NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
563789 | 2luf | 18519 | cing | 4-filtered-FRED | STAR | entry | full | 348 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2luf # This FRED archive file contains, for PDB entry <2luf>: # # - 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, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. 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.PDB_coordinate_file_version . _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_2luf _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2luf _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2170.40 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 $Retro_Trp_cage_peptide A . 1 1 stop_ save_ save_Retro_Trp_cage_peptide _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Retro Trp cage peptide" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code SPPPRGSSPGGDKLWQIYLN _Entity.Number_of_monomers 20 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 SER . 1 1 2 PRO . 1 1 3 PRO . 1 1 4 PRO . 1 1 5 ARG . 1 1 6 GLY . 1 1 7 SER . 1 1 8 SER . 1 1 9 PRO . 1 1 10 GLY . 1 1 11 GLY . 1 1 12 ASP . 1 1 13 LYS . 1 1 14 LEU . 1 1 15 TRP . 1 1 16 GLN . 1 1 17 ILE . 1 1 18 TYR . 1 1 19 LEU . 1 1 20 ASN . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID SER 1 1 1 1 PRO 2 2 1 1 PRO 3 3 1 1 PRO 4 4 1 1 ARG 5 5 1 1 GLY 6 6 1 1 SER 7 7 1 1 SER 8 8 1 1 PRO 9 9 1 1 GLY 10 10 1 1 GLY 11 11 1 1 ASP 12 12 1 1 LYS 13 13 1 1 LEU 14 14 1 1 TRP 15 15 1 1 GLN 16 16 1 1 ILE 17 17 1 1 TYR 18 18 1 1 LEU 19 19 1 1 ASN 20 20 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 SER HA . 1 . HA 1 1 1 1 2 1 1 1 SER QB . 1 . HB2 1 1 2 1 1 1 1 1 SER HA . 1 . HA 1 1 2 1 2 1 1 2 PRO HD2 . 2 . HD1 1 1 3 1 1 1 1 1 SER HA . 1 . HA 1 1 3 1 2 1 1 2 PRO HD3 . 2 . HD2 1 1 4 1 1 1 1 1 SER QB . 1 . HB2 1 1 4 1 2 1 1 2 PRO HD2 . 2 . HD1 1 1 5 1 1 1 1 1 SER QB . 1 . HB2 1 1 5 1 2 1 1 2 PRO HD3 . 2 . HD2 1 1 6 1 1 1 1 1 SER QB . 1 . HB1 1 1 6 1 2 1 1 14 LEU HB2 . 14 . HB2 1 1 7 1 1 1 1 1 SER QB . 1 . HB1 1 1 7 1 2 1 1 14 LEU HB3 . 14 . HB1 1 1 8 1 1 1 1 1 SER QB . 1 . HB1 1 1 8 1 2 1 1 14 LEU MD2 . 14 . HD21 1 1 9 1 1 1 1 1 SER QB . 1 . HB1 1 1 9 1 2 1 1 14 LEU HG . 14 . HG 1 1 10 1 1 1 1 2 PRO HA . 2 . HA 1 1 10 1 2 1 1 2 PRO HB2 . 2 . HB1 1 1 11 1 1 1 1 2 PRO HA . 2 . HA 1 1 11 1 2 1 1 2 PRO HB3 . 2 . HB2 1 1 12 1 1 1 1 2 PRO HA . 2 . HA 1 1 12 1 2 1 1 2 PRO HD3 . 2 . HD2 1 1 13 1 1 1 1 2 PRO HA . 2 . HA 1 1 13 1 2 1 1 3 PRO HD2 . 3 . HD1 1 1 14 1 1 1 1 2 PRO HA . 2 . HA 1 1 14 1 2 1 1 3 PRO HD3 . 3 . HD2 1 1 15 1 1 1 1 2 PRO HA . 2 . HA 1 1 15 1 2 1 1 3 PRO HG3 . 3 . HG2 1 1 16 1 1 1 1 2 PRO HB2 . 2 . HB1 1 1 16 1 2 1 1 2 PRO HD3 . 2 . HD2 1 1 17 1 1 1 1 2 PRO HB2 . 2 . HB1 1 1 17 1 2 1 1 3 PRO HD2 . 3 . HD1 1 1 18 1 1 1 1 2 PRO HB2 . 2 . HB1 1 1 18 1 2 1 1 3 PRO HD3 . 3 . HD2 1 1 19 1 1 1 1 2 PRO HB3 . 2 . HB2 1 1 19 1 2 1 1 2 PRO HD3 . 2 . HD2 1 1 20 1 1 1 1 2 PRO HB3 . 2 . HB2 1 1 20 1 2 1 1 3 PRO HD3 . 3 . HD2 1 1 21 1 1 1 1 2 PRO HD2 . 2 . HD1 1 1 21 1 2 1 1 2 PRO HG3 . 2 . HG2 1 1 22 1 1 1 1 2 PRO HD3 . 2 . HD2 1 1 22 1 2 1 1 2 PRO HG3 . 2 . HG2 1 1 23 1 1 1 1 3 PRO HA . 3 . HA 1 1 23 1 2 1 1 3 PRO HB2 . 3 . HB1 1 1 24 1 1 1 1 3 PRO HA . 3 . HA 1 1 24 1 2 1 1 3 PRO HB3 . 3 . HB2 1 1 25 1 1 1 1 3 PRO HA . 3 . HA 1 1 25 1 2 1 1 4 PRO HD2 . 4 . HD1 1 1 26 1 1 1 1 3 PRO HA . 3 . HA 1 1 26 1 2 1 1 4 PRO HD3 . 4 . HD2 1 1 27 1 1 1 1 3 PRO HB2 . 3 . HB1 1 1 27 1 2 1 1 3 PRO HD3 . 3 . HD2 1 1 28 1 1 1 1 3 PRO HB2 . 3 . HB1 1 1 28 1 2 1 1 4 PRO HA . 4 . HA 1 1 29 1 1 1 1 3 PRO HB2 . 3 . HB1 1 1 29 1 2 1 1 4 PRO HD2 . 4 . HD1 1 1 30 1 1 1 1 3 PRO HB3 . 3 . HB2 1 1 30 1 2 1 1 3 PRO HD2 . 3 . HD1 1 1 31 1 1 1 1 3 PRO HB3 . 3 . HB2 1 1 31 1 2 1 1 3 PRO HD3 . 3 . HD2 1 1 32 1 1 1 1 3 PRO HB3 . 3 . HB2 1 1 32 1 2 1 1 4 PRO HD2 . 4 . HD1 1 1 33 1 1 1 1 3 PRO HB3 . 3 . HB2 1 1 33 1 2 1 1 4 PRO HD3 . 4 . HD2 1 1 34 1 1 1 1 3 PRO HD3 . 3 . HD2 1 1 34 1 2 1 1 3 PRO HG3 . 3 . HG2 1 1 35 1 1 1 1 4 PRO HA . 4 . HA 1 1 35 1 2 1 1 4 PRO HB3 . 4 . HB2 1 1 36 1 1 1 1 4 PRO HA . 4 . HA 1 1 36 1 2 1 1 4 PRO HD2 . 4 . HD1 1 1 37 1 1 1 1 4 PRO HA . 4 . HA 1 1 37 1 2 1 1 4 PRO HG3 . 4 . HG2 1 1 38 1 1 1 1 4 PRO HA . 4 . HA 1 1 38 1 2 1 1 5 ARG H . 5 . HN 1 1 39 1 1 1 1 4 PRO HA . 4 . HA 1 1 39 1 2 1 1 5 ARG HB3 . 5 . HB2 1 1 40 1 1 1 1 4 PRO HA . 4 . HA 1 1 40 1 2 1 1 5 ARG HG3 . 5 . HG2 1 1 41 1 1 1 1 4 PRO HB2 . 4 . HB1 1 1 41 1 2 1 1 4 PRO HD2 . 4 . HD1 1 1 42 1 1 1 1 4 PRO HB2 . 4 . HB1 1 1 42 1 2 1 1 4 PRO HD3 . 4 . HD2 1 1 43 1 1 1 1 4 PRO HB2 . 4 . HB1 1 1 43 1 2 1 1 5 ARG H . 5 . HN 1 1 44 1 1 1 1 4 PRO HB3 . 4 . HB2 1 1 44 1 2 1 1 4 PRO HD2 . 4 . HD1 1 1 45 1 1 1 1 4 PRO HB3 . 4 . HB2 1 1 45 1 2 1 1 4 PRO HD3 . 4 . HD2 1 1 46 1 1 1 1 4 PRO HB3 . 4 . HB2 1 1 46 1 2 1 1 5 ARG H . 5 . HN 1 1 47 1 1 1 1 4 PRO HD2 . 4 . HD1 1 1 47 1 2 1 1 4 PRO HG3 . 4 . HG2 1 1 48 1 1 1 1 4 PRO HD3 . 4 . HD2 1 1 48 1 2 1 1 4 PRO HG3 . 4 . HG2 1 1 49 1 1 1 1 4 PRO HG3 . 4 . HG2 1 1 49 1 2 1 1 5 ARG H . 5 . HN 1 1 50 1 1 1 1 5 ARG H . 5 . HN 1 1 50 1 2 1 1 5 ARG HA . 5 . HA 1 1 51 1 1 1 1 5 ARG H . 5 . HN 1 1 51 1 2 1 1 5 ARG HB2 . 5 . HB1 1 1 52 1 1 1 1 5 ARG H . 5 . HN 1 1 52 1 2 1 1 5 ARG HB3 . 5 . HB2 1 1 53 1 1 1 1 5 ARG H . 5 . HN 1 1 53 1 2 1 1 5 ARG QD . 5 . HD1 1 1 54 1 1 1 1 5 ARG H . 5 . HN 1 1 54 1 2 1 1 5 ARG HG3 . 5 . HG2 1 1 55 1 1 1 1 5 ARG H . 5 . HN 1 1 55 1 2 1 1 6 GLY H . 6 . HN 1 1 56 1 1 1 1 5 ARG HA . 5 . HA 1 1 56 1 2 1 1 5 ARG HB2 . 5 . HB1 1 1 57 1 1 1 1 5 ARG HA . 5 . HA 1 1 57 1 2 1 1 5 ARG HB3 . 5 . HB2 1 1 58 1 1 1 1 5 ARG HA . 5 . HA 1 1 58 1 2 1 1 5 ARG QD . 5 . HD1 1 1 59 1 1 1 1 5 ARG HA . 5 . HA 1 1 59 1 2 1 1 5 ARG HD3 . 5 . HD2 1 1 60 1 1 1 1 5 ARG HA . 5 . HA 1 1 60 1 2 1 1 5 ARG HG3 . 5 . HG2 1 1 61 1 1 1 1 5 ARG HA . 5 . HA 1 1 61 1 2 1 1 6 GLY H . 6 . HN 1 1 62 1 1 1 1 5 ARG HA . 5 . HA 1 1 62 1 2 1 1 15 TRP HD1 . 15 . HD1 1 1 63 1 1 1 1 5 ARG HA . 5 . HA 1 1 63 1 2 1 1 15 TRP HE1 . 15 . HE1 1 1 64 1 1 1 1 5 ARG HB2 . 5 . HB1 1 1 64 1 2 1 1 5 ARG HD3 . 5 . HD2 1 1 65 1 1 1 1 5 ARG HB2 . 5 . HB1 1 1 65 1 2 1 1 6 GLY H . 6 . HN 1 1 66 1 1 1 1 5 ARG HB3 . 5 . HB2 1 1 66 1 2 1 1 5 ARG HD3 . 5 . HD2 1 1 67 1 1 1 1 5 ARG HB3 . 5 . HB2 1 1 67 1 2 1 1 15 TRP HD1 . 15 . HD1 1 1 68 1 1 1 1 5 ARG QD . 5 . HD1 1 1 68 1 2 1 1 15 TRP HE3 . 15 . HE3 1 1 69 1 1 1 1 5 ARG HD3 . 5 . HD2 1 1 69 1 2 1 1 5 ARG HG3 . 5 . HG2 1 1 70 1 1 1 1 5 ARG QG . 5 . HG1 1 1 70 1 2 1 1 6 GLY H . 6 . HN 1 1 71 1 1 1 1 5 ARG HG3 . 5 . HG2 1 1 71 1 2 1 1 6 GLY H . 6 . HN 1 1 72 1 1 1 1 5 ARG HG3 . 5 . HG2 1 1 72 1 2 1 1 15 TRP HD1 . 15 . HD1 1 1 73 1 1 1 1 6 GLY H . 6 . HN 1 1 73 1 2 1 1 6 GLY HA2 . 6 . HA1 1 1 74 1 1 1 1 6 GLY H . 6 . HN 1 1 74 1 2 1 1 7 SER H . 7 . HN 1 1 75 1 1 1 1 6 GLY HA3 . 6 . HA2 1 1 75 1 2 1 1 7 SER H . 7 . HN 1 1 76 1 1 1 1 7 SER H . 7 . HN 1 1 76 1 2 1 1 7 SER HA . 7 . HA 1 1 77 1 1 1 1 7 SER H . 7 . HN 1 1 77 1 2 1 1 7 SER HB2 . 7 . HB1 1 1 78 1 1 1 1 7 SER H . 7 . HN 1 1 78 1 2 1 1 7 SER HB3 . 7 . HB2 1 1 79 1 1 1 1 7 SER HA . 7 . HA 1 1 79 1 2 1 1 7 SER HB3 . 7 . HB2 1 1 80 1 1 1 1 7 SER HA . 7 . HA 1 1 80 1 2 1 1 8 SER H . 8 . HN 1 1 81 1 1 1 1 8 SER H . 8 . HN 1 1 81 1 2 1 1 8 SER HA . 8 . HA 1 1 82 1 1 1 1 8 SER H . 8 . HN 1 1 82 1 2 1 1 8 SER HB3 . 8 . HB2 1 1 83 1 1 1 1 8 SER HA . 8 . HA 1 1 83 1 2 1 1 9 PRO HB2 . 9 . HB1 1 1 84 1 1 1 1 8 SER HA . 8 . HA 1 1 84 1 2 1 1 9 PRO HD2 . 9 . HD1 1 1 85 1 1 1 1 8 SER HA . 8 . HA 1 1 85 1 2 1 1 9 PRO HD3 . 9 . HD2 1 1 86 1 1 1 1 8 SER HA . 8 . HA 1 1 86 1 2 1 1 9 PRO HG3 . 9 . HG2 1 1 87 1 1 1 1 9 PRO HA . 9 . HA 1 1 87 1 2 1 1 9 PRO HD2 . 9 . HD1 1 1 88 1 1 1 1 9 PRO HA . 9 . HA 1 1 88 1 2 1 1 10 GLY H . 10 . HN 1 1 89 1 1 1 1 9 PRO HB2 . 9 . HB1 1 1 89 1 2 1 1 9 PRO HD2 . 9 . HD1 1 1 90 1 1 1 1 9 PRO HB2 . 9 . HB1 1 1 90 1 2 1 1 9 PRO HD3 . 9 . HD2 1 1 91 1 1 1 1 9 PRO HB2 . 9 . HB1 1 1 91 1 2 1 1 10 GLY H . 10 . HN 1 1 92 1 1 1 1 9 PRO HB3 . 9 . HB2 1 1 92 1 2 1 1 9 PRO HD2 . 9 . HD1 1 1 93 1 1 1 1 9 PRO HB3 . 9 . HB2 1 1 93 1 2 1 1 10 GLY H . 10 . HN 1 1 94 1 1 1 1 9 PRO HD2 . 9 . HD1 1 1 94 1 2 1 1 9 PRO HG3 . 9 . HG2 1 1 95 1 1 1 1 9 PRO HD2 . 9 . HD1 1 1 95 1 2 1 1 10 GLY H . 10 . HN 1 1 96 1 1 1 1 9 PRO HD3 . 9 . HD2 1 1 96 1 2 1 1 9 PRO HG3 . 9 . HG2 1 1 97 1 1 1 1 9 PRO HD3 . 9 . HD2 1 1 97 1 2 1 1 10 GLY H . 10 . HN 1 1 98 1 1 1 1 9 PRO HG3 . 9 . HG2 1 1 98 1 2 1 1 10 GLY H . 10 . HN 1 1 99 1 1 1 1 10 GLY QA . 10 . HA1 1 1 99 1 2 1 1 13 LYS HB3 . 13 . HB2 1 1 100 1 1 1 1 10 GLY HA3 . 10 . HA2 1 1 100 1 2 1 1 13 LYS H . 13 . HN 1 1 101 1 1 1 1 11 GLY H . 11 . HN 1 1 101 1 2 1 1 11 GLY HA3 . 11 . HA2 1 1 102 1 1 1 1 11 GLY H . 11 . HN 1 1 102 1 2 1 1 12 ASP H . 12 . HN 1 1 103 1 1 1 1 11 GLY H . 11 . HN 1 1 103 1 2 1 1 13 LYS H . 13 . HN 1 1 104 1 1 1 1 11 GLY HA2 . 11 . HA1 1 1 104 1 2 1 1 12 ASP H . 12 . HN 1 1 105 1 1 1 1 11 GLY HA3 . 11 . HA2 1 1 105 1 2 1 1 12 ASP H . 12 . HN 1 1 106 1 1 1 1 11 GLY HA3 . 11 . HA2 1 1 106 1 2 1 1 13 LYS H . 13 . HN 1 1 107 1 1 1 1 11 GLY HA3 . 11 . HA2 1 1 107 1 2 1 1 14 LEU H . 14 . HN 1 1 108 1 1 1 1 11 GLY HA3 . 11 . HA2 1 1 108 1 2 1 1 14 LEU MD2 . 14 . HD21 1 1 109 1 1 1 1 12 ASP H . 12 . HN 1 1 109 1 2 1 1 12 ASP HA . 12 . HA 1 1 110 1 1 1 1 12 ASP H . 12 . HN 1 1 110 1 2 1 1 12 ASP HB2 . 12 . HB2 1 1 111 1 1 1 1 12 ASP H . 12 . HN 1 1 111 1 2 1 1 13 LYS H . 13 . HN 1 1 112 1 1 1 1 12 ASP H . 12 . HN 1 1 112 1 2 1 1 14 LEU H . 14 . HN 1 1 113 1 1 1 1 12 ASP H . 12 . HN 1 1 113 1 2 1 1 15 TRP H . 15 . HN 1 1 114 1 1 1 1 12 ASP H . 12 . HN 1 1 114 1 2 1 1 15 TRP HD1 . 15 . HD1 1 1 115 1 1 1 1 12 ASP HA . 12 . HA 1 1 115 1 2 1 1 13 LYS H . 13 . HN 1 1 116 1 1 1 1 12 ASP HA . 12 . HA 1 1 116 1 2 1 1 15 TRP H . 15 . HN 1 1 117 1 1 1 1 12 ASP HA . 12 . HA 1 1 117 1 2 1 1 15 TRP HB3 . 15 . HB2 1 1 118 1 1 1 1 12 ASP HA . 12 . HA 1 1 118 1 2 1 1 15 TRP HD1 . 15 . HD1 1 1 119 1 1 1 1 12 ASP HA . 12 . HA 1 1 119 1 2 1 1 15 TRP HE1 . 15 . HE1 1 1 120 1 1 1 1 12 ASP HA . 12 . HA 1 1 120 1 2 1 1 16 GLN H . 16 . HN 1 1 121 1 1 1 1 12 ASP QB . 12 . HB1 1 1 121 1 2 1 1 15 TRP HB3 . 15 . HB2 1 1 122 1 1 1 1 12 ASP HB2 . 12 . HB2 1 1 122 1 2 1 1 13 LYS QB . 13 . HB1 1 1 123 1 1 1 1 12 ASP HB2 . 12 . HB2 1 1 123 1 2 1 1 15 TRP HB3 . 15 . HB2 1 1 124 1 1 1 1 12 ASP HB2 . 12 . HB2 1 1 124 1 2 1 1 15 TRP HD1 . 15 . HD1 1 1 125 1 1 1 1 13 LYS H . 13 . HN 1 1 125 1 2 1 1 13 LYS HA . 13 . HA 1 1 126 1 1 1 1 13 LYS H . 13 . HN 1 1 126 1 2 1 1 13 LYS HB3 . 13 . HB2 1 1 127 1 1 1 1 13 LYS H . 13 . HN 1 1 127 1 2 1 1 13 LYS HD2 . 13 . HD2 1 1 128 1 1 1 1 13 LYS H . 13 . HN 1 1 128 1 2 1 1 13 LYS HG2 . 13 . HG1 1 1 129 1 1 1 1 13 LYS H . 13 . HN 1 1 129 1 2 1 1 13 LYS HG3 . 13 . HG2 1 1 130 1 1 1 1 13 LYS H . 13 . HN 1 1 130 1 2 1 1 14 LEU H . 14 . HN 1 1 131 1 1 1 1 13 LYS HA . 13 . HA 1 1 131 1 2 1 1 13 LYS HB3 . 13 . HB2 1 1 132 1 1 1 1 13 LYS HA . 13 . HA 1 1 132 1 2 1 1 13 LYS HG2 . 13 . HG1 1 1 133 1 1 1 1 13 LYS HA . 13 . HA 1 1 133 1 2 1 1 14 LEU H . 14 . HN 1 1 134 1 1 1 1 13 LYS HA . 13 . HA 1 1 134 1 2 1 1 15 TRP H . 15 . HN 1 1 135 1 1 1 1 13 LYS HA . 13 . HA 1 1 135 1 2 1 1 16 GLN H . 16 . HN 1 1 136 1 1 1 1 13 LYS HA . 13 . HA 1 1 136 1 2 1 1 16 GLN HB3 . 16 . HB2 1 1 137 1 1 1 1 13 LYS HA . 13 . HA 1 1 137 1 2 1 1 16 GLN HG2 . 16 . HG2 1 1 138 1 1 1 1 13 LYS QB . 13 . HB1 1 1 138 1 2 1 1 14 LEU MD1 . 14 . HD11 1 1 139 1 1 1 1 13 LYS HB3 . 13 . HB2 1 1 139 1 2 1 1 13 LYS HD2 . 13 . HD2 1 1 140 1 1 1 1 13 LYS HB3 . 13 . HB2 1 1 140 1 2 1 1 13 LYS HE2 . 13 . HE2 1 1 141 1 1 1 1 13 LYS HB3 . 13 . HB2 1 1 141 1 2 1 1 13 LYS HG2 . 13 . HG1 1 1 142 1 1 1 1 13 LYS HB3 . 13 . HB2 1 1 142 1 2 1 1 13 LYS HG3 . 13 . HG2 1 1 143 1 1 1 1 13 LYS HB3 . 13 . HB2 1 1 143 1 2 1 1 14 LEU H . 14 . HN 1 1 144 1 1 1 1 13 LYS HB3 . 13 . HB2 1 1 144 1 2 1 1 16 GLN H . 16 . HN 1 1 145 1 1 1 1 13 LYS HD2 . 13 . HD2 1 1 145 1 2 1 1 16 GLN H . 16 . HN 1 1 146 1 1 1 1 13 LYS QE . 13 . HE1 1 1 146 1 2 1 1 14 LEU MD1 . 14 . HD11 1 1 147 1 1 1 1 13 LYS HE2 . 13 . HE2 1 1 147 1 2 1 1 13 LYS HG2 . 13 . HG1 1 1 148 1 1 1 1 13 LYS HE2 . 13 . HE2 1 1 148 1 2 1 1 14 LEU MD1 . 14 . HD11 1 1 149 1 1 1 1 13 LYS HG2 . 13 . HG1 1 1 149 1 2 1 1 17 ILE HB . 17 . HB 1 1 150 1 1 1 1 13 LYS HG3 . 13 . HG2 1 1 150 1 2 1 1 14 LEU H . 14 . HN 1 1 151 1 1 1 1 13 LYS HG3 . 13 . HG2 1 1 151 1 2 1 1 17 ILE HB . 17 . HB 1 1 152 1 1 1 1 14 LEU H . 14 . HN 1 1 152 1 2 1 1 14 LEU HA . 14 . HA 1 1 153 1 1 1 1 14 LEU H . 14 . HN 1 1 153 1 2 1 1 14 LEU HB2 . 14 . HB2 1 1 154 1 1 1 1 14 LEU H . 14 . HN 1 1 154 1 2 1 1 14 LEU HB3 . 14 . HB1 1 1 155 1 1 1 1 14 LEU H . 14 . HN 1 1 155 1 2 1 1 14 LEU MD1 . 14 . HD11 1 1 156 1 1 1 1 14 LEU H . 14 . HN 1 1 156 1 2 1 1 14 LEU MD2 . 14 . HD21 1 1 157 1 1 1 1 14 LEU H . 14 . HN 1 1 157 1 2 1 1 14 LEU HG . 14 . HG 1 1 158 1 1 1 1 14 LEU HA . 14 . HA 1 1 158 1 2 1 1 14 LEU HB2 . 14 . HB2 1 1 159 1 1 1 1 14 LEU HA . 14 . HA 1 1 159 1 2 1 1 14 LEU HB3 . 14 . HB1 1 1 160 1 1 1 1 14 LEU HA . 14 . HA 1 1 160 1 2 1 1 14 LEU MD1 . 14 . HD11 1 1 161 1 1 1 1 14 LEU HA . 14 . HA 1 1 161 1 2 1 1 14 LEU MD2 . 14 . HD21 1 1 162 1 1 1 1 14 LEU HA . 14 . HA 1 1 162 1 2 1 1 14 LEU HG . 14 . HG 1 1 163 1 1 1 1 14 LEU HA . 14 . HA 1 1 163 1 2 1 1 15 TRP H . 15 . HN 1 1 164 1 1 1 1 14 LEU HA . 14 . HA 1 1 164 1 2 1 1 17 ILE HA . 17 . HA 1 1 165 1 1 1 1 14 LEU HA . 14 . HA 1 1 165 1 2 1 1 17 ILE HB . 17 . HB 1 1 166 1 1 1 1 14 LEU HA . 14 . HA 1 1 166 1 2 1 1 17 ILE HG13 . 17 . HG12 1 1 167 1 1 1 1 14 LEU HA . 14 . HA 1 1 167 1 2 1 1 18 TYR H . 18 . HN 1 1 168 1 1 1 1 14 LEU HB2 . 14 . HB2 1 1 168 1 2 1 1 14 LEU MD1 . 14 . HD11 1 1 169 1 1 1 1 14 LEU HB2 . 14 . HB2 1 1 169 1 2 1 1 14 LEU MD2 . 14 . HD21 1 1 170 1 1 1 1 14 LEU HB2 . 14 . HB2 1 1 170 1 2 1 1 15 TRP H . 15 . HN 1 1 171 1 1 1 1 14 LEU HB3 . 14 . HB1 1 1 171 1 2 1 1 14 LEU MD1 . 14 . HD11 1 1 172 1 1 1 1 14 LEU HB3 . 14 . HB1 1 1 172 1 2 1 1 14 LEU MD2 . 14 . HD21 1 1 173 1 1 1 1 14 LEU HB3 . 14 . HB1 1 1 173 1 2 1 1 15 TRP H . 15 . HN 1 1 174 1 1 1 1 14 LEU MD1 . 14 . HD11 1 1 174 1 2 1 1 14 LEU MD2 . 14 . HD21 1 1 175 1 1 1 1 14 LEU MD1 . 14 . HD11 1 1 175 1 2 1 1 14 LEU HG . 14 . HG 1 1 176 1 1 1 1 14 LEU MD2 . 14 . HD21 1 1 176 1 2 1 1 14 LEU HG . 14 . HG 1 1 177 1 1 1 1 14 LEU MD2 . 14 . HD21 1 1 177 1 2 1 1 15 TRP H . 15 . HN 1 1 178 1 1 1 1 14 LEU MD2 . 14 . HD21 1 1 178 1 2 1 1 17 ILE HB . 17 . HB 1 1 179 1 1 1 1 15 TRP H . 15 . HN 1 1 179 1 2 1 1 15 TRP HA . 15 . HA 1 1 180 1 1 1 1 15 TRP H . 15 . HN 1 1 180 1 2 1 1 15 TRP HB3 . 15 . HB2 1 1 181 1 1 1 1 15 TRP H . 15 . HN 1 1 181 1 2 1 1 15 TRP HD1 . 15 . HD1 1 1 182 1 1 1 1 15 TRP H . 15 . HN 1 1 182 1 2 1 1 15 TRP HE3 . 15 . HE3 1 1 183 1 1 1 1 15 TRP H . 15 . HN 1 1 183 1 2 1 1 16 GLN H . 16 . HN 1 1 184 1 1 1 1 15 TRP H . 15 . HN 1 1 184 1 2 1 1 16 GLN HA . 16 . HA 1 1 185 1 1 1 1 15 TRP H . 15 . HN 1 1 185 1 2 1 1 18 TYR H . 18 . HN 1 1 186 1 1 1 1 15 TRP HA . 15 . HA 1 1 186 1 2 1 1 15 TRP HB3 . 15 . HB2 1 1 187 1 1 1 1 15 TRP HA . 15 . HA 1 1 187 1 2 1 1 15 TRP HD1 . 15 . HD1 1 1 188 1 1 1 1 15 TRP HA . 15 . HA 1 1 188 1 2 1 1 15 TRP HE3 . 15 . HE3 1 1 189 1 1 1 1 15 TRP HA . 15 . HA 1 1 189 1 2 1 1 15 TRP HZ3 . 15 . HZ3 1 1 190 1 1 1 1 15 TRP HA . 15 . HA 1 1 190 1 2 1 1 16 GLN H . 16 . HN 1 1 191 1 1 1 1 15 TRP HA . 15 . HA 1 1 191 1 2 1 1 18 TYR H . 18 . HN 1 1 192 1 1 1 1 15 TRP HA . 15 . HA 1 1 192 1 2 1 1 18 TYR HB3 . 18 . HB2 1 1 193 1 1 1 1 15 TRP HA . 15 . HA 1 1 193 1 2 1 1 18 TYR HD1 . 18 . HD1 1 1 194 1 1 1 1 15 TRP HA . 15 . HA 1 1 194 1 2 1 1 18 TYR HE1 . 18 . HE1 1 1 195 1 1 1 1 15 TRP HA . 15 . HA 1 1 195 1 2 1 1 19 LEU H . 19 . HN 1 1 196 1 1 1 1 15 TRP HA . 15 . HA 1 1 196 1 2 1 1 19 LEU HB2 . 19 . HB2 1 1 197 1 1 1 1 15 TRP HA . 15 . HA 1 1 197 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 198 1 1 1 1 15 TRP QB . 15 . HB1 1 1 198 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 199 1 1 1 1 15 TRP HB3 . 15 . HB2 1 1 199 1 2 1 1 15 TRP HE3 . 15 . HE3 1 1 200 1 1 1 1 15 TRP HB3 . 15 . HB2 1 1 200 1 2 1 1 15 TRP HZ3 . 15 . HZ3 1 1 201 1 1 1 1 15 TRP HB3 . 15 . HB2 1 1 201 1 2 1 1 18 TYR H . 18 . HN 1 1 202 1 1 1 1 15 TRP HB3 . 15 . HB2 1 1 202 1 2 1 1 18 TYR HD1 . 18 . HD1 1 1 203 1 1 1 1 15 TRP HB3 . 15 . HB2 1 1 203 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 204 1 1 1 1 15 TRP HD1 . 15 . HD1 1 1 204 1 2 1 1 16 GLN H . 16 . HN 1 1 205 1 1 1 1 15 TRP HD1 . 15 . HD1 1 1 205 1 2 1 1 16 GLN HG2 . 16 . HG2 1 1 206 1 1 1 1 15 TRP HD1 . 15 . HD1 1 1 206 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 207 1 1 1 1 15 TRP HE1 . 15 . HE1 1 1 207 1 2 1 1 19 LEU HB2 . 19 . HB2 1 1 208 1 1 1 1 15 TRP HE1 . 15 . HE1 1 1 208 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 209 1 1 1 1 15 TRP HE3 . 15 . HE3 1 1 209 1 2 1 1 16 GLN H . 16 . HN 1 1 210 1 1 1 1 15 TRP HE3 . 15 . HE3 1 1 210 1 2 1 1 16 GLN HA . 16 . HA 1 1 211 1 1 1 1 15 TRP HE3 . 15 . HE3 1 1 211 1 2 1 1 16 GLN HB3 . 16 . HB2 1 1 212 1 1 1 1 15 TRP HE3 . 15 . HE3 1 1 212 1 2 1 1 16 GLN HG2 . 16 . HG2 1 1 213 1 1 1 1 15 TRP HE3 . 15 . HE3 1 1 213 1 2 1 1 18 TYR H . 18 . HN 1 1 214 1 1 1 1 15 TRP HE3 . 15 . HE3 1 1 214 1 2 1 1 18 TYR HD1 . 18 . HD1 1 1 215 1 1 1 1 15 TRP HE3 . 15 . HE3 1 1 215 1 2 1 1 18 TYR HE1 . 18 . HE1 1 1 216 1 1 1 1 15 TRP HE3 . 15 . HE3 1 1 216 1 2 1 1 19 LEU H . 19 . HN 1 1 217 1 1 1 1 15 TRP HE3 . 15 . HE3 1 1 217 1 2 1 1 19 LEU HB2 . 19 . HB2 1 1 218 1 1 1 1 15 TRP HE3 . 15 . HE3 1 1 218 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 219 1 1 1 1 15 TRP HE3 . 15 . HE3 1 1 219 1 2 1 1 19 LEU HG . 19 . HG 1 1 220 1 1 1 1 15 TRP HH2 . 15 . HH2 1 1 220 1 2 1 1 18 TYR QE . 18 . HE1 1 1 221 1 1 1 1 15 TRP HH2 . 15 . HH2 1 1 221 1 2 1 1 19 LEU H . 19 . HN 1 1 222 1 1 1 1 15 TRP HH2 . 15 . HH2 1 1 222 1 2 1 1 19 LEU QB . 19 . HB1 1 1 223 1 1 1 1 15 TRP HH2 . 15 . HH2 1 1 223 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 224 1 1 1 1 15 TRP HH2 . 15 . HH2 1 1 224 1 2 1 1 19 LEU MD2 . 19 . HD21 1 1 225 1 1 1 1 15 TRP HH2 . 15 . HH2 1 1 225 1 2 1 1 20 ASN HA . 20 . HA 1 1 226 1 1 1 1 15 TRP HH2 . 15 . HH2 1 1 226 1 2 1 1 20 ASN HB2 . 20 . HB2 1 1 227 1 1 1 1 15 TRP HH2 . 15 . HH2 1 1 227 1 2 1 1 20 ASN HB3 . 20 . HB1 1 1 228 1 1 1 1 15 TRP HZ2 . 15 . HZ2 1 1 228 1 2 1 1 18 TYR HE1 . 18 . HE1 1 1 229 1 1 1 1 15 TRP HZ2 . 15 . HZ2 1 1 229 1 2 1 1 19 LEU QB . 19 . HB1 1 1 230 1 1 1 1 15 TRP HZ2 . 15 . HZ2 1 1 230 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 231 1 1 1 1 15 TRP HZ2 . 15 . HZ2 1 1 231 1 2 1 1 19 LEU MD2 . 19 . HD21 1 1 232 1 1 1 1 15 TRP HZ3 . 15 . HZ3 1 1 232 1 2 1 1 16 GLN HA . 16 . HA 1 1 233 1 1 1 1 15 TRP HZ3 . 15 . HZ3 1 1 233 1 2 1 1 16 GLN HG2 . 16 . HG2 1 1 234 1 1 1 1 15 TRP HZ3 . 15 . HZ3 1 1 234 1 2 1 1 19 LEU HA . 19 . HA 1 1 235 1 1 1 1 15 TRP HZ3 . 15 . HZ3 1 1 235 1 2 1 1 19 LEU QB . 19 . HB1 1 1 236 1 1 1 1 15 TRP HZ3 . 15 . HZ3 1 1 236 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 237 1 1 1 1 15 TRP HZ3 . 15 . HZ3 1 1 237 1 2 1 1 19 LEU MD2 . 19 . HD21 1 1 238 1 1 1 1 15 TRP HZ3 . 15 . HZ3 1 1 238 1 2 1 1 20 ASN H . 20 . HN 1 1 239 1 1 1 1 15 TRP HZ3 . 15 . HZ3 1 1 239 1 2 1 1 20 ASN HA . 20 . HA 1 1 240 1 1 1 1 15 TRP HZ3 . 15 . HZ3 1 1 240 1 2 1 1 20 ASN HB2 . 20 . HB2 1 1 241 1 1 1 1 15 TRP HZ3 . 15 . HZ3 1 1 241 1 2 1 1 20 ASN HB3 . 20 . HB1 1 1 242 1 1 1 1 16 GLN H . 16 . HN 1 1 242 1 2 1 1 16 GLN HA . 16 . HA 1 1 243 1 1 1 1 16 GLN H . 16 . HN 1 1 243 1 2 1 1 16 GLN HB3 . 16 . HB2 1 1 244 1 1 1 1 16 GLN H . 16 . HN 1 1 244 1 2 1 1 16 GLN HG2 . 16 . HG2 1 1 245 1 1 1 1 16 GLN H . 16 . HN 1 1 245 1 2 1 1 17 ILE H . 17 . HN 1 1 246 1 1 1 1 16 GLN H . 16 . HN 1 1 246 1 2 1 1 17 ILE HA . 17 . HA 1 1 247 1 1 1 1 16 GLN H . 16 . HN 1 1 247 1 2 1 1 17 ILE HB . 17 . HB 1 1 248 1 1 1 1 16 GLN H . 16 . HN 1 1 248 1 2 1 1 17 ILE HG12 . 17 . HG11 1 1 249 1 1 1 1 16 GLN H . 16 . HN 1 1 249 1 2 1 1 17 ILE HG13 . 17 . HG12 1 1 250 1 1 1 1 16 GLN H . 16 . HN 1 1 250 1 2 1 1 18 TYR H . 18 . HN 1 1 251 1 1 1 1 16 GLN H . 16 . HN 1 1 251 1 2 1 1 19 LEU H . 19 . HN 1 1 252 1 1 1 1 16 GLN HA . 16 . HA 1 1 252 1 2 1 1 16 GLN HB3 . 16 . HB2 1 1 253 1 1 1 1 16 GLN HA . 16 . HA 1 1 253 1 2 1 1 16 GLN HE22 . 16 . HE22 1 1 254 1 1 1 1 16 GLN HA . 16 . HA 1 1 254 1 2 1 1 16 GLN HG2 . 16 . HG2 1 1 255 1 1 1 1 16 GLN HA . 16 . HA 1 1 255 1 2 1 1 17 ILE H . 17 . HN 1 1 256 1 1 1 1 16 GLN HA . 16 . HA 1 1 256 1 2 1 1 19 LEU H . 19 . HN 1 1 257 1 1 1 1 16 GLN HA . 16 . HA 1 1 257 1 2 1 1 20 ASN HD21 . 20 . HD21 1 1 258 1 1 1 1 16 GLN HA . 16 . HA 1 1 258 1 2 1 1 20 ASN HD22 . 20 . HD22 1 1 259 1 1 1 1 16 GLN QB . 16 . HB1 1 1 259 1 2 1 1 16 GLN HE21 . 16 . HE21 1 1 260 1 1 1 1 16 GLN QB . 16 . HB1 1 1 260 1 2 1 1 16 GLN HE22 . 16 . HE22 1 1 261 1 1 1 1 16 GLN HB3 . 16 . HB2 1 1 261 1 2 1 1 16 GLN HE21 . 16 . HE21 1 1 262 1 1 1 1 16 GLN HB3 . 16 . HB2 1 1 262 1 2 1 1 16 GLN HE22 . 16 . HE22 1 1 263 1 1 1 1 16 GLN HB3 . 16 . HB2 1 1 263 1 2 1 1 17 ILE H . 17 . HN 1 1 264 1 1 1 1 16 GLN HB3 . 16 . HB2 1 1 264 1 2 1 1 20 ASN HD21 . 20 . HD21 1 1 265 1 1 1 1 16 GLN HB3 . 16 . HB2 1 1 265 1 2 1 1 20 ASN HD22 . 20 . HD22 1 1 266 1 1 1 1 16 GLN HE21 . 16 . HE21 1 1 266 1 2 1 1 16 GLN HG2 . 16 . HG2 1 1 267 1 1 1 1 16 GLN QG . 16 . HG1 1 1 267 1 2 1 1 17 ILE H . 17 . HN 1 1 268 1 1 1 1 16 GLN HG2 . 16 . HG2 1 1 268 1 2 1 1 20 ASN HD21 . 20 . HD21 1 1 269 1 1 1 1 16 GLN HG2 . 16 . HG2 1 1 269 1 2 1 1 20 ASN HD22 . 20 . HD22 1 1 270 1 1 1 1 17 ILE H . 17 . HN 1 1 270 1 2 1 1 17 ILE HA . 17 . HA 1 1 271 1 1 1 1 17 ILE H . 17 . HN 1 1 271 1 2 1 1 17 ILE HB . 17 . HB 1 1 272 1 1 1 1 17 ILE H . 17 . HN 1 1 272 1 2 1 1 17 ILE HG12 . 17 . HG11 1 1 273 1 1 1 1 17 ILE H . 17 . HN 1 1 273 1 2 1 1 17 ILE HG13 . 17 . HG12 1 1 274 1 1 1 1 17 ILE H . 17 . HN 1 1 274 1 2 1 1 18 TYR H . 18 . HN 1 1 275 1 1 1 1 17 ILE H . 17 . HN 1 1 275 1 2 1 1 18 TYR HB3 . 18 . HB2 1 1 276 1 1 1 1 17 ILE H . 17 . HN 1 1 276 1 2 1 1 18 TYR HD1 . 18 . HD1 1 1 277 1 1 1 1 17 ILE H . 17 . HN 1 1 277 1 2 1 1 19 LEU H . 19 . HN 1 1 278 1 1 1 1 17 ILE HA . 17 . HA 1 1 278 1 2 1 1 17 ILE HB . 17 . HB 1 1 279 1 1 1 1 17 ILE HA . 17 . HA 1 1 279 1 2 1 1 17 ILE MD . 17 . HD11 1 1 280 1 1 1 1 17 ILE HA . 17 . HA 1 1 280 1 2 1 1 17 ILE HG12 . 17 . HG11 1 1 281 1 1 1 1 17 ILE HA . 17 . HA 1 1 281 1 2 1 1 17 ILE HG13 . 17 . HG12 1 1 282 1 1 1 1 17 ILE HA . 17 . HA 1 1 282 1 2 1 1 17 ILE MG . 17 . HG21 1 1 283 1 1 1 1 17 ILE HA . 17 . HA 1 1 283 1 2 1 1 18 TYR H . 18 . HN 1 1 284 1 1 1 1 17 ILE HA . 17 . HA 1 1 284 1 2 1 1 18 TYR HA . 18 . HA 1 1 285 1 1 1 1 17 ILE HA . 17 . HA 1 1 285 1 2 1 1 18 TYR HD1 . 18 . HD1 1 1 286 1 1 1 1 17 ILE HA . 17 . HA 1 1 286 1 2 1 1 19 LEU H . 19 . HN 1 1 287 1 1 1 1 17 ILE HA . 17 . HA 1 1 287 1 2 1 1 20 ASN HB3 . 20 . HB1 1 1 288 1 1 1 1 17 ILE HA . 17 . HA 1 1 288 1 2 1 1 20 ASN HD21 . 20 . HD21 1 1 289 1 1 1 1 17 ILE HB . 17 . HB 1 1 289 1 2 1 1 17 ILE HG12 . 17 . HG11 1 1 290 1 1 1 1 17 ILE HB . 17 . HB 1 1 290 1 2 1 1 17 ILE HG13 . 17 . HG12 1 1 291 1 1 1 1 17 ILE HB . 17 . HB 1 1 291 1 2 1 1 17 ILE MG . 17 . HG21 1 1 292 1 1 1 1 17 ILE HB . 17 . HB 1 1 292 1 2 1 1 18 TYR H . 18 . HN 1 1 293 1 1 1 1 17 ILE HB . 17 . HB 1 1 293 1 2 1 1 18 TYR HB3 . 18 . HB2 1 1 294 1 1 1 1 17 ILE HB . 17 . HB 1 1 294 1 2 1 1 18 TYR HD1 . 18 . HD1 1 1 295 1 1 1 1 17 ILE MD . 17 . HD11 1 1 295 1 2 1 1 17 ILE HG12 . 17 . HG11 1 1 296 1 1 1 1 17 ILE HG13 . 17 . HG12 1 1 296 1 2 1 1 18 TYR H . 18 . HN 1 1 297 1 1 1 1 17 ILE MG . 17 . HG21 1 1 297 1 2 1 1 18 TYR QB . 18 . HB1 1 1 298 1 1 1 1 18 TYR H . 18 . HN 1 1 298 1 2 1 1 18 TYR HA . 18 . HA 1 1 299 1 1 1 1 18 TYR H . 18 . HN 1 1 299 1 2 1 1 18 TYR HB3 . 18 . HB2 1 1 300 1 1 1 1 18 TYR H . 18 . HN 1 1 300 1 2 1 1 18 TYR HD1 . 18 . HD1 1 1 301 1 1 1 1 18 TYR H . 18 . HN 1 1 301 1 2 1 1 18 TYR HE1 . 18 . HE1 1 1 302 1 1 1 1 18 TYR H . 18 . HN 1 1 302 1 2 1 1 19 LEU H . 19 . HN 1 1 303 1 1 1 1 18 TYR H . 18 . HN 1 1 303 1 2 1 1 19 LEU HB2 . 19 . HB2 1 1 304 1 1 1 1 18 TYR H . 18 . HN 1 1 304 1 2 1 1 20 ASN H . 20 . HN 1 1 305 1 1 1 1 18 TYR H . 18 . HN 1 1 305 1 2 1 1 20 ASN HB2 . 20 . HB2 1 1 306 1 1 1 1 18 TYR H . 18 . HN 1 1 306 1 2 1 1 20 ASN HB3 . 20 . HB1 1 1 307 1 1 1 1 18 TYR HA . 18 . HA 1 1 307 1 2 1 1 18 TYR HB3 . 18 . HB2 1 1 308 1 1 1 1 18 TYR HA . 18 . HA 1 1 308 1 2 1 1 19 LEU H . 19 . HN 1 1 309 1 1 1 1 18 TYR HA . 18 . HA 1 1 309 1 2 1 1 20 ASN H . 20 . HN 1 1 310 1 1 1 1 18 TYR QB . 18 . HB1 1 1 310 1 2 1 1 19 LEU QB . 19 . HB1 1 1 311 1 1 1 1 18 TYR HB3 . 18 . HB2 1 1 311 1 2 1 1 18 TYR HD1 . 18 . HD1 1 1 312 1 1 1 1 18 TYR HB3 . 18 . HB2 1 1 312 1 2 1 1 18 TYR HE1 . 18 . HE1 1 1 313 1 1 1 1 18 TYR HB3 . 18 . HB2 1 1 313 1 2 1 1 19 LEU H . 19 . HN 1 1 314 1 1 1 1 18 TYR HB3 . 18 . HB2 1 1 314 1 2 1 1 19 LEU HB2 . 19 . HB2 1 1 315 1 1 1 1 18 TYR HB3 . 18 . HB2 1 1 315 1 2 1 1 20 ASN H . 20 . HN 1 1 316 1 1 1 1 18 TYR HD1 . 18 . HD1 1 1 316 1 2 1 1 19 LEU HA . 19 . HA 1 1 317 1 1 1 1 18 TYR HD1 . 18 . HD1 1 1 317 1 2 1 1 19 LEU HB2 . 19 . HB2 1 1 318 1 1 1 1 18 TYR HD1 . 18 . HD1 1 1 318 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 319 1 1 1 1 18 TYR HD1 . 18 . HD1 1 1 319 1 2 1 1 19 LEU HG . 19 . HG 1 1 320 1 1 1 1 18 TYR HE1 . 18 . HE1 1 1 320 1 2 1 1 19 LEU H . 19 . HN 1 1 321 1 1 1 1 18 TYR HE1 . 18 . HE1 1 1 321 1 2 1 1 19 LEU HA . 19 . HA 1 1 322 1 1 1 1 18 TYR HE1 . 18 . HE1 1 1 322 1 2 1 1 19 LEU QB . 19 . HB1 1 1 323 1 1 1 1 18 TYR HE1 . 18 . HE1 1 1 323 1 2 1 1 19 LEU MD2 . 19 . HD21 1 1 324 1 1 1 1 18 TYR HE1 . 18 . HE1 1 1 324 1 2 1 1 20 ASN H . 20 . HN 1 1 325 1 1 1 1 19 LEU H . 19 . HN 1 1 325 1 2 1 1 19 LEU HA . 19 . HA 1 1 326 1 1 1 1 19 LEU H . 19 . HN 1 1 326 1 2 1 1 19 LEU HB2 . 19 . HB2 1 1 327 1 1 1 1 19 LEU H . 19 . HN 1 1 327 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 328 1 1 1 1 19 LEU H . 19 . HN 1 1 328 1 2 1 1 19 LEU HG . 19 . HG 1 1 329 1 1 1 1 19 LEU H . 19 . HN 1 1 329 1 2 1 1 20 ASN H . 20 . HN 1 1 330 1 1 1 1 19 LEU H . 19 . HN 1 1 330 1 2 1 1 20 ASN HB3 . 20 . HB1 1 1 331 1 1 1 1 19 LEU HA . 19 . HA 1 1 331 1 2 1 1 19 LEU HB2 . 19 . HB2 1 1 332 1 1 1 1 19 LEU HA . 19 . HA 1 1 332 1 2 1 1 19 LEU MD2 . 19 . HD21 1 1 333 1 1 1 1 19 LEU HA . 19 . HA 1 1 333 1 2 1 1 19 LEU HG . 19 . HG 1 1 334 1 1 1 1 19 LEU HA . 19 . HA 1 1 334 1 2 1 1 20 ASN H . 20 . HN 1 1 335 1 1 1 1 19 LEU HB2 . 19 . HB2 1 1 335 1 2 1 1 19 LEU MD1 . 19 . HD11 1 1 336 1 1 1 1 19 LEU HB2 . 19 . HB2 1 1 336 1 2 1 1 20 ASN H . 20 . HN 1 1 337 1 1 1 1 19 LEU MD1 . 19 . HD11 1 1 337 1 2 1 1 19 LEU HG . 19 . HG 1 1 338 1 1 1 1 19 LEU MD1 . 19 . HD11 1 1 338 1 2 1 1 20 ASN H . 20 . HN 1 1 339 1 1 1 1 19 LEU MD2 . 19 . HD21 1 1 339 1 2 1 1 19 LEU HG . 19 . HG 1 1 340 1 1 1 1 19 LEU MD2 . 19 . HD21 1 1 340 1 2 1 1 20 ASN H . 20 . HN 1 1 341 1 1 1 1 19 LEU HG . 19 . HG 1 1 341 1 2 1 1 20 ASN H . 20 . HN 1 1 342 1 1 1 1 20 ASN H . 20 . HN 1 1 342 1 2 1 1 20 ASN HA . 20 . HA 1 1 343 1 1 1 1 20 ASN H . 20 . HN 1 1 343 1 2 1 1 20 ASN HB3 . 20 . HB1 1 1 344 1 1 1 1 20 ASN HA . 20 . HA 1 1 344 1 2 1 1 20 ASN HB2 . 20 . HB2 1 1 345 1 1 1 1 20 ASN HA . 20 . HA 1 1 345 1 2 1 1 20 ASN HB3 . 20 . HB1 1 1 346 1 1 1 1 20 ASN HA . 20 . HA 1 1 346 1 2 1 1 20 ASN HD22 . 20 . HD22 1 1 347 1 1 1 1 20 ASN HB2 . 20 . HB2 1 1 347 1 2 1 1 20 ASN HD21 . 20 . HD21 1 1 348 1 1 1 1 20 ASN HB3 . 20 . HB1 1 1 348 1 2 1 1 20 ASN HD21 . 20 . HD21 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 . . . . . 2.658 1.775 4.541 1 1 2 1 . . . . . 2.266 1.624 3.908 1 1 3 1 . . . . . 2.49 1.715 4.265 1 1 4 1 . . . . . 3.334 1.945 5.723 1 1 5 1 . . . . . 2.921 1.854 4.988 1 1 6 1 . . . . . 3.812 1.996 6.628 1 1 7 1 . . . . . 3.403 1.955 5.851 1 1 8 1 . . . . . 3.266 1.932 5.6 1 1 9 1 . . . . . 3.537 1.973 6.101 1 1 10 1 . . . . . 2.542 1.735 4.349 1 1 11 1 . . . . . 2.988 1.872 5.104 1 1 12 1 . . . . . 3.704 1.989 6.419 1 1 13 1 . . . . . 2.238 1.612 3.864 1 1 14 1 . . . . . 2.373 1.669 4.077 1 1 15 1 . . . . . 3.142 1.908 5.376 1 1 16 1 . . . . . 3.5 1.968 6.032 1 1 17 1 . . . . . 3.137 1.907 5.367 1 1 18 1 . . . . . 2.877 1.842 4.912 1 1 19 1 . . . . . 3.099 1.899 5.299 1 1 20 1 . . . . . 3.073 1.893 5.253 1 1 21 1 . . . . . 2.519 1.726 4.312 1 1 22 1 . . . . . 2.647 1.771 4.523 1 1 23 1 . . . . . 2.403 1.681 4.125 1 1 24 1 . . . . . 2.744 1.803 4.685 1 1 25 1 . . . . . 2.24 1.613 3.867 1 1 26 1 . . . . . 2.366 1.666 4.066 1 1 27 1 . . . . . 3.489 1.967 6.011 1 1 28 1 . . . . . 3.31 1.94 5.68 1 1 29 1 . . . . . 2.824 1.827 4.821 1 1 30 1 . . . . . 3.27 1.933 5.607 1 1 31 1 . . . . . 3.239 1.927 5.551 1 1 32 1 . . . . . 2.921 1.854 4.988 1 1 33 1 . . . . . 2.576 1.747 4.405 1 1 34 1 . . . . . 2.523 1.727 4.319 1 1 35 1 . . . . . 2.58 1.748 4.412 1 1 36 1 . . . . . 3.101 1.899 5.303 1 1 37 1 . . . . . 2.488 1.714 4.262 1 1 38 1 . . . . . 3.0 1.875 5.125 1 1 39 1 . . . . . 3.518 1.971 6.065 1 1 40 1 . . . . . 3.678 1.987 6.369 1 1 41 1 . . . . . 2.821 1.826 4.816 1 1 42 1 . . . . . 2.852 1.835 4.869 1 1 43 1 . . . . . 3.226 1.925 5.527 1 1 44 1 . . . . . 2.866 1.839 4.893 1 1 45 1 . . . . . 2.799 1.82 4.778 1 1 46 1 . . . . . 3.274 1.935 5.613 1 1 47 1 . . . . . 2.23 1.608 3.852 1 1 48 1 . . . . . 2.335 1.654 4.016 1 1 49 1 . . . . . 3.518 1.971 6.065 1 1 50 1 . . . . . 2.69 1.785 4.595 1 1 51 1 . . . . . 2.905 1.85 4.96 1 1 52 1 . . . . . 2.791 1.817 4.765 1 1 53 1 . . . . . 3.697 1.988 6.406 1 1 54 1 . . . . . 2.898 1.848 4.948 1 1 55 1 . . . . . 3.704 1.989 6.419 1 1 56 1 . . . . . 2.416 1.686 4.146 1 1 57 1 . . . . . 2.613 1.759 4.467 1 1 58 1 . . . . . 3.158 1.911 5.405 1 1 59 1 . . . . . 2.866 1.839 4.893 1 1 60 1 . . . . . 2.502 1.719 4.285 1 1 61 1 . . . . . 2.565 1.743 4.387 1 1 62 1 . . . . . 2.932 1.857 5.007 1 1 63 1 . . . . . 3.249 1.929 5.569 1 1 64 1 . . . . . 2.477 1.71 4.244 1 1 65 1 . . . . . 3.767 1.993 6.541 1 1 66 1 . . . . . 2.739 1.801 4.677 1 1 67 1 . . . . . 3.626 1.983 6.269 1 1 68 1 . . . . . 3.605 1.981 6.229 1 1 69 1 . . . . . 2.373 1.669 4.077 1 1 70 1 . . . . . 3.898 1.998 6.798 1 1 71 1 . . . . . 3.612 1.982 6.242 1 1 72 1 . . . . . 3.599 1.98 6.218 1 1 73 1 . . . . . 2.934 1.858 5.01 1 1 74 1 . . . . . 3.372 1.951 5.793 1 1 75 1 . . . . . 2.865 1.839 4.891 1 1 76 1 . . . . . 2.644 1.77 4.518 1 1 77 1 . . . . . 2.542 1.735 4.349 1 1 78 1 . . . . . 2.895 1.847 4.943 1 1 79 1 . . . . . 2.404 1.681 4.127 1 1 80 1 . . . . . 2.479 1.711 4.247 1 1 81 1 . . . . . 2.553 1.739 4.367 1 1 82 1 . . . . . 2.248 1.617 3.879 1 1 83 1 . . . . . 3.647 1.985 6.309 1 1 84 1 . . . . . 2.157 1.575 3.739 1 1 85 1 . . . . . 2.253 1.619 3.887 1 1 86 1 . . . . . 3.253 1.93 5.576 1 1 87 1 . . . . . 3.201 1.92 5.482 1 1 88 1 . . . . . 2.497 1.718 4.276 1 1 89 1 . . . . . 3.153 1.911 5.395 1 1 90 1 . . . . . 3.155 1.91 5.4 1 1 91 1 . . . . . 3.385 1.953 5.817 1 1 92 1 . . . . . 2.657 1.774 4.54 1 1 93 1 . . . . . 3.437 1.961 5.913 1 1 94 1 . . . . . 2.527 1.729 4.325 1 1 95 1 . . . . . 3.715 1.99 6.44 1 1 96 1 . . . . . 2.668 1.778 4.558 1 1 97 1 . . . . . 3.591 1.979 6.203 1 1 98 1 . . . . . 3.721 1.99 6.452 1 1 99 1 . . . . . 3.164 1.913 5.415 1 1 100 1 . . . . . 3.26 1.932 5.588 1 1 101 1 . . . . . 2.44 1.696 4.184 1 1 102 1 . . . . . 2.69 1.785 4.595 1 1 103 1 . . . . . 3.813 1.996 6.63 1 1 104 1 . . . . . 2.629 1.765 4.493 1 1 105 1 . . . . . 2.684 1.784 4.584 1 1 106 1 . . . . . 3.769 1.993 6.545 1 1 107 1 . . . . . 3.641 1.984 6.298 1 1 108 1 . . . . . 3.616 1.982 6.25 1 1 109 1 . . . . . 2.519 1.726 4.312 1 1 110 1 . . . . . 2.283 1.632 3.934 1 1 111 1 . . . . . 2.637 1.768 4.506 1 1 112 1 . . . . . 3.647 1.984 6.31 1 1 113 1 . . . . . 3.659 1.985 6.333 1 1 114 1 . . . . . 3.518 1.971 6.065 1 1 115 1 . . . . . 2.514 1.724 4.304 1 1 116 1 . . . . . 