NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | program | type | subtype | item_count |
368894 | 1b1v | 4292 | cing | recoord | 4-filtered-FRED | STAR | entry | full | 326 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1b1v # This FRED archive file contains, for PDB entry <1b1v>: # # - 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_1b1v _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1b1v _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 2488.78 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 $PROTEIN__PLASMATOCYTE_SPREADING_PEPTIDE_ A . 1 1 stop_ save_ save_PROTEIN__PLASMATOCYTE_SPREADING_PEPTIDE_ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "PROTEIN PLASMATOCYTE SPREADING PEPTIDE " _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code ENFNGGCLAGYMRTADGRCKPTF _Entity.Number_of_monomers 23 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 GLU . 1 1 2 ASN . 1 1 3 PHE . 1 1 4 ASN . 1 1 5 GLY . 1 1 6 GLY . 1 1 7 CYS . 1 1 8 LEU . 1 1 9 ALA . 1 1 10 GLY . 1 1 11 TYR . 1 1 12 MET . 1 1 13 ARG . 1 1 14 THR . 1 1 15 ALA . 1 1 16 ASP . 1 1 17 GLY . 1 1 18 ARG . 1 1 19 CYS . 1 1 20 LYS . 1 1 21 PRO . 1 1 22 THR . 1 1 23 PHE . 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 GLU 1 1 1 1 ASN 2 2 1 1 PHE 3 3 1 1 ASN 4 4 1 1 GLY 5 5 1 1 GLY 6 6 1 1 CYS 7 7 1 1 LEU 8 8 1 1 ALA 9 9 1 1 GLY 10 10 1 1 TYR 11 11 1 1 MET 12 12 1 1 ARG 13 13 1 1 THR 14 14 1 1 ALA 15 15 1 1 ASP 16 16 1 1 GLY 17 17 1 1 ARG 18 18 1 1 CYS 19 19 1 1 LYS 20 20 1 1 PRO 21 21 1 1 THR 22 22 1 1 PHE 23 23 1 1 stop_ save_ save_DYANA/DIANA_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 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 ASN HA . 2 ASN HA 1 1 1 1 2 1 1 3 PHE H . 3 PHE HN 1 1 2 1 1 1 1 2 ASN QB . 2 ASN QB 1 1 2 1 2 1 1 3 PHE H . 3 PHE HN 1 1 3 1 1 1 1 2 ASN HB2 . 2 ASN HB2 1 1 3 1 2 1 1 3 PHE H . 3 PHE HN 1 1 4 1 1 1 1 2 ASN HB3 . 2 ASN HB3 1 1 4 1 2 1 1 3 PHE H . 3 PHE HN 1 1 5 1 1 1 1 3 PHE H . 3 PHE HN 1 1 5 1 2 1 1 3 PHE HB2 . 3 PHE HB2 1 1 6 1 1 1 1 3 PHE H . 3 PHE HN 1 1 6 1 2 1 1 3 PHE QB . 3 PHE QB 1 1 7 1 1 1 1 3 PHE H . 3 PHE HN 1 1 7 1 2 1 1 3 PHE HB3 . 3 PHE HB3 1 1 8 1 1 1 1 3 PHE QD . 3 PHE QD 1 1 8 1 2 1 1 4 ASN H . 4 ASN HN 1 1 9 1 1 1 1 3 PHE QD . 3 PHE QD 1 1 9 1 2 1 1 4 ASN HB2 . 4 ASN HB2 1 1 10 1 1 1 1 3 PHE QD . 3 PHE QD 1 1 10 1 2 1 1 4 ASN HB3 . 4 ASN HB3 1 1 11 1 1 1 1 3 PHE QD . 3 PHE QD 1 1 11 1 2 1 1 5 GLY H . 5 GLY HN 1 1 12 1 1 1 1 4 ASN H . 4 ASN HN 1 1 12 1 2 1 1 4 ASN HA . 4 ASN HA 1 1 13 1 1 1 1 4 ASN H . 4 ASN HN 1 1 13 1 2 1 1 4 ASN HB2 . 4 ASN HB2 1 1 14 1 1 1 1 4 ASN H . 4 ASN HN 1 1 14 1 2 1 1 4 ASN QB . 4 ASN QB 1 1 15 1 1 1 1 4 ASN H . 4 ASN HN 1 1 15 1 2 1 1 4 ASN HB3 . 4 ASN HB3 1 1 16 1 1 1 1 4 ASN H . 4 ASN HN 1 1 16 1 2 1 1 5 GLY H . 5 GLY HN 1 1 17 1 1 1 1 4 ASN H . 4 ASN HN 1 1 17 1 2 1 1 5 GLY QA . 5 GLY QA 1 1 18 1 1 1 1 4 ASN H . 4 ASN HN 1 1 18 1 2 1 1 6 GLY H . 6 GLY HN 1 1 19 1 1 1 1 4 ASN HA . 4 ASN HA 1 1 19 1 2 1 1 5 GLY H . 5 GLY HN 1 1 20 1 1 1 1 4 ASN HA . 4 ASN HA 1 1 20 1 2 1 1 6 GLY H . 6 GLY HN 1 1 21 1 1 1 1 4 ASN QB . 4 ASN QB 1 1 21 1 2 1 1 6 GLY H . 6 GLY HN 1 1 22 1 1 1 1 4 ASN QD . 4 ASN QD2 1 1 22 1 2 1 1 5 GLY QA . 5 GLY QA 1 1 23 1 1 1 1 4 ASN QD . 4 ASN QD2 1 1 23 1 2 1 1 7 CYS HA . 7 CYSS HA 1 1 24 1 1 1 1 4 ASN QD . 4 ASN QD2 1 1 24 1 2 1 1 10 GLY H . 10 GLY HN 1 1 25 1 1 1 1 4 ASN QD . 4 ASN QD2 1 1 25 1 2 1 1 11 TYR H . 11 TYR HN 1 1 26 1 1 1 1 5 GLY H . 5 GLY HN 1 1 26 1 2 1 1 6 GLY H . 6 GLY HN 1 1 27 1 1 1 1 5 GLY H . 5 GLY HN 1 1 27 1 2 1 1 6 GLY QA . 6 GLY QA 1 1 28 1 1 1 1 5 GLY QA . 5 GLY QA 1 1 28 1 2 1 1 6 GLY H . 6 GLY HN 1 1 29 1 1 1 1 5 GLY QA . 5 GLY QA 1 1 29 1 2 1 1 13 ARG HE . 13 ARG HE 1 1 30 1 1 1 1 5 GLY HA2 . 5 GLY HA1 1 1 30 1 2 1 1 6 GLY H . 6 GLY HN 1 1 31 1 1 1 1 5 GLY HA3 . 5 GLY HA2 1 1 31 1 2 1 1 6 GLY H . 6 GLY HN 1 1 32 1 1 1 1 6 GLY H . 6 GLY HN 1 1 32 1 2 1 1 7 CYS H . 7 CYSS HN 1 1 33 1 1 1 1 6 GLY H . 6 GLY HN 1 1 33 1 2 1 1 7 CYS HA . 7 CYSS HA 1 1 34 1 1 1 1 7 CYS CB . 7 CYSS CB 1 1 34 1 2 1 1 19 CYS CB . 19 CYSS CB 1 1 35 1 1 1 1 7 CYS H . 7 CYSS HN 1 1 35 1 2 1 1 7 CYS HB2 . 7 CYSS HB2 1 1 36 1 1 1 1 7 CYS H . 7 CYSS HN 1 1 36 1 2 1 1 7 CYS QB . 7 CYSS QB 1 1 37 1 1 1 1 7 CYS H . 7 CYSS HN 1 1 37 1 2 1 1 7 CYS HB3 . 7 CYSS HB3 1 1 38 1 1 1 1 7 CYS HA . 7 CYSS HA 1 1 38 1 2 1 1 8 LEU H . 8 LEU HN 1 1 39 1 1 1 1 7 CYS HA . 7 CYSS HA 1 1 39 1 2 1 1 11 TYR HB2 . 11 TYR HB2 1 1 40 1 1 1 1 7 CYS HA . 7 CYSS HA 1 1 40 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 41 1 1 1 1 7 CYS QB . 7 CYSS QB 1 1 41 1 2 1 1 8 LEU H . 8 LEU HN 1 1 42 1 1 1 1 7 CYS QB . 7 CYSS QB 1 1 42 1 2 1 1 11 TYR H . 11 TYR HN 1 1 43 1 1 1 1 7 CYS QB . 7 CYSS QB 1 1 43 1 2 1 1 11 TYR HB2 . 11 TYR HB2 1 1 44 1 1 1 1 7 CYS QB . 7 CYSS QB 1 1 44 1 2 1 1 11 TYR HB3 . 11 TYR HB3 1 1 45 1 1 1 1 7 CYS QB . 7 CYSS QB 1 1 45 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 46 1 1 1 1 7 CYS QB . 7 CYSS QB 1 1 46 1 2 1 1 12 MET H . 12 MET HN 1 1 47 1 1 1 1 7 CYS QB . 7 CYSS QB 1 1 47 1 2 1 1 13 ARG H . 13 ARG HN 1 1 48 1 1 1 1 7 CYS QB . 7 CYSS QB 1 1 48 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 49 1 1 1 1 7 CYS QB . 7 CYSS QB 1 1 49 1 2 1 1 20 LYS H . 20 LYS HN 1 1 50 1 1 1 1 7 CYS HB2 . 7 CYSS HB2 1 1 50 1 2 1 1 8 LEU H . 8 LEU HN 1 1 51 1 1 1 1 7 CYS HB2 . 7 CYSS HB2 1 1 51 1 2 1 1 11 TYR H . 11 TYR HN 1 1 52 1 1 1 1 7 CYS HB2 . 7 CYSS HB2 1 1 52 1 2 1 1 11 TYR HB2 . 11 TYR HB2 1 1 53 1 1 1 1 7 CYS HB2 . 7 CYSS HB2 1 1 53 1 2 1 1 11 TYR HB3 . 11 TYR HB3 1 1 54 1 1 1 1 7 CYS HB2 . 7 CYSS HB2 1 1 54 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 55 1 1 1 1 7 CYS HB2 . 7 CYSS HB2 1 1 55 1 2 1 1 19 CYS HB2 . 19 CYSS HB2 1 1 56 1 1 1 1 7 CYS HB2 . 7 CYSS HB2 1 1 56 1 2 1 1 19 CYS HB3 . 19 CYSS HB3 1 1 57 1 1 1 1 7 CYS HB3 . 7 CYSS HB3 1 1 57 1 2 1 1 8 LEU H . 8 LEU HN 1 1 58 1 1 1 1 7 CYS HB3 . 7 CYSS HB3 1 1 58 1 2 1 1 11 TYR H . 11 TYR HN 1 1 59 1 1 1 1 7 CYS HB3 . 7 CYSS HB3 1 1 59 1 2 1 1 11 TYR HB2 . 11 TYR HB2 1 1 60 1 1 1 1 7 CYS HB3 . 7 CYSS HB3 1 1 60 1 2 1 1 11 TYR HB3 . 11 TYR HB3 1 1 61 1 1 1 1 7 CYS HB3 . 7 CYSS HB3 1 1 61 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 62 1 1 1 1 7 CYS HB3 . 7 CYSS HB3 1 1 62 1 2 1 1 19 CYS HB2 . 19 CYSS HB2 1 1 63 1 1 1 1 7 CYS HB3 . 7 CYSS HB3 1 1 63 1 2 1 1 19 CYS HB3 . 19 CYSS HB3 1 1 64 1 1 1 1 7 CYS SG . 7 CYSS SG 1 1 64 1 2 1 1 19 CYS SG . 19 CYSS SG 1 1 65 1 1 1 1 8 LEU H . 8 LEU HN 1 1 65 1 2 1 1 8 LEU HB2 . 8 LEU HB2 1 1 66 1 1 1 1 8 LEU H . 8 LEU HN 1 1 66 1 2 1 1 8 LEU HB3 . 8 LEU HB3 1 1 67 1 1 1 1 8 LEU H . 8 LEU HN 1 1 67 1 2 1 1 8 LEU MD1 . 8 LEU QD1 1 1 68 1 1 1 1 8 LEU H . 8 LEU HN 1 1 68 1 2 1 1 8 LEU MD2 . 8 LEU QD2 1 1 69 1 1 1 1 8 LEU H . 8 LEU HN 1 1 69 1 2 1 1 8 LEU HG . 8 LEU HG 1 1 70 1 1 1 1 8 LEU H . 8 LEU HN 1 1 70 1 2 1 1 9 ALA H . 9 ALA HN 1 1 71 1 1 1 1 8 LEU H . 8 LEU HN 1 1 71 1 2 1 1 11 TYR HB2 . 11 TYR HB2 1 1 72 1 1 1 1 8 LEU H . 8 LEU HN 1 1 72 1 2 1 1 11 TYR HB3 . 11 TYR HB3 1 1 73 1 1 1 1 8 LEU H . 8 LEU HN 1 1 73 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 74 1 1 1 1 8 LEU H . 8 LEU HN 1 1 74 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 75 1 1 1 1 8 LEU HA . 8 LEU HA 1 1 75 1 2 1 1 8 LEU HG . 8 LEU HG 1 1 76 1 1 1 1 8 LEU QB . 8 LEU QB 1 1 76 1 2 1 1 8 LEU HG . 8 LEU HG 1 1 77 1 1 1 1 8 LEU QB . 8 LEU QB 1 1 77 1 2 1 1 9 ALA H . 9 ALA HN 1 1 78 1 1 1 1 8 LEU QB . 8 LEU QB 1 1 78 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 79 1 1 1 1 8 LEU QB . 8 LEU QB 1 1 79 1 2 1 1 11 TYR QE . 11 TYR QE 1 1 80 1 1 1 1 8 LEU HB2 . 8 LEU HB2 1 1 80 1 2 1 1 9 ALA H . 9 ALA HN 1 1 81 1 1 1 1 8 LEU HB2 . 8 LEU HB2 1 1 81 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 82 1 1 1 1 8 LEU HB2 . 8 LEU HB2 1 1 82 1 2 1 1 11 TYR QE . 11 TYR QE 1 1 83 1 1 1 1 8 LEU HB3 . 8 LEU HB3 1 1 83 1 2 1 1 9 ALA H . 9 ALA HN 1 1 84 1 1 1 1 8 LEU HB3 . 8 LEU HB3 1 1 84 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 85 1 1 1 1 8 LEU HB3 . 8 LEU HB3 1 1 85 1 2 1 1 11 TYR QE . 11 TYR QE 1 1 86 1 1 1 1 8 LEU QD . 8 LEU QQD 1 1 86 1 2 1 1 9 ALA H . 9 ALA HN 1 1 87 1 1 1 1 8 LEU MD1 . 8 LEU QD1 1 1 87 1 2 1 1 9 ALA H . 9 ALA HN 1 1 88 1 1 1 1 8 LEU MD1 . 8 LEU QD1 1 1 88 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 89 1 1 1 1 8 LEU MD1 . 8 LEU QD1 1 1 89 1 2 1 1 11 TYR QE . 11 TYR QE 1 1 90 1 1 1 1 8 LEU MD2 . 8 LEU QD2 1 1 90 1 2 1 1 9 ALA H . 9 ALA HN 1 1 91 1 1 1 1 8 LEU MD2 . 8 LEU QD2 1 1 91 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 92 1 1 1 1 8 LEU MD2 . 8 LEU QD2 1 1 92 1 2 1 1 11 TYR QE . 11 TYR QE 1 1 93 1 1 1 1 8 LEU HG . 8 LEU HG 1 1 93 1 2 1 1 9 ALA H . 9 ALA HN 1 1 94 1 1 1 1 8 LEU HG . 8 LEU HG 1 1 94 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 95 1 1 1 1 8 LEU HG . 8 LEU HG 1 1 95 1 2 1 1 11 TYR QE . 11 TYR QE 1 1 96 1 1 1 1 9 ALA H . 9 ALA HN 1 1 96 1 2 1 1 9 ALA HA . 9 ALA HA 1 1 97 1 1 1 1 9 ALA H . 9 ALA HN 1 1 97 1 2 1 1 9 ALA MB . 9 ALA QB 1 1 98 1 1 1 1 9 ALA H . 9 ALA HN 1 1 98 1 2 1 1 10 GLY H . 10 GLY HN 1 1 99 1 1 1 1 9 ALA H . 9 ALA HN 1 1 99 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 100 1 1 1 1 9 ALA HA . 9 ALA HA 1 1 100 1 2 1 1 10 GLY H . 10 GLY HN 1 1 101 1 1 1 1 9 ALA HA . 9 ALA HA 1 1 101 1 2 1 1 11 TYR H . 11 TYR HN 1 1 102 1 1 1 1 9 ALA MB . 9 ALA QB 1 1 102 1 2 1 1 10 GLY QA . 10 GLY QA 1 1 103 1 1 1 1 9 ALA MB . 9 ALA QB 1 1 103 1 2 1 1 11 TYR H . 11 TYR HN 1 1 104 1 1 1 1 9 ALA MB . 9 ALA QB 1 1 104 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 105 1 1 1 1 9 ALA MB . 9 ALA QB 1 1 105 1 2 1 1 11 TYR QE . 11 TYR QE 1 1 106 1 1 1 1 10 GLY H . 10 GLY HN 1 1 106 1 2 1 1 11 TYR H . 11 TYR HN 1 1 107 1 1 1 1 10 GLY H . 10 GLY HN 1 1 107 1 2 1 1 11 TYR QD . 11 TYR QD 1 1 108 1 1 1 1 10 GLY QA . 10 GLY QA 1 1 108 1 2 1 1 11 TYR HD2 . 11 TYR HD2 1 1 109 1 1 1 1 10 GLY QA . 10 GLY QA 1 1 109 1 2 1 1 22 THR MG . 22 THR QG2 1 1 110 1 1 1 1 10 GLY QA . 10 GLY QA 1 1 110 1 2 1 1 23 PHE QD . 23 PHE QD 1 1 111 1 1 1 1 11 TYR H . 11 TYR HN 1 1 111 1 2 1 1 11 TYR HB2 . 11 TYR HB2 1 1 112 1 1 1 1 11 TYR H . 11 TYR HN 1 1 112 1 2 1 1 11 TYR HB3 . 11 TYR HB3 1 1 113 1 1 1 1 11 TYR H . 11 TYR HN 1 1 113 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 114 1 1 1 1 11 TYR H . 11 TYR HN 1 1 114 1 2 1 1 21 PRO HA . 21 PRO HA 1 1 115 1 1 1 1 11 TYR H . 11 TYR HN 1 1 115 1 2 1 1 22 THR MG . 22 THR QG2 1 1 116 1 1 1 1 11 TYR HA . 11 TYR HA 1 1 116 1 2 1 1 12 MET H . 12 MET HN 1 1 117 1 1 1 1 11 TYR HA . 11 TYR HA 1 1 117 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 118 1 1 1 1 11 TYR HA . 11 TYR HA 1 1 118 1 2 1 1 21 PRO HA . 21 PRO HA 1 1 119 1 1 1 1 11 TYR HA . 11 TYR HA 1 1 119 1 2 1 1 21 PRO HB2 . 21 PRO HB2 1 1 120 1 1 1 1 11 TYR HA . 11 TYR HA 1 1 120 1 2 1 1 22 THR H . 22 THR HN 1 1 121 1 1 1 1 11 TYR HA . 11 TYR HA 1 1 121 1 2 1 1 22 THR MG . 22 THR QG2 1 1 122 1 1 1 1 11 TYR HB2 . 11 TYR HB2 1 1 122 1 2 1 1 12 MET H . 12 MET HN 1 1 123 1 1 1 1 11 TYR HB2 . 11 TYR HB2 1 1 123 1 2 1 1 19 CYS HB2 . 19 CYSS HB2 1 1 124 1 1 1 1 11 TYR HB2 . 11 TYR HB2 1 1 124 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 125 1 1 1 1 11 TYR HB2 . 11 TYR HB2 1 1 125 1 2 1 1 19 CYS HB3 . 19 CYSS HB3 1 1 126 1 1 1 1 11 TYR HB2 . 11 TYR HB2 1 1 126 1 2 1 1 20 LYS H . 20 LYS HN 1 1 127 1 1 1 1 11 TYR HB3 . 11 TYR HB3 1 1 127 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 128 1 1 1 1 11 TYR HB3 . 11 TYR HB3 1 1 128 1 2 1 1 20 LYS H . 20 LYS HN 1 1 129 1 1 1 1 11 TYR HB3 . 11 TYR HB3 1 1 129 1 2 1 1 21 PRO HA . 21 PRO HA 1 1 130 1 1 1 1 11 TYR HB3 . 11 TYR HB3 1 1 130 1 2 1 1 22 THR H . 22 THR HN 1 1 131 1 1 1 1 11 TYR HB3 . 11 TYR HB3 1 1 131 1 2 1 1 23 PHE QE . 23 PHE QE 1 1 132 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 132 1 2 1 1 12 MET H . 12 MET HN 1 1 133 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 133 1 2 1 1 19 CYS HA . 19 CYSS HA 1 1 134 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 134 1 2 1 1 19 CYS HB2 . 19 CYSS HB2 1 1 135 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 135 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 136 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 136 1 2 1 1 19 CYS HB3 . 19 CYSS HB3 1 1 137 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 137 1 2 1 1 20 LYS H . 20 LYS HN 1 1 138 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 138 1 2 1 1 20 LYS HA . 20 LYS HA 1 1 139 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 139 1 2 1 1 21 PRO HA . 21 PRO HA 1 1 140 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 140 1 2 1 1 21 PRO HD2 . 21 PRO HD2 1 1 141 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 141 1 2 1 1 21 PRO HD3 . 21 PRO HD3 1 1 142 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 142 1 2 1 1 21 PRO HG2 . 21 PRO HG2 1 1 143 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 143 1 2 1 1 21 PRO HG3 . 21 PRO HG3 1 1 144 1 1 1 1 11 TYR QD . 11 TYR QD 1 1 144 1 2 1 1 22 THR H . 22 THR HN 1 1 145 1 1 1 1 11 TYR QE . 11 TYR QE 1 1 145 1 2 1 1 19 CYS HB2 . 19 CYSS HB2 1 1 146 1 1 1 1 11 TYR QE . 11 TYR QE 1 1 146 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 147 1 1 1 1 11 TYR QE . 11 TYR QE 1 1 147 1 2 1 1 19 CYS HB3 . 19 CYSS HB3 1 1 148 1 1 1 1 11 TYR QE . 11 TYR QE 1 1 148 1 2 1 1 20 LYS HA . 20 LYS HA 1 1 149 1 1 1 1 11 TYR QE . 11 TYR QE 1 1 149 1 2 1 1 21 PRO HA . 21 PRO HA 1 1 150 1 1 1 1 11 TYR QE . 11 TYR QE 1 1 150 1 2 1 1 21 PRO HD2 . 21 PRO HD2 1 1 151 1 1 1 1 11 TYR QE . 11 TYR QE 1 1 151 1 2 1 1 21 PRO HD3 . 21 PRO HD3 1 1 152 1 1 1 1 11 TYR QE . 11 TYR QE 1 1 152 1 2 1 1 21 PRO HG2 . 21 PRO HG2 1 1 153 1 1 1 1 11 TYR QE . 11 TYR QE 1 1 153 1 2 1 1 21 PRO QG . 21 PRO QG 1 1 154 1 1 1 1 11 TYR QE . 11 TYR QE 1 1 154 1 2 1 1 21 PRO HG3 . 21 PRO HG3 1 1 155 1 1 1 1 11 TYR QE . 11 TYR QE 1 1 155 1 2 1 1 23 PHE QE . 23 PHE QE 1 1 156 1 1 1 1 12 MET H . 12 MET HN 1 1 156 1 2 1 1 12 MET HB2 . 12 MET HB2 1 1 157 1 1 1 1 12 MET H . 12 MET HN 1 1 157 1 2 1 1 12 MET QB . 12 MET QB 1 1 158 1 1 1 1 12 MET H . 12 MET HN 1 1 158 1 2 1 1 12 MET HB3 . 12 MET HB3 1 1 159 1 1 1 1 12 MET H . 12 MET HN 1 1 159 1 2 1 1 12 MET QG . 12 MET QG 1 1 160 1 1 1 1 12 MET H . 12 MET HN 1 1 160 1 2 1 1 13 ARG H . 13 ARG HN 1 1 161 1 1 1 1 12 MET H . 12 MET HN 1 1 161 1 2 1 1 19 CYS HA . 19 CYSS HA 1 1 162 1 1 1 1 12 MET H . 12 MET HN 1 1 162 1 2 1 1 19 CYS HB2 . 19 CYSS HB2 1 1 163 1 1 1 1 12 MET H . 12 MET HN 1 1 163 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 164 1 1 1 1 12 MET H . 12 MET HN 1 1 164 1 2 1 1 19 CYS HB3 . 19 CYSS HB3 1 1 165 1 1 1 1 12 MET H . 12 MET HN 1 1 165 1 2 1 1 20 LYS H . 20 LYS HN 1 1 166 1 1 1 1 12 MET H . 12 MET HN 1 1 166 1 2 1 1 21 PRO HA . 21 PRO HA 1 1 167 1 1 1 1 12 MET H . 12 MET HN 1 1 167 1 2 1 1 22 THR H . 22 THR HN 1 1 168 1 1 1 1 12 MET H . 12 MET HN 1 1 168 1 2 1 1 22 THR MG . 22 THR QG2 1 1 169 1 1 1 1 12 MET HA . 12 MET HA 1 1 169 1 2 1 1 13 ARG H . 13 ARG HN 1 1 170 1 1 1 1 12 MET HA . 12 MET HA 1 1 170 1 2 1 1 13 ARG QG . 13 ARG QG 1 1 171 1 1 1 1 12 MET HA . 12 MET HA 1 1 171 1 2 1 1 20 LYS H . 20 LYS HN 1 1 172 1 1 1 1 12 MET HA . 12 MET HA 1 1 172 1 2 1 1 22 THR MG . 22 THR QG2 1 1 173 1 1 1 1 12 MET QB . 12 MET QB 1 1 173 1 2 1 1 13 ARG H . 13 ARG HN 1 1 174 1 1 1 1 12 MET QB . 12 MET QB 1 1 174 1 2 1 1 22 THR HB . 22 THR HB 1 1 175 1 1 1 1 12 MET QB . 12 MET QB 1 1 175 1 2 1 1 22 THR MG . 22 THR QG2 1 1 176 1 1 1 1 12 MET HB2 . 12 MET HB2 1 1 176 1 2 1 1 13 ARG H . 13 ARG HN 1 1 177 1 1 1 1 12 MET HB2 . 12 MET HB2 1 1 177 1 2 1 1 22 THR MG . 22 THR QG2 1 1 178 1 1 1 1 12 MET HB3 . 12 MET HB3 1 1 178 1 2 1 1 13 ARG H . 13 ARG HN 1 1 179 1 1 1 1 12 MET HB3 . 12 MET HB3 1 1 179 1 2 1 1 22 THR MG . 22 THR QG2 1 1 180 1 1 1 1 12 MET ME . 12 MET QE 1 1 180 1 2 1 1 13 ARG H . 13 ARG HN 1 1 181 1 1 1 1 12 MET ME . 12 MET QE 1 1 181 1 2 1 1 14 THR HB . 14 THR HB 1 1 182 1 1 1 1 12 MET ME . 12 MET QE 1 1 182 1 2 1 1 14 THR MG . 14 THR QG2 1 1 183 1 1 1 1 12 MET ME . 12 MET QE 1 1 183 1 2 1 1 22 THR H . 22 THR HN 1 1 184 1 1 1 1 12 MET ME . 12 MET QE 1 1 184 1 2 1 1 22 THR HA . 22 THR HA 1 1 185 1 1 1 1 12 MET ME . 12 MET QE 1 1 185 1 2 1 1 22 THR MG . 22 THR QG2 1 1 186 1 1 1 1 12 MET QG . 12 MET QG 1 1 186 1 2 1 1 13 ARG H . 13 ARG HN 1 1 187 1 1 1 1 12 MET QG . 12 MET QG 1 1 187 1 2 1 1 14 THR MG . 14 THR QG2 1 1 188 1 1 1 1 12 MET QG . 12 MET QG 1 1 188 1 2 1 1 19 CYS HA . 19 CYSS HA 1 1 189 1 1 1 1 12 MET QG . 12 MET QG 1 1 189 1 2 1 1 20 LYS H . 20 LYS HN 1 1 190 1 1 1 1 12 MET QG . 12 MET QG 1 1 190 1 2 1 1 22 THR HA . 22 THR HA 1 1 191 1 1 1 1 12 MET QG . 12 MET QG 1 1 191 1 2 1 1 22 THR MG . 22 THR QG2 1 1 192 1 1 1 1 12 MET HG2 . 12 MET HG2 1 1 192 1 2 1 1 13 ARG H . 13 ARG HN 1 1 193 1 1 1 1 12 MET HG2 . 12 MET HG2 1 1 193 1 2 1 1 22 THR HA . 22 THR HA 1 1 194 1 1 1 1 12 MET HG2 . 12 MET HG2 1 1 194 1 2 1 1 22 THR MG . 22 THR QG2 1 1 195 1 1 1 1 12 MET HG3 . 12 MET HG3 1 1 195 1 2 1 1 13 ARG H . 13 ARG HN 1 1 196 1 1 1 1 12 MET HG3 . 12 MET HG3 1 1 196 1 2 1 1 22 THR HA . 22 THR HA 1 1 197 1 1 1 1 12 MET HG3 . 12 MET HG3 1 1 197 1 2 1 1 22 THR MG . 22 THR QG2 1 1 198 1 1 1 1 13 ARG H . 13 ARG HN 1 1 198 1 2 1 1 13 ARG QB . 13 ARG QB 1 1 199 1 1 1 1 13 ARG H . 13 ARG HN 1 1 199 1 2 1 1 13 ARG QD . 13 ARG QD 1 1 200 1 1 1 1 13 ARG H . 13 ARG HN 1 1 200 1 2 1 1 14 THR H . 14 THR HN 1 1 201 1 1 1 1 13 ARG HA . 13 ARG HA 1 1 201 1 2 1 1 13 ARG QD . 13 ARG QD 1 1 202 1 1 1 1 13 ARG HA . 13 ARG HA 1 1 202 1 2 1 1 14 THR H . 14 THR HN 1 1 203 1 1 1 1 13 ARG HA . 13 ARG HA 1 1 203 1 2 1 1 14 THR MG . 14 THR QG2 1 1 204 1 1 1 1 13 ARG HA . 13 ARG HA 1 1 204 1 2 1 1 19 CYS HA . 19 CYSS HA 1 1 205 1 1 1 1 13 ARG HA . 13 ARG HA 1 1 205 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 206 1 1 1 1 13 ARG HA . 13 ARG HA 1 1 206 1 2 1 1 20 LYS H . 20 LYS HN 1 1 207 1 1 1 1 13 ARG QB . 13 ARG QB 1 1 207 1 2 1 1 13 ARG HE . 13 ARG HE 1 1 208 1 1 1 1 13 ARG QB . 13 ARG QB 1 1 208 1 2 1 1 14 THR H . 14 THR HN 1 1 209 1 1 1 1 13 ARG QB . 13 ARG QB 1 1 209 1 2 1 1 17 GLY HA2 . 17 GLY HA1 1 1 210 1 1 1 1 13 ARG QB . 13 ARG QB 1 1 210 1 2 1 1 17 GLY HA3 . 17 GLY HA2 1 1 211 1 1 1 1 13 ARG QB . 13 ARG QB 1 1 211 1 2 1 1 19 CYS HA . 19 CYSS HA 1 1 212 1 1 1 1 13 ARG QD . 13 ARG QD 1 1 212 1 2 1 1 14 THR H . 14 THR HN 1 1 213 1 1 1 1 13 ARG QD . 13 ARG QD 1 1 213 1 2 1 1 17 GLY H . 17 GLY HN 1 1 214 1 1 1 1 13 ARG QD . 13 ARG QD 1 1 214 1 2 1 1 17 GLY HA2 . 17 GLY HA1 1 1 215 1 1 1 1 13 ARG QD . 13 ARG QD 1 1 215 1 2 1 1 17 GLY HA3 . 17 GLY HA2 1 1 216 1 1 1 1 13 ARG QD . 13 ARG QD 1 1 216 1 2 1 1 19 CYS HA . 19 CYSS HA 1 1 217 1 1 1 1 13 ARG HD2 . 13 ARG HD2 1 1 217 1 2 1 1 17 GLY H . 17 GLY HN 1 1 218 1 1 1 1 13 ARG HD3 . 13 ARG HD3 1 1 218 1 2 1 1 17 GLY H . 17 GLY HN 1 1 219 1 1 1 1 13 ARG QG . 13 ARG QG 1 1 219 1 2 1 1 14 THR H . 14 THR HN 1 1 220 1 1 1 1 13 ARG QG . 13 ARG QG 1 1 220 1 2 1 1 17 GLY HA2 . 17 GLY HA1 1 1 221 1 1 1 1 13 ARG QG . 13 ARG QG 1 1 221 1 2 1 1 17 GLY HA3 . 17 GLY HA2 1 1 222 1 1 1 1 14 THR H . 14 THR HN 1 1 222 1 2 1 1 14 THR HB . 14 THR HB 1 1 223 1 1 1 1 14 THR H . 14 THR HN 1 1 223 1 2 1 1 14 THR MG . 14 THR QG2 1 1 224 1 1 1 1 14 THR H . 14 THR HN 1 1 224 1 2 1 1 17 GLY H . 17 GLY HN 1 1 225 1 1 1 1 14 THR H . 14 THR HN 1 1 225 1 2 1 1 17 GLY HA2 . 17 GLY HA1 1 1 226 1 1 1 1 14 THR H . 14 THR HN 1 1 226 1 2 1 1 18 ARG H . 18 ARG HN 1 1 227 1 1 1 1 14 THR H . 14 THR HN 1 1 227 1 2 1 1 18 ARG QG . 18 ARG QG 1 1 228 1 1 1 1 14 THR H . 14 THR HN 1 1 228 1 2 1 1 19 CYS HA . 19 CYSS HA 1 1 229 1 1 1 1 14 THR HA . 14 THR HA 1 1 229 1 2 1 1 15 ALA H . 15 ALA HN 1 1 230 1 1 1 1 14 THR HA . 14 THR HA 1 1 230 1 2 1 1 15 ALA MB . 15 ALA QB 1 1 231 1 1 1 1 14 THR HB . 14 THR HB 1 1 231 1 2 1 1 15 ALA H . 15 ALA HN 1 1 232 1 1 1 1 14 THR HB . 14 THR HB 1 1 232 1 2 1 1 15 ALA MB . 15 ALA QB 1 1 233 1 1 1 1 14 THR HB . 14 THR HB 1 1 233 1 2 1 1 16 ASP H . 16 ASP HN 1 1 234 1 1 1 1 14 THR HB . 14 THR HB 1 1 234 1 2 1 1 18 ARG QB . 18 ARG QB 1 1 235 1 1 1 1 14 THR MG . 14 THR QG2 1 1 235 1 2 1 1 15 ALA H . 15 ALA HN 1 1 236 1 1 1 1 14 THR MG . 14 THR QG2 1 1 236 1 2 1 1 16 ASP H . 16 ASP HN 1 1 237 1 1 1 1 14 THR MG . 14 THR QG2 1 1 237 1 2 1 1 17 GLY H . 17 GLY HN 1 1 238 1 1 1 1 14 THR MG . 14 THR QG2 1 1 238 1 2 1 1 18 ARG H . 18 ARG HN 1 1 239 1 1 1 1 14 THR MG . 14 THR QG2 1 1 239 1 2 1 1 19 CYS H . 19 CYSS HN 1 1 240 1 1 1 1 14 THR MG . 14 THR QG2 1 1 240 1 2 1 1 19 CYS HA . 19 CYSS HA 1 1 241 1 1 1 1 14 THR MG . 14 THR QG2 1 1 241 1 2 1 1 20 LYS H . 20 LYS HN 1 1 242 1 1 1 1 14 THR MG . 14 THR QG2 1 1 242 1 2 1 1 20 LYS HB2 . 20 LYS HB2 1 1 243 1 1 1 1 14 THR MG . 14 THR QG2 1 1 243 1 2 1 1 20 LYS QB . 20 LYS QB 1 1 244 1 1 1 1 14 THR MG . 14 THR QG2 1 1 244 1 2 1 1 20 LYS HB3 . 20 LYS HB3 1 1 245 1 1 1 1 14 THR MG . 14 THR QG2 1 1 245 1 2 1 1 20 LYS QD . 20 LYS QD 1 1 246 1 1 1 1 14 THR MG . 14 THR QG2 1 1 246 1 2 1 1 20 LYS HE2 . 20 LYS HE2 1 1 247 1 1 1 1 14 THR MG . 14 THR QG2 1 1 247 1 2 1 1 20 LYS QE . 20 LYS QE 1 1 248 1 1 1 1 14 THR MG . 14 THR QG2 1 1 248 1 2 1 1 20 LYS HE3 . 20 LYS HE3 1 1 249 1 1 1 1 15 ALA H . 15 ALA HN 1 1 249 1 2 1 1 16 ASP H . 16 ASP HN 1 1 250 1 1 1 1 15 ALA HA . 15 ALA HA 1 1 250 1 2 1 1 16 ASP H . 16 ASP HN 1 1 251 1 1 1 1 15 ALA HA . 15 ALA HA 1 1 251 1 2 1 1 17 GLY H . 17 GLY HN 1 1 252 1 1 1 1 16 ASP H . 16 ASP HN 1 1 252 1 2 1 1 16 ASP HB2 . 16 ASP HB2 1 1 253 1 1 1 1 16 ASP H . 16 ASP HN 1 1 253 1 2 1 1 16 ASP QB . 16 ASP QB 1 1 254 1 1 1 1 16 ASP H . 16 ASP HN 1 1 254 1 2 1 1 16 ASP HB3 . 16 ASP HB3 1 1 255 1 1 1 1 16 ASP H . 16 ASP HN 1 1 255 1 2 1 1 17 GLY HA2 . 17 GLY HA1 1 1 256 1 1 1 1 16 ASP H . 16 ASP HN 1 1 256 1 2 1 1 17 GLY HA3 . 17 GLY HA2 1 1 257 1 1 1 1 16 ASP H . 16 ASP HN 1 1 257 1 2 1 1 18 ARG QB . 18 ARG QB 1 1 258 1 1 1 1 16 ASP HA . 16 ASP HA 1 1 258 1 2 1 1 18 ARG H . 18 ARG HN 1 1 259 1 1 1 1 16 ASP HB2 . 16 ASP HB2 1 1 259 1 2 1 1 17 GLY H . 17 GLY HN 1 1 260 1 1 1 1 16 ASP HB3 . 16 ASP HB3 1 1 260 1 2 1 1 17 GLY H . 17 GLY HN 1 1 261 1 1 1 1 17 GLY H . 17 GLY HN 1 1 261 1 2 1 1 18 ARG H . 18 ARG HN 1 1 262 1 1 1 1 17 GLY H . 17 GLY HN 1 1 262 1 2 1 1 18 ARG QB . 18 ARG QB 1 1 263 1 1 1 1 17 GLY H . 17 GLY HN 1 1 263 1 2 1 1 18 ARG QG . 18 ARG QG 1 1 264 1 1 1 1 18 ARG H . 18 ARG HN 1 1 264 1 2 1 1 18 ARG QB . 18 ARG QB 1 1 265 1 1 1 1 18 ARG H . 18 ARG HN 1 1 265 1 2 1 1 18 ARG HD2 . 18 ARG HD2 1 1 266 1 1 1 1 18 ARG H . 18 ARG HN 1 1 266 1 2 1 1 18 ARG HD3 . 18 ARG HD3 1 1 267 1 1 1 1 18 ARG H . 18 ARG HN 1 1 267 1 2 1 1 18 ARG HG2 . 18 ARG HG2 1 1 268 1 1 1 1 18 ARG H . 18 ARG HN 1 1 268 1 2 1 1 18 ARG QG . 18 ARG QG 1 1 269 1 1 1 1 18 ARG H . 18 ARG HN 1 1 269 1 2 1 1 18 ARG HG3 . 18 ARG HG3 1 1 270 1 1 1 1 18 ARG H . 18 ARG HN 1 1 270 1 2 1 1 19 CYS H . 19 CYSS HN 1 1 271 1 1 1 1 18 ARG HA . 18 ARG HA 1 1 271 1 2 1 1 19 CYS H . 19 CYSS HN 1 1 272 1 1 1 1 18 ARG HA . 18 ARG HA 1 1 272 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 273 1 1 1 1 18 ARG QB . 18 ARG QB 1 1 273 1 2 1 1 19 CYS H . 19 CYSS HN 1 1 274 1 1 1 1 18 ARG QD . 18 ARG QD 1 1 274 1 2 1 1 20 LYS QE . 20 LYS QE 1 1 275 1 1 1 1 18 ARG QG . 18 ARG QG 1 1 275 1 2 1 1 19 CYS H . 19 CYSS HN 1 1 276 1 1 1 1 18 ARG HG2 . 18 ARG HG2 1 1 276 1 2 1 1 19 CYS H . 19 CYSS HN 1 1 277 1 1 1 1 18 ARG HG3 . 18 ARG HG3 1 1 277 1 2 1 1 19 CYS H . 19 CYSS HN 1 1 278 1 1 1 1 19 CYS H . 19 CYSS HN 1 1 278 1 2 1 1 19 CYS QB . 19 CYSS QB 1 1 279 1 1 1 1 19 CYS H . 19 CYSS HN 1 1 279 1 2 1 1 20 LYS H . 20 LYS HN 1 1 280 1 1 1 1 19 CYS HA . 19 CYSS HA 1 1 280 1 2 1 1 20 LYS H . 20 LYS HN 1 1 281 1 1 1 1 19 CYS QB . 19 CYSS QB 1 1 281 1 2 1 1 20 LYS H . 20 LYS HN 1 1 282 1 1 1 1 20 LYS H . 20 LYS HN 1 1 282 1 2 1 1 20 LYS HB2 . 20 LYS HB2 1 1 283 1 1 1 1 20 LYS H . 20 LYS HN 1 1 283 1 2 1 1 20 LYS HB3 . 20 LYS HB3 1 1 284 1 1 1 1 20 LYS H . 20 LYS HN 1 1 284 1 2 1 1 20 LYS HG2 . 20 LYS HG2 1 1 285 1 1 1 1 20 LYS H . 20 LYS HN 1 1 285 1 2 1 1 20 LYS QG . 20 LYS QG 1 1 286 1 1 1 1 20 LYS H . 20 LYS HN 1 1 286 1 2 1 1 20 LYS HG3 . 20 LYS HG3 1 1 287 1 1 1 1 20 LYS H . 20 LYS HN 1 1 287 1 2 1 1 21 PRO HD2 . 21 PRO HD2 1 1 288 1 1 1 1 20 LYS H . 20 LYS HN 1 1 288 1 2 1 1 21 PRO HD3 . 21 PRO HD3 1 1 289 1 1 1 1 20 LYS HA . 20 LYS HA 1 1 289 1 2 1 1 21 PRO HD2 . 21 PRO HD2 1 1 290 1 1 1 1 20 LYS HA . 20 LYS HA 1 1 290 1 2 1 1 21 PRO HD3 . 21 PRO HD3 1 1 291 1 1 1 1 20 LYS HA . 20 LYS HA 1 1 291 1 2 1 1 21 PRO QG . 21 PRO QG 1 1 292 1 1 1 1 20 LYS QB . 20 LYS QB 1 1 292 1 2 1 1 21 PRO HD2 . 21 PRO HD2 1 1 293 1 1 1 1 20 LYS QB . 20 LYS QB 1 1 293 1 2 1 1 21 PRO HD3 . 21 PRO HD3 1 1 294 1 1 1 1 20 LYS HB2 . 20 LYS HB2 1 1 294 1 2 1 1 21 PRO HD2 . 21 PRO HD2 1 1 295 1 1 1 1 20 LYS HB3 . 20 LYS HB3 1 1 295 1 2 1 1 21 PRO HD2 . 21 PRO HD2 1 1 296 1 1 1 1 20 LYS QD . 20 LYS QD 1 1 296 1 2 1 1 21 PRO HD2 . 21 PRO HD2 1 1 297 1 1 1 1 20 LYS QD . 20 LYS QD 1 1 297 1 2 1 1 21 PRO HD3 . 21 PRO HD3 1 1 298 1 1 1 1 20 LYS QE . 20 LYS QE 1 1 298 1 2 1 1 21 PRO QG . 21 PRO QG 1 1 299 1 1 1 1 20 LYS QG . 20 LYS QG 1 1 299 1 2 1 1 21 PRO HD2 . 21 PRO HD2 1 1 300 1 1 1 1 20 LYS QG . 20 LYS QG 1 1 300 1 2 1 1 21 PRO HD3 . 21 PRO HD3 1 1 301 1 1 1 1 20 LYS HG2 . 20 LYS HG2 1 1 301 1 2 1 1 21 PRO HD2 . 21 PRO HD2 1 1 302 1 1 1 1 20 LYS HG2 . 20 LYS HG2 1 1 302 1 2 1 1 21 PRO HD3 . 21 PRO HD3 1 1 303 1 1 1 1 20 LYS HG3 . 20 LYS HG3 1 1 303 1 2 1 1 21 PRO HD2 . 21 PRO HD2 1 1 304 1 1 1 1 20 LYS HG3 . 20 LYS HG3 1 1 304 1 2 1 1 21 PRO HD3 . 21 PRO HD3 1 1 305 1 1 1 1 21 PRO HA . 21 PRO HA 1 1 305 1 2 1 1 22 THR H . 22 THR HN 1 1 306 1 1 1 1 21 PRO HA . 21 PRO HA 1 1 306 1 2 1 1 22 THR MG . 22 THR QG2 1 1 307 1 1 1 1 21 PRO HA . 21 PRO HA 1 1 307 1 2 1 1 23 PHE H . 23 PHE HN 1 1 308 1 1 1 1 21 PRO HB2 . 21 PRO HB2 1 1 308 1 2 1 1 22 THR H . 22 THR HN 1 1 309 1 1 1 1 21 PRO HB2 . 21 PRO HB2 1 1 309 1 2 1 1 23 PHE H . 23 PHE HN 1 1 310 1 1 1 1 21 PRO HB3 . 21 PRO HB3 1 1 310 1 2 1 1 22 THR H . 22 THR HN 1 1 311 1 1 1 1 21 PRO HB3 . 21 PRO HB3 1 1 311 1 2 1 1 23 PHE H . 23 PHE HN 1 1 312 1 1 1 1 21 PRO HB3 . 21 PRO HB3 1 1 312 1 2 1 1 23 PHE QE . 23 PHE QE 1 1 313 1 1 1 1 21 PRO HD3 . 21 PRO HD3 1 1 313 1 2 1 1 23 PHE HZ . 23 PHE HZ 1 1 314 1 1 1 1 21 PRO QG . 21 PRO QG 1 1 314 1 2 1 1 23 PHE HE2 . 23 PHE HE2 1 1 315 1 1 1 1 22 THR H . 22 THR HN 1 1 315 1 2 1 1 22 THR HB . 22 THR HB 1 1 316 1 1 1 1 22 THR H . 22 THR HN 1 1 316 1 2 1 1 22 THR MG . 22 THR QG2 1 1 317 1 1 1 1 22 THR H . 22 THR HN 1 1 317 1 2 1 1 23 PHE H . 23 PHE HN 1 1 318 1 1 1 1 22 THR H . 22 THR HN 1 1 318 1 2 1 1 23 PHE QD . 23 PHE QD 1 1 319 1 1 1 1 22 THR HA . 22 THR HA 1 1 319 1 2 1 1 23 PHE H . 23 PHE HN 1 1 320 1 1 1 1 22 THR HA . 22 THR HA 1 1 320 1 2 1 1 23 PHE QD . 23 PHE QD 1 1 321 1 1 1 1 22 THR HB . 22 THR HB 1 1 321 1 2 1 1 23 PHE H . 23 PHE HN 1 1 322 1 1 1 1 22 THR MG . 22 THR QG2 1 1 322 1 2 1 1 23 PHE H . 23 PHE HN 1 1 323 1 1 1 1 22 THR MG . 22 THR QG2 1 1 323 1 2 1 1 23 PHE QD . 23 PHE QD 1 1 324 1 1 1 1 22 THR MG . 22 THR QG2 1 1 324 1 2 1 1 23 PHE QE . 23 PHE QE 1 1 325 1 1 1 1 23 PHE H . 23 PHE HN 1 1 325 1 2 1 1 23 PHE HB2 . 23 PHE HB2 1 1 326 1 1 1 1 23 PHE H . 23 PHE HN 1 1 326 1 2 1 1 23 PHE HB3 . 23 PHE HB3 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 . . . . . . . 3.01 1 1 2 1 . . . . . . . 3.85 1 1 3 1 . . . . . . . 4.13 1 1 4 1 . . . . . . . 4.13 1 1 5 1 . . . . . . . 3.37 1 1 6 1 . . . . . . . 3.13 1 1 7 1 . . . . . . . 3.37 1 1 8 1 . . . . . . . 8.12 1 1 9 1 . . . . . . . 8.12 1 1 10 1 . . . . . . . 8.12 1 1 11 1 . . . . . . . 8.12 1 1 12 1 . . . . . . . 2.87 1 1 13 1 . . . . . . . 3.59 1 1 14 1 . . . . . . . 3.41 1 1 15 1 . . . . . . . 3.59 1 1 16 1 . . . . . . . 3.34 1 1 17 1 . . . . . . . 5.15 1 1 18 1 . . . . . . . 4.42 1 1 19 1 . . . . . . . 3.26 1 1 20 1 . . . . . . . 4.49 1 1 21 1 . . . . . . . 5.47 1 1 22 1 . . . . . . . 6.95 1 1 23 1 . . . . . . . 6.61 1 1 24 1 . . . . . . . 6.87 1 1 25 1 . . . . . . . 6.69 1 1 26 1 . . . . . . . 2.94 1 1 27 1 . . . . . . . 4.72 1 1 28 1 . . . . . . . 3.04 1 1 29 1 . . . . . . . 6.37 1 1 30 1 . . . . . . . 3.55 1 1 31 1 . . . . . . . 3.55 1 1 32 1 . . . . . . . 2.98 1 1 33 1 . . . . . . . 4.74 1 1 34 1 . . . . . . . 3.72 1 1 35 1 . . . . . . . 3.62 1 1 36 1 . . . . . . . 3.39 1 1 37 1 . . . . . . . 3.62 1 1 38 1 . . . . . . . 2.8 1 1 39 1 . . . . . . . 4.06 1 1 40 1 . . . . . . . 6.08 1 1 41 1 . . . . . . . 3.3 1 1 42 1 . . . . . . . 4.57 1 1 43 1 . . . . . . . 4.01 1 1 44 1 . . . . . . . 4.35 1 1 45 1 . . . . . . . 8.0 1 1 46 1 . . . . . . . 6.88 1 1 47 1 . . . . . . . 6.88 1 1 48 1 . . . . . . . 5.27 1 1 49 1 . . . . . . . 6.88 1 1 50 1 . . . . . . . 3.62 1 1 51 1 . . . . . . . 4.92 1 1 52 1 . . . . . . . 4.6 1 1 53 1 . . . . . . . 4.81 1 1 54 1 . . . . . . . 8.14 1 1 55 1 . . . . . . . 6.64 1 1 56 1 . . . . . . . 6.64 1 1 57 1 . . . . . . . 3.62 1 1 58 1 . . . . . . . 4.92 1 1 59 1 . . . . . . . 4.6 1 1 60 1 . . . . . . . 4.81 1 1 61 1 . . . . . . . 8.14 1 1 62 1 . . . . . . . 6.64 1 1 63 1 . . . . . . . 6.64 1 1 64 1 . . . . . . . 2.0 1 1 65 1 . . . . . . . 3.05 1 1 66 1 . . . . . . . 3.05 1 1 67 1 . . . . . . . 5.73 1 1 68 1 . . . . . . . 5.73 1 1 69 1 . . . . . . . 4.27 1 1 70 1 . . . . . . . 4.09 1 1 71 1 . . . . . . . 3.8 1 1 72 1 . . . . . . . 4.42 1 1 73 1 . . . . . . . 8.14 1 1 74 1 . . . . . . . 6.01 1 1 75 1 . . . . . . . 3.8 1 1 76 1 . . . . . . . 2.67 1 1 77 1 . . . . . . . 3.51 1 1 78 1 . . . . . . . 7.44 1 1 79 1 . . . . . . . 7.65 1 1 80 1 . . . . . . . 3.88 1 1 81 1 . . . . . . . 8.14 1 1 82 1 . . . . . . . 7.81 1 1 83 1 . . . . . . . 3.88 1 1 84 1 . . . . . . . 8.14 1 1 85 1 . . . . . . . 7.81 1 1 86 1 . . . . . . . 5.47 1 1 87 1 . . . . . . . 6.13 1 1 88 1 . . . . . . . 9.17 1 1 89 1 . . . . . . . 9.16 1 1 90 1 . . . . . . . 6.13 1 1 91 1 . . . . . . . 9.17 1 1 92 1 . . . . . . . 9.16 1 1 93 1 . . . . . . . 3.34 1 1 94 1 . . . . . . . 7.49 1 1 95 1 . . . . . . . 7.74 1 1 96 1 . . . . . . . 2.47 1 1 97 1 . . . . . . . 3.57 1 1 98 1 . . . . . . . 4.16 1 1 99 1 . . . . . . . 8.14 1 1 100 1 . . . . . . . 3.16 1 1 101 1 . . . . . . . 4.13 1 1 102 1 . . . . . . . 7.51 1 1 103 1 . . . . . . . 6.88 1 1 104 1 . . . . . . . 9.17 1 1 105 1 . . . . . . . 9.16 1 1 106 1 . . . . . . . 3.19 1 1 107 1 . . . . . . . 8.14 1 1 108 1 . . . . . . . 6.7 1 1 109 1 . . . . . . . 7.9 1 1 110 1 . . . . . . . 9.0 1 1 111 1 . . . . . . . 3.34 1 1 112 1 . . . . . . . 3.77 1 1 113 1 . . . . . . . 6.88 1 1 114 1 . . . . . . . 4.92 1 1 115 1 . . . . . . . 7.03 1 1 116 1 . . . . . . . 2.9 1 1 117 1 . . . . . . . 6.44 1 1 118 1 . . . . . . . 2.94 1 1 119 1 . . . . . . . 6.0 1 1 120 1 . . . . . . . 3.23 1 1 121 1 . . . . . . . 6.42 1 1 122 1 . . . . . . . 3.95 1 1 123 1 . . . . . . . 4.38 1 1 124 1 . . . . . . . 4.18 1 1 125 1 . . . . . . . 4.38 1 1 126 1 . . . . . . . 6.0 1 1 127 1 . . . . . . . 4.54 1 1 128 1 . . . . . . . 5.78 1 1 129 1 . . . . . . . 6.0 1 1 130 1 . . . . . . . 6.0 1 1 131 1 . . . . . . . 8.12 1 1 132 1 . . . . . . . 8.14 1 1 133 1 . . . . . . . 8.14 1 1 134 1 . . . . . . . 6.84 1 1 135 1 . . . . . . . 6.57 1 1 136 1 . . . . . . . 6.84 1 1 137 1 . . . . . . . 8.14 1 1 138 1 . . . . . . . 6.27 1 1 139 1 . . . . . . . 7.17 1 1 140 1 . . . . . . . 8.14 1 1 141 1 . . . . . . . 7.2 1 1 142 1 . . . . . . . 8.14 1 1 143 1 . . . . . . . 8.14 1 1 144 1 . . . . . . . 8.14 1 1 145 1 . . . . . . . 8.13 1 1 146 1 . . . . . . . 7.96 1 1 147 1 . . . . . . . 8.13 1 1 148 1 . . . . . . . 7.77 1 1 149 1 . . . . . . . 7.63 1 1 150 1 . . . . . . . 7.66 1 1 151 1 . . . . . . . 6.37 1 1 152 1 . . . . . . . 8.13 1 1 153 1 . . . . . . . 7.43 1 1 154 1 . . . . . . . 8.13 1 1 155 1 . . . . . . . 10.25 1 1 156 1 . . . . . . . 3.98 1 1 157 1 . . . . . . . 3.76 1 1 158 1 . . . . . . . 3.98 1 1 159 1 . . . . . . . 4.32 1 1 160 1 . . . . . . . 4.56 1 1 161 1 . . . . . . . 4.31 1 1 162 1 . . . . . . . 6.0 1 1 163 1 . . . . . . . 5.69 1 1 164 1 . . . . . . . 6.0 1 1 165 1 . . . . . . . 3.34 1 1 166 1 . . . . . . . 3.91 1 1 167 1 . . . . . . . 4.2 1 1 168 1 . . . . . . . 5.7 1 1 169 1 . . . . . . . 2.58 1 1 170 1 . . . . . . . 6.88 1 1 171 1 . . . . . . . 4.7 1 1 172 1 . . . . . . . 7.03 1 1 173 1 . . . . . . . 3.41 1 1 174 1 . . . . . . . 6.88 1 1 175 1 . . . . . . . 5.41 1 1 176 1 . . . . . . . 3.66 1 1 177 1 . . . . . . . 5.59 1 1 178 1 . . . . . . . 3.66 1 1 179 1 . . . . . . . 5.59 1 1 180 1 . . . . . . . 7.03 1 1 181 1 . . . . . . . 6.42 1 1 182 1 . . . . . . . 7.88 1 1 183 1 . . . . . . . 7.03 1 1 184 1 . . . . . . . 6.56 1 1 185 1 . . . . . . . 7.95 1 1 186 1 . . . . . . . 5.54 1 1 187 1 . . . . . . . 7.22 1 1 188 1 . . . . . . . 6.7 1 1 189 1 . . . . . . . 6.59 1 1 190 1 . . . . . . . 5.72 1 1 191 1 . . . . . . . 6.42 1 1 192 1 . . . . . . . 5.86 1 1 193 1 . . . . . . . 6.0 1 1 194 1 . . . . . . . 7.03 1 1 195 1 . . . . . . . 5.86 1 1 196 1 . . . . . . . 6.0 1 1 197 1 . . . . . . . 7.03 1 1 198 1 . . . . . . . 3.82 1 1 199 1 . . . . . . . 6.01 1 1 200 1 . . . . . . . 4.24 1 1 201 1 . . . . . . . 4.61 1 1 202 1 . . . . . . . 2.65 1 1 203 1 . . . . . . . 6.6 1 1 204 1 . . . . . . . 3.98 1 1 205 1 . . . . . . . 6.73 1 1 206 1 . . . . . . . 3.77 1 1 207 1 . . . . . . . 4.97 1 1 208 1 . . . . . . . 4.46 1 1 209 1 . . . . . . . 5.22 1 1 210 1 . . . . . . . 5.72 1 1 211 1 . . . . . . . 6.88 1 1 212 1 . . . . . . . 5.29 1 1 213 1 . . . . . . . 5.77 1 1 214 1 . . . . . . . 5.0 1 1 215 1 . . . . . . . 6.16 1 1 216 1 . . . . . . . 6.88 1 1 217 1 . . . . . . . 6.0 1 1 218 1 . . . . . . . 6.0 1 1 219 1 . . . . . . . 6.41 1 1 220 1 . . . . . . . 6.88 1 1 221 1 . . . . . . . 6.88 1 1 222 1 . . . . . . . 3.44 1 1 223 1 . . . . . . . 4.36 1 1 224 1 . . . . . . . 4.56 1 1 225 1 . . . . . . . 4.74 1 1 226 1 . . . . . . . 3.7 1 1 227 1 . . . . . . . 6.88 1 1 228 1 . . . . . . . 3.84 1 1 229 1 . . . . . . . 2.98 1 1 230 1 . . . . . . . 5.73 1 1 231 1 . . . . . . . 3.01 1 1 232 1 . . . . . . . 5.52 1 1 233 1 . . . . . . . 3.34 1 1 234 1 . . . . . . . 6.59 1 1 235 1 . . . . . . . 5.66 1 1 236 1 . . . . . . . 6.56 1 1 237 1 . . . . . . . 7.03 1 1 238 1 . . . . . . . 6.34 1 1 239 1 . . . . . . . 7.03 1 1 240 1 . . . . . . . 6.88 1 1 241 1 . . . . . . . 5.84 1 1 242 1 . . . . . . . 5.23 1 1 243 1 . . . . . . . 5.05 1 1 244 1 . . . . . . . 5.23 1 1 245 1 . . . . . . . 5.74 1 1 246 1 . . . . . . . 7.03 1 1 247 1 . . . . . . . 6.92 1 1 248 1 . . . . . . . 7.03 1 1 249 1 . . . . . . . 3.3 1 1 250 1 . . . . . . . 3.59 1 1 251 1 . . . . . . . 3.98 1 1 252 1 . . . . . . . 3.59 1 1 253 1 . . . . . . . 3.35 1 1 254 1 . . . . . . . 3.59 1 1 255 1 . . . . . . . 4.27 1 1 256 1 . . . . . . . 4.49 1 1 257 1 . . . . . . . 5.65 1 1 258 1 . . . . . . . 4.45 1 1 259 1 . . . . . . . 4.6 1 1 260 1 . . . . . . . 4.6 1 1 261 1 . . . . . . . 3.19 1 1 262 1 . . . . . . . 5.18 1 1 263 1 . . . . . . . 5.94 1 1 264 1 . . . . . . . 3.58 1 1 265 1 . . . . . . . 6.0 1 1 266 1 . . . . . . . 6.0 1 1 267 1 . . . . . . . 4.52 1 1 268 1 . . . . . . . 4.21 1 1 269 1 . . . . . . . 4.52 1 1 270 1 . . . . . . . 4.34 1 1 271 1 . . . . . . . 2.72 1 1 272 1 . . . . . . . 5.18 1 1 273 1 . . . . . . . 3.89 1 1 274 1 . . . . . . . 6.67 1 1 275 1 . . . . . . . 5.63 1 1 276 1 . . . . . . . 6.0 1 1 277 1 . . . . . . . 6.0 1 1 278 1 . . . . . . . 3.5 1 1 279 1 . . . . . . . 4.38 1 1 280 1 . . . . . . . 2.72 1 1 281 1 . . . . . . . 4.5 1 1 282 1 . . . . . . . 3.44 1 1 283 1 . . . . . . . 3.44 1 1 284 1 . . . . . . . 5.5 1 1 285 1 . . . . . . . 5.11 1 1 286 1 . . . . . . . 5.5 1 1 287 1 . . . . . . . 6.0 1 1 288 1 . . . . . . . 6.0 1 1 289 1 . . . . . . . 3.26 1 1 290 1 . . . . . . . 3.16 1 1 291 1 . . . . . . . 5.79 1 1 292 1 . . . . . . . 4.35 1 1 293 1 . . . . . . . 6.16 1 1 294 1 . . . . . . . 4.52 1 1 295 1 . . . . . . . 4.52 1 1 296 1 . . . . . . . 6.59 1 1 297 1 . . . . . . . 6.88 1 1 298 1 . . . . . . . 7.21 1 1 299 1 . . . . . . . 5.2 1 1 300 1 . . . . . . . 5.79 1 1 301 1 . . . . . . . 5.57 1 1 302 1 . . . . . . . 6.0 1 1 303 1 . . . . . . . 5.57 1 1 304 1 . . . . . . . 6.0 1 1 305 1 . . . . . . . 2.69 1 1 306 1 . . . . . . . 6.24 1 1 307 1 . . . . . . . 4.24 1 1 308 1 . . . . . . . 3.77 1 1 309 1 . . . . . . . 3.91 1 1 310 1 . . . . . . . 3.7 1 1 311 1 . . . . . . . 5.21 1 1 312 1 . . . . . . . 8.12 1 1 313 1 . . . . . . . 6.0 1 1 314 1 . . . . . . . 6.88 1 1 315 1 . . . . . . . 3.8 1 1 316 1 . . . . . . . 4.62 1 1 317 1 . . . . . . . 3.3 1 1 318 1 . . . . . . . 8.12 1 1 319 1 . . . . . . . 3.16 1 1 320 1 . . . . . . . 8.12 1 1 321 1 . . . . . . . 3.8 1 1 322 1 . . . . . . . 6.67 1 1 323 1 . . . . . . . 9.15 1 1 324 1 . . . . . . . 9.15 1 1 325 1 . . . . . . . 3.91 1 1 326 1 . . . . . . . 3.91 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 GLU C C -9.206 -10.838 16.764 1.00 . A A . 1 GLU C 1 1 1 2 1 1 1 GLU CA C -9.241 -11.392 18.190 1.00 . A A . 1 GLU CA 1 1 1 3 1 1 1 GLU CB C -8.498 -12.726 18.278 1.00 . A A . 1 GLU CB 1 1 1 4 1 1 1 GLU CD C -7.703 -12.160 20.604 1.00 . A A . 1 GLU CD 1 1 1 5 1 1 1 GLU CG C -7.285 -12.618 19.205 1.00 . A A . 1 GLU CG 1 1 1 6 1 1 1 GLU HA H -8.779 -10.680 18.875 1.00 . A A . 1 GLU HA 1 1 1 7 1 1 1 GLU HB2 H -9.173 -13.499 18.645 1.00 . A A . 1 GLU HB2 1 1 1 8 1 1 1 GLU HB3 H -8.173 -13.032 17.284 1.00 . A A . 1 GLU HB3 1 1 1 9 1 1 1 GLU HG2 H -6.785 -13.585 19.270 1.00 . A A . 1 GLU HG2 1 1 1 10 1 1 1 GLU HG3 H -6.565 -11.914 18.788 1.00 . A A . 1 GLU HG3 1 1 1 11 1 1 1 GLU N N -10.614 -11.529 18.644 1.00 . A A . 1 GLU N 1 1 1 12 1 1 1 GLU O O -10.211 -10.874 16.056 1.00 . A A . 1 GLU O 1 1 1 13 1 1 1 GLU OE1 O -8.001 -13.051 21.428 1.00 . A A . 1 GLU OE1 1 1 1 14 1 1 1 GLU OE2 O -7.717 -10.928 20.817 1.00 . A A . 1 GLU OE2 1 1 1 15 1 1 2 ASN C C -6.477 -9.128 14.965 1.00 . A A . 2 ASN C 1 1 1 16 1 1 2 ASN CA C -7.859 -9.779 15.057 1.00 . A A . 2 ASN CA 1 1 1 17 1 1 2 ASN CB C -8.908 -8.703 14.767 1.00 . A A . 2 ASN CB 1 1 1 18 1 1 2 ASN CG C -8.997 -7.697 15.917 1.00 . A A . 2 ASN CG 1 1 1 19 1 1 2 ASN H H -7.227 -10.312 16.970 1.00 . A A . 2 ASN H 1 1 1 20 1 1 2 ASN HA H -7.971 -10.621 14.375 1.00 . A A . 2 ASN HA 1 1 1 21 1 1 2 ASN HB2 H -8.654 -8.183 13.843 1.00 . A A . 2 ASN HB2 1 1 1 22 1 1 2 ASN HB3 H -9.880 -9.170 14.611 1.00 . A A . 2 ASN HB3 1 1 1 23 1 1 2 ASN HD21 H -10.921 -8.260 16.198 1.00 . A A . 2 ASN HD21 1 1 1 24 1 1 2 ASN HD22 H -10.341 -7.036 17.278 1.00 . A A . 2 ASN HD22 1 1 1 25 1 1 2 ASN N N -8.039 -10.338 16.386 1.00 . A A . 2 ASN N 1 1 1 26 1 1 2 ASN ND2 N -10.185 -7.661 16.514 1.00 . A A . 2 ASN ND2 1 1 1 27 1 1 2 ASN O O -6.076 -8.384 15.858 1.00 . A A . 2 ASN O 1 1 1 28 1 1 2 ASN OD1 O -8.048 -7.001 16.241 1.00 . A A . 2 ASN OD1 1 1 1 29 1 1 3 PHE C C -4.177 -8.720 12.161 1.00 . A A . 3 PHE C 1 1 1 30 1 1 3 PHE CA C -4.458 -8.890 13.655 1.00 . A A . 3 PHE CA 1 1 1 31 1 1 3 PHE CB C -3.461 -9.893 14.239 1.00 . A A . 3 PHE CB 1 1 1 32 1 1 3 PHE CD1 C -1.744 -8.488 15.401 1.00 . A A . 3 PHE CD1 1 1 1 33 1 1 3 PHE CD2 C -1.074 -9.710 13.502 1.00 . A A . 3 PHE CD2 1 1 1 34 1 1 3 PHE CE1 C -0.426 -7.978 15.538 1.00 . A A . 3 PHE CE1 1 1 1 35 1 1 3 PHE CE2 C 0.244 -9.199 13.639 1.00 . A A . 3 PHE CE2 1 1 1 36 1 1 3 PHE CG C -2.040 -9.343 14.386 1.00 . A A . 3 PHE CG 1 1 1 37 1 1 3 PHE CZ C 0.540 -8.344 14.654 1.00 . A A . 3 PHE CZ 1 1 1 38 1 1 3 PHE H H -6.120 -10.041 13.155 1.00 . A A . 3 PHE H 1 1 1 39 1 1 3 PHE HA H -4.422 -7.916 14.143 1.00 . A A . 3 PHE HA 1 1 1 40 1 1 3 PHE HB2 H -3.817 -10.216 15.216 1.00 . A A . 3 PHE HB2 1 1 1 41 1 1 3 PHE HB3 H -3.433 -10.775 13.601 1.00 . A A . 3 PHE HB3 1 1 1 42 1 1 3 PHE HD1 H -2.518 -8.193 16.110 1.00 . A A . 3 PHE HD1 1 1 1 43 1 1 3 PHE HD2 H -1.311 -10.395 12.688 1.00 . A A . 3 PHE HD2 1 1 1 44 1 1 3 PHE HE1 H -0.188 -7.293 16.351 1.00 . A A . 3 PHE HE1 1 1 1 45 1 1 3 PHE HE2 H 1.018 -9.493 12.930 1.00 . A A . 3 PHE HE2 1 1 1 46 1 1 3 PHE HZ H 1.553 -7.954 14.760 1.00 . A A . 3 PHE HZ 1 1 1 47 1 1 3 PHE N N -5.787 -9.435 13.877 1.00 . A A . 3 PHE N 1 1 1 48 1 1 3 PHE O O -3.672 -9.635 11.513 1.00 . A A . 3 PHE O 1 1 1 49 1 1 4 ASN C C -3.140 -6.259 10.113 1.00 . A A . 4 ASN C 1 1 1 50 1 1 4 ASN CA C -4.307 -7.240 10.252 1.00 . A A . 4 ASN CA 1 1 1 51 1 1 4 ASN CB C -5.548 -6.589 9.637 1.00 . A A . 4 ASN CB 1 1 1 52 1 1 4 ASN CG C -6.159 -5.563 10.593 1.00 . A A . 4 ASN CG 1 1 1 53 1 1 4 ASN H H -4.927 -6.803 12.192 1.00 . A A . 4 ASN H 1 1 1 54 1 1 4 ASN HA H -4.102 -8.202 9.781 1.00 . A A . 4 ASN HA 1 1 1 55 1 1 4 ASN HB2 H -5.280 -6.103 8.699 1.00 . A A . 4 ASN HB2 1 1 1 56 1 1 4 ASN HB3 H -6.285 -7.356 9.400 1.00 . A A . 4 ASN HB3 1 1 1 57 1 1 4 ASN HD21 H -5.624 -4.105 9.296 1.00 . A A . 4 ASN HD21 1 1 1 58 1 1 4 ASN HD22 H -6.437 -3.562 10.726 1.00 . A A . 4 ASN HD22 1 1 1 59 1 1 4 ASN N N -4.516 -7.542 11.658 1.00 . A A . 4 ASN N 1 1 1 60 1 1 4 ASN ND2 N -6.066 -4.306 10.170 1.00 . A A . 4 ASN ND2 1 1 1 61 1 1 4 ASN O O -3.300 -5.174 9.559 1.00 . A A . 4 ASN O 1 1 1 62 1 1 4 ASN OD1 O -6.681 -5.892 11.646 1.00 . A A . 4 ASN OD1 1 1 1 63 1 1 5 GLY C C -0.413 -5.346 11.960 1.00 . A A . 5 GLY C 1 1 1 64 1 1 5 GLY CA C -0.800 -5.850 10.569 1.00 . A A . 5 GLY CA 1 1 1 65 1 1 5 GLY H H -1.871 -7.563 11.077 1.00 . A A . 5 GLY H 1 1 1 66 1 1 5 GLY HA2 H 0.023 -6.422 10.143 1.00 . A A . 5 GLY HA2 1 1 1 67 1 1 5 GLY HA3 H -0.975 -5.002 9.906 1.00 . A A . 5 GLY HA3 1 1 1 68 1 1 5 GLY N N -1.993 -6.678 10.628 1.00 . A A . 5 GLY N 1 1 1 69 1 1 5 GLY O O 0.767 -5.311 12.305 1.00 . A A . 5 GLY O 1 1 1 70 1 1 6 GLY C C -1.845 -3.089 14.251 1.00 . A A . 6 GLY C 1 1 1 71 1 1 6 GLY CA C -1.209 -4.469 14.069 1.00 . A A . 6 GLY CA 1 1 1 72 1 1 6 GLY H H -2.386 -5.001 12.433 1.00 . A A . 6 GLY H 1 1 1 73 1 1 6 GLY HA2 H -1.631 -5.166 14.792 1.00 . A A . 6 GLY HA2 1 1 1 74 1 1 6 GLY HA3 H -0.140 -4.409 14.269 1.00 . A A . 6 GLY HA3 1 1 1 75 1 1 6 GLY N N -1.429 -4.969 12.722 1.00 . A A . 6 GLY N 1 1 1 76 1 1 6 GLY O O -1.187 -2.153 14.701 1.00 . A A . 6 GLY O 1 1 1 77 1 1 7 CYS C C -5.050 -1.989 14.932 1.00 . A A . 7 CYS C 1 1 1 78 1 1 7 CYS CA C -3.850 -1.758 14.012 1.00 . A A . 7 CYS CA 1 1 1 79 1 1 7 CYS CB C -4.276 -1.219 12.644 1.00 . A A . 7 CYS CB 1 1 1 80 1 1 7 CYS H H -3.647 -3.774 13.528 1.00 . A A . 7 CYS H 1 1 1 81 1 1 7 CYS HA H -3.164 -1.032 14.446 1.00 . A A . 7 CYS HA 1 1 1 82 1 1 7 CYS HB2 H -4.656 -2.047 12.045 1.00 . A A . 7 CYS HB2 1 1 1 83 1 1 7 CYS HB3 H -5.102 -0.522 12.785 1.00 . A A . 7 CYS HB3 1 1 1 84 1 1 7 CYS N N -3.118 -3.007 13.893 1.00 . A A . 7 CYS N 1 1 1 85 1 1 7 CYS O O -5.251 -3.097 15.429 1.00 . A A . 7 CYS O 1 1 1 86 1 1 7 CYS SG S -2.951 -0.376 11.705 1.00 . A A . 7 CYS SG 1 1 1 87 1 1 8 LEU C C -8.150 -1.613 15.197 1.00 . A A . 8 LEU C 1 1 1 88 1 1 8 LEU CA C -6.990 -1.001 15.985 1.00 . A A . 8 LEU CA 1 1 1 89 1 1 8 LEU CB C -7.308 0.373 16.579 1.00 . A A . 8 LEU CB 1 1 1 90 1 1 8 LEU CD1 C -8.813 -0.735 18.273 1.00 . A A . 8 LEU CD1 1 1 1 91 1 1 8 LEU CD2 C -8.691 1.795 18.136 1.00 . A A . 8 LEU CD2 1 1 1 92 1 1 8 LEU CG C -8.619 0.478 17.361 1.00 . A A . 8 LEU CG 1 1 1 93 1 1 8 LEU H H -5.645 -0.030 14.725 1.00 . A A . 8 LEU H 1 1 1 94 1 1 8 LEU HA H -6.750 -1.664 16.816 1.00 . A A . 8 LEU HA 1 1 1 95 1 1 8 LEU HB2 H -6.490 0.658 17.240 1.00 . A A . 8 LEU HB2 1 1 1 96 1 1 8 LEU HB3 H -7.332 1.101 15.768 1.00 . A A . 8 LEU HB3 1 1 1 97 1 1 8 LEU HD11 H -7.884 -0.943 18.803 1.00 . A A . 8 LEU HD11 1 1 1 98 1 1 8 LEU HD12 H -9.604 -0.525 18.993 1.00 . A A . 8 LEU HD12 1 1 1 99 1 1 8 LEU HD13 H -9.090 -1.601 17.671 1.00 . A A . 8 LEU HD13 1 1 1 100 1 1 8 LEU HD21 H -8.317 2.606 17.511 1.00 . A A . 8 LEU HD21 1 1 1 101 1 1 8 LEU HD22 H -9.726 1.998 18.412 1.00 . A A . 8 LEU HD22 1 1 1 102 1 1 8 LEU HD23 H -8.082 1.720 19.036 1.00 . A A . 8 LEU HD23 1 1 1 103 1 1 8 LEU HG H -9.443 0.480 16.647 1.00 . A A . 8 LEU HG 1 1 1 104 1 1 8 LEU N N -5.815 -0.927 15.133 1.00 . A A . 8 LEU N 1 1 1 105 1 1 8 LEU O O -8.736 -2.608 15.620 1.00 . A A . 8 LEU O 1 1 1 106 1 1 9 ALA C C -9.941 -0.345 12.257 1.00 . A A . 9 ALA C 1 1 1 107 1 1 9 ALA CA C -9.525 -1.464 13.212 1.00 . A A . 9 ALA CA 1 1 1 108 1 1 9 ALA CB C -10.687 -1.950 14.081 1.00 . A A . 9 ALA CB 1 1 1 109 1 1 9 ALA H H -7.964 -0.184 13.727 1.00 . A A . 9 ALA H 1 1 1 110 1 1 9 ALA HA H -9.146 -2.305 12.631 1.00 . A A . 9 ALA HA 1 1 1 111 1 1 9 ALA HB1 H -10.717 -1.371 15.005 1.00 . A A . 9 ALA HB1 1 1 1 112 1 1 9 ALA HB2 H -11.624 -1.821 13.541 1.00 . A A . 9 ALA HB2 1 1 1 113 1 1 9 ALA HB3 H -10.546 -3.004 14.319 1.00 . A A . 9 ALA HB3 1 1 1 114 1 1 9 ALA N N -8.446 -0.993 14.064 1.00 . A A . 9 ALA N 1 1 1 115 1 1 9 ALA O O -10.713 0.538 12.627 1.00 . A A . 9 ALA O 1 1 1 116 1 1 10 GLY C C -8.454 1.323 9.596 1.00 . A A . 10 GLY C 1 1 1 117 1 1 10 GLY CA C -9.717 0.579 10.032 1.00 . A A . 10 GLY CA 1 1 1 118 1 1 10 GLY H H -8.784 -1.139 10.751 1.00 . A A . 10 GLY H 1 1 1 119 1 1 10 GLY HA2 H -10.177 0.097 9.170 1.00 . A A . 10 GLY HA2 1 1 1 120 1 1 10 GLY HA3 H -10.445 1.289 10.425 1.00 . A A . 10 GLY HA3 1 1 1 121 1 1 10 GLY N N -9.411 -0.417 11.044 1.00 . A A . 10 GLY N 1 1 1 122 1 1 10 GLY O O -8.324 1.703 8.432 1.00 . A A . 10 GLY O 1 1 1 123 1 1 11 TYR C C -5.435 1.400 9.311 1.00 . A A . 11 TYR C 1 1 1 124 1 1 11 TYR CA C -6.307 2.202 10.279 1.00 . A A . 11 TYR CA 1 1 1 125 1 1 11 TYR CB C -5.585 2.313 11.623 1.00 . A A . 11 TYR CB 1 1 1 126 1 1 11 TYR CD1 C -6.349 4.542 12.523 1.00 . A A . 11 TYR CD1 1 1 1 127 1 1 11 TYR CD2 C -6.961 2.566 13.722 1.00 . A A . 11 TYR CD2 1 1 1 128 1 1 11 TYR CE1 C -7.043 5.346 13.495 1.00 . A A . 11 TYR CE1 1 1 1 129 1 1 11 TYR CE2 C -7.655 3.370 14.694 1.00 . A A . 11 TYR CE2 1 1 1 130 1 1 11 TYR CG C -6.322 3.168 12.656 1.00 . A A . 11 TYR CG 1 1 1 131 1 1 11 TYR CZ C -7.661 4.720 14.532 1.00 . A A . 11 TYR CZ 1 1 1 132 1 1 11 TYR H H -7.668 1.198 11.494 1.00 . A A . 11 TYR H 1 1 1 133 1 1 11 TYR HA H -6.547 3.164 9.828 1.00 . A A . 11 TYR HA 1 1 1 134 1 1 11 TYR HB2 H -5.441 1.312 12.032 1.00 . A A . 11 TYR HB2 1 1 1 135 1 1 11 TYR HB3 H -4.594 2.735 11.459 1.00 . A A . 11 TYR HB3 1 1 1 136 1 1 11 TYR HD1 H -5.845 5.017 11.681 1.00 . A A . 11 TYR HD1 1 1 1 137 1 1 11 TYR HD2 H -6.939 1.481 13.827 1.00 . A A . 11 TYR HD2 1 1 1 138 1 1 11 TYR HE1 H -7.072 6.431 13.402 1.00 . A A . 11 TYR HE1 1 1 1 139 1 1 11 TYR HE2 H -8.163 2.907 15.540 1.00 . A A . 11 TYR HE2 1 1 1 140 1 1 11 TYR HH H -9.268 5.182 15.525 1.00 . A A . 11 TYR HH 1 1 1 141 1 1 11 TYR N N -7.555 1.510 10.550 1.00 . A A . 11 TYR N 1 1 1 142 1 1 11 TYR O O -5.588 0.185 9.192 1.00 . A A . 11 TYR O 1 1 1 143 1 1 11 TYR OH O -8.317 5.481 15.451 1.00 . A A . 11 TYR OH 1 1 1 144 1 1 12 MET C C -2.186 1.611 8.136 1.00 . A A . 12 MET C 1 1 1 145 1 1 12 MET CA C -3.643 1.481 7.688 1.00 . A A . 12 MET CA 1 1 1 146 1 1 12 MET CB C -3.815 2.137 6.316 1.00 . A A . 12 MET CB 1 1 1 147 1 1 12 MET CE C -3.112 6.126 5.539 1.00 . A A . 12 MET CE 1 1 1 148 1 1 12 MET CG C -3.879 3.661 6.441 1.00 . A A . 12 MET CG 1 1 1 149 1 1 12 MET H H -4.422 3.099 8.744 1.00 . A A . 12 MET H 1 1 1 150 1 1 12 MET HA H -3.932 0.431 7.665 1.00 . A A . 12 MET HA 1 1 1 151 1 1 12 MET HB2 H -2.985 1.856 5.669 1.00 . A A . 12 MET HB2 1 1 1 152 1 1 12 MET HB3 H -4.726 1.769 5.845 1.00 . A A . 12 MET HB3 1 1 1 153 1 1 12 MET HE1 H -4.117 6.431 5.829 1.00 . A A . 12 MET HE1 1 1 1 154 1 1 12 MET HE2 H -2.440 6.229 6.391 1.00 . A A . 12 MET HE2 1 1 1 155 1 1 12 MET HE3 H -2.762 6.756 4.722 1.00 . A A . 12 MET HE3 1 1 1 156 1 1 12 MET HG2 H -4.916 3.982 6.539 1.00 . A A . 12 MET HG2 1 1 1 157 1 1 12 MET HG3 H -3.359 3.982 7.343 1.00 . A A . 12 MET HG3 1 1 1 158 1 1 12 MET N N -4.539 2.112 8.642 1.00 . A A . 12 MET N 1 1 1 159 1 1 12 MET O O -1.863 2.453 8.974 1.00 . A A . 12 MET O 1 1 1 160 1 1 12 MET SD S -3.140 4.423 5.006 1.00 . A A . 12 MET SD 1 1 1 161 1 1 13 ARG C C 0.857 1.549 6.834 1.00 . A A . 13 ARG C 1 1 1 162 1 1 13 ARG CA C 0.070 0.773 7.891 1.00 . A A . 13 ARG CA 1 1 1 163 1 1 13 ARG CB C 0.622 -0.650 7.986 1.00 . A A . 13 ARG CB 1 1 1 164 1 1 13 ARG CD C 0.937 -1.272 10.410 1.00 . A A . 13 ARG CD 1 1 1 165 1 1 13 ARG CG C 0.027 -1.391 9.185 1.00 . A A . 13 ARG CG 1 1 1 166 1 1 13 ARG CZ C 2.524 -2.813 11.557 1.00 . A A . 13 ARG CZ 1 1 1 167 1 1 13 ARG H H -1.616 0.083 6.881 1.00 . A A . 13 ARG H 1 1 1 168 1 1 13 ARG HA H 0.126 1.266 8.862 1.00 . A A . 13 ARG HA 1 1 1 169 1 1 13 ARG HB2 H 0.394 -1.194 7.069 1.00 . A A . 13 ARG HB2 1 1 1 170 1 1 13 ARG HB3 H 1.708 -0.618 8.076 1.00 . A A . 13 ARG HB3 1 1 1 171 1 1 13 ARG HD2 H 1.776 -0.612 10.187 1.00 . A A . 13 ARG HD2 1 1 1 172 1 1 13 ARG HD3 H 0.389 -0.822 11.238 1.00 . A A . 13 ARG HD3 1 1 1 173 1 1 13 ARG HE H 0.930 -3.410 10.482 1.00 . A A . 13 ARG HE 1 1 1 174 1 1 13 ARG HG2 H -0.957 -0.983 9.418 1.00 . A A . 13 ARG HG2 1 1 1 175 1 1 13 ARG HG3 H -0.115 -2.442 8.934 1.00 . A A . 13 ARG HG3 1 1 1 176 1 1 13 ARG HH11 H 2.950 -0.837 11.779 1.00 . A A . 13 ARG HH11 1 1 1 177 1 1 13 ARG HH12 H 4.044 -1.921 12.571 1.00 . A A . 13 ARG HH12 1 1 1 178 1 1 13 ARG HH21 H 2.374 -4.841 11.527 1.00 . A A . 13 ARG HH21 1 1 1 179 1 1 13 ARG HH22 H 3.714 -4.214 12.427 1.00 . A A . 13 ARG HH22 1 1 1 180 1 1 13 ARG N N -1.345 0.765 7.561 1.00 . A A . 13 ARG N 1 1 1 181 1 1 13 ARG NE N 1.436 -2.609 10.801 1.00 . A A . 13 ARG NE 1 1 1 182 1 1 13 ARG NH1 N 3.232 -1.769 12.007 1.00 . A A . 13 ARG NH1 1 1 1 183 1 1 13 ARG NH2 N 2.903 -4.061 11.863 1.00 . A A . 13 ARG NH2 1 1 1 184 1 1 13 ARG O O 1.101 1.042 5.740 1.00 . A A . 13 ARG O 1 1 1 185 1 1 14 THR C C 3.357 3.003 5.997 1.00 . A A . 14 THR C 1 1 1 186 1 1 14 THR CA C 1.987 3.618 6.291 1.00 . A A . 14 THR CA 1 1 1 187 1 1 14 THR CB C 2.069 5.014 6.913 1.00 . A A . 14 THR CB 1 1 1 188 1 1 14 THR CG2 C 0.713 5.722 6.943 1.00 . A A . 14 THR CG2 1 1 1 189 1 1 14 THR H H 1.032 3.173 8.088 1.00 . A A . 14 THR H 1 1 1 190 1 1 14 THR HA H 1.451 3.673 5.344 1.00 . A A . 14 THR HA 1 1 1 191 1 1 14 THR HB H 2.816 5.623 6.404 1.00 . A A . 14 THR HB 1 1 1 192 1 1 14 THR HG1 H 3.155 4.164 8.363 1.00 . A A . 14 THR HG1 1 1 1 193 1 1 14 THR HG21 H 0.001 5.120 7.507 1.00 . A A . 14 THR HG21 1 1 1 194 1 1 14 THR HG22 H 0.823 6.697 7.418 1.00 . A A . 14 THR HG22 1 1 1 195 1 1 14 THR HG23 H 0.350 5.854 5.923 1.00 . A A . 14 THR HG23 1 1 1 196 1 1 14 THR N N 1.233 2.767 7.196 1.00 . A A . 14 THR N 1 1 1 197 1 1 14 THR O O 3.600 1.840 6.318 1.00 . A A . 14 THR O 1 1 1 198 1 1 14 THR OG1 O 2.361 4.766 8.286 1.00 . A A . 14 THR OG1 1 1 1 199 1 1 15 ALA C C 6.474 3.551 6.255 1.00 . A A . 15 ALA C 1 1 1 200 1 1 15 ALA CA C 5.552 3.359 5.048 1.00 . A A . 15 ALA CA 1 1 1 201 1 1 15 ALA CB C 6.046 4.114 3.813 1.00 . A A . 15 ALA CB 1 1 1 202 1 1 15 ALA H H 4.007 4.754 5.132 1.00 . A A . 15 ALA H 1 1 1 203 1 1 15 ALA HA H 5.495 2.297 4.810 1.00 . A A . 15 ALA HA 1 1 1 204 1 1 15 ALA HB1 H 5.478 5.038 3.700 1.00 . A A . 15 ALA HB1 1 1 1 205 1 1 15 ALA HB2 H 7.104 4.350 3.929 1.00 . A A . 15 ALA HB2 1 1 1 206 1 1 15 ALA HB3 H 5.908 3.493 2.927 1.00 . A A . 15 ALA HB3 1 1 1 207 1 1 15 ALA N N 4.214 3.810 5.390 1.00 . A A . 15 ALA N 1 1 1 208 1 1 15 ALA O O 7.686 3.378 6.148 1.00 . A A . 15 ALA O 1 1 1 209 1 1 16 ASP C C 6.215 3.063 9.631 1.00 . A A . 16 ASP C 1 1 1 210 1 1 16 ASP CA C 6.612 4.122 8.601 1.00 . A A . 16 ASP CA 1 1 1 211 1 1 16 ASP CB C 6.308 5.498 9.197 1.00 . A A . 16 ASP CB 1 1 1 212 1 1 16 ASP CG C 7.324 5.996 10.227 1.00 . A A . 16 ASP CG 1 1 1 213 1 1 16 ASP H H 4.875 4.044 7.454 1.00 . A A . 16 ASP H 1 1 1 214 1 1 16 ASP HA H 7.660 4.050 8.312 1.00 . A A . 16 ASP HA 1 1 1 215 1 1 16 ASP HB2 H 6.250 6.224 8.386 1.00 . A A . 16 ASP HB2 1 1 1 216 1 1 16 ASP HB3 H 5.324 5.465 9.666 1.00 . A A . 16 ASP HB3 1 1 1 217 1 1 16 ASP N N 5.862 3.906 7.376 1.00 . A A . 16 ASP N 1 1 1 218 1 1 16 ASP O O 6.938 2.830 10.598 1.00 . A A . 16 ASP O 1 1 1 219 1 1 16 ASP OD1 O 8.453 6.321 9.799 1.00 . A A . 16 ASP OD1 1 1 1 220 1 1 16 ASP OD2 O 6.949 6.040 11.418 1.00 . A A . 16 ASP OD2 1 1 1 221 1 1 17 GLY C C 3.570 2.004 11.290 1.00 . A A . 17 GLY C 1 1 1 222 1 1 17 GLY CA C 4.564 1.419 10.283 1.00 . A A . 17 GLY CA 1 1 1 223 1 1 17 GLY H H 4.482 2.644 8.600 1.00 . A A . 17 GLY H 1 1 1 224 1 1 17 GLY HA2 H 4.080 0.633 9.704 1.00 . A A . 17 GLY HA2 1 1 1 225 1 1 17 GLY HA3 H 5.396 0.957 10.815 1.00 . A A . 17 GLY HA3 1 1 1 226 1 1 17 GLY N N 5.065 2.449 9.389 1.00 . A A . 17 GLY N 1 1 1 227 1 1 17 GLY O O 3.078 1.294 12.165 1.00 . A A . 17 GLY O 1 1 1 228 1 1 18 ARG C C 0.941 3.783 11.534 1.00 . A A . 18 ARG C 1 1 1 229 1 1 18 ARG CA C 2.380 3.981 12.015 1.00 . A A . 18 ARG CA 1 1 1 230 1 1 18 ARG CB C 2.689 5.478 12.077 1.00 . A A . 18 ARG CB 1 1 1 231 1 1 18 ARG CD C 4.366 7.174 12.896 1.00 . A A . 18 ARG CD 1 1 1 232 1 1 18 ARG CG C 4.148 5.722 12.465 1.00 . A A . 18 ARG CG 1 1 1 233 1 1 18 ARG CZ C 5.509 7.078 15.108 1.00 . A A . 18 ARG CZ 1 1 1 234 1 1 18 ARG H H 3.711 3.863 10.417 1.00 . A A . 18 ARG H 1 1 1 235 1 1 18 ARG HA H 2.534 3.522 12.991 1.00 . A A . 18 ARG HA 1 1 1 236 1 1 18 ARG HB2 H 2.485 5.936 11.109 1.00 . A A . 18 ARG HB2 1 1 1 237 1 1 18 ARG HB3 H 2.031 5.959 12.801 1.00 . A A . 18 ARG HB3 1 1 1 238 1 1 18 ARG HD2 H 4.509 7.805 12.018 1.00 . A A . 18 ARG HD2 1 1 1 239 1 1 18 ARG HD3 H 3.482 7.545 13.414 1.00 . A A . 18 ARG HD3 1 1 1 240 1 1 18 ARG HE H 6.430 7.486 13.365 1.00 . A A . 18 ARG HE 1 1 1 241 1 1 18 ARG HG2 H 4.429 5.052 13.278 1.00 . A A . 18 ARG HG2 1 1 1 242 1 1 18 ARG HG3 H 4.797 5.488 11.621 1.00 . A A . 18 ARG HG3 1 1 1 243 1 1 18 ARG HH11 H 3.511 6.705 15.168 1.00 . A A . 18 ARG HH11 1 1 1 244 1 1 18 ARG HH12 H 4.320 6.642 16.699 1.00 . A A . 18 ARG HH12 1 1 1 245 1 1 18 ARG HH21 H 7.498 7.403 15.384 1.00 . A A . 18 ARG HH21 1 1 1 246 1 1 18 ARG HH22 H 6.603 7.041 16.822 1.00 . A A . 18 ARG HH22 1 1 1 247 1 1 18 ARG N N 3.306 3.293 11.131 1.00 . A A . 18 ARG N 1 1 1 248 1 1 18 ARG NE N 5.548 7.268 13.782 1.00 . A A . 18 ARG NE 1 1 1 249 1 1 18 ARG NH1 N 4.348 6.783 15.709 1.00 . A A . 18 ARG NH1 1 1 1 250 1 1 18 ARG NH2 N 6.631 7.183 15.833 1.00 . A A . 18 ARG NH2 1 1 1 251 1 1 18 ARG O O 0.562 4.282 10.476 1.00 . A A . 18 ARG O 1 1 1 252 1 1 19 CYS C C -1.939 4.119 11.863 1.00 . A A . 19 CYS C 1 1 1 253 1 1 19 CYS CA C -1.211 2.783 12.004 1.00 . A A . 19 CYS CA 1 1 1 254 1 1 19 CYS CB C -1.874 1.877 13.044 1.00 . A A . 19 CYS CB 1 1 1 255 1 1 19 CYS H H 0.494 2.650 13.194 1.00 . A A . 19 CYS H 1 1 1 256 1 1 19 CYS HA H -1.207 2.241 11.058 1.00 . A A . 19 CYS HA 1 1 1 257 1 1 19 CYS HB2 H -1.658 2.270 14.038 1.00 . A A . 19 CYS HB2 1 1 1 258 1 1 19 CYS HB3 H -2.955 1.925 12.910 1.00 . A A . 19 CYS HB3 1 1 1 259 1 1 19 CYS N N 0.179 3.053 12.336 1.00 . A A . 19 CYS N 1 1 1 260 1 1 19 CYS O O -2.323 4.730 12.861 1.00 . A A . 19 CYS O 1 1 1 261 1 1 19 CYS SG S -1.352 0.125 12.981 1.00 . A A . 19 CYS SG 1 1 1 262 1 1 20 LYS C C -4.245 5.506 9.968 1.00 . A A . 20 LYS C 1 1 1 263 1 1 20 LYS CA C -2.787 5.790 10.334 1.00 . A A . 20 LYS CA 1 1 1 264 1 1 20 LYS CB C -2.028 6.579 9.265 1.00 . A A . 20 LYS CB 1 1 1 265 1 1 20 LYS CD C -0.148 8.244 9.038 1.00 . A A . 20 LYS CD 1 1 1 266 1 1 20 LYS CE C 0.283 9.670 9.391 1.00 . A A . 20 LYS CE 1 1 1 267 1 1 20 LYS CG C -1.359 7.816 9.868 1.00 . A A . 20 LYS CG 1 1 1 268 1 1 20 LYS H H -1.795 4.034 9.812 1.00 . A A . 20 LYS H 1 1 1 269 1 1 20 LYS HA H -2.770 6.385 11.247 1.00 . A A . 20 LYS HA 1 1 1 270 1 1 20 LYS HB2 H -1.273 5.942 8.804 1.00 . A A . 20 LYS HB2 1 1 1 271 1 1 20 LYS HB3 H -2.715 6.882 8.475 1.00 . A A . 20 LYS HB3 1 1 1 272 1 1 20 LYS HD2 H 0.680 7.557 9.214 1.00 . A A . 20 LYS HD2 1 1 1 273 1 1 20 LYS HD3 H -0.390 8.186 7.977 1.00 . A A . 20 LYS HD3 1 1 1 274 1 1 20 LYS HE2 H 1.043 10.011 8.688 1.00 . A A . 20 LYS HE2 1 1 1 275 1 1 20 LYS HE3 H -0.566 10.346 9.294 1.00 . A A . 20 LYS HE3 1 1 1 276 1 1 20 LYS HG2 H -2.078 8.634 9.919 1.00 . A A . 20 LYS HG2 1 1 1 277 1 1 20 LYS HG3 H -1.047 7.603 10.891 1.00 . A A . 20 LYS HG3 1 1 1 278 1 1 20 LYS HZ1 H 0.213 9.206 11.380 1.00 . A A . 20 LYS HZ1 1 1 1 279 1 1 20 LYS HZ2 H 1.731 9.326 10.791 1.00 . A A . 20 LYS HZ2 1 1 1 280 1 1 20 LYS HZ3 H 0.856 10.676 11.074 1.00 . A A . 20 LYS HZ3 1 1 1 281 1 1 20 LYS N N -2.110 4.536 10.618 1.00 . A A . 20 LYS N 1 1 1 282 1 1 20 LYS NZ N 0.814 9.724 10.771 1.00 . A A . 20 LYS NZ 1 1 1 283 1 1 20 LYS O O -4.637 4.350 9.817 1.00 . A A . 20 LYS O 1 1 1 284 1 1 21 PRO C C -6.611 6.142 8.010 1.00 . A A . 21 PRO C 1 1 1 285 1 1 21 PRO CA C -6.436 6.489 9.490 1.00 . A A . 21 PRO CA 1 1 1 286 1 1 21 PRO CB C -7.047 7.831 9.862 1.00 . A A . 21 PRO CB 1 1 1 287 1 1 21 PRO CD C -4.600 7.994 10.005 1.00 . A A . 21 PRO CD 1 1 1 288 1 1 21 PRO CG C -5.885 8.805 9.964 1.00 . A A . 21 PRO CG 1 1 1 289 1 1 21 PRO HA H -6.855 5.737 9.998 1.00 . A A . 21 PRO HA 1 1 1 290 1 1 21 PRO HB2 H -7.764 8.156 9.108 1.00 . A A . 21 PRO HB2 1 1 1 291 1 1 21 PRO HB3 H -7.586 7.766 10.807 1.00 . A A . 21 PRO HB3 1 1 1 292 1 1 21 PRO HD2 H -3.915 8.297 9.213 1.00 . A A . 21 PRO HD2 1 1 1 293 1 1 21 PRO HD3 H -4.074 8.131 10.950 1.00 . A A . 21 PRO HD3 1 1 1 294 1 1 21 PRO HG2 H -5.880 9.485 9.112 1.00 . A A . 21 PRO HG2 1 1 1 295 1 1 21 PRO HG3 H -5.978 9.418 10.860 1.00 . A A . 21 PRO HG3 1 1 1 296 1 1 21 PRO N N -5.030 6.609 9.833 1.00 . A A . 21 PRO N 1 1 1 297 1 1 21 PRO O O -5.859 6.621 7.164 1.00 . A A . 21 PRO O 1 1 1 298 1 1 22 THR C C -9.173 5.562 5.875 1.00 . A A . 22 THR C 1 1 1 299 1 1 22 THR CA C -7.893 4.895 6.381 1.00 . A A . 22 THR CA 1 1 1 300 1 1 22 THR CB C -7.954 3.367 6.358 1.00 . A A . 22 THR CB 1 1 1 301 1 1 22 THR CG2 C -7.726 2.794 4.958 1.00 . A A . 22 THR CG2 1 1 1 302 1 1 22 THR H H -8.216 4.927 8.439 1.00 . A A . 22 THR H 1 1 1 303 1 1 22 THR HA H -7.081 5.238 5.741 1.00 . A A . 22 THR HA 1 1 1 304 1 1 22 THR HB H -8.893 3.008 6.777 1.00 . A A . 22 THR HB 1 1 1 305 1 1 22 THR HG1 H -7.075 2.469 7.916 1.00 . A A . 22 THR HG1 1 1 1 306 1 1 22 THR HG21 H -6.821 3.227 4.531 1.00 . A A . 22 THR HG21 1 1 1 307 1 1 22 THR HG22 H -7.614 1.711 5.022 1.00 . A A . 22 THR HG22 1 1 1 308 1 1 22 THR HG23 H -8.578 3.034 4.323 1.00 . A A . 22 THR HG23 1 1 1 309 1 1 22 THR N N -7.609 5.312 7.744 1.00 . A A . 22 THR N 1 1 1 310 1 1 22 THR O O -9.669 5.228 4.800 1.00 . A A . 22 THR O 1 1 1 311 1 1 22 THR OG1 O -6.800 2.962 7.090 1.00 . A A . 22 THR OG1 1 1 1 312 1 1 23 PHE C C -10.941 7.490 4.818 1.00 . A A . 23 PHE C 1 1 1 313 1 1 23 PHE CA C -10.887 7.209 6.321 1.00 . A A . 23 PHE CA 1 1 1 314 1 1 23 PHE CB C -10.857 8.540 7.076 1.00 . A A . 23 PHE CB 1 1 1 315 1 1 23 PHE CD1 C -11.122 7.358 9.267 1.00 . A A . 23 PHE CD1 1 1 1 316 1 1 23 PHE CD2 C -9.813 9.315 9.216 1.00 . A A . 23 PHE CD2 1 1 1 317 1 1 23 PHE CE1 C -10.872 7.226 10.659 1.00 . A A . 23 PHE CE1 1 1 1 318 1 1 23 PHE CE2 C -9.562 9.184 10.608 1.00 . A A . 23 PHE CE2 1 1 1 319 1 1 23 PHE CG C -10.587 8.399 8.575 1.00 . A A . 23 PHE CG 1 1 1 320 1 1 23 PHE CZ C -10.098 8.143 11.300 1.00 . A A . 23 PHE CZ 1 1 1 321 1 1 23 PHE H H -9.265 6.759 7.548 1.00 . A A . 23 PHE H 1 1 1 322 1 1 23 PHE HA H -11.730 6.577 6.601 1.00 . A A . 23 PHE HA 1 1 1 323 1 1 23 PHE HB2 H -10.089 9.177 6.638 1.00 . A A . 23 PHE HB2 1 1 1 324 1 1 23 PHE HB3 H -11.810 9.048 6.935 1.00 . A A . 23 PHE HB3 1 1 1 325 1 1 23 PHE HD1 H -11.744 6.623 8.754 1.00 . A A . 23 PHE HD1 1 1 1 326 1 1 23 PHE HD2 H -9.384 10.150 8.662 1.00 . A A . 23 PHE HD2 1 1 1 327 1 1 23 PHE HE1 H -11.301 6.392 11.214 1.00 . A A . 23 PHE HE1 1 1 1 328 1 1 23 PHE HE2 H -8.942 9.918 11.122 1.00 . A A . 23 PHE HE2 1 1 1 329 1 1 23 PHE HZ H -9.906 8.042 12.368 1.00 . A A . 23 PHE HZ 1 1 1 330 1 1 23 PHE N N -9.674 6.493 6.674 1.00 . A A . 23 PHE N 1 1 1 331 1 1 23 PHE O O -11.999 7.390 4.201 1.00 . A A . 23 PHE O 1 1 2 332 1 1 1 GLU C C -9.488 -8.144 16.537 1.00 . A A . 1 GLU C 1 1 2 333 1 1 1 GLU CA C -9.700 -8.364 18.036 1.00 . A A . 1 GLU CA 1 1 2 334 1 1 1 GLU CB C -9.057 -7.240 18.851 1.00 . A A . 1 GLU CB 1 1 2 335 1 1 1 GLU CD C -9.041 -7.706 21.329 1.00 . A A . 1 GLU CD 1 1 2 336 1 1 1 GLU CG C -9.792 -7.036 20.177 1.00 . A A . 1 GLU CG 1 1 2 337 1 1 1 GLU HA H -10.766 -8.402 18.257 1.00 . A A . 1 GLU HA 1 1 2 338 1 1 1 GLU HB2 H -8.011 -7.478 19.044 1.00 . A A . 1 GLU HB2 1 1 2 339 1 1 1 GLU HB3 H -9.073 -6.314 18.276 1.00 . A A . 1 GLU HB3 1 1 2 340 1 1 1 GLU HG2 H -9.898 -5.970 20.378 1.00 . A A . 1 GLU HG2 1 1 2 341 1 1 1 GLU HG3 H -10.799 -7.448 20.107 1.00 . A A . 1 GLU HG3 1 1 2 342 1 1 1 GLU N N -9.177 -9.660 18.434 1.00 . A A . 1 GLU N 1 1 2 343 1 1 1 GLU O O -10.445 -7.919 15.797 1.00 . A A . 1 GLU O 1 1 2 344 1 1 1 GLU OE1 O -8.871 -8.942 21.254 1.00 . A A . 1 GLU OE1 1 1 2 345 1 1 1 GLU OE2 O -8.653 -6.967 22.260 1.00 . A A . 1 GLU OE2 1 1 2 346 1 1 2 ASN C C -6.385 -8.303 14.546 1.00 . A A . 2 ASN C 1 1 2 347 1 1 2 ASN CA C -7.878 -8.028 14.735 1.00 . A A . 2 ASN CA 1 1 2 348 1 1 2 ASN CB C -8.155 -6.592 14.287 1.00 . A A . 2 ASN CB 1 1 2 349 1 1 2 ASN CG C -7.303 -5.596 15.077 1.00 . A A . 2 ASN CG 1 1 2 350 1 1 2 ASN H H -7.456 -8.400 16.741 1.00 . A A . 2 ASN H 1 1 2 351 1 1 2 ASN HA H -8.504 -8.731 14.185 1.00 . A A . 2 ASN HA 1 1 2 352 1 1 2 ASN HB2 H -7.944 -6.493 13.222 1.00 . A A . 2 ASN HB2 1 1 2 353 1 1 2 ASN HB3 H -9.212 -6.361 14.425 1.00 . A A . 2 ASN HB3 1 1 2 354 1 1 2 ASN HD21 H -7.704 -4.204 13.664 1.00 . A A . 2 ASN HD21 1 1 2 355 1 1 2 ASN HD22 H -6.693 -3.670 14.965 1.00 . A A . 2 ASN HD22 1 1 2 356 1 1 2 ASN N N -8.228 -8.217 16.133 1.00 . A A . 2 ASN N 1 1 2 357 1 1 2 ASN ND2 N -7.227 -4.390 14.522 1.00 . A A . 2 ASN ND2 1 1 2 358 1 1 2 ASN O O -5.631 -8.351 15.517 1.00 . A A . 2 ASN O 1 1 2 359 1 1 2 ASN OD1 O -6.753 -5.904 16.121 1.00 . A A . 2 ASN OD1 1 1 2 360 1 1 3 PHE C C -4.266 -8.212 11.568 1.00 . A A . 3 PHE C 1 1 2 361 1 1 3 PHE CA C -4.613 -8.743 12.961 1.00 . A A . 3 PHE CA 1 1 2 362 1 1 3 PHE CB C -4.436 -10.263 12.973 1.00 . A A . 3 PHE CB 1 1 2 363 1 1 3 PHE CD1 C -2.523 -10.585 14.559 1.00 . A A . 3 PHE CD1 1 1 2 364 1 1 3 PHE CD2 C -2.234 -11.264 12.321 1.00 . A A . 3 PHE CD2 1 1 2 365 1 1 3 PHE CE1 C -1.202 -11.011 14.857 1.00 . A A . 3 PHE CE1 1 1 2 366 1 1 3 PHE CE2 C -0.913 -11.689 12.621 1.00 . A A . 3 PHE CE2 1 1 2 367 1 1 3 PHE CG C -3.012 -10.722 13.296 1.00 . A A . 3 PHE CG 1 1 2 368 1 1 3 PHE CZ C -0.425 -11.553 13.883 1.00 . A A . 3 PHE CZ 1 1 2 369 1 1 3 PHE H H -6.622 -8.435 12.505 1.00 . A A . 3 PHE H 1 1 2 370 1 1 3 PHE HA H -4.000 -8.234 13.705 1.00 . A A . 3 PHE HA 1 1 2 371 1 1 3 PHE HB2 H -5.119 -10.692 13.705 1.00 . A A . 3 PHE HB2 1 1 2 372 1 1 3 PHE HB3 H -4.721 -10.660 11.998 1.00 . A A . 3 PHE HB3 1 1 2 373 1 1 3 PHE HD1 H -3.146 -10.150 15.340 1.00 . A A . 3 PHE HD1 1 1 2 374 1 1 3 PHE HD2 H -2.625 -11.373 11.309 1.00 . A A . 3 PHE HD2 1 1 2 375 1 1 3 PHE HE1 H -0.811 -10.901 15.869 1.00 . A A . 3 PHE HE1 1 1 2 376 1 1 3 PHE HE2 H -0.290 -12.124 11.839 1.00 . A A . 3 PHE HE2 1 1 2 377 1 1 3 PHE HZ H 0.590 -11.879 14.113 1.00 . A A . 3 PHE HZ 1 1 2 378 1 1 3 PHE N N -6.002 -8.476 13.289 1.00 . A A . 3 PHE N 1 1 2 379 1 1 3 PHE O O -4.578 -8.848 10.562 1.00 . A A . 3 PHE O 1 1 2 380 1 1 4 ASN C C -2.002 -5.550 10.539 1.00 . A A . 4 ASN C 1 1 2 381 1 1 4 ASN CA C -3.231 -6.430 10.303 1.00 . A A . 4 ASN CA 1 1 2 382 1 1 4 ASN CB C -4.351 -5.542 9.755 1.00 . A A . 4 ASN CB 1 1 2 383 1 1 4 ASN CG C -3.928 -4.871 8.447 1.00 . A A . 4 ASN CG 1 1 2 384 1 1 4 ASN H H -3.373 -6.543 12.378 1.00 . A A . 4 ASN H 1 1 2 385 1 1 4 ASN HA H -3.028 -7.257 9.622 1.00 . A A . 4 ASN HA 1 1 2 386 1 1 4 ASN HB2 H -5.246 -6.141 9.588 1.00 . A A . 4 ASN HB2 1 1 2 387 1 1 4 ASN HB3 H -4.609 -4.781 10.491 1.00 . A A . 4 ASN HB3 1 1 2 388 1 1 4 ASN HD21 H -4.211 -3.073 9.333 1.00 . A A . 4 ASN HD21 1 1 2 389 1 1 4 ASN HD22 H -3.679 -3.012 7.686 1.00 . A A . 4 ASN HD22 1 1 2 390 1 1 4 ASN N N -3.624 -7.053 11.555 1.00 . A A . 4 ASN N 1 1 2 391 1 1 4 ASN ND2 N -3.940 -3.542 8.492 1.00 . A A . 4 ASN ND2 1 1 2 392 1 1 4 ASN O O -1.953 -4.411 10.078 1.00 . A A . 4 ASN O 1 1 2 393 1 1 4 ASN OD1 O -3.610 -5.518 7.461 1.00 . A A . 4 ASN OD1 1 1 2 394 1 1 5 GLY C C 0.207 -4.940 13.024 1.00 . A A . 5 GLY C 1 1 2 395 1 1 5 GLY CA C 0.183 -5.391 11.562 1.00 . A A . 5 GLY CA 1 1 2 396 1 1 5 GLY H H -1.091 -7.038 11.630 1.00 . A A . 5 GLY H 1 1 2 397 1 1 5 GLY HA2 H 1.043 -6.030 11.361 1.00 . A A . 5 GLY HA2 1 1 2 398 1 1 5 GLY HA3 H 0.272 -4.524 10.908 1.00 . A A . 5 GLY HA3 1 1 2 399 1 1 5 GLY N N -1.042 -6.111 11.259 1.00 . A A . 5 GLY N 1 1 2 400 1 1 5 GLY O O 1.252 -4.969 13.670 1.00 . A A . 5 GLY O 1 1 2 401 1 1 6 GLY C C -1.861 -2.758 14.946 1.00 . A A . 6 GLY C 1 1 2 402 1 1 6 GLY CA C -1.088 -4.077 14.876 1.00 . A A . 6 GLY CA 1 1 2 403 1 1 6 GLY H H -1.807 -4.513 12.970 1.00 . A A . 6 GLY H 1 1 2 404 1 1 6 GLY HA2 H -1.600 -4.834 15.469 1.00 . A A . 6 GLY HA2 1 1 2 405 1 1 6 GLY HA3 H -0.097 -3.945 15.313 1.00 . A A . 6 GLY HA3 1 1 2 406 1 1 6 GLY N N -0.960 -4.533 13.503 1.00 . A A . 6 GLY N 1 1 2 407 1 1 6 GLY O O -1.406 -1.800 15.570 1.00 . A A . 6 GLY O 1 1 2 408 1 1 7 CYS C C -5.076 -1.827 15.162 1.00 . A A . 7 CYS C 1 1 2 409 1 1 7 CYS CA C -3.855 -1.565 14.277 1.00 . A A . 7 CYS CA 1 1 2 410 1 1 7 CYS CB C -4.257 -1.179 12.852 1.00 . A A . 7 CYS CB 1 1 2 411 1 1 7 CYS H H -3.378 -3.534 13.792 1.00 . A A . 7 CYS H 1 1 2 412 1 1 7 CYS HA H -3.254 -0.749 14.678 1.00 . A A . 7 CYS HA 1 1 2 413 1 1 7 CYS HB2 H -4.670 -2.057 12.356 1.00 . A A . 7 CYS HB2 1 1 2 414 1 1 7 CYS HB3 H -5.052 -0.436 12.902 1.00 . A A . 7 CYS HB3 1 1 2 415 1 1 7 CYS N N -3.015 -2.751 14.297 1.00 . A A . 7 CYS N 1 1 2 416 1 1 7 CYS O O -5.204 -2.901 15.747 1.00 . A A . 7 CYS O 1 1 2 417 1 1 7 CYS SG S -2.895 -0.513 11.826 1.00 . A A . 7 CYS SG 1 1 2 418 1 1 8 LEU C C -8.241 -1.621 15.215 1.00 . A A . 8 LEU C 1 1 2 419 1 1 8 LEU CA C -7.147 -0.935 16.035 1.00 . A A . 8 LEU CA 1 1 2 420 1 1 8 LEU CB C -7.554 0.437 16.579 1.00 . A A . 8 LEU CB 1 1 2 421 1 1 8 LEU CD1 C -8.996 -0.617 18.359 1.00 . A A . 8 LEU CD1 1 1 2 422 1 1 8 LEU CD2 C -9.124 1.879 17.926 1.00 . A A . 8 LEU CD2 1 1 2 423 1 1 8 LEU CG C -8.895 0.496 17.315 1.00 . A A . 8 LEU CG 1 1 2 424 1 1 8 LEU H H -5.830 0.044 14.752 1.00 . A A . 8 LEU H 1 1 2 425 1 1 8 LEU HA H -6.913 -1.564 16.893 1.00 . A A . 8 LEU HA 1 1 2 426 1 1 8 LEU HB2 H -6.774 0.783 17.257 1.00 . A A . 8 LEU HB2 1 1 2 427 1 1 8 LEU HB3 H -7.588 1.140 15.746 1.00 . A A . 8 LEU HB3 1 1 2 428 1 1 8 LEU HD11 H -8.017 -1.078 18.496 1.00 . A A . 8 LEU HD11 1 1 2 429 1 1 8 LEU HD12 H -9.333 -0.196 19.307 1.00 . A A . 8 LEU HD12 1 1 2 430 1 1 8 LEU HD13 H -9.707 -1.370 18.022 1.00 . A A . 8 LEU HD13 1 1 2 431 1 1 8 LEU HD21 H -8.308 2.114 18.608 1.00 . A A . 8 LEU HD21 1 1 2 432 1 1 8 LEU HD22 H -9.161 2.625 17.132 1.00 . A A . 8 LEU HD22 1 1 2 433 1 1 8 LEU HD23 H -10.066 1.883 18.472 1.00 . A A . 8 LEU HD23 1 1 2 434 1 1 8 LEU HG H -9.691 0.329 16.589 1.00 . A A . 8 LEU HG 1 1 2 435 1 1 8 LEU N N -5.941 -0.826 15.232 1.00 . A A . 8 LEU N 1 1 2 436 1 1 8 LEU O O -8.794 -2.636 15.637 1.00 . A A . 8 LEU O 1 1 2 437 1 1 9 ALA C C -9.971 -0.506 12.178 1.00 . A A . 9 ALA C 1 1 2 438 1 1 9 ALA CA C -9.540 -1.583 13.175 1.00 . A A . 9 ALA CA 1 1 2 439 1 1 9 ALA CB C -10.712 -2.107 14.009 1.00 . A A . 9 ALA CB 1 1 2 440 1 1 9 ALA H H -8.069 -0.215 13.723 1.00 . A A . 9 ALA H 1 1 2 441 1 1 9 ALA HA H -9.097 -2.415 12.630 1.00 . A A . 9 ALA HA 1 1 2 442 1 1 9 ALA HB1 H -10.673 -1.669 15.006 1.00 . A A . 9 ALA HB1 1 1 2 443 1 1 9 ALA HB2 H -11.651 -1.834 13.528 1.00 . A A . 9 ALA HB2 1 1 2 444 1 1 9 ALA HB3 H -10.645 -3.192 14.086 1.00 . A A . 9 ALA HB3 1 1 2 445 1 1 9 ALA N N -8.522 -1.040 14.058 1.00 . A A . 9 ALA N 1 1 2 446 1 1 9 ALA O O -10.800 0.345 12.496 1.00 . A A . 9 ALA O 1 1 2 447 1 1 10 GLY C C -8.450 1.146 9.509 1.00 . A A . 10 GLY C 1 1 2 448 1 1 10 GLY CA C -9.701 0.380 9.943 1.00 . A A . 10 GLY CA 1 1 2 449 1 1 10 GLY H H -8.714 -1.273 10.739 1.00 . A A . 10 GLY H 1 1 2 450 1 1 10 GLY HA2 H -10.130 -0.139 9.086 1.00 . A A . 10 GLY HA2 1 1 2 451 1 1 10 GLY HA3 H -10.454 1.081 10.301 1.00 . A A . 10 GLY HA3 1 1 2 452 1 1 10 GLY N N -9.388 -0.578 10.989 1.00 . A A . 10 GLY N 1 1 2 453 1 1 10 GLY O O -8.291 1.467 8.333 1.00 . A A . 10 GLY O 1 1 2 454 1 1 11 TYR C C -5.461 1.354 9.258 1.00 . A A . 11 TYR C 1 1 2 455 1 1 11 TYR CA C -6.360 2.138 10.216 1.00 . A A . 11 TYR CA 1 1 2 456 1 1 11 TYR CB C -5.651 2.274 11.564 1.00 . A A . 11 TYR CB 1 1 2 457 1 1 11 TYR CD1 C -6.304 4.554 12.420 1.00 . A A . 11 TYR CD1 1 1 2 458 1 1 11 TYR CD2 C -7.101 2.632 13.596 1.00 . A A . 11 TYR CD2 1 1 2 459 1 1 11 TYR CE1 C -6.986 5.410 13.357 1.00 . A A . 11 TYR CE1 1 1 2 460 1 1 11 TYR CE2 C -7.783 3.488 14.533 1.00 . A A . 11 TYR CE2 1 1 2 461 1 1 11 TYR CG C -6.375 3.184 12.559 1.00 . A A . 11 TYR CG 1 1 2 462 1 1 11 TYR CZ C -7.691 4.834 14.367 1.00 . A A . 11 TYR CZ 1 1 2 463 1 1 11 TYR H H -7.728 1.152 11.438 1.00 . A A . 11 TYR H 1 1 2 464 1 1 11 TYR HA H -6.621 3.092 9.758 1.00 . A A . 11 TYR HA 1 1 2 465 1 1 11 TYR HB2 H -5.539 1.285 12.007 1.00 . A A . 11 TYR HB2 1 1 2 466 1 1 11 TYR HB3 H -4.646 2.664 11.398 1.00 . A A . 11 TYR HB3 1 1 2 467 1 1 11 TYR HD1 H -5.730 4.991 11.601 1.00 . A A . 11 TYR HD1 1 1 2 468 1 1 11 TYR HD2 H -7.158 1.549 13.706 1.00 . A A . 11 TYR HD2 1 1 2 469 1 1 11 TYR HE1 H -6.937 6.495 13.259 1.00 . A A . 11 TYR HE1 1 1 2 470 1 1 11 TYR HE2 H -8.359 3.065 15.356 1.00 . A A . 11 TYR HE2 1 1 2 471 1 1 11 TYR HH H -7.829 6.497 15.365 1.00 . A A . 11 TYR HH 1 1 2 472 1 1 11 TYR N N -7.592 1.416 10.483 1.00 . A A . 11 TYR N 1 1 2 473 1 1 11 TYR O O -5.566 0.132 9.163 1.00 . A A . 11 TYR O 1 1 2 474 1 1 11 TYR OH O -8.335 5.642 15.251 1.00 . A A . 11 TYR OH 1 1 2 475 1 1 12 MET C C -2.232 1.623 8.091 1.00 . A A . 12 MET C 1 1 2 476 1 1 12 MET CA C -3.682 1.477 7.624 1.00 . A A . 12 MET CA 1 1 2 477 1 1 12 MET CB C -3.847 2.138 6.254 1.00 . A A . 12 MET CB 1 1 2 478 1 1 12 MET CE C -3.538 5.947 4.889 1.00 . A A . 12 MET CE 1 1 2 479 1 1 12 MET CG C -3.790 3.662 6.371 1.00 . A A . 12 MET CG 1 1 2 480 1 1 12 MET H H -4.520 3.082 8.655 1.00 . A A . 12 MET H 1 1 2 481 1 1 12 MET HA H -3.956 0.422 7.591 1.00 . A A . 12 MET HA 1 1 2 482 1 1 12 MET HB2 H -3.061 1.792 5.582 1.00 . A A . 12 MET HB2 1 1 2 483 1 1 12 MET HB3 H -4.797 1.839 5.814 1.00 . A A . 12 MET HB3 1 1 2 484 1 1 12 MET HE1 H -3.746 6.359 5.877 1.00 . A A . 12 MET HE1 1 1 2 485 1 1 12 MET HE2 H -2.860 6.611 4.353 1.00 . A A . 12 MET HE2 1 1 2 486 1 1 12 MET HE3 H -4.470 5.853 4.331 1.00 . A A . 12 MET HE3 1 1 2 487 1 1 12 MET HG2 H -4.797 4.077 6.318 1.00 . A A . 12 MET HG2 1 1 2 488 1 1 12 MET HG3 H -3.380 3.947 7.340 1.00 . A A . 12 MET HG3 1 1 2 489 1 1 12 MET N N -4.598 2.089 8.572 1.00 . A A . 12 MET N 1 1 2 490 1 1 12 MET O O -1.941 2.420 8.982 1.00 . A A . 12 MET O 1 1 2 491 1 1 12 MET SD S -2.783 4.339 5.061 1.00 . A A . 12 MET SD 1 1 2 492 1 1 13 ARG C C 0.834 1.657 6.755 1.00 . A A . 13 ARG C 1 1 2 493 1 1 13 ARG CA C 0.050 0.874 7.810 1.00 . A A . 13 ARG CA 1 1 2 494 1 1 13 ARG CB C 0.624 -0.541 7.915 1.00 . A A . 13 ARG CB 1 1 2 495 1 1 13 ARG CD C 0.812 -1.052 10.377 1.00 . A A . 13 ARG CD 1 1 2 496 1 1 13 ARG CG C 0.011 -1.294 9.097 1.00 . A A . 13 ARG CG 1 1 2 497 1 1 13 ARG CZ C 2.349 -3.006 10.551 1.00 . A A . 13 ARG CZ 1 1 2 498 1 1 13 ARG H H -1.607 0.197 6.745 1.00 . A A . 13 ARG H 1 1 2 499 1 1 13 ARG HA H 0.091 1.371 8.779 1.00 . A A . 13 ARG HA 1 1 2 500 1 1 13 ARG HB2 H 0.429 -1.085 6.991 1.00 . A A . 13 ARG HB2 1 1 2 501 1 1 13 ARG HB3 H 1.706 -0.490 8.033 1.00 . A A . 13 ARG HB3 1 1 2 502 1 1 13 ARG HD2 H 1.677 -0.425 10.161 1.00 . A A . 13 ARG HD2 1 1 2 503 1 1 13 ARG HD3 H 0.202 -0.514 11.102 1.00 . A A . 13 ARG HD3 1 1 2 504 1 1 13 ARG HE H 0.703 -2.746 11.679 1.00 . A A . 13 ARG HE 1 1 2 505 1 1 13 ARG HG2 H -1.021 -0.972 9.243 1.00 . A A . 13 ARG HG2 1 1 2 506 1 1 13 ARG HG3 H -0.017 -2.362 8.878 1.00 . A A . 13 ARG HG3 1 1 2 507 1 1 13 ARG HH11 H 2.877 -1.634 9.146 1.00 . A A . 13 ARG HH11 1 1 2 508 1 1 13 ARG HH12 H 3.935 -2.998 9.279 1.00 . A A . 13 ARG HH12 1 1 2 509 1 1 13 ARG HH21 H 2.099 -4.546 11.855 1.00 . A A . 13 ARG HH21 1 1 2 510 1 1 13 ARG HH22 H 3.490 -4.666 10.830 1.00 . A A . 13 ARG HH22 1 1 2 511 1 1 13 ARG N N -1.362 0.842 7.469 1.00 . A A . 13 ARG N 1 1 2 512 1 1 13 ARG NE N 1.255 -2.343 10.950 1.00 . A A . 13 ARG NE 1 1 2 513 1 1 13 ARG NH1 N 3.119 -2.503 9.576 1.00 . A A . 13 ARG NH1 1 1 2 514 1 1 13 ARG NH2 N 2.673 -4.171 11.127 1.00 . A A . 13 ARG NH2 1 1 2 515 1 1 13 ARG O O 1.067 1.161 5.654 1.00 . A A . 13 ARG O 1 1 2 516 1 1 14 THR C C 3.317 3.083 5.883 1.00 . A A . 14 THR C 1 1 2 517 1 1 14 THR CA C 1.972 3.725 6.230 1.00 . A A . 14 THR CA 1 1 2 518 1 1 14 THR CB C 2.107 5.100 6.888 1.00 . A A . 14 THR CB 1 1 2 519 1 1 14 THR CG2 C 0.771 5.634 7.409 1.00 . A A . 14 THR CG2 1 1 2 520 1 1 14 THR H H 1.024 3.264 8.026 1.00 . A A . 14 THR H 1 1 2 521 1 1 14 THR HA H 1.414 3.822 5.299 1.00 . A A . 14 THR HA 1 1 2 522 1 1 14 THR HB H 2.574 5.813 6.209 1.00 . A A . 14 THR HB 1 1 2 523 1 1 14 THR HG1 H 3.008 5.697 8.573 1.00 . A A . 14 THR HG1 1 1 2 524 1 1 14 THR HG21 H -0.031 5.314 6.744 1.00 . A A . 14 THR HG21 1 1 2 525 1 1 14 THR HG22 H 0.590 5.245 8.411 1.00 . A A . 14 THR HG22 1 1 2 526 1 1 14 THR HG23 H 0.803 6.723 7.441 1.00 . A A . 14 THR HG23 1 1 2 527 1 1 14 THR N N 1.218 2.869 7.129 1.00 . A A . 14 THR N 1 1 2 528 1 1 14 THR O O 3.477 1.868 5.996 1.00 . A A . 14 THR O 1 1 2 529 1 1 14 THR OG1 O 2.864 4.845 8.070 1.00 . A A . 14 THR OG1 1 1 2 530 1 1 15 ALA C C 6.511 3.602 6.305 1.00 . A A . 15 ALA C 1 1 2 531 1 1 15 ALA CA C 5.575 3.456 5.104 1.00 . A A . 15 ALA CA 1 1 2 532 1 1 15 ALA CB C 6.074 4.228 3.881 1.00 . A A . 15 ALA CB 1 1 2 533 1 1 15 ALA H H 4.113 4.913 5.379 1.00 . A A . 15 ALA H 1 1 2 534 1 1 15 ALA HA H 5.494 2.401 4.844 1.00 . A A . 15 ALA HA 1 1 2 535 1 1 15 ALA HB1 H 5.720 5.258 3.932 1.00 . A A . 15 ALA HB1 1 1 2 536 1 1 15 ALA HB2 H 7.164 4.219 3.863 1.00 . A A . 15 ALA HB2 1 1 2 537 1 1 15 ALA HB3 H 5.692 3.758 2.974 1.00 . A A . 15 ALA HB3 1 1 2 538 1 1 15 ALA N N 4.250 3.927 5.468 1.00 . A A . 15 ALA N 1 1 2 539 1 1 15 ALA O O 7.723 3.429 6.179 1.00 . A A . 15 ALA O 1 1 2 540 1 1 16 ASP C C 6.277 3.005 9.671 1.00 . A A . 16 ASP C 1 1 2 541 1 1 16 ASP CA C 6.678 4.090 8.668 1.00 . A A . 16 ASP CA 1 1 2 542 1 1 16 ASP CB C 6.398 5.451 9.308 1.00 . A A . 16 ASP CB 1 1 2 543 1 1 16 ASP CG C 7.633 6.185 9.834 1.00 . A A . 16 ASP CG 1 1 2 544 1 1 16 ASP H H 4.928 4.058 7.539 1.00 . A A . 16 ASP H 1 1 2 545 1 1 16 ASP HA H 7.723 4.013 8.367 1.00 . A A . 16 ASP HA 1 1 2 546 1 1 16 ASP HB2 H 5.902 6.085 8.573 1.00 . A A . 16 ASP HB2 1 1 2 547 1 1 16 ASP HB3 H 5.698 5.312 10.131 1.00 . A A . 16 ASP HB3 1 1 2 548 1 1 16 ASP N N 5.914 3.919 7.445 1.00 . A A . 16 ASP N 1 1 2 549 1 1 16 ASP O O 6.994 2.753 10.638 1.00 . A A . 16 ASP O 1 1 2 550 1 1 16 ASP OD1 O 8.675 5.510 9.979 1.00 . A A . 16 ASP OD1 1 1 2 551 1 1 16 ASP OD2 O 7.506 7.404 10.080 1.00 . A A . 16 ASP OD2 1 1 2 552 1 1 17 GLY C C 3.631 1.898 11.288 1.00 . A A . 17 GLY C 1 1 2 553 1 1 17 GLY CA C 4.630 1.340 10.271 1.00 . A A . 17 GLY CA 1 1 2 554 1 1 17 GLY H H 4.556 2.603 8.616 1.00 . A A . 17 GLY H 1 1 2 555 1 1 17 GLY HA2 H 4.148 0.568 9.670 1.00 . A A . 17 GLY HA2 1 1 2 556 1 1 17 GLY HA3 H 5.459 0.866 10.794 1.00 . A A . 17 GLY HA3 1 1 2 557 1 1 17 GLY N N 5.133 2.392 9.405 1.00 . A A . 17 GLY N 1 1 2 558 1 1 17 GLY O O 3.138 1.165 12.146 1.00 . A A . 17 GLY O 1 1 2 559 1 1 18 ARG C C 0.997 3.700 11.538 1.00 . A A . 18 ARG C 1 1 2 560 1 1 18 ARG CA C 2.430 3.852 12.054 1.00 . A A . 18 ARG CA 1 1 2 561 1 1 18 ARG CB C 2.760 5.339 12.190 1.00 . A A . 18 ARG CB 1 1 2 562 1 1 18 ARG CD C 4.549 7.028 12.745 1.00 . A A . 18 ARG CD 1 1 2 563 1 1 18 ARG CG C 4.205 5.540 12.651 1.00 . A A . 18 ARG CG 1 1 2 564 1 1 18 ARG CZ C 6.594 6.803 14.151 1.00 . A A . 18 ARG CZ 1 1 2 565 1 1 18 ARG H H 3.766 3.776 10.459 1.00 . A A . 18 ARG H 1 1 2 566 1 1 18 ARG HA H 2.557 3.348 13.012 1.00 . A A . 18 ARG HA 1 1 2 567 1 1 18 ARG HB2 H 2.608 5.838 11.232 1.00 . A A . 18 ARG HB2 1 1 2 568 1 1 18 ARG HB3 H 2.079 5.804 12.903 1.00 . A A . 18 ARG HB3 1 1 2 569 1 1 18 ARG HD2 H 5.099 7.339 11.857 1.00 . A A . 18 ARG HD2 1 1 2 570 1 1 18 ARG HD3 H 3.634 7.620 12.777 1.00 . A A . 18 ARG HD3 1 1 2 571 1 1 18 ARG HE H 4.959 7.853 14.676 1.00 . A A . 18 ARG HE 1 1 2 572 1 1 18 ARG HG2 H 4.349 5.068 13.623 1.00 . A A . 18 ARG HG2 1 1 2 573 1 1 18 ARG HG3 H 4.885 5.049 11.955 1.00 . A A . 18 ARG HG3 1 1 2 574 1 1 18 ARG HH11 H 6.677 5.824 12.370 1.00 . A A . 18 ARG HH11 1 1 2 575 1 1 18 ARG HH12 H 8.091 5.677 13.359 1.00 . A A . 18 ARG HH12 1 1 2 576 1 1 18 ARG HH21 H 6.826 7.660 15.981 1.00 . A A . 18 ARG HH21 1 1 2 577 1 1 18 ARG HH22 H 8.177 6.728 15.426 1.00 . A A . 18 ARG HH22 1 1 2 578 1 1 18 ARG N N 3.361 3.188 11.159 1.00 . A A . 18 ARG N 1 1 2 579 1 1 18 ARG NE N 5.359 7.285 13.957 1.00 . A A . 18 ARG NE 1 1 2 580 1 1 18 ARG NH1 N 7.169 6.037 13.214 1.00 . A A . 18 ARG NH1 1 1 2 581 1 1 18 ARG NH2 N 7.255 7.088 15.282 1.00 . A A . 18 ARG NH2 1 1 2 582 1 1 18 ARG O O 0.650 4.245 10.492 1.00 . A A . 18 ARG O 1 1 2 583 1 1 19 CYS C C -1.856 4.083 11.720 1.00 . A A . 19 CYS C 1 1 2 584 1 1 19 CYS CA C -1.182 2.725 11.928 1.00 . A A . 19 CYS CA 1 1 2 585 1 1 19 CYS CB C -1.911 1.880 12.973 1.00 . A A . 19 CYS CB 1 1 2 586 1 1 19 CYS H H 0.495 2.516 13.146 1.00 . A A . 19 CYS H 1 1 2 587 1 1 19 CYS HA H -1.168 2.154 11.000 1.00 . A A . 19 CYS HA 1 1 2 588 1 1 19 CYS HB2 H -1.780 2.343 13.951 1.00 . A A . 19 CYS HB2 1 1 2 589 1 1 19 CYS HB3 H -2.979 1.898 12.754 1.00 . A A . 19 CYS HB3 1 1 2 590 1 1 19 CYS N N 0.205 2.956 12.296 1.00 . A A . 19 CYS N 1 1 2 591 1 1 19 CYS O O -2.185 4.770 12.685 1.00 . A A . 19 CYS O 1 1 2 592 1 1 19 CYS SG S -1.361 0.137 13.072 1.00 . A A . 19 CYS SG 1 1 2 593 1 1 20 LYS C C -4.157 5.460 9.835 1.00 . A A . 20 LYS C 1 1 2 594 1 1 20 LYS CA C -2.670 5.693 10.109 1.00 . A A . 20 LYS CA 1 1 2 595 1 1 20 LYS CB C -1.928 6.360 8.948 1.00 . A A . 20 LYS CB 1 1 2 596 1 1 20 LYS CD C -1.036 8.711 8.761 1.00 . A A . 20 LYS CD 1 1 2 597 1 1 20 LYS CE C 0.312 9.198 8.227 1.00 . A A . 20 LYS CE 1 1 2 598 1 1 20 LYS CG C -0.891 7.359 9.464 1.00 . A A . 20 LYS CG 1 1 2 599 1 1 20 LYS H H -1.773 3.864 9.675 1.00 . A A . 20 LYS H 1 1 2 600 1 1 20 LYS HA H -2.576 6.351 10.972 1.00 . A A . 20 LYS HA 1 1 2 601 1 1 20 LYS HB2 H -1.436 5.600 8.341 1.00 . A A . 20 LYS HB2 1 1 2 602 1 1 20 LYS HB3 H -2.642 6.871 8.302 1.00 . A A . 20 LYS HB3 1 1 2 603 1 1 20 LYS HD2 H -1.746 8.623 7.939 1.00 . A A . 20 LYS HD2 1 1 2 604 1 1 20 LYS HD3 H -1.442 9.445 9.457 1.00 . A A . 20 LYS HD3 1 1 2 605 1 1 20 LYS HE2 H 1.106 8.929 8.924 1.00 . A A . 20 LYS HE2 1 1 2 606 1 1 20 LYS HE3 H 0.537 8.703 7.282 1.00 . A A . 20 LYS HE3 1 1 2 607 1 1 20 LYS HG2 H -1.010 7.490 10.539 1.00 . A A . 20 LYS HG2 1 1 2 608 1 1 20 LYS HG3 H 0.112 6.966 9.299 1.00 . A A . 20 LYS HG3 1 1 2 609 1 1 20 LYS HZ1 H -0.393 11.073 8.635 1.00 . A A . 20 LYS HZ1 1 1 2 610 1 1 20 LYS HZ2 H 1.194 11.042 8.247 1.00 . A A . 20 LYS HZ2 1 1 2 611 1 1 20 LYS HZ3 H 0.064 10.872 7.080 1.00 . A A . 20 LYS HZ3 1 1 2 612 1 1 20 LYS N N -2.042 4.429 10.454 1.00 . A A . 20 LYS N 1 1 2 613 1 1 20 LYS NZ N 0.293 10.665 8.031 1.00 . A A . 20 LYS NZ 1 1 2 614 1 1 20 LYS O O -4.592 4.321 9.677 1.00 . A A . 20 LYS O 1 1 2 615 1 1 21 PRO C C -6.629 6.222 8.060 1.00 . A A . 21 PRO C 1 1 2 616 1 1 21 PRO CA C -6.346 6.518 9.534 1.00 . A A . 21 PRO CA 1 1 2 617 1 1 21 PRO CB C -6.890 7.864 9.984 1.00 . A A . 21 PRO CB 1 1 2 618 1 1 21 PRO CD C -4.435 7.955 9.967 1.00 . A A . 21 PRO CD 1 1 2 619 1 1 21 PRO CG C -5.696 8.802 10.036 1.00 . A A . 21 PRO CG 1 1 2 620 1 1 21 PRO HA H -6.752 5.763 10.048 1.00 . A A . 21 PRO HA 1 1 2 621 1 1 21 PRO HB2 H -7.646 8.232 9.290 1.00 . A A . 21 PRO HB2 1 1 2 622 1 1 21 PRO HB3 H -7.368 7.785 10.961 1.00 . A A . 21 PRO HB3 1 1 2 623 1 1 21 PRO HD2 H -3.795 8.263 9.140 1.00 . A A . 21 PRO HD2 1 1 2 624 1 1 21 PRO HD3 H -3.844 8.049 10.878 1.00 . A A . 21 PRO HD3 1 1 2 625 1 1 21 PRO HG2 H -5.727 9.507 9.205 1.00 . A A . 21 PRO HG2 1 1 2 626 1 1 21 PRO HG3 H -5.711 9.389 10.954 1.00 . A A . 21 PRO HG3 1 1 2 627 1 1 21 PRO N N -4.916 6.588 9.786 1.00 . A A . 21 PRO N 1 1 2 628 1 1 21 PRO O O -5.912 6.694 7.179 1.00 . A A . 21 PRO O 1 1 2 629 1 1 22 THR C C -9.402 5.719 6.121 1.00 . A A . 22 THR C 1 1 2 630 1 1 22 THR CA C -8.062 5.074 6.485 1.00 . A A . 22 THR CA 1 1 2 631 1 1 22 THR CB C -8.078 3.547 6.394 1.00 . A A . 22 THR CB 1 1 2 632 1 1 22 THR CG2 C -7.948 3.045 4.956 1.00 . A A . 22 THR CG2 1 1 2 633 1 1 22 THR H H -8.253 5.059 8.560 1.00 . A A . 22 THR H 1 1 2 634 1 1 22 THR HA H -7.319 5.472 5.796 1.00 . A A . 22 THR HA 1 1 2 635 1 1 22 THR HB H -8.969 3.138 6.871 1.00 . A A . 22 THR HB 1 1 2 636 1 1 22 THR HG1 H -7.043 2.507 7.755 1.00 . A A . 22 THR HG1 1 1 2 637 1 1 22 THR HG21 H -7.247 3.679 4.411 1.00 . A A . 22 THR HG21 1 1 2 638 1 1 22 THR HG22 H -7.580 2.018 4.961 1.00 . A A . 22 THR HG22 1 1 2 639 1 1 22 THR HG23 H -8.922 3.080 4.469 1.00 . A A . 22 THR HG23 1 1 2 640 1 1 22 THR N N -7.676 5.440 7.837 1.00 . A A . 22 THR N 1 1 2 641 1 1 22 THR O O -9.973 5.420 5.075 1.00 . A A . 22 THR O 1 1 2 642 1 1 22 THR OG1 O -6.857 3.150 7.013 1.00 . A A . 22 THR OG1 1 1 2 643 1 1 23 PHE C C -10.892 8.681 6.226 1.00 . A A . 23 PHE C 1 1 2 644 1 1 23 PHE CA C -11.123 7.279 6.792 1.00 . A A . 23 PHE CA 1 1 2 645 1 1 23 PHE CB C -11.806 7.398 8.156 1.00 . A A . 23 PHE CB 1 1 2 646 1 1 23 PHE CD1 C -10.594 9.361 9.130 1.00 . A A . 23 PHE CD1 1 1 2 647 1 1 23 PHE CD2 C -10.503 7.315 10.293 1.00 . A A . 23 PHE CD2 1 1 2 648 1 1 23 PHE CE1 C -9.786 9.964 10.129 1.00 . A A . 23 PHE CE1 1 1 2 649 1 1 23 PHE CE2 C -9.695 7.918 11.292 1.00 . A A . 23 PHE CE2 1 1 2 650 1 1 23 PHE CG C -10.935 8.048 9.233 1.00 . A A . 23 PHE CG 1 1 2 651 1 1 23 PHE CZ C -9.353 9.231 11.190 1.00 . A A . 23 PHE CZ 1 1 2 652 1 1 23 PHE H H -9.391 6.827 7.856 1.00 . A A . 23 PHE H 1 1 2 653 1 1 23 PHE HA H -11.696 6.690 6.075 1.00 . A A . 23 PHE HA 1 1 2 654 1 1 23 PHE HB2 H -12.722 7.979 8.044 1.00 . A A . 23 PHE HB2 1 1 2 655 1 1 23 PHE HB3 H -12.100 6.404 8.493 1.00 . A A . 23 PHE HB3 1 1 2 656 1 1 23 PHE HD1 H -10.940 9.949 8.280 1.00 . A A . 23 PHE HD1 1 1 2 657 1 1 23 PHE HD2 H -10.778 6.263 10.375 1.00 . A A . 23 PHE HD2 1 1 2 658 1 1 23 PHE HE1 H -9.511 11.016 10.046 1.00 . A A . 23 PHE HE1 1 1 2 659 1 1 23 PHE HE2 H -9.349 7.330 12.142 1.00 . A A . 23 PHE HE2 1 1 2 660 1 1 23 PHE HZ H -8.732 9.693 11.957 1.00 . A A . 23 PHE HZ 1 1 2 661 1 1 23 PHE N N -9.863 6.590 7.007 1.00 . A A . 23 PHE N 1 1 2 662 1 1 23 PHE O O -10.442 8.830 5.091 1.00 . A A . 23 PHE O 1 1 3 663 1 1 1 GLU C C -2.597 -10.202 17.393 1.00 . A A . 1 GLU C 1 1 3 664 1 1 1 GLU CA C -2.906 -11.081 18.606 1.00 . A A . 1 GLU CA 1 1 3 665 1 1 1 GLU CB C -1.690 -11.925 18.996 1.00 . A A . 1 GLU CB 1 1 3 666 1 1 1 GLU CD C -0.137 -12.518 20.892 1.00 . A A . 1 GLU CD 1 1 3 667 1 1 1 GLU CG C -1.509 -11.957 20.515 1.00 . A A . 1 GLU CG 1 1 3 668 1 1 1 GLU HA H -3.193 -10.457 19.452 1.00 . A A . 1 GLU HA 1 1 3 669 1 1 1 GLU HB2 H -1.811 -12.940 18.619 1.00 . A A . 1 GLU HB2 1 1 3 670 1 1 1 GLU HB3 H -0.794 -11.516 18.528 1.00 . A A . 1 GLU HB3 1 1 3 671 1 1 1 GLU HG2 H -1.619 -10.951 20.919 1.00 . A A . 1 GLU HG2 1 1 3 672 1 1 1 GLU HG3 H -2.292 -12.569 20.965 1.00 . A A . 1 GLU HG3 1 1 3 673 1 1 1 GLU N N -4.059 -11.923 18.338 1.00 . A A . 1 GLU N 1 1 3 674 1 1 1 GLU O O -2.543 -8.978 17.507 1.00 . A A . 1 GLU O 1 1 3 675 1 1 1 GLU OE1 O 0.853 -12.047 20.291 1.00 . A A . 1 GLU OE1 1 1 3 676 1 1 1 GLU OE2 O -0.108 -13.405 21.773 1.00 . A A . 1 GLU OE2 1 1 3 677 1 1 2 ASN C C -3.406 -9.799 14.314 1.00 . A A . 2 ASN C 1 1 3 678 1 1 2 ASN CA C -2.100 -10.153 15.027 1.00 . A A . 2 ASN CA 1 1 3 679 1 1 2 ASN CB C -1.267 -11.023 14.083 1.00 . A A . 2 ASN CB 1 1 3 680 1 1 2 ASN CG C -2.041 -12.276 13.666 1.00 . A A . 2 ASN CG 1 1 3 681 1 1 2 ASN H H -2.446 -11.856 16.177 1.00 . A A . 2 ASN H 1 1 3 682 1 1 2 ASN HA H -1.538 -9.270 15.333 1.00 . A A . 2 ASN HA 1 1 3 683 1 1 2 ASN HB2 H -0.994 -10.448 13.198 1.00 . A A . 2 ASN HB2 1 1 3 684 1 1 2 ASN HB3 H -0.338 -11.312 14.573 1.00 . A A . 2 ASN HB3 1 1 3 685 1 1 2 ASN HD21 H -1.294 -12.058 11.796 1.00 . A A . 2 ASN HD21 1 1 3 686 1 1 2 ASN HD22 H -2.346 -13.415 12.020 1.00 . A A . 2 ASN HD22 1 1 3 687 1 1 2 ASN N N -2.401 -10.860 16.259 1.00 . A A . 2 ASN N 1 1 3 688 1 1 2 ASN ND2 N -1.880 -12.610 12.388 1.00 . A A . 2 ASN ND2 1 1 3 689 1 1 2 ASN O O -4.418 -10.475 14.493 1.00 . A A . 2 ASN O 1 1 3 690 1 1 2 ASN OD1 O -2.738 -12.897 14.452 1.00 . A A . 2 ASN OD1 1 1 3 691 1 1 3 PHE C C -4.103 -7.692 11.431 1.00 . A A . 3 PHE C 1 1 3 692 1 1 3 PHE CA C -4.508 -8.288 12.781 1.00 . A A . 3 PHE CA 1 1 3 693 1 1 3 PHE CB C -5.179 -7.202 13.623 1.00 . A A . 3 PHE CB 1 1 3 694 1 1 3 PHE CD1 C -7.542 -6.945 12.835 1.00 . A A . 3 PHE CD1 1 1 3 695 1 1 3 PHE CD2 C -6.001 -5.249 12.289 1.00 . A A . 3 PHE CD2 1 1 3 696 1 1 3 PHE CE1 C -8.565 -6.234 12.154 1.00 . A A . 3 PHE CE1 1 1 3 697 1 1 3 PHE CE2 C -7.024 -4.539 11.606 1.00 . A A . 3 PHE CE2 1 1 3 698 1 1 3 PHE CG C -6.282 -6.437 12.888 1.00 . A A . 3 PHE CG 1 1 3 699 1 1 3 PHE CZ C -8.286 -5.047 11.553 1.00 . A A . 3 PHE CZ 1 1 3 700 1 1 3 PHE H H -2.515 -8.195 13.381 1.00 . A A . 3 PHE H 1 1 3 701 1 1 3 PHE HA H -5.143 -9.158 12.615 1.00 . A A . 3 PHE HA 1 1 3 702 1 1 3 PHE HB2 H -5.603 -7.660 14.517 1.00 . A A . 3 PHE HB2 1 1 3 703 1 1 3 PHE HB3 H -4.421 -6.494 13.956 1.00 . A A . 3 PHE HB3 1 1 3 704 1 1 3 PHE HD1 H -7.767 -7.896 13.317 1.00 . A A . 3 PHE HD1 1 1 3 705 1 1 3 PHE HD2 H -4.991 -4.842 12.330 1.00 . A A . 3 PHE HD2 1 1 3 706 1 1 3 PHE HE1 H -9.576 -6.641 12.111 1.00 . A A . 3 PHE HE1 1 1 3 707 1 1 3 PHE HE2 H -6.799 -3.587 11.125 1.00 . A A . 3 PHE HE2 1 1 3 708 1 1 3 PHE HZ H -9.071 -4.502 11.030 1.00 . A A . 3 PHE HZ 1 1 3 709 1 1 3 PHE N N -3.342 -8.740 13.521 1.00 . A A . 3 PHE N 1 1 3 710 1 1 3 PHE O O -4.697 -8.014 10.403 1.00 . A A . 3 PHE O 1 1 3 711 1 1 4 ASN C C -1.412 -5.296 10.624 1.00 . A A . 4 ASN C 1 1 3 712 1 1 4 ASN CA C -2.603 -6.190 10.271 1.00 . A A . 4 ASN CA 1 1 3 713 1 1 4 ASN CB C -3.682 -5.312 9.637 1.00 . A A . 4 ASN CB 1 1 3 714 1 1 4 ASN CG C -3.154 -4.613 8.383 1.00 . A A . 4 ASN CG 1 1 3 715 1 1 4 ASN H H -2.616 -6.578 12.318 1.00 . A A . 4 ASN H 1 1 3 716 1 1 4 ASN HA H -2.329 -7.007 9.603 1.00 . A A . 4 ASN HA 1 1 3 717 1 1 4 ASN HB2 H -4.549 -5.921 9.381 1.00 . A A . 4 ASN HB2 1 1 3 718 1 1 4 ASN HB3 H -4.020 -4.566 10.357 1.00 . A A . 4 ASN HB3 1 1 3 719 1 1 4 ASN HD21 H -3.564 -2.834 9.256 1.00 . A A . 4 ASN HD21 1 1 3 720 1 1 4 ASN HD22 H -2.881 -2.739 7.668 1.00 . A A . 4 ASN HD22 1 1 3 721 1 1 4 ASN N N -3.094 -6.834 11.478 1.00 . A A . 4 ASN N 1 1 3 722 1 1 4 ASN ND2 N -3.204 -3.286 8.440 1.00 . A A . 4 ASN ND2 1 1 3 723 1 1 4 ASN O O -1.342 -4.149 10.186 1.00 . A A . 4 ASN O 1 1 3 724 1 1 4 ASN OD1 O -2.730 -5.240 7.424 1.00 . A A . 4 ASN OD1 1 1 3 725 1 1 5 GLY C C 0.570 -4.696 13.294 1.00 . A A . 5 GLY C 1 1 3 726 1 1 5 GLY CA C 0.678 -5.124 11.828 1.00 . A A . 5 GLY CA 1 1 3 727 1 1 5 GLY H H -0.571 -6.790 11.763 1.00 . A A . 5 GLY H 1 1 3 728 1 1 5 GLY HA2 H 1.562 -5.746 11.691 1.00 . A A . 5 GLY HA2 1 1 3 729 1 1 5 GLY HA3 H 0.806 -4.244 11.197 1.00 . A A . 5 GLY HA3 1 1 3 730 1 1 5 GLY N N -0.506 -5.856 11.411 1.00 . A A . 5 GLY N 1 1 3 731 1 1 5 GLY O O 1.559 -4.720 14.025 1.00 . A A . 5 GLY O 1 1 3 732 1 1 6 GLY C C -1.703 -2.586 15.067 1.00 . A A . 6 GLY C 1 1 3 733 1 1 6 GLY CA C -0.888 -3.881 15.042 1.00 . A A . 6 GLY CA 1 1 3 734 1 1 6 GLY H H -1.437 -4.297 13.077 1.00 . A A . 6 GLY H 1 1 3 735 1 1 6 GLY HA2 H -1.422 -4.662 15.583 1.00 . A A . 6 GLY HA2 1 1 3 736 1 1 6 GLY HA3 H 0.061 -3.727 15.558 1.00 . A A . 6 GLY HA3 1 1 3 737 1 1 6 GLY N N -0.638 -4.314 13.678 1.00 . A A . 6 GLY N 1 1 3 738 1 1 6 GLY O O -1.303 -1.608 15.696 1.00 . A A . 6 GLY O 1 1 3 739 1 1 7 CYS C C -4.946 -1.750 15.161 1.00 . A A . 7 CYS C 1 1 3 740 1 1 7 CYS CA C -3.708 -1.466 14.308 1.00 . A A . 7 CYS CA 1 1 3 741 1 1 7 CYS CB C -4.076 -1.117 12.865 1.00 . A A . 7 CYS CB 1 1 3 742 1 1 7 CYS H H -3.150 -3.423 13.866 1.00 . A A . 7 CYS H 1 1 3 743 1 1 7 CYS HA H -3.145 -0.624 14.713 1.00 . A A . 7 CYS HA 1 1 3 744 1 1 7 CYS HB2 H -4.400 -2.025 12.358 1.00 . A A . 7 CYS HB2 1 1 3 745 1 1 7 CYS HB3 H -4.930 -0.437 12.877 1.00 . A A . 7 CYS HB3 1 1 3 746 1 1 7 CYS N N -2.832 -2.623 14.374 1.00 . A A . 7 CYS N 1 1 3 747 1 1 7 CYS O O -5.085 -2.839 15.715 1.00 . A A . 7 CYS O 1 1 3 748 1 1 7 CYS SG S -2.729 -0.349 11.894 1.00 . A A . 7 CYS SG 1 1 3 749 1 1 8 LEU C C -8.072 -1.654 15.199 1.00 . A A . 8 LEU C 1 1 3 750 1 1 8 LEU CA C -7.035 -0.881 16.015 1.00 . A A . 8 LEU CA 1 1 3 751 1 1 8 LEU CB C -7.520 0.493 16.484 1.00 . A A . 8 LEU CB 1 1 3 752 1 1 8 LEU CD1 C -8.902 -0.355 18.415 1.00 . A A . 8 LEU CD1 1 1 3 753 1 1 8 LEU CD2 C -9.321 1.960 17.465 1.00 . A A . 8 LEU CD2 1 1 3 754 1 1 8 LEU CG C -8.891 0.524 17.162 1.00 . A A . 8 LEU CG 1 1 3 755 1 1 8 LEU H H -5.693 0.131 14.785 1.00 . A A . 8 LEU H 1 1 3 756 1 1 8 LEU HA H -6.796 -1.461 16.907 1.00 . A A . 8 LEU HA 1 1 3 757 1 1 8 LEU HB2 H -6.785 0.898 17.178 1.00 . A A . 8 LEU HB2 1 1 3 758 1 1 8 LEU HB3 H -7.548 1.159 15.622 1.00 . A A . 8 LEU HB3 1 1 3 759 1 1 8 LEU HD11 H -8.023 -0.999 18.416 1.00 . A A . 8 LEU HD11 1 1 3 760 1 1 8 LEU HD12 H -8.890 0.278 19.303 1.00 . A A . 8 LEU HD12 1 1 3 761 1 1 8 LEU HD13 H -9.803 -0.970 18.420 1.00 . A A . 8 LEU HD13 1 1 3 762 1 1 8 LEU HD21 H -8.548 2.650 17.126 1.00 . A A . 8 LEU HD21 1 1 3 763 1 1 8 LEU HD22 H -10.254 2.177 16.947 1.00 . A A . 8 LEU HD22 1 1 3 764 1 1 8 LEU HD23 H -9.465 2.077 18.539 1.00 . A A . 8 LEU HD23 1 1 3 765 1 1 8 LEU HG H -9.624 0.107 16.472 1.00 . A A . 8 LEU HG 1 1 3 766 1 1 8 LEU N N -5.813 -0.751 15.239 1.00 . A A . 8 LEU N 1 1 3 767 1 1 8 LEU O O -8.577 -2.684 15.645 1.00 . A A . 8 LEU O 1 1 3 768 1 1 9 ALA C C -9.805 -0.736 12.098 1.00 . A A . 9 ALA C 1 1 3 769 1 1 9 ALA CA C -9.329 -1.756 13.135 1.00 . A A . 9 ALA CA 1 1 3 770 1 1 9 ALA CB C -10.483 -2.324 13.964 1.00 . A A . 9 ALA CB 1 1 3 771 1 1 9 ALA H H -7.946 -0.290 13.662 1.00 . A A . 9 ALA H 1 1 3 772 1 1 9 ALA HA H -8.828 -2.577 12.622 1.00 . A A . 9 ALA HA 1 1 3 773 1 1 9 ALA HB1 H -10.498 -1.845 14.943 1.00 . A A . 9 ALA HB1 1 1 3 774 1 1 9 ALA HB2 H -11.426 -2.136 13.453 1.00 . A A . 9 ALA HB2 1 1 3 775 1 1 9 ALA HB3 H -10.346 -3.398 14.088 1.00 . A A . 9 ALA HB3 1 1 3 776 1 1 9 ALA N N -8.361 -1.128 14.017 1.00 . A A . 9 ALA N 1 1 3 777 1 1 9 ALA O O -10.751 0.010 12.344 1.00 . A A . 9 ALA O 1 1 3 778 1 1 10 GLY C C -8.251 1.002 9.458 1.00 . A A . 10 GLY C 1 1 3 779 1 1 10 GLY CA C -9.467 0.178 9.885 1.00 . A A . 10 GLY CA 1 1 3 780 1 1 10 GLY H H -8.359 -1.348 10.767 1.00 . A A . 10 GLY H 1 1 3 781 1 1 10 GLY HA2 H -9.849 -0.382 9.032 1.00 . A A . 10 GLY HA2 1 1 3 782 1 1 10 GLY HA3 H -10.266 0.846 10.210 1.00 . A A . 10 GLY HA3 1 1 3 783 1 1 10 GLY N N -9.127 -0.737 10.960 1.00 . A A . 10 GLY N 1 1 3 784 1 1 10 GLY O O -8.048 1.247 8.271 1.00 . A A . 10 GLY O 1 1 3 785 1 1 11 TYR C C -5.377 1.508 9.168 1.00 . A A . 11 TYR C 1 1 3 786 1 1 11 TYR CA C -6.280 2.195 10.195 1.00 . A A . 11 TYR CA 1 1 3 787 1 1 11 TYR CB C -5.537 2.285 11.529 1.00 . A A . 11 TYR CB 1 1 3 788 1 1 11 TYR CD1 C -5.969 4.523 12.607 1.00 . A A . 11 TYR CD1 1 1 3 789 1 1 11 TYR CD2 C -7.116 2.610 13.468 1.00 . A A . 11 TYR CD2 1 1 3 790 1 1 11 TYR CE1 C -6.621 5.354 13.586 1.00 . A A . 11 TYR CE1 1 1 3 791 1 1 11 TYR CE2 C -7.767 3.441 14.446 1.00 . A A . 11 TYR CE2 1 1 3 792 1 1 11 TYR CG C -6.229 3.168 12.569 1.00 . A A . 11 TYR CG 1 1 3 793 1 1 11 TYR CZ C -7.489 4.772 14.457 1.00 . A A . 11 TYR CZ 1 1 3 794 1 1 11 TYR H H -7.644 1.201 11.416 1.00 . A A . 11 TYR H 1 1 3 795 1 1 11 TYR HA H -6.595 3.162 9.801 1.00 . A A . 11 TYR HA 1 1 3 796 1 1 11 TYR HB2 H -5.424 1.280 11.939 1.00 . A A . 11 TYR HB2 1 1 3 797 1 1 11 TYR HB3 H -4.534 2.671 11.350 1.00 . A A . 11 TYR HB3 1 1 3 798 1 1 11 TYR HD1 H -5.269 4.962 11.897 1.00 . A A . 11 TYR HD1 1 1 3 799 1 1 11 TYR HD2 H -7.322 1.540 13.437 1.00 . A A . 11 TYR HD2 1 1 3 800 1 1 11 TYR HE1 H -6.424 6.425 13.627 1.00 . A A . 11 TYR HE1 1 1 3 801 1 1 11 TYR HE2 H -8.469 3.013 15.162 1.00 . A A . 11 TYR HE2 1 1 3 802 1 1 11 TYR HH H -9.082 5.355 15.404 1.00 . A A . 11 TYR HH 1 1 3 803 1 1 11 TYR N N -7.472 1.405 10.452 1.00 . A A . 11 TYR N 1 1 3 804 1 1 11 TYR O O -5.447 0.293 8.990 1.00 . A A . 11 TYR O 1 1 3 805 1 1 11 TYR OH O -8.103 5.557 15.381 1.00 . A A . 11 TYR OH 1 1 3 806 1 1 12 MET C C -2.193 1.831 8.019 1.00 . A A . 12 MET C 1 1 3 807 1 1 12 MET CA C -3.637 1.801 7.514 1.00 . A A . 12 MET CA 1 1 3 808 1 1 12 MET CB C -3.750 2.641 6.241 1.00 . A A . 12 MET CB 1 1 3 809 1 1 12 MET CE C -2.730 6.481 5.715 1.00 . A A . 