NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
409427 | 1zjq | 6654 | cing | 4-filtered-FRED | STAR | entry | full | 322 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1zjq # This FRED archive file contains, for PDB entry <1zjq>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, W Vranken, C Penkett, J Lin, CF Schulte, G Vuister, G Vriend, # JL Markley, EL Ulrich. BioMagResBank database `NMR Restraints Grid` with # curated sets of experimental NMR restraints for over 4,000 protein and nucleic # acid PDB entries. (in preparation) save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_1zjq _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1zjq _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3606.12 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 $Jingzhaotoxin_VII A . 1 1 stop_ save_ save_Jingzhaotoxin_VII _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Jingzhaotoxin VII" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GCGGLMAGCDGKSTFCCSGYNCSPTWKWCVYARP _Entity.Number_of_monomers 34 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 CYS . 1 1 3 GLY . 1 1 4 GLY . 1 1 5 LEU . 1 1 6 MET . 1 1 7 ALA . 1 1 8 GLY . 1 1 9 CYS . 1 1 10 ASP . 1 1 11 GLY . 1 1 12 LYS . 1 1 13 SER . 1 1 14 THR . 1 1 15 PHE . 1 1 16 CYS . 1 1 17 CYS . 1 1 18 SER . 1 1 19 GLY . 1 1 20 TYR . 1 1 21 ASN . 1 1 22 CYS . 1 1 23 SER . 1 1 24 PRO . 1 1 25 THR . 1 1 26 TRP . 1 1 27 LYS . 1 1 28 TRP . 1 1 29 CYS . 1 1 30 VAL . 1 1 31 TYR . 1 1 32 ALA . 1 1 33 ARG . 1 1 34 PRO . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 CYS 2 2 1 1 GLY 3 3 1 1 GLY 4 4 1 1 LEU 5 5 1 1 MET 6 6 1 1 ALA 7 7 1 1 GLY 8 8 1 1 CYS 9 9 1 1 ASP 10 10 1 1 GLY 11 11 1 1 LYS 12 12 1 1 SER 13 13 1 1 THR 14 14 1 1 PHE 15 15 1 1 CYS 16 16 1 1 CYS 17 17 1 1 SER 18 18 1 1 GLY 19 19 1 1 TYR 20 20 1 1 ASN 21 21 1 1 CYS 22 22 1 1 SER 23 23 1 1 PRO 24 24 1 1 THR 25 25 1 1 TRP 26 26 1 1 LYS 27 27 1 1 TRP 28 28 1 1 CYS 29 29 1 1 VAL 30 30 1 1 TYR 31 31 1 1 ALA 32 32 1 1 ARG 33 33 1 1 PRO 34 34 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 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 GLY QA . 1 . HA# 1 1 1 1 2 1 1 2 CYS H . 2 . HN 1 1 2 1 1 1 1 3 GLY H . 3 . HN 1 1 2 1 2 1 1 4 GLY H . 4 . HN 1 1 3 1 1 1 1 3 GLY H . 3 . HN 1 1 3 1 2 1 1 16 CYS HA . 16 . HA 1 1 4 1 1 1 1 2 CYS HA . 2 . HA 1 1 4 1 2 1 1 3 GLY H . 3 . HN 1 1 5 1 1 1 1 2 CYS QB . 2 . HB# 1 1 5 1 2 1 1 3 GLY H . 3 . HN 1 1 6 1 1 1 1 3 GLY H . 3 . HN 1 1 6 1 2 1 1 7 ALA MB . 7 . HB# 1 1 7 1 1 1 1 3 GLY H . 3 . HN 1 1 7 1 2 1 1 17 CYS HA . 17 . HA 1 1 8 1 1 1 1 3 GLY H . 3 . HN 1 1 8 1 2 1 1 15 PHE QD . 15 . HD# 1 1 9 1 1 1 1 3 GLY QA . 3 . HA# 1 1 9 1 2 1 1 7 ALA MB . 7 . HB# 1 1 10 1 1 1 1 3 GLY QA . 3 . HA# 1 1 10 1 2 1 1 4 GLY QA . 4 . HA# 1 1 11 1 1 1 1 4 GLY H . 4 . HN 1 1 11 1 2 1 1 5 LEU H . 5 . HN 1 1 12 1 1 1 1 3 GLY QA . 3 . HA# 1 1 12 1 2 1 1 4 GLY H . 4 . HN 1 1 13 1 1 1 1 4 GLY H . 4 . HN 1 1 13 1 2 1 1 7 ALA MB . 7 . HB# 1 1 14 1 1 1 1 4 GLY H . 4 . HN 1 1 14 1 2 1 1 16 CYS HA . 16 . HA 1 1 15 1 1 1 1 4 GLY QA . 4 . HA# 1 1 15 1 2 1 1 5 LEU QD . 5 . HD# 1 1 16 1 1 1 1 5 LEU H . 5 . HN 1 1 16 1 2 1 1 20 TYR QE . 20 . HE# 1 1 17 1 1 1 1 5 LEU H . 5 . HN 1 1 17 1 2 1 1 29 CYS QB . 29 . HB# 1 1 18 1 1 1 1 4 GLY QA . 4 . HA# 1 1 18 1 2 1 1 5 LEU H . 5 . HN 1 1 19 1 1 1 1 5 LEU H . 5 . HN 1 1 19 1 2 1 1 5 LEU QB . 5 . HB# 1 1 20 1 1 1 1 5 LEU H . 5 . HN 1 1 20 1 2 1 1 5 LEU HG . 5 . HG 1 1 21 1 1 1 1 5 LEU HA . 5 . HA 1 1 21 1 2 1 1 6 MET QB . 6 . HB# 1 1 22 1 1 1 1 6 MET H . 6 . HN 1 1 22 1 2 1 1 29 CYS QB . 29 . HB# 1 1 23 1 1 1 1 6 MET H . 6 . HN 1 1 23 1 2 1 1 29 CYS H . 29 . HN 1 1 24 1 1 1 1 6 MET H . 6 . HN 1 1 24 1 2 1 1 6 MET QB . 6 . HB# 1 1 25 1 1 1 1 5 LEU QB . 5 . HB# 1 1 25 1 2 1 1 6 MET H . 6 . HN 1 1 26 1 1 1 1 5 LEU QD . 5 . HD# 1 1 26 1 2 1 1 6 MET H . 6 . HN 1 1 27 1 1 1 1 5 LEU HA . 5 . HA 1 1 27 1 2 1 1 6 MET H . 6 . HN 1 1 28 1 1 1 1 6 MET H . 6 . HN 1 1 28 1 2 1 1 7 ALA H . 7 . HN 1 1 29 1 1 1 1 5 LEU H . 5 . HN 1 1 29 1 2 1 1 6 MET H . 6 . HN 1 1 30 1 1 1 1 6 MET H . 6 . HN 1 1 30 1 2 1 1 28 TRP HD1 . 28 . HD1 1 1 31 1 1 1 1 6 MET H . 6 . HN 1 1 31 1 2 1 1 20 TYR QE . 20 . HE# 1 1 32 1 1 1 1 6 MET H . 6 . HN 1 1 32 1 2 1 1 20 TYR QD . 20 . HD# 1 1 33 1 1 1 1 6 MET H . 6 . HN 1 1 33 1 2 1 1 7 ALA MB . 7 . HB# 1 1 34 1 1 1 1 6 MET HA . 6 . HA 1 1 34 1 2 1 1 6 MET QG . 6 . HG# 1 1 35 1 1 1 1 5 LEU QD . 5 . HD# 1 1 35 1 2 1 1 6 MET QB . 6 . HB# 1 1 36 1 1 1 1 7 ALA H . 7 . HN 1 1 36 1 2 1 1 28 TRP HA . 28 . HA 1 1 37 1 1 1 1 7 ALA H . 7 . HN 1 1 37 1 2 1 1 29 CYS QB . 29 . HB# 1 1 38 1 1 1 1 6 MET HA . 6 . HA 1 1 38 1 2 1 1 7 ALA H . 7 . HN 1 1 39 1 1 1 1 6 MET QB . 6 . HB# 1 1 39 1 2 1 1 7 ALA H . 7 . HN 1 1 40 1 1 1 1 7 ALA H . 7 . HN 1 1 40 1 2 1 1 7 ALA MB . 7 . HB# 1 1 41 1 1 1 1 5 LEU QD . 5 . HD# 1 1 41 1 2 1 1 7 ALA H . 7 . HN 1 1 42 1 1 1 1 8 GLY H . 8 . HN 1 1 42 1 2 1 1 29 CYS QB . 29 . HB# 1 1 43 1 1 1 1 8 GLY H . 8 . HN 1 1 43 1 2 1 1 28 TRP HA . 28 . HA 1 1 44 1 1 1 1 7 ALA HA . 7 . HA 1 1 44 1 2 1 1 8 GLY H . 8 . HN 1 1 45 1 1 1 1 7 ALA MB . 7 . HB# 1 1 45 1 2 1 1 8 GLY H . 8 . HN 1 1 46 1 1 1 1 8 GLY H . 8 . HN 1 1 46 1 2 1 1 9 CYS H . 9 . HN 1 1 47 1 1 1 1 7 ALA H . 7 . HN 1 1 47 1 2 1 1 8 GLY H . 8 . HN 1 1 48 1 1 1 1 8 GLY QA . 8 . HA# 1 1 48 1 2 1 1 9 CYS H . 9 . HN 1 1 49 1 1 1 1 9 CYS H . 9 . HN 1 1 49 1 2 1 1 9 CYS QB . 9 . HB# 1 1 50 1 1 1 1 9 CYS H . 9 . HN 1 1 50 1 2 1 1 28 TRP HA . 28 . HA 1 1 51 1 1 1 1 9 CYS H . 9 . HN 1 1 51 1 2 1 1 28 TRP QB . 28 . HB# 1 1 52 1 1 1 1 9 CYS H . 9 . HN 1 1 52 1 2 1 1 10 ASP H . 10 . HN 1 1 53 1 1 1 1 9 CYS HA . 9 . HA 1 1 53 1 2 1 1 10 ASP H . 10 . HN 1 1 54 1 1 1 1 9 CYS QB . 9 . HB# 1 1 54 1 2 1 1 10 ASP H . 10 . HN 1 1 55 1 1 1 1 10 ASP H . 10 . HN 1 1 55 1 2 1 1 14 THR HB . 14 . HB 1 1 56 1 1 1 1 10 ASP H . 10 . HN 1 1 56 1 2 1 1 10 ASP QB . 10 . HB# 1 1 57 1 1 1 1 10 ASP H . 10 . HN 1 1 57 1 2 1 1 14 THR MG . 14 . HG2# 1 1 58 1 1 1 1 10 ASP H . 10 . HN 1 1 58 1 2 1 1 27 LYS QB . 27 . HB# 1 1 59 1 1 1 1 10 ASP H . 10 . HN 1 1 59 1 2 1 1 28 TRP HA . 28 . HA 1 1 60 1 1 1 1 10 ASP HA . 10 . HA 1 1 60 1 2 1 1 27 LYS QB . 27 . HB# 1 1 61 1 1 1 1 10 ASP HA . 10 . HA 1 1 61 1 2 1 1 27 LYS QG . 27 . HG# 1 1 62 1 1 1 1 10 ASP HA . 10 . HA 1 1 62 1 2 1 1 27 LYS QD . 27 . HD# 1 1 63 1 1 1 1 10 ASP HA . 10 . HA 1 1 63 1 2 1 1 11 GLY QA . 11 . HA# 1 1 64 1 1 1 1 10 ASP HA . 10 . HA 1 1 64 1 2 1 1 11 GLY H . 11 . HN 1 1 65 1 1 1 1 10 ASP QB . 10 . HB# 1 1 65 1 2 1 1 11 GLY H . 11 . HN 1 1 66 1 1 1 1 11 GLY H . 11 . HN 1 1 66 1 2 1 1 12 LYS QB . 12 . HB# 1 1 67 1 1 1 1 11 GLY H . 11 . HN 1 1 67 1 2 1 1 12 LYS QG . 12 . HG# 1 1 68 1 1 1 1 11 GLY H . 11 . HN 1 1 68 1 2 1 1 13 SER H . 13 . HN 1 1 69 1 1 1 1 11 GLY H . 11 . HN 1 1 69 1 2 1 1 27 LYS QE . 27 . HE# 1 1 70 1 1 1 1 11 GLY QA . 11 . HA# 1 1 70 1 2 1 1 14 THR HA . 14 . HA 1 1 71 1 1 1 1 12 LYS H . 12 . HN 1 1 71 1 2 1 1 13 SER QB . 13 . HB# 1 1 72 1 1 1 1 11 GLY QA . 11 . HA# 1 1 72 1 2 1 1 12 LYS H . 12 . HN 1 1 73 1 1 1 1 12 LYS H . 12 . HN 1 1 73 1 2 1 1 12 LYS QB . 12 . HB# 1 1 74 1 1 1 1 12 LYS H . 12 . HN 1 1 74 1 2 1 1 12 LYS QG . 12 . HG# 1 1 75 1 1 1 1 12 LYS H . 12 . HN 1 1 75 1 2 1 1 14 THR H . 14 . HN 1 1 76 1 1 1 1 11 GLY H . 11 . HN 1 1 76 1 2 1 1 12 LYS H . 12 . HN 1 1 77 1 1 1 1 12 LYS QZ . 12 . HZ# 1 1 77 1 2 1 1 13 SER QB . 13 . HB# 1 1 78 1 1 1 1 12 LYS HA . 12 . HA 1 1 78 1 2 1 1 12 LYS QZ . 12 . HZ# 1 1 79 1 1 1 1 11 GLY QA . 11 . HA# 1 1 79 1 2 1 1 12 LYS QZ . 12 . HZ# 1 1 80 1 1 1 1 12 LYS HA . 12 . HA 1 1 80 1 2 1 1 12 LYS QG . 12 . HG# 1 1 81 1 1 1 1 12 LYS HA . 12 . HA 1 1 81 1 2 1 1 22 CYS QB . 22 . HB# 1 1 82 1 1 1 1 11 GLY QA . 11 . HA# 1 1 82 1 2 1 1 13 SER H . 13 . HN 1 1 83 1 1 1 1 12 LYS H . 12 . HN 1 1 83 1 2 1 1 13 SER H . 13 . HN 1 1 84 1 1 1 1 13 SER H . 13 . HN 1 1 84 1 2 1 1 14 THR H . 14 . HN 1 1 85 1 1 1 1 12 LYS HA . 12 . HA 1 1 85 1 2 1 1 13 SER H . 13 . HN 1 1 86 1 1 1 1 13 SER H . 13 . HN 1 1 86 1 2 1 1 13 SER QB . 13 . HB# 1 1 87 1 1 1 1 12 LYS QB . 12 . HB# 1 1 87 1 2 1 1 13 SER H . 13 . HN 1 1 88 1 1 1 1 12 LYS QG . 12 . HG# 1 1 88 1 2 1 1 13 SER H . 13 . HN 1 1 89 1 1 1 1 13 SER HA . 13 . HA 1 1 89 1 2 1 1 14 THR H . 14 . HN 1 1 90 1 1 1 1 13 SER QB . 13 . HB# 1 1 90 1 2 1 1 14 THR H . 14 . HN 1 1 91 1 1 1 1 12 LYS HA . 12 . HA 1 1 91 1 2 1 1 14 THR H . 14 . HN 1 1 92 1 1 1 1 14 THR H . 14 . HN 1 1 92 1 2 1 1 15 PHE H . 15 . HN 1 1 93 1 1 1 1 15 PHE H . 15 . HN 1 1 93 1 2 1 1 15 PHE QD . 15 . HD# 1 1 94 1 1 1 1 14 THR HB . 14 . HB 1 1 94 1 2 1 1 15 PHE H . 15 . HN 1 1 95 1 1 1 1 15 PHE H . 15 . HN 1 1 95 1 2 1 1 15 PHE QB . 15 . HB# 1 1 96 1 1 1 1 14 THR MG . 14 . HG2# 1 1 96 1 2 1 1 15 PHE H . 15 . HN 1 1 97 1 1 1 1 14 THR HA . 14 . HA 1 1 97 1 2 1 1 15 PHE H . 15 . HN 1 1 98 1 1 1 1 15 PHE HA . 15 . HA 1 1 98 1 2 1 1 15 PHE QD . 15 . HD# 1 1 99 1 1 1 1 14 THR HA . 14 . HA 1 1 99 1 2 1 1 15 PHE QD . 15 . HD# 1 1 100 1 1 1 1 15 PHE QB . 15 . HB# 1 1 100 1 2 1 1 15 PHE QD . 15 . HD# 1 1 101 1 1 1 1 15 PHE H . 15 . HN 1 1 101 1 2 1 1 16 CYS H . 16 . HN 1 1 102 1 1 1 1 15 PHE QD . 15 . HD# 1 1 102 1 2 1 1 16 CYS H . 16 . HN 1 1 103 1 1 1 1 15 PHE QB . 15 . HB# 1 1 103 1 2 1 1 16 CYS H . 16 . HN 1 1 104 1 1 1 1 16 CYS H . 16 . HN 1 1 104 1 2 1 1 16 CYS QB . 16 . HB# 1 1 105 1 1 1 1 15 PHE HA . 15 . HA 1 1 105 1 2 1 1 16 CYS H . 16 . HN 1 1 106 1 1 1 1 16 CYS H . 16 . HN 1 1 106 1 2 1 1 20 TYR QB . 20 . HB# 1 1 107 1 1 1 1 3 GLY QA . 3 . HA# 1 1 107 1 2 1 1 16 CYS HA . 16 . HA 1 1 108 1 1 1 1 15 PHE QB . 15 . HB# 1 1 108 1 2 1 1 16 CYS HA . 16 . HA 1 1 109 1 1 1 1 16 CYS QB . 16 . HB# 1 1 109 1 2 1 1 20 TYR QB . 20 . HB# 1 1 110 1 1 1 1 16 CYS QB . 16 . HB# 1 1 110 1 2 1 1 29 CYS QB . 29 . HB# 1 1 111 1 1 1 1 16 CYS H . 16 . HN 1 1 111 1 2 1 1 17 CYS H . 17 . HN 1 1 112 1 1 1 1 3 GLY H . 3 . HN 1 1 112 1 2 1 1 17 CYS H . 17 . HN 1 1 113 1 1 1 1 17 CYS H . 17 . HN 1 1 113 1 2 1 1 18 SER H . 18 . HN 1 1 114 1 1 1 1 17 CYS H . 17 . HN 1 1 114 1 2 1 1 20 TYR H . 20 . HN 1 1 115 1 1 1 1 4 GLY H . 4 . HN 1 1 115 1 2 1 1 17 CYS H . 17 . HN 1 1 116 1 1 1 1 17 CYS H . 17 . HN 1 1 116 1 2 1 1 20 TYR QD . 20 . HD# 1 1 117 1 1 1 1 16 CYS HA . 16 . HA 1 1 117 1 2 1 1 17 CYS H . 17 . HN 1 1 118 1 1 1 1 3 GLY QA . 3 . HA# 1 1 118 1 2 1 1 17 CYS H . 17 . HN 1 1 119 1 1 1 1 4 GLY QA . 4 . HA# 1 1 119 1 2 1 1 17 CYS H . 17 . HN 1 1 120 1 1 1 1 16 CYS QB . 16 . HB# 1 1 120 1 2 1 1 17 CYS H . 17 . HN 1 1 121 1 1 1 1 2 CYS QB . 2 . HB# 1 1 121 1 2 1 1 17 CYS H . 17 . HN 1 1 122 1 1 1 1 17 CYS H . 17 . HN 1 1 122 1 2 1 1 20 TYR QB . 20 . HB# 1 1 123 1 1 1 1 17 CYS H . 17 . HN 1 1 123 1 2 1 1 17 CYS QB . 17 . HB# 1 1 124 1 1 1 1 2 CYS QB . 2 . HB# 1 1 124 1 2 1 1 17 CYS QB . 17 . HB# 1 1 125 1 1 1 1 17 CYS HA . 17 . HA 1 1 125 1 2 1 1 18 SER H . 18 . HN 1 1 126 1 1 1 1 17 CYS QB . 17 . HB# 1 1 126 1 2 1 1 18 SER H . 18 . HN 1 1 127 1 1 1 1 18 SER H . 18 . HN 1 1 127 1 2 1 1 20 TYR QD . 20 . HD# 1 1 128 1 1 1 1 18 SER H . 18 . HN 1 1 128 1 2 1 1 18 SER QB . 18 . HB# 1 1 129 1 1 1 1 2 CYS QB . 2 . HB# 1 1 129 1 2 1 1 18 SER H . 18 . HN 1 1 130 1 1 1 1 18 SER HA . 18 . HA 1 1 130 1 2 1 1 19 GLY QA . 19 . HA# 1 1 131 1 1 1 1 19 GLY H . 19 . HN 1 1 131 1 2 1 1 32 ALA MB . 32 . HB# 1 1 132 1 1 1 1 19 GLY H . 19 . HN 1 1 132 1 2 1 1 20 TYR H . 20 . HN 1 1 133 1 1 1 1 19 GLY H . 19 . HN 1 1 133 1 2 1 1 20 TYR QD . 20 . HD# 1 1 134 1 1 1 1 18 SER HA . 18 . HA 1 1 134 1 2 1 1 19 GLY H . 19 . HN 1 1 135 1 1 1 1 18 SER QB . 18 . HB# 1 1 135 1 2 1 1 19 GLY H . 19 . HN 1 1 136 1 1 1 1 19 GLY H . 19 . HN 1 1 136 1 2 1 1 20 TYR QB . 20 . HB# 1 1 137 1 1 1 1 19 GLY H . 19 . HN 1 1 137 1 2 1 1 20 TYR HA . 20 . HA 1 1 138 1 1 1 1 18 SER QB . 18 . HB# 1 1 138 1 2 1 1 19 GLY QA . 19 . HA# 1 1 139 1 1 1 1 19 GLY QA . 19 . HA# 1 1 139 1 2 1 1 32 ALA MB . 32 . HB# 1 1 140 1 1 1 1 19 GLY QA . 19 . HA# 1 1 140 1 2 1 1 20 TYR QB . 20 . HB# 1 1 141 1 1 1 1 20 TYR H . 20 . HN 1 1 141 1 2 1 1 20 TYR QD . 20 . HD# 1 1 142 1 1 1 1 20 TYR H . 20 . HN 1 1 142 1 2 1 1 21 ASN HA . 21 . HA 1 1 143 1 1 1 1 18 SER HA . 18 . HA 1 1 143 1 2 1 1 20 TYR H . 20 . HN 1 1 144 1 1 1 1 19 GLY QA . 19 . HA# 1 1 144 1 2 1 1 20 TYR H . 20 . HN 1 1 145 1 1 1 1 20 TYR H . 20 . HN 1 1 145 1 2 1 1 20 TYR QB . 20 . HB# 1 1 146 1 1 1 1 20 TYR H . 20 . HN 1 1 146 1 2 1 1 32 ALA MB . 32 . HB# 1 1 147 1 1 1 1 20 TYR H . 20 . HN 1 1 147 1 2 1 1 20 TYR QE . 20 . HE# 1 1 148 1 1 1 1 20 TYR HA . 20 . HA 1 1 148 1 2 1 1 20 TYR QD . 20 . HD# 1 1 149 1 1 1 1 16 CYS HA . 16 . HA 1 1 149 1 2 1 1 20 TYR QD . 20 . HD# 1 1 150 1 1 1 1 20 TYR QD . 20 . HD# 1 1 150 1 2 1 1 31 TYR HA . 31 . HA 1 1 151 1 1 1 1 17 CYS QB . 17 . HB# 1 1 151 1 2 1 1 20 TYR QD . 20 . HD# 1 1 152 1 1 1 1 20 TYR QD . 20 . HD# 1 1 152 1 2 1 1 29 CYS QB . 29 . HB# 1 1 153 1 1 1 1 20 TYR QB . 20 . HB# 1 1 153 1 2 1 1 20 TYR QD . 20 . HD# 1 1 154 1 1 1 1 5 LEU HG . 5 . HG 1 1 154 1 2 1 1 20 TYR QD . 20 . HD# 1 1 155 1 1 1 1 5 LEU QD . 5 . HD# 1 1 155 1 2 1 1 20 TYR QD . 20 . HD# 1 1 156 1 1 1 1 20 TYR HA . 20 . HA 1 1 156 1 2 1 1 20 TYR QE . 20 . HE# 1 1 157 1 1 1 1 20 TYR QE . 20 . HE# 1 1 157 1 2 1 1 31 TYR HA . 31 . HA 1 1 158 1 1 1 1 20 TYR QE . 20 . HE# 1 1 158 1 2 1 1 29 CYS QB . 29 . HB# 1 1 159 1 1 1 1 5 LEU HA . 5 . HA 1 1 159 1 2 1 1 20 TYR QE . 20 . HE# 1 1 160 1 1 1 1 4 GLY QA . 4 . HA# 1 1 160 1 2 1 1 20 TYR QE . 20 . HE# 1 1 161 1 1 1 1 5 LEU QB . 5 . HB# 1 1 161 1 2 1 1 20 TYR QE . 20 . HE# 1 1 162 1 1 1 1 5 LEU HG . 5 . HG 1 1 162 1 2 1 1 20 TYR QE . 20 . HE# 1 1 163 1 1 1 1 5 LEU QD . 5 . HD# 1 1 163 1 2 1 1 20 TYR QE . 20 . HE# 1 1 164 1 1 1 1 20 TYR HA . 20 . HA 1 1 164 1 2 1 1 31 TYR HA . 31 . HA 1 1 165 1 1 1 1 20 TYR HA . 20 . HA 1 1 165 1 2 1 1 29 CYS QB . 29 . HB# 1 1 166 1 1 1 1 20 TYR HA . 20 . HA 1 1 166 1 2 1 1 32 ALA MB . 32 . HB# 1 1 167 1 1 1 1 5 LEU QD . 5 . HD# 1 1 167 1 2 1 1 20 TYR HA . 20 . HA 1 1 168 1 1 1 1 21 ASN H . 21 . HN 1 1 168 1 2 1 1 32 ALA H . 32 . HN 1 1 169 1 1 1 1 20 TYR H . 20 . HN 1 1 169 1 2 1 1 21 ASN H . 21 . HN 1 1 170 1 1 1 1 21 ASN H . 21 . HN 1 1 170 1 2 1 1 30 VAL H . 30 . HN 1 1 171 1 1 1 1 20 TYR QD . 20 . HD# 1 1 171 1 2 1 1 21 ASN H . 21 . HN 1 1 172 1 1 1 1 20 TYR HA . 20 . HA 1 1 172 1 2 1 1 21 ASN H . 21 . HN 1 1 173 1 1 1 1 21 ASN H . 21 . HN 1 1 173 1 2 1 1 31 TYR HA . 31 . HA 1 1 174 1 1 1 1 21 ASN H . 21 . HN 1 1 174 1 2 1 1 32 ALA HA . 32 . HA 1 1 175 1 1 1 1 21 ASN H . 21 . HN 1 1 175 1 2 1 1 29 CYS QB . 29 . HB# 1 1 176 1 1 1 1 20 TYR QB . 20 . HB# 1 1 176 1 2 1 1 21 ASN H . 21 . HN 1 1 177 1 1 1 1 21 ASN H . 21 . HN 1 1 177 1 2 1 1 21 ASN QB . 21 . HB# 1 1 178 1 1 1 1 21 ASN H . 21 . HN 1 1 178 1 2 1 1 30 VAL QG . 30 . HG# 1 1 179 1 1 1 1 21 ASN HA . 21 . HA 1 1 179 1 2 1 1 22 CYS QB . 22 . HB# 1 1 180 1 1 1 1 21 ASN HA . 21 . HA 1 1 180 1 2 1 1 29 CYS QB . 29 . HB# 1 1 181 1 1 1 1 21 ASN QB . 21 . HB# 1 1 181 1 2 1 1 30 VAL QG . 30 . HG# 1 1 182 1 1 1 1 21 ASN QD . 21 . HD2# 1 1 182 1 2 1 1 22 CYS H . 22 . HN 1 1 183 1 1 1 1 21 ASN QB . 21 . HB# 1 1 183 1 2 1 1 22 CYS H . 22 . HN 1 1 184 1 1 1 1 22 CYS H . 22 . HN 1 1 184 1 2 1 1 22 CYS QB . 22 . HB# 1 1 185 1 1 1 1 21 ASN HA . 21 . HA 1 1 185 1 2 1 1 22 CYS H . 22 . HN 1 1 186 1 1 1 1 22 CYS H . 22 . HN 1 1 186 1 2 1 1 30 VAL QG . 30 . HG# 1 1 187 1 1 1 1 14 THR MG . 14 . HG2# 1 1 187 1 2 1 1 22 CYS H . 22 . HN 1 1 188 1 1 1 1 14 THR MG . 14 . HG2# 1 1 188 1 2 1 1 22 CYS QB . 22 . HB# 1 1 189 1 1 1 1 9 CYS QB . 9 . HB# 1 1 189 1 2 1 1 22 CYS QB . 22 . HB# 1 1 190 1 1 1 1 22 CYS HA . 22 . HA 1 1 190 1 2 1 1 29 CYS HA . 29 . HA 1 1 191 1 1 1 1 23 SER H . 23 . HN 1 1 191 1 2 1 1 30 VAL QG . 30 . HG# 1 1 192 1 1 1 1 23 SER H . 23 . HN 1 1 192 1 2 1 1 28 TRP H . 28 . HN 1 1 193 1 1 1 1 23 SER H . 23 . HN 1 1 193 1 2 1 1 27 LYS H . 27 . HN 1 1 194 1 1 1 1 23 SER H . 23 . HN 1 1 194 1 2 1 1 28 TRP HD1 . 28 . HD1 1 1 195 1 1 1 1 23 SER H . 23 . HN 1 1 195 1 2 1 1 29 CYS HA . 29 . HA 1 1 196 1 1 1 1 23 SER H . 23 . HN 1 1 196 1 2 1 1 23 SER QB . 23 . HB# 1 1 197 1 1 1 1 22 CYS QB . 22 . HB# 1 1 197 1 2 1 1 23 SER H . 23 . HN 1 1 198 1 1 1 1 22 CYS HA . 22 . HA 1 1 198 1 2 1 1 23 SER H . 23 . HN 1 1 199 1 1 1 1 23 SER H . 23 . HN 1 1 199 1 2 1 1 26 TRP QB . 26 . HB# 1 1 200 1 1 1 1 23 SER HA . 23 . HA 1 1 200 1 2 1 1 24 PRO QD . 24 . HD# 1 1 201 1 1 1 1 23 SER HA . 23 . HA 1 1 201 1 2 1 1 26 TRP QB . 26 . HB# 1 1 202 1 1 1 1 23 SER QB . 23 . HB# 1 1 202 1 2 1 1 26 TRP QB . 26 . HB# 1 1 203 1 1 1 1 24 PRO HA . 24 . HA 1 1 203 1 2 1 1 24 PRO QG . 24 . HG# 1 1 204 1 1 1 1 24 PRO HA . 24 . HA 1 1 204 1 2 1 1 24 PRO QD . 24 . HD# 1 1 205 1 1 1 1 24 PRO HA . 24 . HA 1 1 205 1 2 1 1 25 THR H . 25 . HN 1 1 206 1 1 1 1 24 PRO QD . 24 . HD# 1 1 206 1 2 1 1 25 THR H . 25 . HN 1 1 207 1 1 1 1 25 THR H . 25 . HN 1 1 207 1 2 1 1 25 THR HB . 25 . HB 1 1 208 1 1 1 1 24 PRO QB . 24 . HB# 1 1 208 1 2 1 1 25 THR H . 25 . HN 1 1 209 1 1 1 1 24 PRO QG . 24 . HG# 1 1 209 1 2 1 1 25 THR H . 25 . HN 1 1 210 1 1 1 1 25 THR HA . 25 . HA 1 1 210 1 2 1 1 25 THR MG . 25 . HG2# 1 1 211 1 1 1 1 25 THR HA . 25 . HA 1 1 211 1 2 1 1 26 TRP H . 26 . HN 1 1 212 1 1 1 1 25 THR HB . 25 . HB 1 1 212 1 2 1 1 26 TRP H . 26 . HN 1 1 213 1 1 1 1 26 TRP H . 26 . HN 1 1 213 1 2 1 1 26 TRP QB . 26 . HB# 1 1 214 1 1 1 1 26 TRP HA . 26 . HA 1 1 214 1 2 1 1 26 TRP HE1 . 26 . HE1 1 1 215 1 1 1 1 25 THR HB . 25 . HB 1 1 215 1 2 1 1 26 TRP HE1 . 26 . HE1 1 1 216 1 1 1 1 25 THR MG . 25 . HG2# 1 1 216 1 2 1 1 26 TRP HE1 . 26 . HE1 1 1 217 1 1 1 1 23 SER QB . 23 . HB# 1 1 217 1 2 1 1 26 TRP HE1 . 26 . HE1 1 1 218 1 1 1 1 23 SER QB . 23 . HB# 1 1 218 1 2 1 1 26 TRP HD1 . 26 . HD1 1 1 219 1 1 1 1 26 TRP HA . 26 . HA 1 1 219 1 2 1 1 26 TRP HD1 . 26 . HD1 1 1 220 1 1 1 1 25 THR HB . 25 . HB 1 1 220 1 2 1 1 26 TRP HD1 . 26 . HD1 1 1 221 1 1 1 1 25 THR MG . 25 . HG2# 1 1 221 1 2 1 1 26 TRP HD1 . 26 . HD1 1 1 222 1 1 1 1 25 THR MG . 25 . HG2# 1 1 222 1 2 1 1 26 TRP HA . 26 . HA 1 1 223 1 1 1 1 26 TRP HA . 26 . HA 1 1 223 1 2 1 1 27 LYS H . 27 . HN 1 1 224 1 1 1 1 27 LYS H . 27 . HN 1 1 224 1 2 1 1 27 LYS QB . 27 . HB# 1 1 225 1 1 1 1 26 TRP QB . 26 . HB# 1 1 225 1 2 1 1 27 LYS H . 27 . HN 1 1 226 1 1 1 1 26 TRP H . 26 . HN 1 1 226 1 2 1 1 27 LYS H . 27 . HN 1 1 227 1 1 1 1 27 LYS H . 27 . HN 1 1 227 1 2 1 1 28 TRP H . 28 . HN 1 1 228 1 1 1 1 27 LYS H . 27 . HN 1 1 228 1 2 1 1 27 LYS QD . 27 . HD# 1 1 229 1 1 1 1 27 LYS HA . 27 . HA 1 1 229 1 2 1 1 27 LYS QD . 27 . HD# 1 1 230 1 1 1 1 27 LYS HA . 27 . HA 1 1 230 1 2 1 1 27 LYS QG . 27 . HG# 1 1 231 1 1 1 1 27 LYS QB . 27 . HB# 1 1 231 1 2 1 1 27 LYS QD . 27 . HD# 1 1 232 1 1 1 1 26 TRP QB . 26 . HB# 1 1 232 1 2 1 1 28 TRP H . 28 . HN 1 1 233 1 1 1 1 27 LYS HA . 27 . HA 1 1 233 1 2 1 1 28 TRP H . 28 . HN 1 1 234 1 1 1 1 28 TRP H . 28 . HN 1 1 234 1 2 1 1 28 TRP QB . 28 . HB# 1 1 235 1 1 1 1 27 LYS QB . 27 . HB# 1 1 235 1 2 1 1 28 TRP H . 28 . HN 1 1 236 1 1 1 1 27 LYS QD . 27 . HD# 1 1 236 1 2 1 1 28 TRP H . 28 . HN 1 1 237 1 1 1 1 27 LYS QG . 27 . HG# 1 1 237 1 2 1 1 28 TRP H . 28 . HN 1 1 238 1 1 1 1 23 SER QB . 23 . HB# 1 1 238 1 2 1 1 28 TRP H . 28 . HN 1 1 239 1 1 1 1 28 TRP QB . 28 . HB# 1 1 239 1 2 1 1 28 TRP HE3 . 28 . HE3 1 1 240 1 1 1 1 26 TRP QB . 26 . HB# 1 1 240 1 2 1 1 28 TRP HE3 . 28 . HE3 1 1 241 1 1 1 1 6 MET QB . 6 . HB# 1 1 241 1 2 1 1 28 TRP HE3 . 28 . HE3 1 1 242 1 1 1 1 23 SER QB . 23 . HB# 1 1 242 1 2 1 1 28 TRP HE3 . 28 . HE3 1 1 243 1 1 1 1 28 TRP HA . 28 . HA 1 1 243 1 2 1 1 28 TRP HE3 . 28 . HE3 1 1 244 1 1 1 1 26 TRP QB . 26 . HB# 1 1 244 1 2 1 1 28 TRP HE1 . 28 . HE1 1 1 245 1 1 1 1 26 TRP HE3 . 26 . HE3 1 1 245 1 2 1 1 28 TRP HE1 . 28 . HE1 1 1 246 1 1 1 1 6 MET QG . 6 . HG# 1 1 246 1 2 1 1 28 TRP HE1 . 28 . HE1 1 1 247 1 1 1 1 28 TRP HE1 . 28 . HE1 1 1 247 1 2 1 1 30 VAL QG . 30 . HG# 1 1 248 1 1 1 1 23 SER QB . 23 . HB# 1 1 248 1 2 1 1 28 TRP HE1 . 28 . HE1 1 1 249 1 1 1 1 6 MET ME . 6 . HE# 1 1 249 1 2 1 1 28 TRP HE1 . 28 . HE1 1 1 250 1 1 1 1 28 TRP HD1 . 28 . HD1 1 1 250 1 2 1 1 29 CYS HA . 29 . HA 1 1 251 1 1 1 1 28 TRP HD1 . 28 . HD1 1 1 251 1 2 1 1 30 VAL HA . 30 . HA 1 1 252 1 1 1 1 23 SER QB . 23 . HB# 1 1 252 1 2 1 1 28 TRP HD1 . 28 . HD1 1 1 253 1 1 1 1 6 MET QB . 6 . HB# 1 1 253 1 2 1 1 28 TRP HD1 . 28 . HD1 1 1 254 1 1 1 1 28 TRP HD1 . 28 . HD1 1 1 254 1 2 1 1 30 VAL QG . 30 . HG# 1 1 255 1 1 1 1 8 GLY QA . 8 . HA# 1 1 255 1 2 1 1 28 TRP HA . 28 . HA 1 1 256 1 1 1 1 28 TRP HA . 28 . HA 1 1 256 1 2 1 1 29 CYS QB . 29 . HB# 1 1 257 1 1 1 1 27 LYS QB . 27 . HB# 1 1 257 1 2 1 1 28 TRP HA . 28 . HA 1 1 258 1 1 1 1 9 CYS H . 9 . HN 1 1 258 1 2 1 1 29 CYS H . 29 . HN 1 1 259 1 1 1 1 28 TRP HD1 . 28 . HD1 1 1 259 1 2 1 1 29 CYS H . 29 . HN 1 1 260 1 1 1 1 28 TRP QB . 28 . HB# 1 1 260 1 2 1 1 29 CYS H . 29 . HN 1 1 261 1 1 1 1 28 TRP H . 28 . HN 1 1 261 1 2 1 1 29 CYS H . 29 . HN 1 1 262 1 1 1 1 28 TRP HA . 28 . HA 1 1 262 1 2 1 1 29 CYS H . 29 . HN 1 1 263 1 1 1 1 8 GLY QA . 8 . HA# 1 1 263 1 2 1 1 29 CYS H . 29 . HN 1 1 264 1 1 1 1 29 CYS H . 29 . HN 1 1 264 1 2 1 1 29 CYS QB . 29 . HB# 1 1 265 1 1 1 1 22 CYS QB . 22 . HB# 1 1 265 1 2 1 1 29 CYS H . 29 . HN 1 1 266 1 1 1 1 7 ALA H . 7 . HN 1 1 266 1 2 1 1 29 CYS H . 29 . HN 1 1 267 1 1 1 1 7 ALA MB . 7 . HB# 1 1 267 1 2 1 1 29 CYS H . 29 . HN 1 1 268 1 1 1 1 7 ALA HA . 7 . HA 1 1 268 1 2 1 1 29 CYS H . 29 . HN 1 1 269 1 1 1 1 8 GLY H . 8 . HN 1 1 269 1 2 1 1 29 CYS H . 29 . HN 1 1 270 1 1 1 1 22 CYS QB . 22 . HB# 1 1 270 1 2 1 1 29 CYS HA . 29 . HA 1 1 271 1 1 1 1 29 CYS HA . 29 . HA 1 1 271 1 2 1 1 30 VAL QG . 30 . HG# 1 1 272 1 1 1 1 28 TRP HA . 28 . HA 1 1 272 1 2 1 1 29 CYS HA . 29 . HA 1 1 273 1 1 1 1 23 SER H . 23 . HN 1 1 273 1 2 1 1 30 VAL H . 30 . HN 1 1 274 1 1 1 1 29 CYS H . 29 . HN 1 1 274 1 2 1 1 30 VAL H . 30 . HN 1 1 275 1 1 1 1 30 VAL H . 30 . HN 1 1 275 1 2 1 1 31 TYR H . 31 . HN 1 1 276 1 1 1 1 21 ASN HA . 21 . HA 1 1 276 1 2 1 1 30 VAL H . 30 . HN 1 1 277 1 1 1 1 20 TYR QB . 20 . HB# 1 1 277 1 2 1 1 30 VAL H . 30 . HN 1 1 278 1 1 1 1 20 TYR QD . 20 . HD# 1 1 278 1 2 1 1 30 VAL H . 30 . HN 1 1 279 1 1 1 1 28 TRP HD1 . 28 . HD1 1 1 279 1 2 1 1 30 VAL H . 30 . HN 1 1 280 1 1 1 1 29 CYS HA . 29 . HA 1 1 280 1 2 1 1 30 VAL H . 30 . HN 1 1 281 1 1 1 1 29 CYS QB . 29 . HB# 1 1 281 1 2 1 1 30 VAL H . 30 . HN 1 1 282 1 1 1 1 30 VAL H . 30 . HN 1 1 282 1 2 1 1 30 VAL QG . 30 . HG# 1 1 283 1 1 1 1 5 LEU QD . 5 . HD# 1 1 283 1 2 1 1 30 VAL H . 30 . HN 1 1 284 1 1 1 1 5 LEU QD . 5 . HD# 1 1 284 1 2 1 1 30 VAL HA . 30 . HA 1 1 285 1 1 1 1 5 LEU QD . 5 . HD# 1 1 285 1 2 1 1 30 VAL HB . 30 . HB 1 1 286 1 1 1 1 20 TYR QD . 20 . HD# 1 1 286 1 2 1 1 31 TYR H . 31 . HN 1 1 287 1 1 1 1 20 TYR QE . 20 . HE# 1 1 287 1 2 1 1 31 TYR H . 31 . HN 1 1 288 1 1 1 1 31 TYR H . 31 . HN 1 1 288 1 2 1 1 31 TYR QD . 31 . HD# 1 1 289 1 1 1 1 31 TYR H . 31 . HN 1 1 289 1 2 1 1 31 TYR QB . 31 . HB# 1 1 290 1 1 1 1 30 VAL HB . 30 . HB 1 1 290 1 2 1 1 31 TYR H . 31 . HN 1 1 291 1 1 1 1 30 VAL QG . 30 . HG# 1 1 291 1 2 1 1 31 TYR H . 31 . HN 1 1 292 1 1 1 1 20 TYR HA . 20 . HA 1 1 292 1 2 1 1 31 TYR H . 31 . HN 1 1 293 1 1 1 1 30 VAL HA . 30 . HA 1 1 293 1 2 1 1 31 TYR H . 31 . HN 1 1 294 1 1 1 1 5 LEU QD . 5 . HD# 1 1 294 1 2 1 1 31 TYR H . 31 . HN 1 1 295 1 1 1 1 20 TYR HA . 20 . HA 1 1 295 1 2 1 1 31 TYR QD . 31 . HD# 1 1 296 1 1 1 1 31 TYR HA . 31 . HA 1 1 296 1 2 1 1 31 TYR QD . 31 . HD# 1 1 297 1 1 1 1 31 TYR QB . 31 . HB# 1 1 297 1 2 1 1 31 TYR QD . 31 . HD# 1 1 298 1 1 1 1 5 LEU QD . 5 . HD# 1 1 298 1 2 1 1 31 TYR QE . 31 . HE# 1 1 299 1 1 1 1 31 TYR HA . 31 . HA 1 1 299 1 2 1 1 31 TYR QE . 31 . HE# 1 1 300 1 1 1 1 30 VAL QG . 30 . HG# 1 1 300 1 2 1 1 31 TYR QB . 31 . HB# 1 1 301 1 1 1 1 31 TYR HA . 31 . HA 1 1 301 1 2 1 1 32 ALA H . 32 . HN 1 1 302 1 1 1 1 31 TYR QD . 31 . HD# 1 1 302 1 2 1 1 32 ALA H . 32 . HN 1 1 303 1 1 1 1 20 TYR QD . 20 . HD# 1 1 303 1 2 1 1 32 ALA H . 32 . HN 1 1 304 1 1 1 1 20 TYR HA . 20 . HA 1 1 304 1 2 1 1 32 ALA H . 32 . HN 1 1 305 1 1 1 1 19 GLY QA . 19 . HA# 1 1 305 1 2 1 1 32 ALA H . 32 . HN 1 1 306 1 1 1 1 31 TYR QB . 31 . HB# 1 1 306 1 2 1 1 32 ALA H . 32 . HN 1 1 307 1 1 1 1 32 ALA H . 32 . HN 1 1 307 1 2 1 1 32 ALA MB . 32 . HB# 1 1 308 1 1 1 1 32 ALA HA . 32 . HA 1 1 308 1 2 1 1 33 ARG H . 33 . HN 1 1 309 1 1 1 1 33 ARG H . 33 . HN 1 1 309 1 2 1 1 33 ARG QB . 33 . HB# 1 1 310 1 1 1 1 33 ARG HA . 33 . HA 1 1 310 1 2 1 1 34 PRO QD . 34 . HD# 1 1 311 1 1 1 1 32 ALA MB . 32 . HB# 1 1 311 1 2 1 1 33 ARG QB . 33 . HB# 1 1 312 1 1 1 1 34 PRO HA . 34 . HA 1 1 312 1 2 1 1 34 PRO QG . 34 . HG# 1 1 313 1 1 1 1 33 ARG QB . 33 . HB# 1 1 313 1 2 1 1 34 PRO QD . 34 . HD# 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.5 1.8 4.5 1 1 2 1 . . . . . 5.0 1.8 5.0 1 1 3 1 . . . . . 2.7 1.8 2.7 1 1 4 1 . . . . . 5.0 1.8 5.0 1 1 5 1 . . . . . 3.5 1.8 4.5 1 1 6 1 . . . . . 5.0 1.8 6.0 1 1 7 1 . . . . . 6.0 1.8 6.0 1 1 8 1 . . . . . 6.0 1.8 8.4 1 1 9 1 . . . . . 3.5 1.8 5.5 1 1 10 1 . . . . . 3.5 1.8 5.5 1 1 11 1 . . . . . 5.0 1.8 5.0 1 1 12 1 . . . . . 2.7 1.8 3.7 1 1 13 1 . . . . . 2.7 1.8 3.7 1 1 14 1 . . . . . 6.0 1.8 6.0 1 1 15 1 . . . . . 5.0 1.8 8.4 1 1 16 1 . . . . . 3.5 1.8 5.9 1 1 17 1 . . . . . 6.0 1.8 7.0 1 1 18 1 . . . . . 2.7 1.8 3.7 1 1 19 1 . . . . . 3.5 1.8 4.5 1 1 20 1 . . . . . 5.0 1.8 5.0 1 1 21 1 . . . . . 6.0 1.8 7.0 1 1 22 1 . . . . . 5.0 1.8 6.0 1 1 23 1 . . . . . 5.0 1.8 5.0 1 1 24 1 . . . . . 3.5 1.8 4.5 1 1 25 1 . . . . . 3.5 1.8 4.5 1 1 26 1 . . . . . 5.0 1.8 7.4 1 1 27 1 . . . . . 3.5 1.8 3.5 1 1 28 1 . . . . . 2.7 1.8 2.7 1 1 29 1 . . . . . 3.5 1.8 3.5 1 1 30 1 . . . . . 5.0 1.8 5.0 1 1 31 1 . . . . . 5.0 1.8 7.4 1 1 32 1 . . . . . 5.0 1.8 7.4 1 1 33 1 . . . . . 5.0 1.8 6.0 1 1 34 1 . . . . . 3.5 1.8 4.5 1 1 35 1 . . . . . 3.5 1.8 6.9 1 1 36 1 . . . . . 5.0 1.8 5.0 1 1 37 1 . . . . . 3.5 1.8 4.5 1 1 38 1 . . . . . 3.5 1.8 3.5 1 1 39 1 . . . . . 5.0 1.8 6.0 1 1 40 1 . . . . . 2.7 1.8 3.7 1 1 41 1 . . . . . 5.0 1.8 7.4 1 1 42 1 . . . . . 5.0 1.8 6.0 1 1 43 1 . . . . . 5.0 1.8 5.0 1 1 44 1 . . . . . 2.7 1.8 2.7 1 1 45 1 . . . . . 3.5 1.8 4.5 1 1 46 1 . . . . . 5.0 1.8 5.0 1 1 47 1 . . . . . 5.0 1.8 5.0 1 1 48 1 . . . . . 2.7 1.8 3.7 1 1 49 1 . . . . . 3.5 1.8 4.5 1 1 50 1 . . . . . 2.7 1.8 2.7 1 1 51 1 . . . . . 5.0 1.8 6.0 1 1 52 1 . . . . . 3.5 1.8 3.5 1 1 53 1 . . . . . 3.5 1.8 3.5 1 1 54 1 . . . . . 3.5 1.8 4.5 1 1 55 1 . . . . . 5.0 1.8 5.0 1 1 56 1 . . . . . 3.5 1.8 4.5 1 1 57 1 . . . . . 5.0 1.8 6.0 1 1 58 1 . . . . . 5.0 1.8 6.0 1 1 59 1 . . . . . 6.0 1.8 6.0 1 1 60 1 . . . . . 5.0 1.8 6.0 1 1 61 1 . . . . . 5.0 1.8 6.0 1 1 62 1 . . . . . 3.5 1.8 4.5 1 1 63 1 . . . . . 5.0 1.8 6.0 1 1 64 1 . . . . . 3.5 1.8 3.5 1 1 65 1 . . . . . 3.5 1.8 4.5 1 1 66 1 . . . . . 5.0 1.8 6.0 1 1 67 1 . . . . . 6.0 1.8 7.0 1 1 68 1 . . . . . 5.0 1.8 5.0 1 1 69 1 . . . . . 5.0 1.8 6.0 1 1 70 1 . . . . . 5.0 1.8 6.0 1 1 71 1 . . . . . 5.0 1.8 6.0 1 1 72 1 . . . . . 3.5 1.8 4.5 1 1 73 1 . . . . . 2.7 1.8 3.7 1 1 74 1 . . . . . 3.5 1.8 4.5 1 1 75 1 . . . . . 5.0 1.8 5.0 1 1 76 1 . . . . . 5.0 1.8 5.0 1 1 77 1 . . . . . 5.0 1.8 6.0 1 1 78 1 . . . . . 5.0 1.8 6.0 1 1 79 1 . . . . . 3.5 1.8 5.5 1 1 80 1 . . . . . 3.5 1.8 4.5 1 1 81 1 . . . . . 5.0 1.8 6.0 1 1 82 1 . . . . . 5.0 1.8 6.0 1 1 83 1 . . . . . 2.7 1.8 2.7 1 1 84 1 . . . . . 2.7 1.8 2.7 1 1 85 1 . . . . . 3.5 1.8 3.5 1 1 86 1 . . . . . 2.7 1.8 3.7 1 1 87 1 . . . . . 3.5 1.8 4.5 1 1 88 1 . . . . . 5.0 1.8 6.0 1 1 89 1 . . . . . 5.0 1.8 5.0 1 1 90 1 . . . . . 3.5 1.8 4.5 1 1 91 1 . . . . . 5.0 1.8 5.0 1 1 92 1 . . . . . 5.0 1.8 5.0 1 1 93 1 . . . . . 3.5 1.8 5.9 1 1 94 1 . . . . . 5.0 1.8 5.0 1 1 95 1 . . . . . 2.7 1.8 3.7 1 1 96 1 . . . . . 5.0 1.8 6.0 1 1 97 1 . . . . . 3.5 1.8 3.5 1 1 98 1 . . . . . 3.5 1.8 5.9 1 1 99 1 . . . . . 5.0 1.8 7.4 1 1 100 1 . . . . . 2.7 1.8 6.1 1 1 101 1 . . . . . 5.0 1.8 5.0 1 1 102 1 . . . . . 5.0 1.8 7.4 1 1 103 1 . . . . . 3.5 1.8 4.5 1 1 104 1 . . . . . 2.7 1.8 3.7 1 1 105 1 . . . . . 3.5 1.8 3.5 1 1 106 1 . . . . . 5.0 1.8 6.0 1 1 107 1 . . . . . 5.0 1.8 6.0 1 1 108 1 . . . . . 5.0 1.8 6.0 1 1 109 1 . . . . . 3.5 1.8 5.5 1 1 110 1 . . . . . 3.5 1.8 5.5 1 1 111 1 . . . . . 5.0 1.8 5.0 1 1 112 1 . . . . . 3.5 1.8 3.5 1 1 113 1 . . . . . 3.5 1.8 3.5 1 1 114 1 . . . . . 5.0 1.8 5.0 1 1 115 1 . . . . . 5.0 1.8 5.0 1 1 116 1 . . . . . 3.5 1.8 5.9 1 1 117 1 . . . . . 3.5 1.8 3.5 1 1 118 1 . . . . . 5.0 1.8 6.0 1 1 119 1 . . . . . 6.0 1.8 7.0 1 1 120 1 . . . . . 3.5 1.8 4.5 1 1 121 1 . . . . . 5.0 1.8 6.0 1 1 122 1 . . . . . 2.7 1.8 3.7 1 1 123 1 . . . . . 2.7 1.8 3.7 1 1 124 1 . . . . . 3.5 1.8 5.5 1 1 125 1 . . . . . 3.5 1.8 3.5 1 1 126 1 . . . . . 2.7 1.8 3.7 1 1 127 1 . . . . . 5.0 1.8 7.4 1 1 128 1 . . . . . 2.7 1.8 3.7 1 1 129 1 . . . . . 6.0 1.8 7.0 1 1 130 1 . . . . . 5.0 1.8 6.0 1 1 131 1 . . . . . 5.0 1.8 6.0 1 1 132 1 . . . . . 2.7 1.8 2.7 1 1 133 1 . . . . . 5.0 1.8 7.4 1 1 134 1 . . . . . 3.5 1.8 3.5 1 1 135 1 . . . . . 3.5 1.8 4.5 1 1 136 1 . . . . . 5.0 1.8 6.0 1 1 137 1 . . . . . 6.0 1.8 7.0 1 1 138 1 . . . . . 3.5 1.8 5.5 1 1 139 1 . . . . . 3.5 1.8 5.5 1 1 140 1 . . . . . 5.0 1.5 7.0 1 1 141 1 . . . . . 2.7 1.8 5.1 1 1 142 1 . . . . . 6.0 1.8 6.0 1 1 143 1 . . . . . 5.0 1.8 5.0 1 1 144 1 . . . . . 3.5 1.8 4.5 1 1 145 1 . . . . . 2.7 1.8 3.7 1 1 146 1 . . . . . 5.0 1.8 6.0 1 1 147 1 . . . . . 5.0 1.8 7.4 1 1 148 1 . . . . . 3.5 1.8 5.9 1 1 149 1 . . . . . 5.0 1.8 7.4 1 1 150 1 . . . . . 3.5 1.8 5.9 1 1 151 1 . . . . . 3.5 1.8 6.9 1 1 152 1 . . . . . 3.5 1.8 6.9 1 1 153 1 . . . . . 2.7 1.8 6.1 1 1 154 1 . . . . . 5.0 1.8 7.4 1 1 155 1 . . . . . 5.0 1.8 9.8 1 1 156 1 . . . . . 5.0 1.8 7.4 1 1 157 1 . . . . . 5.0 1.8 7.4 1 1 158 1 . . . . . 5.0 1.8 8.4 1 1 159 1 . . . . . 3.5 1.8 5.9 1 1 160 1 . . . . . 5.0 1.8 8.4 1 1 161 1 . . . . . 3.5 1.8 6.9 1 1 162 1 . . . . . 3.5 1.8 5.9 1 1 163 1 . . . . . 3.5 1.8 8.3 1 1 164 1 . . . . . 2.7 1.8 2.7 1 1 165 1 . . . . . 5.0 1.8 6.0 1 1 166 1 . . . . . 5.0 1.8 6.0 1 1 167 1 . . . . . 5.0 1.8 7.4 1 1 168 1 . . . . . 5.0 1.8 5.0 1 1 169 1 . . . . . 5.0 1.8 5.0 1 1 170 1 . . . . . 3.5 1.8 3.5 1 1 171 1 . . . . . 5.0 1.8 7.4 1 1 172 1 . . . . . 2.7 1.8 2.7 1 1 173 1 . . . . . 5.0 1.8 5.0 1 1 174 1 . . . . . 5.0 1.8 5.0 1 1 175 1 . . . . . 5.0 1.8 6.0 1 1 176 1 . . . . . 3.5 1.8 4.5 1 1 177 1 . . . . . 3.5 1.8 4.5 1 1 178 1 . . . . . 5.0 1.8 7.4 1 1 179 1 . . . . . 5.0 1.8 6.0 1 1 180 1 . . . . . 5.0 1.8 6.0 1 1 181 1 . . . . . 3.5 1.8 6.9 1 1 182 1 . . . . . 3.5 1.8 4.5 1 1 183 1 . . . . . 3.5 1.8 4.5 1 1 184 1 . . . . . 2.7 1.8 3.7 1 1 185 1 . . . . . 2.7 1.8 2.7 1 1 186 1 . . . . . 5.0 1.8 7.4 1 1 187 1 . . . . . 5.0 1.8 6.0 1 1 188 1 . . . . . 5.0 1.8 7.0 1 1 189 1 . . . . . 3.5 1.8 5.5 1 1 190 1 . . . . . 2.7 1.8 2.7 1 1 191 1 . . . . . 5.0 1.8 7.4 1 1 192 1 . . . . . 3.5 1.8 3.5 1 1 193 1 . . . . . 5.0 1.8 5.0 1 1 194 1 . . . . . 5.0 1.8 5.0 1 1 195 1 . . . . . 5.0 1.8 5.0 1 1 196 1 . . . . . 2.7 1.8 3.7 1 1 197 1 . . . . . 5.0 1.8 6.0 1 1 198 1 . . . . . 2.7 1.8 2.7 1 1 199 1 . . . . . 5.0 1.8 6.0 1 1 200 1 . . . . . 3.5 1.8 4.5 1 1 201 1 . . . . . 5.0 1.8 6.0 1 1 202 1 . . . . . 3.5 1.8 5.5 1 1 203 1 . . . . . 3.5 1.8 4.5 1 1 204 1 . . . . . 3.5 1.8 4.5 1 1 205 1 . . . . . 3.5 1.8 3.5 1 1 206 1 . . . . . 3.5 1.8 4.5 1 1 207 1 . . . . . 3.5 1.8 3.5 1 1 208 1 . . . . . 3.5 1.8 4.5 1 1 209 1 . . . . . 3.5 1.8 4.5 1 1 210 1 . . . . . 3.5 1.8 4.5 1 1 211 1 . . . . . 3.5 1.8 3.5 1 1 212 1 . . . . . 5.0 1.8 5.0 1 1 213 1 . . . . . 2.7 1.8 3.7 1 1 214 1 . . . . . 6.0 1.8 6.0 1 1 215 1 . . . . . 5.0 1.8 5.0 1 1 216 1 . . . . . 3.5 1.8 4.5 1 1 217 1 . . . . . 5.0 1.8 6.0 1 1 218 1 . . . . . 5.0 1.8 6.0 1 1 219 1 . . . . . 5.0 1.8 5.0 1 1 220 1 . . . . . 5.0 1.8 5.0 1 1 221 1 . . . . . 5.0 1.8 6.0 1 1 222 1 . . . . . 5.0 1.8 6.0 1 1 223 1 . . . . . 3.5 1.8 3.5 1 1 224 1 . . . . . 3.5 1.8 4.5 1 1 225 1 . . . . . 3.5 1.8 4.5 1 1 226 1 . . . . . 2.7 1.8 2.7 1 1 227 1 . . . . . 3.5 1.8 3.5 1 1 228 1 . . . . . 5.0 1.8 6.0 1 1 229 1 . . . . . 3.5 1.8 4.5 1 1 230 1 . . . . . 2.7 1.8 3.7 1 1 231 1 . . . . . 2.7 1.8 4.7 1 1 232 1 . . . . . 5.0 1.8 6.0 1 1 233 1 . . . . . 3.5 1.8 3.5 1 1 234 1 . . . . . 3.5 1.8 4.5 1 1 235 1 . . . . . 3.5 1.8 4.5 1 1 236 1 . . . . . 5.0 1.8 6.0 1 1 237 1 . . . . . 5.0 1.8 6.0 1 1 238 1 . . . . . 3.5 1.8 4.5 1 1 239 1 . . . . . 2.7 1.8 3.7 1 1 240 1 . . . . . 3.5 1.8 4.5 1 1 241 1 . . . . . 5.0 1.8 6.0 1 1 242 1 . . . . . 6.0 1.8 7.0 1 1 243 1 . . . . . 5.0 1.8 5.0 1 1 244 1 . . . . . 5.0 1.8 6.0 1 1 245 1 . . . . . 5.0 1.8 5.0 1 1 246 1 . . . . . 5.0 1.8 6.0 1 1 247 1 . . . . . 3.5 1.8 5.9 1 1 248 1 . . . . . 5.0 1.8 6.0 1 1 249 1 . . . . . 5.0 1.8 7.4 1 1 250 1 . . . . . 5.0 1.8 5.0 1 1 251 1 . . . . . 5.0 3.3 5.0 1 1 252 1 . . . . . 3.5 1.8 4.5 1 1 253 1 . . . . . 6.0 1.8 7.0 1 1 254 1 . . . . . 3.5 1.8 5.9 1 1 255 1 . . . . . 2.7 1.8 3.7 1 1 256 1 . . . . . 5.0 1.8 6.0 1 1 257 1 . . . . . 5.0 1.8 6.0 1 1 258 1 . . . . . 6.0 1.8 6.0 1 1 259 1 . . . . . 5.0 1.8 5.0 1 1 260 1 . . . . . 2.7 1.8 3.7 1 1 261 1 . . . . . 5.0 1.8 5.0 1 1 262 1 . . . . . 2.7 1.8 2.7 1 1 263 1 . . . . . 5.0 1.8 6.0 1 1 264 1 . . . . . 3.5 1.8 4.5 1 1 265 1 . . . . . 5.0 1.8 6.0 1 1 266 1 . . . . . 3.5 1.8 3.5 1 1 267 1 . . . . . 5.0 1.8 6.0 1 1 268 1 . . . . . 5.0 1.8 5.0 1 1 269 1 . . . . . 5.0 1.8 5.0 1 1 270 1 . . . . . 3.5 1.8 4.5 1 1 271 1 . . . . . 5.0 1.8 7.4 1 1 272 1 . . . . . 5.0 1.8 5.0 1 1 273 1 . . . . . 5.0 1.8 5.0 1 1 274 1 . . . . . 5.0 1.8 5.0 1 1 275 1 . . . . . 5.0 1.8 5.0 1 1 276 1 . . . . . 5.0 1.8 5.0 1 1 277 1 . . . . . 3.5 1.8 4.5 1 1 278 1 . . . . . 5.0 1.8 7.4 1 1 279 1 . . . . . 5.0 1.8 5.0 1 1 280 1 . . . . . 2.7 1.8 2.7 1 1 281 1 . . . . . 3.5 1.8 4.5 1 1 282 1 . . . . . 3.5 1.8 5.9 1 1 283 1 . . . . . 5.0 1.8 7.4 1 1 284 1 . . . . . 3.5 1.8 5.9 1 1 285 1 . . . . . 5.0 1.8 7.4 1 1 286 1 . . . . . 5.0 1.8 7.4 1 1 287 1 . . . . . 5.0 1.8 7.4 1 1 288 1 . . . . . 5.0 1.8 7.4 1 1 289 1 . . . . . 3.5 1.8 4.5 1 1 290 1 . . . . . 2.7 1.8 2.7 1 1 291 1 . . . . . 5.0 1.8 7.4 1 1 292 1 . . . . . 5.0 1.8 5.0 1 1 293 1 . . . . . 2.7 1.8 2.7 1 1 294 1 . . . . . 3.5 1.8 5.9 1 1 295 1 . . . . . 3.5 1.8 5.9 1 1 296 1 . . . . . 3.5 1.8 5.9 1 1 297 1 . . . . . 2.7 1.8 6.1 1 1 298 1 . . . . . 5.0 1.8 9.8 1 1 299 1 . . . . . 5.0 1.8 7.4 1 1 300 1 . . . . . 5.0 1.8 8.4 1 1 301 1 . . . . . 3.5 1.8 3.5 1 1 302 1 . . . . . 3.5 1.8 5.9 1 1 303 1 . . . . . 5.0 1.8 7.4 1 1 304 1 . . . . . 3.5 1.8 3.5 1 1 305 1 . . . . . 5.0 1.8 6.0 1 1 306 1 . . . . . 3.5 1.8 4.5 1 1 307 1 . . . . . 2.7 1.8 3.7 1 1 308 1 . . . . . 2.7 1.8 2.7 1 1 309 1 . . . . . 3.5 1.8 4.5 1 1 310 1 . . . . . 3.5 1.8 4.5 1 1 311 1 . . . . . 5.0 1.8 7.0 1 1 312 1 . . . . . 3.5 1.8 4.5 1 1 313 1 . . . . . 5.0 1.8 7.0 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type "disulfide bond" _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 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 2 CYS SG . 2 . SG 1 2 1 1 2 1 1 17 CYS SG . 17 . SG 1 2 2 1 1 1 1 2 CYS SG . 2 . SG 1 2 2 1 2 1 1 17 CYS CB . 17 . CB 1 2 3 1 1 1 1 2 CYS CB . 2 . CB 1 2 3 1 2 1 1 17 CYS SG . 17 . SG 1 2 4 1 1 1 1 9 CYS SG . 9 . SG 1 2 4 1 2 1 1 22 CYS SG . 22 . SG 1 2 5 1 1 1 1 9 CYS SG . 9 . SG 1 2 5 1 2 1 1 22 CYS CB . 22 . CB 1 2 6 1 1 1 1 9 CYS CB . 9 . CB 1 2 6 1 2 1 1 22 CYS SG . 22 . SG 1 2 7 1 1 1 1 16 CYS SG . 16 . SG 1 2 7 1 2 1 1 29 CYS SG . 29 . SG 1 2 8 1 1 1 1 16 CYS SG . 16 . SG 1 2 8 1 2 1 1 29 CYS CB . 29 . CB 1 2 9 1 1 1 1 16 CYS CB . 16 . CB 1 2 9 1 2 1 1 29 CYS SG . 29 . SG 1 2 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 . . . . . 2.02 2.0 2.04 1 2 2 1 . . . . . 2.99 2.49 3.49 1 2 3 1 . . . . . 2.99 2.49 3.49 1 2 4 1 . . . . . 2.02 2.0 2.04 1 2 5 1 . . . . . 2.99 2.49 3.49 1 2 6 1 . . . . . 2.99 2.49 3.49 1 2 7 1 . . . . . 2.02 2.0 2.04 1 2 8 1 . . . . . 2.99 2.49 3.49 1 2 9 1 . . . . . 2.99 2.49 3.49 1 2 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 9.846 4.661 4.189 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 11.322 4.511 3.814 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 13.044 5.672 3.983 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H 11.714 6.276 4.852 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H 11.774 6.438 3.161 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H 11.402 4.180 2.788 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H 11.783 3.784 4.464 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N 12.016 5.824 3.963 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O 9.361 4.009 5.096 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 CYS C C 6.824 5.368 2.585 1.00 . A A . 2 CYS C 1 1 1 11 1 1 2 CYS CA C 7.680 5.708 3.811 1.00 . A A . 2 CYS CA 1 1 1 12 1 1 2 CYS CB C 7.540 7.188 4.181 1.00 . A A . 2 CYS CB 1 1 1 13 1 1 2 CYS H H 9.544 6.026 2.774 1.00 . A A . 2 CYS H 1 1 1 14 1 1 2 CYS HA H 7.391 5.093 4.649 1.00 . A A . 2 CYS HA 1 1 1 15 1 1 2 CYS HB2 H 8.491 7.684 4.048 1.00 . A A . 2 CYS HB2 1 1 1 16 1 1 2 CYS HB3 H 6.800 7.651 3.547 1.00 . A A . 2 CYS HB3 1 1 1 17 1 1 2 CYS N N 9.128 5.514 3.499 1.00 . A A . 2 CYS N 1 1 1 18 1 1 2 CYS O O 6.920 6.007 1.552 1.00 . A A . 2 CYS O 1 1 1 19 1 1 2 CYS SG S 7.024 7.326 5.911 1.00 . A A . 2 CYS SG 1 1 1 20 1 1 3 GLY C C 3.896 4.863 1.481 1.00 . A A . 3 GLY C 1 1 1 21 1 1 3 GLY CA C 5.130 3.960 1.546 1.00 . A A . 3 GLY CA 1 1 1 22 1 1 3 GLY H H 5.942 3.863 3.537 1.00 . A A . 3 GLY H 1 1 1 23 1 1 3 GLY HA2 H 5.690 4.052 0.626 1.00 . A A . 3 GLY HA2 1 1 1 24 1 1 3 GLY HA3 H 4.815 2.936 1.674 1.00 . A A . 3 GLY HA3 1 1 1 25 1 1 3 GLY N N 5.994 4.361 2.695 1.00 . A A . 3 GLY N 1 1 1 26 1 1 3 GLY O O 3.072 4.868 2.376 1.00 . A A . 3 GLY O 1 1 1 27 1 1 4 GLY C C 1.561 5.889 -0.655 1.00 . A A . 4 GLY C 1 1 1 28 1 1 4 GLY CA C 2.583 6.527 0.288 1.00 . A A . 4 GLY CA 1 1 1 29 1 1 4 GLY H H 4.440 5.593 -0.284 1.00 . A A . 4 GLY H 1 1 1 30 1 1 4 GLY HA2 H 2.134 6.683 1.258 1.00 . A A . 4 GLY HA2 1 1 1 31 1 1 4 GLY HA3 H 2.901 7.474 -0.120 1.00 . A A . 4 GLY HA3 1 1 1 32 1 1 4 GLY N N 3.763 5.622 0.425 1.00 . A A . 4 GLY N 1 1 1 33 1 1 4 GLY O O 0.833 4.992 -0.275 1.00 . A A . 4 GLY O 1 1 1 34 1 1 5 LEU C C 1.232 4.830 -3.857 1.00 . A A . 5 LEU C 1 1 1 35 1 1 5 LEU CA C 0.529 5.764 -2.858 1.00 . A A . 5 LEU CA 1 1 1 36 1 1 5 LEU CB C -0.078 6.966 -3.581 1.00 . A A . 5 LEU CB 1 1 1 37 1 1 5 LEU CD1 C -2.064 8.482 -3.610 1.00 . A A . 5 LEU CD1 1 1 1 38 1 1 5 LEU CD2 C -2.375 6.010 -3.832 1.00 . A A . 5 LEU CD2 1 1 1 39 1 1 5 LEU CG C -1.543 7.114 -3.168 1.00 . A A . 5 LEU CG 1 1 1 40 1 1 5 LEU H H 2.103 7.067 -2.164 1.00 . A A . 5 LEU H 1 1 1 41 1 1 5 LEU HA H -0.245 5.226 -2.333 1.00 . A A . 5 LEU HA 1 1 1 42 1 1 5 LEU HB2 H 0.465 7.862 -3.313 1.00 . A A . 5 LEU HB2 1 1 1 43 1 1 5 LEU HB3 H -0.020 6.814 -4.648 1.00 . A A . 5 LEU HB3 1 1 1 44 1 1 5 LEU HD11 H -1.319 9.234 -3.394 1.00 . A A . 5 LEU HD11 1 1 1 45 1 1 5 LEU HD12 H -2.972 8.711 -3.074 1.00 . A A . 5 LEU HD12 1 1 1 46 1 1 5 LEU HD13 H -2.263 8.466 -4.670 1.00 . A A . 5 LEU HD13 1 1 1 47 1 1 5 LEU HD21 H -3.274 5.843 -3.257 1.00 . A A . 5 LEU HD21 1 1 1 48 1 1 5 LEU HD22 H -1.798 5.098 -3.870 1.00 . A A . 5 LEU HD22 1 1 1 49 1 1 5 LEU HD23 H -2.638 6.312 -4.835 1.00 . A A . 5 LEU HD23 1 1 1 50 1 1 5 LEU HG H -1.624 7.028 -2.094 1.00 . A A . 5 LEU HG 1 1 1 51 1 1 5 LEU N N 1.504 6.344 -1.882 1.00 . A A . 5 LEU N 1 1 1 52 1 1 5 LEU O O 0.588 4.188 -4.665 1.00 . A A . 5 LEU O 1 1 1 53 1 1 6 MET C C 4.460 3.182 -4.035 1.00 . A A . 6 MET C 1 1 1 54 1 1 6 MET CA C 3.270 3.835 -4.749 1.00 . A A . 6 MET CA 1 1 1 55 1 1 6 MET CB C 3.739 4.742 -5.890 1.00 . A A . 6 MET CB 1 1 1 56 1 1 6 MET CE C 1.698 5.640 -8.190 1.00 . A A . 6 MET CE 1 1 1 57 1 1 6 MET CG C 3.626 3.989 -7.218 1.00 . A A . 6 MET CG 1 1 1 58 1 1 6 MET H H 3.045 5.256 -3.144 1.00 . A A . 6 MET H 1 1 1 59 1 1 6 MET HA H 2.605 3.078 -5.132 1.00 . A A . 6 MET HA 1 1 1 60 1 1 6 MET HB2 H 3.122 5.627 -5.924 1.00 . A A . 6 MET HB2 1 1 1 61 1 1 6 MET HB3 H 4.768 5.026 -5.727 1.00 . A A . 6 MET HB3 1 1 1 62 1 1 6 MET HE1 H 1.101 5.705 -9.090 1.00 . A A . 6 MET HE1 1 1 1 63 1 1 6 MET HE2 H 2.667 6.074 -8.372 1.00 . A A . 6 MET HE2 1 1 1 64 1 1 6 MET HE3 H 1.210 6.177 -7.388 1.00 . A A . 6 MET HE3 1 1 1 65 1 1 6 MET HG2 H 4.194 4.508 -7.976 1.00 . A A . 6 MET HG2 1 1 1 66 1 1 6 MET HG3 H 4.016 2.988 -7.099 1.00 . A A . 6 MET HG3 1 1 1 67 1 1 6 MET N N 2.541 4.739 -3.807 1.00 . A A . 6 MET N 1 1 1 68 1 1 6 MET O O 5.565 3.150 -4.545 1.00 . A A . 6 MET O 1 1 1 69 1 1 6 MET SD S 1.888 3.902 -7.719 1.00 . A A . 6 MET SD 1 1 1 70 1 1 7 ALA C C 5.635 0.608 -2.686 1.00 . A A . 7 ALA C 1 1 1 71 1 1 7 ALA CA C 5.337 1.992 -2.095 1.00 . A A . 7 ALA CA 1 1 1 72 1 1 7 ALA CB C 4.814 1.877 -0.662 1.00 . A A . 7 ALA CB 1 1 1 73 1 1 7 ALA H H 3.328 2.694 -2.475 1.00 . A A . 7 ALA H 1 1 1 74 1 1 7 ALA HA H 6.228 2.596 -2.110 1.00 . A A . 7 ALA HA 1 1 1 75 1 1 7 ALA HB1 H 4.290 0.940 -0.542 1.00 . A A . 7 ALA HB1 1 1 1 76 1 1 7 ALA HB2 H 4.139 2.696 -0.458 1.00 . A A . 7 ALA HB2 1 1 1 77 1 1 7 ALA HB3 H 5.643 1.916 0.030 1.00 . A A . 7 ALA HB3 1 1 1 78 1 1 7 ALA N N 4.233 2.656 -2.858 1.00 . A A . 7 ALA N 1 1 1 79 1 1 7 ALA O O 5.351 0.341 -3.837 1.00 . A A . 7 ALA O 1 1 1 80 1 1 8 GLY C C 5.820 -2.690 -1.611 1.00 . A A . 8 GLY C 1 1 1 81 1 1 8 GLY CA C 6.556 -1.623 -2.427 1.00 . A A . 8 GLY CA 1 1 1 82 1 1 8 GLY H H 6.460 -0.012 -0.994 1.00 . A A . 8 GLY H 1 1 1 83 1 1 8 GLY HA2 H 6.259 -1.697 -3.464 1.00 . A A . 8 GLY HA2 1 1 1 84 1 1 8 GLY HA3 H 7.619 -1.786 -2.348 1.00 . A A . 8 GLY HA3 1 1 1 85 1 1 8 GLY N N 6.225 -0.261 -1.912 1.00 . A A . 8 GLY N 1 1 1 86 1 1 8 GLY O O 6.044 -2.838 -0.424 1.00 . A A . 8 GLY O 1 1 1 87 1 1 9 CYS C C 4.800 -5.900 -1.873 1.00 . A A . 9 CYS C 1 1 1 88 1 1 9 CYS CA C 4.214 -4.524 -1.523 1.00 . A A . 9 CYS CA 1 1 1 89 1 1 9 CYS CB C 2.769 -4.414 -2.015 1.00 . A A . 9 CYS CB 1 1 1 90 1 1 9 CYS H H 4.808 -3.313 -3.208 1.00 . A A . 9 CYS H 1 1 1 91 1 1 9 CYS HA H 4.255 -4.358 -0.458 1.00 . A A . 9 CYS HA 1 1 1 92 1 1 9 CYS HB2 H 2.581 -3.409 -2.358 1.00 . A A . 9 CYS HB2 1 1 1 93 1 1 9 CYS HB3 H 2.611 -5.107 -2.828 1.00 . A A . 9 CYS HB3 1 1 1 94 1 1 9 CYS N N 4.958 -3.446 -2.248 1.00 . A A . 9 CYS N 1 1 1 95 1 1 9 CYS O O 4.132 -6.913 -1.769 1.00 . A A . 9 CYS O 1 1 1 96 1 1 9 CYS SG S 1.639 -4.807 -0.658 1.00 . A A . 9 CYS SG 1 1 1 97 1 1 10 ASP C C 6.903 -8.101 -1.381 1.00 . A A . 10 ASP C 1 1 1 98 1 1 10 ASP CA C 6.683 -7.250 -2.638 1.00 . A A . 10 ASP CA 1 1 1 99 1 1 10 ASP CB C 8.025 -6.884 -3.279 1.00 . A A . 10 ASP CB 1 1 1 100 1 1 10 ASP CG C 8.736 -8.159 -3.740 1.00 . A A . 10 ASP CG 1 1 1 101 1 1 10 ASP H H 6.563 -5.114 -2.354 1.00 . A A . 10 ASP H 1 1 1 102 1 1 10 ASP HA H 6.071 -7.782 -3.347 1.00 . A A . 10 ASP HA 1 1 1 103 1 1 10 ASP HB2 H 7.854 -6.238 -4.127 1.00 . A A . 10 ASP HB2 1 1 1 104 1 1 10 ASP HB3 H 8.642 -6.372 -2.555 1.00 . A A . 10 ASP HB3 1 1 1 105 1 1 10 ASP N N 6.047 -5.943 -2.283 1.00 . A A . 10 ASP N 1 1 1 106 1 1 10 ASP O O 6.898 -9.316 -1.439 1.00 . A A . 10 ASP O 1 1 1 107 1 1 10 ASP OD1 O 8.354 -8.686 -4.773 1.00 . A A . 10 ASP OD1 1 1 1 108 1 1 10 ASP OD2 O 9.646 -8.590 -3.050 1.00 . A A . 10 ASP OD2 1 1 1 109 1 1 11 GLY C C 5.995 -8.887 1.476 1.00 . A A . 11 GLY C 1 1 1 110 1 1 11 GLY CA C 7.307 -8.231 1.019 1.00 . A A . 11 GLY CA 1 1 1 111 1 1 11 GLY H H 7.089 -6.490 -0.229 1.00 . A A . 11 GLY H 1 1 1 112 1 1 11 GLY HA2 H 8.053 -8.994 0.854 1.00 . A A . 11 GLY HA2 1 1 1 113 1 1 11 GLY HA3 H 7.650 -7.555 1.787 1.00 . A A . 11 GLY HA3 1 1 1 114 1 1 11 GLY N N 7.092 -7.468 -0.247 1.00 . A A . 11 GLY N 1 1 1 115 1 1 11 GLY O O 6.005 -9.738 2.341 1.00 . A A . 11 GLY O 1 1 1 116 1 1 12 LYS C C 3.186 -8.710 2.758 1.00 . A A . 12 LYS C 1 1 1 117 1 1 12 LYS CA C 3.543 -9.068 1.300 1.00 . A A . 12 LYS CA 1 1 1 118 1 1 12 LYS CB C 3.680 -10.593 1.085 1.00 . A A . 12 LYS CB 1 1 1 119 1 1 12 LYS CD C 4.426 -12.688 2.241 1.00 . A A . 12 LYS CD 1 1 1 120 1 1 12 LYS CE C 5.228 -13.024 3.502 1.00 . A A . 12 LYS CE 1 1 1 121 1 1 12 LYS CG C 3.725 -11.340 2.427 1.00 . A A . 12 LYS CG 1 1 1 122 1 1 12 LYS H H 4.898 -7.793 0.223 1.00 . A A . 12 LYS H 1 1 1 123 1 1 12 LYS HA H 2.778 -8.686 0.642 1.00 . A A . 12 LYS HA 1 1 1 124 1 1 12 LYS HB2 H 2.835 -10.946 0.513 1.00 . A A . 12 LYS HB2 1 1 1 125 1 1 12 LYS HB3 H 4.587 -10.795 0.536 1.00 . A A . 12 LYS HB3 1 1 1 126 1 1 12 LYS HD2 H 3.687 -13.457 2.067 1.00 . A A . 12 LYS HD2 1 1 1 127 1 1 12 LYS HD3 H 5.095 -12.634 1.396 1.00 . A A . 12 LYS HD3 1 1 1 128 1 1 12 LYS HE2 H 4.746 -12.604 4.375 1.00 . A A . 12 LYS HE2 1 1 1 129 1 1 12 LYS HE3 H 5.333 -14.092 3.608 1.00 . A A . 12 LYS HE3 1 1 1 130 1 1 12 LYS HG2 H 4.267 -10.749 3.150 1.00 . A A . 12 LYS HG2 1 1 1 131 1 1 12 LYS HG3 H 2.719 -11.505 2.778 1.00 . A A . 12 LYS HG3 1 1 1 132 1 1 12 LYS HZ1 H 7.180 -13.052 2.771 1.00 . A A . 12 LYS HZ1 1 1 1 133 1 1 12 LYS HZ2 H 6.996 -12.188 4.222 1.00 . A A . 12 LYS HZ2 1 1 1 134 1 1 12 LYS HZ3 H 6.463 -11.514 2.757 1.00 . A A . 12 LYS HZ3 1 1 1 135 1 1 12 LYS N N 4.871 -8.487 0.909 1.00 . A A . 12 LYS N 1 1 1 136 1 1 12 LYS NZ N 6.567 -12.396 3.297 1.00 . A A . 12 LYS NZ 1 1 1 137 1 1 12 LYS O O 2.232 -9.223 3.315 1.00 . A A . 12 LYS O 1 1 1 138 1 1 13 SER C C 4.276 -6.087 5.133 1.00 . A A . 13 SER C 1 1 1 139 1 1 13 SER CA C 3.637 -7.443 4.791 1.00 . A A . 13 SER CA 1 1 1 140 1 1 13 SER CB C 4.244 -8.562 5.642 1.00 . A A . 13 SER CB 1 1 1 141 1 1 13 SER H H 4.696 -7.415 2.915 1.00 . A A . 13 SER H 1 1 1 142 1 1 13 SER HA H 2.570 -7.402 4.949 1.00 . A A . 13 SER HA 1 1 1 143 1 1 13 SER HB2 H 4.072 -8.358 6.685 1.00 . A A . 13 SER HB2 1 1 1 144 1 1 13 SER HB3 H 3.777 -9.503 5.381 1.00 . A A . 13 SER HB3 1 1 1 145 1 1 13 SER HG H 5.805 -9.348 4.782 1.00 . A A . 13 SER HG 1 1 1 146 1 1 13 SER N N 3.938 -7.827 3.378 1.00 . A A . 13 SER N 1 1 1 147 1 1 13 SER O O 4.739 -5.871 6.238 1.00 . A A . 13 SER O 1 1 1 148 1 1 13 SER OG O 5.646 -8.633 5.404 1.00 . A A . 13 SER OG 1 1 1 149 1 1 14 THR C C 3.937 -2.978 5.318 1.00 . A A . 14 THR C 1 1 1 150 1 1 14 THR CA C 4.900 -3.827 4.469 1.00 . A A . 14 THR CA 1 1 1 151 1 1 14 THR CB C 5.132 -3.194 3.084 1.00 . A A . 14 THR CB 1 1 1 152 1 1 14 THR CG2 C 3.792 -2.874 2.417 1.00 . A A . 14 THR CG2 1 1 1 153 1 1 14 THR H H 3.913 -5.364 3.314 1.00 . A A . 14 THR H 1 1 1 154 1 1 14 THR HA H 5.844 -3.941 4.980 1.00 . A A . 14 THR HA 1 1 1 155 1 1 14 THR HB H 5.680 -3.887 2.459 1.00 . A A . 14 THR HB 1 1 1 156 1 1 14 THR HG1 H 6.810 -2.213 3.106 1.00 . A A . 14 THR HG1 1 1 1 157 1 1 14 THR HG21 H 3.133 -2.406 3.133 1.00 . A A . 14 THR HG21 1 1 1 158 1 1 14 THR HG22 H 3.341 -3.788 2.056 1.00 . A A . 14 THR HG22 1 1 1 159 1 1 14 THR HG23 H 3.955 -2.202 1.586 1.00 . A A . 14 THR HG23 1 1 1 160 1 1 14 THR N N 4.298 -5.170 4.195 1.00 . A A . 14 THR N 1 1 1 161 1 1 14 THR O O 2.769 -3.298 5.449 1.00 . A A . 14 THR O 1 1 1 162 1 1 14 THR OG1 O 5.884 -1.998 3.231 1.00 . A A . 14 THR OG1 1 1 1 163 1 1 15 PHE C C 3.350 0.354 6.109 1.00 . A A . 15 PHE C 1 1 1 164 1 1 15 PHE CA C 3.530 -1.037 6.741 1.00 . A A . 15 PHE CA 1 1 1 165 1 1 15 PHE CB C 4.255 -0.925 8.089 1.00 . A A . 15 PHE CB 1 1 1 166 1 1 15 PHE CD1 C 2.020 -0.711 9.259 1.00 . A A . 15 PHE CD1 1 1 1 167 1 1 15 PHE CD2 C 3.831 0.759 9.925 1.00 . A A . 15 PHE CD2 1 1 1 168 1 1 15 PHE CE1 C 1.184 -0.110 10.207 1.00 . A A . 15 PHE CE1 1 1 1 169 1 1 15 PHE CE2 C 2.993 1.359 10.874 1.00 . A A . 15 PHE CE2 1 1 1 170 1 1 15 PHE CG C 3.345 -0.277 9.116 1.00 . A A . 15 PHE CG 1 1 1 171 1 1 15 PHE CZ C 1.670 0.925 11.014 1.00 . A A . 15 PHE CZ 1 1 1 172 1 1 15 PHE H H 5.362 -1.666 5.781 1.00 . A A . 15 PHE H 1 1 1 173 1 1 15 PHE HA H 2.570 -1.509 6.882 1.00 . A A . 15 PHE HA 1 1 1 174 1 1 15 PHE HB2 H 4.533 -1.911 8.430 1.00 . A A . 15 PHE HB2 1 1 1 175 1 1 15 PHE HB3 H 5.143 -0.323 7.969 1.00 . A A . 15 PHE HB3 1 1 1 176 1 1 15 PHE HD1 H 1.643 -1.509 8.636 1.00 . A A . 15 PHE HD1 1 1 1 177 1 1 15 PHE HD2 H 4.852 1.095 9.818 1.00 . A A . 15 PHE HD2 1 1 1 178 1 1 15 PHE HE1 H 0.162 -0.445 10.316 1.00 . A A . 15 PHE HE1 1 1 1 179 1 1 15 PHE HE2 H 3.368 2.157 11.497 1.00 . A A . 15 PHE HE2 1 1 1 180 1 1 15 PHE HZ H 1.024 1.388 11.746 1.00 . A A . 15 PHE HZ 1 1 1 181 1 1 15 PHE N N 4.417 -1.904 5.898 1.00 . A A . 15 PHE N 1 1 1 182 1 1 15 PHE O O 2.790 1.246 6.721 1.00 . A A . 15 PHE O 1 1 1 183 1 1 16 CYS C C 4.180 3.003 5.147 1.00 . A A . 16 CYS C 1 1 1 184 1 1 16 CYS CA C 3.676 1.880 4.219 1.00 . A A . 16 CYS CA 1 1 1 185 1 1 16 CYS CB C 2.175 2.029 3.925 1.00 . A A . 16 CYS CB 1 1 1 186 1 1 16 CYS H H 4.260 -0.182 4.417 1.00 . A A . 16 CYS H 1 1 1 187 1 1 16 CYS HA H 4.231 1.887 3.294 1.00 . A A . 16 CYS HA 1 1 1 188 1 1 16 CYS HB2 H 1.650 2.259 4.840 1.00 . A A . 16 CYS HB2 1 1 1 189 1 1 16 CYS HB3 H 2.028 2.832 3.217 1.00 . A A . 16 CYS HB3 1 1 1 190 1 1 16 CYS N N 3.817 0.549 4.892 1.00 . A A . 16 CYS N 1 1 1 191 1 1 16 CYS O O 5.036 2.783 5.985 1.00 . A A . 16 CYS O 1 1 1 192 1 1 16 CYS SG S 1.524 0.485 3.229 1.00 . A A . 16 CYS SG 1 1 1 193 1 1 17 CYS C C 3.083 5.599 6.973 1.00 . A A . 17 CYS C 1 1 1 194 1 1 17 CYS CA C 4.123 5.324 5.878 1.00 . A A . 17 CYS CA 1 1 1 195 1 1 17 CYS CB C 4.271 6.526 4.938 1.00 . A A . 17 CYS CB 1 1 1 196 1 1 17 CYS H H 2.982 4.362 4.320 1.00 . A A . 17 CYS H 1 1 1 197 1 1 17 CYS HA H 5.074 5.089 6.322 1.00 . A A . 17 CYS HA 1 1 1 198 1 1 17 CYS HB2 H 4.866 6.242 4.082 1.00 . A A . 17 CYS HB2 1 1 1 199 1 1 17 CYS HB3 H 3.295 6.845 4.603 1.00 . A A . 17 CYS HB3 1 1 1 200 1 1 17 CYS N N 3.666 4.201 5.004 1.00 . A A . 17 CYS N 1 1 1 201 1 1 17 CYS O O 3.292 5.277 8.128 1.00 . A A . 17 CYS O 1 1 1 202 1 1 17 CYS SG S 5.085 7.887 5.812 1.00 . A A . 17 CYS SG 1 1 1 203 1 1 18 SER C C -0.444 6.680 6.927 1.00 . A A . 18 SER C 1 1 1 204 1 1 18 SER CA C 0.904 6.477 7.626 1.00 . A A . 18 SER CA 1 1 1 205 1 1 18 SER CB C 1.351 7.765 8.320 1.00 . A A . 18 SER CB 1 1 1 206 1 1 18 SER H H 1.827 6.424 5.680 1.00 . A A . 18 SER H 1 1 1 207 1 1 18 SER HA H 0.838 5.675 8.345 1.00 . A A . 18 SER HA 1 1 1 208 1 1 18 SER HB2 H 2.423 7.772 8.414 1.00 . A A . 18 SER HB2 1 1 1 209 1 1 18 SER HB3 H 1.037 8.618 7.731 1.00 . A A . 18 SER HB3 1 1 1 210 1 1 18 SER HG H 0.097 8.514 9.608 1.00 . A A . 18 SER HG 1 1 1 211 1 1 18 SER N N 1.967 6.183 6.616 1.00 . A A . 18 SER N 1 1 1 212 1 1 18 SER O O -0.629 7.620 6.176 1.00 . A A . 18 SER O 1 1 1 213 1 1 18 SER OG O 0.768 7.826 9.616 1.00 . A A . 18 SER OG 1 1 1 214 1 1 19 GLY C C -2.657 5.419 5.079 1.00 . A A . 19 GLY C 1 1 1 215 1 1 19 GLY CA C -2.726 5.934 6.520 1.00 . A A . 19 GLY CA 1 1 1 216 1 1 19 GLY H H -1.212 5.053 7.776 1.00 . A A . 19 GLY H 1 1 1 217 1 1 19 GLY HA2 H -3.451 5.357 7.075 1.00 . A A . 19 GLY HA2 1 1 1 218 1 1 19 GLY HA3 H -3.022 6.972 6.513 1.00 . A A . 19 GLY HA3 1 1 1 219 1 1 19 GLY N N -1.386 5.803 7.168 1.00 . A A . 19 GLY N 1 1 1 220 1 1 19 GLY O O -3.159 6.047 4.165 1.00 . A A . 19 GLY O 1 1 1 221 1 1 20 TYR C C -2.014 2.186 3.533 1.00 . A A . 20 TYR C 1 1 1 222 1 1 20 TYR CA C -1.933 3.717 3.487 1.00 . A A . 20 TYR CA 1 1 1 223 1 1 20 TYR CB C -0.551 4.149 2.980 1.00 . A A . 20 TYR CB 1 1 1 224 1 1 20 TYR CD1 C -1.417 6.113 1.650 1.00 . A A . 20 TYR CD1 1 1 1 225 1 1 20 TYR CD2 C 0.285 6.497 3.334 1.00 . A A . 20 TYR CD2 1 1 1 226 1 1 20 TYR CE1 C -1.424 7.478 1.346 1.00 . A A . 20 TYR CE1 1 1 1 227 1 1 20 TYR CE2 C 0.278 7.862 3.029 1.00 . A A . 20 TYR CE2 1 1 1 228 1 1 20 TYR CG C -0.562 5.622 2.646 1.00 . A A . 20 TYR CG 1 1 1 229 1 1 20 TYR CZ C -0.577 8.354 2.035 1.00 . A A . 20 TYR CZ 1 1 1 230 1 1 20 TYR H H -1.645 3.794 5.625 1.00 . A A . 20 TYR H 1 1 1 231 1 1 20 TYR HA H -2.708 4.123 2.848 1.00 . A A . 20 TYR HA 1 1 1 232 1 1 20 TYR HB2 H 0.188 3.961 3.746 1.00 . A A . 20 TYR HB2 1 1 1 233 1 1 20 TYR HB3 H -0.299 3.582 2.096 1.00 . A A . 20 TYR HB3 1 1 1 234 1 1 20 TYR HD1 H -2.070 5.438 1.119 1.00 . A A . 20 TYR HD1 1 1 1 235 1 1 20 TYR HD2 H 0.944 6.117 4.098 1.00 . A A . 20 TYR HD2 1 1 1 236 1 1 20 TYR HE1 H -2.082 7.856 0.579 1.00 . A A . 20 TYR HE1 1 1 1 237 1 1 20 TYR HE2 H 0.933 8.536 3.561 1.00 . A A . 20 TYR HE2 1 1 1 238 1 1 20 TYR HH H -1.083 10.154 2.419 1.00 . A A . 20 TYR HH 1 1 1 239 1 1 20 TYR N N -2.040 4.280 4.870 1.00 . A A . 20 TYR N 1 1 1 240 1 1 20 TYR O O -1.192 1.533 4.149 1.00 . A A . 20 TYR O 1 1 1 241 1 1 20 TYR OH O -0.585 9.701 1.736 1.00 . A A . 20 TYR OH 1 1 1 242 1 1 21 ASN C C -2.324 -0.443 1.670 1.00 . A A . 21 ASN C 1 1 1 243 1 1 21 ASN CA C -3.106 0.120 2.860 1.00 . A A . 21 ASN CA 1 1 1 244 1 1 21 ASN CB C -4.605 -0.159 2.713 1.00 . A A . 21 ASN CB 1 1 1 245 1 1 21 ASN CG C -4.841 -1.664 2.561 1.00 . A A . 21 ASN CG 1 1 1 246 1 1 21 ASN H H -3.628 2.157 2.373 1.00 . A A . 21 ASN H 1 1 1 247 1 1 21 ASN HA H -2.738 -0.294 3.784 1.00 . A A . 21 ASN HA 1 1 1 248 1 1 21 ASN HB2 H -5.125 0.200 3.589 1.00 . A A . 21 ASN HB2 1 1 1 249 1 1 21 ASN HB3 H -4.981 0.351 1.838 1.00 . A A . 21 ASN HB3 1 1 1 250 1 1 21 ASN HD21 H -5.447 -1.525 0.674 1.00 . A A . 21 ASN HD21 1 1 1 251 1 1 21 ASN HD22 H -5.430 -3.096 1.317 1.00 . A A . 21 ASN HD22 1 1 1 252 1 1 21 ASN N N -2.985 1.610 2.873 1.00 . A A . 21 ASN N 1 1 1 253 1 1 21 ASN ND2 N -5.275 -2.134 1.423 1.00 . A A . 21 ASN ND2 1 1 1 254 1 1 21 ASN O O -2.167 0.215 0.665 1.00 . A A . 21 ASN O 1 1 1 255 1 1 21 ASN OD1 O -4.628 -2.422 3.488 1.00 . A A . 21 ASN OD1 1 1 1 256 1 1 22 CYS C C -1.973 -2.959 -0.343 1.00 . A A . 22 CYS C 1 1 1 257 1 1 22 CYS CA C -1.048 -2.226 0.633 1.00 . A A . 22 CYS CA 1 1 1 258 1 1 22 CYS CB C -0.055 -3.200 1.267 1.00 . A A . 22 CYS CB 1 1 1 259 1 1 22 CYS H H -1.960 -2.168 2.593 1.00 . A A . 22 CYS H 1 1 1 260 1 1 22 CYS HA H -0.513 -1.447 0.119 1.00 . A A . 22 CYS HA 1 1 1 261 1 1 22 CYS HB2 H 0.089 -2.943 2.305 1.00 . A A . 22 CYS HB2 1 1 1 262 1 1 22 CYS HB3 H -0.437 -4.207 1.193 1.00 . A A . 22 CYS HB3 1 1 1 263 1 1 22 CYS N N -1.827 -1.649 1.772 1.00 . A A . 22 CYS N 1 1 1 264 1 1 22 CYS O O -2.923 -3.611 0.052 1.00 . A A . 22 CYS O 1 1 1 265 1 1 22 CYS SG S 1.524 -3.088 0.393 1.00 . A A . 22 CYS SG 1 1 1 266 1 1 23 SER C C -1.775 -4.676 -3.299 1.00 . A A . 23 SER C 1 1 1 267 1 1 23 SER CA C -2.546 -3.521 -2.645 1.00 . A A . 23 SER CA 1 1 1 268 1 1 23 SER CB C -2.851 -2.434 -3.677 1.00 . A A . 23 SER CB 1 1 1 269 1 1 23 SER H H -0.925 -2.311 -1.902 1.00 . A A . 23 SER H 1 1 1 270 1 1 23 SER HA H -3.462 -3.876 -2.203 1.00 . A A . 23 SER HA 1 1 1 271 1 1 23 SER HB2 H -2.113 -1.651 -3.610 1.00 . A A . 23 SER HB2 1 1 1 272 1 1 23 SER HB3 H -2.826 -2.864 -4.668 1.00 . A A . 23 SER HB3 1 1 1 273 1 1 23 SER HG H -4.748 -2.240 -4.064 1.00 . A A . 23 SER HG 1 1 1 274 1 1 23 SER N N -1.696 -2.846 -1.619 1.00 . A A . 23 SER N 1 1 1 275 1 1 23 SER O O -0.672 -4.489 -3.773 1.00 . A A . 23 SER O 1 1 1 276 1 1 23 SER OG O -4.138 -1.886 -3.415 1.00 . A A . 23 SER OG 1 1 1 277 1 1 24 PRO C C -1.801 -6.976 -5.443 1.00 . A A . 24 PRO C 1 1 1 278 1 1 24 PRO CA C -1.752 -7.039 -3.908 1.00 . A A . 24 PRO CA 1 1 1 279 1 1 24 PRO CB C -2.600 -8.196 -3.385 1.00 . A A . 24 PRO CB 1 1 1 280 1 1 24 PRO CD C -3.715 -6.142 -2.746 1.00 . A A . 24 PRO CD 1 1 1 281 1 1 24 PRO CG C -3.936 -7.597 -3.073 1.00 . A A . 24 PRO CG 1 1 1 282 1 1 24 PRO HA H -0.738 -7.143 -3.566 1.00 . A A . 24 PRO HA 1 1 1 283 1 1 24 PRO HB2 H -2.697 -8.961 -4.143 1.00 . A A . 24 PRO HB2 1 1 1 284 1 1 24 PRO HB3 H -2.162 -8.606 -2.489 1.00 . A A . 24 PRO HB3 1 1 1 285 1 1 24 PRO HD2 H -4.475 -5.530 -3.215 1.00 . A A . 24 PRO HD2 1 1 1 286 1 1 24 PRO HD3 H -3.713 -5.991 -1.677 1.00 . A A . 24 PRO HD3 1 1 1 287 1 1 24 PRO HG2 H -4.588 -7.688 -3.930 1.00 . A A . 24 PRO HG2 1 1 1 288 1 1 24 PRO HG3 H -4.373 -8.097 -2.222 1.00 . A A . 24 PRO HG3 1 1 1 289 1 1 24 PRO N N -2.389 -5.839 -3.302 1.00 . A A . 24 PRO N 1 1 1 290 1 1 24 PRO O O -0.924 -7.483 -6.117 1.00 . A A . 24 PRO O 1 1 1 291 1 1 25 THR C C -1.980 -5.187 -8.031 1.00 . A A . 25 THR C 1 1 1 292 1 1 25 THR CA C -2.930 -6.263 -7.484 1.00 . A A . 25 THR CA 1 1 1 293 1 1 25 THR CB C -4.391 -5.873 -7.746 1.00 . A A . 25 THR CB 1 1 1 294 1 1 25 THR CG2 C -4.681 -5.912 -9.250 1.00 . A A . 25 THR CG2 1 1 1 295 1 1 25 THR H H -3.509 -5.961 -5.427 1.00 . A A . 25 THR H 1 1 1 296 1 1 25 THR HA H -2.717 -7.216 -7.939 1.00 . A A . 25 THR HA 1 1 1 297 1 1 25 THR HB H -4.566 -4.874 -7.378 1.00 . A A . 25 THR HB 1 1 1 298 1 1 25 THR HG1 H -5.716 -6.301 -6.387 1.00 . A A . 25 THR HG1 1 1 1 299 1 1 25 THR HG21 H -5.444 -6.650 -9.450 1.00 . A A . 25 THR HG21 1 1 1 300 1 1 25 THR HG22 H -3.780 -6.172 -9.786 1.00 . A A . 25 THR HG22 1 1 1 301 1 1 25 THR HG23 H -5.026 -4.942 -9.573 1.00 . A A . 25 THR HG23 1 1 1 302 1 1 25 THR N N -2.817 -6.361 -5.994 1.00 . A A . 25 THR N 1 1 1 303 1 1 25 THR O O -1.517 -5.273 -9.153 1.00 . A A . 25 THR O 1 1 1 304 1 1 25 THR OG1 O -5.251 -6.783 -7.074 1.00 . A A . 25 THR OG1 1 1 1 305 1 1 26 TRP C C 0.634 -3.262 -7.156 1.00 . A A . 26 TRP C 1 1 1 306 1 1 26 TRP CA C -0.784 -3.082 -7.727 1.00 . A A . 26 TRP CA 1 1 1 307 1 1 26 TRP CB C -1.412 -1.783 -7.211 1.00 . A A . 26 TRP CB 1 1 1 308 1 1 26 TRP CD1 C -3.897 -2.228 -6.976 1.00 . A A . 26 TRP CD1 1 1 1 309 1 1 26 TRP CD2 C -3.401 -1.064 -8.837 1.00 . A A . 26 TRP CD2 1 1 1 310 1 1 26 TRP CE2 C -4.805 -1.242 -8.829 1.00 . A A . 26 TRP CE2 1 1 1 311 1 1 26 TRP CE3 C -2.829 -0.358 -9.909 1.00 . A A . 26 TRP CE3 1 1 1 312 1 1 26 TRP CG C -2.846 -1.700 -7.648 1.00 . A A . 26 TRP CG 1 1 1 313 1 1 26 TRP CH2 C -5.026 -0.038 -10.907 1.00 . A A . 26 TRP CH2 1 1 1 314 1 1 26 TRP CZ2 C -5.612 -0.738 -9.849 1.00 . A A . 26 TRP CZ2 1 1 1 315 1 1 26 TRP CZ3 C -3.638 0.152 -10.937 1.00 . A A . 26 TRP CZ3 1 1 1 316 1 1 26 TRP H H -2.085 -4.124 -6.354 1.00 . A A . 26 TRP H 1 1 1 317 1 1 26 TRP HA H -0.750 -3.066 -8.805 1.00 . A A . 26 TRP HA 1 1 1 318 1 1 26 TRP HB2 H -1.361 -1.762 -6.132 1.00 . A A . 26 TRP HB2 1 1 1 319 1 1 26 TRP HB3 H -0.866 -0.944 -7.611 1.00 . A A . 26 TRP HB3 1 1 1 320 1 1 26 TRP HD1 H -3.839 -2.772 -6.048 1.00 . A A . 26 TRP HD1 1 1 1 321 1 1 26 TRP HE1 H -5.959 -2.231 -7.405 1.00 . A A . 26 TRP HE1 1 1 1 322 1 1 26 TRP HE3 H -1.762 -0.207 -9.943 1.00 . A A . 26 TRP HE3 1 1 1 323 1 1 26 TRP HH2 H -5.643 0.357 -11.701 1.00 . A A . 26 TRP HH2 1 1 1 324 1 1 26 TRP HZ2 H -6.681 -0.887 -9.821 1.00 . A A . 26 TRP HZ2 1 1 1 325 1 1 26 TRP HZ3 H -3.188 0.693 -11.755 1.00 . A A . 26 TRP HZ3 1 1 1 326 1 1 26 TRP N N -1.695 -4.173 -7.252 1.00 . A A . 26 TRP N 1 1 1 327 1 1 26 TRP NE1 N -5.058 -1.957 -7.676 1.00 . A A . 26 TRP NE1 1 1 1 328 1 1 26 TRP O O 1.586 -2.705 -7.669 1.00 . A A . 26 TRP O 1 1 1 329 1 1 27 LYS C C 2.693 -3.017 -4.831 1.00 . A A . 27 LYS C 1 1 1 330 1 1 27 LYS CA C 2.122 -4.285 -5.487 1.00 . A A . 27 LYS CA 1 1 1 331 1 1 27 LYS CB C 3.031 -4.760 -6.628 1.00 . A A . 27 LYS CB 1 1 1 332 1 1 27 LYS CD C 3.336 -7.115 -5.843 1.00 . A A . 27 LYS CD 1 1 1 333 1 1 27 LYS CE C 4.369 -8.163 -5.418 1.00 . A A . 27 LYS CE 1 1 1 334 1 1 27 LYS CG C 4.039 -5.778 -6.091 1.00 . A A . 27 LYS CG 1 1 1 335 1 1 27 LYS H H -0.010 -4.478 -5.720 1.00 . A A . 27 LYS H 1 1 1 336 1 1 27 LYS HA H 2.042 -5.067 -4.749 1.00 . A A . 27 LYS HA 1 1 1 337 1 1 27 LYS HB2 H 2.431 -5.220 -7.399 1.00 . A A . 27 LYS HB2 1 1 1 338 1 1 27 LYS HB3 H 3.563 -3.916 -7.039 1.00 . A A . 27 LYS HB3 1 1 1 339 1 1 27 LYS HD2 H 2.601 -6.994 -5.061 1.00 . A A . 27 LYS HD2 1 1 1 340 1 1 27 LYS HD3 H 2.849 -7.439 -6.751 1.00 . A A . 27 LYS HD3 1 1 1 341 1 1 27 LYS HE2 H 5.300 -8.007 -5.945 1.00 . A A . 27 LYS HE2 1 1 1 342 1 1 27 LYS HE3 H 4.528 -8.123 -4.352 1.00 . A A . 27 LYS HE3 1 1 1 343 1 1 27 LYS HG2 H 4.830 -5.916 -6.815 1.00 . A A . 27 LYS HG2 1 1 1 344 1 1 27 LYS HG3 H 4.458 -5.417 -5.164 1.00 . A A . 27 LYS HG3 1 1 1 345 1 1 27 LYS HZ1 H 2.870 -9.604 -5.290 1.00 . A A . 27 LYS HZ1 1 1 1 346 1 1 27 LYS HZ2 H 4.426 -10.240 -5.539 1.00 . A A . 27 LYS HZ2 1 1 1 347 1 1 27 LYS HZ3 H 3.594 -9.494 -6.821 1.00 . A A . 27 LYS HZ3 1 1 1 348 1 1 27 LYS N N 0.777 -4.041 -6.106 1.00 . A A . 27 LYS N 1 1 1 349 1 1 27 LYS NZ N 3.770 -9.474 -5.796 1.00 . A A . 27 LYS NZ 1 1 1 350 1 1 27 LYS O O 3.894 -2.826 -4.785 1.00 . A A . 27 LYS O 1 1 1 351 1 1 28 TRP C C 1.310 -0.382 -2.638 1.00 . A A . 28 TRP C 1 1 1 352 1 1 28 TRP CA C 2.366 -0.942 -3.599 1.00 . A A . 28 TRP CA 1 1 1 353 1 1 28 TRP CB C 2.745 0.071 -4.699 1.00 . A A . 28 TRP CB 1 1 1 354 1 1 28 TRP CD1 C 0.424 1.071 -5.014 1.00 . A A . 28 TRP CD1 1 1 1 355 1 1 28 TRP CD2 C 1.419 0.532 -6.954 1.00 . A A . 28 TRP CD2 1 1 1 356 1 1 28 TRP CE2 C 0.159 1.077 -7.285 1.00 . A A . 28 TRP CE2 1 1 1 357 1 1 28 TRP CE3 C 2.254 0.109 -8.000 1.00 . A A . 28 TRP CE3 1 1 1 358 1 1 28 TRP CG C 1.563 0.528 -5.505 1.00 . A A . 28 TRP CG 1 1 1 359 1 1 28 TRP CH2 C 0.586 0.779 -9.640 1.00 . A A . 28 TRP CH2 1 1 1 360 1 1 28 TRP CZ2 C -0.258 1.203 -8.610 1.00 . A A . 28 TRP CZ2 1 1 1 361 1 1 28 TRP CZ3 C 1.840 0.233 -9.336 1.00 . A A . 28 TRP CZ3 1 1 1 362 1 1 28 TRP H H 0.889 -2.350 -4.308 1.00 . A A . 28 TRP H 1 1 1 363 1 1 28 TRP HA H 3.254 -1.198 -3.038 1.00 . A A . 28 TRP HA 1 1 1 364 1 1 28 TRP HB2 H 3.198 0.932 -4.236 1.00 . A A . 28 TRP HB2 1 1 1 365 1 1 28 TRP HB3 H 3.466 -0.388 -5.360 1.00 . A A . 28 TRP HB3 1 1 1 366 1 1 28 TRP HD1 H 0.201 1.224 -3.970 1.00 . A A . 28 TRP HD1 1 1 1 367 1 1 28 TRP HE1 H -1.300 1.791 -5.986 1.00 . A A . 28 TRP HE1 1 1 1 368 1 1 28 TRP HE3 H 3.218 -0.313 -7.775 1.00 . A A . 28 TRP HE3 1 1 1 369 1 1 28 TRP HH2 H 0.273 0.873 -10.669 1.00 . A A . 28 TRP HH2 1 1 1 370 1 1 28 TRP HZ2 H -1.225 1.624 -8.839 1.00 . A A . 28 TRP HZ2 1 1 1 371 1 1 28 TRP HZ3 H 2.492 -0.093 -10.133 1.00 . A A . 28 TRP HZ3 1 1 1 372 1 1 28 TRP N N 1.851 -2.168 -4.289 1.00 . A A . 28 TRP N 1 1 1 373 1 1 28 TRP NE1 N -0.411 1.390 -6.069 1.00 . A A . 28 TRP NE1 1 1 1 374 1 1 28 TRP O O 0.130 -0.659 -2.764 1.00 . A A . 28 TRP O 1 1 1 375 1 1 29 CYS C C -0.132 2.008 -1.331 1.00 . A A . 29 CYS C 1 1 1 376 1 1 29 CYS CA C 0.766 0.955 -0.676 1.00 . A A . 29 CYS CA 1 1 1 377 1 1 29 CYS CB C 1.621 1.602 0.418 1.00 . A A . 29 CYS CB 1 1 1 378 1 1 29 CYS H H 2.688 0.578 -1.577 1.00 . A A . 29 CYS H 1 1 1 379 1 1 29 CYS HA H 0.167 0.167 -0.251 1.00 . A A . 29 CYS HA 1 1 1 380 1 1 29 CYS HB2 H 2.377 2.222 -0.036 1.00 . A A . 29 CYS HB2 1 1 1 381 1 1 29 CYS HB3 H 0.990 2.212 1.049 1.00 . A A . 29 CYS HB3 1 1 1 382 1 1 29 CYS N N 1.732 0.388 -1.665 1.00 . A A . 29 CYS N 1 1 1 383 1 1 29 CYS O O 0.311 2.826 -2.110 1.00 . A A . 29 CYS O 1 1 1 384 1 1 29 CYS SG S 2.413 0.322 1.421 1.00 . A A . 29 CYS SG 1 1 1 385 1 1 30 VAL C C -3.194 3.546 -0.392 1.00 . A A . 30 VAL C 1 1 1 386 1 1 30 VAL CA C -2.364 2.979 -1.545 1.00 . A A . 30 VAL CA 1 1 1 387 1 1 30 VAL CB C -3.262 2.192 -2.513 1.00 . A A . 30 VAL CB 1 1 1 388 1 1 30 VAL CG1 C -2.439 1.710 -3.707 1.00 . A A . 30 VAL CG1 1 1 1 389 1 1 30 VAL CG2 C -3.873 0.981 -1.798 1.00 . A A . 30 VAL CG2 1 1 1 390 1 1 30 VAL H H -1.704 1.320 -0.348 1.00 . A A . 30 VAL H 1 1 1 391 1 1 30 VAL HA H -1.853 3.771 -2.068 1.00 . A A . 30 VAL HA 1 1 1 392 1 1 30 VAL HB H -4.054 2.835 -2.867 1.00 . A A . 30 VAL HB 1 1 1 393 1 1 30 VAL HG11 H -1.984 2.559 -4.196 1.00 . A A . 30 VAL HG11 1 1 1 394 1 1 30 VAL HG12 H -3.084 1.197 -4.404 1.00 . A A . 