3.028 1.882 5.174 1 1 117 1 . . . . . 2.924 1.855 4.993 1 1 118 1 . . . . . 2.536 1.732 4.34 1 1 119 1 . . . . . 3.437 1.961 5.913 1 1 120 1 . . . . . 3.648 1.984 6.312 1 1 121 1 . . . . . 3.288 1.937 5.639 1 1 122 1 . . . . . 3.831 1.996 6.666 1 1 123 1 . . . . . 3.121 1.903 5.339 1 1 124 1 . . . . . 3.114 1.902 5.326 1 1 125 1 . . . . . 2.504 1.72 4.288 1 1 126 1 . . . . . 2.306 1.641 3.971 1 1 127 1 . . . . . 3.342 1.946 5.738 1 1 128 1 . . . . . 3.08 1.894 5.266 1 1 129 1 . . . . . 3.099 1.899 5.299 1 1 130 1 . . . . . 2.568 1.744 4.392 1 1 131 1 . . . . . 2.315 1.645 3.985 1 1 132 1 . . . . . 2.642 1.769 4.515 1 1 133 1 . . . . . 2.586 1.75 4.422 1 1 134 1 . . . . . 3.211 1.922 5.5 1 1 135 1 . . . . . 2.904 1.85 4.958 1 1 136 1 . . . . . 2.8 1.82 4.78 1 1 137 1 . . . . . 3.217 1.923 5.511 1 1 138 1 . . . . . 2.913 1.852 4.974 1 1 139 1 . . . . . 2.493 1.716 4.27 1 1 140 1 . . . . . 3.342 1.946 5.738 1 1 141 1 . . . . . 2.535 1.732 4.338 1 1 142 1 . . . . . 2.646 1.771 4.521 1 1 143 1 . . . . . 2.572 1.745 4.399 1 1 144 1 . . . . . 3.826 1.996 6.656 1 1 145 1 . . . . . 3.284 1.936 5.632 1 1 146 1 . . . . . 3.181 1.916 5.446 1 1 147 1 . . . . . 2.749 1.804 4.694 1 1 148 1 . . . . . 3.016 1.879 5.153 1 1 149 1 . . . . . 3.447 1.962 5.932 1 1 150 1 . . . . . 3.696 1.988 6.404 1 1 151 1 . . . . . 3.581 1.978 6.184 1 1 152 1 . . . . . 2.341 1.656 4.026 1 1 153 1 . . . . . 2.558 1.74 4.376 1 1 154 1 . . . . . 2.447 1.699 4.195 1 1 155 1 . . . . . 2.291 1.635 3.947 1 1 156 1 . . . . . 2.977 1.869 5.085 1 1 157 1 . . . . . 2.664 1.777 4.551 1 1 158 1 . . . . . 2.575 1.746 4.404 1 1 159 1 . . . . . 2.551 1.738 4.364 1 1 160 1 . . . . . 2.068 1.533 3.603 1 1 161 1 . . . . . 2.536 1.732 4.34 1 1 162 1 . . . . . 2.867 1.839 4.895 1 1 163 1 . . . . . 2.747 1.804 4.69 1 1 164 1 . . . . . 3.447 1.962 5.932 1 1 165 1 . . . . . 2.637 1.768 4.506 1 1 166 1 . . . . . 3.506 1.969 6.043 1 1 167 1 . . . . . 3.609 1.981 6.237 1 1 168 1 . . . . . 2.393 1.677 4.109 1 1 169 1 . . . . . 2.56 1.741 4.379 1 1 170 1 . . . . . 2.869 1.84 4.898 1 1 171 1 . . . . . 2.373 1.669 4.077 1 1 172 1 . . . . . 2.562 1.741 4.383 1 1 173 1 . . . . . 2.858 1.837 4.879 1 1 174 1 . . . . . 1.858 1.426 3.29 1 1 175 1 . . . . . 2.139 1.567 3.711 1 1 176 1 . . . . . 2.385 1.674 4.096 1 1 177 1 . . . . . 3.807 1.995 6.619 1 1 178 1 . . . . . 3.326 1.943 5.709 1 1 179 1 . . . . . 2.528 1.729 4.327 1 1 180 1 . . . . . 2.348 1.659 4.037 1 1 181 1 . . . . . 3.359 1.949 5.769 1 1 182 1 . . . . . 3.164 1.913 5.415 1 1 183 1 . . . . . 2.528 1.729 4.327 1 1 184 1 . . . . . 3.412 1.956 5.868 1 1 185 1 . . . . . 3.303 1.939 5.667 1 1 186 1 . . . . . 2.46 1.704 4.216 1 1 187 1 . . . . . 2.797 1.819 4.775 1 1 188 1 . . . . . 2.42 1.688 4.152 1 1 189 1 . . . . . 3.506 1.969 6.043 1 1 190 1 . . . . . 2.983 1.871 5.095 1 1 191 1 . . . . . 2.854 1.836 4.872 1 1 192 1 . . . . . 2.685 1.784 4.586 1 1 193 1 . . . . . 2.956 1.864 5.048 1 1 194 1 . . . . . 3.677 1.987 6.367 1 1 195 1 . . . . . 3.253 1.93 5.576 1 1 196 1 . . . . . 3.066 1.891 5.241 1 1 197 1 . . . . . 3.249 1.929 5.569 1 1 198 1 . . . . . 3.066 1.891 5.241 1 1 199 1 . . . . . 2.545 1.735 4.355 1 1 200 1 . . . . . 3.623 1.982 6.264 1 1 201 1 . . . . . 3.736 1.991 6.481 1 1 202 1 . . . . . 3.663 1.986 6.34 1 1 203 1 . . . . . 3.153 1.911 5.395 1 1 204 1 . . . . . 3.314 1.941 5.687 1 1 205 1 . . . . . 3.567 1.977 6.157 1 1 206 1 . . . . . 2.831 1.829 4.833 1 1 207 1 . . . . . 3.664 1.986 6.342 1 1 208 1 . . . . . 2.716 1.794 4.638 1 1 209 1 . . . . . 3.422 1.958 5.886 1 1 210 1 . . . . . 3.178 1.916 5.44 1 1 211 1 . . . . . 3.669 1.986 6.352 1 1 212 1 . . . . . 3.821 1.996 6.646 1 1 213 1 . . . . . 3.949 2.0 6.898 1 1 214 1 . . . . . 2.82 1.826 4.814 1 1 215 1 . . . . . 3.495 1.968 6.022 1 1 216 1 . . . . . 3.73 1.991 6.469 1 1 217 1 . . . . . 2.835 1.83 4.84 1 1 218 1 . . . . . 2.614 1.76 4.468 1 1 219 1 . . . . . 3.855 1.997 6.713 1 1 220 1 . . . . . 3.555 1.975 6.135 1 1 221 1 . . . . . 3.713 1.99 6.436 1 1 222 1 . . . . . 3.693 1.988 6.398 1 1 223 1 . . . . . 3.239 1.927 5.551 1 1 224 1 . . . . . 3.164 1.913 5.415 1 1 225 1 . . . . . 2.963 1.866 5.06 1 1 226 1 . . . . . 3.394 1.954 5.834 1 1 227 1 . . . . . 3.281 1.936 5.626 1 1 228 1 . . . . . 3.542 1.974 6.11 1 1 229 1 . . . . . 3.462 1.964 5.96 1 1 230 1 . . . . . 2.979 1.87 5.088 1 1 231 1 . . . . . 2.988 1.872 5.104 1 1 232 1 . . . . . 3.85 1.997 6.703 1 1 233 1 . . . . . 3.871 1.998 6.744 1 1 234 1 . . . . . 3.719 1.99 6.448 1 1 235 1 . . . . . 3.541 1.974 6.108 1 1 236 1 . . . . . 2.877 1.842 4.912 1 1 237 1 . . . . . 2.873 1.841 4.905 1 1 238 1 . . . . . 2.912 1.852 4.972 1 1 239 1 . . . . . 3.295 1.938 5.652 1 1 240 1 . . . . . 3.787 1.994 6.58 1 1 241 1 . . . . . 3.468 1.965 5.971 1 1 242 1 . . . . . 2.514 1.724 4.304 1 1 243 1 . . . . . 2.37 1.668 4.072 1 1 244 1 . . . . . 2.63 1.765 4.495 1 1 245 1 . . . . . 2.43 1.692 4.168 1 1 246 1 . . . . . 3.568 1.976 6.16 1 1 247 1 . . . . . 3.412 1.956 5.868 1 1 248 1 . . . . . 3.462 1.964 5.96 1 1 249 1 . . . . . 3.87 1.998 6.742 1 1 250 1 . . . . . 3.427 1.959 5.895 1 1 251 1 . . . . . 3.781 1.994 6.568 1 1 252 1 . . . . . 2.348 1.659 4.037 1 1 253 1 . . . . . 3.639 1.984 6.294 1 1 254 1 . . . . . 2.583 1.749 4.417 1 1 255 1 . . . . . 2.863 1.838 4.888 1 1 256 1 . . . . . 2.931 1.857 5.005 1 1 257 1 . . . . . 2.928 1.857 4.999 1 1 258 1 . . . . . 3.673 1.987 6.359 1 1 259 1 . . . . . 3.837 1.997 6.677 1 1 260 1 . . . . . 3.417 1.957 5.877 1 1 261 1 . . . . . 3.702 1.989 6.415 1 1 262 1 . . . . . 3.654 1.985 6.323 1 1 263 1 . . . . . 2.696 1.787 4.605 1 1 264 1 . . . . . 3.299 1.939 5.659 1 1 265 1 . . . . . 3.775 1.994 6.556 1 1 266 1 . . . . . 3.181 1.916 5.446 1 1 267 1 . . . . . 3.31 1.94 5.68 1 1 268 1 . . . . . 3.717 1.99 6.444 1 1 269 1 . . . . . 3.806 1.995 6.617 1 1 270 1 . . . . . 2.501 1.719 4.283 1 1 271 1 . . . . . 2.362 1.664 4.06 1 1 272 1 . . . . . 2.423 1.689 4.157 1 1 273 1 . . . . . 2.74 1.802 4.678 1 1 274 1 . . . . . 2.582 1.748 4.416 1 1 275 1 . . . . . 3.249 1.929 5.569 1 1 276 1 . . . . . 3.8 1.995 6.605 1 1 277 1 . . . . . 3.462 1.964 5.96 1 1 278 1 . . . . . 2.216 1.602 3.83 1 1 279 1 . . . . . 2.125 1.561 3.689 1 1 280 1 . . . . . 2.507 1.721 4.293 1 1 281 1 . . . . . 2.6 1.755 4.445 1 1 282 1 . . . . . 2.074 1.536 3.612 1 1 283 1 . . . . . 2.992 1.873 5.111 1 1 284 1 . . . . . 3.008 1.877 5.139 1 1 285 1 . . . . . 3.551 1.975 6.127 1 1 286 1 . . . . . 3.749 1.992 6.506 1 1 287 1 . . . . . 3.022 1.881 5.163 1 1 288 1 . . . . . 2.873 1.841 4.905 1 1 289 1 . . . . . 2.566 1.743 4.389 1 1 290 1 . . . . . 2.854 1.836 4.872 1 1 291 1 . . . . . 1.992 1.496 3.488 1 1 292 1 . . . . . 2.783 1.815 4.751 1 1 293 1 . . . . . 3.359 1.949 5.769 1 1 294 1 . . . . . 3.562 1.976 6.148 1 1 295 1 . . . . . 1.976 1.488 3.464 1 1 296 1 . . . . . 3.679 1.987 6.371 1 1 297 1 . . . . . 2.983 1.871 5.095 1 1 298 1 . . . . . 2.51 1.723 4.297 1 1 299 1 . . . . . 2.309 1.642 3.976 1 1 300 1 . . . . . 2.822 1.826 4.818 1 1 301 1 . . . . . 3.457 1.963 5.951 1 1 302 1 . . . . . 2.572 1.745 4.399 1 1 303 1 . . . . . 3.274 1.935 5.613 1 1 304 1 . . . . . 3.303 1.939 5.667 1 1 305 1 . . . . . 3.442 1.961 5.923 1 1 306 1 . . . . . 3.633 1.983 6.283 1 1 307 1 . . . . . 2.359 1.663 4.055 1 1 308 1 . . . . . 3.0 1.875 5.125 1 1 309 1 . . . . . 3.385 1.953 5.817 1 1 310 1 . . . . . 3.249 1.929 5.569 1 1 311 1 . . . . . 2.185 1.588 3.782 1 1 312 1 . . . . . 3.147 1.909 5.385 1 1 313 1 . . . . . 2.669 1.778 4.56 1 1 314 1 . . . . . 3.367 1.95 5.784 1 1 315 1 . . . . . 3.651 1.985 6.317 1 1 316 1 . . . . . 2.998 1.875 5.121 1 1 317 1 . . . . . 2.763 1.809 4.717 1 1 318 1 . . . . . 2.451 1.7 4.202 1 1 319 1 . . . . . 3.716 1.99 6.442 1 1 320 1 . . . . . 3.533 1.973 6.093 1 1 321 1 . . . . . 3.417 1.957 5.877 1 1 322 1 . . . . . 3.288 1.937 5.639 1 1 323 1 . . . . . 2.717 1.794 4.64 1 1 324 1 . . . . . 3.734 1.991 6.477 1 1 325 1 . . . . . 2.579 1.748 4.41 1 1 326 1 . . . . . 2.312 1.644 3.98 1 1 327 1 . . . . . 2.63 1.765 4.495 1 1 328 1 . . . . . 2.789 1.817 4.761 1 1 329 1 . . . . . 2.567 1.743 4.391 1 1 330 1 . . . . . 3.747 1.992 6.502 1 1 331 1 . . . . . 2.539 1.733 4.345 1 1 332 1 . . . . . 2.097 1.547 3.647 1 1 333 1 . . . . . 2.703 1.79 4.616 1 1 334 1 . . . . . 2.826 1.828 4.824 1 1 335 1 . . . . . 1.866 1.431 3.301 1 1 336 1 . . . . . 2.753 1.805 4.701 1 1 337 1 . . . . . 2.218 1.603 3.833 1 1 338 1 . . . . . 2.954 1.863 5.045 1 1 339 1 . . . . . 2.218 1.603 3.833 1 1 340 1 . . . . . 3.075 1.893 5.257 1 1 341 1 . . . . . 3.036 1.884 5.188 1 1 342 1 . . . . . 2.373 1.669 4.077 1 1 343 1 . . . . . 2.263 1.623 3.903 1 1 344 1 . . . . . 2.438 1.695 4.181 1 1 345 1 . . . . . 2.389 1.676 4.102 1 1 346 1 . . . . . 3.842 1.997 6.687 1 1 347 1 . . . . . 2.303 1.64 3.966 1 1 348 1 . . . . . 2.37 1.668 4.072 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 SER C C 2.259 -2.587 -4.026 1.00 . A A . 1 SER C 1 1 1 2 1 1 1 SER CA C 1.306 -1.705 -4.821 1.00 . A A . 1 SER CA 1 1 1 3 1 1 1 SER CB C 0.432 -0.853 -3.921 1.00 . A A . 1 SER CB 1 1 1 4 1 1 1 SER H1 H 0.998 -3.085 -6.282 1.00 . A A . 1 SER H1 1 1 1 5 1 1 1 SER H2 H -0.270 -1.968 -6.056 1.00 . A A . 1 SER H2 1 1 1 6 1 1 1 SER H3 H -0.026 -3.237 -4.946 1.00 . A A . 1 SER H3 1 1 1 7 1 1 1 SER HA H 1.868 -1.074 -5.493 1.00 . A A . 1 SER HA 1 1 1 8 1 1 1 SER HB2 H 0.047 -1.450 -3.108 1.00 . A A . 1 SER HB2 1 1 1 9 1 1 1 SER HB3 H 1.001 -0.022 -3.531 1.00 . A A . 1 SER HB3 1 1 1 10 1 1 1 SER HG H -1.164 0.313 -4.181 1.00 . A A . 1 SER HG 1 1 1 11 1 1 1 SER N N 0.440 -2.558 -5.583 1.00 . A A . 1 SER N 1 1 1 12 1 1 1 SER O O 1.863 -3.689 -3.638 1.00 . A A . 1 SER O 1 1 1 13 1 1 1 SER OG O -0.656 -0.336 -4.685 1.00 . A A . 1 SER OG 1 1 1 14 1 1 2 PRO C C 4.058 -3.536 -1.795 1.00 . A A . 2 PRO C 1 1 1 15 1 1 2 PRO CA C 4.575 -2.893 -3.097 1.00 . A A . 2 PRO CA 1 1 1 16 1 1 2 PRO CB C 5.588 -1.799 -2.783 1.00 . A A . 2 PRO CB 1 1 1 17 1 1 2 PRO CD C 4.113 -0.929 -4.458 1.00 . A A . 2 PRO CD 1 1 1 18 1 1 2 PRO CG C 5.549 -0.930 -3.988 1.00 . A A . 2 PRO CG 1 1 1 19 1 1 2 PRO HA H 5.048 -3.646 -3.710 1.00 . A A . 2 PRO HA 1 1 1 20 1 1 2 PRO HB2 H 5.283 -1.270 -1.891 1.00 . A A . 2 PRO HB2 1 1 1 21 1 1 2 PRO HB3 H 6.566 -2.233 -2.639 1.00 . A A . 2 PRO HB3 1 1 1 22 1 1 2 PRO HD2 H 3.593 -0.054 -4.100 1.00 . A A . 2 PRO HD2 1 1 1 23 1 1 2 PRO HD3 H 4.071 -0.976 -5.537 1.00 . A A . 2 PRO HD3 1 1 1 24 1 1 2 PRO HG2 H 5.867 0.072 -3.737 1.00 . A A . 2 PRO HG2 1 1 1 25 1 1 2 PRO HG3 H 6.189 -1.342 -4.754 1.00 . A A . 2 PRO HG3 1 1 1 26 1 1 2 PRO N N 3.543 -2.159 -3.860 1.00 . A A . 2 PRO N 1 1 1 27 1 1 2 PRO O O 3.677 -2.833 -0.846 1.00 . A A . 2 PRO O 1 1 1 28 1 1 3 PRO C C 4.113 -5.298 0.805 1.00 . A A . 3 PRO C 1 1 1 29 1 1 3 PRO CA C 3.554 -5.677 -0.599 1.00 . A A . 3 PRO CA 1 1 1 30 1 1 3 PRO CB C 3.880 -7.123 -0.968 1.00 . A A . 3 PRO CB 1 1 1 31 1 1 3 PRO CD C 4.481 -5.782 -2.848 1.00 . A A . 3 PRO CD 1 1 1 32 1 1 3 PRO CG C 3.913 -7.117 -2.450 1.00 . A A . 3 PRO CG 1 1 1 33 1 1 3 PRO HA H 2.487 -5.569 -0.543 1.00 . A A . 3 PRO HA 1 1 1 34 1 1 3 PRO HB2 H 4.830 -7.408 -0.542 1.00 . A A . 3 PRO HB2 1 1 1 35 1 1 3 PRO HB3 H 3.105 -7.776 -0.597 1.00 . A A . 3 PRO HB3 1 1 1 36 1 1 3 PRO HD2 H 5.559 -5.829 -2.904 1.00 . A A . 3 PRO HD2 1 1 1 37 1 1 3 PRO HD3 H 4.066 -5.464 -3.792 1.00 . A A . 3 PRO HD3 1 1 1 38 1 1 3 PRO HG2 H 4.541 -7.918 -2.809 1.00 . A A . 3 PRO HG2 1 1 1 39 1 1 3 PRO HG3 H 2.910 -7.227 -2.833 1.00 . A A . 3 PRO HG3 1 1 1 40 1 1 3 PRO N N 4.044 -4.889 -1.751 1.00 . A A . 3 PRO N 1 1 1 41 1 1 3 PRO O O 3.339 -5.264 1.760 1.00 . A A . 3 PRO O 1 1 1 42 1 1 4 PRO C C 5.435 -3.278 2.784 1.00 . A A . 4 PRO C 1 1 1 43 1 1 4 PRO CA C 5.994 -4.616 2.280 1.00 . A A . 4 PRO CA 1 1 1 44 1 1 4 PRO CB C 7.500 -4.480 2.034 1.00 . A A . 4 PRO CB 1 1 1 45 1 1 4 PRO CD C 6.496 -5.118 -0.037 1.00 . A A . 4 PRO CD 1 1 1 46 1 1 4 PRO CG C 7.761 -5.187 0.757 1.00 . A A . 4 PRO CG 1 1 1 47 1 1 4 PRO HA H 5.815 -5.377 3.024 1.00 . A A . 4 PRO HA 1 1 1 48 1 1 4 PRO HB2 H 7.758 -3.433 1.965 1.00 . A A . 4 PRO HB2 1 1 1 49 1 1 4 PRO HB3 H 8.043 -4.929 2.852 1.00 . A A . 4 PRO HB3 1 1 1 50 1 1 4 PRO HD2 H 6.430 -4.261 -0.690 1.00 . A A . 4 PRO HD2 1 1 1 51 1 1 4 PRO HD3 H 6.351 -6.022 -0.608 1.00 . A A . 4 PRO HD3 1 1 1 52 1 1 4 PRO HG2 H 8.561 -4.694 0.226 1.00 . A A . 4 PRO HG2 1 1 1 53 1 1 4 PRO HG3 H 8.022 -6.215 0.957 1.00 . A A . 4 PRO HG3 1 1 1 54 1 1 4 PRO N N 5.443 -5.015 0.975 1.00 . A A . 4 PRO N 1 1 1 55 1 1 4 PRO O O 5.606 -2.936 3.957 1.00 . A A . 4 PRO O 1 1 1 56 1 1 5 ARG C C 5.211 -0.161 2.476 1.00 . A A . 5 ARG C 1 1 1 57 1 1 5 ARG CA C 4.173 -1.225 2.164 1.00 . A A . 5 ARG CA 1 1 1 58 1 1 5 ARG CB C 3.111 -1.288 3.263 1.00 . A A . 5 ARG CB 1 1 1 59 1 1 5 ARG CD C 0.843 -2.014 4.003 1.00 . A A . 5 ARG CD 1 1 1 60 1 1 5 ARG CG C 1.851 -2.026 2.874 1.00 . A A . 5 ARG CG 1 1 1 61 1 1 5 ARG CZ C -0.261 -0.315 5.430 1.00 . A A . 5 ARG CZ 1 1 1 62 1 1 5 ARG H H 4.660 -2.902 0.980 1.00 . A A . 5 ARG H 1 1 1 63 1 1 5 ARG HA H 3.688 -0.925 1.245 1.00 . A A . 5 ARG HA 1 1 1 64 1 1 5 ARG HB2 H 3.538 -1.784 4.122 1.00 . A A . 5 ARG HB2 1 1 1 65 1 1 5 ARG HB3 H 2.846 -0.278 3.540 1.00 . A A . 5 ARG HB3 1 1 1 66 1 1 5 ARG HD2 H -0.085 -2.438 3.649 1.00 . A A . 5 ARG HD2 1 1 1 67 1 1 5 ARG HD3 H 1.219 -2.601 4.827 1.00 . A A . 5 ARG HD3 1 1 1 68 1 1 5 ARG HE H 1.129 0.070 4.066 1.00 . A A . 5 ARG HE 1 1 1 69 1 1 5 ARG HG2 H 1.415 -1.544 2.011 1.00 . A A . 5 ARG HG2 1 1 1 70 1 1 5 ARG HG3 H 2.100 -3.049 2.630 1.00 . A A . 5 ARG HG3 1 1 1 71 1 1 5 ARG HH11 H -1.077 -2.180 5.676 1.00 . A A . 5 ARG HH11 1 1 1 72 1 1 5 ARG HH12 H -1.735 -0.984 6.689 1.00 . A A . 5 ARG HH12 1 1 1 73 1 1 5 ARG HH21 H 0.312 1.617 5.393 1.00 . A A . 5 ARG HH21 1 1 1 74 1 1 5 ARG HH22 H -0.920 1.275 6.548 1.00 . A A . 5 ARG HH22 1 1 1 75 1 1 5 ARG N N 4.771 -2.535 1.884 1.00 . A A . 5 ARG N 1 1 1 76 1 1 5 ARG NE N 0.587 -0.654 4.476 1.00 . A A . 5 ARG NE 1 1 1 77 1 1 5 ARG NH1 N -1.077 -1.220 5.970 1.00 . A A . 5 ARG NH1 1 1 1 78 1 1 5 ARG NH2 N -0.303 0.949 5.829 1.00 . A A . 5 ARG NH2 1 1 1 79 1 1 5 ARG O O 5.596 0.617 1.589 1.00 . A A . 5 ARG O 1 1 1 80 1 1 6 GLY C C 8.062 0.572 3.639 1.00 . A A . 6 GLY C 1 1 1 81 1 1 6 GLY CA C 6.674 0.808 4.174 1.00 . A A . 6 GLY CA 1 1 1 82 1 1 6 GLY H H 5.443 -0.901 4.307 1.00 . A A . 6 GLY H 1 1 1 83 1 1 6 GLY HA2 H 6.345 1.785 3.854 1.00 . A A . 6 GLY HA2 1 1 1 84 1 1 6 GLY HA3 H 6.703 0.782 5.253 1.00 . A A . 6 GLY HA3 1 1 1 85 1 1 6 GLY N N 5.720 -0.178 3.703 1.00 . A A . 6 GLY N 1 1 1 86 1 1 6 GLY O O 9.011 0.403 4.389 1.00 . A A . 6 GLY O 1 1 1 87 1 1 7 SER C C 9.338 1.253 0.414 1.00 . A A . 7 SER C 1 1 1 88 1 1 7 SER CA C 9.377 0.350 1.638 1.00 . A A . 7 SER CA 1 1 1 89 1 1 7 SER CB C 9.548 -1.108 1.218 1.00 . A A . 7 SER CB 1 1 1 90 1 1 7 SER H H 7.297 0.522 1.863 1.00 . A A . 7 SER H 1 1 1 91 1 1 7 SER HA H 10.192 0.634 2.285 1.00 . A A . 7 SER HA 1 1 1 92 1 1 7 SER HB2 H 8.752 -1.380 0.541 1.00 . A A . 7 SER HB2 1 1 1 93 1 1 7 SER HB3 H 10.501 -1.236 0.727 1.00 . A A . 7 SER HB3 1 1 1 94 1 1 7 SER HG H 9.598 -1.404 3.139 1.00 . A A . 7 SER HG 1 1 1 95 1 1 7 SER N N 8.149 0.497 2.352 1.00 . A A . 7 SER N 1 1 1 96 1 1 7 SER O O 10.316 1.383 -0.311 1.00 . A A . 7 SER O 1 1 1 97 1 1 7 SER OG O 9.493 -1.963 2.356 1.00 . A A . 7 SER OG 1 1 1 98 1 1 8 SER C C 6.790 3.689 -0.579 1.00 . A A . 8 SER C 1 1 1 99 1 1 8 SER CA C 7.954 2.746 -0.938 1.00 . A A . 8 SER CA 1 1 1 100 1 1 8 SER CB C 7.617 1.917 -2.195 1.00 . A A . 8 SER CB 1 1 1 101 1 1 8 SER H H 7.414 1.754 0.783 1.00 . A A . 8 SER H 1 1 1 102 1 1 8 SER HA H 8.854 3.318 -1.109 1.00 . A A . 8 SER HA 1 1 1 103 1 1 8 SER HB2 H 6.706 1.364 -2.019 1.00 . A A . 8 SER HB2 1 1 1 104 1 1 8 SER HB3 H 7.481 2.573 -3.042 1.00 . A A . 8 SER HB3 1 1 1 105 1 1 8 SER HG H 9.428 1.252 -1.958 1.00 . A A . 8 SER HG 1 1 1 106 1 1 8 SER N N 8.179 1.864 0.180 1.00 . A A . 8 SER N 1 1 1 107 1 1 8 SER O O 5.670 3.220 -0.356 1.00 . A A . 8 SER O 1 1 1 108 1 1 8 SER OG O 8.664 0.990 -2.494 1.00 . A A . 8 SER OG 1 1 1 109 1 1 9 PRO C C 4.758 5.961 -0.919 1.00 . A A . 9 PRO C 1 1 1 110 1 1 9 PRO CA C 6.042 6.030 -0.088 1.00 . A A . 9 PRO CA 1 1 1 111 1 1 9 PRO CB C 6.753 7.361 -0.351 1.00 . A A . 9 PRO CB 1 1 1 112 1 1 9 PRO CD C 8.373 5.637 -0.729 1.00 . A A . 9 PRO CD 1 1 1 113 1 1 9 PRO CG C 8.203 7.050 -0.243 1.00 . A A . 9 PRO CG 1 1 1 114 1 1 9 PRO HA H 5.791 5.955 0.959 1.00 . A A . 9 PRO HA 1 1 1 115 1 1 9 PRO HB2 H 6.495 7.717 -1.338 1.00 . A A . 9 PRO HB2 1 1 1 116 1 1 9 PRO HB3 H 6.449 8.090 0.385 1.00 . A A . 9 PRO HB3 1 1 1 117 1 1 9 PRO HD2 H 8.617 5.624 -1.781 1.00 . A A . 9 PRO HD2 1 1 1 118 1 1 9 PRO HD3 H 9.144 5.144 -0.155 1.00 . A A . 9 PRO HD3 1 1 1 119 1 1 9 PRO HG2 H 8.771 7.730 -0.861 1.00 . A A . 9 PRO HG2 1 1 1 120 1 1 9 PRO HG3 H 8.518 7.132 0.786 1.00 . A A . 9 PRO HG3 1 1 1 121 1 1 9 PRO N N 7.054 5.016 -0.480 1.00 . A A . 9 PRO N 1 1 1 122 1 1 9 PRO O O 3.652 5.862 -0.375 1.00 . A A . 9 PRO O 1 1 1 123 1 1 10 GLY C C 3.137 4.582 -3.119 1.00 . A A . 10 GLY C 1 1 1 124 1 1 10 GLY CA C 3.777 5.943 -3.125 1.00 . A A . 10 GLY CA 1 1 1 125 1 1 10 GLY H H 5.825 6.008 -2.602 1.00 . A A . 10 GLY H 1 1 1 126 1 1 10 GLY HA2 H 3.054 6.682 -2.813 1.00 . A A . 10 GLY HA2 1 1 1 127 1 1 10 GLY HA3 H 4.106 6.171 -4.128 1.00 . A A . 10 GLY HA3 1 1 1 128 1 1 10 GLY N N 4.915 5.985 -2.232 1.00 . A A . 10 GLY N 1 1 1 129 1 1 10 GLY O O 1.928 4.447 -3.314 1.00 . A A . 10 GLY O 1 1 1 130 1 1 11 GLY C C 2.527 2.001 -1.669 1.00 . A A . 11 GLY C 1 1 1 131 1 1 11 GLY CA C 3.496 2.223 -2.802 1.00 . A A . 11 GLY CA 1 1 1 132 1 1 11 GLY H H 4.895 3.797 -2.697 1.00 . A A . 11 GLY H 1 1 1 133 1 1 11 GLY HA2 H 3.004 1.985 -3.733 1.00 . A A . 11 GLY HA2 1 1 1 134 1 1 11 GLY HA3 H 4.345 1.571 -2.670 1.00 . A A . 11 GLY HA3 1 1 1 135 1 1 11 GLY N N 3.954 3.582 -2.859 1.00 . A A . 11 GLY N 1 1 1 136 1 1 11 GLY O O 1.456 1.462 -1.880 1.00 . A A . 11 GLY O 1 1 1 137 1 1 12 ASP C C 0.827 3.207 0.616 1.00 . A A . 12 ASP C 1 1 1 138 1 1 12 ASP CA C 2.044 2.306 0.710 1.00 . A A . 12 ASP CA 1 1 1 139 1 1 12 ASP CB C 2.836 2.590 1.987 1.00 . A A . 12 ASP CB 1 1 1 140 1 1 12 ASP CG C 1.976 2.674 3.248 1.00 . A A . 12 ASP CG 1 1 1 141 1 1 12 ASP H H 3.790 2.847 -0.382 1.00 . A A . 12 ASP H 1 1 1 142 1 1 12 ASP HA H 1.698 1.283 0.739 1.00 . A A . 12 ASP HA 1 1 1 143 1 1 12 ASP HB2 H 3.507 1.752 2.105 1.00 . A A . 12 ASP HB2 1 1 1 144 1 1 12 ASP HB3 H 3.402 3.503 1.872 1.00 . A A . 12 ASP HB3 1 1 1 145 1 1 12 ASP N N 2.901 2.436 -0.476 1.00 . A A . 12 ASP N 1 1 1 146 1 1 12 ASP O O -0.283 2.810 0.997 1.00 . A A . 12 ASP O 1 1 1 147 1 1 12 ASP OD1 O 1.503 3.783 3.595 1.00 . A A . 12 ASP OD1 1 1 1 148 1 1 12 ASP OD2 O 1.806 1.655 3.943 1.00 . A A . 12 ASP OD2 1 1 1 149 1 1 13 LYS C C -1.163 4.732 -0.993 1.00 . A A . 13 LYS C 1 1 1 150 1 1 13 LYS CA C -0.083 5.332 -0.098 1.00 . A A . 13 LYS CA 1 1 1 151 1 1 13 LYS CB C 0.391 6.661 -0.683 1.00 . A A . 13 LYS CB 1 1 1 152 1 1 13 LYS CD C -1.336 8.083 0.455 1.00 . A A . 13 LYS CD 1 1 1 153 1 1 13 LYS CE C -2.507 9.004 0.249 1.00 . A A . 13 LYS CE 1 1 1 154 1 1 13 LYS CG C -0.738 7.660 -0.876 1.00 . A A . 13 LYS CG 1 1 1 155 1 1 13 LYS H H 1.923 4.648 -0.221 1.00 . A A . 13 LYS H 1 1 1 156 1 1 13 LYS HA H -0.508 5.506 0.879 1.00 . A A . 13 LYS HA 1 1 1 157 1 1 13 LYS HB2 H 1.122 7.092 -0.015 1.00 . A A . 13 LYS HB2 1 1 1 158 1 1 13 LYS HB3 H 0.851 6.478 -1.643 1.00 . A A . 13 LYS HB3 1 1 1 159 1 1 13 LYS HD2 H -1.677 7.208 0.986 1.00 . A A . 13 LYS HD2 1 1 1 160 1 1 13 LYS HD3 H -0.583 8.593 1.038 1.00 . A A . 13 LYS HD3 1 1 1 161 1 1 13 LYS HE2 H -2.175 9.855 -0.323 1.00 . A A . 13 LYS HE2 1 1 1 162 1 1 13 LYS HE3 H -3.262 8.476 -0.314 1.00 . A A . 13 LYS HE3 1 1 1 163 1 1 13 LYS HG2 H -0.400 8.521 -1.429 1.00 . A A . 13 LYS HG2 1 1 1 164 1 1 13 LYS HG3 H -1.510 7.170 -1.452 1.00 . A A . 13 LYS HG3 1 1 1 165 1 1 13 LYS HZ1 H -3.420 8.661 2.085 1.00 . A A . 13 LYS HZ1 1 1 1 166 1 1 13 LYS HZ2 H -3.885 10.100 1.329 1.00 . A A . 13 LYS HZ2 1 1 1 167 1 1 13 LYS HZ3 H -2.385 9.997 2.077 1.00 . A A . 13 LYS HZ3 1 1 1 168 1 1 13 LYS N N 1.017 4.397 0.065 1.00 . A A . 13 LYS N 1 1 1 169 1 1 13 LYS NZ N -3.084 9.466 1.520 1.00 . A A . 13 LYS NZ 1 1 1 170 1 1 13 LYS O O -2.340 4.685 -0.631 1.00 . A A . 13 LYS O 1 1 1 171 1 1 14 LEU C C -1.936 2.174 -2.702 1.00 . A A . 14 LEU C 1 1 1 172 1 1 14 LEU CA C -1.680 3.624 -3.061 1.00 . A A . 14 LEU CA 1 1 1 173 1 1 14 LEU CB C -1.230 3.758 -4.531 1.00 . A A . 14 LEU CB 1 1 1 174 1 1 14 LEU CD1 C -2.818 5.639 -5.146 1.00 . A A . 14 LEU CD1 1 1 1 175 1 1 14 LEU CD2 C -0.427 6.185 -4.637 1.00 . A A . 14 LEU CD2 1 1 1 176 1 1 14 LEU CG C -1.381 5.145 -5.210 1.00 . A A . 14 LEU CG 1 1 1 177 1 1 14 LEU H H 0.201 4.272 -2.372 1.00 . A A . 14 LEU H 1 1 1 178 1 1 14 LEU HA H -2.616 4.148 -2.940 1.00 . A A . 14 LEU HA 1 1 1 179 1 1 14 LEU HB2 H -0.190 3.474 -4.585 1.00 . A A . 14 LEU HB2 1 1 1 180 1 1 14 LEU HB3 H -1.800 3.043 -5.106 1.00 . A A . 14 LEU HB3 1 1 1 181 1 1 14 LEU HD11 H -3.115 5.775 -4.117 1.00 . A A . 14 LEU HD11 1 1 1 182 1 1 14 LEU HD12 H -3.469 4.917 -5.617 1.00 . A A . 14 LEU HD12 1 1 1 183 1 1 14 LEU HD13 H -2.891 6.581 -5.667 1.00 . A A . 14 LEU HD13 1 1 1 184 1 1 14 LEU HD21 H -0.569 7.127 -5.145 1.00 . A A . 14 LEU HD21 1 1 1 185 1 1 14 LEU HD22 H 0.592 5.852 -4.771 1.00 . A A . 14 LEU HD22 1 1 1 186 1 1 14 LEU HD23 H -0.627 6.310 -3.582 1.00 . A A . 14 LEU HD23 1 1 1 187 1 1 14 LEU HG H -1.150 5.011 -6.257 1.00 . A A . 14 LEU HG 1 1 1 188 1 1 14 LEU N N -0.754 4.233 -2.136 1.00 . A A . 14 LEU N 1 1 1 189 1 1 14 LEU O O -2.534 1.439 -3.460 1.00 . A A . 14 LEU O 1 1 1 190 1 1 15 TRP C C -3.018 0.591 -0.241 1.00 . A A . 15 TRP C 1 1 1 191 1 1 15 TRP CA C -1.763 0.446 -1.059 1.00 . A A . 15 TRP CA 1 1 1 192 1 1 15 TRP CB C -0.622 -0.060 -0.152 1.00 . A A . 15 TRP CB 1 1 1 193 1 1 15 TRP CD1 C 0.306 -2.422 -0.178 1.00 . A A . 15 TRP CD1 1 1 1 194 1 1 15 TRP CD2 C -1.571 -2.229 1.000 1.00 . A A . 15 TRP CD2 1 1 1 195 1 1 15 TRP CE2 C -1.159 -3.562 1.057 1.00 . A A . 15 TRP CE2 1 1 1 196 1 1 15 TRP CE3 C -2.722 -1.864 1.665 1.00 . A A . 15 TRP CE3 1 1 1 197 1 1 15 TRP CG C -0.625 -1.517 0.200 1.00 . A A . 15 TRP CG 1 1 1 198 1 1 15 TRP CH2 C -3.010 -4.110 2.401 1.00 . A A . 15 TRP CH2 1 1 1 199 1 1 15 TRP CZ2 C -1.875 -4.525 1.766 1.00 . A A . 15 TRP CZ2 1 1 1 200 1 1 15 TRP CZ3 C -3.421 -2.796 2.346 1.00 . A A . 15 TRP CZ3 1 1 1 201 1 1 15 TRP H H -0.915 2.367 -1.019 1.00 . A A . 15 TRP H 1 1 1 202 1 1 15 TRP HA H -1.894 -0.192 -1.922 1.00 . A A . 15 TRP HA 1 1 1 203 1 1 15 TRP HB2 H 0.316 0.113 -0.645 1.00 . A A . 15 TRP HB2 1 1 1 204 1 1 15 TRP HB3 H -0.641 0.504 0.768 1.00 . A A . 15 TRP HB3 1 1 1 205 1 1 15 TRP HD1 H 1.156 -2.149 -0.784 1.00 . A A . 15 TRP HD1 1 1 1 206 1 1 15 TRP HE1 H 0.508 -4.487 0.189 1.00 . A A . 15 TRP HE1 1 1 1 207 1 1 15 TRP HE3 H -3.071 -0.843 1.637 1.00 . A A . 15 TRP HE3 1 1 1 208 1 1 15 TRP HH2 H -3.637 -4.782 2.965 1.00 . A A . 15 TRP HH2 1 1 1 209 1 1 15 TRP HZ2 H -1.567 -5.558 1.821 1.00 . A A . 15 TRP HZ2 1 1 1 210 1 1 15 TRP HZ3 H -4.327 -2.498 2.842 1.00 . A A . 15 TRP HZ3 1 1 1 211 1 1 15 TRP N N -1.476 1.764 -1.553 1.00 . A A . 15 TRP N 1 1 1 212 1 1 15 TRP NE1 N -0.005 -3.662 0.328 1.00 . A A . 15 TRP NE1 1 1 1 213 1 1 15 TRP O O -4.023 -0.098 -0.457 1.00 . A A . 15 TRP O 1 1 1 214 1 1 16 GLN C C -5.298 2.360 0.876 1.00 . A A . 16 GLN C 1 1 1 215 1 1 16 GLN CA C -4.054 1.858 1.590 1.00 . A A . 16 GLN CA 1 1 1 216 1 1 16 GLN CB C -3.566 2.863 2.616 1.00 . A A . 16 GLN CB 1 1 1 217 1 1 16 GLN CD C -3.314 1.301 4.553 1.00 . A A . 16 GLN CD 1 1 1 218 1 1 16 GLN CG C -2.604 2.250 3.608 1.00 . A A . 16 GLN CG 1 1 1 219 1 1 16 GLN H H -2.142 2.080 0.739 1.00 . A A . 16 GLN H 1 1 1 220 1 1 16 GLN HA H -4.290 0.941 2.107 1.00 . A A . 16 GLN HA 1 1 1 221 1 1 16 GLN HB2 H -3.065 3.669 2.102 1.00 . A A . 16 GLN HB2 1 1 1 222 1 1 16 GLN HB3 H -4.412 3.256 3.160 1.00 . A A . 16 GLN HB3 1 1 1 223 1 1 16 GLN HE21 H -3.597 2.771 5.831 1.00 . A A . 16 GLN HE21 1 1 1 224 1 1 16 GLN HE22 H -4.227 1.254 6.310 1.00 . A A . 16 GLN HE22 1 1 1 225 1 1 16 GLN HG2 H -1.858 1.690 3.057 1.00 . A A . 16 GLN HG2 1 1 1 226 1 1 16 GLN HG3 H -2.130 3.031 4.184 1.00 . A A . 16 GLN HG3 1 1 1 227 1 1 16 GLN N N -2.968 1.549 0.666 1.00 . A A . 16 GLN N 1 1 1 228 1 1 16 GLN NE2 N -3.749 1.817 5.661 1.00 . A A . 16 GLN NE2 1 1 1 229 1 1 16 GLN O O -6.378 2.442 1.456 1.00 . A A . 16 GLN O 1 1 1 230 1 1 16 GLN OE1 O -3.457 0.108 4.286 1.00 . A A . 16 GLN OE1 1 1 1 231 1 1 17 ILE C C -6.667 1.970 -2.140 1.00 . A A . 17 ILE C 1 1 1 232 1 1 17 ILE CA C -6.214 3.126 -1.194 1.00 . A A . 17 ILE CA 1 1 1 233 1 1 17 ILE CB C -5.793 4.427 -1.970 1.00 . A A . 17 ILE CB 1 1 1 234 1 1 17 ILE CD1 C -5.142 6.861 -1.537 1.00 . A A . 17 ILE CD1 1 1 1 235 1 1 17 ILE CG1 C -5.580 5.553 -0.943 1.00 . A A . 17 ILE CG1 1 1 1 236 1 1 17 ILE CG2 C -6.830 4.851 -3.016 1.00 . A A . 17 ILE CG2 1 1 1 237 1 1 17 ILE H H -4.223 2.677 -0.725 1.00 . A A . 17 ILE H 1 1 1 238 1 1 17 ILE HA H -7.030 3.379 -0.533 1.00 . A A . 17 ILE HA 1 1 1 239 1 1 17 ILE HB H -4.847 4.260 -2.469 1.00 . A A . 17 ILE HB 1 1 1 240 1 1 17 ILE HD11 H -5.083 7.599 -0.751 1.00 . A A . 17 ILE HD11 1 1 1 241 1 1 17 ILE HD12 H -5.872 7.159 -2.274 1.00 . A A . 17 ILE HD12 1 1 1 242 1 1 17 ILE HD13 H -4.176 6.738 -2.002 1.00 . A A . 17 ILE HD13 1 1 1 243 1 1 17 ILE HG12 H -6.506 5.730 -0.417 1.00 . A A . 17 ILE HG12 1 1 1 244 1 1 17 ILE HG13 H -4.829 5.238 -0.234 1.00 . A A . 17 ILE HG13 1 1 1 245 1 1 17 ILE HG21 H -6.487 5.738 -3.529 1.00 . A A . 17 ILE HG21 1 1 1 246 1 1 17 ILE HG22 H -7.771 5.061 -2.530 1.00 . A A . 17 ILE HG22 1 1 1 247 1 1 17 ILE HG23 H -6.966 4.052 -3.729 1.00 . A A . 17 ILE HG23 1 1 1 248 1 1 17 ILE N N -5.134 2.697 -0.365 1.00 . A A . 17 ILE N 1 1 1 249 1 1 17 ILE O O -7.754 2.007 -2.718 1.00 . A A . 17 ILE O 1 1 1 250 1 1 18 TYR C C -6.592 -1.499 -2.508 1.00 . A A . 18 TYR C 1 1 1 251 1 1 18 TYR CA C -6.162 -0.181 -3.169 1.00 . A A . 18 TYR CA 1 1 1 252 1 1 18 TYR CB C -4.979 -0.337 -4.172 1.00 . A A . 18 TYR CB 1 1 1 253 1 1 18 TYR CD1 C -3.276 -1.805 -3.000 1.00 . A A . 18 TYR CD1 1 1 1 254 1 1 18 TYR CD2 C -3.888 -2.366 -5.213 1.00 . A A . 18 TYR CD2 1 1 1 255 1 1 18 TYR CE1 C -2.358 -2.825 -2.988 1.00 . A A . 18 TYR CE1 1 1 1 256 1 1 18 TYR CE2 C -2.989 -3.410 -5.205 1.00 . A A . 18 TYR CE2 1 1 1 257 1 1 18 TYR CG C -4.053 -1.550 -4.100 1.00 . A A . 18 TYR CG 1 1 1 258 1 1 18 TYR CZ C -2.221 -3.630 -4.088 1.00 . A A . 18 TYR CZ 1 1 1 259 1 1 18 TYR H H -5.117 0.808 -1.597 1.00 . A A . 18 TYR H 1 1 1 260 1 1 18 TYR HA H -7.022 0.160 -3.727 1.00 . A A . 18 TYR HA 1 1 1 261 1 1 18 TYR HB2 H -5.325 -0.327 -5.185 1.00 . A A . 18 TYR HB2 1 1 1 262 1 1 18 TYR HB3 H -4.351 0.533 -4.047 1.00 . A A . 18 TYR HB3 1 1 1 263 1 1 18 TYR HD1 H -3.421 -1.184 -2.130 1.00 . A A . 18 TYR HD1 1 1 1 264 1 1 18 TYR HD2 H -4.494 -2.188 -6.088 1.00 . A A . 18 TYR HD2 1 1 1 265 1 1 18 TYR HE1 H -1.763 -2.997 -2.106 1.00 . A A . 18 TYR HE1 1 1 1 266 1 1 18 TYR HE2 H -2.887 -4.040 -6.075 1.00 . A A . 18 TYR HE2 1 1 1 267 1 1 18 TYR HH H -1.249 -5.071 -3.227 1.00 . A A . 18 TYR HH 1 1 1 268 1 1 18 TYR N N -5.879 0.895 -2.210 1.00 . A A . 18 TYR N 1 1 1 269 1 1 18 TYR O O -7.498 -2.150 -2.978 1.00 . A A . 18 TYR O 1 1 1 270 1 1 18 TYR OH O -1.269 -4.631 -4.090 1.00 . A A . 18 TYR OH 1 1 1 271 1 1 19 LEU C C -7.031 -2.849 0.538 1.00 . A A . 19 LEU C 1 1 1 272 1 1 19 LEU CA C -6.301 -3.120 -0.738 1.00 . A A . 19 LEU CA 1 1 1 273 1 1 19 LEU CB C -5.069 -3.969 -0.457 1.00 . A A . 19 LEU CB 1 1 1 274 1 1 19 LEU CD1 C -3.349 -5.616 -1.153 1.00 . A A . 19 LEU CD1 1 1 1 275 1 1 19 LEU CD2 C -5.723 -6.023 -1.643 1.00 . A A . 19 LEU CD2 1 1 1 276 1 1 19 LEU CG C -4.663 -4.966 -1.527 1.00 . A A . 19 LEU CG 1 1 1 277 1 1 19 LEU H H -5.215 -1.323 -1.080 1.00 . A A . 19 LEU H 1 1 1 278 1 1 19 LEU HA H -6.956 -3.673 -1.393 1.00 . A A . 19 LEU HA 1 1 1 279 1 1 19 LEU HB2 H -4.241 -3.290 -0.316 1.00 . A A . 19 LEU HB2 1 1 1 280 1 1 19 LEU HB3 H -5.228 -4.505 0.466 1.00 . A A . 19 LEU HB3 1 1 1 281 1 1 19 LEU HD11 H -3.049 -6.306 -1.926 1.00 . A A . 19 LEU HD11 1 1 1 282 1 1 19 LEU HD12 H -3.458 -6.142 -0.216 1.00 . A A . 19 LEU HD12 1 1 1 283 1 1 19 LEU HD13 H -2.596 -4.848 -1.044 1.00 . A A . 19 LEU HD13 1 1 1 284 1 1 19 LEU HD21 H -6.653 -5.576 -1.958 1.00 . A A . 19 LEU HD21 1 1 1 285 1 1 19 LEU HD22 H -5.853 -6.457 -0.661 1.00 . A A . 19 LEU HD22 1 1 1 286 1 1 19 LEU HD23 H -5.412 -6.783 -2.343 1.00 . A A . 19 LEU HD23 1 1 1 287 1 1 19 LEU HG H -4.560 -4.476 -2.483 1.00 . A A . 19 LEU HG 1 1 1 288 1 1 19 LEU N N -5.949 -1.878 -1.427 1.00 . A A . 19 LEU N 1 1 1 289 1 1 19 LEU O O -7.669 -3.733 1.113 1.00 . A A . 19 LEU O 1 1 1 290 1 1 20 ASN C C -8.828 -0.527 1.873 1.00 . A A . 20 ASN C 1 1 1 291 1 1 20 ASN CA C -7.555 -1.257 2.194 1.00 . A A . 20 ASN CA 1 1 1 292 1 1 20 ASN CB C -6.592 -0.429 3.040 1.00 . A A . 20 ASN CB 1 1 1 293 1 1 20 ASN CG C -7.231 0.225 4.251 1.00 . A A . 20 ASN CG 1 1 1 294 1 1 20 ASN H H -6.445 -0.984 0.469 1.00 . A A . 20 ASN H 1 1 1 295 1 1 20 ASN HA H -7.807 -2.158 2.733 1.00 . A A . 20 ASN HA 1 1 1 296 1 1 20 ASN HB2 H -5.817 -1.092 3.395 1.00 . A A . 20 ASN HB2 1 1 1 297 1 1 20 ASN HB3 H -6.131 0.321 2.420 1.00 . A A . 20 ASN HB3 1 1 1 298 1 1 20 ASN HD21 H -7.490 1.877 3.230 1.00 . A A . 20 ASN HD21 1 1 1 299 1 1 20 ASN HD22 H -8.040 1.920 4.866 1.00 . A A . 20 ASN HD22 1 1 1 300 1 1 20 ASN N N -6.931 -1.657 0.985 1.00 . A A . 20 ASN N 1 1 1 301 1 1 20 ASN ND2 N -7.627 1.455 4.108 1.00 . A A . 20 ASN ND2 1 1 1 302 1 1 20 ASN O O -8.770 0.603 1.380 1.00 . A A . 20 ASN O 1 1 1 303 1 1 20 ASN OXT O -9.916 -1.099 2.093 1.00 . A A . 20 ASN OXT 1 1 1 304 1 1 20 ASN OD1 O -7.321 -0.373 5.322 1.00 . A A . 20 ASN OD1 1 1 2 305 1 1 1 SER C C 2.268 -3.438 -4.507 1.00 . A A . 1 SER C 1 1 2 306 1 1 1 SER CA C 1.791 -2.211 -5.267 1.00 . A A . 1 SER CA 1 1 2 307 1 1 1 SER CB C 0.819 -1.381 -4.429 1.00 . A A . 1 SER CB 1 1 2 308 1 1 1 SER H1 H 1.742 -3.227 -7.017 1.00 . A A . 1 SER H1 1 1 2 309 1 1 1 SER H2 H 0.670 -1.896 -6.941 1.00 . A A . 1 SER H2 1 1 2 310 1 1 1 SER H3 H 0.338 -3.335 -6.095 1.00 . A A . 1 SER H3 1 1 2 311 1 1 1 SER HA H 2.632 -1.608 -5.580 1.00 . A A . 1 SER HA 1 1 2 312 1 1 1 SER HB2 H 0.113 -2.024 -3.928 1.00 . A A . 1 SER HB2 1 1 2 313 1 1 1 SER HB3 H 1.358 -0.795 -3.700 1.00 . A A . 1 SER HB3 1 1 2 314 1 1 1 SER HG H -0.533 -0.014 -4.685 1.00 . A A . 1 SER HG 1 1 2 315 1 1 1 SER N N 1.085 -2.691 -6.418 1.00 . A A . 1 SER N 1 1 2 316 1 1 1 SER O O 1.601 -4.473 -4.572 1.00 . A A . 1 SER O 1 1 2 317 1 1 1 SER OG O 0.101 -0.468 -5.260 1.00 . A A . 1 SER OG 1 1 2 318 1 1 2 PRO C C 3.031 -4.890 -1.930 1.00 . A A . 2 PRO C 1 1 2 319 1 1 2 PRO CA C 3.955 -4.520 -3.090 1.00 . A A . 2 PRO CA 1 1 2 320 1 1 2 PRO CB C 5.306 -4.011 -2.551 1.00 . A A . 2 PRO CB 1 1 2 321 1 1 2 PRO CD C 4.334 -2.215 -3.775 1.00 . A A . 2 PRO CD 1 1 2 322 1 1 2 PRO CG C 5.212 -2.525 -2.604 1.00 . A A . 2 PRO CG 1 1 2 323 1 1 2 PRO HA H 4.110 -5.380 -3.723 1.00 . A A . 2 PRO HA 1 1 2 324 1 1 2 PRO HB2 H 5.443 -4.360 -1.538 1.00 . A A . 2 PRO HB2 1 1 2 325 1 1 2 PRO HB3 H 6.111 -4.376 -3.171 1.00 . A A . 2 PRO HB3 1 1 2 326 1 1 2 PRO HD2 H 3.777 -1.307 -3.598 1.00 . A A . 2 PRO HD2 1 1 2 327 1 1 2 PRO HD3 H 4.919 -2.132 -4.679 1.00 . A A . 2 PRO HD3 1 1 2 328 1 1 2 PRO HG2 H 4.768 -2.154 -1.693 1.00 . A A . 2 PRO HG2 1 1 2 329 1 1 2 PRO HG3 H 6.194 -2.098 -2.744 1.00 . A A . 2 PRO HG3 1 1 2 330 1 1 2 PRO N N 3.433 -3.380 -3.843 1.00 . A A . 