6263 2 2 29 LYS HZ3 H -2.660 -7.481 -3.781 1.00 . B B . 29 LYS HZ3 1 1 8 6264 2 2 29 LYS N N -3.909 -11.050 -0.297 1.00 . B B . 29 LYS N 1 1 8 6265 2 2 29 LYS NZ N -3.113 -8.070 -3.052 1.00 . B B . 29 LYS NZ 1 1 8 6266 2 2 29 LYS O O -3.513 -10.482 3.100 1.00 . B B . 29 LYS O 1 1 8 6267 2 2 30 THR C C 0.053 -12.123 3.542 1.00 . B B . 30 THR C 1 1 8 6268 2 2 30 THR CA C -1.453 -12.340 3.308 1.00 . B B . 30 THR CA 1 1 8 6269 2 2 30 THR CB C -1.733 -13.853 3.185 1.00 . B B . 30 THR CB 1 1 8 6270 2 2 30 THR CG2 C -0.953 -14.527 2.066 1.00 . B B . 30 THR CG2 1 1 8 6271 2 2 30 THR H H -1.504 -11.811 1.205 1.00 . B B . 30 THR H 1 1 8 6272 2 2 30 THR HA H -1.968 -11.964 4.180 1.00 . B B . 30 THR HA 1 1 8 6273 2 2 30 THR HB H -2.794 -14.083 3.198 1.00 . B B . 30 THR HB 1 1 8 6274 2 2 30 THR HG1 H -0.653 -15.226 4.079 1.00 . B B . 30 THR HG1 1 1 8 6275 2 2 30 THR HG21 H 0.112 -14.419 2.217 1.00 . B B . 30 THR HG21 1 1 8 6276 2 2 30 THR HG22 H -1.196 -15.579 2.034 1.00 . B B . 30 THR HG22 1 1 8 6277 2 2 30 THR HG23 H -1.213 -14.085 1.118 1.00 . B B . 30 THR HG23 1 1 8 6278 2 2 30 THR N N -1.938 -11.629 2.060 1.00 . B B . 30 THR N 1 1 8 6279 2 2 30 THR O O 0.737 -11.552 2.708 1.00 . B B . 30 THR O 1 1 8 6280 2 2 30 THR OG1 O -1.089 -14.401 4.318 1.00 . B B . 30 THR OG1 1 1 9 6281 1 1 1 GLY C C -1.879 -5.673 -1.688 1.00 . A A . 1 GLY C 1 1 9 6282 1 1 1 GLY CA C -3.289 -6.212 -1.549 1.00 . A A . 1 GLY CA 1 1 9 6283 1 1 1 GLY HA2 H -3.511 -6.812 -2.417 1.00 . A A . 1 GLY HA2 1 1 9 6284 1 1 1 GLY HA3 H -3.959 -5.369 -1.519 1.00 . A A . 1 GLY HA3 1 1 9 6285 1 1 1 GLY N N -3.437 -7.042 -0.302 1.00 . A A . 1 GLY N 1 1 9 6286 1 1 1 GLY O O -1.172 -6.027 -2.607 1.00 . A A . 1 GLY O 1 1 9 6287 1 1 2 ILE C C 0.819 -4.923 0.196 1.00 . A A . 2 ILE C 1 1 9 6288 1 1 2 ILE CA C -0.166 -4.192 -0.699 1.00 . A A . 2 ILE CA 1 1 9 6289 1 1 2 ILE CB C -0.252 -2.753 -0.149 1.00 . A A . 2 ILE CB 1 1 9 6290 1 1 2 ILE CD1 C -1.116 -1.391 1.802 1.00 . A A . 2 ILE CD1 1 1 9 6291 1 1 2 ILE CG1 C -1.334 -2.653 0.959 1.00 . A A . 2 ILE CG1 1 1 9 6292 1 1 2 ILE CG2 C -0.549 -1.803 -1.288 1.00 . A A . 2 ILE CG2 1 1 9 6293 1 1 2 ILE H H -2.191 -4.649 -0.064 1.00 . A A . 2 ILE H 1 1 9 6294 1 1 2 ILE HA H 0.265 -4.180 -1.691 1.00 . A A . 2 ILE HA 1 1 9 6295 1 1 2 ILE HB H 0.702 -2.464 0.278 1.00 . A A . 2 ILE HB 1 1 9 6296 1 1 2 ILE HD11 H -1.101 -0.494 1.207 1.00 . A A . 2 ILE HD11 1 1 9 6297 1 1 2 ILE HD12 H -1.887 -1.289 2.551 1.00 . A A . 2 ILE HD12 1 1 9 6298 1 1 2 ILE HD13 H -0.184 -1.480 2.318 1.00 . A A . 2 ILE HD13 1 1 9 6299 1 1 2 ILE HG12 H -2.311 -2.616 0.506 1.00 . A A . 2 ILE HG12 1 1 9 6300 1 1 2 ILE HG13 H -1.301 -3.497 1.631 1.00 . A A . 2 ILE HG13 1 1 9 6301 1 1 2 ILE HG21 H -1.468 -2.086 -1.768 1.00 . A A . 2 ILE HG21 1 1 9 6302 1 1 2 ILE HG22 H -0.640 -0.800 -0.901 1.00 . A A . 2 ILE HG22 1 1 9 6303 1 1 2 ILE HG23 H 0.240 -1.815 -2.022 1.00 . A A . 2 ILE HG23 1 1 9 6304 1 1 2 ILE N N -1.528 -4.846 -0.753 1.00 . A A . 2 ILE N 1 1 9 6305 1 1 2 ILE O O 1.981 -5.033 -0.112 1.00 . A A . 2 ILE O 1 1 9 6306 1 1 3 VAL C C 2.464 -6.826 1.797 1.00 . A A . 3 VAL C 1 1 9 6307 1 1 3 VAL CA C 1.182 -6.119 2.290 1.00 . A A . 3 VAL CA 1 1 9 6308 1 1 3 VAL CB C 0.210 -7.120 3.017 1.00 . A A . 3 VAL CB 1 1 9 6309 1 1 3 VAL CG1 C -0.713 -6.301 3.923 1.00 . A A . 3 VAL CG1 1 1 9 6310 1 1 3 VAL CG2 C -0.748 -7.836 2.021 1.00 . A A . 3 VAL CG2 1 1 9 6311 1 1 3 VAL H H -0.610 -5.236 1.487 1.00 . A A . 3 VAL H 1 1 9 6312 1 1 3 VAL HA H 1.567 -5.368 2.960 1.00 . A A . 3 VAL HA 1 1 9 6313 1 1 3 VAL HB H 0.774 -7.850 3.591 1.00 . A A . 3 VAL HB 1 1 9 6314 1 1 3 VAL HG11 H -0.145 -5.743 4.653 1.00 . A A . 3 VAL HG11 1 1 9 6315 1 1 3 VAL HG12 H -1.291 -5.605 3.334 1.00 . A A . 3 VAL HG12 1 1 9 6316 1 1 3 VAL HG13 H -1.394 -6.957 4.445 1.00 . A A . 3 VAL HG13 1 1 9 6317 1 1 3 VAL HG21 H -1.362 -7.132 1.478 1.00 . A A . 3 VAL HG21 1 1 9 6318 1 1 3 VAL HG22 H -0.210 -8.426 1.295 1.00 . A A . 3 VAL HG22 1 1 9 6319 1 1 3 VAL HG23 H -1.407 -8.507 2.551 1.00 . A A . 3 VAL HG23 1 1 9 6320 1 1 3 VAL N N 0.336 -5.380 1.304 1.00 . A A . 3 VAL N 1 1 9 6321 1 1 3 VAL O O 3.537 -6.267 1.951 1.00 . A A . 3 VAL O 1 1 9 6322 1 1 4 GLU C C 4.273 -8.022 -0.516 1.00 . A A . 4 GLU C 1 1 9 6323 1 1 4 GLU CA C 3.615 -8.672 0.726 1.00 . A A . 4 GLU CA 1 1 9 6324 1 1 4 GLU CB C 3.211 -10.156 0.461 1.00 . A A . 4 GLU CB 1 1 9 6325 1 1 4 GLU CD C 0.984 -9.821 -0.924 1.00 . A A . 4 GLU CD 1 1 9 6326 1 1 4 GLU CG C 2.396 -10.367 -0.881 1.00 . A A . 4 GLU CG 1 1 9 6327 1 1 4 GLU H H 1.506 -8.392 1.027 1.00 . A A . 4 GLU H 1 1 9 6328 1 1 4 GLU HA H 4.344 -8.623 1.524 1.00 . A A . 4 GLU HA 1 1 9 6329 1 1 4 GLU HB2 H 4.108 -10.761 0.435 1.00 . A A . 4 GLU HB2 1 1 9 6330 1 1 4 GLU HB3 H 2.609 -10.507 1.290 1.00 . A A . 4 GLU HB3 1 1 9 6331 1 1 4 GLU HG2 H 2.920 -9.937 -1.715 1.00 . A A . 4 GLU HG2 1 1 9 6332 1 1 4 GLU HG3 H 2.322 -11.428 -1.065 1.00 . A A . 4 GLU HG3 1 1 9 6333 1 1 4 GLU N N 2.376 -7.974 1.195 1.00 . A A . 4 GLU N 1 1 9 6334 1 1 4 GLU O O 5.058 -8.604 -1.240 1.00 . A A . 4 GLU O 1 1 9 6335 1 1 4 GLU OE1 O 0.780 -8.627 -0.861 1.00 . A A . 4 GLU OE1 1 1 9 6336 1 1 4 GLU OE2 O 0.080 -10.618 -1.046 1.00 . A A . 4 GLU OE2 1 1 9 6337 1 1 5 GLN C C 5.214 -4.745 -1.277 1.00 . A A . 5 GLN C 1 1 9 6338 1 1 5 GLN CA C 4.472 -5.959 -1.873 1.00 . A A . 5 GLN CA 1 1 9 6339 1 1 5 GLN CB C 3.235 -5.492 -2.742 1.00 . A A . 5 GLN CB 1 1 9 6340 1 1 5 GLN CD C 2.532 -7.724 -3.904 1.00 . A A . 5 GLN CD 1 1 9 6341 1 1 5 GLN CG C 2.164 -6.617 -2.934 1.00 . A A . 5 GLN CG 1 1 9 6342 1 1 5 GLN H H 3.316 -6.381 -0.113 1.00 . A A . 5 GLN H 1 1 9 6343 1 1 5 GLN HA H 5.233 -6.485 -2.440 1.00 . A A . 5 GLN HA 1 1 9 6344 1 1 5 GLN HB2 H 2.732 -4.649 -2.276 1.00 . A A . 5 GLN HB2 1 1 9 6345 1 1 5 GLN HB3 H 3.559 -5.164 -3.715 1.00 . A A . 5 GLN HB3 1 1 9 6346 1 1 5 GLN HE21 H 3.972 -8.514 -2.821 1.00 . A A . 5 GLN HE21 1 1 9 6347 1 1 5 GLN HE22 H 3.653 -9.239 -4.330 1.00 . A A . 5 GLN HE22 1 1 9 6348 1 1 5 GLN HG2 H 1.966 -7.075 -1.985 1.00 . A A . 5 GLN HG2 1 1 9 6349 1 1 5 GLN HG3 H 1.242 -6.185 -3.288 1.00 . A A . 5 GLN HG3 1 1 9 6350 1 1 5 GLN N N 3.952 -6.786 -0.735 1.00 . A A . 5 GLN N 1 1 9 6351 1 1 5 GLN NE2 N 3.469 -8.561 -3.656 1.00 . A A . 5 GLN NE2 1 1 9 6352 1 1 5 GLN O O 6.396 -4.536 -1.429 1.00 . A A . 5 GLN O 1 1 9 6353 1 1 5 GLN OE1 O 1.952 -7.866 -4.955 1.00 . A A . 5 GLN OE1 1 1 9 6354 1 1 6 CYS C C 5.904 -3.071 1.274 1.00 . A A . 6 CYS C 1 1 9 6355 1 1 6 CYS CA C 5.030 -2.737 0.079 1.00 . A A . 6 CYS CA 1 1 9 6356 1 1 6 CYS CB C 3.803 -1.919 0.413 1.00 . A A . 6 CYS CB 1 1 9 6357 1 1 6 CYS H H 3.538 -4.222 -0.422 1.00 . A A . 6 CYS H 1 1 9 6358 1 1 6 CYS HA H 5.648 -2.195 -0.626 1.00 . A A . 6 CYS HA 1 1 9 6359 1 1 6 CYS HB2 H 3.219 -2.418 1.171 1.00 . A A . 6 CYS HB2 1 1 9 6360 1 1 6 CYS HB3 H 4.118 -0.961 0.801 1.00 . A A . 6 CYS HB3 1 1 9 6361 1 1 6 CYS HG H 3.065 -0.780 -1.393 1.00 . A A . 6 CYS HG 1 1 9 6362 1 1 6 CYS N N 4.476 -3.969 -0.555 1.00 . A A . 6 CYS N 1 1 9 6363 1 1 6 CYS O O 6.895 -2.429 1.542 1.00 . A A . 6 CYS O 1 1 9 6364 1 1 6 CYS SG S 2.747 -1.607 -1.019 1.00 . A A . 6 CYS SG 1 1 9 6365 1 1 7 CYS C C 7.114 -5.820 2.842 1.00 . A A . 7 CYS C 1 1 9 6366 1 1 7 CYS CA C 6.282 -4.531 3.150 1.00 . A A . 7 CYS CA 1 1 9 6367 1 1 7 CYS CB C 5.156 -4.636 4.193 1.00 . A A . 7 CYS CB 1 1 9 6368 1 1 7 CYS H H 4.716 -4.615 1.698 1.00 . A A . 7 CYS H 1 1 9 6369 1 1 7 CYS HA H 6.979 -3.760 3.452 1.00 . A A . 7 CYS HA 1 1 9 6370 1 1 7 CYS HB2 H 4.688 -3.653 4.197 1.00 . A A . 7 CYS HB2 1 1 9 6371 1 1 7 CYS HB3 H 4.388 -5.295 3.821 1.00 . A A . 7 CYS HB3 1 1 9 6372 1 1 7 CYS HG H 5.674 -6.059 5.914 1.00 . A A . 7 CYS HG 1 1 9 6373 1 1 7 CYS N N 5.515 -4.103 1.955 1.00 . A A . 7 CYS N 1 1 9 6374 1 1 7 CYS O O 7.702 -6.436 3.706 1.00 . A A . 7 CYS O 1 1 9 6375 1 1 7 CYS SG S 5.592 -5.103 5.891 1.00 . A A . 7 CYS SG 1 1 9 6376 1 1 8 THR C C 8.357 -7.398 -0.364 1.00 . A A . 8 THR C 1 1 9 6377 1 1 8 THR CA C 7.914 -7.430 1.123 1.00 . A A . 8 THR CA 1 1 9 6378 1 1 8 THR CB C 7.090 -8.735 1.312 1.00 . A A . 8 THR CB 1 1 9 6379 1 1 8 THR CG2 C 8.008 -9.914 1.511 1.00 . A A . 8 THR CG2 1 1 9 6380 1 1 8 THR H H 6.627 -5.650 0.955 1.00 . A A . 8 THR H 1 1 9 6381 1 1 8 THR HA H 8.820 -7.506 1.709 1.00 . A A . 8 THR HA 1 1 9 6382 1 1 8 THR HB H 6.335 -8.936 0.569 1.00 . A A . 8 THR HB 1 1 9 6383 1 1 8 THR HG1 H 7.085 -8.139 3.184 1.00 . A A . 8 THR HG1 1 1 9 6384 1 1 8 THR HG21 H 8.628 -9.767 2.382 1.00 . A A . 8 THR HG21 1 1 9 6385 1 1 8 THR HG22 H 7.414 -10.801 1.662 1.00 . A A . 8 THR HG22 1 1 9 6386 1 1 8 THR HG23 H 8.641 -10.057 0.648 1.00 . A A . 8 THR HG23 1 1 9 6387 1 1 8 THR N N 7.136 -6.198 1.584 1.00 . A A . 8 THR N 1 1 9 6388 1 1 8 THR O O 9.532 -7.442 -0.653 1.00 . A A . 8 THR O 1 1 9 6389 1 1 8 THR OG1 O 6.542 -8.707 2.615 1.00 . A A . 8 THR OG1 1 1 9 6390 1 1 9 SER C C 7.529 -5.898 -3.417 1.00 . A A . 9 SER C 1 1 9 6391 1 1 9 SER CA C 7.792 -7.282 -2.781 1.00 . A A . 9 SER CA 1 1 9 6392 1 1 9 SER CB C 6.964 -8.319 -3.564 1.00 . A A . 9 SER CB 1 1 9 6393 1 1 9 SER H H 6.500 -7.284 -1.013 1.00 . A A . 9 SER H 1 1 9 6394 1 1 9 SER HA H 8.837 -7.524 -2.916 1.00 . A A . 9 SER HA 1 1 9 6395 1 1 9 SER HB2 H 5.924 -8.040 -3.655 1.00 . A A . 9 SER HB2 1 1 9 6396 1 1 9 SER HB3 H 7.383 -8.465 -4.551 1.00 . A A . 9 SER HB3 1 1 9 6397 1 1 9 SER HG H 6.381 -9.478 -2.165 1.00 . A A . 9 SER HG 1 1 9 6398 1 1 9 SER N N 7.435 -7.317 -1.292 1.00 . A A . 9 SER N 1 1 9 6399 1 1 9 SER O O 6.533 -5.654 -4.065 1.00 . A A . 9 SER O 1 1 9 6400 1 1 9 SER OG O 7.115 -9.505 -2.796 1.00 . A A . 9 SER OG 1 1 9 6401 1 1 10 ILE C C 7.312 -2.970 -4.311 1.00 . A A . 10 ILE C 1 1 9 6402 1 1 10 ILE CA C 8.564 -3.607 -3.634 1.00 . A A . 10 ILE CA 1 1 9 6403 1 1 10 ILE CB C 9.823 -3.482 -4.577 1.00 . A A . 10 ILE CB 1 1 9 6404 1 1 10 ILE CD1 C 12.376 -3.728 -4.584 1.00 . A A . 10 ILE CD1 1 1 9 6405 1 1 10 ILE CG1 C 11.094 -3.670 -3.710 1.00 . A A . 10 ILE CG1 1 1 9 6406 1 1 10 ILE CG2 C 9.867 -2.060 -5.206 1.00 . A A . 10 ILE CG2 1 1 9 6407 1 1 10 ILE H H 9.211 -5.426 -2.665 1.00 . A A . 10 ILE H 1 1 9 6408 1 1 10 ILE HA H 8.669 -3.033 -2.733 1.00 . A A . 10 ILE HA 1 1 9 6409 1 1 10 ILE HB H 9.771 -4.243 -5.348 1.00 . A A . 10 ILE HB 1 1 9 6410 1 1 10 ILE HD11 H 12.319 -4.553 -5.280 1.00 . A A . 10 ILE HD11 1 1 9 6411 1 1 10 ILE HD12 H 12.521 -2.816 -5.143 1.00 . A A . 10 ILE HD12 1 1 9 6412 1 1 10 ILE HD13 H 13.239 -3.878 -3.948 1.00 . A A . 10 ILE HD13 1 1 9 6413 1 1 10 ILE HG12 H 11.170 -2.861 -2.991 1.00 . A A . 10 ILE HG12 1 1 9 6414 1 1 10 ILE HG13 H 11.020 -4.589 -3.150 1.00 . A A . 10 ILE HG13 1 1 9 6415 1 1 10 ILE HG21 H 9.890 -1.329 -4.417 1.00 . A A . 10 ILE HG21 1 1 9 6416 1 1 10 ILE HG22 H 10.736 -1.942 -5.831 1.00 . A A . 10 ILE HG22 1 1 9 6417 1 1 10 ILE HG23 H 8.995 -1.867 -5.814 1.00 . A A . 10 ILE HG23 1 1 9 6418 1 1 10 ILE N N 8.483 -5.058 -3.177 1.00 . A A . 10 ILE N 1 1 9 6419 1 1 10 ILE O O 7.031 -3.086 -5.491 1.00 . A A . 10 ILE O 1 1 9 6420 1 1 11 CYS C C 5.216 -0.133 -3.279 1.00 . A A . 11 CYS C 1 1 9 6421 1 1 11 CYS CA C 5.334 -1.565 -3.855 1.00 . A A . 11 CYS CA 1 1 9 6422 1 1 11 CYS CB C 4.196 -2.463 -3.404 1.00 . A A . 11 CYS CB 1 1 9 6423 1 1 11 CYS H H 6.909 -2.227 -2.545 1.00 . A A . 11 CYS H 1 1 9 6424 1 1 11 CYS HA H 5.320 -1.486 -4.919 1.00 . A A . 11 CYS HA 1 1 9 6425 1 1 11 CYS HB2 H 4.136 -3.271 -4.117 1.00 . A A . 11 CYS HB2 1 1 9 6426 1 1 11 CYS HB3 H 4.510 -2.867 -2.471 1.00 . A A . 11 CYS HB3 1 1 9 6427 1 1 11 CYS HG H 1.996 -1.996 -3.914 1.00 . A A . 11 CYS HG 1 1 9 6428 1 1 11 CYS N N 6.591 -2.280 -3.469 1.00 . A A . 11 CYS N 1 1 9 6429 1 1 11 CYS O O 5.028 0.060 -2.095 1.00 . A A . 11 CYS O 1 1 9 6430 1 1 11 CYS SG S 2.529 -1.810 -3.140 1.00 . A A . 11 CYS SG 1 1 9 6431 1 1 12 SER C C 3.881 2.956 -3.860 1.00 . A A . 12 SER C 1 1 9 6432 1 1 12 SER CA C 5.227 2.281 -3.683 1.00 . A A . 12 SER CA 1 1 9 6433 1 1 12 SER CB C 6.250 3.156 -4.430 1.00 . A A . 12 SER CB 1 1 9 6434 1 1 12 SER H H 5.480 0.588 -5.068 1.00 . A A . 12 SER H 1 1 9 6435 1 1 12 SER HA H 5.323 2.302 -2.638 1.00 . A A . 12 SER HA 1 1 9 6436 1 1 12 SER HB2 H 5.905 3.149 -5.442 1.00 . A A . 12 SER HB2 1 1 9 6437 1 1 12 SER HB3 H 6.286 4.178 -4.097 1.00 . A A . 12 SER HB3 1 1 9 6438 1 1 12 SER HG H 7.937 2.727 -5.218 1.00 . A A . 12 SER HG 1 1 9 6439 1 1 12 SER N N 5.326 0.840 -4.136 1.00 . A A . 12 SER N 1 1 9 6440 1 1 12 SER O O 2.890 2.313 -4.101 1.00 . A A . 12 SER O 1 1 9 6441 1 1 12 SER OG O 7.555 2.597 -4.330 1.00 . A A . 12 SER OG 1 1 9 6442 1 1 13 LEU C C 1.810 4.540 -4.948 1.00 . A A . 13 LEU C 1 1 9 6443 1 1 13 LEU CA C 2.675 5.137 -3.853 1.00 . A A . 13 LEU CA 1 1 9 6444 1 1 13 LEU CB C 3.323 6.522 -4.157 1.00 . A A . 13 LEU CB 1 1 9 6445 1 1 13 LEU CD1 C 1.430 7.367 -5.641 1.00 . A A . 13 LEU CD1 1 1 9 6446 1 1 13 LEU CD2 C 1.556 7.993 -3.250 1.00 . A A . 13 LEU CD2 1 1 9 6447 1 1 13 LEU CG C 2.370 7.671 -4.484 1.00 . A A . 13 LEU CG 1 1 9 6448 1 1 13 LEU H H 4.695 4.723 -3.510 1.00 . A A . 13 LEU H 1 1 9 6449 1 1 13 LEU HA H 2.079 5.132 -2.951 1.00 . A A . 13 LEU HA 1 1 9 6450 1 1 13 LEU HB2 H 3.886 6.810 -3.280 1.00 . A A . 13 LEU HB2 1 1 9 6451 1 1 13 LEU HB3 H 4.025 6.430 -4.971 1.00 . A A . 13 LEU HB3 1 1 9 6452 1 1 13 LEU HD11 H 1.951 7.129 -6.551 1.00 . A A . 13 LEU HD11 1 1 9 6453 1 1 13 LEU HD12 H 0.742 6.570 -5.403 1.00 . A A . 13 LEU HD12 1 1 9 6454 1 1 13 LEU HD13 H 0.800 8.227 -5.824 1.00 . A A . 13 LEU HD13 1 1 9 6455 1 1 13 LEU HD21 H 2.179 8.288 -2.421 1.00 . A A . 13 LEU HD21 1 1 9 6456 1 1 13 LEU HD22 H 0.866 8.794 -3.476 1.00 . A A . 13 LEU HD22 1 1 9 6457 1 1 13 LEU HD23 H 0.959 7.138 -2.963 1.00 . A A . 13 LEU HD23 1 1 9 6458 1 1 13 LEU HG H 2.937 8.533 -4.798 1.00 . A A . 13 LEU HG 1 1 9 6459 1 1 13 LEU N N 3.873 4.257 -3.717 1.00 . A A . 13 LEU N 1 1 9 6460 1 1 13 LEU O O 0.715 4.054 -4.776 1.00 . A A . 13 LEU O 1 1 9 6461 1 1 14 TYR C C 1.154 2.661 -7.128 1.00 . A A . 14 TYR C 1 1 9 6462 1 1 14 TYR CA C 1.775 4.055 -7.305 1.00 . A A . 14 TYR CA 1 1 9 6463 1 1 14 TYR CB C 2.778 4.016 -8.508 1.00 . A A . 14 TYR CB 1 1 9 6464 1 1 14 TYR CD1 C 5.001 4.968 -7.802 1.00 . A A . 14 TYR CD1 1 1 9 6465 1 1 14 TYR CD2 C 4.848 2.619 -8.060 1.00 . A A . 14 TYR CD2 1 1 9 6466 1 1 14 TYR CE1 C 6.332 4.841 -7.441 1.00 . A A . 14 TYR CE1 1 1 9 6467 1 1 14 TYR CE2 C 6.178 2.496 -7.699 1.00 . A A . 14 TYR CE2 1 1 9 6468 1 1 14 TYR CG C 4.250 3.856 -8.113 1.00 . A A . 14 TYR CG 1 1 9 6469 1 1 14 TYR CZ C 6.930 3.599 -7.386 1.00 . A A . 14 TYR CZ 1 1 9 6470 1 1 14 TYR H H 3.346 4.963 -6.019 1.00 . A A . 14 TYR H 1 1 9 6471 1 1 14 TYR HA H 0.965 4.747 -7.520 1.00 . A A . 14 TYR HA 1 1 9 6472 1 1 14 TYR HB2 H 2.500 3.170 -9.133 1.00 . A A . 14 TYR HB2 1 1 9 6473 1 1 14 TYR HB3 H 2.645 4.901 -9.106 1.00 . A A . 14 TYR HB3 1 1 9 6474 1 1 14 TYR HD1 H 4.542 5.946 -7.846 1.00 . A A . 14 TYR HD1 1 1 9 6475 1 1 14 TYR HD2 H 4.279 1.736 -8.303 1.00 . A A . 14 TYR HD2 1 1 9 6476 1 1 14 TYR HE1 H 6.901 5.726 -7.200 1.00 . A A . 14 TYR HE1 1 1 9 6477 1 1 14 TYR HE2 H 6.641 1.522 -7.658 1.00 . A A . 14 TYR HE2 1 1 9 6478 1 1 14 TYR HH H 8.596 4.342 -6.938 1.00 . A A . 14 TYR HH 1 1 9 6479 1 1 14 TYR N N 2.443 4.584 -6.078 1.00 . A A . 14 TYR N 1 1 9 6480 1 1 14 TYR O O 0.124 2.387 -7.706 1.00 . A A . 14 TYR O 1 1 9 6481 1 1 14 TYR OH O 8.242 3.441 -6.998 1.00 . A A . 14 TYR OH 1 1 9 6482 1 1 15 GLN C C 0.030 0.504 -5.128 1.00 . A A . 15 GLN C 1 1 9 6483 1 1 15 GLN CA C 1.108 0.451 -6.204 1.00 . A A . 15 GLN CA 1 1 9 6484 1 1 15 GLN CB C 2.258 -0.527 -5.932 1.00 . A A . 15 GLN CB 1 1 9 6485 1 1 15 GLN CD C 4.449 -1.103 -7.063 1.00 . A A . 15 GLN CD 1 1 9 6486 1 1 15 GLN CG C 3.004 -0.752 -7.309 1.00 . A A . 15 GLN CG 1 1 9 6487 1 1 15 GLN H H 2.593 2.022 -5.849 1.00 . A A . 15 GLN H 1 1 9 6488 1 1 15 GLN HA H 0.568 0.242 -7.095 1.00 . A A . 15 GLN HA 1 1 9 6489 1 1 15 GLN HB2 H 2.918 -0.129 -5.171 1.00 . A A . 15 GLN HB2 1 1 9 6490 1 1 15 GLN HB3 H 1.851 -1.470 -5.595 1.00 . A A . 15 GLN HB3 1 1 9 6491 1 1 15 GLN HE21 H 4.264 -3.025 -7.471 1.00 . A A . 15 GLN HE21 1 1 9 6492 1 1 15 GLN HE22 H 5.794 -2.508 -6.944 1.00 . A A . 15 GLN HE22 1 1 9 6493 1 1 15 GLN HG2 H 2.556 -1.558 -7.869 1.00 . A A . 15 GLN HG2 1 1 9 6494 1 1 15 GLN HG3 H 2.984 0.135 -7.922 1.00 . A A . 15 GLN HG3 1 1 9 6495 1 1 15 GLN N N 1.756 1.799 -6.343 1.00 . A A . 15 GLN N 1 1 9 6496 1 1 15 GLN NE2 N 4.860 -2.314 -7.174 1.00 . A A . 15 GLN NE2 1 1 9 6497 1 1 15 GLN O O -0.983 -0.163 -5.182 1.00 . A A . 15 GLN O 1 1 9 6498 1 1 15 GLN OE1 O 5.244 -0.252 -6.739 1.00 . A A . 15 GLN OE1 1 1 9 6499 1 1 16 LEU C C -2.014 1.940 -3.782 1.00 . A A . 16 LEU C 1 1 9 6500 1 1 16 LEU CA C -0.707 1.484 -3.051 1.00 . A A . 16 LEU CA 1 1 9 6501 1 1 16 LEU CB C -0.155 2.560 -2.040 1.00 . A A . 16 LEU CB 1 1 9 6502 1 1 16 LEU CD1 C 1.585 1.005 -1.060 1.00 . A A . 16 LEU CD1 1 1 9 6503 1 1 16 LEU CD2 C 0.782 2.858 0.295 1.00 . A A . 16 LEU CD2 1 1 9 6504 1 1 16 LEU CG C 0.357 1.848 -0.755 1.00 . A A . 16 LEU CG 1 1 9 6505 1 1 16 LEU H H 1.116 1.777 -4.194 1.00 . A A . 16 LEU H 1 1 9 6506 1 1 16 LEU HA H -0.833 0.519 -2.620 1.00 . A A . 16 LEU HA 1 1 9 6507 1 1 16 LEU HB2 H 0.650 3.115 -2.499 1.00 . A A . 16 LEU HB2 1 1 9 6508 1 1 16 LEU HB3 H -0.931 3.268 -1.787 1.00 . A A . 16 LEU HB3 1 1 9 6509 1 1 16 LEU HD11 H 2.405 1.595 -1.441 1.00 . A A . 16 LEU HD11 1 1 9 6510 1 1 16 LEU HD12 H 1.930 0.520 -0.156 1.00 . A A . 16 LEU HD12 1 1 9 6511 1 1 16 LEU HD13 H 1.352 0.242 -1.784 1.00 . A A . 16 LEU HD13 1 1 9 6512 1 1 16 LEU HD21 H 1.584 3.478 -0.074 1.00 . A A . 16 LEU HD21 1 1 9 6513 1 1 16 LEU HD22 H -0.048 3.478 0.591 1.00 . A A . 16 LEU HD22 1 1 9 6514 1 1 16 LEU HD23 H 1.142 2.336 1.169 1.00 . A A . 16 LEU HD23 1 1 9 6515 1 1 16 LEU HG H -0.427 1.223 -0.345 1.00 . A A . 16 LEU HG 1 1 9 6516 1 1 16 LEU N N 0.272 1.313 -4.154 1.00 . A A . 16 LEU N 1 1 9 6517 1 1 16 LEU O O -3.109 1.461 -3.559 1.00 . A A . 16 LEU O 1 1 9 6518 1 1 17 GLU C C -3.615 2.451 -6.503 1.00 . A A . 17 GLU C 1 1 9 6519 1 1 17 GLU CA C -2.985 3.421 -5.488 1.00 . A A . 17 GLU CA 1 1 9 6520 1 1 17 GLU CB C -2.392 4.687 -6.084 1.00 . A A . 17 GLU CB 1 1 9 6521 1 1 17 GLU CD C -1.717 6.999 -5.056 1.00 . A A . 17 GLU CD 1 1 9 6522 1 1 17 GLU CG C -2.271 5.603 -4.808 1.00 . A A . 17 GLU CG 1 1 9 6523 1 1 17 GLU H H -0.937 3.216 -4.811 1.00 . A A . 17 GLU H 1 1 9 6524 1 1 17 GLU HA H -3.790 3.731 -4.861 1.00 . A A . 17 GLU HA 1 1 9 6525 1 1 17 GLU HB2 H -1.422 4.522 -6.532 1.00 . A A . 17 GLU HB2 1 1 9 6526 1 1 17 GLU HB3 H -3.047 5.150 -6.811 1.00 . A A . 17 GLU HB3 1 1 9 6527 1 1 17 GLU HG2 H -3.231 5.725 -4.330 1.00 . A A . 17 GLU HG2 1 1 9 6528 1 1 17 GLU HG3 H -1.621 5.129 -4.084 1.00 . A A . 17 GLU HG3 1 1 9 6529 1 1 17 GLU N N -1.846 2.863 -4.677 1.00 . A A . 17 GLU N 1 1 9 6530 1 1 17 GLU O O -4.458 2.761 -7.320 1.00 . A A . 17 GLU O 1 1 9 6531 1 1 17 GLU OE1 O -1.806 7.469 -6.176 1.00 . A A . 17 GLU OE1 1 1 9 6532 1 1 17 GLU OE2 O -1.236 7.504 -4.060 1.00 . A A . 17 GLU OE2 1 1 9 6533 1 1 18 ASN C C -4.309 -0.951 -6.333 1.00 . A A . 18 ASN C 1 1 9 6534 1 1 18 ASN CA C -3.624 0.116 -7.273 1.00 . A A . 18 ASN CA 1 1 9 6535 1 1 18 ASN CB C -2.342 -0.376 -8.013 1.00 . A A . 18 ASN CB 1 1 9 6536 1 1 18 ASN CG C -1.839 0.628 -9.033 1.00 . A A . 18 ASN CG 1 1 9 6537 1 1 18 ASN H H -2.445 1.082 -5.758 1.00 . A A . 18 ASN H 1 1 9 6538 1 1 18 ASN HA H -4.348 0.461 -7.999 1.00 . A A . 18 ASN HA 1 1 9 6539 1 1 18 ASN HB2 H -1.527 -0.507 -7.325 1.00 . A A . 18 ASN HB2 1 1 9 6540 1 1 18 ASN HB3 H -2.503 -1.297 -8.540 1.00 . A A . 18 ASN HB3 1 1 9 6541 1 1 18 ASN HD21 H -3.155 2.065 -8.670 1.00 . A A . 18 ASN HD21 1 1 9 6542 1 1 18 ASN HD22 H -1.974 2.356 -9.863 1.00 . A A . 18 ASN HD22 1 1 9 6543 1 1 18 ASN N N -3.153 1.242 -6.413 1.00 . A A . 18 ASN N 1 1 9 6544 1 1 18 ASN ND2 N -2.381 1.781 -9.193 1.00 . A A . 18 ASN ND2 1 1 9 6545 1 1 18 ASN O O -4.721 -2.015 -6.745 1.00 . A A . 18 ASN O 1 1 9 6546 1 1 18 ASN OD1 O -0.897 0.373 -9.743 1.00 . A A . 18 ASN OD1 1 1 9 6547 1 1 19 TYR C C -6.094 -0.610 -3.123 1.00 . A A . 19 TYR C 1 1 9 6548 1 1 19 TYR CA C -5.008 -1.416 -3.956 1.00 . A A . 19 TYR CA 1 1 9 6549 1 1 19 TYR CB C -3.768 -1.889 -3.115 1.00 . A A . 19 TYR CB 1 1 9 6550 1 1 19 TYR CD1 C -4.641 -2.259 -0.820 1.00 . A A . 19 TYR CD1 1 1 9 6551 1 1 19 TYR CD2 C -3.238 -0.393 -1.219 1.00 . A A . 19 TYR CD2 1 1 9 6552 1 1 19 TYR CE1 C -4.715 -1.879 0.487 1.00 . A A . 19 TYR CE1 1 1 9 6553 1 1 19 TYR CE2 C -3.313 -0.014 0.083 1.00 . A A . 19 TYR CE2 1 1 9 6554 1 1 19 TYR CG C -3.893 -1.505 -1.672 1.00 . A A . 19 TYR CG 1 1 9 6555 1 1 19 TYR CZ C -4.061 -0.771 0.941 1.00 . A A . 19 TYR CZ 1 1 9 6556 1 1 19 TYR H H -4.030 0.286 -4.843 1.00 . A A . 19 TYR H 1 1 9 6557 1 1 19 TYR HA H -5.515 -2.271 -4.385 1.00 . A A . 19 TYR HA 1 1 9 6558 1 1 19 TYR HB2 H -3.658 -2.962 -3.126 1.00 . A A . 19 TYR HB2 1 1 9 6559 1 1 19 TYR HB3 H -2.846 -1.449 -3.467 1.00 . A A . 19 TYR HB3 1 1 9 6560 1 1 19 TYR HD1 H -5.167 -3.134 -1.177 1.00 . A A . 19 TYR HD1 1 1 9 6561 1 1 19 TYR HD2 H -2.654 0.190 -1.898 1.00 . A A . 19 TYR HD2 1 1 9 6562 1 1 19 TYR HE1 H -5.294 -2.455 1.169 1.00 . A A . 19 TYR HE1 1 1 9 6563 1 1 19 TYR HE2 H -2.783 0.872 0.410 1.00 . A A . 19 TYR HE2 1 1 9 6564 1 1 19 TYR HH H -4.888 0.196 2.183 1.00 . A A . 19 TYR HH 1 1 9 6565 1 1 19 TYR N N -4.398 -0.591 -5.072 1.00 . A A . 19 TYR N 1 1 9 6566 1 1 19 TYR O O -7.175 -1.073 -2.822 1.00 . A A . 19 TYR O 1 1 9 6567 1 1 19 TYR OH O -4.163 -0.445 2.259 1.00 . A A . 19 TYR OH 1 1 9 6568 1 1 20 CYS C C -7.800 1.984 -2.860 1.00 . A A . 20 CYS C 1 1 9 6569 1 1 20 CYS CA C -6.567 1.563 -1.986 1.00 . A A . 20 CYS CA 1 1 9 6570 1 1 20 CYS CB C -5.583 2.672 -1.638 1.00 . A A . 20 CYS CB 1 1 9 6571 1 1 20 CYS H H -4.841 0.856 -3.051 1.00 . A A . 20 CYS H 1 1 9 6572 1 1 20 CYS HA H -6.882 1.227 -1.026 1.00 . A A . 20 CYS HA 1 1 9 6573 1 1 20 CYS HB2 H -5.993 3.291 -0.863 1.00 . A A . 20 CYS HB2 1 1 9 6574 1 1 20 CYS HB3 H -4.716 2.196 -1.201 1.00 . A A . 20 CYS HB3 1 1 9 6575 1 1 20 CYS HG H -4.093 3.395 -3.200 1.00 . A A . 20 CYS HG 1 1 9 6576 1 1 20 CYS N N -5.729 0.587 -2.774 1.00 . A A . 20 CYS N 1 1 9 6577 1 1 20 CYS O O -7.800 2.962 -3.582 1.00 . A A . 20 CYS O 1 1 9 6578 1 1 20 CYS SG S -4.978 3.698 -2.988 1.00 . A A . 20 CYS SG 1 1 9 6579 1 1 21 ASN C C -10.218 2.732 -4.446 1.00 . A A . 21 ASN C 1 1 9 6580 1 1 21 ASN CA C -10.132 1.445 -3.558 1.00 . A A . 21 ASN CA 1 1 9 6581 1 1 21 ASN CB C -11.278 1.390 -2.502 1.00 . A A . 21 ASN CB 1 1 9 6582 1 1 21 ASN CG C -10.870 2.184 -1.299 1.00 . A A . 21 ASN CG 1 1 9 6583 1 1 21 ASN H H -8.784 0.460 -2.154 1.00 . A A . 21 ASN H 1 1 9 6584 1 1 21 ASN HA H -10.253 0.607 -4.232 1.00 . A A . 21 ASN HA 1 1 9 6585 1 1 21 ASN HB2 H -12.201 1.797 -2.873 1.00 . A A . 21 ASN HB2 1 1 9 6586 1 1 21 ASN HB3 H -11.445 0.374 -2.184 1.00 . A A . 21 ASN HB3 1 1 9 6587 1 1 21 ASN HD21 H -10.795 0.574 -0.186 1.00 . A A . 21 ASN HD21 1 1 9 6588 1 1 21 ASN HD22 H -10.311 2.006 0.561 1.00 . A A . 21 ASN HD22 1 1 9 6589 1 1 21 ASN N N -8.852 1.211 -2.778 1.00 . A A . 21 ASN N 1 1 9 6590 1 1 21 ASN ND2 N -10.645 1.535 -0.225 1.00 . A A . 21 ASN ND2 1 1 9 6591 1 1 21 ASN O O -11.184 3.483 -4.451 1.00 . A A . 21 ASN O 1 1 9 6592 1 1 21 ASN OD1 O -10.742 3.390 -1.308 1.00 . A A . 21 ASN OD1 1 1 9 6593 2 2 1 PHE C C 9.381 7.092 -6.032 1.00 . B B . 1 PHE C 1 1 9 6594 2 2 1 PHE CA C 8.890 8.453 -6.611 1.00 . B B . 1 PHE CA 1 1 9 6595 2 2 1 PHE CB C 7.491 8.909 -6.118 1.00 . B B . 1 PHE CB 1 1 9 6596 2 2 1 PHE CD1 C 8.360 9.692 -3.847 1.00 . B B . 1 PHE CD1 1 1 9 6597 2 2 1 PHE CD2 C 6.200 8.715 -3.971 1.00 . B B . 1 PHE CD2 1 1 9 6598 2 2 1 PHE CE1 C 8.197 9.876 -2.487 1.00 . B B . 1 PHE CE1 1 1 9 6599 2 2 1 PHE CE2 C 6.032 8.898 -2.615 1.00 . B B . 1 PHE CE2 1 1 9 6600 2 2 1 PHE CG C 7.361 9.109 -4.601 1.00 . B B . 1 PHE CG 1 1 9 6601 2 2 1 PHE CZ C 7.032 9.480 -1.870 1.00 . B B . 1 PHE CZ 1 1 9 6602 2 2 1 PHE HA H 9.638 9.200 -6.393 1.00 . B B . 1 PHE HA 1 1 9 6603 2 2 1 PHE HB2 H 7.247 9.848 -6.593 1.00 . B B . 1 PHE HB2 1 1 9 6604 2 2 1 PHE HB3 H 6.756 8.186 -6.435 1.00 . B B . 1 PHE HB3 1 1 9 6605 2 2 1 PHE HD1 H 9.277 10.014 -4.317 1.00 . B B . 1 PHE HD1 1 1 9 6606 2 2 1 PHE HD2 H 5.410 8.260 -4.548 1.00 . B B . 1 PHE HD2 1 1 9 6607 2 2 1 PHE HE1 H 8.985 10.333 -1.903 1.00 . B B . 1 PHE HE1 1 1 9 6608 2 2 1 PHE HE2 H 5.113 8.585 -2.137 1.00 . B B . 1 PHE HE2 1 1 9 6609 2 2 1 PHE HZ H 6.902 9.625 -0.806 1.00 . B B . 1 PHE HZ 1 1 9 6610 2 2 1 PHE N N 8.735 8.361 -8.100 1.00 . B B . 1 PHE N 1 1 9 6611 2 2 1 PHE O O 9.045 6.043 -6.547 1.00 . B B . 1 PHE O 1 1 9 6612 2 2 2 VAL C C 10.308 5.620 -2.880 1.00 . B B . 2 VAL C 1 1 9 6613 2 2 2 VAL CA C 10.694 5.896 -4.347 1.00 . B B . 2 VAL CA 1 1 9 6614 2 2 2 VAL CB C 12.250 5.950 -4.520 1.00 . B B . 2 VAL CB 1 1 9 6615 2 2 2 VAL CG1 C 12.839 7.277 -3.996 1.00 . B B . 2 VAL CG1 1 1 9 6616 2 2 2 VAL CG2 C 12.946 4.826 -3.728 1.00 . B B . 2 VAL CG2 1 1 9 6617 2 2 2 VAL H H 10.423 7.928 -4.570 1.00 . B B . 2 VAL H 1 1 9 6618 2 2 2 VAL HA H 10.387 5.089 -4.957 1.00 . B B . 2 VAL HA 1 1 9 6619 2 2 2 VAL HB H 12.446 5.791 -5.574 1.00 . B B . 2 VAL HB 1 1 9 6620 2 2 2 VAL HG11 H 12.610 7.400 -2.945 1.00 . B B . 2 VAL HG11 1 1 9 6621 2 2 2 VAL HG12 H 13.914 7.275 -4.110 1.00 . B B . 2 VAL HG12 1 1 9 6622 2 2 2 VAL HG13 H 12.446 8.121 -4.540 1.00 . B B . 2 VAL HG13 1 1 9 6623 2 2 2 VAL HG21 H 12.601 3.858 -4.059 1.00 . B B . 2 VAL HG21 1 1 9 6624 2 2 2 VAL HG22 H 14.015 4.873 -3.875 1.00 . B B . 2 VAL HG22 1 1 9 6625 2 2 2 VAL HG23 H 12.749 4.917 -2.668 1.00 . B B . 2 VAL HG23 1 1 9 6626 2 2 2 VAL N N 10.155 7.116 -4.985 1.00 . B B . 2 VAL N 1 1 9 6627 2 2 2 VAL O O 10.622 6.334 -1.948 1.00 . B B . 2 VAL O 1 1 9 6628 2 2 3 ASN C C 9.559 2.607 -1.211 1.00 . B B . 3 ASN C 1 1 9 6629 2 2 3 ASN CA C 9.088 4.051 -1.425 1.00 . B B . 3 ASN CA 1 1 9 6630 2 2 3 ASN CB C 7.547 4.159 -1.436 1.00 . B B . 3 ASN CB 1 1 9 6631 2 2 3 ASN CG C 7.081 5.502 -1.953 1.00 . B B . 3 ASN CG 1 1 9 6632 2 2 3 ASN H H 9.389 4.100 -3.585 1.00 . B B . 3 ASN H 1 1 9 6633 2 2 3 ASN HA H 9.556 4.576 -0.638 1.00 . B B . 3 ASN HA 1 1 9 6634 2 2 3 ASN HB2 H 7.117 3.390 -2.048 1.00 . B B . 3 ASN HB2 1 1 9 6635 2 2 3 ASN HB3 H 7.166 4.056 -0.434 1.00 . B B . 3 ASN HB3 1 1 9 6636 2 2 3 ASN HD21 H 8.708 6.508 -1.469 1.00 . B B . 3 ASN HD21 1 1 9 6637 2 2 3 ASN HD22 H 7.468 7.387 -2.224 1.00 . B B . 3 ASN HD22 1 1 9 6638 2 2 3 ASN N N 9.589 4.555 -2.747 1.00 . B B . 3 ASN N 1 1 9 6639 2 2 3 ASN ND2 N 7.818 6.548 -1.872 1.00 . B B . 3 ASN ND2 1 1 9 6640 2 2 3 ASN O O 10.155 2.252 -0.218 1.00 . B B . 3 ASN O 1 1 9 6641 2 2 3 ASN OD1 O 5.992 5.622 -2.462 1.00 . B B . 3 ASN OD1 1 1 9 6642 2 2 4 GLN C C 9.230 -0.536 -1.055 1.00 . B B . 4 GLN C 1 1 9 6643 2 2 4 GLN CA C 9.584 0.374 -2.280 1.00 . B B . 4 GLN CA 1 1 9 6644 2 2 4 GLN CB C 11.121 0.326 -2.609 1.00 . B B . 4 GLN CB 1 1 9 6645 2 2 4 GLN CD C 10.615 1.707 -4.828 1.00 . B B . 4 GLN CD 1 1 9 6646 2 2 4 GLN CG C 11.498 0.678 -4.121 1.00 . B B . 4 GLN CG 1 1 9 6647 2 2 4 GLN H H 8.771 2.285 -2.923 1.00 . B B . 4 GLN H 1 1 9 6648 2 2 4 GLN HA H 9.019 -0.031 -3.106 1.00 . B B . 4 GLN HA 1 1 9 6649 2 2 4 GLN HB2 H 11.629 1.027 -1.957 1.00 . B B . 4 GLN HB2 1 1 9 6650 2 2 4 GLN HB3 H 11.496 -0.661 -2.372 1.00 . B B . 4 GLN HB3 1 1 9 6651 2 2 4 GLN HE21 H 10.063 0.520 -6.304 1.00 . B B . 4 GLN HE21 1 1 9 6652 2 2 4 GLN HE22 H 9.454 2.110 -6.320 1.00 . B B . 4 GLN HE22 1 1 9 6653 2 2 4 GLN HG2 H 12.485 1.111 -4.117 1.00 . B B . 4 GLN HG2 1 1 9 6654 2 2 4 GLN HG3 H 11.549 -0.202 -4.735 1.00 . B B . 4 GLN HG3 1 1 9 6655 2 2 4 GLN N N 9.251 1.839 -2.201 1.00 . B B . 4 GLN N 1 1 9 6656 2 2 4 GLN NE2 N 9.997 1.408 -5.909 1.00 . B B . 4 GLN NE2 1 1 9 6657 2 2 4 GLN O O 8.388 -1.409 -1.169 1.00 . B B . 4 GLN O 1 1 9 6658 2 2 4 GLN OE1 O 10.453 2.830 -4.429 1.00 . B B . 4 GLN OE1 1 1 9 6659 2 2 5 HIS C C 9.092 -0.386 2.594 1.00 . B B . 5 HIS C 1 1 9 6660 2 2 5 HIS CA C 9.657 -1.085 1.315 1.00 . B B . 5 HIS CA 1 1 9 6661 2 2 5 HIS CB C 11.015 -1.759 1.637 1.00 . B B . 5 HIS CB 1 1 9 6662 2 2 5 HIS CD2 C 12.448 -3.145 -0.097 1.00 . B B . 5 HIS CD2 1 1 9 6663 2 2 5 HIS CE1 C 11.020 -4.561 -0.582 1.00 . B B . 5 HIS CE1 1 1 9 6664 2 2 5 HIS CG C 11.316 -2.854 0.626 1.00 . B B . 5 HIS CG 1 1 9 6665 2 2 5 HIS H H 10.524 0.437 0.047 1.00 . B B . 5 HIS H 1 1 9 6666 2 2 5 HIS HA H 8.975 -1.886 1.089 1.00 . B B . 5 HIS HA 1 1 9 6667 2 2 5 HIS HB2 H 11.811 -1.030 1.608 1.00 . B B . 5 HIS HB2 1 1 9 6668 2 2 5 HIS HB3 H 10.996 -2.204 2.621 1.00 . B B . 5 HIS HB3 1 1 9 6669 2 2 5 HIS HD1 H 9.557 -3.810 0.628 1.00 . B B . 5 HIS HD1 1 1 9 6670 2 2 5 HIS HD2 H 13.366 -2.581 -0.056 1.00 . B B . 5 HIS HD2 1 1 9 6671 2 2 5 HIS HE1 H 10.541 -5.417 -1.034 1.00 . B B . 5 HIS HE1 1 1 9 6672 2 2 5 HIS N N 9.875 -0.296 0.054 1.00 . B B . 5 HIS N 1 1 9 6673 2 2 5 HIS ND1 N 10.473 -3.761 0.281 1.00 . B B . 5 HIS ND1 1 1 9 6674 2 2 5 HIS NE2 N 12.253 -4.211 -0.846 1.00 . B B . 5 HIS NE2 1 1 9 6675 2 2 5 HIS O O 9.817 -0.015 3.496 1.00 . B B . 5 HIS O 1 1 9 6676 2 2 6 LEU C C 6.269 -0.686 4.507 1.00 . B B . 6 LEU C 1 1 9 6677 2 2 6 LEU CA C 7.129 0.424 3.823 1.00 . B B . 6 LEU CA 1 1 9 6678 2 2 6 LEU CB C 6.276 1.637 3.284 1.00 . B B . 6 LEU CB 1 1 9 6679 2 2 6 LEU CD1 C 4.261 2.425 2.080 1.00 . B B . 6 LEU CD1 1 1 9 6680 2 2 6 LEU CD2 C 5.973 1.311 0.793 1.00 . B B . 6 LEU CD2 1 1 9 6681 2 2 6 LEU CG C 5.280 1.281 2.161 1.00 . B B . 6 LEU CG 1 1 9 6682 2 2 6 LEU H H 7.272 -0.548 1.895 1.00 . B B . 6 LEU H 1 1 9 6683 2 2 6 LEU HA H 7.866 0.794 4.522 1.00 . B B . 6 LEU HA 1 1 9 6684 2 2 6 LEU HB2 H 5.734 2.064 4.115 1.00 . B B . 6 LEU HB2 1 1 9 6685 2 2 6 LEU HB3 H 6.962 2.389 2.920 1.00 . B B . 6 LEU HB3 1 1 9 6686 2 2 6 LEU HD11 H 3.745 2.539 3.020 1.00 . B B . 6 LEU HD11 1 1 9 6687 2 2 6 LEU HD12 H 4.751 3.359 1.852 1.00 . B B . 6 LEU HD12 1 1 9 6688 2 2 6 LEU HD13 H 3.531 2.220 1.311 1.00 . B B . 6 LEU HD13 1 1 9 6689 2 2 6 LEU HD21 H 6.375 2.293 0.604 1.00 . B B . 6 LEU HD21 1 1 9 6690 2 2 6 LEU HD22 H 6.775 0.601 0.706 1.00 . B B . 6 LEU HD22 1 1 9 6691 2 2 6 LEU HD23 H 5.250 1.083 0.023 1.00 . B B . 6 LEU HD23 1 1 9 6692 2 2 6 LEU HG H 4.814 0.323 2.349 1.00 . B B . 6 LEU HG 1 1 9 6693 2 2 6 LEU N N 7.803 -0.225 2.649 1.00 . B B . 6 LEU N 1 1 9 6694 2 2 6 LEU O O 5.533 -1.403 3.856 1.00 . B B . 6 LEU O 1 1 9 6695 2 2 7 CYS C C 4.376 -1.511 7.426 1.00 . B B . 7 CYS C 1 1 9 6696 2 2 7 CYS CA C 5.551 -1.902 6.497 1.00 . B B . 7 CYS CA 1 1 9 6697 2 2 7 CYS CB C 6.596 -2.762 7.244 1.00 . B B . 7 CYS CB 1 1 9 6698 2 2 7 CYS H H 6.940 -0.219 6.307 1.00 . B B . 7 CYS H 1 1 9 6699 2 2 7 CYS HA H 5.101 -2.529 5.750 1.00 . B B . 7 CYS HA 1 1 9 6700 2 2 7 CYS HB2 H 7.427 -2.941 6.574 1.00 . B B . 7 CYS HB2 1 1 9 6701 2 2 7 CYS HB3 H 6.969 -2.208 8.093 1.00 . B B . 7 CYS HB3 1 1 9 6702 2 2 7 CYS HG H 5.752 -4.279 8.748 1.00 . B B . 7 CYS HG 1 1 9 6703 2 2 7 CYS N N 6.356 -0.823 5.807 1.00 . B B . 7 CYS N 1 1 9 6704 2 2 7 CYS O O 4.088 -0.356 7.635 1.00 . B B . 7 CYS O 1 1 9 6705 2 2 7 CYS SG S 6.058 -4.385 7.843 1.00 . B B . 7 CYS SG 1 1 9 6706 2 2 8 GLY C C 1.917 -1.061 9.057 1.00 . B B . 8 GLY C 1 1 9 6707 2 2 8 GLY CA C 2.552 -2.427 8.886 1.00 . B B . 8 GLY CA 1 1 9 6708 2 2 8 GLY H H 4.081 -3.411 7.711 1.00 . B B . 8 GLY H 1 1 9 6709 2 2 8 GLY HA2 H 1.767 -3.077 8.545 1.00 . B B . 8 GLY HA2 1 1 9 6710 2 2 8 GLY HA3 H 2.869 -2.731 9.873 1.00 . B B . 8 GLY HA3 1 1 9 6711 2 2 8 GLY N N 3.742 -2.530 7.950 1.00 . B B . 8 GLY N 1 1 9 6712 2 2 8 GLY O O 1.107 -0.633 8.260 1.00 . B B . 8 GLY O 1 1 9 6713 2 2 9 ASP C C 2.265 1.916 9.352 1.00 . B B . 9 ASP C 1 1 9 6714 2 2 9 ASP CA C 1.863 0.920 10.484 1.00 . B B . 9 ASP CA 1 1 9 6715 2 2 9 ASP CB C 2.542 1.165 11.872 1.00 . B B . 9 ASP CB 1 1 9 6716 2 2 9 ASP CG C 4.051 1.057 11.765 1.00 . B B . 9 ASP CG 1 1 9 6717 2 2 9 ASP H H 3.010 -0.869 10.666 1.00 . B B . 9 ASP H 1 1 9 6718 2 2 9 ASP HA H 0.784 0.918 10.562 1.00 . B B . 9 ASP HA 1 1 9 6719 2 2 9 ASP HB2 H 2.307 2.154 12.233 1.00 . B B . 9 ASP HB2 1 1 9 6720 2 2 9 ASP HB3 H 2.223 0.441 12.599 1.00 . B B . 9 ASP HB3 1 1 9 6721 2 2 9 ASP N N 2.336 -0.437 10.100 1.00 . B B . 9 ASP N 1 1 9 6722 2 2 9 ASP O O 1.465 2.538 8.688 1.00 . B B . 9 ASP O 1 1 9 6723 2 2 9 ASP OD1 O 4.499 -0.055 11.560 1.00 . B B . 9 ASP OD1 1 1 9 6724 2 2 9 ASP OD2 O 4.662 2.094 11.875 1.00 . B B . 9 ASP OD2 1 1 9 6725 2 2 10 HIS C C 3.435 2.821 6.740 1.00 . B B . 10 HIS C 1 1 9 6726 2 2 10 HIS CA C 4.147 2.900 8.115 1.00 . B B . 10 HIS CA 1 1 9 6727 2 2 10 HIS CB C 5.594 2.466 8.056 1.00 . B B . 10 HIS CB 1 1 9 6728 2 2 10 HIS CD2 C 7.783 3.801 7.498 1.00 . B B . 10 HIS CD2 1 1 9 6729 2 2 10 HIS CE1 C 7.136 4.800 5.807 1.00 . B B . 10 HIS CE1 1 1 9 6730 2 2 10 HIS CG C 6.478 3.428 7.275 1.00 . B B . 10 HIS CG 1 1 9 6731 2 2 10 HIS H H 4.088 1.431 9.733 1.00 . B B . 10 HIS H 1 1 9 6732 2 2 10 HIS HA H 4.003 3.918 8.452 1.00 . B B . 10 HIS HA 1 1 9 6733 2 2 10 HIS HB2 H 5.950 2.393 9.075 1.00 . B B . 10 HIS HB2 1 1 9 6734 2 2 10 HIS HB3 H 5.630 1.489 7.603 1.00 . B B . 10 HIS HB3 1 1 9 6735 2 2 10 HIS HD1 H 5.242 4.036 5.804 1.00 . B B . 10 HIS HD1 1 1 9 6736 2 2 10 HIS HD2 H 8.389 3.443 8.314 1.00 . B B . 10 HIS HD2 1 1 9 6737 2 2 10 HIS HE1 H 7.123 5.446 4.938 1.00 . B B . 10 HIS HE1 1 1 9 6738 2 2 10 HIS N N 3.537 2.005 9.153 1.00 . B B . 10 HIS N 1 1 9 6739 2 2 10 HIS ND1 N 6.136 4.081 6.219 1.00 . B B . 10 HIS ND1 1 1 9 6740 2 2 10 HIS NE2 N 8.183 4.655 6.578 1.00 . B B . 10 HIS NE2 1 1 9 6741 2 2 10 HIS O O 3.457 3.729 5.928 1.00 . B B . 10 HIS O 1 1 9 6742 2 2 11 LEU C C 0.630 1.828 5.491 1.00 . B B . 11 LEU C 1 1 9 6743 2 2 11 LEU CA C 2.083 1.383 5.291 1.00 . B B . 11 LEU CA 1 1 9 6744 2 2 11 LEU CB C 2.279 -0.131 5.087 1.00 . B B . 11 LEU CB 1 1 9 6745 2 2 11 LEU CD1 C 1.743 0.209 2.661 1.00 . B B . 11 LEU CD1 1 1 9 6746 2 2 11 LEU CD2 C 2.036 -2.050 3.594 1.00 . B B . 11 LEU CD2 1 1 9 6747 2 2 11 LEU CG C 1.489 -0.659 3.895 1.00 . B B . 11 LEU CG 1 1 9 6748 2 2 11 LEU H H 2.908 1.034 7.254 1.00 . B B . 11 LEU H 1 1 9 6749 2 2 11 LEU HA H 2.457 1.947 4.455 1.00 . B B . 11 LEU HA 1 1 9 6750 2 2 11 LEU HB2 H 3.334 -0.317 4.936 1.00 . B B . 11 LEU HB2 1 1 9 6751 2 2 11 LEU HB3 H 1.972 -0.655 5.979 1.00 . B B . 11 LEU HB3 1 1 9 6752 2 2 11 LEU HD11 H 2.796 0.242 2.438 1.00 . B B . 11 LEU HD11 1 1 9 6753 2 2 11 LEU HD12 H 1.228 -0.164 1.793 1.00 . B B . 11 LEU HD12 1 1 9 6754 2 2 11 LEU HD13 H 1.396 1.214 2.843 1.00 . B B . 11 LEU HD13 1 1 9 6755 2 2 11 LEU HD21 H 3.095 -1.986 3.374 1.00 . B B . 11 LEU HD21 1 1 9 6756 2 2 11 LEU HD22 H 1.894 -2.690 4.450 1.00 . B B . 11 LEU HD22 1 1 9 6757 2 2 11 LEU HD23 H 1.532 -2.483 2.745 1.00 . B B . 11 LEU HD23 1 1 9 6758 2 2 11 LEU HG H 0.432 -0.695 4.146 1.00 . B B . 11 LEU HG 1 1 9 6759 2 2 11 LEU N N 2.837 1.695 6.534 1.00 . B B . 11 LEU N 1 1 9 6760 2 2 11 LEU O O 0.161 2.675 4.755 1.00 . B B . 11 LEU O 1 1 9 6761 2 2 12 VAL C C -1.602 3.278 6.714 1.00 . B B . 12 VAL C 1 1 9 6762 2 2 12 VAL CA C -1.492 1.736 6.649 1.00 . B B . 12 VAL CA 1 1 9 6763 2 2 12 VAL CB C -2.067 1.137 7.954 1.00 . B B . 12 VAL CB 1 1 9 6764 2 2 12 VAL CG1 C -1.203 1.539 9.126 1.00 . B B . 12 VAL CG1 1 1 9 6765 2 2 12 VAL CG2 C -3.437 1.774 8.203 1.00 . B B . 12 VAL CG2 1 1 9 6766 2 2 12 VAL H H 0.335 0.614 7.034 1.00 . B B . 12 VAL H 1 1 9 6767 2 2 12 VAL HA H -2.072 1.391 5.815 1.00 . B B . 12 VAL HA 1 1 9 6768 2 2 12 VAL HB H -2.129 0.060 7.875 1.00 . B B . 12 VAL HB 1 1 9 6769 2 2 12 VAL HG11 H -0.217 1.176 8.921 1.00 . B B . 12 VAL HG11 1 1 9 6770 2 2 12 VAL HG12 H -1.153 2.614 9.252 1.00 . B B . 12 VAL HG12 1 1 9 6771 2 2 12 VAL HG13 H -1.551 1.121 10.053 1.00 . B B . 12 VAL HG13 1 1 9 6772 2 2 12 VAL HG21 H -4.106 1.598 7.378 1.00 . B B . 12 VAL HG21 1 1 9 6773 2 2 12 VAL HG22 H -3.878 1.403 9.111 1.00 . B B . 12 VAL HG22 1 1 9 6774 2 2 12 VAL HG23 H -3.324 2.847 8.316 1.00 . B B . 12 VAL HG23 1 1 9 6775 2 2 12 VAL N N -0.069 1.290 6.451 1.00 . B B . 12 VAL N 1 1 9 6776 2 2 12 VAL O O -2.485 3.862 6.106 1.00 . B B . 12 VAL O 1 1 9 6777 2 2 13 GLU C C -0.648 6.121 6.204 1.00 . B B . 13 GLU C 1 1 9 6778 2 2 13 GLU CA C -0.721 5.388 7.559 1.00 . B B . 13 GLU CA 1 1 9 6779 2 2 13 GLU CB C 0.463 5.776 8.489 1.00 . B B . 13 GLU CB 1 1 9 6780 2 2 13 GLU CD C -1.088 5.525 10.546 1.00 . B B . 13 GLU CD 1 1 9 6781 2 2 13 GLU CG C 0.242 5.139 9.920 1.00 . B B . 13 GLU CG 1 1 9 6782 2 2 13 GLU H H 0.012 3.403 7.890 1.00 . B B . 13 GLU H 1 1 9 6783 2 2 13 GLU HA H -1.645 5.684 8.032 1.00 . B B . 13 GLU HA 1 1 9 6784 2 2 13 GLU HB2 H 1.396 5.433 8.065 1.00 . B B . 13 GLU HB2 1 1 9 6785 2 2 13 GLU HB3 H 0.497 6.853 8.587 1.00 . B B . 13 GLU HB3 1 1 9 6786 2 2 13 GLU HG2 H 0.282 4.066 9.898 1.00 . B B . 13 GLU HG2 1 1 9 6787 2 2 13 GLU HG3 H 1.003 5.484 10.598 1.00 . B B . 13 GLU HG3 1 1 9 6788 2 2 13 GLU N N -0.701 3.900 7.427 1.00 . B B . 13 GLU N 1 1 9 6789 2 2 13 GLU O O -0.617 7.336 6.140 1.00 . B B . 13 GLU O 1 1 9 6790 2 2 13 GLU OE1 O -1.180 6.667 10.950 1.00 . B B . 13 GLU OE1 1 1 9 6791 2 2 13 GLU OE2 O -1.945 4.659 10.577 1.00 . B B . 13 GLU OE2 1 1 9 6792 2 2 14 ALA C C -2.009 6.115 3.267 1.00 . B B . 14 ALA C 1 1 9 6793 2 2 14 ALA CA C -0.565 6.037 3.794 1.00 . B B . 14 ALA CA 1 1 9 6794 2 2 14 ALA CB C 0.399 5.146 2.948 1.00 . B B . 14 ALA CB 1 1 9 6795 2 2 14 ALA H H -0.658 4.398 5.156 1.00 . B B . 14 ALA H 1 1 9 6796 2 2 14 ALA HA H -0.240 7.037 3.960 1.00 . B B . 14 ALA HA 1 1 9 6797 2 2 14 ALA HB1 H 1.363 5.091 3.439 1.00 . B B . 14 ALA HB1 1 1 9 6798 2 2 14 ALA HB2 H 0.021 4.136 2.877 1.00 . B B . 14 ALA HB2 1 1 9 6799 2 2 14 ALA HB3 H 0.543 5.537 1.953 1.00 . B B . 14 ALA HB3 1 1 9 6800 2 2 14 ALA N N -0.630 5.382 5.119 1.00 . B B . 14 ALA N 1 1 9 6801 2 2 14 ALA O O -2.527 7.151 2.900 1.00 . B B . 14 ALA O 1 1 9 6802 2 2 15 LEU C C -4.958 5.929 2.930 1.00 . B B . 15 LEU C 1 1 9 6803 2 2 15 LEU CA C -4.004 4.710 2.819 1.00 . B B . 15 LEU CA 1 1 9 6804 2 2 15 LEU CB C -4.472 3.548 3.672 1.00 . B B . 15 LEU CB 1 1 9 6805 2 2 15 LEU CD1 C -2.302 2.190 3.144 1.00 . B B . 15 LEU CD1 1 1 9 6806 2 2 15 LEU CD2 C -4.192 1.244 4.382 1.00 . B B . 15 LEU CD2 1 1 9 6807 2 2 15 LEU CG C -3.800 2.226 3.296 1.00 . B B . 15 LEU CG 1 1 9 6808 2 2 15 LEU H H -2.046 4.229 3.603 1.00 . B B . 15 LEU H 1 1 9 6809 2 2 15 LEU HA H -3.996 4.407 1.783 1.00 . B B . 15 LEU HA 1 1 9 6810 2 2 15 LEU HB2 H -4.280 3.786 4.699 1.00 . B B . 15 LEU HB2 1 1 9 6811 2 2 15 LEU HB3 H -5.543 3.424 3.589 1.00 . B B . 15 LEU HB3 1 1 9 6812 2 2 15 LEU HD11 H -1.850 2.497 4.062 1.00 . B B . 15 LEU HD11 1 1 9 6813 2 2 15 LEU HD12 H -1.991 1.177 2.923 1.00 . B B . 15 LEU HD12 1 1 9 6814 2 2 15 LEU HD13 H -1.968 2.816 2.330 1.00 . B B . 15 LEU HD13 1 1 9 6815 2 2 15 LEU HD21 H -3.981 1.656 5.351 1.00 . B B . 15 LEU HD21 1 1 9 6816 2 2 15 LEU HD22 H -5.243 1.022 4.328 1.00 . B B . 15 LEU HD22 1 1 9 6817 2 2 15 LEU HD23 H -3.650 0.323 4.283 1.00 . B B . 15 LEU HD23 1 1 9 6818 2 2 15 LEU HG H -4.166 1.955 2.334 1.00 . B B . 15 LEU HG 1 1 9 6819 2 2 15 LEU N N -2.595 4.964 3.267 1.00 . B B . 15 LEU N 1 1 9 6820 2 2 15 LEU O O -5.437 6.465 1.945 1.00 . B B . 15 LEU O 1 1 9 6821 2 2 16 TYR C C -5.953 8.671 3.644 1.00 . B B . 16 TYR C 1 1 9 6822 2 2 16 TYR CA C -6.051 7.443 4.579 1.00 . B B . 16 TYR CA 1 1 9 6823 2 2 16 TYR CB C -5.686 7.906 6.006 1.00 . B B . 16 TYR CB 1 1 9 6824 2 2 16 TYR CD1 C -6.215 5.641 7.093 1.00 . B B . 16 TYR CD1 1 1 9 6825 2 2 16 TYR CD2 C -4.431 6.964 7.933 1.00 . B B . 16 TYR CD2 1 1 9 6826 2 2 16 TYR CE1 C -5.943 4.688 8.068 1.00 . B B . 16 TYR CE1 1 1 9 6827 2 2 16 TYR CE2 C -4.174 6.015 8.892 1.00 . B B . 16 TYR CE2 1 1 9 6828 2 2 16 TYR CG C -5.451 6.790 7.026 1.00 . B B . 16 TYR CG 1 1 9 6829 2 2 16 TYR CZ C -4.922 4.875 8.968 1.00 . B B . 16 TYR CZ 1 1 9 6830 2 2 16 TYR H H -4.706 5.761 4.858 1.00 . B B . 16 TYR H 1 1 9 6831 2 2 16 TYR HA H -7.083 7.120 4.550 1.00 . B B . 16 TYR HA 1 1 9 6832 2 2 16 TYR HB2 H -4.800 8.520 5.968 1.00 . B B . 16 TYR HB2 1 1 9 6833 2 2 16 TYR HB3 H -6.502 8.509 6.378 1.00 . B B . 16 TYR HB3 1 1 9 6834 2 2 16 TYR HD1 H -7.022 5.485 6.390 1.00 . B B . 16 TYR HD1 1 1 9 6835 2 2 16 TYR HD2 H -3.813 7.852 7.903 1.00 . B B . 16 TYR HD2 1 1 9 6836 2 2 16 TYR HE1 H -6.522 3.782 8.143 1.00 . B B . 16 TYR HE1 1 1 9 6837 2 2 16 TYR HE2 H -3.373 6.174 9.598 1.00 . B B . 16 TYR HE2 1 1 9 6838 2 2 16 TYR HH H -3.738 4.128 10.202 1.00 . B B . 16 TYR HH 1 1 9 6839 2 2 16 TYR N N -5.168 6.290 4.173 1.00 . B B . 16 TYR N 1 1 9 6840 2 2 16 TYR O O -6.927 9.338 3.362 1.00 . B B . 16 TYR O 1 1 9 6841 2 2 16 TYR OH O -4.657 3.933 9.931 1.00 . B B . 16 TYR OH 1 1 9 6842 2 2 17 LEU C C -4.468 9.512 0.861 1.00 . B B . 17 LEU C 1 1 9 6843 2 2 17 LEU CA C -4.491 10.075 2.287 1.00 . B B . 17 LEU CA 1 1 9 6844 2 2 17 LEU CB C -3.133 10.701 2.708 1.00 . B B . 17 LEU CB 1 1 9 6845 2 2 17 LEU CD1 C -1.839 11.795 4.523 1.00 . B B . 17 LEU CD1 1 1 9 6846 2 2 17 LEU CD2 C -4.121 12.571 4.063 1.00 . B B . 17 LEU CD2 1 1 9 6847 2 2 17 LEU CG C -3.233 11.323 4.116 1.00 . B B . 17 LEU CG 1 1 9 6848 2 2 17 LEU H H -4.016 8.333 3.464 1.00 . B B . 17 LEU H 1 1 9 6849 2 2 17 LEU HA H -5.303 10.788 2.333 1.00 . B B . 17 LEU HA 1 1 9 6850 2 2 17 LEU HB2 H -2.368 9.936 2.709 1.00 . B B . 17 LEU HB2 1 1 9 6851 2 2 17 LEU HB3 H -2.853 11.459 1.989 1.00 . B B . 17 LEU HB3 1 1 9 6852 2 2 17 LEU HD11 H -1.464 12.524 3.819 1.00 . B B . 17 LEU HD11 1 1 9 6853 2 2 17 LEU HD12 H -1.869 12.247 5.503 1.00 . B B . 17 LEU HD12 1 1 9 6854 2 2 17 LEU HD13 H -1.156 10.958 4.552 1.00 . B B . 17 LEU HD13 1 1 9 6855 2 2 17 LEU HD21 H -3.722 13.297 3.370 1.00 . B B . 17 LEU HD21 1 1 9 6856 2 2 17 LEU HD22 H -5.124 12.314 3.750 1.00 . B B . 17 LEU HD22 1 1 9 6857 2 2 17 LEU HD23 H -4.182 13.026 5.040 1.00 . B B . 17 LEU HD23 1 1 9 6858 2 2 17 LEU HG H -3.621 10.604 4.831 1.00 . B B . 17 LEU HG 1 1 9 6859 2 2 17 LEU N N -4.755 8.922 3.201 1.00 . B B . 17 LEU N 1 1 9 6860 2 2 17 LEU O O -5.179 10.010 0.017 1.00 . B B . 17 LEU O 1 1 9 6861 2 2 18 VAL C C -4.905 7.797 -1.426 1.00 . B B . 18 VAL C 1 1 9 6862 2 2 18 VAL CA C -3.525 7.823 -0.695 1.00 . B B . 18 VAL CA 1 1 9 6863 2 2 18 VAL CB C -2.957 6.418 -0.372 1.00 . B B . 18 VAL CB 1 1 9 6864 2 2 18 VAL CG1 C -2.942 5.582 -1.624 1.00 . B B . 18 VAL CG1 1 1 9 6865 2 2 18 VAL CG2 C -1.474 6.564 0.012 1.00 . B B . 18 VAL CG2 1 1 9 6866 2 2 18 VAL H H -3.134 8.180 1.412 1.00 . B B . 18 VAL H 1 1 9 6867 2 2 18 VAL HA H -2.840 8.369 -1.332 1.00 . B B . 18 VAL HA 1 1 9 6868 2 2 18 VAL HB H -3.529 5.949 0.416 1.00 . B B . 18 VAL HB 1 1 9 6869 2 2 18 VAL HG11 H -3.926 5.532 -2.055 1.00 . B B . 18 VAL HG11 1 1 9 6870 2 2 18 VAL HG12 H -2.297 6.061 -2.350 1.00 . B B . 18 VAL HG12 1 1 9 6871 2 2 18 VAL HG13 H -2.581 4.584 -1.443 1.00 . B B . 18 VAL HG13 1 1 9 6872 2 2 18 VAL HG21 H -1.350 7.223 0.857 1.00 . B B . 18 VAL HG21 1 1 9 6873 2 2 18 VAL HG22 H -1.052 5.600 0.246 1.00 . B B . 18 VAL HG22 1 1 9 6874 2 2 18 VAL HG23 H -0.929 6.982 -0.826 1.00 . B B . 18 VAL HG23 1 1 9 6875 2 2 18 VAL N N -3.660 8.503 0.652 1.00 . B B . 18 VAL N 1 1 9 6876 2 2 18 VAL O O -5.162 8.584 -2.314 1.00 . B B . 18 VAL O 1 1 9 6877 2 2 19 CYS C C -8.273 7.169 -0.748 1.00 . B B . 19 CYS C 1 1 9 6878 2 2 19 CYS CA C -7.121 6.859 -1.724 1.00 . B B . 19 CYS CA 1 1 9 6879 2 2 19 CYS CB C -7.237 5.486 -2.291 1.00 . B B . 19 CYS CB 1 1 9 6880 2 2 19 CYS H H -5.584 6.216 -0.359 1.00 . B B . 19 CYS H 1 1 9 6881 2 2 19 CYS HA H -7.167 7.592 -2.521 1.00 . B B . 19 CYS HA 1 1 9 6882 2 2 19 CYS HB2 H -6.963 4.824 -1.481 1.00 . B B . 19 CYS HB2 1 1 9 6883 2 2 19 CYS HB3 H -8.255 5.235 -2.534 1.00 . B B . 19 CYS HB3 1 1 9 6884 2 2 19 CYS HG H -6.606 5.391 -4.504 1.00 . B B . 19 CYS HG 1 1 9 6885 2 2 19 CYS N N -5.782 6.894 -1.052 1.00 . B B . 19 CYS N 1 1 9 6886 2 2 19 CYS O O -9.432 6.999 -1.091 1.00 . B B . 19 CYS O 1 1 9 6887 2 2 19 CYS SG S -6.150 5.142 -3.698 1.00 . B B . 19 CYS SG 1 1 9 6888 2 2 20 GLY C C -9.166 6.627 2.283 1.00 . B B . 20 GLY C 1 1 9 6889 2 2 20 GLY CA C -9.044 7.907 1.464 1.00 . B B . 20 GLY CA 1 1 9 6890 2 2 20 GLY H H -7.010 7.704 0.673 1.00 . B B . 20 GLY H 1 1 9 6891 2 2 20 GLY HA2 H -8.749 8.707 2.118 1.00 . B B . 20 GLY HA2 1 1 9 6892 2 2 20 GLY HA3 H -9.993 8.111 0.992 1.00 . B B . 20 GLY HA3 1 1 9 6893 2 2 20 GLY N N -7.961 7.595 0.444 1.00 . B B . 20 GLY N 1 1 9 6894 2 2 20 GLY O O -9.192 6.590 3.493 1.00 . B B . 20 GLY O 1 1 9 6895 2 2 21 GLU C C -10.655 3.610 2.341 1.00 . B B . 21 GLU C 1 1 9 6896 2 2 21 GLU CA C -9.362 4.179 1.774 1.00 . B B . 21 GLU CA 1 1 9 6897 2 2 21 GLU CB C -8.133 3.874 2.632 1.00 . B B . 21 GLU CB 1 1 9 6898 2 2 21 GLU CD C -7.228 1.933 1.262 1.00 . B B . 21 GLU CD 1 1 9 6899 2 2 21 GLU CG C -7.060 3.403 1.561 1.00 . B B . 21 GLU CG 1 1 9 6900 2 2 21 GLU H H -9.216 5.860 0.521 1.00 . B B . 21 GLU H 1 1 9 6901 2 2 21 GLU HA H -9.248 3.672 0.830 1.00 . B B . 21 GLU HA 1 1 9 6902 2 2 21 GLU HB2 H -7.810 4.730 3.201 1.00 . B B . 21 GLU HB2 1 1 9 6903 2 2 21 GLU HB3 H -8.402 3.078 3.304 1.00 . B B . 21 GLU HB3 1 1 9 6904 2 2 21 GLU HG2 H -7.221 3.920 0.634 1.00 . B B . 21 GLU HG2 1 1 9 6905 2 2 21 GLU HG3 H -6.041 3.579 1.813 1.00 . B B . 21 GLU HG3 1 1 9 6906 2 2 21 GLU N N -9.242 5.622 1.461 1.00 . B B . 21 GLU N 1 1 9 6907 2 2 21 GLU O O -10.895 3.189 3.454 1.00 . B B . 21 GLU O 1 1 9 6908 2 2 21 GLU OE1 O -8.280 1.597 0.770 1.00 . B B . 21 GLU OE1 1 1 9 6909 2 2 21 GLU OE2 O -6.295 1.218 1.541 1.00 . B B . 21 GLU OE2 1 1 9 6910 2 2 22 ARG C C -12.994 1.635 1.373 1.00 . B B . 22 ARG C 1 1 9 6911 2 2 22 ARG CA C -12.886 3.186 1.387 1.00 . B B . 22 ARG CA 1 1 9 6912 2 2 22 ARG CB C -13.551 3.828 0.158 1.00 . B B . 22 ARG CB 1 1 9 6913 2 2 22 ARG CD C -12.522 6.140 -0.225 1.00 . B B . 22 ARG CD 1 1 9 6914 2 2 22 ARG CG C -13.718 5.380 0.375 1.00 . B B . 22 ARG CG 1 1 9 6915 2 2 22 ARG CZ C -12.366 5.596 -2.571 1.00 . B B . 22 ARG CZ 1 1 9 6916 2 2 22 ARG H H -11.130 4.005 0.545 1.00 . B B . 22 ARG H 1 1 9 6917 2 2 22 ARG HA H -13.302 3.560 2.294 1.00 . B B . 22 ARG HA 1 1 9 6918 2 2 22 ARG HB2 H -12.888 3.616 -0.675 1.00 . B B . 22 ARG HB2 1 1 9 6919 2 2 22 ARG HB3 H -14.466 3.298 -0.048 1.00 . B B . 22 ARG HB3 1 1 9 6920 2 2 22 ARG HD2 H -12.382 7.099 0.269 1.00 . B B . 22 ARG HD2 1 1 9 6921 2 2 22 ARG HD3 H -11.592 5.588 -0.122 1.00 . B B . 22 ARG HD3 1 1 9 6922 2 2 22 ARG HE H -13.487 7.029 -1.979 1.00 . B B . 22 ARG HE 1 1 9 6923 2 2 22 ARG HG2 H -14.640 5.713 -0.083 1.00 . B B . 22 ARG HG2 1 1 9 6924 2 2 22 ARG HG3 H -13.790 5.603 1.433 1.00 . B B . 22 ARG HG3 1 1 9 6925 2 2 22 ARG HH11 H -10.597 6.243 -2.213 1.00 . B B . 22 ARG HH11 1 1 9 6926 2 2 22 ARG HH12 H -10.733 5.050 -3.468 1.00 . B B . 22 ARG HH12 1 1 9 6927 2 2 22 ARG HH21 H -14.098 4.857 -3.020 1.00 . B B . 22 ARG HH21 1 1 9 6928 2 2 22 ARG HH22 H -12.707 4.280 -3.908 1.00 . B B . 22 ARG HH22 1 1 9 6929 2 2 22 ARG N N -11.488 3.638 1.360 1.00 . B B . 22 ARG N 1 1 9 6930 2 2 22 ARG NE N -12.869 6.332 -1.678 1.00 . B B . 22 ARG NE 1 1 9 6931 2 2 22 ARG NH1 N -11.140 5.629 -2.774 1.00 . B B . 22 ARG NH1 1 1 9 6932 2 2 22 ARG NH2 N -13.129 4.853 -3.217 1.00 . B B . 22 ARG NH2 1 1 9 6933 2 2 22 ARG O O -13.645 1.056 0.527 1.00 . B B . 22 ARG O 1 1 9 6934 2 2 23 GLY C C -11.084 -1.232 1.971 1.00 . B B . 23 GLY C 1 1 9 6935 2 2 23 GLY CA C -12.361 -0.506 2.401 1.00 . B B . 23 GLY CA 1 1 9 6936 2 2 23 GLY H H -11.825 1.557 2.945 1.00 . B B . 23 GLY H 1 1 9 6937 2 2 23 GLY HA2 H -12.555 -0.793 3.423 1.00 . B B . 23 GLY HA2 1 1 9 6938 2 2 23 GLY HA3 H -13.161 -0.899 1.789 1.00 . B B . 23 GLY HA3 1 1 9 6939 2 2 23 GLY N N -12.336 1.007 2.306 1.00 . B B . 23 GLY N 1 1 9 6940 2 2 23 GLY O O -11.171 -2.285 1.379 1.00 . B B . 23 GLY O 1 1 9 6941 2 2 24 PHE C C -8.543 -2.663 1.322 1.00 . B B . 24 PHE C 1 1 9 6942 2 2 24 PHE CA C -8.595 -1.227 1.934 1.00 . B B . 24 PHE CA 1 1 9 6943 2 2 24 PHE CB C -7.746 -1.166 3.243 1.00 . B B . 24 PHE CB 1 1 9 6944 2 2 24 PHE CD1 C -9.257 -0.716 5.232 1.00 . B B . 24 PHE CD1 1 1 9 6945 2 2 24 PHE CD2 C -7.832 1.025 4.501 1.00 . B B . 24 PHE CD2 1 1 9 6946 2 2 24 PHE CE1 C -9.731 0.101 6.242 1.00 . B B . 24 PHE CE1 1 1 9 6947 2 2 24 PHE CE2 C -8.298 1.846 5.505 1.00 . B B . 24 PHE CE2 1 1 9 6948 2 2 24 PHE CG C -8.299 -0.258 4.354 1.00 . B B . 24 PHE CG 1 1 9 6949 2 2 24 PHE CZ C -9.250 1.384 6.379 1.00 . B B . 24 PHE CZ 1 1 9 6950 2 2 24 PHE H H -9.979 0.205 2.728 1.00 . B B . 24 PHE H 1 1 9 6951 2 2 24 PHE HA H -8.119 -0.595 1.205 1.00 . B B . 24 PHE HA 1 1 9 6952 2 2 24 PHE HB2 H -7.612 -2.148 3.668 1.00 . B B . 24 PHE HB2 1 1 9 6953 2 2 24 PHE HB3 H -6.782 -0.768 2.972 1.00 . B B . 24 PHE HB3 1 1 9 6954 2 2 24 PHE HD1 H -9.637 -1.720 5.119 1.00 . B B . 24 PHE HD1 1 1 9 6955 2 2 24 PHE HD2 H -7.095 1.400 3.810 1.00 . B B . 24 PHE HD2 1 1 9 6956 2 2 24 PHE HE1 H -10.475 -0.263 6.932 1.00 . B B . 24 PHE HE1 1 1 9 6957 2 2 24 PHE HE2 H -7.905 2.852 5.598 1.00 . B B . 24 PHE HE2 1 1 9 6958 2 2 24 PHE HZ H -9.619 2.027 7.167 1.00 . B B . 24 PHE HZ 1 1 9 6959 2 2 24 PHE N N -9.955 -0.657 2.267 1.00 . B B . 24 PHE N 1 1 9 6960 2 2 24 PHE O O -8.713 -3.654 2.008 1.00 . B B . 24 PHE O 1 1 9 6961 2 2 25 PHE C C -7.076 -5.095 -0.180 1.00 . B B . 25 PHE C 1 1 9 6962 2 2 25 PHE CA C -8.238 -4.137 -0.602 1.00 . B B . 25 PHE CA 1 1 9 6963 2 2 25 PHE CB C -8.216 -3.887 -2.140 1.00 . B B . 25 PHE CB 1 1 9 6964 2 2 25 PHE CD1 C -10.583 -2.880 -1.894 1.00 . B B . 25 PHE CD1 1 1 9 6965 2 2 25 PHE CD2 C -9.507 -2.818 -4.007 1.00 . B B . 25 PHE CD2 1 1 9 6966 2 2 25 PHE CE1 C -11.684 -2.251 -2.435 1.00 . B B . 25 PHE CE1 1 1 9 6967 2 2 25 PHE CE2 C -10.607 -2.189 -4.554 1.00 . B B . 25 PHE CE2 1 1 9 6968 2 2 25 PHE CG C -9.479 -3.173 -2.674 1.00 . B B . 25 PHE CG 1 1 9 6969 2 2 25 PHE CZ C -11.699 -1.904 -3.767 1.00 . B B . 25 PHE CZ 1 1 9 6970 2 2 25 PHE H H -8.134 -1.967 -0.500 1.00 . B B . 25 PHE H 1 1 9 6971 2 2 25 PHE HA H -9.154 -4.660 -0.357 1.00 . B B . 25 PHE HA 1 1 9 6972 2 2 25 PHE HB2 H -7.354 -3.293 -2.396 1.00 . B B . 25 PHE HB2 1 1 9 6973 2 2 25 PHE HB3 H -8.133 -4.830 -2.660 1.00 . B B . 25 PHE HB3 1 1 9 6974 2 2 25 PHE HD1 H -10.602 -3.141 -0.845 1.00 . B B . 25 PHE HD1 1 1 9 6975 2 2 25 PHE HD2 H -8.652 -3.037 -4.630 1.00 . B B . 25 PHE HD2 1 1 9 6976 2 2 25 PHE HE1 H -12.539 -2.034 -1.806 1.00 . B B . 25 PHE HE1 1 1 9 6977 2 2 25 PHE HE2 H -10.607 -1.923 -5.602 1.00 . B B . 25 PHE HE2 1 1 9 6978 2 2 25 PHE HZ H -12.565 -1.415 -4.190 1.00 . B B . 25 PHE HZ 1 1 9 6979 2 2 25 PHE N N -8.291 -2.773 0.044 1.00 . B B . 25 PHE N 1 1 9 6980 2 2 25 PHE O O -6.182 -5.390 -0.952 1.00 . B B . 25 PHE O 1 1 9 6981 2 2 26 TYR C C -6.108 -7.966 0.952 1.00 . B B . 26 TYR C 1 1 9 6982 2 2 26 TYR CA C -6.000 -6.517 1.504 1.00 . B B . 26 TYR CA 1 1 9 6983 2 2 26 TYR CB C -6.018 -6.506 3.073 1.00 . B B . 26 TYR CB 1 1 9 6984 2 2 26 TYR CD1 C -5.673 -4.035 3.271 1.00 . B B . 26 TYR CD1 1 1 9 6985 2 2 26 TYR CD2 C -3.973 -5.433 4.130 1.00 . B B . 26 TYR CD2 1 1 9 6986 2 2 26 TYR CE1 C -4.935 -2.935 3.626 1.00 . B B . 26 TYR CE1 1 1 9 6987 2 2 26 TYR CE2 C -3.238 -4.311 4.484 1.00 . B B . 26 TYR CE2 1 1 9 6988 2 2 26 TYR CG C -5.199 -5.293 3.516 1.00 . B B . 26 TYR CG 1 1 9 6989 2 2 26 TYR CZ C -3.726 -3.063 4.225 1.00 . B B . 26 TYR CZ 1 1 9 6990 2 2 26 TYR H H -7.832 -5.316 1.621 1.00 . B B . 26 TYR H 1 1 9 6991 2 2 26 TYR HA H -5.045 -6.132 1.171 1.00 . B B . 26 TYR HA 1 1 9 6992 2 2 26 TYR HB2 H -7.025 -6.410 3.453 1.00 . B B . 26 TYR HB2 1 1 9 6993 2 2 26 TYR HB3 H -5.578 -7.406 3.482 1.00 . B B . 26 TYR HB3 1 1 9 6994 2 2 26 TYR HD1 H -6.632 -3.913 2.798 1.00 . B B . 26 TYR HD1 1 1 9 6995 2 2 26 TYR HD2 H -3.594 -6.424 4.336 1.00 . B B . 26 TYR HD2 1 1 9 6996 2 2 26 TYR HE1 H -5.301 -1.943 3.443 1.00 . B B . 26 TYR HE1 1 1 9 6997 2 2 26 TYR HE2 H -2.279 -4.391 4.971 1.00 . B B . 26 TYR HE2 1 1 9 6998 2 2 26 TYR HH H -3.356 -1.333 3.812 1.00 . B B . 26 TYR HH 1 1 9 6999 2 2 26 TYR N N -7.092 -5.581 1.031 1.00 . B B . 26 TYR N 1 1 9 7000 2 2 26 TYR O O -6.387 -8.930 1.633 1.00 . B B . 26 TYR O 1 1 9 7001 2 2 26 TYR OH O -3.034 -1.918 4.515 1.00 . B B . 26 TYR OH 1 1 9 7002 2 2 27 THR C C -4.539 -10.030 -1.328 1.00 . B B . 27 THR C 1 1 9 7003 2 2 27 THR CA C -5.921 -9.405 -1.027 1.00 . B B . 27 THR CA 1 1 9 7004 2 2 27 THR CB C -6.708 -9.210 -2.346 1.00 . B B . 27 THR CB 1 1 9 7005 2 2 27 THR CG2 C -6.194 -8.082 -3.210 1.00 . B B . 27 THR CG2 1 1 9 7006 2 2 27 THR H H -5.627 -7.264 -0.822 1.00 . B B . 27 THR H 1 1 9 7007 2 2 27 THR HA H -6.482 -10.106 -0.429 1.00 . B B . 27 THR HA 1 1 9 7008 2 2 27 THR HB H -7.779 -9.148 -2.172 1.00 . B B . 27 THR HB 1 1 9 7009 2 2 27 THR HG1 H -7.198 -10.694 -3.501 1.00 . B B . 27 THR HG1 1 1 9 7010 2 2 27 THR HG21 H -5.165 -8.253 -3.465 1.00 . B B . 27 THR HG21 1 1 9 7011 2 2 27 THR HG22 H -6.772 -8.031 -4.120 1.00 . B B . 27 THR HG22 1 1 9 7012 2 2 27 THR HG23 H -6.279 -7.138 -2.697 1.00 . B B . 27 THR HG23 1 1 9 7013 2 2 27 THR N N -5.861 -8.076 -0.322 1.00 . B B . 27 THR N 1 1 9 7014 2 2 27 THR O O -3.612 -9.364 -1.765 1.00 . B B . 27 THR O 1 1 9 7015 2 2 27 THR OG1 O -6.377 -10.320 -3.161 1.00 . B B . 27 THR OG1 1 1 9 7016 2 2 28 PRO C C -3.204 -12.326 -3.112 1.00 . B B . 28 PRO C 1 1 9 7017 2 2 28 PRO CA C -3.205 -12.037 -1.585 1.00 . B B . 28 PRO CA 1 1 9 7018 2 2 28 PRO CB C -3.166 -13.292 -0.706 1.00 . B B . 28 PRO CB 1 1 9 7019 2 2 28 PRO CD C -4.844 -11.874 0.242 1.00 . B B . 28 PRO CD 1 1 9 7020 2 2 28 PRO CG C -3.631 -12.723 0.641 1.00 . B B . 28 PRO CG 1 1 9 7021 2 2 28 PRO HA H -2.324 -11.442 -1.377 1.00 . B B . 28 PRO HA 1 1 9 7022 2 2 28 PRO HB2 H -3.829 -14.060 -1.082 1.00 . B B . 28 PRO HB2 1 1 9 7023 2 2 28 PRO HB3 H -2.154 -13.676 -0.654 1.00 . B B . 28 PRO HB3 1 1 9 7024 2 2 28 PRO HD2 H -5.737 -12.475 0.134 1.00 . B B . 28 PRO HD2 1 1 9 7025 2 2 28 PRO HD3 H -5.017 -11.080 0.961 1.00 . B B . 28 PRO HD3 1 1 9 7026 2 2 28 PRO HG2 H -3.907 -13.510 1.330 1.00 . B B . 28 PRO HG2 1 1 9 7027 2 2 28 PRO HG3 H -2.858 -12.108 1.085 1.00 . B B . 28 PRO HG3 1 1 9 7028 2 2 28 PRO N N -4.437 -11.319 -1.094 1.00 . B B . 28 PRO N 1 1 9 7029 2 2 28 PRO O O -2.556 -13.230 -3.595 1.00 . B B . 28 PRO O 1 1 9 7030 2 2 29 LYS C C -3.219 -12.396 -6.269 1.00 . B B . 29 LYS C 1 1 9 7031 2 2 29 LYS CA C -4.152 -11.556 -5.316 1.00 . B B . 29 LYS CA 1 1 9 7032 2 2 29 LYS CB C -4.163 -10.027 -5.709 1.00 . B B . 29 LYS CB 1 1 9 7033 2 2 29 LYS CD C -1.660 -9.923 -5.026 1.00 . B B . 29 LYS CD 1 1 9 7034 2 2 29 LYS CE C -0.564 -9.141 -4.298 1.00 . B B . 29 LYS CE 1 1 9 7035 2 2 29 LYS CG C -3.036 -9.186 -5.008 1.00 . B B . 29 LYS CG 1 1 9 7036 2 2 29 LYS H H -4.480 -10.860 -3.330 1.00 . B B . 29 LYS H 1 1 9 7037 2 2 29 LYS HA H -5.147 -11.930 -5.502 1.00 . B B . 29 LYS HA 1 1 9 7038 2 2 29 LYS HB2 H -4.088 -9.913 -6.782 1.00 . B B . 29 LYS HB2 1 1 9 7039 2 2 29 LYS HB3 H -5.118 -9.617 -5.401 1.00 . B B . 29 LYS HB3 1 1 9 7040 2 2 29 LYS HD2 H -1.724 -10.891 -4.557 1.00 . B B . 29 LYS HD2 1 1 9 7041 2 2 29 LYS HD3 H -1.352 -10.079 -6.051 1.00 . B B . 29 LYS HD3 1 1 9 7042 2 2 29 LYS HE2 H 0.346 -9.732 -4.246 1.00 . B B . 29 LYS HE2 1 1 9 7043 2 2 29 LYS HE3 H -0.342 -8.231 -4.847 1.00 . B B . 29 LYS HE3 1 1 9 7044 2 2 29 LYS HG2 H -2.944 -8.238 -5.524 1.00 . B B . 29 LYS HG2 1 1 9 7045 2 2 29 LYS HG3 H -3.341 -8.979 -3.998 1.00 . B B . 29 LYS HG3 1 1 9 7046 2 2 29 LYS HZ1 H -1.997 -9.116 -2.688 1.00 . B B . 29 LYS HZ1 1 1 9 7047 2 2 29 LYS HZ2 H -0.433 -9.282 -2.218 1.00 . B B . 29 LYS HZ2 1 1 9 7048 2 2 29 LYS HZ3 H -0.921 -7.805 -2.719 1.00 . B B . 29 LYS HZ3 1 1 9 7049 2 2 29 LYS N N -3.963 -11.533 -3.818 1.00 . B B . 29 LYS N 1 1 9 7050 2 2 29 LYS NZ N -1.036 -8.813 -2.923 1.00 . B B . 29 LYS NZ 1 1 9 7051 2 2 29 LYS O O -2.645 -11.879 -7.205 1.00 . B B . 29 LYS O 1 1 9 7052 2 2 30 THR C C -2.926 -15.826 -7.397 1.00 . B B . 30 THR C 1 1 9 7053 2 2 30 THR CA C -2.213 -14.576 -6.876 1.00 . B B . 30 THR CA 1 1 9 7054 2 2 30 THR CB C -0.997 -15.054 -6.083 1.00 . B B . 30 THR CB 1 1 9 7055 2 2 30 THR CG2 C -0.142 -13.917 -5.567 1.00 . B B . 30 THR CG2 1 1 9 7056 2 2 30 THR H H -3.555 -14.023 -5.237 1.00 . B B . 30 THR H 1 1 9 7057 2 2 30 THR HA H -1.863 -14.038 -7.745 1.00 . B B . 30 THR HA 1 1 9 7058 2 2 30 THR HB H -0.427 -15.833 -6.584 1.00 . B B . 30 THR HB 1 1 9 7059 2 2 30 THR HG1 H -1.805 -14.767 -4.361 1.00 . B B . 30 THR HG1 1 1 9 7060 2 2 30 THR HG21 H -0.700 -13.260 -4.923 1.00 . B B . 30 THR HG21 1 1 9 7061 2 2 30 THR HG22 H 0.684 -14.329 -5.007 1.00 . B B . 30 THR HG22 1 1 9 7062 2 2 30 THR HG23 H 0.242 -13.345 -6.397 1.00 . B B . 30 THR HG23 1 1 9 7063 2 2 30 THR N N -3.084 -13.665 -6.018 1.00 . B B . 30 THR N 1 1 9 7064 2 2 30 THR O O -2.719 -16.264 -8.514 1.00 . B B . 30 THR O 1 1 9 7065 2 2 30 THR OG1 O -1.569 -15.544 -4.888 1.00 . B B . 30 THR OG1 1 1 10 7066 1 1 1 GLY C C -1.204 -6.776 -2.559 1.00 . A A . 1 GLY C 1 1 10 7067 1 1 1 GLY CA C -1.282 -8.022 -3.450 1.00 . A A . 1 GLY CA 1 1 10 7068 1 1 1 GLY HA2 H -2.172 -8.560 -3.169 1.00 . A A . 1 GLY HA2 1 1 10 7069 1 1 1 GLY HA3 H -0.423 -8.637 -3.211 1.00 . A A . 1 GLY HA3 1 1 10 7070 1 1 1 GLY N N -1.307 -7.785 -4.944 1.00 . A A . 1 GLY N 1 1 10 7071 1 1 1 GLY O O -2.178 -6.434 -1.914 1.00 . A A . 1 GLY O 1 1 10 7072 1 1 2 ILE C C 1.739 -5.240 -1.067 1.00 . A A . 2 ILE C 1 1 10 7073 1 1 2 ILE CA C 0.424 -4.945 -1.846 1.00 . A A . 2 ILE CA 1 1 10 7074 1 1 2 ILE CB C -0.694 -4.410 -0.807 1.00 . A A . 2 ILE CB 1 1 10 7075 1 1 2 ILE CD1 C -1.086 -2.521 0.958 1.00 . A A . 2 ILE CD1 1 1 10 7076 1 1 2 ILE CG1 C -0.226 -3.013 -0.268 1.00 . A A . 2 ILE CG1 1 1 10 7077 1 1 2 ILE CG2 C -0.890 -5.328 0.424 1.00 . A A . 2 ILE CG2 1 1 10 7078 1 1 2 ILE H H 0.616 -6.642 -3.154 1.00 . A A . 2 ILE H 1 1 10 7079 1 1 2 ILE HA H 0.654 -4.177 -2.571 1.00 . A A . 2 ILE HA 1 1 10 7080 1 1 2 ILE HB H -1.633 -4.287 -1.329 1.00 . A A . 2 ILE HB 1 1 10 7081 1 1 2 ILE HD11 H -2.128 -2.423 0.704 1.00 . A A . 2 ILE HD11 1 1 10 7082 1 1 2 ILE HD12 H -1.003 -3.182 1.810 1.00 . A A . 2 ILE HD12 1 1 10 7083 1 1 2 ILE HD13 H -0.721 -1.563 1.287 1.00 . A A . 2 ILE HD13 1 1 10 7084 1 1 2 ILE HG12 H 0.820 -3.048 0.006 1.00 . A A . 2 ILE HG12 1 1 10 7085 1 1 2 ILE HG13 H -0.305 -2.284 -1.067 1.00 . A A . 2 ILE HG13 1 1 10 7086 1 1 2 ILE HG21 H -1.078 -6.349 0.132 1.00 . A A . 2 ILE HG21 1 1 10 7087 1 1 2 ILE HG22 H -0.028 -5.280 1.070 1.00 . A A . 2 ILE HG22 1 1 10 7088 1 1 2 ILE HG23 H -1.744 -4.981 0.977 1.00 . A A . 2 ILE HG23 1 1 10 7089 1 1 2 ILE N N -0.040 -6.190 -2.581 1.00 . A A . 2 ILE N 1 1 10 7090 1 1 2 ILE O O 2.776 -4.649 -1.312 1.00 . A A . 2 ILE O 1 1 10 7091 1 1 3 VAL C C 4.133 -6.928 -0.147 1.00 . A A . 3 VAL C 1 1 10 7092 1 1 3 VAL CA C 2.892 -6.522 0.671 1.00 . A A . 3 VAL CA 1 1 10 7093 1 1 3 VAL CB C 2.481 -7.669 1.687 1.00 . A A . 3 VAL CB 1 1 10 7094 1 1 3 VAL CG1 C 1.543 -7.097 2.768 1.00 . A A . 3 VAL CG1 1 1 10 7095 1 1 3 VAL CG2 C 1.710 -8.827 1.018 1.00 . A A . 3 VAL CG2 1 1 10 7096 1 1 3 VAL H H 0.837 -6.626 -0.021 1.00 . A A . 3 VAL H 1 1 10 7097 1 1 3 VAL HA H 3.184 -5.651 1.239 1.00 . A A . 3 VAL HA 1 1 10 7098 1 1 3 VAL HB H 3.375 -8.062 2.161 1.00 . A A . 3 VAL HB 1 1 10 7099 1 1 3 VAL HG11 H 2.027 -6.285 3.297 1.00 . A A . 3 VAL HG11 1 1 10 7100 1 1 3 VAL HG12 H 0.628 -6.727 2.337 1.00 . A A . 3 VAL HG12 1 1 10 7101 1 1 3 VAL HG13 H 1.289 -7.864 3.485 1.00 . A A . 3 VAL HG13 1 1 10 7102 1 1 3 VAL HG21 H 0.814 -8.487 0.519 1.00 . A A . 3 VAL HG21 1 1 10 7103 1 1 3 VAL HG22 H 2.317 -9.338 0.288 1.00 . A A . 3 VAL HG22 1 1 10 7104 1 1 3 VAL HG23 H 1.421 -9.558 1.760 1.00 . A A . 3 VAL HG23 1 1 10 7105 1 1 3 VAL N N 1.685 -6.165 -0.149 1.00 . A A . 3 VAL N 1 1 10 7106 1 1 3 VAL O O 5.126 -6.228 -0.109 1.00 . A A . 3 VAL O 1 1 10 7107 1 1 4 GLU C C 5.890 -7.348 -2.668 1.00 . A A . 4 GLU C 1 1 10 7108 1 1 4 GLU CA C 5.306 -8.410 -1.686 1.00 . A A . 4 GLU CA 1 1 10 7109 1 1 4 GLU CB C 4.885 -9.711 -2.408 1.00 . A A . 4 GLU CB 1 1 10 7110 1 1 4 GLU CD C 2.471 -8.852 -2.872 1.00 . A A . 4 GLU CD 1 1 10 7111 1 1 4 GLU CG C 3.748 -9.441 -3.455 1.00 . A A . 4 GLU CG 1 1 10 7112 1 1 4 GLU H H 3.280 -8.530 -0.931 1.00 . A A . 4 GLU H 1 1 10 7113 1 1 4 GLU HA H 6.105 -8.582 -0.977 1.00 . A A . 4 GLU HA 1 1 10 7114 1 1 4 GLU HB2 H 5.743 -10.149 -2.899 1.00 . A A . 4 GLU HB2 1 1 10 7115 1 1 4 GLU HB3 H 4.525 -10.419 -1.673 1.00 . A A . 4 GLU HB3 1 1 10 7116 1 1 4 GLU HG2 H 4.113 -8.778 -4.221 1.00 . A A . 4 GLU HG2 1 1 10 7117 1 1 4 GLU HG3 H 3.475 -10.373 -3.918 1.00 . A A . 4 GLU HG3 1 1 10 7118 1 1 4 GLU N N 4.101 -7.993 -0.884 1.00 . A A . 4 GLU N 1 1 10 7119 1 1 4 GLU O O 6.841 -7.567 -3.397 1.00 . A A . 4 GLU O 1 1 10 7120 1 1 4 GLU OE1 O 1.835 -9.530 -2.098 1.00 . A A . 4 GLU OE1 1 1 10 7121 1 1 4 GLU OE2 O 2.192 -7.729 -3.224 1.00 . A A . 4 GLU OE2 1 1 10 7122 1 1 5 GLN C C 6.211 -3.906 -2.628 1.00 . A A . 5 GLN C 1 1 10 7123 1 1 5 GLN CA C 5.781 -5.070 -3.554 1.00 . A A . 5 GLN CA 1 1 10 7124 1 1 5 GLN CB C 4.612 -4.681 -4.461 1.00 . A A . 5 GLN CB 1 1 10 7125 1 1 5 GLN CD C 2.736 -5.455 -5.886 1.00 . A A . 5 GLN CD 1 1 10 7126 1 1 5 GLN CG C 4.047 -5.881 -5.255 1.00 . A A . 5 GLN CG 1 1 10 7127 1 1 5 GLN H H 4.543 -6.065 -2.088 1.00 . A A . 5 GLN H 1 1 10 7128 1 1 5 GLN HA H 6.657 -5.343 -4.124 1.00 . A A . 5 GLN HA 1 1 10 7129 1 1 5 GLN HB2 H 3.817 -4.215 -3.890 1.00 . A A . 5 GLN HB2 1 1 10 7130 1 1 5 GLN HB3 H 4.986 -3.983 -5.196 1.00 . A A . 5 GLN HB3 1 1 10 7131 1 1 5 GLN HE21 H 1.716 -6.642 -4.743 1.00 . A A . 5 GLN HE21 1 1 10 7132 1 1 5 GLN HE22 H 0.795 -5.718 -5.850 1.00 . A A . 5 GLN HE22 1 1 10 7133 1 1 5 GLN HG2 H 4.705 -6.180 -6.055 1.00 . A A . 5 GLN HG2 1 1 10 7134 1 1 5 GLN HG3 H 3.850 -6.729 -4.622 1.00 . A A . 5 GLN HG3 1 1 10 7135 1 1 5 GLN N N 5.315 -6.187 -2.676 1.00 . A A . 5 GLN N 1 1 10 7136 1 1 5 GLN NE2 N 1.650 -5.982 -5.460 1.00 . A A . 5 GLN NE2 1 1 10 7137 1 1 5 GLN O O 7.319 -3.419 -2.664 1.00 . A A . 5 GLN O 1 1 10 7138 1 1 5 GLN OE1 O 2.682 -4.630 -6.769 1.00 . A A . 5 GLN OE1 1 1 10 7139 1 1 6 CYS C C 6.580 -2.739 0.274 1.00 . A A . 6 CYS C 1 1 10 7140 1 1 6 CYS CA C 5.604 -2.352 -0.840 1.00 . A A . 6 CYS CA 1 1 10 7141 1 1 6 CYS CB C 4.253 -1.947 -0.317 1.00 . A A . 6 CYS CB 1 1 10 7142 1 1 6 CYS H H 4.432 -3.895 -1.767 1.00 . A A . 6 CYS H 1 1 10 7143 1 1 6 CYS HA H 6.052 -1.524 -1.372 1.00 . A A . 6 CYS HA 1 1 10 7144 1 1 6 CYS HB2 H 3.827 -2.750 0.270 1.00 . A A . 6 CYS HB2 1 1 10 7145 1 1 6 CYS HB3 H 4.347 -1.082 0.322 1.00 . A A . 6 CYS HB3 1 1 10 7146 1 1 6 CYS HG H 3.286 -0.622 -1.847 1.00 . A A . 6 CYS HG 1 1 10 7147 1 1 6 CYS N N 5.320 -3.478 -1.790 1.00 . A A . 6 CYS N 1 1 10 7148 1 1 6 CYS O O 7.220 -1.904 0.873 1.00 . A A . 6 CYS O 1 1 10 7149 1 1 6 CYS SG S 3.104 -1.543 -1.646 1.00 . A A . 6 CYS SG 1 1 10 7150 1 1 7 CYS C C 8.614 -5.540 0.961 1.00 . A A . 7 CYS C 1 1 10 7151 1 1 7 CYS CA C 7.539 -4.580 1.560 1.00 . A A . 7 CYS CA 1 1 10 7152 1 1 7 CYS CB C 6.516 -5.200 2.512 1.00 . A A . 7 CYS CB 1 1 10 7153 1 1 7 CYS H H 6.086 -4.643 0.007 1.00 . A A . 7 CYS H 1 1 10 7154 1 1 7 CYS HA H 8.072 -3.783 2.062 1.00 . A A . 7 CYS HA 1 1 10 7155 1 1 7 CYS HB2 H 6.016 -4.335 2.921 1.00 . A A . 7 CYS HB2 1 1 10 7156 1 1 7 CYS HB3 H 5.743 -5.704 1.953 1.00 . A A . 7 CYS HB3 1 1 10 7157 1 1 7 CYS HG H 7.244 -7.135 3.497 1.00 . A A . 7 CYS HG 1 1 10 7158 1 1 7 CYS N N 6.645 -4.015 0.513 1.00 . A A . 7 CYS N 1 1 10 7159 1 1 7 CYS O O 9.366 -6.193 1.655 1.00 . A A . 7 CYS O 1 1 10 7160 1 1 7 CYS SG S 7.072 -6.265 3.867 1.00 . A A . 7 CYS SG 1 1 10 7161 1 1 8 THR C C 10.002 -5.950 -2.488 1.00 . A A . 8 THR C 1 1 10 7162 1 1 8 THR CA C 9.644 -6.487 -1.084 1.00 . A A . 8 THR CA 1 1 10 7163 1 1 8 THR CB C 9.073 -7.924 -1.242 1.00 . A A . 8 THR CB 1 1 10 7164 1 1 8 THR CG2 C 10.112 -8.924 -1.671 1.00 . A A . 8 THR CG2 1 1 10 7165 1 1 8 THR H H 8.005 -5.049 -0.829 1.00 . A A . 8 THR H 1 1 10 7166 1 1 8 THR HA H 10.567 -6.530 -0.524 1.00 . A A . 8 THR HA 1 1 10 7167 1 1 8 THR HB H 8.187 -8.001 -1.836 1.00 . A A . 8 THR HB 1 1 10 7168 1 1 8 THR HG1 H 9.197 -7.809 0.713 1.00 . A A . 8 THR HG1 1 1 10 7169 1 1 8 THR HG21 H 10.526 -8.651 -2.630 1.00 . A A . 8 THR HG21 1 1 10 7170 1 1 8 THR HG22 H 10.899 -8.988 -0.939 1.00 . A A . 8 THR HG22 1 1 10 7171 1 1 8 THR HG23 H 9.639 -9.890 -1.758 1.00 . A A . 8 THR HG23 1 1 10 7172 1 1 8 THR N N 8.649 -5.603 -0.345 1.00 . A A . 8 THR N 1 1 10 7173 1 1 8 THR O O 11.135 -5.627 -2.776 1.00 . A A . 8 THR O 1 1 10 7174 1 1 8 THR OG1 O 8.809 -8.410 0.060 1.00 . A A . 8 THR OG1 1 1 10 7175 1 1 9 SER C C 8.691 -3.913 -4.936 1.00 . A A . 9 SER C 1 1 10 7176 1 1 9 SER CA C 9.258 -5.337 -4.762 1.00 . A A . 9 SER CA 1 1 10 7177 1 1 9 SER CB C 8.570 -6.253 -5.783 1.00 . A A . 9 SER CB 1 1 10 7178 1 1 9 SER H H 8.132 -6.125 -3.062 1.00 . A A . 9 SER H 1 1 10 7179 1 1 9 SER HA H 10.320 -5.301 -4.967 1.00 . A A . 9 SER HA 1 1 10 7180 1 1 9 SER HB2 H 7.502 -6.091 -5.837 1.00 . A A . 9 SER HB2 1 1 10 7181 1 1 9 SER HB3 H 9.012 -6.097 -6.759 1.00 . A A . 9 SER HB3 1 1 10 7182 1 1 9 SER HG H 8.181 -7.776 -4.664 1.00 . A A . 9 SER HG 1 1 10 7183 1 1 9 SER N N 9.025 -5.851 -3.347 1.00 . A A . 9 SER N 1 1 10 7184 1 1 9 SER O O 7.672 -3.676 -5.551 1.00 . A A . 9 SER O 1 1 10 7185 1 1 9 SER OG O 8.865 -7.566 -5.318 1.00 . A A . 9 SER OG 1 1 10 7186 1 1 10 ILE C C 7.908 -0.893 -4.939 1.00 . A A . 10 ILE C 1 1 10 7187 1 1 10 ILE CA C 9.181 -1.536 -4.301 1.00 . A A . 10 ILE CA 1 1 10 7188 1 1 10 ILE CB C 10.435 -0.799 -4.892 1.00 . A A . 10 ILE CB 1 1 10 7189 1 1 10 ILE CD1 C 11.372 -2.526 -6.622 1.00 . A A . 10 ILE CD1 1 1 10 7190 1 1 10 ILE CG1 C 10.747 -1.120 -6.381 1.00 . A A . 10 ILE CG1 1 1 10 7191 1 1 10 ILE CG2 C 11.649 -1.073 -3.989 1.00 . A A . 10 ILE CG2 1 1 10 7192 1 1 10 ILE H H 10.211 -3.394 -3.905 1.00 . A A . 10 ILE H 1 1 10 7193 1 1 10 ILE HA H 9.087 -1.311 -3.252 1.00 . A A . 10 ILE HA 1 1 10 7194 1 1 10 ILE HB H 10.232 0.262 -4.866 1.00 . A A . 10 ILE HB 1 1 10 7195 1 1 10 ILE HD11 H 12.304 -2.628 -6.083 1.00 . A A . 10 ILE HD11 1 1 10 7196 1 1 10 ILE HD12 H 10.705 -3.311 -6.316 1.00 . A A . 10 ILE HD12 1 1 10 7197 1 1 10 ILE HD13 H 11.572 -2.654 -7.675 1.00 . A A . 10 ILE HD13 1 1 10 7198 1 1 10 ILE HG12 H 9.823 -1.043 -6.940 1.00 . A A . 10 ILE HG12 1 1 10 7199 1 1 10 ILE HG13 H 11.399 -0.344 -6.754 1.00 . A A . 10 ILE HG13 1 1 10 7200 1 1 10 ILE HG21 H 11.459 -0.744 -2.978 1.00 . A A . 10 ILE HG21 1 1 10 7201 1 1 10 ILE HG22 H 11.864 -2.128 -3.956 1.00 . A A . 10 ILE HG22 1 1 10 7202 1 1 10 ILE HG23 H 12.509 -0.544 -4.365 1.00 . A A . 10 ILE HG23 1 1 10 7203 1 1 10 ILE N N 9.427 -3.030 -4.348 1.00 . A A . 10 ILE N 1 1 10 7204 1 1 10 ILE O O 7.889 -0.303 -6.001 1.00 . A A . 10 ILE O 1 1 10 7205 1 1 11 CYS C C 5.045 0.803 -3.886 1.00 . A A . 11 CYS C 1 1 10 7206 1 1 11 CYS CA C 5.492 -0.471 -4.645 1.00 . A A . 11 CYS CA 1 1 10 7207 1 1 11 CYS CB C 4.504 -1.640 -4.447 1.00 . A A . 11 CYS CB 1 1 10 7208 1 1 11 CYS H H 6.944 -1.498 -3.372 1.00 . A A . 11 CYS H 1 1 10 7209 1 1 11 CYS HA H 5.526 -0.227 -5.696 1.00 . A A . 11 CYS HA 1 1 10 7210 1 1 11 CYS HB2 H 4.300 -2.116 -5.388 1.00 . A A . 11 CYS HB2 1 1 10 7211 1 1 11 CYS HB3 H 5.015 -2.331 -3.816 1.00 . A A . 11 CYS HB3 1 1 10 7212 1 1 11 CYS HG H 2.289 -1.032 -4.164 1.00 . A A . 11 CYS HG 1 1 10 7213 1 1 11 CYS N N 6.837 -1.017 -4.218 1.00 . A A . 11 CYS N 1 1 10 7214 1 1 11 CYS O O 4.270 0.700 -2.966 1.00 . A A . 11 CYS O 1 1 10 7215 1 1 11 CYS SG S 2.917 -1.484 -3.603 1.00 . A A . 11 CYS SG 1 1 10 7216 1 1 12 SER C C 4.082 4.358 -3.828 1.00 . A A . 12 SER C 1 1 10 7217 1 1 12 SER CA C 4.977 3.180 -3.388 1.00 . A A . 12 SER CA 1 1 10 7218 1 1 12 SER CB C 6.170 3.804 -2.740 1.00 . A A . 12 SER CB 1 1 10 7219 1 1 12 SER H H 6.138 2.104 -4.935 1.00 . A A . 12 SER H 1 1 10 7220 1 1 12 SER HA H 4.385 2.774 -2.586 1.00 . A A . 12 SER HA 1 1 10 7221 1 1 12 SER HB2 H 5.858 4.622 -2.105 1.00 . A A . 12 SER HB2 1 1 10 7222 1 1 12 SER HB3 H 6.676 3.029 -2.186 1.00 . A A . 12 SER HB3 1 1 10 7223 1 1 12 SER HG H 7.280 5.163 -3.684 1.00 . A A . 12 SER HG 1 1 10 7224 1 1 12 SER N N 5.485 1.992 -4.208 1.00 . A A . 12 SER N 1 1 10 7225 1 1 12 SER O O 4.512 5.447 -4.137 1.00 . A A . 12 SER O 1 1 10 7226 1 1 12 SER OG O 6.953 4.259 -3.842 1.00 . A A . 12 SER OG 1 1 10 7227 1 1 13 LEU C C 0.846 4.035 -5.180 1.00 . A A . 13 LEU C 1 1 10 7228 1 1 13 LEU CA C 1.612 4.832 -4.140 1.00 . A A . 13 LEU CA 1 1 10 7229 1 1 13 LEU CB C 2.038 6.230 -4.685 1.00 . A A . 13 LEU CB 1 1 10 7230 1 1 13 LEU CD1 C -0.059 7.308 -3.871 1.00 . A A . 13 LEU CD1 1 1 10 7231 1 1 13 LEU CD2 C 1.371 8.385 -5.575 1.00 . A A . 13 LEU CD2 1 1 10 7232 1 1 13 LEU CG C 0.825 7.056 -5.093 1.00 . A A . 13 LEU CG 1 1 10 7233 1 1 13 LEU H H 2.649 3.099 -3.591 1.00 . A A . 13 LEU H 1 1 10 7234 1 1 13 LEU HA H 0.991 4.924 -3.264 1.00 . A A . 13 LEU HA 1 1 10 7235 1 1 13 LEU HB2 H 2.570 6.763 -3.908 1.00 . A A . 13 LEU HB2 1 1 10 7236 1 1 13 LEU HB3 H 2.705 6.142 -5.528 1.00 . A A . 13 LEU HB3 1 1 10 7237 1 1 13 LEU HD11 H 0.493 7.813 -3.092 1.00 . A A . 13 LEU HD11 1 1 10 7238 1 1 13 LEU HD12 H -0.901 7.916 -4.164 1.00 . A A . 13 LEU HD12 1 1 10 7239 1 1 13 LEU HD13 H -0.448 6.376 -3.488 1.00 . A A . 13 LEU HD13 1 1 10 7240 1 1 13 LEU HD21 H 1.925 8.876 -4.789 1.00 . A A . 13 LEU HD21 1 1 10 7241 1 1 13 LEU HD22 H 2.033 8.226 -6.414 1.00 . A A . 13 LEU HD22 1 1 10 7242 1 1 13 LEU HD23 H 0.557 9.018 -5.892 1.00 . A A . 13 LEU HD23 1 1 10 7243 1 1 13 LEU HG H 0.252 6.569 -5.883 1.00 . A A . 13 LEU HG 1 1 10 7244 1 1 13 LEU N N 2.825 4.018 -3.816 1.00 . A A . 13 LEU N 1 1 10 7245 1 1 13 LEU O O -0.212 3.498 -4.935 1.00 . A A . 13 LEU O 1 1 10 7246 1 1 14 TYR C C 0.539 1.857 -7.146 1.00 . A A . 14 TYR C 1 1 10 7247 1 1 14 TYR CA C 1.031 3.250 -7.501 1.00 . A A . 14 TYR CA 1 1 10 7248 1 1 14 TYR CB C 2.164 3.189 -8.573 1.00 . A A . 14 TYR CB 1 1 10 7249 1 1 14 TYR CD1 C 4.081 4.327 -7.433 1.00 . A A . 14 TYR CD1 1 1 10 7250 1 1 14 TYR CD2 C 4.275 2.003 -7.903 1.00 . A A . 14 TYR CD2 1 1 10 7251 1 1 14 TYR CE1 C 5.328 4.327 -6.858 1.00 . A A . 14 TYR CE1 1 1 10 7252 1 1 14 TYR CE2 C 5.524 2.013 -7.328 1.00 . A A . 14 TYR CE2 1 1 10 7253 1 1 14 TYR CG C 3.550 3.166 -7.955 1.00 . A A . 14 TYR CG 1 1 10 7254 1 1 14 TYR CZ C 6.047 3.161 -6.810 1.00 . A A . 14 TYR CZ 1 1 10 7255 1 1 14 TYR H H 2.394 4.395 -6.177 1.00 . A A . 14 TYR H 1 1 10 7256 1 1 14 TYR HA H 0.191 3.788 -7.918 1.00 . A A . 14 TYR HA 1 1 10 7257 1 1 14 TYR HB2 H 2.025 2.316 -9.197 1.00 . A A . 14 TYR HB2 1 1 10 7258 1 1 14 TYR HB3 H 2.072 4.062 -9.203 1.00 . A A . 14 TYR HB3 1 1 10 7259 1 1 14 TYR HD1 H 3.514 5.248 -7.482 1.00 . A A . 14 TYR HD1 1 1 10 7260 1 1 14 TYR HD2 H 3.872 1.086 -8.312 1.00 . A A . 14 TYR HD2 1 1 10 7261 1 1 14 TYR HE1 H 5.726 5.246 -6.442 1.00 . A A . 14 TYR HE1 1 1 10 7262 1 1 14 TYR HE2 H 6.116 1.115 -7.278 1.00 . A A . 14 TYR HE2 1 1 10 7263 1 1 14 TYR HH H 7.226 3.667 -5.462 1.00 . A A . 14 TYR HH 1 1 10 7264 1 1 14 TYR N N 1.528 3.964 -6.273 1.00 . A A . 14 TYR N 1 1 10 7265 1 1 14 TYR O O -0.326 1.304 -7.795 1.00 . A A . 14 TYR O 1 1 10 7266 1 1 14 TYR OH O 7.290 3.098 -6.239 1.00 . A A . 14 TYR OH 1 1 10 7267 1 1 15 GLN C C 0.134 -0.211 -4.320 1.00 . A A . 15 GLN C 1 1 10 7268 1 1 15 GLN CA C 0.601 -0.094 -5.779 1.00 . A A . 15 GLN CA 1 1 10 7269 1 1 15 GLN CB C 1.728 -1.088 -6.194 1.00 . A A . 15 GLN CB 1 1 10 7270 1 1 15 GLN CD C 0.295 -1.947 -8.085 1.00 . A A . 15 GLN CD 1 1 10 7271 1 1 15 GLN CG C 1.637 -1.321 -7.738 1.00 . A A . 15 GLN CG 1 1 10 7272 1 1 15 GLN H H 1.859 1.717 -5.622 1.00 . A A . 15 GLN H 1 1 10 7273 1 1 15 GLN HA H -0.296 -0.297 -6.343 1.00 . A A . 15 GLN HA 1 1 10 7274 1 1 15 GLN HB2 H 2.699 -0.689 -5.959 1.00 . A A . 15 GLN HB2 1 1 10 7275 1 1 15 GLN HB3 H 1.589 -2.046 -5.702 1.00 . A A . 15 GLN HB3 1 1 10 7276 1 1 15 GLN HE21 H -0.369 -0.428 -9.160 1.00 . A A . 15 GLN HE21 1 1 10 7277 1 1 15 GLN HE22 H -1.361 -1.824 -9.037 1.00 . A A . 15 GLN HE22 1 1 10 7278 1 1 15 GLN HG2 H 1.729 -0.403 -8.296 1.00 . A A . 15 GLN HG2 1 1 10 7279 1 1 15 GLN HG3 H 2.396 -2.017 -8.061 1.00 . A A . 15 GLN HG3 1 1 10 7280 1 1 15 GLN N N 1.119 1.272 -6.123 1.00 . A A . 15 GLN N 1 1 10 7281 1 1 15 GLN NE2 N -0.543 -1.331 -8.830 1.00 . A A . 15 GLN NE2 1 1 10 7282 1 1 15 GLN O O 0.249 -1.192 -3.622 1.00 . A A . 15 GLN O 1 1 10 7283 1 1 15 GLN OE1 O -0.035 -3.029 -7.673 1.00 . A A . 15 GLN OE1 1 1 10 7284 1 1 16 LEU C C -2.463 1.374 -3.047 1.00 . A A . 16 LEU C 1 1 10 7285 1 1 16 LEU CA C -1.006 1.157 -2.610 1.00 . A A . 16 LEU CA 1 1 10 7286 1 1 16 LEU CB C -0.388 2.443 -1.969 1.00 . A A . 16 LEU CB 1 1 10 7287 1 1 16 LEU CD1 C 0.677 1.617 0.148 1.00 . A A . 16 LEU CD1 1 1 10 7288 1 1 16 LEU CD2 C 1.809 1.167 -1.889 1.00 . A A . 16 LEU CD2 1 1 10 7289 1 1 16 LEU CG C 0.948 2.219 -1.224 1.00 . A A . 16 LEU CG 1 1 10 7290 1 1 16 LEU H H -0.453 1.636 -4.547 1.00 . A A . 16 LEU H 1 1 10 7291 1 1 16 LEU HA H -0.922 0.266 -2.050 1.00 . A A . 16 LEU HA 1 1 10 7292 1 1 16 LEU HB2 H -0.247 3.193 -2.726 1.00 . A A . 16 LEU HB2 1 1 10 7293 1 1 16 LEU HB3 H -1.101 2.841 -1.261 1.00 . A A . 16 LEU HB3 1 1 10 7294 1 1 16 LEU HD11 H 0.059 2.252 0.760 1.00 . A A . 16 LEU HD11 1 1 10 7295 1 1 16 LEU HD12 H 0.204 0.647 0.062 1.00 . A A . 16 LEU HD12 1 1 10 7296 1 1 16 LEU HD13 H 1.621 1.475 0.656 1.00 . A A . 16 LEU HD13 1 1 10 7297 1 1 16 LEU HD21 H 2.047 1.402 -2.911 1.00 . A A . 16 LEU HD21 1 1 10 7298 1 1 16 LEU HD22 H 2.731 1.062 -1.330 1.00 . A A . 16 LEU HD22 1 1 10 7299 1 1 16 LEU HD23 H 1.326 0.198 -1.872 1.00 . A A . 16 LEU HD23 1 1 10 7300 1 1 16 LEU HG H 1.485 3.156 -1.130 1.00 . A A . 16 LEU HG 1 1 10 7301 1 1 16 LEU N N -0.418 0.897 -3.933 1.00 . A A . 16 LEU N 1 1 10 7302 1 1 16 LEU O O -3.366 0.693 -2.607 1.00 . A A . 16 LEU O 1 1 10 7303 1 1 17 GLU C C -4.698 1.315 -4.865 1.00 . A A . 17 GLU C 1 1 10 7304 1 1 17 GLU CA C -4.022 2.638 -4.471 1.00 . A A . 17 GLU CA 1 1 10 7305 1 1 17 GLU CB C -3.793 3.618 -5.648 1.00 . A A . 17 GLU CB 1 1 10 7306 1 1 17 GLU CD C -2.163 4.154 -7.544 1.00 . A A . 17 GLU CD 1 1 10 7307 1 1 17 GLU CG C -2.778 3.041 -6.703 1.00 . A A . 17 GLU CG 1 1 10 7308 1 1 17 GLU H H -1.879 2.811 -4.289 1.00 . A A . 17 GLU H 1 1 10 7309 1 1 17 GLU HA H -4.629 3.100 -3.711 1.00 . A A . 17 GLU HA 1 1 10 7310 1 1 17 GLU HB2 H -4.732 3.836 -6.143 1.00 . A A . 17 GLU HB2 1 1 10 7311 1 1 17 GLU HB3 H -3.407 4.557 -5.270 1.00 . A A . 17 GLU HB3 1 1 10 7312 1 1 17 GLU HG2 H -1.953 2.516 -6.264 1.00 . A A . 17 GLU HG2 1 1 10 7313 1 1 17 GLU HG3 H -3.284 2.394 -7.402 1.00 . A A . 17 GLU HG3 1 1 10 7314 1 1 17 GLU N N -2.653 2.313 -3.939 1.00 . A A . 17 GLU N 1 1 10 7315 1 1 17 GLU O O -5.676 0.931 -4.270 1.00 . A A . 17 GLU O 1 1 10 7316 1 1 17 GLU OE1 O -1.569 5.021 -6.929 1.00 . A A . 17 GLU OE1 1 1 10 7317 1 1 17 GLU OE2 O -2.321 4.047 -8.740 1.00 . A A . 17 GLU OE2 1 1 10 7318 1 1 18 ASN C C -5.282 -1.624 -5.244 1.00 . A A . 18 ASN C 1 1 10 7319 1 1 18 ASN CA C -4.653 -0.684 -6.343 1.00 . A A . 18 ASN CA 1 1 10 7320 1 1 18 ASN CB C -3.406 -1.272 -7.072 1.00 . A A . 18 ASN CB 1 1 10 7321 1 1 18 ASN CG C -3.662 -2.518 -7.888 1.00 . A A . 18 ASN CG 1 1 10 7322 1 1 18 ASN H H -3.330 1.020 -6.208 1.00 . A A . 18 ASN H 1 1 10 7323 1 1 18 ASN HA H -5.491 -0.467 -6.986 1.00 . A A . 18 ASN HA 1 1 10 7324 1 1 18 ASN HB2 H -3.000 -0.534 -7.750 1.00 . A A . 18 ASN HB2 1 1 10 7325 1 1 18 ASN HB3 H -2.632 -1.521 -6.363 1.00 . A A . 18 ASN HB3 1 1 10 7326 1 1 18 ASN HD21 H -5.472 -2.950 -7.210 1.00 . A A . 18 ASN HD21 1 1 10 7327 1 1 18 ASN HD22 H -4.801 -3.988 -8.382 1.00 . A A . 18 ASN HD22 1 1 10 7328 1 1 18 ASN N N -4.143 0.640 -5.820 1.00 . A A . 18 ASN N 1 1 10 7329 1 1 18 ASN ND2 N -4.745 -3.202 -7.810 1.00 . A A . 18 ASN ND2 1 1 10 7330 1 1 18 ASN O O -6.125 -2.451 -5.530 1.00 . A A . 18 ASN O 1 1 10 7331 1 1 18 ASN OD1 O -2.828 -2.914 -8.658 1.00 . A A . 18 ASN OD1 1 1 10 7332 1 1 19 TYR C C -6.218 -1.459 -1.858 1.00 . A A . 19 TYR C 1 1 10 7333 1 1 19 TYR CA C -5.388 -2.317 -2.865 1.00 . A A . 19 TYR CA 1 1 10 7334 1 1 19 TYR CB C -4.136 -2.953 -2.213 1.00 . A A . 19 TYR CB 1 1 10 7335 1 1 19 TYR CD1 C -3.779 -4.608 -4.098 1.00 . A A . 19 TYR CD1 1 1 10 7336 1 1 19 TYR CD2 C -2.023 -3.111 -3.572 1.00 . A A . 19 TYR CD2 1 1 10 7337 1 1 19 TYR CE1 C -3.002 -5.153 -5.099 1.00 . A A . 19 TYR CE1 1 1 10 7338 1 1 19 TYR CE2 C -1.251 -3.661 -4.575 1.00 . A A . 19 TYR CE2 1 1 10 7339 1 1 19 TYR CG C -3.291 -3.580 -3.326 1.00 . A A . 19 TYR CG 1 1 10 7340 1 1 19 TYR CZ C -1.740 -4.686 -5.341 1.00 . A A . 19 TYR CZ 1 1 10 7341 1 1 19 TYR H H -4.190 -0.792 -3.851 1.00 . A A . 19 TYR H 1 1 10 7342 1 1 19 TYR HA H -6.046 -3.086 -3.245 1.00 . A A . 19 TYR HA 1 1 10 7343 1 1 19 TYR HB2 H -3.540 -2.213 -1.696 1.00 . A A . 19 TYR HB2 1 1 10 7344 1 1 19 TYR HB3 H -4.402 -3.736 -1.519 1.00 . A A . 19 TYR HB3 1 1 10 7345 1 1 19 TYR HD1 H -4.772 -4.989 -3.922 1.00 . A A . 19 TYR HD1 1 1 10 7346 1 1 19 TYR HD2 H -1.627 -2.307 -2.972 1.00 . A A . 19 TYR HD2 1 1 10 7347 1 1 19 TYR HE1 H -3.384 -5.955 -5.706 1.00 . A A . 19 TYR HE1 1 1 10 7348 1 1 19 TYR HE2 H -0.257 -3.282 -4.758 1.00 . A A . 19 TYR HE2 1 1 10 7349 1 1 19 TYR HH H -0.668 -4.510 -6.875 1.00 . A A . 19 TYR HH 1 1 10 7350 1 1 19 TYR N N -4.867 -1.479 -4.015 1.00 . A A . 19 TYR N 1 1 10 7351 1 1 19 TYR O O -7.129 -1.890 -1.176 1.00 . A A . 19 TYR O 1 1 10 7352 1 1 19 TYR OH O -0.986 -5.256 -6.339 1.00 . A A . 19 TYR OH 1 1 10 7353 1 1 20 CYS C C -7.793 1.387 -1.539 1.00 . A A . 20 CYS C 1 1 10 7354 1 1 20 CYS CA C -6.486 0.809 -0.919 1.00 . A A . 20 CYS CA 1 1 10 7355 1 1 20 CYS CB C -5.348 1.798 -0.745 1.00 . A A . 20 CYS CB 1 1 10 7356 1 1 20 CYS H H -5.109 0.055 -2.371 1.00 . A A . 20 CYS H 1 1 10 7357 1 1 20 CYS HA H -6.744 0.421 0.039 1.00 . A A . 20 CYS HA 1 1 10 7358 1 1 20 CYS HB2 H -4.468 1.235 -0.462 1.00 . A A . 20 CYS HB2 1 1 10 7359 1 1 20 CYS HB3 H -5.128 2.264 -1.692 1.00 . A A . 20 CYS HB3 1 1 10 7360 1 1 20 CYS HG H -5.090 2.836 1.273 1.00 . A A . 20 CYS HG 1 1 10 7361 1 1 20 CYS N N -5.856 -0.222 -1.801 1.00 . A A . 20 CYS N 1 1 10 7362 1 1 20 CYS O O -8.857 1.401 -0.954 1.00 . A A . 20 CYS O 1 1 10 7363 1 1 20 CYS SG S -5.556 3.101 0.478 1.00 . A A . 20 CYS SG 1 1 10 7364 1 1 21 ASN C C -9.496 3.529 -3.179 1.00 . A A . 21 ASN C 1 1 10 7365 1 1 21 ASN CA C -8.536 2.432 -3.705 1.00 . A A . 21 ASN CA 1 1 10 7366 1 1 21 ASN CB C -9.331 1.264 -4.329 1.00 . A A . 21 ASN CB 1 1 10 7367 1 1 21 ASN CG C -8.394 0.227 -4.918 1.00 . A A . 21 ASN CG 1 1 10 7368 1 1 21 ASN H H -6.652 1.667 -2.996 1.00 . A A . 21 ASN H 1 1 10 7369 1 1 21 ASN HA H -7.964 2.896 -4.499 1.00 . A A . 21 ASN HA 1 1 10 7370 1 1 21 ASN HB2 H -9.970 0.794 -3.605 1.00 . A A . 21 ASN HB2 1 1 10 7371 1 1 21 ASN HB3 H -9.932 1.635 -5.147 1.00 . A A . 21 ASN HB3 1 1 10 7372 1 1 21 ASN HD21 H -8.553 -1.011 -3.396 1.00 . A A . 21 ASN HD21 1 1 10 7373 1 1 21 ASN HD22 H -7.567 -1.493 -4.710 1.00 . A A . 21 ASN HD22 1 1 10 7374 1 1 21 ASN N N -7.573 1.804 -2.735 1.00 . A A . 21 ASN N 1 1 10 7375 1 1 21 ASN ND2 N -8.159 -0.855 -4.268 1.00 . A A . 21 ASN ND2 1 1 10 7376 1 1 21 ASN O O -9.876 3.635 -2.020 1.00 . A A . 21 ASN O 1 1 10 7377 1 1 21 ASN OD1 O -7.828 0.333 -5.979 1.00 . A A . 21 ASN OD1 1 1 10 7378 2 2 1 PHE C C 8.922 7.618 -3.150 1.00 . B B . 1 PHE C 1 1 10 7379 2 2 1 PHE CA C 8.243 9.013 -3.026 1.00 . B B . 1 PHE CA 1 1 10 7380 2 2 1 PHE CB C 6.714 8.972 -3.411 1.00 . B B . 1 PHE CB 1 1 10 7381 2 2 1 PHE CD1 C 6.838 7.962 -5.757 1.00 . B B . 1 PHE CD1 1 1 10 7382 2 2 1 PHE CD2 C 5.902 10.126 -5.506 1.00 . B B . 1 PHE CD2 1 1 10 7383 2 2 1 PHE CE1 C 6.622 8.025 -7.119 1.00 . B B . 1 PHE CE1 1 1 10 7384 2 2 1 PHE CE2 C 5.684 10.194 -6.867 1.00 . B B . 1 PHE CE2 1 1 10 7385 2 2 1 PHE CG C 6.482 9.010 -4.935 1.00 . B B . 1 PHE CG 1 1 10 7386 2 2 1 PHE CZ C 6.044 9.142 -7.676 1.00 . B B . 1 PHE CZ 1 1 10 7387 2 2 1 PHE HA H 8.341 9.310 -1.993 1.00 . B B . 1 PHE HA 1 1 10 7388 2 2 1 PHE HB2 H 6.257 8.067 -3.036 1.00 . B B . 1 PHE HB2 1 1 10 7389 2 2 1 PHE HB3 H 6.203 9.812 -2.964 1.00 . B B . 1 PHE HB3 1 1 10 7390 2 2 1 PHE HD1 H 7.287 7.077 -5.336 1.00 . B B . 1 PHE HD1 1 1 10 7391 2 2 1 PHE HD2 H 5.615 10.957 -4.878 1.00 . B B . 1 PHE HD2 1 1 10 7392 2 2 1 PHE HE1 H 6.908 7.192 -7.747 1.00 . B B . 1 PHE HE1 1 1 10 7393 2 2 1 PHE HE2 H 5.228 11.075 -7.299 1.00 . B B . 1 PHE HE2 1 1 10 7394 2 2 1 PHE HZ H 5.875 9.193 -8.743 1.00 . B B . 1 PHE HZ 1 1 10 7395 2 2 1 PHE N N 8.856 10.083 -3.880 1.00 . B B . 1 PHE N 1 1 10 7396 2 2 1 PHE O O 8.280 6.608 -3.365 1.00 . B B . 1 PHE O 1 1 10 7397 2 2 2 VAL C C 11.556 5.884 -1.715 1.00 . B B . 2 VAL C 1 1 10 7398 2 2 2 VAL CA C 11.012 6.351 -3.076 1.00 . B B . 2 VAL CA 1 1 10 7399 2 2 2 VAL CB C 12.184 6.594 -4.082 1.00 . B B . 2 VAL CB 1 1 10 7400 2 2 2 VAL CG1 C 11.599 6.916 -5.467 1.00 . B B . 2 VAL CG1 1 1 10 7401 2 2 2 VAL CG2 C 13.030 7.813 -3.660 1.00 . B B . 2 VAL CG2 1 1 10 7402 2 2 2 VAL H H 10.738 8.347 -2.792 1.00 . B B . 2 VAL H 1 1 10 7403 2 2 2 VAL HA H 10.363 5.605 -3.457 1.00 . B B . 2 VAL HA 1 1 10 7404 2 2 2 VAL HB H 12.802 5.702 -4.144 1.00 . B B . 2 VAL HB 1 1 10 7405 2 2 2 VAL HG11 H 10.989 6.096 -5.821 1.00 . B B . 2 VAL HG11 1 1 10 7406 2 2 2 VAL HG12 H 10.982 7.802 -5.426 1.00 . B B . 2 VAL HG12 1 1 10 7407 2 2 2 VAL HG13 H 12.392 7.087 -6.181 1.00 . B B . 2 VAL HG13 1 1 10 7408 2 2 2 VAL HG21 H 13.449 7.673 -2.673 1.00 . B B . 2 VAL HG21 1 1 10 7409 2 2 2 VAL HG22 H 13.845 7.954 -4.357 1.00 . B B . 2 VAL HG22 1 1 10 7410 2 2 2 VAL HG23 H 12.440 8.718 -3.657 1.00 . B B . 2 VAL HG23 1 1 10 7411 2 2 2 VAL N N 10.216 7.581 -2.986 1.00 . B B . 2 VAL N 1 1 10 7412 2 2 2 VAL O O 11.560 6.587 -0.727 1.00 . B B . 2 VAL O 1 1 10 7413 2 2 3 ASN C C 11.776 2.430 -0.768 1.00 . B B . 3 ASN C 1 1 10 7414 2 2 3 ASN CA C 12.608 3.752 -0.772 1.00 . B B . 3 ASN CA 1 1 10 7415 2 2 3 ASN CB C 12.561 4.406 0.666 1.00 . B B . 3 ASN CB 1 1 10 7416 2 2 3 ASN CG C 11.146 4.451 1.214 1.00 . B B . 3 ASN CG 1 1 10 7417 2 2 3 ASN H H 11.878 4.363 -2.731 1.00 . B B . 3 ASN H 1 1 10 7418 2 2 3 ASN HA H 13.603 3.489 -1.072 1.00 . B B . 3 ASN HA 1 1 10 7419 2 2 3 ASN HB2 H 13.143 3.815 1.355 1.00 . B B . 3 ASN HB2 1 1 10 7420 2 2 3 ASN HB3 H 12.960 5.408 0.658 1.00 . B B . 3 ASN HB3 1 1 10 7421 2 2 3 ASN HD21 H 10.976 6.397 1.128 1.00 . B B . 3 ASN HD21 1 1 10 7422 2 2 3 ASN HD22 H 9.640 5.540 1.767 1.00 . B B . 3 ASN HD22 1 1 10 7423 2 2 3 ASN N N 11.991 4.671 -1.814 1.00 . B B . 3 ASN N 1 1 10 7424 2 2 3 ASN ND2 N 10.535 5.563 1.385 1.00 . B B . 3 ASN ND2 1 1 10 7425 2 2 3 ASN O O 12.230 1.328 -0.553 1.00 . B B . 3 ASN O 1 1 10 7426 2 2 3 ASN OD1 O 10.551 3.441 1.499 1.00 . B B . 3 ASN OD1 1 1 10 7427 2 2 4 GLN C C 9.450 0.347 -0.250 1.00 . B B . 4 GLN C 1 1 10 7428 2 2 4 GLN CA C 9.428 1.649 -1.118 1.00 . B B . 4 GLN CA 1 1 10 7429 2 2 4 GLN CB C 9.340 1.288 -2.581 1.00 . B B . 4 GLN CB 1 1 10 7430 2 2 4 GLN CD C 10.175 2.897 -4.408 1.00 . B B . 4 GLN CD 1 1 10 7431 2 2 4 GLN CG C 9.032 2.514 -3.490 1.00 . B B . 4 GLN CG 1 1 10 7432 2 2 4 GLN H H 10.349 3.606 -1.194 1.00 . B B . 4 GLN H 1 1 10 7433 2 2 4 GLN HA H 8.504 2.133 -0.868 1.00 . B B . 4 GLN HA 1 1 10 7434 2 2 4 GLN HB2 H 10.296 0.852 -2.818 1.00 . B B . 4 GLN HB2 1 1 10 7435 2 2 4 GLN HB3 H 8.565 0.544 -2.673 1.00 . B B . 4 GLN HB3 1 1 10 7436 2 2 4 GLN HE21 H 9.129 2.657 -6.041 1.00 . B B . 4 GLN HE21 1 1 10 7437 2 2 4 GLN HE22 H 10.767 3.092 -6.249 1.00 . B B . 4 GLN HE22 1 1 10 7438 2 2 4 GLN HG2 H 8.184 2.290 -4.117 1.00 . B B . 4 GLN HG2 1 1 10 7439 2 2 4 GLN HG3 H 8.815 3.387 -2.901 1.00 . B B . 4 GLN HG3 1 1 10 7440 2 2 4 GLN N N 10.533 2.664 -1.036 1.00 . B B . 4 GLN N 1 1 10 7441 2 2 4 GLN NE2 N 10.010 2.880 -5.675 1.00 . B B . 4 GLN NE2 1 1 10 7442 2 2 4 GLN O O 9.052 -0.702 -0.715 1.00 . B B . 4 GLN O 1 1 10 7443 2 2 4 GLN OE1 O 11.255 3.230 -3.989 1.00 . B B . 4 GLN OE1 1 1 10 7444 2 2 5 HIS C C 9.156 -0.551 3.256 1.00 . B B . 5 HIS C 1 1 10 7445 2 2 5 HIS CA C 9.974 -0.696 1.922 1.00 . B B . 5 HIS CA 1 1 10 7446 2 2 5 HIS CB C 11.490 -0.955 2.202 1.00 . B B . 5 HIS CB 1 1 10 7447 2 2 5 HIS CD2 C 12.209 -3.211 1.025 1.00 . B B . 5 HIS CD2 1 1 10 7448 2 2 5 HIS CE1 C 12.675 -2.444 -0.840 1.00 . B B . 5 HIS CE1 1 1 10 7449 2 2 5 HIS CG C 11.994 -1.851 1.073 1.00 . B B . 5 HIS CG 1 1 10 7450 2 2 5 HIS H H 10.224 1.373 1.188 1.00 . B B . 5 HIS H 1 1 10 7451 2 2 5 HIS HA H 9.635 -1.592 1.413 1.00 . B B . 5 HIS HA 1 1 10 7452 2 2 5 HIS HB2 H 12.051 -0.033 2.190 1.00 . B B . 5 HIS HB2 1 1 10 7453 2 2 5 HIS HB3 H 11.643 -1.457 3.145 1.00 . B B . 5 HIS HB3 1 1 10 7454 2 2 5 HIS HD1 H 12.248 -0.492 -0.355 1.00 . B B . 5 HIS HD1 1 1 10 7455 2 2 5 HIS HD2 H 12.053 -3.889 1.849 1.00 . B B . 5 HIS HD2 1 1 10 7456 2 2 5 HIS HE1 H 12.982 -2.382 -1.876 1.00 . B B . 5 HIS HE1 1 1 10 7457 2 2 5 HIS N N 9.907 0.477 0.960 1.00 . B B . 5 HIS N 1 1 10 7458 2 2 5 HIS ND1 N 12.300 -1.442 -0.103 1.00 . B B . 5 HIS ND1 1 1 10 7459 2 2 5 HIS NE2 N 12.632 -3.568 -0.171 1.00 . B B . 5 HIS NE2 1 1 10 7460 2 2 5 HIS O O 9.667 -0.469 4.356 1.00 . B B . 5 HIS O 1 1 10 7461 2 2 6 LEU C C 6.030 -1.743 4.251 1.00 . B B . 6 LEU C 1 1 10 7462 2 2 6 LEU CA C 6.847 -0.409 4.184 1.00 . B B . 6 LEU CA 1 1 10 7463 2 2 6 LEU CB C 5.969 0.854 3.828 1.00 . B B . 