30 VAL HG12 1 1 1 395 1 1 30 VAL HG13 H -1.667 1.035 -3.366 1.00 . A A . 30 VAL HG13 1 1 1 396 1 1 30 VAL HG21 H -4.220 1.277 -0.819 1.00 . A A . 30 VAL HG21 1 1 1 397 1 1 30 VAL HG22 H -3.127 0.206 -1.696 1.00 . A A . 30 VAL HG22 1 1 1 398 1 1 30 VAL HG23 H -4.705 0.604 -2.375 1.00 . A A . 30 VAL HG23 1 1 1 399 1 1 30 VAL N N -1.391 1.989 -0.992 1.00 . A A . 30 VAL N 1 1 1 400 1 1 30 VAL O O -2.884 3.329 0.763 1.00 . A A . 30 VAL O 1 1 1 401 1 1 31 TYR C C -5.767 3.650 1.169 1.00 . A A . 31 TYR C 1 1 1 402 1 1 31 TYR CA C -5.097 4.806 0.415 1.00 . A A . 31 TYR CA 1 1 1 403 1 1 31 TYR CB C -6.144 5.684 -0.281 1.00 . A A . 31 TYR CB 1 1 1 404 1 1 31 TYR CD1 C -6.269 7.814 1.064 1.00 . A A . 31 TYR CD1 1 1 1 405 1 1 31 TYR CD2 C -8.007 6.147 1.354 1.00 . A A . 31 TYR CD2 1 1 1 406 1 1 31 TYR CE1 C -6.899 8.635 2.006 1.00 . A A . 31 TYR CE1 1 1 1 407 1 1 31 TYR CE2 C -8.637 6.968 2.296 1.00 . A A . 31 TYR CE2 1 1 1 408 1 1 31 TYR CG C -6.823 6.570 0.736 1.00 . A A . 31 TYR CG 1 1 1 409 1 1 31 TYR CZ C -8.083 8.212 2.623 1.00 . A A . 31 TYR CZ 1 1 1 410 1 1 31 TYR H H -4.493 4.409 -1.622 1.00 . A A . 31 TYR H 1 1 1 411 1 1 31 TYR HA H -4.497 5.398 1.092 1.00 . A A . 31 TYR HA 1 1 1 412 1 1 31 TYR HB2 H -5.658 6.298 -1.025 1.00 . A A . 31 TYR HB2 1 1 1 413 1 1 31 TYR HB3 H -6.881 5.055 -0.758 1.00 . A A . 31 TYR HB3 1 1 1 414 1 1 31 TYR HD1 H -5.356 8.141 0.588 1.00 . A A . 31 TYR HD1 1 1 1 415 1 1 31 TYR HD2 H -8.433 5.188 1.103 1.00 . A A . 31 TYR HD2 1 1 1 416 1 1 31 TYR HE1 H -6.472 9.595 2.258 1.00 . A A . 31 TYR HE1 1 1 1 417 1 1 31 TYR HE2 H -9.549 6.642 2.772 1.00 . A A . 31 TYR HE2 1 1 1 418 1 1 31 TYR HH H -9.368 9.544 3.094 1.00 . A A . 31 TYR HH 1 1 1 419 1 1 31 TYR N N -4.252 4.254 -0.685 1.00 . A A . 31 TYR N 1 1 1 420 1 1 31 TYR O O -6.194 2.677 0.574 1.00 . A A . 31 TYR O 1 1 1 421 1 1 31 TYR OH O -8.706 9.022 3.552 1.00 . A A . 31 TYR OH 1 1 1 422 1 1 32 ALA C C -7.981 2.875 3.418 1.00 . A A . 32 ALA C 1 1 1 423 1 1 32 ALA CA C -6.474 2.643 3.265 1.00 . A A . 32 ALA CA 1 1 1 424 1 1 32 ALA CB C -5.784 2.691 4.629 1.00 . A A . 32 ALA CB 1 1 1 425 1 1 32 ALA H H -5.487 4.532 2.929 1.00 . A A . 32 ALA H 1 1 1 426 1 1 32 ALA HA H -6.289 1.690 2.795 1.00 . A A . 32 ALA HA 1 1 1 427 1 1 32 ALA HB1 H -5.948 3.658 5.081 1.00 . A A . 32 ALA HB1 1 1 1 428 1 1 32 ALA HB2 H -4.724 2.527 4.503 1.00 . A A . 32 ALA HB2 1 1 1 429 1 1 32 ALA HB3 H -6.193 1.921 5.266 1.00 . A A . 32 ALA HB3 1 1 1 430 1 1 32 ALA N N -5.848 3.743 2.472 1.00 . A A . 32 ALA N 1 1 1 431 1 1 32 ALA O O -8.446 4.000 3.439 1.00 . A A . 32 ALA O 1 1 1 432 1 1 33 ARG C C -10.695 1.185 4.941 1.00 . A A . 33 ARG C 1 1 1 433 1 1 33 ARG CA C -10.223 1.956 3.696 1.00 . A A . 33 ARG CA 1 1 1 434 1 1 33 ARG CB C -10.823 1.349 2.421 1.00 . A A . 33 ARG CB 1 1 1 435 1 1 33 ARG CD C -11.331 1.751 0.003 1.00 . A A . 33 ARG CD 1 1 1 436 1 1 33 ARG CG C -10.819 2.391 1.299 1.00 . A A . 33 ARG CG 1 1 1 437 1 1 33 ARG CZ C -13.143 2.375 -1.487 1.00 . A A . 33 ARG CZ 1 1 1 438 1 1 33 ARG H H -8.338 0.920 3.519 1.00 . A A . 33 ARG H 1 1 1 439 1 1 33 ARG HA H -10.496 2.997 3.772 1.00 . A A . 33 ARG HA 1 1 1 440 1 1 33 ARG HB2 H -10.238 0.492 2.121 1.00 . A A . 33 ARG HB2 1 1 1 441 1 1 33 ARG HB3 H -11.839 1.040 2.615 1.00 . A A . 33 ARG HB3 1 1 1 442 1 1 33 ARG HD2 H -10.630 1.924 -0.801 1.00 . A A . 33 ARG HD2 1 1 1 443 1 1 33 ARG HD3 H -11.490 0.693 0.143 1.00 . A A . 33 ARG HD3 1 1 1 444 1 1 33 ARG HE H -13.103 2.907 0.427 1.00 . A A . 33 ARG HE 1 1 1 445 1 1 33 ARG HG2 H -11.457 3.218 1.573 1.00 . A A . 33 ARG HG2 1 1 1 446 1 1 33 ARG HG3 H -9.812 2.750 1.146 1.00 . A A . 33 ARG HG3 1 1 1 447 1 1 33 ARG HH11 H -13.698 0.454 -1.334 1.00 . A A . 33 ARG HH11 1 1 1 448 1 1 33 ARG HH12 H -14.072 1.222 -2.840 1.00 . A A . 33 ARG HH12 1 1 1 449 1 1 33 ARG HH21 H -12.711 4.284 -1.923 1.00 . A A . 33 ARG HH21 1 1 1 450 1 1 33 ARG HH22 H -13.512 3.394 -3.175 1.00 . A A . 33 ARG HH22 1 1 1 451 1 1 33 ARG N N -8.742 1.814 3.534 1.00 . A A . 33 ARG N 1 1 1 452 1 1 33 ARG NE N -12.631 2.427 -0.285 1.00 . A A . 33 ARG NE 1 1 1 453 1 1 33 ARG NH1 N -13.679 1.264 -1.921 1.00 . A A . 33 ARG NH1 1 1 1 454 1 1 33 ARG NH2 N -13.120 3.433 -2.255 1.00 . A A . 33 ARG NH2 1 1 1 455 1 1 33 ARG O O -11.427 0.217 4.829 1.00 . A A . 33 ARG O 1 1 1 456 1 1 34 PRO C C -12.125 1.248 7.692 1.00 . A A . 34 PRO C 1 1 1 457 1 1 34 PRO CA C -10.648 0.980 7.370 1.00 . A A . 34 PRO CA 1 1 1 458 1 1 34 PRO CB C -9.731 1.630 8.406 1.00 . A A . 34 PRO CB 1 1 1 459 1 1 34 PRO CD C -9.383 2.796 6.322 1.00 . A A . 34 PRO CD 1 1 1 460 1 1 34 PRO CG C -9.367 2.957 7.821 1.00 . A A . 34 PRO CG 1 1 1 461 1 1 34 PRO HA H -10.454 -0.080 7.322 1.00 . A A . 34 PRO HA 1 1 1 462 1 1 34 PRO HB2 H -10.257 1.760 9.341 1.00 . A A . 34 PRO HB2 1 1 1 463 1 1 34 PRO HB3 H -8.844 1.035 8.551 1.00 . A A . 34 PRO HB3 1 1 1 464 1 1 34 PRO HD2 H -9.787 3.683 5.852 1.00 . A A . 34 PRO HD2 1 1 1 465 1 1 34 PRO HD3 H -8.391 2.586 5.954 1.00 . A A . 34 PRO HD3 1 1 1 466 1 1 34 PRO HG2 H -10.088 3.703 8.123 1.00 . A A . 34 PRO HG2 1 1 1 467 1 1 34 PRO HG3 H -8.378 3.244 8.144 1.00 . A A . 34 PRO HG3 1 1 1 468 1 1 34 PRO N N -10.261 1.640 6.095 1.00 . A A . 34 PRO N 1 1 1 469 1 1 34 PRO O O -12.530 2.400 7.637 1.00 . A A . 34 PRO O 1 1 1 470 1 1 34 PRO OXT O -12.826 0.292 7.984 1.00 . A A . 34 PRO OXT 1 1 2 471 1 1 1 GLY C C 8.674 6.136 6.199 1.00 . A A . 1 GLY C 1 1 2 472 1 1 1 GLY CA C 10.164 6.233 6.540 1.00 . A A . 1 GLY CA 1 1 2 473 1 1 1 GLY H1 H 10.305 4.403 7.526 1.00 . A A . 1 GLY H1 1 1 2 474 1 1 1 GLY H2 H 11.763 4.932 6.833 1.00 . A A . 1 GLY H2 1 1 2 475 1 1 1 GLY H3 H 10.530 4.303 5.848 1.00 . A A . 1 GLY H3 1 1 2 476 1 1 1 GLY HA2 H 10.289 6.783 7.463 1.00 . A A . 1 GLY HA2 1 1 2 477 1 1 1 GLY HA3 H 10.679 6.746 5.743 1.00 . A A . 1 GLY HA3 1 1 2 478 1 1 1 GLY N N 10.733 4.864 6.699 1.00 . A A . 1 GLY N 1 1 2 479 1 1 1 GLY O O 7.864 5.758 7.026 1.00 . A A . 1 GLY O 1 1 2 480 1 1 2 CYS C C 6.745 6.001 3.111 1.00 . A A . 2 CYS C 1 1 2 481 1 1 2 CYS CA C 6.868 6.411 4.584 1.00 . A A . 2 CYS CA 1 1 2 482 1 1 2 CYS CB C 6.333 7.831 4.787 1.00 . A A . 2 CYS CB 1 1 2 483 1 1 2 CYS H H 8.981 6.780 4.342 1.00 . A A . 2 CYS H 1 1 2 484 1 1 2 CYS HA H 6.330 5.721 5.214 1.00 . A A . 2 CYS HA 1 1 2 485 1 1 2 CYS HB2 H 7.161 8.518 4.885 1.00 . A A . 2 CYS HB2 1 1 2 486 1 1 2 CYS HB3 H 5.732 8.114 3.936 1.00 . A A . 2 CYS HB3 1 1 2 487 1 1 2 CYS N N 8.307 6.478 4.987 1.00 . A A . 2 CYS N 1 1 2 488 1 1 2 CYS O O 7.324 6.622 2.238 1.00 . A A . 2 CYS O 1 1 2 489 1 1 2 CYS SG S 5.319 7.893 6.285 1.00 . A A . 2 CYS SG 1 1 2 490 1 1 3 GLY C C 4.956 5.533 0.659 1.00 . A A . 3 GLY C 1 1 2 491 1 1 3 GLY CA C 5.826 4.519 1.412 1.00 . A A . 3 GLY CA 1 1 2 492 1 1 3 GLY H H 5.532 4.482 3.547 1.00 . A A . 3 GLY H 1 1 2 493 1 1 3 GLY HA2 H 6.796 4.452 0.940 1.00 . A A . 3 GLY HA2 1 1 2 494 1 1 3 GLY HA3 H 5.346 3.553 1.391 1.00 . A A . 3 GLY HA3 1 1 2 495 1 1 3 GLY N N 5.992 4.964 2.828 1.00 . A A . 3 GLY N 1 1 2 496 1 1 3 GLY O O 5.454 6.345 -0.098 1.00 . A A . 3 GLY O 1 1 2 497 1 1 4 GLY C C 1.716 5.687 -0.657 1.00 . A A . 4 GLY C 1 1 2 498 1 1 4 GLY CA C 2.753 6.454 0.169 1.00 . A A . 4 GLY CA 1 1 2 499 1 1 4 GLY H H 3.288 4.828 1.481 1.00 . A A . 4 GLY H 1 1 2 500 1 1 4 GLY HA2 H 2.249 7.064 0.905 1.00 . A A . 4 GLY HA2 1 1 2 501 1 1 4 GLY HA3 H 3.331 7.088 -0.486 1.00 . A A . 4 GLY HA3 1 1 2 502 1 1 4 GLY N N 3.662 5.491 0.865 1.00 . A A . 4 GLY N 1 1 2 503 1 1 4 GLY O O 1.329 4.587 -0.314 1.00 . A A . 4 GLY O 1 1 2 504 1 1 5 LEU C C 0.919 4.806 -3.755 1.00 . A A . 5 LEU C 1 1 2 505 1 1 5 LEU CA C 0.246 5.572 -2.600 1.00 . A A . 5 LEU CA 1 1 2 506 1 1 5 LEU CB C -0.648 6.690 -3.141 1.00 . A A . 5 LEU CB 1 1 2 507 1 1 5 LEU CD1 C -3.046 7.392 -3.101 1.00 . A A . 5 LEU CD1 1 1 2 508 1 1 5 LEU CD2 C -2.327 5.482 -4.548 1.00 . A A . 5 LEU CD2 1 1 2 509 1 1 5 LEU CG C -2.096 6.198 -3.214 1.00 . A A . 5 LEU CG 1 1 2 510 1 1 5 LEU H H 1.591 7.153 -1.999 1.00 . A A . 5 LEU H 1 1 2 511 1 1 5 LEU HA H -0.343 4.896 -2.000 1.00 . A A . 5 LEU HA 1 1 2 512 1 1 5 LEU HB2 H -0.592 7.546 -2.483 1.00 . A A . 5 LEU HB2 1 1 2 513 1 1 5 LEU HB3 H -0.316 6.972 -4.129 1.00 . A A . 5 LEU HB3 1 1 2 514 1 1 5 LEU HD11 H -2.811 8.114 -3.870 1.00 . A A . 5 LEU HD11 1 1 2 515 1 1 5 LEU HD12 H -2.932 7.852 -2.130 1.00 . A A . 5 LEU HD12 1 1 2 516 1 1 5 LEU HD13 H -4.065 7.056 -3.223 1.00 . A A . 5 LEU HD13 1 1 2 517 1 1 5 LEU HD21 H -1.586 5.806 -5.263 1.00 . A A . 5 LEU HD21 1 1 2 518 1 1 5 LEU HD22 H -3.312 5.718 -4.920 1.00 . A A . 5 LEU HD22 1 1 2 519 1 1 5 LEU HD23 H -2.243 4.415 -4.403 1.00 . A A . 5 LEU HD23 1 1 2 520 1 1 5 LEU HG H -2.284 5.513 -2.398 1.00 . A A . 5 LEU HG 1 1 2 521 1 1 5 LEU N N 1.264 6.264 -1.745 1.00 . A A . 5 LEU N 1 1 2 522 1 1 5 LEU O O 0.257 4.147 -4.534 1.00 . A A . 5 LEU O 1 1 2 523 1 1 6 MET C C 4.282 3.615 -4.428 1.00 . A A . 6 MET C 1 1 2 524 1 1 6 MET CA C 2.937 4.140 -4.955 1.00 . A A . 6 MET CA 1 1 2 525 1 1 6 MET CB C 3.151 5.176 -6.065 1.00 . A A . 6 MET CB 1 1 2 526 1 1 6 MET CE C -0.236 6.910 -7.653 1.00 . A A . 6 MET CE 1 1 2 527 1 1 6 MET CG C 1.859 5.366 -6.864 1.00 . A A . 6 MET CG 1 1 2 528 1 1 6 MET H H 2.741 5.398 -3.219 1.00 . A A . 6 MET H 1 1 2 529 1 1 6 MET HA H 2.332 3.324 -5.320 1.00 . A A . 6 MET HA 1 1 2 530 1 1 6 MET HB2 H 3.442 6.117 -5.624 1.00 . A A . 6 MET HB2 1 1 2 531 1 1 6 MET HB3 H 3.931 4.834 -6.728 1.00 . A A . 6 MET HB3 1 1 2 532 1 1 6 MET HE1 H 0.136 6.732 -8.653 1.00 . A A . 6 MET HE1 1 1 2 533 1 1 6 MET HE2 H -0.778 7.842 -7.636 1.00 . A A . 6 MET HE2 1 1 2 534 1 1 6 MET HE3 H -0.897 6.106 -7.361 1.00 . A A . 6 MET HE3 1 1 2 535 1 1 6 MET HG2 H 2.076 5.298 -7.921 1.00 . A A . 6 MET HG2 1 1 2 536 1 1 6 MET HG3 H 1.150 4.598 -6.594 1.00 . A A . 6 MET HG3 1 1 2 537 1 1 6 MET N N 2.224 4.874 -3.864 1.00 . A A . 6 MET N 1 1 2 538 1 1 6 MET O O 5.297 3.686 -5.097 1.00 . A A . 6 MET O 1 1 2 539 1 1 6 MET SD S 1.155 6.994 -6.500 1.00 . A A . 6 MET SD 1 1 2 540 1 1 7 ALA C C 5.822 1.130 -3.108 1.00 . A A . 7 ALA C 1 1 2 541 1 1 7 ALA CA C 5.557 2.561 -2.626 1.00 . A A . 7 ALA CA 1 1 2 542 1 1 7 ALA CB C 5.310 2.584 -1.114 1.00 . A A . 7 ALA CB 1 1 2 543 1 1 7 ALA H H 3.457 3.050 -2.707 1.00 . A A . 7 ALA H 1 1 2 544 1 1 7 ALA HA H 6.391 3.196 -2.869 1.00 . A A . 7 ALA HA 1 1 2 545 1 1 7 ALA HB1 H 4.821 1.669 -0.815 1.00 . A A . 7 ALA HB1 1 1 2 546 1 1 7 ALA HB2 H 4.681 3.425 -0.864 1.00 . A A . 7 ALA HB2 1 1 2 547 1 1 7 ALA HB3 H 6.253 2.673 -0.595 1.00 . A A . 7 ALA HB3 1 1 2 548 1 1 7 ALA N N 4.291 3.091 -3.224 1.00 . A A . 7 ALA N 1 1 2 549 1 1 7 ALA O O 5.279 0.686 -4.099 1.00 . A A . 7 ALA O 1 1 2 550 1 1 8 GLY C C 6.472 -1.958 -1.741 1.00 . A A . 8 GLY C 1 1 2 551 1 1 8 GLY CA C 6.973 -0.991 -2.816 1.00 . A A . 8 GLY CA 1 1 2 552 1 1 8 GLY H H 7.092 0.797 -1.619 1.00 . A A . 8 GLY H 1 1 2 553 1 1 8 GLY HA2 H 6.484 -1.211 -3.756 1.00 . A A . 8 GLY HA2 1 1 2 554 1 1 8 GLY HA3 H 8.040 -1.106 -2.930 1.00 . A A . 8 GLY HA3 1 1 2 555 1 1 8 GLY N N 6.662 0.411 -2.410 1.00 . A A . 8 GLY N 1 1 2 556 1 1 8 GLY O O 6.912 -1.922 -0.607 1.00 . A A . 8 GLY O 1 1 2 557 1 1 9 CYS C C 5.518 -5.211 -1.412 1.00 . A A . 9 CYS C 1 1 2 558 1 1 9 CYS CA C 5.011 -3.798 -1.099 1.00 . A A . 9 CYS CA 1 1 2 559 1 1 9 CYS CB C 3.490 -3.721 -1.256 1.00 . A A . 9 CYS CB 1 1 2 560 1 1 9 CYS H H 5.215 -2.828 -3.012 1.00 . A A . 9 CYS H 1 1 2 561 1 1 9 CYS HA H 5.290 -3.512 -0.097 1.00 . A A . 9 CYS HA 1 1 2 562 1 1 9 CYS HB2 H 3.238 -3.700 -2.305 1.00 . A A . 9 CYS HB2 1 1 2 563 1 1 9 CYS HB3 H 3.035 -4.582 -0.793 1.00 . A A . 9 CYS HB3 1 1 2 564 1 1 9 CYS N N 5.552 -2.821 -2.091 1.00 . A A . 9 CYS N 1 1 2 565 1 1 9 CYS O O 4.756 -6.159 -1.458 1.00 . A A . 9 CYS O 1 1 2 566 1 1 9 CYS SG S 2.880 -2.214 -0.460 1.00 . A A . 9 CYS SG 1 1 2 567 1 1 10 ASP C C 7.464 -7.541 -0.649 1.00 . A A . 10 ASP C 1 1 2 568 1 1 10 ASP CA C 7.369 -6.705 -1.934 1.00 . A A . 10 ASP CA 1 1 2 569 1 1 10 ASP CB C 8.763 -6.431 -2.513 1.00 . A A . 10 ASP CB 1 1 2 570 1 1 10 ASP CG C 8.629 -5.761 -3.883 1.00 . A A . 10 ASP CG 1 1 2 571 1 1 10 ASP H H 7.394 -4.575 -1.582 1.00 . A A . 10 ASP H 1 1 2 572 1 1 10 ASP HA H 6.760 -7.210 -2.666 1.00 . A A . 10 ASP HA 1 1 2 573 1 1 10 ASP HB2 H 9.309 -5.781 -1.845 1.00 . A A . 10 ASP HB2 1 1 2 574 1 1 10 ASP HB3 H 9.297 -7.364 -2.622 1.00 . A A . 10 ASP HB3 1 1 2 575 1 1 10 ASP N N 6.802 -5.356 -1.626 1.00 . A A . 10 ASP N 1 1 2 576 1 1 10 ASP O O 8.451 -7.495 0.063 1.00 . A A . 10 ASP O 1 1 2 577 1 1 10 ASP OD1 O 8.502 -6.477 -4.863 1.00 . A A . 10 ASP OD1 1 1 2 578 1 1 10 ASP OD2 O 8.655 -4.541 -3.930 1.00 . A A . 10 ASP OD2 1 1 2 579 1 1 11 GLY C C 5.139 -8.889 1.657 1.00 . A A . 11 GLY C 1 1 2 580 1 1 11 GLY CA C 6.439 -9.130 0.888 1.00 . A A . 11 GLY CA 1 1 2 581 1 1 11 GLY H H 5.651 -8.303 -0.933 1.00 . A A . 11 GLY H 1 1 2 582 1 1 11 GLY HA2 H 6.515 -10.174 0.618 1.00 . A A . 11 GLY HA2 1 1 2 583 1 1 11 GLY HA3 H 7.278 -8.855 1.510 1.00 . A A . 11 GLY HA3 1 1 2 584 1 1 11 GLY N N 6.435 -8.294 -0.347 1.00 . A A . 11 GLY N 1 1 2 585 1 1 11 GLY O O 4.689 -7.765 1.791 1.00 . A A . 11 GLY O 1 1 2 586 1 1 12 LYS C C 3.508 -9.091 4.296 1.00 . A A . 12 LYS C 1 1 2 587 1 1 12 LYS CA C 3.254 -9.761 2.931 1.00 . A A . 12 LYS CA 1 1 2 588 1 1 12 LYS CB C 2.699 -11.181 3.117 1.00 . A A . 12 LYS CB 1 1 2 589 1 1 12 LYS CD C 3.651 -13.434 3.658 1.00 . A A . 12 LYS CD 1 1 2 590 1 1 12 LYS CE C 4.680 -14.178 4.516 1.00 . A A . 12 LYS CE 1 1 2 591 1 1 12 LYS CG C 3.579 -11.968 4.095 1.00 . A A . 12 LYS CG 1 1 2 592 1 1 12 LYS H H 4.914 -10.827 2.046 1.00 . A A . 12 LYS H 1 1 2 593 1 1 12 LYS HA H 2.555 -9.173 2.356 1.00 . A A . 12 LYS HA 1 1 2 594 1 1 12 LYS HB2 H 1.693 -11.124 3.507 1.00 . A A . 12 LYS HB2 1 1 2 595 1 1 12 LYS HB3 H 2.685 -11.688 2.163 1.00 . A A . 12 LYS HB3 1 1 2 596 1 1 12 LYS HD2 H 2.680 -13.893 3.780 1.00 . A A . 12 LYS HD2 1 1 2 597 1 1 12 LYS HD3 H 3.945 -13.485 2.620 1.00 . A A . 12 LYS HD3 1 1 2 598 1 1 12 LYS HE2 H 4.486 -14.006 5.565 1.00 . A A . 12 LYS HE2 1 1 2 599 1 1 12 LYS HE3 H 4.655 -15.236 4.298 1.00 . A A . 12 LYS HE3 1 1 2 600 1 1 12 LYS HG2 H 4.574 -11.545 4.105 1.00 . A A . 12 LYS HG2 1 1 2 601 1 1 12 LYS HG3 H 3.155 -11.911 5.087 1.00 . A A . 12 LYS HG3 1 1 2 602 1 1 12 LYS HZ1 H 6.018 -13.406 3.111 1.00 . A A . 12 LYS HZ1 1 1 2 603 1 1 12 LYS HZ2 H 6.754 -14.301 4.354 1.00 . A A . 12 LYS HZ2 1 1 2 604 1 1 12 LYS HZ3 H 6.175 -12.733 4.662 1.00 . A A . 12 LYS HZ3 1 1 2 605 1 1 12 LYS N N 4.531 -9.933 2.166 1.00 . A A . 12 LYS N 1 1 2 606 1 1 12 LYS NZ N 6.006 -13.611 4.131 1.00 . A A . 12 LYS NZ 1 1 2 607 1 1 12 LYS O O 2.578 -8.791 5.022 1.00 . A A . 12 LYS O 1 1 2 608 1 1 13 SER C C 5.695 -6.823 5.756 1.00 . A A . 13 SER C 1 1 2 609 1 1 13 SER CA C 5.048 -8.202 5.966 1.00 . A A . 13 SER CA 1 1 2 610 1 1 13 SER CB C 6.017 -9.160 6.665 1.00 . A A . 13 SER CB 1 1 2 611 1 1 13 SER H H 5.489 -9.099 4.055 1.00 . A A . 13 SER H 1 1 2 612 1 1 13 SER HA H 4.146 -8.107 6.549 1.00 . A A . 13 SER HA 1 1 2 613 1 1 13 SER HB2 H 6.792 -9.459 5.978 1.00 . A A . 13 SER HB2 1 1 2 614 1 1 13 SER HB3 H 6.467 -8.661 7.514 1.00 . A A . 13 SER HB3 1 1 2 615 1 1 13 SER HG H 5.355 -10.974 6.405 1.00 . A A . 13 SER HG 1 1 2 616 1 1 13 SER N N 4.751 -8.853 4.652 1.00 . A A . 13 SER N 1 1 2 617 1 1 13 SER O O 6.504 -6.379 6.550 1.00 . A A . 13 SER O 1 1 2 618 1 1 13 SER OG O 5.307 -10.313 7.101 1.00 . A A . 13 SER OG 1 1 2 619 1 1 14 THR C C 5.151 -3.696 5.179 1.00 . A A . 14 THR C 1 1 2 620 1 1 14 THR CA C 5.930 -4.787 4.424 1.00 . A A . 14 THR CA 1 1 2 621 1 1 14 THR CB C 5.816 -4.593 2.901 1.00 . A A . 14 THR CB 1 1 2 622 1 1 14 THR CG2 C 4.343 -4.488 2.487 1.00 . A A . 14 THR CG2 1 1 2 623 1 1 14 THR H H 4.685 -6.517 4.068 1.00 . A A . 14 THR H 1 1 2 624 1 1 14 THR HA H 6.968 -4.769 4.716 1.00 . A A . 14 THR HA 1 1 2 625 1 1 14 THR HB H 6.265 -5.437 2.401 1.00 . A A . 14 THR HB 1 1 2 626 1 1 14 THR HG1 H 7.395 -3.644 2.274 1.00 . A A . 14 THR HG1 1 1 2 627 1 1 14 THR HG21 H 4.282 -4.195 1.450 1.00 . A A . 14 THR HG21 1 1 2 628 1 1 14 THR HG22 H 3.847 -3.749 3.098 1.00 . A A . 14 THR HG22 1 1 2 629 1 1 14 THR HG23 H 3.862 -5.446 2.618 1.00 . A A . 14 THR HG23 1 1 2 630 1 1 14 THR N N 5.341 -6.140 4.692 1.00 . A A . 14 THR N 1 1 2 631 1 1 14 THR O O 4.194 -3.975 5.879 1.00 . A A . 14 THR O 1 1 2 632 1 1 14 THR OG1 O 6.499 -3.405 2.522 1.00 . A A . 14 THR OG1 1 1 2 633 1 1 15 PHE C C 4.806 -0.084 4.868 1.00 . A A . 15 PHE C 1 1 2 634 1 1 15 PHE CA C 4.850 -1.344 5.749 1.00 . A A . 15 PHE CA 1 1 2 635 1 1 15 PHE CB C 5.663 -1.101 7.032 1.00 . A A . 15 PHE CB 1 1 2 636 1 1 15 PHE CD1 C 8.040 -0.796 6.230 1.00 . A A . 15 PHE CD1 1 1 2 637 1 1 15 PHE CD2 C 6.812 1.149 6.995 1.00 . A A . 15 PHE CD2 1 1 2 638 1 1 15 PHE CE1 C 9.154 0.011 5.965 1.00 . A A . 15 PHE CE1 1 1 2 639 1 1 15 PHE CE2 C 7.925 1.956 6.730 1.00 . A A . 15 PHE CE2 1 1 2 640 1 1 15 PHE CG C 6.869 -0.228 6.745 1.00 . A A . 15 PHE CG 1 1 2 641 1 1 15 PHE CZ C 9.095 1.388 6.215 1.00 . A A . 15 PHE CZ 1 1 2 642 1 1 15 PHE H H 6.333 -2.256 4.474 1.00 . A A . 15 PHE H 1 1 2 643 1 1 15 PHE HA H 3.848 -1.648 6.008 1.00 . A A . 15 PHE HA 1 1 2 644 1 1 15 PHE HB2 H 5.038 -0.612 7.764 1.00 . A A . 15 PHE HB2 1 1 2 645 1 1 15 PHE HB3 H 5.997 -2.049 7.427 1.00 . A A . 15 PHE HB3 1 1 2 646 1 1 15 PHE HD1 H 8.086 -1.858 6.036 1.00 . A A . 15 PHE HD1 1 1 2 647 1 1 15 PHE HD2 H 5.909 1.590 7.392 1.00 . A A . 15 PHE HD2 1 1 2 648 1 1 15 PHE HE1 H 10.056 -0.427 5.568 1.00 . A A . 15 PHE HE1 1 1 2 649 1 1 15 PHE HE2 H 7.880 3.018 6.924 1.00 . A A . 15 PHE HE2 1 1 2 650 1 1 15 PHE HZ H 9.953 2.010 6.012 1.00 . A A . 15 PHE HZ 1 1 2 651 1 1 15 PHE N N 5.558 -2.456 5.042 1.00 . A A . 15 PHE N 1 1 2 652 1 1 15 PHE O O 5.683 0.150 4.057 1.00 . A A . 15 PHE O 1 1 2 653 1 1 16 CYS C C 3.828 3.203 5.122 1.00 . A A . 16 CYS C 1 1 2 654 1 1 16 CYS CA C 3.670 1.973 4.213 1.00 . A A . 16 CYS CA 1 1 2 655 1 1 16 CYS CB C 2.267 1.913 3.593 1.00 . A A . 16 CYS CB 1 1 2 656 1 1 16 CYS H H 3.095 0.511 5.691 1.00 . A A . 16 CYS H 1 1 2 657 1 1 16 CYS HA H 4.417 1.988 3.433 1.00 . A A . 16 CYS HA 1 1 2 658 1 1 16 CYS HB2 H 1.525 2.025 4.372 1.00 . A A . 16 CYS HB2 1 1 2 659 1 1 16 CYS HB3 H 2.155 2.713 2.876 1.00 . A A . 16 CYS HB3 1 1 2 660 1 1 16 CYS N N 3.786 0.724 5.028 1.00 . A A . 16 CYS N 1 1 2 661 1 1 16 CYS O O 4.589 3.180 6.072 1.00 . A A . 16 CYS O 1 1 2 662 1 1 16 CYS SG S 2.032 0.320 2.762 1.00 . A A . 16 CYS SG 1 1 2 663 1 1 17 CYS C C 2.215 5.468 6.827 1.00 . A A . 17 CYS C 1 1 2 664 1 1 17 CYS CA C 3.253 5.498 5.699 1.00 . A A . 17 CYS CA 1 1 2 665 1 1 17 CYS CB C 3.002 6.680 4.759 1.00 . A A . 17 CYS CB 1 1 2 666 1 1 17 CYS H H 2.522 4.283 4.072 1.00 . A A . 17 CYS H 1 1 2 667 1 1 17 CYS HA H 4.245 5.561 6.110 1.00 . A A . 17 CYS HA 1 1 2 668 1 1 17 CYS HB2 H 3.604 6.568 3.869 1.00 . A A . 17 CYS HB2 1 1 2 669 1 1 17 CYS HB3 H 1.958 6.708 4.485 1.00 . A A . 17 CYS HB3 1 1 2 670 1 1 17 CYS N N 3.127 4.277 4.842 1.00 . A A . 17 CYS N 1 1 2 671 1 1 17 CYS O O 2.558 5.476 7.995 1.00 . A A . 17 CYS O 1 1 2 672 1 1 17 CYS SG S 3.448 8.221 5.599 1.00 . A A . 17 CYS SG 1 1 2 673 1 1 18 SER C C -1.010 4.161 7.300 1.00 . A A . 18 SER C 1 1 2 674 1 1 18 SER CA C -0.122 5.398 7.522 1.00 . A A . 18 SER CA 1 1 2 675 1 1 18 SER CB C -0.905 6.702 7.322 1.00 . A A . 18 SER CB 1 1 2 676 1 1 18 SER H H 0.714 5.424 5.534 1.00 . A A . 18 SER H 1 1 2 677 1 1 18 SER HA H 0.312 5.375 8.510 1.00 . A A . 18 SER HA 1 1 2 678 1 1 18 SER HB2 H -1.301 6.737 6.320 1.00 . A A . 18 SER HB2 1 1 2 679 1 1 18 SER HB3 H -1.722 6.742 8.031 1.00 . A A . 18 SER HB3 1 1 2 680 1 1 18 SER HG H 0.190 8.170 6.658 1.00 . A A . 18 SER HG 1 1 2 681 1 1 18 SER N N 0.955 5.432 6.483 1.00 . A A . 18 SER N 1 1 2 682 1 1 18 SER O O -0.515 3.053 7.211 1.00 . A A . 18 SER O 1 1 2 683 1 1 18 SER OG O -0.036 7.811 7.519 1.00 . A A . 18 SER OG 1 1 2 684 1 1 19 GLY C C -3.000 2.597 5.550 1.00 . A A . 19 GLY C 1 1 2 685 1 1 19 GLY CA C -3.210 3.158 6.966 1.00 . A A . 19 GLY CA 1 1 2 686 1 1 19 GLY H H -2.698 5.227 7.260 1.00 . A A . 19 GLY H 1 1 2 687 1 1 19 GLY HA2 H -2.988 2.390 7.694 1.00 . A A . 19 GLY HA2 1 1 2 688 1 1 19 GLY HA3 H -4.238 3.467 7.075 1.00 . A A . 19 GLY HA3 1 1 2 689 1 1 19 GLY N N -2.312 4.330 7.196 1.00 . A A . 19 GLY N 1 1 2 690 1 1 19 GLY O O -3.473 1.521 5.238 1.00 . A A . 19 GLY O 1 1 2 691 1 1 20 TYR C C -1.779 1.340 3.249 1.00 . A A . 20 TYR C 1 1 2 692 1 1 20 TYR CA C -2.044 2.853 3.294 1.00 . A A . 20 TYR CA 1 1 2 693 1 1 20 TYR CB C -0.782 3.605 2.850 1.00 . A A . 20 TYR CB 1 1 2 694 1 1 20 TYR CD1 C -1.242 6.061 3.188 1.00 . A A . 20 TYR CD1 1 1 2 695 1 1 20 TYR CD2 C -1.361 5.152 0.944 1.00 . A A . 20 TYR CD2 1 1 2 696 1 1 20 TYR CE1 C -1.560 7.330 2.693 1.00 . A A . 20 TYR CE1 1 1 2 697 1 1 20 TYR CE2 C -1.681 6.421 0.447 1.00 . A A . 20 TYR CE2 1 1 2 698 1 1 20 TYR CG C -1.143 4.972 2.315 1.00 . A A . 20 TYR CG 1 1 2 699 1 1 20 TYR CZ C -1.779 7.510 1.322 1.00 . A A . 20 TYR CZ 1 1 2 700 1 1 20 TYR H H -1.936 4.184 4.984 1.00 . A A . 20 TYR H 1 1 2 701 1 1 20 TYR HA H -2.871 3.115 2.652 1.00 . A A . 20 TYR HA 1 1 2 702 1 1 20 TYR HB2 H -0.117 3.717 3.693 1.00 . A A . 20 TYR HB2 1 1 2 703 1 1 20 TYR HB3 H -0.284 3.040 2.076 1.00 . A A . 20 TYR HB3 1 1 2 704 1 1 20 TYR HD1 H -1.074 5.922 4.247 1.00 . A A . 20 TYR HD1 1 1 2 705 1 1 20 TYR HD2 H -1.285 4.311 0.270 1.00 . A A . 20 TYR HD2 1 1 2 706 1 1 20 TYR HE1 H -1.637 8.169 3.366 1.00 . A A . 20 TYR HE1 1 1 2 707 1 1 20 TYR HE2 H -1.851 6.559 -0.609 1.00 . A A . 20 TYR HE2 1 1 2 708 1 1 20 TYR HH H -1.268 9.229 0.671 1.00 . A A . 20 TYR HH 1 1 2 709 1 1 20 TYR N N -2.298 3.321 4.699 1.00 . A A . 20 TYR N 1 1 2 710 1 1 20 TYR O O -0.767 0.867 3.734 1.00 . A A . 20 TYR O 1 1 2 711 1 1 20 TYR OH O -2.091 8.761 0.831 1.00 . A A . 20 TYR OH 1 1 2 712 1 1 21 ASN C C -1.695 -1.229 1.288 1.00 . A A . 21 ASN C 1 1 2 713 1 1 21 ASN CA C -2.459 -0.899 2.575 1.00 . A A . 21 ASN CA 1 1 2 714 1 1 21 ASN CB C -3.865 -1.511 2.544 1.00 . A A . 21 ASN CB 1 1 2 715 1 1 21 ASN CG C -4.073 -2.373 3.791 1.00 . A A . 21 ASN CG 1 1 2 716 1 1 21 ASN H H -3.475 0.986 2.270 1.00 . A A . 21 ASN H 1 1 2 717 1 1 21 ASN HA H -1.917 -1.252 3.437 1.00 . A A . 21 ASN HA 1 1 2 718 1 1 21 ASN HB2 H -4.603 -0.722 2.523 1.00 . A A . 21 ASN HB2 1 1 2 719 1 1 21 ASN HB3 H -3.971 -2.124 1.663 1.00 . A A . 21 ASN HB3 1 1 2 720 1 1 21 ASN HD21 H -3.740 -4.084 2.837 1.00 . A A . 21 ASN HD21 1 1 2 721 1 1 21 ASN HD22 H -4.085 -4.230 4.493 1.00 . A A . 21 ASN HD22 1 1 2 722 1 1 21 ASN N N -2.672 0.581 2.662 1.00 . A A . 21 ASN N 1 1 2 723 1 1 21 ASN ND2 N -3.957 -3.670 3.699 1.00 . A A . 21 ASN ND2 1 1 2 724 1 1 21 ASN O O -1.308 -0.344 0.562 1.00 . A A . 21 ASN O 1 1 2 725 1 1 21 ASN OD1 O -4.343 -1.861 4.860 1.00 . A A . 21 ASN OD1 1 1 2 726 1 1 22 CYS C C -1.673 -3.501 -1.269 1.00 . A A . 22 CYS C 1 1 2 727 1 1 22 CYS CA C -0.730 -2.829 -0.266 1.00 . A A . 22 CYS CA 1 1 2 728 1 1 22 CYS CB C 0.379 -3.794 0.161 1.00 . A A . 22 CYS CB 1 1 2 729 1 1 22 CYS H H -1.789 -3.196 1.586 1.00 . A A . 22 CYS H 1 1 2 730 1 1 22 CYS HA H -0.296 -1.942 -0.699 1.00 . A A . 22 CYS HA 1 1 2 731 1 1 22 CYS HB2 H -0.031 -4.544 0.819 1.00 . A A . 22 CYS HB2 1 1 2 732 1 1 22 CYS HB3 H 0.794 -4.271 -0.715 1.00 . A A . 22 CYS HB3 1 1 2 733 1 1 22 CYS N N -1.471 -2.485 0.991 1.00 . A A . 22 CYS N 1 1 2 734 1 1 22 CYS O O -2.590 -4.207 -0.891 1.00 . A A . 22 CYS O 1 1 2 735 1 1 22 CYS SG S 1.680 -2.879 1.021 1.00 . A A . 22 CYS SG 1 1 2 736 1 1 23 SER C C -1.844 -5.338 -3.899 1.00 . A A . 23 SER C 1 1 2 737 1 1 23 SER CA C -2.339 -3.924 -3.571 1.00 . A A . 23 SER CA 1 1 2 738 1 1 23 SER CB C -2.253 -3.025 -4.805 1.00 . A A . 23 SER CB 1 1 2 739 1 1 23 SER H H -0.705 -2.722 -2.827 1.00 . A A . 23 SER H 1 1 2 740 1 1 23 SER HA H -3.357 -3.957 -3.212 1.00 . A A . 23 SER HA 1 1 2 741 1 1 23 SER HB2 H -2.136 -1.999 -4.503 1.00 . A A . 23 SER HB2 1 1 2 742 1 1 23 SER HB3 H -1.404 -3.320 -5.406 1.00 . A A . 23 SER HB3 1 1 2 743 1 1 23 SER HG H -4.157 -2.719 -5.078 1.00 . A A . 23 SER HG 1 1 2 744 1 1 23 SER N N -1.453 -3.292 -2.546 1.00 . A A . 23 SER N 1 1 2 745 1 1 23 SER O O -0.654 -5.589 -3.914 1.00 . A A . 23 SER O 1 1 2 746 1 1 23 SER OG O -3.451 -3.155 -5.562 1.00 . A A . 23 SER OG 1 1 2 747 1 1 24 PRO C C -1.847 -7.751 -5.887 1.00 . A A . 24 PRO C 1 1 2 748 1 1 24 PRO CA C -2.444 -7.631 -4.475 1.00 . A A . 24 PRO CA 1 1 2 749 1 1 24 PRO CB C -3.789 -8.351 -4.388 1.00 . A A . 24 PRO CB 1 1 2 750 1 1 24 PRO CD C -4.236 -5.991 -4.149 1.00 . A A . 24 PRO CD 1 1 2 751 1 1 24 PRO CG C -4.816 -7.293 -4.634 1.00 . A A . 24 PRO CG 1 1 2 752 1 1 24 PRO HA H -1.765 -8.034 -3.742 1.00 . A A . 24 PRO HA 1 1 2 753 1 1 24 PRO HB2 H -3.851 -9.123 -5.143 1.00 . A A . 24 PRO HB2 1 1 2 754 1 1 24 PRO HB3 H -3.925 -8.776 -3.406 1.00 . A A . 24 PRO HB3 1 1 2 755 1 1 24 PRO HD2 H -4.495 -5.188 -4.825 1.00 . A A . 24 PRO HD2 1 1 2 756 1 1 24 PRO HD3 H -4.578 -5.772 -3.150 1.00 . A A . 24 PRO HD3 1 1 2 757 1 1 24 PRO HG2 H -5.033 -7.232 -5.692 1.00 . A A . 24 PRO HG2 1 1 2 758 1 1 24 PRO HG3 H -5.716 -7.518 -4.084 1.00 . A A . 24 PRO HG3 1 1 2 759 1 1 24 PRO N N -2.784 -6.220 -4.148 1.00 . A A . 24 PRO N 1 1 2 760 1 1 24 PRO O O -1.138 -8.695 -6.182 1.00 . A A . 24 PRO O 1 1 2 761 1 1 25 THR C C -0.640 -5.708 -8.460 1.00 . A A . 25 THR C 1 1 2 762 1 1 25 THR CA C -1.578 -6.889 -8.154 1.00 . A A . 25 THR CA 1 1 2 763 1 1 25 THR CB C -2.801 -6.863 -9.089 1.00 . A A . 25 THR CB 1 1 2 764 1 1 25 THR CG2 C -3.706 -5.670 -8.761 1.00 . A A . 25 THR CG2 1 1 2 765 1 1 25 THR H H -2.706 -6.064 -6.504 1.00 . A A . 25 THR H 1 1 2 766 1 1 25 THR HA H -1.047 -7.817 -8.287 1.00 . A A . 25 THR HA 1 1 2 767 1 1 25 THR HB H -3.363 -7.773 -8.968 1.00 . A A . 25 THR HB 1 1 2 768 1 1 25 THR HG1 H -2.247 -7.650 -10.782 1.00 . A A . 25 THR HG1 1 1 2 769 1 1 25 THR HG21 H -3.133 -4.911 -8.251 1.00 . A A . 25 THR HG21 1 1 2 770 1 1 25 THR HG22 H -4.515 -5.997 -8.125 1.00 . A A . 25 THR HG22 1 1 2 771 1 1 25 THR HG23 H -4.109 -5.263 -9.676 1.00 . A A . 25 THR HG23 1 1 2 772 1 1 25 THR N N -2.130 -6.812 -6.761 1.00 . A A . 25 THR N 1 1 2 773 1 1 25 THR O O 0.221 -5.807 -9.312 1.00 . A A . 25 THR O 1 1 2 774 1 1 25 THR OG1 O -2.362 -6.760 -10.437 1.00 . A A . 25 THR OG1 1 1 2 775 1 1 26 TRP C C 1.392 -3.493 -7.266 1.00 . A A . 26 TRP C 1 1 2 776 1 1 26 TRP CA C 0.082 -3.413 -8.072 1.00 . A A . 26 TRP CA 1 1 2 777 1 1 26 TRP CB C -0.724 -2.179 -7.654 1.00 . A A . 26 TRP CB 1 1 2 778 1 1 26 TRP CD1 C -2.401 -2.882 -9.426 1.00 . A A . 26 TRP CD1 1 1 2 779 1 1 26 TRP CD2 C -3.248 -1.385 -7.978 1.00 . A A . 26 TRP CD2 1 1 2 780 1 1 26 TRP CE2 C -4.280 -1.694 -8.893 1.00 . A A . 26 TRP CE2 1 1 2 781 1 1 26 TRP CE3 C -3.522 -0.456 -6.958 1.00 . A A . 26 TRP CE3 1 1 2 782 1 1 26 TRP CG C -2.064 -2.160 -8.332 1.00 . A A . 26 TRP CG 1 1 2 783 1 1 26 TRP CH2 C -5.797 -0.181 -7.782 1.00 . A A . 26 TRP CH2 1 1 2 784 1 1 26 TRP CZ2 C -5.541 -1.104 -8.801 1.00 . A A . 26 TRP CZ2 1 1 2 785 1 1 26 TRP CZ3 C -4.789 0.142 -6.863 1.00 . A A . 26 TRP CZ3 1 1 2 786 1 1 26 TRP H H -1.506 -4.524 -7.112 1.00 . A A . 26 TRP H 1 1 2 787 1 1 26 TRP HA H 0.303 -3.362 -9.127 1.00 . A A . 26 TRP HA 1 1 2 788 1 1 26 TRP HB2 H -0.865 -2.188 -6.586 1.00 . A A . 26 TRP HB2 1 1 2 789 1 1 26 TRP HB3 H -0.176 -1.294 -7.930 1.00 . A A . 26 TRP HB3 1 1 2 790 1 1 26 TRP HD1 H -1.752 -3.568 -9.951 1.00 . A A . 26 TRP HD1 1 1 2 791 1 1 26 TRP HE1 H -4.204 -3.022 -10.494 1.00 . A A . 26 TRP HE1 1 1 2 792 1 1 26 TRP HE3 H -2.754 -0.200 -6.245 1.00 . A A . 26 TRP HE3 1 1 2 793 1 1 26 TRP HH2 H -6.769 0.281 -7.703 1.00 . A A . 26 TRP HH2 1 1 2 794 1 1 26 TRP HZ2 H -6.315 -1.358 -9.510 1.00 . A A . 26 TRP HZ2 1 1 2 795 1 1 26 TRP HZ3 H -4.989 0.854 -6.077 1.00 . A A . 26 TRP HZ3 1 1 2 796 1 1 26 TRP N N -0.802 -4.592 -7.789 1.00 . A A . 26 TRP N 1 1 2 797 1 1 26 TRP NE1 N -3.716 -2.617 -9.750 1.00 . A A . 26 TRP NE1 1 1 2 798 1 1 26 TRP O O 2.357 -2.827 -7.587 1.00 . A A . 26 TRP O 1 1 2 799 1 1 27 LYS C C 3.083 -3.097 -4.751 1.00 . A A . 27 LYS C 1 1 2 800 1 1 27 LYS CA C 2.662 -4.435 -5.386 1.00 . A A . 27 LYS CA 1 1 2 801 1 1 27 LYS CB C 3.761 -4.951 -6.328 1.00 . A A . 27 LYS CB 1 1 2 802 1 1 27 LYS CD C 4.464 -6.964 -5.015 1.00 . A A . 27 LYS CD 1 1 2 803 1 1 27 LYS CE C 3.670 -8.139 -4.434 1.00 . A A . 27 LYS CE 1 1 2 804 1 1 27 LYS CG C 3.787 -6.481 -6.302 1.00 . A A . 27 LYS CG 1 1 2 805 1 1 27 LYS H H 0.630 -4.818 -5.993 1.00 . A A . 27 LYS H 1 1 2 806 1 1 27 LYS HA H 2.492 -5.164 -4.610 1.00 . A A . 27 LYS HA 1 1 2 807 1 1 27 LYS HB2 H 3.566 -4.612 -7.334 1.00 . A A . 27 LYS HB2 1 1 2 808 1 1 27 LYS HB3 H 4.720 -4.574 -6.002 1.00 . A A . 27 LYS HB3 1 1 2 809 1 1 27 LYS HD2 H 5.472 -7.282 -5.237 1.00 . A A . 27 LYS HD2 1 1 2 810 1 1 27 LYS HD3 H 4.490 -6.159 -4.296 1.00 . A A . 27 LYS HD3 1 1 2 811 1 1 27 LYS HE2 H 2.642 -7.851 -4.273 1.00 . A A . 27 LYS HE2 1 1 2 812 1 1 27 LYS HE3 H 3.725 -8.990 -5.094 1.00 . A A . 27 LYS HE3 1 1 2 813 1 1 27 LYS HG2 H 2.775 -6.859 -6.340 1.00 . A A . 27 LYS HG2 1 1 2 814 1 1 27 LYS HG3 H 4.339 -6.847 -7.154 1.00 . A A . 27 LYS HG3 1 1 2 815 1 1 27 LYS HZ1 H 4.278 -7.632 -2.506 1.00 . A A . 27 LYS HZ1 1 1 2 816 1 1 27 LYS HZ2 H 5.330 -8.701 -3.305 1.00 . A A . 27 LYS HZ2 1 1 2 817 1 1 27 LYS HZ3 H 3.850 -9.262 -2.691 1.00 . A A . 27 LYS HZ3 1 1 2 818 1 1 27 LYS N N 1.425 -4.297 -6.226 1.00 . A A . 27 LYS N 1 1 2 819 1 1 27 LYS NZ N 4.333 -8.457 -3.136 1.00 . A A . 27 LYS NZ 1 1 2 820 1 1 27 LYS O O 4.225 -2.937 -4.364 1.00 . A A . 27 LYS O 1 1 2 821 1 1 28 TRP C C 1.520 -0.437 -2.927 1.00 . A A . 28 TRP C 1 1 2 822 1 1 28 TRP CA C 2.574 -0.854 -3.959 1.00 . A A . 28 TRP CA 1 1 2 823 1 1 28 TRP CB C 2.738 0.192 -5.085 1.00 . A A . 28 TRP CB 1 1 2 824 1 1 28 TRP CD1 C 0.319 0.982 -5.145 1.00 . A A . 28 TRP CD1 1 1 2 825 1 1 28 TRP CD2 C 1.138 0.509 -7.183 1.00 . A A . 28 TRP CD2 1 1 2 826 1 1 28 TRP CE2 C -0.199 0.928 -7.373 1.00 . A A . 28 TRP CE2 1 1 2 827 1 1 28 TRP CE3 C 1.888 0.155 -8.317 1.00 . A A . 28 TRP CE3 1 1 2 828 1 1 28 TRP CG C 1.440 0.534 -5.759 1.00 . A A . 28 TRP CG 1 1 2 829 1 1 28 TRP CH2 C -0.012 0.640 -9.760 1.00 . A A . 28 TRP CH2 1 1 2 830 1 1 28 TRP CZ2 C -0.772 0.994 -8.642 1.00 . A A . 28 TRP CZ2 1 1 2 831 1 1 28 TRP CZ3 C 1.316 0.221 -9.598 1.00 . A A . 28 TRP CZ3 1 1 2 832 1 1 28 TRP H H 1.261 -2.290 -4.904 1.00 . A A . 28 TRP H 1 1 2 833 1 1 28 TRP HA H 3.525 -0.983 -3.459 1.00 . A A . 28 TRP HA 1 1 2 834 1 1 28 TRP HB2 H 3.154 1.093 -4.664 1.00 . A A . 28 TRP HB2 1 1 2 835 1 1 28 TRP HB3 H 3.425 -0.197 -5.823 1.00 . A A . 28 TRP HB3 1 1 2 836 1 1 28 TRP HD1 H 0.199 1.131 -4.083 1.00 . A A . 28 TRP HD1 1 1 2 837 1 1 28 TRP HE1 H -1.567 1.518 -5.921 1.00 . A A . 28 TRP HE1 1 1 2 838 1 1 28 TRP HE3 H 2.912 -0.166 -8.203 1.00 . A A . 28 TRP HE3 1 1 2 839 1 1 28 TRP HH2 H -0.447 0.689 -10.748 1.00 . A A . 28 TRP HH2 1 1 2 840 1 1 28 TRP HZ2 H -1.796 1.318 -8.762 1.00 . A A . 28 TRP HZ2 1 1 2 841 1 1 28 TRP HZ3 H 1.901 -0.053 -10.462 1.00 . A A . 28 TRP HZ3 1 1 2 842 1 1 28 TRP N N 2.184 -2.147 -4.610 1.00 . A A . 28 TRP N 1 1 2 843 1 1 28 TRP NE1 N -0.657 1.203 -6.102 1.00 . A A . 28 TRP NE1 1 1 2 844 1 1 28 TRP O O 0.390 -0.892 -2.957 1.00 . A A . 28 TRP O 1 1 2 845 1 1 29 CYS C C -0.173 1.731 -1.538 1.00 . A A . 29 CYS C 1 1 2 846 1 1 29 CYS CA C 0.932 0.849 -0.941 1.00 . A A . 29 CYS CA 1 1 2 847 1 1 29 CYS CB C 1.763 1.659 0.060 1.00 . A A . 29 CYS CB 1 1 2 848 1 1 29 CYS H H 2.815 0.743 -1.988 1.00 . A A . 29 CYS H 1 1 2 849 1 1 29 CYS HA H 0.504 -0.007 -0.450 1.00 . A A . 29 CYS HA 1 1 2 850 1 1 29 CYS HB2 H 2.332 2.407 -0.469 1.00 . A A . 29 CYS HB2 1 1 2 851 1 1 29 CYS HB3 H 1.103 2.141 0.765 1.00 . A A . 29 CYS HB3 1 1 2 852 1 1 29 CYS N N 1.893 0.409 -1.998 1.00 . A A . 29 CYS N 1 1 2 853 1 1 29 CYS O O 0.087 2.620 -2.319 1.00 . A A . 29 CYS O 1 1 2 854 1 1 29 CYS SG S 2.898 0.565 0.952 1.00 . A A . 29 CYS SG 1 1 2 855 1 1 30 VAL C C -3.325 2.895 -0.495 1.00 . A A . 30 VAL C 1 1 2 856 1 1 30 VAL CA C -2.543 2.302 -1.674 1.00 . A A . 30 VAL CA 1 1 2 857 1 1 30 VAL CB C -3.423 1.324 -2.463 1.00 . A A . 30 VAL CB 1 1 2 858 1 1 30 VAL CG1 C -2.623 0.736 -3.625 1.00 . A A . 30 VAL CG1 1 1 2 859 1 1 30 VAL CG2 C -3.901 0.189 -1.546 1.00 . A A . 30 VAL CG2 1 1 2 860 1 1 30 VAL H H -1.572 0.768 -0.519 1.00 . A A . 30 VAL H 1 1 2 861 1 1 30 VAL HA H -2.186 3.086 -2.324 1.00 . A A . 30 VAL HA 1 1 2 862 1 1 30 VAL HB H -4.281 1.853 -2.855 1.00 . A A . 30 VAL HB 1 1 2 863 1 1 30 VAL HG11 H -2.249 1.538 -4.241 1.00 . A A . 30 VAL HG11 1 1 2 864 1 1 30 VAL HG12 H -3.261 0.095 -4.215 1.00 . A A . 30 VAL HG12 1 1 2 865 1 1 30 VAL HG13 H -1.794 0.162 -3.238 1.00 . A A . 30 VAL HG13 1 1 2 866 1 1 30 VAL HG21 H -3.464 -0.745 -1.869 1.00 . A A . 30 VAL HG21 1 1 2 867 1 1 30 VAL HG22 H -4.977 0.118 -1.592 1.00 . A A . 30 VAL HG22 1 1 2 868 1 1 30 VAL HG23 H -3.597 0.394 -0.529 1.00 . A A . 30 VAL HG23 1 1 2 869 1 1 30 VAL N N -1.400 1.488 -1.158 1.00 . A A . 30 VAL N 1 1 2 870 1 1 30 VAL O O -3.183 2.457 0.628 1.00 . A A . 30 VAL O 1 1 2 871 1 1 31 TYR C C -5.870 3.455 1.011 1.00 . A A . 31 TYR C 1 1 2 872 1 1 31 TYR CA C -4.935 4.495 0.378 1.00 . A A . 31 TYR CA 1 1 2 873 1 1 31 TYR CB C -5.748 5.624 -0.267 1.00 . A A . 31 TYR CB 1 1 2 874 1 1 31 TYR CD1 C -5.152 7.271 1.551 1.00 . A A . 31 TYR CD1 1 1 2 875 1 1 31 TYR CD2 C -7.490 6.945 0.994 1.00 . A A . 31 TYR CD2 1 1 2 876 1 1 31 TYR CE1 C -5.514 8.210 2.524 1.00 . A A . 31 TYR CE1 1 1 2 877 1 1 31 TYR CE2 C -7.851 7.886 1.968 1.00 . A A . 31 TYR CE2 1 1 2 878 1 1 31 TYR CG C -6.139 6.638 0.786 1.00 . A A . 31 TYR CG 1 1 2 879 1 1 31 TYR CZ C -6.864 8.518 2.732 1.00 . A A . 31 TYR CZ 1 1 2 880 1 1 31 TYR H H -4.250 4.221 -1.655 1.00 . A A . 31 TYR H 1 1 2 881 1 1 31 TYR HA H -4.269 4.902 1.123 1.00 . A A . 31 TYR HA 1 1 2 882 1 1 31 TYR HB2 H -5.153 6.106 -1.029 1.00 . A A . 31 TYR HB2 1 1 2 883 1 1 31 TYR HB3 H -6.640 5.212 -0.716 1.00 . A A . 31 TYR HB3 1 1 2 884 1 1 31 TYR HD1 H -4.111 7.034 1.392 1.00 . A A . 31 TYR HD1 1 1 2 885 1 1 31 TYR HD2 H -8.253 6.459 0.405 1.00 . A A . 31 TYR HD2 1 1 2 886 1 1 31 TYR HE1 H -4.752 8.697 3.114 1.00 . A A . 31 TYR HE1 1 1 2 887 1 1 31 TYR HE2 H -8.893 8.123 2.129 1.00 . A A . 31 TYR HE2 1 1 2 888 1 1 31 TYR HH H -7.255 8.997 4.538 1.00 . A A . 31 TYR HH 1 1 2 889 1 1 31 TYR N N -4.149 3.882 -0.740 1.00 . A A . 31 TYR N 1 1 2 890 1 1 31 TYR O O -6.389 2.583 0.341 1.00 . A A . 31 TYR O 1 1 2 891 1 1 31 TYR OH O -7.220 9.445 3.690 1.00 . A A . 31 TYR OH 1 1 2 892 1 1 32 ALA C C -8.315 3.235 3.351 1.00 . A A . 32 ALA C 1 1 2 893 1 1 32 ALA CA C -6.984 2.567 2.985 1.00 . A A . 32 ALA CA 1 1 2 894 1 1 32 ALA CB C -6.227 2.147 4.247 1.00 . A A . 32 ALA CB 1 1 2 895 1 1 32 ALA H H -5.653 4.259 2.819 1.00 . A A . 32 ALA H 1 1 2 896 1 1 32 ALA HA H -7.154 1.707 2.356 1.00 . A A . 32 ALA HA 1 1 2 897 1 1 32 ALA HB1 H -6.737 1.317 4.714 1.00 . A A . 32 ALA HB1 1 1 2 898 1 1 32 ALA HB2 H -6.186 2.978 4.936 1.00 . A A . 32 ALA HB2 1 1 2 899 1 1 32 ALA HB3 H -5.224 1.849 3.981 1.00 . A A . 32 ALA HB3 1 1 2 900 1 1 32 ALA N N -6.084 3.545 2.300 1.00 . A A . 32 ALA N 1 1 2 901 1 1 32 ALA O O -8.412 3.944 4.336 1.00 . A A . 32 ALA O 1 1 2 902 1 1 33 ARG C C -11.774 2.975 2.034 1.00 . A A . 33 ARG C 1 1 2 903 1 1 33 ARG CA C -10.664 3.641 2.860 1.00 . A A . 33 ARG CA 1 1 2 904 1 1 33 ARG CB C -10.512 5.114 2.466 1.00 . A A . 33 ARG CB 1 1 2 905 1 1 33 ARG CD C -12.290 6.001 3.982 1.00 . A A . 33 ARG CD 1 1 2 906 1 1 33 ARG CG C -10.789 6.000 3.683 1.00 . A A . 33 ARG CG 1 1 2 907 1 1 33 ARG CZ C -13.491 8.072 4.368 1.00 . A A . 33 ARG CZ 1 1 2 908 1 1 33 ARG H H -9.234 2.443 1.772 1.00 . A A . 33 ARG H 1 1 2 909 1 1 33 ARG HA H -10.883 3.565 3.914 1.00 . A A . 33 ARG HA 1 1 2 910 1 1 33 ARG HB2 H -9.507 5.291 2.112 1.00 . A A . 33 ARG HB2 1 1 2 911 1 1 33 ARG HB3 H -11.216 5.352 1.682 1.00 . A A . 33 ARG HB3 1 1 2 912 1 1 33 ARG HD2 H -12.787 5.225 3.414 1.00 . A A . 33 ARG HD2 1 1 2 913 1 1 33 ARG HD3 H -12.465 5.865 5.038 1.00 . A A . 33 ARG HD3 1 1 2 914 1 1 33 ARG HE H -12.543 7.686 2.663 1.00 . A A . 33 ARG HE 1 1 2 915 1 1 33 ARG HG2 H -10.250 5.617 4.537 1.00 . A A . 33 ARG HG2 1 1 2 916 1 1 33 ARG HG3 H -10.464 7.008 3.474 1.00 . A A . 33 ARG HG3 1 1 2 917 1 1 33 ARG HH11 H -15.068 6.833 4.322 1.00 . A A . 33 ARG HH11 1 1 2 918 1 1 33 ARG HH12 H -15.251 8.240 5.317 1.00 . A A . 33 ARG HH12 1 1 2 919 1 1 33 ARG HH21 H -12.083 9.480 4.603 1.00 . A A . 33 ARG HH21 1 1 2 920 1 1 33 ARG HH22 H -13.555 9.742 5.475 1.00 . A A . 33 ARG HH22 1 1 2 921 1 1 33 ARG N N -9.338 3.016 2.562 1.00 . A A . 33 ARG N 1 1 2 922 1 1 33 ARG NE N -12.770 7.346 3.555 1.00 . A A . 33 ARG NE 1 1 2 923 1 1 33 ARG NH1 N -14.698 7.684 4.694 1.00 . A A . 33 ARG NH1 1 1 2 924 1 1 33 ARG NH2 N -13.005 9.184 4.853 1.00 . A A . 33 ARG NH2 1 1 2 925 1 1 33 ARG O O -11.686 2.908 0.822 1.00 . A A . 33 ARG O 1 1 2 926 1 1 34 PRO C C -14.778 2.879 1.267 1.00 . A A . 34 PRO C 1 1 2 927 1 1 34 PRO CA C -13.936 1.848 2.033 1.00 . A A . 34 PRO CA 1 1 2 928 1 1 34 PRO CB C -14.735 1.227 3.179 1.00 . A A . 34 PRO CB 1 1 2 929 1 1 34 PRO CD C -12.979 2.547 4.178 1.00 . A A . 34 PRO CD 1 1 2 930 1 1 34 PRO CG C -14.385 2.043 4.381 1.00 . A A . 34 PRO CG 1 1 2 931 1 1 34 PRO HA H -13.585 1.076 1.368 1.00 . A A . 34 PRO HA 1 1 2 932 1 1 34 PRO HB2 H -15.795 1.291 2.973 1.00 . A A . 34 PRO HB2 1 1 2 933 1 1 34 PRO HB3 H -14.441 0.201 3.329 1.00 . A A . 34 PRO HB3 1 1 2 934 1 1 34 PRO HD2 H -12.883 3.558 4.550 1.00 . A A . 34 PRO HD2 1 1 2 935 1 1 34 PRO HD3 H -12.269 1.893 4.660 1.00 . A A . 34 PRO HD3 1 1 2 936 1 1 34 PRO HG2 H -15.070 2.876 4.474 1.00 . A A . 34 PRO HG2 1 1 2 937 1 1 34 PRO HG3 H -14.427 1.430 5.269 1.00 . A A . 34 PRO HG3 1 1 2 938 1 1 34 PRO N N -12.794 2.508 2.718 1.00 . A A . 34 PRO N 1 1 2 939 1 1 34 PRO O O -15.232 3.830 1.886 1.00 . A A . 34 PRO O 1 1 2 940 1 1 34 PRO OXT O -14.951 2.700 0.074 1.00 . A A . 34 PRO OXT 1 1 3 941 1 1 1 GLY C C 9.029 3.774 5.783 1.00 . A A . 1 GLY C 1 1 3 942 1 1 1 GLY CA C 10.328 3.020 6.084 1.00 . A A . 1 GLY CA 1 1 3 943 1 1 1 GLY H1 H 12.253 3.502 6.723 1.00 . A A . 1 GLY H1 1 1 3 944 1 1 1 GLY H2 H 11.112 4.739 6.968 1.00 . A A . 1 GLY H2 1 1 3 945 1 1 1 GLY H3 H 11.710 4.427 5.410 1.00 . A A . 1 GLY H3 1 1 3 946 1 1 1 GLY HA2 H 10.579 2.384 5.245 1.00 . A A . 1 GLY HA2 1 1 3 947 1 1 1 GLY HA3 H 10.192 2.414 6.967 1.00 . A A . 1 GLY HA3 1 1 3 948 1 1 1 GLY N N 11.434 3.996 6.314 1.00 . A A . 1 GLY N 1 1 3 949 1 1 1 GLY O O 8.223 4.012 6.663 1.00 . A A . 1 GLY O 1 1 3 950 1 1 2 CYS C C 7.132 4.496 2.760 1.00 . A A . 2 CYS C 1 1 3 951 1 1 2 CYS CA C 7.576 4.887 4.175 1.00 . A A . 2 CYS CA 1 1 3 952 1 1 2 CYS CB C 7.962 6.367 4.237 1.00 . A A . 2 CYS CB 1 1 3 953 1 1 2 CYS H H 9.487 3.942 3.855 1.00 . A A . 2 CYS H 1 1 3 954 1 1 2 CYS HA H 6.790 4.680 4.886 1.00 . A A . 2 CYS HA 1 1 3 955 1 1 2 CYS HB2 H 8.207 6.630 5.256 1.00 . A A . 2 CYS HB2 1 1 3 956 1 1 2 CYS HB3 H 8.817 6.544 3.604 1.00 . A A . 2 CYS HB3 1 1 3 957 1 1 2 CYS N N 8.822 4.148 4.545 1.00 . A A . 2 CYS N 1 1 3 958 1 1 2 CYS O O 7.943 4.356 1.863 1.00 . A A . 2 CYS O 1 1 3 959 1 1 2 CYS SG S 6.577 7.388 3.677 1.00 . A A . 2 CYS SG 1 1 3 960 1 1 3 GLY C C 4.739 5.161 0.517 1.00 . A A . 3 GLY C 1 1 3 961 1 1 3 GLY CA C 5.340 3.935 1.209 1.00 . A A . 3 GLY CA 1 1 3 962 1 1 3 GLY H H 5.221 4.438 3.298 1.00 . A A . 3 GLY H 1 1 3 963 1 1 3 GLY HA2 H 6.154 3.547 0.614 1.00 . A A . 3 GLY HA2 1 1 3 964 1 1 3 GLY HA3 H 4.579 3.177 1.315 1.00 . A A . 3 GLY HA3 1 1 3 965 1 1 3 GLY N N 5.850 4.320 2.559 1.00 . A A . 3 GLY N 1 1 3 966 1 1 3 GLY O O 5.439 6.098 0.181 1.00 . A A . 3 GLY O 1 1 3 967 1 1 4 GLY C C 1.660 5.826 -1.280 1.00 . A A . 4 GLY C 1 1 3 968 1 1 4 GLY CA C 2.791 6.321 -0.374 1.00 . A A . 4 GLY CA 1 1 3 969 1 1 4 GLY H H 2.906 4.392 0.580 1.00 . A A . 4 GLY H 1 1 3 970 1 1 4 GLY HA2 H 2.389 6.991 0.373 1.00 . A A . 4 GLY HA2 1 1 3 971 1 1 4 GLY HA3 H 3.519 6.847 -0.973 1.00 . A A . 4 GLY HA3 1 1 3 972 1 1 4 GLY N N 3.446 5.159 0.300 1.00 . A A . 4 GLY N 1 1 3 973 1 1 4 GLY O O 0.910 4.939 -0.920 1.00 . A A . 4 GLY O 1 1 3 974 1 1 5 LEU C C 1.020 5.012 -4.468 1.00 . A A . 5 LEU C 1 1 3 975 1 1 5 LEU CA C 0.455 5.961 -3.398 1.00 . A A . 5 LEU CA 1 1 3 976 1 1 5 LEU CB C -0.056 7.262 -4.034 1.00 . A A . 5 LEU CB 1 1 3 977 1 1 5 LEU CD1 C -1.980 6.221 -5.264 1.00 . A A . 5 LEU CD1 1 1 3 978 1 1 5 LEU CD2 C -2.234 6.822 -2.847 1.00 . A A . 5 LEU CD2 1 1 3 979 1 1 5 LEU CG C -1.586 7.227 -4.179 1.00 . A A . 5 LEU CG 1 1 3 980 1 1 5 LEU H H 2.157 7.104 -2.719 1.00 . A A . 5 LEU H 1 1 3 981 1 1 5 LEU HA H -0.341 5.479 -2.857 1.00 . A A . 5 LEU HA 1 1 3 982 1 1 5 LEU HB2 H 0.222 8.098 -3.409 1.00 . A A . 5 LEU HB2 1 1 3 983 1 1 5 LEU HB3 H 0.391 7.383 -5.010 1.00 . A A . 5 LEU HB3 1 1 3 984 1 1 5 LEU HD11 H -1.259 6.256 -6.066 1.00 . A A . 5 LEU HD11 1 1 3 985 1 1 5 LEU HD12 H -2.958 6.471 -5.648 1.00 . A A . 5 LEU HD12 1 1 3 986 1 1 5 LEU HD13 H -2.002 5.227 -4.842 1.00 . A A . 5 LEU HD13 1 1 3 987 1 1 5 LEU HD21 H -1.468 6.697 -2.097 1.00 . A A . 5 LEU HD21 1 1 3 988 1 1 5 LEU HD22 H -2.768 5.893 -2.973 1.00 . A A . 5 LEU HD22 1 1 3 989 1 1 5 LEU HD23 H -2.922 7.593 -2.535 1.00 . A A . 5 LEU HD23 1 1 3 990 1 1 5 LEU HG H -1.937 8.209 -4.462 1.00 . A A . 5 LEU HG 1 1 3 991 1 1 5 LEU N N 1.536 6.394 -2.455 1.00 . A A . 5 LEU N 1 1 3 992 1 1 5 LEU O O 0.279 4.326 -5.149 1.00 . A A . 5 LEU O 1 1 3 993 1 1 6 MET C C 4.331 3.609 -5.160 1.00 . A A . 6 MET C 1 1 3 994 1 1 6 MET CA C 2.936 4.050 -5.631 1.00 . A A . 6 MET CA 1 1 3 995 1 1 6 MET CB C 3.021 4.887 -6.912 1.00 . A A . 6 MET CB 1 1 3 996 1 1 6 MET CE C 1.074 4.137 -10.458 1.00 . A A . 6 MET CE 1 1 3 997 1 1 6 MET CG C 2.353 4.134 -8.065 1.00 . A A . 6 MET CG 1 1 3 998 1 1 6 MET H H 2.901 5.516 -4.054 1.00 . A A . 6 MET H 1 1 3 999 1 1 6 MET HA H 2.307 3.190 -5.792 1.00 . A A . 6 MET HA 1 1 3 1000 1 1 6 MET HB2 H 2.516 5.828 -6.760 1.00 . A A . 6 MET HB2 1 1 3 1001 1 1 6 MET HB3 H 4.056 5.068 -7.158 1.00 . A A . 6 MET HB3 1 1 3 1002 1 1 6 MET HE1 H 1.861 3.410 -10.607 1.00 . A A . 6 MET HE1 1 1 3 1003 1 1 6 MET HE2 H 0.888 4.656 -11.386 1.00 . A A . 6 MET HE2 1 1 3 1004 1 1 6 MET HE3 H 0.169 3.638 -10.140 1.00 . A A . 6 MET HE3 1 1 3 1005 1 1 6 MET HG2 H 3.096 3.562 -8.600 1.00 . A A . 6 MET HG2 1 1 3 1006 1 1 6 MET HG3 H 1.597 3.468 -7.673 1.00 . A A . 6 MET HG3 1 1 3 1007 1 1 6 MET N N 2.323 4.960 -4.616 1.00 . A A . 6 MET N 1 1 3 1008 1 1 6 MET O O 5.282 3.590 -5.920 1.00 . A A . 6 MET O 1 1 3 1009 1 1 6 MET SD S 1.583 5.323 -9.191 1.00 . A A . 6 MET SD 1 1 3 1010 1 1 7 ALA C C 5.955 1.302 -3.535 1.00 . A A . 7 ALA C 1 1 3 1011 1 1 7 ALA CA C 5.777 2.814 -3.359 1.00 . A A . 7 ALA CA 1 1 3 1012 1 1 7 ALA CB C 5.729 3.183 -1.874 1.00 . A A . 7 ALA CB 1 1 3 1013 1 1 7 ALA H H 3.670 3.279 -3.312 1.00 . A A . 7 ALA H 1 1 3 1014 1 1 7 ALA HA H 6.583 3.340 -3.840 1.00 . A A . 7 ALA HA 1 1 3 1015 1 1 7 ALA HB1 H 5.682 2.283 -1.279 1.00 . A A . 7 ALA HB1 1 1 3 1016 1 1 7 ALA HB2 H 4.856 3.789 -1.682 1.00 . A A . 7 ALA HB2 1 1 3 1017 1 1 7 ALA HB3 H 6.616 3.741 -1.613 1.00 . A A . 7 ALA HB3 1 1 3 1018 1 1 7 ALA N N 4.454 3.255 -3.902 1.00 . A A . 7 ALA N 1 1 3 1019 1 1 7 ALA O O 5.280 0.675 -4.323 1.00 . A A . 7 ALA O 1 1 3 1020 1 1 8 GLY C C 6.656 -1.431 -1.621 1.00 . A A . 8 GLY C 1 1 3 1021 1 1 8 GLY CA C 7.097 -0.753 -2.920 1.00 . A A . 8 GLY CA 1 1 3 1022 1 1 8 GLY H H 7.404 1.249 -2.182 1.00 . A A . 8 GLY H 1 1 3 1023 1 1 8 GLY HA2 H 6.523 -1.145 -3.747 1.00 . A A . 8 GLY HA2 1 1 3 1024 1 1 8 GLY HA3 H 8.146 -0.944 -3.084 1.00 . A A . 8 GLY HA3 1 1 3 1025 1 1 8 GLY N N 6.868 0.718 -2.807 1.00 . A A . 8 GLY N 1 1 3 1026 1 1 8 GLY O O 7.368 -1.415 -0.634 1.00 . A A . 8 GLY O 1 1 3 1027 1 1 9 CYS C C 5.004 -4.220 -0.529 1.00 . A A . 9 CYS C 1 1 3 1028 1 1 9 CYS CA C 4.993 -2.690 -0.368 1.00 . A A . 9 CYS CA 1 1 3 1029 1 1 9 CYS CB C 3.566 -2.165 -0.167 1.00 . A A . 9 CYS CB 1 1 3 1030 1 1 9 CYS H H 4.927 -2.012 -2.418 1.00 . A A . 9 CYS H 1 1 3 1031 1 1 9 CYS HA H 5.605 -2.403 0.473 1.00 . A A . 9 CYS HA 1 1 3 1032 1 1 9 CYS HB2 H 3.213 -2.451 0.811 1.00 . A A . 9 CYS HB2 1 1 3 1033 1 1 9 CYS HB3 H 3.567 -1.087 -0.245 1.00 . A A . 9 CYS HB3 1 1 3 1034 1 1 9 CYS N N 5.485 -2.018 -1.611 1.00 . A A . 9 CYS N 1 1 3 1035 1 1 9 CYS O O 4.104 -4.907 -0.081 1.00 . A A . 9 CYS O 1 1 3 1036 1 1 9 CYS SG S 2.463 -2.855 -1.428 1.00 . A A . 9 CYS SG 1 1 3 1037 1 1 10 ASP C C 6.279 -6.936 0.032 1.00 . A A . 10 ASP C 1 1 3 1038 1 1 10 ASP CA C 6.095 -6.249 -1.329 1.00 . A A . 10 ASP CA 1 1 3 1039 1 1 10 ASP CB C 7.314 -6.498 -2.225 1.00 . A A . 10 ASP CB 1 1 3 1040 1 1 10 ASP CG C 7.335 -7.965 -2.667 1.00 . A A . 10 ASP CG 1 1 3 1041 1 1 10 ASP H H 6.744 -4.194 -1.497 1.00 . A A . 10 ASP H 1 1 3 1042 1 1 10 ASP HA H 5.202 -6.611 -1.813 1.00 . A A . 10 ASP HA 1 1 3 1043 1 1 10 ASP HB2 H 7.258 -5.861 -3.095 1.00 . A A . 10 ASP HB2 1 1 3 1044 1 1 10 ASP HB3 H 8.214 -6.278 -1.674 1.00 . A A . 10 ASP HB3 1 1 3 1045 1 1 10 ASP N N 6.024 -4.762 -1.153 1.00 . A A . 10 ASP N 1 1 3 1046 1 1 10 ASP O O 6.641 -6.308 1.010 1.00 . A A . 10 ASP O 1 1 3 1047 1 1 10 ASP OD1 O 6.618 -8.297 -3.596 1.00 . A A . 10 ASP OD1 1 1 3 1048 1 1 10 ASP OD2 O 8.066 -8.733 -2.064 1.00 . A A . 10 ASP OD2 1 1 3 1049 1 1 11 GLY C C 4.820 -9.481 1.864 1.00 . A A . 11 GLY C 1 1 3 1050 1 1 11 GLY CA C 6.181 -8.954 1.392 1.00 . A A . 11 GLY CA 1 1 3 1051 1 1 11 GLY H H 5.736 -8.703 -0.702 1.00 . A A . 11 GLY H 1 1 3 1052 1 1 11 GLY HA2 H 6.860 -9.784 1.254 1.00 . A A . 11 GLY HA2 1 1 3 1053 1 1 11 GLY HA3 H 6.580 -8.285 2.140 1.00 . A A . 11 GLY HA3 1 1 3 1054 1 1 11 GLY N N 6.028 -8.220 0.098 1.00 . A A . 11 GLY N 1 1 3 1055 1 1 11 GLY O O 4.751 -10.299 2.762 1.00 . A A . 11 GLY O 1 1 3 1056 1 1 12 LYS C C 2.131 -9.188 3.178 1.00 . A A . 12 LYS C 1 1 3 1057 1 1 12 LYS CA C 2.368 -9.472 1.687 1.00 . A A . 12 LYS CA 1 1 3 1058 1 1 12 LYS CB C 2.336 -10.984 1.418 1.00 . A A . 12 LYS CB 1 1 3 1059 1 1 12 LYS CD C 2.813 -12.769 -0.272 1.00 . A A . 12 LYS CD 1 1 3 1060 1 1 12 LYS CE C 4.305 -13.124 -0.312 1.00 . A A . 12 LYS CE 1 1 3 1061 1 1 12 LYS CG C 2.641 -11.260 -0.058 1.00 . A A . 12 LYS CG 1 1 3 1062 1 1 12 LYS H H 3.822 -8.348 0.561 1.00 . A A . 12 LYS H 1 1 3 1063 1 1 12 LYS HA H 1.616 -8.978 1.090 1.00 . A A . 12 LYS HA 1 1 3 1064 1 1 12 LYS HB2 H 3.074 -11.473 2.036 1.00 . A A . 12 LYS HB2 1 1 3 1065 1 1 12 LYS HB3 H 1.357 -11.369 1.657 1.00 . A A . 12 LYS HB3 1 1 3 1066 1 1 12 LYS HD2 H 2.337 -13.303 0.537 1.00 . A A . 12 LYS HD2 1 1 3 1067 1 1 12 LYS HD3 H 2.354 -13.051 -1.208 1.00 . A A . 12 LYS HD3 1 1 3 1068 1 1 12 LYS HE2 H 4.452 -14.050 -0.851 1.00 . A A . 12 LYS HE2 1 1 3 1069 1 1 12 LYS HE3 H 4.870 -12.328 -0.773 1.00 . A A . 12 LYS HE3 1 1 3 1070 1 1 12 LYS HG2 H 1.824 -10.900 -0.667 1.00 . A A . 12 LYS HG2 1 1 3 1071 1 1 12 LYS HG3 H 3.552 -10.752 -0.340 1.00 . A A . 12 LYS HG3 1 1 3 1072 1 1 12 LYS HZ1 H 4.026 -13.881 1.611 1.00 . A A . 12 LYS HZ1 1 1 3 1073 1 1 12 LYS HZ2 H 4.758 -12.348 1.568 1.00 . A A . 12 LYS HZ2 1 1 3 1074 1 1 12 LYS HZ3 H 5.653 -13.732 1.155 1.00 . A A . 12 LYS HZ3 1 1 3 1075 1 1 12 LYS N N 3.737 -9.013 1.273 1.00 . A A . 12 LYS N 1 1 3 1076 1 1 12 LYS NZ N 4.715 -13.283 1.113 1.00 . A A . 12 LYS NZ 1 1 3 1077 1 1 12 LYS O O 1.269 -9.783 3.798 1.00 . A A . 12 LYS O 1 1 3 1078 1 1 13 SER C C 3.591 -6.759 5.598 1.00 . A A . 13 SER C 1 1 3 1079 1 1 13 SER CA C 2.718 -7.965 5.208 1.00 . A A . 13 SER CA 1 1 3 1080 1 1 13 SER CB C 3.181 -9.225 5.947 1.00 . A A . 13 SER CB 1 1 3 1081 1 1 13 SER H H 3.579 -7.821 3.235 1.00 . A A . 13 SER H 1 1 3 1082 1 1 13 SER HA H 1.682 -7.767 5.429 1.00 . A A . 13 SER HA 1 1 3 1083 1 1 13 SER HB2 H 2.926 -10.098 5.371 1.00 . A A . 13 SER HB2 1 1 3 1084 1 1 13 SER HB3 H 4.254 -9.188 6.083 1.00 . A A . 13 SER HB3 1 1 3 1085 1 1 13 SER HG H 1.684 -9.723 7.083 1.00 . A A . 13 SER HG 1 1 3 1086 1 1 13 SER N N 2.892 -8.286 3.756 1.00 . A A . 13 SER N 1 1 3 1087 1 1 13 SER O O 4.143 -6.710 6.681 1.00 . A A . 13 SER O 1 1 3 1088 1 1 13 SER OG O 2.533 -9.295 7.210 1.00 . A A . 13 SER OG 1 1 3 1089 1 1 14 THR C C 3.679 -3.411 5.488 1.00 . A A . 14 THR C 1 1 3 1090 1 1 14 THR CA C 4.559 -4.590 5.043 1.00 . A A . 14 THR CA 1 1 3 1091 1 1 14 THR CB C 5.291 -4.250 3.736 1.00 . A A . 14 THR CB 1 1 3 1092 1 1 14 THR CG2 C 4.322 -3.611 2.735 1.00 . A A . 14 THR CG2 1 1 3 1093 1 1 14 THR H H 3.267 -5.849 3.857 1.00 . A A . 14 THR H 1 1 3 1094 1 1 14 THR HA H 5.277 -4.833 5.809 1.00 . A A . 14 THR HA 1 1 3 1095 1 1 14 THR HB H 5.699 -5.152 3.306 1.00 . A A . 14 THR HB 1 1 3 1096 1 1 14 THR HG1 H 7.125 -3.850 4.250 1.00 . A A . 14 THR HG1 1 1 3 1097 1 1 14 THR HG21 H 3.770 -4.385 2.222 1.00 . A A . 14 THR HG21 1 1 3 1098 1 1 14 THR HG22 H 4.880 -3.030 2.017 1.00 . A A . 14 THR HG22 1 1 3 1099 1 1 14 THR HG23 H 3.632 -2.965 3.258 1.00 . A A . 14 THR HG23 1 1 3 1100 1 1 14 THR N N 3.720 -5.788 4.723 1.00 . A A . 14 THR N 1 1 3 1101 1 1 14 THR O O 2.465 -3.486 5.465 1.00 . A A . 14 THR O 1 1 3 1102 1 1 14 THR OG1 O 6.348 -3.340 4.012 1.00 . A A . 14 THR OG1 1 1 3 1103 1 1 15 PHE C C 4.008 0.121 5.564 1.00 . A A . 15 PHE C 1 1 3 1104 1 1 15 PHE CA C 3.508 -1.124 6.306 1.00 . A A . 15 PHE CA 1 1 3 1105 1 1 15 PHE CB C 3.756 -0.990 7.810 1.00 . A A . 15 PHE CB 1 1 3 1106 1 1 15 PHE CD1 C 1.448 -0.265 8.527 1.00 . A A . 15 PHE CD1 1 1 3 1107 1 1 15 PHE CD2 C 3.290 1.292 8.785 1.00 . A A . 15 PHE CD2 1 1 3 1108 1 1 15 PHE CE1 C 0.570 0.686 9.062 1.00 . A A . 15 PHE CE1 1 1 3 1109 1 1 15 PHE CE2 C 2.412 2.242 9.319 1.00 . A A . 15 PHE CE2 1 1 3 1110 1 1 15 PHE CG C 2.809 0.036 8.389 1.00 . A A . 15 PHE CG 1 1 3 1111 1 1 15 PHE CZ C 1.052 1.940 9.457 1.00 . A A . 15 PHE CZ 1 1 3 1112 1 1 15 PHE H H 5.270 -2.283 5.872 1.00 . A A . 15 PHE H 1 1 3 1113 1 1 15 PHE HA H 2.456 -1.275 6.118 1.00 . A A . 15 PHE HA 1 1 3 1114 1 1 15 PHE HB2 H 3.590 -1.944 8.287 1.00 . A A . 15 PHE HB2 1 1 3 1115 1 1 15 PHE HB3 H 4.775 -0.674 7.980 1.00 . A A . 15 PHE HB3 1 1 3 1116 1 1 15 PHE HD1 H 1.076 -1.232 8.222 1.00 . A A . 15 PHE HD1 1 1 3 1117 1 1 15 PHE HD2 H 4.339 1.526 8.678 1.00 . A A . 15 PHE HD2 1 1 3 1118 1 1 15 PHE HE1 H -0.479 0.452 9.168 1.00 . A A . 15 PHE HE1 1 1 3 1119 1 1 15 PHE HE2 H 2.783 3.209 9.624 1.00 . A A . 15 PHE HE2 1 1 3 1120 1 1 15 PHE HZ H 0.375 2.672 9.869 1.00 . A A . 15 PHE HZ 1 1 3 1121 1 1 15 PHE N N 4.291 -2.320 5.876 1.00 . A A . 15 PHE N 1 1 3 1122 1 1 15 PHE O O 5.197 0.327 5.409 1.00 . A A . 15 PHE O 1 1 3 1123 1 1 16 CYS C C 3.912 3.289 5.369 1.00 . A A . 16 CYS C 1 1 3 1124 1 1 16 CYS CA C 3.513 2.188 4.369 1.00 . A A . 16 CYS CA 1 1 3 1125 1 1 16 CYS CB C 2.274 2.595 3.559 1.00 . A A . 16 CYS CB 1 1 3 1126 1 1 16 CYS H H 2.153 0.758 5.246 1.00 . A A . 16 CYS H 1 1 3 1127 1 1 16 CYS HA H 4.334 1.972 3.701 1.00 . A A . 16 CYS HA 1 1 3 1128 1 1 16 CYS HB2 H 1.529 3.006 4.224 1.00 . A A . 16 CYS HB2 1 1 3 1129 1 1 16 CYS HB3 H 2.552 3.341 2.829 1.00 . A A . 16 CYS HB3 1 1 3 1130 1 1 16 CYS N N 3.104 0.950 5.105 1.00 . A A . 16 CYS N 1 1 3 1131 1 1 16 CYS O O 4.483 3.011 6.408 1.00 . A A . 16 CYS O 1 1 3 1132 1 1 16 CYS SG S 1.588 1.148 2.708 1.00 . A A . 16 CYS SG 1 1 3 1133 1 1 17 CYS C C 2.943 5.749 7.123 1.00 . A A . 17 CYS C 1 1 3 1134 1 1 17 CYS CA C 3.986 5.641 6.008 1.00 . A A . 17 CYS CA 1 1 3 1135 1 1 17 CYS CB C 3.988 6.912 5.152 1.00 . A A . 17 CYS CB 1 1 3 1136 1 1 17 CYS H H 3.162 4.741 4.227 1.00 . A A . 17 CYS H 1 1 3 1137 1 1 17 CYS HA H 4.965 5.474 6.423 1.00 . A A . 17 CYS HA 1 1 3 1138 1 1 17 CYS HB2 H 3.864 6.649 4.112 1.00 . A A . 17 CYS HB2 1 1 3 1139 1 1 17 CYS HB3 H 3.175 7.553 5.458 1.00 . A A . 17 CYS HB3 1 1 3 1140 1 1 17 CYS N N 3.621 4.534 5.069 1.00 . A A . 17 CYS N 1 1 3 1141 1 1 17 CYS O O 3.202 5.411 8.262 1.00 . A A . 17 CYS O 1 1 3 1142 1 1 17 CYS SG S 5.554 7.788 5.370 1.00 . A A . 17 CYS SG 1 1 3 1143 1 1 18 SER C C -0.660 6.632 7.125 1.00 . A A . 18 SER C 1 1 3 1144 1 1 18 SER CA C 0.687 6.362 7.816 1.00 . A A . 18 SER CA 1 1 3 1145 1 1 18 SER CB C 1.109 7.556 8.679 1.00 . A A . 18 SER CB 1 1 3 1146 1 1 18 SER H H 1.598 6.481 5.866 1.00 . A A . 18 SER H 1 1 3 1147 1 1 18 SER HA H 0.625 5.473 8.425 1.00 . A A . 18 SER HA 1 1 3 1148 1 1 18 SER HB2 H 0.374 7.727 9.446 1.00 . A A . 18 SER HB2 1 1 3 1149 1 1 18 SER HB3 H 2.062 7.340 9.142 1.00 . A A . 18 SER HB3 1 1 3 1150 1 1 18 SER HG H 2.145 8.963 7.821 1.00 . A A . 18 SER HG 1 1 3 1151 1 1 18 SER N N 1.768 6.220 6.795 1.00 . A A . 18 SER N 1 1 3 1152 1 1 18 SER O O -0.867 7.673 6.531 1.00 . A A . 18 SER O 1 1 3 1153 1 1 18 SER OG O 1.218 8.717 7.864 1.00 . A A . 18 SER OG 1 1 3 1154 1 1 19 GLY C C -2.861 5.360 5.098 1.00 . A A . 19 GLY C 1 1 3 1155 1 1 19 GLY CA C -2.904 5.890 6.539 1.00 . A A . 19 GLY CA 1 1 3 1156 1 1 19 GLY H H -1.383 4.863 7.673 1.00 . A A . 19 GLY H 1 1 3 1157 1 1 19 GLY HA2 H -3.659 5.354 7.097 1.00 . A A . 19 GLY HA2 1 1 3 1158 1 1 19 GLY HA3 H -3.148 6.942 6.524 1.00 . A A . 19 GLY HA3 1 1 3 1159 1 1 19 GLY N N -1.573 5.696 7.194 1.00 . A A . 19 GLY N 1 1 3 1160 1 1 19 GLY O O -3.666 5.739 4.268 1.00 . A A . 19 GLY O 1 1 3 1161 1 1 20 TYR C C -1.732 2.388 3.496 1.00 . A A . 20 TYR C 1 1 3 1162 1 1 20 TYR CA C -1.830 3.919 3.419 1.00 . A A . 20 TYR CA 1 1 3 1163 1 1 20 TYR CB C -0.536 4.505 2.838 1.00 . A A . 20 TYR CB 1 1 3 1164 1 1 20 TYR CD1 C -0.654 7.003 3.179 1.00 . A A . 20 TYR CD1 1 1 3 1165 1 1 20 TYR CD2 C -1.122 6.108 0.974 1.00 . A A . 20 TYR CD2 1 1 3 1166 1 1 20 TYR CE1 C -0.869 8.301 2.696 1.00 . A A . 20 TYR CE1 1 1 3 1167 1 1 20 TYR CE2 C -1.338 7.405 0.494 1.00 . A A . 20 TYR CE2 1 1 3 1168 1 1 20 TYR CG C -0.781 5.906 2.318 1.00 . A A . 20 TYR CG 1 1 3 1169 1 1 20 TYR CZ C -1.210 8.500 1.355 1.00 . A A . 20 TYR CZ 1 1 3 1170 1 1 20 TYR H H -1.296 4.191 5.486 1.00 . A A . 20 TYR H 1 1 3 1171 1 1 20 TYR HA H -2.677 4.218 2.821 1.00 . A A . 20 TYR HA 1 1 3 1172 1 1 20 TYR HB2 H 0.219 4.538 3.609 1.00 . A A . 20 TYR HB2 1 1 3 1173 1 1 20 TYR HB3 H -0.192 3.879 2.028 1.00 . A A . 20 TYR HB3 1 1 3 1174 1 1 20 TYR HD1 H -0.391 6.851 4.214 1.00 . A A . 20 TYR HD1 1 1 3 1175 1 1 20 TYR HD2 H -1.221 5.263 0.309 1.00 . A A . 20 TYR HD2 1 1 3 1176 1 1 20 TYR HE1 H -0.770 9.147 3.359 1.00 . A A . 20 TYR HE1 1 1 3 1177 1 1 20 TYR HE2 H -1.602 7.560 -0.541 1.00 . A A . 20 TYR HE2 1 1 3 1178 1 1 20 TYR HH H -0.572 10.132 0.596 1.00 . A A . 20 TYR HH 1 1 3 1179 1 1 20 TYR N N -1.930 4.483 4.798 1.00 . A A . 20 TYR N 1 1 3 1180 1 1 20 TYR O O -1.035 1.848 4.336 1.00 . A A . 20 TYR O 1 1 3 1181 1 1 20 TYR OH O -1.420 9.779 0.880 1.00 . A A . 20 TYR OH 1 1 3 1182 1 1 21 ASN C C -1.590 -0.338 1.455 1.00 . A A . 21 ASN C 1 1 3 1183 1 1 21 ASN CA C -2.369 0.191 2.664 1.00 . A A . 21 ASN CA 1 1 3 1184 1 1 21 ASN CB C -3.833 -0.259 2.604 1.00 . A A . 21 ASN CB 1 1 3 1185 1 1 21 ASN CG C -3.990 -1.626 3.275 1.00 . A A . 21 ASN CG 1 1 3 1186 1 1 21 ASN H H -2.980 2.141 1.967 1.00 . A A . 21 ASN H 1 1 3 1187 1 1 21 ASN HA H -1.914 -0.147 3.578 1.00 . A A . 21 ASN HA 1 1 3 1188 1 1 21 ASN HB2 H -4.451 0.465 3.115 1.00 . A A . 21 ASN HB2 1 1 3 1189 1 1 21 ASN HB3 H -4.143 -0.330 1.572 1.00 . A A . 21 ASN HB3 1 1 3 1190 1 1 21 ASN HD21 H -4.296 -2.593 1.565 1.00 . A A . 21 ASN HD21 1 1 3 1191 1 1 21 ASN HD22 H -4.327 -3.559 2.960 1.00 . A A . 21 ASN HD22 1 1 3 1192 1 1 21 ASN N N -2.424 1.686 2.634 1.00 . A A . 21 ASN N 1 1 3 1193 1 1 21 ASN ND2 N -4.222 -2.681 2.539 1.00 . A A . 21 ASN ND2 1 1 3 1194 1 1 21 ASN O O -1.185 0.414 0.598 1.00 . A A . 21 ASN O 1 1 3 1195 1 1 21 ASN OD1 O -3.900 -1.738 4.483 1.00 . A A . 21 ASN OD1 1 1 3 1196 1 1 22 CYS C C -1.547 -3.077 -0.632 1.00 . A A . 22 CYS C 1 1 3 1197 1 1 22 CYS CA C -0.622 -2.204 0.225 1.00 . A A . 22 CYS CA 1 1 3 1198 1 1 22 CYS CB C 0.488 -3.048 0.857 1.00 . A A . 22 CYS CB 1 1 3 1199 1 1 22 CYS H H -1.711 -2.220 2.085 1.00 . A A . 22 CYS H 1 1 3 1200 1 1 22 CYS HA H -0.189 -1.416 -0.372 1.00 . A A . 22 CYS HA 1 1 3 1201 1 1 22 CYS HB2 H 1.239 -2.397 1.278 1.00 . A A . 22 CYS HB2 1 1 3 1202 1 1 22 CYS HB3 H 0.069 -3.666 1.637 1.00 . A A . 22 CYS HB3 1 1 3 1203 1 1 22 CYS N N -1.377 -1.629 1.380 1.00 . A A . 22 CYS N 1 1 3 1204 1 1 22 CYS O O -2.352 -3.832 -0.118 1.00 . A A . 22 CYS O 1 1 3 1205 1 1 22 CYS SG S 1.248 -4.102 -0.404 1.00 . A A . 22 CYS SG 1 1 3 1206 1 1 23 SER C C -1.604 -5.143 -3.151 1.00 . A A . 23 SER C 1 1 3 1207 1 1 23 SER CA C -2.300 -3.814 -2.828 1.00 . A A . 23 SER CA 1 1 3 1208 1 1 23 SER CB C -2.484 -2.987 -4.099 1.00 . A A . 23 SER CB 1 1 3 1209 1 1 23 SER H H -0.773 -2.372 -2.327 1.00 . A A . 23 SER H 1 1 3 1210 1 1 23 SER HA H -3.256 -3.991 -2.361 1.00 . A A . 23 SER HA 1 1 3 1211 1 1 23 SER HB2 H -2.950 -2.045 -3.856 1.00 . A A . 23 SER HB2 1 1 3 1212 1 1 23 SER HB3 H -1.518 -2.802 -4.549 1.00 . A A . 23 SER HB3 1 1 3 1213 1 1 23 SER HG H -4.218 -3.395 -4.888 1.00 . A A . 23 SER HG 1 1 3 1214 1 1 23 SER N N -1.433 -2.984 -1.936 1.00 . A A . 23 SER N 1 1 3 1215 1 1 23 SER O O -0.418 -5.168 -3.419 1.00 . A A . 23 SER O 1 1 3 1216 1 1 23 SER OG O -3.317 -3.701 -5.007 1.00 . A A . 23 SER OG 1 1 3 1217 1 1 24 PRO C C -1.535 -7.737 -4.908 1.00 . A A . 24 PRO C 1 1 3 1218 1 1 24 PRO CA C -1.814 -7.557 -3.404 1.00 . A A . 24 PRO CA 1 1 3 1219 1 1 24 PRO CB C -2.919 -8.505 -2.944 1.00 . A A . 24 PRO CB 1 1 3 1220 1 1 24 PRO CD C -3.803 -6.262 -2.793 1.00 . A A . 24 PRO CD 1 1 3 1221 1 1 24 PRO CG C -4.179 -7.702 -3.024 1.00 . A A . 24 PRO CG 1 1 3 1222 1 1 24 PRO HA H -0.919 -7.732 -2.828 1.00 . A A . 24 PRO HA 1 1 3 1223 1 1 24 PRO HB2 H -2.974 -9.363 -3.598 1.00 . A A . 24 PRO HB2 1 1 3 1224 1 1 24 PRO HB3 H -2.746 -8.817 -1.925 1.00 . A A . 24 PRO HB3 1 1 3 1225 1 1 24 PRO HD2 H -4.367 -5.615 -3.453 1.00 . A A . 24 PRO HD2 1 1 3 1226 1 1 24 PRO HD3 H -3.964 -5.989 -1.762 1.00 . A A . 24 PRO HD3 1 1 3 1227 1 1 24 PRO HG2 H -4.626 -7.816 -4.002 1.00 . A A . 24 PRO HG2 1 1 3 1228 1 1 24 PRO HG3 H -4.871 -8.023 -2.261 1.00 . A A . 24 PRO HG3 1 1 3 1229 1 1 24 PRO N N -2.369 -6.209 -3.111 1.00 . A A . 24 PRO N 1 1 3 1230 1 1 24 PRO O O -0.796 -8.620 -5.302 1.00 . A A . 24 PRO O 1 1 3 1231 1 1 25 THR C C -0.993 -5.936 -7.754 1.00 . A A . 25 THR C 1 1 3 1232 1 1 25 THR CA C -1.898 -7.059 -7.225 1.00 . A A . 25 THR CA 1 1 3 1233 1 1 25 THR CB C -3.297 -6.965 -7.852 1.00 . A A . 25 THR CB 1 1 3 1234 1 1 25 THR CG2 C -3.223 -7.313 -9.342 1.00 . A A . 25 THR CG2 1 1 3 1235 1 1 25 THR H H -2.724 -6.218 -5.418 1.00 . A A . 25 THR H 1 1 3 1236 1 1 25 THR HA H -1.466 -8.020 -7.446 1.00 . A A . 25 THR HA 1 1 3 1237 1 1 25 THR HB H -3.672 -5.958 -7.742 1.00 . A A . 25 THR HB 1 1 3 1238 1 1 25 THR HG1 H -3.732 -8.722 -7.127 1.00 . A A . 25 THR HG1 1 1 3 1239 1 1 25 THR HG21 H -4.197 -7.633 -9.685 1.00 . A A . 25 THR HG21 1 1 3 1240 1 1 25 THR HG22 H -2.511 -8.110 -9.490 1.00 . A A . 25 THR HG22 1 1 3 1241 1 1 25 THR HG23 H -2.913 -6.444 -9.901 1.00 . A A . 25 THR HG23 1 1 3 1242 1 1 25 THR N N -2.126 -6.919 -5.751 1.00 . A A . 25 THR N 1 1 3 1243 1 1 25 THR O O -0.278 -6.117 -8.722 1.00 . A A . 25 THR O 1 1 3 1244 1 1 25 THR OG1 O -4.175 -7.872 -7.196 1.00 . A A . 25 THR OG1 1 1 3 1245 1 1 26 TRP C C 1.216 -3.693 -6.933 1.00 . A A . 26 TRP C 1 1 3 1246 1 1 26 TRP CA C -0.159 -3.651 -7.613 1.00 . A A . 26 TRP CA 1 1 3 1247 1 1 26 TRP CB C -0.902 -2.368 -7.228 1.00 . A A . 26 TRP CB 1 1 3 1248 1 1 26 TRP CD1 C -2.766 -3.154 -8.762 1.00 . A A . 26 TRP CD1 1 1 3 1249 1 1 26 TRP CD2 C -3.467 -1.653 -7.240 1.00 . A A . 26 TRP CD2 1 1 3 1250 1 1 26 TRP CE2 C -4.597 -2.004 -8.017 1.00 . A A . 26 TRP CE2 1 1 3 1251 1 1 26 TRP CE3 C -3.640 -0.718 -6.204 1.00 . A A . 26 TRP CE3 1 1 3 1252 1 1 26 TRP CG C -2.317 -2.401 -7.730 1.00 . A A . 26 TRP CG 1 1 3 1253 1 1 26 TRP CH2 C -6.005 -0.515 -6.744 1.00 . A A . 26 TRP CH2 1 1 3 1254 1 1 26 TRP CZ2 C -5.852 -1.444 -7.777 1.00 . A A . 26 TRP CZ2 1 1 3 1255 1 1 26 TRP CZ3 C -4.902 -0.153 -5.960 1.00 . A A . 26 TRP CZ3 1 1 3 1256 1 1 26 TRP H H -1.602 -4.657 -6.357 1.00 . A A . 26 TRP H 1 1 3 1257 1 1 26 TRP HA H -0.044 -3.699 -8.684 1.00 . A A . 26 TRP HA 1 1 3 1258 1 1 26 TRP HB2 H -0.907 -2.265 -6.153 1.00 . A A . 26 TRP HB2 1 1 3 1259 1 1 26 TRP HB3 H -0.391 -1.525 -7.661 1.00 . A A . 26 TRP HB3 1 1 3 1260 1 1 26 TRP HD1 H -2.168 -3.831 -9.354 1.00 . A A . 26 TRP HD1 1 1 3 1261 1 1 26 TRP HE1 H -4.684 -3.344 -9.608 1.00 . A A . 26 TRP HE1 1 1 3 1262 1 1 26 TRP HE3 H -2.796 -0.433 -5.594 1.00 . A A . 26 TRP HE3 1 1 3 1263 1 1 26 TRP HH2 H -6.972 -0.077 -6.551 1.00 . A A . 26 TRP HH2 1 1 3 1264 1 1 26 TRP HZ2 H -6.698 -1.728 -8.383 1.00 . A A . 26 TRP HZ2 1 1 3 1265 1 1 26 TRP HZ3 H -5.022 0.566 -5.163 1.00 . A A . 26 TRP HZ3 1 1 3 1266 1 1 26 TRP N N -1.018 -4.782 -7.134 1.00 . A A . 26 TRP N 1 1 3 1267 1 1 26 TRP NE1 N -4.118 -2.921 -8.930 1.00 . A A . 26 TRP NE1 1 1 3 1268 1 1 26 TRP O O 2.191 -3.209 -7.473 1.00 . A A . 26 TRP O 1 1 3 1269 1 1 27 LYS C C 3.056 -2.993 -4.490 1.00 . A A . 27 LYS C 1 1 3 1270 1 1 27 LYS CA C 2.590 -4.365 -5.008 1.00 . A A . 27 LYS CA 1 1 3 1271 1 1 27 LYS CB C 3.603 -4.944 -6.005 1.00 . A A . 27 LYS CB 1 1 3 1272 1 1 27 LYS CD C 5.986 -5.435 -5.420 1.00 . A A . 27 LYS CD 1 1 3 1273 1 1 27 LYS CE C 6.814 -6.500 -6.149 1.00 . A A . 27 LYS CE 1 1 3 1274 1 1 27 LYS CG C 4.539 -5.914 -5.279 1.00 . A A . 27 LYS CG 1 1 3 1275 1 1 27 LYS H H 0.483 -4.648 -5.348 1.00 . A A . 27 LYS H 1 1 3 1276 1 1 27 LYS HA H 2.480 -5.045 -4.178 1.00 . A A . 27 LYS HA 1 1 3 1277 1 1 27 LYS HB2 H 3.079 -5.471 -6.788 1.00 . A A . 27 LYS HB2 1 1 3 1278 1 1 27 LYS HB3 H 4.185 -4.142 -6.436 1.00 . A A . 27 LYS HB3 1 1 3 1279 1 1 27 LYS HD2 H 6.007 -4.513 -5.984 1.00 . A A . 27 LYS HD2 1 1 3 1280 1 1 27 LYS HD3 H 6.403 -5.265 -4.440 1.00 . A A . 27 LYS HD3 1 1 3 1281 1 1 27 LYS HE2 H 7.800 -6.571 -5.710 1.00 . A A . 27 LYS HE2 1 1 3 1282 1 1 27 LYS HE3 H 6.315 -7.456 -6.110 1.00 . A A . 27 LYS HE3 1 1 3 1283 1 1 27 LYS HG2 H 4.274 -5.957 -4.232 1.00 . A A . 27 LYS HG2 1 1 3 1284 1 1 27 LYS HG3 H 4.444 -6.898 -5.714 1.00 . A A . 27 LYS HG3 1 1 3 1285 1 1 27 LYS HZ1 H 5.951 -5.985 -7.973 1.00 . A A . 27 LYS HZ1 1 1 3 1286 1 1 27 LYS HZ2 H 7.490 -6.689 -8.109 1.00 . A A . 27 LYS HZ2 1 1 3 1287 1 1 27 LYS HZ3 H 7.333 -5.081 -7.584 1.00 . A A . 27 LYS HZ3 1 1 3 1288 1 1 27 LYS N N 1.291 -4.270 -5.752 1.00 . A A . 27 LYS N 1 1 3 1289 1 1 27 LYS NZ N 6.903 -6.028 -7.560 1.00 . A A . 27 LYS NZ 1 1 3 1290 1 1 27 LYS O O 4.161 -2.869 -3.995 1.00 . A A . 27 LYS O 1 1 3 1291 1 1 28 TRP C C 1.630 -0.133 -3.003 1.00 . A A . 28 TRP C 1 1 3 1292 1 1 28 TRP CA C 2.650 -0.634 -4.034 1.00 . A A . 28 TRP CA 1 1 3 1293 1 1 28 TRP CB C 2.760 0.312 -5.248 1.00 . A A . 28 TRP CB 1 1 3 1294 1 1 28 TRP CD1 C 0.329 1.056 -5.310 1.00 . A A . 28 TRP CD1 1 1 3 1295 1 1 28 TRP CD2 C 1.077 0.356 -7.310 1.00 . A A . 28 TRP CD2 1 1 3 1296 1 1 28 TRP CE2 C -0.273 0.736 -7.493 1.00 . A A . 28 TRP CE2 1 1 3 1297 1 1 28 TRP CE3 C 1.788 -0.125 -8.423 1.00 . A A . 28 TRP CE3 1 1 3 1298 1 1 28 TRP CG C 1.434 0.556 -5.910 1.00 . A A . 28 TRP CG 1 1 3 1299 1 1 28 TRP CH2 C -0.175 0.167 -9.834 1.00 . A A . 28 TRP CH2 1 1 3 1300 1 1 28 TRP CZ2 C -0.895 0.646 -8.738 1.00 . A A . 