2 PRO N 1 1 2 331 1 1 2 PRO O O 2.627 -4.011 -1.166 1.00 . A A . 2 PRO O 1 1 2 332 1 1 3 PRO C C 2.409 -6.280 0.703 1.00 . A A . 3 PRO C 1 1 2 333 1 1 3 PRO CA C 1.829 -6.665 -0.690 1.00 . A A . 3 PRO CA 1 1 2 334 1 1 3 PRO CB C 1.709 -8.170 -0.915 1.00 . A A . 3 PRO CB 1 1 2 335 1 1 3 PRO CD C 2.849 -7.255 -2.813 1.00 . A A . 3 PRO CD 1 1 2 336 1 1 3 PRO CG C 1.857 -8.312 -2.392 1.00 . A A . 3 PRO CG 1 1 2 337 1 1 3 PRO HA H 0.861 -6.204 -0.748 1.00 . A A . 3 PRO HA 1 1 2 338 1 1 3 PRO HB2 H 2.470 -8.706 -0.368 1.00 . A A . 3 PRO HB2 1 1 2 339 1 1 3 PRO HB3 H 0.733 -8.502 -0.595 1.00 . A A . 3 PRO HB3 1 1 2 340 1 1 3 PRO HD2 H 3.854 -7.642 -2.745 1.00 . A A . 3 PRO HD2 1 1 2 341 1 1 3 PRO HD3 H 2.635 -6.909 -3.812 1.00 . A A . 3 PRO HD3 1 1 2 342 1 1 3 PRO HG2 H 2.223 -9.298 -2.635 1.00 . A A . 3 PRO HG2 1 1 2 343 1 1 3 PRO HG3 H 0.905 -8.139 -2.874 1.00 . A A . 3 PRO HG3 1 1 2 344 1 1 3 PRO N N 2.626 -6.182 -1.820 1.00 . A A . 3 PRO N 1 1 2 345 1 1 3 PRO O O 1.649 -5.891 1.578 1.00 . A A . 3 PRO O 1 1 2 346 1 1 4 PRO C C 4.375 -4.270 1.918 1.00 . A A . 4 PRO C 1 1 2 347 1 1 4 PRO CA C 4.328 -5.789 2.134 1.00 . A A . 4 PRO CA 1 1 2 348 1 1 4 PRO CB C 5.759 -6.357 2.186 1.00 . A A . 4 PRO CB 1 1 2 349 1 1 4 PRO CD C 4.725 -7.106 0.152 1.00 . A A . 4 PRO CD 1 1 2 350 1 1 4 PRO CG C 5.828 -7.399 1.118 1.00 . A A . 4 PRO CG 1 1 2 351 1 1 4 PRO HA H 3.771 -6.022 3.029 1.00 . A A . 4 PRO HA 1 1 2 352 1 1 4 PRO HB2 H 6.467 -5.562 2.006 1.00 . A A . 4 PRO HB2 1 1 2 353 1 1 4 PRO HB3 H 5.940 -6.781 3.163 1.00 . A A . 4 PRO HB3 1 1 2 354 1 1 4 PRO HD2 H 5.016 -6.475 -0.675 1.00 . A A . 4 PRO HD2 1 1 2 355 1 1 4 PRO HD3 H 4.285 -8.016 -0.226 1.00 . A A . 4 PRO HD3 1 1 2 356 1 1 4 PRO HG2 H 6.782 -7.343 0.617 1.00 . A A . 4 PRO HG2 1 1 2 357 1 1 4 PRO HG3 H 5.694 -8.378 1.555 1.00 . A A . 4 PRO HG3 1 1 2 358 1 1 4 PRO N N 3.737 -6.389 0.950 1.00 . A A . 4 PRO N 1 1 2 359 1 1 4 PRO O O 4.923 -3.810 0.901 1.00 . A A . 4 PRO O 1 1 2 360 1 1 5 ARG C C 4.975 -1.358 2.422 1.00 . A A . 5 ARG C 1 1 2 361 1 1 5 ARG CA C 3.653 -2.051 2.753 1.00 . A A . 5 ARG CA 1 1 2 362 1 1 5 ARG CB C 3.048 -1.485 4.044 1.00 . A A . 5 ARG CB 1 1 2 363 1 1 5 ARG CD C 1.139 -1.559 5.702 1.00 . A A . 5 ARG CD 1 1 2 364 1 1 5 ARG CG C 1.677 -2.062 4.373 1.00 . A A . 5 ARG CG 1 1 2 365 1 1 5 ARG CZ C 0.572 0.620 6.774 1.00 . A A . 5 ARG CZ 1 1 2 366 1 1 5 ARG H H 3.462 -3.964 3.660 1.00 . A A . 5 ARG H 1 1 2 367 1 1 5 ARG HA H 2.965 -1.860 1.943 1.00 . A A . 5 ARG HA 1 1 2 368 1 1 5 ARG HB2 H 3.714 -1.707 4.865 1.00 . A A . 5 ARG HB2 1 1 2 369 1 1 5 ARG HB3 H 2.952 -0.414 3.946 1.00 . A A . 5 ARG HB3 1 1 2 370 1 1 5 ARG HD2 H 0.205 -2.063 5.897 1.00 . A A . 5 ARG HD2 1 1 2 371 1 1 5 ARG HD3 H 1.845 -1.803 6.482 1.00 . A A . 5 ARG HD3 1 1 2 372 1 1 5 ARG HE H 0.972 0.352 4.831 1.00 . A A . 5 ARG HE 1 1 2 373 1 1 5 ARG HG2 H 0.985 -1.776 3.594 1.00 . A A . 5 ARG HG2 1 1 2 374 1 1 5 ARG HG3 H 1.748 -3.139 4.404 1.00 . A A . 5 ARG HG3 1 1 2 375 1 1 5 ARG HH11 H 0.563 -0.930 8.096 1.00 . A A . 5 ARG HH11 1 1 2 376 1 1 5 ARG HH12 H 0.199 0.586 8.782 1.00 . A A . 5 ARG HH12 1 1 2 377 1 1 5 ARG HH21 H 0.446 2.361 5.724 1.00 . A A . 5 ARG HH21 1 1 2 378 1 1 5 ARG HH22 H 0.094 2.513 7.397 1.00 . A A . 5 ARG HH22 1 1 2 379 1 1 5 ARG N N 3.797 -3.518 2.853 1.00 . A A . 5 ARG N 1 1 2 380 1 1 5 ARG NE N 0.899 -0.115 5.707 1.00 . A A . 5 ARG NE 1 1 2 381 1 1 5 ARG NH1 N 0.434 0.057 7.964 1.00 . A A . 5 ARG NH1 1 1 2 382 1 1 5 ARG NH2 N 0.359 1.922 6.631 1.00 . A A . 5 ARG NH2 1 1 2 383 1 1 5 ARG O O 5.930 -1.414 3.195 1.00 . A A . 5 ARG O 1 1 2 384 1 1 6 GLY C C 6.605 1.118 1.616 1.00 . A A . 6 GLY C 1 1 2 385 1 1 6 GLY CA C 6.210 -0.075 0.772 1.00 . A A . 6 GLY CA 1 1 2 386 1 1 6 GLY H H 4.204 -0.740 0.702 1.00 . A A . 6 GLY H 1 1 2 387 1 1 6 GLY HA2 H 7.027 -0.783 0.773 1.00 . A A . 6 GLY HA2 1 1 2 388 1 1 6 GLY HA3 H 6.042 0.255 -0.243 1.00 . A A . 6 GLY HA3 1 1 2 389 1 1 6 GLY N N 5.016 -0.739 1.249 1.00 . A A . 6 GLY N 1 1 2 390 1 1 6 GLY O O 5.760 1.944 1.986 1.00 . A A . 6 GLY O 1 1 2 391 1 1 7 SER C C 8.647 3.521 1.873 1.00 . A A . 7 SER C 1 1 2 392 1 1 7 SER CA C 8.417 2.276 2.724 1.00 . A A . 7 SER CA 1 1 2 393 1 1 7 SER CB C 9.728 1.819 3.329 1.00 . A A . 7 SER CB 1 1 2 394 1 1 7 SER H H 8.505 0.528 1.590 1.00 . A A . 7 SER H 1 1 2 395 1 1 7 SER HA H 7.722 2.496 3.520 1.00 . A A . 7 SER HA 1 1 2 396 1 1 7 SER HB2 H 10.464 1.711 2.546 1.00 . A A . 7 SER HB2 1 1 2 397 1 1 7 SER HB3 H 10.063 2.554 4.046 1.00 . A A . 7 SER HB3 1 1 2 398 1 1 7 SER HG H 9.334 0.770 4.901 1.00 . A A . 7 SER HG 1 1 2 399 1 1 7 SER N N 7.879 1.210 1.916 1.00 . A A . 7 SER N 1 1 2 400 1 1 7 SER O O 8.545 4.652 2.355 1.00 . A A . 7 SER O 1 1 2 401 1 1 7 SER OG O 9.573 0.569 3.987 1.00 . A A . 7 SER OG 1 1 2 402 1 1 8 SER C C 7.862 5.159 -0.578 1.00 . A A . 8 SER C 1 1 2 403 1 1 8 SER CA C 9.168 4.388 -0.309 1.00 . A A . 8 SER CA 1 1 2 404 1 1 8 SER CB C 9.745 3.825 -1.597 1.00 . A A . 8 SER CB 1 1 2 405 1 1 8 SER H H 8.994 2.385 0.280 1.00 . A A . 8 SER H 1 1 2 406 1 1 8 SER HA H 9.893 5.052 0.138 1.00 . A A . 8 SER HA 1 1 2 407 1 1 8 SER HB2 H 9.008 3.199 -2.079 1.00 . A A . 8 SER HB2 1 1 2 408 1 1 8 SER HB3 H 10.024 4.634 -2.257 1.00 . A A . 8 SER HB3 1 1 2 409 1 1 8 SER HG H 11.139 3.249 -0.393 1.00 . A A . 8 SER HG 1 1 2 410 1 1 8 SER N N 8.935 3.308 0.611 1.00 . A A . 8 SER N 1 1 2 411 1 1 8 SER O O 6.793 4.547 -0.685 1.00 . A A . 8 SER O 1 1 2 412 1 1 8 SER OG O 10.900 3.050 -1.308 1.00 . A A . 8 SER OG 1 1 2 413 1 1 9 PRO C C 5.951 6.933 -2.063 1.00 . A A . 9 PRO C 1 1 2 414 1 1 9 PRO CA C 6.804 7.402 -0.889 1.00 . A A . 9 PRO CA 1 1 2 415 1 1 9 PRO CB C 7.498 8.703 -1.243 1.00 . A A . 9 PRO CB 1 1 2 416 1 1 9 PRO CD C 9.168 7.282 -0.343 1.00 . A A . 9 PRO CD 1 1 2 417 1 1 9 PRO CG C 8.709 8.705 -0.397 1.00 . A A . 9 PRO CG 1 1 2 418 1 1 9 PRO HA H 6.180 7.547 -0.022 1.00 . A A . 9 PRO HA 1 1 2 419 1 1 9 PRO HB2 H 7.749 8.687 -2.292 1.00 . A A . 9 PRO HB2 1 1 2 420 1 1 9 PRO HB3 H 6.856 9.545 -1.031 1.00 . A A . 9 PRO HB3 1 1 2 421 1 1 9 PRO HD2 H 9.918 7.091 -1.096 1.00 . A A . 9 PRO HD2 1 1 2 422 1 1 9 PRO HD3 H 9.549 7.058 0.642 1.00 . A A . 9 PRO HD3 1 1 2 423 1 1 9 PRO HG2 H 9.472 9.320 -0.849 1.00 . A A . 9 PRO HG2 1 1 2 424 1 1 9 PRO HG3 H 8.472 9.060 0.595 1.00 . A A . 9 PRO HG3 1 1 2 425 1 1 9 PRO N N 7.941 6.506 -0.611 1.00 . A A . 9 PRO N 1 1 2 426 1 1 9 PRO O O 6.452 6.717 -3.176 1.00 . A A . 9 PRO O 1 1 2 427 1 1 10 GLY C C 3.456 4.829 -2.611 1.00 . A A . 10 GLY C 1 1 2 428 1 1 10 GLY CA C 3.775 6.289 -2.804 1.00 . A A . 10 GLY CA 1 1 2 429 1 1 10 GLY H H 4.350 6.950 -0.899 1.00 . A A . 10 GLY H 1 1 2 430 1 1 10 GLY HA2 H 2.867 6.870 -2.752 1.00 . A A . 10 GLY HA2 1 1 2 431 1 1 10 GLY HA3 H 4.224 6.423 -3.777 1.00 . A A . 10 GLY HA3 1 1 2 432 1 1 10 GLY N N 4.684 6.755 -1.804 1.00 . A A . 10 GLY N 1 1 2 433 1 1 10 GLY O O 2.399 4.356 -3.031 1.00 . A A . 10 GLY O 1 1 2 434 1 1 11 GLY C C 3.036 2.378 -0.849 1.00 . A A . 11 GLY C 1 1 2 435 1 1 11 GLY CA C 4.204 2.698 -1.731 1.00 . A A . 11 GLY CA 1 1 2 436 1 1 11 GLY H H 5.161 4.564 -1.602 1.00 . A A . 11 GLY H 1 1 2 437 1 1 11 GLY HA2 H 4.062 2.207 -2.682 1.00 . A A . 11 GLY HA2 1 1 2 438 1 1 11 GLY HA3 H 5.104 2.317 -1.271 1.00 . A A . 11 GLY HA3 1 1 2 439 1 1 11 GLY N N 4.360 4.117 -1.955 1.00 . A A . 11 GLY N 1 1 2 440 1 1 11 GLY O O 2.183 1.574 -1.212 1.00 . A A . 11 GLY O 1 1 2 441 1 1 12 ASP C C 0.663 3.584 0.833 1.00 . A A . 12 ASP C 1 1 2 442 1 1 12 ASP CA C 1.886 2.781 1.219 1.00 . A A . 12 ASP CA 1 1 2 443 1 1 12 ASP CB C 2.296 3.062 2.657 1.00 . A A . 12 ASP CB 1 1 2 444 1 1 12 ASP CG C 1.200 2.702 3.630 1.00 . A A . 12 ASP CG 1 1 2 445 1 1 12 ASP H H 3.657 3.694 0.500 1.00 . A A . 12 ASP H 1 1 2 446 1 1 12 ASP HA H 1.637 1.734 1.124 1.00 . A A . 12 ASP HA 1 1 2 447 1 1 12 ASP HB2 H 3.169 2.472 2.893 1.00 . A A . 12 ASP HB2 1 1 2 448 1 1 12 ASP HB3 H 2.527 4.111 2.766 1.00 . A A . 12 ASP HB3 1 1 2 449 1 1 12 ASP N N 2.968 3.030 0.287 1.00 . A A . 12 ASP N 1 1 2 450 1 1 12 ASP O O -0.473 3.194 1.107 1.00 . A A . 12 ASP O 1 1 2 451 1 1 12 ASP OD1 O 0.813 1.527 3.682 1.00 . A A . 12 ASP OD1 1 1 2 452 1 1 12 ASP OD2 O 0.694 3.591 4.362 1.00 . A A . 12 ASP OD2 1 1 2 453 1 1 13 LYS C C -1.048 4.677 -1.334 1.00 . A A . 13 LYS C 1 1 2 454 1 1 13 LYS CA C -0.191 5.514 -0.377 1.00 . A A . 13 LYS CA 1 1 2 455 1 1 13 LYS CB C 0.366 6.744 -1.107 1.00 . A A . 13 LYS CB 1 1 2 456 1 1 13 LYS CD C -1.604 8.280 -0.712 1.00 . A A . 13 LYS CD 1 1 2 457 1 1 13 LYS CE C -2.759 9.023 -1.372 1.00 . A A . 13 LYS CE 1 1 2 458 1 1 13 LYS CG C -0.701 7.631 -1.747 1.00 . A A . 13 LYS CG 1 1 2 459 1 1 13 LYS H H 1.828 4.953 0.001 1.00 . A A . 13 LYS H 1 1 2 460 1 1 13 LYS HA H -0.798 5.831 0.458 1.00 . A A . 13 LYS HA 1 1 2 461 1 1 13 LYS HB2 H 0.929 7.344 -0.407 1.00 . A A . 13 LYS HB2 1 1 2 462 1 1 13 LYS HB3 H 1.030 6.400 -1.887 1.00 . A A . 13 LYS HB3 1 1 2 463 1 1 13 LYS HD2 H -2.010 7.514 -0.070 1.00 . A A . 13 LYS HD2 1 1 2 464 1 1 13 LYS HD3 H -1.024 8.977 -0.126 1.00 . A A . 13 LYS HD3 1 1 2 465 1 1 13 LYS HE2 H -3.392 8.302 -1.866 1.00 . A A . 13 LYS HE2 1 1 2 466 1 1 13 LYS HE3 H -3.325 9.520 -0.600 1.00 . A A . 13 LYS HE3 1 1 2 467 1 1 13 LYS HG2 H -0.215 8.409 -2.314 1.00 . A A . 13 LYS HG2 1 1 2 468 1 1 13 LYS HG3 H -1.302 7.028 -2.411 1.00 . A A . 13 LYS HG3 1 1 2 469 1 1 13 LYS HZ1 H -1.734 10.774 -1.918 1.00 . A A . 13 LYS HZ1 1 1 2 470 1 1 13 LYS HZ2 H -3.122 10.484 -2.818 1.00 . A A . 13 LYS HZ2 1 1 2 471 1 1 13 LYS HZ3 H -1.740 9.596 -3.118 1.00 . A A . 13 LYS HZ3 1 1 2 472 1 1 13 LYS N N 0.894 4.690 0.143 1.00 . A A . 13 LYS N 1 1 2 473 1 1 13 LYS NZ N -2.305 10.031 -2.363 1.00 . A A . 13 LYS NZ 1 1 2 474 1 1 13 LYS O O -2.268 4.637 -1.229 1.00 . A A . 13 LYS O 1 1 2 475 1 1 14 LEU C C -1.263 1.709 -2.578 1.00 . A A . 14 LEU C 1 1 2 476 1 1 14 LEU CA C -1.059 3.088 -3.160 1.00 . A A . 14 LEU CA 1 1 2 477 1 1 14 LEU CB C -0.323 2.996 -4.499 1.00 . A A . 14 LEU CB 1 1 2 478 1 1 14 LEU CD1 C 0.021 5.469 -5.005 1.00 . A A . 14 LEU CD1 1 1 2 479 1 1 14 LEU CD2 C -0.001 3.777 -6.846 1.00 . A A . 14 LEU CD2 1 1 2 480 1 1 14 LEU CG C -0.547 4.141 -5.490 1.00 . A A . 14 LEU CG 1 1 2 481 1 1 14 LEU H H 0.595 4.015 -2.249 1.00 . A A . 14 LEU H 1 1 2 482 1 1 14 LEU HA H -2.036 3.516 -3.335 1.00 . A A . 14 LEU HA 1 1 2 483 1 1 14 LEU HB2 H 0.736 2.942 -4.290 1.00 . A A . 14 LEU HB2 1 1 2 484 1 1 14 LEU HB3 H -0.620 2.074 -4.978 1.00 . A A . 14 LEU HB3 1 1 2 485 1 1 14 LEU HD11 H 1.088 5.374 -4.861 1.00 . A A . 14 LEU HD11 1 1 2 486 1 1 14 LEU HD12 H -0.442 5.734 -4.066 1.00 . A A . 14 LEU HD12 1 1 2 487 1 1 14 LEU HD13 H -0.180 6.239 -5.735 1.00 . A A . 14 LEU HD13 1 1 2 488 1 1 14 LEU HD21 H -0.174 4.593 -7.530 1.00 . A A . 14 LEU HD21 1 1 2 489 1 1 14 LEU HD22 H -0.521 2.898 -7.199 1.00 . A A . 14 LEU HD22 1 1 2 490 1 1 14 LEU HD23 H 1.056 3.575 -6.771 1.00 . A A . 14 LEU HD23 1 1 2 491 1 1 14 LEU HG H -1.615 4.250 -5.588 1.00 . A A . 14 LEU HG 1 1 2 492 1 1 14 LEU N N -0.386 3.962 -2.219 1.00 . A A . 14 LEU N 1 1 2 493 1 1 14 LEU O O -1.506 0.752 -3.302 1.00 . A A . 14 LEU O 1 1 2 494 1 1 15 TRP C C -2.726 0.570 0.149 1.00 . A A . 15 TRP C 1 1 2 495 1 1 15 TRP CA C -1.425 0.383 -0.592 1.00 . A A . 15 TRP CA 1 1 2 496 1 1 15 TRP CB C -0.317 0.089 0.426 1.00 . A A . 15 TRP CB 1 1 2 497 1 1 15 TRP CD1 C 0.829 -2.144 0.624 1.00 . A A . 15 TRP CD1 1 1 2 498 1 1 15 TRP CD2 C -1.164 -2.107 1.592 1.00 . A A . 15 TRP CD2 1 1 2 499 1 1 15 TRP CE2 C -0.623 -3.382 1.751 1.00 . A A . 15 TRP CE2 1 1 2 500 1 1 15 TRP CE3 C -2.410 -1.851 2.116 1.00 . A A . 15 TRP CE3 1 1 2 501 1 1 15 TRP CG C -0.210 -1.330 0.864 1.00 . A A . 15 TRP CG 1 1 2 502 1 1 15 TRP CH2 C -2.532 -4.093 2.914 1.00 . A A . 15 TRP CH2 1 1 2 503 1 1 15 TRP CZ2 C -1.298 -4.396 2.420 1.00 . A A . 15 TRP CZ2 1 1 2 504 1 1 15 TRP CZ3 C -3.074 -2.832 2.761 1.00 . A A . 15 TRP CZ3 1 1 2 505 1 1 15 TRP H H -0.900 2.405 -0.767 1.00 . A A . 15 TRP H 1 1 2 506 1 1 15 TRP HA H -1.487 -0.414 -1.315 1.00 . A A . 15 TRP HA 1 1 2 507 1 1 15 TRP HB2 H 0.633 0.334 -0.013 1.00 . A A . 15 TRP HB2 1 1 2 508 1 1 15 TRP HB3 H -0.473 0.701 1.304 1.00 . A A . 15 TRP HB3 1 1 2 509 1 1 15 TRP HD1 H 1.712 -1.825 0.091 1.00 . A A . 15 TRP HD1 1 1 2 510 1 1 15 TRP HE1 H 1.200 -4.154 1.123 1.00 . A A . 15 TRP HE1 1 1 2 511 1 1 15 TRP HE3 H -2.861 -0.875 2.011 1.00 . A A . 15 TRP HE3 1 1 2 512 1 1 15 TRP HH2 H -3.133 -4.823 3.428 1.00 . A A . 15 TRP HH2 1 1 2 513 1 1 15 TRP HZ2 H -0.879 -5.384 2.542 1.00 . A A . 15 TRP HZ2 1 1 2 514 1 1 15 TRP HZ3 H -4.053 -2.612 3.145 1.00 . A A . 15 TRP HZ3 1 1 2 515 1 1 15 TRP N N -1.166 1.613 -1.279 1.00 . A A . 15 TRP N 1 1 2 516 1 1 15 TRP NE1 N 0.596 -3.376 1.159 1.00 . A A . 15 TRP NE1 1 1 2 517 1 1 15 TRP O O -3.705 -0.159 -0.064 1.00 . A A . 15 TRP O 1 1 2 518 1 1 16 GLN C C -5.112 2.309 1.067 1.00 . A A . 16 GLN C 1 1 2 519 1 1 16 GLN CA C -3.880 1.901 1.864 1.00 . A A . 16 GLN CA 1 1 2 520 1 1 16 GLN CB C -3.527 3.018 2.851 1.00 . A A . 16 GLN CB 1 1 2 521 1 1 16 GLN CD C -2.608 1.515 4.695 1.00 . A A . 16 GLN CD 1 1 2 522 1 1 16 GLN CG C -2.371 2.714 3.802 1.00 . A A . 16 GLN CG 1 1 2 523 1 1 16 GLN H H -1.949 2.171 1.055 1.00 . A A . 16 GLN H 1 1 2 524 1 1 16 GLN HA H -4.098 1.009 2.429 1.00 . A A . 16 GLN HA 1 1 2 525 1 1 16 GLN HB2 H -3.268 3.903 2.289 1.00 . A A . 16 GLN HB2 1 1 2 526 1 1 16 GLN HB3 H -4.403 3.236 3.445 1.00 . A A . 16 GLN HB3 1 1 2 527 1 1 16 GLN HE21 H -1.544 0.396 3.492 1.00 . A A . 16 GLN HE21 1 1 2 528 1 1 16 GLN HE22 H -2.208 -0.414 4.867 1.00 . A A . 16 GLN HE22 1 1 2 529 1 1 16 GLN HG2 H -1.505 2.482 3.198 1.00 . A A . 16 GLN HG2 1 1 2 530 1 1 16 GLN HG3 H -2.172 3.578 4.417 1.00 . A A . 16 GLN HG3 1 1 2 531 1 1 16 GLN N N -2.747 1.594 0.997 1.00 . A A . 16 GLN N 1 1 2 532 1 1 16 GLN NE2 N -2.075 0.389 4.317 1.00 . A A . 16 GLN NE2 1 1 2 533 1 1 16 GLN O O -6.214 2.358 1.598 1.00 . A A . 16 GLN O 1 1 2 534 1 1 16 GLN OE1 O -3.194 1.630 5.778 1.00 . A A . 16 GLN OE1 1 1 2 535 1 1 17 ILE C C -6.182 1.902 -2.146 1.00 . A A . 17 ILE C 1 1 2 536 1 1 17 ILE CA C -5.998 3.008 -1.082 1.00 . A A . 17 ILE CA 1 1 2 537 1 1 17 ILE CB C -5.696 4.424 -1.750 1.00 . A A . 17 ILE CB 1 1 2 538 1 1 17 ILE CD1 C -6.429 5.775 0.330 1.00 . A A . 17 ILE CD1 1 1 2 539 1 1 17 ILE CG1 C -5.327 5.477 -0.676 1.00 . A A . 17 ILE CG1 1 1 2 540 1 1 17 ILE CG2 C -6.888 4.950 -2.567 1.00 . A A . 17 ILE CG2 1 1 2 541 1 1 17 ILE H H -3.994 2.608 -0.545 1.00 . A A . 17 ILE H 1 1 2 542 1 1 17 ILE HA H -6.894 3.051 -0.493 1.00 . A A . 17 ILE HA 1 1 2 543 1 1 17 ILE HB H -4.854 4.310 -2.421 1.00 . A A . 17 ILE HB 1 1 2 544 1 1 17 ILE HD11 H -6.679 4.874 0.871 1.00 . A A . 17 ILE HD11 1 1 2 545 1 1 17 ILE HD12 H -7.304 6.134 -0.192 1.00 . A A . 17 ILE HD12 1 1 2 546 1 1 17 ILE HD13 H -6.087 6.530 1.023 1.00 . A A . 17 ILE HD13 1 1 2 547 1 1 17 ILE HG12 H -4.471 5.124 -0.121 1.00 . A A . 17 ILE HG12 1 1 2 548 1 1 17 ILE HG13 H -5.067 6.401 -1.171 1.00 . A A . 17 ILE HG13 1 1 2 549 1 1 17 ILE HG21 H -6.629 5.897 -3.014 1.00 . A A . 17 ILE HG21 1 1 2 550 1 1 17 ILE HG22 H -7.739 5.085 -1.915 1.00 . A A . 17 ILE HG22 1 1 2 551 1 1 17 ILE HG23 H -7.136 4.239 -3.342 1.00 . A A . 17 ILE HG23 1 1 2 552 1 1 17 ILE N N -4.911 2.619 -0.198 1.00 . A A . 17 ILE N 1 1 2 553 1 1 17 ILE O O -6.704 2.121 -3.234 1.00 . A A . 17 ILE O 1 1 2 554 1 1 18 TYR C C -6.102 -1.761 -2.107 1.00 . A A . 18 TYR C 1 1 2 555 1 1 18 TYR CA C -5.820 -0.384 -2.761 1.00 . A A . 18 TYR CA 1 1 2 556 1 1 18 TYR CB C -4.522 -0.309 -3.594 1.00 . A A . 18 TYR CB 1 1 2 557 1 1 18 TYR CD1 C -2.900 -2.054 -2.984 1.00 . A A . 18 TYR CD1 1 1 2 558 1 1 18 TYR CD2 C -3.934 -2.229 -5.104 1.00 . A A . 18 TYR CD2 1 1 2 559 1 1 18 TYR CE1 C -2.147 -3.174 -3.237 1.00 . A A . 18 TYR CE1 1 1 2 560 1 1 18 TYR CE2 C -3.204 -3.363 -5.375 1.00 . A A . 18 TYR CE2 1 1 2 561 1 1 18 TYR CG C -3.791 -1.570 -3.899 1.00 . A A . 18 TYR CG 1 1 2 562 1 1 18 TYR CZ C -2.307 -3.834 -4.440 1.00 . A A . 18 TYR CZ 1 1 2 563 1 1 18 TYR H H -5.444 0.558 -0.901 1.00 . A A . 18 TYR H 1 1 2 564 1 1 18 TYR HA H -6.646 -0.174 -3.423 1.00 . A A . 18 TYR HA 1 1 2 565 1 1 18 TYR HB2 H -4.738 0.143 -4.546 1.00 . A A . 18 TYR HB2 1 1 2 566 1 1 18 TYR HB3 H -3.840 0.347 -3.072 1.00 . A A . 18 TYR HB3 1 1 2 567 1 1 18 TYR HD1 H -2.855 -1.493 -2.059 1.00 . A A . 18 TYR HD1 1 1 2 568 1 1 18 TYR HD2 H -4.639 -1.853 -5.832 1.00 . A A . 18 TYR HD2 1 1 2 569 1 1 18 TYR HE1 H -1.461 -3.530 -2.481 1.00 . A A . 18 TYR HE1 1 1 2 570 1 1 18 TYR HE2 H -3.334 -3.875 -6.316 1.00 . A A . 18 TYR HE2 1 1 2 571 1 1 18 TYR HH H -1.588 -5.558 -3.970 1.00 . A A . 18 TYR HH 1 1 2 572 1 1 18 TYR N N -5.783 0.706 -1.809 1.00 . A A . 18 TYR N 1 1 2 573 1 1 18 TYR O O -6.972 -2.491 -2.556 1.00 . A A . 18 TYR O 1 1 2 574 1 1 18 TYR OH O -1.553 -4.952 -4.721 1.00 . A A . 18 TYR OH 1 1 2 575 1 1 19 LEU C C -6.258 -3.127 0.976 1.00 . A A . 19 LEU C 1 1 2 576 1 1 19 LEU CA C -5.602 -3.370 -0.343 1.00 . A A . 19 LEU CA 1 1 2 577 1 1 19 LEU CB C -4.309 -4.108 -0.123 1.00 . A A . 19 LEU CB 1 1 2 578 1 1 19 LEU CD1 C -2.513 -5.624 -0.806 1.00 . A A . 19 LEU CD1 1 1 2 579 1 1 19 LEU CD2 C -4.850 -6.115 -1.455 1.00 . A A . 19 LEU CD2 1 1 2 580 1 1 19 LEU CG C -3.835 -5.026 -1.215 1.00 . A A . 19 LEU CG 1 1 2 581 1 1 19 LEU H H -4.666 -1.501 -0.745 1.00 . A A . 19 LEU H 1 1 2 582 1 1 19 LEU HA H -6.260 -3.977 -0.945 1.00 . A A . 19 LEU HA 1 1 2 583 1 1 19 LEU HB2 H -3.557 -3.339 -0.020 1.00 . A A . 19 LEU HB2 1 1 2 584 1 1 19 LEU HB3 H -4.375 -4.663 0.801 1.00 . A A . 19 LEU HB3 1 1 2 585 1 1 19 LEU HD11 H -2.661 -6.207 0.091 1.00 . A A . 19 LEU HD11 1 1 2 586 1 1 19 LEU HD12 H -1.846 -4.801 -0.587 1.00 . A A . 19 LEU HD12 1 1 2 587 1 1 19 LEU HD13 H -2.114 -6.237 -1.601 1.00 . A A . 19 LEU HD13 1 1 2 588 1 1 19 LEU HD21 H -5.768 -5.691 -1.832 1.00 . A A . 19 LEU HD21 1 1 2 589 1 1 19 LEU HD22 H -5.048 -6.593 -0.507 1.00 . A A . 19 LEU HD22 1 1 2 590 1 1 19 LEU HD23 H -4.456 -6.836 -2.154 1.00 . A A . 19 LEU HD23 1 1 2 591 1 1 19 LEU HG H -3.697 -4.470 -2.131 1.00 . A A . 19 LEU HG 1 1 2 592 1 1 19 LEU N N -5.381 -2.100 -1.059 1.00 . A A . 19 LEU N 1 1 2 593 1 1 19 LEU O O -6.426 -4.026 1.799 1.00 . A A . 19 LEU O 1 1 2 594 1 1 20 ASN C C -8.469 -0.736 1.898 1.00 . A A . 20 ASN C 1 1 2 595 1 1 20 ASN CA C -7.257 -1.484 2.342 1.00 . A A . 20 ASN CA 1 1 2 596 1 1 20 ASN CB C -6.341 -0.626 3.217 1.00 . A A . 20 ASN CB 1 1 2 597 1 1 20 ASN CG C -7.074 0.095 4.330 1.00 . A A . 20 ASN CG 1 1 2 598 1 1 20 ASN H H -6.361 -1.282 0.476 1.00 . A A . 20 ASN H 1 1 2 599 1 1 20 ASN HA H -7.555 -2.365 2.890 1.00 . A A . 20 ASN HA 1 1 2 600 1 1 20 ASN HB2 H -5.602 -1.269 3.671 1.00 . A A . 20 ASN HB2 1 1 2 601 1 1 20 ASN HB3 H -5.836 0.095 2.592 1.00 . A A . 20 ASN HB3 1 1 2 602 1 1 20 ASN HD21 H -7.225 1.708 3.203 1.00 . A A . 20 ASN HD21 1 1 2 603 1 1 20 ASN HD22 H -7.916 1.825 4.789 1.00 . A A . 20 ASN HD22 1 1 2 604 1 1 20 ASN N N -6.579 -1.927 1.178 1.00 . A A . 20 ASN N 1 1 2 605 1 1 20 ASN ND2 N -7.443 1.332 4.086 1.00 . A A . 20 ASN ND2 1 1 2 606 1 1 20 ASN O O -9.590 -1.229 2.096 1.00 . A A . 20 ASN O 1 1 2 607 1 1 20 ASN OXT O -8.309 0.283 1.217 1.00 . A A . 20 ASN OXT 1 1 2 608 1 1 20 ASN OD1 O -7.272 -0.452 5.415 1.00 . A A . 20 ASN OD1 1 1 3 609 1 1 1 SER C C 0.793 -2.866 -5.633 1.00 . A A . 1 SER C 1 1 3 610 1 1 1 SER CA C 0.006 -1.648 -6.132 1.00 . A A . 1 SER CA 1 1 3 611 1 1 1 SER CB C -1.064 -1.233 -5.116 1.00 . A A . 1 SER CB 1 1 3 612 1 1 1 SER H1 H 0.083 -2.204 -8.105 1.00 . A A . 1 SER H1 1 1 3 613 1 1 1 SER H2 H -1.239 -1.203 -7.721 1.00 . A A . 1 SER H2 1 1 3 614 1 1 1 SER H3 H -1.218 -2.820 -7.244 1.00 . A A . 1 SER H3 1 1 3 615 1 1 1 SER HA H 0.685 -0.825 -6.298 1.00 . A A . 1 SER HA 1 1 3 616 1 1 1 SER HB2 H -1.585 -0.361 -5.481 1.00 . A A . 1 SER HB2 1 1 3 617 1 1 1 SER HB3 H -1.777 -2.030 -4.977 1.00 . A A . 1 SER HB3 1 1 3 618 1 1 1 SER HG H -1.172 -0.468 -3.333 1.00 . A A . 1 SER HG 1 1 3 619 1 1 1 SER N N -0.628 -1.975 -7.386 1.00 . A A . 1 SER N 1 1 3 620 1 1 1 SER O O 0.325 -3.998 -5.777 1.00 . A A . 1 SER O 1 1 3 621 1 1 1 SER OG O -0.501 -0.901 -3.869 1.00 . A A . 1 SER OG 1 1 3 622 1 1 2 PRO C C 2.473 -4.125 -3.102 1.00 . A A . 2 PRO C 1 1 3 623 1 1 2 PRO CA C 2.835 -3.745 -4.561 1.00 . A A . 2 PRO CA 1 1 3 624 1 1 2 PRO CB C 4.241 -3.168 -4.629 1.00 . A A . 2 PRO CB 1 1 3 625 1 1 2 PRO CD C 2.686 -1.352 -4.959 1.00 . A A . 2 PRO CD 1 1 3 626 1 1 2 PRO CG C 4.068 -1.695 -4.457 1.00 . A A . 2 PRO CG 1 1 3 627 1 1 2 PRO HA H 2.774 -4.619 -5.192 1.00 . A A . 2 PRO HA 1 1 3 628 1 1 2 PRO HB2 H 4.841 -3.593 -3.839 1.00 . A A . 2 PRO HB2 1 1 3 629 1 1 2 PRO HB3 H 4.675 -3.400 -5.589 1.00 . A A . 2 PRO HB3 1 1 3 630 1 1 2 PRO HD2 H 2.170 -0.725 -4.248 1.00 . A A . 2 PRO HD2 1 1 3 631 1 1 2 PRO HD3 H 2.755 -0.859 -5.917 1.00 . A A . 2 PRO HD3 1 1 3 632 1 1 2 PRO HG2 H 4.152 -1.444 -3.409 1.00 . A A . 2 PRO HG2 1 1 3 633 1 1 2 PRO HG3 H 4.818 -1.171 -5.028 1.00 . A A . 2 PRO HG3 1 1 3 634 1 1 2 PRO N N 2.012 -2.661 -5.089 1.00 . A A . 2 PRO N 1 1 3 635 1 1 2 PRO O O 2.548 -3.289 -2.194 1.00 . A A . 2 PRO O 1 1 3 636 1 1 3 PRO C C 2.776 -5.787 -0.396 1.00 . A A . 3 PRO C 1 1 3 637 1 1 3 PRO CA C 1.695 -5.904 -1.538 1.00 . A A . 3 PRO CA 1 1 3 638 1 1 3 PRO CB C 1.277 -7.354 -1.779 1.00 . A A . 3 PRO CB 1 1 3 639 1 1 3 PRO CD C 1.879 -6.424 -3.912 1.00 . A A . 3 PRO CD 1 1 3 640 1 1 3 PRO CG C 0.992 -7.434 -3.242 1.00 . A A . 3 PRO CG 1 1 3 641 1 1 3 PRO HA H 0.841 -5.349 -1.196 1.00 . A A . 3 PRO HA 1 1 3 642 1 1 3 PRO HB2 H 2.081 -8.013 -1.486 1.00 . A A . 3 PRO HB2 1 1 3 643 1 1 3 PRO HB3 H 0.398 -7.578 -1.194 1.00 . A A . 3 PRO HB3 1 1 3 644 1 1 3 PRO HD2 H 2.820 -6.870 -4.196 1.00 . A A . 3 PRO HD2 1 1 3 645 1 1 3 PRO HD3 H 1.375 -6.015 -4.776 1.00 . A A . 3 PRO HD3 1 1 3 646 1 1 3 PRO HG2 H 1.218 -8.426 -3.605 1.00 . A A . 3 PRO HG2 1 1 3 647 1 1 3 PRO HG3 H -0.047 -7.198 -3.423 1.00 . A A . 3 PRO HG3 1 1 3 648 1 1 3 PRO N N 2.067 -5.393 -2.875 1.00 . A A . 3 PRO N 1 1 3 649 1 1 3 PRO O O 2.406 -5.548 0.757 1.00 . A A . 3 PRO O 1 1 3 650 1 1 4 PRO C C 5.278 -4.288 0.598 1.00 . A A . 4 PRO C 1 1 3 651 1 1 4 PRO CA C 5.113 -5.792 0.376 1.00 . A A . 4 PRO CA 1 1 3 652 1 1 4 PRO CB C 6.399 -6.384 -0.222 1.00 . A A . 4 PRO CB 1 1 3 653 1 1 4 PRO CD C 4.650 -6.625 -1.841 1.00 . A A . 4 PRO CD 1 1 3 654 1 1 4 PRO CG C 5.954 -7.211 -1.376 1.00 . A A . 4 PRO CG 1 1 3 655 1 1 4 PRO HA H 4.869 -6.270 1.314 1.00 . A A . 4 PRO HA 1 1 3 656 1 1 4 PRO HB2 H 7.047 -5.579 -0.538 1.00 . A A . 4 PRO HB2 1 1 3 657 1 1 4 PRO HB3 H 6.902 -6.981 0.524 1.00 . A A . 4 PRO HB3 1 1 3 658 1 1 4 PRO HD2 H 4.743 -5.846 -2.582 1.00 . A A . 4 PRO HD2 1 1 3 659 1 1 4 PRO HD3 H 3.988 -7.397 -2.203 1.00 . A A . 4 PRO HD3 1 1 3 660 1 1 4 PRO HG2 H 6.690 -7.166 -2.164 1.00 . A A . 4 PRO HG2 1 1 3 661 1 1 4 PRO HG3 H 5.813 -8.233 -1.058 1.00 . A A . 4 PRO HG3 1 1 3 662 1 1 4 PRO N N 4.086 -6.042 -0.639 1.00 . A A . 4 PRO N 1 1 3 663 1 1 4 PRO O O 5.879 -3.591 -0.217 1.00 . A A . 4 PRO O 1 1 3 664 1 1 5 ARG C C 5.848 -1.993 2.900 1.00 . A A . 5 ARG C 1 1 3 665 1 1 5 ARG CA C 4.729 -2.372 1.919 1.00 . A A . 5 ARG CA 1 1 3 666 1 1 5 ARG CB C 3.370 -1.932 2.448 1.00 . A A . 5 ARG CB 1 1 3 667 1 1 5 ARG CD C 1.714 -1.818 4.316 1.00 . A A . 5 ARG CD 1 1 3 668 1 1 5 ARG CG C 3.002 -2.451 3.831 1.00 . A A . 5 ARG CG 1 1 3 669 1 1 5 ARG CZ C 0.988 0.484 4.881 1.00 . A A . 5 ARG CZ 1 1 3 670 1 1 5 ARG H H 4.280 -4.396 2.296 1.00 . A A . 5 ARG H 1 1 3 671 1 1 5 ARG HA H 4.913 -1.871 0.980 1.00 . A A . 5 ARG HA 1 1 3 672 1 1 5 ARG HB2 H 3.355 -0.853 2.476 1.00 . A A . 5 ARG HB2 1 1 3 673 1 1 5 ARG HB3 H 2.613 -2.260 1.751 1.00 . A A . 5 ARG HB3 1 1 3 674 1 1 5 ARG HD2 H 0.898 -2.154 3.692 1.00 . A A . 5 ARG HD2 1 1 3 675 1 1 5 ARG HD3 H 1.539 -2.122 5.336 1.00 . A A . 5 ARG HD3 1 1 3 676 1 1 5 ARG HE H 2.496 0.027 3.683 1.00 . A A . 5 ARG HE 1 1 3 677 1 1 5 ARG HG2 H 2.860 -3.520 3.775 1.00 . A A . 5 ARG HG2 1 1 3 678 1 1 5 ARG HG3 H 3.796 -2.217 4.524 1.00 . A A . 5 ARG HG3 1 1 3 679 1 1 5 ARG HH11 H -0.017 -0.942 5.954 1.00 . A A . 5 ARG HH11 1 1 3 680 1 1 5 ARG HH12 H -0.571 0.631 6.216 1.00 . A A . 5 ARG HH12 1 1 3 681 1 1 5 ARG HH21 H 1.823 2.152 4.027 1.00 . A A . 5 ARG HH21 1 1 3 682 1 1 5 ARG HH22 H 0.544 2.469 5.121 1.00 . A A . 5 ARG HH22 1 1 3 683 1 1 5 ARG N N 4.719 -3.791 1.661 1.00 . A A . 5 ARG N 1 1 3 684 1 1 5 ARG NE N 1.789 -0.355 4.263 1.00 . A A . 5 ARG NE 1 1 3 685 1 1 5 ARG NH1 N 0.080 0.035 5.743 1.00 . A A . 5 ARG NH1 1 1 3 686 1 1 5 ARG NH2 N 1.121 1.790 4.664 1.00 . A A . 5 ARG NH2 1 1 3 687 1 1 5 ARG O O 6.724 -2.829 3.197 1.00 . A A . 5 ARG O 1 1 3 688 1 1 6 GLY C C 6.897 1.207 4.538 1.00 . A A . 6 GLY C 1 1 3 689 1 1 6 GLY CA C 6.851 -0.312 4.331 1.00 . A A . 6 GLY CA 1 1 3 690 1 1 6 GLY H H 5.140 -0.123 3.073 1.00 . A A . 6 GLY H 1 1 3 691 1 1 6 GLY HA2 H 6.645 -0.780 5.282 1.00 . A A . 6 GLY HA2 1 1 3 692 1 1 6 GLY HA3 H 7.819 -0.646 3.988 1.00 . A A . 6 GLY HA3 1 1 3 693 1 1 6 GLY N N 5.843 -0.748 3.375 1.00 . A A . 6 GLY N 1 1 3 694 1 1 6 GLY O O 7.977 1.766 4.732 1.00 . A A . 6 GLY O 1 1 3 695 1 1 7 SER C C 6.357 4.109 3.659 1.00 . A A . 7 SER C 1 1 3 696 1 1 7 SER CA C 5.561 3.299 4.706 1.00 . A A . 7 SER CA 1 1 3 697 1 1 7 SER CB C 5.964 3.679 6.152 1.00 . A A . 7 SER CB 1 1 3 698 1 1 7 SER H H 4.904 1.363 4.274 1.00 . A A . 7 SER H 1 1 3 699 1 1 7 SER HA H 4.513 3.516 4.562 1.00 . A A . 7 SER HA 1 1 3 700 1 1 7 SER HB2 H 5.589 2.933 6.836 1.00 . A A . 7 SER HB2 1 1 3 701 1 1 7 SER HB3 H 7.042 3.699 6.214 1.00 . A A . 7 SER HB3 1 1 3 702 1 1 7 SER HG H 5.334 5.516 5.770 1.00 . A A . 7 SER HG 1 1 3 703 1 1 7 SER N N 5.729 1.854 4.487 1.00 . A A . 7 SER N 1 1 3 704 1 1 7 SER O O 7.529 4.445 3.863 1.00 . A A . 7 SER O 1 1 3 705 1 1 7 SER OG O 5.457 4.958 6.551 1.00 . A A . 7 SER OG 1 1 3 706 1 1 8 SER C C 5.362 5.666 0.475 1.00 . A A . 8 SER C 1 1 3 707 1 1 8 SER CA C 6.409 5.072 1.425 1.00 . A A . 8 SER CA 1 1 3 708 1 1 8 SER CB C 7.308 4.096 0.621 1.00 . A A . 8 SER CB 1 1 3 709 1 1 8 SER H H 4.809 4.101 2.392 1.00 . A A . 8 SER H 1 1 3 710 1 1 8 SER HA H 7.026 5.852 1.843 1.00 . A A . 8 SER HA 1 1 3 711 1 1 8 SER HB2 H 6.691 3.338 0.163 1.00 . A A . 8 SER HB2 1 1 3 712 1 1 8 SER HB3 H 7.824 4.646 -0.153 1.00 . A A . 8 SER HB3 1 1 3 713 1 1 8 SER HG H 8.139 3.819 2.339 1.00 . A A . 8 SER HG 1 1 3 714 1 1 8 SER N N 5.749 4.364 2.518 1.00 . A A . 8 SER N 1 1 3 715 1 1 8 SER O O 4.375 5.011 0.167 1.00 . A A . 8 SER O 1 1 3 716 1 1 8 SER OG O 8.277 3.451 1.452 1.00 . A A . 8 SER OG 1 1 3 717 1 1 9 PRO C C 4.668 6.700 -2.295 1.00 . A A . 9 PRO C 1 1 3 718 1 1 9 PRO CA C 4.662 7.512 -0.994 1.00 . A A . 9 PRO CA 1 1 3 719 1 1 9 PRO CB C 5.234 8.916 -1.228 1.00 . A A . 9 PRO CB 1 1 3 720 1 1 9 PRO CD C 6.586 7.852 0.458 1.00 . A A . 9 PRO CD 1 1 3 721 1 1 9 PRO CG C 6.588 8.913 -0.598 1.00 . A A . 9 PRO CG 1 1 3 722 1 1 9 PRO HA H 3.646 7.572 -0.634 1.00 . A A . 9 PRO HA 1 1 3 723 1 1 9 PRO HB2 H 5.295 9.105 -2.290 1.00 . A A . 9 PRO HB2 1 1 3 724 1 1 9 PRO HB3 H 4.588 9.650 -0.769 1.00 . A A . 9 PRO HB3 1 1 3 725 1 1 9 PRO HD2 H 7.550 7.368 0.500 1.00 . A A . 9 PRO HD2 1 1 3 726 1 1 9 PRO HD3 H 6.329 8.274 1.418 1.00 . A A . 9 PRO HD3 1 1 3 727 1 1 9 PRO HG2 H 7.339 8.689 -1.340 1.00 . A A . 9 PRO HG2 1 1 3 728 1 1 9 PRO HG3 H 6.779 9.879 -0.155 1.00 . A A . 9 PRO HG3 1 1 3 729 1 1 9 PRO N N 5.551 6.913 0.006 1.00 . A A . 9 PRO N 1 1 3 730 1 1 9 PRO O O 3.661 6.621 -3.009 1.00 . A A . 9 PRO O 1 1 3 731 1 1 10 GLY C C 5.454 3.848 -3.408 1.00 . A A . 10 GLY C 1 1 3 732 1 1 10 GLY CA C 5.886 5.253 -3.738 1.00 . A A . 10 GLY CA 1 1 3 733 1 1 10 GLY H H 6.565 6.198 -1.992 1.00 . A A . 10 GLY H 1 1 3 734 1 1 10 GLY HA2 H 5.250 5.652 -4.514 1.00 . A A . 10 GLY HA2 1 1 3 735 1 1 10 GLY HA3 H 6.908 5.235 -4.085 1.00 . A A . 10 GLY HA3 1 1 3 736 1 1 10 GLY N N 5.793 6.087 -2.585 1.00 . A A . 10 GLY N 1 1 3 737 1 1 10 GLY O O 6.011 3.226 -2.502 1.00 . A A . 10 GLY O 1 1 3 738 1 1 11 GLY C C 3.077 1.827 -2.665 1.00 . A A . 11 GLY C 1 1 3 739 1 1 11 GLY CA C 3.938 2.022 -3.900 1.00 . A A . 11 GLY CA 1 1 3 740 1 1 11 GLY H H 3.974 3.967 -4.725 1.00 . A A . 11 GLY H 1 1 3 741 1 1 11 GLY HA2 H 3.351 1.751 -4.765 1.00 . A A . 11 GLY HA2 1 1 3 742 1 1 11 GLY HA3 H 4.788 1.359 -3.844 1.00 . A A . 11 GLY HA3 1 1 3 743 1 1 11 GLY N N 4.420 3.379 -4.079 1.00 . A A . 11 GLY N 1 1 3 744 1 1 11 GLY O O 1.904 1.496 -2.772 1.00 . A A . 11 GLY O 1 1 3 745 1 1 12 ASP C C 1.777 2.785 -0.045 1.00 . A A . 12 ASP C 1 1 3 746 1 1 12 ASP CA C 2.999 1.870 -0.203 1.00 . A A . 12 ASP CA 1 1 3 747 1 1 12 ASP CB C 4.009 2.102 0.913 1.00 . A A . 12 ASP CB 1 1 3 748 1 1 12 ASP CG C 3.451 1.970 2.309 1.00 . A A . 12 ASP CG 1 1 3 749 1 1 12 ASP H H 4.592 2.377 -1.550 1.00 . A A . 12 ASP H 1 1 3 750 1 1 12 ASP HA H 2.661 0.845 -0.159 1.00 . A A . 12 ASP HA 1 1 3 751 1 1 12 ASP HB2 H 4.802 1.377 0.811 1.00 . A A . 12 ASP HB2 1 1 3 752 1 1 12 ASP HB3 H 4.425 3.092 0.800 1.00 . A A . 12 ASP HB3 1 1 3 753 1 1 12 ASP N N 3.659 2.062 -1.510 1.00 . A A . 12 ASP N 1 1 3 754 1 1 12 ASP O O 0.793 2.423 0.591 1.00 . A A . 12 ASP O 1 1 3 755 1 1 12 ASP OD1 O 2.848 2.925 2.831 1.00 . A A . 12 ASP OD1 1 1 3 756 1 1 12 ASP OD2 O 3.694 0.945 2.947 1.00 . A A . 12 ASP OD2 1 1 3 757 1 1 13 LYS C C -0.463 4.211 -1.418 1.00 . A A . 13 LYS C 1 1 3 758 1 1 13 LYS CA C 0.686 4.855 -0.651 1.00 . A A . 13 LYS CA 1 1 3 759 1 1 13 LYS CB C 1.042 6.199 -1.283 1.00 . A A . 13 LYS CB 1 1 3 760 1 1 13 LYS CD C -0.736 7.478 -0.051 1.00 . A A . 13 LYS CD 1 1 3 761 1 1 13 LYS CE C -1.871 8.471 -0.165 1.00 . A A . 13 LYS CE 1 1 3 762 1 1 13 LYS CG C -0.131 7.161 -1.407 1.00 . A A . 13 LYS CG 1 1 3 763 1 1 13 LYS H H 2.692 4.245 -1.026 1.00 . A A . 13 LYS H 1 1 3 764 1 1 13 LYS HA H 0.380 5.010 0.373 1.00 . A A . 13 LYS HA 1 1 3 765 1 1 13 LYS HB2 H 1.801 6.670 -0.677 1.00 . A A . 13 LYS HB2 1 1 3 766 1 1 13 LYS HB3 H 1.444 6.023 -2.269 1.00 . A A . 13 LYS HB3 1 1 3 767 1 1 13 LYS HD2 H -1.119 6.566 0.384 1.00 . A A . 13 LYS HD2 1 1 3 768 1 1 13 LYS HD3 H 0.031 7.889 0.587 1.00 . A A . 13 LYS HD3 1 1 3 769 1 1 13 LYS HE2 H -2.586 8.083 -0.876 1.00 . A A . 13 LYS HE2 1 1 3 770 1 1 13 LYS HE3 H -2.338 8.569 0.803 1.00 . A A . 13 LYS HE3 1 1 3 771 1 1 13 LYS HG2 H 0.177 8.071 -1.895 1.00 . A A . 13 LYS HG2 1 1 3 772 1 1 13 LYS HG3 H -0.886 6.684 -2.013 1.00 . A A . 13 LYS HG3 1 1 3 773 1 1 13 LYS HZ1 H -2.218 10.459 -0.666 1.00 . A A . 13 LYS HZ1 1 1 3 774 1 1 13 LYS HZ2 H -0.985 9.764 -1.575 1.00 . A A . 13 LYS HZ2 1 1 3 775 1 1 13 LYS HZ3 H -0.717 10.200 0.028 1.00 . A A . 13 LYS HZ3 1 1 3 776 1 1 13 LYS N N 1.836 3.962 -0.639 1.00 . A A . 13 LYS N 1 1 3 777 1 1 13 LYS NZ N -1.416 9.799 -0.628 1.00 . A A . 13 LYS NZ 1 1 3 778 1 1 13 LYS O O -1.619 4.287 -1.019 1.00 . A A . 13 LYS O 1 1 3 779 1 1 14 LEU C C -1.646 1.653 -2.590 1.00 . A A . 14 LEU C 1 1 3 780 1 1 14 LEU CA C -1.098 2.860 -3.319 1.00 . A A . 14 LEU CA 1 1 3 781 1 1 14 LEU CB C -0.511 2.430 -4.681 1.00 . A A . 14 LEU CB 1 1 3 782 1 1 14 LEU CD1 C 0.752 4.565 -5.293 1.00 . A A . 14 LEU CD1 1 1 3 783 1 1 14 LEU CD2 C 0.179 2.876 -7.046 1.00 . A A . 14 LEU CD2 1 1 3 784 1 1 14 LEU CG C -0.264 3.518 -5.745 1.00 . A A . 14 LEU CG 1 1 3 785 1 1 14 LEU H H 0.828 3.463 -2.720 1.00 . A A . 14 LEU H 1 1 3 786 1 1 14 LEU HA H -1.909 3.553 -3.490 1.00 . A A . 14 LEU HA 1 1 3 787 1 1 14 LEU HB2 H 0.433 1.941 -4.492 1.00 . A A . 14 LEU HB2 1 1 3 788 1 1 14 LEU HB3 H -1.183 1.698 -5.105 1.00 . A A . 14 LEU HB3 1 1 3 789 1 1 14 LEU HD11 H 0.888 5.298 -6.075 1.00 . A A . 14 LEU HD11 1 1 3 790 1 1 14 LEU HD12 H 1.697 4.086 -5.081 1.00 . A A . 14 LEU HD12 1 1 3 791 1 1 14 LEU HD13 H 0.390 5.055 -4.401 1.00 . A A . 