6 LEU CB 1 1 10 7464 2 2 6 LEU CD1 C 4.398 1.865 2.162 1.00 . B B . 6 LEU CD1 1 1 10 7465 2 2 6 LEU CD2 C 6.717 1.694 1.554 1.00 . B B . 6 LEU CD2 1 1 10 7466 2 2 6 LEU CG C 5.606 0.944 2.316 1.00 . B B . 6 LEU CG 1 1 10 7467 2 2 6 LEU H H 7.561 -0.630 2.163 1.00 . B B . 6 LEU H 1 1 10 7468 2 2 6 LEU HA H 7.347 -0.233 5.126 1.00 . B B . 6 LEU HA 1 1 10 7469 2 2 6 LEU HB2 H 5.063 0.829 4.413 1.00 . B B . 6 LEU HB2 1 1 10 7470 2 2 6 LEU HB3 H 6.524 1.739 4.107 1.00 . B B . 6 LEU HB3 1 1 10 7471 2 2 6 LEU HD11 H 4.616 2.847 2.553 1.00 . B B . 6 LEU HD11 1 1 10 7472 2 2 6 LEU HD12 H 4.122 1.952 1.121 1.00 . B B . 6 LEU HD12 1 1 10 7473 2 2 6 LEU HD13 H 3.557 1.467 2.699 1.00 . B B . 6 LEU HD13 1 1 10 7474 2 2 6 LEU HD21 H 7.667 1.199 1.645 1.00 . B B . 6 LEU HD21 1 1 10 7475 2 2 6 LEU HD22 H 6.463 1.747 0.507 1.00 . B B . 6 LEU HD22 1 1 10 7476 2 2 6 LEU HD23 H 6.830 2.696 1.940 1.00 . B B . 6 LEU HD23 1 1 10 7477 2 2 6 LEU HG H 5.423 -0.041 1.897 1.00 . B B . 6 LEU HG 1 1 10 7478 2 2 6 LEU N N 7.868 -0.539 3.087 1.00 . B B . 6 LEU N 1 1 10 7479 2 2 6 LEU O O 5.498 -2.179 3.252 1.00 . B B . 6 LEU O 1 1 10 7480 2 2 7 CYS C C 3.758 -3.835 6.171 1.00 . B B . 7 CYS C 1 1 10 7481 2 2 7 CYS CA C 5.146 -3.678 5.480 1.00 . B B . 7 CYS CA 1 1 10 7482 2 2 7 CYS CB C 6.167 -4.674 6.079 1.00 . B B . 7 CYS CB 1 1 10 7483 2 2 7 CYS H H 6.343 -1.966 6.185 1.00 . B B . 7 CYS H 1 1 10 7484 2 2 7 CYS HA H 4.947 -4.016 4.476 1.00 . B B . 7 CYS HA 1 1 10 7485 2 2 7 CYS HB2 H 7.155 -4.405 5.725 1.00 . B B . 7 CYS HB2 1 1 10 7486 2 2 7 CYS HB3 H 6.180 -4.589 7.155 1.00 . B B . 7 CYS HB3 1 1 10 7487 2 2 7 CYS HG H 5.335 -6.809 6.314 1.00 . B B . 7 CYS HG 1 1 10 7488 2 2 7 CYS N N 5.918 -2.366 5.403 1.00 . B B . 7 CYS N 1 1 10 7489 2 2 7 CYS O O 2.802 -4.163 5.502 1.00 . B B . 7 CYS O 1 1 10 7490 2 2 7 CYS SG S 5.930 -6.421 5.669 1.00 . B B . 7 CYS SG 1 1 10 7491 2 2 8 GLY C C 1.698 -2.422 8.426 1.00 . B B . 8 GLY C 1 1 10 7492 2 2 8 GLY CA C 2.247 -3.786 8.097 1.00 . B B . 8 GLY CA 1 1 10 7493 2 2 8 GLY H H 4.402 -3.367 7.986 1.00 . B B . 8 GLY H 1 1 10 7494 2 2 8 GLY HA2 H 1.551 -4.267 7.431 1.00 . B B . 8 GLY HA2 1 1 10 7495 2 2 8 GLY HA3 H 2.336 -4.341 9.020 1.00 . B B . 8 GLY HA3 1 1 10 7496 2 2 8 GLY N N 3.621 -3.624 7.454 1.00 . B B . 8 GLY N 1 1 10 7497 2 2 8 GLY O O 1.123 -1.755 7.591 1.00 . B B . 8 GLY O 1 1 10 7498 2 2 9 ASP C C 1.979 0.322 9.112 1.00 . B B . 9 ASP C 1 1 10 7499 2 2 9 ASP CA C 1.449 -0.721 10.157 1.00 . B B . 9 ASP CA 1 1 10 7500 2 2 9 ASP CB C 2.088 -0.726 11.594 1.00 . B B . 9 ASP CB 1 1 10 7501 2 2 9 ASP CG C 3.534 -1.205 11.559 1.00 . B B . 9 ASP CG 1 1 10 7502 2 2 9 ASP H H 2.362 -2.641 10.266 1.00 . B B . 9 ASP H 1 1 10 7503 2 2 9 ASP HA H 0.364 -0.675 10.159 1.00 . B B . 9 ASP HA 1 1 10 7504 2 2 9 ASP HB2 H 2.090 0.271 12.008 1.00 . B B . 9 ASP HB2 1 1 10 7505 2 2 9 ASP HB3 H 1.548 -1.376 12.261 1.00 . B B . 9 ASP HB3 1 1 10 7506 2 2 9 ASP N N 1.896 -2.045 9.640 1.00 . B B . 9 ASP N 1 1 10 7507 2 2 9 ASP O O 1.278 0.990 8.384 1.00 . B B . 9 ASP O 1 1 10 7508 2 2 9 ASP OD1 O 3.682 -2.408 11.626 1.00 . B B . 9 ASP OD1 1 1 10 7509 2 2 9 ASP OD2 O 4.398 -0.365 11.440 1.00 . B B . 9 ASP OD2 1 1 10 7510 2 2 10 HIS C C 3.489 1.352 6.707 1.00 . B B . 10 HIS C 1 1 10 7511 2 2 10 HIS CA C 4.051 1.278 8.155 1.00 . B B . 10 HIS CA 1 1 10 7512 2 2 10 HIS CB C 5.448 0.708 8.223 1.00 . B B . 10 HIS CB 1 1 10 7513 2 2 10 HIS CD2 C 7.773 1.914 8.117 1.00 . B B . 10 HIS CD2 1 1 10 7514 2 2 10 HIS CE1 C 7.494 3.028 6.399 1.00 . B B . 10 HIS CE1 1 1 10 7515 2 2 10 HIS CG C 6.505 1.642 7.653 1.00 . B B . 10 HIS CG 1 1 10 7516 2 2 10 HIS H H 3.721 -0.220 9.685 1.00 . B B . 10 HIS H 1 1 10 7517 2 2 10 HIS HA H 3.995 2.283 8.555 1.00 . B B . 10 HIS HA 1 1 10 7518 2 2 10 HIS HB2 H 5.668 0.522 9.267 1.00 . B B . 10 HIS HB2 1 1 10 7519 2 2 10 HIS HB3 H 5.461 -0.226 7.689 1.00 . B B . 10 HIS HB3 1 1 10 7520 2 2 10 HIS HD1 H 5.592 2.406 6.023 1.00 . B B . 10 HIS HD1 1 1 10 7521 2 2 10 HIS HD2 H 8.208 1.480 9.003 1.00 . B B . 10 HIS HD2 1 1 10 7522 2 2 10 HIS HE1 H 7.675 3.711 5.578 1.00 . B B . 10 HIS HE1 1 1 10 7523 2 2 10 HIS N N 3.266 0.383 9.062 1.00 . B B . 10 HIS N 1 1 10 7524 2 2 10 HIS ND1 N 6.395 2.363 6.591 1.00 . B B . 10 HIS ND1 1 1 10 7525 2 2 10 HIS NE2 N 8.377 2.776 7.327 1.00 . B B . 10 HIS NE2 1 1 10 7526 2 2 10 HIS O O 3.783 2.253 5.943 1.00 . B B . 10 HIS O 1 1 10 7527 2 2 11 LEU C C 0.652 0.871 5.155 1.00 . B B . 11 LEU C 1 1 10 7528 2 2 11 LEU CA C 2.069 0.292 5.021 1.00 . B B . 11 LEU CA 1 1 10 7529 2 2 11 LEU CB C 2.113 -1.200 4.624 1.00 . B B . 11 LEU CB 1 1 10 7530 2 2 11 LEU CD1 C 1.832 -0.540 2.230 1.00 . B B . 11 LEU CD1 1 1 10 7531 2 2 11 LEU CD2 C 1.714 -2.876 2.905 1.00 . B B . 11 LEU CD2 1 1 10 7532 2 2 11 LEU CG C 1.347 -1.472 3.328 1.00 . B B . 11 LEU CG 1 1 10 7533 2 2 11 LEU H H 2.513 -0.313 7.037 1.00 . B B . 11 LEU H 1 1 10 7534 2 2 11 LEU HA H 2.604 0.891 4.308 1.00 . B B . 11 LEU HA 1 1 10 7535 2 2 11 LEU HB2 H 3.145 -1.487 4.481 1.00 . B B . 11 LEU HB2 1 1 10 7536 2 2 11 LEU HB3 H 1.701 -1.823 5.403 1.00 . B B . 11 LEU HB3 1 1 10 7537 2 2 11 LEU HD11 H 2.898 -0.644 2.083 1.00 . B B . 11 LEU HD11 1 1 10 7538 2 2 11 LEU HD12 H 1.338 -0.764 1.298 1.00 . B B . 11 LEU HD12 1 1 10 7539 2 2 11 LEU HD13 H 1.615 0.486 2.487 1.00 . B B . 11 LEU HD13 1 1 10 7540 2 2 11 LEU HD21 H 2.783 -2.944 2.759 1.00 . B B . 11 LEU HD21 1 1 10 7541 2 2 11 LEU HD22 H 1.422 -3.580 3.669 1.00 . B B . 11 LEU HD22 1 1 10 7542 2 2 11 LEU HD23 H 1.226 -3.137 1.985 1.00 . B B . 11 LEU HD23 1 1 10 7543 2 2 11 LEU HG H 0.279 -1.378 3.485 1.00 . B B . 11 LEU HG 1 1 10 7544 2 2 11 LEU N N 2.700 0.377 6.368 1.00 . B B . 11 LEU N 1 1 10 7545 2 2 11 LEU O O 0.291 1.811 4.475 1.00 . B B . 11 LEU O 1 1 10 7546 2 2 12 VAL C C -1.487 2.434 6.392 1.00 . B B . 12 VAL C 1 1 10 7547 2 2 12 VAL CA C -1.540 0.898 6.173 1.00 . B B . 12 VAL CA 1 1 10 7548 2 2 12 VAL CB C -2.241 0.200 7.340 1.00 . B B . 12 VAL CB 1 1 10 7549 2 2 12 VAL CG1 C -1.477 0.381 8.629 1.00 . B B . 12 VAL CG1 1 1 10 7550 2 2 12 VAL CG2 C -3.599 0.867 7.511 1.00 . B B . 12 VAL CG2 1 1 10 7551 2 2 12 VAL H H 0.184 -0.414 6.567 1.00 . B B . 12 VAL H 1 1 10 7552 2 2 12 VAL HA H -2.105 0.725 5.278 1.00 . B B . 12 VAL HA 1 1 10 7553 2 2 12 VAL HB H -2.300 -0.857 7.089 1.00 . B B . 12 VAL HB 1 1 10 7554 2 2 12 VAL HG11 H -1.293 1.423 8.871 1.00 . B B . 12 VAL HG11 1 1 10 7555 2 2 12 VAL HG12 H -1.981 -0.069 9.467 1.00 . B B . 12 VAL HG12 1 1 10 7556 2 2 12 VAL HG13 H -0.536 -0.114 8.494 1.00 . B B . 12 VAL HG13 1 1 10 7557 2 2 12 VAL HG21 H -4.177 0.802 6.602 1.00 . B B . 12 VAL HG21 1 1 10 7558 2 2 12 VAL HG22 H -4.142 0.421 8.326 1.00 . B B . 12 VAL HG22 1 1 10 7559 2 2 12 VAL HG23 H -3.448 1.913 7.742 1.00 . B B . 12 VAL HG23 1 1 10 7560 2 2 12 VAL N N -0.151 0.333 6.027 1.00 . B B . 12 VAL N 1 1 10 7561 2 2 12 VAL O O -2.307 3.152 5.840 1.00 . B B . 12 VAL O 1 1 10 7562 2 2 13 GLU C C -0.455 5.197 6.156 1.00 . B B . 13 GLU C 1 1 10 7563 2 2 13 GLU CA C -0.363 4.353 7.463 1.00 . B B . 13 GLU CA 1 1 10 7564 2 2 13 GLU CB C 1.020 4.558 8.155 1.00 . B B . 13 GLU CB 1 1 10 7565 2 2 13 GLU CD C -0.027 4.265 10.523 1.00 . B B . 13 GLU CD 1 1 10 7566 2 2 13 GLU CG C 1.077 3.850 9.571 1.00 . B B . 13 GLU CG 1 1 10 7567 2 2 13 GLU H H 0.079 2.245 7.601 1.00 . B B . 13 GLU H 1 1 10 7568 2 2 13 GLU HA H -1.137 4.685 8.134 1.00 . B B . 13 GLU HA 1 1 10 7569 2 2 13 GLU HB2 H 1.810 4.178 7.523 1.00 . B B . 13 GLU HB2 1 1 10 7570 2 2 13 GLU HB3 H 1.176 5.620 8.304 1.00 . B B . 13 GLU HB3 1 1 10 7571 2 2 13 GLU HG2 H 1.016 2.785 9.498 1.00 . B B . 13 GLU HG2 1 1 10 7572 2 2 13 GLU HG3 H 2.001 4.091 10.070 1.00 . B B . 13 GLU HG3 1 1 10 7573 2 2 13 GLU N N -0.539 2.883 7.177 1.00 . B B . 13 GLU N 1 1 10 7574 2 2 13 GLU O O -0.723 6.385 6.148 1.00 . B B . 13 GLU O 1 1 10 7575 2 2 13 GLU OE1 O -0.016 5.424 10.886 1.00 . B B . 13 GLU OE1 1 1 10 7576 2 2 13 GLU OE2 O -0.827 3.399 10.830 1.00 . B B . 13 GLU OE2 1 1 10 7577 2 2 14 ALA C C -1.688 5.011 3.176 1.00 . B B . 14 ALA C 1 1 10 7578 2 2 14 ALA CA C -0.277 5.173 3.711 1.00 . B B . 14 ALA CA 1 1 10 7579 2 2 14 ALA CB C 0.814 4.447 2.857 1.00 . B B . 14 ALA CB 1 1 10 7580 2 2 14 ALA H H -0.049 3.571 5.079 1.00 . B B . 14 ALA H 1 1 10 7581 2 2 14 ALA HA H -0.168 6.227 3.845 1.00 . B B . 14 ALA HA 1 1 10 7582 2 2 14 ALA HB1 H 1.782 4.538 3.330 1.00 . B B . 14 ALA HB1 1 1 10 7583 2 2 14 ALA HB2 H 0.593 3.390 2.781 1.00 . B B . 14 ALA HB2 1 1 10 7584 2 2 14 ALA HB3 H 0.872 4.850 1.858 1.00 . B B . 14 ALA HB3 1 1 10 7585 2 2 14 ALA N N -0.236 4.532 5.047 1.00 . B B . 14 ALA N 1 1 10 7586 2 2 14 ALA O O -2.317 5.936 2.698 1.00 . B B . 14 ALA O 1 1 10 7587 2 2 15 LEU C C -4.574 4.480 3.384 1.00 . B B . 15 LEU C 1 1 10 7588 2 2 15 LEU CA C -3.522 3.511 2.796 1.00 . B B . 15 LEU CA 1 1 10 7589 2 2 15 LEU CB C -3.797 2.031 3.142 1.00 . B B . 15 LEU CB 1 1 10 7590 2 2 15 LEU CD1 C -1.632 0.818 2.570 1.00 . B B . 15 LEU CD1 1 1 10 7591 2 2 15 LEU CD2 C -3.800 -0.129 1.901 1.00 . B B . 15 LEU CD2 1 1 10 7592 2 2 15 LEU CG C -3.027 1.165 2.128 1.00 . B B . 15 LEU CG 1 1 10 7593 2 2 15 LEU H H -1.577 3.123 3.670 1.00 . B B . 15 LEU H 1 1 10 7594 2 2 15 LEU HA H -3.534 3.670 1.732 1.00 . B B . 15 LEU HA 1 1 10 7595 2 2 15 LEU HB2 H -3.504 1.816 4.157 1.00 . B B . 15 LEU HB2 1 1 10 7596 2 2 15 LEU HB3 H -4.855 1.847 3.040 1.00 . B B . 15 LEU HB3 1 1 10 7597 2 2 15 LEU HD11 H -1.054 1.711 2.718 1.00 . B B . 15 LEU HD11 1 1 10 7598 2 2 15 LEU HD12 H -1.622 0.221 3.463 1.00 . B B . 15 LEU HD12 1 1 10 7599 2 2 15 LEU HD13 H -1.146 0.258 1.791 1.00 . B B . 15 LEU HD13 1 1 10 7600 2 2 15 LEU HD21 H -4.794 0.093 1.544 1.00 . B B . 15 LEU HD21 1 1 10 7601 2 2 15 LEU HD22 H -3.297 -0.737 1.167 1.00 . B B . 15 LEU HD22 1 1 10 7602 2 2 15 LEU HD23 H -3.879 -0.683 2.825 1.00 . B B . 15 LEU HD23 1 1 10 7603 2 2 15 LEU HG H -2.870 1.744 1.232 1.00 . B B . 15 LEU HG 1 1 10 7604 2 2 15 LEU N N -2.153 3.807 3.274 1.00 . B B . 15 LEU N 1 1 10 7605 2 2 15 LEU O O -5.422 4.926 2.643 1.00 . B B . 15 LEU O 1 1 10 7606 2 2 16 TYR C C -5.831 6.963 4.378 1.00 . B B . 16 TYR C 1 1 10 7607 2 2 16 TYR CA C -5.518 5.739 5.284 1.00 . B B . 16 TYR CA 1 1 10 7608 2 2 16 TYR CB C -4.996 6.316 6.617 1.00 . B B . 16 TYR CB 1 1 10 7609 2 2 16 TYR CD1 C -5.456 4.176 7.958 1.00 . B B . 16 TYR CD1 1 1 10 7610 2 2 16 TYR CD2 C -3.585 5.533 8.492 1.00 . B B . 16 TYR CD2 1 1 10 7611 2 2 16 TYR CE1 C -5.103 3.313 8.988 1.00 . B B . 16 TYR CE1 1 1 10 7612 2 2 16 TYR CE2 C -3.250 4.673 9.506 1.00 . B B . 16 TYR CE2 1 1 10 7613 2 2 16 TYR CG C -4.687 5.297 7.709 1.00 . B B . 16 TYR CG 1 1 10 7614 2 2 16 TYR CZ C -3.998 3.561 9.764 1.00 . B B . 16 TYR CZ 1 1 10 7615 2 2 16 TYR H H -3.784 4.367 5.168 1.00 . B B . 16 TYR H 1 1 10 7616 2 2 16 TYR HA H -6.456 5.226 5.435 1.00 . B B . 16 TYR HA 1 1 10 7617 2 2 16 TYR HB2 H -4.091 6.874 6.417 1.00 . B B . 16 TYR HB2 1 1 10 7618 2 2 16 TYR HB3 H -5.725 7.007 7.018 1.00 . B B . 16 TYR HB3 1 1 10 7619 2 2 16 TYR HD1 H -6.329 3.971 7.357 1.00 . B B . 16 TYR HD1 1 1 10 7620 2 2 16 TYR HD2 H -2.961 6.400 8.320 1.00 . B B . 16 TYR HD2 1 1 10 7621 2 2 16 TYR HE1 H -5.684 2.432 9.206 1.00 . B B . 16 TYR HE1 1 1 10 7622 2 2 16 TYR HE2 H -2.388 4.887 10.116 1.00 . B B . 16 TYR HE2 1 1 10 7623 2 2 16 TYR HH H -2.673 2.871 10.870 1.00 . B B . 16 TYR HH 1 1 10 7624 2 2 16 TYR N N -4.512 4.784 4.656 1.00 . B B . 16 TYR N 1 1 10 7625 2 2 16 TYR O O -6.928 7.480 4.321 1.00 . B B . 16 TYR O 1 1 10 7626 2 2 16 TYR OH O -3.632 2.704 10.773 1.00 . B B . 16 TYR OH 1 1 10 7627 2 2 17 LEU C C -5.022 8.000 1.324 1.00 . B B . 17 LEU C 1 1 10 7628 2 2 17 LEU CA C -4.804 8.513 2.764 1.00 . B B . 17 LEU CA 1 1 10 7629 2 2 17 LEU CB C -3.438 9.198 3.030 1.00 . B B . 17 LEU CB 1 1 10 7630 2 2 17 LEU CD1 C -1.973 11.146 2.836 1.00 . B B . 17 LEU CD1 1 1 10 7631 2 2 17 LEU CD2 C -2.724 10.065 0.781 1.00 . B B . 17 LEU CD2 1 1 10 7632 2 2 17 LEU CG C -3.176 10.456 2.193 1.00 . B B . 17 LEU CG 1 1 10 7633 2 2 17 LEU H H -3.961 6.852 3.833 1.00 . B B . 17 LEU H 1 1 10 7634 2 2 17 LEU HA H -5.627 9.176 3.002 1.00 . B B . 17 LEU HA 1 1 10 7635 2 2 17 LEU HB2 H -3.406 9.459 4.079 1.00 . B B . 17 LEU HB2 1 1 10 7636 2 2 17 LEU HB3 H -2.643 8.484 2.856 1.00 . B B . 17 LEU HB3 1 1 10 7637 2 2 17 LEU HD11 H -1.117 10.486 2.839 1.00 . B B . 17 LEU HD11 1 1 10 7638 2 2 17 LEU HD12 H -1.718 12.045 2.298 1.00 . B B . 17 LEU HD12 1 1 10 7639 2 2 17 LEU HD13 H -2.199 11.411 3.858 1.00 . B B . 17 LEU HD13 1 1 10 7640 2 2 17 LEU HD21 H -1.835 9.451 0.825 1.00 . B B . 17 LEU HD21 1 1 10 7641 2 2 17 LEU HD22 H -3.492 9.523 0.254 1.00 . B B . 17 LEU HD22 1 1 10 7642 2 2 17 LEU HD23 H -2.500 10.952 0.210 1.00 . B B . 17 LEU HD23 1 1 10 7643 2 2 17 LEU HG H -4.045 11.106 2.169 1.00 . B B . 17 LEU HG 1 1 10 7644 2 2 17 LEU N N -4.790 7.356 3.706 1.00 . B B . 17 LEU N 1 1 10 7645 2 2 17 LEU O O -5.968 8.377 0.660 1.00 . B B . 17 LEU O 1 1 10 7646 2 2 18 VAL C C -5.770 6.098 -0.856 1.00 . B B . 18 VAL C 1 1 10 7647 2 2 18 VAL CA C -4.327 6.621 -0.544 1.00 . B B . 18 VAL CA 1 1 10 7648 2 2 18 VAL CB C -3.274 5.500 -0.757 1.00 . B B . 18 VAL CB 1 1 10 7649 2 2 18 VAL CG1 C -3.367 5.018 -2.209 1.00 . B B . 18 VAL CG1 1 1 10 7650 2 2 18 VAL CG2 C -1.863 6.085 -0.589 1.00 . B B . 18 VAL CG2 1 1 10 7651 2 2 18 VAL H H -3.394 6.868 1.425 1.00 . B B . 18 VAL H 1 1 10 7652 2 2 18 VAL HA H -4.141 7.425 -1.241 1.00 . B B . 18 VAL HA 1 1 10 7653 2 2 18 VAL HB H -3.447 4.689 -0.066 1.00 . B B . 18 VAL HB 1 1 10 7654 2 2 18 VAL HG11 H -4.359 4.643 -2.415 1.00 . B B . 18 VAL HG11 1 1 10 7655 2 2 18 VAL HG12 H -3.175 5.831 -2.900 1.00 . B B . 18 VAL HG12 1 1 10 7656 2 2 18 VAL HG13 H -2.651 4.238 -2.404 1.00 . B B . 18 VAL HG13 1 1 10 7657 2 2 18 VAL HG21 H -1.700 6.875 -1.310 1.00 . B B . 18 VAL HG21 1 1 10 7658 2 2 18 VAL HG22 H -1.733 6.498 0.400 1.00 . B B . 18 VAL HG22 1 1 10 7659 2 2 18 VAL HG23 H -1.118 5.320 -0.740 1.00 . B B . 18 VAL HG23 1 1 10 7660 2 2 18 VAL N N -4.149 7.150 0.855 1.00 . B B . 18 VAL N 1 1 10 7661 2 2 18 VAL O O -6.254 6.264 -1.956 1.00 . B B . 18 VAL O 1 1 10 7662 2 2 19 CYS C C -8.923 6.084 -0.160 1.00 . B B . 19 CYS C 1 1 10 7663 2 2 19 CYS CA C -7.834 4.974 -0.196 1.00 . B B . 19 CYS CA 1 1 10 7664 2 2 19 CYS CB C -8.229 3.893 0.856 1.00 . B B . 19 CYS CB 1 1 10 7665 2 2 19 CYS H H -6.060 5.345 0.969 1.00 . B B . 19 CYS H 1 1 10 7666 2 2 19 CYS HA H -7.855 4.541 -1.186 1.00 . B B . 19 CYS HA 1 1 10 7667 2 2 19 CYS HB2 H -8.531 4.400 1.752 1.00 . B B . 19 CYS HB2 1 1 10 7668 2 2 19 CYS HB3 H -9.078 3.397 0.420 1.00 . B B . 19 CYS HB3 1 1 10 7669 2 2 19 CYS HG H -6.816 2.791 2.283 1.00 . B B . 19 CYS HG 1 1 10 7670 2 2 19 CYS N N -6.448 5.485 0.082 1.00 . B B . 19 CYS N 1 1 10 7671 2 2 19 CYS O O -10.086 5.795 0.056 1.00 . B B . 19 CYS O 1 1 10 7672 2 2 19 CYS SG S -7.169 2.546 1.423 1.00 . B B . 19 CYS SG 1 1 10 7673 2 2 20 GLY C C -10.316 8.597 -1.689 1.00 . B B . 20 GLY C 1 1 10 7674 2 2 20 GLY CA C -9.587 8.446 -0.356 1.00 . B B . 20 GLY CA 1 1 10 7675 2 2 20 GLY H H -7.610 7.512 -0.541 1.00 . B B . 20 GLY H 1 1 10 7676 2 2 20 GLY HA2 H -10.332 8.248 0.399 1.00 . B B . 20 GLY HA2 1 1 10 7677 2 2 20 GLY HA3 H -9.091 9.378 -0.152 1.00 . B B . 20 GLY HA3 1 1 10 7678 2 2 20 GLY N N -8.561 7.322 -0.378 1.00 . B B . 20 GLY N 1 1 10 7679 2 2 20 GLY O O -10.507 9.662 -2.233 1.00 . B B . 20 GLY O 1 1 10 7680 2 2 21 GLU C C -12.609 6.223 -3.034 1.00 . B B . 21 GLU C 1 1 10 7681 2 2 21 GLU CA C -11.429 7.159 -3.391 1.00 . B B . 21 GLU CA 1 1 10 7682 2 2 21 GLU CB C -10.383 6.527 -4.301 1.00 . B B . 21 GLU CB 1 1 10 7683 2 2 21 GLU CD C -10.538 4.429 -5.689 1.00 . B B . 21 GLU CD 1 1 10 7684 2 2 21 GLU CG C -11.029 5.855 -5.552 1.00 . B B . 21 GLU CG 1 1 10 7685 2 2 21 GLU H H -10.457 6.688 -1.555 1.00 . B B . 21 GLU H 1 1 10 7686 2 2 21 GLU HA H -11.830 8.070 -3.814 1.00 . B B . 21 GLU HA 1 1 10 7687 2 2 21 GLU HB2 H -9.682 7.280 -4.620 1.00 . B B . 21 GLU HB2 1 1 10 7688 2 2 21 GLU HB3 H -9.823 5.801 -3.734 1.00 . B B . 21 GLU HB3 1 1 10 7689 2 2 21 GLU HG2 H -12.105 5.832 -5.511 1.00 . B B . 21 GLU HG2 1 1 10 7690 2 2 21 GLU HG3 H -10.725 6.368 -6.448 1.00 . B B . 21 GLU HG3 1 1 10 7691 2 2 21 GLU N N -10.690 7.441 -2.125 1.00 . B B . 21 GLU N 1 1 10 7692 2 2 21 GLU O O -13.773 6.514 -3.228 1.00 . B B . 21 GLU O 1 1 10 7693 2 2 21 GLU OE1 O -9.355 4.290 -5.922 1.00 . B B . 21 GLU OE1 1 1 10 7694 2 2 21 GLU OE2 O -11.360 3.552 -5.534 1.00 . B B . 21 GLU OE2 1 1 10 7695 2 2 22 ARG C C -13.158 3.783 -0.545 1.00 . B B . 22 ARG C 1 1 10 7696 2 2 22 ARG CA C -13.125 4.029 -2.050 1.00 . B B . 22 ARG CA 1 1 10 7697 2 2 22 ARG CB C -12.720 2.730 -2.801 1.00 . B B . 22 ARG CB 1 1 10 7698 2 2 22 ARG CD C -12.686 0.795 -1.281 1.00 . B B . 22 ARG CD 1 1 10 7699 2 2 22 ARG CG C -13.546 1.532 -2.304 1.00 . B B . 22 ARG CG 1 1 10 7700 2 2 22 ARG CZ C -13.796 0.277 0.784 1.00 . B B . 22 ARG CZ 1 1 10 7701 2 2 22 ARG H H -11.272 4.982 -2.384 1.00 . B B . 22 ARG H 1 1 10 7702 2 2 22 ARG HA H -14.072 4.346 -2.339 1.00 . B B . 22 ARG HA 1 1 10 7703 2 2 22 ARG HB2 H -12.854 2.869 -3.858 1.00 . B B . 22 ARG HB2 1 1 10 7704 2 2 22 ARG HB3 H -11.673 2.518 -2.637 1.00 . B B . 22 ARG HB3 1 1 10 7705 2 2 22 ARG HD2 H -11.984 0.153 -1.808 1.00 . B B . 22 ARG HD2 1 1 10 7706 2 2 22 ARG HD3 H -12.076 1.473 -0.693 1.00 . B B . 22 ARG HD3 1 1 10 7707 2 2 22 ARG HE H -14.164 -0.742 -0.825 1.00 . B B . 22 ARG HE 1 1 10 7708 2 2 22 ARG HG2 H -14.487 1.856 -1.881 1.00 . B B . 22 ARG HG2 1 1 10 7709 2 2 22 ARG HG3 H -13.769 0.897 -3.149 1.00 . B B . 22 ARG HG3 1 1 10 7710 2 2 22 ARG HH11 H -14.561 1.984 0.347 1.00 . B B . 22 ARG HH11 1 1 10 7711 2 2 22 ARG HH12 H -14.383 1.656 2.032 1.00 . B B . 22 ARG HH12 1 1 10 7712 2 2 22 ARG HH21 H -13.075 -1.414 1.342 1.00 . B B . 22 ARG HH21 1 1 10 7713 2 2 22 ARG HH22 H -13.518 -0.325 2.609 1.00 . B B . 22 ARG HH22 1 1 10 7714 2 2 22 ARG N N -12.215 5.106 -2.491 1.00 . B B . 22 ARG N 1 1 10 7715 2 2 22 ARG NE N -13.649 -0.003 -0.440 1.00 . B B . 22 ARG NE 1 1 10 7716 2 2 22 ARG NH1 N -14.283 1.382 1.088 1.00 . B B . 22 ARG NH1 1 1 10 7717 2 2 22 ARG NH2 N -13.443 -0.545 1.647 1.00 . B B . 22 ARG NH2 1 1 10 7718 2 2 22 ARG O O -14.185 3.752 0.104 1.00 . B B . 22 ARG O 1 1 10 7719 2 2 23 GLY C C -11.400 1.883 1.863 1.00 . B B . 23 GLY C 1 1 10 7720 2 2 23 GLY CA C -11.769 3.317 1.427 1.00 . B B . 23 GLY CA 1 1 10 7721 2 2 23 GLY H H -11.268 3.637 -0.710 1.00 . B B . 23 GLY H 1 1 10 7722 2 2 23 GLY HA2 H -10.971 3.961 1.771 1.00 . B B . 23 GLY HA2 1 1 10 7723 2 2 23 GLY HA3 H -12.654 3.601 1.978 1.00 . B B . 23 GLY HA3 1 1 10 7724 2 2 23 GLY N N -11.985 3.585 -0.043 1.00 . B B . 23 GLY N 1 1 10 7725 2 2 23 GLY O O -12.058 1.368 2.746 1.00 . B B . 23 GLY O 1 1 10 7726 2 2 24 PHE C C -10.354 -1.485 0.942 1.00 . B B . 24 PHE C 1 1 10 7727 2 2 24 PHE CA C -9.856 -0.100 1.503 1.00 . B B . 24 PHE CA 1 1 10 7728 2 2 24 PHE CB C -9.769 -0.295 3.060 1.00 . B B . 24 PHE CB 1 1 10 7729 2 2 24 PHE CD1 C -8.949 1.972 3.913 1.00 . B B . 24 PHE CD1 1 1 10 7730 2 2 24 PHE CD2 C -7.502 0.094 4.008 1.00 . B B . 24 PHE CD2 1 1 10 7731 2 2 24 PHE CE1 C -7.968 2.758 4.483 1.00 . B B . 24 PHE CE1 1 1 10 7732 2 2 24 PHE CE2 C -6.519 0.870 4.575 1.00 . B B . 24 PHE CE2 1 1 10 7733 2 2 24 PHE CG C -8.718 0.632 3.674 1.00 . B B . 24 PHE CG 1 1 10 7734 2 2 24 PHE CZ C -6.750 2.206 4.816 1.00 . B B . 24 PHE CZ 1 1 10 7735 2 2 24 PHE H H -9.992 1.810 0.510 1.00 . B B . 24 PHE H 1 1 10 7736 2 2 24 PHE HA H -8.827 -0.048 1.176 1.00 . B B . 24 PHE HA 1 1 10 7737 2 2 24 PHE HB2 H -10.706 -0.118 3.559 1.00 . B B . 24 PHE HB2 1 1 10 7738 2 2 24 PHE HB3 H -9.487 -1.313 3.296 1.00 . B B . 24 PHE HB3 1 1 10 7739 2 2 24 PHE HD1 H -9.899 2.413 3.651 1.00 . B B . 24 PHE HD1 1 1 10 7740 2 2 24 PHE HD2 H -7.327 -0.951 3.806 1.00 . B B . 24 PHE HD2 1 1 10 7741 2 2 24 PHE HE1 H -8.158 3.808 4.665 1.00 . B B . 24 PHE HE1 1 1 10 7742 2 2 24 PHE HE2 H -5.567 0.430 4.834 1.00 . B B . 24 PHE HE2 1 1 10 7743 2 2 24 PHE HZ H -5.979 2.816 5.264 1.00 . B B . 24 PHE HZ 1 1 10 7744 2 2 24 PHE N N -10.412 1.298 1.231 1.00 . B B . 24 PHE N 1 1 10 7745 2 2 24 PHE O O -11.394 -1.991 1.315 1.00 . B B . 24 PHE O 1 1 10 7746 2 2 25 PHE C C -8.920 -4.527 -0.122 1.00 . B B . 25 PHE C 1 1 10 7747 2 2 25 PHE CA C -9.967 -3.435 -0.540 1.00 . B B . 25 PHE CA 1 1 10 7748 2 2 25 PHE CB C -10.030 -3.319 -2.095 1.00 . B B . 25 PHE CB 1 1 10 7749 2 2 25 PHE CD1 C -12.579 -3.143 -2.075 1.00 . B B . 25 PHE CD1 1 1 10 7750 2 2 25 PHE CD2 C -11.371 -1.730 -3.543 1.00 . B B . 25 PHE CD2 1 1 10 7751 2 2 25 PHE CE1 C -13.768 -2.607 -2.528 1.00 . B B . 25 PHE CE1 1 1 10 7752 2 2 25 PHE CE2 C -12.554 -1.189 -4.000 1.00 . B B . 25 PHE CE2 1 1 10 7753 2 2 25 PHE CG C -11.363 -2.711 -2.578 1.00 . B B . 25 PHE CG 1 1 10 7754 2 2 25 PHE CZ C -13.755 -1.628 -3.494 1.00 . B B . 25 PHE CZ 1 1 10 7755 2 2 25 PHE H H -8.777 -1.656 -0.247 1.00 . B B . 25 PHE H 1 1 10 7756 2 2 25 PHE HA H -10.914 -3.765 -0.137 1.00 . B B . 25 PHE HA 1 1 10 7757 2 2 25 PHE HB2 H -9.218 -2.704 -2.451 1.00 . B B . 25 PHE HB2 1 1 10 7758 2 2 25 PHE HB3 H -9.937 -4.294 -2.551 1.00 . B B . 25 PHE HB3 1 1 10 7759 2 2 25 PHE HD1 H -12.606 -3.913 -1.321 1.00 . B B . 25 PHE HD1 1 1 10 7760 2 2 25 PHE HD2 H -10.442 -1.377 -3.960 1.00 . B B . 25 PHE HD2 1 1 10 7761 2 2 25 PHE HE1 H -14.710 -2.961 -2.130 1.00 . B B . 25 PHE HE1 1 1 10 7762 2 2 25 PHE HE2 H -12.530 -0.418 -4.763 1.00 . B B . 25 PHE HE2 1 1 10 7763 2 2 25 PHE HZ H -14.682 -1.205 -3.858 1.00 . B B . 25 PHE HZ 1 1 10 7764 2 2 25 PHE N N -9.602 -2.085 0.055 1.00 . B B . 25 PHE N 1 1 10 7765 2 2 25 PHE O O -9.173 -5.716 -0.240 1.00 . B B . 25 PHE O 1 1 10 7766 2 2 26 TYR C C -6.556 -6.315 0.860 1.00 . B B . 26 TYR C 1 1 10 7767 2 2 26 TYR CA C -6.554 -4.753 0.835 1.00 . B B . 26 TYR CA 1 1 10 7768 2 2 26 TYR CB C -6.332 -4.131 2.240 1.00 . B B . 26 TYR CB 1 1 10 7769 2 2 26 TYR CD1 C -3.868 -4.649 2.620 1.00 . B B . 26 TYR CD1 1 1 10 7770 2 2 26 TYR CD2 C -5.460 -5.501 4.163 1.00 . B B . 26 TYR CD2 1 1 10 7771 2 2 26 TYR CE1 C -2.854 -5.242 3.357 1.00 . B B . 26 TYR CE1 1 1 10 7772 2 2 26 TYR CE2 C -4.439 -6.088 4.888 1.00 . B B . 26 TYR CE2 1 1 10 7773 2 2 26 TYR CG C -5.181 -4.777 3.022 1.00 . B B . 26 TYR CG 1 1 10 7774 2 2 26 TYR CZ C -3.141 -5.959 4.488 1.00 . B B . 26 TYR CZ 1 1 10 7775 2 2 26 TYR H H -7.760 -3.048 0.317 1.00 . B B . 26 TYR H 1 1 10 7776 2 2 26 TYR HA H -5.724 -4.462 0.208 1.00 . B B . 26 TYR HA 1 1 10 7777 2 2 26 TYR HB2 H -6.120 -3.077 2.147 1.00 . B B . 26 TYR HB2 1 1 10 7778 2 2 26 TYR HB3 H -7.240 -4.237 2.819 1.00 . B B . 26 TYR HB3 1 1 10 7779 2 2 26 TYR HD1 H -3.633 -4.084 1.730 1.00 . B B . 26 TYR HD1 1 1 10 7780 2 2 26 TYR HD2 H -6.484 -5.610 4.492 1.00 . B B . 26 TYR HD2 1 1 10 7781 2 2 26 TYR HE1 H -1.823 -5.151 3.059 1.00 . B B . 26 TYR HE1 1 1 10 7782 2 2 26 TYR HE2 H -4.644 -6.656 5.783 1.00 . B B . 26 TYR HE2 1 1 10 7783 2 2 26 TYR HH H -1.406 -5.940 5.272 1.00 . B B . 26 TYR HH 1 1 10 7784 2 2 26 TYR N N -7.790 -4.024 0.329 1.00 . B B . 26 TYR N 1 1 10 7785 2 2 26 TYR O O -7.491 -6.923 1.336 1.00 . B B . 26 TYR O 1 1 10 7786 2 2 26 TYR OH O -2.146 -6.551 5.225 1.00 . B B . 26 TYR OH 1 1 10 7787 2 2 27 THR C C -6.263 -9.282 1.371 1.00 . B B . 27 THR C 1 1 10 7788 2 2 27 THR CA C -5.449 -8.460 0.327 1.00 . B B . 27 THR CA 1 1 10 7789 2 2 27 THR CB C -3.927 -8.866 0.371 1.00 . B B . 27 THR CB 1 1 10 7790 2 2 27 THR CG2 C -3.202 -8.815 1.703 1.00 . B B . 27 THR CG2 1 1 10 7791 2 2 27 THR H H -4.782 -6.429 -0.026 1.00 . B B . 27 THR H 1 1 10 7792 2 2 27 THR HA H -5.783 -8.797 -0.638 1.00 . B B . 27 THR HA 1 1 10 7793 2 2 27 THR HB H -3.360 -8.400 -0.429 1.00 . B B . 27 THR HB 1 1 10 7794 2 2 27 THR HG1 H -3.267 -10.706 0.570 1.00 . B B . 27 THR HG1 1 1 10 7795 2 2 27 THR HG21 H -3.258 -7.823 2.125 1.00 . B B . 27 THR HG21 1 1 10 7796 2 2 27 THR HG22 H -3.594 -9.514 2.420 1.00 . B B . 27 THR HG22 1 1 10 7797 2 2 27 THR HG23 H -2.164 -9.067 1.546 1.00 . B B . 27 THR HG23 1 1 10 7798 2 2 27 THR N N -5.524 -6.942 0.350 1.00 . B B . 27 THR N 1 1 10 7799 2 2 27 THR O O -7.404 -9.581 1.068 1.00 . B B . 27 THR O 1 1 10 7800 2 2 27 THR OG1 O -4.030 -10.261 0.150 1.00 . B B . 27 THR OG1 1 1 10 7801 2 2 28 PRO C C -5.549 -12.109 1.679 1.00 . B B . 28 PRO C 1 1 10 7802 2 2 28 PRO CA C -5.687 -11.112 2.857 1.00 . B B . 28 PRO CA 1 1 10 7803 2 2 28 PRO CB C -6.926 -11.318 3.744 1.00 . B B . 28 PRO CB 1 1 10 7804 2 2 28 PRO CD C -6.505 -8.921 3.650 1.00 . B B . 28 PRO CD 1 1 10 7805 2 2 28 PRO CG C -6.835 -10.062 4.642 1.00 . B B . 28 PRO CG 1 1 10 7806 2 2 28 PRO HA H -4.806 -11.268 3.425 1.00 . B B . 28 PRO HA 1 1 10 7807 2 2 28 PRO HB2 H -7.838 -11.336 3.163 1.00 . B B . 28 PRO HB2 1 1 10 7808 2 2 28 PRO HB3 H -6.838 -12.231 4.318 1.00 . B B . 28 PRO HB3 1 1 10 7809 2 2 28 PRO HD2 H -7.405 -8.425 3.305 1.00 . B B . 28 PRO HD2 1 1 10 7810 2 2 28 PRO HD3 H -5.836 -8.197 4.092 1.00 . B B . 28 PRO HD3 1 1 10 7811 2 2 28 PRO HG2 H -7.769 -9.875 5.152 1.00 . B B . 28 PRO HG2 1 1 10 7812 2 2 28 PRO HG3 H -6.042 -10.163 5.372 1.00 . B B . 28 PRO HG3 1 1 10 7813 2 2 28 PRO N N -5.793 -9.637 2.538 1.00 . B B . 28 PRO N 1 1 10 7814 2 2 28 PRO O O -4.623 -12.888 1.643 1.00 . B B . 28 PRO O 1 1 10 7815 2 2 29 LYS C C -5.313 -13.652 -0.888 1.00 . B B . 29 LYS C 1 1 10 7816 2 2 29 LYS CA C -6.592 -12.877 -0.467 1.00 . B B . 29 LYS CA 1 1 10 7817 2 2 29 LYS CB C -7.070 -11.929 -1.645 1.00 . B B . 29 LYS CB 1 1 10 7818 2 2 29 LYS CD C -9.295 -10.748 -0.789 1.00 . B B . 29 LYS CD 1 1 10 7819 2 2 29 LYS CE C -8.853 -9.313 -1.127 1.00 . B B . 29 LYS CE 1 1 10 7820 2 2 29 LYS CG C -8.647 -11.798 -1.763 1.00 . B B . 29 LYS CG 1 1 10 7821 2 2 29 LYS H H -7.135 -11.359 1.042 1.00 . B B . 29 LYS H 1 1 10 7822 2 2 29 LYS HA H -7.296 -13.649 -0.283 1.00 . B B . 29 LYS HA 1 1 10 7823 2 2 29 LYS HB2 H -6.600 -10.966 -1.502 1.00 . B B . 29 LYS HB2 1 1 10 7824 2 2 29 LYS HB3 H -6.692 -12.327 -2.579 1.00 . B B . 29 LYS HB3 1 1 10 7825 2 2 29 LYS HD2 H -10.372 -10.813 -0.867 1.00 . B B . 29 LYS HD2 1 1 10 7826 2 2 29 LYS HD3 H -9.023 -10.994 0.227 1.00 . B B . 29 LYS HD3 1 1 10 7827 2 2 29 LYS HE2 H -7.775 -9.252 -1.209 1.00 . B B . 29 LYS HE2 1 1 10 7828 2 2 29 LYS HE3 H -9.275 -9.021 -2.085 1.00 . B B . 29 LYS HE3 1 1 10 7829 2 2 29 LYS HG2 H -8.904 -11.564 -2.790 1.00 . B B . 29 LYS HG2 1 1 10 7830 2 2 29 LYS HG3 H -9.079 -12.772 -1.554 1.00 . B B . 29 LYS HG3 1 1 10 7831 2 2 29 LYS HZ1 H -9.959 -8.896 0.637 1.00 . B B . 29 LYS HZ1 1 1 10 7832 2 2 29 LYS HZ2 H -8.538 -8.081 0.521 1.00 . B B . 29 LYS HZ2 1 1 10 7833 2 2 29 LYS HZ3 H -9.786 -7.516 -0.365 1.00 . B B . 29 LYS HZ3 1 1 10 7834 2 2 29 LYS N N -6.490 -12.034 0.790 1.00 . B B . 29 LYS N 1 1 10 7835 2 2 29 LYS NZ N -9.353 -8.408 -0.044 1.00 . B B . 29 LYS NZ 1 1 10 7836 2 2 29 LYS O O -5.329 -14.813 -1.238 1.00 . B B . 29 LYS O 1 1 10 7837 2 2 30 THR C C -1.880 -13.095 -0.031 1.00 . B B . 30 THR C 1 1 10 7838 2 2 30 THR CA C -2.857 -13.402 -1.181 1.00 . B B . 30 THR CA 1 1 10 7839 2 2 30 THR CB C -2.342 -12.708 -2.466 1.00 . B B . 30 THR CB 1 1 10 7840 2 2 30 THR CG2 C -2.153 -11.207 -2.342 1.00 . B B . 30 THR CG2 1 1 10 7841 2 2 30 THR H H -4.409 -12.012 -0.529 1.00 . B B . 30 THR H 1 1 10 7842 2 2 30 THR HA H -2.860 -14.472 -1.333 1.00 . B B . 30 THR HA 1 1 10 7843 2 2 30 THR HB H -2.902 -13.008 -3.345 1.00 . B B . 30 THR HB 1 1 10 7844 2 2 30 THR HG1 H -0.408 -12.366 -2.547 1.00 . B B . 30 THR HG1 1 1 10 7845 2 2 30 THR HG21 H -1.435 -10.961 -1.572 1.00 . B B . 30 THR HG21 1 1 10 7846 2 2 30 THR HG22 H -1.795 -10.813 -3.283 1.00 . B B . 30 THR HG22 1 1 10 7847 2 2 30 THR HG23 H -3.094 -10.740 -2.098 1.00 . B B . 30 THR HG23 1 1 10 7848 2 2 30 THR N N -4.250 -12.923 -0.835 1.00 . B B . 30 THR N 1 1 10 7849 2 2 30 THR O O -1.908 -12.022 0.553 1.00 . B B . 30 THR O 1 1 10 7850 2 2 30 THR OG1 O -0.995 -13.138 -2.562 1.00 . B B . 30 THR OG1 1 1 11 7851 1 1 1 GLY C C -0.486 -6.929 -3.380 1.00 . A A . 1 GLY C 1 1 11 7852 1 1 1 GLY CA C -1.017 -7.689 -4.592 1.00 . A A . 1 GLY CA 1 1 11 7853 1 1 1 GLY HA2 H -0.736 -7.155 -5.488 1.00 . A A . 1 GLY HA2 1 1 11 7854 1 1 1 GLY HA3 H -2.094 -7.733 -4.522 1.00 . A A . 1 GLY HA3 1 1 11 7855 1 1 1 GLY N N -0.442 -9.084 -4.632 1.00 . A A . 1 GLY N 1 1 11 7856 1 1 1 GLY O O -0.342 -7.525 -2.333 1.00 . A A . 1 GLY O 1 1 11 7857 1 1 2 ILE C C 1.413 -5.318 -1.554 1.00 . A A . 2 ILE C 1 1 11 7858 1 1 2 ILE CA C 0.300 -4.749 -2.467 1.00 . A A . 2 ILE CA 1 1 11 7859 1 1 2 ILE CB C -0.901 -4.234 -1.530 1.00 . A A . 2 ILE CB 1 1 11 7860 1 1 2 ILE CD1 C -1.258 -2.728 0.545 1.00 . A A . 2 ILE CD1 1 1 11 7861 1 1 2 ILE CG1 C -0.309 -3.106 -0.610 1.00 . A A . 2 ILE CG1 1 1 11 7862 1 1 2 ILE CG2 C -1.627 -5.283 -0.630 1.00 . A A . 2 ILE CG2 1 1 11 7863 1 1 2 ILE H H -0.426 -5.295 -4.441 1.00 . A A . 2 ILE H 1 1 11 7864 1 1 2 ILE HA H 0.732 -3.885 -2.952 1.00 . A A . 2 ILE HA 1 1 11 7865 1 1 2 ILE HB H -1.656 -3.818 -2.158 1.00 . A A . 2 ILE HB 1 1 11 7866 1 1 2 ILE HD11 H -2.214 -2.403 0.161 1.00 . A A . 2 ILE HD11 1 1 11 7867 1 1 2 ILE HD12 H -1.417 -3.562 1.214 1.00 . A A . 2 ILE HD12 1 1 11 7868 1 1 2 ILE HD13 H -0.821 -1.930 1.128 1.00 . A A . 2 ILE HD13 1 1 11 7869 1 1 2 ILE HG12 H 0.639 -3.404 -0.183 1.00 . A A . 2 ILE HG12 1 1 11 7870 1 1 2 ILE HG13 H -0.121 -2.222 -1.206 1.00 . A A . 2 ILE HG13 1 1 11 7871 1 1 2 ILE HG21 H -1.973 -6.127 -1.204 1.00 . A A . 2 ILE HG21 1 1 11 7872 1 1 2 ILE HG22 H -1.007 -5.604 0.191 1.00 . A A . 2 ILE HG22 1 1 11 7873 1 1 2 ILE HG23 H -2.492 -4.811 -0.185 1.00 . A A . 2 ILE HG23 1 1 11 7874 1 1 2 ILE N N -0.243 -5.663 -3.550 1.00 . A A . 2 ILE N 1 1 11 7875 1 1 2 ILE O O 2.561 -4.943 -1.663 1.00 . A A . 2 ILE O 1 1 11 7876 1 1 3 VAL C C 3.415 -7.066 -0.247 1.00 . A A . 3 VAL C 1 1 11 7877 1 1 3 VAL CA C 1.970 -6.861 0.289 1.00 . A A . 3 VAL CA 1 1 11 7878 1 1 3 VAL CB C 1.250 -8.201 0.713 1.00 . A A . 3 VAL CB 1 1 11 7879 1 1 3 VAL CG1 C 1.767 -8.610 2.083 1.00 . A A . 3 VAL CG1 1 1 11 7880 1 1 3 VAL CG2 C -0.295 -8.007 0.903 1.00 . A A . 3 VAL CG2 1 1 11 7881 1 1 3 VAL H H 0.113 -6.456 -0.717 1.00 . A A . 3 VAL H 1 1 11 7882 1 1 3 VAL HA H 2.066 -6.212 1.145 1.00 . A A . 3 VAL HA 1 1 11 7883 1 1 3 VAL HB H 1.461 -8.979 -0.012 1.00 . A A . 3 VAL HB 1 1 11 7884 1 1 3 VAL HG11 H 2.835 -8.759 2.065 1.00 . A A . 3 VAL HG11 1 1 11 7885 1 1 3 VAL HG12 H 1.524 -7.845 2.809 1.00 . A A . 3 VAL HG12 1 1 11 7886 1 1 3 VAL HG13 H 1.285 -9.527 2.386 1.00 . A A . 3 VAL HG13 1 1 11 7887 1 1 3 VAL HG21 H -0.498 -7.227 1.626 1.00 . A A . 3 VAL HG21 1 1 11 7888 1 1 3 VAL HG22 H -0.800 -7.759 -0.016 1.00 . A A . 3 VAL HG22 1 1 11 7889 1 1 3 VAL HG23 H -0.750 -8.912 1.275 1.00 . A A . 3 VAL HG23 1 1 11 7890 1 1 3 VAL N N 1.050 -6.207 -0.689 1.00 . A A . 3 VAL N 1 1 11 7891 1 1 3 VAL O O 4.311 -6.370 0.182 1.00 . A A . 3 VAL O 1 1 11 7892 1 1 4 GLU C C 5.697 -6.892 -2.215 1.00 . A A . 4 GLU C 1 1 11 7893 1 1 4 GLU CA C 5.028 -8.198 -1.704 1.00 . A A . 4 GLU CA 1 1 11 7894 1 1 4 GLU CB C 4.956 -9.217 -2.887 1.00 . A A . 4 GLU CB 1 1 11 7895 1 1 4 GLU CD C 2.600 -10.319 -2.717 1.00 . A A . 4 GLU CD 1 1 11 7896 1 1 4 GLU CG C 4.097 -10.486 -2.546 1.00 . A A . 4 GLU CG 1 1 11 7897 1 1 4 GLU H H 2.902 -8.506 -1.497 1.00 . A A . 4 GLU H 1 1 11 7898 1 1 4 GLU HA H 5.659 -8.591 -0.914 1.00 . A A . 4 GLU HA 1 1 11 7899 1 1 4 GLU HB2 H 4.526 -8.742 -3.759 1.00 . A A . 4 GLU HB2 1 1 11 7900 1 1 4 GLU HB3 H 5.958 -9.534 -3.144 1.00 . A A . 4 GLU HB3 1 1 11 7901 1 1 4 GLU HG2 H 4.384 -11.308 -3.183 1.00 . A A . 4 GLU HG2 1 1 11 7902 1 1 4 GLU HG3 H 4.262 -10.790 -1.524 1.00 . A A . 4 GLU HG3 1 1 11 7903 1 1 4 GLU N N 3.642 -7.967 -1.156 1.00 . A A . 4 GLU N 1 1 11 7904 1 1 4 GLU O O 6.752 -6.458 -1.792 1.00 . A A . 4 GLU O 1 1 11 7905 1 1 4 GLU OE1 O 2.107 -9.278 -3.114 1.00 . A A . 4 GLU OE1 1 1 11 7906 1 1 4 GLU OE2 O 1.924 -11.278 -2.428 1.00 . A A . 4 GLU OE2 1 1 11 7907 1 1 5 GLN C C 5.852 -3.851 -2.734 1.00 . A A . 5 GLN C 1 1 11 7908 1 1 5 GLN CA C 5.562 -4.998 -3.757 1.00 . A A . 5 GLN CA 1 1 11 7909 1 1 5 GLN CB C 4.514 -4.576 -4.833 1.00 . A A . 5 GLN CB 1 1 11 7910 1 1 5 GLN CD C 6.147 -4.099 -6.817 1.00 . A A . 5 GLN CD 1 1 11 7911 1 1 5 GLN CG C 5.159 -3.516 -5.819 1.00 . A A . 5 GLN CG 1 1 11 7912 1 1 5 GLN H H 4.197 -6.679 -3.435 1.00 . A A . 5 GLN H 1 1 11 7913 1 1 5 GLN HA H 6.496 -5.204 -4.248 1.00 . A A . 5 GLN HA 1 1 11 7914 1 1 5 GLN HB2 H 4.203 -5.451 -5.392 1.00 . A A . 5 GLN HB2 1 1 11 7915 1 1 5 GLN HB3 H 3.641 -4.161 -4.343 1.00 . A A . 5 GLN HB3 1 1 11 7916 1 1 5 GLN HE21 H 5.348 -3.178 -8.347 1.00 . A A . 5 GLN HE21 1 1 11 7917 1 1 5 GLN HE22 H 6.664 -4.218 -8.684 1.00 . A A . 5 GLN HE22 1 1 11 7918 1 1 5 GLN HG2 H 4.397 -2.995 -6.380 1.00 . A A . 5 GLN HG2 1 1 11 7919 1 1 5 GLN HG3 H 5.735 -2.797 -5.269 1.00 . A A . 5 GLN HG3 1 1 11 7920 1 1 5 GLN N N 5.043 -6.274 -3.152 1.00 . A A . 5 GLN N 1 1 11 7921 1 1 5 GLN NE2 N 6.042 -3.806 -8.059 1.00 . A A . 5 GLN NE2 1 1 11 7922 1 1 5 GLN O O 6.768 -3.081 -2.913 1.00 . A A . 5 GLN O 1 1 11 7923 1 1 5 GLN OE1 O 7.055 -4.831 -6.504 1.00 . A A . 5 GLN OE1 1 1 11 7924 1 1 6 CYS C C 6.077 -3.098 0.589 1.00 . A A . 6 CYS C 1 1 11 7925 1 1 6 CYS CA C 5.201 -2.715 -0.623 1.00 . A A . 6 CYS CA 1 1 11 7926 1 1 6 CYS CB C 3.777 -2.412 -0.181 1.00 . A A . 6 CYS CB 1 1 11 7927 1 1 6 CYS H H 4.332 -4.410 -1.631 1.00 . A A . 6 CYS H 1 1 11 7928 1 1 6 CYS HA H 5.629 -1.799 -1.015 1.00 . A A . 6 CYS HA 1 1 11 7929 1 1 6 CYS HB2 H 3.385 -3.268 0.348 1.00 . A A . 6 CYS HB2 1 1 11 7930 1 1 6 CYS HB3 H 3.807 -1.581 0.502 1.00 . A A . 6 CYS HB3 1 1 11 7931 1 1 6 CYS HG H 2.220 -2.806 -1.819 1.00 . A A . 6 CYS HG 1 1 11 7932 1 1 6 CYS N N 5.065 -3.764 -1.704 1.00 . A A . 6 CYS N 1 1 11 7933 1 1 6 CYS O O 6.789 -2.294 1.154 1.00 . A A . 6 CYS O 1 1 11 7934 1 1 6 CYS SG S 2.596 -1.990 -1.484 1.00 . A A . 6 CYS SG 1 1 11 7935 1 1 7 CYS C C 7.970 -5.790 1.764 1.00 . A A . 7 CYS C 1 1 11 7936 1 1 7 CYS CA C 6.781 -4.843 2.125 1.00 . A A . 7 CYS CA 1 1 11 7937 1 1 7 CYS CB C 5.672 -5.467 2.967 1.00 . A A . 7 CYS CB 1 1 11 7938 1 1 7 CYS H H 5.414 -4.946 0.477 1.00 . A A . 7 CYS H 1 1 11 7939 1 1 7 CYS HA H 7.188 -3.996 2.671 1.00 . A A . 7 CYS HA 1 1 11 7940 1 1 7 CYS HB2 H 5.009 -4.640 3.201 1.00 . A A . 7 CYS HB2 1 1 11 7941 1 1 7 CYS HB3 H 5.094 -6.116 2.328 1.00 . A A . 7 CYS HB3 1 1 11 7942 1 1 7 CYS HG H 6.433 -7.233 4.203 1.00 . A A . 7 CYS HG 1 1 11 7943 1 1 7 CYS N N 5.999 -4.332 0.961 1.00 . A A . 7 CYS N 1 1 11 7944 1 1 7 CYS O O 8.608 -6.369 2.620 1.00 . A A . 7 CYS O 1 1 11 7945 1 1 7 CYS SG S 6.104 -6.373 4.476 1.00 . A A . 7 CYS SG 1 1 11 7946 1 1 8 THR C C 10.176 -6.238 -1.163 1.00 . A A . 8 THR C 1 1 11 7947 1 1 8 THR CA C 9.377 -6.834 0.012 1.00 . A A . 8 THR CA 1 1 11 7948 1 1 8 THR CB C 8.826 -8.196 -0.428 1.00 . A A . 8 THR CB 1 1 11 7949 1 1 8 THR CG2 C 9.920 -9.229 -0.518 1.00 . A A . 8 THR CG2 1 1 11 7950 1 1 8 THR H H 7.664 -5.467 -0.141 1.00 . A A . 8 THR H 1 1 11 7951 1 1 8 THR HA H 10.080 -6.986 0.817 1.00 . A A . 8 THR HA 1 1 11 7952 1 1 8 THR HB H 8.171 -8.178 -1.290 1.00 . A A . 8 THR HB 1 1 11 7953 1 1 8 THR HG1 H 8.336 -8.130 1.466 1.00 . A A . 8 THR HG1 1 1 11 7954 1 1 8 THR HG21 H 10.391 -9.356 0.446 1.00 . A A . 8 THR HG21 1 1 11 7955 1 1 8 THR HG22 H 9.486 -10.172 -0.814 1.00 . A A . 8 THR HG22 1 1 11 7956 1 1 8 THR HG23 H 10.668 -8.935 -1.238 1.00 . A A . 8 THR HG23 1 1 11 7957 1 1 8 THR N N 8.237 -5.943 0.496 1.00 . A A . 8 THR N 1 1 11 7958 1 1 8 THR O O 11.386 -6.243 -1.193 1.00 . A A . 8 THR O 1 1 11 7959 1 1 8 THR OG1 O 8.152 -8.706 0.707 1.00 . A A . 8 THR OG1 1 1 11 7960 1 1 9 SER C C 9.594 -3.591 -3.389 1.00 . A A . 9 SER C 1 1 11 7961 1 1 9 SER CA C 9.967 -5.105 -3.378 1.00 . A A . 9 SER CA 1 1 11 7962 1 1 9 SER CB C 9.349 -5.918 -4.540 1.00 . A A . 9 SER CB 1 1 11 7963 1 1 9 SER H H 8.472 -5.823 -1.970 1.00 . A A . 9 SER H 1 1 11 7964 1 1 9 SER HA H 11.045 -5.172 -3.409 1.00 . A A . 9 SER HA 1 1 11 7965 1 1 9 SER HB2 H 9.786 -6.910 -4.555 1.00 . A A . 9 SER HB2 1 1 11 7966 1 1 9 SER HB3 H 8.280 -6.014 -4.430 1.00 . A A . 9 SER HB3 1 1 11 7967 1 1 9 SER HG H 8.828 -5.108 -6.210 1.00 . A A . 9 SER HG 1 1 11 7968 1 1 9 SER N N 9.435 -5.750 -2.113 1.00 . A A . 9 SER N 1 1 11 7969 1 1 9 SER O O 9.527 -3.027 -2.316 1.00 . A A . 9 SER O 1 1 11 7970 1 1 9 SER OG O 9.674 -5.246 -5.752 1.00 . A A . 9 SER OG 1 1 11 7971 1 1 10 ILE C C 7.678 -0.967 -5.126 1.00 . A A . 10 ILE C 1 1 11 7972 1 1 10 ILE CA C 9.011 -1.464 -4.475 1.00 . A A . 10 ILE CA 1 1 11 7973 1 1 10 ILE CB C 10.213 -0.639 -5.085 1.00 . A A . 10 ILE CB 1 1 11 7974 1 1 10 ILE CD1 C 12.748 -0.368 -5.003 1.00 . A A . 10 ILE CD1 1 1 11 7975 1 1 10 ILE CG1 C 11.501 -0.924 -4.256 1.00 . A A . 10 ILE CG1 1 1 11 7976 1 1 10 ILE CG2 C 9.902 0.889 -4.874 1.00 . A A . 10 ILE CG2 1 1 11 7977 1 1 10 ILE H H 9.454 -3.448 -5.332 1.00 . A A . 10 ILE H 1 1 11 7978 1 1 10 ILE HA H 8.956 -1.177 -3.457 1.00 . A A . 10 ILE HA 1 1 11 7979 1 1 10 ILE HB H 10.344 -0.884 -6.133 1.00 . A A . 10 ILE HB 1 1 11 7980 1 1 10 ILE HD11 H 12.841 -0.846 -5.968 1.00 . A A . 10 ILE HD11 1 1 11 7981 1 1 10 ILE HD12 H 12.683 0.699 -5.154 1.00 . A A . 10 ILE HD12 1 1 11 7982 1 1 10 ILE HD13 H 13.642 -0.579 -4.433 1.00 . A A . 10 ILE HD13 1 1 11 7983 1 1 10 ILE HG12 H 11.419 -0.464 -3.277 1.00 . A A . 10 ILE HG12 1 1 11 7984 1 1 10 ILE HG13 H 11.619 -1.987 -4.097 1.00 . A A . 10 ILE HG13 1 1 11 7985 1 1 10 ILE HG21 H 9.777 1.106 -3.821 1.00 . A A . 10 ILE HG21 1 1 11 7986 1 1 10 ILE HG22 H 10.702 1.497 -5.268 1.00 . A A . 10 ILE HG22 1 1 11 7987 1 1 10 ILE HG23 H 8.995 1.181 -5.385 1.00 . A A . 10 ILE HG23 1 1 11 7988 1 1 10 ILE N N 9.373 -2.940 -4.506 1.00 . A A . 10 ILE N 1 1 11 7989 1 1 10 ILE O O 7.571 -0.701 -6.309 1.00 . A A . 10 ILE O 1 1 11 7990 1 1 11 CYS C C 5.111 1.187 -4.601 1.00 . A A . 11 CYS C 1 1 11 7991 1 1 11 CYS CA C 5.305 -0.371 -4.758 1.00 . A A . 11 CYS CA 1 1 11 7992 1 1 11 CYS CB C 4.258 -1.136 -3.917 1.00 . A A . 11 CYS CB 1 1 11 7993 1 1 11 CYS H H 6.832 -1.102 -3.375 1.00 . A A . 11 CYS H 1 1 11 7994 1 1 11 CYS HA H 5.190 -0.618 -5.800 1.00 . A A . 11 CYS HA 1 1 11 7995 1 1 11 CYS HB2 H 3.341 -1.280 -4.461 1.00 . A A . 11 CYS HB2 1 1 11 7996 1 1 11 CYS HB3 H 4.644 -2.115 -3.735 1.00 . A A . 11 CYS HB3 1 1 11 7997 1 1 11 CYS HG H 3.116 0.130 -2.392 1.00 . A A . 11 CYS HG 1 1 11 7998 1 1 11 CYS N N 6.667 -0.847 -4.310 1.00 . A A . 11 CYS N 1 1 11 7999 1 1 11 CYS O O 4.252 1.709 -3.912 1.00 . A A . 11 CYS O 1 1 11 8000 1 1 11 CYS SG S 3.842 -0.487 -2.283 1.00 . A A . 11 CYS SG 1 1 11 8001 1 1 12 SER C C 4.821 4.514 -5.262 1.00 . A A . 12 SER C 1 1 11 8002 1 1 12 SER CA C 5.934 3.428 -5.272 1.00 . A A . 12 SER CA 1 1 11 8003 1 1 12 SER CB C 6.920 3.786 -6.382 1.00 . A A . 12 SER CB 1 1 11 8004 1 1 12 SER H H 6.582 1.443 -5.852 1.00 . A A . 12 SER H 1 1 11 8005 1 1 12 SER HA H 6.324 3.632 -4.316 1.00 . A A . 12 SER HA 1 1 11 8006 1 1 12 SER HB2 H 6.898 4.845 -6.607 1.00 . A A . 12 SER HB2 1 1 11 8007 1 1 12 SER HB3 H 7.915 3.494 -6.078 1.00 . A A . 12 SER HB3 1 1 11 8008 1 1 12 SER HG H 6.569 3.611 -8.251 1.00 . A A . 12 SER HG 1 1 11 8009 1 1 12 SER N N 5.929 1.913 -5.285 1.00 . A A . 12 SER N 1 1 11 8010 1 1 12 SER O O 4.742 5.404 -6.076 1.00 . A A . 12 SER O 1 1 11 8011 1 1 12 SER OG O 6.477 3.010 -7.493 1.00 . A A . 12 SER OG 1 1 11 8012 1 1 13 LEU C C 1.592 4.835 -4.705 1.00 . A A . 13 LEU C 1 1 11 8013 1 1 13 LEU CA C 2.778 5.223 -3.910 1.00 . A A . 13 LEU CA 1 1 11 8014 1 1 13 LEU CB C 3.129 6.738 -4.129 1.00 . A A . 13 LEU CB 1 1 11 8015 1 1 13 LEU CD1 C 1.311 7.665 -2.726 1.00 . A A . 13 LEU CD1 1 1 11 8016 1 1 13 LEU CD2 C 2.379 9.041 -4.486 1.00 . A A . 13 LEU CD2 1 1 11 8017 1 1 13 LEU CG C 1.898 7.644 -4.121 1.00 . A A . 13 LEU CG 1 1 11 8018 1 1 13 LEU H H 4.179 3.589 -3.801 1.00 . A A . 13 LEU H 1 1 11 8019 1 1 13 LEU HA H 2.489 5.017 -2.889 1.00 . A A . 13 LEU HA 1 1 11 8020 1 1 13 LEU HB2 H 3.766 7.051 -3.318 1.00 . A A . 13 LEU HB2 1 1 11 8021 1 1 13 LEU HB3 H 3.645 6.922 -5.055 1.00 . A A . 13 LEU HB3 1 1 11 8022 1 1 13 LEU HD11 H 2.035 8.034 -2.013 1.00 . A A . 13 LEU HD11 1 1 11 8023 1 1 13 LEU HD12 H 0.441 8.307 -2.710 1.00 . A A . 13 LEU HD12 1 1 11 8024 1 1 13 LEU HD13 H 1.006 6.670 -2.440 1.00 . A A . 13 LEU HD13 1 1 11 8025 1 1 13 LEU HD21 H 3.115 9.394 -3.777 1.00 . A A . 13 LEU HD21 1 1 11 8026 1 1 13 LEU HD22 H 2.827 9.032 -5.470 1.00 . A A . 13 LEU HD22 1 1 11 8027 1 1 13 LEU HD23 H 1.547 9.728 -4.499 1.00 . A A . 13 LEU HD23 1 1 11 8028 1 1 13 LEU HG H 1.152 7.319 -4.842 1.00 . A A . 13 LEU HG 1 1 11 8029 1 1 13 LEU N N 3.976 4.375 -4.289 1.00 . A A . 13 LEU N 1 1 11 8030 1 1 13 LEU O O 0.507 4.560 -4.233 1.00 . A A . 13 LEU O 1 1 11 8031 1 1 14 TYR C C 0.661 2.913 -6.731 1.00 . A A . 14 TYR C 1 1 11 8032 1 1 14 TYR CA C 0.805 4.411 -6.878 1.00 . A A . 14 TYR CA 1 1 11 8033 1 1 14 TYR CB C 1.140 4.867 -8.337 1.00 . A A . 14 TYR CB 1 1 11 8034 1 1 14 TYR CD1 C 3.229 3.746 -9.122 1.00 . A A . 14 TYR CD1 1 1 11 8035 1 1 14 TYR CD2 C 3.314 6.038 -8.501 1.00 . A A . 14 TYR CD2 1 1 11 8036 1 1 14 TYR CE1 C 4.572 3.790 -9.408 1.00 . A A . 14 TYR CE1 1 1 11 8037 1 1 14 TYR CE2 C 4.657 6.079 -8.788 1.00 . A A . 14 TYR CE2 1 1 11 8038 1 1 14 TYR CG C 2.607 4.873 -8.669 1.00 . A A . 14 TYR CG 1 1 11 8039 1 1 14 TYR CZ C 5.283 4.948 -9.242 1.00 . A A . 14 TYR CZ 1 1 11 8040 1 1 14 TYR H H 2.858 4.951 -6.128 1.00 . A A . 14 TYR H 1 1 11 8041 1 1 14 TYR HA H -0.117 4.881 -6.566 1.00 . A A . 14 TYR HA 1 1 11 8042 1 1 14 TYR HB2 H 0.615 4.229 -9.036 1.00 . A A . 14 TYR HB2 1 1 11 8043 1 1 14 TYR HB3 H 0.733 5.860 -8.478 1.00 . A A . 14 TYR HB3 1 1 11 8044 1 1 14 TYR HD1 H 2.656 2.840 -9.257 1.00 . A A . 14 TYR HD1 1 1 11 8045 1 1 14 TYR HD2 H 2.800 6.918 -8.142 1.00 . A A . 14 TYR HD2 1 1 11 8046 1 1 14 TYR HE1 H 5.084 2.911 -9.759 1.00 . A A . 14 TYR HE1 1 1 11 8047 1 1 14 TYR HE2 H 5.201 7.000 -8.642 1.00 . A A . 14 TYR HE2 1 1 11 8048 1 1 14 TYR HH H 6.707 5.516 -10.306 1.00 . A A . 14 TYR HH 1 1 11 8049 1 1 14 TYR N N 1.905 4.780 -5.944 1.00 . A A . 14 TYR N 1 1 11 8050 1 1 14 TYR O O -0.358 2.340 -7.060 1.00 . A A . 14 TYR O 1 1 11 8051 1 1 14 TYR OH O 6.624 4.941 -9.537 1.00 . A A . 14 TYR OH 1 1 11 8052 1 1 15 GLN C C 0.923 0.416 -4.660 1.00 . A A . 15 GLN C 1 1 11 8053 1 1 15 GLN CA C 1.394 0.767 -6.095 1.00 . A A . 15 GLN CA 1 1 11 8054 1 1 15 GLN CB C 2.669 0.044 -6.488 1.00 . A A . 15 GLN CB 1 1 11 8055 1 1 15 GLN CD C 4.550 -0.271 -8.123 1.00 . A A . 15 GLN CD 1 1 11 8056 1 1 15 GLN CG C 3.283 0.521 -7.849 1.00 . A A . 15 GLN CG 1 1 11 8057 1 1 15 GLN H H 2.531 2.655 -5.911 1.00 . A A . 15 GLN H 1 1 11 8058 1 1 15 GLN HA H 0.524 0.516 -6.670 1.00 . A A . 15 GLN HA 1 1 11 8059 1 1 15 GLN HB2 H 3.330 0.291 -5.702 1.00 . A A . 15 GLN HB2 1 1 11 8060 1 1 15 GLN HB3 H 2.504 -1.027 -6.494 1.00 . A A . 15 GLN HB3 1 1 11 8061 1 1 15 GLN HE21 H 5.846 1.244 -7.926 1.00 . A A . 15 GLN HE21 1 1 11 8062 1 1 15 GLN HE22 H 6.476 -0.294 -8.246 1.00 . A A . 15 GLN HE22 1 1 11 8063 1 1 15 GLN HG2 H 2.604 0.355 -8.672 1.00 . A A . 15 GLN HG2 1 1 11 8064 1 1 15 GLN HG3 H 3.558 1.561 -7.809 1.00 . A A . 15 GLN HG3 1 1 11 8065 1 1 15 GLN N N 1.667 2.237 -6.205 1.00 . A A . 15 GLN N 1 1 11 8066 1 1 15 GLN NE2 N 5.705 0.289 -8.094 1.00 . A A . 15 GLN NE2 1 1 11 8067 1 1 15 GLN O O 1.106 -0.651 -4.115 1.00 . A A . 15 GLN O 1 1 11 8068 1 1 15 GLN OE1 O 4.531 -1.453 -8.367 1.00 . A A . 15 GLN OE1 1 1 11 8069 1 1 16 LEU C C -1.748 1.899 -3.109 1.00 . A A . 16 LEU C 1 1 11 8070 1 1 16 LEU CA C -0.317 1.457 -2.788 1.00 . A A . 16 LEU CA 1 1 11 8071 1 1 16 LEU CB C 0.383 2.498 -1.819 1.00 . A A . 16 LEU CB 1 1 11 8072 1 1 16 LEU CD1 C 2.369 2.923 -0.351 1.00 . A A . 16 LEU CD1 1 1 11 8073 1 1 16 LEU CD2 C 1.496 0.653 -0.496 1.00 . A A . 16 LEU CD2 1 1 11 8074 1 1 16 LEU CG C 1.733 1.934 -1.322 1.00 . A A . 16 LEU CG 1 1 11 8075 1 1 16 LEU H H 0.216 2.227 -4.642 1.00 . A A . 16 LEU H 1 1 11 8076 1 1 16 LEU HA H -0.347 0.460 -2.443 1.00 . A A . 16 LEU HA 1 1 11 8077 1 1 16 LEU HB2 H 0.530 3.452 -2.303 1.00 . A A . 16 LEU HB2 1 1 11 8078 1 1 16 LEU HB3 H -0.260 2.690 -0.967 1.00 . A A . 16 LEU HB3 1 1 11 8079 1 1 16 LEU HD11 H 2.549 3.872 -0.828 1.00 . A A . 16 LEU HD11 1 1 11 8080 1 1 16 LEU HD12 H 1.721 3.071 0.503 1.00 . A A . 16 LEU HD12 1 1 11 8081 1 1 16 LEU HD13 H 3.311 2.528 0.001 1.00 . A A . 16 LEU HD13 1 1 11 8082 1 1 16 LEU HD21 H 0.857 0.838 0.355 1.00 . A A . 16 LEU HD21 1 1 11 8083 1 1 16 LEU HD22 H 1.044 -0.123 -1.095 1.00 . A A . 16 LEU HD22 1 1 11 8084 1 1 16 LEU HD23 H 2.437 0.268 -0.130 1.00 . A A . 16 LEU HD23 1 1 11 8085 1 1 16 LEU HG H 2.396 1.749 -2.161 1.00 . A A . 16 LEU HG 1 1 11 8086 1 1 16 LEU N N 0.295 1.423 -4.125 1.00 . A A . 16 LEU N 1 1 11 8087 1 1 16 LEU O O -2.697 1.234 -2.746 1.00 . A A . 16 LEU O 1 1 11 8088 1 1 17 GLU C C -4.021 2.294 -4.812 1.00 . A A . 17 GLU C 1 1 11 8089 1 1 17 GLU CA C -3.279 3.491 -4.170 1.00 . A A . 17 GLU CA 1 1 11 8090 1 1 17 GLU CB C -3.161 4.710 -5.138 1.00 . A A . 17 GLU CB 1 1 11 8091 1 1 17 GLU CD C -2.310 5.410 -7.486 1.00 . A A . 17 GLU CD 1 1 11 8092 1 1 17 GLU CG C -2.676 4.275 -6.532 1.00 . A A . 17 GLU CG 1 1 11 8093 1 1 17 GLU H H -1.055 3.455 -4.120 1.00 . A A . 17 GLU H 1 1 11 8094 1 1 17 GLU HA H -3.817 3.779 -3.277 1.00 . A A . 17 GLU HA 1 1 11 8095 1 1 17 GLU HB2 H -4.120 5.203 -5.244 1.00 . A A . 17 GLU HB2 1 1 11 8096 1 1 17 GLU HB3 H -2.470 5.447 -4.745 1.00 . A A . 17 GLU HB3 1 1 11 8097 1 1 17 GLU HG2 H -1.794 3.700 -6.406 1.00 . A A . 17 GLU HG2 1 1 11 8098 1 1 17 GLU HG3 H -3.414 3.687 -7.048 1.00 . A A . 17 GLU HG3 1 1 11 8099 1 1 17 GLU N N -1.880 2.996 -3.819 1.00 . A A . 17 GLU N 1 1 11 8100 1 1 17 GLU O O -5.145 1.975 -4.486 1.00 . A A . 17 GLU O 1 1 11 8101 1 1 17 GLU OE1 O -2.399 6.560 -7.103 1.00 . A A . 17 GLU OE1 1 1 11 8102 1 1 17 GLU OE2 O -1.945 4.994 -8.566 1.00 . A A . 17 GLU OE2 1 1 11 8103 1 1 18 ASN C C -4.719 -0.529 -5.502 1.00 . A A . 18 ASN C 1 1 11 8104 1 1 18 ASN CA C -3.899 0.423 -6.448 1.00 . A A . 18 ASN CA 1 1 11 8105 1 1 18 ASN CB C -2.641 -0.256 -7.071 1.00 . A A . 18 ASN CB 1 1 11 8106 1 1 18 ASN CG C -2.891 -1.600 -7.732 1.00 . A A . 18 ASN CG 1 1 11 8107 1 1 18 ASN H H -2.459 1.953 -5.947 1.00 . A A . 18 ASN H 1 1 11 8108 1 1 18 ASN HA H -4.610 0.767 -7.183 1.00 . A A . 18 ASN HA 1 1 11 8109 1 1 18 ASN HB2 H -2.221 0.394 -7.825 1.00 . A A . 18 ASN HB2 1 1 11 8110 1 1 18 ASN HB3 H -1.891 -0.414 -6.315 1.00 . A A . 18 ASN HB3 1 1 11 8111 1 1 18 ASN HD21 H -4.870 -1.555 -7.695 1.00 . A A . 18 ASN HD21 1 1 11 8112 1 1 18 ASN HD22 H -4.130 -2.918 -8.397 1.00 . A A . 18 ASN HD22 1 1 11 8113 1 1 18 ASN N N -3.359 1.634 -5.723 1.00 . A A . 18 ASN N 1 1 11 8114 1 1 18 ASN ND2 N -4.069 -2.051 -7.955 1.00 . A A . 18 ASN ND2 1 1 11 8115 1 1 18 ASN O O -5.636 -1.200 -5.924 1.00 . A A . 18 ASN O 1 1 11 8116 1 1 18 ASN OD1 O -1.977 -2.309 -8.076 1.00 . A A . 18 ASN OD1 1 1 11 8117 1 1 19 TYR C C -5.836 -0.528 -2.196 1.00 . A A . 19 TYR C 1 1 11 8118 1 1 19 TYR CA C -5.016 -1.393 -3.193 1.00 . A A . 19 TYR CA 1 1 11 8119 1 1 19 TYR CB C -3.867 -2.173 -2.502 1.00 . A A . 19 TYR CB 1 1 11 8120 1 1 19 TYR CD1 C -3.524 -3.829 -4.356 1.00 . A A . 19 TYR CD1 1 1 11 8121 1 1 19 TYR CD2 C -1.794 -2.253 -3.928 1.00 . A A . 19 TYR CD2 1 1 11 8122 1 1 19 TYR CE1 C -2.772 -4.366 -5.371 1.00 . A A . 19 TYR CE1 1 1 11 8123 1 1 19 TYR CE2 C -1.051 -2.799 -4.945 1.00 . A A . 19 TYR CE2 1 1 11 8124 1 1 19 TYR CG C -3.037 -2.770 -3.629 1.00 . A A . 19 TYR CG 1 1 11 8125 1 1 19 TYR CZ C -1.541 -3.856 -5.664 1.00 . A A . 19 TYR CZ 1 1 11 8126 1 1 19 TYR H H -3.605 0.036 -3.991 1.00 . A A . 19 TYR H 1 1 11 8127 1 1 19 TYR HA H -5.696 -2.076 -3.677 1.00 . A A . 19 TYR HA 1 1 11 8128 1 1 19 TYR HB2 H -3.229 -1.553 -1.887 1.00 . A A . 19 TYR HB2 1 1 11 8129 1 1 19 TYR HB3 H -4.230 -2.993 -1.892 1.00 . A A . 19 TYR HB3 1 1 11 8130 1 1 19 TYR HD1 H -4.499 -4.239 -4.133 1.00 . A A . 19 TYR HD1 1 1 11 8131 1 1 19 TYR HD2 H -1.399 -1.419 -3.362 1.00 . A A . 19 TYR HD2 1 1 11 8132 1 1 19 TYR HE1 H -3.155 -5.193 -5.943 1.00 . A A . 19 TYR HE1 1 1 11 8133 1 1 19 TYR HE2 H -0.078 -2.398 -5.182 1.00 . A A . 19 TYR HE2 1 1 11 8134 1 1 19 TYR HH H -0.998 -3.789 -7.400 1.00 . A A . 19 TYR HH 1 1 11 8135 1 1 19 TYR N N -4.351 -0.540 -4.249 1.00 . A A . 19 TYR N 1 1 11 8136 1 1 19 TYR O O -6.757 -0.963 -1.533 1.00 . A A . 19 TYR O 1 1 11 8137 1 1 19 TYR OH O -0.802 -4.405 -6.674 1.00 . A A . 19 TYR OH 1 1 11 8138 1 1 20 CYS C C -7.040 2.710 -2.031 1.00 . A A . 20 CYS C 1 1 11 8139 1 1 20 CYS CA C -6.028 1.779 -1.288 1.00 . A A . 20 CYS CA 1 1 11 8140 1 1 20 CYS CB C -4.804 2.487 -0.772 1.00 . A A . 20 CYS CB 1 1 11 8141 1 1 20 CYS H H -4.681 0.939 -2.718 1.00 . A A . 20 CYS H 1 1 11 8142 1 1 20 CYS HA H -6.528 1.403 -0.412 1.00 . A A . 20 CYS HA 1 1 11 8143 1 1 20 CYS HB2 H -4.461 1.946 0.088 1.00 . A A . 20 CYS HB2 1 1 11 8144 1 1 20 CYS HB3 H -4.025 2.516 -1.505 1.00 . A A . 20 CYS HB3 1 1 11 8145 1 1 20 CYS HG H -4.999 4.758 -0.930 1.00 . A A . 20 CYS HG 1 1 11 8146 1 1 20 CYS N N -5.439 0.702 -2.147 1.00 . A A . 20 CYS N 1 1 11 8147 1 1 20 CYS O O -7.025 3.911 -1.891 1.00 . A A . 20 CYS O 1 1 11 8148 1 1 20 CYS SG S -5.004 4.164 -0.175 1.00 . A A . 20 CYS SG 1 1 11 8149 1 1 21 ASN C C -10.430 2.460 -3.374 1.00 . A A . 21 ASN C 1 1 11 8150 1 1 21 ASN CA C -8.943 2.886 -3.576 1.00 . A A . 21 ASN CA 1 1 11 8151 1 1 21 ASN CB C -8.533 2.761 -5.040 1.00 . A A . 21 ASN CB 1 1 11 8152 1 1 21 ASN CG C -8.546 1.300 -5.405 1.00 . A A . 21 ASN CG 1 1 11 8153 1 1 21 ASN H H -7.863 1.133 -2.857 1.00 . A A . 21 ASN H 1 1 11 8154 1 1 21 ASN HA H -8.881 3.931 -3.294 1.00 . A A . 21 ASN HA 1 1 11 8155 1 1 21 ASN HB2 H -9.228 3.286 -5.678 1.00 . A A . 21 ASN HB2 1 1 11 8156 1 1 21 ASN HB3 H -7.541 3.154 -5.192 1.00 . A A . 21 ASN HB3 1 1 11 8157 1 1 21 ASN HD21 H -6.634 1.104 -5.118 1.00 . A A . 21 ASN HD21 1 1 11 8158 1 1 21 ASN HD22 H -7.455 -0.299 -5.643 1.00 . A A . 21 ASN HD22 1 1 11 8159 1 1 21 ASN N N -7.906 2.106 -2.797 1.00 . A A . 21 ASN N 1 1 11 8160 1 1 21 ASN ND2 N -7.450 0.645 -5.388 1.00 . A A . 21 ASN ND2 1 1 11 8161 1 1 21 ASN O O -10.802 1.774 -2.426 1.00 . A A . 21 ASN O 1 1 11 8162 1 1 21 ASN OD1 O -9.549 0.703 -5.706 1.00 . A A . 21 ASN OD1 1 1 11 8163 2 2 1 PHE C C 9.721 6.162 -7.200 1.00 . B B . 1 PHE C 1 1 11 8164 2 2 1 PHE CA C 9.465 6.739 -8.625 1.00 . B B . 1 PHE CA 1 1 11 8165 2 2 1 PHE CB C 8.160 7.576 -8.732 1.00 . B B . 1 PHE CB 1 1 11 8166 2 2 1 PHE CD1 C 8.764 9.982 -8.282 1.00 . B B . 1 PHE CD1 1 1 11 8167 2 2 1 PHE CD2 C 7.609 8.791 -6.582 1.00 . B B . 1 PHE CD2 1 1 11 8168 2 2 1 PHE CE1 C 8.786 11.106 -7.484 1.00 . B B . 1 PHE CE1 1 1 11 8169 2 2 1 PHE CE2 C 7.628 9.914 -5.778 1.00 . B B . 1 PHE CE2 1 1 11 8170 2 2 1 PHE CG C 8.177 8.818 -7.838 1.00 . B B . 1 PHE CG 1 1 11 8171 2 2 1 PHE CZ C 8.217 11.071 -6.231 1.00 . B B . 1 PHE CZ 1 1 11 8172 2 2 1 PHE HA H 10.323 7.342 -8.881 1.00 . B B . 1 PHE HA 1 1 11 8173 2 2 1 PHE HB2 H 8.009 7.887 -9.755 1.00 . B B . 1 PHE HB2 1 1 11 8174 2 2 1 PHE HB3 H 7.328 6.957 -8.436 1.00 . B B . 1 PHE HB3 1 1 11 8175 2 2 1 PHE HD1 H 9.212 10.014 -9.266 1.00 . B B . 1 PHE HD1 1 1 11 8176 2 2 1 PHE HD2 H 7.149 7.879 -6.229 1.00 . B B . 1 PHE HD2 1 1 11 8177 2 2 1 PHE HE1 H 9.250 12.017 -7.840 1.00 . B B . 1 PHE HE1 1 1 11 8178 2 2 1 PHE HE2 H 7.185 9.895 -4.791 1.00 . B B . 1 PHE HE2 1 1 11 8179 2 2 1 PHE HZ H 8.234 11.954 -5.603 1.00 . B B . 1 PHE HZ 1 1 11 8180 2 2 1 PHE N N 9.315 5.665 -9.657 1.00 . B B . 1 PHE N 1 1 11 8181 2 2 1 PHE O O 9.846 4.970 -6.999 1.00 . B B . 1 PHE O 1 1 11 8182 2 2 2 VAL C C 8.721 6.265 -4.051 1.00 . B B . 2 VAL C 1 1 11 8183 2 2 2 VAL CA C 10.033 6.562 -4.832 1.00 . B B . 2 VAL CA 1 1 11 8184 2 2 2 VAL CB C 10.919 7.680 -4.145 1.00 . B B . 2 VAL CB 1 1 11 8185 2 2 2 VAL CG1 C 12.201 7.891 -4.977 1.00 . B B . 2 VAL CG1 1 1 11 8186 2 2 2 VAL CG2 C 10.196 9.035 -4.108 1.00 . B B . 2 VAL CG2 1 1 11 8187 2 2 2 VAL H H 9.694 7.953 -6.336 1.00 . B B . 2 VAL H 1 1 11 8188 2 2 2 VAL HA H 10.604 5.673 -4.906 1.00 . B B . 2 VAL HA 1 1 11 8189 2 2 2 VAL HB H 11.215 7.373 -3.145 1.00 . B B . 2 VAL HB 1 1 11 8190 2 2 2 VAL HG11 H 12.770 6.975 -5.041 1.00 . B B . 2 VAL HG11 1 1 11 8191 2 2 2 VAL HG12 H 11.964 8.213 -5.982 1.00 . B B . 2 VAL HG12 1 1 11 8192 2 2 2 VAL HG13 H 12.824 8.647 -4.522 1.00 . B B . 2 VAL HG13 1 1 11 8193 2 2 2 VAL HG21 H 9.260 8.970 -3.570 1.00 . B B . 2 VAL HG21 1 1 11 8194 2 2 2 VAL HG22 H 10.816 9.774 -3.619 1.00 . B B . 2 VAL HG22 1 1 11 8195 2 2 2 VAL HG23 H 9.997 9.390 -5.108 1.00 . B B . 2 VAL HG23 1 1 11 8196 2 2 2 VAL N N 9.791 7.008 -6.215 1.00 . B B . 2 VAL N 1 1 11 8197 2 2 2 VAL O O 7.689 5.963 -4.620 1.00 . B B . 2 VAL O 1 1 11 8198 2 2 3 ASN C C 7.943 4.698 -1.107 1.00 . B B . 3 ASN C 1 1 11 8199 2 2 3 ASN CA C 7.788 6.122 -1.699 1.00 . B B . 3 ASN CA 1 1 11 8200 2 2 3 ASN CB C 6.344 6.270 -2.283 1.00 . B B . 3 ASN CB 1 1 11 8201 2 2 3 ASN CG C 6.140 7.639 -2.891 1.00 . B B . 3 ASN CG 1 1 11 8202 2 2 3 ASN H H 9.760 6.581 -2.505 1.00 . B B . 3 ASN H 1 1 11 8203 2 2 3 ASN HA H 7.932 6.829 -0.893 1.00 . B B . 3 ASN HA 1 1 11 8204 2 2 3 ASN HB2 H 6.122 5.510 -3.008 1.00 . B B . 3 ASN HB2 1 1 11 8205 2 2 3 ASN HB3 H 5.640 6.177 -1.468 1.00 . B B . 3 ASN HB3 1 1 11 8206 2 2 3 ASN HD21 H 5.871 6.986 -4.724 1.00 . B B . 3 ASN HD21 1 1 11 8207 2 2 3 ASN HD22 H 5.742 8.673 -4.478 1.00 . B B . 3 ASN HD22 1 1 11 8208 2 2 3 ASN N N 8.849 6.345 -2.762 1.00 . B B . 3 ASN N 1 1 11 8209 2 2 3 ASN ND2 N 5.896 7.772 -4.143 1.00 . B B . 3 ASN ND2 1 1 11 8210 2 2 3 ASN O O 7.025 3.901 -1.050 1.00 . B B . 3 ASN O 1 1 11 8211 2 2 3 ASN OD1 O 6.193 8.648 -2.236 1.00 . B B . 3 ASN OD1 1 1 11 8212 2 2 4 GLN C C 8.744 2.691 1.210 1.00 . B B . 4 GLN C 1 1 11 8213 2 2 4 GLN CA C 9.507 3.112 -0.082 1.00 . B B . 4 GLN CA 1 1 11 8214 2 2 4 GLN CB C 11.027 3.166 0.149 1.00 . B B . 4 GLN CB 1 1 11 8215 2 2 4 GLN CD C 11.319 3.952 -2.346 1.00 . B B . 4 GLN CD 1 1 11 8216 2 2 4 GLN CG C 11.840 3.072 -1.211 1.00 . B B . 4 GLN CG 1 1 11 8217 2 2 4 GLN H H 9.832 5.112 -0.788 1.00 . B B . 4 GLN H 1 1 11 8218 2 2 4 GLN HA H 9.315 2.335 -0.810 1.00 . B B . 4 GLN HA 1 1 11 8219 2 2 4 GLN HB2 H 11.263 4.061 0.703 1.00 . B B . 4 GLN HB2 1 1 11 8220 2 2 4 GLN HB3 H 11.272 2.309 0.766 1.00 . B B . 4 GLN HB3 1 1 11 8221 2 2 4 GLN HE21 H 11.162 2.442 -3.584 1.00 . B B . 4 GLN HE21 1 1 11 8222 2 2 4 GLN HE22 H 10.702 3.950 -4.206 1.00 . B B . 4 GLN HE22 1 1 11 8223 2 2 4 GLN HG2 H 12.863 3.366 -1.038 1.00 . B B . 4 GLN HG2 1 1 11 8224 2 2 4 GLN HG3 H 11.839 2.051 -1.560 1.00 . B B . 4 GLN HG3 1 1 11 8225 2 2 4 GLN N N 9.142 4.427 -0.690 1.00 . B B . 4 GLN N 1 1 11 8226 2 2 4 GLN NE2 N 11.038 3.402 -3.473 1.00 . B B . 4 GLN NE2 1 1 11 8227 2 2 4 GLN O O 9.119 2.925 2.339 1.00 . B B . 4 GLN O 1 1 11 8228 2 2 4 GLN OE1 O 11.153 5.146 -2.252 1.00 . B B . 4 GLN OE1 1 1 11 8229 2 2 5 HIS C C 7.111 0.664 2.865 1.00 . B B . 5 HIS C 1 1 11 8230 2 2 5 HIS CA C 6.578 1.471 1.676 1.00 . B B . 5 HIS CA 1 1 11 8231 2 2 5 HIS CB C 5.700 0.578 0.679 1.00 . B B . 5 HIS CB 1 1 11 8232 2 2 5 HIS CD2 C 6.699 0.809 -1.735 1.00 . B B . 5 HIS CD2 1 1 11 8233 2 2 5 HIS CE1 C 8.347 -0.401 -1.407 1.00 . B B . 5 HIS CE1 1 1 11 8234 2 2 5 HIS CG C 6.636 0.322 -0.461 1.00 . B B . 5 HIS CG 1 1 11 8235 2 2 5 HIS H H 7.504 2.015 -0.072 1.00 . B B . 5 HIS H 1 1 11 8236 2 2 5 HIS HA H 5.952 2.247 2.053 1.00 . B B . 5 HIS HA 1 1 11 8237 2 2 5 HIS HB2 H 5.417 -0.362 1.123 1.00 . B B . 5 HIS HB2 1 1 11 8238 2 2 5 HIS HB3 H 4.830 1.098 0.311 1.00 . B B . 5 HIS HB3 1 1 11 8239 2 2 5 HIS HD1 H 7.867 -0.914 0.512 1.00 . B B . 5 HIS HD1 1 1 11 8240 2 2 5 HIS HD2 H 5.969 1.468 -2.176 1.00 . B B . 5 HIS HD2 1 1 11 8241 2 2 5 HIS HE1 H 9.274 -0.945 -1.532 1.00 . B B . 5 HIS HE1 1 1 11 8242 2 2 5 HIS N N 7.656 2.089 0.866 1.00 . B B . 5 HIS N 1 1 11 8243 2 2 5 HIS ND1 N 7.664 -0.415 -0.320 1.00 . B B . 5 HIS ND1 1 1 11 8244 2 2 5 HIS NE2 N 7.780 0.352 -2.320 1.00 . B B . 5 HIS NE2 1 1 11 8245 2 2 5 HIS O O 8.269 0.362 3.065 1.00 . B B . 5 HIS O 1 1 11 8246 2 2 6 LEU C C 5.655 -1.869 4.869 1.00 . B B . 6 LEU C 1 1 11 8247 2 2 6 LEU CA C 6.300 -0.451 4.875 1.00 . B B . 6 LEU CA 1 1 11 8248 2 2 6 LEU CB C 5.701 0.416 6.028 1.00 . B B . 6 LEU CB 1 1 11 8249 2 2 6 LEU CD1 C 7.557 2.185 5.881 1.00 . B B . 6 LEU CD1 1 1 11 8250 2 2 6 LEU CD2 C 5.269 2.760 5.038 1.00 . B B . 6 LEU CD2 1 1 11 8251 2 2 6 LEU CG C 6.058 1.937 6.063 1.00 . B B . 6 LEU CG 1 1 11 8252 2 2 6 LEU H H 5.295 0.645 3.234 1.00 . B B . 6 LEU H 1 1 11 8253 2 2 6 LEU HA H 7.358 -0.583 5.060 1.00 . B B . 6 LEU HA 1 1 11 8254 2 2 6 LEU HB2 H 4.626 0.323 6.006 1.00 . B B . 6 LEU HB2 1 1 11 8255 2 2 6 LEU HB3 H 6.068 0.002 6.952 1.00 . B B . 6 LEU HB3 1 1 11 8256 2 2 6 LEU HD11 H 8.127 1.709 6.662 1.00 . B B . 6 LEU HD11 1 1 11 8257 2 2 6 LEU HD12 H 7.912 1.814 4.931 1.00 . B B . 6 LEU HD12 1 1 11 8258 2 2 6 LEU HD13 H 7.766 3.246 5.903 1.00 . B B . 6 LEU HD13 1 1 11 8259 2 2 6 LEU HD21 H 4.209 2.656 5.218 1.00 . B B . 6 LEU HD21 1 1 11 8260 2 2 6 LEU HD22 H 5.532 3.805 5.131 1.00 . B B . 6 LEU HD22 1 1 11 8261 2 2 6 LEU HD23 H 5.479 2.468 4.028 1.00 . B B . 6 LEU HD23 1 1 11 8262 2 2 6 LEU HG H 5.765 2.308 7.038 1.00 . B B . 6 LEU HG 1 1 11 8263 2 2 6 LEU N N 6.130 0.330 3.612 1.00 . B B . 6 LEU N 1 1 11 8264 2 2 6 LEU O O 5.134 -2.333 3.874 1.00 . B B . 6 LEU O 1 1 11 8265 2 2 7 CYS C C 3.712 -3.947 6.798 1.00 . B B . 7 CYS C 1 1 11 8266 2 2 7 CYS CA C 5.099 -3.908 6.099 1.00 . B B . 7 CYS CA 1 1 11 8267 2 2 7 CYS CB C 6.137 -4.774 6.840 1.00 . B B . 7 CYS CB 1 1 11 8268 2 2 7 CYS H H 6.110 -2.107 6.772 1.00 . B B . 7 CYS H 1 1 11 8269 2 2 7 CYS HA H 4.942 -4.301 5.112 1.00 . B B . 7 CYS HA 1 1 11 8270 2 2 7 CYS HB2 H 7.120 -4.500 6.479 1.00 . B B . 7 CYS HB2 1 1 11 8271 2 2 7 CYS HB3 H 6.102 -4.563 7.898 1.00 . B B . 7 CYS HB3 1 1 11 8272 2 2 7 CYS HG H 6.846 -6.911 6.337 1.00 . B B . 7 CYS HG 1 1 11 8273 2 2 7 CYS N N 5.692 -2.527 5.999 1.00 . B B . 7 CYS N 1 1 11 8274 2 2 7 CYS O O 3.315 -2.988 7.421 1.00 . B B . 7 CYS O 1 1 11 8275 2 2 7 CYS SG S 5.996 -6.567 6.626 1.00 . B B . 7 CYS SG 1 1 11 8276 2 2 8 GLY C C 0.874 -4.120 7.813 1.00 . B B . 8 GLY C 1 1 11 8277 2 2 8 GLY CA C 1.657 -5.308 7.267 1.00 . B B . 8 GLY CA 1 1 11 8278 2 2 8 GLY H H 3.469 -5.775 6.179 1.00 . B B . 8 GLY H 1 1 11 8279 2 2 8 GLY HA2 H 1.026 -5.751 6.516 1.00 . B B . 8 GLY HA2 1 1 11 8280 2 2 8 GLY HA3 H 1.752 -5.996 8.094 1.00 . B B . 8 GLY HA3 1 1 11 8281 2 2 8 GLY N N 3.038 -5.059 6.677 1.00 . B B . 8 GLY N 1 1 11 8282 2 2 8 GLY O O 0.169 -3.427 7.107 1.00 . B B . 8 GLY O 1 1 11 8283 2 2 9 ASP C C 0.855 -1.443 9.212 1.00 . B B . 9 ASP C 1 1 11 8284 2 2 9 ASP CA C 0.347 -2.802 9.784 1.00 . B B . 9 ASP CA 1 1 11 8285 2 2 9 ASP CB C 0.694 -3.093 11.267 1.00 . B B . 9 ASP CB 1 1 11 8286 2 2 9 ASP CG C 0.452 -4.565 11.530 1.00 . B B . 9 ASP CG 1 1 11 8287 2 2 9 ASP H H 1.625 -4.523 9.570 1.00 . B B . 9 ASP H 1 1 11 8288 2 2 9 ASP HA H -0.723 -2.864 9.593 1.00 . B B . 9 ASP HA 1 1 11 8289 2 2 9 ASP HB2 H 1.718 -2.874 11.512 1.00 . B B . 9 ASP HB2 1 1 11 8290 2 2 9 ASP HB3 H 0.041 -2.543 11.925 1.00 . B B . 9 ASP HB3 1 1 11 8291 2 2 9 ASP N N 1.035 -3.917 9.067 1.00 . B B . 9 ASP N 1 1 11 8292 2 2 9 ASP O O 0.133 -0.591 8.740 1.00 . B B . 9 ASP O 1 1 11 8293 2 2 9 ASP OD1 O -0.688 -4.895 11.773 1.00 . B B . 9 ASP OD1 1 1 11 8294 2 2 9 ASP OD2 O 1.450 -5.257 11.440 1.00 . B B . 9 ASP OD2 1 1 11 8295 2 2 10 HIS C C 2.279 0.266 7.236 1.00 . B B . 10 HIS C 1 1 11 8296 2 2 10 HIS CA C 2.733 0.013 8.710 1.00 . B B . 10 HIS CA 1 1 11 8297 2 2 10 HIS CB C 4.246 -0.129 8.832 1.00 . B B . 10 HIS CB 1 1 11 8298 2 2 10 HIS CD2 C 3.937 -0.459 11.449 1.00 . B B . 10 HIS CD2 1 1 11 8299 2 2 10 HIS CE1 C 5.939 -0.566 11.960 1.00 . B B . 10 HIS CE1 1 1 11 8300 2 2 10 HIS CG C 4.667 -0.323 10.285 1.00 . B B . 10 HIS CG 1 1 11 8301 2 2 10 HIS H H 2.670 -2.003 9.611 1.00 . B B . 10 HIS H 1 1 11 8302 2 2 10 HIS HA H 2.366 0.845 9.298 1.00 . B B . 10 HIS HA 1 1 11 8303 2 2 10 HIS HB2 H 4.557 -0.989 8.262 1.00 . B B . 10 HIS HB2 1 1 11 8304 2 2 10 HIS HB3 H 4.706 0.771 8.459 1.00 . B B . 10 HIS HB3 1 1 11 8305 2 2 10 HIS HD1 H 6.666 -0.334 10.078 1.00 . B B . 10 HIS HD1 1 1 11 8306 2 2 10 HIS HD2 H 2.858 -0.445 11.510 1.00 . B B . 10 HIS HD2 1 1 11 8307 2 2 10 HIS HE1 H 6.843 -0.661 12.549 1.00 . B B . 10 HIS HE1 1 1 11 8308 2 2 10 HIS N N 2.138 -1.267 9.242 1.00 . B B . 10 HIS N 1 1 11 8309 2 2 10 HIS ND1 N 5.892 -0.398 10.673 1.00 . B B . 10 HIS ND1 1 1 11 8310 2 2 10 HIS NE2 N 4.740 -0.608 12.481 1.00 . B B . 10 HIS NE2 1 1 11 8311 2 2 10 HIS O O 2.192 1.376 6.746 1.00 . B B . 10 HIS O 1 1 11 8312 2 2 11 LEU C C 0.083 -0.306 5.180 1.00 . B B . 11 LEU C 1 1 11 8313 2 2 11 LEU CA C 1.545 -0.805 5.146 1.00 . B B . 11 LEU CA 1 1 11 8314 2 2 11 LEU CB C 1.736 -2.255 4.627 1.00 . B B . 11 LEU CB 1 1 11 8315 2 2 11 LEU CD1 C 1.810 -1.426 2.273 1.00 . B B . 11 LEU CD1 1 1 11 8316 2 2 11 LEU CD2 C 1.697 -3.828 2.744 1.00 . B B . 11 LEU CD2 1 1 11 8317 2 2 11 LEU CG C 1.202 -2.461 3.209 1.00 . B B . 11 LEU CG 1 1 11 8318 2 2 11 LEU H H 2.114 -1.663 7.052 1.00 . B B . 11 LEU H 1 1 11 8319 2 2 11 LEU HA H 2.127 -0.108 4.562 1.00 . B B . 11 LEU HA 1 1 11 8320 2 2 11 LEU HB2 H 2.795 -2.469 4.636 1.00 . B B . 11 LEU HB2 1 1 11 8321 2 2 11 LEU HB3 H 1.258 -2.961 5.281 1.00 . B B . 11 LEU HB3 1 1 11 8322 2 2 11 LEU HD11 H 2.887 -1.480 2.323 1.00 . B B . 11 LEU HD11 1 1 11 8323 2 2 11 LEU HD12 H 1.490 -1.607 1.256 1.00 . B B . 11 LEU HD12 1 1 11 8324 2 2 11 LEU HD13 H 1.501 -0.429 2.550 1.00 . B B . 11 LEU HD13 1 1 11 8325 2 2 11 LEU HD21 H 1.336 -4.602 3.405 1.00 . B B . 11 LEU HD21 1 1 11 8326 2 2 11 LEU HD22 H 1.342 -4.035 1.748 1.00 . B B . 11 LEU HD22 1 1 11 8327 2 2 11 LEU HD23 H 2.778 -3.855 2.740 1.00 . B B . 11 LEU HD23 1 1 11 8328 2 2 11 LEU HG H 0.117 -2.419 3.202 1.00 . B B . 11 LEU HG 1 1 11 8329 2 2 11 LEU N N 2.005 -0.819 6.570 1.00 . B B . 11 LEU N 1 1 11 8330 2 2 11 LEU O O -0.237 0.657 4.513 1.00 . B B . 11 LEU O 1 1 11 8331 2 2 12 VAL C C -2.207 1.110 6.360 1.00 . B B . 12 VAL C 1 1 11 8332 2 2 12 VAL CA C -2.211 -0.385 5.936 1.00 . B B . 12 VAL CA 1 1 11 8333 2 2 12 VAL CB C -3.110 -1.203 6.923 1.00 . B B . 12 VAL CB 1 1 11 8334 2 2 12 VAL CG1 C -2.456 -1.330 8.269 1.00 . B B . 12 VAL CG1 1 1 11 8335 2 2 12 VAL CG2 C -4.373 -0.385 7.171 1.00 . B B . 12 VAL CG2 1 1 11 8336 2 2 12 VAL H H -0.522 -1.718 6.435 1.00 . B B . 12 VAL H 1 1 11 8337 2 2 12 VAL HA H -2.620 -0.425 4.941 1.00 . B B . 12 VAL HA 1 1 11 8338 2 2 12 VAL HB H -3.340 -2.186 6.539 1.00 . B B . 12 VAL HB 1 1 11 8339 2 2 12 VAL HG11 H -2.258 -0.367 8.726 1.00 . B B . 12 VAL HG11 1 1 11 8340 2 2 12 VAL HG12 H -3.058 -1.896 8.957 1.00 . B B . 12 VAL HG12 1 1 11 8341 2 2 12 VAL HG13 H -1.526 -1.845 8.115 1.00 . B B . 12 VAL HG13 1 1 11 8342 2 2 12 VAL HG21 H -4.849 -0.135 6.235 1.00 . B B . 12 VAL HG21 1 1 11 8343 2 2 12 VAL HG22 H -5.065 -0.904 7.809 1.00 . B B . 12 VAL HG22 1 1 11 8344 2 2 12 VAL HG23 H -4.106 0.540 7.668 1.00 . B B . 12 VAL HG23 1 1 11 8345 2 2 12 VAL N N -0.796 -0.926 5.921 1.00 . B B . 12 VAL N 1 1 11 8346 2 2 12 VAL O O -2.813 1.931 5.694 1.00 . B B . 12 VAL O 1 1 11 8347 2 2 13 GLU C C -1.158 3.743 6.680 1.00 . B B . 13 GLU C 1 1 11 8348 2 2 13 GLU CA C -1.477 2.865 7.914 1.00 . B B . 13 GLU CA 1 1 11 8349 2 2 13 GLU CB C -0.382 2.933 9.013 1.00 . B B . 13 GLU CB 1 1 11 8350 2 2 13 GLU CD C -2.197 2.476 10.811 1.00 . B B . 13 GLU CD 1 1 11 8351 2 2 13 GLU CG C -0.837 2.062 10.256 1.00 . B B . 13 GLU CG 1 1 11 8352 2 2 13 GLU H H -1.071 0.739 7.944 1.00 . B B . 13 GLU H 1 1 11 8353 2 2 13 GLU HA H -2.438 3.159 8.311 1.00 . B B . 13 GLU HA 1 1 11 8354 2 2 13 GLU HB2 H 0.560 2.571 8.627 1.00 . B B . 13 GLU HB2 1 1 11 8355 2 2 13 GLU HB3 H -0.264 3.961 9.332 1.00 . B B . 13 GLU HB3 1 1 11 8356 2 2 13 GLU HG2 H -0.901 1.016 10.014 1.00 . B B . 13 GLU HG2 1 1 11 8357 2 2 13 GLU HG3 H -0.141 2.179 11.068 1.00 . B B . 13 GLU HG3 1 1 11 8358 2 2 13 GLU N N -1.540 1.437 7.438 1.00 . B B . 13 GLU N 1 1 11 8359 2 2 13 GLU O O -1.708 4.802 6.418 1.00 . B B . 13 GLU O 1 1 11 8360 2 2 13 GLU OE1 O -2.266 3.599 11.273 1.00 . B B . 13 GLU OE1 1 1 11 8361 2 2 13 GLU OE2 O -3.091 1.649 10.739 1.00 . B B . 13 GLU OE2 1 1 11 8362 2 2 14 ALA C C -1.019 3.976 3.699 1.00 . B B . 14 ALA C 1 1 11 8363 2 2 14 ALA CA C 0.163 3.982 4.672 1.00 . B B . 14 ALA CA 1 1 11 8364 2 2 14 ALA CB C 1.436 3.286 4.108 1.00 . B B . 14 ALA CB 1 1 11 8365 2 2 14 ALA H H 0.189 2.396 6.155 1.00 . B B . 14 ALA H 1 1 11 8366 2 2 14 ALA HA H 0.235 5.009 4.946 1.00 . B B . 14 ALA HA 1 1 11 8367 2 2 14 ALA HB1 H 2.213 3.314 4.858 1.00 . B B . 14 ALA HB1 1 1 11 8368 2 2 14 ALA HB2 H 1.232 2.256 3.864 1.00 . B B . 14 ALA HB2 1 1 11 8369 2 2 14 ALA HB3 H 1.784 3.793 3.221 1.00 . B B . 14 ALA HB3 1 1 11 8370 2 2 14 ALA N N -0.231 3.245 5.902 1.00 . B B . 14 ALA N 1 1 11 8371 2 2 14 ALA O O -1.326 4.999 3.117 1.00 . B B . 14 ALA O 1 1 11 8372 2 2 15 LEU C C -3.698 4.042 3.045 1.00 . B B . 15 LEU C 1 1 11 8373 2 2 15 LEU CA C -2.832 2.840 2.585 1.00 . B B . 15 LEU CA 1 1 11 8374 2 2 15 LEU CB C -3.591 1.476 2.718 1.00 . B B . 15 LEU CB 1 1 11 8375 2 2 15 LEU CD1 C -3.558 -0.956 2.405 1.00 . B B . 15 LEU CD1 1 1 11 8376 2 2 15 LEU CD2 C -2.495 0.438 0.688 1.00 . B B . 15 LEU CD2 1 1 11 8377 2 2 15 LEU CG C -2.721 0.311 2.207 1.00 . B B . 15 LEU CG 1 1 11 8378 2 2 15 LEU H H -1.343 2.055 3.982 1.00 . B B . 15 LEU H 1 1 11 8379 2 2 15 LEU HA H -2.509 3.047 1.577 1.00 . B B . 15 LEU HA 1 1 11 8380 2 2 15 LEU HB2 H -3.854 1.301 3.751 1.00 . B B . 15 LEU HB2 1 1 11 8381 2 2 15 LEU HB3 H -4.502 1.518 2.142 1.00 . B B . 15 LEU HB3 1 1 11 8382 2 2 15 LEU HD11 H -3.833 -1.073 3.442 1.00 . B B . 15 LEU HD11 1 1 11 8383 2 2 15 LEU HD12 H -4.468 -0.915 1.826 1.00 . B B . 15 LEU HD12 1 1 11 8384 2 2 15 LEU HD13 H -3.006 -1.833 2.111 1.00 . B B . 15 LEU HD13 1 1 11 8385 2 2 15 LEU HD21 H -2.064 1.393 0.435 1.00 . B B . 15 LEU HD21 1 1 11 8386 2 2 15 LEU HD22 H -1.814 -0.318 0.342 1.00 . B B . 15 LEU HD22 1 1 11 8387 2 2 15 LEU HD23 H -3.418 0.315 0.146 1.00 . B B . 15 LEU HD23 1 1 11 8388 2 2 15 LEU HG H -1.780 0.249 2.743 1.00 . B B . 15 LEU HG 1 1 11 8389 2 2 15 LEU N N -1.658 2.853 3.513 1.00 . B B . 15 LEU N 1 1 11 8390 2 2 15 LEU O O -4.091 4.812 2.211 1.00 . B B . 15 LEU O 1 1 11 8391 2 2 16 TYR C C -4.257 6.694 4.154 1.00 . B B . 16 TYR C 1 1 11 8392 2 2 16 TYR CA C -4.800 5.383 4.794 1.00 . B B . 16 TYR CA 1 1 11 8393 2 2 16 TYR CB C -4.715 5.575 6.325 1.00 . B B . 16 TYR CB 1 1 11 8394 2 2 16 TYR CD1 C -5.696 3.232 6.708 1.00 . B B . 16 TYR CD1 1 1 11 8395 2 2 16 TYR CD2 C -4.707 4.437 8.499 1.00 . B B . 16 TYR CD2 1 1 11 8396 2 2 16 TYR CE1 C -5.956 2.187 7.578 1.00 . B B . 16 TYR CE1 1 1 11 8397 2 2 16 TYR CE2 C -4.969 3.396 9.349 1.00 . B B . 16 TYR CE2 1 1 11 8398 2 2 16 TYR CG C -5.064 4.366 7.176 1.00 . B B . 16 TYR CG 1 1 11 8399 2 2 16 TYR CZ C -5.589 2.272 8.898 1.00 . B B . 16 TYR CZ 1 1 11 8400 2 2 16 TYR H H -3.593 3.529 4.937 1.00 . B B . 16 TYR H 1 1 11 8401 2 2 16 TYR HA H -5.823 5.266 4.469 1.00 . B B . 16 TYR HA 1 1 11 8402 2 2 16 TYR HB2 H -3.715 5.878 6.599 1.00 . B B . 16 TYR HB2 1 1 11 8403 2 2 16 TYR HB3 H -5.383 6.373 6.614 1.00 . B B . 16 TYR HB3 1 1 11 8404 2 2 16 TYR HD1 H -5.978 3.158 5.671 1.00 . B B . 16 TYR HD1 1 1 11 8405 2 2 16 TYR HD2 H -4.209 5.313 8.889 1.00 . B B . 16 TYR HD2 1 1 11 8406 2 2 16 TYR HE1 H -6.448 1.289 7.246 1.00 . B B . 16 TYR HE1 1 1 11 8407 2 2 16 TYR HE2 H -4.679 3.458 10.389 1.00 . B B . 16 TYR HE2 1 1 11 8408 2 2 16 TYR HH H -4.931 1.243 10.219 1.00 . B B . 16 TYR HH 1 1 11 8409 2 2 16 TYR N N -3.964 4.201 4.322 1.00 . B B . 16 TYR N 1 1 11 8410 2 2 16 TYR O O -4.969 7.407 3.479 1.00 . B B . 16 TYR O 1 1 11 8411 2 2 16 TYR OH O -5.803 1.239 9.774 1.00 . B B . 16 TYR OH 1 1 11 8412 2 2 17 LEU C C -2.611 8.412 2.423 1.00 . B B . 17 LEU C 1 1 11 8413 2 2 17 LEU CA C -2.258 8.150 3.912 1.00 . B B . 17 LEU CA 1 1 11 8414 2 2 17 LEU CB C -0.745 7.840 4.167 1.00 . B B . 17 LEU CB 1 1 11 8415 2 2 17 LEU CD1 C 1.553 8.685 4.432 1.00 . B B . 17 LEU CD1 1 1 11 8416 2 2 17 LEU CD2 C 0.461 9.001 2.276 1.00 . B B . 17 LEU CD2 1 1 11 8417 2 2 17 LEU CG C 0.202 8.996 3.790 1.00 . B B . 17 LEU CG 1 1 11 8418 2 2 17 LEU H H -2.544 6.283 5.002 1.00 . B B . 17 LEU H 1 1 11 8419 2 2 17 LEU HA H -2.574 9.025 4.462 1.00 . B B . 17 LEU HA 1 1 11 8420 2 2 17 LEU HB2 H -0.624 7.600 5.214 1.00 . B B . 17 LEU HB2 1 1 11 8421 2 2 17 LEU HB3 H -0.456 6.972 3.599 1.00 . B B . 17 LEU HB3 1 1 11 8422 2 2 17 LEU HD11 H 1.938 7.743 4.070 1.00 . B B . 17 LEU HD11 1 1 11 8423 2 2 17 LEU HD12 H 2.266 9.464 4.198 1.00 . B B . 17 LEU HD12 1 1 11 8424 2 2 17 LEU HD13 H 1.452 8.626 5.505 1.00 . B B . 17 LEU HD13 1 1 11 8425 2 2 17 LEU HD21 H 0.880 8.059 1.953 1.00 . B B . 17 LEU HD21 1 1 11 8426 2 2 17 LEU HD22 H -0.447 9.178 1.720 1.00 . B B . 17 LEU HD22 1 1 11 8427 2 2 17 LEU HD23 H 1.154 9.790 2.027 1.00 . B B . 17 LEU HD23 1 1 11 8428 2 2 17 LEU HG H -0.192 9.951 4.124 1.00 . B B . 17 LEU HG 1 1 11 8429 2 2 17 LEU N N -2.999 6.939 4.430 1.00 . B B . 17 LEU N 1 1 11 8430 2 2 17 LEU O O -2.846 9.528 2.001 1.00 . B B . 17 LEU O 1 1 11 8431 2 2 18 VAL C C -4.499 7.539 -0.084 1.00 . B B . 18 VAL C 1 1 11 8432 2 2 18 VAL CA C -2.947 7.410 0.201 1.00 . B B . 18 VAL CA 1 1 11 8433 2 2 18 VAL CB C -2.355 6.125 -0.448 1.00 . B B . 18 VAL CB 1 1 11 8434 2 2 18 VAL CG1 C -2.582 6.152 -1.968 1.00 . B B . 18 VAL CG1 1 1 11 8435 2 2 18 VAL CG2 C -0.840 6.081 -0.217 1.00 . B B . 18 VAL CG2 1 1 11 8436 2 2 18 VAL H H -2.364 6.504 2.151 1.00 . B B . 18 VAL H 1 1 11 8437 2 2 18 VAL HA H -2.447 8.247 -0.254 1.00 . B B . 18 VAL HA 1 1 11 8438 2 2 18 VAL HB H -2.813 5.253 0.004 1.00 . B B . 18 VAL HB 1 1 11 8439 2 2 18 VAL HG11 H -2.123 7.023 -2.413 1.00 . B B . 18 VAL HG11 1 1 11 8440 2 2 18 VAL HG12 H -2.154 5.277 -2.430 1.00 . B B . 18 VAL HG12 1 1 11 8441 2 2 18 VAL HG13 H -3.639 6.178 -2.199 1.00 . B B . 18 VAL HG13 1 1 11 8442 2 2 18 VAL HG21 H -0.372 6.959 -0.638 1.00 . B B . 18 VAL HG21 1 1 11 8443 2 2 18 VAL HG22 H -0.630 6.054 0.844 1.00 . B B . 18 VAL HG22 1 1 11 8444 2 2 18 VAL HG23 H -0.416 5.202 -0.673 1.00 . B B . 18 VAL HG23 1 1 11 8445 2 2 18 VAL N N -2.612 7.341 1.683 1.00 . B B . 18 VAL N 1 1 11 8446 2 2 18 VAL O O -4.987 8.407 -0.785 1.00 . B B . 18 VAL O 1 1 11 8447 2 2 19 CYS C C -7.712 7.619 0.581 1.00 . B B . 19 CYS C 1 1 11 8448 2 2 19 CYS CA C -6.705 6.422 0.445 1.00 . B B . 19 CYS CA 1 1 11 8449 2 2 19 CYS CB C -6.894 5.327 1.523 1.00 . B B . 19 CYS CB 1 1 11 8450 2 2 19 CYS H H -4.731 5.959 1.013 1.00 . B B . 19 CYS H 1 1 11 8451 2 2 19 CYS HA H -6.939 5.970 -0.510 1.00 . B B . 19 CYS HA 1 1 11 8452 2 2 19 CYS HB2 H -6.201 5.568 2.310 1.00 . B B . 19 CYS HB2 1 1 11 8453 2 2 19 CYS HB3 H -7.860 5.325 1.941 1.00 . B B . 19 CYS HB3 1 1 11 8454 2 2 19 CYS HG H -7.244 3.259 0.598 1.00 . B B . 19 CYS HG 1 1 11 8455 2 2 19 CYS N N -5.215 6.621 0.485 1.00 . B B . 19 CYS N 1 1 11 8456 2 2 19 CYS O O -8.467 7.740 1.539 1.00 . B B . 19 CYS O 1 1 11 8457 2 2 19 CYS SG S -6.508 3.613 1.104 1.00 . B B . 19 CYS SG 1 1 11 8458 2 2 20 GLY C C -10.157 9.374 -0.632 1.00 . B B . 20 GLY C 1 1 11 8459 2 2 20 GLY CA C -8.663 9.677 -0.377 1.00 . B B . 20 GLY CA 1 1 11 8460 2 2 20 GLY H H -7.102 8.314 -1.134 1.00 . B B . 20 GLY H 1 1 11 8461 2 2 20 GLY HA2 H -8.587 10.165 0.584 1.00 . B B . 20 GLY HA2 1 1 11 8462 2 2 20 GLY HA3 H -8.342 10.373 -1.136 1.00 . B B . 20 GLY HA3 1 1 11 8463 2 2 20 GLY N N -7.730 8.479 -0.393 1.00 . B B . 20 GLY N 1 1 11 8464 2 2 20 GLY O O -11.028 9.897 0.039 1.00 . B B . 20 GLY O 1 1 11 8465 2 2 21 GLU C C -12.320 6.699 -1.553 1.00 . B B . 21 GLU C 1 1 11 8466 2 2 21 GLU CA C -11.815 8.110 -1.992 1.00 . B B . 21 GLU CA 1 1 11 8467 2 2 21 GLU CB C -11.859 8.228 -3.540 1.00 . B B . 21 GLU CB 1 1 11 8468 2 2 21 GLU CD C -10.024 6.370 -3.669 1.00 . B B . 21 GLU CD 1 1 11 8469 2 2 21 GLU CG C -10.507 7.705 -4.210 1.00 . B B . 21 GLU CG 1 1 11 8470 2 2 21 GLU H H -9.663 8.136 -2.069 1.00 . B B . 21 GLU H 1 1 11 8471 2 2 21 GLU HA H -12.527 8.819 -1.598 1.00 . B B . 21 GLU HA 1 1 11 8472 2 2 21 GLU HB2 H -12.684 7.637 -3.916 1.00 . B B . 21 GLU HB2 1 1 11 8473 2 2 21 GLU HB3 H -12.028 9.260 -3.811 1.00 . B B . 21 GLU HB3 1 1 11 8474 2 2 21 GLU HG2 H -10.671 7.550 -5.264 1.00 . B B . 21 GLU HG2 1 1 11 8475 2 2 21 GLU HG3 H -9.704 8.415 -4.101 1.00 . B B . 21 GLU HG3 1 1 11 8476 2 2 21 GLU N N -10.420 8.532 -1.579 1.00 . B B . 21 GLU N 1 1 11 8477 2 2 21 GLU O O -13.500 6.472 -1.353 1.00 . B B . 21 GLU O 1 1 11 8478 2 2 21 GLU OE1 O -10.588 5.367 -4.054 1.00 . B B . 21 GLU OE1 1 1 11 8479 2 2 21 GLU OE2 O -9.106 6.447 -2.870 1.00 . B B . 21 GLU OE2 1 1 11 8480 2 2 22 ARG C C -12.618 3.748 -0.094 1.00 . B B . 22 ARG C 1 1 11 8481 2 2 22 ARG CA C -11.542 4.387 -1.009 1.00 . B B . 22 ARG CA 1 1 11 8482 2 2 22 ARG CB C -10.122 3.957 -0.469 1.00 . B B . 22 ARG CB 1 1 11 8483 2 2 22 ARG CD C -10.161 5.402 1.647 1.00 . B B . 22 ARG CD 1 1 11 8484 2 2 22 ARG CG C -10.033 3.987 1.097 1.00 . B B . 22 ARG CG 1 1 11 8485 2 2 22 ARG CZ C -12.017 6.949 1.479 1.00 . B B . 22 ARG CZ 1 1 11 8486 2 2 22 ARG H H -10.471 6.089 -1.539 1.00 . B B . 22 ARG H 1 1 11 8487 2 2 22 ARG HA H -11.807 3.946 -1.950 1.00 . B B . 22 ARG HA 1 1 11 8488 2 2 22 ARG HB2 H -9.869 2.962 -0.792 1.00 . B B . 22 ARG HB2 1 1 11 8489 2 2 22 ARG HB3 H -9.368 4.611 -0.897 1.00 . B B . 22 ARG HB3 1 1 11 8490 2 2 22 ARG HD2 H -9.679 5.516 2.613 1.00 . B B . 22 ARG HD2 1 1 11 8491 2 2 22 ARG HD3 H -9.670 6.034 0.914 1.00 . B B . 22 ARG HD3 1 1 11 8492 2 2 22 ARG HE H -12.288 5.127 1.993 1.00 . B B . 22 ARG HE 1 1 11 8493 2 2 22 ARG HG2 H -10.788 3.352 1.540 1.00 . B B . 22 ARG HG2 1 1 11 8494 2 2 22 ARG HG3 H -9.081 3.574 1.396 1.00 . B B . 22 ARG HG3 1 1 11 8495 2 2 22 ARG HH11 H -10.333 7.756 1.980 1.00 . B B . 22 ARG HH11 1 1 11 8496 2 2 22 ARG HH12 H -11.557 8.861 1.480 1.00 . B B . 22 ARG HH12 1 1 11 8497 2 2 22 ARG HH21 H -13.660 6.184 0.877 1.00 . B B . 22 ARG HH21 1 1 11 8498 2 2 22 ARG HH22 H -13.608 7.911 0.852 1.00 . B B . 22 ARG HH22 1 1 11 8499 2 2 22 ARG N N -11.392 5.816 -1.401 1.00 . B B . 22 ARG N 1 1 11 8500 2 2 22 ARG NE N -11.604 5.784 1.739 1.00 . B B . 22 ARG NE 1 1 11 8501 2 2 22 ARG NH1 N -11.260 7.931 1.659 1.00 . B B . 22 ARG NH1 1 1 11 8502 2 2 22 ARG NH2 N -13.179 7.044 1.043 1.00 . B B . 22 ARG NH2 1 1 11 8503 2 2 22 ARG O O -13.389 4.320 0.659 1.00 . B B . 22 ARG O 1 1 11 8504 2 2 23 GLY C C -12.248 0.275 0.825 1.00 . B B . 23 GLY C 1 1 11 8505 2 2 23 GLY CA C -13.267 1.323 0.321 1.00 . B B . 23 GLY CA 1 1 11 8506 2 2 23 GLY H H -11.801 2.281 -0.954 1.00 . B B . 23 GLY H 1 1 11 8507 2 2 23 GLY HA2 H -13.845 1.663 1.170 1.00 . B B . 23 GLY HA2 1 1 11 8508 2 2 23 GLY HA3 H -13.913 0.856 -0.407 1.00 . B B . 23 GLY HA3 1 1 11 8509 2 2 23 GLY N N -12.501 2.468 -0.294 1.00 . B B . 23 GLY N 1 1 11 8510 2 2 23 GLY O O -12.451 -0.332 1.849 1.00 . B B . 23 GLY O 1 1 11 8511 2 2 24 PHE C C -10.086 -2.136 -0.578 1.00 . B B . 24 PHE C 1 1 11 8512 2 2 24 PHE CA C -10.001 -0.784 0.199 1.00 . B B . 24 PHE CA 1 1 11 8513 2 2 24 PHE CB C -9.727 -1.130 1.722 1.00 . B B . 24 PHE CB 1 1 11 8514 2 2 24 PHE CD1 C -7.798 0.298 2.575 1.00 . B B . 24 PHE CD1 1 1 11 8515 2 2 24 PHE CD2 C -9.998 0.951 3.168 1.00 . B B . 24 PHE CD2 1 1 11 8516 2 2 24 PHE CE1 C -7.294 1.377 3.278 1.00 . B B . 24 PHE CE1 1 1 11 8517 2 2 24 PHE CE2 C -9.502 2.027 3.868 1.00 . B B . 24 PHE CE2 1 1 11 8518 2 2 24 PHE CG C -9.162 0.072 2.512 1.00 . B B . 24 PHE CG 1 1 11 8519 2 2 24 PHE CZ C -8.148 2.242 3.925 1.00 . B B . 24 PHE CZ 1 1 11 8520 2 2 24 PHE H H -11.206 0.697 -0.765 1.00 . B B . 24 PHE H 1 1 11 8521 2 2 24 PHE HA H -9.137 -0.262 -0.187 1.00 . B B . 24 PHE HA 1 1 11 8522 2 2 24 PHE HB2 H -10.621 -1.485 2.215 1.00 . B B . 24 PHE HB2 1 1 11 8523 2 2 24 PHE HB3 H -9.000 -1.924 1.771 1.00 . B B . 24 PHE HB3 1 1 11 8524 2 2 24 PHE HD1 H -7.111 -0.375 2.078 1.00 . B B . 24 PHE HD1 1 1 11 8525 2 2 24 PHE HD2 H -11.062 0.790 3.143 1.00 . B B . 24 PHE HD2 1 1 11 8526 2 2 24 PHE HE1 H -6.229 1.548 3.328 1.00 . B B . 24 PHE HE1 1 1 11 8527 2 2 24 PHE HE2 H -10.182 2.701 4.374 1.00 . B B . 24 PHE HE2 1 1 11 8528 2 2 24 PHE HZ H -7.760 3.089 4.474 1.00 . B B . 24 PHE HZ 1 1 11 8529 2 2 24 PHE N N -11.205 0.135 0.035 1.00 . B B . 24 PHE N 1 1 11 8530 2 2 24 PHE O O -11.119 -2.759 -0.681 1.00 . B B . 24 PHE O 1 1 11 8531 2 2 25 PHE C C -8.141 -4.979 -1.083 1.00 . B B . 25 PHE C 1 1 11 8532 2 2 25 PHE CA C -8.878 -3.857 -1.888 1.00 . B B . 25 PHE CA 1 1 11 8533 2 2 25 PHE CB C -8.161 -3.423 -3.204 1.00 . B B . 25 PHE CB 1 1 11 8534 2 2 25 PHE CD1 C -7.127 -5.467 -4.331 1.00 . B B . 25 PHE CD1 1 1 11 8535 2 2 25 PHE CD2 C -8.996 -4.435 -5.358 1.00 . B B . 25 PHE CD2 1 1 11 8536 2 2 25 PHE CE1 C -7.073 -6.395 -5.345 1.00 . B B . 25 PHE CE1 1 1 11 8537 2 2 25 PHE CE2 C -8.948 -5.363 -6.381 1.00 . B B . 25 PHE CE2 1 1 11 8538 2 2 25 PHE CG C -8.086 -4.476 -4.323 1.00 . B B . 25 PHE CG 1 1 11 8539 2 2 25 PHE CZ C -7.984 -6.346 -6.374 1.00 . B B . 25 PHE CZ 1 1 11 8540 2 2 25 PHE H H -8.169 -2.019 -0.997 1.00 . B B . 25 PHE H 1 1 11 8541 2 2 25 PHE HA H -9.871 -4.224 -2.122 1.00 . B B . 25 PHE HA 1 1 11 8542 2 2 25 PHE HB2 H -8.633 -2.538 -3.608 1.00 . B B . 25 PHE HB2 1 1 11 8543 2 2 25 PHE HB3 H -7.150 -3.169 -2.943 1.00 . B B . 25 PHE HB3 1 1 11 8544 2 2 25 PHE HD1 H -6.398 -5.524 -3.540 1.00 . B B . 25 PHE HD1 1 1 11 8545 2 2 25 PHE HD2 H -9.754 -3.665 -5.369 1.00 . B B . 25 PHE HD2 1 1 11 8546 2 2 25 PHE HE1 H -6.311 -7.163 -5.324 1.00 . B B . 25 PHE HE1 1 1 11 8547 2 2 25 PHE HE2 H -9.666 -5.313 -7.187 1.00 . B B . 25 PHE HE2 1 1 11 8548 2 2 25 PHE HZ H -7.941 -7.075 -7.171 1.00 . B B . 25 PHE HZ 1 1 11 8549 2 2 25 PHE N N -8.972 -2.566 -1.103 1.00 . B B . 25 PHE N 1 1 11 8550 2 2 25 PHE O O -7.301 -5.713 -1.564 1.00 . B B . 25 PHE O 1 1 11 8551 2 2 26 TYR C C -7.998 -7.614 0.436 1.00 . B B . 26 TYR C 1 1 11 8552 2 2 26 TYR CA C -7.787 -6.183 0.990 1.00 . B B . 26 TYR CA 1 1 11 8553 2 2 26 TYR CB C -8.304 -6.037 2.455 1.00 . B B . 26 TYR CB 1 1 11 8554 2 2 26 TYR CD1 C -6.298 -4.625 3.084 1.00 . B B . 26 TYR CD1 1 1 11 8555 2 2 26 TYR CD2 C -8.458 -3.731 3.499 1.00 . B B . 26 TYR CD2 1 1 11 8556 2 2 26 TYR CE1 C -5.721 -3.474 3.584 1.00 . B B . 26 TYR CE1 1 1 11 8557 2 2 26 TYR CE2 C -7.870 -2.583 3.998 1.00 . B B . 26 TYR CE2 1 1 11 8558 2 2 26 TYR CG C -7.675 -4.762 3.035 1.00 . B B . 26 TYR CG 1 1 11 8559 2 2 26 TYR CZ C -6.508 -2.451 4.039 1.00 . B B . 26 TYR CZ 1 1 11 8560 2 2 26 TYR H H -9.152 -4.531 0.555 1.00 . B B . 26 TYR H 1 1 11 8561 2 2 26 TYR HA H -6.723 -6.002 0.959 1.00 . B B . 26 TYR HA 1 1 11 8562 2 2 26 TYR HB2 H -9.383 -5.954 2.471 1.00 . B B . 26 TYR HB2 1 1 11 8563 2 2 26 TYR HB3 H -8.012 -6.884 3.061 1.00 . B B . 26 TYR HB3 1 1 11 8564 2 2 26 TYR HD1 H -5.666 -5.427 2.734 1.00 . B B . 26 TYR HD1 1 1 11 8565 2 2 26 TYR HD2 H -9.537 -3.819 3.474 1.00 . B B . 26 TYR HD2 1 1 11 8566 2 2 26 TYR HE1 H -4.646 -3.365 3.623 1.00 . B B . 26 TYR HE1 1 1 11 8567 2 2 26 TYR HE2 H -8.482 -1.777 4.367 1.00 . B B . 26 TYR HE2 1 1 11 8568 2 2 26 TYR HH H -6.640 -0.640 4.572 1.00 . B B . 26 TYR HH 1 1 11 8569 2 2 26 TYR N N -8.469 -5.117 0.172 1.00 . B B . 26 TYR N 1 1 11 8570 2 2 26 TYR O O -8.990 -8.271 0.678 1.00 . B B . 26 TYR O 1 1 11 8571 2 2 26 TYR OH O -5.938 -1.299 4.521 1.00 . B B . 26 TYR OH 1 1 11 8572 2 2 27 THR C C -6.497 -10.474 0.038 1.00 . B B . 27 THR C 1 1 11 8573 2 2 27 THR CA C -7.026 -9.403 -0.953 1.00 . B B . 27 THR CA 1 1 11 8574 2 2 27 THR CB C -6.109 -9.404 -2.218 1.00 . B B . 27 THR CB 1 1 11 8575 2 2 27 THR CG2 C -6.827 -10.006 -3.400 1.00 . B B . 27 THR CG2 1 1 11 8576 2 2 27 THR H H -6.261 -7.434 -0.463 1.00 . B B . 27 THR H 1 1 11 8577 2 2 27 THR HA H -8.037 -9.669 -1.224 1.00 . B B . 27 THR HA 1 1 11 8578 2 2 27 THR HB H -5.132 -9.846 -2.059 1.00 . B B . 27 THR HB 1 1 11 8579 2 2 27 THR HG1 H -6.610 -7.453 -2.350 1.00 . B B . 27 THR HG1 1 1 11 8580 2 2 27 THR HG21 H -7.109 -11.027 -3.193 1.00 . B B . 27 THR HG21 1 1 11 8581 2 2 27 THR HG22 H -7.712 -9.430 -3.635 1.00 . B B . 27 THR HG22 1 1 11 8582 2 2 27 THR HG23 H -6.173 -9.985 -4.258 1.00 . B B . 27 THR HG23 1 1 11 8583 2 2 27 THR N N -7.017 -8.035 -0.313 1.00 . B B . 27 THR N 1 1 11 8584 2 2 27 THR O O -5.628 -11.266 -0.266 1.00 . B B . 27 THR O 1 1 11 8585 2 2 27 THR OG1 O -5.977 -8.083 -2.727 1.00 . B B . 27 THR OG1 1 1 11 8586 2 2 28 PRO C C -4.829 -10.980 2.546 1.00 . B B . 28 PRO C 1 1 11 8587 2 2 28 PRO CA C -6.350 -10.721 2.518 1.00 . B B . 28 PRO CA 1 1 11 8588 2 2 28 PRO CB C -7.168 -11.880 3.140 1.00 . B B . 28 PRO CB 1 1 11 8589 2 2 28 PRO CD C -8.400 -11.175 1.201 1.00 . B B . 28 PRO CD 1 1 11 8590 2 2 28 PRO CG C -8.596 -11.541 2.678 1.00 . B B . 28 PRO CG 1 1 11 8591 2 2 28 PRO HA H -6.447 -9.845 3.115 1.00 . B B . 28 PRO HA 1 1 11 8592 2 2 28 PRO HB2 H -6.854 -12.844 2.764 1.00 . B B . 28 PRO HB2 1 1 11 8593 2 2 28 PRO HB3 H -7.099 -11.874 4.221 1.00 . B B . 28 PRO HB3 1 1 11 8594 2 2 28 PRO HD2 H -8.358 -12.059 0.578 1.00 . B B . 28 PRO HD2 1 1 11 8595 2 2 28 PRO HD3 H -9.185 -10.516 0.854 1.00 . B B . 28 PRO HD3 1 1 11 8596 2 2 28 PRO HG2 H -9.263 -12.386 2.781 1.00 . B B . 28 PRO HG2 1 1 11 8597 2 2 28 PRO HG3 H -9.001 -10.696 3.221 1.00 . B B . 28 PRO HG3 1 1 11 8598 2 2 28 PRO N N -7.079 -10.465 1.214 1.00 . B B . 28 PRO N 1 1 11 8599 2 2 28 PRO O O -4.073 -10.275 3.182 1.00 . B B . 28 PRO O 1 1 11 8600 2 2 29 LYS C C -1.903 -11.708 2.338 1.00 . B B . 29 LYS C 1 1 11 8601 2 2 29 LYS CA C -3.071 -12.523 1.663 1.00 . B B . 29 LYS CA 1 1 11 8602 2 2 29 LYS CB C -2.932 -12.643 0.114 1.00 . B B . 29 LYS CB 1 1 11 8603 2 2 29 LYS CD C -0.983 -12.304 -1.484 1.00 . B B . 29 LYS CD 1 1 11 8604 2 2 29 LYS CE C -0.753 -10.857 -1.029 1.00 . B B . 29 LYS CE 1 1 11 8605 2 2 29 LYS CG C -1.531 -13.181 -0.317 1.00 . B B . 29 LYS CG 1 1 11 8606 2 2 29 LYS H H -5.246 -12.411 1.409 1.00 . B B . 29 LYS H 1 1 11 8607 2 2 29 LYS HA H -3.023 -13.516 2.088 1.00 . B B . 29 LYS HA 1 1 11 8608 2 2 29 LYS HB2 H -3.691 -13.331 -0.238 1.00 . B B . 29 LYS HB2 1 1 11 8609 2 2 29 LYS HB3 H -3.169 -11.686 -0.327 1.00 . B B . 29 LYS HB3 1 1 11 8610 2 2 29 LYS HD2 H -0.034 -12.708 -1.819 1.00 . B B . 29 LYS HD2 1 1 11 8611 2 2 29 LYS HD3 H -1.669 -12.313 -2.319 1.00 . B B . 29 LYS HD3 1 1 11 8612 2 2 29 LYS HE2 H -1.642 -10.392 -0.619 1.00 . B B . 29 LYS HE2 1 1 11 8613 2 2 29 LYS HE3 H 0.021 -10.856 -0.266 1.00 . B B . 29 LYS HE3 1 1 11 8614 2 2 29 LYS HG2 H -0.822 -13.196 0.502 1.00 . B B . 29 LYS HG2 1 1 11 8615 2 2 29 LYS HG3 H -1.634 -14.201 -0.667 1.00 . B B . 29 LYS HG3 1 1 11 8616 2 2 29 LYS HZ1 H 0.005 -10.762 -2.971 1.00 . B B . 29 LYS HZ1 1 1 11 8617 2 2 29 LYS HZ2 H -0.831 -9.321 -2.550 1.00 . B B . 29 LYS HZ2 1 1 11 8618 2 2 29 LYS HZ3 H 0.671 -9.719 -1.984 1.00 . B B . 29 LYS HZ3 1 1 11 8619 2 2 29 LYS N N -4.476 -12.001 1.844 1.00 . B B . 29 LYS N 1 1 11 8620 2 2 29 LYS NZ N -0.266 -10.113 -2.205 1.00 . B B . 29 LYS NZ 1 1 11 8621 2 2 29 LYS O O -1.036 -11.167 1.681 1.00 . B B . 29 LYS O 1 1 11 8622 2 2 30 THR C C -0.136 -11.711 5.481 1.00 . B B . 30 THR C 1 1 11 8623 2 2 30 THR CA C -0.833 -10.879 4.395 1.00 . B B . 30 THR CA 1 1 11 8624 2 2 30 THR CB C -1.454 -9.629 5.044 1.00 . B B . 30 THR CB 1 1 11 8625 2 2 30 THR CG2 C -2.405 -9.959 6.183 1.00 . B B . 30 THR CG2 1 1 11 8626 2 2 30 THR H H -2.632 -12.074 4.121 1.00 . B B . 30 THR H 1 1 11 8627 2 2 30 THR HA H -0.065 -10.546 3.717 1.00 . B B . 30 THR HA 1 1 11 8628 2 2 30 THR HB H -1.872 -8.951 4.306 1.00 . B B . 30 THR HB 1 1 11 8629 2 2 30 THR HG1 H -0.667 -8.861 6.646 1.00 . B B . 30 THR HG1 1 1 11 8630 2 2 30 THR HG21 H -1.911 -10.518 6.964 1.00 . B B . 30 THR HG21 1 1 11 8631 2 2 30 THR HG22 H -2.812 -9.049 6.598 1.00 . B B . 30 THR HG22 1 1 11 8632 2 2 30 THR HG23 H -3.220 -10.552 5.796 1.00 . B B . 30 THR HG23 1 1 11 8633 2 2 30 THR N N -1.908 -11.633 3.636 1.00 . B B . 30 THR N 1 1 11 8634 2 2 30 THR O O -0.697 -12.647 6.023 1.00 . B B . 30 THR O 1 1 11 8635 2 2 30 THR OG1 O -0.374 -9.033 5.744 1.00 . B B . 30 THR OG1 1 1 12 8636 1 1 1 GLY C C -0.216 -6.827 -0.907 1.00 . A A . 1 GLY C 1 1 12 8637 1 1 1 GLY CA C -1.238 -7.873 -1.323 1.00 . A A . 1 GLY CA 1 1 12 8638 1 1 1 GLY HA2 H -0.694 -8.770 -1.578 1.00 . A A . 1 GLY HA2 1 1 12 8639 1 1 1 GLY HA3 H -1.747 -7.512 -2.201 1.00 . A A . 1 GLY HA3 1 1 12 8640 1 1 1 GLY N N -2.236 -8.188 -0.239 1.00 . A A . 1 GLY N 1 1 12 8641 1 1 1 GLY O O 0.969 -7.083 -0.949 1.00 . A A . 1 GLY O 1 1 12 8642 1 1 2 ILE C C 1.590 -4.972 0.508 1.00 . A A . 2 ILE C 1 1 12 8643 1 1 2 ILE CA C 0.221 -4.546 -0.089 1.00 . A A . 2 ILE CA 1 1 12 8644 1 1 2 ILE CB C -0.545 -3.641 0.969 1.00 . A A . 2 ILE CB 1 1 12 8645 1 1 2 ILE CD1 C -1.964 -3.518 3.073 1.00 . A A . 2 ILE CD1 1 1 12 8646 1 1 2 ILE CG1 C -1.399 -4.469 1.980 1.00 . A A . 2 ILE CG1 1 1 12 8647 1 1 2 ILE CG2 C -1.457 -2.671 0.223 1.00 . A A . 2 ILE CG2 1 1 12 8648 1 1 2 ILE H H -1.660 -5.557 -0.555 1.00 . A A . 2 ILE H 1 1 12 8649 1 1 2 ILE HA H 0.457 -3.945 -0.954 1.00 . A A . 2 ILE HA 1 1 12 8650 1 1 2 ILE HB H 0.174 -3.060 1.528 1.00 . A A . 