12 MET CE 1 1 3 810 1 1 12 MET CG C -3.836 4.132 6.575 1.00 . A A . 12 MET CG 1 1 3 811 1 1 12 MET H H -4.502 3.303 8.669 1.00 . A A . 12 MET H 1 1 3 812 1 1 12 MET HA H -3.945 0.770 7.337 1.00 . A A . 12 MET HA 1 1 3 813 1 1 12 MET HB2 H -2.886 2.458 5.602 1.00 . A A . 12 MET HB2 1 1 3 814 1 1 12 MET HB3 H -4.633 2.340 5.678 1.00 . A A . 12 MET HB3 1 1 3 815 1 1 12 MET HE1 H -2.009 6.122 6.450 1.00 . A A . 12 MET HE1 1 1 3 816 1 1 12 MET HE2 H -2.202 6.965 4.894 1.00 . A A . 12 MET HE2 1 1 3 817 1 1 12 MET HE3 H -3.404 7.196 6.186 1.00 . A A . 12 MET HE3 1 1 3 818 1 1 12 MET HG2 H -4.789 4.350 7.057 1.00 . A A . 12 MET HG2 1 1 3 819 1 1 12 MET HG3 H -3.052 4.401 7.282 1.00 . A A . 12 MET HG3 1 1 3 820 1 1 12 MET N N -4.552 2.315 8.518 1.00 . A A . 12 MET N 1 1 3 821 1 1 12 MET O O -1.870 2.582 8.938 1.00 . A A . 12 MET O 1 1 3 822 1 1 12 MET SD S -3.673 5.102 5.085 1.00 . A A . 12 MET SD 1 1 3 823 1 1 13 ARG C C 0.885 1.799 6.847 1.00 . A A . 13 ARG C 1 1 3 824 1 1 13 ARG CA C 0.037 0.928 7.775 1.00 . A A . 13 ARG CA 1 1 3 825 1 1 13 ARG CB C 0.545 -0.514 7.714 1.00 . A A . 13 ARG CB 1 1 3 826 1 1 13 ARG CD C 2.547 -1.706 8.680 1.00 . A A . 13 ARG CD 1 1 3 827 1 1 13 ARG CG C 1.293 -0.887 8.995 1.00 . A A . 13 ARG CG 1 1 3 828 1 1 13 ARG CZ C 4.357 -2.772 10.020 1.00 . A A . 13 ARG CZ 1 1 3 829 1 1 13 ARG H H -1.635 0.398 6.651 1.00 . A A . 13 ARG H 1 1 3 830 1 1 13 ARG HA H 0.071 1.297 8.800 1.00 . A A . 13 ARG HA 1 1 3 831 1 1 13 ARG HB2 H -0.295 -1.194 7.569 1.00 . A A . 13 ARG HB2 1 1 3 832 1 1 13 ARG HB3 H 1.205 -0.635 6.855 1.00 . A A . 13 ARG HB3 1 1 3 833 1 1 13 ARG HD2 H 2.295 -2.527 8.009 1.00 . A A . 13 ARG HD2 1 1 3 834 1 1 13 ARG HD3 H 3.277 -1.084 8.163 1.00 . A A . 13 ARG HD3 1 1 3 835 1 1 13 ARG HE H 2.577 -2.196 10.762 1.00 . A A . 13 ARG HE 1 1 3 836 1 1 13 ARG HG2 H 1.573 0.019 9.534 1.00 . A A . 13 ARG HG2 1 1 3 837 1 1 13 ARG HG3 H 0.637 -1.458 9.652 1.00 . A A . 13 ARG HG3 1 1 3 838 1 1 13 ARG HH11 H 4.801 -2.506 8.053 1.00 . A A . 13 ARG HH11 1 1 3 839 1 1 13 ARG HH12 H 6.050 -3.246 8.997 1.00 . A A . 13 ARG HH12 1 1 3 840 1 1 13 ARG HH21 H 4.225 -3.172 12.009 1.00 . A A . 13 ARG HH21 1 1 3 841 1 1 13 ARG HH22 H 5.720 -3.628 11.263 1.00 . A A . 13 ARG HH22 1 1 3 842 1 1 13 ARG N N -1.364 1.005 7.398 1.00 . A A . 13 ARG N 1 1 3 843 1 1 13 ARG NE N 3.132 -2.238 9.931 1.00 . A A . 13 ARG NE 1 1 3 844 1 1 13 ARG NH1 N 5.135 -2.848 8.931 1.00 . A A . 13 ARG NH1 1 1 3 845 1 1 13 ARG NH2 N 4.806 -3.229 11.197 1.00 . A A . 13 ARG NH2 1 1 3 846 1 1 13 ARG O O 1.124 1.437 5.696 1.00 . A A . 13 ARG O 1 1 3 847 1 1 14 THR C C 3.427 3.179 6.162 1.00 . A A . 14 THR C 1 1 3 848 1 1 14 THR CA C 2.134 3.858 6.616 1.00 . A A . 14 THR CA 1 1 3 849 1 1 14 THR CB C 2.370 5.102 7.476 1.00 . A A . 14 THR CB 1 1 3 850 1 1 14 THR CG2 C 1.103 5.942 7.652 1.00 . A A . 14 THR CG2 1 1 3 851 1 1 14 THR H H 1.119 3.218 8.320 1.00 . A A . 14 THR H 1 1 3 852 1 1 14 THR HA H 1.585 4.136 5.716 1.00 . A A . 14 THR HA 1 1 3 853 1 1 14 THR HB H 3.183 5.705 7.073 1.00 . A A . 14 THR HB 1 1 3 854 1 1 14 THR HG1 H 3.572 4.764 9.039 1.00 . A A . 14 THR HG1 1 1 3 855 1 1 14 THR HG21 H 0.446 5.793 6.794 1.00 . A A . 14 THR HG21 1 1 3 856 1 1 14 THR HG22 H 0.587 5.635 8.561 1.00 . A A . 14 THR HG22 1 1 3 857 1 1 14 THR HG23 H 1.373 6.995 7.725 1.00 . A A . 14 THR HG23 1 1 3 858 1 1 14 THR N N 1.317 2.931 7.382 1.00 . A A . 14 THR N 1 1 3 859 1 1 14 THR O O 3.561 1.961 6.261 1.00 . A A . 14 THR O 1 1 3 860 1 1 14 THR OG1 O 2.624 4.582 8.778 1.00 . A A . 14 THR OG1 1 1 3 861 1 1 15 ALA C C 6.549 3.260 6.399 1.00 . A A . 15 ALA C 1 1 3 862 1 1 15 ALA CA C 5.624 3.491 5.201 1.00 . A A . 15 ALA CA 1 1 3 863 1 1 15 ALA CB C 6.220 4.470 4.186 1.00 . A A . 15 ALA CB 1 1 3 864 1 1 15 ALA H H 4.230 4.988 5.594 1.00 . A A . 15 ALA H 1 1 3 865 1 1 15 ALA HA H 5.442 2.539 4.705 1.00 . A A . 15 ALA HA 1 1 3 866 1 1 15 ALA HB1 H 6.168 5.483 4.585 1.00 . A A . 15 ALA HB1 1 1 3 867 1 1 15 ALA HB2 H 7.260 4.208 3.995 1.00 . A A . 15 ALA HB2 1 1 3 868 1 1 15 ALA HB3 H 5.654 4.417 3.256 1.00 . A A . 15 ALA HB3 1 1 3 869 1 1 15 ALA N N 4.347 3.998 5.672 1.00 . A A . 15 ALA N 1 1 3 870 1 1 15 ALA O O 7.683 2.813 6.235 1.00 . A A . 15 ALA O 1 1 3 871 1 1 16 ASP C C 6.050 2.449 9.733 1.00 . A A . 16 ASP C 1 1 3 872 1 1 16 ASP CA C 6.794 3.407 8.800 1.00 . A A . 16 ASP CA 1 1 3 873 1 1 16 ASP CB C 6.964 4.741 9.530 1.00 . A A . 16 ASP CB 1 1 3 874 1 1 16 ASP CG C 8.356 4.983 10.119 1.00 . A A . 16 ASP CG 1 1 3 875 1 1 16 ASP H H 5.106 3.938 7.701 1.00 . A A . 16 ASP H 1 1 3 876 1 1 16 ASP HA H 7.760 3.015 8.483 1.00 . A A . 16 ASP HA 1 1 3 877 1 1 16 ASP HB2 H 6.734 5.550 8.837 1.00 . A A . 16 ASP HB2 1 1 3 878 1 1 16 ASP HB3 H 6.232 4.794 10.335 1.00 . A A . 16 ASP HB3 1 1 3 879 1 1 16 ASP N N 6.030 3.575 7.576 1.00 . A A . 16 ASP N 1 1 3 880 1 1 16 ASP O O 6.558 2.093 10.796 1.00 . A A . 16 ASP O 1 1 3 881 1 1 16 ASP OD1 O 8.566 4.553 11.274 1.00 . A A . 16 ASP OD1 1 1 3 882 1 1 16 ASP OD2 O 9.178 5.592 9.401 1.00 . A A . 16 ASP OD2 1 1 3 883 1 1 17 GLY C C 2.995 1.916 10.900 1.00 . A A . 17 GLY C 1 1 3 884 1 1 17 GLY CA C 4.041 1.150 10.087 1.00 . A A . 17 GLY CA 1 1 3 885 1 1 17 GLY H H 4.455 2.354 8.438 1.00 . A A . 17 GLY H 1 1 3 886 1 1 17 GLY HA2 H 3.544 0.440 9.425 1.00 . A A . 17 GLY HA2 1 1 3 887 1 1 17 GLY HA3 H 4.675 0.570 10.757 1.00 . A A . 17 GLY HA3 1 1 3 888 1 1 17 GLY N N 4.860 2.059 9.303 1.00 . A A . 17 GLY N 1 1 3 889 1 1 17 GLY O O 2.036 1.326 11.395 1.00 . A A . 17 GLY O 1 1 3 890 1 1 18 ARG C C 0.862 3.817 11.315 1.00 . A A . 18 ARG C 1 1 3 891 1 1 18 ARG CA C 2.305 4.069 11.757 1.00 . A A . 18 ARG CA 1 1 3 892 1 1 18 ARG CB C 2.642 5.548 11.554 1.00 . A A . 18 ARG CB 1 1 3 893 1 1 18 ARG CD C 4.364 6.983 12.708 1.00 . A A . 18 ARG CD 1 1 3 894 1 1 18 ARG CG C 4.136 5.803 11.761 1.00 . A A . 18 ARG CG 1 1 3 895 1 1 18 ARG CZ C 6.710 6.714 13.506 1.00 . A A . 18 ARG CZ 1 1 3 896 1 1 18 ARG H H 3.999 3.689 10.607 1.00 . A A . 18 ARG H 1 1 3 897 1 1 18 ARG HA H 2.450 3.788 12.800 1.00 . A A . 18 ARG HA 1 1 3 898 1 1 18 ARG HB2 H 2.353 5.855 10.549 1.00 . A A . 18 ARG HB2 1 1 3 899 1 1 18 ARG HB3 H 2.065 6.155 12.251 1.00 . A A . 18 ARG HB3 1 1 3 900 1 1 18 ARG HD2 H 3.779 7.842 12.379 1.00 . A A . 18 ARG HD2 1 1 3 901 1 1 18 ARG HD3 H 4.021 6.728 13.710 1.00 . A A . 18 ARG HD3 1 1 3 902 1 1 18 ARG HE H 6.115 8.082 12.155 1.00 . A A . 18 ARG HE 1 1 3 903 1 1 18 ARG HG2 H 4.608 4.909 12.169 1.00 . A A . 18 ARG HG2 1 1 3 904 1 1 18 ARG HG3 H 4.611 6.004 10.801 1.00 . A A . 18 ARG HG3 1 1 3 905 1 1 18 ARG HH11 H 5.378 5.419 14.333 1.00 . A A . 18 ARG HH11 1 1 3 906 1 1 18 ARG HH12 H 7.012 5.244 14.878 1.00 . A A . 18 ARG HH12 1 1 3 907 1 1 18 ARG HH21 H 8.272 7.852 12.874 1.00 . A A . 18 ARG HH21 1 1 3 908 1 1 18 ARG HH22 H 8.670 6.637 14.043 1.00 . A A . 18 ARG HH22 1 1 3 909 1 1 18 ARG N N 3.216 3.217 11.012 1.00 . A A . 18 ARG N 1 1 3 910 1 1 18 ARG NE N 5.802 7.335 12.741 1.00 . A A . 18 ARG NE 1 1 3 911 1 1 18 ARG NH1 N 6.335 5.707 14.307 1.00 . A A . 18 ARG NH1 1 1 3 912 1 1 18 ARG NH2 N 7.992 7.100 13.471 1.00 . A A . 18 ARG NH2 1 1 3 913 1 1 18 ARG O O 0.479 4.170 10.201 1.00 . A A . 18 ARG O 1 1 3 914 1 1 19 CYS C C -2.034 4.222 11.692 1.00 . A A . 19 CYS C 1 1 3 915 1 1 19 CYS CA C -1.293 2.905 11.928 1.00 . A A . 19 CYS CA 1 1 3 916 1 1 19 CYS CB C -1.933 2.082 13.050 1.00 . A A . 19 CYS CB 1 1 3 917 1 1 19 CYS H H 0.418 2.925 13.117 1.00 . A A . 19 CYS H 1 1 3 918 1 1 19 CYS HA H -1.302 2.289 11.029 1.00 . A A . 19 CYS HA 1 1 3 919 1 1 19 CYS HB2 H -1.790 2.608 13.993 1.00 . A A . 19 CYS HB2 1 1 3 920 1 1 19 CYS HB3 H -3.007 2.028 12.873 1.00 . A A . 19 CYS HB3 1 1 3 921 1 1 19 CYS N N 0.099 3.208 12.212 1.00 . A A . 19 CYS N 1 1 3 922 1 1 19 CYS O O -2.559 4.820 12.632 1.00 . A A . 19 CYS O 1 1 3 923 1 1 19 CYS SG S -1.280 0.381 13.222 1.00 . A A . 19 CYS SG 1 1 3 924 1 1 20 LYS C C -4.213 5.598 9.852 1.00 . A A . 20 LYS C 1 1 3 925 1 1 20 LYS CA C -2.723 5.873 10.064 1.00 . A A . 20 LYS CA 1 1 3 926 1 1 20 LYS CB C -2.036 6.511 8.855 1.00 . A A . 20 LYS CB 1 1 3 927 1 1 20 LYS CD C -1.133 8.776 8.212 1.00 . A A . 20 LYS CD 1 1 3 928 1 1 20 LYS CE C -0.145 9.886 8.577 1.00 . A A . 20 LYS CE 1 1 3 929 1 1 20 LYS CG C -1.151 7.683 9.282 1.00 . A A . 20 LYS CG 1 1 3 930 1 1 20 LYS H H -1.625 4.145 9.677 1.00 . A A . 20 LYS H 1 1 3 931 1 1 20 LYS HA H -2.614 6.566 10.899 1.00 . A A . 20 LYS HA 1 1 3 932 1 1 20 LYS HB2 H -1.434 5.765 8.337 1.00 . A A . 20 LYS HB2 1 1 3 933 1 1 20 LYS HB3 H -2.789 6.859 8.147 1.00 . A A . 20 LYS HB3 1 1 3 934 1 1 20 LYS HD2 H -0.860 8.344 7.249 1.00 . A A . 20 LYS HD2 1 1 3 935 1 1 20 LYS HD3 H -2.132 9.197 8.100 1.00 . A A . 20 LYS HD3 1 1 3 936 1 1 20 LYS HE2 H -0.630 10.612 9.230 1.00 . A A . 20 LYS HE2 1 1 3 937 1 1 20 LYS HE3 H 0.693 9.466 9.134 1.00 . A A . 20 LYS HE3 1 1 3 938 1 1 20 LYS HG2 H -1.516 8.096 10.223 1.00 . A A . 20 LYS HG2 1 1 3 939 1 1 20 LYS HG3 H -0.135 7.330 9.463 1.00 . A A . 20 LYS HG3 1 1 3 940 1 1 20 LYS HZ1 H 0.108 10.017 6.553 1.00 . A A . 20 LYS HZ1 1 1 3 941 1 1 20 LYS HZ2 H -0.064 11.467 7.285 1.00 . A A . 20 LYS HZ2 1 1 3 942 1 1 20 LYS HZ3 H 1.346 10.652 7.408 1.00 . A A . 20 LYS HZ3 1 1 3 943 1 1 20 LYS N N -2.054 4.637 10.435 1.00 . A A . 20 LYS N 1 1 3 944 1 1 20 LYS NZ N 0.351 10.560 7.357 1.00 . A A . 20 LYS NZ 1 1 3 945 1 1 20 LYS O O -4.631 4.444 9.784 1.00 . A A . 20 LYS O 1 1 3 946 1 1 21 PRO C C -6.747 6.199 8.107 1.00 . A A . 21 PRO C 1 1 3 947 1 1 21 PRO CA C -6.427 6.598 9.549 1.00 . A A . 21 PRO CA 1 1 3 948 1 1 21 PRO CB C -6.983 7.962 9.925 1.00 . A A . 21 PRO CB 1 1 3 949 1 1 21 PRO CD C -4.531 8.091 9.827 1.00 . A A . 21 PRO CD 1 1 3 950 1 1 21 PRO CG C -5.803 8.921 9.878 1.00 . A A . 21 PRO CG 1 1 3 951 1 1 21 PRO HA H -6.804 5.873 10.123 1.00 . A A . 21 PRO HA 1 1 3 952 1 1 21 PRO HB2 H -7.764 8.270 9.231 1.00 . A A . 21 PRO HB2 1 1 3 953 1 1 21 PRO HB3 H -7.429 7.941 10.919 1.00 . A A . 21 PRO HB3 1 1 3 954 1 1 21 PRO HD2 H -3.921 8.353 8.962 1.00 . A A . 21 PRO HD2 1 1 3 955 1 1 21 PRO HD3 H -3.915 8.255 10.712 1.00 . A A . 21 PRO HD3 1 1 3 956 1 1 21 PRO HG2 H -5.873 9.568 9.004 1.00 . A A . 21 PRO HG2 1 1 3 957 1 1 21 PRO HG3 H -5.803 9.568 10.755 1.00 . A A . 21 PRO HG3 1 1 3 958 1 1 21 PRO N N -4.992 6.708 9.751 1.00 . A A . 21 PRO N 1 1 3 959 1 1 21 PRO O O -6.060 6.616 7.176 1.00 . A A . 21 PRO O 1 1 3 960 1 1 22 THR C C -9.551 5.572 6.270 1.00 . A A . 22 THR C 1 1 3 961 1 1 22 THR CA C -8.213 4.937 6.654 1.00 . A A . 22 THR CA 1 1 3 962 1 1 22 THR CB C -8.252 3.407 6.679 1.00 . A A . 22 THR CB 1 1 3 963 1 1 22 THR CG2 C -8.352 2.801 5.279 1.00 . A A . 22 THR CG2 1 1 3 964 1 1 22 THR H H -8.347 5.062 8.729 1.00 . A A . 22 THR H 1 1 3 965 1 1 22 THR HA H -7.479 5.270 5.922 1.00 . A A . 22 THR HA 1 1 3 966 1 1 22 THR HB H -9.059 3.049 7.318 1.00 . A A . 22 THR HB 1 1 3 967 1 1 22 THR HG1 H -6.280 3.199 6.403 1.00 . A A . 22 THR HG1 1 1 3 968 1 1 22 THR HG21 H -9.244 3.182 4.781 1.00 . A A . 22 THR HG21 1 1 3 969 1 1 22 THR HG22 H -7.469 3.074 4.700 1.00 . A A . 22 THR HG22 1 1 3 970 1 1 22 THR HG23 H -8.415 1.716 5.356 1.00 . A A . 22 THR HG23 1 1 3 971 1 1 22 THR N N -7.793 5.397 7.968 1.00 . A A . 22 THR N 1 1 3 972 1 1 22 THR O O -10.153 5.199 5.264 1.00 . A A . 22 THR O 1 1 3 973 1 1 22 THR OG1 O -6.951 3.035 7.126 1.00 . A A . 22 THR OG1 1 1 3 974 1 1 23 PHE C C -10.988 8.597 6.249 1.00 . A A . 23 PHE C 1 1 3 975 1 1 23 PHE CA C -11.232 7.212 6.849 1.00 . A A . 23 PHE CA 1 1 3 976 1 1 23 PHE CB C -11.923 7.370 8.206 1.00 . A A . 23 PHE CB 1 1 3 977 1 1 23 PHE CD1 C -10.615 9.283 9.158 1.00 . A A . 23 PHE CD1 1 1 3 978 1 1 23 PHE CD2 C -10.674 7.266 10.373 1.00 . A A . 23 PHE CD2 1 1 3 979 1 1 23 PHE CE1 C -9.794 9.864 10.159 1.00 . A A . 23 PHE CE1 1 1 3 980 1 1 23 PHE CE2 C -9.852 7.847 11.376 1.00 . A A . 23 PHE CE2 1 1 3 981 1 1 23 PHE CG C -11.038 7.996 9.286 1.00 . A A . 23 PHE CG 1 1 3 982 1 1 23 PHE CZ C -9.429 9.133 11.248 1.00 . A A . 23 PHE CZ 1 1 3 983 1 1 23 PHE H H -9.481 6.819 7.907 1.00 . A A . 23 PHE H 1 1 3 984 1 1 23 PHE HA H -11.802 6.607 6.145 1.00 . A A . 23 PHE HA 1 1 3 985 1 1 23 PHE HB2 H -12.813 7.987 8.078 1.00 . A A . 23 PHE HB2 1 1 3 986 1 1 23 PHE HB3 H -12.259 6.392 8.547 1.00 . A A . 23 PHE HB3 1 1 3 987 1 1 23 PHE HD1 H -10.907 9.868 8.285 1.00 . A A . 23 PHE HD1 1 1 3 988 1 1 23 PHE HD2 H -11.012 6.235 10.476 1.00 . A A . 23 PHE HD2 1 1 3 989 1 1 23 PHE HE1 H -9.455 10.894 10.057 1.00 . A A . 23 PHE HE1 1 1 3 990 1 1 23 PHE HE2 H -9.560 7.261 12.247 1.00 . A A . 23 PHE HE2 1 1 3 991 1 1 23 PHE HZ H -8.799 9.579 12.017 1.00 . A A . 23 PHE HZ 1 1 3 992 1 1 23 PHE N N -9.977 6.521 7.091 1.00 . A A . 23 PHE N 1 1 3 993 1 1 23 PHE O O -11.523 8.922 5.190 1.00 . A A . 23 PHE O 1 1 4 994 1 1 1 GLU C C -4.091 -7.158 17.799 1.00 . A A . 1 GLU C 1 1 4 995 1 1 1 GLU CA C -4.727 -7.653 19.100 1.00 . A A . 1 GLU CA 1 1 4 996 1 1 1 GLU CB C -6.159 -8.137 18.861 1.00 . A A . 1 GLU CB 1 1 4 997 1 1 1 GLU CD C -6.973 -9.391 20.891 1.00 . A A . 1 GLU CD 1 1 4 998 1 1 1 GLU CG C -6.383 -9.515 19.485 1.00 . A A . 1 GLU CG 1 1 4 999 1 1 1 GLU HA H -4.138 -8.472 19.512 1.00 . A A . 1 GLU HA 1 1 4 1000 1 1 1 GLU HB2 H -6.864 -7.422 19.285 1.00 . A A . 1 GLU HB2 1 1 4 1001 1 1 1 GLU HB3 H -6.357 -8.182 17.790 1.00 . A A . 1 GLU HB3 1 1 4 1002 1 1 1 GLU HG2 H -7.055 -10.099 18.855 1.00 . A A . 1 GLU HG2 1 1 4 1003 1 1 1 GLU HG3 H -5.438 -10.057 19.529 1.00 . A A . 1 GLU HG3 1 1 4 1004 1 1 1 GLU N N -4.693 -6.607 20.108 1.00 . A A . 1 GLU N 1 1 4 1005 1 1 1 GLU O O -4.787 -6.668 16.911 1.00 . A A . 1 GLU O 1 1 4 1006 1 1 1 GLU OE1 O -8.068 -8.798 20.997 1.00 . A A . 1 GLU OE1 1 1 4 1007 1 1 1 GLU OE2 O -6.315 -9.892 21.829 1.00 . A A . 1 GLU OE2 1 1 4 1008 1 1 2 ASN C C -1.956 -8.039 15.559 1.00 . A A . 2 ASN C 1 1 4 1009 1 1 2 ASN CA C -2.038 -6.878 16.551 1.00 . A A . 2 ASN CA 1 1 4 1010 1 1 2 ASN CB C -0.612 -6.464 16.914 1.00 . A A . 2 ASN CB 1 1 4 1011 1 1 2 ASN CG C -0.612 -5.413 18.027 1.00 . A A . 2 ASN CG 1 1 4 1012 1 1 2 ASN H H -2.218 -7.701 18.456 1.00 . A A . 2 ASN H 1 1 4 1013 1 1 2 ASN HA H -2.596 -6.029 16.154 1.00 . A A . 2 ASN HA 1 1 4 1014 1 1 2 ASN HB2 H -0.046 -7.339 17.235 1.00 . A A . 2 ASN HB2 1 1 4 1015 1 1 2 ASN HB3 H -0.108 -6.066 16.033 1.00 . A A . 2 ASN HB3 1 1 4 1016 1 1 2 ASN HD21 H 1.125 -6.201 18.706 1.00 . A A . 2 ASN HD21 1 1 4 1017 1 1 2 ASN HD22 H 0.521 -4.851 19.608 1.00 . A A . 2 ASN HD22 1 1 4 1018 1 1 2 ASN N N -2.776 -7.302 17.729 1.00 . A A . 2 ASN N 1 1 4 1019 1 1 2 ASN ND2 N 0.431 -5.495 18.848 1.00 . A A . 2 ASN ND2 1 1 4 1020 1 1 2 ASN O O -1.757 -9.187 15.957 1.00 . A A . 2 ASN O 1 1 4 1021 1 1 2 ASN OD1 O -1.498 -4.583 18.131 1.00 . A A . 2 ASN OD1 1 1 4 1022 1 1 3 PHE C C -1.350 -8.157 11.995 1.00 . A A . 3 PHE C 1 1 4 1023 1 1 3 PHE CA C -2.060 -8.703 13.236 1.00 . A A . 3 PHE CA 1 1 4 1024 1 1 3 PHE CB C -3.505 -9.048 12.872 1.00 . A A . 3 PHE CB 1 1 4 1025 1 1 3 PHE CD1 C -3.337 -10.677 10.976 1.00 . A A . 3 PHE CD1 1 1 4 1026 1 1 3 PHE CD2 C -4.177 -11.455 13.034 1.00 . A A . 3 PHE CD2 1 1 4 1027 1 1 3 PHE CE1 C -3.498 -11.972 10.419 1.00 . A A . 3 PHE CE1 1 1 4 1028 1 1 3 PHE CE2 C -4.339 -12.751 12.477 1.00 . A A . 3 PHE CE2 1 1 4 1029 1 1 3 PHE CG C -3.679 -10.445 12.271 1.00 . A A . 3 PHE CG 1 1 4 1030 1 1 3 PHE CZ C -3.996 -12.983 11.182 1.00 . A A . 3 PHE CZ 1 1 4 1031 1 1 3 PHE H H -2.275 -6.767 13.972 1.00 . A A . 3 PHE H 1 1 4 1032 1 1 3 PHE HA H -1.500 -9.554 13.627 1.00 . A A . 3 PHE HA 1 1 4 1033 1 1 3 PHE HB2 H -4.123 -8.968 13.765 1.00 . A A . 3 PHE HB2 1 1 4 1034 1 1 3 PHE HB3 H -3.875 -8.310 12.160 1.00 . A A . 3 PHE HB3 1 1 4 1035 1 1 3 PHE HD1 H -2.938 -9.866 10.365 1.00 . A A . 3 PHE HD1 1 1 4 1036 1 1 3 PHE HD2 H -4.452 -11.270 14.072 1.00 . A A . 3 PHE HD2 1 1 4 1037 1 1 3 PHE HE1 H -3.224 -12.158 9.380 1.00 . A A . 3 PHE HE1 1 1 4 1038 1 1 3 PHE HE2 H -4.737 -13.561 13.089 1.00 . A A . 3 PHE HE2 1 1 4 1039 1 1 3 PHE HZ H -4.120 -13.978 10.754 1.00 . A A . 3 PHE HZ 1 1 4 1040 1 1 3 PHE N N -2.113 -7.702 14.287 1.00 . A A . 3 PHE N 1 1 4 1041 1 1 3 PHE O O -0.422 -8.782 11.480 1.00 . A A . 3 PHE O 1 1 4 1042 1 1 4 ASN C C -0.434 -5.131 10.816 1.00 . A A . 4 ASN C 1 1 4 1043 1 1 4 ASN CA C -1.233 -6.362 10.379 1.00 . A A . 4 ASN CA 1 1 4 1044 1 1 4 ASN CB C -2.320 -5.899 9.409 1.00 . A A . 4 ASN CB 1 1 4 1045 1 1 4 ASN CG C -3.517 -5.317 10.164 1.00 . A A . 4 ASN CG 1 1 4 1046 1 1 4 ASN H H -2.565 -6.497 11.974 1.00 . A A . 4 ASN H 1 1 4 1047 1 1 4 ASN HA H -0.604 -7.125 9.920 1.00 . A A . 4 ASN HA 1 1 4 1048 1 1 4 ASN HB2 H -1.914 -5.149 8.731 1.00 . A A . 4 ASN HB2 1 1 4 1049 1 1 4 ASN HB3 H -2.647 -6.740 8.796 1.00 . A A . 4 ASN HB3 1 1 4 1050 1 1 4 ASN HD21 H -3.006 -3.487 9.467 1.00 . A A . 4 ASN HD21 1 1 4 1051 1 1 4 ASN HD22 H -4.409 -3.528 10.482 1.00 . A A . 4 ASN HD22 1 1 4 1052 1 1 4 ASN N N -1.812 -6.998 11.550 1.00 . A A . 4 ASN N 1 1 4 1053 1 1 4 ASN ND2 N -3.656 -4.002 10.026 1.00 . A A . 4 ASN ND2 1 1 4 1054 1 1 4 ASN O O -0.676 -4.027 10.332 1.00 . A A . 4 ASN O 1 1 4 1055 1 1 4 ASN OD1 O -4.265 -6.016 10.827 1.00 . A A . 4 ASN OD1 1 1 4 1056 1 1 5 GLY C C 0.979 -3.956 13.684 1.00 . A A . 5 GLY C 1 1 4 1057 1 1 5 GLY CA C 1.335 -4.288 12.234 1.00 . A A . 5 GLY CA 1 1 4 1058 1 1 5 GLY H H 0.689 -6.266 12.116 1.00 . A A . 5 GLY H 1 1 4 1059 1 1 5 GLY HA2 H 2.383 -4.576 12.170 1.00 . A A . 5 GLY HA2 1 1 4 1060 1 1 5 GLY HA3 H 1.209 -3.401 11.613 1.00 . A A . 5 GLY HA3 1 1 4 1061 1 1 5 GLY N N 0.499 -5.364 11.727 1.00 . A A . 5 GLY N 1 1 4 1062 1 1 5 GLY O O 1.863 -3.699 14.500 1.00 . A A . 5 GLY O 1 1 4 1063 1 1 6 GLY C C -1.688 -2.431 15.298 1.00 . A A . 6 GLY C 1 1 4 1064 1 1 6 GLY CA C -0.799 -3.676 15.300 1.00 . A A . 6 GLY CA 1 1 4 1065 1 1 6 GLY H H -1.029 -4.183 13.292 1.00 . A A . 6 GLY H 1 1 4 1066 1 1 6 GLY HA2 H -1.360 -4.528 15.684 1.00 . A A . 6 GLY HA2 1 1 4 1067 1 1 6 GLY HA3 H 0.047 -3.523 15.970 1.00 . A A . 6 GLY HA3 1 1 4 1068 1 1 6 GLY N N -0.316 -3.973 13.962 1.00 . A A . 6 GLY N 1 1 4 1069 1 1 6 GLY O O -1.402 -1.458 15.995 1.00 . A A . 6 GLY O 1 1 4 1070 1 1 7 CYS C C -4.915 -1.722 15.252 1.00 . A A . 7 CYS C 1 1 4 1071 1 1 7 CYS CA C -3.683 -1.392 14.407 1.00 . A A . 7 CYS CA 1 1 4 1072 1 1 7 CYS CB C -4.051 -1.093 12.952 1.00 . A A . 7 CYS CB 1 1 4 1073 1 1 7 CYS H H -2.976 -3.297 13.945 1.00 . A A . 7 CYS H 1 1 4 1074 1 1 7 CYS HA H -3.168 -0.514 14.798 1.00 . A A . 7 CYS HA 1 1 4 1075 1 1 7 CYS HB2 H -4.463 -1.998 12.504 1.00 . A A . 7 CYS HB2 1 1 4 1076 1 1 7 CYS HB3 H -4.842 -0.343 12.939 1.00 . A A . 7 CYS HB3 1 1 4 1077 1 1 7 CYS N N -2.749 -2.502 14.508 1.00 . A A . 7 CYS N 1 1 4 1078 1 1 7 CYS O O -4.992 -2.794 15.850 1.00 . A A . 7 CYS O 1 1 4 1079 1 1 7 CYS SG S -2.664 -0.503 11.915 1.00 . A A . 7 CYS SG 1 1 4 1080 1 1 8 LEU C C -8.090 -1.721 15.186 1.00 . A A . 8 LEU C 1 1 4 1081 1 1 8 LEU CA C -7.071 -0.958 16.035 1.00 . A A . 8 LEU CA 1 1 4 1082 1 1 8 LEU CB C -7.584 0.390 16.547 1.00 . A A . 8 LEU CB 1 1 4 1083 1 1 8 LEU CD1 C -8.937 -0.511 18.474 1.00 . A A . 8 LEU CD1 1 1 4 1084 1 1 8 LEU CD2 C -9.431 1.793 17.537 1.00 . A A . 8 LEU CD2 1 1 4 1085 1 1 8 LEU CG C -8.955 0.373 17.226 1.00 . A A . 8 LEU CG 1 1 4 1086 1 1 8 LEU H H -5.776 0.089 14.784 1.00 . A A . 8 LEU H 1 1 4 1087 1 1 8 LEU HA H -6.828 -1.562 16.910 1.00 . A A . 8 LEU HA 1 1 4 1088 1 1 8 LEU HB2 H -6.856 0.790 17.252 1.00 . A A . 8 LEU HB2 1 1 4 1089 1 1 8 LEU HB3 H -7.626 1.083 15.706 1.00 . A A . 8 LEU HB3 1 1 4 1090 1 1 8 LEU HD11 H -8.124 -1.234 18.395 1.00 . A A . 8 LEU HD11 1 1 4 1091 1 1 8 LEU HD12 H -8.788 0.109 19.358 1.00 . A A . 8 LEU HD12 1 1 4 1092 1 1 8 LEU HD13 H -9.887 -1.041 18.558 1.00 . A A . 8 LEU HD13 1 1 4 1093 1 1 8 LEU HD21 H -8.577 2.409 17.819 1.00 . A A . 8 LEU HD21 1 1 4 1094 1 1 8 LEU HD22 H -9.909 2.218 16.654 1.00 . A A . 8 LEU HD22 1 1 4 1095 1 1 8 LEU HD23 H -10.147 1.765 18.359 1.00 . A A . 8 LEU HD23 1 1 4 1096 1 1 8 LEU HG H -9.674 -0.064 16.533 1.00 . A A . 8 LEU HG 1 1 4 1097 1 1 8 LEU N N -5.846 -0.781 15.274 1.00 . A A . 8 LEU N 1 1 4 1098 1 1 8 LEU O O -8.591 -2.765 15.600 1.00 . A A . 8 LEU O 1 1 4 1099 1 1 9 ALA C C -9.773 -0.750 12.073 1.00 . A A . 9 ALA C 1 1 4 1100 1 1 9 ALA CA C -9.313 -1.787 13.101 1.00 . A A . 9 ALA CA 1 1 4 1101 1 1 9 ALA CB C -10.479 -2.374 13.898 1.00 . A A . 9 ALA CB 1 1 4 1102 1 1 9 ALA H H -7.952 -0.321 13.683 1.00 . A A . 9 ALA H 1 1 4 1103 1 1 9 ALA HA H -8.799 -2.596 12.584 1.00 . A A . 9 ALA HA 1 1 4 1104 1 1 9 ALA HB1 H -10.508 -1.919 14.888 1.00 . A A . 9 ALA HB1 1 1 4 1105 1 1 9 ALA HB2 H -11.415 -2.170 13.377 1.00 . A A . 9 ALA HB2 1 1 4 1106 1 1 9 ALA HB3 H -10.346 -3.451 13.996 1.00 . A A . 9 ALA HB3 1 1 4 1107 1 1 9 ALA N N -8.364 -1.170 14.013 1.00 . A A . 9 ALA N 1 1 4 1108 1 1 9 ALA O O -10.652 0.062 12.356 1.00 . A A . 9 ALA O 1 1 4 1109 1 1 10 GLY C C -8.277 0.947 9.428 1.00 . A A . 10 GLY C 1 1 4 1110 1 1 10 GLY CA C -9.493 0.110 9.830 1.00 . A A . 10 GLY CA 1 1 4 1111 1 1 10 GLY H H -8.443 -1.476 10.679 1.00 . A A . 10 GLY H 1 1 4 1112 1 1 10 GLY HA2 H -9.858 -0.446 8.967 1.00 . A A . 10 GLY HA2 1 1 4 1113 1 1 10 GLY HA3 H -10.301 0.768 10.151 1.00 . A A . 10 GLY HA3 1 1 4 1114 1 1 10 GLY N N -9.158 -0.812 10.901 1.00 . A A . 10 GLY N 1 1 4 1115 1 1 10 GLY O O -8.063 1.208 8.244 1.00 . A A . 10 GLY O 1 1 4 1116 1 1 11 TYR C C -5.378 1.451 9.217 1.00 . A A . 11 TYR C 1 1 4 1117 1 1 11 TYR CA C -6.324 2.147 10.199 1.00 . A A . 11 TYR CA 1 1 4 1118 1 1 11 TYR CB C -5.626 2.275 11.555 1.00 . A A . 11 TYR CB 1 1 4 1119 1 1 11 TYR CD1 C -6.364 4.518 12.440 1.00 . A A . 11 TYR CD1 1 1 4 1120 1 1 11 TYR CD2 C -7.081 2.552 13.595 1.00 . A A . 11 TYR CD2 1 1 4 1121 1 1 11 TYR CE1 C -7.074 5.335 13.389 1.00 . A A . 11 TYR CE1 1 1 4 1122 1 1 11 TYR CE2 C -7.793 3.369 14.544 1.00 . A A . 11 TYR CE2 1 1 4 1123 1 1 11 TYR CG C -6.382 3.144 12.563 1.00 . A A . 11 TYR CG 1 1 4 1124 1 1 11 TYR CZ C -7.754 4.720 14.394 1.00 . A A . 11 TYR CZ 1 1 4 1125 1 1 11 TYR H H -7.693 1.128 11.393 1.00 . A A . 11 TYR H 1 1 4 1126 1 1 11 TYR HA H -6.639 3.100 9.775 1.00 . A A . 11 TYR HA 1 1 4 1127 1 1 11 TYR HB2 H -5.491 1.279 11.978 1.00 . A A . 11 TYR HB2 1 1 4 1128 1 1 11 TYR HB3 H -4.632 2.695 11.403 1.00 . A A . 11 TYR HB3 1 1 4 1129 1 1 11 TYR HD1 H -5.810 4.985 11.625 1.00 . A A . 11 TYR HD1 1 1 4 1130 1 1 11 TYR HD2 H -7.096 1.466 13.692 1.00 . A A . 11 TYR HD2 1 1 4 1131 1 1 11 TYR HE1 H -7.068 6.421 13.303 1.00 . A A . 11 TYR HE1 1 1 4 1132 1 1 11 TYR HE2 H -8.349 2.915 15.363 1.00 . A A . 11 TYR HE2 1 1 4 1133 1 1 11 TYR HH H -9.298 5.064 15.524 1.00 . A A . 11 TYR HH 1 1 4 1134 1 1 11 TYR N N -7.512 1.344 10.434 1.00 . A A . 11 TYR N 1 1 4 1135 1 1 11 TYR O O -5.418 0.231 9.070 1.00 . A A . 11 TYR O 1 1 4 1136 1 1 11 TYR OH O -8.426 5.493 15.290 1.00 . A A . 11 TYR OH 1 1 4 1137 1 1 12 MET C C -2.162 1.881 8.120 1.00 . A A . 12 MET C 1 1 4 1138 1 1 12 MET CA C -3.596 1.737 7.607 1.00 . A A . 12 MET CA 1 1 4 1139 1 1 12 MET CB C -3.744 2.490 6.283 1.00 . A A . 12 MET CB 1 1 4 1140 1 1 12 MET CE C -3.375 6.511 5.758 1.00 . A A . 12 MET CE 1 1 4 1141 1 1 12 MET CG C -4.039 3.972 6.525 1.00 . A A . 12 MET CG 1 1 4 1142 1 1 12 MET H H -4.524 3.250 8.695 1.00 . A A . 12 MET H 1 1 4 1143 1 1 12 MET HA H -3.844 0.681 7.493 1.00 . A A . 12 MET HA 1 1 4 1144 1 1 12 MET HB2 H -2.829 2.388 5.699 1.00 . A A . 12 MET HB2 1 1 4 1145 1 1 12 MET HB3 H -4.547 2.046 5.695 1.00 . A A . 12 MET HB3 1 1 4 1146 1 1 12 MET HE1 H -3.836 6.571 6.744 1.00 . A A . 12 MET HE1 1 1 4 1147 1 1 12 MET HE2 H -2.299 6.650 5.851 1.00 . A A . 12 MET HE2 1 1 4 1148 1 1 12 MET HE3 H -3.788 7.289 5.115 1.00 . A A . 12 MET HE3 1 1 4 1149 1 1 12 MET HG2 H -5.080 4.099 6.822 1.00 . A A . 12 MET HG2 1 1 4 1150 1 1 12 MET HG3 H -3.426 4.343 7.345 1.00 . A A . 12 MET HG3 1 1 4 1151 1 1 12 MET N N -4.550 2.259 8.570 1.00 . A A . 12 MET N 1 1 4 1152 1 1 12 MET O O -1.880 2.747 8.948 1.00 . A A . 12 MET O 1 1 4 1153 1 1 12 MET SD S -3.708 4.909 5.043 1.00 . A A . 12 MET SD 1 1 4 1154 1 1 13 ARG C C 0.934 1.818 6.978 1.00 . A A . 13 ARG C 1 1 4 1155 1 1 13 ARG CA C 0.104 1.044 8.004 1.00 . A A . 13 ARG CA 1 1 4 1156 1 1 13 ARG CB C 0.661 -0.375 8.135 1.00 . A A . 13 ARG CB 1 1 4 1157 1 1 13 ARG CD C 1.966 -1.438 6.257 1.00 . A A . 13 ARG CD 1 1 4 1158 1 1 13 ARG CG C 0.572 -1.124 6.804 1.00 . A A . 13 ARG CG 1 1 4 1159 1 1 13 ARG CZ C 1.354 -2.461 4.068 1.00 . A A . 13 ARG CZ 1 1 4 1160 1 1 13 ARG H H -1.532 0.322 6.934 1.00 . A A . 13 ARG H 1 1 4 1161 1 1 13 ARG HA H 0.111 1.544 8.972 1.00 . A A . 13 ARG HA 1 1 4 1162 1 1 13 ARG HB2 H 1.700 -0.332 8.463 1.00 . A A . 13 ARG HB2 1 1 4 1163 1 1 13 ARG HB3 H 0.107 -0.918 8.900 1.00 . A A . 13 ARG HB3 1 1 4 1164 1 1 13 ARG HD2 H 2.382 -0.556 5.770 1.00 . A A . 13 ARG HD2 1 1 4 1165 1 1 13 ARG HD3 H 2.637 -1.697 7.076 1.00 . A A . 13 ARG HD3 1 1 4 1166 1 1 13 ARG HE H 2.263 -3.443 5.572 1.00 . A A . 13 ARG HE 1 1 4 1167 1 1 13 ARG HG2 H 0.014 -2.051 6.941 1.00 . A A . 13 ARG HG2 1 1 4 1168 1 1 13 ARG HG3 H 0.020 -0.524 6.081 1.00 . A A . 13 ARG HG3 1 1 4 1169 1 1 13 ARG HH11 H 0.860 -0.497 4.255 1.00 . A A . 13 ARG HH11 1 1 4 1170 1 1 13 ARG HH12 H 0.441 -1.223 2.738 1.00 . A A . 13 ARG HH12 1 1 4 1171 1 1 13 ARG HH21 H 1.711 -4.401 3.572 1.00 . A A . 13 ARG HH21 1 1 4 1172 1 1 13 ARG HH22 H 0.928 -3.458 2.348 1.00 . A A . 13 ARG HH22 1 1 4 1173 1 1 13 ARG N N -1.294 1.022 7.607 1.00 . A A . 13 ARG N 1 1 4 1174 1 1 13 ARG NE N 1.890 -2.558 5.292 1.00 . A A . 13 ARG NE 1 1 4 1175 1 1 13 ARG NH1 N 0.842 -1.295 3.652 1.00 . A A . 13 ARG NH1 1 1 4 1176 1 1 13 ARG NH2 N 1.329 -3.530 3.261 1.00 . A A . 13 ARG NH2 1 1 4 1177 1 1 13 ARG O O 1.221 1.310 5.895 1.00 . A A . 13 ARG O 1 1 4 1178 1 1 14 THR C C 3.381 3.172 6.076 1.00 . A A . 14 THR C 1 1 4 1179 1 1 14 THR CA C 2.090 3.885 6.483 1.00 . A A . 14 THR CA 1 1 4 1180 1 1 14 THR CB C 2.330 5.212 7.205 1.00 . A A . 14 THR CB 1 1 4 1181 1 1 14 THR CG2 C 1.026 5.932 7.556 1.00 . A A . 14 THR CG2 1 1 4 1182 1 1 14 THR H H 1.058 3.441 8.238 1.00 . A A . 14 THR H 1 1 4 1183 1 1 14 THR HA H 1.521 4.064 5.570 1.00 . A A . 14 THR HA 1 1 4 1184 1 1 14 THR HB H 2.988 5.857 6.624 1.00 . A A . 14 THR HB 1 1 4 1185 1 1 14 THR HG1 H 3.553 5.489 8.765 1.00 . A A . 14 THR HG1 1 1 4 1186 1 1 14 THR HG21 H 0.299 5.207 7.924 1.00 . A A . 14 THR HG21 1 1 4 1187 1 1 14 THR HG22 H 1.219 6.677 8.327 1.00 . A A . 14 THR HG22 1 1 4 1188 1 1 14 THR HG23 H 0.631 6.422 6.667 1.00 . A A . 14 THR HG23 1 1 4 1189 1 1 14 THR N N 1.296 3.035 7.356 1.00 . A A . 14 THR N 1 1 4 1190 1 1 14 THR O O 3.504 1.960 6.242 1.00 . A A . 14 THR O 1 1 4 1191 1 1 14 THR OG1 O 2.864 4.827 8.469 1.00 . A A . 14 THR OG1 1 1 4 1192 1 1 15 ALA C C 6.507 3.259 6.327 1.00 . A A . 15 ALA C 1 1 4 1193 1 1 15 ALA CA C 5.587 3.415 5.115 1.00 . A A . 15 ALA CA 1 1 4 1194 1 1 15 ALA CB C 6.188 4.322 4.039 1.00 . A A . 15 ALA CB 1 1 4 1195 1 1 15 ALA H H 4.201 4.941 5.416 1.00 . A A . 15 ALA H 1 1 4 1196 1 1 15 ALA HA H 5.401 2.432 4.682 1.00 . A A . 15 ALA HA 1 1 4 1197 1 1 15 ALA HB1 H 5.400 4.934 3.599 1.00 . A A . 15 ALA HB1 1 1 4 1198 1 1 15 ALA HB2 H 6.941 4.969 4.489 1.00 . A A . 15 ALA HB2 1 1 4 1199 1 1 15 ALA HB3 H 6.650 3.711 3.265 1.00 . A A . 15 ALA HB3 1 1 4 1200 1 1 15 ALA N N 4.310 3.955 5.549 1.00 . A A . 15 ALA N 1 1 4 1201 1 1 15 ALA O O 7.665 2.868 6.186 1.00 . A A . 15 ALA O 1 1 4 1202 1 1 16 ASP C C 6.006 2.510 9.680 1.00 . A A . 16 ASP C 1 1 4 1203 1 1 16 ASP CA C 6.716 3.474 8.727 1.00 . A A . 16 ASP CA 1 1 4 1204 1 1 16 ASP CB C 6.819 4.834 9.421 1.00 . A A . 16 ASP CB 1 1 4 1205 1 1 16 ASP CG C 7.593 4.829 10.742 1.00 . A A . 16 ASP CG 1 1 4 1206 1 1 16 ASP H H 5.016 3.891 7.598 1.00 . A A . 16 ASP H 1 1 4 1207 1 1 16 ASP HA H 7.702 3.117 8.431 1.00 . A A . 16 ASP HA 1 1 4 1208 1 1 16 ASP HB2 H 7.298 5.537 8.740 1.00 . A A . 16 ASP HB2 1 1 4 1209 1 1 16 ASP HB3 H 5.812 5.207 9.609 1.00 . A A . 16 ASP HB3 1 1 4 1210 1 1 16 ASP N N 5.958 3.574 7.492 1.00 . A A . 16 ASP N 1 1 4 1211 1 1 16 ASP O O 6.511 2.217 10.762 1.00 . A A . 16 ASP O 1 1 4 1212 1 1 16 ASP OD1 O 8.839 4.877 10.669 1.00 . A A . 16 ASP OD1 1 1 4 1213 1 1 16 ASP OD2 O 6.919 4.777 11.794 1.00 . A A . 16 ASP OD2 1 1 4 1214 1 1 17 GLY C C 3.025 1.863 10.884 1.00 . A A . 17 GLY C 1 1 4 1215 1 1 17 GLY CA C 4.062 1.118 10.042 1.00 . A A . 17 GLY CA 1 1 4 1216 1 1 17 GLY H H 4.442 2.286 8.360 1.00 . A A . 17 GLY H 1 1 4 1217 1 1 17 GLY HA2 H 3.560 0.403 9.390 1.00 . A A . 17 GLY HA2 1 1 4 1218 1 1 17 GLY HA3 H 4.721 0.545 10.694 1.00 . A A . 17 GLY HA3 1 1 4 1219 1 1 17 GLY N N 4.845 2.043 9.242 1.00 . A A . 17 GLY N 1 1 4 1220 1 1 17 GLY O O 2.105 1.253 11.427 1.00 . A A . 17 GLY O 1 1 4 1221 1 1 18 ARG C C 0.855 3.755 11.305 1.00 . A A . 18 ARG C 1 1 4 1222 1 1 18 ARG CA C 2.302 4.009 11.734 1.00 . A A . 18 ARG CA 1 1 4 1223 1 1 18 ARG CB C 2.629 5.492 11.547 1.00 . A A . 18 ARG CB 1 1 4 1224 1 1 18 ARG CD C 4.362 7.291 11.888 1.00 . A A . 18 ARG CD 1 1 4 1225 1 1 18 ARG CG C 4.072 5.791 11.959 1.00 . A A . 18 ARG CG 1 1 4 1226 1 1 18 ARG CZ C 5.610 8.941 13.278 1.00 . A A . 18 ARG CZ 1 1 4 1227 1 1 18 ARG H H 3.960 3.661 10.523 1.00 . A A . 18 ARG H 1 1 4 1228 1 1 18 ARG HA H 2.460 3.714 12.771 1.00 . A A . 18 ARG HA 1 1 4 1229 1 1 18 ARG HB2 H 2.478 5.773 10.505 1.00 . A A . 18 ARG HB2 1 1 4 1230 1 1 18 ARG HB3 H 1.945 6.097 12.142 1.00 . A A . 18 ARG HB3 1 1 4 1231 1 1 18 ARG HD2 H 4.979 7.510 11.016 1.00 . A A . 18 ARG HD2 1 1 4 1232 1 1 18 ARG HD3 H 3.432 7.845 11.766 1.00 . A A . 18 ARG HD3 1 1 4 1233 1 1 18 ARG HE H 5.112 7.086 13.881 1.00 . A A . 18 ARG HE 1 1 4 1234 1 1 18 ARG HG2 H 4.247 5.430 12.972 1.00 . A A . 18 ARG HG2 1 1 4 1235 1 1 18 ARG HG3 H 4.759 5.252 11.306 1.00 . A A . 18 ARG HG3 1 1 4 1236 1 1 18 ARG HH11 H 5.104 9.604 11.423 1.00 . A A . 18 ARG HH11 1 1 4 1237 1 1 18 ARG HH12 H 5.972 10.740 12.402 1.00 . A A . 18 ARG HH12 1 1 4 1238 1 1 18 ARG HH21 H 6.257 8.584 15.173 1.00 . A A . 18 ARG HH21 1 1 4 1239 1 1 18 ARG HH22 H 6.632 10.156 14.549 1.00 . A A . 18 ARG HH22 1 1 4 1240 1 1 18 ARG N N 3.209 3.173 10.967 1.00 . A A . 18 ARG N 1 1 4 1241 1 1 18 ARG NE N 5.055 7.732 13.120 1.00 . A A . 18 ARG NE 1 1 4 1242 1 1 18 ARG NH1 N 5.558 9.837 12.284 1.00 . A A . 18 ARG NH1 1 1 4 1243 1 1 18 ARG NH2 N 6.218 9.253 14.431 1.00 . A A . 18 ARG NH2 1 1 4 1244 1 1 18 ARG O O 0.467 4.092 10.187 1.00 . A A . 18 ARG O 1 1 4 1245 1 1 19 CYS C C -2.055 4.178 11.782 1.00 . A A . 19 CYS C 1 1 4 1246 1 1 19 CYS CA C -1.298 2.858 11.945 1.00 . A A . 19 CYS CA 1 1 4 1247 1 1 19 CYS CB C -1.909 1.981 13.040 1.00 . A A . 19 CYS CB 1 1 4 1248 1 1 19 CYS H H 0.420 2.892 13.122 1.00 . A A . 19 CYS H 1 1 4 1249 1 1 19 CYS HA H -1.319 2.283 11.019 1.00 . A A . 19 CYS HA 1 1 4 1250 1 1 19 CYS HB2 H -1.793 2.488 13.998 1.00 . A A . 19 CYS HB2 1 1 4 1251 1 1 19 CYS HB3 H -2.979 1.887 12.856 1.00 . A A . 19 CYS HB3 1 1 4 1252 1 1 19 CYS N N 0.097 3.163 12.215 1.00 . A A . 19 CYS N 1 1 4 1253 1 1 19 CYS O O -2.565 4.729 12.757 1.00 . A A . 19 CYS O 1 1 4 1254 1 1 19 CYS SG S -1.187 0.305 13.172 1.00 . A A . 19 CYS SG 1 1 4 1255 1 1 20 LYS C C -4.255 5.596 9.920 1.00 . A A . 20 LYS C 1 1 4 1256 1 1 20 LYS CA C -2.788 5.892 10.242 1.00 . A A . 20 LYS CA 1 1 4 1257 1 1 20 LYS CB C -2.056 6.651 9.133 1.00 . A A . 20 LYS CB 1 1 4 1258 1 1 20 LYS CD C -1.131 8.969 8.776 1.00 . A A . 20 LYS CD 1 1 4 1259 1 1 20 LYS CE C 0.151 9.777 8.989 1.00 . A A . 20 LYS CE 1 1 4 1260 1 1 20 LYS CG C -1.181 7.763 9.715 1.00 . A A . 20 LYS CG 1 1 4 1261 1 1 20 LYS H H -1.685 4.192 9.758 1.00 . A A . 20 LYS H 1 1 4 1262 1 1 20 LYS HA H -2.749 6.512 11.137 1.00 . A A . 20 LYS HA 1 1 4 1263 1 1 20 LYS HB2 H -1.438 5.959 8.560 1.00 . A A . 20 LYS HB2 1 1 4 1264 1 1 20 LYS HB3 H -2.781 7.078 8.440 1.00 . A A . 20 LYS HB3 1 1 4 1265 1 1 20 LYS HD2 H -1.185 8.631 7.741 1.00 . A A . 20 LYS HD2 1 1 4 1266 1 1 20 LYS HD3 H -1.999 9.606 8.949 1.00 . A A . 20 LYS HD3 1 1 4 1267 1 1 20 LYS HE2 H 0.373 9.844 10.054 1.00 . A A . 20 LYS HE2 1 1 4 1268 1 1 20 LYS HE3 H 0.991 9.266 8.519 1.00 . A A . 20 LYS HE3 1 1 4 1269 1 1 20 LYS HG2 H -1.574 8.069 10.685 1.00 . A A . 20 LYS HG2 1 1 4 1270 1 1 20 LYS HG3 H -0.172 7.386 9.884 1.00 . A A . 20 LYS HG3 1 1 4 1271 1 1 20 LYS HZ1 H -0.455 11.080 7.535 1.00 . A A . 20 LYS HZ1 1 1 4 1272 1 1 20 LYS HZ2 H -0.532 11.703 9.042 1.00 . A A . 20 LYS HZ2 1 1 4 1273 1 1 20 LYS HZ3 H 0.913 11.543 8.298 1.00 . A A . 20 LYS HZ3 1 1 4 1274 1 1 20 LYS N N -2.103 4.647 10.545 1.00 . A A . 20 LYS N 1 1 4 1275 1 1 20 LYS NZ N 0.008 11.136 8.420 1.00 . A A . 20 LYS NZ 1 1 4 1276 1 1 20 LYS O O -4.632 4.441 9.731 1.00 . A A . 20 LYS O 1 1 4 1277 1 1 21 PRO C C -6.704 6.275 8.082 1.00 . A A . 21 PRO C 1 1 4 1278 1 1 21 PRO CA C -6.479 6.559 9.569 1.00 . A A . 21 PRO CA 1 1 4 1279 1 1 21 PRO CB C -7.099 7.870 10.024 1.00 . A A . 21 PRO CB 1 1 4 1280 1 1 21 PRO CD C -4.650 8.073 10.084 1.00 . A A . 21 PRO CD 1 1 4 1281 1 1 21 PRO CG C -5.950 8.860 10.128 1.00 . A A . 21 PRO CG 1 1 4 1282 1 1 21 PRO HA H -6.865 5.777 10.058 1.00 . A A . 21 PRO HA 1 1 4 1283 1 1 21 PRO HB2 H -7.849 8.216 9.313 1.00 . A A . 21 PRO HB2 1 1 4 1284 1 1 21 PRO HB3 H -7.600 7.753 10.985 1.00 . A A . 21 PRO HB3 1 1 4 1285 1 1 21 PRO HD2 H -4.002 8.423 9.282 1.00 . A A . 21 PRO HD2 1 1 4 1286 1 1 21 PRO HD3 H -4.093 8.177 11.015 1.00 . A A . 21 PRO HD3 1 1 4 1287 1 1 21 PRO HG2 H -5.989 9.578 9.308 1.00 . A A . 21 PRO HG2 1 1 4 1288 1 1 21 PRO HG3 H -6.019 9.431 11.054 1.00 . A A . 21 PRO HG3 1 1 4 1289 1 1 21 PRO N N -5.063 6.689 9.866 1.00 . A A . 21 PRO N 1 1 4 1290 1 1 21 PRO O O -5.970 6.779 7.233 1.00 . A A . 21 PRO O 1 1 4 1291 1 1 22 THR C C -9.304 5.865 5.986 1.00 . A A . 22 THR C 1 1 4 1292 1 1 22 THR CA C -8.053 5.114 6.445 1.00 . A A . 22 THR CA 1 1 4 1293 1 1 22 THR CB C -8.197 3.593 6.373 1.00 . A A . 22 THR CB 1 1 4 1294 1 1 22 THR CG2 C -8.057 3.057 4.947 1.00 . A A . 22 THR CG2 1 1 4 1295 1 1 22 THR H H -8.314 5.066 8.511 1.00 . A A . 22 THR H 1 1 4 1296 1 1 22 THR HA H -7.235 5.433 5.799 1.00 . A A . 22 THR HA 1 1 4 1297 1 1 22 THR HB H -9.137 3.269 6.821 1.00 . A A . 22 THR HB 1 1 4 1298 1 1 22 THR HG1 H -7.295 2.698 7.920 1.00 . A A . 22 THR HG1 1 1 4 1299 1 1 22 THR HG21 H -7.197 3.523 4.467 1.00 . A A . 22 THR HG21 1 1 4 1300 1 1 22 THR HG22 H -7.915 1.976 4.977 1.00 . A A . 22 THR HG22 1 1 4 1301 1 1 22 THR HG23 H -8.960 3.290 4.382 1.00 . A A . 22 THR HG23 1 1 4 1302 1 1 22 THR N N -7.722 5.471 7.814 1.00 . A A . 22 THR N 1 1 4 1303 1 1 22 THR O O -9.835 5.596 4.910 1.00 . A A . 22 THR O 1 1 4 1304 1 1 22 THR OG1 O -7.038 3.103 7.044 1.00 . A A . 22 THR OG1 1 1 4 1305 1 1 23 PHE C C -10.532 8.987 6.049 1.00 . A A . 23 PHE C 1 1 4 1306 1 1 23 PHE CA C -10.921 7.583 6.520 1.00 . A A . 23 PHE CA 1 1 4 1307 1 1 23 PHE CB C -11.729 7.698 7.813 1.00 . A A . 23 PHE CB 1 1 4 1308 1 1 23 PHE CD1 C -10.454 9.497 9.000 1.00 . A A . 23 PHE CD1 1 1 4 1309 1 1 23 PHE CD2 C -10.684 7.412 10.071 1.00 . A A . 23 PHE CD2 1 1 4 1310 1 1 23 PHE CE1 C -9.709 9.983 10.107 1.00 . A A . 23 PHE CE1 1 1 4 1311 1 1 23 PHE CE2 C -9.938 7.898 11.178 1.00 . A A . 23 PHE CE2 1 1 4 1312 1 1 23 PHE CG C -10.926 8.223 9.006 1.00 . A A . 23 PHE CG 1 1 4 1313 1 1 23 PHE CZ C -9.467 9.174 11.172 1.00 . A A . 23 PHE CZ 1 1 4 1314 1 1 23 PHE H H -9.304 7.005 7.700 1.00 . A A . 23 PHE H 1 1 4 1315 1 1 23 PHE HA H -11.457 7.069 5.723 1.00 . A A . 23 PHE HA 1 1 4 1316 1 1 23 PHE HB2 H -12.578 8.360 7.642 1.00 . A A . 23 PHE HB2 1 1 4 1317 1 1 23 PHE HB3 H -12.135 6.719 8.064 1.00 . A A . 23 PHE HB3 1 1 4 1318 1 1 23 PHE HD1 H -10.649 10.147 8.147 1.00 . A A . 23 PHE HD1 1 1 4 1319 1 1 23 PHE HD2 H -11.062 6.390 10.076 1.00 . A A . 23 PHE HD2 1 1 4 1320 1 1 23 PHE HE1 H -9.331 11.006 10.102 1.00 . A A . 23 PHE HE1 1 1 4 1321 1 1 23 PHE HE2 H -9.743 7.248 12.031 1.00 . A A . 23 PHE HE2 1 1 4 1322 1 1 23 PHE HZ H -8.894 9.546 12.022 1.00 . A A . 23 PHE HZ 1 1 4 1323 1 1 23 PHE N N -9.741 6.792 6.826 1.00 . A A . 23 PHE N 1 1 4 1324 1 1 23 PHE O O -10.642 9.300 4.864 1.00 . A A . 23 PHE O 1 1 5 1325 1 1 1 GLU C C -10.719 -7.382 13.505 1.00 . A A . 1 GLU C 1 1 5 1326 1 1 1 GLU CA C -12.018 -6.768 12.981 1.00 . A A . 1 GLU CA 1 1 5 1327 1 1 1 GLU CB C -13.088 -7.842 12.773 1.00 . A A . 1 GLU CB 1 1 5 1328 1 1 1 GLU CD C -15.258 -6.584 13.036 1.00 . A A . 1 GLU CD 1 1 5 1329 1 1 1 GLU CG C -14.299 -7.591 13.674 1.00 . A A . 1 GLU CG 1 1 5 1330 1 1 1 GLU HA H -12.390 -6.027 13.690 1.00 . A A . 1 GLU HA 1 1 5 1331 1 1 1 GLU HB2 H -13.402 -7.850 11.729 1.00 . A A . 1 GLU HB2 1 1 5 1332 1 1 1 GLU HB3 H -12.668 -8.825 12.987 1.00 . A A . 1 GLU HB3 1 1 5 1333 1 1 1 GLU HG2 H -14.821 -8.531 13.856 1.00 . A A . 1 GLU HG2 1 1 5 1334 1 1 1 GLU HG3 H -13.966 -7.219 14.642 1.00 . A A . 1 GLU HG3 1 1 5 1335 1 1 1 GLU N N -11.770 -6.035 11.751 1.00 . A A . 1 GLU N 1 1 5 1336 1 1 1 GLU O O -10.297 -7.090 14.623 1.00 . A A . 1 GLU O 1 1 5 1337 1 1 1 GLU OE1 O -16.054 -7.023 12.178 1.00 . A A . 1 GLU OE1 1 1 5 1338 1 1 1 GLU OE2 O -15.172 -5.397 13.420 1.00 . A A . 1 GLU OE2 1 1 5 1339 1 1 2 ASN C C -7.714 -7.907 12.836 1.00 . A A . 2 ASN C 1 1 5 1340 1 1 2 ASN CA C -8.878 -8.879 13.039 1.00 . A A . 2 ASN CA 1 1 5 1341 1 1 2 ASN CB C -8.626 -10.108 12.163 1.00 . A A . 2 ASN CB 1 1 5 1342 1 1 2 ASN CG C -9.796 -11.090 12.247 1.00 . A A . 2 ASN CG 1 1 5 1343 1 1 2 ASN H H -10.471 -8.454 11.766 1.00 . A A . 2 ASN H 1 1 5 1344 1 1 2 ASN HA H -9.002 -9.168 14.082 1.00 . A A . 2 ASN HA 1 1 5 1345 1 1 2 ASN HB2 H -8.481 -9.798 11.128 1.00 . A A . 2 ASN HB2 1 1 5 1346 1 1 2 ASN HB3 H -7.709 -10.602 12.479 1.00 . A A . 2 ASN HB3 1 1 5 1347 1 1 2 ASN HD21 H -9.044 -12.052 10.632 1.00 . A A . 2 ASN HD21 1 1 5 1348 1 1 2 ASN HD22 H -10.503 -12.722 11.280 1.00 . A A . 2 ASN HD22 1 1 5 1349 1 1 2 ASN N N -10.121 -8.222 12.673 1.00 . A A . 2 ASN N 1 1 5 1350 1 1 2 ASN ND2 N -9.780 -12.033 11.309 1.00 . A A . 2 ASN ND2 1 1 5 1351 1 1 2 ASN O O -7.755 -7.061 11.943 1.00 . A A . 2 ASN O 1 1 5 1352 1 1 2 ASN OD1 O -10.658 -10.997 13.106 1.00 . A A . 2 ASN OD1 1 1 5 1353 1 1 3 PHE C C -4.806 -7.387 12.266 1.00 . A A . 3 PHE C 1 1 5 1354 1 1 3 PHE CA C -5.529 -7.208 13.602 1.00 . A A . 3 PHE CA 1 1 5 1355 1 1 3 PHE CB C -4.594 -7.632 14.737 1.00 . A A . 3 PHE CB 1 1 5 1356 1 1 3 PHE CD1 C -3.499 -9.788 14.083 1.00 . A A . 3 PHE CD1 1 1 5 1357 1 1 3 PHE CD2 C -5.166 -9.850 15.748 1.00 . A A . 3 PHE CD2 1 1 5 1358 1 1 3 PHE CE1 C -3.332 -11.193 14.199 1.00 . A A . 3 PHE CE1 1 1 5 1359 1 1 3 PHE CE2 C -4.998 -11.256 15.862 1.00 . A A . 3 PHE CE2 1 1 5 1360 1 1 3 PHE CG C -4.413 -9.147 14.860 1.00 . A A . 3 PHE CG 1 1 5 1361 1 1 3 PHE CZ C -4.085 -11.898 15.086 1.00 . A A . 3 PHE CZ 1 1 5 1362 1 1 3 PHE H H -6.677 -8.752 14.402 1.00 . A A . 3 PHE H 1 1 5 1363 1 1 3 PHE HA H -5.872 -6.176 13.692 1.00 . A A . 3 PHE HA 1 1 5 1364 1 1 3 PHE HB2 H -3.618 -7.171 14.580 1.00 . A A . 3 PHE HB2 1 1 5 1365 1 1 3 PHE HB3 H -4.982 -7.244 15.679 1.00 . A A . 3 PHE HB3 1 1 5 1366 1 1 3 PHE HD1 H -2.896 -9.224 13.373 1.00 . A A . 3 PHE HD1 1 1 5 1367 1 1 3 PHE HD2 H -5.898 -9.336 16.370 1.00 . A A . 3 PHE HD2 1 1 5 1368 1 1 3 PHE HE1 H -2.599 -11.707 13.576 1.00 . A A . 3 PHE HE1 1 1 5 1369 1 1 3 PHE HE2 H -5.602 -11.821 16.573 1.00 . A A . 3 PHE HE2 1 1 5 1370 1 1 3 PHE HZ H -3.956 -12.977 15.173 1.00 . A A . 3 PHE HZ 1 1 5 1371 1 1 3 PHE N N -6.703 -8.061 13.679 1.00 . A A . 3 PHE N 1 1 5 1372 1 1 3 PHE O O -4.533 -8.512 11.851 1.00 . A A . 3 PHE O 1 1 5 1373 1 1 4 ASN C C -2.402 -5.765 10.533 1.00 . A A . 4 ASN C 1 1 5 1374 1 1 4 ASN CA C -3.830 -6.280 10.350 1.00 . A A . 4 ASN CA 1 1 5 1375 1 1 4 ASN CB C -4.533 -5.375 9.335 1.00 . A A . 4 ASN CB 1 1 5 1376 1 1 4 ASN CG C -4.983 -4.066 9.987 1.00 . A A . 4 ASN CG 1 1 5 1377 1 1 4 ASN H H -4.742 -5.351 11.975 1.00 . A A . 4 ASN H 1 1 5 1378 1 1 4 ASN HA H -3.859 -7.320 10.025 1.00 . A A . 4 ASN HA 1 1 5 1379 1 1 4 ASN HB2 H -3.859 -5.161 8.506 1.00 . A A . 4 ASN HB2 1 1 5 1380 1 1 4 ASN HB3 H -5.396 -5.893 8.917 1.00 . A A . 4 ASN HB3 1 1 5 1381 1 1 4 ASN HD21 H -3.389 -3.152 9.141 1.00 . A A . 4 ASN HD21 1 1 5 1382 1 1 4 ASN HD22 H -4.404 -2.130 10.103 1.00 . A A . 4 ASN HD22 1 1 5 1383 1 1 4 ASN N N -4.517 -6.261 11.631 1.00 . A A . 4 ASN N 1 1 5 1384 1 1 4 ASN ND2 N -4.194 -3.030 9.721 1.00 . A A . 4 ASN ND2 1 1 5 1385 1 1 4 ASN O O -2.007 -4.782 9.908 1.00 . A A . 4 ASN O 1 1 5 1386 1 1 4 ASN OD1 O -5.982 -4.002 10.685 1.00 . A A . 4 ASN OD1 1 1 5 1387 1 1 5 GLY C C -0.143 -5.529 13.093 1.00 . A A . 5 GLY C 1 1 5 1388 1 1 5 GLY CA C -0.289 -6.073 11.671 1.00 . A A . 5 GLY CA 1 1 5 1389 1 1 5 GLY H H -1.994 -7.248 11.902 1.00 . A A . 5 GLY H 1 1 5 1390 1 1 5 GLY HA2 H 0.361 -6.937 11.539 1.00 . A A . 5 GLY HA2 1 1 5 1391 1 1 5 GLY HA3 H 0.034 -5.318 10.954 1.00 . A A . 5 GLY HA3 1 1 5 1392 1 1 5 GLY N N -1.666 -6.450 11.397 1.00 . A A . 5 GLY N 1 1 5 1393 1 1 5 GLY O O 0.829 -5.834 13.781 1.00 . A A . 5 GLY O 1 1 5 1394 1 1 6 GLY C C -1.846 -2.798 14.826 1.00 . A A . 6 GLY C 1 1 5 1395 1 1 6 GLY CA C -1.116 -4.141 14.820 1.00 . A A . 6 GLY CA 1 1 5 1396 1 1 6 GLY H H -1.911 -4.488 12.925 1.00 . A A . 6 GLY H 1 1 5 1397 1 1 6 GLY HA2 H -1.591 -4.822 15.525 1.00 . A A . 6 GLY HA2 1 1 5 1398 1 1 6 GLY HA3 H -0.088 -4.003 15.153 1.00 . A A . 6 GLY HA3 1 1 5 1399 1 1 6 GLY N N -1.124 -4.732 13.491 1.00 . A A . 6 GLY N 1 1 5 1400 1 1 6 GLY O O -1.316 -1.801 15.314 1.00 . A A . 6 GLY O 1 1 5 1401 1 1 7 CYS C C -5.104 -1.816 15.087 1.00 . A A . 7 CYS C 1 1 5 1402 1 1 7 CYS CA C -3.863 -1.609 14.217 1.00 . A A . 7 CYS CA 1 1 5 1403 1 1 7 CYS CB C -4.230 -1.247 12.776 1.00 . A A . 7 CYS CB 1 1 5 1404 1 1 7 CYS H H -3.478 -3.628 13.886 1.00 . A A . 7 CYS H 1 1 5 1405 1 1 7 CYS HA H -3.248 -0.797 14.608 1.00 . A A . 7 CYS HA 1 1 5 1406 1 1 7 CYS HB2 H -4.594 -2.143 12.273 1.00 . A A . 7 CYS HB2 1 1 5 1407 1 1 7 CYS HB3 H -5.053 -0.534 12.793 1.00 . A A . 7 CYS HB3 1 1 5 1408 1 1 7 CYS N N -3.054 -2.814 14.280 1.00 . A A . 7 CYS N 1 1 5 1409 1 1 7 CYS O O -5.346 -2.919 15.574 1.00 . A A . 7 CYS O 1 1 5 1410 1 1 7 CYS SG S -2.860 -0.538 11.791 1.00 . A A . 7 CYS SG 1 1 5 1411 1 1 8 LEU C C -8.156 -1.540 15.282 1.00 . A A . 8 LEU C 1 1 5 1412 1 1 8 LEU CA C -7.068 -0.791 16.056 1.00 . A A . 8 LEU CA 1 1 5 1413 1 1 8 LEU CB C -7.482 0.616 16.493 1.00 . A A . 8 LEU CB 1 1 5 1414 1 1 8 LEU CD1 C -8.872 -0.098 18.473 1.00 . A A . 8 LEU CD1 1 1 5 1415 1 1 8 LEU CD2 C -9.206 2.195 17.439 1.00 . A A . 8 LEU CD2 1 1 5 1416 1 1 8 LEU CG C -8.841 0.730 17.187 1.00 . A A . 8 LEU CG 1 1 5 1417 1 1 8 LEU H H -5.654 0.154 14.854 1.00 . A A . 8 LEU H 1 1 5 1418 1 1 8 LEU HA H -6.838 -1.355 16.960 1.00 . A A . 8 LEU HA 1 1 5 1419 1 1 8 LEU HB2 H -6.718 1.004 17.166 1.00 . A A . 8 LEU HB2 1 1 5 1420 1 1 8 LEU HB3 H -7.489 1.260 15.614 1.00 . A A . 8 LEU HB3 1 1 5 1421 1 1 8 LEU HD11 H -7.958 -0.687 18.548 1.00 . A A . 8 LEU HD11 1 1 5 1422 1 1 8 LEU HD12 H -8.946 0.569 19.332 1.00 . A A . 8 LEU HD12 1 1 5 1423 1 1 8 LEU HD13 H -9.733 -0.764 18.455 1.00 . A A . 8 LEU HD13 1 1 5 1424 1 1 8 LEU HD21 H -8.296 2.774 17.594 1.00 . A A . 8 LEU HD21 1 1 5 1425 1 1 8 LEU HD22 H -9.744 2.588 16.576 1.00 . A A . 8 LEU HD22 1 1 5 1426 1 1 8 LEU HD23 H -9.837 2.264 18.324 1.00 . A A . 8 LEU HD23 1 1 5 1427 1 1 8 LEU HG H -9.600 0.318 16.521 1.00 . A A . 8 LEU HG 1 1 5 1428 1 1 8 LEU N N -5.858 -0.740 15.254 1.00 . A A . 8 LEU N 1 1 5 1429 1 1 8 LEU O O -8.699 -2.531 15.770 1.00 . A A . 8 LEU O 1 1 5 1430 1 1 9 ALA C C -9.905 -0.635 12.188 1.00 . A A . 9 ALA C 1 1 5 1431 1 1 9 ALA CA C -9.455 -1.645 13.246 1.00 . A A . 9 ALA CA 1 1 5 1432 1 1 9 ALA CB C -10.616 -2.136 14.113 1.00 . A A . 9 ALA CB 1 1 5 1433 1 1 9 ALA H H -7.996 -0.230 13.703 1.00 . A A . 9 ALA H 1 1 5 1434 1 1 9 ALA HA H -9.002 -2.502 12.748 1.00 . A A . 9 ALA HA 1 1 5 1435 1 1 9 ALA HB1 H -10.592 -1.627 15.075 1.00 . A A . 9 ALA HB1 1 1 5 1436 1 1 9 ALA HB2 H -11.560 -1.922 13.612 1.00 . A A . 9 ALA HB2 1 1 5 1437 1 1 9 ALA HB3 H -10.524 -3.211 14.269 1.00 . A A . 9 ALA HB3 1 1 5 1438 1 1 9 ALA N N -8.443 -1.037 14.090 1.00 . A A . 9 ALA N 1 1 5 1439 1 1 9 ALA O O -10.772 0.197 12.448 1.00 . A A . 9 ALA O 1 1 5 1440 1 1 10 GLY C C -8.391 0.949 9.478 1.00 . A A . 10 GLY C 1 1 5 1441 1 1 10 GLY CA C -9.620 0.151 9.919 1.00 . A A . 10 GLY CA 1 1 5 1442 1 1 10 GLY H H -8.590 -1.422 10.813 1.00 . A A . 10 GLY H 1 1 5 1443 1 1 10 GLY HA2 H -10.006 -0.425 9.077 1.00 . A A . 10 GLY HA2 1 1 5 1444 1 1 10 GLY HA3 H -10.413 0.836 10.224 1.00 . A A . 10 GLY HA3 1 1 5 1445 1 1 10 GLY N N -9.294 -0.742 11.016 1.00 . A A . 10 GLY N 1 1 5 1446 1 1 10 GLY O O -8.199 1.192 8.287 1.00 . A A . 10 GLY O 1 1 5 1447 1 1 11 TYR C C -5.485 1.368 9.197 1.00 . A A . 11 TYR C 1 1 5 1448 1 1 11 TYR CA C -6.388 2.102 10.190 1.00 . A A . 11 TYR CA 1 1 5 1449 1 1 11 TYR CB C -5.659 2.229 11.528 1.00 . A A . 11 TYR CB 1 1 5 1450 1 1 11 TYR CD1 C -7.333 2.694 13.354 1.00 . A A . 11 TYR CD1 1 1 5 1451 1 1 11 TYR CD2 C -5.965 4.498 12.585 1.00 . A A . 11 TYR CD2 1 1 5 1452 1 1 11 TYR CE1 C -7.976 3.581 14.289 1.00 . A A . 11 TYR CE1 1 1 5 1453 1 1 11 TYR CE2 C -6.608 5.384 13.520 1.00 . A A . 11 TYR CE2 1 1 5 1454 1 1 11 TYR CG C -6.341 3.171 12.522 1.00 . A A . 11 TYR CG 1 1 5 1455 1 1 11 TYR CZ C -7.581 4.882 14.326 1.00 . A A . 11 TYR CZ 1 1 5 1456 1 1 11 TYR H H -7.757 1.135 11.427 1.00 . A A . 11 TYR H 1 1 5 1457 1 1 11 TYR HA H -6.687 3.058 9.759 1.00 . A A . 11 TYR HA 1 1 5 1458 1 1 11 TYR HB2 H -5.574 1.240 11.979 1.00 . A A . 11 TYR HB2 1 1 5 1459 1 1 11 TYR HB3 H -4.645 2.584 11.345 1.00 . A A . 11 TYR HB3 1 1 5 1460 1 1 11 TYR HD1 H -7.630 1.647 13.304 1.00 . A A . 11 TYR HD1 1 1 5 1461 1 1 11 TYR HD2 H -5.182 4.874 11.927 1.00 . A A . 11 TYR HD2 1 1 5 1462 1 1 11 TYR HE1 H -8.760 3.217 14.953 1.00 . A A . 11 TYR HE1 1 1 5 1463 1 1 11 TYR HE2 H -6.320 6.434 13.581 1.00 . A A . 11 TYR HE2 1 1 5 1464 1 1 11 TYR HH H -7.513 6.094 15.845 1.00 . A A . 11 TYR HH 1 1 5 1465 1 1 11 TYR N N -7.592 1.336 10.461 1.00 . A A . 11 TYR N 1 1 5 1466 1 1 11 TYR O O -5.576 0.149 9.052 1.00 . A A . 11 TYR O 1 1 5 1467 1 1 11 TYR OH O -8.188 5.719 15.210 1.00 . A A . 11 TYR OH 1 1 5 1468 1 1 12 MET C C -2.265 1.678 8.056 1.00 . A A . 12 MET C 1 1 5 1469 1 1 12 MET CA C -3.711 1.578 7.565 1.00 . A A . 12 MET CA 1 1 5 1470 1 1 12 MET CB C -3.854 2.326 6.237 1.00 . A A . 12 MET CB 1 1 5 1471 1 1 12 MET CE C -3.581 6.363 5.465 1.00 . A A . 12 MET CE 1 1 5 1472 1 1 12 MET CG C -3.906 3.838 6.464 1.00 . A A . 12 MET CG 1 1 5 1473 1 1 12 MET H H -4.564 3.129 8.663 1.00 . A A . 12 MET H 1 1 5 1474 1 1 12 MET HA H -3.997 0.531 7.462 1.00 . A A . 12 MET HA 1 1 5 1475 1 1 12 MET HB2 H -3.015 2.081 5.586 1.00 . A A . 12 MET HB2 1 1 5 1476 1 1 12 MET HB3 H -4.760 1.999 5.728 1.00 . A A . 12 MET HB3 1 1 5 1477 1 1 12 MET HE1 H -3.425 6.361 6.545 1.00 . A A . 12 MET HE1 1 1 5 1478 1 1 12 MET HE2 H -2.702 6.780 4.974 1.00 . A A . 12 MET HE2 1 1 5 1479 1 1 12 MET HE3 H -4.454 6.970 5.226 1.00 . A A . 12 MET HE3 1 1 5 1480 1 1 12 MET HG2 H -4.820 4.104 6.995 1.00 . A A . 12 MET HG2 1 1 5 1481 1 1 12 MET HG3 H -3.070 4.150 7.091 1.00 . A A . 12 MET HG3 1 1 5 1482 1 1 12 MET N N -4.632 2.139 8.539 1.00 . A A . 12 MET N 1 1 5 1483 1 1 12 MET O O -1.967 2.448 8.966 1.00 . A A . 12 MET O 1 1 5 1484 1 1 12 MET SD S -3.844 4.692 4.898 1.00 . A A . 12 MET SD 1 1 5 1485 1 1 13 ARG C C 0.819 1.658 6.757 1.00 . A A . 13 ARG C 1 1 5 1486 1 1 13 ARG CA C 0.002 0.879 7.789 1.00 . A A . 13 ARG CA 1 1 5 1487 1 1 13 ARG CB C 0.538 -0.552 7.879 1.00 . A A . 13 ARG CB 1 1 5 1488 1 1 13 ARG CD C 0.724 -1.392 10.249 1.00 . A A . 13 ARG CD 1 1 5 1489 1 1 13 ARG CG C -0.156 -1.328 9.000 1.00 . A A . 13 ARG CG 1 1 5 1490 1 1 13 ARG CZ C 1.937 -3.204 11.455 1.00 . A A . 13 ARG CZ 1 1 5 1491 1 1 13 ARG H H -1.657 0.264 6.689 1.00 . A A . 13 ARG H 1 1 5 1492 1 1 13 ARG HA H 0.042 1.360 8.766 1.00 . A A . 13 ARG HA 1 1 5 1493 1 1 13 ARG HB2 H 0.383 -1.062 6.928 1.00 . A A . 13 ARG HB2 1 1 5 1494 1 1 13 ARG HB3 H 1.613 -0.530 8.058 1.00 . A A . 13 ARG HB3 1 1 5 1495 1 1 13 ARG HD2 H 1.675 -0.893 10.061 1.00 . A A . 13 ARG HD2 1 1 5 1496 1 1 13 ARG HD3 H 0.243 -0.862 11.071 1.00 . A A . 13 ARG HD3 1 1 5 1497 1 1 13 ARG HE H 0.357 -3.500 10.244 1.00 . A A . 13 ARG HE 1 1 5 1498 1 1 13 ARG HG2 H -1.105 -0.850 9.244 1.00 . A A . 13 ARG HG2 1 1 5 1499 1 1 13 ARG HG3 H -0.386 -2.338 8.660 1.00 . A A . 13 ARG HG3 1 1 5 1500 1 1 13 ARG HH11 H 2.667 -1.334 11.779 1.00 . A A . 13 ARG HH11 1 1 5 1501 1 1 13 ARG HH12 H 3.500 -2.605 12.611 1.00 . A A . 13 ARG HH12 1 1 5 1502 1 1 13 ARG HH21 H 1.456 -5.177 11.341 1.00 . A A . 13 ARG HH21 1 1 5 1503 1 1 13 ARG HH22 H 2.806 -4.805 12.360 1.00 . A A . 13 ARG HH22 1 1 5 1504 1 1 13 ARG N N -1.406 0.888 7.429 1.00 . A A . 13 ARG N 1 1 5 1505 1 1 13 ARG NE N 0.962 -2.803 10.629 1.00 . A A . 13 ARG NE 1 1 5 1506 1 1 13 ARG NH1 N 2.772 -2.305 11.994 1.00 . A A . 13 ARG NH1 1 1 5 1507 1 1 13 ARG NH2 N 2.079 -4.506 11.743 1.00 . A A . 13 ARG NH2 1 1 5 1508 1 1 13 ARG O O 1.053 1.173 5.651 1.00 . A A . 13 ARG O 1 1 5 1509 1 1 14 THR C C 3.364 3.051 5.966 1.00 . A A . 14 THR C 1 1 5 1510 1 1 14 THR CA C 2.016 3.705 6.278 1.00 . A A . 14 THR CA 1 1 5 1511 1 1 14 THR CB C 2.146 5.077 6.943 1.00 . A A . 14 THR CB 1 1 5 1512 1 1 14 THR CG2 C 0.788 5.680 7.309 1.00 . A A . 14 THR CG2 1 1 5 1513 1 1 14 THR H H 1.035 3.240 8.055 1.00 . A A . 14 THR H 1 1 5 1514 1 1 14 THR HA H 1.484 3.807 5.332 1.00 . A A . 14 THR HA 1 1 5 1515 1 1 14 THR HB H 2.720 5.759 6.317 1.00 . A A . 14 THR HB 1 1 5 1516 1 1 14 THR HG1 H 2.711 5.605 8.788 1.00 . A A . 14 THR HG1 1 1 5 1517 1 1 14 THR HG21 H 0.025 5.297 6.631 1.00 . A A . 14 THR HG21 1 1 5 1518 1 1 14 THR HG22 H 0.534 5.408 8.333 1.00 . A A . 14 THR HG22 1 1 5 1519 1 1 14 THR HG23 H 0.839 6.766 7.224 1.00 . A A . 14 THR HG23 1 1 5 1520 1 1 14 THR N N 1.230 2.853 7.154 1.00 . A A . 14 THR N 1 1 5 1521 1 1 14 THR O O 3.548 1.858 6.204 1.00 . A A . 14 THR O 1 1 5 1522 1 1 14 THR OG1 O 2.752 4.797 8.202 1.00 . A A . 14 THR OG1 1 1 5 1523 1 1 15 ALA C C 6.517 3.512 6.307 1.00 . A A . 15 ALA C 1 1 5 1524 1 1 15 ALA CA C 5.595 3.375 5.093 1.00 . A A . 15 ALA CA 1 1 5 1525 1 1 15 ALA CB C 6.117 4.140 3.875 1.00 . A A . 15 ALA CB 1 1 5 1526 1 1 15 ALA H H 4.112 4.829 5.250 1.00 . A A . 15 ALA H 1 1 5 1527 1 1 15 ALA HA H 5.505 2.320 4.833 1.00 . A A . 15 ALA HA 1 1 5 1528 1 1 15 ALA HB1 H 5.476 5.000 3.684 1.00 . A A . 15 ALA HB1 1 1 5 1529 1 1 15 ALA HB2 H 7.134 4.481 4.069 1.00 . A A . 15 ALA HB2 1 1 5 1530 1 1 15 ALA HB3 H 6.114 3.484 3.005 1.00 . A A . 15 ALA HB3 1 1 5 1531 1 1 15 ALA N N 4.270 3.859 5.439 1.00 . A A . 15 ALA N 1 1 5 1532 1 1 15 ALA O O 7.726 3.308 6.199 1.00 . A A . 15 ALA O 1 1 5 1533 1 1 16 ASP C C 6.236 2.948 9.669 1.00 . A A . 16 ASP C 1 1 5 1534 1 1 16 ASP CA C 6.664 4.022 8.666 1.00 . A A . 16 ASP CA 1 1 5 1535 1 1 16 ASP CB C 6.394 5.390 9.296 1.00 . A A . 16 ASP CB 1 1 5 1536 1 1 16 ASP CG C 7.355 6.500 8.867 1.00 . A A . 16 ASP CG 1 1 5 1537 1 1 16 ASP H H 4.929 4.019 7.514 1.00 . A A . 16 ASP H 1 1 5 1538 1 1 16 ASP HA H 7.711 3.930 8.378 1.00 . A A . 16 ASP HA 1 1 5 1539 1 1 16 ASP HB2 H 5.377 5.694 9.046 1.00 . A A . 16 ASP HB2 1 1 5 1540 1 1 16 ASP HB3 H 6.439 5.290 10.380 1.00 . A A . 16 ASP HB3 1 1 5 1541 1 1 16 ASP N N 5.912 3.855 7.434 1.00 . A A . 16 ASP N 1 1 5 1542 1 1 16 ASP O O 6.961 2.656 10.618 1.00 . A A . 16 ASP O 1 1 5 1543 1 1 16 ASP OD1 O 8.000 6.316 7.812 1.00 . A A . 16 ASP OD1 1 1 5 1544 1 1 16 ASP OD2 O 7.424 7.508 9.603 1.00 . A A . 16 ASP OD2 1 1 5 1545 1 1 17 GLY C C 3.515 1.935 11.282 1.00 . A A . 17 GLY C 1 1 5 1546 1 1 17 GLY CA C 4.528 1.354 10.294 1.00 . A A . 17 GLY CA 1 1 5 1547 1 1 17 GLY H H 4.476 2.632 8.649 1.00 . A A . 17 GLY H 1 1 5 1548 1 1 17 GLY HA2 H 4.051 0.579 9.693 1.00 . A A . 17 GLY HA2 1 1 5 1549 1 1 17 GLY HA3 H 5.343 0.877 10.840 1.00 . A A . 17 GLY HA3 1 1 5 1550 1 1 17 GLY N N 5.060 2.389 9.424 1.00 . A A . 17 GLY N 1 1 5 1551 1 1 17 GLY O O 2.961 1.210 12.107 1.00 . A A . 17 GLY O 1 1 5 1552 1 1 18 ARG C C 0.938 3.747 11.531 1.00 . A A . 18 ARG C 1 1 5 1553 1 1 18 ARG CA C 2.370 3.926 12.041 1.00 . A A . 18 ARG CA 1 1 5 1554 1 1 18 ARG CB C 2.691 5.419 12.126 1.00 . A A . 18 ARG CB 1 1 5 1555 1 1 18 ARG CD C 4.556 7.114 12.223 1.00 . A A . 18 ARG CD 1 1 5 1556 1 1 18 ARG CG C 4.175 5.645 12.421 1.00 . A A . 18 ARG CG 1 1 5 1557 1 1 18 ARG CZ C 3.904 8.255 14.340 1.00 . A A . 18 ARG CZ 1 1 5 1558 1 1 18 ARG H H 3.761 3.821 10.494 1.00 . A A . 18 ARG H 1 1 5 1559 1 1 18 ARG HA H 2.501 3.455 13.015 1.00 . A A . 18 ARG HA 1 1 5 1560 1 1 18 ARG HB2 H 2.424 5.906 11.188 1.00 . A A . 18 ARG HB2 1 1 5 1561 1 1 18 ARG HB3 H 2.086 5.881 12.907 1.00 . A A . 18 ARG HB3 1 1 5 1562 1 1 18 ARG HD2 H 5.430 7.187 11.576 1.00 . A A . 18 ARG HD2 1 1 5 1563 1 1 18 ARG HD3 H 3.745 7.644 11.724 1.00 . A A . 18 ARG HD3 1 1 5 1564 1 1 18 ARG HE H 5.795 7.790 13.831 1.00 . A A . 18 ARG HE 1 1 5 1565 1 1 18 ARG HG2 H 4.396 5.343 13.445 1.00 . A A . 18 ARG HG2 1 1 5 1566 1 1 18 ARG HG3 H 4.779 5.017 11.766 1.00 . A A . 18 ARG HG3 1 1 5 1567 1 1 18 ARG HH11 H 2.351 7.804 13.106 1.00 . A A . 18 ARG HH11 1 1 5 1568 1 1 18 ARG HH12 H 1.914 8.598 14.582 1.00 . A A . 18 ARG HH12 1 1 5 1569 1 1 18 ARG HH21 H 5.219 8.837 15.778 1.00 . A A . 18 ARG HH21 1 1 5 1570 1 1 18 ARG HH22 H 3.556 9.190 16.112 1.00 . A A . 18 ARG HH22 1 1 5 1571 1 1 18 ARG N N 3.305 3.238 11.167 1.00 . A A . 18 ARG N 1 1 5 1572 1 1 18 ARG NE N 4.842 7.743 13.531 1.00 . A A . 18 ARG NE 1 1 5 1573 1 1 18 ARG NH1 N 2.614 8.216 13.979 1.00 . A A . 18 ARG NH1 1 1 5 1574 1 1 18 ARG NH2 N 4.256 8.808 15.509 1.00 . A A . 18 ARG NH2 1 1 5 1575 1 1 18 ARG O O 0.578 4.279 10.482 1.00 . A A . 18 ARG O 1 1 5 1576 1 1 19 CYS C C -1.924 4.086 11.735 1.00 . A A . 19 CYS C 1 1 5 1577 1 1 19 CYS CA C -1.223 2.740 11.935 1.00 . A A . 19 CYS CA 1 1 5 1578 1 1 19 CYS CB C -1.931 1.878 12.982 1.00 . A A . 19 CYS CB 1 1 5 1579 1 1 19 CYS H H 0.461 2.567 13.148 1.00 . A A . 19 CYS H 1 1 5 1580 1 1 19 CYS HA H -1.204 2.172 11.006 1.00 . A A . 19 CYS HA 1 1 5 1581 1 1 19 CYS HB2 H -1.811 2.345 13.960 1.00 . A A . 19 CYS HB2 1 1 5 1582 1 1 19 CYS HB3 H -2.998 1.868 12.763 1.00 . A A . 19 CYS HB3 1 1 5 1583 1 1 19 CYS N N 0.160 2.996 12.297 1.00 . A A . 19 CYS N 1 1 5 1584 1 1 19 CYS O O -2.347 4.718 12.702 1.00 . A A . 19 CYS O 1 1 5 1585 1 1 19 CYS SG S -1.337 0.150 13.083 1.00 . A A . 19 CYS SG 1 1 5 1586 1 1 20 LYS C C -4.152 5.493 9.858 1.00 . A A . 20 LYS C 1 1 5 1587 1 1 20 LYS CA C -2.668 5.742 10.138 1.00 . A A . 20 LYS CA 1 1 5 1588 1 1 20 LYS CB C -1.931 6.428 8.986 1.00 . A A . 20 LYS CB 1 1 5 1589 1 1 20 LYS CD C -1.342 8.861 9.290 1.00 . A A . 20 LYS CD 1 1 5 1590 1 1 20 LYS CE C -0.176 9.835 9.469 1.00 . A A . 20 LYS CE 1 1 5 1591 1 1 20 LYS CG C -0.889 7.416 9.513 1.00 . A A . 20 LYS CG 1 1 5 1592 1 1 20 LYS H H -1.679 3.963 9.695 1.00 . A A . 20 LYS H 1 1 5 1593 1 1 20 LYS HA H -2.586 6.395 11.007 1.00 . A A . 20 LYS HA 1 1 5 1594 1 1 20 LYS HB2 H -1.444 5.678 8.363 1.00 . A A . 20 LYS HB2 1 1 5 1595 1 1 20 LYS HB3 H -2.647 6.951 8.352 1.00 . A A . 20 LYS HB3 1 1 5 1596 1 1 20 LYS HD2 H -1.758 8.965 8.288 1.00 . A A . 20 LYS HD2 1 1 5 1597 1 1 20 LYS HD3 H -2.138 9.108 9.993 1.00 . A A . 20 LYS HD3 1 1 5 1598 1 1 20 LYS HE2 H 0.769 9.307 9.341 1.00 . A A . 20 LYS HE2 1 1 5 1599 1 1 20 LYS HE3 H -0.217 10.606 8.700 1.00 . A A . 20 LYS HE3 1 1 5 1600 1 1 20 LYS HG2 H -0.723 7.243 10.576 1.00 . A A . 20 LYS HG2 1 1 5 1601 1 1 20 LYS HG3 H 0.063 7.249 9.010 1.00 . A A . 20 LYS HG3 1 1 5 1602 1 1 20 LYS HZ1 H -0.371 9.754 11.502 1.00 . A A . 20 LYS HZ1 1 1 5 1603 1 1 20 LYS HZ2 H 0.642 10.928 10.990 1.00 . A A . 20 LYS HZ2 1 1 5 1604 1 1 20 LYS HZ3 H -0.973 11.121 10.842 1.00 . A A . 20 LYS HZ3 1 1 5 1605 1 1 20 LYS N N -2.026 4.484 10.476 1.00 . A A . 20 LYS N 1 1 5 1606 1 1 20 LYS NZ N -0.223 10.460 10.809 1.00 . A A . 20 LYS NZ 1 1 5 1607 1 1 20 LYS O O -4.570 4.351 9.679 1.00 . A A . 20 LYS O 1 1 5 1608 1 1 21 PRO C C -6.631 6.250 8.091 1.00 . A A . 21 PRO C 1 1 5 1609 1 1 21 PRO CA C -6.355 6.524 9.571 1.00 . A A . 21 PRO CA 1 1 5 1610 1 1 21 PRO CB C -6.921 7.853 10.044 1.00 . A A . 21 PRO CB 1 1 5 1611 1 1 21 PRO CD C -4.467 7.980 10.035 1.00 . A A . 21 PRO CD 1 1 5 1612 1 1 21 PRO CG C -5.740 8.807 10.116 1.00 . A A . 21 PRO CG 1 1 5 1613 1 1 21 PRO HA H -6.751 5.753 10.070 1.00 . A A . 21 PRO HA 1 1 5 1614 1 1 21 PRO HB2 H -7.680 8.221 9.355 1.00 . A A . 21 PRO HB2 1 1 5 1615 1 1 21 PRO HB3 H -7.399 7.749 11.018 1.00 . A A . 21 PRO HB3 1 1 5 1616 1 1 21 PRO HD2 H -3.830 8.313 9.215 1.00 . A A . 21 PRO HD2 1 1 5 1617 1 1 21 PRO HD3 H -3.880 8.066 10.949 1.00 . A A . 21 PRO HD3 1 1 5 1618 1 1 21 PRO HG2 H -5.780 9.527 9.298 1.00 . A A . 21 PRO HG2 1 1 5 1619 1 1 21 PRO HG3 H -5.766 9.377 11.044 1.00 . A A . 21 PRO HG3 1 1 5 1620 1 1 21 PRO N N -4.927 6.611 9.827 1.00 . A A . 21 PRO N 1 1 5 1621 1 1 21 PRO O O -5.899 6.721 7.222 1.00 . A A . 21 PRO O 1 1 5 1622 1 1 22 THR C C -9.232 6.028 6.025 1.00 . A A . 22 THR C 1 1 5 1623 1 1 22 THR CA C -8.070 5.147 6.490 1.00 . A A . 22 THR CA 1 1 5 1624 1 1 22 THR CB C -8.389 3.652 6.451 1.00 . A A . 22 THR CB 1 1 5 1625 1 1 22 THR CG2 C -8.349 3.081 5.032 1.00 . A A . 22 THR CG2 1 1 5 1626 1 1 22 THR H H -8.280 5.111 8.563 1.00 . A A . 22 THR H 1 1 5 1627 1 1 22 THR HA H -7.226 5.358 5.834 1.00 . A A . 22 THR HA 1 1 5 1628 1 1 22 THR HB H -9.347 3.445 6.927 1.00 . A A . 22 THR HB 1 1 5 1629 1 1 22 THR HG1 H -6.469 3.089 6.513 1.00 . A A . 22 THR HG1 1 1 5 1630 1 1 22 THR HG21 H -7.400 3.341 4.563 1.00 . A A . 22 THR HG21 1 1 5 1631 1 1 22 THR HG22 H -8.450 1.997 5.073 1.00 . A A . 22 THR HG22 1 1 5 1632 1 1 22 THR HG23 H -9.169 3.500 4.449 1.00 . A A . 22 THR HG23 1 1 5 1633 1 1 22 THR N N -7.689 5.489 7.850 1.00 . A A . 22 THR N 1 1 5 1634 1 1 22 THR O O -9.799 5.800 4.957 1.00 . A A . 22 THR O 1 1 5 1635 1 1 22 THR OG1 O -7.277 3.043 7.100 1.00 . A A . 22 THR OG1 1 1 5 1636 1 1 23 PHE C C -10.664 8.253 5.038 1.00 . A A . 23 PHE C 1 1 5 1637 1 1 23 PHE CA C -10.633 7.933 6.534 1.00 . A A . 23 PHE CA 1 1 5 1638 1 1 23 PHE CB C -10.368 9.222 7.314 1.00 . A A . 23 PHE CB 1 1 5 1639 1 1 23 PHE CD1 C -10.746 7.965 9.446 1.00 . A A . 23 PHE CD1 1 1 5 1640 1 1 23 PHE CD2 C -9.353 9.864 9.511 1.00 . A A . 23 PHE CD2 1 1 5 1641 1 1 23 PHE CE1 C -10.542 7.768 10.837 1.00 . A A . 23 PHE CE1 1 1 5 1642 1 1 23 PHE CE2 C -9.149 9.666 10.902 1.00 . A A . 23 PHE CE2 1 1 5 1643 1 1 23 PHE CG C -10.148 9.010 8.812 1.00 . A A . 23 PHE CG 1 1 5 1644 1 1 23 PHE CZ C -9.747 8.622 11.535 1.00 . A A . 23 PHE CZ 1 1 5 1645 1 1 23 PHE H H -9.083 7.195 7.714 1.00 . A A . 23 PHE H 1 1 5 1646 1 1 23 PHE HA H -11.564 7.443 6.818 1.00 . A A . 23 PHE HA 1 1 5 1647 1 1 23 PHE HB2 H -9.491 9.715 6.894 1.00 . A A . 23 PHE HB2 1 1 5 1648 1 1 23 PHE HB3 H -11.212 9.899 7.173 1.00 . A A . 23 PHE HB3 1 1 5 1649 1 1 23 PHE HD1 H -11.383 7.280 8.886 1.00 . A A . 23 PHE HD1 1 1 5 1650 1 1 23 PHE HD2 H -8.874 10.700 9.003 1.00 . A A . 23 PHE HD2 1 1 5 1651 1 1 23 PHE HE1 H -11.022 6.931 11.345 1.00 . A A . 23 PHE HE1 1 1 5 1652 1 1 23 PHE HE2 H -8.512 10.351 11.462 1.00 . A A . 23 PHE HE2 1 1 5 1653 1 1 23 PHE HZ H -9.590 8.470 12.604 1.00 . A A . 23 PHE HZ 1 1 5 1654 1 1 23 PHE N N -9.550 7.017 6.848 1.00 . A A . 23 PHE N 1 1 5 1655 1 1 23 PHE O O -9.633 8.566 4.445 1.00 . A A . 23 PHE O 1 1 6 1656 1 1 1 GLU C C -5.498 -12.299 13.871 1.00 . A A . 1 GLU C 1 1 6 1657 1 1 1 GLU CA C -6.182 -13.210 14.893 1.00 . A A . 1 GLU CA 1 1 6 1658 1 1 1 GLU CB C -5.169 -13.768 15.894 1.00 . A A . 1 GLU CB 1 1 6 1659 1 1 1 GLU CD C -4.477 -13.771 18.319 1.00 . A A . 1 GLU CD 1 1 6 1660 1 1 1 GLU CG C -5.616 -13.502 17.332 1.00 . A A . 1 GLU CG 1 1 6 1661 1 1 1 GLU HA H -6.947 -12.652 15.432 1.00 . A A . 1 GLU HA 1 1 6 1662 1 1 1 GLU HB2 H -5.051 -14.840 15.738 1.00 . A A . 1 GLU HB2 1 1 6 1663 1 1 1 GLU HB3 H -4.193 -13.313 15.722 1.00 . A A . 1 GLU HB3 1 1 6 1664 1 1 1 GLU HG2 H -5.948 -12.468 17.428 1.00 . A A . 1 GLU HG2 1 1 6 1665 1 1 1 GLU HG3 H -6.469 -14.135 17.575 1.00 . A A . 1 GLU HG3 1 1 6 1666 1 1 1 GLU N N -6.891 -14.282 14.216 1.00 . A A . 1 GLU N 1 1 6 1667 1 1 1 GLU O O -4.348 -12.528 13.501 1.00 . A A . 1 GLU O 1 1 6 1668 1 1 1 GLU OE1 O -3.759 -14.770 18.098 1.00 . A A . 1 GLU OE1 1 1 6 1669 1 1 1 GLU OE2 O -4.351 -12.972 19.272 1.00 . A A . 1 GLU OE2 1 1 6 1670 1 1 2 ASN C C -4.612 -9.502 13.120 1.00 . A A . 2 ASN C 1 1 6 1671 1 1 2 ASN CA C -5.717 -10.338 12.472 1.00 . A A . 2 ASN CA 1 1 6 1672 1 1 2 ASN CB C -6.812 -9.384 11.992 1.00 . A A . 2 ASN CB 1 1 6 1673 1 1 2 ASN CG C -7.930 -10.146 11.279 1.00 . A A . 2 ASN CG 1 1 6 1674 1 1 2 ASN H H -7.171 -11.105 13.751 1.00 . A A . 2 ASN H 1 1 6 1675 1 1 2 ASN HA H -5.349 -10.949 11.648 1.00 . A A . 2 ASN HA 1 1 6 1676 1 1 2 ASN HB2 H -7.224 -8.840 12.842 1.00 . A A . 2 ASN HB2 1 1 6 1677 1 1 2 ASN HB3 H -6.384 -8.643 11.318 1.00 . A A . 2 ASN HB3 1 1 6 1678 1 1 2 ASN HD21 H -9.227 -9.450 12.667 1.00 . A A . 2 ASN HD21 1 1 6 1679 1 1 2 ASN HD22 H -9.921 -10.473 11.454 1.00 . A A . 2 ASN HD22 1 1 6 1680 1 1 2 ASN N N -6.236 -11.284 13.445 1.00 . A A . 2 ASN N 1 1 6 1681 1 1 2 ASN ND2 N -9.125 -10.013 11.846 1.00 . A A . 2 ASN ND2 1 1 6 1682 1 1 2 ASN O O -4.669 -9.211 14.314 1.00 . A A . 2 ASN O 1 1 6 1683 1 1 2 ASN OD1 O -7.721 -10.813 10.278 1.00 . A A . 2 ASN OD1 1 1 6 1684 1 1 3 PHE C C -1.663 -7.837 11.619 1.00 . A A . 3 PHE C 1 1 6 1685 1 1 3 PHE CA C -2.516 -8.342 12.785 1.00 . A A . 3 PHE CA 1 1 6 1686 1 1 3 PHE CB C -1.662 -9.255 13.668 1.00 . A A . 3 PHE CB 1 1 6 1687 1 1 3 PHE CD1 C -1.121 -7.518 15.388 1.00 . A A . 3 PHE CD1 1 1 6 1688 1 1 3 PHE CD2 C 0.645 -8.827 14.542 1.00 . A A . 3 PHE CD2 1 1 6 1689 1 1 3 PHE CE1 C -0.205 -6.821 16.222 1.00 . A A . 3 PHE CE1 1 1 6 1690 1 1 3 PHE CE2 C 1.560 -8.132 15.376 1.00 . A A . 3 PHE CE2 1 1 6 1691 1 1 3 PHE CG C -0.675 -8.505 14.566 1.00 . A A . 3 PHE CG 1 1 6 1692 1 1 3 PHE CZ C 1.116 -7.144 16.198 1.00 . A A . 3 PHE CZ 1 1 6 1693 1 1 3 PHE H H -3.594 -9.381 11.335 1.00 . A A . 3 PHE H 1 1 6 1694 1 1 3 PHE HA H -2.933 -7.492 13.323 1.00 . A A . 3 PHE HA 1 1 6 1695 1 1 3 PHE HB2 H -2.320 -9.858 14.293 1.00 . A A . 3 PHE HB2 1 1 6 1696 1 1 3 PHE HB3 H -1.106 -9.943 13.031 1.00 . A A . 3 PHE HB3 1 1 6 1697 1 1 3 PHE HD1 H -2.179 -7.259 15.407 1.00 . A A . 3 PHE HD1 1 1 6 1698 1 1 3 PHE HD2 H 1.001 -9.619 13.883 1.00 . A A . 3 PHE HD2 1 1 6 1699 1 1 3 PHE HE1 H -0.562 -6.029 16.880 1.00 . A A . 3 PHE HE1 1 1 6 1700 1 1 3 PHE HE2 H 2.619 -8.390 15.357 1.00 . A A . 3 PHE HE2 1 1 6 1701 1 1 3 PHE HZ H 1.819 -6.609 16.838 1.00 . A A . 3 PHE HZ 1 1 6 1702 1 1 3 PHE N N -3.632 -9.139 12.306 1.00 . A A . 3 PHE N 1 1 6 1703 1 1 3 PHE O O -0.748 -8.526 11.169 1.00 . A A . 3 PHE O 1 1 6 1704 1 1 4 ASN C C -0.373 -4.912 10.596 1.00 . A A . 4 ASN C 1 1 6 1705 1 1 4 ASN CA C -1.268 -6.031 10.060 1.00 . A A . 4 ASN CA 1 1 6 1706 1 1 4 ASN CB C -2.230 -5.419 9.040 1.00 . A A . 4 ASN CB 1 1 6 1707 1 1 4 ASN CG C -3.374 -4.682 9.739 1.00 . A A . 4 ASN CG 1 1 6 1708 1 1 4 ASN H H -2.737 -6.083 11.536 1.00 . A A . 4 ASN H 1 1 6 1709 1 1 4 ASN HA H -0.697 -6.844 9.612 1.00 . A A . 4 ASN HA 1 1 6 1710 1 1 4 ASN HB2 H -1.689 -4.728 8.393 1.00 . A A . 4 ASN HB2 1 1 6 1711 1 1 4 ASN HB3 H -2.635 -6.203 8.400 1.00 . A A . 4 ASN HB3 1 1 6 1712 1 1 4 ASN HD21 H -2.818 -2.994 8.769 1.00 . A A . 4 ASN HD21 1 1 6 1713 1 1 4 ASN HD22 H -4.183 -2.828 9.822 1.00 . A A . 4 ASN HD22 1 1 6 1714 1 1 4 ASN N N -1.992 -6.637 11.164 1.00 . A A . 4 ASN N 1 1 6 1715 1 1 4 ASN ND2 N -3.466 -3.395 9.416 1.00 . A A . 4 ASN ND2 1 1 6 1716 1 1 4 ASN O O -0.487 -3.763 10.171 1.00 . A A . 4 ASN O 1 1 6 1717 1 1 4 ASN OD1 O -4.125 -5.245 10.520 1.00 . A A . 4 ASN OD1 1 1 6 1718 1 1 5 GLY C C 1.053 -4.069 13.585 1.00 . A A . 5 GLY C 1 1 6 1719 1 1 5 GLY CA C 1.412 -4.329 12.121 1.00 . A A . 5 GLY CA 1 1 6 1720 1 1 5 GLY H H 0.584 -6.222 11.863 1.00 . A A . 5 GLY H 1 1 6 1721 1 1 5 GLY HA2 H 2.432 -4.705 12.054 1.00 . A A . 5 GLY HA2 1 1 6 1722 1 1 5 GLY HA3 H 1.380 -3.393 11.563 1.00 . A A . 5 GLY HA3 1 1 6 1723 1 1 5 GLY N N 0.497 -5.286 11.522 1.00 . A A . 5 GLY N 1 1 6 1724 1 1 5 GLY O O 1.935 -3.964 14.435 1.00 . A A . 5 GLY O 1 1 6 1725 1 1 6 GLY C C -1.643 -2.501 15.220 1.00 . A A . 6 GLY C 1 1 6 1726 1 1 6 GLY CA C -0.732 -3.729 15.182 1.00 . A A . 6 GLY CA 1 1 6 1727 1 1 6 GLY H H -0.957 -4.062 13.138 1.00 . A A . 6 GLY H 1 1 6 1728 1 1 6 GLY HA2 H -1.278 -4.603 15.540 1.00 . A A . 6 GLY HA2 1 1 6 1729 1 1 6 GLY HA3 H 0.112 -3.582 15.856 1.00 . A A . 6 GLY HA3 1 1 6 1730 1 1 6 GLY N N -0.245 -3.974 13.834 1.00 . A A . 6 GLY N 1 1 6 1731 1 1 6 GLY O O -1.395 -1.562 15.976 1.00 . A A . 6 GLY O 1 1 6 1732 1 1 7 CYS C C -4.842 -1.808 15.188 1.00 . A A . 7 CYS C 1 1 6 1733 1 1 7 CYS CA C -3.629 -1.449 14.327 1.00 . A A . 7 CYS CA 1 1 6 1734 1 1 7 CYS CB C -4.027 -1.137 12.883 1.00 . A A . 7 CYS CB 1 1 6 1735 1 1 7 CYS H H -2.876 -3.314 13.785 1.00 . A A . 7 CYS H 1 1 6 1736 1 1 7 CYS HA H -3.121 -0.570 14.722 1.00 . A A . 7 CYS HA 1 1 6 1737 1 1 7 CYS HB2 H -4.472 -2.028 12.442 1.00 . A A . 7 CYS HB2 1 1 6 1738 1 1 7 CYS HB3 H -4.800 -0.368 12.893 1.00 . A A . 7 CYS HB3 1 1 6 1739 1 1 7 CYS N N -2.680 -2.547 14.396 1.00 . A A . 7 CYS N 1 1 6 1740 1 1 7 CYS O O -4.898 -2.891 15.767 1.00 . A A . 7 CYS O 1 1 6 1741 1 1 7 CYS SG S -2.654 -0.574 11.813 1.00 . A A . 7 CYS SG 1 1 6 1742 1 1 8 LEU C C -8.046 -1.770 15.156 1.00 . A A . 8 LEU C 1 1 6 1743 1 1 8 LEU CA C -6.991 -1.081 16.027 1.00 . A A . 8 LEU CA 1 1 6 1744 1 1 8 LEU CB C -7.465 0.240 16.636 1.00 . A A . 8 LEU CB 1 1 6 1745 1 1 8 LEU CD1 C -8.835 -0.881 18.432 1.00 . A A . 8 LEU CD1 1 1 6 1746 1 1 8 LEU CD2 C -9.179 1.577 17.913 1.00 . A A . 8 LEU CD2 1 1 6 1747 1 1 8 LEU CG C -8.817 0.201 17.351 1.00 . A A . 8 LEU CG 1 1 6 1748 1 1 8 LEU H H -5.730 0.002 14.771 1.00 . A A . 8 LEU H 1 1 6 1749 1 1 8 LEU HA H -6.738 -1.745 16.852 1.00 . A A . 8 LEU HA 1 1 6 1750 1 1 8 LEU HB2 H -6.710 0.581 17.345 1.00 . A A . 8 LEU HB2 1 1 6 1751 1 1 8 LEU HB3 H -7.517 0.985 15.843 1.00 . A A . 8 LEU HB3 1 1 6 1752 1 1 8 LEU HD11 H -8.419 -1.805 18.028 1.00 . A A . 8 LEU HD11 1 1 6 1753 1 1 8 LEU HD12 H -8.238 -0.556 19.283 1.00 . A A . 8 LEU HD12 1 1 6 1754 1 1 8 LEU HD13 H -9.862 -1.056 18.754 1.00 . A A . 8 LEU HD13 1 1 6 1755 1 1 8 LEU HD21 H -8.514 2.329 17.490 1.00 . A A . 8 LEU HD21 1 1 6 1756 1 1 8 LEU HD22 H -10.210 1.817 17.652 1.00 . A A . 8 LEU HD22 1 1 6 1757 1 1 8 LEU HD23 H -9.072 1.567 18.998 1.00 . A A . 8 LEU HD23 1 1 6 1758 1 1 8 LEU HG H -9.583 -0.060 16.621 1.00 . A A . 8 LEU HG 1 1 6 1759 1 1 8 LEU N N -5.783 -0.877 15.246 1.00 . A A . 8 LEU N 1 1 6 1760 1 1 8 LEU O O -8.561 -2.826 15.520 1.00 . A A . 8 LEU O 1 1 6 1761 1 1 9 ALA C C -9.770 -0.579 12.144 1.00 . A A . 9 ALA C 1 1 6 1762 1 1 9 ALA CA C -9.316 -1.684 13.100 1.00 . A A . 9 ALA CA 1 1 6 1763 1 1 9 ALA CB C -10.480 -2.288 13.889 1.00 . A A . 9 ALA CB 1 1 6 1764 1 1 9 ALA H H -7.909 -0.286 13.736 1.00 . A A . 9 ALA H 1 1 6 1765 1 1 9 ALA HA H -8.833 -2.475 12.527 1.00 . A A . 9 ALA HA 1 1 6 1766 1 1 9 ALA HB1 H -10.501 -1.861 14.891 1.00 . A A . 9 ALA HB1 1 1 6 1767 1 1 9 ALA HB2 H -11.417 -2.065 13.379 1.00 . A A . 9 ALA HB2 1 1 6 1768 1 1 9 ALA HB3 H -10.351 -3.368 13.957 1.00 . A A . 9 ALA HB3 1 1 6 1769 1 1 9 ALA N N -8.333 -1.144 14.025 1.00 . A A . 9 ALA N 1 1 6 1770 1 1 9 ALA O O -10.525 0.311 12.531 1.00 . A A . 9 ALA O 1 1 6 1771 1 1 10 GLY C C -8.415 1.133 9.492 1.00 . A A . 10 GLY C 1 1 6 1772 1 1 10 GLY CA C -9.638 0.307 9.897 1.00 . A A . 10 GLY CA 1 1 6 1773 1 1 10 GLY H H -8.677 -1.401 10.605 1.00 . A A . 10 GLY H 1 1 6 1774 1 1 10 GLY HA2 H -10.045 -0.199 9.022 1.00 . A A . 10 GLY HA2 1 1 6 1775 1 1 10 GLY HA3 H -10.418 0.966 10.276 1.00 . A A . 10 GLY HA3 1 1 6 1776 1 1 10 GLY N N -9.290 -0.673 10.912 1.00 . A A . 10 GLY N 1 1 6 1777 1 1 10 GLY O O -8.274 1.510 8.329 1.00 . A A . 10 GLY O 1 1 6 1778 1 1 11 TYR C C -5.441 1.458 9.235 1.00 . A A . 11 TYR C 1 1 6 1779 1 1 11 TYR CA C -6.358 2.166 10.235 1.00 . A A . 11 TYR CA 1 1 6 1780 1 1 11 TYR CB C -5.644 2.263 11.584 1.00 . A A . 11 TYR CB 1 1 6 1781 1 1 11 TYR CD1 C -6.443 4.484 12.469 1.00 . A A . 11 TYR CD1 1 1 6 1782 1 1 11 TYR CD2 C -6.989 2.511 13.702 1.00 . A A . 11 TYR CD2 1 1 6 1783 1 1 11 TYR CE1 C -7.139 5.286 13.443 1.00 . A A . 11 TYR CE1 1 1 6 1784 1 1 11 TYR CE2 C -7.685 3.311 14.676 1.00 . A A . 11 TYR CE2 1 1 6 1785 1 1 11 TYR CG C -6.383 3.114 12.619 1.00 . A A . 11 TYR CG 1 1 6 1786 1 1 11 TYR CZ C -7.725 4.659 14.498 1.00 . A A . 11 TYR CZ 1 1 6 1787 1 1 11 TYR H H -7.687 1.081 11.416 1.00 . A A . 11 TYR H 1 1 6 1788 1 1 11 TYR HA H -6.655 3.131 9.823 1.00 . A A . 11 TYR HA 1 1 6 1789 1 1 11 TYR HB2 H -5.508 1.258 11.985 1.00 . A A . 11 TYR HB2 1 1 6 1790 1 1 11 TYR HB3 H -4.650 2.682 11.428 1.00 . A A . 11 TYR HB3 1 1 6 1791 1 1 11 TYR HD1 H -5.965 4.961 11.613 1.00 . A A . 11 TYR HD1 1 1 6 1792 1 1 11 TYR HD2 H -6.942 1.428 13.820 1.00 . A A . 11 TYR HD2 1 1 6 1793 1 1 11 TYR HE1 H -7.194 6.369 13.336 1.00 . A A . 11 TYR HE1 1 1 6 1794 1 1 11 TYR HE2 H -8.168 2.849 15.536 1.00 . A A . 11 TYR HE2 1 1 6 1795 1 1 11 TYR HH H -9.300 5.635 15.088 1.00 . A A . 11 TYR HH 1 1 6 1796 1 1 11 TYR N N -7.563 1.391 10.474 1.00 . A A . 11 TYR N 1 1 6 1797 1 1 11 TYR O O -5.508 0.239 9.082 1.00 . A A . 11 TYR O 1 1 6 1798 1 1 11 TYR OH O -8.382 5.416 15.418 1.00 . A A . 11 TYR OH 1 1 6 1799 1 1 12 MET C C -2.230 1.847 8.088 1.00 . A A . 12 MET C 1 1 6 1800 1 1 12 MET CA C -3.675 1.716 7.602 1.00 . A A . 12 MET CA 1 1 6 1801 1 1 12 MET CB C -3.839 2.467 6.280 1.00 . A A . 12 MET CB 1 1 6 1802 1 1 12 MET CE C -3.143 6.489 5.897 1.00 . A A . 12 MET CE 1 1 6 1803 1 1 12 MET CG C -4.006 3.969 6.519 1.00 . A A . 12 MET CG 1 1 6 1804 1 1 12 MET H H -4.557 3.241 8.713 1.00 . A A . 12 MET H 1 1 6 1805 1 1 12 MET HA H -3.936 0.663 7.496 1.00 . A A . 12 MET HA 1 1 6 1806 1 1 12 MET HB2 H -2.968 2.291 5.647 1.00 . A A . 12 MET HB2 1 1 6 1807 1 1 12 MET HB3 H -4.705 2.082 5.743 1.00 . A A . 12 MET HB3 1 1 6 1808 1 1 12 MET HE1 H -3.785 6.557 6.775 1.00 . A A . 12 MET HE1 1 1 6 1809 1 1 12 MET HE2 H -2.104 6.624 6.196 1.00 . A A . 12 MET HE2 1 1 6 1810 1 1 12 MET HE3 H -3.421 7.264 5.183 1.00 . A A . 12 MET HE3 1 1 6 1811 1 1 12 MET HG2 H -5.061 4.210 6.650 1.00 . A A . 12 MET HG2 1 1 6 1812 1 1 12 MET HG3 H -3.496 4.258 7.438 1.00 . A A . 12 MET HG3 1 1 6 1813 1 1 12 MET N N -4.605 2.252 8.582 1.00 . A A . 12 MET N 1 1 6 1814 1 1 12 MET O O -1.933 2.680 8.943 1.00 . A A . 12 MET O 1 1 6 1815 1 1 12 MET SD S -3.340 4.885 5.139 1.00 . A A . 12 MET SD 1 1 6 1816 1 1 13 ARG C C 0.849 1.792 6.843 1.00 . A A . 13 ARG C 1 1 6 1817 1 1 13 ARG CA C 0.036 1.025 7.889 1.00 . A A . 13 ARG CA 1 1 6 1818 1 1 13 ARG CB C 0.587 -0.397 8.011 1.00 . A A . 13 ARG CB 1 1 6 1819 1 1 13 ARG CD C 1.974 -1.229 6.076 1.00 . A A . 13 ARG CD 1 1 6 1820 1 1 13 ARG CG C 0.564 -1.112 6.658 1.00 . A A . 13 ARG CG 1 1 6 1821 1 1 13 ARG CZ C 3.477 -3.147 5.553 1.00 . A A . 13 ARG CZ 1 1 6 1822 1 1 13 ARG H H -1.621 0.336 6.830 1.00 . A A . 13 ARG H 1 1 6 1823 1 1 13 ARG HA H 0.068 1.527 8.856 1.00 . A A . 13 ARG HA 1 1 6 1824 1 1 13 ARG HB2 H 1.608 -0.364 8.391 1.00 . A A . 13 ARG HB2 1 1 6 1825 1 1 13 ARG HB3 H -0.004 -0.959 8.733 1.00 . A A . 13 ARG HB3 1 1 6 1826 1 1 13 ARG HD2 H 2.072 -0.580 5.206 1.00 . A A . 13 ARG HD2 1 1 6 1827 1 1 13 ARG HD3 H 2.708 -0.894 6.808 1.00 . A A . 13 ARG HD3 1 1 6 1828 1 1 13 ARG HE H 1.466 -3.234 5.528 1.00 . A A . 13 ARG HE 1 1 6 1829 1 1 13 ARG HG2 H 0.131 -2.105 6.775 1.00 . A A . 13 ARG HG2 1 1 6 1830 1 1 13 ARG HG3 H -0.075 -0.565 5.965 1.00 . A A . 13 ARG HG3 1 1 6 1831 1 1 13 ARG HH11 H 4.439 -1.419 6.026 1.00 . A A . 13 ARG HH11 1 1 6 1832 1 1 13 ARG HH12 H 5.471 -2.761 5.660 1.00 . A A . 13 ARG HH12 1 1 6 1833 1 1 13 ARG HH21 H 2.827 -5.006 5.045 1.00 . A A . 13 ARG HH21 1 1 6 1834 1 1 13 ARG HH22 H 4.548 -4.815 5.099 1.00 . A A . 13 ARG HH22 1 1 6 1835 1 1 13 ARG N N -1.370 1.012 7.524 1.00 . A A . 13 ARG N 1 1 6 1836 1 1 13 ARG NE N 2.248 -2.632 5.693 1.00 . A A . 13 ARG NE 1 1 6 1837 1 1 13 ARG NH1 N 4.553 -2.377 5.765 1.00 . A A . 13 ARG NH1 1 1 6 1838 1 1 13 ARG NH2 N 3.630 -4.431 5.203 1.00 . A A . 13 ARG NH2 1 1 6 1839 1 1 13 ARG O O 1.067 1.298 5.738 1.00 . A A . 13 ARG O 1 1 6 1840 1 1 14 THR C C 3.339 3.102 5.917 1.00 . A A . 14 THR C 1 1 6 1841 1 1 14 THR CA C 2.058 3.824 6.339 1.00 . A A . 14 THR CA 1 1 6 1842 1 1 14 THR CB C 2.316 5.155 7.049 1.00 . A A . 14 THR CB 1 1 6 1843 1 1 14 THR CG2 C 1.073 5.688 7.764 1.00 . A A . 14 THR CG2 1 1 6 1844 1 1 14 THR H H 1.091 3.380 8.130 1.00 . A A . 14 THR H 1 1 6 1845 1 1 14 THR HA H 1.477 4.002 5.434 1.00 . A A . 14 THR HA 1 1 6 1846 1 1 14 THR HB H 2.713 5.895 6.355 1.00 . A A . 14 THR HB 1 1 6 1847 1 1 14 THR HG1 H 2.869 4.012 8.596 1.00 . A A . 14 THR HG1 1 1 6 1848 1 1 14 THR HG21 H 0.221 5.046 7.539 1.00 . A A . 14 THR HG21 1 1 6 1849 1 1 14 THR HG22 H 1.247 5.695 8.840 1.00 . A A . 14 THR HG22 1 1 6 1850 1 1 14 THR HG23 H 0.864 6.702 7.424 1.00 . A A . 14 THR HG23 1 1 6 1851 1 1 14 THR N N 1.274 2.985 7.230 1.00 . A A . 14 THR N 1 1 6 1852 1 1 14 THR O O 3.386 1.874 5.898 1.00 . A A . 14 THR O 1 1 6 1853 1 1 14 THR OG1 O 3.207 4.817 8.108 1.00 . A A . 14 THR OG1 1 1 6 1854 1 1 15 ALA C C 6.557 3.254 6.378 1.00 . A A . 15 ALA C 1 1 6 1855 1 1 15 ALA CA C 5.625 3.349 5.169 1.00 . A A . 15 ALA CA 1 1 6 1856 1 1 15 ALA CB C 6.209 4.215 4.050 1.00 . A A . 15 ALA CB 1 1 6 1857 1 1 15 ALA H H 4.301 4.896 5.608 1.00 . A A . 15 ALA H 1 1 6 1858 1 1 15 ALA HA H 5.445 2.347 4.779 1.00 . A A . 15 ALA HA 1 1 6 1859 1 1 15 ALA HB1 H 5.413 4.506 3.363 1.00 . A A . 15 ALA HB1 1 1 6 1860 1 1 15 ALA HB2 H 6.662 5.108 4.480 1.00 . A A . 15 ALA HB2 1 1 6 1861 1 1 15 ALA HB3 H 6.966 3.647 3.509 1.00 . A A . 15 ALA HB3 1 1 6 1862 1 1 15 ALA N N 4.347 3.897 5.589 1.00 . A A . 15 ALA N 1 1 6 1863 1 1 15 ALA O O 7.720 2.873 6.243 1.00 . A A . 15 ALA O 1 1 6 1864 1 1 16 ASP C C 6.127 2.579 9.735 1.00 . A A . 16 ASP C 1 1 6 1865 1 1 16 ASP CA C 6.781 3.566 8.766 1.00 . A A . 16 ASP CA 1 1 6 1866 1 1 16 ASP CB C 6.815 4.939 9.440 1.00 . A A . 16 ASP CB 1 1 6 1867 1 1 16 ASP CG C 8.198 5.587 9.516 1.00 . A A . 16 ASP CG 1 1 6 1868 1 1 16 ASP H H 5.068 3.916 7.634 1.00 . A A . 16 ASP H 1 1 6 1869 1 1 16 ASP HA H 7.783 3.257 8.469 1.00 . A A . 16 ASP HA 1 1 6 1870 1 1 16 ASP HB2 H 6.145 5.608 8.900 1.00 . A A . 16 ASP HB2 1 1 6 1871 1 1 16 ASP HB3 H 6.420 4.840 10.451 1.00 . A A . 16 ASP HB3 1 1 6 1872 1 1 16 ASP N N 6.013 3.607 7.533 1.00 . A A . 16 ASP N 1 1 6 1873 1 1 16 ASP O O 6.693 2.263 10.781 1.00 . A A . 16 ASP O 1 1 6 1874 1 1 16 ASP OD1 O 8.879 5.598 8.468 1.00 . A A . 16 ASP OD1 1 1 6 1875 1 1 16 ASP OD2 O 8.544 6.059 10.621 1.00 . A A . 16 ASP OD2 1 1 6 1876 1 1 17 GLY C C 3.177 1.895 11.047 1.00 . A A . 17 GLY C 1 1 6 1877 1 1 17 GLY CA C 4.208 1.175 10.177 1.00 . A A . 17 GLY CA 1 1 6 1878 1 1 17 GLY H H 4.492 2.381 8.502 1.00 . A A . 17 GLY H 1 1 6 1879 1 1 17 GLY HA2 H 3.706 0.446 9.539 1.00 . A A . 17 GLY HA2 1 1 6 1880 1 1 17 GLY HA3 H 4.901 0.621 10.810 1.00 . A A . 17 GLY HA3 1 1 6 1881 1 1 17 GLY N N 4.945 2.119 9.354 1.00 . A A . 17 GLY N 1 1 6 1882 1 1 17 GLY O O 2.359 1.254 11.707 1.00 . A A . 17 GLY O 1 1 6 1883 1 1 18 ARG C C 0.889 3.789 11.346 1.00 . A A . 18 ARG C 1 1 6 1884 1 1 18 ARG CA C 2.330 4.032 11.799 1.00 . A A . 18 ARG CA 1 1 6 1885 1 1 18 ARG CB C 2.657 5.520 11.657 1.00 . A A . 18 ARG CB 1 1 6 1886 1 1 18 ARG CD C 4.360 7.137 12.576 1.00 . A A . 18 ARG CD 1 1 6 1887 1 1 18 ARG CG C 4.145 5.780 11.904 1.00 . A A . 18 ARG CG 1 1 6 1888 1 1 18 ARG CZ C 4.957 8.483 10.566 1.00 . A A . 18 ARG CZ 1 1 6 1889 1 1 18 ARG H H 3.915 3.731 10.482 1.00 . A A . 18 ARG H 1 1 6 1890 1 1 18 ARG HA H 2.476 3.710 12.830 1.00 . A A . 18 ARG HA 1 1 6 1891 1 1 18 ARG HB2 H 2.385 5.862 10.658 1.00 . A A . 18 ARG HB2 1 1 6 1892 1 1 18 ARG HB3 H 2.061 6.097 12.364 1.00 . A A . 18 ARG HB3 1 1 6 1893 1 1 18 ARG HD2 H 3.404 7.648 12.698 1.00 . A A . 18 ARG HD2 1 1 6 1894 1 1 18 ARG HD3 H 4.775 6.996 13.574 1.00 . A A . 18 ARG HD3 1 1 6 1895 1 1 18 ARG HE H 6.187 8.154 12.125 1.00 . A A . 18 ARG HE 1 1 6 1896 1 1 18 ARG HG2 H 4.556 4.990 12.532 1.00 . A A . 18 ARG HG2 1 1 6 1897 1 1 18 ARG HG3 H 4.685 5.749 10.957 1.00 . A A . 18 ARG HG3 1 1 6 1898 1 1 18 ARG HH11 H 3.078 7.706 10.539 1.00 . A A . 18 ARG HH11 1 1 6 1899 1 1 18 ARG HH12 H 3.509 8.644 9.148 1.00 . A A . 18 ARG HH12 1 1 6 1900 1 1 18 ARG HH21 H 6.756 9.391 10.290 1.00 . A A . 18 ARG HH21 1 1 6 1901 1 1 18 ARG HH22 H 5.614 9.609 9.005 1.00 . A A . 18 ARG HH22 1 1 6 1902 1 1 18 ARG N N 3.247 3.218 11.021 1.00 . A A . 18 ARG N 1 1 6 1903 1 1 18 ARG NE N 5.275 7.967 11.761 1.00 . A A . 18 ARG NE 1 1 6 1904 1 1 18 ARG NH1 N 3.746 8.258 10.040 1.00 . A A . 18 ARG NH1 1 1 6 1905 1 1 18 ARG NH2 N 5.851 9.224 9.897 1.00 . A A . 18 ARG NH2 1 1 6 1906 1 1 18 ARG O O 0.507 4.178 10.244 1.00 . A A . 18 ARG O 1 1 6 1907 1 1 19 CYS C C -2.026 4.168 11.814 1.00 . A A . 19 CYS C 1 1 6 1908 1 1 19 CYS CA C -1.263 2.846 11.924 1.00 . A A . 19 CYS CA 1 1 6 1909 1 1 19 CYS CB C -1.878 1.917 12.973 1.00 . A A . 19 CYS CB 1 1 6 1910 1 1 19 CYS H H 0.446 2.832 13.115 1.00 . A A . 19 CYS H 1 1 6 1911 1 1 19 CYS HA H -1.272 2.313 10.973 1.00 . A A . 19 CYS HA 1 1 6 1912 1 1 19 CYS HB2 H -1.767 2.377 13.954 1.00 . A A . 19 CYS HB2 1 1 6 1913 1 1 19 CYS HB3 H -2.947 1.831 12.779 1.00 . A A . 19 CYS HB3 1 1 6 1914 1 1 19 CYS N N 0.127 3.145 12.220 1.00 . A A . 19 CYS N 1 1 6 1915 1 1 19 CYS O O -2.471 4.717 12.821 1.00 . A A . 19 CYS O 1 1 6 1916 1 1 19 CYS SG S -1.155 0.237 13.027 1.00 . A A . 19 CYS SG 1 1 6 1917 1 1 20 LYS C C -4.313 5.582 9.970 1.00 . A A . 20 LYS C 1 1 6 1918 1 1 20 LYS CA C -2.857 5.885 10.328 1.00 . A A . 20 LYS CA 1 1 6 1919 1 1 20 LYS CB C -2.122 6.707 9.268 1.00 . A A . 20 LYS CB 1 1 6 1920 1 1 20 LYS CD C -0.113 8.232 9.276 1.00 . A A . 20 LYS CD 1 1 6 1921 1 1 20 LYS CE C 0.437 9.579 9.750 1.00 . A A . 20 LYS CE 1 1 6 1922 1 1 20 LYS CG C -1.490 7.957 9.884 1.00 . A A . 20 LYS CG 1 1 6 1923 1 1 20 LYS H H -1.791 4.185 9.769 1.00 . A A . 20 LYS H 1 1 6 1924 1 1 20 LYS HA H -2.841 6.464 11.252 1.00 . A A . 20 LYS HA 1 1 6 1925 1 1 20 LYS HB2 H -1.349 6.097 8.800 1.00 . A A . 20 LYS HB2 1 1 6 1926 1 1 20 LYS HB3 H -2.817 6.998 8.480 1.00 . A A . 20 LYS HB3 1 1 6 1927 1 1 20 LYS HD2 H 0.577 7.435 9.555 1.00 . A A . 20 LYS HD2 1 1 6 1928 1 1 20 LYS HD3 H -0.183 8.226 8.188 1.00 . A A . 20 LYS HD3 1 1 6 1929 1 1 20 LYS HE2 H -0.385 10.229 10.048 1.00 . A A . 20 LYS HE2 1 1 6 1930 1 1 20 LYS HE3 H 1.064 9.433 10.629 1.00 . A A . 20 LYS HE3 1 1 6 1931 1 1 20 LYS HG2 H -2.141 8.816 9.721 1.00 . A A . 20 LYS HG2 1 1 6 1932 1 1 20 LYS HG3 H -1.396 7.828 10.962 1.00 . A A . 20 LYS HG3 1 1 6 1933 1 1 20 LYS HZ1 H 0.673 10.272 7.841 1.00 . A A . 20 LYS HZ1 1 1 6 1934 1 1 20 LYS HZ2 H 1.480 11.148 8.958 1.00 . A A . 20 LYS HZ2 1 1 6 1935 1 1 20 LYS HZ3 H 2.049 9.689 8.498 1.00 . A A . 20 LYS HZ3 1 1 6 1936 1 1 20 LYS N N -2.155 4.639 10.583 1.00 . A A . 20 LYS N 1 1 6 1937 1 1 20 LYS NZ N 1.223 10.224 8.675 1.00 . A A . 20 LYS NZ 1 1 6 1938 1 1 20 LYS O O -4.687 4.422 9.803 1.00 . A A . 20 LYS O 1 1 6 1939 1 1 21 PRO C C -6.707 6.211 8.044 1.00 . A A . 21 PRO C 1 1 6 1940 1 1 21 PRO CA C -6.525 6.536 9.528 1.00 . A A . 21 PRO CA 1 1 6 1941 1 1 21 PRO CB C -7.155 7.860 9.927 1.00 . A A . 21 PRO CB 1 1 6 1942 1 1 21 PRO CD C -4.709 8.063 10.052 1.00 . A A . 21 PRO CD 1 1 6 1943 1 1 21 PRO CG C -6.008 8.852 10.036 1.00 . A A . 21 PRO CG 1 1 6 1944 1 1 21 PRO HA H -6.926 5.769 10.027 1.00 . A A . 21 PRO HA 1 1 6 1945 1 1 21 PRO HB2 H -7.884 8.185 9.185 1.00 . A A . 21 PRO HB2 1 1 6 1946 1 1 21 PRO HB3 H -7.684 7.770 10.876 1.00 . A A . 21 PRO HB3 1 1 6 1947 1 1 21 PRO HD2 H -4.037 8.390 9.259 1.00 . A A . 21 PRO HD2 1 1 6 1948 1 1 21 PRO HD3 H -4.178 8.194 10.995 1.00 . A A . 21 PRO HD3 1 1 6 1949 1 1 21 PRO HG2 H -6.022 9.546 9.194 1.00 . A A . 21 PRO HG2 1 1 6 1950 1 1 21 PRO HG3 H -6.104 9.449 10.942 1.00 . A A . 21 PRO HG3 1 1 6 1951 1 1 21 PRO N N -5.118 6.674 9.861 1.00 . A A . 21 PRO N 1 1 6 1952 1 1 21 PRO O O -5.935 6.670 7.204 1.00 . A A . 21 PRO O 1 1 6 1953 1 1 22 THR C C -9.312 5.704 5.914 1.00 . A A . 22 THR C 1 1 6 1954 1 1 22 THR CA C -8.028 5.028 6.398 1.00 . A A . 22 THR CA 1 1 6 1955 1 1 22 THR CB C -8.089 3.500 6.347 1.00 . A A . 22 THR CB 1 1 6 1956 1 1 22 THR CG2 C -7.925 2.954 4.928 1.00 . A A . 22 THR CG2 1 1 6 1957 1 1 22 THR H H -8.358 5.052 8.455 1.00 . A A . 22 THR H 1 1 6 1958 1 1 22 THR HA H -7.220 5.381 5.758 1.00 . A A . 22 THR HA 1 1 6 1959 1 1 22 THR HB H -9.009 3.132 6.802 1.00 . A A . 22 THR HB 1 1 6 1960 1 1 22 THR HG1 H -6.791 3.599 7.869 1.00 . A A . 22 THR HG1 1 1 6 1961 1 1 22 THR HG21 H -8.424 3.619 4.223 1.00 . A A . 22 THR HG21 1 1 6 1962 1 1 22 THR HG22 H -6.864 2.895 4.681 1.00 . A A . 22 THR HG22 1 1 6 1963 1 1 22 THR HG23 H -8.367 1.961 4.867 1.00 . A A . 22 THR HG23 1 1 6 1964 1 1 22 THR N N -7.734 5.421 7.767 1.00 . A A . 22 THR N 1 1 6 1965 1 1 22 THR O O -9.814 5.390 4.835 1.00 . A A . 22 THR O 1 1 6 1966 1 1 22 THR OG1 O -6.903 3.082 7.019 1.00 . A A . 22 THR OG1 1 1 6 1967 1 1 23 PHE C C -10.704 8.742 5.880 1.00 . A A . 23 PHE C 1 1 6 1968 1 1 23 PHE CA C -11.024 7.341 6.404 1.00 . A A . 23 PHE CA 1 1 6 1969 1 1 23 PHE CB C -11.836 7.465 7.694 1.00 . A A . 23 PHE CB 1 1 6 1970 1 1 23 PHE CD1 C -10.631 9.340 8.836 1.00 . A A . 23 PHE CD1 1 1 6 1971 1 1 23 PHE CD2 C -10.768 7.270 9.951 1.00 . A A . 23 PHE CD2 1 1 6 1972 1 1 23 PHE CE1 C -9.900 9.880 9.928 1.00 . A A . 23 PHE CE1 1 1 6 1973 1 1 23 PHE CE2 C -10.037 7.809 11.043 1.00 . A A . 23 PHE CE2 1 1 6 1974 1 1 23 PHE CG C -11.049 8.046 8.871 1.00 . A A . 23 PHE CG 1 1 6 1975 1 1 23 PHE CZ C -9.619 9.103 11.007 1.00 . A A . 23 PHE CZ 1 1 6 1976 1 1 23 PHE H H -9.394 6.866 7.610 1.00 . A A . 23 PHE H 1 1 6 1977 1 1 23 PHE HA H -11.537 6.773 5.628 1.00 . A A . 23 PHE HA 1 1 6 1978 1 1 23 PHE HB2 H -12.706 8.095 7.505 1.00 . A A . 23 PHE HB2 1 1 6 1979 1 1 23 PHE HB3 H -12.210 6.480 7.973 1.00 . A A . 23 PHE HB3 1 1 6 1980 1 1 23 PHE HD1 H -10.856 9.962 7.970 1.00 . A A . 23 PHE HD1 1 1 6 1981 1 1 23 PHE HD2 H -11.103 6.233 9.979 1.00 . A A . 23 PHE HD2 1 1 6 1982 1 1 23 PHE HE1 H -9.565 10.917 9.900 1.00 . A A . 23 PHE HE1 1 1 6 1983 1 1 23 PHE HE2 H -9.812 7.187 11.909 1.00 . A A . 23 PHE HE2 1 1 6 1984 1 1 23 PHE HZ H -9.058 9.517 11.846 1.00 . A A . 23 PHE HZ 1 1 6 1985 1 1 23 PHE N N -9.807 6.618 6.735 1.00 . A A . 23 PHE N 1 1 6 1986 1 1 23 PHE O O -9.755 8.921 5.116 1.00 . A A . 23 PHE O 1 1 7 1987 1 1 1 GLU C C -7.869 -12.712 14.497 1.00 . A A . 1 GLU C 1 1 7 1988 1 1 1 GLU CA C -8.877 -12.866 15.639 1.00 . A A . 1 GLU CA 1 1 7 1989 1 1 1 GLU CB C -8.231 -13.535 16.853 1.00 . A A . 1 GLU CB 1 1 7 1990 1 1 1 GLU CD C -7.689 -12.676 19.161 1.00 . A A . 1 GLU CD 1 1 7 1991 1 1 1 GLU CG C -7.412 -12.529 17.664 1.00 . A A . 1 GLU CG 1 1 7 1992 1 1 1 GLU HA H -9.257 -11.887 15.931 1.00 . A A . 1 GLU HA 1 1 7 1993 1 1 1 GLU HB2 H -9.004 -13.974 17.485 1.00 . A A . 1 GLU HB2 1 1 7 1994 1 1 1 GLU HB3 H -7.588 -14.352 16.524 1.00 . A A . 1 GLU HB3 1 1 7 1995 1 1 1 GLU HG2 H -6.350 -12.678 17.470 1.00 . A A . 1 GLU HG2 1 1 7 1996 1 1 1 GLU HG3 H -7.655 -11.515 17.343 1.00 . A A . 1 GLU HG3 1 1 7 1997 1 1 1 GLU N N -10.038 -13.613 15.188 1.00 . A A . 1 GLU N 1 1 7 1998 1 1 1 GLU O O -7.159 -13.658 14.160 1.00 . A A . 1 GLU O 1 1 7 1999 1 1 1 GLU OE1 O -7.741 -13.839 19.617 1.00 . A A . 1 GLU OE1 1 1 7 2000 1 1 1 GLU OE2 O -7.842 -11.623 19.817 1.00 . A A . 1 GLU OE2 1 1 7 2001 1 1 2 ASN C C -6.191 -9.915 13.125 1.00 . A A . 2 ASN C 1 1 7 2002 1 1 2 ASN CA C -6.931 -11.223 12.838 1.00 . A A . 2 ASN CA 1 1 7 2003 1 1 2 ASN CB C -7.693 -11.056 11.521 1.00 . A A . 2 ASN CB 1 1 7 2004 1 1 2 ASN CG C -7.258 -12.109 10.499 1.00 . A A . 2 ASN CG 1 1 7 2005 1 1 2 ASN H H -8.419 -10.748 14.215 1.00 . A A . 2 ASN H 1 1 7 2006 1 1 2 ASN HA H -6.259 -12.081 12.788 1.00 . A A . 2 ASN HA 1 1 7 2007 1 1 2 ASN HB2 H -8.764 -11.142 11.703 1.00 . A A . 2 ASN HB2 1 1 7 2008 1 1 2 ASN HB3 H -7.516 -10.059 11.118 1.00 . A A . 2 ASN HB3 1 1 7 2009 1 1 2 ASN HD21 H -6.223 -10.667 9.524 1.00 . A A . 2 ASN HD21 1 1 7 2010 1 1 2 ASN HD22 H -6.139 -12.245 8.818 1.00 . A A . 2 ASN HD22 1 1 7 2011 1 1 2 ASN N N -7.839 -11.513 13.934 1.00 . A A . 2 ASN N 1 1 7 2012 1 1 2 ASN ND2 N -6.476 -11.634 9.534 1.00 . A A . 2 ASN ND2 1 1 7 2013 1 1 2 ASN O O -6.591 -9.152 14.002 1.00 . A A . 2 ASN O 1 1 7 2014 1 1 2 ASN OD1 O -7.610 -13.274 10.581 1.00 . A A . 2 ASN OD1 1 1 7 2015 1 1 3 PHE C C -3.885 -7.942 11.174 1.00 . A A . 3 PHE C 1 1 7 2016 1 1 3 PHE CA C -4.326 -8.495 12.531 1.00 . A A . 3 PHE CA 1 1 7 2017 1 1 3 PHE CB C -3.086 -8.887 13.337 1.00 . A A . 3 PHE CB 1 1 7 2018 1 1 3 PHE CD1 C -3.060 -6.934 14.904 1.00 . A A . 3 PHE CD1 1 1 7 2019 1 1 3 PHE CD2 C -2.980 -9.099 15.830 1.00 . A A . 3 PHE CD2 1 1 7 2020 1 1 3 PHE CE1 C -3.018 -6.375 16.208 1.00 . A A . 3 PHE CE1 1 1 7 2021 1 1 3 PHE CE2 C -2.938 -8.539 17.134 1.00 . A A . 3 PHE CE2 1 1 7 2022 1 1 3 PHE CG C -3.040 -8.285 14.742 1.00 . A A . 3 PHE CG 1 1 7 2023 1 1 3 PHE CZ C -2.957 -7.190 17.296 1.00 . A A . 3 PHE CZ 1 1 7 2024 1 1 3 PHE H H -4.806 -10.324 11.657 1.00 . A A . 3 PHE H 1 1 7 2025 1 1 3 PHE HA H -4.950 -7.757 13.036 1.00 . A A . 3 PHE HA 1 1 7 2026 1 1 3 PHE HB2 H -3.046 -9.973 13.416 1.00 . A A . 3 PHE HB2 1 1 7 2027 1 1 3 PHE HB3 H -2.196 -8.575 12.790 1.00 . A A . 3 PHE HB3 1 1 7 2028 1 1 3 PHE HD1 H -3.109 -6.281 14.032 1.00 . A A . 3 PHE HD1 1 1 7 2029 1 1 3 PHE HD2 H -2.964 -10.181 15.699 1.00 . A A . 3 PHE HD2 1 1 7 2030 1 1 3 PHE HE1 H -3.034 -5.293 16.339 1.00 . A A . 3 PHE HE1 1 1 7 2031 1 1 3 PHE HE2 H -2.889 -9.192 18.005 1.00 . A A . 3 PHE HE2 1 1 7 2032 1 1 3 PHE HZ H -2.925 -6.760 18.297 1.00 . A A . 3 PHE HZ 1 1 7 2033 1 1 3 PHE N N -5.126 -9.697 12.368 1.00 . A A . 3 PHE N 1 1 7 2034 1 1 3 PHE O O -4.122 -8.563 10.140 1.00 . A A . 3 PHE O 1 1 7 2035 1 1 4 ASN C C -1.539 -5.294 10.336 1.00 . A A . 4 ASN C 1 1 7 2036 1 1 4 ASN CA C -2.773 -6.137 10.009 1.00 . A A . 4 ASN CA 1 1 7 2037 1 1 4 ASN CB C -3.838 -5.207 9.424 1.00 . A A . 4 ASN CB 1 1 7 2038 1 1 4 ASN CG C -3.317 -4.494 8.175 1.00 . A A . 4 ASN CG 1 1 7 2039 1 1 4 ASN H H -3.061 -6.280 12.068 1.00 . A A . 4 ASN H 1 1 7 2040 1 1 4 ASN HA H -2.552 -6.952 9.321 1.00 . A A . 4 ASN HA 1 1 7 2041 1 1 4 ASN HB2 H -4.729 -5.783 9.173 1.00 . A A . 4 ASN HB2 1 1 7 2042 1 1 4 ASN HB3 H -4.133 -4.471 10.171 1.00 . A A . 4 ASN HB3 1 1 7 2043 1 1 4 ASN HD21 H -3.541 -2.732 9.145 1.00 . A A . 4 ASN HD21 1 1 7 2044 1 1 4 ASN HD22 H -2.928 -2.615 7.530 1.00 . A A . 4 ASN HD22 1 1 7 2045 1 1 4 ASN N N -3.250 -6.780 11.223 1.00 . A A . 4 ASN N 1 1 7 2046 1 1 4 ASN ND2 N -3.257 -3.171 8.293 1.00 . A A . 4 ASN ND2 1 1 7 2047 1 1 4 ASN O O -1.459 -4.128 9.955 1.00 . A A . 4 ASN O 1 1 7 2048 1 1 4 ASN OD1 O -2.989 -5.105 7.172 1.00 . A A . 4 ASN OD1 1 1 7 2049 1 1 5 GLY C C 0.591 -4.840 12.897 1.00 . A A . 5 GLY C 1 1 7 2050 1 1 5 GLY CA C 0.623 -5.242 11.422 1.00 . A A . 5 GLY CA 1 1 7 2051 1 1 5 GLY H H -0.677 -6.868 11.346 1.00 . A A . 5 GLY H 1 1 7 2052 1 1 5 GLY HA2 H 1.475 -5.894 11.236 1.00 . A A . 5 GLY HA2 1 1 7 2053 1 1 5 GLY HA3 H 0.761 -4.355 10.802 1.00 . A A . 5 GLY HA3 1 1 7 2054 1 1 5 GLY N N -0.605 -5.919 11.039 1.00 . A A . 5 GLY N 1 1 7 2055 1 1 5 GLY O O 1.610 -4.898 13.583 1.00 . A A . 5 GLY O 1 1 7 2056 1 1 6 GLY C C -1.573 -2.730 14.812 1.00 . A A . 6 GLY C 1 1 7 2057 1 1 6 GLY CA C -0.770 -4.030 14.726 1.00 . A A . 6 GLY CA 1 1 7 2058 1 1 6 GLY H H -1.416 -4.397 12.780 1.00 . A A . 6 GLY H 1 1 7 2059 1 1 6 GLY HA2 H -1.283 -4.817 15.280 1.00 . A A . 6 GLY HA2 1 1 7 2060 1 1 6 GLY HA3 H 0.204 -3.892 15.197 1.00 . A A . 6 GLY HA3 1 1 7 2061 1 1 6 GLY N N -0.591 -4.441 13.344 1.00 . A A . 6 GLY N 1 1 7 2062 1 1 6 GLY O O -1.100 -1.740 15.370 1.00 . A A . 6 GLY O 1 1 7 2063 1 1 7 CYS C C -4.858 -1.929 15.139 1.00 . A A . 7 CYS C 1 1 7 2064 1 1 7 CYS CA C -3.647 -1.614 14.259 1.00 . A A . 7 CYS CA 1 1 7 2065 1 1 7 CYS CB C -4.059 -1.209 12.843 1.00 . A A . 7 CYS CB 1 1 7 2066 1 1 7 CYS H H -3.149 -3.584 13.801 1.00 . A A . 7 CYS H 1 1 7 2067 1 1 7 CYS HA H -3.067 -0.790 14.677 1.00 . A A . 7 CYS HA 1 1 7 2068 1 1 7 CYS HB2 H -4.334 -2.107 12.289 1.00 . A A . 7 CYS HB2 1 1 7 2069 1 1 7 CYS HB3 H -4.952 -0.586 12.904 1.00 . A A . 7 CYS HB3 1 1 7 2070 1 1 7 CYS N N -2.773 -2.776 14.252 1.00 . A A . 7 CYS N 1 1 7 2071 1 1 7 CYS O O -4.958 -3.021 15.695 1.00 . A A . 7 CYS O 1 1 7 2072 1 1 7 CYS SG S -2.778 -0.307 11.898 1.00 . A A . 7 CYS SG 1 1 7 2073 1 1 8 LEU C C -8.040 -1.765 15.192 1.00 . A A . 8 LEU C 1 1 7 2074 1 1 8 LEU CA C -6.947 -1.111 16.040 1.00 . A A . 8 LEU CA 1 1 7 2075 1 1 8 LEU CB C -7.363 0.227 16.653 1.00 . A A . 8 LEU CB 1 1 7 2076 1 1 8 LEU CD1 C -8.782 -0.912 18.399 1.00 . A A . 8 LEU CD1 1 1 7 2077 1 1 8 LEU CD2 C -8.951 1.595 18.055 1.00 . A A . 8 LEU CD2 1 1 7 2078 1 1 8 LEU CG C -8.702 0.238 17.395 1.00 . A A . 8 LEU CG 1 1 7 2079 1 1 8 LEU H H -5.658 -0.067 14.781 1.00 . A A . 8 LEU H 1 1 7 2080 1 1 8 LEU HA H -6.703 -1.782 16.864 1.00 . A A . 8 LEU HA 1 1 7 2081 1 1 8 LEU HB2 H -6.584 0.544 17.347 1.00 . A A . 8 LEU HB2 1 1 7 2082 1 1 8 LEU HB3 H -7.404 0.971 15.859 1.00 . A A . 8 LEU HB3 1 1 7 2083 1 1 8 LEU HD11 H -8.495 -1.843 17.910 1.00 . A A . 8 LEU HD11 1 1 7 2084 1 1 8 LEU HD12 H -8.106 -0.716 19.232 1.00 . A A . 8 LEU HD12 1 1 7 2085 1 1 8 LEU HD13 H -9.802 -0.999 18.773 1.00 . A A . 8 LEU HD13 1 1 7 2086 1 1 8 LEU HD21 H -8.373 2.362 17.541 1.00 . A A . 8 LEU HD21 1 1 7 2087 1 1 8 LEU HD22 H -10.012 1.839 17.996 1.00 . A A . 8 LEU HD22 1 1 7 2088 1 1 8 LEU HD23 H -8.647 1.551 19.101 1.00 . A A . 8 LEU HD23 1 1 7 2089 1 1 8 LEU HG H -9.497 0.085 16.666 1.00 . A A . 8 LEU HG 1 1 7 2090 1 1 8 LEU N N -5.747 -0.952 15.237 1.00 . A A . 8 LEU N 1 1 7 2091 1 1 8 LEU O O -8.584 -2.803 15.565 1.00 . A A . 8 LEU O 1 1 7 2092 1 1 9 ALA C C -9.788 -0.516 12.217 1.00 . A A . 9 ALA C 1 1 7 2093 1 1 9 ALA CA C -9.348 -1.636 13.161 1.00 . A A . 9 ALA CA 1 1 7 2094 1 1 9 ALA CB C -10.514 -2.206 13.972 1.00 . A A . 9 ALA CB 1 1 7 2095 1 1 9 ALA H H -7.884 -0.286 13.769 1.00 . A A . 9 ALA H 1 1 7 2096 1 1 9 ALA HA H -8.902 -2.440 12.575 1.00 . A A . 9 ALA HA 1 1 7 2097 1 1 9 ALA HB1 H -10.469 -1.822 14.991 1.00 . A A . 9 ALA HB1 1 1 7 2098 1 1 9 ALA HB2 H -11.456 -1.909 13.512 1.00 . A A . 9 ALA HB2 1 1 7 2099 1 1 9 ALA HB3 H -10.446 -3.294 13.990 1.00 . A A . 9 ALA HB3 1 1 7 2100 1 1 9 ALA N N -8.330 -1.129 14.066 1.00 . A A . 9 ALA N 1 1 7 2101 1 1 9 ALA O O -10.596 0.333 12.588 1.00 . A A . 9 ALA O 1 1 7 2102 1 1 10 GLY C C -8.313 1.228 9.586 1.00 . A A . 10 GLY C 1 1 7 2103 1 1 10 GLY CA C -9.560 0.452 10.011 1.00 . A A . 10 GLY CA 1 1 7 2104 1 1 10 GLY H H -8.579 -1.244 10.718 1.00 . A A . 10 GLY H 1 1 7 2105 1 1 10 GLY HA2 H -10.007 -0.030 9.142 1.00 . A A . 10 GLY HA2 1 1 7 2106 1 1 10 GLY HA3 H -10.304 1.142 10.410 1.00 . A A . 10 GLY HA3 1 1 7 2107 1 1 10 GLY N N -9.236 -0.550 11.011 1.00 . A A . 10 GLY N 1 1 7 2108 1 1 10 GLY O O -8.155 1.564 8.414 1.00 . A A . 10 GLY O 1 1 7 2109 1 1 11 TYR C C -5.370 1.499 9.266 1.00 . A A . 11 TYR C 1 1 7 2110 1 1 11 TYR CA C -6.228 2.221 10.306 1.00 . A A . 11 TYR CA 1 1 7 2111 1 1 11 TYR CB C -5.472 2.258 11.636 1.00 . A A . 11 TYR CB 1 1 7 2112 1 1 11 TYR CD1 C -6.238 4.498 12.506 1.00 . A A . 11 TYR CD1 1 1 7 2113 1 1 11 TYR CD2 C -6.623 2.565 13.859 1.00 . A A . 11 TYR CD2 1 1 7 2114 1 1 11 TYR CE1 C -6.859 5.324 13.509 1.00 . A A . 11 TYR CE1 1 1 7 2115 1 1 11 TYR CE2 C -7.244 3.391 14.861 1.00 . A A . 11 TYR CE2 1 1 7 2116 1 1 11 TYR CG C -6.132 3.136 12.702 1.00 . A A . 11 TYR CG 1 1 7 2117 1 1 11 TYR CZ C -7.331 4.730 14.637 1.00 . A A . 11 TYR CZ 1 1 7 2118 1 1 11 TYR H H -7.593 1.214 11.515 1.00 . A A . 11 TYR H 1 1 7 2119 1 1 11 TYR HA H -6.495 3.206 9.924 1.00 . A A . 11 TYR HA 1 1 7 2120 1 1 11 TYR HB2 H -5.384 1.242 12.021 1.00 . A A . 11 TYR HB2 1 1 7 2121 1 1 11 TYR HB3 H -4.460 2.621 11.457 1.00 . A A . 11 TYR HB3 1 1 7 2122 1 1 11 TYR HD1 H -5.851 4.949 11.592 1.00 . A A . 11 TYR HD1 1 1 7 2123 1 1 11 TYR HD2 H -6.540 1.489 14.013 1.00 . A A . 11 TYR HD2 1 1 7 2124 1 1 11 TYR HE1 H -6.949 6.401 13.366 1.00 . A A . 11 TYR HE1 1 1 7 2125 1 1 11 TYR HE2 H -7.635 2.954 15.780 1.00 . A A . 11 TYR HE2 1 1 7 2126 1 1 11 TYR HH H -7.669 5.185 16.497 1.00 . A A . 11 TYR HH 1 1 7 2127 1 1 11 TYR N N -7.457 1.491 10.563 1.00 . A A . 11 TYR N 1 1 7 2128 1 1 11 TYR O O -5.479 0.285 9.099 1.00 . A A . 