14 LEU HD13 1 1 3 792 1 1 14 LEU HD21 H 0.368 3.643 -7.782 1.00 . A A . 14 LEU HD21 1 1 3 793 1 1 14 LEU HD22 H -0.599 2.219 -7.406 1.00 . A A . 14 LEU HD22 1 1 3 794 1 1 14 LEU HD23 H 1.082 2.306 -6.880 1.00 . A A . 14 LEU HD23 1 1 3 795 1 1 14 LEU HG H -1.206 4.010 -5.930 1.00 . A A . 14 LEU HG 1 1 3 796 1 1 14 LEU N N -0.122 3.535 -2.492 1.00 . A A . 14 LEU N 1 1 3 797 1 1 14 LEU O O -2.743 1.211 -2.859 1.00 . A A . 14 LEU O 1 1 3 798 1 1 15 TRP C C -2.445 0.419 -0.012 1.00 . A A . 15 TRP C 1 1 3 799 1 1 15 TRP CA C -1.255 -0.021 -0.843 1.00 . A A . 15 TRP CA 1 1 3 800 1 1 15 TRP CB C -0.106 -0.379 0.096 1.00 . A A . 15 TRP CB 1 1 3 801 1 1 15 TRP CD1 C 0.677 -2.722 0.505 1.00 . A A . 15 TRP CD1 1 1 3 802 1 1 15 TRP CD2 C -1.038 -2.162 1.784 1.00 . A A . 15 TRP CD2 1 1 3 803 1 1 15 TRP CE2 C -0.663 -3.471 2.102 1.00 . A A . 15 TRP CE2 1 1 3 804 1 1 15 TRP CE3 C -2.097 -1.597 2.456 1.00 . A A . 15 TRP CE3 1 1 3 805 1 1 15 TRP CG C -0.151 -1.706 0.762 1.00 . A A . 15 TRP CG 1 1 3 806 1 1 15 TRP CH2 C -2.366 -3.616 3.708 1.00 . A A . 15 TRP CH2 1 1 3 807 1 1 15 TRP CZ2 C -1.320 -4.217 3.073 1.00 . A A . 15 TRP CZ2 1 1 3 808 1 1 15 TRP CZ3 C -2.747 -2.322 3.399 1.00 . A A . 15 TRP CZ3 1 1 3 809 1 1 15 TRP H H 0.042 1.493 -1.557 1.00 . A A . 15 TRP H 1 1 3 810 1 1 15 TRP HA H -1.477 -0.847 -1.499 1.00 . A A . 15 TRP HA 1 1 3 811 1 1 15 TRP HB2 H 0.818 -0.361 -0.450 1.00 . A A . 15 TRP HB2 1 1 3 812 1 1 15 TRP HB3 H -0.058 0.375 0.869 1.00 . A A . 15 TRP HB3 1 1 3 813 1 1 15 TRP HD1 H 1.462 -2.651 -0.230 1.00 . A A . 15 TRP HD1 1 1 3 814 1 1 15 TRP HE1 H 0.899 -4.630 1.298 1.00 . A A . 15 TRP HE1 1 1 3 815 1 1 15 TRP HE3 H -2.417 -0.593 2.229 1.00 . A A . 15 TRP HE3 1 1 3 816 1 1 15 TRP HH2 H -2.938 -4.128 4.465 1.00 . A A . 15 TRP HH2 1 1 3 817 1 1 15 TRP HZ2 H -1.028 -5.227 3.321 1.00 . A A . 15 TRP HZ2 1 1 3 818 1 1 15 TRP HZ3 H -3.583 -1.873 3.902 1.00 . A A . 15 TRP HZ3 1 1 3 819 1 1 15 TRP N N -0.857 1.117 -1.671 1.00 . A A . 15 TRP N 1 1 3 820 1 1 15 TRP NE1 N 0.397 -3.783 1.313 1.00 . A A . 15 TRP NE1 1 1 3 821 1 1 15 TRP O O -3.496 -0.247 0.048 1.00 . A A . 15 TRP O 1 1 3 822 1 1 16 GLN C C -4.510 2.629 0.662 1.00 . A A . 16 GLN C 1 1 3 823 1 1 16 GLN CA C -3.265 2.225 1.425 1.00 . A A . 16 GLN CA 1 1 3 824 1 1 16 GLN CB C -2.637 3.441 2.093 1.00 . A A . 16 GLN CB 1 1 3 825 1 1 16 GLN CD C -2.159 2.372 4.286 1.00 . A A . 16 GLN CD 1 1 3 826 1 1 16 GLN CG C -1.567 3.068 3.086 1.00 . A A . 16 GLN CG 1 1 3 827 1 1 16 GLN H H -1.431 2.057 0.413 1.00 . A A . 16 GLN H 1 1 3 828 1 1 16 GLN HA H -3.526 1.519 2.198 1.00 . A A . 16 GLN HA 1 1 3 829 1 1 16 GLN HB2 H -2.198 4.070 1.332 1.00 . A A . 16 GLN HB2 1 1 3 830 1 1 16 GLN HB3 H -3.406 3.995 2.611 1.00 . A A . 16 GLN HB3 1 1 3 831 1 1 16 GLN HE21 H -2.319 4.091 5.243 1.00 . A A . 16 GLN HE21 1 1 3 832 1 1 16 GLN HE22 H -2.890 2.728 6.104 1.00 . A A . 16 GLN HE22 1 1 3 833 1 1 16 GLN HG2 H -0.882 2.382 2.602 1.00 . A A . 16 GLN HG2 1 1 3 834 1 1 16 GLN HG3 H -1.044 3.955 3.412 1.00 . A A . 16 GLN HG3 1 1 3 835 1 1 16 GLN N N -2.282 1.589 0.567 1.00 . A A . 16 GLN N 1 1 3 836 1 1 16 GLN NE2 N -2.480 3.125 5.303 1.00 . A A . 16 GLN NE2 1 1 3 837 1 1 16 GLN O O -5.519 2.991 1.250 1.00 . A A . 16 GLN O 1 1 3 838 1 1 16 GLN OE1 O -2.304 1.161 4.301 1.00 . A A . 16 GLN OE1 1 1 3 839 1 1 17 ILE C C -5.958 1.643 -2.296 1.00 . A A . 17 ILE C 1 1 3 840 1 1 17 ILE CA C -5.514 2.912 -1.505 1.00 . A A . 17 ILE CA 1 1 3 841 1 1 17 ILE CB C -5.073 4.122 -2.447 1.00 . A A . 17 ILE CB 1 1 3 842 1 1 17 ILE CD1 C -5.667 5.903 -0.659 1.00 . A A . 17 ILE CD1 1 1 3 843 1 1 17 ILE CG1 C -4.611 5.337 -1.600 1.00 . A A . 17 ILE CG1 1 1 3 844 1 1 17 ILE CG2 C -6.175 4.570 -3.399 1.00 . A A . 17 ILE CG2 1 1 3 845 1 1 17 ILE H H -3.592 2.244 -1.045 1.00 . A A . 17 ILE H 1 1 3 846 1 1 17 ILE HA H -6.337 3.215 -0.880 1.00 . A A . 17 ILE HA 1 1 3 847 1 1 17 ILE HB H -4.227 3.803 -3.041 1.00 . A A . 17 ILE HB 1 1 3 848 1 1 17 ILE HD11 H -6.539 6.193 -1.227 1.00 . A A . 17 ILE HD11 1 1 3 849 1 1 17 ILE HD12 H -5.268 6.768 -0.150 1.00 . A A . 17 ILE HD12 1 1 3 850 1 1 17 ILE HD13 H -5.944 5.155 0.069 1.00 . A A . 17 ILE HD13 1 1 3 851 1 1 17 ILE HG12 H -3.768 5.043 -0.995 1.00 . A A . 17 ILE HG12 1 1 3 852 1 1 17 ILE HG13 H -4.303 6.128 -2.269 1.00 . A A . 17 ILE HG13 1 1 3 853 1 1 17 ILE HG21 H -5.825 5.396 -4.001 1.00 . A A . 17 ILE HG21 1 1 3 854 1 1 17 ILE HG22 H -7.029 4.879 -2.817 1.00 . A A . 17 ILE HG22 1 1 3 855 1 1 17 ILE HG23 H -6.457 3.746 -4.037 1.00 . A A . 17 ILE HG23 1 1 3 856 1 1 17 ILE N N -4.430 2.556 -0.637 1.00 . A A . 17 ILE N 1 1 3 857 1 1 17 ILE O O -6.660 1.706 -3.302 1.00 . A A . 17 ILE O 1 1 3 858 1 1 18 TYR C C -6.268 -1.918 -1.487 1.00 . A A . 18 TYR C 1 1 3 859 1 1 18 TYR CA C -5.906 -0.771 -2.457 1.00 . A A . 18 TYR CA 1 1 3 860 1 1 18 TYR CB C -4.745 -1.095 -3.430 1.00 . A A . 18 TYR CB 1 1 3 861 1 1 18 TYR CD1 C -3.133 -2.710 -2.437 1.00 . A A . 18 TYR CD1 1 1 3 862 1 1 18 TYR CD2 C -4.405 -3.436 -4.290 1.00 . A A . 18 TYR CD2 1 1 3 863 1 1 18 TYR CE1 C -2.466 -3.911 -2.405 1.00 . A A . 18 TYR CE1 1 1 3 864 1 1 18 TYR CE2 C -3.761 -4.650 -4.263 1.00 . A A . 18 TYR CE2 1 1 3 865 1 1 18 TYR CG C -4.103 -2.454 -3.369 1.00 . A A . 18 TYR CG 1 1 3 866 1 1 18 TYR CZ C -2.790 -4.883 -3.322 1.00 . A A . 18 TYR CZ 1 1 3 867 1 1 18 TYR H H -5.108 0.475 -0.927 1.00 . A A . 18 TYR H 1 1 3 868 1 1 18 TYR HA H -6.789 -0.575 -3.048 1.00 . A A . 18 TYR HA 1 1 3 869 1 1 18 TYR HB2 H -5.067 -0.960 -4.446 1.00 . A A . 18 TYR HB2 1 1 3 870 1 1 18 TYR HB3 H -3.968 -0.366 -3.246 1.00 . A A . 18 TYR HB3 1 1 3 871 1 1 18 TYR HD1 H -2.947 -1.921 -1.724 1.00 . A A . 18 TYR HD1 1 1 3 872 1 1 18 TYR HD2 H -5.170 -3.249 -5.028 1.00 . A A . 18 TYR HD2 1 1 3 873 1 1 18 TYR HE1 H -1.708 -4.086 -1.654 1.00 . A A . 18 TYR HE1 1 1 3 874 1 1 18 TYR HE2 H -4.017 -5.413 -4.983 1.00 . A A . 18 TYR HE2 1 1 3 875 1 1 18 TYR HH H -1.849 -6.233 -4.230 1.00 . A A . 18 TYR HH 1 1 3 876 1 1 18 TYR N N -5.601 0.480 -1.775 1.00 . A A . 18 TYR N 1 1 3 877 1 1 18 TYR O O -7.260 -2.622 -1.697 1.00 . A A . 18 TYR O 1 1 3 878 1 1 18 TYR OH O -2.126 -6.081 -3.316 1.00 . A A . 18 TYR OH 1 1 3 879 1 1 19 LEU C C -6.325 -2.585 1.840 1.00 . A A . 19 LEU C 1 1 3 880 1 1 19 LEU CA C -5.767 -3.138 0.560 1.00 . A A . 19 LEU CA 1 1 3 881 1 1 19 LEU CB C -4.522 -3.950 0.866 1.00 . A A . 19 LEU CB 1 1 3 882 1 1 19 LEU CD1 C -2.975 -5.834 0.445 1.00 . A A . 19 LEU CD1 1 1 3 883 1 1 19 LEU CD2 C -5.422 -6.207 0.367 1.00 . A A . 19 LEU CD2 1 1 3 884 1 1 19 LEU CG C -4.309 -5.223 0.068 1.00 . A A . 19 LEU CG 1 1 3 885 1 1 19 LEU H H -4.711 -1.507 -0.303 1.00 . A A . 19 LEU H 1 1 3 886 1 1 19 LEU HA H -6.503 -3.796 0.126 1.00 . A A . 19 LEU HA 1 1 3 887 1 1 19 LEU HB2 H -3.676 -3.307 0.675 1.00 . A A . 19 LEU HB2 1 1 3 888 1 1 19 LEU HB3 H -4.530 -4.201 1.916 1.00 . A A . 19 LEU HB3 1 1 3 889 1 1 19 LEU HD11 H -2.206 -5.095 0.269 1.00 . A A . 19 LEU HD11 1 1 3 890 1 1 19 LEU HD12 H -2.789 -6.715 -0.150 1.00 . A A . 19 LEU HD12 1 1 3 891 1 1 19 LEU HD13 H -2.988 -6.088 1.494 1.00 . A A . 19 LEU HD13 1 1 3 892 1 1 19 LEU HD21 H -5.235 -7.138 -0.146 1.00 . A A . 19 LEU HD21 1 1 3 893 1 1 19 LEU HD22 H -6.366 -5.794 0.043 1.00 . A A . 19 LEU HD22 1 1 3 894 1 1 19 LEU HD23 H -5.446 -6.375 1.434 1.00 . A A . 19 LEU HD23 1 1 3 895 1 1 19 LEU HG H -4.312 -5.008 -0.990 1.00 . A A . 19 LEU HG 1 1 3 896 1 1 19 LEU N N -5.497 -2.086 -0.429 1.00 . A A . 19 LEU N 1 1 3 897 1 1 19 LEU O O -6.795 -3.331 2.692 1.00 . A A . 19 LEU O 1 1 3 898 1 1 20 ASN C C -8.006 0.108 2.772 1.00 . A A . 20 ASN C 1 1 3 899 1 1 20 ASN CA C -6.756 -0.634 3.141 1.00 . A A . 20 ASN CA 1 1 3 900 1 1 20 ASN CB C -5.699 0.298 3.744 1.00 . A A . 20 ASN CB 1 1 3 901 1 1 20 ASN CG C -6.255 1.257 4.793 1.00 . A A . 20 ASN CG 1 1 3 902 1 1 20 ASN H H -5.848 -0.777 1.265 1.00 . A A . 20 ASN H 1 1 3 903 1 1 20 ASN HA H -7.013 -1.391 3.867 1.00 . A A . 20 ASN HA 1 1 3 904 1 1 20 ASN HB2 H -4.953 -0.313 4.228 1.00 . A A . 20 ASN HB2 1 1 3 905 1 1 20 ASN HB3 H -5.225 0.858 2.955 1.00 . A A . 20 ASN HB3 1 1 3 906 1 1 20 ASN HD21 H -6.513 2.637 3.420 1.00 . A A . 20 ASN HD21 1 1 3 907 1 1 20 ASN HD22 H -6.976 3.087 5.023 1.00 . A A . 20 ASN HD22 1 1 3 908 1 1 20 ASN N N -6.246 -1.311 1.981 1.00 . A A . 20 ASN N 1 1 3 909 1 1 20 ASN ND2 N -6.617 2.443 4.377 1.00 . A A . 20 ASN ND2 1 1 3 910 1 1 20 ASN O O -9.102 -0.289 3.218 1.00 . A A . 20 ASN O 1 1 3 911 1 1 20 ASN OXT O -7.929 1.035 1.982 1.00 . A A . 20 ASN OXT 1 1 3 912 1 1 20 ASN OD1 O -6.323 0.935 5.976 1.00 . A A . 20 ASN OD1 1 1 4 913 1 1 1 SER C C 3.219 -3.461 -6.483 1.00 . A A . 1 SER C 1 1 4 914 1 1 1 SER CA C 1.938 -3.838 -7.224 1.00 . A A . 1 SER CA 1 1 4 915 1 1 1 SER CB C 0.768 -3.934 -6.245 1.00 . A A . 1 SER CB 1 1 4 916 1 1 1 SER H1 H 1.236 -5.440 -8.291 1.00 . A A . 1 SER H1 1 1 4 917 1 1 1 SER H2 H 2.413 -5.835 -7.120 1.00 . A A . 1 SER H2 1 1 4 918 1 1 1 SER H3 H 2.867 -5.091 -8.559 1.00 . A A . 1 SER H3 1 1 4 919 1 1 1 SER HA H 1.719 -3.106 -7.985 1.00 . A A . 1 SER HA 1 1 4 920 1 1 1 SER HB2 H 1.041 -4.579 -5.422 1.00 . A A . 1 SER HB2 1 1 4 921 1 1 1 SER HB3 H 0.528 -2.951 -5.867 1.00 . A A . 1 SER HB3 1 1 4 922 1 1 1 SER HG H -0.814 -3.764 -7.390 1.00 . A A . 1 SER HG 1 1 4 923 1 1 1 SER N N 2.122 -5.142 -7.838 1.00 . A A . 1 SER N 1 1 4 924 1 1 1 SER O O 4.018 -4.351 -6.174 1.00 . A A . 1 SER O 1 1 4 925 1 1 1 SER OG O -0.380 -4.470 -6.890 1.00 . A A . 1 SER OG 1 1 4 926 1 1 2 PRO C C 4.591 -2.384 -4.030 1.00 . A A . 2 PRO C 1 1 4 927 1 1 2 PRO CA C 4.617 -1.710 -5.415 1.00 . A A . 2 PRO CA 1 1 4 928 1 1 2 PRO CB C 4.400 -0.188 -5.265 1.00 . A A . 2 PRO CB 1 1 4 929 1 1 2 PRO CD C 2.698 -1.005 -6.726 1.00 . A A . 2 PRO CD 1 1 4 930 1 1 2 PRO CG C 3.001 0.061 -5.722 1.00 . A A . 2 PRO CG 1 1 4 931 1 1 2 PRO HA H 5.554 -1.914 -5.911 1.00 . A A . 2 PRO HA 1 1 4 932 1 1 2 PRO HB2 H 4.534 0.088 -4.230 1.00 . A A . 2 PRO HB2 1 1 4 933 1 1 2 PRO HB3 H 5.116 0.348 -5.870 1.00 . A A . 2 PRO HB3 1 1 4 934 1 1 2 PRO HD2 H 1.640 -1.222 -6.745 1.00 . A A . 2 PRO HD2 1 1 4 935 1 1 2 PRO HD3 H 3.041 -0.709 -7.708 1.00 . A A . 2 PRO HD3 1 1 4 936 1 1 2 PRO HG2 H 2.322 -0.014 -4.885 1.00 . A A . 2 PRO HG2 1 1 4 937 1 1 2 PRO HG3 H 2.927 1.039 -6.178 1.00 . A A . 2 PRO HG3 1 1 4 938 1 1 2 PRO N N 3.471 -2.149 -6.226 1.00 . A A . 2 PRO N 1 1 4 939 1 1 2 PRO O O 3.509 -2.721 -3.539 1.00 . A A . 2 PRO O 1 1 4 940 1 1 3 PRO C C 4.932 -2.702 -1.043 1.00 . A A . 3 PRO C 1 1 4 941 1 1 3 PRO CA C 5.882 -3.289 -2.096 1.00 . A A . 3 PRO CA 1 1 4 942 1 1 3 PRO CB C 7.329 -3.037 -1.688 1.00 . A A . 3 PRO CB 1 1 4 943 1 1 3 PRO CD C 7.103 -2.248 -3.938 1.00 . A A . 3 PRO CD 1 1 4 944 1 1 3 PRO CG C 8.065 -2.876 -2.968 1.00 . A A . 3 PRO CG 1 1 4 945 1 1 3 PRO HA H 5.708 -4.350 -2.190 1.00 . A A . 3 PRO HA 1 1 4 946 1 1 3 PRO HB2 H 7.379 -2.144 -1.083 1.00 . A A . 3 PRO HB2 1 1 4 947 1 1 3 PRO HB3 H 7.697 -3.881 -1.123 1.00 . A A . 3 PRO HB3 1 1 4 948 1 1 3 PRO HD2 H 7.228 -1.175 -3.952 1.00 . A A . 3 PRO HD2 1 1 4 949 1 1 3 PRO HD3 H 7.249 -2.662 -4.924 1.00 . A A . 3 PRO HD3 1 1 4 950 1 1 3 PRO HG2 H 8.921 -2.234 -2.818 1.00 . A A . 3 PRO HG2 1 1 4 951 1 1 3 PRO HG3 H 8.385 -3.842 -3.328 1.00 . A A . 3 PRO HG3 1 1 4 952 1 1 3 PRO N N 5.774 -2.613 -3.407 1.00 . A A . 3 PRO N 1 1 4 953 1 1 3 PRO O O 4.937 -1.488 -0.808 1.00 . A A . 3 PRO O 1 1 4 954 1 1 4 PRO C C 3.785 -2.733 1.898 1.00 . A A . 4 PRO C 1 1 4 955 1 1 4 PRO CA C 3.125 -3.108 0.571 1.00 . A A . 4 PRO CA 1 1 4 956 1 1 4 PRO CB C 2.208 -4.326 0.743 1.00 . A A . 4 PRO CB 1 1 4 957 1 1 4 PRO CD C 4.040 -5.013 -0.632 1.00 . A A . 4 PRO CD 1 1 4 958 1 1 4 PRO CG C 3.052 -5.498 0.392 1.00 . A A . 4 PRO CG 1 1 4 959 1 1 4 PRO HA H 2.552 -2.267 0.209 1.00 . A A . 4 PRO HA 1 1 4 960 1 1 4 PRO HB2 H 1.865 -4.376 1.766 1.00 . A A . 4 PRO HB2 1 1 4 961 1 1 4 PRO HB3 H 1.359 -4.238 0.081 1.00 . A A . 4 PRO HB3 1 1 4 962 1 1 4 PRO HD2 H 5.007 -5.464 -0.468 1.00 . A A . 4 PRO HD2 1 1 4 963 1 1 4 PRO HD3 H 3.679 -5.238 -1.623 1.00 . A A . 4 PRO HD3 1 1 4 964 1 1 4 PRO HG2 H 3.570 -5.853 1.272 1.00 . A A . 4 PRO HG2 1 1 4 965 1 1 4 PRO HG3 H 2.437 -6.284 -0.022 1.00 . A A . 4 PRO HG3 1 1 4 966 1 1 4 PRO N N 4.098 -3.548 -0.416 1.00 . A A . 4 PRO N 1 1 4 967 1 1 4 PRO O O 4.490 -3.554 2.510 1.00 . A A . 4 PRO O 1 1 4 968 1 1 5 ARG C C 5.639 -0.838 3.530 1.00 . A A . 5 ARG C 1 1 4 969 1 1 5 ARG CA C 4.101 -0.925 3.572 1.00 . A A . 5 ARG CA 1 1 4 970 1 1 5 ARG CB C 3.673 -1.762 4.807 1.00 . A A . 5 ARG CB 1 1 4 971 1 1 5 ARG CD C 1.493 -0.568 5.258 1.00 . A A . 5 ARG CD 1 1 4 972 1 1 5 ARG CG C 2.173 -1.905 5.033 1.00 . A A . 5 ARG CG 1 1 4 973 1 1 5 ARG CZ C -0.887 0.139 5.411 1.00 . A A . 5 ARG CZ 1 1 4 974 1 1 5 ARG H H 3.039 -0.898 1.731 1.00 . A A . 5 ARG H 1 1 4 975 1 1 5 ARG HA H 3.696 0.071 3.670 1.00 . A A . 5 ARG HA 1 1 4 976 1 1 5 ARG HB2 H 4.081 -2.756 4.698 1.00 . A A . 5 ARG HB2 1 1 4 977 1 1 5 ARG HB3 H 4.108 -1.314 5.688 1.00 . A A . 5 ARG HB3 1 1 4 978 1 1 5 ARG HD2 H 2.008 -0.033 6.043 1.00 . A A . 5 ARG HD2 1 1 4 979 1 1 5 ARG HD3 H 1.541 0.005 4.343 1.00 . A A . 5 ARG HD3 1 1 4 980 1 1 5 ARG HE H -0.104 -1.603 6.070 1.00 . A A . 5 ARG HE 1 1 4 981 1 1 5 ARG HG2 H 1.735 -2.371 4.163 1.00 . A A . 5 ARG HG2 1 1 4 982 1 1 5 ARG HG3 H 2.011 -2.533 5.896 1.00 . A A . 5 ARG HG3 1 1 4 983 1 1 5 ARG HH11 H 0.321 1.617 4.610 1.00 . A A . 5 ARG HH11 1 1 4 984 1 1 5 ARG HH12 H -1.342 1.991 4.690 1.00 . A A . 5 ARG HH12 1 1 4 985 1 1 5 ARG HH21 H -2.390 -1.005 6.223 1.00 . A A . 5 ARG HH21 1 1 4 986 1 1 5 ARG HH22 H -2.877 0.503 5.572 1.00 . A A . 5 ARG HH22 1 1 4 987 1 1 5 ARG N N 3.565 -1.481 2.317 1.00 . A A . 5 ARG N 1 1 4 988 1 1 5 ARG NE N 0.088 -0.743 5.632 1.00 . A A . 5 ARG NE 1 1 4 989 1 1 5 ARG NH1 N -0.616 1.325 4.869 1.00 . A A . 5 ARG NH1 1 1 4 990 1 1 5 ARG NH2 N -2.133 -0.146 5.773 1.00 . A A . 5 ARG NH2 1 1 4 991 1 1 5 ARG O O 6.277 -1.128 2.505 1.00 . A A . 5 ARG O 1 1 4 992 1 1 6 GLY C C 8.238 0.861 4.167 1.00 . A A . 6 GLY C 1 1 4 993 1 1 6 GLY CA C 7.659 -0.397 4.737 1.00 . A A . 6 GLY CA 1 1 4 994 1 1 6 GLY H H 5.677 -0.130 5.383 1.00 . A A . 6 GLY H 1 1 4 995 1 1 6 GLY HA2 H 7.928 -0.460 5.781 1.00 . A A . 6 GLY HA2 1 1 4 996 1 1 6 GLY HA3 H 8.076 -1.245 4.215 1.00 . A A . 6 GLY HA3 1 1 4 997 1 1 6 GLY N N 6.223 -0.437 4.629 1.00 . A A . 6 GLY N 1 1 4 998 1 1 6 GLY O O 7.622 1.920 4.240 1.00 . A A . 6 GLY O 1 1 4 999 1 1 7 SER C C 9.661 2.161 1.555 1.00 . A A . 7 SER C 1 1 4 1000 1 1 7 SER CA C 10.101 1.862 2.997 1.00 . A A . 7 SER CA 1 1 4 1001 1 1 7 SER CB C 11.575 1.523 3.056 1.00 . A A . 7 SER CB 1 1 4 1002 1 1 7 SER H H 9.807 -0.140 3.456 1.00 . A A . 7 SER H 1 1 4 1003 1 1 7 SER HA H 9.927 2.730 3.616 1.00 . A A . 7 SER HA 1 1 4 1004 1 1 7 SER HB2 H 12.134 2.236 2.468 1.00 . A A . 7 SER HB2 1 1 4 1005 1 1 7 SER HB3 H 11.914 1.547 4.081 1.00 . A A . 7 SER HB3 1 1 4 1006 1 1 7 SER HG H 12.569 -0.136 2.991 1.00 . A A . 7 SER HG 1 1 4 1007 1 1 7 SER N N 9.381 0.739 3.555 1.00 . A A . 7 SER N 1 1 4 1008 1 1 7 SER O O 10.388 2.798 0.784 1.00 . A A . 7 SER O 1 1 4 1009 1 1 7 SER OG O 11.792 0.215 2.536 1.00 . A A . 7 SER OG 1 1 4 1010 1 1 8 SER C C 6.802 2.935 -0.014 1.00 . A A . 8 SER C 1 1 4 1011 1 1 8 SER CA C 7.940 1.919 -0.102 1.00 . A A . 8 SER CA 1 1 4 1012 1 1 8 SER CB C 7.443 0.577 -0.674 1.00 . A A . 8 SER CB 1 1 4 1013 1 1 8 SER H H 7.941 1.238 1.871 1.00 . A A . 8 SER H 1 1 4 1014 1 1 8 SER HA H 8.721 2.306 -0.738 1.00 . A A . 8 SER HA 1 1 4 1015 1 1 8 SER HB2 H 8.276 -0.104 -0.753 1.00 . A A . 8 SER HB2 1 1 4 1016 1 1 8 SER HB3 H 6.709 0.159 -0.001 1.00 . A A . 8 SER HB3 1 1 4 1017 1 1 8 SER HG H 6.185 0.005 -1.979 1.00 . A A . 8 SER HG 1 1 4 1018 1 1 8 SER N N 8.482 1.711 1.204 1.00 . A A . 8 SER N 1 1 4 1019 1 1 8 SER O O 5.689 2.586 0.397 1.00 . A A . 8 SER O 1 1 4 1020 1 1 8 SER OG O 6.854 0.704 -1.973 1.00 . A A . 8 SER OG 1 1 4 1021 1 1 9 PRO C C 4.897 4.980 -1.244 1.00 . A A . 9 PRO C 1 1 4 1022 1 1 9 PRO CA C 6.056 5.276 -0.313 1.00 . A A . 9 PRO CA 1 1 4 1023 1 1 9 PRO CB C 6.812 6.532 -0.772 1.00 . A A . 9 PRO CB 1 1 4 1024 1 1 9 PRO CD C 8.374 4.740 -0.805 1.00 . A A . 9 PRO CD 1 1 4 1025 1 1 9 PRO CG C 8.243 6.210 -0.541 1.00 . A A . 9 PRO CG 1 1 4 1026 1 1 9 PRO HA H 5.679 5.415 0.688 1.00 . A A . 9 PRO HA 1 1 4 1027 1 1 9 PRO HB2 H 6.609 6.709 -1.818 1.00 . A A . 9 PRO HB2 1 1 4 1028 1 1 9 PRO HB3 H 6.497 7.384 -0.189 1.00 . A A . 9 PRO HB3 1 1 4 1029 1 1 9 PRO HD2 H 8.537 4.551 -1.855 1.00 . A A . 9 PRO HD2 1 1 4 1030 1 1 9 PRO HD3 H 9.174 4.322 -0.212 1.00 . A A . 9 PRO HD3 1 1 4 1031 1 1 9 PRO HG2 H 8.860 6.775 -1.222 1.00 . A A . 9 PRO HG2 1 1 4 1032 1 1 9 PRO HG3 H 8.508 6.433 0.483 1.00 . A A . 9 PRO HG3 1 1 4 1033 1 1 9 PRO N N 7.068 4.218 -0.365 1.00 . A A . 9 PRO N 1 1 4 1034 1 1 9 PRO O O 3.741 5.054 -0.846 1.00 . A A . 9 PRO O 1 1 4 1035 1 1 10 GLY C C 3.426 3.034 -3.049 1.00 . A A . 10 GLY C 1 1 4 1036 1 1 10 GLY CA C 4.201 4.262 -3.454 1.00 . A A . 10 GLY CA 1 1 4 1037 1 1 10 GLY H H 6.165 4.576 -2.738 1.00 . A A . 10 GLY H 1 1 4 1038 1 1 10 GLY HA2 H 3.511 5.089 -3.540 1.00 . A A . 10 GLY HA2 1 1 4 1039 1 1 10 GLY HA3 H 4.667 4.085 -4.411 1.00 . A A . 10 GLY HA3 1 1 4 1040 1 1 10 GLY N N 5.219 4.603 -2.479 1.00 . A A . 10 GLY N 1 1 4 1041 1 1 10 GLY O O 2.230 2.935 -3.301 1.00 . A A . 10 GLY O 1 1 4 1042 1 1 11 GLY C C 2.505 1.171 -0.816 1.00 . A A . 11 GLY C 1 1 4 1043 1 1 11 GLY CA C 3.470 0.908 -1.937 1.00 . A A . 11 GLY CA 1 1 4 1044 1 1 11 GLY H H 5.054 2.267 -2.195 1.00 . A A . 11 GLY H 1 1 4 1045 1 1 11 GLY HA2 H 2.933 0.462 -2.762 1.00 . A A . 11 GLY HA2 1 1 4 1046 1 1 11 GLY HA3 H 4.225 0.217 -1.593 1.00 . A A . 11 GLY HA3 1 1 4 1047 1 1 11 GLY N N 4.106 2.114 -2.390 1.00 . A A . 11 GLY N 1 1 4 1048 1 1 11 GLY O O 1.392 0.676 -0.833 1.00 . A A . 11 GLY O 1 1 4 1049 1 1 12 ASP C C 0.915 3.212 0.819 1.00 . A A . 12 ASP C 1 1 4 1050 1 1 12 ASP CA C 2.062 2.316 1.276 1.00 . A A . 12 ASP CA 1 1 4 1051 1 1 12 ASP CB C 2.856 2.976 2.401 1.00 . A A . 12 ASP CB 1 1 4 1052 1 1 12 ASP CG C 1.994 3.315 3.596 1.00 . A A . 12 ASP CG 1 1 4 1053 1 1 12 ASP H H 3.839 2.328 0.114 1.00 . A A . 12 ASP H 1 1 4 1054 1 1 12 ASP HA H 1.634 1.393 1.639 1.00 . A A . 12 ASP HA 1 1 4 1055 1 1 12 ASP HB2 H 3.615 2.278 2.724 1.00 . A A . 12 ASP HB2 1 1 4 1056 1 1 12 ASP HB3 H 3.323 3.878 2.034 1.00 . A A . 12 ASP HB3 1 1 4 1057 1 1 12 ASP N N 2.923 1.969 0.150 1.00 . A A . 12 ASP N 1 1 4 1058 1 1 12 ASP O O -0.216 3.094 1.312 1.00 . A A . 12 ASP O 1 1 4 1059 1 1 12 ASP OD1 O 1.754 2.437 4.440 1.00 . A A . 12 ASP OD1 1 1 4 1060 1 1 12 ASP OD2 O 1.541 4.468 3.725 1.00 . A A . 12 ASP OD2 1 1 4 1061 1 1 13 LYS C C -0.873 4.093 -1.394 1.00 . A A . 13 LYS C 1 1 4 1062 1 1 13 LYS CA C 0.194 4.943 -0.749 1.00 . A A . 13 LYS CA 1 1 4 1063 1 1 13 LYS CB C 0.808 5.844 -1.835 1.00 . A A . 13 LYS CB 1 1 4 1064 1 1 13 LYS CD C -0.977 7.636 -1.938 1.00 . A A . 13 LYS CD 1 1 4 1065 1 1 13 LYS CE C -2.063 8.235 -2.803 1.00 . A A . 13 LYS CE 1 1 4 1066 1 1 13 LYS CG C -0.235 6.562 -2.698 1.00 . A A . 13 LYS CG 1 1 4 1067 1 1 13 LYS H H 2.145 4.203 -0.414 1.00 . A A . 13 LYS H 1 1 4 1068 1 1 13 LYS HA H -0.252 5.568 0.009 1.00 . A A . 13 LYS HA 1 1 4 1069 1 1 13 LYS HB2 H 1.432 6.588 -1.363 1.00 . A A . 13 LYS HB2 1 1 4 1070 1 1 13 LYS HB3 H 1.420 5.233 -2.483 1.00 . A A . 13 LYS HB3 1 1 4 1071 1 1 13 LYS HD2 H -1.421 7.204 -1.054 1.00 . A A . 13 LYS HD2 1 1 4 1072 1 1 13 LYS HD3 H -0.280 8.411 -1.660 1.00 . A A . 13 LYS HD3 1 1 4 1073 1 1 13 LYS HE2 H -1.647 8.524 -3.756 1.00 . A A . 13 LYS HE2 1 1 4 1074 1 1 13 LYS HE3 H -2.795 7.460 -2.980 1.00 . A A . 13 LYS HE3 1 1 4 1075 1 1 13 LYS HG2 H 0.206 6.981 -3.587 1.00 . A A . 13 LYS HG2 1 1 4 1076 1 1 13 LYS HG3 H -0.954 5.818 -3.009 1.00 . A A . 13 LYS HG3 1 1 4 1077 1 1 13 LYS HZ1 H -3.481 9.758 -2.749 1.00 . A A . 13 LYS HZ1 1 1 4 1078 1 1 13 LYS HZ2 H -2.060 10.144 -1.943 1.00 . A A . 13 LYS HZ2 1 1 4 1079 1 1 13 LYS HZ3 H -3.166 9.073 -1.248 1.00 . A A . 13 LYS HZ3 1 1 4 1080 1 1 13 LYS N N 1.207 4.097 -0.133 1.00 . A A . 13 LYS N 1 1 4 1081 1 1 13 LYS NZ N -2.730 9.373 -2.143 1.00 . A A . 13 LYS NZ 1 1 4 1082 1 1 13 LYS O O -2.060 4.194 -1.055 1.00 . A A . 13 LYS O 1 1 4 1083 1 1 14 LEU C C -2.055 1.425 -2.196 1.00 . A A . 14 LEU C 1 1 4 1084 1 1 14 LEU CA C -1.353 2.444 -3.068 1.00 . A A . 14 LEU CA 1 1 4 1085 1 1 14 LEU CB C -0.641 1.756 -4.220 1.00 . A A . 14 LEU CB 1 1 4 1086 1 1 14 LEU CD1 C -2.231 2.394 -6.031 1.00 . A A . 14 LEU CD1 1 1 4 1087 1 1 14 LEU CD2 C -0.783 0.372 -6.293 1.00 . A A . 14 LEU CD2 1 1 4 1088 1 1 14 LEU CG C -1.551 1.232 -5.318 1.00 . A A . 14 LEU CG 1 1 4 1089 1 1 14 LEU H H 0.522 3.144 -2.467 1.00 . A A . 14 LEU H 1 1 4 1090 1 1 14 LEU HA H -2.095 3.114 -3.473 1.00 . A A . 14 LEU HA 1 1 4 1091 1 1 14 LEU HB2 H 0.054 2.458 -4.657 1.00 . A A . 14 LEU HB2 1 1 4 1092 1 1 14 LEU HB3 H -0.082 0.922 -3.822 1.00 . A A . 14 LEU HB3 1 1 4 1093 1 1 14 LEU HD11 H -2.837 2.013 -6.839 1.00 . A A . 14 LEU HD11 1 1 4 1094 1 1 14 LEU HD12 H -1.484 3.071 -6.421 1.00 . A A . 14 LEU HD12 1 1 4 1095 1 1 14 LEU HD13 H -2.858 2.940 -5.341 1.00 . A A . 14 LEU HD13 1 1 4 1096 1 1 14 LEU HD21 H -1.444 0.062 -7.089 1.00 . A A . 14 LEU HD21 1 1 4 1097 1 1 14 LEU HD22 H -0.408 -0.501 -5.778 1.00 . A A . 14 LEU HD22 1 1 4 1098 1 1 14 LEU HD23 H 0.044 0.931 -6.705 1.00 . A A . 14 LEU HD23 1 1 4 1099 1 1 14 LEU HG H -2.327 0.633 -4.865 1.00 . A A . 14 LEU HG 1 1 4 1100 1 1 14 LEU N N -0.444 3.235 -2.298 1.00 . A A . 14 LEU N 1 1 4 1101 1 1 14 LEU O O -3.157 1.028 -2.493 1.00 . A A . 14 LEU O 1 1 4 1102 1 1 15 TRP C C -3.289 0.648 0.361 1.00 . A A . 15 TRP C 1 1 4 1103 1 1 15 TRP CA C -1.975 0.079 -0.152 1.00 . A A . 15 TRP CA 1 1 4 1104 1 1 15 TRP CB C -1.009 -0.094 1.041 1.00 . A A . 15 TRP CB 1 1 4 1105 1 1 15 TRP CD1 C -0.207 -2.227 2.160 1.00 . A A . 15 TRP CD1 1 1 4 1106 1 1 15 TRP CD2 C -2.318 -1.740 2.659 1.00 . A A . 15 TRP CD2 1 1 4 1107 1 1 15 TRP CE2 C -1.972 -2.926 3.316 1.00 . A A . 15 TRP CE2 1 1 4 1108 1 1 15 TRP CE3 C -3.590 -1.244 2.826 1.00 . A A . 15 TRP CE3 1 1 4 1109 1 1 15 TRP CG C -1.169 -1.310 1.917 1.00 . A A . 15 TRP CG 1 1 4 1110 1 1 15 TRP CH2 C -4.124 -3.076 4.252 1.00 . A A . 15 TRP CH2 1 1 4 1111 1 1 15 TRP CZ2 C -2.875 -3.610 4.128 1.00 . A A . 15 TRP CZ2 1 1 4 1112 1 1 15 TRP CZ3 C -4.467 -1.907 3.606 1.00 . A A . 15 TRP CZ3 1 1 4 1113 1 1 15 TRP H H -0.503 1.368 -0.965 1.00 . A A . 15 TRP H 1 1 4 1114 1 1 15 TRP HA H -2.132 -0.861 -0.667 1.00 . A A . 15 TRP HA 1 1 4 1115 1 1 15 TRP HB2 H -0.008 -0.161 0.660 1.00 . A A . 15 TRP HB2 1 1 4 1116 1 1 15 TRP HB3 H -1.082 0.781 1.670 1.00 . A A . 15 TRP HB3 1 1 4 1117 1 1 15 TRP HD1 H 0.786 -2.157 1.740 1.00 . A A . 15 TRP HD1 1 1 4 1118 1 1 15 TRP HE1 H -0.158 -3.974 3.325 1.00 . A A . 15 TRP HE1 1 1 4 1119 1 1 15 TRP HE3 H -3.894 -0.331 2.335 1.00 . A A . 15 TRP HE3 1 1 4 1120 1 1 15 TRP HH2 H -4.888 -3.541 4.856 1.00 . A A . 15 TRP HH2 1 1 4 1121 1 1 15 TRP HZ2 H -2.620 -4.528 4.634 1.00 . A A . 15 TRP HZ2 1 1 4 1122 1 1 15 TRP HZ3 H -5.461 -1.510 3.700 1.00 . A A . 15 TRP HZ3 1 1 4 1123 1 1 15 TRP N N -1.413 1.030 -1.112 1.00 . A A . 15 TRP N 1 1 4 1124 1 1 15 TRP NE1 N -0.672 -3.200 3.004 1.00 . A A . 15 TRP NE1 1 1 4 1125 1 1 15 TRP O O -4.344 -0.013 0.296 1.00 . A A . 15 TRP O 1 1 4 1126 1 1 16 GLN C C -5.498 2.816 0.361 1.00 . A A . 16 GLN C 1 1 4 1127 1 1 16 GLN CA C -4.376 2.592 1.369 1.00 . A A . 16 GLN CA 1 1 4 1128 1 1 16 GLN CB C -3.942 3.912 2.001 1.00 . A A . 16 GLN CB 1 1 4 1129 1 1 16 GLN CD C -3.665 2.962 4.320 1.00 . A A . 16 GLN CD 1 1 4 1130 1 1 16 GLN CG C -3.017 3.738 3.190 1.00 . A A . 16 GLN CG 1 1 4 1131 1 1 16 GLN H H -2.386 2.389 0.689 1.00 . A A . 16 GLN H 1 1 4 1132 1 1 16 GLN HA H -4.732 1.946 2.156 1.00 . A A . 16 GLN HA 1 1 4 1133 1 1 16 GLN HB2 H -3.433 4.502 1.254 1.00 . A A . 16 GLN HB2 1 1 4 1134 1 1 16 GLN HB3 H -4.822 4.446 2.330 1.00 . A A . 16 GLN HB3 1 1 4 1135 1 1 16 GLN HE21 H -4.351 4.623 5.136 1.00 . A A . 16 GLN HE21 1 1 4 1136 1 1 16 GLN HE22 H -4.734 3.168 5.958 1.00 . A A . 16 GLN HE22 1 1 4 1137 1 1 16 GLN HG2 H -2.144 3.185 2.866 1.00 . A A . 16 GLN HG2 1 1 4 1138 1 1 16 GLN HG3 H -2.723 4.710 3.555 1.00 . A A . 16 GLN HG3 1 1 4 1139 1 1 16 GLN N N -3.234 1.902 0.784 1.00 . A A . 16 GLN N 1 1 4 1140 1 1 16 GLN NE2 N -4.307 3.646 5.216 1.00 . A A . 16 GLN NE2 1 1 4 1141 1 1 16 GLN O O -6.570 3.306 0.706 1.00 . A A . 16 GLN O 1 1 4 1142 1 1 16 GLN OE1 O -3.570 1.743 4.382 1.00 . A A . 16 GLN OE1 1 1 4 1143 1 1 17 ILE C C -6.580 1.142 -2.422 1.00 . A A . 17 ILE C 1 1 4 1144 1 1 17 ILE CA C -6.181 2.561 -1.923 1.00 . A A . 17 ILE CA 1 1 4 1145 1 1 17 ILE CB C -5.589 3.419 -3.090 1.00 . A A . 17 ILE CB 1 1 4 1146 1 1 17 ILE CD1 C -4.763 5.765 -3.627 1.00 . A A . 17 ILE CD1 1 1 4 1147 1 1 17 ILE CG1 C -5.360 4.851 -2.597 1.00 . A A . 17 ILE CG1 1 1 4 1148 1 1 17 ILE CG2 C -6.509 3.423 -4.309 1.00 . A A . 17 ILE CG2 1 1 4 1149 1 1 17 ILE H H -4.333 2.135 -1.074 1.00 . A A . 17 ILE H 1 1 4 1150 1 1 17 ILE HA H -7.050 3.075 -1.542 1.00 . A A . 17 ILE HA 1 1 4 1151 1 1 17 ILE HB H -4.629 3.012 -3.384 1.00 . A A . 17 ILE HB 1 1 4 1152 1 1 17 ILE HD11 H -4.695 6.761 -3.217 1.00 . A A . 17 ILE HD11 1 1 4 1153 1 1 17 ILE HD12 H -5.409 5.760 -4.492 1.00 . A A . 17 ILE HD12 1 1 4 1154 1 1 17 ILE HD13 H -3.782 5.405 -3.898 1.00 . A A . 17 ILE HD13 1 1 4 1155 1 1 17 ILE HG12 H -6.306 5.273 -2.294 1.00 . A A . 17 ILE HG12 1 1 4 1156 1 1 17 ILE HG13 H -4.696 4.826 -1.744 1.00 . A A . 17 ILE HG13 1 1 4 1157 1 1 17 ILE HG21 H -7.463 3.851 -4.039 1.00 . A A . 17 ILE HG21 1 1 4 1158 1 1 17 ILE HG22 H -6.656 2.409 -4.646 1.00 . A A . 17 ILE HG22 1 1 4 1159 1 1 17 ILE HG23 H -6.060 4.006 -5.099 1.00 . A A . 17 ILE HG23 1 1 4 1160 1 1 17 ILE N N -5.231 2.469 -0.867 1.00 . A A . 17 ILE N 1 1 4 1161 1 1 17 ILE O O -7.693 0.928 -2.889 1.00 . A A . 17 ILE O 1 1 4 1162 1 1 18 TYR C C -6.547 -2.161 -1.878 1.00 . A A . 18 TYR C 1 1 4 1163 1 1 18 TYR CA C -5.897 -1.154 -2.844 1.00 . A A . 18 TYR CA 1 1 4 1164 1 1 18 TYR CB C -4.586 -1.685 -3.547 1.00 . A A . 18 TYR CB 1 1 4 1165 1 1 18 TYR CD1 C -3.275 -2.466 -1.493 1.00 . A A . 18 TYR CD1 1 1 4 1166 1 1 18 TYR CD2 C -2.907 -3.569 -3.552 1.00 . A A . 18 TYR CD2 1 1 4 1167 1 1 18 TYR CE1 C -2.322 -3.278 -0.896 1.00 . A A . 18 TYR CE1 1 1 4 1168 1 1 18 TYR CE2 C -1.965 -4.388 -2.969 1.00 . A A . 18 TYR CE2 1 1 4 1169 1 1 18 TYR CG C -3.587 -2.594 -2.820 1.00 . A A . 18 TYR CG 1 1 4 1170 1 1 18 TYR CZ C -1.672 -4.238 -1.642 1.00 . A A . 18 TYR CZ 1 1 4 1171 1 1 18 TYR H H -4.851 0.355 -1.782 1.00 . A A . 18 TYR H 1 1 4 1172 1 1 18 TYR HA H -6.631 -0.989 -3.620 1.00 . A A . 18 TYR HA 1 1 4 1173 1 1 18 TYR HB2 H -4.844 -2.279 -4.396 1.00 . A A . 18 TYR HB2 1 1 4 1174 1 1 18 TYR HB3 H -4.033 -0.825 -3.895 1.00 . A A . 18 TYR HB3 1 1 4 1175 1 1 18 TYR HD1 H -3.801 -1.721 -0.914 1.00 . A A . 18 TYR HD1 1 1 4 1176 1 1 18 TYR HD2 H -3.138 -3.688 -4.600 1.00 . A A . 18 TYR HD2 1 1 4 1177 1 1 18 TYR HE1 H -2.093 -3.159 0.153 1.00 . A A . 18 TYR HE1 1 1 4 1178 1 1 18 TYR HE2 H -1.460 -5.138 -3.559 1.00 . A A . 18 TYR HE2 1 1 4 1179 1 1 18 TYR HH H 0.029 -5.108 -1.659 1.00 . A A . 18 TYR HH 1 1 4 1180 1 1 18 TYR N N -5.683 0.169 -2.267 1.00 . A A . 18 TYR N 1 1 4 1181 1 1 18 TYR O O -7.325 -3.016 -2.303 1.00 . A A . 18 TYR O 1 1 4 1182 1 1 18 TYR OH O -0.722 -5.048 -1.054 1.00 . A A . 18 TYR OH 1 1 4 1183 1 1 19 LEU C C -7.656 -2.221 1.435 1.00 . A A . 19 LEU C 1 1 4 1184 1 1 19 LEU CA C -6.829 -2.958 0.402 1.00 . A A . 19 LEU CA 1 1 4 1185 1 1 19 LEU CB C -5.743 -3.776 1.103 1.00 . A A . 19 LEU CB 1 1 4 1186 1 1 19 LEU CD1 C -4.036 -5.583 1.146 1.00 . A A . 19 LEU CD1 1 1 4 1187 1 1 19 LEU CD2 C -6.196 -5.958 0.035 1.00 . A A . 19 LEU CD2 1 1 4 1188 1 1 19 LEU CG C -5.137 -4.938 0.330 1.00 . A A . 19 LEU CG 1 1 4 1189 1 1 19 LEU H H -5.636 -1.335 -0.320 1.00 . A A . 19 LEU H 1 1 4 1190 1 1 19 LEU HA H -7.482 -3.637 -0.124 1.00 . A A . 19 LEU HA 1 1 4 1191 1 1 19 LEU HB2 H -4.939 -3.096 1.339 1.00 . A A . 19 LEU HB2 1 1 4 1192 1 1 19 LEU HB3 H -6.149 -4.152 2.028 1.00 . A A . 19 LEU HB3 1 1 4 1193 1 1 19 LEU HD11 H -3.614 -6.407 0.591 1.00 . A A . 19 LEU HD11 1 1 4 1194 1 1 19 LEU HD12 H -4.447 -5.948 2.077 1.00 . A A . 19 LEU HD12 1 1 4 1195 1 1 19 LEU HD13 H -3.266 -4.855 1.356 1.00 . A A . 19 LEU HD13 1 1 4 1196 1 1 19 LEU HD21 H -6.955 -5.523 -0.598 1.00 . A A . 19 LEU HD21 1 1 4 1197 1 1 19 LEU HD22 H -6.629 -6.229 0.986 1.00 . A A . 19 LEU HD22 1 1 4 1198 1 1 19 LEU HD23 H -5.753 -6.822 -0.435 1.00 . A A . 19 LEU HD23 1 1 4 1199 1 1 19 LEU HG H -4.725 -4.589 -0.605 1.00 . A A . 19 LEU HG 1 1 4 1200 1 1 19 LEU N N -6.256 -2.045 -0.599 1.00 . A A . 19 LEU N 1 1 4 1201 1 1 19 LEU O O -8.549 -2.792 2.077 1.00 . A A . 19 LEU O 1 1 4 1202 1 1 20 ASN C C -9.230 0.498 1.894 1.00 . A A . 20 ASN C 1 1 4 1203 1 1 20 ASN CA C -8.040 -0.152 2.548 1.00 . A A . 20 ASN CA 1 1 4 1204 1 1 20 ASN CB C -7.075 0.873 3.133 1.00 . A A . 20 ASN CB 1 1 4 1205 1 1 20 ASN CG C -7.750 1.983 3.911 1.00 . A A . 20 ASN CG 1 1 4 1206 1 1 20 ASN H H -6.678 -0.568 1.033 1.00 . A A . 20 ASN H 1 1 4 1207 1 1 20 ASN HA H -8.397 -0.791 3.342 1.00 . A A . 20 ASN HA 1 1 4 1208 1 1 20 ASN HB2 H -6.400 0.363 3.806 1.00 . A A . 20 ASN HB2 1 1 4 1209 1 1 20 ASN HB3 H -6.504 1.292 2.324 1.00 . A A . 20 ASN HB3 1 1 4 1210 1 1 20 ASN HD21 H -7.732 3.129 2.311 1.00 . A A . 20 ASN HD21 1 1 4 1211 1 1 20 ASN HD22 H -8.429 3.836 3.722 1.00 . A A . 20 ASN HD22 1 1 4 1212 1 1 20 ASN N N -7.361 -0.983 1.598 1.00 . A A . 20 ASN N 1 1 4 1213 1 1 20 ASN ND2 N -7.997 3.087 3.259 1.00 . A A . 20 ASN ND2 1 1 4 1214 1 1 20 ASN O O -10.374 0.242 2.329 1.00 . A A . 20 ASN O 1 1 4 1215 1 1 20 ASN OXT O -9.044 1.181 0.883 1.00 . A A . 20 ASN OXT 1 1 4 1216 1 1 20 ASN OD1 O -8.001 1.857 5.108 1.00 . A A . 20 ASN OD1 1 1 5 1217 1 1 1 SER C C 0.995 -2.719 -5.452 1.00 . A A . 1 SER C 1 1 5 1218 1 1 1 SER CA C 0.400 -1.527 -6.209 1.00 . A A . 1 SER CA 1 1 5 1219 1 1 1 SER CB C -0.837 -0.980 -5.499 1.00 . A A . 1 SER CB 1 1 5 1220 1 1 1 SER H1 H 0.865 -2.284 -8.054 1.00 . A A . 1 SER H1 1 1 5 1221 1 1 1 SER H2 H -0.428 -1.197 -8.087 1.00 . A A . 1 SER H2 1 1 5 1222 1 1 1 SER H3 H -0.631 -2.757 -7.471 1.00 . A A . 1 SER H3 1 1 5 1223 1 1 1 SER HA H 1.147 -0.752 -6.293 1.00 . A A . 1 SER HA 1 1 5 1224 1 1 1 SER HB2 H -1.541 -1.782 -5.336 1.00 . A A . 1 SER HB2 1 1 5 1225 1 1 1 SER HB3 H -0.549 -0.553 -4.550 1.00 . A A . 1 SER HB3 1 1 5 1226 1 1 1 SER HG H -0.790 0.686 -6.532 1.00 . A A . 1 SER HG 1 1 5 1227 1 1 1 SER N N 0.025 -1.955 -7.540 1.00 . A A . 1 SER N 1 1 5 1228 1 1 1 SER O O 0.341 -3.750 -5.313 1.00 . A A . 1 SER O 1 1 5 1229 1 1 1 SER OG O -1.468 0.038 -6.292 1.00 . A A . 1 SER OG 1 1 5 1230 1 1 2 PRO C C 2.442 -4.034 -2.910 1.00 . A A . 2 PRO C 1 1 5 1231 1 1 2 PRO CA C 2.937 -3.704 -4.327 1.00 . A A . 2 PRO CA 1 1 5 1232 1 1 2 PRO CB C 4.389 -3.220 -4.284 1.00 . A A . 2 PRO CB 1 1 5 1233 1 1 2 PRO CD C 3.045 -1.356 -4.960 1.00 . A A . 2 PRO CD 1 1 5 1234 1 1 2 PRO CG C 4.295 -1.735 -4.214 1.00 . A A . 2 PRO CG 1 1 5 1235 1 1 2 PRO HA H 2.885 -4.592 -4.938 1.00 . A A . 2 PRO HA 1 1 5 1236 1 1 2 PRO HB2 H 4.884 -3.627 -3.414 1.00 . A A . 2 PRO HB2 1 1 5 1237 1 1 2 PRO HB3 H 4.902 -3.539 -5.179 1.00 . A A . 2 PRO HB3 1 1 5 1238 1 1 2 PRO HD2 H 2.526 -0.561 -4.445 1.00 . A A . 2 PRO HD2 1 1 5 1239 1 1 2 PRO HD3 H 3.288 -1.057 -5.969 1.00 . A A . 2 PRO HD3 1 1 5 1240 1 1 2 PRO HG2 H 4.224 -1.423 -3.182 1.00 . A A . 2 PRO HG2 1 1 5 1241 1 1 2 PRO HG3 H 5.161 -1.287 -4.680 1.00 . A A . 2 PRO HG3 1 1 5 1242 1 1 2 PRO N N 2.234 -2.595 -4.960 1.00 . A A . 