2 ILE HB 1 1 12 8651 1 1 2 ILE HD11 H -1.161 -3.006 3.583 1.00 . A A . 2 ILE HD11 1 1 12 8652 1 1 2 ILE HD12 H -2.612 -2.778 2.637 1.00 . A A . 2 ILE HD12 1 1 12 8653 1 1 2 ILE HD13 H -2.539 -4.056 3.810 1.00 . A A . 2 ILE HD13 1 1 12 8654 1 1 2 ILE HG12 H -2.220 -4.943 1.458 1.00 . A A . 2 ILE HG12 1 1 12 8655 1 1 2 ILE HG13 H -0.829 -5.248 2.459 1.00 . A A . 2 ILE HG13 1 1 12 8656 1 1 2 ILE HG21 H -0.884 -2.079 -0.477 1.00 . A A . 2 ILE HG21 1 1 12 8657 1 1 2 ILE HG22 H -2.203 -3.238 -0.301 1.00 . A A . 2 ILE HG22 1 1 12 8658 1 1 2 ILE HG23 H -1.949 -1.996 0.903 1.00 . A A . 2 ILE HG23 1 1 12 8659 1 1 2 ILE N N -0.691 -5.671 -0.533 1.00 . A A . 2 ILE N 1 1 12 8660 1 1 2 ILE O O 2.634 -4.673 -0.031 1.00 . A A . 2 ILE O 1 1 12 8661 1 1 3 VAL C C 3.950 -6.662 1.574 1.00 . A A . 3 VAL C 1 1 12 8662 1 1 3 VAL CA C 2.714 -6.185 2.370 1.00 . A A . 3 VAL CA 1 1 12 8663 1 1 3 VAL CB C 2.164 -7.324 3.294 1.00 . A A . 3 VAL CB 1 1 12 8664 1 1 3 VAL CG1 C 1.247 -6.723 4.375 1.00 . A A . 3 VAL CG1 1 1 12 8665 1 1 3 VAL CG2 C 1.286 -8.297 2.471 1.00 . A A . 3 VAL CG2 1 1 12 8666 1 1 3 VAL H H 0.640 -5.879 1.951 1.00 . A A . 3 VAL H 1 1 12 8667 1 1 3 VAL HA H 3.086 -5.368 2.965 1.00 . A A . 3 VAL HA 1 1 12 8668 1 1 3 VAL HB H 2.981 -7.879 3.754 1.00 . A A . 3 VAL HB 1 1 12 8669 1 1 3 VAL HG11 H 1.795 -6.019 4.982 1.00 . A A . 3 VAL HG11 1 1 12 8670 1 1 3 VAL HG12 H 0.397 -6.222 3.940 1.00 . A A . 3 VAL HG12 1 1 12 8671 1 1 3 VAL HG13 H 0.889 -7.519 5.012 1.00 . A A . 3 VAL HG13 1 1 12 8672 1 1 3 VAL HG21 H 0.451 -7.793 2.016 1.00 . A A . 3 VAL HG21 1 1 12 8673 1 1 3 VAL HG22 H 1.837 -8.782 1.680 1.00 . A A . 3 VAL HG22 1 1 12 8674 1 1 3 VAL HG23 H 0.918 -9.080 3.117 1.00 . A A . 3 VAL HG23 1 1 12 8675 1 1 3 VAL N N 1.523 -5.666 1.606 1.00 . A A . 3 VAL N 1 1 12 8676 1 1 3 VAL O O 4.739 -5.855 1.130 1.00 . A A . 3 VAL O 1 1 12 8677 1 1 4 GLU C C 5.941 -7.701 -0.499 1.00 . A A . 4 GLU C 1 1 12 8678 1 1 4 GLU CA C 5.308 -8.488 0.643 1.00 . A A . 4 GLU CA 1 1 12 8679 1 1 4 GLU CB C 4.840 -9.892 0.189 1.00 . A A . 4 GLU CB 1 1 12 8680 1 1 4 GLU CD C 4.608 -10.243 2.752 1.00 . A A . 4 GLU CD 1 1 12 8681 1 1 4 GLU CG C 4.958 -10.887 1.414 1.00 . A A . 4 GLU CG 1 1 12 8682 1 1 4 GLU H H 3.517 -8.573 1.810 1.00 . A A . 4 GLU H 1 1 12 8683 1 1 4 GLU HA H 6.100 -8.527 1.365 1.00 . A A . 4 GLU HA 1 1 12 8684 1 1 4 GLU HB2 H 3.810 -9.845 -0.136 1.00 . A A . 4 GLU HB2 1 1 12 8685 1 1 4 GLU HB3 H 5.445 -10.250 -0.633 1.00 . A A . 4 GLU HB3 1 1 12 8686 1 1 4 GLU HG2 H 4.285 -11.719 1.290 1.00 . A A . 4 GLU HG2 1 1 12 8687 1 1 4 GLU HG3 H 5.959 -11.275 1.506 1.00 . A A . 4 GLU HG3 1 1 12 8688 1 1 4 GLU N N 4.143 -7.930 1.406 1.00 . A A . 4 GLU N 1 1 12 8689 1 1 4 GLU O O 7.080 -7.932 -0.846 1.00 . A A . 4 GLU O 1 1 12 8690 1 1 4 GLU OE1 O 5.538 -9.680 3.305 1.00 . A A . 4 GLU OE1 1 1 12 8691 1 1 4 GLU OE2 O 3.453 -10.333 3.108 1.00 . A A . 4 GLU OE2 1 1 12 8692 1 1 5 GLN C C 6.056 -4.555 -1.649 1.00 . A A . 5 GLN C 1 1 12 8693 1 1 5 GLN CA C 5.750 -5.963 -2.187 1.00 . A A . 5 GLN CA 1 1 12 8694 1 1 5 GLN CB C 4.667 -5.907 -3.300 1.00 . A A . 5 GLN CB 1 1 12 8695 1 1 5 GLN CD C 2.697 -7.136 -4.319 1.00 . A A . 5 GLN CD 1 1 12 8696 1 1 5 GLN CG C 3.981 -7.305 -3.524 1.00 . A A . 5 GLN CG 1 1 12 8697 1 1 5 GLN H H 4.307 -6.659 -0.732 1.00 . A A . 5 GLN H 1 1 12 8698 1 1 5 GLN HA H 6.719 -6.328 -2.523 1.00 . A A . 5 GLN HA 1 1 12 8699 1 1 5 GLN HB2 H 3.922 -5.155 -3.070 1.00 . A A . 5 GLN HB2 1 1 12 8700 1 1 5 GLN HB3 H 5.150 -5.617 -4.226 1.00 . A A . 5 GLN HB3 1 1 12 8701 1 1 5 GLN HE21 H 1.602 -6.904 -2.715 1.00 . A A . 5 GLN HE21 1 1 12 8702 1 1 5 GLN HE22 H 0.772 -6.798 -4.200 1.00 . A A . 5 GLN HE22 1 1 12 8703 1 1 5 GLN HG2 H 4.627 -7.948 -4.102 1.00 . A A . 5 GLN HG2 1 1 12 8704 1 1 5 GLN HG3 H 3.725 -7.803 -2.604 1.00 . A A . 5 GLN HG3 1 1 12 8705 1 1 5 GLN N N 5.218 -6.790 -1.065 1.00 . A A . 5 GLN N 1 1 12 8706 1 1 5 GLN NE2 N 1.598 -6.929 -3.691 1.00 . A A . 5 GLN NE2 1 1 12 8707 1 1 5 GLN O O 7.130 -4.042 -1.837 1.00 . A A . 5 GLN O 1 1 12 8708 1 1 5 GLN OE1 O 2.648 -7.183 -5.522 1.00 . A A . 5 GLN OE1 1 1 12 8709 1 1 6 CYS C C 6.154 -2.514 0.901 1.00 . A A . 6 CYS C 1 1 12 8710 1 1 6 CYS CA C 5.457 -2.541 -0.456 1.00 . A A . 6 CYS CA 1 1 12 8711 1 1 6 CYS CB C 4.108 -1.804 -0.438 1.00 . A A . 6 CYS CB 1 1 12 8712 1 1 6 CYS H H 4.284 -4.325 -0.753 1.00 . A A . 6 CYS H 1 1 12 8713 1 1 6 CYS HA H 6.117 -2.031 -1.144 1.00 . A A . 6 CYS HA 1 1 12 8714 1 1 6 CYS HB2 H 3.436 -2.321 0.230 1.00 . A A . 6 CYS HB2 1 1 12 8715 1 1 6 CYS HB3 H 4.266 -0.816 -0.027 1.00 . A A . 6 CYS HB3 1 1 12 8716 1 1 6 CYS HG H 3.452 -0.725 -2.349 1.00 . A A . 6 CYS HG 1 1 12 8717 1 1 6 CYS N N 5.153 -3.922 -0.962 1.00 . A A . 6 CYS N 1 1 12 8718 1 1 6 CYS O O 6.636 -1.485 1.313 1.00 . A A . 6 CYS O 1 1 12 8719 1 1 6 CYS SG S 3.280 -1.619 -2.038 1.00 . A A . 6 CYS SG 1 1 12 8720 1 1 7 CYS C C 8.112 -4.649 2.852 1.00 . A A . 7 CYS C 1 1 12 8721 1 1 7 CYS CA C 6.848 -3.759 2.892 1.00 . A A . 7 CYS CA 1 1 12 8722 1 1 7 CYS CB C 5.747 -4.314 3.802 1.00 . A A . 7 CYS CB 1 1 12 8723 1 1 7 CYS H H 5.805 -4.444 1.165 1.00 . A A . 7 CYS H 1 1 12 8724 1 1 7 CYS HA H 7.158 -2.786 3.247 1.00 . A A . 7 CYS HA 1 1 12 8725 1 1 7 CYS HB2 H 5.009 -3.529 3.910 1.00 . A A . 7 CYS HB2 1 1 12 8726 1 1 7 CYS HB3 H 5.250 -5.111 3.274 1.00 . A A . 7 CYS HB3 1 1 12 8727 1 1 7 CYS HG H 6.584 -5.821 5.273 1.00 . A A . 7 CYS HG 1 1 12 8728 1 1 7 CYS N N 6.204 -3.637 1.553 1.00 . A A . 7 CYS N 1 1 12 8729 1 1 7 CYS O O 9.108 -4.337 3.468 1.00 . A A . 7 CYS O 1 1 12 8730 1 1 7 CYS SG S 6.234 -4.941 5.433 1.00 . A A . 7 CYS SG 1 1 12 8731 1 1 8 THR C C 9.958 -6.733 0.640 1.00 . A A . 8 THR C 1 1 12 8732 1 1 8 THR CA C 9.177 -6.697 1.979 1.00 . A A . 8 THR CA 1 1 12 8733 1 1 8 THR CB C 8.648 -8.124 2.258 1.00 . A A . 8 THR CB 1 1 12 8734 1 1 8 THR CG2 C 9.716 -9.011 2.805 1.00 . A A . 8 THR CG2 1 1 12 8735 1 1 8 THR H H 7.162 -5.868 1.665 1.00 . A A . 8 THR H 1 1 12 8736 1 1 8 THR HA H 9.901 -6.477 2.750 1.00 . A A . 8 THR HA 1 1 12 8737 1 1 8 THR HB H 8.088 -8.578 1.450 1.00 . A A . 8 THR HB 1 1 12 8738 1 1 8 THR HG1 H 7.105 -8.580 3.434 1.00 . A A . 8 THR HG1 1 1 12 8739 1 1 8 THR HG21 H 10.529 -9.097 2.102 1.00 . A A . 8 THR HG21 1 1 12 8740 1 1 8 THR HG22 H 10.081 -8.600 3.736 1.00 . A A . 8 THR HG22 1 1 12 8741 1 1 8 THR HG23 H 9.286 -9.982 2.997 1.00 . A A . 8 THR HG23 1 1 12 8742 1 1 8 THR N N 8.016 -5.720 2.113 1.00 . A A . 8 THR N 1 1 12 8743 1 1 8 THR O O 11.167 -6.802 0.614 1.00 . A A . 8 THR O 1 1 12 8744 1 1 8 THR OG1 O 7.884 -7.985 3.443 1.00 . A A . 8 THR OG1 1 1 12 8745 1 1 9 SER C C 9.299 -5.613 -2.749 1.00 . A A . 9 SER C 1 1 12 8746 1 1 9 SER CA C 9.869 -6.726 -1.851 1.00 . A A . 9 SER CA 1 1 12 8747 1 1 9 SER CB C 9.584 -8.053 -2.485 1.00 . A A . 9 SER CB 1 1 12 8748 1 1 9 SER H H 8.291 -6.648 -0.358 1.00 . A A . 9 SER H 1 1 12 8749 1 1 9 SER HA H 10.940 -6.591 -1.800 1.00 . A A . 9 SER HA 1 1 12 8750 1 1 9 SER HB2 H 9.991 -8.834 -1.861 1.00 . A A . 9 SER HB2 1 1 12 8751 1 1 9 SER HB3 H 8.522 -8.173 -2.640 1.00 . A A . 9 SER HB3 1 1 12 8752 1 1 9 SER HG H 9.753 -7.413 -4.327 1.00 . A A . 9 SER HG 1 1 12 8753 1 1 9 SER N N 9.259 -6.698 -0.458 1.00 . A A . 9 SER N 1 1 12 8754 1 1 9 SER O O 8.567 -5.826 -3.694 1.00 . A A . 9 SER O 1 1 12 8755 1 1 9 SER OG O 10.278 -7.971 -3.726 1.00 . A A . 9 SER OG 1 1 12 8756 1 1 10 ILE C C 8.372 -2.882 -4.047 1.00 . A A . 10 ILE C 1 1 12 8757 1 1 10 ILE CA C 9.410 -3.104 -2.913 1.00 . A A . 10 ILE CA 1 1 12 8758 1 1 10 ILE CB C 10.773 -2.451 -3.344 1.00 . A A . 10 ILE CB 1 1 12 8759 1 1 10 ILE CD1 C 12.896 -1.485 -2.353 1.00 . A A . 10 ILE CD1 1 1 12 8760 1 1 10 ILE CG1 C 11.412 -1.857 -2.081 1.00 . A A . 10 ILE CG1 1 1 12 8761 1 1 10 ILE CG2 C 10.506 -1.265 -4.318 1.00 . A A . 10 ILE CG2 1 1 12 8762 1 1 10 ILE H H 10.301 -4.536 -1.588 1.00 . A A . 10 ILE H 1 1 12 8763 1 1 10 ILE HA H 8.982 -2.578 -2.078 1.00 . A A . 10 ILE HA 1 1 12 8764 1 1 10 ILE HB H 11.411 -3.197 -3.801 1.00 . A A . 10 ILE HB 1 1 12 8765 1 1 10 ILE HD11 H 13.455 -2.359 -2.651 1.00 . A A . 10 ILE HD11 1 1 12 8766 1 1 10 ILE HD12 H 12.966 -0.748 -3.140 1.00 . A A . 10 ILE HD12 1 1 12 8767 1 1 10 ILE HD13 H 13.354 -1.064 -1.470 1.00 . A A . 10 ILE HD13 1 1 12 8768 1 1 10 ILE HG12 H 10.854 -0.960 -1.854 1.00 . A A . 10 ILE HG12 1 1 12 8769 1 1 10 ILE HG13 H 11.295 -2.531 -1.243 1.00 . A A . 10 ILE HG13 1 1 12 8770 1 1 10 ILE HG21 H 9.834 -0.564 -3.842 1.00 . A A . 10 ILE HG21 1 1 12 8771 1 1 10 ILE HG22 H 11.417 -0.750 -4.575 1.00 . A A . 10 ILE HG22 1 1 12 8772 1 1 10 ILE HG23 H 10.044 -1.598 -5.238 1.00 . A A . 10 ILE HG23 1 1 12 8773 1 1 10 ILE N N 9.716 -4.468 -2.344 1.00 . A A . 10 ILE N 1 1 12 8774 1 1 10 ILE O O 8.399 -3.350 -5.168 1.00 . A A . 10 ILE O 1 1 12 8775 1 1 11 CYS C C 5.977 -0.154 -3.940 1.00 . A A . 11 CYS C 1 1 12 8776 1 1 11 CYS CA C 6.279 -1.611 -4.372 1.00 . A A . 11 CYS CA 1 1 12 8777 1 1 11 CYS CB C 5.141 -2.575 -4.053 1.00 . A A . 11 CYS CB 1 1 12 8778 1 1 11 CYS H H 7.539 -1.775 -2.696 1.00 . A A . 11 CYS H 1 1 12 8779 1 1 11 CYS HA H 6.519 -1.619 -5.427 1.00 . A A . 11 CYS HA 1 1 12 8780 1 1 11 CYS HB2 H 5.264 -3.452 -4.674 1.00 . A A . 11 CYS HB2 1 1 12 8781 1 1 11 CYS HB3 H 5.285 -2.882 -3.042 1.00 . A A . 11 CYS HB3 1 1 12 8782 1 1 11 CYS HG H 3.021 -2.399 -4.937 1.00 . A A . 11 CYS HG 1 1 12 8783 1 1 11 CYS N N 7.446 -2.084 -3.611 1.00 . A A . 11 CYS N 1 1 12 8784 1 1 11 CYS O O 6.417 0.374 -2.937 1.00 . A A . 11 CYS O 1 1 12 8785 1 1 11 CYS SG S 3.413 -2.040 -4.139 1.00 . A A . 11 CYS SG 1 1 12 8786 1 1 12 SER C C 3.271 2.170 -4.390 1.00 . A A . 12 SER C 1 1 12 8787 1 1 12 SER CA C 4.739 1.872 -4.618 1.00 . A A . 12 SER CA 1 1 12 8788 1 1 12 SER CB C 5.197 2.648 -5.844 1.00 . A A . 12 SER CB 1 1 12 8789 1 1 12 SER H H 5.026 -0.164 -5.514 1.00 . A A . 12 SER H 1 1 12 8790 1 1 12 SER HA H 5.156 2.295 -3.761 1.00 . A A . 12 SER HA 1 1 12 8791 1 1 12 SER HB2 H 6.191 2.362 -6.150 1.00 . A A . 12 SER HB2 1 1 12 8792 1 1 12 SER HB3 H 4.500 2.469 -6.651 1.00 . A A . 12 SER HB3 1 1 12 8793 1 1 12 SER HG H 6.025 4.422 -5.622 1.00 . A A . 12 SER HG 1 1 12 8794 1 1 12 SER N N 5.210 0.438 -4.781 1.00 . A A . 12 SER N 1 1 12 8795 1 1 12 SER O O 2.463 1.272 -4.320 1.00 . A A . 12 SER O 1 1 12 8796 1 1 12 SER OG O 5.150 4.023 -5.463 1.00 . A A . 12 SER OG 1 1 12 8797 1 1 13 LEU C C 0.840 3.408 -5.292 1.00 . A A . 13 LEU C 1 1 12 8798 1 1 13 LEU CA C 1.572 3.908 -4.056 1.00 . A A . 13 LEU CA 1 1 12 8799 1 1 13 LEU CB C 1.610 5.475 -3.889 1.00 . A A . 13 LEU CB 1 1 12 8800 1 1 13 LEU CD1 C 0.302 6.406 -5.830 1.00 . A A . 13 LEU CD1 1 1 12 8801 1 1 13 LEU CD2 C 2.075 7.724 -4.772 1.00 . A A . 13 LEU CD2 1 1 12 8802 1 1 13 LEU CG C 1.697 6.303 -5.185 1.00 . A A . 13 LEU CG 1 1 12 8803 1 1 13 LEU H H 3.707 4.079 -4.341 1.00 . A A . 13 LEU H 1 1 12 8804 1 1 13 LEU HA H 1.103 3.428 -3.213 1.00 . A A . 13 LEU HA 1 1 12 8805 1 1 13 LEU HB2 H 0.718 5.772 -3.355 1.00 . A A . 13 LEU HB2 1 1 12 8806 1 1 13 LEU HB3 H 2.450 5.724 -3.254 1.00 . A A . 13 LEU HB3 1 1 12 8807 1 1 13 LEU HD11 H -0.393 6.879 -5.150 1.00 . A A . 13 LEU HD11 1 1 12 8808 1 1 13 LEU HD12 H 0.348 6.999 -6.730 1.00 . A A . 13 LEU HD12 1 1 12 8809 1 1 13 LEU HD13 H -0.118 5.446 -6.095 1.00 . A A . 13 LEU HD13 1 1 12 8810 1 1 13 LEU HD21 H 1.329 8.130 -4.103 1.00 . A A . 13 LEU HD21 1 1 12 8811 1 1 13 LEU HD22 H 3.027 7.730 -4.263 1.00 . A A . 13 LEU HD22 1 1 12 8812 1 1 13 LEU HD23 H 2.143 8.366 -5.638 1.00 . A A . 13 LEU HD23 1 1 12 8813 1 1 13 LEU HG H 2.431 5.899 -5.874 1.00 . A A . 13 LEU HG 1 1 12 8814 1 1 13 LEU N N 2.972 3.440 -4.273 1.00 . A A . 13 LEU N 1 1 12 8815 1 1 13 LEU O O -0.255 2.919 -5.131 1.00 . A A . 13 LEU O 1 1 12 8816 1 1 14 TYR C C 0.478 1.526 -7.590 1.00 . A A . 14 TYR C 1 1 12 8817 1 1 14 TYR CA C 0.764 3.021 -7.676 1.00 . A A . 14 TYR CA 1 1 12 8818 1 1 14 TYR CB C 1.548 3.274 -8.976 1.00 . A A . 14 TYR CB 1 1 12 8819 1 1 14 TYR CD1 C 3.744 4.359 -8.576 1.00 . A A . 14 TYR CD1 1 1 12 8820 1 1 14 TYR CD2 C 3.745 2.044 -9.101 1.00 . A A . 14 TYR CD2 1 1 12 8821 1 1 14 TYR CE1 C 5.114 4.335 -8.491 1.00 . A A . 14 TYR CE1 1 1 12 8822 1 1 14 TYR CE2 C 5.123 2.024 -9.016 1.00 . A A . 14 TYR CE2 1 1 12 8823 1 1 14 TYR CG C 3.057 3.213 -8.881 1.00 . A A . 14 TYR CG 1 1 12 8824 1 1 14 TYR CZ C 5.807 3.180 -8.707 1.00 . A A . 14 TYR CZ 1 1 12 8825 1 1 14 TYR H H 2.363 3.909 -6.471 1.00 . A A . 14 TYR H 1 1 12 8826 1 1 14 TYR HA H -0.185 3.536 -7.756 1.00 . A A . 14 TYR HA 1 1 12 8827 1 1 14 TYR HB2 H 1.211 2.508 -9.667 1.00 . A A . 14 TYR HB2 1 1 12 8828 1 1 14 TYR HB3 H 1.216 4.217 -9.367 1.00 . A A . 14 TYR HB3 1 1 12 8829 1 1 14 TYR HD1 H 3.207 5.280 -8.403 1.00 . A A . 14 TYR HD1 1 1 12 8830 1 1 14 TYR HD2 H 3.200 1.145 -9.347 1.00 . A A . 14 TYR HD2 1 1 12 8831 1 1 14 TYR HE1 H 5.658 5.232 -8.250 1.00 . A A . 14 TYR HE1 1 1 12 8832 1 1 14 TYR HE2 H 5.658 1.102 -9.189 1.00 . A A . 14 TYR HE2 1 1 12 8833 1 1 14 TYR HH H 7.473 2.320 -8.413 1.00 . A A . 14 TYR HH 1 1 12 8834 1 1 14 TYR N N 1.471 3.519 -6.451 1.00 . A A . 14 TYR N 1 1 12 8835 1 1 14 TYR O O -0.124 0.976 -8.494 1.00 . A A . 14 TYR O 1 1 12 8836 1 1 14 TYR OH O 7.172 3.219 -8.599 1.00 . A A . 14 TYR OH 1 1 12 8837 1 1 15 GLN C C 0.073 -0.867 -5.060 1.00 . A A . 15 GLN C 1 1 12 8838 1 1 15 GLN CA C 0.627 -0.588 -6.470 1.00 . A A . 15 GLN CA 1 1 12 8839 1 1 15 GLN CB C 1.854 -1.461 -6.773 1.00 . A A . 15 GLN CB 1 1 12 8840 1 1 15 GLN CD C 1.044 -2.182 -9.080 1.00 . A A . 15 GLN CD 1 1 12 8841 1 1 15 GLN CG C 2.104 -1.391 -8.313 1.00 . A A . 15 GLN CG 1 1 12 8842 1 1 15 GLN H H 1.597 1.307 -5.910 1.00 . A A . 15 GLN H 1 1 12 8843 1 1 15 GLN HA H -0.167 -0.775 -7.163 1.00 . A A . 15 GLN HA 1 1 12 8844 1 1 15 GLN HB2 H 2.682 -1.120 -6.190 1.00 . A A . 15 GLN HB2 1 1 12 8845 1 1 15 GLN HB3 H 1.591 -2.483 -6.497 1.00 . A A . 15 GLN HB3 1 1 12 8846 1 1 15 GLN HE21 H -0.217 -0.683 -9.261 1.00 . A A . 15 GLN HE21 1 1 12 8847 1 1 15 GLN HE22 H -0.682 -2.172 -9.954 1.00 . A A . 15 GLN HE22 1 1 12 8848 1 1 15 GLN HG2 H 2.044 -0.374 -8.660 1.00 . A A . 15 GLN HG2 1 1 12 8849 1 1 15 GLN HG3 H 3.064 -1.807 -8.569 1.00 . A A . 15 GLN HG3 1 1 12 8850 1 1 15 GLN N N 0.980 0.871 -6.564 1.00 . A A . 15 GLN N 1 1 12 8851 1 1 15 GLN NE2 N -0.045 -1.626 -9.464 1.00 . A A . 15 GLN NE2 1 1 12 8852 1 1 15 GLN O O 0.219 -1.920 -4.467 1.00 . A A . 15 GLN O 1 1 12 8853 1 1 15 GLN OE1 O 1.182 -3.348 -9.347 1.00 . A A . 15 GLN OE1 1 1 12 8854 1 1 16 LEU C C -2.715 0.442 -3.550 1.00 . A A . 16 LEU C 1 1 12 8855 1 1 16 LEU CA C -1.242 0.265 -3.310 1.00 . A A . 16 LEU CA 1 1 12 8856 1 1 16 LEU CB C -0.667 1.447 -2.584 1.00 . A A . 16 LEU CB 1 1 12 8857 1 1 16 LEU CD1 C 0.986 0.022 -1.506 1.00 . A A . 16 LEU CD1 1 1 12 8858 1 1 16 LEU CD2 C 0.168 2.110 -0.440 1.00 . A A . 16 LEU CD2 1 1 12 8859 1 1 16 LEU CG C -0.222 0.934 -1.276 1.00 . A A . 16 LEU CG 1 1 12 8860 1 1 16 LEU H H -0.649 0.952 -5.134 1.00 . A A . 16 LEU H 1 1 12 8861 1 1 16 LEU HA H -1.114 -0.675 -2.843 1.00 . A A . 16 LEU HA 1 1 12 8862 1 1 16 LEU HB2 H 0.172 1.807 -3.144 1.00 . A A . 16 LEU HB2 1 1 12 8863 1 1 16 LEU HB3 H -1.387 2.256 -2.493 1.00 . A A . 16 LEU HB3 1 1 12 8864 1 1 16 LEU HD11 H 1.770 0.570 -2.008 1.00 . A A . 16 LEU HD11 1 1 12 8865 1 1 16 LEU HD12 H 1.361 -0.368 -0.575 1.00 . A A . 16 LEU HD12 1 1 12 8866 1 1 16 LEU HD13 H 0.739 -0.819 -2.142 1.00 . A A . 16 LEU HD13 1 1 12 8867 1 1 16 LEU HD21 H 0.961 2.653 -0.934 1.00 . A A . 16 LEU HD21 1 1 12 8868 1 1 16 LEU HD22 H -0.681 2.766 -0.307 1.00 . A A . 16 LEU HD22 1 1 12 8869 1 1 16 LEU HD23 H 0.506 1.767 0.523 1.00 . A A . 16 LEU HD23 1 1 12 8870 1 1 16 LEU HG H -1.059 0.382 -0.881 1.00 . A A . 16 LEU HG 1 1 12 8871 1 1 16 LEU N N -0.577 0.158 -4.597 1.00 . A A . 16 LEU N 1 1 12 8872 1 1 16 LEU O O -3.494 -0.254 -2.942 1.00 . A A . 16 LEU O 1 1 12 8873 1 1 17 GLU C C -5.207 0.213 -4.956 1.00 . A A . 17 GLU C 1 1 12 8874 1 1 17 GLU CA C -4.543 1.613 -4.737 1.00 . A A . 17 GLU CA 1 1 12 8875 1 1 17 GLU CB C -4.620 2.453 -6.027 1.00 . A A . 17 GLU CB 1 1 12 8876 1 1 17 GLU CD C -2.506 1.640 -6.972 1.00 . A A . 17 GLU CD 1 1 12 8877 1 1 17 GLU CG C -3.948 1.657 -7.197 1.00 . A A . 17 GLU CG 1 1 12 8878 1 1 17 GLU H H -2.308 1.853 -4.825 1.00 . A A . 17 GLU H 1 1 12 8879 1 1 17 GLU HA H -5.042 2.118 -3.931 1.00 . A A . 17 GLU HA 1 1 12 8880 1 1 17 GLU HB2 H -5.627 2.729 -6.287 1.00 . A A . 17 GLU HB2 1 1 12 8881 1 1 17 GLU HB3 H -4.048 3.364 -5.883 1.00 . A A . 17 GLU HB3 1 1 12 8882 1 1 17 GLU HG2 H -4.246 0.636 -7.313 1.00 . A A . 17 GLU HG2 1 1 12 8883 1 1 17 GLU HG3 H -4.044 2.156 -8.123 1.00 . A A . 17 GLU HG3 1 1 12 8884 1 1 17 GLU N N -3.067 1.358 -4.403 1.00 . A A . 17 GLU N 1 1 12 8885 1 1 17 GLU O O -6.306 -0.149 -4.579 1.00 . A A . 17 GLU O 1 1 12 8886 1 1 17 GLU OE1 O -2.021 2.733 -7.044 1.00 . A A . 17 GLU OE1 1 1 12 8887 1 1 17 GLU OE2 O -2.017 0.563 -6.728 1.00 . A A . 17 GLU OE2 1 1 12 8888 1 1 18 ASN C C -5.188 -2.799 -4.973 1.00 . A A . 18 ASN C 1 1 12 8889 1 1 18 ASN CA C -4.474 -1.934 -6.067 1.00 . A A . 18 ASN CA 1 1 12 8890 1 1 18 ASN CB C -2.936 -2.154 -6.446 1.00 . A A . 18 ASN CB 1 1 12 8891 1 1 18 ASN CG C -2.472 -3.569 -6.444 1.00 . A A . 18 ASN CG 1 1 12 8892 1 1 18 ASN H H -3.534 -0.054 -5.809 1.00 . A A . 18 ASN H 1 1 12 8893 1 1 18 ASN HA H -5.118 -1.955 -6.932 1.00 . A A . 18 ASN HA 1 1 12 8894 1 1 18 ASN HB2 H -2.732 -1.736 -7.428 1.00 . A A . 18 ASN HB2 1 1 12 8895 1 1 18 ASN HB3 H -2.287 -1.601 -5.780 1.00 . A A . 18 ASN HB3 1 1 12 8896 1 1 18 ASN HD21 H -0.584 -3.116 -6.123 1.00 . A A . 18 ASN HD21 1 1 12 8897 1 1 18 ASN HD22 H -0.980 -4.775 -6.211 1.00 . A A . 18 ASN HD22 1 1 12 8898 1 1 18 ASN N N -4.367 -0.529 -5.607 1.00 . A A . 18 ASN N 1 1 12 8899 1 1 18 ASN ND2 N -1.237 -3.832 -6.244 1.00 . A A . 18 ASN ND2 1 1 12 8900 1 1 18 ASN O O -5.842 -3.786 -5.235 1.00 . A A . 18 ASN O 1 1 12 8901 1 1 18 ASN OD1 O -3.220 -4.493 -6.626 1.00 . A A . 18 ASN OD1 1 1 12 8902 1 1 19 TYR C C -6.483 -1.863 -1.850 1.00 . A A . 19 TYR C 1 1 12 8903 1 1 19 TYR CA C -5.583 -2.957 -2.501 1.00 . A A . 19 TYR CA 1 1 12 8904 1 1 19 TYR CB C -4.368 -3.330 -1.625 1.00 . A A . 19 TYR CB 1 1 12 8905 1 1 19 TYR CD1 C -3.851 -5.280 -3.077 1.00 . A A . 19 TYR CD1 1 1 12 8906 1 1 19 TYR CD2 C -2.119 -3.699 -2.766 1.00 . A A . 19 TYR CD2 1 1 12 8907 1 1 19 TYR CE1 C -3.025 -6.013 -3.890 1.00 . A A . 19 TYR CE1 1 1 12 8908 1 1 19 TYR CE2 C -1.293 -4.446 -3.585 1.00 . A A . 19 TYR CE2 1 1 12 8909 1 1 19 TYR CG C -3.407 -4.121 -2.510 1.00 . A A . 19 TYR CG 1 1 12 8910 1 1 19 TYR CZ C -1.746 -5.615 -4.152 1.00 . A A . 19 TYR CZ 1 1 12 8911 1 1 19 TYR H H -4.463 -1.565 -3.708 1.00 . A A . 19 TYR H 1 1 12 8912 1 1 19 TYR HA H -6.209 -3.806 -2.736 1.00 . A A . 19 TYR HA 1 1 12 8913 1 1 19 TYR HB2 H -3.872 -2.438 -1.272 1.00 . A A . 19 TYR HB2 1 1 12 8914 1 1 19 TYR HB3 H -4.650 -3.945 -0.782 1.00 . A A . 19 TYR HB3 1 1 12 8915 1 1 19 TYR HD1 H -4.859 -5.612 -2.873 1.00 . A A . 19 TYR HD1 1 1 12 8916 1 1 19 TYR HD2 H -1.751 -2.779 -2.334 1.00 . A A . 19 TYR HD2 1 1 12 8917 1 1 19 TYR HE1 H -3.393 -6.904 -4.348 1.00 . A A . 19 TYR HE1 1 1 12 8918 1 1 19 TYR HE2 H -0.291 -4.103 -3.799 1.00 . A A . 19 TYR HE2 1 1 12 8919 1 1 19 TYR HH H -1.414 -7.258 -4.972 1.00 . A A . 19 TYR HH 1 1 12 8920 1 1 19 TYR N N -5.020 -2.360 -3.766 1.00 . A A . 19 TYR N 1 1 12 8921 1 1 19 TYR O O -7.535 -2.068 -1.276 1.00 . A A . 19 TYR O 1 1 12 8922 1 1 19 TYR OH O -0.953 -6.405 -4.957 1.00 . A A . 19 TYR OH 1 1 12 8923 1 1 20 CYS C C -7.553 1.276 -2.482 1.00 . A A . 20 CYS C 1 1 12 8924 1 1 20 CYS CA C -6.591 0.581 -1.477 1.00 . A A . 20 CYS CA 1 1 12 8925 1 1 20 CYS CB C -5.426 1.459 -1.112 1.00 . A A . 20 CYS CB 1 1 12 8926 1 1 20 CYS H H -5.139 -0.625 -2.444 1.00 . A A . 20 CYS H 1 1 12 8927 1 1 20 CYS HA H -7.148 0.398 -0.581 1.00 . A A . 20 CYS HA 1 1 12 8928 1 1 20 CYS HB2 H -4.797 0.935 -0.412 1.00 . A A . 20 CYS HB2 1 1 12 8929 1 1 20 CYS HB3 H -4.832 1.652 -1.990 1.00 . A A . 20 CYS HB3 1 1 12 8930 1 1 20 CYS HG H -5.988 3.675 -1.152 1.00 . A A . 20 CYS HG 1 1 12 8931 1 1 20 CYS N N -5.987 -0.679 -1.979 1.00 . A A . 20 CYS N 1 1 12 8932 1 1 20 CYS O O -7.204 2.119 -3.278 1.00 . A A . 20 CYS O 1 1 12 8933 1 1 20 CYS SG S -5.918 3.049 -0.425 1.00 . A A . 20 CYS SG 1 1 12 8934 1 1 21 ASN C C -10.767 2.318 -2.362 1.00 . A A . 21 ASN C 1 1 12 8935 1 1 21 ASN CA C -9.895 1.383 -3.223 1.00 . A A . 21 ASN CA 1 1 12 8936 1 1 21 ASN CB C -10.632 0.105 -3.722 1.00 . A A . 21 ASN CB 1 1 12 8937 1 1 21 ASN CG C -10.749 -0.911 -2.589 1.00 . A A . 21 ASN CG 1 1 12 8938 1 1 21 ASN H H -8.985 0.209 -1.700 1.00 . A A . 21 ASN H 1 1 12 8939 1 1 21 ASN HA H -9.495 1.962 -4.049 1.00 . A A . 21 ASN HA 1 1 12 8940 1 1 21 ASN HB2 H -11.626 0.326 -4.077 1.00 . A A . 21 ASN HB2 1 1 12 8941 1 1 21 ASN HB3 H -10.065 -0.351 -4.519 1.00 . A A . 21 ASN HB3 1 1 12 8942 1 1 21 ASN HD21 H -9.292 -2.010 -3.308 1.00 . A A . 21 ASN HD21 1 1 12 8943 1 1 21 ASN HD22 H -10.020 -2.585 -1.890 1.00 . A A . 21 ASN HD22 1 1 12 8944 1 1 21 ASN N N -8.779 0.874 -2.375 1.00 . A A . 21 ASN N 1 1 12 8945 1 1 21 ASN ND2 N -9.956 -1.919 -2.597 1.00 . A A . 21 ASN ND2 1 1 12 8946 1 1 21 ASN O O -10.776 2.165 -1.152 1.00 . A A . 21 ASN O 1 1 12 8947 1 1 21 ASN OD1 O -11.535 -0.824 -1.668 1.00 . A A . 21 ASN OD1 1 1 12 8948 2 2 1 PHE C C 7.515 6.096 -3.866 1.00 . B B . 1 PHE C 1 1 12 8949 2 2 1 PHE CA C 6.297 6.610 -3.038 1.00 . B B . 1 PHE CA 1 1 12 8950 2 2 1 PHE CB C 6.373 6.111 -1.555 1.00 . B B . 1 PHE CB 1 1 12 8951 2 2 1 PHE CD1 C 4.268 7.531 -1.072 1.00 . B B . 1 PHE CD1 1 1 12 8952 2 2 1 PHE CD2 C 5.317 6.372 0.711 1.00 . B B . 1 PHE CD2 1 1 12 8953 2 2 1 PHE CE1 C 3.320 8.018 -0.195 1.00 . B B . 1 PHE CE1 1 1 12 8954 2 2 1 PHE CE2 C 4.370 6.857 1.590 1.00 . B B . 1 PHE CE2 1 1 12 8955 2 2 1 PHE CG C 5.281 6.698 -0.630 1.00 . B B . 1 PHE CG 1 1 12 8956 2 2 1 PHE CZ C 3.369 7.682 1.136 1.00 . B B . 1 PHE CZ 1 1 12 8957 2 2 1 PHE HA H 6.322 7.691 -3.069 1.00 . B B . 1 PHE HA 1 1 12 8958 2 2 1 PHE HB2 H 6.254 5.037 -1.544 1.00 . B B . 1 PHE HB2 1 1 12 8959 2 2 1 PHE HB3 H 7.330 6.354 -1.119 1.00 . B B . 1 PHE HB3 1 1 12 8960 2 2 1 PHE HD1 H 4.208 7.808 -2.113 1.00 . B B . 1 PHE HD1 1 1 12 8961 2 2 1 PHE HD2 H 6.098 5.727 1.083 1.00 . B B . 1 PHE HD2 1 1 12 8962 2 2 1 PHE HE1 H 2.533 8.668 -0.555 1.00 . B B . 1 PHE HE1 1 1 12 8963 2 2 1 PHE HE2 H 4.415 6.588 2.637 1.00 . B B . 1 PHE HE2 1 1 12 8964 2 2 1 PHE HZ H 2.626 8.064 1.823 1.00 . B B . 1 PHE HZ 1 1 12 8965 2 2 1 PHE N N 4.987 6.149 -3.602 1.00 . B B . 1 PHE N 1 1 12 8966 2 2 1 PHE O O 7.380 5.394 -4.847 1.00 . B B . 1 PHE O 1 1 12 8967 2 2 2 VAL C C 10.446 4.624 -3.771 1.00 . B B . 2 VAL C 1 1 12 8968 2 2 2 VAL CA C 9.961 6.047 -4.110 1.00 . B B . 2 VAL CA 1 1 12 8969 2 2 2 VAL CB C 11.048 7.066 -3.737 1.00 . B B . 2 VAL CB 1 1 12 8970 2 2 2 VAL CG1 C 10.702 8.454 -4.302 1.00 . B B . 2 VAL CG1 1 1 12 8971 2 2 2 VAL CG2 C 11.221 7.224 -2.211 1.00 . B B . 2 VAL CG2 1 1 12 8972 2 2 2 VAL H H 8.784 6.988 -2.679 1.00 . B B . 2 VAL H 1 1 12 8973 2 2 2 VAL HA H 9.788 6.113 -5.159 1.00 . B B . 2 VAL HA 1 1 12 8974 2 2 2 VAL HB H 11.946 6.661 -4.185 1.00 . B B . 2 VAL HB 1 1 12 8975 2 2 2 VAL HG11 H 10.628 8.424 -5.380 1.00 . B B . 2 VAL HG11 1 1 12 8976 2 2 2 VAL HG12 H 9.769 8.821 -3.901 1.00 . B B . 2 VAL HG12 1 1 12 8977 2 2 2 VAL HG13 H 11.481 9.159 -4.041 1.00 . B B . 2 VAL HG13 1 1 12 8978 2 2 2 VAL HG21 H 11.508 6.285 -1.760 1.00 . B B . 2 VAL HG21 1 1 12 8979 2 2 2 VAL HG22 H 12.013 7.934 -2.014 1.00 . B B . 2 VAL HG22 1 1 12 8980 2 2 2 VAL HG23 H 10.326 7.588 -1.732 1.00 . B B . 2 VAL HG23 1 1 12 8981 2 2 2 VAL N N 8.696 6.443 -3.447 1.00 . B B . 2 VAL N 1 1 12 8982 2 2 2 VAL O O 11.527 4.349 -3.301 1.00 . B B . 2 VAL O 1 1 12 8983 2 2 3 ASN C C 10.608 1.747 -2.763 1.00 . B B . 3 ASN C 1 1 12 8984 2 2 3 ASN CA C 9.653 2.274 -3.888 1.00 . B B . 3 ASN CA 1 1 12 8985 2 2 3 ASN CB C 10.037 1.824 -5.310 1.00 . B B . 3 ASN CB 1 1 12 8986 2 2 3 ASN CG C 9.012 2.353 -6.275 1.00 . B B . 3 ASN CG 1 1 12 8987 2 2 3 ASN H H 8.727 4.147 -4.446 1.00 . B B . 3 ASN H 1 1 12 8988 2 2 3 ASN HA H 8.673 1.876 -3.656 1.00 . B B . 3 ASN HA 1 1 12 8989 2 2 3 ASN HB2 H 11.002 2.221 -5.588 1.00 . B B . 3 ASN HB2 1 1 12 8990 2 2 3 ASN HB3 H 10.053 0.760 -5.436 1.00 . B B . 3 ASN HB3 1 1 12 8991 2 2 3 ASN HD21 H 9.586 4.249 -6.162 1.00 . B B . 3 ASN HD21 1 1 12 8992 2 2 3 ASN HD22 H 8.283 3.861 -7.205 1.00 . B B . 3 ASN HD22 1 1 12 8993 2 2 3 ASN N N 9.537 3.761 -4.070 1.00 . B B . 3 ASN N 1 1 12 8994 2 2 3 ASN ND2 N 8.972 3.609 -6.557 1.00 . B B . 3 ASN ND2 1 1 12 8995 2 2 3 ASN O O 11.734 1.382 -3.018 1.00 . B B . 3 ASN O 1 1 12 8996 2 2 3 ASN OD1 O 8.198 1.634 -6.804 1.00 . B B . 3 ASN OD1 1 1 12 8997 2 2 4 GLN C C 10.146 0.129 0.394 1.00 . B B . 4 GLN C 1 1 12 8998 2 2 4 GLN CA C 10.901 1.256 -0.369 1.00 . B B . 4 GLN CA 1 1 12 8999 2 2 4 GLN CB C 11.156 2.508 0.533 1.00 . B B . 4 GLN CB 1 1 12 9000 2 2 4 GLN CD C 13.355 2.932 -0.661 1.00 . B B . 4 GLN CD 1 1 12 9001 2 2 4 GLN CG C 12.044 3.553 -0.207 1.00 . B B . 4 GLN CG 1 1 12 9002 2 2 4 GLN H H 9.208 2.017 -1.380 1.00 . B B . 4 GLN H 1 1 12 9003 2 2 4 GLN HA H 11.840 0.832 -0.701 1.00 . B B . 4 GLN HA 1 1 12 9004 2 2 4 GLN HB2 H 10.207 2.946 0.805 1.00 . B B . 4 GLN HB2 1 1 12 9005 2 2 4 GLN HB3 H 11.682 2.227 1.433 1.00 . B B . 4 GLN HB3 1 1 12 9006 2 2 4 GLN HE21 H 13.059 3.434 -2.514 1.00 . B B . 4 GLN HE21 1 1 12 9007 2 2 4 GLN HE22 H 14.521 2.607 -2.183 1.00 . B B . 4 GLN HE22 1 1 12 9008 2 2 4 GLN HG2 H 11.545 3.939 -1.078 1.00 . B B . 4 GLN HG2 1 1 12 9009 2 2 4 GLN HG3 H 12.301 4.378 0.439 1.00 . B B . 4 GLN HG3 1 1 12 9010 2 2 4 GLN N N 10.119 1.729 -1.551 1.00 . B B . 4 GLN N 1 1 12 9011 2 2 4 GLN NE2 N 13.677 2.996 -1.896 1.00 . B B . 4 GLN NE2 1 1 12 9012 2 2 4 GLN O O 9.308 -0.565 -0.141 1.00 . B B . 4 GLN O 1 1 12 9013 2 2 4 GLN OE1 O 14.102 2.377 0.109 1.00 . B B . 4 GLN OE1 1 1 12 9014 2 2 5 HIS C C 8.935 -0.369 3.625 1.00 . B B . 5 HIS C 1 1 12 9015 2 2 5 HIS CA C 9.895 -1.001 2.571 1.00 . B B . 5 HIS CA 1 1 12 9016 2 2 5 HIS CB C 11.083 -1.738 3.239 1.00 . B B . 5 HIS CB 1 1 12 9017 2 2 5 HIS CD2 C 11.835 -3.947 2.031 1.00 . B B . 5 HIS CD2 1 1 12 9018 2 2 5 HIS CE1 C 13.036 -3.129 0.564 1.00 . B B . 5 HIS CE1 1 1 12 9019 2 2 5 HIS CG C 11.817 -2.582 2.204 1.00 . B B . 5 HIS CG 1 1 12 9020 2 2 5 HIS H H 11.158 0.648 1.942 1.00 . B B . 5 HIS H 1 1 12 9021 2 2 5 HIS HA H 9.313 -1.718 2.005 1.00 . B B . 5 HIS HA 1 1 12 9022 2 2 5 HIS HB2 H 11.781 -1.044 3.679 1.00 . B B . 5 HIS HB2 1 1 12 9023 2 2 5 HIS HB3 H 10.720 -2.402 4.013 1.00 . B B . 5 HIS HB3 1 1 12 9024 2 2 5 HIS HD1 H 12.775 -1.192 1.119 1.00 . B B . 5 HIS HD1 1 1 12 9025 2 2 5 HIS HD2 H 11.299 -4.647 2.651 1.00 . B B . 5 HIS HD2 1 1 12 9026 2 2 5 HIS HE1 H 13.702 -3.044 -0.285 1.00 . B B . 5 HIS HE1 1 1 12 9027 2 2 5 HIS N N 10.489 0.019 1.639 1.00 . B B . 5 HIS N 1 1 12 9028 2 2 5 HIS ND1 N 12.578 -2.136 1.267 1.00 . B B . 5 HIS ND1 1 1 12 9029 2 2 5 HIS NE2 N 12.596 -4.275 1.008 1.00 . B B . 5 HIS NE2 1 1 12 9030 2 2 5 HIS O O 9.227 -0.167 4.788 1.00 . B B . 5 HIS O 1 1 12 9031 2 2 6 LEU C C 5.921 -0.628 4.607 1.00 . B B . 6 LEU C 1 1 12 9032 2 2 6 LEU CA C 6.657 0.538 3.907 1.00 . B B . 6 LEU CA 1 1 12 9033 2 2 6 LEU CB C 5.672 1.237 2.959 1.00 . B B . 6 LEU CB 1 1 12 9034 2 2 6 LEU CD1 C 7.242 1.900 1.066 1.00 . B B . 6 LEU CD1 1 1 12 9035 2 2 6 LEU CD2 C 5.032 2.951 1.327 1.00 . B B . 6 LEU CD2 1 1 12 9036 2 2 6 LEU CG C 6.222 2.387 2.098 1.00 . B B . 6 LEU CG 1 1 12 9037 2 2 6 LEU H H 7.619 -0.277 2.189 1.00 . B B . 6 LEU H 1 1 12 9038 2 2 6 LEU HA H 7.045 1.215 4.655 1.00 . B B . 6 LEU HA 1 1 12 9039 2 2 6 LEU HB2 H 5.278 0.466 2.310 1.00 . B B . 6 LEU HB2 1 1 12 9040 2 2 6 LEU HB3 H 4.856 1.591 3.569 1.00 . B B . 6 LEU HB3 1 1 12 9041 2 2 6 LEU HD11 H 6.806 1.130 0.440 1.00 . B B . 6 LEU HD11 1 1 12 9042 2 2 6 LEU HD12 H 7.549 2.724 0.443 1.00 . B B . 6 LEU HD12 1 1 12 9043 2 2 6 LEU HD13 H 8.116 1.502 1.548 1.00 . B B . 6 LEU HD13 1 1 12 9044 2 2 6 LEU HD21 H 4.584 2.174 0.723 1.00 . B B . 6 LEU HD21 1 1 12 9045 2 2 6 LEU HD22 H 4.285 3.327 2.011 1.00 . B B . 6 LEU HD22 1 1 12 9046 2 2 6 LEU HD23 H 5.337 3.753 0.675 1.00 . B B . 6 LEU HD23 1 1 12 9047 2 2 6 LEU HG H 6.661 3.139 2.738 1.00 . B B . 6 LEU HG 1 1 12 9048 2 2 6 LEU N N 7.775 -0.076 3.132 1.00 . B B . 6 LEU N 1 1 12 9049 2 2 6 LEU O O 5.027 -1.243 4.059 1.00 . B B . 6 LEU O 1 1 12 9050 2 2 7 CYS C C 4.480 -1.588 7.462 1.00 . B B . 7 CYS C 1 1 12 9051 2 2 7 CYS CA C 5.623 -2.051 6.528 1.00 . B B . 7 CYS CA 1 1 12 9052 2 2 7 CYS CB C 6.738 -2.806 7.278 1.00 . B B . 7 CYS CB 1 1 12 9053 2 2 7 CYS H H 7.024 -0.391 6.194 1.00 . B B . 7 CYS H 1 1 12 9054 2 2 7 CYS HA H 5.170 -2.715 5.812 1.00 . B B . 7 CYS HA 1 1 12 9055 2 2 7 CYS HB2 H 7.647 -2.745 6.694 1.00 . B B . 7 CYS HB2 1 1 12 9056 2 2 7 CYS HB3 H 6.926 -2.337 8.235 1.00 . B B . 7 CYS HB3 1 1 12 9057 2 2 7 CYS HG H 6.013 -4.671 8.415 1.00 . B B . 7 CYS HG 1 1 12 9058 2 2 7 CYS N N 6.303 -0.922 5.808 1.00 . B B . 7 CYS N 1 1 12 9059 2 2 7 CYS O O 4.182 -0.416 7.509 1.00 . B B . 7 CYS O 1 1 12 9060 2 2 7 CYS SG S 6.408 -4.566 7.546 1.00 . B B . 7 CYS SG 1 1 12 9061 2 2 8 GLY C C 2.157 -0.807 9.078 1.00 . B B . 8 GLY C 1 1 12 9062 2 2 8 GLY CA C 2.726 -2.221 9.124 1.00 . B B . 8 GLY CA 1 1 12 9063 2 2 8 GLY H H 4.208 -3.425 8.058 1.00 . B B . 8 GLY H 1 1 12 9064 2 2 8 GLY HA2 H 1.905 -2.882 8.923 1.00 . B B . 8 GLY HA2 1 1 12 9065 2 2 8 GLY HA3 H 3.078 -2.369 10.135 1.00 . B B . 8 GLY HA3 1 1 12 9066 2 2 8 GLY N N 3.878 -2.514 8.167 1.00 . B B . 8 GLY N 1 1 12 9067 2 2 8 GLY O O 1.311 -0.481 8.271 1.00 . B B . 8 GLY O 1 1 12 9068 2 2 9 ASP C C 2.551 2.172 8.790 1.00 . B B . 9 ASP C 1 1 12 9069 2 2 9 ASP CA C 2.305 1.406 10.132 1.00 . B B . 9 ASP CA 1 1 12 9070 2 2 9 ASP CB C 3.205 1.852 11.335 1.00 . B B . 9 ASP CB 1 1 12 9071 2 2 9 ASP CG C 4.655 1.443 11.099 1.00 . B B . 9 ASP CG 1 1 12 9072 2 2 9 ASP H H 3.357 -0.391 10.554 1.00 . B B . 9 ASP H 1 1 12 9073 2 2 9 ASP HA H 1.242 1.479 10.350 1.00 . B B . 9 ASP HA 1 1 12 9074 2 2 9 ASP HB2 H 3.182 2.926 11.444 1.00 . B B . 9 ASP HB2 1 1 12 9075 2 2 9 ASP HB3 H 2.886 1.398 12.256 1.00 . B B . 9 ASP HB3 1 1 12 9076 2 2 9 ASP N N 2.671 -0.025 9.959 1.00 . B B . 9 ASP N 1 1 12 9077 2 2 9 ASP O O 1.686 2.727 8.140 1.00 . B B . 9 ASP O 1 1 12 9078 2 2 9 ASP OD1 O 4.936 0.288 11.356 1.00 . B B . 9 ASP OD1 1 1 12 9079 2 2 9 ASP OD2 O 5.398 2.294 10.660 1.00 . B B . 9 ASP OD2 1 1 12 9080 2 2 10 HIS C C 3.417 2.376 5.892 1.00 . B B . 10 HIS C 1 1 12 9081 2 2 10 HIS CA C 4.238 2.814 7.140 1.00 . B B . 10 HIS CA 1 1 12 9082 2 2 10 HIS CB C 5.714 2.476 7.009 1.00 . B B . 10 HIS CB 1 1 12 9083 2 2 10 HIS CD2 C 7.609 4.163 6.308 1.00 . B B . 10 HIS CD2 1 1 12 9084 2 2 10 HIS CE1 C 6.798 4.838 4.528 1.00 . B B . 10 HIS CE1 1 1 12 9085 2 2 10 HIS CG C 6.410 3.509 6.130 1.00 . B B . 10 HIS CG 1 1 12 9086 2 2 10 HIS H H 4.399 1.644 8.983 1.00 . B B . 10 HIS H 1 1 12 9087 2 2 10 HIS HA H 4.092 3.880 7.258 1.00 . B B . 10 HIS HA 1 1 12 9088 2 2 10 HIS HB2 H 6.150 2.496 7.998 1.00 . B B . 10 HIS HB2 1 1 12 9089 2 2 10 HIS HB3 H 5.819 1.489 6.593 1.00 . B B . 10 HIS HB3 1 1 12 9090 2 2 10 HIS HD1 H 5.105 3.694 4.611 1.00 . B B . 10 HIS HD1 1 1 12 9091 2 2 10 HIS HD2 H 8.261 4.016 7.153 1.00 . B B . 10 HIS HD2 1 1 12 9092 2 2 10 HIS HE1 H 6.664 5.382 3.602 1.00 . B B . 10 HIS HE1 1 1 12 9093 2 2 10 HIS N N 3.782 2.143 8.398 1.00 . B B . 10 HIS N 1 1 12 9094 2 2 10 HIS ND1 N 5.962 3.971 5.016 1.00 . B B . 10 HIS ND1 1 1 12 9095 2 2 10 HIS NE2 N 7.839 4.986 5.306 1.00 . B B . 10 HIS NE2 1 1 12 9096 2 2 10 HIS O O 3.401 3.042 4.872 1.00 . B B . 10 HIS O 1 1 12 9097 2 2 11 LEU C C 0.482 1.218 5.122 1.00 . B B . 11 LEU C 1 1 12 9098 2 2 11 LEU CA C 1.917 0.675 4.923 1.00 . B B . 11 LEU CA 1 1 12 9099 2 2 11 LEU CB C 2.005 -0.864 5.064 1.00 . B B . 11 LEU CB 1 1 12 9100 2 2 11 LEU CD1 C 2.122 -1.254 2.578 1.00 . B B . 11 LEU CD1 1 1 12 9101 2 2 11 LEU CD2 C 1.580 -3.099 4.126 1.00 . B B . 11 LEU CD2 1 1 12 9102 2 2 11 LEU CG C 1.365 -1.609 3.871 1.00 . B B . 11 LEU CG 1 1 12 9103 2 2 11 LEU H H 2.866 0.796 6.877 1.00 . B B . 11 LEU H 1 1 12 9104 2 2 11 LEU HA H 2.282 1.025 3.968 1.00 . B B . 11 LEU HA 1 1 12 9105 2 2 11 LEU HB2 H 3.045 -1.136 5.139 1.00 . B B . 11 LEU HB2 1 1 12 9106 2 2 11 LEU HB3 H 1.524 -1.165 5.982 1.00 . B B . 11 LEU HB3 1 1 12 9107 2 2 11 LEU HD11 H 3.166 -1.518 2.671 1.00 . B B . 11 LEU HD11 1 1 12 9108 2 2 11 LEU HD12 H 1.719 -1.778 1.729 1.00 . B B . 11 LEU HD12 1 1 12 9109 2 2 11 LEU HD13 H 2.061 -0.199 2.367 1.00 . B B . 11 LEU HD13 1 1 12 9110 2 2 11 LEU HD21 H 2.637 -3.312 4.191 1.00 . B B . 11 LEU HD21 1 1 12 9111 2 2 11 LEU HD22 H 1.107 -3.388 5.053 1.00 . B B . 11 LEU HD22 1 1 12 9112 2 2 11 LEU HD23 H 1.158 -3.687 3.328 1.00 . B B . 11 LEU HD23 1 1 12 9113 2 2 11 LEU HG H 0.304 -1.393 3.785 1.00 . B B . 11 LEU HG 1 1 12 9114 2 2 11 LEU N N 2.766 1.256 6.016 1.00 . B B . 11 LEU N 1 1 12 9115 2 2 11 LEU O O -0.150 1.695 4.196 1.00 . B B . 11 LEU O 1 1 12 9116 2 2 12 VAL C C -1.398 3.187 6.255 1.00 . B B . 12 VAL C 1 1 12 9117 2 2 12 VAL CA C -1.413 1.675 6.543 1.00 . B B . 12 VAL CA 1 1 12 9118 2 2 12 VAL CB C -1.879 1.411 8.004 1.00 . B B . 12 VAL CB 1 1 12 9119 2 2 12 VAL CG1 C -0.876 1.902 9.006 1.00 . B B . 12 VAL CG1 1 1 12 9120 2 2 12 VAL CG2 C -3.154 2.239 8.245 1.00 . B B . 12 VAL CG2 1 1 12 9121 2 2 12 VAL H H 0.490 0.734 7.049 1.00 . B B . 12 VAL H 1 1 12 9122 2 2 12 VAL HA H -2.086 1.211 5.848 1.00 . B B . 12 VAL HA 1 1 12 9123 2 2 12 VAL HB H -2.031 0.355 8.163 1.00 . B B . 12 VAL HB 1 1 12 9124 2 2 12 VAL HG11 H 0.049 1.395 8.816 1.00 . B B . 12 VAL HG11 1 1 12 9125 2 2 12 VAL HG12 H -0.709 2.966 8.935 1.00 . B B . 12 VAL HG12 1 1 12 9126 2 2 12 VAL HG13 H -1.179 1.704 10.019 1.00 . B B . 12 VAL HG13 1 1 12 9127 2 2 12 VAL HG21 H -3.918 1.994 7.525 1.00 . B B . 12 VAL HG21 1 1 12 9128 2 2 12 VAL HG22 H -3.524 2.077 9.243 1.00 . B B . 12 VAL HG22 1 1 12 9129 2 2 12 VAL HG23 H -2.927 3.299 8.158 1.00 . B B . 12 VAL HG23 1 1 12 9130 2 2 12 VAL N N -0.028 1.141 6.321 1.00 . B B . 12 VAL N 1 1 12 9131 2 2 12 VAL O O -2.186 3.626 5.444 1.00 . B B . 12 VAL O 1 1 12 9132 2 2 13 GLU C C -0.359 5.717 5.104 1.00 . B B . 13 GLU C 1 1 12 9133 2 2 13 GLU CA C -0.481 5.428 6.611 1.00 . B B . 13 GLU CA 1 1 12 9134 2 2 13 GLU CB C 0.713 5.984 7.436 1.00 . B B . 13 GLU CB 1 1 12 9135 2 2 13 GLU CD C -0.713 5.586 9.560 1.00 . B B . 13 GLU CD 1 1 12 9136 2 2 13 GLU CG C 0.113 6.590 8.763 1.00 . B B . 13 GLU CG 1 1 12 9137 2 2 13 GLU H H 0.104 3.549 7.501 1.00 . B B . 13 GLU H 1 1 12 9138 2 2 13 GLU HA H -1.406 5.877 6.946 1.00 . B B . 13 GLU HA 1 1 12 9139 2 2 13 GLU HB2 H 1.401 5.186 7.692 1.00 . B B . 13 GLU HB2 1 1 12 9140 2 2 13 GLU HB3 H 1.244 6.746 6.883 1.00 . B B . 13 GLU HB3 1 1 12 9141 2 2 13 GLU HG2 H 0.906 6.915 9.416 1.00 . B B . 13 GLU HG2 1 1 12 9142 2 2 13 GLU HG3 H -0.524 7.433 8.554 1.00 . B B . 13 GLU HG3 1 1 12 9143 2 2 13 GLU N N -0.532 3.947 6.867 1.00 . B B . 13 GLU N 1 1 12 9144 2 2 13 GLU O O -0.545 6.819 4.621 1.00 . B B . 13 GLU O 1 1 12 9145 2 2 13 GLU OE1 O -0.091 4.828 10.276 1.00 . B B . 13 GLU OE1 1 1 12 9146 2 2 13 GLU OE2 O -1.918 5.645 9.392 1.00 . B B . 13 GLU OE2 1 1 12 9147 2 2 14 ALA C C -1.269 4.451 2.271 1.00 . B B . 14 ALA C 1 1 12 9148 2 2 14 ALA CA C 0.099 4.807 2.913 1.00 . B B . 14 ALA CA 1 1 12 9149 2 2 14 ALA CB C 1.256 3.859 2.478 1.00 . B B . 14 ALA CB 1 1 12 9150 2 2 14 ALA H H 0.103 3.821 4.824 1.00 . B B . 14 ALA H 1 1 12 9151 2 2 14 ALA HA H 0.294 5.838 2.709 1.00 . B B . 14 ALA HA 1 1 12 9152 2 2 14 ALA HB1 H 2.164 4.139 2.992 1.00 . B B . 14 ALA HB1 1 1 12 9153 2 2 14 ALA HB2 H 1.045 2.826 2.707 1.00 . B B . 14 ALA HB2 1 1 12 9154 2 2 14 ALA HB3 H 1.426 3.945 1.415 1.00 . B B . 14 ALA HB3 1 1 12 9155 2 2 14 ALA N N -0.041 4.677 4.376 1.00 . B B . 14 ALA N 1 1 12 9156 2 2 14 ALA O O -1.851 5.299 1.620 1.00 . B B . 14 ALA O 1 1 12 9157 2 2 15 LEU C C -4.270 3.921 2.389 1.00 . B B . 15 LEU C 1 1 12 9158 2 2 15 LEU CA C -3.144 3.050 1.760 1.00 . B B . 15 LEU CA 1 1 12 9159 2 2 15 LEU CB C -3.555 1.506 1.776 1.00 . B B . 15 LEU CB 1 1 12 9160 2 2 15 LEU CD1 C -3.981 1.178 4.242 1.00 . B B . 15 LEU CD1 1 1 12 9161 2 2 15 LEU CD2 C -4.133 -0.669 2.718 1.00 . B B . 15 LEU CD2 1 1 12 9162 2 2 15 LEU CG C -3.339 0.609 2.996 1.00 . B B . 15 LEU CG 1 1 12 9163 2 2 15 LEU H H -1.336 2.598 2.976 1.00 . B B . 15 LEU H 1 1 12 9164 2 2 15 LEU HA H -3.050 3.356 0.733 1.00 . B B . 15 LEU HA 1 1 12 9165 2 2 15 LEU HB2 H -4.611 1.483 1.556 1.00 . B B . 15 LEU HB2 1 1 12 9166 2 2 15 LEU HB3 H -3.038 1.039 0.950 1.00 . B B . 15 LEU HB3 1 1 12 9167 2 2 15 LEU HD11 H -5.034 1.333 4.094 1.00 . B B . 15 LEU HD11 1 1 12 9168 2 2 15 LEU HD12 H -3.862 0.489 5.066 1.00 . B B . 15 LEU HD12 1 1 12 9169 2 2 15 LEU HD13 H -3.528 2.108 4.514 1.00 . B B . 15 LEU HD13 1 1 12 9170 2 2 15 LEU HD21 H -3.791 -1.144 1.813 1.00 . B B . 15 LEU HD21 1 1 12 9171 2 2 15 LEU HD22 H -4.020 -1.357 3.543 1.00 . B B . 15 LEU HD22 1 1 12 9172 2 2 15 LEU HD23 H -5.185 -0.448 2.615 1.00 . B B . 15 LEU HD23 1 1 12 9173 2 2 15 LEU HG H -2.291 0.352 3.104 1.00 . B B . 15 LEU HG 1 1 12 9174 2 2 15 LEU N N -1.811 3.265 2.433 1.00 . B B . 15 LEU N 1 1 12 9175 2 2 15 LEU O O -5.181 4.341 1.705 1.00 . B B . 15 LEU O 1 1 12 9176 2 2 16 TYR C C -5.317 6.395 3.672 1.00 . B B . 16 TYR C 1 1 12 9177 2 2 16 TYR CA C -5.189 5.031 4.403 1.00 . B B . 16 TYR CA 1 1 12 9178 2 2 16 TYR CB C -4.645 5.151 5.849 1.00 . B B . 16 TYR CB 1 1 12 9179 2 2 16 TYR CD1 C -6.823 6.362 6.537 1.00 . B B . 16 TYR CD1 1 1 12 9180 2 2 16 TYR CD2 C -5.013 6.224 8.064 1.00 . B B . 16 TYR CD2 1 1 12 9181 2 2 16 TYR CE1 C -7.553 7.064 7.480 1.00 . B B . 16 TYR CE1 1 1 12 9182 2 2 16 TYR CE2 C -5.749 6.924 8.999 1.00 . B B . 16 TYR CE2 1 1 12 9183 2 2 16 TYR CG C -5.539 5.934 6.824 1.00 . B B . 16 TYR CG 1 1 12 9184 2 2 16 TYR CZ C -7.020 7.346 8.708 1.00 . B B . 16 TYR CZ 1 1 12 9185 2 2 16 TYR H H -3.419 3.844 4.159 1.00 . B B . 16 TYR H 1 1 12 9186 2 2 16 TYR HA H -6.157 4.554 4.373 1.00 . B B . 16 TYR HA 1 1 12 9187 2 2 16 TYR HB2 H -4.498 4.163 6.264 1.00 . B B . 16 TYR HB2 1 1 12 9188 2 2 16 TYR HB3 H -3.676 5.637 5.832 1.00 . B B . 16 TYR HB3 1 1 12 9189 2 2 16 TYR HD1 H -7.271 6.155 5.578 1.00 . B B . 16 TYR HD1 1 1 12 9190 2 2 16 TYR HD2 H -4.008 5.899 8.310 1.00 . B B . 16 TYR HD2 1 1 12 9191 2 2 16 TYR HE1 H -8.555 7.401 7.263 1.00 . B B . 16 TYR HE1 1 1 12 9192 2 2 16 TYR HE2 H -5.314 7.136 9.964 1.00 . B B . 16 TYR HE2 1 1 12 9193 2 2 16 TYR HH H -7.118 8.548 10.143 1.00 . B B . 16 TYR HH 1 1 12 9194 2 2 16 TYR N N -4.181 4.192 3.661 1.00 . B B . 16 TYR N 1 1 12 9195 2 2 16 TYR O O -6.336 7.053 3.684 1.00 . B B . 16 TYR O 1 1 12 9196 2 2 16 TYR OH O -7.755 8.046 9.634 1.00 . B B . 16 TYR OH 1 1 12 9197 2 2 17 LEU C C -4.530 7.715 0.807 1.00 . B B . 17 LEU C 1 1 12 9198 2 2 17 LEU CA C -4.130 8.021 2.276 1.00 . B B . 17 LEU CA 1 1 12 9199 2 2 17 LEU CB C -2.661 8.492 2.459 1.00 . B B . 17 LEU CB 1 1 12 9200 2 2 17 LEU CD1 C -3.285 10.914 2.145 1.00 . B B . 17 LEU CD1 1 1 12 9201 2 2 17 LEU CD2 C -0.934 10.209 2.080 1.00 . B B . 17 LEU CD2 1 1 12 9202 2 2 17 LEU CG C -2.349 9.789 1.693 1.00 . B B . 17 LEU CG 1 1 12 9203 2 2 17 LEU H H -3.465 6.147 3.110 1.00 . B B . 17 LEU H 1 1 12 9204 2 2 17 LEU HA H -4.835 8.742 2.664 1.00 . B B . 17 LEU HA 1 1 12 9205 2 2 17 LEU HB2 H -2.480 8.646 3.515 1.00 . B B . 17 LEU HB2 1 1 12 9206 2 2 17 LEU HB3 H -1.983 7.714 2.133 1.00 . B B . 17 LEU HB3 1 1 12 9207 2 2 17 LEU HD11 H -3.194 11.085 3.209 1.00 . B B . 17 LEU HD11 1 1 12 9208 2 2 17 LEU HD12 H -3.041 11.828 1.626 1.00 . B B . 17 LEU HD12 1 1 12 9209 2 2 17 LEU HD13 H -4.311 10.666 1.919 1.00 . B B . 17 LEU HD13 1 1 12 9210 2 2 17 LEU HD21 H -0.872 10.373 3.146 1.00 . B B . 17 LEU HD21 1 1 12 9211 2 2 17 LEU HD22 H -0.226 9.439 1.813 1.00 . B B . 17 LEU HD22 1 1 12 9212 2 2 17 LEU HD23 H -0.659 11.122 1.574 1.00 . B B . 17 LEU HD23 1 1 12 9213 2 2 17 LEU HG H -2.427 9.633 0.622 1.00 . B B . 17 LEU HG 1 1 12 9214 2 2 17 LEU N N -4.232 6.750 3.050 1.00 . B B . 17 LEU N 1 1 12 9215 2 2 17 LEU O O -5.466 8.308 0.312 1.00 . B B . 17 LEU O 1 1 12 9216 2 2 18 VAL C C -5.671 6.466 -1.633 1.00 . B B . 18 VAL C 1 1 12 9217 2 2 18 VAL CA C -4.150 6.432 -1.281 1.00 . B B . 18 VAL CA 1 1 12 9218 2 2 18 VAL CB C -3.555 5.028 -1.524 1.00 . B B . 18 VAL CB 1 1 12 9219 2 2 18 VAL CG1 C -3.964 4.503 -2.906 1.00 . B B . 18 VAL CG1 1 1 12 9220 2 2 18 VAL CG2 C -2.028 5.150 -1.550 1.00 . B B . 18 VAL CG2 1 1 12 9221 2 2 18 VAL H H -3.097 6.382 0.636 1.00 . B B . 18 VAL H 1 1 12 9222 2 2 18 VAL HA H -3.637 7.089 -1.964 1.00 . B B . 18 VAL HA 1 1 12 9223 2 2 18 VAL HB H -3.889 4.365 -0.750 1.00 . B B . 18 VAL HB 1 1 12 9224 2 2 18 VAL HG11 H -3.637 5.175 -3.687 1.00 . B B . 18 VAL HG11 1 1 12 9225 2 2 18 VAL HG12 H -3.520 3.537 -3.089 1.00 . B B . 18 VAL HG12 1 1 12 9226 2 2 18 VAL HG13 H -5.039 4.401 -2.987 1.00 . B B . 18 VAL HG13 1 1 12 9227 2 2 18 VAL HG21 H -1.657 5.553 -0.622 1.00 . B B . 18 VAL HG21 1 1 12 9228 2 2 18 VAL HG22 H -1.578 4.186 -1.712 1.00 . B B . 18 VAL HG22 1 1 12 9229 2 2 18 VAL HG23 H -1.723 5.809 -2.350 1.00 . B B . 18 VAL HG23 1 1 12 9230 2 2 18 VAL N N -3.834 6.813 0.157 1.00 . B B . 18 VAL N 1 1 12 9231 2 2 18 VAL O O -6.046 7.078 -2.610 1.00 . B B . 18 VAL O 1 1 12 9232 2 2 19 CYS C C -8.702 6.128 0.276 1.00 . B B . 19 CYS C 1 1 12 9233 2 2 19 CYS CA C -7.964 5.734 -1.037 1.00 . B B . 19 CYS CA 1 1 12 9234 2 2 19 CYS CB C -8.323 4.325 -1.443 1.00 . B B . 19 CYS CB 1 1 12 9235 2 2 19 CYS H H -6.066 5.302 -0.083 1.00 . B B . 19 CYS H 1 1 12 9236 2 2 19 CYS HA H -8.261 6.420 -1.819 1.00 . B B . 19 CYS HA 1 1 12 9237 2 2 19 CYS HB2 H -9.379 4.339 -1.667 1.00 . B B . 19 CYS HB2 1 1 12 9238 2 2 19 CYS HB3 H -7.784 4.100 -2.350 1.00 . B B . 19 CYS HB3 1 1 12 9239 2 2 19 CYS HG H -8.834 2.917 0.281 1.00 . B B . 19 CYS HG 1 1 12 9240 2 2 19 CYS N N -6.464 5.790 -0.835 1.00 . B B . 19 CYS N 1 1 12 9241 2 2 19 CYS O O -9.559 5.427 0.804 1.00 . B B . 19 CYS O 1 1 12 9242 2 2 19 CYS SG S -8.016 3.040 -0.206 1.00 . B B . 19 CYS SG 1 1 12 9243 2 2 20 GLY C C -10.376 7.975 2.147 1.00 . B B . 20 GLY C 1 1 12 9244 2 2 20 GLY CA C -8.848 7.866 2.037 1.00 . B B . 20 GLY CA 1 1 12 9245 2 2 20 GLY H H -7.589 7.720 0.253 1.00 . B B . 20 GLY H 1 1 12 9246 2 2 20 GLY HA2 H -8.515 7.261 2.863 1.00 . B B . 20 GLY HA2 1 1 12 9247 2 2 20 GLY HA3 H -8.434 8.854 2.156 1.00 . B B . 20 GLY HA3 1 1 12 9248 2 2 20 GLY N N -8.294 7.262 0.767 1.00 . B B . 20 GLY N 1 1 12 9249 2 2 20 GLY O O -10.950 7.764 3.196 1.00 . B B . 20 GLY O 1 1 12 9250 2 2 21 GLU C C -13.288 7.265 1.278 1.00 . B B . 21 GLU C 1 1 12 9251 2 2 21 GLU CA C -12.461 8.486 0.890 1.00 . B B . 21 GLU CA 1 1 12 9252 2 2 21 GLU CB C -12.864 8.792 -0.596 1.00 . B B . 21 GLU CB 1 1 12 9253 2 2 21 GLU CD C -10.682 7.981 -1.679 1.00 . B B . 21 GLU CD 1 1 12 9254 2 2 21 GLU CG C -11.636 9.157 -1.486 1.00 . B B . 21 GLU CG 1 1 12 9255 2 2 21 GLU H H -10.393 8.436 0.266 1.00 . B B . 21 GLU H 1 1 12 9256 2 2 21 GLU HA H -12.785 9.291 1.533 1.00 . B B . 21 GLU HA 1 1 12 9257 2 2 21 GLU HB2 H -13.289 7.888 -1.033 1.00 . B B . 21 GLU HB2 1 1 12 9258 2 2 21 GLU HB3 H -13.628 9.548 -0.632 1.00 . B B . 21 GLU HB3 1 1 12 9259 2 2 21 GLU HG2 H -11.950 9.448 -2.474 1.00 . B B . 21 GLU HG2 1 1 12 9260 2 2 21 GLU HG3 H -11.070 9.968 -1.055 1.00 . B B . 21 GLU HG3 1 1 12 9261 2 2 21 GLU N N -10.969 8.308 1.046 1.00 . B B . 21 GLU N 1 1 12 9262 2 2 21 GLU O O -14.227 7.301 2.051 1.00 . B B . 21 GLU O 1 1 12 9263 2 2 21 GLU OE1 O -11.104 6.844 -1.553 1.00 . B B . 21 GLU OE1 1 1 12 9264 2 2 21 GLU OE2 O -9.559 8.337 -1.934 1.00 . B B . 21 GLU OE2 1 1 12 9265 2 2 22 ARG C C -13.062 3.930 1.957 1.00 . B B . 22 ARG C 1 1 12 9266 2 2 22 ARG CA C -13.509 4.893 0.854 1.00 . B B . 22 ARG CA 1 1 12 9267 2 2 22 ARG CB C -13.439 4.269 -0.563 1.00 . B B . 22 ARG CB 1 1 12 9268 2 2 22 ARG CD C -13.405 1.875 -0.446 1.00 . B B . 22 ARG CD 1 1 12 9269 2 2 22 ARG CG C -14.347 3.016 -0.581 1.00 . B B . 22 ARG CG 1 1 12 9270 2 2 22 ARG CZ C -13.511 0.295 1.291 1.00 . B B . 22 ARG CZ 1 1 12 9271 2 2 22 ARG H H -12.107 6.306 0.070 1.00 . B B . 22 ARG H 1 1 12 9272 2 2 22 ARG HA H -14.492 5.137 1.098 1.00 . B B . 22 ARG HA 1 1 12 9273 2 2 22 ARG HB2 H -13.726 4.987 -1.312 1.00 . B B . 22 ARG HB2 1 1 12 9274 2 2 22 ARG HB3 H -12.394 4.034 -0.763 1.00 . B B . 22 ARG HB3 1 1 12 9275 2 2 22 ARG HD2 H -13.074 1.580 -1.434 1.00 . B B . 22 ARG HD2 1 1 12 9276 2 2 22 ARG HD3 H -12.538 2.210 0.123 1.00 . B B . 22 ARG HD3 1 1 12 9277 2 2 22 ARG HE H -14.949 0.378 -0.001 1.00 . B B . 22 ARG HE 1 1 12 9278 2 2 22 ARG HG2 H -15.067 3.034 0.227 1.00 . B B . 22 ARG HG2 1 1 12 9279 2 2 22 ARG HG3 H -14.886 2.964 -1.518 1.00 . B B . 22 ARG HG3 1 1 12 9280 2 2 22 ARG HH11 H -12.429 -0.820 0.164 1.00 . B B . 22 ARG HH11 1 1 12 9281 2 2 22 ARG HH12 H -12.175 -0.966 1.898 1.00 . B B . 22 ARG HH12 1 1 12 9282 2 2 22 ARG HH21 H -14.492 1.444 2.495 1.00 . B B . 22 ARG HH21 1 1 12 9283 2 2 22 ARG HH22 H -13.347 0.349 3.214 1.00 . B B . 22 ARG HH22 1 1 12 9284 2 2 22 ARG N N -12.868 6.200 0.669 1.00 . B B . 22 ARG N 1 1 12 9285 2 2 22 ARG NE N -14.091 0.757 0.272 1.00 . B B . 22 ARG NE 1 1 12 9286 2 2 22 ARG NH1 N -12.638 -0.570 1.104 1.00 . B B . 22 ARG NH1 1 1 12 9287 2 2 22 ARG NH2 N -13.811 0.724 2.419 1.00 . B B . 22 ARG NH2 1 1 12 9288 2 2 22 ARG O O -13.873 3.265 2.581 1.00 . B B . 22 ARG O 1 1 12 9289 2 2 23 GLY C C -10.839 1.520 2.788 1.00 . B B . 23 GLY C 1 1 12 9290 2 2 23 GLY CA C -11.230 2.936 3.232 1.00 . B B . 23 GLY CA 1 1 12 9291 2 2 23 GLY H H -11.255 4.448 1.586 1.00 . B B . 23 GLY H 1 1 12 9292 2 2 23 GLY HA2 H -10.347 3.392 3.656 1.00 . B B . 23 GLY HA2 1 1 12 9293 2 2 23 GLY HA3 H -11.953 2.831 4.029 1.00 . B B . 23 GLY HA3 1 1 12 9294 2 2 23 GLY N N -11.791 3.858 2.160 1.00 . B B . 23 GLY N 1 1 12 9295 2 2 23 GLY O O -11.441 0.564 3.226 1.00 . B B . 23 GLY O 1 1 12 9296 2 2 24 PHE C C -9.842 -1.264 1.493 1.00 . B B . 24 PHE C 1 1 12 9297 2 2 24 PHE CA C -9.254 0.203 1.322 1.00 . B B . 24 PHE CA 1 1 12 9298 2 2 24 PHE CB C -7.768 0.271 1.802 1.00 . B B . 24 PHE CB 1 1 12 9299 2 2 24 PHE CD1 C -8.036 -0.489 4.204 1.00 . B B . 24 PHE CD1 1 1 12 9300 2 2 24 PHE CD2 C -7.383 1.760 3.812 1.00 . B B . 24 PHE CD2 1 1 12 9301 2 2 24 PHE CE1 C -8.008 -0.263 5.562 1.00 . B B . 24 PHE CE1 1 1 12 9302 2 2 24 PHE CE2 C -7.353 1.990 5.174 1.00 . B B . 24 PHE CE2 1 1 12 9303 2 2 24 PHE CG C -7.726 0.516 3.319 1.00 . B B . 24 PHE CG 1 1 12 9304 2 2 24 PHE CZ C -7.666 0.977 6.049 1.00 . B B . 24 PHE CZ 1 1 12 9305 2 2 24 PHE H H -9.507 2.337 1.682 1.00 . B B . 24 PHE H 1 1 12 9306 2 2 24 PHE HA H -9.258 0.374 0.261 1.00 . B B . 24 PHE HA 1 1 12 9307 2 2 24 PHE HB2 H -7.241 -0.646 1.590 1.00 . B B . 24 PHE HB2 1 1 12 9308 2 2 24 PHE HB3 H -7.249 1.091 1.331 1.00 . B B . 24 PHE HB3 1 1 12 9309 2 2 24 PHE HD1 H -8.307 -1.466 3.838 1.00 . B B . 24 PHE HD1 1 1 12 9310 2 2 24 PHE HD2 H -7.131 2.565 3.135 1.00 . B B . 24 PHE HD2 1 1 12 9311 2 2 24 PHE HE1 H -8.256 -1.062 6.249 1.00 . B B . 24 PHE HE1 1 1 12 9312 2 2 24 PHE HE2 H -7.085 2.964 5.562 1.00 . B B . 24 PHE HE2 1 1 12 9313 2 2 24 PHE HZ H -7.644 1.152 7.115 1.00 . B B . 24 PHE HZ 1 1 12 9314 2 2 24 PHE N N -9.861 1.460 1.935 1.00 . B B . 24 PHE N 1 1 12 9315 2 2 24 PHE O O -10.548 -1.605 2.415 1.00 . B B . 24 PHE O 1 1 12 9316 2 2 25 PHE C C -8.936 -4.624 0.292 1.00 . B B . 25 PHE C 1 1 12 9317 2 2 25 PHE CA C -10.049 -3.584 0.648 1.00 . B B . 25 PHE CA 1 1 12 9318 2 2 25 PHE CB C -11.265 -3.734 -0.325 1.00 . B B . 25 PHE CB 1 1 12 9319 2 2 25 PHE CD1 C -11.769 -6.089 0.541 1.00 . B B . 25 PHE CD1 1 1 12 9320 2 2 25 PHE CD2 C -13.555 -4.533 0.369 1.00 . B B . 25 PHE CD2 1 1 12 9321 2 2 25 PHE CE1 C -12.643 -7.040 1.024 1.00 . B B . 25 PHE CE1 1 1 12 9322 2 2 25 PHE CE2 C -14.431 -5.483 0.851 1.00 . B B . 25 PHE CE2 1 1 12 9323 2 2 25 PHE CG C -12.215 -4.823 0.209 1.00 . B B . 25 PHE CG 1 1 12 9324 2 2 25 PHE CZ C -13.976 -6.737 1.179 1.00 . B B . 25 PHE CZ 1 1 12 9325 2 2 25 PHE H H -8.962 -1.910 -0.168 1.00 . B B . 25 PHE H 1 1 12 9326 2 2 25 PHE HA H -10.377 -3.804 1.657 1.00 . B B . 25 PHE HA 1 1 12 9327 2 2 25 PHE HB2 H -11.811 -2.808 -0.401 1.00 . B B . 25 PHE HB2 1 1 12 9328 2 2 25 PHE HB3 H -10.952 -4.041 -1.313 1.00 . B B . 25 PHE HB3 1 1 12 9329 2 2 25 PHE HD1 H -10.731 -6.355 0.424 1.00 . B B . 25 PHE HD1 1 1 12 9330 2 2 25 PHE HD2 H -13.926 -3.553 0.112 1.00 . B B . 25 PHE HD2 1 1 12 9331 2 2 25 PHE HE1 H -12.282 -8.027 1.282 1.00 . B B . 25 PHE HE1 1 1 12 9332 2 2 25 PHE HE2 H -15.481 -5.246 0.971 1.00 . B B . 25 PHE HE2 1 1 12 9333 2 2 25 PHE HZ H -14.661 -7.484 1.559 1.00 . B B . 25 PHE HZ 1 1 12 9334 2 2 25 PHE N N -9.540 -2.155 0.580 1.00 . B B . 25 PHE N 1 1 12 9335 2 2 25 PHE O O -8.654 -4.918 -0.856 1.00 . B B . 25 PHE O 1 1 12 9336 2 2 26 TYR C C -7.380 -7.323 0.143 1.00 . B B . 26 TYR C 1 1 12 9337 2 2 26 TYR CA C -7.224 -6.164 1.200 1.00 . B B . 26 TYR CA 1 1 12 9338 2 2 26 TYR CB C -7.023 -6.729 2.642 1.00 . B B . 26 TYR CB 1 1 12 9339 2 2 26 TYR CD1 C -5.137 -8.323 2.106 1.00 . B B . 26 TYR CD1 1 1 12 9340 2 2 26 TYR CD2 C -4.644 -6.367 3.364 1.00 . B B . 26 TYR CD2 1 1 12 9341 2 2 26 TYR CE1 C -3.807 -8.675 2.144 1.00 . B B . 26 TYR CE1 1 1 12 9342 2 2 26 TYR CE2 C -3.314 -6.732 3.395 1.00 . B B . 26 TYR CE2 1 1 12 9343 2 2 26 TYR CG C -5.563 -7.163 2.715 1.00 . B B . 26 TYR CG 1 1 12 9344 2 2 26 TYR CZ C -2.905 -7.880 2.784 1.00 . B B . 26 TYR CZ 1 1 12 9345 2 2 26 TYR H H -8.615 -4.845 2.206 1.00 . B B . 26 TYR H 1 1 12 9346 2 2 26 TYR HA H -6.324 -5.636 0.915 1.00 . B B . 26 TYR HA 1 1 12 9347 2 2 26 TYR HB2 H -7.218 -5.994 3.409 1.00 . B B . 26 TYR HB2 1 1 12 9348 2 2 26 TYR HB3 H -7.654 -7.592 2.812 1.00 . B B . 26 TYR HB3 1 1 12 9349 2 2 26 TYR HD1 H -5.848 -8.962 1.604 1.00 . B B . 26 TYR HD1 1 1 12 9350 2 2 26 TYR HD2 H -4.967 -5.458 3.851 1.00 . B B . 26 TYR HD2 1 1 12 9351 2 2 26 TYR HE1 H -3.457 -9.578 1.671 1.00 . B B . 26 TYR HE1 1 1 12 9352 2 2 26 TYR HE2 H -2.582 -6.125 3.903 1.00 . B B . 26 TYR HE2 1 1 12 9353 2 2 26 TYR HH H -1.434 -8.804 3.544 1.00 . B B . 26 TYR HH 1 1 12 9354 2 2 26 TYR N N -8.326 -5.143 1.320 1.00 . B B . 26 TYR N 1 1 12 9355 2 2 26 TYR O O -7.764 -8.432 0.456 1.00 . B B . 26 TYR O 1 1 12 9356 2 2 26 TYR OH O -1.583 -8.231 2.784 1.00 . B B . 26 TYR OH 1 1 12 9357 2 2 27 THR C C -5.845 -8.458 -2.863 1.00 . B B . 27 THR C 1 1 12 9358 2 2 27 THR CA C -7.197 -8.096 -2.187 1.00 . B B . 27 THR CA 1 1 12 9359 2 2 27 THR CB C -8.194 -7.578 -3.253 1.00 . B B . 27 THR CB 1 1 12 9360 2 2 27 THR CG2 C -9.596 -7.446 -2.697 1.00 . B B . 27 THR CG2 1 1 12 9361 2 2 27 THR H H -6.786 -6.153 -1.329 1.00 . B B . 27 THR H 1 1 12 9362 2 2 27 THR HA H -7.624 -8.999 -1.782 1.00 . B B . 27 THR HA 1 1 12 9363 2 2 27 THR HB H -8.163 -8.139 -4.180 1.00 . B B . 27 THR HB 1 1 12 9364 2 2 27 THR HG1 H -8.197 -5.742 -2.703 1.00 . B B . 27 THR HG1 1 1 12 9365 2 2 27 THR HG21 H -9.627 -6.779 -1.850 1.00 . B B . 27 THR HG21 1 1 12 9366 2 2 27 THR HG22 H -10.259 -7.061 -3.457 1.00 . B B . 27 THR HG22 1 1 12 9367 2 2 27 THR HG23 H -9.963 -8.408 -2.375 1.00 . B B . 27 THR HG23 1 1 12 9368 2 2 27 THR N N -7.083 -7.053 -1.094 1.00 . B B . 27 THR N 1 1 12 9369 2 2 27 THR O O -5.471 -7.840 -3.843 1.00 . B B . 27 THR O 1 1 12 9370 2 2 27 THR OG1 O -7.850 -6.224 -3.471 1.00 . B B . 27 THR OG1 1 1 12 9371 2 2 28 PRO C C -3.427 -9.472 -4.295 1.00 . B B . 28 PRO C 1 1 12 9372 2 2 28 PRO CA C -3.803 -9.905 -2.863 1.00 . B B . 28 PRO CA 1 1 12 9373 2 2 28 PRO CB C -3.871 -11.427 -2.661 1.00 . B B . 28 PRO CB 1 1 12 9374 2 2 28 PRO CD C -5.693 -10.492 -1.386 1.00 . B B . 28 PRO CD 1 1 12 9375 2 2 28 PRO CG C -4.535 -11.496 -1.274 1.00 . B B . 28 PRO CG 1 1 12 9376 2 2 28 PRO HA H -3.038 -9.503 -2.242 1.00 . B B . 28 PRO HA 1 1 12 9377 2 2 28 PRO HB2 H -4.468 -11.924 -3.415 1.00 . B B . 28 PRO HB2 1 1 12 9378 2 2 28 PRO HB3 H -2.879 -11.863 -2.638 1.00 . B B . 28 PRO HB3 1 1 12 9379 2 2 28 PRO HD2 H -6.574 -10.958 -1.808 1.00 . B B . 28 PRO HD2 1 1 12 9380 2 2 28 PRO HD3 H -5.936 -10.053 -0.425 1.00 . B B . 28 PRO HD3 1 1 12 9381 2 2 28 PRO HG2 H -4.903 -12.490 -1.058 1.00 . B B . 28 PRO HG2 1 1 12 9382 2 2 28 PRO HG3 H -3.850 -11.196 -0.491 1.00 . B B . 28 PRO HG3 1 1 12 9383 2 2 28 PRO N N -5.147 -9.444 -2.311 1.00 . B B . 28 PRO N 1 1 12 9384 2 2 28 PRO O O -2.411 -8.863 -4.568 1.00 . B B . 28 PRO O 1 1 12 9385 2 2 29 LYS C C -3.080 -8.736 -7.149 1.00 . B B . 29 LYS C 1 1 12 9386 2 2 29 LYS CA C -4.302 -9.579 -6.628 1.00 . B B . 29 LYS CA 1 1 12 9387 2 2 29 LYS CB C -5.714 -8.927 -6.863 1.00 . B B . 29 LYS CB 1 1 12 9388 2 2 29 LYS CD C -6.774 -6.840 -7.952 1.00 . B B . 29 LYS CD 1 1 12 9389 2 2 29 LYS CE C -6.644 -6.121 -6.575 1.00 . B B . 29 LYS CE 1 1 12 9390 2 2 29 LYS CG C -5.813 -8.073 -8.167 1.00 . B B . 29 LYS CG 1 1 12 9391 2 2 29 LYS H H -5.058 -10.321 -4.709 1.00 . B B . 29 LYS H 1 1 12 9392 2 2 29 LYS HA H -4.265 -10.526 -7.149 1.00 . B B . 29 LYS HA 1 1 12 9393 2 2 29 LYS HB2 H -6.443 -9.724 -6.922 1.00 . B B . 29 LYS HB2 1 1 12 9394 2 2 29 LYS HB3 H -5.974 -8.359 -5.986 1.00 . B B . 29 LYS HB3 1 1 12 9395 2 2 29 LYS HD2 H -6.582 -6.109 -8.726 1.00 . B B . 29 LYS HD2 1 1 12 9396 2 2 29 LYS HD3 H -7.798 -7.168 -8.068 1.00 . B B . 29 LYS HD3 1 1 12 9397 2 2 29 LYS HE2 H -7.021 -5.108 -6.672 1.00 . B B . 29 LYS HE2 1 1 12 9398 2 2 29 LYS HE3 H -7.255 -6.610 -5.822 1.00 . B B . 29 LYS HE3 1 1 12 9399 2 2 29 LYS HG2 H -4.865 -7.728 -8.555 1.00 . B B . 29 LYS HG2 1 1 12 9400 2 2 29 LYS HG3 H -6.242 -8.695 -8.946 1.00 . B B . 29 LYS HG3 1 1 12 9401 2 2 29 LYS HZ1 H -4.548 -6.508 -6.818 1.00 . B B . 29 LYS HZ1 1 1 12 9402 2 2 29 LYS HZ2 H -4.877 -5.126 -5.974 1.00 . B B . 29 LYS HZ2 1 1 12 9403 2 2 29 LYS HZ3 H -5.154 -6.614 -5.245 1.00 . B B . 29 LYS HZ3 1 1 12 9404 2 2 29 LYS N N -4.331 -9.843 -5.143 1.00 . B B . 29 LYS N 1 1 12 9405 2 2 29 LYS NZ N -5.219 -6.097 -6.142 1.00 . B B . 29 LYS NZ 1 1 12 9406 2 2 29 LYS O O -3.153 -7.527 -7.192 1.00 . B B . 29 LYS O 1 1 12 9407 2 2 30 THR C C -0.340 -9.094 -9.434 1.00 . B B . 30 THR C 1 1 12 9408 2 2 30 THR CA C -0.780 -8.634 -8.032 1.00 . B B . 30 THR CA 1 1 12 9409 2 2 30 THR CB C 0.401 -8.834 -7.071 1.00 . B B . 30 THR CB 1 1 12 9410 2 2 30 THR CG2 C 0.885 -10.262 -6.988 1.00 . B B . 30 THR CG2 1 1 12 9411 2 2 30 THR H H -1.986 -10.347 -7.452 1.00 . B B . 30 THR H 1 1 12 9412 2 2 30 THR HA H -0.974 -7.574 -8.095 1.00 . B B . 30 THR HA 1 1 12 9413 2 2 30 THR HB H 0.259 -8.351 -6.109 1.00 . B B . 30 THR HB 1 1 12 9414 2 2 30 THR HG1 H 1.991 -7.759 -7.109 1.00 . B B . 30 THR HG1 1 1 12 9415 2 2 30 THR HG21 H 1.214 -10.598 -7.960 1.00 . B B . 30 THR HG21 1 1 12 9416 2 2 30 THR HG22 H 1.724 -10.309 -6.311 1.00 . B B . 30 THR HG22 1 1 12 9417 2 2 30 THR HG23 H 0.103 -10.911 -6.632 1.00 . B B . 30 THR HG23 1 1 12 9418 2 2 30 THR N N -2.004 -9.374 -7.511 1.00 . B B . 30 THR N 1 1 12 9419 2 2 30 THR O O -0.862 -10.057 -9.973 1.00 . B B . 30 THR O 1 1 12 9420 2 2 30 THR OG1 O 1.491 -8.264 -7.769 1.00 . B B . 30 THR OG1 1 1 13 9421 1 1 1 GLY C C 0.260 -4.468 -4.027 1.00 . A A . 1 GLY C 1 1 13 9422 1 1 1 GLY CA C -0.811 -5.225 -4.813 1.00 . A A . 1 GLY CA 1 1 13 9423 1 1 1 GLY HA2 H -0.440 -5.348 -5.819 1.00 . A A . 1 GLY HA2 1 1 13 9424 1 1 1 GLY HA3 H -1.697 -4.610 -4.841 1.00 . A A . 1 GLY HA3 1 1 13 9425 1 1 1 GLY N N -1.157 -6.570 -4.223 1.00 . A A . 1 GLY N 1 1 13 9426 1 1 1 GLY O O 1.266 -4.051 -4.566 1.00 . A A . 1 GLY O 1 1 13 9427 1 1 2 ILE C C 1.876 -4.528 -1.029 1.00 . A A . 2 ILE C 1 1 13 9428 1 1 2 ILE CA C 0.987 -3.582 -1.860 1.00 . A A . 2 ILE CA 1 1 13 9429 1 1 2 ILE CB C 0.235 -2.625 -0.852 1.00 . A A . 2 ILE CB 1 1 13 9430 1 1 2 ILE CD1 C -1.703 -3.832 0.113 1.00 . A A . 2 ILE CD1 1 1 13 9431 1 1 2 ILE CG1 C -1.286 -2.728 -0.885 1.00 . A A . 2 ILE CG1 1 1 13 9432 1 1 2 ILE CG2 C 0.665 -1.164 -1.016 1.00 . A A . 2 ILE CG2 1 1 13 9433 1 1 2 ILE H H -0.823 -4.677 -2.414 1.00 . A A . 2 ILE H 1 1 13 9434 1 1 2 ILE HA H 1.647 -2.998 -2.479 1.00 . A A . 2 ILE HA 1 1 13 9435 1 1 2 ILE HB H 0.528 -2.894 0.150 1.00 . A A . 2 ILE HB 1 1 13 9436 1 1 2 ILE HD11 H -1.275 -4.789 -0.141 1.00 . A A . 2 ILE HD11 1 1 13 9437 1 1 2 ILE HD12 H -1.385 -3.565 1.117 1.00 . A A . 2 ILE HD12 1 1 13 9438 1 1 2 ILE HD13 H -2.773 -3.906 0.115 1.00 . A A . 2 ILE HD13 1 1 13 9439 1 1 2 ILE HG12 H -1.702 -1.771 -0.606 1.00 . A A . 2 ILE HG12 1 1 13 9440 1 1 2 ILE HG13 H -1.643 -2.951 -1.880 1.00 . A A . 2 ILE HG13 1 1 13 9441 1 1 2 ILE HG21 H 1.728 -1.049 -0.854 1.00 . A A . 2 ILE HG21 1 1 13 9442 1 1 2 ILE HG22 H 0.443 -0.800 -1.996 1.00 . A A . 2 ILE HG22 1 1 13 9443 1 1 2 ILE HG23 H 0.149 -0.549 -0.293 1.00 . A A . 2 ILE HG23 1 1 13 9444 1 1 2 ILE N N 0.013 -4.311 -2.758 1.00 . A A . 2 ILE N 1 1 13 9445 1 1 2 ILE O O 2.890 -4.128 -0.496 1.00 . A A . 2 ILE O 1 1 13 9446 1 1 3 VAL C C 3.666 -6.957 -0.906 1.00 . A A . 3 VAL C 1 1 13 9447 1 1 3 VAL CA C 2.386 -6.685 -0.100 1.00 . A A . 3 VAL CA 1 1 13 9448 1 1 3 VAL CB C 1.594 -8.008 0.220 1.00 . A A . 3 VAL CB 1 1 13 9449 1 1 3 VAL CG1 C 0.384 -7.675 1.112 1.00 . A A . 3 VAL CG1 1 1 13 9450 1 1 3 VAL CG2 C 1.045 -8.659 -1.060 1.00 . A A . 3 VAL CG2 1 1 13 9451 1 1 3 VAL H H 0.686 -6.080 -1.336 1.00 . A A . 3 VAL H 1 1 13 9452 1 1 3 VAL HA H 2.740 -6.148 0.769 1.00 . A A . 3 VAL HA 1 1 13 9453 1 1 3 VAL HB H 2.239 -8.713 0.734 1.00 . A A . 3 VAL HB 1 1 13 9454 1 1 3 VAL HG11 H 0.714 -7.220 2.034 1.00 . A A . 3 VAL HG11 1 1 13 9455 1 1 3 VAL HG12 H -0.285 -6.990 0.612 1.00 . A A . 3 VAL HG12 1 1 13 9456 1 1 3 VAL HG13 H -0.160 -8.578 1.353 1.00 . A A . 3 VAL HG13 1 1 13 9457 1 1 3 VAL HG21 H 1.852 -8.905 -1.737 1.00 . A A . 3 VAL HG21 1 1 13 9458 1 1 3 VAL HG22 H 0.523 -9.575 -0.817 1.00 . A A . 3 VAL HG22 1 1 13 9459 1 1 3 VAL HG23 H 0.358 -8.006 -1.576 1.00 . A A . 3 VAL HG23 1 1 13 9460 1 1 3 VAL N N 1.504 -5.771 -0.908 1.00 . A A . 3 VAL N 1 1 13 9461 1 1 3 VAL O O 3.786 -6.429 -1.993 1.00 . A A . 3 VAL O 1 1 13 9462 1 1 4 GLU C C 6.252 -6.834 -1.950 1.00 . A A . 4 GLU C 1 1 13 9463 1 1 4 GLU CA C 5.873 -8.067 -1.091 1.00 . A A . 4 GLU CA 1 1 13 9464 1 1 4 GLU CB C 5.634 -9.359 -1.926 1.00 . A A . 4 GLU CB 1 1 13 9465 1 1 4 GLU CD C 7.966 -9.111 -3.093 1.00 . A A . 4 GLU CD 1 1 13 9466 1 1 4 GLU CG C 7.019 -10.016 -2.323 1.00 . A A . 4 GLU CG 1 1 13 9467 1 1 4 GLU H H 4.378 -8.153 0.487 1.00 . A A . 4 GLU H 1 1 13 9468 1 1 4 GLU HA H 6.658 -8.162 -0.362 1.00 . A A . 4 GLU HA 1 1 13 9469 1 1 4 GLU HB2 H 5.059 -10.064 -1.342 1.00 . A A . 4 GLU HB2 1 1 13 9470 1 1 4 GLU HB3 H 5.063 -9.128 -2.816 1.00 . A A . 4 GLU HB3 1 1 13 9471 1 1 4 GLU HG2 H 7.549 -10.355 -1.446 1.00 . A A . 4 GLU HG2 1 1 13 9472 1 1 4 GLU HG3 H 6.854 -10.876 -2.955 1.00 . A A . 4 GLU HG3 1 1 13 9473 1 1 4 GLU N N 4.566 -7.755 -0.381 1.00 . A A . 4 GLU N 1 1 13 9474 1 1 4 GLU O O 6.600 -5.857 -1.332 1.00 . A A . 4 GLU O 1 1 13 9475 1 1 4 GLU OE1 O 7.616 -8.817 -4.216 1.00 . A A . 4 GLU OE1 1 1 13 9476 1 1 4 GLU OE2 O 8.979 -8.757 -2.518 1.00 . A A . 4 GLU OE2 1 1 13 9477 1 1 5 GLN C C 6.410 -4.240 -3.513 1.00 . A A . 5 GLN C 1 1 13 9478 1 1 5 GLN CA C 6.534 -5.680 -4.120 1.00 . A A . 5 GLN CA 1 1 13 9479 1 1 5 GLN CB C 5.642 -5.842 -5.371 1.00 . A A . 5 GLN CB 1 1 13 9480 1 1 5 GLN CD C 7.355 -6.284 -7.266 1.00 . A A . 5 GLN CD 1 1 13 9481 1 1 5 GLN CG C 6.381 -5.288 -6.640 1.00 . A A . 5 GLN CG 1 1 13 9482 1 1 5 GLN H H 5.936 -7.707 -3.650 1.00 . A A . 5 GLN H 1 1 13 9483 1 1 5 GLN HA H 7.584 -5.748 -4.382 1.00 . A A . 5 GLN HA 1 1 13 9484 1 1 5 GLN HB2 H 5.414 -6.891 -5.511 1.00 . A A . 5 GLN HB2 1 1 13 9485 1 1 5 GLN HB3 H 4.708 -5.318 -5.219 1.00 . A A . 5 GLN HB3 1 1 13 9486 1 1 5 GLN HE21 H 7.541 -7.592 -5.751 1.00 . A A . 5 GLN HE21 1 1 13 9487 1 1 5 GLN HE22 H 8.415 -7.883 -7.161 1.00 . A A . 5 GLN HE22 1 1 13 9488 1 1 5 GLN HG2 H 5.681 -5.009 -7.408 1.00 . A A . 5 GLN HG2 1 1 13 9489 1 1 5 GLN HG3 H 6.970 -4.416 -6.387 1.00 . A A . 5 GLN HG3 1 1 13 9490 1 1 5 GLN N N 6.196 -6.857 -3.242 1.00 . A A . 5 GLN N 1 1 13 9491 1 1 5 GLN NE2 N 7.792 -7.330 -6.661 1.00 . A A . 5 GLN NE2 1 1 13 9492 1 1 5 GLN O O 7.133 -3.373 -3.937 1.00 . A A . 5 GLN O 1 1 13 9493 1 1 5 GLN OE1 O 7.768 -6.134 -8.392 1.00 . A A . 5 GLN OE1 1 1 13 9494 1 1 6 CYS C C 5.763 -2.428 -0.490 1.00 . A A . 6 CYS C 1 1 13 9495 1 1 6 CYS CA C 5.477 -2.531 -2.028 1.00 . A A . 6 CYS CA 1 1 13 9496 1 1 6 CYS CB C 4.098 -1.973 -2.392 1.00 . A A . 6 CYS CB 1 1 13 9497 1 1 6 CYS H H 4.926 -4.665 -2.272 1.00 . A A . 6 CYS H 1 1 13 9498 1 1 6 CYS HA H 6.229 -1.924 -2.504 1.00 . A A . 6 CYS HA 1 1 13 9499 1 1 6 CYS HB2 H 3.370 -2.391 -1.728 1.00 . A A . 6 CYS HB2 1 1 13 9500 1 1 6 CYS HB3 H 4.122 -0.910 -2.194 1.00 . A A . 6 CYS HB3 1 1 13 9501 1 1 6 CYS HG H 2.955 -2.919 -4.185 1.00 . A A . 6 CYS HG 1 1 13 9502 1 1 6 CYS N N 5.530 -3.950 -2.582 1.00 . A A . 6 CYS N 1 1 13 9503 1 1 6 CYS O O 5.689 -1.385 0.126 1.00 . A A . 6 CYS O 1 1 13 9504 1 1 6 CYS SG S 3.578 -2.195 -4.114 1.00 . A A . 6 CYS SG 1 1 13 9505 1 1 7 CYS C C 7.977 -4.149 1.549 1.00 . A A . 7 CYS C 1 1 13 9506 1 1 7 CYS CA C 6.445 -3.816 1.497 1.00 . A A . 7 CYS CA 1 1 13 9507 1 1 7 CYS CB C 5.503 -4.964 1.903 1.00 . A A . 7 CYS CB 1 1 13 9508 1 1 7 CYS H H 6.107 -4.314 -0.562 1.00 . A A . 7 CYS H 1 1 13 9509 1 1 7 CYS HA H 6.282 -2.919 2.075 1.00 . A A . 7 CYS HA 1 1 13 9510 1 1 7 CYS HB2 H 4.567 -4.462 2.123 1.00 . A A . 7 CYS HB2 1 1 13 9511 1 1 7 CYS HB3 H 5.319 -5.568 1.027 1.00 . A A . 7 CYS HB3 1 1 13 9512 1 1 7 CYS HG H 6.503 -6.732 2.972 1.00 . A A . 7 CYS HG 1 1 13 9513 1 1 7 CYS N N 6.095 -3.560 0.053 1.00 . A A . 7 CYS N 1 1 13 9514 1 1 7 CYS O O 8.715 -3.808 2.452 1.00 . A A . 7 CYS O 1 1 13 9515 1 1 7 CYS SG S 5.932 -6.034 3.303 1.00 . A A . 7 CYS SG 1 1 13 9516 1 1 8 THR C C 9.773 -5.029 -1.364 1.00 . A A . 8 THR C 1 1 13 9517 1 1 8 THR CA C 9.731 -5.351 0.164 1.00 . A A . 8 THR CA 1 1 13 9518 1 1 8 THR CB C 9.893 -6.890 0.470 1.00 . A A . 8 THR CB 1 1 13 9519 1 1 8 THR CG2 C 8.697 -7.640 0.270 1.00 . A A . 8 THR CG2 1 1 13 9520 1 1 8 THR H H 7.675 -5.076 -0.130 1.00 . A A . 8 THR H 1 1 13 9521 1 1 8 THR HA H 10.463 -4.810 0.686 1.00 . A A . 8 THR HA 1 1 13 9522 1 1 8 THR HB H 10.290 -7.041 1.469 1.00 . A A . 8 THR HB 1 1 13 9523 1 1 8 THR HG1 H 10.240 -7.961 -1.133 1.00 . A A . 8 THR HG1 1 1 13 9524 1 1 8 THR HG21 H 8.394 -7.446 -0.744 1.00 . A A . 8 THR HG21 1 1 13 9525 1 1 8 THR HG22 H 8.877 -8.698 0.398 1.00 . A A . 8 THR HG22 1 1 13 9526 1 1 8 THR HG23 H 7.937 -7.300 0.955 1.00 . A A . 8 THR HG23 1 1 13 9527 1 1 8 THR N N 8.360 -4.845 0.521 1.00 . A A . 8 THR N 1 1 13 9528 1 1 8 THR O O 8.974 -4.212 -1.762 1.00 . A A . 8 THR O 1 1 13 9529 1 1 8 THR OG1 O 10.774 -7.466 -0.475 1.00 . A A . 8 THR OG1 1 1 13 9530 1 1 9 SER C C 9.950 -4.151 -4.396 1.00 . A A . 9 SER C 1 1 13 9531 1 1 9 SER CA C 10.726 -5.330 -3.702 1.00 . A A . 9 SER CA 1 1 13 9532 1 1 9 SER CB C 10.331 -6.623 -4.398 1.00 . A A . 9 SER CB 1 1 13 9533 1 1 9 SER H H 11.194 -6.252 -1.768 1.00 . A A . 9 SER H 1 1 13 9534 1 1 9 SER HA H 11.766 -5.175 -3.934 1.00 . A A . 9 SER HA 1 1 13 9535 1 1 9 SER HB2 H 9.305 -6.879 -4.163 1.00 . A A . 9 SER HB2 1 1 13 9536 1 1 9 SER HB3 H 10.458 -6.562 -5.470 1.00 . A A . 9 SER HB3 1 1 13 9537 1 1 9 SER HG H 10.623 -8.214 -3.391 1.00 . A A . 9 SER HG 1 1 13 9538 1 1 9 SER N N 10.610 -5.592 -2.186 1.00 . A A . 9 SER N 1 1 13 9539 1 1 9 SER O O 9.475 -4.251 -5.507 1.00 . A A . 9 SER O 1 1 13 9540 1 1 9 SER OG O 11.224 -7.581 -3.830 1.00 . A A . 9 SER OG 1 1 13 9541 1 1 10 ILE C C 8.633 -1.226 -5.241 1.00 . A A . 10 ILE C 1 1 13 9542 1 1 10 ILE CA C 9.246 -1.766 -3.937 1.00 . A A . 10 ILE CA 1 1 13 9543 1 1 10 ILE CB C 10.251 -0.668 -3.401 1.00 . A A . 10 ILE CB 1 1 13 9544 1 1 10 ILE CD1 C 8.362 0.347 -1.932 1.00 . A A . 10 ILE CD1 1 1 13 9545 1 1 10 ILE CG1 C 9.795 -0.263 -1.979 1.00 . A A . 10 ILE CG1 1 1 13 9546 1 1 10 ILE CG2 C 10.350 0.647 -4.258 1.00 . A A . 10 ILE CG2 1 1 13 9547 1 1 10 ILE H H 10.303 -3.185 -2.797 1.00 . A A . 10 ILE H 1 1 13 9548 1 1 10 ILE HA H 8.427 -1.786 -3.244 1.00 . A A . 10 ILE HA 1 1 13 9549 1 1 10 ILE HB H 11.235 -1.114 -3.343 1.00 . A A . 10 ILE HB 1 1 13 9550 1 1 10 ILE HD11 H 8.276 1.236 -2.540 1.00 . A A . 10 ILE HD11 1 1 13 9551 1 1 10 ILE HD12 H 7.601 -0.357 -2.215 1.00 . A A . 10 ILE HD12 1 1 13 9552 1 1 10 ILE HD13 H 8.135 0.603 -0.919 1.00 . A A . 10 ILE HD13 1 1 13 9553 1 1 10 ILE HG12 H 9.816 -1.121 -1.318 1.00 . A A . 10 ILE HG12 1 1 13 9554 1 1 10 ILE HG13 H 10.497 0.457 -1.611 1.00 . A A . 10 ILE HG13 1 1 13 9555 1 1 10 ILE HG21 H 10.650 0.422 -5.272 1.00 . A A . 10 ILE HG21 1 1 13 9556 1 1 10 ILE HG22 H 9.397 1.151 -4.307 1.00 . A A . 10 ILE HG22 1 1 13 9557 1 1 10 ILE HG23 H 11.065 1.331 -3.832 1.00 . A A . 10 ILE HG23 1 1 13 9558 1 1 10 ILE N N 9.888 -3.088 -3.660 1.00 . A A . 10 ILE N 1 1 13 9559 1 1 10 ILE O O 8.986 -1.433 -6.384 1.00 . A A . 10 ILE O 1 1 13 9560 1 1 11 CYS C C 6.721 1.806 -5.293 1.00 . A A . 11 CYS C 1 1 13 9561 1 1 11 CYS CA C 6.751 0.308 -5.751 1.00 . A A . 11 CYS CA 1 1 13 9562 1 1 11 CYS CB C 5.337 -0.322 -5.643 1.00 . A A . 11 CYS CB 1 1 13 9563 1 1 11 CYS H H 7.528 -0.403 -3.918 1.00 . A A . 11 CYS H 1 1 13 9564 1 1 11 CYS HA H 7.125 0.275 -6.766 1.00 . A A . 11 CYS HA 1 1 13 9565 1 1 11 CYS HB2 H 4.863 0.075 -4.758 1.00 . A A . 11 CYS HB2 1 1 13 9566 1 1 11 CYS HB3 H 4.758 -0.001 -6.490 1.00 . A A . 11 CYS HB3 1 1 13 9567 1 1 11 CYS HG H 5.142 -2.463 -6.476 1.00 . A A . 11 CYS HG 1 1 13 9568 1 1 11 CYS N N 7.652 -0.456 -4.874 1.00 . A A . 11 CYS N 1 1 13 9569 1 1 11 CYS O O 7.486 2.341 -4.510 1.00 . A A . 11 CYS O 1 1 13 9570 1 1 11 CYS SG S 5.137 -2.119 -5.579 1.00 . A A . 11 CYS SG 1 1 13 9571 1 1 12 SER C C 4.076 4.199 -5.025 1.00 . A A . 12 SER C 1 1 13 9572 1 1 12 SER CA C 5.422 3.876 -5.642 1.00 . A A . 12 SER CA 1 1 13 9573 1 1 12 SER CB C 5.480 4.596 -6.954 1.00 . A A . 12 SER CB 1 1 13 9574 1 1 12 SER H H 5.255 1.841 -6.448 1.00 . A A . 12 SER H 1 1 13 9575 1 1 12 SER HA H 6.128 4.339 -5.018 1.00 . A A . 12 SER HA 1 1 13 9576 1 1 12 SER HB2 H 4.660 4.278 -7.585 1.00 . A A . 12 SER HB2 1 1 13 9577 1 1 12 SER HB3 H 5.438 5.662 -6.775 1.00 . A A . 12 SER HB3 1 1 13 9578 1 1 12 SER HG H 6.585 3.381 -7.939 1.00 . A A . 12 SER HG 1 1 13 9579 1 1 12 SER N N 5.747 2.424 -5.856 1.00 . A A . 12 SER N 1 1 13 9580 1 1 12 SER O O 3.218 3.358 -4.890 1.00 . A A . 12 SER O 1 1 13 9581 1 1 12 SER OG O 6.731 4.259 -7.546 1.00 . A A . 12 SER OG 1 1 13 9582 1 1 13 LEU C C 1.555 5.555 -5.022 1.00 . A A . 13 LEU C 1 1 13 9583 1 1 13 LEU CA C 2.664 5.963 -4.053 1.00 . A A . 13 LEU CA 1 1 13 9584 1 1 13 LEU CB C 2.915 7.467 -3.937 1.00 . A A . 13 LEU CB 1 1 13 9585 1 1 13 LEU CD1 C 2.261 7.908 -1.612 1.00 . A A . 13 LEU CD1 1 1 13 9586 1 1 13 LEU CD2 C 1.992 9.645 -3.364 1.00 . A A . 13 LEU CD2 1 1 13 9587 1 1 13 LEU CG C 1.890 8.156 -3.068 1.00 . A A . 13 LEU CG 1 1 13 9588 1 1 13 LEU H H 4.669 6.050 -4.820 1.00 . A A . 13 LEU H 1 1 13 9589 1 1 13 LEU HA H 2.432 5.463 -3.122 1.00 . A A . 13 LEU HA 1 1 13 9590 1 1 13 LEU HB2 H 3.893 7.604 -3.501 1.00 . A A . 13 LEU HB2 1 1 13 9591 1 1 13 LEU HB3 H 2.908 7.925 -4.915 1.00 . A A . 13 LEU HB3 1 1 13 9592 1 1 13 LEU HD11 H 3.243 8.306 -1.402 1.00 . A A . 13 LEU HD11 1 1 13 9593 1 1 13 LEU HD12 H 1.537 8.385 -0.971 1.00 . A A . 13 LEU HD12 1 1 13 9594 1 1 13 LEU HD13 H 2.263 6.849 -1.403 1.00 . A A . 13 LEU HD13 1 1 13 9595 1 1 13 LEU HD21 H 2.980 10.022 -3.156 1.00 . A A . 13 LEU HD21 1 1 13 9596 1 1 13 LEU HD22 H 1.759 9.817 -4.409 1.00 . A A . 13 LEU HD22 1 1 13 9597 1 1 13 LEU HD23 H 1.272 10.184 -2.771 1.00 . A A . 13 LEU HD23 1 1 13 9598 1 1 13 LEU HG H 0.883 7.803 -3.280 1.00 . A A . 13 LEU HG 1 1 13 9599 1 1 13 LEU N N 3.923 5.439 -4.672 1.00 . A A . 13 LEU N 1 1 13 9600 1 1 13 LEU O O 0.697 4.763 -4.705 1.00 . A A . 13 LEU O 1 1 13 9601 1 1 14 TYR C C 0.439 4.242 -7.353 1.00 . A A . 14 TYR C 1 1 13 9602 1 1 14 TYR CA C 0.634 5.770 -7.257 1.00 . A A . 14 TYR CA 1 1 13 9603 1 1 14 TYR CB C 1.097 6.443 -8.615 1.00 . A A . 14 TYR CB 1 1 13 9604 1 1 14 TYR CD1 C 3.249 7.600 -8.115 1.00 . A A . 14 TYR CD1 1 1 13 9605 1 1 14 TYR CD2 C 3.330 5.624 -9.438 1.00 . A A . 14 TYR CD2 1 1 13 9606 1 1 14 TYR CE1 C 4.619 7.713 -8.185 1.00 . A A . 14 TYR CE1 1 1 13 9607 1 1 14 TYR CE2 C 4.700 5.746 -9.503 1.00 . A A . 14 TYR CE2 1 1 13 9608 1 1 14 TYR CG C 2.604 6.553 -8.740 1.00 . A A . 14 TYR CG 1 1 13 9609 1 1 14 TYR CZ C 5.341 6.781 -8.879 1.00 . A A . 14 TYR CZ 1 1 13 9610 1 1 14 TYR H H 2.414 6.691 -6.334 1.00 . A A . 14 TYR H 1 1 13 9611 1 1 14 TYR HA H -0.323 6.182 -6.969 1.00 . A A . 14 TYR HA 1 1 13 9612 1 1 14 TYR HB2 H 0.704 5.891 -9.457 1.00 . A A . 14 TYR HB2 1 1 13 9613 1 1 14 TYR HB3 H 0.673 7.438 -8.643 1.00 . A A . 14 TYR HB3 1 1 13 9614 1 1 14 TYR HD1 H 2.666 8.335 -7.572 1.00 . A A . 14 TYR HD1 1 1 13 9615 1 1 14 TYR HD2 H 2.826 4.807 -9.936 1.00 . A A . 14 TYR HD2 1 1 13 9616 1 1 14 TYR HE1 H 5.134 8.529 -7.698 1.00 . A A . 14 TYR HE1 1 1 13 9617 1 1 14 TYR HE2 H 5.294 5.029 -10.044 1.00 . A A . 14 TYR HE2 1 1 13 9618 1 1 14 TYR HH H 6.933 5.983 -8.520 1.00 . A A . 14 TYR HH 1 1 13 9619 1 1 14 TYR N N 1.656 6.093 -6.202 1.00 . A A . 14 TYR N 1 1 13 9620 1 1 14 TYR O O -0.576 3.778 -7.839 1.00 . A A . 14 TYR O 1 1 13 9621 1 1 14 TYR OH O 6.706 6.835 -8.923 1.00 . A A . 14 TYR OH 1 1 13 9622 1 1 15 GLN C C 0.228 1.673 -5.789 1.00 . A A . 15 GLN C 1 1 13 9623 1 1 15 GLN CA C 1.118 1.975 -7.006 1.00 . A A . 15 GLN CA 1 1 13 9624 1 1 15 GLN CB C 2.493 1.251 -7.043 1.00 . A A . 15 GLN CB 1 1 13 9625 1 1 15 GLN CD C 4.535 1.106 -8.656 1.00 . A A . 15 GLN CD 1 1 13 9626 1 1 15 GLN CG C 3.089 1.532 -8.487 1.00 . A A . 15 GLN CG 1 1 13 9627 1 1 15 GLN H H 2.240 3.801 -6.515 1.00 . A A . 15 GLN H 1 1 13 9628 1 1 15 GLN HA H 0.496 1.770 -7.828 1.00 . A A . 15 GLN HA 1 1 13 9629 1 1 15 GLN HB2 H 3.130 1.570 -6.240 1.00 . A A . 15 GLN HB2 1 1 13 9630 1 1 15 GLN HB3 H 2.303 0.189 -6.936 1.00 . A A . 15 GLN HB3 1 1 13 9631 1 1 15 GLN HE21 H 4.126 -0.680 -9.368 1.00 . A A . 15 GLN HE21 1 1 13 9632 1 1 15 GLN HE22 H 5.778 -0.277 -9.214 1.00 . A A . 15 GLN HE22 1 1 13 9633 1 1 15 GLN HG2 H 2.508 0.999 -9.226 1.00 . A A . 15 GLN HG2 1 1 13 9634 1 1 15 GLN HG3 H 3.041 2.582 -8.725 1.00 . A A . 15 GLN HG3 1 1 13 9635 1 1 15 GLN N N 1.393 3.447 -6.904 1.00 . A A . 15 GLN N 1 1 13 9636 1 1 15 GLN NE2 N 4.830 -0.051 -9.120 1.00 . A A . 15 GLN NE2 1 1 13 9637 1 1 15 GLN O O -0.811 1.060 -5.908 1.00 . A A . 15 GLN O 1 1 13 9638 1 1 15 GLN OE1 O 5.454 1.830 -8.357 1.00 . A A . 15 GLN OE1 1 1 13 9639 1 1 16 LEU C C -1.644 2.205 -3.748 1.00 . A A . 16 LEU C 1 1 13 9640 1 1 16 LEU CA C -0.155 1.912 -3.378 1.00 . A A . 16 LEU CA 1 1 13 9641 1 1 16 LEU CB C 0.391 2.887 -2.252 1.00 . A A . 16 LEU CB 1 1 13 9642 1 1 16 LEU CD1 C 2.596 1.565 -2.198 1.00 . A A . 16 LEU CD1 1 1 13 9643 1 1 16 LEU CD2 C 2.045 3.081 -0.352 1.00 . A A . 16 LEU CD2 1 1 13 9644 1 1 16 LEU CG C 1.434 2.131 -1.371 1.00 . A A . 16 LEU CG 1 1 13 9645 1 1 16 LEU H H 1.485 2.577 -4.699 1.00 . A A . 16 LEU H 1 1 13 9646 1 1 16 LEU HA H -0.058 0.893 -3.097 1.00 . A A . 16 LEU HA 1 1 13 9647 1 1 16 LEU HB2 H 0.823 3.782 -2.677 1.00 . A A . 16 LEU HB2 1 1 13 9648 1 1 16 LEU HB3 H -0.433 3.216 -1.626 1.00 . A A . 16 LEU HB3 1 1 13 9649 1 1 16 LEU HD11 H 3.119 2.355 -2.715 1.00 . A A . 16 LEU HD11 1 1 13 9650 1 1 16 LEU HD12 H 3.292 1.060 -1.540 1.00 . A A . 16 LEU HD12 1 1 13 9651 1 1 16 LEU HD13 H 2.249 0.847 -2.927 1.00 . A A . 16 LEU HD13 1 1 13 9652 1 1 16 LEU HD21 H 2.544 3.901 -0.845 1.00 . A A . 16 LEU HD21 1 1 13 9653 1 1 16 LEU HD22 H 1.278 3.476 0.298 1.00 . A A . 16 LEU HD22 1 1 13 9654 1 1 16 LEU HD23 H 2.770 2.550 0.254 1.00 . A A . 16 LEU HD23 1 1 13 9655 1 1 16 LEU HG H 0.940 1.334 -0.831 1.00 . A A . 16 LEU HG 1 1 13 9656 1 1 16 LEU N N 0.641 2.116 -4.644 1.00 . A A . 16 LEU N 1 1 13 9657 1 1 16 LEU O O -2.579 1.496 -3.420 1.00 . A A . 16 LEU O 1 1 13 9658 1 1 17 GLU C C -3.772 2.720 -5.860 1.00 . A A . 17 GLU C 1 1 13 9659 1 1 17 GLU CA C -3.102 3.795 -4.959 1.00 . A A . 17 GLU CA 1 1 13 9660 1 1 17 GLU CB C -2.804 5.095 -5.712 1.00 . A A . 17 GLU CB 1 1 13 9661 1 1 17 GLU CD C -1.722 7.401 -5.317 1.00 . A A . 17 GLU CD 1 1 13 9662 1 1 17 GLU CG C -2.143 6.074 -4.691 1.00 . A A . 17 GLU CG 1 1 13 9663 1 1 17 GLU H H -0.944 3.794 -4.643 1.00 . A A . 17 GLU H 1 1 13 9664 1 1 17 GLU HA H -3.765 3.984 -4.130 1.00 . A A . 17 GLU HA 1 1 13 9665 1 1 17 GLU HB2 H -2.145 4.932 -6.551 1.00 . A A . 17 GLU HB2 1 1 13 9666 1 1 17 GLU HB3 H -3.717 5.543 -6.082 1.00 . A A . 17 GLU HB3 1 1 13 9667 1 1 17 GLU HG2 H -2.841 6.290 -3.906 1.00 . A A . 17 GLU HG2 1 1 13 9668 1 1 17 GLU HG3 H -1.275 5.624 -4.244 1.00 . A A . 17 GLU HG3 1 1 13 9669 1 1 17 GLU N N -1.774 3.291 -4.454 1.00 . A A . 17 GLU N 1 1 13 9670 1 1 17 GLU O O -4.935 2.396 -5.725 1.00 . A A . 17 GLU O 1 1 13 9671 1 1 17 GLU OE1 O -2.588 8.026 -5.895 1.00 . A A . 17 GLU OE1 1 1 13 9672 1 1 17 GLU OE2 O -0.550 7.706 -5.178 1.00 . A A . 17 GLU OE2 1 1 13 9673 1 1 18 ASN C C -4.475 0.087 -6.939 1.00 . A A . 18 ASN C 1 1 13 9674 1 1 18 ASN CA C -3.568 1.101 -7.716 1.00 . A A . 18 ASN CA 1 1 13 9675 1 1 18 ASN CB C -2.317 0.431 -8.349 1.00 . A A . 18 ASN CB 1 1 13 9676 1 1 18 ASN CG C -2.608 -0.690 -9.311 1.00 . A A . 18 ASN CG 1 1 13 9677 1 1 18 ASN H H -2.106 2.477 -6.861 1.00 . A A . 18 ASN H 1 1 13 9678 1 1 18 ASN HA H -4.205 1.568 -8.450 1.00 . A A . 18 ASN HA 1 1 13 9679 1 1 18 ASN HB2 H -1.727 1.164 -8.876 1.00 . A A . 18 ASN HB2 1 1 13 9680 1 1 18 ASN HB3 H -1.699 -0.002 -7.585 1.00 . A A . 18 ASN HB3 1 1 13 9681 1 1 18 ASN HD21 H -4.583 -0.694 -9.149 1.00 . A A . 18 ASN HD21 1 1 13 9682 1 1 18 ASN HD22 H -3.871 -1.819 -10.218 1.00 . A A . 18 ASN HD22 1 1 13 9683 1 1 18 ASN N N -3.036 2.172 -6.787 1.00 . A A . 18 ASN N 1 1 13 9684 1 1 18 ASN ND2 N -3.799 -1.092 -9.573 1.00 . A A . 18 ASN ND2 1 1 13 9685 1 1 18 ASN O O -5.485 -0.380 -7.431 1.00 . A A . 18 ASN O 1 1 13 9686 1 1 18 ASN OD1 O -1.712 -1.261 -9.877 1.00 . A A . 18 ASN OD1 1 1 13 9687 1 1 19 TYR C C -5.806 -0.330 -4.002 1.00 . A A . 19 TYR C 1 1 13 9688 1 1 19 TYR CA C -4.781 -1.161 -4.810 1.00 . A A . 19 TYR CA 1 1 13 9689 1 1 19 TYR CB C -3.737 -1.822 -3.858 1.00 . A A . 19 TYR CB 1 1 13 9690 1 1 19 TYR CD1 C -2.167 -2.306 -5.772 1.00 . A A . 19 TYR CD1 1 1 13 9691 1 1 19 TYR CD2 C -1.288 -1.255 -3.840 1.00 . A A . 19 TYR CD2 1 1 13 9692 1 1 19 TYR CE1 C -0.918 -2.273 -6.358 1.00 . A A . 19 TYR CE1 1 1 13 9693 1 1 19 TYR CE2 C -0.040 -1.229 -4.437 1.00 . A A . 19 TYR CE2 1 1 13 9694 1 1 19 TYR CG C -2.355 -1.796 -4.509 1.00 . A A . 19 TYR CG 1 1 13 9695 1 1 19 TYR CZ C 0.141 -1.739 -5.687 1.00 . A A . 19 TYR CZ 1 1 13 9696 1 1 19 TYR H H -3.216 0.236 -5.473 1.00 . A A . 19 TYR H 1 1 13 9697 1 1 19 TYR HA H -5.327 -1.896 -5.384 1.00 . A A . 19 TYR HA 1 1 13 9698 1 1 19 TYR HB2 H -3.686 -1.296 -2.916 1.00 . A A . 19 TYR HB2 1 1 13 9699 1 1 19 TYR HB3 H -4.001 -2.854 -3.665 1.00 . A A . 19 TYR HB3 1 1 13 9700 1 1 19 TYR HD1 H -3.011 -2.730 -6.292 1.00 . A A . 19 TYR HD1 1 1 13 9701 1 1 19 TYR HD2 H -1.438 -0.847 -2.848 1.00 . A A . 19 TYR HD2 1 1 13 9702 1 1 19 TYR HE1 H -0.761 -2.649 -7.355 1.00 . A A . 19 TYR HE1 1 1 13 9703 1 1 19 TYR HE2 H 0.815 -0.797 -3.943 1.00 . A A . 19 TYR HE2 1 1 13 9704 1 1 19 TYR HH H 1.720 -2.563 -5.836 1.00 . A A . 19 TYR HH 1 1 13 9705 1 1 19 TYR N N -4.055 -0.205 -5.739 1.00 . A A . 19 TYR N 1 1 13 9706 1 1 19 TYR O O -6.949 -0.687 -3.786 1.00 . A A . 19 TYR O 1 1 13 9707 1 1 19 TYR OH O 1.395 -1.744 -6.237 1.00 . A A . 19 TYR OH 1 1 13 9708 1 1 20 CYS C C -6.771 2.727 -3.808 1.00 . A A . 20 CYS C 1 1 13 9709 1 1 20 CYS CA C -6.161 1.750 -2.768 1.00 . A A . 20 CYS CA 1 1 13 9710 1 1 20 CYS CB C -5.218 2.393 -1.791 1.00 . A A . 20 CYS CB 1 1 13 9711 1 1 20 CYS H H -4.397 1.008 -3.745 1.00 . A A . 20 CYS H 1 1 13 9712 1 1 20 CYS HA H -6.959 1.316 -2.198 1.00 . A A . 20 CYS HA 1 1 13 9713 1 1 20 CYS HB2 H -4.528 1.666 -1.387 1.00 . A A . 20 CYS HB2 1 1 13 9714 1 1 20 CYS HB3 H -4.640 3.148 -2.305 1.00 . A A . 20 CYS HB3 1 1 13 9715 1 1 20 CYS HG H -5.870 4.097 -0.413 1.00 . A A . 20 CYS HG 1 1 13 9716 1 1 20 CYS N N -5.335 0.792 -3.558 1.00 . A A . 20 CYS N 1 1 13 9717 1 1 20 CYS O O -6.549 3.916 -3.841 1.00 . A A . 20 CYS O 1 1 13 9718 1 1 20 CYS SG S -6.128 3.172 -0.443 1.00 . A A . 20 CYS SG 1 1 13 9719 1 1 21 ASN C C -8.422 4.384 -5.608 1.00 . A A . 21 ASN C 1 1 13 9720 1 1 21 ASN CA C -8.263 2.837 -5.779 1.00 . A A . 21 ASN CA 1 1 13 9721 1 1 21 ASN CB C -9.608 2.064 -5.894 1.00 . A A . 21 ASN CB 1 1 13 9722 1 1 21 ASN CG C -9.344 0.594 -6.198 1.00 . A A . 21 ASN CG 1 1 13 9723 1 1 21 ASN H H -7.650 1.160 -4.535 1.00 . A A . 21 ASN H 1 1 13 9724 1 1 21 ASN HA H -7.689 2.707 -6.685 1.00 . A A . 21 ASN HA 1 1 13 9725 1 1 21 ASN HB2 H -10.165 2.100 -4.970 1.00 . A A . 21 ASN HB2 1 1 13 9726 1 1 21 ASN HB3 H -10.220 2.457 -6.689 1.00 . A A . 21 ASN HB3 1 1 13 9727 1 1 21 ASN HD21 H -7.385 0.744 -6.511 1.00 . A A . 21 ASN HD21 1 1 13 9728 1 1 21 ASN HD22 H -8.091 -0.794 -6.673 1.00 . A A . 21 ASN HD22 1 1 13 9729 1 1 21 ASN N N -7.548 2.127 -4.662 1.00 . A A . 21 ASN N 1 1 13 9730 1 1 21 ASN ND2 N -8.166 0.160 -6.483 1.00 . A A . 21 ASN ND2 1 1 13 9731 1 1 21 ASN O O -9.224 5.067 -6.225 1.00 . A A . 21 ASN O 1 1 13 9732 1 1 21 ASN OD1 O -10.225 -0.228 -6.183 1.00 . A A . 21 ASN OD1 1 1 13 9733 2 2 1 PHE C C 7.312 7.548 -4.514 1.00 . B B . 1 PHE C 1 1 13 9734 2 2 1 PHE CA C 7.131 9.065 -4.264 1.00 . B B . 1 PHE CA 1 1 13 9735 2 2 1 PHE CB C 5.710 9.547 -4.662 1.00 . B B . 1 PHE CB 1 1 13 9736 2 2 1 PHE CD1 C 6.052 11.730 -5.863 1.00 . B B . 1 PHE CD1 1 1 13 9737 2 2 1 PHE CD2 C 5.288 11.801 -3.616 1.00 . B B . 1 PHE CD2 1 1 13 9738 2 2 1 PHE CE1 C 6.041 13.105 -5.919 1.00 . B B . 1 PHE CE1 1 1 13 9739 2 2 1 PHE CE2 C 5.275 13.177 -3.664 1.00 . B B . 1 PHE CE2 1 1 13 9740 2 2 1 PHE CG C 5.677 11.072 -4.713 1.00 . B B . 1 PHE CG 1 1 13 9741 2 2 1 PHE CZ C 5.651 13.831 -4.816 1.00 . B B . 1 PHE CZ 1 1 13 9742 2 2 1 PHE HA H 7.310 9.238 -3.211 1.00 . B B . 1 PHE HA 1 1 13 9743 2 2 1 PHE HB2 H 5.424 9.154 -5.624 1.00 . B B . 1 PHE HB2 1 1 13 9744 2 2 1 PHE HB3 H 4.995 9.221 -3.926 1.00 . B B . 1 PHE HB3 1 1 13 9745 2 2 1 PHE HD1 H 6.357 11.159 -6.729 1.00 . B B . 1 PHE HD1 1 1 13 9746 2 2 1 PHE HD2 H 4.992 11.292 -2.710 1.00 . B B . 1 PHE HD2 1 1 13 9747 2 2 1 PHE HE1 H 6.338 13.608 -6.829 1.00 . B B . 1 PHE HE1 1 1 13 9748 2 2 1 PHE HE2 H 4.970 13.741 -2.794 1.00 . B B . 1 PHE HE2 1 1 13 9749 2 2 1 PHE HZ H 5.638 14.911 -4.850 1.00 . B B . 1 PHE HZ 1 1 13 9750 2 2 1 PHE N N 8.119 9.852 -5.078 1.00 . B B . 1 PHE N 1 1 13 9751 2 2 1 PHE O O 6.391 6.781 -4.734 1.00 . B B . 1 PHE O 1 1 13 9752 2 2 2 VAL C C 9.873 5.501 -3.338 1.00 . B B . 2 VAL C 1 1 13 9753 2 2 2 VAL CA C 9.129 5.866 -4.649 1.00 . B B . 2 VAL CA 1 1 13 9754 2 2 2 VAL CB C 10.078 5.964 -5.862 1.00 . B B . 2 VAL CB 1 1 13 9755 2 2 2 VAL CG1 C 10.593 4.593 -6.313 1.00 . B B . 2 VAL CG1 1 1 13 9756 2 2 2 VAL CG2 C 9.338 6.574 -7.068 1.00 . B B . 2 VAL CG2 1 1 13 9757 2 2 2 VAL H H 9.236 7.853 -4.310 1.00 . B B . 2 VAL H 1 1 13 9758 2 2 2 VAL HA H 8.347 5.200 -4.900 1.00 . B B . 2 VAL HA 1 1 13 9759 2 2 2 VAL HB H 10.903 6.601 -5.570 1.00 . B B . 2 VAL HB 1 1 13 9760 2 2 2 VAL HG11 H 9.760 3.954 -6.574 1.00 . B B . 2 VAL HG11 1 1 13 9761 2 2 2 VAL HG12 H 11.203 4.722 -7.196 1.00 . B B . 2 VAL HG12 1 1 13 9762 2 2 2 VAL HG13 H 11.202 4.105 -5.569 1.00 . B B . 2 VAL HG13 1 1 13 9763 2 2 2 VAL HG21 H 8.492 5.958 -7.330 1.00 . B B . 2 VAL HG21 1 1 13 9764 2 2 2 VAL HG22 H 8.973 7.570 -6.855 1.00 . B B . 2 VAL HG22 1 1 13 9765 2 2 2 VAL HG23 H 9.984 6.639 -7.932 1.00 . B B . 2 VAL HG23 1 1 13 9766 2 2 2 VAL N N 8.562 7.200 -4.467 1.00 . B B . 2 VAL N 1 1 13 9767 2 2 2 VAL O O 9.978 6.286 -2.418 1.00 . B B . 2 VAL O 1 1 13 9768 2 2 3 ASN C C 10.381 3.103 -0.955 1.00 . B B . 3 ASN C 1 1 13 9769 2 2 3 ASN CA C 11.142 3.721 -2.132 1.00 . B B . 3 ASN CA 1 1 13 9770 2 2 3 ASN CB C 12.097 4.804 -1.545 1.00 . B B . 3 ASN CB 1 1 13 9771 2 2 3 ASN CG C 12.906 5.415 -2.660 1.00 . B B . 3 ASN CG 1 1 13 9772 2 2 3 ASN H H 10.157 3.826 -4.122 1.00 . B B . 3 ASN H 1 1 13 9773 2 2 3 ASN HA H 11.729 2.916 -2.516 1.00 . B B . 3 ASN HA 1 1 13 9774 2 2 3 ASN HB2 H 11.566 5.582 -1.019 1.00 . B B . 3 ASN HB2 1 1 13 9775 2 2 3 ASN HB3 H 12.791 4.344 -0.861 1.00 . B B . 3 ASN HB3 1 1 13 9776 2 2 3 ASN HD21 H 12.014 7.154 -2.543 1.00 . B B . 3 ASN HD21 1 1 13 9777 2 2 3 ASN HD22 H 13.262 6.997 -3.708 1.00 . B B . 3 ASN HD22 1 1 13 9778 2 2 3 ASN N N 10.358 4.306 -3.300 1.00 . B B . 3 ASN N 1 1 13 9779 2 2 3 ASN ND2 N 12.705 6.634 -2.996 1.00 . B B . 3 ASN ND2 1 1 13 9780 2 2 3 ASN O O 10.834 2.173 -0.328 1.00 . B B . 3 ASN O 1 1 13 9781 2 2 3 ASN OD1 O 13.744 4.799 -3.265 1.00 . B B . 3 ASN OD1 1 1 13 9782 2 2 4 GLN C C 8.267 1.823 1.057 1.00 . B B . 4 GLN C 1 1 13 9783 2 2 4 GLN CA C 8.322 3.265 0.417 1.00 . B B . 4 GLN CA 1 1 13 9784 2 2 4 GLN CB C 6.915 3.610 -0.046 1.00 . B B . 4 GLN CB 1 1 13 9785 2 2 4 GLN CD C 6.900 5.696 -1.636 1.00 . B B . 4 GLN CD 1 1 13 9786 2 2 4 GLN CG C 6.693 5.158 -0.230 1.00 . B B . 4 GLN CG 1 1 13 9787 2 2 4 GLN H H 9.071 4.430 -1.295 1.00 . B B . 4 GLN H 1 1 13 9788 2 2 4 GLN HA H 8.561 3.900 1.248 1.00 . B B . 4 GLN HA 1 1 13 9789 2 2 4 GLN HB2 H 6.747 3.025 -0.937 1.00 . B B . 4 GLN HB2 1 1 13 9790 2 2 4 GLN HB3 H 6.251 3.243 0.725 1.00 . B B . 4 GLN HB3 1 1 13 9791 2 2 4 GLN HE21 H 7.244 3.975 -2.581 1.00 . B B . 4 GLN HE21 1 1 13 9792 2 2 4 GLN HE22 H 7.232 5.416 -3.494 1.00 . B B . 4 GLN HE22 1 1 13 9793 2 2 4 GLN HG2 H 5.681 5.410 0.043 1.00 . B B . 4 GLN HG2 1 1 13 9794 2 2 4 GLN HG3 H 7.347 5.725 0.416 1.00 . B B . 4 GLN HG3 1 1 13 9795 2 2 4 GLN N N 9.262 3.680 -0.695 1.00 . B B . 4 GLN N 1 1 13 9796 2 2 4 GLN NE2 N 7.148 4.943 -2.646 1.00 . B B . 4 GLN NE2 1 1 13 9797 2 2 4 GLN O O 7.233 1.191 1.070 1.00 . B B . 4 GLN O 1 1 13 9798 2 2 4 GLN OE1 O 6.829 6.878 -1.865 1.00 . B B . 4 GLN OE1 1 1 13 9799 2 2 5 HIS C C 8.535 -0.126 3.522 1.00 . B B . 5 HIS C 1 1 13 9800 2 2 5 HIS CA C 9.386 -0.037 2.212 1.00 . B B . 5 HIS CA 1 1 13 9801 2 2 5 HIS CB C 10.871 -0.404 2.522 1.00 . B B . 5 HIS CB 1 1 13 9802 2 2 5 HIS CD2 C 12.050 -2.285 1.111 1.00 . B B . 5 HIS CD2 1 1 13 9803 2 2 5 HIS CE1 C 12.410 -1.202 -0.611 1.00 . B B . 5 HIS CE1 1 1 13 9804 2 2 5 HIS CG C 11.559 -1.014 1.313 1.00 . B B . 5 HIS CG 1 1 13 9805 2 2 5 HIS H H 10.113 1.928 1.491 1.00 . B B . 5 HIS H 1 1 13 9806 2 2 5 HIS HA H 8.971 -0.762 1.521 1.00 . B B . 5 HIS HA 1 1 13 9807 2 2 5 HIS HB2 H 11.421 0.471 2.829 1.00 . B B . 5 HIS HB2 1 1 13 9808 2 2 5 HIS HB3 H 10.914 -1.125 3.327 1.00 . B B . 5 HIS HB3 1 1 13 9809 2 2 5 HIS HD1 H 11.559 0.538 0.063 1.00 . B B . 5 HIS HD1 1 1 13 9810 2 2 5 HIS HD2 H 12.003 -3.076 1.843 1.00 . B B . 5 HIS HD2 1 1 13 9811 2 2 5 HIS HE1 H 12.736 -0.937 -1.608 1.00 . B B . 5 HIS HE1 1 1 13 9812 2 2 5 HIS N N 9.349 1.340 1.568 1.00 . B B . 5 HIS N 1 1 13 9813 2 2 5 HIS ND1 N 11.810 -0.400 0.218 1.00 . B B . 5 HIS ND1 1 1 13 9814 2 2 5 HIS NE2 N 12.577 -2.391 -0.091 1.00 . B B . 5 HIS NE2 1 1 13 9815 2 2 5 HIS O O 9.036 -0.186 4.630 1.00 . B B . 5 HIS O 1 1 13 9816 2 2 6 LEU C C 5.619 -1.597 4.472 1.00 . B B . 6 LEU C 1 1 13 9817 2 2 6 LEU CA C 6.277 -0.203 4.496 1.00 . B B . 6 LEU CA 1 1 13 9818 2 2 6 LEU CB C 5.231 0.923 4.304 1.00 . B B . 6 LEU CB 1 1 13 9819 2 2 6 LEU CD1 C 6.998 2.752 3.946 1.00 . B B . 6 LEU CD1 1 1 13 9820 2 2 6 LEU CD2 C 4.688 3.357 4.396 1.00 . B B . 6 LEU CD2 1 1 13 9821 2 2 6 LEU CG C 5.755 2.321 4.717 1.00 . B B . 6 LEU CG 1 1 13 9822 2 2 6 LEU H H 6.900 -0.079 2.433 1.00 . B B . 6 LEU H 1 1 13 9823 2 2 6 LEU HA H 6.803 -0.085 5.434 1.00 . B B . 6 LEU HA 1 1 13 9824 2 2 6 LEU HB2 H 4.939 0.920 3.263 1.00 . B B . 6 LEU HB2 1 1 13 9825 2 2 6 LEU HB3 H 4.358 0.682 4.893 1.00 . B B . 6 LEU HB3 1 1 13 9826 2 2 6 LEU HD11 H 6.786 2.748 2.890 1.00 . B B . 6 LEU HD11 1 1 13 9827 2 2 6 LEU HD12 H 7.295 3.748 4.240 1.00 . B B . 6 LEU HD12 1 1 13 9828 2 2 6 LEU HD13 H 7.822 2.090 4.153 1.00 . B B . 6 LEU HD13 1 1 13 9829 2 2 6 LEU HD21 H 4.452 3.342 3.341 1.00 . B B . 6 LEU HD21 1 1 13 9830 2 2 6 LEU HD22 H 3.797 3.143 4.962 1.00 . B B . 6 LEU HD22 1 1 13 9831 2 2 6 LEU HD23 H 5.041 4.342 4.663 1.00 . B B . 6 LEU HD23 1 1 13 9832 2 2 6 LEU HG H 5.949 2.293 5.780 1.00 . B B . 6 LEU HG 1 1 13 9833 2 2 6 LEU N N 7.247 -0.126 3.350 1.00 . B B . 6 LEU N 1 1 13 9834 2 2 6 LEU O O 4.859 -1.905 3.583 1.00 . B B . 6 LEU O 1 1 13 9835 2 2 7 CYS C C 3.960 -3.995 6.227 1.00 . B B . 7 CYS C 1 1 13 9836 2 2 7 CYS CA C 5.257 -3.797 5.399 1.00 . B B . 7 CYS CA 1 1 13 9837 2 2 7 CYS CB C 6.363 -4.778 5.829 1.00 . B B . 7 CYS CB 1 1 13 9838 2 2 7 CYS H H 6.502 -2.133 6.134 1.00 . B B . 7 CYS H 1 1 13 9839 2 2 7 CYS HA H 4.993 -4.022 4.378 1.00 . B B . 7 CYS HA 1 1 13 9840 2 2 7 CYS HB2 H 7.287 -4.475 5.352 1.00 . B B . 7 CYS HB2 1 1 13 9841 2 2 7 CYS HB3 H 6.510 -4.722 6.898 1.00 . B B . 