11 TYR O 1 1 7 2129 1 1 11 TYR OH O -7.918 5.509 15.584 1.00 . A A . 11 TYR OH 1 1 7 2130 1 1 12 MET C C -2.198 1.742 8.038 1.00 . A A . 12 MET C 1 1 7 2131 1 1 12 MET CA C -3.656 1.726 7.573 1.00 . A A . 12 MET CA 1 1 7 2132 1 1 12 MET CB C -3.792 2.543 6.287 1.00 . A A . 12 MET CB 1 1 7 2133 1 1 12 MET CE C -2.972 6.567 5.958 1.00 . A A . 12 MET CE 1 1 7 2134 1 1 12 MET CG C -3.813 4.042 6.590 1.00 . A A . 12 MET CG 1 1 7 2135 1 1 12 MET H H -4.450 3.262 8.735 1.00 . A A . 12 MET H 1 1 7 2136 1 1 12 MET HA H -3.986 0.697 7.427 1.00 . A A . 12 MET HA 1 1 7 2137 1 1 12 MET HB2 H -2.962 2.315 5.619 1.00 . A A . 12 MET HB2 1 1 7 2138 1 1 12 MET HB3 H -4.707 2.261 5.767 1.00 . A A . 12 MET HB3 1 1 7 2139 1 1 12 MET HE1 H -3.809 6.743 6.634 1.00 . A A . 12 MET HE1 1 1 7 2140 1 1 12 MET HE2 H -2.037 6.613 6.515 1.00 . A A . 12 MET HE2 1 1 7 2141 1 1 12 MET HE3 H -2.968 7.330 5.179 1.00 . A A . 12 MET HE3 1 1 7 2142 1 1 12 MET HG2 H -4.834 4.368 6.790 1.00 . A A . 12 MET HG2 1 1 7 2143 1 1 12 MET HG3 H -3.232 4.249 7.491 1.00 . A A . 12 MET HG3 1 1 7 2144 1 1 12 MET N N -4.533 2.276 8.592 1.00 . A A . 12 MET N 1 1 7 2145 1 1 12 MET O O -1.846 2.470 8.964 1.00 . A A . 12 MET O 1 1 7 2146 1 1 12 MET SD S -3.142 4.954 5.211 1.00 . A A . 12 MET SD 1 1 7 2147 1 1 13 ARG C C 0.843 1.748 6.785 1.00 . A A . 13 ARG C 1 1 7 2148 1 1 13 ARG CA C 0.023 0.843 7.706 1.00 . A A . 13 ARG CA 1 1 7 2149 1 1 13 ARG CB C 0.530 -0.595 7.580 1.00 . A A . 13 ARG CB 1 1 7 2150 1 1 13 ARG CD C 2.246 -1.889 8.900 1.00 . A A . 13 ARG CD 1 1 7 2151 1 1 13 ARG CG C 0.897 -1.169 8.950 1.00 . A A . 13 ARG CG 1 1 7 2152 1 1 13 ARG CZ C 3.867 -2.758 10.581 1.00 . A A . 13 ARG CZ 1 1 7 2153 1 1 13 ARG H H -1.682 0.342 6.620 1.00 . A A . 13 ARG H 1 1 7 2154 1 1 13 ARG HA H 0.086 1.176 8.742 1.00 . A A . 13 ARG HA 1 1 7 2155 1 1 13 ARG HB2 H -0.236 -1.215 7.115 1.00 . A A . 13 ARG HB2 1 1 7 2156 1 1 13 ARG HB3 H 1.402 -0.621 6.926 1.00 . A A . 13 ARG HB3 1 1 7 2157 1 1 13 ARG HD2 H 2.179 -2.758 8.246 1.00 . A A . 13 ARG HD2 1 1 7 2158 1 1 13 ARG HD3 H 3.004 -1.230 8.478 1.00 . A A . 13 ARG HD3 1 1 7 2159 1 1 13 ARG HE H 1.960 -2.259 10.988 1.00 . A A . 13 ARG HE 1 1 7 2160 1 1 13 ARG HG2 H 0.936 -0.366 9.686 1.00 . A A . 13 ARG HG2 1 1 7 2161 1 1 13 ARG HG3 H 0.122 -1.863 9.277 1.00 . A A . 13 ARG HG3 1 1 7 2162 1 1 13 ARG HH11 H 4.613 -2.575 8.698 1.00 . A A . 13 ARG HH11 1 1 7 2163 1 1 13 ARG HH12 H 5.729 -3.178 9.878 1.00 . A A . 13 ARG HH12 1 1 7 2164 1 1 13 ARG HH21 H 3.432 -3.054 12.545 1.00 . A A . 13 ARG HH21 1 1 7 2165 1 1 13 ARG HH22 H 5.052 -3.453 12.081 1.00 . A A . 13 ARG HH22 1 1 7 2166 1 1 13 ARG N N -1.389 0.931 7.372 1.00 . A A . 13 ARG N 1 1 7 2167 1 1 13 ARG NE N 2.645 -2.311 10.261 1.00 . A A . 13 ARG NE 1 1 7 2168 1 1 13 ARG NH1 N 4.817 -2.844 9.639 1.00 . A A . 13 ARG NH1 1 1 7 2169 1 1 13 ARG NH2 N 4.140 -3.119 11.842 1.00 . A A . 13 ARG NH2 1 1 7 2170 1 1 13 ARG O O 1.040 1.433 5.613 1.00 . A A . 13 ARG O 1 1 7 2171 1 1 14 THR C C 3.409 3.171 6.145 1.00 . A A . 14 THR C 1 1 7 2172 1 1 14 THR CA C 2.094 3.809 6.596 1.00 . A A . 14 THR CA 1 1 7 2173 1 1 14 THR CB C 2.289 5.054 7.463 1.00 . A A . 14 THR CB 1 1 7 2174 1 1 14 THR CG2 C 1.008 5.880 7.599 1.00 . A A . 14 THR CG2 1 1 7 2175 1 1 14 THR H H 1.137 3.105 8.306 1.00 . A A . 14 THR H 1 1 7 2176 1 1 14 THR HA H 1.544 4.077 5.693 1.00 . A A . 14 THR HA 1 1 7 2177 1 1 14 THR HB H 3.109 5.667 7.086 1.00 . A A . 14 THR HB 1 1 7 2178 1 1 14 THR HG1 H 3.421 4.787 9.091 1.00 . A A . 14 THR HG1 1 1 7 2179 1 1 14 THR HG21 H 0.145 5.215 7.592 1.00 . A A . 14 THR HG21 1 1 7 2180 1 1 14 THR HG22 H 1.032 6.436 8.536 1.00 . A A . 14 THR HG22 1 1 7 2181 1 1 14 THR HG23 H 0.937 6.579 6.764 1.00 . A A . 14 THR HG23 1 1 7 2182 1 1 14 THR N N 1.300 2.855 7.351 1.00 . A A . 14 THR N 1 1 7 2183 1 1 14 THR O O 3.579 1.956 6.242 1.00 . A A . 14 THR O 1 1 7 2184 1 1 14 THR OG1 O 2.508 4.536 8.771 1.00 . A A . 14 THR OG1 1 1 7 2185 1 1 15 ALA C C 6.525 3.338 6.400 1.00 . A A . 15 ALA C 1 1 7 2186 1 1 15 ALA CA C 5.602 3.550 5.198 1.00 . A A . 15 ALA CA 1 1 7 2187 1 1 15 ALA CB C 6.174 4.551 4.192 1.00 . A A . 15 ALA CB 1 1 7 2188 1 1 15 ALA H H 4.162 5.003 5.588 1.00 . A A . 15 ALA H 1 1 7 2189 1 1 15 ALA HA H 5.450 2.595 4.695 1.00 . A A . 15 ALA HA 1 1 7 2190 1 1 15 ALA HB1 H 5.986 5.566 4.542 1.00 . A A . 15 ALA HB1 1 1 7 2191 1 1 15 ALA HB2 H 7.249 4.393 4.095 1.00 . A A . 15 ALA HB2 1 1 7 2192 1 1 15 ALA HB3 H 5.697 4.406 3.223 1.00 . A A . 15 ALA HB3 1 1 7 2193 1 1 15 ALA N N 4.307 4.017 5.663 1.00 . A A . 15 ALA N 1 1 7 2194 1 1 15 ALA O O 7.674 2.929 6.240 1.00 . A A . 15 ALA O 1 1 7 2195 1 1 16 ASP C C 6.009 2.513 9.740 1.00 . A A . 16 ASP C 1 1 7 2196 1 1 16 ASP CA C 6.748 3.472 8.805 1.00 . A A . 16 ASP CA 1 1 7 2197 1 1 16 ASP CB C 6.905 4.811 9.528 1.00 . A A . 16 ASP CB 1 1 7 2198 1 1 16 ASP CG C 8.333 5.356 9.577 1.00 . A A . 16 ASP CG 1 1 7 2199 1 1 16 ASP H H 5.052 3.960 7.697 1.00 . A A . 16 ASP H 1 1 7 2200 1 1 16 ASP HA H 7.719 3.086 8.494 1.00 . A A . 16 ASP HA 1 1 7 2201 1 1 16 ASP HB2 H 6.268 5.548 9.038 1.00 . A A . 16 ASP HB2 1 1 7 2202 1 1 16 ASP HB3 H 6.538 4.701 10.548 1.00 . A A . 16 ASP HB3 1 1 7 2203 1 1 16 ASP N N 5.987 3.627 7.576 1.00 . A A . 16 ASP N 1 1 7 2204 1 1 16 ASP O O 6.497 2.198 10.824 1.00 . A A . 16 ASP O 1 1 7 2205 1 1 16 ASP OD1 O 9.136 4.924 8.722 1.00 . A A . 16 ASP OD1 1 1 7 2206 1 1 16 ASP OD2 O 8.591 6.193 10.470 1.00 . A A . 16 ASP OD2 1 1 7 2207 1 1 17 GLY C C 3.001 1.918 10.906 1.00 . A A . 17 GLY C 1 1 7 2208 1 1 17 GLY CA C 4.032 1.159 10.068 1.00 . A A . 17 GLY CA 1 1 7 2209 1 1 17 GLY H H 4.453 2.337 8.403 1.00 . A A . 17 GLY H 1 1 7 2210 1 1 17 GLY HA2 H 3.523 0.460 9.404 1.00 . A A . 17 GLY HA2 1 1 7 2211 1 1 17 GLY HA3 H 4.674 0.568 10.722 1.00 . A A . 17 GLY HA3 1 1 7 2212 1 1 17 GLY N N 4.843 2.077 9.286 1.00 . A A . 17 GLY N 1 1 7 2213 1 1 17 GLY O O 2.054 1.323 11.420 1.00 . A A . 17 GLY O 1 1 7 2214 1 1 18 ARG C C 0.870 3.826 11.355 1.00 . A A . 18 ARG C 1 1 7 2215 1 1 18 ARG CA C 2.319 4.066 11.783 1.00 . A A . 18 ARG CA 1 1 7 2216 1 1 18 ARG CB C 2.661 5.545 11.595 1.00 . A A . 18 ARG CB 1 1 7 2217 1 1 18 ARG CD C 4.393 7.330 12.012 1.00 . A A . 18 ARG CD 1 1 7 2218 1 1 18 ARG CG C 4.114 5.826 11.982 1.00 . A A . 18 ARG CG 1 1 7 2219 1 1 18 ARG CZ C 6.298 8.707 12.839 1.00 . A A . 18 ARG CZ 1 1 7 2220 1 1 18 ARG H H 3.991 3.696 10.597 1.00 . A A . 18 ARG H 1 1 7 2221 1 1 18 ARG HA H 2.475 3.771 12.821 1.00 . A A . 18 ARG HA 1 1 7 2222 1 1 18 ARG HB2 H 2.496 5.831 10.556 1.00 . A A . 18 ARG HB2 1 1 7 2223 1 1 18 ARG HB3 H 1.994 6.157 12.203 1.00 . A A . 18 ARG HB3 1 1 7 2224 1 1 18 ARG HD2 H 4.627 7.685 11.008 1.00 . A A . 18 ARG HD2 1 1 7 2225 1 1 18 ARG HD3 H 3.503 7.867 12.340 1.00 . A A . 18 ARG HD3 1 1 7 2226 1 1 18 ARG HE H 5.717 6.959 13.651 1.00 . A A . 18 ARG HE 1 1 7 2227 1 1 18 ARG HG2 H 4.323 5.395 12.961 1.00 . A A . 18 ARG HG2 1 1 7 2228 1 1 18 ARG HG3 H 4.784 5.342 11.271 1.00 . A A . 18 ARG HG3 1 1 7 2229 1 1 18 ARG HH11 H 5.326 9.483 11.231 1.00 . A A . 18 ARG HH11 1 1 7 2230 1 1 18 ARG HH12 H 6.653 10.429 11.818 1.00 . A A . 18 ARG HH12 1 1 7 2231 1 1 18 ARG HH21 H 7.468 8.206 14.425 1.00 . A A . 18 ARG HH21 1 1 7 2232 1 1 18 ARG HH22 H 7.880 9.698 13.647 1.00 . A A . 18 ARG HH22 1 1 7 2233 1 1 18 ARG N N 3.218 3.220 11.018 1.00 . A A . 18 ARG N 1 1 7 2234 1 1 18 ARG NE N 5.522 7.618 12.925 1.00 . A A . 18 ARG NE 1 1 7 2235 1 1 18 ARG NH1 N 6.073 9.617 11.882 1.00 . A A . 18 ARG NH1 1 1 7 2236 1 1 18 ARG NH2 N 7.300 8.885 13.711 1.00 . A A . 18 ARG NH2 1 1 7 2237 1 1 18 ARG O O 0.484 4.169 10.238 1.00 . A A . 18 ARG O 1 1 7 2238 1 1 19 CYS C C -2.030 4.273 11.809 1.00 . A A . 19 CYS C 1 1 7 2239 1 1 19 CYS CA C -1.290 2.947 11.994 1.00 . A A . 19 CYS CA 1 1 7 2240 1 1 19 CYS CB C -1.915 2.095 13.101 1.00 . A A . 19 CYS CB 1 1 7 2241 1 1 19 CYS H H 0.429 2.961 13.170 1.00 . A A . 19 CYS H 1 1 7 2242 1 1 19 CYS HA H -1.316 2.359 11.077 1.00 . A A . 19 CYS HA 1 1 7 2243 1 1 19 CYS HB2 H -1.743 2.585 14.059 1.00 . A A . 19 CYS HB2 1 1 7 2244 1 1 19 CYS HB3 H -2.994 2.062 12.949 1.00 . A A . 19 CYS HB3 1 1 7 2245 1 1 19 CYS N N 0.107 3.237 12.265 1.00 . A A . 19 CYS N 1 1 7 2246 1 1 19 CYS O O -2.462 4.888 12.783 1.00 . A A . 19 CYS O 1 1 7 2247 1 1 19 CYS SG S -1.284 0.380 13.198 1.00 . A A . 19 CYS SG 1 1 7 2248 1 1 20 LYS C C -4.296 5.620 9.892 1.00 . A A . 20 LYS C 1 1 7 2249 1 1 20 LYS CA C -2.833 5.918 10.228 1.00 . A A . 20 LYS CA 1 1 7 2250 1 1 20 LYS CB C -2.087 6.663 9.119 1.00 . A A . 20 LYS CB 1 1 7 2251 1 1 20 LYS CD C -1.133 8.932 8.570 1.00 . A A . 20 LYS CD 1 1 7 2252 1 1 20 LYS CE C -0.481 10.195 9.136 1.00 . A A . 20 LYS CE 1 1 7 2253 1 1 20 LYS CG C -1.375 7.899 9.672 1.00 . A A . 20 LYS CG 1 1 7 2254 1 1 20 LYS H H -1.797 4.170 9.766 1.00 . A A . 20 LYS H 1 1 7 2255 1 1 20 LYS HA H -2.804 6.549 11.116 1.00 . A A . 20 LYS HA 1 1 7 2256 1 1 20 LYS HB2 H -1.360 5.998 8.654 1.00 . A A . 20 LYS HB2 1 1 7 2257 1 1 20 LYS HB3 H -2.789 6.962 8.340 1.00 . A A . 20 LYS HB3 1 1 7 2258 1 1 20 LYS HD2 H -0.493 8.503 7.798 1.00 . A A . 20 LYS HD2 1 1 7 2259 1 1 20 LYS HD3 H -2.079 9.189 8.093 1.00 . A A . 20 LYS HD3 1 1 7 2260 1 1 20 LYS HE2 H -1.240 10.830 9.592 1.00 . A A . 20 LYS HE2 1 1 7 2261 1 1 20 LYS HE3 H 0.224 9.927 9.922 1.00 . A A . 20 LYS HE3 1 1 7 2262 1 1 20 LYS HG2 H -1.975 8.344 10.467 1.00 . A A . 20 LYS HG2 1 1 7 2263 1 1 20 LYS HG3 H -0.424 7.607 10.117 1.00 . A A . 20 LYS HG3 1 1 7 2264 1 1 20 LYS HZ1 H 0.925 10.359 7.661 1.00 . A A . 20 LYS HZ1 1 1 7 2265 1 1 20 LYS HZ2 H -0.437 11.208 7.361 1.00 . A A . 20 LYS HZ2 1 1 7 2266 1 1 20 LYS HZ3 H 0.645 11.759 8.453 1.00 . A A . 20 LYS HZ3 1 1 7 2267 1 1 20 LYS N N -2.153 4.676 10.552 1.00 . A A . 20 LYS N 1 1 7 2268 1 1 20 LYS NZ N 0.220 10.941 8.066 1.00 . A A . 20 LYS NZ 1 1 7 2269 1 1 20 LYS O O -4.686 4.460 9.776 1.00 . A A . 20 LYS O 1 1 7 2270 1 1 21 PRO C C -6.693 6.199 7.954 1.00 . A A . 21 PRO C 1 1 7 2271 1 1 21 PRO CA C -6.497 6.585 9.422 1.00 . A A . 21 PRO CA 1 1 7 2272 1 1 21 PRO CB C -7.108 7.933 9.769 1.00 . A A . 21 PRO CB 1 1 7 2273 1 1 21 PRO CD C -4.659 8.107 9.872 1.00 . A A . 21 PRO CD 1 1 7 2274 1 1 21 PRO CG C -5.947 8.912 9.830 1.00 . A A . 21 PRO CG 1 1 7 2275 1 1 21 PRO HA H -6.906 5.844 9.956 1.00 . A A . 21 PRO HA 1 1 7 2276 1 1 21 PRO HB2 H -7.837 8.236 9.018 1.00 . A A . 21 PRO HB2 1 1 7 2277 1 1 21 PRO HB3 H -7.633 7.890 10.723 1.00 . A A . 21 PRO HB3 1 1 7 2278 1 1 21 PRO HD2 H -3.986 8.392 9.063 1.00 . A A . 21 PRO HD2 1 1 7 2279 1 1 21 PRO HD3 H -4.121 8.270 10.806 1.00 . A A . 21 PRO HD3 1 1 7 2280 1 1 21 PRO HG2 H -5.957 9.571 8.960 1.00 . A A . 21 PRO HG2 1 1 7 2281 1 1 21 PRO HG3 H -6.029 9.547 10.711 1.00 . A A . 21 PRO HG3 1 1 7 2282 1 1 21 PRO N N -5.086 6.717 9.742 1.00 . A A . 21 PRO N 1 1 7 2283 1 1 21 PRO O O -5.953 6.658 7.085 1.00 . A A . 21 PRO O 1 1 7 2284 1 1 22 THR C C -9.342 5.472 5.915 1.00 . A A . 22 THR C 1 1 7 2285 1 1 22 THR CA C -7.996 4.911 6.376 1.00 . A A . 22 THR CA 1 1 7 2286 1 1 22 THR CB C -7.940 3.382 6.365 1.00 . A A . 22 THR CB 1 1 7 2287 1 1 22 THR CG2 C -7.721 2.814 4.962 1.00 . A A . 22 THR CG2 1 1 7 2288 1 1 22 THR H H -8.291 4.995 8.436 1.00 . A A . 22 THR H 1 1 7 2289 1 1 22 THR HA H -7.238 5.308 5.702 1.00 . A A . 22 THR HA 1 1 7 2290 1 1 22 THR HB H -8.833 2.956 6.823 1.00 . A A . 22 THR HB 1 1 7 2291 1 1 22 THR HG1 H -6.770 2.141 7.413 1.00 . A A . 22 THR HG1 1 1 7 2292 1 1 22 THR HG21 H -6.825 3.256 4.526 1.00 . A A . 22 THR HG21 1 1 7 2293 1 1 22 THR HG22 H -7.600 1.732 5.023 1.00 . A A . 22 THR HG22 1 1 7 2294 1 1 22 THR HG23 H -8.583 3.048 4.336 1.00 . A A . 22 THR HG23 1 1 7 2295 1 1 22 THR N N -7.694 5.363 7.723 1.00 . A A . 22 THR N 1 1 7 2296 1 1 22 THR O O -9.847 5.096 4.857 1.00 . A A . 22 THR O 1 1 7 2297 1 1 22 THR OG1 O -6.732 3.075 7.057 1.00 . A A . 22 THR OG1 1 1 7 2298 1 1 23 PHE C C -10.975 8.410 5.911 1.00 . A A . 23 PHE C 1 1 7 2299 1 1 23 PHE CA C -11.165 6.980 6.420 1.00 . A A . 23 PHE CA 1 1 7 2300 1 1 23 PHE CB C -11.972 7.017 7.719 1.00 . A A . 23 PHE CB 1 1 7 2301 1 1 23 PHE CD1 C -10.830 8.909 8.897 1.00 . A A . 23 PHE CD1 1 1 7 2302 1 1 23 PHE CD2 C -10.911 6.818 9.979 1.00 . A A . 23 PHE CD2 1 1 7 2303 1 1 23 PHE CE1 C -10.122 9.453 10.001 1.00 . A A . 23 PHE CE1 1 1 7 2304 1 1 23 PHE CE2 C -10.202 7.362 11.083 1.00 . A A . 23 PHE CE2 1 1 7 2305 1 1 23 PHE CG C -11.209 7.603 8.909 1.00 . A A . 23 PHE CG 1 1 7 2306 1 1 23 PHE CZ C -9.823 8.669 11.071 1.00 . A A . 23 PHE CZ 1 1 7 2307 1 1 23 PHE H H -9.470 6.663 7.589 1.00 . A A . 23 PHE H 1 1 7 2308 1 1 23 PHE HA H -11.633 6.379 5.641 1.00 . A A . 23 PHE HA 1 1 7 2309 1 1 23 PHE HB2 H -12.877 7.602 7.557 1.00 . A A . 23 PHE HB2 1 1 7 2310 1 1 23 PHE HB3 H -12.289 6.003 7.968 1.00 . A A . 23 PHE HB3 1 1 7 2311 1 1 23 PHE HD1 H -11.069 9.538 8.039 1.00 . A A . 23 PHE HD1 1 1 7 2312 1 1 23 PHE HD2 H -11.214 5.772 9.988 1.00 . A A . 23 PHE HD2 1 1 7 2313 1 1 23 PHE HE1 H -9.818 10.499 9.991 1.00 . A A . 23 PHE HE1 1 1 7 2314 1 1 23 PHE HE2 H -9.963 6.733 11.941 1.00 . A A . 23 PHE HE2 1 1 7 2315 1 1 23 PHE HZ H -9.280 9.086 11.918 1.00 . A A . 23 PHE HZ 1 1 7 2316 1 1 23 PHE N N -9.887 6.363 6.731 1.00 . A A . 23 PHE N 1 1 7 2317 1 1 23 PHE O O -11.176 8.685 4.729 1.00 . A A . 23 PHE O 1 1 8 2318 1 1 1 GLU C C 0.166 -11.761 8.965 1.00 . A A . 1 GLU C 1 1 8 2319 1 1 1 GLU CA C 1.262 -12.145 9.961 1.00 . A A . 1 GLU CA 1 1 8 2320 1 1 1 GLU CB C 2.002 -13.403 9.503 1.00 . A A . 1 GLU CB 1 1 8 2321 1 1 1 GLU CD C 4.171 -14.687 9.599 1.00 . A A . 1 GLU CD 1 1 8 2322 1 1 1 GLU CG C 3.402 -13.469 10.117 1.00 . A A . 1 GLU CG 1 1 8 2323 1 1 1 GLU HA H 1.975 -11.327 10.061 1.00 . A A . 1 GLU HA 1 1 8 2324 1 1 1 GLU HB2 H 1.434 -14.289 9.788 1.00 . A A . 1 GLU HB2 1 1 8 2325 1 1 1 GLU HB3 H 2.077 -13.410 8.416 1.00 . A A . 1 GLU HB3 1 1 8 2326 1 1 1 GLU HG2 H 3.952 -12.559 9.877 1.00 . A A . 1 GLU HG2 1 1 8 2327 1 1 1 GLU HG3 H 3.325 -13.518 11.203 1.00 . A A . 1 GLU HG3 1 1 8 2328 1 1 1 GLU N N 0.696 -12.328 11.287 1.00 . A A . 1 GLU N 1 1 8 2329 1 1 1 GLU O O -0.169 -12.539 8.073 1.00 . A A . 1 GLU O 1 1 8 2330 1 1 1 GLU OE1 O 3.984 -15.011 8.407 1.00 . A A . 1 GLU OE1 1 1 8 2331 1 1 1 GLU OE2 O 4.928 -15.266 10.408 1.00 . A A . 1 GLU OE2 1 1 8 2332 1 1 2 ASN C C -1.455 -8.536 8.357 1.00 . A A . 2 ASN C 1 1 8 2333 1 1 2 ASN CA C -1.415 -10.063 8.280 1.00 . A A . 2 ASN CA 1 1 8 2334 1 1 2 ASN CB C -2.783 -10.594 8.711 1.00 . A A . 2 ASN CB 1 1 8 2335 1 1 2 ASN CG C -3.674 -10.863 7.495 1.00 . A A . 2 ASN CG 1 1 8 2336 1 1 2 ASN H H -0.086 -9.933 9.879 1.00 . A A . 2 ASN H 1 1 8 2337 1 1 2 ASN HA H -1.156 -10.424 7.284 1.00 . A A . 2 ASN HA 1 1 8 2338 1 1 2 ASN HB2 H -2.657 -11.513 9.283 1.00 . A A . 2 ASN HB2 1 1 8 2339 1 1 2 ASN HB3 H -3.267 -9.872 9.368 1.00 . A A . 2 ASN HB3 1 1 8 2340 1 1 2 ASN HD21 H -5.034 -11.702 8.737 1.00 . A A . 2 ASN HD21 1 1 8 2341 1 1 2 ASN HD22 H -5.472 -11.685 7.061 1.00 . A A . 2 ASN HD22 1 1 8 2342 1 1 2 ASN N N -0.363 -10.561 9.151 1.00 . A A . 2 ASN N 1 1 8 2343 1 1 2 ASN ND2 N -4.822 -11.467 7.788 1.00 . A A . 2 ASN ND2 1 1 8 2344 1 1 2 ASN O O -0.795 -7.936 9.204 1.00 . A A . 2 ASN O 1 1 8 2345 1 1 2 ASN OD1 O -3.340 -10.543 6.366 1.00 . A A . 2 ASN OD1 1 1 8 2346 1 1 3 PHE C C -3.520 -6.032 8.308 1.00 . A A . 3 PHE C 1 1 8 2347 1 1 3 PHE CA C -2.369 -6.505 7.415 1.00 . A A . 3 PHE CA 1 1 8 2348 1 1 3 PHE CB C -2.678 -6.128 5.965 1.00 . A A . 3 PHE CB 1 1 8 2349 1 1 3 PHE CD1 C -2.076 -3.700 6.080 1.00 . A A . 3 PHE CD1 1 1 8 2350 1 1 3 PHE CD2 C -1.071 -5.012 4.402 1.00 . A A . 3 PHE CD2 1 1 8 2351 1 1 3 PHE CE1 C -1.366 -2.562 5.615 1.00 . A A . 3 PHE CE1 1 1 8 2352 1 1 3 PHE CE2 C -0.360 -3.874 3.937 1.00 . A A . 3 PHE CE2 1 1 8 2353 1 1 3 PHE CG C -1.913 -4.901 5.463 1.00 . A A . 3 PHE CG 1 1 8 2354 1 1 3 PHE CZ C -0.523 -2.672 4.554 1.00 . A A . 3 PHE CZ 1 1 8 2355 1 1 3 PHE H H -2.767 -8.446 6.774 1.00 . A A . 3 PHE H 1 1 8 2356 1 1 3 PHE HA H -1.433 -6.081 7.779 1.00 . A A . 3 PHE HA 1 1 8 2357 1 1 3 PHE HB2 H -2.444 -6.977 5.323 1.00 . A A . 3 PHE HB2 1 1 8 2358 1 1 3 PHE HB3 H -3.748 -5.941 5.868 1.00 . A A . 3 PHE HB3 1 1 8 2359 1 1 3 PHE HD1 H -2.751 -3.611 6.931 1.00 . A A . 3 PHE HD1 1 1 8 2360 1 1 3 PHE HD2 H -0.940 -5.975 3.907 1.00 . A A . 3 PHE HD2 1 1 8 2361 1 1 3 PHE HE1 H -1.496 -1.598 6.109 1.00 . A A . 3 PHE HE1 1 1 8 2362 1 1 3 PHE HE2 H 0.315 -3.963 3.086 1.00 . A A . 3 PHE HE2 1 1 8 2363 1 1 3 PHE HZ H 0.022 -1.799 4.196 1.00 . A A . 3 PHE HZ 1 1 8 2364 1 1 3 PHE N N -2.235 -7.950 7.459 1.00 . A A . 3 PHE N 1 1 8 2365 1 1 3 PHE O O -4.361 -5.245 7.878 1.00 . A A . 3 PHE O 1 1 8 2366 1 1 4 ASN C C -4.312 -6.928 11.800 1.00 . A A . 4 ASN C 1 1 8 2367 1 1 4 ASN CA C -4.552 -6.176 10.490 1.00 . A A . 4 ASN CA 1 1 8 2368 1 1 4 ASN CB C -5.939 -6.559 9.972 1.00 . A A . 4 ASN CB 1 1 8 2369 1 1 4 ASN CG C -6.950 -5.440 10.234 1.00 . A A . 4 ASN CG 1 1 8 2370 1 1 4 ASN H H -2.831 -7.176 9.875 1.00 . A A . 4 ASN H 1 1 8 2371 1 1 4 ASN HA H -4.469 -5.095 10.608 1.00 . A A . 4 ASN HA 1 1 8 2372 1 1 4 ASN HB2 H -5.889 -6.766 8.903 1.00 . A A . 4 ASN HB2 1 1 8 2373 1 1 4 ASN HB3 H -6.273 -7.476 10.458 1.00 . A A . 4 ASN HB3 1 1 8 2374 1 1 4 ASN HD21 H -6.710 -5.751 12.220 1.00 . A A . 4 ASN HD21 1 1 8 2375 1 1 4 ASN HD22 H -7.827 -4.498 11.796 1.00 . A A . 4 ASN HD22 1 1 8 2376 1 1 4 ASN N N -3.519 -6.535 9.533 1.00 . A A . 4 ASN N 1 1 8 2377 1 1 4 ASN ND2 N -7.182 -5.211 11.524 1.00 . A A . 4 ASN ND2 1 1 8 2378 1 1 4 ASN O O -5.258 -7.371 12.449 1.00 . A A . 4 ASN O 1 1 8 2379 1 1 4 ASN OD1 O -7.485 -4.826 9.325 1.00 . A A . 4 ASN OD1 1 1 8 2380 1 1 5 GLY C C -1.889 -6.813 14.312 1.00 . A A . 5 GLY C 1 1 8 2381 1 1 5 GLY CA C -2.663 -7.741 13.373 1.00 . A A . 5 GLY CA 1 1 8 2382 1 1 5 GLY H H -2.276 -6.686 11.618 1.00 . A A . 5 GLY H 1 1 8 2383 1 1 5 GLY HA2 H -3.557 -8.110 13.876 1.00 . A A . 5 GLY HA2 1 1 8 2384 1 1 5 GLY HA3 H -2.052 -8.610 13.129 1.00 . A A . 5 GLY HA3 1 1 8 2385 1 1 5 GLY N N -3.040 -7.049 12.152 1.00 . A A . 5 GLY N 1 1 8 2386 1 1 5 GLY O O -0.925 -7.233 14.950 1.00 . A A . 5 GLY O 1 1 8 2387 1 1 6 GLY C C -2.578 -3.333 15.362 1.00 . A A . 6 GLY C 1 1 8 2388 1 1 6 GLY CA C -1.701 -4.578 15.216 1.00 . A A . 6 GLY CA 1 1 8 2389 1 1 6 GLY H H -3.124 -5.234 13.844 1.00 . A A . 6 GLY H 1 1 8 2390 1 1 6 GLY HA2 H -1.507 -5.008 16.198 1.00 . A A . 6 GLY HA2 1 1 8 2391 1 1 6 GLY HA3 H -0.736 -4.299 14.794 1.00 . A A . 6 GLY HA3 1 1 8 2392 1 1 6 GLY N N -2.340 -5.568 14.366 1.00 . A A . 6 GLY N 1 1 8 2393 1 1 6 GLY O O -2.874 -2.905 16.477 1.00 . A A . 6 GLY O 1 1 8 2394 1 1 7 CYS C C -5.030 -1.865 15.089 1.00 . A A . 7 CYS C 1 1 8 2395 1 1 7 CYS CA C -3.808 -1.600 14.207 1.00 . A A . 7 CYS CA 1 1 8 2396 1 1 7 CYS CB C -4.207 -1.205 12.784 1.00 . A A . 7 CYS CB 1 1 8 2397 1 1 7 CYS H H -2.726 -3.142 13.317 1.00 . A A . 7 CYS H 1 1 8 2398 1 1 7 CYS HA H -3.206 -0.787 14.613 1.00 . A A . 7 CYS HA 1 1 8 2399 1 1 7 CYS HB2 H -4.611 -2.082 12.277 1.00 . A A . 7 CYS HB2 1 1 8 2400 1 1 7 CYS HB3 H -5.011 -0.470 12.837 1.00 . A A . 7 CYS HB3 1 1 8 2401 1 1 7 CYS N N -2.971 -2.787 14.220 1.00 . A A . 7 CYS N 1 1 8 2402 1 1 7 CYS O O -5.209 -2.973 15.592 1.00 . A A . 7 CYS O 1 1 8 2403 1 1 7 CYS SG S -2.849 -0.516 11.769 1.00 . A A . 7 CYS SG 1 1 8 2404 1 1 8 LEU C C -8.146 -1.599 15.246 1.00 . A A . 8 LEU C 1 1 8 2405 1 1 8 LEU CA C -7.038 -0.934 16.064 1.00 . A A . 8 LEU CA 1 1 8 2406 1 1 8 LEU CB C -7.426 0.434 16.627 1.00 . A A . 8 LEU CB 1 1 8 2407 1 1 8 LEU CD1 C -8.786 -0.475 18.547 1.00 . A A . 8 LEU CD1 1 1 8 2408 1 1 8 LEU CD2 C -9.080 1.933 17.803 1.00 . A A . 8 LEU CD2 1 1 8 2409 1 1 8 LEU CG C -8.764 0.500 17.368 1.00 . A A . 8 LEU CG 1 1 8 2410 1 1 8 LEU H H -5.686 0.071 14.840 1.00 . A A . 8 LEU H 1 1 8 2411 1 1 8 LEU HA H -6.802 -1.576 16.913 1.00 . A A . 8 LEU HA 1 1 8 2412 1 1 8 LEU HB2 H -6.641 0.762 17.307 1.00 . A A . 8 LEU HB2 1 1 8 2413 1 1 8 LEU HB3 H -7.455 1.149 15.804 1.00 . A A . 8 LEU HB3 1 1 8 2414 1 1 8 LEU HD11 H -7.787 -0.889 18.694 1.00 . A A . 8 LEU HD11 1 1 8 2415 1 1 8 LEU HD12 H -9.096 0.052 19.449 1.00 . A A . 8 LEU HD12 1 1 8 2416 1 1 8 LEU HD13 H -9.487 -1.283 18.338 1.00 . A A . 8 LEU HD13 1 1 8 2417 1 1 8 LEU HD21 H -8.173 2.405 18.182 1.00 . A A . 8 LEU HD21 1 1 8 2418 1 1 8 LEU HD22 H -9.455 2.497 16.951 1.00 . A A . 8 LEU HD22 1 1 8 2419 1 1 8 LEU HD23 H -9.836 1.915 18.589 1.00 . A A . 8 LEU HD23 1 1 8 2420 1 1 8 LEU HG H -9.550 0.191 16.681 1.00 . A A . 8 LEU HG 1 1 8 2421 1 1 8 LEU N N -5.838 -0.828 15.252 1.00 . A A . 8 LEU N 1 1 8 2422 1 1 8 LEU O O -8.705 -2.614 15.661 1.00 . A A . 8 LEU O 1 1 8 2423 1 1 9 ALA C C -9.893 -0.430 12.239 1.00 . A A . 9 ALA C 1 1 8 2424 1 1 9 ALA CA C -9.463 -1.523 13.218 1.00 . A A . 9 ALA CA 1 1 8 2425 1 1 9 ALA CB C -10.631 -2.048 14.056 1.00 . A A . 9 ALA CB 1 1 8 2426 1 1 9 ALA H H -7.972 -0.177 13.769 1.00 . A A . 9 ALA H 1 1 8 2427 1 1 9 ALA HA H -9.033 -2.354 12.658 1.00 . A A . 9 ALA HA 1 1 8 2428 1 1 9 ALA HB1 H -10.607 -1.585 15.043 1.00 . A A . 9 ALA HB1 1 1 8 2429 1 1 9 ALA HB2 H -11.571 -1.803 13.562 1.00 . A A . 9 ALA HB2 1 1 8 2430 1 1 9 ALA HB3 H -10.547 -3.130 14.160 1.00 . A A . 9 ALA HB3 1 1 8 2431 1 1 9 ALA N N -8.432 -1.002 14.099 1.00 . A A . 9 ALA N 1 1 8 2432 1 1 9 ALA O O -10.629 0.483 12.606 1.00 . A A . 9 ALA O 1 1 8 2433 1 1 10 GLY C C -8.495 1.178 9.535 1.00 . A A . 10 GLY C 1 1 8 2434 1 1 10 GLY CA C -9.740 0.406 9.974 1.00 . A A . 10 GLY CA 1 1 8 2435 1 1 10 GLY H H -8.816 -1.306 10.719 1.00 . A A . 10 GLY H 1 1 8 2436 1 1 10 GLY HA2 H -10.175 -0.108 9.117 1.00 . A A . 10 GLY HA2 1 1 8 2437 1 1 10 GLY HA3 H -10.492 1.102 10.345 1.00 . A A . 10 GLY HA3 1 1 8 2438 1 1 10 GLY N N -9.414 -0.560 11.010 1.00 . A A . 10 GLY N 1 1 8 2439 1 1 10 GLY O O -8.359 1.528 8.362 1.00 . A A . 10 GLY O 1 1 8 2440 1 1 11 TYR C C -5.507 1.379 9.238 1.00 . A A . 11 TYR C 1 1 8 2441 1 1 11 TYR CA C -6.389 2.148 10.224 1.00 . A A . 11 TYR CA 1 1 8 2442 1 1 11 TYR CB C -5.659 2.260 11.563 1.00 . A A . 11 TYR CB 1 1 8 2443 1 1 11 TYR CD1 C -6.374 4.522 12.417 1.00 . A A . 11 TYR CD1 1 1 8 2444 1 1 11 TYR CD2 C -6.994 2.587 13.676 1.00 . A A . 11 TYR CD2 1 1 8 2445 1 1 11 TYR CE1 C -7.039 5.361 13.379 1.00 . A A . 11 TYR CE1 1 1 8 2446 1 1 11 TYR CE2 C -7.660 3.427 14.638 1.00 . A A . 11 TYR CE2 1 1 8 2447 1 1 11 TYR CG C -6.365 3.151 12.586 1.00 . A A . 11 TYR CG 1 1 8 2448 1 1 11 TYR CZ C -7.649 4.773 14.442 1.00 . A A . 11 TYR CZ 1 1 8 2449 1 1 11 TYR H H -7.737 1.135 11.448 1.00 . A A . 11 TYR H 1 1 8 2450 1 1 11 TYR HA H -6.656 3.110 9.787 1.00 . A A . 11 TYR HA 1 1 8 2451 1 1 11 TYR HB2 H -5.542 1.261 11.986 1.00 . A A . 11 TYR HB2 1 1 8 2452 1 1 11 TYR HB3 H -4.656 2.650 11.387 1.00 . A A . 11 TYR HB3 1 1 8 2453 1 1 11 TYR HD1 H -5.877 4.967 11.555 1.00 . A A . 11 TYR HD1 1 1 8 2454 1 1 11 TYR HD2 H -6.987 1.505 13.809 1.00 . A A . 11 TYR HD2 1 1 8 2455 1 1 11 TYR HE1 H -7.054 6.444 13.257 1.00 . A A . 11 TYR HE1 1 1 8 2456 1 1 11 TYR HE2 H -8.160 2.993 15.504 1.00 . A A . 11 TYR HE2 1 1 8 2457 1 1 11 TYR HH H -8.987 5.046 15.825 1.00 . A A . 11 TYR HH 1 1 8 2458 1 1 11 TYR N N -7.618 1.423 10.497 1.00 . A A . 11 TYR N 1 1 8 2459 1 1 11 TYR O O -5.634 0.164 9.102 1.00 . A A . 11 TYR O 1 1 8 2460 1 1 11 TYR OH O -8.278 5.566 15.351 1.00 . A A . 11 TYR OH 1 1 8 2461 1 1 12 MET C C -2.276 1.624 8.075 1.00 . A A . 12 MET C 1 1 8 2462 1 1 12 MET CA C -3.729 1.524 7.603 1.00 . A A . 12 MET CA 1 1 8 2463 1 1 12 MET CB C -3.881 2.238 6.259 1.00 . A A . 12 MET CB 1 1 8 2464 1 1 12 MET CE C -2.944 6.089 5.202 1.00 . A A . 12 MET CE 1 1 8 2465 1 1 12 MET CG C -3.668 3.745 6.412 1.00 . A A . 12 MET CG 1 1 8 2466 1 1 12 MET H H -4.535 3.109 8.689 1.00 . A A . 12 MET H 1 1 8 2467 1 1 12 MET HA H -4.025 0.478 7.533 1.00 . A A . 12 MET HA 1 1 8 2468 1 1 12 MET HB2 H -3.160 1.836 5.547 1.00 . A A . 12 MET HB2 1 1 8 2469 1 1 12 MET HB3 H -4.873 2.047 5.852 1.00 . A A . 12 MET HB3 1 1 8 2470 1 1 12 MET HE1 H -1.941 5.902 5.584 1.00 . A A . 12 MET HE1 1 1 8 2471 1 1 12 MET HE2 H -2.882 6.701 4.301 1.00 . A A . 12 MET HE2 1 1 8 2472 1 1 12 MET HE3 H -3.528 6.613 5.958 1.00 . A A . 12 MET HE3 1 1 8 2473 1 1 12 MET HG2 H -4.433 4.165 7.065 1.00 . A A . 12 MET HG2 1 1 8 2474 1 1 12 MET HG3 H -2.705 3.939 6.883 1.00 . A A . 12 MET HG3 1 1 8 2475 1 1 12 MET N N -4.632 2.121 8.574 1.00 . A A . 12 MET N 1 1 8 2476 1 1 12 MET O O -1.973 2.354 9.016 1.00 . A A . 12 MET O 1 1 8 2477 1 1 12 MET SD S -3.733 4.536 4.812 1.00 . A A . 12 MET SD 1 1 8 2478 1 1 13 ARG C C 0.789 1.692 6.715 1.00 . A A . 13 ARG C 1 1 8 2479 1 1 13 ARG CA C -0.004 0.871 7.733 1.00 . A A . 13 ARG CA 1 1 8 2480 1 1 13 ARG CB C 0.548 -0.556 7.767 1.00 . A A . 13 ARG CB 1 1 8 2481 1 1 13 ARG CD C 0.809 -1.910 9.879 1.00 . A A . 13 ARG CD 1 1 8 2482 1 1 13 ARG CG C -0.173 -1.398 8.823 1.00 . A A . 13 ARG CG 1 1 8 2483 1 1 13 ARG CZ C 1.086 -3.986 11.230 1.00 . A A . 13 ARG CZ 1 1 8 2484 1 1 13 ARG H H -1.672 0.287 6.631 1.00 . A A . 13 ARG H 1 1 8 2485 1 1 13 ARG HA H 0.049 1.320 8.725 1.00 . A A . 13 ARG HA 1 1 8 2486 1 1 13 ARG HB2 H 0.431 -1.018 6.787 1.00 . A A . 13 ARG HB2 1 1 8 2487 1 1 13 ARG HB3 H 1.616 -0.532 7.983 1.00 . A A . 13 ARG HB3 1 1 8 2488 1 1 13 ARG HD2 H 1.817 -1.939 9.466 1.00 . A A . 13 ARG HD2 1 1 8 2489 1 1 13 ARG HD3 H 0.831 -1.228 10.728 1.00 . A A . 13 ARG HD3 1 1 8 2490 1 1 13 ARG HE H -0.419 -3.662 9.933 1.00 . A A . 13 ARG HE 1 1 8 2491 1 1 13 ARG HG2 H -0.948 -0.800 9.302 1.00 . A A . 13 ARG HG2 1 1 8 2492 1 1 13 ARG HG3 H -0.670 -2.241 8.343 1.00 . A A . 13 ARG HG3 1 1 8 2493 1 1 13 ARG HH11 H 2.527 -2.582 11.525 1.00 . A A . 13 ARG HH11 1 1 8 2494 1 1 13 ARG HH12 H 2.706 -4.031 12.458 1.00 . A A . 13 ARG HH12 1 1 8 2495 1 1 13 ARG HH21 H -0.184 -5.573 11.163 1.00 . A A . 13 ARG HH21 1 1 8 2496 1 1 13 ARG HH22 H 1.153 -5.743 12.250 1.00 . A A . 13 ARG HH22 1 1 8 2497 1 1 13 ARG N N -1.417 0.877 7.396 1.00 . A A . 13 ARG N 1 1 8 2498 1 1 13 ARG NE N 0.408 -3.263 10.327 1.00 . A A . 13 ARG NE 1 1 8 2499 1 1 13 ARG NH1 N 2.200 -3.491 11.785 1.00 . A A . 13 ARG NH1 1 1 8 2500 1 1 13 ARG NH2 N 0.648 -5.204 11.577 1.00 . A A . 13 ARG NH2 1 1 8 2501 1 1 13 ARG O O 0.978 1.263 5.577 1.00 . A A . 13 ARG O 1 1 8 2502 1 1 14 THR C C 3.343 3.109 5.941 1.00 . A A . 14 THR C 1 1 8 2503 1 1 14 THR CA C 1.999 3.745 6.299 1.00 . A A . 14 THR CA 1 1 8 2504 1 1 14 THR CB C 2.134 5.093 7.010 1.00 . A A . 14 THR CB 1 1 8 2505 1 1 14 THR CG2 C 0.780 5.681 7.414 1.00 . A A . 14 THR CG2 1 1 8 2506 1 1 14 THR H H 1.076 3.201 8.085 1.00 . A A . 14 THR H 1 1 8 2507 1 1 14 THR HA H 1.450 3.878 5.367 1.00 . A A . 14 THR HA 1 1 8 2508 1 1 14 THR HB H 2.699 5.800 6.401 1.00 . A A . 14 THR HB 1 1 8 2509 1 1 14 THR HG1 H 3.478 5.432 8.453 1.00 . A A . 14 THR HG1 1 1 8 2510 1 1 14 THR HG21 H -0.018 5.022 7.073 1.00 . A A . 14 THR HG21 1 1 8 2511 1 1 14 THR HG22 H 0.735 5.776 8.498 1.00 . A A . 14 THR HG22 1 1 8 2512 1 1 14 THR HG23 H 0.660 6.664 6.958 1.00 . A A . 14 THR HG23 1 1 8 2513 1 1 14 THR N N 1.232 2.859 7.159 1.00 . A A . 14 THR N 1 1 8 2514 1 1 14 THR O O 3.522 1.901 6.089 1.00 . A A . 14 THR O 1 1 8 2515 1 1 14 THR OG1 O 2.757 4.771 8.250 1.00 . A A . 14 THR OG1 1 1 8 2516 1 1 15 ALA C C 6.514 3.580 6.305 1.00 . A A . 15 ALA C 1 1 8 2517 1 1 15 ALA CA C 5.578 3.486 5.098 1.00 . A A . 15 ALA CA 1 1 8 2518 1 1 15 ALA CB C 6.083 4.301 3.905 1.00 . A A . 15 ALA CB 1 1 8 2519 1 1 15 ALA H H 4.102 4.932 5.361 1.00 . A A . 15 ALA H 1 1 8 2520 1 1 15 ALA HA H 5.490 2.442 4.798 1.00 . A A . 15 ALA HA 1 1 8 2521 1 1 15 ALA HB1 H 5.239 4.780 3.410 1.00 . A A . 15 ALA HB1 1 1 8 2522 1 1 15 ALA HB2 H 6.780 5.063 4.253 1.00 . A A . 15 ALA HB2 1 1 8 2523 1 1 15 ALA HB3 H 6.589 3.639 3.202 1.00 . A A . 15 ALA HB3 1 1 8 2524 1 1 15 ALA N N 4.256 3.951 5.478 1.00 . A A . 15 ALA N 1 1 8 2525 1 1 15 ALA O O 7.719 3.371 6.179 1.00 . A A . 15 ALA O 1 1 8 2526 1 1 16 ASP C C 6.260 2.924 9.652 1.00 . A A . 16 ASP C 1 1 8 2527 1 1 16 ASP CA C 6.686 4.023 8.676 1.00 . A A . 16 ASP CA 1 1 8 2528 1 1 16 ASP CB C 6.433 5.374 9.347 1.00 . A A . 16 ASP CB 1 1 8 2529 1 1 16 ASP CG C 7.495 6.441 9.075 1.00 . A A . 16 ASP CG 1 1 8 2530 1 1 16 ASP H H 4.941 4.066 7.541 1.00 . A A . 16 ASP H 1 1 8 2531 1 1 16 ASP HA H 7.730 3.931 8.375 1.00 . A A . 16 ASP HA 1 1 8 2532 1 1 16 ASP HB2 H 5.466 5.753 9.014 1.00 . A A . 16 ASP HB2 1 1 8 2533 1 1 16 ASP HB3 H 6.361 5.221 10.424 1.00 . A A . 16 ASP HB3 1 1 8 2534 1 1 16 ASP N N 5.922 3.897 7.447 1.00 . A A . 16 ASP N 1 1 8 2535 1 1 16 ASP O O 6.992 2.600 10.586 1.00 . A A . 16 ASP O 1 1 8 2536 1 1 16 ASP OD1 O 8.678 6.049 8.966 1.00 . A A . 16 ASP OD1 1 1 8 2537 1 1 16 ASP OD2 O 7.102 7.623 8.981 1.00 . A A . 16 ASP OD2 1 1 8 2538 1 1 17 GLY C C 3.547 1.886 11.262 1.00 . A A . 17 GLY C 1 1 8 2539 1 1 17 GLY CA C 4.545 1.324 10.247 1.00 . A A . 17 GLY CA 1 1 8 2540 1 1 17 GLY H H 4.489 2.650 8.641 1.00 . A A . 17 GLY H 1 1 8 2541 1 1 17 GLY HA2 H 4.057 0.571 9.629 1.00 . A A . 17 GLY HA2 1 1 8 2542 1 1 17 GLY HA3 H 5.361 0.827 10.771 1.00 . A A . 17 GLY HA3 1 1 8 2543 1 1 17 GLY N N 5.078 2.380 9.402 1.00 . A A . 17 GLY N 1 1 8 2544 1 1 17 GLY O O 2.994 1.142 12.071 1.00 . A A . 17 GLY O 1 1 8 2545 1 1 18 ARG C C 0.987 3.715 11.583 1.00 . A A . 18 ARG C 1 1 8 2546 1 1 18 ARG CA C 2.424 3.862 12.088 1.00 . A A . 18 ARG CA 1 1 8 2547 1 1 18 ARG CB C 2.762 5.349 12.217 1.00 . A A . 18 ARG CB 1 1 8 2548 1 1 18 ARG CD C 4.507 5.552 14.026 1.00 . A A . 18 ARG CD 1 1 8 2549 1 1 18 ARG CG C 4.249 5.549 12.518 1.00 . A A . 18 ARG CG 1 1 8 2550 1 1 18 ARG CZ C 6.201 3.759 14.380 1.00 . A A . 18 ARG CZ 1 1 8 2551 1 1 18 ARG H H 3.799 3.791 10.525 1.00 . A A . 18 ARG H 1 1 8 2552 1 1 18 ARG HA H 2.557 3.360 13.046 1.00 . A A . 18 ARG HA 1 1 8 2553 1 1 18 ARG HB2 H 2.501 5.867 11.295 1.00 . A A . 18 ARG HB2 1 1 8 2554 1 1 18 ARG HB3 H 2.163 5.794 13.013 1.00 . A A . 18 ARG HB3 1 1 8 2555 1 1 18 ARG HD2 H 4.390 6.561 14.422 1.00 . A A . 18 ARG HD2 1 1 8 2556 1 1 18 ARG HD3 H 3.773 4.925 14.531 1.00 . A A . 18 ARG HD3 1 1 8 2557 1 1 18 ARG HE H 6.597 5.731 14.450 1.00 . A A . 18 ARG HE 1 1 8 2558 1 1 18 ARG HG2 H 4.829 4.755 12.048 1.00 . A A . 18 ARG HG2 1 1 8 2559 1 1 18 ARG HG3 H 4.587 6.491 12.086 1.00 . A A . 18 ARG HG3 1 1 8 2560 1 1 18 ARG HH11 H 4.319 3.087 14.002 1.00 . A A . 18 ARG HH11 1 1 8 2561 1 1 18 ARG HH12 H 5.507 1.851 14.250 1.00 . A A . 18 ARG HH12 1 1 8 2562 1 1 18 ARG HH21 H 8.165 4.101 14.777 1.00 . A A . 18 ARG HH21 1 1 8 2563 1 1 18 ARG HH22 H 7.710 2.432 14.694 1.00 . A A . 18 ARG HH22 1 1 8 2564 1 1 18 ARG N N 3.346 3.193 11.186 1.00 . A A . 18 ARG N 1 1 8 2565 1 1 18 ARG NE N 5.873 5.056 14.306 1.00 . A A . 18 ARG NE 1 1 8 2566 1 1 18 ARG NH1 N 5.263 2.819 14.195 1.00 . A A . 18 ARG NH1 1 1 8 2567 1 1 18 ARG NH2 N 7.466 3.400 14.639 1.00 . A A . 18 ARG NH2 1 1 8 2568 1 1 18 ARG O O 0.626 4.282 10.553 1.00 . A A . 18 ARG O 1 1 8 2569 1 1 19 CYS C C -1.866 4.081 11.806 1.00 . A A . 19 CYS C 1 1 8 2570 1 1 19 CYS CA C -1.183 2.722 11.975 1.00 . A A . 19 CYS CA 1 1 8 2571 1 1 19 CYS CB C -1.898 1.849 13.008 1.00 . A A . 19 CYS CB 1 1 8 2572 1 1 19 CYS H H 0.507 2.494 13.170 1.00 . A A . 19 CYS H 1 1 8 2573 1 1 19 CYS HA H -1.178 2.173 11.033 1.00 . A A . 19 CYS HA 1 1 8 2574 1 1 19 CYS HB2 H -1.770 2.297 13.993 1.00 . A A . 19 CYS HB2 1 1 8 2575 1 1 19 CYS HB3 H -2.967 1.855 12.791 1.00 . A A . 19 CYS HB3 1 1 8 2576 1 1 19 CYS N N 0.206 2.951 12.333 1.00 . A A . 19 CYS N 1 1 8 2577 1 1 19 CYS O O -2.155 4.761 12.790 1.00 . A A . 19 CYS O 1 1 8 2578 1 1 19 CYS SG S -1.323 0.113 13.073 1.00 . A A . 19 CYS SG 1 1 8 2579 1 1 20 LYS C C -4.221 5.450 9.906 1.00 . A A . 20 LYS C 1 1 8 2580 1 1 20 LYS CA C -2.750 5.702 10.243 1.00 . A A . 20 LYS CA 1 1 8 2581 1 1 20 LYS CB C -1.984 6.438 9.142 1.00 . A A . 20 LYS CB 1 1 8 2582 1 1 20 LYS CD C -0.615 8.481 8.582 1.00 . A A . 20 LYS CD 1 1 8 2583 1 1 20 LYS CE C 0.866 8.734 8.872 1.00 . A A . 20 LYS CE 1 1 8 2584 1 1 20 LYS CG C -1.262 7.665 9.703 1.00 . A A . 20 LYS CG 1 1 8 2585 1 1 20 LYS H H -1.865 3.879 9.757 1.00 . A A . 20 LYS H 1 1 8 2586 1 1 20 LYS HA H -2.701 6.321 11.138 1.00 . A A . 20 LYS HA 1 1 8 2587 1 1 20 LYS HB2 H -1.261 5.765 8.683 1.00 . A A . 20 LYS HB2 1 1 8 2588 1 1 20 LYS HB3 H -2.675 6.746 8.357 1.00 . A A . 20 LYS HB3 1 1 8 2589 1 1 20 LYS HD2 H -0.719 7.951 7.635 1.00 . A A . 20 LYS HD2 1 1 8 2590 1 1 20 LYS HD3 H -1.136 9.433 8.473 1.00 . A A . 20 LYS HD3 1 1 8 2591 1 1 20 LYS HE2 H 0.970 9.582 9.548 1.00 . A A . 20 LYS HE2 1 1 8 2592 1 1 20 LYS HE3 H 1.296 7.869 9.376 1.00 . A A . 20 LYS HE3 1 1 8 2593 1 1 20 LYS HG2 H -1.969 8.289 10.250 1.00 . A A . 20 LYS HG2 1 1 8 2594 1 1 20 LYS HG3 H -0.499 7.349 10.414 1.00 . A A . 20 LYS HG3 1 1 8 2595 1 1 20 LYS HZ1 H 1.004 9.483 6.975 1.00 . A A . 20 LYS HZ1 1 1 8 2596 1 1 20 LYS HZ2 H 2.404 9.564 7.812 1.00 . A A . 20 LYS HZ2 1 1 8 2597 1 1 20 LYS HZ3 H 1.894 8.134 7.210 1.00 . A A . 20 LYS HZ3 1 1 8 2598 1 1 20 LYS N N -2.104 4.437 10.552 1.00 . A A . 20 LYS N 1 1 8 2599 1 1 20 LYS NZ N 1.601 9.000 7.615 1.00 . A A . 20 LYS NZ 1 1 8 2600 1 1 20 LYS O O -4.639 4.303 9.754 1.00 . A A . 20 LYS O 1 1 8 2601 1 1 21 PRO C C -6.612 6.151 8.001 1.00 . A A . 21 PRO C 1 1 8 2602 1 1 21 PRO CA C -6.399 6.482 9.480 1.00 . A A . 21 PRO CA 1 1 8 2603 1 1 21 PRO CB C -6.974 7.833 9.874 1.00 . A A . 21 PRO CB 1 1 8 2604 1 1 21 PRO CD C -4.521 7.943 9.969 1.00 . A A . 21 PRO CD 1 1 8 2605 1 1 21 PRO CG C -5.789 8.781 9.961 1.00 . A A . 21 PRO CG 1 1 8 2606 1 1 21 PRO HA H -6.823 5.734 9.991 1.00 . A A . 21 PRO HA 1 1 8 2607 1 1 21 PRO HB2 H -7.699 8.179 9.138 1.00 . A A . 21 PRO HB2 1 1 8 2608 1 1 21 PRO HB3 H -7.495 7.771 10.830 1.00 . A A . 21 PRO HB3 1 1 8 2609 1 1 21 PRO HD2 H -3.847 8.238 9.166 1.00 . A A . 21 PRO HD2 1 1 8 2610 1 1 21 PRO HD3 H -3.974 8.062 10.905 1.00 . A A . 21 PRO HD3 1 1 8 2611 1 1 21 PRO HG2 H -5.788 9.468 9.114 1.00 . A A . 21 PRO HG2 1 1 8 2612 1 1 21 PRO HG3 H -5.852 9.389 10.864 1.00 . A A . 21 PRO HG3 1 1 8 2613 1 1 21 PRO N N -4.983 6.569 9.796 1.00 . A A . 21 PRO N 1 1 8 2614 1 1 21 PRO O O -5.843 6.589 7.147 1.00 . A A . 21 PRO O 1 1 8 2615 1 1 22 THR C C -9.203 5.756 5.881 1.00 . A A . 22 THR C 1 1 8 2616 1 1 22 THR CA C -7.981 4.985 6.385 1.00 . A A . 22 THR CA 1 1 8 2617 1 1 22 THR CB C -8.170 3.466 6.365 1.00 . A A . 22 THR CB 1 1 8 2618 1 1 22 THR CG2 C -8.080 2.883 4.954 1.00 . A A . 22 THR CG2 1 1 8 2619 1 1 22 THR H H -8.278 5.028 8.446 1.00 . A A . 22 THR H 1 1 8 2620 1 1 22 THR HA H -7.144 5.255 5.740 1.00 . A A . 22 THR HA 1 1 8 2621 1 1 22 THR HB H -9.107 3.185 6.844 1.00 . A A . 22 THR HB 1 1 8 2622 1 1 22 THR HG1 H -6.186 3.343 6.601 1.00 . A A . 22 THR HG1 1 1 8 2623 1 1 22 THR HG21 H -8.273 3.669 4.223 1.00 . A A . 22 THR HG21 1 1 8 2624 1 1 22 THR HG22 H -7.083 2.474 4.793 1.00 . A A . 22 THR HG22 1 1 8 2625 1 1 22 THR HG23 H -8.821 2.092 4.840 1.00 . A A . 22 THR HG23 1 1 8 2626 1 1 22 THR N N -7.658 5.380 7.745 1.00 . A A . 22 THR N 1 1 8 2627 1 1 22 THR O O -9.728 5.463 4.807 1.00 . A A . 22 THR O 1 1 8 2628 1 1 22 THR OG1 O -7.010 2.964 7.022 1.00 . A A . 22 THR OG1 1 1 8 2629 1 1 23 PHE C C -10.801 7.831 4.828 1.00 . A A . 23 PHE C 1 1 8 2630 1 1 23 PHE CA C -10.772 7.540 6.331 1.00 . A A . 23 PHE CA 1 1 8 2631 1 1 23 PHE CB C -10.634 8.861 7.091 1.00 . A A . 23 PHE CB 1 1 8 2632 1 1 23 PHE CD1 C -10.983 7.665 9.264 1.00 . A A . 23 PHE CD1 1 1 8 2633 1 1 23 PHE CD2 C -9.590 9.566 9.256 1.00 . A A . 23 PHE CD2 1 1 8 2634 1 1 23 PHE CE1 C -10.760 7.508 10.657 1.00 . A A . 23 PHE CE1 1 1 8 2635 1 1 23 PHE CE2 C -9.367 9.409 10.649 1.00 . A A . 23 PHE CE2 1 1 8 2636 1 1 23 PHE CG C -10.393 8.691 8.592 1.00 . A A . 23 PHE CG 1 1 8 2637 1 1 23 PHE CZ C -9.956 8.383 11.321 1.00 . A A . 23 PHE CZ 1 1 8 2638 1 1 23 PHE H H -9.189 6.958 7.552 1.00 . A A . 23 PHE H 1 1 8 2639 1 1 23 PHE HA H -11.663 6.977 6.606 1.00 . A A . 23 PHE HA 1 1 8 2640 1 1 23 PHE HB2 H -9.809 9.431 6.663 1.00 . A A . 23 PHE HB2 1 1 8 2641 1 1 23 PHE HB3 H -11.539 9.450 6.943 1.00 . A A . 23 PHE HB3 1 1 8 2642 1 1 23 PHE HD1 H -11.626 6.965 8.733 1.00 . A A . 23 PHE HD1 1 1 8 2643 1 1 23 PHE HD2 H -9.118 10.387 8.718 1.00 . A A . 23 PHE HD2 1 1 8 2644 1 1 23 PHE HE1 H -11.232 6.687 11.196 1.00 . A A . 23 PHE HE1 1 1 8 2645 1 1 23 PHE HE2 H -8.724 10.110 11.180 1.00 . A A . 23 PHE HE2 1 1 8 2646 1 1 23 PHE HZ H -9.785 8.263 12.390 1.00 . A A . 23 PHE HZ 1 1 8 2647 1 1 23 PHE N N -9.622 6.726 6.681 1.00 . A A . 23 PHE N 1 1 8 2648 1 1 23 PHE O O -11.766 7.493 4.145 1.00 . A A . 23 PHE O 1 1 9 2649 1 1 1 GLU C C -7.998 -9.896 22.058 1.00 . A A . 1 GLU C 1 1 9 2650 1 1 1 GLU CA C -7.838 -9.753 23.573 1.00 . A A . 1 GLU CA 1 1 9 2651 1 1 1 GLU CB C -6.502 -9.094 23.924 1.00 . A A . 1 GLU CB 1 1 9 2652 1 1 1 GLU CD C -5.488 -7.304 25.382 1.00 . A A . 1 GLU CD 1 1 9 2653 1 1 1 GLU CG C -6.587 -8.362 25.264 1.00 . A A . 1 GLU CG 1 1 9 2654 1 1 1 GLU HA H -8.651 -9.149 23.976 1.00 . A A . 1 GLU HA 1 1 9 2655 1 1 1 GLU HB2 H -5.720 -9.851 23.968 1.00 . A A . 1 GLU HB2 1 1 9 2656 1 1 1 GLU HB3 H -6.223 -8.391 23.139 1.00 . A A . 1 GLU HB3 1 1 9 2657 1 1 1 GLU HG2 H -7.565 -7.889 25.363 1.00 . A A . 1 GLU HG2 1 1 9 2658 1 1 1 GLU HG3 H -6.496 -9.079 26.081 1.00 . A A . 1 GLU HG3 1 1 9 2659 1 1 1 GLU N N -7.964 -11.050 24.218 1.00 . A A . 1 GLU N 1 1 9 2660 1 1 1 GLU O O -7.857 -10.991 21.516 1.00 . A A . 1 GLU O 1 1 9 2661 1 1 1 GLU OE1 O -4.306 -7.707 25.340 1.00 . A A . 1 GLU OE1 1 1 9 2662 1 1 1 GLU OE2 O -5.856 -6.116 25.512 1.00 . A A . 1 GLU OE2 1 1 9 2663 1 1 2 ASN C C -7.167 -8.330 19.306 1.00 . A A . 2 ASN C 1 1 9 2664 1 1 2 ASN CA C -8.473 -8.761 19.976 1.00 . A A . 2 ASN CA 1 1 9 2665 1 1 2 ASN CB C -9.564 -7.769 19.567 1.00 . A A . 2 ASN CB 1 1 9 2666 1 1 2 ASN CG C -10.522 -8.394 18.552 1.00 . A A . 2 ASN CG 1 1 9 2667 1 1 2 ASN H H -8.404 -7.888 21.866 1.00 . A A . 2 ASN H 1 1 9 2668 1 1 2 ASN HA H -8.760 -9.779 19.714 1.00 . A A . 2 ASN HA 1 1 9 2669 1 1 2 ASN HB2 H -10.121 -7.451 20.449 1.00 . A A . 2 ASN HB2 1 1 9 2670 1 1 2 ASN HB3 H -9.107 -6.877 19.140 1.00 . A A . 2 ASN HB3 1 1 9 2671 1 1 2 ASN HD21 H -11.998 -8.261 19.931 1.00 . A A . 2 ASN HD21 1 1 9 2672 1 1 2 ASN HD22 H -12.464 -8.948 18.410 1.00 . A A . 2 ASN HD22 1 1 9 2673 1 1 2 ASN N N -8.291 -8.775 21.418 1.00 . A A . 2 ASN N 1 1 9 2674 1 1 2 ASN ND2 N -11.764 -8.547 19.001 1.00 . A A . 2 ASN ND2 1 1 9 2675 1 1 2 ASN O O -6.285 -7.772 19.958 1.00 . A A . 2 ASN O 1 1 9 2676 1 1 2 ASN OD1 O -10.157 -8.717 17.433 1.00 . A A . 2 ASN OD1 1 1 9 2677 1 1 3 PHE C C -6.174 -8.335 15.744 1.00 . A A . 3 PHE C 1 1 9 2678 1 1 3 PHE CA C -5.900 -8.252 17.247 1.00 . A A . 3 PHE CA 1 1 9 2679 1 1 3 PHE CB C -4.813 -9.265 17.612 1.00 . A A . 3 PHE CB 1 1 9 2680 1 1 3 PHE CD1 C -3.249 -7.702 18.785 1.00 . A A . 3 PHE CD1 1 1 9 2681 1 1 3 PHE CD2 C -2.384 -9.037 17.048 1.00 . A A . 3 PHE CD2 1 1 9 2682 1 1 3 PHE CE1 C -1.965 -7.126 18.982 1.00 . A A . 3 PHE CE1 1 1 9 2683 1 1 3 PHE CE2 C -1.102 -8.462 17.244 1.00 . A A . 3 PHE CE2 1 1 9 2684 1 1 3 PHE CG C -3.431 -8.646 17.823 1.00 . A A . 3 PHE CG 1 1 9 2685 1 1 3 PHE CZ C -0.918 -7.519 18.207 1.00 . A A . 3 PHE CZ 1 1 9 2686 1 1 3 PHE H H -7.806 -9.058 17.489 1.00 . A A . 3 PHE H 1 1 9 2687 1 1 3 PHE HA H -5.638 -7.228 17.510 1.00 . A A . 3 PHE HA 1 1 9 2688 1 1 3 PHE HB2 H -5.109 -9.787 18.521 1.00 . A A . 3 PHE HB2 1 1 9 2689 1 1 3 PHE HB3 H -4.749 -10.013 16.821 1.00 . A A . 3 PHE HB3 1 1 9 2690 1 1 3 PHE HD1 H -4.088 -7.387 19.407 1.00 . A A . 3 PHE HD1 1 1 9 2691 1 1 3 PHE HD2 H -2.531 -9.794 16.277 1.00 . A A . 3 PHE HD2 1 1 9 2692 1 1 3 PHE HE1 H -1.819 -6.370 19.753 1.00 . A A . 3 PHE HE1 1 1 9 2693 1 1 3 PHE HE2 H -0.263 -8.776 16.623 1.00 . A A . 3 PHE HE2 1 1 9 2694 1 1 3 PHE HZ H 0.066 -7.078 18.357 1.00 . A A . 3 PHE HZ 1 1 9 2695 1 1 3 PHE N N -7.085 -8.604 18.012 1.00 . A A . 3 PHE N 1 1 9 2696 1 1 3 PHE O O -7.037 -9.097 15.308 1.00 . A A . 3 PHE O 1 1 9 2697 1 1 4 ASN C C -4.272 -7.036 12.911 1.00 . A A . 4 ASN C 1 1 9 2698 1 1 4 ASN CA C -5.578 -7.516 13.548 1.00 . A A . 4 ASN CA 1 1 9 2699 1 1 4 ASN CB C -6.690 -6.553 13.127 1.00 . A A . 4 ASN CB 1 1 9 2700 1 1 4 ASN CG C -6.849 -6.529 11.607 1.00 . A A . 4 ASN CG 1 1 9 2701 1 1 4 ASN H H -4.727 -6.924 15.355 1.00 . A A . 4 ASN H 1 1 9 2702 1 1 4 ASN HA H -5.827 -8.539 13.269 1.00 . A A . 4 ASN HA 1 1 9 2703 1 1 4 ASN HB2 H -7.630 -6.854 13.591 1.00 . A A . 4 ASN HB2 1 1 9 2704 1 1 4 ASN HB3 H -6.464 -5.550 13.490 1.00 . A A . 4 ASN HB3 1 1 9 2705 1 1 4 ASN HD21 H -6.318 -4.575 11.629 1.00 . A A . 4 ASN HD21 1 1 9 2706 1 1 4 ASN HD22 H -6.665 -5.231 10.063 1.00 . A A . 4 ASN HD22 1 1 9 2707 1 1 4 ASN N N -5.426 -7.542 14.993 1.00 . A A . 4 ASN N 1 1 9 2708 1 1 4 ASN ND2 N -6.590 -5.347 11.054 1.00 . A A . 4 ASN ND2 1 1 9 2709 1 1 4 ASN O O -4.290 -6.245 11.969 1.00 . A A . 4 ASN O 1 1 9 2710 1 1 4 ASN OD1 O -7.185 -7.518 10.976 1.00 . A A . 4 ASN OD1 1 1 9 2711 1 1 5 GLY C C -1.165 -6.180 13.889 1.00 . A A . 5 GLY C 1 1 9 2712 1 1 5 GLY CA C -1.858 -7.167 12.946 1.00 . A A . 5 GLY CA 1 1 9 2713 1 1 5 GLY H H -3.163 -8.177 14.216 1.00 . A A . 5 GLY H 1 1 9 2714 1 1 5 GLY HA2 H -1.244 -8.060 12.834 1.00 . A A . 5 GLY HA2 1 1 9 2715 1 1 5 GLY HA3 H -1.955 -6.721 11.956 1.00 . A A . 5 GLY HA3 1 1 9 2716 1 1 5 GLY N N -3.169 -7.535 13.450 1.00 . A A . 5 GLY N 1 1 9 2717 1 1 5 GLY O O 0.048 -6.249 14.083 1.00 . A A . 5 GLY O 1 1 9 2718 1 1 6 GLY C C -2.393 -3.092 15.474 1.00 . A A . 6 GLY C 1 1 9 2719 1 1 6 GLY CA C -1.443 -4.288 15.368 1.00 . A A . 6 GLY CA 1 1 9 2720 1 1 6 GLY H H -2.951 -5.238 14.287 1.00 . A A . 6 GLY H 1 1 9 2721 1 1 6 GLY HA2 H -1.302 -4.732 16.353 1.00 . A A . 6 GLY HA2 1 1 9 2722 1 1 6 GLY HA3 H -0.465 -3.950 15.026 1.00 . A A . 6 GLY HA3 1 1 9 2723 1 1 6 GLY N N -1.964 -5.286 14.451 1.00 . A A . 6 GLY N 1 1 9 2724 1 1 6 GLY O O -2.706 -2.639 16.574 1.00 . A A . 6 GLY O 1 1 9 2725 1 1 7 CYS C C -4.945 -1.796 15.144 1.00 . A A . 7 CYS C 1 1 9 2726 1 1 7 CYS CA C -3.733 -1.482 14.264 1.00 . A A . 7 CYS CA 1 1 9 2727 1 1 7 CYS CB C -4.142 -1.149 12.828 1.00 . A A . 7 CYS CB 1 1 9 2728 1 1 7 CYS H H -2.566 -2.990 13.425 1.00 . A A . 7 CYS H 1 1 9 2729 1 1 7 CYS HA H -3.184 -0.624 14.654 1.00 . A A . 7 CYS HA 1 1 9 2730 1 1 7 CYS HB2 H -4.564 -2.042 12.369 1.00 . A A . 7 CYS HB2 1 1 9 2731 1 1 7 CYS HB3 H -4.932 -0.399 12.855 1.00 . A A . 7 CYS HB3 1 1 9 2732 1 1 7 CYS N N -2.825 -2.616 14.316 1.00 . A A . 7 CYS N 1 1 9 2733 1 1 7 CYS O O -5.054 -2.895 15.687 1.00 . A A . 7 CYS O 1 1 9 2734 1 1 7 CYS SG S -2.783 -0.532 11.767 1.00 . A A . 7 CYS SG 1 1 9 2735 1 1 8 LEU C C -8.094 -1.689 15.237 1.00 . A A . 8 LEU C 1 1 9 2736 1 1 8 LEU CA C -7.024 -0.971 16.062 1.00 . A A . 8 LEU CA 1 1 9 2737 1 1 8 LEU CB C -7.479 0.381 16.616 1.00 . A A . 8 LEU CB 1 1 9 2738 1 1 8 LEU CD1 C -8.796 -0.540 18.559 1.00 . A A . 8 LEU CD1 1 1 9 2739 1 1 8 LEU CD2 C -9.238 1.813 17.720 1.00 . A A . 8 LEU CD2 1 1 9 2740 1 1 8 LEU CG C -8.825 0.388 17.344 1.00 . A A . 8 LEU CG 1 1 9 2741 1 1 8 LEU H H -5.728 0.078 14.812 1.00 . A A . 8 LEU H 1 1 9 2742 1 1 8 LEU HA H -6.766 -1.598 16.914 1.00 . A A . 8 LEU HA 1 1 9 2743 1 1 8 LEU HB2 H -6.715 0.746 17.303 1.00 . A A . 8 LEU HB2 1 1 9 2744 1 1 8 LEU HB3 H -7.531 1.091 15.791 1.00 . A A . 8 LEU HB3 1 1 9 2745 1 1 8 LEU HD11 H -8.137 -1.384 18.357 1.00 . A A . 8 LEU HD11 1 1 9 2746 1 1 8 LEU HD12 H -8.428 0.008 19.426 1.00 . A A . 8 LEU HD12 1 1 9 2747 1 1 8 LEU HD13 H -9.803 -0.906 18.761 1.00 . A A . 8 LEU HD13 1 1 9 2748 1 1 8 LEU HD21 H -8.385 2.335 18.155 1.00 . A A . 8 LEU HD21 1 1 9 2749 1 1 8 LEU HD22 H -9.570 2.343 16.827 1.00 . A A . 8 LEU HD22 1 1 9 2750 1 1 8 LEU HD23 H -10.050 1.776 18.446 1.00 . A A . 8 LEU HD23 1 1 9 2751 1 1 8 LEU HG H -9.584 0.003 16.663 1.00 . A A . 8 LEU HG 1 1 9 2752 1 1 8 LEU N N -5.825 -0.812 15.257 1.00 . A A . 8 LEU N 1 1 9 2753 1 1 8 LEU O O -8.614 -2.723 15.654 1.00 . A A . 8 LEU O 1 1 9 2754 1 1 9 ALA C C -9.845 -0.623 12.191 1.00 . A A . 9 ALA C 1 1 9 2755 1 1 9 ALA CA C -9.393 -1.684 13.197 1.00 . A A . 9 ALA CA 1 1 9 2756 1 1 9 ALA CB C -10.555 -2.235 14.025 1.00 . A A . 9 ALA CB 1 1 9 2757 1 1 9 ALA H H -7.967 -0.270 13.751 1.00 . A A . 9 ALA H 1 1 9 2758 1 1 9 ALA HA H -8.925 -2.508 12.658 1.00 . A A . 9 ALA HA 1 1 9 2759 1 1 9 ALA HB1 H -10.626 -1.683 14.962 1.00 . A A . 9 ALA HB1 1 1 9 2760 1 1 9 ALA HB2 H -11.484 -2.124 13.466 1.00 . A A . 9 ALA HB2 1 1 9 2761 1 1 9 ALA HB3 H -10.382 -3.290 14.237 1.00 . A A . 9 ALA HB3 1 1 9 2762 1 1 9 ALA N N -8.394 -1.112 14.083 1.00 . A A . 9 ALA N 1 1 9 2763 1 1 9 ALA O O -10.631 0.261 12.528 1.00 . A A . 9 ALA O 1 1 9 2764 1 1 10 GLY C C -8.441 0.992 9.481 1.00 . A A . 10 GLY C 1 1 9 2765 1 1 10 GLY CA C -9.668 0.192 9.921 1.00 . A A . 10 GLY CA 1 1 9 2766 1 1 10 GLY H H -8.689 -1.468 10.712 1.00 . A A . 10 GLY H 1 1 9 2767 1 1 10 GLY HA2 H -10.080 -0.349 9.068 1.00 . A A . 10 GLY HA2 1 1 9 2768 1 1 10 GLY HA3 H -10.444 0.873 10.271 1.00 . A A . 10 GLY HA3 1 1 9 2769 1 1 10 GLY N N -9.328 -0.746 10.977 1.00 . A A . 10 GLY N 1 1 9 2770 1 1 10 GLY O O -8.248 1.236 8.290 1.00 . A A . 10 GLY O 1 1 9 2771 1 1 11 TYR C C -5.538 1.416 9.192 1.00 . A A . 11 TYR C 1 1 9 2772 1 1 11 TYR CA C -6.437 2.143 10.194 1.00 . A A . 11 TYR CA 1 1 9 2773 1 1 11 TYR CB C -5.701 2.259 11.530 1.00 . A A . 11 TYR CB 1 1 9 2774 1 1 11 TYR CD1 C -6.428 4.507 12.412 1.00 . A A . 11 TYR CD1 1 1 9 2775 1 1 11 TYR CD2 C -7.054 2.553 13.638 1.00 . A A . 11 TYR CD2 1 1 9 2776 1 1 11 TYR CE1 C -7.102 5.331 13.381 1.00 . A A . 11 TYR CE1 1 1 9 2777 1 1 11 TYR CE2 C -7.727 3.377 14.608 1.00 . A A . 11 TYR CE2 1 1 9 2778 1 1 11 TYR CG C -6.417 3.135 12.560 1.00 . A A . 11 TYR CG 1 1 9 2779 1 1 11 TYR CZ C -7.718 4.727 14.432 1.00 . A A . 11 TYR CZ 1 1 9 2780 1 1 11 TYR H H -7.804 1.173 11.430 1.00 . A A . 11 TYR H 1 1 9 2781 1 1 11 TYR HA H -6.736 3.102 9.771 1.00 . A A . 11 TYR HA 1 1 9 2782 1 1 11 TYR HB2 H -5.567 1.261 11.948 1.00 . A A . 11 TYR HB2 1 1 9 2783 1 1 11 TYR HB3 H -4.706 2.667 11.352 1.00 . A A . 11 TYR HB3 1 1 9 2784 1 1 11 TYR HD1 H -5.926 4.967 11.560 1.00 . A A . 11 TYR HD1 1 1 9 2785 1 1 11 TYR HD2 H -7.045 1.470 13.756 1.00 . A A . 11 TYR HD2 1 1 9 2786 1 1 11 TYR HE1 H -7.118 6.416 13.276 1.00 . A A . 11 TYR HE1 1 1 9 2787 1 1 11 TYR HE2 H -8.233 2.931 15.464 1.00 . A A . 11 TYR HE2 1 1 9 2788 1 1 11 TYR HH H -8.509 6.418 14.970 1.00 . A A . 11 TYR HH 1 1 9 2789 1 1 11 TYR N N -7.641 1.376 10.465 1.00 . A A . 11 TYR N 1 1 9 2790 1 1 11 TYR O O -5.639 0.201 9.028 1.00 . A A . 11 TYR O 1 1 9 2791 1 1 11 TYR OH O -8.354 5.504 15.347 1.00 . A A . 11 TYR OH 1 1 9 2792 1 1 12 MET C C -2.315 1.705 8.064 1.00 . A A . 12 MET C 1 1 9 2793 1 1 12 MET CA C -3.759 1.635 7.566 1.00 . A A . 12 MET CA 1 1 9 2794 1 1 12 MET CB C -3.886 2.410 6.254 1.00 . A A . 12 MET CB 1 1 9 2795 1 1 12 MET CE C -3.114 6.274 5.242 1.00 . A A . 12 MET CE 1 1 9 2796 1 1 12 MET CG C -3.714 3.913 6.486 1.00 . A A . 12 MET CG 1 1 9 2797 1 1 12 MET H H -4.600 3.178 8.686 1.00 . A A . 12 MET H 1 1 9 2798 1 1 12 MET HA H -4.059 0.594 7.443 1.00 . A A . 12 MET HA 1 1 9 2799 1 1 12 MET HB2 H -3.134 2.061 5.546 1.00 . A A . 12 MET HB2 1 1 9 2800 1 1 12 MET HB3 H -4.860 2.217 5.805 1.00 . A A . 12 MET HB3 1 1 9 2801 1 1 12 MET HE1 H -4.164 6.293 4.950 1.00 . A A . 12 MET HE1 1 1 9 2802 1 1 12 MET HE2 H -3.002 6.736 6.223 1.00 . A A . 12 MET HE2 1 1 9 2803 1 1 12 MET HE3 H -2.523 6.825 4.512 1.00 . A A . 12 MET HE3 1 1 9 2804 1 1 12 MET HG2 H -4.675 4.417 6.384 1.00 . A A . 12 MET HG2 1 1 9 2805 1 1 12 MET HG3 H -3.366 4.095 7.502 1.00 . A A . 12 MET HG3 1 1 9 2806 1 1 12 MET N N -4.677 2.190 8.547 1.00 . A A . 12 MET N 1 1 9 2807 1 1 12 MET O O -2.017 2.429 9.013 1.00 . A A . 12 MET O 1 1 9 2808 1 1 12 MET SD S -2.547 4.583 5.313 1.00 . A A . 12 MET SD 1 1 9 2809 1 1 13 ARG C C 0.780 1.693 6.747 1.00 . A A . 13 ARG C 1 1 9 2810 1 1 13 ARG CA C -0.051 0.910 7.766 1.00 . A A . 13 ARG CA 1 1 9 2811 1 1 13 ARG CB C 0.466 -0.529 7.837 1.00 . A A . 13 ARG CB 1 1 9 2812 1 1 13 ARG CD C 0.562 -1.360 10.216 1.00 . A A . 13 ARG CD 1 1 9 2813 1 1 13 ARG CG C -0.261 -1.319 8.927 1.00 . A A . 13 ARG CG 1 1 9 2814 1 1 13 ARG CZ C 1.326 -3.215 11.693 1.00 . A A . 13 ARG CZ 1 1 9 2815 1 1 13 ARG H H -1.708 0.357 6.632 1.00 . A A . 13 ARG H 1 1 9 2816 1 1 13 ARG HA H -0.006 1.376 8.750 1.00 . A A . 13 ARG HA 1 1 9 2817 1 1 13 ARG HB2 H 0.325 -1.017 6.873 1.00 . A A . 13 ARG HB2 1 1 9 2818 1 1 13 ARG HB3 H 1.537 -0.525 8.039 1.00 . A A . 13 ARG HB3 1 1 9 2819 1 1 13 ARG HD2 H 1.612 -1.169 9.993 1.00 . A A . 13 ARG HD2 1 1 9 2820 1 1 13 ARG HD3 H 0.231 -0.572 10.893 1.00 . A A . 13 ARG HD3 1 1 9 2821 1 1 13 ARG HE H -0.414 -3.206 10.682 1.00 . A A . 13 ARG HE 1 1 9 2822 1 1 13 ARG HG2 H -1.232 -0.864 9.125 1.00 . A A . 13 ARG HG2 1 1 9 2823 1 1 13 ARG HG3 H -0.450 -2.335 8.580 1.00 . A A . 13 ARG HG3 1 1 9 2824 1 1 13 ARG HH11 H 2.615 -1.647 11.564 1.00 . A A . 13 ARG HH11 1 1 9 2825 1 1 13 ARG HH12 H 3.133 -2.946 12.588 1.00 . A A . 13 ARG HH12 1 1 9 2826 1 1 13 ARG HH21 H 0.268 -4.919 12.032 1.00 . A A . 13 ARG HH21 1 1 9 2827 1 1 13 ARG HH22 H 1.789 -4.819 12.855 1.00 . A A . 13 ARG HH22 1 1 9 2828 1 1 13 ARG N N -1.457 0.943 7.402 1.00 . A A . 13 ARG N 1 1 9 2829 1 1 13 ARG NE N 0.416 -2.680 10.868 1.00 . A A . 13 ARG NE 1 1 9 2830 1 1 13 ARG NH1 N 2.453 -2.546 11.972 1.00 . A A . 13 ARG NH1 1 1 9 2831 1 1 13 ARG NH2 N 1.110 -4.419 12.240 1.00 . A A . 13 ARG NH2 1 1 9 2832 1 1 13 ARG O O 0.980 1.237 5.623 1.00 . A A . 13 ARG O 1 1 9 2833 1 1 14 THR C C 3.385 3.037 6.005 1.00 . A A . 14 THR C 1 1 9 2834 1 1 14 THR CA C 2.045 3.709 6.317 1.00 . A A . 14 THR CA 1 1 9 2835 1 1 14 THR CB C 2.193 5.070 6.999 1.00 . A A . 14 THR CB 1 1 9 2836 1 1 14 THR CG2 C 0.880 5.854 7.031 1.00 . A A . 14 THR CG2 1 1 9 2837 1 1 14 THR H H 1.073 3.223 8.094 1.00 . A A . 14 THR H 1 1 9 2838 1 1 14 THR HA H 1.522 3.831 5.368 1.00 . A A . 14 THR HA 1 1 9 2839 1 1 14 THR HB H 2.985 5.656 6.533 1.00 . A A . 14 THR HB 1 1 9 2840 1 1 14 THR HG1 H 3.256 4.180 8.442 1.00 . A A . 14 THR HG1 1 1 9 2841 1 1 14 THR HG21 H 0.089 5.258 6.573 1.00 . A A . 14 THR HG21 1 1 9 2842 1 1 14 THR HG22 H 0.614 6.077 8.064 1.00 . A A . 14 THR HG22 1 1 9 2843 1 1 14 THR HG23 H 0.999 6.786 6.478 1.00 . A A . 14 THR HG23 1 1 9 2844 1 1 14 THR N N 1.241 2.858 7.177 1.00 . A A . 14 THR N 1 1 9 2845 1 1 14 THR O O 3.568 1.853 6.281 1.00 . A A . 14 THR O 1 1 9 2846 1 1 14 THR OG1 O 2.437 4.747 8.366 1.00 . A A . 14 THR OG1 1 1 9 2847 1 1 15 ALA C C 6.528 3.430 6.299 1.00 . A A . 15 ALA C 1 1 9 2848 1 1 15 ALA CA C 5.604 3.320 5.084 1.00 . A A . 15 ALA CA 1 1 9 2849 1 1 15 ALA CB C 6.137 4.088 3.874 1.00 . A A . 15 ALA CB 1 1 9 2850 1 1 15 ALA H H 4.130 4.785 5.215 1.00 . A A . 15 ALA H 1 1 9 2851 1 1 15 ALA HA H 5.496 2.269 4.815 1.00 . A A . 15 ALA HA 1 1 9 2852 1 1 15 ALA HB1 H 5.685 5.079 3.844 1.00 . A A . 15 ALA HB1 1 1 9 2853 1 1 15 ALA HB2 H 7.220 4.183 3.953 1.00 . A A . 15 ALA HB2 1 1 9 2854 1 1 15 ALA HB3 H 5.886 3.546 2.961 1.00 . A A . 15 ALA HB3 1 1 9 2855 1 1 15 ALA N N 4.286 3.823 5.436 1.00 . A A . 15 ALA N 1 1 9 2856 1 1 15 ALA O O 7.731 3.202 6.190 1.00 . A A . 15 ALA O 1 1 9 2857 1 1 16 ASP C C 6.236 2.850 9.656 1.00 . A A . 16 ASP C 1 1 9 2858 1 1 16 ASP CA C 6.684 3.923 8.661 1.00 . A A . 16 ASP CA 1 1 9 2859 1 1 16 ASP CB C 6.439 5.291 9.301 1.00 . A A . 16 ASP CB 1 1 9 2860 1 1 16 ASP CG C 7.626 6.255 9.239 1.00 . A A . 16 ASP CG 1 1 9 2861 1 1 16 ASP H H 4.949 3.963 7.508 1.00 . A A . 16 ASP H 1 1 9 2862 1 1 16 ASP HA H 7.729 3.813 8.372 1.00 . A A . 16 ASP HA 1 1 9 2863 1 1 16 ASP HB2 H 5.585 5.758 8.809 1.00 . A A . 16 ASP HB2 1 1 9 2864 1 1 16 ASP HB3 H 6.165 5.144 10.345 1.00 . A A . 16 ASP HB3 1 1 9 2865 1 1 16 ASP N N 5.929 3.780 7.428 1.00 . A A . 16 ASP N 1 1 9 2866 1 1 16 ASP O O 6.962 2.526 10.594 1.00 . A A . 16 ASP O 1 1 9 2867 1 1 16 ASP OD1 O 7.939 6.698 8.112 1.00 . A A . 16 ASP OD1 1 1 9 2868 1 1 16 ASP OD2 O 8.193 6.528 10.319 1.00 . A A . 16 ASP OD2 1 1 9 2869 1 1 17 GLY C C 3.489 1.893 11.272 1.00 . A A . 17 GLY C 1 1 9 2870 1 1 17 GLY CA C 4.489 1.298 10.278 1.00 . A A . 17 GLY CA 1 1 9 2871 1 1 17 GLY H H 4.458 2.597 8.650 1.00 . A A . 17 GLY H 1 1 9 2872 1 1 17 GLY HA2 H 3.995 0.537 9.673 1.00 . A A . 17 GLY HA2 1 1 9 2873 1 1 17 GLY HA3 H 5.294 0.801 10.820 1.00 . A A . 17 GLY HA3 1 1 9 2874 1 1 17 GLY N N 5.042 2.328 9.416 1.00 . A A . 17 GLY N 1 1 9 2875 1 1 17 GLY O O 2.904 1.171 12.078 1.00 . A A . 17 GLY O 1 1 9 2876 1 1 18 ARG C C 0.968 3.758 11.557 1.00 . A A . 18 ARG C 1 1 9 2877 1 1 18 ARG CA C 2.405 3.905 12.063 1.00 . A A . 18 ARG CA 1 1 9 2878 1 1 18 ARG CB C 2.756 5.391 12.156 1.00 . A A . 18 ARG CB 1 1 9 2879 1 1 18 ARG CD C 4.573 5.382 13.904 1.00 . A A . 18 ARG CD 1 1 9 2880 1 1 18 ARG CG C 4.250 5.586 12.423 1.00 . A A . 18 ARG CG 1 1 9 2881 1 1 18 ARG CZ C 6.636 4.802 15.176 1.00 . A A . 18 ARG CZ 1 1 9 2882 1 1 18 ARG H H 3.803 3.785 10.524 1.00 . A A . 18 ARG H 1 1 9 2883 1 1 18 ARG HA H 2.529 3.426 13.034 1.00 . A A . 18 ARG HA 1 1 9 2884 1 1 18 ARG HB2 H 2.480 5.893 11.228 1.00 . A A . 18 ARG HB2 1 1 9 2885 1 1 18 ARG HB3 H 2.177 5.857 12.953 1.00 . A A . 18 ARG HB3 1 1 9 2886 1 1 18 ARG HD2 H 4.146 6.193 14.493 1.00 . A A . 18 ARG HD2 1 1 9 2887 1 1 18 ARG HD3 H 4.120 4.457 14.260 1.00 . A A . 18 ARG HD3 1 1 9 2888 1 1 18 ARG HE H 6.621 5.721 13.385 1.00 . A A . 18 ARG HE 1 1 9 2889 1 1 18 ARG HG2 H 4.825 4.882 11.821 1.00 . A A . 18 ARG HG2 1 1 9 2890 1 1 18 ARG HG3 H 4.550 6.588 12.116 1.00 . A A . 18 ARG HG3 1 1 9 2891 1 1 18 ARG HH11 H 4.899 4.271 16.089 1.00 . A A . 18 ARG HH11 1 1 9 2892 1 1 18 ARG HH12 H 6.342 3.874 16.961 1.00 . A A . 18 ARG HH12 1 1 9 2893 1 1 18 ARG HH21 H 8.525 5.198 14.535 1.00 . A A . 18 ARG HH21 1 1 9 2894 1 1 18 ARG HH22 H 8.419 4.405 16.071 1.00 . A A . 18 ARG HH22 1 1 9 2895 1 1 18 ARG N N 3.324 3.205 11.182 1.00 . A A . 18 ARG N 1 1 9 2896 1 1 18 ARG NE N 6.040 5.333 14.100 1.00 . A A . 18 ARG NE 1 1 9 2897 1 1 18 ARG NH1 N 5.897 4.271 16.159 1.00 . A A . 18 ARG NH1 1 1 9 2898 1 1 18 ARG NH2 N 7.973 4.802 15.268 1.00 . A A . 18 ARG NH2 1 1 9 2899 1 1 18 ARG O O 0.615 4.307 10.514 1.00 . A A . 18 ARG O 1 1 9 2900 1 1 19 CYS C C -1.896 4.148 11.816 1.00 . A A . 19 CYS C 1 1 9 2901 1 1 19 CYS CA C -1.210 2.789 11.962 1.00 . A A . 19 CYS CA 1 1 9 2902 1 1 19 CYS CB C -1.919 1.898 12.984 1.00 . A A . 19 CYS CB 1 1 9 2903 1 1 19 CYS H H 0.476 2.574 13.166 1.00 . A A . 19 CYS H 1 1 9 2904 1 1 19 CYS HA H -1.206 2.254 11.012 1.00 . A A . 19 CYS HA 1 1 9 2905 1 1 19 CYS HB2 H -1.824 2.354 13.969 1.00 . A A . 19 CYS HB2 1 1 9 2906 1 1 19 CYS HB3 H -2.982 1.871 12.745 1.00 . A A . 19 CYS HB3 1 1 9 2907 1 1 19 CYS N N 0.180 3.015 12.320 1.00 . A A . 19 CYS N 1 1 9 2908 1 1 19 CYS O O -2.176 4.816 12.811 1.00 . A A . 19 CYS O 1 1 9 2909 1 1 19 CYS SG S -1.294 0.180 13.069 1.00 . A A . 19 CYS SG 1 1 9 2910 1 1 20 LYS C C -4.264 5.536 9.928 1.00 . A A . 20 LYS C 1 1 9 2911 1 1 20 LYS CA C -2.796 5.786 10.281 1.00 . A A . 20 LYS CA 1 1 9 2912 1 1 20 LYS CB C -2.026 6.549 9.201 1.00 . A A . 20 LYS CB 1 1 9 2913 1 1 20 LYS CD C -0.104 7.557 10.484 1.00 . A A . 20 LYS CD 1 1 9 2914 1 1 20 LYS CE C 0.523 8.852 11.005 1.00 . A A . 20 LYS CE 1 1 9 2915 1 1 20 LYS CG C -1.424 7.838 9.763 1.00 . A A . 20 LYS CG 1 1 9 2916 1 1 20 LYS H H -1.918 3.969 9.765 1.00 . A A . 20 LYS H 1 1 9 2917 1 1 20 LYS HA H -2.757 6.387 11.189 1.00 . A A . 20 LYS HA 1 1 9 2918 1 1 20 LYS HB2 H -1.233 5.917 8.799 1.00 . A A . 20 LYS HB2 1 1 9 2919 1 1 20 LYS HB3 H -2.694 6.786 8.372 1.00 . A A . 20 LYS HB3 1 1 9 2920 1 1 20 LYS HD2 H -0.277 6.873 11.315 1.00 . A A . 20 LYS HD2 1 1 9 2921 1 1 20 LYS HD3 H 0.589 7.062 9.803 1.00 . A A . 20 LYS HD3 1 1 9 2922 1 1 20 LYS HE2 H 0.979 9.399 10.180 1.00 . A A . 20 LYS HE2 1 1 9 2923 1 1 20 LYS HE3 H -0.251 9.494 11.424 1.00 . A A . 20 LYS HE3 1 1 9 2924 1 1 20 LYS HG2 H -1.256 8.548 8.954 1.00 . A A . 20 LYS HG2 1 1 9 2925 1 1 20 LYS HG3 H -2.128 8.301 10.454 1.00 . A A . 20 LYS HG3 1 1 9 2926 1 1 20 LYS HZ1 H 1.679 7.567 12.096 1.00 . A A . 20 LYS HZ1 1 1 9 2927 1 1 20 LYS HZ2 H 2.405 8.997 11.789 1.00 . A A . 20 LYS HZ2 1 1 9 2928 1 1 20 LYS HZ3 H 1.232 8.904 12.921 1.00 . A A . 20 LYS HZ3 1 1 9 2929 1 1 20 LYS N N -2.148 4.518 10.569 1.00 . A A . 20 LYS N 1 1 9 2930 1 1 20 LYS NZ N 1.542 8.556 12.036 1.00 . A A . 20 LYS NZ 1 1 9 2931 1 1 20 LYS O O -4.675 4.391 9.746 1.00 . A A . 20 LYS O 1 1 9 2932 1 1 21 PRO C C -6.648 6.271 8.027 1.00 . A A . 21 PRO C 1 1 9 2933 1 1 21 PRO CA C -6.446 6.567 9.515 1.00 . A A . 21 PRO CA 1 1 9 2934 1 1 21 PRO CB C -7.031 7.905 9.939 1.00 . A A . 21 PRO CB 1 1 9 2935 1 1 21 PRO CD C -4.579 8.026 10.050 1.00 . A A . 21 PRO CD 1 1 9 2936 1 1 21 PRO CG C -5.852 8.858 10.055 1.00 . A A . 21 PRO CG 1 1 9 2937 1 1 21 PRO HA H -6.869 5.805 10.005 1.00 . A A . 21 PRO HA 1 1 9 2938 1 1 21 PRO HB2 H -7.753 8.265 9.207 1.00 . A A . 21 PRO HB2 1 1 9 2939 1 1 21 PRO HB3 H -7.557 7.817 10.889 1.00 . A A . 21 PRO HB3 1 1 9 2940 1 1 21 PRO HD2 H -3.901 8.344 9.259 1.00 . A A . 21 PRO HD2 1 1 9 2941 1 1 21 PRO HD3 H -4.038 8.125 10.991 1.00 . A A . 21 PRO HD3 1 1 9 2942 1 1 21 PRO HG2 H -5.849 9.564 9.225 1.00 . A A . 21 PRO HG2 1 1 9 2943 1 1 21 PRO HG3 H -5.923 9.443 10.972 1.00 . A A . 21 PRO HG3 1 1 9 2944 1 1 21 PRO N N -5.033 6.654 9.841 1.00 . A A . 21 PRO N 1 1 9 2945 1 1 21 PRO O O -5.872 6.727 7.189 1.00 . A A . 21 PRO O 1 1 9 2946 1 1 22 THR C C -9.167 5.995 5.849 1.00 . A A . 22 THR C 1 1 9 2947 1 1 22 THR CA C -8.008 5.146 6.374 1.00 . A A . 22 THR CA 1 1 9 2948 1 1 22 THR CB C -8.289 3.643 6.335 1.00 . A A . 22 THR CB 1 1 9 2949 1 1 22 THR CG2 C -8.078 3.043 4.943 1.00 . A A . 22 THR CG2 1 1 9 2950 1 1 22 THR H H -8.320 5.142 8.434 1.00 . A A . 22 THR H 1 1 9 2951 1 1 22 THR HA H -7.141 5.371 5.752 1.00 . A A . 22 THR HA 1 1 9 2952 1 1 22 THR HB H -9.291 3.424 6.705 1.00 . A A . 22 THR HB 1 1 9 2953 1 1 22 THR HG1 H -6.362 3.458 6.845 1.00 . A A . 22 THR HG1 1 1 9 2954 1 1 22 THR HG21 H -8.618 3.638 4.206 1.00 . A A . 22 THR HG21 1 1 9 2955 1 1 22 THR HG22 H -7.016 3.046 4.703 1.00 . A A . 22 THR HG22 1 1 9 2956 1 1 22 THR HG23 H -8.452 2.019 4.927 1.00 . A A . 22 THR HG23 1 1 9 2957 1 1 22 THR N N -7.694 5.508 7.745 1.00 . A A . 22 THR N 1 1 9 2958 1 1 22 THR O O -9.678 5.749 4.758 1.00 . A A . 22 THR O 1 1 9 2959 1 1 22 THR OG1 O -7.244 3.073 7.119 1.00 . A A . 22 THR OG1 1 1 9 2960 1 1 23 PHE C C -10.119 9.258 5.935 1.00 . A A . 23 PHE C 1 1 9 2961 1 1 23 PHE CA C -10.641 7.863 6.284 1.00 . A A . 23 PHE CA 1 1 9 2962 1 1 23 PHE CB C -11.565 7.967 7.499 1.00 . A A . 23 PHE CB 1 1 9 2963 1 1 23 PHE CD1 C -10.502 9.675 8.990 1.00 . A A . 23 PHE CD1 1 1 9 2964 1 1 23 PHE CD2 C -10.568 7.442 9.736 1.00 . A A . 23 PHE CD2 1 1 9 2965 1 1 23 PHE CE1 C -9.841 10.055 10.188 1.00 . A A . 23 PHE CE1 1 1 9 2966 1 1 23 PHE CE2 C -9.906 7.822 10.933 1.00 . A A . 23 PHE CE2 1 1 9 2967 1 1 23 PHE CG C -10.852 8.376 8.790 1.00 . A A . 23 PHE CG 1 1 9 2968 1 1 23 PHE CZ C -9.557 9.121 11.134 1.00 . A A . 23 PHE CZ 1 1 9 2969 1 1 23 PHE H H -9.131 7.169 7.540 1.00 . A A . 23 PHE H 1 1 9 2970 1 1 23 PHE HA H -11.128 7.430 5.410 1.00 . A A . 23 PHE HA 1 1 9 2971 1 1 23 PHE HB2 H -12.351 8.690 7.285 1.00 . A A . 23 PHE HB2 1 1 9 2972 1 1 23 PHE HB3 H -12.052 7.003 7.655 1.00 . A A . 23 PHE HB3 1 1 9 2973 1 1 23 PHE HD1 H -10.731 10.424 8.232 1.00 . A A . 23 PHE HD1 1 1 9 2974 1 1 23 PHE HD2 H -10.848 6.401 9.575 1.00 . A A . 23 PHE HD2 1 1 9 2975 1 1 23 PHE HE1 H -9.561 11.097 10.348 1.00 . A A . 23 PHE HE1 1 1 9 2976 1 1 23 PHE HE2 H -9.678 7.073 11.692 1.00 . A A . 23 PHE HE2 1 1 9 2977 1 1 23 PHE HZ H -9.048 9.413 12.053 1.00 . A A . 23 PHE HZ 1 1 9 2978 1 1 23 PHE N N -9.551 6.976 6.654 1.00 . A A . 23 PHE N 1 1 9 2979 1 1 23 PHE O O -9.829 9.544 4.775 1.00 . A A . 23 PHE O 1 1 10 2980 1 1 1 GLU C C -1.316 -6.686 18.857 1.00 . A A . 1 GLU C 1 1 10 2981 1 1 1 GLU CA C -0.280 -6.106 19.822 1.00 . A A . 1 GLU CA 1 1 10 2982 1 1 1 GLU CB C -0.954 -5.276 20.916 1.00 . A A . 1 GLU CB 1 1 10 2983 1 1 1 GLU CD C -0.973 -4.698 23.371 1.00 . A A . 1 GLU CD 1 1 10 2984 1 1 1 GLU CG C -0.333 -5.565 22.284 1.00 . A A . 1 GLU CG 1 1 10 2985 1 1 1 GLU HA H 0.287 -6.914 20.285 1.00 . A A . 1 GLU HA 1 1 10 2986 1 1 1 GLU HB2 H -0.856 -4.215 20.685 1.00 . A A . 1 GLU HB2 1 1 10 2987 1 1 1 GLU HB3 H -2.020 -5.499 20.942 1.00 . A A . 1 GLU HB3 1 1 10 2988 1 1 1 GLU HG2 H -0.462 -6.618 22.531 1.00 . A A . 1 GLU HG2 1 1 10 2989 1 1 1 GLU HG3 H 0.740 -5.375 22.248 1.00 . A A . 1 GLU HG3 1 1 10 2990 1 1 1 GLU N N 0.698 -5.315 19.095 1.00 . A A . 1 GLU N 1 1 10 2991 1 1 1 GLU O O -1.431 -7.903 18.721 1.00 . A A . 1 GLU O 1 1 10 2992 1 1 1 GLU OE1 O -0.636 -3.495 23.409 1.00 . A A . 1 GLU OE1 1 1 10 2993 1 1 1 GLU OE2 O -1.784 -5.258 24.139 1.00 . A A . 1 GLU OE2 1 1 10 2994 1 1 2 ASN C C -2.403 -6.865 16.061 1.00 . A A . 2 ASN C 1 1 10 2995 1 1 2 ASN CA C -3.068 -6.193 17.264 1.00 . A A . 2 ASN CA 1 1 10 2996 1 1 2 ASN CB C -3.858 -4.986 16.755 1.00 . A A . 2 ASN CB 1 1 10 2997 1 1 2 ASN CG C -4.583 -4.281 17.904 1.00 . A A . 2 ASN CG 1 1 10 2998 1 1 2 ASN H H -1.945 -4.798 18.329 1.00 . A A . 2 ASN H 1 1 10 2999 1 1 2 ASN HA H -3.717 -6.873 17.816 1.00 . A A . 2 ASN HA 1 1 10 3000 1 1 2 ASN HB2 H -3.183 -4.286 16.263 1.00 . A A . 2 ASN HB2 1 1 10 3001 1 1 2 ASN HB3 H -4.582 -5.310 16.008 1.00 . A A . 2 ASN HB3 1 1 10 3002 1 1 2 ASN HD21 H -6.091 -5.616 17.709 1.00 . A A . 2 ASN HD21 1 1 10 3003 1 1 2 ASN HD22 H -6.308 -4.430 18.953 1.00 . A A . 2 ASN HD22 1 1 10 3004 1 1 2 ASN N N -2.045 -5.787 18.212 1.00 . A A . 2 ASN N 1 1 10 3005 1 1 2 ASN ND2 N -5.758 -4.820 18.214 1.00 . A A . 2 ASN ND2 1 1 10 3006 1 1 2 ASN O O -1.179 -6.955 15.993 1.00 . A A . 2 ASN O 1 1 10 3007 1 1 2 ASN OD1 O -4.106 -3.311 18.471 1.00 . A A . 2 ASN OD1 1 1 10 3008 1 1 3 PHE C C -2.770 -7.029 12.745 1.00 . A A . 3 PHE C 1 1 10 3009 1 1 3 PHE CA C -2.750 -7.980 13.943 1.00 . A A . 3 PHE CA 1 1 10 3010 1 1 3 PHE CB C -3.692 -9.154 13.662 1.00 . A A . 3 PHE CB 1 1 10 3011 1 1 3 PHE CD1 C -2.407 -11.161 14.433 1.00 . A A . 3 PHE CD1 1 1 10 3012 1 1 3 PHE CD2 C -2.898 -10.974 12.137 1.00 . A A . 3 PHE CD2 1 1 10 3013 1 1 3 PHE CE1 C -1.740 -12.391 14.190 1.00 . A A . 3 PHE CE1 1 1 10 3014 1 1 3 PHE CE2 C -2.231 -12.204 11.894 1.00 . A A . 3 PHE CE2 1 1 10 3015 1 1 3 PHE CG C -2.972 -10.479 13.401 1.00 . A A . 3 PHE CG 1 1 10 3016 1 1 3 PHE CZ C -1.666 -12.886 12.926 1.00 . A A . 3 PHE CZ 1 1 10 3017 1 1 3 PHE H H -4.237 -7.242 15.202 1.00 . A A . 3 PHE H 1 1 10 3018 1 1 3 PHE HA H -1.725 -8.290 14.142 1.00 . A A . 3 PHE HA 1 1 10 3019 1 1 3 PHE HB2 H -4.363 -9.279 14.511 1.00 . A A . 3 PHE HB2 1 1 10 3020 1 1 3 PHE HB3 H -4.311 -8.912 12.799 1.00 . A A . 3 PHE HB3 1 1 10 3021 1 1 3 PHE HD1 H -2.467 -10.764 15.446 1.00 . A A . 3 PHE HD1 1 1 10 3022 1 1 3 PHE HD2 H -3.351 -10.428 11.309 1.00 . A A . 3 PHE HD2 1 1 10 3023 1 1 3 PHE HE1 H -1.287 -12.937 15.017 1.00 . A A . 3 PHE HE1 1 1 10 3024 1 1 3 PHE HE2 H -2.171 -12.601 10.881 1.00 . A A . 3 PHE HE2 1 1 10 3025 1 1 3 PHE HZ H -1.154 -13.830 12.740 1.00 . A A . 3 PHE HZ 1 1 10 3026 1 1 3 PHE N N -3.241 -7.319 15.140 1.00 . A A . 3 PHE N 1 1 10 3027 1 1 3 PHE O O -3.212 -5.887 12.861 1.00 . A A . 3 PHE O 1 1 10 3028 1 1 4 ASN C C -1.355 -5.517 10.626 1.00 . A A . 4 ASN C 1 1 10 3029 1 1 4 ASN CA C -2.241 -6.745 10.402 1.00 . A A . 4 ASN CA 1 1 10 3030 1 1 4 ASN CB C -3.637 -6.254 10.012 1.00 . A A . 4 ASN CB 1 1 10 3031 1 1 4 ASN CG C -3.588 -5.421 8.731 1.00 . A A . 4 ASN CG 1 1 10 3032 1 1 4 ASN H H -1.927 -8.464 11.533 1.00 . A A . 4 ASN H 1 1 10 3033 1 1 4 ASN HA H -1.841 -7.414 9.641 1.00 . A A . 4 ASN HA 1 1 10 3034 1 1 4 ASN HB2 H -4.300 -7.108 9.871 1.00 . A A . 4 ASN HB2 1 1 10 3035 1 1 4 ASN HB3 H -4.057 -5.658 10.823 1.00 . A A . 4 ASN HB3 1 1 10 3036 1 1 4 ASN HD21 H -4.376 -3.870 9.765 1.00 . A A . 4 ASN HD21 1 1 10 3037 1 1 4 ASN HD22 H -4.052 -3.556 8.093 1.00 . A A . 4 ASN HD22 1 1 10 3038 1 1 4 ASN N N -2.285 -7.535 11.621 1.00 . A A . 4 ASN N 1 1 10 3039 1 1 4 ASN ND2 N -4.043 -4.180 8.875 1.00 . A A . 4 ASN ND2 1 1 10 3040 1 1 4 ASN O O -1.696 -4.415 10.200 1.00 . A A . 4 ASN O 1 1 10 3041 1 1 4 ASN OD1 O -3.165 -5.875 7.680 1.00 . A A . 4 ASN OD1 1 1 10 3042 1 1 5 GLY C C 0.613 -4.249 13.048 1.00 . A A . 5 GLY C 1 1 10 3043 1 1 5 GLY CA C 0.702 -4.678 11.582 1.00 . A A . 5 GLY CA 1 1 10 3044 1 1 5 GLY H H 0.034 -6.650 11.639 1.00 . A A . 5 GLY H 1 1 10 3045 1 1 5 GLY HA2 H 1.716 -5.007 11.357 1.00 . A A . 5 GLY HA2 1 1 10 3046 1 1 5 GLY HA3 H 0.493 -3.825 10.936 1.00 . A A . 5 GLY HA3 1 1 10 3047 1 1 5 GLY N N -0.235 -5.750 11.296 1.00 . A A . 5 GLY N 1 1 10 3048 1 1 5 GLY O O 1.626 -3.933 13.669 1.00 . A A . 5 GLY O 1 1 10 3049 1 1 6 GLY C C -1.687 -2.593 15.019 1.00 . A A . 6 GLY C 1 1 10 3050 1 1 6 GLY CA C -0.844 -3.867 14.941 1.00 . A A . 6 GLY CA 1 1 10 3051 1 1 6 GLY H H -1.428 -4.512 13.048 1.00 . A A . 6 GLY H 1 1 10 3052 1 1 6 GLY HA2 H -1.352 -4.677 15.466 1.00 . A A . 6 GLY HA2 1 1 10 3053 1 1 6 GLY HA3 H 0.109 -3.708 15.445 1.00 . A A . 6 GLY HA3 1 1 10 3054 1 1 6 GLY N N -0.609 -4.253 13.560 1.00 . A A . 6 GLY N 1 1 10 3055 1 1 6 GLY O O -1.325 -1.647 15.716 1.00 . A A . 6 GLY O 1 1 10 3056 1 1 7 CYS C C -4.905 -1.792 15.150 1.00 . A A . 7 CYS C 1 1 10 3057 1 1 7 CYS CA C -3.694 -1.468 14.273 1.00 . A A . 7 CYS CA 1 1 10 3058 1 1 7 CYS CB C -4.106 -1.098 12.847 1.00 . A A . 7 CYS CB 1 1 10 3059 1 1 7 CYS H H -3.084 -3.384 13.730 1.00 . A A . 7 CYS H 1 1 10 3060 1 1 7 CYS HA H -3.137 -0.624 14.679 1.00 . A A . 7 CYS HA 1 1 10 3061 1 1 7 CYS HB2 H -4.534 -1.979 12.367 1.00 . A A . 7 CYS HB2 1 1 10 3062 1 1 7 CYS HB3 H -4.894 -0.348 12.894 1.00 . A A . 7 CYS HB3 1 1 10 3063 1 1 7 CYS N N -2.797 -2.610 14.294 1.00 . A A . 7 CYS N 1 1 10 3064 1 1 7 CYS O O -4.975 -2.867 15.746 1.00 . A A . 7 CYS O 1 1 10 3065 1 1 7 CYS SG S -2.749 -0.461 11.797 1.00 . A A . 7 CYS SG 1 1 10 3066 1 1 8 LEU C C -8.099 -1.715 15.156 1.00 . A A . 8 LEU C 1 1 10 3067 1 1 8 LEU CA C -7.033 -1.014 15.999 1.00 . A A . 8 LEU CA 1 1 10 3068 1 1 8 LEU CB C -7.488 0.327 16.576 1.00 . A A . 8 LEU CB 1 1 10 3069 1 1 8 LEU CD1 C -8.810 -0.623 18.502 1.00 . A A . 8 LEU CD1 1 1 10 3070 1 1 8 LEU CD2 C -9.251 1.741 17.695 1.00 . A A . 8 LEU CD2 1 1 10 3071 1 1 8 LEU CG C -8.836 0.322 17.300 1.00 . A A . 8 LEU CG 1 1 10 3072 1 1 8 LEU H H -5.763 0.028 14.717 1.00 . A A . 8 LEU H 1 1 10 3073 1 1 8 LEU HA H -6.779 -1.658 16.842 1.00 . A A . 8 LEU HA 1 1 10 3074 1 1 8 LEU HB2 H -6.726 0.678 17.272 1.00 . A A . 8 LEU HB2 1 1 10 3075 1 1 8 LEU HB3 H -7.537 1.052 15.764 1.00 . A A . 8 LEU HB3 1 1 10 3076 1 1 8 LEU HD11 H -8.291 -1.542 18.231 1.00 . A A . 8 LEU HD11 1 1 10 3077 1 1 8 LEU HD12 H -8.290 -0.142 19.331 1.00 . A A . 8 LEU HD12 1 1 10 3078 1 1 8 LEU HD13 H -9.831 -0.858 18.802 1.00 . A A . 8 LEU HD13 1 1 10 3079 1 1 8 LEU HD21 H -8.369 2.309 17.990 1.00 . A A . 8 LEU HD21 1 1 10 3080 1 1 8 LEU HD22 H -9.730 2.229 16.846 1.00 . A A . 8 LEU HD22 1 1 10 3081 1 1 8 LEU HD23 H -9.951 1.696 18.529 1.00 . A A . 8 LEU HD23 1 1 10 3082 1 1 8 LEU HG H -9.593 -0.054 16.610 1.00 . A A . 8 LEU HG 1 1 10 3083 1 1 8 LEU N N -5.828 -0.843 15.204 1.00 . A A . 8 LEU N 1 1 10 3084 1 1 8 LEU O O -8.620 -2.758 15.549 1.00 . A A . 8 LEU O 1 1 10 3085 1 1 9 ALA C C -9.847 -0.584 12.134 1.00 . A A . 9 ALA C 1 1 10 3086 1 1 9 ALA CA C -9.389 -1.670 13.111 1.00 . A A . 9 ALA CA 1 1 10 3087 1 1 9 ALA CB C -10.547 -2.248 13.923 1.00 . A A . 9 ALA CB 1 1 10 3088 1 1 9 ALA H H -7.965 -0.268 13.700 1.00 . A A . 9 ALA H 1 1 10 3089 1 1 9 ALA HA H -8.916 -2.475 12.549 1.00 . A A . 9 ALA HA 1 1 10 3090 1 1 9 ALA HB1 H -10.701 -1.646 14.819 1.00 . A A . 9 ALA HB1 1 1 10 3091 1 1 9 ALA HB2 H -11.455 -2.240 13.320 1.00 . A A . 9 ALA HB2 1 1 10 3092 1 1 9 ALA HB3 H -10.313 -3.274 14.212 1.00 . A A . 9 ALA HB3 1 1 10 3093 1 1 9 ALA N N -8.393 -1.115 14.012 1.00 . A A . 9 ALA N 1 1 10 3094 1 1 9 ALA O O -10.674 0.258 12.480 1.00 . A A . 9 ALA O 1 1 10 3095 1 1 10 GLY C C -8.402 1.144 9.491 1.00 . A A . 10 GLY C 1 1 10 3096 1 1 10 GLY CA C -9.629 0.329 9.906 1.00 . A A . 10 GLY CA 1 1 10 3097 1 1 10 GLY H H -8.617 -1.327 10.661 1.00 . A A . 10 GLY H 1 1 10 3098 1 1 10 GLY HA2 H -10.037 -0.186 9.036 1.00 . A A . 10 GLY HA2 1 1 10 3099 1 1 10 GLY HA3 H -10.407 0.998 10.274 1.00 . A A . 10 GLY HA3 1 1 10 3100 1 1 10 GLY N N -9.288 -0.638 10.934 1.00 . A A . 10 GLY N 1 1 10 3101 1 1 10 GLY O O -8.246 1.488 8.321 1.00 . A A . 10 GLY O 1 1 10 3102 1 1 11 TYR C C -5.432 1.472 9.249 1.00 . A A . 11 TYR C 1 1 10 3103 1 1 11 TYR CA C -6.354 2.199 10.229 1.00 . A A . 11 TYR CA 1 1 10 3104 1 1 11 TYR CB C -5.648 2.321 11.580 1.00 . A A . 11 TYR CB 1 1 10 3105 1 1 11 TYR CD1 C -6.436 4.538 12.486 1.00 . A A . 11 TYR CD1 1 1 10 3106 1 1 11 TYR CD2 C -7.065 2.549 13.653 1.00 . A A . 11 TYR CD2 1 1 10 3107 1 1 11 TYR CE1 C -7.152 5.331 13.452 1.00 . A A . 11 TYR CE1 1 1 10 3108 1 1 11 TYR CE2 C -7.781 3.343 14.619 1.00 . A A . 11 TYR CE2 1 1 10 3109 1 1 11 TYR CG C -6.408 3.164 12.607 1.00 . A A . 11 TYR CG 1 1 10 3110 1 1 11 TYR CZ C -7.789 4.694 14.470 1.00 . A A . 11 TYR CZ 1 1 10 3111 1 1 11 TYR H H -7.697 1.149 11.425 1.00 . A A . 11 TYR H 1 1 10 3112 1 1 11 TYR HA H -6.647 3.158 9.798 1.00 . A A . 11 TYR HA 1 1 10 3113 1 1 11 TYR HB2 H -5.494 1.322 11.989 1.00 . A A . 11 TYR HB2 1 1 10 3114 1 1 11 TYR HB3 H -4.662 2.759 11.425 1.00 . A A . 11 TYR HB3 1 1 10 3115 1 1 11 TYR HD1 H -5.917 5.023 11.659 1.00 . A A . 11 TYR HD1 1 1 10 3116 1 1 11 TYR HD2 H -7.044 1.464 13.748 1.00 . A A . 11 TYR HD2 1 1 10 3117 1 1 11 TYR HE1 H -7.182 6.417 13.368 1.00 . A A . 11 TYR HE1 1 1 10 3118 1 1 11 TYR HE2 H -8.304 2.870 15.450 1.00 . A A . 11 TYR HE2 1 1 10 3119 1 1 11 TYR HH H -9.167 4.889 15.827 1.00 . A A . 11 TYR HH 1 1 10 3120 1 1 11 TYR N N -7.562 1.431 10.475 1.00 . A A . 11 TYR N 1 1 10 3121 1 1 11 TYR O O -5.510 0.253 9.107 1.00 . A A . 11 TYR O 1 1 10 3122 1 1 11 TYR OH O -8.464 5.443 15.382 1.00 . A A . 11 TYR OH 1 1 10 3123 1 1 12 MET C C -2.204 1.831 8.128 1.00 . A A . 12 MET C 1 1 10 3124 1 1 12 MET CA C -3.646 1.696 7.634 1.00 . A A . 12 MET CA 1 1 10 3125 1 1 12 MET CB C -3.798 2.423 6.296 1.00 . A A . 12 MET CB 1 1 10 3126 1 1 12 MET CE C -3.013 6.399 5.858 1.00 . A A . 12 MET CE 1 1 10 3127 1 1 12 MET CG C -3.984 3.927 6.508 1.00 . A A . 12 MET CG 1 1 10 3128 1 1 12 MET H H -4.525 3.241 8.718 1.00 . A A . 12 MET H 1 1 10 3129 1 1 12 MET HA H -3.909 0.642 7.544 1.00 . A A . 12 MET HA 1 1 10 3130 1 1 12 MET HB2 H -2.916 2.245 5.680 1.00 . A A . 12 MET HB2 1 1 10 3131 1 1 12 MET HB3 H -4.652 2.019 5.754 1.00 . A A . 12 MET HB3 1 1 10 3132 1 1 12 MET HE1 H -3.917 6.784 6.329 1.00 . A A . 12 MET HE1 1 1 10 3133 1 1 12 MET HE2 H -2.236 6.273 6.612 1.00 . A A . 12 MET HE2 1 1 10 3134 1 1 12 MET HE3 H -2.672 7.103 5.098 1.00 . A A . 12 MET HE3 1 1 10 3135 1 1 12 MET HG2 H -5.040 4.153 6.658 1.00 . A A . 12 MET HG2 1 1 10 3136 1 1 12 MET HG3 H -3.459 4.243 7.410 1.00 . A A . 12 MET HG3 1 1 10 3137 1 1 12 MET N N -4.581 2.251 8.597 1.00 . A A . 12 MET N 1 1 10 3138 1 1 12 MET O O -1.912 2.674 8.976 1.00 . A A . 12 MET O 1 1 10 3139 1 1 12 MET SD S -3.364 4.824 5.095 1.00 . A A . 12 MET SD 1 1 10 3140 1 1 13 ARG C C 0.882 1.766 6.909 1.00 . A A . 13 ARG C 1 1 10 3141 1 1 13 ARG CA C 0.062 1.005 7.953 1.00 . A A . 13 ARG CA 1 1 10 3142 1 1 13 ARG CB C 0.612 -0.416 8.087 1.00 . A A . 13 ARG CB 1 1 10 3143 1 1 13 ARG CD C 1.899 -1.470 6.191 1.00 . A A . 13 ARG CD 1 1 10 3144 1 1 13 ARG CG C 0.510 -1.170 6.759 1.00 . A A . 13 ARG CG 1 1 10 3145 1 1 13 ARG CZ C 2.683 -2.432 4.030 1.00 . A A . 13 ARG CZ 1 1 10 3146 1 1 13 ARG H H -1.588 0.308 6.890 1.00 . A A . 13 ARG H 1 1 10 3147 1 1 13 ARG HA H 0.087 1.512 8.918 1.00 . A A . 13 ARG HA 1 1 10 3148 1 1 13 ARG HB2 H 1.653 -0.379 8.409 1.00 . A A . 13 ARG HB2 1 1 10 3149 1 1 13 ARG HB3 H 0.059 -0.953 8.857 1.00 . A A . 13 ARG HB3 1 1 10 3150 1 1 13 ARG HD2 H 2.390 -0.542 5.900 1.00 . A A . 13 ARG HD2 1 1 10 3151 1 1 13 ARG HD3 H 2.521 -1.934 6.956 1.00 . A A . 13 ARG HD3 1 1 10 3152 1 1 13 ARG HE H 0.984 -2.968 4.967 1.00 . A A . 13 ARG HE 1 1 10 3153 1 1 13 ARG HG2 H -0.035 -2.102 6.907 1.00 . A A . 13 ARG HG2 1 1 10 3154 1 1 13 ARG HG3 H -0.060 -0.578 6.043 1.00 . A A . 13 ARG HG3 1 1 10 3155 1 1 13 ARG HH11 H 3.909 -1.017 4.824 1.00 . A A . 13 ARG HH11 1 1 10 3156 1 1 13 ARG HH12 H 4.441 -1.695 3.322 1.00 . A A . 13 ARG HH12 1 1 10 3157 1 1 13 ARG HH21 H 1.686 -3.863 2.985 1.00 . A A . 13 ARG HH21 1 1 10 3158 1 1 13 ARG HH22 H 3.168 -3.324 2.268 1.00 . A A . 13 ARG HH22 1 1 10 3159 1 1 13 ARG N N -1.342 0.990 7.579 1.00 . A A . 13 ARG N 1 1 10 3160 1 1 13 ARG NE N 1.783 -2.369 5.021 1.00 . A A . 13 ARG NE 1 1 10 3161 1 1 13 ARG NH1 N 3.770 -1.648 4.061 1.00 . A A . 13 ARG NH1 1 1 10 3162 1 1 13 ARG NH2 N 2.496 -3.278 3.008 1.00 . A A . 13 ARG NH2 1 1 10 3163 1 1 13 ARG O O 1.129 1.257 5.818 1.00 . A A . 13 ARG O 1 1 10 3164 1 1 14 THR C C 3.379 3.112 6.023 1.00 . A A . 14 THR C 1 1 10 3165 1 1 14 THR CA C 2.067 3.810 6.390 1.00 . A A . 14 THR CA 1 1 10 3166 1 1 14 THR CB C 2.268 5.166 7.069 1.00 . A A . 14 THR CB 1 1 10 3167 1 1 14 THR CG2 C 0.943 5.846 7.423 1.00 . A A . 14 THR CG2 1 1 10 3168 1 1 14 THR H H 1.075 3.380 8.171 1.00 . A A . 14 THR H 1 1 10 3169 1 1 14 THR HA H 1.507 3.946 5.464 1.00 . A A . 14 THR HA 1 1 10 3170 1 1 14 THR HB H 2.889 5.820 6.456 1.00 . A A . 14 THR HB 1 1 10 3171 1 1 14 THR HG1 H 3.015 5.675 8.855 1.00 . A A . 14 THR HG1 1 1 10 3172 1 1 14 THR HG21 H 0.262 5.777 6.575 1.00 . A A . 14 THR HG21 1 1 10 3173 1 1 14 THR HG22 H 0.501 5.351 8.287 1.00 . A A . 14 THR HG22 1 1 10 3174 1 1 14 THR HG23 H 1.126 6.894 7.660 1.00 . A A . 14 THR HG23 1 1 10 3175 1 1 14 THR N N 1.281 2.974 7.281 1.00 . A A . 14 THR N 1 1 10 3176 1 1 14 THR O O 3.522 1.908 6.223 1.00 . A A . 14 THR O 1 1 10 3177 1 1 14 THR OG1 O 2.840 4.841 8.333 1.00 . A A . 14 THR OG1 1 1 10 3178 1 1 15 ALA C C 6.524 3.342 6.317 1.00 . A A . 15 ALA C 1 1 10 3179 1 1 15 ALA CA C 5.598 3.375 5.098 1.00 . A A . 15 ALA CA 1 1 10 3180 1 1 15 ALA CB C 6.165 4.221 3.957 1.00 . A A . 15 ALA CB 1 1 10 3181 1 1 15 ALA H H 4.178 4.880 5.336 1.00 . A A . 15 ALA H 1 1 10 3182 1 1 15 ALA HA H 5.447 2.357 4.740 1.00 . A A . 15 ALA HA 1 1 10 3183 1 1 15 ALA HB1 H 5.391 4.888 3.579 1.00 . A A . 15 ALA HB1 1 1 10 3184 1 1 15 ALA HB2 H 7.005 4.811 4.324 1.00 . A A . 15 ALA HB2 1 1 10 3185 1 1 15 ALA HB3 H 6.505 3.566 3.154 1.00 . A A . 15 ALA HB3 1 1 10 3186 1 1 15 ALA N N 4.303 3.902 5.495 1.00 . A A . 15 ALA N 1 1 10 3187 1 1 15 ALA O O 7.704 3.019 6.195 1.00 . A A . 15 ALA O 1 1 10 3188 1 1 16 ASP C C 6.116 2.678 9.674 1.00 . A A . 16 ASP C 1 1 10 3189 1 1 16 ASP CA C 6.713 3.697 8.702 1.00 . A A . 16 ASP CA 1 1 10 3190 1 1 16 ASP CB C 6.656 5.074 9.366 1.00 . A A . 16 ASP CB 1 1 10 3191 1 1 16 ASP CG C 7.664 5.288 10.497 1.00 . A A . 16 ASP CG 1 1 10 3192 1 1 16 ASP H H 4.992 3.942 7.554 1.00 . A A . 16 ASP H 1 1 10 3193 1 1 16 ASP HA H 7.735 3.449 8.414 1.00 . A A . 16 ASP HA 1 1 10 3194 1 1 16 ASP HB2 H 6.820 5.835 8.604 1.00 . A A . 16 ASP HB2 1 1 10 3195 1 1 16 ASP HB3 H 5.652 5.229 9.760 1.00 . A A . 16 ASP HB3 1 1 10 3196 1 1 16 ASP N N 5.953 3.682 7.463 1.00 . A A . 16 ASP N 1 1 10 3197 1 1 16 ASP O O 6.703 2.389 10.715 1.00 . A A . 16 ASP O 1 1 10 3198 1 1 16 ASP OD1 O 7.296 4.979 11.651 1.00 . A A . 16 ASP OD1 1 1 10 3199 1 1 16 ASP OD2 O 8.779 5.756 10.182 1.00 . A A . 16 ASP OD2 1 1 10 3200 1 1 17 GLY C C 3.258 1.855 11.052 1.00 . A A . 17 GLY C 1 1 10 3201 1 1 17 GLY CA C 4.271 1.180 10.125 1.00 . A A . 17 GLY CA 1 1 10 3202 1 1 17 GLY H H 4.484 2.399 8.450 1.00 . A A . 17 GLY H 1 1 10 3203 1 1 17 GLY HA2 H 3.761 0.456 9.490 1.00 . A A . 17 GLY HA2 1 1 10 3204 1 1 17 GLY HA3 H 4.999 0.627 10.718 1.00 . A A . 17 GLY HA3 1 1 10 3205 1 1 17 GLY N N 4.954 2.160 9.299 1.00 . A A . 17 GLY N 1 1 10 3206 1 1 17 GLY O O 2.483 1.180 11.727 1.00 . A A . 17 GLY O 1 1 10 3207 1 1 18 ARG C C 0.945 3.756 11.422 1.00 . A A . 18 ARG C 1 1 10 3208 1 1 18 ARG CA C 2.390 3.954 11.884 1.00 . A A . 18 ARG CA 1 1 10 3209 1 1 18 ARG CB C 2.735 5.444 11.835 1.00 . A A . 18 ARG CB 1 1 10 3210 1 1 18 ARG CD C 4.204 5.972 13.815 1.00 . A A . 18 ARG CD 1 1 10 3211 1 1 18 ARG CG C 4.167 5.691 12.312 1.00 . A A . 18 ARG CG 1 1 10 3212 1 1 18 ARG CZ C 4.756 8.397 13.967 1.00 . A A . 18 ARG CZ 1 1 10 3213 1 1 18 ARG H H 3.929 3.722 10.500 1.00 . A A . 18 ARG H 1 1 10 3214 1 1 18 ARG HA H 2.537 3.565 12.892 1.00 . A A . 18 ARG HA 1 1 10 3215 1 1 18 ARG HB2 H 2.617 5.814 10.817 1.00 . A A . 18 ARG HB2 1 1 10 3216 1 1 18 ARG HB3 H 2.038 6.002 12.460 1.00 . A A . 18 ARG HB3 1 1 10 3217 1 1 18 ARG HD2 H 3.201 6.195 14.177 1.00 . A A . 18 ARG HD2 1 1 10 3218 1 1 18 ARG HD3 H 4.546 5.085 14.351 1.00 . A A . 18 ARG HD3 1 1 10 3219 1 1 18 ARG HE H 6.038 6.906 14.401 1.00 . A A . 18 ARG HE 1 1 10 3220 1 1 18 ARG HG2 H 4.785 4.822 12.085 1.00 . A A . 18 ARG HG2 1 1 10 3221 1 1 18 ARG HG3 H 4.594 6.536 11.770 1.00 . A A . 18 ARG HG3 1 1 10 3222 1 1 18 ARG HH11 H 2.859 7.995 13.355 1.00 . A A . 18 ARG HH11 1 1 10 3223 1 1 18 ARG HH12 H 3.258 9.677 13.466 1.00 . A A . 18 ARG HH12 1 1 10 3224 1 1 18 ARG HH21 H 6.565 9.125 14.547 1.00 . A A . 18 ARG HH21 1 1 10 3225 1 1 18 ARG HH22 H 5.380 10.324 14.148 1.00 . A A . 18 ARG HH22 1 1 10 3226 1 1 18 ARG N N 3.296 3.180 11.053 1.00 . A A . 18 ARG N 1 1 10 3227 1 1 18 ARG NE N 5.107 7.110 14.096 1.00 . A A . 18 ARG NE 1 1 10 3228 1 1 18 ARG NH1 N 3.520 8.717 13.562 1.00 . A A . 18 ARG NH1 1 1 10 3229 1 1 18 ARG NH2 N 5.642 9.364 14.244 1.00 . A A . 18 ARG NH2 1 1 10 3230 1 1 18 ARG O O 0.574 4.189 10.332 1.00 . A A . 18 ARG O 1 1 10 3231 1 1 19 CYS C C -1.947 4.183 11.829 1.00 . A A . 19 CYS C 1 1 10 3232 1 1 19 CYS CA C -1.227 2.840 11.966 1.00 . A A . 19 CYS CA 1 1 10 3233 1 1 19 CYS CB C -1.881 1.947 13.022 1.00 . A A . 19 CYS CB 1 1 10 3234 1 1 19 CYS H H 0.479 2.753 13.159 1.00 . A A . 19 CYS H 1 1 10 3235 1 1 19 CYS HA H -1.242 2.295 11.022 1.00 . A A . 19 CYS HA 1 1 10 3236 1 1 19 CYS HB2 H -1.748 2.408 14.000 1.00 . A A . 19 CYS HB2 1 1 10 3237 1 1 19 CYS HB3 H -2.953 1.908 12.830 1.00 . A A . 19 CYS HB3 1 1 10 3238 1 1 19 CYS N N 0.169 3.101 12.273 1.00 . A A . 19 CYS N 1 1 10 3239 1 1 19 CYS O O -2.285 4.816 12.828 1.00 . A A . 19 CYS O 1 1 10 3240 1 1 19 CYS SG S -1.235 0.236 13.085 1.00 . A A . 19 CYS SG 1 1 10 3241 1 1 20 LYS C C -4.303 5.553 9.960 1.00 . A A . 20 LYS C 1 1 10 3242 1 1 20 LYS CA C -2.837 5.833 10.300 1.00 . A A . 20 LYS CA 1 1 10 3243 1 1 20 LYS CB C -2.092 6.610 9.214 1.00 . A A . 20 LYS CB 1 1 10 3244 1 1 20 LYS CD C -0.146 7.509 10.543 1.00 . A A . 20 LYS CD 1 1 10 3245 1 1 20 LYS CE C -0.366 7.550 12.057 1.00 . A A . 20 LYS CE 1 1 10 3246 1 1 20 LYS CG C -1.431 7.864 9.793 1.00 . A A . 20 LYS CG 1 1 10 3247 1 1 20 LYS H H -1.884 4.057 9.775 1.00 . A A . 20 LYS H 1 1 10 3248 1 1 20 LYS HA H -2.802 6.434 11.209 1.00 . A A . 20 LYS HA 1 1 10 3249 1 1 20 LYS HB2 H -1.334 5.972 8.760 1.00 . A A . 20 LYS HB2 1 1 10 3250 1 1 20 LYS HB3 H -2.786 6.893 8.423 1.00 . A A . 20 LYS HB3 1 1 10 3251 1 1 20 LYS HD2 H 0.190 6.515 10.247 1.00 . A A . 20 LYS HD2 1 1 10 3252 1 1 20 LYS HD3 H 0.644 8.208 10.268 1.00 . A A . 20 LYS HD3 1 1 10 3253 1 1 20 LYS HE2 H -1.426 7.423 12.280 1.00 . A A . 20 LYS HE2 1 1 10 3254 1 1 20 LYS HE3 H 0.160 6.720 12.529 1.00 . A A . 20 LYS HE3 1 1 10 3255 1 1 20 LYS HG2 H -1.206 8.564 8.988 1.00 . A A . 20 LYS HG2 1 1 10 3256 1 1 20 LYS HG3 H -2.124 8.366 10.468 1.00 . A A . 20 LYS HG3 1 1 10 3257 1 1 20 LYS HZ1 H 1.047 9.006 12.300 1.00 . A A . 20 LYS HZ1 1 1 10 3258 1 1 20 LYS HZ2 H -0.484 9.574 12.312 1.00 . A A . 20 LYS HZ2 1 1 10 3259 1 1 20 LYS HZ3 H 0.105 8.785 13.615 1.00 . A A . 20 LYS HZ3 1 1 10 3260 1 1 20 LYS N N -2.162 4.577 10.582 1.00 . A A . 20 LYS N 1 1 10 3261 1 1 20 LYS NZ N 0.115 8.833 12.616 1.00 . A A . 20 LYS NZ 1 1 10 3262 1 1 20 LYS O O -4.704 4.398 9.827 1.00 . A A . 20 LYS O 1 1 10 3263 1 1 21 PRO C C -6.694 6.182 8.031 1.00 . A A . 21 PRO C 1 1 10 3264 1 1 21 PRO CA C -6.496 6.543 9.504 1.00 . A A . 21 PRO CA 1 1 10 3265 1 1 21 PRO CB C -7.094 7.892 9.871 1.00 . A A . 21 PRO CB 1 1 10 3266 1 1 21 PRO CD C -4.644 8.043 9.976 1.00 . A A . 21 PRO CD 1 1 10 3267 1 1 21 PRO CG C -5.925 8.860 9.946 1.00 . A A . 21 PRO CG 1 1 10 3268 1 1 21 PRO HA H -6.911 5.799 10.027 1.00 . A A . 21 PRO HA 1 1 10 3269 1 1 21 PRO HB2 H -7.820 8.214 9.123 1.00 . A A . 21 PRO HB2 1 1 10 3270 1 1 21 PRO HB3 H -7.620 7.840 10.823 1.00 . A A . 21 PRO HB3 1 1 10 3271 1 1 21 PRO HD2 H -3.970 8.334 9.171 1.00 . A A . 21 PRO HD2 1 1 10 3272 1 1 21 PRO HD3 H -4.104 8.187 10.912 1.00 . A A . 21 PRO HD3 1 1 10 3273 1 1 21 PRO HG2 H -5.929 9.532 9.086 1.00 . A A . 21 PRO HG2 1 1 10 3274 1 1 21 PRO HG3 H -6.002 9.484 10.836 1.00 . A A . 21 PRO HG3 1 1 10 3275 1 1 21 PRO N N -5.083 6.660 9.826 1.00 . A A . 21 PRO N 1 1 10 3276 1 1 21 PRO O O -5.937 6.628 7.171 1.00 . A A . 21 PRO O 1 1 10 3277 1 1 22 THR C C -9.328 5.594 5.952 1.00 . A A . 22 THR C 1 1 10 3278 1 1 22 THR CA C -8.025 4.950 6.430 1.00 . A A . 22 THR CA 1 1 10 3279 1 1 22 THR CB C -8.062 3.421 6.414 1.00 . A A . 22 THR CB 1 1 10 3280 1 1 22 THR CG2 C -7.868 2.846 5.009 1.00 . A A . 22 THR CG2 1 1 10 3281 1 1 22 THR H H -8.329 5.018 8.490 1.00 . A A . 22 THR H 1 1 10 3282 1 1 22 THR HA H -7.233 5.302 5.771 1.00 . A A . 22 THR HA 1 1 10 3283 1 1 22 THR HB H -8.982 3.048 6.863 1.00 . A A . 22 THR HB 1 1 10 3284 1 1 22 THR HG1 H -6.860 2.045 7.230 1.00 . A A . 22 THR HG1 1 1 10 3285 1 1 22 THR HG21 H -8.214 3.568 4.270 1.00 . A A . 22 THR HG21 1 1 10 3286 1 1 22 THR HG22 H -6.811 2.635 4.846 1.00 . A A . 22 THR HG22 1 1 10 3287 1 1 22 THR HG23 H -8.441 1.923 4.911 1.00 . A A . 22 THR HG23 1 1 10 3288 1 1 22 THR N N -7.718 5.377 7.785 1.00 . A A . 22 THR N 1 1 10 3289 1 1 22 THR O O -9.843 5.245 4.890 1.00 . A A . 22 THR O 1 1 10 3290 1 1 22 THR OG1 O -6.880 3.037 7.111 1.00 . A A . 22 THR OG1 1 1 10 3291 1 1 23 PHE C C -11.151 7.485 4.925 1.00 . A A . 23 PHE C 1 1 10 3292 1 1 23 PHE CA C -11.055 7.219 6.429 1.00 . A A . 23 PHE CA 1 1 10 3293 1 1 23 PHE CB C -11.025 8.556 7.170 1.00 . A A . 23 PHE CB 1 1 10 3294 1 1 23 PHE CD1 C -11.255 7.423 9.392 1.00 . A A . 23 PHE CD1 1 1 10 3295 1 1 23 PHE CD2 C -9.881 9.334 9.259 1.00 . A A . 23 PHE CD2 1 1 10 3296 1 1 23 PHE CE1 C -10.961 7.309 10.777 1.00 . A A . 23 PHE CE1 1 1 10 3297 1 1 23 PHE CE2 C -9.588 9.219 10.644 1.00 . A A . 23 PHE CE2 1 1 10 3298 1 1 23 PHE CG C -10.708 8.433 8.663 1.00 . A A . 23 PHE CG 1 1 10 3299 1 1 23 PHE CZ C -10.134 8.209 11.373 1.00 . A A . 23 PHE CZ 1 1 10 3300 1 1 23 PHE H H -9.397 6.800 7.618 1.00 . A A . 23 PHE H 1 1 10 3301 1 1 23 PHE HA H -11.881 6.576 6.735 1.00 . A A . 23 PHE HA 1 1 10 3302 1 1 23 PHE HB2 H -10.281 9.202 6.704 1.00 . A A . 23 PHE HB2 1 1 10 3303 1 1 23 PHE HB3 H -11.991 9.046 7.054 1.00 . A A . 23 PHE HB3 1 1 10 3304 1 1 23 PHE HD1 H -11.917 6.703 8.915 1.00 . A A . 23 PHE HD1 1 1 10 3305 1 1 23 PHE HD2 H -9.444 10.142 8.674 1.00 . A A . 23 PHE HD2 1 1 10 3306 1 1 23 PHE HE1 H -11.399 6.501 11.362 1.00 . A A . 23 PHE HE1 1 1 10 3307 1 1 23 PHE HE2 H -8.925 9.940 11.121 1.00 . A A . 23 PHE HE2 1 1 10 3308 1 1 23 PHE HZ H -9.909 8.123 12.436 1.00 . A A . 23 PHE HZ 1 1 10 3309 1 1 23 PHE N N -9.823 6.523 6.758 1.00 . A A . 23 PHE N 1 1 10 3310 1 1 23 PHE O O -11.934 6.844 4.226 1.00 . A A . 23 PHE O 1 1 11 3311 1 1 1 GLU C C -8.210 -10.809 14.341 1.00 . A A . 1 GLU C 1 1 11 3312 1 1 1 GLU CA C -9.732 -10.652 14.360 1.00 . A A . 1 GLU CA 1 1 11 3313 1 1 1 GLU CB C -10.422 -12.013 14.475 1.00 . A A . 1 GLU CB 1 1 11 3314 1 1 1 GLU CD C -10.811 -14.242 13.361 1.00 . A A . 1 GLU CD 1 1 11 3315 1 1 1 GLU CG C -10.213 -12.842 13.206 1.00 . A A . 1 GLU CG 1 1 11 3316 1 1 1 GLU HA H -10.029 -10.029 15.204 1.00 . A A . 1 GLU HA 1 1 11 3317 1 1 1 GLU HB2 H -10.028 -12.553 15.335 1.00 . A A . 1 GLU HB2 1 1 11 3318 1 1 1 GLU HB3 H -11.488 -11.870 14.648 1.00 . A A . 1 GLU HB3 1 1 11 3319 1 1 1 GLU HG2 H -10.674 -12.337 12.357 1.00 . A A . 1 GLU HG2 1 1 11 3320 1 1 1 GLU HG3 H -9.147 -12.920 12.989 1.00 . A A . 1 GLU HG3 1 1 11 3321 1 1 1 GLU N N -10.180 -9.939 13.176 1.00 . A A . 1 GLU N 1 1 11 3322 1 1 1 GLU O O -7.564 -10.758 15.387 1.00 . A A . 1 GLU O 1 1 11 3323 1 1 1 GLU OE1 O -12.058 -14.329 13.363 1.00 . A A . 1 GLU OE1 1 1 11 3324 1 1 1 GLU OE2 O -10.008 -15.193 13.473 1.00 . A A . 1 GLU OE2 1 1 11 3325 1 1 2 ASN C C -5.575 -9.788 12.970 1.00 . A A . 2 ASN C 1 1 11 3326 1 1 2 ASN CA C -6.246 -11.162 12.972 1.00 . A A . 2 ASN CA 1 1 11 3327 1 1 2 ASN CB C -5.924 -11.849 11.645 1.00 . A A . 2 ASN CB 1 1 11 3328 1 1 2 ASN CG C -6.917 -12.975 11.354 1.00 . A A . 2 ASN CG 1 1 11 3329 1 1 2 ASN H H -8.212 -11.036 12.296 1.00 . A A . 2 ASN H 1 1 11 3330 1 1 2 ASN HA H -5.930 -11.780 13.813 1.00 . A A . 2 ASN HA 1 1 11 3331 1 1 2 ASN HB2 H -5.950 -11.117 10.837 1.00 . A A . 2 ASN HB2 1 1 11 3332 1 1 2 ASN HB3 H -4.911 -12.252 11.676 1.00 . A A . 2 ASN HB3 1 1 11 3333 1 1 2 ASN HD21 H -7.408 -12.033 9.630 1.00 . A A . 2 ASN HD21 1 1 11 3334 1 1 2 ASN HD22 H -8.254 -13.513 9.932 1.00 . A A . 2 ASN HD22 1 1 11 3335 1 1 2 ASN N N -7.680 -10.997 13.141 1.00 . A A . 2 ASN N 1 1 11 3336 1 1 2 ASN ND2 N -7.582 -12.828 10.210 1.00 . A A . 2 ASN ND2 1 1 11 3337 1 1 2 ASN O O -5.914 -8.929 12.157 1.00 . A A . 2 ASN O 1 1 11 3338 1 1 2 ASN OD1 O -7.070 -13.916 12.115 1.00 . A A . 2 ASN OD1 1 1 11 3339 1 1 3 PHE C C -3.251 -7.991 12.675 1.00 . A A . 3 PHE C 1 1 11 3340 1 1 3 PHE CA C -3.914 -8.365 14.003 1.00 . A A . 3 PHE CA 1 1 11 3341 1 1 3 PHE CB C -2.828 -8.568 15.062 1.00 . A A . 3 PHE CB 1 1 11 3342 1 1 3 PHE CD1 C -1.492 -10.546 14.303 1.00 . A A . 3 PHE CD1 1 1 11 3343 1 1 3 PHE CD2 C -0.458 -8.431 14.265 1.00 . A A . 3 PHE CD2 1 1 11 3344 1 1 3 PHE CE1 C -0.302 -11.138 13.803 1.00 . A A . 3 PHE CE1 1 1 11 3345 1 1 3 PHE CE2 C 0.732 -9.022 13.765 1.00 . A A . 3 PHE CE2 1 1 11 3346 1 1 3 PHE CG C -1.545 -9.205 14.523 1.00 . A A . 3 PHE CG 1 1 11 3347 1 1 3 PHE CZ C 0.786 -10.363 13.546 1.00 . A A . 3 PHE CZ 1 1 11 3348 1 1 3 PHE H H -4.366 -10.325 14.546 1.00 . A A . 3 PHE H 1 1 11 3349 1 1 3 PHE HA H -4.639 -7.599 14.274 1.00 . A A . 3 PHE HA 1 1 11 3350 1 1 3 PHE HB2 H -2.584 -7.603 15.506 1.00 . A A . 3 PHE HB2 1 1 11 3351 1 1 3 PHE HB3 H -3.225 -9.194 15.860 1.00 . A A . 3 PHE HB3 1 1 11 3352 1 1 3 PHE HD1 H -2.364 -11.166 14.511 1.00 . A A . 3 PHE HD1 1 1 11 3353 1 1 3 PHE HD2 H -0.500 -7.355 14.442 1.00 . A A . 3 PHE HD2 1 1 11 3354 1 1 3 PHE HE1 H -0.260 -12.213 13.628 1.00 . A A . 3 PHE HE1 1 1 11 3355 1 1 3 PHE HE2 H 1.604 -8.402 13.558 1.00 . A A . 3 PHE HE2 1 1 11 3356 1 1 3 PHE HZ H 1.700 -10.818 13.162 1.00 . A A . 3 PHE HZ 1 1 11 3357 1 1 3 PHE N N -4.636 -9.621 13.889 1.00 . A A . 3 PHE N 1 1 11 3358 1 1 3 PHE O O -2.476 -8.770 12.122 1.00 . A A . 3 PHE O 1 1 11 3359 1 1 4 ASN C C -1.788 -5.465 11.239 1.00 . A A . 4 ASN C 1 1 11 3360 1 1 4 ASN CA C -3.028 -6.312 10.949 1.00 . A A . 4 ASN CA 1 1 11 3361 1 1 4 ASN CB C -4.037 -5.434 10.206 1.00 . A A . 4 ASN CB 1 1 11 3362 1 1 4 ASN CG C -3.442 -4.898 8.902 1.00 . A A . 4 ASN CG 1 1 11 3363 1 1 4 ASN H H -4.213 -6.171 12.657 1.00 . A A . 4 ASN H 1 1 11 3364 1 1 4 ASN HA H -2.796 -7.207 10.372 1.00 . A A . 4 ASN HA 1 1 11 3365 1 1 4 ASN HB2 H -4.936 -6.011 9.989 1.00 . A A . 4 ASN HB2 1 1 11 3366 1 1 4 ASN HB3 H -4.338 -4.601 10.841 1.00 . A A . 4 ASN HB3 1 1 11 3367 1 1 4 ASN HD21 H -3.749 -3.019 9.590 1.00 . A A . 4 ASN HD21 1 1 11 3368 1 1 4 ASN HD22 H -3.033 -3.124 8.016 1.00 . A A . 4 ASN HD22 1 1 11 3369 1 1 4 ASN N N -3.581 -6.799 12.202 1.00 . A A . 4 ASN N 1 1 11 3370 1 1 4 ASN ND2 N -3.405 -3.571 8.830 1.00 . A A . 4 ASN ND2 1 1 11 3371 1 1 4 ASN O O -1.649 -4.360 10.716 1.00 . A A . 4 ASN O 1 1 11 3372 1 1 4 ASN OD1 O -3.043 -5.641 8.020 1.00 . A A . 4 ASN OD1 1 1 11 3373 1 1 5 GLY C C 0.230 -4.794 13.873 1.00 . A A . 5 GLY C 1 1 11 3374 1 1 5 GLY CA C 0.308 -5.323 12.439 1.00 . A A . 5 GLY CA 1 1 11 3375 1 1 5 GLY H H -1.037 -6.913 12.494 1.00 . A A . 5 GLY H 1 1 11 3376 1 1 5 GLY HA2 H 1.156 -6.001 12.343 1.00 . A A . 5 GLY HA2 1 1 11 3377 1 1 5 GLY HA3 H 0.482 -4.496 11.751 1.00 . A A . 5 GLY HA3 1 1 11 3378 1 1 5 GLY N N -0.917 -6.014 12.073 1.00 . A A . 5 GLY N 1 1 11 3379 1 1 5 GLY O O 1.218 -4.831 14.605 1.00 . A A . 5 GLY O 1 1 11 3380 1 1 6 GLY C C -2.002 -2.495 15.508 1.00 . A A . 6 GLY C 1 1 11 3381 1 1 6 GLY CA C -1.170 -3.779 15.563 1.00 . A A . 6 GLY CA 1 1 11 3382 1 1 6 GLY H H -1.749 -4.287 13.627 1.00 . A A . 6 GLY H 1 1 11 3383 1 1 6 GLY HA2 H -1.680 -4.521 16.178 1.00 . A A . 6 GLY HA2 1 1 11 3384 1 1 6 GLY HA3 H -0.211 -3.574 16.038 1.00 . A A . 6 GLY HA3 1 1 11 3385 1 1 6 GLY N N -0.951 -4.314 14.231 1.00 . A A . 6 GLY N 1 1 11 3386 1 1 6 GLY O O -1.680 -1.514 16.178 1.00 . A A . 6 GLY O 1 1 11 3387 1 1 7 CYS C C -5.180 -1.631 15.413 1.00 . A A . 7 CYS C 1 1 11 3388 1 1 7 CYS CA C -3.934 -1.397 14.555 1.00 . A A . 7 CYS CA 1 1 11 3389 1 1 7 CYS CB C -4.290 -1.146 13.088 1.00 . A A . 7 CYS CB 1 1 11 3390 1 1 7 CYS H H -3.309 -3.345 14.165 1.00 . A A . 7 CYS H 1 1 11 3391 1 1 7 CYS HA H -3.380 -0.528 14.909 1.00 . A A . 7 CYS HA 1 1 11 3392 1 1 7 CYS HB2 H -4.837 -2.009 12.709 1.00 . A A . 7 CYS HB2 1 1 11 3393 1 1 7 CYS HB3 H -4.965 -0.292 13.035 1.00 . A A . 7 CYS HB3 1 1 11 3394 1 1 7 CYS N N -3.055 -2.543 14.706 1.00 . A A . 7 CYS N 1 1 11 3395 1 1 7 CYS O O -5.259 -2.620 16.141 1.00 . A A . 7 CYS O 1 1 11 3396 1 1 7 CYS SG S -2.858 -0.830 11.994 1.00 . A A . 7 CYS SG 1 1 11 3397 1 1 8 LEU C C -8.386 -1.595 15.244 1.00 . A A . 8 LEU C 1 1 11 3398 1 1 8 LEU CA C -7.358 -0.800 16.053 1.00 . A A . 8 LEU CA 1 1 11 3399 1 1 8 LEU CB C -7.843 0.592 16.463 1.00 . A A . 8 LEU CB 1 1 11 3400 1 1 8 LEU CD1 C -9.249 -0.190 18.406 1.00 . A A . 8 LEU CD1 1 1 11 3401 1 1 8 LEU CD2 C -9.636 2.104 17.392 1.00 . A A . 8 LEU CD2 1 1 11 3402 1 1 8 LEU CG C -9.218 0.654 17.130 1.00 . A A . 8 LEU CG 1 1 11 3403 1 1 8 LEU H H -6.049 0.094 14.703 1.00 . A A . 8 LEU H 1 1 11 3404 1 1 8 LEU HA H -7.141 -1.349 16.969 1.00 . A A . 8 LEU HA 1 1 11 3405 1 1 8 LEU HB2 H -7.110 1.023 17.145 1.00 . A A . 8 LEU HB2 1 1 11 3406 1 1 8 LEU HB3 H -7.862 1.224 15.575 1.00 . A A . 8 LEU HB3 1 1 11 3407 1 1 8 LEU HD11 H -8.825 -1.173 18.201 1.00 . A A . 8 LEU HD11 1 1 11 3408 1 1 8 LEU HD12 H -8.663 0.303 19.182 1.00 . A A . 8 LEU HD12 1 1 11 3409 1 1 8 LEU HD13 H -10.279 -0.301 18.743 1.00 . A A . 8 LEU HD13 1 1 11 3410 1 1 8 LEU HD21 H -8.751 2.741 17.397 1.00 . A A . 8 LEU HD21 1 1 11 3411 1 1 8 LEU HD22 H -10.315 2.433 16.607 1.00 . A A . 8 LEU HD22 1 1 11 3412 1 1 8 LEU HD23 H -10.137 2.168 18.358 1.00 . A A . 8 LEU HD23 1 1 11 3413 1 1 8 LEU HG H -9.950 0.227 16.444 1.00 . A A . 8 LEU HG 1 1 11 3414 1 1 8 LEU N N -6.121 -0.707 15.297 1.00 . A A . 8 LEU N 1 1 11 3415 1 1 8 LEU O O -8.919 -2.595 15.723 1.00 . A A . 8 LEU O 1 1 11 3416 1 1 9 ALA C C -10.013 -0.798 12.054 1.00 . A A . 9 ALA C 1 1 11 3417 1 1 9 ALA CA C -9.588 -1.772 13.154 1.00 . A A . 9 ALA CA 1 1 11 3418 1 1 9 ALA CB C -10.776 -2.279 13.974 1.00 . A A . 9 ALA CB 1 1 11 3419 1 1 9 ALA H H -8.197 -0.304 13.652 1.00 . A A . 9 ALA H 1 1 11 3420 1 1 9 ALA HA H -9.088 -2.627 12.697 1.00 . A A . 9 ALA HA 1 1 11 3421 1 1 9 ALA HB1 H -10.822 -1.738 14.919 1.00 . A A . 9 ALA HB1 1 1 11 3422 1 1 9 ALA HB2 H -11.698 -2.116 13.416 1.00 . A A . 9 ALA HB2 1 1 11 3423 1 1 9 ALA HB3 H -10.654 -3.345 14.171 1.00 . A A . 9 ALA HB3 1 1 11 3424 1 1 9 ALA N N -8.634 -1.119 14.033 1.00 . A A . 9 ALA N 1 1 11 3425 1 1 9 ALA O O -10.946 -0.018 12.237 1.00 . A A . 9 ALA O 1 1 11 3426 1 1 10 GLY C C -8.358 0.783 9.385 1.00 . A A . 10 GLY C 1 1 11 3427 1 1 10 GLY CA C -9.599 -0.006 9.806 1.00 . A A . 10 GLY CA 1 1 11 3428 1 1 10 GLY H H -8.549 -1.510 10.793 1.00 . A A . 10 GLY H 1 1 11 3429 1 1 10 GLY HA2 H -9.956 -0.603 8.967 1.00 . A A . 10 GLY HA2 1 1 11 3430 1 1 10 GLY HA3 H -10.401 0.683 10.070 1.00 . A A . 10 GLY HA3 1 1 11 3431 1 1 10 GLY N N -9.307 -0.873 10.935 1.00 . A A . 10 GLY N 1 1 11 3432 1 1 10 GLY O O -8.111 0.971 8.195 1.00 . A A . 10 GLY O 1 1 11 3433 1 1 11 TYR C C -5.430 1.207 9.248 1.00 . A A . 11 TYR C 1 1 11 3434 1 1 11 TYR CA C -6.400 1.990 10.134 1.00 . A A . 11 TYR CA 1 1 11 3435 1 1 11 TYR CB C -5.754 2.218 11.502 1.00 . A A . 11 TYR CB 1 1 11 3436 1 1 11 TYR CD1 C -7.529 2.615 13.247 1.00 . A A . 11 TYR CD1 1 1 11 3437 1 1 11 TYR CD2 C -6.300 4.496 12.432 1.00 . A A . 11 TYR CD2 1 1 11 3438 1 1 11 TYR CE1 C -8.283 3.483 14.115 1.00 . A A . 11 TYR CE1 1 1 11 3439 1 1 11 TYR CE2 C -7.054 5.364 13.299 1.00 . A A . 