2 PRO N 1 1 5 1243 1 1 2 PRO O O 2.339 -3.150 -2.057 1.00 . A A . 2 PRO O 1 1 5 1244 1 1 3 PRO C C 2.848 -5.598 -0.238 1.00 . A A . 3 PRO C 1 1 5 1245 1 1 3 PRO CA C 1.748 -5.826 -1.332 1.00 . A A . 3 PRO CA 1 1 5 1246 1 1 3 PRO CB C 1.470 -7.316 -1.550 1.00 . A A . 3 PRO CB 1 1 5 1247 1 1 3 PRO CD C 1.914 -6.359 -3.696 1.00 . A A . 3 PRO CD 1 1 5 1248 1 1 3 PRO CG C 1.117 -7.420 -2.988 1.00 . A A . 3 PRO CG 1 1 5 1249 1 1 3 PRO HA H 0.854 -5.340 -0.989 1.00 . A A . 3 PRO HA 1 1 5 1250 1 1 3 PRO HB2 H 2.347 -7.895 -1.305 1.00 . A A . 3 PRO HB2 1 1 5 1251 1 1 3 PRO HB3 H 0.646 -7.627 -0.923 1.00 . A A . 3 PRO HB3 1 1 5 1252 1 1 3 PRO HD2 H 2.869 -6.749 -4.015 1.00 . A A . 3 PRO HD2 1 1 5 1253 1 1 3 PRO HD3 H 1.356 -5.977 -4.539 1.00 . A A . 3 PRO HD3 1 1 5 1254 1 1 3 PRO HG2 H 1.381 -8.399 -3.358 1.00 . A A . 3 PRO HG2 1 1 5 1255 1 1 3 PRO HG3 H 0.060 -7.242 -3.118 1.00 . A A . 3 PRO HG3 1 1 5 1256 1 1 3 PRO N N 2.089 -5.318 -2.670 1.00 . A A . 3 PRO N 1 1 5 1257 1 1 3 PRO O O 2.499 -5.354 0.918 1.00 . A A . 3 PRO O 1 1 5 1258 1 1 4 PRO C C 5.158 -3.909 0.763 1.00 . A A . 4 PRO C 1 1 5 1259 1 1 4 PRO CA C 5.245 -5.389 0.393 1.00 . A A . 4 PRO CA 1 1 5 1260 1 1 4 PRO CB C 6.541 -5.671 -0.373 1.00 . A A . 4 PRO CB 1 1 5 1261 1 1 4 PRO CD C 4.741 -6.322 -1.777 1.00 . A A . 4 PRO CD 1 1 5 1262 1 1 4 PRO CG C 6.152 -6.657 -1.410 1.00 . A A . 4 PRO CG 1 1 5 1263 1 1 4 PRO HA H 5.193 -5.992 1.285 1.00 . A A . 4 PRO HA 1 1 5 1264 1 1 4 PRO HB2 H 6.905 -4.753 -0.813 1.00 . A A . 4 PRO HB2 1 1 5 1265 1 1 4 PRO HB3 H 7.285 -6.072 0.297 1.00 . A A . 4 PRO HB3 1 1 5 1266 1 1 4 PRO HD2 H 4.667 -5.588 -2.564 1.00 . A A . 4 PRO HD2 1 1 5 1267 1 1 4 PRO HD3 H 4.164 -7.194 -2.044 1.00 . A A . 4 PRO HD3 1 1 5 1268 1 1 4 PRO HG2 H 6.796 -6.564 -2.272 1.00 . A A . 4 PRO HG2 1 1 5 1269 1 1 4 PRO HG3 H 6.203 -7.657 -1.008 1.00 . A A . 4 PRO HG3 1 1 5 1270 1 1 4 PRO N N 4.186 -5.745 -0.552 1.00 . A A . 4 PRO N 1 1 5 1271 1 1 4 PRO O O 5.606 -3.024 0.009 1.00 . A A . 4 PRO O 1 1 5 1272 1 1 5 ARG C C 5.508 -1.724 3.050 1.00 . A A . 5 ARG C 1 1 5 1273 1 1 5 ARG CA C 4.304 -2.304 2.324 1.00 . A A . 5 ARG CA 1 1 5 1274 1 1 5 ARG CB C 3.036 -2.236 3.197 1.00 . A A . 5 ARG CB 1 1 5 1275 1 1 5 ARG CD C 1.812 -2.959 5.279 1.00 . A A . 5 ARG CD 1 1 5 1276 1 1 5 ARG CG C 3.099 -3.053 4.480 1.00 . A A . 5 ARG CG 1 1 5 1277 1 1 5 ARG CZ C 1.283 -1.061 6.811 1.00 . A A . 5 ARG CZ 1 1 5 1278 1 1 5 ARG H H 4.261 -4.412 2.431 1.00 . A A . 5 ARG H 1 1 5 1279 1 1 5 ARG HA H 4.135 -1.711 1.438 1.00 . A A . 5 ARG HA 1 1 5 1280 1 1 5 ARG HB2 H 2.857 -1.206 3.469 1.00 . A A . 5 ARG HB2 1 1 5 1281 1 1 5 ARG HB3 H 2.199 -2.589 2.613 1.00 . A A . 5 ARG HB3 1 1 5 1282 1 1 5 ARG HD2 H 1.010 -3.395 4.700 1.00 . A A . 5 ARG HD2 1 1 5 1283 1 1 5 ARG HD3 H 1.931 -3.511 6.200 1.00 . A A . 5 ARG HD3 1 1 5 1284 1 1 5 ARG HE H 1.351 -0.971 4.809 1.00 . A A . 5 ARG HE 1 1 5 1285 1 1 5 ARG HG2 H 3.279 -4.088 4.230 1.00 . A A . 5 ARG HG2 1 1 5 1286 1 1 5 ARG HG3 H 3.914 -2.679 5.083 1.00 . A A . 5 ARG HG3 1 1 5 1287 1 1 5 ARG HH11 H 1.719 -2.770 7.869 1.00 . A A . 5 ARG HH11 1 1 5 1288 1 1 5 ARG HH12 H 1.285 -1.432 8.813 1.00 . A A . 5 ARG HH12 1 1 5 1289 1 1 5 ARG HH21 H 0.864 0.803 6.119 1.00 . A A . 5 ARG HH21 1 1 5 1290 1 1 5 ARG HH22 H 0.820 0.648 7.824 1.00 . A A . 5 ARG HH22 1 1 5 1291 1 1 5 ARG N N 4.554 -3.646 1.889 1.00 . A A . 5 ARG N 1 1 5 1292 1 1 5 ARG NE N 1.469 -1.572 5.593 1.00 . A A . 5 ARG NE 1 1 5 1293 1 1 5 ARG NH1 N 1.446 -1.806 7.893 1.00 . A A . 5 ARG NH1 1 1 5 1294 1 1 5 ARG NH2 N 0.964 0.213 6.931 1.00 . A A . 5 ARG NH2 1 1 5 1295 1 1 5 ARG O O 6.194 -2.419 3.812 1.00 . A A . 5 ARG O 1 1 5 1296 1 1 6 GLY C C 6.625 1.691 3.224 1.00 . A A . 6 GLY C 1 1 5 1297 1 1 6 GLY CA C 6.850 0.227 3.402 1.00 . A A . 6 GLY CA 1 1 5 1298 1 1 6 GLY H H 5.216 0.016 2.147 1.00 . A A . 6 GLY H 1 1 5 1299 1 1 6 GLY HA2 H 6.880 -0.014 4.455 1.00 . A A . 6 GLY HA2 1 1 5 1300 1 1 6 GLY HA3 H 7.784 -0.048 2.940 1.00 . A A . 6 GLY HA3 1 1 5 1301 1 1 6 GLY N N 5.768 -0.478 2.788 1.00 . A A . 6 GLY N 1 1 5 1302 1 1 6 GLY O O 5.842 2.085 2.334 1.00 . A A . 6 GLY O 1 1 5 1303 1 1 7 SER C C 7.817 4.549 2.816 1.00 . A A . 7 SER C 1 1 5 1304 1 1 7 SER CA C 7.051 3.917 3.985 1.00 . A A . 7 SER CA 1 1 5 1305 1 1 7 SER CB C 7.435 4.551 5.323 1.00 . A A . 7 SER CB 1 1 5 1306 1 1 7 SER H H 7.917 2.138 4.663 1.00 . A A . 7 SER H 1 1 5 1307 1 1 7 SER HA H 5.997 4.074 3.815 1.00 . A A . 7 SER HA 1 1 5 1308 1 1 7 SER HB2 H 6.981 3.985 6.122 1.00 . A A . 7 SER HB2 1 1 5 1309 1 1 7 SER HB3 H 8.508 4.518 5.425 1.00 . A A . 7 SER HB3 1 1 5 1310 1 1 7 SER HG H 7.709 6.413 5.832 1.00 . A A . 7 SER HG 1 1 5 1311 1 1 7 SER N N 7.265 2.497 4.023 1.00 . A A . 7 SER N 1 1 5 1312 1 1 7 SER O O 8.998 4.904 2.923 1.00 . A A . 7 SER O 1 1 5 1313 1 1 7 SER OG O 7.001 5.902 5.417 1.00 . A A . 7 SER OG 1 1 5 1314 1 1 8 SER C C 6.433 5.583 -0.324 1.00 . A A . 8 SER C 1 1 5 1315 1 1 8 SER CA C 7.653 5.175 0.481 1.00 . A A . 8 SER CA 1 1 5 1316 1 1 8 SER CB C 8.495 4.155 -0.310 1.00 . A A . 8 SER CB 1 1 5 1317 1 1 8 SER H H 6.265 4.192 1.655 1.00 . A A . 8 SER H 1 1 5 1318 1 1 8 SER HA H 8.248 6.040 0.729 1.00 . A A . 8 SER HA 1 1 5 1319 1 1 8 SER HB2 H 7.895 3.284 -0.523 1.00 . A A . 8 SER HB2 1 1 5 1320 1 1 8 SER HB3 H 8.819 4.602 -1.238 1.00 . A A . 8 SER HB3 1 1 5 1321 1 1 8 SER HG H 9.534 4.040 1.344 1.00 . A A . 8 SER HG 1 1 5 1322 1 1 8 SER N N 7.162 4.589 1.693 1.00 . A A . 8 SER N 1 1 5 1323 1 1 8 SER O O 5.361 4.975 -0.131 1.00 . A A . 8 SER O 1 1 5 1324 1 1 8 SER OG O 9.639 3.748 0.427 1.00 . A A . 8 SER OG 1 1 5 1325 1 1 9 PRO C C 4.758 5.956 -2.782 1.00 . A A . 9 PRO C 1 1 5 1326 1 1 9 PRO CA C 5.431 7.097 -2.025 1.00 . A A . 9 PRO CA 1 1 5 1327 1 1 9 PRO CB C 6.113 8.057 -3.000 1.00 . A A . 9 PRO CB 1 1 5 1328 1 1 9 PRO CD C 7.761 7.445 -1.389 1.00 . A A . 9 PRO CD 1 1 5 1329 1 1 9 PRO CG C 7.273 8.584 -2.238 1.00 . A A . 9 PRO CG 1 1 5 1330 1 1 9 PRO HA H 4.693 7.626 -1.441 1.00 . A A . 9 PRO HA 1 1 5 1331 1 1 9 PRO HB2 H 6.425 7.513 -3.879 1.00 . A A . 9 PRO HB2 1 1 5 1332 1 1 9 PRO HB3 H 5.431 8.846 -3.281 1.00 . A A . 9 PRO HB3 1 1 5 1333 1 1 9 PRO HD2 H 8.524 6.882 -1.908 1.00 . A A . 9 PRO HD2 1 1 5 1334 1 1 9 PRO HD3 H 8.137 7.814 -0.447 1.00 . A A . 9 PRO HD3 1 1 5 1335 1 1 9 PRO HG2 H 8.046 8.901 -2.921 1.00 . A A . 9 PRO HG2 1 1 5 1336 1 1 9 PRO HG3 H 6.961 9.409 -1.614 1.00 . A A . 9 PRO HG3 1 1 5 1337 1 1 9 PRO N N 6.545 6.623 -1.184 1.00 . A A . 9 PRO N 1 1 5 1338 1 1 9 PRO O O 3.579 5.690 -2.591 1.00 . A A . 9 PRO O 1 1 5 1339 1 1 10 GLY C C 4.984 2.837 -3.540 1.00 . A A . 10 GLY C 1 1 5 1340 1 1 10 GLY CA C 4.997 4.133 -4.324 1.00 . A A . 10 GLY CA 1 1 5 1341 1 1 10 GLY H H 6.492 5.433 -3.614 1.00 . A A . 10 GLY H 1 1 5 1342 1 1 10 GLY HA2 H 3.981 4.387 -4.592 1.00 . A A . 10 GLY HA2 1 1 5 1343 1 1 10 GLY HA3 H 5.582 4.003 -5.222 1.00 . A A . 10 GLY HA3 1 1 5 1344 1 1 10 GLY N N 5.533 5.229 -3.556 1.00 . A A . 10 GLY N 1 1 5 1345 1 1 10 GLY O O 5.206 1.756 -4.094 1.00 . A A . 10 GLY O 1 1 5 1346 1 1 11 GLY C C 3.391 1.676 -0.686 1.00 . A A . 11 GLY C 1 1 5 1347 1 1 11 GLY CA C 4.687 1.784 -1.428 1.00 . A A . 11 GLY CA 1 1 5 1348 1 1 11 GLY H H 4.528 3.826 -1.893 1.00 . A A . 11 GLY H 1 1 5 1349 1 1 11 GLY HA2 H 4.812 0.905 -2.042 1.00 . A A . 11 GLY HA2 1 1 5 1350 1 1 11 GLY HA3 H 5.496 1.838 -0.713 1.00 . A A . 11 GLY HA3 1 1 5 1351 1 1 11 GLY N N 4.721 2.937 -2.264 1.00 . A A . 11 GLY N 1 1 5 1352 1 1 11 GLY O O 2.328 1.487 -1.296 1.00 . A A . 11 GLY O 1 1 5 1353 1 1 12 ASP C C 1.205 2.722 1.202 1.00 . A A . 12 ASP C 1 1 5 1354 1 1 12 ASP CA C 2.297 1.707 1.497 1.00 . A A . 12 ASP CA 1 1 5 1355 1 1 12 ASP CB C 2.701 1.740 2.974 1.00 . A A . 12 ASP CB 1 1 5 1356 1 1 12 ASP CG C 1.545 1.465 3.923 1.00 . A A . 12 ASP CG 1 1 5 1357 1 1 12 ASP H H 4.313 2.146 1.025 1.00 . A A . 12 ASP H 1 1 5 1358 1 1 12 ASP HA H 1.892 0.729 1.278 1.00 . A A . 12 ASP HA 1 1 5 1359 1 1 12 ASP HB2 H 3.458 0.987 3.142 1.00 . A A . 12 ASP HB2 1 1 5 1360 1 1 12 ASP HB3 H 3.113 2.711 3.201 1.00 . A A . 12 ASP HB3 1 1 5 1361 1 1 12 ASP N N 3.459 1.874 0.622 1.00 . A A . 12 ASP N 1 1 5 1362 1 1 12 ASP O O 0.041 2.458 1.443 1.00 . A A . 12 ASP O 1 1 5 1363 1 1 12 ASP OD1 O 0.980 0.367 3.882 1.00 . A A . 12 ASP OD1 1 1 5 1364 1 1 12 ASP OD2 O 1.243 2.310 4.783 1.00 . A A . 12 ASP OD2 1 1 5 1365 1 1 13 LYS C C -0.451 4.263 -0.690 1.00 . A A . 13 LYS C 1 1 5 1366 1 1 13 LYS CA C 0.594 4.879 0.236 1.00 . A A . 13 LYS CA 1 1 5 1367 1 1 13 LYS CB C 1.243 6.079 -0.473 1.00 . A A . 13 LYS CB 1 1 5 1368 1 1 13 LYS CD C -0.626 7.740 0.030 1.00 . A A . 13 LYS CD 1 1 5 1369 1 1 13 LYS CE C -1.833 8.454 -0.570 1.00 . A A . 13 LYS CE 1 1 5 1370 1 1 13 LYS CG C 0.217 7.068 -1.051 1.00 . A A . 13 LYS CG 1 1 5 1371 1 1 13 LYS H H 2.538 4.034 0.494 1.00 . A A . 13 LYS H 1 1 5 1372 1 1 13 LYS HA H 0.104 5.222 1.135 1.00 . A A . 13 LYS HA 1 1 5 1373 1 1 13 LYS HB2 H 1.903 6.599 0.204 1.00 . A A . 13 LYS HB2 1 1 5 1374 1 1 13 LYS HB3 H 1.835 5.703 -1.296 1.00 . A A . 13 LYS HB3 1 1 5 1375 1 1 13 LYS HD2 H -0.976 6.993 0.727 1.00 . A A . 13 LYS HD2 1 1 5 1376 1 1 13 LYS HD3 H -0.016 8.463 0.549 1.00 . A A . 13 LYS HD3 1 1 5 1377 1 1 13 LYS HE2 H -2.476 7.724 -1.037 1.00 . A A . 13 LYS HE2 1 1 5 1378 1 1 13 LYS HE3 H -2.370 8.942 0.229 1.00 . A A . 13 LYS HE3 1 1 5 1379 1 1 13 LYS HG2 H 0.725 7.828 -1.622 1.00 . A A . 13 LYS HG2 1 1 5 1380 1 1 13 LYS HG3 H -0.440 6.521 -1.711 1.00 . A A . 13 LYS HG3 1 1 5 1381 1 1 13 LYS HZ1 H -0.885 9.048 -2.339 1.00 . A A . 13 LYS HZ1 1 1 5 1382 1 1 13 LYS HZ2 H -0.950 10.266 -1.157 1.00 . A A . 13 LYS HZ2 1 1 5 1383 1 1 13 LYS HZ3 H -2.315 9.844 -2.022 1.00 . A A . 13 LYS HZ3 1 1 5 1384 1 1 13 LYS N N 1.583 3.873 0.633 1.00 . A A . 13 LYS N 1 1 5 1385 1 1 13 LYS NZ N -1.458 9.461 -1.576 1.00 . A A . 13 LYS NZ 1 1 5 1386 1 1 13 LYS O O -1.640 4.316 -0.413 1.00 . A A . 13 LYS O 1 1 5 1387 1 1 14 LEU C C -1.526 1.783 -2.164 1.00 . A A . 14 LEU C 1 1 5 1388 1 1 14 LEU CA C -0.899 3.040 -2.714 1.00 . A A . 14 LEU CA 1 1 5 1389 1 1 14 LEU CB C -0.244 2.781 -4.089 1.00 . A A . 14 LEU CB 1 1 5 1390 1 1 14 LEU CD1 C -1.272 4.771 -5.277 1.00 . A A . 14 LEU CD1 1 1 5 1391 1 1 14 LEU CD2 C 1.076 4.929 -4.445 1.00 . A A . 14 LEU CD2 1 1 5 1392 1 1 14 LEU CG C 0.012 4.007 -5.005 1.00 . A A . 14 LEU CG 1 1 5 1393 1 1 14 LEU H H 0.975 3.563 -1.893 1.00 . A A . 14 LEU H 1 1 5 1394 1 1 14 LEU HA H -1.701 3.753 -2.847 1.00 . A A . 14 LEU HA 1 1 5 1395 1 1 14 LEU HB2 H 0.706 2.299 -3.915 1.00 . A A . 14 LEU HB2 1 1 5 1396 1 1 14 LEU HB3 H -0.873 2.087 -4.627 1.00 . A A . 14 LEU HB3 1 1 5 1397 1 1 14 LEU HD11 H -1.671 5.161 -4.352 1.00 . A A . 14 LEU HD11 1 1 5 1398 1 1 14 LEU HD12 H -1.995 4.106 -5.726 1.00 . A A . 14 LEU HD12 1 1 5 1399 1 1 14 LEU HD13 H -1.066 5.588 -5.953 1.00 . A A . 14 LEU HD13 1 1 5 1400 1 1 14 LEU HD21 H 1.243 5.749 -5.129 1.00 . A A . 14 LEU HD21 1 1 5 1401 1 1 14 LEU HD22 H 1.991 4.375 -4.307 1.00 . A A . 14 LEU HD22 1 1 5 1402 1 1 14 LEU HD23 H 0.746 5.317 -3.492 1.00 . A A . 14 LEU HD23 1 1 5 1403 1 1 14 LEU HG H 0.352 3.640 -5.963 1.00 . A A . 14 LEU HG 1 1 5 1404 1 1 14 LEU N N 0.008 3.637 -1.756 1.00 . A A . 14 LEU N 1 1 5 1405 1 1 14 LEU O O -2.609 1.414 -2.566 1.00 . A A . 14 LEU O 1 1 5 1406 1 1 15 TRP C C -2.640 0.309 0.160 1.00 . A A . 15 TRP C 1 1 5 1407 1 1 15 TRP CA C -1.346 -0.055 -0.569 1.00 . A A . 15 TRP CA 1 1 5 1408 1 1 15 TRP CB C -0.309 -0.535 0.466 1.00 . A A . 15 TRP CB 1 1 5 1409 1 1 15 TRP CD1 C 0.383 -2.951 0.761 1.00 . A A . 15 TRP CD1 1 1 5 1410 1 1 15 TRP CD2 C -1.493 -2.451 1.835 1.00 . A A . 15 TRP CD2 1 1 5 1411 1 1 15 TRP CE2 C -1.198 -3.801 2.068 1.00 . A A . 15 TRP CE2 1 1 5 1412 1 1 15 TRP CE3 C -2.626 -1.914 2.406 1.00 . A A . 15 TRP CE3 1 1 5 1413 1 1 15 TRP CG C -0.462 -1.929 0.995 1.00 . A A . 15 TRP CG 1 1 5 1414 1 1 15 TRP CH2 C -3.121 -4.033 3.389 1.00 . A A . 15 TRP CH2 1 1 5 1415 1 1 15 TRP CZ2 C -2.008 -4.610 2.855 1.00 . A A . 15 TRP CZ2 1 1 5 1416 1 1 15 TRP CZ3 C -3.421 -2.703 3.164 1.00 . A A . 15 TRP CZ3 1 1 5 1417 1 1 15 TRP H H 0.028 1.505 -0.959 1.00 . A A . 15 TRP H 1 1 5 1418 1 1 15 TRP HA H -1.502 -0.809 -1.324 1.00 . A A . 15 TRP HA 1 1 5 1419 1 1 15 TRP HB2 H 0.670 -0.500 0.025 1.00 . A A . 15 TRP HB2 1 1 5 1420 1 1 15 TRP HB3 H -0.333 0.141 1.308 1.00 . A A . 15 TRP HB3 1 1 5 1421 1 1 15 TRP HD1 H 1.269 -2.852 0.156 1.00 . A A . 15 TRP HD1 1 1 5 1422 1 1 15 TRP HE1 H 0.418 -4.950 1.381 1.00 . A A . 15 TRP HE1 1 1 5 1423 1 1 15 TRP HE3 H -2.887 -0.878 2.247 1.00 . A A . 15 TRP HE3 1 1 5 1424 1 1 15 TRP HH2 H -3.813 -4.587 4.001 1.00 . A A . 15 TRP HH2 1 1 5 1425 1 1 15 TRP HZ2 H -1.783 -5.651 3.038 1.00 . A A . 15 TRP HZ2 1 1 5 1426 1 1 15 TRP HZ3 H -4.314 -2.281 3.586 1.00 . A A . 15 TRP HZ3 1 1 5 1427 1 1 15 TRP N N -0.847 1.151 -1.224 1.00 . A A . 15 TRP N 1 1 5 1428 1 1 15 TRP NE1 N -0.044 -4.080 1.409 1.00 . A A . 15 TRP NE1 1 1 5 1429 1 1 15 TRP O O -3.695 -0.333 -0.011 1.00 . A A . 15 TRP O 1 1 5 1430 1 1 16 GLN C C -4.794 2.457 0.888 1.00 . A A . 16 GLN C 1 1 5 1431 1 1 16 GLN CA C -3.668 1.877 1.737 1.00 . A A . 16 GLN CA 1 1 5 1432 1 1 16 GLN CB C -3.168 2.933 2.722 1.00 . A A . 16 GLN CB 1 1 5 1433 1 1 16 GLN CD C -2.491 1.330 4.565 1.00 . A A . 16 GLN CD 1 1 5 1434 1 1 16 GLN CG C -2.066 2.437 3.639 1.00 . A A . 16 GLN CG 1 1 5 1435 1 1 16 GLN H H -1.717 1.894 0.925 1.00 . A A . 16 GLN H 1 1 5 1436 1 1 16 GLN HA H -4.032 1.032 2.299 1.00 . A A . 16 GLN HA 1 1 5 1437 1 1 16 GLN HB2 H -2.794 3.778 2.164 1.00 . A A . 16 GLN HB2 1 1 5 1438 1 1 16 GLN HB3 H -3.999 3.256 3.331 1.00 . A A . 16 GLN HB3 1 1 5 1439 1 1 16 GLN HE21 H -0.690 0.546 4.444 1.00 . A A . 16 GLN HE21 1 1 5 1440 1 1 16 GLN HE22 H -1.809 -0.297 5.458 1.00 . A A . 16 GLN HE22 1 1 5 1441 1 1 16 GLN HG2 H -1.292 2.025 3.010 1.00 . A A . 16 GLN HG2 1 1 5 1442 1 1 16 GLN HG3 H -1.677 3.262 4.219 1.00 . A A . 16 GLN HG3 1 1 5 1443 1 1 16 GLN N N -2.566 1.395 0.912 1.00 . A A . 16 GLN N 1 1 5 1444 1 1 16 GLN NE2 N -1.587 0.440 4.853 1.00 . A A . 16 GLN NE2 1 1 5 1445 1 1 16 GLN O O -5.845 2.840 1.406 1.00 . A A . 16 GLN O 1 1 5 1446 1 1 16 GLN OE1 O -3.647 1.256 4.998 1.00 . A A . 16 GLN OE1 1 1 5 1447 1 1 17 ILE C C -5.892 1.905 -2.345 1.00 . A A . 17 ILE C 1 1 5 1448 1 1 17 ILE CA C -5.522 3.048 -1.346 1.00 . A A . 17 ILE CA 1 1 5 1449 1 1 17 ILE CB C -4.919 4.321 -2.094 1.00 . A A . 17 ILE CB 1 1 5 1450 1 1 17 ILE CD1 C -5.503 5.980 -0.189 1.00 . A A . 17 ILE CD1 1 1 5 1451 1 1 17 ILE CG1 C -4.431 5.397 -1.093 1.00 . A A . 17 ILE CG1 1 1 5 1452 1 1 17 ILE CG2 C -5.911 4.963 -3.053 1.00 . A A . 17 ILE CG2 1 1 5 1453 1 1 17 ILE H H -3.692 2.226 -0.740 1.00 . A A . 17 ILE H 1 1 5 1454 1 1 17 ILE HA H -6.406 3.324 -0.798 1.00 . A A . 17 ILE HA 1 1 5 1455 1 1 17 ILE HB H -4.065 3.998 -2.673 1.00 . A A . 17 ILE HB 1 1 5 1456 1 1 17 ILE HD11 H -5.908 5.194 0.429 1.00 . A A . 17 ILE HD11 1 1 5 1457 1 1 17 ILE HD12 H -6.289 6.408 -0.793 1.00 . A A . 17 ILE HD12 1 1 5 1458 1 1 17 ILE HD13 H -5.070 6.745 0.438 1.00 . A A . 17 ILE HD13 1 1 5 1459 1 1 17 ILE HG12 H -3.676 4.964 -0.454 1.00 . A A . 17 ILE HG12 1 1 5 1460 1 1 17 ILE HG13 H -3.988 6.208 -1.650 1.00 . A A . 17 ILE HG13 1 1 5 1461 1 1 17 ILE HG21 H -6.797 5.263 -2.513 1.00 . A A . 17 ILE HG21 1 1 5 1462 1 1 17 ILE HG22 H -6.173 4.251 -3.822 1.00 . A A . 17 ILE HG22 1 1 5 1463 1 1 17 ILE HG23 H -5.451 5.829 -3.502 1.00 . A A . 17 ILE HG23 1 1 5 1464 1 1 17 ILE N N -4.561 2.529 -0.401 1.00 . A A . 17 ILE N 1 1 5 1465 1 1 17 ILE O O -6.508 2.117 -3.395 1.00 . A A . 17 ILE O 1 1 5 1466 1 1 18 TYR C C -6.252 -1.714 -2.118 1.00 . A A . 18 TYR C 1 1 5 1467 1 1 18 TYR CA C -5.759 -0.461 -2.863 1.00 . A A . 18 TYR CA 1 1 5 1468 1 1 18 TYR CB C -4.476 -0.679 -3.700 1.00 . A A . 18 TYR CB 1 1 5 1469 1 1 18 TYR CD1 C -3.037 -2.434 -2.654 1.00 . A A . 18 TYR CD1 1 1 5 1470 1 1 18 TYR CD2 C -3.888 -2.855 -4.830 1.00 . A A . 18 TYR CD2 1 1 5 1471 1 1 18 TYR CE1 C -2.343 -3.624 -2.686 1.00 . A A . 18 TYR CE1 1 1 5 1472 1 1 18 TYR CE2 C -3.216 -4.056 -4.869 1.00 . A A . 18 TYR CE2 1 1 5 1473 1 1 18 TYR CG C -3.814 -2.032 -3.714 1.00 . A A . 18 TYR CG 1 1 5 1474 1 1 18 TYR CZ C -2.443 -4.436 -3.797 1.00 . A A . 18 TYR CZ 1 1 5 1475 1 1 18 TYR H H -5.111 0.560 -1.108 1.00 . A A . 18 TYR H 1 1 5 1476 1 1 18 TYR HA H -6.549 -0.169 -3.540 1.00 . A A . 18 TYR HA 1 1 5 1477 1 1 18 TYR HB2 H -4.663 -0.439 -4.730 1.00 . A A . 18 TYR HB2 1 1 5 1478 1 1 18 TYR HB3 H -3.743 0.027 -3.339 1.00 . A A . 18 TYR HB3 1 1 5 1479 1 1 18 TYR HD1 H -3.015 -1.777 -1.798 1.00 . A A . 18 TYR HD1 1 1 5 1480 1 1 18 TYR HD2 H -4.496 -2.552 -5.669 1.00 . A A . 18 TYR HD2 1 1 5 1481 1 1 18 TYR HE1 H -1.743 -3.917 -1.837 1.00 . A A . 18 TYR HE1 1 1 5 1482 1 1 18 TYR HE2 H -3.294 -4.692 -5.739 1.00 . A A . 18 TYR HE2 1 1 5 1483 1 1 18 TYR HH H -1.148 -5.518 -4.617 1.00 . A A . 18 TYR HH 1 1 5 1484 1 1 18 TYR N N -5.540 0.682 -1.981 1.00 . A A . 18 TYR N 1 1 5 1485 1 1 18 TYR O O -7.101 -2.450 -2.623 1.00 . A A . 18 TYR O 1 1 5 1486 1 1 18 TYR OH O -1.734 -5.609 -3.855 1.00 . A A . 18 TYR OH 1 1 5 1487 1 1 19 LEU C C -6.907 -2.653 1.101 1.00 . A A . 19 LEU C 1 1 5 1488 1 1 19 LEU CA C -6.152 -3.095 -0.126 1.00 . A A . 19 LEU CA 1 1 5 1489 1 1 19 LEU CB C -4.962 -3.958 0.274 1.00 . A A . 19 LEU CB 1 1 5 1490 1 1 19 LEU CD1 C -3.354 -5.811 -0.172 1.00 . A A . 19 LEU CD1 1 1 5 1491 1 1 19 LEU CD2 C -5.745 -6.075 -0.717 1.00 . A A . 19 LEU CD2 1 1 5 1492 1 1 19 LEU CG C -4.602 -5.102 -0.661 1.00 . A A . 19 LEU CG 1 1 5 1493 1 1 19 LEU H H -4.998 -1.380 -0.606 1.00 . A A . 19 LEU H 1 1 5 1494 1 1 19 LEU HA H -6.815 -3.686 -0.736 1.00 . A A . 19 LEU HA 1 1 5 1495 1 1 19 LEU HB2 H -4.109 -3.297 0.310 1.00 . A A . 19 LEU HB2 1 1 5 1496 1 1 19 LEU HB3 H -5.137 -4.357 1.262 1.00 . A A . 19 LEU HB3 1 1 5 1497 1 1 19 LEU HD11 H -3.539 -6.224 0.809 1.00 . A A . 19 LEU HD11 1 1 5 1498 1 1 19 LEU HD12 H -2.545 -5.099 -0.107 1.00 . A A . 19 LEU HD12 1 1 5 1499 1 1 19 LEU HD13 H -3.092 -6.603 -0.858 1.00 . A A . 19 LEU HD13 1 1 5 1500 1 1 19 LEU HD21 H -6.610 -5.609 -1.163 1.00 . A A . 19 LEU HD21 1 1 5 1501 1 1 19 LEU HD22 H -5.981 -6.341 0.302 1.00 . A A . 19 LEU HD22 1 1 5 1502 1 1 19 LEU HD23 H -5.454 -6.950 -1.277 1.00 . A A . 19 LEU HD23 1 1 5 1503 1 1 19 LEU HG H -4.426 -4.726 -1.658 1.00 . A A . 19 LEU HG 1 1 5 1504 1 1 19 LEU N N -5.723 -1.956 -0.940 1.00 . A A . 19 LEU N 1 1 5 1505 1 1 19 LEU O O -7.618 -3.436 1.735 1.00 . A A . 19 LEU O 1 1 5 1506 1 1 20 ASN C C -8.557 -0.011 2.163 1.00 . A A . 20 ASN C 1 1 5 1507 1 1 20 ASN CA C -7.386 -0.863 2.588 1.00 . A A . 20 ASN CA 1 1 5 1508 1 1 20 ASN CB C -6.361 -0.087 3.412 1.00 . A A . 20 ASN CB 1 1 5 1509 1 1 20 ASN CG C -6.943 0.683 4.578 1.00 . A A . 20 ASN CG 1 1 5 1510 1 1 20 ASN H H -6.221 -0.830 0.862 1.00 . A A . 20 ASN H 1 1 5 1511 1 1 20 ASN HA H -7.761 -1.686 3.178 1.00 . A A . 20 ASN HA 1 1 5 1512 1 1 20 ASN HB2 H -5.652 -0.792 3.818 1.00 . A A . 20 ASN HB2 1 1 5 1513 1 1 20 ASN HB3 H -5.834 0.590 2.762 1.00 . A A . 20 ASN HB3 1 1 5 1514 1 1 20 ASN HD21 H -7.122 2.272 3.447 1.00 . A A . 20 ASN HD21 1 1 5 1515 1 1 20 ASN HD22 H -7.613 2.465 5.089 1.00 . A A . 20 ASN HD22 1 1 5 1516 1 1 20 ASN N N -6.756 -1.419 1.431 1.00 . A A . 20 ASN N 1 1 5 1517 1 1 20 ASN ND2 N -7.262 1.923 4.354 1.00 . A A . 20 ASN ND2 1 1 5 1518 1 1 20 ASN O O -8.354 1.140 1.749 1.00 . A A . 20 ASN O 1 1 5 1519 1 1 20 ASN OXT O -9.694 -0.512 2.192 1.00 . A A . 20 ASN OXT 1 1 5 1520 1 1 20 ASN OD1 O -7.080 0.155 5.680 1.00 . A A . 20 ASN OD1 1 1 6 1521 1 1 1 SER C C 3.123 -1.944 -6.396 1.00 . A A . 1 SER C 1 1 6 1522 1 1 1 SER CA C 1.807 -1.702 -7.124 1.00 . A A . 1 SER CA 1 1 6 1523 1 1 1 SER CB C 0.636 -2.291 -6.301 1.00 . A A . 1 SER CB 1 1 6 1524 1 1 1 SER H1 H 2.644 -1.952 -8.982 1.00 . A A . 1 SER H1 1 1 6 1525 1 1 1 SER H2 H 0.968 -2.159 -8.931 1.00 . A A . 1 SER H2 1 1 6 1526 1 1 1 SER H3 H 1.984 -3.362 -8.323 1.00 . A A . 1 SER H3 1 1 6 1527 1 1 1 SER HA H 1.644 -0.645 -7.264 1.00 . A A . 1 SER HA 1 1 6 1528 1 1 1 SER HB2 H -0.291 -2.171 -6.842 1.00 . A A . 1 SER HB2 1 1 6 1529 1 1 1 SER HB3 H 0.820 -3.343 -6.148 1.00 . A A . 1 SER HB3 1 1 6 1530 1 1 1 SER HG H 1.153 -2.026 -4.409 1.00 . A A . 1 SER HG 1 1 6 1531 1 1 1 SER N N 1.857 -2.335 -8.425 1.00 . A A . 1 SER N 1 1 6 1532 1 1 1 SER O O 3.673 -3.054 -6.462 1.00 . A A . 1 SER O 1 1 6 1533 1 1 1 SER OG O 0.503 -1.670 -5.025 1.00 . A A . 1 SER OG 1 1 6 1534 1 1 2 PRO C C 4.533 -1.929 -3.644 1.00 . A A . 2 PRO C 1 1 6 1535 1 1 2 PRO CA C 4.868 -1.046 -4.869 1.00 . A A . 2 PRO CA 1 1 6 1536 1 1 2 PRO CB C 5.161 0.408 -4.426 1.00 . A A . 2 PRO CB 1 1 6 1537 1 1 2 PRO CD C 3.220 0.495 -5.779 1.00 . A A . 2 PRO CD 1 1 6 1538 1 1 2 PRO CG C 4.446 1.259 -5.407 1.00 . A A . 2 PRO CG 1 1 6 1539 1 1 2 PRO HA H 5.708 -1.461 -5.407 1.00 . A A . 2 PRO HA 1 1 6 1540 1 1 2 PRO HB2 H 4.789 0.561 -3.424 1.00 . A A . 2 PRO HB2 1 1 6 1541 1 1 2 PRO HB3 H 6.226 0.586 -4.450 1.00 . A A . 2 PRO HB3 1 1 6 1542 1 1 2 PRO HD2 H 2.432 0.673 -5.063 1.00 . A A . 2 PRO HD2 1 1 6 1543 1 1 2 PRO HD3 H 2.912 0.770 -6.775 1.00 . A A . 2 PRO HD3 1 1 6 1544 1 1 2 PRO HG2 H 4.180 2.203 -4.953 1.00 . A A . 2 PRO HG2 1 1 6 1545 1 1 2 PRO HG3 H 5.066 1.420 -6.276 1.00 . A A . 2 PRO HG3 1 1 6 1546 1 1 2 PRO N N 3.683 -0.903 -5.730 1.00 . A A . 2 PRO N 1 1 6 1547 1 1 2 PRO O O 3.350 -2.283 -3.447 1.00 . A A . 2 PRO O 1 1 6 1548 1 1 3 PRO C C 4.349 -2.507 -0.687 1.00 . A A . 3 PRO C 1 1 6 1549 1 1 3 PRO CA C 5.331 -3.158 -1.638 1.00 . A A . 3 PRO CA 1 1 6 1550 1 1 3 PRO CB C 6.702 -3.218 -0.977 1.00 . A A . 3 PRO CB 1 1 6 1551 1 1 3 PRO CD C 6.982 -2.051 -3.029 1.00 . A A . 3 PRO CD 1 1 6 1552 1 1 3 PRO CG C 7.657 -3.001 -2.081 1.00 . A A . 3 PRO CG 1 1 6 1553 1 1 3 PRO HA H 5.001 -4.155 -1.892 1.00 . A A . 3 PRO HA 1 1 6 1554 1 1 3 PRO HB2 H 6.768 -2.442 -0.228 1.00 . A A . 3 PRO HB2 1 1 6 1555 1 1 3 PRO HB3 H 6.825 -4.186 -0.514 1.00 . A A . 3 PRO HB3 1 1 6 1556 1 1 3 PRO HD2 H 7.205 -1.028 -2.764 1.00 . A A . 3 PRO HD2 1 1 6 1557 1 1 3 PRO HD3 H 7.281 -2.253 -4.048 1.00 . A A . 3 PRO HD3 1 1 6 1558 1 1 3 PRO HG2 H 8.563 -2.562 -1.691 1.00 . A A . 3 PRO HG2 1 1 6 1559 1 1 3 PRO HG3 H 7.871 -3.938 -2.572 1.00 . A A . 3 PRO HG3 1 1 6 1560 1 1 3 PRO N N 5.550 -2.339 -2.838 1.00 . A A . 3 PRO N 1 1 6 1561 1 1 3 PRO O O 4.548 -1.358 -0.300 1.00 . A A . 3 PRO O 1 1 6 1562 1 1 4 PRO C C 2.732 -1.964 1.782 1.00 . A A . 4 PRO C 1 1 6 1563 1 1 4 PRO CA C 2.212 -2.757 0.574 1.00 . A A . 4 PRO CA 1 1 6 1564 1 1 4 PRO CB C 1.534 -4.049 1.018 1.00 . A A . 4 PRO CB 1 1 6 1565 1 1 4 PRO CD C 3.034 -4.642 -0.727 1.00 . A A . 4 PRO CD 1 1 6 1566 1 1 4 PRO CG C 1.688 -4.951 -0.144 1.00 . A A . 4 PRO CG 1 1 6 1567 1 1 4 PRO HA H 1.512 -2.153 0.018 1.00 . A A . 4 PRO HA 1 1 6 1568 1 1 4 PRO HB2 H 2.030 -4.437 1.895 1.00 . A A . 4 PRO HB2 1 1 6 1569 1 1 4 PRO HB3 H 0.491 -3.869 1.234 1.00 . A A . 4 PRO HB3 1 1 6 1570 1 1 4 PRO HD2 H 3.783 -5.308 -0.325 1.00 . A A . 4 PRO HD2 1 1 6 1571 1 1 4 PRO HD3 H 2.996 -4.717 -1.804 1.00 . A A . 4 PRO HD3 1 1 6 1572 1 1 4 PRO HG2 H 1.641 -5.980 0.178 1.00 . A A . 4 PRO HG2 1 1 6 1573 1 1 4 PRO HG3 H 0.912 -4.750 -0.867 1.00 . A A . 4 PRO HG3 1 1 6 1574 1 1 4 PRO N N 3.284 -3.247 -0.305 1.00 . A A . 4 PRO N 1 1 6 1575 1 1 4 PRO O O 2.288 -0.855 2.051 1.00 . A A . 4 PRO O 1 1 6 1576 1 1 5 ARG C C 5.774 -2.061 3.563 1.00 . A A . 5 ARG C 1 1 6 1577 1 1 5 ARG CA C 4.281 -1.850 3.612 1.00 . A A . 5 ARG CA 1 1 6 1578 1 1 5 ARG CB C 3.717 -2.296 4.973 1.00 . A A . 5 ARG CB 1 1 6 1579 1 1 5 ARG CD C 2.091 -0.372 5.289 1.00 . A A . 5 ARG CD 1 1 6 1580 1 1 5 ARG CG C 2.265 -1.895 5.217 1.00 . A A . 5 ARG CG 1 1 6 1581 1 1 5 ARG CZ C 2.379 1.260 7.161 1.00 . A A . 5 ARG CZ 1 1 6 1582 1 1 5 ARG H H 3.945 -3.446 2.275 1.00 . A A . 5 ARG H 1 1 6 1583 1 1 5 ARG HA H 4.063 -0.804 3.467 1.00 . A A . 5 ARG HA 1 1 6 1584 1 1 5 ARG HB2 H 3.791 -3.370 5.042 1.00 . A A . 5 ARG HB2 1 1 6 1585 1 1 5 ARG HB3 H 4.325 -1.860 5.752 1.00 . A A . 5 ARG HB3 1 1 6 1586 1 1 5 ARG HD2 H 2.488 0.070 4.387 1.00 . A A . 5 ARG HD2 1 1 6 1587 1 1 5 ARG HD3 H 1.043 -0.128 5.355 1.00 . A A . 5 ARG HD3 1 1 6 1588 1 1 5 ARG HE H 3.626 -0.246 6.701 1.00 . A A . 5 ARG HE 1 1 6 1589 1 1 5 ARG HG2 H 1.656 -2.281 4.412 1.00 . A A . 5 ARG HG2 1 1 6 1590 1 1 5 ARG HG3 H 1.945 -2.329 6.152 1.00 . A A . 5 ARG HG3 1 1 6 1591 1 1 5 ARG HH11 H 0.695 1.690 6.047 1.00 . A A . 5 ARG HH11 1 1 6 1592 1 1 5 ARG HH12 H 0.964 2.701 7.387 1.00 . A A . 5 ARG HH12 1 1 6 1593 1 1 5 ARG HH21 H 3.940 1.182 8.450 1.00 . A A . 5 ARG HH21 1 1 6 1594 1 1 5 ARG HH22 H 2.816 2.461 8.731 1.00 . A A . 5 ARG HH22 1 1 6 1595 1 1 5 ARG N N 3.657 -2.537 2.505 1.00 . A A . 5 ARG N 1 1 6 1596 1 1 5 ARG NE N 2.789 0.202 6.443 1.00 . A A . 5 ARG NE 1 1 6 1597 1 1 5 ARG NH1 N 1.280 1.921 6.840 1.00 . A A . 5 ARG NH1 1 1 6 1598 1 1 5 ARG NH2 N 3.097 1.660 8.193 1.00 . A A . 5 ARG NH2 1 1 6 1599 1 1 5 ARG O O 6.252 -3.209 3.466 1.00 . A A . 5 ARG O 1 1 6 1600 1 1 6 GLY C C 8.561 0.219 3.130 1.00 . A A . 6 GLY C 1 1 6 1601 1 1 6 GLY CA C 7.937 -1.073 3.555 1.00 . A A . 6 GLY CA 1 1 6 1602 1 1 6 GLY H H 6.100 -0.091 3.619 1.00 . A A . 6 GLY H 1 1 6 1603 1 1 6 GLY HA2 H 8.301 -1.339 4.536 1.00 . A A . 6 GLY HA2 1 1 6 1604 1 1 6 GLY HA3 H 8.216 -1.840 2.849 1.00 . A A . 6 GLY HA3 1 1 6 1605 1 1 6 GLY N N 6.511 -0.983 3.591 1.00 . A A . 6 GLY N 1 1 6 1606 1 1 6 GLY O O 7.909 1.273 3.169 1.00 . A A . 6 GLY O 1 1 6 1607 1 1 7 SER C C 10.144 1.690 0.838 1.00 . A A . 7 SER C 1 1 6 1608 1 1 7 SER CA C 10.529 1.303 2.273 1.00 . A A . 7 SER CA 1 1 6 1609 1 1 7 SER CB C 12.025 1.006 2.392 1.00 . A A . 7 SER CB 1 1 6 1610 1 1 7 SER H H 10.221 -0.730 2.606 1.00 . A A . 7 SER H 1 1 6 1611 1 1 7 SER HA H 10.278 2.114 2.939 1.00 . A A . 7 SER HA 1 1 6 1612 1 1 7 SER HB2 H 12.304 0.256 1.666 1.00 . A A . 7 SER HB2 1 1 6 1613 1 1 7 SER HB3 H 12.591 1.907 2.215 1.00 . A A . 7 SER HB3 1 1 6 1614 1 1 7 SER HG H 11.522 0.188 4.102 1.00 . A A . 7 SER HG 1 1 6 1615 1 1 7 SER N N 9.790 0.148 2.686 1.00 . A A . 7 SER N 1 1 6 1616 1 1 7 SER O O 10.846 1.374 -0.123 1.00 . A A . 7 SER O 1 1 6 1617 1 1 7 SER OG O 12.334 0.527 3.702 1.00 . A A . 7 SER OG 1 1 6 1618 1 1 8 SER C C 7.382 3.789 -0.322 1.00 . A A . 8 SER C 1 1 6 1619 1 1 8 SER CA C 8.426 2.694 -0.569 1.00 . A A . 8 SER CA 1 1 6 1620 1 1 8 SER CB C 7.754 1.492 -1.270 1.00 . A A . 8 SER CB 1 1 6 1621 1 1 8 SER H H 8.431 2.436 1.507 1.00 . A A . 8 SER H 1 1 6 1622 1 1 8 SER HA H 9.226 3.068 -1.188 1.00 . A A . 8 SER HA 1 1 6 1623 1 1 8 SER HB2 H 6.968 1.109 -0.636 1.00 . A A . 8 SER HB2 1 1 6 1624 1 1 8 SER HB3 H 7.327 1.810 -2.209 1.00 . A A . 8 SER HB3 1 1 6 1625 1 1 8 SER HG H 9.532 0.704 -1.138 1.00 . A A . 8 SER HG 1 1 6 1626 1 1 8 SER N N 8.974 2.276 0.703 1.00 . A A . 8 SER N 1 1 6 1627 1 1 8 SER O O 6.425 3.562 0.418 1.00 . A A . 8 SER O 1 1 6 1628 1 1 8 SER OG O 8.681 0.445 -1.513 1.00 . A A . 8 SER OG 1 1 6 1629 1 1 9 PRO C C 5.251 5.844 -1.406 1.00 . A A . 9 PRO C 1 1 6 1630 1 1 9 PRO CA C 6.605 6.108 -0.744 1.00 . A A . 9 PRO CA 1 1 6 1631 1 1 9 PRO CB C 7.316 7.287 -1.412 1.00 . A A . 9 PRO CB 1 1 6 1632 1 1 9 PRO CD C 8.650 5.348 -1.831 1.00 . A A . 9 PRO CD 1 1 6 1633 1 1 9 PRO CG C 8.234 6.671 -2.403 1.00 . A A . 9 PRO CG 1 1 6 1634 1 1 9 PRO HA H 6.451 6.314 0.305 1.00 . A A . 9 PRO HA 1 1 6 1635 1 1 9 PRO HB2 H 6.585 7.923 -1.892 1.00 . A A . 9 PRO HB2 1 1 6 1636 1 1 9 PRO HB3 H 7.859 7.853 -0.670 1.00 . A A . 9 PRO HB3 1 1 6 1637 1 1 9 PRO HD2 H 8.743 4.624 -2.623 1.00 . A A . 9 PRO HD2 1 1 6 1638 1 1 9 PRO HD3 H 9.577 5.441 -1.288 1.00 . A A . 9 PRO HD3 1 1 6 1639 1 1 9 PRO HG2 H 7.718 6.525 -3.341 1.00 . A A . 9 PRO HG2 1 1 6 1640 1 1 9 PRO HG3 H 9.097 7.304 -2.544 1.00 . A A . 9 PRO HG3 1 1 6 1641 1 1 9 PRO N N 7.540 4.986 -0.932 1.00 . A A . 9 PRO N 1 1 6 1642 1 1 9 PRO O O 4.236 6.467 -1.067 1.00 . A A . 9 PRO O 1 1 6 1643 1 1 10 GLY C C 3.481 3.250 -2.406 1.00 . A A . 10 GLY C 1 1 6 1644 1 1 10 GLY CA C 4.022 4.534 -2.989 1.00 . A A . 10 GLY CA 1 1 6 1645 1 1 10 GLY H H 6.088 4.489 -2.605 1.00 . A A . 10 GLY H 1 1 6 1646 1 1 10 GLY HA2 H 3.298 5.325 -2.862 1.00 . A A . 10 GLY HA2 1 1 6 1647 1 1 10 GLY HA3 H 4.207 4.390 -4.044 1.00 . A A . 10 GLY HA3 1 1 6 1648 1 1 10 GLY N N 5.244 4.914 -2.343 1.00 . A A . 10 GLY N 1 1 6 1649 1 1 10 GLY O O 2.456 2.757 -2.839 1.00 . A A . 10 GLY O 1 1 6 1650 1 1 11 GLY C C 2.507 1.535 -0.048 1.00 . A A . 11 GLY C 1 1 6 1651 1 1 11 GLY CA C 3.812 1.473 -0.793 1.00 . A A . 11 GLY CA 1 1 6 1652 1 1 11 GLY H H 4.924 3.250 -1.039 1.00 . A A . 11 GLY H 1 1 6 1653 1 1 11 GLY HA2 H 3.732 0.722 -1.565 1.00 . A A . 11 GLY HA2 1 1 6 1654 1 1 11 GLY HA3 H 4.591 1.182 -0.103 1.00 . A A . 11 GLY HA3 1 1 6 1655 1 1 11 GLY N N 4.170 2.739 -1.399 1.00 . A A . 11 GLY N 1 1 6 1656 1 1 11 GLY O O 1.501 0.978 -0.496 1.00 . A A . 11 GLY O 1 1 6 1657 1 1 12 ASP C C 0.288 3.251 1.110 1.00 . A A . 12 ASP C 1 1 6 1658 1 1 12 ASP CA C 1.292 2.409 1.863 1.00 . A A . 12 ASP CA 1 1 6 1659 1 1 12 ASP CB C 1.586 3.010 3.247 1.00 . A A . 12 ASP CB 1 1 6 1660 1 1 12 ASP CG C 0.335 3.140 4.118 1.00 . A A . 12 ASP CG 1 1 6 1661 1 1 12 ASP H H 3.320 2.705 1.358 1.00 . A A . 12 ASP H 1 1 6 1662 1 1 12 ASP HA H 0.879 1.419 1.984 1.00 . A A . 12 ASP HA 1 1 6 1663 1 1 12 ASP HB2 H 2.294 2.380 3.764 1.00 . A A . 12 ASP HB2 1 1 6 1664 1 1 12 ASP HB3 H 2.015 3.993 3.120 1.00 . A A . 12 ASP HB3 1 1 6 1665 1 1 12 ASP N N 2.499 2.258 1.061 1.00 . A A . 12 ASP N 1 1 6 1666 1 1 12 ASP O O -0.912 3.186 1.357 1.00 . A A . 12 ASP O 1 1 6 1667 1 1 12 ASP OD1 O -0.189 2.109 4.610 1.00 . A A . 12 ASP OD1 1 1 6 1668 1 1 12 ASP OD2 O -0.137 4.276 4.344 1.00 . A A . 12 ASP OD2 1 1 6 1669 1 1 13 LYS C C -1.007 3.853 -1.445 1.00 . A A . 13 LYS C 1 1 6 1670 1 1 13 LYS CA C -0.092 4.805 -0.698 1.00 . A A . 13 LYS CA 1 1 6 1671 1 1 13 LYS CB C 0.680 5.654 -1.700 1.00 . A A . 13 LYS CB 1 1 6 1672 1 1 13 LYS CD C -1.040 7.492 -1.978 1.00 . A A . 13 LYS CD 1 1 6 1673 1 1 13 LYS CE C -2.104 8.062 -2.907 1.00 . A A . 13 LYS CE 1 1 6 1674 1 1 13 LYS CG C -0.237 6.394 -2.667 1.00 . A A . 13 LYS CG 1 1 6 1675 1 1 13 LYS H H 1.759 4.079 0.071 1.00 . A A . 13 LYS H 1 1 6 1676 1 1 13 LYS HA H -0.696 5.444 -0.072 1.00 . A A . 13 LYS HA 1 1 6 1677 1 1 13 LYS HB2 H 1.283 6.374 -1.168 1.00 . A A . 13 LYS HB2 1 1 6 1678 1 1 13 LYS HB3 H 1.321 5.005 -2.277 1.00 . A A . 13 LYS HB3 1 1 6 1679 1 1 13 LYS HD2 H -1.526 7.083 -1.106 1.00 . A A . 13 LYS HD2 1 1 6 1680 1 1 13 LYS HD3 H -0.370 8.285 -1.679 1.00 . A A . 13 LYS HD3 1 1 6 1681 1 1 13 LYS HE2 H -2.867 7.316 -3.068 1.00 . A A . 13 LYS HE2 1 1 6 1682 1 1 13 LYS HE3 H -2.547 8.924 -2.431 1.00 . A A . 13 LYS HE3 1 1 6 1683 1 1 13 LYS HG2 H 0.346 6.820 -3.467 1.00 . A A . 13 LYS HG2 1 1 6 1684 1 1 13 LYS HG3 H -0.925 5.676 -3.086 1.00 . A A . 13 LYS HG3 1 1 6 1685 1 1 13 LYS HZ1 H -2.288 8.879 -4.817 1.00 . A A . 13 LYS HZ1 1 1 6 1686 1 1 13 LYS HZ2 H -1.192 7.637 -4.728 1.00 . A A . 13 LYS HZ2 1 1 6 1687 1 1 13 LYS HZ3 H -0.778 9.161 -4.119 1.00 . A A . 13 LYS HZ3 1 1 6 1688 1 1 13 LYS N N 0.784 4.042 0.163 1.00 . A A . 13 LYS N 1 1 6 1689 1 1 13 LYS NZ N -1.547 8.470 -4.213 1.00 . A A . 13 LYS NZ 1 1 6 1690 1 1 13 LYS O O -2.223 3.952 -1.336 1.00 . A A . 13 LYS O 1 1 6 1691 1 1 14 LEU C C -1.882 0.982 -1.949 1.00 . A A . 14 LEU C 1 1 6 1692 1 1 14 LEU CA C -1.194 1.928 -2.879 1.00 . A A . 14 LEU CA 1 1 6 1693 1 1 14 LEU CB C -0.393 1.161 -3.938 1.00 . A A . 14 LEU CB 1 1 6 1694 1 1 14 LEU CD1 C -1.648 1.984 -5.978 1.00 . A A . 14 LEU CD1 1 1 6 1695 1 1 14 LEU CD2 C 0.478 3.100 -5.298 1.00 . A A . 14 LEU CD2 1 1 6 1696 1 1 14 LEU CG C -0.277 1.795 -5.339 1.00 . A A . 