7 CYS HB3 1 1 13 9842 2 2 7 CYS HG H 5.675 -6.952 6.135 1.00 . B B . 7 CYS HG 1 1 13 9843 2 2 7 CYS N N 5.894 -2.430 5.434 1.00 . B B . 7 CYS N 1 1 13 9844 2 2 7 CYS O O 3.561 -3.140 6.987 1.00 . B B . 7 CYS O 1 1 13 9845 2 2 7 CYS SG S 6.085 -6.512 5.386 1.00 . B B . 7 CYS SG 1 1 13 9846 2 2 8 GLY C C 1.203 -4.476 7.340 1.00 . B B . 8 GLY C 1 1 13 9847 2 2 8 GLY CA C 2.063 -5.575 6.723 1.00 . B B . 8 GLY CA 1 1 13 9848 2 2 8 GLY H H 3.792 -5.755 5.429 1.00 . B B . 8 GLY H 1 1 13 9849 2 2 8 GLY HA2 H 1.438 -6.083 6.011 1.00 . B B . 8 GLY HA2 1 1 13 9850 2 2 8 GLY HA3 H 2.301 -6.257 7.527 1.00 . B B . 8 GLY HA3 1 1 13 9851 2 2 8 GLY N N 3.357 -5.143 6.045 1.00 . B B . 8 GLY N 1 1 13 9852 2 2 8 GLY O O 0.366 -3.871 6.699 1.00 . B B . 8 GLY O 1 1 13 9853 2 2 9 ASP C C 1.078 -1.817 8.759 1.00 . B B . 9 ASP C 1 1 13 9854 2 2 9 ASP CA C 0.720 -3.210 9.355 1.00 . B B . 9 ASP CA 1 1 13 9855 2 2 9 ASP CB C 1.188 -3.443 10.822 1.00 . B B . 9 ASP CB 1 1 13 9856 2 2 9 ASP CG C 1.118 -4.917 11.187 1.00 . B B . 9 ASP CG 1 1 13 9857 2 2 9 ASP H H 2.151 -4.777 9.013 1.00 . B B . 9 ASP H 1 1 13 9858 2 2 9 ASP HA H -0.351 -3.362 9.232 1.00 . B B . 9 ASP HA 1 1 13 9859 2 2 9 ASP HB2 H 2.205 -3.129 10.982 1.00 . B B . 9 ASP HB2 1 1 13 9860 2 2 9 ASP HB3 H 0.546 -2.916 11.508 1.00 . B B . 9 ASP HB3 1 1 13 9861 2 2 9 ASP N N 1.453 -4.243 8.575 1.00 . B B . 9 ASP N 1 1 13 9862 2 2 9 ASP O O 0.260 -1.029 8.329 1.00 . B B . 9 ASP O 1 1 13 9863 2 2 9 ASP OD1 O 2.030 -5.602 10.751 1.00 . B B . 9 ASP OD1 1 1 13 9864 2 2 9 ASP OD2 O 0.166 -5.249 11.858 1.00 . B B . 9 ASP OD2 1 1 13 9865 2 2 10 HIS C C 2.328 -0.039 6.695 1.00 . B B . 10 HIS C 1 1 13 9866 2 2 10 HIS CA C 2.826 -0.229 8.165 1.00 . B B . 10 HIS CA 1 1 13 9867 2 2 10 HIS CB C 4.344 -0.238 8.215 1.00 . B B . 10 HIS CB 1 1 13 9868 2 2 10 HIS CD2 C 5.955 1.761 8.830 1.00 . B B . 10 HIS CD2 1 1 13 9869 2 2 10 HIS CE1 C 4.954 3.280 7.846 1.00 . B B . 10 HIS CE1 1 1 13 9870 2 2 10 HIS CG C 4.849 1.201 8.229 1.00 . B B . 10 HIS CG 1 1 13 9871 2 2 10 HIS H H 2.942 -2.242 9.057 1.00 . B B . 10 HIS H 1 1 13 9872 2 2 10 HIS HA H 2.413 0.579 8.756 1.00 . B B . 10 HIS HA 1 1 13 9873 2 2 10 HIS HB2 H 4.669 -0.735 9.114 1.00 . B B . 10 HIS HB2 1 1 13 9874 2 2 10 HIS HB3 H 4.734 -0.750 7.350 1.00 . B B . 10 HIS HB3 1 1 13 9875 2 2 10 HIS HD1 H 3.446 2.122 7.108 1.00 . B B . 10 HIS HD1 1 1 13 9876 2 2 10 HIS HD2 H 6.677 1.221 9.419 1.00 . B B . 10 HIS HD2 1 1 13 9877 2 2 10 HIS HE1 H 4.694 4.259 7.465 1.00 . B B . 10 HIS HE1 1 1 13 9878 2 2 10 HIS N N 2.344 -1.544 8.719 1.00 . B B . 10 HIS N 1 1 13 9879 2 2 10 HIS ND1 N 4.277 2.192 7.638 1.00 . B B . 10 HIS ND1 1 1 13 9880 2 2 10 HIS NE2 N 6.008 3.054 8.585 1.00 . B B . 10 HIS NE2 1 1 13 9881 2 2 10 HIS O O 2.238 1.058 6.177 1.00 . B B . 10 HIS O 1 1 13 9882 2 2 11 LEU C C 0.028 -0.811 4.688 1.00 . B B . 11 LEU C 1 1 13 9883 2 2 11 LEU CA C 1.531 -1.181 4.667 1.00 . B B . 11 LEU CA 1 1 13 9884 2 2 11 LEU CB C 1.780 -2.603 4.152 1.00 . B B . 11 LEU CB 1 1 13 9885 2 2 11 LEU CD1 C 2.450 -2.069 1.838 1.00 . B B . 11 LEU CD1 1 1 13 9886 2 2 11 LEU CD2 C 1.390 -4.249 2.403 1.00 . B B . 11 LEU CD2 1 1 13 9887 2 2 11 LEU CG C 1.377 -2.754 2.695 1.00 . B B . 11 LEU CG 1 1 13 9888 2 2 11 LEU H H 2.144 -1.974 6.588 1.00 . B B . 11 LEU H 1 1 13 9889 2 2 11 LEU HA H 2.066 -0.433 4.091 1.00 . B B . 11 LEU HA 1 1 13 9890 2 2 11 LEU HB2 H 2.830 -2.820 4.249 1.00 . B B . 11 LEU HB2 1 1 13 9891 2 2 11 LEU HB3 H 1.233 -3.311 4.748 1.00 . B B . 11 LEU HB3 1 1 13 9892 2 2 11 LEU HD11 H 2.540 -1.020 2.079 1.00 . B B . 11 LEU HD11 1 1 13 9893 2 2 11 LEU HD12 H 3.412 -2.528 1.996 1.00 . B B . 11 LEU HD12 1 1 13 9894 2 2 11 LEU HD13 H 2.250 -2.151 0.789 1.00 . B B . 11 LEU HD13 1 1 13 9895 2 2 11 LEU HD21 H 0.701 -4.763 3.055 1.00 . B B . 11 LEU HD21 1 1 13 9896 2 2 11 LEU HD22 H 1.109 -4.437 1.382 1.00 . B B . 11 LEU HD22 1 1 13 9897 2 2 11 LEU HD23 H 2.384 -4.640 2.561 1.00 . B B . 11 LEU HD23 1 1 13 9898 2 2 11 LEU HG H 0.400 -2.320 2.511 1.00 . B B . 11 LEU HG 1 1 13 9899 2 2 11 LEU N N 2.028 -1.146 6.079 1.00 . B B . 11 LEU N 1 1 13 9900 2 2 11 LEU O O -0.402 0.081 3.982 1.00 . B B . 11 LEU O 1 1 13 9901 2 2 12 VAL C C -2.298 0.385 5.884 1.00 . B B . 12 VAL C 1 1 13 9902 2 2 12 VAL CA C -2.235 -1.116 5.510 1.00 . B B . 12 VAL CA 1 1 13 9903 2 2 12 VAL CB C -2.991 -1.979 6.565 1.00 . B B . 12 VAL CB 1 1 13 9904 2 2 12 VAL CG1 C -2.283 -1.980 7.901 1.00 . B B . 12 VAL CG1 1 1 13 9905 2 2 12 VAL CG2 C -4.363 -1.322 6.810 1.00 . B B . 12 VAL CG2 1 1 13 9906 2 2 12 VAL H H -0.405 -2.226 6.007 1.00 . B B . 12 VAL H 1 1 13 9907 2 2 12 VAL HA H -2.668 -1.243 4.534 1.00 . B B . 12 VAL HA 1 1 13 9908 2 2 12 VAL HB H -3.055 -2.999 6.206 1.00 . B B . 12 VAL HB 1 1 13 9909 2 2 12 VAL HG11 H -2.159 -0.989 8.317 1.00 . B B . 12 VAL HG11 1 1 13 9910 2 2 12 VAL HG12 H -2.797 -2.583 8.630 1.00 . B B . 12 VAL HG12 1 1 13 9911 2 2 12 VAL HG13 H -1.310 -2.412 7.743 1.00 . B B . 12 VAL HG13 1 1 13 9912 2 2 12 VAL HG21 H -4.916 -1.238 5.888 1.00 . B B . 12 VAL HG21 1 1 13 9913 2 2 12 VAL HG22 H -4.934 -1.889 7.525 1.00 . B B . 12 VAL HG22 1 1 13 9914 2 2 12 VAL HG23 H -4.229 -0.323 7.209 1.00 . B B . 12 VAL HG23 1 1 13 9915 2 2 12 VAL N N -0.771 -1.490 5.472 1.00 . B B . 12 VAL N 1 1 13 9916 2 2 12 VAL O O -3.008 1.171 5.280 1.00 . B B . 12 VAL O 1 1 13 9917 2 2 13 GLU C C -1.197 3.041 6.235 1.00 . B B . 13 GLU C 1 1 13 9918 2 2 13 GLU CA C -1.395 2.080 7.433 1.00 . B B . 13 GLU CA 1 1 13 9919 2 2 13 GLU CB C -0.206 1.952 8.373 1.00 . B B . 13 GLU CB 1 1 13 9920 2 2 13 GLU CD C -1.061 3.626 10.108 1.00 . B B . 13 GLU CD 1 1 13 9921 2 2 13 GLU CG C 0.025 3.272 9.091 1.00 . B B . 13 GLU CG 1 1 13 9922 2 2 13 GLU H H -0.969 0.060 7.353 1.00 . B B . 13 GLU H 1 1 13 9923 2 2 13 GLU HA H -2.274 2.367 7.981 1.00 . B B . 13 GLU HA 1 1 13 9924 2 2 13 GLU HB2 H -0.407 1.185 9.113 1.00 . B B . 13 GLU HB2 1 1 13 9925 2 2 13 GLU HB3 H 0.673 1.674 7.820 1.00 . B B . 13 GLU HB3 1 1 13 9926 2 2 13 GLU HG2 H 0.952 3.202 9.624 1.00 . B B . 13 GLU HG2 1 1 13 9927 2 2 13 GLU HG3 H 0.060 4.057 8.359 1.00 . B B . 13 GLU HG3 1 1 13 9928 2 2 13 GLU N N -1.529 0.712 6.887 1.00 . B B . 13 GLU N 1 1 13 9929 2 2 13 GLU O O -1.675 4.154 6.143 1.00 . B B . 13 GLU O 1 1 13 9930 2 2 13 GLU OE1 O -1.548 2.717 10.750 1.00 . B B . 13 GLU OE1 1 1 13 9931 2 2 13 GLU OE2 O -1.342 4.806 10.177 1.00 . B B . 13 GLU OE2 1 1 13 9932 2 2 14 ALA C C -1.319 3.293 3.038 1.00 . B B . 14 ALA C 1 1 13 9933 2 2 14 ALA CA C -0.174 3.301 4.066 1.00 . B B . 14 ALA CA 1 1 13 9934 2 2 14 ALA CB C 1.142 2.718 3.494 1.00 . B B . 14 ALA CB 1 1 13 9935 2 2 14 ALA H H -0.139 1.608 5.383 1.00 . B B . 14 ALA H 1 1 13 9936 2 2 14 ALA HA H -0.079 4.311 4.406 1.00 . B B . 14 ALA HA 1 1 13 9937 2 2 14 ALA HB1 H 1.912 2.784 4.245 1.00 . B B . 14 ALA HB1 1 1 13 9938 2 2 14 ALA HB2 H 1.028 1.678 3.226 1.00 . B B . 14 ALA HB2 1 1 13 9939 2 2 14 ALA HB3 H 1.458 3.263 2.618 1.00 . B B . 14 ALA HB3 1 1 13 9940 2 2 14 ALA N N -0.471 2.520 5.281 1.00 . B B . 14 ALA N 1 1 13 9941 2 2 14 ALA O O -1.745 4.346 2.599 1.00 . B B . 14 ALA O 1 1 13 9942 2 2 15 LEU C C -4.134 3.062 2.206 1.00 . B B . 15 LEU C 1 1 13 9943 2 2 15 LEU CA C -2.934 2.246 1.649 1.00 . B B . 15 LEU CA 1 1 13 9944 2 2 15 LEU CB C -3.356 0.780 1.184 1.00 . B B . 15 LEU CB 1 1 13 9945 2 2 15 LEU CD1 C -4.675 -0.147 3.141 1.00 . B B . 15 LEU CD1 1 1 13 9946 2 2 15 LEU CD2 C -3.853 -1.609 1.457 1.00 . B B . 15 LEU CD2 1 1 13 9947 2 2 15 LEU CG C -3.498 -0.341 2.206 1.00 . B B . 15 LEU CG 1 1 13 9948 2 2 15 LEU H H -1.453 1.327 3.022 1.00 . B B . 15 LEU H 1 1 13 9949 2 2 15 LEU HA H -2.565 2.776 0.787 1.00 . B B . 15 LEU HA 1 1 13 9950 2 2 15 LEU HB2 H -4.289 0.865 0.649 1.00 . B B . 15 LEU HB2 1 1 13 9951 2 2 15 LEU HB3 H -2.599 0.469 0.479 1.00 . B B . 15 LEU HB3 1 1 13 9952 2 2 15 LEU HD11 H -5.579 -0.086 2.560 1.00 . B B . 15 LEU HD11 1 1 13 9953 2 2 15 LEU HD12 H -4.759 -0.995 3.802 1.00 . B B . 15 LEU HD12 1 1 13 9954 2 2 15 LEU HD13 H -4.590 0.731 3.743 1.00 . B B . 15 LEU HD13 1 1 13 9955 2 2 15 LEU HD21 H -3.083 -1.843 0.753 1.00 . B B . 15 LEU HD21 1 1 13 9956 2 2 15 LEU HD22 H -3.941 -2.429 2.153 1.00 . B B . 15 LEU HD22 1 1 13 9957 2 2 15 LEU HD23 H -4.786 -1.505 0.925 1.00 . B B . 15 LEU HD23 1 1 13 9958 2 2 15 LEU HG H -2.538 -0.480 2.679 1.00 . B B . 15 LEU HG 1 1 13 9959 2 2 15 LEU N N -1.823 2.154 2.647 1.00 . B B . 15 LEU N 1 1 13 9960 2 2 15 LEU O O -4.704 3.838 1.467 1.00 . B B . 15 LEU O 1 1 13 9961 2 2 16 TYR C C -5.259 5.277 3.718 1.00 . B B . 16 TYR C 1 1 13 9962 2 2 16 TYR CA C -5.699 3.794 3.883 1.00 . B B . 16 TYR CA 1 1 13 9963 2 2 16 TYR CB C -6.075 3.416 5.370 1.00 . B B . 16 TYR CB 1 1 13 9964 2 2 16 TYR CD1 C -5.663 5.612 6.585 1.00 . B B . 16 TYR CD1 1 1 13 9965 2 2 16 TYR CD2 C -4.488 3.687 7.308 1.00 . B B . 16 TYR CD2 1 1 13 9966 2 2 16 TYR CE1 C -5.036 6.360 7.568 1.00 . B B . 16 TYR CE1 1 1 13 9967 2 2 16 TYR CE2 C -3.871 4.445 8.286 1.00 . B B . 16 TYR CE2 1 1 13 9968 2 2 16 TYR CG C -5.389 4.263 6.450 1.00 . B B . 16 TYR CG 1 1 13 9969 2 2 16 TYR CZ C -4.139 5.781 8.421 1.00 . B B . 16 TYR CZ 1 1 13 9970 2 2 16 TYR H H -4.037 2.353 4.064 1.00 . B B . 16 TYR H 1 1 13 9971 2 2 16 TYR HA H -6.532 3.634 3.211 1.00 . B B . 16 TYR HA 1 1 13 9972 2 2 16 TYR HB2 H -7.144 3.523 5.500 1.00 . B B . 16 TYR HB2 1 1 13 9973 2 2 16 TYR HB3 H -5.827 2.378 5.542 1.00 . B B . 16 TYR HB3 1 1 13 9974 2 2 16 TYR HD1 H -6.370 6.091 5.923 1.00 . B B . 16 TYR HD1 1 1 13 9975 2 2 16 TYR HD2 H -4.253 2.637 7.222 1.00 . B B . 16 TYR HD2 1 1 13 9976 2 2 16 TYR HE1 H -5.237 7.412 7.686 1.00 . B B . 16 TYR HE1 1 1 13 9977 2 2 16 TYR HE2 H -3.169 3.987 8.962 1.00 . B B . 16 TYR HE2 1 1 13 9978 2 2 16 TYR HH H -2.766 6.005 9.688 1.00 . B B . 16 TYR HH 1 1 13 9979 2 2 16 TYR N N -4.521 2.951 3.454 1.00 . B B . 16 TYR N 1 1 13 9980 2 2 16 TYR O O -6.001 6.088 3.201 1.00 . B B . 16 TYR O 1 1 13 9981 2 2 16 TYR OH O -3.523 6.543 9.386 1.00 . B B . 16 TYR OH 1 1 13 9982 2 2 17 LEU C C -3.616 7.488 2.586 1.00 . B B . 17 LEU C 1 1 13 9983 2 2 17 LEU CA C -3.529 6.968 4.054 1.00 . B B . 17 LEU CA 1 1 13 9984 2 2 17 LEU CB C -2.075 6.901 4.601 1.00 . B B . 17 LEU CB 1 1 13 9985 2 2 17 LEU CD1 C -2.077 9.370 5.128 1.00 . B B . 17 LEU CD1 1 1 13 9986 2 2 17 LEU CD2 C 0.019 8.084 5.155 1.00 . B B . 17 LEU CD2 1 1 13 9987 2 2 17 LEU CG C -1.318 8.235 4.434 1.00 . B B . 17 LEU CG 1 1 13 9988 2 2 17 LEU H H -3.526 4.883 4.597 1.00 . B B . 17 LEU H 1 1 13 9989 2 2 17 LEU HA H -4.132 7.627 4.662 1.00 . B B . 17 LEU HA 1 1 13 9990 2 2 17 LEU HB2 H -2.115 6.635 5.650 1.00 . B B . 17 LEU HB2 1 1 13 9991 2 2 17 LEU HB3 H -1.536 6.117 4.093 1.00 . B B . 17 LEU HB3 1 1 13 9992 2 2 17 LEU HD11 H -2.204 9.153 6.180 1.00 . B B . 17 LEU HD11 1 1 13 9993 2 2 17 LEU HD12 H -1.532 10.297 5.030 1.00 . B B . 17 LEU HD12 1 1 13 9994 2 2 17 LEU HD13 H -3.052 9.507 4.681 1.00 . B B . 17 LEU HD13 1 1 13 9995 2 2 17 LEU HD21 H 0.585 7.267 4.735 1.00 . B B . 17 LEU HD21 1 1 13 9996 2 2 17 LEU HD22 H 0.599 8.991 5.066 1.00 . B B . 17 LEU HD22 1 1 13 9997 2 2 17 LEU HD23 H -0.147 7.876 6.206 1.00 . B B . 17 LEU HD23 1 1 13 9998 2 2 17 LEU HG H -1.170 8.463 3.383 1.00 . B B . 17 LEU HG 1 1 13 9999 2 2 17 LEU N N -4.070 5.576 4.169 1.00 . B B . 17 LEU N 1 1 13 10000 2 2 17 LEU O O -4.085 8.585 2.357 1.00 . B B . 17 LEU O 1 1 13 10001 2 2 18 VAL C C -4.711 7.318 -0.332 1.00 . B B . 18 VAL C 1 1 13 10002 2 2 18 VAL CA C -3.248 7.186 0.196 1.00 . B B . 18 VAL CA 1 1 13 10003 2 2 18 VAL CB C -2.436 6.223 -0.764 1.00 . B B . 18 VAL CB 1 1 13 10004 2 2 18 VAL CG1 C -1.024 5.974 -0.225 1.00 . B B . 18 VAL CG1 1 1 13 10005 2 2 18 VAL CG2 C -3.110 4.895 -1.046 1.00 . B B . 18 VAL CG2 1 1 13 10006 2 2 18 VAL H H -2.788 5.841 1.885 1.00 . B B . 18 VAL H 1 1 13 10007 2 2 18 VAL HA H -2.770 8.145 0.102 1.00 . B B . 18 VAL HA 1 1 13 10008 2 2 18 VAL HB H -2.334 6.742 -1.714 1.00 . B B . 18 VAL HB 1 1 13 10009 2 2 18 VAL HG11 H -0.498 6.914 -0.143 1.00 . B B . 18 VAL HG11 1 1 13 10010 2 2 18 VAL HG12 H -1.056 5.506 0.745 1.00 . B B . 18 VAL HG12 1 1 13 10011 2 2 18 VAL HG13 H -0.478 5.342 -0.909 1.00 . B B . 18 VAL HG13 1 1 13 10012 2 2 18 VAL HG21 H -3.280 4.369 -0.129 1.00 . B B . 18 VAL HG21 1 1 13 10013 2 2 18 VAL HG22 H -4.052 5.060 -1.547 1.00 . B B . 18 VAL HG22 1 1 13 10014 2 2 18 VAL HG23 H -2.487 4.300 -1.698 1.00 . B B . 18 VAL HG23 1 1 13 10015 2 2 18 VAL N N -3.170 6.708 1.630 1.00 . B B . 18 VAL N 1 1 13 10016 2 2 18 VAL O O -5.038 8.345 -0.895 1.00 . B B . 18 VAL O 1 1 13 10017 2 2 19 CYS C C -8.213 6.517 0.242 1.00 . B B . 19 CYS C 1 1 13 10018 2 2 19 CYS CA C -6.990 6.547 -0.719 1.00 . B B . 19 CYS CA 1 1 13 10019 2 2 19 CYS CB C -7.185 5.500 -1.777 1.00 . B B . 19 CYS CB 1 1 13 10020 2 2 19 CYS H H -5.333 5.497 0.268 1.00 . B B . 19 CYS H 1 1 13 10021 2 2 19 CYS HA H -7.049 7.509 -1.213 1.00 . B B . 19 CYS HA 1 1 13 10022 2 2 19 CYS HB2 H -7.816 5.867 -2.567 1.00 . B B . 19 CYS HB2 1 1 13 10023 2 2 19 CYS HB3 H -6.208 5.334 -2.210 1.00 . B B . 19 CYS HB3 1 1 13 10024 2 2 19 CYS HG H -8.779 3.927 -1.197 1.00 . B B . 19 CYS HG 1 1 13 10025 2 2 19 CYS N N -5.586 6.341 -0.177 1.00 . B B . 19 CYS N 1 1 13 10026 2 2 19 CYS O O -9.314 6.374 -0.247 1.00 . B B . 19 CYS O 1 1 13 10027 2 2 19 CYS SG S -7.819 3.900 -1.205 1.00 . B B . 19 CYS SG 1 1 13 10028 2 2 20 GLY C C -10.573 6.196 2.324 1.00 . B B . 20 GLY C 1 1 13 10029 2 2 20 GLY CA C -9.110 6.642 2.602 1.00 . B B . 20 GLY CA 1 1 13 10030 2 2 20 GLY H H -7.082 6.761 1.813 1.00 . B B . 20 GLY H 1 1 13 10031 2 2 20 GLY HA2 H -8.763 6.007 3.404 1.00 . B B . 20 GLY HA2 1 1 13 10032 2 2 20 GLY HA3 H -9.177 7.642 3.004 1.00 . B B . 20 GLY HA3 1 1 13 10033 2 2 20 GLY N N -8.016 6.652 1.527 1.00 . B B . 20 GLY N 1 1 13 10034 2 2 20 GLY O O -11.114 5.395 3.054 1.00 . B B . 20 GLY O 1 1 13 10035 2 2 21 GLU C C -12.719 5.246 -0.164 1.00 . B B . 21 GLU C 1 1 13 10036 2 2 21 GLU CA C -12.584 6.400 0.878 1.00 . B B . 21 GLU CA 1 1 13 10037 2 2 21 GLU CB C -13.161 7.719 0.307 1.00 . B B . 21 GLU CB 1 1 13 10038 2 2 21 GLU CD C -12.732 8.965 -1.955 1.00 . B B . 21 GLU CD 1 1 13 10039 2 2 21 GLU CG C -12.114 8.314 -0.739 1.00 . B B . 21 GLU CG 1 1 13 10040 2 2 21 GLU H H -10.663 7.346 0.751 1.00 . B B . 21 GLU H 1 1 13 10041 2 2 21 GLU HA H -13.151 6.096 1.747 1.00 . B B . 21 GLU HA 1 1 13 10042 2 2 21 GLU HB2 H -14.109 7.526 -0.182 1.00 . B B . 21 GLU HB2 1 1 13 10043 2 2 21 GLU HB3 H -13.331 8.424 1.108 1.00 . B B . 21 GLU HB3 1 1 13 10044 2 2 21 GLU HG2 H -11.523 9.072 -0.251 1.00 . B B . 21 GLU HG2 1 1 13 10045 2 2 21 GLU HG3 H -11.443 7.564 -1.114 1.00 . B B . 21 GLU HG3 1 1 13 10046 2 2 21 GLU N N -11.169 6.711 1.297 1.00 . B B . 21 GLU N 1 1 13 10047 2 2 21 GLU O O -13.670 4.485 -0.200 1.00 . B B . 21 GLU O 1 1 13 10048 2 2 21 GLU OE1 O -13.594 8.372 -2.560 1.00 . B B . 21 GLU OE1 1 1 13 10049 2 2 21 GLU OE2 O -12.290 10.045 -2.282 1.00 . B B . 21 GLU OE2 1 1 13 10050 2 2 22 ARG C C -11.298 2.678 -1.608 1.00 . B B . 22 ARG C 1 1 13 10051 2 2 22 ARG CA C -11.652 4.116 -2.069 1.00 . B B . 22 ARG CA 1 1 13 10052 2 2 22 ARG CB C -10.643 4.720 -3.072 1.00 . B B . 22 ARG CB 1 1 13 10053 2 2 22 ARG CD C -10.105 7.070 -3.824 1.00 . B B . 22 ARG CD 1 1 13 10054 2 2 22 ARG CG C -11.224 6.081 -3.558 1.00 . B B . 22 ARG CG 1 1 13 10055 2 2 22 ARG CZ C -11.261 8.898 -4.989 1.00 . B B . 22 ARG CZ 1 1 13 10056 2 2 22 ARG H H -10.985 5.743 -0.890 1.00 . B B . 22 ARG H 1 1 13 10057 2 2 22 ARG HA H -12.620 4.108 -2.517 1.00 . B B . 22 ARG HA 1 1 13 10058 2 2 22 ARG HB2 H -9.694 4.853 -2.577 1.00 . B B . 22 ARG HB2 1 1 13 10059 2 2 22 ARG HB3 H -10.509 4.044 -3.903 1.00 . B B . 22 ARG HB3 1 1 13 10060 2 2 22 ARG HD2 H -9.449 7.087 -2.957 1.00 . B B . 22 ARG HD2 1 1 13 10061 2 2 22 ARG HD3 H -9.534 6.814 -4.708 1.00 . B B . 22 ARG HD3 1 1 13 10062 2 2 22 ARG HE H -10.972 8.958 -3.130 1.00 . B B . 22 ARG HE 1 1 13 10063 2 2 22 ARG HG2 H -11.772 5.926 -4.478 1.00 . B B . 22 ARG HG2 1 1 13 10064 2 2 22 ARG HG3 H -11.930 6.503 -2.851 1.00 . B B . 22 ARG HG3 1 1 13 10065 2 2 22 ARG HH11 H -9.621 8.526 -5.841 1.00 . B B . 22 ARG HH11 1 1 13 10066 2 2 22 ARG HH12 H -10.813 9.307 -6.851 1.00 . B B . 22 ARG HH12 1 1 13 10067 2 2 22 ARG HH21 H -12.876 9.249 -4.058 1.00 . B B . 22 ARG HH21 1 1 13 10068 2 2 22 ARG HH22 H -12.903 9.745 -5.711 1.00 . B B . 22 ARG HH22 1 1 13 10069 2 2 22 ARG N N -11.724 5.131 -0.990 1.00 . B B . 22 ARG N 1 1 13 10070 2 2 22 ARG NE N -10.811 8.396 -3.930 1.00 . B B . 22 ARG NE 1 1 13 10071 2 2 22 ARG NH1 N -10.516 8.923 -5.993 1.00 . B B . 22 ARG NH1 1 1 13 10072 2 2 22 ARG NH2 N -12.427 9.339 -4.956 1.00 . B B . 22 ARG NH2 1 1 13 10073 2 2 22 ARG O O -10.271 2.120 -1.943 1.00 . B B . 22 ARG O 1 1 13 10074 2 2 23 GLY C C -11.012 -0.197 -0.450 1.00 . B B . 23 GLY C 1 1 13 10075 2 2 23 GLY CA C -12.180 0.772 -0.210 1.00 . B B . 23 GLY CA 1 1 13 10076 2 2 23 GLY H H -12.979 2.752 -0.652 1.00 . B B . 23 GLY H 1 1 13 10077 2 2 23 GLY HA2 H -12.253 0.882 0.862 1.00 . B B . 23 GLY HA2 1 1 13 10078 2 2 23 GLY HA3 H -13.065 0.241 -0.529 1.00 . B B . 23 GLY HA3 1 1 13 10079 2 2 23 GLY N N -12.212 2.159 -0.833 1.00 . B B . 23 GLY N 1 1 13 10080 2 2 23 GLY O O -11.238 -1.330 -0.813 1.00 . B B . 23 GLY O 1 1 13 10081 2 2 24 PHE C C -8.636 -2.066 -0.774 1.00 . B B . 24 PHE C 1 1 13 10082 2 2 24 PHE CA C -8.556 -0.542 -0.415 1.00 . B B . 24 PHE CA 1 1 13 10083 2 2 24 PHE CB C -7.736 -0.284 0.909 1.00 . B B . 24 PHE CB 1 1 13 10084 2 2 24 PHE CD1 C -9.669 -1.197 2.358 1.00 . B B . 24 PHE CD1 1 1 13 10085 2 2 24 PHE CD2 C -8.077 0.248 3.352 1.00 . B B . 24 PHE CD2 1 1 13 10086 2 2 24 PHE CE1 C -10.328 -1.298 3.564 1.00 . B B . 24 PHE CE1 1 1 13 10087 2 2 24 PHE CE2 C -8.732 0.151 4.563 1.00 . B B . 24 PHE CE2 1 1 13 10088 2 2 24 PHE CG C -8.531 -0.424 2.232 1.00 . B B . 24 PHE CG 1 1 13 10089 2 2 24 PHE CZ C -9.862 -0.625 4.670 1.00 . B B . 24 PHE CZ 1 1 13 10090 2 2 24 PHE H H -9.759 1.203 0.030 1.00 . B B . 24 PHE H 1 1 13 10091 2 2 24 PHE HA H -8.011 -0.093 -1.227 1.00 . B B . 24 PHE HA 1 1 13 10092 2 2 24 PHE HB2 H -6.921 -0.988 0.956 1.00 . B B . 24 PHE HB2 1 1 13 10093 2 2 24 PHE HB3 H -7.317 0.712 0.874 1.00 . B B . 24 PHE HB3 1 1 13 10094 2 2 24 PHE HD1 H -10.057 -1.736 1.507 1.00 . B B . 24 PHE HD1 1 1 13 10095 2 2 24 PHE HD2 H -7.196 0.868 3.284 1.00 . B B . 24 PHE HD2 1 1 13 10096 2 2 24 PHE HE1 H -11.214 -1.913 3.636 1.00 . B B . 24 PHE HE1 1 1 13 10097 2 2 24 PHE HE2 H -8.355 0.685 5.425 1.00 . B B . 24 PHE HE2 1 1 13 10098 2 2 24 PHE HZ H -10.388 -0.703 5.612 1.00 . B B . 24 PHE HZ 1 1 13 10099 2 2 24 PHE N N -9.815 0.267 -0.242 1.00 . B B . 24 PHE N 1 1 13 10100 2 2 24 PHE O O -8.922 -2.929 0.031 1.00 . B B . 24 PHE O 1 1 13 10101 2 2 25 PHE C C -7.180 -4.646 -1.982 1.00 . B B . 25 PHE C 1 1 13 10102 2 2 25 PHE CA C -8.400 -3.798 -2.479 1.00 . B B . 25 PHE CA 1 1 13 10103 2 2 25 PHE CB C -8.475 -3.717 -4.019 1.00 . B B . 25 PHE CB 1 1 13 10104 2 2 25 PHE CD1 C -10.286 -5.371 -4.583 1.00 . B B . 25 PHE CD1 1 1 13 10105 2 2 25 PHE CD2 C -8.047 -5.966 -5.094 1.00 . B B . 25 PHE CD2 1 1 13 10106 2 2 25 PHE CE1 C -10.729 -6.575 -5.086 1.00 . B B . 25 PHE CE1 1 1 13 10107 2 2 25 PHE CE2 C -8.482 -7.172 -5.599 1.00 . B B . 25 PHE CE2 1 1 13 10108 2 2 25 PHE CG C -8.945 -5.058 -4.584 1.00 . B B . 25 PHE CG 1 1 13 10109 2 2 25 PHE CZ C -9.825 -7.480 -5.596 1.00 . B B . 25 PHE CZ 1 1 13 10110 2 2 25 PHE H H -8.103 -1.667 -2.639 1.00 . B B . 25 PHE H 1 1 13 10111 2 2 25 PHE HA H -9.296 -4.268 -2.096 1.00 . B B . 25 PHE HA 1 1 13 10112 2 2 25 PHE HB2 H -9.181 -2.955 -4.320 1.00 . B B . 25 PHE HB2 1 1 13 10113 2 2 25 PHE HB3 H -7.511 -3.477 -4.438 1.00 . B B . 25 PHE HB3 1 1 13 10114 2 2 25 PHE HD1 H -10.994 -4.662 -4.182 1.00 . B B . 25 PHE HD1 1 1 13 10115 2 2 25 PHE HD2 H -6.994 -5.728 -5.094 1.00 . B B . 25 PHE HD2 1 1 13 10116 2 2 25 PHE HE1 H -11.786 -6.801 -5.078 1.00 . B B . 25 PHE HE1 1 1 13 10117 2 2 25 PHE HE2 H -7.764 -7.874 -5.997 1.00 . B B . 25 PHE HE2 1 1 13 10118 2 2 25 PHE HZ H -10.164 -8.427 -5.992 1.00 . B B . 25 PHE HZ 1 1 13 10119 2 2 25 PHE N N -8.353 -2.373 -2.008 1.00 . B B . 25 PHE N 1 1 13 10120 2 2 25 PHE O O -6.281 -4.999 -2.725 1.00 . B B . 25 PHE O 1 1 13 10121 2 2 26 TYR C C -6.534 -6.806 0.940 1.00 . B B . 26 TYR C 1 1 13 10122 2 2 26 TYR CA C -6.058 -5.750 -0.096 1.00 . B B . 26 TYR CA 1 1 13 10123 2 2 26 TYR CB C -5.058 -4.784 0.597 1.00 . B B . 26 TYR CB 1 1 13 10124 2 2 26 TYR CD1 C -6.697 -3.673 2.176 1.00 . B B . 26 TYR CD1 1 1 13 10125 2 2 26 TYR CD2 C -4.878 -4.842 3.130 1.00 . B B . 26 TYR CD2 1 1 13 10126 2 2 26 TYR CE1 C -7.163 -3.363 3.435 1.00 . B B . 26 TYR CE1 1 1 13 10127 2 2 26 TYR CE2 C -5.350 -4.528 4.394 1.00 . B B . 26 TYR CE2 1 1 13 10128 2 2 26 TYR CG C -5.556 -4.414 2.008 1.00 . B B . 26 TYR CG 1 1 13 10129 2 2 26 TYR CZ C -6.493 -3.789 4.541 1.00 . B B . 26 TYR CZ 1 1 13 10130 2 2 26 TYR H H -7.920 -4.601 -0.166 1.00 . B B . 26 TYR H 1 1 13 10131 2 2 26 TYR HA H -5.557 -6.294 -0.886 1.00 . B B . 26 TYR HA 1 1 13 10132 2 2 26 TYR HB2 H -4.097 -5.266 0.677 1.00 . B B . 26 TYR HB2 1 1 13 10133 2 2 26 TYR HB3 H -4.965 -3.880 0.011 1.00 . B B . 26 TYR HB3 1 1 13 10134 2 2 26 TYR HD1 H -7.233 -3.329 1.309 1.00 . B B . 26 TYR HD1 1 1 13 10135 2 2 26 TYR HD2 H -3.975 -5.421 3.017 1.00 . B B . 26 TYR HD2 1 1 13 10136 2 2 26 TYR HE1 H -8.064 -2.778 3.547 1.00 . B B . 26 TYR HE1 1 1 13 10137 2 2 26 TYR HE2 H -4.822 -4.858 5.277 1.00 . B B . 26 TYR HE2 1 1 13 10138 2 2 26 TYR HH H -7.083 -2.526 5.770 1.00 . B B . 26 TYR HH 1 1 13 10139 2 2 26 TYR N N -7.172 -4.934 -0.709 1.00 . B B . 26 TYR N 1 1 13 10140 2 2 26 TYR O O -7.684 -6.862 1.324 1.00 . B B . 26 TYR O 1 1 13 10141 2 2 26 TYR OH O -6.982 -3.489 5.790 1.00 . B B . 26 TYR OH 1 1 13 10142 2 2 27 THR C C -5.371 -8.391 3.791 1.00 . B B . 27 THR C 1 1 13 10143 2 2 27 THR CA C -6.006 -8.667 2.408 1.00 . B B . 27 THR CA 1 1 13 10144 2 2 27 THR CB C -5.609 -10.078 1.846 1.00 . B B . 27 THR CB 1 1 13 10145 2 2 27 THR CG2 C -4.136 -10.406 1.731 1.00 . B B . 27 THR CG2 1 1 13 10146 2 2 27 THR H H -4.707 -7.538 1.052 1.00 . B B . 27 THR H 1 1 13 10147 2 2 27 THR HA H -7.075 -8.673 2.552 1.00 . B B . 27 THR HA 1 1 13 10148 2 2 27 THR HB H -6.157 -10.301 0.935 1.00 . B B . 27 THR HB 1 1 13 10149 2 2 27 THR HG1 H -6.527 -11.664 2.506 1.00 . B B . 27 THR HG1 1 1 13 10150 2 2 27 THR HG21 H -3.631 -9.684 1.112 1.00 . B B . 27 THR HG21 1 1 13 10151 2 2 27 THR HG22 H -3.658 -10.453 2.694 1.00 . B B . 27 THR HG22 1 1 13 10152 2 2 27 THR HG23 H -4.038 -11.383 1.283 1.00 . B B . 27 THR HG23 1 1 13 10153 2 2 27 THR N N -5.618 -7.623 1.389 1.00 . B B . 27 THR N 1 1 13 10154 2 2 27 THR O O -5.953 -7.603 4.514 1.00 . B B . 27 THR O 1 1 13 10155 2 2 27 THR OG1 O -5.986 -10.960 2.889 1.00 . B B . 27 THR OG1 1 1 13 10156 2 2 28 PRO C C -5.570 -9.767 6.236 1.00 . B B . 28 PRO C 1 1 13 10157 2 2 28 PRO CA C -4.199 -9.714 5.480 1.00 . B B . 28 PRO CA 1 1 13 10158 2 2 28 PRO CB C -3.082 -8.988 6.253 1.00 . B B . 28 PRO CB 1 1 13 10159 2 2 28 PRO CD C -3.074 -8.037 4.057 1.00 . B B . 28 PRO CD 1 1 13 10160 2 2 28 PRO CG C -2.121 -8.592 5.121 1.00 . B B . 28 PRO CG 1 1 13 10161 2 2 28 PRO HA H -3.898 -10.730 5.273 1.00 . B B . 28 PRO HA 1 1 13 10162 2 2 28 PRO HB2 H -3.469 -8.124 6.778 1.00 . B B . 28 PRO HB2 1 1 13 10163 2 2 28 PRO HB3 H -2.613 -9.653 6.965 1.00 . B B . 28 PRO HB3 1 1 13 10164 2 2 28 PRO HD2 H -3.360 -7.023 4.304 1.00 . B B . 28 PRO HD2 1 1 13 10165 2 2 28 PRO HD3 H -2.645 -8.087 3.065 1.00 . B B . 28 PRO HD3 1 1 13 10166 2 2 28 PRO HG2 H -1.421 -7.838 5.457 1.00 . B B . 28 PRO HG2 1 1 13 10167 2 2 28 PRO HG3 H -1.579 -9.452 4.746 1.00 . B B . 28 PRO HG3 1 1 13 10168 2 2 28 PRO N N -4.249 -8.959 4.164 1.00 . B B . 28 PRO N 1 1 13 10169 2 2 28 PRO O O -5.713 -9.421 7.393 1.00 . B B . 28 PRO O 1 1 13 10170 2 2 29 LYS C C -8.560 -11.761 6.014 1.00 . B B . 29 LYS C 1 1 13 10171 2 2 29 LYS CA C -7.967 -10.323 6.080 1.00 . B B . 29 LYS CA 1 1 13 10172 2 2 29 LYS CB C -8.793 -9.274 5.259 1.00 . B B . 29 LYS CB 1 1 13 10173 2 2 29 LYS CD C -9.043 -7.631 7.260 1.00 . B B . 29 LYS CD 1 1 13 10174 2 2 29 LYS CE C -7.710 -6.985 6.825 1.00 . B B . 29 LYS CE 1 1 13 10175 2 2 29 LYS CG C -9.782 -8.454 6.133 1.00 . B B . 29 LYS CG 1 1 13 10176 2 2 29 LYS H H -6.373 -10.479 4.607 1.00 . B B . 29 LYS H 1 1 13 10177 2 2 29 LYS HA H -7.961 -10.054 7.126 1.00 . B B . 29 LYS HA 1 1 13 10178 2 2 29 LYS HB2 H -8.129 -8.617 4.717 1.00 . B B . 29 LYS HB2 1 1 13 10179 2 2 29 LYS HB3 H -9.368 -9.805 4.509 1.00 . B B . 29 LYS HB3 1 1 13 10180 2 2 29 LYS HD2 H -9.700 -6.851 7.623 1.00 . B B . 29 LYS HD2 1 1 13 10181 2 2 29 LYS HD3 H -8.839 -8.285 8.097 1.00 . B B . 29 LYS HD3 1 1 13 10182 2 2 29 LYS HE2 H -7.285 -6.396 7.631 1.00 . B B . 29 LYS HE2 1 1 13 10183 2 2 29 LYS HE3 H -6.997 -7.763 6.590 1.00 . B B . 29 LYS HE3 1 1 13 10184 2 2 29 LYS HG2 H -10.384 -7.811 5.503 1.00 . B B . 29 LYS HG2 1 1 13 10185 2 2 29 LYS HG3 H -10.470 -9.152 6.600 1.00 . B B . 29 LYS HG3 1 1 13 10186 2 2 29 LYS HZ1 H -8.920 -6.199 5.281 1.00 . B B . 29 LYS HZ1 1 1 13 10187 2 2 29 LYS HZ2 H -7.664 -5.148 5.766 1.00 . B B . 29 LYS HZ2 1 1 13 10188 2 2 29 LYS HZ3 H -7.318 -6.516 4.877 1.00 . B B . 29 LYS HZ3 1 1 13 10189 2 2 29 LYS N N -6.570 -10.212 5.531 1.00 . B B . 29 LYS N 1 1 13 10190 2 2 29 LYS NZ N -7.945 -6.142 5.619 1.00 . B B . 29 LYS NZ 1 1 13 10191 2 2 29 LYS O O -9.503 -12.029 5.302 1.00 . B B . 29 LYS O 1 1 13 10192 2 2 30 THR C C -9.454 -14.596 5.775 1.00 . B B . 30 THR C 1 1 13 10193 2 2 30 THR CA C -8.426 -14.111 6.832 1.00 . B B . 30 THR CA 1 1 13 10194 2 2 30 THR CB C -9.001 -14.372 8.248 1.00 . B B . 30 THR CB 1 1 13 10195 2 2 30 THR CG2 C -10.445 -13.935 8.405 1.00 . B B . 30 THR CG2 1 1 13 10196 2 2 30 THR H H -7.225 -12.343 7.311 1.00 . B B . 30 THR H 1 1 13 10197 2 2 30 THR HA H -7.562 -14.751 6.729 1.00 . B B . 30 THR HA 1 1 13 10198 2 2 30 THR HB H -8.354 -14.016 9.042 1.00 . B B . 30 THR HB 1 1 13 10199 2 2 30 THR HG1 H -9.652 -16.111 7.578 1.00 . B B . 30 THR HG1 1 1 13 10200 2 2 30 THR HG21 H -10.548 -12.878 8.220 1.00 . B B . 30 THR HG21 1 1 13 10201 2 2 30 THR HG22 H -11.095 -14.477 7.733 1.00 . B B . 30 THR HG22 1 1 13 10202 2 2 30 THR HG23 H -10.762 -14.149 9.414 1.00 . B B . 30 THR HG23 1 1 13 10203 2 2 30 THR N N -7.980 -12.651 6.770 1.00 . B B . 30 THR N 1 1 13 10204 2 2 30 THR O O -9.831 -15.752 5.734 1.00 . B B . 30 THR O 1 1 13 10205 2 2 30 THR OG1 O -9.175 -15.770 8.350 1.00 . B B . 30 THR OG1 1 1 14 10206 1 1 1 GLY C C -1.906 -6.177 -1.547 1.00 . A A . 1 GLY C 1 1 14 10207 1 1 1 GLY CA C -3.197 -6.625 -0.863 1.00 . A A . 1 GLY CA 1 1 14 10208 1 1 1 GLY HA2 H -3.433 -7.614 -1.223 1.00 . A A . 1 GLY HA2 1 1 14 10209 1 1 1 GLY HA3 H -3.979 -5.942 -1.157 1.00 . A A . 1 GLY HA3 1 1 14 10210 1 1 1 GLY N N -3.087 -6.655 0.641 1.00 . A A . 1 GLY N 1 1 14 10211 1 1 1 GLY O O -1.573 -6.598 -2.634 1.00 . A A . 1 GLY O 1 1 14 10212 1 1 2 ILE C C 1.277 -5.358 -0.591 1.00 . A A . 2 ILE C 1 1 14 10213 1 1 2 ILE CA C 0.099 -4.752 -1.356 1.00 . A A . 2 ILE CA 1 1 14 10214 1 1 2 ILE CB C 0.092 -3.198 -1.154 1.00 . A A . 2 ILE CB 1 1 14 10215 1 1 2 ILE CD1 C -1.914 -2.634 0.291 1.00 . A A . 2 ILE CD1 1 1 14 10216 1 1 2 ILE CG1 C -1.348 -2.657 -1.154 1.00 . A A . 2 ILE CG1 1 1 14 10217 1 1 2 ILE CG2 C 0.859 -2.556 -2.327 1.00 . A A . 2 ILE CG2 1 1 14 10218 1 1 2 ILE H H -1.574 -5.071 0.008 1.00 . A A . 2 ILE H 1 1 14 10219 1 1 2 ILE HA H 0.257 -5.002 -2.394 1.00 . A A . 2 ILE HA 1 1 14 10220 1 1 2 ILE HB H 0.584 -2.936 -0.225 1.00 . A A . 2 ILE HB 1 1 14 10221 1 1 2 ILE HD11 H -1.880 -3.581 0.806 1.00 . A A . 2 ILE HD11 1 1 14 10222 1 1 2 ILE HD12 H -1.354 -1.917 0.874 1.00 . A A . 2 ILE HD12 1 1 14 10223 1 1 2 ILE HD13 H -2.944 -2.306 0.271 1.00 . A A . 2 ILE HD13 1 1 14 10224 1 1 2 ILE HG12 H -1.382 -1.671 -1.600 1.00 . A A . 2 ILE HG12 1 1 14 10225 1 1 2 ILE HG13 H -1.966 -3.310 -1.742 1.00 . A A . 2 ILE HG13 1 1 14 10226 1 1 2 ILE HG21 H 0.411 -2.816 -3.275 1.00 . A A . 2 ILE HG21 1 1 14 10227 1 1 2 ILE HG22 H 0.865 -1.481 -2.250 1.00 . A A . 2 ILE HG22 1 1 14 10228 1 1 2 ILE HG23 H 1.887 -2.885 -2.323 1.00 . A A . 2 ILE HG23 1 1 14 10229 1 1 2 ILE N N -1.210 -5.328 -0.861 1.00 . A A . 2 ILE N 1 1 14 10230 1 1 2 ILE O O 2.417 -4.979 -0.747 1.00 . A A . 2 ILE O 1 1 14 10231 1 1 3 VAL C C 3.300 -7.299 0.404 1.00 . A A . 3 VAL C 1 1 14 10232 1 1 3 VAL CA C 1.953 -7.009 1.081 1.00 . A A . 3 VAL CA 1 1 14 10233 1 1 3 VAL CB C 1.239 -8.318 1.581 1.00 . A A . 3 VAL CB 1 1 14 10234 1 1 3 VAL CG1 C 0.145 -7.923 2.576 1.00 . A A . 3 VAL CG1 1 1 14 10235 1 1 3 VAL CG2 C 0.494 -9.046 0.429 1.00 . A A . 3 VAL CG2 1 1 14 10236 1 1 3 VAL H H 0.006 -6.530 0.319 1.00 . A A . 3 VAL H 1 1 14 10237 1 1 3 VAL HA H 2.218 -6.332 1.875 1.00 . A A . 3 VAL HA 1 1 14 10238 1 1 3 VAL HB H 1.964 -8.978 2.046 1.00 . A A . 3 VAL HB 1 1 14 10239 1 1 3 VAL HG11 H -0.583 -7.267 2.116 1.00 . A A . 3 VAL HG11 1 1 14 10240 1 1 3 VAL HG12 H -0.375 -8.798 2.938 1.00 . A A . 3 VAL HG12 1 1 14 10241 1 1 3 VAL HG13 H 0.579 -7.403 3.416 1.00 . A A . 3 VAL HG13 1 1 14 10242 1 1 3 VAL HG21 H -0.256 -8.414 -0.023 1.00 . A A . 3 VAL HG21 1 1 14 10243 1 1 3 VAL HG22 H 1.178 -9.358 -0.342 1.00 . A A . 3 VAL HG22 1 1 14 10244 1 1 3 VAL HG23 H 0.000 -9.929 0.809 1.00 . A A . 3 VAL HG23 1 1 14 10245 1 1 3 VAL N N 0.946 -6.291 0.243 1.00 . A A . 3 VAL N 1 1 14 10246 1 1 3 VAL O O 4.323 -6.839 0.873 1.00 . A A . 3 VAL O 1 1 14 10247 1 1 4 GLU C C 5.095 -7.013 -1.987 1.00 . A A . 4 GLU C 1 1 14 10248 1 1 4 GLU CA C 4.589 -8.322 -1.351 1.00 . A A . 4 GLU CA 1 1 14 10249 1 1 4 GLU CB C 4.343 -9.462 -2.413 1.00 . A A . 4 GLU CB 1 1 14 10250 1 1 4 GLU CD C 2.173 -8.479 -3.465 1.00 . A A . 4 GLU CD 1 1 14 10251 1 1 4 GLU CG C 2.834 -9.679 -2.849 1.00 . A A . 4 GLU CG 1 1 14 10252 1 1 4 GLU H H 2.460 -8.358 -1.041 1.00 . A A . 4 GLU H 1 1 14 10253 1 1 4 GLU HA H 5.298 -8.630 -0.602 1.00 . A A . 4 GLU HA 1 1 14 10254 1 1 4 GLU HB2 H 4.929 -9.257 -3.299 1.00 . A A . 4 GLU HB2 1 1 14 10255 1 1 4 GLU HB3 H 4.715 -10.388 -1.993 1.00 . A A . 4 GLU HB3 1 1 14 10256 1 1 4 GLU HG2 H 2.801 -10.464 -3.589 1.00 . A A . 4 GLU HG2 1 1 14 10257 1 1 4 GLU HG3 H 2.237 -10.004 -2.016 1.00 . A A . 4 GLU HG3 1 1 14 10258 1 1 4 GLU N N 3.299 -8.023 -0.672 1.00 . A A . 4 GLU N 1 1 14 10259 1 1 4 GLU O O 6.190 -6.552 -1.715 1.00 . A A . 4 GLU O 1 1 14 10260 1 1 4 GLU OE1 O 2.273 -8.368 -4.663 1.00 . A A . 4 GLU OE1 1 1 14 10261 1 1 4 GLU OE2 O 1.581 -7.696 -2.748 1.00 . A A . 4 GLU OE2 1 1 14 10262 1 1 5 GLN C C 5.375 -4.148 -2.656 1.00 . A A . 5 GLN C 1 1 14 10263 1 1 5 GLN CA C 4.595 -5.168 -3.526 1.00 . A A . 5 GLN CA 1 1 14 10264 1 1 5 GLN CB C 3.237 -4.588 -4.006 1.00 . A A . 5 GLN CB 1 1 14 10265 1 1 5 GLN CD C 2.249 -4.489 -6.352 1.00 . A A . 5 GLN CD 1 1 14 10266 1 1 5 GLN CG C 2.667 -5.406 -5.213 1.00 . A A . 5 GLN CG 1 1 14 10267 1 1 5 GLN H H 3.425 -6.900 -2.982 1.00 . A A . 5 GLN H 1 1 14 10268 1 1 5 GLN HA H 5.240 -5.378 -4.369 1.00 . A A . 5 GLN HA 1 1 14 10269 1 1 5 GLN HB2 H 2.542 -4.680 -3.184 1.00 . A A . 5 GLN HB2 1 1 14 10270 1 1 5 GLN HB3 H 3.323 -3.543 -4.255 1.00 . A A . 5 GLN HB3 1 1 14 10271 1 1 5 GLN HE21 H 0.327 -4.975 -6.352 1.00 . A A . 5 GLN HE21 1 1 14 10272 1 1 5 GLN HE22 H 0.830 -3.830 -7.490 1.00 . A A . 5 GLN HE22 1 1 14 10273 1 1 5 GLN HG2 H 3.387 -6.110 -5.602 1.00 . A A . 5 GLN HG2 1 1 14 10274 1 1 5 GLN HG3 H 1.796 -5.957 -4.899 1.00 . A A . 5 GLN HG3 1 1 14 10275 1 1 5 GLN N N 4.279 -6.450 -2.823 1.00 . A A . 5 GLN N 1 1 14 10276 1 1 5 GLN NE2 N 1.031 -4.438 -6.754 1.00 . A A . 5 GLN NE2 1 1 14 10277 1 1 5 GLN O O 6.396 -3.646 -3.081 1.00 . A A . 5 GLN O 1 1 14 10278 1 1 5 GLN OE1 O 3.037 -3.774 -6.926 1.00 . A A . 5 GLN OE1 1 1 14 10279 1 1 6 CYS C C 6.191 -3.470 0.751 1.00 . A A . 6 CYS C 1 1 14 10280 1 1 6 CYS CA C 5.515 -2.912 -0.521 1.00 . A A . 6 CYS CA 1 1 14 10281 1 1 6 CYS CB C 4.429 -1.888 -0.086 1.00 . A A . 6 CYS CB 1 1 14 10282 1 1 6 CYS H H 4.047 -4.360 -1.208 1.00 . A A . 6 CYS H 1 1 14 10283 1 1 6 CYS HA H 6.293 -2.374 -1.035 1.00 . A A . 6 CYS HA 1 1 14 10284 1 1 6 CYS HB2 H 3.561 -2.452 0.210 1.00 . A A . 6 CYS HB2 1 1 14 10285 1 1 6 CYS HB3 H 4.782 -1.368 0.791 1.00 . A A . 6 CYS HB3 1 1 14 10286 1 1 6 CYS HG H 4.527 0.029 -1.324 1.00 . A A . 6 CYS HG 1 1 14 10287 1 1 6 CYS N N 4.874 -3.891 -1.475 1.00 . A A . 6 CYS N 1 1 14 10288 1 1 6 CYS O O 7.200 -2.968 1.202 1.00 . A A . 6 CYS O 1 1 14 10289 1 1 6 CYS SG S 3.825 -0.621 -1.229 1.00 . A A . 6 CYS SG 1 1 14 10290 1 1 7 CYS C C 7.024 -6.418 2.362 1.00 . A A . 7 CYS C 1 1 14 10291 1 1 7 CYS CA C 6.214 -5.105 2.548 1.00 . A A . 7 CYS CA 1 1 14 10292 1 1 7 CYS CB C 4.971 -5.211 3.436 1.00 . A A . 7 CYS CB 1 1 14 10293 1 1 7 CYS H H 4.855 -4.921 0.874 1.00 . A A . 7 CYS H 1 1 14 10294 1 1 7 CYS HA H 6.890 -4.393 3.005 1.00 . A A . 7 CYS HA 1 1 14 10295 1 1 7 CYS HB2 H 4.567 -4.205 3.464 1.00 . A A . 7 CYS HB2 1 1 14 10296 1 1 7 CYS HB3 H 4.224 -5.795 2.923 1.00 . A A . 7 CYS HB3 1 1 14 10297 1 1 7 CYS HG H 5.210 -6.787 5.084 1.00 . A A . 7 CYS HG 1 1 14 10298 1 1 7 CYS N N 5.639 -4.513 1.296 1.00 . A A . 7 CYS N 1 1 14 10299 1 1 7 CYS O O 7.070 -7.332 3.158 1.00 . A A . 7 CYS O 1 1 14 10300 1 1 7 CYS SG S 5.191 -5.828 5.127 1.00 . A A . 7 CYS SG 1 1 14 10301 1 1 8 THR C C 9.500 -6.889 -0.294 1.00 . A A . 8 THR C 1 1 14 10302 1 1 8 THR CA C 8.562 -7.530 0.727 1.00 . A A . 8 THR CA 1 1 14 10303 1 1 8 THR CB C 7.793 -8.648 0.008 1.00 . A A . 8 THR CB 1 1 14 10304 1 1 8 THR CG2 C 8.646 -9.879 -0.152 1.00 . A A . 8 THR CG2 1 1 14 10305 1 1 8 THR H H 7.493 -5.601 0.709 1.00 . A A . 8 THR H 1 1 14 10306 1 1 8 THR HA H 9.159 -7.924 1.536 1.00 . A A . 8 THR HA 1 1 14 10307 1 1 8 THR HB H 7.306 -8.351 -0.909 1.00 . A A . 8 THR HB 1 1 14 10308 1 1 8 THR HG1 H 6.903 -8.666 1.769 1.00 . A A . 8 THR HG1 1 1 14 10309 1 1 8 THR HG21 H 8.945 -10.247 0.818 1.00 . A A . 8 THR HG21 1 1 14 10310 1 1 8 THR HG22 H 8.066 -10.647 -0.641 1.00 . A A . 8 THR HG22 1 1 14 10311 1 1 8 THR HG23 H 9.528 -9.666 -0.737 1.00 . A A . 8 THR HG23 1 1 14 10312 1 1 8 THR N N 7.656 -6.414 1.232 1.00 . A A . 8 THR N 1 1 14 10313 1 1 8 THR O O 10.698 -7.063 -0.302 1.00 . A A . 8 THR O 1 1 14 10314 1 1 8 THR OG1 O 6.875 -9.178 0.945 1.00 . A A . 8 THR OG1 1 1 14 10315 1 1 9 SER C C 9.436 -3.873 -1.894 1.00 . A A . 9 SER C 1 1 14 10316 1 1 9 SER CA C 9.521 -5.382 -2.267 1.00 . A A . 9 SER CA 1 1 14 10317 1 1 9 SER CB C 8.754 -5.728 -3.566 1.00 . A A . 9 SER CB 1 1 14 10318 1 1 9 SER H H 7.887 -6.109 -1.077 1.00 . A A . 9 SER H 1 1 14 10319 1 1 9 SER HA H 10.567 -5.642 -2.341 1.00 . A A . 9 SER HA 1 1 14 10320 1 1 9 SER HB2 H 8.867 -6.780 -3.800 1.00 . A A . 9 SER HB2 1 1 14 10321 1 1 9 SER HB3 H 7.699 -5.506 -3.465 1.00 . A A . 9 SER HB3 1 1 14 10322 1 1 9 SER HG H 9.769 -5.461 -5.255 1.00 . A A . 9 SER HG 1 1 14 10323 1 1 9 SER N N 8.862 -6.151 -1.156 1.00 . A A . 9 SER N 1 1 14 10324 1 1 9 SER O O 9.839 -3.514 -0.807 1.00 . A A . 9 SER O 1 1 14 10325 1 1 9 SER OG O 9.347 -4.913 -4.579 1.00 . A A . 9 SER OG 1 1 14 10326 1 1 10 ILE C C 7.484 -0.873 -2.715 1.00 . A A . 10 ILE C 1 1 14 10327 1 1 10 ILE CA C 8.837 -1.548 -2.447 1.00 . A A . 10 ILE CA 1 1 14 10328 1 1 10 ILE CB C 9.970 -0.817 -3.246 1.00 . A A . 10 ILE CB 1 1 14 10329 1 1 10 ILE CD1 C 12.331 0.046 -2.683 1.00 . A A . 10 ILE CD1 1 1 14 10330 1 1 10 ILE CG1 C 11.270 -1.035 -2.430 1.00 . A A . 10 ILE CG1 1 1 14 10331 1 1 10 ILE CG2 C 9.630 0.691 -3.464 1.00 . A A . 10 ILE CG2 1 1 14 10332 1 1 10 ILE H H 8.680 -3.411 -3.616 1.00 . A A . 10 ILE H 1 1 14 10333 1 1 10 ILE HA H 9.033 -1.385 -1.397 1.00 . A A . 10 ILE HA 1 1 14 10334 1 1 10 ILE HB H 10.087 -1.296 -4.208 1.00 . A A . 10 ILE HB 1 1 14 10335 1 1 10 ILE HD11 H 11.923 1.008 -2.420 1.00 . A A . 10 ILE HD11 1 1 14 10336 1 1 10 ILE HD12 H 13.198 -0.128 -2.062 1.00 . A A . 10 ILE HD12 1 1 14 10337 1 1 10 ILE HD13 H 12.625 0.081 -3.719 1.00 . A A . 10 ILE HD13 1 1 14 10338 1 1 10 ILE HG12 H 11.045 -1.070 -1.374 1.00 . A A . 10 ILE HG12 1 1 14 10339 1 1 10 ILE HG13 H 11.664 -2.002 -2.708 1.00 . A A . 10 ILE HG13 1 1 14 10340 1 1 10 ILE HG21 H 9.472 1.148 -2.499 1.00 . A A . 10 ILE HG21 1 1 14 10341 1 1 10 ILE HG22 H 10.423 1.201 -3.988 1.00 . A A . 10 ILE HG22 1 1 14 10342 1 1 10 ILE HG23 H 8.727 0.826 -4.048 1.00 . A A . 10 ILE HG23 1 1 14 10343 1 1 10 ILE N N 8.952 -3.030 -2.756 1.00 . A A . 10 ILE N 1 1 14 10344 1 1 10 ILE O O 6.856 -0.324 -1.835 1.00 . A A . 10 ILE O 1 1 14 10345 1 1 11 CYS C C 5.574 1.161 -4.232 1.00 . A A . 11 CYS C 1 1 14 10346 1 1 11 CYS CA C 5.824 -0.365 -4.457 1.00 . A A . 11 CYS CA 1 1 14 10347 1 1 11 CYS CB C 4.706 -1.216 -3.835 1.00 . A A . 11 CYS CB 1 1 14 10348 1 1 11 CYS H H 7.707 -1.433 -4.551 1.00 . A A . 11 CYS H 1 1 14 10349 1 1 11 CYS HA H 5.812 -0.525 -5.519 1.00 . A A . 11 CYS HA 1 1 14 10350 1 1 11 CYS HB2 H 4.444 -1.965 -4.563 1.00 . A A . 11 CYS HB2 1 1 14 10351 1 1 11 CYS HB3 H 5.122 -1.724 -2.982 1.00 . A A . 11 CYS HB3 1 1 14 10352 1 1 11 CYS HG H 2.537 -0.421 -3.943 1.00 . A A . 11 CYS HG 1 1 14 10353 1 1 11 CYS N N 7.104 -0.954 -3.956 1.00 . A A . 11 CYS N 1 1 14 10354 1 1 11 CYS O O 5.672 1.749 -3.176 1.00 . A A . 11 CYS O 1 1 14 10355 1 1 11 CYS SG S 3.190 -0.423 -3.242 1.00 . A A . 11 CYS SG 1 1 14 10356 1 1 12 SER C C 3.476 3.655 -5.291 1.00 . A A . 12 SER C 1 1 14 10357 1 1 12 SER CA C 4.946 3.243 -5.369 1.00 . A A . 12 SER CA 1 1 14 10358 1 1 12 SER CB C 5.587 3.752 -6.643 1.00 . A A . 12 SER CB 1 1 14 10359 1 1 12 SER H H 5.209 1.213 -6.129 1.00 . A A . 12 SER H 1 1 14 10360 1 1 12 SER HA H 5.359 3.688 -4.512 1.00 . A A . 12 SER HA 1 1 14 10361 1 1 12 SER HB2 H 6.571 3.329 -6.798 1.00 . A A . 12 SER HB2 1 1 14 10362 1 1 12 SER HB3 H 4.943 3.406 -7.431 1.00 . A A . 12 SER HB3 1 1 14 10363 1 1 12 SER HG H 6.056 5.381 -7.488 1.00 . A A . 12 SER HG 1 1 14 10364 1 1 12 SER N N 5.239 1.767 -5.329 1.00 . A A . 12 SER N 1 1 14 10365 1 1 12 SER O O 2.611 2.868 -4.974 1.00 . A A . 12 SER O 1 1 14 10366 1 1 12 SER OG O 5.634 5.187 -6.625 1.00 . A A . 12 SER OG 1 1 14 10367 1 1 13 LEU C C 0.952 4.458 -6.324 1.00 . A A . 13 LEU C 1 1 14 10368 1 1 13 LEU CA C 1.818 5.456 -5.550 1.00 . A A . 13 LEU CA 1 1 14 10369 1 1 13 LEU CB C 1.889 6.858 -6.222 1.00 . A A . 13 LEU CB 1 1 14 10370 1 1 13 LEU CD1 C -0.663 6.880 -6.469 1.00 . A A . 13 LEU CD1 1 1 14 10371 1 1 13 LEU CD2 C 0.439 8.210 -4.693 1.00 . A A . 13 LEU CD2 1 1 14 10372 1 1 13 LEU CG C 0.586 7.676 -6.113 1.00 . A A . 13 LEU CG 1 1 14 10373 1 1 13 LEU H H 3.975 5.444 -5.854 1.00 . A A . 13 LEU H 1 1 14 10374 1 1 13 LEU HA H 1.447 5.490 -4.535 1.00 . A A . 13 LEU HA 1 1 14 10375 1 1 13 LEU HB2 H 2.691 7.425 -5.768 1.00 . A A . 13 LEU HB2 1 1 14 10376 1 1 13 LEU HB3 H 2.125 6.759 -7.270 1.00 . A A . 13 LEU HB3 1 1 14 10377 1 1 13 LEU HD11 H -0.590 6.491 -7.477 1.00 . A A . 13 LEU HD11 1 1 14 10378 1 1 13 LEU HD12 H -0.846 6.053 -5.802 1.00 . A A . 13 LEU HD12 1 1 14 10379 1 1 13 LEU HD13 H -1.539 7.511 -6.439 1.00 . A A . 13 LEU HD13 1 1 14 10380 1 1 13 LEU HD21 H 1.277 8.842 -4.439 1.00 . A A . 13 LEU HD21 1 1 14 10381 1 1 13 LEU HD22 H -0.467 8.795 -4.618 1.00 . A A . 13 LEU HD22 1 1 14 10382 1 1 13 LEU HD23 H 0.382 7.399 -3.983 1.00 . A A . 13 LEU HD23 1 1 14 10383 1 1 13 LEU HG H 0.631 8.478 -6.838 1.00 . A A . 13 LEU HG 1 1 14 10384 1 1 13 LEU N N 3.212 4.898 -5.585 1.00 . A A . 13 LEU N 1 1 14 10385 1 1 13 LEU O O 0.065 3.810 -5.803 1.00 . A A . 13 LEU O 1 1 14 10386 1 1 14 TYR C C 0.511 2.039 -7.969 1.00 . A A . 14 TYR C 1 1 14 10387 1 1 14 TYR CA C 0.638 3.468 -8.527 1.00 . A A . 14 TYR CA 1 1 14 10388 1 1 14 TYR CB C 1.393 3.452 -9.924 1.00 . A A . 14 TYR CB 1 1 14 10389 1 1 14 TYR CD1 C 3.112 5.197 -9.569 1.00 . A A . 14 TYR CD1 1 1 14 10390 1 1 14 TYR CD2 C 3.869 2.964 -9.875 1.00 . A A . 14 TYR CD2 1 1 14 10391 1 1 14 TYR CE1 C 4.403 5.619 -9.411 1.00 . A A . 14 TYR CE1 1 1 14 10392 1 1 14 TYR CE2 C 5.170 3.393 -9.717 1.00 . A A . 14 TYR CE2 1 1 14 10393 1 1 14 TYR CG C 2.841 3.871 -9.797 1.00 . A A . 14 TYR CG 1 1 14 10394 1 1 14 TYR CZ C 5.433 4.725 -9.481 1.00 . A A . 14 TYR CZ 1 1 14 10395 1 1 14 TYR H H 2.090 4.935 -7.808 1.00 . A A . 14 TYR H 1 1 14 10396 1 1 14 TYR HA H -0.344 3.871 -8.679 1.00 . A A . 14 TYR HA 1 1 14 10397 1 1 14 TYR HB2 H 1.332 2.470 -10.369 1.00 . A A . 14 TYR HB2 1 1 14 10398 1 1 14 TYR HB3 H 0.880 4.140 -10.584 1.00 . A A . 14 TYR HB3 1 1 14 10399 1 1 14 TYR HD1 H 2.291 5.904 -9.523 1.00 . A A . 14 TYR HD1 1 1 14 10400 1 1 14 TYR HD2 H 3.656 1.920 -10.062 1.00 . A A . 14 TYR HD2 1 1 14 10401 1 1 14 TYR HE1 H 4.610 6.658 -9.224 1.00 . A A . 14 TYR HE1 1 1 14 10402 1 1 14 TYR HE2 H 5.974 2.675 -9.771 1.00 . A A . 14 TYR HE2 1 1 14 10403 1 1 14 TYR HH H 7.229 4.907 -10.029 1.00 . A A . 14 TYR HH 1 1 14 10404 1 1 14 TYR N N 1.331 4.378 -7.564 1.00 . A A . 14 TYR N 1 1 14 10405 1 1 14 TYR O O -0.286 1.252 -8.440 1.00 . A A . 14 TYR O 1 1 14 10406 1 1 14 TYR OH O 6.703 5.194 -9.274 1.00 . A A . 14 TYR OH 1 1 14 10407 1 1 15 GLN C C 0.258 0.185 -5.202 1.00 . A A . 15 GLN C 1 1 14 10408 1 1 15 GLN CA C 1.129 0.288 -6.450 1.00 . A A . 15 GLN CA 1 1 14 10409 1 1 15 GLN CB C 2.538 -0.261 -6.250 1.00 . A A . 15 GLN CB 1 1 14 10410 1 1 15 GLN CD C 4.588 -0.743 -7.670 1.00 . A A . 15 GLN CD 1 1 14 10411 1 1 15 GLN CG C 3.099 -0.523 -7.682 1.00 . A A . 15 GLN CG 1 1 14 10412 1 1 15 GLN H H 1.971 2.306 -6.581 1.00 . A A . 15 GLN H 1 1 14 10413 1 1 15 GLN HA H 0.560 -0.234 -7.170 1.00 . A A . 15 GLN HA 1 1 14 10414 1 1 15 GLN HB2 H 3.133 0.441 -5.687 1.00 . A A . 15 GLN HB2 1 1 14 10415 1 1 15 GLN HB3 H 2.470 -1.201 -5.713 1.00 . A A . 15 GLN HB3 1 1 14 10416 1 1 15 GLN HE21 H 4.430 -2.679 -7.576 1.00 . A A . 15 GLN HE21 1 1 14 10417 1 1 15 GLN HE22 H 6.024 -2.060 -7.663 1.00 . A A . 15 GLN HE22 1 1 14 10418 1 1 15 GLN HG2 H 2.642 -1.406 -8.105 1.00 . A A . 15 GLN HG2 1 1 14 10419 1 1 15 GLN HG3 H 2.906 0.312 -8.336 1.00 . A A . 15 GLN HG3 1 1 14 10420 1 1 15 GLN N N 1.297 1.686 -6.970 1.00 . A A . 15 GLN N 1 1 14 10421 1 1 15 GLN NE2 N 5.058 -1.931 -7.634 1.00 . A A . 15 GLN NE2 1 1 14 10422 1 1 15 GLN O O -0.288 -0.854 -4.888 1.00 . A A . 15 GLN O 1 1 14 10423 1 1 15 GLN OE1 O 5.363 0.182 -7.684 1.00 . A A . 15 GLN OE1 1 1 14 10424 1 1 16 LEU C C -2.126 1.602 -3.806 1.00 . A A . 16 LEU C 1 1 14 10425 1 1 16 LEU CA C -0.688 1.325 -3.301 1.00 . A A . 16 LEU CA 1 1 14 10426 1 1 16 LEU CB C -0.116 2.451 -2.342 1.00 . A A . 16 LEU CB 1 1 14 10427 1 1 16 LEU CD1 C 1.887 2.889 -0.857 1.00 . A A . 16 LEU CD1 1 1 14 10428 1 1 16 LEU CD2 C 0.746 0.765 -0.600 1.00 . A A . 16 LEU CD2 1 1 14 10429 1 1 16 LEU CG C 1.147 1.837 -1.653 1.00 . A A . 16 LEU CG 1 1 14 10430 1 1 16 LEU H H 0.639 2.040 -4.816 1.00 . A A . 16 LEU H 1 1 14 10431 1 1 16 LEU HA H -0.649 0.356 -2.876 1.00 . A A . 16 LEU HA 1 1 14 10432 1 1 16 LEU HB2 H 0.135 3.354 -2.893 1.00 . A A . 16 LEU HB2 1 1 14 10433 1 1 16 LEU HB3 H -0.846 2.742 -1.593 1.00 . A A . 16 LEU HB3 1 1 14 10434 1 1 16 LEU HD11 H 1.248 3.300 -0.095 1.00 . A A . 16 LEU HD11 1 1 14 10435 1 1 16 LEU HD12 H 2.744 2.430 -0.378 1.00 . A A . 16 LEU HD12 1 1 14 10436 1 1 16 LEU HD13 H 2.244 3.678 -1.498 1.00 . A A . 16 LEU HD13 1 1 14 10437 1 1 16 LEU HD21 H 0.191 -0.051 -1.027 1.00 . A A . 16 LEU HD21 1 1 14 10438 1 1 16 LEU HD22 H 1.636 0.349 -0.148 1.00 . A A . 16 LEU HD22 1 1 14 10439 1 1 16 LEU HD23 H 0.147 1.196 0.188 1.00 . A A . 16 LEU HD23 1 1 14 10440 1 1 16 LEU HG H 1.815 1.421 -2.399 1.00 . A A . 16 LEU HG 1 1 14 10441 1 1 16 LEU N N 0.146 1.273 -4.516 1.00 . A A . 16 LEU N 1 1 14 10442 1 1 16 LEU O O -3.075 1.043 -3.291 1.00 . A A . 16 LEU O 1 1 14 10443 1 1 17 GLU C C -4.307 1.403 -5.798 1.00 . A A . 17 GLU C 1 1 14 10444 1 1 17 GLU CA C -3.650 2.733 -5.358 1.00 . A A . 17 GLU CA 1 1 14 10445 1 1 17 GLU CB C -3.531 3.722 -6.543 1.00 . A A . 17 GLU CB 1 1 14 10446 1 1 17 GLU CD C -2.632 4.096 -8.898 1.00 . A A . 17 GLU CD 1 1 14 10447 1 1 17 GLU CG C -2.696 3.139 -7.708 1.00 . A A . 17 GLU CG 1 1 14 10448 1 1 17 GLU H H -1.456 2.812 -5.234 1.00 . A A . 17 GLU H 1 1 14 10449 1 1 17 GLU HA H -4.249 3.173 -4.581 1.00 . A A . 17 GLU HA 1 1 14 10450 1 1 17 GLU HB2 H -4.517 3.977 -6.911 1.00 . A A . 17 GLU HB2 1 1 14 10451 1 1 17 GLU HB3 H -3.067 4.643 -6.211 1.00 . A A . 17 GLU HB3 1 1 14 10452 1 1 17 GLU HG2 H -1.691 2.975 -7.380 1.00 . A A . 17 GLU HG2 1 1 14 10453 1 1 17 GLU HG3 H -3.104 2.216 -8.084 1.00 . A A . 17 GLU HG3 1 1 14 10454 1 1 17 GLU N N -2.263 2.422 -4.821 1.00 . A A . 17 GLU N 1 1 14 10455 1 1 17 GLU O O -5.470 1.118 -5.586 1.00 . A A . 17 GLU O 1 1 14 10456 1 1 17 GLU OE1 O -2.236 5.224 -8.674 1.00 . A A . 17 GLU OE1 1 1 14 10457 1 1 17 GLU OE2 O -2.975 3.618 -9.959 1.00 . A A . 17 GLU OE2 1 1 14 10458 1 1 18 ASN C C -4.857 -1.493 -5.902 1.00 . A A . 18 ASN C 1 1 14 10459 1 1 18 ASN CA C -3.902 -0.765 -6.919 1.00 . A A . 18 ASN CA 1 1 14 10460 1 1 18 ASN CB C -2.547 -1.490 -7.176 1.00 . A A . 18 ASN CB 1 1 14 10461 1 1 18 ASN CG C -2.666 -2.925 -7.638 1.00 . A A . 18 ASN CG 1 1 14 10462 1 1 18 ASN H H -2.581 0.917 -6.539 1.00 . A A . 18 ASN H 1 1 14 10463 1 1 18 ASN HA H -4.493 -0.622 -7.811 1.00 . A A . 18 ASN HA 1 1 14 10464 1 1 18 ASN HB2 H -1.992 -0.955 -7.933 1.00 . A A . 18 ASN HB2 1 1 14 10465 1 1 18 ASN HB3 H -1.964 -1.497 -6.275 1.00 . A A . 18 ASN HB3 1 1 14 10466 1 1 18 ASN HD21 H -4.631 -2.953 -7.797 1.00 . A A . 18 ASN HD21 1 1 14 10467 1 1 18 ASN HD22 H -3.810 -4.381 -8.217 1.00 . A A . 18 ASN HD22 1 1 14 10468 1 1 18 ASN N N -3.496 0.594 -6.415 1.00 . A A . 18 ASN N 1 1 14 10469 1 1 18 ASN ND2 N -3.801 -3.459 -7.906 1.00 . A A . 18 ASN ND2 1 1 14 10470 1 1 18 ASN O O -5.704 -2.269 -6.296 1.00 . A A . 18 ASN O 1 1 14 10471 1 1 18 ASN OD1 O -1.690 -3.630 -7.768 1.00 . A A . 18 ASN OD1 1 1 14 10472 1 1 19 TYR C C -6.271 -0.711 -2.727 1.00 . A A . 19 TYR C 1 1 14 10473 1 1 19 TYR CA C -5.503 -1.815 -3.521 1.00 . A A . 19 TYR CA 1 1 14 10474 1 1 19 TYR CB C -4.525 -2.606 -2.601 1.00 . A A . 19 TYR CB 1 1 14 10475 1 1 19 TYR CD1 C -4.110 -4.747 -3.849 1.00 . A A . 19 TYR CD1 1 1 14 10476 1 1 19 TYR CD2 C -2.501 -3.012 -4.025 1.00 . A A . 19 TYR CD2 1 1 14 10477 1 1 19 TYR CE1 C -3.348 -5.525 -4.696 1.00 . A A . 19 TYR CE1 1 1 14 10478 1 1 19 TYR CE2 C -1.747 -3.791 -4.866 1.00 . A A . 19 TYR CE2 1 1 14 10479 1 1 19 TYR CG C -3.686 -3.489 -3.514 1.00 . A A . 19 TYR CG 1 1 14 10480 1 1 19 TYR CZ C -2.168 -5.049 -5.204 1.00 . A A . 19 TYR CZ 1 1 14 10481 1 1 19 TYR H H -3.961 -0.578 -4.416 1.00 . A A . 19 TYR H 1 1 14 10482 1 1 19 TYR HA H -6.244 -2.483 -3.941 1.00 . A A . 19 TYR HA 1 1 14 10483 1 1 19 TYR HB2 H -3.862 -1.945 -2.060 1.00 . A A . 19 TYR HB2 1 1 14 10484 1 1 19 TYR HB3 H -5.046 -3.237 -1.893 1.00 . A A . 19 TYR HB3 1 1 14 10485 1 1 19 TYR HD1 H -5.043 -5.115 -3.446 1.00 . A A . 19 TYR HD1 1 1 14 10486 1 1 19 TYR HD2 H -2.159 -2.018 -3.765 1.00 . A A . 19 TYR HD2 1 1 14 10487 1 1 19 TYR HE1 H -3.681 -6.511 -4.962 1.00 . A A . 19 TYR HE1 1 1 14 10488 1 1 19 TYR HE2 H -0.820 -3.397 -5.255 1.00 . A A . 19 TYR HE2 1 1 14 10489 1 1 19 TYR HH H -1.430 -5.243 -6.855 1.00 . A A . 19 TYR HH 1 1 14 10490 1 1 19 TYR N N -4.674 -1.211 -4.636 1.00 . A A . 19 TYR N 1 1 14 10491 1 1 19 TYR O O -7.065 -0.963 -1.846 1.00 . A A . 19 TYR O 1 1 14 10492 1 1 19 TYR OH O -1.417 -5.813 -6.063 1.00 . A A . 19 TYR OH 1 1 14 10493 1 1 20 CYS C C -7.157 2.659 -3.651 1.00 . A A . 20 CYS C 1 1 14 10494 1 1 20 CYS CA C -6.523 1.766 -2.530 1.00 . A A . 20 CYS CA 1 1 14 10495 1 1 20 CYS CB C -5.338 2.369 -1.854 1.00 . A A . 20 CYS CB 1 1 14 10496 1 1 20 CYS H H -5.309 0.592 -3.787 1.00 . A A . 20 CYS H 1 1 14 10497 1 1 20 CYS HA H -7.199 1.655 -1.697 1.00 . A A . 20 CYS HA 1 1 14 10498 1 1 20 CYS HB2 H -4.890 1.632 -1.205 1.00 . A A . 20 CYS HB2 1 1 14 10499 1 1 20 CYS HB3 H -4.599 2.621 -2.598 1.00 . A A . 20 CYS HB3 1 1 14 10500 1 1 20 CYS HG H -5.913 3.587 0.008 1.00 . A A . 20 CYS HG 1 1 14 10501 1 1 20 CYS N N -5.974 0.496 -3.084 1.00 . A A . 20 CYS N 1 1 14 10502 1 1 20 CYS O O -6.468 3.245 -4.454 1.00 . A A . 20 CYS O 1 1 14 10503 1 1 20 CYS SG S -5.715 3.847 -0.895 1.00 . A A . 20 CYS SG 1 1 14 10504 1 1 21 ASN C C -10.220 4.589 -4.379 1.00 . A A . 21 ASN C 1 1 14 10505 1 1 21 ASN CA C -9.082 3.609 -4.800 1.00 . A A . 21 ASN CA 1 1 14 10506 1 1 21 ASN CB C -9.540 2.592 -5.898 1.00 . A A . 21 ASN CB 1 1 14 10507 1 1 21 ASN CG C -10.415 1.523 -5.292 1.00 . A A . 21 ASN CG 1 1 14 10508 1 1 21 ASN H H -8.962 2.237 -3.068 1.00 . A A . 21 ASN H 1 1 14 10509 1 1 21 ASN HA H -8.322 4.247 -5.234 1.00 . A A . 21 ASN HA 1 1 14 10510 1 1 21 ASN HB2 H -10.108 3.086 -6.669 1.00 . A A . 21 ASN HB2 1 1 14 10511 1 1 21 ASN HB3 H -8.681 2.115 -6.344 1.00 . A A . 21 ASN HB3 1 1 14 10512 1 1 21 ASN HD21 H -8.889 0.347 -4.955 1.00 . A A . 21 ASN HD21 1 1 14 10513 1 1 21 ASN HD22 H -10.419 -0.234 -4.458 1.00 . A A . 21 ASN HD22 1 1 14 10514 1 1 21 ASN N N -8.449 2.745 -3.721 1.00 . A A . 21 ASN N 1 1 14 10515 1 1 21 ASN ND2 N -9.855 0.452 -4.865 1.00 . A A . 21 ASN ND2 1 1 14 10516 1 1 21 ASN O O -11.344 4.433 -4.832 1.00 . A A . 21 ASN O 1 1 14 10517 1 1 21 ASN OD1 O -11.616 1.629 -5.181 1.00 . A A . 21 ASN OD1 1 1 14 10518 2 2 1 PHE C C 6.834 7.254 -2.844 1.00 . B B . 1 PHE C 1 1 14 10519 2 2 1 PHE CA C 5.432 7.491 -3.510 1.00 . B B . 1 PHE CA 1 1 14 10520 2 2 1 PHE CB C 4.393 6.363 -3.231 1.00 . B B . 1 PHE CB 1 1 14 10521 2 2 1 PHE CD1 C 3.562 7.020 -0.937 1.00 . B B . 1 PHE CD1 1 1 14 10522 2 2 1 PHE CD2 C 4.745 4.973 -1.173 1.00 . B B . 1 PHE CD2 1 1 14 10523 2 2 1 PHE CE1 C 3.433 6.793 0.418 1.00 . B B . 1 PHE CE1 1 1 14 10524 2 2 1 PHE CE2 C 4.617 4.744 0.175 1.00 . B B . 1 PHE CE2 1 1 14 10525 2 2 1 PHE CG C 4.220 6.112 -1.738 1.00 . B B . 1 PHE CG 1 1 14 10526 2 2 1 PHE CZ C 3.962 5.651 0.976 1.00 . B B . 1 PHE CZ 1 1 14 10527 2 2 1 PHE HA H 5.066 8.426 -3.114 1.00 . B B . 1 PHE HA 1 1 14 10528 2 2 1 PHE HB2 H 3.433 6.633 -3.642 1.00 . B B . 1 PHE HB2 1 1 14 10529 2 2 1 PHE HB3 H 4.723 5.450 -3.693 1.00 . B B . 1 PHE HB3 1 1 14 10530 2 2 1 PHE HD1 H 3.145 7.916 -1.374 1.00 . B B . 1 PHE HD1 1 1 14 10531 2 2 1 PHE HD2 H 5.259 4.243 -1.786 1.00 . B B . 1 PHE HD2 1 1 14 10532 2 2 1 PHE HE1 H 2.916 7.508 1.045 1.00 . B B . 1 PHE HE1 1 1 14 10533 2 2 1 PHE HE2 H 5.037 3.843 0.597 1.00 . B B . 1 PHE HE2 1 1 14 10534 2 2 1 PHE HZ H 3.866 5.464 2.039 1.00 . B B . 1 PHE HZ 1 1 14 10535 2 2 1 PHE N N 5.457 7.594 -5.010 1.00 . B B . 1 PHE N 1 1 14 10536 2 2 1 PHE O O 7.862 7.335 -3.483 1.00 . B B . 1 PHE O 1 1 14 10537 2 2 2 VAL C C 8.854 5.364 -1.071 1.00 . B B . 2 VAL C 1 1 14 10538 2 2 2 VAL CA C 8.115 6.714 -0.780 1.00 . B B . 2 VAL CA 1 1 14 10539 2 2 2 VAL CB C 7.722 6.792 0.705 1.00 . B B . 2 VAL CB 1 1 14 10540 2 2 2 VAL CG1 C 8.963 6.855 1.622 1.00 . B B . 2 VAL CG1 1 1 14 10541 2 2 2 VAL CG2 C 6.881 8.045 1.016 1.00 . B B . 2 VAL CG2 1 1 14 10542 2 2 2 VAL H H 6.029 6.912 -1.084 1.00 . B B . 2 VAL H 1 1 14 10543 2 2 2 VAL HA H 8.773 7.523 -1.006 1.00 . B B . 2 VAL HA 1 1 14 10544 2 2 2 VAL HB H 7.166 5.880 0.869 1.00 . B B . 2 VAL HB 1 1 14 10545 2 2 2 VAL HG11 H 9.563 7.725 1.395 1.00 . B B . 2 VAL HG11 1 1 14 10546 2 2 2 VAL HG12 H 8.650 6.917 2.655 1.00 . B B . 2 VAL HG12 1 1 14 10547 2 2 2 VAL HG13 H 9.582 5.977 1.523 1.00 . B B . 2 VAL HG13 1 1 14 10548 2 2 2 VAL HG21 H 7.435 8.942 0.773 1.00 . B B . 2 VAL HG21 1 1 14 10549 2 2 2 VAL HG22 H 5.955 8.053 0.461 1.00 . B B . 2 VAL HG22 1 1 14 10550 2 2 2 VAL HG23 H 6.637 8.068 2.068 1.00 . B B . 2 VAL HG23 1 1 14 10551 2 2 2 VAL N N 6.861 6.965 -1.571 1.00 . B B . 2 VAL N 1 1 14 10552 2 2 2 VAL O O 9.184 4.571 -0.211 1.00 . B B . 2 VAL O 1 1 14 10553 2 2 3 ASN C C 10.994 3.342 -2.130 1.00 . B B . 3 ASN C 1 1 14 10554 2 2 3 ASN CA C 9.771 3.950 -2.897 1.00 . B B . 3 ASN CA 1 1 14 10555 2 2 3 ASN CB C 10.136 4.367 -4.335 1.00 . B B . 3 ASN CB 1 1 14 10556 2 2 3 ASN CG C 8.867 4.365 -5.142 1.00 . B B . 3 ASN CG 1 1 14 10557 2 2 3 ASN H H 8.741 5.862 -2.901 1.00 . B B . 3 ASN H 1 1 14 10558 2 2 3 ASN HA H 9.037 3.157 -2.949 1.00 . B B . 3 ASN HA 1 1 14 10559 2 2 3 ASN HB2 H 10.573 5.350 -4.367 1.00 . B B . 3 ASN HB2 1 1 14 10560 2 2 3 ASN HB3 H 10.810 3.653 -4.782 1.00 . B B . 3 ASN HB3 1 1 14 10561 2 2 3 ASN HD21 H 8.507 6.308 -4.996 1.00 . B B . 3 ASN HD21 1 1 14 10562 2 2 3 ASN HD22 H 7.393 5.366 -5.872 1.00 . B B . 3 ASN HD22 1 1 14 10563 2 2 3 ASN N N 9.074 5.156 -2.326 1.00 . B B . 3 ASN N 1 1 14 10564 2 2 3 ASN ND2 N 8.210 5.446 -5.347 1.00 . B B . 3 ASN ND2 1 1 14 10565 2 2 3 ASN O O 12.131 3.412 -2.554 1.00 . B B . 3 ASN O 1 1 14 10566 2 2 3 ASN OD1 O 8.419 3.350 -5.611 1.00 . B B . 3 ASN OD1 1 1 14 10567 2 2 4 GLN C C 10.892 0.857 0.425 1.00 . B B . 4 GLN C 1 1 14 10568 2 2 4 GLN CA C 11.678 2.110 -0.098 1.00 . B B . 4 GLN CA 1 1 14 10569 2 2 4 GLN CB C 12.054 3.264 0.930 1.00 . B B . 4 GLN CB 1 1 14 10570 2 2 4 GLN CD C 10.460 2.531 2.783 1.00 . B B . 4 GLN CD 1 1 14 10571 2 2 4 GLN CG C 11.887 2.897 2.438 1.00 . B B . 4 GLN CG 1 1 14 10572 2 2 4 GLN H H 9.778 2.735 -0.712 1.00 . B B . 4 GLN H 1 1 14 10573 2 2 4 GLN HA H 12.545 1.768 -0.646 1.00 . B B . 4 GLN HA 1 1 14 10574 2 2 4 GLN HB2 H 13.085 3.537 0.747 1.00 . B B . 4 GLN HB2 1 1 14 10575 2 2 4 GLN HB3 H 11.462 4.146 0.713 1.00 . B B . 4 GLN HB3 1 1 14 10576 2 2 4 GLN HE21 H 9.610 3.217 1.115 1.00 . B B . 4 GLN HE21 1 1 14 10577 2 2 4 GLN HE22 H 8.623 2.441 2.256 1.00 . B B . 4 GLN HE22 1 1 14 10578 2 2 4 GLN HG2 H 12.520 2.080 2.744 1.00 . B B . 4 GLN HG2 1 1 14 10579 2 2 4 GLN HG3 H 12.132 3.748 3.055 1.00 . B B . 4 GLN HG3 1 1 14 10580 2 2 4 GLN N N 10.707 2.763 -1.008 1.00 . B B . 4 GLN N 1 1 14 10581 2 2 4 GLN NE2 N 9.500 2.758 1.967 1.00 . B B . 4 GLN NE2 1 1 14 10582 2 2 4 GLN O O 9.841 0.533 -0.084 1.00 . B B . 4 GLN O 1 1 14 10583 2 2 4 GLN OE1 O 10.181 2.016 3.832 1.00 . B B . 4 GLN OE1 1 1 14 10584 2 2 5 HIS C C 9.698 -0.762 3.160 1.00 . B B . 5 HIS C 1 1 14 10585 2 2 5 HIS CA C 10.683 -1.031 1.977 1.00 . B B . 5 HIS CA 1 1 14 10586 2 2 5 HIS CB C 11.810 -2.005 2.403 1.00 . B B . 5 HIS CB 1 1 14 10587 2 2 5 HIS CD2 C 14.085 -2.055 1.064 1.00 . B B . 5 HIS CD2 1 1 14 10588 2 2 5 HIS CE1 C 13.360 -2.861 -0.698 1.00 . B B . 5 HIS CE1 1 1 14 10589 2 2 5 HIS CG C 12.733 -2.264 1.227 1.00 . B B . 5 HIS CG 1 1 14 10590 2 2 5 HIS H H 12.206 0.535 1.772 1.00 . B B . 5 HIS H 1 1 14 10591 2 2 5 HIS HA H 10.098 -1.499 1.195 1.00 . B B . 5 HIS HA 1 1 14 10592 2 2 5 HIS HB2 H 12.382 -1.591 3.218 1.00 . B B . 5 HIS HB2 1 1 14 10593 2 2 5 HIS HB3 H 11.391 -2.948 2.719 1.00 . B B . 5 HIS HB3 1 1 14 10594 2 2 5 HIS HD1 H 11.416 -3.019 -0.086 1.00 . B B . 5 HIS HD1 1 1 14 10595 2 2 5 HIS HD2 H 14.739 -1.647 1.815 1.00 . B B . 5 HIS HD2 1 1 14 10596 2 2 5 HIS HE1 H 13.307 -3.251 -1.708 1.00 . B B . 5 HIS HE1 1 1 14 10597 2 2 5 HIS N N 11.376 0.194 1.417 1.00 . B B . 5 HIS N 1 1 14 10598 2 2 5 HIS ND1 N 12.350 -2.760 0.109 1.00 . B B . 5 HIS ND1 1 1 14 10599 2 2 5 HIS NE2 N 14.464 -2.432 -0.141 1.00 . B B . 5 HIS NE2 1 1 14 10600 2 2 5 HIS O O 10.027 -0.948 4.317 1.00 . B B . 5 HIS O 1 1 14 10601 2 2 6 LEU C C 6.531 -1.251 4.236 1.00 . B B . 6 LEU C 1 1 14 10602 2 2 6 LEU CA C 7.485 -0.054 3.918 1.00 . B B . 6 LEU CA 1 1 14 10603 2 2 6 LEU CB C 6.656 1.197 3.472 1.00 . B B . 6 LEU CB 1 1 14 10604 2 2 6 LEU CD1 C 4.685 1.739 2.085 1.00 . B B . 6 LEU CD1 1 1 14 10605 2 2 6 LEU CD2 C 6.861 1.677 0.978 1.00 . B B . 6 LEU CD2 1 1 14 10606 2 2 6 LEU CG C 6.018 1.007 2.073 1.00 . B B . 6 LEU CG 1 1 14 10607 2 2 6 LEU H H 8.279 -0.228 1.896 1.00 . B B . 6 LEU H 1 1 14 10608 2 2 6 LEU HA H 8.012 0.195 4.829 1.00 . B B . 6 LEU HA 1 1 14 10609 2 2 6 LEU HB2 H 5.873 1.368 4.199 1.00 . B B . 6 LEU HB2 1 1 14 10610 2 2 6 LEU HB3 H 7.290 2.072 3.485 1.00 . B B . 6 LEU HB3 1 1 14 10611 2 2 6 LEU HD11 H 4.825 2.779 2.338 1.00 . B B . 6 LEU HD11 1 1 14 10612 2 2 6 LEU HD12 H 4.208 1.661 1.119 1.00 . B B . 6 LEU HD12 1 1 14 10613 2 2 6 LEU HD13 H 4.041 1.300 2.831 1.00 . B B . 6 LEU HD13 1 1 14 10614 2 2 6 LEU HD21 H 6.961 2.738 1.150 1.00 . B B . 6 LEU HD21 1 1 14 10615 2 2 6 LEU HD22 H 7.841 1.236 0.914 1.00 . B B . 6 LEU HD22 1 1 14 10616 2 2 6 LEU HD23 H 6.388 1.529 0.015 1.00 . B B . 6 LEU HD23 1 1 14 10617 2 2 6 LEU HG H 5.883 -0.041 1.845 1.00 . B B . 6 LEU HG 1 1 14 10618 2 2 6 LEU N N 8.502 -0.344 2.842 1.00 . B B . 6 LEU N 1 1 14 10619 2 2 6 LEU O O 5.887 -1.825 3.379 1.00 . B B . 6 LEU O 1 1 14 10620 2 2 7 CYS C C 4.269 -2.460 6.717 1.00 . B B . 7 CYS C 1 1 14 10621 2 2 7 CYS CA C 5.557 -2.754 5.895 1.00 . B B . 7 CYS CA 1 1 14 10622 2 2 7 CYS CB C 6.492 -3.748 6.631 1.00 . B B . 7 CYS CB 1 1 14 10623 2 2 7 CYS H H 6.970 -1.103 6.147 1.00 . B B . 7 CYS H 1 1 14 10624 2 2 7 CYS HA H 5.211 -3.237 5.002 1.00 . B B . 7 CYS HA 1 1 14 10625 2 2 7 CYS HB2 H 7.326 -3.950 5.971 1.00 . B B . 7 CYS HB2 1 1 14 10626 2 2 7 CYS HB3 H 6.882 -3.286 7.524 1.00 . B B . 7 CYS HB3 1 1 14 10627 2 2 7 CYS HG H 5.481 -5.302 7.995 1.00 . B B . 7 CYS HG 1 1 14 10628 2 2 7 CYS N N 6.445 -1.605 5.494 1.00 . B B . 7 CYS N 1 1 14 10629 2 2 7 CYS O O 3.974 -1.340 7.077 1.00 . B B . 7 CYS O 1 1 14 10630 2 2 7 CYS SG S 5.818 -5.363 7.098 1.00 . B B . 7 CYS SG 1 1 14 10631 2 2 8 GLY C C 1.590 -2.243 8.009 1.00 . B B . 8 GLY C 1 1 14 10632 2 2 8 GLY CA C 2.256 -3.574 7.743 1.00 . B B . 8 GLY CA 1 1 14 10633 2 2 8 GLY H H 3.921 -4.370 6.652 1.00 . B B . 8 GLY H 1 1 14 10634 2 2 8 GLY HA2 H 1.539 -4.163 7.194 1.00 . B B . 8 GLY HA2 1 1 14 10635 2 2 8 GLY HA3 H 2.422 -4.036 8.706 1.00 . B B . 8 GLY HA3 1 1 14 10636 2 2 8 GLY N N 3.561 -3.531 6.979 1.00 . B B . 8 GLY N 1 1 14 10637 2 2 8 GLY O O 0.940 -1.681 7.156 1.00 . B B . 8 GLY O 1 1 14 10638 2 2 9 ASP C C 1.522 0.667 8.620 1.00 . B B . 9 ASP C 1 1 14 10639 2 2 9 ASP CA C 1.205 -0.475 9.640 1.00 . B B . 9 ASP CA 1 1 14 10640 2 2 9 ASP CB C 1.827 -0.300 11.043 1.00 . B B . 9 ASP CB 1 1 14 10641 2 2 9 ASP CG C 1.581 -1.564 11.832 1.00 . B B . 9 ASP CG 1 1 14 10642 2 2 9 ASP H H 2.331 -2.309 9.805 1.00 . B B . 9 ASP H 1 1 14 10643 2 2 9 ASP HA H 0.124 -0.580 9.690 1.00 . B B . 9 ASP HA 1 1 14 10644 2 2 9 ASP HB2 H 2.889 -0.126 11.010 1.00 . B B . 9 ASP HB2 1 1 14 10645 2 2 9 ASP HB3 H 1.351 0.507 11.576 1.00 . B B . 9 ASP HB3 1 1 14 10646 2 2 9 ASP N N 1.782 -1.777 9.186 1.00 . B B . 9 ASP N 1 1 14 10647 2 2 9 ASP O O 0.669 1.304 8.032 1.00 . B B . 9 ASP O 1 1 14 10648 2 2 9 ASP OD1 O 0.505 -1.647 12.382 1.00 . B B . 9 ASP OD1 1 1 14 10649 2 2 9 ASP OD2 O 2.508 -2.353 11.795 1.00 . B B . 9 ASP OD2 1 1 14 10650 2 2 10 HIS C C 2.937 1.685 6.003 1.00 . B B . 10 HIS C 1 1 14 10651 2 2 10 HIS CA C 3.343 1.883 7.495 1.00 . B B . 10 HIS CA 1 1 14 10652 2 2 10 HIS CB C 4.847 1.830 7.741 1.00 . B B . 10 HIS CB 1 1 14 10653 2 2 10 HIS CD2 C 6.755 2.909 6.254 1.00 . B B . 10 HIS CD2 1 1 14 10654 2 2 10 HIS CE1 C 6.025 4.843 6.195 1.00 . B B . 10 HIS CE1 1 1 14 10655 2 2 10 HIS CG C 5.581 2.929 6.980 1.00 . B B . 10 HIS CG 1 1 14 10656 2 2 10 HIS H H 3.377 0.240 8.936 1.00 . B B . 10 HIS H 1 1 14 10657 2 2 10 HIS HA H 2.957 2.842 7.795 1.00 . B B . 10 HIS HA 1 1 14 10658 2 2 10 HIS HB2 H 5.009 1.967 8.797 1.00 . B B . 10 HIS HB2 1 1 14 10659 2 2 10 HIS HB3 H 5.207 0.864 7.428 1.00 . B B . 10 HIS HB3 1 1 14 10660 2 2 10 HIS HD1 H 4.353 4.499 7.322 1.00 . B B . 10 HIS HD1 1 1 14 10661 2 2 10 HIS HD2 H 7.373 2.041 6.101 1.00 . B B . 10 HIS HD2 1 1 14 10662 2 2 10 HIS HE1 H 5.918 5.898 5.980 1.00 . B B . 10 HIS HE1 1 1 14 10663 2 2 10 HIS N N 2.794 0.841 8.430 1.00 . B B . 10 HIS N 1 1 14 10664 2 2 10 HIS ND1 N 5.187 4.150 6.903 1.00 . B B . 10 HIS ND1 1 1 14 10665 2 2 10 HIS NE2 N 7.018 4.105 5.770 1.00 . B B . 10 HIS NE2 1 1 14 10666 2 2 10 HIS O O 3.273 2.430 5.105 1.00 . B B . 10 HIS O 1 1 14 10667 2 2 11 LEU C C 0.175 0.524 4.485 1.00 . B B . 11 LEU C 1 1 14 10668 2 2 11 LEU CA C 1.698 0.276 4.423 1.00 . B B . 11 LEU CA 1 1 14 10669 2 2 11 LEU CB C 2.129 -1.189 4.215 1.00 . B B . 11 LEU CB 1 1 14 10670 2 2 11 LEU CD1 C 2.519 -2.937 2.548 1.00 . B B . 11 LEU CD1 1 1 14 10671 2 2 11 LEU CD2 C 0.251 -2.231 2.971 1.00 . B B . 11 LEU CD2 1 1 14 10672 2 2 11 LEU CG C 1.678 -1.724 2.857 1.00 . B B . 11 LEU CG 1 1 14 10673 2 2 11 LEU H H 1.989 0.076 6.555 1.00 . B B . 11 LEU H 1 1 14 10674 2 2 11 LEU HA H 2.114 0.934 3.673 1.00 . B B . 11 LEU HA 1 1 14 10675 2 2 11 LEU HB2 H 3.210 -1.218 4.273 1.00 . B B . 11 LEU HB2 1 1 14 10676 2 2 11 LEU HB3 H 1.742 -1.809 5.007 1.00 . B B . 11 LEU HB3 1 1 14 10677 2 2 11 LEU HD11 H 2.400 -3.683 3.319 1.00 . B B . 11 LEU HD11 1 1 14 10678 2 2 11 LEU HD12 H 2.236 -3.362 1.598 1.00 . B B . 11 LEU HD12 1 1 14 10679 2 2 11 LEU HD13 H 3.557 -2.636 2.501 1.00 . B B . 11 LEU HD13 1 1 14 10680 2 2 11 LEU HD21 H 0.174 -2.968 3.758 1.00 . B B . 11 LEU HD21 1 1 14 10681 2 2 11 LEU HD22 H -0.442 -1.431 3.175 1.00 . B B . 11 LEU HD22 1 1 14 10682 2 2 11 LEU HD23 H -0.019 -2.698 2.042 1.00 . B B . 11 LEU HD23 1 1 14 10683 2 2 11 LEU HG H 1.771 -0.969 2.082 1.00 . B B . 11 LEU HG 1 1 14 10684 2 2 11 LEU N N 2.202 0.637 5.781 1.00 . B B . 11 LEU N 1 1 14 10685 2 2 11 LEU O O -0.417 1.176 3.652 1.00 . B B . 11 LEU O 1 1 14 10686 2 2 12 VAL C C -2.241 1.767 5.665 1.00 . B B . 12 VAL C 1 1 14 10687 2 2 12 VAL CA C -1.960 0.251 5.562 1.00 . B B . 12 VAL CA 1 1 14 10688 2 2 12 VAL CB C -2.521 -0.482 6.791 1.00 . B B . 12 VAL CB 1 1 14 10689 2 2 12 VAL CG1 C -1.781 -0.073 8.050 1.00 . B B . 12 VAL CG1 1 1 14 10690 2 2 12 VAL CG2 C -3.969 -0.011 6.963 1.00 . B B . 12 VAL CG2 1 1 14 10691 2 2 12 VAL H H -0.003 -0.529 6.131 1.00 . B B . 12 VAL H 1 1 14 10692 2 2 12 VAL HA H -2.429 -0.104 4.662 1.00 . B B . 12 VAL HA 1 1 14 10693 2 2 12 VAL HB H -2.402 -1.549 6.640 1.00 . B B . 12 VAL HB 1 1 14 10694 2 2 12 VAL HG11 H -1.831 0.986 8.260 1.00 . B B . 12 VAL HG11 1 1 14 10695 2 2 12 VAL HG12 H -2.137 -0.600 8.918 1.00 . B B . 12 VAL HG12 1 1 14 10696 2 2 12 VAL HG13 H -0.752 -0.335 7.905 1.00 . B B . 12 VAL HG13 1 1 14 10697 2 2 12 VAL HG21 H -4.526 -0.187 6.056 1.00 . B B . 12 VAL HG21 1 1 14 10698 2 2 12 VAL HG22 H -4.447 -0.505 7.791 1.00 . B B . 12 VAL HG22 1 1 14 10699 2 2 12 VAL HG23 H -3.996 1.056 7.155 1.00 . B B . 12 VAL HG23 1 1 14 10700 2 2 12 VAL N N -0.485 0.008 5.474 1.00 . B B . 12 VAL N 1 1 14 10701 2 2 12 VAL O O -3.069 2.303 4.951 1.00 . B B . 12 VAL O 1 1 14 10702 2 2 13 GLU C C -1.444 4.497 5.303 1.00 . B B . 13 GLU C 1 1 14 10703 2 2 13 GLU CA C -1.773 3.912 6.681 1.00 . B B . 13 GLU CA 1 1 14 10704 2 2 13 GLU CB C -0.837 4.455 7.793 1.00 . B B . 13 GLU CB 1 1 14 10705 2 2 13 GLU CD C 1.619 4.999 8.418 1.00 . B B . 13 GLU CD 1 1 14 10706 2 2 13 GLU CG C 0.665 4.501 7.335 1.00 . B B . 13 GLU CG 1 1 14 10707 2 2 13 GLU H H -0.863 2.001 7.097 1.00 . B B . 13 GLU H 1 1 14 10708 2 2 13 GLU HA H -2.811 4.110 6.898 1.00 . B B . 13 GLU HA 1 1 14 10709 2 2 13 GLU HB2 H -1.136 5.454 8.084 1.00 . B B . 13 GLU HB2 1 1 14 10710 2 2 13 GLU HB3 H -0.906 3.831 8.676 1.00 . B B . 13 GLU HB3 1 1 14 10711 2 2 13 GLU HG2 H 1.012 3.523 7.054 1.00 . B B . 13 GLU HG2 1 1 14 10712 2 2 13 GLU HG3 H 0.799 5.171 6.502 1.00 . B B . 13 GLU HG3 1 1 14 10713 2 2 13 GLU N N -1.544 2.442 6.541 1.00 . B B . 13 GLU N 1 1 14 10714 2 2 13 GLU O O -2.084 5.416 4.827 1.00 . B B . 13 GLU O 1 1 14 10715 2 2 13 GLU OE1 O 1.196 5.207 9.537 1.00 . B B . 13 GLU OE1 1 1 14 10716 2 2 13 GLU OE2 O 2.756 5.133 8.013 1.00 . B B . 13 GLU OE2 1 1 14 10717 2 2 14 ALA C C -1.311 4.384 2.445 1.00 . B B . 14 ALA C 1 1 14 10718 2 2 14 ALA CA C -0.046 4.410 3.337 1.00 . B B . 14 ALA CA 1 1 14 10719 2 2 14 ALA CB C 1.111 3.495 2.786 1.00 . B B . 14 ALA CB 1 1 14 10720 2 2 14 ALA H H 0.014 3.183 5.125 1.00 . B B . 14 ALA H 1 1 14 10721 2 2 14 ALA HA H 0.220 5.423 3.506 1.00 . B B . 14 ALA HA 1 1 14 10722 2 2 14 ALA HB1 H 1.922 3.449 3.499 1.00 . B B . 14 ALA HB1 1 1 14 10723 2 2 14 ALA HB2 H 0.803 2.489 2.567 1.00 . B B . 14 ALA HB2 1 1 14 10724 2 2 14 ALA HB3 H 1.498 3.903 1.867 1.00 . B B . 14 ALA HB3 1 1 14 10725 2 2 14 ALA N N -0.444 3.921 4.679 1.00 . B B . 14 ALA N 1 1 14 10726 2 2 14 ALA O O -1.622 5.339 1.766 1.00 . B B . 14 ALA O 1 1 14 10727 2 2 15 LEU C C -4.256 4.265 2.077 1.00 . B B . 15 LEU C 1 1 14 10728 2 2 15 LEU CA C -3.271 3.138 1.664 1.00 . B B . 15 LEU CA 1 1 14 10729 2 2 15 LEU CB C -3.911 1.767 1.945 1.00 . B B . 15 LEU CB 1 1 14 10730 2 2 15 LEU CD1 C -3.565 -0.604 2.213 1.00 . B B . 15 LEU CD1 1 1 14 10731 2 2 15 LEU CD2 C -2.870 0.478 0.106 1.00 . B B . 15 LEU CD2 1 1 14 10732 2 2 15 LEU CG C -2.933 0.645 1.626 1.00 . B B . 15 LEU CG 1 1 14 10733 2 2 15 LEU H H -1.653 2.562 3.045 1.00 . B B . 15 LEU H 1 1 14 10734 2 2 15 LEU HA H -3.059 3.244 0.613 1.00 . B B . 15 LEU HA 1 1 14 10735 2 2 15 LEU HB2 H -4.213 1.720 2.982 1.00 . B B . 15 LEU HB2 1 1 14 10736 2 2 15 LEU HB3 H -4.805 1.671 1.343 1.00 . B B . 15 LEU HB3 1 1 14 10737 2 2 15 LEU HD11 H -3.784 -0.427 3.253 1.00 . B B . 15 LEU HD11 1 1 14 10738 2 2 15 LEU HD12 H -4.485 -0.843 1.703 1.00 . B B . 15 LEU HD12 1 1 14 10739 2 2 15 LEU HD13 H -2.895 -1.442 2.159 1.00 . B B . 15 LEU HD13 1 1 14 10740 2 2 15 LEU HD21 H -2.593 1.408 -0.370 1.00 . B B . 15 LEU HD21 1 1 14 10741 2 2 15 LEU HD22 H -2.125 -0.247 -0.163 1.00 . B B . 15 LEU HD22 1 1 14 10742 2 2 15 LEU HD23 H -3.820 0.158 -0.291 1.00 . B B . 15 LEU HD23 1 1 14 10743 2 2 15 LEU HG H -1.945 0.816 2.028 1.00 . B B . 15 LEU HG 1 1 14 10744 2 2 15 LEU N N -2.005 3.281 2.476 1.00 . B B . 15 LEU N 1 1 14 10745 2 2 15 LEU O O -4.713 5.044 1.264 1.00 . B B . 15 LEU O 1 1 14 10746 2 2 16 TYR C C -5.166 6.753 3.414 1.00 . B B . 16 TYR C 1 1 14 10747 2 2 16 TYR CA C -5.475 5.326 3.942 1.00 . B B . 16 TYR CA 1 1 14 10748 2 2 16 TYR CB C -5.332 5.264 5.489 1.00 . B B . 16 TYR CB 1 1 14 10749 2 2 16 TYR CD1 C -6.290 2.888 5.323 1.00 . B B . 16 TYR CD1 1 1 14 10750 2 2 16 TYR CD2 C -5.922 3.832 7.468 1.00 . B B . 16 TYR CD2 1 1 14 10751 2 2 16 TYR CE1 C -6.765 1.737 5.914 1.00 . B B . 16 TYR CE1 1 1 14 10752 2 2 16 TYR CE2 C -6.400 2.673 8.051 1.00 . B B . 16 TYR CE2 1 1 14 10753 2 2 16 TYR CG C -5.862 3.952 6.095 1.00 . B B . 16 TYR CG 1 1 14 10754 2 2 16 TYR CZ C -6.820 1.629 7.277 1.00 . B B . 16 TYR CZ 1 1 14 10755 2 2 16 TYR H H -4.105 3.632 3.922 1.00 . B B . 16 TYR H 1 1 14 10756 2 2 16 TYR HA H -6.488 5.070 3.653 1.00 . B B . 16 TYR HA 1 1 14 10757 2 2 16 TYR HB2 H -4.291 5.366 5.755 1.00 . B B . 16 TYR HB2 1 1 14 10758 2 2 16 TYR HB3 H -5.878 6.085 5.930 1.00 . B B . 16 TYR HB3 1 1 14 10759 2 2 16 TYR HD1 H -6.256 2.942 4.246 1.00 . B B . 16 TYR HD1 1 1 14 10760 2 2 16 TYR HD2 H -5.592 4.650 8.092 1.00 . B B . 16 TYR HD2 1 1 14 10761 2 2 16 TYR HE1 H -7.093 0.916 5.298 1.00 . B B . 16 TYR HE1 1 1 14 10762 2 2 16 TYR HE2 H -6.452 2.565 9.123 1.00 . B B . 16 TYR HE2 1 1 14 10763 2 2 16 TYR HH H -7.714 0.020 7.130 1.00 . B B . 16 TYR HH 1 1 14 10764 2 2 16 TYR N N -4.540 4.301 3.352 1.00 . B B . 16 TYR N 1 1 14 10765 2 2 16 TYR O O -6.032 7.558 3.138 1.00 . B B . 16 TYR O 1 1 14 10766 2 2 16 TYR OH O -7.299 0.483 7.860 1.00 . B B . 16 TYR OH 1 1 14 10767 2 2 17 LEU C C -3.430 8.433 1.302 1.00 . B B . 17 LEU C 1 1 14 10768 2 2 17 LEU CA C -3.288 8.259 2.842 1.00 . B B . 17 LEU CA 1 1 14 10769 2 2 17 LEU CB C -1.821 8.193 3.339 1.00 . B B . 17 LEU CB 1 1 14 10770 2 2 17 LEU CD1 C -1.624 10.627 3.827 1.00 . B B . 17 LEU CD1 1 1 14 10771 2 2 17 LEU CD2 C 0.385 9.220 3.574 1.00 . B B . 17 LEU CD2 1 1 14 10772 2 2 17 LEU CG C -1.026 9.461 3.044 1.00 . B B . 17 LEU CG 1 1 14 10773 2 2 17 LEU H H -3.294 6.252 3.603 1.00 . B B . 17 LEU H 1 1 14 10774 2 2 17 LEU HA H -3.819 9.081 3.299 1.00 . B B . 17 LEU HA 1 1 14 10775 2 2 17 LEU HB2 H -1.827 8.003 4.405 1.00 . B B . 17 LEU HB2 1 1 14 10776 2 2 17 LEU HB3 H -1.331 7.356 2.868 1.00 . B B . 17 LEU HB3 1 1 14 10777 2 2 17 LEU HD11 H -1.613 10.417 4.887 1.00 . B B . 17 LEU HD11 1 1 14 10778 2 2 17 LEU HD12 H -1.058 11.526 3.644 1.00 . B B . 17 LEU HD12 1 1 14 10779 2 2 17 LEU HD13 H -2.645 10.805 3.522 1.00 . B B . 17 LEU HD13 1 1 14 10780 2 2 17 LEU HD21 H 0.357 9.020 4.637 1.00 . B B . 17 LEU HD21 1 1 14 10781 2 2 17 LEU HD22 H 0.827 8.366 3.081 1.00 . B B . 17 LEU HD22 1 1 14 10782 2 2 17 LEU HD23 H 1.006 10.084 3.399 1.00 . B B . 17 LEU HD23 1 1 14 10783 2 2 17 LEU HG H -1.018 9.674 1.979 1.00 . B B . 17 LEU HG 1 1 14 10784 2 2 17 LEU N N -3.887 6.977 3.323 1.00 . B B . 17 LEU N 1 1 14 10785 2 2 17 LEU O O -3.935 9.445 0.857 1.00 . B B . 17 LEU O 1 1 14 10786 2 2 18 VAL C C -4.643 7.720 -1.394 1.00 . B B . 18 VAL C 1 1 14 10787 2 2 18 VAL CA C -3.131 7.633 -0.977 1.00 . B B . 18 VAL CA 1 1 14 10788 2 2 18 VAL CB C -2.358 6.435 -1.670 1.00 . B B . 18 VAL CB 1 1 14 10789 2 2 18 VAL CG1 C -2.825 5.092 -1.232 1.00 . B B . 18 VAL CG1 1 1 14 10790 2 2 18 VAL CG2 C -2.541 6.508 -3.198 1.00 . B B . 18 VAL CG2 1 1 14 10791 2 2 18 VAL H H -2.583 6.690 0.932 1.00 . B B . 18 VAL H 1 1 14 10792 2 2 18 VAL HA H -2.622 8.513 -1.309 1.00 . B B . 18 VAL HA 1 1 14 10793 2 2 18 VAL HB H -1.306 6.534 -1.428 1.00 . B B . 18 VAL HB 1 1 14 10794 2 2 18 VAL HG11 H -2.696 5.009 -0.171 1.00 . B B . 18 VAL HG11 1 1 14 10795 2 2 18 VAL HG12 H -3.862 4.993 -1.462 1.00 . B B . 18 VAL HG12 1 1 14 10796 2 2 18 VAL HG13 H -2.278 4.307 -1.726 1.00 . B B . 18 VAL HG13 1 1 14 10797 2 2 18 VAL HG21 H -2.157 7.442 -3.581 1.00 . B B . 18 VAL HG21 1 1 14 10798 2 2 18 VAL HG22 H -2.021 5.700 -3.692 1.00 . B B . 18 VAL HG22 1 1 14 10799 2 2 18 VAL HG23 H -3.587 6.444 -3.465 1.00 . B B . 18 VAL HG23 1 1 14 10800 2 2 18 VAL N N -2.992 7.478 0.519 1.00 . B B . 18 VAL N 1 1 14 10801 2 2 18 VAL O O -4.980 8.584 -2.180 1.00 . B B . 18 VAL O 1 1 14 10802 2 2 19 CYS C C -7.883 6.985 -0.004 1.00 . B B . 19 CYS C 1 1 14 10803 2 2 19 CYS CA C -6.988 6.938 -1.278 1.00 . B B . 19 CYS CA 1 1 14 10804 2 2 19 CYS CB C -7.269 5.723 -2.136 1.00 . B B . 19 CYS CB 1 1 14 10805 2 2 19 CYS H H -5.230 6.158 -0.278 1.00 . B B . 19 CYS H 1 1 14 10806 2 2 19 CYS HA H -7.194 7.829 -1.856 1.00 . B B . 19 CYS HA 1 1 14 10807 2 2 19 CYS HB2 H -7.860 4.996 -1.600 1.00 . B B . 19 CYS HB2 1 1 14 10808 2 2 19 CYS HB3 H -7.858 6.042 -2.985 1.00 . B B . 19 CYS HB3 1 1 14 10809 2 2 19 CYS HG H -5.563 5.337 -3.621 1.00 . B B . 19 CYS HG 1 1 14 10810 2 2 19 CYS N N -5.518 6.867 -0.900 1.00 . B B . 19 CYS N 1 1 14 10811 2 2 19 CYS O O -8.552 6.046 0.411 1.00 . B B . 19 CYS O 1 1 14 10812 2 2 19 CYS SG S -5.752 4.969 -2.754 1.00 . B B . 19 CYS SG 1 1 14 10813 2 2 20 GLY C C -10.194 8.463 1.654 1.00 . B B . 20 GLY C 1 1 14 10814 2 2 20 GLY CA C -8.683 8.341 1.868 1.00 . B B . 20 GLY CA 1 1 14 10815 2 2 20 GLY H H -7.306 8.838 0.229 1.00 . B B . 20 GLY H 1 1 14 10816 2 2 20 GLY HA2 H -8.518 7.511 2.540 1.00 . B B . 20 GLY HA2 1 1 14 10817 2 2 20 GLY HA3 H -8.352 9.241 2.362 1.00 . B B . 20 GLY HA3 1 1 14 10818 2 2 20 GLY N N -7.868 8.133 0.612 1.00 . B B . 20 GLY N 1 1 14 10819 2 2 20 GLY O O -10.863 9.126 2.418 1.00 . B B . 20 GLY O 1 1 14 10820 2 2 21 GLU C C -12.754 6.408 0.394 1.00 . B B . 21 GLU C 1 1 14 10821 2 2 21 GLU CA C -12.163 7.858 0.318 1.00 . B B . 21 GLU CA 1 1 14 10822 2 2 21 GLU CB C -12.266 8.572 -1.092 1.00 . B B . 21 GLU CB 1 1 14 10823 2 2 21 GLU CD C -10.533 7.089 -2.437 1.00 . B B . 21 GLU CD 1 1 14 10824 2 2 21 GLU CG C -11.912 7.735 -2.375 1.00 . B B . 21 GLU CG 1 1 14 10825 2 2 21 GLU H H -10.091 7.317 0.047 1.00 . B B . 21 GLU H 1 1 14 10826 2 2 21 GLU HA H -12.685 8.443 1.062 1.00 . B B . 21 GLU HA 1 1 14 10827 2 2 21 GLU HB2 H -13.269 8.965 -1.195 1.00 . B B . 21 GLU HB2 1 1 14 10828 2 2 21 GLU HB3 H -11.596 9.422 -1.067 1.00 . B B . 21 GLU HB3 1 1 14 10829 2 2 21 GLU HG2 H -12.655 6.986 -2.525 1.00 . B B . 21 GLU HG2 1 1 14 10830 2 2 21 GLU HG3 H -11.961 8.396 -3.226 1.00 . B B . 21 GLU HG3 1 1 14 10831 2 2 21 GLU N N -10.694 7.826 0.633 1.00 . B B . 21 GLU N 1 1 14 10832 2 2 21 GLU O O -13.937 6.194 0.575 1.00 . B B . 21 GLU O 1 1 14 10833 2 2 21 GLU OE1 O -10.312 6.171 -1.682 1.00 . B B . 21 GLU OE1 1 1 14 10834 2 2 21 GLU OE2 O -9.752 7.530 -3.245 1.00 . B B . 21 GLU OE2 1 1 14 10835 2 2 22 ARG C C -11.526 3.278 1.475 1.00 . B B . 22 ARG C 1 1 14 10836 2 2 22 ARG CA C -12.187 3.983 0.291 1.00 . B B . 22 ARG CA 1 1 14 10837 2 2 22 ARG CB C -11.705 3.270 -1.016 1.00 . B B . 22 ARG CB 1 1 14 10838 2 2 22 ARG CD C -13.128 4.634 -2.515 1.00 . B B . 22 ARG CD 1 1 14 10839 2 2 22 ARG CG C -12.801 3.212 -2.093 1.00 . B B . 22 ARG CG 1 1 14 10840 2 2 22 ARG CZ C -14.487 3.590 -4.258 1.00 . B B . 22 ARG CZ 1 1 14 10841 2 2 22 ARG H H -10.983 5.699 0.061 1.00 . B B . 22 ARG H 1 1 14 10842 2 2 22 ARG HA H -13.218 3.926 0.415 1.00 . B B . 22 ARG HA 1 1 14 10843 2 2 22 ARG HB2 H -10.846 3.805 -1.402 1.00 . B B . 22 ARG HB2 1 1 14 10844 2 2 22 ARG HB3 H -11.389 2.259 -0.793 1.00 . B B . 22 ARG HB3 1 1 14 10845 2 2 22 ARG HD2 H -13.553 5.196 -1.687 1.00 . B B . 22 ARG HD2 1 1 14 10846 2 2 22 ARG HD3 H -12.187 5.117 -2.769 1.00 . B B . 22 ARG HD3 1 1 14 10847 2 2 22 ARG HE H -14.327 5.499 -4.102 1.00 . B B . 22 ARG HE 1 1 14 10848 2 2 22 ARG HG2 H -12.423 2.647 -2.935 1.00 . B B . 22 ARG HG2 1 1 14 10849 2 2 22 ARG HG3 H -13.681 2.718 -1.704 1.00 . B B . 22 ARG HG3 1 1 14 10850 2 2 22 ARG HH11 H -12.817 3.469 -5.080 1.00 . B B . 22 ARG HH11 1 1 14 10851 2 2 22 ARG HH12 H -13.859 2.178 -5.535 1.00 . B B . 22 ARG HH12 1 1 14 10852 2 2 22 ARG HH21 H -16.143 3.781 -3.347 1.00 . B B . 22 ARG HH21 1 1 14 10853 2 2 22 ARG HH22 H -16.025 2.398 -4.403 1.00 . B B . 22 ARG HH22 1 1 14 10854 2 2 22 ARG N N -11.890 5.439 0.243 1.00 . B B . 22 ARG N 1 1 14 10855 2 2 22 ARG NE N -14.056 4.641 -3.714 1.00 . B B . 22 ARG NE 1 1 14 10856 2 2 22 ARG NH1 N -13.701 3.006 -5.023 1.00 . B B . 22 ARG NH1 1 1 14 10857 2 2 22 ARG NH2 N -15.648 3.213 -3.991 1.00 . B B . 22 ARG NH2 1 1 14 10858 2 2 22 ARG O O -12.052 2.387 2.109 1.00 . B B . 22 ARG O 1 1 14 10859 2 2 23 GLY C C -8.577 2.077 2.265 1.00 . B B . 23 GLY C 1 1 14 10860 2 2 23 GLY CA C -9.502 3.138 2.847 1.00 . B B . 23 GLY CA 1 1 14 10861 2 2 23 GLY H H -10.020 4.425 1.128 1.00 . B B . 23 GLY H 1 1 14 10862 2 2 23 GLY HA2 H -8.894 3.910 3.294 1.00 . B B . 23 GLY HA2 1 1 14 10863 2 2 23 GLY HA3 H -10.127 2.681 3.601 1.00 . B B . 23 GLY HA3 1 1 14 10864 2 2 23 GLY N N -10.332 3.708 1.719 1.00 . B B . 23 GLY N 1 1 14 10865 2 2 23 GLY O O -7.374 2.183 2.355 1.00 . B B . 23 GLY O 1 1 14 10866 2 2 24 PHE C C -9.344 -1.402 0.815 1.00 . B B . 24 PHE C 1 1 14 10867 2 2 24 PHE CA C -8.528 -0.084 1.009 1.00 . B B . 24 PHE CA 1 1 14 10868 2 2 24 PHE CB C -7.242 -0.510 1.812 1.00 . B B . 24 PHE CB 1 1 14 10869 2 2 24 PHE CD1 C -8.779 -0.847 3.881 1.00 . B B . 24 PHE CD1 1 1 14 10870 2 2 24 PHE CD2 C -6.485 -1.380 4.048 1.00 . B B . 24 PHE CD2 1 1 14 10871 2 2 24 PHE CE1 C -8.965 -1.230 5.191 1.00 . B B . 24 PHE CE1 1 1 14 10872 2 2 24 PHE CE2 C -6.663 -1.765 5.357 1.00 . B B . 24 PHE CE2 1 1 14 10873 2 2 24 PHE CG C -7.531 -0.916 3.284 1.00 . B B . 24 PHE CG 1 1 14 10874 2 2 24 PHE CZ C -7.905 -1.693 5.933 1.00 . B B . 24 PHE CZ 1 1 14 10875 2 2 24 PHE H H -10.194 1.158 1.671 1.00 . B B . 24 PHE H 1 1 14 10876 2 2 24 PHE HA H -8.217 0.232 0.025 1.00 . B B . 24 PHE HA 1 1 14 10877 2 2 24 PHE HB2 H -6.792 -1.363 1.326 1.00 . B B . 24 PHE HB2 1 1 14 10878 2 2 24 PHE HB3 H -6.501 0.274 1.814 1.00 . B B . 24 PHE HB3 1 1 14 10879 2 2 24 PHE HD1 H -9.635 -0.492 3.329 1.00 . B B . 24 PHE HD1 1 1 14 10880 2 2 24 PHE HD2 H -5.505 -1.442 3.615 1.00 . B B . 24 PHE HD2 1 1 14 10881 2 2 24 PHE HE1 H -9.952 -1.159 5.628 1.00 . B B . 24 PHE HE1 1 1 14 10882 2 2 24 PHE HE2 H -5.818 -2.120 5.931 1.00 . B B . 24 PHE HE2 1 1 14 10883 2 2 24 PHE HZ H -8.047 -2.002 6.961 1.00 . B B . 24 PHE HZ 1 1 14 10884 2 2 24 PHE N N -9.213 1.097 1.671 1.00 . B B . 24 PHE N 1 1 14 10885 2 2 24 PHE O O -10.284 -1.725 1.507 1.00 . B B . 24 PHE O 1 1 14 10886 2 2 25 PHE C C -8.226 -4.343 -0.312 1.00 . B B . 25 PHE C 1 1 14 10887 2 2 25 PHE CA C -9.460 -3.448 -0.610 1.00 . B B . 25 PHE CA 1 1 14 10888 2 2 25 PHE CB C -9.784 -3.409 -2.136 1.00 . B B . 25 PHE CB 1 1 14 10889 2 2 25 PHE CD1 C -11.560 -1.594 -1.675 1.00 . B B . 25 PHE CD1 1 1 14 10890 2 2 25 PHE CD2 C -11.190 -2.325 -3.898 1.00 . B B . 25 PHE CD2 1 1 14 10891 2 2 25 PHE CE1 C -12.526 -0.718 -2.122 1.00 . B B . 25 PHE CE1 1 1 14 10892 2 2 25 PHE CE2 C -12.155 -1.452 -4.352 1.00 . B B . 25 PHE CE2 1 1 14 10893 2 2 25 PHE CG C -10.878 -2.409 -2.557 1.00 . B B . 25 PHE CG 1 1 14 10894 2 2 25 PHE CZ C -12.824 -0.646 -3.462 1.00 . B B . 25 PHE CZ 1 1 14 10895 2 2 25 PHE H H -8.161 -1.747 -0.679 1.00 . B B . 25 PHE H 1 1 14 10896 2 2 25 PHE HA H -10.293 -3.754 0.009 1.00 . B B . 25 PHE HA 1 1 14 10897 2 2 25 PHE HB2 H -8.886 -3.161 -2.682 1.00 . B B . 25 PHE HB2 1 1 14 10898 2 2 25 PHE HB3 H -10.100 -4.393 -2.451 1.00 . B B . 25 PHE HB3 1 1 14 10899 2 2 25 PHE HD1 H -11.349 -1.641 -0.619 1.00 . B B . 25 PHE HD1 1 1 14 10900 2 2 25 PHE HD2 H -10.668 -2.957 -4.603 1.00 . B B . 25 PHE HD2 1 1 14 10901 2 2 25 PHE HE1 H -13.049 -0.088 -1.414 1.00 . B B . 25 PHE HE1 1 1 14 10902 2 2 25 PHE HE2 H -12.387 -1.402 -5.407 1.00 . B B . 25 PHE HE2 1 1 14 10903 2 2 25 PHE HZ H -13.578 0.038 -3.815 1.00 . B B . 25 PHE HZ 1 1 14 10904 2 2 25 PHE N N -8.907 -2.120 -0.175 1.00 . B B . 25 PHE N 1 1 14 10905 2 2 25 PHE O O -7.529 -4.828 -1.184 1.00 . B B . 25 PHE O 1 1 14 10906 2 2 26 TYR C C -7.059 -6.892 1.457 1.00 . B B . 26 TYR C 1 1 14 10907 2 2 26 TYR CA C -6.818 -5.361 1.399 1.00 . B B . 26 TYR CA 1 1 14 10908 2 2 26 TYR CB C -6.438 -4.767 2.772 1.00 . B B . 26 TYR CB 1 1 14 10909 2 2 26 TYR CD1 C -4.573 -6.353 3.464 1.00 . B B . 26 TYR CD1 1 1 14 10910 2 2 26 TYR CD2 C -4.065 -4.058 3.142 1.00 . B B . 26 TYR CD2 1 1 14 10911 2 2 26 TYR CE1 C -3.250 -6.590 3.791 1.00 . B B . 26 TYR CE1 1 1 14 10912 2 2 26 TYR CE2 C -2.750 -4.302 3.470 1.00 . B B . 26 TYR CE2 1 1 14 10913 2 2 26 TYR CG C -4.987 -5.080 3.137 1.00 . B B . 26 TYR CG 1 1 14 10914 2 2 26 TYR CZ C -2.342 -5.561 3.794 1.00 . B B . 26 TYR CZ 1 1 14 10915 2 2 26 TYR H H -8.591 -4.127 1.607 1.00 . B B . 26 TYR H 1 1 14 10916 2 2 26 TYR HA H -6.000 -5.195 0.713 1.00 . B B . 26 TYR HA 1 1 14 10917 2 2 26 TYR HB2 H -6.579 -3.698 2.771 1.00 . B B . 26 TYR HB2 1 1 14 10918 2 2 26 TYR HB3 H -7.078 -5.182 3.539 1.00 . B B . 26 TYR HB3 1 1 14 10919 2 2 26 TYR HD1 H -5.284 -7.167 3.468 1.00 . B B . 26 TYR HD1 1 1 14 10920 2 2 26 TYR HD2 H -4.378 -3.059 2.887 1.00 . B B . 26 TYR HD2 1 1 14 10921 2 2 26 TYR HE1 H -2.928 -7.589 4.042 1.00 . B B . 26 TYR HE1 1 1 14 10922 2 2 26 TYR HE2 H -2.021 -3.506 3.479 1.00 . B B . 26 TYR HE2 1 1 14 10923 2 2 26 TYR HH H -1.031 -6.482 4.767 1.00 . B B . 26 TYR HH 1 1 14 10924 2 2 26 TYR N N -7.988 -4.533 0.952 1.00 . B B . 26 TYR N 1 1 14 10925 2 2 26 TYR O O -8.080 -7.377 1.897 1.00 . B B . 26 TYR O 1 1 14 10926 2 2 26 TYR OH O -1.027 -5.771 4.122 1.00 . B B . 26 TYR OH 1 1 14 10927 2 2 27 THR C C -4.856 -9.767 1.514 1.00 . B B . 27 THR C 1 1 14 10928 2 2 27 THR CA C -6.148 -9.133 0.978 1.00 . B B . 27 THR CA 1 1 14 10929 2 2 27 THR CB C -6.353 -9.672 -0.457 1.00 . B B . 27 THR CB 1 1 14 10930 2 2 27 THR CG2 C -7.401 -8.889 -1.225 1.00 . B B . 27 THR CG2 1 1 14 10931 2 2 27 THR H H -5.281 -7.169 0.658 1.00 . B B . 27 THR H 1 1 14 10932 2 2 27 THR HA H -6.966 -9.468 1.598 1.00 . B B . 27 THR HA 1 1 14 10933 2 2 27 THR HB H -6.512 -10.747 -0.488 1.00 . B B . 27 THR HB 1 1 14 10934 2 2 27 THR HG1 H -5.440 -8.670 -1.835 1.00 . B B . 27 THR HG1 1 1 14 10935 2 2 27 THR HG21 H -7.135 -7.845 -1.301 1.00 . B B . 27 THR HG21 1 1 14 10936 2 2 27 THR HG22 H -7.517 -9.297 -2.219 1.00 . B B . 27 THR HG22 1 1 14 10937 2 2 27 THR HG23 H -8.347 -8.957 -0.710 1.00 . B B . 27 THR HG23 1 1 14 10938 2 2 27 THR N N -6.081 -7.619 0.996 1.00 . B B . 27 THR N 1 1 14 10939 2 2 27 THR O O -3.904 -9.079 1.824 1.00 . B B . 27 THR O 1 1 14 10940 2 2 27 THR OG1 O -5.175 -9.309 -1.163 1.00 . B B . 27 THR OG1 1 1 14 10941 2 2 28 PRO C C -3.352 -12.515 0.128 1.00 . B B . 28 PRO C 1 1 14 10942 2 2 28 PRO CA C -3.545 -11.796 1.497 1.00 . B B . 28 PRO CA 1 1 14 10943 2 2 28 PRO CB C -3.558 -12.759 2.705 1.00 . B B . 28 PRO CB 1 1 14 10944 2 2 28 PRO CD C -5.584 -11.510 2.847 1.00 . B B . 28 PRO CD 1 1 14 10945 2 2 28 PRO CG C -4.430 -12.006 3.721 1.00 . B B . 28 PRO CG 1 1 14 10946 2 2 28 PRO HA H -2.724 -11.100 1.602 1.00 . B B . 28 PRO HA 1 1 14 10947 2 2 28 PRO HB2 H -3.983 -13.717 2.431 1.00 . B B . 28 PRO HB2 1 1 14 10948 2 2 28 PRO HB3 H -2.553 -12.915 3.075 1.00 . B B . 28 PRO HB3 1 1 14 10949 2 2 28 PRO HD2 H -6.272 -12.314 2.610 1.00 . B B . 28 PRO HD2 1 1 14 10950 2 2 28 PRO HD3 H -6.121 -10.697 3.325 1.00 . B B . 28 PRO HD3 1 1 14 10951 2 2 28 PRO HG2 H -4.783 -12.663 4.505 1.00 . B B . 28 PRO HG2 1 1 14 10952 2 2 28 PRO HG3 H -3.894 -11.174 4.158 1.00 . B B . 28 PRO HG3 1 1 14 10953 2 2 28 PRO N N -4.867 -11.075 1.600 1.00 . B B . 28 PRO N 1 1 14 10954 2 2 28 PRO O O -2.840 -13.611 0.066 1.00 . B B . 28 PRO O 1 1 14 10955 2 2 29 LYS C C -3.001 -13.703 -2.731 1.00 . B B . 29 LYS C 1 1 14 10956 2 2 29 LYS CA C -3.694 -12.338 -2.358 1.00 . B B . 29 LYS CA 1 1 14 10957 2 2 29 LYS CB C -3.045 -11.137 -3.110 1.00 . B B . 29 LYS CB 1 1 14 10958 2 2 29 LYS CD C -1.058 -9.553 -2.908 1.00 . B B . 29 LYS CD 1 1 14 10959 2 2 29 LYS CE C -0.961 -9.257 -4.398 1.00 . B B . 29 LYS CE 1 1 14 10960 2 2 29 LYS CG C -1.588 -10.969 -2.597 1.00 . B B . 29 LYS CG 1 1 14 10961 2 2 29 LYS H H -4.177 -10.972 -0.778 1.00 . B B . 29 LYS H 1 1 14 10962 2 2 29 LYS HA H -4.708 -12.437 -2.720 1.00 . B B . 29 LYS HA 1 1 14 10963 2 2 29 LYS HB2 H -3.050 -11.347 -4.171 1.00 . B B . 29 LYS HB2 1 1 14 10964 2 2 29 LYS HB3 H -3.624 -10.244 -2.923 1.00 . B B . 29 LYS HB3 1 1 14 10965 2 2 29 LYS HD2 H -1.700 -8.834 -2.430 1.00 . B B . 29 LYS HD2 1 1 14 10966 2 2 29 LYS HD3 H -0.073 -9.460 -2.474 1.00 . B B . 29 LYS HD3 1 1 14 10967 2 2 29 LYS HE2 H -0.311 -9.986 -4.873 1.00 . B B . 29 LYS HE2 1 1 14 10968 2 2 29 LYS HE3 H -1.941 -9.303 -4.862 1.00 . B B . 29 LYS HE3 1 1 14 10969 2 2 29 LYS HG2 H -1.541 -11.136 -1.527 1.00 . B B . 29 LYS HG2 1 1 14 10970 2 2 29 LYS HG3 H -0.949 -11.714 -3.058 1.00 . B B . 29 LYS HG3 1 1 14 10971 2 2 29 LYS HZ1 H -0.176 -7.516 -3.561 1.00 . B B . 29 LYS HZ1 1 1 14 10972 2 2 29 LYS HZ2 H 0.546 -7.939 -4.967 1.00 . B B . 29 LYS HZ2 1 1 14 10973 2 2 29 LYS HZ3 H -0.943 -7.173 -5.008 1.00 . B B . 29 LYS HZ3 1 1 14 10974 2 2 29 LYS N N -3.774 -11.856 -0.922 1.00 . B B . 29 LYS N 1 1 14 10975 2 2 29 LYS NZ N -0.387 -7.893 -4.514 1.00 . B B . 29 LYS NZ 1 1 14 10976 2 2 29 LYS O O -2.136 -13.751 -3.585 1.00 . B B . 29 LYS O 1 1 14 10977 2 2 30 THR C C -1.812 -16.368 -3.419 1.00 . B B . 30 THR C 1 1 14 10978 2 2 30 THR CA C -2.865 -16.170 -2.306 1.00 . B B . 30 THR CA 1 1 14 10979 2 2 30 THR CB C -4.067 -17.103 -2.582 1.00 . B B . 30 THR CB 1 1 14 10980 2 2 30 THR CG2 C -3.782 -18.551 -2.202 1.00 . B B . 30 THR CG2 1 1 14 10981 2 2 30 THR H H -4.105 -14.649 -1.420 1.00 . B B . 30 THR H 1 1 14 10982 2 2 30 THR HA H -2.400 -16.487 -1.386 1.00 . B B . 30 THR HA 1 1 14 10983 2 2 30 THR HB H -4.505 -16.971 -3.567 1.00 . B B . 30 THR HB 1 1 14 10984 2 2 30 THR HG1 H -5.188 -17.553 -1.036 1.00 . B B . 30 THR HG1 1 1 14 10985 2 2 30 THR HG21 H -3.518 -18.629 -1.158 1.00 . B B . 30 THR HG21 1 1 14 10986 2 2 30 THR HG22 H -4.651 -19.159 -2.397 1.00 . B B . 30 THR HG22 1 1 14 10987 2 2 30 THR HG23 H -2.961 -18.934 -2.790 1.00 . B B . 30 THR HG23 1 1 14 10988 2 2 30 THR N N -3.404 -14.765 -2.094 1.00 . B B . 30 THR N 1 1 14 10989 2 2 30 THR O O -1.426 -17.473 -3.760 1.00 . B B . 30 THR O 1 1 14 10990 2 2 30 THR OG1 O -4.994 -16.770 -1.561 1.00 . B B . 30 THR OG1 1 1 15 10991 1 1 1 GLY C C -1.428 -4.569 -4.085 1.00 . A A . 1 GLY C 1 1 15 10992 1 1 1 GLY CA C -2.434 -5.421 -4.861 1.00 . A A . 1 GLY CA 1 1 15 10993 1 1 1 GLY HA2 H -2.216 -5.281 -5.909 1.00 . A A . 1 GLY HA2 1 1 15 10994 1 1 1 GLY HA3 H -3.425 -5.061 -4.651 1.00 . A A . 1 GLY HA3 1 1 15 10995 1 1 1 GLY N N -2.349 -6.889 -4.547 1.00 . A A . 1 GLY N 1 1 15 10996 1 1 1 GLY O O -0.925 -3.578 -4.575 1.00 . A A . 1 GLY O 1 1 15 10997 1 1 2 ILE C C 0.916 -5.143 -1.423 1.00 . A A . 2 ILE C 1 1 15 10998 1 1 2 ILE CA C -0.210 -4.242 -1.988 1.00 . A A . 2 ILE CA 1 1 15 10999 1 1 2 ILE CB C -1.012 -3.571 -0.815 1.00 . A A . 2 ILE CB 1 1 15 11000 1 1 2 ILE CD1 C -0.678 -1.888 1.100 1.00 . A A . 2 ILE CD1 1 1 15 11001 1 1 2 ILE CG1 C -0.123 -2.431 -0.240 1.00 . A A . 2 ILE CG1 1 1 15 11002 1 1 2 ILE CG2 C -1.336 -4.558 0.327 1.00 . A A . 2 ILE CG2 1 1 15 11003 1 1 2 ILE H H -1.651 -5.783 -2.598 1.00 . A A . 2 ILE H 1 1 15 11004 1 1 2 ILE HA H 0.286 -3.479 -2.571 1.00 . A A . 2 ILE HA 1 1 15 11005 1 1 2 ILE HB H -1.927 -3.152 -1.213 1.00 . A A . 2 ILE HB 1 1 15 11006 1 1 2 ILE HD11 H -1.693 -1.548 0.995 1.00 . A A . 2 ILE HD11 1 1 15 11007 1 1 2 ILE HD12 H -0.653 -2.636 1.882 1.00 . A A . 2 ILE HD12 1 1 15 11008 1 1 2 ILE HD13 H -0.072 -1.064 1.431 1.00 . A A . 2 ILE HD13 1 1 15 11009 1 1 2 ILE HG12 H 0.895 -2.771 -0.106 1.00 . A A . 2 ILE HG12 1 1 15 11010 1 1 2 ILE HG13 H -0.095 -1.619 -0.955 1.00 . A A . 2 ILE HG13 1 1 15 11011 1 1 2 ILE HG21 H -1.893 -5.404 -0.039 1.00 . A A . 2 ILE HG21 1 1 15 11012 1 1 2 ILE HG22 H -0.432 -4.891 0.821 1.00 . A A . 