28 TRP CZ2 1 1 3 1301 1 1 28 TRP CZ3 C 1.165 -0.217 -9.678 1.00 . A A . 28 TRP CZ3 1 1 3 1302 1 1 28 TRP H H 1.332 -2.084 -4.942 1.00 . A A . 28 TRP H 1 1 3 1303 1 1 28 TRP HA H 3.619 -0.724 -3.564 1.00 . A A . 28 TRP HA 1 1 3 1304 1 1 28 TRP HB2 H 3.159 1.258 -4.918 1.00 . A A . 28 TRP HB2 1 1 3 1305 1 1 28 TRP HB3 H 3.439 -0.121 -5.967 1.00 . A A . 28 TRP HB3 1 1 3 1306 1 1 28 TRP HD1 H 0.247 1.325 -4.269 1.00 . A A . 28 TRP HD1 1 1 3 1307 1 1 28 TRP HE1 H -1.591 1.481 -6.067 1.00 . A A . 28 TRP HE1 1 1 3 1308 1 1 28 TRP HE3 H 2.820 -0.420 -8.313 1.00 . A A . 28 TRP HE3 1 1 3 1309 1 1 28 TRP HH2 H -0.649 0.093 -10.803 1.00 . A A . 28 TRP HH2 1 1 3 1310 1 1 28 TRP HZ2 H -1.927 0.943 -8.852 1.00 . A A . 28 TRP HZ2 1 1 3 1311 1 1 28 TRP HZ3 H 1.719 -0.588 -10.527 1.00 . A A . 28 TRP HZ3 1 1 3 1312 1 1 28 TRP N N 2.229 -1.969 -4.564 1.00 . A A . 28 TRP N 1 1 3 1313 1 1 28 TRP NE1 N -0.684 1.155 -6.247 1.00 . A A . 28 TRP NE1 1 1 3 1314 1 1 28 TRP O O 0.512 -0.613 -2.941 1.00 . A A . 28 TRP O 1 1 3 1315 1 1 29 CYS C C 0.004 2.237 -1.755 1.00 . A A . 29 CYS C 1 1 3 1316 1 1 29 CYS CA C 1.065 1.321 -1.135 1.00 . A A . 29 CYS CA 1 1 3 1317 1 1 29 CYS CB C 1.920 2.108 -0.136 1.00 . A A . 29 CYS CB 1 1 3 1318 1 1 29 CYS H H 2.921 1.171 -2.230 1.00 . A A . 29 CYS H 1 1 3 1319 1 1 29 CYS HA H 0.592 0.494 -0.631 1.00 . A A . 29 CYS HA 1 1 3 1320 1 1 29 CYS HB2 H 2.679 2.658 -0.667 1.00 . A A . 29 CYS HB2 1 1 3 1321 1 1 29 CYS HB3 H 1.289 2.798 0.406 1.00 . A A . 29 CYS HB3 1 1 3 1322 1 1 29 CYS N N 2.012 0.811 -2.175 1.00 . A A . 29 CYS N 1 1 3 1323 1 1 29 CYS O O 0.258 2.955 -2.699 1.00 . A A . 29 CYS O 1 1 3 1324 1 1 29 CYS SG S 2.703 0.972 1.034 1.00 . A A . 29 CYS SG 1 1 3 1325 1 1 30 VAL C C -3.063 3.652 -0.523 1.00 . A A . 30 VAL C 1 1 3 1326 1 1 30 VAL CA C -2.292 3.081 -1.715 1.00 . A A . 30 VAL CA 1 1 3 1327 1 1 30 VAL CB C -3.194 2.159 -2.553 1.00 . A A . 30 VAL CB 1 1 3 1328 1 1 30 VAL CG1 C -2.381 1.526 -3.681 1.00 . A A . 30 VAL CG1 1 1 3 1329 1 1 30 VAL CG2 C -3.785 1.051 -1.668 1.00 . A A . 30 VAL CG2 1 1 3 1330 1 1 30 VAL H H -1.346 1.633 -0.436 1.00 . A A . 30 VAL H 1 1 3 1331 1 1 30 VAL HA H -1.898 3.878 -2.329 1.00 . A A . 30 VAL HA 1 1 3 1332 1 1 30 VAL HB H -3.998 2.741 -2.980 1.00 . A A . 30 VAL HB 1 1 3 1333 1 1 30 VAL HG11 H -1.787 0.715 -3.286 1.00 . A A . 30 VAL HG11 1 1 3 1334 1 1 30 VAL HG12 H -1.732 2.270 -4.118 1.00 . A A . 30 VAL HG12 1 1 3 1335 1 1 30 VAL HG13 H -3.052 1.146 -4.436 1.00 . A A . 30 VAL HG13 1 1 3 1336 1 1 30 VAL HG21 H -4.466 1.486 -0.952 1.00 . A A . 30 VAL HG21 1 1 3 1337 1 1 30 VAL HG22 H -2.990 0.543 -1.145 1.00 . A A . 30 VAL HG22 1 1 3 1338 1 1 30 VAL HG23 H -4.318 0.344 -2.287 1.00 . A A . 30 VAL HG23 1 1 3 1339 1 1 30 VAL N N -1.183 2.217 -1.206 1.00 . A A . 30 VAL N 1 1 3 1340 1 1 30 VAL O O -2.682 3.455 0.615 1.00 . A A . 30 VAL O 1 1 3 1341 1 1 31 TYR C C -5.544 3.775 1.201 1.00 . A A . 31 TYR C 1 1 3 1342 1 1 31 TYR CA C -4.917 4.912 0.385 1.00 . A A . 31 TYR CA 1 1 3 1343 1 1 31 TYR CB C -6.000 5.795 -0.236 1.00 . A A . 31 TYR CB 1 1 3 1344 1 1 31 TYR CD1 C -5.992 7.732 1.372 1.00 . A A . 31 TYR CD1 1 1 3 1345 1 1 31 TYR CD2 C -7.899 6.234 1.361 1.00 . A A . 31 TYR CD2 1 1 3 1346 1 1 31 TYR CE1 C -6.586 8.481 2.393 1.00 . A A . 31 TYR CE1 1 1 3 1347 1 1 31 TYR CE2 C -8.492 6.981 2.383 1.00 . A A . 31 TYR CE2 1 1 3 1348 1 1 31 TYR CG C -6.649 6.610 0.855 1.00 . A A . 31 TYR CG 1 1 3 1349 1 1 31 TYR CZ C -7.835 8.104 2.900 1.00 . A A . 31 TYR CZ 1 1 3 1350 1 1 31 TYR H H -4.440 4.498 -1.681 1.00 . A A . 31 TYR H 1 1 3 1351 1 1 31 TYR HA H -4.272 5.508 1.013 1.00 . A A . 31 TYR HA 1 1 3 1352 1 1 31 TYR HB2 H -5.554 6.454 -0.966 1.00 . A A . 31 TYR HB2 1 1 3 1353 1 1 31 TYR HB3 H -6.743 5.174 -0.714 1.00 . A A . 31 TYR HB3 1 1 3 1354 1 1 31 TYR HD1 H -5.027 8.022 0.979 1.00 . A A . 31 TYR HD1 1 1 3 1355 1 1 31 TYR HD2 H -8.405 5.368 0.961 1.00 . A A . 31 TYR HD2 1 1 3 1356 1 1 31 TYR HE1 H -6.079 9.347 2.791 1.00 . A A . 31 TYR HE1 1 1 3 1357 1 1 31 TYR HE2 H -9.455 6.692 2.774 1.00 . A A . 31 TYR HE2 1 1 3 1358 1 1 31 TYR HH H -8.968 9.516 3.507 1.00 . A A . 31 TYR HH 1 1 3 1359 1 1 31 TYR N N -4.141 4.350 -0.760 1.00 . A A . 31 TYR N 1 1 3 1360 1 1 31 TYR O O -6.144 2.867 0.657 1.00 . A A . 31 TYR O 1 1 3 1361 1 1 31 TYR OH O -8.420 8.840 3.911 1.00 . A A . 31 TYR OH 1 1 3 1362 1 1 32 ALA C C -7.403 3.106 3.784 1.00 . A A . 32 ALA C 1 1 3 1363 1 1 32 ALA CA C -5.975 2.747 3.368 1.00 . A A . 32 ALA CA 1 1 3 1364 1 1 32 ALA CB C -5.060 2.691 4.594 1.00 . A A . 32 ALA CB 1 1 3 1365 1 1 32 ALA H H -4.906 4.563 2.912 1.00 . A A . 32 ALA H 1 1 3 1366 1 1 32 ALA HA H -5.959 1.800 2.854 1.00 . A A . 32 ALA HA 1 1 3 1367 1 1 32 ALA HB1 H -4.074 3.041 4.324 1.00 . A A . 32 ALA HB1 1 1 3 1368 1 1 32 ALA HB2 H -4.996 1.672 4.950 1.00 . A A . 32 ALA HB2 1 1 3 1369 1 1 32 ALA HB3 H -5.465 3.321 5.374 1.00 . A A . 32 ALA HB3 1 1 3 1370 1 1 32 ALA N N -5.399 3.822 2.502 1.00 . A A . 32 ALA N 1 1 3 1371 1 1 32 ALA O O -7.670 4.211 4.219 1.00 . A A . 32 ALA O 1 1 3 1372 1 1 33 ARG C C -9.842 2.489 5.588 1.00 . A A . 33 ARG C 1 1 3 1373 1 1 33 ARG CA C -9.730 2.464 4.059 1.00 . A A . 33 ARG CA 1 1 3 1374 1 1 33 ARG CB C -10.556 1.315 3.477 1.00 . A A . 33 ARG CB 1 1 3 1375 1 1 33 ARG CD C -12.879 0.525 2.986 1.00 . A A . 33 ARG CD 1 1 3 1376 1 1 33 ARG CG C -12.045 1.627 3.644 1.00 . A A . 33 ARG CG 1 1 3 1377 1 1 33 ARG CZ C -12.802 -0.075 0.639 1.00 . A A . 33 ARG CZ 1 1 3 1378 1 1 33 ARG H H -8.077 1.295 3.314 1.00 . A A . 33 ARG H 1 1 3 1379 1 1 33 ARG HA H -10.057 3.402 3.640 1.00 . A A . 33 ARG HA 1 1 3 1380 1 1 33 ARG HB2 H -10.326 1.202 2.427 1.00 . A A . 33 ARG HB2 1 1 3 1381 1 1 33 ARG HB3 H -10.322 0.399 3.999 1.00 . A A . 33 ARG HB3 1 1 3 1382 1 1 33 ARG HD2 H -12.415 -0.439 3.140 1.00 . A A . 33 ARG HD2 1 1 3 1383 1 1 33 ARG HD3 H -13.883 0.528 3.380 1.00 . A A . 33 ARG HD3 1 1 3 1384 1 1 33 ARG HE H -12.989 1.804 1.254 1.00 . A A . 33 ARG HE 1 1 3 1385 1 1 33 ARG HG2 H -12.284 1.679 4.698 1.00 . A A . 33 ARG HG2 1 1 3 1386 1 1 33 ARG HG3 H -12.270 2.573 3.177 1.00 . A A . 33 ARG HG3 1 1 3 1387 1 1 33 ARG HH11 H -10.854 -0.408 0.979 1.00 . A A . 33 ARG HH11 1 1 3 1388 1 1 33 ARG HH12 H -11.580 -1.397 -0.242 1.00 . A A . 33 ARG HH12 1 1 3 1389 1 1 33 ARG HH21 H -14.726 0.041 0.089 1.00 . A A . 33 ARG HH21 1 1 3 1390 1 1 33 ARG HH22 H -13.778 -1.143 -0.748 1.00 . A A . 33 ARG HH22 1 1 3 1391 1 1 33 ARG N N -8.319 2.180 3.662 1.00 . A A . 33 ARG N 1 1 3 1392 1 1 33 ARG NE N -12.900 0.869 1.535 1.00 . A A . 33 ARG NE 1 1 3 1393 1 1 33 ARG NH1 N -11.656 -0.673 0.443 1.00 . A A . 33 ARG NH1 1 1 3 1394 1 1 33 ARG NH2 N -13.850 -0.419 -0.062 1.00 . A A . 33 ARG NH2 1 1 3 1395 1 1 33 ARG O O -9.629 1.485 6.239 1.00 . A A . 33 ARG O 1 1 3 1396 1 1 34 PRO C C -11.636 3.215 8.072 1.00 . A A . 34 PRO C 1 1 3 1397 1 1 34 PRO CA C -10.303 3.802 7.585 1.00 . A A . 34 PRO CA 1 1 3 1398 1 1 34 PRO CB C -10.260 5.314 7.788 1.00 . A A . 34 PRO CB 1 1 3 1399 1 1 34 PRO CD C -10.436 4.901 5.401 1.00 . A A . 34 PRO CD 1 1 3 1400 1 1 34 PRO CG C -10.724 5.904 6.492 1.00 . A A . 34 PRO CG 1 1 3 1401 1 1 34 PRO HA H -9.474 3.338 8.095 1.00 . A A . 34 PRO HA 1 1 3 1402 1 1 34 PRO HB2 H -10.923 5.602 8.591 1.00 . A A . 34 PRO HB2 1 1 3 1403 1 1 34 PRO HB3 H -9.252 5.637 7.999 1.00 . A A . 34 PRO HB3 1 1 3 1404 1 1 34 PRO HD2 H -11.297 4.792 4.754 1.00 . A A . 34 PRO HD2 1 1 3 1405 1 1 34 PRO HD3 H -9.571 5.198 4.836 1.00 . A A . 34 PRO HD3 1 1 3 1406 1 1 34 PRO HG2 H -11.786 6.103 6.539 1.00 . A A . 34 PRO HG2 1 1 3 1407 1 1 34 PRO HG3 H -10.188 6.818 6.291 1.00 . A A . 34 PRO HG3 1 1 3 1408 1 1 34 PRO N N -10.167 3.646 6.115 1.00 . A A . 34 PRO N 1 1 3 1409 1 1 34 PRO O O -11.615 2.484 9.048 1.00 . A A . 34 PRO O 1 1 3 1410 1 1 34 PRO OXT O -12.654 3.508 7.463 1.00 . A A . 34 PRO OXT 1 1 4 1411 1 1 1 GLY C C 8.957 6.232 5.843 1.00 . A A . 1 GLY C 1 1 4 1412 1 1 1 GLY CA C 10.390 6.744 6.010 1.00 . A A . 1 GLY CA 1 1 4 1413 1 1 1 GLY H1 H 10.771 7.551 4.128 1.00 . A A . 1 GLY H1 1 1 4 1414 1 1 1 GLY H2 H 10.843 5.854 4.180 1.00 . A A . 1 GLY H2 1 1 4 1415 1 1 1 GLY H3 H 12.108 6.782 4.832 1.00 . A A . 1 GLY H3 1 1 4 1416 1 1 1 GLY HA2 H 10.925 6.106 6.699 1.00 . A A . 1 GLY HA2 1 1 4 1417 1 1 1 GLY HA3 H 10.367 7.751 6.395 1.00 . A A . 1 GLY HA3 1 1 4 1418 1 1 1 GLY N N 11.081 6.732 4.688 1.00 . A A . 1 GLY N 1 1 4 1419 1 1 1 GLY O O 8.572 5.242 6.436 1.00 . A A . 1 GLY O 1 1 4 1420 1 1 2 CYS C C 6.605 5.844 3.419 1.00 . A A . 2 CYS C 1 1 4 1421 1 1 2 CYS CA C 6.759 6.451 4.818 1.00 . A A . 2 CYS CA 1 1 4 1422 1 1 2 CYS CB C 5.914 7.721 4.945 1.00 . A A . 2 CYS CB 1 1 4 1423 1 1 2 CYS H H 8.506 7.689 4.566 1.00 . A A . 2 CYS H 1 1 4 1424 1 1 2 CYS HA H 6.468 5.737 5.572 1.00 . A A . 2 CYS HA 1 1 4 1425 1 1 2 CYS HB2 H 6.507 8.577 4.660 1.00 . A A . 2 CYS HB2 1 1 4 1426 1 1 2 CYS HB3 H 5.055 7.646 4.294 1.00 . A A . 2 CYS HB3 1 1 4 1427 1 1 2 CYS N N 8.169 6.897 5.034 1.00 . A A . 2 CYS N 1 1 4 1428 1 1 2 CYS O O 7.387 6.120 2.525 1.00 . A A . 2 CYS O 1 1 4 1429 1 1 2 CYS SG S 5.359 7.911 6.657 1.00 . A A . 2 CYS SG 1 1 4 1430 1 1 3 GLY C C 4.876 5.457 0.901 1.00 . A A . 3 GLY C 1 1 4 1431 1 1 3 GLY CA C 5.392 4.400 1.881 1.00 . A A . 3 GLY CA 1 1 4 1432 1 1 3 GLY H H 4.986 4.819 3.956 1.00 . A A . 3 GLY H 1 1 4 1433 1 1 3 GLY HA2 H 6.328 3.998 1.521 1.00 . A A . 3 GLY HA2 1 1 4 1434 1 1 3 GLY HA3 H 4.665 3.605 1.962 1.00 . A A . 3 GLY HA3 1 1 4 1435 1 1 3 GLY N N 5.602 5.024 3.221 1.00 . A A . 3 GLY N 1 1 4 1436 1 1 3 GLY O O 5.646 6.165 0.279 1.00 . A A . 3 GLY O 1 1 4 1437 1 1 4 GLY C C 1.770 5.999 -0.867 1.00 . A A . 4 GLY C 1 1 4 1438 1 1 4 GLY CA C 3.004 6.582 -0.171 1.00 . A A . 4 GLY CA 1 1 4 1439 1 1 4 GLY H H 2.983 4.987 1.278 1.00 . A A . 4 GLY H 1 1 4 1440 1 1 4 GLY HA2 H 2.723 7.465 0.384 1.00 . A A . 4 GLY HA2 1 1 4 1441 1 1 4 GLY HA3 H 3.740 6.844 -0.916 1.00 . A A . 4 GLY HA3 1 1 4 1442 1 1 4 GLY N N 3.580 5.570 0.763 1.00 . A A . 4 GLY N 1 1 4 1443 1 1 4 GLY O O 1.170 5.049 -0.397 1.00 . A A . 4 GLY O 1 1 4 1444 1 1 5 LEU C C 0.634 5.030 -3.806 1.00 . A A . 5 LEU C 1 1 4 1445 1 1 5 LEU CA C 0.203 6.042 -2.729 1.00 . A A . 5 LEU CA 1 1 4 1446 1 1 5 LEU CB C -0.439 7.274 -3.369 1.00 . A A . 5 LEU CB 1 1 4 1447 1 1 5 LEU CD1 C -2.560 8.522 -2.932 1.00 . A A . 5 LEU CD1 1 1 4 1448 1 1 5 LEU CD2 C -2.514 6.683 -4.628 1.00 . A A . 5 LEU CD2 1 1 4 1449 1 1 5 LEU CG C -1.962 7.157 -3.281 1.00 . A A . 5 LEU CG 1 1 4 1450 1 1 5 LEU H H 1.898 7.320 -2.347 1.00 . A A . 5 LEU H 1 1 4 1451 1 1 5 LEU HA H -0.492 5.582 -2.044 1.00 . A A . 5 LEU HA 1 1 4 1452 1 1 5 LEU HB2 H -0.114 8.162 -2.846 1.00 . A A . 5 LEU HB2 1 1 4 1453 1 1 5 LEU HB3 H -0.144 7.338 -4.406 1.00 . A A . 5 LEU HB3 1 1 4 1454 1 1 5 LEU HD11 H -2.718 9.088 -3.837 1.00 . A A . 5 LEU HD11 1 1 4 1455 1 1 5 LEU HD12 H -1.880 9.058 -2.286 1.00 . A A . 5 LEU HD12 1 1 4 1456 1 1 5 LEU HD13 H -3.503 8.383 -2.424 1.00 . A A . 5 LEU HD13 1 1 4 1457 1 1 5 LEU HD21 H -3.398 6.086 -4.464 1.00 . A A . 5 LEU HD21 1 1 4 1458 1 1 5 LEU HD22 H -1.767 6.090 -5.134 1.00 . A A . 5 LEU HD22 1 1 4 1459 1 1 5 LEU HD23 H -2.764 7.540 -5.236 1.00 . A A . 5 LEU HD23 1 1 4 1460 1 1 5 LEU HG H -2.223 6.444 -2.511 1.00 . A A . 5 LEU HG 1 1 4 1461 1 1 5 LEU N N 1.393 6.560 -1.988 1.00 . A A . 5 LEU N 1 1 4 1462 1 1 5 LEU O O -0.194 4.430 -4.465 1.00 . A A . 5 LEU O 1 1 4 1463 1 1 6 MET C C 3.775 3.278 -4.544 1.00 . A A . 6 MET C 1 1 4 1464 1 1 6 MET CA C 2.420 3.854 -4.997 1.00 . A A . 6 MET CA 1 1 4 1465 1 1 6 MET CB C 2.581 4.665 -6.289 1.00 . A A . 6 MET CB 1 1 4 1466 1 1 6 MET CE C 0.134 4.547 -9.600 1.00 . A A . 6 MET CE 1 1 4 1467 1 1 6 MET CG C 1.340 4.488 -7.166 1.00 . A A . 6 MET CG 1 1 4 1468 1 1 6 MET H H 2.568 5.325 -3.435 1.00 . A A . 6 MET H 1 1 4 1469 1 1 6 MET HA H 1.704 3.063 -5.142 1.00 . A A . 6 MET HA 1 1 4 1470 1 1 6 MET HB2 H 2.703 5.710 -6.045 1.00 . A A . 6 MET HB2 1 1 4 1471 1 1 6 MET HB3 H 3.450 4.316 -6.826 1.00 . A A . 6 MET HB3 1 1 4 1472 1 1 6 MET HE1 H 0.059 3.470 -9.679 1.00 . A A . 6 MET HE1 1 1 4 1473 1 1 6 MET HE2 H 0.058 4.983 -10.583 1.00 . A A . 6 MET HE2 1 1 4 1474 1 1 6 MET HE3 H -0.665 4.924 -8.978 1.00 . A A . 6 MET HE3 1 1 4 1475 1 1 6 MET HG2 H 1.034 3.452 -7.156 1.00 . A A . 6 MET HG2 1 1 4 1476 1 1 6 MET HG3 H 0.539 5.103 -6.785 1.00 . A A . 6 MET HG3 1 1 4 1477 1 1 6 MET N N 1.922 4.833 -3.981 1.00 . A A . 6 MET N 1 1 4 1478 1 1 6 MET O O 4.611 2.927 -5.356 1.00 . A A . 6 MET O 1 1 4 1479 1 1 6 MET SD S 1.728 4.984 -8.863 1.00 . A A . 6 MET SD 1 1 4 1480 1 1 7 ALA C C 5.372 1.133 -2.929 1.00 . A A . 7 ALA C 1 1 4 1481 1 1 7 ALA CA C 5.301 2.652 -2.740 1.00 . A A . 7 ALA CA 1 1 4 1482 1 1 7 ALA CB C 5.328 3.012 -1.251 1.00 . A A . 7 ALA CB 1 1 4 1483 1 1 7 ALA H H 3.310 3.484 -2.617 1.00 . A A . 7 ALA H 1 1 4 1484 1 1 7 ALA HA H 6.126 3.130 -3.245 1.00 . A A . 7 ALA HA 1 1 4 1485 1 1 7 ALA HB1 H 4.595 3.782 -1.053 1.00 . A A . 7 ALA HB1 1 1 4 1486 1 1 7 ALA HB2 H 6.310 3.375 -0.987 1.00 . A A . 7 ALA HB2 1 1 4 1487 1 1 7 ALA HB3 H 5.096 2.136 -0.662 1.00 . A A . 7 ALA HB3 1 1 4 1488 1 1 7 ALA N N 3.998 3.190 -3.252 1.00 . A A . 7 ALA N 1 1 4 1489 1 1 7 ALA O O 4.489 0.408 -2.525 1.00 . A A . 7 ALA O 1 1 4 1490 1 1 8 GLY C C 6.547 -1.566 -2.431 1.00 . A A . 8 GLY C 1 1 4 1491 1 1 8 GLY CA C 6.567 -0.820 -3.771 1.00 . A A . 8 GLY CA 1 1 4 1492 1 1 8 GLY H H 7.125 1.261 -3.860 1.00 . A A . 8 GLY H 1 1 4 1493 1 1 8 GLY HA2 H 5.749 -1.166 -4.386 1.00 . A A . 8 GLY HA2 1 1 4 1494 1 1 8 GLY HA3 H 7.502 -1.016 -4.273 1.00 . A A . 8 GLY HA3 1 1 4 1495 1 1 8 GLY N N 6.425 0.652 -3.544 1.00 . A A . 8 GLY N 1 1 4 1496 1 1 8 GLY O O 7.357 -1.311 -1.558 1.00 . A A . 8 GLY O 1 1 4 1497 1 1 9 CYS C C 6.530 -4.442 -1.040 1.00 . A A . 9 CYS C 1 1 4 1498 1 1 9 CYS CA C 5.551 -3.266 -0.995 1.00 . A A . 9 CYS CA 1 1 4 1499 1 1 9 CYS CB C 4.103 -3.769 -0.916 1.00 . A A . 9 CYS CB 1 1 4 1500 1 1 9 CYS H H 4.996 -2.676 -2.994 1.00 . A A . 9 CYS H 1 1 4 1501 1 1 9 CYS HA H 5.767 -2.632 -0.154 1.00 . A A . 9 CYS HA 1 1 4 1502 1 1 9 CYS HB2 H 3.839 -4.251 -1.845 1.00 . A A . 9 CYS HB2 1 1 4 1503 1 1 9 CYS HB3 H 4.014 -4.478 -0.106 1.00 . A A . 9 CYS HB3 1 1 4 1504 1 1 9 CYS N N 5.630 -2.489 -2.270 1.00 . A A . 9 CYS N 1 1 4 1505 1 1 9 CYS O O 7.427 -4.541 -0.224 1.00 . A A . 9 CYS O 1 1 4 1506 1 1 9 CYS SG S 2.986 -2.374 -0.623 1.00 . A A . 9 CYS SG 1 1 4 1507 1 1 10 ASP C C 7.400 -7.264 -0.805 1.00 . A A . 10 ASP C 1 1 4 1508 1 1 10 ASP CA C 7.272 -6.509 -2.137 1.00 . A A . 10 ASP CA 1 1 4 1509 1 1 10 ASP CB C 8.625 -5.932 -2.568 1.00 . A A . 10 ASP CB 1 1 4 1510 1 1 10 ASP CG C 9.492 -7.049 -3.153 1.00 . A A . 10 ASP CG 1 1 4 1511 1 1 10 ASP H H 5.631 -5.202 -2.638 1.00 . A A . 10 ASP H 1 1 4 1512 1 1 10 ASP HA H 6.900 -7.172 -2.901 1.00 . A A . 10 ASP HA 1 1 4 1513 1 1 10 ASP HB2 H 8.468 -5.166 -3.316 1.00 . A A . 10 ASP HB2 1 1 4 1514 1 1 10 ASP HB3 H 9.124 -5.501 -1.713 1.00 . A A . 10 ASP HB3 1 1 4 1515 1 1 10 ASP N N 6.362 -5.324 -1.999 1.00 . A A . 10 ASP N 1 1 4 1516 1 1 10 ASP O O 8.379 -7.128 -0.093 1.00 . A A . 10 ASP O 1 1 4 1517 1 1 10 ASP OD1 O 10.155 -7.723 -2.383 1.00 . A A . 10 ASP OD1 1 1 4 1518 1 1 10 ASP OD2 O 9.475 -7.212 -4.362 1.00 . A A . 10 ASP OD2 1 1 4 1519 1 1 11 GLY C C 5.151 -8.679 1.557 1.00 . A A . 11 GLY C 1 1 4 1520 1 1 11 GLY CA C 6.475 -8.831 0.808 1.00 . A A . 11 GLY CA 1 1 4 1521 1 1 11 GLY H H 5.641 -8.157 -1.057 1.00 . A A . 11 GLY H 1 1 4 1522 1 1 11 GLY HA2 H 6.650 -9.875 0.590 1.00 . A A . 11 GLY HA2 1 1 4 1523 1 1 11 GLY HA3 H 7.277 -8.451 1.423 1.00 . A A . 11 GLY HA3 1 1 4 1524 1 1 11 GLY N N 6.417 -8.062 -0.468 1.00 . A A . 11 GLY N 1 1 4 1525 1 1 11 GLY O O 4.555 -7.618 1.570 1.00 . A A . 11 GLY O 1 1 4 1526 1 1 12 LYS C C 3.628 -8.987 4.326 1.00 . A A . 12 LYS C 1 1 4 1527 1 1 12 LYS CA C 3.404 -9.643 2.951 1.00 . A A . 12 LYS CA 1 1 4 1528 1 1 12 LYS CB C 2.925 -11.095 3.105 1.00 . A A . 12 LYS CB 1 1 4 1529 1 1 12 LYS CD C 4.341 -13.110 3.549 1.00 . A A . 12 LYS CD 1 1 4 1530 1 1 12 LYS CE C 5.658 -13.466 4.245 1.00 . A A . 12 LYS CE 1 1 4 1531 1 1 12 LYS CG C 3.771 -11.826 4.154 1.00 . A A . 12 LYS CG 1 1 4 1532 1 1 12 LYS H H 5.193 -10.572 2.170 1.00 . A A . 12 LYS H 1 1 4 1533 1 1 12 LYS HA H 2.678 -9.081 2.386 1.00 . A A . 12 LYS HA 1 1 4 1534 1 1 12 LYS HB2 H 1.890 -11.097 3.415 1.00 . A A . 12 LYS HB2 1 1 4 1535 1 1 12 LYS HB3 H 3.014 -11.604 2.157 1.00 . A A . 12 LYS HB3 1 1 4 1536 1 1 12 LYS HD2 H 3.634 -13.916 3.682 1.00 . A A . 12 LYS HD2 1 1 4 1537 1 1 12 LYS HD3 H 4.523 -12.961 2.494 1.00 . A A . 12 LYS HD3 1 1 4 1538 1 1 12 LYS HE2 H 5.614 -13.196 5.291 1.00 . A A . 12 LYS HE2 1 1 4 1539 1 1 12 LYS HE3 H 5.867 -14.519 4.136 1.00 . A A . 12 LYS HE3 1 1 4 1540 1 1 12 LYS HG2 H 4.582 -11.187 4.473 1.00 . A A . 12 LYS HG2 1 1 4 1541 1 1 12 LYS HG3 H 3.154 -12.075 5.004 1.00 . A A . 12 LYS HG3 1 1 4 1542 1 1 12 LYS HZ1 H 7.638 -12.899 3.928 1.00 . A A . 12 LYS HZ1 1 1 4 1543 1 1 12 LYS HZ2 H 6.512 -11.650 3.685 1.00 . A A . 12 LYS HZ2 1 1 4 1544 1 1 12 LYS HZ3 H 6.682 -12.882 2.526 1.00 . A A . 12 LYS HZ3 1 1 4 1545 1 1 12 LYS N N 4.690 -9.730 2.189 1.00 . A A . 12 LYS N 1 1 4 1546 1 1 12 LYS NZ N 6.701 -12.664 3.543 1.00 . A A . 12 LYS NZ 1 1 4 1547 1 1 12 LYS O O 2.707 -8.860 5.112 1.00 . A A . 12 LYS O 1 1 4 1548 1 1 13 SER C C 5.705 -6.508 5.725 1.00 . A A . 13 SER C 1 1 4 1549 1 1 13 SER CA C 5.116 -7.913 5.935 1.00 . A A . 13 SER CA 1 1 4 1550 1 1 13 SER CB C 6.132 -8.828 6.625 1.00 . A A . 13 SER CB 1 1 4 1551 1 1 13 SER H H 5.567 -8.672 3.971 1.00 . A A . 13 SER H 1 1 4 1552 1 1 13 SER HA H 4.214 -7.856 6.524 1.00 . A A . 13 SER HA 1 1 4 1553 1 1 13 SER HB2 H 6.318 -9.694 6.010 1.00 . A A . 13 SER HB2 1 1 4 1554 1 1 13 SER HB3 H 7.059 -8.290 6.774 1.00 . A A . 13 SER HB3 1 1 4 1555 1 1 13 SER HG H 5.827 -8.585 8.533 1.00 . A A . 13 SER HG 1 1 4 1556 1 1 13 SER N N 4.839 -8.565 4.619 1.00 . A A . 13 SER N 1 1 4 1557 1 1 13 SER O O 6.376 -5.975 6.589 1.00 . A A . 13 SER O 1 1 4 1558 1 1 13 SER OG O 5.608 -9.252 7.877 1.00 . A A . 13 SER OG 1 1 4 1559 1 1 14 THR C C 5.203 -3.495 5.143 1.00 . A A . 14 THR C 1 1 4 1560 1 1 14 THR CA C 5.985 -4.528 4.322 1.00 . A A . 14 THR CA 1 1 4 1561 1 1 14 THR CB C 5.792 -4.298 2.814 1.00 . A A . 14 THR CB 1 1 4 1562 1 1 14 THR CG2 C 4.298 -4.302 2.465 1.00 . A A . 14 THR CG2 1 1 4 1563 1 1 14 THR H H 4.899 -6.348 3.908 1.00 . A A . 14 THR H 1 1 4 1564 1 1 14 THR HA H 7.035 -4.485 4.568 1.00 . A A . 14 THR HA 1 1 4 1565 1 1 14 THR HB H 6.282 -5.090 2.268 1.00 . A A . 14 THR HB 1 1 4 1566 1 1 14 THR HG1 H 5.750 -2.352 2.681 1.00 . A A . 14 THR HG1 1 1 4 1567 1 1 14 THR HG21 H 4.033 -3.360 2.011 1.00 . A A . 14 THR HG21 1 1 4 1568 1 1 14 THR HG22 H 3.717 -4.445 3.364 1.00 . A A . 14 THR HG22 1 1 4 1569 1 1 14 THR HG23 H 4.095 -5.106 1.774 1.00 . A A . 14 THR HG23 1 1 4 1570 1 1 14 THR N N 5.450 -5.901 4.586 1.00 . A A . 14 THR N 1 1 4 1571 1 1 14 THR O O 4.144 -3.783 5.670 1.00 . A A . 14 THR O 1 1 4 1572 1 1 14 THR OG1 O 6.368 -3.050 2.444 1.00 . A A . 14 THR OG1 1 1 4 1573 1 1 15 PHE C C 4.860 0.043 5.254 1.00 . A A . 15 PHE C 1 1 4 1574 1 1 15 PHE CA C 5.007 -1.252 6.056 1.00 . A A . 15 PHE CA 1 1 4 1575 1 1 15 PHE CB C 5.887 -1.017 7.287 1.00 . A A . 15 PHE CB 1 1 4 1576 1 1 15 PHE CD1 C 4.046 -1.448 8.959 1.00 . A A . 15 PHE CD1 1 1 4 1577 1 1 15 PHE CD2 C 6.067 -2.782 9.078 1.00 . A A . 15 PHE CD2 1 1 4 1578 1 1 15 PHE CE1 C 3.523 -2.144 10.055 1.00 . A A . 15 PHE CE1 1 1 4 1579 1 1 15 PHE CE2 C 5.545 -3.477 10.175 1.00 . A A . 15 PHE CE2 1 1 4 1580 1 1 15 PHE CG C 5.320 -1.767 8.470 1.00 . A A . 15 PHE CG 1 1 4 1581 1 1 15 PHE CZ C 4.272 -3.158 10.663 1.00 . A A . 15 PHE CZ 1 1 4 1582 1 1 15 PHE H H 6.576 -2.088 4.833 1.00 . A A . 15 PHE H 1 1 4 1583 1 1 15 PHE HA H 4.038 -1.613 6.364 1.00 . A A . 15 PHE HA 1 1 4 1584 1 1 15 PHE HB2 H 6.890 -1.367 7.086 1.00 . A A . 15 PHE HB2 1 1 4 1585 1 1 15 PHE HB3 H 5.913 0.039 7.512 1.00 . A A . 15 PHE HB3 1 1 4 1586 1 1 15 PHE HD1 H 3.467 -0.665 8.490 1.00 . A A . 15 PHE HD1 1 1 4 1587 1 1 15 PHE HD2 H 7.050 -3.028 8.700 1.00 . A A . 15 PHE HD2 1 1 4 1588 1 1 15 PHE HE1 H 2.541 -1.897 10.432 1.00 . A A . 15 PHE HE1 1 1 4 1589 1 1 15 PHE HE2 H 6.122 -4.258 10.643 1.00 . A A . 15 PHE HE2 1 1 4 1590 1 1 15 PHE HZ H 3.868 -3.694 11.509 1.00 . A A . 15 PHE HZ 1 1 4 1591 1 1 15 PHE N N 5.720 -2.298 5.261 1.00 . A A . 15 PHE N 1 1 4 1592 1 1 15 PHE O O 5.688 0.374 4.424 1.00 . A A . 15 PHE O 1 1 4 1593 1 1 16 CYS C C 3.654 3.238 5.788 1.00 . A A . 16 CYS C 1 1 4 1594 1 1 16 CYS CA C 3.587 2.072 4.788 1.00 . A A . 16 CYS CA 1 1 4 1595 1 1 16 CYS CB C 2.188 1.941 4.176 1.00 . A A . 16 CYS CB 1 1 4 1596 1 1 16 CYS H H 3.166 0.491 6.192 1.00 . A A . 16 CYS H 1 1 4 1597 1 1 16 CYS HA H 4.323 2.199 4.009 1.00 . A A . 16 CYS HA 1 1 4 1598 1 1 16 CYS HB2 H 1.910 0.898 4.131 1.00 . A A . 16 CYS HB2 1 1 4 1599 1 1 16 CYS HB3 H 1.476 2.477 4.786 1.00 . A A . 16 CYS HB3 1 1 4 1600 1 1 16 CYS N N 3.810 0.783 5.511 1.00 . A A . 16 CYS N 1 1 4 1601 1 1 16 CYS O O 4.349 3.163 6.784 1.00 . A A . 16 CYS O 1 1 4 1602 1 1 16 CYS SG S 2.195 2.634 2.504 1.00 . A A . 16 CYS SG 1 1 4 1603 1 1 17 CYS C C 1.865 5.338 7.528 1.00 . A A . 17 CYS C 1 1 4 1604 1 1 17 CYS CA C 2.982 5.470 6.485 1.00 . A A . 17 CYS CA 1 1 4 1605 1 1 17 CYS CB C 2.782 6.714 5.613 1.00 . A A . 17 CYS CB 1 1 4 1606 1 1 17 CYS H H 2.389 4.362 4.730 1.00 . A A . 17 CYS H 1 1 4 1607 1 1 17 CYS HA H 3.939 5.518 6.973 1.00 . A A . 17 CYS HA 1 1 4 1608 1 1 17 CYS HB2 H 3.345 6.605 4.698 1.00 . A A . 17 CYS HB2 1 1 4 1609 1 1 17 CYS HB3 H 1.734 6.828 5.377 1.00 . A A . 17 CYS HB3 1 1 4 1610 1 1 17 CYS N N 2.945 4.314 5.537 1.00 . A A . 17 CYS N 1 1 4 1611 1 1 17 CYS O O 2.119 5.070 8.686 1.00 . A A . 17 CYS O 1 1 4 1612 1 1 17 CYS SG S 3.362 8.179 6.506 1.00 . A A . 17 CYS SG 1 1 4 1613 1 1 18 SER C C -1.838 5.475 7.312 1.00 . A A . 18 SER C 1 1 4 1614 1 1 18 SER CA C -0.513 5.408 8.080 1.00 . A A . 18 SER CA 1 1 4 1615 1 1 18 SER CB C -0.373 6.603 9.032 1.00 . A A . 18 SER CB 1 1 4 1616 1 1 18 SER H H 0.460 5.732 6.183 1.00 . A A . 18 SER H 1 1 4 1617 1 1 18 SER HA H -0.447 4.485 8.635 1.00 . A A . 18 SER HA 1 1 4 1618 1 1 18 SER HB2 H -1.258 6.685 9.640 1.00 . A A . 18 SER HB2 1 1 4 1619 1 1 18 SER HB3 H 0.486 6.451 9.672 1.00 . A A . 18 SER HB3 1 1 4 1620 1 1 18 SER HG H -1.036 8.291 8.322 1.00 . A A . 18 SER HG 1 1 4 1621 1 1 18 SER N N 0.633 5.522 7.122 1.00 . A A . 18 SER N 1 1 4 1622 1 1 18 SER O O -2.364 6.543 7.053 1.00 . A A . 18 SER O 1 1 4 1623 1 1 18 SER OG O -0.213 7.800 8.278 1.00 . A A . 18 SER OG 1 1 4 1624 1 1 19 GLY C C -3.415 3.714 4.790 1.00 . A A . 19 GLY C 1 1 4 1625 1 1 19 GLY CA C -3.654 4.333 6.169 1.00 . A A . 19 GLY CA 1 1 4 1626 1 1 19 GLY H H -1.928 3.494 7.139 1.00 . A A . 19 GLY H 1 1 4 1627 1 1 19 GLY HA2 H -4.389 3.749 6.706 1.00 . A A . 19 GLY HA2 1 1 4 1628 1 1 19 GLY HA3 H -4.012 5.344 6.048 1.00 . A A . 19 GLY HA3 1 1 4 1629 1 1 19 GLY N N -2.373 4.342 6.932 1.00 . A A . 19 GLY N 1 1 4 1630 1 1 19 GLY O O -4.262 3.025 4.262 1.00 . A A . 19 GLY O 1 1 4 1631 1 1 20 TYR C C -1.770 1.852 2.970 1.00 . A A . 20 TYR C 1 1 4 1632 1 1 20 TYR CA C -1.966 3.370 2.859 1.00 . A A . 20 TYR CA 1 1 4 1633 1 1 20 TYR CB C -0.667 4.042 2.402 1.00 . A A . 20 TYR CB 1 1 4 1634 1 1 20 TYR CD1 C -1.759 5.745 0.895 1.00 . A A . 20 TYR CD1 1 1 4 1635 1 1 20 TYR CD2 C -0.367 6.527 2.720 1.00 . A A . 20 TYR CD2 1 1 4 1636 1 1 20 TYR CE1 C -2.009 7.069 0.518 1.00 . A A . 20 TYR CE1 1 1 4 1637 1 1 20 TYR CE2 C -0.616 7.851 2.342 1.00 . A A . 20 TYR CE2 1 1 4 1638 1 1 20 TYR CG C -0.938 5.473 1.996 1.00 . A A . 20 TYR CG 1 1 4 1639 1 1 20 TYR CZ C -1.439 8.122 1.242 1.00 . A A . 20 TYR CZ 1 1 4 1640 1 1 20 TYR H H -1.593 4.508 4.655 1.00 . A A . 20 TYR H 1 1 4 1641 1 1 20 TYR HA H -2.762 3.599 2.167 1.00 . A A . 20 TYR HA 1 1 4 1642 1 1 20 TYR HB2 H 0.048 4.028 3.214 1.00 . A A . 20 TYR HB2 1 1 4 1643 1 1 20 TYR HB3 H -0.262 3.502 1.560 1.00 . A A . 20 TYR HB3 1 1 4 1644 1 1 20 TYR HD1 H -2.199 4.935 0.337 1.00 . A A . 20 TYR HD1 1 1 4 1645 1 1 20 TYR HD2 H 0.267 6.318 3.568 1.00 . A A . 20 TYR HD2 1 1 4 1646 1 1 20 TYR HE1 H -2.643 7.278 -0.330 1.00 . A A . 20 TYR HE1 1 1 4 1647 1 1 20 TYR HE2 H -0.175 8.664 2.900 1.00 . A A . 20 TYR HE2 1 1 4 1648 1 1 20 TYR HH H -2.353 9.784 1.461 1.00 . A A . 20 TYR HH 1 1 4 1649 1 1 20 TYR N N -2.263 3.951 4.205 1.00 . A A . 20 TYR N 1 1 4 1650 1 1 20 TYR O O -0.952 1.380 3.737 1.00 . A A . 20 TYR O 1 1 4 1651 1 1 20 TYR OH O -1.685 9.428 0.869 1.00 . A A . 20 TYR OH 1 1 4 1652 1 1 21 ASN C C -1.685 -0.903 0.983 1.00 . A A . 21 ASN C 1 1 4 1653 1 1 21 ASN CA C -2.370 -0.400 2.257 1.00 . A A . 21 ASN CA 1 1 4 1654 1 1 21 ASN CB C -3.801 -0.937 2.346 1.00 . A A . 21 ASN CB 1 1 4 1655 1 1 21 ASN CG C -4.223 -1.046 3.814 1.00 . A A . 21 ASN CG 1 1 4 1656 1 1 21 ASN H H -3.161 1.495 1.595 1.00 . A A . 21 ASN H 1 1 4 1657 1 1 21 ASN HA H -1.807 -0.696 3.129 1.00 . A A . 21 ASN HA 1 1 4 1658 1 1 21 ASN HB2 H -4.470 -0.263 1.828 1.00 . A A . 21 ASN HB2 1 1 4 1659 1 1 21 ASN HB3 H -3.848 -1.913 1.887 1.00 . A A . 21 ASN HB3 1 1 4 1660 1 1 21 ASN HD21 H -4.735 -2.959 3.672 1.00 . A A . 21 ASN HD21 1 1 4 1661 1 1 21 ASN HD22 H -4.945 -2.264 5.206 1.00 . A A . 21 ASN HD22 1 1 4 1662 1 1 21 ASN N N -2.512 1.089 2.208 1.00 . A A . 21 ASN N 1 1 4 1663 1 1 21 ASN ND2 N -4.672 -2.185 4.268 1.00 . A A . 21 ASN ND2 1 1 4 1664 1 1 21 ASN O O -1.559 -0.179 0.021 1.00 . A A . 21 ASN O 1 1 4 1665 1 1 21 ASN OD1 O -4.146 -0.086 4.555 1.00 . A A . 21 ASN OD1 1 1 4 1666 1 1 22 CYS C C -1.577 -3.273 -1.222 1.00 . A A . 22 CYS C 1 1 4 1667 1 1 22 CYS CA C -0.556 -2.660 -0.258 1.00 . A A . 22 CYS CA 1 1 4 1668 1 1 22 CYS CB C 0.415 -3.730 0.247 1.00 . A A . 22 CYS CB 1 1 4 1669 1 1 22 CYS H H -1.348 -2.706 1.755 1.00 . A A . 22 CYS H 1 1 4 1670 1 1 22 CYS HA H -0.007 -1.872 -0.748 1.00 . A A . 22 CYS HA 1 1 4 1671 1 1 22 CYS HB2 H -0.073 -4.335 0.997 1.00 . A A . 22 CYS HB2 1 1 4 1672 1 1 22 CYS HB3 H 0.719 -4.357 -0.578 1.00 . A A . 22 CYS HB3 1 1 4 1673 1 1 22 CYS N N -1.239 -2.133 0.967 1.00 . A A . 22 CYS N 1 1 4 1674 1 1 22 CYS O O -2.425 -4.057 -0.833 1.00 . A A . 22 CYS O 1 1 4 1675 1 1 22 CYS SG S 1.873 -2.935 0.969 1.00 . A A . 22 CYS SG 1 1 4 1676 1 1 23 SER C C -2.192 -4.971 -3.698 1.00 . A A . 23 SER C 1 1 4 1677 1 1 23 SER CA C -2.445 -3.470 -3.498 1.00 . A A . 23 SER CA 1 1 4 1678 1 1 23 SER CB C -2.144 -2.701 -4.791 1.00 . A A . 23 SER CB 1 1 4 1679 1 1 23 SER H H -0.798 -2.287 -2.762 1.00 . A A . 23 SER H 1 1 4 1680 1 1 23 SER HA H -3.466 -3.295 -3.194 1.00 . A A . 23 SER HA 1 1 4 1681 1 1 23 SER HB2 H -2.620 -3.190 -5.625 1.00 . A A . 23 SER HB2 1 1 4 1682 1 1 23 SER HB3 H -2.523 -1.691 -4.706 1.00 . A A . 23 SER HB3 1 1 4 1683 1 1 23 SER HG H -0.392 -3.549 -4.816 1.00 . A A . 23 SER HG 1 1 4 1684 1 1 23 SER N N -1.494 -2.918 -2.482 1.00 . A A . 23 SER N 1 1 4 1685 1 1 23 SER O O -1.058 -5.414 -3.665 1.00 . A A . 23 SER O 1 1 4 1686 1 1 23 SER OG O -0.738 -2.676 -5.007 1.00 . A A . 23 SER OG 1 1 4 1687 1 1 24 PRO C C -2.589 -7.530 -5.478 1.00 . A A . 24 PRO C 1 1 4 1688 1 1 24 PRO CA C -3.145 -7.179 -4.088 1.00 . A A . 24 PRO CA 1 1 4 1689 1 1 24 PRO CB C -4.585 -7.667 -3.948 1.00 . A A . 24 PRO CB 1 1 4 1690 1 1 24 PRO CD C -4.655 -5.252 -3.942 1.00 . A A . 24 PRO CD 1 1 4 1691 1 1 24 PRO CG C -5.434 -6.489 -4.304 1.00 . A A . 24 PRO CG 1 1 4 1692 1 1 24 PRO HA H -2.536 -7.617 -3.314 1.00 . A A . 24 PRO HA 1 1 4 1693 1 1 24 PRO HB2 H -4.770 -8.487 -4.631 1.00 . A A . 24 PRO HB2 1 1 4 1694 1 1 24 PRO HB3 H -4.783 -7.972 -2.932 1.00 . A A . 24 PRO HB3 1 1 4 1695 1 1 24 PRO HD2 H -4.780 -4.491 -4.700 1.00 . A A . 24 PRO HD2 1 1 4 1696 1 1 24 PRO HD3 H -4.959 -4.880 -2.976 1.00 . A A . 24 PRO HD3 1 1 4 1697 1 1 24 PRO HG2 H -5.646 -6.496 -5.364 1.00 . A A . 24 PRO HG2 1 1 4 1698 1 1 24 PRO HG3 H -6.355 -6.514 -3.743 1.00 . A A . 24 PRO HG3 1 1 4 1699 1 1 24 PRO N N -3.258 -5.709 -3.891 1.00 . A A . 24 PRO N 1 1 4 1700 1 1 24 PRO O O -2.125 -8.633 -5.697 1.00 . A A . 24 PRO O 1 1 4 1701 1 1 25 THR C C -1.029 -5.957 -8.233 1.00 . A A . 25 THR C 1 1 4 1702 1 1 25 THR CA C -2.128 -6.937 -7.794 1.00 . A A . 25 THR CA 1 1 4 1703 1 1 25 THR CB C -3.350 -6.823 -8.715 1.00 . A A . 25 THR CB 1 1 4 1704 1 1 25 THR CG2 C -2.971 -7.263 -10.131 1.00 . A A . 25 THR CG2 1 1 4 1705 1 1 25 THR H H -3.032 -5.739 -6.237 1.00 . A A . 25 THR H 1 1 4 1706 1 1 25 THR HA H -1.751 -7.943 -7.822 1.00 . A A . 25 THR HA 1 1 4 1707 1 1 25 THR HB H -3.690 -5.799 -8.739 1.00 . A A . 25 THR HB 1 1 4 1708 1 1 25 THR HG1 H -5.077 -7.093 -7.855 1.00 . A A . 25 THR HG1 1 1 4 1709 1 1 25 THR HG21 H -2.265 -8.079 -10.078 1.00 . A A . 25 THR HG21 1 1 4 1710 1 1 25 THR HG22 H -2.525 -6.433 -10.659 1.00 . A A . 25 THR HG22 1 1 4 1711 1 1 25 THR HG23 H -3.858 -7.588 -10.656 1.00 . A A . 25 THR HG23 1 1 4 1712 1 1 25 THR N N -2.643 -6.620 -6.423 1.00 . A A . 25 THR N 1 1 4 1713 1 1 25 THR O O -0.123 -6.327 -8.955 1.00 . A A . 25 THR O 1 1 4 1714 1 1 25 THR OG1 O -4.392 -7.657 -8.223 1.00 . A A . 25 THR OG1 1 1 4 1715 1 1 26 TRP C C 1.230 -3.871 -7.419 1.00 . A A . 26 TRP C 1 1 4 1716 1 1 26 TRP CA C -0.059 -3.723 -8.250 1.00 . A A . 26 TRP CA 1 1 4 1717 1 1 26 TRP CB C -0.690 -2.344 -8.034 1.00 . A A . 26 TRP CB 1 1 4 1718 1 1 26 TRP CD1 C -2.356 -3.062 -9.809 1.00 . A A . 26 TRP CD1 1 1 4 1719 1 1 26 TRP CD2 C -2.984 -1.189 -8.736 1.00 . A A . 26 TRP CD2 1 1 4 1720 1 1 26 TRP CE2 C -3.993 -1.473 -9.685 1.00 . A A . 26 TRP CE2 1 1 4 1721 1 1 26 TRP CE3 C -3.140 -0.051 -7.925 1.00 . A A . 26 TRP CE3 1 1 4 1722 1 1 26 TRP CG C -1.954 -2.214 -8.832 1.00 . A A . 26 TRP CG 1 1 4 1723 1 1 26 TRP CH2 C -5.254 0.470 -9.012 1.00 . A A . 26 TRP CH2 1 1 4 1724 1 1 26 TRP CZ2 C -5.116 -0.658 -9.825 1.00 . A A . 26 TRP CZ2 1 1 4 1725 1 1 26 TRP CZ3 C -4.269 0.772 -8.062 1.00 . A A . 26 TRP CZ3 1 1 4 1726 1 1 26 TRP H H -1.847 -4.432 -7.254 1.00 . A A . 26 TRP H 1 1 4 1727 1 1 26 TRP HA H 0.167 -3.855 -9.297 1.00 . A A . 26 TRP HA 1 1 4 1728 1 1 26 TRP HB2 H -0.914 -2.210 -6.991 1.00 . A A . 26 TRP HB2 1 1 4 1729 1 1 26 TRP HB3 H 0.007 -1.585 -8.349 1.00 . A A . 26 TRP HB3 1 1 4 1730 1 1 26 TRP HD1 H -1.821 -3.941 -10.138 1.00 . A A . 26 TRP HD1 1 1 4 1731 1 1 26 TRP HE1 H -4.070 -3.064 -11.022 1.00 . A A . 26 TRP HE1 1 1 4 1732 1 1 26 TRP HE3 H -2.387 0.189 -7.191 1.00 . A A . 26 TRP HE3 1 1 4 1733 1 1 26 TRP HH2 H -6.121 1.106 -9.113 1.00 . A A . 26 TRP HH2 1 1 4 1734 1 1 26 TRP HZ2 H -5.872 -0.896 -10.558 1.00 . A A . 26 TRP HZ2 1 1 4 1735 1 1 26 TRP HZ3 H -4.378 1.644 -7.435 1.00 . A A . 26 TRP HZ3 1 1 4 1736 1 1 26 TRP N N -1.104 -4.715 -7.825 1.00 . A A . 26 TRP N 1 1 4 1737 1 1 26 TRP NE1 N -3.565 -2.624 -10.310 1.00 . A A . 26 TRP NE1 1 1 4 1738 1 1 26 TRP O O 2.261 -3.332 -7.777 1.00 . A A . 26 TRP O 1 1 4 1739 1 1 27 LYS C C 2.893 -3.529 -4.788 1.00 . A A . 27 LYS C 1 1 4 1740 1 1 27 LYS CA C 2.400 -4.823 -5.472 1.00 . A A . 27 LYS CA 1 1 4 1741 1 1 27 LYS CB C 3.473 -5.372 -6.425 1.00 . A A . 27 LYS CB 1 1 4 1742 1 1 27 LYS CD C 3.864 -7.563 -5.272 1.00 . A A . 27 LYS CD 1 1 4 1743 1 1 27 LYS CE C 4.132 -8.576 -6.388 1.00 . A A . 27 LYS CE 1 1 4 1744 1 1 27 LYS CG C 4.486 -6.212 -5.639 1.00 . A A . 27 LYS CG 1 1 4 1745 1 1 27 LYS H H 0.340 -5.039 -6.074 1.00 . A A . 27 LYS H 1 1 4 1746 1 1 27 LYS HA H 2.185 -5.565 -4.720 1.00 . A A . 27 LYS HA 1 1 4 1747 1 1 27 LYS HB2 H 3.004 -5.986 -7.179 1.00 . A A . 27 LYS HB2 1 1 4 1748 1 1 27 LYS HB3 H 3.986 -4.549 -6.901 1.00 . A A . 27 LYS HB3 1 1 4 1749 1 1 27 LYS HD2 H 4.301 -7.920 -4.349 1.00 . A A . 27 LYS HD2 1 1 4 1750 1 1 27 LYS HD3 H 2.799 -7.447 -5.142 1.00 . A A . 27 LYS HD3 1 1 4 1751 1 1 27 LYS HE2 H 3.628 -8.273 -7.296 1.00 . A A . 27 LYS HE2 1 1 4 1752 1 1 27 LYS HE3 H 5.192 -8.677 -6.561 1.00 . A A . 27 LYS HE3 1 1 4 1753 1 1 27 LYS HG2 H 5.365 -6.374 -6.248 1.00 . A A . 27 LYS HG2 1 1 4 1754 1 1 27 LYS HG3 H 4.765 -5.690 -4.737 1.00 . A A . 27 LYS HG3 1 1 4 1755 1 1 27 LYS HZ1 H 3.832 -10.632 -6.541 1.00 . A A . 27 LYS HZ1 1 1 4 1756 1 1 27 LYS HZ2 H 2.535 -9.794 -5.833 1.00 . A A . 27 LYS HZ2 1 1 4 1757 1 1 27 LYS HZ3 H 3.958 -10.071 -4.946 1.00 . A A . 27 LYS HZ3 1 1 4 1758 1 1 27 LYS N N 1.182 -4.608 -6.328 1.00 . A A . 27 LYS N 1 1 4 1759 1 1 27 LYS NZ N 3.572 -9.865 -5.889 1.00 . A A . 27 LYS NZ 1 1 4 1760 1 1 27 LYS O O 3.968 -3.513 -4.219 1.00 . A A . 27 LYS O 1 1 4 1761 1 1 28 TRP C C 1.534 -0.651 -3.175 1.00 . A A . 28 TRP C 1 1 4 1762 1 1 28 TRP CA C 2.609 -1.205 -4.126 1.00 . A A . 28 TRP CA 1 1 4 1763 1 1 28 TRP CB C 2.972 -0.202 -5.239 1.00 . A A . 28 TRP CB 1 1 4 1764 1 1 28 TRP CD1 C 0.632 0.740 -5.567 1.00 . A A . 28 TRP CD1 1 1 4 1765 1 1 28 TRP CD2 C 1.614 0.148 -7.499 1.00 . A A . 28 TRP CD2 1 1 4 1766 1 1 28 TRP CE2 C 0.339 0.657 -7.832 1.00 . A A . 28 TRP CE2 1 1 4 1767 1 1 28 TRP CE3 C 2.444 -0.298 -8.542 1.00 . A A . 28 TRP CE3 1 1 4 1768 1 1 28 TRP CG C 1.777 0.205 -6.052 1.00 . A A . 28 TRP CG 1 1 4 1769 1 1 28 TRP CH2 C 0.737 0.276 -10.180 1.00 . A A . 28 TRP CH2 1 1 4 1770 1 1 28 TRP CZ2 C -0.100 0.724 -9.155 1.00 . A A . 28 TRP CZ2 1 1 4 1771 1 1 28 TRP CZ3 C 2.006 -0.235 -9.875 1.00 . A A . 28 TRP CZ3 1 1 4 1772 1 1 28 TRP H H 1.262 -2.468 -5.257 1.00 . A A . 28 TRP H 1 1 4 1773 1 1 28 TRP HA H 3.497 -1.432 -3.556 1.00 . A A . 28 TRP HA 1 1 4 1774 1 1 28 TRP HB2 H 3.402 0.679 -4.790 1.00 . A A . 28 TRP HB2 1 1 4 1775 1 1 28 TRP HB3 H 3.705 -0.656 -5.891 1.00 . A A . 28 TRP HB3 1 1 4 1776 1 1 28 TRP HD1 H 0.417 0.924 -4.527 1.00 . A A . 28 TRP HD1 1 1 4 1777 1 1 28 TRP HE1 H -1.115 1.396 -6.541 1.00 . A A . 28 TRP HE1 1 1 4 1778 1 1 28 TRP HE3 H 3.424 -0.692 -8.317 1.00 . A A . 28 TRP HE3 1 1 4 1779 1 1 28 TRP HH2 H 0.405 0.322 -11.207 1.00 . A A . 28 TRP HH2 1 1 4 1780 1 1 28 TRP HZ2 H -1.079 1.119 -9.384 1.00 . A A . 28 TRP HZ2 1 1 4 1781 1 1 28 TRP HZ3 H 2.651 -0.581 -10.668 1.00 . A A . 28 TRP HZ3 1 1 4 1782 1 1 28 TRP N N 2.134 -2.453 -4.811 1.00 . A A . 28 TRP N 1 1 4 1783 1 1 28 TRP NE1 N -0.220 1.007 -6.622 1.00 . A A . 28 TRP NE1 1 1 4 1784 1 1 28 TRP O O 0.382 -1.033 -3.231 1.00 . A A . 28 TRP O 1 1 4 1785 1 1 29 CYS C C -0.044 1.748 -2.008 1.00 . A A . 29 CYS C 1 1 4 1786 1 1 29 CYS CA C 0.946 0.811 -1.308 1.00 . A A . 29 CYS CA 1 1 4 1787 1 1 29 CYS CB C 1.802 1.590 -0.305 1.00 . A A . 29 CYS CB 1 1 4 1788 1 1 29 CYS H H 2.859 0.511 -2.257 1.00 . A A . 29 CYS H 1 1 4 1789 1 1 29 CYS HA H 0.419 0.020 -0.799 1.00 . A A . 29 CYS HA 1 1 4 1790 1 1 29 CYS HB2 H 2.833 1.286 -0.399 1.00 . A A . 29 CYS HB2 1 1 4 1791 1 1 29 CYS HB3 H 1.721 2.647 -0.508 1.00 . A A . 29 CYS HB3 1 1 4 1792 1 1 29 CYS N N 1.919 0.234 -2.287 1.00 . A A . 29 CYS N 1 1 4 1793 1 1 29 CYS O O 0.288 2.409 -2.967 1.00 . A A . 29 CYS O 1 1 4 1794 1 1 29 CYS SG S 1.234 1.256 1.381 1.00 . A A . 29 CYS SG 1 1 4 1795 1 1 30 VAL C C -3.199 3.250 -1.018 1.00 . A A . 30 VAL C 1 1 4 1796 1 1 30 VAL CA C -2.299 2.691 -2.125 1.00 . A A . 30 VAL CA 1 1 4 1797 1 1 30 VAL CB C -3.115 1.789 -3.067 1.00 . A A . 30 VAL CB 1 1 4 1798 1 1 30 VAL CG1 C -2.254 1.373 -4.259 1.00 . A A . 30 VAL CG1 1 1 4 1799 1 1 30 VAL CG2 C -3.583 0.535 -2.317 1.00 . A A . 30 VAL CG2 1 1 4 1800 1 1 30 VAL H H -1.487 1.256 -0.739 1.00 . A A . 30 VAL H 1 1 4 1801 1 1 30 VAL HA H -1.840 3.493 -2.682 1.00 . A A . 30 VAL HA 1 1 4 1802 1 1 30 VAL HB H -3.976 2.336 -3.423 1.00 . A A . 30 VAL HB 1 1 4 1803 1 1 30 VAL HG11 H -1.676 2.219 -4.599 1.00 . A A . 30 VAL HG11 1 1 4 1804 1 1 30 VAL HG12 H -2.891 1.027 -5.059 1.00 . A A . 30 VAL HG12 1 1 4 1805 1 1 30 VAL HG13 H -1.587 0.578 -3.961 1.00 . A A . 30 VAL HG13 1 1 4 1806 1 1 30 VAL HG21 H -4.485 0.157 -2.776 1.00 . A A . 30 VAL HG21 1 1 4 1807 1 1 30 VAL HG22 H -3.781 0.783 -1.284 1.00 . A A . 30 VAL HG22 1 1 4 1808 1 1 30 VAL HG23 H -2.812 -0.221 -2.362 1.00 . A A . 30 VAL HG23 1 1 4 1809 1 1 30 VAL N N -1.257 1.804 -1.519 1.00 . A A . 30 VAL N 1 1 4 1810 1 1 30 VAL O O -3.144 2.804 0.111 1.00 . A A . 30 VAL O 1 1 4 1811 1 1 31 TYR C C -5.940 3.717 0.183 1.00 . A A . 31 TYR C 1 1 4 1812 1 1 31 TYR CA C -4.929 4.778 -0.270 1.00 . A A . 31 TYR CA 1 1 4 1813 1 1 31 TYR CB C -5.650 5.964 -0.920 1.00 . A A . 31 TYR CB 1 1 4 1814 1 1 31 TYR CD1 C -6.228 7.218 1.195 1.00 . A A . 31 TYR CD1 1 1 4 1815 1 1 31 TYR CD2 C -8.031 6.344 -0.173 1.00 . A A . 31 TYR CD2 1 1 4 1816 1 1 31 TYR CE1 C -7.163 7.727 2.103 1.00 . A A . 31 TYR CE1 1 1 4 1817 1 1 31 TYR CE2 C -8.966 6.855 0.736 1.00 . A A . 31 TYR CE2 1 1 4 1818 1 1 31 TYR CG C -6.662 6.526 0.055 1.00 . A A . 31 TYR CG 1 1 4 1819 1 1 31 TYR CZ C -8.532 7.545 1.873 1.00 . A A . 31 TYR CZ 1 1 4 1820 1 1 31 TYR H H -4.067 4.561 -2.243 1.00 . A A . 31 TYR H 1 1 4 1821 1 1 31 TYR HA H -4.345 5.120 0.571 1.00 . A A . 31 TYR HA 1 1 4 1822 1 1 31 TYR HB2 H -4.928 6.729 -1.175 1.00 . A A . 31 TYR HB2 1 1 4 1823 1 1 31 TYR HB3 H -6.156 5.634 -1.814 1.00 . A A . 31 TYR HB3 1 1 4 1824 1 1 31 TYR HD1 H -5.173 7.360 1.371 1.00 . A A . 31 TYR HD1 1 1 4 1825 1 1 31 TYR HD2 H -8.367 5.813 -1.051 1.00 . A A . 31 TYR HD2 1 1 4 1826 1 1 31 TYR HE1 H -6.829 8.259 2.980 1.00 . A A . 31 TYR HE1 1 1 4 1827 1 1 31 TYR HE2 H -10.022 6.716 0.559 1.00 . A A . 31 TYR HE2 1 1 4 1828 1 1 31 TYR HH H -9.797 7.310 3.286 1.00 . A A . 31 TYR HH 1 1 4 1829 1 1 31 TYR N N -4.031 4.214 -1.325 1.00 . A A . 31 TYR N 1 1 4 1830 1 1 31 TYR O O -6.562 3.054 -0.628 1.00 . A A . 31 TYR O 1 1 4 1831 1 1 31 TYR OH O -9.454 8.045 2.771 1.00 . A A . 31 TYR OH 1 1 4 1832 1 1 32 ALA C C -8.235 3.237 2.712 1.00 . A A . 32 ALA C 1 1 4 1833 1 1 32 ALA CA C -7.078 2.543 1.987 1.00 . A A . 32 ALA CA 1 1 4 1834 1 1 32 ALA CB C -6.272 1.682 2.961 1.00 . A A . 32 ALA CB 1 1 4 1835 1 1 32 ALA H H -5.595 4.106 2.103 1.00 . A A . 32 ALA H 1 1 4 1836 1 1 32 ALA HA H -7.451 1.933 1.179 1.00 . A A . 32 ALA HA 1 1 4 1837 1 1 32 ALA HB1 H -5.246 1.626 2.631 1.00 . A A . 32 ALA HB1 1 1 4 1838 1 1 32 ALA HB2 H -6.693 0.689 2.999 1.00 . A A . 32 ALA HB2 1 1 4 1839 1 1 32 ALA HB3 H -6.308 2.124 3.947 1.00 . A A . 32 ALA HB3 1 1 4 1840 1 1 32 ALA N N -6.107 3.557 1.472 1.00 . A A . 32 ALA N 1 1 4 1841 1 1 32 ALA O O -8.185 4.423 2.985 1.00 . A A . 32 ALA O 1 1 4 1842 1 1 33 ARG C C -11.089 4.215 2.897 1.00 . A A . 33 ARG C 1 1 4 1843 1 1 33 ARG CA C -10.456 3.094 3.739 1.00 . A A . 33 ARG CA 1 1 4 1844 1 1 33 ARG CB C -9.896 3.646 5.056 1.00 . A A . 33 ARG CB 1 1 4 1845 1 1 33 ARG CD C -11.024 4.926 6.886 1.00 . A A . 33 ARG CD 1 1 4 1846 1 1 33 ARG CG C -10.976 3.590 6.138 1.00 . A A . 33 ARG CG 1 1 4 1847 1 1 33 ARG CZ C -11.179 5.491 9.239 1.00 . A A . 33 ARG CZ 1 1 4 1848 1 1 33 ARG H H -9.286 1.548 2.793 1.00 . A A . 33 ARG H 1 1 4 1849 1 1 33 ARG HA H -11.187 2.329 3.947 1.00 . A A . 33 ARG HA 1 1 4 1850 1 1 33 ARG HB2 H -9.048 3.049 5.362 1.00 . A A . 33 ARG HB2 1 1 4 1851 1 1 33 ARG HB3 H -9.583 4.669 4.914 1.00 . A A . 33 ARG HB3 1 1 4 1852 1 1 33 ARG HD2 H -10.164 5.530 6.628 1.00 . A A . 33 ARG HD2 1 1 4 1853 1 1 33 ARG HD3 H -11.937 5.452 6.658 1.00 . A A . 33 ARG HD3 1 1 4 1854 1 1 33 ARG HE H -10.827 3.641 8.609 1.00 . A A . 33 ARG HE 1 1 4 1855 1 1 33 ARG HG2 H -11.936 3.400 5.679 1.00 . A A . 33 ARG HG2 1 1 4 1856 1 1 33 ARG HG3 H -10.747 2.796 6.833 1.00 . A A . 33 ARG HG3 1 1 4 1857 1 1 33 ARG HH11 H -9.239 5.979 9.366 1.00 . A A . 33 ARG HH11 1 1 4 1858 1 1 33 ARG HH12 H -10.304 6.875 10.396 1.00 . A A . 33 ARG HH12 1 1 4 1859 1 1 33 ARG HH21 H -13.164 5.220 9.323 1.00 . A A . 33 ARG HH21 1 1 4 1860 1 1 33 ARG HH22 H -12.531 6.444 10.372 1.00 . A A . 33 ARG HH22 1 1 4 1861 1 1 33 ARG N N -9.279 2.500 3.026 1.00 . A A . 33 ARG N 1 1 4 1862 1 1 33 ARG NE N -10.991 4.567 8.334 1.00 . A A . 33 ARG NE 1 1 4 1863 1 1 33 ARG NH1 N -10.161 6.168 9.703 1.00 . A A . 33 ARG NH1 1 1 4 1864 1 1 33 ARG NH2 N -12.385 5.739 9.679 1.00 . A A . 33 ARG NH2 1 1 4 1865 1 1 33 ARG O O -10.818 5.382 3.111 1.00 . A A . 33 ARG O 1 1 4 1866 1 1 34 PRO C C -13.643 5.611 1.880 1.00 . A A . 34 PRO C 1 1 4 1867 1 1 34 PRO CA C -12.610 4.802 1.084 1.00 . A A . 34 PRO CA 1 1 4 1868 1 1 34 PRO CB C -13.286 3.930 0.027 1.00 . A A . 34 PRO CB 1 1 4 1869 1 1 34 PRO CD C -12.309 2.436 1.642 1.00 . A A . 34 PRO CD 1 1 4 1870 1 1 34 PRO CG C -13.460 2.597 0.683 1.00 . A A . 34 PRO CG 1 1 4 1871 1 1 34 PRO HA H -11.893 5.456 0.615 1.00 . A A . 34 PRO HA 1 1 4 1872 1 1 34 PRO HB2 H -14.248 4.347 -0.244 1.00 . A A . 34 PRO HB2 1 1 4 1873 1 1 34 PRO HB3 H -12.658 3.834 -0.844 1.00 . A A . 34 PRO HB3 1 1 4 1874 1 1 34 PRO HD2 H -12.629 1.910 2.532 1.00 . A A . 34 PRO HD2 1 1 4 1875 1 1 34 PRO HD3 H -11.487 1.922 1.169 1.00 . A A . 34 PRO HD3 1 1 4 1876 1 1 34 PRO HG2 H -14.399 2.568 1.217 1.00 . A A . 34 PRO HG2 1 1 4 1877 1 1 34 PRO HG3 H -13.429 1.813 -0.057 1.00 . A A . 34 PRO HG3 1 1 4 1878 1 1 34 PRO N N -11.925 3.818 1.964 1.00 . A A . 34 PRO N 1 1 4 1879 1 1 34 PRO O O -14.484 5.002 2.524 1.00 . A A . 34 PRO O 1 1 4 1880 1 1 34 PRO OXT O -13.570 6.828 1.835 1.00 . A A . 34 PRO OXT 1 1 5 1881 1 1 1 GLY C C 8.693 4.512 5.785 1.00 . A A . 1 GLY C 1 1 5 1882 1 1 1 GLY CA C 10.123 4.411 6.322 1.00 . A A . 1 GLY CA 1 1 5 1883 1 1 1 GLY H1 H 9.872 6.047 7.588 1.00 . A A . 1 GLY H1 1 1 5 1884 1 1 1 GLY H2 H 11.194 5.056 7.991 1.00 . A A . 1 GLY H2 1 1 5 1885 1 1 1 GLY H3 H 9.609 4.548 8.336 1.00 . A A . 1 GLY H3 1 1 5 1886 1 1 1 GLY HA2 H 10.801 4.905 5.640 1.00 . A A . 1 GLY HA2 1 1 5 1887 1 1 1 GLY HA3 H 10.398 3.371 6.411 1.00 . A A . 1 GLY HA3 1 1 5 1888 1 1 1 GLY N N 10.206 5.065 7.660 1.00 . A A . 1 GLY N 1 1 5 1889 1 1 1 GLY O O 7.936 3.563 5.836 1.00 . A A . 1 GLY O 1 1 5 1890 1 1 2 CYS C C 6.911 5.555 3.222 1.00 . A A . 2 CYS C 1 1 5 1891 1 1 2 CYS CA C 6.934 5.832 4.732 1.00 . A A . 2 CYS CA 1 1 5 1892 1 1 2 CYS CB C 6.579 7.298 5.017 1.00 . A A . 2 CYS CB 1 1 5 1893 1 1 2 CYS H H 8.950 6.409 5.247 1.00 . A A . 2 CYS H 1 1 5 1894 1 1 2 CYS HA H 6.247 5.181 5.246 1.00 . A A . 2 CYS HA 1 1 5 1895 1 1 2 CYS HB2 H 6.303 7.404 6.055 1.00 . A A . 2 CYS HB2 1 1 5 1896 1 1 2 CYS HB3 H 7.435 7.922 4.806 1.00 . A A . 2 CYS HB3 1 1 5 1897 1 1 2 CYS N N 8.320 5.659 5.273 1.00 . A A . 2 CYS N 1 1 5 1898 1 1 2 CYS O O 7.722 6.072 2.476 1.00 . A A . 2 CYS O 1 1 5 1899 1 1 2 CYS SG S 5.190 7.811 3.971 1.00 . A A . 2 CYS SG 1 1 5 1900 1 1 3 GLY C C 5.020 5.481 0.615 1.00 . A A . 3 GLY C 1 1 5 1901 1 1 3 GLY CA C 5.900 4.435 1.311 1.00 . A A . 3 GLY CA 1 1 5 1902 1 1 3 GLY H H 5.340 4.338 3.389 1.00 . A A . 3 GLY H 1 1 5 1903 1 1 3 GLY HA2 H 6.893 4.453 0.882 1.00 . A A . 3 GLY HA2 1 1 5 1904 1 1 3 GLY HA3 H 5.465 3.456 1.173 1.00 . A A . 3 GLY HA3 1 1 5 1905 1 1 3 GLY N N 5.983 4.744 2.770 1.00 . A A . 3 GLY N 1 1 5 1906 1 1 3 GLY O O 5.513 6.357 -0.069 1.00 . A A . 3 GLY O 1 1 5 1907 1 1 4 GLY C C 1.758 5.646 -0.703 1.00 . A A . 4 GLY C 1 1 5 1908 1 1 4 GLY CA C 2.804 6.383 0.141 1.00 . A A . 4 GLY CA 1 1 5 1909 1 1 4 GLY H H 3.352 4.679 1.347 1.00 . A A . 4 GLY H 1 1 5 1910 1 1 4 GLY HA2 H 2.308 6.964 0.905 1.00 . A A . 4 GLY HA2 1 1 5 1911 1 1 4 GLY HA3 H 3.375 7.041 -0.496 1.00 . A A . 4 GLY HA3 1 1 5 1912 1 1 4 GLY N N 3.723 5.394 0.787 1.00 . A A . 4 GLY N 1 1 5 1913 1 1 4 GLY O O 1.467 4.488 -0.473 1.00 . A A . 4 GLY O 1 1 5 1914 1 1 5 LEU C C 0.814 4.950 -3.747 1.00 . A A . 5 LEU C 1 1 5 1915 1 1 5 LEU CA C 0.158 5.658 -2.547 1.00 . A A . 5 LEU CA 1 1 5 1916 1 1 5 LEU CB C -0.749 6.797 -3.029 1.00 . A A . 5 LEU CB 1 1 5 1917 1 1 5 LEU CD1 C -3.030 7.760 -2.674 1.00 . A A . 5 LEU CD1 1 1 5 1918 1 1 5 LEU CD2 C -2.775 5.518 -3.752 1.00 . A A . 5 LEU CD2 1 1 5 1919 1 1 5 LEU CG C -2.208 6.470 -2.695 1.00 . A A . 5 LEU CG 1 1 5 1920 1 1 5 LEU H H 1.443 7.246 -1.846 1.00 . A A . 5 LEU H 1 1 5 1921 1 1 5 LEU HA H -0.420 4.953 -1.970 1.00 . A A . 5 LEU HA 1 1 5 1922 1 1 5 LEU HB2 H -0.466 7.716 -2.535 1.00 . A A . 5 LEU HB2 1 1 5 1923 1 1 5 LEU HB3 H -0.643 6.915 -4.098 1.00 . A A . 5 LEU HB3 1 1 5 1924 1 1 5 LEU HD11 H -2.596 8.475 -3.356 1.00 . A A . 5 LEU HD11 1 1 5 1925 1 1 5 LEU HD12 H -3.029 8.169 -1.675 1.00 . A A . 5 LEU HD12 1 1 5 1926 1 1 5 LEU HD13 H -4.044 7.545 -2.975 1.00 . A A . 5 LEU HD13 1 1 5 1927 1 1 5 LEU HD21 H -3.843 5.428 -3.620 1.00 . A A . 5 LEU HD21 1 1 5 1928 1 1 5 LEU HD22 H -2.315 4.548 -3.646 1.00 . A A . 5 LEU HD22 1 1 5 1929 1 1 5 LEU HD23 H -2.566 5.909 -4.738 1.00 . A A . 5 LEU HD23 1 1 5 1930 1 1 5 LEU HG H -2.257 5.998 -1.725 1.00 . A A . 5 LEU HG 1 1 5 1931 1 1 5 LEU N N 1.190 6.314 -1.681 1.00 . A A . 5 LEU N 1 1 5 1932 1 1 5 LEU O O 0.145 4.294 -4.523 1.00 . A A . 5 LEU O 1 1 5 1933 1 1 6 MET C C 4.199 3.931 -4.635 1.00 . A A . 6 MET C 1 1 5 1934 1 1 6 MET CA C 2.800 4.405 -5.055 1.00 . A A . 6 MET CA 1 1 5 1935 1 1 6 MET CB C 2.889 5.477 -6.146 1.00 . A A . 6 MET CB 1 1 5 1936 1 1 6 MET CE C 1.303 5.328 -9.939 1.00 . A A . 6 MET CE 1 1 5 1937 1 1 6 MET CG C 2.279 4.935 -7.440 1.00 . A A . 6 MET CG 1 1 5 1938 1 1 6 MET H H 2.638 5.605 -3.272 1.00 . A A . 6 MET H 1 1 5 1939 1 1 6 MET HA H 2.214 3.570 -5.407 1.00 . A A . 6 MET HA 1 1 5 1940 1 1 6 MET HB2 H 2.347 6.357 -5.833 1.00 . A A . 6 MET HB2 1 1 5 1941 1 1 6 MET HB3 H 3.924 5.734 -6.319 1.00 . A A . 6 MET HB3 1 1 5 1942 1 1 6 MET HE1 H 0.245 5.367 -9.714 1.00 . A A . 6 MET HE1 1 1 5 1943 1 1 6 MET HE2 H 1.630 4.302 -9.943 1.00 . A A . 6 MET HE2 1 1 5 1944 1 1 6 MET HE3 H 1.487 5.767 -10.910 1.00 . A A . 6 MET HE3 1 1 5 1945 1 1 6 MET HG2 H 2.886 4.121 -7.811 1.00 . A A . 6 MET HG2 1 1 5 1946 1 1 6 MET HG3 H 1.279 4.577 -7.245 1.00 . A A . 6 MET HG3 1 1 5 1947 1 1 6 MET N N 2.114 5.074 -3.907 1.00 . A A . 6 MET N 1 1 5 1948 1 1 6 MET O O 5.156 4.043 -5.379 1.00 . A A . 6 MET O 1 1 5 1949 1 1 6 MET SD S 2.216 6.252 -8.679 1.00 . A A . 6 MET SD 1 1 5 1950 1 1 7 ALA C C 5.919 1.491 -3.498 1.00 . A A . 7 ALA C 1 1 5 1951 1 1 7 ALA CA C 5.645 2.900 -2.961 1.00 . A A . 7 ALA CA 1 1 5 1952 1 1 7 ALA CB C 5.523 2.881 -1.435 1.00 . A A . 7 ALA CB 1 1 5 1953 1 1 7 ALA H H 3.527 3.311 -2.870 1.00 . A A . 7 ALA H 1 1 5 1954 1 1 7 ALA HA H 6.434 3.568 -3.257 1.00 . A A . 7 ALA HA 1 1 5 1955 1 1 7 ALA HB1 H 5.074 1.951 -1.121 1.00 . A A . 7 ALA HB1 1 1 5 1956 1 1 7 ALA HB2 H 4.903 3.705 -1.113 1.00 . A A . 7 ALA HB2 1 1 5 1957 1 1 7 ALA HB3 H 6.504 2.974 -0.994 1.00 . A A . 7 ALA HB3 1 1 5 1958 1 1 7 ALA N N 4.317 3.394 -3.446 1.00 . A A . 7 ALA N 1 1 5 1959 1 1 7 ALA O O 5.368 1.076 -4.497 1.00 . A A . 7 ALA O 1 1 5 1960 1 1 8 GLY C C 6.737 -1.611 -2.179 1.00 . A A . 8 GLY C 1 1 5 1961 1 1 8 GLY CA C 7.090 -0.627 -3.295 1.00 . A A . 8 GLY CA 1 1 5 1962 1 1 8 GLY H H 7.209 1.123 -2.042 1.00 . A A . 8 GLY H 1 1 5 1963 1 1 8 GLY HA2 H 6.512 -0.857 -4.179 1.00 . A A . 8 GLY HA2 1 1 5 1964 1 1 8 GLY HA3 H 8.143 -0.704 -3.520 1.00 . A A . 8 GLY HA3 1 1 5 1965 1 1 8 GLY N N 6.774 0.759 -2.840 1.00 . A A . 8 GLY N 1 1 5 1966 1 1 8 GLY O O 7.484 -1.779 -1.234 1.00 . A A . 8 GLY O 1 1 5 1967 1 1 9 CYS C C 6.021 -4.520 -1.333 1.00 . A A . 9 CYS C 1 1 5 1968 1 1 9 CYS CA C 5.196 -3.233 -1.218 1.00 . A A . 9 CYS CA 1 1 5 1969 1 1 9 CYS CB C 3.706 -3.509 -1.462 1.00 . A A . 9 CYS CB 1 1 5 1970 1 1 9 CYS H H 5.015 -2.105 -3.049 1.00 . A A . 9 CYS H 1 1 5 1971 1 1 9 CYS HA H 5.329 -2.796 -0.244 1.00 . A A . 9 CYS HA 1 1 5 1972 1 1 9 CYS HB2 H 3.140 -2.605 -1.284 1.00 . A A . 9 CYS HB2 1 1 5 1973 1 1 9 CYS HB3 H 3.559 -3.831 -2.482 1.00 . A A . 9 CYS HB3 1 1 5 1974 1 1 9 CYS N N 5.600 -2.260 -2.278 1.00 . A A . 9 CYS N 1 1 5 1975 1 1 9 CYS O O 6.938 -4.739 -0.565 1.00 . A A . 9 CYS O 1 1 5 1976 1 1 9 CYS SG S 3.144 -4.805 -0.330 1.00 . A A . 9 CYS SG 1 1 5 1977 1 1 10 ASP C C 6.527 -7.415 -1.130 1.00 . A A . 10 ASP C 1 1 5 1978 1 1 10 ASP CA C 6.464 -6.646 -2.459 1.00 . A A . 10 ASP CA 1 1 5 1979 1 1 10 ASP CB C 7.865 -6.219 -2.917 1.00 . A A . 10 ASP CB 1 1 5 1980 1 1 10 ASP CG C 8.516 -7.357 -3.704 1.00 . A A . 10 ASP CG 1 1 5 1981 1 1 10 ASP H H 4.960 -5.162 -2.890 1.00 . A A . 10 ASP H 1 1 5 1982 1 1 10 ASP HA H 6.001 -7.255 -3.221 1.00 . A A . 10 ASP HA 1 1 5 1983 1 1 10 ASP HB2 H 7.786 -5.344 -3.547 1.00 . A A . 10 ASP HB2 1 1 5 1984 1 1 10 ASP HB3 H 8.473 -5.985 -2.055 1.00 . A A . 10 ASP HB3 1 1 5 1985 1 1 10 ASP N N 5.703 -5.367 -2.286 1.00 . A A . 10 ASP N 1 1 5 1986 1 1 10 ASP O O 7.590 -7.658 -0.587 1.00 . A A . 10 ASP O 1 1 5 1987 1 1 10 ASP OD1 O 8.338 -7.394 -4.911 1.00 . A A . 10 ASP OD1 1 1 5 1988 1 1 10 ASP OD2 O 9.181 -8.174 -3.086 1.00 . A A . 10 ASP OD2 1 1 5 1989 1 1 11 GLY C C 3.964 -8.502 1.282 1.00 . A A . 11 GLY C 1 1 5 1990 1 1 11 GLY CA C 5.374 -8.541 0.692 1.00 . A A . 11 GLY CA 1 1 5 1991 1 1 11 GLY H H 4.544 -7.589 -1.050 1.00 . A A . 11 GLY H 1 1 5 1992 1 1 11 GLY HA2 H 5.668 -9.567 0.519 1.00 . A A . 11 GLY HA2 1 1 5 1993 1 1 11 GLY HA3 H 6.062 -8.079 1.384 1.00 . A A . 11 GLY HA3 1 1 5 1994 1 1 11 GLY N N 5.390 -7.796 -0.599 1.00 . A A . 11 GLY N 1 1 5 1995 1 1 11 GLY O O 3.273 -7.504 1.195 1.00 . A A . 11 GLY O 1 1 5 1996 1 1 12 LYS C C 2.112 -8.754 3.770 1.00 . A A . 12 LYS C 1 1 5 1997 1 1 12 LYS CA C 2.166 -9.611 2.492 1.00 . A A . 12 LYS CA 1 1 5 1998 1 1 12 LYS CB C 1.905 -11.089 2.807 1.00 . A A . 12 LYS CB 1 1 5 1999 1 1 12 LYS CD C 3.587 -12.807 3.516 1.00 . A A . 12 LYS CD 1 1 5 2000 1 1 12 LYS CE C 5.010 -12.757 4.084 1.00 . A A . 12 LYS CE 1 1 5 2001 1 1 12 LYS CG C 2.816 -11.556 3.949 1.00 . A A . 12 LYS CG 1 1 5 2002 1 1 12 LYS H H 4.115 -10.368 1.944 1.00 . A A . 12 LYS H 1 1 5 2003 1 1 12 LYS HA H 1.437 -9.259 1.779 1.00 . A A . 12 LYS HA 1 1 5 2004 1 1 12 LYS HB2 H 0.873 -11.215 3.096 1.00 . A A . 12 LYS HB2 1 1 5 2005 1 1 12 LYS HB3 H 2.105 -11.681 1.926 1.00 . A A . 12 LYS HB3 1 1 5 2006 1 1 12 LYS HD2 H 3.081 -13.686 3.888 1.00 . A A . 12 LYS HD2 1 1 5 2007 1 1 12 LYS HD3 H 3.633 -12.847 2.438 1.00 . A A . 12 LYS HD3 1 1 5 2008 1 1 12 LYS HE2 H 5.124 -11.901 4.735 1.00 . A A . 12 LYS HE2 1 1 5 2009 1 1 12 LYS HE3 H 5.232 -13.669 4.618 1.00 . A A . 12 LYS HE3 1 1 5 2010 1 1 12 LYS HG2 H 3.516 -10.769 4.196 1.00 . A A . 12 LYS HG2 1 1 5 2011 1 1 12 LYS HG3 H 2.217 -11.788 4.816 1.00 . A A . 12 LYS HG3 1 1 5 2012 1 1 12 LYS HZ1 H 5.818 -13.481 2.305 1.00 . A A . 12 LYS HZ1 1 1 5 2013 1 1 12 LYS HZ2 H 6.890 -12.529 3.217 1.00 . A A . 12 LYS HZ2 1 1 5 2014 1 1 12 LYS HZ3 H 5.631 -11.795 2.342 1.00 . A A . 12 LYS HZ3 1 1 5 2015 1 1 12 LYS N N 3.536 -9.580 1.886 1.00 . A A . 12 LYS N 1 1 5 2016 1 1 12 LYS NZ N 5.904 -12.631 2.897 1.00 . A A . 12 LYS NZ 1 1 5 2017 1 1 12 LYS O O 1.049 -8.495 4.303 1.00 . A A . 12 LYS O 1 1 5 2018 1 1 13 SER C C 4.334 -6.377 5.367 1.00 . A A . 13 SER C 1 1 5 2019 1 1 13 SER CA C 3.264 -7.470 5.494 1.00 . A A . 13 SER CA 1 1 5 2020 1 1 13 SER CB C 3.600 -8.443 6.627 1.00 . A A . 13 SER CB 1 1 5 2021 1 1 13 SER H H 4.092 -8.526 3.816 1.00 . A A . 13 SER H 1 1 5 2022 1 1 13 SER HA H 2.294 -7.029 5.663 1.00 . A A . 13 SER HA 1 1 5 2023 1 1 13 SER HB2 H 3.103 -9.382 6.456 1.00 . A A . 13 SER HB2 1 1 5 2024 1 1 13 SER HB3 H 4.670 -8.605 6.657 1.00 . A A . 13 SER HB3 1 1 5 2025 1 1 13 SER HG H 3.917 -7.541 8.323 1.00 . A A . 13 SER HG 1 1 5 2026 1 1 13 SER N N 3.248 -8.310 4.262 1.00 . A A . 13 SER N 1 1 5 2027 1 1 13 SER O O 5.148 -6.179 6.251 1.00 . A A . 13 SER O 1 1 5 2028 1 1 13 SER OG O 3.154 -7.897 7.862 1.00 . A A . 13 SER OG 1 1 5 2029 1 1 14 THR C C 5.082 -3.406 5.013 1.00 . A A . 14 THR C 1 1 5 2030 1 1 14 THR CA C 5.348 -4.581 4.057 1.00 . A A . 14 THR CA 1 1 5 2031 1 1 14 THR CB C 5.174 -4.146 2.593 1.00 . A A . 14 THR CB 1 1 5 2032 1 1 14 THR CG2 C 3.972 -3.202 2.463 1.00 . A A . 14 THR CG2 1 1 5 2033 1 1 14 THR H H 3.669 -5.850 3.568 1.00 . A A . 14 THR H 1 1 5 2034 1 1 14 THR HA H 6.345 -4.966 4.208 1.00 . A A . 14 THR HA 1 1 5 2035 1 1 14 THR HB H 5.009 -5.017 1.977 1.00 . A A . 14 THR HB 1 1 5 2036 1 1 14 THR HG1 H 6.769 -4.024 1.485 1.00 . A A . 14 THR HG1 1 1 5 2037 1 1 14 THR HG21 H 4.181 -2.277 2.982 1.00 . A A . 14 THR HG21 1 1 5 2038 1 1 14 THR HG22 H 3.099 -3.667 2.898 1.00 . A A . 14 THR HG22 1 1 5 2039 1 1 14 THR HG23 H 3.787 -2.993 1.420 1.00 . A A . 14 THR HG23 1 1 5 2040 1 1 14 THR N N 4.336 -5.667 4.264 1.00 . A A . 14 THR N 1 1 5 2041 1 1 14 THR O O 4.116 -3.403 5.755 1.00 . A A . 14 THR O 1 1 5 2042 1 1 14 THR OG1 O 6.351 -3.479 2.157 1.00 . A A . 14 THR OG1 1 1 5 2043 1 1 15 PHE C C 5.439 0.022 5.062 1.00 . A A . 15 PHE C 1 1 5 2044 1 1 15 PHE CA C 5.731 -1.234 5.893 1.00 . A A . 15 PHE CA 1 1 5 2045 1 1 15 PHE CB C 7.047 -1.082 6.664 1.00 . A A . 15 PHE CB 1 1 5 2046 1 1 15 PHE CD1 C 6.184 0.581 8.355 1.00 . A A . 15 PHE CD1 1 1 5 2047 1 1 15 PHE CD2 C 7.071 -1.533 9.147 1.00 . A A . 15 PHE CD2 1 1 5 2048 1 1 15 PHE CE1 C 5.917 0.964 9.675 1.00 . A A . 15 PHE CE1 1 1 5 2049 1 1 15 PHE CE2 C 6.805 -1.149 10.467 1.00 . A A . 15 PHE CE2 1 1 5 2050 1 1 15 PHE CG C 6.760 -0.668 8.090 1.00 . A A . 15 PHE CG 1 1 5 2051 1 1 15 PHE CZ C 6.229 0.099 10.731 1.00 . A A . 15 PHE CZ 1 1 5 2052 1 1 15 PHE H H 6.702 -2.433 4.385 1.00 . A A . 15 PHE H 1 1 5 2053 1 1 15 PHE HA H 4.922 -1.423 6.583 1.00 . A A . 15 PHE HA 1 1 5 2054 1 1 15 PHE HB2 H 7.574 -2.026 6.665 1.00 . A A . 15 PHE HB2 1 1 5 2055 1 1 15 PHE HB3 H 7.660 -0.330 6.189 1.00 . A A . 15 PHE HB3 1 1 5 2056 1 1 15 PHE HD1 H 5.943 1.249 7.541 1.00 . A A . 15 PHE HD1 1 1 5 2057 1 1 15 PHE HD2 H 7.516 -2.496 8.943 1.00 . A A . 15 PHE HD2 1 1 5 2058 1 1 15 PHE HE1 H 5.473 1.927 9.878 1.00 . A A . 15 PHE HE1 1 1 5 2059 1 1 15 PHE HE2 H 7.046 -1.816 11.281 1.00 . A A . 15 PHE HE2 1 1 5 2060 1 1 15 PHE HZ H 6.024 0.395 11.749 1.00 . A A . 15 PHE HZ 1 1 5 2061 1 1 15 PHE N N 5.933 -2.409 4.995 1.00 . A A . 15 PHE N 1 1 5 2062 1 1 15 PHE O O 6.326 0.606 4.468 1.00 . A A . 15 PHE O 1 1 5 2063 1 1 16 CYS C C 4.045 2.916 5.110 1.00 . A A . 16 CYS C 1 1 5 2064 1 1 16 CYS CA C 3.839 1.666 4.239 1.00 . A A . 16 CYS CA 1 1 5 2065 1 1 16 CYS CB C 2.362 1.480 3.865 1.00 . A A . 16 CYS CB 1 1 5 2066 1 1 16 CYS H H 3.502 -0.043 5.517 1.00 . A A . 16 CYS H 1 1 5 2067 1 1 16 CYS HA H 4.442 1.732 3.345 1.00 . A A . 16 CYS HA 1 1 5 2068 1 1 16 CYS HB2 H 1.769 1.409 4.764 1.00 . A A . 16 CYS HB2 1 1 5 2069 1 1 16 CYS HB3 H 2.029 2.325 3.281 1.00 . A A . 16 CYS HB3 1 1 5 2070 1 1 16 CYS N N 4.198 0.443 5.024 1.00 . A A . 16 CYS N 1 1 5 2071 1 1 16 CYS O O 4.911 2.942 5.964 1.00 . A A . 16 CYS O 1 1 5 2072 1 1 16 CYS SG S 2.163 -0.037 2.892 1.00 . A A . 16 CYS SG 1 1 5 2073 1 1 17 CYS C C 2.782 5.013 7.097 1.00 . A A . 17 CYS C 1 1 5 2074 1 1 17 CYS CA C 3.440 5.189 5.725 1.00 . A A . 17 CYS CA 1 1 5 2075 1 1 17 CYS CB C 2.752 6.302 4.931 1.00 . A A . 17 CYS CB 1 1 5 2076 1 1 17 CYS H H 2.578 3.919 4.208 1.00 . A A . 17 CYS H 1 1 5 2077 1 1 17 CYS HA H 4.484 5.415 5.842 1.00 . A A . 17 CYS HA 1 1 5 2078 1 1 17 CYS HB2 H 2.788 6.067 3.877 1.00 . A A . 17 CYS HB2 1 1 5 2079 1 1 17 CYS HB3 H 1.724 6.389 5.245 1.00 . A A . 17 CYS HB3 1 1 5 2080 1 1 17 CYS N N 3.268 3.952 4.902 1.00 . A A . 17 CYS N 1 1 5 2081 1 1 17 CYS O O 3.422 5.156 8.123 1.00 . A A . 17 CYS O 1 1 5 2082 1 1 17 CYS SG S 3.609 7.868 5.227 1.00 . A A . 17 CYS SG 1 1 5 2083 1 1 18 SER C C -0.457 3.658 8.217 1.00 . A A . 18 SER C 1 1 5 2084 1 1 18 SER CA C 0.798 4.517 8.422 1.00 . A A . 18 SER CA 1 1 5 2085 1 1 18 SER CB C 0.432 5.932 8.894 1.00 . A A . 18 SER CB 1 1 5 2086 1 1 18 SER H H 1.026 4.596 6.277 1.00 . A A . 18 SER H 1 1 5 2087 1 1 18 SER HA H 1.452 4.050 9.140 1.00 . A A . 18 SER HA 1 1 5 2088 1 1 18 SER HB2 H -0.321 5.872 9.662 1.00 . A A . 18 SER HB2 1 1 5 2089 1 1 18 SER HB3 H 1.314 6.413 9.297 1.00 . A A . 18 SER HB3 1 1 5 2090 1 1 18 SER HG H -0.217 7.588 8.100 1.00 . A A . 18 SER HG 1 1 5 2091 1 1 18 SER N N 1.511 4.705 7.120 1.00 . A A . 18 SER N 1 1 5 2092 1 1 18 SER O O -0.442 2.464 8.451 1.00 . A A . 18 SER O 1 1 5 2093 1 1 18 SER OG O -0.076 6.687 7.799 1.00 . A A . 18 SER OG 1 1 5 2094 1 1 19 GLY C C -2.785 2.882 6.130 1.00 . A A . 19 GLY C 1 1 5 2095 1 1 19 GLY CA C -2.791 3.476 7.544 1.00 . A A . 19 GLY CA 1 1 5 2096 1 1 19 GLY H H -1.521 5.214 7.587 1.00 . A A . 19 GLY H 1 1 5 2097 1 1 19 GLY HA2 H -2.856 2.677 8.270 1.00 . A A . 19 GLY HA2 1 1 5 2098 1 1 19 GLY HA3 H -3.644 4.129 7.652 1.00 . A A . 19 GLY HA3 1 1 5 2099 1 1 19 GLY N N -1.537 4.253 7.774 1.00 . A A . 19 GLY N 1 1 5 2100 1 1 19 GLY O O -3.400 1.864 5.880 1.00 . A A . 19 GLY O 1 1 5 2101 1 1 20 TYR C C -1.711 1.501 3.782 1.00 . A A . 20 TYR C 1 1 5 2102 1 1 20 TYR CA C -2.035 3.001 3.797 1.00 . A A . 20 TYR CA 1 1 5 2103 1 1 20 TYR CB C -0.900 3.790 3.133 1.00 . A A . 20 TYR CB 1 1 5 2104 1 1 20 TYR CD1 C -2.270 5.912 3.258 1.00 . A A . 20 TYR CD1 1 1 5 2105 1 1 20 TYR CD2 C -1.114 5.384 1.195 1.00 . A A . 20 TYR CD2 1 1 5 2106 1 1 20 TYR CE1 C -2.766 7.086 2.681 1.00 . A A . 20 TYR CE1 1 1 5 2107 1 1 20 TYR CE2 C -1.607 6.559 0.619 1.00 . A A . 20 TYR CE2 1 1 5 2108 1 1 20 TYR CG C -1.444 5.059 2.515 1.00 . A A . 20 TYR CG 1 1 5 2109 1 1 20 TYR CZ C -2.434 7.409 1.360 1.00 . A A . 20 TYR CZ 1 1 5 2110 1 1 20 TYR H H -1.608 4.334 5.440 1.00 . A A . 20 TYR H 1 1 5 2111 1 1 20 TYR HA H -2.965 3.196 3.282 1.00 . A A . 20 TYR HA 1 1 5 2112 1 1 20 TYR HB2 H -0.156 4.042 3.874 1.00 . A A . 20 TYR HB2 1 1 5 2113 1 1 20 TYR HB3 H -0.446 3.183 2.363 1.00 . A A . 20 TYR HB3 1 1 5 2114 1 1 20 TYR HD1 H -2.526 5.664 4.278 1.00 . A A . 20 TYR HD1 1 1 5 2115 1 1 20 TYR HD2 H -0.478 4.728 0.621 1.00 . A A . 20 TYR HD2 1 1 5 2116 1 1 20 TYR HE1 H -3.404 7.742 3.254 1.00 . A A . 20 TYR HE1 1 1 5 2117 1 1 20 TYR HE2 H -1.351 6.809 -0.399 1.00 . A A . 20 TYR HE2 1 1 5 2118 1 1 20 TYR HH H -2.263 9.256 0.904 1.00 . A A . 20 TYR HH 1 1 5 2119 1 1 20 TYR N N -2.092 3.515 5.206 1.00 . A A . 20 TYR N 1 1 5 2120 1 1 20 TYR O O -0.711 1.069 4.326 1.00 . A A . 20 TYR O 1 1 5 2121 1 1 20 TYR OH O -2.922 8.567 0.790 1.00 . A A . 20 TYR OH 1 1 5 2122 1 1 21 ASN C C -1.439 -1.084 1.854 1.00 . A A . 21 ASN C 1 1 5 2123 1 1 21 ASN CA C -2.283 -0.763 3.093 1.00 . A A . 21 ASN CA 1 1 5 2124 1 1 21 ASN CB C -3.669 -1.413 2.991 1.00 . A A . 21 ASN CB 1 1 5 2125 1 1 21 ASN CG C -3.709 -2.686 3.841 1.00 . A A . 21 ASN CG 1 1 5 2126 1 1 21 ASN H H -3.339 1.082 2.719 1.00 . A A . 21 ASN H 1 1 5 2127 1 1 21 ASN HA H -1.781 -1.097 3.986 1.00 . A A . 21 ASN HA 1 1 5 2128 1 1 21 ASN HB2 H -4.417 -0.720 3.346 1.00 . A A . 21 ASN HB2 1 1 5 2129 1 1 21 ASN HB3 H -3.873 -1.664 1.961 1.00 . A A . 21 ASN HB3 1 1 5 2130 1 1 21 ASN HD21 H -3.733 -3.910 2.274 1.00 . A A . 21 ASN HD21 1 1 5 2131 1 1 21 ASN HD22 H -3.763 -4.673 3.790 1.00 . A A . 21 ASN HD22 1 1 5 2132 1 1 21 ASN N N -2.545 0.708 3.155 1.00 . A A . 21 ASN N 1 1 5 2133 1 1 21 ASN ND2 N -3.738 -3.853 3.252 1.00 . A A . 21 ASN ND2 1 1 5 2134 1 1 21 ASN O O -0.933 -0.196 1.201 1.00 . A A . 21 ASN O 1 1 5 2135 1 1 21 ASN OD1 O -3.719 -2.621 5.053 1.00 . A A . 21 ASN OD1 1 1 5 2136 1 1 22 CYS C C -1.358 -3.375 -0.728 1.00 . A A . 22 CYS C 1 1 5 2137 1 1 22 CYS CA C -0.469 -2.713 0.332 1.00 . A A . 22 CYS CA 1 1 5 2138 1 1 22 CYS CB C 0.583 -3.699 0.853 1.00 . A A . 22 CYS CB 1 1 5 2139 1 1 22 CYS H H -1.695 -3.039 2.073 1.00 . A A . 22 CYS H 1 1 5 2140 1 1 22 CYS HA H 0.016 -1.843 -0.077 1.00 . A A . 22 CYS HA 1 1 5 2141 1 1 22 CYS HB2 H 1.428 -3.149 1.239 1.00 . A A . 22 CYS HB2 1 1 5 2142 1 1 22 CYS HB3 H 0.155 -4.299 1.640 1.00 . A A . 22 CYS HB3 1 1 5 2143 1 1 22 CYS N N -1.281 -2.340 1.529 1.00 . A A . 22 CYS N 1 1 5 2144 1 1 22 CYS O O -2.331 -4.035 -0.412 1.00 . A A . 22 CYS O 1 1 5 2145 1 1 22 CYS SG S 1.134 -4.777 -0.497 1.00 . A A . 22 CYS SG 1 1 5 2146 1 1 23 SER C C -1.022 -4.928 -3.772 1.00 . A A . 23 SER C 1 1 5 2147 1 1 23 SER CA C -1.834 -3.824 -3.071 1.00 . A A . 23 SER CA 1 1 5 2148 1 1 23 SER CB C -2.133 -2.679 -4.035 1.00 . A A . 23 SER CB 1 1 5 2149 1 1 23 SER H H -0.231 -2.672 -2.207 1.00 . A A . 23 SER H 1 1 5 2150 1 1 23 SER HA H -2.754 -4.224 -2.675 1.00 . A A . 23 SER HA 1 1 5 2151 1 1 23 SER HB2 H -1.423 -1.884 -3.889 1.00 . A A . 23 SER HB2 1 1 5 2152 1 1 23 SER HB3 H -2.060 -3.039 -5.051 1.00 . A A . 23 SER HB3 1 1 5 2153 1 1 23 SER HG H -4.070 -2.874 -4.029 1.00 . A A . 23 SER HG 1 1 5 2154 1 1 23 SER N N -1.022 -3.205 -1.981 1.00 . A A . 23 SER N 1 1 5 2155 1 1 23 SER O O 0.130 -4.726 -4.103 1.00 . A A . 23 SER O 1 1 5 2156 1 1 23 SER OG O -3.444 -2.188 -3.786 1.00 . A A . 23 SER OG 1 1 5 2157 1 1 24 PRO C C -0.862 -6.997 -6.143 1.00 . A A . 24 PRO C 1 1 5 2158 1 1 24 PRO CA C -0.972 -7.212 -4.625 1.00 . A A . 24 PRO CA 1 1 5 2159 1 1 24 PRO CB C -1.878 -8.397 -4.303 1.00 . A A . 24 PRO CB 1 1 5 2160 1 1 24 PRO CD C -3.037 -6.387 -3.594 1.00 . A A . 24 PRO CD 1 1 5 2161 1 1 24 PRO CG C -3.234 -7.808 -4.060 1.00 . A A . 24 PRO CG 1 1 5 2162 1 1 24 PRO HA H 0.000 -7.368 -4.198 1.00 . A A . 24 PRO HA 1 1 5 2163 1 1 24 PRO HB2 H -1.909 -9.082 -5.140 1.00 . A A . 24 PRO HB2 1 1 5 2164 1 1 24 PRO HB3 H -1.532 -8.904 -3.416 1.00 . A A . 24 PRO HB3 1 1 5 2165 1 1 24 PRO HD2 H -3.731 -5.727 -4.100 1.00 . A A . 24 PRO HD2 1 1 5 2166 1 1 24 PRO HD3 H -3.160 -6.318 -2.524 1.00 . A A . 24 PRO HD3 1 1 5 2167 1 1 24 PRO HG2 H -3.808 -7.822 -4.976 1.00 . A A . 24 PRO HG2 1 1 5 2168 1 1 24 PRO HG3 H -3.747 -8.370 -3.296 1.00 . A A . 24 PRO HG3 1 1 5 2169 1 1 24 PRO N N -1.652 -6.064 -3.967 1.00 . A A . 24 PRO N 1 1 5 2170 1 1 24 PRO O O 0.184 -7.194 -6.731 1.00 . A A . 24 PRO O 1 1 5 2171 1 1 25 THR C C -1.171 -5.059 -8.591 1.00 . A A . 25 THR C 1 1 5 2172 1 1 25 THR CA C -1.911 -6.365 -8.256 1.00 . A A . 25 THR CA 1 1 5 2173 1 1 25 THR CB C -3.390 -6.267 -8.659 1.00 . A A . 25 THR CB 1 1 5 2174 1 1 25 THR CG2 C -3.508 -5.883 -10.137 1.00 . A A . 25 THR CG2 1 1 5 2175 1 1 25 THR H H -2.763 -6.445 -6.273 1.00 . A A . 25 THR H 1 1 5 2176 1 1 25 THR HA H -1.448 -7.199 -8.759 1.00 . A A . 25 THR HA 1 1 5 2177 1 1 25 THR HB H -3.876 -5.513 -8.058 1.00 . A A . 25 THR HB 1 1 5 2178 1 1 25 THR HG1 H -3.662 -8.152 -9.073 1.00 . A A . 25 THR HG1 1 1 5 2179 1 1 25 THR HG21 H -3.429 -4.810 -10.238 1.00 . A A . 25 THR HG21 1 1 5 2180 1 1 25 THR HG22 H -4.466 -6.208 -10.518 1.00 . A A . 25 THR HG22 1 1 5 2181 1 1 25 THR HG23 H -2.717 -6.357 -10.698 1.00 . A A . 25 THR HG23 1 1 5 2182 1 1 25 THR N N -1.936 -6.596 -6.774 1.00 . A A . 25 THR N 1 1 5 2183 1 1 25 THR O O -0.714 -4.869 -9.702 1.00 . A A . 25 THR O 1 1 5 2184 1 1 25 THR OG1 O -4.023 -7.522 -8.444 1.00 . A A . 25 THR OG1 1 1 5 2185 1 1 26 TRP C C 1.072 -2.890 -7.337 1.00 . A A . 26 TRP C 1 1 5 2186 1 1 26 TRP CA C -0.360 -2.863 -7.906 1.00 . A A . 26 TRP CA 1 1 5 2187 1 1 26 TRP CB C -1.218 -1.803 -7.202 1.00 . A A . 26 TRP CB 1 1 5 2188 1 1 26 TRP CD1 C -3.550 -2.779 -6.979 1.00 . A A . 26 TRP CD1 1 1 5 2189 1 1 26 TRP CD2 C -3.385 -1.329 -8.691 1.00 . A A . 26 TRP CD2 1 1 5 2190 1 1 26 TRP CE2 C -4.720 -1.797 -8.680 1.00 . A A . 26 TRP CE2 1 1 5 2191 1 1 26 TRP CE3 C -3.019 -0.399 -9.679 1.00 . A A . 26 TRP CE3 1 1 5 2192 1 1 26 TRP CG C -2.659 -1.968 -7.599 1.00 . A A . 26 TRP CG 1 1 5 2193 1 1 26 TRP CH2 C -5.277 -0.433 -10.589 1.00 . A A . 26 TRP CH2 1 1 5 2194 1 1 26 TRP CZ2 C -5.657 -1.360 -9.615 1.00 . A A . 26 TRP CZ2 1 1 5 2195 1 1 26 TRP CZ3 C -3.960 0.044 -10.622 1.00 . A A . 26 TRP CZ3 1 1 5 2196 1 1 26 TRP H H -1.441 -4.334 -6.757 1.00 . A A . 