14 LEU CG 1 1 6 1697 1 1 14 LEU H H 0.565 2.841 -2.198 1.00 . A A . 14 LEU H 1 1 6 1698 1 1 14 LEU HA H -1.968 2.488 -3.381 1.00 . A A . 14 LEU HA 1 1 6 1699 1 1 14 LEU HB2 H 0.607 1.022 -3.555 1.00 . A A . 14 LEU HB2 1 1 6 1700 1 1 14 LEU HB3 H -0.845 0.186 -4.050 1.00 . A A . 14 LEU HB3 1 1 6 1701 1 1 14 LEU HD11 H -1.526 2.388 -6.971 1.00 . A A . 14 LEU HD11 1 1 6 1702 1 1 14 LEU HD12 H -2.236 2.672 -5.389 1.00 . A A . 14 LEU HD12 1 1 6 1703 1 1 14 LEU HD13 H -2.154 1.032 -6.037 1.00 . A A . 14 LEU HD13 1 1 6 1704 1 1 14 LEU HD21 H 0.509 3.520 -6.291 1.00 . A A . 14 LEU HD21 1 1 6 1705 1 1 14 LEU HD22 H 1.483 2.902 -4.956 1.00 . A A . 14 LEU HD22 1 1 6 1706 1 1 14 LEU HD23 H -0.013 3.784 -4.623 1.00 . A A . 14 LEU HD23 1 1 6 1707 1 1 14 LEU HG H 0.267 1.108 -5.972 1.00 . A A . 14 LEU HG 1 1 6 1708 1 1 14 LEU N N -0.416 2.905 -2.158 1.00 . A A . 14 LEU N 1 1 6 1709 1 1 14 LEU O O -2.943 0.509 -2.262 1.00 . A A . 14 LEU O 1 1 6 1710 1 1 15 TRP C C -3.275 0.398 0.540 1.00 . A A . 15 TRP C 1 1 6 1711 1 1 15 TRP CA C -1.897 -0.147 0.211 1.00 . A A . 15 TRP CA 1 1 6 1712 1 1 15 TRP CB C -1.056 -0.175 1.509 1.00 . A A . 15 TRP CB 1 1 6 1713 1 1 15 TRP CD1 C -0.492 -2.230 2.909 1.00 . A A . 15 TRP CD1 1 1 6 1714 1 1 15 TRP CD2 C -2.558 -1.513 3.256 1.00 . A A . 15 TRP CD2 1 1 6 1715 1 1 15 TRP CE2 C -2.336 -2.638 4.061 1.00 . A A . 15 TRP CE2 1 1 6 1716 1 1 15 TRP CE3 C -3.784 -0.901 3.311 1.00 . A A . 15 TRP CE3 1 1 6 1717 1 1 15 TRP CG C -1.354 -1.270 2.518 1.00 . A A . 15 TRP CG 1 1 6 1718 1 1 15 TRP CH2 C -4.515 -2.503 4.920 1.00 . A A . 15 TRP CH2 1 1 6 1719 1 1 15 TRP CZ2 C -3.313 -3.148 4.910 1.00 . A A . 15 TRP CZ2 1 1 6 1720 1 1 15 TRP CZ3 C -4.736 -1.394 4.126 1.00 . A A . 15 TRP CZ3 1 1 6 1721 1 1 15 TRP H H -0.402 1.116 -0.613 1.00 . A A . 15 TRP H 1 1 6 1722 1 1 15 TRP HA H -1.935 -1.128 -0.239 1.00 . A A . 15 TRP HA 1 1 6 1723 1 1 15 TRP HB2 H -0.023 -0.308 1.248 1.00 . A A . 15 TRP HB2 1 1 6 1724 1 1 15 TRP HB3 H -1.172 0.776 2.011 1.00 . A A . 15 TRP HB3 1 1 6 1725 1 1 15 TRP HD1 H 0.517 -2.312 2.533 1.00 . A A . 15 TRP HD1 1 1 6 1726 1 1 15 TRP HE1 H -0.615 -3.817 4.254 1.00 . A A . 15 TRP HE1 1 1 6 1727 1 1 15 TRP HE3 H -3.992 -0.033 2.704 1.00 . A A . 15 TRP HE3 1 1 6 1728 1 1 15 TRP HH2 H -5.337 -2.829 5.538 1.00 . A A . 15 TRP HH2 1 1 6 1729 1 1 15 TRP HZ2 H -3.143 -4.014 5.531 1.00 . A A . 15 TRP HZ2 1 1 6 1730 1 1 15 TRP HZ3 H -5.690 -0.903 4.131 1.00 . A A . 15 TRP HZ3 1 1 6 1731 1 1 15 TRP N N -1.289 0.729 -0.788 1.00 . A A . 15 TRP N 1 1 6 1732 1 1 15 TRP NE1 N -1.061 -3.049 3.832 1.00 . A A . 15 TRP NE1 1 1 6 1733 1 1 15 TRP O O -4.291 -0.299 0.404 1.00 . A A . 15 TRP O 1 1 6 1734 1 1 16 GLN C C -5.500 2.597 0.166 1.00 . A A . 16 GLN C 1 1 6 1735 1 1 16 GLN CA C -4.540 2.337 1.326 1.00 . A A . 16 GLN CA 1 1 6 1736 1 1 16 GLN CB C -4.234 3.647 2.059 1.00 . A A . 16 GLN CB 1 1 6 1737 1 1 16 GLN CD C -3.822 2.500 4.282 1.00 . A A . 16 GLN CD 1 1 6 1738 1 1 16 GLN CG C -3.312 3.485 3.260 1.00 . A A . 16 GLN CG 1 1 6 1739 1 1 16 GLN H H -2.478 2.194 0.863 1.00 . A A . 16 GLN H 1 1 6 1740 1 1 16 GLN HA H -5.005 1.661 2.028 1.00 . A A . 16 GLN HA 1 1 6 1741 1 1 16 GLN HB2 H -3.770 4.335 1.367 1.00 . A A . 16 GLN HB2 1 1 6 1742 1 1 16 GLN HB3 H -5.165 4.070 2.403 1.00 . A A . 16 GLN HB3 1 1 6 1743 1 1 16 GLN HE21 H -1.960 2.008 4.757 1.00 . A A . 16 GLN HE21 1 1 6 1744 1 1 16 GLN HE22 H -3.195 1.164 5.612 1.00 . A A . 16 GLN HE22 1 1 6 1745 1 1 16 GLN HG2 H -2.358 3.127 2.905 1.00 . A A . 16 GLN HG2 1 1 6 1746 1 1 16 GLN HG3 H -3.183 4.446 3.735 1.00 . A A . 16 GLN HG3 1 1 6 1747 1 1 16 GLN N N -3.315 1.675 0.892 1.00 . A A . 16 GLN N 1 1 6 1748 1 1 16 GLN NE2 N -2.917 1.832 4.951 1.00 . A A . 16 GLN NE2 1 1 6 1749 1 1 16 GLN O O -6.545 3.223 0.339 1.00 . A A . 16 GLN O 1 1 6 1750 1 1 16 GLN OE1 O -5.033 2.330 4.459 1.00 . A A . 16 GLN OE1 1 1 6 1751 1 1 17 ILE C C -6.304 0.812 -2.681 1.00 . A A . 17 ILE C 1 1 6 1752 1 1 17 ILE CA C -5.937 2.240 -2.186 1.00 . A A . 17 ILE CA 1 1 6 1753 1 1 17 ILE CB C -5.152 3.053 -3.293 1.00 . A A . 17 ILE CB 1 1 6 1754 1 1 17 ILE CD1 C -6.114 5.314 -2.496 1.00 . A A . 17 ILE CD1 1 1 6 1755 1 1 17 ILE CG1 C -4.875 4.501 -2.828 1.00 . A A . 17 ILE CG1 1 1 6 1756 1 1 17 ILE CG2 C -5.860 3.065 -4.637 1.00 . A A . 17 ILE CG2 1 1 6 1757 1 1 17 ILE H H -4.246 1.719 -1.076 1.00 . A A . 17 ILE H 1 1 6 1758 1 1 17 ILE HA H -6.844 2.767 -1.934 1.00 . A A . 17 ILE HA 1 1 6 1759 1 1 17 ILE HB H -4.196 2.571 -3.439 1.00 . A A . 17 ILE HB 1 1 6 1760 1 1 17 ILE HD11 H -6.768 5.336 -3.355 1.00 . A A . 17 ILE HD11 1 1 6 1761 1 1 17 ILE HD12 H -5.820 6.323 -2.244 1.00 . A A . 17 ILE HD12 1 1 6 1762 1 1 17 ILE HD13 H -6.630 4.871 -1.656 1.00 . A A . 17 ILE HD13 1 1 6 1763 1 1 17 ILE HG12 H -4.264 4.468 -1.939 1.00 . A A . 17 ILE HG12 1 1 6 1764 1 1 17 ILE HG13 H -4.334 5.018 -3.604 1.00 . A A . 17 ILE HG13 1 1 6 1765 1 1 17 ILE HG21 H -5.255 3.591 -5.359 1.00 . A A . 17 ILE HG21 1 1 6 1766 1 1 17 ILE HG22 H -6.806 3.575 -4.532 1.00 . A A . 17 ILE HG22 1 1 6 1767 1 1 17 ILE HG23 H -6.027 2.052 -4.970 1.00 . A A . 17 ILE HG23 1 1 6 1768 1 1 17 ILE N N -5.131 2.137 -0.998 1.00 . A A . 17 ILE N 1 1 6 1769 1 1 17 ILE O O -7.241 0.617 -3.450 1.00 . A A . 17 ILE O 1 1 6 1770 1 1 18 TYR C C -6.403 -2.464 -1.558 1.00 . A A . 18 TYR C 1 1 6 1771 1 1 18 TYR CA C -5.744 -1.552 -2.612 1.00 . A A . 18 TYR CA 1 1 6 1772 1 1 18 TYR CB C -4.346 -2.041 -3.114 1.00 . A A . 18 TYR CB 1 1 6 1773 1 1 18 TYR CD1 C -3.153 -3.055 -1.149 1.00 . A A . 18 TYR CD1 1 1 6 1774 1 1 18 TYR CD2 C -3.362 -4.360 -3.108 1.00 . A A . 18 TYR CD2 1 1 6 1775 1 1 18 TYR CE1 C -2.422 -4.049 -0.553 1.00 . A A . 18 TYR CE1 1 1 6 1776 1 1 18 TYR CE2 C -2.646 -5.374 -2.515 1.00 . A A . 18 TYR CE2 1 1 6 1777 1 1 18 TYR CG C -3.636 -3.185 -2.423 1.00 . A A . 18 TYR CG 1 1 6 1778 1 1 18 TYR CZ C -2.177 -5.212 -1.238 1.00 . A A . 18 TYR CZ 1 1 6 1779 1 1 18 TYR H H -4.951 0.018 -1.451 1.00 . A A . 18 TYR H 1 1 6 1780 1 1 18 TYR HA H -6.407 -1.515 -3.463 1.00 . A A . 18 TYR HA 1 1 6 1781 1 1 18 TYR HB2 H -4.365 -2.309 -4.150 1.00 . A A . 18 TYR HB2 1 1 6 1782 1 1 18 TYR HB3 H -3.690 -1.185 -3.036 1.00 . A A . 18 TYR HB3 1 1 6 1783 1 1 18 TYR HD1 H -3.398 -2.144 -0.625 1.00 . A A . 18 TYR HD1 1 1 6 1784 1 1 18 TYR HD2 H -3.733 -4.481 -4.114 1.00 . A A . 18 TYR HD2 1 1 6 1785 1 1 18 TYR HE1 H -2.054 -3.917 0.452 1.00 . A A . 18 TYR HE1 1 1 6 1786 1 1 18 TYR HE2 H -2.454 -6.289 -3.055 1.00 . A A . 18 TYR HE2 1 1 6 1787 1 1 18 TYR HH H -1.785 -6.379 0.235 1.00 . A A . 18 TYR HH 1 1 6 1788 1 1 18 TYR N N -5.605 -0.181 -2.155 1.00 . A A . 18 TYR N 1 1 6 1789 1 1 18 TYR O O -7.193 -3.340 -1.894 1.00 . A A . 18 TYR O 1 1 6 1790 1 1 18 TYR OH O -1.439 -6.210 -0.648 1.00 . A A . 18 TYR OH 1 1 6 1791 1 1 19 LEU C C -7.570 -2.202 1.659 1.00 . A A . 19 LEU C 1 1 6 1792 1 1 19 LEU CA C -6.682 -3.041 0.795 1.00 . A A . 19 LEU CA 1 1 6 1793 1 1 19 LEU CB C -5.608 -3.671 1.655 1.00 . A A . 19 LEU CB 1 1 6 1794 1 1 19 LEU CD1 C -3.974 -5.428 2.171 1.00 . A A . 19 LEU CD1 1 1 6 1795 1 1 19 LEU CD2 C -6.202 -6.040 1.321 1.00 . A A . 19 LEU CD2 1 1 6 1796 1 1 19 LEU CG C -5.090 -5.028 1.241 1.00 . A A . 19 LEU CG 1 1 6 1797 1 1 19 LEU H H -5.433 -1.554 -0.071 1.00 . A A . 19 LEU H 1 1 6 1798 1 1 19 LEU HA H -7.272 -3.825 0.348 1.00 . A A . 19 LEU HA 1 1 6 1799 1 1 19 LEU HB2 H -4.767 -2.994 1.619 1.00 . A A . 19 LEU HB2 1 1 6 1800 1 1 19 LEU HB3 H -5.967 -3.726 2.672 1.00 . A A . 19 LEU HB3 1 1 6 1801 1 1 19 LEU HD11 H -3.211 -4.666 2.124 1.00 . A A . 19 LEU HD11 1 1 6 1802 1 1 19 LEU HD12 H -3.566 -6.379 1.864 1.00 . A A . 19 LEU HD12 1 1 6 1803 1 1 19 LEU HD13 H -4.360 -5.487 3.177 1.00 . A A . 19 LEU HD13 1 1 6 1804 1 1 19 LEU HD21 H -6.590 -6.022 2.330 1.00 . A A . 19 LEU HD21 1 1 6 1805 1 1 19 LEU HD22 H -5.819 -7.023 1.089 1.00 . A A . 19 LEU HD22 1 1 6 1806 1 1 19 LEU HD23 H -6.988 -5.779 0.629 1.00 . A A . 19 LEU HD23 1 1 6 1807 1 1 19 LEU HG H -4.719 -4.998 0.228 1.00 . A A . 19 LEU HG 1 1 6 1808 1 1 19 LEU N N -6.092 -2.251 -0.296 1.00 . A A . 19 LEU N 1 1 6 1809 1 1 19 LEU O O -8.158 -2.679 2.632 1.00 . A A . 19 LEU O 1 1 6 1810 1 1 20 ASN C C -9.441 0.562 1.090 1.00 . A A . 20 ASN C 1 1 6 1811 1 1 20 ASN CA C -8.454 -0.041 2.044 1.00 . A A . 20 ASN CA 1 1 6 1812 1 1 20 ASN CB C -7.606 1.013 2.756 1.00 . A A . 20 ASN CB 1 1 6 1813 1 1 20 ASN CG C -8.406 2.182 3.295 1.00 . A A . 20 ASN CG 1 1 6 1814 1 1 20 ASN H H -7.117 -0.671 0.564 1.00 . A A . 20 ASN H 1 1 6 1815 1 1 20 ASN HA H -8.993 -0.617 2.783 1.00 . A A . 20 ASN HA 1 1 6 1816 1 1 20 ASN HB2 H -7.098 0.548 3.588 1.00 . A A . 20 ASN HB2 1 1 6 1817 1 1 20 ASN HB3 H -6.872 1.381 2.058 1.00 . A A . 20 ASN HB3 1 1 6 1818 1 1 20 ASN HD21 H -7.930 3.239 1.712 1.00 . A A . 20 ASN HD21 1 1 6 1819 1 1 20 ASN HD22 H -8.939 4.043 2.865 1.00 . A A . 20 ASN HD22 1 1 6 1820 1 1 20 ASN N N -7.634 -0.974 1.338 1.00 . A A . 20 ASN N 1 1 6 1821 1 1 20 ASN ND2 N -8.430 3.263 2.560 1.00 . A A . 20 ASN ND2 1 1 6 1822 1 1 20 ASN O O -9.039 1.370 0.239 1.00 . A A . 20 ASN O 1 1 6 1823 1 1 20 ASN OXT O -10.612 0.177 1.143 1.00 . A A . 20 ASN OXT 1 1 6 1824 1 1 20 ASN OD1 O -8.953 2.128 4.392 1.00 . A A . 20 ASN OD1 1 1 7 1825 1 1 1 SER C C 2.916 -2.680 -5.071 1.00 . A A . 1 SER C 1 1 7 1826 1 1 1 SER CA C 2.013 -1.710 -5.828 1.00 . A A . 1 SER CA 1 1 7 1827 1 1 1 SER CB C 0.544 -1.924 -5.476 1.00 . A A . 1 SER CB 1 1 7 1828 1 1 1 SER H1 H 1.867 -2.870 -7.456 1.00 . A A . 1 SER H1 1 1 7 1829 1 1 1 SER H2 H 3.169 -1.797 -7.505 1.00 . A A . 1 SER H2 1 1 7 1830 1 1 1 SER H3 H 1.593 -1.228 -7.782 1.00 . A A . 1 SER H3 1 1 7 1831 1 1 1 SER HA H 2.292 -0.698 -5.578 1.00 . A A . 1 SER HA 1 1 7 1832 1 1 1 SER HB2 H 0.441 -2.013 -4.405 1.00 . A A . 1 SER HB2 1 1 7 1833 1 1 1 SER HB3 H -0.038 -1.085 -5.829 1.00 . A A . 1 SER HB3 1 1 7 1834 1 1 1 SER HG H -0.783 -2.913 -6.527 1.00 . A A . 1 SER HG 1 1 7 1835 1 1 1 SER N N 2.169 -1.900 -7.242 1.00 . A A . 1 SER N 1 1 7 1836 1 1 1 SER O O 2.906 -3.892 -5.345 1.00 . A A . 1 SER O 1 1 7 1837 1 1 1 SER OG O 0.054 -3.115 -6.088 1.00 . A A . 1 SER OG 1 1 7 1838 1 1 2 PRO C C 3.821 -3.703 -2.245 1.00 . A A . 2 PRO C 1 1 7 1839 1 1 2 PRO CA C 4.623 -3.005 -3.347 1.00 . A A . 2 PRO CA 1 1 7 1840 1 1 2 PRO CB C 5.629 -2.015 -2.739 1.00 . A A . 2 PRO CB 1 1 7 1841 1 1 2 PRO CD C 3.931 -0.725 -3.856 1.00 . A A . 2 PRO CD 1 1 7 1842 1 1 2 PRO CG C 4.925 -0.699 -2.722 1.00 . A A . 2 PRO CG 1 1 7 1843 1 1 2 PRO HA H 5.137 -3.739 -3.950 1.00 . A A . 2 PRO HA 1 1 7 1844 1 1 2 PRO HB2 H 5.887 -2.336 -1.740 1.00 . A A . 2 PRO HB2 1 1 7 1845 1 1 2 PRO HB3 H 6.519 -1.979 -3.348 1.00 . A A . 2 PRO HB3 1 1 7 1846 1 1 2 PRO HD2 H 2.996 -0.286 -3.542 1.00 . A A . 2 PRO HD2 1 1 7 1847 1 1 2 PRO HD3 H 4.325 -0.199 -4.713 1.00 . A A . 2 PRO HD3 1 1 7 1848 1 1 2 PRO HG2 H 4.413 -0.572 -1.780 1.00 . A A . 2 PRO HG2 1 1 7 1849 1 1 2 PRO HG3 H 5.639 0.098 -2.868 1.00 . A A . 2 PRO HG3 1 1 7 1850 1 1 2 PRO N N 3.758 -2.166 -4.159 1.00 . A A . 2 PRO N 1 1 7 1851 1 1 2 PRO O O 3.187 -3.042 -1.437 1.00 . A A . 2 PRO O 1 1 7 1852 1 1 3 PRO C C 3.395 -5.475 0.283 1.00 . A A . 3 PRO C 1 1 7 1853 1 1 3 PRO CA C 3.090 -5.839 -1.211 1.00 . A A . 3 PRO CA 1 1 7 1854 1 1 3 PRO CB C 3.464 -7.286 -1.535 1.00 . A A . 3 PRO CB 1 1 7 1855 1 1 3 PRO CD C 4.441 -5.930 -3.232 1.00 . A A . 3 PRO CD 1 1 7 1856 1 1 3 PRO CG C 3.775 -7.255 -2.985 1.00 . A A . 3 PRO CG 1 1 7 1857 1 1 3 PRO HA H 2.031 -5.715 -1.349 1.00 . A A . 3 PRO HA 1 1 7 1858 1 1 3 PRO HB2 H 4.318 -7.583 -0.947 1.00 . A A . 3 PRO HB2 1 1 7 1859 1 1 3 PRO HB3 H 2.630 -7.938 -1.326 1.00 . A A . 3 PRO HB3 1 1 7 1860 1 1 3 PRO HD2 H 5.506 -6.001 -3.065 1.00 . A A . 3 PRO HD2 1 1 7 1861 1 1 3 PRO HD3 H 4.235 -5.587 -4.236 1.00 . A A . 3 PRO HD3 1 1 7 1862 1 1 3 PRO HG2 H 4.436 -8.071 -3.236 1.00 . A A . 3 PRO HG2 1 1 7 1863 1 1 3 PRO HG3 H 2.861 -7.327 -3.556 1.00 . A A . 3 PRO HG3 1 1 7 1864 1 1 3 PRO N N 3.804 -5.050 -2.234 1.00 . A A . 3 PRO N 1 1 7 1865 1 1 3 PRO O O 2.457 -5.413 1.089 1.00 . A A . 3 PRO O 1 1 7 1866 1 1 4 PRO C C 4.578 -3.415 2.313 1.00 . A A . 4 PRO C 1 1 7 1867 1 1 4 PRO CA C 4.962 -4.861 2.063 1.00 . A A . 4 PRO CA 1 1 7 1868 1 1 4 PRO CB C 6.471 -5.071 2.227 1.00 . A A . 4 PRO CB 1 1 7 1869 1 1 4 PRO CD C 5.894 -5.316 -0.119 1.00 . A A . 4 PRO CD 1 1 7 1870 1 1 4 PRO CG C 7.037 -5.208 0.849 1.00 . A A . 4 PRO CG 1 1 7 1871 1 1 4 PRO HA H 4.416 -5.476 2.765 1.00 . A A . 4 PRO HA 1 1 7 1872 1 1 4 PRO HB2 H 6.893 -4.220 2.739 1.00 . A A . 4 PRO HB2 1 1 7 1873 1 1 4 PRO HB3 H 6.648 -5.961 2.813 1.00 . A A . 4 PRO HB3 1 1 7 1874 1 1 4 PRO HD2 H 5.895 -4.493 -0.817 1.00 . A A . 4 PRO HD2 1 1 7 1875 1 1 4 PRO HD3 H 5.893 -6.244 -0.672 1.00 . A A . 4 PRO HD3 1 1 7 1876 1 1 4 PRO HG2 H 7.629 -4.336 0.614 1.00 . A A . 4 PRO HG2 1 1 7 1877 1 1 4 PRO HG3 H 7.656 -6.091 0.794 1.00 . A A . 4 PRO HG3 1 1 7 1878 1 1 4 PRO N N 4.676 -5.239 0.697 1.00 . A A . 4 PRO N 1 1 7 1879 1 1 4 PRO O O 5.170 -2.496 1.724 1.00 . A A . 4 PRO O 1 1 7 1880 1 1 5 ARG C C 4.109 -0.953 3.900 1.00 . A A . 5 ARG C 1 1 7 1881 1 1 5 ARG CA C 3.012 -1.930 3.505 1.00 . A A . 5 ARG CA 1 1 7 1882 1 1 5 ARG CB C 2.005 -2.078 4.639 1.00 . A A . 5 ARG CB 1 1 7 1883 1 1 5 ARG CD C 0.408 -0.987 6.209 1.00 . A A . 5 ARG CD 1 1 7 1884 1 1 5 ARG CG C 1.325 -0.791 5.023 1.00 . A A . 5 ARG CG 1 1 7 1885 1 1 5 ARG CZ C -0.971 0.470 7.682 1.00 . A A . 5 ARG CZ 1 1 7 1886 1 1 5 ARG H H 3.206 -4.024 3.618 1.00 . A A . 5 ARG H 1 1 7 1887 1 1 5 ARG HA H 2.501 -1.554 2.631 1.00 . A A . 5 ARG HA 1 1 7 1888 1 1 5 ARG HB2 H 1.246 -2.787 4.341 1.00 . A A . 5 ARG HB2 1 1 7 1889 1 1 5 ARG HB3 H 2.518 -2.461 5.507 1.00 . A A . 5 ARG HB3 1 1 7 1890 1 1 5 ARG HD2 H -0.338 -1.729 5.962 1.00 . A A . 5 ARG HD2 1 1 7 1891 1 1 5 ARG HD3 H 0.995 -1.328 7.047 1.00 . A A . 5 ARG HD3 1 1 7 1892 1 1 5 ARG HE H -0.160 0.983 5.911 1.00 . A A . 5 ARG HE 1 1 7 1893 1 1 5 ARG HG2 H 2.090 -0.075 5.279 1.00 . A A . 5 ARG HG2 1 1 7 1894 1 1 5 ARG HG3 H 0.752 -0.428 4.183 1.00 . A A . 5 ARG HG3 1 1 7 1895 1 1 5 ARG HH11 H -0.617 -1.362 8.541 1.00 . A A . 5 ARG HH11 1 1 7 1896 1 1 5 ARG HH12 H -1.607 -0.317 9.454 1.00 . A A . 5 ARG HH12 1 1 7 1897 1 1 5 ARG HH21 H -1.477 2.355 7.160 1.00 . A A . 5 ARG HH21 1 1 7 1898 1 1 5 ARG HH22 H -2.122 1.854 8.660 1.00 . A A . 5 ARG HH22 1 1 7 1899 1 1 5 ARG N N 3.576 -3.234 3.173 1.00 . A A . 5 ARG N 1 1 7 1900 1 1 5 ARG NE N -0.255 0.258 6.573 1.00 . A A . 5 ARG NE 1 1 7 1901 1 1 5 ARG NH1 N -1.068 -0.468 8.619 1.00 . A A . 5 ARG NH1 1 1 7 1902 1 1 5 ARG NH2 N -1.564 1.636 7.854 1.00 . A A . 5 ARG NH2 1 1 7 1903 1 1 5 ARG O O 4.872 -1.201 4.841 1.00 . A A . 5 ARG O 1 1 7 1904 1 1 6 GLY C C 6.313 0.811 2.380 1.00 . A A . 6 GLY C 1 1 7 1905 1 1 6 GLY CA C 5.235 1.075 3.389 1.00 . A A . 6 GLY CA 1 1 7 1906 1 1 6 GLY H H 3.507 0.318 2.502 1.00 . A A . 6 GLY H 1 1 7 1907 1 1 6 GLY HA2 H 4.863 2.083 3.289 1.00 . A A . 6 GLY HA2 1 1 7 1908 1 1 6 GLY HA3 H 5.645 0.938 4.378 1.00 . A A . 6 GLY HA3 1 1 7 1909 1 1 6 GLY N N 4.180 0.137 3.191 1.00 . A A . 6 GLY N 1 1 7 1910 1 1 6 GLY O O 6.031 0.789 1.178 1.00 . A A . 6 GLY O 1 1 7 1911 1 1 7 SER C C 9.153 1.371 1.117 1.00 . A A . 7 SER C 1 1 7 1912 1 1 7 SER CA C 8.707 0.226 2.056 1.00 . A A . 7 SER CA 1 1 7 1913 1 1 7 SER CB C 8.442 -1.073 1.276 1.00 . A A . 7 SER CB 1 1 7 1914 1 1 7 SER H H 7.656 0.639 3.834 1.00 . A A . 7 SER H 1 1 7 1915 1 1 7 SER HA H 9.519 0.047 2.745 1.00 . A A . 7 SER HA 1 1 7 1916 1 1 7 SER HB2 H 7.684 -0.895 0.528 1.00 . A A . 7 SER HB2 1 1 7 1917 1 1 7 SER HB3 H 9.349 -1.405 0.796 1.00 . A A . 7 SER HB3 1 1 7 1918 1 1 7 SER HG H 7.020 -2.068 2.123 1.00 . A A . 7 SER HG 1 1 7 1919 1 1 7 SER N N 7.529 0.577 2.865 1.00 . A A . 7 SER N 1 1 7 1920 1 1 7 SER O O 10.211 1.986 1.307 1.00 . A A . 7 SER O 1 1 7 1921 1 1 7 SER OG O 7.988 -2.100 2.152 1.00 . A A . 7 SER OG 1 1 7 1922 1 1 8 SER C C 7.594 3.782 -0.661 1.00 . A A . 8 SER C 1 1 7 1923 1 1 8 SER CA C 8.621 2.666 -0.824 1.00 . A A . 8 SER CA 1 1 7 1924 1 1 8 SER CB C 8.538 2.054 -2.220 1.00 . A A . 8 SER CB 1 1 7 1925 1 1 8 SER H H 7.478 1.191 0.093 1.00 . A A . 8 SER H 1 1 7 1926 1 1 8 SER HA H 9.617 3.045 -0.658 1.00 . A A . 8 SER HA 1 1 7 1927 1 1 8 SER HB2 H 7.518 1.763 -2.425 1.00 . A A . 8 SER HB2 1 1 7 1928 1 1 8 SER HB3 H 8.867 2.774 -2.954 1.00 . A A . 8 SER HB3 1 1 7 1929 1 1 8 SER HG H 9.811 0.809 -1.444 1.00 . A A . 8 SER HG 1 1 7 1930 1 1 8 SER N N 8.345 1.657 0.139 1.00 . A A . 8 SER N 1 1 7 1931 1 1 8 SER O O 6.403 3.577 -0.937 1.00 . A A . 8 SER O 1 1 7 1932 1 1 8 SER OG O 9.373 0.902 -2.301 1.00 . A A . 8 SER OG 1 1 7 1933 1 1 9 PRO C C 6.463 6.478 -1.265 1.00 . A A . 9 PRO C 1 1 7 1934 1 1 9 PRO CA C 7.139 6.109 0.046 1.00 . A A . 9 PRO CA 1 1 7 1935 1 1 9 PRO CB C 8.095 7.212 0.490 1.00 . A A . 9 PRO CB 1 1 7 1936 1 1 9 PRO CD C 9.391 5.237 0.328 1.00 . A A . 9 PRO CD 1 1 7 1937 1 1 9 PRO CG C 9.209 6.482 1.138 1.00 . A A . 9 PRO CG 1 1 7 1938 1 1 9 PRO HA H 6.392 5.924 0.804 1.00 . A A . 9 PRO HA 1 1 7 1939 1 1 9 PRO HB2 H 8.432 7.766 -0.375 1.00 . A A . 9 PRO HB2 1 1 7 1940 1 1 9 PRO HB3 H 7.598 7.872 1.183 1.00 . A A . 9 PRO HB3 1 1 7 1941 1 1 9 PRO HD2 H 10.055 5.415 -0.505 1.00 . A A . 9 PRO HD2 1 1 7 1942 1 1 9 PRO HD3 H 9.760 4.435 0.949 1.00 . A A . 9 PRO HD3 1 1 7 1943 1 1 9 PRO HG2 H 10.105 7.085 1.117 1.00 . A A . 9 PRO HG2 1 1 7 1944 1 1 9 PRO HG3 H 8.946 6.232 2.155 1.00 . A A . 9 PRO HG3 1 1 7 1945 1 1 9 PRO N N 8.019 4.951 -0.137 1.00 . A A . 9 PRO N 1 1 7 1946 1 1 9 PRO O O 7.129 6.709 -2.283 1.00 . A A . 9 PRO O 1 1 7 1947 1 1 10 GLY C C 3.544 5.528 -2.730 1.00 . A A . 10 GLY C 1 1 7 1948 1 1 10 GLY CA C 4.405 6.723 -2.438 1.00 . A A . 10 GLY CA 1 1 7 1949 1 1 10 GLY H H 4.683 6.343 -0.408 1.00 . A A . 10 GLY H 1 1 7 1950 1 1 10 GLY HA2 H 3.781 7.593 -2.296 1.00 . A A . 10 GLY HA2 1 1 7 1951 1 1 10 GLY HA3 H 5.074 6.886 -3.269 1.00 . A A . 10 GLY HA3 1 1 7 1952 1 1 10 GLY N N 5.167 6.488 -1.250 1.00 . A A . 10 GLY N 1 1 7 1953 1 1 10 GLY O O 2.324 5.641 -2.858 1.00 . A A . 10 GLY O 1 1 7 1954 1 1 11 GLY C C 2.538 2.765 -1.921 1.00 . A A . 11 GLY C 1 1 7 1955 1 1 11 GLY CA C 3.482 3.127 -3.031 1.00 . A A . 11 GLY CA 1 1 7 1956 1 1 11 GLY H H 5.142 4.339 -2.568 1.00 . A A . 11 GLY H 1 1 7 1957 1 1 11 GLY HA2 H 2.919 3.239 -3.945 1.00 . A A . 11 GLY HA2 1 1 7 1958 1 1 11 GLY HA3 H 4.203 2.332 -3.149 1.00 . A A . 11 GLY HA3 1 1 7 1959 1 1 11 GLY N N 4.179 4.361 -2.753 1.00 . A A . 11 GLY N 1 1 7 1960 1 1 11 GLY O O 1.521 2.114 -2.151 1.00 . A A . 11 GLY O 1 1 7 1961 1 1 12 ASP C C 0.681 3.636 0.325 1.00 . A A . 12 ASP C 1 1 7 1962 1 1 12 ASP CA C 2.045 2.986 0.456 1.00 . A A . 12 ASP CA 1 1 7 1963 1 1 12 ASP CB C 2.756 3.441 1.731 1.00 . A A . 12 ASP CB 1 1 7 1964 1 1 12 ASP CG C 1.849 3.456 2.962 1.00 . A A . 12 ASP CG 1 1 7 1965 1 1 12 ASP H H 3.705 3.718 -0.649 1.00 . A A . 12 ASP H 1 1 7 1966 1 1 12 ASP HA H 1.889 1.919 0.515 1.00 . A A . 12 ASP HA 1 1 7 1967 1 1 12 ASP HB2 H 3.549 2.731 1.912 1.00 . A A . 12 ASP HB2 1 1 7 1968 1 1 12 ASP HB3 H 3.177 4.425 1.586 1.00 . A A . 12 ASP HB3 1 1 7 1969 1 1 12 ASP N N 2.868 3.215 -0.725 1.00 . A A . 12 ASP N 1 1 7 1970 1 1 12 ASP O O -0.307 3.045 0.693 1.00 . A A . 12 ASP O 1 1 7 1971 1 1 12 ASP OD1 O 1.564 2.382 3.533 1.00 . A A . 12 ASP OD1 1 1 7 1972 1 1 12 ASP OD2 O 1.441 4.560 3.393 1.00 . A A . 12 ASP OD2 1 1 7 1973 1 1 13 LYS C C -1.533 4.676 -1.407 1.00 . A A . 13 LYS C 1 1 7 1974 1 1 13 LYS CA C -0.681 5.478 -0.439 1.00 . A A . 13 LYS CA 1 1 7 1975 1 1 13 LYS CB C -0.563 6.934 -0.921 1.00 . A A . 13 LYS CB 1 1 7 1976 1 1 13 LYS CD C -2.733 7.673 0.157 1.00 . A A . 13 LYS CD 1 1 7 1977 1 1 13 LYS CE C -4.138 8.209 -0.068 1.00 . A A . 13 LYS CE 1 1 7 1978 1 1 13 LYS CG C -1.930 7.602 -1.142 1.00 . A A . 13 LYS CG 1 1 7 1979 1 1 13 LYS H H 1.439 5.275 -0.533 1.00 . A A . 13 LYS H 1 1 7 1980 1 1 13 LYS HA H -1.168 5.460 0.525 1.00 . A A . 13 LYS HA 1 1 7 1981 1 1 13 LYS HB2 H -0.015 7.505 -0.185 1.00 . A A . 13 LYS HB2 1 1 7 1982 1 1 13 LYS HB3 H -0.023 6.952 -1.856 1.00 . A A . 13 LYS HB3 1 1 7 1983 1 1 13 LYS HD2 H -2.813 6.680 0.577 1.00 . A A . 13 LYS HD2 1 1 7 1984 1 1 13 LYS HD3 H -2.216 8.318 0.853 1.00 . A A . 13 LYS HD3 1 1 7 1985 1 1 13 LYS HE2 H -4.620 7.594 -0.815 1.00 . A A . 13 LYS HE2 1 1 7 1986 1 1 13 LYS HE3 H -4.688 8.142 0.859 1.00 . A A . 13 LYS HE3 1 1 7 1987 1 1 13 LYS HG2 H -1.816 8.588 -1.562 1.00 . A A . 13 LYS HG2 1 1 7 1988 1 1 13 LYS HG3 H -2.479 6.995 -1.847 1.00 . A A . 13 LYS HG3 1 1 7 1989 1 1 13 LYS HZ1 H -3.654 9.715 -1.447 1.00 . A A . 13 LYS HZ1 1 1 7 1990 1 1 13 LYS HZ2 H -3.676 10.210 0.166 1.00 . A A . 13 LYS HZ2 1 1 7 1991 1 1 13 LYS HZ3 H -5.121 9.940 -0.639 1.00 . A A . 13 LYS HZ3 1 1 7 1992 1 1 13 LYS N N 0.612 4.828 -0.252 1.00 . A A . 13 LYS N 1 1 7 1993 1 1 13 LYS NZ N -4.143 9.601 -0.537 1.00 . A A . 13 LYS NZ 1 1 7 1994 1 1 13 LYS O O -2.734 4.500 -1.197 1.00 . A A . 13 LYS O 1 1 7 1995 1 1 14 LEU C C -2.039 2.038 -2.744 1.00 . A A . 14 LEU C 1 1 7 1996 1 1 14 LEU CA C -1.616 3.336 -3.406 1.00 . A A . 14 LEU CA 1 1 7 1997 1 1 14 LEU CB C -0.805 3.066 -4.697 1.00 . A A . 14 LEU CB 1 1 7 1998 1 1 14 LEU CD1 C -2.051 4.738 -6.145 1.00 . A A . 14 LEU CD1 1 1 7 1999 1 1 14 LEU CD2 C 0.190 5.358 -5.210 1.00 . A A . 14 LEU CD2 1 1 7 2000 1 1 14 LEU CG C -0.681 4.223 -5.722 1.00 . A A . 14 LEU CG 1 1 7 2001 1 1 14 LEU H H 0.046 4.368 -2.570 1.00 . A A . 14 LEU H 1 1 7 2002 1 1 14 LEU HA H -2.522 3.868 -3.661 1.00 . A A . 14 LEU HA 1 1 7 2003 1 1 14 LEU HB2 H 0.195 2.782 -4.402 1.00 . A A . 14 LEU HB2 1 1 7 2004 1 1 14 LEU HB3 H -1.255 2.221 -5.198 1.00 . A A . 14 LEU HB3 1 1 7 2005 1 1 14 LEU HD11 H -2.625 3.931 -6.576 1.00 . A A . 14 LEU HD11 1 1 7 2006 1 1 14 LEU HD12 H -1.922 5.517 -6.881 1.00 . A A . 14 LEU HD12 1 1 7 2007 1 1 14 LEU HD13 H -2.574 5.141 -5.291 1.00 . A A . 14 LEU HD13 1 1 7 2008 1 1 14 LEU HD21 H 0.242 6.137 -5.955 1.00 . A A . 14 LEU HD21 1 1 7 2009 1 1 14 LEU HD22 H 1.185 4.985 -5.011 1.00 . A A . 14 LEU HD22 1 1 7 2010 1 1 14 LEU HD23 H -0.236 5.755 -4.301 1.00 . A A . 14 LEU HD23 1 1 7 2011 1 1 14 LEU HG H -0.224 3.817 -6.613 1.00 . A A . 14 LEU HG 1 1 7 2012 1 1 14 LEU N N -0.909 4.171 -2.452 1.00 . A A . 14 LEU N 1 1 7 2013 1 1 14 LEU O O -3.131 1.538 -2.998 1.00 . A A . 14 LEU O 1 1 7 2014 1 1 15 TRP C C -2.677 0.559 -0.242 1.00 . A A . 15 TRP C 1 1 7 2015 1 1 15 TRP CA C -1.425 0.328 -1.085 1.00 . A A . 15 TRP CA 1 1 7 2016 1 1 15 TRP CB C -0.226 0.097 -0.134 1.00 . A A . 15 TRP CB 1 1 7 2017 1 1 15 TRP CD1 C 0.969 -2.079 0.343 1.00 . A A . 15 TRP CD1 1 1 7 2018 1 1 15 TRP CD2 C -0.959 -1.917 1.418 1.00 . A A . 15 TRP CD2 1 1 7 2019 1 1 15 TRP CE2 C -0.375 -3.147 1.744 1.00 . A A . 15 TRP CE2 1 1 7 2020 1 1 15 TRP CE3 C -2.168 -1.599 1.973 1.00 . A A . 15 TRP CE3 1 1 7 2021 1 1 15 TRP CG C -0.077 -1.252 0.508 1.00 . A A . 15 TRP CG 1 1 7 2022 1 1 15 TRP CH2 C -2.187 -3.677 3.138 1.00 . A A . 15 TRP CH2 1 1 7 2023 1 1 15 TRP CZ2 C -0.982 -4.049 2.615 1.00 . A A . 15 TRP CZ2 1 1 7 2024 1 1 15 TRP CZ3 C -2.763 -2.467 2.815 1.00 . A A . 15 TRP CZ3 1 1 7 2025 1 1 15 TRP H H -0.317 1.991 -1.748 1.00 . A A . 15 TRP H 1 1 7 2026 1 1 15 TRP HA H -1.517 -0.499 -1.768 1.00 . A A . 15 TRP HA 1 1 7 2027 1 1 15 TRP HB2 H 0.682 0.237 -0.692 1.00 . A A . 15 TRP HB2 1 1 7 2028 1 1 15 TRP HB3 H -0.268 0.837 0.651 1.00 . A A . 15 TRP HB3 1 1 7 2029 1 1 15 TRP HD1 H 1.810 -1.835 -0.289 1.00 . A A . 15 TRP HD1 1 1 7 2030 1 1 15 TRP HE1 H 1.441 -3.967 1.096 1.00 . A A . 15 TRP HE1 1 1 7 2031 1 1 15 TRP HE3 H -2.651 -0.661 1.742 1.00 . A A . 15 TRP HE3 1 1 7 2032 1 1 15 TRP HH2 H -2.746 -4.301 3.817 1.00 . A A . 15 TRP HH2 1 1 7 2033 1 1 15 TRP HZ2 H -0.534 -4.996 2.871 1.00 . A A . 15 TRP HZ2 1 1 7 2034 1 1 15 TRP HZ3 H -3.715 -2.193 3.228 1.00 . A A . 15 TRP HZ3 1 1 7 2035 1 1 15 TRP N N -1.180 1.533 -1.866 1.00 . A A . 15 TRP N 1 1 7 2036 1 1 15 TRP NE1 N 0.801 -3.218 1.074 1.00 . A A . 15 TRP NE1 1 1 7 2037 1 1 15 TRP O O -3.643 -0.224 -0.282 1.00 . A A . 15 TRP O 1 1 7 2038 1 1 16 GLN C C -5.044 2.349 0.736 1.00 . A A . 16 GLN C 1 1 7 2039 1 1 16 GLN CA C -3.708 2.069 1.410 1.00 . A A . 16 GLN CA 1 1 7 2040 1 1 16 GLN CB C -3.282 3.290 2.225 1.00 . A A . 16 GLN CB 1 1 7 2041 1 1 16 GLN CD C -2.362 1.983 4.182 1.00 . A A . 16 GLN CD 1 1 7 2042 1 1 16 GLN CG C -2.097 3.057 3.155 1.00 . A A . 16 GLN CG 1 1 7 2043 1 1 16 GLN H H -1.878 2.267 0.394 1.00 . A A . 16 GLN H 1 1 7 2044 1 1 16 GLN HA H -3.828 1.247 2.100 1.00 . A A . 16 GLN HA 1 1 7 2045 1 1 16 GLN HB2 H -3.018 4.084 1.543 1.00 . A A . 16 GLN HB2 1 1 7 2046 1 1 16 GLN HB3 H -4.122 3.613 2.822 1.00 . A A . 16 GLN HB3 1 1 7 2047 1 1 16 GLN HE21 H -1.485 0.645 3.053 1.00 . A A . 16 GLN HE21 1 1 7 2048 1 1 16 GLN HE22 H -2.139 0.074 4.555 1.00 . A A . 16 GLN HE22 1 1 7 2049 1 1 16 GLN HG2 H -1.255 2.736 2.556 1.00 . A A . 16 GLN HG2 1 1 7 2050 1 1 16 GLN HG3 H -1.854 3.979 3.662 1.00 . A A . 16 GLN HG3 1 1 7 2051 1 1 16 GLN N N -2.660 1.672 0.479 1.00 . A A . 16 GLN N 1 1 7 2052 1 1 16 GLN NE2 N -1.952 0.786 3.904 1.00 . A A . 16 GLN NE2 1 1 7 2053 1 1 16 GLN O O -6.043 2.593 1.412 1.00 . A A . 16 GLN O 1 1 7 2054 1 1 16 GLN OE1 O -2.882 2.249 5.249 1.00 . A A . 16 GLN OE1 1 1 7 2055 1 1 17 ILE C C -6.611 1.278 -2.130 1.00 . A A . 17 ILE C 1 1 7 2056 1 1 17 ILE CA C -6.296 2.555 -1.304 1.00 . A A . 17 ILE CA 1 1 7 2057 1 1 17 ILE CB C -6.229 3.855 -2.216 1.00 . A A . 17 ILE CB 1 1 7 2058 1 1 17 ILE CD1 C -6.864 5.460 -0.302 1.00 . A A . 17 ILE CD1 1 1 7 2059 1 1 17 ILE CG1 C -5.862 5.099 -1.380 1.00 . A A . 17 ILE CG1 1 1 7 2060 1 1 17 ILE CG2 C -7.552 4.121 -2.938 1.00 . A A . 17 ILE CG2 1 1 7 2061 1 1 17 ILE H H -4.218 2.259 -1.064 1.00 . A A . 17 ILE H 1 1 7 2062 1 1 17 ILE HA H -7.075 2.662 -0.570 1.00 . A A . 17 ILE HA 1 1 7 2063 1 1 17 ILE HB H -5.456 3.715 -2.958 1.00 . A A . 17 ILE HB 1 1 7 2064 1 1 17 ILE HD11 H -7.825 5.653 -0.757 1.00 . A A . 17 ILE HD11 1 1 7 2065 1 1 17 ILE HD12 H -6.527 6.344 0.220 1.00 . A A . 17 ILE HD12 1 1 7 2066 1 1 17 ILE HD13 H -6.954 4.641 0.396 1.00 . A A . 17 ILE HD13 1 1 7 2067 1 1 17 ILE HG12 H -4.914 4.927 -0.893 1.00 . A A . 17 ILE HG12 1 1 7 2068 1 1 17 ILE HG13 H -5.765 5.946 -2.044 1.00 . A A . 17 ILE HG13 1 1 7 2069 1 1 17 ILE HG21 H -8.336 4.251 -2.207 1.00 . A A . 17 ILE HG21 1 1 7 2070 1 1 17 ILE HG22 H -7.792 3.282 -3.575 1.00 . A A . 17 ILE HG22 1 1 7 2071 1 1 17 ILE HG23 H -7.467 5.016 -3.535 1.00 . A A . 17 ILE HG23 1 1 7 2072 1 1 17 ILE N N -5.063 2.359 -0.575 1.00 . A A . 17 ILE N 1 1 7 2073 1 1 17 ILE O O -7.630 1.178 -2.816 1.00 . A A . 17 ILE O 1 1 7 2074 1 1 18 TYR C C -6.145 -2.200 -1.946 1.00 . A A . 18 TYR C 1 1 7 2075 1 1 18 TYR CA C -5.915 -0.926 -2.791 1.00 . A A . 18 TYR CA 1 1 7 2076 1 1 18 TYR CB C -4.711 -0.995 -3.761 1.00 . A A . 18 TYR CB 1 1 7 2077 1 1 18 TYR CD1 C -2.920 -2.429 -2.819 1.00 . A A . 18 TYR CD1 1 1 7 2078 1 1 18 TYR CD2 C -3.973 -3.149 -4.808 1.00 . A A . 18 TYR CD2 1 1 7 2079 1 1 18 TYR CE1 C -2.089 -3.518 -2.850 1.00 . A A . 18 TYR CE1 1 1 7 2080 1 1 18 TYR CE2 C -3.159 -4.253 -4.848 1.00 . A A . 18 TYR CE2 1 1 7 2081 1 1 18 TYR CG C -3.868 -2.230 -3.784 1.00 . A A . 18 TYR CG 1 1 7 2082 1 1 18 TYR CZ C -2.214 -4.432 -3.865 1.00 . A A . 18 TYR CZ 1 1 7 2083 1 1 18 TYR H H -5.057 0.346 -1.329 1.00 . A A . 18 TYR H 1 1 7 2084 1 1 18 TYR HA H -6.808 -0.784 -3.382 1.00 . A A . 18 TYR HA 1 1 7 2085 1 1 18 TYR HB2 H -5.043 -0.846 -4.773 1.00 . A A . 18 TYR HB2 1 1 7 2086 1 1 18 TYR HB3 H -4.061 -0.169 -3.513 1.00 . A A . 18 TYR HB3 1 1 7 2087 1 1 18 TYR HD1 H -2.891 -1.694 -2.027 1.00 . A A . 18 TYR HD1 1 1 7 2088 1 1 18 TYR HD2 H -4.717 -2.996 -5.574 1.00 . A A . 18 TYR HD2 1 1 7 2089 1 1 18 TYR HE1 H -1.347 -3.655 -2.077 1.00 . A A . 18 TYR HE1 1 1 7 2090 1 1 18 TYR HE2 H -3.262 -4.970 -5.650 1.00 . A A . 18 TYR HE2 1 1 7 2091 1 1 18 TYR HH H -1.093 -5.607 -4.819 1.00 . A A . 18 TYR HH 1 1 7 2092 1 1 18 TYR N N -5.783 0.278 -1.988 1.00 . A A . 18 TYR N 1 1 7 2093 1 1 18 TYR O O -6.992 -3.024 -2.279 1.00 . A A . 18 TYR O 1 1 7 2094 1 1 18 TYR OH O -1.394 -5.527 -3.904 1.00 . A A . 18 TYR OH 1 1 7 2095 1 1 19 LEU C C -6.146 -3.047 1.354 1.00 . A A . 19 LEU C 1 1 7 2096 1 1 19 LEU CA C -5.584 -3.501 0.044 1.00 . A A . 19 LEU CA 1 1 7 2097 1 1 19 LEU CB C -4.277 -4.210 0.289 1.00 . A A . 19 LEU CB 1 1 7 2098 1 1 19 LEU CD1 C -2.509 -5.793 -0.306 1.00 . A A . 19 LEU CD1 1 1 7 2099 1 1 19 LEU CD2 C -4.879 -6.485 -0.500 1.00 . A A . 19 LEU CD2 1 1 7 2100 1 1 19 LEU CG C -3.901 -5.331 -0.649 1.00 . A A . 19 LEU CG 1 1 7 2101 1 1 19 LEU H H -4.710 -1.690 -0.657 1.00 . A A . 19 LEU H 1 1 7 2102 1 1 19 LEU HA H -6.281 -4.184 -0.418 1.00 . A A . 19 LEU HA 1 1 7 2103 1 1 19 LEU HB2 H -3.509 -3.454 0.197 1.00 . A A . 19 LEU HB2 1 1 7 2104 1 1 19 LEU HB3 H -4.274 -4.586 1.301 1.00 . A A . 19 LEU HB3 1 1 7 2105 1 1 19 LEU HD11 H -2.505 -6.155 0.711 1.00 . A A . 19 LEU HD11 1 1 7 2106 1 1 19 LEU HD12 H -1.856 -4.935 -0.375 1.00 . A A . 19 LEU HD12 1 1 7 2107 1 1 19 LEU HD13 H -2.195 -6.568 -0.987 1.00 . A A . 19 LEU HD13 1 1 7 2108 1 1 19 LEU HD21 H -5.871 -6.164 -0.782 1.00 . A A . 19 LEU HD21 1 1 7 2109 1 1 19 LEU HD22 H -4.891 -6.793 0.535 1.00 . A A . 19 LEU HD22 1 1 7 2110 1 1 19 LEU HD23 H -4.568 -7.312 -1.121 1.00 . A A . 19 LEU HD23 1 1 7 2111 1 1 19 LEU HG H -3.919 -4.988 -1.673 1.00 . A A . 19 LEU HG 1 1 7 2112 1 1 19 LEU N N -5.409 -2.352 -0.866 1.00 . A A . 19 LEU N 1 1 7 2113 1 1 19 LEU O O -6.332 -3.828 2.293 1.00 . A A . 19 LEU O 1 1 7 2114 1 1 20 ASN C C -8.226 -0.521 2.199 1.00 . A A . 20 ASN C 1 1 7 2115 1 1 20 ASN CA C -6.935 -1.191 2.575 1.00 . A A . 20 ASN CA 1 1 7 2116 1 1 20 ASN CB C -5.926 -0.206 3.158 1.00 . A A . 20 ASN CB 1 1 7 2117 1 1 20 ASN CG C -6.452 0.597 4.327 1.00 . A A . 20 ASN CG 1 1 7 2118 1 1 20 ASN H H -6.228 -1.267 0.619 1.00 . A A . 20 ASN H 1 1 7 2119 1 1 20 ASN HA H -7.141 -1.964 3.301 1.00 . A A . 20 ASN HA 1 1 7 2120 1 1 20 ASN HB2 H -5.081 -0.776 3.515 1.00 . A A . 20 ASN HB2 1 1 7 2121 1 1 20 ASN HB3 H -5.580 0.452 2.381 1.00 . A A . 20 ASN HB3 1 1 7 2122 1 1 20 ASN HD21 H -7.090 1.975 3.098 1.00 . A A . 20 ASN HD21 1 1 7 2123 1 1 20 ASN HD22 H -7.402 2.279 4.772 1.00 . A A . 20 ASN HD22 1 1 7 2124 1 1 20 ASN N N -6.397 -1.808 1.416 1.00 . A A . 20 ASN N 1 1 7 2125 1 1 20 ASN ND2 N -7.035 1.728 4.050 1.00 . A A . 20 ASN ND2 1 1 7 2126 1 1 20 ASN O O -9.289 -1.056 2.530 1.00 . A A . 20 ASN O 1 1 7 2127 1 1 20 ASN OXT O -8.190 0.492 1.492 1.00 . A A . 20 ASN OXT 1 1 7 2128 1 1 20 ASN OD1 O -6.315 0.196 5.478 1.00 . A A . 20 ASN OD1 1 1 8 2129 1 1 1 SER C C 1.742 -2.161 -5.981 1.00 . A A . 1 SER C 1 1 8 2130 1 1 1 SER CA C 0.493 -1.751 -6.771 1.00 . A A . 1 SER CA 1 1 8 2131 1 1 1 SER CB C -0.661 -2.700 -6.523 1.00 . A A . 1 SER CB 1 1 8 2132 1 1 1 SER H1 H 1.147 -2.686 -8.462 1.00 . A A . 1 SER H1 1 1 8 2133 1 1 1 SER H2 H 1.502 -1.008 -8.396 1.00 . A A . 1 SER H2 1 1 8 2134 1 1 1 SER H3 H -0.071 -1.547 -8.713 1.00 . A A . 1 SER H3 1 1 8 2135 1 1 1 SER HA H 0.209 -0.748 -6.489 1.00 . A A . 1 SER HA 1 1 8 2136 1 1 1 SER HB2 H -0.341 -3.721 -6.661 1.00 . A A . 1 SER HB2 1 1 8 2137 1 1 1 SER HB3 H -0.999 -2.551 -5.507 1.00 . A A . 1 SER HB3 1 1 8 2138 1 1 1 SER HG H -2.235 -3.216 -7.540 1.00 . A A . 1 SER HG 1 1 8 2139 1 1 1 SER N N 0.801 -1.747 -8.183 1.00 . A A . 1 SER N 1 1 8 2140 1 1 1 SER O O 2.596 -2.885 -6.512 1.00 . A A . 1 SER O 1 1 8 2141 1 1 1 SER OG O -1.737 -2.403 -7.398 1.00 . A A . 1 SER OG 1 1 8 2142 1 1 2 PRO C C 3.032 -3.162 -3.010 1.00 . A A . 2 PRO C 1 1 8 2143 1 1 2 PRO CA C 3.086 -1.922 -3.928 1.00 . A A . 2 PRO CA 1 1 8 2144 1 1 2 PRO CB C 3.055 -0.665 -3.062 1.00 . A A . 