11 TYR CE2 1 1 11 3440 1 1 11 TYR CG C -6.554 3.140 12.423 1.00 . A A . 11 TYR CG 1 1 11 3441 1 1 11 TYR CZ C -8.009 4.815 14.098 1.00 . A A . 11 TYR CZ 1 1 11 3442 1 1 11 TYR H H -7.818 1.069 11.351 1.00 . A A . 11 TYR H 1 1 11 3443 1 1 11 TYR HA H -6.684 2.911 9.624 1.00 . A A . 11 TYR HA 1 1 11 3444 1 1 11 TYR HB2 H -5.621 1.254 11.994 1.00 . A A . 11 TYR HB2 1 1 11 3445 1 1 11 TYR HB3 H -4.759 2.641 11.356 1.00 . A A . 11 TYR HB3 1 1 11 3446 1 1 11 TYR HD1 H -7.730 1.543 13.240 1.00 . A A . 11 TYR HD1 1 1 11 3447 1 1 11 TYR HD2 H -5.530 4.912 11.781 1.00 . A A . 11 TYR HD2 1 1 11 3448 1 1 11 TYR HE1 H -9.056 3.081 14.770 1.00 . A A . 11 TYR HE1 1 1 11 3449 1 1 11 TYR HE2 H -6.864 6.437 13.316 1.00 . A A . 11 TYR HE2 1 1 11 3450 1 1 11 TYR HH H -8.438 5.497 15.866 1.00 . A A . 11 TYR HH 1 1 11 3451 1 1 11 TYR N N -7.610 1.225 10.386 1.00 . A A . 11 TYR N 1 1 11 3452 1 1 11 TYR O O -5.481 -0.021 9.200 1.00 . A A . 11 TYR O 1 1 11 3453 1 1 11 TYR OH O -8.720 5.634 14.917 1.00 . A A . 11 TYR OH 1 1 11 3454 1 1 12 MET C C -2.164 1.625 8.169 1.00 . A A . 12 MET C 1 1 11 3455 1 1 12 MET CA C -3.588 1.339 7.687 1.00 . A A . 12 MET CA 1 1 11 3456 1 1 12 MET CB C -3.765 1.887 6.269 1.00 . A A . 12 MET CB 1 1 11 3457 1 1 12 MET CE C -3.514 5.871 5.220 1.00 . A A . 12 MET CE 1 1 11 3458 1 1 12 MET CG C -3.992 3.400 6.290 1.00 . A A . 12 MET CG 1 1 11 3459 1 1 12 MET H H -4.533 2.948 8.614 1.00 . A A . 12 MET H 1 1 11 3460 1 1 12 MET HA H -3.785 0.269 7.726 1.00 . A A . 12 MET HA 1 1 11 3461 1 1 12 MET HB2 H -2.883 1.656 5.673 1.00 . A A . 12 MET HB2 1 1 11 3462 1 1 12 MET HB3 H -4.612 1.396 5.789 1.00 . A A . 12 MET HB3 1 1 11 3463 1 1 12 MET HE1 H -3.302 6.042 6.276 1.00 . A A . 12 MET HE1 1 1 11 3464 1 1 12 MET HE2 H -2.843 6.477 4.611 1.00 . A A . 12 MET HE2 1 1 11 3465 1 1 12 MET HE3 H -4.546 6.150 5.008 1.00 . A A . 12 MET HE3 1 1 11 3466 1 1 12 MET HG2 H -5.059 3.616 6.329 1.00 . A A . 12 MET HG2 1 1 11 3467 1 1 12 MET HG3 H -3.546 3.830 7.187 1.00 . A A . 12 MET HG3 1 1 11 3468 1 1 12 MET N N -4.568 1.950 8.569 1.00 . A A . 12 MET N 1 1 11 3469 1 1 12 MET O O -1.939 2.564 8.930 1.00 . A A . 12 MET O 1 1 11 3470 1 1 12 MET SD S -3.272 4.145 4.836 1.00 . A A . 12 MET SD 1 1 11 3471 1 1 13 ARG C C 0.920 1.700 6.995 1.00 . A A . 13 ARG C 1 1 11 3472 1 1 13 ARG CA C 0.155 0.944 8.083 1.00 . A A . 13 ARG CA 1 1 11 3473 1 1 13 ARG CB C 0.815 -0.418 8.307 1.00 . A A . 13 ARG CB 1 1 11 3474 1 1 13 ARG CD C 1.336 -0.964 10.714 1.00 . A A . 13 ARG CD 1 1 11 3475 1 1 13 ARG CG C 1.864 -0.344 9.418 1.00 . A A . 13 ARG CG 1 1 11 3476 1 1 13 ARG CZ C 2.140 -2.822 12.167 1.00 . A A . 13 ARG CZ 1 1 11 3477 1 1 13 ARG H H -1.432 0.032 7.089 1.00 . A A . 13 ARG H 1 1 11 3478 1 1 13 ARG HA H 0.134 1.511 9.014 1.00 . A A . 13 ARG HA 1 1 11 3479 1 1 13 ARG HB2 H 0.055 -1.155 8.568 1.00 . A A . 13 ARG HB2 1 1 11 3480 1 1 13 ARG HB3 H 1.283 -0.757 7.383 1.00 . A A . 13 ARG HB3 1 1 11 3481 1 1 13 ARG HD2 H 1.524 -0.292 11.551 1.00 . A A . 13 ARG HD2 1 1 11 3482 1 1 13 ARG HD3 H 0.256 -1.098 10.649 1.00 . A A . 13 ARG HD3 1 1 11 3483 1 1 13 ARG HE H 2.349 -2.766 10.165 1.00 . A A . 13 ARG HE 1 1 11 3484 1 1 13 ARG HG2 H 2.769 -0.864 9.105 1.00 . A A . 13 ARG HG2 1 1 11 3485 1 1 13 ARG HG3 H 2.139 0.696 9.594 1.00 . A A . 13 ARG HG3 1 1 11 3486 1 1 13 ARG HH11 H 1.223 -1.303 13.161 1.00 . A A . 13 ARG HH11 1 1 11 3487 1 1 13 ARG HH12 H 1.787 -2.602 14.157 1.00 . A A . 13 ARG HH12 1 1 11 3488 1 1 13 ARG HH21 H 3.094 -4.481 11.480 1.00 . A A . 13 ARG HH21 1 1 11 3489 1 1 13 ARG HH22 H 2.859 -4.422 13.195 1.00 . A A . 13 ARG HH22 1 1 11 3490 1 1 13 ARG N N -1.240 0.794 7.707 1.00 . A A . 13 ARG N 1 1 11 3491 1 1 13 ARG NE N 1.993 -2.268 10.955 1.00 . A A . 13 ARG NE 1 1 11 3492 1 1 13 ARG NH1 N 1.677 -2.189 13.253 1.00 . A A . 13 ARG NH1 1 1 11 3493 1 1 13 ARG NH2 N 2.749 -4.009 12.291 1.00 . A A . 13 ARG NH2 1 1 11 3494 1 1 13 ARG O O 1.251 1.132 5.956 1.00 . A A . 13 ARG O 1 1 11 3495 1 1 14 THR C C 3.239 3.178 5.965 1.00 . A A . 14 THR C 1 1 11 3496 1 1 14 THR CA C 1.894 3.811 6.328 1.00 . A A . 14 THR CA 1 1 11 3497 1 1 14 THR CB C 2.026 5.206 6.944 1.00 . A A . 14 THR CB 1 1 11 3498 1 1 14 THR CG2 C 0.682 5.926 7.053 1.00 . A A . 14 THR CG2 1 1 11 3499 1 1 14 THR H H 0.904 3.424 8.120 1.00 . A A . 14 THR H 1 1 11 3500 1 1 14 THR HA H 1.311 3.872 5.410 1.00 . A A . 14 THR HA 1 1 11 3501 1 1 14 THR HB H 2.747 5.808 6.391 1.00 . A A . 14 THR HB 1 1 11 3502 1 1 14 THR HG1 H 3.124 4.269 8.330 1.00 . A A . 14 THR HG1 1 1 11 3503 1 1 14 THR HG21 H -0.117 5.192 7.160 1.00 . A A . 14 THR HG21 1 1 11 3504 1 1 14 THR HG22 H 0.690 6.582 7.924 1.00 . A A . 14 THR HG22 1 1 11 3505 1 1 14 THR HG23 H 0.512 6.520 6.154 1.00 . A A . 14 THR HG23 1 1 11 3506 1 1 14 THR N N 1.177 2.970 7.272 1.00 . A A . 14 THR N 1 1 11 3507 1 1 14 THR O O 3.473 2.004 6.250 1.00 . A A . 14 THR O 1 1 11 3508 1 1 14 THR OG1 O 2.397 4.955 8.297 1.00 . A A . 14 THR OG1 1 1 11 3509 1 1 15 ALA C C 6.370 3.645 6.114 1.00 . A A . 15 ALA C 1 1 11 3510 1 1 15 ALA CA C 5.401 3.515 4.937 1.00 . A A . 15 ALA CA 1 1 11 3511 1 1 15 ALA CB C 5.867 4.303 3.710 1.00 . A A . 15 ALA CB 1 1 11 3512 1 1 15 ALA H H 3.888 4.936 5.113 1.00 . A A . 15 ALA H 1 1 11 3513 1 1 15 ALA HA H 5.311 2.464 4.665 1.00 . A A . 15 ALA HA 1 1 11 3514 1 1 15 ALA HB1 H 5.288 5.222 3.626 1.00 . A A . 15 ALA HB1 1 1 11 3515 1 1 15 ALA HB2 H 6.924 4.548 3.815 1.00 . A A . 15 ALA HB2 1 1 11 3516 1 1 15 ALA HB3 H 5.722 3.699 2.814 1.00 . A A . 15 ALA HB3 1 1 11 3517 1 1 15 ALA N N 4.087 3.983 5.342 1.00 . A A . 15 ALA N 1 1 11 3518 1 1 15 ALA O O 7.576 3.468 5.953 1.00 . A A . 15 ALA O 1 1 11 3519 1 1 16 ASP C C 6.236 3.001 9.471 1.00 . A A . 16 ASP C 1 1 11 3520 1 1 16 ASP CA C 6.602 4.106 8.477 1.00 . A A . 16 ASP CA 1 1 11 3521 1 1 16 ASP CB C 6.331 5.454 9.148 1.00 . A A . 16 ASP CB 1 1 11 3522 1 1 16 ASP CG C 7.562 6.137 9.747 1.00 . A A . 16 ASP CG 1 1 11 3523 1 1 16 ASP H H 4.822 4.093 7.395 1.00 . A A . 16 ASP H 1 1 11 3524 1 1 16 ASP HA H 7.638 4.042 8.145 1.00 . A A . 16 ASP HA 1 1 11 3525 1 1 16 ASP HB2 H 5.882 6.124 8.415 1.00 . A A . 16 ASP HB2 1 1 11 3526 1 1 16 ASP HB3 H 5.595 5.308 9.939 1.00 . A A . 16 ASP HB3 1 1 11 3527 1 1 16 ASP N N 5.804 3.951 7.273 1.00 . A A . 16 ASP N 1 1 11 3528 1 1 16 ASP O O 6.987 2.730 10.406 1.00 . A A . 16 ASP O 1 1 11 3529 1 1 16 ASP OD1 O 8.623 6.073 9.089 1.00 . A A . 16 ASP OD1 1 1 11 3530 1 1 16 ASP OD2 O 7.414 6.709 10.848 1.00 . A A . 16 ASP OD2 1 1 11 3531 1 1 17 GLY C C 3.628 1.858 11.141 1.00 . A A . 17 GLY C 1 1 11 3532 1 1 17 GLY CA C 4.608 1.325 10.095 1.00 . A A . 17 GLY CA 1 1 11 3533 1 1 17 GLY H H 4.479 2.622 8.470 1.00 . A A . 17 GLY H 1 1 11 3534 1 1 17 GLY HA2 H 4.123 0.556 9.494 1.00 . A A . 17 GLY HA2 1 1 11 3535 1 1 17 GLY HA3 H 5.455 0.852 10.594 1.00 . A A . 17 GLY HA3 1 1 11 3536 1 1 17 GLY N N 5.084 2.395 9.233 1.00 . A A . 17 GLY N 1 1 11 3537 1 1 17 GLY O O 3.159 1.110 11.997 1.00 . A A . 17 GLY O 1 1 11 3538 1 1 18 ARG C C 0.986 3.635 11.473 1.00 . A A . 18 ARG C 1 1 11 3539 1 1 18 ARG CA C 2.427 3.791 11.961 1.00 . A A . 18 ARG CA 1 1 11 3540 1 1 18 ARG CB C 2.749 5.280 12.111 1.00 . A A . 18 ARG CB 1 1 11 3541 1 1 18 ARG CD C 4.581 6.973 12.482 1.00 . A A . 18 ARG CD 1 1 11 3542 1 1 18 ARG CG C 4.214 5.487 12.501 1.00 . A A . 18 ARG CG 1 1 11 3543 1 1 18 ARG CZ C 5.402 8.647 14.134 1.00 . A A . 18 ARG CZ 1 1 11 3544 1 1 18 ARG H H 3.731 3.750 10.336 1.00 . A A . 18 ARG H 1 1 11 3545 1 1 18 ARG HA H 2.579 3.275 12.908 1.00 . A A . 18 ARG HA 1 1 11 3546 1 1 18 ARG HB2 H 2.542 5.796 11.174 1.00 . A A . 18 ARG HB2 1 1 11 3547 1 1 18 ARG HB3 H 2.101 5.721 12.868 1.00 . A A . 18 ARG HB3 1 1 11 3548 1 1 18 ARG HD2 H 5.413 7.141 11.798 1.00 . A A . 18 ARG HD2 1 1 11 3549 1 1 18 ARG HD3 H 3.740 7.559 12.111 1.00 . A A . 18 ARG HD3 1 1 11 3550 1 1 18 ARG HE H 4.850 6.767 14.595 1.00 . A A . 18 ARG HE 1 1 11 3551 1 1 18 ARG HG2 H 4.391 5.078 13.495 1.00 . A A . 18 ARG HG2 1 1 11 3552 1 1 18 ARG HG3 H 4.858 4.941 11.812 1.00 . A A . 18 ARG HG3 1 1 11 3553 1 1 18 ARG HH11 H 5.319 9.318 12.216 1.00 . A A . 18 ARG HH11 1 1 11 3554 1 1 18 ARG HH12 H 5.888 10.471 13.377 1.00 . A A . 18 ARG HH12 1 1 11 3555 1 1 18 ARG HH21 H 5.600 8.288 16.126 1.00 . A A . 18 ARG HH21 1 1 11 3556 1 1 18 ARG HH22 H 6.049 9.881 15.616 1.00 . A A . 18 ARG HH22 1 1 11 3557 1 1 18 ARG N N 3.345 3.149 11.036 1.00 . A A . 18 ARG N 1 1 11 3558 1 1 18 ARG NE N 4.947 7.421 13.844 1.00 . A A . 18 ARG NE 1 1 11 3559 1 1 18 ARG NH1 N 5.549 9.556 13.160 1.00 . A A . 18 ARG NH1 1 1 11 3560 1 1 18 ARG NH2 N 5.710 8.966 15.399 1.00 . A A . 18 ARG NH2 1 1 11 3561 1 1 18 ARG O O 0.611 4.193 10.442 1.00 . A A . 18 ARG O 1 1 11 3562 1 1 19 CYS C C -1.880 3.992 11.787 1.00 . A A . 19 CYS C 1 1 11 3563 1 1 19 CYS CA C -1.177 2.638 11.896 1.00 . A A . 19 CYS CA 1 1 11 3564 1 1 19 CYS CB C -1.860 1.719 12.910 1.00 . A A . 19 CYS CB 1 1 11 3565 1 1 19 CYS H H 0.529 2.423 13.073 1.00 . A A . 19 CYS H 1 1 11 3566 1 1 19 CYS HA H -1.181 2.122 10.936 1.00 . A A . 19 CYS HA 1 1 11 3567 1 1 19 CYS HB2 H -1.766 2.162 13.901 1.00 . A A . 19 CYS HB2 1 1 11 3568 1 1 19 CYS HB3 H -2.924 1.675 12.681 1.00 . A A . 19 CYS HB3 1 1 11 3569 1 1 19 CYS N N 0.216 2.873 12.236 1.00 . A A . 19 CYS N 1 1 11 3570 1 1 19 CYS O O -2.282 4.569 12.797 1.00 . A A . 19 CYS O 1 1 11 3571 1 1 19 CYS SG S -1.201 0.012 12.966 1.00 . A A . 19 CYS SG 1 1 11 3572 1 1 20 LYS C C -4.122 5.494 9.936 1.00 . A A . 20 LYS C 1 1 11 3573 1 1 20 LYS CA C -2.656 5.735 10.301 1.00 . A A . 20 LYS CA 1 1 11 3574 1 1 20 LYS CB C -1.882 6.529 9.247 1.00 . A A . 20 LYS CB 1 1 11 3575 1 1 20 LYS CD C -1.071 8.915 9.334 1.00 . A A . 20 LYS CD 1 1 11 3576 1 1 20 LYS CE C 0.185 9.755 9.573 1.00 . A A . 20 LYS CE 1 1 11 3577 1 1 20 LYS CG C -0.905 7.506 9.905 1.00 . A A . 20 LYS CG 1 1 11 3578 1 1 20 LYS H H -1.680 3.983 9.739 1.00 . A A . 20 LYS H 1 1 11 3579 1 1 20 LYS HA H -2.621 6.309 11.228 1.00 . A A . 20 LYS HA 1 1 11 3580 1 1 20 LYS HB2 H -1.336 5.844 8.599 1.00 . A A . 20 LYS HB2 1 1 11 3581 1 1 20 LYS HB3 H -2.580 7.078 8.615 1.00 . A A . 20 LYS HB3 1 1 11 3582 1 1 20 LYS HD2 H -1.275 8.857 8.265 1.00 . A A . 20 LYS HD2 1 1 11 3583 1 1 20 LYS HD3 H -1.930 9.400 9.796 1.00 . A A . 20 LYS HD3 1 1 11 3584 1 1 20 LYS HE2 H 1.063 9.217 9.215 1.00 . A A . 20 LYS HE2 1 1 11 3585 1 1 20 LYS HE3 H 0.125 10.682 9.003 1.00 . A A . 20 LYS HE3 1 1 11 3586 1 1 20 LYS HG2 H -1.073 7.524 10.982 1.00 . A A . 20 LYS HG2 1 1 11 3587 1 1 20 LYS HG3 H 0.118 7.163 9.748 1.00 . A A . 20 LYS HG3 1 1 11 3588 1 1 20 LYS HZ1 H -0.557 10.023 11.459 1.00 . A A . 20 LYS HZ1 1 1 11 3589 1 1 20 LYS HZ2 H 0.948 9.389 11.434 1.00 . A A . 20 LYS HZ2 1 1 11 3590 1 1 20 LYS HZ3 H 0.726 10.976 11.121 1.00 . A A . 20 LYS HZ3 1 1 11 3591 1 1 20 LYS N N -2.009 4.459 10.554 1.00 . A A . 20 LYS N 1 1 11 3592 1 1 20 LYS NZ N 0.338 10.061 11.013 1.00 . A A . 20 LYS NZ 1 1 11 3593 1 1 20 LYS O O -4.517 4.364 9.650 1.00 . A A . 20 LYS O 1 1 11 3594 1 1 21 PRO C C -6.531 6.361 8.125 1.00 . A A . 21 PRO C 1 1 11 3595 1 1 21 PRO CA C -6.324 6.522 9.631 1.00 . A A . 21 PRO CA 1 1 11 3596 1 1 21 PRO CB C -6.927 7.804 10.181 1.00 . A A . 21 PRO CB 1 1 11 3597 1 1 21 PRO CD C -4.478 7.956 10.290 1.00 . A A . 21 PRO CD 1 1 11 3598 1 1 21 PRO CG C -5.763 8.762 10.379 1.00 . A A . 21 PRO CG 1 1 11 3599 1 1 21 PRO HA H -6.731 5.711 10.051 1.00 . A A . 21 PRO HA 1 1 11 3600 1 1 21 PRO HB2 H -7.660 8.219 9.489 1.00 . A A . 21 PRO HB2 1 1 11 3601 1 1 21 PRO HB3 H -7.446 7.620 11.122 1.00 . A A . 21 PRO HB3 1 1 11 3602 1 1 21 PRO HD2 H -3.810 8.357 9.528 1.00 . A A . 21 PRO HD2 1 1 11 3603 1 1 21 PRO HD3 H -3.932 7.976 11.235 1.00 . A A . 21 PRO HD3 1 1 11 3604 1 1 21 PRO HG2 H -5.777 9.542 9.618 1.00 . A A . 21 PRO HG2 1 1 11 3605 1 1 21 PRO HG3 H -5.837 9.258 11.346 1.00 . A A . 21 PRO HG3 1 1 11 3606 1 1 21 PRO N N -4.910 6.602 9.957 1.00 . A A . 21 PRO N 1 1 11 3607 1 1 21 PRO O O -5.786 6.930 7.328 1.00 . A A . 21 PRO O 1 1 11 3608 1 1 22 THR C C -8.714 6.483 5.820 1.00 . A A . 22 THR C 1 1 11 3609 1 1 22 THR CA C -7.862 5.342 6.380 1.00 . A A . 22 THR CA 1 1 11 3610 1 1 22 THR CB C -8.536 3.973 6.278 1.00 . A A . 22 THR CB 1 1 11 3611 1 1 22 THR CG2 C -8.256 3.280 4.944 1.00 . A A . 22 THR CG2 1 1 11 3612 1 1 22 THR H H -8.149 5.126 8.433 1.00 . A A . 22 THR H 1 1 11 3613 1 1 22 THR HA H -6.930 5.332 5.815 1.00 . A A . 22 THR HA 1 1 11 3614 1 1 22 THR HB H -9.608 4.052 6.458 1.00 . A A . 22 THR HB 1 1 11 3615 1 1 22 THR HG1 H -6.859 3.298 7.136 1.00 . A A . 22 THR HG1 1 1 11 3616 1 1 22 THR HG21 H -7.734 3.970 4.279 1.00 . A A . 22 THR HG21 1 1 11 3617 1 1 22 THR HG22 H -7.636 2.400 5.113 1.00 . A A . 22 THR HG22 1 1 11 3618 1 1 22 THR HG23 H -9.198 2.978 4.486 1.00 . A A . 22 THR HG23 1 1 11 3619 1 1 22 THR N N -7.547 5.585 7.778 1.00 . A A . 22 THR N 1 1 11 3620 1 1 22 THR O O -9.193 6.407 4.689 1.00 . A A . 22 THR O 1 1 11 3621 1 1 22 THR OG1 O -7.846 3.174 7.236 1.00 . A A . 22 THR OG1 1 1 11 3622 1 1 23 PHE C C -8.790 9.918 6.137 1.00 . A A . 23 PHE C 1 1 11 3623 1 1 23 PHE CA C -9.665 8.667 6.238 1.00 . A A . 23 PHE CA 1 1 11 3624 1 1 23 PHE CB C -10.723 8.885 7.322 1.00 . A A . 23 PHE CB 1 1 11 3625 1 1 23 PHE CD1 C -9.430 10.136 9.064 1.00 . A A . 23 PHE CD1 1 1 11 3626 1 1 23 PHE CD2 C -10.354 8.050 9.654 1.00 . A A . 23 PHE CD2 1 1 11 3627 1 1 23 PHE CE1 C -8.897 10.270 10.373 1.00 . A A . 23 PHE CE1 1 1 11 3628 1 1 23 PHE CE2 C -9.820 8.184 10.963 1.00 . A A . 23 PHE CE2 1 1 11 3629 1 1 23 PHE CG C -10.148 9.029 8.732 1.00 . A A . 23 PHE CG 1 1 11 3630 1 1 23 PHE CZ C -9.103 9.291 11.295 1.00 . A A . 23 PHE CZ 1 1 11 3631 1 1 23 PHE H H -8.487 7.566 7.556 1.00 . A A . 23 PHE H 1 1 11 3632 1 1 23 PHE HA H -10.093 8.445 5.260 1.00 . A A . 23 PHE HA 1 1 11 3633 1 1 23 PHE HB2 H -11.296 9.780 7.081 1.00 . A A . 23 PHE HB2 1 1 11 3634 1 1 23 PHE HB3 H -11.420 8.046 7.309 1.00 . A A . 23 PHE HB3 1 1 11 3635 1 1 23 PHE HD1 H -9.266 10.920 8.325 1.00 . A A . 23 PHE HD1 1 1 11 3636 1 1 23 PHE HD2 H -10.929 7.164 9.388 1.00 . A A . 23 PHE HD2 1 1 11 3637 1 1 23 PHE HE1 H -8.323 11.157 10.639 1.00 . A A . 23 PHE HE1 1 1 11 3638 1 1 23 PHE HE2 H -9.986 7.401 11.702 1.00 . A A . 23 PHE HE2 1 1 11 3639 1 1 23 PHE HZ H -8.693 9.394 12.300 1.00 . A A . 23 PHE HZ 1 1 11 3640 1 1 23 PHE N N -8.879 7.512 6.638 1.00 . A A . 23 PHE N 1 1 11 3641 1 1 23 PHE O O -9.186 10.908 5.524 1.00 . A A . 23 PHE O 1 1 12 3642 1 1 1 GLU C C -6.862 -10.688 12.117 1.00 . A A . 1 GLU C 1 1 12 3643 1 1 1 GLU CA C -8.236 -10.937 12.742 1.00 . A A . 1 GLU CA 1 1 12 3644 1 1 1 GLU CB C -9.216 -9.821 12.375 1.00 . A A . 1 GLU CB 1 1 12 3645 1 1 1 GLU CD C -10.873 -11.318 11.203 1.00 . A A . 1 GLU CD 1 1 12 3646 1 1 1 GLU CG C -9.925 -10.125 11.054 1.00 . A A . 1 GLU CG 1 1 12 3647 1 1 1 GLU HA H -8.634 -11.890 12.393 1.00 . A A . 1 GLU HA 1 1 12 3648 1 1 1 GLU HB2 H -9.953 -9.703 13.169 1.00 . A A . 1 GLU HB2 1 1 12 3649 1 1 1 GLU HB3 H -8.681 -8.874 12.294 1.00 . A A . 1 GLU HB3 1 1 12 3650 1 1 1 GLU HG2 H -10.486 -9.250 10.728 1.00 . A A . 1 GLU HG2 1 1 12 3651 1 1 1 GLU HG3 H -9.187 -10.338 10.281 1.00 . A A . 1 GLU HG3 1 1 12 3652 1 1 1 GLU N N -8.117 -11.073 14.183 1.00 . A A . 1 GLU N 1 1 12 3653 1 1 1 GLU O O -6.649 -9.669 11.462 1.00 . A A . 1 GLU O 1 1 12 3654 1 1 1 GLU OE1 O -10.356 -12.456 11.206 1.00 . A A . 1 GLU OE1 1 1 12 3655 1 1 1 GLU OE2 O -12.092 -11.064 11.312 1.00 . A A . 1 GLU OE2 1 1 12 3656 1 1 2 ASN C C -3.985 -10.221 12.279 1.00 . A A . 2 ASN C 1 1 12 3657 1 1 2 ASN CA C -4.616 -11.532 11.808 1.00 . A A . 2 ASN CA 1 1 12 3658 1 1 2 ASN CB C -4.628 -11.529 10.278 1.00 . A A . 2 ASN CB 1 1 12 3659 1 1 2 ASN CG C -4.181 -12.883 9.723 1.00 . A A . 2 ASN CG 1 1 12 3660 1 1 2 ASN H H -6.145 -12.462 12.876 1.00 . A A . 2 ASN H 1 1 12 3661 1 1 2 ASN HA H -4.090 -12.409 12.188 1.00 . A A . 2 ASN HA 1 1 12 3662 1 1 2 ASN HB2 H -5.632 -11.299 9.919 1.00 . A A . 2 ASN HB2 1 1 12 3663 1 1 2 ASN HB3 H -3.970 -10.744 9.907 1.00 . A A . 2 ASN HB3 1 1 12 3664 1 1 2 ASN HD21 H -2.436 -12.023 9.163 1.00 . A A . 2 ASN HD21 1 1 12 3665 1 1 2 ASN HD22 H -2.584 -13.707 8.790 1.00 . A A . 2 ASN HD22 1 1 12 3666 1 1 2 ASN N N -5.963 -11.636 12.342 1.00 . A A . 2 ASN N 1 1 12 3667 1 1 2 ASN ND2 N -2.966 -12.869 9.181 1.00 . A A . 2 ASN ND2 1 1 12 3668 1 1 2 ASN O O -4.675 -9.352 12.810 1.00 . A A . 2 ASN O 1 1 12 3669 1 1 2 ASN OD1 O -4.890 -13.873 9.783 1.00 . A A . 2 ASN OD1 1 1 12 3670 1 1 3 PHE C C -1.301 -8.255 11.252 1.00 . A A . 3 PHE C 1 1 12 3671 1 1 3 PHE CA C -1.949 -8.928 12.463 1.00 . A A . 3 PHE CA 1 1 12 3672 1 1 3 PHE CB C -0.853 -9.377 13.430 1.00 . A A . 3 PHE CB 1 1 12 3673 1 1 3 PHE CD1 C 0.199 -7.399 14.550 1.00 . A A . 3 PHE CD1 1 1 12 3674 1 1 3 PHE CD2 C 1.377 -8.434 12.790 1.00 . A A . 3 PHE CD2 1 1 12 3675 1 1 3 PHE CE1 C 1.254 -6.462 14.704 1.00 . A A . 3 PHE CE1 1 1 12 3676 1 1 3 PHE CE2 C 2.432 -7.495 12.944 1.00 . A A . 3 PHE CE2 1 1 12 3677 1 1 3 PHE CG C 0.283 -8.366 13.596 1.00 . A A . 3 PHE CG 1 1 12 3678 1 1 3 PHE CZ C 2.348 -6.529 13.898 1.00 . A A . 3 PHE CZ 1 1 12 3679 1 1 3 PHE H H -2.128 -10.831 11.633 1.00 . A A . 3 PHE H 1 1 12 3680 1 1 3 PHE HA H -2.667 -8.243 12.915 1.00 . A A . 3 PHE HA 1 1 12 3681 1 1 3 PHE HB2 H -1.300 -9.570 14.405 1.00 . A A . 3 PHE HB2 1 1 12 3682 1 1 3 PHE HB3 H -0.437 -10.322 13.078 1.00 . A A . 3 PHE HB3 1 1 12 3683 1 1 3 PHE HD1 H -0.677 -7.345 15.195 1.00 . A A . 3 PHE HD1 1 1 12 3684 1 1 3 PHE HD2 H 1.444 -9.208 12.027 1.00 . A A . 3 PHE HD2 1 1 12 3685 1 1 3 PHE HE1 H 1.187 -5.686 15.468 1.00 . A A . 3 PHE HE1 1 1 12 3686 1 1 3 PHE HE2 H 3.308 -7.549 12.299 1.00 . A A . 3 PHE HE2 1 1 12 3687 1 1 3 PHE HZ H 3.157 -5.808 14.016 1.00 . A A . 3 PHE HZ 1 1 12 3688 1 1 3 PHE N N -2.681 -10.119 12.067 1.00 . A A . 3 PHE N 1 1 12 3689 1 1 3 PHE O O -0.291 -8.736 10.736 1.00 . A A . 3 PHE O 1 1 12 3690 1 1 4 ASN C C -0.613 -5.195 10.187 1.00 . A A . 4 ASN C 1 1 12 3691 1 1 4 ASN CA C -1.399 -6.411 9.690 1.00 . A A . 4 ASN CA 1 1 12 3692 1 1 4 ASN CB C -2.544 -5.906 8.809 1.00 . A A . 4 ASN CB 1 1 12 3693 1 1 4 ASN CG C -3.672 -5.318 9.660 1.00 . A A . 4 ASN CG 1 1 12 3694 1 1 4 ASN H H -2.726 -6.770 11.255 1.00 . A A . 4 ASN H 1 1 12 3695 1 1 4 ASN HA H -0.774 -7.116 9.143 1.00 . A A . 4 ASN HA 1 1 12 3696 1 1 4 ASN HB2 H -2.171 -5.148 8.121 1.00 . A A . 4 ASN HB2 1 1 12 3697 1 1 4 ASN HB3 H -2.930 -6.725 8.203 1.00 . A A . 4 ASN HB3 1 1 12 3698 1 1 4 ASN HD21 H -3.114 -3.473 9.041 1.00 . A A . 4 ASN HD21 1 1 12 3699 1 1 4 ASN HD22 H -4.463 -3.514 10.127 1.00 . A A . 4 ASN HD22 1 1 12 3700 1 1 4 ASN N N -1.906 -7.154 10.831 1.00 . A A . 4 ASN N 1 1 12 3701 1 1 4 ASN ND2 N -3.756 -3.992 9.604 1.00 . A A . 4 ASN ND2 1 1 12 3702 1 1 4 ASN O O -0.900 -4.064 9.797 1.00 . A A . 4 ASN O 1 1 12 3703 1 1 4 ASN OD1 O -4.416 -6.023 10.323 1.00 . A A . 4 ASN OD1 1 1 12 3704 1 1 5 GLY C C 0.887 -4.198 13.078 1.00 . A A . 5 GLY C 1 1 12 3705 1 1 5 GLY CA C 1.192 -4.413 11.594 1.00 . A A . 5 GLY CA 1 1 12 3706 1 1 5 GLY H H 0.589 -6.392 11.352 1.00 . A A . 5 GLY H 1 1 12 3707 1 1 5 GLY HA2 H 2.243 -4.668 11.468 1.00 . A A . 5 GLY HA2 1 1 12 3708 1 1 5 GLY HA3 H 1.020 -3.487 11.046 1.00 . A A . 5 GLY HA3 1 1 12 3709 1 1 5 GLY N N 0.363 -5.470 11.040 1.00 . A A . 5 GLY N 1 1 12 3710 1 1 5 GLY O O 1.796 -3.978 13.877 1.00 . A A . 5 GLY O 1 1 12 3711 1 1 6 GLY C C -1.660 -2.807 14.921 1.00 . A A . 6 GLY C 1 1 12 3712 1 1 6 GLY CA C -0.832 -4.085 14.776 1.00 . A A . 6 GLY CA 1 1 12 3713 1 1 6 GLY H H -1.129 -4.449 12.747 1.00 . A A . 6 GLY H 1 1 12 3714 1 1 6 GLY HA2 H -1.424 -4.944 15.092 1.00 . A A . 6 GLY HA2 1 1 12 3715 1 1 6 GLY HA3 H 0.036 -4.037 15.433 1.00 . A A . 6 GLY HA3 1 1 12 3716 1 1 6 GLY N N -0.396 -4.269 13.403 1.00 . A A . 6 GLY N 1 1 12 3717 1 1 6 GLY O O -1.323 -1.932 15.718 1.00 . A A . 6 GLY O 1 1 12 3718 1 1 7 CYS C C -4.801 -1.910 15.068 1.00 . A A . 7 CYS C 1 1 12 3719 1 1 7 CYS CA C -3.606 -1.582 14.171 1.00 . A A . 7 CYS CA 1 1 12 3720 1 1 7 CYS CB C -4.044 -1.166 12.765 1.00 . A A . 7 CYS CB 1 1 12 3721 1 1 7 CYS H H -2.994 -3.454 13.494 1.00 . A A . 7 CYS H 1 1 12 3722 1 1 7 CYS HA H -3.025 -0.759 14.587 1.00 . A A . 7 CYS HA 1 1 12 3723 1 1 7 CYS HB2 H -4.371 -2.054 12.224 1.00 . A A . 7 CYS HB2 1 1 12 3724 1 1 7 CYS HB3 H -4.910 -0.507 12.850 1.00 . A A . 7 CYS HB3 1 1 12 3725 1 1 7 CYS N N -2.727 -2.738 14.139 1.00 . A A . 7 CYS N 1 1 12 3726 1 1 7 CYS O O -4.882 -3.005 15.623 1.00 . A A . 7 CYS O 1 1 12 3727 1 1 7 CYS SG S -2.757 -0.317 11.780 1.00 . A A . 7 CYS SG 1 1 12 3728 1 1 8 LEU C C -7.982 -1.786 15.168 1.00 . A A . 8 LEU C 1 1 12 3729 1 1 8 LEU CA C -6.887 -1.117 16.000 1.00 . A A . 8 LEU CA 1 1 12 3730 1 1 8 LEU CB C -7.311 0.218 16.618 1.00 . A A . 8 LEU CB 1 1 12 3731 1 1 8 LEU CD1 C -8.638 -0.845 18.480 1.00 . A A . 8 LEU CD1 1 1 12 3732 1 1 8 LEU CD2 C -8.968 1.607 17.916 1.00 . A A . 8 LEU CD2 1 1 12 3733 1 1 8 LEU CG C -8.641 0.214 17.375 1.00 . A A . 8 LEU CG 1 1 12 3734 1 1 8 LEU H H -5.626 -0.056 14.725 1.00 . A A . 8 LEU H 1 1 12 3735 1 1 8 LEU HA H -6.622 -1.781 16.822 1.00 . A A . 8 LEU HA 1 1 12 3736 1 1 8 LEU HB2 H -6.527 0.545 17.301 1.00 . A A . 8 LEU HB2 1 1 12 3737 1 1 8 LEU HB3 H -7.371 0.960 15.822 1.00 . A A . 8 LEU HB3 1 1 12 3738 1 1 8 LEU HD11 H -8.360 -1.810 18.058 1.00 . A A . 8 LEU HD11 1 1 12 3739 1 1 8 LEU HD12 H -7.920 -0.563 19.250 1.00 . A A . 8 LEU HD12 1 1 12 3740 1 1 8 LEU HD13 H -9.634 -0.913 18.918 1.00 . A A . 8 LEU HD13 1 1 12 3741 1 1 8 LEU HD21 H -8.187 2.306 17.614 1.00 . A A . 8 LEU HD21 1 1 12 3742 1 1 8 LEU HD22 H -9.925 1.937 17.514 1.00 . A A . 8 LEU HD22 1 1 12 3743 1 1 8 LEU HD23 H -9.022 1.570 19.004 1.00 . A A . 8 LEU HD23 1 1 12 3744 1 1 8 LEU HG H -9.432 -0.054 16.674 1.00 . A A . 8 LEU HG 1 1 12 3745 1 1 8 LEU N N -5.699 -0.943 15.181 1.00 . A A . 8 LEU N 1 1 12 3746 1 1 8 LEU O O -8.510 -2.828 15.552 1.00 . A A . 8 LEU O 1 1 12 3747 1 1 9 ALA C C -9.785 -0.566 12.214 1.00 . A A . 9 ALA C 1 1 12 3748 1 1 9 ALA CA C -9.317 -1.679 13.154 1.00 . A A . 9 ALA CA 1 1 12 3749 1 1 9 ALA CB C -10.463 -2.264 13.981 1.00 . A A . 9 ALA CB 1 1 12 3750 1 1 9 ALA H H -7.860 -0.309 13.738 1.00 . A A . 9 ALA H 1 1 12 3751 1 1 9 ALA HA H -8.868 -2.477 12.562 1.00 . A A . 9 ALA HA 1 1 12 3752 1 1 9 ALA HB1 H -10.534 -1.733 14.931 1.00 . A A . 9 ALA HB1 1 1 12 3753 1 1 9 ALA HB2 H -11.399 -2.156 13.434 1.00 . A A . 9 ALA HB2 1 1 12 3754 1 1 9 ALA HB3 H -10.273 -3.322 14.169 1.00 . A A . 9 ALA HB3 1 1 12 3755 1 1 9 ALA N N -8.294 -1.158 14.043 1.00 . A A . 9 ALA N 1 1 12 3756 1 1 9 ALA O O -10.617 0.259 12.589 1.00 . A A . 9 ALA O 1 1 12 3757 1 1 10 GLY C C -8.352 1.225 9.588 1.00 . A A . 10 GLY C 1 1 12 3758 1 1 10 GLY CA C -9.581 0.421 10.016 1.00 . A A . 10 GLY CA 1 1 12 3759 1 1 10 GLY H H -8.555 -1.252 10.714 1.00 . A A . 10 GLY H 1 1 12 3760 1 1 10 GLY HA2 H -10.022 -0.067 9.146 1.00 . A A . 10 GLY HA2 1 1 12 3761 1 1 10 GLY HA3 H -10.338 1.093 10.421 1.00 . A A . 10 GLY HA3 1 1 12 3762 1 1 10 GLY N N -9.231 -0.578 11.012 1.00 . A A . 10 GLY N 1 1 12 3763 1 1 10 GLY O O -8.212 1.578 8.418 1.00 . A A . 10 GLY O 1 1 12 3764 1 1 11 TYR C C -5.402 1.537 9.264 1.00 . A A . 11 TYR C 1 1 12 3765 1 1 11 TYR CA C -6.278 2.246 10.299 1.00 . A A . 11 TYR CA 1 1 12 3766 1 1 11 TYR CB C -5.525 2.307 11.630 1.00 . A A . 11 TYR CB 1 1 12 3767 1 1 11 TYR CD1 C -6.375 4.520 12.487 1.00 . A A . 11 TYR CD1 1 1 12 3768 1 1 11 TYR CD2 C -6.666 2.585 13.861 1.00 . A A . 11 TYR CD2 1 1 12 3769 1 1 11 TYR CE1 C -7.020 5.328 13.489 1.00 . A A . 11 TYR CE1 1 1 12 3770 1 1 11 TYR CE2 C -7.311 3.394 14.862 1.00 . A A . 11 TYR CE2 1 1 12 3771 1 1 11 TYR CG C -6.211 3.165 12.694 1.00 . A A . 11 TYR CG 1 1 12 3772 1 1 11 TYR CZ C -7.457 4.725 14.627 1.00 . A A . 11 TYR CZ 1 1 12 3773 1 1 11 TYR H H -7.612 1.199 11.509 1.00 . A A . 11 TYR H 1 1 12 3774 1 1 11 TYR HA H -6.567 3.223 9.912 1.00 . A A . 11 TYR HA 1 1 12 3775 1 1 11 TYR HB2 H -5.407 1.294 12.016 1.00 . A A . 11 TYR HB2 1 1 12 3776 1 1 11 TYR HB3 H -4.524 2.699 11.451 1.00 . A A . 11 TYR HB3 1 1 12 3777 1 1 11 TYR HD1 H -6.015 4.978 11.566 1.00 . A A . 11 TYR HD1 1 1 12 3778 1 1 11 TYR HD2 H -6.536 1.516 14.024 1.00 . A A . 11 TYR HD2 1 1 12 3779 1 1 11 TYR HE1 H -7.156 6.399 13.339 1.00 . A A . 11 TYR HE1 1 1 12 3780 1 1 11 TYR HE2 H -7.675 2.949 15.789 1.00 . A A . 11 TYR HE2 1 1 12 3781 1 1 11 TYR HH H -7.724 5.247 16.481 1.00 . A A . 11 TYR HH 1 1 12 3782 1 1 11 TYR N N -7.492 1.490 10.560 1.00 . A A . 11 TYR N 1 1 12 3783 1 1 11 TYR O O -5.500 0.323 9.090 1.00 . A A . 11 TYR O 1 1 12 3784 1 1 11 TYR OH O -8.067 5.488 15.573 1.00 . A A . 11 TYR OH 1 1 12 3785 1 1 12 MET C C -2.217 1.850 8.053 1.00 . A A . 12 MET C 1 1 12 3786 1 1 12 MET CA C -3.675 1.787 7.590 1.00 . A A . 12 MET CA 1 1 12 3787 1 1 12 MET CB C -3.834 2.586 6.295 1.00 . A A . 12 MET CB 1 1 12 3788 1 1 12 MET CE C -2.972 6.467 5.775 1.00 . A A . 12 MET CE 1 1 12 3789 1 1 12 MET CG C -4.020 4.076 6.589 1.00 . A A . 12 MET CG 1 1 12 3790 1 1 12 MET H H -4.493 3.311 8.751 1.00 . A A . 12 MET H 1 1 12 3791 1 1 12 MET HA H -3.976 0.749 7.456 1.00 . A A . 12 MET HA 1 1 12 3792 1 1 12 MET HB2 H -2.956 2.443 5.664 1.00 . A A . 12 MET HB2 1 1 12 3793 1 1 12 MET HB3 H -4.692 2.212 5.736 1.00 . A A . 12 MET HB3 1 1 12 3794 1 1 12 MET HE1 H -2.354 6.172 6.622 1.00 . A A . 12 MET HE1 1 1 12 3795 1 1 12 MET HE2 H -2.344 6.926 5.010 1.00 . A A . 12 MET HE2 1 1 12 3796 1 1 12 MET HE3 H -3.723 7.184 6.105 1.00 . A A . 12 MET HE3 1 1 12 3797 1 1 12 MET HG2 H -5.019 4.255 6.986 1.00 . A A . 12 MET HG2 1 1 12 3798 1 1 12 MET HG3 H -3.310 4.396 7.352 1.00 . A A . 12 MET HG3 1 1 12 3799 1 1 12 MET N N -4.566 2.325 8.604 1.00 . A A . 12 MET N 1 1 12 3800 1 1 12 MET O O -1.871 2.652 8.919 1.00 . A A . 12 MET O 1 1 12 3801 1 1 12 MET SD S -3.780 5.028 5.097 1.00 . A A . 12 MET SD 1 1 12 3802 1 1 13 ARG C C 0.829 1.744 6.781 1.00 . A A . 13 ARG C 1 1 12 3803 1 1 13 ARG CA C 0.009 0.942 7.795 1.00 . A A . 13 ARG CA 1 1 12 3804 1 1 13 ARG CB C 0.517 -0.501 7.823 1.00 . A A . 13 ARG CB 1 1 12 3805 1 1 13 ARG CD C 2.643 -1.662 8.524 1.00 . A A . 13 ARG CD 1 1 12 3806 1 1 13 ARG CG C 2.037 -0.551 7.663 1.00 . A A . 13 ARG CG 1 1 12 3807 1 1 13 ARG CZ C 3.618 -3.312 6.933 1.00 . A A . 13 ARG CZ 1 1 12 3808 1 1 13 ARG H H -1.692 0.345 6.751 1.00 . A A . 13 ARG H 1 1 12 3809 1 1 13 ARG HA H 0.073 1.385 8.789 1.00 . A A . 13 ARG HA 1 1 12 3810 1 1 13 ARG HB2 H 0.230 -0.973 8.763 1.00 . A A . 13 ARG HB2 1 1 12 3811 1 1 13 ARG HB3 H 0.045 -1.072 7.023 1.00 . A A . 13 ARG HB3 1 1 12 3812 1 1 13 ARG HD2 H 3.660 -1.397 8.811 1.00 . A A . 13 ARG HD2 1 1 12 3813 1 1 13 ARG HD3 H 2.070 -1.773 9.445 1.00 . A A . 13 ARG HD3 1 1 12 3814 1 1 13 ARG HE H 1.873 -3.559 7.904 1.00 . A A . 13 ARG HE 1 1 12 3815 1 1 13 ARG HG2 H 2.292 -0.717 6.617 1.00 . A A . 13 ARG HG2 1 1 12 3816 1 1 13 ARG HG3 H 2.468 0.409 7.947 1.00 . A A . 13 ARG HG3 1 1 12 3817 1 1 13 ARG HH11 H 4.733 -1.633 7.203 1.00 . A A . 13 ARG HH11 1 1 12 3818 1 1 13 ARG HH12 H 5.399 -2.790 6.099 1.00 . A A . 13 ARG HH12 1 1 12 3819 1 1 13 ARG HH21 H 2.750 -5.087 6.448 1.00 . A A . 13 ARG HH21 1 1 12 3820 1 1 13 ARG HH22 H 4.263 -4.768 5.667 1.00 . A A . 13 ARG HH22 1 1 12 3821 1 1 13 ARG N N -1.402 0.994 7.455 1.00 . A A . 13 ARG N 1 1 12 3822 1 1 13 ARG NE N 2.646 -2.938 7.774 1.00 . A A . 13 ARG NE 1 1 12 3823 1 1 13 ARG NH1 N 4.673 -2.511 6.728 1.00 . A A . 13 ARG NH1 1 1 12 3824 1 1 13 ARG NH2 N 3.537 -4.488 6.295 1.00 . A A . 13 ARG NH2 1 1 12 3825 1 1 13 ARG O O 1.044 1.294 5.657 1.00 . A A . 13 ARG O 1 1 12 3826 1 1 14 THR C C 3.335 3.077 5.917 1.00 . A A . 14 THR C 1 1 12 3827 1 1 14 THR CA C 2.054 3.786 6.360 1.00 . A A . 14 THR CA 1 1 12 3828 1 1 14 THR CB C 2.313 5.088 7.120 1.00 . A A . 14 THR CB 1 1 12 3829 1 1 14 THR CG2 C 1.053 5.636 7.791 1.00 . A A . 14 THR CG2 1 1 12 3830 1 1 14 THR H H 1.085 3.276 8.132 1.00 . A A . 14 THR H 1 1 12 3831 1 1 14 THR HA H 1.478 3.998 5.460 1.00 . A A . 14 THR HA 1 1 12 3832 1 1 14 THR HB H 2.763 5.837 6.467 1.00 . A A . 14 THR HB 1 1 12 3833 1 1 14 THR HG1 H 2.606 4.197 8.887 1.00 . A A . 14 THR HG1 1 1 12 3834 1 1 14 THR HG21 H 0.226 4.944 7.632 1.00 . A A . 14 THR HG21 1 1 12 3835 1 1 14 THR HG22 H 1.231 5.749 8.861 1.00 . A A . 14 THR HG22 1 1 12 3836 1 1 14 THR HG23 H 0.802 6.606 7.360 1.00 . A A . 14 THR HG23 1 1 12 3837 1 1 14 THR N N 1.264 2.918 7.216 1.00 . A A . 14 THR N 1 1 12 3838 1 1 14 THR O O 3.368 1.850 5.820 1.00 . A A . 14 THR O 1 1 12 3839 1 1 14 THR OG1 O 3.145 4.696 8.208 1.00 . A A . 14 THR OG1 1 1 12 3840 1 1 15 ALA C C 6.564 3.205 6.439 1.00 . A A . 15 ALA C 1 1 12 3841 1 1 15 ALA CA C 5.638 3.341 5.227 1.00 . A A . 15 ALA CA 1 1 12 3842 1 1 15 ALA CB C 6.228 4.240 4.140 1.00 . A A . 15 ALA CB 1 1 12 3843 1 1 15 ALA H H 4.323 4.873 5.739 1.00 . A A . 15 ALA H 1 1 12 3844 1 1 15 ALA HA H 5.459 2.352 4.805 1.00 . A A . 15 ALA HA 1 1 12 3845 1 1 15 ALA HB1 H 5.440 4.543 3.450 1.00 . A A . 15 ALA HB1 1 1 12 3846 1 1 15 ALA HB2 H 6.668 5.126 4.600 1.00 . A A . 15 ALA HB2 1 1 12 3847 1 1 15 ALA HB3 H 6.998 3.695 3.595 1.00 . A A . 15 ALA HB3 1 1 12 3848 1 1 15 ALA N N 4.358 3.877 5.658 1.00 . A A . 15 ALA N 1 1 12 3849 1 1 15 ALA O O 7.718 2.803 6.300 1.00 . A A . 15 ALA O 1 1 12 3850 1 1 16 ASP C C 6.075 2.532 9.809 1.00 . A A . 16 ASP C 1 1 12 3851 1 1 16 ASP CA C 6.787 3.471 8.832 1.00 . A A . 16 ASP CA 1 1 12 3852 1 1 16 ASP CB C 6.903 4.844 9.496 1.00 . A A . 16 ASP CB 1 1 12 3853 1 1 16 ASP CG C 8.292 5.481 9.425 1.00 . A A . 16 ASP CG 1 1 12 3854 1 1 16 ASP H H 5.084 3.875 7.703 1.00 . A A . 16 ASP H 1 1 12 3855 1 1 16 ASP HA H 7.769 3.100 8.539 1.00 . A A . 16 ASP HA 1 1 12 3856 1 1 16 ASP HB2 H 6.186 5.519 9.028 1.00 . A A . 16 ASP HB2 1 1 12 3857 1 1 16 ASP HB3 H 6.615 4.751 10.543 1.00 . A A . 16 ASP HB3 1 1 12 3858 1 1 16 ASP N N 6.023 3.549 7.599 1.00 . A A . 16 ASP N 1 1 12 3859 1 1 16 ASP O O 6.586 2.255 10.893 1.00 . A A . 16 ASP O 1 1 12 3860 1 1 16 ASP OD1 O 8.538 6.198 8.431 1.00 . A A . 16 ASP OD1 1 1 12 3861 1 1 16 ASP OD2 O 9.077 5.237 10.367 1.00 . A A . 16 ASP OD2 1 1 12 3862 1 1 17 GLY C C 3.093 1.941 11.046 1.00 . A A . 17 GLY C 1 1 12 3863 1 1 17 GLY CA C 4.119 1.168 10.216 1.00 . A A . 17 GLY CA 1 1 12 3864 1 1 17 GLY H H 4.497 2.299 8.508 1.00 . A A . 17 GLY H 1 1 12 3865 1 1 17 GLY HA2 H 3.608 0.442 9.583 1.00 . A A . 17 GLY HA2 1 1 12 3866 1 1 17 GLY HA3 H 4.779 0.605 10.877 1.00 . A A . 17 GLY HA3 1 1 12 3867 1 1 17 GLY N N 4.906 2.069 9.391 1.00 . A A . 17 GLY N 1 1 12 3868 1 1 17 GLY O O 2.235 1.341 11.693 1.00 . A A . 17 GLY O 1 1 12 3869 1 1 18 ARG C C 0.861 3.856 11.319 1.00 . A A . 18 ARG C 1 1 12 3870 1 1 18 ARG CA C 2.307 4.119 11.742 1.00 . A A . 18 ARG CA 1 1 12 3871 1 1 18 ARG CB C 2.637 5.596 11.513 1.00 . A A . 18 ARG CB 1 1 12 3872 1 1 18 ARG CD C 4.373 7.372 11.949 1.00 . A A . 18 ARG CD 1 1 12 3873 1 1 18 ARG CG C 4.118 5.874 11.777 1.00 . A A . 18 ARG CG 1 1 12 3874 1 1 18 ARG CZ C 5.223 8.109 9.725 1.00 . A A . 18 ARG CZ 1 1 12 3875 1 1 18 ARG H H 3.914 3.739 10.473 1.00 . A A . 18 ARG H 1 1 12 3876 1 1 18 ARG HA H 2.464 3.855 12.788 1.00 . A A . 18 ARG HA 1 1 12 3877 1 1 18 ARG HB2 H 2.389 5.872 10.488 1.00 . A A . 18 ARG HB2 1 1 12 3878 1 1 18 ARG HB3 H 2.025 6.215 12.167 1.00 . A A . 18 ARG HB3 1 1 12 3879 1 1 18 ARG HD2 H 3.455 7.929 11.761 1.00 . A A . 18 ARG HD2 1 1 12 3880 1 1 18 ARG HD3 H 4.670 7.584 12.976 1.00 . A A . 18 ARG HD3 1 1 12 3881 1 1 18 ARG HE H 6.364 7.902 11.370 1.00 . A A . 18 ARG HE 1 1 12 3882 1 1 18 ARG HG2 H 4.437 5.342 12.674 1.00 . A A . 18 ARG HG2 1 1 12 3883 1 1 18 ARG HG3 H 4.717 5.492 10.950 1.00 . A A . 18 ARG HG3 1 1 12 3884 1 1 18 ARG HH11 H 3.229 7.713 9.783 1.00 . A A . 18 ARG HH11 1 1 12 3885 1 1 18 ARG HH12 H 3.835 8.226 8.244 1.00 . A A . 18 ARG HH12 1 1 12 3886 1 1 18 ARG HH21 H 7.163 8.580 9.340 1.00 . A A . 18 ARG HH21 1 1 12 3887 1 1 18 ARG HH22 H 6.088 8.722 7.990 1.00 . A A . 18 ARG HH22 1 1 12 3888 1 1 18 ARG N N 3.214 3.259 11.002 1.00 . A A . 18 ARG N 1 1 12 3889 1 1 18 ARG NE N 5.433 7.816 11.016 1.00 . A A . 18 ARG NE 1 1 12 3890 1 1 18 ARG NH1 N 3.991 8.007 9.207 1.00 . A A . 18 ARG NH1 1 1 12 3891 1 1 18 ARG NH2 N 6.244 8.504 8.953 1.00 . A A . 18 ARG NH2 1 1 12 3892 1 1 18 ARG O O 0.468 4.182 10.200 1.00 . A A . 18 ARG O 1 1 12 3893 1 1 19 CYS C C -2.057 4.273 11.847 1.00 . A A . 19 CYS C 1 1 12 3894 1 1 19 CYS CA C -1.287 2.958 11.973 1.00 . A A . 19 CYS CA 1 1 12 3895 1 1 19 CYS CB C -1.879 2.052 13.054 1.00 . A A . 19 CYS CB 1 1 12 3896 1 1 19 CYS H H 0.435 3.005 13.144 1.00 . A A . 19 CYS H 1 1 12 3897 1 1 19 CYS HA H -1.313 2.403 11.035 1.00 . A A . 19 CYS HA 1 1 12 3898 1 1 19 CYS HB2 H -1.696 2.505 14.028 1.00 . A A . 19 CYS HB2 1 1 12 3899 1 1 19 CYS HB3 H -2.959 2.008 12.921 1.00 . A A . 19 CYS HB3 1 1 12 3900 1 1 19 CYS N N 0.108 3.268 12.236 1.00 . A A . 19 CYS N 1 1 12 3901 1 1 19 CYS O O -2.489 4.842 12.848 1.00 . A A . 19 CYS O 1 1 12 3902 1 1 19 CYS SG S -1.221 0.344 13.071 1.00 . A A . 19 CYS SG 1 1 12 3903 1 1 20 LYS C C -4.366 5.638 9.972 1.00 . A A . 20 LYS C 1 1 12 3904 1 1 20 LYS CA C -2.915 5.957 10.338 1.00 . A A . 20 LYS CA 1 1 12 3905 1 1 20 LYS CB C -2.179 6.776 9.275 1.00 . A A . 20 LYS CB 1 1 12 3906 1 1 20 LYS CD C -1.639 9.196 8.818 1.00 . A A . 20 LYS CD 1 1 12 3907 1 1 20 LYS CE C -0.246 9.810 8.671 1.00 . A A . 20 LYS CE 1 1 12 3908 1 1 20 LYS CG C -1.639 8.080 9.865 1.00 . A A . 20 LYS CG 1 1 12 3909 1 1 20 LYS H H -1.850 4.250 9.799 1.00 . A A . 20 LYS H 1 1 12 3910 1 1 20 LYS HA H -2.911 6.543 11.256 1.00 . A A . 20 LYS HA 1 1 12 3911 1 1 20 LYS HB2 H -1.357 6.191 8.864 1.00 . A A . 20 LYS HB2 1 1 12 3912 1 1 20 LYS HB3 H -2.855 6.998 8.449 1.00 . A A . 20 LYS HB3 1 1 12 3913 1 1 20 LYS HD2 H -1.969 8.800 7.858 1.00 . A A . 20 LYS HD2 1 1 12 3914 1 1 20 LYS HD3 H -2.352 9.969 9.105 1.00 . A A . 20 LYS HD3 1 1 12 3915 1 1 20 LYS HE2 H 0.217 9.916 9.653 1.00 . A A . 20 LYS HE2 1 1 12 3916 1 1 20 LYS HE3 H 0.392 9.145 8.088 1.00 . A A . 20 LYS HE3 1 1 12 3917 1 1 20 LYS HG2 H -2.249 8.377 10.718 1.00 . A A . 20 LYS HG2 1 1 12 3918 1 1 20 LYS HG3 H -0.626 7.924 10.235 1.00 . A A . 20 LYS HG3 1 1 12 3919 1 1 20 LYS HZ1 H -1.253 11.270 7.655 1.00 . A A . 20 LYS HZ1 1 1 12 3920 1 1 20 LYS HZ2 H -0.116 11.850 8.674 1.00 . A A . 20 LYS HZ2 1 1 12 3921 1 1 20 LYS HZ3 H 0.328 11.170 7.257 1.00 . A A . 20 LYS HZ3 1 1 12 3922 1 1 20 LYS N N -2.204 4.719 10.608 1.00 . A A . 20 LYS N 1 1 12 3923 1 1 20 LYS NZ N -0.328 11.132 8.011 1.00 . A A . 20 LYS NZ 1 1 12 3924 1 1 20 LYS O O -4.737 4.472 9.849 1.00 . A A . 20 LYS O 1 1 12 3925 1 1 21 PRO C C -6.732 6.182 7.988 1.00 . A A . 21 PRO C 1 1 12 3926 1 1 21 PRO CA C -6.570 6.571 9.458 1.00 . A A . 21 PRO CA 1 1 12 3927 1 1 21 PRO CB C -7.206 7.911 9.792 1.00 . A A . 21 PRO CB 1 1 12 3928 1 1 21 PRO CD C -4.762 8.119 9.942 1.00 . A A . 21 PRO CD 1 1 12 3929 1 1 21 PRO CG C -6.060 8.906 9.874 1.00 . A A . 21 PRO CG 1 1 12 3930 1 1 21 PRO HA H -6.979 5.825 9.985 1.00 . A A . 21 PRO HA 1 1 12 3931 1 1 21 PRO HB2 H -7.924 8.204 9.027 1.00 . A A . 21 PRO HB2 1 1 12 3932 1 1 21 PRO HB3 H -7.749 7.862 10.736 1.00 . A A . 21 PRO HB3 1 1 12 3933 1 1 21 PRO HD2 H -4.079 8.413 9.146 1.00 . A A . 21 PRO HD2 1 1 12 3934 1 1 21 PRO HD3 H -4.245 8.290 10.886 1.00 . A A . 21 PRO HD3 1 1 12 3935 1 1 21 PRO HG2 H -6.063 9.564 9.004 1.00 . A A . 21 PRO HG2 1 1 12 3936 1 1 21 PRO HG3 H -6.168 9.541 10.754 1.00 . A A . 21 PRO HG3 1 1 12 3937 1 1 21 PRO N N -5.168 6.723 9.805 1.00 . A A . 21 PRO N 1 1 12 3938 1 1 21 PRO O O -5.969 6.634 7.135 1.00 . A A . 21 PRO O 1 1 12 3939 1 1 22 THR C C -9.303 5.511 5.863 1.00 . A A . 22 THR C 1 1 12 3940 1 1 22 THR CA C -8.003 4.894 6.382 1.00 . A A . 22 THR CA 1 1 12 3941 1 1 22 THR CB C -8.017 3.365 6.391 1.00 . A A . 22 THR CB 1 1 12 3942 1 1 22 THR CG2 C -7.794 2.768 5.000 1.00 . A A . 22 THR CG2 1 1 12 3943 1 1 22 THR H H -8.347 4.986 8.434 1.00 . A A . 22 THR H 1 1 12 3944 1 1 22 THR HA H -7.201 5.247 5.733 1.00 . A A . 22 THR HA 1 1 12 3945 1 1 22 THR HB H -8.938 2.986 6.834 1.00 . A A . 22 THR HB 1 1 12 3946 1 1 22 THR HG1 H -6.777 2.016 7.198 1.00 . A A . 22 THR HG1 1 1 12 3947 1 1 22 THR HG21 H -8.285 3.394 4.254 1.00 . A A . 22 THR HG21 1 1 12 3948 1 1 22 THR HG22 H -6.726 2.723 4.791 1.00 . A A . 22 THR HG22 1 1 12 3949 1 1 22 THR HG23 H -8.214 1.763 4.964 1.00 . A A . 22 THR HG23 1 1 12 3950 1 1 22 THR N N -7.731 5.349 7.736 1.00 . A A . 22 THR N 1 1 12 3951 1 1 22 THR O O -9.789 5.137 4.797 1.00 . A A . 22 THR O 1 1 12 3952 1 1 22 THR OG1 O -6.841 3.011 7.113 1.00 . A A . 22 THR OG1 1 1 12 3953 1 1 23 PHE C C -11.126 7.361 4.764 1.00 . A A . 23 PHE C 1 1 12 3954 1 1 23 PHE CA C -11.063 7.118 6.274 1.00 . A A . 23 PHE CA 1 1 12 3955 1 1 23 PHE CB C -11.070 8.467 6.996 1.00 . A A . 23 PHE CB 1 1 12 3956 1 1 23 PHE CD1 C -11.327 7.357 9.226 1.00 . A A . 23 PHE CD1 1 1 12 3957 1 1 23 PHE CD2 C -10.001 9.300 9.102 1.00 . A A . 23 PHE CD2 1 1 12 3958 1 1 23 PHE CE1 C -11.066 7.267 10.618 1.00 . A A . 23 PHE CE1 1 1 12 3959 1 1 23 PHE CE2 C -9.741 9.211 10.496 1.00 . A A . 23 PHE CE2 1 1 12 3960 1 1 23 PHE CG C -10.790 8.371 8.497 1.00 . A A . 23 PHE CG 1 1 12 3961 1 1 23 PHE CZ C -10.279 8.196 11.224 1.00 . A A . 23 PHE CZ 1 1 12 3962 1 1 23 PHE H H -9.426 6.744 7.507 1.00 . A A . 23 PHE H 1 1 12 3963 1 1 23 PHE HA H -11.887 6.468 6.571 1.00 . A A . 23 PHE HA 1 1 12 3964 1 1 23 PHE HB2 H -10.324 9.116 6.537 1.00 . A A . 23 PHE HB2 1 1 12 3965 1 1 23 PHE HB3 H -12.039 8.943 6.847 1.00 . A A . 23 PHE HB3 1 1 12 3966 1 1 23 PHE HD1 H -11.958 6.612 8.740 1.00 . A A . 23 PHE HD1 1 1 12 3967 1 1 23 PHE HD2 H -9.570 10.113 8.517 1.00 . A A . 23 PHE HD2 1 1 12 3968 1 1 23 PHE HE1 H -11.498 6.455 11.202 1.00 . A A . 23 PHE HE1 1 1 12 3969 1 1 23 PHE HE2 H -9.110 9.956 10.981 1.00 . A A . 23 PHE HE2 1 1 12 3970 1 1 23 PHE HZ H -10.079 8.127 12.293 1.00 . A A . 23 PHE HZ 1 1 12 3971 1 1 23 PHE N N -9.828 6.446 6.642 1.00 . A A . 23 PHE N 1 1 12 3972 1 1 23 PHE O O -12.204 7.582 4.213 1.00 . A A . 23 PHE O 1 1 13 3973 1 1 1 GLU C C -0.996 -5.502 21.139 1.00 . A A . 1 GLU C 1 1 13 3974 1 1 1 GLU CA C -0.468 -6.057 22.463 1.00 . A A . 1 GLU CA 1 1 13 3975 1 1 1 GLU CB C 0.303 -4.986 23.238 1.00 . A A . 1 GLU CB 1 1 13 3976 1 1 1 GLU CD C -1.044 -4.617 25.338 1.00 . A A . 1 GLU CD 1 1 13 3977 1 1 1 GLU CG C 0.224 -5.236 24.745 1.00 . A A . 1 GLU CG 1 1 13 3978 1 1 1 GLU HA H -1.298 -6.411 23.074 1.00 . A A . 1 GLU HA 1 1 13 3979 1 1 1 GLU HB2 H 1.345 -4.981 22.921 1.00 . A A . 1 GLU HB2 1 1 13 3980 1 1 1 GLU HB3 H -0.105 -4.001 23.008 1.00 . A A . 1 GLU HB3 1 1 13 3981 1 1 1 GLU HG2 H 0.235 -6.308 24.941 1.00 . A A . 1 GLU HG2 1 1 13 3982 1 1 1 GLU HG3 H 1.102 -4.814 25.234 1.00 . A A . 1 GLU HG3 1 1 13 3983 1 1 1 GLU N N 0.363 -7.225 22.225 1.00 . A A . 1 GLU N 1 1 13 3984 1 1 1 GLU O O -0.516 -4.478 20.655 1.00 . A A . 1 GLU O 1 1 13 3985 1 1 1 GLU OE1 O -2.056 -4.586 24.606 1.00 . A A . 1 GLU OE1 1 1 13 3986 1 1 1 GLU OE2 O -0.972 -4.190 26.511 1.00 . A A . 1 GLU OE2 1 1 13 3987 1 1 2 ASN C C -4.026 -6.281 19.279 1.00 . A A . 2 ASN C 1 1 13 3988 1 1 2 ASN CA C -2.576 -5.793 19.331 1.00 . A A . 2 ASN CA 1 1 13 3989 1 1 2 ASN CB C -1.830 -6.401 18.143 1.00 . A A . 2 ASN CB 1 1 13 3990 1 1 2 ASN CG C -0.319 -6.209 18.287 1.00 . A A . 2 ASN CG 1 1 13 3991 1 1 2 ASN H H -2.361 -7.035 20.990 1.00 . A A . 2 ASN H 1 1 13 3992 1 1 2 ASN HA H -2.502 -4.706 19.319 1.00 . A A . 2 ASN HA 1 1 13 3993 1 1 2 ASN HB2 H -2.059 -7.463 18.069 1.00 . A A . 2 ASN HB2 1 1 13 3994 1 1 2 ASN HB3 H -2.172 -5.936 17.218 1.00 . A A . 2 ASN HB3 1 1 13 3995 1 1 2 ASN HD21 H -0.174 -8.147 18.851 1.00 . A A . 2 ASN HD21 1 1 13 3996 1 1 2 ASN HD22 H 1.322 -7.275 18.803 1.00 . A A . 2 ASN HD22 1 1 13 3997 1 1 2 ASN N N -1.977 -6.203 20.590 1.00 . A A . 2 ASN N 1 1 13 3998 1 1 2 ASN ND2 N 0.330 -7.300 18.679 1.00 . A A . 2 ASN ND2 1 1 13 3999 1 1 2 ASN O O -4.426 -7.134 20.070 1.00 . A A . 2 ASN O 1 1 13 4000 1 1 2 ASN OD1 O 0.222 -5.139 18.058 1.00 . A A . 2 ASN OD1 1 1 13 4001 1 1 3 PHE C C -6.357 -6.981 16.947 1.00 . A A . 3 PHE C 1 1 13 4002 1 1 3 PHE CA C -6.168 -6.086 18.174 1.00 . A A . 3 PHE CA 1 1 13 4003 1 1 3 PHE CB C -6.950 -4.788 17.969 1.00 . A A . 3 PHE CB 1 1 13 4004 1 1 3 PHE CD1 C -6.775 -3.312 19.984 1.00 . A A . 3 PHE CD1 1 1 13 4005 1 1 3 PHE CD2 C -8.761 -4.543 19.680 1.00 . A A . 3 PHE CD2 1 1 13 4006 1 1 3 PHE CE1 C -7.302 -2.759 21.181 1.00 . A A . 3 PHE CE1 1 1 13 4007 1 1 3 PHE CE2 C -9.287 -3.989 20.878 1.00 . A A . 3 PHE CE2 1 1 13 4008 1 1 3 PHE CG C -7.517 -4.192 19.259 1.00 . A A . 3 PHE CG 1 1 13 4009 1 1 3 PHE CZ C -8.546 -3.109 21.604 1.00 . A A . 3 PHE CZ 1 1 13 4010 1 1 3 PHE H H -4.438 -5.027 17.700 1.00 . A A . 3 PHE H 1 1 13 4011 1 1 3 PHE HA H -6.468 -6.631 19.069 1.00 . A A . 3 PHE HA 1 1 13 4012 1 1 3 PHE HB2 H -6.298 -4.053 17.496 1.00 . A A . 3 PHE HB2 1 1 13 4013 1 1 3 PHE HB3 H -7.771 -4.976 17.276 1.00 . A A . 3 PHE HB3 1 1 13 4014 1 1 3 PHE HD1 H -5.778 -3.031 19.646 1.00 . A A . 3 PHE HD1 1 1 13 4015 1 1 3 PHE HD2 H -9.355 -5.247 19.099 1.00 . A A . 3 PHE HD2 1 1 13 4016 1 1 3 PHE HE1 H -6.708 -2.054 21.763 1.00 . A A . 3 PHE HE1 1 1 13 4017 1 1 3 PHE HE2 H -10.285 -4.270 21.216 1.00 . A A . 3 PHE HE2 1 1 13 4018 1 1 3 PHE HZ H -8.949 -2.685 22.522 1.00 . A A . 3 PHE HZ 1 1 13 4019 1 1 3 PHE N N -4.771 -5.719 18.339 1.00 . A A . 3 PHE N 1 1 13 4020 1 1 3 PHE O O -6.602 -8.180 17.081 1.00 . A A . 3 PHE O 1 1 13 4021 1 1 4 ASN C C -5.014 -7.311 13.900 1.00 . A A . 4 ASN C 1 1 13 4022 1 1 4 ASN CA C -6.391 -7.091 14.531 1.00 . A A . 4 ASN CA 1 1 13 4023 1 1 4 ASN CB C -7.246 -6.302 13.538 1.00 . A A . 4 ASN CB 1 1 13 4024 1 1 4 ASN CG C -6.834 -4.830 13.508 1.00 . A A . 4 ASN CG 1 1 13 4025 1 1 4 ASN H H -6.037 -5.391 15.681 1.00 . A A . 4 ASN H 1 1 13 4026 1 1 4 ASN HA H -6.880 -8.028 14.803 1.00 . A A . 4 ASN HA 1 1 13 4027 1 1 4 ASN HB2 H -7.144 -6.734 12.542 1.00 . A A . 4 ASN HB2 1 1 13 4028 1 1 4 ASN HB3 H -8.298 -6.384 13.814 1.00 . A A . 4 ASN HB3 1 1 13 4029 1 1 4 ASN HD21 H -5.134 -5.375 12.554 1.00 . A A . 4 ASN HD21 1 1 13 4030 1 1 4 ASN HD22 H -5.302 -3.677 12.855 1.00 . A A . 4 ASN HD22 1 1 13 4031 1 1 4 ASN N N -6.236 -6.365 15.781 1.00 . A A . 4 ASN N 1 1 13 4032 1 1 4 ASN ND2 N -5.659 -4.609 12.924 1.00 . A A . 4 ASN ND2 1 1 13 4033 1 1 4 ASN O O -4.852 -7.158 12.690 1.00 . A A . 4 ASN O 1 1 13 4034 1 1 4 ASN OD1 O -7.535 -3.952 13.984 1.00 . A A . 4 ASN OD1 1 1 13 4035 1 1 5 GLY C C -1.758 -6.801 14.761 1.00 . A A . 5 GLY C 1 1 13 4036 1 1 5 GLY CA C -2.703 -7.908 14.288 1.00 . A A . 5 GLY CA 1 1 13 4037 1 1 5 GLY H H -4.202 -7.788 15.730 1.00 . A A . 5 GLY H 1 1 13 4038 1 1 5 GLY HA2 H -2.356 -8.872 14.659 1.00 . A A . 5 GLY HA2 1 1 13 4039 1 1 5 GLY HA3 H -2.689 -7.963 13.198 1.00 . A A . 5 GLY HA3 1 1 13 4040 1 1 5 GLY N N -4.061 -7.666 14.748 1.00 . A A . 5 GLY N 1 1 13 4041 1 1 5 GLY O O -0.596 -7.063 15.067 1.00 . A A . 5 GLY O 1 1 13 4042 1 1 6 GLY C C -2.398 -3.208 15.407 1.00 . A A . 6 GLY C 1 1 13 4043 1 1 6 GLY CA C -1.512 -4.444 15.236 1.00 . A A . 6 GLY CA 1 1 13 4044 1 1 6 GLY H H -3.238 -5.387 14.555 1.00 . A A . 6 GLY H 1 1 13 4045 1 1 6 GLY HA2 H -1.015 -4.671 16.180 1.00 . A A . 6 GLY HA2 1 1 13 4046 1 1 6 GLY HA3 H -0.729 -4.237 14.506 1.00 . A A . 6 GLY HA3 1 1 13 4047 1 1 6 GLY N N -2.292 -5.590 14.806 1.00 . A A . 6 GLY N 1 1 13 4048 1 1 6 GLY O O -2.663 -2.779 16.528 1.00 . A A . 6 GLY O 1 1 13 4049 1 1 7 CYS C C -4.895 -1.784 15.176 1.00 . A A . 7 CYS C 1 1 13 4050 1 1 7 CYS CA C -3.685 -1.495 14.285 1.00 . A A . 7 CYS CA 1 1 13 4051 1 1 7 CYS CB C -4.103 -1.088 12.870 1.00 . A A . 7 CYS CB 1 1 13 4052 1 1 7 CYS H H -2.614 -3.028 13.368 1.00 . A A . 7 CYS H 1 1 13 4053 1 1 7 CYS HA H -3.089 -0.681 14.694 1.00 . A A . 7 CYS HA 1 1 13 4054 1 1 7 CYS HB2 H -4.382 -1.985 12.316 1.00 . A A . 7 CYS HB2 1 1 13 4055 1 1 7 CYS HB3 H -4.994 -0.464 12.934 1.00 . A A . 7 CYS HB3 1 1 13 4056 1 1 7 CYS N N -2.834 -2.672 14.275 1.00 . A A . 7 CYS N 1 1 13 4057 1 1 7 CYS O O -5.017 -2.876 15.726 1.00 . A A . 7 CYS O 1 1 13 4058 1 1 7 CYS SG S -2.823 -0.187 11.921 1.00 . A A . 7 CYS SG 1 1 13 4059 1 1 8 LEU C C -8.046 -1.613 15.289 1.00 . A A . 8 LEU C 1 1 13 4060 1 1 8 LEU CA C -6.954 -0.919 16.104 1.00 . A A . 8 LEU CA 1 1 13 4061 1 1 8 LEU CB C -7.375 0.442 16.664 1.00 . A A . 8 LEU CB 1 1 13 4062 1 1 8 LEU CD1 C -8.741 -0.583 18.519 1.00 . A A . 8 LEU CD1 1 1 13 4063 1 1 8 LEU CD2 C -8.999 1.877 17.953 1.00 . A A . 8 LEU CD2 1 1 13 4064 1 1 8 LEU CG C -8.708 0.475 17.414 1.00 . A A . 8 LEU CG 1 1 13 4065 1 1 8 LEU H H -5.650 0.100 14.837 1.00 . A A . 8 LEU H 1 1 13 4066 1 1 8 LEU HA H -6.700 -1.552 16.954 1.00 . A A . 8 LEU HA 1 1 13 4067 1 1 8 LEU HB2 H -6.593 0.794 17.337 1.00 . A A . 8 LEU HB2 1 1 13 4068 1 1 8 LEU HB3 H -7.428 1.151 15.838 1.00 . A A . 8 LEU HB3 1 1 13 4069 1 1 8 LEU HD11 H -7.744 -0.692 18.947 1.00 . A A . 8 LEU HD11 1 1 13 4070 1 1 8 LEU HD12 H -9.437 -0.272 19.299 1.00 . A A . 8 LEU HD12 1 1 13 4071 1 1 8 LEU HD13 H -9.064 -1.536 18.102 1.00 . A A . 8 LEU HD13 1 1 13 4072 1 1 8 LEU HD21 H -9.010 2.588 17.127 1.00 . A A . 8 LEU HD21 1 1 13 4073 1 1 8 LEU HD22 H -9.970 1.881 18.448 1.00 . A A . 8 LEU HD22 1 1 13 4074 1 1 8 LEU HD23 H -8.226 2.161 18.666 1.00 . A A . 8 LEU HD23 1 1 13 4075 1 1 8 LEU HG H -9.503 0.228 16.710 1.00 . A A . 8 LEU HG 1 1 13 4076 1 1 8 LEU N N -5.758 -0.785 15.289 1.00 . A A . 8 LEU N 1 1 13 4077 1 1 8 LEU O O -8.577 -2.642 15.706 1.00 . A A . 8 LEU O 1 1 13 4078 1 1 9 ALA C C -9.829 -0.492 12.285 1.00 . A A . 9 ALA C 1 1 13 4079 1 1 9 ALA CA C -9.370 -1.573 13.265 1.00 . A A . 9 ALA CA 1 1 13 4080 1 1 9 ALA CB C -10.523 -2.124 14.106 1.00 . A A . 9 ALA CB 1 1 13 4081 1 1 9 ALA H H -7.913 -0.187 13.811 1.00 . A A . 9 ALA H 1 1 13 4082 1 1 9 ALA HA H -8.919 -2.392 12.705 1.00 . A A . 9 ALA HA 1 1 13 4083 1 1 9 ALA HB1 H -10.662 -1.499 14.986 1.00 . A A . 9 ALA HB1 1 1 13 4084 1 1 9 ALA HB2 H -11.437 -2.126 13.512 1.00 . A A . 9 ALA HB2 1 1 13 4085 1 1 9 ALA HB3 H -10.290 -3.143 14.417 1.00 . A A . 9 ALA HB3 1 1 13 4086 1 1 9 ALA N N -8.350 -1.024 14.142 1.00 . A A . 9 ALA N 1 1 13 4087 1 1 9 ALA O O -10.673 0.338 12.619 1.00 . A A . 9 ALA O 1 1 13 4088 1 1 10 GLY C C -8.354 1.206 9.608 1.00 . A A . 10 GLY C 1 1 13 4089 1 1 10 GLY CA C -9.592 0.429 10.060 1.00 . A A . 10 GLY CA 1 1 13 4090 1 1 10 GLY H H -8.566 -1.215 10.827 1.00 . A A . 10 GLY H 1 1 13 4091 1 1 10 GLY HA2 H -10.034 -0.086 9.207 1.00 . A A . 10 GLY HA2 1 1 13 4092 1 1 10 GLY HA3 H -10.343 1.121 10.438 1.00 . A A . 10 GLY HA3 1 1 13 4093 1 1 10 GLY N N -9.253 -0.537 11.091 1.00 . A A . 10 GLY N 1 1 13 4094 1 1 10 GLY O O -8.204 1.506 8.425 1.00 . A A . 10 GLY O 1 1 13 4095 1 1 11 TYR C C -5.411 1.499 9.277 1.00 . A A . 11 TYR C 1 1 13 4096 1 1 11 TYR CA C -6.280 2.246 10.290 1.00 . A A . 11 TYR CA 1 1 13 4097 1 1 11 TYR CB C -5.526 2.341 11.619 1.00 . A A . 11 TYR CB 1 1 13 4098 1 1 11 TYR CD1 C -6.361 4.587 12.404 1.00 . A A . 11 TYR CD1 1 1 13 4099 1 1 11 TYR CD2 C -6.657 2.701 13.843 1.00 . A A . 11 TYR CD2 1 1 13 4100 1 1 11 TYR CE1 C -6.999 5.432 13.381 1.00 . A A . 11 TYR CE1 1 1 13 4101 1 1 11 TYR CE2 C -7.295 3.546 14.819 1.00 . A A . 11 TYR CE2 1 1 13 4102 1 1 11 TYR CG C -6.204 3.240 12.656 1.00 . A A . 11 TYR CG 1 1 13 4103 1 1 11 TYR CZ C -7.435 4.870 14.540 1.00 . A A . 11 TYR CZ 1 1 13 4104 1 1 11 TYR H H -7.630 1.261 11.534 1.00 . A A . 11 TYR H 1 1 13 4105 1 1 11 TYR HA H -6.561 3.214 9.873 1.00 . A A . 11 TYR HA 1 1 13 4106 1 1 11 TYR HB2 H -5.418 1.340 12.035 1.00 . A A . 11 TYR HB2 1 1 13 4107 1 1 11 TYR HB3 H -4.522 2.718 11.428 1.00 . A A . 11 TYR HB3 1 1 13 4108 1 1 11 TYR HD1 H -6.002 5.012 11.467 1.00 . A A . 11 TYR HD1 1 1 13 4109 1 1 11 TYR HD2 H -6.533 1.637 14.041 1.00 . A A . 11 TYR HD2 1 1 13 4110 1 1 11 TYR HE1 H -7.129 6.498 13.195 1.00 . A A . 11 TYR HE1 1 1 13 4111 1 1 11 TYR HE2 H -7.658 3.135 15.761 1.00 . A A . 11 TYR HE2 1 1 13 4112 1 1 11 TYR HH H -8.597 6.357 15.003 1.00 . A A . 11 TYR HH 1 1 13 4113 1 1 11 TYR N N -7.500 1.509 10.574 1.00 . A A . 11 TYR N 1 1 13 4114 1 1 11 TYR O O -5.509 0.280 9.150 1.00 . A A . 11 TYR O 1 1 13 4115 1 1 11 TYR OH O -8.035 5.668 15.462 1.00 . A A . 11 TYR OH 1 1 13 4116 1 1 12 MET C C -2.236 1.762 8.035 1.00 . A A . 12 MET C 1 1 13 4117 1 1 12 MET CA C -3.696 1.687 7.582 1.00 . A A . 12 MET CA 1 1 13 4118 1 1 12 MET CB C -3.860 2.440 6.260 1.00 . A A . 12 MET CB 1 1 13 4119 1 1 12 MET CE C -3.512 6.411 5.322 1.00 . A A . 12 MET CE 1 1 13 4120 1 1 12 MET CG C -3.816 3.953 6.482 1.00 . A A . 12 MET CG 1 1 13 4121 1 1 12 MET H H -4.509 3.253 8.689 1.00 . A A . 12 MET H 1 1 13 4122 1 1 12 MET HA H -4.000 0.645 7.486 1.00 . A A . 12 MET HA 1 1 13 4123 1 1 12 MET HB2 H -3.069 2.146 5.570 1.00 . A A . 12 MET HB2 1 1 13 4124 1 1 12 MET HB3 H -4.807 2.164 5.796 1.00 . A A . 12 MET HB3 1 1 13 4125 1 1 12 MET HE1 H -3.552 6.681 6.377 1.00 . A A . 12 MET HE1 1 1 13 4126 1 1 12 MET HE2 H -2.841 7.092 4.798 1.00 . A A . 12 MET HE2 1 1 13 4127 1 1 12 MET HE3 H -4.511 6.482 4.891 1.00 . A A . 12 MET HE3 1 1 13 4128 1 1 12 MET HG2 H -4.829 4.352 6.528 1.00 . A A . 12 MET HG2 1 1 13 4129 1 1 12 MET HG3 H -3.343 4.175 7.438 1.00 . A A . 12 MET HG3 1 1 13 4130 1 1 12 MET N N -4.582 2.262 8.581 1.00 . A A . 12 MET N 1 1 13 4131 1 1 12 MET O O -1.903 2.524 8.941 1.00 . A A . 12 MET O 1 1 13 4132 1 1 12 MET SD S -2.912 4.738 5.158 1.00 . A A . 12 MET SD 1 1 13 4133 1 1 13 ARG C C 0.800 1.803 6.732 1.00 . A A . 13 ARG C 1 1 13 4134 1 1 13 ARG CA C 0.011 0.929 7.709 1.00 . A A . 13 ARG CA 1 1 13 4135 1 1 13 ARG CB C 0.555 -0.500 7.658 1.00 . A A . 13 ARG CB 1 1 13 4136 1 1 13 ARG CD C 0.865 -2.002 9.661 1.00 . A A . 13 ARG CD 1 1 13 4137 1 1 13 ARG CG C -0.145 -1.390 8.688 1.00 . A A . 13 ARG CG 1 1 13 4138 1 1 13 ARG CZ C 0.851 -4.418 9.054 1.00 . A A . 13 ARG CZ 1 1 13 4139 1 1 13 ARG H H -1.684 0.345 6.648 1.00 . A A . 13 ARG H 1 1 13 4140 1 1 13 ARG HA H 0.073 1.321 8.724 1.00 . A A . 13 ARG HA 1 1 13 4141 1 1 13 ARG HB2 H 0.412 -0.912 6.659 1.00 . A A . 13 ARG HB2 1 1 13 4142 1 1 13 ARG HB3 H 1.628 -0.492 7.849 1.00 . A A . 13 ARG HB3 1 1 13 4143 1 1 13 ARG HD2 H 1.873 -1.913 9.255 1.00 . A A . 13 ARG HD2 1 1 13 4144 1 1 13 ARG HD3 H 0.851 -1.455 10.603 1.00 . A A . 13 ARG HD3 1 1 13 4145 1 1 13 ARG HE H 0.059 -3.662 10.743 1.00 . A A . 13 ARG HE 1 1 13 4146 1 1 13 ARG HG2 H -0.879 -0.804 9.241 1.00 . A A . 13 ARG HG2 1 1 13 4147 1 1 13 ARG HG3 H -0.690 -2.184 8.177 1.00 . A A . 13 ARG HG3 1 1 13 4148 1 1 13 ARG HH11 H 1.745 -3.206 7.688 1.00 . A A . 13 ARG HH11 1 1 13 4149 1 1 13 ARG HH12 H 1.727 -4.889 7.280 1.00 . A A . 13 ARG HH12 1 1 13 4150 1 1 13 ARG HH21 H 0.035 -5.883 10.205 1.00 . A A . 13 ARG HH21 1 1 13 4151 1 1 13 ARG HH22 H 0.748 -6.422 8.721 1.00 . A A . 13 ARG HH22 1 1 13 4152 1 1 13 ARG N N -1.405 0.962 7.384 1.00 . A A . 13 ARG N 1 1 13 4153 1 1 13 ARG NE N 0.540 -3.426 9.899 1.00 . A A . 13 ARG NE 1 1 13 4154 1 1 13 ARG NH1 N 1.495 -4.148 7.911 1.00 . A A . 13 ARG NH1 1 1 13 4155 1 1 13 ARG NH2 N 0.516 -5.681 9.352 1.00 . A A . 13 ARG NH2 1 1 13 4156 1 1 13 ARG O O 1.027 1.411 5.588 1.00 . A A . 13 ARG O 1 1 13 4157 1 1 14 THR C C 3.322 3.314 6.051 1.00 . A A . 14 THR C 1 1 13 4158 1 1 14 THR CA C 1.954 3.902 6.402 1.00 . A A . 14 THR CA 1 1 13 4159 1 1 14 THR CB C 2.039 5.230 7.157 1.00 . A A . 14 THR CB 1 1 13 4160 1 1 14 THR CG2 C 0.661 5.783 7.527 1.00 . A A . 14 THR CG2 1 1 13 4161 1 1 14 THR H H 1.008 3.280 8.150 1.00 . A A . 14 THR H 1 1 13 4162 1 1 14 THR HA H 1.419 4.051 5.464 1.00 . A A . 14 THR HA 1 1 13 4163 1 1 14 THR HB H 2.614 5.964 6.591 1.00 . A A . 14 THR HB 1 1 13 4164 1 1 14 THR HG1 H 3.546 5.251 8.473 1.00 . A A . 14 THR HG1 1 1 13 4165 1 1 14 THR HG21 H -0.111 5.205 7.019 1.00 . A A . 14 THR HG21 1 1 13 4166 1 1 14 THR HG22 H 0.518 5.712 8.604 1.00 . A A . 14 THR HG22 1 1 13 4167 1 1 14 THR HG23 H 0.594 6.827 7.218 1.00 . A A . 14 THR HG23 1 1 13 4168 1 1 14 THR N N 1.196 2.969 7.219 1.00 . A A . 14 THR N 1 1 13 4169 1 1 14 THR O O 3.530 2.107 6.161 1.00 . A A . 14 THR O 1 1 13 4170 1 1 14 THR OG1 O 2.620 4.880 8.410 1.00 . A A . 14 THR OG1 1 1 13 4171 1 1 15 ALA C C 6.475 3.874 6.489 1.00 . A A . 15 ALA C 1 1 13 4172 1 1 15 ALA CA C 5.562 3.778 5.265 1.00 . A A . 15 ALA CA 1 1 13 4173 1 1 15 ALA CB C 6.060 4.633 4.098 1.00 . A A . 15 ALA CB 1 1 13 4174 1 1 15 ALA H H 4.043 5.176 5.546 1.00 . A A . 15 ALA H 1 1 13 4175 1 1 15 ALA HA H 5.510 2.739 4.941 1.00 . A A . 15 ALA HA 1 1 13 4176 1 1 15 ALA HB1 H 5.289 4.682 3.329 1.00 . A A . 15 ALA HB1 1 1 13 4177 1 1 15 ALA HB2 H 6.282 5.640 4.454 1.00 . A A . 15 ALA HB2 1 1 13 4178 1 1 15 ALA HB3 H 6.963 4.189 3.681 1.00 . A A . 15 ALA HB3 1 1 13 4179 1 1 15 ALA N N 4.219 4.196 5.633 1.00 . A A . 15 ALA N 1 1 13 4180 1 1 15 ALA O O 7.694 3.966 6.353 1.00 . A A . 15 ALA O 1 1 13 4181 1 1 16 ASP C C 6.129 2.813 9.841 1.00 . A A . 16 ASP C 1 1 13 4182 1 1 16 ASP CA C 6.591 3.930 8.904 1.00 . A A . 16 ASP CA 1 1 13 4183 1 1 16 ASP CB C 6.343 5.267 9.605 1.00 . A A . 16 ASP CB 1 1 13 4184 1 1 16 ASP CG C 7.598 6.102 9.867 1.00 . A A . 16 ASP CG 1 1 13 4185 1 1 16 ASP H H 4.858 3.773 7.758 1.00 . A A . 16 ASP H 1 1 13 4186 1 1 16 ASP HA H 7.639 3.831 8.621 1.00 . A A . 16 ASP HA 1 1 13 4187 1 1 16 ASP HB2 H 5.654 5.856 8.999 1.00 . A A . 16 ASP HB2 1 1 13 4188 1 1 16 ASP HB3 H 5.847 5.076 10.556 1.00 . A A . 16 ASP HB3 1 1 13 4189 1 1 16 ASP N N 5.850 3.848 7.656 1.00 . A A . 16 ASP N 1 1 13 4190 1 1 16 ASP O O 6.528 2.767 11.003 1.00 . A A . 16 ASP O 1 1 13 4191 1 1 16 ASP OD1 O 8.611 5.492 10.273 1.00 . A A . 16 ASP OD1 1 1 13 4192 1 1 16 ASP OD2 O 7.517 7.331 9.656 1.00 . A A . 16 ASP OD2 1 1 13 4193 1 1 17 GLY C C 3.763 1.305 11.117 1.00 . A A . 17 GLY C 1 1 13 4194 1 1 17 GLY CA C 4.773 0.823 10.075 1.00 . A A . 17 GLY CA 1 1 13 4195 1 1 17 GLY H H 4.974 1.981 8.354 1.00 . A A . 17 GLY H 1 1 13 4196 1 1 17 GLY HA2 H 4.297 0.104 9.408 1.00 . A A . 17 GLY HA2 1 1 13 4197 1 1 17 GLY HA3 H 5.594 0.304 10.570 1.00 . A A . 17 GLY HA3 1 1 13 4198 1 1 17 GLY N N 5.293 1.938 9.300 1.00 . A A . 17 GLY N 1 1 13 4199 1 1 17 GLY O O 3.361 0.543 11.996 1.00 . A A . 17 GLY O 1 1 13 4200 1 1 18 ARG C C 1.004 2.723 11.548 1.00 . A A . 18 ARG C 1 1 13 4201 1 1 18 ARG CA C 2.426 3.159 11.907 1.00 . A A . 18 ARG CA 1 1 13 4202 1 1 18 ARG CB C 2.506 4.687 11.877 1.00 . A A . 18 ARG CB 1 1 13 4203 1 1 18 ARG CD C 2.561 6.472 13.657 1.00 . A A . 18 ARG CD 1 1 13 4204 1 1 18 ARG CG C 3.246 5.221 13.105 1.00 . A A . 18 ARG CG 1 1 13 4205 1 1 18 ARG CZ C 2.111 7.438 15.909 1.00 . A A . 18 ARG CZ 1 1 13 4206 1 1 18 ARG H H 3.714 3.180 10.270 1.00 . A A . 18 ARG H 1 1 13 4207 1 1 18 ARG HA H 2.715 2.784 12.888 1.00 . A A . 18 ARG HA 1 1 13 4208 1 1 18 ARG HB2 H 3.018 5.010 10.970 1.00 . A A . 18 ARG HB2 1 1 13 4209 1 1 18 ARG HB3 H 1.501 5.107 11.843 1.00 . A A . 18 ARG HB3 1 1 13 4210 1 1 18 ARG HD2 H 3.072 7.365 13.296 1.00 . A A . 18 ARG HD2 1 1 13 4211 1 1 18 ARG HD3 H 1.534 6.524 13.295 1.00 . A A . 18 ARG HD3 1 1 13 4212 1 1 18 ARG HE H 2.955 5.639 15.587 1.00 . A A . 18 ARG HE 1 1 13 4213 1 1 18 ARG HG2 H 3.281 4.451 13.876 1.00 . A A . 18 ARG HG2 1 1 13 4214 1 1 18 ARG HG3 H 4.278 5.453 12.840 1.00 . A A . 18 ARG HG3 1 1 13 4215 1 1 18 ARG HH11 H 1.554 8.621 14.352 1.00 . A A . 18 ARG HH11 1 1 13 4216 1 1 18 ARG HH12 H 1.247 9.279 15.925 1.00 . A A . 18 ARG HH12 1 1 13 4217 1 1 18 ARG HH21 H 2.550 6.506 17.663 1.00 . A A . 18 ARG HH21 1 1 13 4218 1 1 18 ARG HH22 H 1.818 8.067 17.821 1.00 . A A . 18 ARG HH22 1 1 13 4219 1 1 18 ARG N N 3.382 2.567 10.987 1.00 . A A . 18 ARG N 1 1 13 4220 1 1 18 ARG NE N 2.575 6.446 15.136 1.00 . A A . 18 ARG NE 1 1 13 4221 1 1 18 ARG NH1 N 1.594 8.539 15.348 1.00 . A A . 18 ARG NH1 1 1 13 4222 1 1 18 ARG NH2 N 2.164 7.327 17.244 1.00 . A A . 18 ARG NH2 1 1 13 4223 1 1 18 ARG O O 0.813 1.840 10.713 1.00 . A A . 18 ARG O 1 1 13 4224 1 1 19 CYS C C -2.114 4.367 11.751 1.00 . A A . 19 CYS C 1 1 13 4225 1 1 19 CYS CA C -1.358 3.052 11.955 1.00 . A A . 19 CYS CA 1 1 13 4226 1 1 19 CYS CB C -1.956 2.220 13.091 1.00 . A A . 19 CYS CB 1 1 13 4227 1 1 19 CYS H H 0.204 4.080 12.873 1.00 . A A . 19 CYS H 1 1 13 4228 1 1 19 CYS HA H -1.393 2.442 11.053 1.00 . A A . 19 CYS HA 1 1 13 4229 1 1 19 CYS HB2 H -1.766 2.730 14.035 1.00 . A A . 19 CYS HB2 1 1 13 4230 1 1 19 CYS HB3 H -3.038 2.180 12.963 1.00 . A A . 19 CYS HB3 1 1 13 4231 1 1 19 CYS N N 0.041 3.363 12.196 1.00 . A A . 19 CYS N 1 1 13 4232 1 1 19 CYS O O -2.548 4.993 12.717 1.00 . A A . 19 CYS O 1 1 13 4233 1 1 19 CYS SG S -1.317 0.510 13.209 1.00 . A A . 19 CYS SG 1 1 13 4234 1 1 20 LYS C C -4.402 5.652 9.803 1.00 . A A . 20 LYS C 1 1 13 4235 1 1 20 LYS CA C -2.946 5.974 10.147 1.00 . A A . 20 LYS CA 1 1 13 4236 1 1 20 LYS CB C -2.203 6.720 9.036 1.00 . A A . 20 LYS CB 1 1 13 4237 1 1 20 LYS CD C -1.259 8.985 8.452 1.00 . A A . 20 LYS CD 1 1 13 4238 1 1 20 LYS CE C -0.739 10.310 9.011 1.00 . A A . 20 LYS CE 1 1 13 4239 1 1 20 LYS CG C -1.535 7.986 9.578 1.00 . A A . 20 LYS CG 1 1 13 4240 1 1 20 LYS H H -1.894 4.230 9.709 1.00 . A A . 20 LYS H 1 1 13 4241 1 1 20 LYS HA H -2.933 6.614 11.029 1.00 . A A . 20 LYS HA 1 1 13 4242 1 1 20 LYS HB2 H -1.450 6.068 8.595 1.00 . A A . 20 LYS HB2 1 1 13 4243 1 1 20 LYS HB3 H -2.900 6.984 8.241 1.00 . A A . 20 LYS HB3 1 1 13 4244 1 1 20 LYS HD2 H -0.528 8.565 7.760 1.00 . A A . 20 LYS HD2 1 1 13 4245 1 1 20 LYS HD3 H -2.173 9.159 7.884 1.00 . A A . 20 LYS HD3 1 1 13 4246 1 1 20 LYS HE2 H -0.860 11.098 8.267 1.00 . A A . 20 LYS HE2 1 1 13 4247 1 1 20 LYS HE3 H -1.327 10.601 9.881 1.00 . A A . 20 LYS HE3 1 1 13 4248 1 1 20 LYS HG2 H -2.177 8.447 10.329 1.00 . A A . 20 LYS HG2 1 1 13 4249 1 1 20 LYS HG3 H -0.601 7.725 10.074 1.00 . A A . 20 LYS HG3 1 1 13 4250 1 1 20 LYS HZ1 H 1.163 9.622 8.714 1.00 . A A . 20 LYS HZ1 1 1 13 4251 1 1 20 LYS HZ2 H 1.105 11.099 9.409 1.00 . A A . 20 LYS HZ2 1 1 13 4252 1 1 20 LYS HZ3 H 0.760 9.768 10.290 1.00 . A A . 20 LYS HZ3 1 1 13 4253 1 1 20 LYS N N -2.250 4.746 10.489 1.00 . A A . 20 LYS N 1 1 13 4254 1 1 20 LYS NZ N 0.688 10.190 9.386 1.00 . A A . 20 LYS NZ 1 1 13 4255 1 1 20 LYS O O -4.777 4.484 9.708 1.00 . A A . 20 LYS O 1 1 13 4256 1 1 21 PRO C C -6.786 6.162 7.830 1.00 . A A . 21 PRO C 1 1 13 4257 1 1 21 PRO CA C -6.609 6.580 9.291 1.00 . A A . 21 PRO CA 1 1 13 4258 1 1 21 PRO CB C -7.238 7.928 9.603 1.00 . A A . 21 PRO CB 1 1 13 4259 1 1 21 PRO CD C -4.793 8.133 9.725 1.00 . A A . 21 PRO CD 1 1 13 4260 1 1 21 PRO CG C -6.090 8.922 9.653 1.00 . A A . 21 PRO CG 1 1 13 4261 1 1 21 PRO HA H -7.014 5.846 9.837 1.00 . A A . 21 PRO HA 1 1 13 4262 1 1 21 PRO HB2 H -7.963 8.206 8.838 1.00 . A A . 21 PRO HB2 1 1 13 4263 1 1 21 PRO HB3 H -7.772 7.900 10.552 1.00 . A A . 21 PRO HB3 1 1 13 4264 1 1 21 PRO HD2 H -4.116 8.409 8.917 1.00 . A A . 21 PRO HD2 1 1 13 4265 1 1 21 PRO HD3 H -4.266 8.323 10.660 1.00 . A A . 21 PRO HD3 1 1 13 4266 1 1 21 PRO HG2 H -6.099 9.561 8.770 1.00 . A A . 21 PRO HG2 1 1 13 4267 1 1 21 PRO HG3 H -6.189 9.576 10.520 1.00 . A A . 21 PRO HG3 1 1 13 4268 1 1 21 PRO N N -5.203 6.736 9.622 1.00 . A A . 21 PRO N 1 1 13 4269 1 1 21 PRO O O -6.046 6.613 6.957 1.00 . A A . 21 PRO O 1 1 13 4270 1 1 22 THR C C -9.357 5.425 5.746 1.00 . A A . 22 THR C 1 1 13 4271 1 1 22 THR CA C -8.053 4.817 6.269 1.00 . A A . 22 THR CA 1 1 13 4272 1 1 22 THR CB C -8.071 3.289 6.313 1.00 . A A . 22 THR CB 1 1 13 4273 1 1 22 THR CG2 C -7.891 2.660 4.929 1.00 . A A . 22 THR CG2 1 1 13 4274 1 1 22 THR H H -8.367 4.940 8.324 1.00 . A A . 22 THR H 1 1 13 4275 1 1 22 THR HA H -7.256 5.153 5.606 1.00 . A A . 22 THR HA 1 1 13 4276 1 1 22 THR HB H -8.979 2.923 6.792 1.00 . A A . 22 THR HB 1 1 13 4277 1 1 22 THR HG1 H -6.865 3.381 7.908 1.00 . A A . 22 THR HG1 1 1 13 4278 1 1 22 THR HG21 H -8.233 3.359 4.166 1.00 . A A . 22 THR HG21 1 1 13 4279 1 1 22 THR HG22 H -6.837 2.433 4.768 1.00 . A A . 22 THR HG22 1 1 13 4280 1 1 22 THR HG23 H -8.474 1.741 4.869 1.00 . A A . 22 THR HG23 1 1 13 4281 1 1 22 THR N N -7.770 5.303 7.609 1.00 . A A . 22 THR N 1 1 13 4282 1 1 22 THR O O -9.852 5.027 4.693 1.00 . A A . 22 THR O 1 1 13 4283 1 1 22 THR OG1 O -6.873 2.947 7.007 1.00 . A A . 22 THR OG1 1 1 13 4284 1 1 23 PHE C C -11.186 7.253 4.619 1.00 . A A . 23 PHE C 1 1 13 4285 1 1 23 PHE CA C -11.111 7.045 6.133 1.00 . A A . 23 PHE CA 1 1 13 4286 1 1 23 PHE CB C -11.109 8.410 6.824 1.00 . A A . 23 PHE CB 1 1 13 4287 1 1 23 PHE CD1 C -11.339 7.340 9.076 1.00 . A A . 23 PHE CD1 1 1 13 4288 1 1 23 PHE CD2 C -10.042 9.299 8.908 1.00 . A A . 23 PHE CD2 1 1 13 4289 1 1 23 PHE CE1 C -11.071 7.281 10.470 1.00 . A A . 23 PHE CE1 1 1 13 4290 1 1 23 PHE CE2 C -9.772 9.241 10.301 1.00 . A A . 23 PHE CE2 1 1 13 4291 1 1 23 PHE CG C -10.819 8.347 8.325 1.00 . A A . 23 PHE CG 1 1 13 4292 1 1 23 PHE CZ C -10.293 8.234 11.053 1.00 . A A . 23 PHE CZ 1 1 13 4293 1 1 23 PHE H H -9.465 6.696 7.361 1.00 . A A . 23 PHE H 1 1 13 4294 1 1 23 PHE HA H -11.932 6.403 6.451 1.00 . A A . 23 PHE HA 1 1 13 4295 1 1 23 PHE HB2 H -10.364 9.047 6.347 1.00 . A A . 23 PHE HB2 1 1 13 4296 1 1 23 PHE HB3 H -12.078 8.884 6.671 1.00 . A A . 23 PHE HB3 1 1 13 4297 1 1 23 PHE HD1 H -11.962 6.578 8.609 1.00 . A A . 23 PHE HD1 1 1 13 4298 1 1 23 PHE HD2 H -9.624 10.106 8.306 1.00 . A A . 23 PHE HD2 1 1 13 4299 1 1 23 PHE HE1 H -11.487 6.474 11.072 1.00 . A A . 23 PHE HE1 1 1 13 4300 1 1 23 PHE HE2 H -9.149 10.004 10.768 1.00 . A A . 23 PHE HE2 1 1 13 4301 1 1 23 PHE HZ H -10.086 8.189 12.122 1.00 . A A . 23 PHE HZ 1 1 13 4302 1 1 23 PHE N N -9.874 6.379 6.507 1.00 . A A . 23 PHE N 1 1 13 4303 1 1 23 PHE O O -10.505 8.120 4.074 1.00 . A A . 23 PHE O 1 1 14 4304 1 1 1 GLU C C -1.696 -14.542 11.519 1.00 . A A . 1 GLU C 1 1 14 4305 1 1 1 GLU CA C -2.405 -15.873 11.776 1.00 . A A . 1 GLU CA 1 1 14 4306 1 1 1 GLU CB C -2.620 -16.100 13.274 1.00 . A A . 1 GLU CB 1 1 14 4307 1 1 1 GLU CD C -4.107 -18.073 13.781 1.00 . A A . 1 GLU CD 1 1 14 4308 1 1 1 GLU CG C -4.051 -16.560 13.560 1.00 . A A . 1 GLU CG 1 1 14 4309 1 1 1 GLU HA H -3.372 -15.880 11.272 1.00 . A A . 1 GLU HA 1 1 14 4310 1 1 1 GLU HB2 H -1.914 -16.848 13.636 1.00 . A A . 1 GLU HB2 1 1 14 4311 1 1 1 GLU HB3 H -2.414 -15.179 13.818 1.00 . A A . 1 GLU HB3 1 1 14 4312 1 1 1 GLU HG2 H -4.432 -16.045 14.442 1.00 . A A . 1 GLU HG2 1 1 14 4313 1 1 1 GLU HG3 H -4.698 -16.286 12.726 1.00 . A A . 1 GLU HG3 1 1 14 4314 1 1 1 GLU N N -1.653 -16.967 11.186 1.00 . A A . 1 GLU N 1 1 14 4315 1 1 1 GLU O O -2.175 -13.719 10.741 1.00 . A A . 1 GLU O 1 1 14 4316 1 1 1 GLU OE1 O -3.359 -18.546 14.664 1.00 . A A . 1 GLU OE1 1 1 14 4317 1 1 1 GLU OE2 O -4.897 -18.722 13.061 1.00 . A A . 1 GLU OE2 1 1 14 4318 1 1 2 ASN C C -0.680 -11.945 12.308 1.00 . A A . 2 ASN C 1 1 14 4319 1 1 2 ASN CA C 0.215 -13.156 12.042 1.00 . A A . 2 ASN CA 1 1 14 4320 1 1 2 ASN CB C 0.775 -13.028 10.625 1.00 . A A . 2 ASN CB 1 1 14 4321 1 1 2 ASN CG C 2.233 -13.491 10.567 1.00 . A A . 2 ASN CG 1 1 14 4322 1 1 2 ASN H H -0.183 -15.047 12.821 1.00 . A A . 2 ASN H 1 1 14 4323 1 1 2 ASN HA H 1.022 -13.245 12.770 1.00 . A A . 2 ASN HA 1 1 14 4324 1 1 2 ASN HB2 H 0.174 -13.624 9.938 1.00 . A A . 2 ASN HB2 1 1 14 4325 1 1 2 ASN HB3 H 0.706 -11.992 10.294 1.00 . A A . 2 ASN HB3 1 1 14 4326 1 1 2 ASN HD21 H 1.588 -15.284 9.884 1.00 . A A . 2 ASN HD21 1 1 14 4327 1 1 2 ASN HD22 H 3.304 -15.132 10.062 1.00 . A A . 2 ASN HD22 1 1 14 4328 1 1 2 ASN N N -0.566 -14.372 12.189 1.00 . A A . 2 ASN N 1 1 14 4329 1 1 2 ASN ND2 N 2.388 -14.739 10.135 1.00 . A A . 2 ASN ND2 1 1 14 4330 1 1 2 ASN O O -1.888 -12.090 12.491 1.00 . A A . 2 ASN O 1 1 14 4331 1 1 2 ASN OD1 O 3.156 -12.762 10.893 1.00 . A A . 2 ASN OD1 1 1 14 4332 1 1 3 PHE C C -0.699 -8.614 11.347 1.00 . A A . 3 PHE C 1 1 14 4333 1 1 3 PHE CA C -0.780 -9.542 12.561 1.00 . A A . 3 PHE CA 1 1 14 4334 1 1 3 PHE CB C -0.115 -8.857 13.756 1.00 . A A . 3 PHE CB 1 1 14 4335 1 1 3 PHE CD1 C -0.847 -9.915 15.906 1.00 . A A . 3 PHE CD1 1 1 14 4336 1 1 3 PHE CD2 C -1.819 -7.857 15.296 1.00 . A A . 3 PHE CD2 1 1 14 4337 1 1 3 PHE CE1 C -1.629 -9.934 17.091 1.00 . A A . 3 PHE CE1 1 1 14 4338 1 1 3 PHE CE2 C -2.601 -7.876 16.480 1.00 . A A . 3 PHE CE2 1 1 14 4339 1 1 3 PHE CG C -0.958 -8.877 15.033 1.00 . A A . 3 PHE CG 1 1 14 4340 1 1 3 PHE CZ C -2.489 -8.914 17.353 1.00 . A A . 3 PHE CZ 1 1 14 4341 1 1 3 PHE H H 0.928 -10.668 12.172 1.00 . A A . 3 PHE H 1 1 14 4342 1 1 3 PHE HA H -1.822 -9.808 12.743 1.00 . A A . 3 PHE HA 1 1 14 4343 1 1 3 PHE HB2 H 0.840 -9.344 13.956 1.00 . A A . 3 PHE HB2 1 1 14 4344 1 1 3 PHE HB3 H 0.104 -7.822 13.494 1.00 . A A . 3 PHE HB3 1 1 14 4345 1 1 3 PHE HD1 H -0.157 -10.732 15.695 1.00 . A A . 3 PHE HD1 1 1 14 4346 1 1 3 PHE HD2 H -1.907 -7.025 14.597 1.00 . A A . 3 PHE HD2 1 1 14 4347 1 1 3 PHE HE1 H -1.540 -10.765 17.790 1.00 . A A . 3 PHE HE1 1 1 14 4348 1 1 3 PHE HE2 H -3.290 -7.058 16.691 1.00 . A A . 3 PHE HE2 1 1 14 4349 1 1 3 PHE HZ H -3.090 -8.928 18.263 1.00 . A A . 3 PHE HZ 1 1 14 4350 1 1 3 PHE N N -0.055 -10.778 12.321 1.00 . A A . 3 PHE N 1 1 14 4351 1 1 3 PHE O O 0.216 -8.728 10.533 1.00 . A A . 3 PHE O 1 1 14 4352 1 1 4 ASN C C -0.989 -5.485 10.566 1.00 . A A . 4 ASN C 1 1 14 4353 1 1 4 ASN CA C -1.719 -6.768 10.163 1.00 . A A . 4 ASN CA 1 1 14 4354 1 1 4 ASN CB C -3.163 -6.402 9.816 1.00 . A A . 4 ASN CB 1 1 14 4355 1 1 4 ASN CG C -3.215 -5.435 8.632 1.00 . A A . 4 ASN CG 1 1 14 4356 1 1 4 ASN H H -2.410 -7.629 11.930 1.00 . A A . 4 ASN H 1 1 14 4357 1 1 4 ASN HA H -1.239 -7.275 9.326 1.00 . A A . 4 ASN HA 1 1 14 4358 1 1 4 ASN HB2 H -3.724 -7.305 9.578 1.00 . A A . 4 ASN HB2 1 1 14 4359 1 1 4 ASN HB3 H -3.645 -5.947 10.683 1.00 . A A . 4 ASN HB3 1 1 14 4360 1 1 4 ASN HD21 H -4.088 -4.069 9.845 1.00 . A A . 4 ASN HD21 1 1 14 4361 1 1 4 ASN HD22 H -3.837 -3.555 8.209 1.00 . A A . 4 ASN HD22 1 1 14 4362 1 1 4 ASN N N -1.669 -7.715 11.264 1.00 . A A . 4 ASN N 1 1 14 4363 1 1 4 ASN ND2 N -3.758 -4.255 8.919 1.00 . A A . 4 ASN ND2 1 1 14 4364 1 1 4 ASN O O -1.400 -4.389 10.188 1.00 . A A . 4 ASN O 1 1 14 4365 1 1 4 ASN OD1 O -2.790 -5.740 7.530 1.00 . A A . 4 ASN OD1 1 1 14 4366 1 1 5 GLY C C 0.574 -4.218 13.253 1.00 . A A . 5 GLY C 1 1 14 4367 1 1 5 GLY CA C 0.870 -4.536 11.787 1.00 . A A . 5 GLY CA 1 1 14 4368 1 1 5 GLY H H 0.407 -6.560 11.630 1.00 . A A . 5 GLY H 1 1 14 4369 1 1 5 GLY HA2 H 1.931 -4.756 11.665 1.00 . A A . 5 GLY HA2 1 1 14 4370 1 1 5 GLY HA3 H 0.655 -3.662 11.171 1.00 . A A . 5 GLY HA3 1 1 14 4371 1 1 5 GLY N N 0.080 -5.665 11.327 1.00 . A A . 5 GLY N 1 1 14 4372 1 1 5 GLY O O 1.472 -3.840 14.005 1.00 . A A . 5 GLY O 1 1 14 4373 1 1 6 GLY C C -1.900 -2.809 15.066 1.00 . A A . 6 GLY C 1 1 14 4374 1 1 6 GLY CA C -1.115 -4.120 14.982 1.00 . A A . 6 GLY CA 1 1 14 4375 1 1 6 GLY H H -1.414 -4.691 13.001 1.00 . A A . 6 GLY H 1 1 14 4376 1 1 6 GLY HA2 H -1.734 -4.942 15.338 1.00 . A A . 6 GLY HA2 1 1 14 4377 1 1 6 GLY HA3 H -0.244 -4.068 15.635 1.00 . A A . 6 GLY HA3 1 1 14 4378 1 1 6 GLY N N -0.689 -4.383 13.618 1.00 . A A . 6 GLY N 1 1 14 4379 1 1 6 GLY O O -1.501 -1.885 15.773 1.00 . A A . 6 GLY O 1 1 14 4380 1 1 7 CYS C C -5.078 -1.865 15.192 1.00 . A A . 7 CYS C 1 1 14 4381 1 1 7 CYS CA C -3.852 -1.589 14.320 1.00 . A A . 7 CYS CA 1 1 14 4382 1 1 7 CYS CB C -4.242 -1.192 12.895 1.00 . A A . 7 CYS CB 1 1 14 4383 1 1 7 CYS H H -3.325 -3.527 13.764 1.00 . A A . 7 CYS H 1 1 14 4384 1 1 7 CYS HA H -3.258 -0.774 14.734 1.00 . A A . 7 CYS HA 1 1 14 4385 1 1 7 CYS HB2 H -4.699 -2.051 12.406 1.00 . A A . 7 CYS HB2 1 1 14 4386 1 1 7 CYS HB3 H -5.001 -0.411 12.945 1.00 . A A . 7 CYS HB3 1 1 14 4387 1 1 7 CYS N N -3.006 -2.771 14.337 1.00 . A A . 7 CYS N 1 1 14 4388 1 1 7 CYS O O -5.195 -2.936 15.784 1.00 . A A . 7 CYS O 1 1 14 4389 1 1 7 CYS SG S -2.856 -0.596 11.858 1.00 . A A . 7 CYS SG 1 1 14 4390 1 1 8 LEU C C -8.253 -1.698 15.196 1.00 . A A . 8 LEU C 1 1 14 4391 1 1 8 LEU CA C -7.177 -1.003 16.030 1.00 . A A . 8 LEU CA 1 1 14 4392 1 1 8 LEU CB C -7.605 0.364 16.571 1.00 . A A . 8 LEU CB 1 1 14 4393 1 1 8 LEU CD1 C -8.974 -0.559 18.478 1.00 . A A . 8 LEU CD1 1 1 14 4394 1 1 8 LEU CD2 C -9.306 1.836 17.710 1.00 . A A . 8 LEU CD2 1 1 14 4395 1 1 8 LEU CG C -8.954 0.407 17.292 1.00 . A A . 8 LEU CG 1 1 14 4396 1 1 8 LEU H H -5.860 -0.010 14.757 1.00 . A A . 8 LEU H 1 1 14 4397 1 1 8 LEU HA H -6.945 -1.631 16.891 1.00 . A A . 8 LEU HA 1 1 14 4398 1 1 8 LEU HB2 H -6.836 0.716 17.260 1.00 . A A . 8 LEU HB2 1 1 14 4399 1 1 8 LEU HB3 H -7.635 1.068 15.741 1.00 . A A . 8 LEU HB3 1 1 14 4400 1 1 8 LEU HD11 H -7.961 -0.685 18.861 1.00 . A A . 8 LEU HD11 1 1 14 4401 1 1 8 LEU HD12 H -9.612 -0.156 19.264 1.00 . A A . 8 LEU HD12 1 1 14 4402 1 1 8 LEU HD13 H -9.362 -1.525 18.154 1.00 . A A . 8 LEU HD13 1 1 14 4403 1 1 8 LEU HD21 H -8.408 2.344 18.060 1.00 . A A . 8 LEU HD21 1 1 14 4404 1 1 8 LEU HD22 H -9.719 2.373 16.857 1.00 . A A . 8 LEU HD22 1 1 14 4405 1 1 8 LEU HD23 H -10.044 1.808 18.513 1.00 . A A . 8 LEU HD23 1 1 14 4406 1 1 8 LEU HG H -9.724 0.077 16.594 1.00 . A A . 8 LEU HG 1 1 14 4407 1 1 8 LEU N N -5.962 -0.880 15.242 1.00 . A A . 8 LEU N 1 1 14 4408 1 1 8 LEU O O -8.799 -2.721 15.608 1.00 . A A . 8 LEU O 1 1 14 4409 1 1 9 ALA C C -9.968 -0.589 12.147 1.00 . A A . 9 ALA C 1 1 14 4410 1 1 9 ALA CA C -9.532 -1.666 13.143 1.00 . A A . 9 ALA CA 1 1 14 4411 1 1 9 ALA CB C -10.702 -2.214 13.962 1.00 . A A . 9 ALA CB 1 1 14 4412 1 1 9 ALA H H -8.081 -0.283 13.711 1.00 . A A . 9 ALA H 1 1 14 4413 1 1 9 ALA HA H -9.072 -2.489 12.596 1.00 . A A . 9 ALA HA 1 1 14 4414 1 1 9 ALA HB1 H -10.789 -1.652 14.892 1.00 . A A . 9 ALA HB1 1 1 14 4415 1 1 9 ALA HB2 H -11.625 -2.112 13.390 1.00 . A A . 9 ALA HB2 1 1 14 4416 1 1 9 ALA HB3 H -10.528 -3.266 14.187 1.00 . A A . 9 ALA HB3 1 1 14 4417 1 1 9 ALA N N -8.530 -1.115 14.039 1.00 . A A . 9 ALA N 1 1 14 4418 1 1 9 ALA O O -10.838 0.225 12.452 1.00 . A A . 9 ALA O 1 1 14 4419 1 1 10 GLY C C -8.412 1.132 9.529 1.00 . A A . 10 GLY C 1 1 14 4420 1 1 10 GLY CA C -9.657 0.343 9.938 1.00 . A A . 10 GLY CA 1 1 14 4421 1 1 10 GLY H H -8.637 -1.286 10.741 1.00 . A A . 10 GLY H 1 1 14 4422 1 1 10 GLY HA2 H -10.066 -0.174 9.071 1.00 . A A . 10 GLY HA2 1 1 14 4423 1 1 10 GLY HA3 H -10.426 1.030 10.293 1.00 . A A . 10 GLY HA3 1 1 14 4424 1 1 10 GLY N N -9.344 -0.620 10.980 1.00 . A A . 10 GLY N 1 1 14 4425 1 1 10 GLY O O -8.244 1.469 8.357 1.00 . A A . 10 GLY O 1 1 14 4426 1 1 11 TYR C C -5.420 1.380 9.324 1.00 . A A . 11 TYR C 1 1 14 4427 1 1 11 TYR CA C -6.344 2.145 10.271 1.00 . A A . 11 TYR CA 1 1 14 4428 1 1 11 TYR CB C -5.658 2.283 11.632 1.00 . A A . 11 TYR CB 1 1 14 4429 1 1 11 TYR CD1 C -6.382 4.546 12.477 1.00 . A A . 11 TYR CD1 1 1 14 4430 1 1 11 TYR CD2 C -7.123 2.605 13.659 1.00 . A A . 11 TYR CD2 1 1 14 4431 1 1 11 TYR CE1 C -7.093 5.384 13.409 1.00 . A A . 11 TYR CE1 1 1 14 4432 1 1 11 TYR CE2 C -7.833 3.443 14.591 1.00 . A A . 11 TYR CE2 1 1 14 4433 1 1 11 TYR CG C -6.413 3.173 12.621 1.00 . A A . 11 TYR CG 1 1 14 4434 1 1 11 TYR CZ C -7.783 4.791 14.419 1.00 . A A . 11 TYR CZ 1 1 14 4435 1 1 11 TYR H H -7.713 1.124 11.465 1.00 . A A . 11 TYR H 1 1 14 4436 1 1 11 TYR HA H -6.614 3.098 9.816 1.00 . A A . 11 TYR HA 1 1 14 4437 1 1 11 TYR HB2 H -5.538 1.293 12.070 1.00 . A A . 11 TYR HB2 1 1 14 4438 1 1 11 TYR HB3 H -4.658 2.690 11.483 1.00 . A A . 11 TYR HB3 1 1 14 4439 1 1 11 TYR HD1 H -5.821 4.995 11.657 1.00 . A A . 11 TYR HD1 1 1 14 4440 1 1 11 TYR HD2 H -7.147 1.521 13.773 1.00 . A A . 11 TYR HD2 1 1 14 4441 1 1 11 TYR HE1 H -7.077 6.469 13.306 1.00 . A A . 11 TYR HE1 1 1 14 4442 1 1 11 TYR HE2 H -8.398 3.007 15.414 1.00 . A A . 11 TYR HE2 1 1 14 4443 1 1 11 TYR HH H -9.108 6.158 14.810 1.00 . A A . 11 TYR HH 1 1 14 4444 1 1 11 TYR N N -7.570 1.402 10.516 1.00 . A A . 11 TYR N 1 1 14 4445 1 1 11 TYR O O -5.492 0.155 9.233 1.00 . A A . 11 TYR O 1 1 14 4446 1 1 11 TYR OH O -8.453 5.582 15.298 1.00 . A A . 11 TYR OH 1 1 14 4447 1 1 12 MET C C -2.190 1.746 8.166 1.00 . A A . 12 MET C 1 1 14 4448 1 1 12 MET CA C -3.633 1.542 7.700 1.00 . A A . 12 MET CA 1 1 14 4449 1 1 12 MET CB C -3.821 2.179 6.322 1.00 . A A . 12 MET CB 1 1 14 4450 1 1 12 MET CE C -3.353 6.197 5.542 1.00 . A A . 12 MET CE 1 1 14 4451 1 1 12 MET CG C -3.995 3.694 6.437 1.00 . A A . 12 MET CG 1 1 14 4452 1 1 12 MET H H -4.519 3.130 8.718 1.00 . A A . 12 MET H 1 1 14 4453 1 1 12 MET HA H -3.870 0.478 7.682 1.00 . A A . 12 MET HA 1 1 14 4454 1 1 12 MET HB2 H -2.958 1.956 5.694 1.00 . A A . 12 MET HB2 1 1 14 4455 1 1 12 MET HB3 H -4.692 1.745 5.832 1.00 . A A . 12 MET HB3 1 1 14 4456 1 1 12 MET HE1 H -3.793 6.249 6.538 1.00 . A A . 12 MET HE1 1 1 14 4457 1 1 12 MET HE2 H -2.338 6.592 5.571 1.00 . A A . 12 MET HE2 1 1 14 4458 1 1 12 MET HE3 H -3.953 6.789 4.849 1.00 . A A . 12 MET HE3 1 1 14 4459 1 1 12 MET HG2 H -5.053 3.941 6.537 1.00 . A A . 12 MET HG2 1 1 14 4460 1 1 12 MET HG3 H -3.497 4.059 7.335 1.00 . A A . 12 MET HG3 1 1 14 4461 1 1 12 MET N N -4.571 2.134 8.639 1.00 . A A . 12 MET N 1 1 14 4462 1 1 12 MET O O -1.913 2.635 8.969 1.00 . A A . 12 MET O 1 1 14 4463 1 1 12 MET SD S -3.317 4.499 4.995 1.00 . A A . 12 MET SD 1 1 14 4464 1 1 13 ARG C C 0.880 1.711 6.896 1.00 . A A . 13 ARG C 1 1 14 4465 1 1 13 ARG CA C 0.099 0.984 7.992 1.00 . A A . 13 ARG CA 1 1 14 4466 1 1 13 ARG CB C 0.693 -0.411 8.194 1.00 . A A . 13 ARG CB 1 1 14 4467 1 1 13 ARG CD C 2.761 -1.032 6.891 1.00 . A A . 13 ARG CD 1 1 14 4468 1 1 13 ARG CG C 2.222 -0.366 8.159 1.00 . A A . 13 ARG CG 1 1 14 4469 1 1 13 ARG CZ C 3.568 -3.306 6.271 1.00 . A A . 13 ARG CZ 1 1 14 4470 1 1 13 ARG H H -1.543 0.186 6.988 1.00 . A A . 13 ARG H 1 1 14 4471 1 1 13 ARG HA H 0.122 1.543 8.928 1.00 . A A . 13 ARG HA 1 1 14 4472 1 1 13 ARG HB2 H 0.359 -0.818 9.148 1.00 . A A . 13 ARG HB2 1 1 14 4473 1 1 13 ARG HB3 H 0.328 -1.082 7.416 1.00 . A A . 13 ARG HB3 1 1 14 4474 1 1 13 ARG HD2 H 1.981 -1.071 6.131 1.00 . A A . 13 ARG HD2 1 1 14 4475 1 1 13 ARG HD3 H 3.579 -0.439 6.479 1.00 . A A . 13 ARG HD3 1 1 14 4476 1 1 13 ARG HE H 3.311 -2.663 8.161 1.00 . A A . 13 ARG HE 1 1 14 4477 1 1 13 ARG HG2 H 2.560 0.669 8.202 1.00 . A A . 13 ARG HG2 1 1 14 4478 1 1 13 ARG HG3 H 2.625 -0.870 9.038 1.00 . A A . 13 ARG HG3 1 1 14 4479 1 1 13 ARG HH11 H 3.168 -2.089 4.693 1.00 . A A . 13 ARG HH11 1 1 14 4480 1 1 13 ARG HH12 H 3.730 -3.674 4.278 1.00 . A A . 13 ARG HH12 1 1 14 4481 1 1 13 ARG HH21 H 4.052 -4.755 7.615 1.00 . A A . 13 ARG HH21 1 1 14 4482 1 1 13 ARG HH22 H 4.236 -5.200 5.951 1.00 . A A . 13 ARG HH22 1 1 14 4483 1 1 13 ARG N N -1.309 0.907 7.641 1.00 . A A . 13 ARG N 1 1 14 4484 1 1 13 ARG NE N 3.235 -2.399 7.200 1.00 . A A . 13 ARG NE 1 1 14 4485 1 1 13 ARG NH1 N 3.482 -2.997 4.971 1.00 . A A . 13 ARG NH1 1 1 14 4486 1 1 13 ARG NH2 N 3.988 -4.523 6.644 1.00 . A A . 13 ARG NH2 1 1 14 4487 1 1 13 ARG O O 1.116 1.155 5.824 1.00 . A A . 13 ARG O 1 1 14 4488 1 1 14 THR C C 3.357 3.090 5.942 1.00 . A A . 14 THR C 1 1 14 4489 1 1 14 THR CA C 2.013 3.750 6.257 1.00 . A A . 14 THR CA 1 1 14 4490 1 1 14 THR CB C 2.149 5.157 6.840 1.00 . A A . 14 THR CB 1 1 14 4491 1 1 14 THR CG2 C 0.794 5.791 7.161 1.00 . A A . 14 THR CG2 1 1 14 4492 1 1 14 THR H H 1.065 3.387 8.075 1.00 . A A . 14 THR H 1 1 14 4493 1 1 14 THR HA H 1.453 3.796 5.322 1.00 . A A . 14 THR HA 1 1 14 4494 1 1 14 THR HB H 2.732 5.799 6.179 1.00 . A A . 14 THR HB 1 1 14 4495 1 1 14 THR HG1 H 2.966 5.827 8.540 1.00 . A A . 14 THR HG1 1 1 14 4496 1 1 14 THR HG21 H 0.161 5.061 7.665 1.00 . A A . 14 THR HG21 1 1 14 4497 1 1 14 THR HG22 H 0.941 6.654 7.812 1.00 . A A . 14 THR HG22 1 1 14 4498 1 1 14 THR HG23 H 0.314 6.112 6.237 1.00 . A A . 14 THR HG23 1 1 14 4499 1 1 14 THR N N 1.261 2.942 7.202 1.00 . A A . 14 THR N 1 1 14 4500 1 1 14 THR O O 3.549 1.905 6.209 1.00 . A A . 14 THR O 1 1 14 4501 1 1 14 THR OG1 O 2.746 4.948 8.117 1.00 . A A . 14 THR OG1 1 1 14 4502 1 1 15 ALA C C 6.498 3.507 6.240 1.00 . A A . 15 ALA C 1 1 14 4503 1 1 15 ALA CA C 5.575 3.395 5.025 1.00 . A A . 15 ALA CA 1 1 14 4504 1 1 15 ALA CB C 6.102 4.173 3.819 1.00 . A A . 15 ALA CB 1 1 14 4505 1 1 15 ALA H H 4.090 4.850 5.165 1.00 . A A . 15 ALA H 1 1 14 4506 1 1 15 ALA HA H 5.475 2.344 4.750 1.00 . A A . 15 ALA HA 1 1 14 4507 1 1 15 ALA HB1 H 5.399 4.081 2.991 1.00 . A A . 15 ALA HB1 1 1 14 4508 1 1 15 ALA HB2 H 6.216 5.223 4.084 1.00 . A A . 15 ALA HB2 1 1 14 4509 1 1 15 ALA HB3 H 7.069 3.767 3.520 1.00 . A A . 15 ALA HB3 1 1 14 4510 1 1 15 ALA N N 4.254 3.887 5.379 1.00 . A A . 15 ALA N 1 1 14 4511 1 1 15 ALA O O 7.706 3.298 6.128 1.00 . A A . 15 ALA O 1 1 14 4512 1 1 16 ASP C C 6.180 2.922 9.611 1.00 . A A . 16 ASP C 1 1 14 4513 1 1 16 ASP CA C 6.649 3.978 8.608 1.00 . A A . 16 ASP CA 1 1 14 4514 1 1 16 ASP CB C 6.426 5.356 9.234 1.00 . A A . 16 ASP CB 1 1 14 4515 1 1 16 ASP CG C 7.692 6.046 9.745 1.00 . A A . 16 ASP CG 1 1 14 4516 1 1 16 ASP H H 4.914 4.004 7.456 1.00 . A A . 16 ASP H 1 1 14 4517 1 1 16 ASP HA H 7.693 3.848 8.323 1.00 . A A . 16 ASP HA 1 1 14 4518 1 1 16 ASP HB2 H 5.951 6.001 8.495 1.00 . A A . 16 ASP HB2 1 1 14 4519 1 1 16 ASP HB3 H 5.727 5.253 10.063 1.00 . A A . 16 ASP HB3 1 1 14 4520 1 1 16 ASP N N 5.896 3.836 7.374 1.00 . A A . 16 ASP N 1 1 14 4521 1 1 16 ASP O O 6.844 2.679 10.618 1.00 . A A . 16 ASP O 1 1 14 4522 1 1 16 ASP OD1 O 8.769 5.741 9.189 1.00 . A A . 16 ASP OD1 1 1 14 4523 1 1 16 ASP OD2 O 7.555 6.865 10.680 1.00 . A A . 16 ASP OD2 1 1 14 4524 1 1 17 GLY C C 3.462 1.898 11.137 1.00 . A A . 17 GLY C 1 1 14 4525 1 1 17 GLY CA C 4.476 1.297 10.161 1.00 . A A . 17 GLY CA 1 1 14 4526 1 1 17 GLY H H 4.508 2.525 8.479 1.00 . A A . 17 GLY H 1 1 14 4527 1 1 17 GLY HA2 H 3.992 0.533 9.553 1.00 . A A . 17 GLY HA2 1 1 14 4528 1 1 17 GLY HA3 H 5.274 0.804 10.718 1.00 . A A . 17 GLY HA3 1 1 14 4529 1 1 17 GLY N N 5.041 2.322 9.300 1.00 . A A . 17 GLY N 1 1 14 4530 1 1 17 GLY O O 2.825 1.174 11.899 1.00 . A A . 17 GLY O 1 1 14 4531 1 1 18 ARG C C 0.980 3.731 11.458 1.00 . A A . 18 ARG C 1 1 14 4532 1 1 18 ARG CA C 2.417 3.923 11.947 1.00 . A A . 18 ARG CA 1 1 14 4533 1 1 18 ARG CB C 2.737 5.418 11.994 1.00 . A A . 18 ARG CB 1 1 14 4534 1 1 18 ARG CD C 4.409 7.158 12.727 1.00 . A A . 18 ARG CD 1 1 14 4535 1 1 18 ARG CG C 4.140 5.662 12.553 1.00 . A A . 18 ARG CG 1 1 14 4536 1 1 18 ARG CZ C 4.510 8.662 14.710 1.00 . A A . 18 ARG CZ 1 1 14 4537 1 1 18 ARG H H 3.866 3.798 10.456 1.00 . A A . 18 ARG H 1 1 14 4538 1 1 18 ARG HA H 2.560 3.475 12.931 1.00 . A A . 18 ARG HA 1 1 14 4539 1 1 18 ARG HB2 H 2.663 5.841 10.992 1.00 . A A . 18 ARG HB2 1 1 14 4540 1 1 18 ARG HB3 H 2.001 5.932 12.612 1.00 . A A . 18 ARG HB3 1 1 14 4541 1 1 18 ARG HD2 H 5.468 7.366 12.569 1.00 . A A . 18 ARG HD2 1 1 14 4542 1 1 18 ARG HD3 H 3.858 7.724 11.976 1.00 . A A . 18 ARG HD3 1 1 14 4543 1 1 18 ARG HE H 3.313 7.051 14.561 1.00 . A A . 18 ARG HE 1 1 14 4544 1 1 18 ARG HG2 H 4.246 5.156 13.513 1.00 . A A . 18 ARG HG2 1 1 14 4545 1 1 18 ARG HG3 H 4.883 5.230 11.882 1.00 . A A . 18 ARG HG3 1 1 14 4546 1 1 18 ARG HH11 H 5.758 9.178 13.190 1.00 . A A . 18 ARG HH11 1 1 14 4547 1 1 18 ARG HH12 H 5.816 10.215 14.577 1.00 . A A . 18 ARG HH12 1 1 14 4548 1 1 18 ARG HH21 H 3.390 8.418 16.390 1.00 . A A . 18 ARG HH21 1 1 14 4549 1 1 18 ARG HH22 H 4.461 9.779 16.409 1.00 . A A . 18 ARG HH22 1 1 14 4550 1 1 18 ARG N N 3.344 3.217 11.079 1.00 . A A . 18 ARG N 1 1 14 4551 1 1 18 ARG NE N 4.006 7.591 14.083 1.00 . A A . 18 ARG NE 1 1 14 4552 1 1 18 ARG NH1 N 5.440 9.416 14.108 1.00 . A A . 18 ARG NH1 1 1 14 4553 1 1 18 ARG NH2 N 4.084 8.980 15.941 1.00 . A A . 18 ARG NH2 1 1 14 4554 1 1 18 ARG O O 0.618 4.207 10.384 1.00 . A A . 18 ARG O 1 1 14 4555 1 1 19 CYS C C -1.912 4.111 11.802 1.00 . A A . 19 CYS C 1 1 14 4556 1 1 19 CYS CA C -1.188 2.769 11.932 1.00 . A A . 19 CYS CA 1 1 14 4557 1 1 19 CYS CB C -1.858 1.856 12.961 1.00 . A A . 19 CYS CB 1 1 14 4558 1 1 19 CYS H H 0.503 2.647 13.143 1.00 . A A . 19 CYS H 1 1 14 4559 1 1 19 CYS HA H -1.184 2.237 10.980 1.00 . A A . 19 CYS HA 1 1 14 4560 1 1 19 CYS HB2 H -1.716 2.285 13.953 1.00 . A A . 19 CYS HB2 1 1 14 4561 1 1 19 CYS HB3 H -2.931 1.842 12.770 1.00 . A A . 19 CYS HB3 1 1 14 4562 1 1 19 CYS N N 0.201 3.032 12.270 1.00 . A A . 19 CYS N 1 1 14 4563 1 1 19 CYS O O -2.300 4.710 12.803 1.00 . A A . 19 CYS O 1 1 14 4564 1 1 19 CYS SG S -1.242 0.133 12.974 1.00 . A A . 19 CYS SG 1 1 14 4565 1 1 20 LYS C C -4.209 5.527 9.936 1.00 . A A . 20 LYS C 1 1 14 4566 1 1 20 LYS CA C -2.744 5.801 10.285 1.00 . A A . 20 LYS CA 1 1 14 4567 1 1 20 LYS CB C -1.992 6.587 9.209 1.00 . A A . 20 LYS CB 1 1 14 4568 1 1 20 LYS CD C 0.010 7.819 10.121 1.00 . A A . 20 LYS CD 1 1 14 4569 1 1 20 LYS CE C 0.818 8.907 9.411 1.00 . A A . 20 LYS CE 1 1 14 4570 1 1 20 LYS CG C -1.474 7.916 9.763 1.00 . A A . 20 LYS CG 1 1 14 4571 1 1 20 LYS H H -1.753 4.049 9.750 1.00 . A A . 20 LYS H 1 1 14 4572 1 1 20 LYS HA H -2.712 6.394 11.199 1.00 . A A . 20 LYS HA 1 1 14 4573 1 1 20 LYS HB2 H -1.157 5.994 8.837 1.00 . A A . 20 LYS HB2 1 1 14 4574 1 1 20 LYS HB3 H -2.653 6.774 8.363 1.00 . A A . 20 LYS HB3 1 1 14 4575 1 1 20 LYS HD2 H 0.135 7.915 11.200 1.00 . A A . 20 LYS HD2 1 1 14 4576 1 1 20 LYS HD3 H 0.392 6.837 9.842 1.00 . A A . 20 LYS HD3 1 1 14 4577 1 1 20 LYS HE2 H 1.746 8.485 9.024 1.00 . A A . 20 LYS HE2 1 1 14 4578 1 1 20 LYS HE3 H 0.258 9.283 8.555 1.00 . A A . 20 LYS HE3 1 1 14 4579 1 1 20 LYS HG2 H -1.623 8.704 9.025 1.00 . A A . 20 LYS HG2 1 1 14 4580 1 1 20 LYS HG3 H -2.048 8.195 10.646 1.00 . A A . 20 LYS HG3 1 1 14 4581 1 1 20 LYS HZ1 H 1.416 9.645 11.220 1.00 . A A . 20 LYS HZ1 1 1 14 4582 1 1 20 LYS HZ2 H 1.851 10.584 9.957 1.00 . A A . 20 LYS HZ2 1 1 14 4583 1 1 20 LYS HZ3 H 0.301 10.575 10.472 1.00 . A A . 20 LYS HZ3 1 1 14 4584 1 1 20 LYS N N -2.072 4.542 10.559 1.00 . A A . 20 LYS N 1 1 14 4585 1 1 20 LYS NZ N 1.121 10.018 10.340 1.00 . A A . 20 LYS NZ 1 1 14 4586 1 1 20 LYS O O -4.605 4.375 9.768 1.00 . A A . 20 LYS O 1 1 14 4587 1 1 21 PRO C C -6.602 6.205 8.025 1.00 . A A . 21 PRO C 1 1 14 4588 1 1 21 PRO CA C -6.405 6.523 9.509 1.00 . A A . 21 PRO CA 1 1 14 4589 1 1 21 PRO CB C -7.008 7.858 9.915 1.00 . A A . 21 PRO CB 1 1 14 4590 1 1 21 PRO CD C -4.557 8.014 10.027 1.00 . A A . 21 PRO CD 1 1 14 4591 1 1 21 PRO CG C -5.841 8.828 10.019 1.00 . A A . 21 PRO CG 1 1 14 4592 1 1 21 PRO HA H -6.818 5.763 10.009 1.00 . A A . 21 PRO HA 1 1 14 4593 1 1 21 PRO HB2 H -7.734 8.199 9.177 1.00 . A A . 21 PRO HB2 1 1 14 4594 1 1 21 PRO HB3 H -7.534 7.776 10.866 1.00 . A A . 21 PRO HB3 1 1 14 4595 1 1 21 PRO HD2 H -3.883 8.331 9.232 1.00 . A A . 21 PRO HD2 1 1 14 4596 1 1 21 PRO HD3 H -4.019 8.132 10.966 1.00 . A A . 21 PRO HD3 1 1 14 4597 1 1 21 PRO HG2 H -5.847 9.524 9.180 1.00 . A A . 21 PRO HG2 1 1 14 4598 1 1 21 PRO HG3 H -5.920 9.424 10.928 1.00 . A A . 21 PRO HG3 1 1 14 4599 1 1 21 PRO N N -4.992 6.633 9.835 1.00 . A A . 21 PRO N 1 1 14 4600 1 1 21 PRO O O -5.835 6.666 7.180 1.00 . A A . 21 PRO O 1 1 14 4601 1 1 22 THR C C -9.165 5.797 5.880 1.00 . A A . 22 THR C 1 1 14 4602 1 1 22 THR CA C -7.940 5.034 6.386 1.00 . A A . 22 THR CA 1 1 14 4603 1 1 22 THR CB C -8.112 3.514 6.351 1.00 . A A . 22 THR CB 1 1 14 4604 1 1 22 THR CG2 C -7.999 2.945 4.935 1.00 . A A . 22 THR CG2 1 1 14 4605 1 1 22 THR H H -8.252 5.049 8.446 1.00 . A A . 22 THR H 1 1 14 4606 1 1 22 THR HA H -7.101 5.320 5.752 1.00 . A A . 22 THR HA 1 1 14 4607 1 1 22 THR HB H -9.053 3.219 6.815 1.00 . A A . 22 THR HB 1 1 14 4608 1 1 22 THR HG1 H -6.794 3.539 7.856 1.00 . A A . 22 THR HG1 1 1 14 4609 1 1 22 THR HG21 H -8.149 3.744 4.209 1.00 . A A . 22 THR HG21 1 1 14 4610 1 1 22 THR HG22 H -7.010 2.509 4.797 1.00 . A A . 22 THR HG22 1 1 14 4611 1 1 22 THR HG23 H -8.758 2.176 4.791 1.00 . A A . 22 THR HG23 1 1 14 4612 1 1 22 THR N N -7.632 5.419 7.753 1.00 . A A . 22 THR N 1 1 14 4613 1 1 22 THR O O -9.678 5.509 4.799 1.00 . A A . 22 THR O 1 1 14 4614 1 1 22 THR OG1 O -6.956 3.018 7.018 1.00 . A A . 22 THR OG1 1 1 14 4615 1 1 23 PHE C C -10.329 8.945 5.836 1.00 . A A . 23 PHE C 1 1 14 4616 1 1 23 PHE CA C -10.757 7.563 6.331 1.00 . A A . 23 PHE CA 1 1 14 4617 1 1 23 PHE CB C -11.593 7.725 7.602 1.00 . A A . 23 PHE CB 1 1 14 4618 1 1 23 PHE CD1 C -10.324 9.540 8.771 1.00 . A A . 23 PHE CD1 1 1 14 4619 1 1 23 PHE CD2 C -10.598 7.482 9.887 1.00 . A A . 23 PHE CD2 1 1 14 4620 1 1 23 PHE CE1 C -9.597 10.044 9.882 1.00 . A A . 23 PHE CE1 1 1 14 4621 1 1 23 PHE CE2 C -9.870 7.987 10.997 1.00 . A A . 23 PHE CE2 1 1 14 4622 1 1 23 PHE CG C -10.809 8.270 8.798 1.00 . A A . 23 PHE CG 1 1 14 4623 1 1 23 PHE CZ C -9.385 9.257 10.971 1.00 . A A . 23 PHE CZ 1 1 14 4624 1 1 23 PHE H H -9.178 6.984 7.562 1.00 . A A . 23 PHE H 1 1 14 4625 1 1 23 PHE HA H -11.285 7.040 5.534 1.00 . A A . 23 PHE HA 1 1 14 4626 1 1 23 PHE HB2 H -12.427 8.394 7.392 1.00 . A A . 23 PHE HB2 1 1 14 4627 1 1 23 PHE HB3 H -12.020 6.759 7.869 1.00 . A A . 23 PHE HB3 1 1 14 4628 1 1 23 PHE HD1 H -10.494 10.169 7.899 1.00 . A A . 23 PHE HD1 1 1 14 4629 1 1 23 PHE HD2 H -10.987 6.465 9.908 1.00 . A A . 23 PHE HD2 1 1 14 4630 1 1 23 PHE HE1 H -9.208 11.062 9.861 1.00 . A A . 23 PHE HE1 1 1 14 4631 1 1 23 PHE HE2 H -9.701 7.358 11.870 1.00 . A A . 23 PHE HE2 1 1 14 4632 1 1 23 PHE HZ H -8.827 9.645 11.823 1.00 . A A . 23 PHE HZ 1 1 14 4633 1 1 23 PHE N N -9.600 6.756 6.684 1.00 . A A . 23 PHE N 1 1 14 4634 1 1 23 PHE O O -9.920 9.098 4.686 1.00 . A A . 23 PHE O 1 1 15 4635 1 1 1 GLU C C 0.212 -4.748 19.864 1.00 . A A . 1 GLU C 1 1 15 4636 1 1 1 GLU CA C 1.508 -5.541 20.045 1.00 . A A . 1 GLU CA 1 1 15 4637 1 1 1 GLU CB C 2.728 -4.688 19.693 1.00 . A A . 1 GLU CB 1 1 15 4638 1 1 1 GLU CD C 5.018 -3.989 20.483 1.00 . A A . 1 GLU CD 1 1 15 4639 1 1 1 GLU CG C 3.927 -5.057 20.568 1.00 . A A . 1 GLU CG 1 1 15 4640 1 1 1 GLU HA H 1.594 -5.878 21.078 1.00 . A A . 1 GLU HA 1 1 15 4641 1 1 1 GLU HB2 H 2.983 -4.828 18.642 1.00 . A A . 1 GLU HB2 1 1 15 4642 1 1 1 GLU HB3 H 2.488 -3.633 19.824 1.00 . A A . 1 GLU HB3 1 1 15 4643 1 1 1 GLU HG2 H 3.605 -5.171 21.603 1.00 . A A . 1 GLU HG2 1 1 15 4644 1 1 1 GLU HG3 H 4.330 -6.020 20.252 1.00 . A A . 1 GLU HG3 1 1 15 4645 1 1 1 GLU N N 1.472 -6.754 19.246 1.00 . A A . 1 GLU N 1 1 15 4646 1 1 1 GLU O O -0.545 -4.562 20.815 1.00 . A A . 1 GLU O 1 1 15 4647 1 1 1 GLU OE1 O 5.610 -3.868 19.388 1.00 . A A . 1 GLU OE1 1 1 15 4648 1 1 1 GLU OE2 O 5.237 -3.316 21.514 1.00 . A A . 1 GLU OE2 1 1 15 4649 1 1 2 ASN C C -2.433 -4.320 18.744 1.00 . A A . 2 ASN C 1 1 15 4650 1 1 2 ASN CA C -1.193 -3.532 18.316 1.00 . A A . 2 ASN CA 1 1 15 4651 1 1 2 ASN CB C -1.294 -3.271 16.813 1.00 . A A . 2 ASN CB 1 1 15 4652 1 1 2 ASN CG C -1.524 -1.786 16.527 1.00 . A A . 2 ASN CG 1 1 15 4653 1 1 2 ASN H H 0.619 -4.456 17.867 1.00 . A A . 2 ASN H 1 1 15 4654 1 1 2 ASN HA H -1.084 -2.596 18.864 1.00 . A A . 2 ASN HA 1 1 15 4655 1 1 2 ASN HB2 H -0.379 -3.602 16.320 1.00 . A A . 2 ASN HB2 1 1 15 4656 1 1 2 ASN HB3 H -2.111 -3.858 16.392 1.00 . A A . 2 ASN HB3 1 1 15 4657 1 1 2 ASN HD21 H 0.483 -1.526 16.510 1.00 . A A . 2 ASN HD21 1 1 15 4658 1 1 2 ASN HD22 H -0.452 -0.096 16.224 1.00 . A A . 2 ASN HD22 1 1 15 4659 1 1 2 ASN N N -0.002 -4.301 18.635 1.00 . A A . 2 ASN N 1 1 15 4660 1 1 2 ASN ND2 N -0.405 -1.077 16.410 1.00 . A A . 2 ASN ND2 1 1 15 4661 1 1 2 ASN O O -2.331 -5.481 19.134 1.00 . A A . 2 ASN O 1 1 15 4662 1 1 2 ASN OD1 O -2.645 -1.315 16.420 1.00 . A A . 2 ASN OD1 1 1 15 4663 1 1 3 PHE C C -4.890 -5.730 18.555 1.00 . A A . 3 PHE C 1 1 15 4664 1 1 3 PHE CA C -4.834 -4.278 19.031 1.00 . A A . 3 PHE CA 1 1 15 4665 1 1 3 PHE CB C -5.947 -3.485 18.343 1.00 . A A . 3 PHE CB 1 1 15 4666 1 1 3 PHE CD1 C -7.886 -5.039 18.027 1.00 . A A . 3 PHE CD1 1 1 15 4667 1 1 3 PHE CD2 C -8.084 -3.334 19.640 1.00 . A A . 3 PHE CD2 1 1 15 4668 1 1 3 PHE CE1 C -9.195 -5.489 18.342 1.00 . A A . 3 PHE CE1 1 1 15 4669 1 1 3 PHE CE2 C -9.394 -3.784 19.955 1.00 . A A . 3 PHE CE2 1 1 15 4670 1 1 3 PHE CG C -7.358 -3.970 18.682 1.00 . A A . 3 PHE CG 1 1 15 4671 1 1 3 PHE CZ C -9.921 -4.852 19.299 1.00 . A A . 3 PHE CZ 1 1 15 4672 1 1 3 PHE H H -3.649 -2.709 18.341 1.00 . A A . 3 PHE H 1 1 15 4673 1 1 3 PHE HA H -4.898 -4.251 20.119 1.00 . A A . 3 PHE HA 1 1 15 4674 1 1 3 PHE HB2 H -5.858 -2.435 18.622 1.00 . A A . 3 PHE HB2 1 1 15 4675 1 1 3 PHE HB3 H -5.805 -3.540 17.263 1.00 . A A . 3 PHE HB3 1 1 15 4676 1 1 3 PHE HD1 H -7.303 -5.548 17.259 1.00 . A A . 3 PHE HD1 1 1 15 4677 1 1 3 PHE HD2 H -7.661 -2.477 20.166 1.00 . A A . 3 PHE HD2 1 1 15 4678 1 1 3 PHE HE1 H -9.618 -6.344 17.816 1.00 . A A . 3 PHE HE1 1 1 15 4679 1 1 3 PHE HE2 H -9.975 -3.273 20.722 1.00 . A A . 3 PHE HE2 1 1 15 4680 1 1 3 PHE HZ H -10.926 -5.198 19.542 1.00 . A A . 3 PHE HZ 1 1 15 4681 1 1 3 PHE N N -3.576 -3.655 18.658 1.00 . A A . 3 PHE N 1 1 15 4682 1 1 3 PHE O O -4.903 -6.653 19.368 1.00 . A A . 3 PHE O 1 1 15 4683 1 1 4 ASN C C -3.564 -7.634 16.222 1.00 . A A . 4 ASN C 1 1 15 4684 1 1 4 ASN CA C -4.972 -7.212 16.645 1.00 . A A . 4 ASN CA 1 1 15 4685 1 1 4 ASN CB C -5.862 -7.222 15.401 1.00 . A A . 4 ASN CB 1 1 15 4686 1 1 4 ASN CG C -5.468 -6.103 14.435 1.00 . A A . 4 ASN CG 1 1 15 4687 1 1 4 ASN H H -4.907 -5.131 16.586 1.00 . A A . 4 ASN H 1 1 15 4688 1 1 4 ASN HA H -5.386 -7.857 17.420 1.00 . A A . 4 ASN HA 1 1 15 4689 1 1 4 ASN HB2 H -5.780 -8.186 14.899 1.00 . A A . 4 ASN HB2 1 1 15 4690 1 1 4 ASN HB3 H -6.906 -7.104 15.695 1.00 . A A . 4 ASN HB3 1 1 15 4691 1 1 4 ASN HD21 H -7.343 -5.359 14.606 1.00 . A A . 4 ASN HD21 1 1 15 4692 1 1 4 ASN HD22 H -6.287 -4.472 13.559 1.00 . A A . 4 ASN HD22 1 1 15 4693 1 1 4 ASN N N -4.919 -5.887 17.240 1.00 . A A . 4 ASN N 1 1 15 4694 1 1 4 ASN ND2 N -6.447 -5.240 14.179 1.00 . A A . 4 ASN ND2 1 1 15 4695 1 1 4 ASN O O -3.385 -8.680 15.600 1.00 . A A . 4 ASN O 1 1 15 4696 1 1 4 ASN OD1 O -4.349 -6.027 13.956 1.00 . A A . 4 ASN OD1 1 1 15 4697 1 1 5 GLY C C -0.708 -6.107 15.164 1.00 . A A . 5 GLY C 1 1 15 4698 1 1 5 GLY CA C -1.211 -7.071 16.242 1.00 . A A . 5 GLY CA 1 1 15 4699 1 1 5 GLY H H -2.752 -5.948 17.083 1.00 . A A . 5 GLY H 1 1 15 4700 1 1 5 GLY HA2 H -0.593 -6.979 17.134 1.00 . A A . 5 GLY HA2 1 1 15 4701 1 1 5 GLY HA3 H -1.114 -8.097 15.891 1.00 . A A . 5 GLY HA3 1 1 15 4702 1 1 5 GLY N N -2.598 -6.798 16.577 1.00 . A A . 5 GLY N 1 1 15 4703 1 1 5 GLY O O 0.496 -5.897 15.030 1.00 . A A . 5 GLY O 1 1 15 4704 1 1 6 GLY C C -1.878 -3.218 13.670 1.00 . A A . 6 GLY C 1 1 15 4705 1 1 6 GLY CA C -1.323 -4.612 13.365 1.00 . A A . 6 GLY CA 1 1 15 4706 1 1 6 GLY H H -2.632 -5.725 14.543 1.00 . A A . 6 GLY H 1 1 15 4707 1 1 6 GLY HA2 H -0.241 -4.559 13.249 1.00 . A A . 6 GLY HA2 1 1 15 4708 1 1 6 GLY HA3 H -1.729 -4.970 12.419 1.00 . A A . 6 GLY HA3 1 1 15 4709 1 1 6 GLY N N -1.655 -5.548 14.427 1.00 . A A . 6 GLY N 1 1 15 4710 1 1 6 GLY O O -1.125 -2.309 14.014 1.00 . A A . 6 GLY O 1 1 15 4711 1 1 7 CYS C C -5.036 -2.087 14.726 1.00 . A A . 7 CYS C 1 1 15 4712 1 1 7 CYS CA C -3.854 -1.830 13.790 1.00 . A A . 7 CYS CA 1 1 15 4713 1 1 7 CYS CB C -4.290 -1.147 12.492 1.00 . A A . 7 CYS CB 1 1 15 4714 1 1 7 CYS H H -3.794 -3.842 13.254 1.00 . A A . 7 CYS H 1 1 15 4715 1 1 7 CYS HA H -3.119 -1.181 14.265 1.00 . A A . 7 CYS HA 1 1 15 4716 1 1 7 CYS HB2 H -4.678 -1.906 11.812 1.00 . A A . 7 CYS HB2 1 1 15 4717 1 1 7 CYS HB3 H -5.115 -0.470 12.714 1.00 . A A . 7 CYS HB3 1 1 15 4718 1 1 7 CYS N N -3.190 -3.096 13.533 1.00 . A A . 7 CYS N 1 1 15 4719 1 1 7 CYS O O -5.291 -3.227 15.110 1.00 . A A . 7 CYS O 1 1 15 4720 1 1 7 CYS SG S -2.974 -0.209 11.636 1.00 . A A . 7 CYS SG 1 1 15 4721 1 1 8 LEU C C -8.052 -1.719 15.185 1.00 . A A . 8 LEU C 1 1 15 4722 1 1 8 LEU CA C -6.876 -1.105 15.949 1.00 . A A . 8 LEU CA 1 1 15 4723 1 1 8 LEU CB C -7.191 0.258 16.569 1.00 . A A . 8 LEU CB 1 1 15 4724 1 1 8 LEU CD1 C -8.444 -0.589 18.586 1.00 . A A . 8 LEU CD1 1 1 15 4725 1 1 8 LEU CD2 C -8.786 1.791 17.779 1.00 . A A . 8 LEU CD2 1 1 15 4726 1 1 8 LEU CG C -8.488 0.345 17.376 1.00 . A A . 8 LEU CG 1 1 15 4727 1 1 8 LEU H H -5.512 -0.085 14.749 1.00 . A A . 8 LEU H 1 1 15 4728 1 1 8 LEU HA H -6.607 -1.775 16.765 1.00 . A A . 8 LEU HA 1 1 15 4729 1 1 8 LEU HB2 H -6.362 0.540 17.218 1.00 . A A . 8 LEU HB2 1 1 15 4730 1 1 8 LEU HB3 H -7.233 0.998 15.770 1.00 . A A . 8 LEU HB3 1 1 15 4731 1 1 8 LEU HD11 H -7.522 -1.171 18.563 1.00 . A A . 8 LEU HD11 1 1 15 4732 1 1 8 LEU HD12 H -8.478 0.000 19.502 1.00 . A A . 8 LEU HD12 1 1 15 4733 1 1 8 LEU HD13 H -9.300 -1.264 18.555 1.00 . A A . 8 LEU HD13 1 1 15 4734 1 1 8 LEU HD21 H -7.851 2.313 17.981 1.00 . A A . 8 LEU HD21 1 1 15 4735 1 1 8 LEU HD22 H -9.315 2.292 16.968 1.00 . A A . 8 LEU HD22 1 1 15 4736 1 1 8 LEU HD23 H -9.407 1.797 18.675 1.00 . A A . 8 LEU HD23 1 1 15 4737 1 1 8 LEU HG H -9.308 0.012 16.741 1.00 . A A . 