2 ILE HG22 1 1 15 11013 1 1 2 ILE HG23 H -1.939 -4.035 1.052 1.00 . A A . 2 ILE HG23 1 1 15 11014 1 1 2 ILE N N -1.180 -4.976 -2.876 1.00 . A A . 2 ILE N 1 1 15 11015 1 1 2 ILE O O 2.071 -4.775 -1.438 1.00 . A A . 2 ILE O 1 1 15 11016 1 1 3 VAL C C 2.823 -7.442 -1.371 1.00 . A A . 3 VAL C 1 1 15 11017 1 1 3 VAL CA C 1.685 -7.196 -0.362 1.00 . A A . 3 VAL CA 1 1 15 11018 1 1 3 VAL CB C 1.024 -8.541 0.095 1.00 . A A . 3 VAL CB 1 1 15 11019 1 1 3 VAL CG1 C 0.045 -8.250 1.240 1.00 . A A . 3 VAL CG1 1 1 15 11020 1 1 3 VAL CG2 C 0.240 -9.220 -1.043 1.00 . A A . 3 VAL CG2 1 1 15 11021 1 1 3 VAL H H -0.334 -6.577 -0.931 1.00 . A A . 3 VAL H 1 1 15 11022 1 1 3 VAL HA H 2.141 -6.677 0.466 1.00 . A A . 3 VAL HA 1 1 15 11023 1 1 3 VAL HB H 1.805 -9.209 0.443 1.00 . A A . 3 VAL HB 1 1 15 11024 1 1 3 VAL HG11 H -0.722 -7.555 0.933 1.00 . A A . 3 VAL HG11 1 1 15 11025 1 1 3 VAL HG12 H -0.423 -9.165 1.570 1.00 . A A . 3 VAL HG12 1 1 15 11026 1 1 3 VAL HG13 H 0.576 -7.820 2.078 1.00 . A A . 3 VAL HG13 1 1 15 11027 1 1 3 VAL HG21 H -0.527 -8.574 -1.446 1.00 . A A . 3 VAL HG21 1 1 15 11028 1 1 3 VAL HG22 H 0.907 -9.490 -1.847 1.00 . A A . 3 VAL HG22 1 1 15 11029 1 1 3 VAL HG23 H -0.224 -10.130 -0.690 1.00 . A A . 3 VAL HG23 1 1 15 11030 1 1 3 VAL N N 0.602 -6.305 -0.922 1.00 . A A . 3 VAL N 1 1 15 11031 1 1 3 VAL O O 3.991 -7.294 -1.071 1.00 . A A . 3 VAL O 1 1 15 11032 1 1 4 GLU C C 4.098 -6.653 -3.979 1.00 . A A . 4 GLU C 1 1 15 11033 1 1 4 GLU CA C 3.545 -8.043 -3.576 1.00 . A A . 4 GLU CA 1 1 15 11034 1 1 4 GLU CB C 2.916 -8.819 -4.799 1.00 . A A . 4 GLU CB 1 1 15 11035 1 1 4 GLU CD C 0.622 -7.546 -4.987 1.00 . A A . 4 GLU CD 1 1 15 11036 1 1 4 GLU CG C 1.330 -8.876 -4.826 1.00 . A A . 4 GLU CG 1 1 15 11037 1 1 4 GLU H H 1.543 -7.907 -2.798 1.00 . A A . 4 GLU H 1 1 15 11038 1 1 4 GLU HA H 4.342 -8.607 -3.117 1.00 . A A . 4 GLU HA 1 1 15 11039 1 1 4 GLU HB2 H 3.252 -8.368 -5.724 1.00 . A A . 4 GLU HB2 1 1 15 11040 1 1 4 GLU HB3 H 3.289 -9.835 -4.784 1.00 . A A . 4 GLU HB3 1 1 15 11041 1 1 4 GLU HG2 H 1.022 -9.488 -5.660 1.00 . A A . 4 GLU HG2 1 1 15 11042 1 1 4 GLU HG3 H 0.934 -9.337 -3.939 1.00 . A A . 4 GLU HG3 1 1 15 11043 1 1 4 GLU N N 2.487 -7.803 -2.563 1.00 . A A . 4 GLU N 1 1 15 11044 1 1 4 GLU O O 5.226 -6.335 -3.645 1.00 . A A . 4 GLU O 1 1 15 11045 1 1 4 GLU OE1 O 0.645 -6.773 -4.056 1.00 . A A . 4 GLU OE1 1 1 15 11046 1 1 4 GLU OE2 O 0.086 -7.365 -6.052 1.00 . A A . 4 GLU OE2 1 1 15 11047 1 1 5 GLN C C 4.546 -3.674 -4.047 1.00 . A A . 5 GLN C 1 1 15 11048 1 1 5 GLN CA C 3.751 -4.487 -5.100 1.00 . A A . 5 GLN CA 1 1 15 11049 1 1 5 GLN CB C 2.490 -3.666 -5.508 1.00 . A A . 5 GLN CB 1 1 15 11050 1 1 5 GLN CD C 2.325 -5.133 -7.633 1.00 . A A . 5 GLN CD 1 1 15 11051 1 1 5 GLN CG C 1.570 -4.415 -6.526 1.00 . A A . 5 GLN CG 1 1 15 11052 1 1 5 GLN H H 2.413 -6.195 -4.868 1.00 . A A . 5 GLN H 1 1 15 11053 1 1 5 GLN HA H 4.426 -4.575 -5.946 1.00 . A A . 5 GLN HA 1 1 15 11054 1 1 5 GLN HB2 H 1.896 -3.454 -4.629 1.00 . A A . 5 GLN HB2 1 1 15 11055 1 1 5 GLN HB3 H 2.798 -2.726 -5.946 1.00 . A A . 5 GLN HB3 1 1 15 11056 1 1 5 GLN HE21 H 1.284 -6.779 -7.433 1.00 . A A . 5 GLN HE21 1 1 15 11057 1 1 5 GLN HE22 H 2.493 -6.784 -8.641 1.00 . A A . 5 GLN HE22 1 1 15 11058 1 1 5 GLN HG2 H 0.958 -5.136 -6.009 1.00 . A A . 5 GLN HG2 1 1 15 11059 1 1 5 GLN HG3 H 0.904 -3.715 -7.004 1.00 . A A . 5 GLN HG3 1 1 15 11060 1 1 5 GLN N N 3.317 -5.864 -4.657 1.00 . A A . 5 GLN N 1 1 15 11061 1 1 5 GLN NE2 N 2.008 -6.338 -7.929 1.00 . A A . 5 GLN NE2 1 1 15 11062 1 1 5 GLN O O 5.475 -2.967 -4.373 1.00 . A A . 5 GLN O 1 1 15 11063 1 1 5 GLN OE1 O 3.224 -4.630 -8.268 1.00 . A A . 5 GLN OE1 1 1 15 11064 1 1 6 CYS C C 5.632 -3.826 -0.630 1.00 . A A . 6 CYS C 1 1 15 11065 1 1 6 CYS CA C 4.823 -3.064 -1.686 1.00 . A A . 6 CYS CA 1 1 15 11066 1 1 6 CYS CB C 3.742 -2.279 -0.977 1.00 . A A . 6 CYS CB 1 1 15 11067 1 1 6 CYS H H 3.402 -4.397 -2.617 1.00 . A A . 6 CYS H 1 1 15 11068 1 1 6 CYS HA H 5.540 -2.372 -2.103 1.00 . A A . 6 CYS HA 1 1 15 11069 1 1 6 CYS HB2 H 3.114 -1.775 -1.693 1.00 . A A . 6 CYS HB2 1 1 15 11070 1 1 6 CYS HB3 H 3.122 -2.976 -0.432 1.00 . A A . 6 CYS HB3 1 1 15 11071 1 1 6 CYS HG H 4.561 -1.577 1.032 1.00 . A A . 6 CYS HG 1 1 15 11072 1 1 6 CYS N N 4.155 -3.801 -2.811 1.00 . A A . 6 CYS N 1 1 15 11073 1 1 6 CYS O O 6.602 -3.296 -0.133 1.00 . A A . 6 CYS O 1 1 15 11074 1 1 6 CYS SG S 4.376 -1.090 0.224 1.00 . A A . 6 CYS SG 1 1 15 11075 1 1 7 CYS C C 6.978 -6.860 0.149 1.00 . A A . 7 CYS C 1 1 15 11076 1 1 7 CYS CA C 5.998 -5.798 0.735 1.00 . A A . 7 CYS CA 1 1 15 11077 1 1 7 CYS CB C 4.873 -6.366 1.648 1.00 . A A . 7 CYS CB 1 1 15 11078 1 1 7 CYS H H 4.440 -5.381 -0.739 1.00 . A A . 7 CYS H 1 1 15 11079 1 1 7 CYS HA H 6.603 -5.124 1.326 1.00 . A A . 7 CYS HA 1 1 15 11080 1 1 7 CYS HB2 H 4.341 -5.499 2.022 1.00 . A A . 7 CYS HB2 1 1 15 11081 1 1 7 CYS HB3 H 4.162 -6.901 1.052 1.00 . A A . 7 CYS HB3 1 1 15 11082 1 1 7 CYS HG H 5.388 -8.313 2.761 1.00 . A A . 7 CYS HG 1 1 15 11083 1 1 7 CYS N N 5.238 -5.017 -0.301 1.00 . A A . 7 CYS N 1 1 15 11084 1 1 7 CYS O O 7.785 -7.423 0.858 1.00 . A A . 7 CYS O 1 1 15 11085 1 1 7 CYS SG S 5.312 -7.405 3.065 1.00 . A A . 7 CYS SG 1 1 15 11086 1 1 8 THR C C 8.609 -7.448 -2.931 1.00 . A A . 8 THR C 1 1 15 11087 1 1 8 THR CA C 7.820 -8.128 -1.803 1.00 . A A . 8 THR CA 1 1 15 11088 1 1 8 THR CB C 7.028 -9.325 -2.415 1.00 . A A . 8 THR CB 1 1 15 11089 1 1 8 THR CG2 C 6.704 -9.235 -3.909 1.00 . A A . 8 THR CG2 1 1 15 11090 1 1 8 THR H H 6.208 -6.626 -1.639 1.00 . A A . 8 THR H 1 1 15 11091 1 1 8 THR HA H 8.540 -8.500 -1.088 1.00 . A A . 8 THR HA 1 1 15 11092 1 1 8 THR HB H 6.229 -9.701 -1.784 1.00 . A A . 8 THR HB 1 1 15 11093 1 1 8 THR HG1 H 8.889 -9.874 -2.727 1.00 . A A . 8 THR HG1 1 1 15 11094 1 1 8 THR HG21 H 6.124 -8.363 -4.140 1.00 . A A . 8 THR HG21 1 1 15 11095 1 1 8 THR HG22 H 7.605 -9.211 -4.504 1.00 . A A . 8 THR HG22 1 1 15 11096 1 1 8 THR HG23 H 6.148 -10.119 -4.188 1.00 . A A . 8 THR HG23 1 1 15 11097 1 1 8 THR N N 6.891 -7.113 -1.134 1.00 . A A . 8 THR N 1 1 15 11098 1 1 8 THR O O 9.718 -7.813 -3.255 1.00 . A A . 8 THR O 1 1 15 11099 1 1 8 THR OG1 O 8.033 -10.306 -2.592 1.00 . A A . 8 THR OG1 1 1 15 11100 1 1 9 SER C C 8.679 -4.196 -4.047 1.00 . A A . 9 SER C 1 1 15 11101 1 1 9 SER CA C 8.486 -5.621 -4.628 1.00 . A A . 9 SER CA 1 1 15 11102 1 1 9 SER CB C 7.446 -5.617 -5.765 1.00 . A A . 9 SER CB 1 1 15 11103 1 1 9 SER H H 7.057 -6.291 -3.176 1.00 . A A . 9 SER H 1 1 15 11104 1 1 9 SER HA H 9.447 -5.979 -4.967 1.00 . A A . 9 SER HA 1 1 15 11105 1 1 9 SER HB2 H 7.214 -6.627 -6.078 1.00 . A A . 9 SER HB2 1 1 15 11106 1 1 9 SER HB3 H 6.540 -5.110 -5.453 1.00 . A A . 9 SER HB3 1 1 15 11107 1 1 9 SER HG H 7.600 -4.985 -7.647 1.00 . A A . 9 SER HG 1 1 15 11108 1 1 9 SER N N 7.960 -6.474 -3.502 1.00 . A A . 9 SER N 1 1 15 11109 1 1 9 SER O O 8.983 -4.063 -2.878 1.00 . A A . 9 SER O 1 1 15 11110 1 1 9 SER OG O 8.087 -4.891 -6.815 1.00 . A A . 9 SER OG 1 1 15 11111 1 1 10 ILE C C 7.499 -0.886 -4.717 1.00 . A A . 10 ILE C 1 1 15 11112 1 1 10 ILE CA C 8.684 -1.771 -4.337 1.00 . A A . 10 ILE CA 1 1 15 11113 1 1 10 ILE CB C 10.021 -1.151 -4.889 1.00 . A A . 10 ILE CB 1 1 15 11114 1 1 10 ILE CD1 C 12.486 -0.894 -4.080 1.00 . A A . 10 ILE CD1 1 1 15 11115 1 1 10 ILE CG1 C 11.179 -1.747 -4.020 1.00 . A A . 10 ILE CG1 1 1 15 11116 1 1 10 ILE CG2 C 9.969 0.391 -4.726 1.00 . A A . 10 ILE CG2 1 1 15 11117 1 1 10 ILE H H 8.284 -3.339 -5.751 1.00 . A A . 10 ILE H 1 1 15 11118 1 1 10 ILE HA H 8.776 -1.786 -3.263 1.00 . A A . 10 ILE HA 1 1 15 11119 1 1 10 ILE HB H 10.147 -1.423 -5.930 1.00 . A A . 10 ILE HB 1 1 15 11120 1 1 10 ILE HD11 H 12.849 -0.807 -5.093 1.00 . A A . 10 ILE HD11 1 1 15 11121 1 1 10 ILE HD12 H 12.320 0.104 -3.696 1.00 . A A . 10 ILE HD12 1 1 15 11122 1 1 10 ILE HD13 H 13.255 -1.348 -3.470 1.00 . A A . 10 ILE HD13 1 1 15 11123 1 1 10 ILE HG12 H 10.860 -1.846 -2.991 1.00 . A A . 10 ILE HG12 1 1 15 11124 1 1 10 ILE HG13 H 11.382 -2.747 -4.377 1.00 . A A . 10 ILE HG13 1 1 15 11125 1 1 10 ILE HG21 H 9.805 0.608 -3.686 1.00 . A A . 10 ILE HG21 1 1 15 11126 1 1 10 ILE HG22 H 10.887 0.856 -5.047 1.00 . A A . 10 ILE HG22 1 1 15 11127 1 1 10 ILE HG23 H 9.162 0.825 -5.299 1.00 . A A . 10 ILE HG23 1 1 15 11128 1 1 10 ILE N N 8.521 -3.170 -4.826 1.00 . A A . 10 ILE N 1 1 15 11129 1 1 10 ILE O O 7.090 -0.703 -5.848 1.00 . A A . 10 ILE O 1 1 15 11130 1 1 11 CYS C C 6.080 2.065 -3.506 1.00 . A A . 11 CYS C 1 1 15 11131 1 1 11 CYS CA C 5.829 0.570 -3.753 1.00 . A A . 11 CYS CA 1 1 15 11132 1 1 11 CYS CB C 4.804 0.096 -2.755 1.00 . A A . 11 CYS CB 1 1 15 11133 1 1 11 CYS H H 7.399 -0.538 -2.841 1.00 . A A . 11 CYS H 1 1 15 11134 1 1 11 CYS HA H 5.398 0.447 -4.735 1.00 . A A . 11 CYS HA 1 1 15 11135 1 1 11 CYS HB2 H 3.913 0.702 -2.824 1.00 . A A . 11 CYS HB2 1 1 15 11136 1 1 11 CYS HB3 H 4.529 -0.909 -3.030 1.00 . A A . 11 CYS HB3 1 1 15 11137 1 1 11 CYS HG H 5.164 1.005 -0.670 1.00 . A A . 11 CYS HG 1 1 15 11138 1 1 11 CYS N N 6.984 -0.329 -3.677 1.00 . A A . 11 CYS N 1 1 15 11139 1 1 11 CYS O O 6.747 2.547 -2.609 1.00 . A A . 11 CYS O 1 1 15 11140 1 1 11 CYS SG S 5.345 0.131 -1.026 1.00 . A A . 11 CYS SG 1 1 15 11141 1 1 12 SER C C 3.998 4.603 -4.148 1.00 . A A . 12 SER C 1 1 15 11142 1 1 12 SER CA C 5.416 4.200 -4.531 1.00 . A A . 12 SER CA 1 1 15 11143 1 1 12 SER CB C 5.698 4.670 -5.955 1.00 . A A . 12 SER CB 1 1 15 11144 1 1 12 SER H H 5.016 2.111 -5.043 1.00 . A A . 12 SER H 1 1 15 11145 1 1 12 SER HA H 6.069 4.643 -3.851 1.00 . A A . 12 SER HA 1 1 15 11146 1 1 12 SER HB2 H 4.888 4.415 -6.613 1.00 . A A . 12 SER HB2 1 1 15 11147 1 1 12 SER HB3 H 5.861 5.740 -5.988 1.00 . A A . 12 SER HB3 1 1 15 11148 1 1 12 SER HG H 7.651 4.435 -5.913 1.00 . A A . 12 SER HG 1 1 15 11149 1 1 12 SER N N 5.453 2.709 -4.419 1.00 . A A . 12 SER N 1 1 15 11150 1 1 12 SER O O 3.167 3.727 -3.995 1.00 . A A . 12 SER O 1 1 15 11151 1 1 12 SER OG O 6.894 3.997 -6.334 1.00 . A A . 12 SER OG 1 1 15 11152 1 1 13 LEU C C 1.414 5.545 -4.589 1.00 . A A . 13 LEU C 1 1 15 11153 1 1 13 LEU CA C 2.314 6.293 -3.618 1.00 . A A . 13 LEU CA 1 1 15 11154 1 1 13 LEU CB C 2.267 7.842 -3.766 1.00 . A A . 13 LEU CB 1 1 15 11155 1 1 13 LEU CD1 C 1.877 8.361 -1.349 1.00 . A A . 13 LEU CD1 1 1 15 11156 1 1 13 LEU CD2 C 1.146 9.935 -3.112 1.00 . A A . 13 LEU CD2 1 1 15 11157 1 1 13 LEU CG C 1.294 8.459 -2.763 1.00 . A A . 13 LEU CG 1 1 15 11158 1 1 13 LEU H H 4.394 6.544 -4.149 1.00 . A A . 13 LEU H 1 1 15 11159 1 1 13 LEU HA H 2.021 5.910 -2.651 1.00 . A A . 13 LEU HA 1 1 15 11160 1 1 13 LEU HB2 H 3.242 8.274 -3.627 1.00 . A A . 13 LEU HB2 1 1 15 11161 1 1 13 LEU HB3 H 1.912 8.104 -4.755 1.00 . A A . 13 LEU HB3 1 1 15 11162 1 1 13 LEU HD11 H 2.820 8.883 -1.292 1.00 . A A . 13 LEU HD11 1 1 15 11163 1 1 13 LEU HD12 H 1.190 8.812 -0.647 1.00 . A A . 13 LEU HD12 1 1 15 11164 1 1 13 LEU HD13 H 2.027 7.332 -1.066 1.00 . A A . 13 LEU HD13 1 1 15 11165 1 1 13 LEU HD21 H 2.093 10.453 -3.081 1.00 . A A . 13 LEU HD21 1 1 15 11166 1 1 13 LEU HD22 H 0.733 10.013 -4.111 1.00 . A A . 13 LEU HD22 1 1 15 11167 1 1 13 LEU HD23 H 0.458 10.412 -2.430 1.00 . A A . 13 LEU HD23 1 1 15 11168 1 1 13 LEU HG H 0.325 7.970 -2.838 1.00 . A A . 13 LEU HG 1 1 15 11169 1 1 13 LEU N N 3.711 5.870 -3.999 1.00 . A A . 13 LEU N 1 1 15 11170 1 1 13 LEU O O 0.608 4.727 -4.201 1.00 . A A . 13 LEU O 1 1 15 11171 1 1 14 TYR C C 0.791 3.640 -6.690 1.00 . A A . 14 TYR C 1 1 15 11172 1 1 14 TYR CA C 0.826 5.163 -6.889 1.00 . A A . 14 TYR CA 1 1 15 11173 1 1 14 TYR CB C 1.388 5.575 -8.313 1.00 . A A . 14 TYR CB 1 1 15 11174 1 1 14 TYR CD1 C 3.057 7.349 -7.777 1.00 . A A . 14 TYR CD1 1 1 15 11175 1 1 14 TYR CD2 C 3.863 5.314 -8.693 1.00 . A A . 14 TYR CD2 1 1 15 11176 1 1 14 TYR CE1 C 4.343 7.827 -7.709 1.00 . A A . 14 TYR CE1 1 1 15 11177 1 1 14 TYR CE2 C 5.152 5.796 -8.623 1.00 . A A . 14 TYR CE2 1 1 15 11178 1 1 14 TYR CG C 2.816 6.089 -8.269 1.00 . A A . 14 TYR CG 1 1 15 11179 1 1 14 TYR CZ C 5.392 7.055 -8.128 1.00 . A A . 14 TYR CZ 1 1 15 11180 1 1 14 TYR H H 2.332 6.490 -6.011 1.00 . A A . 14 TYR H 1 1 15 11181 1 1 14 TYR HA H -0.191 5.491 -6.817 1.00 . A A . 14 TYR HA 1 1 15 11182 1 1 14 TYR HB2 H 1.332 4.742 -8.998 1.00 . A A . 14 TYR HB2 1 1 15 11183 1 1 14 TYR HB3 H 0.756 6.366 -8.696 1.00 . A A . 14 TYR HB3 1 1 15 11184 1 1 14 TYR HD1 H 2.219 7.958 -7.451 1.00 . A A . 14 TYR HD1 1 1 15 11185 1 1 14 TYR HD2 H 3.674 4.324 -9.085 1.00 . A A . 14 TYR HD2 1 1 15 11186 1 1 14 TYR HE1 H 4.538 8.813 -7.321 1.00 . A A . 14 TYR HE1 1 1 15 11187 1 1 14 TYR HE2 H 5.965 5.166 -8.954 1.00 . A A . 14 TYR HE2 1 1 15 11188 1 1 14 TYR HH H 7.205 7.051 -8.644 1.00 . A A . 14 TYR HH 1 1 15 11189 1 1 14 TYR N N 1.634 5.835 -5.831 1.00 . A A . 14 TYR N 1 1 15 11190 1 1 14 TYR O O -0.262 3.071 -6.925 1.00 . A A . 14 TYR O 1 1 15 11191 1 1 14 TYR OH O 6.664 7.554 -8.030 1.00 . A A . 14 TYR OH 1 1 15 11192 1 1 15 GLN C C 0.510 1.190 -5.100 1.00 . A A . 15 GLN C 1 1 15 11193 1 1 15 GLN CA C 1.589 1.470 -6.134 1.00 . A A . 15 GLN CA 1 1 15 11194 1 1 15 GLN CB C 2.858 0.660 -5.711 1.00 . A A . 15 GLN CB 1 1 15 11195 1 1 15 GLN CD C 4.624 1.627 -7.206 1.00 . A A . 15 GLN CD 1 1 15 11196 1 1 15 GLN CG C 3.805 0.403 -6.936 1.00 . A A . 15 GLN CG 1 1 15 11197 1 1 15 GLN H H 2.721 3.382 -6.036 1.00 . A A . 15 GLN H 1 1 15 11198 1 1 15 GLN HA H 1.143 1.191 -7.048 1.00 . A A . 15 GLN HA 1 1 15 11199 1 1 15 GLN HB2 H 3.352 1.212 -4.928 1.00 . A A . 15 GLN HB2 1 1 15 11200 1 1 15 GLN HB3 H 2.552 -0.297 -5.307 1.00 . A A . 15 GLN HB3 1 1 15 11201 1 1 15 GLN HE21 H 6.339 0.744 -6.787 1.00 . A A . 15 GLN HE21 1 1 15 11202 1 1 15 GLN HE22 H 6.392 2.413 -7.142 1.00 . A A . 15 GLN HE22 1 1 15 11203 1 1 15 GLN HG2 H 4.479 -0.424 -6.760 1.00 . A A . 15 GLN HG2 1 1 15 11204 1 1 15 GLN HG3 H 3.235 0.199 -7.830 1.00 . A A . 15 GLN HG3 1 1 15 11205 1 1 15 GLN N N 1.846 2.958 -6.261 1.00 . A A . 15 GLN N 1 1 15 11206 1 1 15 GLN NE2 N 5.890 1.581 -7.030 1.00 . A A . 15 GLN NE2 1 1 15 11207 1 1 15 GLN O O -0.332 0.323 -5.217 1.00 . A A . 15 GLN O 1 1 15 11208 1 1 15 GLN OE1 O 4.124 2.661 -7.568 1.00 . A A . 15 GLN OE1 1 1 15 11209 1 1 16 LEU C C -1.762 2.319 -3.553 1.00 . A A . 16 LEU C 1 1 15 11210 1 1 16 LEU CA C -0.396 1.837 -2.990 1.00 . A A . 16 LEU CA 1 1 15 11211 1 1 16 LEU CB C 0.173 2.667 -1.792 1.00 . A A . 16 LEU CB 1 1 15 11212 1 1 16 LEU CD1 C 2.024 2.637 -0.048 1.00 . A A . 16 LEU CD1 1 1 15 11213 1 1 16 LEU CD2 C 1.561 0.553 -1.257 1.00 . A A . 16 LEU CD2 1 1 15 11214 1 1 16 LEU CG C 1.580 2.088 -1.396 1.00 . A A . 16 LEU CG 1 1 15 11215 1 1 16 LEU H H 1.292 2.616 -4.069 1.00 . A A . 16 LEU H 1 1 15 11216 1 1 16 LEU HA H -0.459 0.800 -2.769 1.00 . A A . 16 LEU HA 1 1 15 11217 1 1 16 LEU HB2 H 0.270 3.706 -2.085 1.00 . A A . 16 LEU HB2 1 1 15 11218 1 1 16 LEU HB3 H -0.507 2.624 -0.955 1.00 . A A . 16 LEU HB3 1 1 15 11219 1 1 16 LEU HD11 H 2.104 3.712 -0.078 1.00 . A A . 16 LEU HD11 1 1 15 11220 1 1 16 LEU HD12 H 1.324 2.357 0.724 1.00 . A A . 16 LEU HD12 1 1 15 11221 1 1 16 LEU HD13 H 2.992 2.226 0.214 1.00 . A A . 16 LEU HD13 1 1 15 11222 1 1 16 LEU HD21 H 0.821 0.250 -0.532 1.00 . A A . 16 LEU HD21 1 1 15 11223 1 1 16 LEU HD22 H 1.347 0.057 -2.192 1.00 . A A . 16 LEU HD22 1 1 15 11224 1 1 16 LEU HD23 H 2.525 0.202 -0.918 1.00 . A A . 16 LEU HD23 1 1 15 11225 1 1 16 LEU HG H 2.307 2.380 -2.148 1.00 . A A . 16 LEU HG 1 1 15 11226 1 1 16 LEU N N 0.581 1.967 -4.079 1.00 . A A . 16 LEU N 1 1 15 11227 1 1 16 LEU O O -2.799 1.757 -3.265 1.00 . A A . 16 LEU O 1 1 15 11228 1 1 17 GLU C C -3.755 2.720 -5.708 1.00 . A A . 17 GLU C 1 1 15 11229 1 1 17 GLU CA C -3.056 3.853 -4.945 1.00 . A A . 17 GLU CA 1 1 15 11230 1 1 17 GLU CB C -2.725 5.022 -5.875 1.00 . A A . 17 GLU CB 1 1 15 11231 1 1 17 GLU CD C -1.351 7.226 -5.837 1.00 . A A . 17 GLU CD 1 1 15 11232 1 1 17 GLU CG C -2.076 6.152 -5.014 1.00 . A A . 17 GLU CG 1 1 15 11233 1 1 17 GLU H H -0.883 3.758 -4.553 1.00 . A A . 17 GLU H 1 1 15 11234 1 1 17 GLU HA H -3.722 4.139 -4.159 1.00 . A A . 17 GLU HA 1 1 15 11235 1 1 17 GLU HB2 H -2.055 4.715 -6.663 1.00 . A A . 17 GLU HB2 1 1 15 11236 1 1 17 GLU HB3 H -3.622 5.414 -6.338 1.00 . A A . 17 GLU HB3 1 1 15 11237 1 1 17 GLU HG2 H -2.848 6.658 -4.461 1.00 . A A . 17 GLU HG2 1 1 15 11238 1 1 17 GLU HG3 H -1.381 5.750 -4.298 1.00 . A A . 17 GLU HG3 1 1 15 11239 1 1 17 GLU N N -1.757 3.340 -4.354 1.00 . A A . 17 GLU N 1 1 15 11240 1 1 17 GLU O O -4.925 2.425 -5.548 1.00 . A A . 17 GLU O 1 1 15 11241 1 1 17 GLU OE1 O -1.640 7.346 -7.014 1.00 . A A . 17 GLU OE1 1 1 15 11242 1 1 17 GLU OE2 O -0.523 7.866 -5.219 1.00 . A A . 17 GLU OE2 1 1 15 11243 1 1 18 ASN C C -4.338 -0.076 -6.625 1.00 . A A . 18 ASN C 1 1 15 11244 1 1 18 ASN CA C -3.449 0.954 -7.390 1.00 . A A . 18 ASN CA 1 1 15 11245 1 1 18 ASN CB C -2.184 0.310 -7.950 1.00 . A A . 18 ASN CB 1 1 15 11246 1 1 18 ASN CG C -1.456 1.197 -8.940 1.00 . A A . 18 ASN CG 1 1 15 11247 1 1 18 ASN H H -2.046 2.415 -6.611 1.00 . A A . 18 ASN H 1 1 15 11248 1 1 18 ASN HA H -4.074 1.336 -8.187 1.00 . A A . 18 ASN HA 1 1 15 11249 1 1 18 ASN HB2 H -1.503 0.134 -7.134 1.00 . A A . 18 ASN HB2 1 1 15 11250 1 1 18 ASN HB3 H -2.406 -0.622 -8.436 1.00 . A A . 18 ASN HB3 1 1 15 11251 1 1 18 ASN HD21 H -2.428 2.872 -8.546 1.00 . A A . 18 ASN HD21 1 1 15 11252 1 1 18 ASN HD22 H -1.217 2.932 -9.739 1.00 . A A . 18 ASN HD22 1 1 15 11253 1 1 18 ASN N N -2.979 2.102 -6.547 1.00 . A A . 18 ASN N 1 1 15 11254 1 1 18 ASN ND2 N -1.736 2.441 -9.077 1.00 . A A . 18 ASN ND2 1 1 15 11255 1 1 18 ASN O O -5.215 -0.686 -7.199 1.00 . A A . 18 ASN O 1 1 15 11256 1 1 18 ASN OD1 O -0.575 0.776 -9.645 1.00 . A A . 18 ASN OD1 1 1 15 11257 1 1 19 TYR C C -5.779 -0.513 -3.386 1.00 . A A . 19 TYR C 1 1 15 11258 1 1 19 TYR CA C -4.883 -1.213 -4.515 1.00 . A A . 19 TYR CA 1 1 15 11259 1 1 19 TYR CB C -3.831 -2.258 -3.863 1.00 . A A . 19 TYR CB 1 1 15 11260 1 1 19 TYR CD1 C -4.568 -2.071 -1.514 1.00 . A A . 19 TYR CD1 1 1 15 11261 1 1 19 TYR CD2 C -2.754 -0.722 -2.218 1.00 . A A . 19 TYR CD2 1 1 15 11262 1 1 19 TYR CE1 C -4.560 -1.462 -0.299 1.00 . A A . 19 TYR CE1 1 1 15 11263 1 1 19 TYR CE2 C -2.745 -0.109 -0.991 1.00 . A A . 19 TYR CE2 1 1 15 11264 1 1 19 TYR CG C -3.671 -1.693 -2.480 1.00 . A A . 19 TYR CG 1 1 15 11265 1 1 19 TYR CZ C -3.663 -0.487 -0.036 1.00 . A A . 19 TYR CZ 1 1 15 11266 1 1 19 TYR H H -3.359 0.282 -4.961 1.00 . A A . 19 TYR H 1 1 15 11267 1 1 19 TYR HA H -5.569 -1.759 -5.148 1.00 . A A . 19 TYR HA 1 1 15 11268 1 1 19 TYR HB2 H -4.218 -3.263 -3.812 1.00 . A A . 19 TYR HB2 1 1 15 11269 1 1 19 TYR HB3 H -2.880 -2.241 -4.378 1.00 . A A . 19 TYR HB3 1 1 15 11270 1 1 19 TYR HD1 H -5.277 -2.850 -1.729 1.00 . A A . 19 TYR HD1 1 1 15 11271 1 1 19 TYR HD2 H -2.040 -0.454 -2.983 1.00 . A A . 19 TYR HD2 1 1 15 11272 1 1 19 TYR HE1 H -5.262 -1.735 0.464 1.00 . A A . 19 TYR HE1 1 1 15 11273 1 1 19 TYR HE2 H -2.016 0.666 -0.810 1.00 . A A . 19 TYR HE2 1 1 15 11274 1 1 19 TYR HH H -2.864 0.214 1.495 1.00 . A A . 19 TYR HH 1 1 15 11275 1 1 19 TYR N N -4.086 -0.243 -5.353 1.00 . A A . 19 TYR N 1 1 15 11276 1 1 19 TYR O O -6.862 -0.977 -3.086 1.00 . A A . 19 TYR O 1 1 15 11277 1 1 19 TYR OH O -3.766 0.099 1.191 1.00 . A A . 19 TYR OH 1 1 15 11278 1 1 20 CYS C C -7.510 1.812 -2.103 1.00 . A A . 20 CYS C 1 1 15 11279 1 1 20 CYS CA C -6.109 1.275 -1.673 1.00 . A A . 20 CYS CA 1 1 15 11280 1 1 20 CYS CB C -5.154 2.417 -1.105 1.00 . A A . 20 CYS CB 1 1 15 11281 1 1 20 CYS H H -4.441 0.901 -3.009 1.00 . A A . 20 CYS H 1 1 15 11282 1 1 20 CYS HA H -6.255 0.673 -0.796 1.00 . A A . 20 CYS HA 1 1 15 11283 1 1 20 CYS HB2 H -4.116 2.103 -1.124 1.00 . A A . 20 CYS HB2 1 1 15 11284 1 1 20 CYS HB3 H -5.219 3.341 -1.652 1.00 . A A . 20 CYS HB3 1 1 15 11285 1 1 20 CYS HG H -4.957 2.166 1.107 1.00 . A A . 20 CYS HG 1 1 15 11286 1 1 20 CYS N N -5.323 0.559 -2.762 1.00 . A A . 20 CYS N 1 1 15 11287 1 1 20 CYS O O -8.127 2.608 -1.440 1.00 . A A . 20 CYS O 1 1 15 11288 1 1 20 CYS SG S -5.447 2.839 0.629 1.00 . A A . 20 CYS SG 1 1 15 11289 1 1 21 ASN C C -10.343 0.553 -3.581 1.00 . A A . 21 ASN C 1 1 15 11290 1 1 21 ASN CA C -9.321 1.719 -3.772 1.00 . A A . 21 ASN CA 1 1 15 11291 1 1 21 ASN CB C -9.028 2.064 -5.252 1.00 . A A . 21 ASN CB 1 1 15 11292 1 1 21 ASN CG C -8.449 0.865 -5.948 1.00 . A A . 21 ASN CG 1 1 15 11293 1 1 21 ASN H H -7.477 0.685 -3.679 1.00 . A A . 21 ASN H 1 1 15 11294 1 1 21 ASN HA H -9.699 2.583 -3.258 1.00 . A A . 21 ASN HA 1 1 15 11295 1 1 21 ASN HB2 H -9.928 2.329 -5.780 1.00 . A A . 21 ASN HB2 1 1 15 11296 1 1 21 ASN HB3 H -8.323 2.878 -5.322 1.00 . A A . 21 ASN HB3 1 1 15 11297 1 1 21 ASN HD21 H -6.554 1.472 -5.907 1.00 . A A . 21 ASN HD21 1 1 15 11298 1 1 21 ASN HD22 H -6.897 -0.028 -6.635 1.00 . A A . 21 ASN HD22 1 1 15 11299 1 1 21 ASN N N -8.002 1.334 -3.199 1.00 . A A . 21 ASN N 1 1 15 11300 1 1 21 ASN ND2 N -7.192 0.782 -6.172 1.00 . A A . 21 ASN ND2 1 1 15 11301 1 1 21 ASN O O -10.560 0.118 -2.452 1.00 . A A . 21 ASN O 1 1 15 11302 1 1 21 ASN OD1 O -9.134 -0.057 -6.309 1.00 . A A . 21 ASN OD1 1 1 15 11303 2 2 1 PHE C C 8.202 7.880 1.108 1.00 . B B . 1 PHE C 1 1 15 11304 2 2 1 PHE CA C 7.775 9.373 0.998 1.00 . B B . 1 PHE CA 1 1 15 11305 2 2 1 PHE CB C 8.170 10.038 -0.357 1.00 . B B . 1 PHE CB 1 1 15 11306 2 2 1 PHE CD1 C 6.183 10.110 -1.923 1.00 . B B . 1 PHE CD1 1 1 15 11307 2 2 1 PHE CD2 C 7.802 8.425 -2.297 1.00 . B B . 1 PHE CD2 1 1 15 11308 2 2 1 PHE CE1 C 5.451 9.652 -2.999 1.00 . B B . 1 PHE CE1 1 1 15 11309 2 2 1 PHE CE2 C 7.077 7.958 -3.377 1.00 . B B . 1 PHE CE2 1 1 15 11310 2 2 1 PHE CG C 7.365 9.503 -1.560 1.00 . B B . 1 PHE CG 1 1 15 11311 2 2 1 PHE CZ C 5.899 8.574 -3.731 1.00 . B B . 1 PHE CZ 1 1 15 11312 2 2 1 PHE HA H 6.706 9.419 1.147 1.00 . B B . 1 PHE HA 1 1 15 11313 2 2 1 PHE HB2 H 8.022 11.105 -0.288 1.00 . B B . 1 PHE HB2 1 1 15 11314 2 2 1 PHE HB3 H 9.221 9.863 -0.544 1.00 . B B . 1 PHE HB3 1 1 15 11315 2 2 1 PHE HD1 H 5.825 10.957 -1.353 1.00 . B B . 1 PHE HD1 1 1 15 11316 2 2 1 PHE HD2 H 8.730 7.945 -2.023 1.00 . B B . 1 PHE HD2 1 1 15 11317 2 2 1 PHE HE1 H 4.526 10.146 -3.269 1.00 . B B . 1 PHE HE1 1 1 15 11318 2 2 1 PHE HE2 H 7.436 7.109 -3.945 1.00 . B B . 1 PHE HE2 1 1 15 11319 2 2 1 PHE HZ H 5.333 8.221 -4.581 1.00 . B B . 1 PHE HZ 1 1 15 11320 2 2 1 PHE N N 8.444 10.199 2.056 1.00 . B B . 1 PHE N 1 1 15 11321 2 2 1 PHE O O 8.942 7.502 1.994 1.00 . B B . 1 PHE O 1 1 15 11322 2 2 2 VAL C C 9.003 5.272 -0.999 1.00 . B B . 2 VAL C 1 1 15 11323 2 2 2 VAL CA C 8.010 5.629 0.142 1.00 . B B . 2 VAL CA 1 1 15 11324 2 2 2 VAL CB C 6.619 4.904 -0.006 1.00 . B B . 2 VAL CB 1 1 15 11325 2 2 2 VAL CG1 C 5.740 5.233 1.214 1.00 . B B . 2 VAL CG1 1 1 15 11326 2 2 2 VAL CG2 C 5.871 5.438 -1.233 1.00 . B B . 2 VAL CG2 1 1 15 11327 2 2 2 VAL H H 7.141 7.419 -0.470 1.00 . B B . 2 VAL H 1 1 15 11328 2 2 2 VAL HA H 8.457 5.357 1.051 1.00 . B B . 2 VAL HA 1 1 15 11329 2 2 2 VAL HB H 6.755 3.826 -0.051 1.00 . B B . 2 VAL HB 1 1 15 11330 2 2 2 VAL HG11 H 6.225 4.903 2.122 1.00 . B B . 2 VAL HG11 1 1 15 11331 2 2 2 VAL HG12 H 5.570 6.298 1.291 1.00 . B B . 2 VAL HG12 1 1 15 11332 2 2 2 VAL HG13 H 4.785 4.736 1.135 1.00 . B B . 2 VAL HG13 1 1 15 11333 2 2 2 VAL HG21 H 6.496 5.299 -2.097 1.00 . B B . 2 VAL HG21 1 1 15 11334 2 2 2 VAL HG22 H 4.945 4.896 -1.365 1.00 . B B . 2 VAL HG22 1 1 15 11335 2 2 2 VAL HG23 H 5.643 6.490 -1.136 1.00 . B B . 2 VAL HG23 1 1 15 11336 2 2 2 VAL N N 7.722 7.081 0.206 1.00 . B B . 2 VAL N 1 1 15 11337 2 2 2 VAL O O 9.838 6.077 -1.356 1.00 . B B . 2 VAL O 1 1 15 11338 2 2 3 ASN C C 10.630 2.263 -2.172 1.00 . B B . 3 ASN C 1 1 15 11339 2 2 3 ASN CA C 9.692 3.426 -2.624 1.00 . B B . 3 ASN CA 1 1 15 11340 2 2 3 ASN CB C 10.581 4.484 -3.366 1.00 . B B . 3 ASN CB 1 1 15 11341 2 2 3 ASN CG C 9.745 5.508 -4.096 1.00 . B B . 3 ASN CG 1 1 15 11342 2 2 3 ASN H H 8.166 3.579 -1.062 1.00 . B B . 3 ASN H 1 1 15 11343 2 2 3 ASN HA H 9.003 2.998 -3.340 1.00 . B B . 3 ASN HA 1 1 15 11344 2 2 3 ASN HB2 H 11.243 4.985 -2.680 1.00 . B B . 3 ASN HB2 1 1 15 11345 2 2 3 ASN HB3 H 11.181 3.984 -4.107 1.00 . B B . 3 ASN HB3 1 1 15 11346 2 2 3 ASN HD21 H 10.547 7.048 -3.206 1.00 . B B . 3 ASN HD21 1 1 15 11347 2 2 3 ASN HD22 H 9.371 7.388 -4.399 1.00 . B B . 3 ASN HD22 1 1 15 11348 2 2 3 ASN N N 8.881 4.075 -1.501 1.00 . B B . 3 ASN N 1 1 15 11349 2 2 3 ASN ND2 N 9.903 6.760 -3.880 1.00 . B B . 3 ASN ND2 1 1 15 11350 2 2 3 ASN O O 11.803 2.210 -2.483 1.00 . B B . 3 ASN O 1 1 15 11351 2 2 3 ASN OD1 O 8.906 5.199 -4.904 1.00 . B B . 3 ASN OD1 1 1 15 11352 2 2 4 GLN C C 9.865 -0.964 -0.550 1.00 . B B . 4 GLN C 1 1 15 11353 2 2 4 GLN CA C 10.858 0.167 -0.914 1.00 . B B . 4 GLN CA 1 1 15 11354 2 2 4 GLN CB C 11.730 0.647 0.321 1.00 . B B . 4 GLN CB 1 1 15 11355 2 2 4 GLN CD C 10.451 2.779 0.861 1.00 . B B . 4 GLN CD 1 1 15 11356 2 2 4 GLN CG C 10.850 1.407 1.369 1.00 . B B . 4 GLN CG 1 1 15 11357 2 2 4 GLN H H 9.151 1.416 -1.179 1.00 . B B . 4 GLN H 1 1 15 11358 2 2 4 GLN HA H 11.500 -0.212 -1.695 1.00 . B B . 4 GLN HA 1 1 15 11359 2 2 4 GLN HB2 H 12.232 -0.188 0.790 1.00 . B B . 4 GLN HB2 1 1 15 11360 2 2 4 GLN HB3 H 12.513 1.290 -0.061 1.00 . B B . 4 GLN HB3 1 1 15 11361 2 2 4 GLN HE21 H 12.089 3.086 -0.202 1.00 . B B . 4 GLN HE21 1 1 15 11362 2 2 4 GLN HE22 H 10.939 4.337 -0.187 1.00 . B B . 4 GLN HE22 1 1 15 11363 2 2 4 GLN HG2 H 9.938 0.869 1.578 1.00 . B B . 4 GLN HG2 1 1 15 11364 2 2 4 GLN HG3 H 11.377 1.556 2.298 1.00 . B B . 4 GLN HG3 1 1 15 11365 2 2 4 GLN N N 10.093 1.346 -1.424 1.00 . B B . 4 GLN N 1 1 15 11366 2 2 4 GLN NE2 N 11.235 3.449 0.092 1.00 . B B . 4 GLN NE2 1 1 15 11367 2 2 4 GLN O O 8.794 -1.042 -1.119 1.00 . B B . 4 GLN O 1 1 15 11368 2 2 4 GLN OE1 O 9.400 3.286 1.154 1.00 . B B . 4 GLN OE1 1 1 15 11369 2 2 5 HIS C C 8.827 -2.598 2.271 1.00 . B B . 5 HIS C 1 1 15 11370 2 2 5 HIS CA C 9.503 -2.926 0.909 1.00 . B B . 5 HIS CA 1 1 15 11371 2 2 5 HIS CB C 10.487 -4.120 1.065 1.00 . B B . 5 HIS CB 1 1 15 11372 2 2 5 HIS CD2 C 12.898 -4.149 0.015 1.00 . B B . 5 HIS CD2 1 1 15 11373 2 2 5 HIS CE1 C 12.369 -4.151 -1.983 1.00 . B B . 5 HIS CE1 1 1 15 11374 2 2 5 HIS CG C 11.522 -4.135 -0.050 1.00 . B B . 5 HIS CG 1 1 15 11375 2 2 5 HIS H H 11.141 -1.559 0.763 1.00 . B B . 5 HIS H 1 1 15 11376 2 2 5 HIS HA H 8.742 -3.196 0.195 1.00 . B B . 5 HIS HA 1 1 15 11377 2 2 5 HIS HB2 H 11.003 -4.072 2.012 1.00 . B B . 5 HIS HB2 1 1 15 11378 2 2 5 HIS HB3 H 9.940 -5.052 1.022 1.00 . B B . 5 HIS HB3 1 1 15 11379 2 2 5 HIS HD1 H 10.352 -4.130 -1.696 1.00 . B B . 5 HIS HD1 1 1 15 11380 2 2 5 HIS HD2 H 13.466 -4.154 0.931 1.00 . B B . 5 HIS HD2 1 1 15 11381 2 2 5 HIS HE1 H 12.431 -4.160 -3.064 1.00 . B B . 5 HIS HE1 1 1 15 11382 2 2 5 HIS N N 10.276 -1.757 0.387 1.00 . B B . 5 HIS N 1 1 15 11383 2 2 5 HIS ND1 N 11.260 -4.138 -1.306 1.00 . B B . 5 HIS ND1 1 1 15 11384 2 2 5 HIS NE2 N 13.414 -4.159 -1.197 1.00 . B B . 5 HIS NE2 1 1 15 11385 2 2 5 HIS O O 9.427 -2.665 3.327 1.00 . B B . 5 HIS O 1 1 15 11386 2 2 6 LEU C C 5.740 -3.007 3.610 1.00 . B B . 6 LEU C 1 1 15 11387 2 2 6 LEU CA C 6.795 -1.896 3.445 1.00 . B B . 6 LEU CA 1 1 15 11388 2 2 6 LEU CB C 6.116 -0.513 3.244 1.00 . B B . 6 LEU CB 1 1 15 11389 2 2 6 LEU CD1 C 6.418 1.830 2.468 1.00 . B B . 6 LEU CD1 1 1 15 11390 2 2 6 LEU CD2 C 8.202 0.773 3.799 1.00 . B B . 6 LEU CD2 1 1 15 11391 2 2 6 LEU CG C 7.128 0.511 2.749 1.00 . B B . 6 LEU CG 1 1 15 11392 2 2 6 LEU H H 7.191 -2.226 1.309 1.00 . B B . 6 LEU H 1 1 15 11393 2 2 6 LEU HA H 7.439 -1.898 4.312 1.00 . B B . 6 LEU HA 1 1 15 11394 2 2 6 LEU HB2 H 5.325 -0.607 2.518 1.00 . B B . 6 LEU HB2 1 1 15 11395 2 2 6 LEU HB3 H 5.686 -0.163 4.172 1.00 . B B . 6 LEU HB3 1 1 15 11396 2 2 6 LEU HD11 H 5.945 2.209 3.362 1.00 . B B . 6 LEU HD11 1 1 15 11397 2 2 6 LEU HD12 H 7.132 2.565 2.120 1.00 . B B . 6 LEU HD12 1 1 15 11398 2 2 6 LEU HD13 H 5.666 1.699 1.705 1.00 . B B . 6 LEU HD13 1 1 15 11399 2 2 6 LEU HD21 H 7.760 1.117 4.719 1.00 . B B . 6 LEU HD21 1 1 15 11400 2 2 6 LEU HD22 H 8.774 -0.121 4.005 1.00 . B B . 6 LEU HD22 1 1 15 11401 2 2 6 LEU HD23 H 8.880 1.538 3.449 1.00 . B B . 6 LEU HD23 1 1 15 11402 2 2 6 LEU HG H 7.567 0.106 1.852 1.00 . B B . 6 LEU HG 1 1 15 11403 2 2 6 LEU N N 7.584 -2.243 2.205 1.00 . B B . 6 LEU N 1 1 15 11404 2 2 6 LEU O O 5.242 -3.515 2.631 1.00 . B B . 6 LEU O 1 1 15 11405 2 2 7 CYS C C 3.157 -4.227 5.944 1.00 . B B . 7 CYS C 1 1 15 11406 2 2 7 CYS CA C 4.371 -4.463 4.999 1.00 . B B . 7 CYS CA 1 1 15 11407 2 2 7 CYS CB C 5.195 -5.699 5.430 1.00 . B B . 7 CYS CB 1 1 15 11408 2 2 7 CYS H H 5.836 -2.886 5.549 1.00 . B B . 7 CYS H 1 1 15 11409 2 2 7 CYS HA H 3.932 -4.704 4.040 1.00 . B B . 7 CYS HA 1 1 15 11410 2 2 7 CYS HB2 H 6.154 -5.659 4.927 1.00 . B B . 7 CYS HB2 1 1 15 11411 2 2 7 CYS HB3 H 5.387 -5.674 6.492 1.00 . B B . 7 CYS HB3 1 1 15 11412 2 2 7 CYS HG H 3.894 -7.574 5.751 1.00 . B B . 7 CYS HG 1 1 15 11413 2 2 7 CYS N N 5.399 -3.362 4.817 1.00 . B B . 7 CYS N 1 1 15 11414 2 2 7 CYS O O 2.013 -4.347 5.552 1.00 . B B . 7 CYS O 1 1 15 11415 2 2 7 CYS SG S 4.479 -7.315 5.035 1.00 . B B . 7 CYS SG 1 1 15 11416 2 2 8 GLY C C 2.136 -2.174 8.443 1.00 . B B . 8 GLY C 1 1 15 11417 2 2 8 GLY CA C 2.305 -3.651 8.180 1.00 . B B . 8 GLY CA 1 1 15 11418 2 2 8 GLY H H 4.355 -3.821 7.453 1.00 . B B . 8 GLY H 1 1 15 11419 2 2 8 GLY HA2 H 1.360 -4.023 7.829 1.00 . B B . 8 GLY HA2 1 1 15 11420 2 2 8 GLY HA3 H 2.565 -4.109 9.123 1.00 . B B . 8 GLY HA3 1 1 15 11421 2 2 8 GLY N N 3.420 -3.902 7.178 1.00 . B B . 8 GLY N 1 1 15 11422 2 2 8 GLY O O 1.910 -1.402 7.536 1.00 . B B . 8 GLY O 1 1 15 11423 2 2 9 ASP C C 2.730 0.584 9.101 1.00 . B B . 9 ASP C 1 1 15 11424 2 2 9 ASP CA C 2.116 -0.415 10.148 1.00 . B B . 9 ASP CA 1 1 15 11425 2 2 9 ASP CB C 2.836 -0.473 11.533 1.00 . B B . 9 ASP CB 1 1 15 11426 2 2 9 ASP CG C 4.160 -1.212 11.406 1.00 . B B . 9 ASP CG 1 1 15 11427 2 2 9 ASP H H 2.414 -2.502 10.359 1.00 . B B . 9 ASP H 1 1 15 11428 2 2 9 ASP HA H 1.065 -0.169 10.251 1.00 . B B . 9 ASP HA 1 1 15 11429 2 2 9 ASP HB2 H 3.046 0.519 11.897 1.00 . B B . 9 ASP HB2 1 1 15 11430 2 2 9 ASP HB3 H 2.245 -0.996 12.265 1.00 . B B . 9 ASP HB3 1 1 15 11431 2 2 9 ASP N N 2.235 -1.822 9.675 1.00 . B B . 9 ASP N 1 1 15 11432 2 2 9 ASP O O 2.080 1.361 8.431 1.00 . B B . 9 ASP O 1 1 15 11433 2 2 9 ASP OD1 O 4.092 -2.425 11.373 1.00 . B B . 9 ASP OD1 1 1 15 11434 2 2 9 ASP OD2 O 5.152 -0.523 11.325 1.00 . B B . 9 ASP OD2 1 1 15 11435 2 2 10 HIS C C 4.291 1.433 6.588 1.00 . B B . 10 HIS C 1 1 15 11436 2 2 10 HIS CA C 4.836 1.330 8.045 1.00 . B B . 10 HIS CA 1 1 15 11437 2 2 10 HIS CB C 6.229 0.716 8.125 1.00 . B B . 10 HIS CB 1 1 15 11438 2 2 10 HIS CD2 C 8.544 1.948 8.221 1.00 . B B . 10 HIS CD2 1 1 15 11439 2 2 10 HIS CE1 C 8.366 3.126 6.532 1.00 . B B . 10 HIS CE1 1 1 15 11440 2 2 10 HIS CG C 7.313 1.681 7.664 1.00 . B B . 10 HIS CG 1 1 15 11441 2 2 10 HIS H H 4.430 -0.202 9.548 1.00 . B B . 10 HIS H 1 1 15 11442 2 2 10 HIS HA H 4.822 2.342 8.434 1.00 . B B . 10 HIS HA 1 1 15 11443 2 2 10 HIS HB2 H 6.413 0.457 9.162 1.00 . B B . 10 HIS HB2 1 1 15 11444 2 2 10 HIS HB3 H 6.265 -0.181 7.532 1.00 . B B . 10 HIS HB3 1 1 15 11445 2 2 10 HIS HD1 H 6.502 2.493 6.007 1.00 . B B . 10 HIS HD1 1 1 15 11446 2 2 10 HIS HD2 H 8.923 1.485 9.117 1.00 . B B . 10 HIS HD2 1 1 15 11447 2 2 10 HIS HE1 H 8.587 3.838 5.747 1.00 . B B . 10 HIS HE1 1 1 15 11448 2 2 10 HIS N N 4.014 0.484 8.978 1.00 . B B . 10 HIS N 1 1 15 11449 2 2 10 HIS ND1 N 7.267 2.441 6.627 1.00 . B B . 10 HIS ND1 1 1 15 11450 2 2 10 HIS NE2 N 9.189 2.847 7.507 1.00 . B B . 10 HIS NE2 1 1 15 11451 2 2 10 HIS O O 4.726 2.233 5.783 1.00 . B B . 10 HIS O 1 1 15 11452 2 2 11 LEU C C 1.308 1.200 5.125 1.00 . B B . 11 LEU C 1 1 15 11453 2 2 11 LEU CA C 2.694 0.548 4.944 1.00 . B B . 11 LEU CA 1 1 15 11454 2 2 11 LEU CB C 2.632 -0.927 4.530 1.00 . B B . 11 LEU CB 1 1 15 11455 2 2 11 LEU CD1 C 2.285 0.016 2.197 1.00 . B B . 11 LEU CD1 1 1 15 11456 2 2 11 LEU CD2 C 2.252 -2.404 2.617 1.00 . B B . 11 LEU CD2 1 1 15 11457 2 2 11 LEU CG C 1.875 -1.071 3.210 1.00 . B B . 11 LEU CG 1 1 15 11458 2 2 11 LEU H H 3.052 -0.019 6.983 1.00 . B B . 11 LEU H 1 1 15 11459 2 2 11 LEU HA H 3.239 1.089 4.187 1.00 . B B . 11 LEU HA 1 1 15 11460 2 2 11 LEU HB2 H 3.635 -1.309 4.423 1.00 . B B . 11 LEU HB2 1 1 15 11461 2 2 11 LEU HB3 H 2.126 -1.517 5.280 1.00 . B B . 11 LEU HB3 1 1 15 11462 2 2 11 LEU HD11 H 3.352 0.031 2.060 1.00 . B B . 11 LEU HD11 1 1 15 11463 2 2 11 LEU HD12 H 1.822 -0.169 1.244 1.00 . B B . 11 LEU HD12 1 1 15 11464 2 2 11 LEU HD13 H 1.980 0.998 2.524 1.00 . B B . 11 LEU HD13 1 1 15 11465 2 2 11 LEU HD21 H 1.993 -3.204 3.293 1.00 . B B . 11 LEU HD21 1 1 15 11466 2 2 11 LEU HD22 H 1.738 -2.560 1.688 1.00 . B B . 11 LEU HD22 1 1 15 11467 2 2 11 LEU HD23 H 3.309 -2.433 2.421 1.00 . B B . 11 LEU HD23 1 1 15 11468 2 2 11 LEU HG H 0.815 -1.040 3.413 1.00 . B B . 11 LEU HG 1 1 15 11469 2 2 11 LEU N N 3.347 0.598 6.285 1.00 . B B . 11 LEU N 1 1 15 11470 2 2 11 LEU O O 0.956 2.130 4.420 1.00 . B B . 11 LEU O 1 1 15 11471 2 2 12 VAL C C -0.730 2.851 6.466 1.00 . B B . 12 VAL C 1 1 15 11472 2 2 12 VAL CA C -0.819 1.324 6.292 1.00 . B B . 12 VAL CA 1 1 15 11473 2 2 12 VAL CB C -1.504 0.675 7.521 1.00 . B B . 12 VAL CB 1 1 15 11474 2 2 12 VAL CG1 C -0.642 0.778 8.737 1.00 . B B . 12 VAL CG1 1 1 15 11475 2 2 12 VAL CG2 C -2.789 1.449 7.807 1.00 . B B . 12 VAL CG2 1 1 15 11476 2 2 12 VAL H H 0.893 -0.027 6.606 1.00 . B B . 12 VAL H 1 1 15 11477 2 2 12 VAL HA H -1.461 1.144 5.468 1.00 . B B . 12 VAL HA 1 1 15 11478 2 2 12 VAL HB H -1.720 -0.362 7.279 1.00 . B B . 12 VAL HB 1 1 15 11479 2 2 12 VAL HG11 H -0.360 1.801 8.964 1.00 . B B . 12 VAL HG11 1 1 15 11480 2 2 12 VAL HG12 H -1.117 0.360 9.607 1.00 . B B . 12 VAL HG12 1 1 15 11481 2 2 12 VAL HG13 H 0.242 0.213 8.516 1.00 . B B . 12 VAL HG13 1 1 15 11482 2 2 12 VAL HG21 H -3.442 1.453 6.946 1.00 . B B . 12 VAL HG21 1 1 15 11483 2 2 12 VAL HG22 H -3.306 1.037 8.658 1.00 . B B . 12 VAL HG22 1 1 15 11484 2 2 12 VAL HG23 H -2.531 2.475 8.036 1.00 . B B . 12 VAL HG23 1 1 15 11485 2 2 12 VAL N N 0.543 0.716 6.069 1.00 . B B . 12 VAL N 1 1 15 11486 2 2 12 VAL O O -1.586 3.526 5.917 1.00 . B B . 12 VAL O 1 1 15 11487 2 2 13 GLU C C 0.069 5.623 6.125 1.00 . B B . 13 GLU C 1 1 15 11488 2 2 13 GLU CA C 0.427 4.819 7.408 1.00 . B B . 13 GLU CA 1 1 15 11489 2 2 13 GLU CB C 1.899 5.061 7.839 1.00 . B B . 13 GLU CB 1 1 15 11490 2 2 13 GLU CD C 1.202 4.946 10.335 1.00 . B B . 13 GLU CD 1 1 15 11491 2 2 13 GLU CG C 2.150 4.425 9.264 1.00 . B B . 13 GLU CG 1 1 15 11492 2 2 13 GLU H H 0.886 2.711 7.619 1.00 . B B . 13 GLU H 1 1 15 11493 2 2 13 GLU HA H -0.226 5.148 8.199 1.00 . B B . 13 GLU HA 1 1 15 11494 2 2 13 GLU HB2 H 2.579 4.637 7.115 1.00 . B B . 13 GLU HB2 1 1 15 11495 2 2 13 GLU HB3 H 2.075 6.128 7.906 1.00 . B B . 13 GLU HB3 1 1 15 11496 2 2 13 GLU HG2 H 2.042 3.360 9.258 1.00 . B B . 13 GLU HG2 1 1 15 11497 2 2 13 GLU HG3 H 3.142 4.657 9.610 1.00 . B B . 13 GLU HG3 1 1 15 11498 2 2 13 GLU N N 0.249 3.332 7.194 1.00 . B B . 13 GLU N 1 1 15 11499 2 2 13 GLU O O -0.453 6.722 6.131 1.00 . B B . 13 GLU O 1 1 15 11500 2 2 13 GLU OE1 O 1.319 6.121 10.619 1.00 . B B . 13 GLU OE1 1 1 15 11501 2 2 13 GLU OE2 O 0.412 4.146 10.805 1.00 . B B . 13 GLU OE2 1 1 15 11502 2 2 14 ALA C C -1.367 5.343 3.320 1.00 . B B . 14 ALA C 1 1 15 11503 2 2 14 ALA CA C 0.110 5.599 3.679 1.00 . B B . 14 ALA CA 1 1 15 11504 2 2 14 ALA CB C 1.129 4.922 2.708 1.00 . B B . 14 ALA CB 1 1 15 11505 2 2 14 ALA H H 0.788 4.112 5.097 1.00 . B B . 14 ALA H 1 1 15 11506 2 2 14 ALA HA H 0.189 6.662 3.782 1.00 . B B . 14 ALA HA 1 1 15 11507 2 2 14 ALA HB1 H 2.140 5.110 3.040 1.00 . B B . 14 ALA HB1 1 1 15 11508 2 2 14 ALA HB2 H 0.985 3.850 2.699 1.00 . B B . 14 ALA HB2 1 1 15 11509 2 2 14 ALA HB3 H 1.022 5.290 1.699 1.00 . B B . 14 ALA HB3 1 1 15 11510 2 2 14 ALA N N 0.377 4.997 5.016 1.00 . B B . 14 ALA N 1 1 15 11511 2 2 14 ALA O O -2.147 6.260 3.148 1.00 . B B . 14 ALA O 1 1 15 11512 2 2 15 LEU C C -4.102 4.551 3.501 1.00 . B B . 15 LEU C 1 1 15 11513 2 2 15 LEU CA C -3.058 3.592 2.878 1.00 . B B . 15 LEU CA 1 1 15 11514 2 2 15 LEU CB C -3.124 2.146 3.433 1.00 . B B . 15 LEU CB 1 1 15 11515 2 2 15 LEU CD1 C -2.019 -0.185 3.422 1.00 . B B . 15 LEU CD1 1 1 15 11516 2 2 15 LEU CD2 C -1.339 1.616 1.613 1.00 . B B . 15 LEU CD2 1 1 15 11517 2 2 15 LEU CG C -1.860 1.319 3.041 1.00 . B B . 15 LEU CG 1 1 15 11518 2 2 15 LEU H H -0.985 3.428 3.325 1.00 . B B . 15 LEU H 1 1 15 11519 2 2 15 LEU HA H -3.209 3.592 1.810 1.00 . B B . 15 LEU HA 1 1 15 11520 2 2 15 LEU HB2 H -3.207 2.184 4.510 1.00 . B B . 15 LEU HB2 1 1 15 11521 2 2 15 LEU HB3 H -4.010 1.669 3.045 1.00 . B B . 15 LEU HB3 1 1 15 11522 2 2 15 LEU HD11 H -2.196 -0.303 4.478 1.00 . B B . 15 LEU HD11 1 1 15 11523 2 2 15 LEU HD12 H -2.830 -0.710 2.951 1.00 . B B . 15 LEU HD12 1 1 15 11524 2 2 15 LEU HD13 H -1.114 -0.715 3.203 1.00 . B B . 15 LEU HD13 1 1 15 11525 2 2 15 LEU HD21 H -2.125 1.602 0.882 1.00 . B B . 15 LEU HD21 1 1 15 11526 2 2 15 LEU HD22 H -0.923 2.611 1.567 1.00 . B B . 15 LEU HD22 1 1 15 11527 2 2 15 LEU HD23 H -0.552 0.933 1.331 1.00 . B B . 15 LEU HD23 1 1 15 11528 2 2 15 LEU HG H -1.042 1.684 3.629 1.00 . B B . 15 LEU HG 1 1 15 11529 2 2 15 LEU N N -1.687 4.085 3.200 1.00 . B B . 15 LEU N 1 1 15 11530 2 2 15 LEU O O -4.985 4.999 2.803 1.00 . B B . 15 LEU O 1 1 15 11531 2 2 16 TYR C C -5.520 6.831 4.742 1.00 . B B . 16 TYR C 1 1 15 11532 2 2 16 TYR CA C -4.832 5.726 5.584 1.00 . B B . 16 TYR CA 1 1 15 11533 2 2 16 TYR CB C -3.978 6.407 6.681 1.00 . B B . 16 TYR CB 1 1 15 11534 2 2 16 TYR CD1 C -4.313 4.474 8.372 1.00 . B B . 16 TYR CD1 1 1 15 11535 2 2 16 TYR CD2 C -2.541 6.025 8.648 1.00 . B B . 16 TYR CD2 1 1 15 11536 2 2 16 TYR CE1 C -3.894 3.822 9.528 1.00 . B B . 16 TYR CE1 1 1 15 11537 2 2 16 TYR CE2 C -2.138 5.372 9.787 1.00 . B B . 16 TYR CE2 1 1 15 11538 2 2 16 TYR CG C -3.627 5.589 7.926 1.00 . B B . 16 TYR CG 1 1 15 11539 2 2 16 TYR CZ C -2.807 4.270 10.232 1.00 . B B . 16 TYR CZ 1 1 15 11540 2 2 16 TYR H H -3.170 4.370 5.214 1.00 . B B . 16 TYR H 1 1 15 11541 2 2 16 TYR HA H -5.628 5.149 6.028 1.00 . B B . 16 TYR HA 1 1 15 11542 2 2 16 TYR HB2 H -3.037 6.684 6.226 1.00 . B B . 16 TYR HB2 1 1 15 11543 2 2 16 TYR HB3 H -4.464 7.312 7.017 1.00 . B B . 16 TYR HB3 1 1 15 11544 2 2 16 TYR HD1 H -5.170 4.108 7.830 1.00 . B B . 16 TYR HD1 1 1 15 11545 2 2 16 TYR HD2 H -1.985 6.892 8.318 1.00 . B B . 16 TYR HD2 1 1 15 11546 2 2 16 TYR HE1 H -4.410 2.953 9.901 1.00 . B B . 16 TYR HE1 1 1 15 11547 2 2 16 TYR HE2 H -1.282 5.730 10.344 1.00 . B B . 16 TYR HE2 1 1 15 11548 2 2 16 TYR HH H -1.404 3.728 11.282 1.00 . B B . 16 TYR HH 1 1 15 11549 2 2 16 TYR N N -3.937 4.807 4.779 1.00 . B B . 16 TYR N 1 1 15 11550 2 2 16 TYR O O -6.723 7.007 4.775 1.00 . B B . 16 TYR O 1 1 15 11551 2 2 16 TYR OH O -2.373 3.617 11.358 1.00 . B B . 16 TYR OH 1 1 15 11552 2 2 17 LEU C C -5.044 8.215 1.647 1.00 . B B . 17 LEU C 1 1 15 11553 2 2 17 LEU CA C -5.102 8.640 3.125 1.00 . B B . 17 LEU CA 1 1 15 11554 2 2 17 LEU CB C -4.172 9.869 3.374 1.00 . B B . 17 LEU CB 1 1 15 11555 2 2 17 LEU CD1 C -3.084 9.733 5.628 1.00 . B B . 17 LEU CD1 1 1 15 11556 2 2 17 LEU CD2 C -4.095 11.857 4.889 1.00 . B B . 17 LEU CD2 1 1 15 11557 2 2 17 LEU CG C -4.248 10.338 4.845 1.00 . B B . 17 LEU CG 1 1 15 11558 2 2 17 LEU H H -3.733 7.257 4.069 1.00 . B B . 17 LEU H 1 1 15 11559 2 2 17 LEU HA H -6.132 8.901 3.332 1.00 . B B . 17 LEU HA 1 1 15 11560 2 2 17 LEU HB2 H -3.155 9.605 3.122 1.00 . B B . 17 LEU HB2 1 1 15 11561 2 2 17 LEU HB3 H -4.482 10.668 2.715 1.00 . B B . 17 LEU HB3 1 1 15 11562 2 2 17 LEU HD11 H -3.115 8.658 5.585 1.00 . B B . 17 LEU HD11 1 1 15 11563 2 2 17 LEU HD12 H -2.139 10.056 5.214 1.00 . B B . 17 LEU HD12 1 1 15 11564 2 2 17 LEU HD13 H -3.125 10.037 6.662 1.00 . B B . 17 LEU HD13 1 1 15 11565 2 2 17 LEU HD21 H -3.148 12.155 4.460 1.00 . B B . 17 LEU HD21 1 1 15 11566 2 2 17 LEU HD22 H -4.892 12.330 4.331 1.00 . B B . 17 LEU HD22 1 1 15 11567 2 2 17 LEU HD23 H -4.138 12.207 5.909 1.00 . B B . 17 LEU HD23 1 1 15 11568 2 2 17 LEU HG H -5.193 10.044 5.291 1.00 . B B . 17 LEU HG 1 1 15 11569 2 2 17 LEU N N -4.677 7.516 4.019 1.00 . B B . 17 LEU N 1 1 15 11570 2 2 17 LEU O O -5.901 8.607 0.884 1.00 . B B . 17 LEU O 1 1 15 11571 2 2 18 VAL C C -5.352 6.503 -0.661 1.00 . B B . 18 VAL C 1 1 15 11572 2 2 18 VAL CA C -3.958 6.996 -0.186 1.00 . B B . 18 VAL CA 1 1 15 11573 2 2 18 VAL CB C -2.904 5.863 -0.277 1.00 . B B . 18 VAL CB 1 1 15 11574 2 2 18 VAL CG1 C -2.890 5.292 -1.704 1.00 . B B . 18 VAL CG1 1 1 15 11575 2 2 18 VAL CG2 C -1.517 6.475 -0.070 1.00 . B B . 18 VAL CG2 1 1 15 11576 2 2 18 VAL H H -3.377 7.176 1.931 1.00 . B B . 18 VAL H 1 1 15 11577 2 2 18 VAL HA H -3.675 7.821 -0.822 1.00 . B B . 18 VAL HA 1 1 15 11578 2 2 18 VAL HB H -3.116 5.099 0.455 1.00 . B B . 18 VAL HB 1 1 15 11579 2 2 18 VAL HG11 H -3.856 4.900 -1.985 1.00 . B B . 18 VAL HG11 1 1 15 11580 2 2 18 VAL HG12 H -2.641 6.071 -2.414 1.00 . B B . 18 VAL HG12 1 1 15 11581 2 2 18 VAL HG13 H -2.159 4.506 -1.809 1.00 . B B . 18 VAL HG13 1 1 15 11582 2 2 18 VAL HG21 H -1.455 6.962 0.892 1.00 . B B . 18 VAL HG21 1 1 15 11583 2 2 18 VAL HG22 H -0.756 5.713 -0.132 1.00 . B B . 18 VAL HG22 1 1 15 11584 2 2 18 VAL HG23 H -1.324 7.210 -0.842 1.00 . B B . 18 VAL HG23 1 1 15 11585 2 2 18 VAL N N -4.049 7.450 1.264 1.00 . B B . 18 VAL N 1 1 15 11586 2 2 18 VAL O O -5.837 6.841 -1.721 1.00 . B B . 18 VAL O 1 1 15 11587 2 2 19 CYS C C -8.464 5.867 -0.655 1.00 . B B . 19 CYS C 1 1 15 11588 2 2 19 CYS CA C -7.260 5.078 -0.032 1.00 . B B . 19 CYS CA 1 1 15 11589 2 2 19 CYS CB C -7.617 4.501 1.366 1.00 . B B . 19 CYS CB 1 1 15 11590 2 2 19 CYS H H -5.461 5.417 0.988 1.00 . B B . 19 CYS H 1 1 15 11591 2 2 19 CYS HA H -7.091 4.273 -0.712 1.00 . B B . 19 CYS HA 1 1 15 11592 2 2 19 CYS HB2 H -7.205 5.199 2.078 1.00 . B B . 19 CYS HB2 1 1 15 11593 2 2 19 CYS HB3 H -8.681 4.498 1.467 1.00 . B B . 19 CYS HB3 1 1 15 11594 2 2 19 CYS HG H -7.557 2.208 1.484 1.00 . B B . 19 CYS HG 1 1 15 11595 2 2 19 CYS N N -5.923 5.682 0.171 1.00 . B B . 19 CYS N 1 1 15 11596 2 2 19 CYS O O -9.476 6.074 -0.007 1.00 . B B . 19 CYS O 1 1 15 11597 2 2 19 CYS SG S -6.983 2.879 1.861 1.00 . B B . 19 CYS SG 1 1 15 11598 2 2 20 GLY C C -10.043 5.878 -3.392 1.00 . B B . 20 GLY C 1 1 15 11599 2 2 20 GLY CA C -9.412 7.018 -2.606 1.00 . B B . 20 GLY CA 1 1 15 11600 2 2 20 GLY H H -7.549 6.106 -2.401 1.00 . B B . 20 GLY H 1 1 15 11601 2 2 20 GLY HA2 H -10.133 7.453 -1.932 1.00 . B B . 20 GLY HA2 1 1 15 11602 2 2 20 GLY HA3 H -9.000 7.744 -3.292 1.00 . B B . 20 GLY HA3 1 1 15 11603 2 2 20 GLY N N -8.348 6.275 -1.886 1.00 . B B . 20 GLY N 1 1 15 11604 2 2 20 GLY O O -9.568 4.759 -3.369 1.00 . B B . 20 GLY O 1 1 15 11605 2 2 21 GLU C C -11.915 3.831 -4.132 1.00 . B B . 21 GLU C 1 1 15 11606 2 2 21 GLU CA C -11.859 5.171 -4.917 1.00 . B B . 21 GLU CA 1 1 15 11607 2 2 21 GLU CB C -11.073 5.032 -6.188 1.00 . B B . 21 GLU CB 1 1 15 11608 2 2 21 GLU CD C -11.705 7.539 -6.476 1.00 . B B . 21 GLU CD 1 1 15 11609 2 2 21 GLU CG C -10.634 6.473 -6.707 1.00 . B B . 21 GLU CG 1 1 15 11610 2 2 21 GLU H H -11.290 7.133 -4.031 1.00 . B B . 21 GLU H 1 1 15 11611 2 2 21 GLU HA H -12.862 5.527 -5.112 1.00 . B B . 21 GLU HA 1 1 15 11612 2 2 21 GLU HB2 H -10.189 4.471 -5.897 1.00 . B B . 21 GLU HB2 1 1 15 11613 2 2 21 GLU HB3 H -11.646 4.446 -6.885 1.00 . B B . 21 GLU HB3 1 1 15 11614 2 2 21 GLU HG2 H -9.738 6.798 -6.197 1.00 . B B . 21 GLU HG2 1 1 15 11615 2 2 21 GLU HG3 H -10.430 6.460 -7.762 1.00 . B B . 21 GLU HG3 1 1 15 11616 2 2 21 GLU N N -11.079 6.186 -4.077 1.00 . B B . 21 GLU N 1 1 15 11617 2 2 21 GLU O O -11.868 2.713 -4.609 1.00 . B B . 21 GLU O 1 1 15 11618 2 2 21 GLU OE1 O -12.713 7.451 -7.146 1.00 . B B . 21 GLU OE1 1 1 15 11619 2 2 21 GLU OE2 O -11.433 8.366 -5.619 1.00 . B B . 21 GLU OE2 1 1 15 11620 2 2 22 ARG C C -13.191 2.145 -1.243 1.00 . B B . 22 ARG C 1 1 15 11621 2 2 22 ARG CA C -12.082 3.064 -1.816 1.00 . B B . 22 ARG CA 1 1 15 11622 2 2 22 ARG CB C -11.384 3.907 -0.730 1.00 . B B . 22 ARG CB 1 1 15 11623 2 2 22 ARG CD C -10.067 2.364 0.605 1.00 . B B . 22 ARG CD 1 1 15 11624 2 2 22 ARG CG C -11.260 3.287 0.660 1.00 . B B . 22 ARG CG 1 1 15 11625 2 2 22 ARG CZ C -10.285 2.315 3.051 1.00 . B B . 22 ARG CZ 1 1 15 11626 2 2 22 ARG H H -12.101 4.983 -2.599 1.00 . B B . 22 ARG H 1 1 15 11627 2 2 22 ARG HA H -11.320 2.397 -2.151 1.00 . B B . 22 ARG HA 1 1 15 11628 2 2 22 ARG HB2 H -10.388 4.098 -1.123 1.00 . B B . 22 ARG HB2 1 1 15 11629 2 2 22 ARG HB3 H -11.867 4.867 -0.650 1.00 . B B . 22 ARG HB3 1 1 15 11630 2 2 22 ARG HD2 H -10.170 1.589 -0.152 1.00 . B B . 22 ARG HD2 1 1 15 11631 2 2 22 ARG HD3 H -9.264 2.999 0.251 1.00 . B B . 22 ARG HD3 1 1 15 11632 2 2 22 ARG HE H -9.126 1.112 2.154 1.00 . B B . 22 ARG HE 1 1 15 11633 2 2 22 ARG HG2 H -11.083 4.097 1.357 1.00 . B B . 22 ARG HG2 1 1 15 11634 2 2 22 ARG HG3 H -12.165 2.773 0.958 1.00 . B B . 22 ARG HG3 1 1 15 11635 2 2 22 ARG HH11 H -8.900 3.624 3.084 1.00 . B B . 22 ARG HH11 1 1 15 11636 2 2 22 ARG HH12 H -10.030 3.752 4.385 1.00 . B B . 22 ARG HH12 1 1 15 11637 2 2 22 ARG HH21 H -11.687 0.995 3.004 1.00 . B B . 22 ARG HH21 1 1 15 11638 2 2 22 ARG HH22 H -11.767 2.108 4.324 1.00 . B B . 22 ARG HH22 1 1 15 11639 2 2 22 ARG N N -12.039 4.064 -2.871 1.00 . B B . 22 ARG N 1 1 15 11640 2 2 22 ARG NE N -9.759 1.844 2.000 1.00 . B B . 22 ARG NE 1 1 15 11641 2 2 22 ARG NH1 N -9.712 3.304 3.563 1.00 . B B . 22 ARG NH1 1 1 15 11642 2 2 22 ARG NH2 N -11.322 1.779 3.507 1.00 . B B . 22 ARG NH2 1 1 15 11643 2 2 22 ARG O O -14.376 2.371 -1.144 1.00 . B B . 22 ARG O 1 1 15 11644 2 2 23 GLY C C -11.895 -0.504 0.797 1.00 . B B . 23 GLY C 1 1 15 11645 2 2 23 GLY CA C -12.998 -0.199 -0.244 1.00 . B B . 23 GLY CA 1 1 15 11646 2 2 23 GLY H H -11.592 1.172 -1.111 1.00 . B B . 23 GLY H 1 1 15 11647 2 2 23 GLY HA2 H -13.945 -0.060 0.260 1.00 . B B . 23 GLY HA2 1 1 15 11648 2 2 23 GLY HA3 H -13.056 -1.000 -0.966 1.00 . B B . 23 GLY HA3 1 1 15 11649 2 2 23 GLY N N -12.536 1.077 -0.888 1.00 . B B . 23 GLY N 1 1 15 11650 2 2 23 GLY O O -12.132 -0.443 1.984 1.00 . B B . 23 GLY O 1 1 15 11651 2 2 24 PHE C C -8.897 -2.551 0.579 1.00 . B B . 24 PHE C 1 1 15 11652 2 2 24 PHE CA C -9.400 -1.129 0.989 1.00 . B B . 24 PHE CA 1 1 15 11653 2 2 24 PHE CB C -9.546 -1.113 2.586 1.00 . B B . 24 PHE CB 1 1 15 11654 2 2 24 PHE CD1 C -6.991 -0.642 2.766 1.00 . B B . 24 PHE CD1 1 1 15 11655 2 2 24 PHE CD2 C -8.267 -0.899 4.745 1.00 . B B . 24 PHE CD2 1 1 15 11656 2 2 24 PHE CE1 C -5.869 -0.424 3.536 1.00 . B B . 24 PHE CE1 1 1 15 11657 2 2 24 PHE CE2 C -7.142 -0.678 5.509 1.00 . B B . 24 PHE CE2 1 1 15 11658 2 2 24 PHE CG C -8.220 -0.884 3.360 1.00 . B B . 24 PHE CG 1 1 15 11659 2 2 24 PHE CZ C -5.937 -0.440 4.903 1.00 . B B . 24 PHE CZ 1 1 15 11660 2 2 24 PHE H H -10.714 -0.738 -0.709 1.00 . B B . 24 PHE H 1 1 15 11661 2 2 24 PHE HA H -8.649 -0.424 0.662 1.00 . B B . 24 PHE HA 1 1 15 11662 2 2 24 PHE HB2 H -10.222 -0.360 2.929 1.00 . B B . 24 PHE HB2 1 1 15 11663 2 2 24 PHE HB3 H -9.951 -2.063 2.913 1.00 . B B . 24 PHE HB3 1 1 15 11664 2 2 24 PHE HD1 H -6.864 -0.618 1.699 1.00 . B B . 24 PHE HD1 1 1 15 11665 2 2 24 PHE HD2 H -9.195 -1.091 5.258 1.00 . B B . 24 PHE HD2 1 1 15 11666 2 2 24 PHE HE1 H -4.922 -0.238 3.055 1.00 . B B . 24 PHE HE1 1 1 15 11667 2 2 24 PHE HE2 H -7.205 -0.695 6.590 1.00 . B B . 24 PHE HE2 1 1 15 11668 2 2 24 PHE HZ H -5.052 -0.265 5.497 1.00 . B B . 24 PHE HZ 1 1 15 11669 2 2 24 PHE N N -10.718 -0.779 0.274 1.00 . B B . 24 PHE N 1 1 15 11670 2 2 24 PHE O O -9.028 -3.509 1.316 1.00 . B B . 24 PHE O 1 1 15 11671 2 2 25 PHE C C -6.496 -4.553 -0.329 1.00 . B B . 25 PHE C 1 1 15 11672 2 2 25 PHE CA C -7.838 -4.082 -0.974 1.00 . B B . 25 PHE CA 1 1 15 11673 2 2 25 PHE CB C -7.789 -4.037 -2.528 1.00 . B B . 25 PHE CB 1 1 15 11674 2 2 25 PHE CD1 C -10.356 -3.809 -2.487 1.00 . B B . 25 PHE CD1 1 1 15 11675 2 2 25 PHE CD2 C -9.154 -2.905 -4.321 1.00 . B B . 25 PHE CD2 1 1 15 11676 2 2 25 PHE CE1 C -11.541 -3.382 -3.050 1.00 . B B . 25 PHE CE1 1 1 15 11677 2 2 25 PHE CE2 C -10.337 -2.478 -4.885 1.00 . B B . 25 PHE CE2 1 1 15 11678 2 2 25 PHE CG C -9.144 -3.574 -3.117 1.00 . B B . 25 PHE CG 1 1 15 11679 2 2 25 PHE CZ C -11.531 -2.715 -4.251 1.00 . B B . 25 PHE CZ 1 1 15 11680 2 2 25 PHE H H -8.166 -1.954 -1.202 1.00 . B B . 25 PHE H 1 1 15 11681 2 2 25 PHE HA H -8.576 -4.811 -0.672 1.00 . B B . 25 PHE HA 1 1 15 11682 2 2 25 PHE HB2 H -7.023 -3.358 -2.869 1.00 . B B . 25 PHE HB2 1 1 15 11683 2 2 25 PHE HB3 H -7.573 -5.017 -2.927 1.00 . B B . 25 PHE HB3 1 1 15 11684 2 2 25 PHE HD1 H -10.391 -4.332 -1.546 1.00 . B B . 25 PHE HD1 1 1 15 11685 2 2 25 PHE HD2 H -8.226 -2.705 -4.835 1.00 . B B . 25 PHE HD2 1 1 15 11686 2 2 25 PHE HE1 H -12.479 -3.573 -2.548 1.00 . B B . 25 PHE HE1 1 1 15 11687 2 2 25 PHE HE2 H -10.324 -1.956 -5.833 1.00 . B B . 25 PHE HE2 1 1 15 11688 2 2 25 PHE HZ H -12.456 -2.378 -4.699 1.00 . B B . 25 PHE HZ 1 1 15 11689 2 2 25 PHE N N -8.309 -2.704 -0.578 1.00 . B B . 25 PHE N 1 1 15 11690 2 2 25 PHE O O -5.584 -5.016 -0.983 1.00 . B B . 25 PHE O 1 1 15 11691 2 2 26 TYR C C -5.456 -6.178 2.510 1.00 . B B . 26 TYR C 1 1 15 11692 2 2 26 TYR CA C -5.194 -4.851 1.738 1.00 . B B . 26 TYR CA 1 1 15 11693 2 2 26 TYR CB C -4.840 -3.663 2.700 1.00 . B B . 26 TYR CB 1 1 15 11694 2 2 26 TYR CD1 C -2.657 -4.877 3.363 1.00 . B B . 26 TYR CD1 1 1 15 11695 2 2 26 TYR CD2 C -3.613 -3.310 4.864 1.00 . B B . 26 TYR CD2 1 1 15 11696 2 2 26 TYR CE1 C -1.634 -5.113 4.263 1.00 . B B . 26 TYR CE1 1 1 15 11697 2 2 26 TYR CE2 C -2.588 -3.553 5.757 1.00 . B B . 26 TYR CE2 1 1 15 11698 2 2 26 TYR CG C -3.663 -3.969 3.656 1.00 . B B . 26 TYR CG 1 1 15 11699 2 2 26 TYR CZ C -1.603 -4.452 5.459 1.00 . B B . 26 TYR CZ 1 1 15 11700 2 2 26 TYR H H -7.204 -4.069 1.437 1.00 . B B . 26 TYR H 1 1 15 11701 2 2 26 TYR HA H -4.376 -5.027 1.053 1.00 . B B . 26 TYR HA 1 1 15 11702 2 2 26 TYR HB2 H -4.564 -2.796 2.121 1.00 . B B . 26 TYR HB2 1 1 15 11703 2 2 26 TYR HB3 H -5.708 -3.405 3.291 1.00 . B B . 26 TYR HB3 1 1 15 11704 2 2 26 TYR HD1 H -2.671 -5.413 2.425 1.00 . B B . 26 TYR HD1 1 1 15 11705 2 2 26 TYR HD2 H -4.389 -2.596 5.109 1.00 . B B . 26 TYR HD2 1 1 15 11706 2 2 26 TYR HE1 H -0.844 -5.816 4.035 1.00 . B B . 26 TYR HE1 1 1 15 11707 2 2 26 TYR HE2 H -2.545 -3.034 6.704 1.00 . B B . 26 TYR HE2 1 1 15 11708 2 2 26 TYR HH H 0.241 -4.536 5.951 1.00 . B B . 26 TYR HH 1 1 15 11709 2 2 26 TYR N N -6.425 -4.437 0.968 1.00 . B B . 26 TYR N 1 1 15 11710 2 2 26 TYR O O -5.013 -6.391 3.617 1.00 . B B . 26 TYR O 1 1 15 11711 2 2 26 TYR OH O -0.617 -4.701 6.375 1.00 . B B . 26 TYR OH 1 1 15 11712 2 2 27 THR C C -6.533 -9.524 1.472 1.00 . B B . 27 THR C 1 1 15 11713 2 2 27 THR CA C -6.522 -8.394 2.521 1.00 . B B . 27 THR CA 1 1 15 11714 2 2 27 THR CB C -7.898 -8.282 3.229 1.00 . B B . 27 THR CB 1 1 15 11715 2 2 27 THR CG2 C -8.267 -9.496 4.054 1.00 . B B . 27 THR CG2 1 1 15 11716 2 2 27 THR H H -6.519 -6.815 1.004 1.00 . B B . 27 THR H 1 1 15 11717 2 2 27 THR HA H -5.824 -8.638 3.291 1.00 . B B . 27 THR HA 1 1 15 11718 2 2 27 THR HB H -8.699 -7.897 2.606 1.00 . B B . 27 THR HB 1 1 15 11719 2 2 27 THR HG1 H -8.218 -6.684 4.285 1.00 . B B . 27 THR HG1 1 1 15 11720 2 2 27 THR HG21 H -7.543 -9.668 4.833 1.00 . B B . 27 THR HG21 1 1 15 11721 2 2 27 THR HG22 H -9.226 -9.330 4.518 1.00 . B B . 27 THR HG22 1 1 15 11722 2 2 27 THR HG23 H -8.334 -10.379 3.437 1.00 . B B . 27 THR HG23 1 1 15 11723 2 2 27 THR N N -6.188 -7.052 1.893 1.00 . B B . 27 THR N 1 1 15 11724 2 2 27 THR O O -7.548 -10.146 1.245 1.00 . B B . 27 THR O 1 1 15 11725 2 2 27 THR OG1 O -7.592 -7.416 4.314 1.00 . B B . 27 THR OG1 1 1 15 11726 2 2 28 PRO C C -3.609 -9.147 2.732 1.00 . B B . 28 PRO C 1 1 15 11727 2 2 28 PRO CA C -3.987 -9.506 1.255 1.00 . B B . 28 PRO CA 1 1 15 11728 2 2 28 PRO CB C -3.582 -8.430 0.224 1.00 . B B . 28 PRO CB 1 1 15 11729 2 2 28 PRO CD C -5.626 -9.420 -0.617 1.00 . B B . 28 PRO CD 1 1 15 11730 2 2 28 PRO CG C -4.219 -8.986 -1.070 1.00 . B B . 28 PRO CG 1 1 15 11731 2 2 28 PRO HA H -3.410 -10.392 1.028 1.00 . B B . 28 PRO HA 1 1 15 11732 2 2 28 PRO HB2 H -3.985 -7.459 0.478 1.00 . B B . 28 PRO HB2 1 1 15 11733 2 2 28 PRO HB3 H -2.510 -8.364 0.121 1.00 . B B . 28 PRO HB3 1 1 15 11734 2 2 28 PRO HD2 H -6.343 -8.614 -0.728 1.00 . B B . 28 PRO HD2 1 1 15 11735 2 2 28 PRO HD3 H -5.976 -10.289 -1.162 1.00 . B B . 28 PRO HD3 1 1 15 11736 2 2 28 PRO HG2 H -4.278 -8.224 -1.839 1.00 . B B . 28 PRO HG2 1 1 15 11737 2 2 28 PRO HG3 H -3.667 -9.833 -1.457 1.00 . B B . 28 PRO HG3 1 1 15 11738 2 2 28 PRO N N -5.413 -9.787 0.824 1.00 . B B . 28 PRO N 1 1 15 11739 2 2 28 PRO O O -3.017 -8.128 3.045 1.00 . B B . 28 PRO O 1 1 15 11740 2 2 29 LYS C C -2.911 -10.914 5.815 1.00 . B B . 29 LYS C 1 1 15 11741 2 2 29 LYS CA C -3.657 -9.775 5.102 1.00 . B B . 29 LYS CA 1 1 15 11742 2 2 29 LYS CB C -5.003 -9.461 5.836 1.00 . B B . 29 LYS CB 1 1 15 11743 2 2 29 LYS CD C -4.356 -7.608 7.616 1.00 . B B . 29 LYS CD 1 1 15 11744 2 2 29 LYS CE C -3.137 -7.087 6.844 1.00 . B B . 29 LYS CE 1 1 15 11745 2 2 29 LYS CG C -4.764 -9.109 7.343 1.00 . B B . 29 LYS CG 1 1 15 11746 2 2 29 LYS H H -4.455 -10.812 3.344 1.00 . B B . 29 LYS H 1 1 15 11747 2 2 29 LYS HA H -2.962 -8.984 5.167 1.00 . B B . 29 LYS HA 1 1 15 11748 2 2 29 LYS HB2 H -5.536 -8.656 5.349 1.00 . B B . 29 LYS HB2 1 1 15 11749 2 2 29 LYS HB3 H -5.640 -10.336 5.789 1.00 . B B . 29 LYS HB3 1 1 15 11750 2 2 29 LYS HD2 H -5.202 -6.966 7.417 1.00 . B B . 29 LYS HD2 1 1 15 11751 2 2 29 LYS HD3 H -4.136 -7.512 8.672 1.00 . B B . 29 LYS HD3 1 1 15 11752 2 2 29 LYS HE2 H -2.715 -6.217 7.340 1.00 . B B . 29 LYS HE2 1 1 15 11753 2 2 29 LYS HE3 H -2.360 -7.847 6.801 1.00 . B B . 29 LYS HE3 1 1 15 11754 2 2 29 LYS HG2 H -5.689 -9.302 7.876 1.00 . B B . 29 LYS HG2 1 1 15 11755 2 2 29 LYS HG3 H -4.021 -9.766 7.780 1.00 . B B . 29 LYS HG3 1 1 15 11756 2 2 29 LYS HZ1 H -4.643 -6.929 5.345 1.00 . B B . 29 LYS HZ1 1 1 15 11757 2 2 29 LYS HZ2 H -3.537 -5.715 5.272 1.00 . B B . 29 LYS HZ2 1 1 15 11758 2 2 29 LYS HZ3 H -3.166 -7.207 4.682 1.00 . B B . 29 LYS HZ3 1 1 15 11759 2 2 29 LYS N N -3.972 -10.013 3.641 1.00 . B B . 29 LYS N 1 1 15 11760 2 2 29 LYS NZ N -3.629 -6.728 5.483 1.00 . B B . 29 LYS NZ 1 1 15 11761 2 2 29 LYS O O -1.978 -10.698 6.556 1.00 . B B . 29 LYS O 1 1 15 11762 2 2 30 THR C C -2.050 -14.227 5.106 1.00 . B B . 30 THR C 1 1 15 11763 2 2 30 THR CA C -2.838 -13.373 6.111 1.00 . B B . 30 THR CA 1 1 15 11764 2 2 30 THR CB C -4.005 -14.211 6.628 1.00 . B B . 30 THR CB 1 1 15 11765 2 2 30 THR CG2 C -4.900 -13.445 7.573 1.00 . B B . 30 THR CG2 1 1 15 11766 2 2 30 THR H H -4.139 -12.078 4.932 1.00 . B B . 30 THR H 1 1 15 11767 2 2 30 THR HA H -2.174 -13.161 6.937 1.00 . B B . 30 THR HA 1 1 15 11768 2 2 30 THR HB H -3.726 -15.203 6.972 1.00 . B B . 30 THR HB 1 1 15 11769 2 2 30 THR HG1 H -5.065 -15.181 5.318 1.00 . B B . 30 THR HG1 1 1 15 11770 2 2 30 THR HG21 H -5.324 -12.585 7.079 1.00 . B B . 30 THR HG21 1 1 15 11771 2 2 30 THR HG22 H -5.708 -14.083 7.897 1.00 . B B . 30 THR HG22 1 1 15 11772 2 2 30 THR HG23 H -4.343 -13.117 8.438 1.00 . B B . 30 THR HG23 1 1 15 11773 2 2 30 THR N N -3.381 -12.078 5.542 1.00 . B B . 30 THR N 1 1 15 11774 2 2 30 THR O O -1.800 -15.400 5.321 1.00 . B B . 30 THR O 1 1 15 11775 2 2 30 THR OG1 O -4.859 -14.255 5.494 1.00 . B B . 30 THR OG1 1 1 16 11776 1 1 1 GLY C C -2.251 -4.928 -2.323 1.00 . A A . 1 GLY C 1 1 16 11777 1 1 1 GLY CA C -3.265 -5.696 -3.181 1.00 . A A . 1 GLY CA 1 1 16 11778 1 1 1 GLY HA2 H -2.723 -6.230 -3.945 1.00 . A A . 1 GLY HA2 1 1 16 11779 1 1 1 GLY HA3 H -3.902 -4.966 -3.648 1.00 . A A . 1 GLY HA3 1 1 16 11780 1 1 1 GLY N N -4.131 -6.663 -2.417 1.00 . A A . 1 GLY N 1 1 16 11781 1 1 1 GLY O O -2.236 -5.052 -1.112 1.00 . A A . 1 GLY O 1 1 16 11782 1 1 2 ILE C C 0.845 -4.244 -1.976 1.00 . A A . 2 ILE C 1 1 16 11783 1 1 2 ILE CA C -0.326 -3.302 -2.324 1.00 . A A . 2 ILE CA 1 1 16 11784 1 1 2 ILE CB C -0.859 -2.609 -0.983 1.00 . A A . 2 ILE CB 1 1 16 11785 1 1 2 ILE CD1 C -2.900 -1.852 0.290 1.00 . A A . 2 ILE CD1 1 1 16 11786 1 1 2 ILE CG1 C -2.271 -2.003 -1.117 1.00 . A A . 2 ILE CG1 1 1 16 11787 1 1 2 ILE CG2 C 0.077 -1.447 -0.647 1.00 . A A . 2 ILE CG2 1 1 16 11788 1 1 2 ILE H H -1.530 -4.140 -3.951 1.00 . A A . 2 ILE H 1 1 16 11789 1 1 2 ILE HA H 0.081 -2.593 -3.029 1.00 . A A . 2 ILE HA 1 1 16 11790 1 1 2 ILE HB H -0.864 -3.310 -0.159 1.00 . A A . 2 ILE HB 1 1 16 11791 1 1 2 ILE HD11 H -2.931 -2.806 0.791 1.00 . A A . 2 ILE HD11 1 1 16 11792 1 1 2 ILE HD12 H -2.339 -1.161 0.903 1.00 . A A . 2 ILE HD12 1 1 16 11793 1 1 2 ILE HD13 H -3.915 -1.488 0.212 1.00 . A A . 2 ILE HD13 1 1 16 11794 1 1 2 ILE HG12 H -2.214 -1.028 -1.578 1.00 . A A . 2 ILE HG12 1 1 16 11795 1 1 2 ILE HG13 H -2.911 -2.634 -1.715 1.00 . A A . 2 ILE HG13 1 1 16 11796 1 1 2 ILE HG21 H 0.106 -0.747 -1.466 1.00 . A A . 2 ILE HG21 1 1 16 11797 1 1 2 ILE HG22 H -0.301 -0.927 0.217 1.00 . A A . 2 ILE HG22 1 1 16 11798 1 1 2 ILE HG23 H 1.078 -1.781 -0.426 1.00 . A A . 2 ILE HG23 1 1 16 11799 1 1 2 ILE N N -1.419 -4.154 -2.978 1.00 . A A . 2 ILE N 1 1 16 11800 1 1 2 ILE O O 1.961 -4.187 -2.445 1.00 . A A . 2 ILE O 1 1 16 11801 1 1 3 VAL C C 2.431 -6.828 -1.239 1.00 . A A . 3 VAL C 1 1 16 11802 1 1 3 VAL CA C 1.227 -6.204 -0.459 1.00 . A A . 3 VAL CA 1 1 16 11803 1 1 3 VAL CB C 0.023 -7.108 -0.119 1.00 . A A . 3 VAL CB 1 1 16 11804 1 1 3 VAL CG1 C -0.562 -7.734 -1.405 1.00 . A A . 3 VAL CG1 1 1 16 11805 1 1 3 VAL CG2 C 0.359 -8.153 0.845 1.00 . A A . 3 VAL CG2 1 1 16 11806 1 1 3 VAL H H -0.467 -4.990 -0.824 1.00 . A A . 3 VAL H 1 1 16 11807 1 1 3 VAL HA H 1.706 -5.772 0.406 1.00 . A A . 3 VAL HA 1 1 16 11808 1 1 3 VAL HB H -0.748 -6.501 0.335 1.00 . A A . 3 VAL HB 1 1 16 11809 1 1 3 VAL HG11 H -0.857 -6.960 -2.097 1.00 . A A . 3 VAL HG11 1 1 16 11810 1 1 3 VAL HG12 H 0.171 -8.355 -1.901 1.00 . A A . 3 VAL HG12 1 1 16 11811 1 1 3 VAL HG13 H -1.437 -8.326 -1.184 1.00 . A A . 3 VAL HG13 1 1 16 11812 1 1 3 VAL HG21 H 1.129 -8.734 0.384 1.00 . A A . 3 VAL HG21 1 1 16 11813 1 1 3 VAL HG22 H 0.704 -7.732 1.777 1.00 . A A . 3 VAL HG22 1 1 16 11814 1 1 3 VAL HG23 H -0.519 -8.756 1.006 1.00 . A A . 3 VAL HG23 1 1 16 11815 1 1 3 VAL N N 0.462 -5.098 -1.096 1.00 . A A . 3 VAL N 1 1 16 11816 1 1 3 VAL O O 2.545 -6.674 -2.436 1.00 . A A . 3 VAL O 1 1 16 11817 1 1 4 GLU C C 5.468 -7.454 -2.082 1.00 . A A . 4 GLU C 1 1 16 11818 1 1 4 GLU CA C 4.543 -8.199 -1.071 1.00 . A A . 4 GLU CA 1 1 16 11819 1 1 4 GLU CB C 4.129 -9.572 -1.684 1.00 . A A . 4 GLU CB 1 1 16 11820 1 1 4 GLU CD C 2.844 -10.434 0.345 1.00 . A A . 4 GLU CD 1 1 16 11821 1 1 4 GLU CG C 4.044 -10.634 -0.531 1.00 . A A . 4 GLU CG 1 1 16 11822 1 1 4 GLU H H 3.095 -7.646 0.421 1.00 . A A . 4 GLU H 1 1 16 11823 1 1 4 GLU HA H 5.187 -8.324 -0.214 1.00 . A A . 4 GLU HA 1 1 16 11824 1 1 4 GLU HB2 H 3.164 -9.482 -2.170 1.00 . A A . 4 GLU HB2 1 1 16 11825 1 1 4 GLU HB3 H 4.845 -9.900 -2.428 1.00 . A A . 4 GLU HB3 1 1 16 11826 1 1 4 GLU HG2 H 3.967 -11.625 -0.949 1.00 . A A . 4 GLU HG2 1 1 16 11827 1 1 4 GLU HG3 H 4.918 -10.599 0.097 1.00 . A A . 4 GLU HG3 1 1 16 11828 1 1 4 GLU N N 3.287 -7.524 -0.533 1.00 . A A . 4 GLU N 1 1 16 11829 1 1 4 GLU O O 6.548 -7.888 -2.433 1.00 . A A . 4 GLU O 1 1 16 11830 1 1 4 GLU OE1 O 1.789 -10.895 -0.045 1.00 . A A . 4 GLU OE1 1 1 16 11831 1 1 4 GLU OE2 O 2.991 -9.824 1.390 1.00 . A A . 4 GLU OE2 1 1 16 11832 1 1 5 GLN C C 5.846 -4.089 -2.842 1.00 . A A . 5 GLN C 1 1 16 11833 1 1 5 GLN CA C 5.800 -5.466 -3.509 1.00 . A A . 5 GLN CA 1 1 16 11834 1 1 5 GLN CB C 5.013 -5.491 -4.850 1.00 . A A . 5 GLN CB 1 1 16 11835 1 1 5 GLN CD C 4.250 -7.151 -6.703 1.00 . A A . 5 GLN CD 1 1 16 11836 1 1 5 GLN CG C 4.866 -6.995 -5.319 1.00 . A A . 5 GLN CG 1 1 16 11837 1 1 5 GLN H H 4.174 -6.020 -2.240 1.00 . A A . 5 GLN H 1 1 16 11838 1 1 5 GLN HA H 6.830 -5.777 -3.621 1.00 . A A . 5 GLN HA 1 1 16 11839 1 1 5 GLN HB2 H 4.034 -5.044 -4.726 1.00 . A A . 5 GLN HB2 1 1 16 11840 1 1 5 GLN HB3 H 5.565 -4.929 -5.593 1.00 . A A . 5 GLN HB3 1 1 16 11841 1 1 5 GLN HE21 H 3.817 -5.254 -6.970 1.00 . A A . 5 GLN HE21 1 1 16 11842 1 1 5 GLN HE22 H 3.411 -6.340 -8.230 1.00 . A A . 5 GLN HE22 1 1 16 11843 1 1 5 GLN HG2 H 5.818 -7.500 -5.344 1.00 . A A . 5 GLN HG2 1 1 16 11844 1 1 5 GLN HG3 H 4.222 -7.536 -4.641 1.00 . A A . 5 GLN HG3 1 1 16 11845 1 1 5 GLN N N 5.047 -6.322 -2.542 1.00 . A A . 5 GLN N 1 1 16 11846 1 1 5 GLN NE2 N 3.787 -6.147 -7.351 1.00 . A A . 5 GLN NE2 1 1 16 11847 1 1 5 GLN O O 6.889 -3.493 -2.658 1.00 . A A . 5 GLN O 1 1 16 11848 1 1 5 GLN OE1 O 4.169 -8.218 -7.256 1.00 . A A . 5 GLN OE1 1 1 16 11849 1 1 6 CYS C C 4.679 -2.457 -0.259 1.00 . A A . 6 CYS C 1 1 16 11850 1 1 6 CYS CA C 4.632 -2.271 -1.794 1.00 . A A . 6 CYS CA 1 1 16 11851 1 1 6 CYS CB C 3.366 -1.721 -2.356 1.00 . A A . 6 CYS CB 1 1 16 11852 1 1 6 CYS H H 3.834 -4.073 -2.588 1.00 . A A . 6 CYS H 1 1 16 11853 1 1 6 CYS HA H 5.493 -1.667 -2.049 1.00 . A A . 6 CYS HA 1 1 16 11854 1 1 6 CYS HB2 H 2.532 -2.055 -1.768 1.00 . A A . 6 CYS HB2 1 1 16 11855 1 1 6 CYS HB3 H 3.420 -0.646 -2.265 1.00 . A A . 6 CYS HB3 1 1 16 11856 1 1 6 CYS HG H 2.650 -3.045 -4.078 1.00 . A A . 6 CYS HG 1 1 16 11857 1 1 6 CYS N N 4.696 -3.608 -2.458 1.00 . A A . 6 CYS N 1 1 16 11858 1 1 6 CYS O O 4.323 -1.644 0.566 1.00 . A A . 6 CYS O 1 1 16 11859 1 1 6 CYS SG S 3.068 -2.181 -4.092 1.00 . A A . 6 CYS SG 1 1 16 11860 1 1 7 CYS C C 6.697 -4.877 1.433 1.00 . A A . 7 CYS C 1 1 16 11861 1 1 7 CYS CA C 5.316 -4.130 1.416 1.00 . A A . 7 CYS CA 1 1 16 11862 1 1 7 CYS CB C 4.068 -4.967 1.664 1.00 . A A . 7 CYS CB 1 1 16 11863 1 1 7 CYS H H 5.316 -4.257 -0.683 1.00 . A A . 7 CYS H 1 1 16 11864 1 1 7 CYS HA H 5.392 -3.292 2.098 1.00 . A A . 7 CYS HA 1 1 16 11865 1 1 7 CYS HB2 H 3.258 -4.247 1.729 1.00 . A A . 7 CYS HB2 1 1 16 11866 1 1 7 CYS HB3 H 3.865 -5.557 0.787 1.00 . A A . 7 CYS HB3 1 1 16 11867 1 1 7 CYS HG H 4.522 -6.811 2.920 1.00 . A A . 7 CYS HG 1 1 16 11868 1 1 7 CYS N N 5.122 -3.639 0.044 1.00 . A A . 7 CYS N 1 1 16 11869 1 1 7 CYS O O 7.371 -4.902 2.437 1.00 . A A . 7 CYS O 1 1 16 11870 1 1 7 CYS SG S 4.035 -6.013 3.141 1.00 . A A . 7 CYS SG 1 1 16 11871 1 1 8 THR C C 9.243 -5.878 -1.046 1.00 . A A . 8 THR C 1 1 16 11872 1 1 8 THR CA C 8.403 -6.206 0.221 1.00 . A A . 8 THR CA 1 1 16 11873 1 1 8 THR CB C 8.147 -7.740 0.234 1.00 . A A . 8 THR CB 1 1 16 11874 1 1 8 THR CG2 C 9.232 -8.458 1.009 1.00 . A A . 8 THR CG2 1 1 16 11875 1 1 8 THR H H 6.502 -5.396 -0.461 1.00 . A A . 8 THR H 1 1 16 11876 1 1 8 THR HA H 9.009 -5.963 1.080 1.00 . A A . 8 THR HA 1 1 16 11877 1 1 8 THR HB H 7.943 -8.202 -0.722 1.00 . A A . 8 THR HB 1 1 16 11878 1 1 8 THR HG1 H 7.248 -8.619 1.749 1.00 . A A . 8 THR HG1 1 1 16 11879 1 1 8 THR HG21 H 9.267 -8.099 2.029 1.00 . A A . 8 THR HG21 1 1 16 11880 1 1 8 THR HG22 H 9.038 -9.520 1.014 1.00 . A A . 8 THR HG22 1 1 16 11881 1 1 8 THR HG23 H 10.194 -8.285 0.548 1.00 . A A . 8 THR HG23 1 1 16 11882 1 1 8 THR N N 7.079 -5.454 0.315 1.00 . A A . 8 THR N 1 1 16 11883 1 1 8 THR O O 10.338 -5.354 -0.973 1.00 . A A . 8 THR O 1 1 16 11884 1 1 8 THR OG1 O 7.063 -7.902 1.130 1.00 . A A . 8 THR OG1 1 1 16 11885 1 1 9 SER C C 9.013 -4.602 -4.240 1.00 . A A . 9 SER C 1 1 16 11886 1 1 9 SER CA C 9.351 -5.948 -3.543 1.00 . A A . 9 SER CA 1 1 16 11887 1 1 9 SER CB C 8.955 -7.102 -4.497 1.00 . A A . 9 SER CB 1 1 16 11888 1 1 9 SER H H 7.807 -6.590 -2.157 1.00 . A A . 9 SER H 1 1 16 11889 1 1 9 SER HA H 10.424 -5.997 -3.419 1.00 . A A . 9 SER HA 1 1 16 11890 1 1 9 SER HB2 H 7.948 -7.016 -4.885 1.00 . A A . 9 SER HB2 1 1 16 11891 1 1 9 SER HB3 H 9.647 -7.179 -5.328 1.00 . A A . 9 SER HB3 1 1 16 11892 1 1 9 SER HG H 8.211 -8.386 -3.254 1.00 . A A . 9 SER HG 1 1 16 11893 1 1 9 SER N N 8.689 -6.181 -2.189 1.00 . A A . 9 SER N 1 1 16 11894 1 1 9 SER O O 8.113 -4.484 -5.044 1.00 . A A . 9 SER O 1 1 16 11895 1 1 9 SER OG O 9.080 -8.249 -3.662 1.00 . A A . 9 SER OG 1 1 16 11896 1 1 10 ILE C C 8.665 -1.690 -5.348 1.00 . A A . 10 ILE C 1 1 16 11897 1 1 10 ILE CA C 9.748 -2.193 -4.330 1.00 . A A . 10 ILE CA 1 1 16 11898 1 1 10 ILE CB C 11.190 -1.857 -4.863 1.00 . A A . 10 ILE CB 1 1 16 11899 1 1 10 ILE CD1 C 13.607 -1.563 -4.030 1.00 . A A . 10 ILE CD1 1 1 16 11900 1 1 10 ILE CG1 C 12.160 -1.980 -3.647 1.00 . A A . 10 ILE CG1 1 1 16 11901 1 1 10 ILE CG2 C 11.267 -0.383 -5.360 1.00 . A A . 10 ILE CG2 1 1 16 11902 1 1 10 ILE H H 10.452 -3.908 -3.209 1.00 . A A . 10 ILE H 1 1 16 11903 1 1 10 ILE HA H 9.567 -1.624 -3.453 1.00 . A A . 10 ILE HA 1 1 16 11904 1 1 10 ILE HB H 11.465 -2.541 -5.657 1.00 . A A . 10 ILE HB 1 1 16 11905 1 1 10 ILE HD11 H 13.973 -2.161 -4.851 1.00 . A A . 10 ILE HD11 1 1 16 11906 1 1 10 ILE HD12 H 13.635 -0.521 -4.320 1.00 . A A . 10 ILE HD12 1 1 16 11907 1 1 10 ILE HD13 H 14.270 -1.679 -3.186 1.00 . A A . 10 ILE HD13 1 1 16 11908 1 1 10 ILE HG12 H 11.813 -1.336 -2.845 1.00 . A A . 10 ILE HG12 1 1 16 11909 1 1 10 ILE HG13 H 12.165 -2.994 -3.274 1.00 . A A . 10 ILE HG13 1 1 16 11910 1 1 10 ILE HG21 H 10.538 -0.176 -6.129 1.00 . A A . 10 ILE HG21 1 1 16 11911 1 1 10 ILE HG22 H 11.123 0.302 -4.543 1.00 . A A . 10 ILE HG22 1 1 16 11912 1 1 10 ILE HG23 H 12.238 -0.188 -5.784 1.00 . A A . 10 ILE HG23 1 1 16 11913 1 1 10 ILE N N 9.787 -3.638 -3.861 1.00 . A A . 10 ILE N 1 1 16 11914 1 1 10 ILE O O 8.825 -1.614 -6.549 1.00 . A A . 10 ILE O 1 1 16 11915 1 1 11 CYS C C 5.687 0.389 -4.666 1.00 . A A . 11 CYS C 1 1 16 11916 1 1 11 CYS CA C 6.326 -0.828 -5.477 1.00 . A A . 11 CYS CA 1 1 16 11917 1 1 11 CYS CB C 5.518 -2.157 -5.591 1.00 . A A . 11 CYS CB 1 1 16 11918 1 1 11 CYS H H 7.514 -1.470 -3.794 1.00 . A A . 11 CYS H 1 1 16 11919 1 1 11 CYS HA H 6.610 -0.475 -6.459 1.00 . A A . 11 CYS HA 1 1 16 11920 1 1 11 CYS HB2 H 6.113 -2.814 -6.212 1.00 . A A . 11 CYS HB2 1 1 16 11921 1 1 11 CYS HB3 H 5.542 -2.572 -4.604 1.00 . A A . 11 CYS HB3 1 1 16 11922 1 1 11 CYS HG H 3.800 -2.478 -7.084 1.00 . A A . 11 CYS HG 1 1 16 11923 1 1 11 CYS N N 7.548 -1.354 -4.764 1.00 . A A . 11 CYS N 1 1 16 11924 1 1 11 CYS O O 4.915 0.134 -3.775 1.00 . A A . 11 CYS O 1 1 16 11925 1 1 11 CYS SG S 3.800 -2.341 -6.133 1.00 . A A . 11 CYS SG 1 1 16 11926 1 1 12 SER C C 4.595 4.147 -4.512 1.00 . A A . 12 SER C 1 1 16 11927 1 1 12 SER CA C 5.340 2.814 -4.091 1.00 . A A . 12 SER CA 1 1 16 11928 1 1 12 SER CB C 6.402 3.304 -3.117 1.00 . A A . 12 SER CB 1 1 16 11929 1 1 12 SER H H 6.645 1.862 -5.589 1.00 . A A . 12 SER H 1 1 16 11930 1 1 12 SER HA H 4.703 2.353 -3.354 1.00 . A A . 12 SER HA 1 1 16 11931 1 1 12 SER HB2 H 6.067 4.186 -2.584 1.00 . A A . 12 SER HB2 1 1 16 11932 1 1 12 SER HB3 H 6.624 2.531 -2.394 1.00 . A A . 12 SER HB3 1 1 16 11933 1 1 12 SER HG H 7.377 3.509 -4.875 1.00 . A A . 12 SER HG 1 1 16 11934 1 1 12 SER N N 5.979 1.656 -4.906 1.00 . A A . 12 SER N 1 1 16 11935 1 1 12 SER O O 5.202 5.068 -5.006 1.00 . A A . 12 SER O 1 1 16 11936 1 1 12 SER OG O 7.543 3.627 -3.921 1.00 . A A . 12 SER OG 1 1 16 11937 1 1 13 LEU C C 1.350 4.848 -5.645 1.00 . A A . 13 LEU C 1 1 16 11938 1 1 13 LEU CA C 2.275 5.269 -4.530 1.00 . A A . 13 LEU CA 1 1 16 11939 1 1 13 LEU CB C 3.000 6.612 -4.882 1.00 . A A . 13 LEU CB 1 1 16 11940 1 1 13 LEU CD1 C 1.387 8.092 -3.660 1.00 . A A . 13 LEU CD1 1 1 16 11941 1 1 13 LEU CD2 C 2.803 8.991 -5.460 1.00 . A A . 13 LEU CD2 1 1 16 11942 1 1 13 LEU CG C 2.007 7.771 -5.021 1.00 . A A . 13 LEU CG 1 1 16 11943 1 1 13 LEU H H 2.968 3.367 -3.937 1.00 . A A . 13 LEU H 1 1 16 11944 1 1 13 LEU HA H 1.628 5.360 -3.667 1.00 . A A . 13 LEU HA 1 1 16 11945 1 1 13 LEU HB2 H 3.714 6.845 -4.105 1.00 . A A . 13 LEU HB2 1 1 16 11946 1 1 13 LEU HB3 H 3.557 6.515 -5.803 1.00 . A A . 13 LEU HB3 1 1 16 11947 1 1 13 LEU HD11 H 2.156 8.352 -2.947 1.00 . A A . 13 LEU HD11 1 1 16 11948 1 1 13 LEU HD12 H 0.711 8.929 -3.751 1.00 . A A . 13 LEU HD12 1 1 16 11949 1 1 13 LEU HD13 H 0.828 7.256 -3.270 1.00 . A A . 13 LEU HD13 1 1 16 11950 1 1 13 LEU HD21 H 3.562 9.235 -4.730 1.00 . A A . 13 LEU HD21 1 1 16 11951 1 1 13 LEU HD22 H 3.292 8.805 -6.405 1.00 . A A . 13 LEU HD22 1 1 16 11952 1 1 13 LEU HD23 H 2.150 9.843 -5.575 1.00 . A A . 13 LEU HD23 1 1 16 11953 1 1 13 LEU HG H 1.234 7.550 -5.751 1.00 . A A . 13 LEU HG 1 1 16 11954 1 1 13 LEU N N 3.304 4.184 -4.291 1.00 . A A . 13 LEU N 1 1 16 11955 1 1 13 LEU O O 0.146 4.730 -5.525 1.00 . A A . 13 LEU O 1 1 16 11956 1 1 14 TYR C C 0.612 2.845 -7.749 1.00 . A A . 14 TYR C 1 1 16 11957 1 1 14 TYR CA C 1.366 4.141 -7.979 1.00 . A A . 14 TYR CA 1 1 16 11958 1 1 14 TYR CB C 2.426 3.931 -9.103 1.00 . A A . 14 TYR CB 1 1 16 11959 1 1 14 TYR CD1 C 4.591 4.704 -8.105 1.00 . A A . 14 TYR CD1 1 1 16 11960 1 1 14 TYR CD2 C 4.267 2.366 -8.357 1.00 . A A . 14 TYR CD2 1 1 16 11961 1 1 14 TYR CE1 C 5.828 4.477 -7.543 1.00 . A A . 14 TYR CE1 1 1 16 11962 1 1 14 TYR CE2 C 5.509 2.149 -7.793 1.00 . A A . 14 TYR CE2 1 1 16 11963 1 1 14 TYR CG C 3.803 3.650 -8.512 1.00 . A A . 14 TYR CG 1 1 16 11964 1 1 14 TYR CZ C 6.285 3.200 -7.386 1.00 . A A . 14 TYR CZ 1 1 16 11965 1 1 14 TYR H H 3.001 4.655 -6.546 1.00 . A A . 14 TYR H 1 1 16 11966 1 1 14 TYR HA H 0.627 4.876 -8.276 1.00 . A A . 14 TYR HA 1 1 16 11967 1 1 14 TYR HB2 H 2.130 3.092 -9.723 1.00 . A A . 14 TYR HB2 1 1 16 11968 1 1 14 TYR HB3 H 2.471 4.807 -9.729 1.00 . A A . 14 TYR HB3 1 1 16 11969 1 1 14 TYR HD1 H 4.237 5.720 -8.228 1.00 . A A . 14 TYR HD1 1 1 16 11970 1 1 14 TYR HD2 H 3.662 1.529 -8.678 1.00 . A A . 14 TYR HD2 1 1 16 11971 1 1 14 TYR HE1 H 6.437 5.310 -7.219 1.00 . A A . 14 TYR HE1 1 1 16 11972 1 1 14 TYR HE2 H 5.885 1.147 -7.671 1.00 . A A . 14 TYR HE2 1 1 16 11973 1 1 14 TYR HH H 8.149 3.293 -7.453 1.00 . A A . 14 TYR HH 1 1 16 11974 1 1 14 TYR N N 2.033 4.577 -6.700 1.00 . A A . 14 TYR N 1 1 16 11975 1 1 14 TYR O O -0.283 2.475 -8.470 1.00 . A A . 14 TYR O 1 1 16 11976 1 1 14 TYR OH O 7.509 2.964 -6.810 1.00 . A A . 14 TYR OH 1 1 16 11977 1 1 15 GLN C C -0.436 0.902 -5.084 1.00 . A A . 15 GLN C 1 1 16 11978 1 1 15 GLN CA C 0.338 0.879 -6.397 1.00 . A A . 15 GLN CA 1 1 16 11979 1 1 15 GLN CB C 1.476 -0.163 -6.431 1.00 . A A . 15 GLN CB 1 1 16 11980 1 1 15 GLN CD C 2.248 0.701 -4.154 1.00 . A A . 15 GLN CD 1 1 16 11981 1 1 15 GLN CG C 2.657 0.410 -5.576 1.00 . A A . 15 GLN CG 1 1 16 11982 1 1 15 GLN H H 1.756 2.513 -6.159 1.00 . A A . 15 GLN H 1 1 16 11983 1 1 15 GLN HA H -0.440 0.709 -7.124 1.00 . A A . 15 GLN HA 1 1 16 11984 1 1 15 GLN HB2 H 1.137 -1.114 -6.042 1.00 . A A . 15 GLN HB2 1 1 16 11985 1 1 15 GLN HB3 H 1.800 -0.310 -7.454 1.00 . A A . 15 GLN HB3 1 1 16 11986 1 1 15 GLN HE21 H 1.176 -0.917 -3.882 1.00 . A A . 15 GLN HE21 1 1 16 11987 1 1 15 GLN HE22 H 1.326 0.137 -2.554 1.00 . A A . 15 GLN HE22 1 1 16 11988 1 1 15 GLN HG2 H 3.468 -0.272 -5.513 1.00 . A A . 15 GLN HG2 1 1 16 11989 1 1 15 GLN HG3 H 3.067 1.314 -5.989 1.00 . A A . 15 GLN HG3 1 1 16 11990 1 1 15 GLN N N 1.012 2.169 -6.716 1.00 . A A . 15 GLN N 1 1 16 11991 1 1 15 GLN NE2 N 1.519 -0.100 -3.477 1.00 . A A . 15 GLN NE2 1 1 16 11992 1 1 15 GLN O O -0.791 -0.115 -4.533 1.00 . A A . 15 GLN O 1 1 16 11993 1 1 15 GLN OE1 O 2.594 1.710 -3.608 1.00 . A A . 15 GLN OE1 1 1 16 11994 1 1 16 LEU C C -2.780 2.715 -3.867 1.00 . A A . 16 LEU C 1 1 16 11995 1 1 16 LEU CA C -1.425 2.284 -3.367 1.00 . A A . 16 LEU CA 1 1 16 11996 1 1 16 LEU CB C -0.680 3.353 -2.511 1.00 . A A . 16 LEU CB 1 1 16 11997 1 1 16 LEU CD1 C 1.527 3.429 -1.297 1.00 . A A . 16 LEU CD1 1 1 16 11998 1 1 16 LEU CD2 C -0.210 1.860 -0.528 1.00 . A A . 16 LEU CD2 1 1 16 11999 1 1 16 LEU CG C 0.394 2.552 -1.755 1.00 . A A . 16 LEU CG 1 1 16 12000 1 1 16 LEU H H -0.365 2.866 -5.072 1.00 . A A . 16 LEU H 1 1 16 12001 1 1 16 LEU HA H -1.511 1.340 -2.902 1.00 . A A . 16 LEU HA 1 1 16 12002 1 1 16 LEU HB2 H -0.251 4.133 -3.126 1.00 . A A . 16 LEU HB2 1 1 16 12003 1 1 16 LEU HB3 H -1.356 3.822 -1.808 1.00 . A A . 16 LEU HB3 1 1 16 12004 1 1 16 LEU HD11 H 1.160 4.238 -0.696 1.00 . A A . 16 LEU HD11 1 1 16 12005 1 1 16 LEU HD12 H 2.233 2.836 -0.725 1.00 . A A . 16 LEU HD12 1 1 16 12006 1 1 16 LEU HD13 H 2.048 3.830 -2.148 1.00 . A A . 16 LEU HD13 1 1 16 12007 1 1 16 LEU HD21 H -0.635 2.578 0.157 1.00 . A A . 16 LEU HD21 1 1 16 12008 1 1 16 LEU HD22 H -0.987 1.166 -0.815 1.00 . A A . 16 LEU HD22 1 1 16 12009 1 1 16 LEU HD23 H 0.556 1.299 -0.010 1.00 . A A . 16 LEU HD23 1 1 16 12010 1 1 16 LEU HG H 0.777 1.791 -2.403 1.00 . A A . 16 LEU HG 1 1 16 12011 1 1 16 LEU N N -0.677 2.082 -4.612 1.00 . A A . 16 LEU N 1 1 16 12012 1 1 16 LEU O O -3.774 2.185 -3.419 1.00 . A A . 16 LEU O 1 1 16 12013 1 1 17 GLU C C -4.927 2.845 -5.736 1.00 . A A . 17 GLU C 1 1 16 12014 1 1 17 GLU CA C -4.099 4.112 -5.351 1.00 . A A . 17 GLU CA 1 1 16 12015 1 1 17 GLU CB C -3.783 5.040 -6.581 1.00 . A A . 17 GLU CB 1 1 16 12016 1 1 17 GLU CD C -4.286 3.449 -8.630 1.00 . A A . 17 GLU CD 1 1 16 12017 1 1 17 GLU CG C -3.226 4.260 -7.845 1.00 . A A . 17 GLU CG 1 1 16 12018 1 1 17 GLU H H -1.911 3.980 -5.115 1.00 . A A . 17 GLU H 1 1 16 12019 1 1 17 GLU HA H -4.652 4.649 -4.596 1.00 . A A . 17 GLU HA 1 1 16 12020 1 1 17 GLU HB2 H -4.702 5.536 -6.869 1.00 . A A . 17 GLU HB2 1 1 16 12021 1 1 17 GLU HB3 H -3.078 5.804 -6.286 1.00 . A A . 17 GLU HB3 1 1 16 12022 1 1 17 GLU HG2 H -2.812 4.964 -8.544 1.00 . A A . 17 GLU HG2 1 1 16 12023 1 1 17 GLU HG3 H -2.430 3.588 -7.569 1.00 . A A . 17 GLU HG3 1 1 16 12024 1 1 17 GLU N N -2.779 3.635 -4.794 1.00 . A A . 17 GLU N 1 1 16 12025 1 1 17 GLU O O -6.047 2.620 -5.334 1.00 . A A . 17 GLU O 1 1 16 12026 1 1 17 GLU OE1 O -5.472 3.668 -8.448 1.00 . A A . 17 GLU OE1 1 1 16 12027 1 1 17 GLU OE2 O -3.834 2.608 -9.381 1.00 . A A . 17 GLU OE2 1 1 16 12028 1 1 18 ASN C C -5.644 -0.076 -6.088 1.00 . A A . 18 ASN C 1 1 16 12029 1 1 18 ASN CA C -4.733 0.728 -7.070 1.00 . A A . 18 ASN CA 1 1 16 12030 1 1 18 ASN CB C -3.372 0.066 -7.489 1.00 . A A . 18 ASN CB 1 1 16 12031 1 1 18 ASN CG C -3.553 -0.841 -8.673 1.00 . A A . 18 ASN CG 1 1 16 12032 1 1 18 ASN H H -3.367 2.321 -6.727 1.00 . A A . 18 ASN H 1 1 16 12033 1 1 18 ASN HA H -5.381 0.959 -7.899 1.00 . A A . 18 ASN HA 1 1 16 12034 1 1 18 ASN HB2 H -2.685 0.835 -7.820 1.00 . A A . 18 ASN HB2 1 1 16 12035 1 1 18 ASN HB3 H -2.912 -0.489 -6.695 1.00 . A A . 18 ASN HB3 1 1 16 12036 1 1 18 ASN HD21 H -3.870 0.692 -9.827 1.00 . A A . 18 ASN HD21 1 1 16 12037 1 1 18 ASN HD22 H -3.942 -0.849 -10.587 1.00 . A A . 18 ASN HD22 1 1 16 12038 1 1 18 ASN N N -4.267 2.036 -6.502 1.00 . A A . 18 ASN N 1 1 16 12039 1 1 18 ASN ND2 N -3.813 -0.293 -9.801 1.00 . A A . 18 ASN ND2 1 1 16 12040 1 1 18 ASN O O -6.565 -0.773 -6.472 1.00 . A A . 18 ASN O 1 1 16 12041 1 1 18 ASN OD1 O -3.461 -2.046 -8.606 1.00 . A A . 18 ASN OD1 1 1 16 12042 1 1 19 TYR C C -6.899 0.444 -2.894 1.00 . A A . 19 TYR C 1 1 16 12043 1 1 19 TYR CA C -6.134 -0.642 -3.728 1.00 . A A . 19 TYR CA 1 1 16 12044 1 1 19 TYR CB C -5.028 -1.497 -2.940 1.00 . A A . 19 TYR CB 1 1 16 12045 1 1 19 TYR CD1 C -4.832 -3.078 -4.897 1.00 . A A . 19 TYR CD1 1 1 16 12046 1 1 19 TYR CD2 C -2.901 -1.900 -4.223 1.00 . A A . 19 TYR CD2 1 1 16 12047 1 1 19 TYR CE1 C -4.115 -3.670 -5.916 1.00 . A A . 19 TYR CE1 1 1 16 12048 1 1 19 TYR CE2 C -2.187 -2.495 -5.243 1.00 . A A . 19 TYR CE2 1 1 16 12049 1 1 19 TYR CG C -4.227 -2.187 -4.046 1.00 . A A . 19 TYR CG 1 1 16 12050 1 1 19 TYR CZ C -2.793 -3.376 -6.087 1.00 . A A . 19 TYR CZ 1 1 16 12051 1 1 19 TYR H H -4.604 0.646 -4.611 1.00 . A A . 19 TYR H 1 1 16 12052 1 1 19 TYR HA H -6.878 -1.285 -4.172 1.00 . A A . 19 TYR HA 1 1 16 12053 1 1 19 TYR HB2 H -4.346 -0.912 -2.340 1.00 . A A . 19 TYR HB2 1 1 16 12054 1 1 19 TYR HB3 H -5.426 -2.284 -2.313 1.00 . A A . 19 TYR HB3 1 1 16 12055 1 1 19 TYR HD1 H -5.875 -3.308 -4.760 1.00 . A A . 19 TYR HD1 1 1 16 12056 1 1 19 TYR HD2 H -2.423 -1.201 -3.554 1.00 . A A . 19 TYR HD2 1 1 16 12057 1 1 19 TYR HE1 H -4.588 -4.365 -6.588 1.00 . A A . 19 TYR HE1 1 1 16 12058 1 1 19 TYR HE2 H -1.143 -2.270 -5.390 1.00 . A A . 19 TYR HE2 1 1 16 12059 1 1 19 TYR HH H -2.473 -3.468 -7.857 1.00 . A A . 19 TYR HH 1 1 16 12060 1 1 19 TYR N N -5.357 0.059 -4.823 1.00 . A A . 19 TYR N 1 1 16 12061 1 1 19 TYR O O -7.891 0.209 -2.225 1.00 . A A . 19 TYR O 1 1 16 12062 1 1 19 TYR OH O -2.084 -3.946 -7.108 1.00 . A A . 19 TYR OH 1 1 16 12063 1 1 20 CYS C C -7.358 3.904 -3.452 1.00 . A A . 20 CYS C 1 1 16 12064 1 1 20 CYS CA C -6.821 2.911 -2.373 1.00 . A A . 20 CYS CA 1 1 16 12065 1 1 20 CYS CB C -5.625 3.478 -1.668 1.00 . A A . 20 CYS CB 1 1 16 12066 1 1 20 CYS H H -5.588 1.695 -3.581 1.00 . A A . 20 CYS H 1 1 16 12067 1 1 20 CYS HA H -7.575 2.787 -1.614 1.00 . A A . 20 CYS HA 1 1 16 12068 1 1 20 CYS HB2 H -4.993 2.679 -1.346 1.00 . A A . 20 CYS HB2 1 1 16 12069 1 1 20 CYS HB3 H -5.045 4.043 -2.384 1.00 . A A . 20 CYS HB3 1 1 16 12070 1 1 20 CYS HG H -5.848 5.486 -0.529 1.00 . A A . 20 CYS HG 1 1 16 12071 1 1 20 CYS N N -6.375 1.628 -3.007 1.00 . A A . 20 CYS N 1 1 16 12072 1 1 20 CYS O O -6.778 4.932 -3.731 1.00 . A A . 20 CYS O 1 1 16 12073 1 1 20 CYS SG S -6.032 4.574 -0.290 1.00 . A A . 20 CYS SG 1 1 16 12074 1 1 21 ASN C C -10.577 4.550 -5.090 1.00 . A A . 21 ASN C 1 1 16 12075 1 1 21 ASN CA C -9.038 4.483 -5.110 1.00 . A A . 21 ASN CA 1 1 16 12076 1 1 21 ASN CB C -8.486 3.991 -6.491 1.00 . A A . 21 ASN CB 1 1 16 12077 1 1 21 ASN CG C -8.499 2.488 -6.597 1.00 . A A . 21 ASN CG 1 1 16 12078 1 1 21 ASN H H -8.881 2.729 -3.808 1.00 . A A . 21 ASN H 1 1 16 12079 1 1 21 ASN HA H -8.690 5.494 -4.937 1.00 . A A . 21 ASN HA 1 1 16 12080 1 1 21 ASN HB2 H -9.035 4.384 -7.330 1.00 . A A . 21 ASN HB2 1 1 16 12081 1 1 21 ASN HB3 H -7.454 4.298 -6.594 1.00 . A A . 21 ASN HB3 1 1 16 12082 1 1 21 ASN HD21 H -6.968 2.487 -7.812 1.00 . A A . 21 ASN HD21 1 1 16 12083 1 1 21 ASN HD22 H -7.617 0.951 -7.433 1.00 . A A . 21 ASN HD22 1 1 16 12084 1 1 21 ASN N N -8.456 3.573 -4.056 1.00 . A A . 21 ASN N 1 1 16 12085 1 1 21 ASN ND2 N -7.626 1.920 -7.343 1.00 . A A . 21 ASN ND2 1 1 16 12086 1 1 21 ASN O O -11.171 4.719 -4.041 1.00 . A A . 21 ASN O 1 1 16 12087 1 1 21 ASN OD1 O -9.307 1.804 -6.000 1.00 . A A . 21 ASN OD1 1 1 16 12088 2 2 1 PHE C C 10.794 6.046 -2.062 1.00 . B B . 1 PHE C 1 1 16 12089 2 2 1 PHE CA C 11.182 6.652 -3.444 1.00 . B B . 1 PHE CA 1 1 16 12090 2 2 1 PHE CB C 9.990 6.677 -4.450 1.00 . B B . 1 PHE CB 1 1 16 12091 2 2 1 PHE CD1 C 9.267 9.029 -3.885 1.00 . B B . 1 PHE CD1 1 1 16 12092 2 2 1 PHE CD2 C 7.638 7.301 -3.756 1.00 . B B . 1 PHE CD2 1 1 16 12093 2 2 1 PHE CE1 C 8.324 9.956 -3.496 1.00 . B B . 1 PHE CE1 1 1 16 12094 2 2 1 PHE CE2 C 6.692 8.226 -3.366 1.00 . B B . 1 PHE CE2 1 1 16 12095 2 2 1 PHE CG C 8.932 7.696 -4.017 1.00 . B B . 1 PHE CG 1 1 16 12096 2 2 1 PHE CZ C 7.034 9.555 -3.235 1.00 . B B . 1 PHE CZ 1 1 16 12097 2 2 1 PHE HA H 11.553 7.650 -3.266 1.00 . B B . 1 PHE HA 1 1 16 12098 2 2 1 PHE HB2 H 10.341 6.948 -5.435 1.00 . B B . 1 PHE HB2 1 1 16 12099 2 2 1 PHE HB3 H 9.530 5.700 -4.514 1.00 . B B . 1 PHE HB3 1 1 16 12100 2 2 1 PHE HD1 H 10.276 9.352 -4.093 1.00 . B B . 1 PHE HD1 1 1 16 12101 2 2 1 PHE HD2 H 7.357 6.260 -3.858 1.00 . B B . 1 PHE HD2 1 1 16 12102 2 2 1 PHE HE1 H 8.597 10.998 -3.395 1.00 . B B . 1 PHE HE1 1 1 16 12103 2 2 1 PHE HE2 H 5.679 7.907 -3.165 1.00 . B B . 1 PHE HE2 1 1 16 12104 2 2 1 PHE HZ H 6.289 10.279 -2.930 1.00 . B B . 1 PHE HZ 1 1 16 12105 2 2 1 PHE N N 12.268 5.859 -4.112 1.00 . B B . 1 PHE N 1 1 16 12106 2 2 1 PHE O O 11.470 5.156 -1.592 1.00 . B B . 1 PHE O 1 1 16 12107 2 2 2 VAL C C 9.285 4.556 0.132 1.00 . B B . 2 VAL C 1 1 16 12108 2 2 2 VAL CA C 9.192 6.089 -0.104 1.00 . B B . 2 VAL CA 1 1 16 12109 2 2 2 VAL CB C 7.743 6.558 -0.020 1.00 . B B . 2 VAL CB 1 1 16 12110 2 2 2 VAL CG1 C 7.124 6.197 1.347 1.00 . B B . 2 VAL CG1 1 1 16 12111 2 2 2 VAL CG2 C 7.666 8.090 -0.142 1.00 . B B . 2 VAL CG2 1 1 16 12112 2 2 2 VAL H H 9.265 7.242 -1.906 1.00 . B B . 2 VAL H 1 1 16 12113 2 2 2 VAL HA H 9.798 6.535 0.663 1.00 . B B . 2 VAL HA 1 1 16 12114 2 2 2 VAL HB H 7.259 6.036 -0.827 1.00 . B B . 2 VAL HB 1 1 16 12115 2 2 2 VAL HG11 H 7.674 6.660 2.153 1.00 . B B . 2 VAL HG11 1 1 16 12116 2 2 2 VAL HG12 H 6.103 6.548 1.392 1.00 . B B . 2 VAL HG12 1 1 16 12117 2 2 2 VAL HG13 H 7.116 5.128 1.507 1.00 . B B . 2 VAL HG13 1 1 16 12118 2 2 2 VAL HG21 H 8.067 8.434 -1.081 1.00 . B B . 2 VAL HG21 1 1 16 12119 2 2 2 VAL HG22 H 6.637 8.412 -0.084 1.00 . B B . 2 VAL HG22 1 1 16 12120 2 2 2 VAL HG23 H 8.216 8.566 0.658 1.00 . B B . 2 VAL HG23 1 1 16 12121 2 2 2 VAL N N 9.747 6.537 -1.452 1.00 . B B . 2 VAL N 1 1 16 12122 2 2 2 VAL O O 8.372 3.768 0.008 1.00 . B B . 2 VAL O 1 1 16 12123 2 2 3 ASN C C 10.243 1.662 0.896 1.00 . B B . 3 ASN C 1 1 16 12124 2 2 3 ASN CA C 11.121 2.944 0.795 1.00 . B B . 3 ASN CA 1 1 16 12125 2 2 3 ASN CB C 11.908 3.255 2.093 1.00 . B B . 3 ASN CB 1 1 16 12126 2 2 3 ASN CG C 12.850 4.437 1.893 1.00 . B B . 3 ASN CG 1 1 16 12127 2 2 3 ASN H H 11.030 5.079 0.469 1.00 . B B . 3 ASN H 1 1 16 12128 2 2 3 ASN HA H 11.839 2.716 0.017 1.00 . B B . 3 ASN HA 1 1 16 12129 2 2 3 ASN HB2 H 11.239 3.503 2.902 1.00 . B B . 3 ASN HB2 1 1 16 12130 2 2 3 ASN HB3 H 12.505 2.407 2.393 1.00 . B B . 3 ASN HB3 1 1 16 12131 2 2 3 ASN HD21 H 12.533 4.767 -0.058 1.00 . B B . 3 ASN HD21 1 1 16 12132 2 2 3 ASN HD22 H 13.631 5.777 0.763 1.00 . B B . 3 ASN HD22 1 1 16 12133 2 2 3 ASN N N 10.495 4.269 0.461 1.00 . B B . 3 ASN N 1 1 16 12134 2 2 3 ASN ND2 N 13.001 5.032 0.756 1.00 . B B . 3 ASN ND2 1 1 16 12135 2 2 3 ASN O O 10.297 0.904 1.841 1.00 . B B . 3 ASN O 1 1 16 12136 2 2 3 ASN OD1 O 13.505 4.882 2.798 1.00 . B B . 3 ASN OD1 1 1 16 12137 2 2 4 GLN C C 8.291 -0.722 0.644 1.00 . B B . 4 GLN C 1 1 16 12138 2 2 4 GLN CA C 8.490 0.403 -0.410 1.00 . B B . 4 GLN CA 1 1 16 12139 2 2 4 GLN CB C 8.919 -0.215 -1.737 1.00 . B B . 4 GLN CB 1 1 16 12140 2 2 4 GLN CD C 10.239 1.798 -2.694 1.00 . B B . 4 GLN CD 1 1 16 12141 2 2 4 GLN CG C 9.064 0.850 -2.907 1.00 . B B . 4 GLN CG 1 1 16 12142 2 2 4 GLN H H 9.543 2.234 -0.783 1.00 . B B . 4 GLN H 1 1 16 12143 2 2 4 GLN HA H 7.521 0.848 -0.565 1.00 . B B . 4 GLN HA 1 1 16 12144 2 2 4 GLN HB2 H 9.876 -0.695 -1.570 1.00 . B B . 4 GLN HB2 1 1 16 12145 2 2 4 GLN HB3 H 8.191 -0.972 -1.995 1.00 . B B . 4 GLN HB3 1 1 16 12146 2 2 4 GLN HE21 H 9.225 3.365 -3.239 1.00 . B B . 4 GLN HE21 1 1 16 12147 2 2 4 GLN HE22 H 10.847 3.639 -2.746 1.00 . B B . 4 GLN HE22 1 1 16 12148 2 2 4 GLN HG2 H 9.205 0.389 -3.865 1.00 . B B . 4 GLN HG2 1 1 16 12149 2 2 4 GLN HG3 H 8.176 1.448 -2.973 1.00 . B B . 4 GLN HG3 1 1 16 12150 2 2 4 GLN N N 9.469 1.513 -0.134 1.00 . B B . 4 GLN N 1 1 16 12151 2 2 4 GLN NE2 N 10.089 3.047 -2.913 1.00 . B B . 4 GLN NE2 1 1 16 12152 2 2 4 GLN O O 7.185 -1.055 1.025 1.00 . B B . 4 GLN O 1 1 16 12153 2 2 4 GLN OE1 O 11.326 1.443 -2.319 1.00 . B B . 4 GLN OE1 1 1 16 12154 2 2 5 HIS C C 9.190 -1.782 3.548 1.00 . B B . 5 HIS C 1 1 16 12155 2 2 5 HIS CA C 9.242 -2.399 2.122 1.00 . B B . 5 HIS CA 1 1 16 12156 2 2 5 HIS CB C 10.464 -3.370 1.939 1.00 . B B . 5 HIS CB 1 1 16 12157 2 2 5 HIS CD2 C 12.354 -1.637 1.317 1.00 . B B . 5 HIS CD2 1 1 16 12158 2 2 5 HIS CE1 C 12.921 -2.488 -0.485 1.00 . B B . 5 HIS CE1 1 1 16 12159 2 2 5 HIS CG C 11.573 -2.750 1.114 1.00 . B B . 5 HIS CG 1 1 16 12160 2 2 5 HIS H H 10.238 -1.020 0.787 1.00 . B B . 5 HIS H 1 1 16 12161 2 2 5 HIS HA H 8.311 -2.917 1.949 1.00 . B B . 5 HIS HA 1 1 16 12162 2 2 5 HIS HB2 H 10.882 -3.640 2.899 1.00 . B B . 5 HIS HB2 1 1 16 12163 2 2 5 HIS HB3 H 10.147 -4.272 1.447 1.00 . B B . 5 HIS HB3 1 1 16 12164 2 2 5 HIS HD1 H 11.565 -4.040 -0.404 1.00 . B B . 5 HIS HD1 1 1 16 12165 2 2 5 HIS HD2 H 12.284 -0.989 2.179 1.00 . B B . 5 HIS HD2 1 1 16 12166 2 2 5 HIS HE1 H 13.444 -2.660 -1.416 1.00 . B B . 5 HIS HE1 1 1 16 12167 2 2 5 HIS N N 9.357 -1.305 1.103 1.00 . B B . 5 HIS N 1 1 16 12168 2 2 5 HIS ND1 N 11.967 -3.230 -0.008 1.00 . B B . 5 HIS ND1 1 1 16 12169 2 2 5 HIS NE2 N 13.192 -1.485 0.313 1.00 . B B . 5 HIS NE2 1 1 16 12170 2 2 5 HIS O O 9.992 -1.994 4.434 1.00 . B B . 5 HIS O 1 1 16 12171 2 2 6 LEU C C 6.590 -1.016 5.622 1.00 . B B . 6 LEU C 1 1 16 12172 2 2 6 LEU CA C 7.752 -0.228 4.880 1.00 . B B . 6 LEU CA 1 1 16 12173 2 2 6 LEU CB C 7.437 1.184 4.175 1.00 . B B . 6 LEU CB 1 1 16 12174 2 2 6 LEU CD1 C 7.919 2.632 6.191 1.00 . B B . 6 LEU CD1 1 1 16 12175 2 2 6 LEU CD2 C 7.140 3.647 4.085 1.00 . B B . 6 LEU CD2 1 1 16 12176 2 2 6 LEU CG C 7.014 2.432 5.005 1.00 . B B . 6 LEU CG 1 1 16 12177 2 2 6 LEU H H 7.594 -0.925 2.863 1.00 . B B . 6 LEU H 1 1 16 12178 2 2 6 LEU HA H 8.591 -0.151 5.558 1.00 . B B . 6 LEU HA 1 1 16 12179 2 2 6 LEU HB2 H 8.299 1.456 3.594 1.00 . B B . 6 LEU HB2 1 1 16 12180 2 2 6 LEU HB3 H 6.665 1.031 3.439 1.00 . B B . 6 LEU HB3 1 1 16 12181 2 2 6 LEU HD11 H 8.941 2.757 5.870 1.00 . B B . 6 LEU HD11 1 1 16 12182 2 2 6 LEU HD12 H 7.607 3.504 6.746 1.00 . B B . 6 LEU HD12 1 1 16 12183 2 2 6 LEU HD13 H 7.852 1.769 6.840 1.00 . B B . 6 LEU HD13 1 1 16 12184 2 2 6 LEU HD21 H 6.500 3.511 3.223 1.00 . B B . 6 LEU HD21 1 1 16 12185 2 2 6 LEU HD22 H 6.832 4.548 4.595 1.00 . B B . 6 LEU HD22 1 1 16 12186 2 2 6 LEU HD23 H 8.153 3.766 3.736 1.00 . B B . 6 LEU HD23 1 1 16 12187 2 2 6 LEU HG H 5.978 2.445 5.290 1.00 . B B . 