2 PRO CB 1 1 8 2145 1 1 2 PRO CD C 0.852 -0.995 -3.926 1.00 . A A . 2 PRO CD 1 1 8 2146 1 1 2 PRO CG C 1.616 -0.531 -2.710 1.00 . A A . 2 PRO CG 1 1 8 2147 1 1 2 PRO HA H 3.979 -1.905 -4.533 1.00 . A A . 2 PRO HA 1 1 8 2148 1 1 2 PRO HB2 H 3.673 -0.806 -2.187 1.00 . A A . 2 PRO HB2 1 1 8 2149 1 1 2 PRO HB3 H 3.399 0.192 -3.622 1.00 . A A . 2 PRO HB3 1 1 8 2150 1 1 2 PRO HD2 H 0.046 -1.654 -3.639 1.00 . A A . 2 PRO HD2 1 1 8 2151 1 1 2 PRO HD3 H 0.474 -0.150 -4.478 1.00 . A A . 2 PRO HD3 1 1 8 2152 1 1 2 PRO HG2 H 1.392 -1.159 -1.860 1.00 . A A . 2 PRO HG2 1 1 8 2153 1 1 2 PRO HG3 H 1.381 0.499 -2.486 1.00 . A A . 2 PRO HG3 1 1 8 2154 1 1 2 PRO N N 1.872 -1.722 -4.718 1.00 . A A . 2 PRO N 1 1 8 2155 1 1 2 PRO O O 2.000 -3.862 -2.931 1.00 . A A . 2 PRO O 1 1 8 2156 1 1 3 PRO C C 3.758 -3.728 0.044 1.00 . A A . 3 PRO C 1 1 8 2157 1 1 3 PRO CA C 4.194 -4.455 -1.276 1.00 . A A . 3 PRO CA 1 1 8 2158 1 1 3 PRO CB C 5.698 -4.871 -1.238 1.00 . A A . 3 PRO CB 1 1 8 2159 1 1 3 PRO CD C 5.504 -2.994 -2.669 1.00 . A A . 3 PRO CD 1 1 8 2160 1 1 3 PRO CG C 6.330 -4.205 -2.415 1.00 . A A . 3 PRO CG 1 1 8 2161 1 1 3 PRO HA H 3.550 -5.301 -1.465 1.00 . A A . 3 PRO HA 1 1 8 2162 1 1 3 PRO HB2 H 6.138 -4.528 -0.312 1.00 . A A . 3 PRO HB2 1 1 8 2163 1 1 3 PRO HB3 H 5.780 -5.946 -1.301 1.00 . A A . 3 PRO HB3 1 1 8 2164 1 1 3 PRO HD2 H 5.791 -2.189 -2.008 1.00 . A A . 3 PRO HD2 1 1 8 2165 1 1 3 PRO HD3 H 5.586 -2.692 -3.702 1.00 . A A . 3 PRO HD3 1 1 8 2166 1 1 3 PRO HG2 H 7.348 -3.929 -2.183 1.00 . A A . 3 PRO HG2 1 1 8 2167 1 1 3 PRO HG3 H 6.303 -4.865 -3.269 1.00 . A A . 3 PRO HG3 1 1 8 2168 1 1 3 PRO N N 4.157 -3.487 -2.364 1.00 . A A . 3 PRO N 1 1 8 2169 1 1 3 PRO O O 3.319 -2.573 -0.028 1.00 . A A . 3 PRO O 1 1 8 2170 1 1 4 PRO C C 4.091 -2.374 2.784 1.00 . A A . 4 PRO C 1 1 8 2171 1 1 4 PRO CA C 3.464 -3.762 2.534 1.00 . A A . 4 PRO CA 1 1 8 2172 1 1 4 PRO CB C 3.986 -4.757 3.543 1.00 . A A . 4 PRO CB 1 1 8 2173 1 1 4 PRO CD C 4.124 -5.823 1.423 1.00 . A A . 4 PRO CD 1 1 8 2174 1 1 4 PRO CG C 3.812 -6.064 2.873 1.00 . A A . 4 PRO CG 1 1 8 2175 1 1 4 PRO HA H 2.395 -3.682 2.643 1.00 . A A . 4 PRO HA 1 1 8 2176 1 1 4 PRO HB2 H 5.023 -4.542 3.751 1.00 . A A . 4 PRO HB2 1 1 8 2177 1 1 4 PRO HB3 H 3.407 -4.697 4.453 1.00 . A A . 4 PRO HB3 1 1 8 2178 1 1 4 PRO HD2 H 5.166 -6.017 1.220 1.00 . A A . 4 PRO HD2 1 1 8 2179 1 1 4 PRO HD3 H 3.499 -6.433 0.790 1.00 . A A . 4 PRO HD3 1 1 8 2180 1 1 4 PRO HG2 H 4.491 -6.789 3.297 1.00 . A A . 4 PRO HG2 1 1 8 2181 1 1 4 PRO HG3 H 2.791 -6.398 2.983 1.00 . A A . 4 PRO HG3 1 1 8 2182 1 1 4 PRO N N 3.812 -4.392 1.237 1.00 . A A . 4 PRO N 1 1 8 2183 1 1 4 PRO O O 5.155 -2.031 2.230 1.00 . A A . 4 PRO O 1 1 8 2184 1 1 5 ARG C C 5.212 -0.164 4.498 1.00 . A A . 5 ARG C 1 1 8 2185 1 1 5 ARG CA C 3.776 -0.241 4.007 1.00 . A A . 5 ARG CA 1 1 8 2186 1 1 5 ARG CB C 2.829 0.275 5.098 1.00 . A A . 5 ARG CB 1 1 8 2187 1 1 5 ARG CD C 0.456 0.435 5.920 1.00 . A A . 5 ARG CD 1 1 8 2188 1 1 5 ARG CG C 1.362 0.132 4.743 1.00 . A A . 5 ARG CG 1 1 8 2189 1 1 5 ARG CZ C 0.050 2.399 7.401 1.00 . A A . 5 ARG CZ 1 1 8 2190 1 1 5 ARG H H 2.665 -2.030 4.123 1.00 . A A . 5 ARG H 1 1 8 2191 1 1 5 ARG HA H 3.656 0.371 3.127 1.00 . A A . 5 ARG HA 1 1 8 2192 1 1 5 ARG HB2 H 3.018 -0.278 6.005 1.00 . A A . 5 ARG HB2 1 1 8 2193 1 1 5 ARG HB3 H 3.033 1.319 5.279 1.00 . A A . 5 ARG HB3 1 1 8 2194 1 1 5 ARG HD2 H -0.537 0.092 5.672 1.00 . A A . 5 ARG HD2 1 1 8 2195 1 1 5 ARG HD3 H 0.816 -0.101 6.787 1.00 . A A . 5 ARG HD3 1 1 8 2196 1 1 5 ARG HE H 0.578 2.443 5.444 1.00 . A A . 5 ARG HE 1 1 8 2197 1 1 5 ARG HG2 H 1.133 0.830 3.951 1.00 . A A . 5 ARG HG2 1 1 8 2198 1 1 5 ARG HG3 H 1.168 -0.870 4.393 1.00 . A A . 5 ARG HG3 1 1 8 2199 1 1 5 ARG HH11 H -0.190 0.620 8.395 1.00 . A A . 5 ARG HH11 1 1 8 2200 1 1 5 ARG HH12 H -0.479 1.990 9.345 1.00 . A A . 5 ARG HH12 1 1 8 2201 1 1 5 ARG HH21 H 0.140 4.326 6.729 1.00 . A A . 5 ARG HH21 1 1 8 2202 1 1 5 ARG HH22 H -0.310 4.171 8.370 1.00 . A A . 5 ARG HH22 1 1 8 2203 1 1 5 ARG N N 3.426 -1.617 3.660 1.00 . A A . 5 ARG N 1 1 8 2204 1 1 5 ARG NE N 0.393 1.861 6.229 1.00 . A A . 5 ARG NE 1 1 8 2205 1 1 5 ARG NH1 N -0.224 1.622 8.447 1.00 . A A . 5 ARG NH1 1 1 8 2206 1 1 5 ARG NH2 N -0.042 3.722 7.510 1.00 . A A . 5 ARG NH2 1 1 8 2207 1 1 5 ARG O O 5.538 -0.605 5.608 1.00 . A A . 5 ARG O 1 1 8 2208 1 1 6 GLY C C 8.236 0.219 2.748 1.00 . A A . 6 GLY C 1 1 8 2209 1 1 6 GLY CA C 7.452 0.461 3.988 1.00 . A A . 6 GLY CA 1 1 8 2210 1 1 6 GLY H H 5.734 0.731 2.825 1.00 . A A . 6 GLY H 1 1 8 2211 1 1 6 GLY HA2 H 7.675 1.445 4.376 1.00 . A A . 6 GLY HA2 1 1 8 2212 1 1 6 GLY HA3 H 7.710 -0.287 4.722 1.00 . A A . 6 GLY HA3 1 1 8 2213 1 1 6 GLY N N 6.055 0.377 3.682 1.00 . A A . 6 GLY N 1 1 8 2214 1 1 6 GLY O O 9.275 0.820 2.523 1.00 . A A . 6 GLY O 1 1 8 2215 1 1 7 SER C C 7.831 0.171 -0.300 1.00 . A A . 7 SER C 1 1 8 2216 1 1 7 SER CA C 8.305 -0.912 0.662 1.00 . A A . 7 SER CA 1 1 8 2217 1 1 7 SER CB C 7.852 -2.278 0.205 1.00 . A A . 7 SER CB 1 1 8 2218 1 1 7 SER H H 6.884 -1.106 2.166 1.00 . A A . 7 SER H 1 1 8 2219 1 1 7 SER HA H 9.381 -0.889 0.756 1.00 . A A . 7 SER HA 1 1 8 2220 1 1 7 SER HB2 H 6.793 -2.251 -0.005 1.00 . A A . 7 SER HB2 1 1 8 2221 1 1 7 SER HB3 H 8.393 -2.559 -0.687 1.00 . A A . 7 SER HB3 1 1 8 2222 1 1 7 SER HG H 8.466 -2.780 1.981 1.00 . A A . 7 SER HG 1 1 8 2223 1 1 7 SER N N 7.717 -0.641 1.924 1.00 . A A . 7 SER N 1 1 8 2224 1 1 7 SER O O 6.626 0.420 -0.386 1.00 . A A . 7 SER O 1 1 8 2225 1 1 7 SER OG O 8.098 -3.248 1.218 1.00 . A A . 7 SER OG 1 1 8 2226 1 1 8 SER C C 7.928 3.132 -1.169 1.00 . A A . 8 SER C 1 1 8 2227 1 1 8 SER CA C 8.561 1.924 -1.892 1.00 . A A . 8 SER CA 1 1 8 2228 1 1 8 SER CB C 7.820 1.522 -3.194 1.00 . A A . 8 SER CB 1 1 8 2229 1 1 8 SER H H 9.711 0.511 -0.938 1.00 . A A . 8 SER H 1 1 8 2230 1 1 8 SER HA H 9.559 2.244 -2.157 1.00 . A A . 8 SER HA 1 1 8 2231 1 1 8 SER HB2 H 7.698 2.417 -3.779 1.00 . A A . 8 SER HB2 1 1 8 2232 1 1 8 SER HB3 H 8.441 0.829 -3.744 1.00 . A A . 8 SER HB3 1 1 8 2233 1 1 8 SER HG H 6.434 0.866 -2.003 1.00 . A A . 8 SER HG 1 1 8 2234 1 1 8 SER N N 8.779 0.800 -1.000 1.00 . A A . 8 SER N 1 1 8 2235 1 1 8 SER O O 6.737 3.143 -0.898 1.00 . A A . 8 SER O 1 1 8 2236 1 1 8 SER OG O 6.538 0.928 -2.966 1.00 . A A . 8 SER OG 1 1 8 2237 1 1 9 PRO C C 7.115 6.030 -0.834 1.00 . A A . 9 PRO C 1 1 8 2238 1 1 9 PRO CA C 8.269 5.351 -0.101 1.00 . A A . 9 PRO CA 1 1 8 2239 1 1 9 PRO CB C 9.489 6.272 -0.079 1.00 . A A . 9 PRO CB 1 1 8 2240 1 1 9 PRO CD C 10.194 4.221 -1.081 1.00 . A A . 9 PRO CD 1 1 8 2241 1 1 9 PRO CG C 10.656 5.365 -0.225 1.00 . A A . 9 PRO CG 1 1 8 2242 1 1 9 PRO HA H 7.965 5.114 0.908 1.00 . A A . 9 PRO HA 1 1 8 2243 1 1 9 PRO HB2 H 9.424 6.972 -0.898 1.00 . A A . 9 PRO HB2 1 1 8 2244 1 1 9 PRO HB3 H 9.521 6.809 0.858 1.00 . A A . 9 PRO HB3 1 1 8 2245 1 1 9 PRO HD2 H 10.387 4.426 -2.124 1.00 . A A . 9 PRO HD2 1 1 8 2246 1 1 9 PRO HD3 H 10.687 3.311 -0.774 1.00 . A A . 9 PRO HD3 1 1 8 2247 1 1 9 PRO HG2 H 11.472 5.888 -0.701 1.00 . A A . 9 PRO HG2 1 1 8 2248 1 1 9 PRO HG3 H 10.960 5.006 0.746 1.00 . A A . 9 PRO HG3 1 1 8 2249 1 1 9 PRO N N 8.746 4.153 -0.812 1.00 . A A . 9 PRO N 1 1 8 2250 1 1 9 PRO O O 7.263 6.480 -1.973 1.00 . A A . 9 PRO O 1 1 8 2251 1 1 10 GLY C C 3.894 5.596 -1.404 1.00 . A A . 10 GLY C 1 1 8 2252 1 1 10 GLY CA C 4.803 6.644 -0.810 1.00 . A A . 10 GLY CA 1 1 8 2253 1 1 10 GLY H H 5.890 5.604 0.669 1.00 . A A . 10 GLY H 1 1 8 2254 1 1 10 GLY HA2 H 4.264 7.200 -0.057 1.00 . A A . 10 GLY HA2 1 1 8 2255 1 1 10 GLY HA3 H 5.119 7.315 -1.594 1.00 . A A . 10 GLY HA3 1 1 8 2256 1 1 10 GLY N N 5.964 6.040 -0.208 1.00 . A A . 10 GLY N 1 1 8 2257 1 1 10 GLY O O 2.769 5.891 -1.829 1.00 . A A . 10 GLY O 1 1 8 2258 1 1 11 GLY C C 2.414 2.965 -1.070 1.00 . A A . 11 GLY C 1 1 8 2259 1 1 11 GLY CA C 3.617 3.235 -1.925 1.00 . A A . 11 GLY CA 1 1 8 2260 1 1 11 GLY H H 5.273 4.183 -1.052 1.00 . A A . 11 GLY H 1 1 8 2261 1 1 11 GLY HA2 H 3.301 3.454 -2.933 1.00 . A A . 11 GLY HA2 1 1 8 2262 1 1 11 GLY HA3 H 4.247 2.358 -1.930 1.00 . A A . 11 GLY HA3 1 1 8 2263 1 1 11 GLY N N 4.373 4.359 -1.409 1.00 . A A . 11 GLY N 1 1 8 2264 1 1 11 GLY O O 1.429 2.393 -1.529 1.00 . A A . 11 GLY O 1 1 8 2265 1 1 12 ASP C C 0.114 3.938 0.592 1.00 . A A . 12 ASP C 1 1 8 2266 1 1 12 ASP CA C 1.410 3.329 1.132 1.00 . A A . 12 ASP CA 1 1 8 2267 1 1 12 ASP CB C 1.822 3.970 2.447 1.00 . A A . 12 ASP CB 1 1 8 2268 1 1 12 ASP CG C 0.671 4.224 3.383 1.00 . A A . 12 ASP CG 1 1 8 2269 1 1 12 ASP H H 3.348 3.807 0.458 1.00 . A A . 12 ASP H 1 1 8 2270 1 1 12 ASP HA H 1.234 2.276 1.309 1.00 . A A . 12 ASP HA 1 1 8 2271 1 1 12 ASP HB2 H 2.486 3.271 2.935 1.00 . A A . 12 ASP HB2 1 1 8 2272 1 1 12 ASP HB3 H 2.343 4.897 2.257 1.00 . A A . 12 ASP HB3 1 1 8 2273 1 1 12 ASP N N 2.496 3.412 0.172 1.00 . A A . 12 ASP N 1 1 8 2274 1 1 12 ASP O O -0.949 3.428 0.866 1.00 . A A . 12 ASP O 1 1 8 2275 1 1 12 ASP OD1 O 0.252 3.305 4.085 1.00 . A A . 12 ASP OD1 1 1 8 2276 1 1 12 ASP OD2 O 0.205 5.387 3.460 1.00 . A A . 12 ASP OD2 1 1 8 2277 1 1 13 LYS C C -1.692 4.499 -1.688 1.00 . A A . 13 LYS C 1 1 8 2278 1 1 13 LYS CA C -0.986 5.572 -0.868 1.00 . A A . 13 LYS CA 1 1 8 2279 1 1 13 LYS CB C -0.632 6.745 -1.801 1.00 . A A . 13 LYS CB 1 1 8 2280 1 1 13 LYS CD C -2.944 7.809 -1.835 1.00 . A A . 13 LYS CD 1 1 8 2281 1 1 13 LYS CE C -4.158 8.146 -2.694 1.00 . A A . 13 LYS CE 1 1 8 2282 1 1 13 LYS CG C -1.815 7.214 -2.666 1.00 . A A . 13 LYS CG 1 1 8 2283 1 1 13 LYS H H 1.093 5.408 -0.362 1.00 . A A . 13 LYS H 1 1 8 2284 1 1 13 LYS HA H -1.652 5.919 -0.091 1.00 . A A . 13 LYS HA 1 1 8 2285 1 1 13 LYS HB2 H -0.289 7.580 -1.206 1.00 . A A . 13 LYS HB2 1 1 8 2286 1 1 13 LYS HB3 H 0.165 6.435 -2.460 1.00 . A A . 13 LYS HB3 1 1 8 2287 1 1 13 LYS HD2 H -3.239 7.096 -1.079 1.00 . A A . 13 LYS HD2 1 1 8 2288 1 1 13 LYS HD3 H -2.588 8.711 -1.361 1.00 . A A . 13 LYS HD3 1 1 8 2289 1 1 13 LYS HE2 H -4.506 7.243 -3.172 1.00 . A A . 13 LYS HE2 1 1 8 2290 1 1 13 LYS HE3 H -4.938 8.531 -2.053 1.00 . A A . 13 LYS HE3 1 1 8 2291 1 1 13 LYS HG2 H -1.500 7.915 -3.420 1.00 . A A . 13 LYS HG2 1 1 8 2292 1 1 13 LYS HG3 H -2.200 6.339 -3.169 1.00 . A A . 13 LYS HG3 1 1 8 2293 1 1 13 LYS HZ1 H -3.101 8.821 -4.376 1.00 . A A . 13 LYS HZ1 1 1 8 2294 1 1 13 LYS HZ2 H -3.536 10.038 -3.300 1.00 . A A . 13 LYS HZ2 1 1 8 2295 1 1 13 LYS HZ3 H -4.699 9.350 -4.302 1.00 . A A . 13 LYS HZ3 1 1 8 2296 1 1 13 LYS N N 0.211 5.002 -0.218 1.00 . A A . 13 LYS N 1 1 8 2297 1 1 13 LYS NZ N -3.851 9.149 -3.735 1.00 . A A . 13 LYS NZ 1 1 8 2298 1 1 13 LYS O O -2.895 4.286 -1.563 1.00 . A A . 13 LYS O 1 1 8 2299 1 1 14 LEU C C -1.903 1.596 -2.501 1.00 . A A . 14 LEU C 1 1 8 2300 1 1 14 LEU CA C -1.414 2.760 -3.344 1.00 . A A . 14 LEU CA 1 1 8 2301 1 1 14 LEU CB C -0.335 2.263 -4.339 1.00 . A A . 14 LEU CB 1 1 8 2302 1 1 14 LEU CD1 C 0.900 4.441 -4.871 1.00 . A A . 14 LEU CD1 1 1 8 2303 1 1 14 LEU CD2 C 1.098 2.474 -6.381 1.00 . A A . 14 LEU CD2 1 1 8 2304 1 1 14 LEU CG C 0.178 3.221 -5.438 1.00 . A A . 14 LEU CG 1 1 8 2305 1 1 14 LEU H H 0.052 3.972 -2.448 1.00 . A A . 14 LEU H 1 1 8 2306 1 1 14 LEU HA H -2.247 3.165 -3.899 1.00 . A A . 14 LEU HA 1 1 8 2307 1 1 14 LEU HB2 H 0.524 1.951 -3.764 1.00 . A A . 14 LEU HB2 1 1 8 2308 1 1 14 LEU HB3 H -0.747 1.393 -4.827 1.00 . A A . 14 LEU HB3 1 1 8 2309 1 1 14 LEU HD11 H 1.229 5.073 -5.683 1.00 . A A . 14 LEU HD11 1 1 8 2310 1 1 14 LEU HD12 H 1.756 4.120 -4.296 1.00 . A A . 14 LEU HD12 1 1 8 2311 1 1 14 LEU HD13 H 0.225 4.994 -4.236 1.00 . A A . 14 LEU HD13 1 1 8 2312 1 1 14 LEU HD21 H 1.949 2.100 -5.831 1.00 . A A . 14 LEU HD21 1 1 8 2313 1 1 14 LEU HD22 H 1.436 3.139 -7.163 1.00 . A A . 14 LEU HD22 1 1 8 2314 1 1 14 LEU HD23 H 0.562 1.645 -6.817 1.00 . A A . 14 LEU HD23 1 1 8 2315 1 1 14 LEU HG H -0.673 3.551 -6.014 1.00 . A A . 14 LEU HG 1 1 8 2316 1 1 14 LEU N N -0.912 3.797 -2.476 1.00 . A A . 14 LEU N 1 1 8 2317 1 1 14 LEU O O -2.860 0.927 -2.857 1.00 . A A . 14 LEU O 1 1 8 2318 1 1 15 TRP C C -2.962 0.590 0.137 1.00 . A A . 15 TRP C 1 1 8 2319 1 1 15 TRP CA C -1.564 0.333 -0.428 1.00 . A A . 15 TRP CA 1 1 8 2320 1 1 15 TRP CB C -0.537 0.353 0.724 1.00 . A A . 15 TRP CB 1 1 8 2321 1 1 15 TRP CD1 C 0.478 -1.719 1.759 1.00 . A A . 15 TRP CD1 1 1 8 2322 1 1 15 TRP CD2 C -1.474 -1.185 2.658 1.00 . A A . 15 TRP CD2 1 1 8 2323 1 1 15 TRP CE2 C -0.999 -2.333 3.300 1.00 . A A . 15 TRP CE2 1 1 8 2324 1 1 15 TRP CE3 C -2.680 -0.665 3.055 1.00 . A A . 15 TRP CE3 1 1 8 2325 1 1 15 TRP CG C -0.512 -0.816 1.666 1.00 . A A . 15 TRP CG 1 1 8 2326 1 1 15 TRP CH2 C -2.890 -2.403 4.682 1.00 . A A . 15 TRP CH2 1 1 8 2327 1 1 15 TRP CZ2 C -1.701 -2.957 4.323 1.00 . A A . 15 TRP CZ2 1 1 8 2328 1 1 15 TRP CZ3 C -3.369 -1.270 4.048 1.00 . A A . 15 TRP CZ3 1 1 8 2329 1 1 15 TRP H H -0.469 1.970 -1.190 1.00 . A A . 15 TRP H 1 1 8 2330 1 1 15 TRP HA H -1.501 -0.601 -0.967 1.00 . A A . 15 TRP HA 1 1 8 2331 1 1 15 TRP HB2 H 0.454 0.396 0.311 1.00 . A A . 15 TRP HB2 1 1 8 2332 1 1 15 TRP HB3 H -0.709 1.244 1.310 1.00 . A A . 15 TRP HB3 1 1 8 2333 1 1 15 TRP HD1 H 1.350 -1.662 1.127 1.00 . A A . 15 TRP HD1 1 1 8 2334 1 1 15 TRP HE1 H 0.747 -3.407 3.003 1.00 . A A . 15 TRP HE1 1 1 8 2335 1 1 15 TRP HE3 H -3.078 0.213 2.575 1.00 . A A . 15 TRP HE3 1 1 8 2336 1 1 15 TRP HH2 H -3.497 -2.832 5.464 1.00 . A A . 15 TRP HH2 1 1 8 2337 1 1 15 TRP HZ2 H -1.332 -3.841 4.821 1.00 . A A . 15 TRP HZ2 1 1 8 2338 1 1 15 TRP HZ3 H -4.309 -0.841 4.346 1.00 . A A . 15 TRP HZ3 1 1 8 2339 1 1 15 TRP N N -1.238 1.387 -1.378 1.00 . A A . 15 TRP N 1 1 8 2340 1 1 15 TRP NE1 N 0.196 -2.642 2.738 1.00 . A A . 15 TRP NE1 1 1 8 2341 1 1 15 TRP O O -3.844 -0.288 0.107 1.00 . A A . 15 TRP O 1 1 8 2342 1 1 16 GLN C C -5.578 2.297 0.235 1.00 . A A . 16 GLN C 1 1 8 2343 1 1 16 GLN CA C -4.422 2.235 1.238 1.00 . A A . 16 GLN CA 1 1 8 2344 1 1 16 GLN CB C -4.254 3.588 1.931 1.00 . A A . 16 GLN CB 1 1 8 2345 1 1 16 GLN CD C -3.313 2.711 4.153 1.00 . A A . 16 GLN CD 1 1 8 2346 1 1 16 GLN CG C -3.129 3.631 2.964 1.00 . A A . 16 GLN CG 1 1 8 2347 1 1 16 GLN H H -2.448 2.479 0.514 1.00 . A A . 16 GLN H 1 1 8 2348 1 1 16 GLN HA H -4.630 1.489 1.989 1.00 . A A . 16 GLN HA 1 1 8 2349 1 1 16 GLN HB2 H -4.051 4.338 1.180 1.00 . A A . 16 GLN HB2 1 1 8 2350 1 1 16 GLN HB3 H -5.180 3.838 2.430 1.00 . A A . 16 GLN HB3 1 1 8 2351 1 1 16 GLN HE21 H -1.363 2.627 4.353 1.00 . A A . 16 GLN HE21 1 1 8 2352 1 1 16 GLN HE22 H -2.267 1.698 5.496 1.00 . A A . 16 GLN HE22 1 1 8 2353 1 1 16 GLN HG2 H -2.243 3.268 2.463 1.00 . A A . 16 GLN HG2 1 1 8 2354 1 1 16 GLN HG3 H -2.982 4.644 3.308 1.00 . A A . 16 GLN HG3 1 1 8 2355 1 1 16 GLN N N -3.175 1.818 0.598 1.00 . A A . 16 GLN N 1 1 8 2356 1 1 16 GLN NE2 N -2.223 2.302 4.727 1.00 . A A . 16 GLN NE2 1 1 8 2357 1 1 16 GLN O O -6.712 2.630 0.587 1.00 . A A . 16 GLN O 1 1 8 2358 1 1 16 GLN OE1 O -4.430 2.401 4.581 1.00 . A A . 16 GLN OE1 1 1 8 2359 1 1 17 ILE C C -6.377 0.458 -2.553 1.00 . A A . 17 ILE C 1 1 8 2360 1 1 17 ILE CA C -6.243 1.933 -2.061 1.00 . A A . 17 ILE CA 1 1 8 2361 1 1 17 ILE CB C -5.858 2.890 -3.259 1.00 . A A . 17 ILE CB 1 1 8 2362 1 1 17 ILE CD1 C -7.182 4.903 -2.339 1.00 . A A . 17 ILE CD1 1 1 8 2363 1 1 17 ILE CG1 C -5.845 4.369 -2.811 1.00 . A A . 17 ILE CG1 1 1 8 2364 1 1 17 ILE CG2 C -6.792 2.713 -4.458 1.00 . A A . 17 ILE CG2 1 1 8 2365 1 1 17 ILE H H -4.318 1.891 -1.216 1.00 . A A . 17 ILE H 1 1 8 2366 1 1 17 ILE HA H -7.194 2.246 -1.657 1.00 . A A . 17 ILE HA 1 1 8 2367 1 1 17 ILE HB H -4.856 2.635 -3.582 1.00 . A A . 17 ILE HB 1 1 8 2368 1 1 17 ILE HD11 H -7.079 5.940 -2.055 1.00 . A A . 17 ILE HD11 1 1 8 2369 1 1 17 ILE HD12 H -7.510 4.328 -1.489 1.00 . A A . 17 ILE HD12 1 1 8 2370 1 1 17 ILE HD13 H -7.905 4.815 -3.135 1.00 . A A . 17 ILE HD13 1 1 8 2371 1 1 17 ILE HG12 H -5.149 4.479 -1.992 1.00 . A A . 17 ILE HG12 1 1 8 2372 1 1 17 ILE HG13 H -5.511 4.980 -3.636 1.00 . A A . 17 ILE HG13 1 1 8 2373 1 1 17 ILE HG21 H -6.503 3.393 -5.247 1.00 . A A . 17 ILE HG21 1 1 8 2374 1 1 17 ILE HG22 H -7.807 2.925 -4.157 1.00 . A A . 17 ILE HG22 1 1 8 2375 1 1 17 ILE HG23 H -6.728 1.697 -4.816 1.00 . A A . 17 ILE HG23 1 1 8 2376 1 1 17 ILE N N -5.267 2.016 -1.007 1.00 . A A . 17 ILE N 1 1 8 2377 1 1 17 ILE O O -7.440 0.037 -3.001 1.00 . A A . 17 ILE O 1 1 8 2378 1 1 18 TYR C C -5.684 -2.760 -1.936 1.00 . A A . 18 TYR C 1 1 8 2379 1 1 18 TYR CA C -5.288 -1.689 -2.959 1.00 . A A . 18 TYR CA 1 1 8 2380 1 1 18 TYR CB C -3.885 -1.970 -3.615 1.00 . A A . 18 TYR CB 1 1 8 2381 1 1 18 TYR CD1 C -2.442 -2.511 -1.608 1.00 . A A . 18 TYR CD1 1 1 8 2382 1 1 18 TYR CD2 C -2.201 -3.852 -3.528 1.00 . A A . 18 TYR CD2 1 1 8 2383 1 1 18 TYR CE1 C -1.446 -3.218 -0.979 1.00 . A A . 18 TYR CE1 1 1 8 2384 1 1 18 TYR CE2 C -1.212 -4.580 -2.906 1.00 . A A . 18 TYR CE2 1 1 8 2385 1 1 18 TYR CG C -2.841 -2.805 -2.878 1.00 . A A . 18 TYR CG 1 1 8 2386 1 1 18 TYR CZ C -0.838 -4.253 -1.625 1.00 . A A . 18 TYR CZ 1 1 8 2387 1 1 18 TYR H H -4.535 0.006 -1.914 1.00 . A A . 18 TYR H 1 1 8 2388 1 1 18 TYR HA H -6.030 -1.708 -3.744 1.00 . A A . 18 TYR HA 1 1 8 2389 1 1 18 TYR HB2 H -3.983 -2.458 -4.563 1.00 . A A . 18 TYR HB2 1 1 8 2390 1 1 18 TYR HB3 H -3.430 -1.007 -3.799 1.00 . A A . 18 TYR HB3 1 1 8 2391 1 1 18 TYR HD1 H -2.959 -1.709 -1.101 1.00 . A A . 18 TYR HD1 1 1 8 2392 1 1 18 TYR HD2 H -2.496 -4.105 -4.536 1.00 . A A . 18 TYR HD2 1 1 8 2393 1 1 18 TYR HE1 H -1.160 -2.954 0.028 1.00 . A A . 18 TYR HE1 1 1 8 2394 1 1 18 TYR HE2 H -0.735 -5.399 -3.424 1.00 . A A . 18 TYR HE2 1 1 8 2395 1 1 18 TYR HH H 0.955 -4.799 -1.573 1.00 . A A . 18 TYR HH 1 1 8 2396 1 1 18 TYR N N -5.318 -0.331 -2.399 1.00 . A A . 18 TYR N 1 1 8 2397 1 1 18 TYR O O -6.315 -3.762 -2.275 1.00 . A A . 18 TYR O 1 1 8 2398 1 1 18 TYR OH O 0.182 -4.935 -1.011 1.00 . A A . 18 TYR OH 1 1 8 2399 1 1 19 LEU C C -6.579 -2.950 1.337 1.00 . A A . 19 LEU C 1 1 8 2400 1 1 19 LEU CA C -5.581 -3.520 0.343 1.00 . A A . 19 LEU CA 1 1 8 2401 1 1 19 LEU CB C -4.227 -3.843 1.003 1.00 . A A . 19 LEU CB 1 1 8 2402 1 1 19 LEU CD1 C -2.583 -5.387 2.036 1.00 . A A . 19 LEU CD1 1 1 8 2403 1 1 19 LEU CD2 C -4.837 -5.233 3.025 1.00 . A A . 19 LEU CD2 1 1 8 2404 1 1 19 LEU CG C -4.051 -5.184 1.733 1.00 . A A . 19 LEU CG 1 1 8 2405 1 1 19 LEU H H -4.906 -1.685 -0.469 1.00 . A A . 19 LEU H 1 1 8 2406 1 1 19 LEU HA H -5.982 -4.413 -0.111 1.00 . A A . 19 LEU HA 1 1 8 2407 1 1 19 LEU HB2 H -3.475 -3.801 0.229 1.00 . A A . 19 LEU HB2 1 1 8 2408 1 1 19 LEU HB3 H -4.015 -3.050 1.705 1.00 . A A . 19 LEU HB3 1 1 8 2409 1 1 19 LEU HD11 H -2.236 -4.536 2.609 1.00 . A A . 19 LEU HD11 1 1 8 2410 1 1 19 LEU HD12 H -2.026 -5.443 1.111 1.00 . A A . 19 LEU HD12 1 1 8 2411 1 1 19 LEU HD13 H -2.443 -6.289 2.610 1.00 . A A . 19 LEU HD13 1 1 8 2412 1 1 19 LEU HD21 H -4.684 -6.195 3.489 1.00 . A A . 19 LEU HD21 1 1 8 2413 1 1 19 LEU HD22 H -5.886 -5.093 2.814 1.00 . A A . 19 LEU HD22 1 1 8 2414 1 1 19 LEU HD23 H -4.493 -4.452 3.689 1.00 . A A . 19 LEU HD23 1 1 8 2415 1 1 19 LEU HG H -4.376 -5.988 1.089 1.00 . A A . 19 LEU HG 1 1 8 2416 1 1 19 LEU N N -5.345 -2.534 -0.696 1.00 . A A . 19 LEU N 1 1 8 2417 1 1 19 LEU O O -7.341 -3.671 1.979 1.00 . A A . 19 LEU O 1 1 8 2418 1 1 20 ASN C C -8.706 -0.573 1.502 1.00 . A A . 20 ASN C 1 1 8 2419 1 1 20 ASN CA C -7.491 -0.984 2.304 1.00 . A A . 20 ASN CA 1 1 8 2420 1 1 20 ASN CB C -6.790 0.202 2.954 1.00 . A A . 20 ASN CB 1 1 8 2421 1 1 20 ASN CG C -7.686 1.082 3.787 1.00 . A A . 20 ASN CG 1 1 8 2422 1 1 20 ASN H H -5.970 -1.129 0.898 1.00 . A A . 20 ASN H 1 1 8 2423 1 1 20 ASN HA H -7.800 -1.682 3.068 1.00 . A A . 20 ASN HA 1 1 8 2424 1 1 20 ASN HB2 H -6.007 -0.165 3.597 1.00 . A A . 20 ASN HB2 1 1 8 2425 1 1 20 ASN HB3 H -6.354 0.796 2.170 1.00 . A A . 20 ASN HB3 1 1 8 2426 1 1 20 ASN HD21 H -7.935 2.266 2.253 1.00 . A A . 20 ASN HD21 1 1 8 2427 1 1 20 ASN HD22 H -8.766 2.717 3.704 1.00 . A A . 20 ASN HD22 1 1 8 2428 1 1 20 ASN N N -6.582 -1.665 1.440 1.00 . A A . 20 ASN N 1 1 8 2429 1 1 20 ASN ND2 N -8.176 2.124 3.198 1.00 . A A . 20 ASN ND2 1 1 8 2430 1 1 20 ASN O O -8.667 0.455 0.822 1.00 . A A . 20 ASN O 1 1 8 2431 1 1 20 ASN OXT O -9.690 -1.327 1.497 1.00 . A A . 20 ASN OXT 1 1 8 2432 1 1 20 ASN OD1 O -7.895 0.831 4.976 1.00 . A A . 20 ASN OD1 1 1 9 2433 1 1 1 SER C C 5.418 -1.535 -6.904 1.00 . A A . 1 SER C 1 1 9 2434 1 1 1 SER CA C 4.577 -1.383 -8.168 1.00 . A A . 1 SER CA 1 1 9 2435 1 1 1 SER CB C 3.272 -2.151 -8.011 1.00 . A A . 1 SER CB 1 1 9 2436 1 1 1 SER H1 H 5.512 -2.938 -9.078 1.00 . A A . 1 SER H1 1 1 9 2437 1 1 1 SER H2 H 6.203 -1.447 -9.414 1.00 . A A . 1 SER H2 1 1 9 2438 1 1 1 SER H3 H 4.736 -1.887 -10.151 1.00 . A A . 1 SER H3 1 1 9 2439 1 1 1 SER HA H 4.362 -0.345 -8.371 1.00 . A A . 1 SER HA 1 1 9 2440 1 1 1 SER HB2 H 3.493 -3.175 -7.750 1.00 . A A . 1 SER HB2 1 1 9 2441 1 1 1 SER HB3 H 2.684 -1.698 -7.228 1.00 . A A . 1 SER HB3 1 1 9 2442 1 1 1 SER HG H 1.696 -2.615 -9.002 1.00 . A A . 1 SER HG 1 1 9 2443 1 1 1 SER N N 5.299 -1.942 -9.282 1.00 . A A . 1 SER N 1 1 9 2444 1 1 1 SER O O 6.120 -2.527 -6.766 1.00 . A A . 1 SER O 1 1 9 2445 1 1 1 SER OG O 2.512 -2.142 -9.222 1.00 . A A . 1 SER OG 1 1 9 2446 1 1 2 PRO C C 5.218 -1.518 -3.769 1.00 . A A . 2 PRO C 1 1 9 2447 1 1 2 PRO CA C 6.092 -0.672 -4.710 1.00 . A A . 2 PRO CA 1 1 9 2448 1 1 2 PRO CB C 6.199 0.777 -4.182 1.00 . A A . 2 PRO CB 1 1 9 2449 1 1 2 PRO CD C 4.864 0.805 -6.172 1.00 . A A . 2 PRO CD 1 1 9 2450 1 1 2 PRO CG C 5.748 1.652 -5.305 1.00 . A A . 2 PRO CG 1 1 9 2451 1 1 2 PRO HA H 7.072 -1.113 -4.818 1.00 . A A . 2 PRO HA 1 1 9 2452 1 1 2 PRO HB2 H 5.563 0.890 -3.315 1.00 . A A . 2 PRO HB2 1 1 9 2453 1 1 2 PRO HB3 H 7.222 0.985 -3.907 1.00 . A A . 2 PRO HB3 1 1 9 2454 1 1 2 PRO HD2 H 3.841 0.849 -5.829 1.00 . A A . 2 PRO HD2 1 1 9 2455 1 1 2 PRO HD3 H 4.937 1.134 -7.198 1.00 . A A . 2 PRO HD3 1 1 9 2456 1 1 2 PRO HG2 H 5.195 2.495 -4.916 1.00 . A A . 2 PRO HG2 1 1 9 2457 1 1 2 PRO HG3 H 6.605 1.996 -5.865 1.00 . A A . 2 PRO HG3 1 1 9 2458 1 1 2 PRO N N 5.433 -0.534 -6.001 1.00 . A A . 2 PRO N 1 1 9 2459 1 1 2 PRO O O 3.978 -1.404 -3.814 1.00 . A A . 2 PRO O 1 1 9 2460 1 1 3 PRO C C 4.214 -2.475 -1.028 1.00 . A A . 3 PRO C 1 1 9 2461 1 1 3 PRO CA C 5.086 -3.268 -2.014 1.00 . A A . 3 PRO CA 1 1 9 2462 1 1 3 PRO CB C 6.204 -3.991 -1.260 1.00 . A A . 3 PRO CB 1 1 9 2463 1 1 3 PRO CD C 7.274 -2.643 -2.883 1.00 . A A . 3 PRO CD 1 1 9 2464 1 1 3 PRO CG C 7.348 -3.968 -2.199 1.00 . A A . 3 PRO CG 1 1 9 2465 1 1 3 PRO HA H 4.481 -3.986 -2.545 1.00 . A A . 3 PRO HA 1 1 9 2466 1 1 3 PRO HB2 H 6.426 -3.461 -0.346 1.00 . A A . 3 PRO HB2 1 1 9 2467 1 1 3 PRO HB3 H 5.900 -5.003 -1.033 1.00 . A A . 3 PRO HB3 1 1 9 2468 1 1 3 PRO HD2 H 7.776 -1.884 -2.303 1.00 . A A . 3 PRO HD2 1 1 9 2469 1 1 3 PRO HD3 H 7.700 -2.720 -3.872 1.00 . A A . 3 PRO HD3 1 1 9 2470 1 1 3 PRO HG2 H 8.276 -4.059 -1.657 1.00 . A A . 3 PRO HG2 1 1 9 2471 1 1 3 PRO HG3 H 7.250 -4.767 -2.919 1.00 . A A . 3 PRO HG3 1 1 9 2472 1 1 3 PRO N N 5.824 -2.397 -2.953 1.00 . A A . 3 PRO N 1 1 9 2473 1 1 3 PRO O O 4.637 -1.421 -0.544 1.00 . A A . 3 PRO O 1 1 9 2474 1 1 4 PRO C C 2.652 -1.942 1.525 1.00 . A A . 4 PRO C 1 1 9 2475 1 1 4 PRO CA C 2.018 -2.329 0.193 1.00 . A A . 4 PRO CA 1 1 9 2476 1 1 4 PRO CB C 0.952 -3.402 0.407 1.00 . A A . 4 PRO CB 1 1 9 2477 1 1 4 PRO CD C 2.417 -4.238 -1.275 1.00 . A A . 4 PRO CD 1 1 9 2478 1 1 4 PRO CG C 0.978 -4.196 -0.842 1.00 . A A . 4 PRO CG 1 1 9 2479 1 1 4 PRO HA H 1.574 -1.455 -0.260 1.00 . A A . 4 PRO HA 1 1 9 2480 1 1 4 PRO HB2 H 1.212 -4.001 1.267 1.00 . A A . 4 PRO HB2 1 1 9 2481 1 1 4 PRO HB3 H -0.012 -2.938 0.562 1.00 . A A . 4 PRO HB3 1 1 9 2482 1 1 4 PRO HD2 H 2.914 -5.103 -0.860 1.00 . A A . 4 PRO HD2 1 1 9 2483 1 1 4 PRO HD3 H 2.475 -4.249 -2.354 1.00 . A A . 4 PRO HD3 1 1 9 2484 1 1 4 PRO HG2 H 0.610 -5.194 -0.651 1.00 . A A . 4 PRO HG2 1 1 9 2485 1 1 4 PRO HG3 H 0.375 -3.713 -1.597 1.00 . A A . 4 PRO HG3 1 1 9 2486 1 1 4 PRO N N 2.979 -2.985 -0.726 1.00 . A A . 4 PRO N 1 1 9 2487 1 1 4 PRO O O 2.425 -0.853 2.045 1.00 . A A . 4 PRO O 1 1 9 2488 1 1 5 ARG C C 5.632 -2.655 3.050 1.00 . A A . 5 ARG C 1 1 9 2489 1 1 5 ARG CA C 4.156 -2.540 3.280 1.00 . A A . 5 ARG CA 1 1 9 2490 1 1 5 ARG CB C 3.705 -3.373 4.485 1.00 . A A . 5 ARG CB 1 1 9 2491 1 1 5 ARG CD C 2.220 -1.506 5.349 1.00 . A A . 5 ARG CD 1 1 9 2492 1 1 5 ARG CG C 2.323 -3.005 5.022 1.00 . A A . 5 ARG CG 1 1 9 2493 1 1 5 ARG CZ C 3.623 0.217 6.499 1.00 . A A . 5 ARG CZ 1 1 9 2494 1 1 5 ARG H H 3.549 -3.708 1.647 1.00 . A A . 5 ARG H 1 1 9 2495 1 1 5 ARG HA H 3.964 -1.499 3.490 1.00 . A A . 5 ARG HA 1 1 9 2496 1 1 5 ARG HB2 H 3.687 -4.413 4.195 1.00 . A A . 5 ARG HB2 1 1 9 2497 1 1 5 ARG HB3 H 4.424 -3.246 5.280 1.00 . A A . 5 ARG HB3 1 1 9 2498 1 1 5 ARG HD2 H 2.253 -0.935 4.433 1.00 . A A . 5 ARG HD2 1 1 9 2499 1 1 5 ARG HD3 H 1.271 -1.329 5.836 1.00 . A A . 5 ARG HD3 1 1 9 2500 1 1 5 ARG HE H 3.816 -1.788 6.657 1.00 . A A . 5 ARG HE 1 1 9 2501 1 1 5 ARG HG2 H 1.578 -3.257 4.284 1.00 . A A . 5 ARG HG2 1 1 9 2502 1 1 5 ARG HG3 H 2.142 -3.571 5.924 1.00 . A A . 5 ARG HG3 1 1 9 2503 1 1 5 ARG HH11 H 2.150 1.111 5.339 1.00 . A A . 5 ARG HH11 1 1 9 2504 1 1 5 ARG HH12 H 3.194 2.179 6.136 1.00 . A A . 5 ARG HH12 1 1 9 2505 1 1 5 ARG HH21 H 5.175 -0.271 7.713 1.00 . A A . 5 ARG HH21 1 1 9 2506 1 1 5 ARG HH22 H 4.917 1.408 7.541 1.00 . A A . 5 ARG HH22 1 1 9 2507 1 1 5 ARG N N 3.433 -2.834 2.078 1.00 . A A . 5 ARG N 1 1 9 2508 1 1 5 ARG NE N 3.299 -1.058 6.241 1.00 . A A . 5 ARG NE 1 1 9 2509 1 1 5 ARG NH1 N 2.942 1.224 5.958 1.00 . A A . 5 ARG NH1 1 1 9 2510 1 1 5 ARG NH2 N 4.641 0.475 7.302 1.00 . A A . 5 ARG NH2 1 1 9 2511 1 1 5 ARG O O 6.175 -3.760 2.829 1.00 . A A . 5 ARG O 1 1 9 2512 1 1 6 GLY C C 8.078 0.006 2.991 1.00 . A A . 6 GLY C 1 1 9 2513 1 1 6 GLY CA C 7.663 -1.421 2.855 1.00 . A A . 6 GLY CA 1 1 9 2514 1 1 6 GLY H H 5.766 -0.683 3.169 1.00 . A A . 6 GLY H 1 1 9 2515 1 1 6 GLY HA2 H 8.168 -2.020 3.597 1.00 . A A . 6 GLY HA2 1 1 9 2516 1 1 6 GLY HA3 H 7.916 -1.766 1.864 1.00 . A A . 6 GLY HA3 1 1 9 2517 1 1 6 GLY N N 6.260 -1.521 3.043 1.00 . A A . 6 GLY N 1 1 9 2518 1 1 6 GLY O O 7.211 0.907 2.995 1.00 . A A . 6 GLY O 1 1 9 2519 1 1 7 SER C C 10.052 2.197 1.859 1.00 . A A . 7 SER C 1 1 9 2520 1 1 7 SER CA C 9.857 1.582 3.240 1.00 . A A . 7 SER CA 1 1 9 2521 1 1 7 SER CB C 11.159 1.609 4.067 1.00 . A A . 7 SER CB 1 1 9 2522 1 1 7 SER H H 9.979 -0.513 3.065 1.00 . A A . 7 SER H 1 1 9 2523 1 1 7 SER HA H 9.099 2.155 3.753 1.00 . A A . 7 SER HA 1 1 9 2524 1 1 7 SER HB2 H 10.986 1.125 5.017 1.00 . A A . 7 SER HB2 1 1 9 2525 1 1 7 SER HB3 H 11.927 1.073 3.530 1.00 . A A . 7 SER HB3 1 1 9 2526 1 1 7 SER HG H 11.634 3.409 3.471 1.00 . A A . 7 SER HG 1 1 9 2527 1 1 7 SER N N 9.356 0.245 3.101 1.00 . A A . 7 SER N 1 1 9 2528 1 1 7 SER O O 11.156 2.203 1.303 1.00 . A A . 7 SER O 1 1 9 2529 1 1 7 SER OG O 11.612 2.938 4.314 1.00 . A A . 7 SER OG 1 1 9 2530 1 1 8 SER C C 7.701 4.096 -0.109 1.00 . A A . 8 SER C 1 1 9 2531 1 1 8 SER CA C 8.942 3.230 -0.016 1.00 . A A . 8 SER CA 1 1 9 2532 1 1 8 SER CB C 8.914 2.163 -1.125 1.00 . A A . 8 SER CB 1 1 9 2533 1 1 8 SER H H 8.106 2.474 1.737 1.00 . A A . 8 SER H 1 1 9 2534 1 1 8 SER HA H 9.832 3.831 -0.124 1.00 . A A . 8 SER HA 1 1 9 2535 1 1 8 SER HB2 H 8.040 1.542 -0.997 1.00 . A A . 8 SER HB2 1 1 9 2536 1 1 8 SER HB3 H 8.871 2.646 -2.090 1.00 . A A . 8 SER HB3 1 1 9 2537 1 1 8 SER HG H 10.542 1.567 -0.253 1.00 . A A . 8 SER HG 1 1 9 2538 1 1 8 SER N N 8.963 2.605 1.274 1.00 . A A . 8 SER N 1 1 9 2539 1 1 8 SER O O 6.576 3.577 0.021 1.00 . A A . 8 SER O 1 1 9 2540 1 1 8 SER OG O 10.073 1.334 -1.071 1.00 . A A . 8 SER OG 1 1 9 2541 1 1 9 PRO C C 5.943 5.944 -1.676 1.00 . A A . 9 PRO C 1 1 9 2542 1 1 9 PRO CA C 6.736 6.325 -0.435 1.00 . A A . 9 PRO CA 1 1 9 2543 1 1 9 PRO CB C 7.385 7.708 -0.608 1.00 . A A . 9 PRO CB 1 1 9 2544 1 1 9 PRO CD C 9.153 6.137 -0.324 1.00 . A A . 9 PRO CD 1 1 9 2545 1 1 9 PRO CG C 8.756 7.556 -0.052 1.00 . A A . 9 PRO CG 1 1 9 2546 1 1 9 PRO HA H 6.088 6.311 0.429 1.00 . A A . 9 PRO HA 1 1 9 2547 1 1 9 PRO HB2 H 7.411 7.962 -1.657 1.00 . A A . 9 PRO HB2 1 1 9 2548 1 1 9 PRO HB3 H 6.818 8.449 -0.065 1.00 . A A . 9 PRO HB3 1 1 9 2549 1 1 9 PRO HD2 H 9.610 6.050 -1.298 1.00 . A A . 9 PRO HD2 1 1 9 2550 1 1 9 PRO HD3 H 9.820 5.784 0.448 1.00 . A A . 9 PRO HD3 1 1 9 2551 1 1 9 PRO HG2 H 9.431 8.240 -0.545 1.00 . A A . 9 PRO HG2 1 1 9 2552 1 1 9 PRO HG3 H 8.744 7.745 1.012 1.00 . A A . 9 PRO HG3 1 1 9 2553 1 1 9 PRO N N 7.862 5.419 -0.275 1.00 . A A . 9 PRO N 1 1 9 2554 1 1 9 PRO O O 6.427 6.057 -2.800 1.00 . A A . 9 PRO O 1 1 9 2555 1 1 10 GLY C C 3.432 3.615 -2.300 1.00 . A A . 10 GLY C 1 1 9 2556 1 1 10 GLY CA C 3.962 4.987 -2.549 1.00 . A A . 10 GLY CA 1 1 9 2557 1 1 10 GLY H H 4.454 5.336 -0.539 1.00 . A A . 10 GLY H 1 1 9 2558 1 1 10 GLY HA2 H 3.137 5.672 -2.674 1.00 . A A . 10 GLY HA2 1 1 9 2559 1 1 10 GLY HA3 H 4.555 4.972 -3.452 1.00 . A A . 10 GLY HA3 1 1 9 2560 1 1 10 GLY N N 4.777 5.422 -1.462 1.00 . A A . 10 GLY N 1 1 9 2561 1 1 10 GLY O O 2.306 3.321 -2.646 1.00 . A A . 10 GLY O 1 1 9 2562 1 1 11 GLY C C 2.622 1.368 -0.462 1.00 . A A . 11 GLY C 1 1 9 2563 1 1 11 GLY CA C 3.820 1.416 -1.373 1.00 . A A . 11 GLY CA 1 1 9 2564 1 1 11 GLY H H 5.100 3.113 -1.320 1.00 . A A . 11 GLY H 1 1 9 2565 1 1 11 GLY HA2 H 3.571 0.935 -2.306 1.00 . A A . 11 GLY HA2 1 1 9 2566 1 1 11 GLY HA3 H 4.637 0.886 -0.907 1.00 . A A . 11 GLY HA3 1 1 9 2567 1 1 11 GLY N N 4.231 2.787 -1.642 1.00 . A A . 11 GLY N 1 1 9 2568 1 1 11 GLY O O 1.628 0.693 -0.743 1.00 . A A . 11 GLY O 1 1 9 2569 1 1 12 ASP C C 0.416 2.961 0.940 1.00 . A A . 12 ASP C 1 1 9 2570 1 1 12 ASP CA C 1.615 2.234 1.560 1.00 . A A . 12 ASP CA 1 1 9 2571 1 1 12 ASP CB C 2.106 2.930 2.826 1.00 . A A . 12 ASP CB 1 1 9 2572 1 1 12 ASP CG C 1.072 2.989 3.923 1.00 . A A . 12 ASP CG 1 1 9 2573 1 1 12 ASP H H 3.516 2.642 0.757 1.00 . A A . 12 ASP H 1 1 9 2574 1 1 12 ASP HA H 1.310 1.226 1.808 1.00 . A A . 12 ASP HA 1 1 9 2575 1 1 12 ASP HB2 H 2.965 2.398 3.207 1.00 . A A . 12 ASP HB2 1 1 9 2576 1 1 12 ASP HB3 H 2.403 3.938 2.577 1.00 . A A . 12 ASP HB3 1 1 9 2577 1 1 12 ASP N N 2.695 2.137 0.598 1.00 . A A . 12 ASP N 1 1 9 2578 1 1 12 ASP O O -0.717 2.755 1.333 1.00 . A A . 12 ASP O 1 1 9 2579 1 1 12 ASP OD1 O 0.759 1.933 4.518 1.00 . A A . 12 ASP OD1 1 1 9 2580 1 1 12 ASP OD2 O 0.608 4.102 4.255 1.00 . A A . 12 ASP OD2 1 1 9 2581 1 1 13 LYS C C -1.184 3.410 -1.614 1.00 . A A . 13 LYS C 1 1 9 2582 1 1 13 LYS CA C -0.394 4.445 -0.809 1.00 . A A . 13 LYS CA 1 1 9 2583 1 1 13 LYS CB C 0.154 5.544 -1.729 1.00 . A A . 13 LYS CB 1 1 9 2584 1 1 13 LYS CD C -1.953 6.949 -1.759 1.00 . A A . 13 LYS CD 1 1 9 2585 1 1 13 LYS CE C -2.987 7.610 -2.649 1.00 . A A . 13 LYS CE 1 1 9 2586 1 1 13 LYS CG C -0.906 6.224 -2.592 1.00 . A A . 13 LYS CG 1 1 9 2587 1 1 13 LYS H H 1.610 3.914 -0.337 1.00 . A A . 13 LYS H 1 1 9 2588 1 1 13 LYS HA H -1.057 4.882 -0.074 1.00 . A A . 13 LYS HA 1 1 9 2589 1 1 13 LYS HB2 H 0.627 6.299 -1.119 1.00 . A A . 13 LYS HB2 1 1 9 2590 1 1 13 LYS HB3 H 0.894 5.106 -2.382 1.00 . A A . 13 LYS HB3 1 1 9 2591 1 1 13 LYS HD2 H -2.448 6.236 -1.116 1.00 . A A . 13 LYS HD2 1 1 9 2592 1 1 13 LYS HD3 H -1.467 7.705 -1.160 1.00 . A A . 13 LYS HD3 1 1 9 2593 1 1 13 LYS HE2 H -3.428 6.852 -3.277 1.00 . A A . 13 LYS HE2 1 1 9 2594 1 1 13 LYS HE3 H -3.753 8.057 -2.032 1.00 . A A . 13 LYS HE3 1 1 9 2595 1 1 13 LYS HG2 H -0.444 6.926 -3.267 1.00 . A A . 13 LYS HG2 1 1 9 2596 1 1 13 LYS HG3 H -1.401 5.461 -3.175 1.00 . A A . 13 LYS HG3 1 1 9 2597 1 1 13 LYS HZ1 H -3.103 9.057 -4.152 1.00 . A A . 13 LYS HZ1 1 1 9 2598 1 1 13 LYS HZ2 H -1.618 8.292 -4.109 1.00 . A A . 