8 LEU HG 1 1 15 4738 1 1 8 LEU N N -5.727 -1.009 15.066 1.00 . A A . 8 LEU N 1 1 15 4739 1 1 8 LEU O O -8.621 -2.720 15.616 1.00 . A A . 8 LEU O 1 1 15 4740 1 1 9 ALA C C -9.920 -0.442 12.296 1.00 . A A . 9 ALA C 1 1 15 4741 1 1 9 ALA CA C -9.477 -1.564 13.238 1.00 . A A . 9 ALA CA 1 1 15 4742 1 1 9 ALA CB C -10.616 -2.057 14.132 1.00 . A A . 9 ALA CB 1 1 15 4743 1 1 9 ALA H H -7.912 -0.277 13.722 1.00 . A A . 9 ALA H 1 1 15 4744 1 1 9 ALA HA H -9.109 -2.401 12.644 1.00 . A A . 9 ALA HA 1 1 15 4745 1 1 9 ALA HB1 H -10.607 -1.503 15.071 1.00 . A A . 9 ALA HB1 1 1 15 4746 1 1 9 ALA HB2 H -11.569 -1.900 13.627 1.00 . A A . 9 ALA HB2 1 1 15 4747 1 1 9 ALA HB3 H -10.483 -3.120 14.336 1.00 . A A . 9 ALA HB3 1 1 15 4748 1 1 9 ALA N N -8.380 -1.092 14.065 1.00 . A A . 9 ALA N 1 1 15 4749 1 1 9 ALA O O -10.743 0.395 12.666 1.00 . A A . 9 ALA O 1 1 15 4750 1 1 10 GLY C C -8.429 1.308 9.661 1.00 . A A . 10 GLY C 1 1 15 4751 1 1 10 GLY CA C -9.680 0.545 10.101 1.00 . A A . 10 GLY CA 1 1 15 4752 1 1 10 GLY H H -8.686 -1.145 10.806 1.00 . A A . 10 GLY H 1 1 15 4753 1 1 10 GLY HA2 H -10.142 0.069 9.236 1.00 . A A . 10 GLY HA2 1 1 15 4754 1 1 10 GLY HA3 H -10.411 1.243 10.509 1.00 . A A . 10 GLY HA3 1 1 15 4755 1 1 10 GLY N N -9.354 -0.461 11.098 1.00 . A A . 10 GLY N 1 1 15 4756 1 1 10 GLY O O -8.297 1.672 8.494 1.00 . A A . 10 GLY O 1 1 15 4757 1 1 11 TYR C C -5.407 1.437 9.403 1.00 . A A . 11 TYR C 1 1 15 4758 1 1 11 TYR CA C -6.305 2.239 10.348 1.00 . A A . 11 TYR CA 1 1 15 4759 1 1 11 TYR CB C -5.598 2.390 11.696 1.00 . A A . 11 TYR CB 1 1 15 4760 1 1 11 TYR CD1 C -7.286 2.680 13.546 1.00 . A A . 11 TYR CD1 1 1 15 4761 1 1 11 TYR CD2 C -6.116 4.614 12.768 1.00 . A A . 11 TYR CD2 1 1 15 4762 1 1 11 TYR CE1 C -8.002 3.495 14.493 1.00 . A A . 11 TYR CE1 1 1 15 4763 1 1 11 TYR CE2 C -6.832 5.428 13.715 1.00 . A A . 11 TYR CE2 1 1 15 4764 1 1 11 TYR CG C -6.358 3.256 12.703 1.00 . A A . 11 TYR CG 1 1 15 4765 1 1 11 TYR CZ C -7.740 4.829 14.531 1.00 . A A . 11 TYR CZ 1 1 15 4766 1 1 11 TYR H H -7.656 1.227 11.568 1.00 . A A . 11 TYR H 1 1 15 4767 1 1 11 TYR HA H -6.560 3.188 9.876 1.00 . A A . 11 TYR HA 1 1 15 4768 1 1 11 TYR HB2 H -5.444 1.402 12.127 1.00 . A A . 11 TYR HB2 1 1 15 4769 1 1 11 TYR HB3 H -4.612 2.824 11.532 1.00 . A A . 11 TYR HB3 1 1 15 4770 1 1 11 TYR HD1 H -7.478 1.609 13.495 1.00 . A A . 11 TYR HD1 1 1 15 4771 1 1 11 TYR HD2 H -5.383 5.069 12.102 1.00 . A A . 11 TYR HD2 1 1 15 4772 1 1 11 TYR HE1 H -8.738 3.053 15.165 1.00 . A A . 11 TYR HE1 1 1 15 4773 1 1 11 TYR HE2 H -6.650 6.502 13.777 1.00 . A A . 11 TYR HE2 1 1 15 4774 1 1 11 TYR HH H -7.821 6.324 15.770 1.00 . A A . 11 TYR HH 1 1 15 4775 1 1 11 TYR N N -7.540 1.527 10.621 1.00 . A A . 11 TYR N 1 1 15 4776 1 1 11 TYR O O -5.480 0.210 9.364 1.00 . A A . 11 TYR O 1 1 15 4777 1 1 11 TYR OH O -8.415 5.598 15.426 1.00 . A A . 11 TYR OH 1 1 15 4778 1 1 12 MET C C -2.219 1.682 8.182 1.00 . A A . 12 MET C 1 1 15 4779 1 1 12 MET CA C -3.671 1.536 7.721 1.00 . A A . 12 MET CA 1 1 15 4780 1 1 12 MET CB C -3.837 2.181 6.344 1.00 . A A . 12 MET CB 1 1 15 4781 1 1 12 MET CE C -3.480 6.131 5.327 1.00 . A A . 12 MET CE 1 1 15 4782 1 1 12 MET CG C -3.993 3.698 6.463 1.00 . A A . 12 MET CG 1 1 15 4783 1 1 12 MET H H -4.528 3.162 8.702 1.00 . A A . 12 MET H 1 1 15 4784 1 1 12 MET HA H -3.949 0.482 7.703 1.00 . A A . 12 MET HA 1 1 15 4785 1 1 12 MET HB2 H -2.971 1.949 5.723 1.00 . A A . 12 MET HB2 1 1 15 4786 1 1 12 MET HB3 H -4.709 1.759 5.844 1.00 . A A . 12 MET HB3 1 1 15 4787 1 1 12 MET HE1 H -3.555 6.228 6.411 1.00 . A A . 12 MET HE1 1 1 15 4788 1 1 12 MET HE2 H -2.467 6.377 5.009 1.00 . A A . 12 MET HE2 1 1 15 4789 1 1 12 MET HE3 H -4.186 6.813 4.852 1.00 . A A . 12 MET HE3 1 1 15 4790 1 1 12 MET HG2 H -4.959 3.938 6.910 1.00 . A A . 12 MET HG2 1 1 15 4791 1 1 12 MET HG3 H -3.228 4.100 7.127 1.00 . A A . 12 MET HG3 1 1 15 4792 1 1 12 MET N N -4.582 2.164 8.664 1.00 . A A . 12 MET N 1 1 15 4793 1 1 12 MET O O -1.896 2.583 8.954 1.00 . A A . 12 MET O 1 1 15 4794 1 1 12 MET SD S -3.862 4.453 4.852 1.00 . A A . 12 MET SD 1 1 15 4795 1 1 13 ARG C C 0.837 1.500 6.947 1.00 . A A . 13 ARG C 1 1 15 4796 1 1 13 ARG CA C 0.028 0.797 8.038 1.00 . A A . 13 ARG CA 1 1 15 4797 1 1 13 ARG CB C 0.565 -0.623 8.228 1.00 . A A . 13 ARG CB 1 1 15 4798 1 1 13 ARG CD C 0.832 -1.793 10.446 1.00 . A A . 13 ARG CD 1 1 15 4799 1 1 13 ARG CG C -0.158 -1.334 9.373 1.00 . A A . 13 ARG CG 1 1 15 4800 1 1 13 ARG CZ C 0.476 -4.234 10.090 1.00 . A A . 13 ARG CZ 1 1 15 4801 1 1 13 ARG H H -1.653 0.050 7.061 1.00 . A A . 13 ARG H 1 1 15 4802 1 1 13 ARG HA H 0.075 1.348 8.978 1.00 . A A . 13 ARG HA 1 1 15 4803 1 1 13 ARG HB2 H 0.439 -1.189 7.305 1.00 . A A . 13 ARG HB2 1 1 15 4804 1 1 13 ARG HB3 H 1.635 -0.586 8.435 1.00 . A A . 13 ARG HB3 1 1 15 4805 1 1 13 ARG HD2 H 1.847 -1.773 10.048 1.00 . A A . 13 ARG HD2 1 1 15 4806 1 1 13 ARG HD3 H 0.807 -1.107 11.292 1.00 . A A . 13 ARG HD3 1 1 15 4807 1 1 13 ARG HE H 0.263 -3.296 11.859 1.00 . A A . 13 ARG HE 1 1 15 4808 1 1 13 ARG HG2 H -0.894 -0.664 9.816 1.00 . A A . 13 ARG HG2 1 1 15 4809 1 1 13 ARG HG3 H -0.703 -2.195 8.985 1.00 . A A . 13 ARG HG3 1 1 15 4810 1 1 13 ARG HH11 H 1.016 -3.204 8.422 1.00 . A A . 13 ARG HH11 1 1 15 4811 1 1 13 ARG HH12 H 0.764 -4.902 8.191 1.00 . A A . 13 ARG HH12 1 1 15 4812 1 1 13 ARG HH21 H -0.069 -5.536 11.554 1.00 . A A . 13 ARG HH21 1 1 15 4813 1 1 13 ARG HH22 H 0.143 -6.237 9.985 1.00 . A A . 13 ARG HH22 1 1 15 4814 1 1 13 ARG N N -1.382 0.780 7.688 1.00 . A A . 13 ARG N 1 1 15 4815 1 1 13 ARG NE N 0.493 -3.162 10.895 1.00 . A A . 13 ARG NE 1 1 15 4816 1 1 13 ARG NH1 N 0.777 -4.102 8.792 1.00 . A A . 13 ARG NH1 1 1 15 4817 1 1 13 ARG NH2 N 0.156 -5.438 10.585 1.00 . A A . 13 ARG NH2 1 1 15 4818 1 1 13 ARG O O 1.083 0.929 5.886 1.00 . A A . 13 ARG O 1 1 15 4819 1 1 14 THR C C 3.365 2.860 6.049 1.00 . A A . 14 THR C 1 1 15 4820 1 1 14 THR CA C 2.006 3.518 6.300 1.00 . A A . 14 THR CA 1 1 15 4821 1 1 14 THR CB C 2.112 4.943 6.848 1.00 . A A . 14 THR CB 1 1 15 4822 1 1 14 THR CG2 C 0.771 5.679 6.829 1.00 . A A . 14 THR CG2 1 1 15 4823 1 1 14 THR H H 1.027 3.189 8.110 1.00 . A A . 14 THR H 1 1 15 4824 1 1 14 THR HA H 1.476 3.532 5.349 1.00 . A A . 14 THR HA 1 1 15 4825 1 1 14 THR HB H 2.876 5.508 6.314 1.00 . A A . 14 THR HB 1 1 15 4826 1 1 14 THR HG1 H 3.179 4.158 8.350 1.00 . A A . 14 THR HG1 1 1 15 4827 1 1 14 THR HG21 H -0.027 4.986 7.093 1.00 . A A . 14 THR HG21 1 1 15 4828 1 1 14 THR HG22 H 0.796 6.496 7.549 1.00 . A A . 14 THR HG22 1 1 15 4829 1 1 14 THR HG23 H 0.591 6.078 5.832 1.00 . A A . 14 THR HG23 1 1 15 4830 1 1 14 THR N N 1.230 2.731 7.245 1.00 . A A . 14 THR N 1 1 15 4831 1 1 14 THR O O 3.584 1.713 6.435 1.00 . A A . 14 THR O 1 1 15 4832 1 1 14 THR OG1 O 2.391 4.762 8.234 1.00 . A A . 14 THR OG1 1 1 15 4833 1 1 15 ALA C C 6.493 3.371 6.290 1.00 . A A . 15 ALA C 1 1 15 4834 1 1 15 ALA CA C 5.572 3.121 5.095 1.00 . A A . 15 ALA CA 1 1 15 4835 1 1 15 ALA CB C 6.082 3.788 3.815 1.00 . A A . 15 ALA CB 1 1 15 4836 1 1 15 ALA H H 4.054 4.548 5.092 1.00 . A A . 15 ALA H 1 1 15 4837 1 1 15 ALA HA H 5.496 2.047 4.925 1.00 . A A . 15 ALA HA 1 1 15 4838 1 1 15 ALA HB1 H 5.685 4.802 3.752 1.00 . A A . 15 ALA HB1 1 1 15 4839 1 1 15 ALA HB2 H 7.170 3.824 3.834 1.00 . A A . 15 ALA HB2 1 1 15 4840 1 1 15 ALA HB3 H 5.751 3.213 2.951 1.00 . A A . 15 ALA HB3 1 1 15 4841 1 1 15 ALA N N 4.241 3.616 5.403 1.00 . A A . 15 ALA N 1 1 15 4842 1 1 15 ALA O O 7.705 3.185 6.194 1.00 . A A . 15 ALA O 1 1 15 4843 1 1 16 ASP C C 6.236 3.062 9.685 1.00 . A A . 16 ASP C 1 1 15 4844 1 1 16 ASP CA C 6.634 4.068 8.602 1.00 . A A . 16 ASP CA 1 1 15 4845 1 1 16 ASP CB C 6.331 5.472 9.128 1.00 . A A . 16 ASP CB 1 1 15 4846 1 1 16 ASP CG C 7.275 6.567 8.627 1.00 . A A . 16 ASP CG 1 1 15 4847 1 1 16 ASP H H 4.897 3.939 7.459 1.00 . A A . 16 ASP H 1 1 15 4848 1 1 16 ASP HA H 7.682 3.980 8.317 1.00 . A A . 16 ASP HA 1 1 15 4849 1 1 16 ASP HB2 H 5.311 5.736 8.848 1.00 . A A . 16 ASP HB2 1 1 15 4850 1 1 16 ASP HB3 H 6.368 5.452 10.217 1.00 . A A . 16 ASP HB3 1 1 15 4851 1 1 16 ASP N N 5.883 3.790 7.389 1.00 . A A . 16 ASP N 1 1 15 4852 1 1 16 ASP O O 6.981 2.846 10.640 1.00 . A A . 16 ASP O 1 1 15 4853 1 1 16 ASP OD1 O 8.488 6.278 8.548 1.00 . A A . 16 ASP OD1 1 1 15 4854 1 1 16 ASP OD2 O 6.761 7.669 8.334 1.00 . A A . 16 ASP OD2 1 1 15 4855 1 1 17 GLY C C 3.528 2.126 11.388 1.00 . A A . 17 GLY C 1 1 15 4856 1 1 17 GLY CA C 4.558 1.496 10.449 1.00 . A A . 17 GLY CA 1 1 15 4857 1 1 17 GLY H H 4.464 2.655 8.720 1.00 . A A . 17 GLY H 1 1 15 4858 1 1 17 GLY HA2 H 4.104 0.663 9.911 1.00 . A A . 17 GLY HA2 1 1 15 4859 1 1 17 GLY HA3 H 5.385 1.088 11.030 1.00 . A A . 17 GLY HA3 1 1 15 4860 1 1 17 GLY N N 5.063 2.474 9.499 1.00 . A A . 17 GLY N 1 1 15 4861 1 1 17 GLY O O 2.974 1.448 12.252 1.00 . A A . 17 GLY O 1 1 15 4862 1 1 18 ARG C C 0.926 3.920 11.493 1.00 . A A . 18 ARG C 1 1 15 4863 1 1 18 ARG CA C 2.350 4.146 12.007 1.00 . A A . 18 ARG CA 1 1 15 4864 1 1 18 ARG CB C 2.654 5.645 12.003 1.00 . A A . 18 ARG CB 1 1 15 4865 1 1 18 ARG CD C 4.596 7.206 11.616 1.00 . A A . 18 ARG CD 1 1 15 4866 1 1 18 ARG CG C 4.137 5.904 12.276 1.00 . A A . 18 ARG CG 1 1 15 4867 1 1 18 ARG CZ C 4.966 9.558 12.353 1.00 . A A . 18 ARG CZ 1 1 15 4868 1 1 18 ARG H H 3.758 3.961 10.483 1.00 . A A . 18 ARG H 1 1 15 4869 1 1 18 ARG HA H 2.474 3.737 13.010 1.00 . A A . 18 ARG HA 1 1 15 4870 1 1 18 ARG HB2 H 2.378 6.073 11.039 1.00 . A A . 18 ARG HB2 1 1 15 4871 1 1 18 ARG HB3 H 2.048 6.144 12.759 1.00 . A A . 18 ARG HB3 1 1 15 4872 1 1 18 ARG HD2 H 5.547 7.049 11.106 1.00 . A A . 18 ARG HD2 1 1 15 4873 1 1 18 ARG HD3 H 3.875 7.514 10.859 1.00 . A A . 18 ARG HD3 1 1 15 4874 1 1 18 ARG HE H 4.666 8.006 13.600 1.00 . A A . 18 ARG HE 1 1 15 4875 1 1 18 ARG HG2 H 4.308 5.957 13.351 1.00 . A A . 18 ARG HG2 1 1 15 4876 1 1 18 ARG HG3 H 4.731 5.072 11.899 1.00 . A A . 18 ARG HG3 1 1 15 4877 1 1 18 ARG HH11 H 4.985 9.287 10.338 1.00 . A A . 18 ARG HH11 1 1 15 4878 1 1 18 ARG HH12 H 5.241 10.917 10.866 1.00 . A A . 18 ARG HH12 1 1 15 4879 1 1 18 ARG HH21 H 5.003 10.156 14.297 1.00 . A A . 18 ARG HH21 1 1 15 4880 1 1 18 ARG HH22 H 5.251 11.414 13.133 1.00 . A A . 18 ARG HH22 1 1 15 4881 1 1 18 ARG N N 3.303 3.416 11.188 1.00 . A A . 18 ARG N 1 1 15 4882 1 1 18 ARG NE N 4.741 8.267 12.637 1.00 . A A . 18 ARG NE 1 1 15 4883 1 1 18 ARG NH1 N 5.073 9.954 11.078 1.00 . A A . 18 ARG NH1 1 1 15 4884 1 1 18 ARG NH2 N 5.083 10.451 13.345 1.00 . A A . 18 ARG NH2 1 1 15 4885 1 1 18 ARG O O 0.571 4.388 10.412 1.00 . A A . 18 ARG O 1 1 15 4886 1 1 19 CYS C C -1.962 4.234 11.718 1.00 . A A . 19 CYS C 1 1 15 4887 1 1 19 CYS CA C -1.227 2.908 11.930 1.00 . A A . 19 CYS CA 1 1 15 4888 1 1 19 CYS CB C -1.915 2.036 12.982 1.00 . A A . 19 CYS CB 1 1 15 4889 1 1 19 CYS H H 0.445 2.825 13.169 1.00 . A A . 19 CYS H 1 1 15 4890 1 1 19 CYS HA H -1.192 2.334 11.005 1.00 . A A . 19 CYS HA 1 1 15 4891 1 1 19 CYS HB2 H -1.707 2.450 13.968 1.00 . A A . 19 CYS HB2 1 1 15 4892 1 1 19 CYS HB3 H -2.993 2.094 12.833 1.00 . A A . 19 CYS HB3 1 1 15 4893 1 1 19 CYS N N 0.149 3.202 12.291 1.00 . A A . 19 CYS N 1 1 15 4894 1 1 19 CYS O O -2.414 4.857 12.678 1.00 . A A . 19 CYS O 1 1 15 4895 1 1 19 CYS SG S -1.414 0.276 12.967 1.00 . A A . 19 CYS SG 1 1 15 4896 1 1 20 LYS C C -4.205 5.583 9.828 1.00 . A A . 20 LYS C 1 1 15 4897 1 1 20 LYS CA C -2.728 5.868 10.108 1.00 . A A . 20 LYS CA 1 1 15 4898 1 1 20 LYS CB C -2.005 6.561 8.951 1.00 . A A . 20 LYS CB 1 1 15 4899 1 1 20 LYS CD C -0.841 8.713 8.343 1.00 . A A . 20 LYS CD 1 1 15 4900 1 1 20 LYS CE C 0.597 9.229 8.430 1.00 . A A . 20 LYS CE 1 1 15 4901 1 1 20 LYS CG C -1.132 7.709 9.460 1.00 . A A . 20 LYS CG 1 1 15 4902 1 1 20 LYS H H -1.688 4.114 9.682 1.00 . A A . 20 LYS H 1 1 15 4903 1 1 20 LYS HA H -2.662 6.529 10.972 1.00 . A A . 20 LYS HA 1 1 15 4904 1 1 20 LYS HB2 H -1.388 5.838 8.418 1.00 . A A . 20 LYS HB2 1 1 15 4905 1 1 20 LYS HB3 H -2.736 6.943 8.238 1.00 . A A . 20 LYS HB3 1 1 15 4906 1 1 20 LYS HD2 H -1.003 8.241 7.374 1.00 . A A . 20 LYS HD2 1 1 15 4907 1 1 20 LYS HD3 H -1.536 9.550 8.410 1.00 . A A . 20 LYS HD3 1 1 15 4908 1 1 20 LYS HE2 H 0.594 10.290 8.681 1.00 . A A . 20 LYS HE2 1 1 15 4909 1 1 20 LYS HE3 H 1.126 8.714 9.232 1.00 . A A . 20 LYS HE3 1 1 15 4910 1 1 20 LYS HG2 H -1.633 8.214 10.286 1.00 . A A . 20 LYS HG2 1 1 15 4911 1 1 20 LYS HG3 H -0.195 7.312 9.851 1.00 . A A . 20 LYS HG3 1 1 15 4912 1 1 20 LYS HZ1 H 1.148 8.082 6.831 1.00 . A A . 20 LYS HZ1 1 1 15 4913 1 1 20 LYS HZ2 H 0.954 9.662 6.465 1.00 . A A . 20 LYS HZ2 1 1 15 4914 1 1 20 LYS HZ3 H 2.283 9.170 7.276 1.00 . A A . 20 LYS HZ3 1 1 15 4915 1 1 20 LYS N N -2.058 4.627 10.457 1.00 . A A . 20 LYS N 1 1 15 4916 1 1 20 LYS NZ N 1.303 9.019 7.147 1.00 . A A . 20 LYS NZ 1 1 15 4917 1 1 20 LYS O O -4.608 4.426 9.717 1.00 . A A . 20 LYS O 1 1 15 4918 1 1 21 PRO C C -6.673 6.196 7.991 1.00 . A A . 21 PRO C 1 1 15 4919 1 1 21 PRO CA C -6.416 6.567 9.454 1.00 . A A . 21 PRO CA 1 1 15 4920 1 1 21 PRO CB C -7.003 7.916 9.836 1.00 . A A . 21 PRO CB 1 1 15 4921 1 1 21 PRO CD C -4.550 8.072 9.844 1.00 . A A . 21 PRO CD 1 1 15 4922 1 1 21 PRO CG C -5.834 8.887 9.859 1.00 . A A . 21 PRO CG 1 1 15 4923 1 1 21 PRO HA H -6.810 5.824 9.996 1.00 . A A . 21 PRO HA 1 1 15 4924 1 1 21 PRO HB2 H -7.759 8.232 9.117 1.00 . A A . 21 PRO HB2 1 1 15 4925 1 1 21 PRO HB3 H -7.491 7.867 10.811 1.00 . A A . 21 PRO HB3 1 1 15 4926 1 1 21 PRO HD2 H -3.909 8.360 9.010 1.00 . A A . 21 PRO HD2 1 1 15 4927 1 1 21 PRO HD3 H -3.975 8.223 10.756 1.00 . A A . 21 PRO HD3 1 1 15 4928 1 1 21 PRO HG2 H -5.874 9.553 8.998 1.00 . A A . 21 PRO HG2 1 1 15 4929 1 1 21 PRO HG3 H -5.877 9.515 10.750 1.00 . A A . 21 PRO HG3 1 1 15 4930 1 1 21 PRO N N -4.993 6.686 9.718 1.00 . A A . 21 PRO N 1 1 15 4931 1 1 21 PRO O O -5.945 6.630 7.100 1.00 . A A . 21 PRO O 1 1 15 4932 1 1 22 THR C C -9.361 5.655 5.996 1.00 . A A . 22 THR C 1 1 15 4933 1 1 22 THR CA C -8.073 4.965 6.451 1.00 . A A . 22 THR CA 1 1 15 4934 1 1 22 THR CB C -8.172 3.438 6.459 1.00 . A A . 22 THR CB 1 1 15 4935 1 1 22 THR CG2 C -8.131 2.841 5.051 1.00 . A A . 22 THR CG2 1 1 15 4936 1 1 22 THR H H -8.299 5.050 8.520 1.00 . A A . 22 THR H 1 1 15 4937 1 1 22 THR HA H -7.285 5.275 5.764 1.00 . A A . 22 THR HA 1 1 15 4938 1 1 22 THR HB H -9.062 3.108 6.995 1.00 . A A . 22 THR HB 1 1 15 4939 1 1 22 THR HG1 H -6.812 3.479 7.926 1.00 . A A . 22 THR HG1 1 1 15 4940 1 1 22 THR HG21 H -7.442 3.418 4.432 1.00 . A A . 22 THR HG21 1 1 15 4941 1 1 22 THR HG22 H -7.792 1.807 5.104 1.00 . A A . 22 THR HG22 1 1 15 4942 1 1 22 THR HG23 H -9.128 2.875 4.612 1.00 . A A . 22 THR HG23 1 1 15 4943 1 1 22 THR N N -7.711 5.398 7.790 1.00 . A A . 22 THR N 1 1 15 4944 1 1 22 THR O O -9.916 5.316 4.952 1.00 . A A . 22 THR O 1 1 15 4945 1 1 22 THR OG1 O -6.947 3.014 7.052 1.00 . A A . 22 THR OG1 1 1 15 4946 1 1 23 PHE C C -10.680 8.725 5.911 1.00 . A A . 23 PHE C 1 1 15 4947 1 1 23 PHE CA C -11.011 7.351 6.498 1.00 . A A . 23 PHE CA 1 1 15 4948 1 1 23 PHE CB C -11.764 7.539 7.815 1.00 . A A . 23 PHE CB 1 1 15 4949 1 1 23 PHE CD1 C -10.473 9.430 8.830 1.00 . A A . 23 PHE CD1 1 1 15 4950 1 1 23 PHE CD2 C -10.610 7.411 10.034 1.00 . A A . 23 PHE CD2 1 1 15 4951 1 1 23 PHE CE1 C -9.687 9.997 9.868 1.00 . A A . 23 PHE CE1 1 1 15 4952 1 1 23 PHE CE2 C -9.824 7.978 11.072 1.00 . A A . 23 PHE CE2 1 1 15 4953 1 1 23 PHE CG C -10.918 8.150 8.935 1.00 . A A . 23 PHE CG 1 1 15 4954 1 1 23 PHE CZ C -9.380 9.258 10.967 1.00 . A A . 23 PHE CZ 1 1 15 4955 1 1 23 PHE H H -9.341 6.880 7.651 1.00 . A A . 23 PHE H 1 1 15 4956 1 1 23 PHE HA H -11.569 6.769 5.763 1.00 . A A . 23 PHE HA 1 1 15 4957 1 1 23 PHE HB2 H -12.630 8.178 7.639 1.00 . A A . 23 PHE HB2 1 1 15 4958 1 1 23 PHE HB3 H -12.144 6.574 8.147 1.00 . A A . 23 PHE HB3 1 1 15 4959 1 1 23 PHE HD1 H -10.720 10.023 7.948 1.00 . A A . 23 PHE HD1 1 1 15 4960 1 1 23 PHE HD2 H -10.966 6.384 10.118 1.00 . A A . 23 PHE HD2 1 1 15 4961 1 1 23 PHE HE1 H -9.331 11.024 9.784 1.00 . A A . 23 PHE HE1 1 1 15 4962 1 1 23 PHE HE2 H -9.578 7.385 11.954 1.00 . A A . 23 PHE HE2 1 1 15 4963 1 1 23 PHE HZ H -8.776 9.694 11.765 1.00 . A A . 23 PHE HZ 1 1 15 4964 1 1 23 PHE N N -9.799 6.611 6.803 1.00 . A A . 23 PHE N 1 1 15 4965 1 1 23 PHE O O -10.434 8.850 4.712 1.00 . A A . 23 PHE O 1 1 16 4966 1 1 1 GLU C C -7.592 -12.983 13.162 1.00 . A A . 1 GLU C 1 1 16 4967 1 1 1 GLU CA C -9.096 -13.205 12.993 1.00 . A A . 1 GLU CA 1 1 16 4968 1 1 1 GLU CB C -9.891 -12.374 14.002 1.00 . A A . 1 GLU CB 1 1 16 4969 1 1 1 GLU CD C -11.977 -11.770 12.721 1.00 . A A . 1 GLU CD 1 1 16 4970 1 1 1 GLU CG C -10.661 -11.252 13.302 1.00 . A A . 1 GLU CG 1 1 16 4971 1 1 1 GLU HA H -9.400 -12.928 11.983 1.00 . A A . 1 GLU HA 1 1 16 4972 1 1 1 GLU HB2 H -10.587 -13.017 14.540 1.00 . A A . 1 GLU HB2 1 1 16 4973 1 1 1 GLU HB3 H -9.213 -11.948 14.741 1.00 . A A . 1 GLU HB3 1 1 16 4974 1 1 1 GLU HG2 H -10.863 -10.449 14.011 1.00 . A A . 1 GLU HG2 1 1 16 4975 1 1 1 GLU HG3 H -10.049 -10.828 12.506 1.00 . A A . 1 GLU HG3 1 1 16 4976 1 1 1 GLU N N -9.414 -14.618 13.117 1.00 . A A . 1 GLU N 1 1 16 4977 1 1 1 GLU O O -7.007 -13.405 14.158 1.00 . A A . 1 GLU O 1 1 16 4978 1 1 1 GLU OE1 O -12.546 -12.695 13.340 1.00 . A A . 1 GLU OE1 1 1 16 4979 1 1 1 GLU OE2 O -12.386 -11.230 11.670 1.00 . A A . 1 GLU OE2 1 1 16 4980 1 1 2 ASN C C -5.368 -10.524 12.100 1.00 . A A . 2 ASN C 1 1 16 4981 1 1 2 ASN CA C -5.585 -12.035 12.201 1.00 . A A . 2 ASN CA 1 1 16 4982 1 1 2 ASN CB C -4.869 -12.695 11.019 1.00 . A A . 2 ASN CB 1 1 16 4983 1 1 2 ASN CG C -4.978 -14.219 11.095 1.00 . A A . 2 ASN CG 1 1 16 4984 1 1 2 ASN H H -7.493 -11.979 11.366 1.00 . A A . 2 ASN H 1 1 16 4985 1 1 2 ASN HA H -5.229 -12.446 13.145 1.00 . A A . 2 ASN HA 1 1 16 4986 1 1 2 ASN HB2 H -5.302 -12.341 10.084 1.00 . A A . 2 ASN HB2 1 1 16 4987 1 1 2 ASN HB3 H -3.819 -12.400 11.017 1.00 . A A . 2 ASN HB3 1 1 16 4988 1 1 2 ASN HD21 H -4.000 -14.329 9.325 1.00 . A A . 2 ASN HD21 1 1 16 4989 1 1 2 ASN HD22 H -4.451 -15.851 10.017 1.00 . A A . 2 ASN HD22 1 1 16 4990 1 1 2 ASN N N -7.010 -12.320 12.173 1.00 . A A . 2 ASN N 1 1 16 4991 1 1 2 ASN ND2 N -4.431 -14.851 10.061 1.00 . A A . 2 ASN ND2 1 1 16 4992 1 1 2 ASN O O -6.030 -9.850 11.312 1.00 . A A . 2 ASN O 1 1 16 4993 1 1 2 ASN OD1 O -5.521 -14.784 12.030 1.00 . A A . 2 ASN OD1 1 1 16 4994 1 1 3 PHE C C -3.635 -8.152 11.552 1.00 . A A . 3 PHE C 1 1 16 4995 1 1 3 PHE CA C -4.129 -8.617 12.923 1.00 . A A . 3 PHE CA 1 1 16 4996 1 1 3 PHE CB C -3.015 -8.413 13.951 1.00 . A A . 3 PHE CB 1 1 16 4997 1 1 3 PHE CD1 C -1.151 -9.549 12.723 1.00 . A A . 3 PHE CD1 1 1 16 4998 1 1 3 PHE CD2 C -1.626 -10.258 14.919 1.00 . A A . 3 PHE CD2 1 1 16 4999 1 1 3 PHE CE1 C -0.107 -10.507 12.640 1.00 . A A . 3 PHE CE1 1 1 16 5000 1 1 3 PHE CE2 C -0.582 -11.217 14.836 1.00 . A A . 3 PHE CE2 1 1 16 5001 1 1 3 PHE CG C -1.889 -9.444 13.861 1.00 . A A . 3 PHE CG 1 1 16 5002 1 1 3 PHE CZ C 0.156 -11.320 13.697 1.00 . A A . 3 PHE CZ 1 1 16 5003 1 1 3 PHE H H -3.908 -10.591 13.549 1.00 . A A . 3 PHE H 1 1 16 5004 1 1 3 PHE HA H -5.048 -8.087 13.175 1.00 . A A . 3 PHE HA 1 1 16 5005 1 1 3 PHE HB2 H -2.592 -7.417 13.819 1.00 . A A . 3 PHE HB2 1 1 16 5006 1 1 3 PHE HB3 H -3.447 -8.446 14.951 1.00 . A A . 3 PHE HB3 1 1 16 5007 1 1 3 PHE HD1 H -1.362 -8.897 11.875 1.00 . A A . 3 PHE HD1 1 1 16 5008 1 1 3 PHE HD2 H -2.218 -10.175 15.830 1.00 . A A . 3 PHE HD2 1 1 16 5009 1 1 3 PHE HE1 H 0.485 -10.591 11.728 1.00 . A A . 3 PHE HE1 1 1 16 5010 1 1 3 PHE HE2 H -0.371 -11.869 15.683 1.00 . A A . 3 PHE HE2 1 1 16 5011 1 1 3 PHE HZ H 0.958 -12.056 13.634 1.00 . A A . 3 PHE HZ 1 1 16 5012 1 1 3 PHE N N -4.441 -10.036 12.910 1.00 . A A . 3 PHE N 1 1 16 5013 1 1 3 PHE O O -3.233 -8.967 10.723 1.00 . A A . 3 PHE O 1 1 16 5014 1 1 4 ASN C C -1.958 -5.460 10.333 1.00 . A A . 4 ASN C 1 1 16 5015 1 1 4 ASN CA C -3.241 -6.259 10.098 1.00 . A A . 4 ASN CA 1 1 16 5016 1 1 4 ASN CB C -4.296 -5.304 9.537 1.00 . A A . 4 ASN CB 1 1 16 5017 1 1 4 ASN CG C -3.813 -4.655 8.239 1.00 . A A . 4 ASN CG 1 1 16 5018 1 1 4 ASN H H -4.008 -6.185 12.034 1.00 . A A . 4 ASN H 1 1 16 5019 1 1 4 ASN HA H -3.091 -7.105 9.428 1.00 . A A . 4 ASN HA 1 1 16 5020 1 1 4 ASN HB2 H -5.223 -5.848 9.352 1.00 . A A . 4 ASN HB2 1 1 16 5021 1 1 4 ASN HB3 H -4.522 -4.532 10.272 1.00 . A A . 4 ASN HB3 1 1 16 5022 1 1 4 ASN HD21 H -3.839 -2.863 9.180 1.00 . A A . 4 ASN HD21 1 1 16 5023 1 1 4 ASN HD22 H -3.334 -2.823 7.523 1.00 . A A . 4 ASN HD22 1 1 16 5024 1 1 4 ASN N N -3.680 -6.843 11.355 1.00 . A A . 4 ASN N 1 1 16 5025 1 1 4 ASN ND2 N -3.648 -3.337 8.321 1.00 . A A . 4 ASN ND2 1 1 16 5026 1 1 4 ASN O O -1.852 -4.311 9.909 1.00 . A A . 4 ASN O 1 1 16 5027 1 1 4 ASN OD1 O -3.602 -5.307 7.229 1.00 . A A . 4 ASN OD1 1 1 16 5028 1 1 5 GLY C C 0.330 -5.040 12.771 1.00 . A A . 5 GLY C 1 1 16 5029 1 1 5 GLY CA C 0.258 -5.465 11.302 1.00 . A A . 5 GLY CA 1 1 16 5030 1 1 5 GLY H H -1.109 -7.037 11.349 1.00 . A A . 5 GLY H 1 1 16 5031 1 1 5 GLY HA2 H 1.074 -6.154 11.079 1.00 . A A . 5 GLY HA2 1 1 16 5032 1 1 5 GLY HA3 H 0.391 -4.595 10.661 1.00 . A A . 5 GLY HA3 1 1 16 5033 1 1 5 GLY N N -1.014 -6.102 11.007 1.00 . A A . 5 GLY N 1 1 16 5034 1 1 5 GLY O O 1.384 -5.136 13.397 1.00 . A A . 5 GLY O 1 1 16 5035 1 1 6 GLY C C -1.663 -2.827 14.773 1.00 . A A . 6 GLY C 1 1 16 5036 1 1 6 GLY CA C -0.883 -4.139 14.659 1.00 . A A . 6 GLY CA 1 1 16 5037 1 1 6 GLY H H -1.657 -4.504 12.760 1.00 . A A . 6 GLY H 1 1 16 5038 1 1 6 GLY HA2 H -1.365 -4.907 15.262 1.00 . A A . 6 GLY HA2 1 1 16 5039 1 1 6 GLY HA3 H 0.123 -4.003 15.058 1.00 . A A . 6 GLY HA3 1 1 16 5040 1 1 6 GLY N N -0.804 -4.578 13.276 1.00 . A A . 6 GLY N 1 1 16 5041 1 1 6 GLY O O -1.188 -1.868 15.377 1.00 . A A . 6 GLY O 1 1 16 5042 1 1 7 CYS C C -4.914 -1.959 15.093 1.00 . A A . 7 CYS C 1 1 16 5043 1 1 7 CYS CA C -3.702 -1.653 14.211 1.00 . A A . 7 CYS CA 1 1 16 5044 1 1 7 CYS CB C -4.114 -1.220 12.803 1.00 . A A . 7 CYS CB 1 1 16 5045 1 1 7 CYS H H -3.230 -3.615 13.694 1.00 . A A . 7 CYS H 1 1 16 5046 1 1 7 CYS HA H -3.107 -0.845 14.638 1.00 . A A . 7 CYS HA 1 1 16 5047 1 1 7 CYS HB2 H -4.423 -2.102 12.242 1.00 . A A . 7 CYS HB2 1 1 16 5048 1 1 7 CYS HB3 H -4.986 -0.570 12.879 1.00 . A A . 7 CYS HB3 1 1 16 5049 1 1 7 CYS N N -2.850 -2.831 14.183 1.00 . A A . 7 CYS N 1 1 16 5050 1 1 7 CYS O O -5.048 -3.067 15.609 1.00 . A A . 7 CYS O 1 1 16 5051 1 1 7 CYS SG S -2.814 -0.349 11.856 1.00 . A A . 7 CYS SG 1 1 16 5052 1 1 8 LEU C C -8.069 -1.747 15.207 1.00 . A A . 8 LEU C 1 1 16 5053 1 1 8 LEU CA C -6.965 -1.103 16.048 1.00 . A A . 8 LEU CA 1 1 16 5054 1 1 8 LEU CB C -7.365 0.239 16.663 1.00 . A A . 8 LEU CB 1 1 16 5055 1 1 8 LEU CD1 C -8.705 -0.706 18.580 1.00 . A A . 8 LEU CD1 1 1 16 5056 1 1 8 LEU CD2 C -9.065 1.691 17.830 1.00 . A A . 8 LEU CD2 1 1 16 5057 1 1 8 LEU CG C -8.706 0.267 17.399 1.00 . A A . 8 LEU CG 1 1 16 5058 1 1 8 LEU H H -5.653 -0.058 14.815 1.00 . A A . 8 LEU H 1 1 16 5059 1 1 8 LEU HA H -6.722 -1.775 16.871 1.00 . A A . 8 LEU HA 1 1 16 5060 1 1 8 LEU HB2 H -6.584 0.544 17.361 1.00 . A A . 8 LEU HB2 1 1 16 5061 1 1 8 LEU HB3 H -7.392 0.986 15.870 1.00 . A A . 8 LEU HB3 1 1 16 5062 1 1 8 LEU HD11 H -7.915 -1.445 18.440 1.00 . A A . 8 LEU HD11 1 1 16 5063 1 1 8 LEU HD12 H -8.528 -0.156 19.504 1.00 . A A . 8 LEU HD12 1 1 16 5064 1 1 8 LEU HD13 H -9.669 -1.211 18.636 1.00 . A A . 8 LEU HD13 1 1 16 5065 1 1 8 LEU HD21 H -8.152 2.262 17.994 1.00 . A A . 8 LEU HD21 1 1 16 5066 1 1 8 LEU HD22 H -9.658 2.168 17.049 1.00 . A A . 8 LEU HD22 1 1 16 5067 1 1 8 LEU HD23 H -9.642 1.656 18.754 1.00 . A A . 8 LEU HD23 1 1 16 5068 1 1 8 LEU HG H -9.481 -0.065 16.708 1.00 . A A . 8 LEU HG 1 1 16 5069 1 1 8 LEU N N -5.769 -0.956 15.238 1.00 . A A . 8 LEU N 1 1 16 5070 1 1 8 LEU O O -8.628 -2.774 15.590 1.00 . A A . 8 LEU O 1 1 16 5071 1 1 9 ALA C C -9.794 -0.500 12.217 1.00 . A A . 9 ALA C 1 1 16 5072 1 1 9 ALA CA C -9.378 -1.615 13.178 1.00 . A A . 9 ALA CA 1 1 16 5073 1 1 9 ALA CB C -10.556 -2.150 13.995 1.00 . A A . 9 ALA CB 1 1 16 5074 1 1 9 ALA H H -7.893 -0.282 13.772 1.00 . A A . 9 ALA H 1 1 16 5075 1 1 9 ALA HA H -8.948 -2.436 12.604 1.00 . A A . 9 ALA HA 1 1 16 5076 1 1 9 ALA HB1 H -10.502 -1.757 15.010 1.00 . A A . 9 ALA HB1 1 1 16 5077 1 1 9 ALA HB2 H -11.492 -1.835 13.532 1.00 . A A . 9 ALA HB2 1 1 16 5078 1 1 9 ALA HB3 H -10.514 -3.239 14.023 1.00 . A A . 9 ALA HB3 1 1 16 5079 1 1 9 ALA N N -8.351 -1.116 14.077 1.00 . A A . 9 ALA N 1 1 16 5080 1 1 9 ALA O O -10.561 0.388 12.585 1.00 . A A . 9 ALA O 1 1 16 5081 1 1 10 GLY C C -8.320 1.179 9.572 1.00 . A A . 10 GLY C 1 1 16 5082 1 1 10 GLY CA C -9.576 0.411 9.987 1.00 . A A . 10 GLY CA 1 1 16 5083 1 1 10 GLY H H -8.646 -1.307 10.711 1.00 . A A . 10 GLY H 1 1 16 5084 1 1 10 GLY HA2 H -10.011 -0.080 9.114 1.00 . A A . 10 GLY HA2 1 1 16 5085 1 1 10 GLY HA3 H -10.324 1.107 10.366 1.00 . A A . 10 GLY HA3 1 1 16 5086 1 1 10 GLY N N -9.269 -0.582 11.002 1.00 . A A . 10 GLY N 1 1 16 5087 1 1 10 GLY O O -8.121 1.462 8.392 1.00 . A A . 10 GLY O 1 1 16 5088 1 1 11 TYR C C -5.402 1.502 9.292 1.00 . A A . 11 TYR C 1 1 16 5089 1 1 11 TYR CA C -6.273 2.225 10.322 1.00 . A A . 11 TYR CA 1 1 16 5090 1 1 11 TYR CB C -5.531 2.265 11.661 1.00 . A A . 11 TYR CB 1 1 16 5091 1 1 11 TYR CD1 C -6.165 4.493 12.657 1.00 . A A . 11 TYR CD1 1 1 16 5092 1 1 11 TYR CD2 C -6.900 2.506 13.764 1.00 . A A . 11 TYR CD2 1 1 16 5093 1 1 11 TYR CE1 C -6.814 5.293 13.663 1.00 . A A . 11 TYR CE1 1 1 16 5094 1 1 11 TYR CE2 C -7.551 3.307 14.769 1.00 . A A . 11 TYR CE2 1 1 16 5095 1 1 11 TYR CG C -6.221 3.116 12.728 1.00 . A A . 11 TYR CG 1 1 16 5096 1 1 11 TYR CZ C -7.475 4.661 14.669 1.00 . A A . 11 TYR CZ 1 1 16 5097 1 1 11 TYR H H -7.673 1.261 11.525 1.00 . A A . 11 TYR H 1 1 16 5098 1 1 11 TYR HA H -6.536 3.210 9.936 1.00 . A A . 11 TYR HA 1 1 16 5099 1 1 11 TYR HB2 H -5.424 1.247 12.034 1.00 . A A . 11 TYR HB2 1 1 16 5100 1 1 11 TYR HB3 H -4.526 2.652 11.496 1.00 . A A . 11 TYR HB3 1 1 16 5101 1 1 11 TYR HD1 H -5.628 4.975 11.839 1.00 . A A . 11 TYR HD1 1 1 16 5102 1 1 11 TYR HD2 H -6.946 1.419 13.820 1.00 . A A . 11 TYR HD2 1 1 16 5103 1 1 11 TYR HE1 H -6.777 6.382 13.618 1.00 . A A . 11 TYR HE1 1 1 16 5104 1 1 11 TYR HE2 H -8.090 2.838 15.592 1.00 . A A . 11 TYR HE2 1 1 16 5105 1 1 11 TYR HH H -7.406 5.815 16.231 1.00 . A A . 11 TYR HH 1 1 16 5106 1 1 11 TYR N N -7.504 1.495 10.567 1.00 . A A . 11 TYR N 1 1 16 5107 1 1 11 TYR O O -5.504 0.287 9.133 1.00 . A A . 11 TYR O 1 1 16 5108 1 1 11 TYR OH O -8.088 5.417 15.618 1.00 . A A . 11 TYR OH 1 1 16 5109 1 1 12 MET C C -2.221 1.781 8.073 1.00 . A A . 12 MET C 1 1 16 5110 1 1 12 MET CA C -3.678 1.729 7.610 1.00 . A A . 12 MET CA 1 1 16 5111 1 1 12 MET CB C -3.830 2.521 6.310 1.00 . A A . 12 MET CB 1 1 16 5112 1 1 12 MET CE C -3.143 6.467 5.657 1.00 . A A . 12 MET CE 1 1 16 5113 1 1 12 MET CG C -3.935 4.021 6.590 1.00 . A A . 12 MET CG 1 1 16 5114 1 1 12 MET H H -4.490 3.268 8.756 1.00 . A A . 12 MET H 1 1 16 5115 1 1 12 MET HA H -3.989 0.692 7.482 1.00 . A A . 12 MET HA 1 1 16 5116 1 1 12 MET HB2 H -2.976 2.328 5.660 1.00 . A A . 12 MET HB2 1 1 16 5117 1 1 12 MET HB3 H -4.719 2.185 5.776 1.00 . A A . 12 MET HB3 1 1 16 5118 1 1 12 MET HE1 H -2.455 6.257 6.476 1.00 . A A . 12 MET HE1 1 1 16 5119 1 1 12 MET HE2 H -2.606 6.960 4.848 1.00 . A A . 12 MET HE2 1 1 16 5120 1 1 12 MET HE3 H -3.943 7.118 6.012 1.00 . A A . 12 MET HE3 1 1 16 5121 1 1 12 MET HG2 H -4.874 4.240 7.100 1.00 . A A . 12 MET HG2 1 1 16 5122 1 1 12 MET HG3 H -3.132 4.332 7.259 1.00 . A A . 12 MET HG3 1 1 16 5123 1 1 12 MET N N -4.566 2.280 8.620 1.00 . A A . 12 MET N 1 1 16 5124 1 1 12 MET O O -1.878 2.552 8.969 1.00 . A A . 12 MET O 1 1 16 5125 1 1 12 MET SD S -3.844 4.936 5.061 1.00 . A A . 12 MET SD 1 1 16 5126 1 1 13 ARG C C 0.826 1.724 6.786 1.00 . A A . 13 ARG C 1 1 16 5127 1 1 13 ARG CA C 0.010 0.894 7.780 1.00 . A A . 13 ARG CA 1 1 16 5128 1 1 13 ARG CB C 0.520 -0.548 7.770 1.00 . A A . 13 ARG CB 1 1 16 5129 1 1 13 ARG CD C 2.286 -1.648 9.195 1.00 . A A . 13 ARG CD 1 1 16 5130 1 1 13 ARG CG C 0.897 -1.006 9.180 1.00 . A A . 13 ARG CG 1 1 16 5131 1 1 13 ARG CZ C 3.738 -2.520 11.023 1.00 . A A . 13 ARG CZ 1 1 16 5132 1 1 13 ARG H H -1.690 0.328 6.716 1.00 . A A . 13 ARG H 1 1 16 5133 1 1 13 ARG HA H 0.074 1.311 8.785 1.00 . A A . 13 ARG HA 1 1 16 5134 1 1 13 ARG HB2 H -0.247 -1.206 7.363 1.00 . A A . 13 ARG HB2 1 1 16 5135 1 1 13 ARG HB3 H 1.387 -0.626 7.114 1.00 . A A . 13 ARG HB3 1 1 16 5136 1 1 13 ARG HD2 H 2.227 -2.670 8.822 1.00 . A A . 13 ARG HD2 1 1 16 5137 1 1 13 ARG HD3 H 2.955 -1.103 8.529 1.00 . A A . 13 ARG HD3 1 1 16 5138 1 1 13 ARG HE H 2.501 -0.942 11.204 1.00 . A A . 13 ARG HE 1 1 16 5139 1 1 13 ARG HG2 H 0.879 -0.154 9.860 1.00 . A A . 13 ARG HG2 1 1 16 5140 1 1 13 ARG HG3 H 0.159 -1.720 9.544 1.00 . A A . 13 ARG HG3 1 1 16 5141 1 1 13 ARG HH11 H 3.881 -3.536 9.268 1.00 . A A . 13 ARG HH11 1 1 16 5142 1 1 13 ARG HH12 H 4.884 -4.131 10.548 1.00 . A A . 13 ARG HH12 1 1 16 5143 1 1 13 ARG HH21 H 3.824 -1.726 12.894 1.00 . A A . 13 ARG HH21 1 1 16 5144 1 1 13 ARG HH22 H 4.852 -3.094 12.625 1.00 . A A . 13 ARG HH22 1 1 16 5145 1 1 13 ARG N N -1.403 0.952 7.443 1.00 . A A . 13 ARG N 1 1 16 5146 1 1 13 ARG NE N 2.831 -1.643 10.572 1.00 . A A . 13 ARG NE 1 1 16 5147 1 1 13 ARG NH1 N 4.207 -3.477 10.211 1.00 . A A . 13 ARG NH1 1 1 16 5148 1 1 13 ARG NH2 N 4.175 -2.440 12.287 1.00 . A A . 13 ARG NH2 1 1 16 5149 1 1 13 ARG O O 1.018 1.316 5.642 1.00 . A A . 13 ARG O 1 1 16 5150 1 1 14 THR C C 3.397 3.098 6.039 1.00 . A A . 14 THR C 1 1 16 5151 1 1 14 THR CA C 2.075 3.764 6.428 1.00 . A A . 14 THR CA 1 1 16 5152 1 1 14 THR CB C 2.259 5.080 7.185 1.00 . A A . 14 THR CB 1 1 16 5153 1 1 14 THR CG2 C 0.926 5.747 7.531 1.00 . A A . 14 THR CG2 1 1 16 5154 1 1 14 THR H H 1.123 3.198 8.192 1.00 . A A . 14 THR H 1 1 16 5155 1 1 14 THR HA H 1.527 3.948 5.504 1.00 . A A . 14 THR HA 1 1 16 5156 1 1 14 THR HB H 2.903 5.762 6.630 1.00 . A A . 14 THR HB 1 1 16 5157 1 1 14 THR HG1 H 3.169 5.477 8.923 1.00 . A A . 14 THR HG1 1 1 16 5158 1 1 14 THR HG21 H 0.262 5.702 6.667 1.00 . A A . 14 THR HG21 1 1 16 5159 1 1 14 THR HG22 H 0.466 5.226 8.371 1.00 . A A . 14 THR HG22 1 1 16 5160 1 1 14 THR HG23 H 1.099 6.788 7.802 1.00 . A A . 14 THR HG23 1 1 16 5161 1 1 14 THR N N 1.285 2.874 7.260 1.00 . A A . 14 THR N 1 1 16 5162 1 1 14 THR O O 3.551 1.886 6.186 1.00 . A A . 14 THR O 1 1 16 5163 1 1 14 THR OG1 O 2.787 4.684 8.448 1.00 . A A . 14 THR OG1 1 1 16 5164 1 1 15 ALA C C 6.533 3.333 6.364 1.00 . A A . 15 ALA C 1 1 16 5165 1 1 15 ALA CA C 5.618 3.423 5.141 1.00 . A A . 15 ALA CA 1 1 16 5166 1 1 15 ALA CB C 6.191 4.333 4.052 1.00 . A A . 15 ALA CB 1 1 16 5167 1 1 15 ALA H H 4.182 4.902 5.437 1.00 . A A . 15 ALA H 1 1 16 5168 1 1 15 ALA HA H 5.480 2.424 4.728 1.00 . A A . 15 ALA HA 1 1 16 5169 1 1 15 ALA HB1 H 5.399 4.971 3.659 1.00 . A A . 15 ALA HB1 1 1 16 5170 1 1 15 ALA HB2 H 6.982 4.952 4.474 1.00 . A A . 15 ALA HB2 1 1 16 5171 1 1 15 ALA HB3 H 6.598 3.722 3.246 1.00 . A A . 15 ALA HB3 1 1 16 5172 1 1 15 ALA N N 4.316 3.918 5.552 1.00 . A A . 15 ALA N 1 1 16 5173 1 1 15 ALA O O 7.698 2.956 6.246 1.00 . A A . 15 ALA O 1 1 16 5174 1 1 16 ASP C C 6.075 2.641 9.707 1.00 . A A . 16 ASP C 1 1 16 5175 1 1 16 ASP CA C 6.722 3.649 8.755 1.00 . A A . 16 ASP CA 1 1 16 5176 1 1 16 ASP CB C 6.719 5.016 9.440 1.00 . A A . 16 ASP CB 1 1 16 5177 1 1 16 ASP CG C 8.067 5.740 9.447 1.00 . A A . 16 ASP CG 1 1 16 5178 1 1 16 ASP H H 5.023 3.990 7.599 1.00 . A A . 16 ASP H 1 1 16 5179 1 1 16 ASP HA H 7.734 3.362 8.470 1.00 . A A . 16 ASP HA 1 1 16 5180 1 1 16 ASP HB2 H 5.985 5.652 8.945 1.00 . A A . 16 ASP HB2 1 1 16 5181 1 1 16 ASP HB3 H 6.387 4.889 10.471 1.00 . A A . 16 ASP HB3 1 1 16 5182 1 1 16 ASP N N 5.971 3.685 7.511 1.00 . A A . 16 ASP N 1 1 16 5183 1 1 16 ASP O O 6.642 2.312 10.747 1.00 . A A . 16 ASP O 1 1 16 5184 1 1 16 ASP OD1 O 8.833 5.522 8.483 1.00 . A A . 16 ASP OD1 1 1 16 5185 1 1 16 ASP OD2 O 8.302 6.494 10.416 1.00 . A A . 16 ASP OD2 1 1 16 5186 1 1 17 GLY C C 3.156 1.917 11.036 1.00 . A A . 17 GLY C 1 1 16 5187 1 1 17 GLY CA C 4.165 1.216 10.124 1.00 . A A . 17 GLY CA 1 1 16 5188 1 1 17 GLY H H 4.441 2.452 8.469 1.00 . A A . 17 GLY H 1 1 16 5189 1 1 17 GLY HA2 H 3.645 0.513 9.474 1.00 . A A . 17 GLY HA2 1 1 16 5190 1 1 17 GLY HA3 H 4.864 0.637 10.727 1.00 . A A . 17 GLY HA3 1 1 16 5191 1 1 17 GLY N N 4.896 2.179 9.317 1.00 . A A . 17 GLY N 1 1 16 5192 1 1 17 GLY O O 2.342 1.264 11.686 1.00 . A A . 17 GLY O 1 1 16 5193 1 1 18 ARG C C 0.899 3.832 11.434 1.00 . A A . 18 ARG C 1 1 16 5194 1 1 18 ARG CA C 2.349 4.037 11.876 1.00 . A A . 18 ARG CA 1 1 16 5195 1 1 18 ARG CB C 2.698 5.524 11.785 1.00 . A A . 18 ARG CB 1 1 16 5196 1 1 18 ARG CD C 4.327 5.717 13.701 1.00 . A A . 18 ARG CD 1 1 16 5197 1 1 18 ARG CG C 4.155 5.770 12.181 1.00 . A A . 18 ARG CG 1 1 16 5198 1 1 18 ARG CZ C 6.111 7.428 14.014 1.00 . A A . 18 ARG CZ 1 1 16 5199 1 1 18 ARG H H 3.909 3.763 10.522 1.00 . A A . 18 ARG H 1 1 16 5200 1 1 18 ARG HA H 2.505 3.673 12.891 1.00 . A A . 18 ARG HA 1 1 16 5201 1 1 18 ARG HB2 H 2.529 5.880 10.769 1.00 . A A . 18 ARG HB2 1 1 16 5202 1 1 18 ARG HB3 H 2.038 6.096 12.437 1.00 . A A . 18 ARG HB3 1 1 16 5203 1 1 18 ARG HD2 H 3.586 6.355 14.182 1.00 . A A . 18 ARG HD2 1 1 16 5204 1 1 18 ARG HD3 H 4.154 4.702 14.059 1.00 . A A . 18 ARG HD3 1 1 16 5205 1 1 18 ARG HE H 6.338 5.463 14.385 1.00 . A A . 18 ARG HE 1 1 16 5206 1 1 18 ARG HG2 H 4.795 5.023 11.713 1.00 . A A . 18 ARG HG2 1 1 16 5207 1 1 18 ARG HG3 H 4.477 6.743 11.810 1.00 . A A . 18 ARG HG3 1 1 16 5208 1 1 18 ARG HH11 H 4.340 8.162 13.334 1.00 . A A . 18 ARG HH11 1 1 16 5209 1 1 18 ARG HH12 H 5.591 9.340 13.557 1.00 . A A . 18 ARG HH12 1 1 16 5210 1 1 18 ARG HH21 H 7.988 7.016 14.680 1.00 . A A . 18 ARG HH21 1 1 16 5211 1 1 18 ARG HH22 H 7.679 8.684 14.328 1.00 . A A . 18 ARG HH22 1 1 16 5212 1 1 18 ARG N N 3.244 3.239 11.054 1.00 . A A . 18 ARG N 1 1 16 5213 1 1 18 ARG NE N 5.690 6.157 14.072 1.00 . A A . 18 ARG NE 1 1 16 5214 1 1 18 ARG NH1 N 5.277 8.392 13.600 1.00 . A A . 18 ARG NH1 1 1 16 5215 1 1 18 ARG NH2 N 7.365 7.735 14.371 1.00 . A A . 18 ARG NH2 1 1 16 5216 1 1 18 ARG O O 0.510 4.263 10.350 1.00 . A A . 18 ARG O 1 1 16 5217 1 1 19 CYS C C -1.983 4.250 11.857 1.00 . A A . 19 CYS C 1 1 16 5218 1 1 19 CYS CA C -1.262 2.909 12.009 1.00 . A A . 19 CYS CA 1 1 16 5219 1 1 19 CYS CB C -1.905 2.035 13.086 1.00 . A A . 19 CYS CB 1 1 16 5220 1 1 19 CYS H H 0.462 2.827 13.176 1.00 . A A . 19 CYS H 1 1 16 5221 1 1 19 CYS HA H -1.289 2.348 11.075 1.00 . A A . 19 CYS HA 1 1 16 5222 1 1 19 CYS HB2 H -1.737 2.498 14.058 1.00 . A A . 19 CYS HB2 1 1 16 5223 1 1 19 CYS HB3 H -2.982 2.015 12.924 1.00 . A A . 19 CYS HB3 1 1 16 5224 1 1 19 CYS N N 0.137 3.175 12.295 1.00 . A A . 19 CYS N 1 1 16 5225 1 1 19 CYS O O -2.332 4.888 12.850 1.00 . A A . 19 CYS O 1 1 16 5226 1 1 19 CYS SG S -1.289 0.312 13.144 1.00 . A A . 19 CYS SG 1 1 16 5227 1 1 20 LYS C C -4.317 5.611 9.947 1.00 . A A . 20 LYS C 1 1 16 5228 1 1 20 LYS CA C -2.858 5.893 10.312 1.00 . A A . 20 LYS CA 1 1 16 5229 1 1 20 LYS CB C -2.095 6.671 9.238 1.00 . A A . 20 LYS CB 1 1 16 5230 1 1 20 LYS CD C -0.075 7.770 10.273 1.00 . A A . 20 LYS CD 1 1 16 5231 1 1 20 LYS CE C 0.120 8.296 11.696 1.00 . A A . 20 LYS CE 1 1 16 5232 1 1 20 LYS CG C -1.518 7.969 9.807 1.00 . A A . 20 LYS CG 1 1 16 5233 1 1 20 LYS H H -1.900 4.114 9.805 1.00 . A A . 20 LYS H 1 1 16 5234 1 1 20 LYS HA H -2.840 6.495 11.221 1.00 . A A . 20 LYS HA 1 1 16 5235 1 1 20 LYS HB2 H -1.289 6.054 8.841 1.00 . A A . 20 LYS HB2 1 1 16 5236 1 1 20 LYS HB3 H -2.761 6.898 8.406 1.00 . A A . 20 LYS HB3 1 1 16 5237 1 1 20 LYS HD2 H 0.181 6.710 10.235 1.00 . A A . 20 LYS HD2 1 1 16 5238 1 1 20 LYS HD3 H 0.605 8.285 9.594 1.00 . A A . 20 LYS HD3 1 1 16 5239 1 1 20 LYS HE2 H -0.750 8.049 12.304 1.00 . A A . 20 LYS HE2 1 1 16 5240 1 1 20 LYS HE3 H 0.979 7.809 12.157 1.00 . A A . 20 LYS HE3 1 1 16 5241 1 1 20 LYS HG2 H -1.555 8.750 9.048 1.00 . A A . 20 LYS HG2 1 1 16 5242 1 1 20 LYS HG3 H -2.130 8.307 10.643 1.00 . A A . 20 LYS HG3 1 1 16 5243 1 1 20 LYS HZ1 H 0.409 10.078 10.738 1.00 . A A . 20 LYS HZ1 1 1 16 5244 1 1 20 LYS HZ2 H -0.459 10.211 12.115 1.00 . A A . 20 LYS HZ2 1 1 16 5245 1 1 20 LYS HZ3 H 1.157 9.988 12.187 1.00 . A A . 20 LYS HZ3 1 1 16 5246 1 1 20 LYS N N -2.186 4.639 10.607 1.00 . A A . 20 LYS N 1 1 16 5247 1 1 20 LYS NZ N 0.323 9.762 11.683 1.00 . A A . 20 LYS NZ 1 1 16 5248 1 1 20 LYS O O -4.722 4.454 9.843 1.00 . A A . 20 LYS O 1 1 16 5249 1 1 21 PRO C C -6.659 6.191 7.943 1.00 . A A . 21 PRO C 1 1 16 5250 1 1 21 PRO CA C -6.491 6.600 9.407 1.00 . A A . 21 PRO CA 1 1 16 5251 1 1 21 PRO CB C -7.087 7.964 9.715 1.00 . A A . 21 PRO CB 1 1 16 5252 1 1 21 PRO CD C -4.640 8.103 9.872 1.00 . A A . 21 PRO CD 1 1 16 5253 1 1 21 PRO CG C -5.914 8.927 9.785 1.00 . A A . 21 PRO CG 1 1 16 5254 1 1 21 PRO HA H -6.924 5.877 9.944 1.00 . A A . 21 PRO HA 1 1 16 5255 1 1 21 PRO HB2 H -7.794 8.265 8.941 1.00 . A A . 21 PRO HB2 1 1 16 5256 1 1 21 PRO HB3 H -7.635 7.947 10.657 1.00 . A A . 21 PRO HB3 1 1 16 5257 1 1 21 PRO HD2 H -3.944 8.361 9.074 1.00 . A A . 21 PRO HD2 1 1 16 5258 1 1 21 PRO HD3 H -4.121 8.274 10.816 1.00 . A A . 21 PRO HD3 1 1 16 5259 1 1 21 PRO HG2 H -5.893 9.568 8.904 1.00 . A A . 21 PRO HG2 1 1 16 5260 1 1 21 PRO HG3 H -6.006 9.580 10.653 1.00 . A A . 21 PRO HG3 1 1 16 5261 1 1 21 PRO N N -5.086 6.717 9.757 1.00 . A A . 21 PRO N 1 1 16 5262 1 1 21 PRO O O -5.878 6.604 7.086 1.00 . A A . 21 PRO O 1 1 16 5263 1 1 22 THR C C -9.272 5.515 5.842 1.00 . A A . 22 THR C 1 1 16 5264 1 1 22 THR CA C -7.961 4.915 6.354 1.00 . A A . 22 THR CA 1 1 16 5265 1 1 22 THR CB C -7.960 3.385 6.376 1.00 . A A . 22 THR CB 1 1 16 5266 1 1 22 THR CG2 C -7.862 2.779 4.976 1.00 . A A . 22 THR CG2 1 1 16 5267 1 1 22 THR H H -8.311 5.054 8.403 1.00 . A A . 22 THR H 1 1 16 5268 1 1 22 THR HA H -7.169 5.270 5.695 1.00 . A A . 22 THR HA 1 1 16 5269 1 1 22 THR HB H -8.832 3.004 6.907 1.00 . A A . 22 THR HB 1 1 16 5270 1 1 22 THR HG1 H -6.789 3.141 7.981 1.00 . A A . 22 THR HG1 1 1 16 5271 1 1 22 THR HG21 H -7.136 3.339 4.387 1.00 . A A . 22 THR HG21 1 1 16 5272 1 1 22 THR HG22 H -7.544 1.739 5.052 1.00 . A A . 22 THR HG22 1 1 16 5273 1 1 22 THR HG23 H -8.837 2.825 4.491 1.00 . A A . 22 THR HG23 1 1 16 5274 1 1 22 THR N N -7.681 5.385 7.699 1.00 . A A . 22 THR N 1 1 16 5275 1 1 22 THR O O -9.764 5.126 4.783 1.00 . A A . 22 THR O 1 1 16 5276 1 1 22 THR OG1 O -6.718 3.048 6.988 1.00 . A A . 22 THR OG1 1 1 16 5277 1 1 23 PHE C C -10.791 8.534 5.770 1.00 . A A . 23 PHE C 1 1 16 5278 1 1 23 PHE CA C -11.046 7.106 6.255 1.00 . A A . 23 PHE CA 1 1 16 5279 1 1 23 PHE CB C -11.909 7.154 7.518 1.00 . A A . 23 PHE CB 1 1 16 5280 1 1 23 PHE CD1 C -10.864 9.034 8.803 1.00 . A A . 23 PHE CD1 1 1 16 5281 1 1 23 PHE CD2 C -10.865 6.889 9.778 1.00 . A A . 23 PHE CD2 1 1 16 5282 1 1 23 PHE CE1 C -10.193 9.552 9.941 1.00 . A A . 23 PHE CE1 1 1 16 5283 1 1 23 PHE CE2 C -10.193 7.407 10.917 1.00 . A A . 23 PHE CE2 1 1 16 5284 1 1 23 PHE CG C -11.186 7.713 8.745 1.00 . A A . 23 PHE CG 1 1 16 5285 1 1 23 PHE CZ C -9.871 8.727 10.975 1.00 . A A . 23 PHE CZ 1 1 16 5286 1 1 23 PHE H H -9.394 6.760 7.476 1.00 . A A . 23 PHE H 1 1 16 5287 1 1 23 PHE HA H -11.495 6.525 5.450 1.00 . A A . 23 PHE HA 1 1 16 5288 1 1 23 PHE HB2 H -12.790 7.765 7.320 1.00 . A A . 23 PHE HB2 1 1 16 5289 1 1 23 PHE HB3 H -12.262 6.148 7.743 1.00 . A A . 23 PHE HB3 1 1 16 5290 1 1 23 PHE HD1 H -11.121 9.693 7.975 1.00 . A A . 23 PHE HD1 1 1 16 5291 1 1 23 PHE HD2 H -11.122 5.831 9.732 1.00 . A A . 23 PHE HD2 1 1 16 5292 1 1 23 PHE HE1 H -9.935 10.609 9.988 1.00 . A A . 23 PHE HE1 1 1 16 5293 1 1 23 PHE HE2 H -9.935 6.747 11.745 1.00 . A A . 23 PHE HE2 1 1 16 5294 1 1 23 PHE HZ H -9.356 9.125 11.849 1.00 . A A . 23 PHE HZ 1 1 16 5295 1 1 23 PHE N N -9.800 6.450 6.617 1.00 . A A . 23 PHE N 1 1 16 5296 1 1 23 PHE O O -9.766 9.131 6.096 1.00 . A A . 23 PHE O 1 1 17 5297 1 1 1 GLU C C -4.384 -9.045 3.770 1.00 . A A . 1 GLU C 1 1 17 5298 1 1 1 GLU CA C -4.720 -10.285 2.939 1.00 . A A . 1 GLU CA 1 1 17 5299 1 1 1 GLU CB C -3.562 -11.285 2.955 1.00 . A A . 1 GLU CB 1 1 17 5300 1 1 1 GLU CD C -2.993 -13.575 3.845 1.00 . A A . 1 GLU CD 1 1 17 5301 1 1 1 GLU CG C -3.678 -12.240 4.144 1.00 . A A . 1 GLU CG 1 1 17 5302 1 1 1 GLU HA H -5.613 -10.767 3.338 1.00 . A A . 1 GLU HA 1 1 17 5303 1 1 1 GLU HB2 H -3.556 -11.855 2.026 1.00 . A A . 1 GLU HB2 1 1 17 5304 1 1 1 GLU HB3 H -2.614 -10.749 3.006 1.00 . A A . 1 GLU HB3 1 1 17 5305 1 1 1 GLU HG2 H -3.227 -11.786 5.026 1.00 . A A . 1 GLU HG2 1 1 17 5306 1 1 1 GLU HG3 H -4.729 -12.411 4.376 1.00 . A A . 1 GLU HG3 1 1 17 5307 1 1 1 GLU N N -5.060 -9.904 1.579 1.00 . A A . 1 GLU N 1 1 17 5308 1 1 1 GLU O O -3.262 -8.901 4.252 1.00 . A A . 1 GLU O 1 1 17 5309 1 1 1 GLU OE1 O -3.650 -14.417 3.195 1.00 . A A . 1 GLU OE1 1 1 17 5310 1 1 1 GLU OE2 O -1.828 -13.723 4.272 1.00 . A A . 1 GLU OE2 1 1 17 5311 1 1 2 ASN C C -4.512 -7.279 5.999 1.00 . A A . 2 ASN C 1 1 17 5312 1 1 2 ASN CA C -5.201 -6.956 4.672 1.00 . A A . 2 ASN CA 1 1 17 5313 1 1 2 ASN CB C -6.550 -6.304 4.987 1.00 . A A . 2 ASN CB 1 1 17 5314 1 1 2 ASN CG C -7.460 -7.269 5.750 1.00 . A A . 2 ASN CG 1 1 17 5315 1 1 2 ASN H H -6.288 -8.305 3.515 1.00 . A A . 2 ASN H 1 1 17 5316 1 1 2 ASN HA H -4.599 -6.307 4.037 1.00 . A A . 2 ASN HA 1 1 17 5317 1 1 2 ASN HB2 H -6.393 -5.402 5.578 1.00 . A A . 2 ASN HB2 1 1 17 5318 1 1 2 ASN HB3 H -7.035 -5.997 4.061 1.00 . A A . 2 ASN HB3 1 1 17 5319 1 1 2 ASN HD21 H -7.784 -5.810 7.115 1.00 . A A . 2 ASN HD21 1 1 17 5320 1 1 2 ASN HD22 H -8.603 -7.305 7.421 1.00 . A A . 2 ASN HD22 1 1 17 5321 1 1 2 ASN N N -5.378 -8.180 3.910 1.00 . A A . 2 ASN N 1 1 17 5322 1 1 2 ASN ND2 N -7.993 -6.752 6.853 1.00 . A A . 2 ASN ND2 1 1 17 5323 1 1 2 ASN O O -4.354 -8.448 6.351 1.00 . A A . 2 ASN O 1 1 17 5324 1 1 2 ASN OD1 O -7.665 -8.407 5.362 1.00 . A A . 2 ASN OD1 1 1 17 5325 1 1 3 PHE C C -4.353 -5.927 9.129 1.00 . A A . 3 PHE C 1 1 17 5326 1 1 3 PHE CA C -3.452 -6.384 7.980 1.00 . A A . 3 PHE CA 1 1 17 5327 1 1 3 PHE CB C -2.203 -5.500 7.945 1.00 . A A . 3 PHE CB 1 1 17 5328 1 1 3 PHE CD1 C -0.476 -6.717 6.601 1.00 . A A . 3 PHE CD1 1 1 17 5329 1 1 3 PHE CD2 C -0.145 -6.534 8.926 1.00 . A A . 3 PHE CD2 1 1 17 5330 1 1 3 PHE CE1 C 0.742 -7.440 6.484 1.00 . A A . 3 PHE CE1 1 1 17 5331 1 1 3 PHE CE2 C 1.071 -7.258 8.810 1.00 . A A . 3 PHE CE2 1 1 17 5332 1 1 3 PHE CG C -0.893 -6.279 7.819 1.00 . A A . 3 PHE CG 1 1 17 5333 1 1 3 PHE CZ C 1.488 -7.695 7.591 1.00 . A A . 3 PHE CZ 1 1 17 5334 1 1 3 PHE H H -4.254 -5.278 6.406 1.00 . A A . 3 PHE H 1 1 17 5335 1 1 3 PHE HA H -3.225 -7.443 8.097 1.00 . A A . 3 PHE HA 1 1 17 5336 1 1 3 PHE HB2 H -2.284 -4.808 7.106 1.00 . A A . 3 PHE HB2 1 1 17 5337 1 1 3 PHE HB3 H -2.171 -4.898 8.852 1.00 . A A . 3 PHE HB3 1 1 17 5338 1 1 3 PHE HD1 H -1.074 -6.511 5.713 1.00 . A A . 3 PHE HD1 1 1 17 5339 1 1 3 PHE HD2 H -0.480 -6.185 9.902 1.00 . A A . 3 PHE HD2 1 1 17 5340 1 1 3 PHE HE1 H 1.076 -7.790 5.508 1.00 . A A . 3 PHE HE1 1 1 17 5341 1 1 3 PHE HE2 H 1.670 -7.463 9.697 1.00 . A A . 3 PHE HE2 1 1 17 5342 1 1 3 PHE HZ H 2.422 -8.250 7.502 1.00 . A A . 3 PHE HZ 1 1 17 5343 1 1 3 PHE N N -4.121 -6.225 6.699 1.00 . A A . 3 PHE N 1 1 17 5344 1 1 3 PHE O O -5.358 -5.254 8.905 1.00 . A A . 3 PHE O 1 1 17 5345 1 1 4 ASN C C -4.109 -6.638 12.741 1.00 . A A . 4 ASN C 1 1 17 5346 1 1 4 ASN CA C -4.720 -5.949 11.520 1.00 . A A . 4 ASN CA 1 1 17 5347 1 1 4 ASN CB C -6.176 -6.402 11.400 1.00 . A A . 4 ASN CB 1 1 17 5348 1 1 4 ASN CG C -7.133 -5.294 11.840 1.00 . A A . 4 ASN CG 1 1 17 5349 1 1 4 ASN H H -3.141 -6.857 10.508 1.00 . A A . 4 ASN H 1 1 17 5350 1 1 4 ASN HA H -4.658 -4.863 11.579 1.00 . A A . 4 ASN HA 1 1 17 5351 1 1 4 ASN HB2 H -6.389 -6.684 10.368 1.00 . A A . 4 ASN HB2 1 1 17 5352 1 1 4 ASN HB3 H -6.336 -7.291 12.011 1.00 . A A . 4 ASN HB3 1 1 17 5353 1 1 4 ASN HD21 H -6.371 -5.443 13.710 1.00 . A A . 4 ASN HD21 1 1 17 5354 1 1 4 ASN HD22 H -7.616 -4.256 13.511 1.00 . A A . 4 ASN HD22 1 1 17 5355 1 1 4 ASN N N -3.960 -6.311 10.335 1.00 . A A . 4 ASN N 1 1 17 5356 1 1 4 ASN ND2 N -7.032 -4.972 13.127 1.00 . A A . 4 ASN ND2 1 1 17 5357 1 1 4 ASN O O -4.831 -7.116 13.614 1.00 . A A . 4 ASN O 1 1 17 5358 1 1 4 ASN OD1 O -7.913 -4.766 11.064 1.00 . A A . 4 ASN OD1 1 1 17 5359 1 1 5 GLY C C -1.301 -6.249 14.679 1.00 . A A . 5 GLY C 1 1 17 5360 1 1 5 GLY CA C -2.068 -7.291 13.864 1.00 . A A . 5 GLY CA 1 1 17 5361 1 1 5 GLY H H -2.204 -6.278 12.049 1.00 . A A . 5 GLY H 1 1 17 5362 1 1 5 GLY HA2 H -2.772 -7.817 14.509 1.00 . A A . 5 GLY HA2 1 1 17 5363 1 1 5 GLY HA3 H -1.374 -8.036 13.475 1.00 . A A . 5 GLY HA3 1 1 17 5364 1 1 5 GLY N N -2.785 -6.669 12.764 1.00 . A A . 5 GLY N 1 1 17 5365 1 1 5 GLY O O -0.189 -6.507 15.135 1.00 . A A . 5 GLY O 1 1 17 5366 1 1 6 GLY C C -2.243 -2.791 15.647 1.00 . A A . 6 GLY C 1 1 17 5367 1 1 6 GLY CA C -1.319 -4.008 15.591 1.00 . A A . 6 GLY CA 1 1 17 5368 1 1 6 GLY H H -2.832 -4.889 14.464 1.00 . A A . 6 GLY H 1 1 17 5369 1 1 6 GLY HA2 H -1.094 -4.346 16.603 1.00 . A A . 6 GLY HA2 1 1 17 5370 1 1 6 GLY HA3 H -0.371 -3.729 15.131 1.00 . A A . 6 GLY HA3 1 1 17 5371 1 1 6 GLY N N -1.928 -5.092 14.838 1.00 . A A . 6 GLY N 1 1 17 5372 1 1 6 GLY O O -2.308 -2.101 16.664 1.00 . A A . 6 GLY O 1 1 17 5373 1 1 7 CYS C C -5.078 -1.751 15.313 1.00 . A A . 7 CYS C 1 1 17 5374 1 1 7 CYS CA C -3.854 -1.441 14.450 1.00 . A A . 7 CYS CA 1 1 17 5375 1 1 7 CYS CB C -4.240 -1.141 12.999 1.00 . A A . 7 CYS CB 1 1 17 5376 1 1 7 CYS H H -2.877 -3.129 13.717 1.00 . A A . 7 CYS H 1 1 17 5377 1 1 7 CYS HA H -3.322 -0.569 14.831 1.00 . A A . 7 CYS HA 1 1 17 5378 1 1 7 CYS HB2 H -4.781 -1.997 12.598 1.00 . A A . 7 CYS HB2 1 1 17 5379 1 1 7 CYS HB3 H -4.929 -0.296 12.989 1.00 . A A . 7 CYS HB3 1 1 17 5380 1 1 7 CYS N N -2.936 -2.563 14.540 1.00 . A A . 7 CYS N 1 1 17 5381 1 1 7 CYS O O -5.124 -2.780 15.984 1.00 . A A . 7 CYS O 1 1 17 5382 1 1 7 CYS SG S -2.831 -0.765 11.893 1.00 . A A . 7 CYS SG 1 1 17 5383 1 1 8 LEU C C -8.322 -1.681 15.168 1.00 . A A . 8 LEU C 1 1 17 5384 1 1 8 LEU CA C -7.261 -1.005 16.039 1.00 . A A . 8 LEU CA 1 1 17 5385 1 1 8 LEU CB C -7.709 0.336 16.623 1.00 . A A . 8 LEU CB 1 1 17 5386 1 1 8 LEU CD1 C -9.114 -0.631 18.481 1.00 . A A . 8 LEU CD1 1 1 17 5387 1 1 8 LEU CD2 C -9.471 1.765 17.727 1.00 . A A . 8 LEU CD2 1 1 17 5388 1 1 8 LEU CG C -9.079 0.347 17.305 1.00 . A A . 8 LEU CG 1 1 17 5389 1 1 8 LEU H H -5.995 -0.006 14.721 1.00 . A A . 8 LEU H 1 1 17 5390 1 1 8 LEU HA H -7.032 -1.661 16.879 1.00 . A A . 8 LEU HA 1 1 17 5391 1 1 8 LEU HB2 H -6.963 0.662 17.348 1.00 . A A . 8 LEU HB2 1 1 17 5392 1 1 8 LEU HB3 H -7.719 1.075 15.821 1.00 . A A . 8 LEU HB3 1 1 17 5393 1 1 8 LEU HD11 H -8.265 -1.312 18.413 1.00 . A A . 8 LEU HD11 1 1 17 5394 1 1 8 LEU HD12 H -9.059 -0.075 19.417 1.00 . A A . 8 LEU HD12 1 1 17 5395 1 1 8 LEU HD13 H -10.042 -1.202 18.452 1.00 . A A . 8 LEU HD13 1 1 17 5396 1 1 8 LEU HD21 H -8.583 2.304 18.058 1.00 . A A . 8 LEU HD21 1 1 17 5397 1 1 8 LEU HD22 H -9.917 2.286 16.879 1.00 . A A . 8 LEU HD22 1 1 17 5398 1 1 8 LEU HD23 H -10.192 1.715 18.543 1.00 . A A . 8 LEU HD23 1 1 17 5399 1 1 8 LEU HG H -9.822 0.009 16.584 1.00 . A A . 8 LEU HG 1 1 17 5400 1 1 8 LEU N N -6.040 -0.841 15.270 1.00 . A A . 8 LEU N 1 1 17 5401 1 1 8 LEU O O -8.877 -2.711 15.548 1.00 . A A . 8 LEU O 1 1 17 5402 1 1 9 ALA C C -9.954 -0.513 12.094 1.00 . A A . 9 ALA C 1 1 17 5403 1 1 9 ALA CA C -9.555 -1.605 13.090 1.00 . A A . 9 ALA CA 1 1 17 5404 1 1 9 ALA CB C -10.754 -2.147 13.872 1.00 . A A . 9 ALA CB 1 1 17 5405 1 1 9 ALA H H -8.116 -0.236 13.717 1.00 . A A . 9 ALA H 1 1 17 5406 1 1 9 ALA HA H -9.090 -2.428 12.547 1.00 . A A . 9 ALA HA 1 1 17 5407 1 1 9 ALA HB1 H -10.912 -1.538 14.762 1.00 . A A . 9 ALA HB1 1 1 17 5408 1 1 9 ALA HB2 H -11.645 -2.108 13.243 1.00 . A A . 9 ALA HB2 1 1 17 5409 1 1 9 ALA HB3 H -10.561 -3.178 14.166 1.00 . A A . 9 ALA HB3 1 1 17 5410 1 1 9 ALA N N -8.572 -1.074 14.018 1.00 . A A . 9 ALA N 1 1 17 5411 1 1 9 ALA O O -10.713 0.393 12.433 1.00 . A A . 9 ALA O 1 1 17 5412 1 1 10 GLY C C -8.451 1.101 9.442 1.00 . A A . 10 GLY C 1 1 17 5413 1 1 10 GLY CA C -9.711 0.330 9.841 1.00 . A A . 10 GLY CA 1 1 17 5414 1 1 10 GLY H H -8.804 -1.376 10.621 1.00 . A A . 10 GLY H 1 1 17 5415 1 1 10 GLY HA2 H -10.119 -0.184 8.970 1.00 . A A . 10 GLY HA2 1 1 17 5416 1 1 10 GLY HA3 H -10.474 1.027 10.186 1.00 . A A . 10 GLY HA3 1 1 17 5417 1 1 10 GLY N N -9.421 -0.635 10.888 1.00 . A A . 10 GLY N 1 1 17 5418 1 1 10 GLY O O -8.259 1.418 8.268 1.00 . A A . 10 GLY O 1 1 17 5419 1 1 11 TYR C C -5.441 1.305 9.313 1.00 . A A . 11 TYR C 1 1 17 5420 1 1 11 TYR CA C -6.389 2.106 10.206 1.00 . A A . 11 TYR CA 1 1 17 5421 1 1 11 TYR CB C -5.743 2.290 11.581 1.00 . A A . 11 TYR CB 1 1 17 5422 1 1 11 TYR CD1 C -7.528 2.691 13.317 1.00 . A A . 11 TYR CD1 1 1 17 5423 1 1 11 TYR CD2 C -6.232 4.556 12.571 1.00 . A A . 11 TYR CD2 1 1 17 5424 1 1 11 TYR CE1 C -8.265 3.557 14.200 1.00 . A A . 11 TYR CE1 1 1 17 5425 1 1 11 TYR CE2 C -6.969 5.422 13.454 1.00 . A A . 11 TYR CE2 1 1 17 5426 1 1 11 TYR CG C -6.527 3.210 12.520 1.00 . A A . 11 TYR CG 1 1 17 5427 1 1 11 TYR CZ C -7.950 4.879 14.225 1.00 . A A . 11 TYR CZ 1 1 17 5428 1 1 11 TYR H H -7.789 1.117 11.391 1.00 . A A . 11 TYR H 1 1 17 5429 1 1 11 TYR HA H -6.639 3.044 9.711 1.00 . A A . 11 TYR HA 1 1 17 5430 1 1 11 TYR HB2 H -5.634 1.313 12.053 1.00 . A A . 11 TYR HB2 1 1 17 5431 1 1 11 TYR HB3 H -4.739 2.693 11.449 1.00 . A A . 11 TYR HB3 1 1 17 5432 1 1 11 TYR HD1 H -7.760 1.627 13.277 1.00 . A A . 11 TYR HD1 1 1 17 5433 1 1 11 TYR HD2 H -5.441 4.966 11.942 1.00 . A A . 11 TYR HD2 1 1 17 5434 1 1 11 TYR HE1 H -9.058 3.161 14.834 1.00 . A A . 11 TYR HE1 1 1 17 5435 1 1 11 TYR HE2 H -6.747 6.488 13.504 1.00 . A A . 11 TYR HE2 1 1 17 5436 1 1 11 TYR HH H -9.558 5.870 14.687 1.00 . A A . 11 TYR HH 1 1 17 5437 1 1 11 TYR N N -7.626 1.379 10.440 1.00 . A A . 11 TYR N 1 1 17 5438 1 1 11 TYR O O -5.518 0.079 9.263 1.00 . A A . 11 TYR O 1 1 17 5439 1 1 11 TYR OH O -8.646 5.697 15.060 1.00 . A A . 11 TYR OH 1 1 17 5440 1 1 12 MET C C -2.174 1.679 8.198 1.00 . A A . 12 MET C 1 1 17 5441 1 1 12 MET CA C -3.607 1.403 7.740 1.00 . A A . 12 MET CA 1 1 17 5442 1 1 12 MET CB C -3.800 1.937 6.319 1.00 . A A . 12 MET CB 1 1 17 5443 1 1 12 MET CE C -3.676 5.768 4.899 1.00 . A A . 12 MET CE 1 1 17 5444 1 1 12 MET CG C -3.990 3.454 6.324 1.00 . A A . 12 MET CG 1 1 17 5445 1 1 12 MET H H -4.514 3.028 8.674 1.00 . A A . 12 MET H 1 1 17 5446 1 1 12 MET HA H -3.813 0.334 7.793 1.00 . A A . 12 MET HA 1 1 17 5447 1 1 12 MET HB2 H -2.936 1.677 5.708 1.00 . A A . 12 MET HB2 1 1 17 5448 1 1 12 MET HB3 H -4.668 1.460 5.862 1.00 . A A . 12 MET HB3 1 1 17 5449 1 1 12 MET HE1 H -2.691 5.818 5.361 1.00 . A A . 12 MET HE1 1 1 17 5450 1 1 12 MET HE2 H -3.654 6.281 3.938 1.00 . A A . 12 MET HE2 1 1 17 5451 1 1 12 MET HE3 H -4.407 6.247 5.551 1.00 . A A . 12 MET HE3 1 1 17 5452 1 1 12 MET HG2 H -4.885 3.716 6.890 1.00 . A A . 12 MET HG2 1 1 17 5453 1 1 12 MET HG3 H -3.147 3.933 6.823 1.00 . A A . 12 MET HG3 1 1 17 5454 1 1 12 MET N N -4.570 2.031 8.629 1.00 . A A . 12 MET N 1 1 17 5455 1 1 12 MET O O -1.934 2.605 8.971 1.00 . A A . 12 MET O 1 1 17 5456 1 1 12 MET SD S -4.130 4.059 4.651 1.00 . A A . 12 MET SD 1 1 17 5457 1 1 13 ARG C C 0.893 1.740 6.937 1.00 . A A . 13 ARG C 1 1 17 5458 1 1 13 ARG CA C 0.143 1.004 8.050 1.00 . A A . 13 ARG CA 1 1 17 5459 1 1 13 ARG CB C 0.798 -0.359 8.281 1.00 . A A . 13 ARG CB 1 1 17 5460 1 1 13 ARG CD C 0.784 -0.652 10.786 1.00 . A A . 13 ARG CD 1 1 17 5461 1 1 13 ARG CG C 1.644 -0.352 9.556 1.00 . A A . 13 ARG CG 1 1 17 5462 1 1 13 ARG CZ C 2.038 -2.696 11.465 1.00 . A A . 13 ARG CZ 1 1 17 5463 1 1 13 ARG H H -1.464 0.108 7.074 1.00 . A A . 13 ARG H 1 1 17 5464 1 1 13 ARG HA H 0.143 1.585 8.972 1.00 . A A . 13 ARG HA 1 1 17 5465 1 1 13 ARG HB2 H 0.028 -1.128 8.355 1.00 . A A . 13 ARG HB2 1 1 17 5466 1 1 13 ARG HB3 H 1.423 -0.616 7.427 1.00 . A A . 13 ARG HB3 1 1 17 5467 1 1 13 ARG HD2 H 1.109 -0.037 11.625 1.00 . A A . 13 ARG HD2 1 1 17 5468 1 1 13 ARG HD3 H -0.255 -0.395 10.585 1.00 . A A . 13 ARG HD3 1 1 17 5469 1 1 13 ARG HE H 0.053 -2.633 11.136 1.00 . A A . 13 ARG HE 1 1 17 5470 1 1 13 ARG HG2 H 2.438 -1.093 9.473 1.00 . A A . 13 ARG HG2 1 1 17 5471 1 1 13 ARG HG3 H 2.125 0.619 9.672 1.00 . A A . 13 ARG HG3 1 1 17 5472 1 1 13 ARG HH11 H 3.183 -1.029 11.255 1.00 . A A . 13 ARG HH11 1 1 17 5473 1 1 13 ARG HH12 H 4.041 -2.458 11.727 1.00 . A A . 13 ARG HH12 1 1 17 5474 1 1 13 ARG HH21 H 1.184 -4.518 11.758 1.00 . A A . 13 ARG HH21 1 1 17 5475 1 1 13 ARG HH22 H 2.895 -4.456 12.015 1.00 . A A . 13 ARG HH22 1 1 17 5476 1 1 13 ARG N N -1.260 0.859 7.702 1.00 . A A . 13 ARG N 1 1 17 5477 1 1 13 ARG NE N 0.890 -2.086 11.140 1.00 . A A . 13 ARG NE 1 1 17 5478 1 1 13 ARG NH1 N 3.184 -2.002 11.484 1.00 . A A . 13 ARG NH1 1 1 17 5479 1 1 13 ARG NH2 N 2.039 -4.001 11.772 1.00 . A A . 13 ARG NH2 1 1 17 5480 1 1 13 ARG O O 1.162 1.167 5.882 1.00 . A A . 13 ARG O 1 1 17 5481 1 1 14 THR C C 3.253 3.161 5.870 1.00 . A A . 14 THR C 1 1 17 5482 1 1 14 THR CA C 1.922 3.816 6.247 1.00 . A A . 14 THR CA 1 1 17 5483 1 1 14 THR CB C 2.081 5.217 6.843 1.00 . A A . 14 THR CB 1 1 17 5484 1 1 14 THR CG2 C 0.796 5.723 7.501 1.00 . A A . 14 THR CG2 1 1 17 5485 1 1 14 THR H H 0.985 3.454 8.071 1.00 . A A . 14 THR H 1 1 17 5486 1 1 14 THR HA H 1.326 3.875 5.337 1.00 . A A . 14 THR HA 1 1 17 5487 1 1 14 THR HB H 2.438 5.921 6.091 1.00 . A A . 14 THR HB 1 1 17 5488 1 1 14 THR HG1 H 3.718 5.703 7.887 1.00 . A A . 14 THR HG1 1 1 17 5489 1 1 14 THR HG21 H 0.001 4.991 7.356 1.00 . A A . 14 THR HG21 1 1 17 5490 1 1 14 THR HG22 H 0.967 5.868 8.567 1.00 . A A . 14 THR HG22 1 1 17 5491 1 1 14 THR HG23 H 0.505 6.670 7.047 1.00 . A A . 14 THR HG23 1 1 17 5492 1 1 14 THR N N 1.208 2.997 7.211 1.00 . A A . 14 THR N 1 1 17 5493 1 1 14 THR O O 3.419 1.952 6.026 1.00 . A A . 14 THR O 1 1 17 5494 1 1 14 THR OG1 O 2.980 5.030 7.933 1.00 . A A . 14 THR OG1 1 1 17 5495 1 1 15 ALA C C 6.439 3.612 6.169 1.00 . A A . 15 ALA C 1 1 17 5496 1 1 15 ALA CA C 5.477 3.504 4.984 1.00 . A A . 15 ALA CA 1 1 17 5497 1 1 15 ALA CB C 5.963 4.291 3.766 1.00 . A A . 15 ALA CB 1 1 17 5498 1 1 15 ALA H H 4.023 4.970 5.261 1.00 . A A . 15 ALA H 1 1 17 5499 1 1 15 ALA HA H 5.372 2.455 4.706 1.00 . A A . 15 ALA HA 1 1 17 5500 1 1 15 ALA HB1 H 5.184 4.985 3.448 1.00 . A A . 15 ALA HB1 1 1 17 5501 1 1 15 ALA HB2 H 6.861 4.850 4.028 1.00 . A A . 15 ALA HB2 1 1 17 5502 1 1 15 ALA HB3 H 6.187 3.600 2.953 1.00 . A A . 15 ALA HB3 1 1 17 5503 1 1 15 ALA N N 4.166 3.988 5.384 1.00 . A A . 15 ALA N 1 1 17 5504 1 1 15 ALA O O 7.643 3.419 6.016 1.00 . A A . 15 ALA O 1 1 17 5505 1 1 16 ASP C C 6.278 2.951 9.519 1.00 . A A . 16 ASP C 1 1 17 5506 1 1 16 ASP CA C 6.661 4.059 8.536 1.00 . A A . 16 ASP CA 1 1 17 5507 1 1 16 ASP CB C 6.398 5.405 9.215 1.00 . A A . 16 ASP CB 1 1 17 5508 1 1 16 ASP CG C 7.558 6.400 9.147 1.00 . A A . 16 ASP CG 1 1 17 5509 1 1 16 ASP H H 4.888 4.076 7.442 1.00 . A A . 16 ASP H 1 1 17 5510 1 1 16 ASP HA H 7.698 3.987 8.209 1.00 . A A . 16 ASP HA 1 1 17 5511 1 1 16 ASP HB2 H 5.520 5.861 8.757 1.00 . A A . 16 ASP HB2 1 1 17 5512 1 1 16 ASP HB3 H 6.155 5.225 10.262 1.00 . A A . 16 ASP HB3 1 1 17 5513 1 1 16 ASP N N 5.869 3.921 7.325 1.00 . A A . 16 ASP N 1 1 17 5514 1 1 16 ASP O O 7.028 2.655 10.449 1.00 . A A . 16 ASP O 1 1 17 5515 1 1 16 ASP OD1 O 7.978 6.705 8.010 1.00 . A A . 16 ASP OD1 1 1 17 5516 1 1 16 ASP OD2 O 7.998 6.835 10.233 1.00 . A A . 16 ASP OD2 1 1 17 5517 1 1 17 GLY C C 3.610 1.829 11.150 1.00 . A A . 17 GLY C 1 1 17 5518 1 1 17 GLY CA C 4.622 1.298 10.133 1.00 . A A . 17 GLY CA 1 1 17 5519 1 1 17 GLY H H 4.510 2.614 8.522 1.00 . A A . 17 GLY H 1 1 17 5520 1 1 17 GLY HA2 H 4.157 0.525 9.521 1.00 . A A . 17 GLY HA2 1 1 17 5521 1 1 17 GLY HA3 H 5.458 0.832 10.654 1.00 . A A . 17 GLY HA3 1 1 17 5522 1 1 17 GLY N N 5.113 2.367 9.280 1.00 . A A . 17 GLY N 1 1 17 5523 1 1 17 GLY O O 3.098 1.073 11.974 1.00 . A A . 17 GLY O 1 1 17 5524 1 1 18 ARG C C 0.980 3.574 11.463 1.00 . A A . 18 ARG C 1 1 17 5525 1 1 18 ARG CA C 2.413 3.767 11.964 1.00 . A A . 18 ARG CA 1 1 17 5526 1 1 18 ARG CB C 2.704 5.263 12.092 1.00 . A A . 18 ARG CB 1 1 17 5527 1 1 18 ARG CD C 2.889 7.373 10.723 1.00 . A A . 18 ARG CD 1 1 17 5528 1 1 18 ARG CG C 2.171 6.031 10.881 1.00 . A A . 18 ARG CG 1 1 17 5529 1 1 18 ARG CZ C 2.531 8.629 12.844 1.00 . A A . 18 ARG CZ 1 1 17 5530 1 1 18 ARG H H 3.775 3.734 10.389 1.00 . A A . 18 ARG H 1 1 17 5531 1 1 18 ARG HA H 2.563 3.269 12.923 1.00 . A A . 18 ARG HA 1 1 17 5532 1 1 18 ARG HB2 H 2.247 5.650 13.003 1.00 . A A . 18 ARG HB2 1 1 17 5533 1 1 18 ARG HB3 H 3.779 5.422 12.184 1.00 . A A . 18 ARG HB3 1 1 17 5534 1 1 18 ARG HD2 H 3.935 7.271 11.013 1.00 . A A . 18 ARG HD2 1 1 17 5535 1 1 18 ARG HD3 H 2.877 7.680 9.677 1.00 . A A . 18 ARG HD3 1 1 17 5536 1 1 18 ARG HE H 1.517 8.961 11.138 1.00 . A A . 18 ARG HE 1 1 17 5537 1 1 18 ARG HG2 H 2.306 5.434 9.979 1.00 . A A . 18 ARG HG2 1 1 17 5538 1 1 18 ARG HG3 H 1.100 6.199 10.995 1.00 . A A . 18 ARG HG3 1 1 17 5539 1 1 18 ARG HH11 H 3.966 7.191 12.942 1.00 . A A . 18 ARG HH11 1 1 17 5540 1 1 18 ARG HH12 H 3.705 8.074 14.409 1.00 . A A . 18 ARG HH12 1 1 17 5541 1 1 18 ARG HH21 H 1.173 10.125 13.073 1.00 . A A . 18 ARG HH21 1 1 17 5542 1 1 18 ARG HH22 H 2.106 9.754 14.485 1.00 . A A . 18 ARG HH22 1 1 17 5543 1 1 18 ARG N N 3.354 3.126 11.061 1.00 . A A . 18 ARG N 1 1 17 5544 1 1 18 ARG NE N 2.231 8.401 11.559 1.00 . A A . 18 ARG NE 1 1 17 5545 1 1 18 ARG NH1 N 3.481 7.903 13.450 1.00 . A A . 18 ARG NH1 1 1 17 5546 1 1 18 ARG NH2 N 1.882 9.584 13.525 1.00 . A A . 18 ARG NH2 1 1 17 5547 1 1 18 ARG O O 0.638 4.015 10.367 1.00 . A A . 18 ARG O 1 1 17 5548 1 1 19 CYS C C -1.930 4.003 11.836 1.00 . A A . 19 CYS C 1 1 17 5549 1 1 19 CYS CA C -1.206 2.659 11.943 1.00 . A A . 19 CYS CA 1 1 17 5550 1 1 19 CYS CB C -1.879 1.727 12.954 1.00 . A A . 19 CYS CB 1 1 17 5551 1 1 19 CYS H H 0.468 2.559 13.178 1.00 . A A . 19 CYS H 1 1 17 5552 1 1 19 CYS HA H -1.200 2.145 10.982 1.00 . A A . 19 CYS HA 1 1 17 5553 1 1 19 CYS HB2 H -1.776 2.159 13.948 1.00 . A A . 19 CYS HB2 1 1 17 5554 1 1 19 CYS HB3 H -2.946 1.685 12.733 1.00 . A A . 19 CYS HB3 1 1 17 5555 1 1 19 CYS N N 0.181 2.914 12.289 1.00 . A A . 19 CYS N 1 1 17 5556 1 1 19 CYS O O -2.353 4.566 12.844 1.00 . A A . 19 CYS O 1 1 17 5557 1 1 19 CYS SG S -1.218 0.022 12.983 1.00 . A A . 19 CYS SG 1 1 17 5558 1 1 20 LYS C C -4.178 5.481 9.980 1.00 . A A . 20 LYS C 1 1 17 5559 1 1 20 LYS CA C -2.717 5.744 10.352 1.00 . A A . 20 LYS CA 1 1 17 5560 1 1 20 LYS CB C -1.951 6.552 9.303 1.00 . A A . 20 LYS CB 1 1 17 5561 1 1 20 LYS CD C -0.596 8.635 8.868 1.00 . A A . 20 LYS CD 1 1 17 5562 1 1 20 LYS CE C -1.031 10.100 8.940 1.00 . A A . 20 LYS CE 1 1 17 5563 1 1 20 LYS CG C -1.316 7.797 9.927 1.00 . A A . 20 LYS CG 1 1 17 5564 1 1 20 LYS H H -1.704 4.013 9.789 1.00 . A A . 20 LYS H 1 1 17 5565 1 1 20 LYS HA H -2.694 6.315 11.280 1.00 . A A . 20 LYS HA 1 1 17 5566 1 1 20 LYS HB2 H -1.176 5.931 8.854 1.00 . A A . 20 LYS HB2 1 1 17 5567 1 1 20 LYS HB3 H -2.627 6.848 8.501 1.00 . A A . 20 LYS HB3 1 1 17 5568 1 1 20 LYS HD2 H 0.482 8.564 9.014 1.00 . A A . 20 LYS HD2 1 1 17 5569 1 1 20 LYS HD3 H -0.811 8.236 7.877 1.00 . A A . 20 LYS HD3 1 1 17 5570 1 1 20 LYS HE2 H -1.307 10.354 9.963 1.00 . A A . 20 LYS HE2 1 1 17 5571 1 1 20 LYS HE3 H -0.197 10.746 8.665 1.00 . A A . 20 LYS HE3 1 1 17 5572 1 1 20 LYS HG2 H -2.086 8.399 10.411 1.00 . A A . 20 LYS HG2 1 1 17 5573 1 1 20 LYS HG3 H -0.610 7.500 10.702 1.00 . A A . 20 LYS HG3 1 1 17 5574 1 1 20 LYS HZ1 H -2.064 9.805 7.202 1.00 . A A . 20 LYS HZ1 1 1 17 5575 1 1 20 LYS HZ2 H -3.025 10.082 8.493 1.00 . A A . 20 LYS HZ2 1 1 17 5576 1 1 20 LYS HZ3 H -2.212 11.317 7.800 1.00 . A A . 20 LYS HZ3 1 1 17 5577 1 1 20 LYS N N -2.051 4.477 10.604 1.00 . A A . 20 LYS N 1 1 17 5578 1 1 20 LYS NZ N -2.176 10.346 8.035 1.00 . A A . 20 LYS NZ 1 1 17 5579 1 1 20 LYS O O -4.577 4.334 9.788 1.00 . A A . 20 LYS O 1 1 17 5580 1 1 21 PRO C C -6.543 6.203 8.050 1.00 . A A . 21 PRO C 1 1 17 5581 1 1 21 PRO CA C -6.363 6.495 9.541 1.00 . A A . 21 PRO CA 1 1 17 5582 1 1 21 PRO CB C -6.966 7.826 9.961 1.00 . A A . 21 PRO CB 1 1 17 5583 1 1 21 PRO CD C -4.516 7.968 10.106 1.00 . A A . 21 PRO CD 1 1 17 5584 1 1 21 PRO CG C -5.796 8.788 10.096 1.00 . A A . 21 PRO CG 1 1 17 5585 1 1 21 PRO HA H -6.787 5.728 10.023 1.00 . A A . 21 PRO HA 1 1 17 5586 1 1 21 PRO HB2 H -7.681 8.183 9.221 1.00 . A A . 21 PRO HB2 1 1 17 5587 1 1 21 PRO HB3 H -7.504 7.731 10.905 1.00 . A A . 21 PRO HB3 1 1 17 5588 1 1 21 PRO HD2 H -3.830 8.295 9.325 1.00 . A A . 21 PRO HD2 1 1 17 5589 1 1 21 PRO HD3 H -3.989 8.069 11.055 1.00 . A A . 21 PRO HD3 1 1 17 5590 1 1 21 PRO HG2 H -5.788 9.498 9.269 1.00 . A A . 21 PRO HG2 1 1 17 5591 1 1 21 PRO HG3 H -5.884 9.369 11.014 1.00 . A A . 21 PRO HG3 1 1 17 5592 1 1 21 PRO N N -4.955 6.593 9.886 1.00 . A A . 21 PRO N 1 1 17 5593 1 1 21 PRO O O -5.764 6.674 7.223 1.00 . A A . 21 PRO O 1 1 17 5594 1 1 22 THR C C -9.067 5.858 5.859 1.00 . A A . 22 THR C 1 1 17 5595 1 1 22 THR CA C -7.865 5.063 6.375 1.00 . A A . 22 THR CA 1 1 17 5596 1 1 22 THR CB C -8.068 3.548 6.317 1.00 . A A . 22 THR CB 1 1 17 5597 1 1 22 THR CG2 C -7.854 2.983 4.912 1.00 . A A . 22 THR CG2 1 1 17 5598 1 1 22 THR H H -8.202 5.045 8.431 1.00 . A A . 22 THR H 1 1 17 5599 1 1 22 THR HA H -7.010 5.341 5.759 1.00 . A A . 22 THR HA 1 1 17 5600 1 1 22 THR HB H -9.049 3.272 6.703 1.00 . A A . 22 THR HB 1 1 17 5601 1 1 22 THR HG1 H -6.892 2.040 6.908 1.00 . A A . 22 THR HG1 1 1 17 5602 1 1 22 THR HG21 H -7.094 3.569 4.396 1.00 . A A . 22 THR HG21 1 1 17 5603 1 1 22 THR HG22 H -7.526 1.945 4.984 1.00 . A A . 22 THR HG22 1 1 17 5604 1 1 22 THR HG23 H -8.789 3.030 4.354 1.00 . A A . 22 THR HG23 1 1 17 5605 1 1 22 THR N N -7.574 5.425 7.752 1.00 . A A . 22 THR N 1 1 17 5606 1 1 22 THR O O -9.562 5.597 4.764 1.00 . A A . 22 THR O 1 1 17 5607 1 1 22 THR OG1 O -6.979 3.023 7.072 1.00 . A A . 22 THR OG1 1 1 17 5608 1 1 23 PHE C C -10.177 9.045 5.903 1.00 . A A . 23 PHE C 1 1 17 5609 1 1 23 PHE CA C -10.635 7.643 6.310 1.00 . A A . 23 PHE CA 1 1 17 5610 1 1 23 PHE CB C -11.524 7.751 7.551 1.00 . A A . 23 PHE CB 1 1 17 5611 1 1 23 PHE CD1 C -10.420 9.565 8.878 1.00 . A A . 23 PHE CD1 1 1 17 5612 1 1 23 PHE CD2 C -10.524 7.408 9.821 1.00 . A A . 23 PHE CD2 1 1 17 5613 1 1 23 PHE CE1 C -9.743 10.037 10.034 1.00 . A A . 23 PHE CE1 1 1 17 5614 1 1 23 PHE CE2 C -9.847 7.880 10.977 1.00 . A A . 23 PHE CE2 1 1 17 5615 1 1 23 PHE CG C -10.796 8.260 8.796 1.00 . A A . 23 PHE CG 1 1 17 5616 1 1 23 PHE CZ C -9.472 9.185 11.059 1.00 . A A . 23 PHE CZ 1 1 17 5617 1 1 23 PHE H H -9.091 7.015 7.560 1.00 . A A . 23 PHE H 1 1 17 5618 1 1 23 PHE HA H -11.131 7.165 5.466 1.00 . A A . 23 PHE HA 1 1 17 5619 1 1 23 PHE HB2 H -12.357 8.418 7.332 1.00 . A A . 23 PHE HB2 1 1 17 5620 1 1 23 PHE HB3 H -11.949 6.771 7.767 1.00 . A A . 23 PHE HB3 1 1 17 5621 1 1 23 PHE HD1 H -10.638 10.248 8.057 1.00 . A A . 23 PHE HD1 1 1 17 5622 1 1 23 PHE HD2 H -10.824 6.363 9.755 1.00 . A A . 23 PHE HD2 1 1 17 5623 1 1 23 PHE HE1 H -9.443 11.082 10.101 1.00 . A A . 23 PHE HE1 1 1 17 5624 1 1 23 PHE HE2 H -9.629 7.198 11.799 1.00 . A A . 23 PHE HE2 1 1 17 5625 1 1 23 PHE HZ H -8.953 9.548 11.946 1.00 . A A . 23 PHE HZ 1 1 17 5626 1 1 23 PHE N N -9.500 6.810 6.671 1.00 . A A . 23 PHE N 1 1 17 5627 1 1 23 PHE O O -9.243 9.591 6.487 1.00 . A A . 23 PHE O 1 1 18 5628 1 1 1 GLU C C -9.181 -11.117 14.599 1.00 . A A . 1 GLU C 1 1 18 5629 1 1 1 GLU CA C -9.681 -11.934 15.792 1.00 . A A . 1 GLU CA 1 1 18 5630 1 1 1 GLU CB C -9.858 -11.050 17.028 1.00 . A A . 1 GLU CB 1 1 18 5631 1 1 1 GLU CD C -11.085 -10.782 19.214 1.00 . A A . 1 GLU CD 1 1 18 5632 1 1 1 GLU CG C -11.041 -11.521 17.875 1.00 . A A . 1 GLU CG 1 1 18 5633 1 1 1 GLU HA H -10.636 -12.400 15.547 1.00 . A A . 1 GLU HA 1 1 18 5634 1 1 1 GLU HB2 H -8.947 -11.069 17.626 1.00 . A A . 1 GLU HB2 1 1 18 5635 1 1 1 GLU HB3 H -10.015 -10.016 16.720 1.00 . A A . 1 GLU HB3 1 1 18 5636 1 1 1 GLU HG2 H -11.971 -11.353 17.332 1.00 . A A . 1 GLU HG2 1 1 18 5637 1 1 1 GLU HG3 H -10.963 -12.594 18.050 1.00 . A A . 1 GLU HG3 1 1 18 5638 1 1 1 GLU N N -8.774 -13.035 16.065 1.00 . A A . 1 GLU N 1 1 18 5639 1 1 1 GLU O O -9.874 -10.996 13.590 1.00 . A A . 1 GLU O 1 1 18 5640 1 1 1 GLU OE1 O -10.009 -10.304 19.634 1.00 . A A . 1 GLU OE1 1 1 18 5641 1 1 1 GLU OE2 O -12.194 -10.712 19.788 1.00 . A A . 1 GLU OE2 1 1 18 5642 1 1 2 ASN C C -6.023 -9.252 14.182 1.00 . A A . 2 ASN C 1 1 18 5643 1 1 2 ASN CA C -7.379 -9.774 13.705 1.00 . A A . 2 ASN CA 1 1 18 5644 1 1 2 ASN CB C -8.257 -8.568 13.363 1.00 . A A . 2 ASN CB 1 1 18 5645 1 1 2 ASN CG C -7.770 -7.880 12.086 1.00 . A A . 2 ASN CG 1 1 18 5646 1 1 2 ASN H H -7.424 -10.681 15.580 1.00 . A A . 2 ASN H 1 1 18 5647 1 1 2 ASN HA H -7.291 -10.443 12.849 1.00 . A A . 2 ASN HA 1 1 18 5648 1 1 2 ASN HB2 H -9.290 -8.890 13.235 1.00 . A A . 2 ASN HB2 1 1 18 5649 1 1 2 ASN HB3 H -8.244 -7.858 14.190 1.00 . A A . 2 ASN HB3 1 1 18 5650 1 1 2 ASN HD21 H -7.770 -6.122 13.089 1.00 . A A . 2 ASN HD21 1 1 18 5651 1 1 2 ASN HD22 H -7.271 -6.030 11.432 1.00 . A A . 2 ASN HD22 1 1 18 5652 1 1 2 ASN N N -7.981 -10.578 14.756 1.00 . A A . 2 ASN N 1 1 18 5653 1 1 2 ASN ND2 N -7.588 -6.569 12.213 1.00 . A A . 2 ASN ND2 1 1 18 5654 1 1 2 ASN O O -5.807 -9.078 15.380 1.00 . A A . 2 ASN O 1 1 18 5655 1 1 2 ASN OD1 O -7.572 -8.500 11.053 1.00 . A A . 2 ASN OD1 1 1 18 5656 1 1 3 PHE C C -3.034 -8.213 12.244 1.00 . A A . 3 PHE C 1 1 18 5657 1 1 3 PHE CA C -3.815 -8.516 13.525 1.00 . A A . 3 PHE CA 1 1 18 5658 1 1 3 PHE CB C -3.090 -9.618 14.300 1.00 . A A . 3 PHE CB 1 1 18 5659 1 1 3 PHE CD1 C -0.682 -9.017 14.631 1.00 . A A . 3 PHE CD1 1 1 18 5660 1 1 3 PHE CD2 C -2.147 -8.764 16.457 1.00 . A A . 3 PHE CD2 1 1 18 5661 1 1 3 PHE CE1 C 0.395 -8.549 15.430 1.00 . A A . 3 PHE CE1 1 1 18 5662 1 1 3 PHE CE2 C -1.071 -8.295 17.256 1.00 . A A . 3 PHE CE2 1 1 18 5663 1 1 3 PHE CG C -1.931 -9.114 15.161 1.00 . A A . 3 PHE CG 1 1 18 5664 1 1 3 PHE CZ C 0.178 -8.198 16.725 1.00 . A A . 3 PHE CZ 1 1 18 5665 1 1 3 PHE H H -5.328 -9.158 12.247 1.00 . A A . 3 PHE H 1 1 18 5666 1 1 3 PHE HA H -3.938 -7.597 14.099 1.00 . A A . 3 PHE HA 1 1 18 5667 1 1 3 PHE HB2 H -3.809 -10.130 14.941 1.00 . A A . 3 PHE HB2 1 1 18 5668 1 1 3 PHE HB3 H -2.711 -10.356 13.594 1.00 . A A . 3 PHE HB3 1 1 18 5669 1 1 3 PHE HD1 H -0.508 -9.298 13.592 1.00 . A A . 3 PHE HD1 1 1 18 5670 1 1 3 PHE HD2 H -3.148 -8.841 16.882 1.00 . A A . 3 PHE HD2 1 1 18 5671 1 1 3 PHE HE1 H 1.395 -8.472 15.004 1.00 . A A . 3 PHE HE1 1 1 18 5672 1 1 3 PHE HE2 H -1.245 -8.014 18.294 1.00 . A A . 3 PHE HE2 1 1 18 5673 1 1 3 PHE HZ H 1.004 -7.839 17.339 1.00 . A A . 3 PHE HZ 1 1 18 5674 1 1 3 PHE N N -5.144 -9.015 13.218 1.00 . A A . 3 PHE N 1 1 18 5675 1 1 3 PHE O O -2.258 -9.045 11.775 1.00 . A A . 3 PHE O 1 1 18 5676 1 1 4 ASN C C -1.511 -5.574 10.848 1.00 . A A . 4 ASN C 1 1 18 5677 1 1 4 ASN CA C -2.595 -6.598 10.499 1.00 . A A . 4 ASN CA 1 1 18 5678 1 1 4 ASN CB C -3.576 -5.935 9.530 1.00 . A A . 4 ASN CB 1 1 18 5679 1 1 4 ASN CG C -4.540 -5.010 10.274 1.00 . A A . 4 ASN CG 1 1 18 5680 1 1 4 ASN H H -3.899 -6.350 12.104 1.00 . A A . 4 ASN H 1 1 18 5681 1 1 4 ASN HA H -2.182 -7.510 10.067 1.00 . A A . 4 ASN HA 1 1 18 5682 1 1 4 ASN HB2 H -3.025 -5.366 8.781 1.00 . A A . 4 ASN HB2 1 1 18 5683 1 1 4 ASN HB3 H -4.139 -6.701 8.997 1.00 . A A . 4 ASN HB3 1 1 18 5684 1 1 4 ASN HD21 H -3.435 -3.433 9.649 1.00 . A A . 4 ASN HD21 1 1 18 5685 1 1 4 ASN HD22 H -4.808 -3.034 10.628 1.00 . A A . 4 ASN HD22 1 1 18 5686 1 1 4 ASN N N -3.266 -7.020 11.716 1.00 . A A . 4 ASN N 1 1 18 5687 1 1 4 ASN ND2 N -4.236 -3.718 10.175 1.00 . A A . 4 ASN ND2 1 1 18 5688 1 1 4 ASN O O -1.520 -4.457 10.335 1.00 . A A . 4 ASN O 1 1 18 5689 1 1 4 ASN OD1 O -5.498 -5.439 10.896 1.00 . A A . 4 ASN OD1 1 1 18 5690 1 1 5 GLY C C 0.312 -4.711 13.604 1.00 . A A . 5 GLY C 1 1 18 5691 1 1 5 GLY CA C 0.483 -5.129 12.142 1.00 . A A . 5 GLY CA 1 1 18 5692 1 1 5 GLY H H -0.605 -6.906 12.131 1.00 . A A . 5 GLY H 1 1 18 5693 1 1 5 GLY HA2 H 1.434 -5.646 12.016 1.00 . A A . 5 GLY HA2 1 1 18 5694 1 1 5 GLY HA3 H 0.514 -4.242 11.509 1.00 . A A . 5 GLY HA3 1 1 18 5695 1 1 5 GLY N N -0.605 -5.995 11.718 1.00 . A A . 5 GLY N 1 1 18 5696 1 1 5 GLY O O 1.284 -4.662 14.357 1.00 . A A . 5 GLY O 1 1 18 5697 1 1 6 GLY C C -2.038 -2.705 15.331 1.00 . A A . 6 GLY C 1 1 18 5698 1 1 6 GLY CA C -1.239 -4.009 15.322 1.00 . A A . 6 GLY CA 1 1 18 5699 1 1 6 GLY H H -1.714 -4.464 13.346 1.00 . A A . 6 GLY H 1 1 18 5700 1 1 6 GLY HA2 H -1.809 -4.793 15.822 1.00 . A A . 6 GLY HA2 1 1 18 5701 1 1 6 GLY HA3 H -0.316 -3.877 15.885 1.00 . A A . 6 GLY HA3 1 1 18 5702 1 1 6 GLY N N -0.929 -4.421 13.964 1.00 . A A . 6 GLY N 1 1 18 5703 1 1 6 GLY O O -1.688 -1.762 16.039 1.00 . A A . 6 GLY O 1 1 18 5704 1 1 7 CYS C C -5.197 -1.763 15.296 1.00 . A A . 7 CYS C 1 1 18 5705 1 1 7 CYS CA C -3.950 -1.519 14.443 1.00 . A A . 7 CYS CA 1 1 18 5706 1 1 7 CYS CB C -4.307 -1.192 12.991 1.00 . A A . 7 CYS CB 1 1 18 5707 1 1 7 CYS H H -3.376 -3.463 13.962 1.00 . A A . 7 CYS H 1 1 18 5708 1 1 7 CYS HA H -3.372 -0.681 14.832 1.00 . A A . 7 CYS HA 1 1 18 5709 1 1 7 CYS HB2 H -4.799 -2.058 12.549 1.00 . A A . 7 CYS HB2 1 1 18 5710 1 1 7 CYS HB3 H -5.030 -0.377 12.984 1.00 . A A . 7 CYS HB3 1 1 18 5711 1 1 7 CYS N N -3.098 -2.692 14.536 1.00 . A A . 7 CYS N 1 1 18 5712 1 1 7 CYS O O -5.353 -2.832 15.882 1.00 . A A . 7 CYS O 1 1 18 5713 1 1 7 CYS SG S -2.885 -0.724 11.939 1.00 . A A . 7 CYS SG 1 1 18 5714 1 1 8 LEU C C -8.335 -1.597 15.296 1.00 . A A . 8 LEU C 1 1 18 5715 1 1 8 LEU CA C -7.281 -0.842 16.109 1.00 . A A . 8 LEU CA 1 1 18 5716 1 1 8 LEU CB C -7.733 0.547 16.562 1.00 . A A . 8 LEU CB 1 1 18 5717 1 1 8 LEU CD1 C -9.143 -0.246 18.496 1.00 . A A . 8 LEU CD1 1 1 18 5718 1 1 8 LEU CD2 C -9.497 2.071 17.525 1.00 . A A . 8 LEU CD2 1 1 18 5719 1 1 8 LEU CG C -9.104 0.621 17.236 1.00 . A A . 8 LEU CG 1 1 18 5720 1 1 8 LEU H H -5.918 0.115 14.858 1.00 . A A . 8 LEU H 1 1 18 5721 1 1 8 LEU HA H -7.060 -1.418 17.008 1.00 . A A . 8 LEU HA 1 1 18 5722 1 1 8 LEU HB2 H -6.989 0.942 17.254 1.00 . A A . 8 LEU HB2 1 1 18 5723 1 1 8 LEU HB3 H -7.741 1.206 15.693 1.00 . A A . 8 LEU HB3 1 1 18 5724 1 1 8 LEU HD11 H -8.272 -0.902 18.513 1.00 . A A . 8 LEU HD11 1 1 18 5725 1 1 8 LEU HD12 H -9.133 0.394 19.378 1.00 . A A . 8 LEU HD12 1 1 18 5726 1 1 8 LEU HD13 H -10.051 -0.849 18.495 1.00 . A A . 8 LEU HD13 1 1 18 5727 1 1 8 LEU HD21 H -8.838 2.742 16.974 1.00 . A A . 8 LEU HD21 1 1 18 5728 1 1 8 LEU HD22 H -10.529 2.237 17.214 1.00 . A A . 8 LEU HD22 1 1 18 5729 1 1 8 LEU HD23 H -9.404 2.265 18.594 1.00 . A A . 8 LEU HD23 1 1 18 5730 1 1 8 LEU HG H -9.846 0.218 16.545 1.00 . A A . 8 LEU HG 1 1 18 5731 1 1 8 LEU N N -6.052 -0.752 15.338 1.00 . A A . 8 LEU N 1 1 18 5732 1 1 8 LEU O O -8.887 -2.592 15.761 1.00 . A A . 8 LEU O 1 1 18 5733 1 1 9 ALA C C -9.960 -0.707 12.129 1.00 . A A . 9 ALA C 1 1 18 5734 1 1 9 ALA CA C -9.558 -1.708 13.213 1.00 . A A . 9 ALA CA 1 1 18 5735 1 1 9 ALA CB C -10.756 -2.191 14.033 1.00 . A A . 9 ALA CB 1 1 18 5736 1 1 9 ALA H H -8.126 -0.284 13.723 1.00 . A A . 9 ALA H 1 1 18 5737 1 1 9 ALA HA H -9.085 -2.570 12.742 1.00 . A A . 9 ALA HA 1 1 18 5738 1 1 9 ALA HB1 H -10.760 -1.687 15.000 1.00 . A A . 9 ALA HB1 1 1 18 5739 1 1 9 ALA HB2 H -11.677 -1.963 13.500 1.00 . A A . 9 ALA HB2 1 1 18 5740 1 1 9 ALA HB3 H -10.681 -3.268 14.186 1.00 . A A . 9 ALA HB3 1 1 18 5741 1 1 9 ALA N N -8.580 -1.094 14.095 1.00 . A A . 9 ALA N 1 1 18 5742 1 1 9 ALA O O -10.822 0.143 12.352 1.00 . A A . 9 ALA O 1 1 18 5743 1 1 10 GLY C C -8.347 0.820 9.445 1.00 . A A . 10 GLY C 1 1 18 5744 1 1 10 GLY CA C -9.598 0.044 9.858 1.00 . A A . 10 GLY CA 1 1 18 5745 1 1 10 GLY H H -8.619 -1.532 10.803 1.00 . A A . 10 GLY H 1 1 18 5746 1 1 10 GLY HA2 H -9.964 -0.539 9.013 1.00 . A A . 10 GLY HA2 1 1 18 5747 1 1 10 GLY HA3 H -10.390 0.742 10.131 1.00 . A A . 10 GLY HA3 1 1 18 5748 1 1 10 GLY N N -9.318 -0.839 10.977 1.00 . A A . 10 GLY N 1 1 18 5749 1 1 10 GLY O O -8.069 0.972 8.256 1.00 . A A . 10 GLY O 1 1 18 5750 1 1 11 TYR C C -5.451 1.272 9.298 1.00 . A A . 11 TYR C 1 1 18 5751 1 1 11 TYR CA C -6.407 2.048 10.207 1.00 . A A . 11 TYR CA 1 1 18 5752 1 1 11 TYR CB C -5.749 2.241 11.574 1.00 . A A . 11 TYR CB 1 1 18 5753 1 1 11 TYR CD1 C -7.507 2.642 13.335 1.00 . A A . 11 TYR CD1 1 1 18 5754 1 1 11 TYR CD2 C -6.248 4.514 12.544 1.00 . A A . 11 TYR CD2 1 1 18 5755 1 1 11 TYR CE1 C -8.240 3.509 14.220 1.00 . A A . 11 TYR CE1 1 1 18 5756 1 1 11 TYR CE2 C -6.981 5.380 13.430 1.00 . A A . 11 TYR CE2 1 1 18 5757 1 1 11 TYR CG C -6.527 3.162 12.515 1.00 . A A . 11 TYR CG 1 1 18 5758 1 1 11 TYR CZ C -7.941 4.836 14.224 1.00 . A A . 11 TYR CZ 1 1 18 5759 1 1 11 TYR H H -7.855 1.163 11.414 1.00 . A A . 11 TYR H 1 1 18 5760 1 1 11 TYR HA H -6.684 2.982 9.716 1.00 . A A . 11 TYR HA 1 1 18 5761 1 1 11 TYR HB2 H -5.632 1.267 12.050 1.00 . A A . 11 TYR HB2 1 1 18 5762 1 1 11 TYR HB3 H -4.747 2.647 11.430 1.00 . A A . 11 TYR HB3 1 1 18 5763 1 1 11 TYR HD1 H -7.727 1.574 13.312 1.00 . A A . 11 TYR HD1 1 1 18 5764 1 1 11 TYR HD2 H -5.474 4.924 11.896 1.00 . A A . 11 TYR HD2 1 1 18 5765 1 1 11 TYR HE1 H -9.018 3.112 14.873 1.00 . A A . 11 TYR HE1 1 1 18 5766 1 1 11 TYR HE2 H -6.771 6.450 13.463 1.00 . A A . 11 TYR HE2 1 1 18 5767 1 1 11 TYR HH H -9.545 5.828 14.692 1.00 . A A . 11 TYR HH 1 1 18 5768 1 1 11 TYR N N -7.623 1.291 10.450 1.00 . A A . 11 TYR N 1 1 18 5769 1 1 11 TYR O O -5.511 0.045 9.230 1.00 . A A . 11 TYR O 1 1 18 5770 1 1 11 TYR OH O -8.632 5.655 15.061 1.00 . A A . 11 TYR OH 1 1 18 5771 1 1 12 MET C C -2.192 1.689 8.192 1.00 . A A . 12 MET C 1 1 18 5772 1 1 12 MET CA C -3.621 1.417 7.722 1.00 . A A . 12 MET CA 1 1 18 5773 1 1 12 MET CB C -3.813 1.984 6.314 1.00 . A A . 12 MET CB 1 1 18 5774 1 1 12 MET CE C -3.736 5.868 5.001 1.00 . A A . 12 MET CE 1 1 18 5775 1 1 12 MET CG C -3.985 3.504 6.353 1.00 . A A . 12 MET CG 1 1 18 5776 1 1 12 MET H H -4.547 3.017 8.683 1.00 . A A . 12 MET H 1 1 18 5777 1 1 12 MET HA H -3.823 0.346 7.750 1.00 . A A . 12 MET HA 1 1 18 5778 1 1 12 MET HB2 H -2.953 1.728 5.695 1.00 . A A . 12 MET HB2 1 1 18 5779 1 1 12 MET HB3 H -4.687 1.528 5.849 1.00 . A A . 12 MET HB3 1 1 18 5780 1 1 12 MET HE1 H -3.141 5.955 5.911 1.00 . A A . 12 MET HE1 1 1 18 5781 1 1 12 MET HE2 H -3.175 6.275 4.160 1.00 . A A . 12 MET HE2 1 1 18 5782 1 1 12 MET HE3 H -4.666 6.424 5.121 1.00 . A A . 12 MET HE3 1 1 18 5783 1 1 12 MET HG2 H -4.881 3.762 6.918 1.00 . A A . 12 MET HG2 1 1 18 5784 1 1 12 MET HG3 H -3.141 3.960 6.870 1.00 . A A . 12 MET HG3 1 1 18 5785 1 1 12 MET N N -4.590 2.019 8.623 1.00 . A A . 12 MET N 1 1 18 5786 1 1 12 MET O O -1.957 2.599 8.986 1.00 . A A . 12 MET O 1 1 18 5787 1 1 12 MET SD S -4.105 4.149 4.693 1.00 . A A . 12 MET SD 1 1 18 5788 1 1 13 ARG C C 0.885 1.767 6.935 1.00 . A A . 13 ARG C 1 1 18 5789 1 1 13 ARG CA C 0.129 1.025 8.039 1.00 . A A . 13 ARG CA 1 1 18 5790 1 1 13 ARG CB C 0.781 -0.340 8.266 1.00 . A A . 13 ARG CB 1 1 18 5791 1 1 13 ARG CD C 1.271 -0.834 10.690 1.00 . A A . 13 ARG CD 1 1 18 5792 1 1 13 ARG CG C 1.827 -0.270 9.381 1.00 . A A . 13 ARG CG 1 1 18 5793 1 1 13 ARG CZ C 2.145 -2.490 12.334 1.00 . A A . 13 ARG CZ 1 1 18 5794 1 1 13 ARG H H -1.471 0.144 7.038 1.00 . A A . 13 ARG H 1 1 18 5795 1 1 13 ARG HA H 0.124 1.600 8.965 1.00 . A A . 13 ARG HA 1 1 18 5796 1 1 13 ARG HB2 H 0.017 -1.074 8.525 1.00 . A A . 13 ARG HB2 1 1 18 5797 1 1 13 ARG HB3 H 1.250 -0.681 7.343 1.00 . A A . 13 ARG HB3 1 1 18 5798 1 1 13 ARG HD2 H 1.350 -0.086 11.479 1.00 . A A . 13 ARG HD2 1 1 18 5799 1 1 13 ARG HD3 H 0.213 -1.066 10.575 1.00 . A A . 13 ARG HD3 1 1 18 5800 1 1 13 ARG HE H 2.454 -2.583 10.347 1.00 . A A . 13 ARG HE 1 1 18 5801 1 1 13 ARG HG2 H 2.715 -0.830 9.087 1.00 . A A . 13 ARG HG2 1 1 18 5802 1 1 13 ARG HG3 H 2.137 0.764 9.528 1.00 . A A . 13 ARG HG3 1 1 18 5803 1 1 13 ARG HH11 H 1.058 -0.978 13.150 1.00 . A A . 13 ARG HH11 1 1 18 5804 1 1 13 ARG HH12 H 1.672 -2.138 14.280 1.00 . A A . 13 ARG HH12 1 1 18 5805 1 1 13 ARG HH21 H 3.265 -4.114 11.837 1.00 . A A . 13 ARG HH21 1 1 18 5806 1 1 13 ARG HH22 H 2.936 -3.934 13.528 1.00 . A A . 13 ARG HH22 1 1 18 5807 1 1 13 ARG N N -1.272 0.883 7.682 1.00 . A A . 13 ARG N 1 1 18 5808 1 1 13 ARG NE N 2.018 -2.053 11.074 1.00 . A A . 13 ARG NE 1 1 18 5809 1 1 13 ARG NH1 N 1.577 -1.811 13.339 1.00 . A A . 13 ARG NH1 1 1 18 5810 1 1 13 ARG NH2 N 2.841 -3.607 12.588 1.00 . A A . 13 ARG NH2 1 1 18 5811 1 1 13 ARG O O 1.158 1.201 5.877 1.00 . A A . 13 ARG O 1 1 18 5812 1 1 14 THR C C 3.248 3.187 5.882 1.00 . A A . 14 THR C 1 1 18 5813 1 1 14 THR CA C 1.921 3.846 6.262 1.00 . A A . 14 THR CA 1 1 18 5814 1 1 14 THR CB C 2.086 5.240 6.870 1.00 . A A . 14 THR CB 1 1 18 5815 1 1 14 THR CG2 C 0.803 5.746 7.531 1.00 . A A . 14 THR CG2 1 1 18 5816 1 1 14 THR H H 0.978 3.474 8.081 1.00 . A A . 14 THR H 1 1 18 5817 1 1 14 THR HA H 1.326 3.913 5.351 1.00 . A A . 14 THR HA 1 1 18 5818 1 1 14 THR HB H 2.446 5.949 6.125 1.00 . A A . 14 THR HB 1 1 18 5819 1 1 14 THR HG1 H 3.773 5.647 7.867 1.00 . A A . 14 THR HG1 1 1 18 5820 1 1 14 THR HG21 H -0.061 5.352 6.998 1.00 . A A . 14 THR HG21 1 1 18 5821 1 1 14 THR HG22 H 0.773 5.412 8.569 1.00 . A A . 14 THR HG22 1 1 18 5822 1 1 14 THR HG23 H 0.784 6.835 7.500 1.00 . A A . 14 THR HG23 1 1 18 5823 1 1 14 THR N N 1.203 3.022 7.218 1.00 . A A . 14 THR N 1 1 18 5824 1 1 14 THR O O 3.417 1.980 6.046 1.00 . A A . 14 THR O 1 1 18 5825 1 1 14 THR OG1 O 2.984 5.041 7.959 1.00 . A A . 14 THR OG1 1 1 18 5826 1 1 15 ALA C C 6.431 3.621 6.158 1.00 . A A . 15 ALA C 1 1 18 5827 1 1 15 ALA CA C 5.466 3.523 4.975 1.00 . A A . 15 ALA CA 1 1 18 5828 1 1 15 ALA CB C 5.952 4.315 3.759 1.00 . A A . 15 ALA CB 1 1 18 5829 1 1 15 ALA H H 4.014 4.991 5.249 1.00 . A A . 15 ALA H 1 1 18 5830 1 1 15 ALA HA H 5.357 2.476 4.691 1.00 . A A . 15 ALA HA 1 1 18 5831 1 1 15 ALA HB1 H 5.109 4.834 3.303 1.00 . A A . 15 ALA HB1 1 1 18 5832 1 1 15 ALA HB2 H 6.698 5.044 4.075 1.00 . A A . 15 ALA HB2 1 1 18 5833 1 1 15 ALA HB3 H 6.394 3.632 3.034 1.00 . A A . 15 ALA HB3 1 1 18 5834 1 1 15 ALA N N 4.159 4.011 5.381 1.00 . A A . 15 ALA N 1 1 18 5835 1 1 15 ALA O O 7.636 3.430 5.999 1.00 . A A . 15 ALA O 1 1 18 5836 1 1 16 ASP C C 6.272 2.933 9.505 1.00 . A A . 16 ASP C 1 1 18 5837 1 1 16 ASP CA C 6.659 4.045 8.528 1.00 . A A . 16 ASP CA 1 1 18 5838 1 1 16 ASP CB C 6.406 5.388 9.216 1.00 . A A . 16 ASP CB 1 1 18 5839 1 1 16 ASP CG C 7.659 6.092 9.739 1.00 . A A . 16 ASP CG 1 1 18 5840 1 1 16 ASP H H 4.884 4.074 7.438 1.00 . A A . 16 ASP H 1 1 18 5841 1 1 16 ASP HA H 7.696 3.969 8.199 1.00 . A A . 16 ASP HA 1 1 18 5842 1 1 16 ASP HB2 H 5.902 6.050 8.512 1.00 . A A . 16 ASP HB2 1 1 18 5843 1 1 16 ASP HB3 H 5.722 5.229 10.050 1.00 . A A . 16 ASP HB3 1 1 18 5844 1 1 16 ASP N N 5.865 3.919 7.318 1.00 . A A . 16 ASP N 1 1 18 5845 1 1 16 ASP O O 7.016 2.633 10.437 1.00 . A A . 16 ASP O 1 1 18 5846 1 1 16 ASP OD1 O 8.341 6.729 8.907 1.00 . A A . 16 ASP OD1 1 1 18 5847 1 1 16 ASP OD2 O 7.907 5.979 10.959 1.00 . A A . 16 ASP OD2 1 1 18 5848 1 1 17 GLY C C 3.621 1.814 11.142 1.00 . A A . 17 GLY C 1 1 18 5849 1 1 17 GLY CA C 4.611 1.280 10.105 1.00 . A A . 17 GLY CA 1 1 18 5850 1 1 17 GLY H H 4.508 2.601 8.497 1.00 . A A . 17 GLY H 1 1 18 5851 1 1 17 GLY HA2 H 4.126 0.522 9.491 1.00 . A A . 17 GLY HA2 1 1 18 5852 1 1 17 GLY HA3 H 5.446 0.795 10.610 1.00 . A A . 17 GLY HA3 1 1 18 5853 1 1 17 GLY N N 5.107 2.351 9.258 1.00 . A A . 17 GLY N 1 1 18 5854 1 1 17 GLY O O 3.139 1.064 11.990 1.00 . A A . 17 GLY O 1 1 18 5855 1 1 18 ARG C C 0.983 3.587 11.461 1.00 . A A . 18 ARG C 1 1 18 5856 1 1 18 ARG CA C 2.421 3.750 11.957 1.00 . A A . 18 ARG CA 1 1 18 5857 1 1 18 ARG CB C 2.738 5.239 12.103 1.00 . A A . 18 ARG CB 1 1 18 5858 1 1 18 ARG CD C 3.001 7.336 10.726 1.00 . A A . 18 ARG CD 1 1 18 5859 1 1 18 ARG CG C 2.222 6.030 10.899 1.00 . A A . 18 ARG CG 1 1 18 5860 1 1 18 ARG CZ C 3.369 9.371 12.117 1.00 . A A . 18 ARG CZ 1 1 18 5861 1 1 18 ARG H H 3.743 3.709 10.347 1.00 . A A . 18 ARG H 1 1 18 5862 1 1 18 ARG HA H 2.569 3.237 12.907 1.00 . A A . 18 ARG HA 1 1 18 5863 1 1 18 ARG HB2 H 2.284 5.623 13.017 1.00 . A A . 18 ARG HB2 1 1 18 5864 1 1 18 ARG HB3 H 3.814 5.378 12.200 1.00 . A A . 18 ARG HB3 1 1 18 5865 1 1 18 ARG HD2 H 4.072 7.134 10.738 1.00 . A A . 18 ARG HD2 1 1 18 5866 1 1 18 ARG HD3 H 2.770 7.781 9.758 1.00 . A A . 18 ARG HD3 1 1 18 5867 1 1 18 ARG HE H 1.832 8.093 12.351 1.00 . A A . 18 ARG HE 1 1 18 5868 1 1 18 ARG HG2 H 2.313 5.426 9.997 1.00 . A A . 18 ARG HG2 1 1 18 5869 1 1 18 ARG HG3 H 1.162 6.249 11.031 1.00 . A A . 18 ARG HG3 1 1 18 5870 1 1 18 ARG HH11 H 4.769 9.064 10.674 1.00 . A A . 18 ARG HH11 1 1 18 5871 1 1 18 ARG HH12 H 5.012 10.475 11.649 1.00 . A A . 18 ARG HH12 1 1 18 5872 1 1 18 ARG HH21 H 2.152 9.954 13.637 1.00 . A A . 18 ARG HH21 1 1 18 5873 1 1 18 ARG HH22 H 3.513 10.984 13.346 1.00 . A A . 18 ARG HH22 1 1 18 5874 1 1 18 ARG N N 3.346 3.106 11.040 1.00 . A A . 18 ARG N 1 1 18 5875 1 1 18 ARG NE N 2.653 8.280 11.812 1.00 . A A . 18 ARG NE 1 1 18 5876 1 1 18 ARG NH1 N 4.477 9.661 11.421 1.00 . A A . 18 ARG NH1 1 1 18 5877 1 1 18 ARG NH2 N 2.978 10.171 13.118 1.00 . A A . 18 ARG NH2 1 1 18 5878 1 1 18 ARG O O 0.641 4.049 10.374 1.00 . A A . 18 ARG O 1 1 18 5879 1 1 19 CYS C C -1.911 4.053 11.826 1.00 . A A . 19 CYS C 1 1 18 5880 1 1 19 CYS CA C -1.214 2.697 11.942 1.00 . A A . 19 CYS CA 1 1 18 5881 1 1 19 CYS CB C -1.902 1.786 12.961 1.00 . A A . 19 CYS CB 1 1 18 5882 1 1 19 CYS H H 0.465 2.555 13.166 1.00 . A A . 19 CYS H 1 1 18 5883 1 1 19 CYS HA H -1.219 2.176 10.985 1.00 . A A . 19 CYS HA 1 1 18 5884 1 1 19 CYS HB2 H -1.797 2.228 13.952 1.00 . A A . 19 CYS HB2 1 1 18 5885 1 1 19 CYS HB3 H -2.969 1.756 12.737 1.00 . A A . 19 CYS HB3 1 1 18 5886 1 1 19 CYS N N 0.179 2.928 12.284 1.00 . A A . 19 CYS N 1 1 18 5887 1 1 19 CYS O O -2.277 4.657 12.834 1.00 . A A . 19 CYS O 1 1 18 5888 1 1 19 CYS SG S -1.265 0.072 13.012 1.00 . A A . 19 CYS SG 1 1 18 5889 1 1 20 LYS C C -4.184 5.524 9.943 1.00 . A A . 20 LYS C 1 1 18 5890 1 1 20 LYS CA C -2.722 5.768 10.325 1.00 . A A . 20 LYS CA 1 1 18 5891 1 1 20 LYS CB C -1.938 6.562 9.279 1.00 . A A . 20 LYS CB 1 1 18 5892 1 1 20 LYS CD C -0.759 8.747 8.836 1.00 . A A . 20 LYS CD 1 1 18 5893 1 1 20 LYS CE C -1.114 10.192 9.193 1.00 . A A . 20 LYS CE 1 1 18 5894 1 1 20 LYS CG C -1.258 7.779 9.910 1.00 . A A . 20 LYS CG 1 1 18 5895 1 1 20 LYS H H -1.776 3.996 9.773 1.00 . A A . 20 LYS H 1 1 18 5896 1 1 20 LYS HA H -2.698 6.343 11.251 1.00 . A A . 20 LYS HA 1 1 18 5897 1 1 20 LYS HB2 H -1.187 5.921 8.817 1.00 . A A . 20 LYS HB2 1 1 18 5898 1 1 20 LYS HB3 H -2.610 6.888 8.485 1.00 . A A . 20 LYS HB3 1 1 18 5899 1 1 20 LYS HD2 H 0.321 8.651 8.728 1.00 . A A . 20 LYS HD2 1 1 18 5900 1 1 20 LYS HD3 H -1.200 8.487 7.874 1.00 . A A . 20 LYS HD3 1 1 18 5901 1 1 20 LYS HE2 H -1.850 10.204 9.997 1.00 . A A . 20 LYS HE2 1 1 18 5902 1 1 20 LYS HE3 H -0.230 10.710 9.563 1.00 . A A . 20 LYS HE3 1 1 18 5903 1 1 20 LYS HG2 H -1.960 8.291 10.569 1.00 . A A . 20 LYS HG2 1 1 18 5904 1 1 20 LYS HG3 H -0.421 7.453 10.528 1.00 . A A . 20 LYS HG3 1 1 18 5905 1 1 20 LYS HZ1 H -2.362 10.342 7.581 1.00 . A A . 20 LYS HZ1 1 1 18 5906 1 1 20 LYS HZ2 H -2.043 11.776 8.295 1.00 . A A . 20 LYS HZ2 1 1 18 5907 1 1 20 LYS HZ3 H -0.914 11.063 7.355 1.00 . A A . 20 LYS HZ3 1 1 18 5908 1 1 20 LYS N N -2.076 4.494 10.587 1.00 . A A . 20 LYS N 1 1 18 5909 1 1 20 LYS NZ N -1.652 10.901 8.010 1.00 . A A . 20 LYS NZ 1 1 18 5910 1 1 20 LYS O O -4.590 4.384 9.724 1.00 . A A . 20 LYS O 1 1 18 5911 1 1 21 PRO C C -6.537 6.307 8.024 1.00 . A A . 21 PRO C 1 1 18 5912 1 1 21 PRO CA C -6.360 6.564 9.522 1.00 . A A . 21 PRO CA 1 1 18 5913 1 1 21 PRO CB C -6.954 7.889 9.972 1.00 . A A . 21 PRO CB 1 1 18 5914 1 1 21 PRO CD C -4.505 8.010 10.127 1.00 . A A . 21 PRO CD 1 1 18 5915 1 1 21 PRO CG C -5.779 8.839 10.132 1.00 . A A . 21 PRO CG 1 1 18 5916 1 1 21 PRO HA H -6.791 5.789 9.985 1.00 . A A . 21 PRO HA 1 1 18 5917 1 1 21 PRO HB2 H -7.666 8.267 9.238 1.00 . A A . 21 PRO HB2 1 1 18 5918 1 1 21 PRO HB3 H -7.496 7.775 10.911 1.00 . A A . 21 PRO HB3 1 1 18 5919 1 1 21 PRO HD2 H -3.814 8.350 9.354 1.00 . A A . 21 PRO HD2 1 1 18 5920 1 1 21 PRO HD3 H -3.980 8.085 11.080 1.00 . A A . 21 PRO HD3 1 1 18 5921 1 1 21 PRO HG2 H -5.763 9.568 9.322 1.00 . A A . 21 PRO HG2 1 1 18 5922 1 1 21 PRO HG3 H -5.865 9.400 11.063 1.00 . A A . 21 PRO HG3 1 1 18 5923 1 1 21 PRO N N -4.953 6.644 9.874 1.00 . A A . 21 PRO N 1 1 18 5924 1 1 21 PRO O O -5.761 6.803 7.209 1.00 . A A . 21 PRO O 1 1 18 5925 1 1 22 THR C C -8.791 6.246 5.710 1.00 . A A . 22 THR C 1 1 18 5926 1 1 22 THR CA C -7.854 5.203 6.321 1.00 . A A . 22 THR CA 1 1 18 5927 1 1 22 THR CB C -8.416 3.781 6.281 1.00 . A A . 22 THR CB 1 1 18 5928 1 1 22 THR CG2 C -8.234 3.118 4.913 1.00 . A A . 22 THR CG2 1 1 18 5929 1 1 22 THR H H -8.191 5.132 8.376 1.00 . A A . 22 THR H 1 1 18 5930 1 1 22 THR HA H -6.921 5.243 5.757 1.00 . A A . 22 THR HA 1 1 18 5931 1 1 22 THR HB H -9.463 3.768 6.584 1.00 . A A . 22 THR HB 1 1 18 5932 1 1 22 THR HG1 H -6.666 2.907 6.703 1.00 . A A . 22 THR HG1 1 1 18 5933 1 1 22 THR HG21 H -7.202 3.238 4.586 1.00 . A A . 22 THR HG21 1 1 18 5934 1 1 22 THR HG22 H -8.471 2.058 4.990 1.00 . A A . 22 THR HG22 1 1 18 5935 1 1 22 THR HG23 H -8.902 3.588 4.191 1.00 . A A . 22 THR HG23 1 1 18 5936 1 1 22 THR N N -7.564 5.532 7.707 1.00 . A A . 22 THR N 1 1 18 5937 1 1 22 THR O O -9.269 6.076 4.589 1.00 . A A . 22 THR O 1 1 18 5938 1 1 22 THR OG1 O -7.555 3.042 7.142 1.00 . A A . 22 THR OG1 1 1 18 5939 1 1 23 PHE C C -9.108 9.656 5.768 1.00 . A A . 23 PHE C 1 1 18 5940 1 1 23 PHE CA C -9.901 8.372 6.023 1.00 . A A . 23 PHE CA 1 1 18 5941 1 1 23 PHE CB C -10.914 8.626 7.140 1.00 . A A . 23 PHE CB 1 1 18 5942 1 1 23 PHE CD1 C -9.612 10.095 8.695 1.00 . A A . 23 PHE CD1 1 1 18 5943 1 1 23 PHE CD2 C -10.381 8.024 9.512 1.00 . A A . 23 PHE CD2 1 1 18 5944 1 1 23 PHE CE1 C -9.023 10.374 9.956 1.00 . A A . 23 PHE CE1 1 1 18 5945 1 1 23 PHE CE2 C -9.792 8.303 10.773 1.00 . A A . 23 PHE CE2 1 1 18 5946 1 1 23 PHE CG C -10.279 8.927 8.500 1.00 . A A . 23 PHE CG 1 1 18 5947 1 1 23 PHE CZ C -9.125 9.472 10.969 1.00 . A A . 23 PHE CZ 1 1 18 5948 1 1 23 PHE H H -8.636 7.433 7.385 1.00 . A A . 23 PHE H 1 1 18 5949 1 1 23 PHE HA H -10.363 8.042 5.091 1.00 . A A . 23 PHE HA 1 1 18 5950 1 1 23 PHE HB2 H -11.552 9.463 6.856 1.00 . A A . 23 PHE HB2 1 1 18 5951 1 1 23 PHE HB3 H -11.559 7.752 7.237 1.00 . A A . 23 PHE HB3 1 1 18 5952 1 1 23 PHE HD1 H -9.531 10.818 7.883 1.00 . A A . 23 PHE HD1 1 1 18 5953 1 1 23 PHE HD2 H -10.916 7.087 9.355 1.00 . A A . 23 PHE HD2 1 1 18 5954 1 1 23 PHE HE1 H -8.488 11.311 10.113 1.00 . A A . 23 PHE HE1 1 1 18 5955 1 1 23 PHE HE2 H -9.874 7.580 11.585 1.00 . A A . 23 PHE HE2 1 1 18 5956 1 1 23 PHE HZ H -8.673 9.686 11.937 1.00 . A A . 23 PHE HZ 1 1 18 5957 1 1 23 PHE N N -9.028 7.302 6.475 1.00 . A A . 23 PHE N 1 1 18 5958 1 1 23 PHE O O -8.426 9.777 4.751 1.00 . A A . 23 PHE O 1 1 19 5959 1 1 1 GLU C C -2.565 -9.068 14.377 1.00 . A A . 1 GLU C 1 1 19 5960 1 1 1 GLU CA C -1.812 -9.763 15.513 1.00 . A A . 1 GLU CA 1 1 19 5961 1 1 1 GLU CB C -1.759 -8.876 16.759 1.00 . A A . 1 GLU CB 1 1 19 5962 1 1 1 GLU CD C -3.252 -7.649 18.379 1.00 . A A . 1 GLU CD 1 1 19 5963 1 1 1 GLU CG C -3.097 -8.893 17.501 1.00 . A A . 1 GLU CG 1 1 19 5964 1 1 1 GLU HA H -2.305 -10.702 15.764 1.00 . A A . 1 GLU HA 1 1 19 5965 1 1 1 GLU HB2 H -0.966 -9.222 17.423 1.00 . A A . 1 GLU HB2 1 1 19 5966 1 1 1 GLU HB3 H -1.511 -7.854 16.472 1.00 . A A . 1 GLU HB3 1 1 19 5967 1 1 1 GLU HG2 H -3.915 -8.940 16.782 1.00 . A A . 1 GLU HG2 1 1 19 5968 1 1 1 GLU HG3 H -3.163 -9.789 18.119 1.00 . A A . 1 GLU HG3 1 1 19 5969 1 1 1 GLU N N -0.475 -10.132 15.080 1.00 . A A . 1 GLU N 1 1 19 5970 1 1 1 GLU O O -2.255 -7.930 14.026 1.00 . A A . 1 GLU O 1 1 19 5971 1 1 1 GLU OE1 O -2.404 -7.482 19.282 1.00 . A A . 1 GLU OE1 1 1 19 5972 1 1 1 GLU OE2 O -4.216 -6.894 18.127 1.00 . A A . 1 GLU OE2 1 1 19 5973 1 1 2 ASN C C -3.498 -9.211 11.469 1.00 . A A . 2 ASN C 1 1 19 5974 1 1 2 ASN CA C -4.341 -9.247 12.746 1.00 . A A . 2 ASN CA 1 1 19 5975 1 1 2 ASN CB C -4.801 -7.820 13.049 1.00 . A A . 2 ASN CB 1 1 19 5976 1 1 2 ASN CG C -5.281 -7.694 14.496 1.00 . A A . 2 ASN CG 1 1 19 5977 1 1 2 ASN H H -3.786 -10.705 14.126 1.00 . A A . 2 ASN H 1 1 19 5978 1 1 2 ASN HA H -5.195 -9.919 12.662 1.00 . A A . 2 ASN HA 1 1 19 5979 1 1 2 ASN HB2 H -3.981 -7.124 12.872 1.00 . A A . 2 ASN HB2 1 1 19 5980 1 1 2 ASN HB3 H -5.607 -7.542 12.369 1.00 . A A . 2 ASN HB3 1 1 19 5981 1 1 2 ASN HD21 H -7.035 -8.539 13.937 1.00 . A A . 2 ASN HD21 1 1 19 5982 1 1 2 ASN HD22 H -6.916 -8.117 15.613 1.00 . A A . 2 ASN HD22 1 1 19 5983 1 1 2 ASN N N -3.541 -9.781 13.835 1.00 . A A . 2 ASN N 1 1 19 5984 1 1 2 ASN ND2 N -6.512 -8.155 14.698 1.00 . A A . 2 ASN ND2 1 1 19 5985 1 1 2 ASN O O -2.272 -9.127 11.533 1.00 . A A . 2 ASN O 1 1 19 5986 1 1 2 ASN OD1 O -4.581 -7.212 15.369 1.00 . A A . 2 ASN OD1 1 1 19 5987 1 1 3 PHE C C -3.359 -7.817 8.543 1.00 . A A . 3 PHE C 1 1 19 5988 1 1 3 PHE CA C -3.519 -9.251 9.051 1.00 . A A . 3 PHE CA 1 1 19 5989 1 1 3 PHE CB C -4.400 -10.031 8.074 1.00 . A A . 3 PHE CB 1 1 19 5990 1 1 3 PHE CD1 C -3.045 -12.091 7.637 1.00 . A A . 3 PHE CD1 1 1 19 5991 1 1 3 PHE CD2 C -3.511 -10.666 5.820 1.00 . A A . 3 PHE CD2 1 1 19 5992 1 1 3 PHE CE1 C -2.324 -12.957 6.772 1.00 . A A . 3 PHE CE1 1 1 19 5993 1 1 3 PHE CE2 C -2.790 -11.531 4.955 1.00 . A A . 3 PHE CE2 1 1 19 5994 1 1 3 PHE CG C -3.623 -10.964 7.142 1.00 . A A . 3 PHE CG 1 1 19 5995 1 1 3 PHE CZ C -2.212 -12.659 5.450 1.00 . A A . 3 PHE CZ 1 1 19 5996 1 1 3 PHE H H -5.185 -9.344 10.298 1.00 . A A . 3 PHE H 1 1 19 5997 1 1 3 PHE HA H -2.533 -9.698 9.190 1.00 . A A . 3 PHE HA 1 1 19 5998 1 1 3 PHE HB2 H -5.121 -10.620 8.641 1.00 . A A . 3 PHE HB2 1 1 19 5999 1 1 3 PHE HB3 H -4.970 -9.324 7.470 1.00 . A A . 3 PHE HB3 1 1 19 6000 1 1 3 PHE HD1 H -3.135 -12.330 8.696 1.00 . A A . 3 PHE HD1 1 1 19 6001 1 1 3 PHE HD2 H -3.973 -9.761 5.424 1.00 . A A . 3 PHE HD2 1 1 19 6002 1 1 3 PHE HE1 H -1.861 -13.861 7.167 1.00 . A A . 3 PHE HE1 1 1 19 6003 1 1 3 PHE HE2 H -2.699 -11.292 3.896 1.00 . A A . 3 PHE HE2 1 1 19 6004 1 1 3 PHE HZ H -1.659 -13.323 4.786 1.00 . A A . 3 PHE HZ 1 1 19 6005 1 1 3 PHE N N -4.188 -9.276 10.340 1.00 . A A . 3 PHE N 1 1 19 6006 1 1 3 PHE O O -3.347 -7.580 7.335 1.00 . A A . 3 PHE O 1 1 19 6007 1 1 4 ASN C C -1.723 -5.003 9.651 1.00 . A A . 4 ASN C 1 1 19 6008 1 1 4 ASN CA C -3.084 -5.493 9.152 1.00 . A A . 4 ASN CA 1 1 19 6009 1 1 4 ASN CB C -4.166 -4.642 9.820 1.00 . A A . 4 ASN CB 1 1 19 6010 1 1 4 ASN CG C -3.840 -3.151 9.704 1.00 . A A . 4 ASN CG 1 1 19 6011 1 1 4 ASN H H -3.253 -7.098 10.469 1.00 . A A . 4 ASN H 1 1 19 6012 1 1 4 ASN HA H -3.173 -5.447 8.067 1.00 . A A . 4 ASN HA 1 1 19 6013 1 1 4 ASN HB2 H -5.131 -4.844 9.356 1.00 . A A . 4 ASN HB2 1 1 19 6014 1 1 4 ASN HB3 H -4.254 -4.918 10.871 1.00 . A A . 4 ASN HB3 1 1 19 6015 1 1 4 ASN HD21 H -5.049 -3.061 8.084 1.00 . A A . 4 ASN HD21 1 1 19 6016 1 1 4 ASN HD22 H -4.295 -1.567 8.529 1.00 . A A . 4 ASN HD22 1 1 19 6017 1 1 4 ASN N N -3.242 -6.897 9.489 1.00 . A A . 4 ASN N 1 1 19 6018 1 1 4 ASN ND2 N -4.445 -2.542 8.688 1.00 . A A . 4 ASN ND2 1 1 19 6019 1 1 4 ASN O O -1.356 -3.849 9.433 1.00 . A A . 4 ASN O 1 1 19 6020 1 1 4 ASN OD1 O -3.089 -2.591 10.485 1.00 . A A . 4 ASN OD1 1 1 19 6021 1 1 5 GLY C C 0.237 -5.318 12.345 1.00 . A A . 5 GLY C 1 1 19 6022 1 1 5 GLY CA C 0.303 -5.580 10.840 1.00 . A A . 5 GLY CA 1 1 19 6023 1 1 5 GLY H H -1.315 -6.842 10.481 1.00 . A A . 5 GLY H 1 1 19 6024 1 1 5 GLY HA2 H 0.993 -6.399 10.639 1.00 . A A . 5 GLY HA2 1 1 19 6025 1 1 5 GLY HA3 H 0.696 -4.700 10.331 1.00 . A A . 5 GLY HA3 1 1 19 6026 1 1 5 GLY N N -1.010 -5.905 10.309 1.00 . A A . 5 GLY N 1 1 19 6027 1 1 5 GLY O O 1.156 -5.672 13.081 1.00 . A A . 5 GLY O 1 1 19 6028 1 1 6 GLY C C -1.711 -3.014 14.333 1.00 . A A . 6 GLY C 1 1 19 6029 1 1 6 GLY CA C -1.059 -4.388 14.164 1.00 . A A . 6 GLY CA 1 1 19 6030 1 1 6 GLY H H -1.604 -4.416 12.153 1.00 . A A . 6 GLY H 1 1 19 6031 1 1 6 GLY HA2 H -1.686 -5.151 14.625 1.00 . A A . 6 GLY HA2 1 1 19 6032 1 1 6 GLY HA3 H -0.102 -4.406 14.683 1.00 . A A . 6 GLY HA3 1 1 19 6033 1 1 6 GLY N N -0.860 -4.700 12.759 1.00 . A A . 6 GLY N 1 1 19 6034 1 1 6 GLY O O -1.050 -2.055 14.727 1.00 . A A . 6 GLY O 1 1 19 6035 1 1 7 CYS C C -4.969 -1.978 15.022 1.00 . A A . 7 CYS C 1 1 19 6036 1 1 7 CYS CA C -3.747 -1.723 14.139 1.00 . A A . 