26 TRP H 1 1 5 2197 1 1 26 TRP HA H -0.334 -2.663 -8.966 1.00 . A A . 26 TRP HA 1 1 5 2198 1 1 26 TRP HB2 H -1.124 -1.917 -6.132 1.00 . A A . 26 TRP HB2 1 1 5 2199 1 1 26 TRP HB3 H -0.878 -0.820 -7.487 1.00 . A A . 26 TRP HB3 1 1 5 2200 1 1 26 TRP HD1 H -3.342 -3.406 -6.126 1.00 . A A . 26 TRP HD1 1 1 5 2201 1 1 26 TRP HE1 H -5.579 -3.169 -7.372 1.00 . A A . 26 TRP HE1 1 1 5 2202 1 1 26 TRP HE3 H -2.007 -0.026 -9.715 1.00 . A A . 26 TRP HE3 1 1 5 2203 1 1 26 TRP HH2 H -5.996 -0.089 -11.317 1.00 . A A . 26 TRP HH2 1 1 5 2204 1 1 26 TRP HZ2 H -6.671 -1.733 -9.585 1.00 . A A . 26 TRP HZ2 1 1 5 2205 1 1 26 TRP HZ3 H -3.668 0.760 -11.376 1.00 . A A . 26 TRP HZ3 1 1 5 2206 1 1 26 TRP N N -1.059 -4.161 -7.643 1.00 . A A . 26 TRP N 1 1 5 2207 1 1 26 TRP NE1 N -4.770 -2.681 -7.622 1.00 . A A . 26 TRP NE1 1 1 5 2208 1 1 26 TRP O O 1.904 -2.082 -7.703 1.00 . A A . 26 TRP O 1 1 5 2209 1 1 27 LYS C C 3.173 -2.675 -5.110 1.00 . A A . 27 LYS C 1 1 5 2210 1 1 27 LYS CA C 2.734 -3.949 -5.858 1.00 . A A . 27 LYS CA 1 1 5 2211 1 1 27 LYS CB C 3.676 -4.240 -7.035 1.00 . A A . 27 LYS CB 1 1 5 2212 1 1 27 LYS CD C 4.874 -6.228 -6.082 1.00 . A A . 27 LYS CD 1 1 5 2213 1 1 27 LYS CE C 4.667 -7.725 -5.819 1.00 . A A . 27 LYS CE 1 1 5 2214 1 1 27 LYS CG C 3.891 -5.754 -7.159 1.00 . A A . 27 LYS CG 1 1 5 2215 1 1 27 LYS H H 0.670 -4.467 -6.193 1.00 . A A . 27 LYS H 1 1 5 2216 1 1 27 LYS HA H 2.754 -4.786 -5.178 1.00 . A A . 27 LYS HA 1 1 5 2217 1 1 27 LYS HB2 H 3.243 -3.862 -7.948 1.00 . A A . 27 LYS HB2 1 1 5 2218 1 1 27 LYS HB3 H 4.628 -3.759 -6.863 1.00 . A A . 27 LYS HB3 1 1 5 2219 1 1 27 LYS HD2 H 5.886 -6.059 -6.419 1.00 . A A . 27 LYS HD2 1 1 5 2220 1 1 27 LYS HD3 H 4.701 -5.678 -5.170 1.00 . A A . 27 LYS HD3 1 1 5 2221 1 1 27 LYS HE2 H 4.366 -8.227 -6.728 1.00 . A A . 27 LYS HE2 1 1 5 2222 1 1 27 LYS HE3 H 5.571 -8.166 -5.428 1.00 . A A . 27 LYS HE3 1 1 5 2223 1 1 27 LYS HG2 H 2.946 -6.261 -7.034 1.00 . A A . 27 LYS HG2 1 1 5 2224 1 1 27 LYS HG3 H 4.294 -5.980 -8.135 1.00 . A A . 27 LYS HG3 1 1 5 2225 1 1 27 LYS HZ1 H 2.698 -7.430 -5.203 1.00 . A A . 27 LYS HZ1 1 1 5 2226 1 1 27 LYS HZ2 H 3.847 -7.229 -3.966 1.00 . A A . 27 LYS HZ2 1 1 5 2227 1 1 27 LYS HZ3 H 3.443 -8.787 -4.510 1.00 . A A . 27 LYS HZ3 1 1 5 2228 1 1 27 LYS N N 1.362 -3.826 -6.457 1.00 . A A . 27 LYS N 1 1 5 2229 1 1 27 LYS NZ N 3.582 -7.797 -4.797 1.00 . A A . 27 LYS NZ 1 1 5 2230 1 1 27 LYS O O 4.353 -2.459 -4.902 1.00 . A A . 27 LYS O 1 1 5 2231 1 1 28 TRP C C 1.633 -0.304 -2.812 1.00 . A A . 28 TRP C 1 1 5 2232 1 1 28 TRP CA C 2.656 -0.621 -3.909 1.00 . A A . 28 TRP CA 1 1 5 2233 1 1 28 TRP CB C 2.778 0.526 -4.933 1.00 . A A . 28 TRP CB 1 1 5 2234 1 1 28 TRP CD1 C 0.340 1.250 -4.881 1.00 . A A . 28 TRP CD1 1 1 5 2235 1 1 28 TRP CD2 C 1.134 0.994 -6.968 1.00 . A A . 28 TRP CD2 1 1 5 2236 1 1 28 TRP CE2 C -0.213 1.403 -7.094 1.00 . A A . 28 TRP CE2 1 1 5 2237 1 1 28 TRP CE3 C 1.872 0.765 -8.146 1.00 . A A . 28 TRP CE3 1 1 5 2238 1 1 28 TRP CG C 1.462 0.895 -5.552 1.00 . A A . 28 TRP CG 1 1 5 2239 1 1 28 TRP CH2 C -0.063 1.348 -9.501 1.00 . A A . 28 TRP CH2 1 1 5 2240 1 1 28 TRP CZ2 C -0.809 1.578 -8.342 1.00 . A A . 28 TRP CZ2 1 1 5 2241 1 1 28 TRP CZ3 C 1.274 0.942 -9.403 1.00 . A A . 28 TRP CZ3 1 1 5 2242 1 1 28 TRP H H 1.301 -2.039 -4.819 1.00 . A A . 28 TRP H 1 1 5 2243 1 1 28 TRP HA H 3.621 -0.788 -3.453 1.00 . A A . 28 TRP HA 1 1 5 2244 1 1 28 TRP HB2 H 3.180 1.395 -4.436 1.00 . A A . 28 TRP HB2 1 1 5 2245 1 1 28 TRP HB3 H 3.461 0.224 -5.713 1.00 . A A . 28 TRP HB3 1 1 5 2246 1 1 28 TRP HD1 H 0.236 1.292 -3.809 1.00 . A A . 28 TRP HD1 1 1 5 2247 1 1 28 TRP HE1 H -1.565 1.823 -5.569 1.00 . A A . 28 TRP HE1 1 1 5 2248 1 1 28 TRP HE3 H 2.904 0.454 -8.080 1.00 . A A . 28 TRP HE3 1 1 5 2249 1 1 28 TRP HH2 H -0.517 1.481 -10.472 1.00 . A A . 28 TRP HH2 1 1 5 2250 1 1 28 TRP HZ2 H -1.840 1.893 -8.413 1.00 . A A . 28 TRP HZ2 1 1 5 2251 1 1 28 TRP HZ3 H 1.849 0.763 -10.301 1.00 . A A . 28 TRP HZ3 1 1 5 2252 1 1 28 TRP N N 2.250 -1.845 -4.671 1.00 . A A . 28 TRP N 1 1 5 2253 1 1 28 TRP NE1 N -0.653 1.544 -5.795 1.00 . A A . 28 TRP NE1 1 1 5 2254 1 1 28 TRP O O 0.512 -0.778 -2.839 1.00 . A A . 28 TRP O 1 1 5 2255 1 1 29 CYS C C -0.049 1.731 -1.248 1.00 . A A . 29 CYS C 1 1 5 2256 1 1 29 CYS CA C 1.073 0.826 -0.730 1.00 . A A . 29 CYS CA 1 1 5 2257 1 1 29 CYS CB C 1.911 1.554 0.326 1.00 . A A . 29 CYS CB 1 1 5 2258 1 1 29 CYS H H 2.929 0.848 -1.831 1.00 . A A . 29 CYS H 1 1 5 2259 1 1 29 CYS HA H 0.658 -0.076 -0.309 1.00 . A A . 29 CYS HA 1 1 5 2260 1 1 29 CYS HB2 H 2.481 2.338 -0.146 1.00 . A A . 29 CYS HB2 1 1 5 2261 1 1 29 CYS HB3 H 1.257 1.983 1.071 1.00 . A A . 29 CYS HB3 1 1 5 2262 1 1 29 CYS N N 2.017 0.486 -1.837 1.00 . A A . 29 CYS N 1 1 5 2263 1 1 29 CYS O O 0.180 2.636 -2.025 1.00 . A A . 29 CYS O 1 1 5 2264 1 1 29 CYS SG S 3.040 0.382 1.120 1.00 . A A . 29 CYS SG 1 1 5 2265 1 1 30 VAL C C -3.139 2.910 -0.064 1.00 . A A . 30 VAL C 1 1 5 2266 1 1 30 VAL CA C -2.415 2.315 -1.276 1.00 . A A . 30 VAL CA 1 1 5 2267 1 1 30 VAL CB C -3.337 1.348 -2.036 1.00 . A A . 30 VAL CB 1 1 5 2268 1 1 30 VAL CG1 C -2.590 0.759 -3.235 1.00 . A A . 30 VAL CG1 1 1 5 2269 1 1 30 VAL CG2 C -3.784 0.209 -1.108 1.00 . A A . 30 VAL CG2 1 1 5 2270 1 1 30 VAL H H -1.409 0.746 -0.196 1.00 . A A . 30 VAL H 1 1 5 2271 1 1 30 VAL HA H -2.079 3.100 -1.935 1.00 . A A . 30 VAL HA 1 1 5 2272 1 1 30 VAL HB H -4.206 1.886 -2.388 1.00 . A A . 30 VAL HB 1 1 5 2273 1 1 30 VAL HG11 H -1.875 1.479 -3.603 1.00 . A A . 30 VAL HG11 1 1 5 2274 1 1 30 VAL HG12 H -3.294 0.520 -4.018 1.00 . A A . 30 VAL HG12 1 1 5 2275 1 1 30 VAL HG13 H -2.072 -0.140 -2.932 1.00 . A A . 30 VAL HG13 1 1 5 2276 1 1 30 VAL HG21 H -4.856 0.094 -1.170 1.00 . A A . 30 VAL HG21 1 1 5 2277 1 1 30 VAL HG22 H -3.506 0.440 -0.091 1.00 . A A . 30 VAL HG22 1 1 5 2278 1 1 30 VAL HG23 H -3.306 -0.711 -1.411 1.00 . A A . 30 VAL HG23 1 1 5 2279 1 1 30 VAL N N -1.258 1.483 -0.821 1.00 . A A . 30 VAL N 1 1 5 2280 1 1 30 VAL O O -2.864 2.553 1.063 1.00 . A A . 30 VAL O 1 1 5 2281 1 1 31 TYR C C -5.592 3.343 1.629 1.00 . A A . 31 TYR C 1 1 5 2282 1 1 31 TYR CA C -4.812 4.423 0.858 1.00 . A A . 31 TYR CA 1 1 5 2283 1 1 31 TYR CB C -5.775 5.442 0.221 1.00 . A A . 31 TYR CB 1 1 5 2284 1 1 31 TYR CD1 C -7.616 3.818 -0.395 1.00 . A A . 31 TYR CD1 1 1 5 2285 1 1 31 TYR CD2 C -6.548 5.090 -2.160 1.00 . A A . 31 TYR CD2 1 1 5 2286 1 1 31 TYR CE1 C -8.439 3.197 -1.337 1.00 . A A . 31 TYR CE1 1 1 5 2287 1 1 31 TYR CE2 C -7.372 4.467 -3.105 1.00 . A A . 31 TYR CE2 1 1 5 2288 1 1 31 TYR CG C -6.668 4.766 -0.803 1.00 . A A . 31 TYR CG 1 1 5 2289 1 1 31 TYR CZ C -8.317 3.520 -2.692 1.00 . A A . 31 TYR CZ 1 1 5 2290 1 1 31 TYR H H -4.266 4.079 -1.207 1.00 . A A . 31 TYR H 1 1 5 2291 1 1 31 TYR HA H -4.129 4.929 1.521 1.00 . A A . 31 TYR HA 1 1 5 2292 1 1 31 TYR HB2 H -6.388 5.884 0.994 1.00 . A A . 31 TYR HB2 1 1 5 2293 1 1 31 TYR HB3 H -5.199 6.218 -0.263 1.00 . A A . 31 TYR HB3 1 1 5 2294 1 1 31 TYR HD1 H -7.710 3.566 0.649 1.00 . A A . 31 TYR HD1 1 1 5 2295 1 1 31 TYR HD2 H -5.819 5.820 -2.478 1.00 . A A . 31 TYR HD2 1 1 5 2296 1 1 31 TYR HE1 H -9.168 2.467 -1.019 1.00 . A A . 31 TYR HE1 1 1 5 2297 1 1 31 TYR HE2 H -7.279 4.716 -4.151 1.00 . A A . 31 TYR HE2 1 1 5 2298 1 1 31 TYR HH H -9.828 3.519 -3.862 1.00 . A A . 31 TYR HH 1 1 5 2299 1 1 31 TYR N N -4.062 3.809 -0.288 1.00 . A A . 31 TYR N 1 1 5 2300 1 1 31 TYR O O -5.651 2.197 1.220 1.00 . A A . 31 TYR O 1 1 5 2301 1 1 31 TYR OH O -9.130 2.905 -3.623 1.00 . A A . 31 TYR OH 1 1 5 2302 1 1 32 ALA C C -8.330 3.260 3.951 1.00 . A A . 32 ALA C 1 1 5 2303 1 1 32 ALA CA C -6.969 2.688 3.525 1.00 . A A . 32 ALA CA 1 1 5 2304 1 1 32 ALA CB C -6.094 2.380 4.744 1.00 . A A . 32 ALA CB 1 1 5 2305 1 1 32 ALA H H -6.138 4.625 3.052 1.00 . A A . 32 ALA H 1 1 5 2306 1 1 32 ALA HA H -7.112 1.794 2.941 1.00 . A A . 32 ALA HA 1 1 5 2307 1 1 32 ALA HB1 H -6.467 2.917 5.602 1.00 . A A . 32 ALA HB1 1 1 5 2308 1 1 32 ALA HB2 H -5.078 2.686 4.542 1.00 . A A . 32 ALA HB2 1 1 5 2309 1 1 32 ALA HB3 H -6.116 1.319 4.945 1.00 . A A . 32 ALA HB3 1 1 5 2310 1 1 32 ALA N N -6.193 3.698 2.739 1.00 . A A . 32 ALA N 1 1 5 2311 1 1 32 ALA O O -8.731 3.148 5.096 1.00 . A A . 32 ALA O 1 1 5 2312 1 1 33 ARG C C -10.340 5.301 4.606 1.00 . A A . 33 ARG C 1 1 5 2313 1 1 33 ARG CA C -10.388 4.447 3.326 1.00 . A A . 33 ARG CA 1 1 5 2314 1 1 33 ARG CB C -11.327 3.246 3.500 1.00 . A A . 33 ARG CB 1 1 5 2315 1 1 33 ARG CD C -13.735 2.613 3.788 1.00 . A A . 33 ARG CD 1 1 5 2316 1 1 33 ARG CG C -12.775 3.691 3.270 1.00 . A A . 33 ARG CG 1 1 5 2317 1 1 33 ARG CZ C -16.103 2.476 3.278 1.00 . A A . 33 ARG CZ 1 1 5 2318 1 1 33 ARG H H -8.686 3.918 2.113 1.00 . A A . 33 ARG H 1 1 5 2319 1 1 33 ARG HA H -10.723 5.048 2.494 1.00 . A A . 33 ARG HA 1 1 5 2320 1 1 33 ARG HB2 H -11.067 2.480 2.783 1.00 . A A . 33 ARG HB2 1 1 5 2321 1 1 33 ARG HB3 H -11.228 2.850 4.499 1.00 . A A . 33 ARG HB3 1 1 5 2322 1 1 33 ARG HD2 H -13.250 1.647 3.785 1.00 . A A . 33 ARG HD2 1 1 5 2323 1 1 33 ARG HD3 H -14.077 2.860 4.781 1.00 . A A . 33 ARG HD3 1 1 5 2324 1 1 33 ARG HE H -14.722 2.734 1.874 1.00 . A A . 33 ARG HE 1 1 5 2325 1 1 33 ARG HG2 H -12.954 4.616 3.797 1.00 . A A . 33 ARG HG2 1 1 5 2326 1 1 33 ARG HG3 H -12.942 3.839 2.213 1.00 . A A . 33 ARG HG3 1 1 5 2327 1 1 33 ARG HH11 H -15.892 0.520 3.665 1.00 . A A . 33 ARG HH11 1 1 5 2328 1 1 33 ARG HH12 H -17.448 1.191 4.028 1.00 . A A . 33 ARG HH12 1 1 5 2329 1 1 33 ARG HH21 H -16.601 4.397 2.992 1.00 . A A . 33 ARG HH21 1 1 5 2330 1 1 33 ARG HH22 H -17.848 3.390 3.646 1.00 . A A . 33 ARG HH22 1 1 5 2331 1 1 33 ARG N N -9.040 3.859 3.022 1.00 . A A . 33 ARG N 1 1 5 2332 1 1 33 ARG NE N -14.882 2.621 2.835 1.00 . A A . 33 ARG NE 1 1 5 2333 1 1 33 ARG NH1 N -16.513 1.305 3.689 1.00 . A A . 33 ARG NH1 1 1 5 2334 1 1 33 ARG NH2 N -16.914 3.500 3.308 1.00 . A A . 33 ARG NH2 1 1 5 2335 1 1 33 ARG O O -10.729 4.851 5.669 1.00 . A A . 33 ARG O 1 1 5 2336 1 1 34 PRO C C -11.151 7.950 6.026 1.00 . A A . 34 PRO C 1 1 5 2337 1 1 34 PRO CA C -9.760 7.445 5.612 1.00 . A A . 34 PRO CA 1 1 5 2338 1 1 34 PRO CB C -8.893 8.584 5.080 1.00 . A A . 34 PRO CB 1 1 5 2339 1 1 34 PRO CD C -9.378 7.130 3.212 1.00 . A A . 34 PRO CD 1 1 5 2340 1 1 34 PRO CG C -9.078 8.556 3.597 1.00 . A A . 34 PRO CG 1 1 5 2341 1 1 34 PRO HA H -9.268 6.965 6.443 1.00 . A A . 34 PRO HA 1 1 5 2342 1 1 34 PRO HB2 H -9.226 9.529 5.486 1.00 . A A . 34 PRO HB2 1 1 5 2343 1 1 34 PRO HB3 H -7.857 8.413 5.326 1.00 . A A . 34 PRO HB3 1 1 5 2344 1 1 34 PRO HD2 H -10.141 7.098 2.447 1.00 . A A . 34 PRO HD2 1 1 5 2345 1 1 34 PRO HD3 H -8.481 6.631 2.877 1.00 . A A . 34 PRO HD3 1 1 5 2346 1 1 34 PRO HG2 H -9.902 9.198 3.318 1.00 . A A . 34 PRO HG2 1 1 5 2347 1 1 34 PRO HG3 H -8.172 8.881 3.106 1.00 . A A . 34 PRO HG3 1 1 5 2348 1 1 34 PRO N N -9.863 6.515 4.456 1.00 . A A . 34 PRO N 1 1 5 2349 1 1 34 PRO O O -11.834 8.519 5.188 1.00 . A A . 34 PRO O 1 1 5 2350 1 1 34 PRO OXT O -11.510 7.753 7.175 1.00 . A A . 34 PRO OXT 1 1 6 2351 1 1 1 GLY C C 8.898 6.004 5.718 1.00 . A A . 1 GLY C 1 1 6 2352 1 1 1 GLY CA C 10.417 5.898 5.901 1.00 . A A . 1 GLY CA 1 1 6 2353 1 1 1 GLY H1 H 11.715 5.604 7.506 1.00 . A A . 1 GLY H1 1 1 6 2354 1 1 1 GLY H2 H 10.598 4.344 7.278 1.00 . A A . 1 GLY H2 1 1 6 2355 1 1 1 GLY H3 H 10.095 5.817 7.961 1.00 . A A . 1 GLY H3 1 1 6 2356 1 1 1 GLY HA2 H 10.862 6.876 5.783 1.00 . A A . 1 GLY HA2 1 1 6 2357 1 1 1 GLY HA3 H 10.820 5.227 5.159 1.00 . A A . 1 GLY HA3 1 1 6 2358 1 1 1 GLY N N 10.730 5.376 7.265 1.00 . A A . 1 GLY N 1 1 6 2359 1 1 1 GLY O O 8.146 5.997 6.675 1.00 . A A . 1 GLY O 1 1 6 2360 1 1 2 CYS C C 6.631 5.730 2.828 1.00 . A A . 2 CYS C 1 1 6 2361 1 1 2 CYS CA C 6.974 6.217 4.242 1.00 . A A . 2 CYS CA 1 1 6 2362 1 1 2 CYS CB C 6.668 7.709 4.393 1.00 . A A . 2 CYS CB 1 1 6 2363 1 1 2 CYS H H 9.071 6.113 3.738 1.00 . A A . 2 CYS H 1 1 6 2364 1 1 2 CYS HA H 6.424 5.653 4.978 1.00 . A A . 2 CYS HA 1 1 6 2365 1 1 2 CYS HB2 H 6.801 7.999 5.425 1.00 . A A . 2 CYS HB2 1 1 6 2366 1 1 2 CYS HB3 H 7.339 8.280 3.771 1.00 . A A . 2 CYS HB3 1 1 6 2367 1 1 2 CYS N N 8.444 6.106 4.493 1.00 . A A . 2 CYS N 1 1 6 2368 1 1 2 CYS O O 7.335 6.013 1.876 1.00 . A A . 2 CYS O 1 1 6 2369 1 1 2 CYS SG S 4.961 8.040 3.897 1.00 . A A . 2 CYS SG 1 1 6 2370 1 1 3 GLY C C 4.287 5.546 0.630 1.00 . A A . 3 GLY C 1 1 6 2371 1 1 3 GLY CA C 5.146 4.495 1.342 1.00 . A A . 3 GLY CA 1 1 6 2372 1 1 3 GLY H H 4.998 4.793 3.471 1.00 . A A . 3 GLY H 1 1 6 2373 1 1 3 GLY HA2 H 6.030 4.293 0.754 1.00 . A A . 3 GLY HA2 1 1 6 2374 1 1 3 GLY HA3 H 4.576 3.587 1.457 1.00 . A A . 3 GLY HA3 1 1 6 2375 1 1 3 GLY N N 5.549 5.003 2.687 1.00 . A A . 3 GLY N 1 1 6 2376 1 1 3 GLY O O 4.716 6.664 0.410 1.00 . A A . 3 GLY O 1 1 6 2377 1 1 4 GLY C C 1.065 5.423 -1.157 1.00 . A A . 4 GLY C 1 1 6 2378 1 1 4 GLY CA C 2.183 6.171 -0.426 1.00 . A A . 4 GLY CA 1 1 6 2379 1 1 4 GLY H H 2.753 4.289 0.460 1.00 . A A . 4 GLY H 1 1 6 2380 1 1 4 GLY HA2 H 1.752 6.844 0.301 1.00 . A A . 4 GLY HA2 1 1 6 2381 1 1 4 GLY HA3 H 2.759 6.738 -1.142 1.00 . A A . 4 GLY HA3 1 1 6 2382 1 1 4 GLY N N 3.076 5.195 0.271 1.00 . A A . 4 GLY N 1 1 6 2383 1 1 4 GLY O O 0.712 4.315 -0.800 1.00 . A A . 4 GLY O 1 1 6 2384 1 1 5 LEU C C -0.027 4.511 -4.099 1.00 . A A . 5 LEU C 1 1 6 2385 1 1 5 LEU CA C -0.593 5.350 -2.941 1.00 . A A . 5 LEU CA 1 1 6 2386 1 1 5 LEU CB C -1.469 6.489 -3.471 1.00 . A A . 5 LEU CB 1 1 6 2387 1 1 5 LEU CD1 C -3.493 7.796 -2.802 1.00 . A A . 5 LEU CD1 1 1 6 2388 1 1 5 LEU CD2 C -3.731 5.438 -3.597 1.00 . A A . 5 LEU CD2 1 1 6 2389 1 1 5 LEU CG C -2.847 6.411 -2.813 1.00 . A A . 5 LEU CG 1 1 6 2390 1 1 5 LEU H H 0.809 6.916 -2.446 1.00 . A A . 5 LEU H 1 1 6 2391 1 1 5 LEU HA H -1.172 4.725 -2.281 1.00 . A A . 5 LEU HA 1 1 6 2392 1 1 5 LEU HB2 H -1.008 7.438 -3.237 1.00 . A A . 5 LEU HB2 1 1 6 2393 1 1 5 LEU HB3 H -1.577 6.394 -4.542 1.00 . A A . 5 LEU HB3 1 1 6 2394 1 1 5 LEU HD11 H -4.204 7.856 -1.991 1.00 . A A . 5 LEU HD11 1 1 6 2395 1 1 5 LEU HD12 H -4.001 7.965 -3.740 1.00 . A A . 5 LEU HD12 1 1 6 2396 1 1 5 LEU HD13 H -2.729 8.549 -2.666 1.00 . A A . 5 LEU HD13 1 1 6 2397 1 1 5 LEU HD21 H -4.665 5.297 -3.073 1.00 . A A . 5 LEU HD21 1 1 6 2398 1 1 5 LEU HD22 H -3.224 4.488 -3.690 1.00 . A A . 5 LEU HD22 1 1 6 2399 1 1 5 LEU HD23 H -3.926 5.840 -4.580 1.00 . A A . 5 LEU HD23 1 1 6 2400 1 1 5 LEU HG H -2.739 6.060 -1.796 1.00 . A A . 5 LEU HG 1 1 6 2401 1 1 5 LEU N N 0.505 6.023 -2.179 1.00 . A A . 5 LEU N 1 1 6 2402 1 1 5 LEU O O -0.744 3.762 -4.735 1.00 . A A . 5 LEU O 1 1 6 2403 1 1 6 MET C C 3.314 3.450 -5.091 1.00 . A A . 6 MET C 1 1 6 2404 1 1 6 MET CA C 1.870 3.815 -5.465 1.00 . A A . 6 MET CA 1 1 6 2405 1 1 6 MET CB C 1.842 4.727 -6.696 1.00 . A A . 6 MET CB 1 1 6 2406 1 1 6 MET CE C 2.775 2.934 -10.288 1.00 . A A . 6 MET CE 1 1 6 2407 1 1 6 MET CG C 1.733 3.873 -7.963 1.00 . A A . 6 MET CG 1 1 6 2408 1 1 6 MET H H 1.814 5.216 -3.833 1.00 . A A . 6 MET H 1 1 6 2409 1 1 6 MET HA H 1.293 2.924 -5.651 1.00 . A A . 6 MET HA 1 1 6 2410 1 1 6 MET HB2 H 0.992 5.389 -6.634 1.00 . A A . 6 MET HB2 1 1 6 2411 1 1 6 MET HB3 H 2.750 5.308 -6.734 1.00 . A A . 6 MET HB3 1 1 6 2412 1 1 6 MET HE1 H 2.950 3.414 -11.241 1.00 . A A . 6 MET HE1 1 1 6 2413 1 1 6 MET HE2 H 1.730 2.681 -10.202 1.00 . A A . 6 MET HE2 1 1 6 2414 1 1 6 MET HE3 H 3.368 2.034 -10.217 1.00 . A A . 6 MET HE3 1 1 6 2415 1 1 6 MET HG2 H 1.614 2.835 -7.690 1.00 . A A . 6 MET HG2 1 1 6 2416 1 1 6 MET HG3 H 0.878 4.194 -8.539 1.00 . A A . 6 MET HG3 1 1 6 2417 1 1 6 MET N N 1.253 4.617 -4.365 1.00 . A A . 6 MET N 1 1 6 2418 1 1 6 MET O O 4.175 3.331 -5.944 1.00 . A A . 6 MET O 1 1 6 2419 1 1 6 MET SD S 3.236 4.066 -8.954 1.00 . A A . 6 MET SD 1 1 6 2420 1 1 7 ALA C C 5.159 1.399 -3.389 1.00 . A A . 7 ALA C 1 1 6 2421 1 1 7 ALA CA C 4.966 2.919 -3.380 1.00 . A A . 7 ALA CA 1 1 6 2422 1 1 7 ALA CB C 5.086 3.468 -1.957 1.00 . A A . 7 ALA CB 1 1 6 2423 1 1 7 ALA H H 2.869 3.373 -3.151 1.00 . A A . 7 ALA H 1 1 6 2424 1 1 7 ALA HA H 5.695 3.392 -4.018 1.00 . A A . 7 ALA HA 1 1 6 2425 1 1 7 ALA HB1 H 4.364 2.980 -1.320 1.00 . A A . 7 ALA HB1 1 1 6 2426 1 1 7 ALA HB2 H 4.897 4.532 -1.966 1.00 . A A . 7 ALA HB2 1 1 6 2427 1 1 7 ALA HB3 H 6.081 3.283 -1.582 1.00 . A A . 7 ALA HB3 1 1 6 2428 1 1 7 ALA N N 3.581 3.272 -3.819 1.00 . A A . 7 ALA N 1 1 6 2429 1 1 7 ALA O O 4.463 0.673 -2.707 1.00 . A A . 7 ALA O 1 1 6 2430 1 1 8 GLY C C 6.691 -1.085 -2.832 1.00 . A A . 8 GLY C 1 1 6 2431 1 1 8 GLY CA C 6.353 -0.553 -4.229 1.00 . A A . 8 GLY CA 1 1 6 2432 1 1 8 GLY H H 6.644 1.529 -4.698 1.00 . A A . 8 GLY H 1 1 6 2433 1 1 8 GLY HA2 H 5.470 -1.052 -4.602 1.00 . A A . 8 GLY HA2 1 1 6 2434 1 1 8 GLY HA3 H 7.182 -0.746 -4.893 1.00 . A A . 8 GLY HA3 1 1 6 2435 1 1 8 GLY N N 6.101 0.918 -4.161 1.00 . A A . 8 GLY N 1 1 6 2436 1 1 8 GLY O O 7.733 -0.783 -2.281 1.00 . A A . 8 GLY O 1 1 6 2437 1 1 9 CYS C C 6.928 -3.696 -0.973 1.00 . A A . 9 CYS C 1 1 6 2438 1 1 9 CYS CA C 6.078 -2.420 -0.890 1.00 . A A . 9 CYS CA 1 1 6 2439 1 1 9 CYS CB C 4.690 -2.711 -0.303 1.00 . A A . 9 CYS CB 1 1 6 2440 1 1 9 CYS H H 4.981 -2.095 -2.721 1.00 . A A . 9 CYS H 1 1 6 2441 1 1 9 CYS HA H 6.579 -1.682 -0.286 1.00 . A A . 9 CYS HA 1 1 6 2442 1 1 9 CYS HB2 H 4.764 -2.774 0.768 1.00 . A A . 9 CYS HB2 1 1 6 2443 1 1 9 CYS HB3 H 4.015 -1.909 -0.567 1.00 . A A . 9 CYS HB3 1 1 6 2444 1 1 9 CYS N N 5.814 -1.870 -2.256 1.00 . A A . 9 CYS N 1 1 6 2445 1 1 9 CYS O O 7.771 -3.940 -0.130 1.00 . A A . 9 CYS O 1 1 6 2446 1 1 9 CYS SG S 4.047 -4.276 -0.955 1.00 . A A . 9 CYS SG 1 1 6 2447 1 1 10 ASP C C 7.424 -6.643 -0.897 1.00 . A A . 10 ASP C 1 1 6 2448 1 1 10 ASP CA C 7.502 -5.767 -2.160 1.00 . A A . 10 ASP CA 1 1 6 2449 1 1 10 ASP CB C 8.941 -5.312 -2.427 1.00 . A A . 10 ASP CB 1 1 6 2450 1 1 10 ASP CG C 9.739 -6.466 -3.041 1.00 . A A . 10 ASP CG 1 1 6 2451 1 1 10 ASP H H 6.032 -4.270 -2.651 1.00 . A A . 10 ASP H 1 1 6 2452 1 1 10 ASP HA H 7.133 -6.317 -3.011 1.00 . A A . 10 ASP HA 1 1 6 2453 1 1 10 ASP HB2 H 8.934 -4.474 -3.109 1.00 . A A . 10 ASP HB2 1 1 6 2454 1 1 10 ASP HB3 H 9.403 -5.014 -1.497 1.00 . A A . 10 ASP HB3 1 1 6 2455 1 1 10 ASP N N 6.715 -4.503 -1.990 1.00 . A A . 10 ASP N 1 1 6 2456 1 1 10 ASP O O 8.395 -6.802 -0.179 1.00 . A A . 10 ASP O 1 1 6 2457 1 1 10 ASP OD1 O 9.577 -6.706 -4.227 1.00 . A A . 10 ASP OD1 1 1 6 2458 1 1 10 ASP OD2 O 10.496 -7.089 -2.315 1.00 . A A . 10 ASP OD2 1 1 6 2459 1 1 11 GLY C C 4.848 -7.709 1.324 1.00 . A A . 11 GLY C 1 1 6 2460 1 1 11 GLY CA C 6.128 -8.083 0.575 1.00 . A A . 11 GLY CA 1 1 6 2461 1 1 11 GLY H H 5.509 -7.075 -1.219 1.00 . A A . 11 GLY H 1 1 6 2462 1 1 11 GLY HA2 H 6.077 -9.118 0.265 1.00 . A A . 11 GLY HA2 1 1 6 2463 1 1 11 GLY HA3 H 6.975 -7.944 1.229 1.00 . A A . 11 GLY HA3 1 1 6 2464 1 1 11 GLY N N 6.275 -7.215 -0.627 1.00 . A A . 11 GLY N 1 1 6 2465 1 1 11 GLY O O 4.570 -6.546 1.552 1.00 . A A . 11 GLY O 1 1 6 2466 1 1 12 LYS C C 3.113 -7.919 3.896 1.00 . A A . 12 LYS C 1 1 6 2467 1 1 12 LYS CA C 2.805 -8.397 2.464 1.00 . A A . 12 LYS CA 1 1 6 2468 1 1 12 LYS CB C 2.031 -9.722 2.488 1.00 . A A . 12 LYS CB 1 1 6 2469 1 1 12 LYS CD C 2.611 -12.141 2.798 1.00 . A A . 12 LYS CD 1 1 6 2470 1 1 12 LYS CE C 3.566 -12.298 1.608 1.00 . A A . 12 LYS CE 1 1 6 2471 1 1 12 LYS CG C 2.747 -10.735 3.391 1.00 . A A . 12 LYS CG 1 1 6 2472 1 1 12 LYS H H 4.324 -9.618 1.526 1.00 . A A . 12 LYS H 1 1 6 2473 1 1 12 LYS HA H 2.231 -7.651 1.939 1.00 . A A . 12 LYS HA 1 1 6 2474 1 1 12 LYS HB2 H 1.035 -9.546 2.866 1.00 . A A . 12 LYS HB2 1 1 6 2475 1 1 12 LYS HB3 H 1.969 -10.119 1.486 1.00 . A A . 12 LYS HB3 1 1 6 2476 1 1 12 LYS HD2 H 2.852 -12.874 3.554 1.00 . A A . 12 LYS HD2 1 1 6 2477 1 1 12 LYS HD3 H 1.594 -12.292 2.463 1.00 . A A . 12 LYS HD3 1 1 6 2478 1 1 12 LYS HE2 H 3.273 -13.146 1.003 1.00 . A A . 12 LYS HE2 1 1 6 2479 1 1 12 LYS HE3 H 3.576 -11.398 1.013 1.00 . A A . 12 LYS HE3 1 1 6 2480 1 1 12 LYS HG2 H 3.793 -10.476 3.468 1.00 . A A . 12 LYS HG2 1 1 6 2481 1 1 12 LYS HG3 H 2.299 -10.717 4.374 1.00 . A A . 12 LYS HG3 1 1 6 2482 1 1 12 LYS HZ1 H 4.852 -13.281 2.923 1.00 . A A . 12 LYS HZ1 1 1 6 2483 1 1 12 LYS HZ2 H 5.248 -11.649 2.655 1.00 . A A . 12 LYS HZ2 1 1 6 2484 1 1 12 LYS HZ3 H 5.579 -12.814 1.463 1.00 . A A . 12 LYS HZ3 1 1 6 2485 1 1 12 LYS N N 4.072 -8.689 1.717 1.00 . A A . 12 LYS N 1 1 6 2486 1 1 12 LYS NZ N 4.912 -12.528 2.208 1.00 . A A . 12 LYS NZ 1 1 6 2487 1 1 12 LYS O O 2.225 -7.507 4.617 1.00 . A A . 12 LYS O 1 1 6 2488 1 1 13 SER C C 5.437 -6.144 5.614 1.00 . A A . 13 SER C 1 1 6 2489 1 1 13 SER CA C 4.723 -7.502 5.681 1.00 . A A . 13 SER CA 1 1 6 2490 1 1 13 SER CB C 5.659 -8.582 6.230 1.00 . A A . 13 SER CB 1 1 6 2491 1 1 13 SER H H 5.063 -8.288 3.703 1.00 . A A . 13 SER H 1 1 6 2492 1 1 13 SER HA H 3.840 -7.432 6.299 1.00 . A A . 13 SER HA 1 1 6 2493 1 1 13 SER HB2 H 6.505 -8.697 5.572 1.00 . A A . 13 SER HB2 1 1 6 2494 1 1 13 SER HB3 H 6.007 -8.289 7.213 1.00 . A A . 13 SER HB3 1 1 6 2495 1 1 13 SER HG H 5.205 -10.348 5.549 1.00 . A A . 13 SER HG 1 1 6 2496 1 1 13 SER N N 4.362 -7.962 4.304 1.00 . A A . 13 SER N 1 1 6 2497 1 1 13 SER O O 6.257 -5.820 6.452 1.00 . A A . 13 SER O 1 1 6 2498 1 1 13 SER OG O 4.959 -9.817 6.310 1.00 . A A . 13 SER OG 1 1 6 2499 1 1 14 THR C C 5.149 -3.004 5.458 1.00 . A A . 14 THR C 1 1 6 2500 1 1 14 THR CA C 5.775 -4.009 4.479 1.00 . A A . 14 THR CA 1 1 6 2501 1 1 14 THR CB C 5.508 -3.594 3.024 1.00 . A A . 14 THR CB 1 1 6 2502 1 1 14 THR CG2 C 4.004 -3.372 2.812 1.00 . A A . 14 THR CG2 1 1 6 2503 1 1 14 THR H H 4.459 -5.638 3.958 1.00 . A A . 14 THR H 1 1 6 2504 1 1 14 THR HA H 6.836 -4.088 4.649 1.00 . A A . 14 THR HA 1 1 6 2505 1 1 14 THR HB H 5.845 -4.377 2.362 1.00 . A A . 14 THR HB 1 1 6 2506 1 1 14 THR HG1 H 5.729 -1.655 3.097 1.00 . A A . 14 THR HG1 1 1 6 2507 1 1 14 THR HG21 H 3.460 -3.741 3.669 1.00 . A A . 14 THR HG21 1 1 6 2508 1 1 14 THR HG22 H 3.685 -3.903 1.927 1.00 . A A . 14 THR HG22 1 1 6 2509 1 1 14 THR HG23 H 3.809 -2.318 2.689 1.00 . A A . 14 THR HG23 1 1 6 2510 1 1 14 THR N N 5.124 -5.350 4.618 1.00 . A A . 14 THR N 1 1 6 2511 1 1 14 THR O O 4.068 -3.216 5.975 1.00 . A A . 14 THR O 1 1 6 2512 1 1 14 THR OG1 O 6.220 -2.395 2.730 1.00 . A A . 14 THR OG1 1 1 6 2513 1 1 15 PHE C C 5.237 0.488 5.961 1.00 . A A . 15 PHE C 1 1 6 2514 1 1 15 PHE CA C 5.279 -0.882 6.648 1.00 . A A . 15 PHE CA 1 1 6 2515 1 1 15 PHE CB C 6.253 -0.871 7.831 1.00 . A A . 15 PHE CB 1 1 6 2516 1 1 15 PHE CD1 C 4.697 -1.963 9.491 1.00 . A A . 15 PHE CD1 1 1 6 2517 1 1 15 PHE CD2 C 5.545 0.259 9.970 1.00 . A A . 15 PHE CD2 1 1 6 2518 1 1 15 PHE CE1 C 3.982 -1.949 10.694 1.00 . A A . 15 PHE CE1 1 1 6 2519 1 1 15 PHE CE2 C 4.829 0.272 11.174 1.00 . A A . 15 PHE CE2 1 1 6 2520 1 1 15 PHE CG C 5.478 -0.859 9.128 1.00 . A A . 15 PHE CG 1 1 6 2521 1 1 15 PHE CZ C 4.048 -0.833 11.535 1.00 . A A . 15 PHE CZ 1 1 6 2522 1 1 15 PHE H H 6.691 -1.761 5.277 1.00 . A A . 15 PHE H 1 1 6 2523 1 1 15 PHE HA H 4.294 -1.163 6.986 1.00 . A A . 15 PHE HA 1 1 6 2524 1 1 15 PHE HB2 H 6.874 -1.754 7.794 1.00 . A A . 15 PHE HB2 1 1 6 2525 1 1 15 PHE HB3 H 6.877 0.008 7.777 1.00 . A A . 15 PHE HB3 1 1 6 2526 1 1 15 PHE HD1 H 4.645 -2.825 8.842 1.00 . A A . 15 PHE HD1 1 1 6 2527 1 1 15 PHE HD2 H 6.147 1.111 9.691 1.00 . A A . 15 PHE HD2 1 1 6 2528 1 1 15 PHE HE1 H 3.378 -2.800 10.972 1.00 . A A . 15 PHE HE1 1 1 6 2529 1 1 15 PHE HE2 H 4.880 1.133 11.823 1.00 . A A . 15 PHE HE2 1 1 6 2530 1 1 15 PHE HZ H 3.496 -0.823 12.463 1.00 . A A . 15 PHE HZ 1 1 6 2531 1 1 15 PHE N N 5.824 -1.909 5.709 1.00 . A A . 15 PHE N 1 1 6 2532 1 1 15 PHE O O 6.234 1.179 5.866 1.00 . A A . 15 PHE O 1 1 6 2533 1 1 16 CYS C C 3.853 3.342 5.809 1.00 . A A . 16 CYS C 1 1 6 2534 1 1 16 CYS CA C 3.973 2.205 4.781 1.00 . A A . 16 CYS CA 1 1 6 2535 1 1 16 CYS CB C 2.712 2.086 3.919 1.00 . A A . 16 CYS CB 1 1 6 2536 1 1 16 CYS H H 3.298 0.304 5.557 1.00 . A A . 16 CYS H 1 1 6 2537 1 1 16 CYS HA H 4.832 2.366 4.148 1.00 . A A . 16 CYS HA 1 1 6 2538 1 1 16 CYS HB2 H 1.894 1.718 4.522 1.00 . A A . 16 CYS HB2 1 1 6 2539 1 1 16 CYS HB3 H 2.456 3.053 3.513 1.00 . A A . 16 CYS HB3 1 1 6 2540 1 1 16 CYS N N 4.087 0.882 5.473 1.00 . A A . 16 CYS N 1 1 6 2541 1 1 16 CYS O O 4.266 3.203 6.946 1.00 . A A . 16 CYS O 1 1 6 2542 1 1 16 CYS SG S 3.033 0.930 2.562 1.00 . A A . 16 CYS SG 1 1 6 2543 1 1 17 CYS C C 2.123 5.304 7.443 1.00 . A A . 17 CYS C 1 1 6 2544 1 1 17 CYS CA C 3.176 5.617 6.372 1.00 . A A . 17 CYS CA 1 1 6 2545 1 1 17 CYS CB C 2.738 6.809 5.512 1.00 . A A . 17 CYS CB 1 1 6 2546 1 1 17 CYS H H 2.987 4.564 4.497 1.00 . A A . 17 CYS H 1 1 6 2547 1 1 17 CYS HA H 4.124 5.827 6.835 1.00 . A A . 17 CYS HA 1 1 6 2548 1 1 17 CYS HB2 H 2.657 6.499 4.481 1.00 . A A . 17 CYS HB2 1 1 6 2549 1 1 17 CYS HB3 H 1.779 7.170 5.854 1.00 . A A . 17 CYS HB3 1 1 6 2550 1 1 17 CYS N N 3.305 4.470 5.419 1.00 . A A . 17 CYS N 1 1 6 2551 1 1 17 CYS O O 2.448 4.944 8.558 1.00 . A A . 17 CYS O 1 1 6 2552 1 1 17 CYS SG S 3.958 8.134 5.645 1.00 . A A . 17 CYS SG 1 1 6 2553 1 1 18 SER C C -1.557 5.042 7.350 1.00 . A A . 18 SER C 1 1 6 2554 1 1 18 SER CA C -0.221 5.156 8.086 1.00 . A A . 18 SER CA 1 1 6 2555 1 1 18 SER CB C -0.232 6.344 9.054 1.00 . A A . 18 SER CB 1 1 6 2556 1 1 18 SER H H 0.640 5.733 6.198 1.00 . A A . 18 SER H 1 1 6 2557 1 1 18 SER HA H -0.010 4.243 8.624 1.00 . A A . 18 SER HA 1 1 6 2558 1 1 18 SER HB2 H -1.111 6.294 9.673 1.00 . A A . 18 SER HB2 1 1 6 2559 1 1 18 SER HB3 H 0.647 6.299 9.683 1.00 . A A . 18 SER HB3 1 1 6 2560 1 1 18 SER HG H 0.595 8.007 8.467 1.00 . A A . 18 SER HG 1 1 6 2561 1 1 18 SER N N 0.869 5.441 7.105 1.00 . A A . 18 SER N 1 1 6 2562 1 1 18 SER O O -2.043 5.997 6.771 1.00 . A A . 18 SER O 1 1 6 2563 1 1 18 SER OG O -0.245 7.564 8.321 1.00 . A A . 18 SER OG 1 1 6 2564 1 1 19 GLY C C -3.190 3.362 5.174 1.00 . A A . 19 GLY C 1 1 6 2565 1 1 19 GLY CA C -3.446 3.682 6.653 1.00 . A A . 19 GLY CA 1 1 6 2566 1 1 19 GLY H H -1.729 3.121 7.826 1.00 . A A . 19 GLY H 1 1 6 2567 1 1 19 GLY HA2 H -3.984 2.864 7.111 1.00 . A A . 19 GLY HA2 1 1 6 2568 1 1 19 GLY HA3 H -4.034 4.584 6.727 1.00 . A A . 19 GLY HA3 1 1 6 2569 1 1 19 GLY N N -2.147 3.875 7.359 1.00 . A A . 19 GLY N 1 1 6 2570 1 1 19 GLY O O -3.985 3.696 4.318 1.00 . A A . 19 GLY O 1 1 6 2571 1 1 20 TYR C C -1.425 0.879 3.345 1.00 . A A . 20 TYR C 1 1 6 2572 1 1 20 TYR CA C -1.781 2.369 3.447 1.00 . A A . 20 TYR CA 1 1 6 2573 1 1 20 TYR CB C -0.580 3.242 3.069 1.00 . A A . 20 TYR CB 1 1 6 2574 1 1 20 TYR CD1 C -1.193 5.609 3.703 1.00 . A A . 20 TYR CD1 1 1 6 2575 1 1 20 TYR CD2 C -1.363 4.940 1.379 1.00 . A A . 20 TYR CD2 1 1 6 2576 1 1 20 TYR CE1 C -1.637 6.893 3.366 1.00 . A A . 20 TYR CE1 1 1 6 2577 1 1 20 TYR CE2 C -1.806 6.225 1.042 1.00 . A A . 20 TYR CE2 1 1 6 2578 1 1 20 TYR CG C -1.057 4.632 2.708 1.00 . A A . 20 TYR CG 1 1 6 2579 1 1 20 TYR CZ C -1.943 7.201 2.036 1.00 . A A . 20 TYR CZ 1 1 6 2580 1 1 20 TYR H H -1.458 2.458 5.576 1.00 . A A . 20 TYR H 1 1 6 2581 1 1 20 TYR HA H -2.622 2.602 2.812 1.00 . A A . 20 TYR HA 1 1 6 2582 1 1 20 TYR HB2 H 0.103 3.299 3.902 1.00 . A A . 20 TYR HB2 1 1 6 2583 1 1 20 TYR HB3 H -0.073 2.807 2.219 1.00 . A A . 20 TYR HB3 1 1 6 2584 1 1 20 TYR HD1 H -0.955 5.371 4.728 1.00 . A A . 20 TYR HD1 1 1 6 2585 1 1 20 TYR HD2 H -1.258 4.188 0.612 1.00 . A A . 20 TYR HD2 1 1 6 2586 1 1 20 TYR HE1 H -1.742 7.647 4.132 1.00 . A A . 20 TYR HE1 1 1 6 2587 1 1 20 TYR HE2 H -2.043 6.461 0.015 1.00 . A A . 20 TYR HE2 1 1 6 2588 1 1 20 TYR HH H -3.327 8.419 1.535 1.00 . A A . 20 TYR HH 1 1 6 2589 1 1 20 TYR N N -2.087 2.717 4.869 1.00 . A A . 20 TYR N 1 1 6 2590 1 1 20 TYR O O -0.464 0.422 3.935 1.00 . A A . 20 TYR O 1 1 6 2591 1 1 20 TYR OH O -2.382 8.466 1.703 1.00 . A A . 20 TYR OH 1 1 6 2592 1 1 21 ASN C C -1.390 -1.658 1.065 1.00 . A A . 21 ASN C 1 1 6 2593 1 1 21 ASN CA C -1.910 -1.344 2.470 1.00 . A A . 21 ASN CA 1 1 6 2594 1 1 21 ASN CB C -3.250 -2.042 2.714 1.00 . A A . 21 ASN CB 1 1 6 2595 1 1 21 ASN CG C -2.998 -3.508 3.076 1.00 . A A . 21 ASN CG 1 1 6 2596 1 1 21 ASN H H -2.968 0.511 2.144 1.00 . A A . 21 ASN H 1 1 6 2597 1 1 21 ASN HA H -1.193 -1.654 3.211 1.00 . A A . 21 ASN HA 1 1 6 2598 1 1 21 ASN HB2 H -3.769 -1.553 3.524 1.00 . A A . 21 ASN HB2 1 1 6 2599 1 1 21 ASN HB3 H -3.850 -1.994 1.817 1.00 . A A . 21 ASN HB3 1 1 6 2600 1 1 21 ASN HD21 H -3.433 -4.185 1.260 1.00 . A A . 21 ASN HD21 1 1 6 2601 1 1 21 ASN HD22 H -2.998 -5.373 2.392 1.00 . A A . 21 ASN HD22 1 1 6 2602 1 1 21 ASN N N -2.197 0.120 2.606 1.00 . A A . 21 ASN N 1 1 6 2603 1 1 21 ASN ND2 N -3.156 -4.433 2.167 1.00 . A A . 21 ASN ND2 1 1 6 2604 1 1 21 ASN O O -1.640 -0.930 0.129 1.00 . A A . 21 ASN O 1 1 6 2605 1 1 21 ASN OD1 O -2.651 -3.815 4.200 1.00 . A A . 21 ASN OD1 1 1 6 2606 1 1 22 CYS C C -1.141 -3.965 -1.203 1.00 . A A . 22 CYS C 1 1 6 2607 1 1 22 CYS CA C -0.136 -3.095 -0.440 1.00 . A A . 22 CYS CA 1 1 6 2608 1 1 22 CYS CB C 1.155 -3.873 -0.172 1.00 . A A . 22 CYS CB 1 1 6 2609 1 1 22 CYS H H -0.482 -3.318 1.680 1.00 . A A . 22 CYS H 1 1 6 2610 1 1 22 CYS HA H 0.086 -2.202 -1.001 1.00 . A A . 22 CYS HA 1 1 6 2611 1 1 22 CYS HB2 H 1.678 -3.427 0.662 1.00 . A A . 22 CYS HB2 1 1 6 2612 1 1 22 CYS HB3 H 0.916 -4.900 0.060 1.00 . A A . 22 CYS HB3 1 1 6 2613 1 1 22 CYS N N -0.670 -2.740 0.911 1.00 . A A . 22 CYS N 1 1 6 2614 1 1 22 CYS O O -1.699 -4.903 -0.664 1.00 . A A . 22 CYS O 1 1 6 2615 1 1 22 CYS SG S 2.207 -3.813 -1.644 1.00 . A A . 22 CYS SG 1 1 6 2616 1 1 23 SER C C -1.673 -5.740 -3.776 1.00 . A A . 23 SER C 1 1 6 2617 1 1 23 SER CA C -2.340 -4.456 -3.265 1.00 . A A . 23 SER CA 1 1 6 2618 1 1 23 SER CB C -2.727 -3.556 -4.438 1.00 . A A . 23 SER CB 1 1 6 2619 1 1 23 SER H H -0.907 -2.893 -2.863 1.00 . A A . 23 SER H 1 1 6 2620 1 1 23 SER HA H -3.214 -4.691 -2.679 1.00 . A A . 23 SER HA 1 1 6 2621 1 1 23 SER HB2 H -2.951 -2.566 -4.078 1.00 . A A . 23 SER HB2 1 1 6 2622 1 1 23 SER HB3 H -1.902 -3.505 -5.136 1.00 . A A . 23 SER HB3 1 1 6 2623 1 1 23 SER HG H -4.650 -3.644 -4.729 1.00 . A A . 23 SER HG 1 1 6 2624 1 1 23 SER N N -1.372 -3.654 -2.455 1.00 . A A . 23 SER N 1 1 6 2625 1 1 23 SER O O -0.515 -5.730 -4.146 1.00 . A A . 23 SER O 1 1 6 2626 1 1 23 SER OG O -3.877 -4.091 -5.082 1.00 . A A . 23 SER OG 1 1 6 2627 1 1 24 PRO C C -1.761 -8.122 -5.795 1.00 . A A . 24 PRO C 1 1 6 2628 1 1 24 PRO CA C -1.913 -8.115 -4.263 1.00 . A A . 24 PRO CA 1 1 6 2629 1 1 24 PRO CB C -2.980 -9.113 -3.814 1.00 . A A . 24 PRO CB 1 1 6 2630 1 1 24 PRO CD C -3.838 -6.901 -3.353 1.00 . A A . 24 PRO CD 1 1 6 2631 1 1 24 PRO CG C -4.238 -8.312 -3.694 1.00 . A A . 24 PRO CG 1 1 6 2632 1 1 24 PRO HA H -0.974 -8.344 -3.787 1.00 . A A . 24 PRO HA 1 1 6 2633 1 1 24 PRO HB2 H -3.097 -9.894 -4.552 1.00 . A A . 24 PRO HB2 1 1 6 2634 1 1 24 PRO HB3 H -2.721 -9.535 -2.855 1.00 . A A . 24 PRO HB3 1 1 6 2635 1 1 24 PRO HD2 H -4.452 -6.194 -3.894 1.00 . A A . 24 PRO HD2 1 1 6 2636 1 1 24 PRO HD3 H -3.910 -6.734 -2.289 1.00 . A A . 24 PRO HD3 1 1 6 2637 1 1 24 PRO HG2 H -4.775 -8.329 -4.633 1.00 . A A . 24 PRO HG2 1 1 6 2638 1 1 24 PRO HG3 H -4.858 -8.714 -2.908 1.00 . A A . 24 PRO HG3 1 1 6 2639 1 1 24 PRO N N -2.436 -6.809 -3.784 1.00 . A A . 24 PRO N 1 1 6 2640 1 1 24 PRO O O -1.051 -8.944 -6.344 1.00 . A A . 24 PRO O 1 1 6 2641 1 1 25 THR C C -1.439 -6.004 -8.443 1.00 . A A . 25 THR C 1 1 6 2642 1 1 25 THR CA C -2.306 -7.186 -7.982 1.00 . A A . 25 THR CA 1 1 6 2643 1 1 25 THR CB C -3.743 -7.024 -8.497 1.00 . A A . 25 THR CB 1 1 6 2644 1 1 25 THR CG2 C -3.783 -7.301 -10.003 1.00 . A A . 25 THR CG2 1 1 6 2645 1 1 25 THR H H -2.988 -6.567 -6.030 1.00 . A A . 25 THR H 1 1 6 2646 1 1 25 THR HA H -1.892 -8.111 -8.344 1.00 . A A . 25 THR HA 1 1 6 2647 1 1 25 THR HB H -4.080 -6.017 -8.313 1.00 . A A . 25 THR HB 1 1 6 2648 1 1 25 THR HG1 H -5.387 -7.467 -7.555 1.00 . A A . 25 THR HG1 1 1 6 2649 1 1 25 THR HG21 H -4.750 -7.020 -10.394 1.00 . A A . 25 THR HG21 1 1 6 2650 1 1 25 THR HG22 H -3.614 -8.353 -10.181 1.00 . A A . 25 THR HG22 1 1 6 2651 1 1 25 THR HG23 H -3.014 -6.724 -10.496 1.00 . A A . 25 THR HG23 1 1 6 2652 1 1 25 THR N N -2.419 -7.219 -6.488 1.00 . A A . 25 THR N 1 1 6 2653 1 1 25 THR O O -0.851 -6.045 -9.509 1.00 . A A . 25 THR O 1 1 6 2654 1 1 25 THR OG1 O -4.598 -7.942 -7.826 1.00 . A A . 25 THR OG1 1 1 6 2655 1 1 26 TRP C C 0.883 -3.842 -7.471 1.00 . A A . 26 TRP C 1 1 6 2656 1 1 26 TRP CA C -0.531 -3.771 -8.077 1.00 . A A . 26 TRP CA 1 1 6 2657 1 1 26 TRP CB C -1.277 -2.539 -7.551 1.00 . A A . 26 TRP CB 1 1 6 2658 1 1 26 TRP CD1 C -3.163 -3.136 -9.148 1.00 . A A . 26 TRP CD1 1 1 6 2659 1 1 26 TRP CD2 C -3.859 -1.916 -7.392 1.00 . A A . 26 TRP CD2 1 1 6 2660 1 1 26 TRP CE2 C -5.001 -2.174 -8.185 1.00 . A A . 26 TRP CE2 1 1 6 2661 1 1 26 TRP CE3 C -4.026 -1.160 -6.218 1.00 . A A . 26 TRP CE3 1 1 6 2662 1 1 26 TRP CG C -2.703 -2.539 -8.021 1.00 . A A . 26 TRP CG 1 1 6 2663 1 1 26 TRP CH2 C -6.410 -0.950 -6.656 1.00 . A A . 26 TRP CH2 1 1 6 2664 1 1 26 TRP CZ2 C -6.263 -1.699 -7.826 1.00 . A A . 26 TRP CZ2 1 1 6 2665 1 1 26 TRP CZ3 C -5.293 -0.680 -5.853 1.00 . A A . 26 TRP CZ3 1 1 6 2666 1 1 26 TRP H H -1.842 -4.935 -6.812 1.00 . A A . 26 TRP H 1 1 6 2667 1 1 26 TRP HA H -0.469 -3.723 -9.152 1.00 . A A . 26 TRP HA 1 1 6 2668 1 1 26 TRP HB2 H -1.258 -2.541 -6.473 1.00 . A A . 26 TRP HB2 1 1 6 2669 1 1 26 TRP HB3 H -0.784 -1.651 -7.912 1.00 . A A . 26 TRP HB3 1 1 6 2670 1 1 26 TRP HD1 H -2.563 -3.690 -9.855 1.00 . A A . 26 TRP HD1 1 1 6 2671 1 1 26 TRP HE1 H -5.100 -3.250 -9.966 1.00 . A A . 26 TRP HE1 1 1 6 2672 1 1 26 TRP HE3 H -3.172 -0.948 -5.593 1.00 . A A . 26 TRP HE3 1 1 6 2673 1 1 26 TRP HH2 H -7.383 -0.578 -6.372 1.00 . A A . 26 TRP HH2 1 1 6 2674 1 1 26 TRP HZ2 H -7.120 -1.909 -8.449 1.00 . A A . 26 TRP HZ2 1 1 6 2675 1 1 26 TRP HZ3 H -5.410 -0.102 -4.949 1.00 . A A . 26 TRP HZ3 1 1 6 2676 1 1 26 TRP N N -1.358 -4.952 -7.662 1.00 . A A . 26 TRP N 1 1 6 2677 1 1 26 TRP NE1 N -4.525 -2.921 -9.244 1.00 . A A . 26 TRP NE1 1 1 6 2678 1 1 26 TRP O O 1.794 -3.192 -7.949 1.00 . A A . 26 TRP O 1 1 6 2679 1 1 27 LYS C C 2.896 -3.456 -5.124 1.00 . A A . 27 LYS C 1 1 6 2680 1 1 27 LYS CA C 2.421 -4.768 -5.784 1.00 . A A . 27 LYS CA 1 1 6 2681 1 1 27 LYS CB C 3.380 -5.186 -6.912 1.00 . A A . 27 LYS CB 1 1 6 2682 1 1 27 LYS CD C 4.949 -6.411 -5.376 1.00 . A A . 27 LYS CD 1 1 6 2683 1 1 27 LYS CE C 6.407 -6.557 -5.831 1.00 . A A . 27 LYS CE 1 1 6 2684 1 1 27 LYS CG C 4.010 -6.546 -6.582 1.00 . A A . 27 LYS CG 1 1 6 2685 1 1 27 LYS H H 0.316 -5.141 -6.073 1.00 . A A . 27 LYS H 1 1 6 2686 1 1 27 LYS HA H 2.386 -5.551 -5.043 1.00 . A A . 27 LYS HA 1 1 6 2687 1 1 27 LYS HB2 H 2.833 -5.262 -7.840 1.00 . A A . 27 LYS HB2 1 1 6 2688 1 1 27 LYS HB3 H 4.160 -4.447 -7.015 1.00 . A A . 27 LYS HB3 1 1 6 2689 1 1 27 LYS HD2 H 4.810 -5.444 -4.920 1.00 . A A . 27 LYS HD2 1 1 6 2690 1 1 27 LYS HD3 H 4.720 -7.183 -4.656 1.00 . A A . 27 LYS HD3 1 1 6 2691 1 1 27 LYS HE2 H 6.465 -6.556 -6.910 1.00 . A A . 27 LYS HE2 1 1 6 2692 1 1 27 LYS HE3 H 7.009 -5.761 -5.421 1.00 . A A . 27 LYS HE3 1 1 6 2693 1 1 27 LYS HG2 H 3.229 -7.257 -6.352 1.00 . A A . 27 LYS HG2 1 1 6 2694 1 1 27 LYS HG3 H 4.573 -6.897 -7.434 1.00 . A A . 27 LYS HG3 1 1 6 2695 1 1 27 LYS HZ1 H 7.873 -7.994 -5.477 1.00 . A A . 27 LYS HZ1 1 1 6 2696 1 1 27 LYS HZ2 H 6.324 -8.638 -5.741 1.00 . A A . 27 LYS HZ2 1 1 6 2697 1 1 27 LYS HZ3 H 6.697 -7.896 -4.258 1.00 . A A . 27 LYS HZ3 1 1 6 2698 1 1 27 LYS N N 1.070 -4.629 -6.432 1.00 . A A . 27 LYS N 1 1 6 2699 1 1 27 LYS NZ N 6.859 -7.870 -5.286 1.00 . A A . 27 LYS NZ 1 1 6 2700 1 1 27 LYS O O 4.042 -3.348 -4.728 1.00 . A A . 27 LYS O 1 1 6 2701 1 1 28 TRP C C 1.492 -0.822 -3.188 1.00 . A A . 28 TRP C 1 1 6 2702 1 1 28 TRP CA C 2.475 -1.204 -4.301 1.00 . A A . 28 TRP CA 1 1 6 2703 1 1 28 TRP CB C 2.554 -0.122 -5.400 1.00 . A A . 28 TRP CB 1 1 6 2704 1 1 28 TRP CD1 C 0.112 0.580 -5.271 1.00 . A A . 28 TRP CD1 1 1 6 2705 1 1 28 TRP CD2 C 0.804 0.221 -7.380 1.00 . A A . 28 TRP CD2 1 1 6 2706 1 1 28 TRP CE2 C -0.557 0.599 -7.457 1.00 . A A . 28 TRP CE2 1 1 6 2707 1 1 28 TRP CE3 C 1.482 -0.061 -8.578 1.00 . A A . 28 TRP CE3 1 1 6 2708 1 1 28 TRP CG C 1.204 0.203 -5.978 1.00 . A A . 28 TRP CG 1 1 6 2709 1 1 28 TRP CH2 C -0.532 0.413 -9.862 1.00 . A A . 28 TRP CH2 1 1 6 2710 1 1 28 TRP CZ2 C -1.221 0.696 -8.680 1.00 . A A . 28 TRP CZ2 1 1 6 2711 1 1 28 TRP CZ3 C 0.817 0.036 -9.811 1.00 . A A . 28 TRP CZ3 1 1 6 2712 1 1 28 TRP H H 1.110 -2.572 -5.270 1.00 . A A . 28 TRP H 1 1 6 2713 1 1 28 TRP HA H 3.457 -1.346 -3.874 1.00 . A A . 28 TRP HA 1 1 6 2714 1 1 28 TRP HB2 H 2.977 0.776 -4.977 1.00 . A A . 28 TRP HB2 1 1 6 2715 1 1 28 TRP HB3 H 3.202 -0.474 -6.192 1.00 . A A . 28 TRP HB3 1 1 6 2716 1 1 28 TRP HD1 H 0.060 0.678 -4.199 1.00 . A A . 28 TRP HD1 1 1 6 2717 1 1 28 TRP HE1 H -1.838 1.081 -5.890 1.00 . A A . 28 TRP HE1 1 1 6 2718 1 1 28 TRP HE3 H 2.522 -0.350 -8.550 1.00 . A A . 28 TRP HE3 1 1 6 2719 1 1 28 TRP HH2 H -1.038 0.485 -10.813 1.00 . A A . 28 TRP HH2 1 1 6 2720 1 1 28 TRP HZ2 H -2.260 0.987 -8.713 1.00 . A A . 28 TRP HZ2 1 1 6 2721 1 1 28 TRP HZ3 H 1.348 -0.182 -10.726 1.00 . A A . 28 TRP HZ3 1 1 6 2722 1 1 28 TRP N N 2.037 -2.472 -4.971 1.00 . A A . 28 TRP N 1 1 6 2723 1 1 28 TRP NE1 N -0.934 0.806 -6.148 1.00 . A A . 28 TRP NE1 1 1 6 2724 1 1 28 TRP O O 0.395 -1.345 -3.108 1.00 . A A . 28 TRP O 1 1 6 2725 1 1 29 CYS C C -0.132 1.401 -1.710 1.00 . A A . 29 CYS C 1 1 6 2726 1 1 29 CYS CA C 0.989 0.490 -1.197 1.00 . A A . 29 CYS CA 1 1 6 2727 1 1 29 CYS CB C 1.897 1.238 -0.220 1.00 . A A . 29 CYS CB 1 1 6 2728 1 1 29 CYS H H 2.776 0.478 -2.404 1.00 . A A . 29 CYS H 1 1 6 2729 1 1 29 CYS HA H 0.571 -0.380 -0.715 1.00 . A A . 29 CYS HA 1 1 6 2730 1 1 29 CYS HB2 H 2.912 0.882 -0.328 1.00 . A A . 29 CYS HB2 1 1 6 2731 1 1 29 CYS HB3 H 1.863 2.295 -0.433 1.00 . A A . 29 CYS HB3 1 1 6 2732 1 1 29 CYS N N 1.884 0.077 -2.320 1.00 . A A . 29 CYS N 1 1 6 2733 1 1 29 CYS O O 0.076 2.225 -2.578 1.00 . A A . 29 CYS O 1 1 6 2734 1 1 29 CYS SG S 1.334 0.944 1.473 1.00 . A A . 29 CYS SG 1 1 6 2735 1 1 30 VAL C C -3.152 2.714 -0.382 1.00 . A A . 30 VAL C 1 1 6 2736 1 1 30 VAL CA C -2.474 2.095 -1.609 1.00 . A A . 30 VAL CA 1 1 6 2737 1 1 30 VAL CB C -3.442 1.141 -2.332 1.00 . A A . 30 VAL CB 1 1 6 2738 1 1 30 VAL CG1 C -2.734 0.481 -3.516 1.00 . A A . 30 VAL CG1 1 1 6 2739 1 1 30 VAL CG2 C -3.937 0.055 -1.367 1.00 . A A . 30 VAL CG2 1 1 6 2740 1 1 30 VAL H H -1.447 0.579 -0.469 1.00 . A A . 30 VAL H 1 1 6 2741 1 1 30 VAL HA H -2.143 2.869 -2.285 1.00 . A A . 30 VAL HA 1 1 6 2742 1 1 30 VAL HB H -4.287 1.707 -2.697 1.00 . A A . 30 VAL HB 1 1 6 2743 1 1 30 VAL HG11 H -2.541 -0.558 -3.289 1.00 . A A . 30 VAL HG11 1 1 6 2744 1 1 30 VAL HG12 H -1.801 0.987 -3.707 1.00 . A A . 30 VAL HG12 1 1 6 2745 1 1 30 VAL HG13 H -3.363 0.545 -4.391 1.00 . A A . 30 VAL HG13 1 1 6 2746 1 1 30 VAL HG21 H -5.014 -0.001 -1.411 1.00 . A A . 30 VAL HG21 1 1 6 2747 1 1 30 VAL HG22 H -3.631 0.296 -0.361 1.00 . A A . 30 VAL HG22 1 1 6 2748 1 1 30 VAL HG23 H -3.515 -0.898 -1.652 1.00 . A A . 30 VAL HG23 1 1 6 2749 1 1 30 VAL N N -1.316 1.251 -1.173 1.00 . A A . 30 VAL N 1 1 6 2750 1 1 30 VAL O O -2.872 2.339 0.740 1.00 . A A . 30 VAL O 1 1 6 2751 1 1 31 TYR C C -5.870 3.386 1.079 1.00 . A A . 31 TYR C 1 1 6 2752 1 1 31 TYR CA C -4.729 4.281 0.584 1.00 . A A . 31 TYR CA 1 1 6 2753 1 1 31 TYR CB C -5.273 5.617 0.062 1.00 . A A . 31 TYR CB 1 1 6 2754 1 1 31 TYR CD1 C -4.954 6.462 2.428 1.00 . A A . 31 TYR CD1 1 1 6 2755 1 1 31 TYR CD2 C -6.759 7.377 1.093 1.00 . A A . 31 TYR CD2 1 1 6 2756 1 1 31 TYR CE1 C -5.324 7.286 3.495 1.00 . A A . 31 TYR CE1 1 1 6 2757 1 1 31 TYR CE2 C -7.126 8.205 2.161 1.00 . A A . 31 TYR CE2 1 1 6 2758 1 1 31 TYR CG C -5.672 6.505 1.224 1.00 . A A . 31 TYR CG 1 1 6 2759 1 1 31 TYR CZ C -6.409 8.158 3.362 1.00 . A A . 31 TYR CZ 1 1 6 2760 1 1 31 TYR H H -4.257 3.937 -1.494 1.00 . A A . 31 TYR H 1 1 6 2761 1 1 31 TYR HA H -4.022 4.458 1.380 1.00 . A A . 31 TYR HA 1 1 6 2762 1 1 31 TYR HB2 H -4.510 6.111 -0.520 1.00 . A A . 31 TYR HB2 1 1 6 2763 1 1 31 TYR HB3 H -6.136 5.433 -0.560 1.00 . A A . 31 TYR HB3 1 1 6 2764 1 1 31 TYR HD1 H -4.117 5.790 2.533 1.00 . A A . 31 TYR HD1 1 1 6 2765 1 1 31 TYR HD2 H -7.314 7.413 0.166 1.00 . A A . 31 TYR HD2 1 1 6 2766 1 1 31 TYR HE1 H -4.770 7.250 4.421 1.00 . A A . 31 TYR HE1 1 1 6 2767 1 1 31 TYR HE2 H -7.966 8.877 2.059 1.00 . A A . 31 TYR HE2 1 1 6 2768 1 1 31 TYR HH H -7.245 8.440 5.057 1.00 . A A . 31 TYR HH 1 1 6 2769 1 1 31 TYR N N -4.041 3.651 -0.582 1.00 . A A . 31 TYR N 1 1 6 2770 1 1 31 TYR O O -6.783 3.066 0.342 1.00 . A A . 31 TYR O 1 1 6 2771 1 1 31 TYR OH O -6.771 8.974 4.415 1.00 . A A . 31 TYR OH 1 1 6 2772 1 1 32 ALA C C -8.004 2.984 3.497 1.00 . A A . 32 ALA C 1 1 6 2773 1 1 32 ALA CA C -6.899 2.116 2.881 1.00 . A A . 32 ALA CA 1 1 6 2774 1 1 32 ALA CB C -6.211 1.260 3.949 1.00 . A A . 32 ALA CB 1 1 6 2775 1 1 32 ALA H H -5.074 3.263 2.896 1.00 . A A . 32 ALA H 1 1 6 2776 1 1 32 ALA HA H -7.307 1.483 2.109 1.00 . A A . 32 ALA HA 1 1 6 2777 1 1 32 ALA HB1 H -6.878 0.470 4.262 1.00 . A A . 32 ALA HB1 1 1 6 2778 1 1 32 ALA HB2 H -5.959 1.877 4.799 1.00 . A A . 32 ALA HB2 1 1 6 2779 1 1 32 ALA HB3 H -5.310 0.829 3.538 1.00 . A A . 32 ALA HB3 1 1 6 2780 1 1 32 ALA N N -5.821 2.987 2.325 1.00 . A A . 32 ALA N 1 1 6 2781 1 1 32 ALA O O -8.185 3.021 4.701 1.00 . A A . 32 ALA O 1 1 6 2782 1 1 33 ARG C C -11.060 4.451 2.255 1.00 . A A . 33 ARG C 1 1 6 2783 1 1 33 ARG CA C -9.838 4.557 3.182 1.00 . A A . 33 ARG CA 1 1 6 2784 1 1 33 ARG CB C -9.250 5.975 3.161 1.00 . A A . 33 ARG CB 1 1 6 2785 1 1 33 ARG CD C -11.062 7.029 4.546 1.00 . A A . 33 ARG CD 1 1 6 2786 1 1 33 ARG CG C -9.567 6.694 4.477 1.00 . A A . 33 ARG CG 1 1 6 2787 1 1 33 ARG CZ C -11.943 9.214 3.948 1.00 . A A . 33 ARG CZ 1 1 6 2788 1 1 33 ARG H H -8.569 3.634 1.707 1.00 . A A . 33 ARG H 1 1 6 2789 1 1 33 ARG HA H -10.103 4.281 4.191 1.00 . A A . 33 ARG HA 1 1 6 2790 1 1 33 ARG HB2 H -8.179 5.916 3.034 1.00 . A A . 33 ARG HB2 1 1 6 2791 1 1 33 ARG HB3 H -9.676 6.531 2.339 1.00 . A A . 33 ARG HB3 1 1 6 2792 1 1 33 ARG HD2 H -11.652 6.172 4.251 1.00 . A A . 33 ARG HD2 1 1 6 2793 1 1 33 ARG HD3 H -11.329 7.343 5.545 1.00 . A A . 33 ARG HD3 1 1 6 2794 1 1 33 ARG HE H -10.885 8.102 2.683 1.00 . A A . 33 ARG HE 1 1 6 2795 1 1 33 ARG HG2 H -9.304 6.054 5.307 1.00 . A A . 33 ARG HG2 1 1 6 2796 1 1 33 ARG HG3 H -8.994 7.608 4.533 1.00 . A A . 33 ARG HG3 1 1 6 2797 1 1 33 ARG HH11 H -13.376 8.169 4.885 1.00 . A A . 33 ARG HH11 1 1 6 2798 1 1 33 ARG HH12 H -13.568 9.891 4.911 1.00 . A A . 33 ARG HH12 1 1 6 2799 1 1 33 ARG HH21 H -10.677 10.511 3.089 1.00 . A A . 33 ARG HH21 1 1 6 2800 1 1 33 ARG HH22 H -12.040 11.216 3.892 1.00 . A A . 33 ARG HH22 1 1 6 2801 1 1 33 ARG N N -8.740 3.683 2.671 1.00 . A A . 33 ARG N 1 1 6 2802 1 1 33 ARG NE N -11.261 8.155 3.587 1.00 . A A . 33 ARG NE 1 1 6 2803 1 1 33 ARG NH1 N -13.049 9.081 4.634 1.00 . A A . 33 ARG NH1 1 1 6 2804 1 1 33 ARG NH2 N -11.521 10.407 3.617 1.00 . A A . 33 ARG NH2 1 1 6 2805 1 1 33 ARG O O -11.379 5.382 1.538 1.00 . A A . 33 ARG O 1 1 6 2806 1 1 34 PRO C C -14.097 3.883 1.946 1.00 . A A . 34 PRO C 1 1 6 2807 1 1 34 PRO CA C -12.896 3.072 1.438 1.00 . A A . 34 PRO CA 1 1 6 2808 1 1 34 PRO CB C -13.147 1.570 1.572 1.00 . A A . 34 PRO CB 1 1 6 2809 1 1 34 PRO CD C -11.387 2.136 3.127 1.00 . A A . 34 PRO CD 1 1 6 2810 1 1 34 PRO CG C -12.536 1.190 2.882 1.00 . A A . 34 PRO CG 1 1 6 2811 1 1 34 PRO HA H -12.679 3.317 0.411 1.00 . A A . 34 PRO HA 1 1 6 2812 1 1 34 PRO HB2 H -14.209 1.365 1.575 1.00 . A A . 34 PRO HB2 1 1 6 2813 1 1 34 PRO HB3 H -12.662 1.035 0.771 1.00 . A A . 34 PRO HB3 1 1 6 2814 1 1 34 PRO HD2 H -11.342 2.412 4.171 1.00 . A A . 34 PRO HD2 1 1 6 2815 1 1 34 PRO HD3 H -10.457 1.693 2.807 1.00 . A A . 34 PRO HD3 1 1 6 2816 1 1 34 PRO HG2 H -13.270 1.285 3.672 1.00 . A A . 34 PRO HG2 1 1 6 2817 1 1 34 PRO HG3 H -12.169 0.177 2.839 1.00 . A A . 34 PRO HG3 1 1 6 2818 1 1 34 PRO N N -11.703 3.306 2.294 1.00 . A A . 34 PRO N 1 1 6 2819 1 1 34 PRO O O -14.398 3.795 3.127 1.00 . A A . 34 PRO O 1 1 6 2820 1 1 34 PRO OXT O -14.694 4.580 1.142 1.00 . A A . 34 PRO OXT 1 1 7 2821 1 1 1 GLY C C 9.044 8.030 4.127 1.00 . A A . 1 GLY C 1 1 7 2822 1 1 1 GLY CA C 9.659 9.425 3.961 1.00 . A A . 1 GLY CA 1 1 7 2823 1 1 1 GLY H1 H 11.719 9.738 3.926 1.00 . A A . 1 GLY H1 1 1 7 2824 1 1 1 GLY H2 H 11.225 8.539 5.024 1.00 . A A . 1 GLY H2 1 1 7 2825 1 1 1 GLY H3 H 10.981 10.181 5.385 1.00 . A A . 1 GLY H3 1 1 7 2826 1 1 1 GLY HA2 H 9.008 10.161 4.411 1.00 . A A . 1 GLY HA2 1 1 7 2827 1 1 1 GLY HA3 H 9.772 9.640 2.909 1.00 . A A . 1 GLY HA3 1 1 7 2828 1 1 1 GLY N N 10.997 9.474 4.624 1.00 . A A . 1 GLY N 1 1 7 2829 1 1 1 GLY O O 9.739 7.031 4.128 1.00 . A A . 1 GLY O 1 1 7 2830 1 1 2 CYS C C 6.768 6.017 3.049 1.00 . A A . 2 CYS C 1 1 7 2831 1 1 2 CYS CA C 7.073 6.631 4.425 1.00 . A A . 2 CYS CA 1 1 7 2832 1 1 2 CYS CB C 5.781 6.929 5.196 1.00 . A A . 2 CYS CB 1 1 7 2833 1 1 2 CYS H H 7.204 8.778 4.253 1.00 . A A . 2 CYS H 1 1 7 2834 1 1 2 CYS HA H 7.697 5.966 5.001 1.00 . A A . 2 CYS HA 1 1 7 2835 1 1 2 CYS HB2 H 5.341 6.002 5.531 1.00 . A A . 2 CYS HB2 1 1 7 2836 1 1 2 CYS HB3 H 6.009 7.547 6.053 1.00 . A A . 2 CYS HB3 1 1 7 2837 1 1 2 CYS N N 7.742 7.958 4.262 1.00 . A A . 2 CYS N 1 1 7 2838 1 1 2 CYS O O 7.415 6.333 2.068 1.00 . A A . 2 CYS O 1 1 7 2839 1 1 2 CYS SG S 4.605 7.798 4.124 1.00 . A A . 2 CYS SG 1 1 7 2840 1 1 3 GLY C C 4.779 5.541 0.750 1.00 . A A . 3 GLY C 1 1 7 2841 1 1 3 GLY CA C 5.448 4.508 1.661 1.00 . A A . 3 GLY CA 1 1 7 2842 1 1 3 GLY H H 5.287 4.898 3.774 1.00 . A A . 3 GLY H 1 1 7 2843 1 1 3 GLY HA2 H 6.349 4.139 1.191 1.00 . A A . 3 GLY HA2 1 1 7 2844 1 1 3 GLY HA3 H 4.768 3.686 1.828 1.00 . A A . 3 GLY HA3 1 1 7 2845 1 1 3 GLY N N 5.792 5.140 2.970 1.00 . A A . 3 GLY N 1 1 7 2846 1 1 3 GLY O O 5.428 6.423 0.219 1.00 . A A . 3 GLY O 1 1 7 2847 1 1 4 GLY C C 1.726 5.692 -1.168 1.00 . A A . 4 GLY C 1 1 7 2848 1 1 4 GLY CA C 2.774 6.416 -0.315 1.00 . A A . 4 GLY CA 1 1 7 2849 1 1 4 GLY H H 2.983 4.719 1.000 1.00 . A A . 4 GLY H 1 1 7 2850 1 1 4 GLY HA2 H 2.288 7.161 0.300 1.00 . A A . 4 GLY HA2 1 1 7 2851 1 1 4 GLY HA3 H 3.487 6.900 -0.966 1.00 . A A . 4 GLY HA3 1 1 7 2852 1 1 4 GLY N N 3.486 5.439 0.563 1.00 . A A . 4 GLY N 1 1 7 2853 1 1 4 GLY O O 1.452 4.523 -0.970 1.00 . A A . 4 GLY O 1 1 7 2854 1 1 5 LEU C C 0.739 4.827 -4.042 1.00 . A A . 5 LEU C 1 1 7 2855 1 1 5 LEU CA C 0.101 5.746 -2.991 1.00 . A A . 5 LEU CA 1 1 7 2856 1 1 5 LEU CB C -0.607 6.911 -3.685 1.00 . A A . 5 LEU CB 1 1 7 2857 1 1 5 LEU CD1 C -2.133 8.855 -3.380 1.00 . A A . 5 LEU CD1 1 1 7 2858 1 1 5 LEU CD2 C -2.450 6.795 -1.998 1.00 . A A . 5 LEU CD2 1 1 7 2859 1 1 5 LEU CG C -1.417 7.710 -2.664 1.00 . A A . 5 LEU CG 1 1 7 2860 1 1 5 LEU H H 1.380 7.323 -2.252 1.00 . A A . 5 LEU H 1 1 7 2861 1 1 5 LEU HA H -0.607 5.195 -2.393 1.00 . A A . 5 LEU HA 1 1 7 2862 1 1 5 LEU HB2 H 0.129 7.555 -4.144 1.00 . A A . 5 LEU HB2 1 1 7 2863 1 1 5 LEU HB3 H -1.270 6.525 -4.445 1.00 . A A . 5 LEU HB3 1 1 7 2864 1 1 5 LEU HD11 H -2.829 8.451 -4.100 1.00 . A A . 5 LEU HD11 1 1 7 2865 1 1 5 LEU HD12 H -1.406 9.471 -3.889 1.00 . A A . 5 LEU HD12 1 1 7 2866 1 1 5 LEU HD13 H -2.668 9.453 -2.657 1.00 . A A . 5 LEU HD13 1 1 7 2867 1 1 5 LEU HD21 H -3.355 7.353 -1.809 1.00 . A A . 5 LEU HD21 1 1 7 2868 1 1 5 LEU HD22 H -2.053 6.424 -1.064 1.00 . A A . 5 LEU HD22 1 1 7 2869 1 1 5 LEU HD23 H -2.669 5.963 -2.651 1.00 . A A . 5 LEU HD23 1 1 7 2870 1 1 5 LEU HG H -0.753 8.114 -1.914 1.00 . A A . 5 LEU HG 1 1 7 2871 1 1 5 LEU N N 1.139 6.382 -2.116 1.00 . A A . 5 LEU N 1 1 7 2872 1 1 5 LEU O O 0.049 4.101 -4.733 1.00 . A A . 5 LEU O 1 1 7 2873 1 1 6 MET C C 4.048 3.477 -4.623 1.00 . A A . 6 MET C 1 1 7 2874 1 1 6 MET CA C 2.708 3.975 -5.176 1.00 . A A . 6 MET CA 1 1 7 2875 1 1 6 MET CB C 2.909 4.872 -6.399 1.00 . A A . 6 MET CB 1 1 7 2876 1 1 6 MET CE C 2.450 4.026 -10.266 1.00 . A A . 6 MET CE 1 1 7 2877 1 1 6 MET CG C 3.117 4.001 -7.637 1.00 . A A . 6 MET CG 1 1 7 2878 1 1 6 MET H H 2.581 5.439 -3.607 1.00 . A A . 6 MET H 1 1 7 2879 1 1 6 MET HA H 2.074 3.141 -5.431 1.00 . A A . 6 MET HA 1 1 7 2880 1 1 6 MET HB2 H 2.033 5.492 -6.535 1.00 . A A . 6 MET HB2 1 1 7 2881 1 1 6 MET HB3 H 3.774 5.500 -6.249 1.00 . A A . 6 MET HB3 1 1 7 2882 1 1 6 MET HE1 H 3.136 3.645 -11.010 1.00 . A A . 6 MET HE1 1 1 7 2883 1 1 6 MET HE2 H 1.690 4.617 -10.751 1.00 . A A . 6 MET HE2 1 1 7 2884 1 1 6 MET HE3 H 1.985 3.204 -9.742 1.00 . A A . 6 MET HE3 1 1 7 2885 1 1 6 MET HG2 H 3.988 3.379 -7.497 1.00 . A A . 6 MET HG2 1 1 7 2886 1 1 6 MET HG3 H 2.249 3.376 -7.786 1.00 . A A . 6 MET HG3 1 1 7 2887 1 1 6 MET N N 2.040 4.849 -4.170 1.00 . A A . 6 MET N 1 1 7 2888 1 1 6 MET O O 5.049 3.443 -5.317 1.00 . A A . 6 MET O 1 1 7 2889 1 1 6 MET SD S 3.358 5.056 -9.087 1.00 . A A . 6 MET SD 1 1 7 2890 1 1 7 ALA C C 5.471 1.082 -2.983 1.00 . A A . 7 ALA C 1 1 7 2891 1 1 7 ALA CA C 5.335 2.591 -2.754 1.00 . A A . 7 ALA CA 1 1 7 2892 1 1 7 ALA CB C 5.202 2.906 -1.262 1.00 . A A . 7 ALA CB 1 1 7 2893 1 1 7 ALA H H 3.247 3.128 -2.835 1.00 . A A . 7 ALA H 1 1 7 2894 1 1 7 ALA HA H 6.186 3.112 -3.165 1.00 . A A . 7 ALA HA 1 1 7 2895 1 1 7 ALA HB1 H 4.751 2.067 -0.755 1.00 . A A . 7 ALA HB1 1 1 7 2896 1 1 7 ALA HB2 H 4.581 3.781 -1.134 1.00 . A A . 7 ALA HB2 1 1 7 2897 1 1 7 ALA HB3 H 6.180 3.096 -0.846 1.00 . A A . 7 ALA HB3 1 1 7 2898 1 1 7 ALA N N 4.070 3.090 -3.371 1.00 . A A . 7 ALA N 1 1 7 2899 1 1 7 ALA O O 4.831 0.285 -2.324 1.00 . A A . 7 ALA O 1 1 7 2900 1 1 8 GLY C C 6.908 -1.500 -2.931 1.00 . A A . 8 GLY C 1 1 7 2901 1 1 8 GLY CA C 6.488 -0.766 -4.208 1.00 . A A . 8 GLY CA 1 1 7 2902 1 1 8 GLY H H 6.801 1.355 -4.432 1.00 . A A . 8 GLY H 1 1 7 2903 1 1 8 GLY HA2 H 5.560 -1.180 -4.575 1.00 . A A . 8 GLY HA2 1 1 7 2904 1 1 8 GLY HA3 H 7.258 -0.886 -4.957 1.00 . A A . 8 GLY HA3 1 1 7 2905 1 1 8 GLY N N 6.302 0.689 -3.917 1.00 . A A . 8 GLY N 1 1 7 2906 1 1 8 GLY O O 7.934 -1.207 -2.348 1.00 . A A . 8 GLY O 1 1 7 2907 1 1 9 CYS C C 6.684 -4.688 -1.555 1.00 . A A . 9 CYS C 1 1 7 2908 1 1 9 CYS CA C 6.466 -3.203 -1.248 1.00 . A A . 9 CYS CA 1 1 7 2909 1 1 9 CYS CB C 5.279 -3.007 -0.293 1.00 . A A . 9 CYS CB 1 1 7 2910 1 1 9 CYS H H 5.296 -2.663 -2.982 1.00 . A A . 9 CYS H 1 1 7 2911 1 1 9 CYS HA H 7.354 -2.790 -0.806 1.00 . A A . 9 CYS HA 1 1 7 2912 1 1 9 CYS HB2 H 5.347 -3.724 0.512 1.00 . A A . 9 CYS HB2 1 1 7 2913 1 1 9 CYS HB3 H 5.314 -2.008 0.118 1.00 . A A . 9 CYS HB3 1 1 7 2914 1 1 9 CYS N N 6.117 -2.448 -2.492 1.00 . A A . 9 CYS N 1 1 7 2915 1 1 9 CYS O O 7.653 -5.277 -1.114 1.00 . A A . 9 CYS O 1 1 7 2916 1 1 9 CYS SG S 3.709 -3.242 -1.166 1.00 . A A . 9 CYS SG 1 1 7 2917 1 1 10 ASP C C 6.153 -7.582 -1.380 1.00 . A A . 10 ASP C 1 1 7 2918 1 1 10 ASP CA C 5.937 -6.745 -2.651 1.00 . A A . 10 ASP CA 1 1 7 2919 1 1 10 ASP CB C 7.161 -6.821 -3.574 1.00 . A A . 10 ASP CB 1 1 7 2920 1 1 10 ASP CG C 7.131 -8.131 -4.368 1.00 . A A . 10 ASP CG 1 1 7 2921 1 1 10 ASP H H 5.029 -4.790 -2.643 1.00 . A A . 10 ASP H 1 1 7 2922 1 1 10 ASP HA H 5.061 -7.089 -3.179 1.00 . A A . 10 ASP HA 1 1 7 2923 1 1 10 ASP HB2 H 7.148 -5.985 -4.258 1.00 . A A . 10 ASP HB2 1 1 7 2924 1 1 10 ASP HB3 H 8.063 -6.785 -2.980 1.00 . A A . 10 ASP HB3 1 1 7 2925 1 1 10 ASP N N 5.795 -5.294 -2.305 1.00 . A A . 10 ASP N 1 1 7 2926 1 1 10 ASP O O 7.211 -8.144 -1.165 1.00 . A A . 10 ASP O 1 1 7 2927 1 1 10 ASP OD1 O 6.492 -8.158 -5.408 1.00 . A A . 10 ASP OD1 1 1 7 2928 1 1 10 ASP OD2 O 7.749 -9.085 -3.923 1.00 . A A . 10 ASP OD2 1 1 7 2929 1 1 11 GLY C C 4.254 -8.000 1.741 1.00 . A A . 11 GLY C 1 1 7 2930 1 1 11 GLY CA C 5.296 -8.458 0.719 1.00 . A A . 11 GLY CA 1 1 7 2931 1 1 11 GLY H H 4.312 -7.201 -0.725 1.00 . A A . 11 GLY H 1 1 7 2932 1 1 11 GLY HA2 H 5.148 -9.506 0.497 1.00 . A A . 11 GLY HA2 1 1 7 2933 1 1 11 GLY HA3 H 6.285 -8.314 1.130 1.00 . A A . 11 GLY HA3 1 1 7 2934 1 1 11 GLY N N 5.155 -7.663 -0.535 1.00 . A A . 11 GLY N 1 1 7 2935 1 1 11 GLY O O 4.144 -6.827 2.048 1.00 . A A . 11 GLY O 1 1 7 2936 1 1 12 LYS C C 3.100 -8.042 4.587 1.00 . A A . 12 LYS C 1 1 7 2937 1 1 12 LYS CA C 2.451 -8.564 3.291 1.00 . A A . 12 LYS CA 1 1 7 2938 1 1 12 LYS CB C 1.670 -9.860 3.563 1.00 . A A . 12 LYS CB 1 1 7 2939 1 1 12 LYS CD C 2.572 -11.225 5.465 1.00 . A A . 12 LYS CD 1 1 7 2940 1 1 12 LYS CE C 3.425 -12.448 5.828 1.00 . A A . 12 LYS CE 1 1 7 2941 1 1 12 LYS CG C 2.632 -10.990 3.953 1.00 . A A . 12 LYS CG 1 1 7 2942 1 1 12 LYS H H 3.611 -9.860 2.006 1.00 . A A . 12 LYS H 1 1 7 2943 1 1 12 LYS HA H 1.785 -7.817 2.887 1.00 . A A . 12 LYS HA 1 1 7 2944 1 1 12 LYS HB2 H 0.968 -9.691 4.367 1.00 . A A . 12 LYS HB2 1 1 7 2945 1 1 12 LYS HB3 H 1.130 -10.144 2.672 1.00 . A A . 12 LYS HB3 1 1 7 2946 1 1 12 LYS HD2 H 2.952 -10.354 5.980 1.00 . A A . 12 LYS HD2 1 1 7 2947 1 1 12 LYS HD3 H 1.549 -11.402 5.762 1.00 . A A . 12 LYS HD3 1 1 7 2948 1 1 12 LYS HE2 H 3.359 -12.648 6.889 1.00 . A A . 12 LYS HE2 1 1 7 2949 1 1 12 LYS HE3 H 3.105 -13.310 5.263 1.00 . A A . 12 LYS HE3 1 1 7 2950 1 1 12 LYS HG2 H 2.349 -11.896 3.439 1.00 . A A . 12 LYS HG2 1 1 7 2951 1 1 12 LYS HG3 H 3.638 -10.720 3.675 1.00 . A A . 12 LYS HG3 1 1 7 2952 1 1 12 LYS HZ1 H 4.927 -12.109 4.419 1.00 . A A . 12 LYS HZ1 1 1 7 2953 1 1 12 LYS HZ2 H 5.486 -12.759 5.885 1.00 . A A . 12 LYS HZ2 1 1 7 2954 1 1 12 LYS HZ3 H 5.037 -11.124 5.795 1.00 . A A . 12 LYS HZ3 1 1 7 2955 1 1 12 LYS N N 3.493 -8.925 2.273 1.00 . A A . 12 LYS N 1 1 7 2956 1 1 12 LYS NZ N 4.825 -12.082 5.454 1.00 . A A . 12 LYS NZ 1 1 7 2957 1 1 12 LYS O O 2.434 -7.475 5.431 1.00 . A A . 12 LYS O 1 1 7 2958 1 1 13 SER C C 5.773 -6.380 5.720 1.00 . A A . 13 SER C 1 1 7 2959 1 1 13 SER CA C 5.074 -7.724 5.987 1.00 . A A . 13 SER CA 1 1 7 2960 1 1 13 SER CB C 6.098 -8.806 6.338 1.00 . A A . 13 SER CB 1 1 7 2961 1 1 13 SER H H 4.917 -8.676 4.056 1.00 . A A . 13 SER H 1 1 7 2962 1 1 13 SER HA H 4.361 -7.621 6.790 1.00 . A A . 13 SER HA 1 1 7 2963 1 1 13 SER HB2 H 6.372 -9.348 5.448 1.00 . A A . 13 SER HB2 1 1 7 2964 1 1 13 SER HB3 H 6.981 -8.343 6.760 1.00 . A A . 13 SER HB3 1 1 7 2965 1 1 13 SER HG H 6.098 -9.737 8.047 1.00 . A A . 13 SER HG 1 1 7 2966 1 1 13 SER N N 4.393 -8.221 4.749 1.00 . A A . 13 SER N 1 1 7 2967 1 1 13 SER O O 6.676 -5.990 6.437 1.00 . A A . 13 SER O 1 1 7 2968 1 1 13 SER OG O 5.526 -9.707 7.276 1.00 . A A . 13 SER OG 1 1 7 2969 1 1 14 THR C C 5.415 -3.245 5.295 1.00 . A A . 14 THR C 1 1 7 2970 1 1 14 THR CA C 5.995 -4.343 4.390 1.00 . A A . 14 THR CA 1 1 7 2971 1 1 14 THR CB C 5.658 -4.068 2.916 1.00 . A A . 14 THR CB 1 1 7 2972 1 1 14 THR CG2 C 4.172 -3.708 2.776 1.00 . A A . 14 THR CG2 1 1 7 2973 1 1 14 THR H H 4.626 -5.992 4.137 1.00 . A A . 14 THR H 1 1 7 2974 1 1 14 THR HA H 7.065 -4.405 4.515 1.00 . A A . 14 THR HA 1 1 7 2975 1 1 14 THR HB H 5.863 -4.951 2.330 1.00 . A A . 14 THR HB 1 1 7 2976 1 1 14 THR HG1 H 6.050 -2.166 2.702 1.00 . A A . 14 THR HG1 1 1 7 2977 1 1 14 THR HG21 H 4.056 -2.634 2.793 1.00 . A A . 14 THR HG21 1 1 7 2978 1 1 14 THR HG22 H 3.616 -4.144 3.594 1.00 . A A . 14 THR HG22 1 1 7 2979 1 1 14 THR HG23 H 3.797 -4.096 1.841 1.00 . A A . 14 THR HG23 1 1 7 2980 1 1 14 THR N N 5.358 -5.663 4.698 1.00 . A A . 14 THR N 1 1 7 2981 1 1 14 THR O O 4.434 -3.452 5.987 1.00 . A A . 14 THR O 1 1 7 2982 1 1 14 THR OG1 O 6.462 -2.993 2.439 1.00 . A A . 14 THR OG1 1 1 7 2983 1 1 15 PHE C C 5.304 0.305 5.311 1.00 . A A . 15 PHE C 1 1 7 2984 1 1 15 PHE CA C 5.499 -0.966 6.148 1.00 . A A . 15 PHE CA 1 1 7 2985 1 1 15 PHE CB C 6.575 -0.753 7.216 1.00 . A A . 15 PHE CB 1 1 7 2986 1 1 15 PHE CD1 C 5.494 -1.989 9.130 1.00 . A A . 15 PHE CD1 1 1 7 2987 1 1 15 PHE CD2 C 7.551 -2.864 8.191 1.00 . A A . 15 PHE CD2 1 1 7 2988 1 1 15 PHE CE1 C 5.460 -3.050 10.043 1.00 . A A . 15 PHE CE1 1 1 7 2989 1 1 15 PHE CE2 C 7.517 -3.925 9.104 1.00 . A A . 15 PHE CE2 1 1 7 2990 1 1 15 PHE CG C 6.539 -1.896 8.202 1.00 . A A . 15 PHE CG 1 1 7 2991 1 1 15 PHE CZ C 6.472 -4.016 10.030 1.00 . A A . 15 PHE CZ 1 1 7 2992 1 1 15 PHE H H 6.801 -1.935 4.725 1.00 . A A . 15 PHE H 1 1 7 2993 1 1 15 PHE HA H 4.569 -1.250 6.616 1.00 . A A . 15 PHE HA 1 1 7 2994 1 1 15 PHE HB2 H 7.547 -0.712 6.744 1.00 . A A . 15 PHE HB2 1 1 7 2995 1 1 15 PHE HB3 H 6.389 0.176 7.735 1.00 . A A . 15 PHE HB3 1 1 7 2996 1 1 15 PHE HD1 H 4.713 -1.243 9.140 1.00 . A A . 15 PHE HD1 1 1 7 2997 1 1 15 PHE HD2 H 8.358 -2.793 7.475 1.00 . A A . 15 PHE HD2 1 1 7 2998 1 1 15 PHE HE1 H 4.654 -3.121 10.758 1.00 . A A . 15 PHE HE1 1 1 7 2999 1 1 15 PHE HE2 H 8.297 -4.671 9.094 1.00 . A A . 15 PHE HE2 1 1 7 3000 1 1 15 PHE HZ H 6.446 -4.834 10.735 1.00 . A A . 15 PHE HZ 1 1 7 3001 1 1 15 PHE N N 6.013 -2.079 5.292 1.00 . A A . 15 PHE N 1 1 7 3002 1 1 15 PHE O O 6.085 0.602 4.425 1.00 . A A . 15 PHE O 1 1 7 3003 1 1 16 CYS C C 3.834 3.496 5.781 1.00 . A A . 16 CYS C 1 1 7 3004 1 1 16 CYS CA C 4.002 2.308 4.816 1.00 . A A . 16 CYS CA 1 1 7 3005 1 1 16 CYS CB C 2.705 2.030 4.046 1.00 . A A . 16 CYS CB 1 1 7 3006 1 1 16 CYS H H 3.652 0.788 6.307 1.00 . A A . 16 CYS H 1 1 7 3007 1 1 16 CYS HA H 4.807 2.499 4.125 1.00 . A A . 16 CYS HA 1 1 7 3008 1 1 16 CYS HB2 H 1.947 1.677 4.730 1.00 . A A . 16 CYS HB2 1 1 7 3009 1 1 16 CYS HB3 H 2.366 2.936 3.570 1.00 . A A . 16 CYS HB3 1 1 7 3010 1 1 16 CYS N N 4.265 1.052 5.589 1.00 . A A . 16 CYS N 1 1 7 3011 1 1 16 CYS O O 4.401 3.509 6.858 1.00 . A A . 16 CYS O 1 1 7 3012 1 1 16 CYS SG S 3.011 0.768 2.784 1.00 . A A . 16 CYS SG 1 1 7 3013 1 1 17 CYS C C 2.075 5.300 7.544 1.00 . A A . 17 CYS C 1 1 7 3014 1 1 17 CYS CA C 2.877 5.683 6.294 1.00 . A A . 17 CYS CA 1 1 7 3015 1 1 17 CYS CB C 2.109 6.705 5.446 1.00 . A A . 17 CYS CB 1 1 7 3016 1 1 17 CYS H H 2.630 4.470 4.528 1.00 . A A . 17 CYS H 1 1 7 3017 1 1 17 CYS HA H 3.828 6.091 6.581 1.00 . A A . 17 CYS HA 1 1 7 3018 1 1 17 CYS HB2 H 1.959 6.310 4.453 1.00 . A A . 17 CYS HB2 1 1 7 3019 1 1 17 CYS HB3 H 1.150 6.905 5.903 1.00 . A A . 17 CYS HB3 1 1 7 3020 1 1 17 CYS N N 3.070 4.496 5.402 1.00 . A A . 17 CYS N 1 1 7 3021 1 1 17 CYS O O 2.589 5.319 8.646 1.00 . A A . 17 CYS O 1 1 7 3022 1 1 17 CYS SG S 3.058 8.243 5.346 1.00 . A A . 17 CYS SG 1 1 7 3023 1 1 18 SER C C -1.095 3.571 8.132 1.00 . A A . 18 SER C 1 1 7 3024 1 1 18 SER CA C -0.016 4.573 8.557 1.00 . A A . 18 SER CA 1 1 7 3025 1 1 18 SER CB C -0.645 5.882 9.040 1.00 . A A . 18 SER CB 1 1 7 3026 1 1 18 SER H H 0.436 4.949 6.480 1.00 . A A . 18 SER H 1 1 7 3027 1 1 18 SER HA H 0.597 4.152 9.335 1.00 . A A . 18 SER HA 1 1 7 3028 1 1 18 SER HB2 H -0.785 6.547 8.205 1.00 . A A . 18 SER HB2 1 1 7 3029 1 1 18 SER HB3 H -1.605 5.674 9.495 1.00 . A A . 18 SER HB3 1 1 7 3030 1 1 18 SER HG H -0.308 7.091 10.527 1.00 . A A . 18 SER HG 1 1 7 3031 1 1 18 SER N N 0.824 4.956 7.380 1.00 . A A . 18 SER N 1 1 7 3032 1 1 18 SER O O -0.984 2.385 8.385 1.00 . A A . 18 SER O 1 1 7 3033 1 1 18 SER OG O 0.218 6.498 9.987 1.00 . A A . 18 SER OG 1 1 7 3034 1 1 19 GLY C C -3.023 2.764 5.548 1.00 . A A . 19 GLY C 1 1 7 3035 1 1 19 GLY CA C -3.217 3.115 7.029 1.00 . A A . 19 GLY CA 1 1 7 3036 1 1 19 GLY H H -2.194 4.992 7.286 1.00 . A A . 19 GLY H 1 1 7 3037 1 1 19 GLY HA2 H -3.188 2.210 7.620 1.00 . A A . 19 GLY HA2 1 1 7 3038 1 1 19 GLY HA3 H -4.174 3.597 7.158 1.00 . A A . 19 GLY HA3 1 1 7 3039 1 1 19 GLY N N -2.133 4.036 7.482 1.00 . A A . 19 GLY N 1 1 7 3040 1 1 19 GLY O O -3.909 2.223 4.917 1.00 . A A . 19 GLY O 1 1 7 3041 1 1 20 TYR C C -1.425 1.226 3.385 1.00 . A A . 20 TYR C 1 1 7 3042 1 1 20 TYR CA C -1.628 2.736 3.548 1.00 . A A . 20 TYR CA 1 1 7 3043 1 1 20 TYR CB C -0.354 3.504 3.179 1.00 . A A . 20 TYR CB 1 1 7 3044 1 1 20 TYR CD1 C -1.534 5.708 3.570 1.00 . A A . 20 TYR CD1 1 1 7 3045 1 1 20 TYR CD2 C -0.224 5.423 1.551 1.00 . A A . 20 TYR CD2 1 1 7 3046 1 1 20 TYR CE1 C -1.865 7.008 3.173 1.00 . A A . 20 TYR CE1 1 1 7 3047 1 1 20 TYR CE2 C -0.555 6.723 1.153 1.00 . A A . 20 TYR CE2 1 1 7 3048 1 1 20 TYR CG C -0.712 4.913 2.758 1.00 . A A . 20 TYR CG 1 1 7 3049 1 1 20 TYR CZ C -1.377 7.516 1.964 1.00 . A A . 20 TYR CZ 1 1 7 3050 1 1 20 TYR H H -1.168 3.491 5.514 1.00 . A A . 20 TYR H 1 1 7 3051 1 1 20 TYR HA H -2.452 3.076 2.938 1.00 . A A . 20 TYR HA 1 1 7 3052 1 1 20 TYR HB2 H 0.306 3.540 4.035 1.00 . A A . 20 TYR HB2 1 1 7 3053 1 1 20 TYR HB3 H 0.144 3.002 2.364 1.00 . A A . 20 TYR HB3 1 1 7 3054 1 1 20 TYR HD1 H -1.911 5.317 4.503 1.00 . A A . 20 TYR HD1 1 1 7 3055 1 1 20 TYR HD2 H 0.409 4.813 0.926 1.00 . A A . 20 TYR HD2 1 1 7 3056 1 1 20 TYR HE1 H -2.498 7.620 3.799 1.00 . A A . 20 TYR HE1 1 1 7 3057 1 1 20 TYR HE2 H -0.178 7.116 0.221 1.00 . A A . 20 TYR HE2 1 1 7 3058 1 1 20 TYR HH H -2.358 8.735 0.867 1.00 . A A . 20 TYR HH 1 1 7 3059 1 1 20 TYR N N -1.873 3.059 4.987 1.00 . A A . 20 TYR N 1 1 7 3060 1 1 20 TYR O O -0.522 0.648 3.962 1.00 . A A . 20 TYR O 1 1 7 3061 1 1 20 TYR OH O -1.705 8.798 1.569 1.00 . A A . 20 TYR OH 1 1 7 3062 1 1 21 ASN C C -1.573 -1.204 1.027 1.00 . A A . 21 ASN C 1 1 7 3063 1 1 21 ASN CA C -2.132 -0.895 2.418 1.00 . A A . 21 ASN CA 1 1 7 3064 1 1 21 ASN CB C -3.551 -1.452 2.565 1.00 . A A . 21 ASN CB 1 1 7 3065 1 1 21 ASN CG C -3.509 -2.753 3.373 1.00 . A A . 21 ASN CG 1 1 7 3066 1 1 21 ASN H H -2.988 1.071 2.164 1.00 . A A . 21 ASN H 1 1 7 3067 1 1 21 ASN HA H -1.492 -1.315 3.178 1.00 . A A . 21 ASN HA 1 1 7 3068 1 1 21 ASN HB2 H -4.172 -0.730 3.075 1.00 . A A . 21 ASN HB2 1 1 7 3069 1 1 21 ASN HB3 H -3.961 -1.653 1.587 1.00 . A A . 21 ASN HB3 1 1 7 3070 1 1 21 ASN HD21 H -4.618 -3.767 2.072 1.00 . A A . 21 ASN HD21 1 1 7 3071 1 1 21 ASN HD22 H -4.104 -4.646 3.431 1.00 . A A . 21 ASN HD22 1 1 7 3072 1 1 21 ASN N N -2.265 0.583 2.613 1.00 . A A . 21 ASN N 1 1 7 3073 1 1 21 ASN ND2 N -4.129 -3.809 2.922 1.00 . A A . 21 ASN ND2 1 1 7 3074 1 1 21 ASN O O -1.730 -0.434 0.102 1.00 . A A . 21 ASN O 1 1 7 3075 1 1 21 ASN OD1 O -2.906 -2.808 4.429 1.00 . A A . 21 ASN OD1 1 1 7 3076 1 1 22 CYS C C -1.359 -3.465 -1.299 1.00 . A A . 22 CYS C 1 1 7 3077 1 1 22 CYS CA C -0.342 -2.685 -0.458 1.00 . A A . 22 CYS CA 1 1 7 3078 1 1 22 CYS CB C 0.878 -3.556 -0.145 1.00 . A A . 22 CYS CB 1 1 7 3079 1 1 22 CYS H H -0.803 -2.933 1.636 1.00 . A A . 22 CYS H 1 1 7 3080 1 1 22 CYS HA H -0.030 -1.797 -0.980 1.00 . A A . 22 CYS HA 1 1 7 3081 1 1 22 CYS HB2 H 0.692 -4.128 0.753 1.00 . A A . 22 CYS HB2 1 1 7 3082 1 1 22 CYS HB3 H 1.062 -4.230 -0.969 1.00 . A A . 22 CYS HB3 1 1 7 3083 1 1 22 CYS N N -0.919 -2.328 0.874 1.00 . A A . 22 CYS N 1 1 7 3084 1 1 22 CYS O O -2.018 -4.368 -0.816 1.00 . A A . 22 CYS O 1 1 7 3085 1 1 22 CYS SG S 2.326 -2.498 0.103 1.00 . A A . 22 CYS SG 1 1 7 3086 1 1 23 SER C C -1.782 -5.091 -4.044 1.00 . A A . 23 SER C 1 1 7 3087 1 1 23 SER CA C -2.447 -3.841 -3.449 1.00 . A A . 23 SER CA 1 1 7 3088 1 1 23 SER CB C -2.802 -2.844 -4.556 1.00 . A A . 23 SER CB 1 1 7 3089 1 1 23 SER H H -0.934 -2.396 -2.924 1.00 . A A . 23 SER H 1 1 7 3090 1 1 23 SER HA H -3.334 -4.112 -2.899 1.00 . A A . 23 SER HA 1 1 7 3091 1 1 23 SER HB2 H -2.758 -1.840 -4.169 1.00 . A A . 23 SER HB2 1 1 7 3092 1 1 23 SER HB3 H -2.095 -2.943 -5.370 1.00 . A A . 23 SER HB3 1 1 7 3093 1 1 23 SER HG H -4.694 -2.409 -4.700 1.00 . A A . 