13 LYS HZ2 1 1 9 2599 1 1 13 LYS HZ3 H -2.021 9.427 -2.937 1.00 . A A . 13 LYS HZ3 1 1 9 2600 1 1 13 LYS N N 0.676 3.777 -0.078 1.00 . A A . 13 LYS N 1 1 9 2601 1 1 13 LYS NZ N -2.394 8.645 -3.515 1.00 . A A . 13 LYS NZ 1 1 9 2602 1 1 13 LYS O O -2.412 3.457 -1.667 1.00 . A A . 13 LYS O 1 1 9 2603 1 1 14 LEU C C -1.894 0.534 -1.959 1.00 . A A . 14 LEU C 1 1 9 2604 1 1 14 LEU CA C -1.101 1.363 -2.928 1.00 . A A . 14 LEU CA 1 1 9 2605 1 1 14 LEU CB C -0.085 0.481 -3.660 1.00 . A A . 14 LEU CB 1 1 9 2606 1 1 14 LEU CD1 C 0.869 2.290 -5.158 1.00 . A A . 14 LEU CD1 1 1 9 2607 1 1 14 LEU CD2 C 1.287 -0.110 -5.645 1.00 . A A . 14 LEU CD2 1 1 9 2608 1 1 14 LEU CG C 0.302 0.887 -5.087 1.00 . A A . 14 LEU CG 1 1 9 2609 1 1 14 LEU H H 0.514 2.533 -2.210 1.00 . A A . 14 LEU H 1 1 9 2610 1 1 14 LEU HA H -1.785 1.788 -3.648 1.00 . A A . 14 LEU HA 1 1 9 2611 1 1 14 LEU HB2 H 0.817 0.459 -3.066 1.00 . A A . 14 LEU HB2 1 1 9 2612 1 1 14 LEU HB3 H -0.485 -0.522 -3.692 1.00 . A A . 14 LEU HB3 1 1 9 2613 1 1 14 LEU HD11 H 1.763 2.351 -4.556 1.00 . A A . 14 LEU HD11 1 1 9 2614 1 1 14 LEU HD12 H 0.137 2.989 -4.782 1.00 . A A . 14 LEU HD12 1 1 9 2615 1 1 14 LEU HD13 H 1.105 2.533 -6.182 1.00 . A A . 14 LEU HD13 1 1 9 2616 1 1 14 LEU HD21 H 2.160 -0.146 -5.011 1.00 . A A . 14 LEU HD21 1 1 9 2617 1 1 14 LEU HD22 H 1.575 0.183 -6.643 1.00 . A A . 14 LEU HD22 1 1 9 2618 1 1 14 LEU HD23 H 0.826 -1.086 -5.673 1.00 . A A . 14 LEU HD23 1 1 9 2619 1 1 14 LEU HG H -0.579 0.855 -5.711 1.00 . A A . 14 LEU HG 1 1 9 2620 1 1 14 LEU N N -0.468 2.472 -2.224 1.00 . A A . 14 LEU N 1 1 9 2621 1 1 14 LEU O O -2.983 0.074 -2.280 1.00 . A A . 14 LEU O 1 1 9 2622 1 1 15 TRP C C -3.361 0.344 0.558 1.00 . A A . 15 TRP C 1 1 9 2623 1 1 15 TRP CA C -2.017 -0.333 0.319 1.00 . A A . 15 TRP CA 1 1 9 2624 1 1 15 TRP CB C -1.180 -0.228 1.605 1.00 . A A . 15 TRP CB 1 1 9 2625 1 1 15 TRP CD1 C -0.655 -2.019 3.288 1.00 . A A . 15 TRP CD1 1 1 9 2626 1 1 15 TRP CD2 C -2.733 -1.275 3.489 1.00 . A A . 15 TRP CD2 1 1 9 2627 1 1 15 TRP CE2 C -2.524 -2.263 4.456 1.00 . A A . 15 TRP CE2 1 1 9 2628 1 1 15 TRP CE3 C -3.965 -0.667 3.428 1.00 . A A . 15 TRP CE3 1 1 9 2629 1 1 15 TRP CG C -1.511 -1.144 2.745 1.00 . A A . 15 TRP CG 1 1 9 2630 1 1 15 TRP CH2 C -4.721 -2.009 5.248 1.00 . A A . 15 TRP CH2 1 1 9 2631 1 1 15 TRP CZ2 C -3.517 -2.645 5.355 1.00 . A A . 15 TRP CZ2 1 1 9 2632 1 1 15 TRP CZ3 C -4.933 -1.033 4.292 1.00 . A A . 15 TRP CZ3 1 1 9 2633 1 1 15 TRP H H -0.452 0.748 -0.615 1.00 . A A . 15 TRP H 1 1 9 2634 1 1 15 TRP HA H -2.090 -1.361 0.002 1.00 . A A . 15 TRP HA 1 1 9 2635 1 1 15 TRP HB2 H -0.170 -0.495 1.359 1.00 . A A . 15 TRP HB2 1 1 9 2636 1 1 15 TRP HB3 H -1.208 0.788 1.967 1.00 . A A . 15 TRP HB3 1 1 9 2637 1 1 15 TRP HD1 H 0.355 -2.115 2.919 1.00 . A A . 15 TRP HD1 1 1 9 2638 1 1 15 TRP HE1 H -0.820 -3.395 4.864 1.00 . A A . 15 TRP HE1 1 1 9 2639 1 1 15 TRP HE3 H -4.164 0.100 2.693 1.00 . A A . 15 TRP HE3 1 1 9 2640 1 1 15 TRP HH2 H -5.550 -2.241 5.898 1.00 . A A . 15 TRP HH2 1 1 9 2641 1 1 15 TRP HZ2 H -3.359 -3.407 6.103 1.00 . A A . 15 TRP HZ2 1 1 9 2642 1 1 15 TRP HZ3 H -5.889 -0.547 4.208 1.00 . A A . 15 TRP HZ3 1 1 9 2643 1 1 15 TRP N N -1.352 0.377 -0.758 1.00 . A A . 15 TRP N 1 1 9 2644 1 1 15 TRP NE1 N -1.246 -2.698 4.315 1.00 . A A . 15 TRP NE1 1 1 9 2645 1 1 15 TRP O O -4.433 -0.292 0.492 1.00 . A A . 15 TRP O 1 1 9 2646 1 1 16 GLN C C -5.484 2.551 -0.063 1.00 . A A . 16 GLN C 1 1 9 2647 1 1 16 GLN CA C -4.444 2.501 1.069 1.00 . A A . 16 GLN CA 1 1 9 2648 1 1 16 GLN CB C -4.009 3.930 1.423 1.00 . A A . 16 GLN CB 1 1 9 2649 1 1 16 GLN CD C -3.653 3.402 3.876 1.00 . A A . 16 GLN CD 1 1 9 2650 1 1 16 GLN CG C -3.097 4.064 2.644 1.00 . A A . 16 GLN CG 1 1 9 2651 1 1 16 GLN H H -2.408 2.088 0.697 1.00 . A A . 16 GLN H 1 1 9 2652 1 1 16 GLN HA H -4.899 2.069 1.948 1.00 . A A . 16 GLN HA 1 1 9 2653 1 1 16 GLN HB2 H -3.485 4.345 0.575 1.00 . A A . 16 GLN HB2 1 1 9 2654 1 1 16 GLN HB3 H -4.896 4.520 1.598 1.00 . A A . 16 GLN HB3 1 1 9 2655 1 1 16 GLN HE21 H -2.472 1.855 3.597 1.00 . A A . 16 GLN HE21 1 1 9 2656 1 1 16 GLN HE22 H -3.514 1.769 4.970 1.00 . A A . 16 GLN HE22 1 1 9 2657 1 1 16 GLN HG2 H -2.168 3.554 2.421 1.00 . A A . 16 GLN HG2 1 1 9 2658 1 1 16 GLN HG3 H -2.913 5.107 2.852 1.00 . A A . 16 GLN HG3 1 1 9 2659 1 1 16 GLN N N -3.292 1.660 0.756 1.00 . A A . 16 GLN N 1 1 9 2660 1 1 16 GLN NE2 N -3.169 2.231 4.176 1.00 . A A . 16 GLN NE2 1 1 9 2661 1 1 16 GLN O O -6.527 3.178 0.081 1.00 . A A . 16 GLN O 1 1 9 2662 1 1 16 GLN OE1 O -4.444 3.990 4.607 1.00 . A A . 16 GLN OE1 1 1 9 2663 1 1 17 ILE C C -6.503 0.389 -2.561 1.00 . A A . 17 ILE C 1 1 9 2664 1 1 17 ILE CA C -6.096 1.863 -2.287 1.00 . A A . 17 ILE CA 1 1 9 2665 1 1 17 ILE CB C -5.480 2.565 -3.555 1.00 . A A . 17 ILE CB 1 1 9 2666 1 1 17 ILE CD1 C -4.829 4.869 -4.444 1.00 . A A . 17 ILE CD1 1 1 9 2667 1 1 17 ILE CG1 C -5.381 4.077 -3.291 1.00 . A A . 17 ILE CG1 1 1 9 2668 1 1 17 ILE CG2 C -6.285 2.300 -4.830 1.00 . A A . 17 ILE CG2 1 1 9 2669 1 1 17 ILE H H -4.286 1.544 -1.272 1.00 . A A . 17 ILE H 1 1 9 2670 1 1 17 ILE HA H -6.978 2.411 -1.993 1.00 . A A . 17 ILE HA 1 1 9 2671 1 1 17 ILE HB H -4.474 2.194 -3.701 1.00 . A A . 17 ILE HB 1 1 9 2672 1 1 17 ILE HD11 H -3.802 4.585 -4.619 1.00 . A A . 17 ILE HD11 1 1 9 2673 1 1 17 ILE HD12 H -4.908 5.923 -4.230 1.00 . A A . 17 ILE HD12 1 1 9 2674 1 1 17 ILE HD13 H -5.419 4.636 -5.318 1.00 . A A . 17 ILE HD13 1 1 9 2675 1 1 17 ILE HG12 H -6.368 4.462 -3.075 1.00 . A A . 17 ILE HG12 1 1 9 2676 1 1 17 ILE HG13 H -4.744 4.243 -2.435 1.00 . A A . 17 ILE HG13 1 1 9 2677 1 1 17 ILE HG21 H -7.292 2.669 -4.700 1.00 . A A . 17 ILE HG21 1 1 9 2678 1 1 17 ILE HG22 H -6.313 1.238 -5.026 1.00 . A A . 17 ILE HG22 1 1 9 2679 1 1 17 ILE HG23 H -5.819 2.809 -5.659 1.00 . A A . 17 ILE HG23 1 1 9 2680 1 1 17 ILE N N -5.179 1.939 -1.178 1.00 . A A . 17 ILE N 1 1 9 2681 1 1 17 ILE O O -7.496 0.107 -3.235 1.00 . A A . 17 ILE O 1 1 9 2682 1 1 18 TYR C C -6.740 -2.669 -1.065 1.00 . A A . 18 TYR C 1 1 9 2683 1 1 18 TYR CA C -5.993 -1.958 -2.213 1.00 . A A . 18 TYR CA 1 1 9 2684 1 1 18 TYR CB C -4.628 -2.599 -2.571 1.00 . A A . 18 TYR CB 1 1 9 2685 1 1 18 TYR CD1 C -3.512 -3.390 -0.474 1.00 . A A . 18 TYR CD1 1 1 9 2686 1 1 18 TYR CD2 C -4.032 -4.999 -2.121 1.00 . A A . 18 TYR CD2 1 1 9 2687 1 1 18 TYR CE1 C -2.921 -4.355 0.301 1.00 . A A . 18 TYR CE1 1 1 9 2688 1 1 18 TYR CE2 C -3.465 -5.982 -1.349 1.00 . A A . 18 TYR CE2 1 1 9 2689 1 1 18 TYR CG C -4.073 -3.688 -1.687 1.00 . A A . 18 TYR CG 1 1 9 2690 1 1 18 TYR CZ C -2.905 -5.656 -0.141 1.00 . A A . 18 TYR CZ 1 1 9 2691 1 1 18 TYR H H -5.080 -0.263 -1.332 1.00 . A A . 18 TYR H 1 1 9 2692 1 1 18 TYR HA H -6.627 -2.014 -3.086 1.00 . A A . 18 TYR HA 1 1 9 2693 1 1 18 TYR HB2 H -4.652 -3.013 -3.560 1.00 . A A . 18 TYR HB2 1 1 9 2694 1 1 18 TYR HB3 H -3.900 -1.801 -2.580 1.00 . A A . 18 TYR HB3 1 1 9 2695 1 1 18 TYR HD1 H -3.584 -2.367 -0.145 1.00 . A A . 18 TYR HD1 1 1 9 2696 1 1 18 TYR HD2 H -4.471 -5.253 -3.073 1.00 . A A . 18 TYR HD2 1 1 9 2697 1 1 18 TYR HE1 H -2.486 -4.091 1.253 1.00 . A A . 18 TYR HE1 1 1 9 2698 1 1 18 TYR HE2 H -3.455 -7.003 -1.697 1.00 . A A . 18 TYR HE2 1 1 9 2699 1 1 18 TYR HH H -2.411 -6.405 1.556 1.00 . A A . 18 TYR HH 1 1 9 2700 1 1 18 TYR N N -5.785 -0.536 -1.960 1.00 . A A . 18 TYR N 1 1 9 2701 1 1 18 TYR O O -7.490 -3.621 -1.297 1.00 . A A . 18 TYR O 1 1 9 2702 1 1 18 TYR OH O -2.312 -6.636 0.622 1.00 . A A . 18 TYR OH 1 1 9 2703 1 1 19 LEU C C -8.029 -1.747 2.072 1.00 . A A . 19 LEU C 1 1 9 2704 1 1 19 LEU CA C -7.228 -2.783 1.320 1.00 . A A . 19 LEU CA 1 1 9 2705 1 1 19 LEU CB C -6.247 -3.434 2.274 1.00 . A A . 19 LEU CB 1 1 9 2706 1 1 19 LEU CD1 C -4.787 -5.274 3.021 1.00 . A A . 19 LEU CD1 1 1 9 2707 1 1 19 LEU CD2 C -7.002 -5.788 2.029 1.00 . A A . 19 LEU CD2 1 1 9 2708 1 1 19 LEU CG C -5.810 -4.854 1.985 1.00 . A A . 19 LEU CG 1 1 9 2709 1 1 19 LEU H H -5.890 -1.481 0.283 1.00 . A A . 19 LEU H 1 1 9 2710 1 1 19 LEU HA H -7.906 -3.539 0.957 1.00 . A A . 19 LEU HA 1 1 9 2711 1 1 19 LEU HB2 H -5.353 -2.830 2.225 1.00 . A A . 19 LEU HB2 1 1 9 2712 1 1 19 LEU HB3 H -6.649 -3.387 3.275 1.00 . A A . 19 LEU HB3 1 1 9 2713 1 1 19 LEU HD11 H -4.451 -6.281 2.820 1.00 . A A . 19 LEU HD11 1 1 9 2714 1 1 19 LEU HD12 H -5.232 -5.218 4.002 1.00 . A A . 19 LEU HD12 1 1 9 2715 1 1 19 LEU HD13 H -3.951 -4.591 2.966 1.00 . A A . 19 LEU HD13 1 1 9 2716 1 1 19 LEU HD21 H -6.675 -6.806 1.882 1.00 . A A . 19 LEU HD21 1 1 9 2717 1 1 19 LEU HD22 H -7.701 -5.517 1.252 1.00 . A A . 19 LEU HD22 1 1 9 2718 1 1 19 LEU HD23 H -7.473 -5.690 2.995 1.00 . A A . 19 LEU HD23 1 1 9 2719 1 1 19 LEU HG H -5.358 -4.909 1.006 1.00 . A A . 19 LEU HG 1 1 9 2720 1 1 19 LEU N N -6.538 -2.209 0.152 1.00 . A A . 19 LEU N 1 1 9 2721 1 1 19 LEU O O -8.778 -2.073 2.988 1.00 . A A . 19 LEU O 1 1 9 2722 1 1 20 ASN C C -9.522 1.136 1.355 1.00 . A A . 20 ASN C 1 1 9 2723 1 1 20 ASN CA C -8.541 0.566 2.337 1.00 . A A . 20 ASN CA 1 1 9 2724 1 1 20 ASN CB C -7.545 1.619 2.848 1.00 . A A . 20 ASN CB 1 1 9 2725 1 1 20 ASN CG C -8.179 2.949 3.252 1.00 . A A . 20 ASN CG 1 1 9 2726 1 1 20 ASN H H -7.248 -0.334 0.968 1.00 . A A . 20 ASN H 1 1 9 2727 1 1 20 ASN HA H -9.087 0.156 3.175 1.00 . A A . 20 ASN HA 1 1 9 2728 1 1 20 ASN HB2 H -7.050 1.218 3.720 1.00 . A A . 20 ASN HB2 1 1 9 2729 1 1 20 ASN HB3 H -6.804 1.791 2.085 1.00 . A A . 20 ASN HB3 1 1 9 2730 1 1 20 ASN HD21 H -7.831 3.672 1.456 1.00 . A A . 20 ASN HD21 1 1 9 2731 1 1 20 ASN HD22 H -8.594 4.767 2.548 1.00 . A A . 20 ASN HD22 1 1 9 2732 1 1 20 ASN N N -7.848 -0.531 1.713 1.00 . A A . 20 ASN N 1 1 9 2733 1 1 20 ASN ND2 N -8.213 3.889 2.339 1.00 . A A . 20 ASN ND2 1 1 9 2734 1 1 20 ASN O O -9.092 1.629 0.308 1.00 . A A . 20 ASN O 1 1 9 2735 1 1 20 ASN OXT O -10.740 1.055 1.596 1.00 . A A . 20 ASN OXT 1 1 9 2736 1 1 20 ASN OD1 O -8.601 3.135 4.397 1.00 . A A . 20 ASN OD1 1 1 10 2737 1 1 1 SER C C 2.995 -3.348 -7.400 1.00 . A A . 1 SER C 1 1 10 2738 1 1 1 SER CA C 3.753 -2.665 -8.532 1.00 . A A . 1 SER CA 1 1 10 2739 1 1 1 SER CB C 4.063 -1.219 -8.134 1.00 . A A . 1 SER CB 1 1 10 2740 1 1 1 SER H1 H 2.672 -3.629 -9.981 1.00 . A A . 1 SER H1 1 1 10 2741 1 1 1 SER H2 H 3.460 -2.200 -10.482 1.00 . A A . 1 SER H2 1 1 10 2742 1 1 1 SER H3 H 2.072 -2.110 -9.518 1.00 . A A . 1 SER H3 1 1 10 2743 1 1 1 SER HA H 4.677 -3.185 -8.736 1.00 . A A . 1 SER HA 1 1 10 2744 1 1 1 SER HB2 H 3.147 -0.732 -7.834 1.00 . A A . 1 SER HB2 1 1 10 2745 1 1 1 SER HB3 H 4.753 -1.216 -7.302 1.00 . A A . 1 SER HB3 1 1 10 2746 1 1 1 SER HG H 5.154 0.224 -8.813 1.00 . A A . 1 SER HG 1 1 10 2747 1 1 1 SER N N 2.932 -2.659 -9.715 1.00 . A A . 1 SER N 1 1 10 2748 1 1 1 SER O O 1.781 -3.170 -7.273 1.00 . A A . 1 SER O 1 1 10 2749 1 1 1 SER OG O 4.635 -0.485 -9.215 1.00 . A A . 1 SER OG 1 1 10 2750 1 1 2 PRO C C 3.106 -3.762 -4.265 1.00 . A A . 2 PRO C 1 1 10 2751 1 1 2 PRO CA C 3.064 -4.770 -5.425 1.00 . A A . 2 PRO CA 1 1 10 2752 1 1 2 PRO CB C 3.957 -5.982 -5.134 1.00 . A A . 2 PRO CB 1 1 10 2753 1 1 2 PRO CD C 5.079 -4.594 -6.769 1.00 . A A . 2 PRO CD 1 1 10 2754 1 1 2 PRO CG C 5.296 -5.632 -5.694 1.00 . A A . 2 PRO CG 1 1 10 2755 1 1 2 PRO HA H 2.048 -5.078 -5.623 1.00 . A A . 2 PRO HA 1 1 10 2756 1 1 2 PRO HB2 H 4.007 -6.144 -4.068 1.00 . A A . 2 PRO HB2 1 1 10 2757 1 1 2 PRO HB3 H 3.548 -6.858 -5.617 1.00 . A A . 2 PRO HB3 1 1 10 2758 1 1 2 PRO HD2 H 5.746 -3.758 -6.623 1.00 . A A . 2 PRO HD2 1 1 10 2759 1 1 2 PRO HD3 H 5.233 -5.028 -7.745 1.00 . A A . 2 PRO HD3 1 1 10 2760 1 1 2 PRO HG2 H 5.926 -5.234 -4.913 1.00 . A A . 2 PRO HG2 1 1 10 2761 1 1 2 PRO HG3 H 5.744 -6.520 -6.116 1.00 . A A . 2 PRO HG3 1 1 10 2762 1 1 2 PRO N N 3.671 -4.174 -6.596 1.00 . A A . 2 PRO N 1 1 10 2763 1 1 2 PRO O O 4.169 -3.218 -3.970 1.00 . A A . 2 PRO O 1 1 10 2764 1 1 3 PRO C C 2.670 -2.913 -1.292 1.00 . A A . 3 PRO C 1 1 10 2765 1 1 3 PRO CA C 1.899 -2.470 -2.545 1.00 . A A . 3 PRO CA 1 1 10 2766 1 1 3 PRO CB C 0.408 -2.355 -2.217 1.00 . A A . 3 PRO CB 1 1 10 2767 1 1 3 PRO CD C 0.629 -4.008 -3.937 1.00 . A A . 3 PRO CD 1 1 10 2768 1 1 3 PRO CG C -0.304 -2.985 -3.366 1.00 . A A . 3 PRO CG 1 1 10 2769 1 1 3 PRO HA H 2.269 -1.509 -2.872 1.00 . A A . 3 PRO HA 1 1 10 2770 1 1 3 PRO HB2 H 0.225 -2.866 -1.284 1.00 . A A . 3 PRO HB2 1 1 10 2771 1 1 3 PRO HB3 H 0.146 -1.313 -2.108 1.00 . A A . 3 PRO HB3 1 1 10 2772 1 1 3 PRO HD2 H 0.482 -4.966 -3.462 1.00 . A A . 3 PRO HD2 1 1 10 2773 1 1 3 PRO HD3 H 0.470 -4.081 -5.002 1.00 . A A . 3 PRO HD3 1 1 10 2774 1 1 3 PRO HG2 H -1.211 -3.457 -3.020 1.00 . A A . 3 PRO HG2 1 1 10 2775 1 1 3 PRO HG3 H -0.538 -2.234 -4.105 1.00 . A A . 3 PRO HG3 1 1 10 2776 1 1 3 PRO N N 1.956 -3.450 -3.637 1.00 . A A . 3 PRO N 1 1 10 2777 1 1 3 PRO O O 2.324 -3.930 -0.653 1.00 . A A . 3 PRO O 1 1 10 2778 1 1 4 PRO C C 4.077 -1.551 1.385 1.00 . A A . 4 PRO C 1 1 10 2779 1 1 4 PRO CA C 4.510 -2.453 0.237 1.00 . A A . 4 PRO CA 1 1 10 2780 1 1 4 PRO CB C 5.925 -2.115 -0.209 1.00 . A A . 4 PRO CB 1 1 10 2781 1 1 4 PRO CD C 4.323 -1.107 -1.737 1.00 . A A . 4 PRO CD 1 1 10 2782 1 1 4 PRO CG C 5.755 -1.035 -1.243 1.00 . A A . 4 PRO CG 1 1 10 2783 1 1 4 PRO HA H 4.463 -3.471 0.595 1.00 . A A . 4 PRO HA 1 1 10 2784 1 1 4 PRO HB2 H 6.484 -1.763 0.645 1.00 . A A . 4 PRO HB2 1 1 10 2785 1 1 4 PRO HB3 H 6.398 -2.990 -0.628 1.00 . A A . 4 PRO HB3 1 1 10 2786 1 1 4 PRO HD2 H 3.780 -0.194 -1.544 1.00 . A A . 4 PRO HD2 1 1 10 2787 1 1 4 PRO HD3 H 4.307 -1.348 -2.791 1.00 . A A . 4 PRO HD3 1 1 10 2788 1 1 4 PRO HG2 H 5.941 -0.072 -0.793 1.00 . A A . 4 PRO HG2 1 1 10 2789 1 1 4 PRO HG3 H 6.443 -1.200 -2.059 1.00 . A A . 4 PRO HG3 1 1 10 2790 1 1 4 PRO N N 3.741 -2.204 -0.954 1.00 . A A . 4 PRO N 1 1 10 2791 1 1 4 PRO O O 3.383 -0.543 1.194 1.00 . A A . 4 PRO O 1 1 10 2792 1 1 5 ARG C C 5.299 -0.403 4.254 1.00 . A A . 5 ARG C 1 1 10 2793 1 1 5 ARG CA C 4.114 -1.186 3.724 1.00 . A A . 5 ARG CA 1 1 10 2794 1 1 5 ARG CB C 3.585 -2.137 4.784 1.00 . A A . 5 ARG CB 1 1 10 2795 1 1 5 ARG CD C 2.028 -0.474 5.790 1.00 . A A . 5 ARG CD 1 1 10 2796 1 1 5 ARG CG C 3.145 -1.461 6.056 1.00 . A A . 5 ARG CG 1 1 10 2797 1 1 5 ARG CZ C 0.583 1.065 7.053 1.00 . A A . 5 ARG CZ 1 1 10 2798 1 1 5 ARG H H 5.014 -2.728 2.642 1.00 . A A . 5 ARG H 1 1 10 2799 1 1 5 ARG HA H 3.323 -0.502 3.454 1.00 . A A . 5 ARG HA 1 1 10 2800 1 1 5 ARG HB2 H 2.740 -2.671 4.378 1.00 . A A . 5 ARG HB2 1 1 10 2801 1 1 5 ARG HB3 H 4.362 -2.846 5.028 1.00 . A A . 5 ARG HB3 1 1 10 2802 1 1 5 ARG HD2 H 2.371 0.259 5.074 1.00 . A A . 5 ARG HD2 1 1 10 2803 1 1 5 ARG HD3 H 1.180 -1.003 5.383 1.00 . A A . 5 ARG HD3 1 1 10 2804 1 1 5 ARG HE H 2.171 0.078 7.786 1.00 . A A . 5 ARG HE 1 1 10 2805 1 1 5 ARG HG2 H 2.782 -2.245 6.700 1.00 . A A . 5 ARG HG2 1 1 10 2806 1 1 5 ARG HG3 H 3.984 -0.957 6.512 1.00 . A A . 5 ARG HG3 1 1 10 2807 1 1 5 ARG HH11 H 0.002 0.823 5.103 1.00 . A A . 5 ARG HH11 1 1 10 2808 1 1 5 ARG HH12 H -0.955 1.901 6.002 1.00 . A A . 5 ARG HH12 1 1 10 2809 1 1 5 ARG HH21 H 0.876 1.573 9.009 1.00 . A A . 5 ARG HH21 1 1 10 2810 1 1 5 ARG HH22 H -0.465 2.323 8.282 1.00 . A A . 5 ARG HH22 1 1 10 2811 1 1 5 ARG N N 4.469 -1.916 2.557 1.00 . A A . 5 ARG N 1 1 10 2812 1 1 5 ARG NE N 1.612 0.233 6.989 1.00 . A A . 5 ARG NE 1 1 10 2813 1 1 5 ARG NH1 N -0.171 1.274 5.981 1.00 . A A . 5 ARG NH1 1 1 10 2814 1 1 5 ARG NH2 N 0.314 1.698 8.188 1.00 . A A . 5 ARG NH2 1 1 10 2815 1 1 5 ARG O O 5.249 0.816 4.346 1.00 . A A . 5 ARG O 1 1 10 2816 1 1 6 GLY C C 8.589 -0.236 4.097 1.00 . A A . 6 GLY C 1 1 10 2817 1 1 6 GLY CA C 7.526 -0.453 5.131 1.00 . A A . 6 GLY CA 1 1 10 2818 1 1 6 GLY H H 6.387 -2.067 4.404 1.00 . A A . 6 GLY H 1 1 10 2819 1 1 6 GLY HA2 H 7.233 0.501 5.544 1.00 . A A . 6 GLY HA2 1 1 10 2820 1 1 6 GLY HA3 H 7.927 -1.069 5.922 1.00 . A A . 6 GLY HA3 1 1 10 2821 1 1 6 GLY N N 6.367 -1.098 4.568 1.00 . A A . 6 GLY N 1 1 10 2822 1 1 6 GLY O O 9.781 -0.360 4.373 1.00 . A A . 6 GLY O 1 1 10 2823 1 1 7 SER C C 8.354 1.195 0.803 1.00 . A A . 7 SER C 1 1 10 2824 1 1 7 SER CA C 9.052 0.272 1.787 1.00 . A A . 7 SER CA 1 1 10 2825 1 1 7 SER CB C 9.416 -1.062 1.114 1.00 . A A . 7 SER CB 1 1 10 2826 1 1 7 SER H H 7.204 0.122 2.724 1.00 . A A . 7 SER H 1 1 10 2827 1 1 7 SER HA H 9.947 0.745 2.159 1.00 . A A . 7 SER HA 1 1 10 2828 1 1 7 SER HB2 H 8.525 -1.518 0.709 1.00 . A A . 7 SER HB2 1 1 10 2829 1 1 7 SER HB3 H 10.122 -0.879 0.319 1.00 . A A . 7 SER HB3 1 1 10 2830 1 1 7 SER HG H 10.020 -1.466 2.890 1.00 . A A . 7 SER HG 1 1 10 2831 1 1 7 SER N N 8.167 0.039 2.894 1.00 . A A . 7 SER N 1 1 10 2832 1 1 7 SER O O 7.112 1.267 0.818 1.00 . A A . 7 SER O 1 1 10 2833 1 1 7 SER OG O 10.002 -1.955 2.056 1.00 . A A . 7 SER OG 1 1 10 2834 1 1 8 SER C C 7.999 4.111 -0.431 1.00 . A A . 8 SER C 1 1 10 2835 1 1 8 SER CA C 8.672 2.844 -1.032 1.00 . A A . 8 SER CA 1 1 10 2836 1 1 8 SER CB C 7.735 2.112 -2.010 1.00 . A A . 8 SER CB 1 1 10 2837 1 1 8 SER H H 10.122 1.839 0.117 1.00 . A A . 8 SER H 1 1 10 2838 1 1 8 SER HA H 9.552 3.159 -1.573 1.00 . A A . 8 SER HA 1 1 10 2839 1 1 8 SER HB2 H 6.849 1.800 -1.479 1.00 . A A . 8 SER HB2 1 1 10 2840 1 1 8 SER HB3 H 7.457 2.781 -2.810 1.00 . A A . 8 SER HB3 1 1 10 2841 1 1 8 SER HG H 9.332 1.120 -2.507 1.00 . A A . 8 SER HG 1 1 10 2842 1 1 8 SER N N 9.150 1.923 0.003 1.00 . A A . 8 SER N 1 1 10 2843 1 1 8 SER O O 7.151 4.014 0.465 1.00 . A A . 8 SER O 1 1 10 2844 1 1 8 SER OG O 8.382 0.963 -2.561 1.00 . A A . 8 SER OG 1 1 10 2845 1 1 9 PRO C C 6.281 6.621 -0.543 1.00 . A A . 9 PRO C 1 1 10 2846 1 1 9 PRO CA C 7.803 6.594 -0.414 1.00 . A A . 9 PRO CA 1 1 10 2847 1 1 9 PRO CB C 8.424 7.657 -1.329 1.00 . A A . 9 PRO CB 1 1 10 2848 1 1 9 PRO CD C 9.372 5.559 -1.983 1.00 . A A . 9 PRO CD 1 1 10 2849 1 1 9 PRO CG C 9.659 7.028 -1.869 1.00 . A A . 9 PRO CG 1 1 10 2850 1 1 9 PRO HA H 8.085 6.775 0.613 1.00 . A A . 9 PRO HA 1 1 10 2851 1 1 9 PRO HB2 H 7.727 7.906 -2.117 1.00 . A A . 9 PRO HB2 1 1 10 2852 1 1 9 PRO HB3 H 8.650 8.544 -0.756 1.00 . A A . 9 PRO HB3 1 1 10 2853 1 1 9 PRO HD2 H 8.972 5.324 -2.958 1.00 . A A . 9 PRO HD2 1 1 10 2854 1 1 9 PRO HD3 H 10.275 4.998 -1.800 1.00 . A A . 9 PRO HD3 1 1 10 2855 1 1 9 PRO HG2 H 9.886 7.442 -2.841 1.00 . A A . 9 PRO HG2 1 1 10 2856 1 1 9 PRO HG3 H 10.483 7.193 -1.191 1.00 . A A . 9 PRO HG3 1 1 10 2857 1 1 9 PRO N N 8.371 5.324 -0.917 1.00 . A A . 9 PRO N 1 1 10 2858 1 1 9 PRO O O 5.565 7.057 0.367 1.00 . A A . 9 PRO O 1 1 10 2859 1 1 10 GLY C C 3.883 4.665 -1.832 1.00 . A A . 10 GLY C 1 1 10 2860 1 1 10 GLY CA C 4.391 6.080 -1.903 1.00 . A A . 10 GLY CA 1 1 10 2861 1 1 10 GLY H H 6.421 5.837 -2.359 1.00 . A A . 10 GLY H 1 1 10 2862 1 1 10 GLY HA2 H 3.878 6.682 -1.168 1.00 . A A . 10 GLY HA2 1 1 10 2863 1 1 10 GLY HA3 H 4.191 6.469 -2.890 1.00 . A A . 10 GLY HA3 1 1 10 2864 1 1 10 GLY N N 5.799 6.143 -1.662 1.00 . A A . 10 GLY N 1 1 10 2865 1 1 10 GLY O O 2.923 4.312 -2.507 1.00 . A A . 10 GLY O 1 1 10 2866 1 1 11 GLY C C 2.737 2.386 -0.252 1.00 . A A . 11 GLY C 1 1 10 2867 1 1 11 GLY CA C 4.116 2.461 -0.848 1.00 . A A . 11 GLY CA 1 1 10 2868 1 1 11 GLY H H 5.300 4.182 -0.496 1.00 . A A . 11 GLY H 1 1 10 2869 1 1 11 GLY HA2 H 4.117 1.979 -1.816 1.00 . A A . 11 GLY HA2 1 1 10 2870 1 1 11 GLY HA3 H 4.810 1.952 -0.196 1.00 . A A . 11 GLY HA3 1 1 10 2871 1 1 11 GLY N N 4.532 3.845 -1.008 1.00 . A A . 11 GLY N 1 1 10 2872 1 1 11 GLY O O 1.854 1.673 -0.755 1.00 . A A . 11 GLY O 1 1 10 2873 1 1 12 ASP C C 0.154 3.778 0.533 1.00 . A A . 12 ASP C 1 1 10 2874 1 1 12 ASP CA C 1.259 3.287 1.463 1.00 . A A . 12 ASP CA 1 1 10 2875 1 1 12 ASP CB C 1.372 4.173 2.700 1.00 . A A . 12 ASP CB 1 1 10 2876 1 1 12 ASP CG C 0.029 4.560 3.293 1.00 . A A . 12 ASP CG 1 1 10 2877 1 1 12 ASP H H 3.293 3.708 1.121 1.00 . A A . 12 ASP H 1 1 10 2878 1 1 12 ASP HA H 1.000 2.289 1.782 1.00 . A A . 12 ASP HA 1 1 10 2879 1 1 12 ASP HB2 H 1.912 3.613 3.450 1.00 . A A . 12 ASP HB2 1 1 10 2880 1 1 12 ASP HB3 H 1.924 5.067 2.452 1.00 . A A . 12 ASP HB3 1 1 10 2881 1 1 12 ASP N N 2.538 3.183 0.784 1.00 . A A . 12 ASP N 1 1 10 2882 1 1 12 ASP O O -0.987 3.408 0.695 1.00 . A A . 12 ASP O 1 1 10 2883 1 1 12 ASP OD1 O -0.567 3.751 4.041 1.00 . A A . 12 ASP OD1 1 1 10 2884 1 1 12 ASP OD2 O -0.441 5.702 3.034 1.00 . A A . 12 ASP OD2 1 1 10 2885 1 1 13 LYS C C -1.149 3.878 -2.154 1.00 . A A . 13 LYS C 1 1 10 2886 1 1 13 LYS CA C -0.495 5.049 -1.421 1.00 . A A . 13 LYS CA 1 1 10 2887 1 1 13 LYS CB C 0.108 6.019 -2.437 1.00 . A A . 13 LYS CB 1 1 10 2888 1 1 13 LYS CD C -1.900 7.505 -2.713 1.00 . A A . 13 LYS CD 1 1 10 2889 1 1 13 LYS CE C -3.020 7.932 -3.638 1.00 . A A . 13 LYS CE 1 1 10 2890 1 1 13 LYS CG C -0.921 6.579 -3.410 1.00 . A A . 13 LYS CG 1 1 10 2891 1 1 13 LYS H H 1.450 4.781 -0.601 1.00 . A A . 13 LYS H 1 1 10 2892 1 1 13 LYS HA H -1.252 5.557 -0.844 1.00 . A A . 13 LYS HA 1 1 10 2893 1 1 13 LYS HB2 H 0.567 6.842 -1.908 1.00 . A A . 13 LYS HB2 1 1 10 2894 1 1 13 LYS HB3 H 0.868 5.499 -3.002 1.00 . A A . 13 LYS HB3 1 1 10 2895 1 1 13 LYS HD2 H -2.333 6.991 -1.867 1.00 . A A . 13 LYS HD2 1 1 10 2896 1 1 13 LYS HD3 H -1.376 8.383 -2.367 1.00 . A A . 13 LYS HD3 1 1 10 2897 1 1 13 LYS HE2 H -3.562 7.051 -3.948 1.00 . A A . 13 LYS HE2 1 1 10 2898 1 1 13 LYS HE3 H -3.684 8.581 -3.088 1.00 . A A . 13 LYS HE3 1 1 10 2899 1 1 13 LYS HG2 H -0.435 7.106 -4.213 1.00 . A A . 13 LYS HG2 1 1 10 2900 1 1 13 LYS HG3 H -1.476 5.748 -3.823 1.00 . A A . 13 LYS HG3 1 1 10 2901 1 1 13 LYS HZ1 H -3.356 8.897 -5.436 1.00 . A A . 13 LYS HZ1 1 1 10 2902 1 1 13 LYS HZ2 H -1.917 8.041 -5.432 1.00 . A A . 13 LYS HZ2 1 1 10 2903 1 1 13 LYS HZ3 H -2.037 9.515 -4.609 1.00 . A A . 13 LYS HZ3 1 1 10 2904 1 1 13 LYS N N 0.506 4.554 -0.483 1.00 . A A . 13 LYS N 1 1 10 2905 1 1 13 LYS NZ N -2.537 8.637 -4.849 1.00 . A A . 13 LYS NZ 1 1 10 2906 1 1 13 LYS O O -2.361 3.829 -2.325 1.00 . A A . 13 LYS O 1 1 10 2907 1 1 14 LEU C C -1.530 0.830 -2.229 1.00 . A A . 14 LEU C 1 1 10 2908 1 1 14 LEU CA C -0.837 1.744 -3.223 1.00 . A A . 14 LEU CA 1 1 10 2909 1 1 14 LEU CB C 0.285 0.993 -3.972 1.00 . A A . 14 LEU CB 1 1 10 2910 1 1 14 LEU CD1 C 1.403 2.981 -5.121 1.00 . A A . 14 LEU CD1 1 1 10 2911 1 1 14 LEU CD2 C 1.786 0.666 -5.955 1.00 . A A . 14 LEU CD2 1 1 10 2912 1 1 14 LEU CG C 0.791 1.601 -5.302 1.00 . A A . 14 LEU CG 1 1 10 2913 1 1 14 LEU H H 0.621 3.011 -2.366 1.00 . A A . 14 LEU H 1 1 10 2914 1 1 14 LEU HA H -1.574 2.079 -3.939 1.00 . A A . 14 LEU HA 1 1 10 2915 1 1 14 LEU HB2 H 1.133 0.921 -3.307 1.00 . A A . 14 LEU HB2 1 1 10 2916 1 1 14 LEU HB3 H -0.061 -0.010 -4.175 1.00 . A A . 14 LEU HB3 1 1 10 2917 1 1 14 LEU HD11 H 0.654 3.659 -4.737 1.00 . A A . 14 LEU HD11 1 1 10 2918 1 1 14 LEU HD12 H 1.768 3.347 -6.070 1.00 . A A . 14 LEU HD12 1 1 10 2919 1 1 14 LEU HD13 H 2.219 2.922 -4.417 1.00 . A A . 14 LEU HD13 1 1 10 2920 1 1 14 LEU HD21 H 2.130 1.102 -6.881 1.00 . A A . 14 LEU HD21 1 1 10 2921 1 1 14 LEU HD22 H 1.303 -0.278 -6.162 1.00 . A A . 14 LEU HD22 1 1 10 2922 1 1 14 LEU HD23 H 2.626 0.515 -5.292 1.00 . A A . 14 LEU HD23 1 1 10 2923 1 1 14 LEU HG H -0.047 1.707 -5.974 1.00 . A A . 14 LEU HG 1 1 10 2924 1 1 14 LEU N N -0.339 2.922 -2.547 1.00 . A A . 14 LEU N 1 1 10 2925 1 1 14 LEU O O -2.497 0.150 -2.568 1.00 . A A . 14 LEU O 1 1 10 2926 1 1 15 TRP C C -3.039 0.505 0.364 1.00 . A A . 15 TRP C 1 1 10 2927 1 1 15 TRP CA C -1.588 0.071 0.108 1.00 . A A . 15 TRP CA 1 1 10 2928 1 1 15 TRP CB C -0.742 0.363 1.362 1.00 . A A . 15 TRP CB 1 1 10 2929 1 1 15 TRP CD1 C -0.005 -1.419 2.990 1.00 . A A . 15 TRP CD1 1 1 10 2930 1 1 15 TRP CD2 C -2.010 -0.593 3.457 1.00 . A A . 15 TRP CD2 1 1 10 2931 1 1 15 TRP CE2 C -1.696 -1.555 4.421 1.00 . A A . 15 TRP CE2 1 1 10 2932 1 1 15 TRP CE3 C -3.219 0.060 3.540 1.00 . A A . 15 TRP CE3 1 1 10 2933 1 1 15 TRP CG C -0.911 -0.526 2.549 1.00 . A A . 15 TRP CG 1 1 10 2934 1 1 15 TRP CH2 C -3.745 -1.198 5.504 1.00 . A A . 15 TRP CH2 1 1 10 2935 1 1 15 TRP CZ2 C -2.559 -1.867 5.460 1.00 . A A . 15 TRP CZ2 1 1 10 2936 1 1 15 TRP CZ3 C -4.069 -0.245 4.549 1.00 . A A . 15 TRP CZ3 1 1 10 2937 1 1 15 TRP H H -0.271 1.435 -0.823 1.00 . A A . 15 TRP H 1 1 10 2938 1 1 15 TRP HA H -1.512 -0.974 -0.144 1.00 . A A . 15 TRP HA 1 1 10 2939 1 1 15 TRP HB2 H 0.297 0.260 1.105 1.00 . A A . 15 TRP HB2 1 1 10 2940 1 1 15 TRP HB3 H -0.931 1.379 1.675 1.00 . A A . 15 TRP HB3 1 1 10 2941 1 1 15 TRP HD1 H 0.940 -1.568 2.491 1.00 . A A . 15 TRP HD1 1 1 10 2942 1 1 15 TRP HE1 H 0.017 -2.738 4.627 1.00 . A A . 15 TRP HE1 1 1 10 2943 1 1 15 TRP HE3 H -3.493 0.799 2.807 1.00 . A A . 15 TRP HE3 1 1 10 2944 1 1 15 TRP HH2 H -4.465 -1.401 6.279 1.00 . A A . 15 TRP HH2 1 1 10 2945 1 1 15 TRP HZ2 H -2.314 -2.608 6.206 1.00 . A A . 15 TRP HZ2 1 1 10 2946 1 1 15 TRP HZ3 H -5.010 0.277 4.595 1.00 . A A . 15 TRP HZ3 1 1 10 2947 1 1 15 TRP N N -1.046 0.857 -0.998 1.00 . A A . 15 TRP N 1 1 10 2948 1 1 15 TRP NE1 N -0.461 -2.044 4.118 1.00 . A A . 15 TRP NE1 1 1 10 2949 1 1 15 TRP O O -3.966 -0.324 0.458 1.00 . A A . 15 TRP O 1 1 10 2950 1 1 16 GLN C C -5.510 2.282 -0.410 1.00 . A A . 16 GLN C 1 1 10 2951 1 1 16 GLN CA C -4.512 2.426 0.741 1.00 . A A . 16 GLN CA 1 1 10 2952 1 1 16 GLN CB C -4.327 3.898 1.088 1.00 . A A . 16 GLN CB 1 1 10 2953 1 1 16 GLN CD C -4.037 3.659 3.601 1.00 . A A . 16 GLN CD 1 1 10 2954 1 1 16 GLN CG C -3.446 4.149 2.301 1.00 . A A . 16 GLN CG 1 1 10 2955 1 1 16 GLN H H -2.447 2.400 0.303 1.00 . A A . 16 GLN H 1 1 10 2956 1 1 16 GLN HA H -4.885 1.919 1.616 1.00 . A A . 16 GLN HA 1 1 10 2957 1 1 16 GLN HB2 H -3.892 4.405 0.239 1.00 . A A . 16 GLN HB2 1 1 10 2958 1 1 16 GLN HB3 H -5.301 4.317 1.292 1.00 . A A . 16 GLN HB3 1 1 10 2959 1 1 16 GLN HE21 H -2.227 3.398 4.281 1.00 . A A . 16 GLN HE21 1 1 10 2960 1 1 16 GLN HE22 H -3.483 2.967 5.389 1.00 . A A . 16 GLN HE22 1 1 10 2961 1 1 16 GLN HG2 H -2.529 3.595 2.153 1.00 . A A . 16 GLN HG2 1 1 10 2962 1 1 16 GLN HG3 H -3.237 5.205 2.380 1.00 . A A . 16 GLN HG3 1 1 10 2963 1 1 16 GLN N N -3.226 1.812 0.437 1.00 . A A . 16 GLN N 1 1 10 2964 1 1 16 GLN NE2 N -3.186 3.306 4.518 1.00 . A A . 16 GLN NE2 1 1 10 2965 1 1 16 GLN O O -6.685 2.618 -0.272 1.00 . A A . 16 GLN O 1 1 10 2966 1 1 16 GLN OE1 O -5.258 3.624 3.780 1.00 . A A . 16 GLN OE1 1 1 10 2967 1 1 17 ILE C C -5.843 0.033 -2.990 1.00 . A A . 17 ILE C 1 1 10 2968 1 1 17 ILE CA C -5.847 1.561 -2.700 1.00 . A A . 17 ILE CA 1 1 10 2969 1 1 17 ILE CB C -5.341 2.439 -3.912 1.00 . A A . 17 ILE CB 1 1 10 2970 1 1 17 ILE CD1 C -5.026 4.880 -4.591 1.00 . A A . 17 ILE CD1 1 1 10 2971 1 1 17 ILE CG1 C -5.427 3.920 -3.507 1.00 . A A . 17 ILE CG1 1 1 10 2972 1 1 17 ILE CG2 C -6.179 2.220 -5.183 1.00 . A A . 17 ILE CG2 1 1 10 2973 1 1 17 ILE H H -4.066 1.620 -1.584 1.00 . A A . 17 ILE H 1 1 10 2974 1 1 17 ILE HA H -6.845 1.863 -2.429 1.00 . A A . 17 ILE HA 1 1 10 2975 1 1 17 ILE HB H -4.302 2.210 -4.113 1.00 . A A . 17 ILE HB 1 1 10 2976 1 1 17 ILE HD11 H -5.651 4.683 -5.449 1.00 . A A . 17 ILE HD11 1 1 10 2977 1 1 17 ILE HD12 H -3.985 4.737 -4.839 1.00 . A A . 17 ILE HD12 1 1 10 2978 1 1 17 ILE HD13 H -5.200 5.886 -4.243 1.00 . A A . 17 ILE HD13 1 1 10 2979 1 1 17 ILE HG12 H -6.444 4.151 -3.227 1.00 . A A . 17 ILE HG12 1 1 10 2980 1 1 17 ILE HG13 H -4.782 4.087 -2.657 1.00 . A A . 17 ILE HG13 1 1 10 2981 1 1 17 ILE HG21 H -6.112 1.184 -5.483 1.00 . A A . 17 ILE HG21 1 1 10 2982 1 1 17 ILE HG22 H -5.806 2.850 -5.977 1.00 . A A . 17 ILE HG22 1 1 10 2983 1 1 17 ILE HG23 H -7.209 2.469 -4.979 1.00 . A A . 17 ILE HG23 1 1 10 2984 1 1 17 ILE N N -5.027 1.806 -1.533 1.00 . A A . 17 ILE N 1 1 10 2985 1 1 17 ILE O O -6.033 -0.448 -4.118 1.00 . A A . 17 ILE O 1 1 10 2986 1 1 18 TYR C C -6.171 -2.883 -0.791 1.00 . A A . 18 TYR C 1 1 10 2987 1 1 18 TYR CA C -5.613 -2.171 -2.043 1.00 . A A . 18 TYR CA 1 1 10 2988 1 1 18 TYR CB C -4.148 -2.587 -2.394 1.00 . A A . 18 TYR CB 1 1 10 2989 1 1 18 TYR CD1 C -2.852 -3.331 -0.393 1.00 . A A . 18 TYR CD1 1 1 10 2990 1 1 18 TYR CD2 C -3.575 -4.997 -1.910 1.00 . A A . 18 TYR CD2 1 1 10 2991 1 1 18 TYR CE1 C -2.255 -4.285 0.400 1.00 . A A . 18 TYR CE1 1 1 10 2992 1 1 18 TYR CE2 C -2.988 -5.967 -1.129 1.00 . A A . 18 TYR CE2 1 1 10 2993 1 1 18 TYR CG C -3.518 -3.668 -1.548 1.00 . A A . 18 TYR CG 1 1 10 2994 1 1 18 TYR CZ C -2.328 -5.607 0.028 1.00 . A A . 18 TYR CZ 1 1 10 2995 1 1 18 TYR H H -5.611 -0.297 -1.056 1.00 . A A . 18 TYR H 1 1 10 2996 1 1 18 TYR HA H -6.245 -2.443 -2.876 1.00 . A A . 18 TYR HA 1 1 10 2997 1 1 18 TYR HB2 H -4.105 -2.930 -3.416 1.00 . A A . 18 TYR HB2 1 1 10 2998 1 1 18 TYR HB3 H -3.529 -1.706 -2.314 1.00 . A A . 18 TYR HB3 1 1 10 2999 1 1 18 TYR HD1 H -2.842 -2.282 -0.136 1.00 . A A . 18 TYR HD1 1 1 10 3000 1 1 18 TYR HD2 H -4.091 -5.270 -2.818 1.00 . A A . 18 TYR HD2 1 1 10 3001 1 1 18 TYR HE1 H -1.746 -3.990 1.304 1.00 . A A . 18 TYR HE1 1 1 10 3002 1 1 18 TYR HE2 H -3.049 -7.002 -1.423 1.00 . A A . 18 TYR HE2 1 1 10 3003 1 1 18 TYR HH H -1.284 -7.190 0.215 1.00 . A A . 18 TYR HH 1 1 10 3004 1 1 18 TYR N N -5.682 -0.728 -1.933 1.00 . A A . 18 TYR N 1 1 10 3005 1 1 18 TYR O O -6.983 -3.790 -0.903 1.00 . A A . 18 TYR O 1 1 10 3006 1 1 18 TYR OH O -1.740 -6.581 0.814 1.00 . A A . 18 TYR OH 1 1 10 3007 1 1 19 LEU C C -7.173 -2.259 2.320 1.00 . A A . 19 LEU C 1 1 10 3008 1 1 19 LEU CA C -6.140 -3.133 1.616 1.00 . A A . 19 LEU CA 1 1 10 3009 1 1 19 LEU CB C -4.877 -3.344 2.465 1.00 . A A . 19 LEU CB 1 1 10 3010 1 1 19 LEU CD1 C -3.405 -4.727 3.895 1.00 . A A . 19 LEU CD1 1 1 10 3011 1 1 19 LEU CD2 C -5.727 -4.311 4.641 1.00 . A A . 19 LEU CD2 1 1 10 3012 1 1 19 LEU CG C -4.832 -4.531 3.436 1.00 . A A . 19 LEU CG 1 1 10 3013 1 1 19 LEU H H -5.112 -1.709 0.420 1.00 . A A . 19 LEU H 1 1 10 3014 1 1 19 LEU HA H -6.579 -4.088 1.367 1.00 . A A . 19 LEU HA 1 1 10 3015 1 1 19 LEU HB2 H -4.046 -3.452 1.784 1.00 . A A . 19 LEU HB2 1 1 10 3016 1 1 19 LEU HB3 H -4.716 -2.439 3.033 1.00 . A A . 19 LEU HB3 1 1 10 3017 1 1 19 LEU HD11 H -3.349 -5.511 4.634 1.00 . A A . 19 LEU HD11 1 1 10 3018 1 1 19 LEU HD12 H -3.043 -3.790 4.298 1.00 . A A . 19 LEU HD12 1 1 10 3019 1 1 19 LEU HD13 H -2.792 -4.981 3.042 1.00 . A A . 19 LEU HD13 1 1 10 3020 1 1 19 LEU HD21 H -6.745 -4.177 4.308 1.00 . A A . 19 LEU HD21 1 1 10 3021 1 1 19 LEU HD22 H -5.397 -3.429 5.170 1.00 . A A . 19 LEU HD22 1 1 10 3022 1 1 19 LEU HD23 H -5.667 -5.170 5.293 1.00 . A A . 19 LEU HD23 1 1 10 3023 1 1 19 LEU HG H -5.145 -5.426 2.919 1.00 . A A . 19 LEU HG 1 1 10 3024 1 1 19 LEU N N -5.739 -2.467 0.380 1.00 . A A . 19 LEU N 1 1 10 3025 1 1 19 LEU O O -8.042 -2.734 3.054 1.00 . A A . 19 LEU O 1 1 10 3026 1 1 20 ASN C C -9.048 0.144 1.476 1.00 . A A . 20 ASN C 1 1 10 3027 1 1 20 ASN CA C -8.010 -0.013 2.535 1.00 . A A . 20 ASN CA 1 1 10 3028 1 1 20 ASN CB C -7.316 1.318 2.803 1.00 . A A . 20 ASN CB 1 1 10 3029 1 1 20 ASN CG C -8.275 2.496 2.989 1.00 . A A . 20 ASN CG 1 1 10 3030 1 1 20 ASN H H -6.335 -0.676 1.502 1.00 . A A . 20 ASN H 1 1 10 3031 1 1 20 ASN HA H -8.469 -0.378 3.442 1.00 . A A . 20 ASN HA 1 1 10 3032 1 1 20 ASN HB2 H -6.713 1.232 3.695 1.00 . A A . 20 ASN HB2 1 1 10 3033 1 1 20 ASN HB3 H -6.675 1.526 1.965 1.00 . A A . 20 ASN HB3 1 1 10 3034 1 1 20 ASN HD21 H -8.107 2.941 1.082 1.00 . A A . 20 ASN HD21 1 1 10 3035 1 1 20 ASN HD22 H -9.150 3.972 1.984 1.00 . A A . 20 ASN HD22 1 1 10 3036 1 1 20 ASN N N -7.068 -0.991 2.066 1.00 . A A . 20 ASN N 1 1 10 3037 1 1 20 ASN ND2 N -8.538 3.206 1.927 1.00 . A A . 20 ASN ND2 1 1 10 3038 1 1 20 ASN O O -10.215 -0.118 1.735 1.00 . A A . 20 ASN O 1 1 10 3039 1 1 20 ASN OXT O -8.674 0.418 0.322 1.00 . A A . 20 ASN OXT 1 1 10 3040 1 1 20 ASN OD1 O -8.727 2.786 4.098 1.00 . A A . 20 ASN OD1 1 1 stop_ save_
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