7 CYS CA 1 1 19 6037 1 1 7 CYS CB C -4.139 -1.172 12.766 1.00 . A A . 7 CYS CB 1 1 19 6038 1 1 7 CYS H H -3.528 -3.749 13.704 1.00 . A A . 7 CYS H 1 1 19 6039 1 1 7 CYS HA H -3.079 -0.996 14.601 1.00 . A A . 7 CYS HA 1 1 19 6040 1 1 7 CYS HB2 H -4.428 -2.004 12.125 1.00 . A A . 7 CYS HB2 1 1 19 6041 1 1 7 CYS HB3 H -5.019 -0.538 12.882 1.00 . A A . 7 CYS HB3 1 1 19 6042 1 1 7 CYS N N -2.999 -2.964 14.025 1.00 . A A . 7 CYS N 1 1 19 6043 1 1 7 CYS O O -5.206 -3.107 15.450 1.00 . A A . 7 CYS O 1 1 19 6044 1 1 7 CYS SG S -2.831 -0.209 11.922 1.00 . A A . 7 CYS SG 1 1 19 6045 1 1 8 LEU C C -8.030 -1.659 15.285 1.00 . A A . 8 LEU C 1 1 19 6046 1 1 8 LEU CA C -6.907 -1.005 16.093 1.00 . A A . 8 LEU CA 1 1 19 6047 1 1 8 LEU CB C -7.276 0.368 16.659 1.00 . A A . 8 LEU CB 1 1 19 6048 1 1 8 LEU CD1 C -8.614 -0.463 18.629 1.00 . A A . 8 LEU CD1 1 1 19 6049 1 1 8 LEU CD2 C -8.950 1.897 17.763 1.00 . A A . 8 LEU CD2 1 1 19 6050 1 1 8 LEU CG C -8.612 0.450 17.402 1.00 . A A . 8 LEU CG 1 1 19 6051 1 1 8 LEU H H -5.515 0.004 14.916 1.00 . A A . 8 LEU H 1 1 19 6052 1 1 8 LEU HA H -6.670 -1.650 16.938 1.00 . A A . 8 LEU HA 1 1 19 6053 1 1 8 LEU HB2 H -6.485 0.682 17.340 1.00 . A A . 8 LEU HB2 1 1 19 6054 1 1 8 LEU HB3 H -7.295 1.084 15.838 1.00 . A A . 8 LEU HB3 1 1 19 6055 1 1 8 LEU HD11 H -7.893 -1.269 18.484 1.00 . A A . 8 LEU HD11 1 1 19 6056 1 1 8 LEU HD12 H -8.341 0.114 19.512 1.00 . A A . 8 LEU HD12 1 1 19 6057 1 1 8 LEU HD13 H -9.609 -0.887 18.765 1.00 . A A . 8 LEU HD13 1 1 19 6058 1 1 8 LEU HD21 H -8.030 2.445 17.968 1.00 . A A . 8 LEU HD21 1 1 19 6059 1 1 8 LEU HD22 H -9.475 2.366 16.932 1.00 . A A . 8 LEU HD22 1 1 19 6060 1 1 8 LEU HD23 H -9.586 1.912 18.649 1.00 . A A . 8 LEU HD23 1 1 19 6061 1 1 8 LEU HG H -9.396 0.093 16.733 1.00 . A A . 8 LEU HG 1 1 19 6062 1 1 8 LEU N N -5.714 -0.910 15.268 1.00 . A A . 8 LEU N 1 1 19 6063 1 1 8 LEU O O -8.599 -2.665 15.707 1.00 . A A . 8 LEU O 1 1 19 6064 1 1 9 ALA C C -9.780 -0.479 12.283 1.00 . A A . 9 ALA C 1 1 19 6065 1 1 9 ALA CA C -9.361 -1.573 13.267 1.00 . A A . 9 ALA CA 1 1 19 6066 1 1 9 ALA CB C -10.532 -2.074 14.115 1.00 . A A . 9 ALA CB 1 1 19 6067 1 1 9 ALA H H -7.849 -0.243 13.802 1.00 . A A . 9 ALA H 1 1 19 6068 1 1 9 ALA HA H -8.947 -2.412 12.709 1.00 . A A . 9 ALA HA 1 1 19 6069 1 1 9 ALA HB1 H -10.484 -1.620 15.104 1.00 . A A . 9 ALA HB1 1 1 19 6070 1 1 9 ALA HB2 H -11.471 -1.800 13.635 1.00 . A A . 9 ALA HB2 1 1 19 6071 1 1 9 ALA HB3 H -10.474 -3.158 14.209 1.00 . A A . 9 ALA HB3 1 1 19 6072 1 1 9 ALA N N -8.316 -1.061 14.137 1.00 . A A . 9 ALA N 1 1 19 6073 1 1 9 ALA O O -10.585 0.389 12.619 1.00 . A A . 9 ALA O 1 1 19 6074 1 1 10 GLY C C -8.260 1.168 9.617 1.00 . A A . 10 GLY C 1 1 19 6075 1 1 10 GLY CA C -9.520 0.417 10.052 1.00 . A A . 10 GLY CA 1 1 19 6076 1 1 10 GLY H H -8.562 -1.265 10.822 1.00 . A A . 10 GLY H 1 1 19 6077 1 1 10 GLY HA2 H -9.961 -0.087 9.192 1.00 . A A . 10 GLY HA2 1 1 19 6078 1 1 10 GLY HA3 H -10.262 1.126 10.420 1.00 . A A . 10 GLY HA3 1 1 19 6079 1 1 10 GLY N N -9.215 -0.556 11.086 1.00 . A A . 10 GLY N 1 1 19 6080 1 1 10 GLY O O -8.065 1.426 8.429 1.00 . A A . 10 GLY O 1 1 19 6081 1 1 11 TYR C C -5.352 1.478 9.300 1.00 . A A . 11 TYR C 1 1 19 6082 1 1 11 TYR CA C -6.202 2.217 10.336 1.00 . A A . 11 TYR CA 1 1 19 6083 1 1 11 TYR CB C -5.445 2.258 11.664 1.00 . A A . 11 TYR CB 1 1 19 6084 1 1 11 TYR CD1 C -6.095 4.529 12.546 1.00 . A A . 11 TYR CD1 1 1 19 6085 1 1 11 TYR CD2 C -6.661 2.604 13.845 1.00 . A A . 11 TYR CD2 1 1 19 6086 1 1 11 TYR CE1 C -6.701 5.378 13.539 1.00 . A A . 11 TYR CE1 1 1 19 6087 1 1 11 TYR CE2 C -7.267 3.453 14.838 1.00 . A A . 11 TYR CE2 1 1 19 6088 1 1 11 TYR CG C -6.088 3.160 12.719 1.00 . A A . 11 TYR CG 1 1 19 6089 1 1 11 TYR CZ C -7.257 4.798 14.636 1.00 . A A . 11 TYR CZ 1 1 19 6090 1 1 11 TYR H H -7.605 1.286 11.565 1.00 . A A . 11 TYR H 1 1 19 6091 1 1 11 TYR HA H -6.462 3.201 9.947 1.00 . A A . 11 TYR HA 1 1 19 6092 1 1 11 TYR HB2 H -5.373 1.245 12.062 1.00 . A A . 11 TYR HB2 1 1 19 6093 1 1 11 TYR HB3 H -4.427 2.601 11.480 1.00 . A A . 11 TYR HB3 1 1 19 6094 1 1 11 TYR HD1 H -5.642 4.967 11.656 1.00 . A A . 11 TYR HD1 1 1 19 6095 1 1 11 TYR HD2 H -6.657 1.522 13.983 1.00 . A A . 11 TYR HD2 1 1 19 6096 1 1 11 TYR HE1 H -6.713 6.461 13.414 1.00 . A A . 11 TYR HE1 1 1 19 6097 1 1 11 TYR HE2 H -7.723 3.027 15.732 1.00 . A A . 11 TYR HE2 1 1 19 6098 1 1 11 TYR HH H -8.140 6.452 15.153 1.00 . A A . 11 TYR HH 1 1 19 6099 1 1 11 TYR N N -7.438 1.499 10.601 1.00 . A A . 11 TYR N 1 1 19 6100 1 1 11 TYR O O -5.463 0.262 9.153 1.00 . A A . 11 TYR O 1 1 19 6101 1 1 11 TYR OH O -7.828 5.599 15.574 1.00 . A A . 11 TYR OH 1 1 19 6102 1 1 12 MET C C -2.192 1.687 8.050 1.00 . A A . 12 MET C 1 1 19 6103 1 1 12 MET CA C -3.652 1.677 7.591 1.00 . A A . 12 MET CA 1 1 19 6104 1 1 12 MET CB C -3.787 2.484 6.298 1.00 . A A . 12 MET CB 1 1 19 6105 1 1 12 MET CE C -2.973 6.414 5.488 1.00 . A A . 12 MET CE 1 1 19 6106 1 1 12 MET CG C -3.605 3.980 6.564 1.00 . A A . 12 MET CG 1 1 19 6107 1 1 12 MET H H -4.437 3.233 8.734 1.00 . A A . 12 MET H 1 1 19 6108 1 1 12 MET HA H -3.992 0.651 7.456 1.00 . A A . 12 MET HA 1 1 19 6109 1 1 12 MET HB2 H -3.044 2.146 5.576 1.00 . A A . 12 MET HB2 1 1 19 6110 1 1 12 MET HB3 H -4.767 2.307 5.854 1.00 . A A . 12 MET HB3 1 1 19 6111 1 1 12 MET HE1 H -3.517 6.565 6.421 1.00 . A A . 12 MET HE1 1 1 19 6112 1 1 12 MET HE2 H -2.070 7.024 5.491 1.00 . A A . 12 MET HE2 1 1 19 6113 1 1 12 MET HE3 H -3.605 6.704 4.649 1.00 . A A . 12 MET HE3 1 1 19 6114 1 1 12 MET HG2 H -4.572 4.481 6.547 1.00 . A A . 12 MET HG2 1 1 19 6115 1 1 12 MET HG3 H -3.184 4.133 7.557 1.00 . A A . 12 MET HG3 1 1 19 6116 1 1 12 MET N N -4.521 2.244 8.609 1.00 . A A . 12 MET N 1 1 19 6117 1 1 12 MET O O -1.845 2.367 9.014 1.00 . A A . 12 MET O 1 1 19 6118 1 1 12 MET SD S -2.528 4.693 5.331 1.00 . A A . 12 MET SD 1 1 19 6119 1 1 13 ARG C C 0.846 1.773 6.762 1.00 . A A . 13 ARG C 1 1 19 6120 1 1 13 ARG CA C 0.037 0.835 7.660 1.00 . A A . 13 ARG CA 1 1 19 6121 1 1 13 ARG CB C 0.553 -0.595 7.486 1.00 . A A . 13 ARG CB 1 1 19 6122 1 1 13 ARG CD C 2.139 -1.908 8.943 1.00 . A A . 13 ARG CD 1 1 19 6123 1 1 13 ARG CG C 0.749 -1.275 8.843 1.00 . A A . 13 ARG CG 1 1 19 6124 1 1 13 ARG CZ C 3.687 -2.501 10.803 1.00 . A A . 13 ARG CZ 1 1 19 6125 1 1 13 ARG H H -1.667 0.374 6.554 1.00 . A A . 13 ARG H 1 1 19 6126 1 1 13 ARG HA H 0.105 1.137 8.705 1.00 . A A . 13 ARG HA 1 1 19 6127 1 1 13 ARG HB2 H -0.153 -1.170 6.886 1.00 . A A . 13 ARG HB2 1 1 19 6128 1 1 13 ARG HB3 H 1.497 -0.582 6.942 1.00 . A A . 13 ARG HB3 1 1 19 6129 1 1 13 ARG HD2 H 2.173 -2.825 8.355 1.00 . A A . 13 ARG HD2 1 1 19 6130 1 1 13 ARG HD3 H 2.885 -1.233 8.526 1.00 . A A . 13 ARG HD3 1 1 19 6131 1 1 13 ARG HE H 1.713 -2.178 11.023 1.00 . A A . 13 ARG HE 1 1 19 6132 1 1 13 ARG HG2 H 0.619 -0.545 9.642 1.00 . A A . 13 ARG HG2 1 1 19 6133 1 1 13 ARG HG3 H -0.014 -2.041 8.984 1.00 . A A . 13 ARG HG3 1 1 19 6134 1 1 13 ARG HH11 H 4.570 -2.357 8.977 1.00 . A A . 13 ARG HH11 1 1 19 6135 1 1 13 ARG HH12 H 5.634 -2.769 10.280 1.00 . A A . 13 ARG HH12 1 1 19 6136 1 1 13 ARG HH21 H 3.116 -2.721 12.742 1.00 . A A . 13 ARG HH21 1 1 19 6137 1 1 13 ARG HH22 H 4.802 -2.977 12.436 1.00 . A A . 13 ARG HH22 1 1 19 6138 1 1 13 ARG N N -1.377 0.924 7.338 1.00 . A A . 13 ARG N 1 1 19 6139 1 1 13 ARG NE N 2.459 -2.203 10.358 1.00 . A A . 13 ARG NE 1 1 19 6140 1 1 13 ARG NH1 N 4.718 -2.546 9.947 1.00 . A A . 13 ARG NH1 1 1 19 6141 1 1 13 ARG NH2 N 3.885 -2.755 12.104 1.00 . A A . 13 ARG NH2 1 1 19 6142 1 1 13 ARG O O 1.038 1.495 5.579 1.00 . A A . 13 ARG O 1 1 19 6143 1 1 14 THR C C 3.405 3.233 6.162 1.00 . A A . 14 THR C 1 1 19 6144 1 1 14 THR CA C 2.084 3.846 6.627 1.00 . A A . 14 THR CA 1 1 19 6145 1 1 14 THR CB C 2.267 5.071 7.527 1.00 . A A . 14 THR CB 1 1 19 6146 1 1 14 THR CG2 C 0.967 5.856 7.718 1.00 . A A . 14 THR CG2 1 1 19 6147 1 1 14 THR H H 1.138 3.085 8.320 1.00 . A A . 14 THR H 1 1 19 6148 1 1 14 THR HA H 1.531 4.132 5.732 1.00 . A A . 14 THR HA 1 1 19 6149 1 1 14 THR HB H 3.060 5.716 7.150 1.00 . A A . 14 THR HB 1 1 19 6150 1 1 14 THR HG1 H 3.279 3.859 8.756 1.00 . A A . 14 THR HG1 1 1 19 6151 1 1 14 THR HG21 H 0.208 5.474 7.035 1.00 . A A . 14 THR HG21 1 1 19 6152 1 1 14 THR HG22 H 0.622 5.744 8.745 1.00 . A A . 14 THR HG22 1 1 19 6153 1 1 14 THR HG23 H 1.146 6.911 7.509 1.00 . A A . 14 THR HG23 1 1 19 6154 1 1 14 THR N N 1.298 2.866 7.358 1.00 . A A . 14 THR N 1 1 19 6155 1 1 14 THR O O 3.584 2.017 6.223 1.00 . A A . 14 THR O 1 1 19 6156 1 1 14 THR OG1 O 2.530 4.520 8.814 1.00 . A A . 14 THR OG1 1 1 19 6157 1 1 15 ALA C C 6.518 3.416 6.429 1.00 . A A . 15 ALA C 1 1 19 6158 1 1 15 ALA CA C 5.597 3.658 5.232 1.00 . A A . 15 ALA CA 1 1 19 6159 1 1 15 ALA CB C 6.164 4.696 4.260 1.00 . A A . 15 ALA CB 1 1 19 6160 1 1 15 ALA H H 4.143 5.088 5.661 1.00 . A A . 15 ALA H 1 1 19 6161 1 1 15 ALA HA H 5.453 2.719 4.698 1.00 . A A . 15 ALA HA 1 1 19 6162 1 1 15 ALA HB1 H 5.832 5.691 4.555 1.00 . A A . 15 ALA HB1 1 1 19 6163 1 1 15 ALA HB2 H 7.253 4.655 4.281 1.00 . A A . 15 ALA HB2 1 1 19 6164 1 1 15 ALA HB3 H 5.812 4.480 3.252 1.00 . A A . 15 ALA HB3 1 1 19 6165 1 1 15 ALA N N 4.297 4.101 5.707 1.00 . A A . 15 ALA N 1 1 19 6166 1 1 15 ALA O O 7.668 3.016 6.261 1.00 . A A . 15 ALA O 1 1 19 6167 1 1 16 ASP C C 5.985 2.515 9.755 1.00 . A A . 16 ASP C 1 1 19 6168 1 1 16 ASP CA C 6.736 3.482 8.837 1.00 . A A . 16 ASP CA 1 1 19 6169 1 1 16 ASP CB C 6.909 4.806 9.585 1.00 . A A . 16 ASP CB 1 1 19 6170 1 1 16 ASP CG C 8.343 5.335 9.639 1.00 . A A . 16 ASP CG 1 1 19 6171 1 1 16 ASP H H 5.040 3.994 7.741 1.00 . A A . 16 ASP H 1 1 19 6172 1 1 16 ASP HA H 7.701 3.090 8.519 1.00 . A A . 16 ASP HA 1 1 19 6173 1 1 16 ASP HB2 H 6.278 5.558 9.112 1.00 . A A . 16 ASP HB2 1 1 19 6174 1 1 16 ASP HB3 H 6.545 4.680 10.605 1.00 . A A . 16 ASP HB3 1 1 19 6175 1 1 16 ASP N N 5.977 3.669 7.612 1.00 . A A . 16 ASP N 1 1 19 6176 1 1 16 ASP O O 6.458 2.194 10.844 1.00 . A A . 16 ASP O 1 1 19 6177 1 1 16 ASP OD1 O 8.984 5.349 8.566 1.00 . A A . 16 ASP OD1 1 1 19 6178 1 1 16 ASP OD2 O 8.767 5.713 10.753 1.00 . A A . 16 ASP OD2 1 1 19 6179 1 1 17 GLY C C 2.977 1.908 10.891 1.00 . A A . 17 GLY C 1 1 19 6180 1 1 17 GLY CA C 4.006 1.155 10.045 1.00 . A A . 17 GLY CA 1 1 19 6181 1 1 17 GLY H H 4.450 2.345 8.394 1.00 . A A . 17 GLY H 1 1 19 6182 1 1 17 GLY HA2 H 3.496 0.471 9.368 1.00 . A A . 17 GLY HA2 1 1 19 6183 1 1 17 GLY HA3 H 4.640 0.550 10.694 1.00 . A A . 17 GLY HA3 1 1 19 6184 1 1 17 GLY N N 4.828 2.079 9.282 1.00 . A A . 17 GLY N 1 1 19 6185 1 1 17 GLY O O 2.022 1.313 11.389 1.00 . A A . 17 GLY O 1 1 19 6186 1 1 18 ARG C C 0.859 3.815 11.372 1.00 . A A . 18 ARG C 1 1 19 6187 1 1 18 ARG CA C 2.310 4.047 11.802 1.00 . A A . 18 ARG CA 1 1 19 6188 1 1 18 ARG CB C 2.655 5.527 11.628 1.00 . A A . 18 ARG CB 1 1 19 6189 1 1 18 ARG CD C 4.347 7.300 12.225 1.00 . A A . 18 ARG CD 1 1 19 6190 1 1 18 ARG CG C 4.106 5.802 12.029 1.00 . A A . 18 ARG CG 1 1 19 6191 1 1 18 ARG CZ C 5.853 8.677 13.654 1.00 . A A . 18 ARG CZ 1 1 19 6192 1 1 18 ARG H H 3.984 3.682 10.617 1.00 . A A . 18 ARG H 1 1 19 6193 1 1 18 ARG HA H 2.466 3.740 12.836 1.00 . A A . 18 ARG HA 1 1 19 6194 1 1 18 ARG HB2 H 2.499 5.821 10.590 1.00 . A A . 18 ARG HB2 1 1 19 6195 1 1 18 ARG HB3 H 1.985 6.134 12.236 1.00 . A A . 18 ARG HB3 1 1 19 6196 1 1 18 ARG HD2 H 4.475 7.785 11.257 1.00 . A A . 18 ARG HD2 1 1 19 6197 1 1 18 ARG HD3 H 3.478 7.757 12.699 1.00 . A A . 18 ARG HD3 1 1 19 6198 1 1 18 ARG HE H 6.173 6.744 13.191 1.00 . A A . 18 ARG HE 1 1 19 6199 1 1 18 ARG HG2 H 4.339 5.269 12.951 1.00 . A A . 18 ARG HG2 1 1 19 6200 1 1 18 ARG HG3 H 4.778 5.419 11.261 1.00 . A A . 18 ARG HG3 1 1 19 6201 1 1 18 ARG HH11 H 4.216 9.659 12.955 1.00 . A A . 18 ARG HH11 1 1 19 6202 1 1 18 ARG HH12 H 5.273 10.603 13.950 1.00 . A A . 18 ARG HH12 1 1 19 6203 1 1 18 ARG HH21 H 7.568 7.990 14.504 1.00 . A A . 18 ARG HH21 1 1 19 6204 1 1 18 ARG HH22 H 7.193 9.647 14.837 1.00 . A A . 18 ARG HH22 1 1 19 6205 1 1 18 ARG N N 3.205 3.206 11.026 1.00 . A A . 18 ARG N 1 1 19 6206 1 1 18 ARG NE N 5.549 7.515 13.061 1.00 . A A . 18 ARG NE 1 1 19 6207 1 1 18 ARG NH1 N 5.046 9.736 13.507 1.00 . A A . 18 ARG NH1 1 1 19 6208 1 1 18 ARG NH2 N 6.966 8.780 14.394 1.00 . A A . 18 ARG NH2 1 1 19 6209 1 1 18 ARG O O 0.476 4.162 10.257 1.00 . A A . 18 ARG O 1 1 19 6210 1 1 19 CYS C C -2.027 4.276 11.770 1.00 . A A . 19 CYS C 1 1 19 6211 1 1 19 CYS CA C -1.307 2.947 12.010 1.00 . A A . 19 CYS CA 1 1 19 6212 1 1 19 CYS CB C -1.952 2.146 13.142 1.00 . A A . 19 CYS CB 1 1 19 6213 1 1 19 CYS H H 0.413 2.950 13.186 1.00 . A A . 19 CYS H 1 1 19 6214 1 1 19 CYS HA H -1.334 2.326 11.115 1.00 . A A . 19 CYS HA 1 1 19 6215 1 1 19 CYS HB2 H -1.760 2.656 14.085 1.00 . A A . 19 CYS HB2 1 1 19 6216 1 1 19 CYS HB3 H -3.032 2.141 12.996 1.00 . A A . 19 CYS HB3 1 1 19 6217 1 1 19 CYS N N 0.092 3.230 12.281 1.00 . A A . 19 CYS N 1 1 19 6218 1 1 19 CYS O O -2.482 4.919 12.714 1.00 . A A . 19 CYS O 1 1 19 6219 1 1 19 CYS SG S -1.372 0.416 13.284 1.00 . A A . 19 CYS SG 1 1 19 6220 1 1 20 LYS C C -4.236 5.607 9.818 1.00 . A A . 20 LYS C 1 1 19 6221 1 1 20 LYS CA C -2.764 5.887 10.124 1.00 . A A . 20 LYS CA 1 1 19 6222 1 1 20 LYS CB C -2.014 6.562 8.973 1.00 . A A . 20 LYS CB 1 1 19 6223 1 1 20 LYS CD C -0.886 8.725 8.333 1.00 . A A . 20 LYS CD 1 1 19 6224 1 1 20 LYS CE C 0.589 9.130 8.346 1.00 . A A . 20 LYS CE 1 1 19 6225 1 1 20 LYS CG C -1.198 7.755 9.475 1.00 . A A . 20 LYS CG 1 1 19 6226 1 1 20 LYS H H -1.733 4.118 9.739 1.00 . A A . 20 LYS H 1 1 19 6227 1 1 20 LYS HA H -2.710 6.559 10.981 1.00 . A A . 20 LYS HA 1 1 19 6228 1 1 20 LYS HB2 H -1.353 5.842 8.492 1.00 . A A . 20 LYS HB2 1 1 19 6229 1 1 20 LYS HB3 H -2.726 6.896 8.217 1.00 . A A . 20 LYS HB3 1 1 19 6230 1 1 20 LYS HD2 H -1.131 8.260 7.379 1.00 . A A . 20 LYS HD2 1 1 19 6231 1 1 20 LYS HD3 H -1.511 9.613 8.425 1.00 . A A . 20 LYS HD3 1 1 19 6232 1 1 20 LYS HE2 H 1.163 8.417 8.938 1.00 . A A . 20 LYS HE2 1 1 19 6233 1 1 20 LYS HE3 H 0.990 9.098 7.333 1.00 . A A . 20 LYS HE3 1 1 19 6234 1 1 20 LYS HG2 H -1.751 8.275 10.257 1.00 . A A . 20 LYS HG2 1 1 19 6235 1 1 20 LYS HG3 H -0.269 7.403 9.922 1.00 . A A . 20 LYS HG3 1 1 19 6236 1 1 20 LYS HZ1 H -0.061 11.037 8.690 1.00 . A A . 20 LYS HZ1 1 1 19 6237 1 1 20 LYS HZ2 H 0.857 10.432 9.898 1.00 . A A . 20 LYS HZ2 1 1 19 6238 1 1 20 LYS HZ3 H 1.558 10.922 8.507 1.00 . A A . 20 LYS HZ3 1 1 19 6239 1 1 20 LYS N N -2.107 4.647 10.501 1.00 . A A . 20 LYS N 1 1 19 6240 1 1 20 LYS NZ N 0.749 10.490 8.906 1.00 . A A . 20 LYS NZ 1 1 19 6241 1 1 20 LYS O O -4.648 4.451 9.736 1.00 . A A . 20 LYS O 1 1 19 6242 1 1 21 PRO C C -6.654 6.181 7.906 1.00 . A A . 21 PRO C 1 1 19 6243 1 1 21 PRO CA C -6.428 6.598 9.360 1.00 . A A . 21 PRO CA 1 1 19 6244 1 1 21 PRO CB C -7.009 7.965 9.684 1.00 . A A . 21 PRO CB 1 1 19 6245 1 1 21 PRO CD C -4.556 8.098 9.744 1.00 . A A . 21 PRO CD 1 1 19 6246 1 1 21 PRO CG C -5.831 8.925 9.703 1.00 . A A . 21 PRO CG 1 1 19 6247 1 1 21 PRO HA H -6.841 5.878 9.918 1.00 . A A . 21 PRO HA 1 1 19 6248 1 1 21 PRO HB2 H -7.745 8.263 8.937 1.00 . A A . 21 PRO HB2 1 1 19 6249 1 1 21 PRO HB3 H -7.519 7.954 10.647 1.00 . A A . 21 PRO HB3 1 1 19 6250 1 1 21 PRO HD2 H -3.892 8.351 8.917 1.00 . A A . 21 PRO HD2 1 1 19 6251 1 1 21 PRO HD3 H -4.000 8.273 10.664 1.00 . A A . 21 PRO HD3 1 1 19 6252 1 1 21 PRO HG2 H -5.843 9.562 8.818 1.00 . A A . 21 PRO HG2 1 1 19 6253 1 1 21 PRO HG3 H -5.888 9.583 10.570 1.00 . A A . 21 PRO HG3 1 1 19 6254 1 1 21 PRO N N -5.009 6.713 9.654 1.00 . A A . 21 PRO N 1 1 19 6255 1 1 21 PRO O O -5.922 6.606 7.013 1.00 . A A . 21 PRO O 1 1 19 6256 1 1 22 THR C C -9.383 5.387 5.959 1.00 . A A . 22 THR C 1 1 19 6257 1 1 22 THR CA C -8.004 4.877 6.380 1.00 . A A . 22 THR CA 1 1 19 6258 1 1 22 THR CB C -7.895 3.351 6.386 1.00 . A A . 22 THR CB 1 1 19 6259 1 1 22 THR CG2 C -7.775 2.767 4.976 1.00 . A A . 22 THR CG2 1 1 19 6260 1 1 22 THR H H -8.262 5.015 8.442 1.00 . A A . 22 THR H 1 1 19 6261 1 1 22 THR HA H -7.281 5.291 5.676 1.00 . A A . 22 THR HA 1 1 19 6262 1 1 22 THR HB H -8.733 2.904 6.922 1.00 . A A . 22 THR HB 1 1 19 6263 1 1 22 THR HG1 H -6.648 3.322 7.951 1.00 . A A . 22 THR HG1 1 1 19 6264 1 1 22 THR HG21 H -7.674 3.579 4.255 1.00 . A A . 22 THR HG21 1 1 19 6265 1 1 22 THR HG22 H -6.898 2.123 4.924 1.00 . A A . 22 THR HG22 1 1 19 6266 1 1 22 THR HG23 H -8.667 2.186 4.746 1.00 . A A . 22 THR HG23 1 1 19 6267 1 1 22 THR N N -7.672 5.355 7.711 1.00 . A A . 22 THR N 1 1 19 6268 1 1 22 THR O O -9.913 4.977 4.926 1.00 . A A . 22 THR O 1 1 19 6269 1 1 22 THR OG1 O -6.625 3.095 6.977 1.00 . A A . 22 THR OG1 1 1 19 6270 1 1 23 PHE C C -11.108 8.255 5.928 1.00 . A A . 23 PHE C 1 1 19 6271 1 1 23 PHE CA C -11.235 6.843 6.506 1.00 . A A . 23 PHE CA 1 1 19 6272 1 1 23 PHE CB C -11.981 6.916 7.840 1.00 . A A . 23 PHE CB 1 1 19 6273 1 1 23 PHE CD1 C -10.902 8.893 8.934 1.00 . A A . 23 PHE CD1 1 1 19 6274 1 1 23 PHE CD2 C -10.731 6.802 10.007 1.00 . A A . 23 PHE CD2 1 1 19 6275 1 1 23 PHE CE1 C -10.153 9.490 9.982 1.00 . A A . 23 PHE CE1 1 1 19 6276 1 1 23 PHE CE2 C -9.983 7.400 11.055 1.00 . A A . 23 PHE CE2 1 1 19 6277 1 1 23 PHE CG C -11.175 7.560 8.969 1.00 . A A . 23 PHE CG 1 1 19 6278 1 1 23 PHE CZ C -9.710 8.732 11.021 1.00 . A A . 23 PHE CZ 1 1 19 6279 1 1 23 PHE H H -9.491 6.601 7.618 1.00 . A A . 23 PHE H 1 1 19 6280 1 1 23 PHE HA H -11.723 6.198 5.776 1.00 . A A . 23 PHE HA 1 1 19 6281 1 1 23 PHE HB2 H -12.903 7.478 7.699 1.00 . A A . 23 PHE HB2 1 1 19 6282 1 1 23 PHE HB3 H -12.265 5.907 8.140 1.00 . A A . 23 PHE HB3 1 1 19 6283 1 1 23 PHE HD1 H -11.257 9.500 8.103 1.00 . A A . 23 PHE HD1 1 1 19 6284 1 1 23 PHE HD2 H -10.949 5.734 10.034 1.00 . A A . 23 PHE HD2 1 1 19 6285 1 1 23 PHE HE1 H -9.935 10.558 9.956 1.00 . A A . 23 PHE HE1 1 1 19 6286 1 1 23 PHE HE2 H -9.627 6.792 11.887 1.00 . A A . 23 PHE HE2 1 1 19 6287 1 1 23 PHE HZ H -9.135 9.191 11.825 1.00 . A A . 23 PHE HZ 1 1 19 6288 1 1 23 PHE N N -9.927 6.273 6.780 1.00 . A A . 23 PHE N 1 1 19 6289 1 1 23 PHE O O -10.065 8.617 5.387 1.00 . A A . 23 PHE O 1 1 20 6290 1 1 1 GLU C C 0.308 -4.956 3.806 1.00 . A A . 1 GLU C 1 1 20 6291 1 1 1 GLU CA C 1.015 -5.120 2.459 1.00 . A A . 1 GLU CA 1 1 20 6292 1 1 1 GLU CB C 1.159 -3.772 1.749 1.00 . A A . 1 GLU CB 1 1 20 6293 1 1 1 GLU CD C -0.663 -2.029 1.766 1.00 . A A . 1 GLU CD 1 1 20 6294 1 1 1 GLU CG C -0.171 -3.332 1.133 1.00 . A A . 1 GLU CG 1 1 20 6295 1 1 1 GLU HA H 2.004 -5.551 2.611 1.00 . A A . 1 GLU HA 1 1 20 6296 1 1 1 GLU HB2 H 1.503 -3.019 2.457 1.00 . A A . 1 GLU HB2 1 1 20 6297 1 1 1 GLU HB3 H 1.917 -3.847 0.969 1.00 . A A . 1 GLU HB3 1 1 20 6298 1 1 1 GLU HG2 H -0.051 -3.196 0.059 1.00 . A A . 1 GLU HG2 1 1 20 6299 1 1 1 GLU HG3 H -0.918 -4.114 1.275 1.00 . A A . 1 GLU HG3 1 1 20 6300 1 1 1 GLU N N 0.301 -6.073 1.627 1.00 . A A . 1 GLU N 1 1 20 6301 1 1 1 GLU O O 0.949 -4.680 4.819 1.00 . A A . 1 GLU O 1 1 20 6302 1 1 1 GLU OE1 O -0.767 -2.007 3.012 1.00 . A A . 1 GLU OE1 1 1 20 6303 1 1 1 GLU OE2 O -0.925 -1.085 0.990 1.00 . A A . 1 GLU OE2 1 1 20 6304 1 1 2 ASN C C -1.444 -6.140 5.946 1.00 . A A . 2 ASN C 1 1 20 6305 1 1 2 ASN CA C -1.806 -5.010 4.979 1.00 . A A . 2 ASN CA 1 1 20 6306 1 1 2 ASN CB C -3.299 -5.120 4.662 1.00 . A A . 2 ASN CB 1 1 20 6307 1 1 2 ASN CG C -3.978 -3.750 4.736 1.00 . A A . 2 ASN CG 1 1 20 6308 1 1 2 ASN H H -1.519 -5.359 2.946 1.00 . A A . 2 ASN H 1 1 20 6309 1 1 2 ASN HA H -1.569 -4.025 5.381 1.00 . A A . 2 ASN HA 1 1 20 6310 1 1 2 ASN HB2 H -3.433 -5.543 3.666 1.00 . A A . 2 ASN HB2 1 1 20 6311 1 1 2 ASN HB3 H -3.775 -5.803 5.365 1.00 . A A . 2 ASN HB3 1 1 20 6312 1 1 2 ASN HD21 H -5.712 -4.633 4.178 1.00 . A A . 2 ASN HD21 1 1 20 6313 1 1 2 ASN HD22 H -5.803 -2.924 4.448 1.00 . A A . 2 ASN HD22 1 1 20 6314 1 1 2 ASN N N -1.005 -5.134 3.773 1.00 . A A . 2 ASN N 1 1 20 6315 1 1 2 ASN ND2 N -5.271 -3.771 4.429 1.00 . A A . 2 ASN ND2 1 1 20 6316 1 1 2 ASN O O -0.774 -7.097 5.564 1.00 . A A . 2 ASN O 1 1 20 6317 1 1 2 ASN OD1 O -3.367 -2.743 5.051 1.00 . A A . 2 ASN OD1 1 1 20 6318 1 1 3 PHE C C -2.792 -7.068 9.203 1.00 . A A . 3 PHE C 1 1 20 6319 1 1 3 PHE CA C -1.636 -6.985 8.204 1.00 . A A . 3 PHE CA 1 1 20 6320 1 1 3 PHE CB C -0.372 -6.541 8.940 1.00 . A A . 3 PHE CB 1 1 20 6321 1 1 3 PHE CD1 C -0.049 -8.389 10.599 1.00 . A A . 3 PHE CD1 1 1 20 6322 1 1 3 PHE CD2 C 1.646 -8.023 9.005 1.00 . A A . 3 PHE CD2 1 1 20 6323 1 1 3 PHE CE1 C 0.703 -9.459 11.153 1.00 . A A . 3 PHE CE1 1 1 20 6324 1 1 3 PHE CE2 C 2.398 -9.093 9.558 1.00 . A A . 3 PHE CE2 1 1 20 6325 1 1 3 PHE CG C 0.438 -7.693 9.536 1.00 . A A . 3 PHE CG 1 1 20 6326 1 1 3 PHE CZ C 1.911 -9.787 10.621 1.00 . A A . 3 PHE CZ 1 1 20 6327 1 1 3 PHE H H -2.448 -5.207 7.482 1.00 . A A . 3 PHE H 1 1 20 6328 1 1 3 PHE HA H -1.526 -7.946 7.701 1.00 . A A . 3 PHE HA 1 1 20 6329 1 1 3 PHE HB2 H 0.262 -5.985 8.250 1.00 . A A . 3 PHE HB2 1 1 20 6330 1 1 3 PHE HB3 H -0.651 -5.855 9.740 1.00 . A A . 3 PHE HB3 1 1 20 6331 1 1 3 PHE HD1 H -1.017 -8.125 11.026 1.00 . A A . 3 PHE HD1 1 1 20 6332 1 1 3 PHE HD2 H 2.037 -7.466 8.153 1.00 . A A . 3 PHE HD2 1 1 20 6333 1 1 3 PHE HE1 H 0.312 -10.016 12.004 1.00 . A A . 3 PHE HE1 1 1 20 6334 1 1 3 PHE HE2 H 3.366 -9.356 9.132 1.00 . A A . 3 PHE HE2 1 1 20 6335 1 1 3 PHE HZ H 2.487 -10.609 11.046 1.00 . A A . 3 PHE HZ 1 1 20 6336 1 1 3 PHE N N -1.904 -5.990 7.179 1.00 . A A . 3 PHE N 1 1 20 6337 1 1 3 PHE O O -3.305 -8.151 9.477 1.00 . A A . 3 PHE O 1 1 20 6338 1 1 4 ASN C C -3.872 -6.624 11.937 1.00 . A A . 4 ASN C 1 1 20 6339 1 1 4 ASN CA C -4.254 -5.834 10.684 1.00 . A A . 4 ASN CA 1 1 20 6340 1 1 4 ASN CB C -5.538 -6.441 10.114 1.00 . A A . 4 ASN CB 1 1 20 6341 1 1 4 ASN CG C -6.685 -6.337 11.120 1.00 . A A . 4 ASN CG 1 1 20 6342 1 1 4 ASN H H -2.745 -5.030 9.492 1.00 . A A . 4 ASN H 1 1 20 6343 1 1 4 ASN HA H -4.386 -4.771 10.886 1.00 . A A . 4 ASN HA 1 1 20 6344 1 1 4 ASN HB2 H -5.809 -5.925 9.193 1.00 . A A . 4 ASN HB2 1 1 20 6345 1 1 4 ASN HB3 H -5.368 -7.485 9.857 1.00 . A A . 4 ASN HB3 1 1 20 6346 1 1 4 ASN HD21 H -6.695 -4.333 10.833 1.00 . A A . 4 ASN HD21 1 1 20 6347 1 1 4 ASN HD22 H -7.868 -4.926 11.963 1.00 . A A . 4 ASN HD22 1 1 20 6348 1 1 4 ASN N N -3.169 -5.907 9.721 1.00 . A A . 4 ASN N 1 1 20 6349 1 1 4 ASN ND2 N -7.119 -5.096 11.322 1.00 . A A . 4 ASN ND2 1 1 20 6350 1 1 4 ASN O O -4.742 -7.122 12.649 1.00 . A A . 4 ASN O 1 1 20 6351 1 1 4 ASN OD1 O -7.149 -7.320 11.676 1.00 . A A . 4 ASN OD1 1 1 20 6352 1 1 5 GLY C C -1.390 -6.486 14.311 1.00 . A A . 5 GLY C 1 1 20 6353 1 1 5 GLY CA C -2.063 -7.439 13.320 1.00 . A A . 5 GLY CA 1 1 20 6354 1 1 5 GLY H H -1.869 -6.309 11.581 1.00 . A A . 5 GLY H 1 1 20 6355 1 1 5 GLY HA2 H -2.881 -7.964 13.813 1.00 . A A . 5 GLY HA2 1 1 20 6356 1 1 5 GLY HA3 H -1.349 -8.196 12.996 1.00 . A A . 5 GLY HA3 1 1 20 6357 1 1 5 GLY N N -2.571 -6.717 12.167 1.00 . A A . 5 GLY N 1 1 20 6358 1 1 5 GLY O O -0.390 -6.838 14.934 1.00 . A A . 5 GLY O 1 1 20 6359 1 1 6 GLY C C -2.392 -3.104 15.450 1.00 . A A . 6 GLY C 1 1 20 6360 1 1 6 GLY CA C -1.437 -4.294 15.331 1.00 . A A . 6 GLY CA 1 1 20 6361 1 1 6 GLY H H -2.782 -5.022 13.917 1.00 . A A . 6 GLY H 1 1 20 6362 1 1 6 GLY HA2 H -1.274 -4.734 16.315 1.00 . A A . 6 GLY HA2 1 1 20 6363 1 1 6 GLY HA3 H -0.466 -3.951 14.970 1.00 . A A . 6 GLY HA3 1 1 20 6364 1 1 6 GLY N N -1.969 -5.299 14.426 1.00 . A A . 6 GLY N 1 1 20 6365 1 1 6 GLY O O -2.732 -2.685 16.556 1.00 . A A . 6 GLY O 1 1 20 6366 1 1 7 CYS C C -4.916 -1.786 15.139 1.00 . A A . 7 CYS C 1 1 20 6367 1 1 7 CYS CA C -3.707 -1.462 14.258 1.00 . A A . 7 CYS CA 1 1 20 6368 1 1 7 CYS CB C -4.121 -1.117 12.825 1.00 . A A . 7 CYS CB 1 1 20 6369 1 1 7 CYS H H -2.518 -2.942 13.401 1.00 . A A . 7 CYS H 1 1 20 6370 1 1 7 CYS HA H -3.160 -0.607 14.653 1.00 . A A . 7 CYS HA 1 1 20 6371 1 1 7 CYS HB2 H -4.511 -2.017 12.349 1.00 . A A . 7 CYS HB2 1 1 20 6372 1 1 7 CYS HB3 H -4.938 -0.397 12.862 1.00 . A A . 7 CYS HB3 1 1 20 6373 1 1 7 CYS N N -2.798 -2.595 14.297 1.00 . A A . 7 CYS N 1 1 20 6374 1 1 7 CYS O O -4.994 -2.867 15.721 1.00 . A A . 7 CYS O 1 1 20 6375 1 1 7 CYS SG S -2.781 -0.434 11.784 1.00 . A A . 7 CYS SG 1 1 20 6376 1 1 8 LEU C C -8.092 -1.727 15.180 1.00 . A A . 8 LEU C 1 1 20 6377 1 1 8 LEU CA C -7.031 -1.000 16.009 1.00 . A A . 8 LEU CA 1 1 20 6378 1 1 8 LEU CB C -7.501 0.348 16.564 1.00 . A A . 8 LEU CB 1 1 20 6379 1 1 8 LEU CD1 C -8.818 -0.595 18.496 1.00 . A A . 8 LEU CD1 1 1 20 6380 1 1 8 LEU CD2 C -9.271 1.761 17.671 1.00 . A A . 8 LEU CD2 1 1 20 6381 1 1 8 LEU CG C -8.849 0.342 17.286 1.00 . A A . 8 LEU CG 1 1 20 6382 1 1 8 LEU H H -5.760 0.047 14.732 1.00 . A A . 8 LEU H 1 1 20 6383 1 1 8 LEU HA H -6.770 -1.626 16.861 1.00 . A A . 8 LEU HA 1 1 20 6384 1 1 8 LEU HB2 H -6.743 0.718 17.253 1.00 . A A . 8 LEU HB2 1 1 20 6385 1 1 8 LEU HB3 H -7.556 1.057 15.739 1.00 . A A . 8 LEU HB3 1 1 20 6386 1 1 8 LEU HD11 H -8.374 -1.547 18.207 1.00 . A A . 8 LEU HD11 1 1 20 6387 1 1 8 LEU HD12 H -8.224 -0.143 19.291 1.00 . A A . 8 LEU HD12 1 1 20 6388 1 1 8 LEU HD13 H -9.835 -0.762 18.852 1.00 . A A . 8 LEU HD13 1 1 20 6389 1 1 8 LEU HD21 H -8.458 2.247 18.213 1.00 . A A . 8 LEU HD21 1 1 20 6390 1 1 8 LEU HD22 H -9.498 2.330 16.770 1.00 . A A . 8 LEU HD22 1 1 20 6391 1 1 8 LEU HD23 H -10.156 1.717 18.306 1.00 . A A . 8 LEU HD23 1 1 20 6392 1 1 8 LEU HG H -9.603 -0.044 16.601 1.00 . A A . 8 LEU HG 1 1 20 6393 1 1 8 LEU N N -5.830 -0.829 15.209 1.00 . A A . 8 LEU N 1 1 20 6394 1 1 8 LEU O O -8.603 -2.767 15.594 1.00 . A A . 8 LEU O 1 1 20 6395 1 1 9 ALA C C -9.847 -0.670 12.135 1.00 . A A . 9 ALA C 1 1 20 6396 1 1 9 ALA CA C -9.383 -1.731 13.134 1.00 . A A . 9 ALA CA 1 1 20 6397 1 1 9 ALA CB C -10.540 -2.300 13.959 1.00 . A A . 9 ALA CB 1 1 20 6398 1 1 9 ALA H H -7.973 -0.305 13.696 1.00 . A A . 9 ALA H 1 1 20 6399 1 1 9 ALA HA H -8.904 -2.546 12.592 1.00 . A A . 9 ALA HA 1 1 20 6400 1 1 9 ALA HB1 H -10.559 -1.820 14.938 1.00 . A A . 9 ALA HB1 1 1 20 6401 1 1 9 ALA HB2 H -11.481 -2.112 13.443 1.00 . A A . 9 ALA HB2 1 1 20 6402 1 1 9 ALA HB3 H -10.402 -3.375 14.085 1.00 . A A . 9 ALA HB3 1 1 20 6403 1 1 9 ALA N N -8.392 -1.150 14.025 1.00 . A A . 9 ALA N 1 1 20 6404 1 1 9 ALA O O -10.700 0.157 12.453 1.00 . A A . 9 ALA O 1 1 20 6405 1 1 10 GLY C C -8.384 1.027 9.467 1.00 . A A . 10 GLY C 1 1 20 6406 1 1 10 GLY CA C -9.608 0.216 9.897 1.00 . A A . 10 GLY CA 1 1 20 6407 1 1 10 GLY H H -8.573 -1.406 10.695 1.00 . A A . 10 GLY H 1 1 20 6408 1 1 10 GLY HA2 H -10.014 -0.320 9.038 1.00 . A A . 10 GLY HA2 1 1 20 6409 1 1 10 GLY HA3 H -10.389 0.889 10.251 1.00 . A A . 10 GLY HA3 1 1 20 6410 1 1 10 GLY N N -9.266 -0.729 10.945 1.00 . A A . 10 GLY N 1 1 20 6411 1 1 10 GLY O O -8.191 1.284 8.280 1.00 . A A . 10 GLY O 1 1 20 6412 1 1 11 TYR C C -5.484 1.473 9.188 1.00 . A A . 11 TYR C 1 1 20 6413 1 1 11 TYR CA C -6.389 2.183 10.196 1.00 . A A . 11 TYR CA 1 1 20 6414 1 1 11 TYR CB C -5.656 2.289 11.535 1.00 . A A . 11 TYR CB 1 1 20 6415 1 1 11 TYR CD1 C -7.321 2.618 13.400 1.00 . A A . 11 TYR CD1 1 1 20 6416 1 1 11 TYR CD2 C -6.056 4.508 12.664 1.00 . A A . 11 TYR CD2 1 1 20 6417 1 1 11 TYR CE1 C -7.991 3.444 14.370 1.00 . A A . 11 TYR CE1 1 1 20 6418 1 1 11 TYR CE2 C -6.725 5.334 13.634 1.00 . A A . 11 TYR CE2 1 1 20 6419 1 1 11 TYR CG C -6.367 3.166 12.567 1.00 . A A . 11 TYR CG 1 1 20 6420 1 1 11 TYR CZ C -7.660 4.761 14.440 1.00 . A A . 11 TYR CZ 1 1 20 6421 1 1 11 TYR H H -7.754 1.193 11.420 1.00 . A A . 11 TYR H 1 1 20 6422 1 1 11 TYR HA H -6.693 3.146 9.785 1.00 . A A . 11 TYR HA 1 1 20 6423 1 1 11 TYR HB2 H -5.531 1.288 11.950 1.00 . A A . 11 TYR HB2 1 1 20 6424 1 1 11 TYR HB3 H -4.657 2.688 11.360 1.00 . A A . 11 TYR HB3 1 1 20 6425 1 1 11 TYR HD1 H -7.567 1.559 13.323 1.00 . A A . 11 TYR HD1 1 1 20 6426 1 1 11 TYR HD2 H -5.303 4.942 12.005 1.00 . A A . 11 TYR HD2 1 1 20 6427 1 1 11 TYR HE1 H -8.745 3.023 15.034 1.00 . A A . 11 TYR HE1 1 1 20 6428 1 1 11 TYR HE2 H -6.489 6.395 13.722 1.00 . A A . 11 TYR HE2 1 1 20 6429 1 1 11 TYR HH H -8.209 6.505 15.101 1.00 . A A . 11 TYR HH 1 1 20 6430 1 1 11 TYR N N -7.589 1.407 10.457 1.00 . A A . 11 TYR N 1 1 20 6431 1 1 11 TYR O O -5.559 0.254 9.032 1.00 . A A . 11 TYR O 1 1 20 6432 1 1 11 TYR OH O -8.292 5.542 15.357 1.00 . A A . 11 TYR OH 1 1 20 6433 1 1 12 MET C C -2.289 1.774 8.046 1.00 . A A . 12 MET C 1 1 20 6434 1 1 12 MET CA C -3.732 1.725 7.540 1.00 . A A . 12 MET CA 1 1 20 6435 1 1 12 MET CB C -3.846 2.531 6.245 1.00 . A A . 12 MET CB 1 1 20 6436 1 1 12 MET CE C -3.129 6.547 5.630 1.00 . A A . 12 MET CE 1 1 20 6437 1 1 12 MET CG C -3.724 4.031 6.520 1.00 . A A . 12 MET CG 1 1 20 6438 1 1 12 MET H H -4.596 3.253 8.662 1.00 . A A . 12 MET H 1 1 20 6439 1 1 12 MET HA H -4.037 0.689 7.391 1.00 . A A . 12 MET HA 1 1 20 6440 1 1 12 MET HB2 H -3.067 2.221 5.549 1.00 . A A . 12 MET HB2 1 1 20 6441 1 1 12 MET HB3 H -4.803 2.322 5.765 1.00 . A A . 12 MET HB3 1 1 20 6442 1 1 12 MET HE1 H -4.129 6.693 6.039 1.00 . A A . 12 MET HE1 1 1 20 6443 1 1 12 MET HE2 H -2.386 6.800 6.387 1.00 . A A . 12 MET HE2 1 1 20 6444 1 1 12 MET HE3 H -2.995 7.191 4.761 1.00 . A A . 12 MET HE3 1 1 20 6445 1 1 12 MET HG2 H -4.713 4.461 6.683 1.00 . A A . 12 MET HG2 1 1 20 6446 1 1 12 MET HG3 H -3.150 4.196 7.432 1.00 . A A . 12 MET HG3 1 1 20 6447 1 1 12 MET N N -4.650 2.263 8.529 1.00 . A A . 12 MET N 1 1 20 6448 1 1 12 MET O O -1.983 2.505 8.987 1.00 . A A . 12 MET O 1 1 20 6449 1 1 12 MET SD S -2.928 4.842 5.143 1.00 . A A . 12 MET SD 1 1 20 6450 1 1 13 ARG C C 0.814 1.683 6.752 1.00 . A A . 13 ARG C 1 1 20 6451 1 1 13 ARG CA C -0.039 0.931 7.776 1.00 . A A . 13 ARG CA 1 1 20 6452 1 1 13 ARG CB C 0.449 -0.516 7.871 1.00 . A A . 13 ARG CB 1 1 20 6453 1 1 13 ARG CD C 0.921 -1.809 9.984 1.00 . A A . 13 ARG CD 1 1 20 6454 1 1 13 ARG CG C -0.166 -1.223 9.081 1.00 . A A . 13 ARG CG 1 1 20 6455 1 1 13 ARG CZ C 1.913 -4.065 10.351 1.00 . A A . 13 ARG CZ 1 1 20 6456 1 1 13 ARG H H -1.699 0.395 6.637 1.00 . A A . 13 ARG H 1 1 20 6457 1 1 13 ARG HA H 0.008 1.411 8.753 1.00 . A A . 13 ARG HA 1 1 20 6458 1 1 13 ARG HB2 H 0.186 -1.053 6.959 1.00 . A A . 13 ARG HB2 1 1 20 6459 1 1 13 ARG HB3 H 1.536 -0.533 7.949 1.00 . A A . 13 ARG HB3 1 1 20 6460 1 1 13 ARG HD2 H 1.893 -1.401 9.708 1.00 . A A . 13 ARG HD2 1 1 20 6461 1 1 13 ARG HD3 H 0.738 -1.522 11.020 1.00 . A A . 13 ARG HD3 1 1 20 6462 1 1 13 ARG HE H 0.176 -3.725 9.391 1.00 . A A . 13 ARG HE 1 1 20 6463 1 1 13 ARG HG2 H -0.775 -0.519 9.647 1.00 . A A . 13 ARG HG2 1 1 20 6464 1 1 13 ARG HG3 H -0.830 -2.019 8.742 1.00 . A A . 13 ARG HG3 1 1 20 6465 1 1 13 ARG HH11 H 3.004 -2.525 11.108 1.00 . A A . 13 ARG HH11 1 1 20 6466 1 1 13 ARG HH12 H 3.681 -4.101 11.354 1.00 . A A . 13 ARG HH12 1 1 20 6467 1 1 13 ARG HH21 H 1.068 -5.803 9.717 1.00 . A A . 13 ARG HH21 1 1 20 6468 1 1 13 ARG HH22 H 2.572 -5.978 10.558 1.00 . A A . 13 ARG HH22 1 1 20 6469 1 1 13 ARG N N -1.442 0.987 7.401 1.00 . A A . 13 ARG N 1 1 20 6470 1 1 13 ARG NE N 0.939 -3.284 9.865 1.00 . A A . 13 ARG NE 1 1 20 6471 1 1 13 ARG NH1 N 2.954 -3.517 10.992 1.00 . A A . 13 ARG NH1 1 1 20 6472 1 1 13 ARG NH2 N 1.845 -5.394 10.195 1.00 . A A . 13 ARG NH2 1 1 20 6473 1 1 13 ARG O O 1.016 1.206 5.636 1.00 . A A . 13 ARG O 1 1 20 6474 1 1 14 THR C C 3.451 2.974 6.017 1.00 . A A . 14 THR C 1 1 20 6475 1 1 14 THR CA C 2.118 3.669 6.302 1.00 . A A . 14 THR CA 1 1 20 6476 1 1 14 THR CB C 2.277 5.040 6.962 1.00 . A A . 14 THR CB 1 1 20 6477 1 1 14 THR CG2 C 0.973 5.840 6.970 1.00 . A A . 14 THR CG2 1 1 20 6478 1 1 14 THR H H 1.124 3.227 8.077 1.00 . A A . 14 THR H 1 1 20 6479 1 1 14 THR HA H 1.606 3.782 5.346 1.00 . A A . 14 THR HA 1 1 20 6480 1 1 14 THR HB H 3.079 5.608 6.491 1.00 . A A . 14 THR HB 1 1 20 6481 1 1 14 THR HG1 H 2.541 5.584 8.869 1.00 . A A . 14 THR HG1 1 1 20 6482 1 1 14 THR HG21 H 0.548 5.853 5.966 1.00 . A A . 14 THR HG21 1 1 20 6483 1 1 14 THR HG22 H 0.265 5.376 7.658 1.00 . A A . 14 THR HG22 1 1 20 6484 1 1 14 THR HG23 H 1.175 6.862 7.292 1.00 . A A . 14 THR HG23 1 1 20 6485 1 1 14 THR N N 1.292 2.846 7.168 1.00 . A A . 14 THR N 1 1 20 6486 1 1 14 THR O O 3.614 1.791 6.313 1.00 . A A . 14 THR O 1 1 20 6487 1 1 14 THR OG1 O 2.508 4.739 8.335 1.00 . A A . 14 THR OG1 1 1 20 6488 1 1 15 ALA C C 6.590 3.312 6.348 1.00 . A A . 15 ALA C 1 1 20 6489 1 1 15 ALA CA C 5.684 3.211 5.119 1.00 . A A . 15 ALA CA 1 1 20 6490 1 1 15 ALA CB C 6.251 3.963 3.914 1.00 . A A . 15 ALA CB 1 1 20 6491 1 1 15 ALA H H 4.230 4.699 5.210 1.00 . A A . 15 ALA H 1 1 20 6492 1 1 15 ALA HA H 5.563 2.161 4.853 1.00 . A A . 15 ALA HA 1 1 20 6493 1 1 15 ALA HB1 H 6.268 5.032 4.128 1.00 . A A . 15 ALA HB1 1 1 20 6494 1 1 15 ALA HB2 H 7.265 3.617 3.713 1.00 . A A . 15 ALA HB2 1 1 20 6495 1 1 15 ALA HB3 H 5.623 3.777 3.042 1.00 . A A . 15 ALA HB3 1 1 20 6496 1 1 15 ALA N N 4.371 3.739 5.447 1.00 . A A . 15 ALA N 1 1 20 6497 1 1 15 ALA O O 7.790 3.050 6.263 1.00 . A A . 15 ALA O 1 1 20 6498 1 1 16 ASP C C 6.213 2.793 9.713 1.00 . A A . 16 ASP C 1 1 20 6499 1 1 16 ASP CA C 6.720 3.829 8.708 1.00 . A A . 16 ASP CA 1 1 20 6500 1 1 16 ASP CB C 6.519 5.218 9.317 1.00 . A A . 16 ASP CB 1 1 20 6501 1 1 16 ASP CG C 7.305 5.481 10.602 1.00 . A A . 16 ASP CG 1 1 20 6502 1 1 16 ASP H H 5.008 3.902 7.524 1.00 . A A . 16 ASP H 1 1 20 6503 1 1 16 ASP HA H 7.766 3.673 8.440 1.00 . A A . 16 ASP HA 1 1 20 6504 1 1 16 ASP HB2 H 6.800 5.967 8.577 1.00 . A A . 16 ASP HB2 1 1 20 6505 1 1 16 ASP HB3 H 5.457 5.357 9.523 1.00 . A A . 16 ASP HB3 1 1 20 6506 1 1 16 ASP N N 5.983 3.691 7.463 1.00 . A A . 16 ASP N 1 1 20 6507 1 1 16 ASP O O 6.882 2.505 10.704 1.00 . A A . 16 ASP O 1 1 20 6508 1 1 16 ASP OD1 O 8.513 5.159 10.604 1.00 . A A . 16 ASP OD1 1 1 20 6509 1 1 16 ASP OD2 O 6.681 5.998 11.554 1.00 . A A . 16 ASP OD2 1 1 20 6510 1 1 17 GLY C C 3.422 1.909 11.247 1.00 . A A . 17 GLY C 1 1 20 6511 1 1 17 GLY CA C 4.428 1.266 10.291 1.00 . A A . 17 GLY CA 1 1 20 6512 1 1 17 GLY H H 4.496 2.502 8.615 1.00 . A A . 17 GLY H 1 1 20 6513 1 1 17 GLY HA2 H 3.929 0.509 9.687 1.00 . A A . 17 GLY HA2 1 1 20 6514 1 1 17 GLY HA3 H 5.204 0.756 10.862 1.00 . A A . 17 GLY HA3 1 1 20 6515 1 1 17 GLY N N 5.033 2.262 9.424 1.00 . A A . 17 GLY N 1 1 20 6516 1 1 17 GLY O O 2.780 1.218 12.035 1.00 . A A . 17 GLY O 1 1 20 6517 1 1 18 ARG C C 0.965 3.807 11.491 1.00 . A A . 18 ARG C 1 1 20 6518 1 1 18 ARG CA C 2.402 3.972 11.991 1.00 . A A . 18 ARG CA 1 1 20 6519 1 1 18 ARG CB C 2.759 5.459 12.014 1.00 . A A . 18 ARG CB 1 1 20 6520 1 1 18 ARG CD C 4.331 5.899 13.936 1.00 . A A . 18 ARG CD 1 1 20 6521 1 1 18 ARG CG C 4.217 5.667 12.428 1.00 . A A . 18 ARG CG 1 1 20 6522 1 1 18 ARG CZ C 5.930 7.046 15.464 1.00 . A A . 18 ARG CZ 1 1 20 6523 1 1 18 ARG H H 3.846 3.781 10.502 1.00 . A A . 18 ARG H 1 1 20 6524 1 1 18 ARG HA H 2.523 3.539 12.984 1.00 . A A . 18 ARG HA 1 1 20 6525 1 1 18 ARG HB2 H 2.592 5.892 11.027 1.00 . A A . 18 ARG HB2 1 1 20 6526 1 1 18 ARG HB3 H 2.102 5.984 12.707 1.00 . A A . 18 ARG HB3 1 1 20 6527 1 1 18 ARG HD2 H 3.485 6.492 14.286 1.00 . A A . 18 ARG HD2 1 1 20 6528 1 1 18 ARG HD3 H 4.291 4.946 14.463 1.00 . A A . 18 ARG HD3 1 1 20 6529 1 1 18 ARG HE H 6.250 6.739 13.501 1.00 . A A . 18 ARG HE 1 1 20 6530 1 1 18 ARG HG2 H 4.807 4.795 12.145 1.00 . A A . 18 ARG HG2 1 1 20 6531 1 1 18 ARG HG3 H 4.633 6.520 11.893 1.00 . A A . 18 ARG HG3 1 1 20 6532 1 1 18 ARG HH11 H 4.213 6.413 16.352 1.00 . A A . 18 ARG HH11 1 1 20 6533 1 1 18 ARG HH12 H 5.335 7.212 17.402 1.00 . A A . 18 ARG HH12 1 1 20 6534 1 1 18 ARG HH21 H 7.731 7.793 14.886 1.00 . A A . 18 ARG HH21 1 1 20 6535 1 1 18 ARG HH22 H 7.349 8.003 16.562 1.00 . A A . 18 ARG HH22 1 1 20 6536 1 1 18 ARG N N 3.318 3.226 11.145 1.00 . A A . 18 ARG N 1 1 20 6537 1 1 18 ARG NE N 5.599 6.595 14.247 1.00 . A A . 18 ARG NE 1 1 20 6538 1 1 18 ARG NH1 N 5.088 6.876 16.493 1.00 . A A . 18 ARG NH1 1 1 20 6539 1 1 18 ARG NH2 N 7.102 7.666 15.653 1.00 . A A . 18 ARG NH2 1 1 20 6540 1 1 18 ARG O O 0.618 4.294 10.416 1.00 . A A . 18 ARG O 1 1 20 6541 1 1 19 CYS C C -1.915 4.235 11.786 1.00 . A A . 19 CYS C 1 1 20 6542 1 1 19 CYS CA C -1.223 2.880 11.946 1.00 . A A . 19 CYS CA 1 1 20 6543 1 1 19 CYS CB C -1.923 1.999 12.981 1.00 . A A . 19 CYS CB 1 1 20 6544 1 1 19 CYS H H 0.457 2.726 13.167 1.00 . A A . 19 CYS H 1 1 20 6545 1 1 19 CYS HA H -1.220 2.334 11.002 1.00 . A A . 19 CYS HA 1 1 20 6546 1 1 19 CYS HB2 H -1.823 2.466 13.962 1.00 . A A . 19 CYS HB2 1 1 20 6547 1 1 19 CYS HB3 H -2.989 1.969 12.751 1.00 . A A . 19 CYS HB3 1 1 20 6548 1 1 19 CYS N N 0.167 3.118 12.294 1.00 . A A . 19 CYS N 1 1 20 6549 1 1 19 CYS O O -2.196 4.914 12.773 1.00 . A A . 19 CYS O 1 1 20 6550 1 1 19 CYS SG S -1.295 0.284 13.081 1.00 . A A . 19 CYS SG 1 1 20 6551 1 1 20 LYS C C -4.302 5.590 9.923 1.00 . A A . 20 LYS C 1 1 20 6552 1 1 20 LYS CA C -2.827 5.849 10.232 1.00 . A A . 20 LYS CA 1 1 20 6553 1 1 20 LYS CB C -2.084 6.585 9.115 1.00 . A A . 20 LYS CB 1 1 20 6554 1 1 20 LYS CD C 0.078 7.500 10.036 1.00 . A A . 20 LYS CD 1 1 20 6555 1 1 20 LYS CE C 0.954 8.753 9.978 1.00 . A A . 20 LYS CE 1 1 20 6556 1 1 20 LYS CG C -1.368 7.824 9.656 1.00 . A A . 20 LYS CG 1 1 20 6557 1 1 20 LYS H H -1.939 4.030 9.738 1.00 . A A . 20 LYS H 1 1 20 6558 1 1 20 LYS HA H -2.765 6.472 11.125 1.00 . A A . 20 LYS HA 1 1 20 6559 1 1 20 LYS HB2 H -1.359 5.915 8.653 1.00 . A A . 20 LYS HB2 1 1 20 6560 1 1 20 LYS HB3 H -2.788 6.878 8.337 1.00 . A A . 20 LYS HB3 1 1 20 6561 1 1 20 LYS HD2 H 0.108 7.078 11.041 1.00 . A A . 20 LYS HD2 1 1 20 6562 1 1 20 LYS HD3 H 0.475 6.743 9.360 1.00 . A A . 20 LYS HD3 1 1 20 6563 1 1 20 LYS HE2 H 1.463 8.803 9.015 1.00 . A A . 20 LYS HE2 1 1 20 6564 1 1 20 LYS HE3 H 0.331 9.644 10.055 1.00 . A A . 20 LYS HE3 1 1 20 6565 1 1 20 LYS HG2 H -1.382 8.613 8.905 1.00 . A A . 20 LYS HG2 1 1 20 6566 1 1 20 LYS HG3 H -1.901 8.204 10.528 1.00 . A A . 20 LYS HG3 1 1 20 6567 1 1 20 LYS HZ1 H 2.282 7.808 11.210 1.00 . A A . 20 LYS HZ1 1 1 20 6568 1 1 20 LYS HZ2 H 2.718 9.335 10.831 1.00 . A A . 20 LYS HZ2 1 1 20 6569 1 1 20 LYS HZ3 H 1.524 9.071 11.914 1.00 . A A . 20 LYS HZ3 1 1 20 6570 1 1 20 LYS N N -2.171 4.588 10.535 1.00 . A A . 20 LYS N 1 1 20 6571 1 1 20 LYS NZ N 1.950 8.741 11.072 1.00 . A A . 20 LYS NZ 1 1 20 6572 1 1 20 LYS O O -4.713 4.443 9.755 1.00 . A A . 20 LYS O 1 1 20 6573 1 1 21 PRO C C -6.745 6.307 8.089 1.00 . A A . 21 PRO C 1 1 20 6574 1 1 21 PRO CA C -6.501 6.609 9.570 1.00 . A A . 21 PRO CA 1 1 20 6575 1 1 21 PRO CB C -7.081 7.944 10.007 1.00 . A A . 21 PRO CB 1 1 20 6576 1 1 21 PRO CD C -4.628 8.079 10.047 1.00 . A A . 21 PRO CD 1 1 20 6577 1 1 21 PRO CG C -5.905 8.903 10.086 1.00 . A A . 21 PRO CG 1 1 20 6578 1 1 21 PRO HA H -6.906 5.846 10.074 1.00 . A A . 21 PRO HA 1 1 20 6579 1 1 21 PRO HB2 H -7.827 8.298 9.295 1.00 . A A . 21 PRO HB2 1 1 20 6580 1 1 21 PRO HB3 H -7.579 7.855 10.972 1.00 . A A . 21 PRO HB3 1 1 20 6581 1 1 21 PRO HD2 H -3.975 8.399 9.235 1.00 . A A . 21 PRO HD2 1 1 20 6582 1 1 21 PRO HD3 H -4.061 8.184 10.972 1.00 . A A . 21 PRO HD3 1 1 20 6583 1 1 21 PRO HG2 H -5.930 9.608 9.255 1.00 . A A . 21 PRO HG2 1 1 20 6584 1 1 21 PRO HG3 H -5.952 9.490 11.004 1.00 . A A . 21 PRO HG3 1 1 20 6585 1 1 21 PRO N N -5.079 6.705 9.854 1.00 . A A . 21 PRO N 1 1 20 6586 1 1 21 PRO O O -6.009 6.784 7.226 1.00 . A A . 21 PRO O 1 1 20 6587 1 1 22 THR C C -9.519 5.675 6.125 1.00 . A A . 22 THR C 1 1 20 6588 1 1 22 THR CA C -8.129 5.147 6.481 1.00 . A A . 22 THR CA 1 1 20 6589 1 1 22 THR CB C -8.006 3.626 6.359 1.00 . A A . 22 THR CB 1 1 20 6590 1 1 22 THR CG2 C -8.442 3.111 4.985 1.00 . A A . 22 THR CG2 1 1 20 6591 1 1 22 THR H H -8.372 5.133 8.549 1.00 . A A . 22 THR H 1 1 20 6592 1 1 22 THR HA H -7.421 5.624 5.802 1.00 . A A . 22 THR HA 1 1 20 6593 1 1 22 THR HB H -8.559 3.126 7.155 1.00 . A A . 22 THR HB 1 1 20 6594 1 1 22 THR HG1 H -6.180 3.722 5.547 1.00 . A A . 22 THR HG1 1 1 20 6595 1 1 22 THR HG21 H -8.224 3.866 4.230 1.00 . A A . 22 THR HG21 1 1 20 6596 1 1 22 THR HG22 H -7.900 2.195 4.752 1.00 . A A . 22 THR HG22 1 1 20 6597 1 1 22 THR HG23 H -9.513 2.907 4.996 1.00 . A A . 22 THR HG23 1 1 20 6598 1 1 22 THR N N -7.779 5.517 7.841 1.00 . A A . 22 THR N 1 1 20 6599 1 1 22 THR O O -10.068 5.332 5.079 1.00 . A A . 22 THR O 1 1 20 6600 1 1 22 THR OG1 O -6.603 3.387 6.390 1.00 . A A . 22 THR OG1 1 1 20 6601 1 1 23 PHE C C -11.597 7.401 5.329 1.00 . A A . 23 PHE C 1 1 20 6602 1 1 23 PHE CA C -11.366 7.080 6.807 1.00 . A A . 23 PHE CA 1 1 20 6603 1 1 23 PHE CB C -11.413 8.381 7.611 1.00 . A A . 23 PHE CB 1 1 20 6604 1 1 23 PHE CD1 C -11.424 7.206 9.823 1.00 . A A . 23 PHE CD1 1 1 20 6605 1 1 23 PHE CD2 C -10.077 9.125 9.594 1.00 . A A . 23 PHE CD2 1 1 20 6606 1 1 23 PHE CE1 C -10.996 7.068 11.170 1.00 . A A . 23 PHE CE1 1 1 20 6607 1 1 23 PHE CE2 C -9.651 8.987 10.942 1.00 . A A . 23 PHE CE2 1 1 20 6608 1 1 23 PHE CG C -10.955 8.232 9.063 1.00 . A A . 23 PHE CG 1 1 20 6609 1 1 23 PHE CZ C -10.120 7.961 11.701 1.00 . A A . 23 PHE CZ 1 1 20 6610 1 1 23 PHE H H -9.595 6.775 7.863 1.00 . A A . 23 PHE H 1 1 20 6611 1 1 23 PHE HA H -12.098 6.344 7.136 1.00 . A A . 23 PHE HA 1 1 20 6612 1 1 23 PHE HB2 H -10.788 9.125 7.118 1.00 . A A . 23 PHE HB2 1 1 20 6613 1 1 23 PHE HB3 H -12.434 8.765 7.602 1.00 . A A . 23 PHE HB3 1 1 20 6614 1 1 23 PHE HD1 H -12.127 6.489 9.398 1.00 . A A . 23 PHE HD1 1 1 20 6615 1 1 23 PHE HD2 H -9.701 9.947 8.985 1.00 . A A . 23 PHE HD2 1 1 20 6616 1 1 23 PHE HE1 H -11.373 6.245 11.780 1.00 . A A . 23 PHE HE1 1 1 20 6617 1 1 23 PHE HE2 H -8.948 9.702 11.367 1.00 . A A . 23 PHE HE2 1 1 20 6618 1 1 23 PHE HZ H -9.792 7.855 12.735 1.00 . A A . 23 PHE HZ 1 1 20 6619 1 1 23 PHE N N -10.049 6.502 7.014 1.00 . A A . 23 PHE N 1 1 20 6620 1 1 23 PHE O O -12.504 8.158 4.989 1.00 . A A . 23 PHE O 1 1 21 6621 1 1 1 GLU C C 1.587 -9.066 17.380 1.00 . A A . 1 GLU C 1 1 21 6622 1 1 1 GLU CA C 2.886 -9.806 17.707 1.00 . A A . 1 GLU CA 1 1 21 6623 1 1 1 GLU CB C 3.074 -9.944 19.219 1.00 . A A . 1 GLU CB 1 1 21 6624 1 1 1 GLU CD C 3.909 -12.142 20.130 1.00 . A A . 1 GLU CD 1 1 21 6625 1 1 1 GLU CG C 2.679 -11.343 19.696 1.00 . A A . 1 GLU CG 1 1 21 6626 1 1 1 GLU HA H 2.868 -10.799 17.257 1.00 . A A . 1 GLU HA 1 1 21 6627 1 1 1 GLU HB2 H 4.114 -9.747 19.479 1.00 . A A . 1 GLU HB2 1 1 21 6628 1 1 1 GLU HB3 H 2.470 -9.196 19.733 1.00 . A A . 1 GLU HB3 1 1 21 6629 1 1 1 GLU HG2 H 1.979 -11.263 20.528 1.00 . A A . 1 GLU HG2 1 1 21 6630 1 1 1 GLU HG3 H 2.162 -11.871 18.895 1.00 . A A . 1 GLU HG3 1 1 21 6631 1 1 1 GLU N N 4.019 -9.128 17.100 1.00 . A A . 1 GLU N 1 1 21 6632 1 1 1 GLU O O 0.920 -8.552 18.277 1.00 . A A . 1 GLU O 1 1 21 6633 1 1 1 GLU OE1 O 4.566 -12.706 19.229 1.00 . A A . 1 GLU OE1 1 1 21 6634 1 1 1 GLU OE2 O 4.164 -12.169 21.354 1.00 . A A . 1 GLU OE2 1 1 21 6635 1 1 2 ASN C C -0.557 -9.167 14.492 1.00 . A A . 2 ASN C 1 1 21 6636 1 1 2 ASN CA C 0.062 -8.365 15.639 1.00 . A A . 2 ASN CA 1 1 21 6637 1 1 2 ASN CB C 0.374 -6.961 15.121 1.00 . A A . 2 ASN CB 1 1 21 6638 1 1 2 ASN CG C 1.183 -6.164 16.147 1.00 . A A . 2 ASN CG 1 1 21 6639 1 1 2 ASN H H 1.817 -9.456 15.373 1.00 . A A . 2 ASN H 1 1 21 6640 1 1 2 ASN HA H -0.588 -8.320 16.513 1.00 . A A . 2 ASN HA 1 1 21 6641 1 1 2 ASN HB2 H 0.931 -7.028 14.187 1.00 . A A . 2 ASN HB2 1 1 21 6642 1 1 2 ASN HB3 H -0.556 -6.436 14.900 1.00 . A A . 2 ASN HB3 1 1 21 6643 1 1 2 ASN HD21 H -0.510 -5.937 17.235 1.00 . A A . 2 ASN HD21 1 1 21 6644 1 1 2 ASN HD22 H 0.907 -5.201 17.906 1.00 . A A . 2 ASN HD22 1 1 21 6645 1 1 2 ASN N N 1.268 -9.035 16.095 1.00 . A A . 2 ASN N 1 1 21 6646 1 1 2 ASN ND2 N 0.467 -5.732 17.181 1.00 . A A . 2 ASN ND2 1 1 21 6647 1 1 2 ASN O O 0.058 -10.100 13.978 1.00 . A A . 2 ASN O 1 1 21 6648 1 1 2 ASN OD1 O 2.377 -5.957 16.008 1.00 . A A . 2 ASN OD1 1 1 21 6649 1 1 3 PHE C C -2.091 -8.854 11.687 1.00 . A A . 3 PHE C 1 1 21 6650 1 1 3 PHE CA C -2.476 -9.442 13.046 1.00 . A A . 3 PHE CA 1 1 21 6651 1 1 3 PHE CB C -3.971 -9.212 13.283 1.00 . A A . 3 PHE CB 1 1 21 6652 1 1 3 PHE CD1 C -5.041 -11.456 12.979 1.00 . A A . 3 PHE CD1 1 1 21 6653 1 1 3 PHE CD2 C -5.040 -10.511 15.138 1.00 . A A . 3 PHE CD2 1 1 21 6654 1 1 3 PHE CE1 C -5.729 -12.594 13.478 1.00 . A A . 3 PHE CE1 1 1 21 6655 1 1 3 PHE CE2 C -5.728 -11.649 15.636 1.00 . A A . 3 PHE CE2 1 1 21 6656 1 1 3 PHE CG C -4.712 -10.438 13.820 1.00 . A A . 3 PHE CG 1 1 21 6657 1 1 3 PHE CZ C -6.058 -12.666 14.796 1.00 . A A . 3 PHE CZ 1 1 21 6658 1 1 3 PHE H H -2.261 -8.013 14.546 1.00 . A A . 3 PHE H 1 1 21 6659 1 1 3 PHE HA H -2.194 -10.494 13.077 1.00 . A A . 3 PHE HA 1 1 21 6660 1 1 3 PHE HB2 H -4.094 -8.388 13.986 1.00 . A A . 3 PHE HB2 1 1 21 6661 1 1 3 PHE HB3 H -4.434 -8.902 12.346 1.00 . A A . 3 PHE HB3 1 1 21 6662 1 1 3 PHE HD1 H -4.778 -11.397 11.923 1.00 . A A . 3 PHE HD1 1 1 21 6663 1 1 3 PHE HD2 H -4.776 -9.695 15.812 1.00 . A A . 3 PHE HD2 1 1 21 6664 1 1 3 PHE HE1 H -5.994 -13.408 12.805 1.00 . A A . 3 PHE HE1 1 1 21 6665 1 1 3 PHE HE2 H -5.992 -11.707 16.692 1.00 . A A . 3 PHE HE2 1 1 21 6666 1 1 3 PHE HZ H -6.585 -13.540 15.178 1.00 . A A . 3 PHE HZ 1 1 21 6667 1 1 3 PHE N N -1.768 -8.773 14.123 1.00 . A A . 3 PHE N 1 1 21 6668 1 1 3 PHE O O -1.562 -9.558 10.829 1.00 . A A . 3 PHE O 1 1 21 6669 1 1 4 ASN C C -1.231 -5.630 10.604 1.00 . A A . 4 ASN C 1 1 21 6670 1 1 4 ASN CA C -2.062 -6.877 10.294 1.00 . A A . 4 ASN CA 1 1 21 6671 1 1 4 ASN CB C -3.339 -6.428 9.580 1.00 . A A . 4 ASN CB 1 1 21 6672 1 1 4 ASN CG C -4.447 -6.109 10.585 1.00 . A A . 4 ASN CG 1 1 21 6673 1 1 4 ASN H H -2.804 -7.002 12.237 1.00 . A A . 4 ASN H 1 1 21 6674 1 1 4 ASN HA H -1.517 -7.602 9.690 1.00 . A A . 4 ASN HA 1 1 21 6675 1 1 4 ASN HB2 H -3.129 -5.547 8.971 1.00 . A A . 4 ASN HB2 1 1 21 6676 1 1 4 ASN HB3 H -3.673 -7.211 8.899 1.00 . A A . 4 ASN HB3 1 1 21 6677 1 1 4 ASN HD21 H -3.732 -4.218 10.700 1.00 . A A . 4 ASN HD21 1 1 21 6678 1 1 4 ASN HD22 H -5.116 -4.549 11.689 1.00 . A A . 4 ASN HD22 1 1 21 6679 1 1 4 ASN N N -2.372 -7.568 11.534 1.00 . A A . 4 ASN N 1 1 21 6680 1 1 4 ASN ND2 N -4.430 -4.854 11.027 1.00 . A A . 4 ASN ND2 1 1 21 6681 1 1 4 ASN O O -1.549 -4.536 10.141 1.00 . A A . 4 ASN O 1 1 21 6682 1 1 4 ASN OD1 O -5.263 -6.945 10.935 1.00 . A A . 4 ASN OD1 1 1 21 6683 1 1 5 GLY C C 0.493 -4.357 13.231 1.00 . A A . 5 GLY C 1 1 21 6684 1 1 5 GLY CA C 0.697 -4.743 11.765 1.00 . A A . 5 GLY CA 1 1 21 6685 1 1 5 GLY H H 0.070 -6.730 11.760 1.00 . A A . 5 GLY H 1 1 21 6686 1 1 5 GLY HA2 H 1.736 -5.035 11.603 1.00 . A A . 5 GLY HA2 1 1 21 6687 1 1 5 GLY HA3 H 0.505 -3.881 11.127 1.00 . A A . 5 GLY HA3 1 1 21 6688 1 1 5 GLY N N -0.182 -5.837 11.387 1.00 . A A . 5 GLY N 1 1 21 6689 1 1 5 GLY O O 1.452 -4.051 13.936 1.00 . A A . 5 GLY O 1 1 21 6690 1 1 6 GLY C C -1.894 -2.728 15.071 1.00 . A A . 6 GLY C 1 1 21 6691 1 1 6 GLY CA C -1.109 -4.040 15.016 1.00 . A A . 6 GLY CA 1 1 21 6692 1 1 6 GLY H H -1.541 -4.634 13.067 1.00 . A A . 6 GLY H 1 1 21 6693 1 1 6 GLY HA2 H -1.700 -4.841 15.459 1.00 . A A . 6 GLY HA2 1 1 21 6694 1 1 6 GLY HA3 H -0.199 -3.949 15.610 1.00 . A A . 6 GLY HA3 1 1 21 6695 1 1 6 GLY N N -0.766 -4.384 13.647 1.00 . A A . 6 GLY N 1 1 21 6696 1 1 6 GLY O O -1.490 -1.787 15.752 1.00 . A A . 6 GLY O 1 1 21 6697 1 1 7 CYS C C -5.080 -1.788 15.172 1.00 . A A . 7 CYS C 1 1 21 6698 1 1 7 CYS CA C -3.848 -1.527 14.304 1.00 . A A . 7 CYS CA 1 1 21 6699 1 1 7 CYS CB C -4.228 -1.154 12.870 1.00 . A A . 7 CYS CB 1 1 21 6700 1 1 7 CYS H H -3.324 -3.477 13.793 1.00 . A A . 7 CYS H 1 1 21 6701 1 1 7 CYS HA H -3.257 -0.704 14.707 1.00 . A A . 7 CYS HA 1 1 21 6702 1 1 7 CYS HB2 H -4.689 -2.020 12.394 1.00 . A A . 7 CYS HB2 1 1 21 6703 1 1 7 CYS HB3 H -4.984 -0.370 12.901 1.00 . A A . 7 CYS HB3 1 1 21 6704 1 1 7 CYS N N -3.002 -2.707 14.345 1.00 . A A . 7 CYS N 1 1 21 6705 1 1 7 CYS O O -5.241 -2.879 15.715 1.00 . A A . 7 CYS O 1 1 21 6706 1 1 7 CYS SG S -2.835 -0.586 11.828 1.00 . A A . 7 CYS SG 1 1 21 6707 1 1 8 LEU C C -8.213 -1.575 15.247 1.00 . A A . 8 LEU C 1 1 21 6708 1 1 8 LEU CA C -7.132 -0.872 16.068 1.00 . A A . 8 LEU CA 1 1 21 6709 1 1 8 LEU CB C -7.552 0.505 16.589 1.00 . A A . 8 LEU CB 1 1 21 6710 1 1 8 LEU CD1 C -8.919 -0.324 18.540 1.00 . A A . 8 LEU CD1 1 1 21 6711 1 1 8 LEU CD2 C -9.286 2.014 17.625 1.00 . A A . 8 LEU CD2 1 1 21 6712 1 1 8 LEU CG C -8.907 0.568 17.297 1.00 . A A . 8 LEU CG 1 1 21 6713 1 1 8 LEU H H -5.779 0.118 14.830 1.00 . A A . 8 LEU H 1 1 21 6714 1 1 8 LEU HA H -6.901 -1.488 16.937 1.00 . A A . 8 LEU HA 1 1 21 6715 1 1 8 LEU HB2 H -6.787 0.859 17.280 1.00 . A A . 8 LEU HB2 1 1 21 6716 1 1 8 LEU HB3 H -7.570 1.199 15.749 1.00 . A A . 8 LEU HB3 1 1 21 6717 1 1 8 LEU HD11 H -8.119 -1.061 18.466 1.00 . A A . 8 LEU HD11 1 1 21 6718 1 1 8 LEU HD12 H -8.765 0.290 19.428 1.00 . A A . 8 LEU HD12 1 1 21 6719 1 1 8 LEU HD13 H -9.879 -0.834 18.612 1.00 . A A . 8 LEU HD13 1 1 21 6720 1 1 8 LEU HD21 H -8.394 2.567 17.917 1.00 . A A . 8 LEU HD21 1 1 21 6721 1 1 8 LEU HD22 H -9.731 2.481 16.746 1.00 . A A . 8 LEU HD22 1 1 21 6722 1 1 8 LEU HD23 H -10.006 2.024 18.444 1.00 . A A . 8 LEU HD23 1 1 21 6723 1 1 8 LEU HG H -9.666 0.182 16.617 1.00 . A A . 8 LEU HG 1 1 21 6724 1 1 8 LEU N N -5.918 -0.766 15.275 1.00 . A A . 8 LEU N 1 1 21 6725 1 1 8 LEU O O -8.768 -2.584 15.678 1.00 . A A . 8 LEU O 1 1 21 6726 1 1 9 ALA C C -9.902 -0.520 12.164 1.00 . A A . 9 ALA C 1 1 21 6727 1 1 9 ALA CA C -9.486 -1.576 13.190 1.00 . A A . 9 ALA CA 1 1 21 6728 1 1 9 ALA CB C -10.669 -2.083 14.017 1.00 . A A . 9 ALA CB 1 1 21 6729 1 1 9 ALA H H -8.024 -0.194 13.733 1.00 . A A . 9 ALA H 1 1 21 6730 1 1 9 ALA HA H -9.035 -2.420 12.668 1.00 . A A . 9 ALA HA 1 1 21 6731 1 1 9 ALA HB1 H -10.639 -1.634 15.009 1.00 . A A . 9 ALA HB1 1 1 21 6732 1 1 9 ALA HB2 H -11.602 -1.810 13.523 1.00 . A A . 9 ALA HB2 1 1 21 6733 1 1 9 ALA HB3 H -10.611 -3.167 14.108 1.00 . A A . 9 ALA HB3 1 1 21 6734 1 1 9 ALA N N -8.481 -1.014 14.077 1.00 . A A . 9 ALA N 1 1 21 6735 1 1 9 ALA O O -10.698 0.367 12.469 1.00 . A A . 9 ALA O 1 1 21 6736 1 1 10 GLY C C -8.399 1.059 9.475 1.00 . A A . 10 GLY C 1 1 21 6737 1 1 10 GLY CA C -9.648 0.283 9.897 1.00 . A A . 10 GLY CA 1 1 21 6738 1 1 10 GLY H H -8.698 -1.374 10.729 1.00 . A A . 10 GLY H 1 1 21 6739 1 1 10 GLY HA2 H -10.049 -0.260 9.041 1.00 . A A . 10 GLY HA2 1 1 21 6740 1 1 10 GLY HA3 H -10.420 0.980 10.222 1.00 . A A . 10 GLY HA3 1 1 21 6741 1 1 10 GLY N N -9.345 -0.649 10.969 1.00 . A A . 10 GLY N 1 1 21 6742 1 1 10 GLY O O -8.188 1.308 8.289 1.00 . A A . 10 GLY O 1 1 21 6743 1 1 11 TYR C C -5.459 1.397 9.264 1.00 . A A . 11 TYR C 1 1 21 6744 1 1 11 TYR CA C -6.378 2.162 10.218 1.00 . A A . 11 TYR CA 1 1 21 6745 1 1 11 TYR CB C -5.682 2.304 11.573 1.00 . A A . 11 TYR CB 1 1 21 6746 1 1 11 TYR CD1 C -6.455 4.561 12.390 1.00 . A A . 11 TYR CD1 1 1 21 6747 1 1 11 TYR CD2 C -7.086 2.625 13.643 1.00 . A A . 11 TYR CD2 1 1 21 6748 1 1 11 TYR CE1 C -7.160 5.397 13.326 1.00 . A A . 11 TYR CE1 1 1 21 6749 1 1 11 TYR CE2 C -7.793 3.461 14.579 1.00 . A A . 11 TYR CE2 1 1 21 6750 1 1 11 TYR CG C -6.433 3.192 12.568 1.00 . A A . 11 TYR CG 1 1 21 6751 1 1 11 TYR CZ C -7.794 4.806 14.375 1.00 . A A . 11 TYR CZ 1 1 21 6752 1 1 11 TYR H H -7.779 1.214 11.432 1.00 . A A . 11 TYR H 1 1 21 6753 1 1 11 TYR HA H -6.651 3.114 9.762 1.00 . A A . 11 TYR HA 1 1 21 6754 1 1 11 TYR HB2 H -5.557 1.313 12.010 1.00 . A A . 11 TYR HB2 1 1 21 6755 1 1 11 TYR HB3 H -4.685 2.712 11.417 1.00 . A A . 11 TYR HB3 1 1 21 6756 1 1 11 TYR HD1 H -5.938 5.007 11.541 1.00 . A A . 11 TYR HD1 1 1 21 6757 1 1 11 TYR HD2 H -7.069 1.544 13.783 1.00 . A A . 11 TYR HD2 1 1 21 6758 1 1 11 TYR HE1 H -7.185 6.479 13.198 1.00 . A A . 11 TYR HE1 1 1 21 6759 1 1 11 TYR HE2 H -8.313 3.027 15.432 1.00 . A A . 11 TYR HE2 1 1 21 6760 1 1 11 TYR HH H -8.381 5.219 16.181 1.00 . A A . 11 TYR HH 1 1 21 6761 1 1 11 TYR N N -7.602 1.420 10.470 1.00 . A A . 11 TYR N 1 1 21 6762 1 1 11 TYR O O -5.551 0.175 9.153 1.00 . A A . 11 TYR O 1 1 21 6763 1 1 11 TYR OH O -8.460 5.596 15.259 1.00 . A A . 11 TYR OH 1 1 21 6764 1 1 12 MET C C -2.215 1.731 8.134 1.00 . A A . 12 MET C 1 1 21 6765 1 1 12 MET CA C -3.658 1.554 7.658 1.00 . A A . 12 MET CA 1 1 21 6766 1 1 12 MET CB C -3.827 2.213 6.287 1.00 . A A . 12 MET CB 1 1 21 6767 1 1 12 MET CE C -3.484 6.181 5.191 1.00 . A A . 12 MET CE 1 1 21 6768 1 1 12 MET CG C -3.717 3.735 6.393 1.00 . A A . 12 MET CG 1 1 21 6769 1 1 12 MET H H -4.524 3.140 8.694 1.00 . A A . 12 MET H 1 1 21 6770 1 1 12 MET HA H -3.910 0.494 7.622 1.00 . A A . 12 MET HA 1 1 21 6771 1 1 12 MET HB2 H -3.067 1.837 5.602 1.00 . A A . 12 MET HB2 1 1 21 6772 1 1 12 MET HB3 H -4.795 1.943 5.866 1.00 . A A . 12 MET HB3 1 1 21 6773 1 1 12 MET HE1 H -3.766 6.330 6.234 1.00 . A A . 12 MET HE1 1 1 21 6774 1 1 12 MET HE2 H -2.445 6.475 5.050 1.00 . A A . 12 MET HE2 1 1 21 6775 1 1 12 MET HE3 H -4.124 6.791 4.552 1.00 . A A . 12 MET HE3 1 1 21 6776 1 1 12 MET HG2 H -4.562 4.131 6.956 1.00 . A A . 12 MET HG2 1 1 21 6777 1 1 12 MET HG3 H -2.814 4.006 6.940 1.00 . A A . 12 MET HG3 1 1 21 6778 1 1 12 MET N N -4.593 2.147 8.598 1.00 . A A . 12 MET N 1 1 21 6779 1 1 12 MET O O -1.943 2.545 9.014 1.00 . A A . 12 MET O 1 1 21 6780 1 1 12 MET SD S -3.681 4.460 4.762 1.00 . A A . 12 MET SD 1 1 21 6781 1 1 13 ARG C C 0.862 1.788 6.825 1.00 . A A . 13 ARG C 1 1 21 6782 1 1 13 ARG CA C 0.081 1.010 7.885 1.00 . A A . 13 ARG CA 1 1 21 6783 1 1 13 ARG CB C 0.674 -0.394 8.018 1.00 . A A . 13 ARG CB 1 1 21 6784 1 1 13 ARG CD C 2.759 -0.967 6.720 1.00 . A A . 13 ARG CD 1 1 21 6785 1 1 13 ARG CG C 2.203 -0.347 8.003 1.00 . A A . 13 ARG CG 1 1 21 6786 1 1 13 ARG CZ C 4.368 -2.805 6.229 1.00 . A A . 13 ARG CZ 1 1 21 6787 1 1 13 ARG H H -1.556 0.292 6.816 1.00 . A A . 13 ARG H 1 1 21 6788 1 1 13 ARG HA H 0.106 1.524 8.846 1.00 . A A . 13 ARG HA 1 1 21 6789 1 1 13 ARG HB2 H 0.330 -0.852 8.945 1.00 . A A . 13 ARG HB2 1 1 21 6790 1 1 13 ARG HB3 H 0.318 -1.022 7.201 1.00 . A A . 13 ARG HB3 1 1 21 6791 1 1 13 ARG HD2 H 1.982 -1.546 6.220 1.00 . A A . 13 ARG HD2 1 1 21 6792 1 1 13 ARG HD3 H 3.064 -0.181 6.029 1.00 . A A . 13 ARG HD3 1 1 21 6793 1 1 13 ARG HE H 4.383 -1.694 7.907 1.00 . A A . 13 ARG HE 1 1 21 6794 1 1 13 ARG HG2 H 2.540 0.687 8.087 1.00 . A A . 13 ARG HG2 1 1 21 6795 1 1 13 ARG HG3 H 2.596 -0.881 8.869 1.00 . A A . 13 ARG HG3 1 1 21 6796 1 1 13 ARG HH11 H 2.983 -2.479 4.776 1.00 . A A . 13 ARG HH11 1 1 21 6797 1 1 13 ARG HH12 H 4.109 -3.754 4.449 1.00 . A A . 13 ARG HH12 1 1 21 6798 1 1 13 ARG HH21 H 5.869 -3.375 7.476 1.00 . A A . 13 ARG HH21 1 1 21 6799 1 1 13 ARG HH22 H 5.762 -4.267 5.995 1.00 . A A . 13 ARG HH22 1 1 21 6800 1 1 13 ARG N N -1.327 0.952 7.532 1.00 . A A . 13 ARG N 1 1 21 6801 1 1 13 ARG NE N 3.913 -1.837 7.036 1.00 . A A . 13 ARG NE 1 1 21 6802 1 1 13 ARG NH1 N 3.770 -3.032 5.052 1.00 . A A . 13 ARG NH1 1 1 21 6803 1 1 13 ARG NH2 N 5.422 -3.545 6.598 1.00 . A A . 13 ARG NH2 1 1 21 6804 1 1 13 ARG O O 1.111 1.279 5.733 1.00 . A A . 13 ARG O 1 1 21 6805 1 1 14 THR C C 3.304 3.204 5.896 1.00 . A A . 14 THR C 1 1 21 6806 1 1 14 THR CA C 1.977 3.864 6.276 1.00 . A A . 14 THR CA 1 1 21 6807 1 1 14 THR CB C 2.147 5.230 6.943 1.00 . A A . 14 THR CB 1 1 21 6808 1 1 14 THR CG2 C 0.856 5.724 7.600 1.00 . A A . 14 THR CG2 1 1 21 6809 1 1 14 THR H H 1.022 3.418 8.073 1.00 . A A . 14 THR H 1 1 21 6810 1 1 14 THR HA H 1.402 3.976 5.356 1.00 . A A . 14 THR HA 1 1 21 6811 1 1 14 THR HB H 2.529 5.965 6.235 1.00 . A A . 14 THR HB 1 1 21 6812 1 1 14 THR HG1 H 2.554 4.415 8.725 1.00 . A A . 14 THR HG1 1 1 21 6813 1 1 14 THR HG21 H 0.003 5.436 6.988 1.00 . A A . 14 THR HG21 1 1 21 6814 1 1 14 THR HG22 H 0.760 5.280 8.591 1.00 . A A . 14 THR HG22 1 1 21 6815 1 1 14 THR HG23 H 0.888 6.810 7.692 1.00 . A A . 14 THR HG23 1 1 21 6816 1 1 14 THR N N 1.229 3.011 7.183 1.00 . A A . 14 THR N 1 1 21 6817 1 1 14 THR O O 3.446 1.986 5.993 1.00 . A A . 14 THR O 1 1 21 6818 1 1 14 THR OG1 O 3.020 4.974 8.040 1.00 . A A . 14 THR OG1 1 1 21 6819 1 1 15 ALA C C 6.490 3.582 6.287 1.00 . A A . 15 ALA C 1 1 21 6820 1 1 15 ALA CA C 5.553 3.550 5.077 1.00 . A A . 15 ALA CA 1 1 21 6821 1 1 15 ALA CB C 6.080 4.389 3.910 1.00 . A A . 15 ALA CB 1 1 21 6822 1 1 15 ALA H H 4.119 5.027 5.396 1.00 . A A . 15 ALA H 1 1 21 6823 1 1 15 ALA HA H 5.438 2.519 4.745 1.00 . A A . 15 ALA HA 1 1 21 6824 1 1 15 ALA HB1 H 5.338 4.406 3.112 1.00 . A A . 15 ALA HB1 1 1 21 6825 1 1 15 ALA HB2 H 6.270 5.406 4.251 1.00 . A A . 15 ALA HB2 1 1 21 6826 1 1 15 ALA HB3 H 7.005 3.950 3.537 1.00 . A A . 15 ALA HB3 1 1 21 6827 1 1 15 ALA N N 4.243 4.037 5.472 1.00 . A A . 15 ALA N 1 1 21 6828 1 1 15 ALA O O 7.692 3.358 6.152 1.00 . A A . 15 ALA O 1 1 21 6829 1 1 16 ASP C C 6.187 2.830 9.626 1.00 . A A . 16 ASP C 1 1 21 6830 1 1 16 ASP CA C 6.670 3.926 8.674 1.00 . A A . 16 ASP CA 1 1 21 6831 1 1 16 ASP CB C 6.481 5.275 9.371 1.00 . A A . 16 ASP CB 1 1 21 6832 1 1 16 ASP CG C 7.753 5.877 9.971 1.00 . A A . 16 ASP CG 1 1 21 6833 1 1 16 ASP H H 4.925 4.045 7.542 1.00 . A A . 16 ASP H 1 1 21 6834 1 1 16 ASP HA H 7.708 3.790 8.373 1.00 . A A . 16 ASP HA 1 1 21 6835 1 1 16 ASP HB2 H 6.065 5.982 8.654 1.00 . A A . 16 ASP HB2 1 1 21 6836 1 1 16 ASP HB3 H 5.744 5.156 10.166 1.00 . A A . 16 ASP HB3 1 1 21 6837 1 1 16 ASP N N 5.903 3.863 7.441 1.00 . A A . 16 ASP N 1 1 21 6838 1 1 16 ASP O O 6.843 2.537 10.624 1.00 . A A . 16 ASP O 1 1 21 6839 1 1 16 ASP OD1 O 8.455 6.585 9.217 1.00 . A A . 16 ASP OD1 1 1 21 6840 1 1 16 ASP OD2 O 7.995 5.615 11.169 1.00 . A A . 16 ASP OD2 1 1 21 6841 1 1 17 GLY C C 3.486 1.766 11.122 1.00 . A A . 17 GLY C 1 1 21 6842 1 1 17 GLY CA C 4.466 1.196 10.096 1.00 . A A . 17 GLY CA 1 1 21 6843 1 1 17 GLY H H 4.516 2.498 8.471 1.00 . A A . 17 GLY H 1 1 21 6844 1 1 17 GLY HA2 H 3.954 0.479 9.455 1.00 . A A . 17 GLY HA2 1 1 21 6845 1 1 17 GLY HA3 H 5.261 0.653 10.610 1.00 . A A . 17 GLY HA3 1 1 21 6846 1 1 17 GLY N N 5.043 2.254 9.285 1.00 . A A . 17 GLY N 1 1 21 6847 1 1 17 GLY O O 2.888 1.019 11.896 1.00 . A A . 17 GLY O 1 1 21 6848 1 1 18 ARG C C 1.005 3.636 11.532 1.00 . A A . 18 ARG C 1 1 21 6849 1 1 18 ARG CA C 2.452 3.761 12.015 1.00 . A A . 18 ARG CA 1 1 21 6850 1 1 18 ARG CB C 2.812 5.243 12.145 1.00 . A A . 18 ARG CB 1 1 21 6851 1 1 18 ARG CD C 4.371 6.819 13.347 1.00 . A A . 18 ARG CD 1 1 21 6852 1 1 18 ARG CG C 4.202 5.416 12.760 1.00 . A A . 18 ARG CG 1 1 21 6853 1 1 18 ARG CZ C 5.558 8.890 12.633 1.00 . A A . 18 ARG CZ 1 1 21 6854 1 1 18 ARG H H 3.840 3.683 10.464 1.00 . A A . 18 ARG H 1 1 21 6855 1 1 18 ARG HA H 2.592 3.253 12.968 1.00 . A A . 18 ARG HA 1 1 21 6856 1 1 18 ARG HB2 H 2.783 5.715 11.163 1.00 . A A . 18 ARG HB2 1 1 21 6857 1 1 18 ARG HB3 H 2.071 5.748 12.764 1.00 . A A . 18 ARG HB3 1 1 21 6858 1 1 18 ARG HD2 H 3.403 7.210 13.661 1.00 . A A . 18 ARG HD2 1 1 21 6859 1 1 18 ARG HD3 H 5.001 6.778 14.235 1.00 . A A . 18 ARG HD3 1 1 21 6860 1 1 18 ARG HE H 4.948 7.437 11.381 1.00 . A A . 18 ARG HE 1 1 21 6861 1 1 18 ARG HG2 H 4.354 4.671 13.541 1.00 . A A . 18 ARG HG2 1 1 21 6862 1 1 18 ARG HG3 H 4.964 5.242 12.001 1.00 . A A . 18 ARG HG3 1 1 21 6863 1 1 18 ARG HH11 H 5.228 8.749 14.634 1.00 . A A . 18 ARG HH11 1 1 21 6864 1 1 18 ARG HH12 H 6.053 10.183 14.122 1.00 . A A . 18 ARG HH12 1 1 21 6865 1 1 18 ARG HH21 H 6.036 9.329 10.705 1.00 . A A . 18 ARG HH21 1 1 21 6866 1 1 18 ARG HH22 H 6.515 10.516 11.872 1.00 . A A . 18 ARG HH22 1 1 21 6867 1 1 18 ARG N N 3.350 3.083 11.096 1.00 . A A . 18 ARG N 1 1 21 6868 1 1 18 ARG NE N 4.975 7.720 12.340 1.00 . A A . 18 ARG NE 1 1 21 6869 1 1 18 ARG NH1 N 5.618 9.310 13.904 1.00 . A A . 18 ARG NH1 1 1 21 6870 1 1 18 ARG NH2 N 6.080 9.642 11.654 1.00 . A A . 18 ARG NH2 1 1 21 6871 1 1 18 ARG O O 0.645 4.182 10.490 1.00 . A A . 18 ARG O 1 1 21 6872 1 1 19 CYS C C -1.851 4.080 11.848 1.00 . A A . 19 CYS C 1 1 21 6873 1 1 19 CYS CA C -1.183 2.709 11.979 1.00 . A A . 19 CYS CA 1 1 21 6874 1 1 19 CYS CB C -1.888 1.827 13.011 1.00 . A A . 19 CYS CB 1 1 21 6875 1 1 19 CYS H H 0.517 2.474 13.159 1.00 . A A . 19 CYS H 1 1 21 6876 1 1 19 CYS HA H -1.203 2.177 11.028 1.00 . A A . 19 CYS HA 1 1 21 6877 1 1 19 CYS HB2 H -1.768 2.277 13.995 1.00 . A A . 19 CYS HB2 1 1 21 6878 1 1 19 CYS HB3 H -2.956 1.819 12.792 1.00 . A A . 19 CYS HB3 1 1 21 6879 1 1 19 CYS N N 0.216 2.914 12.314 1.00 . A A . 19 CYS N 1 1 21 6880 1 1 19 CYS O O -2.094 4.753 12.847 1.00 . A A . 19 CYS O 1 1 21 6881 1 1 19 CYS SG S -1.291 0.098 13.078 1.00 . A A . 19 CYS SG 1 1 21 6882 1 1 20 LYS C C -4.230 5.494 9.953 1.00 . A A . 20 LYS C 1 1 21 6883 1 1 20 LYS CA C -2.766 5.729 10.333 1.00 . A A . 20 LYS CA 1 1 21 6884 1 1 20 LYS CB C -1.975 6.506 9.279 1.00 . A A . 20 LYS CB 1 1 21 6885 1 1 20 LYS CD C 0.066 7.628 10.248 1.00 . A A . 20 LYS CD 1 1 21 6886 1 1 20 LYS CE C 0.364 8.294 11.593 1.00 . A A . 20 LYS CE 1 1 21 6887 1 1 20 LYS CG C -1.406 7.800 9.866 1.00 . A A . 20 LYS CG 1 1 21 6888 1 1 20 LYS H H -1.930 3.897 9.798 1.00 . A A . 20 LYS H 1 1 21 6889 1 1 20 LYS HA H -2.737 6.312 11.253 1.00 . A A . 20 LYS HA 1 1 21 6890 1 1 20 LYS HB2 H -1.163 5.887 8.898 1.00 . A A . 20 LYS HB2 1 1 21 6891 1 1 20 LYS HB3 H -2.621 6.740 8.433 1.00 . A A . 20 LYS HB3 1 1 21 6892 1 1 20 LYS HD2 H 0.309 6.566 10.302 1.00 . A A . 20 LYS HD2 1 1 21 6893 1 1 20 LYS HD3 H 0.700 8.061 9.475 1.00 . A A . 20 LYS HD3 1 1 21 6894 1 1 20 LYS HE2 H -0.525 8.811 11.955 1.00 . A A . 20 LYS HE2 1 1 21 6895 1 1 20 LYS HE3 H 0.616 7.535 12.334 1.00 . A A . 20 LYS HE3 1 1 21 6896 1 1 20 LYS HG2 H -1.504 8.607 9.139 1.00 . A A . 20 LYS HG2 1 1 21 6897 1 1 20 LYS HG3 H -1.982 8.090 10.744 1.00 . A A . 20 LYS HG3 1 1 21 6898 1 1 20 LYS HZ1 H 1.729 9.346 10.493 1.00 . A A . 20 LYS HZ1 1 1 21 6899 1 1 20 LYS HZ2 H 1.203 10.144 11.818 1.00 . A A . 20 LYS HZ2 1 1 21 6900 1 1 20 LYS HZ3 H 2.273 8.919 11.973 1.00 . A A . 20 LYS HZ3 1 1 21 6901 1 1 20 LYS N N -2.130 4.451 10.606 1.00 . A A . 20 LYS N 1 1 21 6902 1 1 20 LYS NZ N 1.483 9.254 11.458 1.00 . A A . 20 LYS NZ 1 1 21 6903 1 1 20 LYS O O -4.657 4.352 9.790 1.00 . A A . 20 LYS O 1 1 21 6904 1 1 21 PRO C C -6.558 6.218 7.979 1.00 . A A . 21 PRO C 1 1 21 6905 1 1 21 PRO CA C -6.385 6.549 9.462 1.00 . A A . 21 PRO CA 1 1 21 6906 1 1 21 PRO CB C -6.957 7.906 9.839 1.00 . A A . 21 PRO CB 1 1 21 6907 1 1 21 PRO CD C -4.507 7.991 10.005 1.00 . A A . 21 PRO CD 1 1 21 6908 1 1 21 PRO CG C -5.765 8.842 9.959 1.00 . A A . 21 PRO CG 1 1 21 6909 1 1 21 PRO HA H -6.832 5.808 9.963 1.00 . A A . 21 PRO HA 1 1 21 6910 1 1 21 PRO HB2 H -7.656 8.260 9.081 1.00 . A A . 21 PRO HB2 1 1 21 6911 1 1 21 PRO HB3 H -7.506 7.852 10.779 1.00 . A A . 21 PRO HB3 1 1 21 6912 1 1 21 PRO HD2 H -3.805 8.278 9.222 1.00 . A A . 21 PRO HD2 1 1 21 6913 1 1 21 PRO HD3 H -3.987 8.105 10.956 1.00 . A A . 21 PRO HD3 1 1 21 6914 1 1 21 PRO HG2 H -5.731 9.528 9.112 1.00 . A A . 21 PRO HG2 1 1 21 6915 1 1 21 PRO HG3 H -5.847 9.452 10.859 1.00 . A A . 21 PRO HG3 1 1 21 6916 1 1 21 PRO N N -4.979 6.622 9.820 1.00 . A A . 21 PRO N 1 1 21 6917 1 1 21 PRO O O -5.762 6.651 7.146 1.00 . A A . 21 PRO O 1 1 21 6918 1 1 22 THR C C -9.347 5.361 5.977 1.00 . A A . 22 THR C 1 1 21 6919 1 1 22 THR CA C -7.888 5.060 6.324 1.00 . A A . 22 THR CA 1 1 21 6920 1 1 22 THR CB C -7.520 3.583 6.170 1.00 . A A . 22 THR CB 1 1 21 6921 1 1 22 THR CG2 C -8.359 2.878 5.104 1.00 . A A . 22 THR CG2 1 1 21 6922 1 1 22 THR H H -8.243 5.106 8.376 1.00 . A A . 22 THR H 1 1 21 6923 1 1 22 THR HA H -7.270 5.660 5.657 1.00 . A A . 22 THR HA 1 1 21 6924 1 1 22 THR HB H -7.590 3.063 7.126 1.00 . A A . 22 THR HB 1 1 21 6925 1 1 22 THR HG1 H -6.236 3.959 4.683 1.00 . A A . 22 THR HG1 1 1 21 6926 1 1 22 THR HG21 H -8.391 3.491 4.203 1.00 . A A . 22 THR HG21 1 1 21 6927 1 1 22 THR HG22 H -7.913 1.912 4.869 1.00 . A A . 22 THR HG22 1 1 21 6928 1 1 22 THR HG23 H -9.373 2.730 5.477 1.00 . A A . 22 THR HG23 1 1 21 6929 1 1 22 THR N N -7.601 5.454 7.693 1.00 . A A . 22 THR N 1 1 21 6930 1 1 22 THR O O -9.812 5.027 4.890 1.00 . A A . 22 THR O 1 1 21 6931 1 1 22 THR OG1 O -6.206 3.607 5.619 1.00 . A A . 22 THR OG1 1 1 21 6932 1 1 23 PHE C C -11.565 7.770 6.202 1.00 . A A . 23 PHE C 1 1 21 6933 1 1 23 PHE CA C -11.426 6.342 6.732 1.00 . A A . 23 PHE CA 1 1 21 6934 1 1 23 PHE CB C -12.103 6.249 8.101 1.00 . A A . 23 PHE CB 1 1 21 6935 1 1 23 PHE CD1 C -11.436 8.414 9.169 1.00 . A A . 23 PHE CD1 1 1 21 6936 1 1 23 PHE CD2 C -10.744 6.412 10.198 1.00 . A A . 23 PHE CD2 1 1 21 6937 1 1 23 PHE CE1 C -10.785 9.162 10.186 1.00 . A A . 23 PHE CE1 1 1 21 6938 1 1 23 PHE CE2 C -10.094 7.159 11.215 1.00 . A A . 23 PHE CE2 1 1 21 6939 1 1 23 PHE CG C -11.402 7.055 9.196 1.00 . A A . 23 PHE CG 1 1 21 6940 1 1 23 PHE CZ C -10.128 8.518 11.188 1.00 . A A . 23 PHE CZ 1 1 21 6941 1 1 23 PHE H H -9.643 6.260 7.806 1.00 . A A . 23 PHE H 1 1 21 6942 1 1 23 PHE HA H -11.837 5.644 6.002 1.00 . A A . 23 PHE HA 1 1 21 6943 1 1 23 PHE HB2 H -13.132 6.598 8.011 1.00 . A A . 23 PHE HB2 1 1 21 6944 1 1 23 PHE HB3 H -12.145 5.204 8.404 1.00 . A A . 23 PHE HB3 1 1 21 6945 1 1 23 PHE HD1 H -11.963 8.930 8.366 1.00 . A A . 23 PHE HD1 1 1 21 6946 1 1 23 PHE HD2 H -10.717 5.322 10.221 1.00 . A A . 23 PHE HD2 1 1 21 6947 1 1 23 PHE HE1 H -10.813 10.252 10.164 1.00 . A A . 23 PHE HE1 1 1 21 6948 1 1 23 PHE HE2 H -9.567 6.644 12.018 1.00 . A A . 23 PHE HE2 1 1 21 6949 1 1 23 PHE HZ H -9.628 9.092 11.968 1.00 . A A . 23 PHE HZ 1 1 21 6950 1 1 23 PHE N N -10.029 5.991 6.924 1.00 . A A . 23 PHE N 1 1 21 6951 1 1 23 PHE O O -11.843 7.975 5.022 1.00 . A A . 23 PHE O 1 1 22 6952 1 1 1 GLU C C -0.859 -14.055 14.139 1.00 . A A . 1 GLU C 1 1 22 6953 1 1 1 GLU CA C -1.189 -15.523 14.417 1.00 . A A . 1 GLU CA 1 1 22 6954 1 1 1 GLU CB C -1.843 -16.178 13.199 1.00 . A A . 1 GLU CB 1 1 22 6955 1 1 1 GLU CD C -0.584 -18.160 12.279 1.00 . A A . 1 GLU CD 1 1 22 6956 1 1 1 GLU CG C -1.681 -17.699 13.241 1.00 . A A . 1 GLU CG 1 1 22 6957 1 1 1 GLU HA H -0.278 -16.066 14.668 1.00 . A A . 1 GLU HA 1 1 22 6958 1 1 1 GLU HB2 H -2.902 -15.922 13.169 1.00 . A A . 1 GLU HB2 1 1 22 6959 1 1 1 GLU HB3 H -1.395 -15.786 12.286 1.00 . A A . 1 GLU HB3 1 1 22 6960 1 1 1 GLU HG2 H -1.436 -18.014 14.255 1.00 . A A . 1 GLU HG2 1 1 22 6961 1 1 1 GLU HG3 H -2.625 -18.176 12.978 1.00 . A A . 1 GLU HG3 1 1 22 6962 1 1 1 GLU N N -2.041 -15.635 15.589 1.00 . A A . 1 GLU N 1 1 22 6963 1 1 1 GLU O O 0.307 -13.662 14.161 1.00 . A A . 1 GLU O 1 1 22 6964 1 1 1 GLU OE1 O 0.599 -18.012 12.655 1.00 . A A . 1 GLU OE1 1 1 22 6965 1 1 1 GLU OE2 O -0.954 -18.649 11.190 1.00 . A A . 1 GLU OE2 1 1 22 6966 1 1 2 ASN C C -3.110 -11.246 13.314 1.00 . A A . 2 ASN C 1 1 22 6967 1 1 2 ASN CA C -1.742 -11.868 13.602 1.00 . A A . 2 ASN CA 1 1 22 6968 1 1 2 ASN CB C -0.856 -11.649 12.375 1.00 . A A . 2 ASN CB 1 1 22 6969 1 1 2 ASN CG C -0.434 -10.184 12.256 1.00 . A A . 2 ASN CG 1 1 22 6970 1 1 2 ASN H H -2.851 -13.611 13.868 1.00 . A A . 2 ASN H 1 1 22 6971 1 1 2 ASN HA H -1.274 -11.451 14.495 1.00 . A A . 2 ASN HA 1 1 22 6972 1 1 2 ASN HB2 H 0.030 -12.282 12.443 1.00 . A A . 2 ASN HB2 1 1 22 6973 1 1 2 ASN HB3 H -1.393 -11.950 11.475 1.00 . A A . 2 ASN HB3 1 1 22 6974 1 1 2 ASN HD21 H -0.233 -10.451 10.259 1.00 . A A . 2 ASN HD21 1 1 22 6975 1 1 2 ASN HD22 H 0.128 -8.857 10.833 1.00 . A A . 2 ASN HD22 1 1 22 6976 1 1 2 ASN N N -1.905 -13.283 13.883 1.00 . A A . 2 ASN N 1 1 22 6977 1 1 2 ASN ND2 N -0.157 -9.798 11.014 1.00 . A A . 2 ASN ND2 1 1 22 6978 1 1 2 ASN O O -4.070 -11.959 13.025 1.00 . A A . 2 ASN O 1 1 22 6979 1 1 2 ASN OD1 O -0.365 -9.450 13.228 1.00 . A A . 2 ASN OD1 1 1 22 6980 1 1 3 PHE C C -4.352 -8.502 11.795 1.00 . A A . 3 PHE C 1 1 22 6981 1 1 3 PHE CA C -4.390 -9.200 13.156 1.00 . A A . 3 PHE CA 1 1 22 6982 1 1 3 PHE CB C -4.516 -8.144 14.255 1.00 . A A . 3 PHE CB 1 1 22 6983 1 1 3 PHE CD1 C -6.403 -9.048 15.632 1.00 . A A . 3 PHE CD1 1 1 22 6984 1 1 3 PHE CD2 C -6.679 -6.936 14.625 1.00 . A A . 3 PHE CD2 1 1 22 6985 1 1 3 PHE CE1 C -7.704 -8.951 16.192 1.00 . A A . 3 PHE CE1 1 1 22 6986 1 1 3 PHE CE2 C -7.980 -6.838 15.186 1.00 . A A . 3 PHE CE2 1 1 22 6987 1 1 3 PHE CG C -5.918 -8.039 14.860 1.00 . A A . 3 PHE CG 1 1 22 6988 1 1 3 PHE CZ C -8.465 -7.847 15.957 1.00 . A A . 3 PHE CZ 1 1 22 6989 1 1 3 PHE H H -2.370 -9.354 13.640 1.00 . A A . 3 PHE H 1 1 22 6990 1 1 3 PHE HA H -5.200 -9.929 13.166 1.00 . A A . 3 PHE HA 1 1 22 6991 1 1 3 PHE HB2 H -3.806 -8.374 15.049 1.00 . A A . 3 PHE HB2 1 1 22 6992 1 1 3 PHE HB3 H -4.234 -7.174 13.846 1.00 . A A . 3 PHE HB3 1 1 22 6993 1 1 3 PHE HD1 H -5.793 -9.932 15.819 1.00 . A A . 3 PHE HD1 1 1 22 6994 1 1 3 PHE HD2 H -6.290 -6.127 14.007 1.00 . A A . 3 PHE HD2 1 1 22 6995 1 1 3 PHE HE1 H -8.093 -9.760 16.810 1.00 . A A . 3 PHE HE1 1 1 22 6996 1 1 3 PHE HE2 H -8.590 -5.955 14.997 1.00 . A A . 3 PHE HE2 1 1 22 6997 1 1 3 PHE HZ H -9.464 -7.773 16.388 1.00 . A A . 3 PHE HZ 1 1 22 6998 1 1 3 PHE N N -3.155 -9.925 13.404 1.00 . A A . 3 PHE N 1 1 22 6999 1 1 3 PHE O O -5.141 -8.823 10.907 1.00 . A A . 3 PHE O 1 1 22 7000 1 1 4 ASN C C -2.195 -5.749 10.618 1.00 . A A . 4 ASN C 1 1 22 7001 1 1 4 ASN CA C -3.278 -6.814 10.437 1.00 . A A . 4 ASN CA 1 1 22 7002 1 1 4 ASN CB C -4.581 -6.107 10.059 1.00 . A A . 4 ASN CB 1 1 22 7003 1 1 4 ASN CG C -4.434 -5.363 8.730 1.00 . A A . 4 ASN CG 1 1 22 7004 1 1 4 ASN H H -2.791 -7.306 12.401 1.00 . A A . 4 ASN H 1 1 22 7005 1 1 4 ASN HA H -3.010 -7.558 9.686 1.00 . A A . 4 ASN HA 1 1 22 7006 1 1 4 ASN HB2 H -5.387 -6.836 9.984 1.00 . A A . 4 ASN HB2 1 1 22 7007 1 1 4 ASN HB3 H -4.858 -5.404 10.844 1.00 . A A . 4 ASN HB3 1 1 22 7008 1 1 4 ASN HD21 H -4.772 -3.629 9.718 1.00 . A A . 4 ASN HD21 1 1 22 7009 1 1 4 ASN HD22 H -4.504 -3.470 8.014 1.00 . A A . 4 ASN HD22 1 1 22 7010 1 1 4 ASN N N -3.429 -7.561 11.674 1.00 . A A . 4 ASN N 1 1 22 7011 1 1 4 ASN ND2 N -4.582 -4.044 8.829 1.00 . A A . 4 ASN ND2 1 1 22 7012 1 1 4 ASN O O -2.364 -4.609 10.187 1.00 . A A . 4 ASN O 1 1 22 7013 1 1 4 ASN OD1 O -4.202 -5.946 7.684 1.00 . A A . 4 ASN OD1 1 1 22 7014 1 1 5 GLY C C 0.038 -4.809 12.962 1.00 . A A . 5 GLY C 1 1 22 7015 1 1 5 GLY CA C 0.001 -5.251 11.499 1.00 . A A . 5 GLY CA 1 1 22 7016 1 1 5 GLY H H -0.980 -7.086 11.602 1.00 . A A . 5 GLY H 1 1 22 7017 1 1 5 GLY HA2 H 0.940 -5.742 11.239 1.00 . A A . 5 GLY HA2 1 1 22 7018 1 1 5 GLY HA3 H -0.090 -4.378 10.853 1.00 . A A . 5 GLY HA3 1 1 22 7019 1 1 5 GLY N N -1.108 -6.157 11.255 1.00 . A A . 5 GLY N 1 1 22 7020 1 1 5 GLY O O 1.112 -4.663 13.544 1.00 . A A . 5 GLY O 1 1 22 7021 1 1 6 GLY C C -2.016 -2.856 15.008 1.00 . A A . 6 GLY C 1 1 22 7022 1 1 6 GLY CA C -1.267 -4.186 14.902 1.00 . A A . 6 GLY CA 1 1 22 7023 1 1 6 GLY H H -2.018 -4.729 13.036 1.00 . A A . 6 GLY H 1 1 22 7024 1 1 6 GLY HA2 H -1.790 -4.950 15.476 1.00 . A A . 6 GLY HA2 1 1 22 7025 1 1 6 GLY HA3 H -0.274 -4.083 15.339 1.00 . A A . 6 GLY HA3 1 1 22 7026 1 1 6 GLY N N -1.149 -4.608 13.516 1.00 . A A . 6 GLY N 1 1 22 7027 1 1 6 GLY O O -1.577 -1.946 15.707 1.00 . A A . 6 GLY O 1 1 22 7028 1 1 7 CYS C C -5.182 -1.844 15.182 1.00 . A A . 7 CYS C 1 1 22 7029 1 1 7 CYS CA C -3.952 -1.585 14.310 1.00 . A A . 7 CYS CA 1 1 22 7030 1 1 7 CYS CB C -4.338 -1.157 12.893 1.00 . A A . 7 CYS CB 1 1 22 7031 1 1 7 CYS H H -3.487 -3.534 13.737 1.00 . A A . 7 CYS H 1 1 22 7032 1 1 7 CYS HA H -3.337 -0.792 14.733 1.00 . A A . 7 CYS HA 1 1 22 7033 1 1 7 CYS HB2 H -4.809 -2.000 12.388 1.00 . A A . 7 CYS HB2 1 1 22 7034 1 1 7 CYS HB3 H -5.086 -0.366 12.958 1.00 . A A . 7 CYS HB3 1 1 22 7035 1 1 7 CYS N N -3.136 -2.788 14.303 1.00 . A A . 7 CYS N 1 1 22 7036 1 1 7 CYS O O -5.305 -2.907 15.790 1.00 . A A . 7 CYS O 1 1 22 7037 1 1 7 CYS SG S -2.946 -0.562 11.864 1.00 . A A . 7 CYS SG 1 1 22 7038 1 1 8 LEU C C -8.369 -1.629 15.165 1.00 . A A . 8 LEU C 1 1 22 7039 1 1 8 LEU CA C -7.278 -0.961 16.005 1.00 . A A . 8 LEU CA 1 1 22 7040 1 1 8 LEU CB C -7.680 0.408 16.559 1.00 . A A . 8 LEU CB 1 1 22 7041 1 1 8 LEU CD1 C -9.060 -0.460 18.483 1.00 . A A . 8 LEU CD1 1 1 22 7042 1 1 8 LEU CD2 C -9.385 1.913 17.648 1.00 . A A . 8 LEU CD2 1 1 22 7043 1 1 8 LEU CG C -9.032 0.473 17.271 1.00 . A A . 8 LEU CG 1 1 22 7044 1 1 8 LEU H H -5.955 0.007 14.721 1.00 . A A . 8 LEU H 1 1 22 7045 1 1 8 LEU HA H -7.059 -1.602 16.859 1.00 . A A . 8 LEU HA 1 1 22 7046 1 1 8 LEU HB2 H -6.908 0.736 17.256 1.00 . A A . 8 LEU HB2 1 1 22 7047 1 1 8 LEU HB3 H -7.690 1.122 15.735 1.00 . A A . 8 LEU HB3 1 1 22 7048 1 1 8 LEU HD11 H -8.204 -1.136 18.441 1.00 . A A . 8 LEU HD11 1 1 22 7049 1 1 8 LEU HD12 H -9.011 0.130 19.398 1.00 . A A . 8 LEU HD12 1 1 22 7050 1 1 8 LEU HD13 H -9.981 -1.041 18.474 1.00 . A A . 8 LEU HD13 1 1 22 7051 1 1 8 LEU HD21 H -8.651 2.592 17.213 1.00 . A A . 8 LEU HD21 1 1 22 7052 1 1 8 LEU HD22 H -10.376 2.156 17.268 1.00 . A A . 8 LEU HD22 1 1 22 7053 1 1 8 LEU HD23 H -9.376 2.017 18.733 1.00 . A A . 8 LEU HD23 1 1 22 7054 1 1 8 LEU HG H -9.800 0.124 16.580 1.00 . A A . 8 LEU HG 1 1 22 7055 1 1 8 LEU N N -6.062 -0.854 15.217 1.00 . A A . 8 LEU N 1 1 22 7056 1 1 8 LEU O O -8.937 -2.641 15.571 1.00 . A A . 8 LEU O 1 1 22 7057 1 1 9 ALA C C -10.041 -0.471 12.111 1.00 . A A . 9 ALA C 1 1 22 7058 1 1 9 ALA CA C -9.640 -1.559 13.109 1.00 . A A . 9 ALA CA 1 1 22 7059 1 1 9 ALA CB C -10.830 -2.072 13.922 1.00 . A A . 9 ALA CB 1 1 22 7060 1 1 9 ALA H H -8.159 -0.211 13.687 1.00 . A A . 9 ALA H 1 1 22 7061 1 1 9 ALA HA H -9.199 -2.395 12.565 1.00 . A A . 9 ALA HA 1 1 22 7062 1 1 9 ALA HB1 H -10.826 -1.605 14.906 1.00 . A A . 9 ALA HB1 1 1 22 7063 1 1 9 ALA HB2 H -11.756 -1.824 13.405 1.00 . A A . 9 ALA HB2 1 1 22 7064 1 1 9 ALA HB3 H -10.754 -3.154 14.032 1.00 . A A . 9 ALA HB3 1 1 22 7065 1 1 9 ALA N N -8.627 -1.034 14.009 1.00 . A A . 9 ALA N 1 1 22 7066 1 1 9 ALA O O -10.865 0.387 12.420 1.00 . A A . 9 ALA O 1 1 22 7067 1 1 10 GLY C C -8.457 1.185 9.484 1.00 . A A . 10 GLY C 1 1 22 7068 1 1 10 GLY CA C -9.723 0.425 9.887 1.00 . A A . 10 GLY CA 1 1 22 7069 1 1 10 GLY H H -8.769 -1.245 10.688 1.00 . A A . 10 GLY H 1 1 22 7070 1 1 10 GLY HA2 H -10.138 -0.084 9.017 1.00 . A A . 10 GLY HA2 1 1 22 7071 1 1 10 GLY HA3 H -10.478 1.130 10.234 1.00 . A A . 10 GLY HA3 1 1 22 7072 1 1 10 GLY N N -9.438 -0.543 10.932 1.00 . A A . 10 GLY N 1 1 22 7073 1 1 10 GLY O O -8.300 1.566 8.325 1.00 . A A . 10 GLY O 1 1 22 7074 1 1 11 TYR C C -5.384 1.245 9.379 1.00 . A A . 11 TYR C 1 1 22 7075 1 1 11 TYR CA C -6.340 2.090 10.225 1.00 . A A . 11 TYR CA 1 1 22 7076 1 1 11 TYR CB C -5.716 2.318 11.603 1.00 . A A . 11 TYR CB 1 1 22 7077 1 1 11 TYR CD1 C -6.433 4.603 12.390 1.00 . A A . 11 TYR CD1 1 1 22 7078 1 1 11 TYR CD2 C -7.381 2.687 13.460 1.00 . A A . 11 TYR CD2 1 1 22 7079 1 1 11 TYR CE1 C -7.207 5.463 13.249 1.00 . A A . 11 TYR CE1 1 1 22 7080 1 1 11 TYR CE2 C -8.154 3.547 14.318 1.00 . A A . 11 TYR CE2 1 1 22 7081 1 1 11 TYR CG C -6.537 3.232 12.514 1.00 . A A . 11 TYR CG 1 1 22 7082 1 1 11 TYR CZ C -8.028 4.893 14.169 1.00 . A A . 11 TYR CZ 1 1 22 7083 1 1 11 TYR H H -7.723 1.068 11.403 1.00 . A A . 11 TYR H 1 1 22 7084 1 1 11 TYR HA H -6.572 3.010 9.689 1.00 . A A . 11 TYR HA 1 1 22 7085 1 1 11 TYR HB2 H -5.584 1.355 12.096 1.00 . A A . 11 TYR HB2 1 1 22 7086 1 1 11 TYR HB3 H -4.723 2.748 11.473 1.00 . A A . 11 TYR HB3 1 1 22 7087 1 1 11 TYR HD1 H -5.767 5.034 11.643 1.00 . A A . 11 TYR HD1 1 1 22 7088 1 1 11 TYR HD2 H -7.462 1.604 13.557 1.00 . A A . 11 TYR HD2 1 1 22 7089 1 1 11 TYR HE1 H -7.135 6.548 13.161 1.00 . A A . 11 TYR HE1 1 1 22 7090 1 1 11 TYR HE2 H -8.824 3.129 15.068 1.00 . A A . 11 TYR HE2 1 1 22 7091 1 1 11 TYR HH H -8.286 5.834 15.851 1.00 . A A . 11 TYR HH 1 1 22 7092 1 1 11 TYR N N -7.586 1.382 10.463 1.00 . A A . 11 TYR N 1 1 22 7093 1 1 11 TYR O O -5.449 0.017 9.402 1.00 . A A . 11 TYR O 1 1 22 7094 1 1 11 TYR OH O -8.759 5.706 14.979 1.00 . A A . 11 TYR OH 1 1 22 7095 1 1 12 MET C C -2.121 1.597 8.233 1.00 . A A . 12 MET C 1 1 22 7096 1 1 12 MET CA C -3.551 1.268 7.801 1.00 . A A . 12 MET CA 1 1 22 7097 1 1 12 MET CB C -3.760 1.704 6.350 1.00 . A A . 12 MET CB 1 1 22 7098 1 1 12 MET CE C -3.694 5.484 4.721 1.00 . A A . 12 MET CE 1 1 22 7099 1 1 12 MET CG C -3.901 3.225 6.249 1.00 . A A . 12 MET CG 1 1 22 7100 1 1 12 MET H H -4.473 2.937 8.640 1.00 . A A . 12 MET H 1 1 22 7101 1 1 12 MET HA H -3.740 0.202 7.926 1.00 . A A . 12 MET HA 1 1 22 7102 1 1 12 MET HB2 H -2.919 1.373 5.741 1.00 . A A . 12 MET HB2 1 1 22 7103 1 1 12 MET HB3 H -4.652 1.226 5.947 1.00 . A A . 12 MET HB3 1 1 22 7104 1 1 12 MET HE1 H -3.478 6.002 5.656 1.00 . A A . 12 MET HE1 1 1 22 7105 1 1 12 MET HE2 H -3.226 6.018 3.895 1.00 . A A . 12 MET HE2 1 1 22 7106 1 1 12 MET HE3 H -4.772 5.448 4.567 1.00 . A A . 12 MET HE3 1 1 22 7107 1 1 12 MET HG2 H -4.955 3.498 6.199 1.00 . A A . 12 MET HG2 1 1 22 7108 1 1 12 MET HG3 H -3.492 3.696 7.143 1.00 . A A . 12 MET HG3 1 1 22 7109 1 1 12 MET N N -4.520 1.938 8.653 1.00 . A A . 12 MET N 1 1 22 7110 1 1 12 MET O O -1.894 2.566 8.956 1.00 . A A . 12 MET O 1 1 22 7111 1 1 12 MET SD S -3.046 3.823 4.800 1.00 . A A . 12 MET SD 1 1 22 7112 1 1 13 ARG C C 0.931 1.680 6.957 1.00 . A A . 13 ARG C 1 1 22 7113 1 1 13 ARG CA C 0.210 0.964 8.101 1.00 . A A . 13 ARG CA 1 1 22 7114 1 1 13 ARG CB C 0.900 -0.375 8.370 1.00 . A A . 13 ARG CB 1 1 22 7115 1 1 13 ARG CD C 1.469 -0.740 10.800 1.00 . A A . 13 ARG CD 1 1 22 7116 1 1 13 ARG CG C 1.975 -0.229 9.449 1.00 . A A . 13 ARG CG 1 1 22 7117 1 1 13 ARG CZ C 2.855 -2.754 11.286 1.00 . A A . 13 ARG CZ 1 1 22 7118 1 1 13 ARG H H -1.384 -0.013 7.183 1.00 . A A . 13 ARG H 1 1 22 7119 1 1 13 ARG HA H 0.203 1.575 9.003 1.00 . A A . 13 ARG HA 1 1 22 7120 1 1 13 ARG HB2 H 0.162 -1.112 8.685 1.00 . A A . 13 ARG HB2 1 1 22 7121 1 1 13 ARG HB3 H 1.351 -0.747 7.451 1.00 . A A . 13 ARG HB3 1 1 22 7122 1 1 13 ARG HD2 H 1.126 0.096 11.409 1.00 . A A . 13 ARG HD2 1 1 22 7123 1 1 13 ARG HD3 H 0.614 -1.399 10.651 1.00 . A A . 13 ARG HD3 1 1 22 7124 1 1 13 ARG HE H 3.086 -0.967 12.183 1.00 . A A . 13 ARG HE 1 1 22 7125 1 1 13 ARG HG2 H 2.867 -0.785 9.157 1.00 . A A . 13 ARG HG2 1 1 22 7126 1 1 13 ARG HG3 H 2.267 0.817 9.538 1.00 . A A . 13 ARG HG3 1 1 22 7127 1 1 13 ARG HH11 H 1.419 -3.032 9.872 1.00 . A A . 13 ARG HH11 1 1 22 7128 1 1 13 ARG HH12 H 2.390 -4.423 10.221 1.00 . A A . 13 ARG HH12 1 1 22 7129 1 1 13 ARG HH21 H 4.368 -2.802 12.643 1.00 . A A . 13 ARG HH21 1 1 22 7130 1 1 13 ARG HH22 H 4.079 -4.291 11.808 1.00 . A A . 13 ARG HH22 1 1 22 7131 1 1 13 ARG N N -1.192 0.772 7.771 1.00 . A A . 13 ARG N 1 1 22 7132 1 1 13 ARG NE N 2.550 -1.467 11.503 1.00 . A A . 13 ARG NE 1 1 22 7133 1 1 13 ARG NH1 N 2.163 -3.463 10.383 1.00 . A A . 13 ARG NH1 1 1 22 7134 1 1 13 ARG NH2 N 3.851 -3.331 11.970 1.00 . A A . 13 ARG NH2 1 1 22 7135 1 1 13 ARG O O 1.183 1.087 5.909 1.00 . A A . 13 ARG O 1 1 22 7136 1 1 14 THR C C 3.266 3.108 5.826 1.00 . A A . 14 THR C 1 1 22 7137 1 1 14 THR CA C 1.928 3.749 6.201 1.00 . A A . 14 THR CA 1 1 22 7138 1 1 14 THR CB C 2.069 5.170 6.753 1.00 . A A . 14 THR CB 1 1 22 7139 1 1 14 THR CG2 C 0.759 5.702 7.337 1.00 . A A . 14 THR CG2 1 1 22 7140 1 1 14 THR H H 1.033 3.420 8.053 1.00 . A A . 14 THR H 1 1 22 7141 1 1 14 THR HA H 1.319 3.770 5.297 1.00 . A A . 14 THR HA 1 1 22 7142 1 1 14 THR HB H 2.460 5.845 5.993 1.00 . A A . 14 THR HB 1 1 22 7143 1 1 14 THR HG1 H 3.664 5.682 7.847 1.00 . A A . 14 THR HG1 1 1 22 7144 1 1 14 THR HG21 H -0.082 5.305 6.768 1.00 . A A . 14 THR HG21 1 1 22 7145 1 1 14 THR HG22 H 0.672 5.392 8.379 1.00 . A A . 14 THR HG22 1 1 22 7146 1 1 14 THR HG23 H 0.752 6.791 7.281 1.00 . A A . 14 THR HG23 1 1 22 7147 1 1 14 THR N N 1.242 2.945 7.198 1.00 . A A . 14 THR N 1 1 22 7148 1 1 14 THR O O 3.431 1.895 5.947 1.00 . A A . 14 THR O 1 1 22 7149 1 1 14 THR OG1 O 2.918 5.017 7.888 1.00 . A A . 14 THR OG1 1 1 22 7150 1 1 15 ALA C C 6.467 3.634 6.169 1.00 . A A . 15 ALA C 1 1 22 7151 1 1 15 ALA CA C 5.504 3.481 4.989 1.00 . A A . 15 ALA CA 1 1 22 7152 1 1 15 ALA CB C 5.972 4.247 3.751 1.00 . A A . 15 ALA CB 1 1 22 7153 1 1 15 ALA H H 4.043 4.936 5.287 1.00 . A A . 15 ALA H 1 1 22 7154 1 1 15 ALA HA H 5.418 2.424 4.736 1.00 . A A . 15 ALA HA 1 1 22 7155 1 1 15 ALA HB1 H 5.530 5.244 3.753 1.00 . A A . 15 ALA HB1 1 1 22 7156 1 1 15 ALA HB2 H 7.059 4.332 3.766 1.00 . A A . 15 ALA HB2 1 1 22 7157 1 1 15 ALA HB3 H 5.661 3.713 2.854 1.00 . A A . 15 ALA HB3 1 1 22 7158 1 1 15 ALA N N 4.186 3.950 5.381 1.00 . A A . 15 ALA N 1 1 22 7159 1 1 15 ALA O O 7.676 3.467 6.013 1.00 . A A . 15 ALA O 1 1 22 7160 1 1 16 ASP C C 6.323 3.040 9.537 1.00 . A A . 16 ASP C 1 1 22 7161 1 1 16 ASP CA C 6.688 4.129 8.526 1.00 . A A . 16 ASP CA 1 1 22 7162 1 1 16 ASP CB C 6.409 5.487 9.173 1.00 . A A . 16 ASP CB 1 1 22 7163 1 1 16 ASP CG C 7.306 5.833 10.363 1.00 . A A . 16 ASP CG 1 1 22 7164 1 1 16 ASP H H 4.911 4.085 7.439 1.00 . A A . 16 ASP H 1 1 22 7165 1 1 16 ASP HA H 7.725 4.063 8.198 1.00 . A A . 16 ASP HA 1 1 22 7166 1 1 16 ASP HB2 H 6.520 6.263 8.415 1.00 . A A . 16 ASP HB2 1 1 22 7167 1 1 16 ASP HB3 H 5.370 5.509 9.502 1.00 . A A . 16 ASP HB3 1 1 22 7168 1 1 16 ASP N N 5.895 3.950 7.321 1.00 . A A . 16 ASP N 1 1 22 7169 1 1 16 ASP O O 7.076 2.781 10.475 1.00 . A A . 16 ASP O 1 1 22 7170 1 1 16 ASP OD1 O 8.484 5.417 10.325 1.00 . A A . 16 ASP OD1 1 1 22 7171 1 1 16 ASP OD2 O 6.794 6.506 11.283 1.00 . A A . 16 ASP OD2 1 1 22 7172 1 1 17 GLY C C 3.680 1.916 11.201 1.00 . A A . 17 GLY C 1 1 22 7173 1 1 17 GLY CA C 4.696 1.375 10.192 1.00 . A A . 17 GLY CA 1 1 22 7174 1 1 17 GLY H H 4.561 2.648 8.548 1.00 . A A . 17 GLY H 1 1 22 7175 1 1 17 GLY HA2 H 4.238 0.583 9.600 1.00 . A A . 17 GLY HA2 1 1 22 7176 1 1 17 GLY HA3 H 5.539 0.933 10.721 1.00 . A A . 17 GLY HA3 1 1 22 7177 1 1 17 GLY N N 5.169 2.431 9.313 1.00 . A A . 17 GLY N 1 1 22 7178 1 1 17 GLY O O 3.197 1.177 12.057 1.00 . A A . 17 GLY O 1 1 22 7179 1 1 18 ARG C C 1.009 3.644 11.448 1.00 . A A . 18 ARG C 1 1 22 7180 1 1 18 ARG CA C 2.437 3.849 11.956 1.00 . A A . 18 ARG CA 1 1 22 7181 1 1 18 ARG CB C 2.722 5.348 12.069 1.00 . A A . 18 ARG CB 1 1 22 7182 1 1 18 ARG CD C 2.965 7.410 10.638 1.00 . A A . 18 ARG CD 1 1 22 7183 1 1 18 ARG CG C 2.205 6.097 10.839 1.00 . A A . 18 ARG CG 1 1 22 7184 1 1 18 ARG CZ C 2.354 9.775 10.145 1.00 . A A . 18 ARG CZ 1 1 22 7185 1 1 18 ARG H H 3.784 3.796 10.368 1.00 . A A . 18 ARG H 1 1 22 7186 1 1 18 ARG HA H 2.583 3.363 12.921 1.00 . A A . 18 ARG HA 1 1 22 7187 1 1 18 ARG HB2 H 2.248 5.745 12.967 1.00 . A A . 18 ARG HB2 1 1 22 7188 1 1 18 ARG HB3 H 3.794 5.511 12.175 1.00 . A A . 18 ARG HB3 1 1 22 7189 1 1 18 ARG HD2 H 3.637 7.583 11.478 1.00 . A A . 18 ARG HD2 1 1 22 7190 1 1 18 ARG HD3 H 3.583 7.348 9.742 1.00 . A A . 18 ARG HD3 1 1 22 7191 1 1 18 ARG HE H 1.048 8.356 10.722 1.00 . A A . 18 ARG HE 1 1 22 7192 1 1 18 ARG HG2 H 2.314 5.470 9.954 1.00 . A A . 18 ARG HG2 1 1 22 7193 1 1 18 ARG HG3 H 1.141 6.303 10.955 1.00 . A A . 18 ARG HG3 1 1 22 7194 1 1 18 ARG HH11 H 4.329 9.345 9.922 1.00 . A A . 18 ARG HH11 1 1 22 7195 1 1 18 ARG HH12 H 3.889 10.985 9.583 1.00 . A A . 18 ARG HH12 1 1 22 7196 1 1 18 ARG HH21 H 0.466 10.520 10.274 1.00 . A A . 18 ARG HH21 1 1 22 7197 1 1 18 ARG HH22 H 1.677 11.658 9.785 1.00 . A A . 18 ARG HH22 1 1 22 7198 1 1 18 ARG N N 3.386 3.201 11.067 1.00 . A A . 18 ARG N 1 1 22 7199 1 1 18 ARG NE N 2.010 8.534 10.515 1.00 . A A . 18 ARG NE 1 1 22 7200 1 1 18 ARG NH1 N 3.632 10.059 9.859 1.00 . A A . 18 ARG NH1 1 1 22 7201 1 1 18 ARG NH2 N 1.420 10.732 10.061 1.00 . A A . 18 ARG NH2 1 1 22 7202 1 1 18 ARG O O 0.674 4.064 10.341 1.00 . A A . 18 ARG O 1 1 22 7203 1 1 19 CYS C C -1.899 4.073 11.763 1.00 . A A . 19 CYS C 1 1 22 7204 1 1 19 CYS CA C -1.179 2.733 11.929 1.00 . A A . 19 CYS CA 1 1 22 7205 1 1 19 CYS CB C -1.865 1.842 12.967 1.00 . A A . 19 CYS CB 1 1 22 7206 1 1 19 CYS H H 0.486 2.662 13.179 1.00 . A A . 19 CYS H 1 1 22 7207 1 1 19 CYS HA H -1.163 2.183 10.988 1.00 . A A . 19 CYS HA 1 1 22 7208 1 1 19 CYS HB2 H -1.707 2.272 13.956 1.00 . A A . 19 CYS HB2 1 1 22 7209 1 1 19 CYS HB3 H -2.940 1.853 12.782 1.00 . A A . 19 CYS HB3 1 1 22 7210 1 1 19 CYS N N 0.205 2.999 12.281 1.00 . A A . 19 CYS N 1 1 22 7211 1 1 19 CYS O O -2.316 4.684 12.745 1.00 . A A . 19 CYS O 1 1 22 7212 1 1 19 CYS SG S -1.291 0.105 12.986 1.00 . A A . 19 CYS SG 1 1 22 7213 1 1 20 LYS C C -4.158 5.482 9.899 1.00 . A A . 20 LYS C 1 1 22 7214 1 1 20 LYS CA C -2.682 5.748 10.204 1.00 . A A . 20 LYS CA 1 1 22 7215 1 1 20 LYS CB C -1.945 6.481 9.081 1.00 . A A . 20 LYS CB 1 1 22 7216 1 1 20 LYS CD C -1.151 8.871 8.953 1.00 . A A . 20 LYS CD 1 1 22 7217 1 1 20 LYS CE C -1.348 9.993 9.975 1.00 . A A . 20 LYS CE 1 1 22 7218 1 1 20 LYS CG C -0.976 7.520 9.649 1.00 . A A . 20 LYS CG 1 1 22 7219 1 1 20 LYS H H -1.679 3.988 9.718 1.00 . A A . 20 LYS H 1 1 22 7220 1 1 20 LYS HA H -2.621 6.376 11.093 1.00 . A A . 20 LYS HA 1 1 22 7221 1 1 20 LYS HB2 H -1.397 5.763 8.471 1.00 . A A . 20 LYS HB2 1 1 22 7222 1 1 20 LYS HB3 H -2.666 6.970 8.427 1.00 . A A . 20 LYS HB3 1 1 22 7223 1 1 20 LYS HD2 H -0.276 9.084 8.339 1.00 . A A . 20 LYS HD2 1 1 22 7224 1 1 20 LYS HD3 H -2.009 8.830 8.283 1.00 . A A . 20 LYS HD3 1 1 22 7225 1 1 20 LYS HE2 H -2.371 9.974 10.352 1.00 . A A . 20 LYS HE2 1 1 22 7226 1 1 20 LYS HE3 H -0.691 9.833 10.830 1.00 . A A . 20 LYS HE3 1 1 22 7227 1 1 20 LYS HG2 H -1.145 7.634 10.720 1.00 . A A . 20 LYS HG2 1 1 22 7228 1 1 20 LYS HG3 H 0.050 7.173 9.524 1.00 . A A . 20 LYS HG3 1 1 22 7229 1 1 20 LYS HZ1 H -0.118 11.326 9.033 1.00 . A A . 20 LYS HZ1 1 1 22 7230 1 1 20 LYS HZ2 H -1.685 11.461 8.594 1.00 . A A . 20 LYS HZ2 1 1 22 7231 1 1 20 LYS HZ3 H -1.191 12.029 10.043 1.00 . A A . 20 LYS HZ3 1 1 22 7232 1 1 20 LYS N N -2.021 4.491 10.511 1.00 . A A . 20 LYS N 1 1 22 7233 1 1 20 LYS NZ N -1.062 11.309 9.361 1.00 . A A . 20 LYS NZ 1 1 22 7234 1 1 20 LYS O O -4.558 4.335 9.704 1.00 . A A . 20 LYS O 1 1 22 7235 1 1 21 PRO C C -6.620 6.221 8.101 1.00 . A A . 21 PRO C 1 1 22 7236 1 1 21 PRO CA C -6.369 6.486 9.587 1.00 . A A . 21 PRO CA 1 1 22 7237 1 1 21 PRO CB C -6.959 7.803 10.064 1.00 . A A . 21 PRO CB 1 1 22 7238 1 1 21 PRO CD C -4.508 7.962 10.091 1.00 . A A . 21 PRO CD 1 1 22 7239 1 1 21 PRO CG C -5.792 8.772 10.161 1.00 . A A . 21 PRO CG 1 1 22 7240 1 1 21 PRO HA H -6.763 5.706 10.075 1.00 . A A . 21 PRO HA 1 1 22 7241 1 1 21 PRO HB2 H -7.713 8.168 9.366 1.00 . A A . 21 PRO HB2 1 1 22 7242 1 1 21 PRO HB3 H -7.449 7.685 11.030 1.00 . A A . 21 PRO HB3 1 1 22 7243 1 1 21 PRO HD2 H -3.864 8.310 9.283 1.00 . A A . 21 PRO HD2 1 1 22 7244 1 1 21 PRO HD3 H -3.934 8.049 11.014 1.00 . A A . 21 PRO HD3 1 1 22 7245 1 1 21 PRO HG2 H -5.830 9.498 9.348 1.00 . A A . 21 PRO HG2 1 1 22 7246 1 1 21 PRO HG3 H -5.839 9.335 11.093 1.00 . A A . 21 PRO HG3 1 1 22 7247 1 1 21 PRO N N -4.946 6.588 9.865 1.00 . A A . 21 PRO N 1 1 22 7248 1 1 21 PRO O O -5.922 6.760 7.245 1.00 . A A . 21 PRO O 1 1 22 7249 1 1 22 THR C C -9.247 5.776 6.053 1.00 . A A . 22 THR C 1 1 22 7250 1 1 22 THR CA C -7.970 5.046 6.475 1.00 . A A . 22 THR CA 1 1 22 7251 1 1 22 THR CB C -8.083 3.523 6.383 1.00 . A A . 22 THR CB 1 1 22 7252 1 1 22 THR CG2 C -7.901 3.007 4.955 1.00 . A A . 22 THR CG2 1 1 22 7253 1 1 22 THR H H -8.181 4.954 8.545 1.00 . A A . 22 THR H 1 1 22 7254 1 1 22 THR HA H -7.171 5.392 5.818 1.00 . A A . 22 THR HA 1 1 22 7255 1 1 22 THR HB H -9.026 3.177 6.806 1.00 . A A . 22 THR HB 1 1 22 7256 1 1 22 THR HG1 H -7.204 2.440 7.819 1.00 . A A . 22 THR HG1 1 1 22 7257 1 1 22 THR HG21 H -8.161 3.794 4.248 1.00 . A A . 22 THR HG21 1 1 22 7258 1 1 22 THR HG22 H -6.862 2.713 4.804 1.00 . A A . 22 THR HG22 1 1 22 7259 1 1 22 THR HG23 H -8.549 2.146 4.794 1.00 . A A . 22 THR HG23 1 1 22 7260 1 1 22 THR N N -7.618 5.390 7.842 1.00 . A A . 22 THR N 1 1 22 7261 1 1 22 THR O O -9.790 5.516 4.980 1.00 . A A . 22 THR O 1 1 22 7262 1 1 22 THR OG1 O -6.929 3.048 7.073 1.00 . A A . 22 THR OG1 1 1 22 7263 1 1 23 PHE C C -10.545 8.859 6.178 1.00 . A A . 23 PHE C 1 1 22 7264 1 1 23 PHE CA C -10.892 7.446 6.650 1.00 . A A . 23 PHE CA 1 1 22 7265 1 1 23 PHE CB C -11.669 7.536 7.965 1.00 . A A . 23 PHE CB 1 1 22 7266 1 1 23 PHE CD1 C -10.407 9.359 9.128 1.00 . A A . 23 PHE CD1 1 1 22 7267 1 1 23 PHE CD2 C -10.554 7.262 10.191 1.00 . A A . 23 PHE CD2 1 1 22 7268 1 1 23 PHE CE1 C -9.644 9.858 10.217 1.00 . A A . 23 PHE CE1 1 1 22 7269 1 1 23 PHE CE2 C -9.791 7.761 11.279 1.00 . A A . 23 PHE CE2 1 1 22 7270 1 1 23 PHE CG C -10.846 8.072 9.138 1.00 . A A . 23 PHE CG 1 1 22 7271 1 1 23 PHE CZ C -9.352 9.048 11.269 1.00 . A A . 23 PHE CZ 1 1 22 7272 1 1 23 PHE H H -9.242 6.882 7.789 1.00 . A A . 23 PHE H 1 1 22 7273 1 1 23 PHE HA H -11.439 6.926 5.863 1.00 . A A . 23 PHE HA 1 1 22 7274 1 1 23 PHE HB2 H -12.537 8.178 7.818 1.00 . A A . 23 PHE HB2 1 1 22 7275 1 1 23 PHE HB3 H -12.045 6.545 8.221 1.00 . A A . 23 PHE HB3 1 1 22 7276 1 1 23 PHE HD1 H -10.642 10.008 8.284 1.00 . A A . 23 PHE HD1 1 1 22 7277 1 1 23 PHE HD2 H -10.906 6.231 10.198 1.00 . A A . 23 PHE HD2 1 1 22 7278 1 1 23 PHE HE1 H -9.292 10.889 10.209 1.00 . A A . 23 PHE HE1 1 1 22 7279 1 1 23 PHE HE2 H -9.556 7.111 12.123 1.00 . A A . 23 PHE HE2 1 1 22 7280 1 1 23 PHE HZ H -8.766 9.429 12.105 1.00 . A A . 23 PHE HZ 1 1 22 7281 1 1 23 PHE N N -9.689 6.676 6.919 1.00 . A A . 23 PHE N 1 1 22 7282 1 1 23 PHE O O -11.390 9.752 6.207 1.00 . A A . 23 PHE O 1 1 23 7283 1 1 1 GLU C C -2.764 -13.086 14.278 1.00 . A A . 1 GLU C 1 1 23 7284 1 1 1 GLU CA C -1.446 -13.017 15.053 1.00 . A A . 1 GLU CA 1 1 23 7285 1 1 1 GLU CB C -1.669 -13.302 16.539 1.00 . A A . 1 GLU CB 1 1 23 7286 1 1 1 GLU CD C -0.681 -14.309 18.630 1.00 . A A . 1 GLU CD 1 1 23 7287 1 1 1 GLU CG C -0.507 -14.108 17.123 1.00 . A A . 1 GLU CG 1 1 23 7288 1 1 1 GLU HA H -0.742 -13.746 14.651 1.00 . A A . 1 GLU HA 1 1 23 7289 1 1 1 GLU HB2 H -1.773 -12.362 17.082 1.00 . A A . 1 GLU HB2 1 1 23 7290 1 1 1 GLU HB3 H -2.601 -13.852 16.673 1.00 . A A . 1 GLU HB3 1 1 23 7291 1 1 1 GLU HG2 H -0.446 -15.077 16.628 1.00 . A A . 1 GLU HG2 1 1 23 7292 1 1 1 GLU HG3 H 0.433 -13.591 16.928 1.00 . A A . 1 GLU HG3 1 1 23 7293 1 1 1 GLU N N -0.815 -11.723 14.859 1.00 . A A . 1 GLU N 1 1 23 7294 1 1 1 GLU O O -2.946 -13.961 13.433 1.00 . A A . 1 GLU O 1 1 23 7295 1 1 1 GLU OE1 O -1.333 -13.438 19.247 1.00 . A A . 1 GLU OE1 1 1 23 7296 1 1 1 GLU OE2 O -0.159 -15.328 19.131 1.00 . A A . 1 GLU OE2 1 1 23 7297 1 1 2 ASN C C -5.242 -10.651 13.530 1.00 . A A . 2 ASN C 1 1 23 7298 1 1 2 ASN CA C -4.944 -12.096 13.938 1.00 . A A . 2 ASN CA 1 1 23 7299 1 1 2 ASN CB C -6.058 -12.560 14.878 1.00 . A A . 2 ASN CB 1 1 23 7300 1 1 2 ASN CG C -6.689 -13.861 14.379 1.00 . A A . 2 ASN CG 1 1 23 7301 1 1 2 ASN H H -3.492 -11.443 15.282 1.00 . A A . 2 ASN H 1 1 23 7302 1 1 2 ASN HA H -4.860 -12.762 13.080 1.00 . A A . 2 ASN HA 1 1 23 7303 1 1 2 ASN HB2 H -5.654 -12.709 15.880 1.00 . A A . 2 ASN HB2 1 1 23 7304 1 1 2 ASN HB3 H -6.822 -11.786 14.954 1.00 . A A . 2 ASN HB3 1 1 23 7305 1 1 2 ASN HD21 H -7.323 -14.223 16.267 1.00 . A A . 2 ASN HD21 1 1 23 7306 1 1 2 ASN HD22 H -7.749 -15.429 15.098 1.00 . A A . 2 ASN HD22 1 1 23 7307 1 1 2 ASN N N -3.648 -12.152 14.594 1.00 . A A . 2 ASN N 1 1 23 7308 1 1 2 ASN ND2 N -7.305 -14.563 15.327 1.00 . A A . 2 ASN ND2 1 1 23 7309 1 1 2 ASN O O -6.380 -10.316 13.205 1.00 . A A . 2 ASN O 1 1 23 7310 1 1 2 ASN OD1 O -6.621 -14.206 13.211 1.00 . A A . 2 ASN OD1 1 1 23 7311 1 1 3 PHE C C -3.701 -8.156 11.835 1.00 . A A . 3 PHE C 1 1 23 7312 1 1 3 PHE CA C -4.335 -8.433 13.199 1.00 . A A . 3 PHE CA 1 1 23 7313 1 1 3 PHE CB C -3.598 -7.622 14.266 1.00 . A A . 3 PHE CB 1 1 23 7314 1 1 3 PHE CD1 C -5.219 -6.025 15.312 1.00 . A A . 3 PHE CD1 1 1 23 7315 1 1 3 PHE CD2 C -4.543 -7.900 16.568 1.00 . A A . 3 PHE CD2 1 1 23 7316 1 1 3 PHE CE1 C -6.044 -5.602 16.388 1.00 . A A . 3 PHE CE1 1 1 23 7317 1 1 3 PHE CE2 C -5.367 -7.476 17.645 1.00 . A A . 3 PHE CE2 1 1 23 7318 1 1 3 PHE CG C -4.486 -7.165 15.425 1.00 . A A . 3 PHE CG 1 1 23 7319 1 1 3 PHE CZ C -6.100 -6.336 17.531 1.00 . A A . 3 PHE CZ 1 1 23 7320 1 1 3 PHE H H -3.277 -10.113 13.827 1.00 . A A . 3 PHE H 1 1 23 7321 1 1 3 PHE HA H -5.402 -8.212 13.153 1.00 . A A . 3 PHE HA 1 1 23 7322 1 1 3 PHE HB2 H -2.780 -8.221 14.663 1.00 . A A . 3 PHE HB2 1 1 23 7323 1 1 3 PHE HB3 H -3.152 -6.745 13.796 1.00 . A A . 3 PHE HB3 1 1 23 7324 1 1 3 PHE HD1 H -5.174 -5.436 14.396 1.00 . A A . 3 PHE HD1 1 1 23 7325 1 1 3 PHE HD2 H -3.956 -8.813 16.658 1.00 . A A . 3 PHE HD2 1 1 23 7326 1 1 3 PHE HE1 H -6.631 -4.688 16.297 1.00 . A A . 3 PHE HE1 1 1 23 7327 1 1 3 PHE HE2 H -5.413 -8.064 18.561 1.00 . A A . 3 PHE HE2 1 1 23 7328 1 1 3 PHE HZ H -6.733 -6.011 18.357 1.00 . A A . 3 PHE HZ 1 1 23 7329 1 1 3 PHE N N -4.200 -9.834 13.562 1.00 . A A . 3 PHE N 1 1 23 7330 1 1 3 PHE O O -3.037 -9.021 11.267 1.00 . A A . 3 PHE O 1 1 23 7331 1 1 4 ASN C C -2.142 -5.680 10.283 1.00 . A A . 4 ASN C 1 1 23 7332 1 1 4 ASN CA C -3.386 -6.542 10.061 1.00 . A A . 4 ASN CA 1 1 23 7333 1 1 4 ASN CB C -4.402 -5.713 9.271 1.00 . A A . 4 ASN CB 1 1 23 7334 1 1 4 ASN CG C -5.024 -4.626 10.150 1.00 . A A . 