6 LEU HG 1 1 16 12188 2 2 6 LEU N N 8.153 -1.008 3.661 1.00 . B B . 6 LEU N 1 1 16 12189 2 2 6 LEU O O 6.318 -0.837 6.789 1.00 . B B . 6 LEU O 1 1 16 12190 2 2 7 CYS C C 3.762 -2.800 6.163 1.00 . B B . 7 CYS C 1 1 16 12191 2 2 7 CYS CA C 4.849 -2.881 5.045 1.00 . B B . 7 CYS CA 1 1 16 12192 2 2 7 CYS CB C 5.515 -4.274 5.083 1.00 . B B . 7 CYS CB 1 1 16 12193 2 2 7 CYS H H 6.405 -1.957 3.976 1.00 . B B . 7 CYS H 1 1 16 12194 2 2 7 CYS HA H 4.219 -2.676 4.201 1.00 . B B . 7 CYS HA 1 1 16 12195 2 2 7 CYS HB2 H 6.136 -4.388 4.210 1.00 . B B . 7 CYS HB2 1 1 16 12196 2 2 7 CYS HB3 H 6.179 -4.299 5.935 1.00 . B B . 7 CYS HB3 1 1 16 12197 2 2 7 CYS HG H 4.357 -5.978 6.109 1.00 . B B . 7 CYS HG 1 1 16 12198 2 2 7 CYS N N 6.004 -1.897 4.845 1.00 . B B . 7 CYS N 1 1 16 12199 2 2 7 CYS O O 3.850 -2.111 7.147 1.00 . B B . 7 CYS O 1 1 16 12200 2 2 7 CYS SG S 4.459 -5.743 5.183 1.00 . B B . 7 CYS SG 1 1 16 12201 2 2 8 GLY C C 0.975 -2.353 7.255 1.00 . B B . 8 GLY C 1 1 16 12202 2 2 8 GLY CA C 1.492 -3.704 6.787 1.00 . B B . 8 GLY CA 1 1 16 12203 2 2 8 GLY H H 2.777 -4.087 5.093 1.00 . B B . 8 GLY H 1 1 16 12204 2 2 8 GLY HA2 H 0.688 -4.170 6.241 1.00 . B B . 8 GLY HA2 1 1 16 12205 2 2 8 GLY HA3 H 1.721 -4.281 7.670 1.00 . B B . 8 GLY HA3 1 1 16 12206 2 2 8 GLY N N 2.725 -3.568 5.908 1.00 . B B . 8 GLY N 1 1 16 12207 2 2 8 GLY O O 0.172 -1.710 6.606 1.00 . B B . 8 GLY O 1 1 16 12208 2 2 9 ASP C C 1.511 0.447 8.002 1.00 . B B . 9 ASP C 1 1 16 12209 2 2 9 ASP CA C 1.123 -0.676 9.013 1.00 . B B . 9 ASP CA 1 1 16 12210 2 2 9 ASP CB C 1.918 -0.761 10.335 1.00 . B B . 9 ASP CB 1 1 16 12211 2 2 9 ASP CG C 1.488 -2.033 11.041 1.00 . B B . 9 ASP CG 1 1 16 12212 2 2 9 ASP H H 2.135 -2.554 8.808 1.00 . B B . 9 ASP H 1 1 16 12213 2 2 9 ASP HA H 0.051 -0.635 9.177 1.00 . B B . 9 ASP HA 1 1 16 12214 2 2 9 ASP HB2 H 2.982 -0.813 10.175 1.00 . B B . 9 ASP HB2 1 1 16 12215 2 2 9 ASP HB3 H 1.682 0.064 10.985 1.00 . B B . 9 ASP HB3 1 1 16 12216 2 2 9 ASP N N 1.481 -1.967 8.366 1.00 . B B . 9 ASP N 1 1 16 12217 2 2 9 ASP O O 0.782 1.371 7.696 1.00 . B B . 9 ASP O 1 1 16 12218 2 2 9 ASP OD1 O 0.506 -1.941 11.748 1.00 . B B . 9 ASP OD1 1 1 16 12219 2 2 9 ASP OD2 O 2.174 -3.011 10.801 1.00 . B B . 9 ASP OD2 1 1 16 12220 2 2 10 HIS C C 2.208 1.691 5.398 1.00 . B B . 10 HIS C 1 1 16 12221 2 2 10 HIS CA C 3.188 1.323 6.480 1.00 . B B . 10 HIS CA 1 1 16 12222 2 2 10 HIS CB C 4.405 0.757 5.794 1.00 . B B . 10 HIS CB 1 1 16 12223 2 2 10 HIS CD2 C 4.528 0.192 3.154 1.00 . B B . 10 HIS CD2 1 1 16 12224 2 2 10 HIS CE1 C 4.367 2.119 2.423 1.00 . B B . 10 HIS CE1 1 1 16 12225 2 2 10 HIS CG C 4.433 1.034 4.250 1.00 . B B . 10 HIS CG 1 1 16 12226 2 2 10 HIS H H 3.263 -0.440 7.710 1.00 . B B . 10 HIS H 1 1 16 12227 2 2 10 HIS HA H 3.402 2.242 7.007 1.00 . B B . 10 HIS HA 1 1 16 12228 2 2 10 HIS HB2 H 5.294 1.077 6.303 1.00 . B B . 10 HIS HB2 1 1 16 12229 2 2 10 HIS HB3 H 4.316 -0.305 5.906 1.00 . B B . 10 HIS HB3 1 1 16 12230 2 2 10 HIS HD1 H 4.253 3.035 4.236 1.00 . B B . 10 HIS HD1 1 1 16 12231 2 2 10 HIS HD2 H 4.624 -0.875 3.182 1.00 . B B . 10 HIS HD2 1 1 16 12232 2 2 10 HIS HE1 H 4.305 2.951 1.734 1.00 . B B . 10 HIS HE1 1 1 16 12233 2 2 10 HIS N N 2.690 0.327 7.469 1.00 . B B . 10 HIS N 1 1 16 12234 2 2 10 HIS ND1 N 4.337 2.206 3.718 1.00 . B B . 10 HIS ND1 1 1 16 12235 2 2 10 HIS NE2 N 4.485 0.880 2.033 1.00 . B B . 10 HIS NE2 1 1 16 12236 2 2 10 HIS O O 1.761 2.804 5.207 1.00 . B B . 10 HIS O 1 1 16 12237 2 2 11 LEU C C -0.370 1.143 4.066 1.00 . B B . 11 LEU C 1 1 16 12238 2 2 11 LEU CA C 1.035 0.795 3.582 1.00 . B B . 11 LEU CA 1 1 16 12239 2 2 11 LEU CB C 1.131 -0.484 2.756 1.00 . B B . 11 LEU CB 1 1 16 12240 2 2 11 LEU CD1 C -0.809 -1.899 3.247 1.00 . B B . 11 LEU CD1 1 1 16 12241 2 2 11 LEU CD2 C 1.427 -2.834 2.766 1.00 . B B . 11 LEU CD2 1 1 16 12242 2 2 11 LEU CG C 0.690 -1.729 3.470 1.00 . B B . 11 LEU CG 1 1 16 12243 2 2 11 LEU H H 2.348 -0.216 4.934 1.00 . B B . 11 LEU H 1 1 16 12244 2 2 11 LEU HA H 1.518 1.591 3.023 1.00 . B B . 11 LEU HA 1 1 16 12245 2 2 11 LEU HB2 H 0.524 -0.324 1.882 1.00 . B B . 11 LEU HB2 1 1 16 12246 2 2 11 LEU HB3 H 2.152 -0.563 2.406 1.00 . B B . 11 LEU HB3 1 1 16 12247 2 2 11 LEU HD11 H -1.367 -1.045 3.599 1.00 . B B . 11 LEU HD11 1 1 16 12248 2 2 11 LEU HD12 H -1.002 -1.998 2.193 1.00 . B B . 11 LEU HD12 1 1 16 12249 2 2 11 LEU HD13 H -1.176 -2.769 3.761 1.00 . B B . 11 LEU HD13 1 1 16 12250 2 2 11 LEU HD21 H 1.164 -2.827 1.716 1.00 . B B . 11 LEU HD21 1 1 16 12251 2 2 11 LEU HD22 H 2.488 -2.642 2.847 1.00 . B B . 11 LEU HD22 1 1 16 12252 2 2 11 LEU HD23 H 1.187 -3.787 3.200 1.00 . B B . 11 LEU HD23 1 1 16 12253 2 2 11 LEU HG H 0.938 -1.696 4.521 1.00 . B B . 11 LEU HG 1 1 16 12254 2 2 11 LEU N N 1.938 0.635 4.694 1.00 . B B . 11 LEU N 1 1 16 12255 2 2 11 LEU O O -0.993 1.935 3.407 1.00 . B B . 11 LEU O 1 1 16 12256 2 2 12 VAL C C -2.201 2.681 5.603 1.00 . B B . 12 VAL C 1 1 16 12257 2 2 12 VAL CA C -2.319 1.138 5.430 1.00 . B B . 12 VAL CA 1 1 16 12258 2 2 12 VAL CB C -2.896 0.515 6.718 1.00 . B B . 12 VAL CB 1 1 16 12259 2 2 12 VAL CG1 C -1.999 0.768 7.909 1.00 . B B . 12 VAL CG1 1 1 16 12260 2 2 12 VAL CG2 C -4.215 1.261 6.970 1.00 . B B . 12 VAL CG2 1 1 16 12261 2 2 12 VAL H H -0.477 -0.061 5.685 1.00 . B B . 12 VAL H 1 1 16 12262 2 2 12 VAL HA H -2.966 0.959 4.588 1.00 . B B . 12 VAL HA 1 1 16 12263 2 2 12 VAL HB H -3.024 -0.551 6.566 1.00 . B B . 12 VAL HB 1 1 16 12264 2 2 12 VAL HG11 H -1.831 1.822 8.096 1.00 . B B . 12 VAL HG11 1 1 16 12265 2 2 12 VAL HG12 H -2.394 0.333 8.809 1.00 . B B . 12 VAL HG12 1 1 16 12266 2 2 12 VAL HG13 H -1.060 0.299 7.693 1.00 . B B . 12 VAL HG13 1 1 16 12267 2 2 12 VAL HG21 H -4.865 1.185 6.110 1.00 . B B . 12 VAL HG21 1 1 16 12268 2 2 12 VAL HG22 H -4.724 0.899 7.845 1.00 . B B . 12 VAL HG22 1 1 16 12269 2 2 12 VAL HG23 H -4.014 2.316 7.121 1.00 . B B . 12 VAL HG23 1 1 16 12270 2 2 12 VAL N N -0.926 0.620 5.133 1.00 . B B . 12 VAL N 1 1 16 12271 2 2 12 VAL O O -2.989 3.419 5.035 1.00 . B B . 12 VAL O 1 1 16 12272 2 2 13 GLU C C -1.013 5.203 5.119 1.00 . B B . 13 GLU C 1 1 16 12273 2 2 13 GLU CA C -1.078 4.624 6.541 1.00 . B B . 13 GLU CA 1 1 16 12274 2 2 13 GLU CB C 0.218 4.876 7.355 1.00 . B B . 13 GLU CB 1 1 16 12275 2 2 13 GLU CD C -1.174 5.319 9.519 1.00 . B B . 13 GLU CD 1 1 16 12276 2 2 13 GLU CG C -0.077 4.479 8.853 1.00 . B B . 13 GLU CG 1 1 16 12277 2 2 13 GLU H H -0.609 2.532 6.820 1.00 . B B . 13 GLU H 1 1 16 12278 2 2 13 GLU HA H -1.938 5.032 7.037 1.00 . B B . 13 GLU HA 1 1 16 12279 2 2 13 GLU HB2 H 1.039 4.294 6.964 1.00 . B B . 13 GLU HB2 1 1 16 12280 2 2 13 GLU HB3 H 0.471 5.927 7.310 1.00 . B B . 13 GLU HB3 1 1 16 12281 2 2 13 GLU HG2 H -0.380 3.447 8.926 1.00 . B B . 13 GLU HG2 1 1 16 12282 2 2 13 GLU HG3 H 0.801 4.615 9.458 1.00 . B B . 13 GLU HG3 1 1 16 12283 2 2 13 GLU N N -1.234 3.140 6.363 1.00 . B B . 13 GLU N 1 1 16 12284 2 2 13 GLU O O -1.637 6.183 4.749 1.00 . B B . 13 GLU O 1 1 16 12285 2 2 13 GLU OE1 O -1.382 6.439 9.087 1.00 . B B . 13 GLU OE1 1 1 16 12286 2 2 13 GLU OE2 O -1.741 4.770 10.446 1.00 . B B . 13 GLU OE2 1 1 16 12287 2 2 14 ALA C C -1.424 5.114 2.237 1.00 . B B . 14 ALA C 1 1 16 12288 2 2 14 ALA CA C -0.046 4.947 2.914 1.00 . B B . 14 ALA CA 1 1 16 12289 2 2 14 ALA CB C 0.850 3.847 2.237 1.00 . B B . 14 ALA CB 1 1 16 12290 2 2 14 ALA H H 0.270 3.767 4.669 1.00 . B B . 14 ALA H 1 1 16 12291 2 2 14 ALA HA H 0.339 5.929 2.976 1.00 . B B . 14 ALA HA 1 1 16 12292 2 2 14 ALA HB1 H 1.743 3.650 2.814 1.00 . B B . 14 ALA HB1 1 1 16 12293 2 2 14 ALA HB2 H 0.325 2.913 2.134 1.00 . B B . 14 ALA HB2 1 1 16 12294 2 2 14 ALA HB3 H 1.135 4.118 1.244 1.00 . B B . 14 ALA HB3 1 1 16 12295 2 2 14 ALA N N -0.220 4.538 4.321 1.00 . B B . 14 ALA N 1 1 16 12296 2 2 14 ALA O O -1.704 6.100 1.584 1.00 . B B . 14 ALA O 1 1 16 12297 2 2 15 LEU C C -4.336 5.434 2.333 1.00 . B B . 15 LEU C 1 1 16 12298 2 2 15 LEU CA C -3.622 4.146 1.837 1.00 . B B . 15 LEU CA 1 1 16 12299 2 2 15 LEU CB C -4.377 2.868 2.283 1.00 . B B . 15 LEU CB 1 1 16 12300 2 2 15 LEU CD1 C -4.540 0.428 2.379 1.00 . B B . 15 LEU CD1 1 1 16 12301 2 2 15 LEU CD2 C -3.813 1.429 0.300 1.00 . B B . 15 LEU CD2 1 1 16 12302 2 2 15 LEU CG C -3.700 1.552 1.799 1.00 . B B . 15 LEU CG 1 1 16 12303 2 2 15 LEU H H -1.904 3.390 2.970 1.00 . B B . 15 LEU H 1 1 16 12304 2 2 15 LEU HA H -3.560 4.191 0.764 1.00 . B B . 15 LEU HA 1 1 16 12305 2 2 15 LEU HB2 H -4.504 2.869 3.354 1.00 . B B . 15 LEU HB2 1 1 16 12306 2 2 15 LEU HB3 H -5.357 2.929 1.838 1.00 . B B . 15 LEU HB3 1 1 16 12307 2 2 15 LEU HD11 H -4.609 0.511 3.452 1.00 . B B . 15 LEU HD11 1 1 16 12308 2 2 15 LEU HD12 H -5.533 0.502 1.973 1.00 . B B . 15 LEU HD12 1 1 16 12309 2 2 15 LEU HD13 H -4.134 -0.540 2.135 1.00 . B B . 15 LEU HD13 1 1 16 12310 2 2 15 LEU HD21 H -3.359 2.284 -0.179 1.00 . B B . 15 LEU HD21 1 1 16 12311 2 2 15 LEU HD22 H -3.302 0.550 -0.050 1.00 . B B . 15 LEU HD22 1 1 16 12312 2 2 15 LEU HD23 H -4.853 1.354 0.024 1.00 . B B . 15 LEU HD23 1 1 16 12313 2 2 15 LEU HG H -2.660 1.442 2.052 1.00 . B B . 15 LEU HG 1 1 16 12314 2 2 15 LEU N N -2.245 4.127 2.424 1.00 . B B . 15 LEU N 1 1 16 12315 2 2 15 LEU O O -4.870 6.171 1.530 1.00 . B B . 15 LEU O 1 1 16 12316 2 2 16 TYR C C -4.431 8.166 3.418 1.00 . B B . 16 TYR C 1 1 16 12317 2 2 16 TYR CA C -5.000 6.920 4.166 1.00 . B B . 16 TYR CA 1 1 16 12318 2 2 16 TYR CB C -4.712 7.110 5.682 1.00 . B B . 16 TYR CB 1 1 16 12319 2 2 16 TYR CD1 C -6.233 5.171 6.415 1.00 . B B . 16 TYR CD1 1 1 16 12320 2 2 16 TYR CD2 C -4.255 5.638 7.631 1.00 . B B . 16 TYR CD2 1 1 16 12321 2 2 16 TYR CE1 C -6.506 4.129 7.293 1.00 . B B . 16 TYR CE1 1 1 16 12322 2 2 16 TYR CE2 C -4.529 4.606 8.496 1.00 . B B . 16 TYR CE2 1 1 16 12323 2 2 16 TYR CG C -5.095 5.934 6.585 1.00 . B B . 16 TYR CG 1 1 16 12324 2 2 16 TYR CZ C -5.655 3.848 8.332 1.00 . B B . 16 TYR CZ 1 1 16 12325 2 2 16 TYR H H -3.884 5.016 4.205 1.00 . B B . 16 TYR H 1 1 16 12326 2 2 16 TYR HA H -6.062 6.888 3.963 1.00 . B B . 16 TYR HA 1 1 16 12327 2 2 16 TYR HB2 H -3.654 7.294 5.815 1.00 . B B . 16 TYR HB2 1 1 16 12328 2 2 16 TYR HB3 H -5.244 7.980 6.038 1.00 . B B . 16 TYR HB3 1 1 16 12329 2 2 16 TYR HD1 H -6.911 5.390 5.601 1.00 . B B . 16 TYR HD1 1 1 16 12330 2 2 16 TYR HD2 H -3.360 6.226 7.788 1.00 . B B . 16 TYR HD2 1 1 16 12331 2 2 16 TYR HE1 H -7.391 3.524 7.176 1.00 . B B . 16 TYR HE1 1 1 16 12332 2 2 16 TYR HE2 H -3.841 4.406 9.305 1.00 . B B . 16 TYR HE2 1 1 16 12333 2 2 16 TYR HH H -5.144 2.831 9.783 1.00 . B B . 16 TYR HH 1 1 16 12334 2 2 16 TYR N N -4.331 5.673 3.624 1.00 . B B . 16 TYR N 1 1 16 12335 2 2 16 TYR O O -5.153 9.022 2.958 1.00 . B B . 16 TYR O 1 1 16 12336 2 2 16 TYR OH O -5.914 2.818 9.205 1.00 . B B . 16 TYR OH 1 1 16 12337 2 2 17 LEU C C -2.861 9.532 1.175 1.00 . B B . 17 LEU C 1 1 16 12338 2 2 17 LEU CA C -2.416 9.352 2.651 1.00 . B B . 17 LEU CA 1 1 16 12339 2 2 17 LEU CB C -0.884 9.049 2.778 1.00 . B B . 17 LEU CB 1 1 16 12340 2 2 17 LEU CD1 C -0.189 11.246 3.771 1.00 . B B . 17 LEU CD1 1 1 16 12341 2 2 17 LEU CD2 C -1.054 9.485 5.282 1.00 . B B . 17 LEU CD2 1 1 16 12342 2 2 17 LEU CG C -0.233 9.732 4.011 1.00 . B B . 17 LEU CG 1 1 16 12343 2 2 17 LEU H H -2.623 7.499 3.772 1.00 . B B . 17 LEU H 1 1 16 12344 2 2 17 LEU HA H -2.677 10.274 3.145 1.00 . B B . 17 LEU HA 1 1 16 12345 2 2 17 LEU HB2 H -0.751 7.981 2.867 1.00 . B B . 17 LEU HB2 1 1 16 12346 2 2 17 LEU HB3 H -0.379 9.373 1.880 1.00 . B B . 17 LEU HB3 1 1 16 12347 2 2 17 LEU HD11 H 0.394 11.463 2.887 1.00 . B B . 17 LEU HD11 1 1 16 12348 2 2 17 LEU HD12 H -1.179 11.653 3.632 1.00 . B B . 17 LEU HD12 1 1 16 12349 2 2 17 LEU HD13 H 0.268 11.745 4.613 1.00 . B B . 17 LEU HD13 1 1 16 12350 2 2 17 LEU HD21 H -2.056 9.878 5.187 1.00 . B B . 17 LEU HD21 1 1 16 12351 2 2 17 LEU HD22 H -1.124 8.425 5.491 1.00 . B B . 17 LEU HD22 1 1 16 12352 2 2 17 LEU HD23 H -0.584 9.959 6.131 1.00 . B B . 17 LEU HD23 1 1 16 12353 2 2 17 LEU HG H 0.772 9.349 4.151 1.00 . B B . 17 LEU HG 1 1 16 12354 2 2 17 LEU N N -3.129 8.222 3.347 1.00 . B B . 17 LEU N 1 1 16 12355 2 2 17 LEU O O -3.058 10.640 0.716 1.00 . B B . 17 LEU O 1 1 16 12356 2 2 18 VAL C C -4.965 8.625 -1.263 1.00 . B B . 18 VAL C 1 1 16 12357 2 2 18 VAL CA C -3.426 8.528 -0.977 1.00 . B B . 18 VAL CA 1 1 16 12358 2 2 18 VAL CB C -2.843 7.291 -1.747 1.00 . B B . 18 VAL CB 1 1 16 12359 2 2 18 VAL CG1 C -3.411 6.010 -1.184 1.00 . B B . 18 VAL CG1 1 1 16 12360 2 2 18 VAL CG2 C -3.332 7.325 -3.210 1.00 . B B . 18 VAL CG2 1 1 16 12361 2 2 18 VAL H H -2.754 7.591 0.908 1.00 . B B . 18 VAL H 1 1 16 12362 2 2 18 VAL HA H -2.972 9.395 -1.428 1.00 . B B . 18 VAL HA 1 1 16 12363 2 2 18 VAL HB H -1.761 7.300 -1.687 1.00 . B B . 18 VAL HB 1 1 16 12364 2 2 18 VAL HG11 H -3.222 5.959 -0.126 1.00 . B B . 18 VAL HG11 1 1 16 12365 2 2 18 VAL HG12 H -4.474 6.011 -1.343 1.00 . B B . 18 VAL HG12 1 1 16 12366 2 2 18 VAL HG13 H -3.004 5.138 -1.662 1.00 . B B . 18 VAL HG13 1 1 16 12367 2 2 18 VAL HG21 H -3.037 8.248 -3.685 1.00 . B B . 18 VAL HG21 1 1 16 12368 2 2 18 VAL HG22 H -2.939 6.489 -3.766 1.00 . B B . 18 VAL HG22 1 1 16 12369 2 2 18 VAL HG23 H -4.415 7.266 -3.250 1.00 . B B . 18 VAL HG23 1 1 16 12370 2 2 18 VAL N N -2.983 8.442 0.468 1.00 . B B . 18 VAL N 1 1 16 12371 2 2 18 VAL O O -5.362 9.440 -2.074 1.00 . B B . 18 VAL O 1 1 16 12372 2 2 19 CYS C C -8.266 8.026 0.267 1.00 . B B . 19 CYS C 1 1 16 12373 2 2 19 CYS CA C -7.288 7.915 -0.938 1.00 . B B . 19 CYS CA 1 1 16 12374 2 2 19 CYS CB C -7.578 6.684 -1.774 1.00 . B B . 19 CYS CB 1 1 16 12375 2 2 19 CYS H H -5.479 7.158 -0.005 1.00 . B B . 19 CYS H 1 1 16 12376 2 2 19 CYS HA H -7.474 8.778 -1.563 1.00 . B B . 19 CYS HA 1 1 16 12377 2 2 19 CYS HB2 H -8.390 6.837 -2.460 1.00 . B B . 19 CYS HB2 1 1 16 12378 2 2 19 CYS HB3 H -6.675 6.538 -2.344 1.00 . B B . 19 CYS HB3 1 1 16 12379 2 2 19 CYS HG H -8.774 5.081 -0.610 1.00 . B B . 19 CYS HG 1 1 16 12380 2 2 19 CYS N N -5.805 7.824 -0.649 1.00 . B B . 19 CYS N 1 1 16 12381 2 2 19 CYS O O -8.085 8.757 1.213 1.00 . B B . 19 CYS O 1 1 16 12382 2 2 19 CYS SG S -7.856 5.139 -0.873 1.00 . B B . 19 CYS SG 1 1 16 12383 2 2 20 GLY C C -10.486 5.656 1.508 1.00 . B B . 20 GLY C 1 1 16 12384 2 2 20 GLY CA C -10.409 7.138 1.134 1.00 . B B . 20 GLY CA 1 1 16 12385 2 2 20 GLY H H -9.412 6.691 -0.628 1.00 . B B . 20 GLY H 1 1 16 12386 2 2 20 GLY HA2 H -10.161 7.707 2.023 1.00 . B B . 20 GLY HA2 1 1 16 12387 2 2 20 GLY HA3 H -11.338 7.465 0.706 1.00 . B B . 20 GLY HA3 1 1 16 12388 2 2 20 GLY N N -9.316 7.253 0.149 1.00 . B B . 20 GLY N 1 1 16 12389 2 2 20 GLY O O -10.016 4.760 0.834 1.00 . B B . 20 GLY O 1 1 16 12390 2 2 21 GLU C C -12.451 3.258 2.585 1.00 . B B . 21 GLU C 1 1 16 12391 2 2 21 GLU CA C -11.391 4.140 3.232 1.00 . B B . 21 GLU CA 1 1 16 12392 2 2 21 GLU CB C -11.707 4.513 4.691 1.00 . B B . 21 GLU CB 1 1 16 12393 2 2 21 GLU CD C -11.176 6.952 5.376 1.00 . B B . 21 GLU CD 1 1 16 12394 2 2 21 GLU CG C -10.604 5.548 5.203 1.00 . B B . 21 GLU CG 1 1 16 12395 2 2 21 GLU H H -11.499 6.273 2.932 1.00 . B B . 21 GLU H 1 1 16 12396 2 2 21 GLU HA H -10.484 3.567 3.213 1.00 . B B . 21 GLU HA 1 1 16 12397 2 2 21 GLU HB2 H -12.689 4.970 4.740 1.00 . B B . 21 GLU HB2 1 1 16 12398 2 2 21 GLU HB3 H -11.717 3.628 5.309 1.00 . B B . 21 GLU HB3 1 1 16 12399 2 2 21 GLU HG2 H -10.168 5.251 6.142 1.00 . B B . 21 GLU HG2 1 1 16 12400 2 2 21 GLU HG3 H -9.803 5.670 4.494 1.00 . B B . 21 GLU HG3 1 1 16 12401 2 2 21 GLU N N -11.145 5.457 2.572 1.00 . B B . 21 GLU N 1 1 16 12402 2 2 21 GLU O O -13.114 2.427 3.171 1.00 . B B . 21 GLU O 1 1 16 12403 2 2 21 GLU OE1 O -11.574 7.487 4.356 1.00 . B B . 21 GLU OE1 1 1 16 12404 2 2 21 GLU OE2 O -11.171 7.381 6.509 1.00 . B B . 21 GLU OE2 1 1 16 12405 2 2 22 ARG C C -13.240 1.206 0.320 1.00 . B B . 22 ARG C 1 1 16 12406 2 2 22 ARG CA C -13.511 2.759 0.428 1.00 . B B . 22 ARG CA 1 1 16 12407 2 2 22 ARG CB C -13.435 3.481 -0.986 1.00 . B B . 22 ARG CB 1 1 16 12408 2 2 22 ARG CD C -11.079 2.586 -1.653 1.00 . B B . 22 ARG CD 1 1 16 12409 2 2 22 ARG CG C -12.571 2.725 -2.072 1.00 . B B . 22 ARG CG 1 1 16 12410 2 2 22 ARG CZ C -11.041 0.461 -2.980 1.00 . B B . 22 ARG CZ 1 1 16 12411 2 2 22 ARG H H -11.977 4.209 1.012 1.00 . B B . 22 ARG H 1 1 16 12412 2 2 22 ARG HA H -14.476 2.911 0.860 1.00 . B B . 22 ARG HA 1 1 16 12413 2 2 22 ARG HB2 H -14.446 3.577 -1.366 1.00 . B B . 22 ARG HB2 1 1 16 12414 2 2 22 ARG HB3 H -13.049 4.484 -0.862 1.00 . B B . 22 ARG HB3 1 1 16 12415 2 2 22 ARG HD2 H -10.561 3.477 -2.009 1.00 . B B . 22 ARG HD2 1 1 16 12416 2 2 22 ARG HD3 H -10.973 2.582 -0.571 1.00 . B B . 22 ARG HD3 1 1 16 12417 2 2 22 ARG HE H -9.496 1.115 -2.154 1.00 . B B . 22 ARG HE 1 1 16 12418 2 2 22 ARG HG2 H -13.040 1.794 -2.340 1.00 . B B . 22 ARG HG2 1 1 16 12419 2 2 22 ARG HG3 H -12.606 3.329 -2.968 1.00 . B B . 22 ARG HG3 1 1 16 12420 2 2 22 ARG HH11 H -12.083 -0.090 -1.468 1.00 . B B . 22 ARG HH11 1 1 16 12421 2 2 22 ARG HH12 H -12.324 -1.013 -2.905 1.00 . B B . 22 ARG HH12 1 1 16 12422 2 2 22 ARG HH21 H -10.139 0.935 -4.665 1.00 . B B . 22 ARG HH21 1 1 16 12423 2 2 22 ARG HH22 H -11.243 -0.369 -4.711 1.00 . B B . 22 ARG HH22 1 1 16 12424 2 2 22 ARG N N -12.557 3.493 1.318 1.00 . B B . 22 ARG N 1 1 16 12425 2 2 22 ARG NE N -10.448 1.336 -2.272 1.00 . B B . 22 ARG NE 1 1 16 12426 2 2 22 ARG NH1 N -11.878 -0.276 -2.421 1.00 . B B . 22 ARG NH1 1 1 16 12427 2 2 22 ARG NH2 N -10.786 0.340 -4.198 1.00 . B B . 22 ARG NH2 1 1 16 12428 2 2 22 ARG O O -13.584 0.546 -0.642 1.00 . B B . 22 ARG O 1 1 16 12429 2 2 23 GLY C C -10.836 -1.231 1.322 1.00 . B B . 23 GLY C 1 1 16 12430 2 2 23 GLY CA C -12.322 -0.875 1.267 1.00 . B B . 23 GLY CA 1 1 16 12431 2 2 23 GLY H H -12.365 1.142 2.082 1.00 . B B . 23 GLY H 1 1 16 12432 2 2 23 GLY HA2 H -12.773 -1.336 2.135 1.00 . B B . 23 GLY HA2 1 1 16 12433 2 2 23 GLY HA3 H -12.747 -1.347 0.395 1.00 . B B . 23 GLY HA3 1 1 16 12434 2 2 23 GLY N N -12.624 0.609 1.301 1.00 . B B . 23 GLY N 1 1 16 12435 2 2 23 GLY O O -10.515 -2.306 1.768 1.00 . B B . 23 GLY O 1 1 16 12436 2 2 24 PHE C C -8.081 -2.137 0.521 1.00 . B B . 24 PHE C 1 1 16 12437 2 2 24 PHE CA C -8.480 -0.677 0.914 1.00 . B B . 24 PHE CA 1 1 16 12438 2 2 24 PHE CB C -7.983 -0.380 2.352 1.00 . B B . 24 PHE CB 1 1 16 12439 2 2 24 PHE CD1 C -7.707 2.115 1.868 1.00 . B B . 24 PHE CD1 1 1 16 12440 2 2 24 PHE CD2 C -8.417 1.437 4.030 1.00 . B B . 24 PHE CD2 1 1 16 12441 2 2 24 PHE CE1 C -7.748 3.434 2.272 1.00 . B B . 24 PHE CE1 1 1 16 12442 2 2 24 PHE CE2 C -8.457 2.755 4.431 1.00 . B B . 24 PHE CE2 1 1 16 12443 2 2 24 PHE CG C -8.040 1.102 2.746 1.00 . B B . 24 PHE CG 1 1 16 12444 2 2 24 PHE CZ C -8.120 3.752 3.548 1.00 . B B . 24 PHE CZ 1 1 16 12445 2 2 24 PHE H H -10.271 0.500 0.517 1.00 . B B . 24 PHE H 1 1 16 12446 2 2 24 PHE HA H -7.964 -0.031 0.221 1.00 . B B . 24 PHE HA 1 1 16 12447 2 2 24 PHE HB2 H -8.614 -0.933 3.034 1.00 . B B . 24 PHE HB2 1 1 16 12448 2 2 24 PHE HB3 H -6.980 -0.747 2.497 1.00 . B B . 24 PHE HB3 1 1 16 12449 2 2 24 PHE HD1 H -7.406 1.887 0.859 1.00 . B B . 24 PHE HD1 1 1 16 12450 2 2 24 PHE HD2 H -8.683 0.657 4.730 1.00 . B B . 24 PHE HD2 1 1 16 12451 2 2 24 PHE HE1 H -7.491 4.234 1.590 1.00 . B B . 24 PHE HE1 1 1 16 12452 2 2 24 PHE HE2 H -8.756 3.015 5.438 1.00 . B B . 24 PHE HE2 1 1 16 12453 2 2 24 PHE HZ H -8.145 4.789 3.855 1.00 . B B . 24 PHE HZ 1 1 16 12454 2 2 24 PHE N N -9.964 -0.359 0.874 1.00 . B B . 24 PHE N 1 1 16 12455 2 2 24 PHE O O -7.689 -2.932 1.349 1.00 . B B . 24 PHE O 1 1 16 12456 2 2 25 PHE C C -6.410 -4.389 -0.839 1.00 . B B . 25 PHE C 1 1 16 12457 2 2 25 PHE CA C -7.831 -3.833 -1.235 1.00 . B B . 25 PHE CA 1 1 16 12458 2 2 25 PHE CB C -7.988 -3.824 -2.789 1.00 . B B . 25 PHE CB 1 1 16 12459 2 2 25 PHE CD1 C -10.548 -3.623 -2.612 1.00 . B B . 25 PHE CD1 1 1 16 12460 2 2 25 PHE CD2 C -9.466 -2.799 -4.557 1.00 . B B . 25 PHE CD2 1 1 16 12461 2 2 25 PHE CE1 C -11.775 -3.256 -3.140 1.00 . B B . 25 PHE CE1 1 1 16 12462 2 2 25 PHE CE2 C -10.685 -2.433 -5.088 1.00 . B B . 25 PHE CE2 1 1 16 12463 2 2 25 PHE CG C -9.379 -3.401 -3.316 1.00 . B B . 25 PHE CG 1 1 16 12464 2 2 25 PHE CZ C -11.846 -2.660 -4.382 1.00 . B B . 25 PHE CZ 1 1 16 12465 2 2 25 PHE H H -8.482 -1.753 -1.363 1.00 . B B . 25 PHE H 1 1 16 12466 2 2 25 PHE HA H -8.540 -4.531 -0.812 1.00 . B B . 25 PHE HA 1 1 16 12467 2 2 25 PHE HB2 H -7.247 -3.162 -3.204 1.00 . B B . 25 PHE HB2 1 1 16 12468 2 2 25 PHE HB3 H -7.782 -4.816 -3.167 1.00 . B B . 25 PHE HB3 1 1 16 12469 2 2 25 PHE HD1 H -10.508 -4.092 -1.637 1.00 . B B . 25 PHE HD1 1 1 16 12470 2 2 25 PHE HD2 H -8.563 -2.615 -5.128 1.00 . B B . 25 PHE HD2 1 1 16 12471 2 2 25 PHE HE1 H -12.679 -3.447 -2.574 1.00 . B B . 25 PHE HE1 1 1 16 12472 2 2 25 PHE HE2 H -10.718 -1.973 -6.070 1.00 . B B . 25 PHE HE2 1 1 16 12473 2 2 25 PHE HZ H -12.805 -2.384 -4.802 1.00 . B B . 25 PHE HZ 1 1 16 12474 2 2 25 PHE N N -8.183 -2.446 -0.743 1.00 . B B . 25 PHE N 1 1 16 12475 2 2 25 PHE O O -5.518 -4.466 -1.660 1.00 . B B . 25 PHE O 1 1 16 12476 2 2 26 TYR C C -4.891 -6.885 1.053 1.00 . B B . 26 TYR C 1 1 16 12477 2 2 26 TYR CA C -4.910 -5.316 0.896 1.00 . B B . 26 TYR CA 1 1 16 12478 2 2 26 TYR CB C -4.654 -4.558 2.245 1.00 . B B . 26 TYR CB 1 1 16 12479 2 2 26 TYR CD1 C -2.204 -5.159 2.474 1.00 . B B . 26 TYR CD1 1 1 16 12480 2 2 26 TYR CD2 C -3.726 -5.898 4.147 1.00 . B B . 26 TYR CD2 1 1 16 12481 2 2 26 TYR CE1 C -1.178 -5.802 3.140 1.00 . B B . 26 TYR CE1 1 1 16 12482 2 2 26 TYR CE2 C -2.696 -6.536 4.802 1.00 . B B . 26 TYR CE2 1 1 16 12483 2 2 26 TYR CG C -3.486 -5.211 2.978 1.00 . B B . 26 TYR CG 1 1 16 12484 2 2 26 TYR CZ C -1.430 -6.487 4.296 1.00 . B B . 26 TYR CZ 1 1 16 12485 2 2 26 TYR H H -6.989 -4.680 1.007 1.00 . B B . 26 TYR H 1 1 16 12486 2 2 26 TYR HA H -4.132 -5.063 0.191 1.00 . B B . 26 TYR HA 1 1 16 12487 2 2 26 TYR HB2 H -4.427 -3.519 2.067 1.00 . B B . 26 TYR HB2 1 1 16 12488 2 2 26 TYR HB3 H -5.542 -4.606 2.861 1.00 . B B . 26 TYR HB3 1 1 16 12489 2 2 26 TYR HD1 H -2.005 -4.613 1.561 1.00 . B B . 26 TYR HD1 1 1 16 12490 2 2 26 TYR HD2 H -4.730 -5.938 4.547 1.00 . B B . 26 TYR HD2 1 1 16 12491 2 2 26 TYR HE1 H -0.169 -5.771 2.759 1.00 . B B . 26 TYR HE1 1 1 16 12492 2 2 26 TYR HE2 H -2.882 -7.076 5.718 1.00 . B B . 26 TYR HE2 1 1 16 12493 2 2 26 TYR HH H -0.314 -6.749 5.798 1.00 . B B . 26 TYR HH 1 1 16 12494 2 2 26 TYR N N -6.227 -4.768 0.393 1.00 . B B . 26 TYR N 1 1 16 12495 2 2 26 TYR O O -5.916 -7.516 0.913 1.00 . B B . 26 TYR O 1 1 16 12496 2 2 26 TYR OH O -0.422 -7.162 4.933 1.00 . B B . 26 TYR OH 1 1 16 12497 2 2 27 THR C C -4.696 -9.933 1.205 1.00 . B B . 27 THR C 1 1 16 12498 2 2 27 THR CA C -3.533 -8.966 1.519 1.00 . B B . 27 THR CA 1 1 16 12499 2 2 27 THR CB C -3.043 -9.221 3.010 1.00 . B B . 27 THR CB 1 1 16 12500 2 2 27 THR CG2 C -3.177 -10.621 3.586 1.00 . B B . 27 THR CG2 1 1 16 12501 2 2 27 THR H H -2.968 -6.871 1.415 1.00 . B B . 27 THR H 1 1 16 12502 2 2 27 THR HA H -2.725 -9.266 0.873 1.00 . B B . 27 THR HA 1 1 16 12503 2 2 27 THR HB H -3.483 -8.496 3.679 1.00 . B B . 27 THR HB 1 1 16 12504 2 2 27 THR HG1 H -1.321 -8.506 3.658 1.00 . B B . 27 THR HG1 1 1 16 12505 2 2 27 THR HG21 H -2.665 -11.351 2.997 1.00 . B B . 27 THR HG21 1 1 16 12506 2 2 27 THR HG22 H -2.763 -10.635 4.583 1.00 . B B . 27 THR HG22 1 1 16 12507 2 2 27 THR HG23 H -4.215 -10.908 3.665 1.00 . B B . 27 THR HG23 1 1 16 12508 2 2 27 THR N N -3.738 -7.461 1.330 1.00 . B B . 27 THR N 1 1 16 12509 2 2 27 THR O O -5.560 -10.199 2.016 1.00 . B B . 27 THR O 1 1 16 12510 2 2 27 THR OG1 O -1.616 -9.155 2.994 1.00 . B B . 27 THR OG1 1 1 16 12511 2 2 28 PRO C C -4.355 -12.898 -0.151 1.00 . B B . 28 PRO C 1 1 16 12512 2 2 28 PRO CA C -5.387 -11.742 -0.248 1.00 . B B . 28 PRO CA 1 1 16 12513 2 2 28 PRO CB C -6.021 -11.554 -1.647 1.00 . B B . 28 PRO CB 1 1 16 12514 2 2 28 PRO CD C -4.852 -9.532 -1.174 1.00 . B B . 28 PRO CD 1 1 16 12515 2 2 28 PRO CG C -6.185 -10.025 -1.723 1.00 . B B . 28 PRO CG 1 1 16 12516 2 2 28 PRO HA H -6.149 -11.901 0.503 1.00 . B B . 28 PRO HA 1 1 16 12517 2 2 28 PRO HB2 H -5.378 -11.935 -2.429 1.00 . B B . 28 PRO HB2 1 1 16 12518 2 2 28 PRO HB3 H -6.980 -12.051 -1.698 1.00 . B B . 28 PRO HB3 1 1 16 12519 2 2 28 PRO HD2 H -4.050 -9.668 -1.889 1.00 . B B . 28 PRO HD2 1 1 16 12520 2 2 28 PRO HD3 H -4.902 -8.498 -0.875 1.00 . B B . 28 PRO HD3 1 1 16 12521 2 2 28 PRO HG2 H -6.353 -9.674 -2.731 1.00 . B B . 28 PRO HG2 1 1 16 12522 2 2 28 PRO HG3 H -6.985 -9.682 -1.078 1.00 . B B . 28 PRO HG3 1 1 16 12523 2 2 28 PRO N N -4.656 -10.445 -0.004 1.00 . B B . 28 PRO N 1 1 16 12524 2 2 28 PRO O O -4.229 -13.771 -0.988 1.00 . B B . 28 PRO O 1 1 16 12525 2 2 29 LYS C C -2.825 -14.558 2.611 1.00 . B B . 29 LYS C 1 1 16 12526 2 2 29 LYS CA C -2.560 -13.833 1.263 1.00 . B B . 29 LYS CA 1 1 16 12527 2 2 29 LYS CB C -1.202 -13.041 1.284 1.00 . B B . 29 LYS CB 1 1 16 12528 2 2 29 LYS CD C 1.256 -13.110 2.149 1.00 . B B . 29 LYS CD 1 1 16 12529 2 2 29 LYS CE C 1.188 -11.797 2.958 1.00 . B B . 29 LYS CE 1 1 16 12530 2 2 29 LYS CG C -0.101 -13.862 2.039 1.00 . B B . 29 LYS CG 1 1 16 12531 2 2 29 LYS H H -3.825 -12.095 1.539 1.00 . B B . 29 LYS H 1 1 16 12532 2 2 29 LYS HA H -2.533 -14.590 0.490 1.00 . B B . 29 LYS HA 1 1 16 12533 2 2 29 LYS HB2 H -0.893 -12.854 0.261 1.00 . B B . 29 LYS HB2 1 1 16 12534 2 2 29 LYS HB3 H -1.368 -12.084 1.749 1.00 . B B . 29 LYS HB3 1 1 16 12535 2 2 29 LYS HD2 H 1.968 -13.757 2.644 1.00 . B B . 29 LYS HD2 1 1 16 12536 2 2 29 LYS HD3 H 1.654 -12.916 1.163 1.00 . B B . 29 LYS HD3 1 1 16 12537 2 2 29 LYS HE2 H 0.643 -11.949 3.884 1.00 . B B . 29 LYS HE2 1 1 16 12538 2 2 29 LYS HE3 H 2.196 -11.470 3.201 1.00 . B B . 29 LYS HE3 1 1 16 12539 2 2 29 LYS HG2 H -0.419 -14.100 3.048 1.00 . B B . 29 LYS HG2 1 1 16 12540 2 2 29 LYS HG3 H 0.073 -14.800 1.525 1.00 . B B . 29 LYS HG3 1 1 16 12541 2 2 29 LYS HZ1 H 0.363 -11.178 1.168 1.00 . B B . 29 LYS HZ1 1 1 16 12542 2 2 29 LYS HZ2 H -0.318 -10.287 2.486 1.00 . B B . 29 LYS HZ2 1 1 16 12543 2 2 29 LYS HZ3 H 1.241 -10.059 1.882 1.00 . B B . 29 LYS HZ3 1 1 16 12544 2 2 29 LYS N N -3.632 -12.835 0.931 1.00 . B B . 29 LYS N 1 1 16 12545 2 2 29 LYS NZ N 0.520 -10.776 2.117 1.00 . B B . 29 LYS NZ 1 1 16 12546 2 2 29 LYS O O -3.511 -14.061 3.476 1.00 . B B . 29 LYS O 1 1 16 12547 2 2 30 THR C C -1.043 -16.814 4.676 1.00 . B B . 30 THR C 1 1 16 12548 2 2 30 THR CA C -2.394 -16.560 3.990 1.00 . B B . 30 THR CA 1 1 16 12549 2 2 30 THR CB C -3.041 -17.910 3.623 1.00 . B B . 30 THR CB 1 1 16 12550 2 2 30 THR CG2 C -2.194 -18.752 2.679 1.00 . B B . 30 THR CG2 1 1 16 12551 2 2 30 THR H H -1.700 -16.034 1.996 1.00 . B B . 30 THR H 1 1 16 12552 2 2 30 THR HA H -3.025 -16.060 4.711 1.00 . B B . 30 THR HA 1 1 16 12553 2 2 30 THR HB H -4.076 -17.801 3.316 1.00 . B B . 30 THR HB 1 1 16 12554 2 2 30 THR HG1 H -2.701 -19.576 4.602 1.00 . B B . 30 THR HG1 1 1 16 12555 2 2 30 THR HG21 H -1.232 -18.975 3.115 1.00 . B B . 30 THR HG21 1 1 16 12556 2 2 30 THR HG22 H -2.707 -19.677 2.459 1.00 . B B . 30 THR HG22 1 1 16 12557 2 2 30 THR HG23 H -2.037 -18.222 1.752 1.00 . B B . 30 THR HG23 1 1 16 12558 2 2 30 THR N N -2.247 -15.717 2.740 1.00 . B B . 30 THR N 1 1 16 12559 2 2 30 THR O O -0.017 -16.342 4.211 1.00 . B B . 30 THR O 1 1 16 12560 2 2 30 THR OG1 O -2.943 -18.669 4.814 1.00 . B B . 30 THR OG1 1 1 17 12561 1 1 1 GLY C C -1.302 -6.824 -1.357 1.00 . A A . 1 GLY C 1 1 17 12562 1 1 1 GLY CA C -2.359 -7.898 -1.137 1.00 . A A . 1 GLY CA 1 1 17 12563 1 1 1 GLY HA2 H -2.446 -8.439 -2.066 1.00 . A A . 1 GLY HA2 1 1 17 12564 1 1 1 GLY HA3 H -3.295 -7.410 -0.922 1.00 . A A . 1 GLY HA3 1 1 17 12565 1 1 1 GLY N N -2.009 -8.875 -0.039 1.00 . A A . 1 GLY N 1 1 17 12566 1 1 1 GLY O O -1.025 -6.423 -2.469 1.00 . A A . 1 GLY O 1 1 17 12567 1 1 2 ILE C C 1.702 -5.977 -0.435 1.00 . A A . 2 ILE C 1 1 17 12568 1 1 2 ILE CA C 0.334 -5.316 -0.356 1.00 . A A . 2 ILE CA 1 1 17 12569 1 1 2 ILE CB C 0.293 -4.423 0.909 1.00 . A A . 2 ILE CB 1 1 17 12570 1 1 2 ILE CD1 C -1.244 -3.113 2.519 1.00 . A A . 2 ILE CD1 1 1 17 12571 1 1 2 ILE CG1 C -1.156 -4.001 1.232 1.00 . A A . 2 ILE CG1 1 1 17 12572 1 1 2 ILE CG2 C 1.215 -3.222 0.597 1.00 . A A . 2 ILE CG2 1 1 17 12573 1 1 2 ILE H H -1.013 -6.763 0.583 1.00 . A A . 2 ILE H 1 1 17 12574 1 1 2 ILE HA H 0.245 -4.736 -1.264 1.00 . A A . 2 ILE HA 1 1 17 12575 1 1 2 ILE HB H 0.686 -4.962 1.763 1.00 . A A . 2 ILE HB 1 1 17 12576 1 1 2 ILE HD11 H -0.856 -3.622 3.392 1.00 . A A . 2 ILE HD11 1 1 17 12577 1 1 2 ILE HD12 H -0.696 -2.188 2.408 1.00 . A A . 2 ILE HD12 1 1 17 12578 1 1 2 ILE HD13 H -2.275 -2.853 2.718 1.00 . A A . 2 ILE HD13 1 1 17 12579 1 1 2 ILE HG12 H -1.599 -3.507 0.390 1.00 . A A . 2 ILE HG12 1 1 17 12580 1 1 2 ILE HG13 H -1.743 -4.894 1.377 1.00 . A A . 2 ILE HG13 1 1 17 12581 1 1 2 ILE HG21 H 0.931 -2.737 -0.316 1.00 . A A . 2 ILE HG21 1 1 17 12582 1 1 2 ILE HG22 H 1.190 -2.492 1.375 1.00 . A A . 2 ILE HG22 1 1 17 12583 1 1 2 ILE HG23 H 2.240 -3.549 0.490 1.00 . A A . 2 ILE HG23 1 1 17 12584 1 1 2 ILE N N -0.731 -6.384 -0.276 1.00 . A A . 2 ILE N 1 1 17 12585 1 1 2 ILE O O 2.545 -5.649 -1.242 1.00 . A A . 2 ILE O 1 1 17 12586 1 1 3 VAL C C 4.259 -7.641 -0.287 1.00 . A A . 3 VAL C 1 1 17 12587 1 1 3 VAL CA C 3.048 -7.753 0.655 1.00 . A A . 3 VAL CA 1 1 17 12588 1 1 3 VAL CB C 2.485 -9.224 0.737 1.00 . A A . 3 VAL CB 1 1 17 12589 1 1 3 VAL CG1 C 1.442 -9.334 1.874 1.00 . A A . 3 VAL CG1 1 1 17 12590 1 1 3 VAL CG2 C 1.736 -9.595 -0.563 1.00 . A A . 3 VAL CG2 1 1 17 12591 1 1 3 VAL H H 1.060 -7.056 1.031 1.00 . A A . 3 VAL H 1 1 17 12592 1 1 3 VAL HA H 3.489 -7.403 1.561 1.00 . A A . 3 VAL HA 1 1 17 12593 1 1 3 VAL HB H 3.294 -9.932 0.915 1.00 . A A . 3 VAL HB 1 1 17 12594 1 1 3 VAL HG11 H 1.890 -9.062 2.819 1.00 . A A . 3 VAL HG11 1 1 17 12595 1 1 3 VAL HG12 H 0.583 -8.705 1.692 1.00 . A A . 3 VAL HG12 1 1 17 12596 1 1 3 VAL HG13 H 1.097 -10.357 1.938 1.00 . A A . 3 VAL HG13 1 1 17 12597 1 1 3 VAL HG21 H 0.913 -8.925 -0.763 1.00 . A A . 3 VAL HG21 1 1 17 12598 1 1 3 VAL HG22 H 2.414 -9.586 -1.400 1.00 . A A . 3 VAL HG22 1 1 17 12599 1 1 3 VAL HG23 H 1.344 -10.600 -0.484 1.00 . A A . 3 VAL HG23 1 1 17 12600 1 1 3 VAL N N 1.832 -6.905 0.454 1.00 . A A . 3 VAL N 1 1 17 12601 1 1 3 VAL O O 4.769 -6.550 -0.448 1.00 . A A . 3 VAL O 1 1 17 12602 1 1 4 GLU C C 6.108 -7.284 -2.495 1.00 . A A . 4 GLU C 1 1 17 12603 1 1 4 GLU CA C 5.914 -8.614 -1.790 1.00 . A A . 4 GLU CA 1 1 17 12604 1 1 4 GLU CB C 5.767 -9.810 -2.783 1.00 . A A . 4 GLU CB 1 1 17 12605 1 1 4 GLU CD C 5.716 -11.177 -0.633 1.00 . A A . 4 GLU CD 1 1 17 12606 1 1 4 GLU CG C 6.310 -11.078 -2.027 1.00 . A A . 4 GLU CG 1 1 17 12607 1 1 4 GLU H H 4.316 -9.577 -0.704 1.00 . A A . 4 GLU H 1 1 17 12608 1 1 4 GLU HA H 6.776 -8.719 -1.161 1.00 . A A . 4 GLU HA 1 1 17 12609 1 1 4 GLU HB2 H 4.726 -9.970 -3.031 1.00 . A A . 4 GLU HB2 1 1 17 12610 1 1 4 GLU HB3 H 6.326 -9.646 -3.694 1.00 . A A . 4 GLU HB3 1 1 17 12611 1 1 4 GLU HG2 H 6.028 -11.983 -2.541 1.00 . A A . 4 GLU HG2 1 1 17 12612 1 1 4 GLU HG3 H 7.384 -11.061 -1.925 1.00 . A A . 4 GLU HG3 1 1 17 12613 1 1 4 GLU N N 4.730 -8.698 -0.870 1.00 . A A . 4 GLU N 1 1 17 12614 1 1 4 GLU O O 7.002 -6.538 -2.153 1.00 . A A . 4 GLU O 1 1 17 12615 1 1 4 GLU OE1 O 4.564 -11.556 -0.563 1.00 . A A . 4 GLU OE1 1 1 17 12616 1 1 4 GLU OE2 O 6.462 -10.827 0.259 1.00 . A A . 4 GLU OE2 1 1 17 12617 1 1 5 GLN C C 5.542 -4.435 -3.263 1.00 . A A . 5 GLN C 1 1 17 12618 1 1 5 GLN CA C 5.418 -5.697 -4.173 1.00 . A A . 5 GLN CA 1 1 17 12619 1 1 5 GLN CB C 4.188 -5.587 -5.152 1.00 . A A . 5 GLN CB 1 1 17 12620 1 1 5 GLN CD C 2.396 -7.138 -4.197 1.00 . A A . 5 GLN CD 1 1 17 12621 1 1 5 GLN CG C 2.802 -5.692 -4.421 1.00 . A A . 5 GLN CG 1 1 17 12622 1 1 5 GLN H H 4.588 -7.648 -3.669 1.00 . A A . 5 GLN H 1 1 17 12623 1 1 5 GLN HA H 6.346 -5.697 -4.742 1.00 . A A . 5 GLN HA 1 1 17 12624 1 1 5 GLN HB2 H 4.241 -4.662 -5.707 1.00 . A A . 5 GLN HB2 1 1 17 12625 1 1 5 GLN HB3 H 4.263 -6.386 -5.879 1.00 . A A . 5 GLN HB3 1 1 17 12626 1 1 5 GLN HE21 H 2.922 -7.195 -2.302 1.00 . A A . 5 GLN HE21 1 1 17 12627 1 1 5 GLN HE22 H 2.274 -8.628 -2.973 1.00 . A A . 5 GLN HE22 1 1 17 12628 1 1 5 GLN HG2 H 2.800 -5.188 -3.470 1.00 . A A . 5 GLN HG2 1 1 17 12629 1 1 5 GLN HG3 H 2.035 -5.249 -5.037 1.00 . A A . 5 GLN HG3 1 1 17 12630 1 1 5 GLN N N 5.283 -6.995 -3.450 1.00 . A A . 5 GLN N 1 1 17 12631 1 1 5 GLN NE2 N 2.548 -7.695 -3.054 1.00 . A A . 5 GLN NE2 1 1 17 12632 1 1 5 GLN O O 6.303 -3.571 -3.643 1.00 . A A . 5 GLN O 1 1 17 12633 1 1 5 GLN OE1 O 1.926 -7.816 -5.076 1.00 . A A . 5 GLN OE1 1 1 17 12634 1 1 6 CYS C C 5.533 -3.037 0.099 1.00 . A A . 6 CYS C 1 1 17 12635 1 1 6 CYS CA C 5.094 -3.001 -1.362 1.00 . A A . 6 CYS CA 1 1 17 12636 1 1 6 CYS CB C 3.789 -2.239 -1.521 1.00 . A A . 6 CYS CB 1 1 17 12637 1 1 6 CYS H H 4.261 -4.991 -1.765 1.00 . A A . 6 CYS H 1 1 17 12638 1 1 6 CYS HA H 5.880 -2.417 -1.820 1.00 . A A . 6 CYS HA 1 1 17 12639 1 1 6 CYS HB2 H 2.982 -2.954 -1.536 1.00 . A A . 6 CYS HB2 1 1 17 12640 1 1 6 CYS HB3 H 3.646 -1.547 -0.711 1.00 . A A . 6 CYS HB3 1 1 17 12641 1 1 6 CYS HG H 4.036 -0.467 -2.915 1.00 . A A . 6 CYS HG 1 1 17 12642 1 1 6 CYS N N 4.879 -4.295 -2.134 1.00 . A A . 6 CYS N 1 1 17 12643 1 1 6 CYS O O 5.678 -2.015 0.732 1.00 . A A . 6 CYS O 1 1 17 12644 1 1 6 CYS SG S 3.601 -1.310 -3.047 1.00 . A A . 6 CYS SG 1 1 17 12645 1 1 7 CYS C C 7.563 -5.062 2.044 1.00 . A A . 7 CYS C 1 1 17 12646 1 1 7 CYS CA C 6.166 -4.401 2.004 1.00 . A A . 7 CYS CA 1 1 17 12647 1 1 7 CYS CB C 5.007 -5.208 2.588 1.00 . A A . 7 CYS CB 1 1 17 12648 1 1 7 CYS H H 5.591 -4.997 0.012 1.00 . A A . 7 CYS H 1 1 17 12649 1 1 7 CYS HA H 6.257 -3.442 2.502 1.00 . A A . 7 CYS HA 1 1 17 12650 1 1 7 CYS HB2 H 4.298 -4.468 2.946 1.00 . A A . 7 CYS HB2 1 1 17 12651 1 1 7 CYS HB3 H 4.504 -5.705 1.778 1.00 . A A . 7 CYS HB3 1 1 17 12652 1 1 7 CYS HG H 5.824 -7.124 3.500 1.00 . A A . 7 CYS HG 1 1 17 12653 1 1 7 CYS N N 5.733 -4.212 0.586 1.00 . A A . 7 CYS N 1 1 17 12654 1 1 7 CYS O O 8.402 -4.746 2.864 1.00 . A A . 7 CYS O 1 1 17 12655 1 1 7 CYS SG S 5.357 -6.392 3.914 1.00 . A A . 7 CYS SG 1 1 17 12656 1 1 8 THR C C 9.874 -6.054 -0.131 1.00 . A A . 8 THR C 1 1 17 12657 1 1 8 THR CA C 9.069 -6.716 1.004 1.00 . A A . 8 THR CA 1 1 17 12658 1 1 8 THR CB C 8.819 -8.192 0.640 1.00 . A A . 8 THR CB 1 1 17 12659 1 1 8 THR CG2 C 9.912 -9.083 1.161 1.00 . A A . 8 THR CG2 1 1 17 12660 1 1 8 THR H H 7.015 -6.151 0.520 1.00 . A A . 8 THR H 1 1 17 12661 1 1 8 THR HA H 9.637 -6.639 1.919 1.00 . A A . 8 THR HA 1 1 17 12662 1 1 8 THR HB H 8.577 -8.370 -0.399 1.00 . A A . 8 THR HB 1 1 17 12663 1 1 8 THR HG1 H 7.366 -9.407 1.157 1.00 . A A . 8 THR HG1 1 1 17 12664 1 1 8 THR HG21 H 10.865 -8.796 0.745 1.00 . A A . 8 THR HG21 1 1 17 12665 1 1 8 THR HG22 H 9.957 -9.017 2.238 1.00 . A A . 8 THR HG22 1 1 17 12666 1 1 8 THR HG23 H 9.689 -10.104 0.887 1.00 . A A . 8 THR HG23 1 1 17 12667 1 1 8 THR N N 7.756 -5.964 1.128 1.00 . A A . 8 THR N 1 1 17 12668 1 1 8 THR O O 11.086 -6.032 -0.149 1.00 . A A . 8 THR O 1 1 17 12669 1 1 8 THR OG1 O 7.790 -8.603 1.519 1.00 . A A . 8 THR OG1 1 1 17 12670 1 1 9 SER C C 9.118 -3.366 -2.279 1.00 . A A . 9 SER C 1 1 17 12671 1 1 9 SER CA C 9.671 -4.818 -2.287 1.00 . A A . 9 SER CA 1 1 17 12672 1 1 9 SER CB C 9.216 -5.545 -3.559 1.00 . A A . 9 SER CB 1 1 17 12673 1 1 9 SER H H 8.168 -5.617 -0.976 1.00 . A A . 9 SER H 1 1 17 12674 1 1 9 SER HA H 10.748 -4.764 -2.251 1.00 . A A . 9 SER HA 1 1 17 12675 1 1 9 SER HB2 H 9.409 -6.610 -3.494 1.00 . A A . 9 SER HB2 1 1 17 12676 1 1 9 SER HB3 H 8.167 -5.368 -3.738 1.00 . A A . 9 SER HB3 1 1 17 12677 1 1 9 SER HG H 10.565 -5.568 -5.029 1.00 . A A . 9 SER HG 1 1 17 12678 1 1 9 SER N N 9.136 -5.534 -1.072 1.00 . A A . 9 SER N 1 1 17 12679 1 1 9 SER O O 8.673 -2.907 -1.245 1.00 . A A . 9 SER O 1 1 17 12680 1 1 9 SER OG O 9.989 -4.928 -4.591 1.00 . A A . 9 SER OG 1 1 17 12681 1 1 10 ILE C C 7.629 -0.858 -4.584 1.00 . A A . 10 ILE C 1 1 17 12682 1 1 10 ILE CA C 8.632 -1.257 -3.454 1.00 . A A . 10 ILE CA 1 1 17 12683 1 1 10 ILE CB C 9.883 -0.307 -3.515 1.00 . A A . 10 ILE CB 1 1 17 12684 1 1 10 ILE CD1 C 12.113 0.266 -2.397 1.00 . A A . 10 ILE CD1 1 1 17 12685 1 1 10 ILE CG1 C 10.840 -0.624 -2.332 1.00 . A A . 10 ILE CG1 1 1 17 12686 1 1 10 ILE CG2 C 9.388 1.153 -3.345 1.00 . A A . 10 ILE CG2 1 1 17 12687 1 1 10 ILE H H 9.492 -3.169 -4.169 1.00 . A A . 10 ILE H 1 1 17 12688 1 1 10 ILE HA H 8.151 -1.024 -2.515 1.00 . A A . 10 ILE HA 1 1 17 12689 1 1 10 ILE HB H 10.392 -0.436 -4.463 1.00 . A A . 10 ILE HB 1 1 17 12690 1 1 10 ILE HD11 H 12.633 0.107 -3.332 1.00 . A A . 10 ILE HD11 1 1 17 12691 1 1 10 ILE HD12 H 11.879 1.314 -2.310 1.00 . A A . 10 ILE HD12 1 1 17 12692 1 1 10 ILE HD13 H 12.784 0.008 -1.591 1.00 . A A . 10 ILE HD13 1 1 17 12693 1 1 10 ILE HG12 H 10.319 -0.498 -1.390 1.00 . A A . 10 ILE HG12 1 1 17 12694 1 1 10 ILE HG13 H 11.145 -1.660 -2.387 1.00 . A A . 10 ILE HG13 1 1 17 12695 1 1 10 ILE HG21 H 8.878 1.261 -2.397 1.00 . A A . 10 ILE HG21 1 1 17 12696 1 1 10 ILE HG22 H 10.221 1.830 -3.380 1.00 . A A . 10 ILE HG22 1 1 17 12697 1 1 10 ILE HG23 H 8.705 1.423 -4.139 1.00 . A A . 10 ILE HG23 1 1 17 12698 1 1 10 ILE N N 9.140 -2.687 -3.392 1.00 . A A . 10 ILE N 1 1 17 12699 1 1 10 ILE O O 7.996 -0.380 -5.639 1.00 . A A . 10 ILE O 1 1 17 12700 1 1 11 CYS C C 4.429 0.510 -4.851 1.00 . A A . 11 CYS C 1 1 17 12701 1 1 11 CYS CA C 5.303 -0.702 -5.375 1.00 . A A . 11 CYS CA 1 1 17 12702 1 1 11 CYS CB C 4.522 -2.029 -5.578 1.00 . A A . 11 CYS CB 1 1 17 12703 1 1 11 CYS H H 6.129 -1.474 -3.500 1.00 . A A . 11 CYS H 1 1 17 12704 1 1 11 CYS HA H 5.770 -0.423 -6.304 1.00 . A A . 11 CYS HA 1 1 17 12705 1 1 11 CYS HB2 H 4.110 -2.063 -6.564 1.00 . A A . 11 CYS HB2 1 1 17 12706 1 1 11 CYS HB3 H 5.271 -2.798 -5.501 1.00 . A A . 11 CYS HB3 1 1 17 12707 1 1 11 CYS HG H 3.592 -3.278 -3.868 1.00 . A A . 11 CYS HG 1 1 17 12708 1 1 11 CYS N N 6.363 -1.061 -4.354 1.00 . A A . 11 CYS N 1 1 17 12709 1 1 11 CYS O O 3.334 0.844 -5.253 1.00 . A A . 11 CYS O 1 1 17 12710 1 1 11 CYS SG S 3.232 -2.595 -4.441 1.00 . A A . 11 CYS SG 1 1 17 12711 1 1 12 SER C C 3.743 3.625 -3.692 1.00 . A A . 12 SER C 1 1 17 12712 1 1 12 SER CA C 4.462 2.356 -3.165 1.00 . A A . 12 SER CA 1 1 17 12713 1 1 12 SER CB C 5.599 2.811 -2.289 1.00 . A A . 12 SER CB 1 1 17 12714 1 1 12 SER H H 5.903 0.847 -3.645 1.00 . A A . 12 SER H 1 1 17 12715 1 1 12 SER HA H 3.745 1.943 -2.482 1.00 . A A . 12 SER HA 1 1 17 12716 1 1 12 SER HB2 H 5.484 3.845 -1.988 1.00 . A A . 12 SER HB2 1 1 17 12717 1 1 12 SER HB3 H 5.644 2.169 -1.421 1.00 . A A . 12 SER HB3 1 1 17 12718 1 1 12 SER HG H 6.678 2.870 -4.024 1.00 . A A . 12 SER HG 1 1 17 12719 1 1 12 SER N N 5.010 1.159 -3.901 1.00 . A A . 12 SER N 1 1 17 12720 1 1 12 SER O O 4.373 4.614 -3.992 1.00 . A A . 12 SER O 1 1 17 12721 1 1 12 SER OG O 6.780 2.648 -3.075 1.00 . A A . 12 SER OG 1 1 17 12722 1 1 13 LEU C C 0.708 4.115 -5.467 1.00 . A A . 13 LEU C 1 1 17 12723 1 1 13 LEU CA C 1.439 4.575 -4.215 1.00 . A A . 13 LEU CA 1 1 17 12724 1 1 13 LEU CB C 2.144 5.954 -4.494 1.00 . A A . 13 LEU CB 1 1 17 12725 1 1 13 LEU CD1 C 0.144 7.286 -3.694 1.00 . A A . 13 LEU CD1 1 1 17 12726 1 1 13 LEU CD2 C 1.896 8.356 -5.045 1.00 . A A . 13 LEU CD2 1 1 17 12727 1 1 13 LEU CG C 1.122 7.055 -4.856 1.00 . A A . 13 LEU CG 1 1 17 12728 1 1 13 LEU H H 2.072 2.663 -3.506 1.00 . A A . 13 LEU H 1 1 17 12729 1 1 13 LEU HA H 0.682 4.675 -3.452 1.00 . A A . 13 LEU HA 1 1 17 12730 1 1 13 LEU HB2 H 2.697 6.261 -3.617 1.00 . A A . 13 LEU HB2 1 1 17 12731 1 1 13 LEU HB3 H 2.850 5.852 -5.305 1.00 . A A . 13 LEU HB3 1 1 17 12732 1 1 13 LEU HD11 H 0.672 7.570 -2.795 1.00 . A A . 13 LEU HD11 1 1 17 12733 1 1 13 LEU HD12 H -0.547 8.077 -3.948 1.00 . A A . 13 LEU HD12 1 1 17 12734 1 1 13 LEU HD13 H -0.439 6.400 -3.493 1.00 . A A . 13 LEU HD13 1 1 17 12735 1 1 13 LEU HD21 H 2.625 8.255 -5.834 1.00 . A A . 13 LEU HD21 1 1 17 12736 1 1 13 LEU HD22 H 1.221 9.158 -5.304 1.00 . A A . 13 LEU HD22 1 1 17 12737 1 1 13 LEU HD23 H 2.410 8.628 -4.134 1.00 . A A . 13 LEU HD23 1 1 17 12738 1 1 13 LEU HG H 0.577 6.796 -5.759 1.00 . A A . 13 LEU HG 1 1 17 12739 1 1 13 LEU N N 2.441 3.526 -3.765 1.00 . A A . 13 LEU N 1 1 17 12740 1 1 13 LEU O O -0.489 4.246 -5.570 1.00 . A A . 13 LEU O 1 1 17 12741 1 1 14 TYR C C 0.532 1.633 -7.510 1.00 . A A . 14 TYR C 1 1 17 12742 1 1 14 TYR CA C 1.024 3.055 -7.663 1.00 . A A . 14 TYR CA 1 1 17 12743 1 1 14 TYR CB C 2.166 3.068 -8.714 1.00 . A A . 14 TYR CB 1 1 17 12744 1 1 14 TYR CD1 C 3.876 4.347 -7.388 1.00 . A A . 14 TYR CD1 1 1 17 12745 1 1 14 TYR CD2 C 4.319 2.067 -7.855 1.00 . A A . 14 TYR CD2 1 1 17 12746 1 1 14 TYR CE1 C 5.043 4.431 -6.663 1.00 . A A . 14 TYR CE1 1 1 17 12747 1 1 14 TYR CE2 C 5.487 2.164 -7.129 1.00 . A A . 14 TYR CE2 1 1 17 12748 1 1 14 TYR CG C 3.505 3.161 -7.984 1.00 . A A . 14 TYR CG 1 1 17 12749 1 1 14 TYR CZ C 5.853 3.338 -6.527 1.00 . A A . 14 TYR CZ 1 1 17 12750 1 1 14 TYR H H 2.445 3.572 -6.076 1.00 . A A . 14 TYR H 1 1 17 12751 1 1 14 TYR HA H 0.175 3.661 -7.986 1.00 . A A . 14 TYR HA 1 1 17 12752 1 1 14 TYR HB2 H 2.105 2.132 -9.262 1.00 . A A . 14 TYR HB2 1 1 17 12753 1 1 14 TYR HB3 H 2.013 3.888 -9.387 1.00 . A A . 14 TYR HB3 1 1 17 12754 1 1 14 TYR HD1 H 3.240 5.218 -7.497 1.00 . A A . 14 TYR HD1 1 1 17 12755 1 1 14 TYR HD2 H 4.039 1.135 -8.324 1.00 . A A . 14 TYR HD2 1 1 17 12756 1 1 14 TYR HE1 H 5.315 5.359 -6.192 1.00 . A A . 14 TYR HE1 1 1 17 12757 1 1 14 TYR HE2 H 6.138 1.312 -7.031 1.00 . A A . 14 TYR HE2 1 1 17 12758 1 1 14 TYR HH H 7.410 4.248 -5.784 1.00 . A A . 14 TYR HH 1 1 17 12759 1 1 14 TYR N N 1.504 3.587 -6.340 1.00 . A A . 14 TYR N 1 1 17 12760 1 1 14 TYR O O -0.145 1.129 -8.379 1.00 . A A . 14 TYR O 1 1 17 12761 1 1 14 TYR OH O 7.002 3.370 -5.773 1.00 . A A . 14 TYR OH 1 1 17 12762 1 1 15 GLN C C -0.003 -0.605 -4.781 1.00 . A A . 15 GLN C 1 1 17 12763 1 1 15 GLN CA C 0.457 -0.406 -6.234 1.00 . A A . 15 GLN CA 1 1 17 12764 1 1 15 GLN CB C 1.581 -1.374 -6.633 1.00 . A A . 15 GLN CB 1 1 17 12765 1 1 15 GLN CD C 0.433 -2.159 -8.756 1.00 . A A . 15 GLN CD 1 1 17 12766 1 1 15 GLN CG C 1.664 -1.466 -8.192 1.00 . A A . 15 GLN CG 1 1 17 12767 1 1 15 GLN H H 1.632 1.373 -5.862 1.00 . A A . 15 GLN H 1 1 17 12768 1 1 15 GLN HA H -0.378 -0.519 -6.883 1.00 . A A . 15 GLN HA 1 1 17 12769 1 1 15 GLN HB2 H 2.483 -0.970 -6.234 1.00 . A A . 15 GLN HB2 1 1 17 12770 1 1 15 GLN HB3 H 1.392 -2.352 -6.206 1.00 . A A . 15 GLN HB3 1 1 17 12771 1 1 15 GLN HE21 H -0.471 -0.481 -9.237 1.00 . A A . 15 GLN HE21 1 1 17 12772 1 1 15 GLN HE22 H -1.269 -1.933 -9.639 1.00 . A A . 15 GLN HE22 1 1 17 12773 1 1 15 GLN HG2 H 1.716 -0.486 -8.639 1.00 . A A . 15 GLN HG2 1 1 17 12774 1 1 15 GLN HG3 H 2.520 -2.038 -8.509 1.00 . A A . 15 GLN HG3 1 1 17 12775 1 1 15 GLN N N 0.953 0.986 -6.457 1.00 . A A . 15 GLN N 1 1 17 12776 1 1 15 GLN NE2 N -0.515 -1.461 -9.254 1.00 . A A . 15 GLN NE2 1 1 17 12777 1 1 15 GLN O O 0.164 -1.625 -4.140 1.00 . A A . 15 GLN O 1 1 17 12778 1 1 15 GLN OE1 O 0.294 -3.360 -8.748 1.00 . A A . 15 GLN OE1 1 1 17 12779 1 1 16 LEU C C -2.649 0.896 -3.187 1.00 . A A . 16 LEU C 1 1 17 12780 1 1 16 LEU CA C -1.180 0.696 -3.025 1.00 . A A . 16 LEU CA 1 1 17 12781 1 1 16 LEU CB C -0.498 1.956 -2.405 1.00 . A A . 16 LEU CB 1 1 17 12782 1 1 16 LEU CD1 C 1.654 0.611 -2.314 1.00 . A A . 16 LEU CD1 1 1 17 12783 1 1 16 LEU CD2 C 1.397 2.719 -0.946 1.00 . A A . 16 LEU CD2 1 1 17 12784 1 1 16 LEU CG C 0.706 1.546 -1.598 1.00 . A A . 16 LEU CG 1 1 17 12785 1 1 16 LEU H H -0.662 1.197 -4.958 1.00 . A A . 16 LEU H 1 1 17 12786 1 1 16 LEU HA H -1.118 -0.223 -2.535 1.00 . A A . 16 LEU HA 1 1 17 12787 1 1 16 LEU HB2 H -0.241 2.653 -3.189 1.00 . A A . 16 LEU HB2 1 1 17 12788 1 1 16 LEU HB3 H -1.200 2.464 -1.753 1.00 . A A . 16 LEU HB3 1 1 17 12789 1 1 16 LEU HD11 H 1.982 0.963 -3.275 1.00 . A A . 16 LEU HD11 1 1 17 12790 1 1 16 LEU HD12 H 2.500 0.395 -1.682 1.00 . A A . 16 LEU HD12 1 1 17 12791 1 1 16 LEU HD13 H 1.148 -0.328 -2.482 1.00 . A A . 16 LEU HD13 1 1 17 12792 1 1 16 LEU HD21 H 1.724 3.459 -1.650 1.00 . A A . 16 LEU HD21 1 1 17 12793 1 1 16 LEU HD22 H 0.695 3.183 -0.268 1.00 . A A . 16 LEU HD22 1 1 17 12794 1 1 16 LEU HD23 H 2.239 2.366 -0.368 1.00 . A A . 16 LEU HD23 1 1 17 12795 1 1 16 LEU HG H 0.282 0.984 -0.805 1.00 . A A . 16 LEU HG 1 1 17 12796 1 1 16 LEU N N -0.591 0.462 -4.345 1.00 . A A . 16 LEU N 1 1 17 12797 1 1 16 LEU O O -3.477 0.209 -2.636 1.00 . A A . 16 LEU O 1 1 17 12798 1 1 17 GLU C C -5.023 0.903 -4.740 1.00 . A A . 17 GLU C 1 1 17 12799 1 1 17 GLU CA C -4.313 2.245 -4.323 1.00 . A A . 17 GLU CA 1 1 17 12800 1 1 17 GLU CB C -4.079 3.295 -5.417 1.00 . A A . 17 GLU CB 1 1 17 12801 1 1 17 GLU CD C -2.730 1.761 -7.128 1.00 . A A . 17 GLU CD 1 1 17 12802 1 1 17 GLU CG C -3.925 2.596 -6.791 1.00 . A A . 17 GLU CG 1 1 17 12803 1 1 17 GLU H H -2.172 2.301 -4.449 1.00 . A A . 17 GLU H 1 1 17 12804 1 1 17 GLU HA H -4.804 2.659 -3.457 1.00 . A A . 17 GLU HA 1 1 17 12805 1 1 17 GLU HB2 H -4.874 4.022 -5.463 1.00 . A A . 17 GLU HB2 1 1 17 12806 1 1 17 GLU HB3 H -3.148 3.829 -5.245 1.00 . A A . 17 GLU HB3 1 1 17 12807 1 1 17 GLU HG2 H -4.749 1.918 -6.882 1.00 . A A . 17 GLU HG2 1 1 17 12808 1 1 17 GLU HG3 H -3.917 3.358 -7.519 1.00 . A A . 17 GLU HG3 1 1 17 12809 1 1 17 GLU N N -2.922 1.847 -3.998 1.00 . A A . 17 GLU N 1 1 17 12810 1 1 17 GLU O O -6.137 0.536 -4.421 1.00 . A A . 17 GLU O 1 1 17 12811 1 1 17 GLU OE1 O -1.836 1.761 -6.318 1.00 . A A . 17 GLU OE1 1 1 17 12812 1 1 17 GLU OE2 O -2.819 1.154 -8.177 1.00 . A A . 17 GLU OE2 1 1 17 12813 1 1 18 ASN C C -5.183 -2.119 -5.155 1.00 . A A . 18 ASN C 1 1 17 12814 1 1 18 ASN CA C -4.459 -1.116 -6.095 1.00 . A A . 18 ASN CA 1 1 17 12815 1 1 18 ASN CB C -3.018 -1.517 -6.587 1.00 . A A . 18 ASN CB 1 1 17 12816 1 1 18 ASN CG C -3.208 -2.334 -7.818 1.00 . A A . 18 ASN CG 1 1 17 12817 1 1 18 ASN H H -3.356 0.638 -5.619 1.00 . A A . 18 ASN H 1 1 17 12818 1 1 18 ASN HA H -5.120 -0.956 -6.936 1.00 . A A . 18 ASN HA 1 1 17 12819 1 1 18 ASN HB2 H -2.434 -0.655 -6.886 1.00 . A A . 18 ASN HB2 1 1 17 12820 1 1 18 ASN HB3 H -2.408 -2.053 -5.885 1.00 . A A . 18 ASN HB3 1 1 17 12821 1 1 18 ASN HD21 H -2.952 -0.753 -8.913 1.00 . A A . 18 ASN HD21 1 1 17 12822 1 1 18 ASN HD22 H -3.262 -2.215 -9.771 1.00 . A A . 18 ASN HD22 1 1 17 12823 1 1 18 ASN N N -4.219 0.205 -5.478 1.00 . A A . 18 ASN N 1 1 17 12824 1 1 18 ASN ND2 N -3.136 -1.724 -8.941 1.00 . A A . 18 ASN ND2 1 1 17 12825 1 1 18 ASN O O -5.876 -3.014 -5.601 1.00 . A A . 18 ASN O 1 1 17 12826 1 1 18 ASN OD1 O -3.435 -3.523 -7.800 1.00 . A A . 18 ASN OD1 1 1 17 12827 1 1 19 TYR C C -6.326 -1.829 -1.754 1.00 . A A . 19 TYR C 1 1 17 12828 1 1 19 TYR CA C -5.589 -2.782 -2.788 1.00 . A A . 19 TYR CA 1 1 17 12829 1 1 19 TYR CB C -4.370 -3.597 -2.213 1.00 . A A . 19 TYR CB 1 1 17 12830 1 1 19 TYR CD1 C -3.685 -1.943 -0.463 1.00 . A A . 19 TYR CD1 1 1 17 12831 1 1 19 TYR CD2 C -2.072 -2.750 -1.999 1.00 . A A . 19 TYR CD2 1 1 17 12832 1 1 19 TYR CE1 C -2.726 -1.180 0.132 1.00 . A A . 19 TYR CE1 1 1 17 12833 1 1 19 TYR CE2 C -1.122 -1.986 -1.393 1.00 . A A . 19 TYR CE2 1 1 17 12834 1 1 19 TYR CG C -3.356 -2.731 -1.533 1.00 . A A . 19 TYR CG 1 1 17 12835 1 1 19 TYR CZ C -1.451 -1.199 -0.314 1.00 . A A . 19 TYR CZ 1 1 17 12836 1 1 19 TYR H H -4.383 -1.200 -3.640 1.00 . A A . 19 TYR H 1 1 17 12837 1 1 19 TYR HA H -6.334 -3.448 -3.203 1.00 . A A . 19 TYR HA 1 1 17 12838 1 1 19 TYR HB2 H -4.631 -4.349 -1.495 1.00 . A A . 19 TYR HB2 1 1 17 12839 1 1 19 TYR HB3 H -3.832 -4.059 -3.030 1.00 . A A . 19 TYR HB3 1 1 17 12840 1 1 19 TYR HD1 H -4.691 -1.923 -0.077 1.00 . A A . 19 TYR HD1 1 1 17 12841 1 1 19 TYR HD2 H -1.802 -3.362 -2.846 1.00 . A A . 19 TYR HD2 1 1 17 12842 1 1 19 TYR HE1 H -2.978 -0.523 0.937 1.00 . A A . 19 TYR HE1 1 1 17 12843 1 1 19 TYR HE2 H -0.128 -1.985 -1.812 1.00 . A A . 19 TYR HE2 1 1 17 12844 1 1 19 TYR HH H -0.002 -1.103 0.839 1.00 . A A . 19 TYR HH 1 1 17 12845 1 1 19 TYR N N -4.980 -1.939 -3.882 1.00 . A A . 19 TYR N 1 1 17 12846 1 1 19 TYR O O -7.200 -2.171 -0.985 1.00 . A A . 19 TYR O 1 1 17 12847 1 1 19 TYR OH O -0.540 -0.453 0.379 1.00 . A A . 19 TYR OH 1 1 17 12848 1 1 20 CYS C C -7.278 1.354 -1.969 1.00 . A A . 20 CYS C 1 1 17 12849 1 1 20 CYS CA C -6.340 0.573 -0.991 1.00 . A A . 20 CYS CA 1 1 17 12850 1 1 20 CYS CB C -5.011 1.298 -0.591 1.00 . A A . 20 CYS CB 1 1 17 12851 1 1 20 CYS H H -5.198 -0.435 -2.438 1.00 . A A . 20 CYS H 1 1 17 12852 1 1 20 CYS HA H -6.894 0.306 -0.106 1.00 . A A . 20 CYS HA 1 1 17 12853 1 1 20 CYS HB2 H -4.223 0.583 -0.432 1.00 . A A . 20 CYS HB2 1 1 17 12854 1 1 20 CYS HB3 H -4.664 1.957 -1.369 1.00 . A A . 20 CYS HB3 1 1 17 12855 1 1 20 CYS HG H -4.527 1.785 1.575 1.00 . A A . 20 CYS HG 1 1 17 12856 1 1 20 CYS N N -5.898 -0.605 -1.799 1.00 . A A . 20 CYS N 1 1 17 12857 1 1 20 CYS O O -6.918 2.294 -2.647 1.00 . A A . 20 CYS O 1 1 17 12858 1 1 20 CYS SG S -5.004 2.285 0.909 1.00 . A A . 20 CYS SG 1 1 17 12859 1 1 21 ASN C C -9.241 2.406 -3.991 1.00 . A A . 21 ASN C 1 1 17 12860 1 1 21 ASN CA C -9.618 1.448 -2.825 1.00 . A A . 21 ASN CA 1 1 17 12861 1 1 21 ASN CB C -10.587 2.118 -1.839 1.00 . A A . 21 ASN CB 1 1 17 12862 1 1 21 ASN CG C -10.922 1.143 -0.740 1.00 . A A . 21 ASN CG 1 1 17 12863 1 1 21 ASN H H -8.682 0.180 -1.352 1.00 . A A . 21 ASN H 1 1 17 12864 1 1 21 ASN HA H -10.113 0.611 -3.298 1.00 . A A . 21 ASN HA 1 1 17 12865 1 1 21 ASN HB2 H -10.142 2.988 -1.396 1.00 . A A . 21 ASN HB2 1 1 17 12866 1 1 21 ASN HB3 H -11.499 2.413 -2.335 1.00 . A A . 21 ASN HB3 1 1 17 12867 1 1 21 ASN HD21 H -12.840 1.060 -1.169 1.00 . A A . 21 ASN HD21 1 1 17 12868 1 1 21 ASN HD22 H -12.304 0.087 0.119 1.00 . A A . 21 ASN HD22 1 1 17 12869 1 1 21 ASN N N -8.496 0.909 -1.973 1.00 . A A . 21 ASN N 1 1 17 12870 1 1 21 ASN ND2 N -12.123 0.737 -0.590 1.00 . A A . 21 ASN ND2 1 1 17 12871 1 1 21 ASN O O -9.819 2.355 -5.064 1.00 . A A . 21 ASN O 1 1 17 12872 1 1 21 ASN OD1 O -10.089 0.713 0.026 1.00 . A A . 21 ASN OD1 1 1 17 12873 2 2 1 PHE C C 9.806 5.988 -5.625 1.00 . B B . 1 PHE C 1 1 17 12874 2 2 1 PHE CA C 9.896 7.393 -6.278 1.00 . B B . 1 PHE CA 1 1 17 12875 2 2 1 PHE CB C 8.480 8.026 -6.425 1.00 . B B . 1 PHE CB 1 1 17 12876 2 2 1 PHE CD1 C 8.702 9.597 -8.397 1.00 . B B . 1 PHE CD1 1 1 17 12877 2 2 1 PHE CD2 C 8.520 10.542 -6.225 1.00 . B B . 1 PHE CD2 1 1 17 12878 2 2 1 PHE CE1 C 8.785 10.861 -8.943 1.00 . B B . 1 PHE CE1 1 1 17 12879 2 2 1 PHE CE2 C 8.602 11.807 -6.764 1.00 . B B . 1 PHE CE2 1 1 17 12880 2 2 1 PHE CG C 8.568 9.428 -7.035 1.00 . B B . 1 PHE CG 1 1 17 12881 2 2 1 PHE CZ C 8.736 11.969 -8.125 1.00 . B B . 1 PHE CZ 1 1 17 12882 2 2 1 PHE HA H 10.501 8.007 -5.625 1.00 . B B . 1 PHE HA 1 1 17 12883 2 2 1 PHE HB2 H 7.870 7.409 -7.070 1.00 . B B . 1 PHE HB2 1 1 17 12884 2 2 1 PHE HB3 H 7.994 8.092 -5.462 1.00 . B B . 1 PHE HB3 1 1 17 12885 2 2 1 PHE HD1 H 8.738 8.731 -9.043 1.00 . B B . 1 PHE HD1 1 1 17 12886 2 2 1 PHE HD2 H 8.415 10.420 -5.156 1.00 . B B . 1 PHE HD2 1 1 17 12887 2 2 1 PHE HE1 H 8.889 10.985 -10.012 1.00 . B B . 1 PHE HE1 1 1 17 12888 2 2 1 PHE HE2 H 8.561 12.675 -6.120 1.00 . B B . 1 PHE HE2 1 1 17 12889 2 2 1 PHE HZ H 8.801 12.961 -8.549 1.00 . B B . 1 PHE HZ 1 1 17 12890 2 2 1 PHE N N 10.524 7.369 -7.639 1.00 . B B . 1 PHE N 1 1 17 12891 2 2 1 PHE O O 8.740 5.506 -5.287 1.00 . B B . 1 PHE O 1 1 17 12892 2 2 2 VAL C C 11.903 3.852 -3.582 1.00 . B B . 2 VAL C 1 1 17 12893 2 2 2 VAL CA C 11.034 3.999 -4.866 1.00 . B B . 2 VAL CA 1 1 17 12894 2 2 2 VAL CB C 11.547 3.022 -5.929 1.00 . B B . 2 VAL CB 1 1 17 12895 2 2 2 VAL CG1 C 10.482 2.836 -7.025 1.00 . B B . 2 VAL CG1 1 1 17 12896 2 2 2 VAL CG2 C 12.834 3.534 -6.603 1.00 . B B . 2 VAL CG2 1 1 17 12897 2 2 2 VAL H H 11.750 5.746 -5.783 1.00 . B B . 2 VAL H 1 1 17 12898 2 2 2 VAL HA H 10.043 3.701 -4.668 1.00 . B B . 2 VAL HA 1 1 17 12899 2 2 2 VAL HB H 11.712 2.105 -5.379 1.00 . B B . 2 VAL HB 1 1 17 12900 2 2 2 VAL HG11 H 9.568 2.440 -6.600 1.00 . B B . 2 VAL HG11 1 1 17 12901 2 2 2 VAL HG12 H 10.255 3.776 -7.505 1.00 . B B . 2 VAL HG12 1 1 17 12902 2 2 2 VAL HG13 H 10.832 2.139 -7.774 1.00 . B B . 2 VAL HG13 1 1 17 12903 2 2 2 VAL HG21 H 13.614 3.668 -5.868 1.00 . B B . 2 VAL HG21 1 1 17 12904 2 2 2 VAL HG22 H 13.178 2.814 -7.332 1.00 . B B . 2 VAL HG22 1 1 17 12905 2 2 2 VAL HG23 H 12.667 4.473 -7.109 1.00 . B B . 2 VAL HG23 1 1 17 12906 2 2 2 VAL N N 10.934 5.351 -5.475 1.00 . B B . 2 VAL N 1 1 17 12907 2 2 2 VAL O O 12.917 3.186 -3.514 1.00 . B B . 2 VAL O 1 1 17 12908 2 2 3 ASN C C 11.132 4.024 -0.137 1.00 . B B . 3 ASN C 1 1 17 12909 2 2 3 ASN CA C 12.113 4.515 -1.220 1.00 . B B . 3 ASN CA 1 1 17 12910 2 2 3 ASN CB C 12.528 5.948 -0.930 1.00 . B B . 3 ASN CB 1 1 17 12911 2 2 3 ASN CG C 13.360 6.520 -2.060 1.00 . B B . 3 ASN CG 1 1 17 12912 2 2 3 ASN H H 10.625 5.011 -2.733 1.00 . B B . 3 ASN H 1 1 17 12913 2 2 3 ASN HA H 12.964 3.845 -1.216 1.00 . B B . 3 ASN HA 1 1 17 12914 2 2 3 ASN HB2 H 11.627 6.542 -0.841 1.00 . B B . 3 ASN HB2 1 1 17 12915 2 2 3 ASN HB3 H 13.059 6.001 0.005 1.00 . B B . 3 ASN HB3 1 1 17 12916 2 2 3 ASN HD21 H 15.013 6.653 -1.001 1.00 . B B . 3 ASN HD21 1 1 17 12917 2 2 3 ASN HD22 H 15.084 7.163 -2.630 1.00 . B B . 3 ASN HD22 1 1 17 12918 2 2 3 ASN N N 11.442 4.507 -2.570 1.00 . B B . 3 ASN N 1 1 17 12919 2 2 3 ASN ND2 N 14.596 6.800 -1.868 1.00 . B B . 3 ASN ND2 1 1 17 12920 2 2 3 ASN O O 11.208 4.405 1.014 1.00 . B B . 3 ASN O 1 1 17 12921 2 2 3 ASN OD1 O 12.917 6.734 -3.164 1.00 . B B . 3 ASN OD1 1 1 17 12922 2 2 4 GLN C C 9.109 1.145 0.782 1.00 . B B . 4 GLN C 1 1 17 12923 2 2 4 GLN CA C 9.224 2.656 0.443 1.00 . B B . 4 GLN CA 1 1 17 12924 2 2 4 GLN CB C 7.884 3.207 -0.075 1.00 . B B . 4 GLN CB 1 1 17 12925 2 2 4 GLN CD C 8.634 5.304 -1.477 1.00 . B B . 4 GLN CD 1 1 17 12926 2 2 4 GLN CG C 7.914 4.789 -0.228 1.00 . B B . 4 GLN CG 1 1 17 12927 2 2 4 GLN H H 10.235 2.878 -1.463 1.00 . B B . 4 GLN H 1 1 17 12928 2 2 4 GLN HA H 9.380 3.142 1.396 1.00 . B B . 4 GLN HA 1 1 17 12929 2 2 4 GLN HB2 H 7.719 2.719 -1.021 1.00 . B B . 4 GLN HB2 1 1 17 12930 2 2 4 GLN HB3 H 7.095 2.920 0.602 1.00 . B B . 4 GLN HB3 1 1 17 12931 2 2 4 GLN HE21 H 7.900 3.991 -2.739 1.00 . B B . 4 GLN HE21 1 1 17 12932 2 2 4 GLN HE22 H 8.928 5.161 -3.393 1.00 . B B . 4 GLN HE22 1 1 17 12933 2 2 4 GLN HG2 H 6.913 5.188 -0.261 1.00 . B B . 4 GLN HG2 1 1 17 12934 2 2 4 GLN HG3 H 8.418 5.236 0.616 1.00 . B B . 4 GLN HG3 1 1 17 12935 2 2 4 GLN N N 10.235 3.170 -0.530 1.00 . B B . 4 GLN N 1 1 17 12936 2 2 4 GLN NE2 N 8.471 4.768 -2.627 1.00 . B B . 4 GLN NE2 1 1 17 12937 2 2 4 GLN O O 8.427 0.392 0.119 1.00 . B B . 4 GLN O 1 1 17 12938 2 2 4 GLN OE1 O 9.390 6.241 -1.452 1.00 . B B . 4 GLN OE1 1 1 17 12939 2 2 5 HIS C C 9.040 -0.582 3.707 1.00 . B B . 5 HIS C 1 1 17 12940 2 2 5 HIS CA C 9.819 -0.629 2.363 1.00 . B B . 5 HIS CA 1 1 17 12941 2 2 5 HIS CB C 11.284 -1.066 2.606 1.00 . B B . 5 HIS CB 1 1 17 12942 2 2 5 HIS CD2 C 13.075 -1.242 0.681 1.00 . B B . 5 HIS CD2 1 1 17 12943 2 2 5 HIS CE1 C 12.265 -2.857 -0.325 1.00 . B B . 5 HIS CE1 1 1 17 12944 2 2 5 HIS CG C 11.932 -1.618 1.352 1.00 . B B . 5 HIS CG 1 1 17 12945 2 2 5 HIS H H 10.300 1.487 2.268 1.00 . B B . 5 HIS H 1 1 17 12946 2 2 5 HIS HA H 9.292 -1.298 1.688 1.00 . B B . 5 HIS HA 1 1 17 12947 2 2 5 HIS HB2 H 11.871 -0.236 2.960 1.00 . B B . 5 HIS HB2 1 1 17 12948 2 2 5 HIS HB3 H 11.313 -1.845 3.357 1.00 . B B . 5 HIS HB3 1 1 17 12949 2 2 5 HIS HD1 H 10.661 -3.117 0.896 1.00 . B B . 5 HIS HD1 1 1 17 12950 2 2 5 HIS HD2 H 13.717 -0.427 0.969 1.00 . B B . 5 HIS HD2 1 1 17 12951 2 2 5 HIS HE1 H 12.120 -3.650 -1.046 1.00 . B B . 5 HIS HE1 1 1 17 12952 2 2 5 HIS N N 9.790 0.783 1.829 1.00 . B B . 5 HIS N 1 1 17 12953 2 2 5 HIS ND1 N 11.480 -2.616 0.679 1.00 . B B . 5 HIS ND1 1 1 17 12954 2 2 5 HIS NE2 N 13.271 -2.024 -0.361 1.00 . B B . 5 HIS NE2 1 1 17 12955 2 2 5 HIS O O 9.551 -0.727 4.802 1.00 . B B . 5 HIS O 1 1 17 12956 2 2 6 LEU C C 5.832 -1.465 4.677 1.00 . B B . 6 LEU C 1 1 17 12957 2 2 6 LEU CA C 6.814 -0.265 4.698 1.00 . B B . 6 LEU CA 1 1 17 12958 2 2 6 LEU CB C 6.166 1.183 4.545 1.00 . B B . 6 LEU CB 1 1 17 12959 2 2 6 LEU CD1 C 5.376 3.075 3.093 1.00 . B B . 6 LEU CD1 1 1 17 12960 2 2 6 LEU CD2 C 5.903 0.981 1.973 1.00 . B B . 6 LEU CD2 1 1 17 12961 2 2 6 LEU CG C 5.344 1.544 3.257 1.00 . B B . 6 LEU CG 1 1 17 12962 2 2 6 LEU H H 7.457 -0.276 2.634 1.00 . B B . 6 LEU H 1 1 17 12963 2 2 6 LEU HA H 7.366 -0.304 5.628 1.00 . B B . 6 LEU HA 1 1 17 12964 2 2 6 LEU HB2 H 5.507 1.329 5.384 1.00 . B B . 6 LEU HB2 1 1 17 12965 2 2 6 LEU HB3 H 6.974 1.895 4.648 1.00 . B B . 6 LEU HB3 1 1 17 12966 2 2 6 LEU HD11 H 6.396 3.422 2.999 1.00 . B B . 6 LEU HD11 1 1 17 12967 2 2 6 LEU HD12 H 4.838 3.371 2.205 1.00 . B B . 6 LEU HD12 1 1 17 12968 2 2 6 LEU HD13 H 4.928 3.572 3.937 1.00 . B B . 6 LEU HD13 1 1 17 12969 2 2 6 LEU HD21 H 6.920 1.308 1.847 1.00 . B B . 6 LEU HD21 1 1 17 12970 2 2 6 LEU HD22 H 5.869 -0.097 1.984 1.00 . B B . 6 LEU HD22 1 1 17 12971 2 2 6 LEU HD23 H 5.325 1.315 1.124 1.00 . B B . 6 LEU HD23 1 1 17 12972 2 2 6 LEU HG H 4.320 1.205 3.381 1.00 . B B . 6 LEU HG 1 1 17 12973 2 2 6 LEU N N 7.774 -0.364 3.553 1.00 . B B . 6 LEU N 1 1 17 12974 2 2 6 LEU O O 5.054 -1.652 3.769 1.00 . B B . 6 LEU O 1 1 17 12975 2 2 7 CYS C C 3.756 -3.478 6.729 1.00 . B B . 7 CYS C 1 1 17 12976 2 2 7 CYS CA C 4.999 -3.481 5.801 1.00 . B B . 7 CYS CA 1 1 17 12977 2 2 7 CYS CB C 5.946 -4.643 6.159 1.00 . B B . 7 CYS CB 1 1 17 12978 2 2 7 CYS H H 6.525 -2.049 6.422 1.00 . B B . 7 CYS H 1 1 17 12979 2 2 7 CYS HA H 4.609 -3.691 4.817 1.00 . B B . 7 CYS HA 1 1 17 12980 2 2 7 CYS HB2 H 6.797 -4.604 5.489 1.00 . B B . 7 CYS HB2 1 1 17 12981 2 2 7 CYS HB3 H 6.318 -4.517 7.165 1.00 . B B . 7 CYS HB3 1 1 17 12982 2 2 7 CYS HG H 4.833 -6.527 6.868 1.00 . B B . 7 CYS HG 1 1 17 12983 2 2 7 CYS N N 5.890 -2.263 5.713 1.00 . B B . 7 CYS N 1 1 17 12984 2 2 7 CYS O O 2.730 -4.010 6.361 1.00 . B B . 7 CYS O 1 1 17 12985 2 2 7 CYS SG S 5.251 -6.310 6.033 1.00 . B B . 7 CYS SG 1 1 17 12986 2 2 8 GLY C C 2.177 -1.472 9.065 1.00 . B B . 8 GLY C 1 1 17 12987 2 2 8 GLY CA C 2.643 -2.887 8.831 1.00 . B B . 8 GLY CA 1 1 17 12988 2 2 8 GLY H H 4.686 -2.497 8.173 1.00 . B B . 8 GLY H 1 1 17 12989 2 2 8 GLY HA2 H 1.813 -3.429 8.418 1.00 . B B . 8 GLY HA2 1 1 17 12990 2 2 8 GLY HA3 H 2.927 -3.293 9.791 1.00 . B B . 8 GLY HA3 1 1 17 12991 2 2 8 GLY N N 3.843 -2.909 7.901 1.00 . B B . 8 GLY N 1 1 17 12992 2 2 8 GLY O O 1.563 -0.852 8.225 1.00 . B B . 8 GLY O 1 1 17 12993 2 2 9 ASP C C 2.420 1.404 9.505 1.00 . B B . 9 ASP C 1 1 17 12994 2 2 9 ASP CA C 2.146 0.377 10.659 1.00 . B B . 9 ASP CA 1 1 17 12995 2 2 9 ASP CB C 3.038 0.514 11.941 1.00 . B B . 9 ASP CB 1 1 17 12996 2 2 9 ASP CG C 4.515 0.096 11.776 1.00 . B B . 9 ASP CG 1 1 17 12997 2 2 9 ASP H H 2.998 -1.541 10.849 1.00 . B B . 9 ASP H 1 1 17 12998 2 2 9 ASP HA H 1.078 0.427 10.867 1.00 . B B . 9 ASP HA 1 1 17 12999 2 2 9 ASP HB2 H 3.041 1.550 12.248 1.00 . B B . 9 ASP HB2 1 1 17 13000 2 2 9 ASP HB3 H 2.637 -0.066 12.752 1.00 . B B . 9 ASP HB3 1 1 17 13001 2 2 9 ASP N N 2.489 -0.997 10.214 1.00 . B B . 9 ASP N 1 1 17 13002 2 2 9 ASP O O 1.577 2.020 8.882 1.00 . B B . 9 ASP O 1 1 17 13003 2 2 9 ASP OD1 O 4.884 -0.515 10.779 1.00 . B B . 9 ASP OD1 1 1 17 13004 2 2 9 ASP OD2 O 5.219 0.423 12.699 1.00 . B B . 9 ASP OD2 1 1 17 13005 2 2 10 HIS C C 3.502 2.272 6.796 1.00 . B B . 10 HIS C 1 1 17 13006 2 2 10 HIS CA C 4.222 2.413 8.167 1.00 . B B . 10 HIS CA 1 1 17 13007 2 2 10 HIS CB C 5.712 2.064 8.118 1.00 . B B . 10 HIS CB 1 1 17 13008 2 2 10 HIS CD2 C 7.757 3.676 7.766 1.00 . B B . 10 HIS CD2 1 1 17 13009 2 2 10 HIS CE1 C 7.162 4.579 6.004 1.00 . B B . 10 HIS CE1 1 1 17 13010 2 2 10 HIS CG C 6.542 3.133 7.419 1.00 . B B . 10 HIS CG 1 1 17 13011 2 2 10 HIS H H 4.252 0.922 9.762 1.00 . B B . 10 HIS H 1 1 17 13012 2 2 10 HIS HA H 4.055 3.431 8.495 1.00 . B B . 10 HIS HA 1 1 17 13013 2 2 10 HIS HB2 H 6.064 1.966 9.136 1.00 . B B . 10 HIS HB2 1 1 17 13014 2 2 10 HIS HB3 H 5.845 1.117 7.620 1.00 . B B . 10 HIS HB3 1 1 17 13015 2 2 10 HIS HD1 H 5.401 3.567 5.821 1.00 . B B . 10 HIS HD1 1 1 17 13016 2 2 10 HIS HD2 H 8.320 3.403 8.645 1.00 . B B . 10 HIS HD2 1 1 17 13017 2 2 10 HIS HE1 H 7.152 5.216 5.128 1.00 . B B . 10 HIS HE1 1 1 17 13018 2 2 10 HIS N N 3.677 1.506 9.223 1.00 . B B . 10 HIS N 1 1 17 13019 2 2 10 HIS ND1 N 6.231 3.732 6.324 1.00 . B B . 10 HIS ND1 1 1 17 13020 2 2 10 HIS NE2 N 8.134 4.573 6.880 1.00 . B B . 10 HIS NE2 1 1 17 13021 2 2 10 HIS O O 3.676 3.065 5.891 1.00 . B B . 10 HIS O 1 1 17 13022 2 2 11 LEU C C 0.477 1.380 5.705 1.00 . B B . 11 LEU C 1 1 17 13023 2 2 11 LEU CA C 1.938 0.958 5.440 1.00 . B B . 11 LEU CA 1 1 17 13024 2 2 11 LEU CB C 2.132 -0.540 5.200 1.00 . B B . 11 LEU CB 1 1 17 13025 2 2 11 LEU CD1 C 2.102 -0.365 2.726 1.00 . B B . 11 LEU CD1 1 1 17 13026 2 2 11 LEU CD2 C 1.722 -2.528 3.949 1.00 . B B . 11 LEU CD2 1 1 17 13027 2 2 11 LEU CG C 1.432 -1.027 3.945 1.00 . B B . 11 LEU CG 1 1 17 13028 2 2 11 LEU H H 2.619 0.661 7.456 1.00 . B B . 11 LEU H 1 1 17 13029 2 2 11 LEU HA H 2.311 1.558 4.624 1.00 . B B . 11 LEU HA 1 1 17 13030 2 2 11 LEU HB2 H 3.189 -0.741 5.113 1.00 . B B . 11 LEU HB2 1 1 17 13031 2 2 11 LEU HB3 H 1.755 -1.105 6.036 1.00 . B B . 11 LEU HB3 1 1 17 13032 2 2 11 LEU HD11 H 2.033 0.709 2.786 1.00 . B B . 11 LEU HD11 1 1 17 13033 2 2 11 LEU HD12 H 3.149 -0.636 2.681 1.00 . B B . 11 LEU HD12 1 1 17 13034 2 2 11 LEU HD13 H 1.642 -0.656 1.801 1.00 . B B . 11 LEU HD13 1 1 17 13035 2 2 11 LEU HD21 H 1.349 -2.961 4.865 1.00 . B B . 11 LEU HD21 1 1 17 13036 2 2 11 LEU HD22 H 1.258 -3.059 3.146 1.00 . B B . 11 LEU HD22 1 1 17 13037 2 2 11 LEU HD23 H 2.788 -2.699 3.899 1.00 . B B . 11 LEU HD23 1 1 17 13038 2 2 11 LEU HG H 0.366 -0.831 3.981 1.00 . B B . 11 LEU HG 1 1 17 13039 2 2 11 LEU N N 2.710 1.251 6.680 1.00 . B B . 11 LEU N 1 1 17 13040 2 2 11 LEU O O -0.124 2.083 4.916 1.00 . B B . 11 LEU O 1 1 17 13041 2 2 12 VAL C C -1.581 2.898 7.162 1.00 . B B . 12 VAL C 1 1 17 13042 2 2 12 VAL CA C -1.514 1.360 7.102 1.00 . B B . 12 VAL CA 1 1 17 13043 2 2 12 VAL CB C -1.956 0.725 8.441 1.00 . B B . 12 VAL CB 1 1 17 13044 2 2 12 VAL CG1 C -0.969 1.015 9.535 1.00 . B B . 12 VAL CG1 1 1 17 13045 2 2 12 VAL CG2 C -3.258 1.394 8.857 1.00 . B B . 12 VAL CG2 1 1 17 13046 2 2 12 VAL H H 0.429 0.383 7.394 1.00 . B B . 12 VAL H 1 1 17 13047 2 2 12 VAL HA H -2.179 1.046 6.329 1.00 . B B . 12 VAL HA 1 1 17 13048 2 2 12 VAL HB H -2.053 -0.346 8.313 1.00 . B B . 12 VAL HB 1 1 17 13049 2 2 12 VAL HG11 H -0.817 2.077 9.685 1.00 . B B . 12 VAL HG11 1 1 17 13050 2 2 12 VAL HG12 H -1.270 0.603 10.481 1.00 . B B . 12 VAL HG12 1 1 17 13051 2 2 12 VAL HG13 H -0.033 0.578 9.252 1.00 . B B . 12 VAL HG13 1 1 17 13052 2 2 12 VAL HG21 H -4.011 1.299 8.090 1.00 . B B . 12 VAL HG21 1 1 17 13053 2 2 12 VAL HG22 H -3.621 0.992 9.787 1.00 . B B . 12 VAL HG22 1 1 17 13054 2 2 12 VAL HG23 H -3.059 2.446 9.017 1.00 . B B . 12 VAL HG23 1 1 17 13055 2 2 12 VAL N N -0.092 0.957 6.797 1.00 . B B . 12 VAL N 1 1 17 13056 2 2 12 VAL O O -2.476 3.486 6.572 1.00 . B B . 12 VAL O 1 1 17 13057 2 2 13 GLU C C -0.636 5.628 6.570 1.00 . B B . 13 GLU C 1 1 17 13058 2 2 13 GLU CA C -0.586 4.979 7.977 1.00 . B B . 13 GLU CA 1 1 17 13059 2 2 13 GLU CB C 0.719 5.337 8.756 1.00 . B B . 13 GLU CB 1 1 17 13060 2 2 13 GLU CD C -0.065 4.206 10.978 1.00 . B B . 13 GLU CD 1 1 17 13061 2 2 13 GLU CG C 0.367 5.500 10.292 1.00 . B B . 13 GLU CG 1 1 17 13062 2 2 13 GLU H H 0.055 2.957 8.302 1.00 . B B . 13 GLU H 1 1 17 13063 2 2 13 GLU HA H -1.445 5.312 8.534 1.00 . B B . 13 GLU HA 1 1 17 13064 2 2 13 GLU HB2 H 1.443 4.537 8.655 1.00 . B B . 13 GLU HB2 1 1 17 13065 2 2 13 GLU HB3 H 1.154 6.248 8.373 1.00 . B B . 13 GLU HB3 1 1 17 13066 2 2 13 GLU HG2 H 1.231 5.846 10.835 1.00 . B B . 13 GLU HG2 1 1 17 13067 2 2 13 GLU HG3 H -0.429 6.210 10.432 1.00 . B B . 13 GLU HG3 1 1 17 13068 2 2 13 GLU N N -0.639 3.490 7.851 1.00 . B B . 13 GLU N 1 1 17 13069 2 2 13 GLU O O -0.920 6.801 6.405 1.00 . B B . 13 GLU O 1 1 17 13070 2 2 13 GLU OE1 O 0.819 3.411 11.206 1.00 . B B . 13 GLU OE1 1 1 17 13071 2 2 13 GLU OE2 O -1.249 4.088 11.234 1.00 . B B . 13 GLU OE2 1 1 17 13072 2 2 14 ALA C C -1.784 4.959 3.681 1.00 . B B . 14 ALA C 1 1 17 13073 2 2 14 ALA CA C -0.377 5.307 4.168 1.00 . B B . 14 ALA CA 1 1 17 13074 2 2 14 ALA CB C 0.762 4.570 3.391 1.00 . B B . 14 ALA CB 1 1 17 13075 2 2 14 ALA H H -0.142 3.887 5.761 1.00 . B B . 14 ALA H 1 1 17 13076 2 2 14 ALA HA H -0.336 6.373 4.188 1.00 . B B . 14 ALA HA 1 1 17 13077 2 2 14 ALA HB1 H 1.715 4.754 3.868 1.00 . B B . 14 ALA HB1 1 1 17 13078 2 2 14 ALA HB2 H 0.600 3.505 3.365 1.00 . B B . 14 ALA HB2 1 1 17 13079 2 2 14 ALA HB3 H 0.806 4.928 2.373 1.00 . B B . 14 ALA HB3 1 1 17 13080 2 2 14 ALA N N -0.357 4.822 5.571 1.00 . B B . 14 ALA N 1 1 17 13081 2 2 14 ALA O O -2.490 5.858 3.256 1.00 . B B . 14 ALA O 1 1 17 13082 2 2 15 LEU C C -4.529 4.383 3.630 1.00 . B B . 15 LEU C 1 1 17 13083 2 2 15 LEU CA C -3.517 3.260 3.301 1.00 . B B . 15 LEU CA 1 1 17 13084 2 2 15 LEU CB C -3.875 1.934 4.057 1.00 . B B . 15 LEU CB 1 1 17 13085 2 2 15 LEU CD1 C -2.463 -0.158 4.256 1.00 . B B . 15 LEU CD1 1 1 17 13086 2 2 15 LEU CD2 C -4.495 -0.242 2.967 1.00 . B B . 15 LEU CD2 1 1 17 13087 2 2 15 LEU CG C -3.315 0.684 3.335 1.00 . B B . 15 LEU CG 1 1 17 13088 2 2 15 LEU H H -1.518 3.025 4.038 1.00 . B B . 15 LEU H 1 1 17 13089 2 2 15 LEU HA H -3.479 3.146 2.238 1.00 . B B . 15 LEU HA 1 1 17 13090 2 2 15 LEU HB2 H -3.477 1.995 5.058 1.00 . B B . 15 LEU HB2 1 1 17 13091 2 2 15 LEU HB3 H -4.947 1.850 4.146 1.00 . B B . 15 LEU HB3 1 1 17 13092 2 2 15 LEU HD11 H -3.016 -0.483 5.127 1.00 . B B . 15 LEU HD11 1 1 17 13093 2 2 15 LEU HD12 H -2.108 -1.030 3.735 1.00 . B B . 15 LEU HD12 1 1 17 13094 2 2 15 LEU HD13 H -1.597 0.400 4.560 1.00 . B B . 15 LEU HD13 1 1 17 13095 2 2 15 LEU HD21 H -5.036 -0.515 3.862 1.00 . B B . 15 LEU HD21 1 1 17 13096 2 2 15 LEU HD22 H -5.186 0.229 2.288 1.00 . B B . 15 LEU HD22 1 1 17 13097 2 2 15 LEU HD23 H -4.143 -1.153 2.509 1.00 . B B . 15 LEU HD23 1 1 17 13098 2 2 15 LEU HG H -2.700 0.998 2.495 1.00 . B B . 15 LEU HG 1 1 17 13099 2 2 15 LEU N N -2.153 3.696 3.728 1.00 . B B . 15 LEU N 1 1 17 13100 2 2 15 LEU O O -5.258 4.831 2.773 1.00 . B B . 15 LEU O 1 1 17 13101 2 2 16 TYR C C -5.856 6.948 4.422 1.00 . B B . 16 TYR C 1 1 17 13102 2 2 16 TYR CA C -5.393 5.863 5.426 1.00 . B B . 16 TYR CA 1 1 17 13103 2 2 16 TYR CB C -4.634 6.535 6.590 1.00 . B B . 16 TYR CB 1 1 17 13104 2 2 16 TYR CD1 C -5.215 4.517 8.088 1.00 . B B . 16 TYR CD1 1 1 17 13105 2 2 16 TYR CD2 C -3.735 6.204 8.866 1.00 . B B . 16 TYR CD2 1 1 17 13106 2 2 16 TYR CE1 C -5.061 3.847 9.290 1.00 . B B . 16 TYR CE1 1 1 17 13107 2 2 16 TYR CE2 C -3.591 5.528 10.054 1.00 . B B . 16 TYR CE2 1 1 17 13108 2 2 16 TYR CG C -4.545 5.708 7.872 1.00 . B B . 16 TYR CG 1 1 17 13109 2 2 16 TYR CZ C -4.249 4.355 10.268 1.00 . B B . 16 TYR CZ 1 1 17 13110 2 2 16 TYR H H -3.858 4.330 5.468 1.00 . B B . 16 TYR H 1 1 17 13111 2 2 16 TYR HA H -6.299 5.408 5.790 1.00 . B B . 16 TYR HA 1 1 17 13112 2 2 16 TYR HB2 H -3.613 6.707 6.268 1.00 . B B . 16 TYR HB2 1 1 17 13113 2 2 16 TYR HB3 H -5.069 7.495 6.836 1.00 . B B . 16 TYR HB3 1 1 17 13114 2 2 16 TYR HD1 H -5.846 4.098 7.325 1.00 . B B . 16 TYR HD1 1 1 17 13115 2 2 16 TYR HD2 H -3.200 7.133 8.715 1.00 . B B . 16 TYR HD2 1 1 17 13116 2 2 16 TYR HE1 H -5.565 2.917 9.492 1.00 . B B . 16 TYR HE1 1 1 17 13117 2 2 16 TYR HE2 H -2.948 5.908 10.837 1.00 . B B . 16 TYR HE2 1 1 17 13118 2 2 16 TYR HH H -3.096 3.742 11.514 1.00 . B B . 16 TYR HH 1 1 17 13119 2 2 16 TYR N N -4.507 4.777 4.877 1.00 . B B . 16 TYR N 1 1 17 13120 2 2 16 TYR O O -7.021 7.306 4.431 1.00 . B B . 16 TYR O 1 1 17 13121 2 2 16 TYR OH O -4.070 3.691 11.452 1.00 . B B . 16 TYR OH 1 1 17 13122 2 2 17 LEU C C -5.059 7.918 1.144 1.00 . B B . 17 LEU C 1 1 17 13123 2 2 17 LEU CA C -5.166 8.455 2.594 1.00 . B B . 17 LEU CA 1 1 17 13124 2 2 17 LEU CB C -4.125 9.625 2.776 1.00 . B B . 17 LEU CB 1 1 17 13125 2 2 17 LEU CD1 C -5.477 10.504 4.761 1.00 . B B . 17 LEU CD1 1 1 17 13126 2 2 17 LEU CD2 C -3.222 9.491 5.143 1.00 . B B . 17 LEU CD2 1 1 17 13127 2 2 17 LEU CG C -4.081 10.297 4.176 1.00 . B B . 17 LEU CG 1 1 17 13128 2 2 17 LEU H H -4.029 7.005 3.719 1.00 . B B . 17 LEU H 1 1 17 13129 2 2 17 LEU HA H -6.169 8.845 2.698 1.00 . B B . 17 LEU HA 1 1 17 13130 2 2 17 LEU HB2 H -3.137 9.251 2.546 1.00 . B B . 17 LEU HB2 1 1 17 13131 2 2 17 LEU HB3 H -4.354 10.392 2.049 1.00 . B B . 17 LEU HB3 1 1 17 13132 2 2 17 LEU HD11 H -6.066 11.129 4.105 1.00 . B B . 17 LEU HD11 1 1 17 13133 2 2 17 LEU HD12 H -5.987 9.563 4.892 1.00 . B B . 17 LEU HD12 1 1 17 13134 2 2 17 LEU HD13 H -5.400 10.988 5.724 1.00 . B B . 17 LEU HD13 1 1 17 13135 2 2 17 LEU HD21 H -3.602 8.494 5.253 1.00 . B B . 17 LEU HD21 1 1 17 13136 2 2 17 LEU HD22 H -2.206 9.424 4.781 1.00 . B B . 17 LEU HD22 1 1 17 13137 2 2 17 LEU HD23 H -3.203 9.960 6.115 1.00 . B B . 17 LEU HD23 1 1 17 13138 2 2 17 LEU HG H -3.621 11.273 4.058 1.00 . B B . 17 LEU HG 1 1 17 13139 2 2 17 LEU N N -4.923 7.397 3.630 1.00 . B B . 17 LEU N 1 1 17 13140 2 2 17 LEU O O -5.912 8.205 0.329 1.00 . B B . 17 LEU O 1 1 17 13141 2 2 18 VAL C C -5.084 5.746 -1.013 1.00 . B B . 18 VAL C 1 1 17 13142 2 2 18 VAL CA C -3.913 6.630 -0.574 1.00 . B B . 18 VAL CA 1 1 17 13143 2 2 18 VAL CB C -2.611 5.826 -0.732 1.00 . B B . 18 VAL CB 1 1 17 13144 2 2 18 VAL CG1 C -1.448 6.718 -0.337 1.00 . B B . 18 VAL CG1 1 1 17 13145 2 2 18 VAL CG2 C -2.644 4.584 0.138 1.00 . B B . 18 VAL CG2 1 1 17 13146 2 2 18 VAL H H -3.374 6.937 1.541 1.00 . B B . 18 VAL H 1 1 17 13147 2 2 18 VAL HA H -3.868 7.445 -1.277 1.00 . B B . 18 VAL HA 1 1 17 13148 2 2 18 VAL HB H -2.512 5.539 -1.776 1.00 . B B . 18 VAL HB 1 1 17 13149 2 2 18 VAL HG11 H -1.446 7.598 -0.969 1.00 . B B . 18 VAL HG11 1 1 17 13150 2 2 18 VAL HG12 H -1.545 7.034 0.692 1.00 . B B . 18 VAL HG12 1 1 17 13151 2 2 18 VAL HG13 H -0.516 6.195 -0.463 1.00 . B B . 18 VAL HG13 1 1 17 13152 2 2 18 VAL HG21 H -2.811 4.870 1.163 1.00 . B B . 18 VAL HG21 1 1 17 13153 2 2 18 VAL HG22 H -3.453 3.943 -0.180 1.00 . B B . 18 VAL HG22 1 1 17 13154 2 2 18 VAL HG23 H -1.722 4.033 0.057 1.00 . B B . 18 VAL HG23 1 1 17 13155 2 2 18 VAL N N -4.034 7.159 0.844 1.00 . B B . 18 VAL N 1 1 17 13156 2 2 18 VAL O O -5.429 5.741 -2.175 1.00 . B B . 18 VAL O 1 1 17 13157 2 2 19 CYS C C -7.922 4.662 -1.300 1.00 . B B . 19 CYS C 1 1 17 13158 2 2 19 CYS CA C -6.790 4.112 -0.376 1.00 . B B . 19 CYS CA 1 1 17 13159 2 2 19 CYS CB C -7.365 3.662 1.033 1.00 . B B . 19 CYS CB 1 1 17 13160 2 2 19 CYS H H -5.320 5.035 0.834 1.00 . B B . 19 CYS H 1 1 17 13161 2 2 19 CYS HA H -6.375 3.267 -0.864 1.00 . B B . 19 CYS HA 1 1 17 13162 2 2 19 CYS HB2 H -7.305 4.534 1.670 1.00 . B B . 19 CYS HB2 1 1 17 13163 2 2 19 CYS HB3 H -8.398 3.384 0.939 1.00 . B B . 19 CYS HB3 1 1 17 13164 2 2 19 CYS HG H -6.093 2.775 2.718 1.00 . B B . 19 CYS HG 1 1 17 13165 2 2 19 CYS N N -5.644 5.011 -0.087 1.00 . B B . 19 CYS N 1 1 17 13166 2 2 19 CYS O O -8.986 4.851 -0.776 1.00 . B B . 19 CYS O 1 1 17 13167 2 2 19 CYS SG S -6.608 2.355 2.026 1.00 . B B . 19 CYS SG 1 1 17 13168 2 2 20 GLY C C -10.269 5.558 -2.813 1.00 . B B . 20 GLY C 1 1 17 13169 2 2 20 GLY CA C -8.880 5.457 -3.477 1.00 . B B . 20 GLY CA 1 1 17 13170 2 2 20 GLY H H -6.859 4.738 -2.932 1.00 . B B . 20 GLY H 1 1 17 13171 2 2 20 GLY HA2 H -8.618 6.450 -3.809 1.00 . B B . 20 GLY HA2 1 1 17 13172 2 2 20 GLY HA3 H -8.984 4.839 -4.355 1.00 . B B . 20 GLY HA3 1 1 17 13173 2 2 20 GLY N N -7.756 4.915 -2.576 1.00 . B B . 20 GLY N 1 1 17 13174 2 2 20 GLY O O -11.114 4.714 -3.025 1.00 . B B . 20 GLY O 1 1 17 13175 2 2 21 GLU C C -12.154 5.587 -0.492 1.00 . B B . 21 GLU C 1 1 17 13176 2 2 21 GLU CA C -11.698 6.876 -1.260 1.00 . B B . 21 GLU CA 1 1 17 13177 2 2 21 GLU CB C -12.604 7.427 -2.355 1.00 . B B . 21 GLU CB 1 1 17 13178 2 2 21 GLU CD C -12.528 9.549 -3.873 1.00 . B B . 21 GLU CD 1 1 17 13179 2 2 21 GLU CG C -11.723 8.616 -2.988 1.00 . B B . 21 GLU CG 1 1 17 13180 2 2 21 GLU H H -9.660 7.184 -1.932 1.00 . B B . 21 GLU H 1 1 17 13181 2 2 21 GLU HA H -11.523 7.657 -0.535 1.00 . B B . 21 GLU HA 1 1 17 13182 2 2 21 GLU HB2 H -12.840 6.663 -3.081 1.00 . B B . 21 GLU HB2 1 1 17 13183 2 2 21 GLU HB3 H -13.520 7.815 -1.930 1.00 . B B . 21 GLU HB3 1 1 17 13184 2 2 21 GLU HG2 H -11.250 9.218 -2.226 1.00 . B B . 21 GLU HG2 1 1 17 13185 2 2 21 GLU HG3 H -10.922 8.211 -3.595 1.00 . B B . 21 GLU HG3 1 1 17 13186 2 2 21 GLU N N -10.421 6.584 -2.020 1.00 . B B . 21 GLU N 1 1 17 13187 2 2 21 GLU O O -13.179 4.937 -0.544 1.00 . B B . 21 GLU O 1 1 17 13188 2 2 21 GLU OE1 O -13.403 10.172 -3.302 1.00 . B B . 21 GLU OE1 1 1 17 13189 2 2 21 GLU OE2 O -12.207 9.575 -5.047 1.00 . B B . 21 GLU OE2 1 1 17 13190 2 2 22 ARG C C -11.414 3.402 2.250 1.00 . B B . 22 ARG C 1 1 17 13191 2 2 22 ARG CA C -10.708 4.369 1.284 1.00 . B B . 22 ARG CA 1 1 17 13192 2 2 22 ARG CB C -9.632 5.228 2.032 1.00 . B B . 22 ARG CB 1 1 17 13193 2 2 22 ARG CD C -10.749 6.468 3.892 1.00 . B B . 22 ARG CD 1 1 17 13194 2 2 22 ARG CG C -10.167 6.593 2.535 1.00 . B B . 22 ARG CG 1 1 17 13195 2 2 22 ARG CZ C -9.493 5.497 5.778 1.00 . B B . 22 ARG CZ 1 1 17 13196 2 2 22 ARG H H -10.438 6.046 0.155 1.00 . B B . 22 ARG H 1 1 17 13197 2 2 22 ARG HA H -10.310 3.616 0.639 1.00 . B B . 22 ARG HA 1 1 17 13198 2 2 22 ARG HB2 H -9.149 4.637 2.796 1.00 . B B . 22 ARG HB2 1 1 17 13199 2 2 22 ARG HB3 H -8.890 5.498 1.299 1.00 . B B . 22 ARG HB3 1 1 17 13200 2 2 22 ARG HD2 H -11.272 7.385 4.121 1.00 . B B . 22 ARG HD2 1 1 17 13201 2 2 22 ARG HD3 H -11.439 5.633 3.894 1.00 . B B . 22 ARG HD3 1 1 17 13202 2 2 22 ARG HE H -8.716 6.748 4.568 1.00 . B B . 22 ARG HE 1 1 17 13203 2 2 22 ARG HG2 H -9.349 7.302 2.555 1.00 . B B . 22 ARG HG2 1 1 17 13204 2 2 22 ARG HG3 H -10.920 6.998 1.873 1.00 . B B . 22 ARG HG3 1 1 17 13205 2 2 22 ARG HH11 H -10.406 4.101 4.857 1.00 . B B . 22 ARG HH11 1 1 17 13206 2 2 22 ARG HH12 H -9.942 3.686 6.454 1.00 . B B . 22 ARG HH12 1 1 17 13207 2 2 22 ARG HH21 H -8.596 6.905 6.697 1.00 . B B . 22 ARG HH21 1 1 17 13208 2 2 22 ARG HH22 H -8.840 5.460 7.631 1.00 . B B . 22 ARG HH22 1 1 17 13209 2 2 22 ARG N N -11.130 5.372 0.260 1.00 . B B . 22 ARG N 1 1 17 13210 2 2 22 ARG NE N -9.548 6.263 4.775 1.00 . B B . 22 ARG NE 1 1 17 13211 2 2 22 ARG NH1 N -9.972 4.343 5.717 1.00 . B B . 22 ARG NH1 1 1 17 13212 2 2 22 ARG NH2 N -8.935 5.975 6.791 1.00 . B B . 22 ARG NH2 1 1 17 13213 2 2 22 ARG O O -11.301 3.488 3.458 1.00 . B B . 22 ARG O 1 1 17 13214 2 2 23 GLY C C -11.925 0.188 2.385 1.00 . B B . 23 GLY C 1 1 17 13215 2 2 23 GLY CA C -12.838 1.426 2.496 1.00 . B B . 23 GLY CA 1 1 17 13216 2 2 23 GLY H H -12.154 2.468 0.702 1.00 . B B . 23 GLY H 1 1 17 13217 2 2 23 GLY HA2 H -12.937 1.709 3.532 1.00 . B B . 23 GLY HA2 1 1 17 13218 2 2 23 GLY HA3 H -13.796 1.193 2.059 1.00 . B B . 23 GLY HA3 1 1 17 13219 2 2 23 GLY N N -12.110 2.467 1.682 1.00 . B B . 23 GLY N 1 1 17 13220 2 2 23 GLY O O -12.343 -0.846 1.918 1.00 . B B . 23 GLY O 1 1 17 13221 2 2 24 PHE C C -9.834 -1.993 2.012 1.00 . B B . 24 PHE C 1 1 17 13222 2 2 24 PHE CA C -9.595 -0.665 2.826 1.00 . B B . 24 PHE CA 1 1 17 13223 2 2 24 PHE CB C -9.285 -1.012 4.330 1.00 . B B . 24 PHE CB 1 1 17 13224 2 2 24 PHE CD1 C -7.737 0.973 4.875 1.00 . B B . 24 PHE CD1 1 1 17 13225 2 2 24 PHE CD2 C -9.526 0.488 6.350 1.00 . B B . 24 PHE CD2 1 1 17 13226 2 2 24 PHE CE1 C -7.362 2.029 5.688 1.00 . B B . 24 PHE CE1 1 1 17 13227 2 2 24 PHE CE2 C -9.157 1.537 7.165 1.00 . B B . 24 PHE CE2 1 1 17 13228 2 2 24 PHE CG C -8.828 0.187 5.197 1.00 . B B . 24 PHE CG 1 1 17 13229 2 2 24 PHE CZ C -8.072 2.313 6.835 1.00 . B B . 24 PHE CZ 1 1 17 13230 2 2 24 PHE H H -10.517 1.269 3.174 1.00 . B B . 24 PHE H 1 1 17 13231 2 2 24 PHE HA H -8.719 -0.210 2.391 1.00 . B B . 24 PHE HA 1 1 17 13232 2 2 24 PHE HB2 H -10.176 -1.439 4.768 1.00 . B B . 24 PHE HB2 1 1 17 13233 2 2 24 PHE HB3 H -8.513 -1.768 4.375 1.00 . B B . 24 PHE HB3 1 1 17 13234 2 2 24 PHE HD1 H -7.161 0.758 3.987 1.00 . B B . 24 PHE HD1 1 1 17 13235 2 2 24 PHE HD2 H -10.373 -0.121 6.624 1.00 . B B . 24 PHE HD2 1 1 17 13236 2 2 24 PHE HE1 H -6.505 2.633 5.420 1.00 . B B . 24 PHE HE1 1 1 17 13237 2 2 24 PHE HE2 H -9.726 1.737 8.066 1.00 . B B . 24 PHE HE2 1 1 17 13238 2 2 24 PHE HZ H -7.773 3.129 7.475 1.00 . B B . 24 PHE HZ 1 1 17 13239 2 2 24 PHE N N -10.704 0.377 2.825 1.00 . B B . 24 PHE N 1 1 17 13240 2 2 24 PHE O O -10.097 -3.038 2.577 1.00 . B B . 24 PHE O 1 1 17 13241 2 2 25 PHE C C -8.833 -4.304 -0.105 1.00 . B B . 25 PHE C 1 1 17 13242 2 2 25 PHE CA C -9.950 -3.217 -0.104 1.00 . B B . 25 PHE CA 1 1 17 13243 2 2 25 PHE CB C -10.264 -2.748 -1.563 1.00 . B B . 25 PHE CB 1 1 17 13244 2 2 25 PHE CD1 C -12.626 -2.089 -0.759 1.00 . B B . 25 PHE CD1 1 1 17 13245 2 2 25 PHE CD2 C -11.916 -1.445 -2.928 1.00 . B B . 25 PHE CD2 1 1 17 13246 2 2 25 PHE CE1 C -13.847 -1.483 -0.977 1.00 . B B . 25 PHE CE1 1 1 17 13247 2 2 25 PHE CE2 C -13.134 -0.836 -3.152 1.00 . B B . 25 PHE CE2 1 1 17 13248 2 2 25 PHE CG C -11.643 -2.078 -1.733 1.00 . B B . 25 PHE CG 1 1 17 13249 2 2 25 PHE CZ C -14.103 -0.854 -2.175 1.00 . B B . 25 PHE CZ 1 1 17 13250 2 2 25 PHE H H -9.464 -1.118 0.263 1.00 . B B . 25 PHE H 1 1 17 13251 2 2 25 PHE HA H -10.820 -3.721 0.293 1.00 . B B . 25 PHE HA 1 1 17 13252 2 2 25 PHE HB2 H -9.505 -2.052 -1.884 1.00 . B B . 25 PHE HB2 1 1 17 13253 2 2 25 PHE HB3 H -10.235 -3.595 -2.232 1.00 . B B . 25 PHE HB3 1 1 17 13254 2 2 25 PHE HD1 H -12.453 -2.571 0.193 1.00 . B B . 25 PHE HD1 1 1 17 13255 2 2 25 PHE HD2 H -11.161 -1.428 -3.703 1.00 . B B . 25 PHE HD2 1 1 17 13256 2 2 25 PHE HE1 H -14.601 -1.504 -0.201 1.00 . B B . 25 PHE HE1 1 1 17 13257 2 2 25 PHE HE2 H -13.327 -0.344 -4.097 1.00 . B B . 25 PHE HE2 1 1 17 13258 2 2 25 PHE HZ H -15.060 -0.379 -2.349 1.00 . B B . 25 PHE HZ 1 1 17 13259 2 2 25 PHE N N -9.713 -1.959 0.709 1.00 . B B . 25 PHE N 1 1 17 13260 2 2 25 PHE O O -8.356 -4.750 -1.139 1.00 . B B . 25 PHE O 1 1 17 13261 2 2 26 TYR C C -7.952 -7.149 0.678 1.00 . B B . 26 TYR C 1 1 17 13262 2 2 26 TYR CA C -7.378 -5.788 1.182 1.00 . B B . 26 TYR CA 1 1 17 13263 2 2 26 TYR CB C -6.923 -5.864 2.670 1.00 . B B . 26 TYR CB 1 1 17 13264 2 2 26 TYR CD1 C -5.152 -7.636 2.199 1.00 . B B . 26 TYR CD1 1 1 17 13265 2 2 26 TYR CD2 C -4.453 -5.554 3.099 1.00 . B B . 26 TYR CD2 1 1 17 13266 2 2 26 TYR CE1 C -3.835 -8.060 2.171 1.00 . B B . 26 TYR CE1 1 1 17 13267 2 2 26 TYR CE2 C -3.142 -5.988 3.067 1.00 . B B . 26 TYR CE2 1 1 17 13268 2 2 26 TYR CG C -5.472 -6.374 2.663 1.00 . B B . 26 TYR CG 1 1 17 13269 2 2 26 TYR CZ C -2.828 -7.237 2.602 1.00 . B B . 26 TYR CZ 1 1 17 13270 2 2 26 TYR H H -8.893 -4.357 1.860 1.00 . B B . 26 TYR H 1 1 17 13271 2 2 26 TYR HA H -6.546 -5.519 0.543 1.00 . B B . 26 TYR HA 1 1 17 13272 2 2 26 TYR HB2 H -6.964 -4.891 3.136 1.00 . B B . 26 TYR HB2 1 1 17 13273 2 2 26 TYR HB3 H -7.538 -6.551 3.236 1.00 . B B . 26 TYR HB3 1 1 17 13274 2 2 26 TYR HD1 H -5.940 -8.296 1.861 1.00 . B B . 26 TYR HD1 1 1 17 13275 2 2 26 TYR HD2 H -4.688 -4.565 3.469 1.00 . B B . 26 TYR HD2 1 1 17 13276 2 2 26 TYR HE1 H -3.589 -9.047 1.812 1.00 . B B . 26 TYR HE1 1 1 17 13277 2 2 26 TYR HE2 H -2.349 -5.344 3.415 1.00 . B B . 26 TYR HE2 1 1 17 13278 2 2 26 TYR HH H -1.291 -7.822 3.477 1.00 . B B . 26 TYR HH 1 1 17 13279 2 2 26 TYR N N -8.452 -4.737 1.068 1.00 . B B . 26 TYR N 1 1 17 13280 2 2 26 TYR O O -8.382 -8.026 1.399 1.00 . B B . 26 TYR O 1 1 17 13281 2 2 26 TYR OH O -1.514 -7.643 2.552 1.00 . B B . 26 TYR OH 1 1 17 13282 2 2 27 THR C C -7.290 -9.414 -1.800 1.00 . B B . 27 THR C 1 1 17 13283 2 2 27 THR CA C -8.398 -8.422 -1.414 1.00 . B B . 27 THR CA 1 1 17 13284 2 2 27 THR CB C -9.075 -7.866 -2.688 1.00 . B B . 27 THR CB 1 1 17 13285 2 2 27 THR CG2 C -10.323 -7.070 -2.368 1.00 . B B . 27 THR CG2 1 1 17 13286 2 2 27 THR H H -7.534 -6.473 -1.092 1.00 . B B . 27 THR H 1 1 17 13287 2 2 27 THR HA H -9.136 -8.963 -0.843 1.00 . B B . 27 THR HA 1 1 17 13288 2 2 27 THR HB H -9.220 -8.614 -3.462 1.00 . B B . 27 THR HB 1 1 17 13289 2 2 27 THR HG1 H -8.361 -6.059 -2.581 1.00 . B B . 27 THR HG1 1 1 17 13290 2 2 27 THR HG21 H -10.105 -6.239 -1.718 1.00 . B B . 27 THR HG21 1 1 17 13291 2 2 27 THR HG22 H -10.748 -6.693 -3.285 1.00 . B B . 27 THR HG22 1 1 17 13292 2 2 27 THR HG23 H -11.050 -7.702 -1.880 1.00 . B B . 27 THR HG23 1 1 17 13293 2 2 27 THR N N -7.910 -7.239 -0.613 1.00 . B B . 27 THR N 1 1 17 13294 2 2 27 THR O O -7.171 -9.830 -2.933 1.00 . B B . 27 THR O 1 1 17 13295 2 2 27 THR OG1 O -8.205 -6.832 -3.144 1.00 . B B . 27 THR OG1 1 1 17 13296 2 2 28 PRO C C -4.410 -10.059 -2.409 1.00 . B B . 28 PRO C 1 1 17 13297 2 2 28 PRO CA C -5.066 -10.167 -0.997 1.00 . B B . 28 PRO CA 1 1 17 13298 2 2 28 PRO CB C -5.034 -11.590 -0.428 1.00 . B B . 28 PRO CB 1 1 17 13299 2 2 28 PRO CD C -7.184 -10.723 0.145 1.00 . B B . 28 PRO CD 1 1 17 13300 2 2 28 PRO CG C -5.996 -11.467 0.763 1.00 . B B . 28 PRO CG 1 1 17 13301 2 2 28 PRO HA H -4.465 -9.544 -0.353 1.00 . B B . 28 PRO HA 1 1 17 13302 2 2 28 PRO HB2 H -5.384 -12.295 -1.172 1.00 . B B . 28 PRO HB2 1 1 17 13303 2 2 28 PRO HB3 H -4.029 -11.858 -0.129 1.00 . B B . 28 PRO HB3 1 1 17 13304 2 2 28 PRO HD2 H -7.833 -11.406 -0.391 1.00 . B B . 28 PRO HD2 1 1 17 13305 2 2 28 PRO HD3 H -7.746 -10.181 0.894 1.00 . B B . 28 PRO HD3 1 1 17 13306 2 2 28 PRO HG2 H -6.288 -12.441 1.130 1.00 . B B . 28 PRO HG2 1 1 17 13307 2 2 28 PRO HG3 H -5.563 -10.891 1.569 1.00 . B B . 28 PRO HG3 1 1 17 13308 2 2 28 PRO N N -6.513 -9.774 -0.803 1.00 . B B . 28 PRO N 1 1 17 13309 2 2 28 PRO O O -3.617 -10.884 -2.815 1.00 . B B . 28 PRO O 1 1 17 13310 2 2 29 LYS C C -3.371 -7.466 -4.546 1.00 . B B . 29 LYS C 1 1 17 13311 2 2 29 LYS CA C -4.212 -8.766 -4.489 1.00 . B B . 29 LYS CA 1 1 17 13312 2 2 29 LYS CB C -5.446 -8.707 -5.432 1.00 . B B . 29 LYS CB 1 1 17 13313 2 2 29 LYS CD C -6.049 -6.965 -7.217 1.00 . B B . 29 LYS CD 1 1 17 13314 2 2 29 LYS CE C -6.046 -5.801 -6.206 1.00 . B B . 29 LYS CE 1 1 17 13315 2 2 29 LYS CG C -5.079 -8.138 -6.847 1.00 . B B . 29 LYS CG 1 1 17 13316 2 2 29 LYS H H -5.405 -8.400 -2.735 1.00 . B B . 29 LYS H 1 1 17 13317 2 2 29 LYS HA H -3.574 -9.592 -4.777 1.00 . B B . 29 LYS HA 1 1 17 13318 2 2 29 LYS HB2 H -5.802 -9.725 -5.537 1.00 . B B . 29 LYS HB2 1 1 17 13319 2 2 29 LYS HB3 H -6.252 -8.164 -4.954 1.00 . B B . 29 LYS HB3 1 1 17 13320 2 2 29 LYS HD2 H -5.779 -6.576 -8.188 1.00 . B B . 29 LYS HD2 1 1 17 13321 2 2 29 LYS HD3 H -7.062 -7.340 -7.284 1.00 . B B . 29 LYS HD3 1 1 17 13322 2 2 29 LYS HE2 H -6.752 -5.044 -6.535 1.00 . B B . 29 LYS HE2 1 1 17 13323 2 2 29 LYS HE3 H -6.363 -6.134 -5.222 1.00 . B B . 29 LYS HE3 1 1 17 13324 2 2 29 LYS HG2 H -4.048 -7.818 -6.938 1.00 . B B . 29 LYS HG2 1 1 17 13325 2 2 29 LYS HG3 H -5.221 -8.930 -7.574 1.00 . B B . 29 LYS HG3 1 1 17 13326 2 2 29 LYS HZ1 H -3.960 -5.666 -6.734 1.00 . B B . 29 LYS HZ1 1 1 17 13327 2 2 29 LYS HZ2 H -4.672 -4.213 -6.409 1.00 . B B . 29 LYS HZ2 1 1 17 13328 2 2 29 LYS HZ3 H -4.294 -5.237 -5.171 1.00 . B B . 29 LYS HZ3 1 1 17 13329 2 2 29 LYS N N -4.756 -9.021 -3.116 1.00 . B B . 29 LYS N 1 1 17 13330 2 2 29 LYS NZ N -4.681 -5.217 -6.138 1.00 . B B . 29 LYS NZ 1 1 17 13331 2 2 29 LYS O O -3.728 -6.471 -3.947 1.00 . B B . 29 LYS O 1 1 17 13332 2 2 30 THR C C -1.602 -5.012 -4.853 1.00 . B B . 30 THR C 1 1 17 13333 2 2 30 THR CA C -1.308 -6.393 -5.489 1.00 . B B . 30 THR CA 1 1 17 13334 2 2 30 THR CB C -1.118 -6.174 -7.018 1.00 . B B . 30 THR CB 1 1 17 13335 2 2 30 THR CG2 C -0.822 -7.464 -7.746 1.00 . B B . 30 THR CG2 1 1 17 13336 2 2 30 THR H H -2.114 -8.390 -5.710 1.00 . B B . 30 THR H 1 1 17 13337 2 2 30 THR HA H -0.357 -6.706 -5.088 1.00 . B B . 30 THR HA 1 1 17 13338 2 2 30 THR HB H -0.442 -5.362 -7.279 1.00 . B B . 30 THR HB 1 1 17 13339 2 2 30 THR HG1 H -2.393 -5.085 -7.963 1.00 . B B . 30 THR HG1 1 1 17 13340 2 2 30 THR HG21 H 0.080 -7.915 -7.359 1.00 . B B . 30 THR HG21 1 1 17 13341 2 2 30 THR HG22 H -1.639 -8.162 -7.652 1.00 . B B . 30 THR HG22 1 1 17 13342 2 2 30 THR HG23 H -0.683 -7.249 -8.794 1.00 . B B . 30 THR HG23 1 1 17 13343 2 2 30 THR N N -2.294 -7.536 -5.274 1.00 . B B . 30 THR N 1 1 17 13344 2 2 30 THR O O -2.583 -4.336 -5.129 1.00 . B B . 30 THR O 1 1 17 13345 2 2 30 THR OG1 O -2.425 -5.955 -7.525 1.00 . B B . 30 THR OG1 1 1 18 13346 1 1 1 GLY C C 0.835 -4.272 -3.213 1.00 . A A . 1 GLY C 1 1 18 13347 1 1 1 GLY CA C -0.149 -4.888 -4.218 1.00 . A A . 1 GLY CA 1 1 18 13348 1 1 1 GLY HA2 H 0.241 -5.854 -4.498 1.00 . A A . 1 GLY HA2 1 1 18 13349 1 1 1 GLY HA3 H -0.149 -4.257 -5.092 1.00 . A A . 1 GLY HA3 1 1 18 13350 1 1 1 GLY N N -1.562 -5.041 -3.718 1.00 . A A . 1 GLY N 1 1 18 13351 1 1 1 GLY O O 1.562 -3.357 -3.551 1.00 . A A . 1 GLY O 1 1 18 13352 1 1 2 ILE C C 2.538 -5.299 -0.139 1.00 . A A . 2 ILE C 1 1 18 13353 1 1 2 ILE CA C 1.754 -4.274 -0.926 1.00 . A A . 2 ILE CA 1 1 18 13354 1 1 2 ILE CB C 1.029 -3.441 0.194 1.00 . A A . 2 ILE CB 1 1 18 13355 1 1 2 ILE CD1 C -1.043 -2.827 1.545 1.00 . A A . 2 ILE CD1 1 1 18 13356 1 1 2 ILE CG1 C -0.501 -3.642 0.309 1.00 . A A . 2 ILE CG1 1 1 18 13357 1 1 2 ILE CG2 C 1.490 -2.002 0.050 1.00 . A A . 