23 SER HG 1 1 7 3094 1 1 23 SER N N -1.482 -3.124 -2.561 1.00 . A A . 23 SER N 1 1 7 3095 1 1 23 SER O O -0.619 -5.058 -4.399 1.00 . A A . 23 SER O 1 1 7 3096 1 1 23 SER OG O -4.119 -3.108 -5.022 1.00 . A A . 23 SER OG 1 1 7 3097 1 1 24 PRO C C -1.828 -7.347 -6.206 1.00 . A A . 24 PRO C 1 1 7 3098 1 1 24 PRO CA C -2.010 -7.432 -4.680 1.00 . A A . 24 PRO CA 1 1 7 3099 1 1 24 PRO CB C -3.084 -8.455 -4.316 1.00 . A A . 24 PRO CB 1 1 7 3100 1 1 24 PRO CD C -3.949 -6.280 -3.720 1.00 . A A . 24 PRO CD 1 1 7 3101 1 1 24 PRO CG C -4.344 -7.661 -4.173 1.00 . A A . 24 PRO CG 1 1 7 3102 1 1 24 PRO HA H -1.082 -7.692 -4.203 1.00 . A A . 24 PRO HA 1 1 7 3103 1 1 24 PRO HB2 H -3.186 -9.189 -5.103 1.00 . A A . 24 PRO HB2 1 1 7 3104 1 1 24 PRO HB3 H -2.844 -8.934 -3.380 1.00 . A A . 24 PRO HB3 1 1 7 3105 1 1 24 PRO HD2 H -4.556 -5.533 -4.213 1.00 . A A . 24 PRO HD2 1 1 7 3106 1 1 24 PRO HD3 H -4.034 -6.193 -2.648 1.00 . A A . 24 PRO HD3 1 1 7 3107 1 1 24 PRO HG2 H -4.855 -7.608 -5.124 1.00 . A A . 24 PRO HG2 1 1 7 3108 1 1 24 PRO HG3 H -4.985 -8.116 -3.434 1.00 . A A . 24 PRO HG3 1 1 7 3109 1 1 24 PRO N N -2.541 -6.158 -4.127 1.00 . A A . 24 PRO N 1 1 7 3110 1 1 24 PRO O O -1.013 -8.047 -6.776 1.00 . A A . 24 PRO O 1 1 7 3111 1 1 25 THR C C -1.424 -5.294 -8.737 1.00 . A A . 25 THR C 1 1 7 3112 1 1 25 THR CA C -2.449 -6.376 -8.356 1.00 . A A . 25 THR CA 1 1 7 3113 1 1 25 THR CB C -3.851 -6.004 -8.865 1.00 . A A . 25 THR CB 1 1 7 3114 1 1 25 THR CG2 C -4.312 -4.678 -8.250 1.00 . A A . 25 THR CG2 1 1 7 3115 1 1 25 THR H H -3.231 -5.947 -6.388 1.00 . A A . 25 THR H 1 1 7 3116 1 1 25 THR HA H -2.154 -7.323 -8.778 1.00 . A A . 25 THR HA 1 1 7 3117 1 1 25 THR HB H -4.548 -6.779 -8.590 1.00 . A A . 25 THR HB 1 1 7 3118 1 1 25 THR HG1 H -4.582 -6.349 -10.634 1.00 . A A . 25 THR HG1 1 1 7 3119 1 1 25 THR HG21 H -3.452 -4.089 -7.973 1.00 . A A . 25 THR HG21 1 1 7 3120 1 1 25 THR HG22 H -4.909 -4.876 -7.371 1.00 . A A . 25 THR HG22 1 1 7 3121 1 1 25 THR HG23 H -4.903 -4.134 -8.971 1.00 . A A . 25 THR HG23 1 1 7 3122 1 1 25 THR N N -2.580 -6.500 -6.867 1.00 . A A . 25 THR N 1 1 7 3123 1 1 25 THR O O -0.863 -5.323 -9.817 1.00 . A A . 25 THR O 1 1 7 3124 1 1 25 THR OG1 O -3.821 -5.883 -10.279 1.00 . A A . 25 THR OG1 1 1 7 3125 1 1 26 TRP C C 1.153 -3.523 -7.507 1.00 . A A . 26 TRP C 1 1 7 3126 1 1 26 TRP CA C -0.191 -3.260 -8.197 1.00 . A A . 26 TRP CA 1 1 7 3127 1 1 26 TRP CB C -0.810 -1.966 -7.665 1.00 . A A . 26 TRP CB 1 1 7 3128 1 1 26 TRP CD1 C -2.577 -2.232 -9.461 1.00 . A A . 26 TRP CD1 1 1 7 3129 1 1 26 TRP CD2 C -3.297 -1.028 -7.704 1.00 . A A . 26 TRP CD2 1 1 7 3130 1 1 26 TRP CE2 C -4.376 -1.103 -8.614 1.00 . A A . 26 TRP CE2 1 1 7 3131 1 1 26 TRP CE3 C -3.486 -0.318 -6.506 1.00 . A A . 26 TRP CE3 1 1 7 3132 1 1 26 TRP CG C -2.168 -1.758 -8.261 1.00 . A A . 26 TRP CG 1 1 7 3133 1 1 26 TRP CH2 C -5.773 0.210 -7.151 1.00 . A A . 26 TRP CH2 1 1 7 3134 1 1 26 TRP CZ2 C -5.601 -0.494 -8.346 1.00 . A A . 26 TRP CZ2 1 1 7 3135 1 1 26 TRP CZ3 C -4.718 0.296 -6.232 1.00 . A A . 26 TRP CZ3 1 1 7 3136 1 1 26 TRP H H -1.642 -4.332 -7.007 1.00 . A A . 26 TRP H 1 1 7 3137 1 1 26 TRP HA H -0.055 -3.187 -9.264 1.00 . A A . 26 TRP HA 1 1 7 3138 1 1 26 TRP HB2 H -0.898 -2.026 -6.591 1.00 . A A . 26 TRP HB2 1 1 7 3139 1 1 26 TRP HB3 H -0.175 -1.137 -7.925 1.00 . A A . 26 TRP HB3 1 1 7 3140 1 1 26 TRP HD1 H -1.980 -2.820 -10.142 1.00 . A A . 26 TRP HD1 1 1 7 3141 1 1 26 TRP HE1 H -4.423 -2.076 -10.454 1.00 . A A . 26 TRP HE1 1 1 7 3142 1 1 26 TRP HE3 H -2.679 -0.246 -5.793 1.00 . A A . 26 TRP HE3 1 1 7 3143 1 1 26 TRP HH2 H -6.718 0.684 -6.935 1.00 . A A . 26 TRP HH2 1 1 7 3144 1 1 26 TRP HZ2 H -6.409 -0.564 -9.058 1.00 . A A . 26 TRP HZ2 1 1 7 3145 1 1 26 TRP HZ3 H -4.852 0.841 -5.310 1.00 . A A . 26 TRP HZ3 1 1 7 3146 1 1 26 TRP N N -1.177 -4.341 -7.870 1.00 . A A . 26 TRP N 1 1 7 3147 1 1 26 TRP NE1 N -3.889 -1.852 -9.666 1.00 . A A . 26 TRP NE1 1 1 7 3148 1 1 26 TRP O O 2.178 -3.022 -7.933 1.00 . A A . 26 TRP O 1 1 7 3149 1 1 27 LYS C C 2.959 -3.403 -4.949 1.00 . A A . 27 LYS C 1 1 7 3150 1 1 27 LYS CA C 2.409 -4.623 -5.706 1.00 . A A . 27 LYS CA 1 1 7 3151 1 1 27 LYS CB C 3.408 -5.099 -6.770 1.00 . A A . 27 LYS CB 1 1 7 3152 1 1 27 LYS CD C 3.190 -7.556 -6.343 1.00 . A A . 27 LYS CD 1 1 7 3153 1 1 27 LYS CE C 2.749 -7.955 -4.928 1.00 . A A . 27 LYS CE 1 1 7 3154 1 1 27 LYS CG C 4.134 -6.350 -6.270 1.00 . A A . 27 LYS CG 1 1 7 3155 1 1 27 LYS H H 0.302 -4.684 -6.135 1.00 . A A . 27 LYS H 1 1 7 3156 1 1 27 LYS HA H 2.224 -5.425 -5.010 1.00 . A A . 27 LYS HA 1 1 7 3157 1 1 27 LYS HB2 H 2.878 -5.329 -7.684 1.00 . A A . 27 LYS HB2 1 1 7 3158 1 1 27 LYS HB3 H 4.130 -4.318 -6.960 1.00 . A A . 27 LYS HB3 1 1 7 3159 1 1 27 LYS HD2 H 2.323 -7.299 -6.934 1.00 . A A . 27 LYS HD2 1 1 7 3160 1 1 27 LYS HD3 H 3.704 -8.386 -6.804 1.00 . A A . 27 LYS HD3 1 1 7 3161 1 1 27 LYS HE2 H 2.968 -8.998 -4.751 1.00 . A A . 27 LYS HE2 1 1 7 3162 1 1 27 LYS HE3 H 3.242 -7.337 -4.193 1.00 . A A . 27 LYS HE3 1 1 7 3163 1 1 27 LYS HG2 H 4.999 -6.532 -6.889 1.00 . A A . 27 LYS HG2 1 1 7 3164 1 1 27 LYS HG3 H 4.447 -6.201 -5.248 1.00 . A A . 27 LYS HG3 1 1 7 3165 1 1 27 LYS HZ1 H 0.780 -8.546 -5.277 1.00 . A A . 27 LYS HZ1 1 1 7 3166 1 1 27 LYS HZ2 H 1.039 -6.876 -5.451 1.00 . A A . 27 LYS HZ2 1 1 7 3167 1 1 27 LYS HZ3 H 0.975 -7.572 -3.903 1.00 . A A . 27 LYS HZ3 1 1 7 3168 1 1 27 LYS N N 1.147 -4.302 -6.448 1.00 . A A . 27 LYS N 1 1 7 3169 1 1 27 LYS NZ N 1.275 -7.719 -4.887 1.00 . A A . 27 LYS NZ 1 1 7 3170 1 1 27 LYS O O 4.053 -3.454 -4.418 1.00 . A A . 27 LYS O 1 1 7 3171 1 1 28 TRP C C 1.710 -0.693 -3.052 1.00 . A A . 28 TRP C 1 1 7 3172 1 1 28 TRP CA C 2.729 -1.132 -4.110 1.00 . A A . 28 TRP CA 1 1 7 3173 1 1 28 TRP CB C 2.999 -0.026 -5.150 1.00 . A A . 28 TRP CB 1 1 7 3174 1 1 28 TRP CD1 C 0.631 0.906 -5.207 1.00 . A A . 28 TRP CD1 1 1 7 3175 1 1 28 TRP CD2 C 1.470 0.525 -7.258 1.00 . A A . 28 TRP CD2 1 1 7 3176 1 1 28 TRP CE2 C 0.166 1.043 -7.441 1.00 . A A . 28 TRP CE2 1 1 7 3177 1 1 28 TRP CE3 C 2.220 0.198 -8.401 1.00 . A A . 28 TRP CE3 1 1 7 3178 1 1 28 TRP CG C 1.741 0.439 -5.828 1.00 . A A . 28 TRP CG 1 1 7 3179 1 1 28 TRP CH2 C 0.387 0.906 -9.839 1.00 . A A . 28 TRP CH2 1 1 7 3180 1 1 28 TRP CZ2 C -0.372 1.234 -8.714 1.00 . A A . 28 TRP CZ2 1 1 7 3181 1 1 28 TRP CZ3 C 1.681 0.389 -9.683 1.00 . A A . 28 TRP CZ3 1 1 7 3182 1 1 28 TRP H H 1.331 -2.292 -5.281 1.00 . A A . 28 TRP H 1 1 7 3183 1 1 28 TRP HA H 3.656 -1.393 -3.622 1.00 . A A . 28 TRP HA 1 1 7 3184 1 1 28 TRP HB2 H 3.457 0.815 -4.654 1.00 . A A . 28 TRP HB2 1 1 7 3185 1 1 28 TRP HB3 H 3.682 -0.407 -5.895 1.00 . A A . 28 TRP HB3 1 1 7 3186 1 1 28 TRP HD1 H 0.494 0.984 -4.140 1.00 . A A . 28 TRP HD1 1 1 7 3187 1 1 28 TRP HE1 H -1.195 1.620 -5.977 1.00 . A A . 28 TRP HE1 1 1 7 3188 1 1 28 TRP HE3 H 3.218 -0.200 -8.292 1.00 . A A . 28 TRP HE3 1 1 7 3189 1 1 28 TRP HH2 H -0.021 1.051 -10.827 1.00 . A A . 28 TRP HH2 1 1 7 3190 1 1 28 TRP HZ2 H -1.370 1.632 -8.827 1.00 . A A . 28 TRP HZ2 1 1 7 3191 1 1 28 TRP HZ3 H 2.267 0.136 -10.555 1.00 . A A . 28 TRP HZ3 1 1 7 3192 1 1 28 TRP N N 2.219 -2.319 -4.866 1.00 . A A . 28 TRP N 1 1 7 3193 1 1 28 TRP NE1 N -0.304 1.258 -6.162 1.00 . A A . 28 TRP NE1 1 1 7 3194 1 1 28 TRP O O 0.602 -1.193 -3.000 1.00 . A A . 28 TRP O 1 1 7 3195 1 1 29 CYS C C 0.180 1.744 -1.664 1.00 . A A . 29 CYS C 1 1 7 3196 1 1 29 CYS CA C 1.151 0.692 -1.125 1.00 . A A . 29 CYS CA 1 1 7 3197 1 1 29 CYS CB C 2.045 1.293 -0.039 1.00 . A A . 29 CYS CB 1 1 7 3198 1 1 29 CYS H H 2.987 0.608 -2.255 1.00 . A A . 29 CYS H 1 1 7 3199 1 1 29 CYS HA H 0.605 -0.144 -0.720 1.00 . A A . 29 CYS HA 1 1 7 3200 1 1 29 CYS HB2 H 3.045 0.902 -0.137 1.00 . A A . 29 CYS HB2 1 1 7 3201 1 1 29 CYS HB3 H 2.067 2.369 -0.144 1.00 . A A . 29 CYS HB3 1 1 7 3202 1 1 29 CYS N N 2.085 0.228 -2.197 1.00 . A A . 29 CYS N 1 1 7 3203 1 1 29 CYS O O 0.512 2.522 -2.535 1.00 . A A . 29 CYS O 1 1 7 3204 1 1 29 CYS SG S 1.385 0.860 1.589 1.00 . A A . 29 CYS SG 1 1 7 3205 1 1 30 VAL C C -2.764 3.342 -0.379 1.00 . A A . 30 VAL C 1 1 7 3206 1 1 30 VAL CA C -2.042 2.756 -1.597 1.00 . A A . 30 VAL CA 1 1 7 3207 1 1 30 VAL CB C -3.024 1.962 -2.474 1.00 . A A . 30 VAL CB 1 1 7 3208 1 1 30 VAL CG1 C -2.264 1.265 -3.604 1.00 . A A . 30 VAL CG1 1 1 7 3209 1 1 30 VAL CG2 C -3.756 0.910 -1.626 1.00 . A A . 30 VAL CG2 1 1 7 3210 1 1 30 VAL H H -1.250 1.122 -0.438 1.00 . A A . 30 VAL H 1 1 7 3211 1 1 30 VAL HA H -1.580 3.541 -2.174 1.00 . A A . 30 VAL HA 1 1 7 3212 1 1 30 VAL HB H -3.748 2.642 -2.902 1.00 . A A . 30 VAL HB 1 1 7 3213 1 1 30 VAL HG11 H -1.820 0.352 -3.233 1.00 . A A . 30 VAL HG11 1 1 7 3214 1 1 30 VAL HG12 H -1.487 1.918 -3.973 1.00 . A A . 30 VAL HG12 1 1 7 3215 1 1 30 VAL HG13 H -2.947 1.031 -4.406 1.00 . A A . 30 VAL HG13 1 1 7 3216 1 1 30 VAL HG21 H -3.562 -0.075 -2.026 1.00 . A A . 30 VAL HG21 1 1 7 3217 1 1 30 VAL HG22 H -4.817 1.105 -1.649 1.00 . A A . 30 VAL HG22 1 1 7 3218 1 1 30 VAL HG23 H -3.404 0.958 -0.605 1.00 . A A . 30 VAL HG23 1 1 7 3219 1 1 30 VAL N N -1.020 1.764 -1.141 1.00 . A A . 30 VAL N 1 1 7 3220 1 1 30 VAL O O -2.367 3.126 0.748 1.00 . A A . 30 VAL O 1 1 7 3221 1 1 31 TYR C C -5.730 3.720 0.949 1.00 . A A . 31 TYR C 1 1 7 3222 1 1 31 TYR CA C -4.581 4.657 0.552 1.00 . A A . 31 TYR CA 1 1 7 3223 1 1 31 TYR CB C -5.112 6.001 0.034 1.00 . A A . 31 TYR CB 1 1 7 3224 1 1 31 TYR CD1 C -5.915 7.064 2.178 1.00 . A A . 31 TYR CD1 1 1 7 3225 1 1 31 TYR CD2 C -7.555 6.424 0.510 1.00 . A A . 31 TYR CD2 1 1 7 3226 1 1 31 TYR CE1 C -6.942 7.535 3.005 1.00 . A A . 31 TYR CE1 1 1 7 3227 1 1 31 TYR CE2 C -8.581 6.894 1.337 1.00 . A A . 31 TYR CE2 1 1 7 3228 1 1 31 TYR CG C -6.221 6.509 0.930 1.00 . A A . 31 TYR CG 1 1 7 3229 1 1 31 TYR CZ C -8.276 7.449 2.584 1.00 . A A . 31 TYR CZ 1 1 7 3230 1 1 31 TYR H H -4.134 4.225 -1.514 1.00 . A A . 31 TYR H 1 1 7 3231 1 1 31 TYR HA H -3.921 4.818 1.392 1.00 . A A . 31 TYR HA 1 1 7 3232 1 1 31 TYR HB2 H -4.306 6.720 0.020 1.00 . A A . 31 TYR HB2 1 1 7 3233 1 1 31 TYR HB3 H -5.493 5.872 -0.968 1.00 . A A . 31 TYR HB3 1 1 7 3234 1 1 31 TYR HD1 H -4.886 7.131 2.504 1.00 . A A . 31 TYR HD1 1 1 7 3235 1 1 31 TYR HD2 H -7.791 5.994 -0.453 1.00 . A A . 31 TYR HD2 1 1 7 3236 1 1 31 TYR HE1 H -6.706 7.965 3.967 1.00 . A A . 31 TYR HE1 1 1 7 3237 1 1 31 TYR HE2 H -9.609 6.828 1.012 1.00 . A A . 31 TYR HE2 1 1 7 3238 1 1 31 TYR HH H -9.579 7.180 3.951 1.00 . A A . 31 TYR HH 1 1 7 3239 1 1 31 TYR N N -3.827 4.071 -0.597 1.00 . A A . 31 TYR N 1 1 7 3240 1 1 31 TYR O O -6.411 3.167 0.105 1.00 . A A . 31 TYR O 1 1 7 3241 1 1 31 TYR OH O -9.286 7.910 3.401 1.00 . A A . 31 TYR OH 1 1 7 3242 1 1 32 ALA C C -8.349 3.437 2.855 1.00 . A A . 32 ALA C 1 1 7 3243 1 1 32 ALA CA C -7.050 2.642 2.688 1.00 . A A . 32 ALA CA 1 1 7 3244 1 1 32 ALA CB C -6.583 2.089 4.036 1.00 . A A . 32 ALA CB 1 1 7 3245 1 1 32 ALA H H -5.383 3.999 2.889 1.00 . A A . 32 ALA H 1 1 7 3246 1 1 32 ALA HA H -7.191 1.833 1.990 1.00 . A A . 32 ALA HA 1 1 7 3247 1 1 32 ALA HB1 H -5.886 1.280 3.870 1.00 . A A . 32 ALA HB1 1 1 7 3248 1 1 32 ALA HB2 H -7.435 1.723 4.590 1.00 . A A . 32 ALA HB2 1 1 7 3249 1 1 32 ALA HB3 H -6.098 2.873 4.599 1.00 . A A . 32 ALA HB3 1 1 7 3250 1 1 32 ALA N N -5.947 3.540 2.228 1.00 . A A . 32 ALA N 1 1 7 3251 1 1 32 ALA O O -8.335 4.580 3.270 1.00 . A A . 32 ALA O 1 1 7 3252 1 1 33 ARG C C -10.947 4.135 4.081 1.00 . A A . 33 ARG C 1 1 7 3253 1 1 33 ARG CA C -10.784 3.544 2.668 1.00 . A A . 33 ARG CA 1 1 7 3254 1 1 33 ARG CB C -11.851 2.478 2.394 1.00 . A A . 33 ARG CB 1 1 7 3255 1 1 33 ARG CD C -13.108 3.494 0.484 1.00 . A A . 33 ARG CD 1 1 7 3256 1 1 33 ARG CG C -12.119 2.396 0.890 1.00 . A A . 33 ARG CG 1 1 7 3257 1 1 33 ARG CZ C -12.814 5.047 -1.353 1.00 . A A . 33 ARG CZ 1 1 7 3258 1 1 33 ARG H H -9.447 1.911 2.202 1.00 . A A . 33 ARG H 1 1 7 3259 1 1 33 ARG HA H -10.856 4.327 1.929 1.00 . A A . 33 ARG HA 1 1 7 3260 1 1 33 ARG HB2 H -11.502 1.519 2.749 1.00 . A A . 33 ARG HB2 1 1 7 3261 1 1 33 ARG HB3 H -12.764 2.741 2.907 1.00 . A A . 33 ARG HB3 1 1 7 3262 1 1 33 ARG HD2 H -14.123 3.133 0.570 1.00 . A A . 33 ARG HD2 1 1 7 3263 1 1 33 ARG HD3 H -12.966 4.371 1.097 1.00 . A A . 33 ARG HD3 1 1 7 3264 1 1 33 ARG HE H -12.549 3.087 -1.558 1.00 . A A . 33 ARG HE 1 1 7 3265 1 1 33 ARG HG2 H -11.192 2.527 0.351 1.00 . A A . 33 ARG HG2 1 1 7 3266 1 1 33 ARG HG3 H -12.540 1.430 0.651 1.00 . A A . 33 ARG HG3 1 1 7 3267 1 1 33 ARG HH11 H -14.808 5.084 -1.572 1.00 . A A . 33 ARG HH11 1 1 7 3268 1 1 33 ARG HH12 H -13.983 6.553 -1.976 1.00 . A A . 33 ARG HH12 1 1 7 3269 1 1 33 ARG HH21 H -10.829 5.300 -1.232 1.00 . A A . 33 ARG HH21 1 1 7 3270 1 1 33 ARG HH22 H -11.727 6.675 -1.783 1.00 . A A . 33 ARG HH22 1 1 7 3271 1 1 33 ARG N N -9.469 2.834 2.534 1.00 . A A . 33 ARG N 1 1 7 3272 1 1 33 ARG NE N -12.783 3.809 -0.936 1.00 . A A . 33 ARG NE 1 1 7 3273 1 1 33 ARG NH1 N -13.957 5.605 -1.658 1.00 . A A . 33 ARG NH1 1 1 7 3274 1 1 33 ARG NH2 N -11.703 5.727 -1.465 1.00 . A A . 33 ARG NH2 1 1 7 3275 1 1 33 ARG O O -11.181 5.321 4.218 1.00 . A A . 33 ARG O 1 1 7 3276 1 1 34 PRO C C -9.727 4.627 6.891 1.00 . A A . 34 PRO C 1 1 7 3277 1 1 34 PRO CA C -10.945 3.777 6.494 1.00 . A A . 34 PRO CA 1 1 7 3278 1 1 34 PRO CB C -11.006 2.490 7.313 1.00 . A A . 34 PRO CB 1 1 7 3279 1 1 34 PRO CD C -10.530 1.854 5.035 1.00 . A A . 34 PRO CD 1 1 7 3280 1 1 34 PRO CG C -10.316 1.463 6.474 1.00 . A A . 34 PRO CG 1 1 7 3281 1 1 34 PRO HA H -11.857 4.338 6.617 1.00 . A A . 34 PRO HA 1 1 7 3282 1 1 34 PRO HB2 H -10.489 2.619 8.255 1.00 . A A . 34 PRO HB2 1 1 7 3283 1 1 34 PRO HB3 H -12.031 2.199 7.482 1.00 . A A . 34 PRO HB3 1 1 7 3284 1 1 34 PRO HD2 H -9.637 1.660 4.457 1.00 . A A . 34 PRO HD2 1 1 7 3285 1 1 34 PRO HD3 H -11.374 1.327 4.620 1.00 . A A . 34 PRO HD3 1 1 7 3286 1 1 34 PRO HG2 H -9.260 1.451 6.703 1.00 . A A . 34 PRO HG2 1 1 7 3287 1 1 34 PRO HG3 H -10.745 0.490 6.654 1.00 . A A . 34 PRO HG3 1 1 7 3288 1 1 34 PRO N N -10.812 3.297 5.092 1.00 . A A . 34 PRO N 1 1 7 3289 1 1 34 PRO O O -9.929 5.657 7.515 1.00 . A A . 34 PRO O 1 1 7 3290 1 1 34 PRO OXT O -8.617 4.238 6.558 1.00 . A A . 34 PRO OXT 1 1 8 3291 1 1 1 GLY C C 10.175 4.443 4.216 1.00 . A A . 1 GLY C 1 1 8 3292 1 1 1 GLY CA C 11.534 5.147 4.192 1.00 . A A . 1 GLY CA 1 1 8 3293 1 1 1 GLY H1 H 10.928 6.493 2.722 1.00 . A A . 1 GLY H1 1 1 8 3294 1 1 1 GLY H2 H 11.746 5.130 2.119 1.00 . A A . 1 GLY H2 1 1 8 3295 1 1 1 GLY H3 H 12.612 6.370 2.895 1.00 . A A . 1 GLY H3 1 1 8 3296 1 1 1 GLY HA2 H 12.323 4.419 4.328 1.00 . A A . 1 GLY HA2 1 1 8 3297 1 1 1 GLY HA3 H 11.573 5.873 4.990 1.00 . A A . 1 GLY HA3 1 1 8 3298 1 1 1 GLY N N 11.719 5.838 2.884 1.00 . A A . 1 GLY N 1 1 8 3299 1 1 1 GLY O O 10.096 3.231 4.139 1.00 . A A . 1 GLY O 1 1 8 3300 1 1 2 CYS C C 7.136 4.555 2.936 1.00 . A A . 2 CYS C 1 1 8 3301 1 1 2 CYS CA C 7.745 4.571 4.344 1.00 . A A . 2 CYS CA 1 1 8 3302 1 1 2 CYS CB C 6.916 5.449 5.288 1.00 . A A . 2 CYS CB 1 1 8 3303 1 1 2 CYS H H 9.199 6.169 4.376 1.00 . A A . 2 CYS H 1 1 8 3304 1 1 2 CYS HA H 7.803 3.567 4.737 1.00 . A A . 2 CYS HA 1 1 8 3305 1 1 2 CYS HB2 H 5.954 4.987 5.452 1.00 . A A . 2 CYS HB2 1 1 8 3306 1 1 2 CYS HB3 H 7.432 5.548 6.233 1.00 . A A . 2 CYS HB3 1 1 8 3307 1 1 2 CYS N N 9.106 5.194 4.318 1.00 . A A . 2 CYS N 1 1 8 3308 1 1 2 CYS O O 7.770 4.944 1.971 1.00 . A A . 2 CYS O 1 1 8 3309 1 1 2 CYS SG S 6.680 7.089 4.556 1.00 . A A . 2 CYS SG 1 1 8 3310 1 1 3 GLY C C 4.346 5.265 1.277 1.00 . A A . 3 GLY C 1 1 8 3311 1 1 3 GLY CA C 5.261 4.050 1.465 1.00 . A A . 3 GLY CA 1 1 8 3312 1 1 3 GLY H H 5.423 3.788 3.600 1.00 . A A . 3 GLY H 1 1 8 3313 1 1 3 GLY HA2 H 6.023 4.051 0.699 1.00 . A A . 3 GLY HA2 1 1 8 3314 1 1 3 GLY HA3 H 4.675 3.147 1.386 1.00 . A A . 3 GLY HA3 1 1 8 3315 1 1 3 GLY N N 5.913 4.101 2.809 1.00 . A A . 3 GLY N 1 1 8 3316 1 1 3 GLY O O 4.600 6.334 1.801 1.00 . A A . 3 GLY O 1 1 8 3317 1 1 4 GLY C C 1.168 5.778 -0.571 1.00 . A A . 4 GLY C 1 1 8 3318 1 1 4 GLY CA C 2.347 6.247 0.288 1.00 . A A . 4 GLY CA 1 1 8 3319 1 1 4 GLY H H 3.106 4.236 0.109 1.00 . A A . 4 GLY H 1 1 8 3320 1 1 4 GLY HA2 H 1.981 6.611 1.237 1.00 . A A . 4 GLY HA2 1 1 8 3321 1 1 4 GLY HA3 H 2.869 7.040 -0.225 1.00 . A A . 4 GLY HA3 1 1 8 3322 1 1 4 GLY N N 3.284 5.107 0.523 1.00 . A A . 4 GLY N 1 1 8 3323 1 1 4 GLY O O 0.362 4.974 -0.142 1.00 . A A . 4 GLY O 1 1 8 3324 1 1 5 LEU C C 0.444 4.976 -3.831 1.00 . A A . 5 LEU C 1 1 8 3325 1 1 5 LEU CA C -0.063 5.856 -2.676 1.00 . A A . 5 LEU CA 1 1 8 3326 1 1 5 LEU CB C -0.649 7.157 -3.220 1.00 . A A . 5 LEU CB 1 1 8 3327 1 1 5 LEU CD1 C -2.776 8.176 -2.407 1.00 . A A . 5 LEU CD1 1 1 8 3328 1 1 5 LEU CD2 C -2.666 7.167 -4.693 1.00 . A A . 5 LEU CD2 1 1 8 3329 1 1 5 LEU CG C -2.174 7.051 -3.248 1.00 . A A . 5 LEU CG 1 1 8 3330 1 1 5 LEU H H 1.729 6.919 -2.103 1.00 . A A . 5 LEU H 1 1 8 3331 1 1 5 LEU HA H -0.813 5.329 -2.108 1.00 . A A . 5 LEU HA 1 1 8 3332 1 1 5 LEU HB2 H -0.353 7.980 -2.583 1.00 . A A . 5 LEU HB2 1 1 8 3333 1 1 5 LEU HB3 H -0.282 7.329 -4.221 1.00 . A A . 5 LEU HB3 1 1 8 3334 1 1 5 LEU HD11 H -3.843 8.214 -2.566 1.00 . A A . 5 LEU HD11 1 1 8 3335 1 1 5 LEU HD12 H -2.334 9.118 -2.697 1.00 . A A . 5 LEU HD12 1 1 8 3336 1 1 5 LEU HD13 H -2.574 7.991 -1.362 1.00 . A A . 5 LEU HD13 1 1 8 3337 1 1 5 LEU HD21 H -3.744 7.226 -4.704 1.00 . A A . 5 LEU HD21 1 1 8 3338 1 1 5 LEU HD22 H -2.348 6.297 -5.251 1.00 . A A . 5 LEU HD22 1 1 8 3339 1 1 5 LEU HD23 H -2.251 8.055 -5.145 1.00 . A A . 5 LEU HD23 1 1 8 3340 1 1 5 LEU HG H -2.476 6.097 -2.838 1.00 . A A . 5 LEU HG 1 1 8 3341 1 1 5 LEU N N 1.064 6.273 -1.782 1.00 . A A . 5 LEU N 1 1 8 3342 1 1 5 LEU O O -0.327 4.299 -4.483 1.00 . A A . 5 LEU O 1 1 8 3343 1 1 6 MET C C 3.729 3.713 -4.824 1.00 . A A . 6 MET C 1 1 8 3344 1 1 6 MET CA C 2.293 4.128 -5.174 1.00 . A A . 6 MET CA 1 1 8 3345 1 1 6 MET CB C 2.268 5.015 -6.422 1.00 . A A . 6 MET CB 1 1 8 3346 1 1 6 MET CE C -0.850 4.897 -8.895 1.00 . A A . 6 MET CE 1 1 8 3347 1 1 6 MET CG C 1.417 4.350 -7.506 1.00 . A A . 6 MET CG 1 1 8 3348 1 1 6 MET H H 2.332 5.517 -3.533 1.00 . A A . 6 MET H 1 1 8 3349 1 1 6 MET HA H 1.679 3.255 -5.328 1.00 . A A . 6 MET HA 1 1 8 3350 1 1 6 MET HB2 H 1.843 5.976 -6.170 1.00 . A A . 6 MET HB2 1 1 8 3351 1 1 6 MET HB3 H 3.273 5.151 -6.790 1.00 . A A . 6 MET HB3 1 1 8 3352 1 1 6 MET HE1 H -0.749 3.854 -9.160 1.00 . A A . 6 MET HE1 1 1 8 3353 1 1 6 MET HE2 H -1.353 5.420 -9.692 1.00 . A A . 6 MET HE2 1 1 8 3354 1 1 6 MET HE3 H -1.429 4.988 -7.986 1.00 . A A . 6 MET HE3 1 1 8 3355 1 1 6 MET HG2 H 2.023 3.644 -8.054 1.00 . A A . 6 MET HG2 1 1 8 3356 1 1 6 MET HG3 H 0.587 3.832 -7.047 1.00 . A A . 6 MET HG3 1 1 8 3357 1 1 6 MET N N 1.731 4.972 -4.077 1.00 . A A . 6 MET N 1 1 8 3358 1 1 6 MET O O 4.571 3.554 -5.689 1.00 . A A . 6 MET O 1 1 8 3359 1 1 6 MET SD S 0.790 5.615 -8.638 1.00 . A A . 6 MET SD 1 1 8 3360 1 1 7 ALA C C 5.649 1.667 -3.515 1.00 . A A . 7 ALA C 1 1 8 3361 1 1 7 ALA CA C 5.385 3.124 -3.127 1.00 . A A . 7 ALA CA 1 1 8 3362 1 1 7 ALA CB C 5.396 3.294 -1.604 1.00 . A A . 7 ALA CB 1 1 8 3363 1 1 7 ALA H H 3.307 3.665 -2.879 1.00 . A A . 7 ALA H 1 1 8 3364 1 1 7 ALA HA H 6.126 3.766 -3.572 1.00 . A A . 7 ALA HA 1 1 8 3365 1 1 7 ALA HB1 H 6.111 4.055 -1.332 1.00 . A A . 7 ALA HB1 1 1 8 3366 1 1 7 ALA HB2 H 5.670 2.359 -1.138 1.00 . A A . 7 ALA HB2 1 1 8 3367 1 1 7 ALA HB3 H 4.414 3.588 -1.266 1.00 . A A . 7 ALA HB3 1 1 8 3368 1 1 7 ALA N N 4.008 3.533 -3.554 1.00 . A A . 7 ALA N 1 1 8 3369 1 1 7 ALA O O 4.957 1.100 -4.335 1.00 . A A . 7 ALA O 1 1 8 3370 1 1 8 GLY C C 6.446 -1.287 -2.191 1.00 . A A . 8 GLY C 1 1 8 3371 1 1 8 GLY CA C 6.955 -0.358 -3.292 1.00 . A A . 8 GLY CA 1 1 8 3372 1 1 8 GLY H H 7.206 1.537 -2.293 1.00 . A A . 8 GLY H 1 1 8 3373 1 1 8 GLY HA2 H 6.464 -0.608 -4.223 1.00 . A A . 8 GLY HA2 1 1 8 3374 1 1 8 GLY HA3 H 8.018 -0.482 -3.399 1.00 . A A . 8 GLY HA3 1 1 8 3375 1 1 8 GLY N N 6.651 1.059 -2.943 1.00 . A A . 8 GLY N 1 1 8 3376 1 1 8 GLY O O 6.904 -1.244 -1.064 1.00 . A A . 8 GLY O 1 1 8 3377 1 1 9 CYS C C 5.353 -4.517 -1.856 1.00 . A A . 9 CYS C 1 1 8 3378 1 1 9 CYS CA C 4.950 -3.079 -1.510 1.00 . A A . 9 CYS CA 1 1 8 3379 1 1 9 CYS CB C 3.431 -2.907 -1.595 1.00 . A A . 9 CYS CB 1 1 8 3380 1 1 9 CYS H H 5.159 -2.143 -3.436 1.00 . A A . 9 CYS H 1 1 8 3381 1 1 9 CYS HA H 5.294 -2.821 -0.521 1.00 . A A . 9 CYS HA 1 1 8 3382 1 1 9 CYS HB2 H 3.191 -2.220 -2.391 1.00 . A A . 9 CYS HB2 1 1 8 3383 1 1 9 CYS HB3 H 2.970 -3.863 -1.793 1.00 . A A . 9 CYS HB3 1 1 8 3384 1 1 9 CYS N N 5.502 -2.131 -2.519 1.00 . A A . 9 CYS N 1 1 8 3385 1 1 9 CYS O O 4.556 -5.433 -1.766 1.00 . A A . 9 CYS O 1 1 8 3386 1 1 9 CYS SG S 2.811 -2.252 -0.030 1.00 . A A . 9 CYS SG 1 1 8 3387 1 1 10 ASP C C 7.170 -6.938 -1.308 1.00 . A A . 10 ASP C 1 1 8 3388 1 1 10 ASP CA C 7.044 -6.107 -2.590 1.00 . A A . 10 ASP CA 1 1 8 3389 1 1 10 ASP CB C 8.407 -5.930 -3.271 1.00 . A A . 10 ASP CB 1 1 8 3390 1 1 10 ASP CG C 8.203 -5.404 -4.695 1.00 . A A . 10 ASP CG 1 1 8 3391 1 1 10 ASP H H 7.215 -3.974 -2.309 1.00 . A A . 10 ASP H 1 1 8 3392 1 1 10 ASP HA H 6.349 -6.572 -3.271 1.00 . A A . 10 ASP HA 1 1 8 3393 1 1 10 ASP HB2 H 9.003 -5.225 -2.707 1.00 . A A . 10 ASP HB2 1 1 8 3394 1 1 10 ASP HB3 H 8.917 -6.881 -3.311 1.00 . A A . 10 ASP HB3 1 1 8 3395 1 1 10 ASP N N 6.589 -4.726 -2.247 1.00 . A A . 10 ASP N 1 1 8 3396 1 1 10 ASP O O 8.242 -7.091 -0.751 1.00 . A A . 10 ASP O 1 1 8 3397 1 1 10 ASP OD1 O 8.026 -6.218 -5.588 1.00 . A A . 10 ASP OD1 1 1 8 3398 1 1 10 ASP OD2 O 8.224 -4.196 -4.868 1.00 . A A . 10 ASP OD2 1 1 8 3399 1 1 11 GLY C C 4.746 -8.076 1.146 1.00 . A A . 11 GLY C 1 1 8 3400 1 1 11 GLY CA C 6.082 -8.262 0.423 1.00 . A A . 11 GLY CA 1 1 8 3401 1 1 11 GLY H H 5.217 -7.302 -1.294 1.00 . A A . 11 GLY H 1 1 8 3402 1 1 11 GLY HA2 H 6.225 -9.305 0.178 1.00 . A A . 11 GLY HA2 1 1 8 3403 1 1 11 GLY HA3 H 6.885 -7.925 1.062 1.00 . A A . 11 GLY HA3 1 1 8 3404 1 1 11 GLY N N 6.066 -7.455 -0.830 1.00 . A A . 11 GLY N 1 1 8 3405 1 1 11 GLY O O 4.338 -6.966 1.434 1.00 . A A . 11 GLY O 1 1 8 3406 1 1 12 LYS C C 2.921 -8.541 3.588 1.00 . A A . 12 LYS C 1 1 8 3407 1 1 12 LYS CA C 2.743 -9.046 2.143 1.00 . A A . 12 LYS CA 1 1 8 3408 1 1 12 LYS CB C 2.168 -10.468 2.134 1.00 . A A . 12 LYS CB 1 1 8 3409 1 1 12 LYS CD C 2.839 -12.829 2.620 1.00 . A A . 12 LYS CD 1 1 8 3410 1 1 12 LYS CE C 4.224 -13.459 2.433 1.00 . A A . 12 LYS CE 1 1 8 3411 1 1 12 LYS CG C 2.988 -11.371 3.062 1.00 . A A . 12 LYS CG 1 1 8 3412 1 1 12 LYS H H 4.414 -10.034 1.193 1.00 . A A . 12 LYS H 1 1 8 3413 1 1 12 LYS HA H 2.085 -8.386 1.598 1.00 . A A . 12 LYS HA 1 1 8 3414 1 1 12 LYS HB2 H 1.143 -10.442 2.473 1.00 . A A . 12 LYS HB2 1 1 8 3415 1 1 12 LYS HB3 H 2.204 -10.862 1.129 1.00 . A A . 12 LYS HB3 1 1 8 3416 1 1 12 LYS HD2 H 2.293 -13.377 3.374 1.00 . A A . 12 LYS HD2 1 1 8 3417 1 1 12 LYS HD3 H 2.299 -12.869 1.686 1.00 . A A . 12 LYS HD3 1 1 8 3418 1 1 12 LYS HE2 H 4.876 -13.178 3.249 1.00 . A A . 12 LYS HE2 1 1 8 3419 1 1 12 LYS HE3 H 4.143 -14.533 2.370 1.00 . A A . 12 LYS HE3 1 1 8 3420 1 1 12 LYS HG2 H 4.029 -11.084 3.015 1.00 . A A . 12 LYS HG2 1 1 8 3421 1 1 12 LYS HG3 H 2.631 -11.266 4.074 1.00 . A A . 12 LYS HG3 1 1 8 3422 1 1 12 LYS HZ1 H 5.432 -13.573 0.739 1.00 . A A . 12 LYS HZ1 1 1 8 3423 1 1 12 LYS HZ2 H 5.201 -11.994 1.316 1.00 . A A . 12 LYS HZ2 1 1 8 3424 1 1 12 LYS HZ3 H 3.955 -12.786 0.474 1.00 . A A . 12 LYS HZ3 1 1 8 3425 1 1 12 LYS N N 4.062 -9.153 1.438 1.00 . A A . 12 LYS N 1 1 8 3426 1 1 12 LYS NZ N 4.741 -12.911 1.143 1.00 . A A . 12 LYS NZ 1 1 8 3427 1 1 12 LYS O O 1.958 -8.214 4.255 1.00 . A A . 12 LYS O 1 1 8 3428 1 1 13 SER C C 5.058 -6.622 5.472 1.00 . A A . 13 SER C 1 1 8 3429 1 1 13 SER CA C 4.372 -7.998 5.472 1.00 . A A . 13 SER CA 1 1 8 3430 1 1 13 SER CB C 5.282 -9.055 6.099 1.00 . A A . 13 SER CB 1 1 8 3431 1 1 13 SER H H 4.903 -8.747 3.522 1.00 . A A . 13 SER H 1 1 8 3432 1 1 13 SER HA H 3.440 -7.949 6.013 1.00 . A A . 13 SER HA 1 1 8 3433 1 1 13 SER HB2 H 4.984 -10.034 5.762 1.00 . A A . 13 SER HB2 1 1 8 3434 1 1 13 SER HB3 H 6.306 -8.870 5.802 1.00 . A A . 13 SER HB3 1 1 8 3435 1 1 13 SER HG H 5.489 -9.824 7.876 1.00 . A A . 13 SER HG 1 1 8 3436 1 1 13 SER N N 4.140 -8.478 4.075 1.00 . A A . 13 SER N 1 1 8 3437 1 1 13 SER O O 5.768 -6.275 6.398 1.00 . A A . 13 SER O 1 1 8 3438 1 1 13 SER OG O 5.167 -8.994 7.516 1.00 . A A . 13 SER OG 1 1 8 3439 1 1 14 THR C C 4.538 -3.440 5.025 1.00 . A A . 14 THR C 1 1 8 3440 1 1 14 THR CA C 5.475 -4.478 4.394 1.00 . A A . 14 THR CA 1 1 8 3441 1 1 14 THR CB C 5.699 -4.186 2.902 1.00 . A A . 14 THR CB 1 1 8 3442 1 1 14 THR CG2 C 4.366 -3.864 2.220 1.00 . A A . 14 THR CG2 1 1 8 3443 1 1 14 THR H H 4.260 -6.127 3.716 1.00 . A A . 14 THR H 1 1 8 3444 1 1 14 THR HA H 6.422 -4.487 4.912 1.00 . A A . 14 THR HA 1 1 8 3445 1 1 14 THR HB H 6.135 -5.054 2.431 1.00 . A A . 14 THR HB 1 1 8 3446 1 1 14 THR HG1 H 6.118 -2.287 3.033 1.00 . A A . 14 THR HG1 1 1 8 3447 1 1 14 THR HG21 H 4.462 -4.010 1.154 1.00 . A A . 14 THR HG21 1 1 8 3448 1 1 14 THR HG22 H 4.098 -2.836 2.419 1.00 . A A . 14 THR HG22 1 1 8 3449 1 1 14 THR HG23 H 3.597 -4.517 2.604 1.00 . A A . 14 THR HG23 1 1 8 3450 1 1 14 THR N N 4.844 -5.832 4.446 1.00 . A A . 14 THR N 1 1 8 3451 1 1 14 THR O O 3.333 -3.618 5.057 1.00 . A A . 14 THR O 1 1 8 3452 1 1 14 THR OG1 O 6.585 -3.081 2.763 1.00 . A A . 14 THR OG1 1 1 8 3453 1 1 15 PHE C C 4.312 -0.002 5.368 1.00 . A A . 15 PHE C 1 1 8 3454 1 1 15 PHE CA C 4.226 -1.313 6.160 1.00 . A A . 15 PHE CA 1 1 8 3455 1 1 15 PHE CB C 4.790 -1.137 7.573 1.00 . A A . 15 PHE CB 1 1 8 3456 1 1 15 PHE CD1 C 4.297 -3.452 8.453 1.00 . A A . 15 PHE CD1 1 1 8 3457 1 1 15 PHE CD2 C 3.175 -1.555 9.464 1.00 . A A . 15 PHE CD2 1 1 8 3458 1 1 15 PHE CE1 C 3.627 -4.315 9.328 1.00 . A A . 15 PHE CE1 1 1 8 3459 1 1 15 PHE CE2 C 2.505 -2.417 10.340 1.00 . A A . 15 PHE CE2 1 1 8 3460 1 1 15 PHE CG C 4.071 -2.071 8.520 1.00 . A A . 15 PHE CG 1 1 8 3461 1 1 15 PHE CZ C 2.731 -3.798 10.271 1.00 . A A . 15 PHE CZ 1 1 8 3462 1 1 15 PHE H H 6.055 -2.242 5.492 1.00 . A A . 15 PHE H 1 1 8 3463 1 1 15 PHE HA H 3.203 -1.649 6.214 1.00 . A A . 15 PHE HA 1 1 8 3464 1 1 15 PHE HB2 H 5.846 -1.366 7.572 1.00 . A A . 15 PHE HB2 1 1 8 3465 1 1 15 PHE HB3 H 4.642 -0.116 7.895 1.00 . A A . 15 PHE HB3 1 1 8 3466 1 1 15 PHE HD1 H 4.987 -3.852 7.725 1.00 . A A . 15 PHE HD1 1 1 8 3467 1 1 15 PHE HD2 H 3.001 -0.490 9.517 1.00 . A A . 15 PHE HD2 1 1 8 3468 1 1 15 PHE HE1 H 3.800 -5.379 9.275 1.00 . A A . 15 PHE HE1 1 1 8 3469 1 1 15 PHE HE2 H 1.814 -2.018 11.068 1.00 . A A . 15 PHE HE2 1 1 8 3470 1 1 15 PHE HZ H 2.213 -4.463 10.946 1.00 . A A . 15 PHE HZ 1 1 8 3471 1 1 15 PHE N N 5.083 -2.361 5.528 1.00 . A A . 15 PHE N 1 1 8 3472 1 1 15 PHE O O 5.279 0.257 4.678 1.00 . A A . 15 PHE O 1 1 8 3473 1 1 16 CYS C C 3.604 3.281 5.671 1.00 . A A . 16 CYS C 1 1 8 3474 1 1 16 CYS CA C 3.297 2.118 4.718 1.00 . A A . 16 CYS CA 1 1 8 3475 1 1 16 CYS CB C 1.881 2.243 4.145 1.00 . A A . 16 CYS CB 1 1 8 3476 1 1 16 CYS H H 2.528 0.583 6.026 1.00 . A A . 16 CYS H 1 1 8 3477 1 1 16 CYS HA H 4.016 2.090 3.914 1.00 . A A . 16 CYS HA 1 1 8 3478 1 1 16 CYS HB2 H 1.179 2.391 4.952 1.00 . A A . 16 CYS HB2 1 1 8 3479 1 1 16 CYS HB3 H 1.838 3.088 3.474 1.00 . A A . 16 CYS HB3 1 1 8 3480 1 1 16 CYS N N 3.296 0.821 5.463 1.00 . A A . 16 CYS N 1 1 8 3481 1 1 16 CYS O O 4.060 3.080 6.782 1.00 . A A . 16 CYS O 1 1 8 3482 1 1 16 CYS SG S 1.452 0.732 3.244 1.00 . A A . 16 CYS SG 1 1 8 3483 1 1 17 CYS C C 2.507 5.855 7.145 1.00 . A A . 17 CYS C 1 1 8 3484 1 1 17 CYS CA C 3.638 5.674 6.125 1.00 . A A . 17 CYS CA 1 1 8 3485 1 1 17 CYS CB C 3.723 6.879 5.179 1.00 . A A . 17 CYS CB 1 1 8 3486 1 1 17 CYS H H 2.991 4.636 4.345 1.00 . A A . 17 CYS H 1 1 8 3487 1 1 17 CYS HA H 4.575 5.544 6.634 1.00 . A A . 17 CYS HA 1 1 8 3488 1 1 17 CYS HB2 H 3.825 6.533 4.162 1.00 . A A . 17 CYS HB2 1 1 8 3489 1 1 17 CYS HB3 H 2.825 7.472 5.267 1.00 . A A . 17 CYS HB3 1 1 8 3490 1 1 17 CYS N N 3.358 4.498 5.243 1.00 . A A . 17 CYS N 1 1 8 3491 1 1 17 CYS O O 2.687 5.622 8.326 1.00 . A A . 17 CYS O 1 1 8 3492 1 1 17 CYS SG S 5.158 7.892 5.617 1.00 . A A . 17 CYS SG 1 1 8 3493 1 1 18 SER C C -1.112 6.602 6.852 1.00 . A A . 18 SER C 1 1 8 3494 1 1 18 SER CA C 0.200 6.464 7.636 1.00 . A A . 18 SER CA 1 1 8 3495 1 1 18 SER CB C 0.516 7.762 8.384 1.00 . A A . 18 SER CB 1 1 8 3496 1 1 18 SER H H 1.233 6.446 5.744 1.00 . A A . 18 SER H 1 1 8 3497 1 1 18 SER HA H 0.137 5.643 8.333 1.00 . A A . 18 SER HA 1 1 8 3498 1 1 18 SER HB2 H 1.326 8.275 7.896 1.00 . A A . 18 SER HB2 1 1 8 3499 1 1 18 SER HB3 H -0.360 8.398 8.386 1.00 . A A . 18 SER HB3 1 1 8 3500 1 1 18 SER HG H 0.113 7.520 10.273 1.00 . A A . 18 SER HG 1 1 8 3501 1 1 18 SER N N 1.348 6.266 6.698 1.00 . A A . 18 SER N 1 1 8 3502 1 1 18 SER O O -1.240 7.446 5.984 1.00 . A A . 18 SER O 1 1 8 3503 1 1 18 SER OG O 0.895 7.452 9.718 1.00 . A A . 18 SER OG 1 1 8 3504 1 1 19 GLY C C -3.245 5.280 5.014 1.00 . A A . 19 GLY C 1 1 8 3505 1 1 19 GLY CA C -3.391 5.849 6.430 1.00 . A A . 19 GLY CA 1 1 8 3506 1 1 19 GLY H H -1.954 5.105 7.856 1.00 . A A . 19 GLY H 1 1 8 3507 1 1 19 GLY HA2 H -4.132 5.278 6.972 1.00 . A A . 19 GLY HA2 1 1 8 3508 1 1 19 GLY HA3 H -3.709 6.878 6.367 1.00 . A A . 19 GLY HA3 1 1 8 3509 1 1 19 GLY N N -2.084 5.776 7.152 1.00 . A A . 19 GLY N 1 1 8 3510 1 1 19 GLY O O -3.930 5.700 4.101 1.00 . A A . 19 GLY O 1 1 8 3511 1 1 20 TYR C C -2.237 2.207 3.534 1.00 . A A . 20 TYR C 1 1 8 3512 1 1 20 TYR CA C -2.182 3.735 3.464 1.00 . A A . 20 TYR CA 1 1 8 3513 1 1 20 TYR CB C -0.799 4.196 2.992 1.00 . A A . 20 TYR CB 1 1 8 3514 1 1 20 TYR CD1 C -1.818 6.247 1.925 1.00 . A A . 20 TYR CD1 1 1 8 3515 1 1 20 TYR CD2 C 0.184 6.501 3.270 1.00 . A A . 20 TYR CD2 1 1 8 3516 1 1 20 TYR CE1 C -1.827 7.625 1.678 1.00 . A A . 20 TYR CE1 1 1 8 3517 1 1 20 TYR CE2 C 0.174 7.879 3.022 1.00 . A A . 20 TYR CE2 1 1 8 3518 1 1 20 TYR CG C -0.812 5.684 2.722 1.00 . A A . 20 TYR CG 1 1 8 3519 1 1 20 TYR CZ C -0.831 8.441 2.226 1.00 . A A . 20 TYR CZ 1 1 8 3520 1 1 20 TYR H H -1.822 4.001 5.574 1.00 . A A . 20 TYR H 1 1 8 3521 1 1 20 TYR HA H -2.939 4.105 2.791 1.00 . A A . 20 TYR HA 1 1 8 3522 1 1 20 TYR HB2 H -0.068 3.974 3.755 1.00 . A A . 20 TYR HB2 1 1 8 3523 1 1 20 TYR HB3 H -0.539 3.672 2.084 1.00 . A A . 20 TYR HB3 1 1 8 3524 1 1 20 TYR HD1 H -2.587 5.619 1.502 1.00 . A A . 20 TYR HD1 1 1 8 3525 1 1 20 TYR HD2 H 0.960 6.069 3.884 1.00 . A A . 20 TYR HD2 1 1 8 3526 1 1 20 TYR HE1 H -2.603 8.058 1.064 1.00 . A A . 20 TYR HE1 1 1 8 3527 1 1 20 TYR HE2 H 0.943 8.509 3.444 1.00 . A A . 20 TYR HE2 1 1 8 3528 1 1 20 TYR HH H -0.269 9.967 1.227 1.00 . A A . 20 TYR HH 1 1 8 3529 1 1 20 TYR N N -2.363 4.327 4.823 1.00 . A A . 20 TYR N 1 1 8 3530 1 1 20 TYR O O -1.588 1.588 4.358 1.00 . A A . 20 TYR O 1 1 8 3531 1 1 20 TYR OH O -0.838 9.799 1.981 1.00 . A A . 20 TYR OH 1 1 8 3532 1 1 21 ASN C C -2.159 -0.471 1.596 1.00 . A A . 21 ASN C 1 1 8 3533 1 1 21 ASN CA C -3.096 0.108 2.659 1.00 . A A . 21 ASN CA 1 1 8 3534 1 1 21 ASN CB C -4.559 -0.197 2.320 1.00 . A A . 21 ASN CB 1 1 8 3535 1 1 21 ASN CG C -4.752 -1.710 2.193 1.00 . A A . 21 ASN CG 1 1 8 3536 1 1 21 ASN H H -3.503 2.120 2.007 1.00 . A A . 21 ASN H 1 1 8 3537 1 1 21 ASN HA H -2.847 -0.287 3.627 1.00 . A A . 21 ASN HA 1 1 8 3538 1 1 21 ASN HB2 H -5.197 0.184 3.103 1.00 . A A . 21 ASN HB2 1 1 8 3539 1 1 21 ASN HB3 H -4.816 0.276 1.384 1.00 . A A . 21 ASN HB3 1 1 8 3540 1 1 21 ASN HD21 H -4.675 -1.697 0.207 1.00 . A A . 21 ASN HD21 1 1 8 3541 1 1 21 ASN HD22 H -4.899 -3.223 0.915 1.00 . A A . 21 ASN HD22 1 1 8 3542 1 1 21 ASN N N -2.999 1.596 2.664 1.00 . A A . 21 ASN N 1 1 8 3543 1 1 21 ASN ND2 N -4.778 -2.256 1.006 1.00 . A A . 21 ASN ND2 1 1 8 3544 1 1 21 ASN O O -2.029 0.067 0.516 1.00 . A A . 21 ASN O 1 1 8 3545 1 1 21 ASN OD1 O -4.878 -2.403 3.182 1.00 . A A . 21 ASN OD1 1 1 8 3546 1 1 22 CYS C C -1.293 -3.163 0.003 1.00 . A A . 22 CYS C 1 1 8 3547 1 1 22 CYS CA C -0.563 -2.170 0.915 1.00 . A A . 22 CYS CA 1 1 8 3548 1 1 22 CYS CB C 0.482 -2.888 1.770 1.00 . A A . 22 CYS CB 1 1 8 3549 1 1 22 CYS H H -1.626 -1.972 2.781 1.00 . A A . 22 CYS H 1 1 8 3550 1 1 22 CYS HA H -0.085 -1.402 0.329 1.00 . A A . 22 CYS HA 1 1 8 3551 1 1 22 CYS HB2 H 1.009 -2.165 2.376 1.00 . A A . 22 CYS HB2 1 1 8 3552 1 1 22 CYS HB3 H -0.008 -3.606 2.409 1.00 . A A . 22 CYS HB3 1 1 8 3553 1 1 22 CYS N N -1.504 -1.560 1.900 1.00 . A A . 22 CYS N 1 1 8 3554 1 1 22 CYS O O -2.042 -4.007 0.457 1.00 . A A . 22 CYS O 1 1 8 3555 1 1 22 CYS SG S 1.659 -3.741 0.696 1.00 . A A . 22 CYS SG 1 1 8 3556 1 1 23 SER C C -0.706 -5.001 -2.790 1.00 . A A . 23 SER C 1 1 8 3557 1 1 23 SER CA C -1.731 -3.994 -2.248 1.00 . A A . 23 SER CA 1 1 8 3558 1 1 23 SER CB C -2.245 -3.097 -3.377 1.00 . A A . 23 SER CB 1 1 8 3559 1 1 23 SER H H -0.455 -2.374 -1.621 1.00 . A A . 23 SER H 1 1 8 3560 1 1 23 SER HA H -2.556 -4.504 -1.776 1.00 . A A . 23 SER HA 1 1 8 3561 1 1 23 SER HB2 H -1.767 -2.133 -3.323 1.00 . A A . 23 SER HB2 1 1 8 3562 1 1 23 SER HB3 H -2.015 -3.555 -4.330 1.00 . A A . 23 SER HB3 1 1 8 3563 1 1 23 SER HG H -3.935 -2.293 -3.909 1.00 . A A . 23 SER HG 1 1 8 3564 1 1 23 SER N N -1.068 -3.063 -1.286 1.00 . A A . 23 SER N 1 1 8 3565 1 1 23 SER O O 0.275 -4.613 -3.395 1.00 . A A . 23 SER O 1 1 8 3566 1 1 23 SER OG O -3.650 -2.928 -3.246 1.00 . A A . 23 SER OG 1 1 8 3567 1 1 24 PRO C C -0.149 -7.519 -4.548 1.00 . A A . 24 PRO C 1 1 8 3568 1 1 24 PRO CA C -0.046 -7.338 -3.025 1.00 . A A . 24 PRO CA 1 1 8 3569 1 1 24 PRO CB C -0.540 -8.583 -2.293 1.00 . A A . 24 PRO CB 1 1 8 3570 1 1 24 PRO CD C -2.122 -6.816 -1.831 1.00 . A A . 24 PRO CD 1 1 8 3571 1 1 24 PRO CG C -1.978 -8.309 -1.986 1.00 . A A . 24 PRO CG 1 1 8 3572 1 1 24 PRO HA H 0.968 -7.120 -2.738 1.00 . A A . 24 PRO HA 1 1 8 3573 1 1 24 PRO HB2 H -0.448 -9.454 -2.928 1.00 . A A . 24 PRO HB2 1 1 8 3574 1 1 24 PRO HB3 H 0.011 -8.726 -1.376 1.00 . A A . 24 PRO HB3 1 1 8 3575 1 1 24 PRO HD2 H -3.047 -6.480 -2.280 1.00 . A A . 24 PRO HD2 1 1 8 3576 1 1 24 PRO HD3 H -2.079 -6.536 -0.791 1.00 . A A . 24 PRO HD3 1 1 8 3577 1 1 24 PRO HG2 H -2.601 -8.660 -2.797 1.00 . A A . 24 PRO HG2 1 1 8 3578 1 1 24 PRO HG3 H -2.260 -8.797 -1.066 1.00 . A A . 24 PRO HG3 1 1 8 3579 1 1 24 PRO N N -0.965 -6.266 -2.553 1.00 . A A . 24 PRO N 1 1 8 3580 1 1 24 PRO O O 0.813 -7.876 -5.202 1.00 . A A . 24 PRO O 1 1 8 3581 1 1 25 THR C C -0.903 -6.212 -7.334 1.00 . A A . 25 THR C 1 1 8 3582 1 1 25 THR CA C -1.481 -7.427 -6.591 1.00 . A A . 25 THR CA 1 1 8 3583 1 1 25 THR CB C -2.997 -7.511 -6.812 1.00 . A A . 25 THR CB 1 1 8 3584 1 1 25 THR CG2 C -3.298 -7.652 -8.307 1.00 . A A . 25 THR CG2 1 1 8 3585 1 1 25 THR H H -2.064 -6.986 -4.560 1.00 . A A . 25 THR H 1 1 8 3586 1 1 25 THR HA H -1.009 -8.334 -6.932 1.00 . A A . 25 THR HA 1 1 8 3587 1 1 25 THR HB H -3.463 -6.612 -6.440 1.00 . A A . 25 THR HB 1 1 8 3588 1 1 25 THR HG1 H -4.233 -8.330 -5.554 1.00 . A A . 25 THR HG1 1 1 8 3589 1 1 25 THR HG21 H -4.319 -7.978 -8.439 1.00 . A A . 25 THR HG21 1 1 8 3590 1 1 25 THR HG22 H -2.629 -8.379 -8.743 1.00 . A A . 25 THR HG22 1 1 8 3591 1 1 25 THR HG23 H -3.158 -6.698 -8.794 1.00 . A A . 25 THR HG23 1 1 8 3592 1 1 25 THR N N -1.307 -7.273 -5.111 1.00 . A A . 25 THR N 1 1 8 3593 1 1 25 THR O O -0.476 -6.319 -8.466 1.00 . A A . 25 THR O 1 1 8 3594 1 1 25 THR OG1 O -3.516 -8.635 -6.115 1.00 . A A . 25 THR OG1 1 1 8 3595 1 1 26 TRP C C 1.099 -3.576 -6.976 1.00 . A A . 26 TRP C 1 1 8 3596 1 1 26 TRP CA C -0.363 -3.837 -7.382 1.00 . A A . 26 TRP CA 1 1 8 3597 1 1 26 TRP CB C -1.270 -2.696 -6.911 1.00 . A A . 26 TRP CB 1 1 8 3598 1 1 26 TRP CD1 C -3.561 -3.688 -6.468 1.00 . A A . 26 TRP CD1 1 1 8 3599 1 1 26 TRP CD2 C -3.432 -2.679 -8.475 1.00 . A A . 26 TRP CD2 1 1 8 3600 1 1 26 TRP CE2 C -4.748 -3.183 -8.355 1.00 . A A . 26 TRP CE2 1 1 8 3601 1 1 26 TRP CE3 C -3.090 -1.995 -9.655 1.00 . A A . 26 TRP CE3 1 1 8 3602 1 1 26 TRP CG C -2.696 -3.010 -7.261 1.00 . A A . 26 TRP CG 1 1 8 3603 1 1 26 TRP CH2 C -5.334 -2.334 -10.537 1.00 . A A . 26 TRP CH2 1 1 8 3604 1 1 26 TRP CZ2 C -5.691 -3.018 -9.372 1.00 . A A . 26 TRP CZ2 1 1 8 3605 1 1 26 TRP CZ3 C -4.036 -1.826 -10.679 1.00 . A A . 26 TRP CZ3 1 1 8 3606 1 1 26 TRP H H -1.256 -5.001 -5.796 1.00 . A A . 26 TRP H 1 1 8 3607 1 1 26 TRP HA H -0.436 -3.941 -8.453 1.00 . A A . 26 TRP HA 1 1 8 3608 1 1 26 TRP HB2 H -1.178 -2.579 -5.841 1.00 . A A . 26 TRP HB2 1 1 8 3609 1 1 26 TRP HB3 H -0.975 -1.780 -7.399 1.00 . A A . 26 TRP HB3 1 1 8 3610 1 1 26 TRP HD1 H -3.336 -4.085 -5.490 1.00 . A A . 26 TRP HD1 1 1 8 3611 1 1 26 TRP HE1 H -5.573 -4.237 -6.758 1.00 . A A . 26 TRP HE1 1 1 8 3612 1 1 26 TRP HE3 H -2.093 -1.600 -9.775 1.00 . A A . 26 TRP HE3 1 1 8 3613 1 1 26 TRP HH2 H -6.056 -2.201 -11.327 1.00 . A A . 26 TRP HH2 1 1 8 3614 1 1 26 TRP HZ2 H -6.690 -3.412 -9.256 1.00 . A A . 26 TRP HZ2 1 1 8 3615 1 1 26 TRP HZ3 H -3.762 -1.298 -11.581 1.00 . A A . 26 TRP HZ3 1 1 8 3616 1 1 26 TRP N N -0.899 -5.063 -6.708 1.00 . A A . 26 TRP N 1 1 8 3617 1 1 26 TRP NE1 N -4.776 -3.791 -7.117 1.00 . A A . 26 TRP NE1 1 1 8 3618 1 1 26 TRP O O 1.782 -2.781 -7.591 1.00 . A A . 26 TRP O 1 1 8 3619 1 1 27 LYS C C 3.259 -2.632 -4.983 1.00 . A A . 27 LYS C 1 1 8 3620 1 1 27 LYS CA C 3.000 -4.061 -5.498 1.00 . A A . 27 LYS CA 1 1 8 3621 1 1 27 LYS CB C 3.876 -4.375 -6.719 1.00 . A A . 27 LYS CB 1 1 8 3622 1 1 27 LYS CD C 4.154 -6.816 -6.225 1.00 . A A . 27 LYS CD 1 1 8 3623 1 1 27 LYS CE C 4.958 -7.744 -5.311 1.00 . A A . 27 LYS CE 1 1 8 3624 1 1 27 LYS CG C 4.882 -5.474 -6.358 1.00 . A A . 27 LYS CG 1 1 8 3625 1 1 27 LYS H H 1.011 -4.886 -5.481 1.00 . A A . 27 LYS H 1 1 8 3626 1 1 27 LYS HA H 3.220 -4.769 -4.713 1.00 . A A . 27 LYS HA 1 1 8 3627 1 1 27 LYS HB2 H 3.253 -4.712 -7.535 1.00 . A A . 27 LYS HB2 1 1 8 3628 1 1 27 LYS HB3 H 4.412 -3.488 -7.019 1.00 . A A . 27 LYS HB3 1 1 8 3629 1 1 27 LYS HD2 H 3.173 -6.653 -5.802 1.00 . A A . 27 LYS HD2 1 1 8 3630 1 1 27 LYS HD3 H 4.056 -7.270 -7.200 1.00 . A A . 27 LYS HD3 1 1 8 3631 1 1 27 LYS HE2 H 5.981 -7.816 -5.655 1.00 . A A . 27 LYS HE2 1 1 8 3632 1 1 27 LYS HE3 H 4.926 -7.389 -4.293 1.00 . A A . 27 LYS HE3 1 1 8 3633 1 1 27 LYS HG2 H 5.630 -5.546 -7.134 1.00 . A A . 27 LYS HG2 1 1 8 3634 1 1 27 LYS HG3 H 5.359 -5.232 -5.420 1.00 . A A . 27 LYS HG3 1 1 8 3635 1 1 27 LYS HZ1 H 3.277 -8.966 -5.155 1.00 . A A . 27 LYS HZ1 1 1 8 3636 1 1 27 LYS HZ2 H 4.737 -9.741 -4.762 1.00 . A A . 27 LYS HZ2 1 1 8 3637 1 1 27 LYS HZ3 H 4.351 -9.422 -6.387 1.00 . A A . 27 LYS HZ3 1 1 8 3638 1 1 27 LYS N N 1.582 -4.246 -5.954 1.00 . A A . 27 LYS N 1 1 8 3639 1 1 27 LYS NZ N 4.280 -9.068 -5.412 1.00 . A A . 27 LYS NZ 1 1 8 3640 1 1 27 LYS O O 4.379 -2.157 -5.009 1.00 . A A . 27 LYS O 1 1 8 3641 1 1 28 TRP C C 1.338 -0.249 -2.925 1.00 . A A . 28 TRP C 1 1 8 3642 1 1 28 TRP CA C 2.462 -0.586 -3.916 1.00 . A A . 28 TRP CA 1 1 8 3643 1 1 28 TRP CB C 2.497 0.398 -5.108 1.00 . A A . 28 TRP CB 1 1 8 3644 1 1 28 TRP CD1 C 0.009 0.920 -5.223 1.00 . A A . 28 TRP CD1 1 1 8 3645 1 1 28 TRP CD2 C 0.879 0.344 -7.213 1.00 . A A . 28 TRP CD2 1 1 8 3646 1 1 28 TRP CE2 C -0.492 0.601 -7.432 1.00 . A A . 28 TRP CE2 1 1 8 3647 1 1 28 TRP CE3 C 1.666 -0.036 -8.312 1.00 . A A . 28 TRP CE3 1 1 8 3648 1 1 28 TRP CG C 1.171 0.533 -5.800 1.00 . A A . 28 TRP CG 1 1 8 3649 1 1 28 TRP CH2 C -0.266 0.111 -9.783 1.00 . A A . 28 TRP CH2 1 1 8 3650 1 1 28 TRP CZ2 C -1.064 0.489 -8.699 1.00 . A A . 28 TRP CZ2 1 1 8 3651 1 1 28 TRP CZ3 C 1.097 -0.150 -9.590 1.00 . A A . 28 TRP CZ3 1 1 8 3652 1 1 28 TRP H H 1.361 -2.371 -4.434 1.00 . A A . 28 TRP H 1 1 8 3653 1 1 28 TRP HA H 3.418 -0.555 -3.403 1.00 . A A . 28 TRP HA 1 1 8 3654 1 1 28 TRP HB2 H 2.792 1.369 -4.746 1.00 . A A . 28 TRP HB2 1 1 8 3655 1 1 28 TRP HB3 H 3.232 0.055 -5.822 1.00 . A A . 28 TRP HB3 1 1 8 3656 1 1 28 TRP HD1 H -0.128 1.156 -4.179 1.00 . A A . 28 TRP HD1 1 1 8 3657 1 1 28 TRP HE1 H -1.919 1.181 -6.033 1.00 . A A . 28 TRP HE1 1 1 8 3658 1 1 28 TRP HE3 H 2.717 -0.236 -8.172 1.00 . A A . 28 TRP HE3 1 1 8 3659 1 1 28 TRP HH2 H -0.699 0.024 -10.768 1.00 . A A . 28 TRP HH2 1 1 8 3660 1 1 28 TRP HZ2 H -2.114 0.692 -8.842 1.00 . A A . 28 TRP HZ2 1 1 8 3661 1 1 28 TRP HZ3 H 1.712 -0.440 -10.428 1.00 . A A . 28 TRP HZ3 1 1 8 3662 1 1 28 TRP N N 2.250 -1.960 -4.478 1.00 . A A . 28 TRP N 1 1 8 3663 1 1 28 TRP NE1 N -0.982 0.947 -6.190 1.00 . A A . 28 TRP NE1 1 1 8 3664 1 1 28 TRP O O 0.227 -0.735 -3.043 1.00 . A A . 28 TRP O 1 1 8 3665 1 1 29 CYS C C -0.317 2.044 -1.478 1.00 . A A . 29 CYS C 1 1 8 3666 1 1 29 CYS CA C 0.571 0.923 -0.934 1.00 . A A . 29 CYS CA 1 1 8 3667 1 1 29 CYS CB C 1.341 1.395 0.303 1.00 . A A . 29 CYS CB 1 1 8 3668 1 1 29 CYS H H 2.526 0.932 -1.850 1.00 . A A . 29 CYS H 1 1 8 3669 1 1 29 CYS HA H -0.023 0.059 -0.691 1.00 . A A . 29 CYS HA 1 1 8 3670 1 1 29 CYS HB2 H 2.177 0.737 0.478 1.00 . A A . 29 CYS HB2 1 1 8 3671 1 1 29 CYS HB3 H 1.698 2.399 0.143 1.00 . A A . 29 CYS HB3 1 1 8 3672 1 1 29 CYS N N 1.622 0.564 -1.938 1.00 . A A . 29 CYS N 1 1 8 3673 1 1 29 CYS O O 0.134 2.901 -2.204 1.00 . A A . 29 CYS O 1 1 8 3674 1 1 29 CYS SG S 0.256 1.368 1.747 1.00 . A A . 29 CYS SG 1 1 8 3675 1 1 30 VAL C C -3.278 3.679 -0.413 1.00 . A A . 30 VAL C 1 1 8 3676 1 1 30 VAL CA C -2.513 3.100 -1.603 1.00 . A A . 30 VAL CA 1 1 8 3677 1 1 30 VAL CB C -3.479 2.397 -2.574 1.00 . A A . 30 VAL CB 1 1 8 3678 1 1 30 VAL CG1 C -2.698 1.821 -3.756 1.00 . A A . 30 VAL CG1 1 1 8 3679 1 1 30 VAL CG2 C -4.220 1.263 -1.853 1.00 . A A . 30 VAL CG2 1 1 8 3680 1 1 30 VAL H H -1.905 1.333 -0.529 1.00 . A A . 30 VAL H 1 1 8 3681 1 1 30 VAL HA H -1.976 3.879 -2.116 1.00 . A A . 30 VAL HA 1 1 8 3682 1 1 30 VAL HB H -4.196 3.116 -2.943 1.00 . A A . 30 VAL HB 1 1 8 3683 1 1 30 VAL HG11 H -2.050 2.582 -4.166 1.00 . A A . 30 VAL HG11 1 1 8 3684 1 1 30 VAL HG12 H -3.391 1.491 -4.517 1.00 . A A . 30 VAL HG12 1 1 8 3685 1 1 30 VAL HG13 H -2.105 0.983 -3.422 1.00 . A A . 30 VAL HG13 1 1 8 3686 1 1 30 VAL HG21 H -5.281 1.355 -2.036 1.00 . A A . 30 VAL HG21 1 1 8 3687 1 1 30 VAL HG22 H -4.031 1.325 -0.792 1.00 . A A . 30 VAL HG22 1 1 8 3688 1 1 30 VAL HG23 H -3.872 0.311 -2.226 1.00 . A A . 30 VAL HG23 1 1 8 3689 1 1 30 VAL N N -1.575 2.037 -1.123 1.00 . A A . 30 VAL N 1 1 8 3690 1 1 30 VAL O O -2.937 3.432 0.724 1.00 . A A . 30 VAL O 1 1 8 3691 1 1 31 TYR C C -5.808 3.897 1.239 1.00 . A A . 31 TYR C 1 1 8 3692 1 1 31 TYR CA C -5.101 5.019 0.466 1.00 . A A . 31 TYR CA 1 1 8 3693 1 1 31 TYR CB C -6.124 5.949 -0.193 1.00 . A A . 31 TYR CB 1 1 8 3694 1 1 31 TYR CD1 C -7.541 6.807 1.707 1.00 . A A . 31 TYR CD1 1 1 8 3695 1 1 31 TYR CD2 C -5.864 8.274 0.752 1.00 . A A . 31 TYR CD2 1 1 8 3696 1 1 31 TYR CE1 C -7.908 7.813 2.607 1.00 . A A . 31 TYR CE1 1 1 8 3697 1 1 31 TYR CE2 C -6.231 9.280 1.652 1.00 . A A . 31 TYR CE2 1 1 8 3698 1 1 31 TYR CG C -6.519 7.036 0.779 1.00 . A A . 31 TYR CG 1 1 8 3699 1 1 31 TYR CZ C -7.254 9.050 2.580 1.00 . A A . 31 TYR CZ 1 1 8 3700 1 1 31 TYR H H -4.571 4.620 -1.589 1.00 . A A . 31 TYR H 1 1 8 3701 1 1 31 TYR HA H -4.460 5.584 1.123 1.00 . A A . 31 TYR HA 1 1 8 3702 1 1 31 TYR HB2 H -5.687 6.395 -1.075 1.00 . A A . 31 TYR HB2 1 1 8 3703 1 1 31 TYR HB3 H -6.999 5.382 -0.473 1.00 . A A . 31 TYR HB3 1 1 8 3704 1 1 31 TYR HD1 H -8.047 5.852 1.728 1.00 . A A . 31 TYR HD1 1 1 8 3705 1 1 31 TYR HD2 H -5.074 8.452 0.037 1.00 . A A . 31 TYR HD2 1 1 8 3706 1 1 31 TYR HE1 H -8.697 7.634 3.324 1.00 . A A . 31 TYR HE1 1 1 8 3707 1 1 31 TYR HE2 H -5.726 10.235 1.632 1.00 . A A . 31 TYR HE2 1 1 8 3708 1 1 31 TYR HH H -8.350 10.530 3.081 1.00 . A A . 31 TYR HH 1 1 8 3709 1 1 31 TYR N N -4.312 4.439 -0.663 1.00 . A A . 31 TYR N 1 1 8 3710 1 1 31 TYR O O -6.129 2.861 0.688 1.00 . A A . 31 TYR O 1 1 8 3711 1 1 31 TYR OH O -7.618 10.041 3.467 1.00 . A A . 31 TYR OH 1 1 8 3712 1 1 32 ALA C C -8.248 3.218 3.262 1.00 . A A . 32 ALA C 1 1 8 3713 1 1 32 ALA CA C -6.728 3.033 3.317 1.00 . A A . 32 ALA CA 1 1 8 3714 1 1 32 ALA CB C -6.214 3.222 4.746 1.00 . A A . 32 ALA CB 1 1 8 3715 1 1 32 ALA H H -5.777 4.935 2.937 1.00 . A A . 32 ALA H 1 1 8 3716 1 1 32 ALA HA H -6.455 2.054 2.956 1.00 . A A . 32 ALA HA 1 1 8 3717 1 1 32 ALA HB1 H -6.844 2.673 5.430 1.00 . A A . 32 ALA HB1 1 1 8 3718 1 1 32 ALA HB2 H -6.235 4.272 5.001 1.00 . A A . 32 ALA HB2 1 1 8 3719 1 1 32 ALA HB3 H -5.201 2.855 4.818 1.00 . A A . 32 ALA HB3 1 1 8 3720 1 1 32 ALA N N -6.047 4.093 2.512 1.00 . A A . 32 ALA N 1 1 8 3721 1 1 32 ALA O O -8.772 4.244 3.655 1.00 . A A . 32 ALA O 1 1 8 3722 1 1 33 ARG C C -11.100 1.116 3.356 1.00 . A A . 33 ARG C 1 1 8 3723 1 1 33 ARG CA C -10.445 2.334 2.688 1.00 . A A . 33 ARG CA 1 1 8 3724 1 1 33 ARG CB C -10.757 2.364 1.187 1.00 . A A . 33 ARG CB 1 1 8 3725 1 1 33 ARG CD C -10.574 4.635 0.160 1.00 . A A . 33 ARG CD 1 1 8 3726 1 1 33 ARG CG C -11.519 3.646 0.847 1.00 . A A . 33 ARG CG 1 1 8 3727 1 1 33 ARG CZ C -10.878 6.946 0.824 1.00 . A A . 33 ARG CZ 1 1 8 3728 1 1 33 ARG H H -8.506 1.415 2.464 1.00 . A A . 33 ARG H 1 1 8 3729 1 1 33 ARG HA H -10.784 3.246 3.152 1.00 . A A . 33 ARG HA 1 1 8 3730 1 1 33 ARG HB2 H -9.834 2.333 0.626 1.00 . A A . 33 ARG HB2 1 1 8 3731 1 1 33 ARG HB3 H -11.364 1.509 0.928 1.00 . A A . 33 ARG HB3 1 1 8 3732 1 1 33 ARG HD2 H -9.658 4.733 0.726 1.00 . A A . 33 ARG HD2 1 1 8 3733 1 1 33 ARG HD3 H -10.362 4.313 -0.849 1.00 . A A . 33 ARG HD3 1 1 8 3734 1 1 33 ARG HE H -12.138 6.008 -0.393 1.00 . A A . 33 ARG HE 1 1 8 3735 1 1 33 ARG HG2 H -12.340 3.412 0.185 1.00 . A A . 33 ARG HG2 1 1 8 3736 1 1 33 ARG HG3 H -11.902 4.090 1.754 1.00 . A A . 33 ARG HG3 1 1 8 3737 1 1 33 ARG HH11 H -11.420 6.182 2.596 1.00 . A A . 33 ARG HH11 1 1 8 3738 1 1 33 ARG HH12 H -10.661 7.737 2.654 1.00 . A A . 33 ARG HH12 1 1 8 3739 1 1 33 ARG HH21 H -10.234 7.948 -0.789 1.00 . A A . 33 ARG HH21 1 1 8 3740 1 1 33 ARG HH22 H -9.986 8.740 0.731 1.00 . A A . 33 ARG HH22 1 1 8 3741 1 1 33 ARG N N -8.956 2.229 2.775 1.00 . A A . 33 ARG N 1 1 8 3742 1 1 33 ARG NE N -11.317 5.925 0.137 1.00 . A A . 33 ARG NE 1 1 8 3743 1 1 33 ARG NH1 N -10.995 6.955 2.127 1.00 . A A . 33 ARG NH1 1 1 8 3744 1 1 33 ARG NH2 N -10.323 7.957 0.207 1.00 . A A . 33 ARG NH2 1 1 8 3745 1 1 33 ARG O O -11.311 0.100 2.720 1.00 . A A . 33 ARG O 1 1 8 3746 1 1 34 PRO C C -13.501 -0.027 4.946 1.00 . A A . 34 PRO C 1 1 8 3747 1 1 34 PRO CA C -12.041 0.152 5.386 1.00 . A A . 34 PRO CA 1 1 8 3748 1 1 34 PRO CB C -11.952 0.617 6.840 1.00 . A A . 34 PRO CB 1 1 8 3749 1 1 34 PRO CD C -11.177 2.444 5.465 1.00 . A A . 34 PRO CD 1 1 8 3750 1 1 34 PRO CG C -11.860 2.108 6.766 1.00 . A A . 34 PRO CG 1 1 8 3751 1 1 34 PRO HA H -11.489 -0.765 5.258 1.00 . A A . 34 PRO HA 1 1 8 3752 1 1 34 PRO HB2 H -12.837 0.318 7.384 1.00 . A A . 34 PRO HB2 1 1 8 3753 1 1 34 PRO HB3 H -11.067 0.216 7.310 1.00 . A A . 34 PRO HB3 1 1 8 3754 1 1 34 PRO HD2 H -11.627 3.320 5.018 1.00 . A A . 34 PRO HD2 1 1 8 3755 1 1 34 PRO HD3 H -10.120 2.594 5.620 1.00 . A A . 34 PRO HD3 1 1 8 3756 1 1 34 PRO HG2 H -12.852 2.538 6.789 1.00 . A A . 34 PRO HG2 1 1 8 3757 1 1 34 PRO HG3 H -11.276 2.483 7.591 1.00 . A A . 34 PRO HG3 1 1 8 3758 1 1 34 PRO N N -11.401 1.259 4.627 1.00 . A A . 34 PRO N 1 1 8 3759 1 1 34 PRO O O -13.821 -1.102 4.463 1.00 . A A . 34 PRO O 1 1 8 3760 1 1 34 PRO OXT O -14.270 0.912 5.093 1.00 . A A . 34 PRO OXT 1 1 9 3761 1 1 1 GLY C C 8.687 5.737 6.180 1.00 . A A . 1 GLY C 1 1 9 3762 1 1 1 GLY CA C 10.086 6.068 6.713 1.00 . A A . 1 GLY CA 1 1 9 3763 1 1 1 GLY H1 H 11.081 6.066 8.542 1.00 . A A . 1 GLY H1 1 1 9 3764 1 1 1 GLY H2 H 9.909 4.844 8.390 1.00 . A A . 1 GLY H2 1 1 9 3765 1 1 1 GLY H3 H 9.434 6.455 8.653 1.00 . A A . 1 GLY H3 1 1 9 3766 1 1 1 GLY HA2 H 10.316 7.103 6.503 1.00 . A A . 1 GLY HA2 1 1 9 3767 1 1 1 GLY HA3 H 10.811 5.432 6.228 1.00 . A A . 1 GLY HA3 1 1 9 3768 1 1 1 GLY N N 10.131 5.841 8.185 1.00 . A A . 1 GLY N 1 1 9 3769 1 1 1 GLY O O 8.260 4.597 6.202 1.00 . A A . 1 GLY O 1 1 9 3770 1 1 2 CYS C C 6.678 6.051 3.688 1.00 . A A . 2 CYS C 1 1 9 3771 1 1 2 CYS CA C 6.601 6.477 5.160 1.00 . A A . 2 CYS CA 1 1 9 3772 1 1 2 CYS CB C 5.869 7.816 5.291 1.00 . A A . 2 CYS CB 1 1 9 3773 1 1 2 CYS H H 8.345 7.635 5.691 1.00 . A A . 2 CYS H 1 1 9 3774 1 1 2 CYS HA H 6.098 5.723 5.745 1.00 . A A . 2 CYS HA 1 1 9 3775 1 1 2 CYS HB2 H 6.554 8.623 5.081 1.00 . A A . 2 CYS HB2 1 1 9 3776 1 1 2 CYS HB3 H 5.049 7.848 4.589 1.00 . A A . 2 CYS HB3 1 1 9 3777 1 1 2 CYS N N 7.975 6.726 5.699 1.00 . A A . 2 CYS N 1 1 9 3778 1 1 2 CYS O O 7.508 6.532 2.939 1.00 . A A . 2 CYS O 1 1 9 3779 1 1 2 CYS SG S 5.228 7.993 6.975 1.00 . A A . 2 CYS SG 1 1 9 3780 1 1 3 GLY C C 5.174 5.740 0.958 1.00 . A A . 3 GLY C 1 1 9 3781 1 1 3 GLY CA C 5.841 4.689 1.851 1.00 . A A . 3 GLY CA 1 1 9 3782 1 1 3 GLY H H 5.162 4.775 3.895 1.00 . A A . 3 GLY H 1 1 9 3783 1 1 3 GLY HA2 H 6.865 4.544 1.535 1.00 . A A . 3 GLY HA2 1 1 9 3784 1 1 3 GLY HA3 H 5.303 3.757 1.768 1.00 . A A . 3 GLY HA3 1 1 9 3785 1 1 3 GLY N N 5.820 5.150 3.272 1.00 . A A . 3 GLY N 1 1 9 3786 1 1 3 GLY O O 5.832 6.610 0.416 1.00 . A A . 3 GLY O 1 1 9 3787 1 1 4 GLY C C 1.931 6.008 -0.699 1.00 . A A . 4 GLY C 1 1 9 3788 1 1 4 GLY CA C 3.162 6.658 -0.059 1.00 . A A . 4 GLY CA 1 1 9 3789 1 1 4 GLY H H 3.369 4.954 1.248 1.00 . A A . 4 GLY H 1 1 9 3790 1 1 4 GLY HA2 H 2.851 7.497 0.547 1.00 . A A . 4 GLY HA2 1 1 9 3791 1 1 4 GLY HA3 H 3.826 7.002 -0.837 1.00 . A A . 4 GLY HA3 1 1 9 3792 1 1 4 GLY N N 3.875 5.665 0.801 1.00 . A A . 4 GLY N 1 1 9 3793 1 1 4 GLY O O 1.456 4.980 -0.252 1.00 . A A . 4 GLY O 1 1 9 3794 1 1 5 LEU C C 0.607 5.106 -3.585 1.00 . A A . 5 LEU C 1 1 9 3795 1 1 5 LEU CA C 0.207 6.033 -2.424 1.00 . A A . 5 LEU CA 1 1 9 3796 1 1 5 LEU CB C -0.564 7.244 -2.948 1.00 . A A . 5 LEU CB 1 1 9 3797 1 1 5 LEU CD1 C -2.691 8.314 -2.194 1.00 . A A . 5 LEU CD1 1 1 9 3798 1 1 5 LEU CD2 C -2.721 6.638 -4.054 1.00 . A A . 5 LEU CD2 1 1 9 3799 1 1 5 LEU CG C -2.062 7.025 -2.727 1.00 . A A . 5 LEU CG 1 1 9 3800 1 1 5 LEU H H 1.816 7.432 -2.083 1.00 . A A . 5 LEU H 1 1 9 3801 1 1 5 LEU HA H -0.401 5.495 -1.713 1.00 . A A . 5 LEU HA 1 1 9 3802 1 1 5 LEU HB2 H -0.245 8.130 -2.417 1.00 . A A . 5 LEU HB2 1 1 9 3803 1 1 5 LEU HB3 H -0.371 7.366 -4.003 1.00 . A A . 5 LEU HB3 1 1 9 3804 1 1 5 LEU HD11 H -2.456 8.422 -1.146 1.00 . A A . 5 LEU HD11 1 1 9 3805 1 1 5 LEU HD12 H -3.763 8.269 -2.320 1.00 . A A . 5 LEU HD12 1 1 9 3806 1 1 5 LEU HD13 H -2.300 9.159 -2.740 1.00 . A A . 5 LEU HD13 1 1 9 3807 1 1 5 LEU HD21 H -2.954 5.584 -4.045 1.00 . A A . 5 LEU HD21 1 1 9 3808 1 1 5 LEU HD22 H -2.042 6.849 -4.868 1.00 . A A . 5 LEU HD22 1 1 9 3809 1 1 5 LEU HD23 H -3.629 7.206 -4.187 1.00 . A A . 5 LEU HD23 1 1 9 3810 1 1 5 LEU HG H -2.206 6.233 -2.006 1.00 . A A . 5 LEU HG 1 1 9 3811 1 1 5 LEU N N 1.412 6.604 -1.745 1.00 . A A . 5 LEU N 1 1 9 3812 1 1 5 LEU O O -0.240 4.501 -4.218 1.00 . A A . 5 LEU O 1 1 9 3813 1 1 6 MET C C 3.729 3.523 -4.655 1.00 . A A . 6 MET C 1 1 9 3814 1 1 6 MET CA C 2.333 4.079 -4.971 1.00 . A A . 6 MET CA 1 1 9 3815 1 1 6 MET CB C 2.367 4.968 -6.219 1.00 . A A . 6 MET CB 1 1 9 3816 1 1 6 MET CE C 1.224 4.650 -9.951 1.00 . A A . 6 MET CE 1 1 9 3817 1 1 6 MET CG C 1.355 4.451 -7.245 1.00 . A A . 6 MET CG 1 1 9 3818 1 1 6 MET H H 2.549 5.465 -3.337 1.00 . A A . 6 MET H 1 1 9 3819 1 1 6 MET HA H 1.632 3.273 -5.110 1.00 . A A . 6 MET HA 1 1 9 3820 1 1 6 MET HB2 H 2.117 5.983 -5.946 1.00 . A A . 6 MET HB2 1 1 9 3821 1 1 6 MET HB3 H 3.357 4.946 -6.651 1.00 . A A . 6 MET HB3 1 1 9 3822 1 1 6 MET HE1 H 0.476 3.962 -10.320 1.00 . A A . 6 MET HE1 1 1 9 3823 1 1 6 MET HE2 H 1.851 4.968 -10.769 1.00 . A A . 6 MET HE2 1 1 9 3824 1 1 6 MET HE3 H 0.743 5.513 -9.513 1.00 . A A . 6 MET HE3 1 1 9 3825 1 1 6 MET HG2 H 0.771 3.656 -6.807 1.00 . A A . 6 MET HG2 1 1 9 3826 1 1 6 MET HG3 H 0.700 5.257 -7.541 1.00 . A A . 6 MET HG3 1 1 9 3827 1 1 6 MET N N 1.883 4.978 -3.863 1.00 . A A . 6 MET N 1 1 9 3828 1 1 6 MET O O 4.543 3.325 -5.537 1.00 . A A . 6 MET O 1 1 9 3829 1 1 6 MET SD S 2.235 3.824 -8.698 1.00 . A A . 6 MET SD 1 1 9 3830 1 1 7 ALA C C 5.377 1.209 -3.149 1.00 . A A . 7 ALA C 1 1 9 3831 1 1 7 ALA CA C 5.348 2.735 -3.009 1.00 . A A . 7 ALA CA 1 1 9 3832 1 1 7 ALA CB C 5.532 3.146 -1.544 1.00 . A A . 7 ALA CB 1 1 9 3833 1 1 7 ALA H H 3.329 3.445 -2.706 1.00 . A A . 7 ALA H 1 1 9 3834 1 1 7 ALA HA H 6.120 3.182 -3.614 1.00 . A A . 7 ALA HA 1 1 9 3835 1 1 7 ALA HB1 H 4.566 3.226 -1.066 1.00 . A A . 7 ALA HB1 1 1 9 3836 1 1 7 ALA HB2 H 6.035 4.101 -1.498 1.00 . A A . 7 ALA HB2 1 1 9 3837 1 1 7 ALA HB3 H 6.124 2.402 -1.033 1.00 . A A . 7 ALA HB3 1 1 9 3838 1 1 7 ALA N N 4.006 3.273 -3.397 1.00 . A A . 7 ALA N 1 1 9 3839 1 1 7 ALA O O 4.826 0.494 -2.332 1.00 . A A . 7 ALA O 1 1 9 3840 1 1 8 GLY C C 6.683 -1.427 -3.118 1.00 . A A . 8 GLY C 1 1 9 3841 1 1 8 GLY CA C 6.103 -0.774 -4.375 1.00 . A A . 8 GLY CA 1 1 9 3842 1 1 8 GLY H H 6.462 1.306 -4.817 1.00 . A A . 8 GLY H 1 1 9 3843 1 1 8 GLY HA2 H 5.114 -1.166 -4.564 1.00 . A A . 8 GLY HA2 1 1 9 3844 1 1 8 GLY HA3 H 6.743 -0.992 -5.217 1.00 . A A . 8 GLY HA3 1 1 9 3845 1 1 8 GLY N N 6.024 0.706 -4.177 1.00 . A A . 8 GLY N 1 1 9 3846 1 1 8 GLY O O 7.831 -1.214 -2.773 1.00 . A A . 8 GLY O 1 1 9 3847 1 1 9 CYS C C 6.683 -4.354 -1.401 1.00 . A A . 9 CYS C 1 1 9 3848 1 1 9 CYS CA C 6.395 -2.863 -1.172 1.00 . A A . 9 CYS CA 1 1 9 3849 1 1 9 CYS CB C 5.274 -2.668 -0.146 1.00 . A A . 9 CYS CB 1 1 9 3850 1 1 9 CYS H H 4.970 -2.356 -2.715 1.00 . A A . 9 CYS H 1 1 9 3851 1 1 9 CYS HA H 7.286 -2.368 -0.830 1.00 . A A . 9 CYS HA 1 1 9 3852 1 1 9 CYS HB2 H 5.610 -3.012 0.819 1.00 . A A . 9 CYS HB2 1 1 9 3853 1 1 9 CYS HB3 H 5.027 -1.619 -0.083 1.00 . A A . 9 CYS HB3 1 1 9 3854 1 1 9 CYS N N 5.894 -2.209 -2.421 1.00 . A A . 9 CYS N 1 1 9 3855 1 1 9 CYS O O 7.623 -4.893 -0.851 1.00 . A A . 9 CYS O 1 1 9 3856 1 1 9 CYS SG S 3.803 -3.603 -0.637 1.00 . A A . 9 CYS SG 1 1 9 3857 1 1 10 ASP C C 6.142 -7.277 -1.174 1.00 . A A . 10 ASP C 1 1 9 3858 1 1 10 ASP CA C 6.103 -6.474 -2.485 1.00 . A A . 10 ASP CA 1 1 9 3859 1 1 10 ASP CB C 7.452 -6.544 -3.214 1.00 . A A . 10 ASP CB 1 1 9 3860 1 1 10 ASP CG C 7.627 -7.926 -3.852 1.00 . A A . 10 ASP CG 1 1 9 3861 1 1 10 ASP H H 5.138 -4.552 -2.636 1.00 . A A . 10 ASP H 1 1 9 3862 1 1 10 ASP HA H 5.322 -6.851 -3.128 1.00 . A A . 10 ASP HA 1 1 9 3863 1 1 10 ASP HB2 H 7.485 -5.786 -3.981 1.00 . A A . 10 ASP HB2 1 1 9 3864 1 1 10 ASP HB3 H 8.251 -6.374 -2.507 1.00 . A A . 10 ASP HB3 1 1 9 3865 1 1 10 ASP N N 5.885 -5.016 -2.208 1.00 . A A . 10 ASP N 1 1 9 3866 1 1 10 ASP O O 7.196 -7.659 -0.699 1.00 . A A . 10 ASP O 1 1 9 3867 1 1 10 ASP OD1 O 6.992 -8.174 -4.863 1.00 . A A . 10 ASP OD1 1 1 9 3868 1 1 10 ASP OD2 O 8.400 -8.707 -3.321 1.00 . A A . 10 ASP OD2 1 1 9 3869 1 1 11 GLY C C 3.617 -8.113 1.382 1.00 . A A . 11 GLY C 1 1 9 3870 1 1 11 GLY CA C 4.967 -8.311 0.687 1.00 . A A . 11 GLY CA 1 1 9 3871 1 1 11 GLY H H 4.160 -7.221 -0.988 1.00 . A A . 11 GLY H 1 1 9 3872 1 1 11 GLY HA2 H 5.110 -9.361 0.472 1.00 . A A . 11 GLY HA2 1 1 9 3873 1 1 11 GLY HA3 H 5.755 -7.966 1.338 1.00 . A A . 11 GLY HA3 1 1 9 3874 1 1 11 GLY N N 4.998 -7.536 -0.589 1.00 . A A . 11 GLY N 1 1 9 3875 1 1 11 GLY O O 2.988 -7.079 1.254 1.00 . A A . 11 GLY O 1 1 9 3876 1 1 12 LYS C C 2.048 -8.269 4.202 1.00 . A A . 12 LYS C 1 1 9 3877 1 1 12 LYS CA C 1.864 -8.970 2.844 1.00 . A A . 12 LYS CA 1 1 9 3878 1 1 12 LYS CB C 1.370 -10.411 3.034 1.00 . A A . 12 LYS CB 1 1 9 3879 1 1 12 LYS CD C 2.586 -12.518 3.640 1.00 . A A . 12 LYS CD 1 1 9 3880 1 1 12 LYS CE C 3.679 -13.087 4.552 1.00 . A A . 12 LYS CE 1 1 9 3881 1 1 12 LYS CG C 2.195 -11.117 4.118 1.00 . A A . 12 LYS CG 1 1 9 3882 1 1 12 LYS H H 3.704 -9.917 2.217 1.00 . A A . 12 LYS H 1 1 9 3883 1 1 12 LYS HA H 1.159 -8.423 2.238 1.00 . A A . 12 LYS HA 1 1 9 3884 1 1 12 LYS HB2 H 0.331 -10.395 3.329 1.00 . A A . 12 LYS HB2 1 1 9 3885 1 1 12 LYS HB3 H 1.468 -10.948 2.103 1.00 . A A . 12 LYS HB3 1 1 9 3886 1 1 12 LYS HD2 H 1.718 -13.162 3.672 1.00 . A A . 12 LYS HD2 1 1 9 3887 1 1 12 LYS HD3 H 2.956 -12.464 2.627 1.00 . A A . 12 LYS HD3 1 1 9 3888 1 1 12 LYS HE2 H 3.505 -12.785 5.577 1.00 . A A . 12 LYS HE2 1 1 9 3889 1 1 12 LYS HE3 H 3.709 -14.162 4.477 1.00 . A A . 12 LYS HE3 1 1 9 3890 1 1 12 LYS HG2 H 3.088 -10.545 4.321 1.00 . A A . 12 LYS HG2 1 1 9 3891 1 1 12 LYS HG3 H 1.608 -11.198 5.020 1.00 . A A . 12 LYS HG3 1 1 9 3892 1 1 12 LYS HZ1 H 4.931 -11.470 4.147 1.00 . A A . 12 LYS HZ1 1 1 9 3893 1 1 12 LYS HZ2 H 5.078 -12.755 3.043 1.00 . A A . 12 LYS HZ2 1 1 9 3894 1 1 12 LYS HZ3 H 5.752 -12.884 4.597 1.00 . A A . 12 LYS HZ3 1 1 9 3895 1 1 12 LYS N N 3.173 -9.097 2.126 1.00 . A A . 12 LYS N 1 1 9 3896 1 1 12 LYS NZ N 4.956 -12.505 4.047 1.00 . A A . 12 LYS NZ 1 1 9 3897 1 1 12 LYS O O 1.094 -8.049 4.924 1.00 . A A . 12 LYS O 1 1 9 3898 1 1 13 SER C C 4.706 -6.271 5.722 1.00 . A A . 13 SER C 1 1 9 3899 1 1 13 SER CA C 3.512 -7.229 5.857 1.00 . A A . 13 SER CA 1 1 9 3900 1 1 13 SER CB C 3.819 -8.357 6.847 1.00 . A A . 13 SER CB 1 1 9 3901 1 1 13 SER H H 4.020 -8.102 3.956 1.00 . A A . 13 SER H 1 1 9 3902 1 1 13 SER HA H 2.632 -6.689 6.172 1.00 . A A . 13 SER HA 1 1 9 3903 1 1 13 SER HB2 H 4.118 -7.937 7.793 1.00 . A A . 13 SER HB2 1 1 9 3904 1 1 13 SER HB3 H 2.932 -8.960 6.988 1.00 . A A . 13 SER HB3 1 1 9 3905 1 1 13 SER HG H 5.399 -9.469 7.082 1.00 . A A . 13 SER HG 1 1 9 3906 1 1 13 SER N N 3.265 -7.916 4.552 1.00 . A A . 13 SER N 1 1 9 3907 1 1 13 SER O O 5.620 -6.280 6.526 1.00 . A A . 13 SER O 1 1 9 3908 1 1 13 SER OG O 4.877 -9.162 6.338 1.00 . A A . 13 SER OG 1 1 9 3909 1 1 14 THR C C 5.741 -3.317 5.497 1.00 . A A . 14 THR C 1 1 9 3910 1 1 14 THR CA C 5.821 -4.479 4.490 1.00 . A A . 14 THR CA 1 1 9 3911 1 1 14 THR CB C 5.635 -3.973 3.052 1.00 . A A . 14 THR CB 1 1 9 3912 1 1 14 THR CG2 C 4.434 -3.022 2.982 1.00 . A A . 14 THR CG2 1 1 9 3913 1 1 14 THR H H 3.945 -5.464 4.072 1.00 . A A . 14 THR H 1 1 9 3914 1 1 14 THR HA H 6.769 -4.984 4.579 1.00 . A A . 14 THR HA 1 1 9 3915 1 1 14 THR HB H 5.460 -4.812 2.394 1.00 . A A . 14 THR HB 1 1 9 3916 1 1 14 THR HG1 H 7.322 -3.883 2.085 1.00 . A A . 14 THR HG1 1 1 9 3917 1 1 14 THR HG21 H 4.764 -2.048 2.651 1.00 . A A . 14 THR HG21 1 1 9 3918 1 1 14 THR HG22 H 3.982 -2.936 3.960 1.00 . A A . 14 THR HG22 1 1 9 3919 1 1 14 THR HG23 H 3.709 -3.411 2.285 1.00 . A A . 14 THR HG23 1 1 9 3920 1 1 14 THR N N 4.694 -5.446 4.703 1.00 . A A . 14 THR N 1 1 9 3921 1 1 14 THR O O 4.971 -3.352 6.440 1.00 . A A . 14 THR O 1 1 9 3922 1 1 14 THR OG1 O 6.810 -3.288 2.639 1.00 . A A . 14 THR OG1 1 1 9 3923 1 1 15 PHE C C 6.126 0.162 5.487 1.00 . A A . 15 PHE C 1 1 9 3924 1 1 15 PHE CA C 6.507 -1.124 6.236 1.00 . A A . 15 PHE CA 1 1 9 3925 1 1 15 PHE CB C 7.932 -1.026 6.792 1.00 . A A . 15 PHE CB 1 1 9 3926 1 1 15 PHE CD1 C 7.604 -0.559 9.249 1.00 . A A . 15 PHE CD1 1 1 9 3927 1 1 15 PHE CD2 C 8.305 1.256 7.801 1.00 . A A . 15 PHE CD2 1 1 9 3928 1 1 15 PHE CE1 C 7.616 0.310 10.345 1.00 . A A . 15 PHE CE1 1 1 9 3929 1 1 15 PHE CE2 C 8.317 2.126 8.898 1.00 . A A . 15 PHE CE2 1 1 9 3930 1 1 15 PHE CG C 7.948 -0.087 7.976 1.00 . A A . 15 PHE CG 1 1 9 3931 1 1 15 PHE CZ C 7.972 1.653 10.171 1.00 . A A . 15 PHE CZ 1 1 9 3932 1 1 15 PHE H H 7.142 -2.281 4.531 1.00 . A A . 15 PHE H 1 1 9 3933 1 1 15 PHE HA H 5.812 -1.308 7.042 1.00 . A A . 15 PHE HA 1 1 9 3934 1 1 15 PHE HB2 H 8.266 -2.006 7.104 1.00 . A A . 15 PHE HB2 1 1 9 3935 1 1 15 PHE HB3 H 8.593 -0.650 6.026 1.00 . A A . 15 PHE HB3 1 1 9 3936 1 1 15 PHE HD1 H 7.329 -1.595 9.384 1.00 . A A . 15 PHE HD1 1 1 9 3937 1 1 15 PHE HD2 H 8.571 1.621 6.820 1.00 . A A . 15 PHE HD2 1 1 9 3938 1 1 15 PHE HE1 H 7.351 -0.054 11.326 1.00 . A A . 15 PHE HE1 1 1 9 3939 1 1 15 PHE HE2 H 8.591 3.161 8.763 1.00 . A A . 15 PHE HE2 1 1 9 3940 1 1 15 PHE HZ H 7.981 2.325 11.016 1.00 . A A . 15 PHE HZ 1 1 9 3941 1 1 15 PHE N N 6.532 -2.288 5.298 1.00 . A A . 15 PHE N 1 1 9 3942 1 1 15 PHE O O 6.949 0.779 4.834 1.00 . A A . 15 PHE O 1 1 9 3943 1 1 16 CYS C C 4.424 2.989 5.893 1.00 . A A . 16 CYS C 1 1 9 3944 1 1 16 CYS CA C 4.437 1.818 4.895 1.00 . A A . 16 CYS CA 1 1 9 3945 1 1 16 CYS CB C 3.023 1.499 4.390 1.00 . A A . 16 CYS CB 1 1 9 3946 1 1 16 CYS H H 4.247 0.055 6.124 1.00 . A A . 16 CYS H 1 1 9 3947 1 1 16 CYS HA H 5.085 2.045 4.061 1.00 . A A . 16 CYS HA 1 1 9 3948 1 1 16 CYS HB2 H 2.930 0.436 4.229 1.00 . A A . 16 CYS HB2 1 1 9 3949 1 1 16 CYS HB3 H 2.297 1.818 5.123 1.00 . A A . 16 CYS HB3 1 1 9 3950 1 1 16 CYS N N 4.886 0.570 5.586 1.00 . A A . 16 CYS N 1 1 9 3951 1 1 16 CYS O O 5.244 3.049 6.791 1.00 . A A . 16 CYS O 1 1 9 3952 1 1 16 CYS SG S 2.730 2.371 2.832 1.00 . A A . 16 CYS SG 1 1 9 3953 1 1 17 CYS C C 2.457 4.784 7.833 1.00 . A A . 17 CYS C 1 1 9 3954 1 1 17 CYS CA C 3.457 5.077 6.694 1.00 . A A . 17 CYS CA 1 1 9 3955 1 1 17 CYS CB C 3.018 6.269 5.833 1.00 . A A . 17 CYS CB 1 1 9 3956 1 1 17 CYS H H 2.858 3.859 5.018 1.00 . A A . 17 CYS H 1 1 9 3957 1 1 17 CYS HA H 4.438 5.264 7.103 1.00 . A A . 17 CYS HA 1 1 9 3958 1 1 17 CYS HB2 H 3.624 6.307 4.940 1.00 . A A . 17 CYS HB2 1 1 9 3959 1 1 17 CYS HB3 H 1.981 6.152 5.556 1.00 . A A . 17 CYS HB3 1 1 9 3960 1 1 17 CYS N N 3.509 3.920 5.749 1.00 . A A . 17 CYS N 1 1 9 3961 1 1 17 CYS O O 2.746 4.000 8.718 1.00 . A A . 17 CYS O 1 1 9 3962 1 1 17 CYS SG S 3.226 7.805 6.768 1.00 . A A . 17 CYS SG 1 1 9 3963 1 1 18 SER C C -1.139 5.098 8.348 1.00 . A A . 18 SER C 1 1 9 3964 1 1 18 SER CA C 0.294 5.129 8.913 1.00 . A A . 18 SER CA 1 1 9 3965 1 1 18 SER CB C 0.463 6.294 9.890 1.00 . A A . 18 SER CB 1 1 9 3966 1 1 18 SER H H 1.067 6.020 7.107 1.00 . A A . 18 SER H 1 1 9 3967 1 1 18 SER HA H 0.520 4.199 9.409 1.00 . A A . 18 SER HA 1 1 9 3968 1 1 18 SER HB2 H 1.293 6.908 9.586 1.00 . A A . 18 SER HB2 1 1 9 3969 1 1 18 SER HB3 H -0.440 6.892 9.897 1.00 . A A . 18 SER HB3 1 1 9 3970 1 1 18 SER HG H -0.130 5.621 11.618 1.00 . A A . 18 SER HG 1 1 9 3971 1 1 18 SER N N 1.290 5.393 7.825 1.00 . A A . 18 SER N 1 1 9 3972 1 1 18 SER O O -2.101 5.274 9.073 1.00 . A A . 18 SER O 1 1 9 3973 1 1 18 SER OG O 0.715 5.781 11.192 1.00 . A A . 18 SER OG 1 1 9 3974 1 1 19 GLY C C -2.537 4.373 4.993 1.00 . A A . 19 GLY C 1 1 9 3975 1 1 19 GLY CA C -2.651 4.820 6.453 1.00 . A A . 19 GLY CA 1 1 9 3976 1 1 19 GLY H H -0.500 4.725 6.500 1.00 . A A . 19 GLY H 1 1 9 3977 1 1 19 GLY HA2 H -3.266 4.119 7.000 1.00 . A A . 19 GLY HA2 1 1 9 3978 1 1 19 GLY HA3 H -3.100 5.801 6.492 1.00 . A A . 19 GLY HA3 1 1 9 3979 1 1 19 GLY N N -1.287 4.869 7.064 1.00 . A A . 19 GLY N 1 1 9 3980 1 1 19 GLY O O -3.188 4.912 4.117 1.00 . A A . 19 GLY O 1 1 9 3981 1 1 20 TYR C C -1.461 1.370 3.315 1.00 . A A . 20 TYR C 1 1 9 3982 1 1 20 TYR CA C -1.530 2.902 3.329 1.00 . A A . 20 TYR CA 1 1 9 3983 1 1 20 TYR CB C -0.196 3.494 2.864 1.00 . A A . 20 TYR CB 1 1 9 3984 1 1 20 TYR CD1 C -0.887 5.479 1.470 1.00 . A A . 20 TYR CD1 1 1 9 3985 1 1 20 TYR CD2 C 0.105 5.870 3.647 1.00 . A A . 20 TYR CD2 1 1 9 3986 1 1 20 TYR CE1 C -1.008 6.860 1.276 1.00 . A A . 20 TYR CE1 1 1 9 3987 1 1 20 TYR CE2 C -0.016 7.251 3.454 1.00 . A A . 20 TYR CE2 1 1 9 3988 1 1 20 TYR CG C -0.332 4.984 2.655 1.00 . A A . 20 TYR CG 1 1 9 3989 1 1 20 TYR CZ C -0.572 7.746 2.268 1.00 . A A . 