4 ASN CG 1 1 23 7335 1 1 4 ASN H H -4.469 -6.246 11.816 1.00 . A A . 4 ASN H 1 1 23 7336 1 1 4 ASN HA H -3.161 -7.474 9.541 1.00 . A A . 4 ASN HA 1 1 23 7337 1 1 4 ASN HB2 H -3.912 -5.255 8.411 1.00 . A A . 4 ASN HB2 1 1 23 7338 1 1 4 ASN HB3 H -5.185 -6.365 8.882 1.00 . A A . 4 ASN HB3 1 1 23 7339 1 1 4 ASN HD21 H -6.351 -5.998 10.825 1.00 . A A . 4 ASN HD21 1 1 23 7340 1 1 4 ASN HD22 H -6.527 -4.408 11.489 1.00 . A A . 4 ASN HD22 1 1 23 7341 1 1 4 ASN N N -3.928 -6.944 11.347 1.00 . A A . 4 ASN N 1 1 23 7342 1 1 4 ASN ND2 N -6.051 -5.045 10.882 1.00 . A A . 4 ASN ND2 1 1 23 7343 1 1 4 ASN O O -2.063 -4.559 9.782 1.00 . A A . 4 ASN O 1 1 23 7344 1 1 4 ASN OD1 O -4.598 -3.483 10.163 1.00 . A A . 4 ASN OD1 1 1 23 7345 1 1 5 GLY C C 0.086 -5.105 12.796 1.00 . A A . 5 GLY C 1 1 23 7346 1 1 5 GLY CA C 0.034 -5.531 11.328 1.00 . A A . 5 GLY CA 1 1 23 7347 1 1 5 GLY H H -1.275 -7.148 11.436 1.00 . A A . 5 GLY H 1 1 23 7348 1 1 5 GLY HA2 H 0.885 -6.173 11.101 1.00 . A A . 5 GLY HA2 1 1 23 7349 1 1 5 GLY HA3 H 0.117 -4.653 10.687 1.00 . A A . 5 GLY HA3 1 1 23 7350 1 1 5 GLY N N -1.202 -6.235 11.033 1.00 . A A . 5 GLY N 1 1 23 7351 1 1 5 GLY O O 1.135 -5.184 13.432 1.00 . A A . 5 GLY O 1 1 23 7352 1 1 6 GLY C C -1.886 -2.881 14.772 1.00 . A A . 6 GLY C 1 1 23 7353 1 1 6 GLY CA C -1.159 -4.223 14.673 1.00 . A A . 6 GLY CA 1 1 23 7354 1 1 6 GLY H H -1.910 -4.601 12.767 1.00 . A A . 6 GLY H 1 1 23 7355 1 1 6 GLY HA2 H -1.689 -4.973 15.259 1.00 . A A . 6 GLY HA2 1 1 23 7356 1 1 6 GLY HA3 H -0.161 -4.132 15.101 1.00 . A A . 6 GLY HA3 1 1 23 7357 1 1 6 GLY N N -1.060 -4.662 13.291 1.00 . A A . 6 GLY N 1 1 23 7358 1 1 6 GLY O O -1.359 -1.926 15.340 1.00 . A A . 6 GLY O 1 1 23 7359 1 1 7 CYS C C -5.116 -1.894 15.106 1.00 . A A . 7 CYS C 1 1 23 7360 1 1 7 CYS CA C -3.890 -1.642 14.225 1.00 . A A . 7 CYS CA 1 1 23 7361 1 1 7 CYS CB C -4.281 -1.203 12.813 1.00 . A A . 7 CYS CB 1 1 23 7362 1 1 7 CYS H H -3.507 -3.633 13.748 1.00 . A A . 7 CYS H 1 1 23 7363 1 1 7 CYS HA H -3.265 -0.856 14.649 1.00 . A A . 7 CYS HA 1 1 23 7364 1 1 7 CYS HB2 H -4.670 -2.065 12.274 1.00 . A A . 7 CYS HB2 1 1 23 7365 1 1 7 CYS HB3 H -5.093 -0.479 12.885 1.00 . A A . 7 CYS HB3 1 1 23 7366 1 1 7 CYS N N -3.084 -2.851 14.209 1.00 . A A . 7 CYS N 1 1 23 7367 1 1 7 CYS O O -5.282 -2.984 15.649 1.00 . A A . 7 CYS O 1 1 23 7368 1 1 7 CYS SG S -2.922 -0.463 11.836 1.00 . A A . 7 CYS SG 1 1 23 7369 1 1 8 LEU C C -8.250 -1.646 15.205 1.00 . A A . 8 LEU C 1 1 23 7370 1 1 8 LEU CA C -7.152 -0.962 16.022 1.00 . A A . 8 LEU CA 1 1 23 7371 1 1 8 LEU CB C -7.550 0.414 16.556 1.00 . A A . 8 LEU CB 1 1 23 7372 1 1 8 LEU CD1 C -8.928 -0.462 18.479 1.00 . A A . 8 LEU CD1 1 1 23 7373 1 1 8 LEU CD2 C -9.224 1.928 17.682 1.00 . A A . 8 LEU CD2 1 1 23 7374 1 1 8 LEU CG C -8.896 0.489 17.281 1.00 . A A . 8 LEU CG 1 1 23 7375 1 1 8 LEU H H -5.805 0.018 14.772 1.00 . A A . 8 LEU H 1 1 23 7376 1 1 8 LEU HA H -6.922 -1.589 16.882 1.00 . A A . 8 LEU HA 1 1 23 7377 1 1 8 LEU HB2 H -6.773 0.754 17.241 1.00 . A A . 8 LEU HB2 1 1 23 7378 1 1 8 LEU HB3 H -7.570 1.115 15.722 1.00 . A A . 8 LEU HB3 1 1 23 7379 1 1 8 LEU HD11 H -8.039 -1.093 18.466 1.00 . A A . 8 LEU HD11 1 1 23 7380 1 1 8 LEU HD12 H -8.949 0.117 19.402 1.00 . A A . 8 LEU HD12 1 1 23 7381 1 1 8 LEU HD13 H -9.819 -1.087 18.422 1.00 . A A . 8 LEU HD13 1 1 23 7382 1 1 8 LEU HD21 H -8.406 2.584 17.385 1.00 . A A . 8 LEU HD21 1 1 23 7383 1 1 8 LEU HD22 H -10.142 2.244 17.186 1.00 . A A . 8 LEU HD22 1 1 23 7384 1 1 8 LEU HD23 H -9.358 1.982 18.762 1.00 . A A . 8 LEU HD23 1 1 23 7385 1 1 8 LEU HG H -9.674 0.162 16.590 1.00 . A A . 8 LEU HG 1 1 23 7386 1 1 8 LEU N N -5.946 -0.866 15.218 1.00 . A A . 8 LEU N 1 1 23 7387 1 1 8 LEU O O -8.813 -2.652 15.633 1.00 . A A . 8 LEU O 1 1 23 7388 1 1 9 ALA C C -9.967 -0.538 12.157 1.00 . A A . 9 ALA C 1 1 23 7389 1 1 9 ALA CA C -9.545 -1.612 13.162 1.00 . A A . 9 ALA CA 1 1 23 7390 1 1 9 ALA CB C -10.721 -2.123 13.997 1.00 . A A . 9 ALA CB 1 1 23 7391 1 1 9 ALA H H -8.062 -0.252 13.701 1.00 . A A . 9 ALA H 1 1 23 7392 1 1 9 ALA HA H -9.107 -2.451 12.621 1.00 . A A . 9 ALA HA 1 1 23 7393 1 1 9 ALA HB1 H -10.689 -1.667 14.986 1.00 . A A . 9 ALA HB1 1 1 23 7394 1 1 9 ALA HB2 H -11.658 -1.859 13.506 1.00 . A A . 9 ALA HB2 1 1 23 7395 1 1 9 ALA HB3 H -10.654 -3.207 14.093 1.00 . A A . 9 ALA HB3 1 1 23 7396 1 1 9 ALA N N -8.525 -1.071 14.042 1.00 . A A . 9 ALA N 1 1 23 7397 1 1 9 ALA O O -10.818 0.298 12.457 1.00 . A A . 9 ALA O 1 1 23 7398 1 1 10 GLY C C -8.397 1.128 9.514 1.00 . A A . 10 GLY C 1 1 23 7399 1 1 10 GLY CA C -9.653 0.362 9.934 1.00 . A A . 10 GLY CA 1 1 23 7400 1 1 10 GLY H H -8.661 -1.278 10.748 1.00 . A A . 10 GLY H 1 1 23 7401 1 1 10 GLY HA2 H -10.070 -0.159 9.072 1.00 . A A . 10 GLY HA2 1 1 23 7402 1 1 10 GLY HA3 H -10.412 1.063 10.282 1.00 . A A . 10 GLY HA3 1 1 23 7403 1 1 10 GLY N N -9.353 -0.596 10.985 1.00 . A A . 10 GLY N 1 1 23 7404 1 1 10 GLY O O -8.207 1.417 8.333 1.00 . A A . 10 GLY O 1 1 23 7405 1 1 11 TYR C C -5.440 1.399 9.281 1.00 . A A . 11 TYR C 1 1 23 7406 1 1 11 TYR CA C -6.341 2.164 10.253 1.00 . A A . 11 TYR CA 1 1 23 7407 1 1 11 TYR CB C -5.633 2.276 11.605 1.00 . A A . 11 TYR CB 1 1 23 7408 1 1 11 TYR CD1 C -6.315 4.527 12.513 1.00 . A A . 11 TYR CD1 1 1 23 7409 1 1 11 TYR CD2 C -7.083 2.567 13.647 1.00 . A A . 11 TYR CD2 1 1 23 7410 1 1 11 TYR CE1 C -7.005 5.351 13.470 1.00 . A A . 11 TYR CE1 1 1 23 7411 1 1 11 TYR CE2 C -7.775 3.392 14.604 1.00 . A A . 11 TYR CE2 1 1 23 7412 1 1 11 TYR CG C -6.367 3.152 12.622 1.00 . A A . 11 TYR CG 1 1 23 7413 1 1 11 TYR CZ C -7.701 4.744 14.468 1.00 . A A . 11 TYR CZ 1 1 23 7414 1 1 11 TYR H H -7.735 1.198 11.462 1.00 . A A . 11 TYR H 1 1 23 7415 1 1 11 TYR HA H -6.603 3.127 9.813 1.00 . A A . 11 TYR HA 1 1 23 7416 1 1 11 TYR HB2 H -5.512 1.277 12.023 1.00 . A A . 11 TYR HB2 1 1 23 7417 1 1 11 TYR HB3 H -4.633 2.679 11.448 1.00 . A A . 11 TYR HB3 1 1 23 7418 1 1 11 TYR HD1 H -5.749 4.988 11.703 1.00 . A A . 11 TYR HD1 1 1 23 7419 1 1 11 TYR HD2 H -7.125 1.482 13.732 1.00 . A A . 11 TYR HD2 1 1 23 7420 1 1 11 TYR HE1 H -6.973 6.438 13.396 1.00 . A A . 11 TYR HE1 1 1 23 7421 1 1 11 TYR HE2 H -8.343 2.944 15.419 1.00 . A A . 11 TYR HE2 1 1 23 7422 1 1 11 TYR HH H -8.756 4.952 16.088 1.00 . A A . 11 TYR HH 1 1 23 7423 1 1 11 TYR N N -7.573 1.437 10.504 1.00 . A A . 11 TYR N 1 1 23 7424 1 1 11 TYR O O -5.531 0.176 9.177 1.00 . A A . 11 TYR O 1 1 23 7425 1 1 11 TYR OH O -8.354 5.522 15.372 1.00 . A A . 11 TYR OH 1 1 23 7426 1 1 12 MET C C -2.226 1.687 8.107 1.00 . A A . 12 MET C 1 1 23 7427 1 1 12 MET CA C -3.676 1.558 7.634 1.00 . A A . 12 MET CA 1 1 23 7428 1 1 12 MET CB C -3.835 2.252 6.281 1.00 . A A . 12 MET CB 1 1 23 7429 1 1 12 MET CE C -3.568 6.250 5.352 1.00 . A A . 12 MET CE 1 1 23 7430 1 1 12 MET CG C -3.919 3.770 6.450 1.00 . A A . 12 MET CG 1 1 23 7431 1 1 12 MET H H -4.524 3.144 8.684 1.00 . A A . 12 MET H 1 1 23 7432 1 1 12 MET HA H -3.954 0.505 7.575 1.00 . A A . 12 MET HA 1 1 23 7433 1 1 12 MET HB2 H -2.992 2.001 5.637 1.00 . A A . 12 MET HB2 1 1 23 7434 1 1 12 MET HB3 H -4.735 1.888 5.784 1.00 . A A . 12 MET HB3 1 1 23 7435 1 1 12 MET HE1 H -3.824 6.372 6.405 1.00 . A A . 12 MET HE1 1 1 23 7436 1 1 12 MET HE2 H -2.512 6.481 5.206 1.00 . A A . 12 MET HE2 1 1 23 7437 1 1 12 MET HE3 H -4.174 6.928 4.750 1.00 . A A . 12 MET HE3 1 1 23 7438 1 1 12 MET HG2 H -4.836 4.036 6.977 1.00 . A A . 12 MET HG2 1 1 23 7439 1 1 12 MET HG3 H -3.087 4.124 7.059 1.00 . A A . 12 MET HG3 1 1 23 7440 1 1 12 MET N N -4.592 2.150 8.594 1.00 . A A . 12 MET N 1 1 23 7441 1 1 12 MET O O -1.924 2.502 8.977 1.00 . A A . 12 MET O 1 1 23 7442 1 1 12 MET SD S -3.884 4.567 4.853 1.00 . A A . 12 MET SD 1 1 23 7443 1 1 13 ARG C C 0.846 1.627 6.799 1.00 . A A . 13 ARG C 1 1 23 7444 1 1 13 ARG CA C 0.041 0.880 7.864 1.00 . A A . 13 ARG CA 1 1 23 7445 1 1 13 ARG CB C 0.586 -0.543 8.002 1.00 . A A . 13 ARG CB 1 1 23 7446 1 1 13 ARG CD C 0.806 -1.186 10.430 1.00 . A A . 13 ARG CD 1 1 23 7447 1 1 13 ARG CG C -0.070 -1.269 9.178 1.00 . A A . 13 ARG CG 1 1 23 7448 1 1 13 ARG CZ C 2.229 -3.231 10.427 1.00 . A A . 13 ARG CZ 1 1 23 7449 1 1 13 ARG H H -1.624 0.209 6.807 1.00 . A A . 13 ARG H 1 1 23 7450 1 1 13 ARG HA H 0.086 1.397 8.823 1.00 . A A . 13 ARG HA 1 1 23 7451 1 1 13 ARG HB2 H 0.404 -1.096 7.081 1.00 . A A . 13 ARG HB2 1 1 23 7452 1 1 13 ARG HB3 H 1.666 -0.510 8.146 1.00 . A A . 13 ARG HB3 1 1 23 7453 1 1 13 ARG HD2 H 1.706 -0.611 10.217 1.00 . A A . 13 ARG HD2 1 1 23 7454 1 1 13 ARG HD3 H 0.272 -0.661 11.223 1.00 . A A . 13 ARG HD3 1 1 23 7455 1 1 13 ARG HE H 0.593 -2.983 11.573 1.00 . A A . 13 ARG HE 1 1 23 7456 1 1 13 ARG HG2 H -1.046 -0.830 9.383 1.00 . A A . 13 ARG HG2 1 1 23 7457 1 1 13 ARG HG3 H -0.238 -2.314 8.917 1.00 . A A . 13 ARG HG3 1 1 23 7458 1 1 13 ARG HH11 H 2.842 -1.769 9.154 1.00 . A A . 13 ARG HH11 1 1 23 7459 1 1 13 ARG HH12 H 3.822 -3.198 9.163 1.00 . A A . 13 ARG HH12 1 1 23 7460 1 1 13 ARG HH21 H 1.885 -4.868 11.585 1.00 . A A . 13 ARG HH21 1 1 23 7461 1 1 13 ARG HH22 H 3.274 -4.972 10.555 1.00 . A A . 13 ARG HH22 1 1 23 7462 1 1 13 ARG N N -1.369 0.869 7.514 1.00 . A A . 13 ARG N 1 1 23 7463 1 1 13 ARG NE N 1.171 -2.547 10.883 1.00 . A A . 13 ARG NE 1 1 23 7464 1 1 13 ARG NH1 N 3.032 -2.687 9.503 1.00 . A A . 13 ARG NH1 1 1 23 7465 1 1 13 ARG NH2 N 2.484 -4.461 10.895 1.00 . A A . 13 ARG NH2 1 1 23 7466 1 1 13 ARG O O 1.089 1.097 5.715 1.00 . A A . 13 ARG O 1 1 23 7467 1 1 14 THR C C 3.364 3.018 5.940 1.00 . A A . 14 THR C 1 1 23 7468 1 1 14 THR CA C 2.010 3.669 6.230 1.00 . A A . 14 THR CA 1 1 23 7469 1 1 14 THR CB C 2.126 5.067 6.839 1.00 . A A . 14 THR CB 1 1 23 7470 1 1 14 THR CG2 C 0.817 5.542 7.472 1.00 . A A . 14 THR CG2 1 1 23 7471 1 1 14 THR H H 1.036 3.268 8.027 1.00 . A A . 14 THR H 1 1 23 7472 1 1 14 THR HA H 1.474 3.728 5.283 1.00 . A A . 14 THR HA 1 1 23 7473 1 1 14 THR HB H 2.484 5.785 6.101 1.00 . A A . 14 THR HB 1 1 23 7474 1 1 14 THR HG1 H 2.582 4.289 8.626 1.00 . A A . 14 THR HG1 1 1 23 7475 1 1 14 THR HG21 H -0.024 5.069 6.965 1.00 . A A . 14 THR HG21 1 1 23 7476 1 1 14 THR HG22 H 0.804 5.269 8.528 1.00 . A A . 14 THR HG22 1 1 23 7477 1 1 14 THR HG23 H 0.737 6.625 7.375 1.00 . A A . 14 THR HG23 1 1 23 7478 1 1 14 THR N N 1.238 2.844 7.144 1.00 . A A . 14 THR N 1 1 23 7479 1 1 14 THR O O 3.559 1.834 6.209 1.00 . A A . 14 THR O 1 1 23 7480 1 1 14 THR OG1 O 3.004 4.891 7.948 1.00 . A A . 14 THR OG1 1 1 23 7481 1 1 15 ALA C C 6.516 3.529 6.268 1.00 . A A . 15 ALA C 1 1 23 7482 1 1 15 ALA CA C 5.595 3.338 5.061 1.00 . A A . 15 ALA CA 1 1 23 7483 1 1 15 ALA CB C 6.107 4.065 3.816 1.00 . A A . 15 ALA CB 1 1 23 7484 1 1 15 ALA H H 4.099 4.783 5.175 1.00 . A A . 15 ALA H 1 1 23 7485 1 1 15 ALA HA H 5.516 2.274 4.840 1.00 . A A . 15 ALA HA 1 1 23 7486 1 1 15 ALA HB1 H 5.261 4.456 3.250 1.00 . A A . 15 ALA HB1 1 1 23 7487 1 1 15 ALA HB2 H 6.756 4.888 4.116 1.00 . A A . 15 ALA HB2 1 1 23 7488 1 1 15 ALA HB3 H 6.669 3.367 3.194 1.00 . A A . 15 ALA HB3 1 1 23 7489 1 1 15 ALA N N 4.265 3.821 5.392 1.00 . A A . 15 ALA N 1 1 23 7490 1 1 15 ALA O O 7.731 3.364 6.159 1.00 . A A . 15 ALA O 1 1 23 7491 1 1 16 ASP C C 6.266 3.021 9.641 1.00 . A A . 16 ASP C 1 1 23 7492 1 1 16 ASP CA C 6.654 4.090 8.617 1.00 . A A . 16 ASP CA 1 1 23 7493 1 1 16 ASP CB C 6.341 5.460 9.222 1.00 . A A . 16 ASP CB 1 1 23 7494 1 1 16 ASP CG C 7.296 6.582 8.810 1.00 . A A . 16 ASP CG 1 1 23 7495 1 1 16 ASP H H 4.916 4.008 7.471 1.00 . A A . 16 ASP H 1 1 23 7496 1 1 16 ASP HA H 7.703 4.027 8.326 1.00 . A A . 16 ASP HA 1 1 23 7497 1 1 16 ASP HB2 H 5.328 5.743 8.937 1.00 . A A . 16 ASP HB2 1 1 23 7498 1 1 16 ASP HB3 H 6.354 5.373 10.308 1.00 . A A . 16 ASP HB3 1 1 23 7499 1 1 16 ASP N N 5.904 3.875 7.391 1.00 . A A . 16 ASP N 1 1 23 7500 1 1 16 ASP O O 7.003 2.774 10.594 1.00 . A A . 16 ASP O 1 1 23 7501 1 1 16 ASP OD1 O 7.068 7.150 7.720 1.00 . A A . 16 ASP OD1 1 1 23 7502 1 1 16 ASP OD2 O 8.233 6.847 9.594 1.00 . A A . 16 ASP OD2 1 1 23 7503 1 1 17 GLY C C 3.616 1.955 11.307 1.00 . A A . 17 GLY C 1 1 23 7504 1 1 17 GLY CA C 4.616 1.381 10.299 1.00 . A A . 17 GLY CA 1 1 23 7505 1 1 17 GLY H H 4.517 2.625 8.631 1.00 . A A . 17 GLY H 1 1 23 7506 1 1 17 GLY HA2 H 4.138 0.594 9.717 1.00 . A A . 17 GLY HA2 1 1 23 7507 1 1 17 GLY HA3 H 5.450 0.923 10.830 1.00 . A A . 17 GLY HA3 1 1 23 7508 1 1 17 GLY N N 5.110 2.417 9.409 1.00 . A A . 17 GLY N 1 1 23 7509 1 1 17 GLY O O 3.115 1.234 12.169 1.00 . A A . 17 GLY O 1 1 23 7510 1 1 18 ARG C C 0.994 3.765 11.540 1.00 . A A . 18 ARG C 1 1 23 7511 1 1 18 ARG CA C 2.427 3.925 12.051 1.00 . A A . 18 ARG CA 1 1 23 7512 1 1 18 ARG CB C 2.758 5.415 12.162 1.00 . A A . 18 ARG CB 1 1 23 7513 1 1 18 ARG CD C 4.463 7.067 13.013 1.00 . A A . 18 ARG CD 1 1 23 7514 1 1 18 ARG CG C 4.218 5.623 12.571 1.00 . A A . 18 ARG CG 1 1 23 7515 1 1 18 ARG CZ C 5.579 9.080 12.059 1.00 . A A . 18 ARG CZ 1 1 23 7516 1 1 18 ARG H H 3.769 3.825 10.462 1.00 . A A . 18 ARG H 1 1 23 7517 1 1 18 ARG HA H 2.556 3.437 13.017 1.00 . A A . 18 ARG HA 1 1 23 7518 1 1 18 ARG HB2 H 2.572 5.904 11.206 1.00 . A A . 18 ARG HB2 1 1 23 7519 1 1 18 ARG HB3 H 2.101 5.884 12.894 1.00 . A A . 18 ARG HB3 1 1 23 7520 1 1 18 ARG HD2 H 3.514 7.551 13.245 1.00 . A A . 18 ARG HD2 1 1 23 7521 1 1 18 ARG HD3 H 5.059 7.081 13.925 1.00 . A A . 18 ARG HD3 1 1 23 7522 1 1 18 ARG HE H 5.332 7.340 11.077 1.00 . A A . 18 ARG HE 1 1 23 7523 1 1 18 ARG HG2 H 4.472 4.942 13.383 1.00 . A A . 18 ARG HG2 1 1 23 7524 1 1 18 ARG HG3 H 4.872 5.379 11.734 1.00 . A A . 18 ARG HG3 1 1 23 7525 1 1 18 ARG HH11 H 4.905 9.307 13.964 1.00 . A A . 18 ARG HH11 1 1 23 7526 1 1 18 ARG HH12 H 5.683 10.698 13.287 1.00 . A A . 18 ARG HH12 1 1 23 7527 1 1 18 ARG HH21 H 6.359 9.176 10.183 1.00 . A A . 18 ARG HH21 1 1 23 7528 1 1 18 ARG HH22 H 6.516 10.623 11.122 1.00 . A A . 18 ARG HH22 1 1 23 7529 1 1 18 ARG N N 3.357 3.246 11.165 1.00 . A A . 18 ARG N 1 1 23 7530 1 1 18 ARG NE N 5.161 7.812 11.942 1.00 . A A . 18 ARG NE 1 1 23 7531 1 1 18 ARG NH1 N 5.371 9.752 13.200 1.00 . A A . 18 ARG NH1 1 1 23 7532 1 1 18 ARG NH2 N 6.204 9.677 11.035 1.00 . A A . 18 ARG NH2 1 1 23 7533 1 1 18 ARG O O 0.641 4.304 10.492 1.00 . A A . 18 ARG O 1 1 23 7534 1 1 19 CYS C C -1.864 4.139 11.741 1.00 . A A . 19 CYS C 1 1 23 7535 1 1 19 CYS CA C -1.181 2.785 11.942 1.00 . A A . 19 CYS CA 1 1 23 7536 1 1 19 CYS CB C -1.900 1.931 12.988 1.00 . A A . 19 CYS CB 1 1 23 7537 1 1 19 CYS H H 0.501 2.587 13.155 1.00 . A A . 19 CYS H 1 1 23 7538 1 1 19 CYS HA H -1.168 2.216 11.012 1.00 . A A . 19 CYS HA 1 1 23 7539 1 1 19 CYS HB2 H -1.755 2.384 13.969 1.00 . A A . 19 CYS HB2 1 1 23 7540 1 1 19 CYS HB3 H -2.971 1.955 12.781 1.00 . A A . 19 CYS HB3 1 1 23 7541 1 1 19 CYS N N 0.207 3.022 12.305 1.00 . A A . 19 CYS N 1 1 23 7542 1 1 19 CYS O O -2.206 4.815 12.709 1.00 . A A . 19 CYS O 1 1 23 7543 1 1 19 CYS SG S -1.356 0.186 13.062 1.00 . A A . 19 CYS SG 1 1 23 7544 1 1 20 LYS C C -4.166 5.512 9.866 1.00 . A A . 20 LYS C 1 1 23 7545 1 1 20 LYS CA C -2.680 5.754 10.136 1.00 . A A . 20 LYS CA 1 1 23 7546 1 1 20 LYS CB C -1.946 6.430 8.976 1.00 . A A . 20 LYS CB 1 1 23 7547 1 1 20 LYS CD C -0.840 8.632 8.441 1.00 . A A . 20 LYS CD 1 1 23 7548 1 1 20 LYS CE C 0.388 9.492 8.746 1.00 . A A . 20 LYS CE 1 1 23 7549 1 1 20 LYS CG C -1.009 7.527 9.485 1.00 . A A . 20 LYS CG 1 1 23 7550 1 1 20 LYS H H -1.760 3.938 9.695 1.00 . A A . 20 LYS H 1 1 23 7551 1 1 20 LYS HA H -2.588 6.411 11.002 1.00 . A A . 20 LYS HA 1 1 23 7552 1 1 20 LYS HB2 H -1.374 5.687 8.420 1.00 . A A . 20 LYS HB2 1 1 23 7553 1 1 20 LYS HB3 H -2.670 6.858 8.283 1.00 . A A . 20 LYS HB3 1 1 23 7554 1 1 20 LYS HD2 H -0.741 8.189 7.450 1.00 . A A . 20 LYS HD2 1 1 23 7555 1 1 20 LYS HD3 H -1.732 9.259 8.422 1.00 . A A . 20 LYS HD3 1 1 23 7556 1 1 20 LYS HE2 H 0.357 9.825 9.783 1.00 . A A . 20 LYS HE2 1 1 23 7557 1 1 20 LYS HE3 H 1.294 8.898 8.628 1.00 . A A . 20 LYS HE3 1 1 23 7558 1 1 20 LYS HG2 H -1.406 7.951 10.407 1.00 . A A . 20 LYS HG2 1 1 23 7559 1 1 20 LYS HG3 H -0.036 7.097 9.725 1.00 . A A . 20 LYS HG3 1 1 23 7560 1 1 20 LYS HZ1 H -0.436 10.751 7.362 1.00 . A A . 20 LYS HZ1 1 1 23 7561 1 1 20 LYS HZ2 H 0.603 11.492 8.381 1.00 . A A . 20 LYS HZ2 1 1 23 7562 1 1 20 LYS HZ3 H 1.174 10.544 7.180 1.00 . A A . 20 LYS HZ3 1 1 23 7563 1 1 20 LYS N N -2.042 4.494 10.477 1.00 . A A . 20 LYS N 1 1 23 7564 1 1 20 LYS NZ N 0.436 10.665 7.844 1.00 . A A . 20 LYS NZ 1 1 23 7565 1 1 20 LYS O O -4.600 4.368 9.741 1.00 . A A . 20 LYS O 1 1 23 7566 1 1 21 PRO C C -6.631 6.219 8.060 1.00 . A A . 21 PRO C 1 1 23 7567 1 1 21 PRO CA C -6.353 6.558 9.526 1.00 . A A . 21 PRO CA 1 1 23 7568 1 1 21 PRO CB C -6.901 7.917 9.935 1.00 . A A . 21 PRO CB 1 1 23 7569 1 1 21 PRO CD C -4.445 8.009 9.925 1.00 . A A . 21 PRO CD 1 1 23 7570 1 1 21 PRO CG C -5.707 8.856 9.965 1.00 . A A . 21 PRO CG 1 1 23 7571 1 1 21 PRO HA H -6.761 5.818 10.060 1.00 . A A . 21 PRO HA 1 1 23 7572 1 1 21 PRO HB2 H -7.654 8.264 9.228 1.00 . A A . 21 PRO HB2 1 1 23 7573 1 1 21 PRO HB3 H -7.382 7.866 10.913 1.00 . A A . 21 PRO HB3 1 1 23 7574 1 1 21 PRO HD2 H -3.803 8.293 9.093 1.00 . A A . 21 PRO HD2 1 1 23 7575 1 1 21 PRO HD3 H -3.859 8.130 10.836 1.00 . A A . 21 PRO HD3 1 1 23 7576 1 1 21 PRO HG2 H -5.736 9.537 9.114 1.00 . A A . 21 PRO HG2 1 1 23 7577 1 1 21 PRO HG3 H -5.726 9.470 10.865 1.00 . A A . 21 PRO HG3 1 1 23 7578 1 1 21 PRO N N -4.925 6.637 9.782 1.00 . A A . 21 PRO N 1 1 23 7579 1 1 21 PRO O O -5.904 6.658 7.170 1.00 . A A . 21 PRO O 1 1 23 7580 1 1 22 THR C C -9.426 5.633 6.145 1.00 . A A . 22 THR C 1 1 23 7581 1 1 22 THR CA C -8.066 5.038 6.514 1.00 . A A . 22 THR CA 1 1 23 7582 1 1 22 THR CB C -8.035 3.510 6.452 1.00 . A A . 22 THR CB 1 1 23 7583 1 1 22 THR CG2 C -7.823 2.985 5.030 1.00 . A A . 22 THR CG2 1 1 23 7584 1 1 22 THR H H -8.269 5.090 8.585 1.00 . A A . 22 THR H 1 1 23 7585 1 1 22 THR HA H -7.339 5.446 5.812 1.00 . A A . 22 THR HA 1 1 23 7586 1 1 22 THR HB H -8.935 3.084 6.894 1.00 . A A . 22 THR HB 1 1 23 7587 1 1 22 THR HG1 H -6.824 2.180 7.331 1.00 . A A . 22 THR HG1 1 1 23 7588 1 1 22 THR HG21 H -7.782 3.825 4.335 1.00 . A A . 22 THR HG21 1 1 23 7589 1 1 22 THR HG22 H -6.886 2.429 4.983 1.00 . A A . 22 THR HG22 1 1 23 7590 1 1 22 THR HG23 H -8.649 2.329 4.759 1.00 . A A . 22 THR HG23 1 1 23 7591 1 1 22 THR N N -7.684 5.442 7.856 1.00 . A A . 22 THR N 1 1 23 7592 1 1 22 THR O O -9.991 5.304 5.102 1.00 . A A . 22 THR O 1 1 23 7593 1 1 22 THR OG1 O -6.832 3.160 7.133 1.00 . A A . 22 THR OG1 1 1 23 7594 1 1 23 PHE C C -11.015 8.552 6.233 1.00 . A A . 23 PHE C 1 1 23 7595 1 1 23 PHE CA C -11.198 7.143 6.801 1.00 . A A . 23 PHE CA 1 1 23 7596 1 1 23 PHE CB C -11.889 7.240 8.162 1.00 . A A . 23 PHE CB 1 1 23 7597 1 1 23 PHE CD1 C -10.834 9.257 9.207 1.00 . A A . 23 PHE CD1 1 1 23 7598 1 1 23 PHE CD2 C -10.494 7.168 10.241 1.00 . A A . 23 PHE CD2 1 1 23 7599 1 1 23 PHE CE1 C -10.046 9.881 10.211 1.00 . A A . 23 PHE CE1 1 1 23 7600 1 1 23 PHE CE2 C -9.707 7.792 11.244 1.00 . A A . 23 PHE CE2 1 1 23 7601 1 1 23 PHE CG C -11.041 7.914 9.243 1.00 . A A . 23 PHE CG 1 1 23 7602 1 1 23 PHE CZ C -9.500 9.136 11.208 1.00 . A A . 23 PHE CZ 1 1 23 7603 1 1 23 PHE H H -9.450 6.761 7.866 1.00 . A A . 23 PHE H 1 1 23 7604 1 1 23 PHE HA H -11.747 6.533 6.084 1.00 . A A . 23 PHE HA 1 1 23 7605 1 1 23 PHE HB2 H -12.820 7.796 8.047 1.00 . A A . 23 PHE HB2 1 1 23 7606 1 1 23 PHE HB3 H -12.156 6.238 8.496 1.00 . A A . 23 PHE HB3 1 1 23 7607 1 1 23 PHE HD1 H -11.272 9.855 8.407 1.00 . A A . 23 PHE HD1 1 1 23 7608 1 1 23 PHE HD2 H -10.661 6.091 10.270 1.00 . A A . 23 PHE HD2 1 1 23 7609 1 1 23 PHE HE1 H -9.880 10.958 10.181 1.00 . A A . 23 PHE HE1 1 1 23 7610 1 1 23 PHE HE2 H -9.269 7.195 12.044 1.00 . A A . 23 PHE HE2 1 1 23 7611 1 1 23 PHE HZ H -8.896 9.616 11.978 1.00 . A A . 23 PHE HZ 1 1 23 7612 1 1 23 PHE N N -9.915 6.499 7.021 1.00 . A A . 23 PHE N 1 1 23 7613 1 1 23 PHE O O -11.804 8.996 5.401 1.00 . A A . 23 PHE O 1 1 24 7614 1 1 1 GLU C C -6.196 -8.607 3.998 1.00 . A A . 1 GLU C 1 1 24 7615 1 1 1 GLU CA C -6.532 -9.852 3.176 1.00 . A A . 1 GLU CA 1 1 24 7616 1 1 1 GLU CB C -7.547 -10.734 3.907 1.00 . A A . 1 GLU CB 1 1 24 7617 1 1 1 GLU CD C -9.904 -10.962 3.037 1.00 . A A . 1 GLU CD 1 1 24 7618 1 1 1 GLU CG C -8.461 -11.456 2.914 1.00 . A A . 1 GLU CG 1 1 24 7619 1 1 1 GLU HA H -6.944 -9.558 2.211 1.00 . A A . 1 GLU HA 1 1 24 7620 1 1 1 GLU HB2 H -7.023 -11.464 4.523 1.00 . A A . 1 GLU HB2 1 1 24 7621 1 1 1 GLU HB3 H -8.148 -10.122 4.580 1.00 . A A . 1 GLU HB3 1 1 24 7622 1 1 1 GLU HG2 H -8.102 -11.293 1.898 1.00 . A A . 1 GLU HG2 1 1 24 7623 1 1 1 GLU HG3 H -8.424 -12.530 3.096 1.00 . A A . 1 GLU HG3 1 1 24 7624 1 1 1 GLU N N -5.322 -10.596 2.870 1.00 . A A . 1 GLU N 1 1 24 7625 1 1 1 GLU O O -6.710 -8.429 5.102 1.00 . A A . 1 GLU O 1 1 24 7626 1 1 1 GLU OE1 O -10.069 -9.781 3.412 1.00 . A A . 1 GLU OE1 1 1 24 7627 1 1 1 GLU OE2 O -10.809 -11.776 2.753 1.00 . A A . 1 GLU OE2 1 1 24 7628 1 1 2 ASN C C -4.331 -6.896 5.465 1.00 . A A . 2 ASN C 1 1 24 7629 1 1 2 ASN CA C -4.922 -6.552 4.096 1.00 . A A . 2 ASN CA 1 1 24 7630 1 1 2 ASN CB C -6.114 -5.618 4.319 1.00 . A A . 2 ASN CB 1 1 24 7631 1 1 2 ASN CG C -6.485 -4.886 3.028 1.00 . A A . 2 ASN CG 1 1 24 7632 1 1 2 ASN H H -4.921 -7.927 2.532 1.00 . A A . 2 ASN H 1 1 24 7633 1 1 2 ASN HA H -4.193 -6.094 3.430 1.00 . A A . 2 ASN HA 1 1 24 7634 1 1 2 ASN HB2 H -6.970 -6.193 4.674 1.00 . A A . 2 ASN HB2 1 1 24 7635 1 1 2 ASN HB3 H -5.873 -4.894 5.096 1.00 . A A . 2 ASN HB3 1 1 24 7636 1 1 2 ASN HD21 H -6.356 -3.137 4.039 1.00 . A A . 2 ASN HD21 1 1 24 7637 1 1 2 ASN HD22 H -6.780 -2.995 2.365 1.00 . A A . 2 ASN HD22 1 1 24 7638 1 1 2 ASN N N -5.335 -7.776 3.430 1.00 . A A . 2 ASN N 1 1 24 7639 1 1 2 ASN ND2 N -6.545 -3.563 3.155 1.00 . A A . 2 ASN ND2 1 1 24 7640 1 1 2 ASN O O -4.424 -8.037 5.917 1.00 . A A . 2 ASN O 1 1 24 7641 1 1 2 ASN OD1 O -6.702 -5.482 1.985 1.00 . A A . 2 ASN OD1 1 1 24 7642 1 1 3 PHE C C -4.117 -5.731 8.510 1.00 . A A . 3 PHE C 1 1 24 7643 1 1 3 PHE CA C -3.128 -6.071 7.394 1.00 . A A . 3 PHE CA 1 1 24 7644 1 1 3 PHE CB C -1.938 -5.112 7.473 1.00 . A A . 3 PHE CB 1 1 24 7645 1 1 3 PHE CD1 C -0.248 -6.347 8.848 1.00 . A A . 3 PHE CD1 1 1 24 7646 1 1 3 PHE CD2 C 0.276 -5.891 6.597 1.00 . A A . 3 PHE CD2 1 1 24 7647 1 1 3 PHE CE1 C 1.006 -6.993 9.009 1.00 . A A . 3 PHE CE1 1 1 24 7648 1 1 3 PHE CE2 C 1.529 -6.537 6.758 1.00 . A A . 3 PHE CE2 1 1 24 7649 1 1 3 PHE CG C -0.587 -5.809 7.645 1.00 . A A . 3 PHE CG 1 1 24 7650 1 1 3 PHE CZ C 1.868 -7.074 7.960 1.00 . A A . 3 PHE CZ 1 1 24 7651 1 1 3 PHE H H -3.663 -4.965 5.712 1.00 . A A . 3 PHE H 1 1 24 7652 1 1 3 PHE HA H -2.839 -7.120 7.474 1.00 . A A . 3 PHE HA 1 1 24 7653 1 1 3 PHE HB2 H -1.911 -4.509 6.565 1.00 . A A . 3 PHE HB2 1 1 24 7654 1 1 3 PHE HB3 H -2.091 -4.427 8.306 1.00 . A A . 3 PHE HB3 1 1 24 7655 1 1 3 PHE HD1 H -0.940 -6.281 9.688 1.00 . A A . 3 PHE HD1 1 1 24 7656 1 1 3 PHE HD2 H 0.004 -5.459 5.633 1.00 . A A . 3 PHE HD2 1 1 24 7657 1 1 3 PHE HE1 H 1.277 -7.424 9.972 1.00 . A A . 3 PHE HE1 1 1 24 7658 1 1 3 PHE HE2 H 2.221 -6.603 5.918 1.00 . A A . 3 PHE HE2 1 1 24 7659 1 1 3 PHE HZ H 2.831 -7.572 8.083 1.00 . A A . 3 PHE HZ 1 1 24 7660 1 1 3 PHE N N -3.734 -5.889 6.086 1.00 . A A . 3 PHE N 1 1 24 7661 1 1 3 PHE O O -5.133 -5.083 8.267 1.00 . A A . 3 PHE O 1 1 24 7662 1 1 4 ASN C C -4.094 -6.717 12.064 1.00 . A A . 4 ASN C 1 1 24 7663 1 1 4 ASN CA C -4.631 -5.934 10.864 1.00 . A A . 4 ASN CA 1 1 24 7664 1 1 4 ASN CB C -6.066 -6.393 10.604 1.00 . A A . 4 ASN CB 1 1 24 7665 1 1 4 ASN CG C -7.073 -5.343 11.077 1.00 . A A . 4 ASN CG 1 1 24 7666 1 1 4 ASN H H -2.955 -6.709 9.900 1.00 . A A . 4 ASN H 1 1 24 7667 1 1 4 ASN HA H -4.593 -4.855 11.020 1.00 . A A . 4 ASN HA 1 1 24 7668 1 1 4 ASN HB2 H -6.205 -6.583 9.540 1.00 . A A . 4 ASN HB2 1 1 24 7669 1 1 4 ASN HB3 H -6.249 -7.335 11.122 1.00 . A A . 4 ASN HB3 1 1 24 7670 1 1 4 ASN HD21 H -6.341 -5.552 12.952 1.00 . A A . 4 ASN HD21 1 1 24 7671 1 1 4 ASN HD22 H -7.626 -4.402 12.783 1.00 . A A . 4 ASN HD22 1 1 24 7672 1 1 4 ASN N N -3.784 -6.182 9.711 1.00 . A A . 4 ASN N 1 1 24 7673 1 1 4 ASN ND2 N -7.008 -5.077 12.378 1.00 . A A . 4 ASN ND2 1 1 24 7674 1 1 4 ASN O O -4.865 -7.288 12.833 1.00 . A A . 4 ASN O 1 1 24 7675 1 1 4 ASN OD1 O -7.857 -4.808 10.309 1.00 . A A . 4 ASN OD1 1 1 24 7676 1 1 5 GLY C C -1.387 -6.446 14.198 1.00 . A A . 5 GLY C 1 1 24 7677 1 1 5 GLY CA C -2.125 -7.421 13.280 1.00 . A A . 5 GLY CA 1 1 24 7678 1 1 5 GLY H H -2.154 -6.251 11.557 1.00 . A A . 5 GLY H 1 1 24 7679 1 1 5 GLY HA2 H -2.868 -7.976 13.853 1.00 . A A . 5 GLY HA2 1 1 24 7680 1 1 5 GLY HA3 H -1.421 -8.153 12.880 1.00 . A A . 5 GLY HA3 1 1 24 7681 1 1 5 GLY N N -2.775 -6.718 12.187 1.00 . A A . 5 GLY N 1 1 24 7682 1 1 5 GLY O O -0.297 -6.747 14.682 1.00 . A A . 5 GLY O 1 1 24 7683 1 1 6 GLY C C -2.365 -3.073 15.400 1.00 . A A . 6 GLY C 1 1 24 7684 1 1 6 GLY CA C -1.427 -4.275 15.264 1.00 . A A . 6 GLY CA 1 1 24 7685 1 1 6 GLY H H -2.898 -5.059 14.014 1.00 . A A . 6 GLY H 1 1 24 7686 1 1 6 GLY HA2 H -1.220 -4.692 16.249 1.00 . A A . 6 GLY HA2 1 1 24 7687 1 1 6 GLY HA3 H -0.473 -3.951 14.848 1.00 . A A . 6 GLY HA3 1 1 24 7688 1 1 6 GLY N N -2.011 -5.297 14.412 1.00 . A A . 6 GLY N 1 1 24 7689 1 1 6 GLY O O -2.661 -2.635 16.510 1.00 . A A . 6 GLY O 1 1 24 7690 1 1 7 CYS C C -4.909 -1.751 15.117 1.00 . A A . 7 CYS C 1 1 24 7691 1 1 7 CYS CA C -3.703 -1.431 14.231 1.00 . A A . 7 CYS CA 1 1 24 7692 1 1 7 CYS CB C -4.122 -1.070 12.804 1.00 . A A . 7 CYS CB 1 1 24 7693 1 1 7 CYS H H -2.559 -2.936 13.355 1.00 . A A . 7 CYS H 1 1 24 7694 1 1 7 CYS HA H -3.143 -0.585 14.629 1.00 . A A . 7 CYS HA 1 1 24 7695 1 1 7 CYS HB2 H -4.550 -1.954 12.332 1.00 . A A . 7 CYS HB2 1 1 24 7696 1 1 7 CYS HB3 H -4.912 -0.321 12.852 1.00 . A A . 7 CYS HB3 1 1 24 7697 1 1 7 CYS N N -2.805 -2.574 14.254 1.00 . A A . 7 CYS N 1 1 24 7698 1 1 7 CYS O O -4.982 -2.827 15.709 1.00 . A A . 7 CYS O 1 1 24 7699 1 1 7 CYS SG S -2.772 -0.434 11.746 1.00 . A A . 7 CYS SG 1 1 24 7700 1 1 8 LEU C C -8.084 -1.699 15.164 1.00 . A A . 8 LEU C 1 1 24 7701 1 1 8 LEU CA C -7.024 -0.962 15.984 1.00 . A A . 8 LEU CA 1 1 24 7702 1 1 8 LEU CB C -7.497 0.389 16.526 1.00 . A A . 8 LEU CB 1 1 24 7703 1 1 8 LEU CD1 C -8.787 -0.510 18.497 1.00 . A A . 8 LEU CD1 1 1 24 7704 1 1 8 LEU CD2 C -9.283 1.809 17.599 1.00 . A A . 8 LEU CD2 1 1 24 7705 1 1 8 LEU CG C -8.840 0.385 17.258 1.00 . A A . 8 LEU CG 1 1 24 7706 1 1 8 LEU H H -5.758 0.076 14.695 1.00 . A A . 8 LEU H 1 1 24 7707 1 1 8 LEU HA H -6.759 -1.578 16.842 1.00 . A A . 8 LEU HA 1 1 24 7708 1 1 8 LEU HB2 H -6.736 0.772 17.206 1.00 . A A . 8 LEU HB2 1 1 24 7709 1 1 8 LEU HB3 H -7.561 1.090 15.694 1.00 . A A . 8 LEU HB3 1 1 24 7710 1 1 8 LEU HD11 H -8.067 -1.312 18.335 1.00 . A A . 8 LEU HD11 1 1 24 7711 1 1 8 LEU HD12 H -8.485 0.082 19.360 1.00 . A A . 8 LEU HD12 1 1 24 7712 1 1 8 LEU HD13 H -9.773 -0.940 18.678 1.00 . A A . 8 LEU HD13 1 1 24 7713 1 1 8 LEU HD21 H -8.789 2.514 16.929 1.00 . A A . 8 LEU HD21 1 1 24 7714 1 1 8 LEU HD22 H -10.363 1.892 17.480 1.00 . A A . 8 LEU HD22 1 1 24 7715 1 1 8 LEU HD23 H -9.013 2.037 18.630 1.00 . A A . 8 LEU HD23 1 1 24 7716 1 1 8 LEU HG H -9.592 -0.035 16.589 1.00 . A A . 8 LEU HG 1 1 24 7717 1 1 8 LEU N N -5.825 -0.796 15.180 1.00 . A A . 8 LEU N 1 1 24 7718 1 1 8 LEU O O -8.581 -2.744 15.583 1.00 . A A . 8 LEU O 1 1 24 7719 1 1 9 ALA C C -9.893 -0.657 12.148 1.00 . A A . 9 ALA C 1 1 24 7720 1 1 9 ALA CA C -9.391 -1.719 13.129 1.00 . A A . 9 ALA CA 1 1 24 7721 1 1 9 ALA CB C -10.524 -2.321 13.965 1.00 . A A . 9 ALA CB 1 1 24 7722 1 1 9 ALA H H -7.991 -0.278 13.679 1.00 . A A . 9 ALA H 1 1 24 7723 1 1 9 ALA HA H -8.905 -2.518 12.570 1.00 . A A . 9 ALA HA 1 1 24 7724 1 1 9 ALA HB1 H -10.574 -1.814 14.928 1.00 . A A . 9 ALA HB1 1 1 24 7725 1 1 9 ALA HB2 H -11.470 -2.195 13.438 1.00 . A A . 9 ALA HB2 1 1 24 7726 1 1 9 ALA HB3 H -10.334 -3.383 14.122 1.00 . A A . 9 ALA HB3 1 1 24 7727 1 1 9 ALA N N -8.400 -1.128 14.011 1.00 . A A . 9 ALA N 1 1 24 7728 1 1 9 ALA O O -10.781 0.127 12.477 1.00 . A A . 9 ALA O 1 1 24 7729 1 1 10 GLY C C -8.469 1.119 9.491 1.00 . A A . 10 GLY C 1 1 24 7730 1 1 10 GLY CA C -9.675 0.286 9.931 1.00 . A A . 10 GLY CA 1 1 24 7731 1 1 10 GLY H H -8.578 -1.307 10.704 1.00 . A A . 10 GLY H 1 1 24 7732 1 1 10 GLY HA2 H -10.088 -0.245 9.074 1.00 . A A . 10 GLY HA2 1 1 24 7733 1 1 10 GLY HA3 H -10.459 0.944 10.307 1.00 . A A . 10 GLY HA3 1 1 24 7734 1 1 10 GLY N N -9.299 -0.667 10.963 1.00 . A A . 10 GLY N 1 1 24 7735 1 1 10 GLY O O -8.367 1.501 8.326 1.00 . A A . 10 GLY O 1 1 24 7736 1 1 11 TYR C C -5.462 1.415 9.209 1.00 . A A . 11 TYR C 1 1 24 7737 1 1 11 TYR CA C -6.393 2.157 10.170 1.00 . A A . 11 TYR CA 1 1 24 7738 1 1 11 TYR CB C -5.684 2.333 11.514 1.00 . A A . 11 TYR CB 1 1 24 7739 1 1 11 TYR CD1 C -7.409 2.662 13.324 1.00 . A A . 11 TYR CD1 1 1 24 7740 1 1 11 TYR CD2 C -6.163 4.564 12.586 1.00 . A A . 11 TYR CD2 1 1 24 7741 1 1 11 TYR CE1 C -8.123 3.492 14.258 1.00 . A A . 11 TYR CE1 1 1 24 7742 1 1 11 TYR CE2 C -6.879 5.394 13.521 1.00 . A A . 11 TYR CE2 1 1 24 7743 1 1 11 TYR CG C -6.444 3.215 12.508 1.00 . A A . 11 TYR CG 1 1 24 7744 1 1 11 TYR CZ C -7.822 4.817 14.311 1.00 . A A . 11 TYR CZ 1 1 24 7745 1 1 11 TYR H H -7.678 1.062 11.390 1.00 . A A . 11 TYR H 1 1 24 7746 1 1 11 TYR HA H -6.703 3.096 9.710 1.00 . A A . 11 TYR HA 1 1 24 7747 1 1 11 TYR HB2 H -5.528 1.351 11.962 1.00 . A A . 11 TYR HB2 1 1 24 7748 1 1 11 TYR HB3 H -4.699 2.764 11.340 1.00 . A A . 11 TYR HB3 1 1 24 7749 1 1 11 TYR HD1 H -7.629 1.596 13.262 1.00 . A A . 11 TYR HD1 1 1 24 7750 1 1 11 TYR HD2 H -5.402 5.001 11.940 1.00 . A A . 11 TYR HD2 1 1 24 7751 1 1 11 TYR HE1 H -8.888 3.067 14.911 1.00 . A A . 11 TYR HE1 1 1 24 7752 1 1 11 TYR HE2 H -6.668 6.461 13.593 1.00 . A A . 11 TYR HE2 1 1 24 7753 1 1 11 TYR HH H -8.362 6.567 14.967 1.00 . A A . 11 TYR HH 1 1 24 7754 1 1 11 TYR N N -7.588 1.377 10.445 1.00 . A A . 11 TYR N 1 1 24 7755 1 1 11 TYR O O -5.542 0.194 9.080 1.00 . A A . 11 TYR O 1 1 24 7756 1 1 11 TYR OH O -8.497 5.601 15.193 1.00 . A A . 11 TYR OH 1 1 24 7757 1 1 12 MET C C -2.217 1.777 8.111 1.00 . A A . 12 MET C 1 1 24 7758 1 1 12 MET CA C -3.655 1.613 7.614 1.00 . A A . 12 MET CA 1 1 24 7759 1 1 12 MET CB C -3.808 2.305 6.258 1.00 . A A . 12 MET CB 1 1 24 7760 1 1 12 MET CE C -2.739 6.110 5.269 1.00 . A A . 12 MET CE 1 1 24 7761 1 1 12 MET CG C -3.722 3.825 6.405 1.00 . A A . 12 MET CG 1 1 24 7762 1 1 12 MET H H -4.541 3.175 8.669 1.00 . A A . 12 MET H 1 1 24 7763 1 1 12 MET HA H -3.907 0.555 7.551 1.00 . A A . 12 MET HA 1 1 24 7764 1 1 12 MET HB2 H -3.031 1.957 5.578 1.00 . A A . 12 MET HB2 1 1 24 7765 1 1 12 MET HB3 H -4.765 2.033 5.814 1.00 . A A . 12 MET HB3 1 1 24 7766 1 1 12 MET HE1 H -2.304 6.003 6.262 1.00 . A A . 12 MET HE1 1 1 24 7767 1 1 12 MET HE2 H -1.952 6.343 4.552 1.00 . A A . 12 MET HE2 1 1 24 7768 1 1 12 MET HE3 H -3.472 6.917 5.278 1.00 . A A . 12 MET HE3 1 1 24 7769 1 1 12 MET HG2 H -4.619 4.204 6.895 1.00 . A A . 12 MET HG2 1 1 24 7770 1 1 12 MET HG3 H -2.876 4.090 7.041 1.00 . A A . 12 MET HG3 1 1 24 7771 1 1 12 MET N N -4.600 2.183 8.559 1.00 . A A . 12 MET N 1 1 24 7772 1 1 12 MET O O -1.946 2.609 8.975 1.00 . A A . 12 MET O 1 1 24 7773 1 1 12 MET SD S -3.538 4.585 4.800 1.00 . A A . 12 MET SD 1 1 24 7774 1 1 13 ARG C C 0.881 1.754 6.847 1.00 . A A . 13 ARG C 1 1 24 7775 1 1 13 ARG CA C 0.071 1.016 7.916 1.00 . A A . 13 ARG CA 1 1 24 7776 1 1 13 ARG CB C 0.639 -0.393 8.095 1.00 . A A . 13 ARG CB 1 1 24 7777 1 1 13 ARG CD C 1.002 -1.232 10.445 1.00 . A A . 13 ARG CD 1 1 24 7778 1 1 13 ARG CG C 1.607 -0.448 9.279 1.00 . A A . 13 ARG CG 1 1 24 7779 1 1 13 ARG CZ C 2.163 -3.402 10.055 1.00 . A A . 13 ARG CZ 1 1 24 7780 1 1 13 ARG H H -1.561 0.296 6.840 1.00 . A A . 13 ARG H 1 1 24 7781 1 1 13 ARG HA H 0.090 1.555 8.863 1.00 . A A . 13 ARG HA 1 1 24 7782 1 1 13 ARG HB2 H -0.175 -1.100 8.253 1.00 . A A . 13 ARG HB2 1 1 24 7783 1 1 13 ARG HB3 H 1.155 -0.699 7.185 1.00 . A A . 13 ARG HB3 1 1 24 7784 1 1 13 ARG HD2 H 1.556 -1.025 11.360 1.00 . A A . 13 ARG HD2 1 1 24 7785 1 1 13 ARG HD3 H -0.026 -0.912 10.615 1.00 . A A . 13 ARG HD3 1 1 24 7786 1 1 13 ARG HE H 0.166 -3.155 10.017 1.00 . A A . 13 ARG HE 1 1 24 7787 1 1 13 ARG HG2 H 2.542 -0.914 8.968 1.00 . A A . 13 ARG HG2 1 1 24 7788 1 1 13 ARG HG3 H 1.848 0.565 9.603 1.00 . A A . 13 ARG HG3 1 1 24 7789 1 1 13 ARG HH11 H 3.401 -1.833 10.429 1.00 . A A . 13 ARG HH11 1 1 24 7790 1 1 13 ARG HH12 H 4.193 -3.349 10.156 1.00 . A A . 13 ARG HH12 1 1 24 7791 1 1 13 ARG HH21 H 1.211 -5.155 9.656 1.00 . A A . 13 ARG HH21 1 1 24 7792 1 1 13 ARG HH22 H 2.939 -5.251 9.713 1.00 . A A . 13 ARG HH22 1 1 24 7793 1 1 13 ARG N N -1.333 0.970 7.542 1.00 . A A . 13 ARG N 1 1 24 7794 1 1 13 ARG NE N 1.037 -2.682 10.151 1.00 . A A . 13 ARG NE 1 1 24 7795 1 1 13 ARG NH1 N 3.353 -2.811 10.228 1.00 . A A . 13 ARG NH1 1 1 24 7796 1 1 13 ARG NH2 N 2.099 -4.713 9.785 1.00 . A A . 13 ARG NH2 1 1 24 7797 1 1 13 ARG O O 1.112 1.223 5.762 1.00 . A A . 13 ARG O 1 1 24 7798 1 1 14 THR C C 3.362 3.064 5.891 1.00 . A A . 14 THR C 1 1 24 7799 1 1 14 THR CA C 2.067 3.782 6.276 1.00 . A A . 14 THR CA 1 1 24 7800 1 1 14 THR CB C 2.301 5.142 6.936 1.00 . A A . 14 THR CB 1 1 24 7801 1 1 14 THR CG2 C 1.045 5.682 7.623 1.00 . A A . 14 THR CG2 1 1 24 7802 1 1 14 THR H H 1.096 3.391 8.076 1.00 . A A . 14 THR H 1 1 24 7803 1 1 14 THR HA H 1.491 3.915 5.360 1.00 . A A . 14 THR HA 1 1 24 7804 1 1 14 THR HB H 2.691 5.862 6.216 1.00 . A A . 14 THR HB 1 1 24 7805 1 1 14 THR HG1 H 2.841 4.091 8.551 1.00 . A A . 14 THR HG1 1 1 24 7806 1 1 14 THR HG21 H 0.178 5.108 7.300 1.00 . A A . 14 THR HG21 1 1 24 7807 1 1 14 THR HG22 H 1.156 5.596 8.704 1.00 . A A . 14 THR HG22 1 1 24 7808 1 1 14 THR HG23 H 0.908 6.730 7.356 1.00 . A A . 14 THR HG23 1 1 24 7809 1 1 14 THR N N 1.289 2.966 7.192 1.00 . A A . 14 THR N 1 1 24 7810 1 1 14 THR O O 3.426 1.836 5.916 1.00 . A A . 14 THR O 1 1 24 7811 1 1 14 THR OG1 O 3.190 4.858 8.012 1.00 . A A . 14 THR OG1 1 1 24 7812 1 1 15 ALA C C 6.581 3.297 6.366 1.00 . A A . 15 ALA C 1 1 24 7813 1 1 15 ALA CA C 5.651 3.315 5.152 1.00 . A A . 15 ALA CA 1 1 24 7814 1 1 15 ALA CB C 6.222 4.135 3.993 1.00 . A A . 15 ALA CB 1 1 24 7815 1 1 15 ALA H H 4.302 4.858 5.524 1.00 . A A . 15 ALA H 1 1 24 7816 1 1 15 ALA HA H 5.490 2.292 4.813 1.00 . A A . 15 ALA HA 1 1 24 7817 1 1 15 ALA HB1 H 5.451 4.282 3.238 1.00 . A A . 15 ALA HB1 1 1 24 7818 1 1 15 ALA HB2 H 6.558 5.104 4.364 1.00 . A A . 15 ALA HB2 1 1 24 7819 1 1 15 ALA HB3 H 7.066 3.603 3.552 1.00 . A A . 15 ALA HB3 1 1 24 7820 1 1 15 ALA N N 4.361 3.860 5.542 1.00 . A A . 15 ALA N 1 1 24 7821 1 1 15 ALA O O 7.758 2.959 6.247 1.00 . A A . 15 ALA O 1 1 24 7822 1 1 16 ASP C C 6.195 2.682 9.726 1.00 . A A . 16 ASP C 1 1 24 7823 1 1 16 ASP CA C 6.782 3.697 8.743 1.00 . A A . 16 ASP CA 1 1 24 7824 1 1 16 ASP CB C 6.718 5.079 9.395 1.00 . A A . 16 ASP CB 1 1 24 7825 1 1 16 ASP CG C 8.069 5.657 9.821 1.00 . A A . 16 ASP CG 1 1 24 7826 1 1 16 ASP H H 5.060 3.938 7.596 1.00 . A A . 16 ASP H 1 1 24 7827 1 1 16 ASP HA H 7.804 3.454 8.454 1.00 . A A . 16 ASP HA 1 1 24 7828 1 1 16 ASP HB2 H 6.246 5.772 8.698 1.00 . A A . 16 ASP HB2 1 1 24 7829 1 1 16 ASP HB3 H 6.072 5.021 10.272 1.00 . A A . 16 ASP HB3 1 1 24 7830 1 1 16 ASP N N 6.018 3.665 7.508 1.00 . A A . 16 ASP N 1 1 24 7831 1 1 16 ASP O O 6.806 2.379 10.750 1.00 . A A . 16 ASP O 1 1 24 7832 1 1 16 ASP OD1 O 8.713 6.290 8.956 1.00 . A A . 16 ASP OD1 1 1 24 7833 1 1 16 ASP OD2 O 8.428 5.453 11.000 1.00 . A A . 16 ASP OD2 1 1 24 7834 1 1 17 GLY C C 3.320 1.890 11.136 1.00 . A A . 17 GLY C 1 1 24 7835 1 1 17 GLY CA C 4.341 1.211 10.220 1.00 . A A . 17 GLY CA 1 1 24 7836 1 1 17 GLY H H 4.527 2.437 8.547 1.00 . A A . 17 GLY H 1 1 24 7837 1 1 17 GLY HA2 H 3.838 0.472 9.595 1.00 . A A . 17 GLY HA2 1 1 24 7838 1 1 17 GLY HA3 H 5.074 0.673 10.822 1.00 . A A . 17 GLY HA3 1 1 24 7839 1 1 17 GLY N N 5.016 2.185 9.381 1.00 . A A . 17 GLY N 1 1 24 7840 1 1 17 GLY O O 2.592 1.218 11.865 1.00 . A A . 17 GLY O 1 1 24 7841 1 1 18 ARG C C 0.944 3.783 11.405 1.00 . A A . 18 ARG C 1 1 24 7842 1 1 18 ARG CA C 2.383 3.990 11.883 1.00 . A A . 18 ARG CA 1 1 24 7843 1 1 18 ARG CB C 2.722 5.481 11.825 1.00 . A A . 18 ARG CB 1 1 24 7844 1 1 18 ARG CD C 4.699 7.021 11.541 1.00 . A A . 18 ARG CD 1 1 24 7845 1 1 18 ARG CG C 4.192 5.722 12.173 1.00 . A A . 18 ARG CG 1 1 24 7846 1 1 18 ARG CZ C 5.965 8.181 13.347 1.00 . A A . 18 ARG CZ 1 1 24 7847 1 1 18 ARG H H 3.897 3.751 10.473 1.00 . A A . 18 ARG H 1 1 24 7848 1 1 18 ARG HA H 2.518 3.611 12.896 1.00 . A A . 18 ARG HA 1 1 24 7849 1 1 18 ARG HB2 H 2.512 5.867 10.828 1.00 . A A . 18 ARG HB2 1 1 24 7850 1 1 18 ARG HB3 H 2.086 6.030 12.520 1.00 . A A . 18 ARG HB3 1 1 24 7851 1 1 18 ARG HD2 H 5.647 6.843 11.034 1.00 . A A . 18 ARG HD2 1 1 24 7852 1 1 18 ARG HD3 H 3.993 7.367 10.785 1.00 . A A . 18 ARG HD3 1 1 24 7853 1 1 18 ARG HE H 4.123 8.706 12.727 1.00 . A A . 18 ARG HE 1 1 24 7854 1 1 18 ARG HG2 H 4.311 5.770 13.255 1.00 . A A . 18 ARG HG2 1 1 24 7855 1 1 18 ARG HG3 H 4.795 4.884 11.822 1.00 . A A . 18 ARG HG3 1 1 24 7856 1 1 18 ARG HH11 H 6.940 6.609 12.502 1.00 . A A . 18 ARG HH11 1 1 24 7857 1 1 18 ARG HH12 H 7.807 7.425 13.760 1.00 . A A . 18 ARG HH12 1 1 24 7858 1 1 18 ARG HH21 H 5.267 9.784 14.386 1.00 . A A . 18 ARG HH21 1 1 24 7859 1 1 18 ARG HH22 H 6.849 9.244 14.838 1.00 . A A . 18 ARG HH22 1 1 24 7860 1 1 18 ARG N N 3.301 3.213 11.069 1.00 . A A . 18 ARG N 1 1 24 7861 1 1 18 ARG NE N 4.870 8.057 12.583 1.00 . A A . 18 ARG NE 1 1 24 7862 1 1 18 ARG NH1 N 6.991 7.333 13.190 1.00 . A A . 18 ARG NH1 1 1 24 7863 1 1 18 ARG NH2 N 6.033 9.151 14.268 1.00 . A A . 18 ARG NH2 1 1 24 7864 1 1 18 ARG O O 0.582 4.209 10.310 1.00 . A A . 18 ARG O 1 1 24 7865 1 1 19 CYS C C -1.955 4.196 11.776 1.00 . A A . 19 CYS C 1 1 24 7866 1 1 19 CYS CA C -1.230 2.858 11.928 1.00 . A A . 19 CYS CA 1 1 24 7867 1 1 19 CYS CB C -1.892 1.966 12.980 1.00 . A A . 19 CYS CB 1 1 24 7868 1 1 19 CYS H H 0.463 2.785 13.141 1.00 . A A . 19 CYS H 1 1 24 7869 1 1 19 CYS HA H -1.231 2.309 10.987 1.00 . A A . 19 CYS HA 1 1 24 7870 1 1 19 CYS HB2 H -1.758 2.424 13.961 1.00 . A A . 19 CYS HB2 1 1 24 7871 1 1 19 CYS HB3 H -2.963 1.935 12.786 1.00 . A A . 19 CYS HB3 1 1 24 7872 1 1 19 CYS N N 0.161 3.128 12.252 1.00 . A A . 19 CYS N 1 1 24 7873 1 1 19 CYS O O -2.323 4.824 12.769 1.00 . A A . 19 CYS O 1 1 24 7874 1 1 19 CYS SG S -1.256 0.251 13.041 1.00 . A A . 19 CYS SG 1 1 24 7875 1 1 20 LYS C C -4.280 5.563 9.894 1.00 . A A . 20 LYS C 1 1 24 7876 1 1 20 LYS CA C -2.815 5.847 10.232 1.00 . A A . 20 LYS CA 1 1 24 7877 1 1 20 LYS CB C -2.069 6.614 9.138 1.00 . A A . 20 LYS CB 1 1 24 7878 1 1 20 LYS CD C -0.186 8.002 10.079 1.00 . A A . 20 LYS CD 1 1 24 7879 1 1 20 LYS CE C 0.495 9.325 9.722 1.00 . A A . 20 LYS CE 1 1 24 7880 1 1 20 LYS CG C -1.649 8.000 9.630 1.00 . A A . 20 LYS CG 1 1 24 7881 1 1 20 LYS H H -1.836 4.079 9.725 1.00 . A A . 20 LYS H 1 1 24 7882 1 1 20 LYS HA H -2.781 6.457 11.134 1.00 . A A . 20 LYS HA 1 1 24 7883 1 1 20 LYS HB2 H -1.188 6.051 8.830 1.00 . A A . 20 LYS HB2 1 1 24 7884 1 1 20 LYS HB3 H -2.707 6.714 8.260 1.00 . A A . 20 LYS HB3 1 1 24 7885 1 1 20 LYS HD2 H -0.132 7.840 11.156 1.00 . A A . 20 LYS HD2 1 1 24 7886 1 1 20 LYS HD3 H 0.345 7.176 9.606 1.00 . A A . 20 LYS HD3 1 1 24 7887 1 1 20 LYS HE2 H 1.399 9.131 9.144 1.00 . A A . 20 LYS HE2 1 1 24 7888 1 1 20 LYS HE3 H -0.164 9.921 9.091 1.00 . A A . 20 LYS HE3 1 1 24 7889 1 1 20 LYS HG2 H -1.790 8.731 8.834 1.00 . A A . 20 LYS HG2 1 1 24 7890 1 1 20 LYS HG3 H -2.288 8.305 10.459 1.00 . A A . 20 LYS HG3 1 1 24 7891 1 1 20 LYS HZ1 H 0.233 9.795 11.694 1.00 . A A . 20 LYS HZ1 1 1 24 7892 1 1 20 LYS HZ2 H 1.786 9.898 11.199 1.00 . A A . 20 LYS HZ2 1 1 24 7893 1 1 20 LYS HZ3 H 0.717 11.059 10.780 1.00 . A A . 20 LYS HZ3 1 1 24 7894 1 1 20 LYS N N -2.139 4.595 10.527 1.00 . A A . 20 LYS N 1 1 24 7895 1 1 20 LYS NZ N 0.835 10.080 10.948 1.00 . A A . 20 LYS NZ 1 1 24 7896 1 1 20 LYS O O -4.649 4.421 9.624 1.00 . A A . 20 LYS O 1 1 24 7897 1 1 21 PRO C C -6.740 6.350 8.114 1.00 . A A . 21 PRO C 1 1 24 7898 1 1 21 PRO CA C -6.513 6.528 9.617 1.00 . A A . 21 PRO CA 1 1 24 7899 1 1 21 PRO CB C -7.142 7.799 10.164 1.00 . A A . 21 PRO CB 1 1 24 7900 1 1 21 PRO CD C -4.697 8.017 10.234 1.00 . A A . 21 PRO CD 1 1 24 7901 1 1 21 PRO CG C -6.002 8.788 10.336 1.00 . A A . 21 PRO CG 1 1 24 7902 1 1 21 PRO HA H -6.893 5.711 10.049 1.00 . A A . 21 PRO HA 1 1 24 7903 1 1 21 PRO HB2 H -7.898 8.188 9.481 1.00 . A A . 21 PRO HB2 1 1 24 7904 1 1 21 PRO HB3 H -7.641 7.609 11.116 1.00 . A A . 21 PRO HB3 1 1 24 7905 1 1 21 PRO HD2 H -4.052 8.430 9.458 1.00 . A A . 21 PRO HD2 1 1 24 7906 1 1 21 PRO HD3 H -4.137 8.061 11.168 1.00 . A A . 21 PRO HD3 1 1 24 7907 1 1 21 PRO HG2 H -6.049 9.562 9.569 1.00 . A A . 21 PRO HG2 1 1 24 7908 1 1 21 PRO HG3 H -6.074 9.291 11.300 1.00 . A A . 21 PRO HG3 1 1 24 7909 1 1 21 PRO N N -5.098 6.649 9.919 1.00 . A A . 21 PRO N 1 1 24 7910 1 1 21 PRO O O -6.042 6.954 7.301 1.00 . A A . 21 PRO O 1 1 24 7911 1 1 22 THR C C -9.555 5.353 6.178 1.00 . A A . 22 THR C 1 1 24 7912 1 1 22 THR CA C -8.045 5.250 6.400 1.00 . A A . 22 THR CA 1 1 24 7913 1 1 22 THR CB C -7.469 3.880 6.032 1.00 . A A . 22 THR CB 1 1 24 7914 1 1 22 THR CG2 C -8.275 3.182 4.935 1.00 . A A . 22 THR CG2 1 1 24 7915 1 1 22 THR H H -8.280 5.028 8.458 1.00 . A A . 22 THR H 1 1 24 7916 1 1 22 THR HA H -7.578 6.018 5.784 1.00 . A A . 22 THR HA 1 1 24 7917 1 1 22 THR HB H -7.382 3.245 6.915 1.00 . A A . 22 THR HB 1 1 24 7918 1 1 22 THR HG1 H -5.891 3.386 4.906 1.00 . A A . 22 THR HG1 1 1 24 7919 1 1 22 THR HG21 H -8.464 3.884 4.122 1.00 . A A . 22 THR HG21 1 1 24 7920 1 1 22 THR HG22 H -7.709 2.331 4.556 1.00 . A A . 22 THR HG22 1 1 24 7921 1 1 22 THR HG23 H -9.223 2.836 5.345 1.00 . A A . 22 THR HG23 1 1 24 7922 1 1 22 THR N N -7.718 5.516 7.790 1.00 . A A . 22 THR N 1 1 24 7923 1 1 22 THR O O -10.048 5.061 5.090 1.00 . A A . 22 THR O 1 1 24 7924 1 1 22 THR OG1 O -6.224 4.182 5.411 1.00 . A A . 22 THR OG1 1 1 24 7925 1 1 23 PHE C C -12.080 7.317 6.684 1.00 . A A . 23 PHE C 1 1 24 7926 1 1 23 PHE CA C -11.692 5.916 7.162 1.00 . A A . 23 PHE CA 1 1 24 7927 1 1 23 PHE CB C -12.228 5.706 8.580 1.00 . A A . 23 PHE CB 1 1 24 7928 1 1 23 PHE CD1 C -11.763 7.911 9.670 1.00 . A A . 23 PHE CD1 1 1 24 7929 1 1 23 PHE CD2 C -10.709 5.997 10.548 1.00 . A A . 23 PHE CD2 1 1 24 7930 1 1 23 PHE CE1 C -11.126 8.713 10.654 1.00 . A A . 23 PHE CE1 1 1 24 7931 1 1 23 PHE CE2 C -10.072 6.798 11.532 1.00 . A A . 23 PHE CE2 1 1 24 7932 1 1 23 PHE CG C -11.542 6.570 9.639 1.00 . A A . 23 PHE CG 1 1 24 7933 1 1 23 PHE CZ C -10.294 8.140 11.564 1.00 . A A . 23 PHE CZ 1 1 24 7934 1 1 23 PHE H H -9.839 6.006 8.110 1.00 . A A . 23 PHE H 1 1 24 7935 1 1 23 PHE HA H -12.059 5.177 6.449 1.00 . A A . 23 PHE HA 1 1 24 7936 1 1 23 PHE HB2 H -13.297 5.920 8.587 1.00 . A A . 23 PHE HB2 1 1 24 7937 1 1 23 PHE HB3 H -12.112 4.657 8.849 1.00 . A A . 23 PHE HB3 1 1 24 7938 1 1 23 PHE HD1 H -12.430 8.371 8.941 1.00 . A A . 23 PHE HD1 1 1 24 7939 1 1 23 PHE HD2 H -10.532 4.921 10.523 1.00 . A A . 23 PHE HD2 1 1 24 7940 1 1 23 PHE HE1 H -11.304 9.788 10.679 1.00 . A A . 23 PHE HE1 1 1 24 7941 1 1 23 PHE HE2 H -9.405 6.339 12.262 1.00 . A A . 23 PHE HE2 1 1 24 7942 1 1 23 PHE HZ H -9.805 8.755 12.320 1.00 . A A . 23 PHE HZ 1 1 24 7943 1 1 23 PHE N N -10.248 5.771 7.228 1.00 . A A . 23 PHE N 1 1 24 7944 1 1 23 PHE O O -11.223 8.093 6.264 1.00 . A A . 23 PHE O 1 1 25 7945 1 1 1 GLU C C -3.476 -10.522 3.089 1.00 . A A . 1 GLU C 1 1 25 7946 1 1 1 GLU CA C -2.607 -11.775 2.964 1.00 . A A . 1 GLU CA 1 1 25 7947 1 1 1 GLU CB C -3.470 -13.038 2.925 1.00 . A A . 1 GLU CB 1 1 25 7948 1 1 1 GLU CD C -5.140 -14.367 1.582 1.00 . A A . 1 GLU CD 1 1 25 7949 1 1 1 GLU CG C -4.180 -13.176 1.576 1.00 . A A . 1 GLU CG 1 1 25 7950 1 1 1 GLU HA H -2.010 -11.723 2.054 1.00 . A A . 1 GLU HA 1 1 25 7951 1 1 1 GLU HB2 H -2.846 -13.915 3.103 1.00 . A A . 1 GLU HB2 1 1 25 7952 1 1 1 GLU HB3 H -4.208 -13.004 3.726 1.00 . A A . 1 GLU HB3 1 1 25 7953 1 1 1 GLU HG2 H -4.730 -12.261 1.356 1.00 . A A . 1 GLU HG2 1 1 25 7954 1 1 1 GLU HG3 H -3.442 -13.303 0.784 1.00 . A A . 1 GLU HG3 1 1 25 7955 1 1 1 GLU N N -1.648 -11.834 4.053 1.00 . A A . 1 GLU N 1 1 25 7956 1 1 1 GLU O O -3.479 -9.674 2.198 1.00 . A A . 1 GLU O 1 1 25 7957 1 1 1 GLU OE1 O -6.150 -14.278 2.314 1.00 . A A . 1 GLU OE1 1 1 25 7958 1 1 1 GLU OE2 O -4.844 -15.339 0.853 1.00 . A A . 1 GLU OE2 1 1 25 7959 1 1 2 ASN C C -4.344 -8.315 5.368 1.00 . A A . 2 ASN C 1 1 25 7960 1 1 2 ASN CA C -5.062 -9.309 4.454 1.00 . A A . 2 ASN CA 1 1 25 7961 1 1 2 ASN CB C -6.351 -9.748 5.152 1.00 . A A . 2 ASN CB 1 1 25 7962 1 1 2 ASN CG C -7.513 -9.826 4.159 1.00 . A A . 2 ASN CG 1 1 25 7963 1 1 2 ASN H H -4.183 -11.139 4.920 1.00 . A A . 2 ASN H 1 1 25 7964 1 1 2 ASN HA H -5.279 -8.891 3.471 1.00 . A A . 2 ASN HA 1 1 25 7965 1 1 2 ASN HB2 H -6.202 -10.722 5.619 1.00 . A A . 2 ASN HB2 1 1 25 7966 1 1 2 ASN HB3 H -6.594 -9.046 5.948 1.00 . A A . 2 ASN HB3 1 1 25 7967 1 1 2 ASN HD21 H -7.852 -11.724 4.778 1.00 . A A . 2 ASN HD21 1 1 25 7968 1 1 2 ASN HD22 H -8.924 -11.142 3.547 1.00 . A A . 2 ASN HD22 1 1 25 7969 1 1 2 ASN N N -4.191 -10.445 4.201 1.00 . A A . 2 ASN N 1 1 25 7970 1 1 2 ASN ND2 N -8.149 -10.994 4.161 1.00 . A A . 2 ASN ND2 1 1 25 7971 1 1 2 ASN O O -3.360 -8.663 6.018 1.00 . A A . 2 ASN O 1 1 25 7972 1 1 2 ASN OD1 O -7.813 -8.887 3.439 1.00 . A A . 2 ASN OD1 1 1 25 7973 1 1 3 PHE C C -5.188 -5.730 7.407 1.00 . A A . 3 PHE C 1 1 25 7974 1 1 3 PHE CA C -4.286 -6.050 6.213 1.00 . A A . 3 PHE CA 1 1 25 7975 1 1 3 PHE CB C -4.164 -4.804 5.334 1.00 . A A . 3 PHE CB 1 1 25 7976 1 1 3 PHE CD1 C -1.803 -4.973 4.517 1.00 . A A . 3 PHE CD1 1 1 25 7977 1 1 3 PHE CD2 C -2.403 -3.084 5.789 1.00 . A A . 3 PHE CD2 1 1 25 7978 1 1 3 PHE CE1 C -0.478 -4.475 4.401 1.00 . A A . 3 PHE CE1 1 1 25 7979 1 1 3 PHE CE2 C -1.078 -2.585 5.674 1.00 . A A . 3 PHE CE2 1 1 25 7980 1 1 3 PHE CG C -2.737 -4.267 5.208 1.00 . A A . 3 PHE CG 1 1 25 7981 1 1 3 PHE CZ C -0.143 -3.291 4.982 1.00 . A A . 3 PHE CZ 1 1 25 7982 1 1 3 PHE H H -5.666 -6.821 4.858 1.00 . A A . 3 PHE H 1 1 25 7983 1 1 3 PHE HA H -3.325 -6.416 6.574 1.00 . A A . 3 PHE HA 1 1 25 7984 1 1 3 PHE HB2 H -4.543 -5.036 4.338 1.00 . A A . 3 PHE HB2 1 1 25 7985 1 1 3 PHE HB3 H -4.802 -4.019 5.741 1.00 . A A . 3 PHE HB3 1 1 25 7986 1 1 3 PHE HD1 H -2.071 -5.921 4.051 1.00 . A A . 3 PHE HD1 1 1 25 7987 1 1 3 PHE HD2 H -3.151 -2.518 6.344 1.00 . A A . 3 PHE HD2 1 1 25 7988 1 1 3 PHE HE1 H 0.270 -5.041 3.846 1.00 . A A . 3 PHE HE1 1 1 25 7989 1 1 3 PHE HE2 H -0.809 -1.637 6.140 1.00 . A A . 3 PHE HE2 1 1 25 7990 1 1 3 PHE HZ H 0.873 -2.910 4.893 1.00 . A A . 3 PHE HZ 1 1 25 7991 1 1 3 PHE N N -4.865 -7.097 5.389 1.00 . A A . 3 PHE N 1 1 25 7992 1 1 3 PHE O O -6.163 -4.992 7.273 1.00 . A A . 3 PHE O 1 1 25 7993 1 1 4 ASN C C -5.081 -7.027 10.857 1.00 . A A . 4 ASN C 1 1 25 7994 1 1 4 ASN CA C -5.594 -6.087 9.765 1.00 . A A . 4 ASN CA 1 1 25 7995 1 1 4 ASN CB C -7.079 -6.386 9.543 1.00 . A A . 4 ASN CB 1 1 25 7996 1 1 4 ASN CG C -7.956 -5.295 10.160 1.00 . A A . 4 ASN CG 1 1 25 7997 1 1 4 ASN H H -4.036 -6.900 8.648 1.00 . A A . 4 ASN H 1 1 25 7998 1 1 4 ASN HA H -5.446 -5.036 10.014 1.00 . A A . 4 ASN HA 1 1 25 7999 1 1 4 ASN HB2 H -7.283 -6.460 8.474 1.00 . A A . 4 ASN HB2 1 1 25 8000 1 1 4 ASN HB3 H -7.328 -7.351 9.983 1.00 . A A . 4 ASN HB3 1 1 25 8001 1 1 4 ASN HD21 H -7.218 -5.796 11.978 1.00 . A A . 4 ASN HD21 1 1 25 8002 1 1 4 ASN HD22 H -8.373 -4.506 11.977 1.00 . A A . 4 ASN HD22 1 1 25 8003 1 1 4 ASN N N -4.830 -6.301 8.548 1.00 . A A . 4 ASN N 1 1 25 8004 1 1 4 ASN ND2 N -7.840 -5.190 11.481 1.00 . A A . 4 ASN ND2 1 1 25 8005 1 1 4 ASN O O -5.869 -7.602 11.606 1.00 . A A . 4 ASN O 1 1 25 8006 1 1 4 ASN OD1 O -8.690 -4.595 9.483 1.00 . A A . 4 ASN OD1 1 1 25 8007 1 1 5 GLY C C -2.130 -7.232 12.748 1.00 . A A . 5 GLY C 1 1 25 8008 1 1 5 GLY CA C -3.135 -8.014 11.901 1.00 . A A . 5 GLY CA 1 1 25 8009 1 1 5 GLY H H -3.130 -6.682 10.299 1.00 . A A . 5 GLY H 1 1 25 8010 1 1 5 GLY HA2 H -3.898 -8.450 12.546 1.00 . A A . 5 GLY HA2 1 1 25 8011 1 1 5 GLY HA3 H -2.630 -8.840 11.400 1.00 . A A . 5 GLY HA3 1 1 25 8012 1 1 5 GLY N N -3.763 -7.154 10.913 1.00 . A A . 5 GLY N 1 1 25 8013 1 1 5 GLY O O -1.052 -7.737 13.062 1.00 . A A . 5 GLY O 1 1 25 8014 1 1 6 GLY C C -2.425 -3.923 14.386 1.00 . A A . 6 GLY C 1 1 25 8015 1 1 6 GLY CA C -1.663 -5.158 13.901 1.00 . A A . 6 GLY CA 1 1 25 8016 1 1 6 GLY H H -3.395 -5.611 12.836 1.00 . A A . 6 GLY H 1 1 25 8017 1 1 6 GLY HA2 H -1.286 -5.717 14.757 1.00 . A A . 6 GLY HA2 1 1 25 8018 1 1 6 GLY HA3 H -0.797 -4.848 13.315 1.00 . A A . 6 GLY HA3 1 1 25 8019 1 1 6 GLY N N -2.517 -6.014 13.096 1.00 . A A . 6 GLY N 1 1 25 8020 1 1 6 GLY O O -2.515 -3.678 15.588 1.00 . A A . 6 GLY O 1 1 25 8021 1 1 7 CYS C C -4.833 -2.352 14.704 1.00 . A A . 7 CYS C 1 1 25 8022 1 1 7 CYS CA C -3.705 -1.976 13.740 1.00 . A A . 7 CYS CA 1 1 25 8023 1 1 7 CYS CB C -4.237 -1.294 12.478 1.00 . A A . 7 CYS CB 1 1 25 8024 1 1 7 CYS H H -2.876 -3.385 12.451 1.00 . A A . 7 CYS H 1 1 25 8025 1 1 7 CYS HA H -3.007 -1.285 14.213 1.00 . A A . 7 CYS HA 1 1 25 8026 1 1 7 CYS HB2 H -4.643 -2.058 11.814 1.00 . A A . 7 CYS HB2 1 1 25 8027 1 1 7 CYS HB3 H -5.063 -0.641 12.756 1.00 . A A . 7 CYS HB3 1 1 25 8028 1 1 7 CYS N N -2.954 -3.179 13.426 1.00 . A A . 7 CYS N 1 1 25 8029 1 1 7 CYS O O -4.910 -3.491 15.161 1.00 . A A . 7 CYS O 1 1 25 8030 1 1 7 CYS SG S -2.998 -0.314 11.555 1.00 . A A . 7 CYS SG 1 1 25 8031 1 1 8 LEU C C -8.054 -1.894 15.069 1.00 . A A . 8 LEU C 1 1 25 8032 1 1 8 LEU CA C -6.798 -1.585 15.886 1.00 . A A . 8 LEU CA 1 1 25 8033 1 1 8 LEU CB C -6.959 -0.394 16.834 1.00 . A A . 8 LEU CB 1 1 25 8034 1 1 8 LEU CD1 C -8.289 -1.640 18.577 1.00 . A A . 8 LEU CD1 1 1 25 8035 1 1 8 LEU CD2 C -8.318 0.896 18.521 1.00 . A A . 8 LEU CD2 1 1 25 8036 1 1 8 LEU CG C -8.221 -0.390 17.698 1.00 . A A . 8 LEU CG 1 1 25 8037 1 1 8 LEU H H -5.608 -0.447 14.610 1.00 . A A . 8 LEU H 1 1 25 8038 1 1 8 LEU HA H -6.563 -2.455 16.500 1.00 . A A . 8 LEU HA 1 1 25 8039 1 1 8 LEU HB2 H -6.091 -0.361 17.493 1.00 . A A . 8 LEU HB2 1 1 25 8040 1 1 8 LEU HB3 H -6.945 0.520 16.242 1.00 . A A . 8 LEU HB3 1 1 25 8041 1 1 8 LEU HD11 H -7.434 -2.281 18.363 1.00 . A A . 8 LEU HD11 1 1 25 8042 1 1 8 LEU HD12 H -8.270 -1.347 19.627 1.00 . A A . 8 LEU HD12 1 1 25 8043 1 1 8 LEU HD13 H -9.211 -2.182 18.368 1.00 . A A . 8 LEU HD13 1 1 25 8044 1 1 8 LEU HD21 H -7.342 1.130 18.946 1.00 . A A . 8 LEU HD21 1 1 25 8045 1 1 8 LEU HD22 H -8.640 1.716 17.878 1.00 . A A . 8 LEU HD22 1 1 25 8046 1 1 8 LEU HD23 H -9.041 0.760 19.325 1.00 . A A . 8 LEU HD23 1 1 25 8047 1 1 8 LEU HG H -9.089 -0.414 17.036 1.00 . A A . 8 LEU HG 1 1 25 8048 1 1 8 LEU N N -5.679 -1.371 14.986 1.00 . A A . 8 LEU N 1 1 25 8049 1 1 8 LEU O O -8.716 -2.905 15.298 1.00 . A A . 8 LEU O 1 1 25 8050 1 1 9 ALA C C -9.816 0.158 12.580 1.00 . A A . 9 ALA C 1 1 25 8051 1 1 9 ALA CA C -9.510 -1.168 13.279 1.00 . A A . 9 ALA CA 1 1 25 8052 1 1 9 ALA CB C -10.688 -1.672 14.115 1.00 . A A . 9 ALA CB 1 1 25 8053 1 1 9 ALA H H -7.802 -0.183 13.952 1.00 . A A . 9 ALA H 1 1 25 8054 1 1 9 ALA HA H -9.267 -1.918 12.526 1.00 . A A . 9 ALA HA 1 1 25 8055 1 1 9 ALA HB1 H -10.464 -1.541 15.173 1.00 . A A . 9 ALA HB1 1 1 25 8056 1 1 9 ALA HB2 H -11.583 -1.104 13.859 1.00 . A A . 9 ALA HB2 1 1 25 8057 1 1 9 ALA HB3 H -10.855 -2.728 13.906 1.00 . A A . 9 ALA HB3 1 1 25 8058 1 1 9 ALA N N -8.345 -1.003 14.132 1.00 . A A . 9 ALA N 1 1 25 8059 1 1 9 ALA O O -10.116 1.155 13.234 1.00 . A A . 9 ALA O 1 1 25 8060 1 1 10 GLY C C -8.707 2.107 10.218 1.00 . A A . 10 GLY C 1 1 25 8061 1 1 10 GLY CA C -9.992 1.314 10.462 1.00 . A A . 10 GLY CA 1 1 25 8062 1 1 10 GLY H H -9.483 -0.687 10.733 1.00 . A A . 10 GLY H 1 1 25 8063 1 1 10 GLY HA2 H -10.433 1.026 9.508 1.00 . A A . 10 GLY HA2 1 1 25 8064 1 1 10 GLY HA3 H -10.721 1.943 10.973 1.00 . A A . 10 GLY HA3 1 1 25 8065 1 1 10 GLY N N -9.728 0.127 11.257 1.00 . A A . 10 GLY N 1 1 25 8066 1 1 10 GLY O O -8.756 3.256 9.782 1.00 . A A . 10 GLY O 1 1 25 8067 1 1 11 TYR C C -5.382 1.235 9.445 1.00 . A A . 11 TYR C 1 1 25 8068 1 1 11 TYR CA C -6.291 2.093 10.328 1.00 . A A . 11 TYR CA 1 1 25 8069 1 1 11 TYR CB C -5.673 2.199 11.724 1.00 . A A . 11 TYR CB 1 1 25 8070 1 1 11 TYR CD1 C -7.097 4.126 12.510 1.00 . A A . 11 TYR CD1 1 1 25 8071 1 1 11 TYR CD2 C -6.885 2.218 13.934 1.00 . A A . 11 TYR CD2 1 1 25 8072 1 1 11 TYR CE1 C -7.951 4.757 13.482 1.00 . A A . 11 TYR CE1 1 1 25 8073 1 1 11 TYR CE2 C -7.740 2.849 14.907 1.00 . A A . 11 TYR CE2 1 1 25 8074 1 1 11 TYR CG C -6.582 2.870 12.757 1.00 . A A . 11 TYR CG 1 1 25 8075 1 1 11 TYR CZ C -8.231 4.088 14.633 1.00 . A A . 11 TYR CZ 1 1 25 8076 1 1 11 TYR H H -7.556 0.528 10.865 1.00 . A A . 11 TYR H 1 1 25 8077 1 1 11 TYR HA H -6.451 3.056 9.844 1.00 . A A . 11 TYR HA 1 1 25 8078 1 1 11 TYR HB2 H -5.419 1.199 12.074 1.00 . A A . 11 TYR HB2 1 1 25 8079 1 1 11 TYR HB3 H -4.741 2.761 11.656 1.00 . A A . 11 TYR HB3 1 1 25 8080 1 1 11 TYR HD1 H -6.857 4.641 11.580 1.00 . A A . 11 TYR HD1 1 1 25 8081 1 1 11 TYR HD2 H -6.478 1.226 14.130 1.00 . A A . 11 TYR HD2 1 1 25 8082 1 1 11 TYR HE1 H -8.365 5.748 13.300 1.00 . A A . 11 TYR HE1 1 1 25 8083 1 1 11 TYR HE2 H -7.987 2.346 15.842 1.00 . A A . 11 TYR HE2 1 1 25 8084 1 1 11 TYR HH H -8.509 4.930 16.363 1.00 . A A . 11 TYR HH 1 1 25 8085 1 1 11 TYR N N -7.587 1.463 10.510 1.00 . A A . 11 TYR N 1 1 25 8086 1 1 11 TYR O O -5.488 0.009 9.446 1.00 . A A . 11 TYR O 1 1 25 8087 1 1 11 TYR OH O -9.037 4.684 15.551 1.00 . A A . 11 TYR OH 1 1 25 8088 1 1 12 MET C C -2.134 1.495 8.237 1.00 . A A . 12 MET C 1 1 25 8089 1 1 12 MET CA C -3.584 1.228 7.828 1.00 . A A . 12 MET CA 1 1 25 8090 1 1 12 MET CB C -3.805 1.702 6.391 1.00 . A A . 12 MET CB 1 1 25 8091 1 1 12 MET CE C -3.978 5.603 5.045 1.00 . A A . 12 MET CE 1 1 25 8092 1 1 12 MET CG C -4.107 3.201 6.349 1.00 . A A . 12 MET CG 1 1 25 8093 1 1 12 MET H H -4.431 2.910 8.719 1.00 . A A . 12 MET H 1 1 25 8094 1 1 12 MET HA H -3.809 0.166 7.934 1.00 . A A . 12 MET HA 1 1 25 8095 1 1 12 MET HB2 H -2.920 1.490 5.793 1.00 . A A . 12 MET HB2 1 1 25 8096 1 1 12 MET HB3 H -4.632 1.149 5.944 1.00 . A A . 12 MET HB3 1 1 25 8097 1 1 12 MET HE1 H -3.840 5.825 6.104 1.00 . A A . 12 MET HE1 1 1 25 8098 1 1 12 MET HE2 H -3.286 6.203 4.455 1.00 . A A . 12 MET HE2 1 1 25 8099 1 1 12 MET HE3 H -5.003 5.838 4.755 1.00 . A A . 12 MET HE3 1 1 25 8100 1 1 12 MET HG2 H -5.166 3.374 6.541 1.00 . A A . 12 MET HG2 1 1 25 8101 1 1 12 MET HG3 H -3.553 3.715 7.135 1.00 . A A . 12 MET HG3 1 1 25 8102 1 1 12 MET N N -4.510 1.913 8.714 1.00 . A A . 12 MET N 1 1 25 8103 1 1 12 MET O O -1.847 2.490 8.902 1.00 . A A . 12 MET O 1 1 25 8104 1 1 12 MET SD S -3.661 3.870 4.755 1.00 . A A . 12 MET SD 1 1 25 8105 1 1 13 ARG C C 0.892 1.415 6.990 1.00 . A A . 13 ARG C 1 1 25 8106 1 1 13 ARG CA C 0.154 0.719 8.136 1.00 . A A . 13 ARG CA 1 1 25 8107 1 1 13 ARG CB C 0.788 -0.651 8.384 1.00 . A A . 13 ARG CB 1 1 25 8108 1 1 13 ARG CD C 1.306 -1.586 10.669 1.00 . A A . 13 ARG CD 1 1 25 8109 1 1 13 ARG CG C 0.208 -1.303 9.641 1.00 . A A . 13 ARG CG 1 1 25 8110 1 1 13 ARG CZ C 2.017 -3.539 12.042 1.00 . A A . 13 ARG CZ 1 1 25 8111 1 1 13 ARG H H -1.501 -0.213 7.281 1.00 . A A . 13 ARG H 1 1 25 8112 1 1 13 ARG HA H 0.184 1.321 9.044 1.00 . A A . 13 ARG HA 1 1 25 8113 1 1 13 ARG HB2 H 0.618 -1.296 7.523 1.00 . A A . 13 ARG HB2 1 1 25 8114 1 1 13 ARG HB3 H 1.868 -0.542 8.492 1.00 . A A . 13 ARG HB3 1 1 25 8115 1 1 13 ARG HD2 H 2.286 -1.512 10.196 1.00 . A A . 13 ARG HD2 1 1 25 8116 1 1 13 ARG HD3 H 1.277 -0.836 11.460 1.00 . A A . 13 ARG HD3 1 1 25 8117 1 1 13 ARG HE H 0.282 -3.429 11.028 1.00 . A A . 13 ARG HE 1 1 25 8118 1 1 13 ARG HG2 H -0.546 -0.650 10.079 1.00 . A A . 13 ARG HG2 1 1 25 8119 1 1 13 ARG HG3 H -0.292 -2.234 9.374 1.00 . A A . 13 ARG HG3 1 1 25 8120 1 1 13 ARG HH11 H 3.346 -2.001 12.004 1.00 . A A . 13 ARG HH11 1 1 25 8121 1 1 13 ARG HH12 H 3.826 -3.366 12.955 1.00 . A A . 13 ARG HH12 1 1 25 8122 1 1 13 ARG HH21 H 0.915 -5.232 12.282 1.00 . A A . 13 ARG HH21 1 1 25 8123 1 1 13 ARG HH22 H 2.434 -5.217 13.114 1.00 . A A . 13 ARG HH22 1 1 25 8124 1 1 13 ARG N N -1.259 0.592 7.821 1.00 . A A . 13 ARG N 1 1 25 8125 1 1 13 ARG NE N 1.124 -2.936 11.246 1.00 . A A . 13 ARG NE 1 1 25 8126 1 1 13 ARG NH1 N 3.160 -2.916 12.361 1.00 . A A . 13 ARG NH1 1 1 25 8127 1 1 13 ARG NH2 N 1.767 -4.766 12.520 1.00 . A A . 13 ARG NH2 1 1 25 8128 1 1 13 ARG O O 1.178 0.797 5.966 1.00 . A A . 13 ARG O 1 1 25 8129 1 1 14 THR C C 3.237 2.850 5.885 1.00 . A A . 14 THR C 1 1 25 8130 1 1 14 THR CA C 1.878 3.477 6.202 1.00 . A A . 14 THR CA 1 1 25 8131 1 1 14 THR CB C 1.978 4.915 6.715 1.00 . A A . 14 THR CB 1 1 25 8132 1 1 14 THR CG2 C 0.669 5.407 7.336 1.00 . A A . 14 THR CG2 1 1 25 8133 1 1 14 THR H H 0.943 3.185 8.040 1.00 . A A . 14 THR H 1 1 25 8134 1 1 14 THR HA H 1.295 3.459 5.282 1.00 . A A . 14 THR HA 1 1 25 8135 1 1 14 THR HB H 2.311 5.588 5.925 1.00 . A A . 14 THR HB 1 1 25 8136 1 1 14 THR HG1 H 3.339 5.704 7.951 1.00 . A A . 14 THR HG1 1 1 25 8137 1 1 14 THR HG21 H -0.120 4.678 7.148 1.00 . A A . 14 THR HG21 1 1 25 8138 1 1 14 THR HG22 H 0.800 5.529 8.411 1.00 . A A . 14 THR HG22 1 1 25 8139 1 1 14 THR HG23 H 0.393 6.363 6.893 1.00 . A A . 14 THR HG23 1 1 25 8140 1 1 14 THR N N 1.179 2.691 7.204 1.00 . A A . 14 THR N 1 1 25 8141 1 1 14 THR O O 3.418 1.643 6.034 1.00 . A A . 14 THR O 1 1 25 8142 1 1 14 THR OG1 O 2.875 4.829 7.819 1.00 . A A . 14 THR OG1 1 1 25 8143 1 1 15 ALA C C 6.443 3.542 6.277 1.00 . A A . 15 ALA C 1 1 25 8144 1 1 15 ALA CA C 5.496 3.244 5.113 1.00 . A A . 15 ALA CA 1 1 25 8145 1 1 15 ALA CB C 5.946 3.907 3.810 1.00 . A A . 15 ALA CB 1 1 25 8146 1 1 15 ALA H H 4.003 4.680 5.333 1.00 . A A . 15 ALA H 1 1 25 8147 1 1 15 ALA HA H 5.450 2.165 4.960 1.00 . A A . 15 ALA HA 1 1 25 8148 1 1 15 ALA HB1 H 5.160 3.809 3.061 1.00 . A A . 15 ALA HB1 1 1 25 8149 1 1 15 ALA HB2 H 6.145 4.963 3.991 1.00 . A A . 15 ALA HB2 1 1 25 8150 1 1 15 ALA HB3 H 6.853 3.421 3.450 1.00 . A A . 15 ALA HB3 1 1 25 8151 1 1 15 ALA N N 4.158 3.699 5.453 1.00 . A A . 15 ALA N 1 1 25 8152 1 1 15 ALA O O 7.657 3.399 6.146 1.00 . A A . 15 ALA O 1 1 25 8153 1 1 16 ASP C C 6.293 3.268 9.683 1.00 . A A . 16 ASP C 1 1 25 8154 1 1 16 ASP CA C 6.626 4.270 8.576 1.00 . A A . 16 ASP CA 1 1 25 8155 1 1 16 ASP CB C 6.292 5.672 9.091 1.00 . A A . 16 ASP CB 1 1 25 8156 1 1 16 ASP CG C 7.156 6.155 10.258 1.00 . A A . 16 ASP CG 1 1 25 8157 1 1 16 ASP H H 4.862 4.064 7.488 1.00 . A A . 16 ASP H 1 1 25 8158 1 1 16 ASP HA H 7.668 4.213 8.261 1.00 . A A . 16 ASP HA 1 1 25 8159 1 1 16 ASP HB2 H 6.392 6.379 8.267 1.00 . A A . 16 ASP HB2 1 1 25 8160 1 1 16 ASP HB3 H 5.247 5.689 9.401 1.00 . A A . 16 ASP HB3 1 1 25 8161 1 1 16 ASP N N 5.851 3.951 7.389 1.00 . A A . 16 ASP N 1 1 25 8162 1 1 16 ASP O O 7.041 3.135 10.650 1.00 . A A . 16 ASP O 1 1 25 8163 1 1 16 ASP OD1 O 8.109 5.421 10.600 1.00 . A A . 16 ASP OD1 1 1 25 8164 1 1 16 ASP OD2 O 6.845 7.246 10.781 1.00 . A A . 16 ASP OD2 1 1 25 8165 1 1 17 GLY C C 3.680 2.188 11.417 1.00 . A A . 17 GLY C 1 1 25 8166 1 1 17 GLY CA C 4.731 1.600 10.474 1.00 . A A . 17 GLY CA 1 1 25 8167 1 1 17 GLY H H 4.568 2.702 8.714 1.00 . A A . 17 GLY H 1 1 25 8168 1 1 17 GLY HA2 H 4.317 0.736 9.956 1.00 . A A . 17 GLY HA2 1 1 25 8169 1 1 17 GLY HA3 H 5.585 1.247 11.051 1.00 . A A . 17 GLY HA3 1 1 25 8170 1 1 17 GLY N N 5.171 2.588 9.504 1.00 . A A . 17 GLY N 1 1 25 8171 1 1 17 GLY O O 3.233 1.521 12.348 1.00 . A A . 17 GLY O 1 1 25 8172 1 1 18 ARG C C 0.917 3.816 11.444 1.00 . A A . 18 ARG C 1 1 25 8173 1 1 18 ARG CA C 2.327 4.119 11.955 1.00 . A A . 18 ARG CA 1 1 25 8174 1 1 18 ARG CB C 2.553 5.632 11.938 1.00 . A A . 18 ARG CB 1 1 25 8175 1 1 18 ARG CD C 2.923 7.493 10.276 1.00 . A A . 18 ARG CD 1 1 25 8176 1 1 18 ARG CG C 2.111 6.238 10.604 1.00 . A A . 18 ARG CG 1 1 25 8177 1 1 18 ARG CZ C 2.902 9.107 8.378 1.00 . A A . 18 ARG CZ 1 1 25 8178 1 1 18 ARG H H 3.685 3.969 10.383 1.00 . A A . 18 ARG H 1 1 25 8179 1 1 18 ARG HA H 2.472 3.726 12.962 1.00 . A A . 18 ARG HA 1 1 25 8180 1 1 18 ARG HB2 H 1.999 6.096 12.754 1.00 . A A . 18 ARG HB2 1 1 25 8181 1 1 18 ARG HB3 H 3.608 5.847 12.107 1.00 . A A . 18 ARG HB3 1 1 25 8182 1 1 18 ARG HD2 H 3.014 8.119 11.164 1.00 . A A . 18 ARG HD2 1 1 25 8183 1 1 18 ARG HD3 H 3.933 7.215 9.978 1.00 . A A . 18 ARG HD3 1 1 25 8184 1 1 18 ARG HE H 1.284 8.115 9.049 1.00 . A A . 18 ARG HE 1 1 25 8185 1 1 18 ARG HG2 H 2.234 5.503 9.809 1.00 . A A . 18 ARG HG2 1 1 25 8186 1 1 18 ARG HG3 H 1.051 6.487 10.648 1.00 . A A . 18 ARG HG3 1 1 25 8187 1 1 18 ARG HH11 H 4.722 8.840 9.245 1.00 . A A . 18 ARG HH11 1 1 25 8188 1 1 18 ARG HH12 H 4.691 9.959 7.924 1.00 . A A . 18 ARG HH12 1 1 25 8189 1 1 18 ARG HH21 H 1.243 9.592 7.306 1.00 . A A . 18 ARG HH21 1 1 25 8190 1 1 18 ARG HH22 H 2.699 10.390 6.813 1.00 . A A . 18 ARG HH22 1 1 25 8191 1 1 18 ARG N N 3.317 3.432 11.143 1.00 . A A . 18 ARG N 1 1 25 8192 1 1 18 ARG NE N 2.265 8.250 9.189 1.00 . A A . 18 ARG NE 1 1 25 8193 1 1 18 ARG NH1 N 4.216 9.320 8.528 1.00 . A A . 18 ARG NH1 1 1 25 8194 1 1 18 ARG NH2 N 2.224 9.751 7.418 1.00 . A A . 18 ARG NH2 1 1 25 8195 1 1 18 ARG O O 0.579 4.151 10.309 1.00 . A A . 18 ARG O 1 1 25 8196 1 1 19 CYS C C -2.048 4.120 11.835 1.00 . A A . 19 CYS C 1 1 25 8197 1 1 19 CYS CA C -1.232 2.831 11.953 1.00 . A A . 19 CYS CA 1 1 25 8198 1 1 19 CYS CB C -1.843 1.859 12.966 1.00 . A A . 19 CYS CB 1 1 25 8199 1 1 19 CYS H H 0.415 2.916 13.226 1.00 . A A . 19 CYS H 1 1 25 8200 1 1 19 CYS HA H -1.185 2.314 10.996 1.00 . A A . 19 CYS HA 1 1 25 8201 1 1 19 CYS HB2 H -1.578 2.189 13.970 1.00 . A A . 19 CYS HB2 1 1 25 8202 1 1 19 CYS HB3 H -2.929 1.914 12.889 1.00 . A A . 19 CYS HB3 1 1 25 8203 1 1 19 CYS N N 0.132 3.185 12.305 1.00 . A A . 19 CYS N 1 1 25 8204 1 1 19 CYS O O -2.470 4.685 12.842 1.00 . A A . 19 CYS O 1 1 25 8205 1 1 19 CYS SG S -1.327 0.115 12.765 1.00 . A A . 19 CYS SG 1 1 25 8206 1 1 20 LYS C C -4.401 5.387 9.844 1.00 . A A . 20 LYS C 1 1 25 8207 1 1 20 LYS CA C -3.001 5.760 10.334 1.00 . A A . 20 LYS CA 1 1 25 8208 1 1 20 LYS CB C -2.235 6.672 9.373 1.00 . A A . 20 LYS CB 1 1 25 8209 1 1 20 LYS CD C -1.987 9.151 9.764 1.00 . A A . 20 LYS CD 1 1 25 8210 1 1 20 LYS CE C -0.908 10.211 9.993 1.00 . A A . 20 LYS CE 1 1 25 8211 1 1 20 LYS CG C -1.475 7.758 10.137 1.00 . A A . 20 LYS CG 1 1 25 8212 1 1 20 LYS H H -1.897 4.082 9.782 1.00 . A A . 20 LYS H 1 1 25 8213 1 1 20 LYS HA H -3.097 6.296 11.279 1.00 . A A . 20 LYS HA 1 1 25 8214 1 1 20 LYS HB2 H -1.536 6.080 8.783 1.00 . A A . 20 LYS HB2 1 1 25 8215 1 1 20 LYS HB3 H -2.931 7.134 8.673 1.00 . A A . 20 LYS HB3 1 1 25 8216 1 1 20 LYS HD2 H -2.296 9.161 8.719 1.00 . A A . 20 LYS HD2 1 1 25 8217 1 1 20 LYS HD3 H -2.868 9.390 10.360 1.00 . A A . 20 LYS HD3 1 1 25 8218 1 1 20 LYS HE2 H -0.559 10.167 11.024 1.00 . A A . 20 LYS HE2 1 1 25 8219 1 1 20 LYS HE3 H -0.047 10.006 9.356 1.00 . A A . 20 LYS HE3 1 1 25 8220 1 1 20 LYS HG2 H -1.587 7.600 11.209 1.00 . A A . 20 LYS HG2 1 1 25 8221 1 1 20 LYS HG3 H -0.410 7.687 9.914 1.00 . A A . 20 LYS HG3 1 1 25 8222 1 1 20 LYS HZ1 H -2.315 11.684 10.165 1.00 . A A . 20 LYS HZ1 1 1 25 8223 1 1 20 LYS HZ2 H -0.790 12.252 10.025 1.00 . A A . 20 LYS HZ2 1 1 25 8224 1 1 20 LYS HZ3 H -1.567 11.663 8.714 1.00 . A A . 20 LYS HZ3 1 1 25 8225 1 1 20 LYS N N -2.244 4.548 10.596 1.00 . A A . 20 LYS N 1 1 25 8226 1 1 20 LYS NZ N -1.438 11.562 9.700 1.00 . A A . 20 LYS NZ 1 1 25 8227 1 1 20 LYS O O -4.657 4.232 9.508 1.00 . A A . 20 LYS O 1 1 25 8228 1 1 21 PRO C C -6.727 6.061 7.850 1.00 . A A . 21 PRO C 1 1 25 8229 1 1 21 PRO CA C -6.661 6.204 9.371 1.00 . A A . 21 PRO CA 1 1 25 8230 1 1 21 PRO CB C -7.431 7.407 9.889 1.00 . A A . 21 PRO CB 1 1 25 8231 1 1 21 PRO CD C -5.026 7.794 10.208 1.00 . A A . 21 PRO CD 1 1 25 8232 1 1 21 PRO CG C -6.388 8.468 10.200 1.00 . A A . 21 PRO CG 1 1 25 8233 1 1 21 PRO HA H -7.019 5.347 9.742 1.00 . A A . 21 PRO HA 1 1 25 8234 1 1 21 PRO HB2 H -8.142 7.766 9.144 1.00 . A A . 21 PRO HB2 1 1 25 8235 1 1 21 PRO HB3 H -8.005 7.151 10.779 1.00 . A A . 21 PRO HB3 1 1 25 8236 1 1 21 PRO HD2 H -4.340 8.277 9.510 1.00 . A A . 21 PRO HD2 1 1 25 8237 1 1 21 PRO HD3 H -4.565 7.845 11.193 1.00 . A A . 21 PRO HD3 1 1 25 8238 1 1 21 PRO HG2 H -6.417 9.262 9.453 1.00 . A A . 21 PRO HG2 1 1 25 8239 1 1 21 PRO HG3 H -6.590 8.932 11.165 1.00 . A A . 21 PRO HG3 1 1 25 8240 1 1 21 PRO N N -5.294 6.412 9.817 1.00 . A A . 21 PRO N 1 1 25 8241 1 1 21 PRO O O -5.990 6.731 7.127 1.00 . A A . 21 PRO O 1 1 25 8242 1 1 22 THR C C -8.689 6.013 5.369 1.00 . A A . 22 THR C 1 1 25 8243 1 1 22 THR CA C -7.785 4.943 5.985 1.00 . A A . 22 THR CA 1 1 25 8244 1 1 22 THR CB C -8.320 3.520 5.806 1.00 . A A . 22 THR CB 1 1 25 8245 1 1 22 THR CG2 C -7.858 2.882 4.495 1.00 . A A . 22 THR CG2 1 1 25 8246 1 1 22 THR H H -8.209 4.641 8.002 1.00 . A A . 22 THR H 1 1 25 8247 1 1 22 THR HA H -6.812 5.030 5.502 1.00 . A A . 22 THR HA 1 1 25 8248 1 1 22 THR HB H -9.406 3.500 5.887 1.00 . A A . 22 THR HB 1 1 25 8249 1 1 22 THR HG1 H -8.123 1.901 6.965 1.00 . A A . 22 THR HG1 1 1 25 8250 1 1 22 THR HG21 H -7.010 3.441 4.097 1.00 . A A . 22 THR HG21 1 1 25 8251 1 1 22 THR HG22 H -7.557 1.850 4.679 1.00 . A A . 22 THR HG22 1 1 25 8252 1 1 22 THR HG23 H -8.675 2.899 3.774 1.00 . A A . 22 THR HG23 1 1 25 8253 1 1 22 THR N N -7.615 5.183 7.408 1.00 . A A . 22 THR N 1 1 25 8254 1 1 22 THR O O -9.057 5.922 4.199 1.00 . A A . 22 THR O 1 1 25 8255 1 1 22 THR OG1 O -7.650 2.768 6.814 1.00 . A A . 22 THR OG1 1 1 25 8256 1 1 23 PHE C C -9.122 9.421 5.750 1.00 . A A . 23 PHE C 1 1 25 8257 1 1 23 PHE CA C -9.875 8.090 5.734 1.00 . A A . 23 PHE CA 1 1 25 8258 1 1 23 PHE CB C -11.049 8.170 6.711 1.00 . A A . 23 PHE CB 1 1 25 8259 1 1 23 PHE CD1 C -10.068 9.503 8.590 1.00 . A A . 23 PHE CD1 1 1 25 8260 1 1 23 PHE CD2 C -10.826 7.322 9.057 1.00 . A A . 23 PHE CD2 1 1 25 8261 1 1 23 PHE CE1 C -9.681 9.660 9.947 1.00 . A A . 23 PHE CE1 1 1 25 8262 1 1 23 PHE CE2 C -10.439 7.478 10.415 1.00 . A A . 23 PHE CE2 1 1 25 8263 1 1 23 PHE CG C -10.632 8.338 8.173 1.00 . A A . 23 PHE CG 1 1 25 8264 1 1 23 PHE CZ C -9.875 8.644 10.831 1.00 . A A . 23 PHE CZ 1 1 25 8265 1 1 23 PHE H H -8.719 7.070 7.135 1.00 . A A . 23 PHE H 1 1 25 8266 1 1 23 PHE HA H -10.180 7.859 4.714 1.00 . A A . 23 PHE HA 1 1 25 8267 1 1 23 PHE HB2 H -11.689 9.006 6.427 1.00 . A A . 23 PHE HB2 1 1 25 8268 1 1 23 PHE HB3 H -11.650 7.264 6.617 1.00 . A A . 23 PHE HB3 1 1 25 8269 1 1 23 PHE HD1 H -9.913 10.317 7.882 1.00 . A A . 23 PHE HD1 1 1 25 8270 1 1 23 PHE HD2 H -11.278 6.388 8.723 1.00 . A A . 23 PHE HD2 1 1 25 8271 1 1 23 PHE HE1 H -9.230 10.593 10.281 1.00 . A A . 23 PHE HE1 1 1 25 8272 1 1 23 PHE HE2 H -10.594 6.665 11.123 1.00 . A A . 23 PHE HE2 1 1 25 8273 1 1 23 PHE HZ H -9.578 8.764 11.872 1.00 . A A . 23 PHE HZ 1 1 25 8274 1 1 23 PHE N N -9.022 7.003 6.185 1.00 . A A . 23 PHE N 1 1 25 8275 1 1 23 PHE O O -8.665 9.892 4.711 1.00 . A A . 23 PHE O 1 1 26 8276 1 1 1 GLU C C -6.557 -11.981 13.856 1.00 . A A . 1 GLU C 1 1 26 8277 1 1 1 GLU CA C -6.919 -13.276 14.585 1.00 . A A . 1 GLU CA 1 1 26 8278 1 1 1 GLU CB C -5.679 -14.144 14.808 1.00 . A A . 1 GLU CB 1 1 26 8279 1 1 1 GLU CD C -5.165 -16.323 15.970 1.00 . A A . 1 GLU CD 1 1 26 8280 1 1 1 GLU CG C -5.790 -14.934 16.114 1.00 . A A . 1 GLU CG 1 1 26 8281 1 1 1 GLU HA H -7.370 -13.043 15.550 1.00 . A A . 1 GLU HA 1 1 26 8282 1 1 1 GLU HB2 H -5.557 -14.832 13.972 1.00 . A A . 1 GLU HB2 1 1 26 8283 1 1 1 GLU HB3 H -4.789 -13.515 14.835 1.00 . A A . 1 GLU HB3 1 1 26 8284 1 1 1 GLU HG2 H -5.293 -14.389 16.916 1.00 . A A . 1 GLU HG2 1 1 26 8285 1 1 1 GLU HG3 H -6.838 -15.030 16.397 1.00 . A A . 1 GLU HG3 1 1 26 8286 1 1 1 GLU N N -7.937 -14.003 13.847 1.00 . A A . 1 GLU N 1 1 26 8287 1 1 1 GLU O O -5.599 -11.945 13.084 1.00 . A A . 1 GLU O 1 1 26 8288 1 1 1 GLU OE1 O -4.116 -16.406 15.296 1.00 . A A . 1 GLU OE1 1 1 26 8289 1 1 1 GLU OE2 O -5.751 -17.271 16.537 1.00 . A A . 1 GLU OE2 1 1 26 8290 1 1 2 ASN C C -5.656 -9.245 13.702 1.00 . A A . 2 ASN C 1 1 26 8291 1 1 2 ASN CA C -7.117 -9.654 13.503 1.00 . A A . 2 ASN CA 1 1 26 8292 1 1 2 ASN CB C -8.000 -8.577 14.138 1.00 . A A . 2 ASN CB 1 1 26 8293 1 1 2 ASN CG C -7.924 -8.636 15.665 1.00 . A A . 2 ASN CG 1 1 26 8294 1 1 2 ASN H H -8.118 -10.986 14.754 1.00 . A A . 2 ASN H 1 1 26 8295 1 1 2 ASN HA H -7.372 -9.792 12.454 1.00 . A A . 2 ASN HA 1 1 26 8296 1 1 2 ASN HB2 H -7.684 -7.593 13.792 1.00 . A A . 2 ASN HB2 1 1 26 8297 1 1 2 ASN HB3 H -9.033 -8.712 13.816 1.00 . A A . 2 ASN HB3 1 1 26 8298 1 1 2 ASN HD21 H -6.694 -7.029 15.619 1.00 . A A . 2 ASN HD21 1 1 26 8299 1 1 2 ASN HD22 H -7.044 -7.648 17.198 1.00 . A A . 2 ASN HD22 1 1 26 8300 1 1 2 ASN N N -7.342 -10.948 14.125 1.00 . A A . 2 ASN N 1 1 26 8301 1 1 2 ASN ND2 N -7.157 -7.693 16.205 1.00 . A A . 2 ASN ND2 1 1 26 8302 1 1 2 ASN O O -5.127 -9.335 14.809 1.00 . A A . 2 ASN O 1 1 26 8303 1 1 2 ASN OD1 O -8.522 -9.482 16.310 1.00 . A A . 2 ASN OD1 1 1 26 8304 1 1 3 PHE C C -3.224 -7.788 11.309 1.00 . A A . 3 PHE C 1 1 26 8305 1 1 3 PHE CA C -3.656 -8.381 12.652 1.00 . A A . 3 PHE CA 1 1 26 8306 1 1 3 PHE CB C -2.817 -9.629 12.938 1.00 . A A . 3 PHE CB 1 1 26 8307 1 1 3 PHE CD1 C -1.188 -8.822 14.661 1.00 . A A . 3 PHE CD1 1 1 26 8308 1 1 3 PHE CD2 C -0.336 -9.561 12.593 1.00 . A A . 3 PHE CD2 1 1 26 8309 1 1 3 PHE CE1 C 0.131 -8.541 15.103 1.00 . A A . 3 PHE CE1 1 1 26 8310 1 1 3 PHE CE2 C 0.983 -9.280 13.034 1.00 . A A . 3 PHE CE2 1 1 26 8311 1 1 3 PHE CG C -1.394 -9.326 13.415 1.00 . A A . 3 PHE CG 1 1 26 8312 1 1 3 PHE CZ C 1.190 -8.776 14.281 1.00 . A A . 3 PHE CZ 1 1 26 8313 1 1 3 PHE H H -5.482 -8.735 11.715 1.00 . A A . 3 PHE H 1 1 26 8314 1 1 3 PHE HA H -3.571 -7.620 13.427 1.00 . A A . 3 PHE HA 1 1 26 8315 1 1 3 PHE HB2 H -3.322 -10.229 13.694 1.00 . A A . 3 PHE HB2 1 1 26 8316 1 1 3 PHE HB3 H -2.764 -10.234 12.033 1.00 . A A . 3 PHE HB3 1 1 26 8317 1 1 3 PHE HD1 H -2.035 -8.633 15.319 1.00 . A A . 3 PHE HD1 1 1 26 8318 1 1 3 PHE HD2 H -0.502 -9.965 11.593 1.00 . A A . 3 PHE HD2 1 1 26 8319 1 1 3 PHE HE1 H 0.297 -8.136 16.102 1.00 . A A . 3 PHE HE1 1 1 26 8320 1 1 3 PHE HE2 H 1.830 -9.468 12.376 1.00 . A A . 3 PHE HE2 1 1 26 8321 1 1 3 PHE HZ H 2.203 -8.560 14.621 1.00 . A A . 3 PHE HZ 1 1 26 8322 1 1 3 PHE N N -5.045 -8.805 12.611 1.00 . A A . 3 PHE N 1 1 26 8323 1 1 3 PHE O O -3.413 -8.407 10.264 1.00 . A A . 3 PHE O 1 1 26 8324 1 1 4 ASN C C -1.049 -4.963 10.553 1.00 . A A . 4 ASN C 1 1 26 8325 1 1 4 ASN CA C -2.193 -5.910 10.186 1.00 . A A . 4 ASN CA 1 1 26 8326 1 1 4 ASN CB C -3.315 -5.077 9.563 1.00 . A A . 4 ASN CB 1 1 26 8327 1 1 4 ASN CG C -2.821 -4.335 8.320 1.00 . A A . 4 ASN CG 1 1 26 8328 1 1 4 ASN H H -2.503 -6.098 12.237 1.00 . A A . 4 ASN H 1 1 26 8329 1 1 4 ASN HA H -1.878 -6.702 9.506 1.00 . A A . 4 ASN HA 1 1 26 8330 1 1 4 ASN HB2 H -4.149 -5.726 9.296 1.00 . A A . 4 ASN HB2 1 1 26 8331 1 1 4 ASN HB3 H -3.690 -4.360 10.293 1.00 . A A . 4 ASN HB3 1 1 26 8332 1 1 4 ASN HD21 H -3.363 -2.595 9.200 1.00 . A A . 4 ASN HD21 1 1 26 8333 1 1 4 ASN HD22 H -2.669 -2.441 7.622 1.00 . A A . 4 ASN HD22 1 1 26 8334 1 1 4 ASN N N -2.653 -6.595 11.383 1.00 . A A . 4 ASN N 1 1 26 8335 1 1 4 ASN ND2 N -2.963 -3.014 8.386 1.00 . A A . 4 ASN ND2 1 1 26 8336 1 1 4 ASN O O -1.038 -3.806 10.136 1.00 . A A . 4 ASN O 1 1 26 8337 1 1 4 ASN OD1 O -2.342 -4.923 7.364 1.00 . A A . 4 ASN OD1 1 1 26 8338 1 1 5 GLY C C 0.908 -4.312 13.231 1.00 . A A . 5 GLY C 1 1 26 8339 1 1 5 GLY CA C 1.032 -4.706 11.758 1.00 . A A . 5 GLY CA 1 1 26 8340 1 1 5 GLY H H -0.130 -6.432 11.665 1.00 . A A . 5 GLY H 1 1 26 8341 1 1 5 GLY HA2 H 1.946 -5.280 11.608 1.00 . A A . 5 GLY HA2 1 1 26 8342 1 1 5 GLY HA3 H 1.114 -3.809 11.144 1.00 . A A . 5 GLY HA3 1 1 26 8343 1 1 5 GLY N N -0.113 -5.490 11.330 1.00 . A A . 5 GLY N 1 1 26 8344 1 1 5 GLY O O 1.898 -4.301 13.960 1.00 . A A . 5 GLY O 1 1 26 8345 1 1 6 GLY C C -1.492 -2.373 15.050 1.00 . A A . 6 GLY C 1 1 26 8346 1 1 6 GLY CA C -0.584 -3.604 14.999 1.00 . A A . 6 GLY CA 1 1 26 8347 1 1 6 GLY H H -1.118 -4.009 13.025 1.00 . A A . 6 GLY H 1 1 26 8348 1 1 6 GLY HA2 H -1.054 -4.430 15.532 1.00 . A A . 6 GLY HA2 1 1 26 8349 1 1 6 GLY HA3 H 0.355 -3.389 15.508 1.00 . A A . 6 GLY HA3 1 1 26 8350 1 1 6 GLY N N -0.318 -3.998 13.625 1.00 . A A . 6 GLY N 1 1 26 8351 1 1 6 GLY O O -1.170 -1.388 15.709 1.00 . A A . 6 GLY O 1 1 26 8352 1 1 7 CYS C C -4.758 -1.750 15.183 1.00 . A A . 7 CYS C 1 1 26 8353 1 1 7 CYS CA C -3.565 -1.378 14.301 1.00 . A A . 7 CYS CA 1 1 26 8354 1 1 7 CYS CB C -3.994 -1.059 12.867 1.00 . A A . 7 CYS CB 1 1 26 8355 1 1 7 CYS H H -2.863 -3.278 13.809 1.00 . A A . 7 CYS H 1 1 26 8356 1 1 7 CYS HA H -3.054 -0.500 14.690 1.00 . A A . 7 CYS HA 1 1 26 8357 1 1 7 CYS HB2 H -4.359 -1.972 12.399 1.00 . A A . 7 CYS HB2 1 1 26 8358 1 1 7 CYS HB3 H -4.831 -0.362 12.900 1.00 . A A . 7 CYS HB3 1 1 26 8359 1 1 7 CYS N N -2.609 -2.472 14.343 1.00 . A A . 7 CYS N 1 1 26 8360 1 1 7 CYS O O -4.763 -2.804 15.817 1.00 . A A . 7 CYS O 1 1 26 8361 1 1 7 CYS SG S -2.679 -0.344 11.814 1.00 . A A . 7 CYS SG 1 1 26 8362 1 1 8 LEU C C -7.982 -1.812 15.143 1.00 . A A . 8 LEU C 1 1 26 8363 1 1 8 LEU CA C -6.938 -1.082 15.992 1.00 . A A . 8 LEU CA 1 1 26 8364 1 1 8 LEU CB C -7.440 0.236 16.582 1.00 . A A . 8 LEU CB 1 1 26 8365 1 1 8 LEU CD1 C -8.738 -0.793 18.484 1.00 . A A . 8 LEU CD1 1 1 26 8366 1 1 8 LEU CD2 C -9.241 1.576 17.731 1.00 . A A . 8 LEU CD2 1 1 26 8367 1 1 8 LEU CG C -8.788 0.179 17.304 1.00 . A A . 8 LEU CG 1 1 26 8368 1 1 8 LEU H H -5.731 -0.007 14.678 1.00 . A A . 8 LEU H 1 1 26 8369 1 1 8 LEU HA H -6.661 -1.725 16.827 1.00 . A A . 8 LEU HA 1 1 26 8370 1 1 8 LEU HB2 H -6.691 0.606 17.284 1.00 . A A . 8 LEU HB2 1 1 26 8371 1 1 8 LEU HB3 H -7.511 0.968 15.778 1.00 . A A . 8 LEU HB3 1 1 26 8372 1 1 8 LEU HD11 H -7.841 -1.409 18.409 1.00 . A A . 8 LEU HD11 1 1 26 8373 1 1 8 LEU HD12 H -8.715 -0.230 19.417 1.00 . A A . 8 LEU HD12 1 1 26 8374 1 1 8 LEU HD13 H -9.620 -1.432 18.466 1.00 . A A . 8 LEU HD13 1 1 26 8375 1 1 8 LEU HD21 H -8.399 2.116 18.162 1.00 . A A . 8 LEU HD21 1 1 26 8376 1 1 8 LEU HD22 H -9.614 2.119 16.863 1.00 . A A . 8 LEU HD22 1 1 26 8377 1 1 8 LEU HD23 H -10.035 1.489 18.473 1.00 . A A . 8 LEU HD23 1 1 26 8378 1 1 8 LEU HG H -9.533 -0.201 16.605 1.00 . A A . 8 LEU HG 1 1 26 8379 1 1 8 LEU N N -5.742 -0.861 15.197 1.00 . A A . 8 LEU N 1 1 26 8380 1 1 8 LEU O O -8.471 -2.873 15.531 1.00 . A A . 8 LEU O 1 1 26 8381 1 1 9 ALA C C -9.747 -0.724 12.114 1.00 . A A . 9 ALA C 1 1 26 8382 1 1 9 ALA CA C -9.269 -1.795 13.095 1.00 . A A . 9 ALA CA 1 1 26 8383 1 1 9 ALA CB C -10.418 -2.401 13.903 1.00 . A A . 9 ALA CB 1 1 26 8384 1 1 9 ALA H H -7.890 -0.353 13.695 1.00 . A A . 9 ALA H 1 1 26 8385 1 1 9 ALA HA H -8.773 -2.590 12.538 1.00 . A A . 9 ALA HA 1 1 26 8386 1 1 9 ALA HB1 H -10.513 -1.874 14.852 1.00 . A A . 9 ALA HB1 1 1 26 8387 1 1 9 ALA HB2 H -11.347 -2.308 13.340 1.00 . A A . 9 ALA HB2 1 1 26 8388 1 1 9 ALA HB3 H -10.213 -3.455 14.092 1.00 . A A . 9 ALA HB3 1 1 26 8389 1 1 9 ALA N N -8.292 -1.215 14.002 1.00 . A A . 9 ALA N 1 1 26 8390 1 1 9 ALA O O -10.602 0.094 12.451 1.00 . A A . 9 ALA O 1 1 26 8391 1 1 10 GLY C C -8.318 1.026 9.465 1.00 . A A . 10 GLY C 1 1 26 8392 1 1 10 GLY CA C -9.532 0.196 9.888 1.00 . A A . 10 GLY CA 1 1 26 8393 1 1 10 GLY H H -8.480 -1.429 10.655 1.00 . A A . 10 GLY H 1 1 26 8394 1 1 10 GLY HA2 H -9.937 -0.329 9.023 1.00 . A A . 10 GLY HA2 1 1 26 8395 1 1 10 GLY HA3 H -10.317 0.857 10.256 1.00 . A A . 10 GLY HA3 1 1 26 8396 1 1 10 GLY N N -9.175 -0.762 10.920 1.00 . A A . 10 GLY N 1 1 26 8397 1 1 10 GLY O O -8.125 1.292 8.280 1.00 . A A . 10 GLY O 1 1 26 8398 1 1 11 TYR C C -5.429 1.517 9.185 1.00 . A A . 11 TYR C 1 1 26 8399 1 1 11 TYR CA C -6.340 2.205 10.204 1.00 . A A . 11 TYR CA 1 1 26 8400 1 1 11 TYR CB C -5.604 2.302 11.542 1.00 . A A . 11 TYR CB 1 1 26 8401 1 1 11 TYR CD1 C -6.370 4.516 12.473 1.00 . A A . 11 TYR CD1 1 1 26 8402 1 1 11 TYR CD2 C -6.951 2.526 13.661 1.00 . A A . 11 TYR CD2 1 1 26 8403 1 1 11 TYR CE1 C -7.055 5.308 13.462 1.00 . A A . 11 TYR CE1 1 1 26 8404 1 1 11 TYR CE2 C -7.636 3.318 14.650 1.00 . A A . 11 TYR CE2 1 1 26 8405 1 1 11 TYR CG C -6.333 3.143 12.593 1.00 . A A . 11 TYR CG 1 1 26 8406 1 1 11 TYR CZ C -7.654 4.669 14.501 1.00 . A A . 11 TYR CZ 1 1 26 8407 1 1 11 TYR H H -7.693 1.190 11.420 1.00 . A A . 11 TYR H 1 1 26 8408 1 1 11 TYR HA H -6.656 3.169 9.806 1.00 . A A . 11 TYR HA 1 1 26 8409 1 1 11 TYR HB2 H -5.454 1.297 11.936 1.00 . A A . 11 TYR HB2 1 1 26 8410 1 1 11 TYR HB3 H -4.615 2.729 11.372 1.00 . A A . 11 TYR HB3 1 1 26 8411 1 1 11 TYR HD1 H -5.880 5.003 11.628 1.00 . A A . 11 TYR HD1 1 1 26 8412 1 1 11 TYR HD2 H -6.921 1.441 13.757 1.00 . A A . 11 TYR HD2 1 1 26 8413 1 1 11 TYR HE1 H -7.092 6.394 13.378 1.00 . A A . 11 TYR HE1 1 1 26 8414 1 1 11 TYR HE2 H -8.129 2.844 15.500 1.00 . A A . 11 TYR HE2 1 1 26 8415 1 1 11 TYR HH H -7.670 5.671 16.168 1.00 . A A . 11 TYR HH 1 1 26 8416 1 1 11 TYR N N -7.529 1.411 10.458 1.00 . A A . 11 TYR N 1 1 26 8417 1 1 11 TYR O O -5.477 0.298 9.027 1.00 . A A . 11 TYR O 1 1 26 8418 1 1 11 TYR OH O -8.302 5.417 15.436 1.00 . A A . 11 TYR OH 1 1 26 8419 1 1 12 MET C C -2.257 1.869 8.021 1.00 . A A . 12 MET C 1 1 26 8420 1 1 12 MET CA C -3.701 1.814 7.519 1.00 . A A . 12 MET CA 1 1 26 8421 1 1 12 MET CB C -3.828 2.638 6.236 1.00 . A A . 12 MET CB 1 1 26 8422 1 1 12 MET CE C -3.461 6.721 5.735 1.00 . A A . 12 MET CE 1 1 26 8423 1 1 12 MET CG C -3.837 4.136 6.546 1.00 . A A . 12 MET CG 1 1 26 8424 1 1 12 MET H H -4.588 3.318 8.652 1.00 . A A . 12 MET H 1 1 26 8425 1 1 12 MET HA H -3.997 0.777 7.355 1.00 . A A . 12 MET HA 1 1 26 8426 1 1 12 MET HB2 H -2.999 2.407 5.567 1.00 . A A . 12 MET HB2 1 1 26 8427 1 1 12 MET HB3 H -4.744 2.366 5.713 1.00 . A A . 12 MET HB3 1 1 26 8428 1 1 12 MET HE1 H -4.060 6.757 6.646 1.00 . A A . 12 MET HE1 1 1 26 8429 1 1 12 MET HE2 H -2.432 6.994 5.967 1.00 . A A . 12 MET HE2 1 1 26 8430 1 1 12 MET HE3 H -3.868 7.421 5.006 1.00 . A A . 12 MET HE3 1 1 26 8431 1 1 12 MET HG2 H -4.804 4.425 6.956 1.00 . A A . 12 MET HG2 1 1 26 8432 1 1 12 MET HG3 H -3.087 4.364 7.304 1.00 . A A . 12 MET HG3 1 1 26 8433 1 1 12 MET N N -4.620 2.328 8.518 1.00 . A A . 12 MET N 1 1 26 8434 1 1 12 MET O O -1.943 2.632 8.933 1.00 . A A . 12 MET O 1 1 26 8435 1 1 12 MET SD S -3.503 5.069 5.061 1.00 . A A . 12 MET SD 1 1 26 8436 1 1 13 ARG C C 0.836 1.762 6.761 1.00 . A A . 13 ARG C 1 1 26 8437 1 1 13 ARG CA C -0.014 0.997 7.778 1.00 . A A . 13 ARG CA 1 1 26 8438 1 1 13 ARG CB C 0.479 -0.449 7.860 1.00 . A A . 13 ARG CB 1 1 26 8439 1 1 13 ARG CD C 2.559 -1.563 8.750 1.00 . A A . 13 ARG CD 1 1 26 8440 1 1 13 ARG CG C 2.006 -0.512 7.785 1.00 . A A . 13 ARG CG 1 1 26 8441 1 1 13 ARG CZ C 4.870 -2.281 9.344 1.00 . A A . 13 ARG CZ 1 1 26 8442 1 1 13 ARG H H -1.681 0.434 6.662 1.00 . A A . 13 ARG H 1 1 26 8443 1 1 13 ARG HA H 0.030 1.468 8.760 1.00 . A A . 13 ARG HA 1 1 26 8444 1 1 13 ARG HB2 H 0.138 -0.901 8.791 1.00 . A A . 13 ARG HB2 1 1 26 8445 1 1 13 ARG HB3 H 0.046 -1.031 7.046 1.00 . A A . 13 ARG HB3 1 1 26 8446 1 1 13 ARG HD2 H 2.456 -1.214 9.778 1.00 . A A . 13 ARG HD2 1 1 26 8447 1 1 13 ARG HD3 H 1.982 -2.484 8.667 1.00 . A A . 13 ARG HD3 1 1 26 8448 1 1 13 ARG HE H 4.303 -1.661 7.514 1.00 . A A . 13 ARG HE 1 1 26 8449 1 1 13 ARG HG2 H 2.314 -0.751 6.767 1.00 . A A . 13 ARG HG2 1 1 26 8450 1 1 13 ARG HG3 H 2.426 0.464 8.025 1.00 . A A . 13 ARG HG3 1 1 26 8451 1 1 13 ARG HH11 H 3.537 -2.360 10.877 1.00 . A A . 13 ARG HH11 1 1 26 8452 1 1 13 ARG HH12 H 5.148 -2.856 11.274 1.00 . A A . 13 ARG HH12 1 1 26 8453 1 1 13 ARG HH21 H 6.429 -2.316 8.038 1.00 . A A . 13 ARG HH21 1 1 26 8454 1 1 13 ARG HH22 H 6.804 -2.830 9.648 1.00 . A A . 13 ARG HH22 1 1 26 8455 1 1 13 ARG N N -1.417 1.051 7.404 1.00 . A A . 13 ARG N 1 1 26 8456 1 1 13 ARG NE N 3.983 -1.829 8.447 1.00 . A A . 13 ARG NE 1 1 26 8457 1 1 13 ARG NH1 N 4.486 -2.519 10.605 1.00 . A A . 13 ARG NH1 1 1 26 8458 1 1 13 ARG NH2 N 6.142 -2.494 8.979 1.00 . A A . 13 ARG NH2 1 1 26 8459 1 1 13 ARG O O 1.009 1.313 5.629 1.00 . A A . 13 ARG O 1 1 26 8460 1 1 14 THR C C 3.459 2.999 5.971 1.00 . A A . 14 THR C 1 1 26 8461 1 1 14 THR CA C 2.171 3.735 6.343 1.00 . A A . 14 THR CA 1 1 26 8462 1 1 14 THR CB C 2.416 5.062 7.065 1.00 . A A . 14 THR CB 1 1 26 8463 1 1 14 THR CG2 C 1.161 5.590 7.762 1.00 . A A . 14 THR CG2 1 1 26 8464 1 1 14 THR H H 1.197 3.263 8.123 1.00 . A A . 14 THR H 1 1 26 8465 1 1 14 THR HA H 1.629 3.920 5.416 1.00 . A A . 14 THR HA 1 1 26 8466 1 1 14 THR HB H 2.826 5.807 6.382 1.00 . A A . 14 THR HB 1 1 26 8467 1 1 14 THR HG1 H 2.957 3.896 8.599 1.00 . A A . 14 THR HG1 1 1 26 8468 1 1 14 THR HG21 H 0.329 4.912 7.574 1.00 . A A . 14 THR HG21 1 1 26 8469 1 1 14 THR HG22 H 1.342 5.658 8.834 1.00 . A A . 14 THR HG22 1 1 26 8470 1 1 14 THR HG23 H 0.918 6.579 7.371 1.00 . A A . 14 THR HG23 1 1 26 8471 1 1 14 THR N N 1.343 2.905 7.202 1.00 . A A . 14 THR N 1 1 26 8472 1 1 14 THR O O 3.507 1.770 5.997 1.00 . A A . 14 THR O 1 1 26 8473 1 1 14 THR OG1 O 3.290 4.718 8.137 1.00 . A A . 14 THR OG1 1 1 26 8474 1 1 15 ALA C C 6.652 3.123 6.493 1.00 . A A . 15 ALA C 1 1 26 8475 1 1 15 ALA CA C 5.759 3.219 5.254 1.00 . A A . 15 ALA CA 1 1 26 8476 1 1 15 ALA CB C 6.385 4.073 4.150 1.00 . A A . 15 ALA CB 1 1 26 8477 1 1 15 ALA H H 4.427 4.780 5.613 1.00 . A A . 15 ALA H 1 1 26 8478 1 1 15 ALA HA H 5.582 2.216 4.865 1.00 . A A . 15 ALA HA 1 1 26 8479 1 1 15 ALA HB1 H 6.408 5.116 4.466 1.00 . A A . 15 ALA HB1 1 1 26 8480 1 1 15 ALA HB2 H 7.401 3.729 3.957 1.00 . A A . 15 ALA HB2 1 1 26 8481 1 1 15 ALA HB3 H 5.792 3.982 3.240 1.00 . A A . 15 ALA HB3 1 1 26 8482 1 1 15 ALA N N 4.474 3.781 5.632 1.00 . A A . 15 ALA N 1 1 26 8483 1 1 15 ALA O O 7.816 2.738 6.395 1.00 . A A . 15 ALA O 1 1 26 8484 1 1 16 ASP C C 6.065 2.521 9.868 1.00 . A A . 16 ASP C 1 1 26 8485 1 1 16 ASP CA C 6.802 3.436 8.887 1.00 . A A . 16 ASP CA 1 1 26 8486 1 1 16 ASP CB C 6.895 4.827 9.516 1.00 . A A . 16 ASP CB 1 1 26 8487 1 1 16 ASP CG C 8.306 5.262 9.916 1.00 . A A . 16 ASP CG 1 1 26 8488 1 1 16 ASP H H 5.125 3.789 7.702 1.00 . A A . 16 ASP H 1 1 26 8489 1 1 16 ASP HA H 7.792 3.061 8.631 1.00 . A A . 16 ASP HA 1 1 26 8490 1 1 16 ASP HB2 H 6.492 5.555 8.813 1.00 . A A . 16 ASP HB2 1 1 26 8491 1 1 16 ASP HB3 H 6.259 4.852 10.401 1.00 . A A . 16 ASP HB3 1 1 26 8492 1 1 16 ASP N N 6.073 3.478 7.631 1.00 . A A . 16 ASP N 1 1 26 8493 1 1 16 ASP O O 6.531 2.301 10.985 1.00 . A A . 16 ASP O 1 1 26 8494 1 1 16 ASP OD1 O 8.988 5.846 9.046 1.00 . A A . 16 ASP OD1 1 1 26 8495 1 1 16 ASP OD2 O 8.671 5.001 11.083 1.00 . A A . 16 ASP OD2 1 1 26 8496 1 1 17 GLY C C 3.074 1.917 11.028 1.00 . A A . 17 GLY C 1 1 26 8497 1 1 17 GLY CA C 4.123 1.129 10.240 1.00 . A A . 17 GLY CA 1 1 26 8498 1 1 17 GLY H H 4.556 2.197 8.506 1.00 . A A . 17 GLY H 1 1 26 8499 1 1 17 GLY HA2 H 3.630 0.388 9.612 1.00 . A A . 17 GLY HA2 1 1 26 8500 1 1 17 GLY HA3 H 4.767 0.583 10.931 1.00 . A A . 17 GLY HA3 1 1 26 8501 1 1 17 GLY N N 4.928 2.013 9.416 1.00 . A A . 17 GLY N 1 1 26 8502 1 1 17 GLY O O 2.163 1.333 11.613 1.00 . A A . 17 GLY O 1 1 26 8503 1 1 18 ARG C C 0.880 3.838 11.271 1.00 . A A . 18 ARG C 1 1 26 8504 1 1 18 ARG CA C 2.317 4.106 11.722 1.00 . A A . 18 ARG CA 1 1 26 8505 1 1 18 ARG CB C 2.656 5.578 11.474 1.00 . A A . 18 ARG CB 1 1 26 8506 1 1 18 ARG CD C 4.079 6.368 13.399 1.00 . A A . 18 ARG CD 1 1 26 8507 1 1 18 ARG CG C 4.076 5.900 11.943 1.00 . A A . 18 ARG CG 1 1 26 8508 1 1 18 ARG CZ C 6.545 6.375 13.762 1.00 . A A . 18 ARG CZ 1 1 26 8509 1 1 18 ARG H H 3.982 3.698 10.538 1.00 . A A . 18 ARG H 1 1 26 8510 1 1 18 ARG HA H 2.450 3.860 12.775 1.00 . A A . 18 ARG HA 1 1 26 8511 1 1 18 ARG HB2 H 2.560 5.802 10.412 1.00 . A A . 18 ARG HB2 1 1 26 8512 1 1 18 ARG HB3 H 1.942 6.212 12.000 1.00 . A A . 18 ARG HB3 1 1 26 8513 1 1 18 ARG HD2 H 4.002 7.455 13.441 1.00 . A A . 18 ARG HD2 1 1 26 8514 1 1 18 ARG HD3 H 3.211 5.967 13.921 1.00 . A A . 18 ARG HD3 1 1 26 8515 1 1 18 ARG HE H 5.242 5.246 14.801 1.00 . A A . 18 ARG HE 1 1 26 8516 1 1 18 ARG HG2 H 4.706 5.016 11.840 1.00 . A A . 18 ARG HG2 1 1 26 8517 1 1 18 ARG HG3 H 4.506 6.674 11.307 1.00 . A A . 18 ARG HG3 1 1 26 8518 1 1 18 ARG HH11 H 5.899 7.627 12.295 1.00 . A A . 18 ARG HH11 1 1 26 8519 1 1 18 ARG HH12 H 7.611 7.620 12.559 1.00 . A A . 18 ARG HH12 1 1 26 8520 1 1 18 ARG HH21 H 7.501 5.237 15.149 1.00 . A A . 18 ARG HH21 1 1 26 8521 1 1 18 ARG HH22 H 8.528 6.252 14.193 1.00 . A A . 18 ARG HH22 1 1 26 8522 1 1 18 ARG N N 3.238 3.231 11.017 1.00 . A A . 18 ARG N 1 1 26 8523 1 1 18 ARG NE N 5.321 5.924 14.071 1.00 . A A . 18 ARG NE 1 1 26 8524 1 1 18 ARG NH1 N 6.698 7.284 12.790 1.00 . A A . 18 ARG NH1 1 1 26 8525 1 1 18 ARG NH2 N 7.615 5.916 14.424 1.00 . A A . 18 ARG NH2 1 1 26 8526 1 1 18 ARG O O 0.524 4.109 10.125 1.00 . A A . 18 ARG O 1 1 26 8527 1 1 19 CYS C C -2.057 4.318 11.737 1.00 . A A . 19 CYS C 1 1 26 8528 1 1 19 CYS CA C -1.298 3.000 11.908 1.00 . A A . 19 CYS CA 1 1 26 8529 1 1 19 CYS CB C -1.919 2.120 12.995 1.00 . A A . 19 CYS CB 1 1 26 8530 1 1 19 CYS H H 0.389 3.092 13.127 1.00 . A A . 19 CYS H 1 1 26 8531 1 1 19 CYS HA H -1.306 2.426 10.982 1.00 . A A . 19 CYS HA 1 1 26 8532 1 1 19 CYS HB2 H -1.798 2.616 13.958 1.00 . A A . 19 CYS HB2 1 1 26 8533 1 1 19 CYS HB3 H -2.990 2.041 12.810 1.00 . A A . 19 CYS HB3 1 1 26 8534 1 1 19 CYS N N 0.093 3.309 12.196 1.00 . A A . 19 CYS N 1 1 26 8535 1 1 19 CYS O O -2.503 4.912 12.717 1.00 . A A . 19 CYS O 1 1 26 8536 1 1 19 CYS SG S -1.218 0.433 13.111 1.00 . A A . 19 CYS SG 1 1 26 8537 1 1 20 LYS C C -4.350 5.667 9.899 1.00 . A A . 20 LYS C 1 1 26 8538 1 1 20 LYS CA C -2.877 5.972 10.175 1.00 . A A . 20 LYS CA 1 1 26 8539 1 1 20 LYS CB C -2.176 6.709 9.031 1.00 . A A . 20 LYS CB 1 1 26 8540 1 1 20 LYS CD C -0.162 8.216 8.860 1.00 . A A . 20 LYS CD 1 1 26 8541 1 1 20 LYS CE C 0.405 9.594 9.206 1.00 . A A . 20 LYS CE 1 1 26 8542 1 1 20 LYS CG C -1.519 7.998 9.530 1.00 . A A . 20 LYS CG 1 1 26 8543 1 1 20 LYS H H -1.815 4.246 9.694 1.00 . A A . 20 LYS H 1 1 26 8544 1 1 20 LYS HA H -2.815 6.612 11.056 1.00 . A A . 20 LYS HA 1 1 26 8545 1 1 20 LYS HB2 H -1.422 6.061 8.585 1.00 . A A . 20 LYS HB2 1 1 26 8546 1 1 20 LYS HB3 H -2.898 6.943 8.249 1.00 . A A . 20 LYS HB3 1 1 26 8547 1 1 20 LYS HD2 H 0.535 7.441 9.180 1.00 . A A . 20 LYS HD2 1 1 26 8548 1 1 20 LYS HD3 H -0.267 8.123 7.779 1.00 . A A . 20 LYS HD3 1 1 26 8549 1 1 20 LYS HE2 H 0.162 10.303 8.414 1.00 . A A . 20 LYS HE2 1 1 26 8550 1 1 20 LYS HE3 H -0.058 9.966 10.120 1.00 . A A . 20 LYS HE3 1 1 26 8551 1 1 20 LYS HG2 H -2.172 8.846 9.323 1.00 . A A . 20 LYS HG2 1 1 26 8552 1 1 20 LYS HG3 H -1.392 7.950 10.612 1.00 . A A . 20 LYS HG3 1 1 26 8553 1 1 20 LYS HZ1 H 2.175 8.574 9.277 1.00 . A A . 20 LYS HZ1 1 1 26 8554 1 1 20 LYS HZ2 H 2.320 10.092 8.691 1.00 . A A . 20 LYS HZ2 1 1 26 8555 1 1 20 LYS HZ3 H 2.116 9.851 10.293 1.00 . A A . 20 LYS HZ3 1 1 26 8556 1 1 20 LYS N N -2.180 4.735 10.486 1.00 . A A . 20 LYS N 1 1 26 8557 1 1 20 LYS NZ N 1.873 9.522 9.381 1.00 . A A . 20 LYS NZ 1 1 26 8558 1 1 20 LYS O O -4.727 4.509 9.727 1.00 . A A . 20 LYS O 1 1 26 8559 1 1 21 PRO C C -6.858 6.321 8.132 1.00 . A A . 21 PRO C 1 1 26 8560 1 1 21 PRO CA C -6.591 6.614 9.610 1.00 . A A . 21 PRO CA 1 1 26 8561 1 1 21 PRO CB C -7.204 7.923 10.076 1.00 . A A . 21 PRO CB 1 1 26 8562 1 1 21 PRO CD C -4.757 8.141 10.062 1.00 . A A . 21 PRO CD 1 1 26 8563 1 1 21 PRO CG C -6.060 8.922 10.140 1.00 . A A . 21 PRO CG 1 1 26 8564 1 1 21 PRO HA H -6.957 5.832 10.114 1.00 . A A . 21 PRO HA 1 1 26 8565 1 1 21 PRO HB2 H -7.978 8.260 9.386 1.00 . A A . 21 PRO HB2 1 1 26 8566 1 1 21 PRO HB3 H -7.676 7.808 11.052 1.00 . A A . 21 PRO HB3 1 1 26 8567 1 1 21 PRO HD2 H -4.134 8.493 9.238 1.00 . A A . 21 PRO HD2 1 1 26 8568 1 1 21 PRO HD3 H -4.171 8.255 10.974 1.00 . A A . 21 PRO HD3 1 1 26 8569 1 1 21 PRO HG2 H -6.128 9.633 9.318 1.00 . A A . 21 PRO HG2 1 1 26 8570 1 1 21 PRO HG3 H -6.105 9.497 11.066 1.00 . A A . 21 PRO HG3 1 1 26 8571 1 1 21 PRO N N -5.167 6.754 9.863 1.00 . A A . 21 PRO N 1 1 26 8572 1 1 21 PRO O O -6.162 6.832 7.258 1.00 . A A . 21 PRO O 1 1 26 8573 1 1 22 THR C C -9.646 5.638 6.217 1.00 . A A . 22 THR C 1 1 26 8574 1 1 22 THR CA C -8.240 5.132 6.542 1.00 . A A . 22 THR CA 1 1 26 8575 1 1 22 THR CB C -8.094 3.615 6.407 1.00 . A A . 22 THR CB 1 1 26 8576 1 1 22 THR CG2 C -8.413 3.120 4.994 1.00 . A A . 22 THR CG2 1 1 26 8577 1 1 22 THR H H -8.433 5.087 8.616 1.00 . A A . 22 THR H 1 1 26 8578 1 1 22 THR HA H -7.554 5.626 5.855 1.00 . A A . 22 THR HA 1 1 26 8579 1 1 22 THR HB H -8.704 3.098 7.148 1.00 . A A . 22 THR HB 1 1 26 8580 1 1 22 THR HG1 H -6.212 3.712 5.734 1.00 . A A . 22 THR HG1 1 1 26 8581 1 1 22 THR HG21 H -7.862 3.718 4.268 1.00 . A A . 22 THR HG21 1 1 26 8582 1 1 22 THR HG22 H -8.118 2.074 4.901 1.00 . A A . 22 THR HG22 1 1 26 8583 1 1 22 THR HG23 H -9.482 3.214 4.809 1.00 . A A . 22 THR HG23 1 1 26 8584 1 1 22 THR N N -7.871 5.499 7.900 1.00 . A A . 22 THR N 1 1 26 8585 1 1 22 THR O O -10.204 5.303 5.173 1.00 . A A . 22 THR O 1 1 26 8586 1 1 22 THR OG1 O -6.695 3.386 6.548 1.00 . A A . 22 THR OG1 1 1 26 8587 1 1 23 PHE C C -11.438 8.424 6.413 1.00 . A A . 23 PHE C 1 1 26 8588 1 1 23 PHE CA C -11.509 6.995 6.952 1.00 . A A . 23 PHE CA 1 1 26 8589 1 1 23 PHE CB C -12.173 7.014 8.330 1.00 . A A . 23 PHE CB 1 1 26 8590 1 1 23 PHE CD1 C -11.084 9.026 9.349 1.00 . A A . 23 PHE CD1 1 1 26 8591 1 1 23 PHE CD2 C -10.837 6.957 10.448 1.00 . A A . 23 PHE CD2 1 1 26 8592 1 1 23 PHE CE1 C -10.306 9.655 10.355 1.00 . A A . 23 PHE CE1 1 1 26 8593 1 1 23 PHE CE2 C -10.059 7.587 11.455 1.00 . A A . 23 PHE CE2 1 1 26 8594 1 1 23 PHE CG C -11.334 7.691 9.415 1.00 . A A . 23 PHE CG 1 1 26 8595 1 1 23 PHE CZ C -9.809 8.922 11.387 1.00 . A A . 23 PHE CZ 1 1 26 8596 1 1 23 PHE H H -9.718 6.706 7.975 1.00 . A A . 23 PHE H 1 1 26 8597 1 1 23 PHE HA H -12.031 6.363 6.233 1.00 . A A . 23 PHE HA 1 1 26 8598 1 1 23 PHE HB2 H -13.131 7.528 8.253 1.00 . A A . 23 PHE HB2 1 1 26 8599 1 1 23 PHE HB3 H -12.384 5.989 8.635 1.00 . A A . 23 PHE HB3 1 1 26 8600 1 1 23 PHE HD1 H -11.483 9.614 8.521 1.00 . A A . 23 PHE HD1 1 1 26 8601 1 1 23 PHE HD2 H -11.037 5.887 10.502 1.00 . A A . 23 PHE HD2 1 1 26 8602 1 1 23 PHE HE1 H -10.105 10.725 10.301 1.00 . A A . 23 PHE HE1 1 1 26 8603 1 1 23 PHE HE2 H -9.661 6.998 12.283 1.00 . A A . 23 PHE HE2 1 1 26 8604 1 1 23 PHE HZ H -9.212 9.404 12.161 1.00 . A A . 23 PHE HZ 1 1 26 8605 1 1 23 PHE N N -10.179 6.438 7.129 1.00 . A A . 23 PHE N 1 1 26 8606 1 1 23 PHE O O -10.532 8.760 5.651 1.00 . A A . 23 PHE O 1 1 27 8607 1 1 1 GLU C C -7.146 -12.749 11.922 1.00 . A A . 1 GLU C 1 1 27 8608 1 1 1 GLU CA C -8.669 -12.785 11.780 1.00 . A A . 1 GLU CA 1 1 27 8609 1 1 1 GLU CB C -9.280 -11.412 12.068 1.00 . A A . 1 GLU CB 1 1 27 8610 1 1 1 GLU CD C -10.956 -9.691 11.303 1.00 . A A . 1 GLU CD 1 1 27 8611 1 1 1 GLU CG C -10.444 -11.121 11.119 1.00 . A A . 1 GLU CG 1 1 27 8612 1 1 1 GLU HA H -8.939 -13.092 10.770 1.00 . A A . 1 GLU HA 1 1 27 8613 1 1 1 GLU HB2 H -9.628 -11.374 13.100 1.00 . A A . 1 GLU HB2 1 1 27 8614 1 1 1 GLU HB3 H -8.517 -10.641 11.960 1.00 . A A . 1 GLU HB3 1 1 27 8615 1 1 1 GLU HG2 H -10.123 -11.266 10.088 1.00 . A A . 1 GLU HG2 1 1 27 8616 1 1 1 GLU HG3 H -11.254 -11.827 11.304 1.00 . A A . 1 GLU HG3 1 1 27 8617 1 1 1 GLU N N -9.232 -13.799 12.655 1.00 . A A . 1 GLU N 1 1 27 8618 1 1 1 GLU O O -6.584 -13.405 12.797 1.00 . A A . 1 GLU O 1 1 27 8619 1 1 1 GLU OE1 O -11.659 -9.465 12.312 1.00 . A A . 1 GLU OE1 1 1 27 8620 1 1 1 GLU OE2 O -10.633 -8.856 10.431 1.00 . A A . 1 GLU OE2 1 1 27 8621 1 1 2 ASN C C -4.702 -10.368 11.241 1.00 . A A . 2 ASN C 1 1 27 8622 1 1 2 ASN CA C -5.074 -11.842 11.064 1.00 . A A . 2 ASN CA 1 1 27 8623 1 1 2 ASN CB C -4.461 -12.330 9.750 1.00 . A A . 2 ASN CB 1 1 27 8624 1 1 2 ASN CG C -4.634 -13.842 9.592 1.00 . A A . 2 ASN CG 1 1 27 8625 1 1 2 ASN H H -6.985 -11.443 10.337 1.00 . A A . 2 ASN H 1 1 27 8626 1 1 2 ASN HA H -4.740 -12.460 11.898 1.00 . A A . 2 ASN HA 1 1 27 8627 1 1 2 ASN HB2 H -4.933 -11.817 8.911 1.00 . A A . 2 ASN HB2 1 1 27 8628 1 1 2 ASN HB3 H -3.401 -12.077 9.723 1.00 . A A . 2 ASN HB3 1 1 27 8629 1 1 2 ASN HD21 H -4.545 -13.596 7.585 1.00 . A A . 2 ASN HD21 1 1 27 8630 1 1 2 ASN HD22 H -4.752 -15.229 8.122 1.00 . A A . 2 ASN HD22 1 1 27 8631 1 1 2 ASN N N -6.521 -11.974 11.047 1.00 . A A . 2 ASN N 1 1 27 8632 1 1 2 ASN ND2 N -4.644 -14.256 8.329 1.00 . A A . 2 ASN ND2 1 1 27 8633 1 1 2 ASN O O -5.344 -9.490 10.667 1.00 . A A . 