2 ILE CG2 1 1 18 13358 1 1 2 ILE H H 0.207 -5.516 -1.875 1.00 . A A . 2 ILE H 1 1 18 13359 1 1 2 ILE HA H 2.502 -3.653 -1.398 1.00 . A A . 2 ILE HA 1 1 18 13360 1 1 2 ILE HB H 1.404 -3.757 1.159 1.00 . A A . 2 ILE HB 1 1 18 13361 1 1 2 ILE HD11 H -0.595 -3.124 2.482 1.00 . A A . 2 ILE HD11 1 1 18 13362 1 1 2 ILE HD12 H -0.843 -1.771 1.431 1.00 . A A . 2 ILE HD12 1 1 18 13363 1 1 2 ILE HD13 H -2.115 -2.928 1.642 1.00 . A A . 2 ILE HD13 1 1 18 13364 1 1 2 ILE HG12 H -0.988 -3.324 -0.600 1.00 . A A . 2 ILE HG12 1 1 18 13365 1 1 2 ILE HG13 H -0.725 -4.691 0.445 1.00 . A A . 2 ILE HG13 1 1 18 13366 1 1 2 ILE HG21 H 1.303 -1.680 -0.951 1.00 . A A . 2 ILE HG21 1 1 18 13367 1 1 2 ILE HG22 H 0.988 -1.349 0.743 1.00 . A A . 2 ILE HG22 1 1 18 13368 1 1 2 ILE HG23 H 2.552 -1.925 0.227 1.00 . A A . 2 ILE HG23 1 1 18 13369 1 1 2 ILE N N 0.832 -4.781 -2.015 1.00 . A A . 2 ILE N 1 1 18 13370 1 1 2 ILE O O 3.750 -5.279 -0.113 1.00 . A A . 2 ILE O 1 1 18 13371 1 1 3 VAL C C 3.692 -7.925 0.586 1.00 . A A . 3 VAL C 1 1 18 13372 1 1 3 VAL CA C 2.564 -7.215 1.314 1.00 . A A . 3 VAL CA 1 1 18 13373 1 1 3 VAL CB C 1.487 -8.227 1.869 1.00 . A A . 3 VAL CB 1 1 18 13374 1 1 3 VAL CG1 C 0.533 -7.466 2.808 1.00 . A A . 3 VAL CG1 1 1 18 13375 1 1 3 VAL CG2 C 0.618 -8.801 0.741 1.00 . A A . 3 VAL CG2 1 1 18 13376 1 1 3 VAL H H 0.872 -6.166 0.437 1.00 . A A . 3 VAL H 1 1 18 13377 1 1 3 VAL HA H 3.114 -6.635 2.026 1.00 . A A . 3 VAL HA 1 1 18 13378 1 1 3 VAL HB H 2.001 -9.019 2.400 1.00 . A A . 3 VAL HB 1 1 18 13379 1 1 3 VAL HG11 H 1.088 -7.030 3.628 1.00 . A A . 3 VAL HG11 1 1 18 13380 1 1 3 VAL HG12 H 0.031 -6.666 2.281 1.00 . A A . 3 VAL HG12 1 1 18 13381 1 1 3 VAL HG13 H -0.219 -8.123 3.216 1.00 . A A . 3 VAL HG13 1 1 18 13382 1 1 3 VAL HG21 H 1.249 -9.301 0.023 1.00 . A A . 3 VAL HG21 1 1 18 13383 1 1 3 VAL HG22 H -0.104 -9.504 1.115 1.00 . A A . 3 VAL HG22 1 1 18 13384 1 1 3 VAL HG23 H 0.087 -8.015 0.223 1.00 . A A . 3 VAL HG23 1 1 18 13385 1 1 3 VAL N N 1.844 -6.185 0.506 1.00 . A A . 3 VAL N 1 1 18 13386 1 1 3 VAL O O 4.607 -8.444 1.190 1.00 . A A . 3 VAL O 1 1 18 13387 1 1 4 GLU C C 5.378 -7.413 -2.238 1.00 . A A . 4 GLU C 1 1 18 13388 1 1 4 GLU CA C 4.596 -8.543 -1.566 1.00 . A A . 4 GLU CA 1 1 18 13389 1 1 4 GLU CB C 3.864 -9.466 -2.622 1.00 . A A . 4 GLU CB 1 1 18 13390 1 1 4 GLU CD C 1.733 -7.869 -2.846 1.00 . A A . 4 GLU CD 1 1 18 13391 1 1 4 GLU CG C 2.272 -9.285 -2.698 1.00 . A A . 4 GLU CG 1 1 18 13392 1 1 4 GLU H H 2.787 -7.481 -1.082 1.00 . A A . 4 GLU H 1 1 18 13393 1 1 4 GLU HA H 5.324 -9.024 -0.940 1.00 . A A . 4 GLU HA 1 1 18 13394 1 1 4 GLU HB2 H 4.279 -9.295 -3.607 1.00 . A A . 4 GLU HB2 1 1 18 13395 1 1 4 GLU HB3 H 4.083 -10.492 -2.361 1.00 . A A . 4 GLU HB3 1 1 18 13396 1 1 4 GLU HG2 H 1.917 -9.818 -3.564 1.00 . A A . 4 GLU HG2 1 1 18 13397 1 1 4 GLU HG3 H 1.812 -9.729 -1.836 1.00 . A A . 4 GLU HG3 1 1 18 13398 1 1 4 GLU N N 3.575 -7.913 -0.697 1.00 . A A . 4 GLU N 1 1 18 13399 1 1 4 GLU O O 6.469 -7.079 -1.815 1.00 . A A . 4 GLU O 1 1 18 13400 1 1 4 GLU OE1 O 2.081 -7.235 -3.810 1.00 . A A . 4 GLU OE1 1 1 18 13401 1 1 4 GLU OE2 O 0.977 -7.486 -1.974 1.00 . A A . 4 GLU OE2 1 1 18 13402 1 1 5 GLN C C 6.085 -4.623 -3.064 1.00 . A A . 5 GLN C 1 1 18 13403 1 1 5 GLN CA C 5.481 -5.726 -3.982 1.00 . A A . 5 GLN CA 1 1 18 13404 1 1 5 GLN CB C 4.421 -5.171 -4.972 1.00 . A A . 5 GLN CB 1 1 18 13405 1 1 5 GLN CD C 6.103 -5.085 -6.967 1.00 . A A . 5 GLN CD 1 1 18 13406 1 1 5 GLN CG C 5.131 -4.300 -6.098 1.00 . A A . 5 GLN CG 1 1 18 13407 1 1 5 GLN H H 3.929 -7.159 -3.524 1.00 . A A . 5 GLN H 1 1 18 13408 1 1 5 GLN HA H 6.315 -6.131 -4.536 1.00 . A A . 5 GLN HA 1 1 18 13409 1 1 5 GLN HB2 H 3.897 -6.010 -5.417 1.00 . A A . 5 GLN HB2 1 1 18 13410 1 1 5 GLN HB3 H 3.687 -4.592 -4.426 1.00 . A A . 5 GLN HB3 1 1 18 13411 1 1 5 GLN HE21 H 4.921 -5.150 -8.541 1.00 . A A . 5 GLN HE21 1 1 18 13412 1 1 5 GLN HE22 H 6.450 -5.900 -8.675 1.00 . A A . 5 GLN HE22 1 1 18 13413 1 1 5 GLN HG2 H 4.403 -3.842 -6.745 1.00 . A A . 5 GLN HG2 1 1 18 13414 1 1 5 GLN HG3 H 5.740 -3.528 -5.656 1.00 . A A . 5 GLN HG3 1 1 18 13415 1 1 5 GLN N N 4.813 -6.838 -3.250 1.00 . A A . 5 GLN N 1 1 18 13416 1 1 5 GLN NE2 N 5.783 -5.401 -8.168 1.00 . A A . 5 GLN NE2 1 1 18 13417 1 1 5 GLN O O 6.916 -3.892 -3.548 1.00 . A A . 5 GLN O 1 1 18 13418 1 1 5 GLN OE1 O 7.192 -5.439 -6.588 1.00 . A A . 5 GLN OE1 1 1 18 13419 1 1 6 CYS C C 7.071 -3.971 0.228 1.00 . A A . 6 CYS C 1 1 18 13420 1 1 6 CYS CA C 6.347 -3.385 -0.977 1.00 . A A . 6 CYS CA 1 1 18 13421 1 1 6 CYS CB C 5.281 -2.402 -0.441 1.00 . A A . 6 CYS CB 1 1 18 13422 1 1 6 CYS H H 5.026 -5.068 -1.388 1.00 . A A . 6 CYS H 1 1 18 13423 1 1 6 CYS HA H 7.093 -2.845 -1.544 1.00 . A A . 6 CYS HA 1 1 18 13424 1 1 6 CYS HB2 H 4.528 -2.969 0.085 1.00 . A A . 6 CYS HB2 1 1 18 13425 1 1 6 CYS HB3 H 5.760 -1.765 0.292 1.00 . A A . 6 CYS HB3 1 1 18 13426 1 1 6 CYS HG H 4.965 -0.516 -1.715 1.00 . A A . 6 CYS HG 1 1 18 13427 1 1 6 CYS N N 5.709 -4.479 -1.812 1.00 . A A . 6 CYS N 1 1 18 13428 1 1 6 CYS O O 8.170 -3.621 0.596 1.00 . A A . 6 CYS O 1 1 18 13429 1 1 6 CYS SG S 4.427 -1.303 -1.589 1.00 . A A . 6 CYS SG 1 1 18 13430 1 1 7 CYS C C 7.615 -6.952 1.693 1.00 . A A . 7 CYS C 1 1 18 13431 1 1 7 CYS CA C 6.927 -5.594 2.014 1.00 . A A . 7 CYS CA 1 1 18 13432 1 1 7 CYS CB C 5.636 -5.582 2.852 1.00 . A A . 7 CYS CB 1 1 18 13433 1 1 7 CYS H H 5.538 -5.177 0.429 1.00 . A A . 7 CYS H 1 1 18 13434 1 1 7 CYS HA H 7.668 -4.971 2.499 1.00 . A A . 7 CYS HA 1 1 18 13435 1 1 7 CYS HB2 H 5.461 -4.537 3.106 1.00 . A A . 7 CYS HB2 1 1 18 13436 1 1 7 CYS HB3 H 4.808 -5.804 2.198 1.00 . A A . 7 CYS HB3 1 1 18 13437 1 1 7 CYS HG H 5.367 -7.482 4.105 1.00 . A A . 7 CYS HG 1 1 18 13438 1 1 7 CYS N N 6.404 -4.910 0.807 1.00 . A A . 7 CYS N 1 1 18 13439 1 1 7 CYS O O 7.670 -7.883 2.468 1.00 . A A . 7 CYS O 1 1 18 13440 1 1 7 CYS SG S 5.555 -6.576 4.365 1.00 . A A . 7 CYS SG 1 1 18 13441 1 1 8 THR C C 9.173 -7.686 -1.667 1.00 . A A . 8 THR C 1 1 18 13442 1 1 8 THR CA C 8.896 -8.081 -0.185 1.00 . A A . 8 THR CA 1 1 18 13443 1 1 8 THR CB C 8.021 -9.379 -0.032 1.00 . A A . 8 THR CB 1 1 18 13444 1 1 8 THR CG2 C 8.249 -10.523 -0.993 1.00 . A A . 8 THR CG2 1 1 18 13445 1 1 8 THR H H 7.985 -6.123 -0.006 1.00 . A A . 8 THR H 1 1 18 13446 1 1 8 THR HA H 9.844 -8.233 0.305 1.00 . A A . 8 THR HA 1 1 18 13447 1 1 8 THR HB H 6.979 -9.155 0.151 1.00 . A A . 8 THR HB 1 1 18 13448 1 1 8 THR HG1 H 8.138 -9.560 1.866 1.00 . A A . 8 THR HG1 1 1 18 13449 1 1 8 THR HG21 H 9.278 -10.839 -0.951 1.00 . A A . 8 THR HG21 1 1 18 13450 1 1 8 THR HG22 H 7.623 -11.346 -0.690 1.00 . A A . 8 THR HG22 1 1 18 13451 1 1 8 THR HG23 H 7.991 -10.254 -2.005 1.00 . A A . 8 THR HG23 1 1 18 13452 1 1 8 THR N N 8.134 -6.950 0.492 1.00 . A A . 8 THR N 1 1 18 13453 1 1 8 THR O O 8.972 -8.410 -2.617 1.00 . A A . 8 THR O 1 1 18 13454 1 1 8 THR OG1 O 8.584 -9.983 1.117 1.00 . A A . 8 THR OG1 1 1 18 13455 1 1 9 SER C C 9.627 -4.252 -2.919 1.00 . A A . 9 SER C 1 1 18 13456 1 1 9 SER CA C 10.061 -5.742 -3.073 1.00 . A A . 9 SER CA 1 1 18 13457 1 1 9 SER CB C 9.344 -6.381 -4.306 1.00 . A A . 9 SER CB 1 1 18 13458 1 1 9 SER H H 9.800 -5.983 -0.948 1.00 . A A . 9 SER H 1 1 18 13459 1 1 9 SER HA H 11.130 -5.764 -3.211 1.00 . A A . 9 SER HA 1 1 18 13460 1 1 9 SER HB2 H 9.669 -7.402 -4.456 1.00 . A A . 9 SER HB2 1 1 18 13461 1 1 9 SER HB3 H 8.272 -6.363 -4.170 1.00 . A A . 9 SER HB3 1 1 18 13462 1 1 9 SER HG H 8.915 -5.497 -5.957 1.00 . A A . 9 SER HG 1 1 18 13463 1 1 9 SER N N 9.671 -6.475 -1.785 1.00 . A A . 9 SER N 1 1 18 13464 1 1 9 SER O O 9.443 -3.836 -1.791 1.00 . A A . 9 SER O 1 1 18 13465 1 1 9 SER OG O 9.735 -5.617 -5.446 1.00 . A A . 9 SER OG 1 1 18 13466 1 1 10 ILE C C 7.919 -1.647 -4.823 1.00 . A A . 10 ILE C 1 1 18 13467 1 1 10 ILE CA C 9.068 -2.044 -3.872 1.00 . A A . 10 ILE CA 1 1 18 13468 1 1 10 ILE CB C 10.315 -1.118 -4.135 1.00 . A A . 10 ILE CB 1 1 18 13469 1 1 10 ILE CD1 C 9.512 1.000 -5.501 1.00 . A A . 10 ILE CD1 1 1 18 13470 1 1 10 ILE CG1 C 9.924 0.418 -4.121 1.00 . A A . 10 ILE CG1 1 1 18 13471 1 1 10 ILE CG2 C 11.010 -1.485 -5.448 1.00 . A A . 10 ILE CG2 1 1 18 13472 1 1 10 ILE H H 9.645 -3.880 -4.833 1.00 . A A . 10 ILE H 1 1 18 13473 1 1 10 ILE HA H 8.768 -1.836 -2.855 1.00 . A A . 10 ILE HA 1 1 18 13474 1 1 10 ILE HB H 11.008 -1.297 -3.324 1.00 . A A . 10 ILE HB 1 1 18 13475 1 1 10 ILE HD11 H 8.657 0.487 -5.910 1.00 . A A . 10 ILE HD11 1 1 18 13476 1 1 10 ILE HD12 H 9.268 2.047 -5.404 1.00 . A A . 10 ILE HD12 1 1 18 13477 1 1 10 ILE HD13 H 10.329 0.903 -6.202 1.00 . A A . 10 ILE HD13 1 1 18 13478 1 1 10 ILE HG12 H 9.081 0.552 -3.451 1.00 . A A . 10 ILE HG12 1 1 18 13479 1 1 10 ILE HG13 H 10.754 0.989 -3.733 1.00 . A A . 10 ILE HG13 1 1 18 13480 1 1 10 ILE HG21 H 10.320 -1.387 -6.274 1.00 . A A . 10 ILE HG21 1 1 18 13481 1 1 10 ILE HG22 H 11.852 -0.831 -5.613 1.00 . A A . 10 ILE HG22 1 1 18 13482 1 1 10 ILE HG23 H 11.353 -2.506 -5.406 1.00 . A A . 10 ILE HG23 1 1 18 13483 1 1 10 ILE N N 9.484 -3.487 -3.964 1.00 . A A . 10 ILE N 1 1 18 13484 1 1 10 ILE O O 7.976 -1.683 -6.038 1.00 . A A . 10 ILE O 1 1 18 13485 1 1 11 CYS C C 5.469 0.638 -4.384 1.00 . A A . 11 CYS C 1 1 18 13486 1 1 11 CYS CA C 5.627 -0.815 -4.883 1.00 . A A . 11 CYS CA 1 1 18 13487 1 1 11 CYS CB C 4.480 -1.754 -4.442 1.00 . A A . 11 CYS CB 1 1 18 13488 1 1 11 CYS H H 6.899 -1.271 -3.242 1.00 . A A . 11 CYS H 1 1 18 13489 1 1 11 CYS HA H 5.790 -0.819 -5.949 1.00 . A A . 11 CYS HA 1 1 18 13490 1 1 11 CYS HB2 H 3.924 -2.090 -5.302 1.00 . A A . 11 CYS HB2 1 1 18 13491 1 1 11 CYS HB3 H 4.936 -2.628 -4.009 1.00 . A A . 11 CYS HB3 1 1 18 13492 1 1 11 CYS HG H 2.490 -0.940 -3.637 1.00 . A A . 11 CYS HG 1 1 18 13493 1 1 11 CYS N N 6.858 -1.258 -4.201 1.00 . A A . 11 CYS N 1 1 18 13494 1 1 11 CYS O O 5.676 0.969 -3.237 1.00 . A A . 11 CYS O 1 1 18 13495 1 1 11 CYS SG S 3.295 -1.216 -3.193 1.00 . A A . 11 CYS SG 1 1 18 13496 1 1 12 SER C C 3.480 3.514 -5.074 1.00 . A A . 12 SER C 1 1 18 13497 1 1 12 SER CA C 4.894 2.941 -5.053 1.00 . A A . 12 SER CA 1 1 18 13498 1 1 12 SER CB C 5.889 3.581 -6.064 1.00 . A A . 12 SER CB 1 1 18 13499 1 1 12 SER H H 4.995 1.009 -6.151 1.00 . A A . 12 SER H 1 1 18 13500 1 1 12 SER HA H 5.160 3.172 -4.063 1.00 . A A . 12 SER HA 1 1 18 13501 1 1 12 SER HB2 H 6.899 3.373 -5.725 1.00 . A A . 12 SER HB2 1 1 18 13502 1 1 12 SER HB3 H 5.766 3.108 -7.022 1.00 . A A . 12 SER HB3 1 1 18 13503 1 1 12 SER HG H 6.151 5.189 -7.013 1.00 . A A . 12 SER HG 1 1 18 13504 1 1 12 SER N N 5.105 1.459 -5.304 1.00 . A A . 12 SER N 1 1 18 13505 1 1 12 SER O O 2.548 2.756 -4.932 1.00 . A A . 12 SER O 1 1 18 13506 1 1 12 SER OG O 5.716 4.994 -6.161 1.00 . A A . 12 SER OG 1 1 18 13507 1 1 13 LEU C C 1.034 4.571 -6.167 1.00 . A A . 13 LEU C 1 1 18 13508 1 1 13 LEU CA C 1.926 5.399 -5.249 1.00 . A A . 13 LEU CA 1 1 18 13509 1 1 13 LEU CB C 2.070 6.870 -5.724 1.00 . A A . 13 LEU CB 1 1 18 13510 1 1 13 LEU CD1 C -0.068 7.520 -4.538 1.00 . A A . 13 LEU CD1 1 1 18 13511 1 1 13 LEU CD2 C 0.888 8.986 -6.265 1.00 . A A . 13 LEU CD2 1 1 18 13512 1 1 13 LEU CG C 0.680 7.530 -5.874 1.00 . A A . 13 LEU CG 1 1 18 13513 1 1 13 LEU H H 4.102 5.326 -5.368 1.00 . A A . 13 LEU H 1 1 18 13514 1 1 13 LEU HA H 1.508 5.341 -4.254 1.00 . A A . 13 LEU HA 1 1 18 13515 1 1 13 LEU HB2 H 2.653 7.419 -4.999 1.00 . A A . 13 LEU HB2 1 1 18 13516 1 1 13 LEU HB3 H 2.585 6.907 -6.673 1.00 . A A . 13 LEU HB3 1 1 18 13517 1 1 13 LEU HD11 H 0.490 8.038 -3.772 1.00 . A A . 13 LEU HD11 1 1 18 13518 1 1 13 LEU HD12 H -1.027 8.001 -4.664 1.00 . A A . 13 LEU HD12 1 1 18 13519 1 1 13 LEU HD13 H -0.254 6.505 -4.221 1.00 . A A . 13 LEU HD13 1 1 18 13520 1 1 13 LEU HD21 H 1.448 9.515 -5.509 1.00 . A A . 13 LEU HD21 1 1 18 13521 1 1 13 LEU HD22 H 1.414 9.046 -7.206 1.00 . A A . 13 LEU HD22 1 1 18 13522 1 1 13 LEU HD23 H -0.075 9.459 -6.386 1.00 . A A . 13 LEU HD23 1 1 18 13523 1 1 13 LEU HG H 0.083 7.027 -6.634 1.00 . A A . 13 LEU HG 1 1 18 13524 1 1 13 LEU N N 3.302 4.794 -5.235 1.00 . A A . 13 LEU N 1 1 18 13525 1 1 13 LEU O O 0.048 3.992 -5.760 1.00 . A A . 13 LEU O 1 1 18 13526 1 1 14 TYR C C 0.480 2.323 -7.996 1.00 . A A . 14 TYR C 1 1 18 13527 1 1 14 TYR CA C 0.752 3.762 -8.454 1.00 . A A . 14 TYR CA 1 1 18 13528 1 1 14 TYR CB C 1.575 3.797 -9.803 1.00 . A A . 14 TYR CB 1 1 18 13529 1 1 14 TYR CD1 C 3.408 5.377 -9.303 1.00 . A A . 14 TYR CD1 1 1 18 13530 1 1 14 TYR CD2 C 3.977 3.080 -9.565 1.00 . A A . 14 TYR CD2 1 1 18 13531 1 1 14 TYR CE1 C 4.718 5.679 -9.045 1.00 . A A . 14 TYR CE1 1 1 18 13532 1 1 14 TYR CE2 C 5.293 3.390 -9.307 1.00 . A A . 14 TYR CE2 1 1 18 13533 1 1 14 TYR CG C 3.038 4.079 -9.560 1.00 . A A . 14 TYR CG 1 1 18 13534 1 1 14 TYR CZ C 5.657 4.690 -9.045 1.00 . A A . 14 TYR CZ 1 1 18 13535 1 1 14 TYR H H 2.325 5.020 -7.520 1.00 . A A . 14 TYR H 1 1 18 13536 1 1 14 TYR HA H -0.200 4.221 -8.635 1.00 . A A . 14 TYR HA 1 1 18 13537 1 1 14 TYR HB2 H 1.467 2.858 -10.329 1.00 . A A . 14 TYR HB2 1 1 18 13538 1 1 14 TYR HB3 H 1.162 4.574 -10.430 1.00 . A A . 14 TYR HB3 1 1 18 13539 1 1 14 TYR HD1 H 2.652 6.153 -9.310 1.00 . A A . 14 TYR HD1 1 1 18 13540 1 1 14 TYR HD2 H 3.680 2.059 -9.777 1.00 . A A . 14 TYR HD2 1 1 18 13541 1 1 14 TYR HE1 H 5.009 6.696 -8.838 1.00 . A A . 14 TYR HE1 1 1 18 13542 1 1 14 TYR HE2 H 6.041 2.612 -9.311 1.00 . A A . 14 TYR HE2 1 1 18 13543 1 1 14 TYR HH H 7.334 5.385 -9.557 1.00 . A A . 14 TYR HH 1 1 18 13544 1 1 14 TYR N N 1.488 4.532 -7.384 1.00 . A A . 14 TYR N 1 1 18 13545 1 1 14 TYR O O -0.349 1.624 -8.543 1.00 . A A . 14 TYR O 1 1 18 13546 1 1 14 TYR OH O 6.953 5.022 -8.748 1.00 . A A . 14 TYR OH 1 1 18 13547 1 1 15 GLN C C -0.046 0.481 -5.348 1.00 . A A . 15 GLN C 1 1 18 13548 1 1 15 GLN CA C 0.922 0.482 -6.517 1.00 . A A . 15 GLN CA 1 1 18 13549 1 1 15 GLN CB C 2.266 -0.174 -6.146 1.00 . A A . 15 GLN CB 1 1 18 13550 1 1 15 GLN CD C 2.617 -0.946 -8.616 1.00 . A A . 15 GLN CD 1 1 18 13551 1 1 15 GLN CG C 3.190 -0.197 -7.418 1.00 . A A . 15 GLN CG 1 1 18 13552 1 1 15 GLN H H 1.874 2.437 -6.549 1.00 . A A . 15 GLN H 1 1 18 13553 1 1 15 GLN HA H 0.360 0.009 -7.268 1.00 . A A . 15 GLN HA 1 1 18 13554 1 1 15 GLN HB2 H 2.725 0.393 -5.347 1.00 . A A . 15 GLN HB2 1 1 18 13555 1 1 15 GLN HB3 H 2.076 -1.178 -5.782 1.00 . A A . 15 GLN HB3 1 1 18 13556 1 1 15 GLN HE21 H 1.028 -1.728 -7.729 1.00 . A A . 15 GLN HE21 1 1 18 13557 1 1 15 GLN HE22 H 1.238 -2.064 -9.380 1.00 . A A . 15 GLN HE22 1 1 18 13558 1 1 15 GLN HG2 H 3.378 0.808 -7.758 1.00 . A A . 15 GLN HG2 1 1 18 13559 1 1 15 GLN HG3 H 4.134 -0.666 -7.208 1.00 . A A . 15 GLN HG3 1 1 18 13560 1 1 15 GLN N N 1.187 1.873 -6.984 1.00 . A A . 15 GLN N 1 1 18 13561 1 1 15 GLN NE2 N 1.535 -1.635 -8.554 1.00 . A A . 15 GLN NE2 1 1 18 13562 1 1 15 GLN O O -0.901 -0.370 -5.226 1.00 . A A . 15 GLN O 1 1 18 13563 1 1 15 GLN OE1 O 3.187 -0.912 -9.675 1.00 . A A . 15 GLN OE1 1 1 18 13564 1 1 16 LEU C C -2.187 1.881 -3.869 1.00 . A A . 16 LEU C 1 1 18 13565 1 1 16 LEU CA C -0.792 1.528 -3.347 1.00 . A A . 16 LEU CA 1 1 18 13566 1 1 16 LEU CB C -0.232 2.612 -2.302 1.00 . A A . 16 LEU CB 1 1 18 13567 1 1 16 LEU CD1 C 1.391 2.515 -0.251 1.00 . A A . 16 LEU CD1 1 1 18 13568 1 1 16 LEU CD2 C 1.793 0.922 -2.032 1.00 . A A . 16 LEU CD2 1 1 18 13569 1 1 16 LEU CG C 1.259 2.327 -1.784 1.00 . A A . 16 LEU CG 1 1 18 13570 1 1 16 LEU H H 0.826 2.050 -4.678 1.00 . A A . 16 LEU H 1 1 18 13571 1 1 16 LEU HA H -0.905 0.538 -3.007 1.00 . A A . 16 LEU HA 1 1 18 13572 1 1 16 LEU HB2 H -0.252 3.582 -2.790 1.00 . A A . 16 LEU HB2 1 1 18 13573 1 1 16 LEU HB3 H -0.916 2.689 -1.467 1.00 . A A . 16 LEU HB3 1 1 18 13574 1 1 16 LEU HD11 H 1.156 3.523 0.036 1.00 . A A . 16 LEU HD11 1 1 18 13575 1 1 16 LEU HD12 H 0.757 1.839 0.304 1.00 . A A . 16 LEU HD12 1 1 18 13576 1 1 16 LEU HD13 H 2.408 2.301 0.057 1.00 . A A . 16 LEU HD13 1 1 18 13577 1 1 16 LEU HD21 H 1.813 0.687 -3.080 1.00 . A A . 16 LEU HD21 1 1 18 13578 1 1 16 LEU HD22 H 2.810 0.846 -1.663 1.00 . A A . 16 LEU HD22 1 1 18 13579 1 1 16 LEU HD23 H 1.233 0.168 -1.518 1.00 . A A . 16 LEU HD23 1 1 18 13580 1 1 16 LEU HG H 1.923 3.025 -2.285 1.00 . A A . 16 LEU HG 1 1 18 13581 1 1 16 LEU N N 0.107 1.438 -4.506 1.00 . A A . 16 LEU N 1 1 18 13582 1 1 16 LEU O O -3.151 1.368 -3.353 1.00 . A A . 16 LEU O 1 1 18 13583 1 1 17 GLU C C -4.310 1.738 -5.951 1.00 . A A . 17 GLU C 1 1 18 13584 1 1 17 GLU CA C -3.695 3.032 -5.368 1.00 . A A . 17 GLU CA 1 1 18 13585 1 1 17 GLU CB C -3.553 4.173 -6.408 1.00 . A A . 17 GLU CB 1 1 18 13586 1 1 17 GLU CD C -2.355 4.992 -8.486 1.00 . A A . 17 GLU CD 1 1 18 13587 1 1 17 GLU CG C -2.661 3.775 -7.617 1.00 . A A . 17 GLU CG 1 1 18 13588 1 1 17 GLU H H -1.500 3.081 -5.285 1.00 . A A . 17 GLU H 1 1 18 13589 1 1 17 GLU HA H -4.309 3.341 -4.543 1.00 . A A . 17 GLU HA 1 1 18 13590 1 1 17 GLU HB2 H -4.528 4.472 -6.771 1.00 . A A . 17 GLU HB2 1 1 18 13591 1 1 17 GLU HB3 H -3.110 5.039 -5.932 1.00 . A A . 17 GLU HB3 1 1 18 13592 1 1 17 GLU HG2 H -1.718 3.388 -7.288 1.00 . A A . 17 GLU HG2 1 1 18 13593 1 1 17 GLU HG3 H -3.146 3.049 -8.251 1.00 . A A . 17 GLU HG3 1 1 18 13594 1 1 17 GLU N N -2.309 2.703 -4.869 1.00 . A A . 17 GLU N 1 1 18 13595 1 1 17 GLU O O -5.446 1.385 -5.696 1.00 . A A . 17 GLU O 1 1 18 13596 1 1 17 GLU OE1 O -1.739 5.898 -7.950 1.00 . A A . 17 GLU OE1 1 1 18 13597 1 1 17 GLU OE2 O -2.746 4.928 -9.632 1.00 . A A . 17 GLU OE2 1 1 18 13598 1 1 18 ASN C C -4.762 -1.155 -6.411 1.00 . A A . 18 ASN C 1 1 18 13599 1 1 18 ASN CA C -3.918 -0.252 -7.377 1.00 . A A . 18 ASN CA 1 1 18 13600 1 1 18 ASN CB C -2.577 -0.904 -7.835 1.00 . A A . 18 ASN CB 1 1 18 13601 1 1 18 ASN CG C -2.707 -2.243 -8.525 1.00 . A A . 18 ASN CG 1 1 18 13602 1 1 18 ASN H H -2.619 1.422 -6.864 1.00 . A A . 18 ASN H 1 1 18 13603 1 1 18 ASN HA H -4.576 -0.020 -8.199 1.00 . A A . 18 ASN HA 1 1 18 13604 1 1 18 ASN HB2 H -2.061 -0.243 -8.514 1.00 . A A . 18 ASN HB2 1 1 18 13605 1 1 18 ASN HB3 H -1.945 -1.076 -6.988 1.00 . A A . 18 ASN HB3 1 1 18 13606 1 1 18 ASN HD21 H -4.674 -2.429 -8.398 1.00 . A A . 18 ASN HD21 1 1 18 13607 1 1 18 ASN HD22 H -3.813 -3.682 -9.170 1.00 . A A . 18 ASN HD22 1 1 18 13608 1 1 18 ASN N N -3.515 1.048 -6.724 1.00 . A A . 18 ASN N 1 1 18 13609 1 1 18 ASN ND2 N -3.836 -2.825 -8.708 1.00 . A A . 18 ASN ND2 1 1 18 13610 1 1 18 ASN O O -5.685 -1.815 -6.850 1.00 . A A . 18 ASN O 1 1 18 13611 1 1 18 ASN OD1 O -1.731 -2.824 -8.932 1.00 . A A . 18 ASN OD1 1 1 18 13612 1 1 19 TYR C C -5.964 -1.052 -3.139 1.00 . A A . 19 TYR C 1 1 18 13613 1 1 19 TYR CA C -5.158 -1.983 -4.116 1.00 . A A . 19 TYR CA 1 1 18 13614 1 1 19 TYR CB C -4.078 -2.863 -3.390 1.00 . A A . 19 TYR CB 1 1 18 13615 1 1 19 TYR CD1 C -3.650 -1.536 -1.308 1.00 . A A . 19 TYR CD1 1 1 18 13616 1 1 19 TYR CD2 C -1.862 -1.999 -2.794 1.00 . A A . 19 TYR CD2 1 1 18 13617 1 1 19 TYR CE1 C -2.789 -0.842 -0.496 1.00 . A A . 19 TYR CE1 1 1 18 13618 1 1 19 TYR CE2 C -1.018 -1.312 -1.982 1.00 . A A . 19 TYR CE2 1 1 18 13619 1 1 19 TYR CG C -3.179 -2.111 -2.462 1.00 . A A . 19 TYR CG 1 1 18 13620 1 1 19 TYR CZ C -1.475 -0.726 -0.832 1.00 . A A . 19 TYR CZ 1 1 18 13621 1 1 19 TYR H H -3.646 -0.607 -4.897 1.00 . A A . 19 TYR H 1 1 18 13622 1 1 19 TYR HA H -5.882 -2.620 -4.608 1.00 . A A . 19 TYR HA 1 1 18 13623 1 1 19 TYR HB2 H -4.508 -3.649 -2.805 1.00 . A A . 19 TYR HB2 1 1 18 13624 1 1 19 TYR HB3 H -3.422 -3.280 -4.141 1.00 . A A . 19 TYR HB3 1 1 18 13625 1 1 19 TYR HD1 H -4.692 -1.637 -1.042 1.00 . A A . 19 TYR HD1 1 1 18 13626 1 1 19 TYR HD2 H -1.486 -2.453 -3.701 1.00 . A A . 19 TYR HD2 1 1 18 13627 1 1 19 TYR HE1 H -3.139 -0.388 0.414 1.00 . A A . 19 TYR HE1 1 1 18 13628 1 1 19 TYR HE2 H 0.014 -1.245 -2.271 1.00 . A A . 19 TYR HE2 1 1 18 13629 1 1 19 TYR HH H -0.187 0.610 -0.637 1.00 . A A . 19 TYR HH 1 1 18 13630 1 1 19 TYR N N -4.416 -1.158 -5.148 1.00 . A A . 19 TYR N 1 1 18 13631 1 1 19 TYR O O -6.949 -1.417 -2.526 1.00 . A A . 19 TYR O 1 1 18 13632 1 1 19 TYR OH O -0.640 0.010 -0.034 1.00 . A A . 19 TYR OH 1 1 18 13633 1 1 20 CYS C C -6.632 2.249 -3.187 1.00 . A A . 20 CYS C 1 1 18 13634 1 1 20 CYS CA C -6.116 1.219 -2.139 1.00 . A A . 20 CYS CA 1 1 18 13635 1 1 20 CYS CB C -4.987 1.748 -1.216 1.00 . A A . 20 CYS CB 1 1 18 13636 1 1 20 CYS H H -4.689 0.378 -3.493 1.00 . A A . 20 CYS H 1 1 18 13637 1 1 20 CYS HA H -6.959 0.890 -1.559 1.00 . A A . 20 CYS HA 1 1 18 13638 1 1 20 CYS HB2 H -4.317 0.948 -0.960 1.00 . A A . 20 CYS HB2 1 1 18 13639 1 1 20 CYS HB3 H -4.403 2.456 -1.784 1.00 . A A . 20 CYS HB3 1 1 18 13640 1 1 20 CYS HG H -5.437 3.516 0.199 1.00 . A A . 20 CYS HG 1 1 18 13641 1 1 20 CYS N N -5.504 0.153 -3.002 1.00 . A A . 20 CYS N 1 1 18 13642 1 1 20 CYS O O -6.135 3.343 -3.341 1.00 . A A . 20 CYS O 1 1 18 13643 1 1 20 CYS SG S -5.458 2.563 0.329 1.00 . A A . 20 CYS SG 1 1 18 13644 1 1 21 ASN C C -8.077 4.132 -5.114 1.00 . A A . 21 ASN C 1 1 18 13645 1 1 21 ASN CA C -8.340 2.598 -4.960 1.00 . A A . 21 ASN CA 1 1 18 13646 1 1 21 ASN CB C -9.848 2.293 -4.758 1.00 . A A . 21 ASN CB 1 1 18 13647 1 1 21 ASN CG C -10.156 2.385 -3.289 1.00 . A A . 21 ASN CG 1 1 18 13648 1 1 21 ASN H H -7.998 0.927 -3.656 1.00 . A A . 21 ASN H 1 1 18 13649 1 1 21 ASN HA H -8.029 2.174 -5.904 1.00 . A A . 21 ASN HA 1 1 18 13650 1 1 21 ASN HB2 H -10.465 3.010 -5.277 1.00 . A A . 21 ASN HB2 1 1 18 13651 1 1 21 ASN HB3 H -10.093 1.299 -5.093 1.00 . A A . 21 ASN HB3 1 1 18 13652 1 1 21 ASN HD21 H -10.511 4.305 -3.403 1.00 . A A . 21 ASN HD21 1 1 18 13653 1 1 21 ASN HD22 H -10.656 3.656 -1.873 1.00 . A A . 21 ASN HD22 1 1 18 13654 1 1 21 ASN N N -7.651 1.815 -3.876 1.00 . A A . 21 ASN N 1 1 18 13655 1 1 21 ASN ND2 N -10.465 3.520 -2.818 1.00 . A A . 21 ASN ND2 1 1 18 13656 1 1 21 ASN O O -8.399 4.680 -6.154 1.00 . A A . 21 ASN O 1 1 18 13657 1 1 21 ASN OD1 O -10.112 1.433 -2.543 1.00 . A A . 21 ASN OD1 1 1 18 13658 2 2 1 PHE C C 7.817 7.091 -2.930 1.00 . B B . 1 PHE C 1 1 18 13659 2 2 1 PHE CA C 7.116 7.905 -4.068 1.00 . B B . 1 PHE CA 1 1 18 13660 2 2 1 PHE CB C 5.572 8.037 -3.885 1.00 . B B . 1 PHE CB 1 1 18 13661 2 2 1 PHE CD1 C 5.102 10.136 -2.555 1.00 . B B . 1 PHE CD1 1 1 18 13662 2 2 1 PHE CD2 C 5.035 8.057 -1.419 1.00 . B B . 1 PHE CD2 1 1 18 13663 2 2 1 PHE CE1 C 4.797 10.790 -1.379 1.00 . B B . 1 PHE CE1 1 1 18 13664 2 2 1 PHE CE2 C 4.731 8.701 -0.240 1.00 . B B . 1 PHE CE2 1 1 18 13665 2 2 1 PHE CG C 5.223 8.765 -2.582 1.00 . B B . 1 PHE CG 1 1 18 13666 2 2 1 PHE CZ C 4.612 10.072 -0.219 1.00 . B B . 1 PHE CZ 1 1 18 13667 2 2 1 PHE HA H 7.570 8.885 -4.079 1.00 . B B . 1 PHE HA 1 1 18 13668 2 2 1 PHE HB2 H 5.152 8.588 -4.712 1.00 . B B . 1 PHE HB2 1 1 18 13669 2 2 1 PHE HB3 H 5.117 7.056 -3.867 1.00 . B B . 1 PHE HB3 1 1 18 13670 2 2 1 PHE HD1 H 5.246 10.702 -3.464 1.00 . B B . 1 PHE HD1 1 1 18 13671 2 2 1 PHE HD2 H 5.130 6.982 -1.440 1.00 . B B . 1 PHE HD2 1 1 18 13672 2 2 1 PHE HE1 H 4.704 11.869 -1.366 1.00 . B B . 1 PHE HE1 1 1 18 13673 2 2 1 PHE HE2 H 4.587 8.133 0.670 1.00 . B B . 1 PHE HE2 1 1 18 13674 2 2 1 PHE HZ H 4.375 10.583 0.704 1.00 . B B . 1 PHE HZ 1 1 18 13675 2 2 1 PHE N N 7.281 7.294 -5.426 1.00 . B B . 1 PHE N 1 1 18 13676 2 2 1 PHE O O 8.401 6.042 -3.138 1.00 . B B . 1 PHE O 1 1 18 13677 2 2 2 VAL C C 7.532 5.762 0.061 1.00 . B B . 2 VAL C 1 1 18 13678 2 2 2 VAL CA C 8.408 6.853 -0.592 1.00 . B B . 2 VAL CA 1 1 18 13679 2 2 2 VAL CB C 8.874 7.918 0.415 1.00 . B B . 2 VAL CB 1 1 18 13680 2 2 2 VAL CG1 C 7.751 8.850 0.897 1.00 . B B . 2 VAL CG1 1 1 18 13681 2 2 2 VAL CG2 C 9.520 7.266 1.654 1.00 . B B . 2 VAL CG2 1 1 18 13682 2 2 2 VAL H H 7.310 8.401 -1.531 1.00 . B B . 2 VAL H 1 1 18 13683 2 2 2 VAL HA H 9.285 6.427 -0.999 1.00 . B B . 2 VAL HA 1 1 18 13684 2 2 2 VAL HB H 9.638 8.417 -0.164 1.00 . B B . 2 VAL HB 1 1 18 13685 2 2 2 VAL HG11 H 6.975 8.277 1.382 1.00 . B B . 2 VAL HG11 1 1 18 13686 2 2 2 VAL HG12 H 8.141 9.559 1.613 1.00 . B B . 2 VAL HG12 1 1 18 13687 2 2 2 VAL HG13 H 7.314 9.404 0.081 1.00 . B B . 2 VAL HG13 1 1 18 13688 2 2 2 VAL HG21 H 10.369 6.661 1.364 1.00 . B B . 2 VAL HG21 1 1 18 13689 2 2 2 VAL HG22 H 9.862 8.026 2.342 1.00 . B B . 2 VAL HG22 1 1 18 13690 2 2 2 VAL HG23 H 8.813 6.637 2.175 1.00 . B B . 2 VAL HG23 1 1 18 13691 2 2 2 VAL N N 7.762 7.572 -1.719 1.00 . B B . 2 VAL N 1 1 18 13692 2 2 2 VAL O O 6.811 5.891 1.031 1.00 . B B . 2 VAL O 1 1 18 13693 2 2 3 ASN C C 7.854 2.141 -0.052 1.00 . B B . 3 ASN C 1 1 18 13694 2 2 3 ASN CA C 6.947 3.372 -0.254 1.00 . B B . 3 ASN CA 1 1 18 13695 2 2 3 ASN CB C 5.909 3.120 -1.375 1.00 . B B . 3 ASN CB 1 1 18 13696 2 2 3 ASN CG C 4.785 4.136 -1.383 1.00 . B B . 3 ASN CG 1 1 18 13697 2 2 3 ASN H H 8.271 4.760 -1.361 1.00 . B B . 3 ASN H 1 1 18 13698 2 2 3 ASN HA H 6.471 3.477 0.689 1.00 . B B . 3 ASN HA 1 1 18 13699 2 2 3 ASN HB2 H 6.386 3.157 -2.339 1.00 . B B . 3 ASN HB2 1 1 18 13700 2 2 3 ASN HB3 H 5.452 2.151 -1.251 1.00 . B B . 3 ASN HB3 1 1 18 13701 2 2 3 ASN HD21 H 5.238 5.008 0.334 1.00 . B B . 3 ASN HD21 1 1 18 13702 2 2 3 ASN HD22 H 3.867 5.582 -0.504 1.00 . B B . 3 ASN HD22 1 1 18 13703 2 2 3 ASN N N 7.656 4.659 -0.602 1.00 . B B . 3 ASN N 1 1 18 13704 2 2 3 ASN ND2 N 4.625 4.978 -0.428 1.00 . B B . 3 ASN ND2 1 1 18 13705 2 2 3 ASN O O 7.556 1.243 0.711 1.00 . B B . 3 ASN O 1 1 18 13706 2 2 3 ASN OD1 O 3.984 4.202 -2.283 1.00 . B B . 3 ASN OD1 1 1 18 13707 2 2 4 GLN C C 9.700 -0.135 0.014 1.00 . B B . 4 GLN C 1 1 18 13708 2 2 4 GLN CA C 10.006 1.141 -0.787 1.00 . B B . 4 GLN CA 1 1 18 13709 2 2 4 GLN CB C 11.335 1.827 -0.291 1.00 . B B . 4 GLN CB 1 1 18 13710 2 2 4 GLN CD C 10.909 3.940 -1.692 1.00 . B B . 4 GLN CD 1 1 18 13711 2 2 4 GLN CG C 11.913 2.853 -1.357 1.00 . B B . 4 GLN CG 1 1 18 13712 2 2 4 GLN H H 9.007 3.005 -1.290 1.00 . B B . 4 GLN H 1 1 18 13713 2 2 4 GLN HA H 10.155 0.805 -1.791 1.00 . B B . 4 GLN HA 1 1 18 13714 2 2 4 GLN HB2 H 11.134 2.358 0.633 1.00 . B B . 4 GLN HB2 1 1 18 13715 2 2 4 GLN HB3 H 12.076 1.061 -0.085 1.00 . B B . 4 GLN HB3 1 1 18 13716 2 2 4 GLN HE21 H 11.161 3.924 -3.649 1.00 . B B . 4 GLN HE21 1 1 18 13717 2 2 4 GLN HE22 H 9.989 4.992 -3.033 1.00 . B B . 4 GLN HE22 1 1 18 13718 2 2 4 GLN HG2 H 12.792 3.341 -0.967 1.00 . B B . 4 GLN HG2 1 1 18 13719 2 2 4 GLN HG3 H 12.176 2.344 -2.271 1.00 . B B . 4 GLN HG3 1 1 18 13720 2 2 4 GLN N N 8.935 2.195 -0.763 1.00 . B B . 4 GLN N 1 1 18 13721 2 2 4 GLN NE2 N 10.677 4.308 -2.897 1.00 . B B . 4 GLN NE2 1 1 18 13722 2 2 4 GLN O O 9.141 -1.060 -0.538 1.00 . B B . 4 GLN O 1 1 18 13723 2 2 4 GLN OE1 O 10.278 4.504 -0.837 1.00 . B B . 4 GLN OE1 1 1 18 13724 2 2 5 HIS C C 8.921 -1.203 3.365 1.00 . B B . 5 HIS C 1 1 18 13725 2 2 5 HIS CA C 9.797 -1.354 2.098 1.00 . B B . 5 HIS CA 1 1 18 13726 2 2 5 HIS CB C 11.218 -1.918 2.389 1.00 . B B . 5 HIS CB 1 1 18 13727 2 2 5 HIS CD2 C 13.218 -1.889 0.647 1.00 . B B . 5 HIS CD2 1 1 18 13728 2 2 5 HIS CE1 C 12.184 -2.541 -1.025 1.00 . B B . 5 HIS CE1 1 1 18 13729 2 2 5 HIS CG C 11.911 -2.100 1.031 1.00 . B B . 5 HIS CG 1 1 18 13730 2 2 5 HIS H H 10.518 0.646 1.610 1.00 . B B . 5 HIS H 1 1 18 13731 2 2 5 HIS HA H 9.355 -2.119 1.493 1.00 . B B . 5 HIS HA 1 1 18 13732 2 2 5 HIS HB2 H 11.795 -1.237 2.995 1.00 . B B . 5 HIS HB2 1 1 18 13733 2 2 5 HIS HB3 H 11.159 -2.877 2.882 1.00 . B B . 5 HIS HB3 1 1 18 13734 2 2 5 HIS HD1 H 10.363 -2.745 -0.128 1.00 . B B . 5 HIS HD1 1 1 18 13735 2 2 5 HIS HD2 H 14.001 -1.547 1.305 1.00 . B B . 5 HIS HD2 1 1 18 13736 2 2 5 HIS HE1 H 11.943 -2.837 -2.040 1.00 . B B . 5 HIS HE1 1 1 18 13737 2 2 5 HIS N N 10.061 -0.140 1.263 1.00 . B B . 5 HIS N 1 1 18 13738 2 2 5 HIS ND1 N 11.328 -2.503 -0.050 1.00 . B B . 5 HIS ND1 1 1 18 13739 2 2 5 HIS NE2 N 13.374 -2.166 -0.633 1.00 . B B . 5 HIS NE2 1 1 18 13740 2 2 5 HIS O O 9.276 -1.593 4.462 1.00 . B B . 5 HIS O 1 1 18 13741 2 2 6 LEU C C 5.951 -1.722 4.437 1.00 . B B . 6 LEU C 1 1 18 13742 2 2 6 LEU CA C 6.813 -0.427 4.314 1.00 . B B . 6 LEU CA 1 1 18 13743 2 2 6 LEU CB C 6.006 0.844 3.955 1.00 . B B . 6 LEU CB 1 1 18 13744 2 2 6 LEU CD1 C 6.062 3.271 3.511 1.00 . B B . 6 LEU CD1 1 1 18 13745 2 2 6 LEU CD2 C 7.395 2.393 5.357 1.00 . B B . 6 LEU CD2 1 1 18 13746 2 2 6 LEU CG C 6.915 2.077 3.936 1.00 . B B . 6 LEU CG 1 1 18 13747 2 2 6 LEU H H 7.552 -0.309 2.269 1.00 . B B . 6 LEU H 1 1 18 13748 2 2 6 LEU HA H 7.358 -0.307 5.237 1.00 . B B . 6 LEU HA 1 1 18 13749 2 2 6 LEU HB2 H 5.581 0.720 2.971 1.00 . B B . 6 LEU HB2 1 1 18 13750 2 2 6 LEU HB3 H 5.205 1.011 4.651 1.00 . B B . 6 LEU HB3 1 1 18 13751 2 2 6 LEU HD11 H 5.607 3.101 2.550 1.00 . B B . 6 LEU HD11 1 1 18 13752 2 2 6 LEU HD12 H 5.275 3.436 4.240 1.00 . B B . 6 LEU HD12 1 1 18 13753 2 2 6 LEU HD13 H 6.658 4.171 3.466 1.00 . B B . 6 LEU HD13 1 1 18 13754 2 2 6 LEU HD21 H 6.543 2.577 6.001 1.00 . B B . 6 LEU HD21 1 1 18 13755 2 2 6 LEU HD22 H 7.984 1.594 5.776 1.00 . B B . 6 LEU HD22 1 1 18 13756 2 2 6 LEU HD23 H 7.995 3.291 5.349 1.00 . B B . 6 LEU HD23 1 1 18 13757 2 2 6 LEU HG H 7.754 1.910 3.273 1.00 . B B . 6 LEU HG 1 1 18 13758 2 2 6 LEU N N 7.771 -0.626 3.171 1.00 . B B . 6 LEU N 1 1 18 13759 2 2 6 LEU O O 5.635 -2.333 3.435 1.00 . B B . 6 LEU O 1 1 18 13760 2 2 7 CYS C C 3.424 -3.382 6.630 1.00 . B B . 7 CYS C 1 1 18 13761 2 2 7 CYS CA C 4.753 -3.376 5.811 1.00 . B B . 7 CYS CA 1 1 18 13762 2 2 7 CYS CB C 5.740 -4.414 6.383 1.00 . B B . 7 CYS CB 1 1 18 13763 2 2 7 CYS H H 5.838 -1.545 6.386 1.00 . B B . 7 CYS H 1 1 18 13764 2 2 7 CYS HA H 4.461 -3.737 4.834 1.00 . B B . 7 CYS HA 1 1 18 13765 2 2 7 CYS HB2 H 6.643 -4.381 5.786 1.00 . B B . 7 CYS HB2 1 1 18 13766 2 2 7 CYS HB3 H 6.007 -4.137 7.391 1.00 . B B . 7 CYS HB3 1 1 18 13767 2 2 7 CYS HG H 4.704 -6.289 7.228 1.00 . B B . 7 CYS HG 1 1 18 13768 2 2 7 CYS N N 5.577 -2.112 5.631 1.00 . B B . 7 CYS N 1 1 18 13769 2 2 7 CYS O O 2.402 -3.788 6.118 1.00 . B B . 7 CYS O 1 1 18 13770 2 2 7 CYS SG S 5.184 -6.138 6.409 1.00 . B B . 7 CYS SG 1 1 18 13771 2 2 8 GLY C C 1.713 -1.526 8.976 1.00 . B B . 8 GLY C 1 1 18 13772 2 2 8 GLY CA C 2.145 -2.954 8.689 1.00 . B B . 8 GLY CA 1 1 18 13773 2 2 8 GLY H H 4.281 -2.646 8.251 1.00 . B B . 8 GLY H 1 1 18 13774 2 2 8 GLY HA2 H 1.343 -3.440 8.153 1.00 . B B . 8 GLY HA2 1 1 18 13775 2 2 8 GLY HA3 H 2.308 -3.456 9.630 1.00 . B B . 8 GLY HA3 1 1 18 13776 2 2 8 GLY N N 3.433 -2.958 7.867 1.00 . B B . 8 GLY N 1 1 18 13777 2 2 8 GLY O O 1.306 -0.824 8.074 1.00 . B B . 8 GLY O 1 1 18 13778 2 2 9 ASP C C 2.198 1.220 9.680 1.00 . B B . 9 ASP C 1 1 18 13779 2 2 9 ASP CA C 1.426 0.265 10.641 1.00 . B B . 9 ASP CA 1 1 18 13780 2 2 9 ASP CB C 1.837 0.262 12.146 1.00 . B B . 9 ASP CB 1 1 18 13781 2 2 9 ASP CG C 3.225 -0.317 12.299 1.00 . B B . 9 ASP CG 1 1 18 13782 2 2 9 ASP H H 2.126 -1.740 10.899 1.00 . B B . 9 ASP H 1 1 18 13783 2 2 9 ASP HA H 0.377 0.452 10.494 1.00 . B B . 9 ASP HA 1 1 18 13784 2 2 9 ASP HB2 H 1.866 1.265 12.541 1.00 . B B . 9 ASP HB2 1 1 18 13785 2 2 9 ASP HB3 H 1.168 -0.335 12.743 1.00 . B B . 9 ASP HB3 1 1 18 13786 2 2 9 ASP N N 1.798 -1.125 10.206 1.00 . B B . 9 ASP N 1 1 18 13787 2 2 9 ASP O O 1.683 2.136 9.059 1.00 . B B . 9 ASP O 1 1 18 13788 2 2 9 ASP OD1 O 4.141 0.463 12.207 1.00 . B B . 9 ASP OD1 1 1 18 13789 2 2 9 ASP OD2 O 3.268 -1.519 12.472 1.00 . B B . 9 ASP OD2 1 1 18 13790 2 2 10 HIS C C 4.290 1.055 7.305 1.00 . B B . 10 HIS C 1 1 18 13791 2 2 10 HIS CA C 4.416 1.626 8.752 1.00 . B B . 10 HIS CA 1 1 18 13792 2 2 10 HIS CB C 5.728 1.382 9.459 1.00 . B B . 10 HIS CB 1 1 18 13793 2 2 10 HIS CD2 C 6.163 -1.140 10.205 1.00 . B B . 10 HIS CD2 1 1 18 13794 2 2 10 HIS CE1 C 7.068 -1.789 8.451 1.00 . B B . 10 HIS CE1 1 1 18 13795 2 2 10 HIS CG C 6.202 -0.070 9.342 1.00 . B B . 10 HIS CG 1 1 18 13796 2 2 10 HIS H H 3.751 0.148 10.153 1.00 . B B . 10 HIS H 1 1 18 13797 2 2 10 HIS HA H 4.174 2.680 8.738 1.00 . B B . 10 HIS HA 1 1 18 13798 2 2 10 HIS HB2 H 6.446 2.064 9.048 1.00 . B B . 10 HIS HB2 1 1 18 13799 2 2 10 HIS HB3 H 5.540 1.611 10.499 1.00 . B B . 10 HIS HB3 1 1 18 13800 2 2 10 HIS HD1 H 6.899 0.042 7.503 1.00 . B B . 10 HIS HD1 1 1 18 13801 2 2 10 HIS HD2 H 5.746 -1.107 11.204 1.00 . B B . 10 HIS HD2 1 1 18 13802 2 2 10 HIS HE1 H 7.557 -2.416 7.715 1.00 . B B . 10 HIS HE1 1 1 18 13803 2 2 10 HIS N N 3.446 0.899 9.601 1.00 . B B . 10 HIS N 1 1 18 13804 2 2 10 HIS ND1 N 6.767 -0.537 8.289 1.00 . B B . 10 HIS ND1 1 1 18 13805 2 2 10 HIS NE2 N 6.704 -2.203 9.638 1.00 . B B . 10 HIS NE2 1 1 18 13806 2 2 10 HIS O O 5.096 0.322 6.756 1.00 . B B . 10 HIS O 1 1 18 13807 2 2 11 LEU C C 1.214 1.626 5.349 1.00 . B B . 11 LEU C 1 1 18 13808 2 2 11 LEU CA C 2.670 1.155 5.398 1.00 . B B . 11 LEU CA 1 1 18 13809 2 2 11 LEU CB C 2.734 -0.368 5.119 1.00 . B B . 11 LEU CB 1 1 18 13810 2 2 11 LEU CD1 C 2.887 0.014 2.629 1.00 . B B . 11 LEU CD1 1 1 18 13811 2 2 11 LEU CD2 C 2.131 -2.141 3.525 1.00 . B B . 11 LEU CD2 1 1 18 13812 2 2 11 LEU CG C 2.088 -0.656 3.753 1.00 . B B . 11 LEU CG 1 1 18 13813 2 2 11 LEU H H 2.667 2.057 7.361 1.00 . B B . 11 LEU H 1 1 18 13814 2 2 11 LEU HA H 3.227 1.744 4.686 1.00 . B B . 11 LEU HA 1 1 18 13815 2 2 11 LEU HB2 H 3.761 -0.680 5.098 1.00 . B B . 11 LEU HB2 1 1 18 13816 2 2 11 LEU HB3 H 2.229 -0.918 5.899 1.00 . B B . 11 LEU HB3 1 1 18 13817 2 2 11 LEU HD11 H 2.939 1.085 2.763 1.00 . B B . 11 LEU HD11 1 1 18 13818 2 2 11 LEU HD12 H 3.889 -0.388 2.599 1.00 . B B . 11 LEU HD12 1 1 18 13819 2 2 11 LEU HD13 H 2.421 -0.172 1.676 1.00 . B B . 11 LEU HD13 1 1 18 13820 2 2 11 LEU HD21 H 3.150 -2.499 3.522 1.00 . B B . 11 LEU HD21 1 1 18 13821 2 2 11 LEU HD22 H 1.577 -2.652 4.298 1.00 . B B . 11 LEU HD22 1 1 18 13822 2 2 11 LEU HD23 H 1.678 -2.367 2.580 1.00 . B B . 11 LEU HD23 1 1 18 13823 2 2 11 LEU HG H 1.055 -0.335 3.739 1.00 . B B . 11 LEU HG 1 1 18 13824 2 2 11 LEU N N 3.183 1.468 6.770 1.00 . B B . 11 LEU N 1 1 18 13825 2 2 11 LEU O O 0.868 2.446 4.523 1.00 . B B . 11 LEU O 1 1 18 13826 2 2 12 VAL C C -1.099 3.111 6.136 1.00 . B B . 12 VAL C 1 1 18 13827 2 2 12 VAL CA C -1.092 1.573 6.191 1.00 . B B . 12 VAL CA 1 1 18 13828 2 2 12 VAL CB C -1.804 1.060 7.448 1.00 . B B . 12 VAL CB 1 1 18 13829 2 2 12 VAL CG1 C -1.000 1.398 8.680 1.00 . B B . 12 VAL CG1 1 1 18 13830 2 2 12 VAL CG2 C -3.131 1.807 7.588 1.00 . B B . 12 VAL CG2 1 1 18 13831 2 2 12 VAL H H 0.682 0.438 6.833 1.00 . B B . 12 VAL H 1 1 18 13832 2 2 12 VAL HA H -1.621 1.192 5.339 1.00 . B B . 12 VAL HA 1 1 18 13833 2 2 12 VAL HB H -1.949 -0.012 7.307 1.00 . B B . 12 VAL HB 1 1 18 13834 2 2 12 VAL HG11 H -0.811 2.459 8.794 1.00 . B B . 12 VAL HG11 1 1 18 13835 2 2 12 VAL HG12 H -1.468 1.033 9.578 1.00 . B B . 12 VAL HG12 1 1 18 13836 2 2 12 VAL HG13 H -0.051 0.907 8.567 1.00 . B B . 12 VAL HG13 1 1 18 13837 2 2 12 VAL HG21 H -3.731 1.658 6.703 1.00 . B B . 12 VAL HG21 1 1 18 13838 2 2 12 VAL HG22 H -3.662 1.448 8.453 1.00 . B B . 12 VAL HG22 1 1 18 13839 2 2 12 VAL HG23 H -2.955 2.869 7.711 1.00 . B B . 12 VAL HG23 1 1 18 13840 2 2 12 VAL N N 0.357 1.115 6.201 1.00 . B B . 12 VAL N 1 1 18 13841 2 2 12 VAL O O -1.915 3.721 5.471 1.00 . B B . 12 VAL O 1 1 18 13842 2 2 13 GLU C C -0.157 5.844 5.543 1.00 . B B . 13 GLU C 1 1 18 13843 2 2 13 GLU CA C 0.005 5.165 6.946 1.00 . B B . 13 GLU CA 1 1 18 13844 2 2 13 GLU CB C 1.413 5.375 7.540 1.00 . B B . 13 GLU CB 1 1 18 13845 2 2 13 GLU CD C 3.900 4.850 7.066 1.00 . B B . 13 GLU CD 1 1 18 13846 2 2 13 GLU CG C 2.501 4.960 6.476 1.00 . B B . 13 GLU CG 1 1 18 13847 2 2 13 GLU H H 0.415 3.103 7.415 1.00 . B B . 13 GLU H 1 1 18 13848 2 2 13 GLU HA H -0.740 5.594 7.597 1.00 . B B . 13 GLU HA 1 1 18 13849 2 2 13 GLU HB2 H 1.563 6.415 7.801 1.00 . B B . 13 GLU HB2 1 1 18 13850 2 2 13 GLU HB3 H 1.549 4.785 8.438 1.00 . B B . 13 GLU HB3 1 1 18 13851 2 2 13 GLU HG2 H 2.270 4.016 6.016 1.00 . B B . 13 GLU HG2 1 1 18 13852 2 2 13 GLU HG3 H 2.576 5.707 5.705 1.00 . B B . 13 GLU HG3 1 1 18 13853 2 2 13 GLU N N -0.181 3.676 6.873 1.00 . B B . 13 GLU N 1 1 18 13854 2 2 13 GLU O O -0.530 6.996 5.418 1.00 . B B . 13 GLU O 1 1 18 13855 2 2 13 GLU OE1 O 4.270 5.731 7.814 1.00 . B B . 13 GLU OE1 1 1 18 13856 2 2 13 GLU OE2 O 4.517 3.865 6.711 1.00 . B B . 13 GLU OE2 1 1 18 13857 2 2 14 ALA C C -1.359 5.150 2.602 1.00 . B B . 14 ALA C 1 1 18 13858 2 2 14 ALA CA C 0.021 5.559 3.114 1.00 . B B . 14 ALA CA 1 1 18 13859 2 2 14 ALA CB C 1.216 4.896 2.385 1.00 . B B . 14 ALA CB 1 1 18 13860 2 2 14 ALA H H 0.373 4.150 4.641 1.00 . B B . 14 ALA H 1 1 18 13861 2 2 14 ALA HA H 0.032 6.629 3.147 1.00 . B B . 14 ALA HA 1 1 18 13862 2 2 14 ALA HB1 H 2.138 5.187 2.874 1.00 . B B . 14 ALA HB1 1 1 18 13863 2 2 14 ALA HB2 H 1.147 3.817 2.439 1.00 . B B . 14 ALA HB2 1 1 18 13864 2 2 14 ALA HB3 H 1.260 5.199 1.351 1.00 . B B . 14 ALA HB3 1 1 18 13865 2 2 14 ALA N N 0.112 5.083 4.510 1.00 . B B . 14 ALA N 1 1 18 13866 2 2 14 ALA O O -2.058 5.930 1.991 1.00 . B B . 14 ALA O 1 1 18 13867 2 2 15 LEU C C -4.159 4.477 2.766 1.00 . B B . 15 LEU C 1 1 18 13868 2 2 15 LEU CA C -3.062 3.431 2.409 1.00 . B B . 15 LEU CA 1 1 18 13869 2 2 15 LEU CB C -3.257 2.121 3.124 1.00 . B B . 15 LEU CB 1 1 18 13870 2 2 15 LEU CD1 C -0.876 1.116 2.748 1.00 . B B . 15 LEU CD1 1 1 18 13871 2 2 15 LEU CD2 C -2.885 -0.247 3.025 1.00 . B B . 15 LEU CD2 1 1 18 13872 2 2 15 LEU CG C -2.363 1.062 2.496 1.00 . B B . 15 LEU CG 1 1 18 13873 2 2 15 LEU H H -1.116 3.319 3.310 1.00 . B B . 15 LEU H 1 1 18 13874 2 2 15 LEU HA H -3.071 3.284 1.342 1.00 . B B . 15 LEU HA 1 1 18 13875 2 2 15 LEU HB2 H -3.057 2.218 4.177 1.00 . B B . 15 LEU HB2 1 1 18 13876 2 2 15 LEU HB3 H -4.291 1.825 3.013 1.00 . B B . 15 LEU HB3 1 1 18 13877 2 2 15 LEU HD11 H -0.414 2.017 2.381 1.00 . B B . 15 LEU HD11 1 1 18 13878 2 2 15 LEU HD12 H -0.639 0.978 3.777 1.00 . B B . 15 LEU HD12 1 1 18 13879 2 2 15 LEU HD13 H -0.415 0.295 2.220 1.00 . B B . 15 LEU HD13 1 1 18 13880 2 2 15 LEU HD21 H -3.922 -0.351 2.758 1.00 . B B . 15 LEU HD21 1 1 18 13881 2 2 15 LEU HD22 H -2.335 -1.078 2.630 1.00 . B B . 15 LEU HD22 1 1 18 13882 2 2 15 LEU HD23 H -2.822 -0.292 4.104 1.00 . B B . 15 LEU HD23 1 1 18 13883 2 2 15 LEU HG H -2.397 1.209 1.438 1.00 . B B . 15 LEU HG 1 1 18 13884 2 2 15 LEU N N -1.727 3.928 2.842 1.00 . B B . 15 LEU N 1 1 18 13885 2 2 15 LEU O O -4.989 4.840 1.961 1.00 . B B . 15 LEU O 1 1 18 13886 2 2 16 TYR C C -5.015 7.261 3.768 1.00 . B B . 16 TYR C 1 1 18 13887 2 2 16 TYR CA C -5.016 5.930 4.588 1.00 . B B . 16 TYR CA 1 1 18 13888 2 2 16 TYR CB C -4.537 6.119 6.054 1.00 . B B . 16 TYR CB 1 1 18 13889 2 2 16 TYR CD1 C -5.962 8.128 6.698 1.00 . B B . 16 TYR CD1 1 1 18 13890 2 2 16 TYR CD2 C -6.258 6.102 7.899 1.00 . B B . 16 TYR CD2 1 1 18 13891 2 2 16 TYR CE1 C -6.940 8.725 7.476 1.00 . B B . 16 TYR CE1 1 1 18 13892 2 2 16 TYR CE2 C -7.233 6.707 8.670 1.00 . B B . 16 TYR CE2 1 1 18 13893 2 2 16 TYR CG C -5.615 6.809 6.904 1.00 . B B . 16 TYR CG 1 1 18 13894 2 2 16 TYR CZ C -7.573 8.014 8.462 1.00 . B B . 16 TYR CZ 1 1 18 13895 2 2 16 TYR H H -3.349 4.534 4.529 1.00 . B B . 16 TYR H 1 1 18 13896 2 2 16 TYR HA H -6.029 5.548 4.560 1.00 . B B . 16 TYR HA 1 1 18 13897 2 2 16 TYR HB2 H -4.298 5.162 6.495 1.00 . B B . 16 TYR HB2 1 1 18 13898 2 2 16 TYR HB3 H -3.644 6.729 6.074 1.00 . B B . 16 TYR HB3 1 1 18 13899 2 2 16 TYR HD1 H -5.471 8.699 5.924 1.00 . B B . 16 TYR HD1 1 1 18 13900 2 2 16 TYR HD2 H -6.000 5.068 8.075 1.00 . B B . 16 TYR HD2 1 1 18 13901 2 2 16 TYR HE1 H -7.211 9.755 7.308 1.00 . B B . 16 TYR HE1 1 1 18 13902 2 2 16 TYR HE2 H -7.744 6.165 9.451 1.00 . B B . 16 TYR HE2 1 1 18 13903 2 2 16 TYR HH H -8.269 9.506 9.382 1.00 . B B . 16 TYR HH 1 1 18 13904 2 2 16 TYR N N -4.078 4.911 3.992 1.00 . B B . 16 TYR N 1 1 18 13905 2 2 16 TYR O O -5.989 7.983 3.698 1.00 . B B . 16 TYR O 1 1 18 13906 2 2 16 TYR OH O -8.541 8.598 9.243 1.00 . B B . 16 TYR OH 1 1 18 13907 2 2 17 LEU C C -4.163 8.526 0.879 1.00 . B B . 17 LEU C 1 1 18 13908 2 2 17 LEU CA C -3.673 8.752 2.332 1.00 . B B . 17 LEU CA 1 1 18 13909 2 2 17 LEU CB C -2.145 9.079 2.383 1.00 . B B . 17 LEU CB 1 1 18 13910 2 2 17 LEU CD1 C -2.262 10.046 4.694 1.00 . B B . 17 LEU CD1 1 1 18 13911 2 2 17 LEU CD2 C -0.349 10.547 3.235 1.00 . B B . 17 LEU CD2 1 1 18 13912 2 2 17 LEU CG C -1.858 10.317 3.245 1.00 . B B . 17 LEU CG 1 1 18 13913 2 2 17 LEU H H -3.163 6.880 3.292 1.00 . B B . 17 LEU H 1 1 18 13914 2 2 17 LEU HA H -4.259 9.569 2.730 1.00 . B B . 17 LEU HA 1 1 18 13915 2 2 17 LEU HB2 H -1.615 8.238 2.807 1.00 . B B . 17 LEU HB2 1 1 18 13916 2 2 17 LEU HB3 H -1.769 9.242 1.383 1.00 . B B . 17 LEU HB3 1 1 18 13917 2 2 17 LEU HD11 H -1.706 9.206 5.091 1.00 . B B . 17 LEU HD11 1 1 18 13918 2 2 17 LEU HD12 H -2.057 10.913 5.305 1.00 . B B . 17 LEU HD12 1 1 18 13919 2 2 17 LEU HD13 H -3.316 9.820 4.764 1.00 . B B . 17 LEU HD13 1 1 18 13920 2 2 17 LEU HD21 H 0.000 10.701 2.225 1.00 . B B . 17 LEU HD21 1 1 18 13921 2 2 17 LEU HD22 H -0.101 11.418 3.822 1.00 . B B . 17 LEU HD22 1 1 18 13922 2 2 17 LEU HD23 H 0.162 9.691 3.655 1.00 . B B . 17 LEU HD23 1 1 18 13923 2 2 17 LEU HG H -2.381 11.184 2.853 1.00 . B B . 17 LEU HG 1 1 18 13924 2 2 17 LEU N N -3.889 7.523 3.174 1.00 . B B . 17 LEU N 1 1 18 13925 2 2 17 LEU O O -4.822 9.369 0.306 1.00 . B B . 17 LEU O 1 1 18 13926 2 2 18 VAL C C -5.787 6.698 -1.186 1.00 . B B . 18 VAL C 1 1 18 13927 2 2 18 VAL CA C -4.264 7.087 -1.091 1.00 . B B . 18 VAL CA 1 1 18 13928 2 2 18 VAL CB C -3.312 5.965 -1.622 1.00 . B B . 18 VAL CB 1 1 18 13929 2 2 18 VAL CG1 C -3.530 4.679 -0.894 1.00 . B B . 18 VAL CG1 1 1 18 13930 2 2 18 VAL CG2 C -3.595 5.704 -3.108 1.00 . B B . 18 VAL CG2 1 1 18 13931 2 2 18 VAL H H -3.278 6.790 0.858 1.00 . B B . 18 VAL H 1 1 18 13932 2 2 18 VAL HA H -4.093 7.936 -1.728 1.00 . B B . 18 VAL HA 1 1 18 13933 2 2 18 VAL HB H -2.285 6.291 -1.501 1.00 . B B . 18 VAL HB 1 1 18 13934 2 2 18 VAL HG11 H -3.384 4.844 0.158 1.00 . B B . 18 VAL HG11 1 1 18 13935 2 2 18 VAL HG12 H -4.544 4.361 -1.078 1.00 . B B . 18 VAL HG12 1 1 18 13936 2 2 18 VAL HG13 H -2.849 3.917 -1.242 1.00 . B B . 18 VAL HG13 1 1 18 13937 2 2 18 VAL HG21 H -3.444 6.599 -3.693 1.00 . B B . 18 VAL HG21 1 1 18 13938 2 2 18 VAL HG22 H -2.937 4.939 -3.494 1.00 . B B . 18 VAL HG22 1 1 18 13939 2 2 18 VAL HG23 H -4.618 5.379 -3.258 1.00 . B B . 18 VAL HG23 1 1 18 13940 2 2 18 VAL N N -3.826 7.399 0.320 1.00 . B B . 18 VAL N 1 1 18 13941 2 2 18 VAL O O -6.454 7.206 -2.062 1.00 . B B . 18 VAL O 1 1 18 13942 2 2 19 CYS C C -8.617 5.756 0.893 1.00 . B B . 19 CYS C 1 1 18 13943 2 2 19 CYS CA C -7.781 5.458 -0.395 1.00 . B B . 19 CYS CA 1 1 18 13944 2 2 19 CYS CB C -7.880 3.968 -0.693 1.00 . B B . 19 CYS CB 1 1 18 13945 2 2 19 CYS H H -5.760 5.438 0.363 1.00 . B B . 19 CYS H 1 1 18 13946 2 2 19 CYS HA H -8.255 6.000 -1.204 1.00 . B B . 19 CYS HA 1 1 18 13947 2 2 19 CYS HB2 H -8.886 3.739 -1.005 1.00 . B B . 19 CYS HB2 1 1 18 13948 2 2 19 CYS HB3 H -7.230 3.811 -1.525 1.00 . B B . 19 CYS HB3 1 1 18 13949 2 2 19 CYS HG H -8.127 2.809 1.264 1.00 . B B . 19 CYS HG 1 1 18 13950 2 2 19 CYS N N -6.314 5.843 -0.331 1.00 . B B . 19 CYS N 1 1 18 13951 2 2 19 CYS O O -9.046 4.855 1.600 1.00 . B B . 19 CYS O 1 1 18 13952 2 2 19 CYS SG S -7.415 2.816 0.619 1.00 . B B . 19 CYS SG 1 1 18 13953 2 2 20 GLY C C -11.101 7.756 2.075 1.00 . B B . 20 GLY C 1 1 18 13954 2 2 20 GLY CA C -9.661 7.376 2.420 1.00 . B B . 20 GLY CA 1 1 18 13955 2 2 20 GLY H H -8.487 7.682 0.575 1.00 . B B . 20 GLY H 1 1 18 13956 2 2 20 GLY HA2 H -9.702 6.545 3.107 1.00 . B B . 20 GLY HA2 1 1 18 13957 2 2 20 GLY HA3 H -9.209 8.221 2.913 1.00 . B B . 20 GLY HA3 1 1 18 13958 2 2 20 GLY N N -8.852 7.006 1.184 1.00 . B B . 20 GLY N 1 1 18 13959 2 2 20 GLY O O -11.695 8.647 2.644 1.00 . B B . 20 GLY O 1 1 18 13960 2 2 21 GLU C C -13.824 5.857 0.667 1.00 . B B . 21 GLU C 1 1 18 13961 2 2 21 GLU CA C -12.978 7.146 0.565 1.00 . B B . 21 GLU CA 1 1 18 13962 2 2 21 GLU CB C -12.866 7.555 -0.948 1.00 . B B . 21 GLU CB 1 1 18 13963 2 2 21 GLU CD C -10.772 6.276 -1.817 1.00 . B B . 21 GLU CD 1 1 18 13964 2 2 21 GLU CG C -11.375 7.630 -1.485 1.00 . B B . 21 GLU CG 1 1 18 13965 2 2 21 GLU H H -10.988 6.345 0.756 1.00 . B B . 21 GLU H 1 1 18 13966 2 2 21 GLU HA H -13.514 7.914 1.107 1.00 . B B . 21 GLU HA 1 1 18 13967 2 2 21 GLU HB2 H -13.356 6.790 -1.544 1.00 . B B . 21 GLU HB2 1 1 18 13968 2 2 21 GLU HB3 H -13.383 8.480 -1.126 1.00 . B B . 21 GLU HB3 1 1 18 13969 2 2 21 GLU HG2 H -11.352 8.212 -2.392 1.00 . B B . 21 GLU HG2 1 1 18 13970 2 2 21 GLU HG3 H -10.716 8.106 -0.781 1.00 . B B . 21 GLU HG3 1 1 18 13971 2 2 21 GLU N N -11.589 7.020 1.130 1.00 . B B . 21 GLU N 1 1 18 13972 2 2 21 GLU O O -14.951 5.815 1.115 1.00 . B B . 21 GLU O 1 1 18 13973 2 2 21 GLU OE1 O -10.745 5.424 -0.950 1.00 . B B . 21 GLU OE1 1 1 18 13974 2 2 21 GLU OE2 O -10.358 6.143 -2.942 1.00 . B B . 21 GLU OE2 1 1 18 13975 2 2 22 ARG C C -13.155 2.414 1.154 1.00 . B B . 22 ARG C 1 1 18 13976 2 2 22 ARG CA C -13.677 3.450 0.147 1.00 . B B . 22 ARG CA 1 1 18 13977 2 2 22 ARG CB C -13.413 3.038 -1.326 1.00 . B B . 22 ARG CB 1 1 18 13978 2 2 22 ARG CD C -12.772 0.713 -1.506 1.00 . B B . 22 ARG CD 1 1 18 13979 2 2 22 ARG CG C -13.964 1.622 -1.571 1.00 . B B . 22 ARG CG 1 1 18 13980 2 2 22 ARG CZ C -12.826 -1.268 -0.165 1.00 . B B . 22 ARG CZ 1 1 18 13981 2 2 22 ARG H H -12.293 5.010 -0.097 1.00 . B B . 22 ARG H 1 1 18 13982 2 2 22 ARG HA H -14.699 3.543 0.342 1.00 . B B . 22 ARG HA 1 1 18 13983 2 2 22 ARG HB2 H -13.826 3.751 -2.021 1.00 . B B . 22 ARG HB2 1 1 18 13984 2 2 22 ARG HB3 H -12.339 3.061 -1.485 1.00 . B B . 22 ARG HB3 1 1 18 13985 2 2 22 ARG HD2 H -12.284 0.738 -2.475 1.00 . B B . 22 ARG HD2 1 1 18 13986 2 2 22 ARG HD3 H -12.042 1.071 -0.778 1.00 . B B . 22 ARG HD3 1 1 18 13987 2 2 22 ARG HE H -13.981 -1.116 -1.684 1.00 . B B . 22 ARG HE 1 1 18 13988 2 2 22 ARG HG2 H -14.711 1.350 -0.837 1.00 . B B . 22 ARG HG2 1 1 18 13989 2 2 22 ARG HG3 H -14.418 1.572 -2.553 1.00 . B B . 22 ARG HG3 1 1 18 13990 2 2 22 ARG HH11 H -13.836 -0.159 1.060 1.00 . B B . 22 ARG HH11 1 1 18 13991 2 2 22 ARG HH12 H -12.799 -1.354 1.770 1.00 . B B . 22 ARG HH12 1 1 18 13992 2 2 22 ARG HH21 H -11.790 -2.451 -1.297 1.00 . B B . 22 ARG HH21 1 1 18 13993 2 2 22 ARG HH22 H -11.624 -2.678 0.413 1.00 . B B . 22 ARG HH22 1 1 18 13994 2 2 22 ARG N N -13.176 4.830 0.217 1.00 . B B . 22 ARG N 1 1 18 13995 2 2 22 ARG NE N -13.291 -0.658 -1.166 1.00 . B B . 22 ARG NE 1 1 18 13996 2 2 22 ARG NH1 N -13.183 -0.903 0.971 1.00 . B B . 22 ARG NH1 1 1 18 13997 2 2 22 ARG NH2 N -12.025 -2.201 -0.363 1.00 . B B . 22 ARG NH2 1 1 18 13998 2 2 22 ARG O O -13.885 1.577 1.652 1.00 . B B . 22 ARG O 1 1 18 13999 2 2 23 GLY C C -10.582 0.239 1.822 1.00 . B B . 23 GLY C 1 1 18 14000 2 2 23 GLY CA C -11.228 1.521 2.383 1.00 . B B . 23 GLY CA 1 1 18 14001 2 2 23 GLY H H -11.444 3.204 0.914 1.00 . B B . 23 GLY H 1 1 18 14002 2 2 23 GLY HA2 H -10.450 2.050 2.914 1.00 . B B . 23 GLY HA2 1 1 18 14003 2 2 23 GLY HA3 H -11.955 1.206 3.119 1.00 . B B . 23 GLY HA3 1 1 18 14004 2 2 23 GLY N N -11.890 2.482 1.403 1.00 . B B . 23 GLY N 1 1 18 14005 2 2 23 GLY O O -11.012 -0.844 2.158 1.00 . B B . 23 GLY O 1 1 18 14006 2 2 24 PHE C C -9.097 -2.202 0.271 1.00 . B B . 24 PHE C 1 1 18 14007 2 2 24 PHE CA C -8.775 -0.657 0.304 1.00 . B B . 24 PHE CA 1 1 18 14008 2 2 24 PHE CB C -7.333 -0.491 0.866 1.00 . B B . 24 PHE CB 1 1 18 14009 2 2 24 PHE CD1 C -8.020 -1.323 3.177 1.00 . B B . 24 PHE CD1 1 1 18 14010 2 2 24 PHE CD2 C -6.898 0.757 3.028 1.00 . B B . 24 PHE CD2 1 1 18 14011 2 2 24 PHE CE1 C -8.103 -1.184 4.545 1.00 . B B . 24 PHE CE1 1 1 18 14012 2 2 24 PHE CE2 C -6.977 0.903 4.397 1.00 . B B . 24 PHE CE2 1 1 18 14013 2 2 24 PHE CG C -7.417 -0.354 2.401 1.00 . B B . 24 PHE CG 1 1 18 14014 2 2 24 PHE CZ C -7.582 -0.070 5.159 1.00 . B B . 24 PHE CZ 1 1 18 14015 2 2 24 PHE H H -9.381 1.366 0.829 1.00 . B B . 24 PHE H 1 1 18 14016 2 2 24 PHE HA H -8.734 -0.376 -0.739 1.00 . B B . 24 PHE HA 1 1 18 14017 2 2 24 PHE HB2 H -6.714 -1.348 0.640 1.00 . B B . 24 PHE HB2 1 1 18 14018 2 2 24 PHE HB3 H -6.852 0.385 0.467 1.00 . B B . 24 PHE HB3 1 1 18 14019 2 2 24 PHE HD1 H -8.439 -2.204 2.712 1.00 . B B . 24 PHE HD1 1 1 18 14020 2 2 24 PHE HD2 H -6.424 1.528 2.442 1.00 . B B . 24 PHE HD2 1 1 18 14021 2 2 24 PHE HE1 H -8.582 -1.956 5.135 1.00 . B B . 24 PHE HE1 1 1 18 14022 2 2 24 PHE HE2 H -6.566 1.782 4.874 1.00 . B B . 24 PHE HE2 1 1 18 14023 2 2 24 PHE HZ H -7.649 0.039 6.232 1.00 . B B . 24 PHE HZ 1 1 18 14024 2 2 24 PHE N N -9.595 0.427 0.998 1.00 . B B . 24 PHE N 1 1 18 14025 2 2 24 PHE O O -9.913 -2.773 0.965 1.00 . B B . 24 PHE O 1 1 18 14026 2 2 25 PHE C C -7.029 -4.842 -0.620 1.00 . B B . 25 PHE C 1 1 18 14027 2 2 25 PHE CA C -8.491 -4.335 -0.829 1.00 . B B . 25 PHE CA 1 1 18 14028 2 2 25 PHE CB C -8.971 -4.616 -2.279 1.00 . B B . 25 PHE CB 1 1 18 14029 2 2 25 PHE CD1 C -10.113 -2.481 -2.998 1.00 . B B . 25 PHE CD1 1 1 18 14030 2 2 25 PHE CD2 C -11.474 -4.397 -2.696 1.00 . B B . 25 PHE CD2 1 1 18 14031 2 2 25 PHE CE1 C -11.217 -1.743 -3.364 1.00 . B B . 25 PHE CE1 1 1 18 14032 2 2 25 PHE CE2 C -12.588 -3.665 -3.062 1.00 . B B . 25 PHE CE2 1 1 18 14033 2 2 25 PHE CG C -10.226 -3.811 -2.662 1.00 . B B . 25 PHE CG 1 1 18 14034 2 2 25 PHE CZ C -12.460 -2.335 -3.398 1.00 . B B . 25 PHE CZ 1 1 18 14035 2 2 25 PHE H H -7.770 -2.342 -1.167 1.00 . B B . 25 PHE H 1 1 18 14036 2 2 25 PHE HA H -9.125 -4.795 -0.081 1.00 . B B . 25 PHE HA 1 1 18 14037 2 2 25 PHE HB2 H -8.187 -4.354 -2.975 1.00 . B B . 25 PHE HB2 1 1 18 14038 2 2 25 PHE HB3 H -9.187 -5.668 -2.400 1.00 . B B . 25 PHE HB3 1 1 18 14039 2 2 25 PHE HD1 H -9.139 -2.012 -2.978 1.00 . B B . 25 PHE HD1 1 1 18 14040 2 2 25 PHE HD2 H -11.578 -5.442 -2.436 1.00 . B B . 25 PHE HD2 1 1 18 14041 2 2 25 PHE HE1 H -11.097 -0.701 -3.627 1.00 . B B . 25 PHE HE1 1 1 18 14042 2 2 25 PHE HE2 H -13.561 -4.141 -3.090 1.00 . B B . 25 PHE HE2 1 1 18 14043 2 2 25 PHE HZ H -13.327 -1.760 -3.693 1.00 . B B . 25 PHE HZ 1 1 18 14044 2 2 25 PHE N N -8.392 -2.850 -0.609 1.00 . B B . 25 PHE N 1 1 18 14045 2 2 25 PHE O O -6.105 -4.141 -0.987 1.00 . B B . 25 PHE O 1 1 18 14046 2 2 26 TYR C C -5.059 -7.865 -0.539 1.00 . B B . 26 TYR C 1 1 18 14047 2 2 26 TYR CA C -5.403 -6.512 0.148 1.00 . B B . 26 TYR CA 1 1 18 14048 2 2 26 TYR CB C -5.203 -6.604 1.689 1.00 . B B . 26 TYR CB 1 1 18 14049 2 2 26 TYR CD1 C -4.874 -4.059 1.757 1.00 . B B . 26 TYR CD1 1 1 18 14050 2 2 26 TYR CD2 C -5.466 -5.193 3.751 1.00 . B B . 26 TYR CD2 1 1 18 14051 2 2 26 TYR CE1 C -4.859 -2.869 2.446 1.00 . B B . 26 TYR CE1 1 1 18 14052 2 2 26 TYR CE2 C -5.445 -3.990 4.433 1.00 . B B . 26 TYR CE2 1 1 18 14053 2 2 26 TYR CG C -5.179 -5.241 2.402 1.00 . B B . 26 TYR CG 1 1 18 14054 2 2 26 TYR CZ C -5.143 -2.827 3.782 1.00 . B B . 26 TYR CZ 1 1 18 14055 2 2 26 TYR H H -7.565 -6.571 0.195 1.00 . B B . 26 TYR H 1 1 18 14056 2 2 26 TYR HA H -4.699 -5.796 -0.249 1.00 . B B . 26 TYR HA 1 1 18 14057 2 2 26 TYR HB2 H -6.010 -7.181 2.112 1.00 . B B . 26 TYR HB2 1 1 18 14058 2 2 26 TYR HB3 H -4.267 -7.096 1.907 1.00 . B B . 26 TYR HB3 1 1 18 14059 2 2 26 TYR HD1 H -4.637 -4.044 0.707 1.00 . B B . 26 TYR HD1 1 1 18 14060 2 2 26 TYR HD2 H -5.708 -6.103 4.279 1.00 . B B . 26 TYR HD2 1 1 18 14061 2 2 26 TYR HE1 H -4.622 -1.961 1.923 1.00 . B B . 26 TYR HE1 1 1 18 14062 2 2 26 TYR HE2 H -5.668 -3.944 5.487 1.00 . B B . 26 TYR HE2 1 1 18 14063 2 2 26 TYR HH H -5.937 -1.185 4.214 1.00 . B B . 26 TYR HH 1 1 18 14064 2 2 26 TYR N N -6.812 -6.005 -0.073 1.00 . B B . 26 TYR N 1 1 18 14065 2 2 26 TYR O O -5.613 -8.893 -0.202 1.00 . B B . 26 TYR O 1 1 18 14066 2 2 26 TYR OH O -5.120 -1.636 4.462 1.00 . B B . 26 TYR OH 1 1 18 14067 2 2 27 THR C C -3.895 -10.350 -1.960 1.00 . B B . 27 THR C 1 1 18 14068 2 2 27 THR CA C -3.573 -8.865 -2.336 1.00 . B B . 27 THR CA 1 1 18 14069 2 2 27 THR CB C -2.025 -8.615 -2.372 1.00 . B B . 27 THR CB 1 1 18 14070 2 2 27 THR CG2 C -1.539 -8.477 -3.805 1.00 . B B . 27 THR CG2 1 1 18 14071 2 2 27 THR H H -3.780 -6.867 -1.628 1.00 . B B . 27 THR H 1 1 18 14072 2 2 27 THR HA H -3.962 -8.726 -3.334 1.00 . B B . 27 THR HA 1 1 18 14073 2 2 27 THR HB H -1.425 -9.254 -1.733 1.00 . B B . 27 THR HB 1 1 18 14074 2 2 27 THR HG1 H -0.851 -7.218 -1.946 1.00 . B B . 27 THR HG1 1 1 18 14075 2 2 27 THR HG21 H -1.755 -9.352 -4.391 1.00 . B B . 27 THR HG21 1 1 18 14076 2 2 27 THR HG22 H -2.006 -7.627 -4.280 1.00 . B B . 27 THR HG22 1 1 18 14077 2 2 27 THR HG23 H -0.473 -8.319 -3.822 1.00 . B B . 27 THR HG23 1 1 18 14078 2 2 27 THR N N -4.151 -7.762 -1.467 1.00 . B B . 27 THR N 1 1 18 14079 2 2 27 THR O O -5.049 -10.725 -1.954 1.00 . B B . 27 THR O 1 1 18 14080 2 2 27 THR OG1 O -1.820 -7.262 -2.005 1.00 . B B . 27 THR OG1 1 1 18 14081 2 2 28 PRO C C -3.683 -12.334 0.546 1.00 . B B . 28 PRO C 1 1 18 14082 2 2 28 PRO CA C -3.300 -12.461 -0.954 1.00 . B B . 28 PRO CA 1 1 18 14083 2 2 28 PRO CB C -2.089 -13.367 -1.215 1.00 . B B . 28 PRO CB 1 1 18 14084 2 2 28 PRO CD C -1.900 -11.524 -2.721 1.00 . B B . 28 PRO CD 1 1 18 14085 2 2 28 PRO CG C -1.817 -13.055 -2.683 1.00 . B B . 28 PRO CG 1 1 18 14086 2 2 28 PRO HA H -4.163 -12.887 -1.451 1.00 . B B . 28 PRO HA 1 1 18 14087 2 2 28 PRO HB2 H -1.248 -13.095 -0.593 1.00 . B B . 28 PRO HB2 1 1 18 14088 2 2 28 PRO HB3 H -2.338 -14.410 -1.066 1.00 . B B . 28 PRO HB3 1 1 18 14089 2 2 28 PRO HD2 H -0.935 -11.083 -2.502 1.00 . B B . 28 PRO HD2 1 1 18 14090 2 2 28 PRO HD3 H -2.246 -11.204 -3.696 1.00 . B B . 28 PRO HD3 1 1 18 14091 2 2 28 PRO HG2 H -0.833 -13.393 -2.983 1.00 . B B . 28 PRO HG2 1 1 18 14092 2 2 28 PRO HG3 H -2.562 -13.502 -3.330 1.00 . B B . 28 PRO HG3 1 1 18 14093 2 2 28 PRO N N -2.912 -11.180 -1.652 1.00 . B B . 28 PRO N 1 1 18 14094 2 2 28 PRO O O -3.109 -12.972 1.414 1.00 . B B . 28 PRO O 1 1 18 14095 2 2 29 LYS C C -6.697 -11.296 2.250 1.00 . B B . 29 LYS C 1 1 18 14096 2 2 29 LYS CA C -5.159 -11.238 2.196 1.00 . B B . 29 LYS CA 1 1 18 14097 2 2 29 LYS CB C -4.643 -9.840 2.676 1.00 . B B . 29 LYS CB 1 1 18 14098 2 2 29 LYS CD C -2.463 -10.764 3.578 1.00 . B B . 29 LYS CD 1 1 18 14099 2 2 29 LYS CE C -1.279 -11.479 2.927 1.00 . B B . 29 LYS CE 1 1 18 14100 2 2 29 LYS CG C -3.098 -9.736 2.586 1.00 . B B . 29 LYS CG 1 1 18 14101 2 2 29 LYS H H -5.033 -11.000 0.038 1.00 . B B . 29 LYS H 1 1 18 14102 2 2 29 LYS HA H -4.854 -12.032 2.833 1.00 . B B . 29 LYS HA 1 1 18 14103 2 2 29 LYS HB2 H -5.096 -9.089 2.052 1.00 . B B . 29 LYS HB2 1 1 18 14104 2 2 29 LYS HB3 H -4.972 -9.663 3.692 1.00 . B B . 29 LYS HB3 1 1 18 14105 2 2 29 LYS HD2 H -2.113 -10.224 4.448 1.00 . B B . 29 LYS HD2 1 1 18 14106 2 2 29 LYS HD3 H -3.209 -11.464 3.920 1.00 . B B . 29 LYS HD3 1 1 18 14107 2 2 29 LYS HE2 H -1.298 -11.369 1.845 1.00 . B B . 29 LYS HE2 1 1 18 14108 2 2 29 LYS HE3 H -0.340 -11.061 3.288 1.00 . B B . 29 LYS HE3 1 1 18 14109 2 2 29 LYS HG2 H -2.805 -9.898 1.557 1.00 . B B . 29 LYS HG2 1 1 18 14110 2 2 29 LYS HG3 H -2.806 -8.727 2.853 1.00 . B B . 29 LYS HG3 1 1 18 14111 2 2 29 LYS HZ1 H -2.251 -13.046 3.906 1.00 . B B . 29 LYS HZ1 1 1 18 14112 2 2 29 LYS HZ2 H -1.631 -13.460 2.441 1.00 . B B . 29 LYS HZ2 1 1 18 14113 2 2 29 LYS HZ3 H -0.572 -13.307 3.786 1.00 . B B . 29 LYS HZ3 1 1 18 14114 2 2 29 LYS N N -4.645 -11.488 0.799 1.00 . B B . 29 LYS N 1 1 18 14115 2 2 29 LYS NZ N -1.411 -12.920 3.310 1.00 . B B . 29 LYS NZ 1 1 18 14116 2 2 29 LYS O O -7.306 -11.925 3.088 1.00 . B B . 29 LYS O 1 1 18 14117 2 2 30 THR C C -9.264 -10.986 -0.228 1.00 . B B . 30 THR C 1 1 18 14118 2 2 30 THR CA C -8.744 -10.476 1.125 1.00 . B B . 30 THR CA 1 1 18 14119 2 2 30 THR CB C -9.189 -8.998 1.260 1.00 . B B . 30 THR CB 1 1 18 14120 2 2 30 THR CG2 C -8.764 -8.400 2.577 1.00 . B B . 30 THR CG2 1 1 18 14121 2 2 30 THR H H -6.593 -10.158 0.737 1.00 . B B . 30 THR H 1 1 18 14122 2 2 30 THR HA H -9.250 -11.053 1.886 1.00 . B B . 30 THR HA 1 1 18 14123 2 2 30 THR HB H -10.243 -8.848 1.040 1.00 . B B . 30 THR HB 1 1 18 14124 2 2 30 THR HG1 H -7.600 -8.742 0.125 1.00 . B B . 30 THR HG1 1 1 18 14125 2 2 30 THR HG21 H -7.693 -8.437 2.686 1.00 . B B . 30 THR HG21 1 1 18 14126 2 2 30 THR HG22 H -9.082 -7.369 2.619 1.00 . B B . 30 THR HG22 1 1 18 14127 2 2 30 THR HG23 H -9.217 -8.940 3.395 1.00 . B B . 30 THR HG23 1 1 18 14128 2 2 30 THR N N -7.243 -10.599 1.312 1.00 . B B . 30 THR N 1 1 18 14129 2 2 30 THR O O -10.453 -10.988 -0.485 1.00 . B B . 30 THR O 1 1 18 14130 2 2 30 THR OG1 O -8.376 -8.226 0.391 1.00 . B B . 30 THR OG1 1 1 19 14131 1 1 1 GLY C C 2.585 -1.591 0.703 1.00 . A A . 1 GLY C 1 1 19 14132 1 1 1 GLY CA C 3.634 -0.471 0.593 1.00 . A A . 1 GLY CA 1 1 19 14133 1 1 1 GLY HA2 H 3.151 0.436 0.916 1.00 . A A . 1 GLY HA2 1 1 19 14134 1 1 1 GLY HA3 H 3.889 -0.352 -0.441 1.00 . A A . 1 GLY HA3 1 1 19 14135 1 1 1 GLY N N 4.894 -0.649 1.401 1.00 . A A . 1 GLY N 1 1 19 14136 1 1 1 GLY O O 1.546 -1.501 0.097 1.00 . A A . 1 GLY O 1 1 19 14137 1 1 2 ILE C C 2.480 -5.226 1.252 1.00 . A A . 2 ILE C 1 1 19 14138 1 1 2 ILE CA C 2.164 -3.844 1.848 1.00 . A A . 2 ILE CA 1 1 19 14139 1 1 2 ILE CB C 0.590 -3.547 1.664 1.00 . A A . 2 ILE CB 1 1 19 14140 1 1 2 ILE CD1 C -1.409 -3.368 3.186 1.00 . A A . 2 ILE CD1 1 1 19 14141 1 1 2 ILE CG1 C -0.259 -4.317 2.719 1.00 . A A . 2 ILE CG1 1 1 19 14142 1 1 2 ILE CG2 C 0.077 -3.967 0.284 1.00 . A A . 2 ILE CG2 1 1 19 14143 1 1 2 ILE H H 3.809 -2.458 1.895 1.00 . A A . 2 ILE H 1 1 19 14144 1 1 2 ILE HA H 2.459 -4.030 2.852 1.00 . A A . 2 ILE HA 1 1 19 14145 1 1 2 ILE HB H 0.399 -2.491 1.771 1.00 . A A . 2 ILE HB 1 1 19 14146 1 1 2 ILE HD11 H -1.001 -2.465 3.624 1.00 . A A . 2 ILE HD11 1 1 19 14147 1 1 2 ILE HD12 H -2.042 -3.078 2.359 1.00 . A A . 2 ILE HD12 1 1 19 14148 1 1 2 ILE HD13 H -2.025 -3.830 3.942 1.00 . A A . 2 ILE HD13 1 1 19 14149 1 1 2 ILE HG12 H -0.684 -5.212 2.289 1.00 . A A . 2 ILE HG12 1 1 19 14150 1 1 2 ILE HG13 H 0.329 -4.596 3.583 1.00 . A A . 2 ILE HG13 1 1 19 14151 1 1 2 ILE HG21 H 0.639 -3.458 -0.484 1.00 . A A . 2 ILE HG21 1 1 19 14152 1 1 2 ILE HG22 H 0.170 -5.023 0.124 1.00 . A A . 2 ILE HG22 1 1 19 14153 1 1 2 ILE HG23 H -0.962 -3.686 0.191 1.00 . A A . 2 ILE HG23 1 1 19 14154 1 1 2 ILE N N 2.931 -2.579 1.487 1.00 . A A . 2 ILE N 1 1 19 14155 1 1 2 ILE O O 2.863 -5.443 0.129 1.00 . A A . 2 ILE O 1 1 19 14156 1 1 3 VAL C C 3.521 -8.179 1.032 1.00 . A A . 3 VAL C 1 1 19 14157 1 1 3 VAL CA C 2.453 -7.629 2.005 1.00 . A A . 3 VAL CA 1 1 19 14158 1 1 3 VAL CB C 1.004 -8.164 1.734 1.00 . A A . 3 VAL CB 1 1 19 14159 1 1 3 VAL CG1 C 0.604 -8.022 0.273 1.00 . A A . 3 VAL CG1 1 1 19 14160 1 1 3 VAL CG2 C 0.819 -9.600 2.253 1.00 . A A . 3 VAL CG2 1 1 19 14161 1 1 3 VAL H H 1.929 -5.816 3.008 1.00 . A A . 3 VAL H 1 1 19 14162 1 1 3 VAL HA H 2.881 -7.933 2.927 1.00 . A A . 3 VAL HA 1 1 19 14163 1 1 3 VAL HB H 0.320 -7.543 2.302 1.00 . A A . 3 VAL HB 1 1 19 14164 1 1 3 VAL HG11 H 0.647 -6.987 -0.020 1.00 . A A . 3 VAL HG11 1 1 19 14165 1 1 3 VAL HG12 H 1.274 -8.566 -0.372 1.00 . A A . 3 VAL HG12 1 1 19 14166 1 1 3 VAL HG13 H -0.396 -8.384 0.116 1.00 . A A . 3 VAL HG13 1 1 19 14167 1 1 3 VAL HG21 H 1.521 -10.291 1.816 1.00 . A A . 3 VAL HG21 1 1 19 14168 1 1 3 VAL HG22 H 0.962 -9.628 3.324 1.00 . A A . 3 VAL HG22 1 1 19 14169 1 1 3 VAL HG23 H -0.179 -9.950 2.042 1.00 . A A . 3 VAL HG23 1 1 19 14170 1 1 3 VAL N N 2.261 -6.146 2.149 1.00 . A A . 3 VAL N 1 1 19 14171 1 1 3 VAL O O 4.495 -7.473 0.854 1.00 . A A . 3 VAL O 1 1 19 14172 1 1 4 GLU C C 4.805 -8.973 -1.778 1.00 . A A . 4 GLU C 1 1 19 14173 1 1 4 GLU CA C 4.524 -9.783 -0.495 1.00 . A A . 4 GLU CA 1 1 19 14174 1 1 4 GLU CB C 4.224 -11.280 -0.826 1.00 . A A . 4 GLU CB 1 1 19 14175 1 1 4 GLU CD C 1.723 -10.859 -1.434 1.00 . A A . 4 GLU CD 1 1 19 14176 1 1 4 GLU CG C 3.037 -11.450 -1.858 1.00 . A A . 4 GLU CG 1 1 19 14177 1 1 4 GLU H H 2.622 -9.901 0.522 1.00 . A A . 4 GLU H 1 1 19 14178 1 1 4 GLU HA H 5.439 -9.659 0.074 1.00 . A A . 4 GLU HA 1 1 19 14179 1 1 4 GLU HB2 H 5.119 -11.719 -1.243 1.00 . A A . 4 GLU HB2 1 1 19 14180 1 1 4 GLU HB3 H 3.987 -11.811 0.087 1.00 . A A . 4 GLU HB3 1 1 19 14181 1 1 4 GLU HG2 H 3.310 -10.991 -2.797 1.00 . A A . 4 GLU HG2 1 1 19 14182 1 1 4 GLU HG3 H 2.860 -12.495 -2.046 1.00 . A A . 4 GLU HG3 1 1 19 14183 1 1 4 GLU N N 3.411 -9.327 0.419 1.00 . A A . 4 GLU N 1 1 19 14184 1 1 4 GLU O O 5.433 -9.393 -2.732 1.00 . A A . 4 GLU O 1 1 19 14185 1 1 4 GLU OE1 O 1.258 -11.185 -0.359 1.00 . A A . 4 GLU OE1 1 1 19 14186 1 1 4 GLU OE2 O 1.171 -10.086 -2.189 1.00 . A A . 4 GLU OE2 1 1 19 14187 1 1 5 GLN C C 5.299 -5.662 -2.211 1.00 . A A . 5 GLN C 1 1 19 14188 1 1 5 GLN CA C 4.465 -6.801 -2.827 1.00 . A A . 5 GLN CA 1 1 19 14189 1 1 5 GLN CB C 3.044 -6.400 -3.254 1.00 . A A . 5 GLN CB 1 1 19 14190 1 1 5 GLN CD C 2.082 -5.944 -5.570 1.00 . A A . 5 GLN CD 1 1 19 14191 1 1 5 GLN CG C 3.143 -5.540 -4.558 1.00 . A A . 5 GLN CG 1 1 19 14192 1 1 5 GLN H H 3.816 -7.518 -0.943 1.00 . A A . 5 GLN H 1 1 19 14193 1 1 5 GLN HA H 5.059 -7.209 -3.641 1.00 . A A . 5 GLN HA 1 1 19 14194 1 1 5 GLN HB2 H 2.475 -7.308 -3.429 1.00 . A A . 5 GLN HB2 1 1 19 14195 1 1 5 GLN HB3 H 2.565 -5.843 -2.461 1.00 . A A . 5 GLN HB3 1 1 19 14196 1 1 5 GLN HE21 H 1.109 -4.284 -5.383 1.00 . A A . 5 GLN HE21 1 1 19 14197 1 1 5 GLN HE22 H 0.475 -5.399 -6.513 1.00 . A A . 5 GLN HE22 1 1 19 14198 1 1 5 GLN HG2 H 2.996 -4.497 -4.331 1.00 . A A . 5 GLN HG2 1 1 19 14199 1 1 5 GLN HG3 H 4.100 -5.656 -5.043 1.00 . A A . 5 GLN HG3 1 1 19 14200 1 1 5 GLN N N 4.315 -7.778 -1.733 1.00 . A A . 5 GLN N 1 1 19 14201 1 1 5 GLN NE2 N 1.136 -5.137 -5.847 1.00 . A A . 5 GLN NE2 1 1 19 14202 1 1 5 GLN O O 6.065 -5.057 -2.929 1.00 . A A . 5 GLN O 1 1 19 14203 1 1 5 GLN OE1 O 2.071 -7.005 -6.142 1.00 . A A . 5 GLN OE1 1 1 19 14204 1 1 6 CYS C C 6.603 -4.545 1.009 1.00 . A A . 6 CYS C 1 1 19 14205 1 1 6 CYS CA C 6.019 -4.253 -0.385 1.00 . A A . 6 CYS CA 1 1 19 14206 1 1 6 CYS CB C 5.153 -3.030 -0.367 1.00 . A A . 6 CYS CB 1 1 19 14207 1 1 6 CYS H H 4.540 -5.839 -0.306 1.00 . A A . 6 CYS H 1 1 19 14208 1 1 6 CYS HA H 6.856 -4.055 -1.037 1.00 . A A . 6 CYS HA 1 1 19 14209 1 1 6 CYS HB2 H 4.138 -3.290 -0.636 1.00 . A A . 6 CYS HB2 1 1 19 14210 1 1 6 CYS HB3 H 5.161 -2.657 0.636 1.00 . A A . 6 CYS HB3 1 1 19 14211 1 1 6 CYS HG H 6.558 -1.446 -1.175 1.00 . A A . 6 CYS HG 1 1 19 14212 1 1 6 CYS N N 5.172 -5.366 -0.931 1.00 . A A . 6 CYS N 1 1 19 14213 1 1 6 CYS O O 7.627 -4.050 1.429 1.00 . A A . 6 CYS O 1 1 19 14214 1 1 6 CYS SG S 5.676 -1.690 -1.461 1.00 . A A . 6 CYS SG 1 1 19 14215 1 1 7 CYS C C 6.626 -7.321 2.987 1.00 . A A . 7 CYS C 1 1 19 14216 1 1 7 CYS CA C 6.281 -5.817 3.077 1.00 . A A . 7 CYS CA 1 1 19 14217 1 1 7 CYS CB C 5.044 -5.455 3.903 1.00 . A A . 7 CYS CB 1 1 19 14218 1 1 7 CYS H H 5.131 -5.808 1.282 1.00 . A A . 7 CYS H 1 1 19 14219 1 1 7 CYS HA H 7.155 -5.279 3.426 1.00 . A A . 7 CYS HA 1 1 19 14220 1 1 7 CYS HB2 H 4.949 -4.374 3.857 1.00 . A A . 7 CYS HB2 1 1 19 14221 1 1 7 CYS HB3 H 4.179 -5.860 3.409 1.00 . A A . 7 CYS HB3 1 1 19 14222 1 1 7 CYS HG H 4.715 -6.876 5.678 1.00 . A A . 7 CYS HG 1 1 19 14223 1 1 7 CYS N N 5.913 -5.396 1.697 1.00 . A A . 7 CYS N 1 1 19 14224 1 1 7 CYS O O 6.132 -8.175 3.692 1.00 . A A . 7 CYS O 1 1 19 14225 1 1 7 CYS SG S 5.012 -5.964 5.639 1.00 . A A . 7 CYS SG 1 1 19 14226 1 1 8 THR C C 8.153 -8.680 -0.024 1.00 . A A . 8 THR C 1 1 19 14227 1 1 8 THR CA C 8.176 -8.743 1.517 1.00 . A A . 8 THR CA 1 1 19 14228 1 1 8 THR CB C 7.426 -10.013 2.012 1.00 . A A . 8 THR CB 1 1 19 14229 1 1 8 THR CG2 C 8.051 -11.302 1.552 1.00 . A A . 8 THR CG2 1 1 19 14230 1 1 8 THR H H 7.704 -6.634 1.594 1.00 . A A . 8 THR H 1 1 19 14231 1 1 8 THR HA H 9.201 -8.779 1.850 1.00 . A A . 8 THR HA 1 1 19 14232 1 1 8 THR HB H 6.345 -9.976 1.932 1.00 . A A . 8 THR HB 1 1 19 14233 1 1 8 THR HG1 H 7.137 -9.695 3.890 1.00 . A A . 8 THR HG1 1 1 19 14234 1 1 8 THR HG21 H 9.066 -11.364 1.911 1.00 . A A . 8 THR HG21 1 1 19 14235 1 1 8 THR HG22 H 7.484 -12.118 1.970 1.00 . A A . 8 THR HG22 1 1 19 14236 1 1 8 THR HG23 H 8.042 -11.383 0.477 1.00 . A A . 8 THR HG23 1 1 19 14237 1 1 8 THR N N 7.498 -7.480 2.030 1.00 . A A . 8 THR N 1 1 19 14238 1 1 8 THR O O 7.580 -9.494 -0.708 1.00 . A A . 8 THR O 1 1 19 14239 1 1 8 THR OG1 O 7.844 -10.087 3.359 1.00 . A A . 8 THR OG1 1 1 19 14240 1 1 9 SER C C 8.856 -5.725 -2.059 1.00 . A A . 9 SER C 1 1 19 14241 1 1 9 SER CA C 9.004 -7.272 -1.973 1.00 . A A . 9 SER CA 1 1 19 14242 1 1 9 SER CB C 7.930 -7.929 -2.888 1.00 . A A . 9 SER CB 1 1 19 14243 1 1 9 SER H H 9.242 -7.071 0.151 1.00 . A A . 9 SER H 1 1 19 14244 1 1 9 SER HA H 9.992 -7.535 -2.316 1.00 . A A . 9 SER HA 1 1 19 14245 1 1 9 SER HB2 H 7.980 -9.011 -2.873 1.00 . A A . 9 SER HB2 1 1 19 14246 1 1 9 SER HB3 H 6.941 -7.616 -2.597 1.00 . A A . 9 SER HB3 1 1 19 14247 1 1 9 SER HG H 7.430 -7.289 -4.671 1.00 . A A . 9 SER HG 1 1 19 14248 1 1 9 SER N N 8.817 -7.660 -0.506 1.00 . A A . 9 SER N 1 1 19 14249 1 1 9 SER O O 8.814 -5.111 -1.010 1.00 . A A . 9 SER O 1 1 19 14250 1 1 9 SER OG O 8.260 -7.464 -4.199 1.00 . A A . 9 SER OG 1 1 19 14251 1 1 10 ILE C C 7.582 -3.207 -4.392 1.00 . A A . 10 ILE C 1 1 19 14252 1 1 10 ILE CA C 8.651 -3.660 -3.406 1.00 . A A . 10 ILE CA 1 1 19 14253 1 1 10 ILE CB C 10.016 -3.035 -3.883 1.00 . A A . 10 ILE CB 1 1 19 14254 1 1 10 ILE CD1 C 12.335 -2.414 -3.013 1.00 . A A . 10 ILE CD1 1 1 19 14255 1 1 10 ILE CG1 C 10.905 -2.893 -2.646 1.00 . A A . 10 ILE CG1 1 1 19 14256 1 1 10 ILE CG2 C 9.792 -1.610 -4.545 1.00 . A A . 10 ILE CG2 1 1 19 14257 1 1 10 ILE H H 8.805 -5.678 -4.018 1.00 . A A . 10 ILE H 1 1 19 14258 1 1 10 ILE HA H 8.464 -3.210 -2.441 1.00 . A A . 10 ILE HA 1 1 19 14259 1 1 10 ILE HB H 10.483 -3.708 -4.591 1.00 . A A . 10 ILE HB 1 1 19 14260 1 1 10 ILE HD11 H 12.812 -3.111 -3.688 1.00 . A A . 10 ILE HD11 1 1 19 14261 1 1 10 ILE HD12 H 12.318 -1.439 -3.475 1.00 . A A . 10 ILE HD12 1 1 19 14262 1 1 10 ILE HD13 H 12.934 -2.343 -2.117 1.00 . A A . 10 ILE HD13 1 1 19 14263 1 1 10 ILE HG12 H 10.432 -2.202 -1.961 1.00 . A A . 10 ILE HG12 1 1 19 14264 1 1 10 ILE HG13 H 10.945 -3.851 -2.153 1.00 . A A . 10 ILE HG13 1 1 19 14265 1 1 10 ILE HG21 H 9.304 -0.932 -3.856 1.00 . A A . 10 ILE HG21 1 1 19 14266 1 1 10 ILE HG22 H 10.723 -1.167 -4.857 1.00 . A A . 10 ILE HG22 1 1 19 14267 1 1 10 ILE HG23 H 9.169 -1.689 -5.427 1.00 . A A . 10 ILE HG23 1 1 19 14268 1 1 10 ILE N N 8.786 -5.138 -3.220 1.00 . A A . 10 ILE N 1 1 19 14269 1 1 10 ILE O O 7.363 -3.716 -5.474 1.00 . A A . 10 ILE O 1 1 19 14270 1 1 11 CYS C C 6.001 0.041 -4.500 1.00 . A A . 11 CYS C 1 1 19 14271 1 1 11 CYS CA C 5.873 -1.513 -4.635 1.00 . A A . 11 CYS CA 1 1 19 14272 1 1 11 CYS CB C 4.539 -2.048 -4.064 1.00 . A A . 11 CYS CB 1 1 19 14273 1 1 11 CYS H H 7.248 -1.929 -3.041 1.00 . A A . 11 CYS H 1 1 19 14274 1 1 11 CYS HA H 5.951 -1.756 -5.687 1.00 . A A . 11 CYS HA 1 1 19 14275 1 1 11 CYS HB2 H 3.755 -2.010 -4.804 1.00 . A A . 11 CYS HB2 1 1 19 14276 1 1 11 CYS HB3 H 4.696 -3.094 -3.831 1.00 . A A . 11 CYS HB3 1 1 19 14277 1 1 11 CYS HG H 3.318 -0.581 -2.792 1.00 . A A . 11 CYS HG 1 1 19 14278 1 1 11 CYS N N 6.954 -2.196 -3.916 1.00 . A A . 11 CYS N 1 1 19 14279 1 1 11 CYS O O 6.827 0.649 -3.843 1.00 . A A . 11 CYS O 1 1 19 14280 1 1 11 CYS SG S 3.907 -1.299 -2.548 1.00 . A A . 11 CYS SG 1 1 19 14281 1 1 12 SER C C 3.503 2.677 -4.865 1.00 . A A . 12 SER C 1 1 19 14282 1 1 12 SER CA C 4.814 2.069 -5.387 1.00 . A A . 12 SER CA 1 1 19 14283 1 1 12 SER CB C 4.929 2.362 -6.882 1.00 . A A . 12 SER CB 1 1 19 14284 1 1 12 SER H H 4.576 -0.137 -5.613 1.00 . A A . 12 SER H 1 1 19 14285 1 1 12 SER HA H 5.556 2.640 -4.896 1.00 . A A . 12 SER HA 1 1 19 14286 1 1 12 SER HB2 H 5.912 2.121 -7.266 1.00 . A A . 12 SER HB2 1 1 19 14287 1 1 12 SER HB3 H 4.173 1.835 -7.452 1.00 . A A . 12 SER HB3 1 1 19 14288 1 1 12 SER HG H 5.311 4.218 -7.511 1.00 . A A . 12 SER HG 1 1 19 14289 1 1 12 SER N N 5.078 0.581 -5.208 1.00 . A A . 12 SER N 1 1 19 14290 1 1 12 SER O O 2.569 1.968 -4.578 1.00 . A A . 12 SER O 1 1 19 14291 1 1 12 SER OG O 4.688 3.759 -6.930 1.00 . A A . 12 SER OG 1 1 19 14292 1 1 13 LEU C C 1.083 4.288 -5.202 1.00 . A A . 13 LEU C 1 1 19 14293 1 1 13 LEU CA C 2.224 4.701 -4.281 1.00 . A A . 13 LEU CA 1 1 19 14294 1 1 13 LEU CB C 2.547 6.221 -4.341 1.00 . A A . 13 LEU CB 1 1 19 14295 1 1 13 LEU CD1 C 0.884 6.801 -2.558 1.00 . A A . 13 LEU CD1 1 1 19 14296 1 1 13 LEU CD2 C 1.766 8.545 -4.055 1.00 . A A . 13 LEU CD2 1 1 19 14297 1 1 13 LEU CG C 1.328 7.085 -3.990 1.00 . A A . 13 LEU CG 1 1 19 14298 1 1 13 LEU H H 4.260 4.461 -5.047 1.00 . A A . 13 LEU H 1 1 19 14299 1 1 13 LEU HA H 1.923 4.337 -3.306 1.00 . A A . 13 LEU HA 1 1 19 14300 1 1 13 LEU HB2 H 3.340 6.446 -3.649 1.00 . A A . 13 LEU HB2 1 1 19 14301 1 1 13 LEU HB3 H 2.882 6.479 -5.337 1.00 . A A . 13 LEU HB3 1 1 19 14302 1 1 13 LEU HD11 H 1.680 6.993 -1.855 1.00 . A A . 13 LEU HD11 1 1 19 14303 1 1 13 LEU HD12 H 0.037 7.426 -2.314 1.00 . A A . 13 LEU HD12 1 1 19 14304 1 1 13 LEU HD13 H 0.572 5.772 -2.467 1.00 . A A . 13 LEU HD13 1 1 19 14305 1 1 13 LEU HD21 H 2.559 8.747 -3.351 1.00 . A A . 13 LEU HD21 1 1 19 14306 1 1 13 LEU HD22 H 2.108 8.783 -5.053 1.00 . A A . 13 LEU HD22 1 1 19 14307 1 1 13 LEU HD23 H 0.921 9.181 -3.828 1.00 . A A . 13 LEU HD23 1 1 19 14308 1 1 13 LEU HG H 0.501 6.906 -4.679 1.00 . A A . 13 LEU HG 1 1 19 14309 1 1 13 LEU N N 3.452 3.978 -4.771 1.00 . A A . 13 LEU N 1 1 19 14310 1 1 13 LEU O O 0.087 3.762 -4.751 1.00 . A A . 13 LEU O 1 1 19 14311 1 1 14 TYR C C -0.092 2.617 -7.241 1.00 . A A . 14 TYR C 1 1 19 14312 1 1 14 TYR CA C 0.194 4.110 -7.447 1.00 . A A . 14 TYR CA 1 1 19 14313 1 1 14 TYR CB C 0.623 4.390 -8.938 1.00 . A A . 14 TYR CB 1 1 19 14314 1 1 14 TYR CD1 C 2.622 5.829 -8.607 1.00 . A A . 14 TYR CD1 1 1 19 14315 1 1 14 TYR CD2 C 2.939 3.712 -9.640 1.00 . A A . 14 TYR CD2 1 1 19 14316 1 1 14 TYR CE1 C 3.968 6.077 -8.696 1.00 . A A . 14 TYR CE1 1 1 19 14317 1 1 14 TYR CE2 C 4.290 3.964 -9.728 1.00 . A A . 14 TYR CE2 1 1 19 14318 1 1 14 TYR CG C 2.108 4.646 -9.076 1.00 . A A . 14 TYR CG 1 1 19 14319 1 1 14 TYR CZ C 4.803 5.146 -9.254 1.00 . A A . 14 TYR CZ 1 1 19 14320 1 1 14 TYR H H 2.135 4.892 -6.736 1.00 . A A . 14 TYR H 1 1 19 14321 1 1 14 TYR HA H -0.710 4.643 -7.213 1.00 . A A . 14 TYR HA 1 1 19 14322 1 1 14 TYR HB2 H 0.326 3.573 -9.578 1.00 . A A . 14 TYR HB2 1 1 19 14323 1 1 14 TYR HB3 H 0.088 5.272 -9.263 1.00 . A A . 14 TYR HB3 1 1 19 14324 1 1 14 TYR HD1 H 1.953 6.561 -8.169 1.00 . A A . 14 TYR HD1 1 1 19 14325 1 1 14 TYR HD2 H 2.527 2.786 -10.013 1.00 . A A . 14 TYR HD2 1 1 19 14326 1 1 14 TYR HE1 H 4.359 7.007 -8.321 1.00 . A A . 14 TYR HE1 1 1 19 14327 1 1 14 TYR HE2 H 4.942 3.227 -10.167 1.00 . A A . 14 TYR HE2 1 1 19 14328 1 1 14 TYR HH H 6.335 5.537 -10.245 1.00 . A A . 14 TYR HH 1 1 19 14329 1 1 14 TYR N N 1.279 4.501 -6.474 1.00 . A A . 14 TYR N 1 1 19 14330 1 1 14 TYR O O -1.092 2.085 -7.684 1.00 . A A . 14 TYR O 1 1 19 14331 1 1 14 TYR OH O 6.152 5.384 -9.310 1.00 . A A . 14 TYR OH 1 1 19 14332 1 1 15 GLN C C -0.326 0.413 -5.062 1.00 . A A . 15 GLN C 1 1 19 14333 1 1 15 GLN CA C 0.524 0.491 -6.350 1.00 . A A . 15 GLN CA 1 1 19 14334 1 1 15 GLN CB C 1.884 -0.263 -6.294 1.00 . A A . 15 GLN CB 1 1 19 14335 1 1 15 GLN CD C 0.922 -2.001 -7.863 1.00 . A A . 15 GLN CD 1 1 19 14336 1 1 15 GLN CG C 2.079 -1.036 -7.659 1.00 . A A . 15 GLN CG 1 1 19 14337 1 1 15 GLN H H 1.642 2.357 -6.241 1.00 . A A . 15 GLN H 1 1 19 14338 1 1 15 GLN HA H -0.122 0.176 -7.115 1.00 . A A . 15 GLN HA 1 1 19 14339 1 1 15 GLN HB2 H 2.686 0.432 -6.172 1.00 . A A . 15 GLN HB2 1 1 19 14340 1 1 15 GLN HB3 H 1.873 -0.946 -5.460 1.00 . A A . 15 GLN HB3 1 1 19 14341 1 1 15 GLN HE21 H 0.434 -1.454 -9.703 1.00 . A A . 15 GLN HE21 1 1 19 14342 1 1 15 GLN HE22 H -0.499 -2.673 -8.960 1.00 . A A . 15 GLN HE22 1 1 19 14343 1 1 15 GLN HG2 H 2.097 -0.358 -8.498 1.00 . A A . 15 GLN HG2 1 1 19 14344 1 1 15 GLN HG3 H 2.982 -1.626 -7.655 1.00 . A A . 15 GLN HG3 1 1 19 14345 1 1 15 GLN N N 0.812 1.930 -6.572 1.00 . A A . 15 GLN N 1 1 19 14346 1 1 15 GLN NE2 N 0.240 -2.029 -8.945 1.00 . A A . 15 GLN NE2 1 1 19 14347 1 1 15 GLN O O -1.250 -0.361 -4.988 1.00 . A A . 15 GLN O 1 1 19 14348 1 1 15 GLN OE1 O 0.613 -2.770 -6.992 1.00 . A A . 15 GLN OE1 1 1 19 14349 1 1 16 LEU C C -2.301 1.324 -3.215 1.00 . A A . 16 LEU C 1 1 19 14350 1 1 16 LEU CA C -0.808 1.211 -2.789 1.00 . A A . 16 LEU CA 1 1 19 14351 1 1 16 LEU CB C -0.403 2.446 -1.901 1.00 . A A . 16 LEU CB 1 1 19 14352 1 1 16 LEU CD1 C 0.212 1.182 0.212 1.00 . A A . 16 LEU CD1 1 1 19 14353 1 1 16 LEU CD2 C 1.888 1.452 -1.554 1.00 . A A . 16 LEU CD2 1 1 19 14354 1 1 16 LEU CG C 0.720 2.144 -0.872 1.00 . A A . 16 LEU CG 1 1 19 14355 1 1 16 LEU H H 0.756 1.734 -4.249 1.00 . A A . 16 LEU H 1 1 19 14356 1 1 16 LEU HA H -0.635 0.286 -2.298 1.00 . A A . 16 LEU HA 1 1 19 14357 1 1 16 LEU HB2 H -0.083 3.252 -2.543 1.00 . A A . 16 LEU HB2 1 1 19 14358 1 1 16 LEU HB3 H -1.273 2.804 -1.365 1.00 . A A . 16 LEU HB3 1 1 19 14359 1 1 16 LEU HD11 H -0.621 1.600 0.754 1.00 . A A . 16 LEU HD11 1 1 19 14360 1 1 16 LEU HD12 H -0.089 0.235 -0.210 1.00 . A A . 16 LEU HD12 1 1 19 14361 1 1 16 LEU HD13 H 1.005 0.979 0.915 1.00 . A A . 16 LEU HD13 1 1 19 14362 1 1 16 LEU HD21 H 2.253 2.063 -2.359 1.00 . A A . 16 LEU HD21 1 1 19 14363 1 1 16 LEU HD22 H 2.699 1.322 -0.861 1.00 . A A . 16 LEU HD22 1 1 19 14364 1 1 16 LEU HD23 H 1.614 0.482 -1.946 1.00 . A A . 16 LEU HD23 1 1 19 14365 1 1 16 LEU HG H 1.054 3.066 -0.410 1.00 . A A . 16 LEU HG 1 1 19 14366 1 1 16 LEU N N -0.017 1.191 -4.076 1.00 . A A . 16 LEU N 1 1 19 14367 1 1 16 LEU O O -3.201 0.654 -2.742 1.00 . A A . 16 LEU O 1 1 19 14368 1 1 17 GLU C C -4.586 1.242 -5.219 1.00 . A A . 17 GLU C 1 1 19 14369 1 1 17 GLU CA C -3.842 2.533 -4.742 1.00 . A A . 17 GLU CA 1 1 19 14370 1 1 17 GLU CB C -3.596 3.511 -5.920 1.00 . A A . 17 GLU CB 1 1 19 14371 1 1 17 GLU CD C -2.483 5.858 -6.346 1.00 . A A . 17 GLU CD 1 1 19 14372 1 1 17 GLU CG C -2.869 4.774 -5.353 1.00 . A A . 17 GLU CG 1 1 19 14373 1 1 17 GLU H H -1.669 2.728 -4.416 1.00 . A A . 17 GLU H 1 1 19 14374 1 1 17 GLU HA H -4.471 3.003 -4.001 1.00 . A A . 17 GLU HA 1 1 19 14375 1 1 17 GLU HB2 H -2.993 3.057 -6.694 1.00 . A A . 17 GLU HB2 1 1 19 14376 1 1 17 GLU HB3 H -4.535 3.816 -6.366 1.00 . A A . 17 GLU HB3 1 1 19 14377 1 1 17 GLU HG2 H -3.515 5.256 -4.655 1.00 . A A . 17 GLU HG2 1 1 19 14378 1 1 17 GLU HG3 H -1.970 4.494 -4.842 1.00 . A A . 17 GLU HG3 1 1 19 14379 1 1 17 GLU N N -2.482 2.230 -4.134 1.00 . A A . 17 GLU N 1 1 19 14380 1 1 17 GLU O O -5.794 1.110 -5.219 1.00 . A A . 17 GLU O 1 1 19 14381 1 1 17 GLU OE1 O -2.865 5.774 -7.499 1.00 . A A . 17 GLU OE1 1 1 19 14382 1 1 17 GLU OE2 O -1.791 6.726 -5.847 1.00 . A A . 17 GLU OE2 1 1 19 14383 1 1 18 ASN C C -4.739 -1.991 -4.982 1.00 . A A . 18 ASN C 1 1 19 14384 1 1 18 ASN CA C -4.250 -1.047 -6.131 1.00 . A A . 18 ASN CA 1 1 19 14385 1 1 18 ASN CB C -3.006 -1.572 -6.924 1.00 . A A . 18 ASN CB 1 1 19 14386 1 1 18 ASN CG C -3.127 -2.860 -7.690 1.00 . A A . 18 ASN CG 1 1 19 14387 1 1 18 ASN H H -2.834 0.500 -5.577 1.00 . A A . 18 ASN H 1 1 19 14388 1 1 18 ASN HA H -5.089 -0.896 -6.796 1.00 . A A . 18 ASN HA 1 1 19 14389 1 1 18 ASN HB2 H -2.670 -0.817 -7.617 1.00 . A A . 18 ASN HB2 1 1 19 14390 1 1 18 ASN HB3 H -2.205 -1.764 -6.240 1.00 . A A . 18 ASN HB3 1 1 19 14391 1 1 18 ASN HD21 H -4.929 -3.374 -7.079 1.00 . A A . 18 ASN HD21 1 1 19 14392 1 1 18 ASN HD22 H -4.161 -4.419 -8.183 1.00 . A A . 18 ASN HD22 1 1 19 14393 1 1 18 ASN N N -3.790 0.293 -5.622 1.00 . A A . 18 ASN N 1 1 19 14394 1 1 18 ASN ND2 N -4.166 -3.610 -7.641 1.00 . A A . 18 ASN ND2 1 1 19 14395 1 1 18 ASN O O -5.293 -3.043 -5.240 1.00 . A A . 18 ASN O 1 1 19 14396 1 1 18 ASN OD1 O -2.207 -3.222 -8.384 1.00 . A A . 18 ASN OD1 1 1 19 14397 1 1 19 TYR C C -6.019 -1.608 -1.763 1.00 . A A . 19 TYR C 1 1 19 14398 1 1 19 TYR CA C -4.927 -2.384 -2.532 1.00 . A A . 19 TYR CA 1 1 19 14399 1 1 19 TYR CB C -3.706 -2.576 -1.572 1.00 . A A . 19 TYR CB 1 1 19 14400 1 1 19 TYR CD1 C -2.283 -3.247 -3.544 1.00 . A A . 19 TYR CD1 1 1 19 14401 1 1 19 TYR CD2 C -1.261 -2.039 -1.781 1.00 . A A . 19 TYR CD2 1 1 19 14402 1 1 19 TYR CE1 C -1.087 -3.276 -4.223 1.00 . A A . 19 TYR CE1 1 1 19 14403 1 1 19 TYR CE2 C -0.065 -2.074 -2.467 1.00 . A A . 19 TYR CE2 1 1 19 14404 1 1 19 TYR CG C -2.380 -2.629 -2.323 1.00 . A A . 19 TYR CG 1 1 19 14405 1 1 19 TYR CZ C 0.021 -2.688 -3.679 1.00 . A A . 19 TYR CZ 1 1 19 14406 1 1 19 TYR H H -4.053 -0.739 -3.649 1.00 . A A . 19 TYR H 1 1 19 14407 1 1 19 TYR HA H -5.362 -3.331 -2.821 1.00 . A A . 19 TYR HA 1 1 19 14408 1 1 19 TYR HB2 H -3.659 -1.764 -0.861 1.00 . A A . 19 TYR HB2 1 1 19 14409 1 1 19 TYR HB3 H -3.818 -3.501 -1.025 1.00 . A A . 19 TYR HB3 1 1 19 14410 1 1 19 TYR HD1 H -3.162 -3.713 -3.959 1.00 . A A . 19 TYR HD1 1 1 19 14411 1 1 19 TYR HD2 H -1.311 -1.546 -0.815 1.00 . A A . 19 TYR HD2 1 1 19 14412 1 1 19 TYR HE1 H -1.021 -3.748 -5.189 1.00 . A A . 19 TYR HE1 1 1 19 14413 1 1 19 TYR HE2 H 0.818 -1.607 -2.060 1.00 . A A . 19 TYR HE2 1 1 19 14414 1 1 19 TYR HH H 0.922 -2.635 -5.264 1.00 . A A . 19 TYR HH 1 1 19 14415 1 1 19 TYR N N -4.517 -1.593 -3.760 1.00 . A A . 19 TYR N 1 1 19 14416 1 1 19 TYR O O -6.983 -2.141 -1.260 1.00 . A A . 19 TYR O 1 1 19 14417 1 1 19 TYR OH O 1.212 -2.725 -4.352 1.00 . A A . 19 TYR OH 1 1 19 14418 1 1 20 CYS C C -7.353 1.694 -1.869 1.00 . A A . 20 CYS C 1 1 19 14419 1 1 20 CYS CA C -6.728 0.579 -0.979 1.00 . A A . 20 CYS CA 1 1 19 14420 1 1 20 CYS CB C -5.898 1.083 0.183 1.00 . A A . 20 CYS CB 1 1 19 14421 1 1 20 CYS H H -4.990 0.029 -2.080 1.00 . A A . 20 CYS H 1 1 19 14422 1 1 20 CYS HA H -7.520 0.026 -0.525 1.00 . A A . 20 CYS HA 1 1 19 14423 1 1 20 CYS HB2 H -5.293 0.247 0.493 1.00 . A A . 20 CYS HB2 1 1 19 14424 1 1 20 CYS HB3 H -5.242 1.868 -0.157 1.00 . A A . 20 CYS HB3 1 1 19 14425 1 1 20 CYS HG H -6.947 0.928 2.230 1.00 . A A . 20 CYS HG 1 1 19 14426 1 1 20 CYS N N -5.796 -0.333 -1.680 1.00 . A A . 20 CYS N 1 1 19 14427 1 1 20 CYS O O -6.706 2.601 -2.354 1.00 . A A . 20 CYS O 1 1 19 14428 1 1 20 CYS SG S -6.805 1.671 1.637 1.00 . A A . 20 CYS SG 1 1 19 14429 1 1 21 ASN C C -10.575 3.233 -2.023 1.00 . A A . 21 ASN C 1 1 19 14430 1 1 21 ASN CA C -9.469 2.504 -2.856 1.00 . A A . 21 ASN CA 1 1 19 14431 1 1 21 ASN CB C -10.060 1.651 -4.021 1.00 . A A . 21 ASN CB 1 1 19 14432 1 1 21 ASN CG C -10.978 0.559 -3.508 1.00 . A A . 21 ASN CG 1 1 19 14433 1 1 21 ASN H H -9.024 0.782 -1.583 1.00 . A A . 21 ASN H 1 1 19 14434 1 1 21 ASN HA H -8.825 3.271 -3.272 1.00 . A A . 21 ASN HA 1 1 19 14435 1 1 21 ASN HB2 H -10.610 2.263 -4.716 1.00 . A A . 21 ASN HB2 1 1 19 14436 1 1 21 ASN HB3 H -9.252 1.163 -4.543 1.00 . A A . 21 ASN HB3 1 1 19 14437 1 1 21 ASN HD21 H -12.570 1.188 -4.483 1.00 . A A . 21 ASN HD21 1 1 19 14438 1 1 21 ASN HD22 H -12.746 -0.213 -3.526 1.00 . A A . 21 ASN HD22 1 1 19 14439 1 1 21 ASN N N -8.634 1.557 -2.037 1.00 . A A . 21 ASN N 1 1 19 14440 1 1 21 ASN ND2 N -12.206 0.518 -3.880 1.00 . A A . 21 ASN ND2 1 1 19 14441 1 1 21 ASN O O -11.749 2.900 -1.991 1.00 . A A . 21 ASN O 1 1 19 14442 1 1 21 ASN OD1 O -10.617 -0.304 -2.747 1.00 . A A . 21 ASN OD1 1 1 19 14443 2 2 1 PHE C C 7.115 5.648 -5.708 1.00 . B B . 1 PHE C 1 1 19 14444 2 2 1 PHE CA C 7.158 7.160 -6.050 1.00 . B B . 1 PHE CA 1 1 19 14445 2 2 1 PHE CB C 6.401 7.969 -4.960 1.00 . B B . 1 PHE CB 1 1 19 14446 2 2 1 PHE CD1 C 8.209 7.139 -3.306 1.00 . B B . 1 PHE CD1 1 1 19 14447 2 2 1 PHE CD2 C 6.214 8.095 -2.449 1.00 . B B . 1 PHE CD2 1 1 19 14448 2 2 1 PHE CE1 C 8.672 6.938 -2.024 1.00 . B B . 1 PHE CE1 1 1 19 14449 2 2 1 PHE CE2 C 6.675 7.896 -1.163 1.00 . B B . 1 PHE CE2 1 1 19 14450 2 2 1 PHE CG C 6.970 7.721 -3.540 1.00 . B B . 1 PHE CG 1 1 19 14451 2 2 1 PHE CZ C 7.904 7.316 -0.950 1.00 . B B . 1 PHE CZ 1 1 19 14452 2 2 1 PHE HA H 8.191 7.473 -6.069 1.00 . B B . 1 PHE HA 1 1 19 14453 2 2 1 PHE HB2 H 6.468 9.026 -5.176 1.00 . B B . 1 PHE HB2 1 1 19 14454 2 2 1 PHE HB3 H 5.359 7.684 -4.969 1.00 . B B . 1 PHE HB3 1 1 19 14455 2 2 1 PHE HD1 H 8.837 6.836 -4.127 1.00 . B B . 1 PHE HD1 1 1 19 14456 2 2 1 PHE HD2 H 5.248 8.554 -2.601 1.00 . B B . 1 PHE HD2 1 1 19 14457 2 2 1 PHE HE1 H 9.641 6.482 -1.858 1.00 . B B . 1 PHE HE1 1 1 19 14458 2 2 1 PHE HE2 H 6.070 8.196 -0.318 1.00 . B B . 1 PHE HE2 1 1 19 14459 2 2 1 PHE HZ H 8.270 7.159 0.058 1.00 . B B . 1 PHE HZ 1 1 19 14460 2 2 1 PHE N N 6.558 7.489 -7.382 1.00 . B B . 1 PHE N 1 1 19 14461 2 2 1 PHE O O 6.125 5.127 -5.236 1.00 . B B . 1 PHE O 1 1 19 14462 2 2 2 VAL C C 8.655 3.217 -4.184 1.00 . B B . 2 VAL C 1 1 19 14463 2 2 2 VAL CA C 8.282 3.505 -5.659 1.00 . B B . 2 VAL CA 1 1 19 14464 2 2 2 VAL CB C 9.324 2.872 -6.607 1.00 . B B . 2 VAL CB 1 1 19 14465 2 2 2 VAL CG1 C 8.821 2.922 -8.059 1.00 . B B . 2 VAL CG1 1 1 19 14466 2 2 2 VAL CG2 C 10.680 3.611 -6.574 1.00 . B B . 2 VAL CG2 1 1 19 14467 2 2 2 VAL H H 8.961 5.388 -6.321 1.00 . B B . 2 VAL H 1 1 19 14468 2 2 2 VAL HA H 7.328 3.103 -5.873 1.00 . B B . 2 VAL HA 1 1 19 14469 2 2 2 VAL HB H 9.433 1.856 -6.254 1.00 . B B . 2 VAL HB 1 1 19 14470 2 2 2 VAL HG11 H 8.642 3.941 -8.375 1.00 . B B . 2 VAL HG11 1 1 19 14471 2 2 2 VAL HG12 H 9.560 2.490 -8.720 1.00 . B B . 2 VAL HG12 1 1 19 14472 2 2 2 VAL HG13 H 7.906 2.363 -8.174 1.00 . B B . 2 VAL HG13 1 1 19 14473 2 2 2 VAL HG21 H 11.096 3.602 -5.576 1.00 . B B . 2 VAL HG21 1 1 19 14474 2 2 2 VAL HG22 H 11.381 3.110 -7.228 1.00 . B B . 2 VAL HG22 1 1 19 14475 2 2 2 VAL HG23 H 10.590 4.634 -6.905 1.00 . B B . 2 VAL HG23 1 1 19 14476 2 2 2 VAL N N 8.193 4.961 -5.945 1.00 . B B . 2 VAL N 1 1 19 14477 2 2 2 VAL O O 9.665 2.639 -3.850 1.00 . B B . 2 VAL O 1 1 19 14478 2 2 3 ASN C C 8.891 2.843 -1.144 1.00 . B B . 3 ASN C 1 1 19 14479 2 2 3 ASN CA C 7.752 3.590 -1.867 1.00 . B B . 3 ASN CA 1 1 19 14480 2 2 3 ASN CB C 6.361 3.011 -1.501 1.00 . B B . 3 ASN CB 1 1 19 14481 2 2 3 ASN CG C 5.268 3.881 -2.090 1.00 . B B . 3 ASN CG 1 1 19 14482 2 2 3 ASN H H 7.008 4.088 -3.860 1.00 . B B . 3 ASN H 1 1 19 14483 2 2 3 ASN HA H 7.824 4.577 -1.478 1.00 . B B . 3 ASN HA 1 1 19 14484 2 2 3 ASN HB2 H 6.226 2.014 -1.886 1.00 . B B . 3 ASN HB2 1 1 19 14485 2 2 3 ASN HB3 H 6.213 3.000 -0.434 1.00 . B B . 3 ASN HB3 1 1 19 14486 2 2 3 ASN HD21 H 6.432 5.387 -2.674 1.00 . B B . 3 ASN HD21 1 1 19 14487 2 2 3 ASN HD22 H 4.769 5.495 -3.009 1.00 . B B . 3 ASN HD22 1 1 19 14488 2 2 3 ASN N N 7.748 3.670 -3.379 1.00 . B B . 3 ASN N 1 1 19 14489 2 2 3 ASN ND2 N 5.530 5.017 -2.635 1.00 . B B . 3 ASN ND2 1 1 19 14490 2 2 3 ASN O O 9.582 3.407 -0.323 1.00 . B B . 3 ASN O 1 1 19 14491 2 2 3 ASN OD1 O 4.111 3.551 -2.078 1.00 . B B . 3 ASN OD1 1 1 19 14492 2 2 4 GLN C C 9.281 -0.474 -0.093 1.00 . B B . 4 GLN C 1 1 19 14493 2 2 4 GLN CA C 9.931 0.540 -1.072 1.00 . B B . 4 GLN CA 1 1 19 14494 2 2 4 GLN CB C 11.203 1.213 -0.417 1.00 . B B . 4 GLN CB 1 1 19 14495 2 2 4 GLN CD C 12.624 1.235 -2.541 1.00 . B B . 4 GLN CD 1 1 19 14496 2 2 4 GLN CG C 11.984 2.083 -1.459 1.00 . B B . 4 GLN CG 1 1 19 14497 2 2 4 GLN H H 8.311 1.376 -2.170 1.00 . B B . 4 GLN H 1 1 19 14498 2 2 4 GLN HA H 10.236 -0.027 -1.940 1.00 . B B . 4 GLN HA 1 1 19 14499 2 2 4 GLN HB2 H 10.915 1.823 0.425 1.00 . B B . 4 GLN HB2 1 1 19 14500 2 2 4 GLN HB3 H 11.854 0.424 -0.069 1.00 . B B . 4 GLN HB3 1 1 19 14501 2 2 4 GLN HE21 H 11.252 1.677 -3.841 1.00 . B B . 4 GLN HE21 1 1 19 14502 2 2 4 GLN HE22 H 12.510 0.644 -4.384 1.00 . B B . 4 GLN HE22 1 1 19 14503 2 2 4 GLN HG2 H 11.337 2.796 -1.943 1.00 . B B . 4 GLN HG2 1 1 19 14504 2 2 4 GLN HG3 H 12.777 2.624 -0.969 1.00 . B B . 4 GLN HG3 1 1 19 14505 2 2 4 GLN N N 8.975 1.607 -1.514 1.00 . B B . 4 GLN N 1 1 19 14506 2 2 4 GLN NE2 N 12.079 1.180 -3.697 1.00 . B B . 4 GLN NE2 1 1 19 14507 2 2 4 GLN O O 8.494 -1.301 -0.506 1.00 . B B . 4 GLN O 1 1 19 14508 2 2 4 GLN OE1 O 13.633 0.597 -2.374 1.00 . B B . 4 GLN OE1 1 1 19 14509 2 2 5 HIS C C 8.247 -0.682 3.446 1.00 . B B . 5 HIS C 1 1 19 14510 2 2 5 HIS CA C 9.113 -1.225 2.266 1.00 . B B . 5 HIS CA 1 1 19 14511 2 2 5 HIS CB C 10.364 -1.934 2.850 1.00 . B B . 5 HIS CB 1 1 19 14512 2 2 5 HIS CD2 C 12.365 -2.961 1.483 1.00 . B B . 5 HIS CD2 1 1 19 14513 2 2 5 HIS CE1 C 11.290 -4.312 0.350 1.00 . B B . 5 HIS CE1 1 1 19 14514 2 2 5 HIS CG C 11.039 -2.835 1.834 1.00 . B B . 5 HIS CG 1 1 19 14515 2 2 5 HIS H H 10.226 0.399 1.320 1.00 . B B . 5 HIS H 1 1 19 14516 2 2 5 HIS HA H 8.522 -2.006 1.812 1.00 . B B . 5 HIS HA 1 1 19 14517 2 2 5 HIS HB2 H 11.083 -1.201 3.180 1.00 . B B . 5 HIS HB2 1 1 19 14518 2 2 5 HIS HB3 H 10.091 -2.543 3.700 1.00 . B B . 5 HIS HB3 1 1 19 14519 2 2 5 HIS HD1 H 9.448 -3.835 1.113 1.00 . B B . 5 HIS HD1 1 1 19 14520 2 2 5 HIS HD2 H 13.170 -2.384 1.906 1.00 . B B . 5 HIS HD2 1 1 19 14521 2 2 5 HIS HE1 H 11.051 -5.086 -0.365 1.00 . B B . 5 HIS HE1 1 1 19 14522 2 2 5 HIS N N 9.615 -0.336 1.157 1.00 . B B . 5 HIS N 1 1 19 14523 2 2 5 HIS ND1 N 10.428 -3.695 1.099 1.00 . B B . 5 HIS ND1 1 1 19 14524 2 2 5 HIS NE2 N 12.508 -3.886 0.559 1.00 . B B . 5 HIS NE2 1 1 19 14525 2 2 5 HIS O O 8.698 -0.581 4.572 1.00 . B B . 5 HIS O 1 1 19 14526 2 2 6 LEU C C 5.385 -1.108 4.776 1.00 . B B . 6 LEU C 1 1 19 14527 2 2 6 LEU CA C 6.148 0.177 4.324 1.00 . B B . 6 LEU CA 1 1 19 14528 2 2 6 LEU CB C 5.189 1.297 3.763 1.00 . B B . 6 LEU CB 1 1 19 14529 2 2 6 LEU CD1 C 7.029 2.376 2.330 1.00 . B B . 6 LEU CD1 1 1 19 14530 2 2 6 LEU CD2 C 4.903 3.529 2.687 1.00 . B B . 6 LEU CD2 1 1 19 14531 2 2 6 LEU CG C 5.922 2.609 3.361 1.00 . B B . 