20 TYR CZ 1 1 9 3990 1 1 20 TYR H H -1.192 2.981 5.454 1.00 . A A . 20 TYR H 1 1 9 3991 1 1 20 TYR HA H -2.332 3.255 2.699 1.00 . A A . 20 TYR HA 1 1 9 3992 1 1 20 TYR HB2 H 0.560 3.304 3.613 1.00 . A A . 20 TYR HB2 1 1 9 3993 1 1 20 TYR HB3 H 0.097 3.027 1.935 1.00 . A A . 20 TYR HB3 1 1 9 3994 1 1 20 TYR HD1 H -1.223 4.797 0.704 1.00 . A A . 20 TYR HD1 1 1 9 3995 1 1 20 TYR HD2 H 0.533 5.488 4.562 1.00 . A A . 20 TYR HD2 1 1 9 3996 1 1 20 TYR HE1 H -1.436 7.242 0.361 1.00 . A A . 20 TYR HE1 1 1 9 3997 1 1 20 TYR HE2 H 0.322 7.935 4.219 1.00 . A A . 20 TYR HE2 1 1 9 3998 1 1 20 TYR HH H -1.485 9.404 2.527 1.00 . A A . 20 TYR HH 1 1 9 3999 1 1 20 TYR N N -1.706 3.394 4.727 1.00 . A A . 20 TYR N 1 1 9 4000 1 1 20 TYR O O -0.832 0.763 4.162 1.00 . A A . 20 TYR O 1 1 9 4001 1 1 20 TYR OH O -0.689 9.108 2.077 1.00 . A A . 20 TYR OH 1 1 9 4002 1 1 21 ASN C C -1.475 -1.197 0.941 1.00 . A A . 21 ASN C 1 1 9 4003 1 1 21 ASN CA C -2.066 -0.749 2.281 1.00 . A A . 21 ASN CA 1 1 9 4004 1 1 21 ASN CB C -3.527 -1.185 2.402 1.00 . A A . 21 ASN CB 1 1 9 4005 1 1 21 ASN CG C -3.607 -2.477 3.218 1.00 . A A . 21 ASN CG 1 1 9 4006 1 1 21 ASN H H -2.592 1.254 1.685 1.00 . A A . 21 ASN H 1 1 9 4007 1 1 21 ASN HA H -1.488 -1.156 3.097 1.00 . A A . 21 ASN HA 1 1 9 4008 1 1 21 ASN HB2 H -4.093 -0.410 2.899 1.00 . A A . 21 ASN HB2 1 1 9 4009 1 1 21 ASN HB3 H -3.935 -1.356 1.418 1.00 . A A . 21 ASN HB3 1 1 9 4010 1 1 21 ASN HD21 H -3.561 -3.659 1.621 1.00 . A A . 21 ASN HD21 1 1 9 4011 1 1 21 ASN HD22 H -3.661 -4.459 3.115 1.00 . A A . 21 ASN HD22 1 1 9 4012 1 1 21 ASN N N -2.096 0.742 2.358 1.00 . A A . 21 ASN N 1 1 9 4013 1 1 21 ASN ND2 N -3.610 -3.628 2.600 1.00 . A A . 21 ASN ND2 1 1 9 4014 1 1 21 ASN O O -1.544 -0.489 -0.042 1.00 . A A . 21 ASN O 1 1 9 4015 1 1 21 ASN OD1 O -3.667 -2.440 4.431 1.00 . A A . 21 ASN OD1 1 1 9 4016 1 1 22 CYS C C -1.316 -3.612 -1.222 1.00 . A A . 22 CYS C 1 1 9 4017 1 1 22 CYS CA C -0.285 -2.847 -0.386 1.00 . A A . 22 CYS CA 1 1 9 4018 1 1 22 CYS CB C 0.860 -3.771 0.033 1.00 . A A . 22 CYS CB 1 1 9 4019 1 1 22 CYS H H -0.841 -2.922 1.700 1.00 . A A . 22 CYS H 1 1 9 4020 1 1 22 CYS HA H 0.108 -2.015 -0.950 1.00 . A A . 22 CYS HA 1 1 9 4021 1 1 22 CYS HB2 H 0.562 -4.343 0.899 1.00 . A A . 22 CYS HB2 1 1 9 4022 1 1 22 CYS HB3 H 1.099 -4.442 -0.779 1.00 . A A . 22 CYS HB3 1 1 9 4023 1 1 22 CYS N N -0.890 -2.366 0.894 1.00 . A A . 22 CYS N 1 1 9 4024 1 1 22 CYS O O -2.048 -4.443 -0.715 1.00 . A A . 22 CYS O 1 1 9 4025 1 1 22 CYS SG S 2.312 -2.772 0.440 1.00 . A A . 22 CYS SG 1 1 9 4026 1 1 23 SER C C -1.700 -5.284 -4.003 1.00 . A A . 23 SER C 1 1 9 4027 1 1 23 SER CA C -2.347 -4.035 -3.387 1.00 . A A . 23 SER CA 1 1 9 4028 1 1 23 SER CB C -2.692 -3.020 -4.477 1.00 . A A . 23 SER CB 1 1 9 4029 1 1 23 SER H H -0.765 -2.660 -2.879 1.00 . A A . 23 SER H 1 1 9 4030 1 1 23 SER HA H -3.234 -4.300 -2.836 1.00 . A A . 23 SER HA 1 1 9 4031 1 1 23 SER HB2 H -2.586 -2.020 -4.090 1.00 . A A . 23 SER HB2 1 1 9 4032 1 1 23 SER HB3 H -2.022 -3.153 -5.313 1.00 . A A . 23 SER HB3 1 1 9 4033 1 1 23 SER HG H -4.600 -2.630 -4.386 1.00 . A A . 23 SER HG 1 1 9 4034 1 1 23 SER N N -1.371 -3.333 -2.500 1.00 . A A . 23 SER N 1 1 9 4035 1 1 23 SER O O -0.514 -5.295 -4.270 1.00 . A A . 23 SER O 1 1 9 4036 1 1 23 SER OG O -4.037 -3.219 -4.896 1.00 . A A . 23 SER OG 1 1 9 4037 1 1 24 PRO C C -1.737 -7.400 -6.304 1.00 . A A . 24 PRO C 1 1 9 4038 1 1 24 PRO CA C -2.001 -7.566 -4.800 1.00 . A A . 24 PRO CA 1 1 9 4039 1 1 24 PRO CB C -3.139 -8.554 -4.555 1.00 . A A . 24 PRO CB 1 1 9 4040 1 1 24 PRO CD C -3.944 -6.366 -3.908 1.00 . A A . 24 PRO CD 1 1 9 4041 1 1 24 PRO CG C -4.370 -7.712 -4.435 1.00 . A A . 24 PRO CG 1 1 9 4042 1 1 24 PRO HA H -1.112 -7.894 -4.293 1.00 . A A . 24 PRO HA 1 1 9 4043 1 1 24 PRO HB2 H -3.227 -9.237 -5.390 1.00 . A A . 24 PRO HB2 1 1 9 4044 1 1 24 PRO HB3 H -2.974 -9.099 -3.638 1.00 . A A . 24 PRO HB3 1 1 9 4045 1 1 24 PRO HD2 H -4.477 -5.575 -4.418 1.00 . A A . 24 PRO HD2 1 1 9 4046 1 1 24 PRO HD3 H -4.104 -6.308 -2.843 1.00 . A A . 24 PRO HD3 1 1 9 4047 1 1 24 PRO HG2 H -4.833 -7.600 -5.405 1.00 . A A . 24 PRO HG2 1 1 9 4048 1 1 24 PRO HG3 H -5.063 -8.168 -3.745 1.00 . A A . 24 PRO HG3 1 1 9 4049 1 1 24 PRO N N -2.506 -6.299 -4.208 1.00 . A A . 24 PRO N 1 1 9 4050 1 1 24 PRO O O -0.807 -7.969 -6.843 1.00 . A A . 24 PRO O 1 1 9 4051 1 1 25 THR C C -1.386 -5.258 -8.702 1.00 . A A . 25 THR C 1 1 9 4052 1 1 25 THR CA C -2.355 -6.419 -8.448 1.00 . A A . 25 THR CA 1 1 9 4053 1 1 25 THR CB C -3.749 -6.090 -8.997 1.00 . A A . 25 THR CB 1 1 9 4054 1 1 25 THR CG2 C -3.712 -6.078 -10.527 1.00 . A A . 25 THR CG2 1 1 9 4055 1 1 25 THR H H -3.289 -6.179 -6.519 1.00 . A A . 25 THR H 1 1 9 4056 1 1 25 THR HA H -1.984 -7.318 -8.907 1.00 . A A . 25 THR HA 1 1 9 4057 1 1 25 THR HB H -4.054 -5.116 -8.643 1.00 . A A . 25 THR HB 1 1 9 4058 1 1 25 THR HG1 H -4.317 -7.938 -8.735 1.00 . A A . 25 THR HG1 1 1 9 4059 1 1 25 THR HG21 H -4.666 -5.742 -10.907 1.00 . A A . 25 THR HG21 1 1 9 4060 1 1 25 THR HG22 H -3.511 -7.076 -10.890 1.00 . A A . 25 THR HG22 1 1 9 4061 1 1 25 THR HG23 H -2.934 -5.409 -10.865 1.00 . A A . 25 THR HG23 1 1 9 4062 1 1 25 THR N N -2.549 -6.625 -6.979 1.00 . A A . 25 THR N 1 1 9 4063 1 1 25 THR O O -0.585 -5.300 -9.617 1.00 . A A . 25 THR O 1 1 9 4064 1 1 25 THR OG1 O -4.682 -7.069 -8.552 1.00 . A A . 25 THR OG1 1 1 9 4065 1 1 26 TRP C C 0.828 -3.340 -7.437 1.00 . A A . 26 TRP C 1 1 9 4066 1 1 26 TRP CA C -0.531 -3.058 -8.089 1.00 . A A . 26 TRP CA 1 1 9 4067 1 1 26 TRP CB C -1.214 -1.872 -7.398 1.00 . A A . 26 TRP CB 1 1 9 4068 1 1 26 TRP CD1 C -3.072 -2.132 -9.111 1.00 . A A . 26 TRP CD1 1 1 9 4069 1 1 26 TRP CD2 C -3.734 -1.020 -7.271 1.00 . A A . 26 TRP CD2 1 1 9 4070 1 1 26 TRP CE2 C -4.857 -1.093 -8.129 1.00 . A A . 26 TRP CE2 1 1 9 4071 1 1 26 TRP CE3 C -3.886 -0.363 -6.037 1.00 . A A . 26 TRP CE3 1 1 9 4072 1 1 26 TRP CG C -2.612 -1.689 -7.915 1.00 . A A . 26 TRP CG 1 1 9 4073 1 1 26 TRP CH2 C -6.219 0.114 -6.545 1.00 . A A . 26 TRP CH2 1 1 9 4074 1 1 26 TRP CZ2 C -6.085 -0.535 -7.776 1.00 . A A . 26 TRP CZ2 1 1 9 4075 1 1 26 TRP CZ3 C -5.121 0.200 -5.677 1.00 . A A . 26 TRP CZ3 1 1 9 4076 1 1 26 TRP H H -2.104 -4.222 -7.167 1.00 . A A . 26 TRP H 1 1 9 4077 1 1 26 TRP HA H -0.406 -2.849 -9.138 1.00 . A A . 26 TRP HA 1 1 9 4078 1 1 26 TRP HB2 H -1.245 -2.046 -6.335 1.00 . A A . 26 TRP HB2 1 1 9 4079 1 1 26 TRP HB3 H -0.643 -0.979 -7.592 1.00 . A A . 26 TRP HB3 1 1 9 4080 1 1 26 TRP HD1 H -2.494 -2.675 -9.844 1.00 . A A . 26 TRP HD1 1 1 9 4081 1 1 26 TRP HE1 H -4.971 -1.987 -10.007 1.00 . A A . 26 TRP HE1 1 1 9 4082 1 1 26 TRP HE3 H -3.047 -0.292 -5.360 1.00 . A A . 26 TRP HE3 1 1 9 4083 1 1 26 TRP HH2 H -7.165 0.549 -6.263 1.00 . A A . 26 TRP HH2 1 1 9 4084 1 1 26 TRP HZ2 H -6.928 -0.605 -8.448 1.00 . A A . 26 TRP HZ2 1 1 9 4085 1 1 26 TRP HZ3 H -5.226 0.702 -4.726 1.00 . A A . 26 TRP HZ3 1 1 9 4086 1 1 26 TRP N N -1.452 -4.227 -7.898 1.00 . A A . 26 TRP N 1 1 9 4087 1 1 26 TRP NE1 N -4.404 -1.782 -9.236 1.00 . A A . 26 TRP NE1 1 1 9 4088 1 1 26 TRP O O 1.848 -2.849 -7.883 1.00 . A A . 26 TRP O 1 1 9 4089 1 1 27 LYS C C 2.713 -3.276 -4.934 1.00 . A A . 27 LYS C 1 1 9 4090 1 1 27 LYS CA C 2.112 -4.482 -5.678 1.00 . A A . 27 LYS CA 1 1 9 4091 1 1 27 LYS CB C 3.070 -4.981 -6.768 1.00 . A A . 27 LYS CB 1 1 9 4092 1 1 27 LYS CD C 3.088 -7.371 -6.024 1.00 . A A . 27 LYS CD 1 1 9 4093 1 1 27 LYS CE C 3.999 -8.571 -5.756 1.00 . A A . 27 LYS CE 1 1 9 4094 1 1 27 LYS CG C 3.940 -6.113 -6.211 1.00 . A A . 27 LYS CG 1 1 9 4095 1 1 27 LYS H H -0.006 -4.508 -6.063 1.00 . A A . 27 LYS H 1 1 9 4096 1 1 27 LYS HA H 1.926 -5.282 -4.977 1.00 . A A . 27 LYS HA 1 1 9 4097 1 1 27 LYS HB2 H 2.499 -5.346 -7.610 1.00 . A A . 27 LYS HB2 1 1 9 4098 1 1 27 LYS HB3 H 3.705 -4.169 -7.088 1.00 . A A . 27 LYS HB3 1 1 9 4099 1 1 27 LYS HD2 H 2.421 -7.231 -5.185 1.00 . A A . 27 LYS HD2 1 1 9 4100 1 1 27 LYS HD3 H 2.511 -7.552 -6.918 1.00 . A A . 27 LYS HD3 1 1 9 4101 1 1 27 LYS HE2 H 4.820 -8.581 -6.460 1.00 . A A . 27 LYS HE2 1 1 9 4102 1 1 27 LYS HE3 H 4.371 -8.543 -4.744 1.00 . A A . 27 LYS HE3 1 1 9 4103 1 1 27 LYS HG2 H 4.743 -6.321 -6.904 1.00 . A A . 27 LYS HG2 1 1 9 4104 1 1 27 LYS HG3 H 4.352 -5.815 -5.260 1.00 . A A . 27 LYS HG3 1 1 9 4105 1 1 27 LYS HZ1 H 2.936 -9.898 -6.961 1.00 . A A . 27 LYS HZ1 1 1 9 4106 1 1 27 LYS HZ2 H 2.238 -9.641 -5.433 1.00 . A A . 27 LYS HZ2 1 1 9 4107 1 1 27 LYS HZ3 H 3.623 -10.613 -5.586 1.00 . A A . 27 LYS HZ3 1 1 9 4108 1 1 27 LYS N N 0.838 -4.132 -6.388 1.00 . A A . 27 LYS N 1 1 9 4109 1 1 27 LYS NZ N 3.133 -9.770 -5.948 1.00 . A A . 27 LYS NZ 1 1 9 4110 1 1 27 LYS O O 3.833 -3.342 -4.465 1.00 . A A . 27 LYS O 1 1 9 4111 1 1 28 TRP C C 1.586 -0.525 -2.975 1.00 . A A . 28 TRP C 1 1 9 4112 1 1 28 TRP CA C 2.556 -1.016 -4.057 1.00 . A A . 28 TRP CA 1 1 9 4113 1 1 28 TRP CB C 2.856 0.072 -5.104 1.00 . A A . 28 TRP CB 1 1 9 4114 1 1 28 TRP CD1 C 0.489 0.985 -5.279 1.00 . A A . 28 TRP CD1 1 1 9 4115 1 1 28 TRP CD2 C 1.416 0.564 -7.283 1.00 . A A . 28 TRP CD2 1 1 9 4116 1 1 28 TRP CE2 C 0.121 1.070 -7.535 1.00 . A A . 28 TRP CE2 1 1 9 4117 1 1 28 TRP CE3 C 2.218 0.217 -8.385 1.00 . A A . 28 TRP CE3 1 1 9 4118 1 1 28 TRP CG C 1.626 0.514 -5.842 1.00 . A A . 28 TRP CG 1 1 9 4119 1 1 28 TRP CH2 C 0.448 0.880 -9.918 1.00 . A A . 28 TRP CH2 1 1 9 4120 1 1 28 TRP CZ2 C -0.363 1.228 -8.834 1.00 . A A . 28 TRP CZ2 1 1 9 4121 1 1 28 TRP CZ3 C 1.734 0.374 -9.694 1.00 . A A . 28 TRP CZ3 1 1 9 4122 1 1 28 TRP H H 1.080 -2.142 -5.162 1.00 . A A . 28 TRP H 1 1 9 4123 1 1 28 TRP HA H 3.481 -1.314 -3.587 1.00 . A A . 28 TRP HA 1 1 9 4124 1 1 28 TRP HB2 H 3.287 0.927 -4.607 1.00 . A A . 28 TRP HB2 1 1 9 4125 1 1 28 TRP HB3 H 3.574 -0.316 -5.813 1.00 . A A . 28 TRP HB3 1 1 9 4126 1 1 28 TRP HD1 H 0.306 1.084 -4.220 1.00 . A A . 28 TRP HD1 1 1 9 4127 1 1 28 TRP HE1 H -1.305 1.673 -6.145 1.00 . A A . 28 TRP HE1 1 1 9 4128 1 1 28 TRP HE3 H 3.209 -0.175 -8.222 1.00 . A A . 28 TRP HE3 1 1 9 4129 1 1 28 TRP HH2 H 0.081 1.000 -10.927 1.00 . A A . 28 TRP HH2 1 1 9 4130 1 1 28 TRP HZ2 H -1.355 1.618 -9.000 1.00 . A A . 28 TRP HZ2 1 1 9 4131 1 1 28 TRP HZ3 H 2.361 0.106 -10.534 1.00 . A A . 28 TRP HZ3 1 1 9 4132 1 1 28 TRP N N 1.988 -2.185 -4.798 1.00 . A A . 28 TRP N 1 1 9 4133 1 1 28 TRP NE1 N -0.405 1.311 -6.284 1.00 . A A . 28 TRP NE1 1 1 9 4134 1 1 28 TRP O O 0.433 -0.916 -2.926 1.00 . A A . 28 TRP O 1 1 9 4135 1 1 29 CYS C C 0.264 1.929 -1.472 1.00 . A A . 29 CYS C 1 1 9 4136 1 1 29 CYS CA C 1.215 0.833 -0.978 1.00 . A A . 29 CYS CA 1 1 9 4137 1 1 29 CYS CB C 2.215 1.411 0.027 1.00 . A A . 29 CYS CB 1 1 9 4138 1 1 29 CYS H H 3.004 0.595 -2.154 1.00 . A A . 29 CYS H 1 1 9 4139 1 1 29 CYS HA H 0.661 0.029 -0.521 1.00 . A A . 29 CYS HA 1 1 9 4140 1 1 29 CYS HB2 H 3.184 0.963 -0.134 1.00 . A A . 29 CYS HB2 1 1 9 4141 1 1 29 CYS HB3 H 2.287 2.479 -0.113 1.00 . A A . 29 CYS HB3 1 1 9 4142 1 1 29 CYS N N 2.066 0.315 -2.092 1.00 . A A . 29 CYS N 1 1 9 4143 1 1 29 CYS O O 0.676 2.874 -2.107 1.00 . A A . 29 CYS O 1 1 9 4144 1 1 29 CYS SG S 1.671 1.062 1.716 1.00 . A A . 29 CYS SG 1 1 9 4145 1 1 30 VAL C C -2.834 3.269 -0.369 1.00 . A A . 30 VAL C 1 1 9 4146 1 1 30 VAL CA C -2.005 2.839 -1.581 1.00 . A A . 30 VAL CA 1 1 9 4147 1 1 30 VAL CB C -2.907 2.159 -2.623 1.00 . A A . 30 VAL CB 1 1 9 4148 1 1 30 VAL CG1 C -2.059 1.627 -3.776 1.00 . A A . 30 VAL CG1 1 1 9 4149 1 1 30 VAL CG2 C -3.678 0.997 -1.981 1.00 . A A . 30 VAL CG2 1 1 9 4150 1 1 30 VAL H H -1.297 1.035 -0.633 1.00 . A A . 30 VAL H 1 1 9 4151 1 1 30 VAL HA H -1.509 3.691 -2.019 1.00 . A A . 30 VAL HA 1 1 9 4152 1 1 30 VAL HB H -3.611 2.884 -3.008 1.00 . A A . 30 VAL HB 1 1 9 4153 1 1 30 VAL HG11 H -1.257 2.320 -3.983 1.00 . A A . 30 VAL HG11 1 1 9 4154 1 1 30 VAL HG12 H -2.676 1.518 -4.655 1.00 . A A . 30 VAL HG12 1 1 9 4155 1 1 30 VAL HG13 H -1.644 0.667 -3.506 1.00 . A A . 30 VAL HG13 1 1 9 4156 1 1 30 VAL HG21 H -3.155 0.657 -1.101 1.00 . A A . 30 VAL HG21 1 1 9 4157 1 1 30 VAL HG22 H -3.759 0.185 -2.687 1.00 . A A . 30 VAL HG22 1 1 9 4158 1 1 30 VAL HG23 H -4.667 1.332 -1.704 1.00 . A A . 30 VAL HG23 1 1 9 4159 1 1 30 VAL N N -1.002 1.807 -1.160 1.00 . A A . 30 VAL N 1 1 9 4160 1 1 30 VAL O O -2.770 2.656 0.676 1.00 . A A . 30 VAL O 1 1 9 4161 1 1 31 TYR C C -5.298 3.601 1.202 1.00 . A A . 31 TYR C 1 1 9 4162 1 1 31 TYR CA C -4.461 4.768 0.652 1.00 . A A . 31 TYR CA 1 1 9 4163 1 1 31 TYR CB C -5.375 5.872 0.092 1.00 . A A . 31 TYR CB 1 1 9 4164 1 1 31 TYR CD1 C -7.143 4.472 -1.055 1.00 . A A . 31 TYR CD1 1 1 9 4165 1 1 31 TYR CD2 C -5.677 5.844 -2.415 1.00 . A A . 31 TYR CD2 1 1 9 4166 1 1 31 TYR CE1 C -7.789 4.018 -2.210 1.00 . A A . 31 TYR CE1 1 1 9 4167 1 1 31 TYR CE2 C -6.324 5.389 -3.570 1.00 . A A . 31 TYR CE2 1 1 9 4168 1 1 31 TYR CG C -6.086 5.385 -1.156 1.00 . A A . 31 TYR CG 1 1 9 4169 1 1 31 TYR CZ C -7.379 4.475 -3.468 1.00 . A A . 31 TYR CZ 1 1 9 4170 1 1 31 TYR H H -3.654 4.784 -1.356 1.00 . A A . 31 TYR H 1 1 9 4171 1 1 31 TYR HA H -3.833 5.172 1.432 1.00 . A A . 31 TYR HA 1 1 9 4172 1 1 31 TYR HB2 H -6.109 6.142 0.838 1.00 . A A . 31 TYR HB2 1 1 9 4173 1 1 31 TYR HB3 H -4.779 6.739 -0.151 1.00 . A A . 31 TYR HB3 1 1 9 4174 1 1 31 TYR HD1 H -7.460 4.117 -0.086 1.00 . A A . 31 TYR HD1 1 1 9 4175 1 1 31 TYR HD2 H -4.863 6.548 -2.493 1.00 . A A . 31 TYR HD2 1 1 9 4176 1 1 31 TYR HE1 H -8.604 3.313 -2.131 1.00 . A A . 31 TYR HE1 1 1 9 4177 1 1 31 TYR HE2 H -6.007 5.744 -4.540 1.00 . A A . 31 TYR HE2 1 1 9 4178 1 1 31 TYR HH H -7.503 3.291 -4.962 1.00 . A A . 31 TYR HH 1 1 9 4179 1 1 31 TYR N N -3.617 4.309 -0.501 1.00 . A A . 31 TYR N 1 1 9 4180 1 1 31 TYR O O -5.584 2.645 0.503 1.00 . A A . 31 TYR O 1 1 9 4181 1 1 31 TYR OH O -8.015 4.023 -4.608 1.00 . A A . 31 TYR OH 1 1 9 4182 1 1 32 ALA C C -7.881 3.090 3.464 1.00 . A A . 32 ALA C 1 1 9 4183 1 1 32 ALA CA C -6.498 2.571 3.051 1.00 . A A . 32 ALA CA 1 1 9 4184 1 1 32 ALA CB C -5.698 2.113 4.275 1.00 . A A . 32 ALA CB 1 1 9 4185 1 1 32 ALA H H -5.440 4.450 2.995 1.00 . A A . 32 ALA H 1 1 9 4186 1 1 32 ALA HA H -6.598 1.754 2.354 1.00 . A A . 32 ALA HA 1 1 9 4187 1 1 32 ALA HB1 H -6.359 2.018 5.124 1.00 . A A . 32 ALA HB1 1 1 9 4188 1 1 32 ALA HB2 H -4.931 2.840 4.497 1.00 . A A . 32 ALA HB2 1 1 9 4189 1 1 32 ALA HB3 H -5.239 1.158 4.067 1.00 . A A . 32 ALA HB3 1 1 9 4190 1 1 32 ALA N N -5.685 3.672 2.450 1.00 . A A . 32 ALA N 1 1 9 4191 1 1 32 ALA O O -7.997 4.031 4.229 1.00 . A A . 32 ALA O 1 1 9 4192 1 1 33 ARG C C -10.994 1.889 4.208 1.00 . A A . 33 ARG C 1 1 9 4193 1 1 33 ARG CA C -10.310 2.933 3.314 1.00 . A A . 33 ARG CA 1 1 9 4194 1 1 33 ARG CB C -11.048 3.056 1.975 1.00 . A A . 33 ARG CB 1 1 9 4195 1 1 33 ARG CD C -12.735 4.877 2.311 1.00 . A A . 33 ARG CD 1 1 9 4196 1 1 33 ARG CG C -11.373 4.527 1.701 1.00 . A A . 33 ARG CG 1 1 9 4197 1 1 33 ARG CZ C -14.856 4.858 1.134 1.00 . A A . 33 ARG CZ 1 1 9 4198 1 1 33 ARG H H -8.804 1.729 2.345 1.00 . A A . 33 ARG H 1 1 9 4199 1 1 33 ARG HA H -10.279 3.890 3.806 1.00 . A A . 33 ARG HA 1 1 9 4200 1 1 33 ARG HB2 H -10.422 2.671 1.183 1.00 . A A . 33 ARG HB2 1 1 9 4201 1 1 33 ARG HB3 H -11.966 2.490 2.017 1.00 . A A . 33 ARG HB3 1 1 9 4202 1 1 33 ARG HD2 H -13.139 4.025 2.839 1.00 . A A . 33 ARG HD2 1 1 9 4203 1 1 33 ARG HD3 H -12.644 5.723 2.975 1.00 . A A . 33 ARG HD3 1 1 9 4204 1 1 33 ARG HE H -13.235 5.745 0.401 1.00 . A A . 33 ARG HE 1 1 9 4205 1 1 33 ARG HG2 H -10.610 5.152 2.141 1.00 . A A . 33 ARG HG2 1 1 9 4206 1 1 33 ARG HG3 H -11.403 4.696 0.634 1.00 . A A . 33 ARG HG3 1 1 9 4207 1 1 33 ARG HH11 H -14.473 3.072 0.307 1.00 . A A . 33 ARG HH11 1 1 9 4208 1 1 33 ARG HH12 H -16.140 3.398 0.644 1.00 . A A . 33 ARG HH12 1 1 9 4209 1 1 33 ARG HH21 H -15.531 6.558 1.956 1.00 . A A . 33 ARG HH21 1 1 9 4210 1 1 33 ARG HH22 H -16.740 5.377 1.580 1.00 . A A . 33 ARG HH22 1 1 9 4211 1 1 33 ARG N N -8.927 2.483 2.959 1.00 . A A . 33 ARG N 1 1 9 4212 1 1 33 ARG NE N -13.603 5.231 1.150 1.00 . A A . 33 ARG NE 1 1 9 4213 1 1 33 ARG NH1 N -15.182 3.685 0.658 1.00 . A A . 33 ARG NH1 1 1 9 4214 1 1 33 ARG NH2 N -15.782 5.660 1.593 1.00 . A A . 33 ARG NH2 1 1 9 4215 1 1 33 ARG O O -11.085 0.731 3.844 1.00 . A A . 33 ARG O 1 1 9 4216 1 1 34 PRO C C -13.539 1.032 5.790 1.00 . A A . 34 PRO C 1 1 9 4217 1 1 34 PRO CA C -12.144 1.424 6.308 1.00 . A A . 34 PRO CA 1 1 9 4218 1 1 34 PRO CB C -12.253 2.256 7.583 1.00 . A A . 34 PRO CB 1 1 9 4219 1 1 34 PRO CD C -11.386 3.711 5.866 1.00 . A A . 34 PRO CD 1 1 9 4220 1 1 34 PRO CG C -12.216 3.678 7.122 1.00 . A A . 34 PRO CG 1 1 9 4221 1 1 34 PRO HA H -11.545 0.546 6.492 1.00 . A A . 34 PRO HA 1 1 9 4222 1 1 34 PRO HB2 H -13.185 2.045 8.090 1.00 . A A . 34 PRO HB2 1 1 9 4223 1 1 34 PRO HB3 H -11.415 2.057 8.233 1.00 . A A . 34 PRO HB3 1 1 9 4224 1 1 34 PRO HD2 H -11.808 4.406 5.153 1.00 . A A . 34 PRO HD2 1 1 9 4225 1 1 34 PRO HD3 H -10.364 3.970 6.093 1.00 . A A . 34 PRO HD3 1 1 9 4226 1 1 34 PRO HG2 H -13.220 4.024 6.914 1.00 . A A . 34 PRO HG2 1 1 9 4227 1 1 34 PRO HG3 H -11.759 4.299 7.877 1.00 . A A . 34 PRO HG3 1 1 9 4228 1 1 34 PRO N N -11.457 2.335 5.353 1.00 . A A . 34 PRO N 1 1 9 4229 1 1 34 PRO O O -14.082 1.763 4.974 1.00 . A A . 34 PRO O 1 1 9 4230 1 1 34 PRO OXT O -14.038 0.006 6.222 1.00 . A A . 34 PRO OXT 1 1 10 4231 1 1 1 GLY C C 9.027 4.727 5.615 1.00 . A A . 1 GLY C 1 1 10 4232 1 1 1 GLY CA C 10.507 4.576 5.979 1.00 . A A . 1 GLY CA 1 1 10 4233 1 1 1 GLY H1 H 11.642 3.932 7.603 1.00 . A A . 1 GLY H1 1 1 10 4234 1 1 1 GLY H2 H 10.204 3.055 7.371 1.00 . A A . 1 GLY H2 1 1 10 4235 1 1 1 GLY H3 H 10.152 4.621 8.032 1.00 . A A . 1 GLY H3 1 1 10 4236 1 1 1 GLY HA2 H 10.988 5.543 5.950 1.00 . A A . 1 GLY HA2 1 1 10 4237 1 1 1 GLY HA3 H 10.982 3.917 5.269 1.00 . A A . 1 GLY HA3 1 1 10 4238 1 1 1 GLY N N 10.636 4.002 7.350 1.00 . A A . 1 GLY N 1 1 10 4239 1 1 1 GLY O O 8.310 3.754 5.484 1.00 . A A . 1 GLY O 1 1 10 4240 1 1 2 CYS C C 6.920 5.894 3.584 1.00 . A A . 2 CYS C 1 1 10 4241 1 1 2 CYS CA C 7.132 6.165 5.080 1.00 . A A . 2 CYS CA 1 1 10 4242 1 1 2 CYS CB C 6.857 7.637 5.409 1.00 . A A . 2 CYS CB 1 1 10 4243 1 1 2 CYS H H 9.168 6.711 5.550 1.00 . A A . 2 CYS H 1 1 10 4244 1 1 2 CYS HA H 6.493 5.529 5.672 1.00 . A A . 2 CYS HA 1 1 10 4245 1 1 2 CYS HB2 H 6.727 7.749 6.476 1.00 . A A . 2 CYS HB2 1 1 10 4246 1 1 2 CYS HB3 H 7.691 8.240 5.084 1.00 . A A . 2 CYS HB3 1 1 10 4247 1 1 2 CYS N N 8.567 5.943 5.443 1.00 . A A . 2 CYS N 1 1 10 4248 1 1 2 CYS O O 7.699 6.322 2.752 1.00 . A A . 2 CYS O 1 1 10 4249 1 1 2 CYS SG S 5.350 8.186 4.562 1.00 . A A . 2 CYS SG 1 1 10 4250 1 1 3 GLY C C 4.811 6.042 1.176 1.00 . A A . 3 GLY C 1 1 10 4251 1 1 3 GLY CA C 5.597 4.887 1.804 1.00 . A A . 3 GLY CA 1 1 10 4252 1 1 3 GLY H H 5.258 4.859 3.932 1.00 . A A . 3 GLY H 1 1 10 4253 1 1 3 GLY HA2 H 6.533 4.758 1.278 1.00 . A A . 3 GLY HA2 1 1 10 4254 1 1 3 GLY HA3 H 5.014 3.981 1.731 1.00 . A A . 3 GLY HA3 1 1 10 4255 1 1 3 GLY N N 5.870 5.189 3.242 1.00 . A A . 3 GLY N 1 1 10 4256 1 1 3 GLY O O 5.234 7.183 1.215 1.00 . A A . 3 GLY O 1 1 10 4257 1 1 4 GLY C C 1.688 6.212 -0.807 1.00 . A A . 4 GLY C 1 1 10 4258 1 1 4 GLY CA C 2.857 6.832 -0.035 1.00 . A A . 4 GLY CA 1 1 10 4259 1 1 4 GLY H H 3.355 4.825 0.579 1.00 . A A . 4 GLY H 1 1 10 4260 1 1 4 GLY HA2 H 2.474 7.488 0.733 1.00 . A A . 4 GLY HA2 1 1 10 4261 1 1 4 GLY HA3 H 3.475 7.397 -0.717 1.00 . A A . 4 GLY HA3 1 1 10 4262 1 1 4 GLY N N 3.673 5.753 0.597 1.00 . A A . 4 GLY N 1 1 10 4263 1 1 4 GLY O O 1.007 5.331 -0.315 1.00 . A A . 4 GLY O 1 1 10 4264 1 1 5 LEU C C 0.824 5.086 -3.847 1.00 . A A . 5 LEU C 1 1 10 4265 1 1 5 LEU CA C 0.324 6.115 -2.823 1.00 . A A . 5 LEU CA 1 1 10 4266 1 1 5 LEU CB C -0.284 7.323 -3.530 1.00 . A A . 5 LEU CB 1 1 10 4267 1 1 5 LEU CD1 C -2.171 8.945 -3.388 1.00 . A A . 5 LEU CD1 1 1 10 4268 1 1 5 LEU CD2 C -2.633 6.498 -3.653 1.00 . A A . 5 LEU CD2 1 1 10 4269 1 1 5 LEU CG C -1.705 7.537 -3.018 1.00 . A A . 5 LEU CG 1 1 10 4270 1 1 5 LEU H H 2.015 7.379 -2.382 1.00 . A A . 5 LEU H 1 1 10 4271 1 1 5 LEU HA H -0.412 5.665 -2.175 1.00 . A A . 5 LEU HA 1 1 10 4272 1 1 5 LEU HB2 H 0.312 8.202 -3.323 1.00 . A A . 5 LEU HB2 1 1 10 4273 1 1 5 LEU HB3 H -0.309 7.146 -4.594 1.00 . A A . 5 LEU HB3 1 1 10 4274 1 1 5 LEU HD11 H -1.631 9.284 -4.262 1.00 . A A . 5 LEU HD11 1 1 10 4275 1 1 5 LEU HD12 H -1.976 9.615 -2.564 1.00 . A A . 5 LEU HD12 1 1 10 4276 1 1 5 LEU HD13 H -3.228 8.931 -3.600 1.00 . A A . 5 LEU HD13 1 1 10 4277 1 1 5 LEU HD21 H -2.582 6.580 -4.729 1.00 . A A . 5 LEU HD21 1 1 10 4278 1 1 5 LEU HD22 H -3.647 6.671 -3.326 1.00 . A A . 5 LEU HD22 1 1 10 4279 1 1 5 LEU HD23 H -2.321 5.509 -3.353 1.00 . A A . 5 LEU HD23 1 1 10 4280 1 1 5 LEU HG H -1.720 7.426 -1.943 1.00 . A A . 5 LEU HG 1 1 10 4281 1 1 5 LEU N N 1.453 6.669 -2.011 1.00 . A A . 5 LEU N 1 1 10 4282 1 1 5 LEU O O 0.036 4.425 -4.501 1.00 . A A . 5 LEU O 1 1 10 4283 1 1 6 MET C C 4.007 3.399 -4.471 1.00 . A A . 6 MET C 1 1 10 4284 1 1 6 MET CA C 2.657 3.937 -4.961 1.00 . A A . 6 MET CA 1 1 10 4285 1 1 6 MET CB C 2.817 4.703 -6.278 1.00 . A A . 6 MET CB 1 1 10 4286 1 1 6 MET CE C 0.473 4.427 -8.766 1.00 . A A . 6 MET CE 1 1 10 4287 1 1 6 MET CG C 2.741 3.721 -7.450 1.00 . A A . 6 MET CG 1 1 10 4288 1 1 6 MET H H 2.736 5.467 -3.450 1.00 . A A . 6 MET H 1 1 10 4289 1 1 6 MET HA H 1.957 3.126 -5.092 1.00 . A A . 6 MET HA 1 1 10 4290 1 1 6 MET HB2 H 2.025 5.434 -6.366 1.00 . A A . 6 MET HB2 1 1 10 4291 1 1 6 MET HB3 H 3.773 5.204 -6.290 1.00 . A A . 6 MET HB3 1 1 10 4292 1 1 6 MET HE1 H 0.084 5.273 -8.219 1.00 . A A . 6 MET HE1 1 1 10 4293 1 1 6 MET HE2 H 0.257 3.520 -8.224 1.00 . A A . 6 MET HE2 1 1 10 4294 1 1 6 MET HE3 H 0.014 4.378 -9.744 1.00 . A A . 6 MET HE3 1 1 10 4295 1 1 6 MET HG2 H 3.706 3.260 -7.596 1.00 . A A . 6 MET HG2 1 1 10 4296 1 1 6 MET HG3 H 2.006 2.959 -7.234 1.00 . A A . 6 MET HG3 1 1 10 4297 1 1 6 MET N N 2.118 4.934 -3.989 1.00 . A A . 6 MET N 1 1 10 4298 1 1 6 MET O O 4.879 3.074 -5.255 1.00 . A A . 6 MET O 1 1 10 4299 1 1 6 MET SD S 2.265 4.607 -8.954 1.00 . A A . 6 MET SD 1 1 10 4300 1 1 7 ALA C C 5.549 1.255 -2.860 1.00 . A A . 7 ALA C 1 1 10 4301 1 1 7 ALA CA C 5.469 2.766 -2.627 1.00 . A A . 7 ALA CA 1 1 10 4302 1 1 7 ALA CB C 5.432 3.079 -1.129 1.00 . A A . 7 ALA CB 1 1 10 4303 1 1 7 ALA H H 3.459 3.554 -2.561 1.00 . A A . 7 ALA H 1 1 10 4304 1 1 7 ALA HA H 6.307 3.265 -3.089 1.00 . A A . 7 ALA HA 1 1 10 4305 1 1 7 ALA HB1 H 6.356 2.758 -0.672 1.00 . A A . 7 ALA HB1 1 1 10 4306 1 1 7 ALA HB2 H 4.604 2.558 -0.672 1.00 . A A . 7 ALA HB2 1 1 10 4307 1 1 7 ALA HB3 H 5.310 4.142 -0.986 1.00 . A A . 7 ALA HB3 1 1 10 4308 1 1 7 ALA N N 4.181 3.294 -3.174 1.00 . A A . 7 ALA N 1 1 10 4309 1 1 7 ALA O O 4.585 0.544 -2.667 1.00 . A A . 7 ALA O 1 1 10 4310 1 1 8 GLY C C 6.515 -1.490 -2.252 1.00 . A A . 8 GLY C 1 1 10 4311 1 1 8 GLY CA C 6.826 -0.704 -3.531 1.00 . A A . 8 GLY CA 1 1 10 4312 1 1 8 GLY H H 7.451 1.357 -3.429 1.00 . A A . 8 GLY H 1 1 10 4313 1 1 8 GLY HA2 H 6.135 -0.997 -4.309 1.00 . A A . 8 GLY HA2 1 1 10 4314 1 1 8 GLY HA3 H 7.835 -0.922 -3.845 1.00 . A A . 8 GLY HA3 1 1 10 4315 1 1 8 GLY N N 6.688 0.762 -3.277 1.00 . A A . 8 GLY N 1 1 10 4316 1 1 8 GLY O O 7.170 -1.328 -1.238 1.00 . A A . 8 GLY O 1 1 10 4317 1 1 9 CYS C C 5.828 -4.523 -1.164 1.00 . A A . 9 CYS C 1 1 10 4318 1 1 9 CYS CA C 5.151 -3.145 -1.096 1.00 . A A . 9 CYS CA 1 1 10 4319 1 1 9 CYS CB C 3.622 -3.267 -1.158 1.00 . A A . 9 CYS CB 1 1 10 4320 1 1 9 CYS H H 5.010 -2.448 -3.130 1.00 . A A . 9 CYS H 1 1 10 4321 1 1 9 CYS HA H 5.442 -2.630 -0.197 1.00 . A A . 9 CYS HA 1 1 10 4322 1 1 9 CYS HB2 H 3.175 -2.322 -0.884 1.00 . A A . 9 CYS HB2 1 1 10 4323 1 1 9 CYS HB3 H 3.322 -3.526 -2.163 1.00 . A A . 9 CYS HB3 1 1 10 4324 1 1 9 CYS N N 5.519 -2.339 -2.299 1.00 . A A . 9 CYS N 1 1 10 4325 1 1 9 CYS O O 6.820 -4.760 -0.501 1.00 . A A . 9 CYS O 1 1 10 4326 1 1 9 CYS SG S 3.059 -4.549 -0.011 1.00 . A A . 9 CYS SG 1 1 10 4327 1 1 10 ASP C C 6.101 -7.450 -0.732 1.00 . A A . 10 ASP C 1 1 10 4328 1 1 10 ASP CA C 5.898 -6.794 -2.106 1.00 . A A . 10 ASP CA 1 1 10 4329 1 1 10 ASP CB C 7.242 -6.582 -2.813 1.00 . A A . 10 ASP CB 1 1 10 4330 1 1 10 ASP CG C 7.020 -6.488 -4.323 1.00 . A A . 10 ASP CG 1 1 10 4331 1 1 10 ASP H H 4.507 -5.191 -2.490 1.00 . A A . 10 ASP H 1 1 10 4332 1 1 10 ASP HA H 5.262 -7.413 -2.717 1.00 . A A . 10 ASP HA 1 1 10 4333 1 1 10 ASP HB2 H 7.698 -5.669 -2.460 1.00 . A A . 10 ASP HB2 1 1 10 4334 1 1 10 ASP HB3 H 7.894 -7.415 -2.602 1.00 . A A . 10 ASP HB3 1 1 10 4335 1 1 10 ASP N N 5.301 -5.422 -1.968 1.00 . A A . 10 ASP N 1 1 10 4336 1 1 10 ASP O O 7.212 -7.563 -0.245 1.00 . A A . 10 ASP O 1 1 10 4337 1 1 10 ASP OD1 O 6.673 -5.412 -4.786 1.00 . A A . 10 ASP OD1 1 1 10 4338 1 1 10 ASP OD2 O 7.200 -7.494 -4.992 1.00 . A A . 10 ASP OD2 1 1 10 4339 1 1 11 GLY C C 3.977 -8.113 2.091 1.00 . A A . 11 GLY C 1 1 10 4340 1 1 11 GLY CA C 5.162 -8.532 1.225 1.00 . A A . 11 GLY CA 1 1 10 4341 1 1 11 GLY H H 4.151 -7.788 -0.516 1.00 . A A . 11 GLY H 1 1 10 4342 1 1 11 GLY HA2 H 5.165 -9.607 1.105 1.00 . A A . 11 GLY HA2 1 1 10 4343 1 1 11 GLY HA3 H 6.080 -8.217 1.697 1.00 . A A . 11 GLY HA3 1 1 10 4344 1 1 11 GLY N N 5.037 -7.886 -0.108 1.00 . A A . 11 GLY N 1 1 10 4345 1 1 11 GLY O O 3.767 -6.942 2.345 1.00 . A A . 11 GLY O 1 1 10 4346 1 1 12 LYS C C 2.463 -8.078 4.720 1.00 . A A . 12 LYS C 1 1 10 4347 1 1 12 LYS CA C 2.020 -8.740 3.401 1.00 . A A . 12 LYS CA 1 1 10 4348 1 1 12 LYS CB C 1.350 -10.088 3.668 1.00 . A A . 12 LYS CB 1 1 10 4349 1 1 12 LYS CD C 0.886 -12.046 2.169 1.00 . A A . 12 LYS CD 1 1 10 4350 1 1 12 LYS CE C 2.148 -12.217 1.314 1.00 . A A . 12 LYS CE 1 1 10 4351 1 1 12 LYS CG C 0.615 -10.556 2.405 1.00 . A A . 12 LYS CG 1 1 10 4352 1 1 12 LYS H H 3.400 -9.998 2.322 1.00 . A A . 12 LYS H 1 1 10 4353 1 1 12 LYS HA H 1.340 -8.094 2.868 1.00 . A A . 12 LYS HA 1 1 10 4354 1 1 12 LYS HB2 H 2.104 -10.814 3.937 1.00 . A A . 12 LYS HB2 1 1 10 4355 1 1 12 LYS HB3 H 0.643 -9.986 4.476 1.00 . A A . 12 LYS HB3 1 1 10 4356 1 1 12 LYS HD2 H 1.027 -12.540 3.120 1.00 . A A . 12 LYS HD2 1 1 10 4357 1 1 12 LYS HD3 H 0.045 -12.487 1.656 1.00 . A A . 12 LYS HD3 1 1 10 4358 1 1 12 LYS HE2 H 1.972 -12.937 0.526 1.00 . A A . 12 LYS HE2 1 1 10 4359 1 1 12 LYS HE3 H 2.453 -11.270 0.896 1.00 . A A . 12 LYS HE3 1 1 10 4360 1 1 12 LYS HG2 H -0.448 -10.400 2.531 1.00 . A A . 12 LYS HG2 1 1 10 4361 1 1 12 LYS HG3 H 0.963 -9.989 1.555 1.00 . A A . 12 LYS HG3 1 1 10 4362 1 1 12 LYS HZ1 H 2.900 -13.643 2.634 1.00 . A A . 12 LYS HZ1 1 1 10 4363 1 1 12 LYS HZ2 H 3.305 -12.043 3.039 1.00 . A A . 12 LYS HZ2 1 1 10 4364 1 1 12 LYS HZ3 H 4.093 -12.821 1.751 1.00 . A A . 12 LYS HZ3 1 1 10 4365 1 1 12 LYS N N 3.203 -9.065 2.545 1.00 . A A . 12 LYS N 1 1 10 4366 1 1 12 LYS NZ N 3.190 -12.719 2.256 1.00 . A A . 12 LYS NZ 1 1 10 4367 1 1 12 LYS O O 1.657 -7.501 5.426 1.00 . A A . 12 LYS O 1 1 10 4368 1 1 13 SER C C 5.009 -6.228 6.002 1.00 . A A . 13 SER C 1 1 10 4369 1 1 13 SER CA C 4.225 -7.512 6.315 1.00 . A A . 13 SER CA 1 1 10 4370 1 1 13 SER CB C 5.142 -8.555 6.958 1.00 . A A . 13 SER CB 1 1 10 4371 1 1 13 SER H H 4.369 -8.609 4.464 1.00 . A A . 13 SER H 1 1 10 4372 1 1 13 SER HA H 3.398 -7.295 6.973 1.00 . A A . 13 SER HA 1 1 10 4373 1 1 13 SER HB2 H 4.709 -9.536 6.847 1.00 . A A . 13 SER HB2 1 1 10 4374 1 1 13 SER HB3 H 6.109 -8.533 6.472 1.00 . A A . 13 SER HB3 1 1 10 4375 1 1 13 SER HG H 6.215 -8.336 8.568 1.00 . A A . 13 SER HG 1 1 10 4376 1 1 13 SER N N 3.735 -8.147 5.051 1.00 . A A . 13 SER N 1 1 10 4377 1 1 13 SER O O 5.880 -5.828 6.752 1.00 . A A . 13 SER O 1 1 10 4378 1 1 13 SER OG O 5.285 -8.261 8.343 1.00 . A A . 13 SER OG 1 1 10 4379 1 1 14 THR C C 5.054 -3.185 5.511 1.00 . A A . 14 THR C 1 1 10 4380 1 1 14 THR CA C 5.429 -4.317 4.541 1.00 . A A . 14 THR CA 1 1 10 4381 1 1 14 THR CB C 4.981 -3.989 3.107 1.00 . A A . 14 THR CB 1 1 10 4382 1 1 14 THR CG2 C 3.511 -3.555 3.099 1.00 . A A . 14 THR CG2 1 1 10 4383 1 1 14 THR H H 3.997 -5.918 4.313 1.00 . A A . 14 THR H 1 1 10 4384 1 1 14 THR HA H 6.495 -4.482 4.561 1.00 . A A . 14 THR HA 1 1 10 4385 1 1 14 THR HB H 5.094 -4.866 2.487 1.00 . A A . 14 THR HB 1 1 10 4386 1 1 14 THR HG1 H 6.526 -3.335 2.123 1.00 . A A . 14 THR HG1 1 1 10 4387 1 1 14 THR HG21 H 2.878 -4.427 3.186 1.00 . A A . 14 THR HG21 1 1 10 4388 1 1 14 THR HG22 H 3.293 -3.042 2.174 1.00 . A A . 14 THR HG22 1 1 10 4389 1 1 14 THR HG23 H 3.325 -2.893 3.931 1.00 . A A . 14 THR HG23 1 1 10 4390 1 1 14 THR N N 4.705 -5.577 4.902 1.00 . A A . 14 THR N 1 1 10 4391 1 1 14 THR O O 4.295 -3.380 6.445 1.00 . A A . 14 THR O 1 1 10 4392 1 1 14 THR OG1 O 5.786 -2.939 2.589 1.00 . A A . 14 THR OG1 1 1 10 4393 1 1 15 PHE C C 5.013 0.417 5.403 1.00 . A A . 15 PHE C 1 1 10 4394 1 1 15 PHE CA C 5.268 -0.863 6.208 1.00 . A A . 15 PHE CA 1 1 10 4395 1 1 15 PHE CB C 6.502 -0.705 7.116 1.00 . A A . 15 PHE CB 1 1 10 4396 1 1 15 PHE CD1 C 8.235 0.653 5.869 1.00 . A A . 15 PHE CD1 1 1 10 4397 1 1 15 PHE CD2 C 8.486 -1.758 5.950 1.00 . A A . 15 PHE CD2 1 1 10 4398 1 1 15 PHE CE1 C 9.409 0.749 5.111 1.00 . A A . 15 PHE CE1 1 1 10 4399 1 1 15 PHE CE2 C 9.659 -1.661 5.191 1.00 . A A . 15 PHE CE2 1 1 10 4400 1 1 15 PHE CG C 7.771 -0.601 6.290 1.00 . A A . 15 PHE CG 1 1 10 4401 1 1 15 PHE CZ C 10.120 -0.408 4.772 1.00 . A A . 15 PHE CZ 1 1 10 4402 1 1 15 PHE H H 6.195 -1.876 4.542 1.00 . A A . 15 PHE H 1 1 10 4403 1 1 15 PHE HA H 4.404 -1.098 6.810 1.00 . A A . 15 PHE HA 1 1 10 4404 1 1 15 PHE HB2 H 6.392 0.189 7.711 1.00 . A A . 15 PHE HB2 1 1 10 4405 1 1 15 PHE HB3 H 6.573 -1.560 7.772 1.00 . A A . 15 PHE HB3 1 1 10 4406 1 1 15 PHE HD1 H 7.687 1.546 6.130 1.00 . A A . 15 PHE HD1 1 1 10 4407 1 1 15 PHE HD2 H 8.131 -2.725 6.274 1.00 . A A . 15 PHE HD2 1 1 10 4408 1 1 15 PHE HE1 H 9.766 1.715 4.787 1.00 . A A . 15 PHE HE1 1 1 10 4409 1 1 15 PHE HE2 H 10.208 -2.553 4.930 1.00 . A A . 15 PHE HE2 1 1 10 4410 1 1 15 PHE HZ H 11.025 -0.335 4.186 1.00 . A A . 15 PHE HZ 1 1 10 4411 1 1 15 PHE N N 5.584 -2.007 5.298 1.00 . A A . 15 PHE N 1 1 10 4412 1 1 15 PHE O O 5.605 0.638 4.363 1.00 . A A . 15 PHE O 1 1 10 4413 1 1 16 CYS C C 3.860 3.712 6.151 1.00 . A A . 16 CYS C 1 1 10 4414 1 1 16 CYS CA C 3.828 2.531 5.167 1.00 . A A . 16 CYS CA 1 1 10 4415 1 1 16 CYS CB C 2.424 2.337 4.586 1.00 . A A . 16 CYS CB 1 1 10 4416 1 1 16 CYS H H 3.671 1.052 6.727 1.00 . A A . 16 CYS H 1 1 10 4417 1 1 16 CYS HA H 4.536 2.691 4.369 1.00 . A A . 16 CYS HA 1 1 10 4418 1 1 16 CYS HB2 H 2.174 1.287 4.586 1.00 . A A . 16 CYS HB2 1 1 10 4419 1 1 16 CYS HB3 H 1.706 2.878 5.185 1.00 . A A . 16 CYS HB3 1 1 10 4420 1 1 16 CYS N N 4.132 1.259 5.886 1.00 . A A . 16 CYS N 1 1 10 4421 1 1 16 CYS O O 4.479 3.636 7.196 1.00 . A A . 16 CYS O 1 1 10 4422 1 1 16 CYS SG S 2.390 2.967 2.890 1.00 . A A . 16 CYS SG 1 1 10 4423 1 1 17 CYS C C 2.189 5.788 7.870 1.00 . A A . 17 CYS C 1 1 10 4424 1 1 17 CYS CA C 3.203 5.984 6.737 1.00 . A A . 17 CYS CA 1 1 10 4425 1 1 17 CYS CB C 2.810 7.176 5.856 1.00 . A A . 17 CYS CB 1 1 10 4426 1 1 17 CYS H H 2.716 4.840 4.974 1.00 . A A . 17 CYS H 1 1 10 4427 1 1 17 CYS HA H 4.186 6.142 7.144 1.00 . A A . 17 CYS HA 1 1 10 4428 1 1 17 CYS HB2 H 2.781 6.867 4.822 1.00 . A A . 17 CYS HB2 1 1 10 4429 1 1 17 CYS HB3 H 1.835 7.537 6.150 1.00 . A A . 17 CYS HB3 1 1 10 4430 1 1 17 CYS N N 3.204 4.800 5.823 1.00 . A A . 17 CYS N 1 1 10 4431 1 1 17 CYS O O 2.556 5.646 9.022 1.00 . A A . 17 CYS O 1 1 10 4432 1 1 17 CYS SG S 4.027 8.502 6.054 1.00 . A A . 17 CYS SG 1 1 10 4433 1 1 18 SER C C -1.493 5.352 7.940 1.00 . A A . 18 SER C 1 1 10 4434 1 1 18 SER CA C -0.133 5.603 8.599 1.00 . A A . 18 SER CA 1 1 10 4435 1 1 18 SER CB C -0.150 6.917 9.391 1.00 . A A . 18 SER CB 1 1 10 4436 1 1 18 SER H H 0.660 5.902 6.615 1.00 . A A . 18 SER H 1 1 10 4437 1 1 18 SER HA H 0.123 4.785 9.251 1.00 . A A . 18 SER HA 1 1 10 4438 1 1 18 SER HB2 H -1.023 6.945 10.025 1.00 . A A . 18 SER HB2 1 1 10 4439 1 1 18 SER HB3 H 0.739 6.973 10.007 1.00 . A A . 18 SER HB3 1 1 10 4440 1 1 18 SER HG H -1.068 8.412 8.542 1.00 . A A . 18 SER HG 1 1 10 4441 1 1 18 SER N N 0.921 5.784 7.550 1.00 . A A . 18 SER N 1 1 10 4442 1 1 18 SER O O -2.203 4.428 8.290 1.00 . A A . 18 SER O 1 1 10 4443 1 1 18 SER OG O -0.192 8.020 8.491 1.00 . A A . 18 SER OG 1 1 10 4444 1 1 19 GLY C C -2.928 5.341 4.906 1.00 . A A . 19 GLY C 1 1 10 4445 1 1 19 GLY CA C -3.154 5.995 6.276 1.00 . A A . 19 GLY CA 1 1 10 4446 1 1 19 GLY H H -1.251 6.898 6.721 1.00 . A A . 19 GLY H 1 1 10 4447 1 1 19 GLY HA2 H -3.804 5.369 6.872 1.00 . A A . 19 GLY HA2 1 1 10 4448 1 1 19 GLY HA3 H -3.616 6.961 6.136 1.00 . A A . 19 GLY HA3 1 1 10 4449 1 1 19 GLY N N -1.849 6.169 6.981 1.00 . A A . 19 GLY N 1 1 10 4450 1 1 19 GLY O O -3.725 5.501 4.002 1.00 . A A . 19 GLY O 1 1 10 4451 1 1 20 TYR C C -1.452 2.418 3.641 1.00 . A A . 20 TYR C 1 1 10 4452 1 1 20 TYR CA C -1.588 3.933 3.436 1.00 . A A . 20 TYR CA 1 1 10 4453 1 1 20 TYR CB C -0.268 4.529 2.928 1.00 . A A . 20 TYR CB 1 1 10 4454 1 1 20 TYR CD1 C -1.295 6.193 1.334 1.00 . A A . 20 TYR CD1 1 1 10 4455 1 1 20 TYR CD2 C 0.090 7.021 3.145 1.00 . A A . 20 TYR CD2 1 1 10 4456 1 1 20 TYR CE1 C -1.513 7.505 0.899 1.00 . A A . 20 TYR CE1 1 1 10 4457 1 1 20 TYR CE2 C -0.126 8.335 2.708 1.00 . A A . 20 TYR CE2 1 1 10 4458 1 1 20 TYR CG C -0.495 5.949 2.457 1.00 . A A . 20 TYR CG 1 1 10 4459 1 1 20 TYR CZ C -0.929 8.575 1.585 1.00 . A A . 20 TYR CZ 1 1 10 4460 1 1 20 TYR H H -1.225 4.481 5.488 1.00 . A A . 20 TYR H 1 1 10 4461 1 1 20 TYR HA H -2.381 4.149 2.737 1.00 . A A . 20 TYR HA 1 1 10 4462 1 1 20 TYR HB2 H 0.459 4.524 3.726 1.00 . A A . 20 TYR HB2 1 1 10 4463 1 1 20 TYR HB3 H 0.099 3.933 2.105 1.00 . A A . 20 TYR HB3 1 1 10 4464 1 1 20 TYR HD1 H -1.744 5.369 0.802 1.00 . A A . 20 TYR HD1 1 1 10 4465 1 1 20 TYR HD2 H 0.709 6.836 4.010 1.00 . A A . 20 TYR HD2 1 1 10 4466 1 1 20 TYR HE1 H -2.129 7.692 0.032 1.00 . A A . 20 TYR HE1 1 1 10 4467 1 1 20 TYR HE2 H 0.324 9.162 3.236 1.00 . A A . 20 TYR HE2 1 1 10 4468 1 1 20 TYR HH H -1.966 10.179 1.570 1.00 . A A . 20 TYR HH 1 1 10 4469 1 1 20 TYR N N -1.854 4.601 4.746 1.00 . A A . 20 TYR N 1 1 10 4470 1 1 20 TYR O O -0.719 1.963 4.500 1.00 . A A . 20 TYR O 1 1 10 4471 1 1 20 TYR OH O -1.151 9.869 1.161 1.00 . A A . 20 TYR OH 1 1 10 4472 1 1 21 ASN C C -1.515 -0.473 1.719 1.00 . A A . 21 ASN C 1 1 10 4473 1 1 21 ASN CA C -2.086 0.149 3.000 1.00 . A A . 21 ASN CA 1 1 10 4474 1 1 21 ASN CB C -3.533 -0.298 3.217 1.00 . A A . 21 ASN CB 1 1 10 4475 1 1 21 ASN CG C -3.564 -1.498 4.168 1.00 . A A . 21 ASN CG 1 1 10 4476 1 1 21 ASN H H -2.743 2.031 2.178 1.00 . A A . 21 ASN H 1 1 10 4477 1 1 21 ASN HA H -1.482 -0.122 3.853 1.00 . A A . 21 ASN HA 1 1 10 4478 1 1 21 ASN HB2 H -4.100 0.515 3.644 1.00 . A A . 21 ASN HB2 1 1 10 4479 1 1 21 ASN HB3 H -3.967 -0.582 2.270 1.00 . A A . 21 ASN HB3 1 1 10 4480 1 1 21 ASN HD21 H -4.253 -2.757 2.793 1.00 . A A . 21 ASN HD21 1 1 10 4481 1 1 21 ASN HD22 H -3.995 -3.430 4.328 1.00 . A A . 21 ASN HD22 1 1 10 4482 1 1 21 ASN N N -2.159 1.637 2.861 1.00 . A A . 21 ASN N 1 1 10 4483 1 1 21 ASN ND2 N -3.971 -2.658 3.726 1.00 . A A . 21 ASN ND2 1 1 10 4484 1 1 21 ASN O O -1.477 0.155 0.683 1.00 . A A . 21 ASN O 1 1 10 4485 1 1 21 ASN OD1 O -3.216 -1.378 5.327 1.00 . A A . 21 ASN OD1 1 1 10 4486 1 1 22 CYS C C -1.588 -3.082 -0.230 1.00 . A A . 22 CYS C 1 1 10 4487 1 1 22 CYS CA C -0.493 -2.367 0.574 1.00 . A A . 22 CYS CA 1 1 10 4488 1 1 22 CYS CB C 0.514 -3.377 1.132 1.00 . A A . 22 CYS CB 1 1 10 4489 1 1 22 CYS H H -1.112 -2.190 2.638 1.00 . A A . 22 CYS H 1 1 10 4490 1 1 22 CYS HA H 0.017 -1.644 -0.044 1.00 . A A . 22 CYS HA 1 1 10 4491 1 1 22 CYS HB2 H 1.372 -2.850 1.521 1.00 . A A . 22 CYS HB2 1 1 10 4492 1 1 22 CYS HB3 H 0.051 -3.943 1.927 1.00 . A A . 22 CYS HB3 1 1 10 4493 1 1 22 CYS N N -1.071 -1.703 1.787 1.00 . A A . 22 CYS N 1 1 10 4494 1 1 22 CYS O O -2.447 -3.742 0.326 1.00 . A A . 22 CYS O 1 1 10 4495 1 1 22 CYS SG S 1.047 -4.506 -0.181 1.00 . A A . 22 CYS SG 1 1 10 4496 1 1 23 SER C C -2.079 -5.011 -2.843 1.00 . A A . 23 SER C 1 1 10 4497 1 1 23 SER CA C -2.590 -3.636 -2.387 1.00 . A A . 23 SER CA 1 1 10 4498 1 1 23 SER CB C -2.804 -2.722 -3.594 1.00 . A A . 23 SER CB 1 1 10 4499 1 1 23 SER H H -0.851 -2.425 -1.963 1.00 . A A . 23 SER H 1 1 10 4500 1 1 23 SER HA H -3.512 -3.741 -1.838 1.00 . A A . 23 SER HA 1 1 10 4501 1 1 23 SER HB2 H -2.692 -1.692 -3.299 1.00 . A A . 23 SER HB2 1 1 10 4502 1 1 23 SER HB3 H -2.074 -2.955 -4.359 1.00 . A A . 23 SER HB3 1 1 10 4503 1 1 23 SER HG H -4.057 -3.513 -4.854 1.00 . A A . 23 SER HG 1 1 10 4504 1 1 23 SER N N -1.557 -2.958 -1.539 1.00 . A A . 23 SER N 1 1 10 4505 1 1 23 SER O O -0.904 -5.171 -3.122 1.00 . A A . 23 SER O 1 1 10 4506 1 1 23 SER OG O -4.117 -2.921 -4.102 1.00 . A A . 23 SER OG 1 1 10 4507 1 1 24 PRO C C -2.361 -7.422 -4.840 1.00 . A A . 24 PRO C 1 1 10 4508 1 1 24 PRO CA C -2.614 -7.341 -3.323 1.00 . A A . 24 PRO CA 1 1 10 4509 1 1 24 PRO CB C -3.839 -8.169 -2.936 1.00 . A A . 24 PRO CB 1 1 10 4510 1 1 24 PRO CD C -4.413 -5.848 -2.578 1.00 . A A . 24 PRO CD 1 1 10 4511 1 1 24 PRO CG C -4.980 -7.202 -2.923 1.00 . A A . 24 PRO CG 1 1 10 4512 1 1 24 PRO HA H -1.753 -7.686 -2.777 1.00 . A A . 24 PRO HA 1 1 10 4513 1 1 24 PRO HB2 H -4.011 -8.946 -3.668 1.00 . A A . 24 PRO HB2 1 1 10 4514 1 1 24 PRO HB3 H -3.708 -8.599 -1.955 1.00 . A A . 24 PRO HB3 1 1 10 4515 1 1 24 PRO HD2 H -4.881 -5.081 -3.179 1.00 . A A . 24 PRO HD2 1 1 10 4516 1 1 24 PRO HD3 H -4.541 -5.640 -1.528 1.00 . A A . 24 PRO HD3 1 1 10 4517 1 1 24 PRO HG2 H -5.447 -7.171 -3.897 1.00 . A A . 24 PRO HG2 1 1 10 4518 1 1 24 PRO HG3 H -5.701 -7.493 -2.176 1.00 . A A . 24 PRO HG3 1 1 10 4519 1 1 24 PRO N N -2.981 -5.962 -2.900 1.00 . A A . 24 PRO N 1 1 10 4520 1 1 24 PRO O O -1.700 -8.330 -5.308 1.00 . A A . 24 PRO O 1 1 10 4521 1 1 25 THR C C -1.754 -5.421 -7.569 1.00 . A A . 25 THR C 1 1 10 4522 1 1 25 THR CA C -2.685 -6.546 -7.095 1.00 . A A . 25 THR CA 1 1 10 4523 1 1 25 THR CB C -4.085 -6.367 -7.694 1.00 . A A . 25 THR CB 1 1 10 4524 1 1 25 THR CG2 C -4.013 -6.470 -9.219 1.00 . A A . 25 THR CG2 1 1 10 4525 1 1 25 THR H H -3.428 -5.780 -5.216 1.00 . A A . 25 THR H 1 1 10 4526 1 1 25 THR HA H -2.286 -7.502 -7.384 1.00 . A A . 25 THR HA 1 1 10 4527 1 1 25 THR HB H -4.469 -5.396 -7.423 1.00 . A A . 25 THR HB 1 1 10 4528 1 1 25 THR HG1 H -4.671 -8.221 -7.542 1.00 . A A . 25 THR HG1 1 1 10 4529 1 1 25 THR HG21 H -3.378 -7.299 -9.494 1.00 . A A . 25 THR HG21 1 1 10 4530 1 1 25 THR HG22 H -3.607 -5.555 -9.625 1.00 . A A . 25 THR HG22 1 1 10 4531 1 1 25 THR HG23 H -5.005 -6.630 -9.617 1.00 . A A . 25 THR HG23 1 1 10 4532 1 1 25 THR N N -2.888 -6.498 -5.610 1.00 . A A . 25 THR N 1 1 10 4533 1 1 25 THR O O -0.943 -5.613 -8.455 1.00 . A A . 25 THR O 1 1 10 4534 1 1 25 THR OG1 O -4.953 -7.375 -7.186 1.00 . A A . 25 THR OG1 1 1 10 4535 1 1 26 TRP C C 0.438 -3.301 -6.938 1.00 . A A . 26 TRP C 1 1 10 4536 1 1 26 TRP CA C -1.002 -3.105 -7.426 1.00 . A A . 26 TRP CA 1 1 10 4537 1 1 26 TRP CB C -1.616 -1.855 -6.787 1.00 . A A . 26 TRP CB 1 1 10 4538 1 1 26 TRP CD1 C -3.621 -2.303 -8.274 1.00 . A A . 26 TRP CD1 1 1 10 4539 1 1 26 TRP CD2 C -4.123 -0.982 -6.523 1.00 . A A . 26 TRP CD2 1 1 10 4540 1 1 26 TRP CE2 C -5.318 -1.155 -7.259 1.00 . A A . 26 TRP CE2 1 1 10 4541 1 1 26 TRP CE3 C -4.169 -0.182 -5.367 1.00 . A A . 26 TRP CE3 1 1 10 4542 1 1 26 TRP CG C -3.057 -1.725 -7.187 1.00 . A A . 26 TRP CG 1 1 10 4543 1 1 26 TRP CH2 C -6.543 0.232 -5.711 1.00 . A A . 26 TRP CH2 1 1 10 4544 1 1 26 TRP CZ2 C -6.516 -0.560 -6.862 1.00 . A A . 26 TRP CZ2 1 1 10 4545 1 1 26 TRP CZ3 C -5.372 0.420 -4.964 1.00 . A A . 26 TRP CZ3 1 1 10 4546 1 1 26 TRP H H -2.540 -4.121 -6.291 1.00 . A A . 26 TRP H 1 1 10 4547 1 1 26 TRP HA H -1.018 -3.008 -8.500 1.00 . A A . 26 TRP HA 1 1 10 4548 1 1 26 TRP HB2 H -1.545 -1.929 -5.714 1.00 . A A . 26 TRP HB2 1 1 10 4549 1 1 26 TRP HB3 H -1.072 -0.986 -7.119 1.00 . A A . 26 TRP HB3 1 1 10 4550 1 1 26 TRP HD1 H -3.109 -2.929 -8.989 1.00 . A A . 26 TRP HD1 1 1 10 4551 1 1 26 TRP HE1 H -5.592 -2.272 -8.994 1.00 . A A . 26 TRP HE1 1 1 10 4552 1 1 26 TRP HE3 H -3.272 -0.031 -4.784 1.00 . A A . 26 TRP HE3 1 1 10 4553 1 1 26 TRP HH2 H -7.466 0.697 -5.396 1.00 . A A . 26 TRP HH2 1 1 10 4554 1 1 26 TRP HZ2 H -7.415 -0.707 -7.441 1.00 . A A . 26 TRP HZ2 1 1 10 4555 1 1 26 TRP HZ3 H -5.396 1.031 -4.074 1.00 . A A . 26 TRP HZ3 1 1 10 4556 1 1 26 TRP N N -1.873 -4.250 -6.997 1.00 . A A . 26 TRP N 1 1 10 4557 1 1 26 TRP NE1 N -4.960 -1.973 -8.312 1.00 . A A . 26 TRP NE1 1 1 10 4558 1 1 26 TRP O O 1.359 -2.712 -7.471 1.00 . A A . 26 TRP O 1 1 10 4559 1 1 27 LYS C C 2.623 -3.115 -4.770 1.00 . A A . 27 LYS C 1 1 10 4560 1 1 27 LYS CA C 2.009 -4.378 -5.396 1.00 . A A . 27 LYS CA 1 1 10 4561 1 1 27 LYS CB C 2.842 -4.854 -6.597 1.00 . A A . 27 LYS CB 1 1 10 4562 1 1 27 LYS CD C 3.939 -6.785 -5.457 1.00 . A A . 27 LYS CD 1 1 10 4563 1 1 27 LYS CE C 3.402 -8.018 -4.723 1.00 . A A . 27 LYS CE 1 1 10 4564 1 1 27 LYS CG C 2.962 -6.378 -6.561 1.00 . A A . 27 LYS CG 1 1 10 4565 1 1 27 LYS H H -0.130 -4.583 -5.525 1.00 . A A . 27 LYS H 1 1 10 4566 1 1 27 LYS HA H 1.970 -5.164 -4.659 1.00 . A A . 27 LYS HA 1 1 10 4567 1 1 27 LYS HB2 H 2.360 -4.555 -7.516 1.00 . A A . 27 LYS HB2 1 1 10 4568 1 1 27 LYS HB3 H 3.828 -4.417 -6.550 1.00 . A A . 27 LYS HB3 1 1 10 4569 1 1 27 LYS HD2 H 4.900 -7.015 -5.895 1.00 . A A . 27 LYS HD2 1 1 10 4570 1 1 27 LYS HD3 H 4.049 -5.972 -4.755 1.00 . A A . 27 LYS HD3 1 1 10 4571 1 1 27 LYS HE2 H 3.615 -7.945 -3.665 1.00 . A A . 27 LYS HE2 1 1 10 4572 1 1 27 LYS HE3 H 2.340 -8.121 -4.886 1.00 . A A . 27 LYS HE3 1 1 10 4573 1 1 27 LYS HG2 H 1.990 -6.810 -6.364 1.00 . A A . 27 LYS HG2 1 1 10 4574 1 1 27 LYS HG3 H 3.327 -6.733 -7.512 1.00 . A A . 27 LYS HG3 1 1 10 4575 1 1 27 LYS HZ1 H 3.513 -10.020 -5.289 1.00 . A A . 27 LYS HZ1 1 1 10 4576 1 1 27 LYS HZ2 H 4.994 -9.362 -4.777 1.00 . A A . 27 LYS HZ2 1 1 10 4577 1 1 27 LYS HZ3 H 4.370 -8.970 -6.311 1.00 . A A . 27 LYS HZ3 1 1 10 4578 1 1 27 LYS N N 0.634 -4.123 -5.932 1.00 . A A . 27 LYS N 1 1 10 4579 1 1 27 LYS NZ N 4.125 -9.180 -5.321 1.00 . A A . 27 LYS NZ 1 1 10 4580 1 1 27 LYS O O 3.814 -3.068 -4.519 1.00 . A A . 27 LYS O 1 1 10 4581 1 1 28 TRP C C 1.442 -0.320 -2.786 1.00 . A A . 28 TRP C 1 1 10 4582 1 1 28 TRP CA C 2.405 -0.879 -3.842 1.00 . A A . 28 TRP CA 1 1 10 4583 1 1 28 TRP CB C 2.678 0.137 -4.969 1.00 . A A . 28 TRP CB 1 1 10 4584 1 1 28 TRP CD1 C 0.339 1.126 -5.101 1.00 . A A . 28 TRP CD1 1 1 10 4585 1 1 28 TRP CD2 C 1.134 0.494 -7.106 1.00 . A A . 28 TRP CD2 1 1 10 4586 1 1 28 TRP CE2 C -0.154 1.029 -7.332 1.00 . A A . 28 TRP CE2 1 1 10 4587 1 1 28 TRP CE3 C 1.856 0.022 -8.214 1.00 . A A . 28 TRP CE3 1 1 10 4588 1 1 28 TRP CG C 1.424 0.559 -5.679 1.00 . A A . 28 TRP CG 1 1 10 4589 1 1 28 TRP CH2 C 0.028 0.625 -9.701 1.00 . A A . 28 TRP CH2 1 1 10 4590 1 1 28 TRP CZ2 C -0.705 1.098 -8.611 1.00 . A A . 28 TRP CZ2 1 1 10 4591 1 1 28 TRP CZ3 C 1.307 0.088 -9.504 1.00 . A A . 28 TRP CZ3 1 1 10 4592 1 1 28 TRP H H 0.873 -2.156 -4.667 1.00 . A A . 28 TRP H 1 1 10 4593 1 1 28 TRP HA H 3.341 -1.134 -3.365 1.00 . A A . 28 TRP HA 1 1 10 4594 1 1 28 TRP HB2 H 3.145 1.011 -4.546 1.00 . A A . 28 TRP HB2 1 1 10 4595 1 1 28 TRP HB3 H 3.355 -0.308 -5.685 1.00 . A A . 28 TRP HB3 1 1 10 4596 1 1 28 TRP HD1 H 0.221 1.325 -4.047 1.00 . A A . 28 TRP HD1 1 1 10 4597 1 1 28 TRP HE1 H -1.475 1.807 -5.929 1.00 . A A . 28 TRP HE1 1 1 10 4598 1 1 28 TRP HE3 H 2.838 -0.397 -8.070 1.00 . A A . 28 TRP HE3 1 1 10 4599 1 1 28 TRP HH2 H -0.390 0.673 -10.696 1.00 . A A . 28 TRP HH2 1 1 10 4600 1 1 28 TRP HZ2 H -1.691 1.513 -8.757 1.00 . A A . 28 TRP HZ2 1 1 10 4601 1 1 28 TRP HZ3 H 1.873 -0.278 -10.348 1.00 . A A . 28 TRP HZ3 1 1 10 4602 1 1 28 TRP N N 1.834 -2.102 -4.483 1.00 . A A . 28 TRP N 1 1 10 4603 1 1 28 TRP NE1 N -0.599 1.400 -6.082 1.00 . A A . 28 TRP NE1 1 1 10 4604 1 1 28 TRP O O 0.274 -0.662 -2.750 1.00 . A A . 28 TRP O 1 1 10 4605 1 1 29 CYS C C 0.097 2.130 -1.429 1.00 . A A . 29 CYS C 1 1 10 4606 1 1 29 CYS CA C 1.068 1.100 -0.841 1.00 . A A . 29 CYS CA 1 1 10 4607 1 1 29 CYS CB C 2.032 1.768 0.143 1.00 . A A . 29 CYS CB 1 1 10 4608 1 1 29 CYS H H 2.883 0.771 -1.959 1.00 . A A . 29 CYS H 1 1 10 4609 1 1 29 CYS HA H 0.523 0.314 -0.341 1.00 . A A . 29 CYS HA 1 1 10 4610 1 1 29 CYS HB2 H 3.011 1.325 0.046 1.00 . A A . 29 CYS HB2 1 1 10 4611 1 1 29 CYS HB3 H 2.093 2.824 -0.074 1.00 . A A . 29 CYS HB3 1 1 10 4612 1 1 29 CYS N N 1.935 0.524 -1.914 1.00 . A A . 29 CYS N 1 1 10 4613 1 1 29 CYS O O 0.460 2.929 -2.265 1.00 . A A . 29 CYS O 1 1 10 4614 1 1 29 CYS SG S 1.433 1.535 1.835 1.00 . A A . 29 CYS SG 1 1 10 4615 1 1 30 VAL C C -2.959 3.628 -0.301 1.00 . A A . 30 VAL C 1 1 10 4616 1 1 30 VAL CA C -2.157 3.082 -1.483 1.00 . A A . 30 VAL CA 1 1 10 4617 1 1 30 VAL CB C -3.082 2.281 -2.414 1.00 . A A . 30 VAL CB 1 1 10 4618 1 1 30 VAL CG1 C -2.375 2.009 -3.738 1.00 . A A . 30 VAL CG1 1 1 10 4619 1 1 30 VAL CG2 C -3.465 0.947 -1.760 1.00 . A A . 30 VAL CG2 1 1 10 4620 1 1 30 VAL H H -1.384 1.459 -0.294 1.00 . A A . 30 VAL H 1 1 10 4621 1 1 30 VAL HA H -1.686 3.886 -2.026 1.00 . A A . 30 VAL HA 1 1 10 4622 1 1 30 VAL HB H -3.977 2.856 -2.604 1.00 . A A . 30 VAL HB 1 1 10 4623 1 1 30 VAL HG11 H -1.882 1.050 -3.693 1.00 . A A . 30 VAL HG11 1 1 10 4624 1 1 30 VAL HG12 H -1.644 2.783 -3.924 1.00 . A A . 30 VAL HG12 1 1 10 4625 1 1 30 VAL HG13 H -3.102 2.002 -4.537 1.00 . A A . 30 VAL HG13 1 1 10 4626 1 1 30 VAL HG21 H -2.654 0.243 -1.875 1.00 . A A . 30 VAL HG21 1 1 10 4627 1 1 30 VAL HG22 H -4.352 0.554 -2.237 1.00 . A A . 30 VAL HG22 1 1 10 4628 1 1 30 VAL HG23 H -3.661 1.103 -0.710 1.00 . A A . 30 VAL HG23 1 1 10 4629 1 1 30 VAL N N -1.132 2.112 -0.980 1.00 . A A . 30 VAL N 1 1 10 4630 1 1 30 VAL O O -2.711 3.278 0.833 1.00 . A A . 30 VAL O 1 1 10 4631 1 1 31 TYR C C -5.426 3.888 1.341 1.00 . A A . 31 TYR C 1 1 10 4632 1 1 31 TYR CA C -4.747 5.029 0.565 1.00 . A A . 31 TYR CA 1 1 10 4633 1 1 31 TYR CB C -5.789 5.925 -0.115 1.00 . A A . 31 TYR CB 1 1 10 4634 1 1 31 TYR CD1 C -5.904 7.470 1.878 1.00 . A A . 31 TYR CD1 1 1 10 4635 1 1 31 TYR CD2 C -7.971 6.599 0.952 1.00 . A A . 31 TYR CD2 1 1 10 4636 1 1 31 TYR CE1 C -6.634 8.170 2.846 1.00 . A A . 31 TYR CE1 1 1 10 4637 1 1 31 TYR CE2 C -8.700 7.299 1.920 1.00 . A A . 31 TYR CE2 1 1 10 4638 1 1 31 TYR CG C -6.573 6.683 0.931 1.00 . A A . 31 TYR CG 1 1 10 4639 1 1 31 TYR CZ C -8.031 8.085 2.867 1.00 . A A . 31 TYR CZ 1 1 10 4640 1 1 31 TYR H H -4.114 4.739 -1.481 1.00 . A A . 31 TYR H 1 1 10 4641 1 1 31 TYR HA H -4.129 5.616 1.227 1.00 . A A . 31 TYR HA 1 1 10 4642 1 1 31 TYR HB2 H -5.287 6.625 -0.766 1.00 . A A . 31 TYR HB2 1 1 10 4643 1 1 31 TYR HB3 H -6.463 5.314 -0.696 1.00 . A A . 31 TYR HB3 1 1 10 4644 1 1 31 TYR HD1 H -4.826 7.535 1.862 1.00 . A A . 31 TYR HD1 1 1 10 4645 1 1 31 TYR HD2 H -8.488 5.994 0.220 1.00 . A A . 31 TYR HD2 1 1 10 4646 1 1 31 TYR HE1 H -6.117 8.775 3.576 1.00 . A A . 31 TYR HE1 1 1 10 4647 1 1 31 TYR HE2 H -9.779 7.235 1.936 1.00 . A A . 31 TYR HE2 1 1 10 4648 1 1 31 TYR HH H -9.075 8.138 4.465 1.00 . A A . 31 TYR HH 1 1 10 4649 1 1 31 TYR N N -3.925 4.474 -0.555 1.00 . A A . 31 TYR N 1 1 10 4650 1 1 31 TYR O O -5.669 2.820 0.808 1.00 . A A . 31 TYR O 1 1 10 4651 1 1 31 TYR OH O -8.750 8.774 3.822 1.00 . A A . 31 TYR OH 1 1 10 4652 1 1 32 ALA C C -7.896 3.121 3.299 1.00 . A A . 32 ALA C 1 1 10 4653 1 1 32 ALA CA C -6.371 3.035 3.417 1.00 . A A . 32 ALA CA 1 1 10 4654 1 1 32 ALA CB C -5.929 3.309 4.857 1.00 . A A . 32 ALA CB 1 1 10 4655 1 1 32 ALA H H -5.510 4.971 3.008 1.00 . A A . 32 ALA H 1 1 10 4656 1 1 32 ALA HA H -6.025 2.062 3.107 1.00 . A A . 32 ALA HA 1 1 10 4657 1 1 32 ALA HB1 H -4.914 2.963 4.995 1.00 . A A . 32 ALA HB1 1 1 10 4658 1 1 32 ALA HB2 H -6.583 2.788 5.541 1.00 . A A . 32 ALA HB2 1 1 10 4659 1 1 32 ALA HB3 H -5.977 4.371 5.052 1.00 . A A . 32 ALA HB3 1 1 10 4660 1 1 32 ALA N N -5.722 4.105 2.598 1.00 . A A . 32 ALA N 1 1 10 4661 1 1 32 ALA O O -8.497 4.136 3.602 1.00 . A A . 32 ALA O 1 1 10 4662 1 1 33 ARG C C -10.551 0.618 2.808 1.00 . A A . 33 ARG C 1 1 10 4663 1 1 33 ARG CA C -10.009 2.055 2.711 1.00 . A A . 33 ARG CA 1 1 10 4664 1 1 33 ARG CB C -10.278 2.648 1.319 1.00 . A A . 33 ARG CB 1 1 10 4665 1 1 33 ARG CD C -9.031 2.697 -0.857 1.00 . A A . 33 ARG CD 1 1 10 4666 1 1 33 ARG CG C -9.601 1.792 0.241 1.00 . A A . 33 ARG CG 1 1 10 4667 1 1 33 ARG CZ C -7.608 0.921 -1.711 1.00 . A A . 33 ARG CZ 1 1 10 4668 1 1 33 ARG H H -8.008 1.255 2.622 1.00 . A A . 33 ARG H 1 1 10 4669 1 1 33 ARG HA H -10.459 2.678 3.467 1.00 . A A . 33 ARG HA 1 1 10 4670 1 1 33 ARG HB2 H -11.343 2.672 1.141 1.00 . A A . 33 ARG HB2 1 1 10 4671 1 1 33 ARG HB3 H -9.885 3.652 1.278 1.00 . A A . 33 ARG HB3 1 1 10 4672 1 1 33 ARG HD2 H -9.674 2.681 -1.727 1.00 . A A . 33 ARG HD2 1 1 10 4673 1 1 33 ARG HD3 H -8.915 3.706 -0.493 1.00 . A A . 33 ARG HD3 1 1 10 4674 1 1 33 ARG HE H -6.882 2.632 -1.005 1.00 . A A . 33 ARG HE 1 1 10 4675 1 1 33 ARG HG2 H -8.802 1.219 0.685 1.00 . A A . 33 ARG HG2 1 1 10 4676 1 1 33 ARG HG3 H -10.328 1.120 -0.193 1.00 . A A . 33 ARG HG3 1 1 10 4677 1 1 33 ARG HH11 H -8.639 1.401 -3.362 1.00 . A A . 33 ARG HH11 1 1 10 4678 1 1 33 ARG HH12 H -8.088 -0.239 -3.274 1.00 . A A . 33 ARG HH12 1 1 10 4679 1 1 33 ARG HH21 H -6.554 0.164 -0.181 1.00 . A A . 33 ARG HH21 1 1 10 4680 1 1 33 ARG HH22 H -6.902 -0.942 -1.469 1.00 . A A . 33 ARG HH22 1 1 10 4681 1 1 33 ARG N N -8.520 2.057 2.858 1.00 . A A . 33 ARG N 1 1 10 4682 1 1 33 ARG NE N -7.695 2.117 -1.185 1.00 . A A . 33 ARG NE 1 1 10 4683 1 1 33 ARG NH1 N -8.154 0.674 -2.874 1.00 . A A . 33 ARG NH1 1 1 10 4684 1 1 33 ARG NH2 N -6.971 -0.026 -1.070 1.00 . A A . 33 ARG NH2 1 1 10 4685 1 1 33 ARG O O -9.925 -0.312 2.335 1.00 . A A . 33 ARG O 1 1 10 4686 1 1 34 PRO C C -12.888 -1.371 2.254 1.00 . A A . 34 PRO C 1 1 10 4687 1 1 34 PRO CA C -12.332 -0.855 3.592 1.00 . A A . 34 PRO CA 1 1 10 4688 1 1 34 PRO CB C -13.459 -0.601 4.591 1.00 . A A . 34 PRO CB 1 1 10 4689 1 1 34 PRO CD C -12.520 1.550 4.027 1.00 . A A . 34 PRO CD 1 1 10 4690 1 1 34 PRO CG C -13.787 0.850 4.445 1.00 . A A . 34 PRO CG 1 1 10 4691 1 1 34 PRO HA H -11.626 -1.557 4.006 1.00 . A A . 34 PRO HA 1 1 10 4692 1 1 34 PRO HB2 H -14.319 -1.211 4.351 1.00 . A A . 34 PRO HB2 1 1 10 4693 1 1 34 PRO HB3 H -13.122 -0.803 5.596 1.00 . A A . 34 PRO HB3 1 1 10 4694 1 1 34 PRO HD2 H -12.736 2.321 3.301 1.00 . A A . 34 PRO HD2 1 1 10 4695 1 1 34 PRO HD3 H -12.015 1.964 4.886 1.00 . A A . 34 PRO HD3 1 1 10 4696 1 1 34 PRO HG2 H -14.549 0.980 3.689 1.00 . A A . 34 PRO HG2 1 1 10 4697 1 1 34 PRO HG3 H -14.129 1.249 5.387 1.00 . A A . 34 PRO HG3 1 1 10 4698 1 1 34 PRO N N -11.704 0.484 3.427 1.00 . A A . 34 PRO N 1 1 10 4699 1 1 34 PRO O O -13.548 -0.605 1.567 1.00 . A A . 34 PRO O 1 1 10 4700 1 1 34 PRO OXT O -12.644 -2.525 1.943 1.00 . A A . 34 PRO OXT 1 1 11 4701 1 1 1 GLY C C 8.779 4.500 5.848 1.00 . A A . 1 GLY C 1 1 11 4702 1 1 1 GLY CA C 10.291 4.300 5.986 1.00 . A A . 1 GLY CA 1 1 11 4703 1 1 1 GLY H1 H 10.487 6.316 6.480 1.00 . A A . 1 GLY H1 1 1 11 4704 1 1 1 GLY H2 H 11.908 5.410 6.689 1.00 . A A . 1 GLY H2 1 1 11 4705 1 1 1 GLY H3 H 10.634 5.263 7.803 1.00 . A A . 1 GLY H3 1 1 11 4706 1 1 1 GLY HA2 H 10.746 4.299 5.006 1.00 . A A . 1 GLY HA2 1 1 11 4707 1 1 1 GLY HA3 H 10.483 3.355 6.473 1.00 . A A . 1 GLY HA3 1 1 11 4708 1 1 1 GLY N N 10.874 5.406 6.801 1.00 . A A . 1 GLY N 1 1 11 4709 1 1 1 GLY O O 7.996 3.861 6.526 1.00 . A A . 1 GLY O 1 1 11 4710 1 1 2 CYS C C 6.518 5.397 3.311 1.00 . A A . 2 CYS C 1 1 11 4711 1 1 2 CYS CA C 6.905 5.636 4.778 1.00 . A A . 2 CYS CA 1 1 11 4712 1 1 2 CYS CB C 6.710 7.108 5.159 1.00 . A A . 2 CYS CB 1 1 11 4713 1 1 2 CYS H H 9.021 5.882 4.441 1.00 . A A . 2 CYS H 1 1 11 4714 1 1 2 CYS HA H 6.322 5.005 5.429 1.00 . A A . 2 CYS HA 1 1 11 4715 1 1 2 CYS HB2 H 6.697 7.200 6.234 1.00 . A A . 2 CYS HB2 1 1 11 4716 1 1 2 CYS HB3 H 7.526 7.692 4.759 1.00 . A A . 2 CYS HB3 1 1 11 4717 1 1 2 CYS N N 8.366 5.383 4.972 1.00 . A A . 2 CYS N 1 1 11 4718 1 1 2 CYS O O 7.312 5.600 2.411 1.00 . A A . 2 CYS O 1 1 11 4719 1 1 2 CYS SG S 5.144 7.721 4.486 1.00 . A A . 2 CYS SG 1 1 11 4720 1 1 3 GLY C C 4.512 6.050 0.984 1.00 . A A . 3 GLY C 1 1 11 4721 1 1 3 GLY CA C 4.858 4.721 1.664 1.00 . A A . 3 GLY CA 1 1 11 4722 1 1 3 GLY H H 4.682 4.821 3.809 1.00 . A A . 3 GLY H 1 1 11 4723 1 1 3 GLY HA2 H 5.653 4.233 1.119 1.00 . A A . 3 GLY HA2 1 1 11 4724 1 1 3 GLY HA3 H 3.983 4.088 1.672 1.00 . A A . 3 GLY HA3 1 1 11 4725 1 1 3 GLY N N 5.303 4.972 3.068 1.00 . A A . 3 GLY N 1 1 11 4726 1 1 3 GLY O O 5.049 7.089 1.321 1.00 . A A . 3 GLY O 1 1 11 4727 1 1 4 GLY C C 2.242 6.973 -1.803 1.00 . A A . 4 GLY C 1 1 11 4728 1 1 4 GLY CA C 3.238 7.283 -0.681 1.00 . A A . 4 GLY CA 1 1 11 4729 1 1 4 GLY H H 3.203 5.173 -0.229 1.00 . A A . 4 GLY H 1 1 11 4730 1 1 4 GLY HA2 H 2.783 7.965 0.023 1.00 . A A . 4 GLY HA2 1 1 11 4731 1 1 4 GLY HA3 H 4.120 7.740 -1.103 1.00 . A A . 4 GLY HA3 1 1 11 4732 1 1 4 GLY N N 3.620 6.023 0.026 1.00 . A A . 4 GLY N 1 1 11 4733 1 1 4 GLY O O 2.390 7.445 -2.916 1.00 . A A . 4 GLY O 1 1 11 4734 1 1 5 LEU C C 0.740 4.872 -3.625 1.00 . A A . 5 LEU C 1 1 11 4735 1 1 5 LEU CA C 0.190 5.818 -2.536 1.00 . A A . 5 LEU CA 1 1 11 4736 1 1 5 LEU CB C -0.265 7.144 -3.153 1.00 . A A . 5 LEU CB 1 1 11 4737 1 1 5 LEU CD1 C -2.253 8.618 -2.816 1.00 . A A . 5 LEU CD1 1 1 11 4738 1 1 5 LEU CD2 C -2.311 6.810 -4.546 1.00 . A A . 5 LEU CD2 1 1 11 4739 1 1 5 LEU CG C -1.793 7.200 -3.160 1.00 . A A . 5 LEU CG 1 1 11 4740 1 1 5 LEU H H 1.148 5.825 -0.602 1.00 . A A . 5 LEU H 1 1 11 4741 1 1 5 LEU HA H -0.649 5.350 -2.045 1.00 . A A . 5 LEU HA 1 1 11 4742 1 1 5 LEU HB2 H 0.125 7.966 -2.570 1.00 . A A . 5 LEU HB2 1 1 11 4743 1 1 5 LEU HB3 H 0.101 7.214 -4.167 1.00 . A A . 5 LEU HB3 1 1 11 4744 1 1 5 LEU HD11 H -3.318 8.618 -2.636 1.00 . A A . 5 LEU HD11 1 1 11 4745 1 1 5 LEU HD12 H -2.026 9.281 -3.638 1.00 . A A . 5 LEU HD12 1 1 11 4746 1 1 5 LEU HD13 H -1.739 8.957 -1.928 1.00 . A A . 5 LEU HD13 1 1 11 4747 1 1 5 LEU HD21 H -3.141 6.127 -4.440 1.00 . A A . 5 LEU HD21 1 1 11 4748 1 1 5 LEU HD22 H -1.521 6.330 -5.104 1.00 . A A . 5 LEU HD22 1 1 11 4749 1 1 5 LEU HD23 H -2.638 7.694 -5.073 1.00 . A A . 5 LEU HD23 1 1 11 4750 1 1 5 LEU HG H -2.180 6.512 -2.423 1.00 . A A . 5 LEU HG 1 1 11 4751 1 1 5 LEU N N 1.229 6.182 -1.511 1.00 . A A . 5 LEU N 1 1 11 4752 1 1 5 LEU O O -0.012 4.369 -4.440 1.00 . A A . 5 LEU O 1 1 11 4753 1 1 6 MET C C 3.871 3.011 -4.102 1.00 . A A . 6 MET C 1 1 11 4754 1 1 6 MET CA C 2.608 3.687 -4.664 1.00 . A A . 6 MET CA 1 1 11 4755 1 1 6 MET CB C 2.957 4.576 -5.864 1.00 . A A . 6 MET CB 1 1 11 4756 1 1 6 MET CE C 0.804 6.822 -6.881 1.00 . A A . 6 MET CE 1 1 11 4757 1 1 6 MET CG C 1.937 4.355 -6.985 1.00 . A A . 6 MET CG 1 1 11 4758 1 1 6 MET H H 2.612 5.012 -2.973 1.00 . A A . 6 MET H 1 1 11 4759 1 1 6 MET HA H 1.883 2.943 -4.954 1.00 . A A . 6 MET HA 1 1 11 4760 1 1 6 MET HB2 H 2.940 5.611 -5.562 1.00 . A A . 6 MET HB2 1 1 11 4761 1 1 6 MET HB3 H 3.943 4.321 -6.226 1.00 . A A . 6 MET HB3 1 1 11 4762 1 1 6 MET HE1 H 0.486 7.727 -7.379 1.00 . A A . 6 MET HE1 1 1 11 4763 1 1 6 MET HE2 H 1.376 7.079 -6.004 1.00 . A A . 6 MET HE2 1 1 11 4764 1 1 6 MET HE3 H -0.060 6.242 -6.587 1.00 . A A . 6 MET HE3 1 1 11 4765 1 1 6 MET HG2 H 2.247 3.521 -7.596 1.00 . A A . 6 MET HG2 1 1 11 4766 1 1 6 MET HG3 H 0.970 4.144 -6.554 1.00 . A A . 6 MET HG3 1 1 11 4767 1 1 6 MET N N 2.026 4.613 -3.641 1.00 . A A . 6 MET N 1 1 11 4768 1 1 6 MET O O 4.753 2.615 -4.842 1.00 . A A . 6 MET O 1 1 11 4769 1 1 6 MET SD S 1.830 5.845 -8.008 1.00 . A A . 6 MET SD 1 1 11 4770 1 1 7 ALA C C 5.276 0.778 -2.587 1.00 . A A . 7 ALA C 1 1 11 4771 1 1 7 ALA CA C 5.175 2.252 -2.182 1.00 . A A . 7 ALA CA 1 1 11 4772 1 1 7 ALA CB C 4.976 2.380 -0.670 1.00 . A A . 7 ALA CB 1 1 11 4773 1 1 7 ALA H H 3.243 3.221 -2.223 1.00 . A A . 7 ALA H 1 1 11 4774 1 1 7 ALA HA H 6.066 2.782 -2.479 1.00 . A A . 7 ALA HA 1 1 11 4775 1 1 7 ALA HB1 H 3.928 2.527 -0.453 1.00 . A A . 7 ALA HB1 1 1 11 4776 1 1 7 ALA HB2 H 5.540 3.224 -0.306 1.00 . A A . 7 ALA HB2 1 1 11 4777 1 1 7 ALA HB3 H 5.321 1.479 -0.183 1.00 . A A . 7 ALA HB3 1 1 11 4778 1 1 7 ALA N N 3.966 2.887 -2.797 1.00 . A A . 7 ALA N 1 1 11 4779 1 1 7 ALA O O 4.446 -0.031 -2.223 1.00 . A A . 7 ALA O 1 1 11 4780 1 1 8 GLY C C 6.473 -1.918 -2.566 1.00 . A A . 8 GLY C 1 1 11 4781 1 1 8 GLY CA C 6.465 -0.987 -3.781 1.00 . A A . 8 GLY CA 1 1 11 4782 1 1 8 GLY H H 6.946 1.108 -3.615 1.00 . A A . 8 GLY H 1 1 11 4783 1 1 8 GLY HA2 H 5.649 -1.258 -4.436 1.00 . A A . 8 GLY HA2 1 1 11 4784 1 1 8 GLY HA3 H 7.400 -1.085 -4.311 1.00 . A A . 8 GLY HA3 1 1 11 4785 1 1 8 GLY N N 6.293 0.431 -3.339 1.00 . A A . 8 GLY N 1 1 11 4786 1 1 8 GLY O O 7.311 -1.805 -1.689 1.00 . A A . 8 GLY O 1 1 11 4787 1 1 9 CYS C C 6.535 -4.897 -1.549 1.00 . A A . 9 CYS C 1 1 11 4788 1 1 9 CYS CA C 5.491 -3.792 -1.363 1.00 . A A . 9 CYS CA 1 1 11 4789 1 1 9 CYS CB C 4.075 -4.377 -1.383 1.00 . A A . 9 CYS CB 1 1 11 4790 1 1 9 CYS H H 4.888 -2.913 -3.235 1.00 . A A . 9 CYS H 1 1 11 4791 1 1 9 CYS HA H 5.662 -3.270 -0.437 1.00 . A A . 9 CYS HA 1 1 11 4792 1 1 9 CYS HB2 H 3.774 -4.558 -2.404 1.00 . A A . 9 CYS HB2 1 1 11 4793 1 1 9 CYS HB3 H 4.065 -5.310 -0.837 1.00 . A A . 9 CYS HB3 1 1 11 4794 1 1 9 CYS N N 5.547 -2.842 -2.513 1.00 . A A . 9 CYS N 1 1 11 4795 1 1 9 CYS O O 7.550 -4.917 -0.878 1.00 . A A . 9 CYS O 1 1 11 4796 1 1 9 CYS SG S 2.917 -3.218 -0.611 1.00 . A A . 9 CYS SG 1 1 11 4797 1 1 10 ASP C C 7.614 -7.608 -1.372 1.00 . A A . 10 ASP C 1 1 11 4798 1 1 10 ASP CA C 7.248 -6.937 -2.704 1.00 . A A . 10 ASP CA 1 1 11 4799 1 1 10 ASP CB C 8.470 -6.281 -3.357 1.00 . A A . 10 ASP CB 1 1 11 4800 1 1 10 ASP CG C 9.146 -7.278 -4.301 1.00 . A A . 10 ASP CG 1 1 11 4801 1 1 10 ASP H H 5.460 -5.766 -2.978 1.00 . A A . 10 ASP H 1 1 11 4802 1 1 10 ASP HA H 6.812 -7.658 -3.379 1.00 . A A . 10 ASP HA 1 1 11 4803 1 1 10 ASP HB2 H 8.155 -5.412 -3.918 1.00 . A A . 10 ASP HB2 1 1 11 4804 1 1 10 ASP HB3 H 9.171 -5.980 -2.594 1.00 . A A . 10 ASP HB3 1 1 11 4805 1 1 10 ASP N N 6.286 -5.815 -2.458 1.00 . A A . 10 ASP N 1 1 11 4806 1 1 10 ASP O O 8.770 -7.691 -0.998 1.00 . A A . 10 ASP O 1 1 11 4807 1 1 10 ASP OD1 O 8.758 -7.325 -5.459 1.00 . A A . 10 ASP OD1 1 1 11 4808 1 1 10 ASP OD2 O 10.038 -7.978 -3.853 1.00 . A A . 10 ASP OD2 1 1 11 4809 1 1 11 GLY C C 5.669 -8.482 1.560 1.00 . A A . 11 GLY C 1 1 11 4810 1 1 11 GLY CA C 6.881 -8.721 0.662 1.00 . A A . 11 GLY CA 1 1 11 4811 1 1 11 GLY H H 5.701 -7.983 -0.969 1.00 . A A . 11 GLY H 1 1 11 4812 1 1 11 GLY HA2 H 7.030 -9.783 0.520 1.00 . A A . 11 GLY HA2 1 1 11 4813 1 1 11 GLY HA3 H 7.757 -8.286 1.120 1.00 . A A . 11 GLY HA3 1 1 11 4814 1 1 11 GLY N N 6.625 -8.072 -0.650 1.00 . A A . 11 GLY N 1 1 11 4815 1 1 11 GLY O O 5.270 -7.355 1.790 1.00 . A A . 11 GLY O 1 1 11 4816 1 1 12 LYS C C 4.242 -8.622 4.234 1.00 . A A . 12 LYS C 1 1 11 4817 1 1 12 LYS CA C 3.879 -9.377 2.950 1.00 . A A . 12 LYS CA 1 1 11 4818 1 1 12 LYS CB C 3.454 -10.803 3.291 1.00 . A A . 12 LYS CB 1 1 11 4819 1 1 12 LYS CD C 3.372 -12.922 1.962 1.00 . A A . 12 LYS CD 1 1 11 4820 1 1 12 LYS CE C 4.687 -12.955 1.172 1.00 . A A . 12 LYS CE 1 1 11 4821 1 1 12 LYS CG C 2.859 -11.481 2.055 1.00 . A A . 12 LYS CG 1 1 11 4822 1 1 12 LYS H H 5.418 -10.428 1.857 1.00 . A A . 12 LYS H 1 1 11 4823 1 1 12 LYS HA H 3.083 -8.870 2.425 1.00 . A A . 12 LYS HA 1 1 11 4824 1 1 12 LYS HB2 H 4.317 -11.359 3.625 1.00 . A A . 12 LYS HB2 1 1 11 4825 1 1 12 LYS HB3 H 2.715 -10.777 4.075 1.00 . A A . 12 LYS HB3 1 1 11 4826 1 1 12 LYS HD2 H 3.537 -13.311 2.956 1.00 . A A . 12 LYS HD2 1 1 11 4827 1 1 12 LYS HD3 H 2.637 -13.530 1.455 1.00 . A A . 12 LYS HD3 1 1 11 4828 1 1 12 LYS HE2 H 4.702 -13.808 0.509 1.00 . A A . 12 LYS HE2 1 1 11 4829 1 1 12 LYS HE3 H 4.812 -12.040 0.613 1.00 . A A . 12 LYS HE3 1 1 11 4830 1 1 12 LYS HG2 H 1.780 -11.486 2.133 1.00 . A A . 12 LYS HG2 1 1 11 4831 1 1 12 LYS HG3 H 3.153 -10.938 1.170 1.00 . A A . 12 LYS HG3 1 1 11 4832 1 1 12 LYS HZ1 H 5.597 -13.923 2.780 1.00 . A A . 12 LYS HZ1 1 1 11 4833 1 1 12 LYS HZ2 H 5.762 -12.231 2.808 1.00 . A A . 12 LYS HZ2 1 1 11 4834 1 1 12 LYS HZ3 H 6.685 -13.159 1.727 1.00 . A A . 12 LYS HZ3 1 1 11 4835 1 1 12 LYS N N 5.076 -9.533 2.064 1.00 . A A . 12 LYS N 1 1 11 4836 1 1 12 LYS NZ N 5.763 -13.076 2.200 1.00 . A A . 12 LYS NZ 1 1 11 4837 1 1 12 LYS O O 3.376 -8.167 4.959 1.00 . A A . 12 LYS O 1 1 11 4838 1 1 13 SER C C 6.262 -6.300 5.453 1.00 . A A . 13 SER C 1 1 11 4839 1 1 13 SER CA C 5.938 -7.775 5.760 1.00 . A A . 13 SER CA 1 1 11 4840 1 1 13 SER CB C 7.189 -8.528 6.221 1.00 . A A . 13 SER CB 1 1 11 4841 1 1 13 SER H H 6.191 -8.870 3.929 1.00 . A A . 13 SER H 1 1 11 4842 1 1 13 SER HA H 5.172 -7.842 6.515 1.00 . A A . 13 SER HA 1 1 11 4843 1 1 13 SER HB2 H 7.534 -9.176 5.431 1.00 . A A . 13 SER HB2 1 1 11 4844 1 1 13 SER HB3 H 7.968 -7.819 6.467 1.00 . A A . 13 SER HB3 1 1 11 4845 1 1 13 SER HG H 6.750 -10.223 7.069 1.00 . A A . 13 SER HG 1 1 11 4846 1 1 13 SER N N 5.513 -8.492 4.524 1.00 . A A . 13 SER N 1 1 11 4847 1 1 13 SER O O 6.858 -5.613 6.262 1.00 . A A . 13 SER O 1 1 11 4848 1 1 13 SER OG O 6.868 -9.315 7.361 1.00 . A A . 13 SER OG 1 1 11 4849 1 1 14 THR C C 5.281 -3.437 4.796 1.00 . A A . 14 THR C 1 1 11 4850 1 1 14 THR CA C 6.156 -4.375 3.948 1.00 . A A . 14 THR CA 1 1 11 4851 1 1 14 THR CB C 5.820 -4.240 2.453 1.00 . A A . 14 THR CB 1 1 11 4852 1 1 14 THR CG2 C 4.306 -4.345 2.240 1.00 . A A . 14 THR CG2 1 1 11 4853 1 1 14 THR H H 5.389 -6.371 3.660 1.00 . A A . 14 THR H 1 1 11 4854 1 1 14 THR HA H 7.199 -4.154 4.110 1.00 . A A . 14 THR HA 1 1 11 4855 1 1 14 THR HB H 6.311 -5.030 1.902 1.00 . A A . 14 THR HB 1 1 11 4856 1 1 14 THR HG1 H 7.016 -3.134 1.386 1.00 . A A . 14 THR HG1 1 1 11 4857 1 1 14 THR HG21 H 4.108 -4.694 1.238 1.00 . A A . 14 THR HG21 1 1 11 4858 1 1 14 THR HG22 H 3.855 -3.374 2.379 1.00 . A A . 14 THR HG22 1 1 11 4859 1 1 14 THR HG23 H 3.889 -5.041 2.952 1.00 . A A . 14 THR HG23 1 1 11 4860 1 1 14 THR N N 5.872 -5.805 4.296 1.00 . A A . 14 THR N 1 1 11 4861 1 1 14 THR O O 4.158 -3.763 5.138 1.00 . A A . 14 THR O 1 1 11 4862 1 1 14 THR OG1 O 6.276 -2.980 1.979 1.00 . A A . 14 THR OG1 1 1 11 4863 1 1 15 PHE C C 4.921 0.049 5.292 1.00 . A A . 15 PHE C 1 1 11 4864 1 1 15 PHE CA C 4.995 -1.323 5.969 1.00 . A A . 15 PHE CA 1 1 11 4865 1 1 15 PHE CB C 5.752 -1.229 7.296 1.00 . A A . 15 PHE CB 1 1 11 4866 1 1 15 PHE CD1 C 3.761 -1.268 8.845 1.00 . A A . 15 PHE CD1 1 1 11 4867 1 1 15 PHE CD2 C 5.168 0.707 8.801 1.00 . A A . 15 PHE CD2 1 1 11 4868 1 1 15 PHE CE1 C 2.947 -0.666 9.812 1.00 . A A . 15 PHE CE1 1 1 11 4869 1 1 15 PHE CE2 C 4.354 1.309 9.768 1.00 . A A . 15 PHE CE2 1 1 11 4870 1 1 15 PHE CG C 4.872 -0.580 8.339 1.00 . A A . 15 PHE CG 1 1 11 4871 1 1 15 PHE CZ C 3.244 0.623 10.274 1.00 . A A . 15 PHE CZ 1 1 11 4872 1 1 15 PHE H H 6.698 -2.040 4.856 1.00 . A A . 15 PHE H 1 1 11 4873 1 1 15 PHE HA H 4.003 -1.710 6.140 1.00 . A A . 15 PHE HA 1 1 11 4874 1 1 15 PHE HB2 H 6.027 -2.222 7.623 1.00 . A A . 15 PHE HB2 1 1 11 4875 1 1 15 PHE HB3 H 6.644 -0.636 7.159 1.00 . A A . 