2 ASN O 1 1 27 8634 1 1 2 ASN OD1 O -4.750 -14.583 10.554 1.00 . A A . 2 ASN OD1 1 1 27 8635 1 1 3 PHE C C -2.813 -8.087 10.996 1.00 . A A . 3 PHE C 1 1 27 8636 1 1 3 PHE CA C -3.204 -8.791 12.297 1.00 . A A . 3 PHE CA 1 1 27 8637 1 1 3 PHE CB C -1.967 -8.907 13.192 1.00 . A A . 3 PHE CB 1 1 27 8638 1 1 3 PHE CD1 C -2.621 -7.395 15.078 1.00 . A A . 3 PHE CD1 1 1 27 8639 1 1 3 PHE CD2 C -2.110 -9.639 15.582 1.00 . A A . 3 PHE CD2 1 1 27 8640 1 1 3 PHE CE1 C -2.876 -7.145 16.452 1.00 . A A . 3 PHE CE1 1 1 27 8641 1 1 3 PHE CE2 C -2.366 -9.389 16.956 1.00 . A A . 3 PHE CE2 1 1 27 8642 1 1 3 PHE CG C -2.243 -8.637 14.672 1.00 . A A . 3 PHE CG 1 1 27 8643 1 1 3 PHE CZ C -2.743 -8.148 17.362 1.00 . A A . 3 PHE CZ 1 1 27 8644 1 1 3 PHE H H -3.152 -10.864 12.500 1.00 . A A . 3 PHE H 1 1 27 8645 1 1 3 PHE HA H -4.025 -8.252 12.768 1.00 . A A . 3 PHE HA 1 1 27 8646 1 1 3 PHE HB2 H -1.549 -9.908 13.086 1.00 . A A . 3 PHE HB2 1 1 27 8647 1 1 3 PHE HB3 H -1.210 -8.206 12.839 1.00 . A A . 3 PHE HB3 1 1 27 8648 1 1 3 PHE HD1 H -2.727 -6.592 14.348 1.00 . A A . 3 PHE HD1 1 1 27 8649 1 1 3 PHE HD2 H -1.807 -10.635 15.257 1.00 . A A . 3 PHE HD2 1 1 27 8650 1 1 3 PHE HE1 H -3.179 -6.150 16.777 1.00 . A A . 3 PHE HE1 1 1 27 8651 1 1 3 PHE HE2 H -2.259 -10.192 17.685 1.00 . A A . 3 PHE HE2 1 1 27 8652 1 1 3 PHE HZ H -2.939 -7.955 18.417 1.00 . A A . 3 PHE HZ 1 1 27 8653 1 1 3 PHE N N -3.668 -10.144 12.038 1.00 . A A . 3 PHE N 1 1 27 8654 1 1 3 PHE O O -2.892 -8.676 9.919 1.00 . A A . 3 PHE O 1 1 27 8655 1 1 4 ASN C C -0.955 -5.013 10.425 1.00 . A A . 4 ASN C 1 1 27 8656 1 1 4 ASN CA C -1.999 -6.044 9.989 1.00 . A A . 4 ASN CA 1 1 27 8657 1 1 4 ASN CB C -3.191 -5.289 9.396 1.00 . A A . 4 ASN CB 1 1 27 8658 1 1 4 ASN CG C -2.761 -4.444 8.195 1.00 . A A . 4 ASN CG 1 1 27 8659 1 1 4 ASN H H -2.341 -6.364 12.018 1.00 . A A . 4 ASN H 1 1 27 8660 1 1 4 ASN HA H -1.602 -6.762 9.271 1.00 . A A . 4 ASN HA 1 1 27 8661 1 1 4 ASN HB2 H -3.959 -5.999 9.089 1.00 . A A . 4 ASN HB2 1 1 27 8662 1 1 4 ASN HB3 H -3.635 -4.647 10.156 1.00 . A A . 4 ASN HB3 1 1 27 8663 1 1 4 ASN HD21 H -3.382 -2.795 9.193 1.00 . A A . 4 ASN HD21 1 1 27 8664 1 1 4 ASN HD22 H -2.726 -2.504 7.617 1.00 . A A . 4 ASN HD22 1 1 27 8665 1 1 4 ASN N N -2.402 -6.835 11.139 1.00 . A A . 4 ASN N 1 1 27 8666 1 1 4 ASN ND2 N -2.974 -3.140 8.348 1.00 . A A . 4 ASN ND2 1 1 27 8667 1 1 4 ASN O O -1.039 -3.844 10.051 1.00 . A A . 4 ASN O 1 1 27 8668 1 1 4 ASN OD1 O -2.269 -4.942 7.196 1.00 . A A . 4 ASN OD1 1 1 27 8669 1 1 5 GLY C C 0.862 -4.293 13.180 1.00 . A A . 5 GLY C 1 1 27 8670 1 1 5 GLY CA C 1.062 -4.618 11.698 1.00 . A A . 5 GLY CA 1 1 27 8671 1 1 5 GLY H H 0.064 -6.437 11.507 1.00 . A A . 5 GLY H 1 1 27 8672 1 1 5 GLY HA2 H 2.027 -5.102 11.556 1.00 . A A . 5 GLY HA2 1 1 27 8673 1 1 5 GLY HA3 H 1.079 -3.696 11.118 1.00 . A A . 5 GLY HA3 1 1 27 8674 1 1 5 GLY N N 0.003 -5.484 11.208 1.00 . A A . 5 GLY N 1 1 27 8675 1 1 5 GLY O O 1.827 -4.218 13.938 1.00 . A A . 5 GLY O 1 1 27 8676 1 1 6 GLY C C -1.611 -2.538 15.000 1.00 . A A . 6 GLY C 1 1 27 8677 1 1 6 GLY CA C -0.736 -3.792 14.925 1.00 . A A . 6 GLY CA 1 1 27 8678 1 1 6 GLY H H -1.177 -4.170 12.923 1.00 . A A . 6 GLY H 1 1 27 8679 1 1 6 GLY HA2 H -1.261 -4.634 15.376 1.00 . A A . 6 GLY HA2 1 1 27 8680 1 1 6 GLY HA3 H 0.176 -3.638 15.501 1.00 . A A . 6 GLY HA3 1 1 27 8681 1 1 6 GLY N N -0.398 -4.107 13.547 1.00 . A A . 6 GLY N 1 1 27 8682 1 1 6 GLY O O -1.285 -1.592 15.714 1.00 . A A . 6 GLY O 1 1 27 8683 1 1 7 CYS C C -4.837 -1.805 15.101 1.00 . A A . 7 CYS C 1 1 27 8684 1 1 7 CYS CA C -3.630 -1.453 14.229 1.00 . A A . 7 CYS CA 1 1 27 8685 1 1 7 CYS CB C -4.043 -1.094 12.800 1.00 . A A . 7 CYS CB 1 1 27 8686 1 1 7 CYS H H -2.964 -3.349 13.677 1.00 . A A . 7 CYS H 1 1 27 8687 1 1 7 CYS HA H -3.095 -0.597 14.637 1.00 . A A . 7 CYS HA 1 1 27 8688 1 1 7 CYS HB2 H -4.457 -1.982 12.322 1.00 . A A . 7 CYS HB2 1 1 27 8689 1 1 7 CYS HB3 H -4.842 -0.353 12.843 1.00 . A A . 7 CYS HB3 1 1 27 8690 1 1 7 CYS N N -2.706 -2.574 14.255 1.00 . A A . 7 CYS N 1 1 27 8691 1 1 7 CYS O O -4.912 -2.904 15.650 1.00 . A A . 7 CYS O 1 1 27 8692 1 1 7 CYS SG S -2.693 -0.439 11.753 1.00 . A A . 7 CYS SG 1 1 27 8693 1 1 8 LEU C C -8.014 -1.750 15.145 1.00 . A A . 8 LEU C 1 1 27 8694 1 1 8 LEU CA C -6.953 -1.049 15.995 1.00 . A A . 8 LEU CA 1 1 27 8695 1 1 8 LEU CB C -7.423 0.280 16.592 1.00 . A A . 8 LEU CB 1 1 27 8696 1 1 8 LEU CD1 C -8.725 -0.699 18.517 1.00 . A A . 8 LEU CD1 1 1 27 8697 1 1 8 LEU CD2 C -9.207 1.659 17.719 1.00 . A A . 8 LEU CD2 1 1 27 8698 1 1 8 LEU CG C -8.770 0.249 17.318 1.00 . A A . 8 LEU CG 1 1 27 8699 1 1 8 LEU H H -5.684 0.037 14.750 1.00 . A A . 8 LEU H 1 1 27 8700 1 1 8 LEU HA H -6.690 -1.702 16.828 1.00 . A A . 8 LEU HA 1 1 27 8701 1 1 8 LEU HB2 H -6.663 0.629 17.292 1.00 . A A . 8 LEU HB2 1 1 27 8702 1 1 8 LEU HB3 H -7.480 1.016 15.791 1.00 . A A . 8 LEU HB3 1 1 27 8703 1 1 8 LEU HD11 H -7.930 -1.430 18.372 1.00 . A A . 8 LEU HD11 1 1 27 8704 1 1 8 LEU HD12 H -8.533 -0.128 19.426 1.00 . A A . 8 LEU HD12 1 1 27 8705 1 1 8 LEU HD13 H -9.681 -1.215 18.608 1.00 . A A . 8 LEU HD13 1 1 27 8706 1 1 8 LEU HD21 H -8.334 2.242 18.014 1.00 . A A . 8 LEU HD21 1 1 27 8707 1 1 8 LEU HD22 H -9.697 2.143 16.873 1.00 . A A . 8 LEU HD22 1 1 27 8708 1 1 8 LEU HD23 H -9.903 1.600 18.556 1.00 . A A . 8 LEU HD23 1 1 27 8709 1 1 8 LEU HG H -9.520 -0.137 16.629 1.00 . A A . 8 LEU HG 1 1 27 8710 1 1 8 LEU N N -5.752 -0.853 15.200 1.00 . A A . 8 LEU N 1 1 27 8711 1 1 8 LEU O O -8.521 -2.805 15.525 1.00 . A A . 8 LEU O 1 1 27 8712 1 1 9 ALA C C -9.782 -0.595 12.144 1.00 . A A . 9 ALA C 1 1 27 8713 1 1 9 ALA CA C -9.311 -1.689 13.105 1.00 . A A . 9 ALA CA 1 1 27 8714 1 1 9 ALA CB C -10.461 -2.291 13.912 1.00 . A A . 9 ALA CB 1 1 27 8715 1 1 9 ALA H H -7.902 -0.279 13.710 1.00 . A A . 9 ALA H 1 1 27 8716 1 1 9 ALA HA H -8.830 -2.482 12.531 1.00 . A A . 9 ALA HA 1 1 27 8717 1 1 9 ALA HB1 H -10.595 -1.725 14.833 1.00 . A A . 9 ALA HB1 1 1 27 8718 1 1 9 ALA HB2 H -11.379 -2.251 13.324 1.00 . A A . 9 ALA HB2 1 1 27 8719 1 1 9 ALA HB3 H -10.231 -3.329 14.154 1.00 . A A . 9 ALA HB3 1 1 27 8720 1 1 9 ALA N N -8.319 -1.137 14.012 1.00 . A A . 9 ALA N 1 1 27 8721 1 1 9 ALA O O -10.556 0.280 12.526 1.00 . A A . 9 ALA O 1 1 27 8722 1 1 10 GLY C C -8.446 1.125 9.480 1.00 . A A . 10 GLY C 1 1 27 8723 1 1 10 GLY CA C -9.658 0.289 9.896 1.00 . A A . 10 GLY CA 1 1 27 8724 1 1 10 GLY H H -8.665 -1.397 10.612 1.00 . A A . 10 GLY H 1 1 27 8725 1 1 10 GLY HA2 H -10.065 -0.225 9.027 1.00 . A A . 10 GLY HA2 1 1 27 8726 1 1 10 GLY HA3 H -10.443 0.944 10.276 1.00 . A A . 10 GLY HA3 1 1 27 8727 1 1 10 GLY N N -9.295 -0.682 10.915 1.00 . A A . 10 GLY N 1 1 27 8728 1 1 10 GLY O O -8.321 1.508 8.318 1.00 . A A . 10 GLY O 1 1 27 8729 1 1 11 TYR C C -5.455 1.448 9.222 1.00 . A A . 11 TYR C 1 1 27 8730 1 1 11 TYR CA C -6.385 2.167 10.202 1.00 . A A . 11 TYR CA 1 1 27 8731 1 1 11 TYR CB C -5.679 2.300 11.552 1.00 . A A . 11 TYR CB 1 1 27 8732 1 1 11 TYR CD1 C -6.543 4.503 12.424 1.00 . A A . 11 TYR CD1 1 1 27 8733 1 1 11 TYR CD2 C -7.051 2.518 13.655 1.00 . A A . 11 TYR CD2 1 1 27 8734 1 1 11 TYR CE1 C -7.268 5.288 13.389 1.00 . A A . 11 TYR CE1 1 1 27 8735 1 1 11 TYR CE2 C -7.777 3.303 14.621 1.00 . A A . 11 TYR CE2 1 1 27 8736 1 1 11 TYR CG C -6.450 3.135 12.577 1.00 . A A . 11 TYR CG 1 1 27 8737 1 1 11 TYR CZ C -7.850 4.649 14.440 1.00 . A A . 11 TYR CZ 1 1 27 8738 1 1 11 TYR H H -7.691 1.068 11.395 1.00 . A A . 11 TYR H 1 1 27 8739 1 1 11 TYR HA H -6.691 3.119 9.768 1.00 . A A . 11 TYR HA 1 1 27 8740 1 1 11 TYR HB2 H -5.509 1.306 11.962 1.00 . A A . 11 TYR HB2 1 1 27 8741 1 1 11 TYR HB3 H -4.699 2.752 11.395 1.00 . A A . 11 TYR HB3 1 1 27 8742 1 1 11 TYR HD1 H -6.067 4.990 11.573 1.00 . A A . 11 TYR HD1 1 1 27 8743 1 1 11 TYR HD2 H -6.977 1.437 13.776 1.00 . A A . 11 TYR HD2 1 1 27 8744 1 1 11 TYR HE1 H -7.350 6.369 13.281 1.00 . A A . 11 TYR HE1 1 1 27 8745 1 1 11 TYR HE2 H -8.257 2.828 15.476 1.00 . A A . 11 TYR HE2 1 1 27 8746 1 1 11 TYR HH H -9.373 4.913 15.619 1.00 . A A . 11 TYR HH 1 1 27 8747 1 1 11 TYR N N -7.583 1.384 10.452 1.00 . A A . 11 TYR N 1 1 27 8748 1 1 11 TYR O O -5.530 0.229 9.070 1.00 . A A . 11 TYR O 1 1 27 8749 1 1 11 TYR OH O -8.535 5.389 15.351 1.00 . A A . 11 TYR OH 1 1 27 8750 1 1 12 MET C C -2.219 1.814 8.132 1.00 . A A . 12 MET C 1 1 27 8751 1 1 12 MET CA C -3.657 1.686 7.622 1.00 . A A . 12 MET CA 1 1 27 8752 1 1 12 MET CB C -3.794 2.429 6.292 1.00 . A A . 12 MET CB 1 1 27 8753 1 1 12 MET CE C -3.159 6.435 5.578 1.00 . A A . 12 MET CE 1 1 27 8754 1 1 12 MET CG C -3.800 3.944 6.508 1.00 . A A . 12 MET CG 1 1 27 8755 1 1 12 MET H H -4.545 3.222 8.712 1.00 . A A . 12 MET H 1 1 27 8756 1 1 12 MET HA H -3.921 0.634 7.519 1.00 . A A . 12 MET HA 1 1 27 8757 1 1 12 MET HB2 H -2.971 2.156 5.632 1.00 . A A . 12 MET HB2 1 1 27 8758 1 1 12 MET HB3 H -4.715 2.126 5.795 1.00 . A A . 12 MET HB3 1 1 27 8759 1 1 12 MET HE1 H -2.344 6.418 6.300 1.00 . A A . 12 MET HE1 1 1 27 8760 1 1 12 MET HE2 H -2.893 7.086 4.745 1.00 . A A . 12 MET HE2 1 1 27 8761 1 1 12 MET HE3 H -4.062 6.810 6.058 1.00 . A A . 12 MET HE3 1 1 27 8762 1 1 12 MET HG2 H -4.768 4.261 6.893 1.00 . A A . 12 MET HG2 1 1 27 8763 1 1 12 MET HG3 H -3.055 4.216 7.257 1.00 . A A . 12 MET HG3 1 1 27 8764 1 1 12 MET N N -4.600 2.233 8.583 1.00 . A A . 12 MET N 1 1 27 8765 1 1 12 MET O O -1.934 2.642 8.996 1.00 . A A . 12 MET O 1 1 27 8766 1 1 12 MET SD S -3.451 4.782 4.971 1.00 . A A . 12 MET SD 1 1 27 8767 1 1 13 ARG C C 0.886 1.719 6.912 1.00 . A A . 13 ARG C 1 1 27 8768 1 1 13 ARG CA C 0.048 0.989 7.964 1.00 . A A . 13 ARG CA 1 1 27 8769 1 1 13 ARG CB C 0.582 -0.435 8.133 1.00 . A A . 13 ARG CB 1 1 27 8770 1 1 13 ARG CD C 1.937 -1.443 6.260 1.00 . A A . 13 ARG CD 1 1 27 8771 1 1 13 ARG CG C 0.529 -1.201 6.810 1.00 . A A . 13 ARG CG 1 1 27 8772 1 1 13 ARG CZ C 3.190 -3.503 5.634 1.00 . A A . 13 ARG CZ 1 1 27 8773 1 1 13 ARG H H -1.592 0.310 6.874 1.00 . A A . 13 ARG H 1 1 27 8774 1 1 13 ARG HA H 0.070 1.517 8.917 1.00 . A A . 13 ARG HA 1 1 27 8775 1 1 13 ARG HB2 H 1.609 -0.401 8.498 1.00 . A A . 13 ARG HB2 1 1 27 8776 1 1 13 ARG HB3 H -0.006 -0.960 8.885 1.00 . A A . 13 ARG HB3 1 1 27 8777 1 1 13 ARG HD2 H 2.158 -0.721 5.473 1.00 . A A . 13 ARG HD2 1 1 27 8778 1 1 13 ARG HD3 H 2.675 -1.292 7.048 1.00 . A A . 13 ARG HD3 1 1 27 8779 1 1 13 ARG HE H 1.204 -3.267 5.415 1.00 . A A . 13 ARG HE 1 1 27 8780 1 1 13 ARG HG2 H 0.024 -2.155 6.958 1.00 . A A . 13 ARG HG2 1 1 27 8781 1 1 13 ARG HG3 H -0.057 -0.639 6.083 1.00 . A A . 13 ARG HG3 1 1 27 8782 1 1 13 ARG HH11 H 4.338 -2.014 6.410 1.00 . A A . 13 ARG HH11 1 1 27 8783 1 1 13 ARG HH12 H 5.196 -3.453 5.970 1.00 . A A . 13 ARG HH12 1 1 27 8784 1 1 13 ARG HH21 H 2.334 -5.166 4.835 1.00 . A A . 13 ARG HH21 1 1 27 8785 1 1 13 ARG HH22 H 4.048 -5.258 5.068 1.00 . A A . 13 ARG HH22 1 1 27 8786 1 1 13 ARG N N -1.352 0.980 7.576 1.00 . A A . 13 ARG N 1 1 27 8787 1 1 13 ARG NE N 2.042 -2.819 5.726 1.00 . A A . 13 ARG NE 1 1 27 8788 1 1 13 ARG NH1 N 4.338 -2.943 6.039 1.00 . A A . 13 ARG NH1 1 1 27 8789 1 1 13 ARG NH2 N 3.191 -4.747 5.137 1.00 . A A . 13 ARG NH2 1 1 27 8790 1 1 13 ARG O O 1.135 1.185 5.832 1.00 . A A . 13 ARG O 1 1 27 8791 1 1 14 THR C C 3.417 3.024 6.039 1.00 . A A . 14 THR C 1 1 27 8792 1 1 14 THR CA C 2.102 3.736 6.366 1.00 . A A . 14 THR CA 1 1 27 8793 1 1 14 THR CB C 2.299 5.109 7.011 1.00 . A A . 14 THR CB 1 1 27 8794 1 1 14 THR CG2 C 1.019 5.947 7.007 1.00 . A A . 14 THR CG2 1 1 27 8795 1 1 14 THR H H 1.091 3.354 8.145 1.00 . A A . 14 THR H 1 1 27 8796 1 1 14 THR HA H 1.559 3.850 5.427 1.00 . A A . 14 THR HA 1 1 27 8797 1 1 14 THR HB H 3.119 5.648 6.537 1.00 . A A . 14 THR HB 1 1 27 8798 1 1 14 THR HG1 H 2.524 5.662 8.922 1.00 . A A . 14 THR HG1 1 1 27 8799 1 1 14 THR HG21 H 0.555 5.897 6.021 1.00 . A A . 14 THR HG21 1 1 27 8800 1 1 14 THR HG22 H 0.327 5.558 7.754 1.00 . A A . 14 THR HG22 1 1 27 8801 1 1 14 THR HG23 H 1.263 6.983 7.242 1.00 . A A . 14 THR HG23 1 1 27 8802 1 1 14 THR N N 1.297 2.928 7.265 1.00 . A A . 14 THR N 1 1 27 8803 1 1 14 THR O O 3.572 1.839 6.328 1.00 . A A . 14 THR O 1 1 27 8804 1 1 14 THR OG1 O 2.517 4.816 8.389 1.00 . A A . 14 THR OG1 1 1 27 8805 1 1 15 ALA C C 6.539 3.231 6.301 1.00 . A A . 15 ALA C 1 1 27 8806 1 1 15 ALA CA C 5.625 3.233 5.074 1.00 . A A . 15 ALA CA 1 1 27 8807 1 1 15 ALA CB C 6.207 4.041 3.914 1.00 . A A . 15 ALA CB 1 1 27 8808 1 1 15 ALA H H 4.194 4.740 5.211 1.00 . A A . 15 ALA H 1 1 27 8809 1 1 15 ALA HA H 5.471 2.205 4.744 1.00 . A A . 15 ALA HA 1 1 27 8810 1 1 15 ALA HB1 H 5.430 4.223 3.171 1.00 . A A . 15 ALA HB1 1 1 27 8811 1 1 15 ALA HB2 H 6.583 4.994 4.287 1.00 . A A . 15 ALA HB2 1 1 27 8812 1 1 15 ALA HB3 H 7.024 3.484 3.456 1.00 . A A . 15 ALA HB3 1 1 27 8813 1 1 15 ALA N N 4.328 3.777 5.443 1.00 . A A . 15 ALA N 1 1 27 8814 1 1 15 ALA O O 7.714 2.880 6.203 1.00 . A A . 15 ALA O 1 1 27 8815 1 1 16 ASP C C 6.138 2.652 9.650 1.00 . A A . 16 ASP C 1 1 27 8816 1 1 16 ASP CA C 6.715 3.678 8.671 1.00 . A A . 16 ASP CA 1 1 27 8817 1 1 16 ASP CB C 6.614 5.059 9.320 1.00 . A A . 16 ASP CB 1 1 27 8818 1 1 16 ASP CG C 7.780 6.003 9.018 1.00 . A A . 16 ASP CG 1 1 27 8819 1 1 16 ASP H H 5.010 3.912 7.498 1.00 . A A . 16 ASP H 1 1 27 8820 1 1 16 ASP HA H 7.745 3.456 8.394 1.00 . A A . 16 ASP HA 1 1 27 8821 1 1 16 ASP HB2 H 5.689 5.532 8.991 1.00 . A A . 16 ASP HB2 1 1 27 8822 1 1 16 ASP HB3 H 6.539 4.932 10.400 1.00 . A A . 16 ASP HB3 1 1 27 8823 1 1 16 ASP N N 5.966 3.628 7.427 1.00 . A A . 16 ASP N 1 1 27 8824 1 1 16 ASP O O 6.782 2.301 10.637 1.00 . A A . 16 ASP O 1 1 27 8825 1 1 16 ASP OD1 O 7.735 6.632 7.939 1.00 . A A . 16 ASP OD1 1 1 27 8826 1 1 16 ASP OD2 O 8.689 6.073 9.873 1.00 . A A . 16 ASP OD2 1 1 27 8827 1 1 17 GLY C C 3.256 1.899 11.114 1.00 . A A . 17 GLY C 1 1 27 8828 1 1 17 GLY CA C 4.262 1.222 10.179 1.00 . A A . 17 GLY CA 1 1 27 8829 1 1 17 GLY H H 4.416 2.492 8.536 1.00 . A A . 17 GLY H 1 1 27 8830 1 1 17 GLY HA2 H 3.748 0.493 9.554 1.00 . A A . 17 GLY HA2 1 1 27 8831 1 1 17 GLY HA3 H 4.999 0.676 10.767 1.00 . A A . 17 GLY HA3 1 1 27 8832 1 1 17 GLY N N 4.932 2.201 9.341 1.00 . A A . 17 GLY N 1 1 27 8833 1 1 17 GLY O O 2.503 1.224 11.814 1.00 . A A . 17 GLY O 1 1 27 8834 1 1 18 ARG C C 0.931 3.816 11.467 1.00 . A A . 18 ARG C 1 1 27 8835 1 1 18 ARG CA C 2.377 3.999 11.932 1.00 . A A . 18 ARG CA 1 1 27 8836 1 1 18 ARG CB C 2.734 5.486 11.894 1.00 . A A . 18 ARG CB 1 1 27 8837 1 1 18 ARG CD C 4.547 7.188 12.314 1.00 . A A . 18 ARG CD 1 1 27 8838 1 1 18 ARG CG C 4.224 5.700 12.165 1.00 . A A . 18 ARG CG 1 1 27 8839 1 1 18 ARG CZ C 5.925 7.342 14.384 1.00 . A A . 18 ARG CZ 1 1 27 8840 1 1 18 ARG H H 3.893 3.765 10.522 1.00 . A A . 18 ARG H 1 1 27 8841 1 1 18 ARG HA H 2.519 3.601 12.937 1.00 . A A . 18 ARG HA 1 1 27 8842 1 1 18 ARG HB2 H 2.474 5.902 10.921 1.00 . A A . 18 ARG HB2 1 1 27 8843 1 1 18 ARG HB3 H 2.145 6.024 12.637 1.00 . A A . 18 ARG HB3 1 1 27 8844 1 1 18 ARG HD2 H 5.437 7.435 11.735 1.00 . A A . 18 ARG HD2 1 1 27 8845 1 1 18 ARG HD3 H 3.730 7.787 11.913 1.00 . A A . 18 ARG HD3 1 1 27 8846 1 1 18 ARG HE H 3.995 7.898 14.255 1.00 . A A . 18 ARG HE 1 1 27 8847 1 1 18 ARG HG2 H 4.512 5.169 13.073 1.00 . A A . 18 ARG HG2 1 1 27 8848 1 1 18 ARG HG3 H 4.810 5.277 11.349 1.00 . A A . 18 ARG HG3 1 1 27 8849 1 1 18 ARG HH11 H 6.904 6.591 12.768 1.00 . A A . 18 ARG HH11 1 1 27 8850 1 1 18 ARG HH12 H 7.849 6.705 14.215 1.00 . A A . 18 ARG HH12 1 1 27 8851 1 1 18 ARG HH21 H 5.241 8.048 16.165 1.00 . A A . 18 ARG HH21 1 1 27 8852 1 1 18 ARG HH22 H 6.896 7.539 16.160 1.00 . A A . 18 ARG HH22 1 1 27 8853 1 1 18 ARG N N 3.277 3.224 11.095 1.00 . A A . 18 ARG N 1 1 27 8854 1 1 18 ARG NE N 4.763 7.519 13.740 1.00 . A A . 18 ARG NE 1 1 27 8855 1 1 18 ARG NH1 N 6.982 6.837 13.734 1.00 . A A . 18 ARG NH1 1 1 27 8856 1 1 18 ARG NH2 N 6.030 7.671 15.679 1.00 . A A . 18 ARG NH2 1 1 27 8857 1 1 18 ARG O O 0.556 4.288 10.394 1.00 . A A . 18 ARG O 1 1 27 8858 1 1 19 CYS C C -1.958 4.226 11.885 1.00 . A A . 19 CYS C 1 1 27 8859 1 1 19 CYS CA C -1.239 2.879 11.983 1.00 . A A . 19 CYS CA 1 1 27 8860 1 1 19 CYS CB C -1.892 1.956 13.014 1.00 . A A . 19 CYS CB 1 1 27 8861 1 1 19 CYS H H 0.471 2.751 13.166 1.00 . A A . 19 CYS H 1 1 27 8862 1 1 19 CYS HA H -1.256 2.360 11.024 1.00 . A A . 19 CYS HA 1 1 27 8863 1 1 19 CYS HB2 H -1.784 2.403 14.001 1.00 . A A . 19 CYS HB2 1 1 27 8864 1 1 19 CYS HB3 H -2.960 1.900 12.804 1.00 . A A . 19 CYS HB3 1 1 27 8865 1 1 19 CYS N N 0.158 3.131 12.296 1.00 . A A . 19 CYS N 1 1 27 8866 1 1 19 CYS O O -2.212 4.873 12.900 1.00 . A A . 19 CYS O 1 1 27 8867 1 1 19 CYS SG S -1.214 0.258 13.060 1.00 . A A . 19 CYS SG 1 1 27 8868 1 1 20 LYS C C -4.391 5.585 9.979 1.00 . A A . 20 LYS C 1 1 27 8869 1 1 20 LYS CA C -2.951 5.867 10.412 1.00 . A A . 20 LYS CA 1 1 27 8870 1 1 20 LYS CB C -2.165 6.721 9.415 1.00 . A A . 20 LYS CB 1 1 27 8871 1 1 20 LYS CD C -0.214 8.319 9.442 1.00 . A A . 20 LYS CD 1 1 27 8872 1 1 20 LYS CE C -0.361 9.611 8.637 1.00 . A A . 20 LYS CE 1 1 27 8873 1 1 20 LYS CG C -1.538 7.934 10.106 1.00 . A A . 20 LYS CG 1 1 27 8874 1 1 20 LYS H H -2.057 4.077 9.835 1.00 . A A . 20 LYS H 1 1 27 8875 1 1 20 LYS HA H -2.975 6.414 11.355 1.00 . A A . 20 LYS HA 1 1 27 8876 1 1 20 LYS HB2 H -1.385 6.119 8.950 1.00 . A A . 20 LYS HB2 1 1 27 8877 1 1 20 LYS HB3 H -2.827 7.056 8.616 1.00 . A A . 20 LYS HB3 1 1 27 8878 1 1 20 LYS HD2 H 0.555 8.446 10.204 1.00 . A A . 20 LYS HD2 1 1 27 8879 1 1 20 LYS HD3 H 0.116 7.513 8.787 1.00 . A A . 20 LYS HD3 1 1 27 8880 1 1 20 LYS HE2 H -1.298 10.103 8.895 1.00 . A A . 20 LYS HE2 1 1 27 8881 1 1 20 LYS HE3 H 0.443 10.301 8.896 1.00 . A A . 20 LYS HE3 1 1 27 8882 1 1 20 LYS HG2 H -2.228 8.777 10.066 1.00 . A A . 20 LYS HG2 1 1 27 8883 1 1 20 LYS HG3 H -1.369 7.709 11.159 1.00 . A A . 20 LYS HG3 1 1 27 8884 1 1 20 LYS HZ1 H 0.453 8.732 6.981 1.00 . A A . 20 LYS HZ1 1 1 27 8885 1 1 20 LYS HZ2 H -1.174 8.865 6.917 1.00 . A A . 20 LYS HZ2 1 1 27 8886 1 1 20 LYS HZ3 H -0.236 10.181 6.678 1.00 . A A . 20 LYS HZ3 1 1 27 8887 1 1 20 LYS N N -2.267 4.609 10.655 1.00 . A A . 20 LYS N 1 1 27 8888 1 1 20 LYS NZ N -0.327 9.324 7.185 1.00 . A A . 20 LYS NZ 1 1 27 8889 1 1 20 LYS O O -4.739 4.444 9.676 1.00 . A A . 20 LYS O 1 1 27 8890 1 1 21 PRO C C -6.733 6.385 8.054 1.00 . A A . 21 PRO C 1 1 27 8891 1 1 21 PRO CA C -6.603 6.550 9.569 1.00 . A A . 21 PRO CA 1 1 27 8892 1 1 21 PRO CB C -7.269 7.814 10.088 1.00 . A A . 21 PRO CB 1 1 27 8893 1 1 21 PRO CD C -4.833 8.036 10.315 1.00 . A A . 21 PRO CD 1 1 27 8894 1 1 21 PRO CG C -6.143 8.804 10.341 1.00 . A A . 21 PRO CG 1 1 27 8895 1 1 21 PRO HA H -7.008 5.727 9.969 1.00 . A A . 21 PRO HA 1 1 27 8896 1 1 21 PRO HB2 H -7.979 8.208 9.361 1.00 . A A . 21 PRO HB2 1 1 27 8897 1 1 21 PRO HB3 H -7.827 7.614 11.003 1.00 . A A . 21 PRO HB3 1 1 27 8898 1 1 21 PRO HD2 H -4.141 8.457 9.585 1.00 . A A . 21 PRO HD2 1 1 27 8899 1 1 21 PRO HD3 H -4.334 8.070 11.284 1.00 . A A . 21 PRO HD3 1 1 27 8900 1 1 21 PRO HG2 H -6.144 9.584 9.580 1.00 . A A . 21 PRO HG2 1 1 27 8901 1 1 21 PRO HG3 H -6.279 9.297 11.303 1.00 . A A . 21 PRO HG3 1 1 27 8902 1 1 21 PRO N N -5.210 6.670 9.963 1.00 . A A . 21 PRO N 1 1 27 8903 1 1 21 PRO O O -5.983 6.994 7.292 1.00 . A A . 21 PRO O 1 1 27 8904 1 1 22 THR C C -9.416 5.455 5.924 1.00 . A A . 22 THR C 1 1 27 8905 1 1 22 THR CA C -7.929 5.305 6.248 1.00 . A A . 22 THR CA 1 1 27 8906 1 1 22 THR CB C -7.370 3.920 5.916 1.00 . A A . 22 THR CB 1 1 27 8907 1 1 22 THR CG2 C -8.233 3.169 4.899 1.00 . A A . 22 THR CG2 1 1 27 8908 1 1 22 THR H H -8.297 5.067 8.285 1.00 . A A . 22 THR H 1 1 27 8909 1 1 22 THR HA H -7.397 6.060 5.670 1.00 . A A . 22 THR HA 1 1 27 8910 1 1 22 THR HB H -7.232 3.329 6.822 1.00 . A A . 22 THR HB 1 1 27 8911 1 1 22 THR HG1 H -5.854 3.371 4.732 1.00 . A A . 22 THR HG1 1 1 27 8912 1 1 22 THR HG21 H -9.242 3.053 5.295 1.00 . A A . 22 THR HG21 1 1 27 8913 1 1 22 THR HG22 H -8.271 3.734 3.967 1.00 . A A . 22 THR HG22 1 1 27 8914 1 1 22 THR HG23 H -7.802 2.187 4.712 1.00 . A A . 22 THR HG23 1 1 27 8915 1 1 22 THR N N -7.691 5.558 7.660 1.00 . A A . 22 THR N 1 1 27 8916 1 1 22 THR O O -9.836 5.205 4.795 1.00 . A A . 22 THR O 1 1 27 8917 1 1 22 THR OG1 O -6.162 4.193 5.212 1.00 . A A . 22 THR OG1 1 1 27 8918 1 1 23 PHE C C -11.912 7.428 6.182 1.00 . A A . 23 PHE C 1 1 27 8919 1 1 23 PHE CA C -11.603 6.049 6.768 1.00 . A A . 23 PHE CA 1 1 27 8920 1 1 23 PHE CB C -12.230 5.946 8.160 1.00 . A A . 23 PHE CB 1 1 27 8921 1 1 23 PHE CD1 C -11.680 8.207 9.084 1.00 . A A . 23 PHE CD1 1 1 27 8922 1 1 23 PHE CD2 C -10.905 6.314 10.253 1.00 . A A . 23 PHE CD2 1 1 27 8923 1 1 23 PHE CE1 C -11.077 9.053 10.053 1.00 . A A . 23 PHE CE1 1 1 27 8924 1 1 23 PHE CE2 C -10.302 7.160 11.222 1.00 . A A . 23 PHE CE2 1 1 27 8925 1 1 23 PHE CG C -11.581 6.856 9.204 1.00 . A A . 23 PHE CG 1 1 27 8926 1 1 23 PHE CZ C -10.401 8.510 11.101 1.00 . A A . 23 PHE CZ 1 1 27 8927 1 1 23 PHE H H -9.821 6.064 7.847 1.00 . A A . 23 PHE H 1 1 27 8928 1 1 23 PHE HA H -11.953 5.278 6.082 1.00 . A A . 23 PHE HA 1 1 27 8929 1 1 23 PHE HB2 H -13.290 6.191 8.088 1.00 . A A . 23 PHE HB2 1 1 27 8930 1 1 23 PHE HB3 H -12.164 4.913 8.501 1.00 . A A . 23 PHE HB3 1 1 27 8931 1 1 23 PHE HD1 H -12.221 8.642 8.243 1.00 . A A . 23 PHE HD1 1 1 27 8932 1 1 23 PHE HD2 H -10.826 5.231 10.349 1.00 . A A . 23 PHE HD2 1 1 27 8933 1 1 23 PHE HE1 H -11.155 10.135 9.956 1.00 . A A . 23 PHE HE1 1 1 27 8934 1 1 23 PHE HE2 H -9.761 6.724 12.062 1.00 . A A . 23 PHE HE2 1 1 27 8935 1 1 23 PHE HZ H -9.938 9.159 11.844 1.00 . A A . 23 PHE HZ 1 1 27 8936 1 1 23 PHE N N -10.172 5.863 6.932 1.00 . A A . 23 PHE N 1 1 27 8937 1 1 23 PHE O O -12.972 7.633 5.594 1.00 . A A . 23 PHE O 1 1 28 8938 1 1 1 GLU C C -12.245 -6.024 17.780 1.00 . A A . 1 GLU C 1 1 28 8939 1 1 1 GLU CA C -13.213 -6.776 16.864 1.00 . A A . 1 GLU CA 1 1 28 8940 1 1 1 GLU CB C -14.013 -5.803 15.996 1.00 . A A . 1 GLU CB 1 1 28 8941 1 1 1 GLU CD C -14.433 -5.061 13.622 1.00 . A A . 1 GLU CD 1 1 28 8942 1 1 1 GLU CG C -13.451 -5.749 14.573 1.00 . A A . 1 GLU CG 1 1 28 8943 1 1 1 GLU HA H -12.659 -7.458 16.219 1.00 . A A . 1 GLU HA 1 1 28 8944 1 1 1 GLU HB2 H -15.058 -6.111 15.966 1.00 . A A . 1 GLU HB2 1 1 28 8945 1 1 1 GLU HB3 H -13.987 -4.808 16.439 1.00 . A A . 1 GLU HB3 1 1 28 8946 1 1 1 GLU HG2 H -12.503 -5.211 14.574 1.00 . A A . 1 GLU HG2 1 1 28 8947 1 1 1 GLU HG3 H -13.245 -6.759 14.221 1.00 . A A . 1 GLU HG3 1 1 28 8948 1 1 1 GLU N N -14.097 -7.620 17.650 1.00 . A A . 1 GLU N 1 1 28 8949 1 1 1 GLU O O -12.606 -5.008 18.371 1.00 . A A . 1 GLU O 1 1 28 8950 1 1 1 GLU OE1 O -15.436 -5.719 13.269 1.00 . A A . 1 GLU OE1 1 1 28 8951 1 1 1 GLU OE2 O -14.158 -3.894 13.269 1.00 . A A . 1 GLU OE2 1 1 28 8952 1 1 2 ASN C C -8.637 -6.479 18.286 1.00 . A A . 2 ASN C 1 1 28 8953 1 1 2 ASN CA C -10.010 -5.946 18.702 1.00 . A A . 2 ASN CA 1 1 28 8954 1 1 2 ASN CB C -10.225 -6.290 20.177 1.00 . A A . 2 ASN CB 1 1 28 8955 1 1 2 ASN CG C -11.653 -5.959 20.614 1.00 . A A . 2 ASN CG 1 1 28 8956 1 1 2 ASN H H -10.748 -7.381 17.384 1.00 . A A . 2 ASN H 1 1 28 8957 1 1 2 ASN HA H -10.108 -4.873 18.538 1.00 . A A . 2 ASN HA 1 1 28 8958 1 1 2 ASN HB2 H -10.027 -7.349 20.338 1.00 . A A . 2 ASN HB2 1 1 28 8959 1 1 2 ASN HB3 H -9.515 -5.736 20.790 1.00 . A A . 2 ASN HB3 1 1 28 8960 1 1 2 ASN HD21 H -12.010 -7.944 20.788 1.00 . A A . 2 ASN HD21 1 1 28 8961 1 1 2 ASN HD22 H -13.347 -6.914 21.176 1.00 . A A . 2 ASN HD22 1 1 28 8962 1 1 2 ASN N N -11.034 -6.554 17.868 1.00 . A A . 2 ASN N 1 1 28 8963 1 1 2 ASN ND2 N -12.399 -7.028 20.882 1.00 . A A . 2 ASN ND2 1 1 28 8964 1 1 2 ASN O O -8.461 -7.684 18.119 1.00 . A A . 2 ASN O 1 1 28 8965 1 1 2 ASN OD1 O -12.052 -4.810 20.704 1.00 . A A . 2 ASN OD1 1 1 28 8966 1 1 3 PHE C C -6.364 -6.959 16.622 1.00 . A A . 3 PHE C 1 1 28 8967 1 1 3 PHE CA C -6.349 -5.916 17.740 1.00 . A A . 3 PHE CA 1 1 28 8968 1 1 3 PHE CB C -5.672 -6.518 18.973 1.00 . A A . 3 PHE CB 1 1 28 8969 1 1 3 PHE CD1 C -3.238 -6.394 18.398 1.00 . A A . 3 PHE CD1 1 1 28 8970 1 1 3 PHE CD2 C -4.196 -8.523 18.712 1.00 . A A . 3 PHE CD2 1 1 28 8971 1 1 3 PHE CE1 C -1.982 -6.999 18.129 1.00 . A A . 3 PHE CE1 1 1 28 8972 1 1 3 PHE CE2 C -2.939 -9.128 18.443 1.00 . A A . 3 PHE CE2 1 1 28 8973 1 1 3 PHE CG C -4.318 -7.169 18.684 1.00 . A A . 3 PHE CG 1 1 28 8974 1 1 3 PHE CZ C -1.859 -8.353 18.157 1.00 . A A . 3 PHE CZ 1 1 28 8975 1 1 3 PHE H H -7.853 -4.575 18.271 1.00 . A A . 3 PHE H 1 1 28 8976 1 1 3 PHE HA H -5.862 -5.009 17.383 1.00 . A A . 3 PHE HA 1 1 28 8977 1 1 3 PHE HB2 H -5.534 -5.733 19.719 1.00 . A A . 3 PHE HB2 1 1 28 8978 1 1 3 PHE HB3 H -6.335 -7.262 19.413 1.00 . A A . 3 PHE HB3 1 1 28 8979 1 1 3 PHE HD1 H -3.336 -5.309 18.375 1.00 . A A . 3 PHE HD1 1 1 28 8980 1 1 3 PHE HD2 H -5.061 -9.144 18.942 1.00 . A A . 3 PHE HD2 1 1 28 8981 1 1 3 PHE HE1 H -1.115 -6.378 17.900 1.00 . A A . 3 PHE HE1 1 1 28 8982 1 1 3 PHE HE2 H -2.841 -10.213 18.466 1.00 . A A . 3 PHE HE2 1 1 28 8983 1 1 3 PHE HZ H -0.894 -8.817 17.951 1.00 . A A . 3 PHE HZ 1 1 28 8984 1 1 3 PHE N N -7.700 -5.554 18.133 1.00 . A A . 3 PHE N 1 1 28 8985 1 1 3 PHE O O -6.409 -8.159 16.887 1.00 . A A . 3 PHE O 1 1 28 8986 1 1 4 ASN C C -4.945 -7.334 13.588 1.00 . A A . 4 ASN C 1 1 28 8987 1 1 4 ASN CA C -6.333 -7.337 14.233 1.00 . A A . 4 ASN CA 1 1 28 8988 1 1 4 ASN CB C -7.340 -6.856 13.187 1.00 . A A . 4 ASN CB 1 1 28 8989 1 1 4 ASN CG C -7.286 -5.335 13.033 1.00 . A A . 4 ASN CG 1 1 28 8990 1 1 4 ASN H H -6.288 -5.486 15.186 1.00 . A A . 4 ASN H 1 1 28 8991 1 1 4 ASN HA H -6.613 -8.318 14.616 1.00 . A A . 4 ASN HA 1 1 28 8992 1 1 4 ASN HB2 H -7.130 -7.329 12.229 1.00 . A A . 4 ASN HB2 1 1 28 8993 1 1 4 ASN HB3 H -8.346 -7.159 13.480 1.00 . A A . 4 ASN HB3 1 1 28 8994 1 1 4 ASN HD21 H -6.606 -5.598 11.144 1.00 . A A . 4 ASN HD21 1 1 28 8995 1 1 4 ASN HD22 H -6.786 -3.949 11.644 1.00 . A A . 4 ASN HD22 1 1 28 8996 1 1 4 ASN N N -6.324 -6.463 15.393 1.00 . A A . 4 ASN N 1 1 28 8997 1 1 4 ASN ND2 N -6.857 -4.927 11.842 1.00 . A A . 4 ASN ND2 1 1 28 8998 1 1 4 ASN O O -4.803 -6.996 12.414 1.00 . A A . 4 ASN O 1 1 28 8999 1 1 4 ASN OD1 O -7.612 -4.581 13.936 1.00 . A A . 4 ASN OD1 1 1 28 9000 1 1 5 GLY C C -1.736 -6.677 14.572 1.00 . A A . 5 GLY C 1 1 28 9001 1 1 5 GLY CA C -2.586 -7.761 13.906 1.00 . A A . 5 GLY CA 1 1 28 9002 1 1 5 GLY H H -4.081 -7.988 15.338 1.00 . A A . 5 GLY H 1 1 28 9003 1 1 5 GLY HA2 H -2.157 -8.742 14.112 1.00 . A A . 5 GLY HA2 1 1 28 9004 1 1 5 GLY HA3 H -2.569 -7.627 12.825 1.00 . A A . 5 GLY HA3 1 1 28 9005 1 1 5 GLY N N -3.957 -7.716 14.384 1.00 . A A . 5 GLY N 1 1 28 9006 1 1 5 GLY O O -0.586 -6.920 14.935 1.00 . A A . 5 GLY O 1 1 28 9007 1 1 6 GLY C C -2.571 -3.167 15.440 1.00 . A A . 6 GLY C 1 1 28 9008 1 1 6 GLY CA C -1.648 -4.382 15.330 1.00 . A A . 6 GLY CA 1 1 28 9009 1 1 6 GLY H H -3.271 -5.315 14.416 1.00 . A A . 6 GLY H 1 1 28 9010 1 1 6 GLY HA2 H -1.296 -4.667 16.322 1.00 . A A . 6 GLY HA2 1 1 28 9011 1 1 6 GLY HA3 H -0.768 -4.122 14.742 1.00 . A A . 6 GLY HA3 1 1 28 9012 1 1 6 GLY N N -2.335 -5.504 14.714 1.00 . A A . 6 GLY N 1 1 28 9013 1 1 6 GLY O O -2.922 -2.747 16.542 1.00 . A A . 6 GLY O 1 1 28 9014 1 1 7 CYS C C -5.033 -1.760 15.113 1.00 . A A . 7 CYS C 1 1 28 9015 1 1 7 CYS CA C -3.813 -1.477 14.235 1.00 . A A . 7 CYS CA 1 1 28 9016 1 1 7 CYS CB C -4.212 -1.128 12.800 1.00 . A A . 7 CYS CB 1 1 28 9017 1 1 7 CYS H H -2.648 -2.983 13.391 1.00 . A A . 7 CYS H 1 1 28 9018 1 1 7 CYS HA H -3.241 -0.636 14.627 1.00 . A A . 7 CYS HA 1 1 28 9019 1 1 7 CYS HB2 H -4.636 -2.015 12.330 1.00 . A A . 7 CYS HB2 1 1 28 9020 1 1 7 CYS HB3 H -4.999 -0.375 12.829 1.00 . A A . 7 CYS HB3 1 1 28 9021 1 1 7 CYS N N -2.938 -2.635 14.282 1.00 . A A . 7 CYS N 1 1 28 9022 1 1 7 CYS O O -5.183 -2.864 15.637 1.00 . A A . 7 CYS O 1 1 28 9023 1 1 7 CYS SG S -2.845 -0.507 11.753 1.00 . A A . 7 CYS SG 1 1 28 9024 1 1 8 LEU C C -8.153 -1.599 15.247 1.00 . A A . 8 LEU C 1 1 28 9025 1 1 8 LEU CA C -7.077 -0.872 16.055 1.00 . A A . 8 LEU CA 1 1 28 9026 1 1 8 LEU CB C -7.519 0.497 16.574 1.00 . A A . 8 LEU CB 1 1 28 9027 1 1 8 LEU CD1 C -8.843 -0.351 18.545 1.00 . A A . 8 LEU CD1 1 1 28 9028 1 1 8 LEU CD2 C -9.270 1.975 17.628 1.00 . A A . 8 LEU CD2 1 1 28 9029 1 1 8 LEU CG C -8.866 0.537 17.299 1.00 . A A . 8 LEU CG 1 1 28 9030 1 1 8 LEU H H -5.745 0.148 14.819 1.00 . A A . 8 LEU H 1 1 28 9031 1 1 8 LEU HA H -6.825 -1.481 16.923 1.00 . A A . 8 LEU HA 1 1 28 9032 1 1 8 LEU HB2 H -6.753 0.872 17.253 1.00 . A A . 8 LEU HB2 1 1 28 9033 1 1 8 LEU HB3 H -7.563 1.187 15.732 1.00 . A A . 8 LEU HB3 1 1 28 9034 1 1 8 LEU HD11 H -8.017 -1.058 18.473 1.00 . A A . 8 LEU HD11 1 1 28 9035 1 1 8 LEU HD12 H -8.714 0.269 19.432 1.00 . A A . 8 LEU HD12 1 1 28 9036 1 1 8 LEU HD13 H -9.783 -0.899 18.618 1.00 . A A . 8 LEU HD13 1 1 28 9037 1 1 8 LEU HD21 H -8.441 2.482 18.122 1.00 . A A . 8 LEU HD21 1 1 28 9038 1 1 8 LEU HD22 H -9.521 2.502 16.707 1.00 . A A . 8 LEU HD22 1 1 28 9039 1 1 8 LEU HD23 H -10.137 1.967 18.290 1.00 . A A . 8 LEU HD23 1 1 28 9040 1 1 8 LEU HG H -9.626 0.133 16.630 1.00 . A A . 8 LEU HG 1 1 28 9041 1 1 8 LEU N N -5.875 -0.745 15.248 1.00 . A A . 8 LEU N 1 1 28 9042 1 1 8 LEU O O -8.680 -2.620 15.687 1.00 . A A . 8 LEU O 1 1 28 9043 1 1 9 ALA C C -9.900 -0.586 12.182 1.00 . A A . 9 ALA C 1 1 28 9044 1 1 9 ALA CA C -9.450 -1.631 13.205 1.00 . A A . 9 ALA CA 1 1 28 9045 1 1 9 ALA CB C -10.612 -2.162 14.047 1.00 . A A . 9 ALA CB 1 1 28 9046 1 1 9 ALA H H -8.012 -0.217 13.728 1.00 . A A . 9 ALA H 1 1 28 9047 1 1 9 ALA HA H -8.987 -2.466 12.680 1.00 . A A . 9 ALA HA 1 1 28 9048 1 1 9 ALA HB1 H -10.648 -1.626 14.996 1.00 . A A . 9 ALA HB1 1 1 28 9049 1 1 9 ALA HB2 H -11.548 -2.012 13.509 1.00 . A A . 9 ALA HB2 1 1 28 9050 1 1 9 ALA HB3 H -10.468 -3.226 14.236 1.00 . A A . 9 ALA HB3 1 1 28 9051 1 1 9 ALA N N -8.446 -1.047 14.079 1.00 . A A . 9 ALA N 1 1 28 9052 1 1 9 ALA O O -10.713 0.284 12.494 1.00 . A A . 9 ALA O 1 1 28 9053 1 1 10 GLY C C -8.459 1.012 9.468 1.00 . A A . 10 GLY C 1 1 28 9054 1 1 10 GLY CA C -9.688 0.217 9.911 1.00 . A A . 10 GLY CA 1 1 28 9055 1 1 10 GLY H H -8.693 -1.417 10.736 1.00 . A A . 10 GLY H 1 1 28 9056 1 1 10 GLY HA2 H -10.094 -0.336 9.063 1.00 . A A . 10 GLY HA2 1 1 28 9057 1 1 10 GLY HA3 H -10.467 0.902 10.247 1.00 . A A . 10 GLY HA3 1 1 28 9058 1 1 10 GLY N N -9.353 -0.706 10.982 1.00 . A A . 10 GLY N 1 1 28 9059 1 1 10 GLY O O -8.272 1.259 8.277 1.00 . A A . 10 GLY O 1 1 28 9060 1 1 11 TYR C C -5.531 1.400 9.207 1.00 . A A . 11 TYR C 1 1 28 9061 1 1 11 TYR CA C -6.447 2.152 10.175 1.00 . A A . 11 TYR CA 1 1 28 9062 1 1 11 TYR CB C -5.731 2.308 11.518 1.00 . A A . 11 TYR CB 1 1 28 9063 1 1 11 TYR CD1 C -7.426 2.712 13.341 1.00 . A A . 11 TYR CD1 1 1 28 9064 1 1 11 TYR CD2 C -6.137 4.567 12.560 1.00 . A A . 11 TYR CD2 1 1 28 9065 1 1 11 TYR CE1 C -8.107 3.576 14.270 1.00 . A A . 11 TYR CE1 1 1 28 9066 1 1 11 TYR CE2 C -6.819 5.432 13.489 1.00 . A A . 11 TYR CE2 1 1 28 9067 1 1 11 TYR CG C -6.456 3.226 12.505 1.00 . A A . 11 TYR CG 1 1 28 9068 1 1 11 TYR CZ C -7.770 4.893 14.298 1.00 . A A . 11 TYR CZ 1 1 28 9069 1 1 11 TYR H H -7.812 1.185 11.414 1.00 . A A . 11 TYR H 1 1 28 9070 1 1 11 TYR HA H -6.742 3.099 9.721 1.00 . A A . 11 TYR HA 1 1 28 9071 1 1 11 TYR HB2 H -5.615 1.324 11.972 1.00 . A A . 11 TYR HB2 1 1 28 9072 1 1 11 TYR HB3 H -4.730 2.699 11.342 1.00 . A A . 11 TYR HB3 1 1 28 9073 1 1 11 TYR HD1 H -7.677 1.652 13.298 1.00 . A A . 11 TYR HD1 1 1 28 9074 1 1 11 TYR HD2 H -5.371 4.973 11.900 1.00 . A A . 11 TYR HD2 1 1 28 9075 1 1 11 TYR HE1 H -8.876 3.183 14.936 1.00 . A A . 11 TYR HE1 1 1 28 9076 1 1 11 TYR HE2 H -6.577 6.494 13.543 1.00 . A A . 11 TYR HE2 1 1 28 9077 1 1 11 TYR HH H -8.995 5.167 15.783 1.00 . A A . 11 TYR HH 1 1 28 9078 1 1 11 TYR N N -7.653 1.390 10.448 1.00 . A A . 11 TYR N 1 1 28 9079 1 1 11 TYR O O -5.613 0.178 9.092 1.00 . A A . 11 TYR O 1 1 28 9080 1 1 11 TYR OH O -8.413 5.709 15.176 1.00 . A A . 11 TYR OH 1 1 28 9081 1 1 12 MET C C -2.306 1.711 8.075 1.00 . A A . 12 MET C 1 1 28 9082 1 1 12 MET CA C -3.748 1.581 7.582 1.00 . A A . 12 MET CA 1 1 28 9083 1 1 12 MET CB C -3.892 2.289 6.234 1.00 . A A . 12 MET CB 1 1 28 9084 1 1 12 MET CE C -3.332 5.860 4.617 1.00 . A A . 12 MET CE 1 1 28 9085 1 1 12 MET CG C -3.664 3.794 6.377 1.00 . A A . 12 MET CG 1 1 28 9086 1 1 12 MET H H -4.617 3.154 8.636 1.00 . A A . 12 MET H 1 1 28 9087 1 1 12 MET HA H -4.021 0.528 7.511 1.00 . A A . 12 MET HA 1 1 28 9088 1 1 12 MET HB2 H -3.177 1.874 5.524 1.00 . A A . 12 MET HB2 1 1 28 9089 1 1 12 MET HB3 H -4.887 2.105 5.827 1.00 . A A . 12 MET HB3 1 1 28 9090 1 1 12 MET HE1 H -4.309 5.925 5.094 1.00 . A A . 12 MET HE1 1 1 28 9091 1 1 12 MET HE2 H -2.727 6.720 4.906 1.00 . A A . 12 MET HE2 1 1 28 9092 1 1 12 MET HE3 H -3.456 5.852 3.533 1.00 . A A . 12 MET HE3 1 1 28 9093 1 1 12 MET HG2 H -4.611 4.325 6.278 1.00 . A A . 12 MET HG2 1 1 28 9094 1 1 12 MET HG3 H -3.275 4.018 7.370 1.00 . A A . 12 MET HG3 1 1 28 9095 1 1 12 MET N N -4.678 2.161 8.536 1.00 . A A . 12 MET N 1 1 28 9096 1 1 12 MET O O -2.031 2.460 9.013 1.00 . A A . 12 MET O 1 1 28 9097 1 1 12 MET SD S -2.516 4.359 5.132 1.00 . A A . 12 MET SD 1 1 28 9098 1 1 13 ARG C C 0.790 1.761 6.731 1.00 . A A . 13 ARG C 1 1 28 9099 1 1 13 ARG CA C -0.014 0.994 7.783 1.00 . A A . 13 ARG CA 1 1 28 9100 1 1 13 ARG CB C 0.545 -0.424 7.908 1.00 . A A . 13 ARG CB 1 1 28 9101 1 1 13 ARG CD C 0.816 -1.768 10.025 1.00 . A A . 13 ARG CD 1 1 28 9102 1 1 13 ARG CG C -0.178 -1.204 9.008 1.00 . A A . 13 ARG CG 1 1 28 9103 1 1 13 ARG CZ C 1.219 -4.140 9.378 1.00 . A A . 13 ARG CZ 1 1 28 9104 1 1 13 ARG H H -1.654 0.365 6.662 1.00 . A A . 13 ARG H 1 1 28 9105 1 1 13 ARG HA H 0.018 1.500 8.747 1.00 . A A . 13 ARG HA 1 1 28 9106 1 1 13 ARG HB2 H 0.439 -0.947 6.957 1.00 . A A . 13 ARG HB2 1 1 28 9107 1 1 13 ARG HB3 H 1.612 -0.380 8.130 1.00 . A A . 13 ARG HB3 1 1 28 9108 1 1 13 ARG HD2 H 1.836 -1.553 9.706 1.00 . A A . 13 ARG HD2 1 1 28 9109 1 1 13 ARG HD3 H 0.676 -1.283 10.991 1.00 . A A . 13 ARG HD3 1 1 28 9110 1 1 13 ARG HE H 0.018 -3.557 10.884 1.00 . A A . 13 ARG HE 1 1 28 9111 1 1 13 ARG HG2 H -0.890 -0.551 9.514 1.00 . A A . 13 ARG HG2 1 1 28 9112 1 1 13 ARG HG3 H -0.751 -2.018 8.565 1.00 . A A . 13 ARG HG3 1 1 28 9113 1 1 13 ARG HH11 H 2.215 -2.772 8.250 1.00 . A A . 13 ARG HH11 1 1 28 9114 1 1 13 ARG HH12 H 2.485 -4.426 7.812 1.00 . A A . 13 ARG HH12 1 1 28 9115 1 1 13 ARG HH21 H 0.374 -5.739 10.307 1.00 . A A . 13 ARG HH21 1 1 28 9116 1 1 13 ARG HH22 H 1.431 -6.125 8.990 1.00 . A A . 13 ARG HH22 1 1 28 9117 1 1 13 ARG N N -1.422 0.971 7.423 1.00 . A A . 13 ARG N 1 1 28 9118 1 1 13 ARG NE N 0.627 -3.229 10.162 1.00 . A A . 13 ARG NE 1 1 28 9119 1 1 13 ARG NH1 N 2.043 -3.746 8.397 1.00 . A A . 13 ARG NH1 1 1 28 9120 1 1 13 ARG NH2 N 0.989 -5.445 9.575 1.00 . A A . 13 ARG NH2 1 1 28 9121 1 1 13 ARG O O 0.990 1.273 5.620 1.00 . A A . 13 ARG O 1 1 28 9122 1 1 14 THR C C 3.317 3.094 5.848 1.00 . A A . 14 THR C 1 1 28 9123 1 1 14 THR CA C 2.007 3.788 6.226 1.00 . A A . 14 THR CA 1 1 28 9124 1 1 14 THR CB C 2.212 5.143 6.907 1.00 . A A . 14 THR CB 1 1 28 9125 1 1 14 THR CG2 C 0.931 5.675 7.551 1.00 . A A . 14 THR CG2 1 1 28 9126 1 1 14 THR H H 1.061 3.339 8.025 1.00 . A A . 14 THR H 1 1 28 9127 1 1 14 THR HA H 1.441 3.927 5.305 1.00 . A A . 14 THR HA 1 1 28 9128 1 1 14 THR HB H 2.629 5.870 6.211 1.00 . A A . 14 THR HB 1 1 28 9129 1 1 14 THR HG1 H 3.799 5.522 8.068 1.00 . A A . 14 THR HG1 1 1 28 9130 1 1 14 THR HG21 H 0.129 4.949 7.417 1.00 . A A . 14 THR HG21 1 1 28 9131 1 1 14 THR HG22 H 1.099 5.838 8.615 1.00 . A A . 14 THR HG22 1 1 28 9132 1 1 14 THR HG23 H 0.651 6.617 7.079 1.00 . A A . 14 THR HG23 1 1 28 9133 1 1 14 THR N N 1.228 2.949 7.120 1.00 . A A . 14 THR N 1 1 28 9134 1 1 14 THR O O 3.396 1.866 5.850 1.00 . A A . 14 THR O 1 1 28 9135 1 1 14 THR OG1 O 3.060 4.849 8.014 1.00 . A A . 14 THR OG1 1 1 28 9136 1 1 15 ALA C C 6.568 3.492 6.342 1.00 . A A . 15 ALA C 1 1 28 9137 1 1 15 ALA CA C 5.614 3.388 5.150 1.00 . A A . 15 ALA CA 1 1 28 9138 1 1 15 ALA CB C 6.128 4.145 3.924 1.00 . A A . 15 ALA CB 1 1 28 9139 1 1 15 ALA H H 4.239 4.907 5.529 1.00 . A A . 15 ALA H 1 1 28 9140 1 1 15 ALA HA H 5.487 2.338 4.887 1.00 . A A . 15 ALA HA 1 1 28 9141 1 1 15 ALA HB1 H 5.301 4.338 3.242 1.00 . A A . 15 ALA HB1 1 1 28 9142 1 1 15 ALA HB2 H 6.568 5.091 4.239 1.00 . A A . 15 ALA HB2 1 1 28 9143 1 1 15 ALA HB3 H 6.883 3.544 3.417 1.00 . A A . 15 ALA HB3 1 1 28 9144 1 1 15 ALA N N 4.312 3.909 5.530 1.00 . A A . 15 ALA N 1 1 28 9145 1 1 15 ALA O O 7.770 3.276 6.200 1.00 . A A . 15 ALA O 1 1 28 9146 1 1 16 ASP C C 6.360 2.874 9.701 1.00 . A A . 16 ASP C 1 1 28 9147 1 1 16 ASP CA C 6.779 3.958 8.706 1.00 . A A . 16 ASP CA 1 1 28 9148 1 1 16 ASP CB C 6.546 5.320 9.363 1.00 . A A . 16 ASP CB 1 1 28 9149 1 1 16 ASP CG C 7.635 6.361 9.099 1.00 . A A . 16 ASP CG 1 1 28 9150 1 1 16 ASP H H 5.016 3.996 7.597 1.00 . A A . 16 ASP H 1 1 28 9151 1 1 16 ASP HA H 7.818 3.855 8.390 1.00 . A A . 16 ASP HA 1 1 28 9152 1 1 16 ASP HB2 H 5.593 5.716 9.013 1.00 . A A . 16 ASP HB2 1 1 28 9153 1 1 16 ASP HB3 H 6.455 5.176 10.440 1.00 . A A . 16 ASP HB3 1 1 28 9154 1 1 16 ASP N N 5.995 3.822 7.490 1.00 . A A . 16 ASP N 1 1 28 9155 1 1 16 ASP O O 7.085 2.586 10.652 1.00 . A A . 16 ASP O 1 1 28 9156 1 1 16 ASP OD1 O 8.821 5.988 9.232 1.00 . A A . 16 ASP OD1 1 1 28 9157 1 1 16 ASP OD2 O 7.258 7.506 8.769 1.00 . A A . 16 ASP OD2 1 1 28 9158 1 1 17 GLY C C 3.651 1.823 11.303 1.00 . A A . 17 GLY C 1 1 28 9159 1 1 17 GLY CA C 4.669 1.257 10.311 1.00 . A A . 17 GLY CA 1 1 28 9160 1 1 17 GLY H H 4.609 2.542 8.673 1.00 . A A . 17 GLY H 1 1 28 9161 1 1 17 GLY HA2 H 4.200 0.482 9.705 1.00 . A A . 17 GLY HA2 1 1 28 9162 1 1 17 GLY HA3 H 5.487 0.784 10.855 1.00 . A A . 17 GLY HA3 1 1 28 9163 1 1 17 GLY N N 5.192 2.303 9.449 1.00 . A A . 17 GLY N 1 1 28 9164 1 1 17 GLY O O 3.134 1.096 12.150 1.00 . A A . 17 GLY O 1 1 28 9165 1 1 18 ARG C C 1.024 3.630 11.502 1.00 . A A . 18 ARG C 1 1 28 9166 1 1 18 ARG CA C 2.448 3.788 12.039 1.00 . A A . 18 ARG CA 1 1 28 9167 1 1 18 ARG CB C 2.776 5.277 12.165 1.00 . A A . 18 ARG CB 1 1 28 9168 1 1 18 ARG CD C 3.134 7.330 10.745 1.00 . A A . 18 ARG CD 1 1 28 9169 1 1 18 ARG CG C 2.322 6.045 10.923 1.00 . A A . 18 ARG CG 1 1 28 9170 1 1 18 ARG CZ C 3.502 9.353 12.152 1.00 . A A . 18 ARG CZ 1 1 28 9171 1 1 18 ARG H H 3.819 3.699 10.473 1.00 . A A . 18 ARG H 1 1 28 9172 1 1 18 ARG HA H 2.560 3.293 13.004 1.00 . A A . 18 ARG HA 1 1 28 9173 1 1 18 ARG HB2 H 2.289 5.687 13.050 1.00 . A A . 18 ARG HB2 1 1 28 9174 1 1 18 ARG HB3 H 3.850 5.405 12.304 1.00 . A A . 18 ARG HB3 1 1 28 9175 1 1 18 ARG HD2 H 4.198 7.112 10.835 1.00 . A A . 18 ARG HD2 1 1 28 9176 1 1 18 ARG HD3 H 2.975 7.735 9.746 1.00 . A A . 18 ARG HD3 1 1 28 9177 1 1 18 ARG HE H 1.835 8.227 12.189 1.00 . A A . 18 ARG HE 1 1 28 9178 1 1 18 ARG HG2 H 2.433 5.415 10.040 1.00 . A A . 18 ARG HG2 1 1 28 9179 1 1 18 ARG HG3 H 1.263 6.289 11.009 1.00 . A A . 18 ARG HG3 1 1 28 9180 1 1 18 ARG HH11 H 5.047 8.888 10.914 1.00 . A A . 18 ARG HH11 1 1 28 9181 1 1 18 ARG HH12 H 5.288 10.293 11.898 1.00 . A A . 18 ARG HH12 1 1 28 9182 1 1 18 ARG HH21 H 2.152 10.080 13.488 1.00 . A A . 18 ARG HH21 1 1 28 9183 1 1 18 ARG HH22 H 3.630 10.975 13.372 1.00 . A A . 18 ARG HH22 1 1 28 9184 1 1 18 ARG N N 3.394 3.115 11.165 1.00 . A A . 18 ARG N 1 1 28 9185 1 1 18 ARG NE N 2.734 8.326 11.764 1.00 . A A . 18 ARG NE 1 1 28 9186 1 1 18 ARG NH1 N 4.715 9.526 11.609 1.00 . A A . 18 ARG NH1 1 1 28 9187 1 1 18 ARG NH2 N 3.057 10.208 13.083 1.00 . A A . 18 ARG NH2 1 1 28 9188 1 1 18 ARG O O 0.721 4.077 10.397 1.00 . A A . 18 ARG O 1 1 28 9189 1 1 19 CYS C C -1.868 4.134 11.745 1.00 . A A . 19 CYS C 1 1 28 9190 1 1 19 CYS CA C -1.195 2.772 11.930 1.00 . A A . 19 CYS CA 1 1 28 9191 1 1 19 CYS CB C -1.931 1.905 12.954 1.00 . A A . 19 CYS CB 1 1 28 9192 1 1 19 CYS H H 0.444 2.634 13.207 1.00 . A A . 19 CYS H 1 1 28 9193 1 1 19 CYS HA H -1.178 2.219 10.991 1.00 . A A . 19 CYS HA 1 1 28 9194 1 1 19 CYS HB2 H -1.834 2.369 13.937 1.00 . A A . 19 CYS HB2 1 1 28 9195 1 1 19 CYS HB3 H -2.993 1.900 12.708 1.00 . A A . 19 CYS HB3 1 1 28 9196 1 1 19 CYS N N 0.189 2.994 12.310 1.00 . A A . 19 CYS N 1 1 28 9197 1 1 19 CYS O O -2.138 4.833 12.721 1.00 . A A . 19 CYS O 1 1 28 9198 1 1 19 CYS SG S -1.344 0.176 13.061 1.00 . A A . 19 CYS SG 1 1 28 9199 1 1 20 LYS C C -4.238 5.496 9.872 1.00 . A A . 20 LYS C 1 1 28 9200 1 1 20 LYS CA C -2.756 5.736 10.166 1.00 . A A . 20 LYS CA 1 1 28 9201 1 1 20 LYS CB C -2.009 6.436 9.029 1.00 . A A . 20 LYS CB 1 1 28 9202 1 1 20 LYS CD C -0.551 8.394 8.395 1.00 . A A . 20 LYS CD 1 1 28 9203 1 1 20 LYS CE C -0.851 9.895 8.379 1.00 . A A . 20 LYS CE 1 1 28 9204 1 1 20 LYS CG C -1.303 7.697 9.531 1.00 . A A . 20 LYS CG 1 1 28 9205 1 1 20 LYS H H -1.896 3.896 9.701 1.00 . A A . 20 LYS H 1 1 28 9206 1 1 20 LYS HA H -2.677 6.375 11.045 1.00 . A A . 20 LYS HA 1 1 28 9207 1 1 20 LYS HB2 H -1.278 5.755 8.594 1.00 . A A . 20 LYS HB2 1 1 28 9208 1 1 20 LYS HB3 H -2.710 6.699 8.236 1.00 . A A . 20 LYS HB3 1 1 28 9209 1 1 20 LYS HD2 H 0.521 8.235 8.513 1.00 . A A . 20 LYS HD2 1 1 28 9210 1 1 20 LYS HD3 H -0.837 7.952 7.441 1.00 . A A . 20 LYS HD3 1 1 28 9211 1 1 20 LYS HE2 H -1.057 10.241 9.392 1.00 . A A . 20 LYS HE2 1 1 28 9212 1 1 20 LYS HE3 H 0.023 10.442 8.026 1.00 . A A . 20 LYS HE3 1 1 28 9213 1 1 20 LYS HG2 H -2.035 8.381 9.961 1.00 . A A . 20 LYS HG2 1 1 28 9214 1 1 20 LYS HG3 H -0.606 7.436 10.327 1.00 . A A . 20 LYS HG3 1 1 28 9215 1 1 20 LYS HZ1 H -2.626 9.395 7.498 1.00 . A A . 20 LYS HZ1 1 1 28 9216 1 1 20 LYS HZ2 H -2.497 10.984 7.850 1.00 . A A . 20 LYS HZ2 1 1 28 9217 1 1 20 LYS HZ3 H -1.689 10.362 6.574 1.00 . A A . 20 LYS HZ3 1 1 28 9218 1 1 20 LYS N N -2.119 4.470 10.489 1.00 . A A . 20 LYS N 1 1 28 9219 1 1 20 LYS NZ N -2.010 10.182 7.504 1.00 . A A . 20 LYS NZ 1 1 28 9220 1 1 20 LYS O O -4.667 4.354 9.720 1.00 . A A . 20 LYS O 1 1 28 9221 1 1 21 PRO C C -6.686 6.228 8.052 1.00 . A A . 21 PRO C 1 1 28 9222 1 1 21 PRO CA C -6.425 6.543 9.527 1.00 . A A . 21 PRO CA 1 1 28 9223 1 1 21 PRO CB C -6.981 7.891 9.955 1.00 . A A . 21 PRO CB 1 1 28 9224 1 1 21 PRO CD C -4.526 7.990 9.972 1.00 . A A . 21 PRO CD 1 1 28 9225 1 1 21 PRO CG C -5.790 8.834 10.013 1.00 . A A . 21 PRO CG 1 1 28 9226 1 1 21 PRO HA H -6.837 5.792 10.043 1.00 . A A . 21 PRO HA 1 1 28 9227 1 1 21 PRO HB2 H -7.727 8.249 9.245 1.00 . A A . 21 PRO HB2 1 1 28 9228 1 1 21 PRO HB3 H -7.473 7.822 10.925 1.00 . A A . 21 PRO HB3 1 1 28 9229 1 1 21 PRO HD2 H -3.875 8.292 9.152 1.00 . A A . 21 PRO HD2 1 1 28 9230 1 1 21 PRO HD3 H -3.949 8.096 10.891 1.00 . A A . 21 PRO HD3 1 1 28 9231 1 1 21 PRO HG2 H -5.812 9.529 9.174 1.00 . A A . 21 PRO HG2 1 1 28 9232 1 1 21 PRO HG3 H -5.820 9.432 10.924 1.00 . A A . 21 PRO HG3 1 1 28 9233 1 1 21 PRO N N -5.000 6.620 9.799 1.00 . A A . 21 PRO N 1 1 28 9234 1 1 21 PRO O O -5.938 6.666 7.179 1.00 . A A . 21 PRO O 1 1 28 9235 1 1 22 THR C C -9.488 5.672 6.105 1.00 . A A . 22 THR C 1 1 28 9236 1 1 22 THR CA C -8.118 5.095 6.466 1.00 . A A . 22 THR CA 1 1 28 9237 1 1 22 THR CB C -8.056 3.569 6.368 1.00 . A A . 22 THR CB 1 1 28 9238 1 1 22 THR CG2 C -8.532 3.051 5.010 1.00 . A A . 22 THR CG2 1 1 28 9239 1 1 22 THR H H -8.352 5.121 8.536 1.00 . A A . 22 THR H 1 1 28 9240 1 1 22 THR HA H -7.395 5.534 5.779 1.00 . A A . 22 THR HA 1 1 28 9241 1 1 22 THR HB H -8.614 3.104 7.181 1.00 . A A . 22 THR HB 1 1 28 9242 1 1 22 THR HG1 H -6.253 3.514 5.499 1.00 . A A . 22 THR HG1 1 1 28 9243 1 1 22 THR HG21 H -8.030 3.601 4.214 1.00 . A A . 22 THR HG21 1 1 28 9244 1 1 22 THR HG22 H -8.298 1.990 4.923 1.00 . A A . 22 THR HG22 1 1 28 9245 1 1 22 THR HG23 H -9.610 3.192 4.925 1.00 . A A . 22 THR HG23 1 1 28 9246 1 1 22 THR N N -7.749 5.473 7.820 1.00 . A A . 22 THR N 1 1 28 9247 1 1 22 THR O O -10.045 5.349 5.058 1.00 . A A . 22 THR O 1 1 28 9248 1 1 22 THR OG1 O -6.661 3.277 6.381 1.00 . A A . 22 THR OG1 1 1 28 9249 1 1 23 PHE C C -11.129 8.629 6.458 1.00 . A A . 23 PHE C 1 1 28 9250 1 1 23 PHE CA C -11.286 7.142 6.783 1.00 . A A . 23 PHE CA 1 1 28 9251 1 1 23 PHE CB C -12.070 6.998 8.089 1.00 . A A . 23 PHE CB 1 1 28 9252 1 1 23 PHE CD1 C -11.570 8.890 9.651 1.00 . A A . 23 PHE CD1 1 1 28 9253 1 1 23 PHE CD2 C -10.524 6.817 10.051 1.00 . A A . 23 PHE CD2 1 1 28 9254 1 1 23 PHE CE1 C -10.912 9.440 10.784 1.00 . A A . 23 PHE CE1 1 1 28 9255 1 1 23 PHE CE2 C -9.868 7.367 11.184 1.00 . A A . 23 PHE CE2 1 1 28 9256 1 1 23 PHE CG C -11.362 7.591 9.309 1.00 . A A . 23 PHE CG 1 1 28 9257 1 1 23 PHE CZ C -10.076 8.667 11.526 1.00 . A A . 23 PHE CZ 1 1 28 9258 1 1 23 PHE H H -9.531 6.775 7.845 1.00 . A A . 23 PHE H 1 1 28 9259 1 1 23 PHE HA H -11.756 6.635 5.942 1.00 . A A . 23 PHE HA 1 1 28 9260 1 1 23 PHE HB2 H -13.039 7.483 7.973 1.00 . A A . 23 PHE HB2 1 1 28 9261 1 1 23 PHE HB3 H -12.262 5.941 8.271 1.00 . A A . 23 PHE HB3 1 1 28 9262 1 1 23 PHE HD1 H -12.241 9.510 9.056 1.00 . A A . 23 PHE HD1 1 1 28 9263 1 1 23 PHE HD2 H -10.358 5.776 9.777 1.00 . A A . 23 PHE HD2 1 1 28 9264 1 1 23 PHE HE1 H -11.080 10.481 11.058 1.00 . A A . 23 PHE HE1 1 1 28 9265 1 1 23 PHE HE2 H -9.196 6.748 11.778 1.00 . A A . 23 PHE HE2 1 1 28 9266 1 1 23 PHE HZ H -9.571 9.088 12.395 1.00 . A A . 23 PHE HZ 1 1 28 9267 1 1 23 PHE N N -9.990 6.517 6.995 1.00 . A A . 23 PHE N 1 1 28 9268 1 1 23 PHE O O -10.090 9.224 6.739 1.00 . A A . 23 PHE O 1 1 29 9269 1 1 1 GLU C C 1.240 -7.931 9.554 1.00 . A A . 1 GLU C 1 1 29 9270 1 1 1 GLU CA C 1.201 -8.454 10.992 1.00 . A A . 1 GLU CA 1 1 29 9271 1 1 1 GLU CB C 1.034 -9.974 11.017 1.00 . A A . 1 GLU CB 1 1 29 9272 1 1 1 GLU CD C 2.159 -12.111 11.746 1.00 . A A . 1 GLU CD 1 1 29 9273 1 1 1 GLU CG C 1.994 -10.614 12.022 1.00 . A A . 1 GLU CG 1 1 29 9274 1 1 1 GLU HA H 2.123 -8.187 11.508 1.00 . A A . 1 GLU HA 1 1 29 9275 1 1 1 GLU HB2 H 0.007 -10.227 11.280 1.00 . A A . 1 GLU HB2 1 1 29 9276 1 1 1 GLU HB3 H 1.218 -10.381 10.023 1.00 . A A . 1 GLU HB3 1 1 29 9277 1 1 1 GLU HG2 H 2.965 -10.122 11.966 1.00 . A A . 1 GLU HG2 1 1 29 9278 1 1 1 GLU HG3 H 1.619 -10.466 13.034 1.00 . A A . 1 GLU HG3 1 1 29 9279 1 1 1 GLU N N 0.139 -7.800 11.737 1.00 . A A . 1 GLU N 1 1 29 9280 1 1 1 GLU O O 1.173 -8.709 8.604 1.00 . A A . 1 GLU O 1 1 29 9281 1 1 1 GLU OE1 O 1.144 -12.732 11.362 1.00 . A A . 1 GLU OE1 1 1 29 9282 1 1 1 GLU OE2 O 3.295 -12.599 11.926 1.00 . A A . 1 GLU OE2 1 1 29 9283 1 1 2 ASN C C 0.063 -6.187 7.418 1.00 . A A . 2 ASN C 1 1 29 9284 1 1 2 ASN CA C 1.399 -5.979 8.134 1.00 . A A . 2 ASN CA 1 1 29 9285 1 1 2 ASN CB C 2.501 -6.591 7.266 1.00 . A A . 2 ASN CB 1 1 29 9286 1 1 2 ASN CG C 3.600 -5.568 6.975 1.00 . A A . 2 ASN CG 1 1 29 9287 1 1 2 ASN H H 1.402 -5.989 10.217 1.00 . A A . 2 ASN H 1 1 29 9288 1 1 2 ASN HA H 1.606 -4.928 8.335 1.00 . A A . 2 ASN HA 1 1 29 9289 1 1 2 ASN HB2 H 2.929 -7.456 7.771 1.00 . A A . 2 ASN HB2 1 1 29 9290 1 1 2 ASN HB3 H 2.074 -6.948 6.328 1.00 . A A . 2 ASN HB3 1 1 29 9291 1 1 2 ASN HD21 H 4.741 -6.461 8.389 1.00 . A A . 2 ASN HD21 1 1 29 9292 1 1 2 ASN HD22 H 5.469 -5.103 7.598 1.00 . A A . 2 ASN HD22 1 1 29 9293 1 1 2 ASN N N 1.348 -6.615 9.439 1.00 . A A . 2 ASN N 1 1 29 9294 1 1 2 ASN ND2 N 4.694 -5.723 7.715 1.00 . A A . 2 ASN ND2 1 1 29 9295 1 1 2 ASN O O -0.038 -5.974 6.211 1.00 . A A . 2 ASN O 1 1 29 9296 1 1 2 ASN OD1 O 3.465 -4.695 6.132 1.00 . A A . 2 ASN OD1 1 1 29 9297 1 1 3 PHE C C -3.331 -6.196 8.524 1.00 . A A . 3 PHE C 1 1 29 9298 1 1 3 PHE CA C -2.255 -6.839 7.648 1.00 . A A . 3 PHE CA 1 1 29 9299 1 1 3 PHE CB C -2.465 -8.354 7.633 1.00 . A A . 3 PHE CB 1 1 29 9300 1 1 3 PHE CD1 C -2.580 -9.092 5.241 1.00 . A A . 3 PHE CD1 1 1 29 9301 1 1 3 PHE CD2 C -4.574 -9.085 6.495 1.00 . A A . 3 PHE CD2 1 1 29 9302 1 1 3 PHE CE1 C -3.293 -9.564 4.109 1.00 . A A . 3 PHE CE1 1 1 29 9303 1 1 3 PHE CE2 C -5.287 -9.557 5.362 1.00 . A A . 3 PHE CE2 1 1 29 9304 1 1 3 PHE CG C -3.235 -8.863 6.411 1.00 . A A . 3 PHE CG 1 1 29 9305 1 1 3 PHE CZ C -4.633 -9.786 4.194 1.00 . A A . 3 PHE CZ 1 1 29 9306 1 1 3 PHE H H -0.839 -6.771 9.174 1.00 . A A . 3 PHE H 1 1 29 9307 1 1 3 PHE HA H -2.282 -6.391 6.655 1.00 . A A . 3 PHE HA 1 1 29 9308 1 1 3 PHE HB2 H -1.493 -8.846 7.666 1.00 . A A . 3 PHE HB2 1 1 29 9309 1 1 3 PHE HB3 H -3.002 -8.646 8.535 1.00 . A A . 3 PHE HB3 1 1 29 9310 1 1 3 PHE HD1 H -1.506 -8.913 5.174 1.00 . A A . 3 PHE HD1 1 1 29 9311 1 1 3 PHE HD2 H -5.099 -8.902 7.433 1.00 . A A . 3 PHE HD2 1 1 29 9312 1 1 3 PHE HE1 H -2.768 -9.747 3.171 1.00 . A A . 3 PHE HE1 1 1 29 9313 1 1 3 PHE HE2 H -6.361 -9.736 5.430 1.00 . A A . 3 PHE HE2 1 1 29 9314 1 1 3 PHE HZ H -5.181 -10.149 3.323 1.00 . A A . 3 PHE HZ 1 1 29 9315 1 1 3 PHE N N -0.929 -6.600 8.193 1.00 . A A . 3 PHE N 1 1 29 9316 1 1 3 PHE O O -4.159 -5.429 8.034 1.00 . A A . 3 PHE O 1 1 29 9317 1 1 4 ASN C C -4.051 -6.676 12.111 1.00 . A A . 4 ASN C 1 1 29 9318 1 1 4 ASN CA C -4.248 -5.997 10.754 1.00 . A A . 4 ASN CA 1 1 29 9319 1 1 4 ASN CB C -5.682 -6.265 10.295 1.00 . A A . 4 ASN CB 1 1 29 9320 1 1 4 ASN CG C -6.579 -5.055 10.562 1.00 . A A . 4 ASN CG 1 1 29 9321 1 1 4 ASN H H -2.610 -7.157 10.196 1.00 . A A . 4 ASN H 1 1 29 9322 1 1 4 ASN HA H -4.048 -4.926 10.790 1.00 . A A . 4 ASN HA 1 1 29 9323 1 1 4 ASN HB2 H -5.689 -6.501 9.231 1.00 . A A . 4 ASN HB2 1 1 29 9324 1 1 4 ASN HB3 H -6.077 -7.138 10.816 1.00 . A A . 4 ASN HB3 1 1 29 9325 1 1 4 ASN HD21 H -6.446 -5.453 12.542 1.00 . A A . 4 ASN HD21 1 1 29 9326 1 1 4 ASN HD22 H -7.410 -4.075 12.127 1.00 . A A . 4 ASN HD22 1 1 29 9327 1 1 4 ASN N N -3.286 -6.532 9.804 1.00 . A A . 4 ASN N 1 1 29 9328 1 1 4 ASN ND2 N -6.833 -4.844 11.850 1.00 . A A . 4 ASN ND2 1 1 29 9329 1 1 4 ASN O O -5.021 -7.002 12.793 1.00 . A A . 4 ASN O 1 1 29 9330 1 1 4 ASN OD1 O -7.012 -4.359 9.658 1.00 . A A . 4 ASN OD1 1 1 29 9331 1 1 5 GLY C C -1.691 -6.537 14.638 1.00 . A A . 5 GLY C 1 1 29 9332 1 1 5 GLY CA C -2.451 -7.503 13.725 1.00 . A A . 5 GLY CA 1 1 29 9333 1 1 5 GLY H H -2.004 -6.600 11.901 1.00 . A A . 5 GLY H 1 1 29 9334 1 1 5 GLY HA2 H -3.361 -7.838 14.222 1.00 . A A . 5 GLY HA2 1 1 29 9335 1 1 5 GLY HA3 H -1.843 -8.388 13.542 1.00 . A A . 5 GLY HA3 1 1 29 9336 1 1 5 GLY N N -2.788 -6.869 12.462 1.00 . A A . 5 GLY N 1 1 29 9337 1 1 5 GLY O O -0.760 -6.938 15.334 1.00 . A A . 5 GLY O 1 1 29 9338 1 1 6 GLY C C -2.384 -3.021 15.531 1.00 . A A . 6 GLY C 1 1 29 9339 1 1 6 GLY CA C -1.491 -4.257 15.421 1.00 . A A . 6 GLY CA 1 1 29 9340 1 1 6 GLY H H -2.877 -4.965 14.036 1.00 . A A . 6 GLY H 1 1 29 9341 1 1 6 GLY HA2 H -1.287 -4.652 16.416 1.00 . A A . 6 GLY HA2 1 1 29 9342 1 1 6 GLY HA3 H -0.530 -3.979 14.986 1.00 . A A . 6 GLY HA3 1 1 29 9343 1 1 6 GLY N N -2.119 -5.283 14.605 1.00 . A A . 6 GLY N 1 1 29 9344 1 1 6 GLY O O -2.660 -2.544 16.631 1.00 . A A . 6 GLY O 1 1 29 9345 1 1 7 CYS C C -4.895 -1.627 15.205 1.00 . A A . 7 CYS C 1 1 29 9346 1 1 7 CYS CA C -3.671 -1.364 14.326 1.00 . A A . 7 CYS CA 1 1 29 9347 1 1 7 CYS CB C -4.064 -1.009 12.891 1.00 . A A . 7 CYS CB 1 1 29 9348 1 1 7 CYS H H -2.585 -2.929 13.484 1.00 . A A . 7 CYS H 1 1 29 9349 1 1 7 CYS HA H -3.086 -0.531 14.717 1.00 . A A . 7 CYS HA 1 1 29 9350 1 1 7 CYS HB2 H -4.375 -1.919 12.379 1.00 . A A . 7 CYS HB2 1 1 29 9351 1 1 7 CYS HB3 H -4.930 -0.348 12.919 1.00 . A A . 7 CYS HB3 1 1 29 9352 1 1 7 CYS N N -2.813 -2.536 14.375 1.00 . A A . 7 CYS N 1 1 29 9353 1 1 7 CYS O O -5.024 -2.702 15.790 1.00 . A A . 7 CYS O 1 1 29 9354 1 1 7 CYS SG S -2.745 -0.205 11.910 1.00 . A A . 7 CYS SG 1 1 29 9355 1 1 8 LEU C C -8.014 -1.553 15.298 1.00 . A A . 8 LEU C 1 1 29 9356 1 1 8 LEU CA C -6.972 -0.739 16.068 1.00 . A A . 8 LEU CA 1 1 29 9357 1 1 8 LEU CB C -7.464 0.647 16.491 1.00 . A A . 8 LEU CB 1 1 29 9358 1 1 8 LEU CD1 C -8.860 -0.237 18.396 1.00 . A A . 8 LEU CD1 1 1 29 9359 1 1 8 LEU CD2 C -9.209 2.128 17.548 1.00 . A A . 8 LEU CD2 1 1 29 9360 1 1 8 LEU CG C -8.829 0.693 17.182 1.00 . A A . 8 LEU CG 1 1 29 9361 1 1 8 LEU H H -5.650 0.242 14.792 1.00 . A A . 8 LEU H 1 1 29 9362 1 1 8 LEU HA H -6.715 -1.281 16.979 1.00 . A A . 8 LEU HA 1 1 29 9363 1 1 8 LEU HB2 H -6.725 1.085 17.161 1.00 . A A . 8 LEU HB2 1 1 29 9364 1 1 8 LEU HB3 H -7.506 1.282 15.605 1.00 . A A . 8 LEU HB3 1 1 29 9365 1 1 8 LEU HD11 H -8.353 -1.171 18.152 1.00 . A A . 8 LEU HD11 1 1 29 9366 1 1 8 LEU HD12 H -8.354 0.243 19.234 1.00 . A A . 8 LEU HD12 1 1 29 9367 1 1 8 LEU HD13 H -9.894 -0.445 18.668 1.00 . A A . 8 LEU HD13 1 1 29 9368 1 1 8 LEU HD21 H -8.468 2.816 17.143 1.00 . A A . 8 LEU HD21 1 1 29 9369 1 1 8 LEU HD22 H -10.189 2.363 17.130 1.00 . A A . 8 LEU HD22 1 1 29 9370 1 1 8 LEU HD23 H -9.244 2.230 18.634 1.00 . A A . 8 LEU HD23 1 1 29 9371 1 1 8 LEU HG H -9.580 0.330 16.479 1.00 . A A . 8 LEU HG 1 1 29 9372 1 1 8 LEU N N -5.763 -0.628 15.270 1.00 . A A . 8 LEU N 1 1 29 9373 1 1 8 LEU O O -8.488 -2.579 15.783 1.00 . A A . 8 LEU O 1 1 29 9374 1 1 9 ALA C C -9.834 -0.751 12.215 1.00 . A A . 9 ALA C 1 1 29 9375 1 1 9 ALA CA C -9.315 -1.733 13.267 1.00 . A A . 9 ALA CA 1 1 29 9376 1 1 9 ALA CB C -10.438 -2.301 14.138 1.00 . A A . 9 ALA CB 1 1 29 9377 1 1 9 ALA H H -7.948 -0.229 13.723 1.00 . A A . 9 ALA H 1 1 29 9378 1 1 9 ALA HA H -8.811 -2.558 12.764 1.00 . A A . 9 ALA HA 1 1 29 9379 1 1 9 ALA HB1 H -10.574 -1.667 15.014 1.00 . A A . 9 ALA HB1 1 1 29 9380 1 1 9 ALA HB2 H -11.364 -2.331 13.564 1.00 . A A . 9 ALA HB2 1 1 29 9381 1 1 9 ALA HB3 H -10.176 -3.310 14.457 1.00 . A A . 9 ALA HB3 1 1 29 9382 1 1 9 ALA N N -8.339 -1.064 14.110 1.00 . A A . 9 ALA N 1 1 29 9383 1 1 9 ALA O O -10.832 -0.066 12.439 1.00 . A A . 9 ALA O 1 1 29 9384 1 1 10 GLY C C -8.315 1.006 9.535 1.00 . A A . 10 GLY C 1 1 29 9385 1 1 10 GLY CA C -9.510 0.176 10.005 1.00 . A A . 10 GLY CA 1 1 29 9386 1 1 10 GLY H H -8.323 -1.272 10.918 1.00 . A A . 10 GLY H 1 1 29 9387 1 1 10 GLY HA2 H -9.901 -0.410 9.171 1.00 . A A . 10 GLY HA2 1 1 29 9388 1 1 10 GLY HA3 H -10.311 0.838 10.332 1.00 . A A . 10 GLY HA3 1 1 29 9389 1 1 10 GLY N N -9.133 -0.712 11.091 1.00 . A A . 10 GLY N 1 1 29 9390 1 1 10 GLY O O -8.168 1.271 8.343 1.00 . A A . 10 GLY O 1 1 29 9391 1 1 11 TYR C C -5.417 1.480 9.179 1.00 . A A . 11 TYR C 1 1 29 9392 1 1 11 TYR CA C -6.312 2.189 10.197 1.00 . A A . 11 TYR CA 1 1 29 9393 1 1 11 TYR CB C -5.550 2.331 11.517 1.00 . A A . 11 TYR CB 1 1 29 9394 1 1 11 TYR CD1 C -7.178 2.673 13.412 1.00 . A A . 11 TYR CD1 1 1 29 9395 1 1 11 TYR CD2 C -5.954 4.565 12.612 1.00 . A A . 11 TYR CD2 1 1 29 9396 1 1 11 TYR CE1 C -7.837 3.509 14.381 1.00 . A A . 11 TYR CE1 1 1 29 9397 1 1 11 TYR CE2 C -6.614 5.401 13.582 1.00 . A A . 11 TYR CE2 1 1 29 9398 1 1 11 TYR CG C -6.250 3.218 12.547 1.00 . A A . 11 TYR CG 1 1 29 9399 1 1 11 TYR CZ C -7.522 4.832 14.418 1.00 . A A . 11 TYR CZ 1 1 29 9400 1 1 11 TYR H H -7.617 1.174 11.464 1.00 . A A . 11 TYR H 1 1 29 9401 1 1 11 TYR HA H -6.644 3.139 9.778 1.00 . A A . 11 TYR HA 1 1 29 9402 1 1 11 TYR HB2 H -5.403 1.339 11.947 1.00 . A A . 11 TYR HB2 1 1 29 9403 1 1 11 TYR HB3 H -4.561 2.739 11.312 1.00 . A A . 11 TYR HB3 1 1 29 9404 1 1 11 TYR HD1 H -7.412 1.610 13.360 1.00 . A A . 11 TYR HD1 1 1 29 9405 1 1 11 TYR HD2 H -5.223 4.996 11.929 1.00 . A A . 11 TYR HD2 1 1 29 9406 1 1 11 TYR HE1 H -8.571 3.091 15.070 1.00 . A A . 11 TYR HE1 1 1 29 9407 1 1 11 TYR HE2 H -6.390 6.466 13.644 1.00 . A A . 11 TYR HE2 1 1 29 9408 1 1 11 TYR HH H -9.051 5.883 15.002 1.00 . A A . 11 TYR HH 1 1 29 9409 1 1 11 TYR N N -7.490 1.395 10.497 1.00 . A A . 11 TYR N 1 1 29 9410 1 1 11 TYR O O -5.479 0.260 9.036 1.00 . A A . 11 TYR O 1 1 29 9411 1 1 11 TYR OH O -8.145 5.622 15.334 1.00 . A A . 11 TYR OH 1 1 29 9412 1 1 12 MET C C -2.246 1.810 7.979 1.00 . A A . 12 MET C 1 1 29 9413 1 1 12 MET CA C -3.696 1.739 7.498 1.00 . A A . 12 MET CA 1 1 29 9414 1 1 12 MET CB C -3.843 2.533 6.198 1.00 . A A . 12 MET CB 1 1 29 9415 1 1 12 MET CE C -3.475 6.607 5.634 1.00 . A A . 12 MET CE 1 1 29 9416 1 1 12 MET CG C -3.884 4.037 6.474 1.00 . A A . 12 MET CG 1 1 29 9417 1 1 12 MET H H -4.559 3.267 8.621 1.00 . A A . 12 MET H 1 1 29 9418 1 1 12 MET HA H -3.992 0.698 7.364 1.00 . A A . 12 MET HA 1 1 29 9419 1 1 12 MET HB2 H -3.011 2.304 5.532 1.00 . A A . 12 MET HB2 1 1 29 9420 1 1 12 MET HB3 H -4.755 2.229 5.684 1.00 . A A . 12 MET HB3 1 1 29 9421 1 1 12 MET HE1 H -4.108 6.656 6.520 1.00 . A A . 12 MET HE1 1 1 29 9422 1 1 12 MET HE2 H -2.456 6.889 5.901 1.00 . A A . 12 MET HE2 1 1 29 9423 1 1 12 MET HE3 H -3.856 7.291 4.877 1.00 . A A . 12 MET HE3 1 1 29 9424 1 1 12 MET HG2 H -4.874 4.323 6.829 1.00 . A A . 12 MET HG2 1 1 29 9425 1 1 12 MET HG3 H -3.177 4.287 7.266 1.00 . A A . 12 MET HG3 1 1 29 9426 1 1 12 MET N N -4.603 2.275 8.498 1.00 . A A . 12 MET N 1 1 29 9427 1 1 12 MET O O -1.925 2.579 8.883 1.00 . A A . 12 MET O 1 1 29 9428 1 1 12 MET SD S -3.482 4.942 4.990 1.00 . A A . 12 MET SD 1 1 29 9429 1 1 13 ARG C C 0.815 1.814 6.732 1.00 . A A . 13 ARG C 1 1 29 9430 1 1 13 ARG CA C 0.001 0.958 7.704 1.00 . A A . 13 ARG CA 1 1 29 9431 1 1 13 ARG CB C 0.534 -0.476 7.681 1.00 . A A . 13 ARG CB 1 1 29 9432 1 1 13 ARG CD C 0.809 -1.943 9.714 1.00 . A A . 13 ARG CD 1 1 29 9433 1 1 13 ARG CG C -0.184 -1.345 8.715 1.00 . A A . 13 ARG CG 1 1 29 9434 1 1 13 ARG CZ C 0.846 -3.883 11.277 1.00 . A A . 13 ARG CZ 1 1 29 9435 1 1 13 ARG H H -1.678 0.375 6.617 1.00 . A A . 13 ARG H 1 1 29 9436 1 1 13 ARG HA H 0.047 1.362 8.716 1.00 . A A . 13 ARG HA 1 1 29 9437 1 1 13 ARG HB2 H 0.400 -0.901 6.687 1.00 . A A . 13 ARG HB2 1 1 29 9438 1 1 13 ARG HB3 H 1.605 -0.472 7.885 1.00 . A A . 13 ARG HB3 1 1 29 9439 1 1 13 ARG HD2 H 1.751 -2.165 9.213 1.00 . A A . 13 ARG HD2 1 1 29 9440 1 1 13 ARG HD3 H 1.028 -1.219 10.499 1.00 . A A . 13 ARG HD3 1 1 29 9441 1 1 13 ARG HE H -0.631 -3.506 9.963 1.00 . A A . 13 ARG HE 1 1 29 9442 1 1 13 ARG HG2 H -0.924 -0.747 9.247 1.00 . A A . 13 ARG HG2 1 1 29 9443 1 1 13 ARG HG3 H -0.724 -2.146 8.210 1.00 . A A . 13 ARG HG3 1 1 29 9444 1 1 13 ARG HH11 H 2.460 -2.653 11.412 1.00 . A A . 13 ARG HH11 1 1 29 9445 1 1 13 ARG HH12 H 2.472 -4.006 12.493 1.00 . A A . 13 ARG HH12 1 1 29 9446 1 1 13 ARG HH21 H -0.616 -5.292 11.388 1.00 . A A . 13 ARG HH21 1 1 29 9447 1 1 13 ARG HH22 H 0.710 -5.517 12.480 1.00 . A A . 13 ARG HH22 1 1 29 9448 1 1 13 ARG N N -1.408 0.997 7.352 1.00 . A A . 13 ARG N 1 1 29 9449 1 1 13 ARG NE N 0.249 -3.178 10.307 1.00 . A A . 13 ARG NE 1 1 29 9450 1 1 13 ARG NH1 N 2.026 -3.480 11.769 1.00 . A A . 13 ARG NH1 1 1 29 9451 1 1 13 ARG NH2 N 0.264 -4.991 11.756 1.00 . A A . 13 ARG NH2 1 1 29 9452 1 1 13 ARG O O 1.044 1.416 5.591 1.00 . A A . 13 ARG O 1 1 29 9453 1 1 14 THR C C 3.371 3.267 6.063 1.00 . A A . 14 THR C 1 1 29 9454 1 1 14 THR CA C 2.016 3.889 6.408 1.00 . A A . 14 THR CA 1 1 29 9455 1 1 14 THR CB C 2.129 5.214 7.164 1.00 . A A . 14 THR CB 1 1 29 9456 1 1 14 THR CG2 C 0.764 5.789 7.545 1.00 . A A . 14 THR CG2 1 1 29 9457 1 1 14 THR H H 1.042 3.290 8.149 1.00 . A A . 14 THR H 1 1 29 9458 1 1 14 THR HA H 1.490 4.050 5.467 1.00 . A A . 14 THR HA 1 1 29 9459 1 1 14 THR HB H 2.711 5.938 6.594 1.00 . A A . 14 THR HB 1 1 29 9460 1 1 14 THR HG1 H 3.304 5.592 8.740 1.00 . A A . 14 THR HG1 1 1 29 9461 1 1 14 THR HG21 H 0.215 5.058 8.141 1.00 . A A . 14 THR HG21 1 1 29 9462 1 1 14 THR HG22 H 0.902 6.700 8.126 1.00 . A A . 14 THR HG22 1 1 29 9463 1 1 14 THR HG23 H 0.199 6.016 6.642 1.00 . A A . 14 THR HG23 1 1 29 9464 1 1 14 THR N N 1.231 2.974 7.220 1.00 . A A . 14 THR N 1 1 29 9465 1 1 14 THR O O 3.550 2.056 6.176 1.00 . A A . 14 THR O 1 1 29 9466 1 1 14 THR OG1 O 2.715 4.853 8.412 1.00 . A A . 14 THR OG1 1 1 29 9467 1 1 15 ALA C C 6.536 3.761 6.512 1.00 . A A . 15 ALA C 1 1 29 9468 1 1 15 ALA CA C 5.625 3.678 5.287 1.00 . A A . 15 ALA CA 1 1 29 9469 1 1 15 ALA CB C 6.145 4.514 4.116 1.00 . A A . 15 ALA CB 1 1 29 9470 1 1 15 ALA H H 4.137 5.111 5.559 1.00 . A A . 15 ALA H 1 1 29 9471 1 1 15 ALA HA H 5.551 2.637 4.969 1.00 . A A . 15 ALA HA 1 1 29 9472 1 1 15 ALA HB1 H 5.308 5.006 3.620 1.00 . A A . 15 ALA HB1 1 1 29 9473 1 1 15 ALA HB2 H 6.840 5.266 4.487 1.00 . A A . 15 ALA HB2 1 1 29 9474 1 1 15 ALA HB3 H 6.656 3.866 3.405 1.00 . A A . 15 ALA HB3 1 1 29 9475 1 1 15 ALA N N 4.291 4.126 5.648 1.00 . A A . 15 ALA N 1 1 29 9476 1 1 15 ALA O O 7.758 3.816 6.379 1.00 . A A . 15 ALA O 1 1 29 9477 1 1 16 ASP C C 6.158 2.744 9.871 1.00 . A A . 16 ASP C 1 1 29 9478 1 1 16 ASP CA C 6.646 3.845 8.927 1.00 . A A . 16 ASP CA 1 1 29 9479 1 1 16 ASP CB C 6.425 5.192 9.617 1.00 . A A . 16 ASP CB 1 1 29 9480 1 1 16 ASP CG C 7.363 5.479 10.791 1.00 . A A . 16 ASP CG 1 1 29 9481 1 1 16 ASP H H 4.913 3.724 7.778 1.00 . A A . 16 ASP H 1 1 29 9482 1 1 16 ASP HA H 7.693 3.721 8.648 1.00 . A A . 16 ASP HA 1 1 29 9483 1 1 16 ASP HB2 H 6.539 5.985 8.878 1.00 . A A . 16 ASP HB2 1 1 29 9484 1 1 16 ASP HB3 H 5.396 5.236 9.974 1.00 . A A . 16 ASP HB3 1 1 29 9485 1 1 16 ASP N N 5.907 3.769 7.678 1.00 . A A . 16 ASP N 1 1 29 9486 1 1 16 ASP O O 6.562 2.693 11.032 1.00 . A A . 16 ASP O 1 1 29 9487 1 1 16 ASP OD1 O 8.485 4.929 10.769 1.00 . A A . 16 ASP OD1 1 1 29 9488 1 1 16 ASP OD2 O 6.937 6.242 11.685 1.00 . A A . 16 ASP OD2 1 1 29 9489 1 1 17 GLY C C 3.721 1.303 11.132 1.00 . A A . 17 GLY C 1 1 29 9490 1 1 17 GLY CA C 4.749 0.794 10.118 1.00 . A A . 17 GLY CA 1 1 29 9491 1 1 17 GLY H H 4.974 1.939 8.393 1.00 . A A . 17 GLY H 1 1 29 9492 1 1 17 GLY HA2 H 4.281 0.068 9.454 1.00 . A A . 17 GLY HA2 1 1 29 9493 1 1 17 GLY HA3 H 5.554 0.277 10.640 1.00 . A A . 17 GLY HA3 1 1 29 9494 1 1 17 GLY N N 5.297 1.891 9.338 1.00 . A A . 17 GLY N 1 1 29 9495 1 1 17 GLY O O 3.271 0.552 11.996 1.00 . A A . 17 GLY O 1 1 29 9496 1 1 18 ARG C C 0.996 2.747 11.526 1.00 . A A . 18 ARG C 1 1 29 9497 1 1 18 ARG CA C 2.415 3.194 11.885 1.00 . A A . 18 ARG CA 1 1 29 9498 1 1 18 ARG CB C 2.496 4.720 11.812 1.00 . A A . 18 ARG CB 1 1 29 9499 1 1 18 ARG CD C 2.252 5.983 13.981 1.00 . A A . 18 ARG CD 1 1 29 9500 1 1 18 ARG CG C 3.228 5.290 13.028 1.00 . A A . 18 ARG CG 1 1 29 9501 1 1 18 ARG CZ C 2.498 7.292 16.087 1.00 . A A . 18 ARG CZ 1 1 29 9502 1 1 18 ARG H H 3.750 3.180 10.286 1.00 . A A . 18 ARG H 1 1 29 9503 1 1 18 ARG HA H 2.695 2.848 12.880 1.00 . A A . 18 ARG HA 1 1 29 9504 1 1 18 ARG HB2 H 3.013 5.017 10.899 1.00 . A A . 18 ARG HB2 1 1 29 9505 1 1 18 ARG HB3 H 1.491 5.139 11.759 1.00 . A A . 18 ARG HB3 1 1 29 9506 1 1 18 ARG HD2 H 1.538 6.580 13.413 1.00 . A A . 18 ARG HD2 1 1 29 9507 1 1 18 ARG HD3 H 1.678 5.239 14.532 1.00 . A A . 18 ARG HD3 1 1 29 9508 1 1 18 ARG HE H 3.926 7.119 14.679 1.00 . A A . 18 ARG HE 1 1 29 9509 1 1 18 ARG HG2 H 3.747 4.488 13.553 1.00 . A A . 18 ARG HG2 1 1 29 9510 1 1 18 ARG HG3 H 3.988 6.000 12.700 1.00 . A A . 18 ARG HG3 1 1 29 9511 1 1 18 ARG HH11 H 0.698 6.372 15.865 1.00 . A A . 18 ARG HH11 1 1 29 9512 1 1 18 ARG HH12 H 0.884 7.285 17.324 1.00 . A A . 18 ARG HH12 1 1 29 9513 1 1 18 ARG HH21 H 4.172 8.324 16.605 1.00 . A A . 18 ARG HH21 1 1 29 9514 1 1 18 ARG HH22 H 2.873 8.404 17.748 1.00 . A A . 18 ARG HH22 1 1 29 9515 1 1 18 ARG N N 3.380 2.576 10.992 1.00 . A A . 18 ARG N 1 1 29 9516 1 1 18 ARG NE N 2.995 6.848 14.925 1.00 . A A . 18 ARG NE 1 1 29 9517 1 1 18 ARG NH1 N 1.255 6.954 16.457 1.00 . A A . 18 ARG NH1 1 1 29 9518 1 1 18 ARG NH2 N 3.244 8.073 16.881 1.00 . A A . 18 ARG NH2 1 1 29 9519 1 1 18 ARG O O 0.814 1.840 10.716 1.00 . A A . 18 ARG O 1 1 29 9520 1 1 19 CYS C C -2.128 4.398 11.681 1.00 . A A . 19 CYS C 1 1 29 9521 1 1 19 CYS CA C -1.368 3.088 11.902 1.00 . A A . 19 CYS CA 1 1 29 9522 1 1 19 CYS CB C -1.970 2.266 13.044 1.00 . A A . 19 CYS CB 1 1 29 9523 1 1 19 CYS H H 0.185 4.143 12.804 1.00 . A A . 19 CYS H 1 1 29 9524 1 1 19 CYS HA H -1.397 2.469 11.006 1.00 . A A . 19 CYS HA 1 1 29 9525 1 1 19 CYS HB2 H -1.814 2.803 13.980 1.00 . A A . 19 CYS HB2 1 1 29 9526 1 1 19 CYS HB3 H -3.046 2.193 12.892 1.00 . A A . 19 CYS HB3 1 1 29 9527 1 1 19 CYS N N 0.028 3.406 12.146 1.00 . A A . 19 CYS N 1 1 29 9528 1 1 19 CYS O O -2.575 5.029 12.637 1.00 . A A . 19 CYS O 1 1 29 9529 1 1 19 CYS SG S -1.285 0.577 13.216 1.00 . A A . 19 CYS SG 1 1 29 9530 1 1 20 LYS C C -4.416 5.670 9.772 1.00 . A A . 20 LYS C 1 1 29 9531 1 1 20 LYS CA C -2.947 5.990 10.055 1.00 . A A . 20 LYS CA 1 1 29 9532 1 1 20 LYS CB C -2.236 6.692 8.896 1.00 . A A . 20 LYS CB 1 1 29 9533 1 1 20 LYS CD C -0.475 7.624 10.442 1.00 . A A . 20 LYS CD 1 1 29 9534 1 1 20 LYS CE C 0.143 8.898 11.021 1.00 . A A . 20 LYS CE 1 1 29 9535 1 1 20 LYS CG C -1.522 7.956 9.377 1.00 . A A . 20 LYS CG 1 1 29 9536 1 1 20 LYS H H -1.884 4.247 9.642 1.00 . A A . 20 LYS H 1 1 29 9537 1 1 20 LYS HA H -2.899 6.658 10.915 1.00 . A A . 20 LYS HA 1 1 29 9538 1 1 20 LYS HB2 H -1.515 6.012 8.442 1.00 . A A . 20 LYS HB2 1 1 29 9539 1 1 20 LYS HB3 H -2.960 6.950 8.123 1.00 . A A . 20 LYS HB3 1 1 29 9540 1 1 20 LYS HD2 H -0.937 7.044 11.242 1.00 . A A . 20 LYS HD2 1 1 29 9541 1 1 20 LYS HD3 H 0.307 7.001 10.007 1.00 . A A . 20 LYS HD3 1 1 29 9542 1 1 20 LYS HE2 H 0.313 9.621 10.223 1.00 . A A . 20 LYS HE2 1 1 29 9543 1 1 20 LYS HE3 H -0.551 9.358 11.725 1.00 . A A . 20 LYS HE3 1 1 29 9544 1 1 20 LYS HG2 H -1.041 8.450 8.532 1.00 . A A . 20 LYS HG2 1 1 29 9545 1 1 20 LYS HG3 H -2.250 8.658 9.784 1.00 . A A . 20 LYS HG3 1 1 29 9546 1 1 20 LYS HZ1 H 1.557 7.601 11.725 1.00 . A A . 20 LYS HZ1 1 1 29 9547 1 1 20 LYS HZ2 H 2.175 9.021 11.204 1.00 . A A . 20 LYS HZ2 1 1 29 9548 1 1 20 LYS HZ3 H 1.393 8.946 12.637 1.00 . A A . 20 LYS HZ3 1 1 29 9549 1 1 20 LYS N N -2.250 4.767 10.414 1.00 . A A . 20 LYS N 1 1 29 9550 1 1 20 LYS NZ N 1.420 8.592 11.702 1.00 . A A . 20 LYS NZ 1 1 29 9551 1 1 20 LYS O O -4.786 4.505 9.630 1.00 . A A . 20 LYS O 1 1 29 9552 1 1 21 PRO C C -6.908 6.263 7.962 1.00 . A A . 21 PRO C 1 1 29 9553 1 1 21 PRO CA C -6.656 6.599 9.433 1.00 . A A . 21 PRO CA 1 1 29 9554 1 1 21 PRO CB C -7.280 7.920 9.856 1.00 . A A . 21 PRO CB 1 1 29 9555 1 1 21 PRO CD C -4.834 8.147 9.859 1.00 . A A . 21 PRO CD 1 1 29 9556 1 1 21 PRO CG C -6.140 8.923 9.903 1.00 . A A . 21 PRO CG 1 1 29 9557 1 1 21 PRO HA H -7.025 5.831 9.956 1.00 . A A . 21 PRO HA 1 1 29 9558 1 1 21 PRO HB2 H -8.048 8.232 9.149 1.00 . A A . 21 PRO HB2 1 1 29 9559 1 1 21 PRO HB3 H -7.761 7.830 10.830 1.00 . A A . 21 PRO HB3 1 1 29 9560 1 1 21 PRO HD2 H -4.204 8.476 9.032 1.00 . A A . 21 PRO HD2 1 1 29 9561 1 1 21 PRO HD3 H -4.258 8.288 10.775 1.00 . A A . 21 PRO HD3 1 1 29 9562 1 1 21 PRO HG2 H -6.203 9.612 9.060 1.00 . A A . 21 PRO HG2 1 1 29 9563 1 1 21 PRO HG3 H -6.196 9.524 10.810 1.00 . A A . 21 PRO HG3 1 1 29 9564 1 1 21 PRO N N -5.236 6.753 9.696 1.00 . A A . 21 PRO N 1 1 29 9565 1 1 21 PRO O O -6.231 6.784 7.077 1.00 . A A . 21 PRO O 1 1 29 9566 1 1 22 THR C C -9.492 5.716 5.925 1.00 . A A . 22 THR C 1 1 29 9567 1 1 22 THR CA C -8.235 4.982 6.396 1.00 . A A . 22 THR CA 1 1 29 9568 1 1 22 THR CB C -8.381 3.459 6.390 1.00 . A A . 22 THR CB 1 1 29 9569 1 1 22 THR CG2 C -8.318 2.872 4.980 1.00 . A A . 22 THR CG2 1 1 29 9570 1 1 22 THR H H -8.432 4.975 8.470 1.00 . A A . 22 THR H 1 1 29 9571 1 1 22 THR HA H -7.425 5.273 5.727 1.00 . A A . 22 THR HA 1 1 29 9572 1 1 22 THR HB H -9.296 3.154 6.899 1.00 . A A . 22 THR HB 1 1 29 9573 1 1 22 THR HG1 H -6.410 3.118 6.400 1.00 . A A . 22 THR HG1 1 1 29 9574 1 1 22 THR HG21 H -7.431 3.245 4.470 1.00 . A A . 22 THR HG21 1 1 29 9575 1 1 22 THR HG22 H -8.270 1.784 5.041 1.00 . A A . 22 THR HG22 1 1 29 9576 1 1 22 THR HG23 H -9.208 3.165 4.423 1.00 . A A . 22 THR HG23 1 1 29 9577 1 1 22 THR N N -7.885 5.394 7.746 1.00 . A A . 22 THR N 1 1 29 9578 1 1 22 THR O O -10.039 5.401 4.868 1.00 . A A . 22 THR O 1 1 29 9579 1 1 22 THR OG1 O -7.188 2.994 7.015 1.00 . A A . 22 THR OG1 1 1 29 9580 1 1 23 PHE C C -11.173 7.746 4.907 1.00 . A A . 23 PHE C 1 1 29 9581 1 1 23 PHE CA C -11.096 7.460 6.407 1.00 . A A . 23 PHE CA 1 1 29 9582 1 1 23 PHE CB C -10.976 8.786 7.162 1.00 . A A . 23 PHE CB 1 1 29 9583 1 1 23 PHE CD1 C -11.189 7.550 9.328 1.00 . A A . 23 PHE CD1 1 1 29 9584 1 1 23 PHE CD2 C -9.973 9.567 9.319 1.00 . A A . 23 PHE CD2 1 1 29 9585 1 1 23 PHE CE1 C -10.936 7.403 10.718 1.00 . A A . 23 PHE CE1 1 1 29 9586 1 1 23 PHE CE2 C -9.720 9.421 10.709 1.00 . A A . 23 PHE CE2 1 1 29 9587 1 1 23 PHE CG C -10.704 8.628 8.659 1.00 . A A . 23 PHE CG 1 1 29 9588 1 1 23 PHE CZ C -10.206 8.342 11.379 1.00 . A A . 23 PHE CZ 1 1 29 9589 1 1 23 PHE H H -9.464 6.930 7.587 1.00 . A A . 23 PHE H 1 1 29 9590 1 1 23 PHE HA H -11.964 6.872 6.708 1.00 . A A . 23 PHE HA 1 1 29 9591 1 1 23 PHE HB2 H -10.174 9.374 6.716 1.00 . A A . 23 PHE HB2 1 1 29 9592 1 1 23 PHE HB3 H -11.898 9.352 7.029 1.00 . A A . 23 PHE HB3 1 1 29 9593 1 1 23 PHE HD1 H -11.773 6.797 8.799 1.00 . A A . 23 PHE HD1 1 1 29 9594 1 1 23 PHE HD2 H -9.584 10.432 8.782 1.00 . A A . 23 PHE HD2 1 1 29 9595 1 1 23 PHE HE1 H -11.326 6.538 11.255 1.00 . A A . 23 PHE HE1 1 1 29 9596 1 1 23 PHE HE2 H -9.135 10.173 11.238 1.00 . A A . 23 PHE HE2 1 1 29 9597 1 1 23 PHE HZ H -10.011 8.229 12.446 1.00 . A A . 23 PHE HZ 1 1 29 9598 1 1 23 PHE N N -9.914 6.680 6.730 1.00 . A A . 23 PHE N 1 1 29 9599 1 1 23 PHE O O -12.000 7.168 4.202 1.00 . A A . 23 PHE O 1 1 30 9600 1 1 1 GLU C C -5.679 -12.787 11.076 1.00 . A A . 1 GLU C 1 1 30 9601 1 1 1 GLU CA C -4.888 -13.893 11.779 1.00 . A A . 1 GLU CA 1 1 30 9602 1 1 1 GLU CB C -3.768 -13.304 12.639 1.00 . A A . 1 GLU CB 1 1 30 9603 1 1 1 GLU CD C -1.737 -14.414 13.642 1.00 . A A . 1 GLU CD 1 1 30 9604 1 1 1 GLU CG C -3.265 -14.328 13.659 1.00 . A A . 1 GLU CG 1 1 30 9605 1 1 1 GLU HA H -5.554 -14.479 12.412 1.00 . A A . 1 GLU HA 1 1 30 9606 1 1 1 GLU HB2 H -2.944 -12.986 12.001 1.00 . A A . 1 GLU HB2 1 1 30 9607 1 1 1 GLU HB3 H -4.131 -12.417 13.158 1.00 . A A . 1 GLU HB3 1 1 30 9608 1 1 1 GLU HG2 H -3.605 -14.050 14.657 1.00 . A A . 1 GLU HG2 1 1 30 9609 1 1 1 GLU HG3 H -3.690 -15.307 13.438 1.00 . A A . 1 GLU HG3 1 1 30 9610 1 1 1 GLU N N -4.358 -14.831 10.804 1.00 . A A . 1 GLU N 1 1 30 9611 1 1 1 GLU O O -5.627 -12.663 9.854 1.00 . A A . 1 GLU O 1 1 30 9612 1 1 1 GLU OE1 O -1.107 -13.369 13.911 1.00 . A A . 1 GLU OE1 1 1 30 9613 1 1 1 GLU OE2 O -1.234 -15.523 13.359 1.00 . A A . 1 GLU OE2 1 1 30 9614 1 1 2 ASN C C -6.501 -9.591 11.655 1.00 . A A . 2 ASN C 1 1 30 9615 1 1 2 ASN CA C -7.193 -10.921 11.349 1.00 . A A . 2 ASN CA 1 1 30 9616 1 1 2 ASN CB C -8.580 -10.891 11.994 1.00 . A A . 2 ASN CB 1 1 30 9617 1 1 2 ASN CG C -9.669 -11.205 10.968 1.00 . A A . 2 ASN CG 1 1 30 9618 1 1 2 ASN H H -6.430 -12.119 12.872 1.00 . A A . 2 ASN H 1 1 30 9619 1 1 2 ASN HA H -7.269 -11.115 10.280 1.00 . A A . 2 ASN HA 1 1 30 9620 1 1 2 ASN HB2 H -8.622 -11.615 12.808 1.00 . A A . 2 ASN HB2 1 1 30 9621 1 1 2 ASN HB3 H -8.761 -9.909 12.432 1.00 . A A . 2 ASN HB3 1 1 30 9622 1 1 2 ASN HD21 H -9.469 -13.167 11.425 1.00 . A A . 2 ASN HD21 1 1 30 9623 1 1 2 ASN HD22 H -10.654 -12.806 10.214 1.00 . A A . 2 ASN HD22 1 1 30 9624 1 1 2 ASN N N -6.393 -12.011 11.879 1.00 . A A . 2 ASN N 1 1 30 9625 1 1 2 ASN ND2 N -9.954 -12.501 10.860 1.00 . A A . 2 ASN ND2 1 1 30 9626 1 1 2 ASN O O -7.111 -8.529 11.542 1.00 . A A . 2 ASN O 1 1 30 9627 1 1 2 ASN OD1 O -10.216 -10.330 10.316 1.00 . A A . 2 ASN OD1 1 1 30 9628 1 1 3 PHE C C -3.789 -7.935 11.106 1.00 . A A . 3 PHE C 1 1 30 9629 1 1 3 PHE CA C -4.454 -8.511 12.358 1.00 . A A . 3 PHE CA 1 1 30 9630 1 1 3 PHE CB C -3.368 -8.949 13.342 1.00 . A A . 3 PHE CB 1 1 30 9631 1 1 3 PHE CD1 C -4.651 -9.174 15.481 1.00 . A A . 3 PHE CD1 1 1 30 9632 1 1 3 PHE CD2 C -2.903 -7.597 15.398 1.00 . A A . 3 PHE CD2 1 1 30 9633 1 1 3 PHE CE1 C -4.914 -8.813 16.829 1.00 . A A . 3 PHE CE1 1 1 30 9634 1 1 3 PHE CE2 C -3.166 -7.235 16.747 1.00 . A A . 3 PHE CE2 1 1 30 9635 1 1 3 PHE CG C -3.651 -8.559 14.794 1.00 . A A . 3 PHE CG 1 1 30 9636 1 1 3 PHE CZ C -4.165 -7.851 17.433 1.00 . A A . 3 PHE CZ 1 1 30 9637 1 1 3 PHE H H -4.747 -10.560 12.124 1.00 . A A . 3 PHE H 1 1 30 9638 1 1 3 PHE HA H -5.140 -7.774 12.775 1.00 . A A . 3 PHE HA 1 1 30 9639 1 1 3 PHE HB2 H -3.252 -10.031 13.283 1.00 . A A . 3 PHE HB2 1 1 30 9640 1 1 3 PHE HB3 H -2.418 -8.510 13.038 1.00 . A A . 3 PHE HB3 1 1 30 9641 1 1 3 PHE HD1 H -5.249 -9.946 14.997 1.00 . A A . 3 PHE HD1 1 1 30 9642 1 1 3 PHE HD2 H -2.102 -7.103 14.849 1.00 . A A . 3 PHE HD2 1 1 30 9643 1 1 3 PHE HE1 H -5.714 -9.306 17.379 1.00 . A A . 3 PHE HE1 1 1 30 9644 1 1 3 PHE HE2 H -2.567 -6.464 17.230 1.00 . A A . 3 PHE HE2 1 1 30 9645 1 1 3 PHE HZ H -4.367 -7.573 18.468 1.00 . A A . 3 PHE HZ 1 1 30 9646 1 1 3 PHE N N -5.236 -9.692 12.036 1.00 . A A . 3 PHE N 1 1 30 9647 1 1 3 PHE O O -3.121 -8.655 10.366 1.00 . A A . 3 PHE O 1 1 30 9648 1 1 4 ASN C C -2.083 -5.338 10.153 1.00 . A A . 4 ASN C 1 1 30 9649 1 1 4 ASN CA C -3.424 -5.961 9.758 1.00 . A A . 4 ASN CA 1 1 30 9650 1 1 4 ASN CB C -4.341 -4.837 9.272 1.00 . A A . 4 ASN CB 1 1 30 9651 1 1 4 ASN CG C -3.744 -4.130 8.053 1.00 . A A . 4 ASN CG 1 1 30 9652 1 1 4 ASN H H -4.540 -6.062 11.514 1.00 . A A . 4 ASN H 1 1 30 9653 1 1 4 ASN HA H -3.318 -6.730 8.993 1.00 . A A . 4 ASN HA 1 1 30 9654 1 1 4 ASN HB2 H -5.320 -5.245 9.017 1.00 . A A . 4 ASN HB2 1 1 30 9655 1 1 4 ASN HB3 H -4.497 -4.115 10.074 1.00 . A A . 4 ASN HB3 1 1 30 9656 1 1 4 ASN HD21 H -3.831 -2.388 9.080 1.00 . A A . 4 ASN HD21 1 1 30 9657 1 1 4 ASN HD22 H -3.189 -2.271 7.474 1.00 . A A . 4 ASN HD22 1 1 30 9658 1 1 4 ASN N N -3.995 -6.641 10.908 1.00 . A A . 4 ASN N 1 1 30 9659 1 1 4 ASN ND2 N -3.574 -2.821 8.216 1.00 . A A . 4 ASN ND2 1 1 30 9660 1 1 4 ASN O O -1.799 -4.194 9.804 1.00 . A A . 4 ASN O 1 1 30 9661 1 1 4 ASN OD1 O -3.457 -4.734 7.032 1.00 . A A . 4 ASN OD1 1 1 30 9662 1 1 5 GLY C C -0.010 -5.324 12.815 1.00 . A A . 5 GLY C 1 1 30 9663 1 1 5 GLY CA C 0.009 -5.661 11.323 1.00 . A A . 5 GLY CA 1 1 30 9664 1 1 5 GLY H H -1.534 -7.050 11.156 1.00 . A A . 5 GLY H 1 1 30 9665 1 1 5 GLY HA2 H 0.756 -6.432 11.130 1.00 . A A . 5 GLY HA2 1 1 30 9666 1 1 5 GLY HA3 H 0.304 -4.782 10.751 1.00 . A A . 5 GLY HA3 1 1 30 9667 1 1 5 GLY N N -1.295 -6.121 10.876 1.00 . A A . 5 GLY N 1 1 30 9668 1 1 5 GLY O O 0.960 -5.583 13.526 1.00 . A A . 5 GLY O 1 1 30 9669 1 1 6 GLY C C -1.974 -3.016 14.767 1.00 . A A . 6 GLY C 1 1 30 9670 1 1 6 GLY CA C -1.282 -4.374 14.640 1.00 . A A . 6 GLY CA 1 1 30 9671 1 1 6 GLY H H -1.908 -4.542 12.660 1.00 . A A . 6 GLY H 1 1 30 9672 1 1 6 GLY HA2 H -1.864 -5.134 15.161 1.00 . A A . 6 GLY HA2 1 1 30 9673 1 1 6 GLY HA3 H -0.305 -4.335 15.123 1.00 . A A . 6 GLY HA3 1 1 30 9674 1 1 6 GLY N N -1.124 -4.750 13.245 1.00 . A A . 6 GLY N 1 1 30 9675 1 1 6 GLY O O -1.436 -2.096 15.379 1.00 . A A . 6 GLY O 1 1 30 9676 1 1 7 CYS C C -5.159 -1.936 15.099 1.00 . A A . 7 CYS C 1 1 30 9677 1 1 7 CYS CA C -3.931 -1.705 14.218 1.00 . A A . 7 CYS CA 1 1 30 9678 1 1 7 CYS CB C -4.317 -1.233 12.814 1.00 . A A . 7 CYS CB 1 1 30 9679 1 1 7 CYS H H -3.590 -3.688 13.681 1.00 . A A . 7 CYS H 1 1 30 9680 1 1 7 CYS HA H -3.283 -0.942 14.649 1.00 . A A . 7 CYS HA 1 1 30 9681 1 1 7 CYS HB2 H -4.728 -2.079 12.263 1.00 . A A . 7 CYS HB2 1 1 30 9682 1 1 7 CYS HB3 H -5.111 -0.492 12.899 1.00 . A A . 7 CYS HB3 1 1 30 9683 1 1 7 CYS N N -3.159 -2.935 14.178 1.00 . A A . 7 CYS N 1 1 30 9684 1 1 7 CYS O O -5.349 -3.029 15.631 1.00 . A A . 7 CYS O 1 1 30 9685 1 1 7 CYS SG S -2.944 -0.511 11.842 1.00 . A A . 7 CYS SG 1 1 30 9686 1 1 8 LEU C C -8.282 -1.622 15.221 1.00 . A A . 8 LEU C 1 1 30 9687 1 1 8 LEU CA C -7.166 -0.965 16.036 1.00 . A A . 8 LEU CA 1 1 30 9688 1 1 8 LEU CB C -7.535 0.417 16.580 1.00 . A A . 8 LEU CB 1 1 30 9689 1 1 8 LEU CD1 C -8.888 -0.389 18.550 1.00 . A A . 8 LEU CD1 1 1 30 9690 1 1 8 LEU CD2 C -9.204 1.967 17.663 1.00 . A A . 8 LEU CD2 1 1 30 9691 1 1 8 LEU CG C -8.873 0.514 17.314 1.00 . A A . 8 LEU CG 1 1 30 9692 1 1 8 LEU H H -5.799 -0.004 14.793 1.00 . A A . 8 LEU H 1 1 30 9693 1 1 8 LEU HA H -6.945 -1.600 16.894 1.00 . A A . 8 LEU HA 1 1 30 9694 1 1 8 LEU HB2 H -6.746 0.740 17.260 1.00 . A A . 8 LEU HB2 1 1 30 9695 1 1 8 LEU HB3 H -7.547 1.120 15.748 1.00 . A A . 8 LEU HB3 1 1 30 9696 1 1 8 LEU HD11 H -8.264 -1.264 18.368 1.00 . A A . 8 LEU HD11 1 1 30 9697 1 1 8 LEU HD12 H -8.499 0.163 19.407 1.00 . A A . 8 LEU HD12 1 1 30 9698 1 1 8 LEU HD13 H -9.910 -0.707 18.756 1.00 . A A . 8 LEU HD13 1 1 30 9699 1 1 8 LEU HD21 H -8.281 2.514 17.852 1.00 . A A . 8 LEU HD21 1 1 30 9700 1 1 8 LEU HD22 H -9.735 2.427 16.829 1.00 . A A . 8 LEU HD22 1 1 30 9701 1 1 8 LEU HD23 H -9.832 1.993 18.553 1.00 . A A . 8 LEU HD23 1 1 30 9702 1 1 8 LEU HG H -9.657 0.156 16.646 1.00 . A A . 8 LEU HG 1 1 30 9703 1 1 8 LEU N N -5.961 -0.890 15.229 1.00 . A A . 8 LEU N 1 1 30 9704 1 1 8 LEU O O -8.854 -2.627 15.643 1.00 . A A . 8 LEU O 1 1 30 9705 1 1 9 ALA C C -10.014 -0.451 12.208 1.00 . A A . 9 ALA C 1 1 30 9706 1 1 9 ALA CA C -9.594 -1.545 13.192 1.00 . A A . 9 ALA CA 1 1 30 9707 1 1 9 ALA CB C -10.766 -2.057 14.031 1.00 . A A . 9 ALA CB 1 1 30 9708 1 1 9 ALA H H -8.087 -0.213 13.734 1.00 . A A . 9 ALA H 1 1 30 9709 1 1 9 ALA HA H -9.172 -2.380 12.633 1.00 . A A . 9 ALA HA 1 1 30 9710 1 1 9 ALA HB1 H -10.724 -1.610 15.025 1.00 . A A . 9 ALA HB1 1 1 30 9711 1 1 9 ALA HB2 H -11.705 -1.782 13.550 1.00 . A A . 9 ALA HB2 1 1 30 9712 1 1 9 ALA HB3 H -10.706 -3.141 14.117 1.00 . A A . 9 ALA HB3 1 1 30 9713 1 1 9 ALA N N -8.558 -1.030 14.069 1.00 . A A . 9 ALA N 1 1 30 9714 1 1 9 ALA O O -10.860 0.383 12.527 1.00 . A A . 9 ALA O 1 1 30 9715 1 1 10 GLY C C -8.446 1.249 9.582 1.00 . A A . 10 GLY C 1 1 30 9716 1 1 10 GLY CA C -9.706 0.488 10.001 1.00 . A A . 10 GLY CA 1 1 30 9717 1 1 10 GLY H H -8.719 -1.172 10.781 1.00 . A A . 10 GLY H 1 1 30 9718 1 1 10 GLY HA2 H -10.138 -0.013 9.135 1.00 . A A . 10 GLY HA2 1 1 30 9719 1 1 10 GLY HA3 H -10.453 1.192 10.369 1.00 . A A . 10 GLY HA3 1 1 30 9720 1 1 10 GLY N N -9.405 -0.489 11.033 1.00 . A A . 10 GLY N 1 1 30 9721 1 1 10 GLY O O -8.299 1.620 8.419 1.00 . A A . 10 GLY O 1 1 30 9722 1 1 11 TYR C C -5.433 1.380 9.339 1.00 . A A . 11 TYR C 1 1 30 9723 1 1 11 TYR CA C -6.326 2.167 10.300 1.00 . A A . 11 TYR CA 1 1 30 9724 1 1 11 TYR CB C -5.622 2.281 11.654 1.00 . A A . 11 TYR CB 1 1 30 9725 1 1 11 TYR CD1 C -6.344 4.535 12.522 1.00 . A A . 11 TYR CD1 1 1 30 9726 1 1 11 TYR CD2 C -7.035 2.585 13.720 1.00 . A A . 11 TYR CD2 1 1 30 9727 1 1 11 TYR CE1 C -7.036 5.365 13.474 1.00 . A A . 11 TYR CE1 1 1 30 9728 1 1 11 TYR CE2 C -7.728 3.415 14.671 1.00 . A A . 11 TYR CE2 1 1 30 9729 1 1 11 TYR CG C -6.358 3.163 12.665 1.00 . A A . 11 TYR CG 1 1 30 9730 1 1 11 TYR CZ C -7.694 4.764 14.501 1.00 . A A . 11 TYR CZ 1 1 30 9731 1 1 11 TYR H H -7.696 1.153 11.497 1.00 . A A . 11 TYR H 1 1 30 9732 1 1 11 TYR HA H -6.573 3.128 9.850 1.00 . A A . 11 TYR HA 1 1 30 9733 1 1 11 TYR HB2 H -5.504 1.283 12.076 1.00 . A A . 11 TYR HB2 1 1 30 9734 1 1 11 TYR HB3 H -4.621 2.682 11.498 1.00 . A A . 11 TYR HB3 1 1 30 9735 1 1 11 TYR HD1 H -5.809 4.991 11.690 1.00 . A A . 11 TYR HD1 1 1 30 9736 1 1 11 TYR HD2 H -7.047 1.501 13.832 1.00 . A A . 11 TYR HD2 1 1 30 9737 1 1 11 TYR HE1 H -7.033 6.450 13.374 1.00 . A A . 11 TYR HE1 1 1 30 9738 1 1 11 TYR HE2 H -8.267 2.972 15.509 1.00 . A A . 11 TYR HE2 1 1 30 9739 1 1 11 TYR HH H -9.231 5.832 15.027 1.00 . A A . 11 TYR HH 1 1 30 9740 1 1 11 TYR N N -7.569 1.457 10.554 1.00 . A A . 11 TYR N 1 1 30 9741 1 1 11 TYR O O -5.541 0.159 9.244 1.00 . A A . 11 TYR O 1 1 30 9742 1 1 11 TYR OH O -8.348 5.548 15.401 1.00 . A A . 11 TYR OH 1 1 30 9743 1 1 12 MET C C -2.203 1.673 8.145 1.00 . A A . 12 MET C 1 1 30 9744 1 1 12 MET CA C -3.657 1.500 7.701 1.00 . A A . 12 MET CA 1 1 30 9745 1 1 12 MET CB C -3.851 2.136 6.323 1.00 . A A . 12 MET CB 1 1 30 9746 1 1 12 MET CE C -3.579 6.067 5.197 1.00 . A A . 12 MET CE 1 1 30 9747 1 1 12 MET CG C -3.961 3.659 6.434 1.00 . A A . 12 MET CG 1 1 30 9748 1 1 12 MET H H -4.487 3.106 8.735 1.00 . A A . 12 MET H 1 1 30 9749 1 1 12 MET HA H -3.916 0.440 7.688 1.00 . A A . 12 MET HA 1 1 30 9750 1 1 12 MET HB2 H -3.012 1.875 5.677 1.00 . A A . 12 MET HB2 1 1 30 9751 1 1 12 MET HB3 H -4.749 1.735 5.856 1.00 . A A . 12 MET HB3 1 1 30 9752 1 1 12 MET HE1 H -3.822 6.276 6.238 1.00 . A A . 12 MET HE1 1 1 30 9753 1 1 12 MET HE2 H -2.508 6.202 5.041 1.00 . A A . 12 MET HE2 1 1 30 9754 1 1 12 MET HE3 H -4.128 6.751 4.551 1.00 . A A . 12 MET HE3 1 1 30 9755 1 1 12 MET HG2 H -4.854 3.926 6.999 1.00 . A A . 12 MET HG2 1 1 30 9756 1 1 12 MET HG3 H -3.106 4.055 6.982 1.00 . A A . 12 MET HG3 1 1 30 9757 1 1 12 MET N N -4.569 2.113 8.651 1.00 . A A . 12 MET N 1 1 30 9758 1 1 12 MET O O -1.904 2.522 8.983 1.00 . A A . 12 MET O 1 1 30 9759 1 1 12 MET SD S -4.031 4.386 4.805 1.00 . A A . 12 MET SD 1 1 30 9760 1 1 13 ARG C C 0.841 1.684 6.816 1.00 . A A . 13 ARG C 1 1 30 9761 1 1 13 ARG CA C 0.076 0.907 7.890 1.00 . A A . 13 ARG CA 1 1 30 9762 1 1 13 ARG CB C 0.666 -0.500 8.008 1.00 . A A . 13 ARG CB 1 1 30 9763 1 1 13 ARG CD C 1.166 -1.300 10.347 1.00 . A A . 13 ARG CD 1 1 30 9764 1 1 13 ARG CG C 0.114 -1.224 9.238 1.00 . A A . 13 ARG CG 1 1 30 9765 1 1 13 ARG CZ C 2.400 -3.154 11.465 1.00 . A A . 13 ARG CZ 1 1 30 9766 1 1 13 ARG H H -1.590 0.167 6.882 1.00 . A A . 13 ARG H 1 1 30 9767 1 1 13 ARG HA H 0.122 1.418 8.851 1.00 . A A . 13 ARG HA 1 1 30 9768 1 1 13 ARG HB2 H 0.434 -1.072 7.110 1.00 . A A . 13 ARG HB2 1 1 30 9769 1 1 13 ARG HB3 H 1.752 -0.438 8.075 1.00 . A A . 13 ARG HB3 1 1 30 9770 1 1 13 ARG HD2 H 1.955 -0.572 10.162 1.00 . A A . 13 ARG HD2 1 1 30 9771 1 1 13 ARG HD3 H 0.714 -1.045 11.306 1.00 . A A . 13 ARG HD3 1 1 30 9772 1 1 13 ARG HE H 1.630 -3.254 9.607 1.00 . A A . 13 ARG HE 1 1 30 9773 1 1 13 ARG HG2 H -0.770 -0.703 9.605 1.00 . A A . 13 ARG HG2 1 1 30 9774 1 1 13 ARG HG3 H -0.201 -2.230 8.961 1.00 . A A . 13 ARG HG3 1 1 30 9775 1 1 13 ARG HH11 H 2.208 -1.467 12.583 1.00 . A A . 13 ARG HH11 1 1 30 9776 1 1 13 ARG HH12 H 3.064 -2.765 13.347 1.00 . A A . 13 ARG HH12 1 1 30 9777 1 1 13 ARG HH21 H 2.759 -4.967 10.614 1.00 . A A . 13 ARG HH21 1 1 30 9778 1 1 13 ARG HH22 H 3.379 -4.769 12.219 1.00 . A A . 13 ARG HH22 1 1 30 9779 1 1 13 ARG N N -1.339 0.855 7.563 1.00 . A A . 13 ARG N 1 1 30 9780 1 1 13 ARG NE N 1.741 -2.663 10.407 1.00 . A A . 13 ARG NE 1 1 30 9781 1 1 13 ARG NH1 N 2.572 -2.398 12.557 1.00 . A A . 13 ARG NH1 1 1 30 9782 1 1 13 ARG NH2 N 2.887 -4.402 11.430 1.00 . A A . 13 ARG NH2 1 1 30 9783 1 1 13 ARG O O 1.089 1.166 5.729 1.00 . A A . 13 ARG O 1 1 30 9784 1 1 14 THR C C 3.246 3.115 5.840 1.00 . A A . 14 THR C 1 1 30 9785 1 1 14 THR CA C 1.921 3.769 6.238 1.00 . A A . 14 THR CA 1 1 30 9786 1 1 14 THR CB C 2.093 5.138 6.898 1.00 . A A . 14 THR CB 1 1 30 9787 1 1 14 THR CG2 C 0.818 5.616 7.597 1.00 . A A . 14 THR CG2 1 1 30 9788 1 1 14 THR H H 0.985 3.328 8.046 1.00 . A A . 14 THR H 1 1 30 9789 1 1 14 THR HA H 1.332 3.875 5.327 1.00 . A A . 14 THR HA 1 1 30 9790 1 1 14 THR HB H 2.442 5.877 6.177 1.00 . A A . 14 THR HB 1 1 30 9791 1 1 14 THR HG1 H 2.665 4.156 8.545 1.00 . A A . 14 THR HG1 1 1 30 9792 1 1 14 THR HG21 H 0.015 4.900 7.416 1.00 . A A . 14 THR HG21 1 1 30 9793 1 1 14 THR HG22 H 1.000 5.695 8.669 1.00 . A A . 14 THR HG22 1 1 30 9794 1 1 14 THR HG23 H 0.532 6.591 7.204 1.00 . A A . 14 THR HG23 1 1 30 9795 1 1 14 THR N N 1.192 2.915 7.159 1.00 . A A . 14 THR N 1 1 30 9796 1 1 14 THR O O 3.378 1.893 5.885 1.00 . A A . 14 THR O 1 1 30 9797 1 1 14 THR OG1 O 3.005 4.896 7.966 1.00 . A A . 14 THR OG1 1 1 30 9798 1 1 15 ALA C C 6.479 3.616 6.226 1.00 . A A . 15 ALA C 1 1 30 9799 1 1 15 ALA CA C 5.504 3.478 5.055 1.00 . A A . 15 ALA CA 1 1 30 9800 1 1 15 ALA CB C 5.969 4.246 3.816 1.00 . A A . 15 ALA CB 1 1 30 9801 1 1 15 ALA H H 4.079 4.952 5.426 1.00 . A A . 15 ALA H 1 1 30 9802 1 1 15 ALA HA H 5.406 2.423 4.798 1.00 . A A . 15 ALA HA 1 1 30 9803 1 1 15 ALA HB1 H 5.107 4.691 3.320 1.00 . A A . 15 ALA HB1 1 1 30 9804 1 1 15 ALA HB2 H 6.662 5.032 4.115 1.00 . A A . 15 ALA HB2 1 1 30 9805 1 1 15 ALA HB3 H 6.469 3.561 3.131 1.00 . A A . 15 ALA HB3 1 1 30 9806 1 1 15 ALA N N 4.195 3.959 5.460 1.00 . A A . 15 ALA N 1 1 30 9807 1 1 15 ALA O O 7.683 3.436 6.061 1.00 . A A . 15 ALA O 1 1 30 9808 1 1 16 ASP C C 6.357 3.009 9.592 1.00 . A A . 16 ASP C 1 1 30 9809 1 1 16 ASP CA C 6.724 4.100 8.584 1.00 . A A . 16 ASP CA 1 1 30 9810 1 1 16 ASP CB C 6.464 5.457 9.240 1.00 . A A . 16 ASP CB 1 1 30 9811 1 1 16 ASP CG C 7.632 6.015 10.056 1.00 . A A . 16 ASP CG 1 1 30 9812 1 1 16 ASP H H 4.938 4.080 7.512 1.00 . A A . 16 ASP H 1 1 30 9813 1 1 16 ASP HA H 7.758 4.025 8.247 1.00 . A A . 16 ASP HA 1 1 30 9814 1 1 16 ASP HB2 H 6.208 6.177 8.462 1.00 . A A . 16 ASP HB2 1 1 30 9815 1 1 16 ASP HB3 H 5.595 5.369 9.891 1.00 . A A . 16 ASP HB3 1 1 30 9816 1 1 16 ASP N N 5.919 3.935 7.385 1.00 . A A . 16 ASP N 1 1 30 9817 1 1 16 ASP O O 7.107 2.750 10.532 1.00 . A A . 16 ASP O 1 1 30 9818 1 1 16 ASP OD1 O 8.676 6.301 9.431 1.00 . A A . 16 ASP OD1 1 1 30 9819 1 1 16 ASP OD2 O 7.454 6.142 11.287 1.00 . A A . 16 ASP OD2 1 1 30 9820 1 1 17 GLY C C 3.724 1.889 11.260 1.00 . A A . 17 GLY C 1 1 30 9821 1 1 17 GLY CA C 4.727 1.344 10.241 1.00 . A A . 17 GLY CA 1 1 30 9822 1 1 17 GLY H H 4.599 2.617 8.598 1.00 . A A . 17 GLY H 1 1 30 9823 1 1 17 GLY HA2 H 4.260 0.557 9.649 1.00 . A A . 17 GLY HA2 1 1 30 9824 1 1 17 GLY HA3 H 5.571 0.891 10.762 1.00 . A A . 17 GLY HA3 1 1 30 9825 1 1 17 GLY N N 5.203 2.399 9.363 1.00 . A A . 17 GLY N 1 1 30 9826 1 1 17 GLY O O 3.261 1.155 12.132 1.00 . A A . 17 GLY O 1 1 30 9827 1 1 18 ARG C C 1.046 3.641 11.501 1.00 . A A . 18 ARG C 1 1 30 9828 1 1 18 ARG CA C 2.477 3.819 12.012 1.00 . A A . 18 ARG CA 1 1 30 9829 1 1 18 ARG CB C 2.782 5.313 12.142 1.00 . A A . 18 ARG CB 1 1 30 9830 1 1 18 ARG CD C 2.849 7.498 10.885 1.00 . A A . 18 ARG CD 1 1 30 9831 1 1 18 ARG CG C 2.261 6.086 10.929 1.00 . A A . 18 ARG CG 1 1 30 9832 1 1 18 ARG CZ C 2.714 9.544 12.301 1.00 . A A . 18 ARG CZ 1 1 30 9833 1 1 18 ARG H H 3.799 3.759 10.403 1.00 . A A . 18 ARG H 1 1 30 9834 1 1 18 ARG HA H 2.615 3.321 12.971 1.00 . A A . 18 ARG HA 1 1 30 9835 1 1 18 ARG HB2 H 2.324 5.704 13.050 1.00 . A A . 18 ARG HB2 1 1 30 9836 1 1 18 ARG HB3 H 3.857 5.461 12.238 1.00 . A A . 18 ARG HB3 1 1 30 9837 1 1 18 ARG HD2 H 3.934 7.452 10.978 1.00 . A A . 18 ARG HD2 1 1 30 9838 1 1 18 ARG HD3 H 2.631 7.962 9.922 1.00 . A A . 18 ARG HD3 1 1 30 9839 1 1 18 ARG HE H 1.530 7.930 12.513 1.00 . A A . 18 ARG HE 1 1 30 9840 1 1 18 ARG HG2 H 2.519 5.552 10.014 1.00 . A A . 18 ARG HG2 1 1 30 9841 1 1 18 ARG HG3 H 1.173 6.143 10.968 1.00 . A A . 18 ARG HG3 1 1 30 9842 1 1 18 ARG HH11 H 4.148 9.603 10.860 1.00 . A A . 18 ARG HH11 1 1 30 9843 1 1 18 ARG HH12 H 4.042 11.018 11.853 1.00 . A A . 18 ARG HH12 1 1 30 9844 1 1 18 ARG HH21 H 1.389 9.797 13.823 1.00 . A A . 18 ARG HH21 1 1 30 9845 1 1 18 ARG HH22 H 2.462 11.129 13.549 1.00 . A A . 18 ARG HH22 1 1 30 9846 1 1 18 ARG N N 3.417 3.169 11.116 1.00 . A A . 18 ARG N 1 1 30 9847 1 1 18 ARG NE N 2.282 8.317 11.979 1.00 . A A . 18 ARG NE 1 1 30 9848 1 1 18 ARG NH1 N 3.719 10.102 11.613 1.00 . A A . 18 ARG NH1 1 1 30 9849 1 1 18 ARG NH2 N 2.140 10.213 13.310 1.00 . A A . 18 ARG NH2 1 1 30 9850 1 1 18 ARG O O 0.720 4.069 10.394 1.00 . A A . 18 ARG O 1 1 30 9851 1 1 19 CYS C C -1.859 4.120 11.833 1.00 . A A . 19 CYS C 1 1 30 9852 1 1 19 CYS CA C -1.159 2.768 11.977 1.00 . A A . 19 CYS CA 1 1 30 9853 1 1 19 CYS CB C -1.857 1.870 13.000 1.00 . A A . 19 CYS CB 1 1 30 9854 1 1 19 CYS H H 0.503 2.664 13.229 1.00 . A A . 19 CYS H 1 1 30 9855 1 1 19 CYS HA H -1.152 2.233 11.027 1.00 . A A . 19 CYS HA 1 1 30 9856 1 1 19 CYS HB2 H -1.692 2.282 13.996 1.00 . A A . 19 CYS HB2 1 1 30 9857 1 1 19 CYS HB3 H -2.931 1.900 12.817 1.00 . A A . 19 CYS HB3 1 1 30 9858 1 1 19 CYS N N 0.229 3.008 12.331 1.00 . A A . 19 CYS N 1 1 30 9859 1 1 19 CYS O O -2.144 4.785 12.828 1.00 . A A . 19 CYS O 1 1 30 9860 1 1 19 CYS SG S -1.308 0.123 12.989 1.00 . A A . 19 CYS SG 1 1 30 9861 1 1 20 LYS C C -4.241 5.485 9.940 1.00 . A A . 20 LYS C 1 1 30 9862 1 1 20 LYS CA C -2.777 5.750 10.300 1.00 . A A . 20 LYS CA 1 1 30 9863 1 1 20 LYS CB C -2.011 6.524 9.225 1.00 . A A . 20 LYS CB 1 1 30 9864 1 1 20 LYS CD C -0.757 8.651 8.710 1.00 . A A . 20 LYS CD 1 1 30 9865 1 1 20 LYS CE C -1.504 9.981 8.591 1.00 . A A . 20 LYS CE 1 1 30 9866 1 1 20 LYS CG C -1.361 7.779 9.813 1.00 . A A . 20 LYS CG 1 1 30 9867 1 1 20 LYS H H -1.883 3.941 9.782 1.00 . A A . 20 LYS H 1 1 30 9868 1 1 20 LYS HA H -2.748 6.348 11.210 1.00 . A A . 20 LYS HA 1 1 30 9869 1 1 20 LYS HB2 H -1.245 5.885 8.787 1.00 . A A . 20 LYS HB2 1 1 30 9870 1 1 20 LYS HB3 H -2.689 6.805 8.420 1.00 . A A . 20 LYS HB3 1 1 30 9871 1 1 20 LYS HD2 H 0.295 8.839 8.925 1.00 . A A . 20 LYS HD2 1 1 30 9872 1 1 20 LYS HD3 H -0.798 8.120 7.759 1.00 . A A . 20 LYS HD3 1 1 30 9873 1 1 20 LYS HE2 H -1.440 10.351 7.568 1.00 . A A . 20 LYS HE2 1 1 30 9874 1 1 20 LYS HE3 H -2.561 9.831 8.811 1.00 . A A . 20 LYS HE3 1 1 30 9875 1 1 20 LYS HG2 H -2.103 8.352 10.368 1.00 . A A . 20 LYS HG2 1 1 30 9876 1 1 20 LYS HG3 H -0.584 7.493 10.521 1.00 . A A . 20 LYS HG3 1 1 30 9877 1 1 20 LYS HZ1 H -0.311 10.525 10.159 1.00 . A A . 20 LYS HZ1 1 1 30 9878 1 1 20 LYS HZ2 H -0.435 11.673 9.003 1.00 . A A . 20 LYS HZ2 1 1 30 9879 1 1 20 LYS HZ3 H -1.674 11.416 10.036 1.00 . A A . 20 LYS HZ3 1 1 30 9880 1 1 20 LYS N N -2.117 4.488 10.586 1.00 . A A . 20 LYS N 1 1 30 9881 1 1 20 LYS NZ N -0.935 10.980 9.523 1.00 . A A . 20 LYS NZ 1 1 30 9882 1 1 20 LYS O O -4.653 4.334 9.809 1.00 . A A . 20 LYS O 1 1 30 9883 1 1 21 PRO C C -6.595 6.127 7.969 1.00 . A A . 21 PRO C 1 1 30 9884 1 1 21 PRO CA C -6.414 6.498 9.443 1.00 . A A . 21 PRO CA 1 1 30 9885 1 1 21 PRO CB C -7.002 7.856 9.790 1.00 . A A . 21 PRO CB 1 1 30 9886 1 1 21 PRO CD C -4.552 7.979 9.932 1.00 . A A . 21 PRO CD 1 1 30 9887 1 1 21 PRO CG C -5.823 8.811 9.875 1.00 . A A . 21 PRO CG 1 1 30 9888 1 1 21 PRO HA H -6.847 5.762 9.965 1.00 . A A . 21 PRO HA 1 1 30 9889 1 1 21 PRO HB2 H -7.713 8.179 9.030 1.00 . A A . 21 PRO HB2 1 1 30 9890 1 1 21 PRO HB3 H -7.543 7.817 10.735 1.00 . A A . 21 PRO HB3 1 1 30 9891 1 1 21 PRO HD2 H -3.861 8.256 9.135 1.00 . A A . 21 PRO HD2 1 1 30 9892 1 1 21 PRO HD3 H -4.025 8.125 10.874 1.00 . A A . 21 PRO HD3 1 1 30 9893 1 1 21 PRO HG2 H -5.806 9.475 9.011 1.00 . A A . 21 PRO HG2 1 1 30 9894 1 1 21 PRO HG3 H -5.906 9.442 10.761 1.00 . A A . 21 PRO HG3 1 1 30 9895 1 1 21 PRO N N -5.006 6.599 9.786 1.00 . A A . 21 PRO N 1 1 30 9896 1 1 21 PRO O O -5.820 6.559 7.117 1.00 . A A . 21 PRO O 1 1 30 9897 1 1 22 THR C C -9.183 5.580 5.842 1.00 . A A . 22 THR C 1 1 30 9898 1 1 22 THR CA C -7.915 4.897 6.358 1.00 . A A . 22 THR CA 1 1 30 9899 1 1 22 THR CB C -8.005 3.370 6.359 1.00 . A A . 22 THR CB 1 1 30 9900 1 1 22 THR CG2 C -7.835 2.772 4.962 1.00 . A A . 22 THR CG2 1 1 30 9901 1 1 22 THR H H -8.248 4.983 8.413 1.00 . A A . 22 THR H 1 1 30 9902 1 1 22 THR HA H -7.096 5.212 5.712 1.00 . A A . 22 THR HA 1 1 30 9903 1 1 22 THR HB H -8.937 3.036 6.815 1.00 . A A . 22 THR HB 1 1 30 9904 1 1 22 THR HG1 H -6.728 3.492 7.897 1.00 . A A . 22 THR HG1 1 1 30 9905 1 1 22 THR HG21 H -8.511 3.270 4.268 1.00 . A A . 22 THR HG21 1 1 30 9906 1 1 22 THR HG22 H -6.806 2.912 4.629 1.00 . A A . 22 THR HG22 1 1 30 9907 1 1 22 THR HG23 H -8.065 1.707 4.991 1.00 . A A . 22 THR HG23 1 1 30 9908 1 1 22 THR N N -7.622 5.331 7.714 1.00 . A A . 22 THR N 1 1 30 9909 1 1 22 THR O O -9.685 5.237 4.773 1.00 . A A . 22 THR O 1 1 30 9910 1 1 22 THR OG1 O -6.836 2.954 7.060 1.00 . A A . 22 THR OG1 1 1 30 9911 1 1 23 PHE C C -10.911 7.525 4.752 1.00 . A A . 23 PHE C 1 1 30 9912 1 1 23 PHE CA C -10.862 7.270 6.260 1.00 . A A . 23 PHE CA 1 1 30 9913 1 1 23 PHE CB C -10.804 8.612 6.990 1.00 . A A . 23 PHE CB 1 1 30 9914 1 1 23 PHE CD1 C -11.059 7.452 9.195 1.00 . A A . 23 PHE CD1 1 1 30 9915 1 1 23 PHE CD2 C -9.775 9.425 9.124 1.00 . A A . 23 PHE CD2 1 1 30 9916 1 1 23 PHE CE1 C -10.811 7.340 10.589 1.00 . A A . 23 PHE CE1 1 1 30 9917 1 1 23 PHE CE2 C -9.527 9.314 10.517 1.00 . A A . 23 PHE CE2 1 1 30 9918 1 1 23 PHE CG C -10.537 8.492 8.492 1.00 . A A . 23 PHE CG 1 1 30 9919 1 1 23 PHE CZ C -10.050 8.273 11.221 1.00 . A A . 23 PHE CZ 1 1 30 9920 1 1 23 PHE H H -9.248 6.809 7.493 1.00 . A A . 23 PHE H 1 1 30 9921 1 1 23 PHE HA H -11.716 6.659 6.550 1.00 . A A . 23 PHE HA 1 1 30 9922 1 1 23 PHE HB2 H -10.024 9.226 6.540 1.00 . A A . 23 PHE HB2 1 1 30 9923 1 1 23 PHE HB3 H -11.749 9.136 6.842 1.00 . A A . 23 PHE HB3 1 1 30 9924 1 1 23 PHE HD1 H -11.669 6.703 8.689 1.00 . A A . 23 PHE HD1 1 1 30 9925 1 1 23 PHE HD2 H -9.357 10.259 8.561 1.00 . A A . 23 PHE HD2 1 1 30 9926 1 1 23 PHE HE1 H -11.230 6.506 11.152 1.00 . A A . 23 PHE HE1 1 1 30 9927 1 1 23 PHE HE2 H -8.917 10.062 11.024 1.00 . A A . 23 PHE HE2 1 1 30 9928 1 1 23 PHE HZ H -9.859 8.188 12.290 1.00 . A A . 23 PHE HZ 1 1 30 9929 1 1 23 PHE N N -9.663 6.535 6.624 1.00 . A A . 23 PHE N 1 1 30 9930 1 1 23 PHE O O -11.879 8.090 4.245 1.00 . A A . 23 PHE O 1 1 stop_ save_
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