6 LEU CG 1 1 19 14532 2 2 6 LEU H H 6.686 -0.421 2.281 1.00 . B B . 6 LEU H 1 1 19 14533 2 2 6 LEU HA H 6.750 0.542 5.142 1.00 . B B . 6 LEU HA 1 1 19 14534 2 2 6 LEU HB2 H 4.606 0.956 2.927 1.00 . B B . 6 LEU HB2 1 1 19 14535 2 2 6 LEU HB3 H 4.492 1.560 4.547 1.00 . B B . 6 LEU HB3 1 1 19 14536 2 2 6 LEU HD11 H 6.628 1.890 1.455 1.00 . B B . 6 LEU HD11 1 1 19 14537 2 2 6 LEU HD12 H 7.469 3.318 2.036 1.00 . B B . 6 LEU HD12 1 1 19 14538 2 2 6 LEU HD13 H 7.818 1.769 2.744 1.00 . B B . 6 LEU HD13 1 1 19 14539 2 2 6 LEU HD21 H 4.092 3.752 3.367 1.00 . B B . 6 LEU HD21 1 1 19 14540 2 2 6 LEU HD22 H 5.371 4.460 2.405 1.00 . B B . 6 LEU HD22 1 1 19 14541 2 2 6 LEU HD23 H 4.489 3.068 1.801 1.00 . B B . 6 LEU HD23 1 1 19 14542 2 2 6 LEU HG H 6.325 3.094 4.245 1.00 . B B . 6 LEU HG 1 1 19 14543 2 2 6 LEU N N 7.016 -0.338 3.198 1.00 . B B . 6 LEU N 1 1 19 14544 2 2 6 LEU O O 4.876 -1.826 3.933 1.00 . B B . 6 LEU O 1 1 19 14545 2 2 7 CYS C C 3.447 -2.500 7.594 1.00 . B B . 7 CYS C 1 1 19 14546 2 2 7 CYS CA C 4.604 -2.620 6.559 1.00 . B B . 7 CYS CA 1 1 19 14547 2 2 7 CYS CB C 5.716 -3.526 7.109 1.00 . B B . 7 CYS CB 1 1 19 14548 2 2 7 CYS H H 5.721 -0.761 6.690 1.00 . B B . 7 CYS H 1 1 19 14549 2 2 7 CYS HA H 4.172 -3.149 5.722 1.00 . B B . 7 CYS HA 1 1 19 14550 2 2 7 CYS HB2 H 6.478 -3.628 6.350 1.00 . B B . 7 CYS HB2 1 1 19 14551 2 2 7 CYS HB3 H 6.178 -3.055 7.964 1.00 . B B . 7 CYS HB3 1 1 19 14552 2 2 7 CYS HG H 4.886 -5.160 8.497 1.00 . B B . 7 CYS HG 1 1 19 14553 2 2 7 CYS N N 5.312 -1.380 6.053 1.00 . B B . 7 CYS N 1 1 19 14554 2 2 7 CYS O O 2.446 -3.173 7.467 1.00 . B B . 7 CYS O 1 1 19 14555 2 2 7 CYS SG S 5.221 -5.197 7.598 1.00 . B B . 7 CYS SG 1 1 19 14556 2 2 8 GLY C C 1.867 -0.124 9.617 1.00 . B B . 8 GLY C 1 1 19 14557 2 2 8 GLY CA C 2.505 -1.503 9.641 1.00 . B B . 8 GLY CA 1 1 19 14558 2 2 8 GLY H H 4.428 -1.151 8.631 1.00 . B B . 8 GLY H 1 1 19 14559 2 2 8 GLY HA2 H 1.714 -2.221 9.483 1.00 . B B . 8 GLY HA2 1 1 19 14560 2 2 8 GLY HA3 H 2.929 -1.653 10.621 1.00 . B B . 8 GLY HA3 1 1 19 14561 2 2 8 GLY N N 3.597 -1.666 8.589 1.00 . B B . 8 GLY N 1 1 19 14562 2 2 8 GLY O O 1.260 0.263 8.641 1.00 . B B . 8 GLY O 1 1 19 14563 2 2 9 ASP C C 1.817 2.785 9.486 1.00 . B B . 9 ASP C 1 1 19 14564 2 2 9 ASP CA C 1.432 1.974 10.773 1.00 . B B . 9 ASP CA 1 1 19 14565 2 2 9 ASP CB C 2.008 2.507 12.137 1.00 . B B . 9 ASP CB 1 1 19 14566 2 2 9 ASP CG C 3.470 2.174 12.425 1.00 . B B . 9 ASP CG 1 1 19 14567 2 2 9 ASP H H 2.507 0.270 11.451 1.00 . B B . 9 ASP H 1 1 19 14568 2 2 9 ASP HA H 0.352 1.904 10.799 1.00 . B B . 9 ASP HA 1 1 19 14569 2 2 9 ASP HB2 H 1.948 3.584 12.149 1.00 . B B . 9 ASP HB2 1 1 19 14570 2 2 9 ASP HB3 H 1.433 2.133 12.966 1.00 . B B . 9 ASP HB3 1 1 19 14571 2 2 9 ASP N N 2.003 0.599 10.677 1.00 . B B . 9 ASP N 1 1 19 14572 2 2 9 ASP O O 0.983 3.231 8.719 1.00 . B B . 9 ASP O 1 1 19 14573 2 2 9 ASP OD1 O 4.139 1.648 11.555 1.00 . B B . 9 ASP OD1 1 1 19 14574 2 2 9 ASP OD2 O 3.819 2.477 13.542 1.00 . B B . 9 ASP OD2 1 1 19 14575 2 2 10 HIS C C 3.134 3.109 6.676 1.00 . B B . 10 HIS C 1 1 19 14576 2 2 10 HIS CA C 3.583 3.672 8.059 1.00 . B B . 10 HIS CA 1 1 19 14577 2 2 10 HIS CB C 5.089 3.691 8.177 1.00 . B B . 10 HIS CB 1 1 19 14578 2 2 10 HIS CD2 C 5.361 1.084 8.659 1.00 . B B . 10 HIS CD2 1 1 19 14579 2 2 10 HIS CE1 C 7.141 0.786 7.648 1.00 . B B . 10 HIS CE1 1 1 19 14580 2 2 10 HIS CG C 5.731 2.300 8.122 1.00 . B B . 10 HIS CG 1 1 19 14581 2 2 10 HIS H H 3.698 2.517 9.913 1.00 . B B . 10 HIS H 1 1 19 14582 2 2 10 HIS HA H 3.204 4.686 8.118 1.00 . B B . 10 HIS HA 1 1 19 14583 2 2 10 HIS HB2 H 5.464 4.318 7.387 1.00 . B B . 10 HIS HB2 1 1 19 14584 2 2 10 HIS HB3 H 5.285 4.133 9.143 1.00 . B B . 10 HIS HB3 1 1 19 14585 2 2 10 HIS HD1 H 7.354 2.721 7.029 1.00 . B B . 10 HIS HD1 1 1 19 14586 2 2 10 HIS HD2 H 4.474 0.925 9.251 1.00 . B B . 10 HIS HD2 1 1 19 14587 2 2 10 HIS HE1 H 8.025 0.312 7.233 1.00 . B B . 10 HIS HE1 1 1 19 14588 2 2 10 HIS N N 3.085 2.921 9.260 1.00 . B B . 10 HIS N 1 1 19 14589 2 2 10 HIS ND1 N 6.836 2.042 7.514 1.00 . B B . 10 HIS ND1 1 1 19 14590 2 2 10 HIS NE2 N 6.242 0.152 8.358 1.00 . B B . 10 HIS NE2 1 1 19 14591 2 2 10 HIS O O 3.491 3.589 5.618 1.00 . B B . 10 HIS O 1 1 19 14592 2 2 11 LEU C C 0.316 1.772 5.491 1.00 . B B . 11 LEU C 1 1 19 14593 2 2 11 LEU CA C 1.798 1.397 5.519 1.00 . B B . 11 LEU CA 1 1 19 14594 2 2 11 LEU CB C 2.001 -0.104 5.675 1.00 . B B . 11 LEU CB 1 1 19 14595 2 2 11 LEU CD1 C 1.604 -0.286 3.218 1.00 . B B . 11 LEU CD1 1 1 19 14596 2 2 11 LEU CD2 C 1.602 -2.244 4.665 1.00 . B B . 11 LEU CD2 1 1 19 14597 2 2 11 LEU CG C 1.212 -0.812 4.591 1.00 . B B . 11 LEU CG 1 1 19 14598 2 2 11 LEU H H 2.115 1.748 7.620 1.00 . B B . 11 LEU H 1 1 19 14599 2 2 11 LEU HA H 2.249 1.731 4.596 1.00 . B B . 11 LEU HA 1 1 19 14600 2 2 11 LEU HB2 H 3.051 -0.330 5.588 1.00 . B B . 11 LEU HB2 1 1 19 14601 2 2 11 LEU HB3 H 1.659 -0.461 6.631 1.00 . B B . 11 LEU HB3 1 1 19 14602 2 2 11 LEU HD11 H 2.659 -0.436 3.053 1.00 . B B . 11 LEU HD11 1 1 19 14603 2 2 11 LEU HD12 H 1.041 -0.798 2.460 1.00 . B B . 11 LEU HD12 1 1 19 14604 2 2 11 LEU HD13 H 1.377 0.763 3.107 1.00 . B B . 11 LEU HD13 1 1 19 14605 2 2 11 LEU HD21 H 2.659 -2.370 4.512 1.00 . B B . 11 LEU HD21 1 1 19 14606 2 2 11 LEU HD22 H 1.319 -2.661 5.619 1.00 . B B . 11 LEU HD22 1 1 19 14607 2 2 11 LEU HD23 H 1.074 -2.768 3.906 1.00 . B B . 11 LEU HD23 1 1 19 14608 2 2 11 LEU HG H 0.144 -0.712 4.756 1.00 . B B . 11 LEU HG 1 1 19 14609 2 2 11 LEU N N 2.348 2.078 6.729 1.00 . B B . 11 LEU N 1 1 19 14610 2 2 11 LEU O O -0.205 2.278 4.514 1.00 . B B . 11 LEU O 1 1 19 14611 2 2 12 VAL C C -1.983 3.335 6.311 1.00 . B B . 12 VAL C 1 1 19 14612 2 2 12 VAL CA C -1.794 1.850 6.653 1.00 . B B . 12 VAL CA 1 1 19 14613 2 2 12 VAL CB C -2.345 1.548 8.067 1.00 . B B . 12 VAL CB 1 1 19 14614 2 2 12 VAL CG1 C -1.461 2.137 9.136 1.00 . B B . 12 VAL CG1 1 1 19 14615 2 2 12 VAL CG2 C -3.693 2.267 8.210 1.00 . B B . 12 VAL CG2 1 1 19 14616 2 2 12 VAL H H 0.142 1.088 7.324 1.00 . B B . 12 VAL H 1 1 19 14617 2 2 12 VAL HA H -2.328 1.265 5.933 1.00 . B B . 12 VAL HA 1 1 19 14618 2 2 12 VAL HB H -2.413 0.468 8.178 1.00 . B B . 12 VAL HB 1 1 19 14619 2 2 12 VAL HG11 H -1.345 3.212 9.049 1.00 . B B . 12 VAL HG11 1 1 19 14620 2 2 12 VAL HG12 H -1.816 1.922 10.127 1.00 . B B . 12 VAL HG12 1 1 19 14621 2 2 12 VAL HG13 H -0.496 1.681 9.017 1.00 . B B . 12 VAL HG13 1 1 19 14622 2 2 12 VAL HG21 H -4.367 1.952 7.427 1.00 . B B . 12 VAL HG21 1 1 19 14623 2 2 12 VAL HG22 H -4.125 2.058 9.172 1.00 . B B . 12 VAL HG22 1 1 19 14624 2 2 12 VAL HG23 H -3.562 3.340 8.127 1.00 . B B . 12 VAL HG23 1 1 19 14625 2 2 12 VAL N N -0.341 1.506 6.581 1.00 . B B . 12 VAL N 1 1 19 14626 2 2 12 VAL O O -2.807 3.663 5.483 1.00 . B B . 12 VAL O 1 1 19 14627 2 2 13 GLU C C -1.418 5.917 5.155 1.00 . B B . 13 GLU C 1 1 19 14628 2 2 13 GLU CA C -1.340 5.668 6.667 1.00 . B B . 13 GLU CA 1 1 19 14629 2 2 13 GLU CB C -0.111 6.372 7.247 1.00 . B B . 13 GLU CB 1 1 19 14630 2 2 13 GLU CD C 1.077 7.070 9.365 1.00 . B B . 13 GLU CD 1 1 19 14631 2 2 13 GLU CG C -0.101 6.285 8.800 1.00 . B B . 13 GLU CG 1 1 19 14632 2 2 13 GLU H H -0.563 3.880 7.593 1.00 . B B . 13 GLU H 1 1 19 14633 2 2 13 GLU HA H -2.239 6.059 7.120 1.00 . B B . 13 GLU HA 1 1 19 14634 2 2 13 GLU HB2 H 0.798 5.911 6.878 1.00 . B B . 13 GLU HB2 1 1 19 14635 2 2 13 GLU HB3 H -0.091 7.416 6.958 1.00 . B B . 13 GLU HB3 1 1 19 14636 2 2 13 GLU HG2 H -1.000 6.695 9.229 1.00 . B B . 13 GLU HG2 1 1 19 14637 2 2 13 GLU HG3 H 0.024 5.277 9.150 1.00 . B B . 13 GLU HG3 1 1 19 14638 2 2 13 GLU N N -1.227 4.194 6.940 1.00 . B B . 13 GLU N 1 1 19 14639 2 2 13 GLU O O -2.180 6.717 4.640 1.00 . B B . 13 GLU O 1 1 19 14640 2 2 13 GLU OE1 O 2.185 6.741 8.978 1.00 . B B . 13 GLU OE1 1 1 19 14641 2 2 13 GLU OE2 O 0.780 7.952 10.146 1.00 . B B . 13 GLU OE2 1 1 19 14642 2 2 14 ALA C C -1.729 4.634 2.296 1.00 . B B . 14 ALA C 1 1 19 14643 2 2 14 ALA CA C -0.535 5.270 3.009 1.00 . B B . 14 ALA CA 1 1 19 14644 2 2 14 ALA CB C 0.825 4.638 2.599 1.00 . B B . 14 ALA CB 1 1 19 14645 2 2 14 ALA H H -0.063 4.498 4.956 1.00 . B B . 14 ALA H 1 1 19 14646 2 2 14 ALA HA H -0.607 6.317 2.820 1.00 . B B . 14 ALA HA 1 1 19 14647 2 2 14 ALA HB1 H 1.635 5.169 3.080 1.00 . B B . 14 ALA HB1 1 1 19 14648 2 2 14 ALA HB2 H 0.874 3.601 2.901 1.00 . B B . 14 ALA HB2 1 1 19 14649 2 2 14 ALA HB3 H 0.963 4.691 1.527 1.00 . B B . 14 ALA HB3 1 1 19 14650 2 2 14 ALA N N -0.606 5.155 4.476 1.00 . B B . 14 ALA N 1 1 19 14651 2 2 14 ALA O O -2.360 5.290 1.487 1.00 . B B . 14 ALA O 1 1 19 14652 2 2 15 LEU C C -4.493 3.678 2.207 1.00 . B B . 15 LEU C 1 1 19 14653 2 2 15 LEU CA C -3.221 2.838 1.854 1.00 . B B . 15 LEU CA 1 1 19 14654 2 2 15 LEU CB C -3.344 1.304 2.207 1.00 . B B . 15 LEU CB 1 1 19 14655 2 2 15 LEU CD1 C -4.351 1.151 4.485 1.00 . B B . 15 LEU CD1 1 1 19 14656 2 2 15 LEU CD2 C -3.100 -0.698 3.530 1.00 . B B . 15 LEU CD2 1 1 19 14657 2 2 15 LEU CG C -3.149 0.814 3.605 1.00 . B B . 15 LEU CG 1 1 19 14658 2 2 15 LEU H H -1.488 2.921 3.240 1.00 . B B . 15 LEU H 1 1 19 14659 2 2 15 LEU HA H -3.049 2.912 0.794 1.00 . B B . 15 LEU HA 1 1 19 14660 2 2 15 LEU HB2 H -4.342 1.013 1.966 1.00 . B B . 15 LEU HB2 1 1 19 14661 2 2 15 LEU HB3 H -2.665 0.777 1.555 1.00 . B B . 15 LEU HB3 1 1 19 14662 2 2 15 LEU HD11 H -5.254 0.732 4.061 1.00 . B B . 15 LEU HD11 1 1 19 14663 2 2 15 LEU HD12 H -4.222 0.725 5.468 1.00 . B B . 15 LEU HD12 1 1 19 14664 2 2 15 LEU HD13 H -4.496 2.207 4.599 1.00 . B B . 15 LEU HD13 1 1 19 14665 2 2 15 LEU HD21 H -2.281 -0.984 2.890 1.00 . B B . 15 LEU HD21 1 1 19 14666 2 2 15 LEU HD22 H -2.936 -1.117 4.514 1.00 . B B . 15 LEU HD22 1 1 19 14667 2 2 15 LEU HD23 H -4.018 -1.103 3.128 1.00 . B B . 15 LEU HD23 1 1 19 14668 2 2 15 LEU HG H -2.189 1.168 3.943 1.00 . B B . 15 LEU HG 1 1 19 14669 2 2 15 LEU N N -2.037 3.399 2.580 1.00 . B B . 15 LEU N 1 1 19 14670 2 2 15 LEU O O -5.328 3.927 1.365 1.00 . B B . 15 LEU O 1 1 19 14671 2 2 16 TYR C C -5.832 6.190 2.892 1.00 . B B . 16 TYR C 1 1 19 14672 2 2 16 TYR CA C -5.813 4.950 3.837 1.00 . B B . 16 TYR CA 1 1 19 14673 2 2 16 TYR CB C -5.597 5.316 5.328 1.00 . B B . 16 TYR CB 1 1 19 14674 2 2 16 TYR CD1 C -8.022 5.365 6.082 1.00 . B B . 16 TYR CD1 1 1 19 14675 2 2 16 TYR CD2 C -6.740 7.343 6.342 1.00 . B B . 16 TYR CD2 1 1 19 14676 2 2 16 TYR CE1 C -9.117 6.011 6.638 1.00 . B B . 16 TYR CE1 1 1 19 14677 2 2 16 TYR CE2 C -7.842 7.977 6.896 1.00 . B B . 16 TYR CE2 1 1 19 14678 2 2 16 TYR CG C -6.821 6.028 5.930 1.00 . B B . 16 TYR CG 1 1 19 14679 2 2 16 TYR CZ C -9.032 7.315 7.047 1.00 . B B . 16 TYR CZ 1 1 19 14680 2 2 16 TYR H H -3.927 3.910 4.078 1.00 . B B . 16 TYR H 1 1 19 14681 2 2 16 TYR HA H -6.724 4.390 3.674 1.00 . B B . 16 TYR HA 1 1 19 14682 2 2 16 TYR HB2 H -5.424 4.411 5.892 1.00 . B B . 16 TYR HB2 1 1 19 14683 2 2 16 TYR HB3 H -4.726 5.947 5.437 1.00 . B B . 16 TYR HB3 1 1 19 14684 2 2 16 TYR HD1 H -8.116 4.336 5.761 1.00 . B B . 16 TYR HD1 1 1 19 14685 2 2 16 TYR HD2 H -5.812 7.883 6.230 1.00 . B B . 16 TYR HD2 1 1 19 14686 2 2 16 TYR HE1 H -10.062 5.501 6.758 1.00 . B B . 16 TYR HE1 1 1 19 14687 2 2 16 TYR HE2 H -7.791 9.004 7.221 1.00 . B B . 16 TYR HE2 1 1 19 14688 2 2 16 TYR HH H -10.429 8.648 7.004 1.00 . B B . 16 TYR HH 1 1 19 14689 2 2 16 TYR N N -4.623 4.123 3.427 1.00 . B B . 16 TYR N 1 1 19 14690 2 2 16 TYR O O -6.840 6.519 2.293 1.00 . B B . 16 TYR O 1 1 19 14691 2 2 16 TYR OH O -10.124 7.940 7.602 1.00 . B B . 16 TYR OH 1 1 19 14692 2 2 17 LEU C C -5.027 7.735 0.499 1.00 . B B . 17 LEU C 1 1 19 14693 2 2 17 LEU CA C -4.521 8.046 1.931 1.00 . B B . 17 LEU CA 1 1 19 14694 2 2 17 LEU CB C -3.006 8.408 1.978 1.00 . B B . 17 LEU CB 1 1 19 14695 2 2 17 LEU CD1 C -1.242 10.109 1.642 1.00 . B B . 17 LEU CD1 1 1 19 14696 2 2 17 LEU CD2 C -2.663 9.578 -0.263 1.00 . B B . 17 LEU CD2 1 1 19 14697 2 2 17 LEU CG C -2.676 9.743 1.267 1.00 . B B . 17 LEU CG 1 1 19 14698 2 2 17 LEU H H -3.928 6.515 3.335 1.00 . B B . 17 LEU H 1 1 19 14699 2 2 17 LEU HA H -5.126 8.855 2.314 1.00 . B B . 17 LEU HA 1 1 19 14700 2 2 17 LEU HB2 H -2.708 8.471 3.015 1.00 . B B . 17 LEU HB2 1 1 19 14701 2 2 17 LEU HB3 H -2.430 7.616 1.524 1.00 . B B . 17 LEU HB3 1 1 19 14702 2 2 17 LEU HD11 H -1.152 10.222 2.712 1.00 . B B . 17 LEU HD11 1 1 19 14703 2 2 17 LEU HD12 H -0.557 9.339 1.318 1.00 . B B . 17 LEU HD12 1 1 19 14704 2 2 17 LEU HD13 H -0.958 11.041 1.174 1.00 . B B . 17 LEU HD13 1 1 19 14705 2 2 17 LEU HD21 H -1.950 8.823 -0.562 1.00 . B B . 17 LEU HD21 1 1 19 14706 2 2 17 LEU HD22 H -3.630 9.302 -0.650 1.00 . B B . 17 LEU HD22 1 1 19 14707 2 2 17 LEU HD23 H -2.388 10.512 -0.730 1.00 . B B . 17 LEU HD23 1 1 19 14708 2 2 17 LEU HG H -3.365 10.526 1.565 1.00 . B B . 17 LEU HG 1 1 19 14709 2 2 17 LEU N N -4.691 6.833 2.807 1.00 . B B . 17 LEU N 1 1 19 14710 2 2 17 LEU O O -5.932 8.387 0.019 1.00 . B B . 17 LEU O 1 1 19 14711 2 2 18 VAL C C -6.445 6.107 -1.517 1.00 . B B . 18 VAL C 1 1 19 14712 2 2 18 VAL CA C -4.926 6.420 -1.559 1.00 . B B . 18 VAL CA 1 1 19 14713 2 2 18 VAL CB C -4.109 5.215 -2.103 1.00 . B B . 18 VAL CB 1 1 19 14714 2 2 18 VAL CG1 C -2.638 5.640 -2.247 1.00 . B B . 18 VAL CG1 1 1 19 14715 2 2 18 VAL CG2 C -4.127 4.051 -1.174 1.00 . B B . 18 VAL CG2 1 1 19 14716 2 2 18 VAL H H -3.728 6.265 0.290 1.00 . B B . 18 VAL H 1 1 19 14717 2 2 18 VAL HA H -4.780 7.267 -2.212 1.00 . B B . 18 VAL HA 1 1 19 14718 2 2 18 VAL HB H -4.534 4.920 -3.054 1.00 . B B . 18 VAL HB 1 1 19 14719 2 2 18 VAL HG11 H -2.221 5.951 -1.301 1.00 . B B . 18 VAL HG11 1 1 19 14720 2 2 18 VAL HG12 H -2.050 4.823 -2.643 1.00 . B B . 18 VAL HG12 1 1 19 14721 2 2 18 VAL HG13 H -2.563 6.460 -2.950 1.00 . B B . 18 VAL HG13 1 1 19 14722 2 2 18 VAL HG21 H -3.712 4.380 -0.241 1.00 . B B . 18 VAL HG21 1 1 19 14723 2 2 18 VAL HG22 H -5.139 3.714 -1.022 1.00 . B B . 18 VAL HG22 1 1 19 14724 2 2 18 VAL HG23 H -3.547 3.232 -1.570 1.00 . B B . 18 VAL HG23 1 1 19 14725 2 2 18 VAL N N -4.452 6.756 -0.155 1.00 . B B . 18 VAL N 1 1 19 14726 2 2 18 VAL O O -7.215 6.591 -2.324 1.00 . B B . 18 VAL O 1 1 19 14727 2 2 19 CYS C C -9.180 6.238 -0.199 1.00 . B B . 19 CYS C 1 1 19 14728 2 2 19 CYS CA C -8.337 4.973 -0.465 1.00 . B B . 19 CYS CA 1 1 19 14729 2 2 19 CYS CB C -8.620 4.037 0.728 1.00 . B B . 19 CYS CB 1 1 19 14730 2 2 19 CYS H H -6.252 4.885 0.052 1.00 . B B . 19 CYS H 1 1 19 14731 2 2 19 CYS HA H -8.659 4.559 -1.403 1.00 . B B . 19 CYS HA 1 1 19 14732 2 2 19 CYS HB2 H -8.009 4.378 1.552 1.00 . B B . 19 CYS HB2 1 1 19 14733 2 2 19 CYS HB3 H -9.640 4.180 1.036 1.00 . B B . 19 CYS HB3 1 1 19 14734 2 2 19 CYS HG H -9.251 1.855 0.416 1.00 . B B . 19 CYS HG 1 1 19 14735 2 2 19 CYS N N -6.876 5.300 -0.579 1.00 . B B . 19 CYS N 1 1 19 14736 2 2 19 CYS O O -10.396 6.160 -0.155 1.00 . B B . 19 CYS O 1 1 19 14737 2 2 19 CYS SG S -8.410 2.251 0.661 1.00 . B B . 19 CYS SG 1 1 19 14738 2 2 20 GLY C C -10.100 8.350 1.523 1.00 . B B . 20 GLY C 1 1 19 14739 2 2 20 GLY CA C -9.268 8.640 0.273 1.00 . B B . 20 GLY CA 1 1 19 14740 2 2 20 GLY H H -7.554 7.354 -0.067 1.00 . B B . 20 GLY H 1 1 19 14741 2 2 20 GLY HA2 H -8.578 9.443 0.485 1.00 . B B . 20 GLY HA2 1 1 19 14742 2 2 20 GLY HA3 H -9.928 8.899 -0.540 1.00 . B B . 20 GLY HA3 1 1 19 14743 2 2 20 GLY N N -8.534 7.359 -0.014 1.00 . B B . 20 GLY N 1 1 19 14744 2 2 20 GLY O O -11.196 8.854 1.653 1.00 . B B . 20 GLY O 1 1 19 14745 2 2 21 GLU C C -10.916 5.737 3.609 1.00 . B B . 21 GLU C 1 1 19 14746 2 2 21 GLU CA C -9.981 6.991 3.676 1.00 . B B . 21 GLU CA 1 1 19 14747 2 2 21 GLU CB C -10.759 8.046 4.406 1.00 . B B . 21 GLU CB 1 1 19 14748 2 2 21 GLU CD C -11.113 10.363 5.159 1.00 . B B . 21 GLU CD 1 1 19 14749 2 2 21 GLU CG C -10.058 9.415 4.627 1.00 . B B . 21 GLU CG 1 1 19 14750 2 2 21 GLU H H -8.606 7.211 2.063 1.00 . B B . 21 GLU H 1 1 19 14751 2 2 21 GLU HA H -9.120 6.720 4.262 1.00 . B B . 21 GLU HA 1 1 19 14752 2 2 21 GLU HB2 H -11.618 8.209 3.807 1.00 . B B . 21 GLU HB2 1 1 19 14753 2 2 21 GLU HB3 H -11.095 7.647 5.356 1.00 . B B . 21 GLU HB3 1 1 19 14754 2 2 21 GLU HG2 H -9.260 9.371 5.343 1.00 . B B . 21 GLU HG2 1 1 19 14755 2 2 21 GLU HG3 H -9.675 9.822 3.703 1.00 . B B . 21 GLU HG3 1 1 19 14756 2 2 21 GLU N N -9.490 7.519 2.345 1.00 . B B . 21 GLU N 1 1 19 14757 2 2 21 GLU O O -11.386 5.244 4.616 1.00 . B B . 21 GLU O 1 1 19 14758 2 2 21 GLU OE1 O -11.699 9.999 6.158 1.00 . B B . 21 GLU OE1 1 1 19 14759 2 2 21 GLU OE2 O -11.313 11.385 4.544 1.00 . B B . 21 GLU OE2 1 1 19 14760 2 2 22 ARG C C -11.523 2.647 1.814 1.00 . B B . 22 ARG C 1 1 19 14761 2 2 22 ARG CA C -12.074 4.063 2.240 1.00 . B B . 22 ARG CA 1 1 19 14762 2 2 22 ARG CB C -13.175 4.612 1.253 1.00 . B B . 22 ARG CB 1 1 19 14763 2 2 22 ARG CD C -13.430 7.118 1.833 1.00 . B B . 22 ARG CD 1 1 19 14764 2 2 22 ARG CG C -14.073 5.726 1.957 1.00 . B B . 22 ARG CG 1 1 19 14765 2 2 22 ARG CZ C -13.693 8.934 3.439 1.00 . B B . 22 ARG CZ 1 1 19 14766 2 2 22 ARG H H -10.798 5.656 1.656 1.00 . B B . 22 ARG H 1 1 19 14767 2 2 22 ARG HA H -12.520 3.923 3.188 1.00 . B B . 22 ARG HA 1 1 19 14768 2 2 22 ARG HB2 H -12.658 5.013 0.384 1.00 . B B . 22 ARG HB2 1 1 19 14769 2 2 22 ARG HB3 H -13.809 3.811 0.906 1.00 . B B . 22 ARG HB3 1 1 19 14770 2 2 22 ARG HD2 H -12.421 7.085 2.214 1.00 . B B . 22 ARG HD2 1 1 19 14771 2 2 22 ARG HD3 H -13.347 7.409 0.787 1.00 . B B . 22 ARG HD3 1 1 19 14772 2 2 22 ARG HE H -15.223 8.195 2.540 1.00 . B B . 22 ARG HE 1 1 19 14773 2 2 22 ARG HG2 H -15.052 5.738 1.496 1.00 . B B . 22 ARG HG2 1 1 19 14774 2 2 22 ARG HG3 H -14.197 5.491 3.005 1.00 . B B . 22 ARG HG3 1 1 19 14775 2 2 22 ARG HH11 H -12.976 9.964 1.985 1.00 . B B . 22 ARG HH11 1 1 19 14776 2 2 22 ARG HH12 H -12.628 10.566 3.559 1.00 . B B . 22 ARG HH12 1 1 19 14777 2 2 22 ARG HH21 H -14.270 8.007 5.051 1.00 . B B . 22 ARG HH21 1 1 19 14778 2 2 22 ARG HH22 H -13.266 9.404 5.271 1.00 . B B . 22 ARG HH22 1 1 19 14779 2 2 22 ARG N N -11.183 5.242 2.431 1.00 . B B . 22 ARG N 1 1 19 14780 2 2 22 ARG NE N -14.254 8.127 2.625 1.00 . B B . 22 ARG NE 1 1 19 14781 2 2 22 ARG NH1 N -13.060 9.892 2.965 1.00 . B B . 22 ARG NH1 1 1 19 14782 2 2 22 ARG NH2 N -13.760 8.760 4.676 1.00 . B B . 22 ARG NH2 1 1 19 14783 2 2 22 ARG O O -10.634 2.115 2.440 1.00 . B B . 22 ARG O 1 1 19 14784 2 2 23 GLY C C -10.495 -0.125 0.695 1.00 . B B . 23 GLY C 1 1 19 14785 2 2 23 GLY CA C -11.692 0.706 0.205 1.00 . B B . 23 GLY CA 1 1 19 14786 2 2 23 GLY H H -12.780 2.544 0.311 1.00 . B B . 23 GLY H 1 1 19 14787 2 2 23 GLY HA2 H -12.549 0.059 0.297 1.00 . B B . 23 GLY HA2 1 1 19 14788 2 2 23 GLY HA3 H -11.530 0.833 -0.855 1.00 . B B . 23 GLY HA3 1 1 19 14789 2 2 23 GLY N N -12.069 2.064 0.774 1.00 . B B . 23 GLY N 1 1 19 14790 2 2 23 GLY O O -9.579 -0.314 -0.068 1.00 . B B . 23 GLY O 1 1 19 14791 2 2 24 PHE C C -9.238 -2.847 1.717 1.00 . B B . 24 PHE C 1 1 19 14792 2 2 24 PHE CA C -9.329 -1.439 2.419 1.00 . B B . 24 PHE CA 1 1 19 14793 2 2 24 PHE CB C -9.531 -1.594 3.951 1.00 . B B . 24 PHE CB 1 1 19 14794 2 2 24 PHE CD1 C -9.762 0.688 5.035 1.00 . B B . 24 PHE CD1 1 1 19 14795 2 2 24 PHE CD2 C -7.696 -0.454 5.263 1.00 . B B . 24 PHE CD2 1 1 19 14796 2 2 24 PHE CE1 C -9.271 1.736 5.785 1.00 . B B . 24 PHE CE1 1 1 19 14797 2 2 24 PHE CE2 C -7.201 0.590 6.014 1.00 . B B . 24 PHE CE2 1 1 19 14798 2 2 24 PHE CG C -8.983 -0.417 4.768 1.00 . B B . 24 PHE CG 1 1 19 14799 2 2 24 PHE CZ C -7.987 1.687 6.276 1.00 . B B . 24 PHE CZ 1 1 19 14800 2 2 24 PHE H H -11.253 -0.397 2.477 1.00 . B B . 24 PHE H 1 1 19 14801 2 2 24 PHE HA H -8.403 -0.915 2.219 1.00 . B B . 24 PHE HA 1 1 19 14802 2 2 24 PHE HB2 H -10.583 -1.696 4.173 1.00 . B B . 24 PHE HB2 1 1 19 14803 2 2 24 PHE HB3 H -9.041 -2.491 4.291 1.00 . B B . 24 PHE HB3 1 1 19 14804 2 2 24 PHE HD1 H -10.767 0.741 4.652 1.00 . B B . 24 PHE HD1 1 1 19 14805 2 2 24 PHE HD2 H -7.059 -1.304 5.064 1.00 . B B . 24 PHE HD2 1 1 19 14806 2 2 24 PHE HE1 H -9.900 2.596 5.983 1.00 . B B . 24 PHE HE1 1 1 19 14807 2 2 24 PHE HE2 H -6.194 0.543 6.399 1.00 . B B . 24 PHE HE2 1 1 19 14808 2 2 24 PHE HZ H -7.597 2.504 6.868 1.00 . B B . 24 PHE HZ 1 1 19 14809 2 2 24 PHE N N -10.490 -0.604 1.905 1.00 . B B . 24 PHE N 1 1 19 14810 2 2 24 PHE O O -9.409 -3.882 2.337 1.00 . B B . 24 PHE O 1 1 19 14811 2 2 25 PHE C C -7.427 -4.812 -0.380 1.00 . B B . 25 PHE C 1 1 19 14812 2 2 25 PHE CA C -8.856 -4.183 -0.314 1.00 . B B . 25 PHE CA 1 1 19 14813 2 2 25 PHE CB C -9.434 -3.864 -1.721 1.00 . B B . 25 PHE CB 1 1 19 14814 2 2 25 PHE CD1 C -10.588 -6.059 -2.188 1.00 . B B . 25 PHE CD1 1 1 19 14815 2 2 25 PHE CD2 C -8.821 -5.396 -3.628 1.00 . B B . 25 PHE CD2 1 1 19 14816 2 2 25 PHE CE1 C -10.759 -7.213 -2.924 1.00 . B B . 25 PHE CE1 1 1 19 14817 2 2 25 PHE CE2 C -8.986 -6.546 -4.368 1.00 . B B . 25 PHE CE2 1 1 19 14818 2 2 25 PHE CG C -9.619 -5.145 -2.537 1.00 . B B . 25 PHE CG 1 1 19 14819 2 2 25 PHE CZ C -9.956 -7.458 -4.016 1.00 . B B . 25 PHE CZ 1 1 19 14820 2 2 25 PHE H H -8.794 -2.038 -0.040 1.00 . B B . 25 PHE H 1 1 19 14821 2 2 25 PHE HA H -9.494 -4.918 0.156 1.00 . B B . 25 PHE HA 1 1 19 14822 2 2 25 PHE HB2 H -10.387 -3.366 -1.638 1.00 . B B . 25 PHE HB2 1 1 19 14823 2 2 25 PHE HB3 H -8.765 -3.207 -2.257 1.00 . B B . 25 PHE HB3 1 1 19 14824 2 2 25 PHE HD1 H -11.220 -5.867 -1.334 1.00 . B B . 25 PHE HD1 1 1 19 14825 2 2 25 PHE HD2 H -8.060 -4.678 -3.898 1.00 . B B . 25 PHE HD2 1 1 19 14826 2 2 25 PHE HE1 H -11.525 -7.921 -2.640 1.00 . B B . 25 PHE HE1 1 1 19 14827 2 2 25 PHE HE2 H -8.351 -6.724 -5.225 1.00 . B B . 25 PHE HE2 1 1 19 14828 2 2 25 PHE HZ H -10.088 -8.362 -4.595 1.00 . B B . 25 PHE HZ 1 1 19 14829 2 2 25 PHE N N -8.952 -2.880 0.445 1.00 . B B . 25 PHE N 1 1 19 14830 2 2 25 PHE O O -6.858 -5.084 -1.417 1.00 . B B . 25 PHE O 1 1 19 14831 2 2 26 TYR C C -4.765 -6.518 -0.058 1.00 . B B . 26 TYR C 1 1 19 14832 2 2 26 TYR CA C -5.510 -5.631 1.012 1.00 . B B . 26 TYR CA 1 1 19 14833 2 2 26 TYR CB C -5.613 -6.424 2.347 1.00 . B B . 26 TYR CB 1 1 19 14834 2 2 26 TYR CD1 C -4.593 -4.953 4.108 1.00 . B B . 26 TYR CD1 1 1 19 14835 2 2 26 TYR CD2 C -6.963 -5.044 4.015 1.00 . B B . 26 TYR CD2 1 1 19 14836 2 2 26 TYR CE1 C -4.667 -4.066 5.166 1.00 . B B . 26 TYR CE1 1 1 19 14837 2 2 26 TYR CE2 C -7.028 -4.155 5.076 1.00 . B B . 26 TYR CE2 1 1 19 14838 2 2 26 TYR CG C -5.738 -5.448 3.524 1.00 . B B . 26 TYR CG 1 1 19 14839 2 2 26 TYR CZ C -5.880 -3.666 5.650 1.00 . B B . 26 TYR CZ 1 1 19 14840 2 2 26 TYR H H -7.428 -4.762 1.558 1.00 . B B . 26 TYR H 1 1 19 14841 2 2 26 TYR HA H -4.833 -4.806 1.185 1.00 . B B . 26 TYR HA 1 1 19 14842 2 2 26 TYR HB2 H -6.478 -7.072 2.340 1.00 . B B . 26 TYR HB2 1 1 19 14843 2 2 26 TYR HB3 H -4.733 -7.034 2.501 1.00 . B B . 26 TYR HB3 1 1 19 14844 2 2 26 TYR HD1 H -3.631 -5.267 3.731 1.00 . B B . 26 TYR HD1 1 1 19 14845 2 2 26 TYR HD2 H -7.875 -5.423 3.573 1.00 . B B . 26 TYR HD2 1 1 19 14846 2 2 26 TYR HE1 H -3.775 -3.673 5.629 1.00 . B B . 26 TYR HE1 1 1 19 14847 2 2 26 TYR HE2 H -7.984 -3.841 5.463 1.00 . B B . 26 TYR HE2 1 1 19 14848 2 2 26 TYR HH H -6.785 -2.877 7.120 1.00 . B B . 26 TYR HH 1 1 19 14849 2 2 26 TYR N N -6.884 -5.026 0.787 1.00 . B B . 26 TYR N 1 1 19 14850 2 2 26 TYR O O -3.564 -6.671 0.037 1.00 . B B . 26 TYR O 1 1 19 14851 2 2 26 TYR OH O -5.927 -2.780 6.700 1.00 . B B . 26 TYR OH 1 1 19 14852 2 2 27 THR C C -3.318 -8.044 -2.356 1.00 . B B . 27 THR C 1 1 19 14853 2 2 27 THR CA C -4.854 -7.966 -2.102 1.00 . B B . 27 THR CA 1 1 19 14854 2 2 27 THR CB C -5.593 -7.586 -3.431 1.00 . B B . 27 THR CB 1 1 19 14855 2 2 27 THR CG2 C -5.237 -6.227 -4.016 1.00 . B B . 27 THR CG2 1 1 19 14856 2 2 27 THR H H -6.410 -6.923 -1.027 1.00 . B B . 27 THR H 1 1 19 14857 2 2 27 THR HA H -5.156 -8.979 -1.898 1.00 . B B . 27 THR HA 1 1 19 14858 2 2 27 THR HB H -6.667 -7.713 -3.334 1.00 . B B . 27 THR HB 1 1 19 14859 2 2 27 THR HG1 H -4.731 -7.919 -5.127 1.00 . B B . 27 THR HG1 1 1 19 14860 2 2 27 THR HG21 H -5.466 -5.465 -3.287 1.00 . B B . 27 THR HG21 1 1 19 14861 2 2 27 THR HG22 H -4.201 -6.137 -4.287 1.00 . B B . 27 THR HG22 1 1 19 14862 2 2 27 THR HG23 H -5.838 -6.037 -4.892 1.00 . B B . 27 THR HG23 1 1 19 14863 2 2 27 THR N N -5.446 -7.088 -1.014 1.00 . B B . 27 THR N 1 1 19 14864 2 2 27 THR O O -2.739 -9.067 -2.033 1.00 . B B . 27 THR O 1 1 19 14865 2 2 27 THR OG1 O -5.071 -8.473 -4.408 1.00 . B B . 27 THR OG1 1 1 19 14866 2 2 28 PRO C C -2.467 -8.428 -5.086 1.00 . B B . 28 PRO C 1 1 19 14867 2 2 28 PRO CA C -1.932 -7.285 -4.202 1.00 . B B . 28 PRO CA 1 1 19 14868 2 2 28 PRO CB C -0.482 -7.459 -3.742 1.00 . B B . 28 PRO CB 1 1 19 14869 2 2 28 PRO CD C -1.689 -6.398 -1.929 1.00 . B B . 28 PRO CD 1 1 19 14870 2 2 28 PRO CG C -0.366 -6.318 -2.724 1.00 . B B . 28 PRO CG 1 1 19 14871 2 2 28 PRO HA H -1.996 -6.412 -4.805 1.00 . B B . 28 PRO HA 1 1 19 14872 2 2 28 PRO HB2 H -0.301 -8.415 -3.270 1.00 . B B . 28 PRO HB2 1 1 19 14873 2 2 28 PRO HB3 H 0.206 -7.345 -4.567 1.00 . B B . 28 PRO HB3 1 1 19 14874 2 2 28 PRO HD2 H -1.563 -6.994 -1.036 1.00 . B B . 28 PRO HD2 1 1 19 14875 2 2 28 PRO HD3 H -2.051 -5.414 -1.659 1.00 . B B . 28 PRO HD3 1 1 19 14876 2 2 28 PRO HG2 H 0.485 -6.478 -2.080 1.00 . B B . 28 PRO HG2 1 1 19 14877 2 2 28 PRO HG3 H -0.253 -5.362 -3.210 1.00 . B B . 28 PRO HG3 1 1 19 14878 2 2 28 PRO N N -2.647 -7.046 -2.890 1.00 . B B . 28 PRO N 1 1 19 14879 2 2 28 PRO O O -3.039 -8.191 -6.130 1.00 . B B . 28 PRO O 1 1 19 14880 2 2 29 LYS C C -3.405 -10.978 -6.583 1.00 . B B . 29 LYS C 1 1 19 14881 2 2 29 LYS CA C -2.671 -10.922 -5.222 1.00 . B B . 29 LYS CA 1 1 19 14882 2 2 29 LYS CB C -3.514 -11.676 -4.127 1.00 . B B . 29 LYS CB 1 1 19 14883 2 2 29 LYS CD C -1.526 -12.180 -2.607 1.00 . B B . 29 LYS CD 1 1 19 14884 2 2 29 LYS CE C -2.098 -11.693 -1.280 1.00 . B B . 29 LYS CE 1 1 19 14885 2 2 29 LYS CG C -2.646 -12.811 -3.485 1.00 . B B . 29 LYS CG 1 1 19 14886 2 2 29 LYS H H -1.789 -9.546 -3.746 1.00 . B B . 29 LYS H 1 1 19 14887 2 2 29 LYS HA H -1.776 -11.454 -5.429 1.00 . B B . 29 LYS HA 1 1 19 14888 2 2 29 LYS HB2 H -3.839 -10.951 -3.389 1.00 . B B . 29 LYS HB2 1 1 19 14889 2 2 29 LYS HB3 H -4.413 -12.094 -4.564 1.00 . B B . 29 LYS HB3 1 1 19 14890 2 2 29 LYS HD2 H -0.748 -12.904 -2.404 1.00 . B B . 29 LYS HD2 1 1 19 14891 2 2 29 LYS HD3 H -1.057 -11.360 -3.133 1.00 . B B . 29 LYS HD3 1 1 19 14892 2 2 29 LYS HE2 H -3.095 -11.283 -1.409 1.00 . B B . 29 LYS HE2 1 1 19 14893 2 2 29 LYS HE3 H -2.154 -12.514 -0.573 1.00 . B B . 29 LYS HE3 1 1 19 14894 2 2 29 LYS HG2 H -3.274 -13.475 -2.903 1.00 . B B . 29 LYS HG2 1 1 19 14895 2 2 29 LYS HG3 H -2.192 -13.407 -4.270 1.00 . B B . 29 LYS HG3 1 1 19 14896 2 2 29 LYS HZ1 H -0.404 -10.562 -1.491 1.00 . B B . 29 LYS HZ1 1 1 19 14897 2 2 29 LYS HZ2 H -1.601 -9.721 -0.739 1.00 . B B . 29 LYS HZ2 1 1 19 14898 2 2 29 LYS HZ3 H -0.605 -10.902 0.050 1.00 . B B . 29 LYS HZ3 1 1 19 14899 2 2 29 LYS N N -2.261 -9.604 -4.597 1.00 . B B . 29 LYS N 1 1 19 14900 2 2 29 LYS NZ N -1.168 -10.659 -0.794 1.00 . B B . 29 LYS NZ 1 1 19 14901 2 2 29 LYS O O -3.021 -11.686 -7.490 1.00 . B B . 29 LYS O 1 1 19 14902 2 2 30 THR C C -5.076 -11.080 -9.048 1.00 . B B . 30 THR C 1 1 19 14903 2 2 30 THR CA C -5.345 -10.098 -7.879 1.00 . B B . 30 THR CA 1 1 19 14904 2 2 30 THR CB C -5.231 -8.640 -8.397 1.00 . B B . 30 THR CB 1 1 19 14905 2 2 30 THR CG2 C -3.996 -8.401 -9.242 1.00 . B B . 30 THR CG2 1 1 19 14906 2 2 30 THR H H -4.594 -9.721 -5.828 1.00 . B B . 30 THR H 1 1 19 14907 2 2 30 THR HA H -6.371 -10.252 -7.582 1.00 . B B . 30 THR HA 1 1 19 14908 2 2 30 THR HB H -5.357 -7.903 -7.612 1.00 . B B . 30 THR HB 1 1 19 14909 2 2 30 THR HG1 H -6.151 -9.216 -10.028 1.00 . B B . 30 THR HG1 1 1 19 14910 2 2 30 THR HG21 H -3.110 -8.611 -8.662 1.00 . B B . 30 THR HG21 1 1 19 14911 2 2 30 THR HG22 H -3.996 -9.019 -10.128 1.00 . B B . 30 THR HG22 1 1 19 14912 2 2 30 THR HG23 H -3.976 -7.367 -9.551 1.00 . B B . 30 THR HG23 1 1 19 14913 2 2 30 THR N N -4.446 -10.222 -6.654 1.00 . B B . 30 THR N 1 1 19 14914 2 2 30 THR O O -5.735 -11.055 -10.074 1.00 . B B . 30 THR O 1 1 19 14915 2 2 30 THR OG1 O -6.228 -8.490 -9.390 1.00 . B B . 30 THR OG1 1 1 20 14916 1 1 1 GLY C C 0.057 -5.544 3.121 1.00 . A A . 1 GLY C 1 1 20 14917 1 1 1 GLY CA C -1.099 -5.399 4.113 1.00 . A A . 1 GLY CA 1 1 20 14918 1 1 1 GLY HA2 H -0.691 -5.573 5.098 1.00 . A A . 1 GLY HA2 1 1 20 14919 1 1 1 GLY HA3 H -1.832 -6.159 3.894 1.00 . A A . 1 GLY HA3 1 1 20 14920 1 1 1 GLY N N -1.735 -4.032 4.079 1.00 . A A . 1 GLY N 1 1 20 14921 1 1 1 GLY O O 1.075 -6.103 3.446 1.00 . A A . 1 GLY O 1 1 20 14922 1 1 2 ILE C C 2.176 -5.633 0.845 1.00 . A A . 2 ILE C 1 1 20 14923 1 1 2 ILE CA C 0.760 -5.005 0.738 1.00 . A A . 2 ILE CA 1 1 20 14924 1 1 2 ILE CB C 0.834 -3.498 0.314 1.00 . A A . 2 ILE CB 1 1 20 14925 1 1 2 ILE CD1 C -0.125 -2.098 2.139 1.00 . A A . 2 ILE CD1 1 1 20 14926 1 1 2 ILE CG1 C -0.404 -2.653 0.711 1.00 . A A . 2 ILE CG1 1 1 20 14927 1 1 2 ILE CG2 C 0.949 -3.443 -1.210 1.00 . A A . 2 ILE CG2 1 1 20 14928 1 1 2 ILE H H -1.053 -4.619 1.874 1.00 . A A . 2 ILE H 1 1 20 14929 1 1 2 ILE HA H 0.360 -5.541 -0.102 1.00 . A A . 2 ILE HA 1 1 20 14930 1 1 2 ILE HB H 1.690 -3.060 0.801 1.00 . A A . 2 ILE HB 1 1 20 14931 1 1 2 ILE HD11 H 0.072 -2.867 2.873 1.00 . A A . 2 ILE HD11 1 1 20 14932 1 1 2 ILE HD12 H 0.741 -1.464 2.082 1.00 . A A . 2 ILE HD12 1 1 20 14933 1 1 2 ILE HD13 H -0.906 -1.486 2.533 1.00 . A A . 2 ILE HD13 1 1 20 14934 1 1 2 ILE HG12 H -0.521 -1.822 0.029 1.00 . A A . 2 ILE HG12 1 1 20 14935 1 1 2 ILE HG13 H -1.311 -3.235 0.675 1.00 . A A . 2 ILE HG13 1 1 20 14936 1 1 2 ILE HG21 H 0.125 -3.967 -1.670 1.00 . A A . 2 ILE HG21 1 1 20 14937 1 1 2 ILE HG22 H 0.948 -2.422 -1.555 1.00 . A A . 2 ILE HG22 1 1 20 14938 1 1 2 ILE HG23 H 1.862 -3.912 -1.538 1.00 . A A . 2 ILE HG23 1 1 20 14939 1 1 2 ILE N N -0.173 -5.032 1.946 1.00 . A A . 2 ILE N 1 1 20 14940 1 1 2 ILE O O 3.186 -5.084 0.471 1.00 . A A . 2 ILE O 1 1 20 14941 1 1 3 VAL C C 4.546 -7.711 0.563 1.00 . A A . 3 VAL C 1 1 20 14942 1 1 3 VAL CA C 3.381 -7.672 1.592 1.00 . A A . 3 VAL CA 1 1 20 14943 1 1 3 VAL CB C 2.764 -9.091 1.858 1.00 . A A . 3 VAL CB 1 1 20 14944 1 1 3 VAL CG1 C 1.841 -9.046 3.092 1.00 . A A . 3 VAL CG1 1 1 20 14945 1 1 3 VAL CG2 C 1.849 -9.502 0.666 1.00 . A A . 3 VAL CG2 1 1 20 14946 1 1 3 VAL H H 1.311 -7.164 1.633 1.00 . A A . 3 VAL H 1 1 20 14947 1 1 3 VAL HA H 3.862 -7.256 2.455 1.00 . A A . 3 VAL HA 1 1 20 14948 1 1 3 VAL HB H 3.554 -9.811 2.033 1.00 . A A . 3 VAL HB 1 1 20 14949 1 1 3 VAL HG11 H 2.400 -8.710 3.954 1.00 . A A . 3 VAL HG11 1 1 20 14950 1 1 3 VAL HG12 H 1.005 -8.381 2.954 1.00 . A A . 3 VAL HG12 1 1 20 14951 1 1 3 VAL HG13 H 1.454 -10.034 3.294 1.00 . A A . 3 VAL HG13 1 1 20 14952 1 1 3 VAL HG21 H 2.399 -9.532 -0.263 1.00 . A A . 3 VAL HG21 1 1 20 14953 1 1 3 VAL HG22 H 1.443 -10.488 0.844 1.00 . A A . 3 VAL HG22 1 1 20 14954 1 1 3 VAL HG23 H 1.025 -8.815 0.539 1.00 . A A . 3 VAL HG23 1 1 20 14955 1 1 3 VAL N N 2.177 -6.812 1.361 1.00 . A A . 3 VAL N 1 1 20 14956 1 1 3 VAL O O 5.236 -6.719 0.373 1.00 . A A . 3 VAL O 1 1 20 14957 1 1 4 GLU C C 5.538 -8.213 -2.372 1.00 . A A . 4 GLU C 1 1 20 14958 1 1 4 GLU CA C 5.852 -8.979 -1.081 1.00 . A A . 4 GLU CA 1 1 20 14959 1 1 4 GLU CB C 6.032 -10.504 -1.320 1.00 . A A . 4 GLU CB 1 1 20 14960 1 1 4 GLU CD C 6.016 -10.829 1.246 1.00 . A A . 4 GLU CD 1 1 20 14961 1 1 4 GLU CG C 6.697 -11.194 -0.060 1.00 . A A . 4 GLU CG 1 1 20 14962 1 1 4 GLU H H 4.206 -9.611 0.147 1.00 . A A . 4 GLU H 1 1 20 14963 1 1 4 GLU HA H 6.719 -8.511 -0.653 1.00 . A A . 4 GLU HA 1 1 20 14964 1 1 4 GLU HB2 H 5.067 -10.955 -1.501 1.00 . A A . 4 GLU HB2 1 1 20 14965 1 1 4 GLU HB3 H 6.645 -10.666 -2.196 1.00 . A A . 4 GLU HB3 1 1 20 14966 1 1 4 GLU HG2 H 6.629 -12.265 -0.148 1.00 . A A . 4 GLU HG2 1 1 20 14967 1 1 4 GLU HG3 H 7.737 -10.934 0.033 1.00 . A A . 4 GLU HG3 1 1 20 14968 1 1 4 GLU N N 4.758 -8.831 -0.066 1.00 . A A . 4 GLU N 1 1 20 14969 1 1 4 GLU O O 5.163 -8.702 -3.420 1.00 . A A . 4 GLU O 1 1 20 14970 1 1 4 GLU OE1 O 5.059 -11.509 1.550 1.00 . A A . 4 GLU OE1 1 1 20 14971 1 1 4 GLU OE2 O 6.498 -9.882 1.841 1.00 . A A . 4 GLU OE2 1 1 20 14972 1 1 5 GLN C C 5.653 -4.521 -2.408 1.00 . A A . 5 GLN C 1 1 20 14973 1 1 5 GLN CA C 5.543 -5.847 -3.136 1.00 . A A . 5 GLN CA 1 1 20 14974 1 1 5 GLN CB C 4.143 -6.019 -3.815 1.00 . A A . 5 GLN CB 1 1 20 14975 1 1 5 GLN CD C 1.607 -6.214 -3.252 1.00 . A A . 5 GLN CD 1 1 20 14976 1 1 5 GLN CG C 3.024 -6.274 -2.715 1.00 . A A . 5 GLN CG 1 1 20 14977 1 1 5 GLN H H 6.041 -6.749 -1.260 1.00 . A A . 5 GLN H 1 1 20 14978 1 1 5 GLN HA H 6.413 -5.806 -3.796 1.00 . A A . 5 GLN HA 1 1 20 14979 1 1 5 GLN HB2 H 3.912 -5.140 -4.399 1.00 . A A . 5 GLN HB2 1 1 20 14980 1 1 5 GLN HB3 H 4.193 -6.864 -4.491 1.00 . A A . 5 GLN HB3 1 1 20 14981 1 1 5 GLN HE21 H 2.147 -5.956 -5.117 1.00 . A A . 5 GLN HE21 1 1 20 14982 1 1 5 GLN HE22 H 0.484 -5.959 -4.829 1.00 . A A . 5 GLN HE22 1 1 20 14983 1 1 5 GLN HG2 H 3.140 -7.262 -2.295 1.00 . A A . 5 GLN HG2 1 1 20 14984 1 1 5 GLN HG3 H 3.078 -5.567 -1.912 1.00 . A A . 5 GLN HG3 1 1 20 14985 1 1 5 GLN N N 5.733 -6.950 -2.161 1.00 . A A . 5 GLN N 1 1 20 14986 1 1 5 GLN NE2 N 1.400 -6.029 -4.502 1.00 . A A . 5 GLN NE2 1 1 20 14987 1 1 5 GLN O O 6.387 -3.709 -2.901 1.00 . A A . 5 GLN O 1 1 20 14988 1 1 5 GLN OE1 O 0.650 -6.334 -2.523 1.00 . A A . 5 GLN OE1 1 1 20 14989 1 1 6 CYS C C 6.165 -2.912 0.487 1.00 . A A . 6 CYS C 1 1 20 14990 1 1 6 CYS CA C 5.298 -2.839 -0.762 1.00 . A A . 6 CYS CA 1 1 20 14991 1 1 6 CYS CB C 3.980 -2.189 -0.513 1.00 . A A . 6 CYS CB 1 1 20 14992 1 1 6 CYS H H 4.377 -4.832 -0.838 1.00 . A A . 6 CYS H 1 1 20 14993 1 1 6 CYS HA H 5.817 -2.207 -1.459 1.00 . A A . 6 CYS HA 1 1 20 14994 1 1 6 CYS HB2 H 3.346 -2.908 -0.046 1.00 . A A . 6 CYS HB2 1 1 20 14995 1 1 6 CYS HB3 H 4.107 -1.332 0.129 1.00 . A A . 6 CYS HB3 1 1 20 14996 1 1 6 CYS HG H 3.514 -0.744 -2.231 1.00 . A A . 6 CYS HG 1 1 20 14997 1 1 6 CYS N N 5.014 -4.221 -1.311 1.00 . A A . 6 CYS N 1 1 20 14998 1 1 6 CYS O O 6.820 -1.964 0.858 1.00 . A A . 6 CYS O 1 1 20 14999 1 1 6 CYS SG S 3.178 -1.620 -2.021 1.00 . A A . 6 CYS SG 1 1 20 15000 1 1 7 CYS C C 8.233 -5.015 1.788 1.00 . A A . 7 CYS C 1 1 20 15001 1 1 7 CYS CA C 6.960 -4.311 2.304 1.00 . A A . 7 CYS CA 1 1 20 15002 1 1 7 CYS CB C 5.995 -5.132 3.164 1.00 . A A . 7 CYS CB 1 1 20 15003 1 1 7 CYS H H 5.644 -4.824 0.714 1.00 . A A . 7 CYS H 1 1 20 15004 1 1 7 CYS HA H 7.251 -3.380 2.772 1.00 . A A . 7 CYS HA 1 1 20 15005 1 1 7 CYS HB2 H 5.268 -4.416 3.534 1.00 . A A . 7 CYS HB2 1 1 20 15006 1 1 7 CYS HB3 H 5.436 -5.792 2.519 1.00 . A A . 7 CYS HB3 1 1 20 15007 1 1 7 CYS HG H 7.094 -6.835 4.170 1.00 . A A . 7 CYS HG 1 1 20 15008 1 1 7 CYS N N 6.165 -4.067 1.073 1.00 . A A . 7 CYS N 1 1 20 15009 1 1 7 CYS O O 9.348 -4.658 2.103 1.00 . A A . 7 CYS O 1 1 20 15010 1 1 7 CYS SG S 6.644 -6.083 4.564 1.00 . A A . 7 CYS SG 1 1 20 15011 1 1 8 THR C C 9.097 -6.738 -1.182 1.00 . A A . 8 THR C 1 1 20 15012 1 1 8 THR CA C 9.145 -6.793 0.368 1.00 . A A . 8 THR CA 1 1 20 15013 1 1 8 THR CB C 9.060 -8.270 0.846 1.00 . A A . 8 THR CB 1 1 20 15014 1 1 8 THR CG2 C 10.430 -8.860 0.987 1.00 . A A . 8 THR CG2 1 1 20 15015 1 1 8 THR H H 7.076 -6.219 0.777 1.00 . A A . 8 THR H 1 1 20 15016 1 1 8 THR HA H 10.088 -6.382 0.693 1.00 . A A . 8 THR HA 1 1 20 15017 1 1 8 THR HB H 8.381 -8.926 0.320 1.00 . A A . 8 THR HB 1 1 20 15018 1 1 8 THR HG1 H 7.942 -8.752 2.295 1.00 . A A . 8 THR HG1 1 1 20 15019 1 1 8 THR HG21 H 10.990 -8.296 1.720 1.00 . A A . 8 THR HG21 1 1 20 15020 1 1 8 THR HG22 H 10.320 -9.875 1.338 1.00 . A A . 8 THR HG22 1 1 20 15021 1 1 8 THR HG23 H 10.947 -8.855 0.042 1.00 . A A . 8 THR HG23 1 1 20 15022 1 1 8 THR N N 8.009 -6.003 0.973 1.00 . A A . 8 THR N 1 1 20 15023 1 1 8 THR O O 8.535 -7.604 -1.813 1.00 . A A . 8 THR O 1 1 20 15024 1 1 8 THR OG1 O 8.744 -8.198 2.222 1.00 . A A . 8 THR OG1 1 1 20 15025 1 1 9 SER C C 8.926 -4.202 -3.800 1.00 . A A . 9 SER C 1 1 20 15026 1 1 9 SER CA C 9.769 -5.413 -3.271 1.00 . A A . 9 SER CA 1 1 20 15027 1 1 9 SER CB C 9.347 -6.641 -4.104 1.00 . A A . 9 SER CB 1 1 20 15028 1 1 9 SER H H 10.093 -5.073 -1.130 1.00 . A A . 9 SER H 1 1 20 15029 1 1 9 SER HA H 10.798 -5.202 -3.524 1.00 . A A . 9 SER HA 1 1 20 15030 1 1 9 SER HB2 H 9.848 -7.533 -3.755 1.00 . A A . 9 SER HB2 1 1 20 15031 1 1 9 SER HB3 H 8.275 -6.785 -4.097 1.00 . A A . 9 SER HB3 1 1 20 15032 1 1 9 SER HG H 9.186 -5.663 -5.799 1.00 . A A . 9 SER HG 1 1 20 15033 1 1 9 SER N N 9.676 -5.704 -1.752 1.00 . A A . 9 SER N 1 1 20 15034 1 1 9 SER O O 8.330 -4.209 -4.858 1.00 . A A . 9 SER O 1 1 20 15035 1 1 9 SER OG O 9.812 -6.295 -5.406 1.00 . A A . 9 SER OG 1 1 20 15036 1 1 10 ILE C C 7.503 -1.497 -4.391 1.00 . A A . 10 ILE C 1 1 20 15037 1 1 10 ILE CA C 8.272 -1.855 -3.075 1.00 . A A . 10 ILE CA 1 1 20 15038 1 1 10 ILE CB C 9.381 -0.786 -2.721 1.00 . A A . 10 ILE CB 1 1 20 15039 1 1 10 ILE CD1 C 8.160 1.374 -3.581 1.00 . A A . 10 ILE CD1 1 1 20 15040 1 1 10 ILE CG1 C 8.802 0.632 -2.385 1.00 . A A . 10 ILE CG1 1 1 20 15041 1 1 10 ILE CG2 C 10.511 -0.638 -3.740 1.00 . A A . 10 ILE CG2 1 1 20 15042 1 1 10 ILE H H 9.453 -3.456 -2.184 1.00 . A A . 10 ILE H 1 1 20 15043 1 1 10 ILE HA H 7.552 -1.793 -2.281 1.00 . A A . 10 ILE HA 1 1 20 15044 1 1 10 ILE HB H 9.834 -1.151 -1.814 1.00 . A A . 10 ILE HB 1 1 20 15045 1 1 10 ILE HD11 H 8.877 1.472 -4.384 1.00 . A A . 10 ILE HD11 1 1 20 15046 1 1 10 ILE HD12 H 7.290 0.863 -3.958 1.00 . A A . 10 ILE HD12 1 1 20 15047 1 1 10 ILE HD13 H 7.858 2.365 -3.283 1.00 . A A . 10 ILE HD13 1 1 20 15048 1 1 10 ILE HG12 H 8.095 0.538 -1.567 1.00 . A A . 10 ILE HG12 1 1 20 15049 1 1 10 ILE HG13 H 9.620 1.221 -2.007 1.00 . A A . 10 ILE HG13 1 1 20 15050 1 1 10 ILE HG21 H 11.045 -1.565 -3.869 1.00 . A A . 10 ILE HG21 1 1 20 15051 1 1 10 ILE HG22 H 10.122 -0.325 -4.695 1.00 . A A . 10 ILE HG22 1 1 20 15052 1 1 10 ILE HG23 H 11.211 0.112 -3.391 1.00 . A A . 10 ILE HG23 1 1 20 15053 1 1 10 ILE N N 8.945 -3.217 -2.959 1.00 . A A . 10 ILE N 1 1 20 15054 1 1 10 ILE O O 7.994 -1.194 -5.463 1.00 . A A . 10 ILE O 1 1 20 15055 1 1 11 CYS C C 4.670 0.186 -5.012 1.00 . A A . 11 CYS C 1 1 20 15056 1 1 11 CYS CA C 5.137 -1.282 -5.155 1.00 . A A . 11 CYS CA 1 1 20 15057 1 1 11 CYS CB C 4.002 -2.302 -4.834 1.00 . A A . 11 CYS CB 1 1 20 15058 1 1 11 CYS H H 5.956 -1.784 -3.283 1.00 . A A . 11 CYS H 1 1 20 15059 1 1 11 CYS HA H 5.519 -1.434 -6.155 1.00 . A A . 11 CYS HA 1 1 20 15060 1 1 11 CYS HB2 H 3.633 -2.785 -5.716 1.00 . A A . 11 CYS HB2 1 1 20 15061 1 1 11 CYS HB3 H 4.450 -3.061 -4.209 1.00 . A A . 11 CYS HB3 1 1 20 15062 1 1 11 CYS HG H 2.173 -1.013 -4.297 1.00 . A A . 11 CYS HG 1 1 20 15063 1 1 11 CYS N N 6.220 -1.546 -4.178 1.00 . A A . 11 CYS N 1 1 20 15064 1 1 11 CYS O O 4.059 0.576 -4.043 1.00 . A A . 11 CYS O 1 1 20 15065 1 1 11 CYS SG S 2.575 -1.767 -3.861 1.00 . A A . 11 CYS SG 1 1 20 15066 1 1 12 SER C C 3.273 2.929 -5.679 1.00 . A A . 12 SER C 1 1 20 15067 1 1 12 SER CA C 4.666 2.429 -6.098 1.00 . A A . 12 SER CA 1 1 20 15068 1 1 12 SER CB C 4.926 2.869 -7.527 1.00 . A A . 12 SER CB 1 1 20 15069 1 1 12 SER H H 5.520 0.478 -6.687 1.00 . A A . 12 SER H 1 1 20 15070 1 1 12 SER HA H 5.275 2.971 -5.442 1.00 . A A . 12 SER HA 1 1 20 15071 1 1 12 SER HB2 H 5.862 2.474 -7.903 1.00 . A A . 12 SER HB2 1 1 20 15072 1 1 12 SER HB3 H 4.109 2.538 -8.151 1.00 . A A . 12 SER HB3 1 1 20 15073 1 1 12 SER HG H 5.347 4.605 -8.296 1.00 . A A . 12 SER HG 1 1 20 15074 1 1 12 SER N N 5.011 0.947 -6.000 1.00 . A A . 12 SER N 1 1 20 15075 1 1 12 SER O O 2.405 2.167 -5.332 1.00 . A A . 12 SER O 1 1 20 15076 1 1 12 SER OG O 4.966 4.297 -7.452 1.00 . A A . 12 SER OG 1 1 20 15077 1 1 13 LEU C C 0.621 4.182 -6.149 1.00 . A A . 13 LEU C 1 1 20 15078 1 1 13 LEU CA C 1.734 4.826 -5.332 1.00 . A A . 13 LEU CA 1 1 20 15079 1 1 13 LEU CB C 1.868 6.351 -5.585 1.00 . A A . 13 LEU CB 1 1 20 15080 1 1 13 LEU CD1 C 0.003 6.954 -4.021 1.00 . A A . 13 LEU CD1 1 1 20 15081 1 1 13 LEU CD2 C 0.744 8.548 -5.740 1.00 . A A . 13 LEU CD2 1 1 20 15082 1 1 13 LEU CG C 0.515 7.072 -5.451 1.00 . A A . 13 LEU CG 1 1 20 15083 1 1 13 LEU H H 3.809 4.760 -6.038 1.00 . A A . 13 LEU H 1 1 20 15084 1 1 13 LEU HA H 1.486 4.574 -4.306 1.00 . A A . 13 LEU HA 1 1 20 15085 1 1 13 LEU HB2 H 2.561 6.761 -4.865 1.00 . A A . 13 LEU HB2 1 1 20 15086 1 1 13 LEU HB3 H 2.276 6.520 -6.573 1.00 . A A . 13 LEU HB3 1 1 20 15087 1 1 13 LEU HD11 H 0.711 7.381 -3.326 1.00 . A A . 13 LEU HD11 1 1 20 15088 1 1 13 LEU HD12 H -0.938 7.480 -3.926 1.00 . A A . 13 LEU HD12 1 1 20 15089 1 1 13 LEU HD13 H -0.162 5.919 -3.761 1.00 . A A . 13 LEU HD13 1 1 20 15090 1 1 13 LEU HD21 H 1.452 8.967 -5.040 1.00 . A A . 13 LEU HD21 1 1 20 15091 1 1 13 LEU HD22 H 1.128 8.680 -6.741 1.00 . A A . 13 LEU HD22 1 1 20 15092 1 1 13 LEU HD23 H -0.185 9.094 -5.657 1.00 . A A . 13 LEU HD23 1 1 20 15093 1 1 13 LEU HG H -0.219 6.671 -6.144 1.00 . A A . 13 LEU HG 1 1 20 15094 1 1 13 LEU N N 3.060 4.215 -5.719 1.00 . A A . 13 LEU N 1 1 20 15095 1 1 13 LEU O O -0.381 3.731 -5.623 1.00 . A A . 13 LEU O 1 1 20 15096 1 1 14 TYR C C -0.292 2.056 -7.944 1.00 . A A . 14 TYR C 1 1 20 15097 1 1 14 TYR CA C -0.174 3.528 -8.333 1.00 . A A . 14 TYR CA 1 1 20 15098 1 1 14 TYR CB C 0.235 3.681 -9.840 1.00 . A A . 14 TYR CB 1 1 20 15099 1 1 14 TYR CD1 C 2.139 5.308 -9.748 1.00 . A A . 14 TYR CD1 1 1 20 15100 1 1 14 TYR CD2 C 2.615 3.050 -10.295 1.00 . A A . 14 TYR CD2 1 1 20 15101 1 1 14 TYR CE1 C 3.478 5.607 -9.835 1.00 . A A . 14 TYR CE1 1 1 20 15102 1 1 14 TYR CE2 C 3.953 3.353 -10.383 1.00 . A A . 14 TYR CE2 1 1 20 15103 1 1 14 TYR CG C 1.708 4.022 -9.977 1.00 . A A . 14 TYR CG 1 1 20 15104 1 1 14 TYR CZ C 4.382 4.631 -10.150 1.00 . A A . 14 TYR CZ 1 1 20 15105 1 1 14 TYR H H 1.699 4.517 -7.752 1.00 . A A . 14 TYR H 1 1 20 15106 1 1 14 TYR HA H -1.145 3.971 -8.148 1.00 . A A . 14 TYR HA 1 1 20 15107 1 1 14 TYR HB2 H 0.029 2.744 -10.345 1.00 . A A . 14 TYR HB2 1 1 20 15108 1 1 14 TYR HB3 H -0.368 4.445 -10.302 1.00 . A A . 14 TYR HB3 1 1 20 15109 1 1 14 TYR HD1 H 1.421 6.079 -9.503 1.00 . A A . 14 TYR HD1 1 1 20 15110 1 1 14 TYR HD2 H 2.270 2.048 -10.476 1.00 . A A . 14 TYR HD2 1 1 20 15111 1 1 14 TYR HE1 H 3.825 6.610 -9.651 1.00 . A A . 14 TYR HE1 1 1 20 15112 1 1 14 TYR HE2 H 4.665 2.581 -10.631 1.00 . A A . 14 TYR HE2 1 1 20 15113 1 1 14 TYR HH H 5.925 5.100 -11.120 1.00 . A A . 14 TYR HH 1 1 20 15114 1 1 14 TYR N N 0.851 4.147 -7.431 1.00 . A A . 14 TYR N 1 1 20 15115 1 1 14 TYR O O -1.235 1.418 -8.347 1.00 . A A . 14 TYR O 1 1 20 15116 1 1 14 TYR OH O 5.718 4.937 -10.194 1.00 . A A . 14 TYR OH 1 1 20 15117 1 1 15 GLN C C -0.349 0.091 -5.520 1.00 . A A . 15 GLN C 1 1 20 15118 1 1 15 GLN CA C 0.432 0.081 -6.837 1.00 . A A . 15 GLN CA 1 1 20 15119 1 1 15 GLN CB C 1.789 -0.665 -6.690 1.00 . A A . 15 GLN CB 1 1 20 15120 1 1 15 GLN CD C 2.758 -0.333 -9.081 1.00 . A A . 15 GLN CD 1 1 20 15121 1 1 15 GLN CG C 2.272 -1.310 -8.033 1.00 . A A . 15 GLN CG 1 1 20 15122 1 1 15 GLN H H 1.457 2.016 -6.898 1.00 . A A . 15 GLN H 1 1 20 15123 1 1 15 GLN HA H -0.255 -0.341 -7.507 1.00 . A A . 15 GLN HA 1 1 20 15124 1 1 15 GLN HB2 H 2.532 0.003 -6.287 1.00 . A A . 15 GLN HB2 1 1 20 15125 1 1 15 GLN HB3 H 1.637 -1.481 -6.003 1.00 . A A . 15 GLN HB3 1 1 20 15126 1 1 15 GLN HE21 H 1.450 -0.908 -10.430 1.00 . A A . 15 GLN HE21 1 1 20 15127 1 1 15 GLN HE22 H 2.558 0.297 -10.905 1.00 . A A . 15 GLN HE22 1 1 20 15128 1 1 15 GLN HG2 H 3.089 -1.987 -7.839 1.00 . A A . 15 GLN HG2 1 1 20 15129 1 1 15 GLN HG3 H 1.465 -1.882 -8.468 1.00 . A A . 15 GLN HG3 1 1 20 15130 1 1 15 GLN N N 0.649 1.516 -7.196 1.00 . A A . 15 GLN N 1 1 20 15131 1 1 15 GLN NE2 N 2.202 -0.317 -10.238 1.00 . A A . 15 GLN NE2 1 1 20 15132 1 1 15 GLN O O -1.368 -0.542 -5.380 1.00 . A A . 15 GLN O 1 1 20 15133 1 1 15 GLN OE1 O 3.664 0.440 -8.886 1.00 . A A . 15 GLN OE1 1 1 20 15134 1 1 16 LEU C C -2.079 0.941 -3.382 1.00 . A A . 16 LEU C 1 1 20 15135 1 1 16 LEU CA C -0.538 0.914 -3.233 1.00 . A A . 16 LEU CA 1 1 20 15136 1 1 16 LEU CB C -0.050 2.208 -2.510 1.00 . A A . 16 LEU CB 1 1 20 15137 1 1 16 LEU CD1 C 0.458 0.966 -0.319 1.00 . A A . 16 LEU CD1 1 1 20 15138 1 1 16 LEU CD2 C 2.194 1.239 -2.030 1.00 . A A . 16 LEU CD2 1 1 20 15139 1 1 16 LEU CG C 1.000 1.913 -1.409 1.00 . A A . 16 LEU CG 1 1 20 15140 1 1 16 LEU H H 0.960 1.249 -4.808 1.00 . A A . 16 LEU H 1 1 20 15141 1 1 16 LEU HA H -0.274 0.041 -2.675 1.00 . A A . 16 LEU HA 1 1 20 15142 1 1 16 LEU HB2 H 0.375 2.876 -3.246 1.00 . A A . 16 LEU HB2 1 1 20 15143 1 1 16 LEU HB3 H -0.893 2.707 -2.055 1.00 . A A . 16 LEU HB3 1 1 20 15144 1 1 16 LEU HD11 H -0.411 1.383 0.165 1.00 . A A . 16 LEU HD11 1 1 20 15145 1 1 16 LEU HD12 H 0.196 0.002 -0.728 1.00 . A A . 16 LEU HD12 1 1 20 15146 1 1 16 LEU HD13 H 1.217 0.800 0.434 1.00 . A A . 16 LEU HD13 1 1 20 15147 1 1 16 LEU HD21 H 1.895 0.342 -2.548 1.00 . A A . 16 LEU HD21 1 1 20 15148 1 1 16 LEU HD22 H 2.669 1.891 -2.748 1.00 . A A . 16 LEU HD22 1 1 20 15149 1 1 16 LEU HD23 H 2.918 0.963 -1.280 1.00 . A A . 16 LEU HD23 1 1 20 15150 1 1 16 LEU HG H 1.311 2.851 -0.965 1.00 . A A . 16 LEU HG 1 1 20 15151 1 1 16 LEU N N 0.138 0.805 -4.569 1.00 . A A . 16 LEU N 1 1 20 15152 1 1 16 LEU O O -2.799 0.232 -2.699 1.00 . A A . 16 LEU O 1 1 20 15153 1 1 17 GLU C C -4.648 0.463 -4.723 1.00 . A A . 17 GLU C 1 1 20 15154 1 1 17 GLU CA C -4.031 1.876 -4.520 1.00 . A A . 17 GLU CA 1 1 20 15155 1 1 17 GLU CB C -4.290 2.805 -5.769 1.00 . A A . 17 GLU CB 1 1 20 15156 1 1 17 GLU CD C -5.149 1.103 -7.619 1.00 . A A . 17 GLU CD 1 1 20 15157 1 1 17 GLU CG C -4.054 2.093 -7.163 1.00 . A A . 17 GLU CG 1 1 20 15158 1 1 17 GLU H H -1.863 2.294 -4.805 1.00 . A A . 17 GLU H 1 1 20 15159 1 1 17 GLU HA H -4.506 2.300 -3.649 1.00 . A A . 17 GLU HA 1 1 20 15160 1 1 17 GLU HB2 H -5.319 3.139 -5.733 1.00 . A A . 17 GLU HB2 1 1 20 15161 1 1 17 GLU HB3 H -3.658 3.679 -5.700 1.00 . A A . 17 GLU HB3 1 1 20 15162 1 1 17 GLU HG2 H -3.974 2.827 -7.943 1.00 . A A . 17 GLU HG2 1 1 20 15163 1 1 17 GLU HG3 H -3.129 1.548 -7.143 1.00 . A A . 17 GLU HG3 1 1 20 15164 1 1 17 GLU N N -2.532 1.770 -4.291 1.00 . A A . 17 GLU N 1 1 20 15165 1 1 17 GLU O O -5.580 0.081 -4.039 1.00 . A A . 17 GLU O 1 1 20 15166 1 1 17 GLU OE1 O -6.217 1.073 -7.033 1.00 . A A . 17 GLU OE1 1 1 20 15167 1 1 17 GLU OE2 O -4.841 0.395 -8.555 1.00 . A A . 17 GLU OE2 1 1 20 15168 1 1 18 ASN C C -4.850 -2.549 -4.775 1.00 . A A . 18 ASN C 1 1 20 15169 1 1 18 ASN CA C -4.510 -1.664 -6.016 1.00 . A A . 18 ASN CA 1 1 20 15170 1 1 18 ASN CB C -3.321 -2.179 -6.915 1.00 . A A . 18 ASN CB 1 1 20 15171 1 1 18 ASN CG C -3.397 -3.635 -7.289 1.00 . A A . 18 ASN CG 1 1 20 15172 1 1 18 ASN H H -3.340 0.133 -6.121 1.00 . A A . 18 ASN H 1 1 20 15173 1 1 18 ASN HA H -5.418 -1.577 -6.593 1.00 . A A . 18 ASN HA 1 1 20 15174 1 1 18 ASN HB2 H -3.321 -1.599 -7.832 1.00 . A A . 18 ASN HB2 1 1 20 15175 1 1 18 ASN HB3 H -2.367 -2.036 -6.456 1.00 . A A . 18 ASN HB3 1 1 20 15176 1 1 18 ASN HD21 H -5.323 -3.811 -6.992 1.00 . A A . 18 ASN HD21 1 1 20 15177 1 1 18 ASN HD22 H -4.492 -5.224 -7.490 1.00 . A A . 18 ASN HD22 1 1 20 15178 1 1 18 ASN N N -4.090 -0.271 -5.643 1.00 . A A . 18 ASN N 1 1 20 15179 1 1 18 ASN ND2 N -4.507 -4.277 -7.253 1.00 . A A . 18 ASN ND2 1 1 20 15180 1 1 18 ASN O O -5.537 -3.552 -4.865 1.00 . A A . 18 ASN O 1 1 20 15181 1 1 18 ASN OD1 O -2.413 -4.250 -7.633 1.00 . A A . 18 ASN OD1 1 1 20 15182 1 1 19 TYR C C -5.474 -1.913 -1.508 1.00 . A A . 19 TYR C 1 1 20 15183 1 1 19 TYR CA C -4.554 -2.857 -2.329 1.00 . A A . 19 TYR CA 1 1 20 15184 1 1 19 TYR CB C -3.116 -3.106 -1.708 1.00 . A A . 19 TYR CB 1 1 20 15185 1 1 19 TYR CD1 C -2.547 -4.615 -3.638 1.00 . A A . 19 TYR CD1 1 1 20 15186 1 1 19 TYR CD2 C -1.214 -2.697 -3.288 1.00 . A A . 19 TYR CD2 1 1 20 15187 1 1 19 TYR CE1 C -1.795 -4.930 -4.748 1.00 . A A . 19 TYR CE1 1 1 20 15188 1 1 19 TYR CE2 C -0.468 -3.021 -4.397 1.00 . A A . 19 TYR CE2 1 1 20 15189 1 1 19 TYR CG C -2.257 -3.492 -2.905 1.00 . A A . 19 TYR CG 1 1 20 15190 1 1 19 TYR CZ C -0.756 -4.134 -5.129 1.00 . A A . 19 TYR CZ 1 1 20 15191 1 1 19 TYR H H -3.780 -1.344 -3.697 1.00 . A A . 19 TYR H 1 1 20 15192 1 1 19 TYR HA H -5.090 -3.778 -2.494 1.00 . A A . 19 TYR HA 1 1 20 15193 1 1 19 TYR HB2 H -2.689 -2.237 -1.229 1.00 . A A . 19 TYR HB2 1 1 20 15194 1 1 19 TYR HB3 H -3.089 -3.936 -1.014 1.00 . A A . 19 TYR HB3 1 1 20 15195 1 1 19 TYR HD1 H -3.367 -5.246 -3.339 1.00 . A A . 19 TYR HD1 1 1 20 15196 1 1 19 TYR HD2 H -0.983 -1.816 -2.714 1.00 . A A . 19 TYR HD2 1 1 20 15197 1 1 19 TYR HE1 H -2.018 -5.803 -5.336 1.00 . A A . 19 TYR HE1 1 1 20 15198 1 1 19 TYR HE2 H 0.348 -2.392 -4.694 1.00 . A A . 19 TYR HE2 1 1 20 15199 1 1 19 TYR HH H -0.725 -4.481 -6.924 1.00 . A A . 19 TYR HH 1 1 20 15200 1 1 19 TYR N N -4.337 -2.150 -3.645 1.00 . A A . 19 TYR N 1 1 20 15201 1 1 19 TYR O O -6.333 -2.352 -0.770 1.00 . A A . 19 TYR O 1 1 20 15202 1 1 19 TYR OH O -0.030 -4.464 -6.246 1.00 . A A . 19 TYR OH 1 1 20 15203 1 1 20 CYS C C -6.863 1.380 -1.869 1.00 . A A . 20 CYS C 1 1 20 15204 1 1 20 CYS CA C -6.076 0.408 -0.947 1.00 . A A . 20 CYS CA 1 1 20 15205 1 1 20 CYS CB C -5.175 1.232 -0.077 1.00 . A A . 20 CYS CB 1 1 20 15206 1 1 20 CYS H H -4.525 -0.360 -2.232 1.00 . A A . 20 CYS H 1 1 20 15207 1 1 20 CYS HA H -6.787 -0.065 -0.289 1.00 . A A . 20 CYS HA 1 1 20 15208 1 1 20 CYS HB2 H -4.916 0.605 0.745 1.00 . A A . 20 CYS HB2 1 1 20 15209 1 1 20 CYS HB3 H -4.281 1.504 -0.627 1.00 . A A . 20 CYS HB3 1 1 20 15210 1 1 20 CYS HG H -6.238 2.499 1.516 1.00 . A A . 20 CYS HG 1 1 20 15211 1 1 20 CYS N N -5.264 -0.639 -1.648 1.00 . A A . 20 CYS N 1 1 20 15212 1 1 20 CYS O O -6.444 2.491 -2.117 1.00 . A A . 20 CYS O 1 1 20 15213 1 1 20 CYS SG S -5.948 2.709 0.625 1.00 . A A . 20 CYS SG 1 1 20 15214 1 1 21 ASN C C -10.313 1.688 -2.700 1.00 . A A . 21 ASN C 1 1 20 15215 1 1 21 ASN CA C -8.859 1.739 -3.246 1.00 . A A . 21 ASN CA 1 1 20 15216 1 1 21 ASN CB C -8.710 1.149 -4.685 1.00 . A A . 21 ASN CB 1 1 20 15217 1 1 21 ASN CG C -8.536 -0.352 -4.672 1.00 . A A . 21 ASN CG 1 1 20 15218 1 1 21 ASN H H -8.241 0.005 -2.138 1.00 . A A . 21 ASN H 1 1 20 15219 1 1 21 ASN HA H -8.555 2.779 -3.231 1.00 . A A . 21 ASN HA 1 1 20 15220 1 1 21 ASN HB2 H -9.561 1.380 -5.302 1.00 . A A . 21 ASN HB2 1 1 20 15221 1 1 21 ASN HB3 H -7.827 1.566 -5.147 1.00 . A A . 21 ASN HB3 1 1 20 15222 1 1 21 ASN HD21 H -7.117 -0.276 -5.996 1.00 . A A . 21 ASN HD21 1 1 20 15223 1 1 21 ASN HD22 H -7.528 -1.839 -5.435 1.00 . A A . 21 ASN HD22 1 1 20 15224 1 1 21 ASN N N -7.972 0.919 -2.352 1.00 . A A . 21 ASN N 1 1 20 15225 1 1 21 ASN ND2 N -7.653 -0.878 -5.431 1.00 . A A . 21 ASN ND2 1 1 20 15226 1 1 21 ASN O O -10.517 1.227 -1.582 1.00 . A A . 21 ASN O 1 1 20 15227 1 1 21 ASN OD1 O -9.195 -1.088 -3.974 1.00 . A A . 21 ASN OD1 1 1 20 15228 2 2 1 PHE C C 5.246 6.864 -0.800 1.00 . B B . 1 PHE C 1 1 20 15229 2 2 1 PHE CA C 4.252 7.907 -1.399 1.00 . B B . 1 PHE CA 1 1 20 15230 2 2 1 PHE CB C 4.050 9.109 -0.438 1.00 . B B . 1 PHE CB 1 1 20 15231 2 2 1 PHE CD1 C 5.782 10.721 -1.340 1.00 . B B . 1 PHE CD1 1 1 20 15232 2 2 1 PHE CD2 C 6.158 9.770 0.802 1.00 . B B . 1 PHE CD2 1 1 20 15233 2 2 1 PHE CE1 C 6.968 11.421 -1.240 1.00 . B B . 1 PHE CE1 1 1 20 15234 2 2 1 PHE CE2 C 7.343 10.467 0.909 1.00 . B B . 1 PHE CE2 1 1 20 15235 2 2 1 PHE CG C 5.368 9.890 -0.319 1.00 . B B . 1 PHE CG 1 1 20 15236 2 2 1 PHE CZ C 7.750 11.294 -0.113 1.00 . B B . 1 PHE CZ 1 1 20 15237 2 2 1 PHE HA H 4.680 8.257 -2.329 1.00 . B B . 1 PHE HA 1 1 20 15238 2 2 1 PHE HB2 H 3.285 9.776 -0.805 1.00 . B B . 1 PHE HB2 1 1 20 15239 2 2 1 PHE HB3 H 3.767 8.757 0.544 1.00 . B B . 1 PHE HB3 1 1 20 15240 2 2 1 PHE HD1 H 5.173 10.825 -2.224 1.00 . B B . 1 PHE HD1 1 1 20 15241 2 2 1 PHE HD2 H 5.844 9.117 1.605 1.00 . B B . 1 PHE HD2 1 1 20 15242 2 2 1 PHE HE1 H 7.282 12.070 -2.045 1.00 . B B . 1 PHE HE1 1 1 20 15243 2 2 1 PHE HE2 H 7.951 10.362 1.797 1.00 . B B . 1 PHE HE2 1 1 20 15244 2 2 1 PHE HZ H 8.678 11.842 -0.032 1.00 . B B . 1 PHE HZ 1 1 20 15245 2 2 1 PHE N N 2.893 7.327 -1.673 1.00 . B B . 1 PHE N 1 1 20 15246 2 2 1 PHE O O 5.571 6.881 0.369 1.00 . B B . 1 PHE O 1 1 20 15247 2 2 2 VAL C C 7.979 5.096 -1.952 1.00 . B B . 2 VAL C 1 1 20 15248 2 2 2 VAL CA C 6.645 4.906 -1.219 1.00 . B B . 2 VAL CA 1 1 20 15249 2 2 2 VAL CB C 6.004 3.519 -1.541 1.00 . B B . 2 VAL CB 1 1 20 15250 2 2 2 VAL CG1 C 4.817 3.303 -0.599 1.00 . B B . 2 VAL CG1 1 1 20 15251 2 2 2 VAL CG2 C 5.421 3.512 -2.961 1.00 . B B . 2 VAL CG2 1 1 20 15252 2 2 2 VAL H H 5.459 5.902 -2.528 1.00 . B B . 2 VAL H 1 1 20 15253 2 2 2 VAL HA H 6.787 5.001 -0.171 1.00 . B B . 2 VAL HA 1 1 20 15254 2 2 2 VAL HB H 6.717 2.709 -1.414 1.00 . B B . 2 VAL HB 1 1 20 15255 2 2 2 VAL HG11 H 5.136 3.341 0.433 1.00 . B B . 2 VAL HG11 1 1 20 15256 2 2 2 VAL HG12 H 4.060 4.061 -0.748 1.00 . B B . 2 VAL HG12 1 1 20 15257 2 2 2 VAL HG13 H 4.374 2.336 -0.783 1.00 . B B . 2 VAL HG13 1 1 20 15258 2 2 2 VAL HG21 H 6.185 3.740 -3.691 1.00 . B B . 2 VAL HG21 1 1 20 15259 2 2 2 VAL HG22 H 5.020 2.531 -3.172 1.00 . B B . 2 VAL HG22 1 1 20 15260 2 2 2 VAL HG23 H 4.615 4.226 -3.065 1.00 . B B . 2 VAL HG23 1 1 20 15261 2 2 2 VAL N N 5.704 5.957 -1.614 1.00 . B B . 2 VAL N 1 1 20 15262 2 2 2 VAL O O 8.185 6.024 -2.704 1.00 . B B . 2 VAL O 1 1 20 15263 2 2 3 ASN C C 11.185 3.034 -1.842 1.00 . B B . 3 ASN C 1 1 20 15264 2 2 3 ASN CA C 10.244 4.166 -2.308 1.00 . B B . 3 ASN CA 1 1 20 15265 2 2 3 ASN CB C 10.884 5.580 -2.019 1.00 . B B . 3 ASN CB 1 1 20 15266 2 2 3 ASN CG C 10.358 6.112 -0.706 1.00 . B B . 3 ASN CG 1 1 20 15267 2 2 3 ASN H H 8.506 3.495 -1.102 1.00 . B B . 3 ASN H 1 1 20 15268 2 2 3 ASN HA H 10.141 3.998 -3.352 1.00 . B B . 3 ASN HA 1 1 20 15269 2 2 3 ASN HB2 H 11.958 5.523 -1.943 1.00 . B B . 3 ASN HB2 1 1 20 15270 2 2 3 ASN HB3 H 10.612 6.277 -2.793 1.00 . B B . 3 ASN HB3 1 1 20 15271 2 2 3 ASN HD21 H 9.831 7.872 -1.403 1.00 . B B . 3 ASN HD21 1 1 20 15272 2 2 3 ASN HD22 H 9.548 7.595 0.252 1.00 . B B . 3 ASN HD22 1 1 20 15273 2 2 3 ASN N N 8.849 4.174 -1.703 1.00 . B B . 3 ASN N 1 1 20 15274 2 2 3 ASN ND2 N 9.873 7.294 -0.617 1.00 . B B . 3 ASN ND2 1 1 20 15275 2 2 3 ASN O O 11.965 2.482 -2.586 1.00 . B B . 3 ASN O 1 1 20 15276 2 2 3 ASN OD1 O 10.365 5.435 0.291 1.00 . B B . 3 ASN OD1 1 1 20 15277 2 2 4 GLN C C 10.964 0.513 0.607 1.00 . B B . 4 GLN C 1 1 20 15278 2 2 4 GLN CA C 11.858 1.680 0.093 1.00 . B B . 4 GLN CA 1 1 20 15279 2 2 4 GLN CB C 12.634 2.393 1.235 1.00 . B B . 4 GLN CB 1 1 20 15280 2 2 4 GLN CD C 10.311 2.778 2.357 1.00 . B B . 4 GLN CD 1 1 20 15281 2 2 4 GLN CG C 11.714 3.321 2.141 1.00 . B B . 4 GLN CG 1 1 20 15282 2 2 4 GLN H H 10.411 3.261 -0.108 1.00 . B B . 4 GLN H 1 1 20 15283 2 2 4 GLN HA H 12.557 1.245 -0.610 1.00 . B B . 4 GLN HA 1 1 20 15284 2 2 4 GLN HB2 H 13.164 1.667 1.832 1.00 . B B . 4 GLN HB2 1 1 20 15285 2 2 4 GLN HB3 H 13.372 3.008 0.739 1.00 . B B . 4 GLN HB3 1 1 20 15286 2 2 4 GLN HE21 H 9.479 4.105 1.209 1.00 . B B . 4 GLN HE21 1 1 20 15287 2 2 4 GLN HE22 H 8.434 2.932 1.908 1.00 . B B . 4 GLN HE22 1 1 20 15288 2 2 4 GLN HG2 H 12.152 3.405 3.124 1.00 . B B . 4 GLN HG2 1 1 20 15289 2 2 4 GLN HG3 H 11.640 4.317 1.739 1.00 . B B . 4 GLN HG3 1 1 20 15290 2 2 4 GLN N N 11.063 2.742 -0.594 1.00 . B B . 4 GLN N 1 1 20 15291 2 2 4 GLN NE2 N 9.316 3.324 1.765 1.00 . B B . 4 GLN NE2 1 1 20 15292 2 2 4 GLN O O 9.973 0.166 0.010 1.00 . B B . 4 GLN O 1 1 20 15293 2 2 4 GLN OE1 O 10.079 1.836 3.064 1.00 . B B . 4 GLN OE1 1 1 20 15294 2 2 5 HIS C C 9.863 -0.958 3.656 1.00 . B B . 5 HIS C 1 1 20 15295 2 2 5 HIS CA C 10.514 -1.230 2.273 1.00 . B B . 5 HIS CA 1 1 20 15296 2 2 5 HIS CB C 11.479 -2.439 2.303 1.00 . B B . 5 HIS CB 1 1 20 15297 2 2 5 HIS CD2 C 12.073 -4.247 0.472 1.00 . B B . 5 HIS CD2 1 1 20 15298 2 2 5 HIS CE1 C 11.556 -3.174 -1.221 1.00 . B B . 5 HIS CE1 1 1 20 15299 2 2 5 HIS CG C 11.615 -3.019 0.892 1.00 . B B . 5 HIS CG 1 1 20 15300 2 2 5 HIS H H 12.110 0.256 2.122 1.00 . B B . 5 HIS H 1 1 20 15301 2 2 5 HIS HA H 9.710 -1.502 1.600 1.00 . B B . 5 HIS HA 1 1 20 15302 2 2 5 HIS HB2 H 12.454 -2.148 2.659 1.00 . B B . 5 HIS HB2 1 1 20 15303 2 2 5 HIS HB3 H 11.089 -3.211 2.950 1.00 . B B . 5 HIS HB3 1 1 20 15304 2 2 5 HIS HD1 H 10.940 -1.496 -0.222 1.00 . B B . 5 HIS HD1 1 1 20 15305 2 2 5 HIS HD2 H 12.416 -5.025 1.138 1.00 . B B . 5 HIS HD2 1 1 20 15306 2 2 5 HIS HE1 H 11.402 -2.900 -2.258 1.00 . B B . 5 HIS HE1 1 1 20 15307 2 2 5 HIS N N 11.311 -0.083 1.695 1.00 . B B . 5 HIS N 1 1 20 15308 2 2 5 HIS ND1 N 11.312 -2.409 -0.202 1.00 . B B . 5 HIS ND1 1 1 20 15309 2 2 5 HIS NE2 N 12.032 -4.330 -0.841 1.00 . B B . 5 HIS NE2 1 1 20 15310 2 2 5 HIS O O 10.448 -1.094 4.715 1.00 . B B . 5 HIS O 1 1 20 15311 2 2 6 LEU C C 6.776 -1.413 4.948 1.00 . B B . 6 LEU C 1 1 20 15312 2 2 6 LEU CA C 7.794 -0.253 4.776 1.00 . B B . 6 LEU CA 1 1 20 15313 2 2 6 LEU CB C 7.147 1.163 4.500 1.00 . B B . 6 LEU CB 1 1 20 15314 2 2 6 LEU CD1 C 5.599 2.719 3.298 1.00 . B B . 6 LEU CD1 1 1 20 15315 2 2 6 LEU CD2 C 6.466 0.807 2.071 1.00 . B B . 6 LEU CD2 1 1 20 15316 2 2 6 LEU CG C 6.012 1.254 3.444 1.00 . B B . 6 LEU CG 1 1 20 15317 2 2 6 LEU H H 8.245 -0.509 2.674 1.00 . B B . 6 LEU H 1 1 20 15318 2 2 6 LEU HA H 8.429 -0.214 5.649 1.00 . B B . 6 LEU HA 1 1 20 15319 2 2 6 LEU HB2 H 6.770 1.561 5.428 1.00 . B B . 6 LEU HB2 1 1 20 15320 2 2 6 LEU HB3 H 7.950 1.805 4.167 1.00 . B B . 6 LEU HB3 1 1 20 15321 2 2 6 LEU HD11 H 5.253 3.118 4.238 1.00 . B B . 6 LEU HD11 1 1 20 15322 2 2 6 LEU HD12 H 6.429 3.327 2.966 1.00 . B B . 6 LEU HD12 1 1 20 15323 2 2 6 LEU HD13 H 4.798 2.816 2.581 1.00 . B B . 6 LEU HD13 1 1 20 15324 2 2 6 LEU HD21 H 7.342 1.341 1.736 1.00 . B B . 6 LEU HD21 1 1 20 15325 2 2 6 LEU HD22 H 6.683 -0.241 2.122 1.00 . B B . 6 LEU HD22 1 1 20 15326 2 2 6 LEU HD23 H 5.676 0.935 1.348 1.00 . B B . 6 LEU HD23 1 1 20 15327 2 2 6 LEU HG H 5.169 0.654 3.765 1.00 . B B . 6 LEU HG 1 1 20 15328 2 2 6 LEU N N 8.624 -0.573 3.570 1.00 . B B . 6 LEU N 1 1 20 15329 2 2 6 LEU O O 6.067 -1.766 4.031 1.00 . B B . 6 LEU O 1 1 20 15330 2 2 7 CYS C C 4.487 -2.931 7.210 1.00 . B B . 7 CYS C 1 1 20 15331 2 2 7 CYS CA C 5.741 -3.140 6.332 1.00 . B B . 7 CYS CA 1 1 20 15332 2 2 7 CYS CB C 6.589 -4.310 6.880 1.00 . B B . 7 CYS CB 1 1 20 15333 2 2 7 CYS H H 7.286 -1.661 6.834 1.00 . B B . 7 CYS H 1 1 20 15334 2 2 7 CYS HA H 5.358 -3.460 5.373 1.00 . B B . 7 CYS HA 1 1 20 15335 2 2 7 CYS HB2 H 7.568 -4.281 6.422 1.00 . B B . 7 CYS HB2 1 1 20 15336 2 2 7 CYS HB3 H 6.717 -4.188 7.947 1.00 . B B . 7 CYS HB3 1 1 20 15337 2 2 7 CYS HG H 5.372 -6.217 7.341 1.00 . B B . 7 CYS HG 1 1 20 15338 2 2 7 CYS N N 6.706 -1.991 6.121 1.00 . B B . 7 CYS N 1 1 20 15339 2 2 7 CYS O O 3.427 -3.415 6.879 1.00 . B B . 7 CYS O 1 1 20 15340 2 2 7 CYS SG S 5.925 -5.973 6.595 1.00 . B B . 7 CYS SG 1 1 20 15341 2 2 8 GLY C C 2.945 -0.578 9.167 1.00 . B B . 8 GLY C 1 1 20 15342 2 2 8 GLY CA C 3.377 -2.018 9.176 1.00 . B B . 8 GLY CA 1 1 20 15343 2 2 8 GLY H H 5.466 -1.861 8.555 1.00 . B B . 8 GLY H 1 1 20 15344 2 2 8 GLY HA2 H 2.540 -2.595 8.827 1.00 . B B . 8 GLY HA2 1 1 20 15345 2 2 8 GLY HA3 H 3.620 -2.275 10.197 1.00 . B B . 8 GLY HA3 1 1 20 15346 2 2 8 GLY N N 4.597 -2.236 8.304 1.00 . B B . 8 GLY N 1 1 20 15347 2 2 8 GLY O O 2.485 -0.045 8.182 1.00 . B B . 8 GLY O 1 1 20 15348 2 2 9 ASP C C 2.914 2.382 9.291 1.00 . B B . 9 ASP C 1 1 20 15349 2 2 9 ASP CA C 2.759 1.438 10.532 1.00 . B B . 9 ASP CA 1 1 20 15350 2 2 9 ASP CB C 3.687 1.754 11.748 1.00 . B B . 9 ASP CB 1 1 20 15351 2 2 9 ASP CG C 5.003 0.990 11.573 1.00 . B B . 9 ASP CG 1 1 20 15352 2 2 9 ASP H H 3.474 -0.487 11.049 1.00 . B B . 9 ASP H 1 1 20 15353 2 2 9 ASP HA H 1.693 1.459 10.757 1.00 . B B . 9 ASP HA 1 1 20 15354 2 2 9 ASP HB2 H 3.934 2.802 11.787 1.00 . B B . 9 ASP HB2 1 1 20 15355 2 2 9 ASP HB3 H 3.245 1.457 12.684 1.00 . B B . 9 ASP HB3 1 1 20 15356 2 2 9 ASP N N 3.097 0.011 10.289 1.00 . B B . 9 ASP N 1 1 20 15357 2 2 9 ASP O O 1.980 2.958 8.777 1.00 . B B . 9 ASP O 1 1 20 15358 2 2 9 ASP OD1 O 5.789 1.377 10.733 1.00 . B B . 9 ASP OD1 1 1 20 15359 2 2 9 ASP OD2 O 5.106 0.021 12.291 1.00 . B B . 9 ASP OD2 1 1 20 15360 2 2 10 HIS C C 3.628 2.865 6.359 1.00 . B B . 10 HIS C 1 1 20 15361 2 2 10 HIS CA C 4.364 3.379 7.627 1.00 . B B . 10 HIS CA 1 1 20 15362 2 2 10 HIS CB C 5.898 3.422 7.515 1.00 . B B . 10 HIS CB 1 1 20 15363 2 2 10 HIS CD2 C 7.253 4.437 5.468 1.00 . B B . 10 HIS CD2 1 1 20 15364 2 2 10 HIS CE1 C 6.432 6.332 5.493 1.00 . B B . 10 HIS CE1 1 1 20 15365 2 2 10 HIS CG C 6.336 4.474 6.500 1.00 . B B . 10 HIS CG 1 1 20 15366 2 2 10 HIS H H 4.803 1.962 9.261 1.00 . B B . 10 HIS H 1 1 20 15367 2 2 10 HIS HA H 3.977 4.364 7.847 1.00 . B B . 10 HIS HA 1 1 20 15368 2 2 10 HIS HB2 H 6.286 3.707 8.483 1.00 . B B . 10 HIS HB2 1 1 20 15369 2 2 10 HIS HB3 H 6.285 2.456 7.250 1.00 . B B . 10 HIS HB3 1 1 20 15370 2 2 10 HIS HD1 H 5.179 6.028 7.084 1.00 . B B . 10 HIS HD1 1 1 20 15371 2 2 10 HIS HD2 H 7.851 3.584 5.205 1.00 . B B . 10 HIS HD2 1 1 20 15372 2 2 10 HIS HE1 H 6.210 7.362 5.247 1.00 . B B . 10 HIS HE1 1 1 20 15373 2 2 10 HIS N N 4.109 2.490 8.810 1.00 . B B . 10 HIS N 1 1 20 15374 2 2 10 HIS ND1 N 5.869 5.672 6.457 1.00 . B B . 10 HIS ND1 1 1 20 15375 2 2 10 HIS NE2 N 7.302 5.599 4.849 1.00 . B B . 10 HIS NE2 1 1 20 15376 2 2 10 HIS O O 3.243 3.587 5.459 1.00 . B B . 10 HIS O 1 1 20 15377 2 2 11 LEU C C 1.213 1.355 5.269 1.00 . B B . 11 LEU C 1 1 20 15378 2 2 11 LEU CA C 2.714 0.971 5.135 1.00 . B B . 11 LEU CA 1 1 20 15379 2 2 11 LEU CB C 2.963 -0.555 5.201 1.00 . B B . 11 LEU CB 1 1 20 15380 2 2 11 LEU CD1 C 3.152 -0.780 2.703 1.00 . B B . 11 LEU CD1 1 1 20 15381 2 2 11 LEU CD2 C 2.573 -2.725 4.094 1.00 . B B . 11 LEU CD2 1 1 20 15382 2 2 11 LEU CG C 2.386 -1.224 3.963 1.00 . B B . 11 LEU CG 1 1 20 15383 2 2 11 LEU H H 3.725 1.036 7.063 1.00 . B B . 11 LEU H 1 1 20 15384 2 2 11 LEU HA H 3.079 1.412 4.220 1.00 . B B . 11 LEU HA 1 1 20 15385 2 2 11 LEU HB2 H 4.023 -0.759 5.253 1.00 . B B . 11 LEU HB2 1 1 20 15386 2 2 11 LEU HB3 H 2.492 -0.984 6.074 1.00 . B B . 11 LEU HB3 1 1 20 15387 2 2 11 LEU HD11 H 4.197 -1.043 2.791 1.00 . B B . 11 LEU HD11 1 1 20 15388 2 2 11 LEU HD12 H 2.762 -1.285 1.835 1.00 . B B . 11 LEU HD12 1 1 20 15389 2 2 11 LEU HD13 H 3.073 0.282 2.536 1.00 . B B . 11 LEU HD13 1 1 20 15390 2 2 11 LEU HD21 H 3.621 -2.957 4.194 1.00 . B B . 11 LEU HD21 1 1 20 15391 2 2 11 LEU HD22 H 2.054 -3.099 4.963 1.00 . B B . 11 LEU HD22 1 1 20 15392 2 2 11 LEU HD23 H 2.195 -3.243 3.225 1.00 . B B . 11 LEU HD23 1 1 20 15393 2 2 11 LEU HG H 1.332 -0.984 3.912 1.00 . B B . 11 LEU HG 1 1 20 15394 2 2 11 LEU N N 3.421 1.581 6.310 1.00 . B B . 11 LEU N 1 1 20 15395 2 2 11 LEU O O 0.546 1.737 4.324 1.00 . B B . 11 LEU O 1 1 20 15396 2 2 12 VAL C C -0.845 3.164 6.404 1.00 . B B . 12 VAL C 1 1 20 15397 2 2 12 VAL CA C -0.767 1.641 6.609 1.00 . B B . 12 VAL CA 1 1 20 15398 2 2 12 VAL CB C -1.301 1.253 8.005 1.00 . B B . 12 VAL CB 1 1 20 15399 2 2 12 VAL CG1 C -0.542 1.906 9.127 1.00 . B B . 12 VAL CG1 1 1 20 15400 2 2 12 VAL CG2 C -2.761 1.725 8.082 1.00 . B B . 12 VAL CG2 1 1 20 15401 2 2 12 VAL H H 1.245 0.932 7.185 1.00 . B B . 12 VAL H 1 1 20 15402 2 2 12 VAL HA H -1.353 1.180 5.829 1.00 . B B . 12 VAL HA 1 1 20 15403 2 2 12 VAL HB H -1.183 0.180 8.096 1.00 . B B . 12 VAL HB 1 1 20 15404 2 2 12 VAL HG11 H -0.505 2.983 9.034 1.00 . B B . 12 VAL HG11 1 1 20 15405 2 2 12 VAL HG12 H -0.966 1.661 10.085 1.00 . B B . 12 VAL HG12 1 1 20 15406 2 2 12 VAL HG13 H 0.457 1.512 9.092 1.00 . B B . 12 VAL HG13 1 1 20 15407 2 2 12 VAL HG21 H -3.343 1.263 7.297 1.00 . B B . 12 VAL HG21 1 1 20 15408 2 2 12 VAL HG22 H -3.193 1.475 9.037 1.00 . B B . 12 VAL HG22 1 1 20 15409 2 2 12 VAL HG23 H -2.819 2.798 7.952 1.00 . B B . 12 VAL HG23 1 1 20 15410 2 2 12 VAL N N 0.679 1.257 6.455 1.00 . B B . 12 VAL N 1 1 20 15411 2 2 12 VAL O O -1.787 3.621 5.783 1.00 . B B . 12 VAL O 1 1 20 15412 2 2 13 GLU C C -0.147 5.699 5.273 1.00 . B B . 13 GLU C 1 1 20 15413 2 2 13 GLU CA C 0.132 5.406 6.755 1.00 . B B . 13 GLU CA 1 1 20 15414 2 2 13 GLU CB C 1.511 5.964 7.125 1.00 . B B . 13 GLU CB 1 1 20 15415 2 2 13 GLU CD C 2.990 6.755 9.082 1.00 . B B . 13 GLU CD 1 1 20 15416 2 2 13 GLU CG C 1.638 6.178 8.667 1.00 . B B . 13 GLU CG 1 1 20 15417 2 2 13 GLU H H 0.816 3.491 7.459 1.00 . B B . 13 GLU H 1 1 20 15418 2 2 13 GLU HA H -0.639 5.848 7.359 1.00 . B B . 13 GLU HA 1 1 20 15419 2 2 13 GLU HB2 H 2.289 5.292 6.793 1.00 . B B . 13 GLU HB2 1 1 20 15420 2 2 13 GLU HB3 H 1.678 6.914 6.634 1.00 . B B . 13 GLU HB3 1 1 20 15421 2 2 13 GLU HG2 H 0.889 6.859 9.032 1.00 . B B . 13 GLU HG2 1 1 20 15422 2 2 13 GLU HG3 H 1.542 5.245 9.195 1.00 . B B . 13 GLU HG3 1 1 20 15423 2 2 13 GLU N N 0.106 3.907 6.927 1.00 . B B . 13 GLU N 1 1 20 15424 2 2 13 GLU O O -0.738 6.687 4.885 1.00 . B B . 13 GLU O 1 1 20 15425 2 2 13 GLU OE1 O 3.909 6.705 8.282 1.00 . B B . 13 GLU OE1 1 1 20 15426 2 2 13 GLU OE2 O 3.004 7.211 10.205 1.00 . B B . 13 GLU OE2 1 1 20 15427 2 2 14 ALA C C -1.327 4.452 2.685 1.00 . B B . 14 ALA C 1 1 20 15428 2 2 14 ALA CA C 0.121 4.914 3.009 1.00 . B B . 14 ALA CA 1 1 20 15429 2 2 14 ALA CB C 1.222 4.048 2.330 1.00 . B B . 14 ALA CB 1 1 20 15430 2 2 14 ALA H H 0.815 4.032 4.854 1.00 . B B . 14 ALA H 1 1 20 15431 2 2 14 ALA HA H 0.178 5.957 2.787 1.00 . B B . 14 ALA HA 1 1 20 15432 2 2 14 ALA HB1 H 2.195 4.403 2.643 1.00 . B B . 14 ALA HB1 1 1 20 15433 2 2 14 ALA HB2 H 1.138 3.013 2.617 1.00 . B B . 14 ALA HB2 1 1 20 15434 2 2 14 ALA HB3 H 1.158 4.107 1.254 1.00 . B B . 14 ALA HB3 1 1 20 15435 2 2 14 ALA N N 0.322 4.785 4.466 1.00 . B B . 14 ALA N 1 1 20 15436 2 2 14 ALA O O -2.086 5.201 2.104 1.00 . B B . 14 ALA O 1 1 20 15437 2 2 15 LEU C C -4.188 3.837 3.188 1.00 . B B . 15 LEU C 1 1 20 15438 2 2 15 LEU CA C -3.110 2.803 2.742 1.00 . B B . 15 LEU CA 1 1 20 15439 2 2 15 LEU CB C -3.476 1.481 3.461 1.00 . B B . 15 LEU CB 1 1 20 15440 2 2 15 LEU CD1 C -2.773 -0.780 4.202 1.00 . B B . 15 LEU CD1 1 1 20 15441 2 2 15 LEU CD2 C -3.067 -0.361 1.827 1.00 . B B . 15 LEU CD2 1 1 20 15442 2 2 15 LEU CG C -2.559 0.283 3.119 1.00 . B B . 15 LEU CG 1 1 20 15443 2 2 15 LEU H H -1.039 2.687 3.504 1.00 . B B . 15 LEU H 1 1 20 15444 2 2 15 LEU HA H -3.217 2.681 1.674 1.00 . B B . 15 LEU HA 1 1 20 15445 2 2 15 LEU HB2 H -3.517 1.670 4.521 1.00 . B B . 15 LEU HB2 1 1 20 15446 2 2 15 LEU HB3 H -4.494 1.249 3.149 1.00 . B B . 15 LEU HB3 1 1 20 15447 2 2 15 LEU HD11 H -2.542 -0.380 5.177 1.00 . B B . 15 LEU HD11 1 1 20 15448 2 2 15 LEU HD12 H -3.796 -1.122 4.202 1.00 . B B . 15 LEU HD12 1 1 20 15449 2 2 15 LEU HD13 H -2.144 -1.640 4.053 1.00 . B B . 15 LEU HD13 1 1 20 15450 2 2 15 LEU HD21 H -4.088 -0.685 1.962 1.00 . B B . 15 LEU HD21 1 1 20 15451 2 2 15 LEU HD22 H -2.994 0.349 1.017 1.00 . B B . 15 LEU HD22 1 1 20 15452 2 2 15 LEU HD23 H -2.501 -1.228 1.541 1.00 . B B . 15 LEU HD23 1 1 20 15453 2 2 15 LEU HG H -1.516 0.568 3.022 1.00 . B B . 15 LEU HG 1 1 20 15454 2 2 15 LEU N N -1.699 3.252 3.046 1.00 . B B . 15 LEU N 1 1 20 15455 2 2 15 LEU O O -5.028 4.207 2.406 1.00 . B B . 15 LEU O 1 1 20 15456 2 2 16 TYR C C -5.078 6.754 4.226 1.00 . B B . 16 TYR C 1 1 20 15457 2 2 16 TYR CA C -5.248 5.315 4.797 1.00 . B B . 16 TYR CA 1 1 20 15458 2 2 16 TYR CB C -5.291 5.288 6.373 1.00 . B B . 16 TYR CB 1 1 20 15459 2 2 16 TYR CD1 C -3.142 6.621 6.652 1.00 . B B . 16 TYR CD1 1 1 20 15460 2 2 16 TYR CD2 C -4.943 7.072 8.122 1.00 . B B . 16 TYR CD2 1 1 20 15461 2 2 16 TYR CE1 C -2.384 7.585 7.298 1.00 . B B . 16 TYR CE1 1 1 20 15462 2 2 16 TYR CE2 C -4.177 8.032 8.761 1.00 . B B . 16 TYR CE2 1 1 20 15463 2 2 16 TYR CG C -4.427 6.358 7.059 1.00 . B B . 16 TYR CG 1 1 20 15464 2 2 16 TYR CZ C -2.900 8.288 8.351 1.00 . B B . 16 TYR CZ 1 1 20 15465 2 2 16 TYR H H -3.441 4.051 4.996 1.00 . B B . 16 TYR H 1 1 20 15466 2 2 16 TYR HA H -6.200 4.962 4.423 1.00 . B B . 16 TYR HA 1 1 20 15467 2 2 16 TYR HB2 H -6.315 5.435 6.683 1.00 . B B . 16 TYR HB2 1 1 20 15468 2 2 16 TYR HB3 H -4.967 4.323 6.730 1.00 . B B . 16 TYR HB3 1 1 20 15469 2 2 16 TYR HD1 H -2.726 6.073 5.820 1.00 . B B . 16 TYR HD1 1 1 20 15470 2 2 16 TYR HD2 H -5.953 6.882 8.454 1.00 . B B . 16 TYR HD2 1 1 20 15471 2 2 16 TYR HE1 H -1.378 7.796 6.970 1.00 . B B . 16 TYR HE1 1 1 20 15472 2 2 16 TYR HE2 H -4.573 8.596 9.591 1.00 . B B . 16 TYR HE2 1 1 20 15473 2 2 16 TYR HH H -1.239 8.885 9.002 1.00 . B B . 16 TYR HH 1 1 20 15474 2 2 16 TYR N N -4.167 4.327 4.398 1.00 . B B . 16 TYR N 1 1 20 15475 2 2 16 TYR O O -5.689 7.703 4.669 1.00 . B B . 16 TYR O 1 1 20 15476 2 2 16 TYR OH O -2.139 9.231 9.001 1.00 . B B . 16 TYR OH 1 1 20 15477 2 2 17 LEU C C -4.230 7.940 1.008 1.00 . B B . 17 LEU C 1 1 20 15478 2 2 17 LEU CA C -3.923 8.114 2.522 1.00 . B B . 17 LEU CA 1 1 20 15479 2 2 17 LEU CB C -2.425 8.392 2.843 1.00 . B B . 17 LEU CB 1 1 20 15480 2 2 17 LEU CD1 C -0.543 9.983 2.953 1.00 . B B . 17 LEU CD1 1 1 20 15481 2 2 17 LEU CD2 C -1.682 9.722 0.806 1.00 . B B . 17 LEU CD2 1 1 20 15482 2 2 17 LEU CG C -1.915 9.755 2.323 1.00 . B B . 17 LEU CG 1 1 20 15483 2 2 17 LEU H H -3.796 6.014 2.944 1.00 . B B . 17 LEU H 1 1 20 15484 2 2 17 LEU HA H -4.553 8.911 2.895 1.00 . B B . 17 LEU HA 1 1 20 15485 2 2 17 LEU HB2 H -2.323 8.372 3.921 1.00 . B B . 17 LEU HB2 1 1 20 15486 2 2 17 LEU HB3 H -1.811 7.595 2.454 1.00 . B B . 17 LEU HB3 1 1 20 15487 2 2 17 LEU HD11 H 0.136 9.187 2.683 1.00 . B B . 17 LEU HD11 1 1 20 15488 2 2 17 LEU HD12 H -0.129 10.924 2.628 1.00 . B B . 17 LEU HD12 1 1 20 15489 2 2 17 LEU HD13 H -0.635 9.999 4.030 1.00 . B B . 17 LEU HD13 1 1 20 15490 2 2 17 LEU HD21 H -0.980 8.946 0.544 1.00 . B B . 17 LEU HD21 1 1 20 15491 2 2 17 LEU HD22 H -2.601 9.554 0.268 1.00 . B B . 17 LEU HD22 1 1 20 15492 2 2 17 LEU HD23 H -1.286 10.671 0.478 1.00 . B B . 17 LEU HD23 1 1 20 15493 2 2 17 LEU HG H -2.603 10.549 2.598 1.00 . B B . 17 LEU HG 1 1 20 15494 2 2 17 LEU N N -4.240 6.833 3.233 1.00 . B B . 17 LEU N 1 1 20 15495 2 2 17 LEU O O -4.957 8.709 0.414 1.00 . B B . 17 LEU O 1 1 20 15496 2 2 18 VAL C C -5.286 6.478 -1.586 1.00 . B B . 18 VAL C 1 1 20 15497 2 2 18 VAL CA C -3.836 6.586 -1.032 1.00 . B B . 18 VAL CA 1 1 20 15498 2 2 18 VAL CB C -3.050 5.258 -1.276 1.00 . B B . 18 VAL CB 1 1 20 15499 2 2 18 VAL CG1 C -3.217 4.790 -2.739 1.00 . B B . 18 VAL CG1 1 1 20 15500 2 2 18 VAL CG2 C -1.556 5.531 -1.067 1.00 . B B . 18 VAL CG2 1 1 20 15501 2 2 18 VAL H H -3.101 6.352 1.004 1.00 . B B . 18 VAL H 1 1 20 15502 2 2 18 VAL HA H -3.373 7.374 -1.608 1.00 . B B . 18 VAL HA 1 1 20 15503 2 2 18 VAL HB H -3.393 4.497 -0.583 1.00 . B B . 18 VAL HB 1 1 20 15504 2 2 18 VAL HG11 H -2.864 5.543 -3.430 1.00 . B B . 18 VAL HG11 1 1 20 15505 2 2 18 VAL HG12 H -2.667 3.880 -2.917 1.00 . B B . 18 VAL HG12 1 1 20 15506 2 2 18 VAL HG13 H -4.257 4.593 -2.968 1.00 . B B . 18 VAL HG13 1 1 20 15507 2 2 18 VAL HG21 H -1.217 6.287 -1.757 1.00 . B B . 18 VAL HG21 1 1 20 15508 2 2 18 VAL HG22 H -1.373 5.878 -0.062 1.00 . B B . 18 VAL HG22 1 1 20 15509 2 2 18 VAL HG23 H -0.982 4.632 -1.225 1.00 . B B . 18 VAL HG23 1 1 20 15510 2 2 18 VAL N N -3.660 6.916 0.434 1.00 . B B . 18 VAL N 1 1 20 15511 2 2 18 VAL O O -5.704 7.334 -2.338 1.00 . B B . 18 VAL O 1 1 20 15512 2 2 19 CYS C C -8.232 6.482 -2.085 1.00 . B B . 19 CYS C 1 1 20 15513 2 2 19 CYS CA C -7.418 5.215 -1.686 1.00 . B B . 19 CYS CA 1 1 20 15514 2 2 19 CYS CB C -8.074 4.380 -0.525 1.00 . B B . 19 CYS CB 1 1 20 15515 2 2 19 CYS H H -5.584 4.795 -0.617 1.00 . B B . 19 CYS H 1 1 20 15516 2 2 19 CYS HA H -7.387 4.613 -2.582 1.00 . B B . 19 CYS HA 1 1 20 15517 2 2 19 CYS HB2 H -9.096 4.668 -0.343 1.00 . B B . 19 CYS HB2 1 1 20 15518 2 2 19 CYS HB3 H -8.114 3.347 -0.831 1.00 . B B . 19 CYS HB3 1 1 20 15519 2 2 19 CYS HG H -7.587 5.123 1.599 1.00 . B B . 19 CYS HG 1 1 20 15520 2 2 19 CYS N N -5.997 5.442 -1.220 1.00 . B B . 19 CYS N 1 1 20 15521 2 2 19 CYS O O -8.630 6.651 -3.220 1.00 . B B . 19 CYS O 1 1 20 15522 2 2 19 CYS SG S -7.240 4.396 1.077 1.00 . B B . 19 CYS SG 1 1 20 15523 2 2 20 GLY C C -10.702 8.565 -1.046 1.00 . B B . 20 GLY C 1 1 20 15524 2 2 20 GLY CA C -9.244 8.616 -1.444 1.00 . B B . 20 GLY CA 1 1 20 15525 2 2 20 GLY H H -8.109 7.155 -0.250 1.00 . B B . 20 GLY H 1 1 20 15526 2 2 20 GLY HA2 H -8.804 9.444 -0.921 1.00 . B B . 20 GLY HA2 1 1 20 15527 2 2 20 GLY HA3 H -9.227 8.798 -2.507 1.00 . B B . 20 GLY HA3 1 1 20 15528 2 2 20 GLY N N -8.463 7.353 -1.139 1.00 . B B . 20 GLY N 1 1 20 15529 2 2 20 GLY O O -11.248 9.476 -0.461 1.00 . B B . 20 GLY O 1 1 20 15530 2 2 21 GLU C C -12.912 6.189 0.046 1.00 . B B . 21 GLU C 1 1 20 15531 2 2 21 GLU CA C -12.706 7.168 -1.128 1.00 . B B . 21 GLU CA 1 1 20 15532 2 2 21 GLU CB C -13.296 6.617 -2.484 1.00 . B B . 21 GLU CB 1 1 20 15533 2 2 21 GLU CD C -11.722 4.513 -2.782 1.00 . B B . 21 GLU CD 1 1 20 15534 2 2 21 GLU CG C -12.225 5.813 -3.375 1.00 . B B . 21 GLU CG 1 1 20 15535 2 2 21 GLU H H -10.730 6.789 -1.879 1.00 . B B . 21 GLU H 1 1 20 15536 2 2 21 GLU HA H -13.217 8.080 -0.856 1.00 . B B . 21 GLU HA 1 1 20 15537 2 2 21 GLU HB2 H -14.120 5.949 -2.264 1.00 . B B . 21 GLU HB2 1 1 20 15538 2 2 21 GLU HB3 H -13.684 7.444 -3.061 1.00 . B B . 21 GLU HB3 1 1 20 15539 2 2 21 GLU HG2 H -12.678 5.544 -4.314 1.00 . B B . 21 GLU HG2 1 1 20 15540 2 2 21 GLU HG3 H -11.359 6.415 -3.604 1.00 . B B . 21 GLU HG3 1 1 20 15541 2 2 21 GLU N N -11.269 7.462 -1.402 1.00 . B B . 21 GLU N 1 1 20 15542 2 2 21 GLU O O -13.711 6.403 0.940 1.00 . B B . 21 GLU O 1 1 20 15543 2 2 21 GLU OE1 O -12.472 3.561 -2.815 1.00 . B B . 21 GLU OE1 1 1 20 15544 2 2 21 GLU OE2 O -10.600 4.532 -2.311 1.00 . B B . 21 GLU OE2 1 1 20 15545 2 2 22 ARG C C -10.878 3.602 1.692 1.00 . B B . 22 ARG C 1 1 20 15546 2 2 22 ARG CA C -12.174 4.049 0.968 1.00 . B B . 22 ARG CA 1 1 20 15547 2 2 22 ARG CB C -12.818 2.913 0.195 1.00 . B B . 22 ARG CB 1 1 20 15548 2 2 22 ARG CD C -12.693 0.516 0.221 1.00 . B B . 22 ARG CD 1 1 20 15549 2 2 22 ARG CG C -13.130 1.684 1.059 1.00 . B B . 22 ARG CG 1 1 20 15550 2 2 22 ARG CZ C -12.600 -1.600 1.332 1.00 . B B . 22 ARG CZ 1 1 20 15551 2 2 22 ARG H H -11.589 5.076 -0.786 1.00 . B B . 22 ARG H 1 1 20 15552 2 2 22 ARG HA H -12.915 4.293 1.661 1.00 . B B . 22 ARG HA 1 1 20 15553 2 2 22 ARG HB2 H -13.728 3.279 -0.248 1.00 . B B . 22 ARG HB2 1 1 20 15554 2 2 22 ARG HB3 H -12.156 2.673 -0.626 1.00 . B B . 22 ARG HB3 1 1 20 15555 2 2 22 ARG HD2 H -12.984 0.660 -0.820 1.00 . B B . 22 ARG HD2 1 1 20 15556 2 2 22 ARG HD3 H -11.605 0.461 0.243 1.00 . B B . 22 ARG HD3 1 1 20 15557 2 2 22 ARG HE H -14.291 -0.811 0.883 1.00 . B B . 22 ARG HE 1 1 20 15558 2 2 22 ARG HG2 H -12.599 1.700 2.001 1.00 . B B . 22 ARG HG2 1 1 20 15559 2 2 22 ARG HG3 H -14.192 1.641 1.257 1.00 . B B . 22 ARG HG3 1 1 20 15560 2 2 22 ARG HH11 H -12.383 -0.595 2.939 1.00 . B B . 22 ARG HH11 1 1 20 15561 2 2 22 ARG HH12 H -11.586 -2.142 2.893 1.00 . B B . 22 ARG HH12 1 1 20 15562 2 2 22 ARG HH21 H -12.750 -2.640 -0.272 1.00 . B B . 22 ARG HH21 1 1 20 15563 2 2 22 ARG HH22 H -11.781 -3.309 1.028 1.00 . B B . 22 ARG HH22 1 1 20 15564 2 2 22 ARG N N -12.163 5.139 -0.021 1.00 . B B . 22 ARG N 1 1 20 15565 2 2 22 ARG NE N -13.323 -0.697 0.845 1.00 . B B . 22 ARG NE 1 1 20 15566 2 2 22 ARG NH1 N -12.155 -1.443 2.480 1.00 . B B . 22 ARG NH1 1 1 20 15567 2 2 22 ARG NH2 N -12.356 -2.603 0.645 1.00 . B B . 22 ARG NH2 1 1 20 15568 2 2 22 ARG O O -10.489 4.068 2.744 1.00 . B B . 22 ARG O 1 1 20 15569 2 2 23 GLY C C -9.209 0.584 1.959 1.00 . B B . 23 GLY C 1 1 20 15570 2 2 23 GLY CA C -8.978 2.016 1.493 1.00 . B B . 23 GLY CA 1 1 20 15571 2 2 23 GLY H H -10.675 2.383 0.204 1.00 . B B . 23 GLY H 1 1 20 15572 2 2 23 GLY HA2 H -8.286 1.985 0.672 1.00 . B B . 23 GLY HA2 1 1 20 15573 2 2 23 GLY HA3 H -8.553 2.569 2.319 1.00 . B B . 23 GLY HA3 1 1 20 15574 2 2 23 GLY N N -10.255 2.661 1.042 1.00 . B B . 23 GLY N 1 1 20 15575 2 2 23 GLY O O -10.302 0.192 2.309 1.00 . B B . 23 GLY O 1 1 20 15576 2 2 24 PHE C C -9.139 -2.603 1.603 1.00 . B B . 24 PHE C 1 1 20 15577 2 2 24 PHE CA C -8.215 -1.625 2.397 1.00 . B B . 24 PHE CA 1 1 20 15578 2 2 24 PHE CB C -8.608 -1.589 3.899 1.00 . B B . 24 PHE CB 1 1 20 15579 2 2 24 PHE CD1 C -6.442 -0.835 4.944 1.00 . B B . 24 PHE CD1 1 1 20 15580 2 2 24 PHE CD2 C -8.255 0.690 4.890 1.00 . B B . 24 PHE CD2 1 1 20 15581 2 2 24 PHE CE1 C -5.665 0.114 5.576 1.00 . B B . 24 PHE CE1 1 1 20 15582 2 2 24 PHE CE2 C -7.486 1.645 5.520 1.00 . B B . 24 PHE CE2 1 1 20 15583 2 2 24 PHE CG C -7.737 -0.551 4.601 1.00 . B B . 24 PHE CG 1 1 20 15584 2 2 24 PHE CZ C -6.186 1.355 5.865 1.00 . B B . 24 PHE CZ 1 1 20 15585 2 2 24 PHE H H -7.329 0.237 1.656 1.00 . B B . 24 PHE H 1 1 20 15586 2 2 24 PHE HA H -7.216 -2.031 2.324 1.00 . B B . 24 PHE HA 1 1 20 15587 2 2 24 PHE HB2 H -9.644 -1.319 4.033 1.00 . B B . 24 PHE HB2 1 1 20 15588 2 2 24 PHE HB3 H -8.439 -2.549 4.365 1.00 . B B . 24 PHE HB3 1 1 20 15589 2 2 24 PHE HD1 H -6.039 -1.808 4.700 1.00 . B B . 24 PHE HD1 1 1 20 15590 2 2 24 PHE HD2 H -9.276 0.911 4.607 1.00 . B B . 24 PHE HD2 1 1 20 15591 2 2 24 PHE HE1 H -4.648 -0.118 5.853 1.00 . B B . 24 PHE HE1 1 1 20 15592 2 2 24 PHE HE2 H -7.902 2.619 5.742 1.00 . B B . 24 PHE HE2 1 1 20 15593 2 2 24 PHE HZ H -5.578 2.099 6.359 1.00 . B B . 24 PHE HZ 1 1 20 15594 2 2 24 PHE N N -8.160 -0.178 1.954 1.00 . B B . 24 PHE N 1 1 20 15595 2 2 24 PHE O O -10.161 -3.080 2.069 1.00 . B B . 24 PHE O 1 1 20 15596 2 2 25 PHE C C -8.667 -5.074 -0.815 1.00 . B B . 25 PHE C 1 1 20 15597 2 2 25 PHE CA C -9.488 -3.805 -0.524 1.00 . B B . 25 PHE CA 1 1 20 15598 2 2 25 PHE CB C -9.806 -3.057 -1.852 1.00 . B B . 25 PHE CB 1 1 20 15599 2 2 25 PHE CD1 C -12.144 -4.039 -1.893 1.00 . B B . 25 PHE CD1 1 1 20 15600 2 2 25 PHE CD2 C -11.905 -1.700 -2.206 1.00 . B B . 25 PHE CD2 1 1 20 15601 2 2 25 PHE CE1 C -13.513 -3.918 -2.002 1.00 . B B . 25 PHE CE1 1 1 20 15602 2 2 25 PHE CE2 C -13.272 -1.571 -2.316 1.00 . B B . 25 PHE CE2 1 1 20 15603 2 2 25 PHE CG C -11.328 -2.929 -1.991 1.00 . B B . 25 PHE CG 1 1 20 15604 2 2 25 PHE CZ C -14.079 -2.681 -2.214 1.00 . B B . 25 PHE CZ 1 1 20 15605 2 2 25 PHE H H -7.918 -2.470 0.077 1.00 . B B . 25 PHE H 1 1 20 15606 2 2 25 PHE HA H -10.387 -4.148 -0.039 1.00 . B B . 25 PHE HA 1 1 20 15607 2 2 25 PHE HB2 H -9.380 -2.066 -1.840 1.00 . B B . 25 PHE HB2 1 1 20 15608 2 2 25 PHE HB3 H -9.432 -3.572 -2.726 1.00 . B B . 25 PHE HB3 1 1 20 15609 2 2 25 PHE HD1 H -11.702 -5.012 -1.735 1.00 . B B . 25 PHE HD1 1 1 20 15610 2 2 25 PHE HD2 H -11.273 -0.828 -2.295 1.00 . B B . 25 PHE HD2 1 1 20 15611 2 2 25 PHE HE1 H -14.147 -4.793 -1.925 1.00 . B B . 25 PHE HE1 1 1 20 15612 2 2 25 PHE HE2 H -13.707 -0.594 -2.492 1.00 . B B . 25 PHE HE2 1 1 20 15613 2 2 25 PHE HZ H -15.152 -2.581 -2.302 1.00 . B B . 25 PHE HZ 1 1 20 15614 2 2 25 PHE N N -8.741 -2.880 0.398 1.00 . B B . 25 PHE N 1 1 20 15615 2 2 25 PHE O O -9.237 -6.101 -1.126 1.00 . B B . 25 PHE O 1 1 20 15616 2 2 26 TYR C C -6.671 -7.054 -2.079 1.00 . B B . 26 TYR C 1 1 20 15617 2 2 26 TYR CA C -6.361 -6.035 -0.922 1.00 . B B . 26 TYR CA 1 1 20 15618 2 2 26 TYR CB C -6.229 -6.731 0.462 1.00 . B B . 26 TYR CB 1 1 20 15619 2 2 26 TYR CD1 C -4.679 -4.938 1.442 1.00 . B B . 26 TYR CD1 1 1 20 15620 2 2 26 TYR CD2 C -6.377 -5.865 2.814 1.00 . B B . 26 TYR CD2 1 1 20 15621 2 2 26 TYR CE1 C -4.265 -4.149 2.502 1.00 . B B . 26 TYR CE1 1 1 20 15622 2 2 26 TYR CE2 C -5.960 -5.075 3.869 1.00 . B B . 26 TYR CE2 1 1 20 15623 2 2 26 TYR CG C -5.741 -5.806 1.592 1.00 . B B . 26 TYR CG 1 1 20 15624 2 2 26 TYR CZ C -4.904 -4.219 3.713 1.00 . B B . 26 TYR CZ 1 1 20 15625 2 2 26 TYR H H -7.057 -4.047 -0.445 1.00 . B B . 26 TYR H 1 1 20 15626 2 2 26 TYR HA H -5.416 -5.578 -1.166 1.00 . B B . 26 TYR HA 1 1 20 15627 2 2 26 TYR HB2 H -7.206 -7.089 0.749 1.00 . B B . 26 TYR HB2 1 1 20 15628 2 2 26 TYR HB3 H -5.555 -7.570 0.420 1.00 . B B . 26 TYR HB3 1 1 20 15629 2 2 26 TYR HD1 H -4.168 -4.879 0.496 1.00 . B B . 26 TYR HD1 1 1 20 15630 2 2 26 TYR HD2 H -7.211 -6.539 2.948 1.00 . B B . 26 TYR HD2 1 1 20 15631 2 2 26 TYR HE1 H -3.438 -3.462 2.398 1.00 . B B . 26 TYR HE1 1 1 20 15632 2 2 26 TYR HE2 H -6.468 -5.133 4.819 1.00 . B B . 26 TYR HE2 1 1 20 15633 2 2 26 TYR HH H -5.020 -3.660 5.525 1.00 . B B . 26 TYR HH 1 1 20 15634 2 2 26 TYR N N -7.374 -4.938 -0.696 1.00 . B B . 26 TYR N 1 1 20 15635 2 2 26 TYR O O -7.609 -7.823 -2.045 1.00 . B B . 26 TYR O 1 1 20 15636 2 2 26 TYR OH O -4.472 -3.444 4.763 1.00 . B B . 26 TYR OH 1 1 20 15637 2 2 27 THR C C -5.132 -9.176 -4.515 1.00 . B B . 27 THR C 1 1 20 15638 2 2 27 THR CA C -6.097 -8.000 -4.282 1.00 . B B . 27 THR CA 1 1 20 15639 2 2 27 THR CB C -6.155 -7.136 -5.542 1.00 . B B . 27 THR CB 1 1 20 15640 2 2 27 THR CG2 C -7.353 -6.208 -5.443 1.00 . B B . 27 THR CG2 1 1 20 15641 2 2 27 THR H H -5.113 -6.446 -3.145 1.00 . B B . 27 THR H 1 1 20 15642 2 2 27 THR HA H -7.076 -8.439 -4.196 1.00 . B B . 27 THR HA 1 1 20 15643 2 2 27 THR HB H -6.082 -7.689 -6.475 1.00 . B B . 27 THR HB 1 1 20 15644 2 2 27 THR HG1 H -5.391 -5.337 -5.283 1.00 . B B . 27 THR HG1 1 1 20 15645 2 2 27 THR HG21 H -7.288 -5.582 -4.566 1.00 . B B . 27 THR HG21 1 1 20 15646 2 2 27 THR HG22 H -7.418 -5.588 -6.320 1.00 . B B . 27 THR HG22 1 1 20 15647 2 2 27 THR HG23 H -8.256 -6.798 -5.371 1.00 . B B . 27 THR HG23 1 1 20 15648 2 2 27 THR N N -5.873 -7.058 -3.108 1.00 . B B . 27 THR N 1 1 20 15649 2 2 27 THR O O -5.497 -10.131 -5.169 1.00 . B B . 27 THR O 1 1 20 15650 2 2 27 THR OG1 O -5.066 -6.245 -5.386 1.00 . B B . 27 THR OG1 1 1 20 15651 2 2 28 PRO C C -5.094 -10.165 -1.893 1.00 . B B . 28 PRO C 1 1 20 15652 2 2 28 PRO CA C -3.767 -9.748 -2.613 1.00 . B B . 28 PRO CA 1 1 20 15653 2 2 28 PRO CB C -2.940 -8.672 -1.898 1.00 . B B . 28 PRO CB 1 1 20 15654 2 2 28 PRO CD C -2.878 -8.134 -4.264 1.00 . B B . 28 PRO CD 1 1 20 15655 2 2 28 PRO CG C -1.971 -8.237 -3.022 1.00 . B B . 28 PRO CG 1 1 20 15656 2 2 28 PRO HA H -3.173 -10.645 -2.715 1.00 . B B . 28 PRO HA 1 1 20 15657 2 2 28 PRO HB2 H -3.570 -7.860 -1.564 1.00 . B B . 28 PRO HB2 1 1 20 15658 2 2 28 PRO HB3 H -2.412 -9.088 -1.050 1.00 . B B . 28 PRO HB3 1 1 20 15659 2 2 28 PRO HD2 H -3.311 -7.153 -4.365 1.00 . B B . 28 PRO HD2 1 1 20 15660 2 2 28 PRO HD3 H -2.358 -8.399 -5.176 1.00 . B B . 28 PRO HD3 1 1 20 15661 2 2 28 PRO HG2 H -1.514 -7.280 -2.805 1.00 . B B . 28 PRO HG2 1 1 20 15662 2 2 28 PRO HG3 H -1.188 -8.966 -3.183 1.00 . B B . 28 PRO HG3 1 1 20 15663 2 2 28 PRO N N -3.944 -9.134 -3.977 1.00 . B B . 28 PRO N 1 1 20 15664 2 2 28 PRO O O -5.384 -9.686 -0.818 1.00 . B B . 28 PRO O 1 1 20 15665 2 2 29 LYS C C -8.176 -11.676 -3.334 1.00 . B B . 29 LYS C 1 1 20 15666 2 2 29 LYS CA C -7.159 -11.655 -2.154 1.00 . B B . 29 LYS CA 1 1 20 15667 2 2 29 LYS CB C -7.763 -10.844 -0.930 1.00 . B B . 29 LYS CB 1 1 20 15668 2 2 29 LYS CD C -9.880 -9.984 0.194 1.00 . B B . 29 LYS CD 1 1 20 15669 2 2 29 LYS CE C -10.679 -9.035 -0.728 1.00 . B B . 29 LYS CE 1 1 20 15670 2 2 29 LYS CG C -9.249 -11.191 -0.585 1.00 . B B . 29 LYS CG 1 1 20 15671 2 2 29 LYS H H -5.419 -11.304 -3.418 1.00 . B B . 29 LYS H 1 1 20 15672 2 2 29 LYS HA H -6.995 -12.682 -1.901 1.00 . B B . 29 LYS HA 1 1 20 15673 2 2 29 LYS HB2 H -7.176 -11.153 -0.073 1.00 . B B . 29 LYS HB2 1 1 20 15674 2 2 29 LYS HB3 H -7.580 -9.791 -1.017 1.00 . B B . 29 LYS HB3 1 1 20 15675 2 2 29 LYS HD2 H -10.548 -10.371 0.951 1.00 . B B . 29 LYS HD2 1 1 20 15676 2 2 29 LYS HD3 H -9.109 -9.418 0.701 1.00 . B B . 29 LYS HD3 1 1 20 15677 2 2 29 LYS HE2 H -11.588 -9.504 -1.086 1.00 . B B . 29 LYS HE2 1 1 20 15678 2 2 29 LYS HE3 H -10.935 -8.120 -0.201 1.00 . B B . 29 LYS HE3 1 1 20 15679 2 2 29 LYS HG2 H -9.844 -11.424 -1.458 1.00 . B B . 29 LYS HG2 1 1 20 15680 2 2 29 LYS HG3 H -9.261 -12.072 0.048 1.00 . B B . 29 LYS HG3 1 1 20 15681 2 2 29 LYS HZ1 H -8.907 -9.139 -1.776 1.00 . B B . 29 LYS HZ1 1 1 20 15682 2 2 29 LYS HZ2 H -10.222 -9.015 -2.777 1.00 . B B . 29 LYS HZ2 1 1 20 15683 2 2 29 LYS HZ3 H -9.599 -7.672 -1.884 1.00 . B B . 29 LYS HZ3 1 1 20 15684 2 2 29 LYS N N -5.817 -11.040 -2.559 1.00 . B B . 29 LYS N 1 1 20 15685 2 2 29 LYS NZ N -9.830 -8.687 -1.874 1.00 . B B . 29 LYS NZ 1 1 20 15686 2 2 29 LYS O O -9.150 -12.397 -3.371 1.00 . B B . 29 LYS O 1 1 20 15687 2 2 30 THR C C -8.017 -10.345 -6.788 1.00 . B B . 30 THR C 1 1 20 15688 2 2 30 THR CA C -8.799 -10.735 -5.524 1.00 . B B . 30 THR CA 1 1 20 15689 2 2 30 THR CB C -9.899 -9.679 -5.277 1.00 . B B . 30 THR CB 1 1 20 15690 2 2 30 THR CG2 C -11.065 -9.850 -6.219 1.00 . B B . 30 THR CG2 1 1 20 15691 2 2 30 THR H H -7.114 -10.319 -4.167 1.00 . B B . 30 THR H 1 1 20 15692 2 2 30 THR HA H -9.262 -11.690 -5.727 1.00 . B B . 30 THR HA 1 1 20 15693 2 2 30 THR HB H -9.533 -8.659 -5.211 1.00 . B B . 30 THR HB 1 1 20 15694 2 2 30 THR HG1 H -10.472 -11.066 -4.043 1.00 . B B . 30 THR HG1 1 1 20 15695 2 2 30 THR HG21 H -11.518 -10.824 -6.109 1.00 . B B . 30 THR HG21 1 1 20 15696 2 2 30 THR HG22 H -11.813 -9.104 -5.997 1.00 . B B . 30 THR HG22 1 1 20 15697 2 2 30 THR HG23 H -10.750 -9.723 -7.244 1.00 . B B . 30 THR HG23 1 1 20 15698 2 2 30 THR N N -7.919 -10.850 -4.292 1.00 . B B . 30 THR N 1 1 20 15699 2 2 30 THR O O -7.821 -9.173 -7.053 1.00 . B B . 30 THR O 1 1 20 15700 2 2 30 THR OG1 O -10.549 -10.094 -4.085 1.00 . B B . 30 THR OG1 1 1 stop_ save_
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