15 PHE HB3 1 1 11 4876 1 1 15 PHE HD1 H 3.534 -2.261 8.490 1.00 . A A . 15 PHE HD1 1 1 11 4877 1 1 15 PHE HD2 H 6.025 1.239 8.411 1.00 . A A . 15 PHE HD2 1 1 11 4878 1 1 15 PHE HE1 H 2.091 -1.195 10.202 1.00 . A A . 15 PHE HE1 1 1 11 4879 1 1 15 PHE HE2 H 4.582 2.303 10.123 1.00 . A A . 15 PHE HE2 1 1 11 4880 1 1 15 PHE HZ H 2.616 1.087 11.019 1.00 . A A . 15 PHE HZ 1 1 11 4881 1 1 15 PHE N N 5.790 -2.279 5.139 1.00 . A A . 15 PHE N 1 1 11 4882 1 1 15 PHE O O 5.898 0.549 4.766 1.00 . A A . 15 PHE O 1 1 11 4883 1 1 16 CYS C C 3.630 3.094 5.772 1.00 . A A . 16 CYS C 1 1 11 4884 1 1 16 CYS CA C 3.604 2.006 4.685 1.00 . A A . 16 CYS CA 1 1 11 4885 1 1 16 CYS CB C 2.239 1.953 3.990 1.00 . A A . 16 CYS CB 1 1 11 4886 1 1 16 CYS H H 2.997 0.234 5.751 1.00 . A A . 16 CYS H 1 1 11 4887 1 1 16 CYS HA H 4.382 2.180 3.958 1.00 . A A . 16 CYS HA 1 1 11 4888 1 1 16 CYS HB2 H 1.465 1.813 4.730 1.00 . A A . 16 CYS HB2 1 1 11 4889 1 1 16 CYS HB3 H 2.068 2.876 3.458 1.00 . A A . 16 CYS HB3 1 1 11 4890 1 1 16 CYS N N 3.764 0.661 5.314 1.00 . A A . 16 CYS N 1 1 11 4891 1 1 16 CYS O O 4.207 2.907 6.827 1.00 . A A . 16 CYS O 1 1 11 4892 1 1 16 CYS SG S 2.212 0.570 2.822 1.00 . A A . 16 CYS SG 1 1 11 4893 1 1 17 CYS C C 1.982 5.023 7.646 1.00 . A A . 17 CYS C 1 1 11 4894 1 1 17 CYS CA C 3.017 5.317 6.552 1.00 . A A . 17 CYS CA 1 1 11 4895 1 1 17 CYS CB C 2.659 6.596 5.788 1.00 . A A . 17 CYS CB 1 1 11 4896 1 1 17 CYS H H 2.559 4.362 4.669 1.00 . A A . 17 CYS H 1 1 11 4897 1 1 17 CYS HA H 3.995 5.416 6.988 1.00 . A A . 17 CYS HA 1 1 11 4898 1 1 17 CYS HB2 H 2.609 6.382 4.729 1.00 . A A . 17 CYS HB2 1 1 11 4899 1 1 17 CYS HB3 H 1.702 6.964 6.126 1.00 . A A . 17 CYS HB3 1 1 11 4900 1 1 17 CYS N N 3.017 4.227 5.526 1.00 . A A . 17 CYS N 1 1 11 4901 1 1 17 CYS O O 2.331 4.674 8.758 1.00 . A A . 17 CYS O 1 1 11 4902 1 1 17 CYS SG S 3.927 7.850 6.091 1.00 . A A . 17 CYS SG 1 1 11 4903 1 1 18 SER C C -1.722 4.805 7.696 1.00 . A A . 18 SER C 1 1 11 4904 1 1 18 SER CA C -0.346 4.903 8.363 1.00 . A A . 18 SER CA 1 1 11 4905 1 1 18 SER CB C -0.294 6.101 9.313 1.00 . A A . 18 SER CB 1 1 11 4906 1 1 18 SER H H 0.466 5.450 6.436 1.00 . A A . 18 SER H 1 1 11 4907 1 1 18 SER HA H -0.129 3.998 8.902 1.00 . A A . 18 SER HA 1 1 11 4908 1 1 18 SER HB2 H 0.323 6.875 8.887 1.00 . A A . 18 SER HB2 1 1 11 4909 1 1 18 SER HB3 H -1.295 6.486 9.463 1.00 . A A . 18 SER HB3 1 1 11 4910 1 1 18 SER HG H 1.128 6.093 10.640 1.00 . A A . 18 SER HG 1 1 11 4911 1 1 18 SER N N 0.716 5.167 7.340 1.00 . A A . 18 SER N 1 1 11 4912 1 1 18 SER O O -2.504 3.922 7.998 1.00 . A A . 18 SER O 1 1 11 4913 1 1 18 SER OG O 0.260 5.691 10.556 1.00 . A A . 18 SER OG 1 1 11 4914 1 1 19 GLY C C -3.150 5.056 4.694 1.00 . A A . 19 GLY C 1 1 11 4915 1 1 19 GLY CA C -3.333 5.666 6.087 1.00 . A A . 19 GLY CA 1 1 11 4916 1 1 19 GLY H H -1.365 6.391 6.562 1.00 . A A . 19 GLY H 1 1 11 4917 1 1 19 GLY HA2 H -4.031 5.068 6.658 1.00 . A A . 19 GLY HA2 1 1 11 4918 1 1 19 GLY HA3 H -3.716 6.670 5.989 1.00 . A A . 19 GLY HA3 1 1 11 4919 1 1 19 GLY N N -2.016 5.700 6.789 1.00 . A A . 19 GLY N 1 1 11 4920 1 1 19 GLY O O -3.881 5.369 3.773 1.00 . A A . 19 GLY O 1 1 11 4921 1 1 20 TYR C C -1.969 2.020 3.342 1.00 . A A . 20 TYR C 1 1 11 4922 1 1 20 TYR CA C -1.940 3.549 3.205 1.00 . A A . 20 TYR CA 1 1 11 4923 1 1 20 TYR CB C -0.540 4.009 2.779 1.00 . A A . 20 TYR CB 1 1 11 4924 1 1 20 TYR CD1 C -1.458 5.873 1.342 1.00 . A A . 20 TYR CD1 1 1 11 4925 1 1 20 TYR CD2 C 0.285 6.384 2.948 1.00 . A A . 20 TYR CD2 1 1 11 4926 1 1 20 TYR CE1 C -1.482 7.212 0.940 1.00 . A A . 20 TYR CE1 1 1 11 4927 1 1 20 TYR CE2 C 0.263 7.723 2.545 1.00 . A A . 20 TYR CE2 1 1 11 4928 1 1 20 TYR CG C -0.574 5.458 2.347 1.00 . A A . 20 TYR CG 1 1 11 4929 1 1 20 TYR CZ C -0.622 8.138 1.541 1.00 . A A . 20 TYR CZ 1 1 11 4930 1 1 20 TYR H H -1.604 3.955 5.294 1.00 . A A . 20 TYR H 1 1 11 4931 1 1 20 TYR HA H -2.675 3.883 2.487 1.00 . A A . 20 TYR HA 1 1 11 4932 1 1 20 TYR HB2 H 0.142 3.900 3.610 1.00 . A A . 20 TYR HB2 1 1 11 4933 1 1 20 TYR HB3 H -0.200 3.400 1.956 1.00 . A A . 20 TYR HB3 1 1 11 4934 1 1 20 TYR HD1 H -2.122 5.159 0.879 1.00 . A A . 20 TYR HD1 1 1 11 4935 1 1 20 TYR HD2 H 0.966 6.064 3.722 1.00 . A A . 20 TYR HD2 1 1 11 4936 1 1 20 TYR HE1 H -2.164 7.532 0.167 1.00 . A A . 20 TYR HE1 1 1 11 4937 1 1 20 TYR HE2 H 0.927 8.438 3.009 1.00 . A A . 20 TYR HE2 1 1 11 4938 1 1 20 TYR HH H -1.160 9.955 1.784 1.00 . A A . 20 TYR HH 1 1 11 4939 1 1 20 TYR N N -2.179 4.188 4.535 1.00 . A A . 20 TYR N 1 1 11 4940 1 1 20 TYR O O -1.330 1.455 4.212 1.00 . A A . 20 TYR O 1 1 11 4941 1 1 20 TYR OH O -0.643 9.460 1.144 1.00 . A A . 20 TYR OH 1 1 11 4942 1 1 21 ASN C C -2.013 -0.752 1.354 1.00 . A A . 21 ASN C 1 1 11 4943 1 1 21 ASN CA C -2.757 -0.147 2.551 1.00 . A A . 21 ASN CA 1 1 11 4944 1 1 21 ASN CB C -4.249 -0.490 2.499 1.00 . A A . 21 ASN CB 1 1 11 4945 1 1 21 ASN CG C -4.445 -1.977 2.809 1.00 . A A . 21 ASN CG 1 1 11 4946 1 1 21 ASN H H -3.193 1.826 1.787 1.00 . A A . 21 ASN H 1 1 11 4947 1 1 21 ASN HA H -2.327 -0.498 3.475 1.00 . A A . 21 ASN HA 1 1 11 4948 1 1 21 ASN HB2 H -4.779 0.103 3.230 1.00 . A A . 21 ASN HB2 1 1 11 4949 1 1 21 ASN HB3 H -4.634 -0.275 1.514 1.00 . A A . 21 ASN HB3 1 1 11 4950 1 1 21 ASN HD21 H -5.070 -2.426 0.977 1.00 . A A . 21 ASN HD21 1 1 11 4951 1 1 21 ASN HD22 H -5.003 -3.730 2.061 1.00 . A A . 21 ASN HD22 1 1 11 4952 1 1 21 ASN N N -2.694 1.347 2.484 1.00 . A A . 21 ASN N 1 1 11 4953 1 1 21 ASN ND2 N -4.876 -2.777 1.871 1.00 . A A . 21 ASN ND2 1 1 11 4954 1 1 21 ASN O O -1.948 -0.161 0.296 1.00 . A A . 21 ASN O 1 1 11 4955 1 1 21 ASN OD1 O -4.207 -2.416 3.916 1.00 . A A . 21 ASN OD1 1 1 11 4956 1 1 22 CYS C C -1.620 -3.403 -0.491 1.00 . A A . 22 CYS C 1 1 11 4957 1 1 22 CYS CA C -0.691 -2.551 0.381 1.00 . A A . 22 CYS CA 1 1 11 4958 1 1 22 CYS CB C 0.377 -3.430 1.040 1.00 . A A . 22 CYS CB 1 1 11 4959 1 1 22 CYS H H -1.502 -2.381 2.378 1.00 . A A . 22 CYS H 1 1 11 4960 1 1 22 CYS HA H -0.216 -1.792 -0.215 1.00 . A A . 22 CYS HA 1 1 11 4961 1 1 22 CYS HB2 H 1.066 -2.809 1.592 1.00 . A A . 22 CYS HB2 1 1 11 4962 1 1 22 CYS HB3 H -0.096 -4.129 1.714 1.00 . A A . 22 CYS HB3 1 1 11 4963 1 1 22 CYS N N -1.444 -1.923 1.514 1.00 . A A . 22 CYS N 1 1 11 4964 1 1 22 CYS O O -2.430 -4.163 0.002 1.00 . A A . 22 CYS O 1 1 11 4965 1 1 22 CYS SG S 1.281 -4.344 -0.238 1.00 . A A . 22 CYS SG 1 1 11 4966 1 1 23 SER C C -1.523 -5.247 -3.295 1.00 . A A . 23 SER C 1 1 11 4967 1 1 23 SER CA C -2.342 -4.086 -2.716 1.00 . A A . 23 SER CA 1 1 11 4968 1 1 23 SER CB C -2.759 -3.115 -3.822 1.00 . A A . 23 SER CB 1 1 11 4969 1 1 23 SER H H -0.819 -2.667 -2.157 1.00 . A A . 23 SER H 1 1 11 4970 1 1 23 SER HA H -3.213 -4.456 -2.200 1.00 . A A . 23 SER HA 1 1 11 4971 1 1 23 SER HB2 H -2.080 -2.278 -3.850 1.00 . A A . 23 SER HB2 1 1 11 4972 1 1 23 SER HB3 H -2.736 -3.624 -4.777 1.00 . A A . 23 SER HB3 1 1 11 4973 1 1 23 SER HG H -4.634 -2.885 -4.296 1.00 . A A . 23 SER HG 1 1 11 4974 1 1 23 SER N N -1.489 -3.283 -1.790 1.00 . A A . 23 SER N 1 1 11 4975 1 1 23 SER O O -0.421 -5.045 -3.770 1.00 . A A . 23 SER O 1 1 11 4976 1 1 23 SER OG O -4.073 -2.641 -3.555 1.00 . A A . 23 SER OG 1 1 11 4977 1 1 24 PRO C C -1.365 -7.664 -5.278 1.00 . A A . 24 PRO C 1 1 11 4978 1 1 24 PRO CA C -1.387 -7.639 -3.742 1.00 . A A . 24 PRO CA 1 1 11 4979 1 1 24 PRO CB C -2.222 -8.795 -3.195 1.00 . A A . 24 PRO CB 1 1 11 4980 1 1 24 PRO CD C -3.404 -6.757 -2.665 1.00 . A A . 24 PRO CD 1 1 11 4981 1 1 24 PRO CG C -3.584 -8.220 -2.976 1.00 . A A . 24 PRO CG 1 1 11 4982 1 1 24 PRO HA H -0.387 -7.694 -3.350 1.00 . A A . 24 PRO HA 1 1 11 4983 1 1 24 PRO HB2 H -2.261 -9.602 -3.914 1.00 . A A . 24 PRO HB2 1 1 11 4984 1 1 24 PRO HB3 H -1.813 -9.143 -2.259 1.00 . A A . 24 PRO HB3 1 1 11 4985 1 1 24 PRO HD2 H -4.178 -6.171 -3.142 1.00 . A A . 24 PRO HD2 1 1 11 4986 1 1 24 PRO HD3 H -3.405 -6.593 -1.599 1.00 . A A . 24 PRO HD3 1 1 11 4987 1 1 24 PRO HG2 H -4.181 -8.339 -3.870 1.00 . A A . 24 PRO HG2 1 1 11 4988 1 1 24 PRO HG3 H -4.064 -8.711 -2.144 1.00 . A A . 24 PRO HG3 1 1 11 4989 1 1 24 PRO N N -2.084 -6.431 -3.226 1.00 . A A . 24 PRO N 1 1 11 4990 1 1 24 PRO O O -0.442 -8.182 -5.881 1.00 . A A . 24 PRO O 1 1 11 4991 1 1 25 THR C C -1.554 -5.980 -7.978 1.00 . A A . 25 THR C 1 1 11 4992 1 1 25 THR CA C -2.409 -7.121 -7.412 1.00 . A A . 25 THR CA 1 1 11 4993 1 1 25 THR CB C -3.885 -6.922 -7.778 1.00 . A A . 25 THR CB 1 1 11 4994 1 1 25 THR CG2 C -4.059 -7.004 -9.296 1.00 . A A . 25 THR CG2 1 1 11 4995 1 1 25 THR H H -3.104 -6.713 -5.408 1.00 . A A . 25 THR H 1 1 11 4996 1 1 25 THR HA H -2.064 -8.067 -7.791 1.00 . A A . 25 THR HA 1 1 11 4997 1 1 25 THR HB H -4.213 -5.952 -7.435 1.00 . A A . 25 THR HB 1 1 11 4998 1 1 25 THR HG1 H -5.247 -7.511 -6.518 1.00 . A A . 25 THR HG1 1 1 11 4999 1 1 25 THR HG21 H -5.075 -7.290 -9.526 1.00 . A A . 25 THR HG21 1 1 11 5000 1 1 25 THR HG22 H -3.379 -7.741 -9.699 1.00 . A A . 25 THR HG22 1 1 11 5001 1 1 25 THR HG23 H -3.847 -6.041 -9.735 1.00 . A A . 25 THR HG23 1 1 11 5002 1 1 25 THR N N -2.371 -7.118 -5.914 1.00 . A A . 25 THR N 1 1 11 5003 1 1 25 THR O O -0.976 -6.101 -9.042 1.00 . A A . 25 THR O 1 1 11 5004 1 1 25 THR OG1 O -4.667 -7.933 -7.157 1.00 . A A . 25 THR OG1 1 1 11 5005 1 1 26 TRP C C 0.792 -3.815 -7.248 1.00 . A A . 26 TRP C 1 1 11 5006 1 1 26 TRP CA C -0.649 -3.728 -7.776 1.00 . A A . 26 TRP CA 1 1 11 5007 1 1 26 TRP CB C -1.342 -2.472 -7.233 1.00 . A A . 26 TRP CB 1 1 11 5008 1 1 26 TRP CD1 C -3.245 -3.048 -8.809 1.00 . A A . 26 TRP CD1 1 1 11 5009 1 1 26 TRP CD2 C -3.877 -1.664 -7.153 1.00 . A A . 26 TRP CD2 1 1 11 5010 1 1 26 TRP CE2 C -5.024 -1.899 -7.948 1.00 . A A . 26 TRP CE2 1 1 11 5011 1 1 26 TRP CE3 C -4.007 -0.816 -6.038 1.00 . A A . 26 TRP CE3 1 1 11 5012 1 1 26 TRP CG C -2.759 -2.406 -7.721 1.00 . A A . 26 TRP CG 1 1 11 5013 1 1 26 TRP CH2 C -6.366 -0.478 -6.535 1.00 . A A . 26 TRP CH2 1 1 11 5014 1 1 26 TRP CZ2 C -6.255 -1.317 -7.647 1.00 . A A . 26 TRP CZ2 1 1 11 5015 1 1 26 TRP CZ3 C -5.246 -0.229 -5.731 1.00 . A A . 26 TRP CZ3 1 1 11 5016 1 1 26 TRP H H -1.944 -4.805 -6.424 1.00 . A A . 26 TRP H 1 1 11 5017 1 1 26 TRP HA H -0.651 -3.706 -8.855 1.00 . A A . 26 TRP HA 1 1 11 5018 1 1 26 TRP HB2 H -1.336 -2.500 -6.154 1.00 . A A . 26 TRP HB2 1 1 11 5019 1 1 26 TRP HB3 H -0.807 -1.600 -7.570 1.00 . A A . 26 TRP HB3 1 1 11 5020 1 1 26 TRP HD1 H -2.677 -3.692 -9.465 1.00 . A A . 26 TRP HD1 1 1 11 5021 1 1 26 TRP HE1 H -5.173 -3.090 -9.651 1.00 . A A . 26 TRP HE1 1 1 11 5022 1 1 26 TRP HE3 H -3.150 -0.620 -5.413 1.00 . A A . 26 TRP HE3 1 1 11 5023 1 1 26 TRP HH2 H -7.316 -0.024 -6.295 1.00 . A A . 26 TRP HH2 1 1 11 5024 1 1 26 TRP HZ2 H -7.116 -1.512 -8.269 1.00 . A A . 26 TRP HZ2 1 1 11 5025 1 1 26 TRP HZ3 H -5.334 0.419 -4.872 1.00 . A A . 26 TRP HZ3 1 1 11 5026 1 1 26 TRP N N -1.469 -4.878 -7.278 1.00 . A A . 26 TRP N 1 1 11 5027 1 1 26 TRP NE1 N -4.587 -2.750 -8.943 1.00 . A A . 26 TRP NE1 1 1 11 5028 1 1 26 TRP O O 1.686 -3.180 -7.773 1.00 . A A . 26 TRP O 1 1 11 5029 1 1 27 LYS C C 2.864 -3.446 -4.957 1.00 . A A . 27 LYS C 1 1 11 5030 1 1 27 LYS CA C 2.387 -4.747 -5.625 1.00 . A A . 27 LYS CA 1 1 11 5031 1 1 27 LYS CB C 3.308 -5.124 -6.793 1.00 . A A . 27 LYS CB 1 1 11 5032 1 1 27 LYS CD C 4.248 -7.324 -6.059 1.00 . A A . 27 LYS CD 1 1 11 5033 1 1 27 LYS CE C 5.560 -8.098 -5.887 1.00 . A A . 27 LYS CE 1 1 11 5034 1 1 27 LYS CG C 4.552 -5.836 -6.256 1.00 . A A . 27 LYS CG 1 1 11 5035 1 1 27 LYS H H 0.270 -5.092 -5.812 1.00 . A A . 27 LYS H 1 1 11 5036 1 1 27 LYS HA H 2.385 -5.546 -4.901 1.00 . A A . 27 LYS HA 1 1 11 5037 1 1 27 LYS HB2 H 2.780 -5.780 -7.470 1.00 . A A . 27 LYS HB2 1 1 11 5038 1 1 27 LYS HB3 H 3.608 -4.230 -7.318 1.00 . A A . 27 LYS HB3 1 1 11 5039 1 1 27 LYS HD2 H 3.636 -7.451 -5.177 1.00 . A A . 27 LYS HD2 1 1 11 5040 1 1 27 LYS HD3 H 3.720 -7.702 -6.921 1.00 . A A . 27 LYS HD3 1 1 11 5041 1 1 27 LYS HE2 H 6.272 -7.508 -5.326 1.00 . A A . 27 LYS HE2 1 1 11 5042 1 1 27 LYS HE3 H 5.378 -9.039 -5.392 1.00 . A A . 27 LYS HE3 1 1 11 5043 1 1 27 LYS HG2 H 5.362 -5.724 -6.963 1.00 . A A . 27 LYS HG2 1 1 11 5044 1 1 27 LYS HG3 H 4.837 -5.401 -5.310 1.00 . A A . 27 LYS HG3 1 1 11 5045 1 1 27 LYS HZ1 H 6.953 -8.865 -7.231 1.00 . A A . 27 LYS HZ1 1 1 11 5046 1 1 27 LYS HZ2 H 6.215 -7.426 -7.749 1.00 . A A . 27 LYS HZ2 1 1 11 5047 1 1 27 LYS HZ3 H 5.358 -8.892 -7.804 1.00 . A A . 27 LYS HZ3 1 1 11 5048 1 1 27 LYS N N 1.015 -4.597 -6.212 1.00 . A A . 27 LYS N 1 1 11 5049 1 1 27 LYS NZ N 6.059 -8.339 -7.272 1.00 . A A . 27 LYS NZ 1 1 11 5050 1 1 27 LYS O O 4.038 -3.285 -4.689 1.00 . A A . 27 LYS O 1 1 11 5051 1 1 28 TRP C C 1.330 -0.788 -2.995 1.00 . A A . 28 TRP C 1 1 11 5052 1 1 28 TRP CA C 2.404 -1.265 -3.983 1.00 . A A . 28 TRP CA 1 1 11 5053 1 1 28 TRP CB C 2.671 -0.231 -5.097 1.00 . A A . 28 TRP CB 1 1 11 5054 1 1 28 TRP CD1 C 0.280 0.624 -5.272 1.00 . A A . 28 TRP CD1 1 1 11 5055 1 1 28 TRP CD2 C 1.178 0.131 -7.272 1.00 . A A . 28 TRP CD2 1 1 11 5056 1 1 28 TRP CE2 C -0.138 0.584 -7.519 1.00 . A A . 28 TRP CE2 1 1 11 5057 1 1 28 TRP CE3 C 1.967 -0.244 -8.371 1.00 . A A . 28 TRP CE3 1 1 11 5058 1 1 28 TRP CG C 1.417 0.149 -5.834 1.00 . A A . 28 TRP CG 1 1 11 5059 1 1 28 TRP CH2 C 0.146 0.293 -9.896 1.00 . A A . 28 TRP CH2 1 1 11 5060 1 1 28 TRP CZ2 C -0.652 0.667 -8.814 1.00 . A A . 28 TRP CZ2 1 1 11 5061 1 1 28 TRP CZ3 C 1.455 -0.162 -9.677 1.00 . A A . 28 TRP CZ3 1 1 11 5062 1 1 28 TRP H H 1.024 -2.673 -4.862 1.00 . A A . 28 TRP H 1 1 11 5063 1 1 28 TRP HA H 3.322 -1.449 -3.445 1.00 . A A . 28 TRP HA 1 1 11 5064 1 1 28 TRP HB2 H 3.099 0.656 -4.657 1.00 . A A . 28 TRP HB2 1 1 11 5065 1 1 28 TRP HB3 H 3.379 -0.650 -5.798 1.00 . A A . 28 TRP HB3 1 1 11 5066 1 1 28 TRP HD1 H 0.118 0.776 -4.215 1.00 . A A . 28 TRP HD1 1 1 11 5067 1 1 28 TRP HE1 H -1.553 1.208 -6.131 1.00 . A A . 28 TRP HE1 1 1 11 5068 1 1 28 TRP HE3 H 2.973 -0.592 -8.210 1.00 . A A . 28 TRP HE3 1 1 11 5069 1 1 28 TRP HH2 H -0.242 0.355 -10.903 1.00 . A A . 28 TRP HH2 1 1 11 5070 1 1 28 TRP HZ2 H -1.661 1.018 -8.978 1.00 . A A . 28 TRP HZ2 1 1 11 5071 1 1 28 TRP HZ3 H 2.071 -0.448 -10.515 1.00 . A A . 28 TRP HZ3 1 1 11 5072 1 1 28 TRP N N 1.972 -2.526 -4.659 1.00 . A A . 28 TRP N 1 1 11 5073 1 1 28 TRP NE1 N -0.645 0.870 -6.271 1.00 . A A . 28 TRP NE1 1 1 11 5074 1 1 28 TRP O O 0.222 -1.291 -2.975 1.00 . A A . 28 TRP O 1 1 11 5075 1 1 29 CYS C C -0.231 1.743 -1.767 1.00 . A A . 29 CYS C 1 1 11 5076 1 1 29 CYS CA C 0.679 0.673 -1.157 1.00 . A A . 29 CYS CA 1 1 11 5077 1 1 29 CYS CB C 1.533 1.272 -0.037 1.00 . A A . 29 CYS CB 1 1 11 5078 1 1 29 CYS H H 2.567 0.545 -2.194 1.00 . A A . 29 CYS H 1 1 11 5079 1 1 29 CYS HA H 0.091 -0.139 -0.770 1.00 . A A . 29 CYS HA 1 1 11 5080 1 1 29 CYS HB2 H 2.497 0.785 -0.019 1.00 . A A . 29 CYS HB2 1 1 11 5081 1 1 29 CYS HB3 H 1.667 2.329 -0.211 1.00 . A A . 29 CYS HB3 1 1 11 5082 1 1 29 CYS N N 1.663 0.167 -2.164 1.00 . A A . 29 CYS N 1 1 11 5083 1 1 29 CYS O O 0.157 2.458 -2.664 1.00 . A A . 29 CYS O 1 1 11 5084 1 1 29 CYS SG S 0.708 1.024 1.553 1.00 . A A . 29 CYS SG 1 1 11 5085 1 1 30 VAL C C -3.177 3.485 -0.619 1.00 . A A . 30 VAL C 1 1 11 5086 1 1 30 VAL CA C -2.400 2.878 -1.790 1.00 . A A . 30 VAL CA 1 1 11 5087 1 1 30 VAL CB C -3.353 2.121 -2.727 1.00 . A A . 30 VAL CB 1 1 11 5088 1 1 30 VAL CG1 C -2.574 1.581 -3.926 1.00 . A A . 30 VAL CG1 1 1 11 5089 1 1 30 VAL CG2 C -4.013 0.953 -1.980 1.00 . A A . 30 VAL CG2 1 1 11 5090 1 1 30 VAL H H -1.712 1.261 -0.540 1.00 . A A . 30 VAL H 1 1 11 5091 1 1 30 VAL HA H -1.876 3.648 -2.332 1.00 . A A . 30 VAL HA 1 1 11 5092 1 1 30 VAL HB H -4.119 2.799 -3.078 1.00 . A A . 30 VAL HB 1 1 11 5093 1 1 30 VAL HG11 H -2.106 0.645 -3.659 1.00 . A A . 30 VAL HG11 1 1 11 5094 1 1 30 VAL HG12 H -1.815 2.293 -4.214 1.00 . A A . 30 VAL HG12 1 1 11 5095 1 1 30 VAL HG13 H -3.250 1.422 -4.752 1.00 . A A . 30 VAL HG13 1 1 11 5096 1 1 30 VAL HG21 H -3.809 1.039 -0.924 1.00 . A A . 30 VAL HG21 1 1 11 5097 1 1 30 VAL HG22 H -3.616 0.018 -2.348 1.00 . A A . 30 VAL HG22 1 1 11 5098 1 1 30 VAL HG23 H -5.080 0.979 -2.143 1.00 . A A . 30 VAL HG23 1 1 11 5099 1 1 30 VAL N N -1.437 1.853 -1.270 1.00 . A A . 30 VAL N 1 1 11 5100 1 1 30 VAL O O -2.989 3.101 0.515 1.00 . A A . 30 VAL O 1 1 11 5101 1 1 31 TYR C C -5.631 3.968 0.994 1.00 . A A . 31 TYR C 1 1 11 5102 1 1 31 TYR CA C -4.837 5.044 0.236 1.00 . A A . 31 TYR CA 1 1 11 5103 1 1 31 TYR CB C -5.781 6.059 -0.429 1.00 . A A . 31 TYR CB 1 1 11 5104 1 1 31 TYR CD1 C -7.989 4.867 -0.744 1.00 . A A . 31 TYR CD1 1 1 11 5105 1 1 31 TYR CD2 C -6.546 5.177 -2.670 1.00 . A A . 31 TYR CD2 1 1 11 5106 1 1 31 TYR CE1 C -8.926 4.213 -1.554 1.00 . A A . 31 TYR CE1 1 1 11 5107 1 1 31 TYR CE2 C -7.484 4.525 -3.477 1.00 . A A . 31 TYR CE2 1 1 11 5108 1 1 31 TYR CG C -6.796 5.349 -1.302 1.00 . A A . 31 TYR CG 1 1 11 5109 1 1 31 TYR CZ C -8.673 4.043 -2.920 1.00 . A A . 31 TYR CZ 1 1 11 5110 1 1 31 TYR H H -4.189 4.720 -1.803 1.00 . A A . 31 TYR H 1 1 11 5111 1 1 31 TYR HA H -4.172 5.556 0.915 1.00 . A A . 31 TYR HA 1 1 11 5112 1 1 31 TYR HB2 H -6.299 6.618 0.336 1.00 . A A . 31 TYR HB2 1 1 11 5113 1 1 31 TYR HB3 H -5.202 6.739 -1.036 1.00 . A A . 31 TYR HB3 1 1 11 5114 1 1 31 TYR HD1 H -8.184 4.997 0.309 1.00 . A A . 31 TYR HD1 1 1 11 5115 1 1 31 TYR HD2 H -5.628 5.547 -3.101 1.00 . A A . 31 TYR HD2 1 1 11 5116 1 1 31 TYR HE1 H -9.845 3.841 -1.124 1.00 . A A . 31 TYR HE1 1 1 11 5117 1 1 31 TYR HE2 H -7.290 4.394 -4.533 1.00 . A A . 31 TYR HE2 1 1 11 5118 1 1 31 TYR HH H -10.163 4.067 -4.115 1.00 . A A . 31 TYR HH 1 1 11 5119 1 1 31 TYR N N -4.051 4.425 -0.879 1.00 . A A . 31 TYR N 1 1 11 5120 1 1 31 TYR O O -5.996 2.947 0.440 1.00 . A A . 31 TYR O 1 1 11 5121 1 1 31 TYR OH O -9.598 3.400 -3.718 1.00 . A A . 31 TYR OH 1 1 11 5122 1 1 32 ALA C C -7.842 3.850 3.764 1.00 . A A . 32 ALA C 1 1 11 5123 1 1 32 ALA CA C -6.656 3.182 3.059 1.00 . A A . 32 ALA CA 1 1 11 5124 1 1 32 ALA CB C -5.653 2.648 4.082 1.00 . A A . 32 ALA CB 1 1 11 5125 1 1 32 ALA H H -5.585 5.018 2.684 1.00 . A A . 32 ALA H 1 1 11 5126 1 1 32 ALA HA H -6.999 2.380 2.426 1.00 . A A . 32 ALA HA 1 1 11 5127 1 1 32 ALA HB1 H -4.740 2.368 3.578 1.00 . A A . 32 ALA HB1 1 1 11 5128 1 1 32 ALA HB2 H -6.070 1.785 4.578 1.00 . A A . 32 ALA HB2 1 1 11 5129 1 1 32 ALA HB3 H -5.439 3.414 4.813 1.00 . A A . 32 ALA HB3 1 1 11 5130 1 1 32 ALA N N -5.894 4.189 2.258 1.00 . A A . 32 ALA N 1 1 11 5131 1 1 32 ALA O O -7.687 4.841 4.454 1.00 . A A . 32 ALA O 1 1 11 5132 1 1 33 ARG C C -11.312 2.836 4.440 1.00 . A A . 33 ARG C 1 1 11 5133 1 1 33 ARG CA C -10.225 3.904 4.256 1.00 . A A . 33 ARG CA 1 1 11 5134 1 1 33 ARG CB C -10.702 5.000 3.300 1.00 . A A . 33 ARG CB 1 1 11 5135 1 1 33 ARG CD C -11.044 7.478 3.219 1.00 . A A . 33 ARG CD 1 1 11 5136 1 1 33 ARG CG C -11.128 6.231 4.104 1.00 . A A . 33 ARG CG 1 1 11 5137 1 1 33 ARG CZ C -12.490 7.309 1.281 1.00 . A A . 33 ARG CZ 1 1 11 5138 1 1 33 ARG H H -9.119 2.509 3.037 1.00 . A A . 33 ARG H 1 1 11 5139 1 1 33 ARG HA H -9.955 4.335 5.207 1.00 . A A . 33 ARG HA 1 1 11 5140 1 1 33 ARG HB2 H -9.896 5.268 2.631 1.00 . A A . 33 ARG HB2 1 1 11 5141 1 1 33 ARG HB3 H -11.541 4.638 2.727 1.00 . A A . 33 ARG HB3 1 1 11 5142 1 1 33 ARG HD2 H -10.859 8.355 3.824 1.00 . A A . 33 ARG HD2 1 1 11 5143 1 1 33 ARG HD3 H -10.269 7.362 2.477 1.00 . A A . 33 ARG HD3 1 1 11 5144 1 1 33 ARG HE H -13.165 7.833 3.075 1.00 . A A . 33 ARG HE 1 1 11 5145 1 1 33 ARG HG2 H -12.144 6.100 4.449 1.00 . A A . 33 ARG HG2 1 1 11 5146 1 1 33 ARG HG3 H -10.473 6.351 4.953 1.00 . A A . 33 ARG HG3 1 1 11 5147 1 1 33 ARG HH11 H -11.778 9.091 0.693 1.00 . A A . 33 ARG HH11 1 1 11 5148 1 1 33 ARG HH12 H -12.221 8.004 -0.582 1.00 . A A . 33 ARG HH12 1 1 11 5149 1 1 33 ARG HH21 H -13.222 5.466 1.574 1.00 . A A . 33 ARG HH21 1 1 11 5150 1 1 33 ARG HH22 H -13.042 5.946 -0.081 1.00 . A A . 33 ARG HH22 1 1 11 5151 1 1 33 ARG N N -9.023 3.309 3.596 1.00 . A A . 33 ARG N 1 1 11 5152 1 1 33 ARG NE N -12.376 7.573 2.557 1.00 . A A . 33 ARG NE 1 1 11 5153 1 1 33 ARG NH1 N -12.136 8.205 0.394 1.00 . A A . 33 ARG NH1 1 1 11 5154 1 1 33 ARG NH2 N -12.954 6.150 0.894 1.00 . A A . 33 ARG NH2 1 1 11 5155 1 1 33 ARG O O -11.604 2.087 3.525 1.00 . A A . 33 ARG O 1 1 11 5156 1 1 34 PRO C C -14.237 2.149 5.173 1.00 . A A . 34 PRO C 1 1 11 5157 1 1 34 PRO CA C -12.946 1.812 5.933 1.00 . A A . 34 PRO CA 1 1 11 5158 1 1 34 PRO CB C -13.141 1.956 7.443 1.00 . A A . 34 PRO CB 1 1 11 5159 1 1 34 PRO CD C -11.582 3.665 6.775 1.00 . A A . 34 PRO CD 1 1 11 5160 1 1 34 PRO CG C -12.673 3.340 7.760 1.00 . A A . 34 PRO CG 1 1 11 5161 1 1 34 PRO HA H -12.616 0.812 5.700 1.00 . A A . 34 PRO HA 1 1 11 5162 1 1 34 PRO HB2 H -14.186 1.841 7.699 1.00 . A A . 34 PRO HB2 1 1 11 5163 1 1 34 PRO HB3 H -12.539 1.233 7.972 1.00 . A A . 34 PRO HB3 1 1 11 5164 1 1 34 PRO HD2 H -11.627 4.708 6.492 1.00 . A A . 34 PRO HD2 1 1 11 5165 1 1 34 PRO HD3 H -10.614 3.421 7.185 1.00 . A A . 34 PRO HD3 1 1 11 5166 1 1 34 PRO HG2 H -13.492 4.039 7.652 1.00 . A A . 34 PRO HG2 1 1 11 5167 1 1 34 PRO HG3 H -12.281 3.379 8.763 1.00 . A A . 34 PRO HG3 1 1 11 5168 1 1 34 PRO N N -11.877 2.800 5.625 1.00 . A A . 34 PRO N 1 1 11 5169 1 1 34 PRO O O -14.663 3.292 5.236 1.00 . A A . 34 PRO O 1 1 11 5170 1 1 34 PRO OXT O -14.775 1.256 4.541 1.00 . A A . 34 PRO OXT 1 1 12 5171 1 1 1 GLY C C 8.207 4.044 5.138 1.00 . A A . 1 GLY C 1 1 12 5172 1 1 1 GLY CA C 8.872 2.780 5.690 1.00 . A A . 1 GLY CA 1 1 12 5173 1 1 1 GLY H1 H 7.256 1.462 5.651 1.00 . A A . 1 GLY H1 1 1 12 5174 1 1 1 GLY H2 H 8.757 0.731 5.334 1.00 . A A . 1 GLY H2 1 1 12 5175 1 1 1 GLY H3 H 8.005 1.682 4.145 1.00 . A A . 1 GLY H3 1 1 12 5176 1 1 1 GLY HA2 H 8.819 2.786 6.771 1.00 . A A . 1 GLY HA2 1 1 12 5177 1 1 1 GLY HA3 H 9.906 2.757 5.382 1.00 . A A . 1 GLY HA3 1 1 12 5178 1 1 1 GLY N N 8.169 1.573 5.165 1.00 . A A . 1 GLY N 1 1 12 5179 1 1 1 GLY O O 8.848 4.860 4.503 1.00 . A A . 1 GLY O 1 1 12 5180 1 1 2 CYS C C 6.371 5.571 3.364 1.00 . A A . 2 CYS C 1 1 12 5181 1 1 2 CYS CA C 6.190 5.411 4.880 1.00 . A A . 2 CYS CA 1 1 12 5182 1 1 2 CYS CB C 6.790 6.602 5.634 1.00 . A A . 2 CYS CB 1 1 12 5183 1 1 2 CYS H H 6.444 3.526 5.897 1.00 . A A . 2 CYS H 1 1 12 5184 1 1 2 CYS HA H 5.142 5.324 5.114 1.00 . A A . 2 CYS HA 1 1 12 5185 1 1 2 CYS HB2 H 6.913 6.344 6.675 1.00 . A A . 2 CYS HB2 1 1 12 5186 1 1 2 CYS HB3 H 7.751 6.852 5.208 1.00 . A A . 2 CYS HB3 1 1 12 5187 1 1 2 CYS N N 6.927 4.205 5.380 1.00 . A A . 2 CYS N 1 1 12 5188 1 1 2 CYS O O 7.117 6.416 2.901 1.00 . A A . 2 CYS O 1 1 12 5189 1 1 2 CYS SG S 5.679 8.025 5.493 1.00 . A A . 2 CYS SG 1 1 12 5190 1 1 3 GLY C C 4.894 5.981 0.592 1.00 . A A . 3 GLY C 1 1 12 5191 1 1 3 GLY CA C 5.808 4.866 1.107 1.00 . A A . 3 GLY CA 1 1 12 5192 1 1 3 GLY H H 5.090 4.097 2.988 1.00 . A A . 3 GLY H 1 1 12 5193 1 1 3 GLY HA2 H 6.833 5.088 0.844 1.00 . A A . 3 GLY HA2 1 1 12 5194 1 1 3 GLY HA3 H 5.515 3.930 0.659 1.00 . A A . 3 GLY HA3 1 1 12 5195 1 1 3 GLY N N 5.687 4.766 2.591 1.00 . A A . 3 GLY N 1 1 12 5196 1 1 3 GLY O O 5.335 7.084 0.331 1.00 . A A . 3 GLY O 1 1 12 5197 1 1 4 GLY C C 1.506 6.062 -0.774 1.00 . A A . 4 GLY C 1 1 12 5198 1 1 4 GLY CA C 2.672 6.739 -0.051 1.00 . A A . 4 GLY CA 1 1 12 5199 1 1 4 GLY H H 3.294 4.803 0.664 1.00 . A A . 4 GLY H 1 1 12 5200 1 1 4 GLY HA2 H 2.296 7.310 0.787 1.00 . A A . 4 GLY HA2 1 1 12 5201 1 1 4 GLY HA3 H 3.183 7.398 -0.737 1.00 . A A . 4 GLY HA3 1 1 12 5202 1 1 4 GLY N N 3.623 5.699 0.445 1.00 . A A . 4 GLY N 1 1 12 5203 1 1 4 GLY O O 0.937 5.103 -0.286 1.00 . A A . 4 GLY O 1 1 12 5204 1 1 5 LEU C C 0.524 5.110 -3.883 1.00 . A A . 5 LEU C 1 1 12 5205 1 1 5 LEU CA C 0.011 5.942 -2.695 1.00 . A A . 5 LEU CA 1 1 12 5206 1 1 5 LEU CB C -0.825 7.125 -3.183 1.00 . A A . 5 LEU CB 1 1 12 5207 1 1 5 LEU CD1 C -2.974 8.181 -2.475 1.00 . A A . 5 LEU CD1 1 1 12 5208 1 1 5 LEU CD2 C -2.986 6.280 -4.101 1.00 . A A . 5 LEU CD2 1 1 12 5209 1 1 5 LEU CG C -2.298 6.866 -2.866 1.00 . A A . 5 LEU CG 1 1 12 5210 1 1 5 LEU H H 1.619 7.329 -2.306 1.00 . A A . 5 LEU H 1 1 12 5211 1 1 5 LEU HA H -0.582 5.325 -2.040 1.00 . A A . 5 LEU HA 1 1 12 5212 1 1 5 LEU HB2 H -0.500 8.026 -2.683 1.00 . A A . 5 LEU HB2 1 1 12 5213 1 1 5 LEU HB3 H -0.703 7.239 -4.250 1.00 . A A . 5 LEU HB3 1 1 12 5214 1 1 5 LEU HD11 H -2.409 8.654 -1.686 1.00 . A A . 5 LEU HD11 1 1 12 5215 1 1 5 LEU HD12 H -3.977 7.981 -2.129 1.00 . A A . 5 LEU HD12 1 1 12 5216 1 1 5 LEU HD13 H -3.011 8.836 -3.332 1.00 . A A . 5 LEU HD13 1 1 12 5217 1 1 5 LEU HD21 H -2.729 6.870 -4.969 1.00 . A A . 5 LEU HD21 1 1 12 5218 1 1 5 LEU HD22 H -4.056 6.294 -3.959 1.00 . A A . 5 LEU HD22 1 1 12 5219 1 1 5 LEU HD23 H -2.656 5.262 -4.247 1.00 . A A . 5 LEU HD23 1 1 12 5220 1 1 5 LEU HG H -2.372 6.167 -2.045 1.00 . A A . 5 LEU HG 1 1 12 5221 1 1 5 LEU N N 1.144 6.555 -1.934 1.00 . A A . 5 LEU N 1 1 12 5222 1 1 5 LEU O O -0.242 4.448 -4.558 1.00 . A A . 5 LEU O 1 1 12 5223 1 1 6 MET C C 3.807 3.885 -4.926 1.00 . A A . 6 MET C 1 1 12 5224 1 1 6 MET CA C 2.375 4.322 -5.262 1.00 . A A . 6 MET CA 1 1 12 5225 1 1 6 MET CB C 2.366 5.257 -6.474 1.00 . A A . 6 MET CB 1 1 12 5226 1 1 6 MET CE C 0.516 3.998 -9.524 1.00 . A A . 6 MET CE 1 1 12 5227 1 1 6 MET CG C 2.528 4.433 -7.754 1.00 . A A . 6 MET CG 1 1 12 5228 1 1 6 MET H H 2.414 5.653 -3.571 1.00 . A A . 6 MET H 1 1 12 5229 1 1 6 MET HA H 1.757 3.460 -5.455 1.00 . A A . 6 MET HA 1 1 12 5230 1 1 6 MET HB2 H 1.430 5.796 -6.507 1.00 . A A . 6 MET HB2 1 1 12 5231 1 1 6 MET HB3 H 3.183 5.958 -6.395 1.00 . A A . 6 MET HB3 1 1 12 5232 1 1 6 MET HE1 H 0.412 3.919 -10.596 1.00 . A A . 6 MET HE1 1 1 12 5233 1 1 6 MET HE2 H -0.437 4.249 -9.088 1.00 . A A . 6 MET HE2 1 1 12 5234 1 1 6 MET HE3 H 0.856 3.053 -9.120 1.00 . A A . 6 MET HE3 1 1 12 5235 1 1 6 MET HG2 H 3.579 4.311 -7.971 1.00 . A A . 6 MET HG2 1 1 12 5236 1 1 6 MET HG3 H 2.074 3.463 -7.616 1.00 . A A . 6 MET HG3 1 1 12 5237 1 1 6 MET N N 1.812 5.124 -4.134 1.00 . A A . 6 MET N 1 1 12 5238 1 1 6 MET O O 4.658 3.786 -5.792 1.00 . A A . 6 MET O 1 1 12 5239 1 1 6 MET SD S 1.722 5.288 -9.130 1.00 . A A . 6 MET SD 1 1 12 5240 1 1 7 ALA C C 5.701 1.741 -3.697 1.00 . A A . 7 ALA C 1 1 12 5241 1 1 7 ALA CA C 5.452 3.191 -3.265 1.00 . A A . 7 ALA CA 1 1 12 5242 1 1 7 ALA CB C 5.470 3.318 -1.739 1.00 . A A . 7 ALA CB 1 1 12 5243 1 1 7 ALA H H 3.371 3.709 -2.992 1.00 . A A . 7 ALA H 1 1 12 5244 1 1 7 ALA HA H 6.195 3.842 -3.697 1.00 . A A . 7 ALA HA 1 1 12 5245 1 1 7 ALA HB1 H 6.184 2.621 -1.326 1.00 . A A . 7 ALA HB1 1 1 12 5246 1 1 7 ALA HB2 H 4.488 3.101 -1.346 1.00 . A A . 7 ALA HB2 1 1 12 5247 1 1 7 ALA HB3 H 5.752 4.324 -1.467 1.00 . A A . 7 ALA HB3 1 1 12 5248 1 1 7 ALA N N 4.077 3.623 -3.670 1.00 . A A . 7 ALA N 1 1 12 5249 1 1 7 ALA O O 4.952 1.177 -4.467 1.00 . A A . 7 ALA O 1 1 12 5250 1 1 8 GLY C C 6.939 -1.182 -2.379 1.00 . A A . 8 GLY C 1 1 12 5251 1 1 8 GLY CA C 7.044 -0.276 -3.606 1.00 . A A . 8 GLY CA 1 1 12 5252 1 1 8 GLY H H 7.352 1.609 -2.601 1.00 . A A . 8 GLY H 1 1 12 5253 1 1 8 GLY HA2 H 6.330 -0.597 -4.350 1.00 . A A . 8 GLY HA2 1 1 12 5254 1 1 8 GLY HA3 H 8.041 -0.340 -4.012 1.00 . A A . 8 GLY HA3 1 1 12 5255 1 1 8 GLY N N 6.752 1.135 -3.214 1.00 . A A . 8 GLY N 1 1 12 5256 1 1 8 GLY O O 7.913 -1.425 -1.691 1.00 . A A . 8 GLY O 1 1 12 5257 1 1 9 CYS C C 5.578 -4.055 -1.380 1.00 . A A . 9 CYS C 1 1 12 5258 1 1 9 CYS CA C 5.582 -2.585 -0.926 1.00 . A A . 9 CYS CA 1 1 12 5259 1 1 9 CYS CB C 4.235 -2.174 -0.321 1.00 . A A . 9 CYS CB 1 1 12 5260 1 1 9 CYS H H 4.996 -1.475 -2.679 1.00 . A A . 9 CYS H 1 1 12 5261 1 1 9 CYS HA H 6.371 -2.420 -0.208 1.00 . A A . 9 CYS HA 1 1 12 5262 1 1 9 CYS HB2 H 4.127 -2.628 0.652 1.00 . A A . 9 CYS HB2 1 1 12 5263 1 1 9 CYS HB3 H 4.202 -1.099 -0.220 1.00 . A A . 9 CYS HB3 1 1 12 5264 1 1 9 CYS N N 5.762 -1.686 -2.105 1.00 . A A . 9 CYS N 1 1 12 5265 1 1 9 CYS O O 4.674 -4.811 -1.077 1.00 . A A . 9 CYS O 1 1 12 5266 1 1 9 CYS SG S 2.878 -2.719 -1.390 1.00 . A A . 9 CYS SG 1 1 12 5267 1 1 10 ASP C C 6.958 -6.818 -1.404 1.00 . A A . 10 ASP C 1 1 12 5268 1 1 10 ASP CA C 6.654 -5.881 -2.580 1.00 . A A . 10 ASP CA 1 1 12 5269 1 1 10 ASP CB C 7.787 -5.908 -3.612 1.00 . A A . 10 ASP CB 1 1 12 5270 1 1 10 ASP CG C 7.954 -7.331 -4.155 1.00 . A A . 10 ASP CG 1 1 12 5271 1 1 10 ASP H H 7.310 -3.839 -2.331 1.00 . A A . 10 ASP H 1 1 12 5272 1 1 10 ASP HA H 5.723 -6.159 -3.050 1.00 . A A . 10 ASP HA 1 1 12 5273 1 1 10 ASP HB2 H 7.549 -5.239 -4.427 1.00 . A A . 10 ASP HB2 1 1 12 5274 1 1 10 ASP HB3 H 8.709 -5.592 -3.144 1.00 . A A . 10 ASP HB3 1 1 12 5275 1 1 10 ASP N N 6.591 -4.464 -2.104 1.00 . A A . 10 ASP N 1 1 12 5276 1 1 10 ASP O O 8.093 -6.954 -0.983 1.00 . A A . 10 ASP O 1 1 12 5277 1 1 10 ASP OD1 O 7.141 -7.733 -4.972 1.00 . A A . 10 ASP OD1 1 1 12 5278 1 1 10 ASP OD2 O 8.891 -7.995 -3.741 1.00 . A A . 10 ASP OD2 1 1 12 5279 1 1 11 GLY C C 4.902 -8.415 1.139 1.00 . A A . 11 GLY C 1 1 12 5280 1 1 11 GLY CA C 6.163 -8.383 0.277 1.00 . A A . 11 GLY CA 1 1 12 5281 1 1 11 GLY H H 5.046 -7.328 -1.228 1.00 . A A . 11 GLY H 1 1 12 5282 1 1 11 GLY HA2 H 6.375 -9.378 -0.092 1.00 . A A . 11 GLY HA2 1 1 12 5283 1 1 11 GLY HA3 H 6.992 -8.035 0.872 1.00 . A A . 11 GLY HA3 1 1 12 5284 1 1 11 GLY N N 5.949 -7.459 -0.872 1.00 . A A . 11 GLY N 1 1 12 5285 1 1 11 GLY O O 4.407 -7.390 1.569 1.00 . A A . 11 GLY O 1 1 12 5286 1 1 12 LYS C C 3.408 -9.203 3.673 1.00 . A A . 12 LYS C 1 1 12 5287 1 1 12 LYS CA C 3.147 -9.704 2.241 1.00 . A A . 12 LYS CA 1 1 12 5288 1 1 12 LYS CB C 2.787 -11.199 2.251 1.00 . A A . 12 LYS CB 1 1 12 5289 1 1 12 LYS CD C 3.776 -12.946 3.763 1.00 . A A . 12 LYS CD 1 1 12 5290 1 1 12 LYS CE C 4.918 -13.964 3.903 1.00 . A A . 12 LYS CE 1 1 12 5291 1 1 12 LYS CG C 4.034 -12.041 2.554 1.00 . A A . 12 LYS CG 1 1 12 5292 1 1 12 LYS H H 4.807 -10.393 1.037 1.00 . A A . 12 LYS H 1 1 12 5293 1 1 12 LYS HA H 2.341 -9.142 1.796 1.00 . A A . 12 LYS HA 1 1 12 5294 1 1 12 LYS HB2 H 2.039 -11.379 3.009 1.00 . A A . 12 LYS HB2 1 1 12 5295 1 1 12 LYS HB3 H 2.394 -11.477 1.286 1.00 . A A . 12 LYS HB3 1 1 12 5296 1 1 12 LYS HD2 H 3.719 -12.342 4.657 1.00 . A A . 12 LYS HD2 1 1 12 5297 1 1 12 LYS HD3 H 2.843 -13.472 3.625 1.00 . A A . 12 LYS HD3 1 1 12 5298 1 1 12 LYS HE2 H 4.813 -14.517 4.826 1.00 . A A . 12 LYS HE2 1 1 12 5299 1 1 12 LYS HE3 H 4.926 -14.637 3.060 1.00 . A A . 12 LYS HE3 1 1 12 5300 1 1 12 LYS HG2 H 4.272 -12.650 1.694 1.00 . A A . 12 LYS HG2 1 1 12 5301 1 1 12 LYS HG3 H 4.866 -11.388 2.771 1.00 . A A . 12 LYS HG3 1 1 12 5302 1 1 12 LYS HZ1 H 6.030 -12.303 4.503 1.00 . A A . 12 LYS HZ1 1 1 12 5303 1 1 12 LYS HZ2 H 6.420 -12.873 2.951 1.00 . A A . 12 LYS HZ2 1 1 12 5304 1 1 12 LYS HZ3 H 6.944 -13.719 4.326 1.00 . A A . 12 LYS HZ3 1 1 12 5305 1 1 12 LYS N N 4.382 -9.587 1.396 1.00 . A A . 12 LYS N 1 1 12 5306 1 1 12 LYS NZ N 6.172 -13.153 3.923 1.00 . A A . 12 LYS NZ 1 1 12 5307 1 1 12 LYS O O 2.484 -8.966 4.427 1.00 . A A . 12 LYS O 1 1 12 5308 1 1 13 SER C C 5.493 -7.095 5.368 1.00 . A A . 13 SER C 1 1 12 5309 1 1 13 SER CA C 4.969 -8.541 5.424 1.00 . A A . 13 SER CA 1 1 12 5310 1 1 13 SER CB C 6.048 -9.491 5.945 1.00 . A A . 13 SER CB 1 1 12 5311 1 1 13 SER H H 5.385 -9.224 3.423 1.00 . A A . 13 SER H 1 1 12 5312 1 1 13 SER HA H 4.093 -8.599 6.052 1.00 . A A . 13 SER HA 1 1 12 5313 1 1 13 SER HB2 H 5.804 -10.503 5.671 1.00 . A A . 13 SER HB2 1 1 12 5314 1 1 13 SER HB3 H 7.003 -9.224 5.511 1.00 . A A . 13 SER HB3 1 1 12 5315 1 1 13 SER HG H 5.546 -10.074 7.731 1.00 . A A . 13 SER HG 1 1 12 5316 1 1 13 SER N N 4.656 -9.034 4.048 1.00 . A A . 13 SER N 1 1 12 5317 1 1 13 SER O O 6.279 -6.681 6.199 1.00 . A A . 13 SER O 1 1 12 5318 1 1 13 SER OG O 6.114 -9.394 7.361 1.00 . A A . 13 SER OG 1 1 12 5319 1 1 14 THR C C 4.511 -3.954 4.935 1.00 . A A . 14 THR C 1 1 12 5320 1 1 14 THR CA C 5.527 -4.907 4.285 1.00 . A A . 14 THR CA 1 1 12 5321 1 1 14 THR CB C 5.643 -4.635 2.775 1.00 . A A . 14 THR CB 1 1 12 5322 1 1 14 THR CG2 C 4.248 -4.504 2.156 1.00 . A A . 14 THR CG2 1 1 12 5323 1 1 14 THR H H 4.422 -6.683 3.741 1.00 . A A . 14 THR H 1 1 12 5324 1 1 14 THR HA H 6.493 -4.796 4.751 1.00 . A A . 14 THR HA 1 1 12 5325 1 1 14 THR HB H 6.167 -5.450 2.300 1.00 . A A . 14 THR HB 1 1 12 5326 1 1 14 THR HG1 H 6.825 -3.495 1.729 1.00 . A A . 14 THR HG1 1 1 12 5327 1 1 14 THR HG21 H 3.890 -3.494 2.286 1.00 . A A . 14 THR HG21 1 1 12 5328 1 1 14 THR HG22 H 3.571 -5.190 2.642 1.00 . A A . 14 THR HG22 1 1 12 5329 1 1 14 THR HG23 H 4.299 -4.736 1.103 1.00 . A A . 14 THR HG23 1 1 12 5330 1 1 14 THR N N 5.059 -6.327 4.396 1.00 . A A . 14 THR N 1 1 12 5331 1 1 14 THR O O 3.405 -4.342 5.265 1.00 . A A . 14 THR O 1 1 12 5332 1 1 14 THR OG1 O 6.366 -3.427 2.569 1.00 . A A . 14 THR OG1 1 1 12 5333 1 1 15 PHE C C 4.211 -0.311 5.183 1.00 . A A . 15 PHE C 1 1 12 5334 1 1 15 PHE CA C 3.940 -1.722 5.733 1.00 . A A . 15 PHE CA 1 1 12 5335 1 1 15 PHE CB C 4.208 -1.800 7.247 1.00 . A A . 15 PHE CB 1 1 12 5336 1 1 15 PHE CD1 C 6.721 -1.528 7.337 1.00 . A A . 15 PHE CD1 1 1 12 5337 1 1 15 PHE CD2 C 5.322 0.240 8.228 1.00 . A A . 15 PHE CD2 1 1 12 5338 1 1 15 PHE CE1 C 7.865 -0.795 7.678 1.00 . A A . 15 PHE CE1 1 1 12 5339 1 1 15 PHE CE2 C 6.465 0.973 8.568 1.00 . A A . 15 PHE CE2 1 1 12 5340 1 1 15 PHE CG C 5.449 -1.010 7.612 1.00 . A A . 15 PHE CG 1 1 12 5341 1 1 15 PHE CZ C 7.736 0.456 8.294 1.00 . A A . 15 PHE CZ 1 1 12 5342 1 1 15 PHE H H 5.774 -2.421 4.833 1.00 . A A . 15 PHE H 1 1 12 5343 1 1 15 PHE HA H 2.920 -2.006 5.529 1.00 . A A . 15 PHE HA 1 1 12 5344 1 1 15 PHE HB2 H 3.360 -1.395 7.778 1.00 . A A . 15 PHE HB2 1 1 12 5345 1 1 15 PHE HB3 H 4.347 -2.833 7.531 1.00 . A A . 15 PHE HB3 1 1 12 5346 1 1 15 PHE HD1 H 6.821 -2.493 6.862 1.00 . A A . 15 PHE HD1 1 1 12 5347 1 1 15 PHE HD2 H 4.341 0.641 8.440 1.00 . A A . 15 PHE HD2 1 1 12 5348 1 1 15 PHE HE1 H 8.845 -1.194 7.466 1.00 . A A . 15 PHE HE1 1 1 12 5349 1 1 15 PHE HE2 H 6.366 1.939 9.043 1.00 . A A . 15 PHE HE2 1 1 12 5350 1 1 15 PHE HZ H 8.617 1.022 8.556 1.00 . A A . 15 PHE HZ 1 1 12 5351 1 1 15 PHE N N 4.879 -2.708 5.112 1.00 . A A . 15 PHE N 1 1 12 5352 1 1 15 PHE O O 5.337 0.047 4.889 1.00 . A A . 15 PHE O 1 1 12 5353 1 1 16 CYS C C 3.622 2.857 5.662 1.00 . A A . 16 CYS C 1 1 12 5354 1 1 16 CYS CA C 3.367 1.875 4.504 1.00 . A A . 16 CYS CA 1 1 12 5355 1 1 16 CYS CB C 2.057 2.200 3.771 1.00 . A A . 16 CYS CB 1 1 12 5356 1 1 16 CYS H H 2.283 0.175 5.279 1.00 . A A . 16 CYS H 1 1 12 5357 1 1 16 CYS HA H 4.191 1.898 3.808 1.00 . A A . 16 CYS HA 1 1 12 5358 1 1 16 CYS HB2 H 1.270 2.356 4.493 1.00 . A A . 16 CYS HB2 1 1 12 5359 1 1 16 CYS HB3 H 2.187 3.096 3.183 1.00 . A A . 16 CYS HB3 1 1 12 5360 1 1 16 CYS N N 3.181 0.488 5.039 1.00 . A A . 16 CYS N 1 1 12 5361 1 1 16 CYS O O 4.273 2.518 6.632 1.00 . A A . 16 CYS O 1 1 12 5362 1 1 16 CYS SG S 1.606 0.823 2.679 1.00 . A A . 16 CYS SG 1 1 12 5363 1 1 17 CYS C C 2.367 4.849 7.813 1.00 . A A . 17 CYS C 1 1 12 5364 1 1 17 CYS CA C 3.362 5.062 6.668 1.00 . A A . 17 CYS CA 1 1 12 5365 1 1 17 CYS CB C 3.161 6.436 6.021 1.00 . A A . 17 CYS CB 1 1 12 5366 1 1 17 CYS H H 2.613 4.333 4.779 1.00 . A A . 17 CYS H 1 1 12 5367 1 1 17 CYS HA H 4.369 4.978 7.036 1.00 . A A . 17 CYS HA 1 1 12 5368 1 1 17 CYS HB2 H 3.421 6.383 4.974 1.00 . A A . 17 CYS HB2 1 1 12 5369 1 1 17 CYS HB3 H 2.128 6.736 6.120 1.00 . A A . 17 CYS HB3 1 1 12 5370 1 1 17 CYS N N 3.129 4.071 5.570 1.00 . A A . 17 CYS N 1 1 12 5371 1 1 17 CYS O O 2.743 4.493 8.914 1.00 . A A . 17 CYS O 1 1 12 5372 1 1 17 CYS SG S 4.222 7.653 6.841 1.00 . A A . 17 CYS SG 1 1 12 5373 1 1 18 SER C C -1.333 4.835 8.025 1.00 . A A . 18 SER C 1 1 12 5374 1 1 18 SER CA C 0.073 4.888 8.634 1.00 . A A . 18 SER CA 1 1 12 5375 1 1 18 SER CB C 0.225 6.112 9.541 1.00 . A A . 18 SER CB 1 1 12 5376 1 1 18 SER H H 0.830 5.357 6.668 1.00 . A A . 18 SER H 1 1 12 5377 1 1 18 SER HA H 0.270 3.991 9.192 1.00 . A A . 18 SER HA 1 1 12 5378 1 1 18 SER HB2 H 1.232 6.156 9.921 1.00 . A A . 18 SER HB2 1 1 12 5379 1 1 18 SER HB3 H 0.017 7.009 8.972 1.00 . A A . 18 SER HB3 1 1 12 5380 1 1 18 SER HG H -1.472 6.502 10.409 1.00 . A A . 18 SER HG 1 1 12 5381 1 1 18 SER N N 1.102 5.069 7.562 1.00 . A A . 18 SER N 1 1 12 5382 1 1 18 SER O O -2.114 3.952 8.328 1.00 . A A . 18 SER O 1 1 12 5383 1 1 18 SER OG O -0.681 6.006 10.632 1.00 . A A . 18 SER OG 1 1 12 5384 1 1 19 GLY C C -2.921 5.121 5.135 1.00 . A A . 19 GLY C 1 1 12 5385 1 1 19 GLY CA C -3.002 5.774 6.521 1.00 . A A . 19 GLY CA 1 1 12 5386 1 1 19 GLY H H -1.001 6.458 6.933 1.00 . A A . 19 GLY H 1 1 12 5387 1 1 19 GLY HA2 H -3.698 5.226 7.139 1.00 . A A . 19 GLY HA2 1 1 12 5388 1 1 19 GLY HA3 H -3.342 6.793 6.414 1.00 . A A . 19 GLY HA3 1 1 12 5389 1 1 19 GLY N N -1.653 5.767 7.163 1.00 . A A . 19 GLY N 1 1 12 5390 1 1 19 GLY O O -3.736 5.385 4.271 1.00 . A A . 19 GLY O 1 1 12 5391 1 1 20 TYR C C -1.569 2.094 3.773 1.00 . A A . 20 TYR C 1 1 12 5392 1 1 20 TYR CA C -1.804 3.599 3.585 1.00 . A A . 20 TYR CA 1 1 12 5393 1 1 20 TYR CB C -0.580 4.248 2.924 1.00 . A A . 20 TYR CB 1 1 12 5394 1 1 20 TYR CD1 C -1.484 6.111 1.482 1.00 . A A . 20 TYR CD1 1 1 12 5395 1 1 20 TYR CD2 C -0.461 6.675 3.607 1.00 . A A . 20 TYR CD2 1 1 12 5396 1 1 20 TYR CE1 C -1.734 7.467 1.242 1.00 . A A . 20 TYR CE1 1 1 12 5397 1 1 20 TYR CE2 C -0.710 8.031 3.367 1.00 . A A . 20 TYR CE2 1 1 12 5398 1 1 20 TYR CG C -0.848 5.713 2.664 1.00 . A A . 20 TYR CG 1 1 12 5399 1 1 20 TYR CZ C -1.347 8.427 2.185 1.00 . A A . 20 TYR CZ 1 1 12 5400 1 1 20 TYR H H -1.294 4.076 5.624 1.00 . A A . 20 TYR H 1 1 12 5401 1 1 20 TYR HA H -2.681 3.771 2.983 1.00 . A A . 20 TYR HA 1 1 12 5402 1 1 20 TYR HB2 H 0.276 4.150 3.577 1.00 . A A . 20 TYR HB2 1 1 12 5403 1 1 20 TYR HB3 H -0.374 3.750 1.987 1.00 . A A . 20 TYR HB3 1 1 12 5404 1 1 20 TYR HD1 H -1.782 5.371 0.754 1.00 . A A . 20 TYR HD1 1 1 12 5405 1 1 20 TYR HD2 H 0.030 6.370 4.519 1.00 . A A . 20 TYR HD2 1 1 12 5406 1 1 20 TYR HE1 H -2.224 7.773 0.330 1.00 . A A . 20 TYR HE1 1 1 12 5407 1 1 20 TYR HE2 H -0.412 8.773 4.094 1.00 . A A . 20 TYR HE2 1 1 12 5408 1 1 20 TYR HH H -2.409 10.001 2.397 1.00 . A A . 20 TYR HH 1 1 12 5409 1 1 20 TYR N N -1.941 4.271 4.914 1.00 . A A . 20 TYR N 1 1 12 5410 1 1 20 TYR O O -0.911 1.673 4.707 1.00 . A A . 20 TYR O 1 1 12 5411 1 1 20 TYR OH O -1.594 9.764 1.947 1.00 . A A . 20 TYR OH 1 1 12 5412 1 1 21 ASN C C -1.242 -0.727 1.723 1.00 . A A . 21 ASN C 1 1 12 5413 1 1 21 ASN CA C -1.900 -0.193 2.998 1.00 . A A . 21 ASN CA 1 1 12 5414 1 1 21 ASN CB C -3.308 -0.772 3.161 1.00 . A A . 21 ASN CB 1 1 12 5415 1 1 21 ASN CG C -3.684 -0.793 4.646 1.00 . A A . 21 ASN CG 1 1 12 5416 1 1 21 ASN H H -2.614 1.655 2.140 1.00 . A A . 21 ASN H 1 1 12 5417 1 1 21 ASN HA H -1.299 -0.432 3.860 1.00 . A A . 21 ASN HA 1 1 12 5418 1 1 21 ASN HB2 H -4.015 -0.159 2.619 1.00 . A A . 21 ASN HB2 1 1 12 5419 1 1 21 ASN HB3 H -3.332 -1.780 2.772 1.00 . A A . 21 ASN HB3 1 1 12 5420 1 1 21 ASN HD21 H -2.757 -2.514 5.005 1.00 . A A . 21 ASN HD21 1 1 12 5421 1 1 21 ASN HD22 H -3.525 -1.810 6.345 1.00 . A A . 21 ASN HD22 1 1 12 5422 1 1 21 ASN N N -2.094 1.286 2.887 1.00 . A A . 21 ASN N 1 1 12 5423 1 1 21 ASN ND2 N -3.290 -1.789 5.394 1.00 . A A . 21 ASN ND2 1 1 12 5424 1 1 21 ASN O O -1.312 -0.110 0.684 1.00 . A A . 21 ASN O 1 1 12 5425 1 1 21 ASN OD1 O -4.343 0.105 5.130 1.00 . A A . 21 ASN OD1 1 1 12 5426 1 1 22 CYS C C -0.923 -3.279 -0.237 1.00 . A A . 22 CYS C 1 1 12 5427 1 1 22 CYS CA C 0.058 -2.417 0.563 1.00 . A A . 22 CYS CA 1 1 12 5428 1 1 22 CYS CB C 1.221 -3.268 1.073 1.00 . A A . 22 CYS CB 1 1 12 5429 1 1 22 CYS H H -0.554 -2.357 2.635 1.00 . A A . 22 CYS H 1 1 12 5430 1 1 22 CYS HA H 0.435 -1.613 -0.051 1.00 . A A . 22 CYS HA 1 1 12 5431 1 1 22 CYS HB2 H 1.963 -2.629 1.528 1.00 . A A . 22 CYS HB2 1 1 12 5432 1 1 22 CYS HB3 H 0.858 -3.974 1.803 1.00 . A A . 22 CYS HB3 1 1 12 5433 1 1 22 CYS N N -0.603 -1.868 1.787 1.00 . A A . 22 CYS N 1 1 12 5434 1 1 22 CYS O O -1.717 -4.015 0.320 1.00 . A A . 22 CYS O 1 1 12 5435 1 1 22 CYS SG S 1.961 -4.161 -0.315 1.00 . A A . 22 CYS SG 1 1 12 5436 1 1 23 SER C C -1.009 -5.138 -3.074 1.00 . A A . 23 SER C 1 1 12 5437 1 1 23 SER CA C -1.784 -3.998 -2.398 1.00 . A A . 23 SER CA 1 1 12 5438 1 1 23 SER CB C -2.323 -3.017 -3.440 1.00 . A A . 23 SER CB 1 1 12 5439 1 1 23 SER H H -0.213 -2.590 -1.962 1.00 . A A . 23 SER H 1 1 12 5440 1 1 23 SER HA H -2.597 -4.392 -1.808 1.00 . A A . 23 SER HA 1 1 12 5441 1 1 23 SER HB2 H -1.769 -2.094 -3.390 1.00 . A A . 23 SER HB2 1 1 12 5442 1 1 23 SER HB3 H -2.212 -3.446 -4.427 1.00 . A A . 23 SER HB3 1 1 12 5443 1 1 23 SER HG H -3.802 -1.806 -3.080 1.00 . A A . 23 SER HG 1 1 12 5444 1 1 23 SER N N -0.866 -3.190 -1.542 1.00 . A A . 23 SER N 1 1 12 5445 1 1 23 SER O O 0.062 -4.923 -3.607 1.00 . A A . 23 SER O 1 1 12 5446 1 1 23 SER OG O -3.694 -2.755 -3.173 1.00 . A A . 23 SER OG 1 1 12 5447 1 1 24 PRO C C -1.023 -7.468 -5.170 1.00 . A A . 24 PRO C 1 1 12 5448 1 1 24 PRO CA C -0.928 -7.511 -3.636 1.00 . A A . 24 PRO CA 1 1 12 5449 1 1 24 PRO CB C -1.729 -8.684 -3.075 1.00 . A A . 24 PRO CB 1 1 12 5450 1 1 24 PRO CD C -2.864 -6.661 -2.395 1.00 . A A . 24 PRO CD 1 1 12 5451 1 1 24 PRO CG C -3.069 -8.115 -2.733 1.00 . A A . 24 PRO CG 1 1 12 5452 1 1 24 PRO HA H 0.098 -7.585 -3.321 1.00 . A A . 24 PRO HA 1 1 12 5453 1 1 24 PRO HB2 H -1.827 -9.462 -3.820 1.00 . A A . 24 PRO HB2 1 1 12 5454 1 1 24 PRO HB3 H -1.256 -9.071 -2.186 1.00 . A A . 24 PRO HB3 1 1 12 5455 1 1 24 PRO HD2 H -3.664 -6.062 -2.811 1.00 . A A . 24 PRO HD2 1 1 12 5456 1 1 24 PRO HD3 H -2.804 -6.525 -1.327 1.00 . A A . 24 PRO HD3 1 1 12 5457 1 1 24 PRO HG2 H -3.734 -8.208 -3.581 1.00 . A A . 24 PRO HG2 1 1 12 5458 1 1 24 PRO HG3 H -3.483 -8.630 -1.881 1.00 . A A . 24 PRO HG3 1 1 12 5459 1 1 24 PRO N N -1.579 -6.321 -3.022 1.00 . A A . 24 PRO N 1 1 12 5460 1 1 24 PRO O O -0.169 -7.988 -5.862 1.00 . A A . 24 PRO O 1 1 12 5461 1 1 25 THR C C -1.461 -5.562 -7.750 1.00 . A A . 25 THR C 1 1 12 5462 1 1 25 THR CA C -2.205 -6.783 -7.191 1.00 . A A . 25 THR CA 1 1 12 5463 1 1 25 THR CB C -3.717 -6.653 -7.427 1.00 . A A . 25 THR CB 1 1 12 5464 1 1 25 THR CG2 C -3.990 -6.291 -8.890 1.00 . A A . 25 THR CG2 1 1 12 5465 1 1 25 THR H H -2.729 -6.449 -5.122 1.00 . A A . 25 THR H 1 1 12 5466 1 1 25 THR HA H -1.839 -7.685 -7.648 1.00 . A A . 25 THR HA 1 1 12 5467 1 1 25 THR HB H -4.115 -5.881 -6.789 1.00 . A A . 25 THR HB 1 1 12 5468 1 1 25 THR HG1 H -5.194 -7.698 -6.712 1.00 . A A . 25 THR HG1 1 1 12 5469 1 1 25 THR HG21 H -5.012 -6.537 -9.138 1.00 . A A . 25 THR HG21 1 1 12 5470 1 1 25 THR HG22 H -3.320 -6.844 -9.532 1.00 . A A . 25 THR HG22 1 1 12 5471 1 1 25 THR HG23 H -3.832 -5.231 -9.034 1.00 . A A . 25 THR HG23 1 1 12 5472 1 1 25 THR N N -2.053 -6.857 -5.701 1.00 . A A . 25 THR N 1 1 12 5473 1 1 25 THR O O -0.885 -5.616 -8.820 1.00 . A A . 25 THR O 1 1 12 5474 1 1 25 THR OG1 O -4.347 -7.890 -7.122 1.00 . A A . 25 THR OG1 1 1 12 5475 1 1 26 TRP C C 0.683 -3.200 -7.045 1.00 . A A . 26 TRP C 1 1 12 5476 1 1 26 TRP CA C -0.779 -3.233 -7.524 1.00 . A A . 26 TRP CA 1 1 12 5477 1 1 26 TRP CB C -1.572 -2.067 -6.928 1.00 . A A . 26 TRP CB 1 1 12 5478 1 1 26 TRP CD1 C -3.980 -2.701 -6.478 1.00 . A A . 26 TRP CD1 1 1 12 5479 1 1 26 TRP CD2 C -3.684 -1.857 -8.542 1.00 . A A . 26 TRP CD2 1 1 12 5480 1 1 26 TRP CE2 C -5.059 -2.167 -8.423 1.00 . A A . 26 TRP CE2 1 1 12 5481 1 1 26 TRP CE3 C -3.232 -1.308 -9.754 1.00 . A A . 26 TRP CE3 1 1 12 5482 1 1 26 TRP CG C -3.020 -2.203 -7.292 1.00 . A A . 26 TRP CG 1 1 12 5483 1 1 26 TRP CH2 C -5.486 -1.395 -10.668 1.00 . A A . 26 TRP CH2 1 1 12 5484 1 1 26 TRP CZ2 C -5.953 -1.941 -9.470 1.00 . A A . 26 TRP CZ2 1 1 12 5485 1 1 26 TRP CZ3 C -4.128 -1.080 -10.810 1.00 . A A . 26 TRP CZ3 1 1 12 5486 1 1 26 TRP H H -1.951 -4.453 -6.181 1.00 . A A . 26 TRP H 1 1 12 5487 1 1 26 TRP HA H -0.817 -3.185 -8.601 1.00 . A A . 26 TRP HA 1 1 12 5488 1 1 26 TRP HB2 H -1.468 -2.070 -5.854 1.00 . A A . 26 TRP HB2 1 1 12 5489 1 1 26 TRP HB3 H -1.192 -1.139 -7.323 1.00 . A A . 26 TRP HB3 1 1 12 5490 1 1 26 TRP HD1 H -3.828 -3.057 -5.471 1.00 . A A . 26 TRP HD1 1 1 12 5491 1 1 26 TRP HE1 H -6.044 -2.985 -6.780 1.00 . A A . 26 TRP HE1 1 1 12 5492 1 1 26 TRP HE3 H -2.187 -1.063 -9.875 1.00 . A A . 26 TRP HE3 1 1 12 5493 1 1 26 TRP HH2 H -6.171 -1.216 -11.484 1.00 . A A . 26 TRP HH2 1 1 12 5494 1 1 26 TRP HZ2 H -6.998 -2.186 -9.354 1.00 . A A . 26 TRP HZ2 1 1 12 5495 1 1 26 TRP HZ3 H -3.769 -0.657 -11.737 1.00 . A A . 26 TRP HZ3 1 1 12 5496 1 1 26 TRP N N -1.476 -4.466 -7.037 1.00 . A A . 26 TRP N 1 1 12 5497 1 1 26 TRP NE1 N -5.189 -2.680 -7.148 1.00 . A A . 26 TRP NE1 1 1 12 5498 1 1 26 TRP O O 1.488 -2.443 -7.553 1.00 . A A . 26 TRP O 1 1 12 5499 1 1 27 LYS C C 2.897 -2.731 -4.963 1.00 . A A . 27 LYS C 1 1 12 5500 1 1 27 LYS CA C 2.432 -4.077 -5.552 1.00 . A A . 27 LYS CA 1 1 12 5501 1 1 27 LYS CB C 3.309 -4.479 -6.746 1.00 . A A . 27 LYS CB 1 1 12 5502 1 1 27 LYS CD C 4.048 -6.731 -5.938 1.00 . A A . 27 LYS CD 1 1 12 5503 1 1 27 LYS CE C 3.632 -8.206 -5.896 1.00 . A A . 27 LYS CE 1 1 12 5504 1 1 27 LYS CG C 3.201 -5.990 -6.978 1.00 . A A . 27 LYS CG 1 1 12 5505 1 1 27 LYS H H 0.354 -4.624 -5.695 1.00 . A A . 27 LYS H 1 1 12 5506 1 1 27 LYS HA H 2.501 -4.842 -4.793 1.00 . A A . 27 LYS HA 1 1 12 5507 1 1 27 LYS HB2 H 2.979 -3.956 -7.630 1.00 . A A . 27 LYS HB2 1 1 12 5508 1 1 27 LYS HB3 H 4.338 -4.224 -6.540 1.00 . A A . 27 LYS HB3 1 1 12 5509 1 1 27 LYS HD2 H 5.091 -6.658 -6.206 1.00 . A A . 27 LYS HD2 1 1 12 5510 1 1 27 LYS HD3 H 3.894 -6.288 -4.966 1.00 . A A . 27 LYS HD3 1 1 12 5511 1 1 27 LYS HE2 H 3.204 -8.502 -6.843 1.00 . A A . 27 LYS HE2 1 1 12 5512 1 1 27 LYS HE3 H 4.481 -8.828 -5.655 1.00 . A A . 27 LYS HE3 1 1 12 5513 1 1 27 LYS HG2 H 2.168 -6.295 -6.887 1.00 . A A . 27 LYS HG2 1 1 12 5514 1 1 27 LYS HG3 H 3.560 -6.229 -7.967 1.00 . A A . 27 LYS HG3 1 1 12 5515 1 1 27 LYS HZ1 H 3.071 -8.151 -3.889 1.00 . A A . 27 LYS HZ1 1 1 12 5516 1 1 27 LYS HZ2 H 2.164 -9.233 -4.834 1.00 . A A . 27 LYS HZ2 1 1 12 5517 1 1 27 LYS HZ3 H 1.887 -7.560 -4.953 1.00 . A A . 27 LYS HZ3 1 1 12 5518 1 1 27 LYS N N 1.026 -4.024 -6.078 1.00 . A A . 27 LYS N 1 1 12 5519 1 1 27 LYS NZ N 2.612 -8.294 -4.811 1.00 . A A . 27 LYS NZ 1 1 12 5520 1 1 27 LYS O O 4.073 -2.545 -4.714 1.00 . A A . 27 LYS O 1 1 12 5521 1 1 28 TRP C C 1.487 -0.089 -2.976 1.00 . A A . 28 TRP C 1 1 12 5522 1 1 28 TRP CA C 2.435 -0.502 -4.109 1.00 . A A . 28 TRP CA 1 1 12 5523 1 1 28 TRP CB C 2.449 0.534 -5.253 1.00 . A A . 28 TRP CB 1 1 12 5524 1 1 28 TRP CD1 C -0.013 1.175 -5.131 1.00 . A A . 28 TRP CD1 1 1 12 5525 1 1 28 TRP CD2 C 0.679 0.750 -7.226 1.00 . A A . 28 TRP CD2 1 1 12 5526 1 1 28 TRP CE2 C -0.689 1.095 -7.313 1.00 . A A . 28 TRP CE2 1 1 12 5527 1 1 28 TRP CE3 C 1.359 0.437 -8.416 1.00 . A A . 28 TRP CE3 1 1 12 5528 1 1 28 TRP CG C 1.085 0.796 -5.828 1.00 . A A . 28 TRP CG 1 1 12 5529 1 1 28 TRP CH2 C -0.668 0.818 -9.709 1.00 . A A . 28 TRP CH2 1 1 12 5530 1 1 28 TRP CZ2 C -1.359 1.130 -8.535 1.00 . A A . 28 TRP CZ2 1 1 12 5531 1 1 28 TRP CZ3 C 0.689 0.471 -9.649 1.00 . A A . 28 TRP CZ3 1 1 12 5532 1 1 28 TRP H H 1.051 -1.966 -4.891 1.00 . A A . 28 TRP H 1 1 12 5533 1 1 28 TRP HA H 3.437 -0.606 -3.715 1.00 . A A . 28 TRP HA 1 1 12 5534 1 1 28 TRP HB2 H 2.844 1.463 -4.874 1.00 . A A . 28 TRP HB2 1 1 12 5535 1 1 28 TRP HB3 H 3.099 0.176 -6.038 1.00 . A A . 28 TRP HB3 1 1 12 5536 1 1 28 TRP HD1 H -0.063 1.314 -4.061 1.00 . A A . 28 TRP HD1 1 1 12 5537 1 1 28 TRP HE1 H -1.974 1.611 -5.762 1.00 . A A . 28 TRP HE1 1 1 12 5538 1 1 28 TRP HE3 H 2.404 0.170 -8.380 1.00 . A A . 28 TRP HE3 1 1 12 5539 1 1 28 TRP HH2 H -1.178 0.843 -10.660 1.00 . A A . 28 TRP HH2 1 1 12 5540 1 1 28 TRP HZ2 H -2.405 1.398 -8.576 1.00 . A A . 28 TRP HZ2 1 1 12 5541 1 1 28 TRP HZ3 H 1.222 0.230 -10.557 1.00 . A A . 28 TRP HZ3 1 1 12 5542 1 1 28 TRP N N 2.000 -1.802 -4.710 1.00 . A A . 28 TRP N 1 1 12 5543 1 1 28 TRP NE1 N -1.065 1.345 -6.012 1.00 . A A . 28 TRP NE1 1 1 12 5544 1 1 28 TRP O O 0.362 -0.549 -2.897 1.00 . A A . 28 TRP O 1 1 12 5545 1 1 29 CYS C C -0.101 2.048 -1.487 1.00 . A A . 29 CYS C 1 1 12 5546 1 1 29 CYS CA C 1.070 1.211 -0.958 1.00 . A A . 29 CYS CA 1 1 12 5547 1 1 29 CYS CB C 1.971 2.062 -0.058 1.00 . A A . 29 CYS CB 1 1 12 5548 1 1 29 CYS H H 2.852 1.116 -2.173 1.00 . A A . 29 CYS H 1 1 12 5549 1 1 29 CYS HA H 0.705 0.356 -0.412 1.00 . A A . 29 CYS HA 1 1 12 5550 1 1 29 CYS HB2 H 2.681 2.602 -0.664 1.00 . A A . 29 CYS HB2 1 1 12 5551 1 1 29 CYS HB3 H 1.363 2.764 0.495 1.00 . A A . 29 CYS HB3 1 1 12 5552 1 1 29 CYS N N 1.939 0.768 -2.093 1.00 . A A . 29 CYS N 1 1 12 5553 1 1 29 CYS O O 0.081 2.947 -2.280 1.00 . A A . 29 CYS O 1 1 12 5554 1 1 29 CYS SG S 2.860 0.994 1.103 1.00 . A A . 29 CYS SG 1 1 12 5555 1 1 30 VAL C C -3.135 3.246 -0.319 1.00 . A A . 30 VAL C 1 1 12 5556 1 1 30 VAL CA C -2.492 2.525 -1.508 1.00 . A A . 30 VAL CA 1 1 12 5557 1 1 30 VAL CB C -3.461 1.484 -2.096 1.00 . A A . 30 VAL CB 1 1 12 5558 1 1 30 VAL CG1 C -2.857 0.874 -3.361 1.00 . A A . 30 VAL CG1 1 1 12 5559 1 1 30 VAL CG2 C -3.727 0.371 -1.074 1.00 . A A . 30 VAL CG2 1 1 12 5560 1 1 30 VAL H H -1.408 1.024 -0.401 1.00 . A A . 30 VAL H 1 1 12 5561 1 1 30 VAL HA H -2.211 3.236 -2.269 1.00 . A A . 30 VAL HA 1 1 12 5562 1 1 30 VAL HB H -4.393 1.969 -2.348 1.00 . A A . 30 VAL HB 1 1 12 5563 1 1 30 VAL HG11 H -3.502 0.088 -3.725 1.00 . A A . 30 VAL HG11 1 1 12 5564 1 1 30 VAL HG12 H -1.883 0.466 -3.138 1.00 . A A . 30 VAL HG12 1 1 12 5565 1 1 30 VAL HG13 H -2.763 1.639 -4.116 1.00 . A A . 30 VAL HG13 1 1 12 5566 1 1 30 VAL HG21 H -4.679 -0.093 -1.289 1.00 . A A . 30 VAL HG21 1 1 12 5567 1 1 30 VAL HG22 H -3.749 0.791 -0.079 1.00 . A A . 30 VAL HG22 1 1 12 5568 1 1 30 VAL HG23 H -2.944 -0.370 -1.135 1.00 . A A . 30 VAL HG23 1 1 12 5569 1 1 30 VAL N N -1.296 1.754 -1.047 1.00 . A A . 30 VAL N 1 1 12 5570 1 1 30 VAL O O -2.676 3.137 0.801 1.00 . A A . 30 VAL O 1 1 12 5571 1 1 31 TYR C C -5.683 3.706 1.420 1.00 . A A . 31 TYR C 1 1 12 5572 1 1 31 TYR CA C -4.866 4.695 0.578 1.00 . A A . 31 TYR CA 1 1 12 5573 1 1 31 TYR CB C -5.785 5.726 -0.086 1.00 . A A . 31 TYR CB 1 1 12 5574 1 1 31 TYR CD1 C -5.563 7.472 1.723 1.00 . A A . 31 TYR CD1 1 1 12 5575 1 1 31 TYR CD2 C -7.768 6.608 1.201 1.00 . A A . 31 TYR CD2 1 1 12 5576 1 1 31 TYR CE1 C -6.119 8.302 2.703 1.00 . A A . 31 TYR CE1 1 1 12 5577 1 1 31 TYR CE2 C -8.325 7.438 2.181 1.00 . A A . 31 TYR CE2 1 1 12 5578 1 1 31 TYR CG C -6.386 6.625 0.972 1.00 . A A . 31 TYR CG 1 1 12 5579 1 1 31 TYR CZ C -7.501 8.285 2.932 1.00 . A A . 31 TYR CZ 1 1 12 5580 1 1 31 TYR H H -4.556 4.048 -1.459 1.00 . A A . 31 TYR H 1 1 12 5581 1 1 31 TYR HA H -4.134 5.194 1.193 1.00 . A A . 31 TYR HA 1 1 12 5582 1 1 31 TYR HB2 H -5.212 6.323 -0.781 1.00 . A A . 31 TYR HB2 1 1 12 5583 1 1 31 TYR HB3 H -6.575 5.216 -0.615 1.00 . A A . 31 TYR HB3 1 1 12 5584 1 1 31 TYR HD1 H -4.498 7.486 1.547 1.00 . A A . 31 TYR HD1 1 1 12 5585 1 1 31 TYR HD2 H -8.404 5.955 0.621 1.00 . A A . 31 TYR HD2 1 1 12 5586 1 1 31 TYR HE1 H -5.485 8.954 3.283 1.00 . A A . 31 TYR HE1 1 1 12 5587 1 1 31 TYR HE2 H -9.390 7.424 2.358 1.00 . A A . 31 TYR HE2 1 1 12 5588 1 1 31 TYR HH H -8.206 9.965 3.507 1.00 . A A . 31 TYR HH 1 1 12 5589 1 1 31 TYR N N -4.197 3.976 -0.548 1.00 . A A . 31 TYR N 1 1 12 5590 1 1 31 TYR O O -6.290 2.788 0.898 1.00 . A A . 31 TYR O 1 1 12 5591 1 1 31 TYR OH O -8.050 9.103 3.900 1.00 . A A . 31 TYR OH 1 1 12 5592 1 1 32 ALA C C -7.915 3.479 3.753 1.00 . A A . 32 ALA C 1 1 12 5593 1 1 32 ALA CA C -6.478 2.964 3.594 1.00 . A A . 32 ALA CA 1 1 12 5594 1 1 32 ALA CB C -5.740 2.977 4.936 1.00 . A A . 32 ALA CB 1 1 12 5595 1 1 32 ALA H H -5.207 4.638 3.110 1.00 . A A . 32 ALA H 1 1 12 5596 1 1 32 ALA HA H -6.479 1.967 3.183 1.00 . A A . 32 ALA HA 1 1 12 5597 1 1 32 ALA HB1 H -6.195 2.262 5.604 1.00 . A A . 32 ALA HB1 1 1 12 5598 1 1 32 ALA HB2 H -5.797 3.963 5.371 1.00 . A A . 32 ALA HB2 1 1 12 5599 1 1 32 ALA HB3 H -4.704 2.712 4.779 1.00 . A A . 32 ALA HB3 1 1 12 5600 1 1 32 ALA N N -5.703 3.890 2.715 1.00 . A A . 32 ALA N 1 1 12 5601 1 1 32 ALA O O -8.215 4.252 4.644 1.00 . A A . 32 ALA O 1 1 12 5602 1 1 33 ARG C C -10.967 2.753 4.075 1.00 . A A . 33 ARG C 1 1 12 5603 1 1 33 ARG CA C -10.223 3.519 2.970 1.00 . A A . 33 ARG CA 1 1 12 5604 1 1 33 ARG CB C -10.831 3.207 1.599 1.00 . A A . 33 ARG CB 1 1 12 5605 1 1 33 ARG CD C -11.715 4.424 -0.403 1.00 . A A . 33 ARG CD 1 1 12 5606 1 1 33 ARG CG C -10.607 4.393 0.657 1.00 . A A . 33 ARG CG 1 1 12 5607 1 1 33 ARG CZ C -11.537 3.359 -2.576 1.00 . A A . 33 ARG CZ 1 1 12 5608 1 1 33 ARG H H -8.533 2.437 2.174 1.00 . A A . 33 ARG H 1 1 12 5609 1 1 33 ARG HA H -10.260 4.579 3.156 1.00 . A A . 33 ARG HA 1 1 12 5610 1 1 33 ARG HB2 H -10.359 2.326 1.189 1.00 . A A . 33 ARG HB2 1 1 12 5611 1 1 33 ARG HB3 H -11.890 3.031 1.707 1.00 . A A . 33 ARG HB3 1 1 12 5612 1 1 33 ARG HD2 H -12.441 3.646 -0.210 1.00 . A A . 33 ARG HD2 1 1 12 5613 1 1 33 ARG HD3 H -12.194 5.390 -0.417 1.00 . A A . 33 ARG HD3 1 1 12 5614 1 1 33 ARG HE H -10.176 4.639 -1.898 1.00 . A A . 33 ARG HE 1 1 12 5615 1 1 33 ARG HG2 H -10.628 5.312 1.225 1.00 . A A . 33 ARG HG2 1 1 12 5616 1 1 33 ARG HG3 H -9.649 4.291 0.171 1.00 . A A . 33 ARG HG3 1 1 12 5617 1 1 33 ARG HH11 H -13.031 4.596 -3.085 1.00 . A A . 33 ARG HH11 1 1 12 5618 1 1 33 ARG HH12 H -13.003 3.076 -3.915 1.00 . A A . 33 ARG HH12 1 1 12 5619 1 1 33 ARG HH21 H -10.163 1.930 -2.277 1.00 . A A . 33 ARG HH21 1 1 12 5620 1 1 33 ARG HH22 H -11.378 1.564 -3.456 1.00 . A A . 33 ARG HH22 1 1 12 5621 1 1 33 ARG N N -8.802 3.056 2.885 1.00 . A A . 33 ARG N 1 1 12 5622 1 1 33 ARG NE N -11.020 4.181 -1.701 1.00 . A A . 33 ARG NE 1 1 12 5623 1 1 33 ARG NH1 N -12.608 3.704 -3.244 1.00 . A A . 33 ARG NH1 1 1 12 5624 1 1 33 ARG NH2 N -10.983 2.194 -2.786 1.00 . A A . 33 ARG NH2 1 1 12 5625 1 1 33 ARG O O -10.837 1.549 4.185 1.00 . A A . 33 ARG O 1 1 12 5626 1 1 34 PRO C C -13.689 2.056 5.417 1.00 . A A . 34 PRO C 1 1 12 5627 1 1 34 PRO CA C -12.501 2.862 5.967 1.00 . A A . 34 PRO CA 1 1 12 5628 1 1 34 PRO CB C -12.981 4.059 6.786 1.00 . A A . 34 PRO CB 1 1 12 5629 1 1 34 PRO CD C -11.937 4.937 4.791 1.00 . A A . 34 PRO CD 1 1 12 5630 1 1 34 PRO CG C -13.002 5.205 5.825 1.00 . A A . 34 PRO CG 1 1 12 5631 1 1 34 PRO HA H -11.864 2.236 6.570 1.00 . A A . 34 PRO HA 1 1 12 5632 1 1 34 PRO HB2 H -13.973 3.872 7.174 1.00 . A A . 34 PRO HB2 1 1 12 5633 1 1 34 PRO HB3 H -12.293 4.264 7.591 1.00 . A A . 34 PRO HB3 1 1 12 5634 1 1 34 PRO HD2 H -12.286 5.229 3.809 1.00 . A A . 34 PRO HD2 1 1 12 5635 1 1 34 PRO HD3 H -11.026 5.456 5.043 1.00 . A A . 34 PRO HD3 1 1 12 5636 1 1 34 PRO HG2 H -13.972 5.269 5.352 1.00 . A A . 34 PRO HG2 1 1 12 5637 1 1 34 PRO HG3 H -12.781 6.125 6.343 1.00 . A A . 34 PRO HG3 1 1 12 5638 1 1 34 PRO N N -11.727 3.483 4.859 1.00 . A A . 34 PRO N 1 1 12 5639 1 1 34 PRO O O -14.410 2.583 4.585 1.00 . A A . 34 PRO O 1 1 12 5640 1 1 34 PRO OXT O -13.853 0.924 5.841 1.00 . A A . 34 PRO OXT 1 1 13 5641 1 1 1 GLY C C 8.057 5.153 6.765 1.00 . A A . 1 GLY C 1 1 13 5642 1 1 1 GLY CA C 9.432 4.886 7.388 1.00 . A A . 1 GLY CA 1 1 13 5643 1 1 1 GLY H1 H 8.946 5.970 9.102 1.00 . A A . 1 GLY H1 1 1 13 5644 1 1 1 GLY H2 H 10.306 4.967 9.278 1.00 . A A . 1 GLY H2 1 1 13 5645 1 1 1 GLY H3 H 8.747 4.294 9.266 1.00 . A A . 1 GLY H3 1 1 13 5646 1 1 1 GLY HA2 H 10.150 5.590 6.993 1.00 . A A . 1 GLY HA2 1 1 13 5647 1 1 1 GLY HA3 H 9.742 3.882 7.148 1.00 . A A . 1 GLY HA3 1 1 13 5648 1 1 1 GLY N N 9.351 5.041 8.871 1.00 . A A . 1 GLY N 1 1 13 5649 1 1 1 GLY O O 7.042 4.699 7.260 1.00 . A A . 1 GLY O 1 1 13 5650 1 1 2 CYS C C 6.795 5.880 3.515 1.00 . A A . 2 CYS C 1 1 13 5651 1 1 2 CYS CA C 6.715 6.188 5.015 1.00 . A A . 2 CYS CA 1 1 13 5652 1 1 2 CYS CB C 6.490 7.686 5.245 1.00 . A A . 2 CYS CB 1 1 13 5653 1 1 2 CYS H H 8.852 6.240 5.300 1.00 . A A . 2 CYS H 1 1 13 5654 1 1 2 CYS HA H 5.920 5.623 5.474 1.00 . A A . 2 CYS HA 1 1 13 5655 1 1 2 CYS HB2 H 7.439 8.202 5.203 1.00 . A A . 2 CYS HB2 1 1 13 5656 1 1 2 CYS HB3 H 5.837 8.074 4.477 1.00 . A A . 2 CYS HB3 1 1 13 5657 1 1 2 CYS N N 8.021 5.887 5.679 1.00 . A A . 2 CYS N 1 1 13 5658 1 1 2 CYS O O 7.691 6.337 2.827 1.00 . A A . 2 CYS O 1 1 13 5659 1 1 2 CYS SG S 5.735 7.947 6.870 1.00 . A A . 2 CYS SG 1 1 13 5660 1 1 3 GLY C C 5.258 5.918 0.749 1.00 . A A . 3 GLY C 1 1 13 5661 1 1 3 GLY CA C 5.880 4.771 1.548 1.00 . A A . 3 GLY CA 1 1 13 5662 1 1 3 GLY H H 5.154 4.757 3.576 1.00 . A A . 3 GLY H 1 1 13 5663 1 1 3 GLY HA2 H 6.900 4.617 1.226 1.00 . A A . 3 GLY HA2 1 1 13 5664 1 1 3 GLY HA3 H 5.308 3.870 1.382 1.00 . A A . 3 GLY HA3 1 1 13 5665 1 1 3 GLY N N 5.865 5.111 3.003 1.00 . A A . 3 GLY N 1 1 13 5666 1 1 3 GLY O O 5.946 6.815 0.300 1.00 . A A . 3 GLY O 1 1 13 5667 1 1 4 GLY C C 2.126 6.408 -1.012 1.00 . A A . 4 GLY C 1 1 13 5668 1 1 4 GLY CA C 3.287 6.985 -0.199 1.00 . A A . 4 GLY CA 1 1 13 5669 1 1 4 GLY H H 3.429 5.163 0.944 1.00 . A A . 4 GLY H 1 1 13 5670 1 1 4 GLY HA2 H 2.911 7.730 0.490 1.00 . A A . 4 GLY HA2 1 1 13 5671 1 1 4 GLY HA3 H 3.997 7.444 -0.870 1.00 . A A . 4 GLY HA3 1 1 13 5672 1 1 4 GLY N N 3.960 5.896 0.569 1.00 . A A . 4 GLY N 1 1 13 5673 1 1 4 GLY O O 1.453 5.490 -0.582 1.00 . A A . 4 GLY O 1 1 13 5674 1 1 5 LEU C C 1.285 5.456 -4.107 1.00 . A A . 5 LEU C 1 1 13 5675 1 1 5 LEU CA C 0.766 6.431 -3.034 1.00 . A A . 5 LEU CA 1 1 13 5676 1 1 5 LEU CB C 0.161 7.674 -3.686 1.00 . A A . 5 LEU CB 1 1 13 5677 1 1 5 LEU CD1 C -1.974 8.963 -3.539 1.00 . A A . 5 LEU CD1 1 1 13 5678 1 1 5 LEU CD2 C -1.847 6.910 -4.965 1.00 . A A . 5 LEU CD2 1 1 13 5679 1 1 5 LEU CG C -1.365 7.565 -3.666 1.00 . A A . 5 LEU CG 1 1 13 5680 1 1 5 LEU H H 2.444 7.683 -2.505 1.00 . A A . 5 LEU H 1 1 13 5681 1 1 5 LEU HA H 0.026 5.945 -2.419 1.00 . A A . 5 LEU HA 1 1 13 5682 1 1 5 LEU HB2 H 0.467 8.553 -3.136 1.00 . A A . 5 LEU HB2 1 1 13 5683 1 1 5 LEU HB3 H 0.503 7.750 -4.707 1.00 . A A . 5 LEU HB3 1 1 13 5684 1 1 5 LEU HD11 H -2.441 9.239 -4.472 1.00 . A A . 5 LEU HD11 1 1 13 5685 1 1 5 LEU HD12 H -1.196 9.674 -3.302 1.00 . A A . 5 LEU HD12 1 1 13 5686 1 1 5 LEU HD13 H -2.712 8.962 -2.751 1.00 . A A . 5 LEU HD13 1 1 13 5687 1 1 5 LEU HD21 H -1.015 6.801 -5.644 1.00 . A A . 5 LEU HD21 1 1 13 5688 1 1 5 LEU HD22 H -2.605 7.528 -5.422 1.00 . A A . 5 LEU HD22 1 1 13 5689 1 1 5 LEU HD23 H -2.261 5.937 -4.744 1.00 . A A . 5 LEU HD23 1 1 13 5690 1 1 5 LEU HG H -1.671 6.963 -2.823 1.00 . A A . 5 LEU HG 1 1 13 5691 1 1 5 LEU N N 1.886 6.943 -2.185 1.00 . A A . 5 LEU N 1 1 13 5692 1 1 5 LEU O O 0.511 4.866 -4.836 1.00 . A A . 5 LEU O 1 1 13 5693 1 1 6 MET C C 4.456 3.729 -4.681 1.00 . A A . 6 MET C 1 1 13 5694 1 1 6 MET CA C 3.146 4.328 -5.212 1.00 . A A . 6 MET CA 1 1 13 5695 1 1 6 MET CB C 3.398 5.173 -6.465 1.00 . A A . 6 MET CB 1 1 13 5696 1 1 6 MET CE C 1.248 3.898 -9.387 1.00 . A A . 6 MET CE 1 1 13 5697 1 1 6 MET CG C 2.090 5.343 -7.242 1.00 . A A . 6 MET CG 1 1 13 5698 1 1 6 MET H H 3.185 5.752 -3.597 1.00 . A A . 6 MET H 1 1 13 5699 1 1 6 MET HA H 2.438 3.545 -5.430 1.00 . A A . 6 MET HA 1 1 13 5700 1 1 6 MET HB2 H 3.774 6.144 -6.175 1.00 . A A . 6 MET HB2 1 1 13 5701 1 1 6 MET HB3 H 4.125 4.678 -7.093 1.00 . A A . 6 MET HB3 1 1 13 5702 1 1 6 MET HE1 H 0.836 3.515 -8.464 1.00 . A A . 6 MET HE1 1 1 13 5703 1 1 6 MET HE2 H 1.754 3.102 -9.909 1.00 . A A . 6 MET HE2 1 1 13 5704 1 1 6 MET HE3 H 0.454 4.284 -10.009 1.00 . A A . 6 MET HE3 1 1 13 5705 1 1 6 MET HG2 H 1.397 4.566 -6.954 1.00 . A A . 6 MET HG2 1 1 13 5706 1 1 6 MET HG3 H 1.662 6.309 -7.019 1.00 . A A . 6 MET HG3 1 1 13 5707 1 1 6 MET N N 2.581 5.274 -4.200 1.00 . A A . 6 MET N 1 1 13 5708 1 1 6 MET O O 5.427 3.589 -5.402 1.00 . A A . 6 MET O 1 1 13 5709 1 1 6 MET SD S 2.423 5.225 -9.019 1.00 . A A . 6 MET SD 1 1 13 5710 1 1 7 ALA C C 5.936 1.350 -3.323 1.00 . A A . 7 ALA C 1 1 13 5711 1 1 7 ALA CA C 5.721 2.783 -2.818 1.00 . A A . 7 ALA CA 1 1 13 5712 1 1 7 ALA CB C 5.472 2.793 -1.305 1.00 . A A . 7 ALA CB 1 1 13 5713 1 1 7 ALA H H 3.682 3.502 -2.863 1.00 . A A . 7 ALA H 1 1 13 5714 1 1 7 ALA HA H 6.580 3.390 -3.050 1.00 . A A . 7 ALA HA 1 1 13 5715 1 1 7 ALA HB1 H 4.654 3.460 -1.078 1.00 . A A . 7 ALA HB1 1 1 13 5716 1 1 7 ALA HB2 H 6.363 3.130 -0.797 1.00 . A A . 7 ALA HB2 1 1 13 5717 1 1 7 ALA HB3 H 5.225 1.795 -0.973 1.00 . A A . 7 ALA HB3 1 1 13 5718 1 1 7 ALA N N 4.483 3.375 -3.419 1.00 . A A . 7 ALA N 1 1 13 5719 1 1 7 ALA O O 5.331 0.925 -4.287 1.00 . A A . 7 ALA O 1 1 13 5720 1 1 8 GLY C C 6.645 -1.765 -2.015 1.00 . A A . 8 GLY C 1 1 13 5721 1 1 8 GLY CA C 7.063 -0.794 -3.123 1.00 . A A . 8 GLY CA 1 1 13 5722 1 1 8 GLY H H 7.283 0.978 -1.914 1.00 . A A . 8 GLY H 1 1 13 5723 1 1 8 GLY HA2 H 6.498 -1.003 -4.020 1.00 . A A . 8 GLY HA2 1 1 13 5724 1 1 8 GLY HA3 H 8.116 -0.917 -3.324 1.00 . A A . 8 GLY HA3 1 1 13 5725 1 1 8 GLY N N 6.801 0.609 -2.684 1.00 . A A . 8 GLY N 1 1 13 5726 1 1 8 GLY O O 7.247 -1.804 -0.958 1.00 . A A . 8 GLY O 1 1 13 5727 1 1 9 CYS C C 6.058 -4.769 -1.226 1.00 . A A . 9 CYS C 1 1 13 5728 1 1 9 CYS CA C 5.166 -3.522 -1.206 1.00 . A A . 9 CYS CA 1 1 13 5729 1 1 9 CYS CB C 3.720 -3.878 -1.578 1.00 . A A . 9 CYS CB 1 1 13 5730 1 1 9 CYS H H 5.154 -2.502 -3.110 1.00 . A A . 9 CYS H 1 1 13 5731 1 1 9 CYS HA H 5.192 -3.063 -0.233 1.00 . A A . 9 CYS HA 1 1 13 5732 1 1 9 CYS HB2 H 3.684 -4.217 -2.603 1.00 . A A . 9 CYS HB2 1 1 13 5733 1 1 9 CYS HB3 H 3.366 -4.666 -0.928 1.00 . A A . 9 CYS HB3 1 1 13 5734 1 1 9 CYS N N 5.620 -2.551 -2.249 1.00 . A A . 9 CYS N 1 1 13 5735 1 1 9 CYS O O 6.927 -4.926 -0.390 1.00 . A A . 9 CYS O 1 1 13 5736 1 1 9 CYS SG S 2.657 -2.423 -1.391 1.00 . A A . 9 CYS SG 1 1 13 5737 1 1 10 ASP C C 6.735 -7.613 -0.920 1.00 . A A . 10 ASP C 1 1 13 5738 1 1 10 ASP CA C 6.676 -6.898 -2.278 1.00 . A A . 10 ASP CA 1 1 13 5739 1 1 10 ASP CB C 8.071 -6.420 -2.708 1.00 . A A . 10 ASP CB 1 1 13 5740 1 1 10 ASP CG C 8.787 -7.523 -3.501 1.00 . A A . 10 ASP CG 1 1 13 5741 1 1 10 ASP H H 5.143 -5.490 -2.835 1.00 . A A . 10 ASP H 1 1 13 5742 1 1 10 ASP HA H 6.268 -7.557 -3.029 1.00 . A A . 10 ASP HA 1 1 13 5743 1 1 10 ASP HB2 H 7.971 -5.541 -3.330 1.00 . A A . 10 ASP HB2 1 1 13 5744 1 1 10 ASP HB3 H 8.653 -6.174 -1.833 1.00 . A A . 10 ASP HB3 1 1 13 5745 1 1 10 ASP N N 5.849 -5.651 -2.179 1.00 . A A . 10 ASP N 1 1 13 5746 1 1 10 ASP O O 7.771 -7.670 -0.282 1.00 . A A . 10 ASP O 1 1 13 5747 1 1 10 ASP OD1 O 8.635 -8.683 -3.147 1.00 . A A . 10 ASP OD1 1 1 13 5748 1 1 10 ASP OD2 O 9.483 -7.186 -4.445 1.00 . A A . 10 ASP OD2 1 1 13 5749 1 1 11 GLY C C 4.324 -8.479 1.570 1.00 . A A . 11 GLY C 1 1 13 5750 1 1 11 GLY CA C 5.610 -8.849 0.837 1.00 . A A . 11 GLY CA 1 1 13 5751 1 1 11 GLY H H 4.801 -8.087 -0.995 1.00 . A A . 11 GLY H 1 1 13 5752 1 1 11 GLY HA2 H 5.647 -9.918 0.679 1.00 . A A . 11 GLY HA2 1 1 13 5753 1 1 11 GLY HA3 H 6.458 -8.538 1.428 1.00 . A A . 11 GLY HA3 1 1 13 5754 1 1 11 GLY N N 5.627 -8.150 -0.472 1.00 . A A . 11 GLY N 1 1 13 5755 1 1 11 GLY O O 4.062 -7.320 1.827 1.00 . A A . 11 GLY O 1 1 13 5756 1 1 12 LYS C C 2.533 -8.505 3.993 1.00 . A A . 12 LYS C 1 1 13 5757 1 1 12 LYS CA C 2.245 -9.161 2.631 1.00 . A A . 12 LYS CA 1 1 13 5758 1 1 12 LYS CB C 1.579 -10.524 2.833 1.00 . A A . 12 LYS CB 1 1 13 5759 1 1 12 LYS CD C 1.304 -12.621 1.495 1.00 . A A . 12 LYS CD 1 1 13 5760 1 1 12 LYS CE C 2.725 -12.991 1.044 1.00 . A A . 12 LYS CE 1 1 13 5761 1 1 12 LYS CG C 1.134 -11.098 1.484 1.00 . A A . 12 LYS CG 1 1 13 5762 1 1 12 LYS H H 3.761 -10.378 1.688 1.00 . A A . 12 LYS H 1 1 13 5763 1 1 12 LYS HA H 1.611 -8.527 2.032 1.00 . A A . 12 LYS HA 1 1 13 5764 1 1 12 LYS HB2 H 2.283 -11.199 3.293 1.00 . A A . 12 LYS HB2 1 1 13 5765 1 1 12 LYS HB3 H 0.719 -10.409 3.472 1.00 . A A . 12 LYS HB3 1 1 13 5766 1 1 12 LYS HD2 H 1.133 -12.995 2.494 1.00 . A A . 12 LYS HD2 1 1 13 5767 1 1 12 LYS HD3 H 0.589 -13.065 0.819 1.00 . A A . 12 LYS HD3 1 1 13 5768 1 1 12 LYS HE2 H 2.704 -13.894 0.449 1.00 . A A . 12 LYS HE2 1 1 13 5769 1 1 12 LYS HE3 H 3.165 -12.182 0.482 1.00 . A A . 12 LYS HE3 1 1 13 5770 1 1 12 LYS HG2 H 0.094 -10.854 1.315 1.00 . A A . 12 LYS HG2 1 1 13 5771 1 1 12 LYS HG3 H 1.736 -10.675 0.695 1.00 . A A . 12 LYS HG3 1 1 13 5772 1 1 12 LYS HZ1 H 2.945 -13.817 2.949 1.00 . A A . 12 LYS HZ1 1 1 13 5773 1 1 12 LYS HZ2 H 3.698 -12.304 2.759 1.00 . A A . 12 LYS HZ2 1 1 13 5774 1 1 12 LYS HZ3 H 4.394 -13.694 2.076 1.00 . A A . 12 LYS HZ3 1 1 13 5775 1 1 12 LYS N N 3.523 -9.453 1.908 1.00 . A A . 12 LYS N 1 1 13 5776 1 1 12 LYS NZ N 3.498 -13.219 2.302 1.00 . A A . 12 LYS NZ 1 1 13 5777 1 1 12 LYS O O 1.655 -7.929 4.606 1.00 . A A . 12 LYS O 1 1 13 5778 1 1 13 SER C C 4.718 -6.567 5.590 1.00 . A A . 13 SER C 1 1 13 5779 1 1 13 SER CA C 4.104 -7.967 5.783 1.00 . A A . 13 SER CA 1 1 13 5780 1 1 13 SER CB C 5.125 -8.918 6.410 1.00 . A A . 13 SER CB 1 1 13 5781 1 1 13 SER H H 4.451 -9.052 3.952 1.00 . A A . 13 SER H 1 1 13 5782 1 1 13 SER HA H 3.229 -7.906 6.410 1.00 . A A . 13 SER HA 1 1 13 5783 1 1 13 SER HB2 H 5.522 -9.574 5.652 1.00 . A A . 13 SER HB2 1 1 13 5784 1 1 13 SER HB3 H 5.932 -8.346 6.846 1.00 . A A . 13 SER HB3 1 1 13 5785 1 1 13 SER HG H 4.498 -10.614 7.127 1.00 . A A . 13 SER HG 1 1 13 5786 1 1 13 SER N N 3.758 -8.586 4.465 1.00 . A A . 13 SER N 1 1 13 5787 1 1 13 SER O O 5.216 -5.970 6.527 1.00 . A A . 13 SER O 1 1 13 5788 1 1 13 SER OG O 4.485 -9.697 7.412 1.00 . A A . 13 SER OG 1 1 13 5789 1 1 14 THR C C 4.363 -3.600 4.784 1.00 . A A . 14 THR C 1 1 13 5790 1 1 14 THR CA C 5.262 -4.673 4.150 1.00 . A A . 14 THR CA 1 1 13 5791 1 1 14 THR CB C 5.317 -4.514 2.619 1.00 . A A . 14 THR CB 1 1 13 5792 1 1 14 THR CG2 C 3.902 -4.362 2.054 1.00 . A A . 14 THR CG2 1 1 13 5793 1 1 14 THR H H 4.274 -6.525 3.646 1.00 . A A . 14 THR H 1 1 13 5794 1 1 14 THR HA H 6.257 -4.616 4.560 1.00 . A A . 14 THR HA 1 1 13 5795 1 1 14 THR HB H 5.777 -5.391 2.182 1.00 . A A . 14 THR HB 1 1 13 5796 1 1 14 THR HG1 H 5.583 -2.585 2.515 1.00 . A A . 14 THR HG1 1 1 13 5797 1 1 14 THR HG21 H 3.941 -4.393 0.975 1.00 . A A . 14 THR HG21 1 1 13 5798 1 1 14 THR HG22 H 3.486 -3.419 2.373 1.00 . A A . 14 THR HG22 1 1 13 5799 1 1 14 THR HG23 H 3.281 -5.169 2.414 1.00 . A A . 14 THR HG23 1 1 13 5800 1 1 14 THR N N 4.683 -6.034 4.388 1.00 . A A . 14 THR N 1 1 13 5801 1 1 14 THR O O 3.192 -3.825 5.027 1.00 . A A . 14 THR O 1 1 13 5802 1 1 14 THR OG1 O 6.091 -3.367 2.286 1.00 . A A . 14 THR OG1 1 1 13 5803 1 1 15 PHE C C 4.389 0.000 5.013 1.00 . A A . 15 PHE C 1 1 13 5804 1 1 15 PHE CA C 4.082 -1.350 5.673 1.00 . A A . 15 PHE CA 1 1 13 5805 1 1 15 PHE CB C 4.481 -1.331 7.153 1.00 . A A . 15 PHE CB 1 1 13 5806 1 1 15 PHE CD1 C 2.289 -1.240 8.400 1.00 . A A . 15 PHE CD1 1 1 13 5807 1 1 15 PHE CD2 C 3.490 -3.344 8.307 1.00 . A A . 15 PHE CD2 1 1 13 5808 1 1 15 PHE CE1 C 1.282 -1.848 9.159 1.00 . A A . 15 PHE CE1 1 1 13 5809 1 1 15 PHE CE2 C 2.484 -3.952 9.065 1.00 . A A . 15 PHE CE2 1 1 13 5810 1 1 15 PHE CG C 3.394 -1.988 7.974 1.00 . A A . 15 PHE CG 1 1 13 5811 1 1 15 PHE CZ C 1.379 -3.204 9.491 1.00 . A A . 15 PHE CZ 1 1 13 5812 1 1 15 PHE H H 5.851 -2.278 4.853 1.00 . A A . 15 PHE H 1 1 13 5813 1 1 15 PHE HA H 3.032 -1.578 5.580 1.00 . A A . 15 PHE HA 1 1 13 5814 1 1 15 PHE HB2 H 5.408 -1.869 7.284 1.00 . A A . 15 PHE HB2 1 1 13 5815 1 1 15 PHE HB3 H 4.608 -0.309 7.479 1.00 . A A . 15 PHE HB3 1 1 13 5816 1 1 15 PHE HD1 H 2.215 -0.193 8.144 1.00 . A A . 15 PHE HD1 1 1 13 5817 1 1 15 PHE HD2 H 4.342 -3.923 7.979 1.00 . A A . 15 PHE HD2 1 1 13 5818 1 1 15 PHE HE1 H 0.430 -1.271 9.488 1.00 . A A . 15 PHE HE1 1 1 13 5819 1 1 15 PHE HE2 H 2.558 -4.999 9.322 1.00 . A A . 15 PHE HE2 1 1 13 5820 1 1 15 PHE HZ H 0.601 -3.674 10.076 1.00 . A A . 15 PHE HZ 1 1 13 5821 1 1 15 PHE N N 4.904 -2.436 5.055 1.00 . A A . 15 PHE N 1 1 13 5822 1 1 15 PHE O O 5.517 0.287 4.656 1.00 . A A . 15 PHE O 1 1 13 5823 1 1 16 CYS C C 3.815 3.238 5.299 1.00 . A A . 16 CYS C 1 1 13 5824 1 1 16 CYS CA C 3.604 2.167 4.214 1.00 . A A . 16 CYS CA 1 1 13 5825 1 1 16 CYS CB C 2.328 2.431 3.408 1.00 . A A . 16 CYS CB 1 1 13 5826 1 1 16 CYS H H 2.489 0.571 5.149 1.00 . A A . 16 CYS H 1 1 13 5827 1 1 16 CYS HA H 4.456 2.133 3.553 1.00 . A A . 16 CYS HA 1 1 13 5828 1 1 16 CYS HB2 H 1.498 2.565 4.085 1.00 . A A . 16 CYS HB2 1 1 13 5829 1 1 16 CYS HB3 H 2.455 3.325 2.815 1.00 . A A . 16 CYS HB3 1 1 13 5830 1 1 16 CYS N N 3.387 0.829 4.851 1.00 . A A . 16 CYS N 1 1 13 5831 1 1 16 CYS O O 4.506 3.009 6.273 1.00 . A A . 16 CYS O 1 1 13 5832 1 1 16 CYS SG S 1.992 1.026 2.313 1.00 . A A . 16 CYS SG 1 1 13 5833 1 1 17 CYS C C 2.315 5.418 7.228 1.00 . A A . 17 CYS C 1 1 13 5834 1 1 17 CYS CA C 3.422 5.482 6.164 1.00 . A A . 17 CYS CA 1 1 13 5835 1 1 17 CYS CB C 3.370 6.796 5.375 1.00 . A A . 17 CYS CB 1 1 13 5836 1 1 17 CYS H H 2.688 4.583 4.345 1.00 . A A . 17 CYS H 1 1 13 5837 1 1 17 CYS HA H 4.385 5.382 6.633 1.00 . A A . 17 CYS HA 1 1 13 5838 1 1 17 CYS HB2 H 4.090 6.760 4.571 1.00 . A A . 17 CYS HB2 1 1 13 5839 1 1 17 CYS HB3 H 2.381 6.934 4.966 1.00 . A A . 17 CYS HB3 1 1 13 5840 1 1 17 CYS N N 3.236 4.409 5.140 1.00 . A A . 17 CYS N 1 1 13 5841 1 1 17 CYS O O 2.491 4.816 8.271 1.00 . A A . 17 CYS O 1 1 13 5842 1 1 17 CYS SG S 3.768 8.179 6.475 1.00 . A A . 17 CYS SG 1 1 13 5843 1 1 18 SER C C -1.292 6.010 7.298 1.00 . A A . 18 SER C 1 1 13 5844 1 1 18 SER CA C 0.074 6.008 7.991 1.00 . A A . 18 SER CA 1 1 13 5845 1 1 18 SER CB C 0.260 7.281 8.820 1.00 . A A . 18 SER CB 1 1 13 5846 1 1 18 SER H H 1.060 6.515 6.140 1.00 . A A . 18 SER H 1 1 13 5847 1 1 18 SER HA H 0.167 5.145 8.624 1.00 . A A . 18 SER HA 1 1 13 5848 1 1 18 SER HB2 H 0.501 8.106 8.170 1.00 . A A . 18 SER HB2 1 1 13 5849 1 1 18 SER HB3 H -0.656 7.501 9.350 1.00 . A A . 18 SER HB3 1 1 13 5850 1 1 18 SER HG H 2.114 7.488 9.375 1.00 . A A . 18 SER HG 1 1 13 5851 1 1 18 SER N N 1.182 6.034 6.982 1.00 . A A . 18 SER N 1 1 13 5852 1 1 18 SER O O -2.163 5.227 7.627 1.00 . A A . 18 SER O 1 1 13 5853 1 1 18 SER OG O 1.322 7.090 9.746 1.00 . A A . 18 SER OG 1 1 13 5854 1 1 19 GLY C C -2.673 6.208 4.278 1.00 . A A . 19 GLY C 1 1 13 5855 1 1 19 GLY CA C -2.791 6.941 5.619 1.00 . A A . 19 GLY CA 1 1 13 5856 1 1 19 GLY H H -0.765 7.498 6.096 1.00 . A A . 19 GLY H 1 1 13 5857 1 1 19 GLY HA2 H -3.556 6.472 6.220 1.00 . A A . 19 GLY HA2 1 1 13 5858 1 1 19 GLY HA3 H -3.057 7.972 5.438 1.00 . A A . 19 GLY HA3 1 1 13 5859 1 1 19 GLY N N -1.484 6.883 6.342 1.00 . A A . 19 GLY N 1 1 13 5860 1 1 19 GLY O O -3.396 6.495 3.343 1.00 . A A . 19 GLY O 1 1 13 5861 1 1 20 TYR C C -1.476 3.008 3.195 1.00 . A A . 20 TYR C 1 1 13 5862 1 1 20 TYR CA C -1.602 4.506 2.905 1.00 . A A . 20 TYR CA 1 1 13 5863 1 1 20 TYR CB C -0.299 5.026 2.288 1.00 . A A . 20 TYR CB 1 1 13 5864 1 1 20 TYR CD1 C -1.165 6.767 0.679 1.00 . A A . 20 TYR CD1 1 1 13 5865 1 1 20 TYR CD2 C 0.074 7.495 2.633 1.00 . A A . 20 TYR CD2 1 1 13 5866 1 1 20 TYR CE1 C -1.320 8.098 0.280 1.00 . A A . 20 TYR CE1 1 1 13 5867 1 1 20 TYR CE2 C -0.081 8.827 2.233 1.00 . A A . 20 TYR CE2 1 1 13 5868 1 1 20 TYR CG C -0.469 6.464 1.856 1.00 . A A . 20 TYR CG 1 1 13 5869 1 1 20 TYR CZ C -0.778 9.128 1.057 1.00 . A A . 20 TYR CZ 1 1 13 5870 1 1 20 TYR H H -1.200 5.050 4.948 1.00 . A A . 20 TYR H 1 1 13 5871 1 1 20 TYR HA H -2.430 4.699 2.238 1.00 . A A . 20 TYR HA 1 1 13 5872 1 1 20 TYR HB2 H 0.494 4.962 3.019 1.00 . A A . 20 TYR HB2 1 1 13 5873 1 1 20 TYR HB3 H -0.043 4.422 1.429 1.00 . A A . 20 TYR HB3 1 1 13 5874 1 1 20 TYR HD1 H -1.583 5.971 0.079 1.00 . A A . 20 TYR HD1 1 1 13 5875 1 1 20 TYR HD2 H 0.611 7.262 3.540 1.00 . A A . 20 TYR HD2 1 1 13 5876 1 1 20 TYR HE1 H -1.857 8.331 -0.627 1.00 . A A . 20 TYR HE1 1 1 13 5877 1 1 20 TYR HE2 H 0.338 9.622 2.832 1.00 . A A . 20 TYR HE2 1 1 13 5878 1 1 20 TYR HH H -0.096 10.741 0.295 1.00 . A A . 20 TYR HH 1 1 13 5879 1 1 20 TYR N N -1.769 5.263 4.180 1.00 . A A . 20 TYR N 1 1 13 5880 1 1 20 TYR O O -0.734 2.598 4.067 1.00 . A A . 20 TYR O 1 1 13 5881 1 1 20 TYR OH O -0.930 10.442 0.663 1.00 . A A . 20 TYR OH 1 1 13 5882 1 1 21 ASN C C -1.306 0.084 1.527 1.00 . A A . 21 ASN C 1 1 13 5883 1 1 21 ASN CA C -2.092 0.713 2.679 1.00 . A A . 21 ASN CA 1 1 13 5884 1 1 21 ASN CB C -3.541 0.217 2.688 1.00 . A A . 21 ASN CB 1 1 13 5885 1 1 21 ASN CG C -3.676 -0.942 3.678 1.00 . A A . 21 ASN CG 1 1 13 5886 1 1 21 ASN H H -2.766 2.543 1.758 1.00 . A A . 21 ASN H 1 1 13 5887 1 1 21 ASN HA H -1.619 0.497 3.624 1.00 . A A . 21 ASN HA 1 1 13 5888 1 1 21 ASN HB2 H -4.196 1.023 2.985 1.00 . A A . 21 ASN HB2 1 1 13 5889 1 1 21 ASN HB3 H -3.812 -0.122 1.700 1.00 . A A . 21 ASN HB3 1 1 13 5890 1 1 21 ASN HD21 H -4.284 -2.239 2.302 1.00 . A A . 21 ASN HD21 1 1 13 5891 1 1 21 ASN HD22 H -4.163 -2.857 3.879 1.00 . A A . 21 ASN HD22 1 1 13 5892 1 1 21 ASN N N -2.184 2.188 2.463 1.00 . A A . 21 ASN N 1 1 13 5893 1 1 21 ASN ND2 N -4.074 -2.109 3.250 1.00 . A A . 21 ASN ND2 1 1 13 5894 1 1 21 ASN O O -1.326 0.579 0.421 1.00 . A A . 21 ASN O 1 1 13 5895 1 1 21 ASN OD1 O -3.417 -0.784 4.856 1.00 . A A . 21 ASN OD1 1 1 13 5896 1 1 22 CYS C C -0.691 -2.622 -0.109 1.00 . A A . 22 CYS C 1 1 13 5897 1 1 22 CYS CA C 0.178 -1.625 0.661 1.00 . A A . 22 CYS CA 1 1 13 5898 1 1 22 CYS CB C 1.350 -2.336 1.342 1.00 . A A . 22 CYS CB 1 1 13 5899 1 1 22 CYS H H -0.597 -1.386 2.666 1.00 . A A . 22 CYS H 1 1 13 5900 1 1 22 CYS HA H 0.553 -0.865 -0.006 1.00 . A A . 22 CYS HA 1 1 13 5901 1 1 22 CYS HB2 H 1.387 -2.053 2.384 1.00 . A A . 22 CYS HB2 1 1 13 5902 1 1 22 CYS HB3 H 1.218 -3.405 1.263 1.00 . A A . 22 CYS HB3 1 1 13 5903 1 1 22 CYS N N -0.609 -0.995 1.767 1.00 . A A . 22 CYS N 1 1 13 5904 1 1 22 CYS O O -1.259 -3.538 0.460 1.00 . A A . 22 CYS O 1 1 13 5905 1 1 22 CYS SG S 2.899 -1.858 0.534 1.00 . A A . 22 CYS SG 1 1 13 5906 1 1 23 SER C C -0.764 -4.474 -2.831 1.00 . A A . 23 SER C 1 1 13 5907 1 1 23 SER CA C -1.632 -3.360 -2.230 1.00 . A A . 23 SER CA 1 1 13 5908 1 1 23 SER CB C -2.215 -2.476 -3.336 1.00 . A A . 23 SER CB 1 1 13 5909 1 1 23 SER H H -0.331 -1.691 -1.826 1.00 . A A . 23 SER H 1 1 13 5910 1 1 23 SER HA H -2.430 -3.779 -1.638 1.00 . A A . 23 SER HA 1 1 13 5911 1 1 23 SER HB2 H -1.764 -1.499 -3.295 1.00 . A A . 23 SER HB2 1 1 13 5912 1 1 23 SER HB3 H -2.009 -2.924 -4.298 1.00 . A A . 23 SER HB3 1 1 13 5913 1 1 23 SER HG H -4.033 -3.165 -3.437 1.00 . A A . 23 SER HG 1 1 13 5914 1 1 23 SER N N -0.799 -2.440 -1.401 1.00 . A A . 23 SER N 1 1 13 5915 1 1 23 SER O O 0.249 -4.201 -3.445 1.00 . A A . 23 SER O 1 1 13 5916 1 1 23 SER OG O -3.618 -2.351 -3.146 1.00 . A A . 23 SER OG 1 1 13 5917 1 1 24 PRO C C -0.634 -6.979 -4.691 1.00 . A A . 24 PRO C 1 1 13 5918 1 1 24 PRO CA C -0.448 -6.867 -3.170 1.00 . A A . 24 PRO CA 1 1 13 5919 1 1 24 PRO CB C -1.080 -8.057 -2.452 1.00 . A A . 24 PRO CB 1 1 13 5920 1 1 24 PRO CD C -2.402 -6.108 -1.903 1.00 . A A . 24 PRO CD 1 1 13 5921 1 1 24 PRO CG C -2.456 -7.604 -2.076 1.00 . A A . 24 PRO CG 1 1 13 5922 1 1 24 PRO HA H 0.595 -6.796 -2.920 1.00 . A A . 24 PRO HA 1 1 13 5923 1 1 24 PRO HB2 H -1.131 -8.911 -3.115 1.00 . A A . 24 PRO HB2 1 1 13 5924 1 1 24 PRO HB3 H -0.517 -8.303 -1.565 1.00 . A A . 24 PRO HB3 1 1 13 5925 1 1 24 PRO HD2 H -3.283 -5.648 -2.331 1.00 . A A . 24 PRO HD2 1 1 13 5926 1 1 24 PRO HD3 H -2.309 -5.851 -0.860 1.00 . A A . 24 PRO HD3 1 1 13 5927 1 1 24 PRO HG2 H -3.153 -7.862 -2.862 1.00 . A A . 24 PRO HG2 1 1 13 5928 1 1 24 PRO HG3 H -2.757 -8.066 -1.149 1.00 . A A . 24 PRO HG3 1 1 13 5929 1 1 24 PRO N N -1.195 -5.699 -2.635 1.00 . A A . 24 PRO N 1 1 13 5930 1 1 24 PRO O O 0.280 -7.332 -5.410 1.00 . A A . 24 PRO O 1 1 13 5931 1 1 25 THR C C -1.346 -5.612 -7.381 1.00 . A A . 25 THR C 1 1 13 5932 1 1 25 THR CA C -2.071 -6.750 -6.650 1.00 . A A . 25 THR CA 1 1 13 5933 1 1 25 THR CB C -3.593 -6.604 -6.794 1.00 . A A . 25 THR CB 1 1 13 5934 1 1 25 THR CG2 C -3.984 -6.650 -8.272 1.00 . A A . 25 THR CG2 1 1 13 5935 1 1 25 THR H H -2.525 -6.388 -4.572 1.00 . A A . 25 THR H 1 1 13 5936 1 1 25 THR HA H -1.757 -7.703 -7.036 1.00 . A A . 25 THR HA 1 1 13 5937 1 1 25 THR HB H -3.904 -5.659 -6.373 1.00 . A A . 25 THR HB 1 1 13 5938 1 1 25 THR HG1 H -4.550 -7.324 -5.261 1.00 . A A . 25 THR HG1 1 1 13 5939 1 1 25 THR HG21 H -3.118 -6.899 -8.867 1.00 . A A . 25 THR HG21 1 1 13 5940 1 1 25 THR HG22 H -4.361 -5.684 -8.574 1.00 . A A . 25 THR HG22 1 1 13 5941 1 1 25 THR HG23 H -4.750 -7.397 -8.420 1.00 . A A . 25 THR HG23 1 1 13 5942 1 1 25 THR N N -1.812 -6.673 -5.178 1.00 . A A . 25 THR N 1 1 13 5943 1 1 25 THR O O -0.832 -5.792 -8.469 1.00 . A A . 25 THR O 1 1 13 5944 1 1 25 THR OG1 O -4.237 -7.665 -6.101 1.00 . A A . 25 THR OG1 1 1 13 5945 1 1 26 TRP C C 0.867 -3.231 -7.019 1.00 . A A . 26 TRP C 1 1 13 5946 1 1 26 TRP CA C -0.612 -3.288 -7.440 1.00 . A A . 26 TRP CA 1 1 13 5947 1 1 26 TRP CB C -1.363 -2.044 -6.952 1.00 . A A . 26 TRP CB 1 1 13 5948 1 1 26 TRP CD1 C -3.759 -2.684 -6.448 1.00 . A A . 26 TRP CD1 1 1 13 5949 1 1 26 TRP CD2 C -3.519 -1.798 -8.501 1.00 . A A . 26 TRP CD2 1 1 13 5950 1 1 26 TRP CE2 C -4.892 -2.111 -8.349 1.00 . A A . 26 TRP CE2 1 1 13 5951 1 1 26 TRP CE3 C -3.102 -1.223 -9.715 1.00 . A A . 26 TRP CE3 1 1 13 5952 1 1 26 TRP CG C -2.821 -2.172 -7.277 1.00 . A A . 26 TRP CG 1 1 13 5953 1 1 26 TRP CH2 C -5.383 -1.290 -10.564 1.00 . A A . 26 TRP CH2 1 1 13 5954 1 1 26 TRP CZ2 C -5.815 -1.863 -9.366 1.00 . A A . 26 TRP CZ2 1 1 13 5955 1 1 26 TRP CZ3 C -4.030 -0.972 -10.739 1.00 . A A . 26 TRP CZ3 1 1 13 5956 1 1 26 TRP H H -1.725 -4.333 -5.911 1.00 . A A . 26 TRP H 1 1 13 5957 1 1 26 TRP HA H -0.690 -3.363 -8.513 1.00 . A A . 26 TRP HA 1 1 13 5958 1 1 26 TRP HB2 H -1.238 -1.945 -5.884 1.00 . A A . 26 TRP HB2 1 1 13 5959 1 1 26 TRP HB3 H -0.962 -1.171 -7.443 1.00 . A A . 26 TRP HB3 1 1 13 5960 1 1 26 TRP HD1 H -3.578 -3.062 -5.453 1.00 . A A . 26 TRP HD1 1 1 13 5961 1 1 26 TRP HE1 H -5.831 -2.965 -6.699 1.00 . A A . 26 TRP HE1 1 1 13 5962 1 1 26 TRP HE3 H -2.062 -0.975 -9.859 1.00 . A A . 26 TRP HE3 1 1 13 5963 1 1 26 TRP HH2 H -6.091 -1.093 -11.355 1.00 . A A . 26 TRP HH2 1 1 13 5964 1 1 26 TRP HZ2 H -6.858 -2.110 -9.225 1.00 . A A . 26 TRP HZ2 1 1 13 5965 1 1 26 TRP HZ3 H -3.698 -0.529 -11.666 1.00 . A A . 26 TRP HZ3 1 1 13 5966 1 1 26 TRP N N -1.303 -4.447 -6.787 1.00 . A A . 26 TRP N 1 1 13 5967 1 1 26 TRP NE1 N -4.986 -2.652 -7.083 1.00 . A A . 26 TRP NE1 1 1 13 5968 1 1 26 TRP O O 1.652 -2.509 -7.603 1.00 . A A . 26 TRP O 1 1 13 5969 1 1 27 LYS C C 3.138 -2.637 -5.031 1.00 . A A . 27 LYS C 1 1 13 5970 1 1 27 LYS CA C 2.670 -4.015 -5.538 1.00 . A A . 27 LYS CA 1 1 13 5971 1 1 27 LYS CB C 3.508 -4.468 -6.743 1.00 . A A . 27 LYS CB 1 1 13 5972 1 1 27 LYS CD C 3.724 -6.795 -5.840 1.00 . A A . 27 LYS CD 1 1 13 5973 1 1 27 LYS CE C 4.429 -8.058 -6.349 1.00 . A A . 27 LYS CE 1 1 13 5974 1 1 27 LYS CG C 3.246 -5.952 -7.027 1.00 . A A . 27 LYS CG 1 1 13 5975 1 1 27 LYS H H 0.590 -4.565 -5.569 1.00 . A A . 27 LYS H 1 1 13 5976 1 1 27 LYS HA H 2.772 -4.739 -4.747 1.00 . A A . 27 LYS HA 1 1 13 5977 1 1 27 LYS HB2 H 3.243 -3.883 -7.611 1.00 . A A . 27 LYS HB2 1 1 13 5978 1 1 27 LYS HB3 H 4.557 -4.328 -6.524 1.00 . A A . 27 LYS HB3 1 1 13 5979 1 1 27 LYS HD2 H 4.413 -6.217 -5.243 1.00 . A A . 27 LYS HD2 1 1 13 5980 1 1 27 LYS HD3 H 2.875 -7.079 -5.236 1.00 . A A . 27 LYS HD3 1 1 13 5981 1 1 27 LYS HE2 H 5.041 -7.824 -7.209 1.00 . A A . 27 LYS HE2 1 1 13 5982 1 1 27 LYS HE3 H 5.029 -8.493 -5.566 1.00 . A A . 27 LYS HE3 1 1 13 5983 1 1 27 LYS HG2 H 2.187 -6.107 -7.178 1.00 . A A . 27 LYS HG2 1 1 13 5984 1 1 27 LYS HG3 H 3.783 -6.247 -7.916 1.00 . A A . 27 LYS HG3 1 1 13 5985 1 1 27 LYS HZ1 H 3.740 -9.912 -7.002 1.00 . A A . 27 LYS HZ1 1 1 13 5986 1 1 27 LYS HZ2 H 2.800 -8.600 -7.532 1.00 . A A . 27 LYS HZ2 1 1 13 5987 1 1 27 LYS HZ3 H 2.692 -9.130 -5.922 1.00 . A A . 27 LYS HZ3 1 1 13 5988 1 1 27 LYS N N 1.247 -3.992 -6.015 1.00 . A A . 27 LYS N 1 1 13 5989 1 1 27 LYS NZ N 3.332 -8.995 -6.730 1.00 . A A . 27 LYS NZ 1 1 13 5990 1 1 27 LYS O O 4.326 -2.394 -4.916 1.00 . A A . 27 LYS O 1 1 13 5991 1 1 28 TRP C C 1.652 0.132 -3.151 1.00 . A A . 28 TRP C 1 1 13 5992 1 1 28 TRP CA C 2.666 -0.409 -4.171 1.00 . A A . 28 TRP CA 1 1 13 5993 1 1 28 TRP CB C 2.817 0.520 -5.393 1.00 . A A . 28 TRP CB 1 1 13 5994 1 1 28 TRP CD1 C 0.427 1.393 -5.434 1.00 . A A . 28 TRP CD1 1 1 13 5995 1 1 28 TRP CD2 C 1.123 0.659 -7.441 1.00 . A A . 28 TRP CD2 1 1 13 5996 1 1 28 TRP CE2 C -0.204 1.112 -7.614 1.00 . A A . 28 TRP CE2 1 1 13 5997 1 1 28 TRP CE3 C 1.799 0.146 -8.563 1.00 . A A . 28 TRP CE3 1 1 13 5998 1 1 28 TRP CG C 1.500 0.837 -6.045 1.00 . A A . 28 TRP CG 1 1 13 5999 1 1 28 TRP CH2 C -0.154 0.546 -9.959 1.00 . A A . 28 TRP CH2 1 1 13 6000 1 1 28 TRP CZ2 C -0.840 1.058 -8.854 1.00 . A A . 28 TRP CZ2 1 1 13 6001 1 1 28 TRP CZ3 C 1.163 0.091 -9.814 1.00 . A A . 28 TRP CZ3 1 1 13 6002 1 1 28 TRP H H 1.278 -1.954 -4.771 1.00 . A A . 28 TRP H 1 1 13 6003 1 1 28 TRP HA H 3.627 -0.515 -3.688 1.00 . A A . 28 TRP HA 1 1 13 6004 1 1 28 TRP HB2 H 3.275 1.443 -5.076 1.00 . A A . 28 TRP HB2 1 1 13 6005 1 1 28 TRP HB3 H 3.461 0.041 -6.116 1.00 . A A . 28 TRP HB3 1 1 13 6006 1 1 28 TRP HD1 H 0.367 1.664 -4.392 1.00 . A A . 28 TRP HD1 1 1 13 6007 1 1 28 TRP HE1 H -1.471 1.921 -6.178 1.00 . A A . 28 TRP HE1 1 1 13 6008 1 1 28 TRP HE3 H 2.813 -0.207 -8.461 1.00 . A A . 28 TRP HE3 1 1 13 6009 1 1 28 TRP HH2 H -0.639 0.503 -10.923 1.00 . A A . 28 TRP HH2 1 1 13 6010 1 1 28 TRP HZ2 H -1.856 1.411 -8.961 1.00 . A A . 28 TRP HZ2 1 1 13 6011 1 1 28 TRP HZ3 H 1.692 -0.304 -10.669 1.00 . A A . 28 TRP HZ3 1 1 13 6012 1 1 28 TRP N N 2.232 -1.743 -4.698 1.00 . A A . 28 TRP N 1 1 13 6013 1 1 28 TRP NE1 N -0.586 1.547 -6.364 1.00 . A A . 28 TRP NE1 1 1 13 6014 1 1 28 TRP O O 0.502 -0.266 -3.131 1.00 . A A . 28 TRP O 1 1 13 6015 1 1 29 CYS C C 0.078 2.452 -1.907 1.00 . A A . 29 CYS C 1 1 13 6016 1 1 29 CYS CA C 1.170 1.594 -1.257 1.00 . A A . 29 CYS CA 1 1 13 6017 1 1 29 CYS CB C 2.060 2.458 -0.355 1.00 . A A . 29 CYS CB 1 1 13 6018 1 1 29 CYS H H 3.023 1.314 -2.325 1.00 . A A . 29 CYS H 1 1 13 6019 1 1 29 CYS HA H 0.724 0.801 -0.678 1.00 . A A . 29 CYS HA 1 1 13 6020 1 1 29 CYS HB2 H 2.683 3.092 -0.967 1.00 . A A . 29 CYS HB2 1 1 13 6021 1 1 29 CYS HB3 H 1.439 3.071 0.282 1.00 . A A . 29 CYS HB3 1 1 13 6022 1 1 29 CYS N N 2.087 1.026 -2.294 1.00 . A A . 29 CYS N 1 1 13 6023 1 1 29 CYS O O 0.341 3.245 -2.784 1.00 . A A . 29 CYS O 1 1 13 6024 1 1 29 CYS SG S 3.106 1.392 0.668 1.00 . A A . 29 CYS SG 1 1 13 6025 1 1 30 VAL C C -2.966 3.852 -0.889 1.00 . A A . 30 VAL C 1 1 13 6026 1 1 30 VAL CA C -2.274 3.093 -2.026 1.00 . A A . 30 VAL CA 1 1 13 6027 1 1 30 VAL CB C -3.233 2.067 -2.658 1.00 . A A . 30 VAL CB 1 1 13 6028 1 1 30 VAL CG1 C -2.545 1.367 -3.830 1.00 . A A . 30 VAL CG1 1 1 13 6029 1 1 30 VAL CG2 C -3.648 1.020 -1.618 1.00 . A A . 30 VAL CG2 1 1 13 6030 1 1 30 VAL H H -1.315 1.652 -0.748 1.00 . A A . 30 VAL H 1 1 13 6031 1 1 30 VAL HA H -1.919 3.781 -2.776 1.00 . A A . 30 VAL HA 1 1 13 6032 1 1 30 VAL HB H -4.113 2.581 -3.020 1.00 . A A . 30 VAL HB 1 1 13 6033 1 1 30 VAL HG11 H -3.027 0.419 -4.016 1.00 . A A . 30 VAL HG11 1 1 13 6034 1 1 30 VAL HG12 H -1.505 1.203 -3.594 1.00 . A A . 30 VAL HG12 1 1 13 6035 1 1 30 VAL HG13 H -2.621 1.986 -4.711 1.00 . A A . 30 VAL HG13 1 1 13 6036 1 1 30 VAL HG21 H -4.569 0.549 -1.928 1.00 . A A . 30 VAL HG21 1 1 13 6037 1 1 30 VAL HG22 H -3.795 1.499 -0.660 1.00 . A A . 30 VAL HG22 1 1 13 6038 1 1 30 VAL HG23 H -2.874 0.272 -1.530 1.00 . A A . 30 VAL HG23 1 1 13 6039 1 1 30 VAL N N -1.141 2.295 -1.466 1.00 . A A . 30 VAL N 1 1 13 6040 1 1 30 VAL O O -2.495 3.855 0.230 1.00 . A A . 30 VAL O 1 1 13 6041 1 1 31 TYR C C -5.388 4.249 0.944 1.00 . A A . 31 TYR C 1 1 13 6042 1 1 31 TYR CA C -4.785 5.234 -0.069 1.00 . A A . 31 TYR CA 1 1 13 6043 1 1 31 TYR CB C -5.882 6.047 -0.775 1.00 . A A . 31 TYR CB 1 1 13 6044 1 1 31 TYR CD1 C -7.042 4.502 -2.404 1.00 . A A . 31 TYR CD1 1 1 13 6045 1 1 31 TYR CD2 C -8.112 4.969 -0.278 1.00 . A A . 31 TYR CD2 1 1 13 6046 1 1 31 TYR CE1 C -8.114 3.677 -2.762 1.00 . A A . 31 TYR CE1 1 1 13 6047 1 1 31 TYR CE2 C -9.183 4.143 -0.635 1.00 . A A . 31 TYR CE2 1 1 13 6048 1 1 31 TYR CG C -7.040 5.150 -1.162 1.00 . A A . 31 TYR CG 1 1 13 6049 1 1 31 TYR CZ C -9.184 3.496 -1.877 1.00 . A A . 31 TYR CZ 1 1 13 6050 1 1 31 TYR H H -4.443 4.473 -2.063 1.00 . A A . 31 TYR H 1 1 13 6051 1 1 31 TYR HA H -4.098 5.902 0.429 1.00 . A A . 31 TYR HA 1 1 13 6052 1 1 31 TYR HB2 H -6.238 6.818 -0.108 1.00 . A A . 31 TYR HB2 1 1 13 6053 1 1 31 TYR HB3 H -5.472 6.505 -1.662 1.00 . A A . 31 TYR HB3 1 1 13 6054 1 1 31 TYR HD1 H -6.216 4.641 -3.087 1.00 . A A . 31 TYR HD1 1 1 13 6055 1 1 31 TYR HD2 H -8.110 5.467 0.681 1.00 . A A . 31 TYR HD2 1 1 13 6056 1 1 31 TYR HE1 H -8.116 3.178 -3.720 1.00 . A A . 31 TYR HE1 1 1 13 6057 1 1 31 TYR HE2 H -10.008 4.003 0.047 1.00 . A A . 31 TYR HE2 1 1 13 6058 1 1 31 TYR HH H -10.013 1.780 -1.993 1.00 . A A . 31 TYR HH 1 1 13 6059 1 1 31 TYR N N -4.076 4.488 -1.156 1.00 . A A . 31 TYR N 1 1 13 6060 1 1 31 TYR O O -5.773 3.146 0.598 1.00 . A A . 31 TYR O 1 1 13 6061 1 1 31 TYR OH O -10.241 2.682 -2.231 1.00 . A A . 31 TYR OH 1 1 13 6062 1 1 32 ALA C C -7.438 4.221 3.646 1.00 . A A . 32 ALA C 1 1 13 6063 1 1 32 ALA CA C -6.049 3.731 3.226 1.00 . A A . 32 ALA CA 1 1 13 6064 1 1 32 ALA CB C -5.076 3.797 4.404 1.00 . A A . 32 ALA CB 1 1 13 6065 1 1 32 ALA H H -5.153 5.532 2.446 1.00 . A A . 32 ALA H 1 1 13 6066 1 1 32 ALA HA H -6.105 2.720 2.851 1.00 . A A . 32 ALA HA 1 1 13 6067 1 1 32 ALA HB1 H -4.102 3.459 4.086 1.00 . A A . 32 ALA HB1 1 1 13 6068 1 1 32 ALA HB2 H -5.434 3.162 5.202 1.00 . A A . 32 ALA HB2 1 1 13 6069 1 1 32 ALA HB3 H -5.007 4.814 4.759 1.00 . A A . 32 ALA HB3 1 1 13 6070 1 1 32 ALA N N -5.471 4.639 2.191 1.00 . A A . 32 ALA N 1 1 13 6071 1 1 32 ALA O O -7.638 5.392 3.913 1.00 . A A . 32 ALA O 1 1 13 6072 1 1 33 ARG C C -9.808 4.194 5.577 1.00 . A A . 33 ARG C 1 1 13 6073 1 1 33 ARG CA C -9.782 3.739 4.107 1.00 . A A . 33 ARG CA 1 1 13 6074 1 1 33 ARG CB C -10.647 2.489 3.908 1.00 . A A . 33 ARG CB 1 1 13 6075 1 1 33 ARG CD C -12.852 2.753 2.753 1.00 . A A . 33 ARG CD 1 1 13 6076 1 1 33 ARG CG C -11.347 2.560 2.547 1.00 . A A . 33 ARG CG 1 1 13 6077 1 1 33 ARG CZ C -14.083 0.732 2.219 1.00 . A A . 33 ARG CZ 1 1 13 6078 1 1 33 ARG H H -8.210 2.395 3.483 1.00 . A A . 33 ARG H 1 1 13 6079 1 1 33 ARG HA H -10.136 4.533 3.467 1.00 . A A . 33 ARG HA 1 1 13 6080 1 1 33 ARG HB2 H -10.023 1.608 3.946 1.00 . A A . 33 ARG HB2 1 1 13 6081 1 1 33 ARG HB3 H -11.390 2.438 4.690 1.00 . A A . 33 ARG HB3 1 1 13 6082 1 1 33 ARG HD2 H -13.034 3.443 3.566 1.00 . A A . 33 ARG HD2 1 1 13 6083 1 1 33 ARG HD3 H -13.313 3.111 1.845 1.00 . A A . 33 ARG HD3 1 1 13 6084 1 1 33 ARG HE H -13.188 1.008 3.972 1.00 . A A . 33 ARG HE 1 1 13 6085 1 1 33 ARG HG2 H -10.951 3.391 1.981 1.00 . A A . 33 ARG HG2 1 1 13 6086 1 1 33 ARG HG3 H -11.175 1.641 2.008 1.00 . A A . 33 ARG HG3 1 1 13 6087 1 1 33 ARG HH11 H -15.792 1.692 2.641 1.00 . A A . 33 ARG HH11 1 1 13 6088 1 1 33 ARG HH12 H -15.901 0.477 1.411 1.00 . A A . 33 ARG HH12 1 1 13 6089 1 1 33 ARG HH21 H -12.540 -0.387 1.593 1.00 . A A . 33 ARG HH21 1 1 13 6090 1 1 33 ARG HH22 H -14.056 -0.703 0.817 1.00 . A A . 33 ARG HH22 1 1 13 6091 1 1 33 ARG N N -8.399 3.332 3.705 1.00 . A A . 33 ARG N 1 1 13 6092 1 1 33 ARG NE N -13.375 1.398 3.093 1.00 . A A . 33 ARG NE 1 1 13 6093 1 1 33 ARG NH1 N -15.358 0.986 2.080 1.00 . A A . 33 ARG NH1 1 1 13 6094 1 1 33 ARG NH2 N -13.516 -0.191 1.486 1.00 . A A . 33 ARG NH2 1 1 13 6095 1 1 33 ARG O O -10.233 5.295 5.864 1.00 . A A . 33 ARG O 1 1 13 6096 1 1 34 PRO C C -8.220 4.698 8.210 1.00 . A A . 34 PRO C 1 1 13 6097 1 1 34 PRO CA C -9.330 3.678 7.912 1.00 . A A . 34 PRO CA 1 1 13 6098 1 1 34 PRO CB C -9.047 2.343 8.597 1.00 . A A . 34 PRO CB 1 1 13 6099 1 1 34 PRO CD C -8.819 1.983 6.218 1.00 . A A . 34 PRO CD 1 1 13 6100 1 1 34 PRO CG C -8.340 1.518 7.569 1.00 . A A . 34 PRO CG 1 1 13 6101 1 1 34 PRO HA H -10.290 4.056 8.224 1.00 . A A . 34 PRO HA 1 1 13 6102 1 1 34 PRO HB2 H -8.414 2.493 9.462 1.00 . A A . 34 PRO HB2 1 1 13 6103 1 1 34 PRO HB3 H -9.970 1.863 8.883 1.00 . A A . 34 PRO HB3 1 1 13 6104 1 1 34 PRO HD2 H -7.994 2.018 5.520 1.00 . A A . 34 PRO HD2 1 1 13 6105 1 1 34 PRO HD3 H -9.601 1.337 5.852 1.00 . A A . 34 PRO HD3 1 1 13 6106 1 1 34 PRO HG2 H -7.272 1.662 7.653 1.00 . A A . 34 PRO HG2 1 1 13 6107 1 1 34 PRO HG3 H -8.584 0.476 7.701 1.00 . A A . 34 PRO HG3 1 1 13 6108 1 1 34 PRO N N -9.349 3.333 6.466 1.00 . A A . 34 PRO N 1 1 13 6109 1 1 34 PRO O O -7.119 4.520 7.711 1.00 . A A . 34 PRO O 1 1 13 6110 1 1 34 PRO OXT O -8.495 5.643 8.932 1.00 . A A . 34 PRO OXT 1 1 14 6111 1 1 1 GLY C C 7.901 4.315 6.193 1.00 . A A . 1 GLY C 1 1 14 6112 1 1 1 GLY CA C 8.916 3.246 6.608 1.00 . A A . 1 GLY CA 1 1 14 6113 1 1 1 GLY H1 H 9.070 4.459 8.302 1.00 . A A . 1 GLY H1 1 1 14 6114 1 1 1 GLY H2 H 10.474 3.570 7.955 1.00 . A A . 1 GLY H2 1 1 14 6115 1 1 1 GLY H3 H 9.122 2.797 8.635 1.00 . A A . 1 GLY H3 1 1 14 6116 1 1 1 GLY HA2 H 9.740 3.239 5.909 1.00 . A A . 1 GLY HA2 1 1 14 6117 1 1 1 GLY HA3 H 8.436 2.279 6.607 1.00 . A A . 1 GLY HA3 1 1 14 6118 1 1 1 GLY N N 9.434 3.540 7.977 1.00 . A A . 1 GLY N 1 1 14 6119 1 1 1 GLY O O 7.099 4.765 6.990 1.00 . A A . 1 GLY O 1 1 14 6120 1 1 2 CYS C C 6.783 5.658 2.951 1.00 . A A . 2 CYS C 1 1 14 6121 1 1 2 CYS CA C 6.972 5.766 4.470 1.00 . A A . 2 CYS CA 1 1 14 6122 1 1 2 CYS CB C 7.617 7.106 4.845 1.00 . A A . 2 CYS CB 1 1 14 6123 1 1 2 CYS H H 8.589 4.346 4.326 1.00 . A A . 2 CYS H 1 1 14 6124 1 1 2 CYS HA H 6.025 5.662 4.974 1.00 . A A . 2 CYS HA 1 1 14 6125 1 1 2 CYS HB2 H 8.357 6.946 5.613 1.00 . A A . 2 CYS HB2 1 1 14 6126 1 1 2 CYS HB3 H 8.088 7.535 3.974 1.00 . A A . 2 CYS HB3 1 1 14 6127 1 1 2 CYS N N 7.932 4.725 4.948 1.00 . A A . 2 CYS N 1 1 14 6128 1 1 2 CYS O O 7.631 6.066 2.179 1.00 . A A . 2 CYS O 1 1 14 6129 1 1 2 CYS SG S 6.350 8.240 5.461 1.00 . A A . 2 CYS SG 1 1 14 6130 1 1 3 GLY C C 4.401 6.013 0.600 1.00 . A A . 3 GLY C 1 1 14 6131 1 1 3 GLY CA C 5.422 4.966 1.053 1.00 . A A . 3 GLY CA 1 1 14 6132 1 1 3 GLY H H 5.008 4.785 3.159 1.00 . A A . 3 GLY H 1 1 14 6133 1 1 3 GLY HA2 H 6.347 5.104 0.512 1.00 . A A . 3 GLY HA2 1 1 14 6134 1 1 3 GLY HA3 H 5.032 3.979 0.850 1.00 . A A . 3 GLY HA3 1 1 14 6135 1 1 3 GLY N N 5.674 5.108 2.517 1.00 . A A . 3 GLY N 1 1 14 6136 1 1 3 GLY O O 4.631 7.203 0.715 1.00 . A A . 3 GLY O 1 1 14 6137 1 1 4 GLY C C 1.132 5.803 -1.131 1.00 . A A . 4 GLY C 1 1 14 6138 1 1 4 GLY CA C 2.238 6.550 -0.378 1.00 . A A . 4 GLY CA 1 1 14 6139 1 1 4 GLY H H 3.115 4.617 0.003 1.00 . A A . 4 GLY H 1 1 14 6140 1 1 4 GLY HA2 H 1.812 7.056 0.477 1.00 . A A . 4 GLY HA2 1 1 14 6141 1 1 4 GLY HA3 H 2.691 7.275 -1.037 1.00 . A A . 4 GLY HA3 1 1 14 6142 1 1 4 GLY N N 3.276 5.581 0.086 1.00 . A A . 4 GLY N 1 1 14 6143 1 1 4 GLY O O 0.560 4.854 -0.626 1.00 . A A . 4 GLY O 1 1 14 6144 1 1 5 LEU C C 0.369 4.662 -4.233 1.00 . A A . 5 LEU C 1 1 14 6145 1 1 5 LEU CA C -0.240 5.542 -3.129 1.00 . A A . 5 LEU CA 1 1 14 6146 1 1 5 LEU CB C -1.068 6.674 -3.738 1.00 . A A . 5 LEU CB 1 1 14 6147 1 1 5 LEU CD1 C -1.314 8.459 -2.004 1.00 . A A . 5 LEU CD1 1 1 14 6148 1 1 5 LEU CD2 C -3.301 7.709 -3.324 1.00 . A A . 5 LEU CD2 1 1 14 6149 1 1 5 LEU CG C -1.993 7.260 -2.669 1.00 . A A . 5 LEU CG 1 1 14 6150 1 1 5 LEU H H 1.306 6.992 -2.716 1.00 . A A . 5 LEU H 1 1 14 6151 1 1 5 LEU HA H -0.862 4.946 -2.482 1.00 . A A . 5 LEU HA 1 1 14 6152 1 1 5 LEU HB2 H -0.406 7.445 -4.108 1.00 . A A . 5 LEU HB2 1 1 14 6153 1 1 5 LEU HB3 H -1.662 6.288 -4.553 1.00 . A A . 5 LEU HB3 1 1 14 6154 1 1 5 LEU HD11 H -0.647 8.933 -2.708 1.00 . A A . 5 LEU HD11 1 1 14 6155 1 1 5 LEU HD12 H -0.751 8.123 -1.145 1.00 . A A . 5 LEU HD12 1 1 14 6156 1 1 5 LEU HD13 H -2.065 9.168 -1.685 1.00 . A A . 5 LEU HD13 1 1 14 6157 1 1 5 LEU HD21 H -3.805 8.411 -2.675 1.00 . A A . 5 LEU HD21 1 1 14 6158 1 1 5 LEU HD22 H -3.935 6.850 -3.486 1.00 . A A . 5 LEU HD22 1 1 14 6159 1 1 5 LEU HD23 H -3.086 8.183 -4.270 1.00 . A A . 5 LEU HD23 1 1 14 6160 1 1 5 LEU HG H -2.203 6.507 -1.923 1.00 . A A . 5 LEU HG 1 1 14 6161 1 1 5 LEU N N 0.830 6.225 -2.334 1.00 . A A . 5 LEU N 1 1 14 6162 1 1 5 LEU O O -0.341 3.980 -4.949 1.00 . A A . 5 LEU O 1 1 14 6163 1 1 6 MET C C 3.729 3.409 -4.960 1.00 . A A . 6 MET C 1 1 14 6164 1 1 6 MET CA C 2.320 3.818 -5.416 1.00 . A A . 6 MET CA 1 1 14 6165 1 1 6 MET CB C 2.378 4.704 -6.663 1.00 . A A . 6 MET CB 1 1 14 6166 1 1 6 MET CE C 4.142 2.151 -8.908 1.00 . A A . 6 MET CE 1 1 14 6167 1 1 6 MET CG C 2.253 3.836 -7.918 1.00 . A A . 6 MET CG 1 1 14 6168 1 1 6 MET H H 2.228 5.214 -3.781 1.00 . A A . 6 MET H 1 1 14 6169 1 1 6 MET HA H 1.723 2.942 -5.613 1.00 . A A . 6 MET HA 1 1 14 6170 1 1 6 MET HB2 H 1.564 5.413 -6.634 1.00 . A A . 6 MET HB2 1 1 14 6171 1 1 6 MET HB3 H 3.318 5.234 -6.687 1.00 . A A . 6 MET HB3 1 1 14 6172 1 1 6 MET HE1 H 3.230 1.600 -8.724 1.00 . A A . 6 MET HE1 1 1 14 6173 1 1 6 MET HE2 H 4.866 1.908 -8.146 1.00 . A A . 6 MET HE2 1 1 14 6174 1 1 6 MET HE3 H 4.540 1.885 -9.877 1.00 . A A . 6 MET HE3 1 1 14 6175 1 1 6 MET HG2 H 2.064 2.813 -7.632 1.00 . A A . 6 MET HG2 1 1 14 6176 1 1 6 MET HG3 H 1.434 4.197 -8.524 1.00 . A A . 6 MET HG3 1 1 14 6177 1 1 6 MET N N 1.673 4.664 -4.372 1.00 . A A . 6 MET N 1 1 14 6178 1 1 6 MET O O 4.627 3.239 -5.763 1.00 . A A . 6 MET O 1 1 14 6179 1 1 6 MET SD S 3.791 3.926 -8.868 1.00 . A A . 6 MET SD 1 1 14 6180 1 1 7 ALA C C 5.459 1.334 -3.347 1.00 . A A . 7 ALA C 1 1 14 6181 1 1 7 ALA CA C 5.266 2.840 -3.159 1.00 . A A . 7 ALA CA 1 1 14 6182 1 1 7 ALA CB C 5.257 3.201 -1.672 1.00 . A A . 7 ALA CB 1 1 14 6183 1 1 7 ALA H H 3.180 3.381 -3.044 1.00 . A A . 7 ALA H 1 1 14 6184 1 1 7 ALA HA H 6.044 3.386 -3.668 1.00 . A A . 7 ALA HA 1 1 14 6185 1 1 7 ALA HB1 H 4.758 2.422 -1.115 1.00 . A A . 7 ALA HB1 1 1 14 6186 1 1 7 ALA HB2 H 4.735 4.136 -1.533 1.00 . A A . 7 ALA HB2 1 1 14 6187 1 1 7 ALA HB3 H 6.273 3.301 -1.321 1.00 . A A . 7 ALA HB3 1 1 14 6188 1 1 7 ALA N N 3.923 3.244 -3.672 1.00 . A A . 7 ALA N 1 1 14 6189 1 1 7 ALA O O 4.610 0.545 -2.981 1.00 . A A . 7 ALA O 1 1 14 6190 1 1 8 GLY C C 6.703 -1.280 -2.816 1.00 . A A . 8 GLY C 1 1 14 6191 1 1 8 GLY CA C 6.819 -0.522 -4.141 1.00 . A A . 8 GLY CA 1 1 14 6192 1 1 8 GLY H H 7.230 1.592 -4.203 1.00 . A A . 8 GLY H 1 1 14 6193 1 1 8 GLY HA2 H 6.089 -0.907 -4.840 1.00 . A A . 8 GLY HA2 1 1 14 6194 1 1 8 GLY HA3 H 7.810 -0.658 -4.543 1.00 . A A . 8 GLY HA3 1 1 14 6195 1 1 8 GLY N N 6.566 0.933 -3.917 1.00 . A A . 8 GLY N 1 1 14 6196 1 1 8 GLY O O 7.445 -1.036 -1.884 1.00 . A A . 8 GLY O 1 1 14 6197 1 1 9 CYS C C 6.456 -4.251 -1.522 1.00 . A A . 9 CYS C 1 1 14 6198 1 1 9 CYS CA C 5.599 -2.980 -1.472 1.00 . A A . 9 CYS CA 1 1 14 6199 1 1 9 CYS CB C 4.107 -3.325 -1.413 1.00 . A A . 9 CYS CB 1 1 14 6200 1 1 9 CYS H H 5.189 -2.375 -3.499 1.00 . A A . 9 CYS H 1 1 14 6201 1 1 9 CYS HA H 5.871 -2.381 -0.620 1.00 . A A . 9 CYS HA 1 1 14 6202 1 1 9 CYS HB2 H 3.541 -2.436 -1.170 1.00 . A A . 9 CYS HB2 1 1 14 6203 1 1 9 CYS HB3 H 3.786 -3.704 -2.373 1.00 . A A . 9 CYS HB3 1 1 14 6204 1 1 9 CYS N N 5.773 -2.199 -2.732 1.00 . A A . 9 CYS N 1 1 14 6205 1 1 9 CYS O O 7.482 -4.335 -0.874 1.00 . A A . 9 CYS O 1 1 14 6206 1 1 9 CYS SG S 3.826 -4.583 -0.142 1.00 . A A . 9 CYS SG 1 1 14 6207 1 1 10 ASP C C 7.005 -7.152 -1.019 1.00 . A A . 10 ASP C 1 1 14 6208 1 1 10 ASP CA C 6.817 -6.510 -2.404 1.00 . A A . 10 ASP CA 1 1 14 6209 1 1 10 ASP CB C 8.166 -6.112 -3.016 1.00 . A A . 10 ASP CB 1 1 14 6210 1 1 10 ASP CG C 8.457 -6.992 -4.234 1.00 . A A . 10 ASP CG 1 1 14 6211 1 1 10 ASP H H 5.213 -5.125 -2.801 1.00 . A A . 10 ASP H 1 1 14 6212 1 1 10 ASP HA H 6.306 -7.194 -3.063 1.00 . A A . 10 ASP HA 1 1 14 6213 1 1 10 ASP HB2 H 8.132 -5.075 -3.322 1.00 . A A . 10 ASP HB2 1 1 14 6214 1 1 10 ASP HB3 H 8.949 -6.244 -2.284 1.00 . A A . 10 ASP HB3 1 1 14 6215 1 1 10 ASP N N 6.040 -5.231 -2.291 1.00 . A A . 10 ASP N 1 1 14 6216 1 1 10 ASP O O 7.950 -6.861 -0.307 1.00 . A A . 10 ASP O 1 1 14 6217 1 1 10 ASP OD1 O 8.020 -6.634 -5.316 1.00 . A A . 10 ASP OD1 1 1 14 6218 1 1 10 ASP OD2 O 9.112 -8.006 -4.063 1.00 . A A . 10 ASP OD2 1 1 14 6219 1 1 11 GLY C C 4.837 -8.870 1.340 1.00 . A A . 11 GLY C 1 1 14 6220 1 1 11 GLY CA C 6.225 -8.688 0.703 1.00 . A A . 11 GLY CA 1 1 14 6221 1 1 11 GLY H H 5.359 -8.246 -1.225 1.00 . A A . 11 GLY H 1 1 14 6222 1 1 11 GLY HA2 H 6.693 -9.654 0.583 1.00 . A A . 11 GLY HA2 1 1 14 6223 1 1 11 GLY HA3 H 6.833 -8.076 1.353 1.00 . A A . 11 GLY HA3 1 1 14 6224 1 1 11 GLY N N 6.109 -8.025 -0.633 1.00 . A A . 11 GLY N 1 1 14 6225 1 1 11 GLY O O 4.693 -9.588 2.311 1.00 . A A . 11 GLY O 1 1 14 6226 1 1 12 LYS C C 2.395 -7.852 2.840 1.00 . A A . 12 LYS C 1 1 14 6227 1 1 12 LYS CA C 2.433 -8.340 1.381 1.00 . A A . 12 LYS CA 1 1 14 6228 1 1 12 LYS CB C 2.072 -9.831 1.293 1.00 . A A . 12 LYS CB 1 1 14 6229 1 1 12 LYS CD C 2.387 -11.813 -0.206 1.00 . A A . 12 LYS CD 1 1 14 6230 1 1 12 LYS CE C 3.838 -12.092 -0.611 1.00 . A A . 12 LYS CE 1 1 14 6231 1 1 12 LYS CG C 2.144 -10.301 -0.164 1.00 . A A . 12 LYS CG 1 1 14 6232 1 1 12 LYS H H 3.964 -7.641 0.036 1.00 . A A . 12 LYS H 1 1 14 6233 1 1 12 LYS HA H 1.741 -7.766 0.784 1.00 . A A . 12 LYS HA 1 1 14 6234 1 1 12 LYS HB2 H 2.761 -10.405 1.892 1.00 . A A . 12 LYS HB2 1 1 14 6235 1 1 12 LYS HB3 H 1.068 -9.978 1.664 1.00 . A A . 12 LYS HB3 1 1 14 6236 1 1 12 LYS HD2 H 2.196 -12.236 0.771 1.00 . A A . 12 LYS HD2 1 1 14 6237 1 1 12 LYS HD3 H 1.722 -12.263 -0.927 1.00 . A A . 12 LYS HD3 1 1 14 6238 1 1 12 LYS HE2 H 3.888 -12.969 -1.242 1.00 . A A . 12 LYS HE2 1 1 14 6239 1 1 12 LYS HE3 H 4.259 -11.238 -1.118 1.00 . A A . 12 LYS HE3 1 1 14 6240 1 1 12 LYS HG2 H 1.213 -10.072 -0.663 1.00 . A A . 12 LYS HG2 1 1 14 6241 1 1 12 LYS HG3 H 2.955 -9.795 -0.666 1.00 . A A . 12 LYS HG3 1 1 14 6242 1 1 12 LYS HZ1 H 4.424 -11.524 1.308 1.00 . A A . 12 LYS HZ1 1 1 14 6243 1 1 12 LYS HZ2 H 5.580 -12.448 0.475 1.00 . A A . 12 LYS HZ2 1 1 14 6244 1 1 12 LYS HZ3 H 4.198 -13.194 1.121 1.00 . A A . 12 LYS HZ3 1 1 14 6245 1 1 12 LYS N N 3.819 -8.220 0.809 1.00 . A A . 12 LYS N 1 1 14 6246 1 1 12 LYS NZ N 4.564 -12.333 0.670 1.00 . A A . 12 LYS NZ 1 1 14 6247 1 1 12 LYS O O 1.491 -8.182 3.587 1.00 . A A . 12 LYS O 1 1 14 6248 1 1 13 SER C C 4.473 -5.464 4.792 1.00 . A A . 13 SER C 1 1 14 6249 1 1 13 SER CA C 3.387 -6.543 4.649 1.00 . A A . 13 SER CA 1 1 14 6250 1 1 13 SER CB C 3.712 -7.761 5.522 1.00 . A A . 13 SER CB 1 1 14 6251 1 1 13 SER H H 4.075 -6.806 2.623 1.00 . A A . 13 SER H 1 1 14 6252 1 1 13 SER HA H 2.423 -6.141 4.919 1.00 . A A . 13 SER HA 1 1 14 6253 1 1 13 SER HB2 H 3.110 -8.600 5.215 1.00 . A A . 13 SER HB2 1 1 14 6254 1 1 13 SER HB3 H 4.758 -8.015 5.408 1.00 . A A . 13 SER HB3 1 1 14 6255 1 1 13 SER HG H 2.506 -7.657 7.045 1.00 . A A . 13 SER HG 1 1 14 6256 1 1 13 SER N N 3.363 -7.062 3.246 1.00 . A A . 13 SER N 1 1 14 6257 1 1 13 SER O O 5.267 -5.487 5.715 1.00 . A A . 13 SER O 1 1 14 6258 1 1 13 SER OG O 3.430 -7.455 6.881 1.00 . A A . 13 SER OG 1 1 14 6259 1 1 14 THR C C 5.085 -2.321 4.905 1.00 . A A . 14 THR C 1 1 14 6260 1 1 14 THR CA C 5.544 -3.439 3.959 1.00 . A A . 14 THR CA 1 1 14 6261 1 1 14 THR CB C 5.691 -2.918 2.520 1.00 . A A . 14 THR CB 1 1 14 6262 1 1 14 THR CG2 C 4.512 -2.006 2.163 1.00 . A A . 14 THR CG2 1 1 14 6263 1 1 14 THR H H 3.860 -4.521 3.149 1.00 . A A . 14 THR H 1 1 14 6264 1 1 14 THR HA H 6.484 -3.850 4.294 1.00 . A A . 14 THR HA 1 1 14 6265 1 1 14 THR HB H 5.712 -3.753 1.838 1.00 . A A . 14 THR HB 1 1 14 6266 1 1 14 THR HG1 H 7.398 -2.545 1.665 1.00 . A A . 14 THR HG1 1 1 14 6267 1 1 14 THR HG21 H 4.398 -1.968 1.089 1.00 . A A . 14 THR HG21 1 1 14 6268 1 1 14 THR HG22 H 4.698 -1.011 2.541 1.00 . A A . 14 THR HG22 1 1 14 6269 1 1 14 THR HG23 H 3.608 -2.396 2.607 1.00 . A A . 14 THR HG23 1 1 14 6270 1 1 14 THR N N 4.511 -4.519 3.882 1.00 . A A . 14 THR N 1 1 14 6271 1 1 14 THR O O 3.907 -2.159 5.165 1.00 . A A . 14 THR O 1 1 14 6272 1 1 14 THR OG1 O 6.905 -2.187 2.406 1.00 . A A . 14 THR OG1 1 1 14 6273 1 1 15 PHE C C 5.472 0.873 5.563 1.00 . A A . 15 PHE C 1 1 14 6274 1 1 15 PHE CA C 5.631 -0.437 6.343 1.00 . A A . 15 PHE CA 1 1 14 6275 1 1 15 PHE CB C 6.785 -0.331 7.346 1.00 . A A . 15 PHE CB 1 1 14 6276 1 1 15 PHE CD1 C 5.259 0.103 9.309 1.00 . A A . 15 PHE CD1 1 1 14 6277 1 1 15 PHE CD2 C 6.828 -1.742 9.435 1.00 . A A . 15 PHE CD2 1 1 14 6278 1 1 15 PHE CE1 C 4.789 -0.209 10.589 1.00 . A A . 15 PHE CE1 1 1 14 6279 1 1 15 PHE CE2 C 6.358 -2.054 10.716 1.00 . A A . 15 PHE CE2 1 1 14 6280 1 1 15 PHE CG C 6.279 -0.663 8.731 1.00 . A A . 15 PHE CG 1 1 14 6281 1 1 15 PHE CZ C 5.338 -1.287 11.293 1.00 . A A . 15 PHE CZ 1 1 14 6282 1 1 15 PHE H H 6.951 -1.696 5.191 1.00 . A A . 15 PHE H 1 1 14 6283 1 1 15 PHE HA H 4.715 -0.676 6.860 1.00 . A A . 15 PHE HA 1 1 14 6284 1 1 15 PHE HB2 H 7.566 -1.024 7.071 1.00 . A A . 15 PHE HB2 1 1 14 6285 1 1 15 PHE HB3 H 7.177 0.675 7.340 1.00 . A A . 15 PHE HB3 1 1 14 6286 1 1 15 PHE HD1 H 4.835 0.936 8.766 1.00 . A A . 15 PHE HD1 1 1 14 6287 1 1 15 PHE HD2 H 7.615 -2.333 8.990 1.00 . A A . 15 PHE HD2 1 1 14 6288 1 1 15 PHE HE1 H 4.002 0.382 11.034 1.00 . A A . 15 PHE HE1 1 1 14 6289 1 1 15 PHE HE2 H 6.782 -2.886 11.259 1.00 . A A . 15 PHE HE2 1 1 14 6290 1 1 15 PHE HZ H 4.973 -1.529 12.281 1.00 . A A . 15 PHE HZ 1 1 14 6291 1 1 15 PHE N N 6.009 -1.547 5.416 1.00 . A A . 15 PHE N 1 1 14 6292 1 1 15 PHE O O 6.398 1.345 4.927 1.00 . A A . 15 PHE O 1 1 14 6293 1 1 16 CYS C C 4.149 3.934 5.836 1.00 . A A . 16 CYS C 1 1 14 6294 1 1 16 CYS CA C 4.074 2.741 4.871 1.00 . A A . 16 CYS CA 1 1 14 6295 1 1 16 CYS CB C 2.673 2.608 4.267 1.00 . A A . 16 CYS CB 1 1 14 6296 1 1 16 CYS H H 3.574 1.060 6.126 1.00 . A A . 16 CYS H 1 1 14 6297 1 1 16 CYS HA H 4.802 2.855 4.084 1.00 . A A . 16 CYS HA 1 1 14 6298 1 1 16 CYS HB2 H 2.322 1.593 4.387 1.00 . A A . 16 CYS HB2 1 1 14 6299 1 1 16 CYS HB3 H 1.996 3.284 4.770 1.00 . A A . 16 CYS HB3 1 1 14 6300 1 1 16 CYS N N 4.303 1.461 5.608 1.00 . A A . 16 CYS N 1 1 14 6301 1 1 16 CYS O O 4.547 3.793 6.978 1.00 . A A . 16 CYS O 1 1 14 6302 1 1 16 CYS SG S 2.743 3.019 2.506 1.00 . A A . 16 CYS SG 1 1 14 6303 1 1 17 CYS C C 2.863 6.168 7.441 1.00 . A A . 17 CYS C 1 1 14 6304 1 1 17 CYS CA C 3.835 6.318 6.265 1.00 . A A . 17 CYS CA 1 1 14 6305 1 1 17 CYS CB C 3.422 7.495 5.371 1.00 . A A . 17 CYS CB 1 1 14 6306 1 1 17 CYS H H 3.467 5.197 4.456 1.00 . A A . 17 CYS H 1 1 14 6307 1 1 17 CYS HA H 4.839 6.468 6.627 1.00 . A A . 17 CYS HA 1 1 14 6308 1 1 17 CYS HB2 H 2.551 7.221 4.796 1.00 . A A . 17 CYS HB2 1 1 14 6309 1 1 17 CYS HB3 H 3.187 8.350 5.989 1.00 . A A . 17 CYS HB3 1 1 14 6310 1 1 17 CYS N N 3.777 5.109 5.381 1.00 . A A . 17 CYS N 1 1 14 6311 1 1 17 CYS O O 3.238 5.738 8.516 1.00 . A A . 17 CYS O 1 1 14 6312 1 1 17 CYS SG S 4.772 7.921 4.244 1.00 . A A . 17 CYS SG 1 1 14 6313 1 1 18 SER C C -0.804 6.368 7.748 1.00 . A A . 18 SER C 1 1 14 6314 1 1 18 SER CA C 0.610 6.405 8.340 1.00 . A A . 18 SER CA 1 1 14 6315 1 1 18 SER CB C 0.810 7.655 9.205 1.00 . A A . 18 SER CB 1 1 14 6316 1 1 18 SER H H 1.346 6.863 6.368 1.00 . A A . 18 SER H 1 1 14 6317 1 1 18 SER HA H 0.796 5.519 8.927 1.00 . A A . 18 SER HA 1 1 14 6318 1 1 18 SER HB2 H 0.022 7.718 9.937 1.00 . A A . 18 SER HB2 1 1 14 6319 1 1 18 SER HB3 H 1.763 7.591 9.713 1.00 . A A . 18 SER HB3 1 1 14 6320 1 1 18 SER HG H -0.082 9.236 8.498 1.00 . A A . 18 SER HG 1 1 14 6321 1 1 18 SER N N 1.618 6.521 7.244 1.00 . A A . 18 SER N 1 1 14 6322 1 1 18 SER O O -1.445 7.389 7.578 1.00 . A A . 18 SER O 1 1 14 6323 1 1 18 SER OG O 0.774 8.817 8.383 1.00 . A A . 18 SER OG 1 1 14 6324 1 1 19 GLY C C -2.592 4.373 5.475 1.00 . A A . 19 GLY C 1 1 14 6325 1 1 19 GLY CA C -2.660 5.085 6.834 1.00 . A A . 19 GLY CA 1 1 14 6326 1 1 19 GLY H H -0.755 4.386 7.562 1.00 . A A . 19 GLY H 1 1 14 6327 1 1 19 GLY HA2 H -3.292 4.520 7.505 1.00 . A A . 19 GLY HA2 1 1 14 6328 1 1 19 GLY HA3 H -3.075 6.073 6.698 1.00 . A A . 19 GLY HA3 1 1 14 6329 1 1 19 GLY N N -1.291 5.196 7.424 1.00 . A A . 19 GLY N 1 1 14 6330 1 1 19 GLY O O -3.594 3.905 4.970 1.00 . A A . 19 GLY O 1 1 14 6331 1 1 20 TYR C C -1.149 2.089 3.766 1.00 . A A . 20 TYR C 1 1 14 6332 1 1 20 TYR CA C -1.303 3.600 3.558 1.00 . A A . 20 TYR CA 1 1 14 6333 1 1 20 TYR CB C -0.046 4.187 2.907 1.00 . A A . 20 TYR CB 1 1 14 6334 1 1 20 TYR CD1 C -1.392 5.944 1.693 1.00 . A A . 20 TYR CD1 1 1 14 6335 1 1 20 TYR CD2 C 0.564 6.633 2.948 1.00 . A A . 20 TYR CD2 1 1 14 6336 1 1 20 TYR CE1 C -1.623 7.272 1.323 1.00 . A A . 20 TYR CE1 1 1 14 6337 1 1 20 TYR CE2 C 0.334 7.962 2.577 1.00 . A A . 20 TYR CE2 1 1 14 6338 1 1 20 TYR CG C -0.299 5.623 2.505 1.00 . A A . 20 TYR CG 1 1 14 6339 1 1 20 TYR CZ C -0.762 8.283 1.765 1.00 . A A . 20 TYR CZ 1 1 14 6340 1 1 20 TYR H H -0.628 4.669 5.303 1.00 . A A . 20 TYR H 1 1 14 6341 1 1 20 TYR HA H -2.164 3.809 2.947 1.00 . A A . 20 TYR HA 1 1 14 6342 1 1 20 TYR HB2 H 0.773 4.151 3.609 1.00 . A A . 20 TYR HB2 1 1 14 6343 1 1 20 TYR HB3 H 0.206 3.610 2.030 1.00 . A A . 20 TYR HB3 1 1 14 6344 1 1 20 TYR HD1 H -2.057 5.166 1.351 1.00 . A A . 20 TYR HD1 1 1 14 6345 1 1 20 TYR HD2 H 1.409 6.384 3.574 1.00 . A A . 20 TYR HD2 1 1 14 6346 1 1 20 TYR HE1 H -2.468 7.520 0.696 1.00 . A A . 20 TYR HE1 1 1 14 6347 1 1 20 TYR HE2 H 0.999 8.741 2.918 1.00 . A A . 20 TYR HE2 1 1 14 6348 1 1 20 TYR HH H -1.464 10.024 2.116 1.00 . A A . 20 TYR HH 1 1 14 6349 1 1 20 TYR N N -1.423 4.286 4.880 1.00 . A A . 20 TYR N 1 1 14 6350 1 1 20 TYR O O -0.542 1.643 4.723 1.00 . A A . 20 TYR O 1 1 14 6351 1 1 20 TYR OH O -0.990 9.594 1.399 1.00 . A A . 20 TYR OH 1 1 14 6352 1 1 21 ASN C C -1.007 -0.793 1.738 1.00 . A A . 21 ASN C 1 1 14 6353 1 1 21 ASN CA C -1.599 -0.183 3.013 1.00 . A A . 21 ASN CA 1 1 14 6354 1 1 21 ASN CB C -3.042 -0.653 3.232 1.00 . A A . 21 ASN CB 1 1 14 6355 1 1 21 ASN CG C -3.128 -2.177 3.100 1.00 . A A . 21 ASN CG 1 1 14 6356 1 1 21 ASN H H -2.184 1.687 2.117 1.00 . A A . 21 ASN H 1 1 14 6357 1 1 21 ASN HA H -0.992 -0.438 3.865 1.00 . A A . 21 ASN HA 1 1 14 6358 1 1 21 ASN HB2 H -3.367 -0.360 4.220 1.00 . A A . 21 ASN HB2 1 1 14 6359 1 1 21 ASN HB3 H -3.684 -0.194 2.495 1.00 . A A . 21 ASN HB3 1 1 14 6360 1 1 21 ASN HD21 H -2.336 -2.526 4.890 1.00 . A A . 21 ASN HD21 1 1 14 6361 1 1 21 ASN HD22 H -2.759 -3.909 4.001 1.00 . A A . 21 ASN HD22 1 1 14 6362 1 1 21 ASN N N -1.700 1.301 2.877 1.00 . A A . 21 ASN N 1 1 14 6363 1 1 21 ASN ND2 N -2.706 -2.933 4.079 1.00 . A A . 21 ASN ND2 1 1 14 6364 1 1 21 ASN O O -1.107 -0.228 0.669 1.00 . A A . 21 ASN O 1 1 14 6365 1 1 21 ASN OD1 O -3.583 -2.687 2.093 1.00 . A A . 21 ASN OD1 1 1 14 6366 1 1 22 CYS C C -0.817 -3.470 -0.062 1.00 . A A . 22 CYS C 1 1 14 6367 1 1 22 CYS CA C 0.216 -2.590 0.647 1.00 . A A . 22 CYS CA 1 1 14 6368 1 1 22 CYS CB C 1.369 -3.441 1.194 1.00 . A A . 22 CYS CB 1 1 14 6369 1 1 22 CYS H H -0.324 -2.378 2.727 1.00 . A A . 22 CYS H 1 1 14 6370 1 1 22 CYS HA H 0.600 -1.841 -0.028 1.00 . A A . 22 CYS HA 1 1 14 6371 1 1 22 CYS HB2 H 2.223 -2.809 1.381 1.00 . A A . 22 CYS HB2 1 1 14 6372 1 1 22 CYS HB3 H 1.062 -3.911 2.117 1.00 . A A . 22 CYS HB3 1 1 14 6373 1 1 22 CYS N N -0.391 -1.943 1.850 1.00 . A A . 22 CYS N 1 1 14 6374 1 1 22 CYS O O -1.529 -4.234 0.562 1.00 . A A . 22 CYS O 1 1 14 6375 1 1 22 CYS SG S 1.817 -4.715 -0.012 1.00 . A A . 22 CYS SG 1 1 14 6376 1 1 23 SER C C -1.160 -5.383 -2.782 1.00 . A A . 23 SER C 1 1 14 6377 1 1 23 SER CA C -1.873 -4.187 -2.136 1.00 . A A . 23 SER CA 1 1 14 6378 1 1 23 SER CB C -2.428 -3.254 -3.215 1.00 . A A . 23 SER CB 1 1 14 6379 1 1 23 SER H H -0.306 -2.737 -1.839 1.00 . A A . 23 SER H 1 1 14 6380 1 1 23 SER HA H -2.671 -4.523 -1.493 1.00 . A A . 23 SER HA 1 1 14 6381 1 1 23 SER HB2 H -2.459 -2.244 -2.844 1.00 . A A . 23 SER HB2 1 1 14 6382 1 1 23 SER HB3 H -1.790 -3.294 -4.089 1.00 . A A . 23 SER HB3 1 1 14 6383 1 1 23 SER HG H -4.362 -3.130 -3.056 1.00 . A A . 23 SER HG 1 1 14 6384 1 1 23 SER N N -0.896 -3.363 -1.365 1.00 . A A . 23 SER N 1 1 14 6385 1 1 23 SER O O -0.112 -5.226 -3.378 1.00 . A A . 23 SER O 1 1 14 6386 1 1 23 SER OG O -3.744 -3.669 -3.555 1.00 . A A . 23 SER OG 1 1 14 6387 1 1 24 PRO C C -1.330 -7.793 -4.754 1.00 . A A . 24 PRO C 1 1 14 6388 1 1 24 PRO CA C -1.166 -7.776 -3.226 1.00 . A A . 24 PRO CA 1 1 14 6389 1 1 24 PRO CB C -1.975 -8.899 -2.581 1.00 . A A . 24 PRO CB 1 1 14 6390 1 1 24 PRO CD C -3.014 -6.817 -1.934 1.00 . A A . 24 PRO CD 1 1 14 6391 1 1 24 PRO CG C -3.282 -8.274 -2.208 1.00 . A A . 24 PRO CG 1 1 14 6392 1 1 24 PRO HA H -0.129 -7.867 -2.953 1.00 . A A . 24 PRO HA 1 1 14 6393 1 1 24 PRO HB2 H -2.127 -9.704 -3.289 1.00 . A A . 24 PRO HB2 1 1 14 6394 1 1 24 PRO HB3 H -1.475 -9.264 -1.697 1.00 . A A . 24 PRO HB3 1 1 14 6395 1 1 24 PRO HD2 H -3.815 -6.206 -2.329 1.00 . A A . 24 PRO HD2 1 1 14 6396 1 1 24 PRO HD3 H -2.890 -6.647 -0.877 1.00 . A A . 24 PRO HD3 1 1 14 6397 1 1 24 PRO HG2 H -3.984 -8.376 -3.024 1.00 . A A . 24 PRO HG2 1 1 14 6398 1 1 24 PRO HG3 H -3.676 -8.743 -1.320 1.00 . A A . 24 PRO HG3 1 1 14 6399 1 1 24 PRO N N -1.755 -6.543 -2.642 1.00 . A A . 24 PRO N 1 1 14 6400 1 1 24 PRO O O -0.537 -8.386 -5.461 1.00 . A A . 24 PRO O 1 1 14 6401 1 1 25 THR C C -1.819 -5.958 -7.384 1.00 . A A . 25 THR C 1 1 14 6402 1 1 25 THR CA C -2.571 -7.130 -6.745 1.00 . A A . 25 THR CA 1 1 14 6403 1 1 25 THR CB C -4.086 -6.968 -6.929 1.00 . A A . 25 THR CB 1 1 14 6404 1 1 25 THR CG2 C -4.450 -7.159 -8.404 1.00 . A A . 25 THR CG2 1 1 14 6405 1 1 25 THR H H -2.978 -6.681 -4.674 1.00 . A A . 25 THR H 1 1 14 6406 1 1 25 THR HA H -2.248 -8.060 -7.181 1.00 . A A . 25 THR HA 1 1 14 6407 1 1 25 THR HB H -4.382 -5.978 -6.616 1.00 . A A . 25 THR HB 1 1 14 6408 1 1 25 THR HG1 H -4.380 -8.797 -6.321 1.00 . A A . 25 THR HG1 1 1 14 6409 1 1 25 THR HG21 H -3.747 -6.620 -9.022 1.00 . A A . 25 THR HG21 1 1 14 6410 1 1 25 THR HG22 H -5.446 -6.784 -8.581 1.00 . A A . 25 THR HG22 1 1 14 6411 1 1 25 THR HG23 H -4.412 -8.211 -8.650 1.00 . A A . 25 THR HG23 1 1 14 6412 1 1 25 THR N N -2.352 -7.150 -5.265 1.00 . A A . 25 THR N 1 1 14 6413 1 1 25 THR O O -1.299 -6.070 -8.478 1.00 . A A . 25 THR O 1 1 14 6414 1 1 25 THR OG1 O -4.770 -7.937 -6.143 1.00 . A A . 25 THR OG1 1 1 14 6415 1 1 26 TRP C C 0.454 -3.694 -6.895 1.00 . A A . 26 TRP C 1 1 14 6416 1 1 26 TRP CA C -1.034 -3.654 -7.280 1.00 . A A . 26 TRP CA 1 1 14 6417 1 1 26 TRP CB C -1.700 -2.416 -6.667 1.00 . A A . 26 TRP CB 1 1 14 6418 1 1 26 TRP CD1 C -3.853 -3.179 -7.780 1.00 . A A . 26 TRP CD1 1 1 14 6419 1 1 26 TRP CD2 C -4.212 -1.803 -6.037 1.00 . A A . 26 TRP CD2 1 1 14 6420 1 1 26 TRP CE2 C -5.482 -2.145 -6.553 1.00 . A A . 26 TRP CE2 1 1 14 6421 1 1 26 TRP CE3 C -4.157 -0.939 -4.928 1.00 . A A . 26 TRP CE3 1 1 14 6422 1 1 26 TRP CG C -3.191 -2.474 -6.831 1.00 . A A . 26 TRP CG 1 1 14 6423 1 1 26 TRP CH2 C -6.586 -0.792 -4.888 1.00 . A A . 26 TRP CH2 1 1 14 6424 1 1 26 TRP CZ2 C -6.658 -1.650 -5.989 1.00 . A A . 26 TRP CZ2 1 1 14 6425 1 1 26 TRP CZ3 C -5.338 -0.438 -4.358 1.00 . A A . 26 TRP CZ3 1 1 14 6426 1 1 26 TRP H H -2.181 -4.774 -5.829 1.00 . A A . 26 TRP H 1 1 14 6427 1 1 26 TRP HA H -1.139 -3.632 -8.354 1.00 . A A . 26 TRP HA 1 1 14 6428 1 1 26 TRP HB2 H -1.459 -2.363 -5.618 1.00 . A A . 26 TRP HB2 1 1 14 6429 1 1 26 TRP HB3 H -1.323 -1.537 -7.161 1.00 . A A . 26 TRP HB3 1 1 14 6430 1 1 26 TRP HD1 H -3.396 -3.794 -8.539 1.00 . A A . 26 TRP HD1 1 1 14 6431 1 1 26 TRP HE1 H -5.908 -3.388 -8.164 1.00 . A A . 26 TRP HE1 1 1 14 6432 1 1 26 TRP HE3 H -3.200 -0.661 -4.512 1.00 . A A . 26 TRP HE3 1 1 14 6433 1 1 26 TRP HH2 H -7.492 -0.404 -4.446 1.00 . A A . 26 TRP HH2 1 1 14 6434 1 1 26 TRP HZ2 H -7.616 -1.926 -6.402 1.00 . A A . 26 TRP HZ2 1 1 14 6435 1 1 26 TRP HZ3 H -5.285 0.225 -3.508 1.00 . A A . 26 TRP HZ3 1 1 14 6436 1 1 26 TRP N N -1.757 -4.837 -6.710 1.00 . A A . 26 TRP N 1 1 14 6437 1 1 26 TRP NE1 N -5.211 -2.987 -7.611 1.00 . A A . 26 TRP NE1 1 1 14 6438 1 1 26 TRP O O 1.262 -2.985 -7.462 1.00 . A A . 26 TRP O 1 1 14 6439 1 1 27 LYS C C 2.778 -3.293 -4.946 1.00 . A A . 27 LYS C 1 1 14 6440 1 1 27 LYS CA C 2.240 -4.628 -5.489 1.00 . A A . 27 LYS CA 1 1 14 6441 1 1 27 LYS CB C 3.030 -5.072 -6.727 1.00 . A A . 27 LYS CB 1 1 14 6442 1 1 27 LYS CD C 3.849 -7.244 -5.786 1.00 . A A . 27 LYS CD 1 1 14 6443 1 1 27 LYS CE C 2.974 -8.035 -4.804 1.00 . A A . 27 LYS CE 1 1 14 6444 1 1 27 LYS CG C 2.967 -6.597 -6.859 1.00 . A A . 27 LYS CG 1 1 14 6445 1 1 27 LYS H H 0.135 -5.073 -5.495 1.00 . A A . 27 LYS H 1 1 14 6446 1 1 27 LYS HA H 2.322 -5.386 -4.726 1.00 . A A . 27 LYS HA 1 1 14 6447 1 1 27 LYS HB2 H 2.608 -4.617 -7.610 1.00 . A A . 27 LYS HB2 1 1 14 6448 1 1 27 LYS HB3 H 4.060 -4.766 -6.624 1.00 . A A . 27 LYS HB3 1 1 14 6449 1 1 27 LYS HD2 H 4.556 -7.911 -6.256 1.00 . A A . 27 LYS HD2 1 1 14 6450 1 1 27 LYS HD3 H 4.384 -6.475 -5.247 1.00 . A A . 27 LYS HD3 1 1 14 6451 1 1 27 LYS HE2 H 3.505 -8.190 -3.875 1.00 . A A . 27 LYS HE2 1 1 14 6452 1 1 27 LYS HE3 H 2.045 -7.516 -4.625 1.00 . A A . 27 LYS HE3 1 1 14 6453 1 1 27 LYS HG2 H 1.945 -6.927 -6.735 1.00 . A A . 27 LYS HG2 1 1 14 6454 1 1 27 LYS HG3 H 3.322 -6.888 -7.835 1.00 . A A . 27 LYS HG3 1 1 14 6455 1 1 27 LYS HZ1 H 2.134 -9.940 -4.852 1.00 . A A . 27 LYS HZ1 1 1 14 6456 1 1 27 LYS HZ2 H 3.612 -9.815 -5.682 1.00 . A A . 27 LYS HZ2 1 1 14 6457 1 1 27 LYS HZ3 H 2.192 -9.176 -6.364 1.00 . A A . 27 LYS HZ3 1 1 14 6458 1 1 27 LYS N N 0.812 -4.518 -5.934 1.00 . A A . 27 LYS N 1 1 14 6459 1 1 27 LYS NZ N 2.709 -9.340 -5.477 1.00 . A A . 27 LYS NZ 1 1 14 6460 1 1 27 LYS O O 3.975 -3.098 -4.869 1.00 . A A . 27 LYS O 1 1 14 6461 1 1 28 TRP C C 1.498 -0.578 -2.867 1.00 . A A . 28 TRP C 1 1 14 6462 1 1 28 TRP CA C 2.419 -1.088 -3.985 1.00 . A A . 28 TRP CA 1 1 14 6463 1 1 28 TRP CB C 2.503 -0.096 -5.164 1.00 . A A . 28 TRP CB 1 1 14 6464 1 1 28 TRP CD1 C 0.063 0.631 -5.089 1.00 . A A . 28 TRP CD1 1 1 14 6465 1 1 28 TRP CD2 C 0.770 0.150 -7.166 1.00 . A A . 28 TRP CD2 1 1 14 6466 1 1 28 TRP CE2 C -0.583 0.540 -7.281 1.00 . A A . 28 TRP CE2 1 1 14 6467 1 1 28 TRP CE3 C 1.458 -0.206 -8.335 1.00 . A A . 28 TRP CE3 1 1 14 6468 1 1 28 TRP CG C 1.158 0.206 -5.763 1.00 . A A . 28 TRP CG 1 1 14 6469 1 1 28 TRP CH2 C -0.530 0.219 -9.672 1.00 . A A . 28 TRP CH2 1 1 14 6470 1 1 28 TRP CZ2 C -1.231 0.577 -8.517 1.00 . A A . 28 TRP CZ2 1 1 14 6471 1 1 28 TRP CZ3 C 0.813 -0.171 -9.581 1.00 . A A . 28 TRP CZ3 1 1 14 6472 1 1 28 TRP H H 0.954 -2.556 -4.591 1.00 . A A . 28 TRP H 1 1 14 6473 1 1 28 TRP HA H 3.411 -1.239 -3.584 1.00 . A A . 28 TRP HA 1 1 14 6474 1 1 28 TRP HB2 H 2.940 0.824 -4.814 1.00 . A A . 28 TRP HB2 1 1 14 6475 1 1 28 TRP HB3 H 3.143 -0.517 -5.927 1.00 . A A . 28 TRP HB3 1 1 14 6476 1 1 28 TRP HD1 H 0.002 0.787 -4.023 1.00 . A A . 28 TRP HD1 1 1 14 6477 1 1 28 TRP HE1 H -1.874 1.121 -5.760 1.00 . A A . 28 TRP HE1 1 1 14 6478 1 1 28 TRP HE3 H 2.490 -0.508 -8.272 1.00 . A A . 28 TRP HE3 1 1 14 6479 1 1 28 TRP HH2 H -1.022 0.245 -10.633 1.00 . A A . 28 TRP HH2 1 1 14 6480 1 1 28 TRP HZ2 H -2.265 0.880 -8.580 1.00 . A A . 28 TRP HZ2 1 1 14 6481 1 1 28 TRP HZ3 H 1.354 -0.447 -10.474 1.00 . A A . 28 TRP HZ3 1 1 14 6482 1 1 28 TRP N N 1.917 -2.382 -4.545 1.00 . A A . 28 TRP N 1 1 14 6483 1 1 28 TRP NE1 N -0.971 0.822 -5.990 1.00 . A A . 28 TRP NE1 1 1 14 6484 1 1 28 TRP O O 0.415 -1.093 -2.655 1.00 . A A . 28 TRP O 1 1 14 6485 1 1 29 CYS C C 0.004 1.885 -1.547 1.00 . A A . 29 CYS C 1 1 14 6486 1 1 29 CYS CA C 1.112 0.966 -1.017 1.00 . A A . 29 CYS CA 1 1 14 6487 1 1 29 CYS CB C 2.098 1.759 -0.154 1.00 . A A . 29 CYS CB 1 1 14 6488 1 1 29 CYS H H 2.819 0.804 -2.328 1.00 . A A . 29 CYS H 1 1 14 6489 1 1 29 CYS HA H 0.689 0.160 -0.441 1.00 . A A . 29 CYS HA 1 1 14 6490 1 1 29 CYS HB2 H 3.099 1.397 -0.328 1.00 . A A . 29 CYS HB2 1 1 14 6491 1 1 29 CYS HB3 H 2.042 2.804 -0.415 1.00 . A A . 29 CYS HB3 1 1 14 6492 1 1 29 CYS N N 1.937 0.420 -2.141 1.00 . A A . 29 CYS N 1 1 14 6493 1 1 29 CYS O O 0.147 2.519 -2.572 1.00 . A A . 29 CYS O 1 1 14 6494 1 1 29 CYS SG S 1.688 1.555 1.597 1.00 . A A . 29 CYS SG 1 1 14 6495 1 1 30 VAL C C -2.994 3.324 -0.028 1.00 . A A . 30 VAL C 1 1 14 6496 1 1 30 VAL CA C -2.240 2.829 -1.267 1.00 . A A . 30 VAL CA 1 1 14 6497 1 1 30 VAL CB C -3.158 1.938 -2.116 1.00 . A A . 30 VAL CB 1 1 14 6498 1 1 30 VAL CG1 C -2.499 1.650 -3.465 1.00 . A A . 30 VAL CG1 1 1 14 6499 1 1 30 VAL CG2 C -3.425 0.615 -1.385 1.00 . A A . 30 VAL CG2 1 1 14 6500 1 1 30 VAL H H -1.175 1.435 -0.017 1.00 . A A . 30 VAL H 1 1 14 6501 1 1 30 VAL HA H -1.885 3.662 -1.852 1.00 . A A . 30 VAL HA 1 1 14 6502 1 1 30 VAL HB H -4.095 2.451 -2.282 1.00 . A A . 30 VAL HB 1 1 14 6503 1 1 30 VAL HG11 H -1.868 0.778 -3.378 1.00 . A A . 30 VAL HG11 1 1 14 6504 1 1 30 VAL HG12 H -1.902 2.499 -3.764 1.00 . A A . 30 VAL HG12 1 1 14 6505 1 1 30 VAL HG13 H -3.263 1.469 -4.205 1.00 . A A . 30 VAL HG13 1 1 14 6506 1 1 30 VAL HG21 H -4.360 0.196 -1.727 1.00 . A A . 30 VAL HG21 1 1 14 6507 1 1 30 VAL HG22 H -3.479 0.796 -0.321 1.00 . A A . 30 VAL HG22 1 1 14 6508 1 1 30 VAL HG23 H -2.623 -0.079 -1.592 1.00 . A A . 30 VAL HG23 1 1 14 6509 1 1 30 VAL N N -1.097 1.956 -0.842 1.00 . A A . 30 VAL N 1 1 14 6510 1 1 30 VAL O O -2.734 2.885 1.072 1.00 . A A . 30 VAL O 1 1 14 6511 1 1 31 TYR C C -5.592 3.598 1.539 1.00 . A A . 31 TYR C 1 1 14 6512 1 1 31 TYR CA C -4.696 4.715 0.994 1.00 . A A . 31 TYR CA 1 1 14 6513 1 1 31 TYR CB C -5.539 5.889 0.485 1.00 . A A . 31 TYR CB 1 1 14 6514 1 1 31 TYR CD1 C -5.152 7.282 2.552 1.00 . A A . 31 TYR CD1 1 1 14 6515 1 1 31 TYR CD2 C -7.432 6.823 1.867 1.00 . A A . 31 TYR CD2 1 1 14 6516 1 1 31 TYR CE1 C -5.627 8.018 3.643 1.00 . A A . 31 TYR CE1 1 1 14 6517 1 1 31 TYR CE2 C -7.908 7.558 2.958 1.00 . A A . 31 TYR CE2 1 1 14 6518 1 1 31 TYR CG C -6.054 6.683 1.663 1.00 . A A . 31 TYR CG 1 1 14 6519 1 1 31 TYR CZ C -7.006 8.157 3.846 1.00 . A A . 31 TYR CZ 1 1 14 6520 1 1 31 TYR H H -4.138 4.559 -1.090 1.00 . A A . 31 TYR H 1 1 14 6521 1 1 31 TYR HA H -4.015 5.056 1.759 1.00 . A A . 31 TYR HA 1 1 14 6522 1 1 31 TYR HB2 H -4.929 6.525 -0.141 1.00 . A A . 31 TYR HB2 1 1 14 6523 1 1 31 TYR HB3 H -6.373 5.511 -0.088 1.00 . A A . 31 TYR HB3 1 1 14 6524 1 1 31 TYR HD1 H -4.089 7.175 2.397 1.00 . A A . 31 TYR HD1 1 1 14 6525 1 1 31 TYR HD2 H -8.129 6.362 1.182 1.00 . A A . 31 TYR HD2 1 1 14 6526 1 1 31 TYR HE1 H -4.931 8.478 4.329 1.00 . A A . 31 TYR HE1 1 1 14 6527 1 1 31 TYR HE2 H -8.971 7.666 3.115 1.00 . A A . 31 TYR HE2 1 1 14 6528 1 1 31 TYR HH H -7.325 9.817 4.735 1.00 . A A . 31 TYR HH 1 1 14 6529 1 1 31 TYR N N -3.932 4.220 -0.193 1.00 . A A . 31 TYR N 1 1 14 6530 1 1 31 TYR O O -6.252 2.901 0.790 1.00 . A A . 31 TYR O 1 1 14 6531 1 1 31 TYR OH O -7.475 8.885 4.920 1.00 . A A . 31 TYR OH 1 1 14 6532 1 1 32 ALA C C -7.866 2.874 3.731 1.00 . A A . 32 ALA C 1 1 14 6533 1 1 32 ALA CA C -6.463 2.338 3.428 1.00 . A A . 32 ALA CA 1 1 14 6534 1 1 32 ALA CB C -5.748 1.927 4.718 1.00 . A A . 32 ALA CB 1 1 14 6535 1 1 32 ALA H H -5.071 3.988 3.420 1.00 . A A . 32 ALA H 1 1 14 6536 1 1 32 ALA HA H -6.521 1.496 2.756 1.00 . A A . 32 ALA HA 1 1 14 6537 1 1 32 ALA HB1 H -5.748 2.756 5.410 1.00 . A A . 32 ALA HB1 1 1 14 6538 1 1 32 ALA HB2 H -4.729 1.647 4.492 1.00 . A A . 32 ALA HB2 1 1 14 6539 1 1 32 ALA HB3 H -6.261 1.087 5.163 1.00 . A A . 32 ALA HB3 1 1 14 6540 1 1 32 ALA N N -5.616 3.417 2.836 1.00 . A A . 32 ALA N 1 1 14 6541 1 1 32 ALA O O -8.073 3.597 4.689 1.00 . A A . 32 ALA O 1 1 14 6542 1 1 33 ARG C C -11.237 1.891 2.848 1.00 . A A . 33 ARG C 1 1 14 6543 1 1 33 ARG CA C -10.226 3.010 3.140 1.00 . A A . 33 ARG CA 1 1 14 6544 1 1 33 ARG CB C -10.411 4.178 2.162 1.00 . A A . 33 ARG CB 1 1 14 6545 1 1 33 ARG CD C -11.198 4.275 -0.213 1.00 . A A . 33 ARG CD 1 1 14 6546 1 1 33 ARG CG C -10.127 3.716 0.727 1.00 . A A . 33 ARG CG 1 1 14 6547 1 1 33 ARG CZ C -11.804 2.636 -1.895 1.00 . A A . 33 ARG CZ 1 1 14 6548 1 1 33 ARG H H -8.633 1.945 2.148 1.00 . A A . 33 ARG H 1 1 14 6549 1 1 33 ARG HA H -10.340 3.362 4.154 1.00 . A A . 33 ARG HA 1 1 14 6550 1 1 33 ARG HB2 H -11.426 4.542 2.227 1.00 . A A . 33 ARG HB2 1 1 14 6551 1 1 33 ARG HB3 H -9.728 4.974 2.420 1.00 . A A . 33 ARG HB3 1 1 14 6552 1 1 33 ARG HD2 H -12.185 4.059 0.173 1.00 . A A . 33 ARG HD2 1 1 14 6553 1 1 33 ARG HD3 H -11.068 5.339 -0.342 1.00 . A A . 33 ARG HD3 1 1 14 6554 1 1 33 ARG HE H -10.214 3.816 -2.074 1.00 . A A . 33 ARG HE 1 1 14 6555 1 1 33 ARG HG2 H -9.155 4.074 0.419 1.00 . A A . 33 ARG HG2 1 1 14 6556 1 1 33 ARG HG3 H -10.142 2.637 0.684 1.00 . A A . 33 ARG HG3 1 1 14 6557 1 1 33 ARG HH11 H -13.061 3.903 -2.809 1.00 . A A . 33 ARG HH11 1 1 14 6558 1 1 33 ARG HH12 H -13.506 2.231 -2.876 1.00 . A A . 33 ARG HH12 1 1 14 6559 1 1 33 ARG HH21 H -10.738 1.148 -1.074 1.00 . A A . 33 ARG HH21 1 1 14 6560 1 1 33 ARG HH22 H -12.187 0.668 -1.890 1.00 . A A . 33 ARG HH22 1 1 14 6561 1 1 33 ARG N N -8.829 2.526 2.915 1.00 . A A . 33 ARG N 1 1 14 6562 1 1 33 ARG NE N -10.978 3.574 -1.510 1.00 . A A . 33 ARG NE 1 1 14 6563 1 1 33 ARG NH1 N -12.874 2.947 -2.580 1.00 . A A . 33 ARG NH1 1 1 14 6564 1 1 33 ARG NH2 N -11.557 1.386 -1.596 1.00 . A A . 33 ARG NH2 1 1 14 6565 1 1 33 ARG O O -10.928 0.945 2.148 1.00 . A A . 33 ARG O 1 1 14 6566 1 1 34 PRO C C -14.029 1.092 1.755 1.00 . A A . 34 PRO C 1 1 14 6567 1 1 34 PRO CA C -13.490 1.025 3.192 1.00 . A A . 34 PRO CA 1 1 14 6568 1 1 34 PRO CB C -14.564 1.424 4.203 1.00 . A A . 34 PRO CB 1 1 14 6569 1 1 34 PRO CD C -12.871 3.144 4.255 1.00 . A A . 34 PRO CD 1 1 14 6570 1 1 34 PRO CG C -14.343 2.883 4.446 1.00 . A A . 34 PRO CG 1 1 14 6571 1 1 34 PRO HA H -13.124 0.036 3.416 1.00 . A A . 34 PRO HA 1 1 14 6572 1 1 34 PRO HB2 H -15.549 1.254 3.790 1.00 . A A . 34 PRO HB2 1 1 14 6573 1 1 34 PRO HB3 H -14.440 0.874 5.122 1.00 . A A . 34 PRO HB3 1 1 14 6574 1 1 34 PRO HD2 H -12.718 4.094 3.764 1.00 . A A . 34 PRO HD2 1 1 14 6575 1 1 34 PRO HD3 H -12.355 3.115 5.201 1.00 . A A . 34 PRO HD3 1 1 14 6576 1 1 34 PRO HG2 H -14.919 3.465 3.739 1.00 . A A . 34 PRO HG2 1 1 14 6577 1 1 34 PRO HG3 H -14.629 3.137 5.455 1.00 . A A . 34 PRO HG3 1 1 14 6578 1 1 34 PRO N N -12.421 2.037 3.398 1.00 . A A . 34 PRO N 1 1 14 6579 1 1 34 PRO O O -14.186 0.041 1.155 1.00 . A A . 34 PRO O 1 1 14 6580 1 1 34 PRO OXT O -14.274 2.191 1.280 1.00 . A A . 34 PRO OXT 1 1 15 6581 1 1 1 GLY C C 9.187 4.493 5.295 1.00 . A A . 1 GLY C 1 1 15 6582 1 1 1 GLY CA C 10.695 4.323 5.503 1.00 . A A . 1 GLY CA 1 1 15 6583 1 1 1 GLY H1 H 11.438 5.907 4.368 1.00 . A A . 1 GLY H1 1 1 15 6584 1 1 1 GLY H2 H 10.956 4.563 3.447 1.00 . A A . 1 GLY H2 1 1 15 6585 1 1 1 GLY H3 H 12.407 4.516 4.330 1.00 . A A . 1 GLY H3 1 1 15 6586 1 1 1 GLY HA2 H 10.928 3.274 5.618 1.00 . A A . 1 GLY HA2 1 1 15 6587 1 1 1 GLY HA3 H 10.993 4.859 6.392 1.00 . A A . 1 GLY HA3 1 1 15 6588 1 1 1 GLY N N 11.430 4.868 4.323 1.00 . A A . 1 GLY N 1 1 15 6589 1 1 1 GLY O O 8.445 3.528 5.260 1.00 . A A . 1 GLY O 1 1 15 6590 1 1 2 CYS C C 6.882 5.600 3.498 1.00 . A A . 2 CYS C 1 1 15 6591 1 1 2 CYS CA C 7.270 5.953 4.939 1.00 . A A . 2 CYS CA 1 1 15 6592 1 1 2 CYS CB C 7.069 7.449 5.197 1.00 . A A . 2 CYS CB 1 1 15 6593 1 1 2 CYS H H 9.351 6.472 5.178 1.00 . A A . 2 CYS H 1 1 15 6594 1 1 2 CYS HA H 6.688 5.375 5.640 1.00 . A A . 2 CYS HA 1 1 15 6595 1 1 2 CYS HB2 H 7.922 7.841 5.729 1.00 . A A . 2 CYS HB2 1 1 15 6596 1 1 2 CYS HB3 H 6.960 7.965 4.256 1.00 . A A . 2 CYS HB3 1 1 15 6597 1 1 2 CYS N N 8.731 5.713 5.150 1.00 . A A . 2 CYS N 1 1 15 6598 1 1 2 CYS O O 7.605 5.894 2.562 1.00 . A A . 2 CYS O 1 1 15 6599 1 1 2 CYS SG S 5.582 7.699 6.190 1.00 . A A . 2 CYS SG 1 1 15 6600 1 1 3 GLY C C 4.499 5.745 1.327 1.00 . A A . 3 GLY C 1 1 15 6601 1 1 3 GLY CA C 5.307 4.597 1.938 1.00 . A A . 3 GLY CA 1 1 15 6602 1 1 3 GLY H H 5.184 4.748 4.083 1.00 . A A . 3 GLY H 1 1 15 6603 1 1 3 GLY HA2 H 6.175 4.400 1.323 1.00 . A A . 3 GLY HA2 1 1 15 6604 1 1 3 GLY HA3 H 4.691 3.712 1.983 1.00 . A A . 3 GLY HA3 1 1 15 6605 1 1 3 GLY N N 5.748 4.972 3.314 1.00 . A A . 3 GLY N 1 1 15 6606 1 1 3 GLY O O 4.865 6.901 1.439 1.00 . A A . 3 GLY O 1 1 15 6607 1 1 4 GLY C C 1.401 5.891 -0.710 1.00 . A A . 4 GLY C 1 1 15 6608 1 1 4 GLY CA C 2.572 6.510 0.060 1.00 . A A . 4 GLY CA 1 1 15 6609 1 1 4 GLY H H 3.129 4.497 0.601 1.00 . A A . 4 GLY H 1 1 15 6610 1 1 4 GLY HA2 H 2.190 7.158 0.835 1.00 . A A . 4 GLY HA2 1 1 15 6611 1 1 4 GLY HA3 H 3.180 7.086 -0.621 1.00 . A A . 4 GLY HA3 1 1 15 6612 1 1 4 GLY N N 3.403 5.436 0.679 1.00 . A A . 4 GLY N 1 1 15 6613 1 1 4 GLY O O 0.804 4.920 -0.279 1.00 . A A . 4 GLY O 1 1 15 6614 1 1 5 LEU C C 0.435 4.921 -3.720 1.00 . A A . 5 LEU C 1 1 15 6615 1 1 5 LEU CA C -0.068 5.912 -2.657 1.00 . A A . 5 LEU CA 1 1 15 6616 1 1 5 LEU CB C -0.705 7.137 -3.319 1.00 . A A . 5 LEU CB 1 1 15 6617 1 1 5 LEU CD1 C -2.760 8.559 -3.277 1.00 . A A . 5 LEU CD1 1 1 15 6618 1 1 5 LEU CD2 C -2.923 6.138 -3.883 1.00 . A A . 5 LEU CD2 1 1 15 6619 1 1 5 LEU CG C -2.201 7.162 -3.004 1.00 . A A . 5 LEU CG 1 1 15 6620 1 1 5 LEU H H 1.565 7.236 -2.166 1.00 . A A . 5 LEU H 1 1 15 6621 1 1 5 LEU HA H -0.788 5.431 -2.014 1.00 . A A . 5 LEU HA 1 1 15 6622 1 1 5 LEU HB2 H -0.241 8.036 -2.938 1.00 . A A . 5 LEU HB2 1 1 15 6623 1 1 5 LEU HB3 H -0.565 7.084 -4.389 1.00 . A A . 5 LEU HB3 1 1 15 6624 1 1 5 LEU HD11 H -3.669 8.699 -2.712 1.00 . A A . 5 LEU HD11 1 1 15 6625 1 1 5 LEU HD12 H -2.972 8.663 -4.331 1.00 . A A . 5 LEU HD12 1 1 15 6626 1 1 5 LEU HD13 H -2.035 9.302 -2.981 1.00 . A A . 5 LEU HD13 1 1 15 6627 1 1 5 LEU HD21 H -3.159 5.263 -3.296 1.00 . A A . 5 LEU HD21 1 1 15 6628 1 1 5 LEU HD22 H -2.284 5.855 -4.708 1.00 . A A . 5 LEU HD22 1 1 15 6629 1 1 5 LEU HD23 H -3.835 6.570 -4.268 1.00 . A A . 5 LEU HD23 1 1 15 6630 1 1 5 LEU HG H -2.352 6.914 -1.963 1.00 . A A . 5 LEU HG 1 1 15 6631 1 1 5 LEU N N 1.067 6.454 -1.845 1.00 . A A . 5 LEU N 1 1 15 6632 1 1 5 LEU O O -0.346 4.204 -4.320 1.00 . A A . 5 LEU O 1 1 15 6633 1 1 6 MET C C 3.694 3.475 -4.568 1.00 . A A . 6 MET C 1 1 15 6634 1 1 6 MET CA C 2.273 3.907 -4.962 1.00 . A A . 6 MET CA 1 1 15 6635 1 1 6 MET CB C 2.290 4.683 -6.284 1.00 . A A . 6 MET CB 1 1 15 6636 1 1 6 MET CE C -0.517 3.920 -9.166 1.00 . A A . 6 MET CE 1 1 15 6637 1 1 6 MET CG C 0.921 4.580 -6.962 1.00 . A A . 6 MET CG 1 1 15 6638 1 1 6 MET H H 2.339 5.441 -3.451 1.00 . A A . 6 MET H 1 1 15 6639 1 1 6 MET HA H 1.631 3.045 -5.048 1.00 . A A . 6 MET HA 1 1 15 6640 1 1 6 MET HB2 H 2.519 5.721 -6.089 1.00 . A A . 6 MET HB2 1 1 15 6641 1 1 6 MET HB3 H 3.042 4.264 -6.936 1.00 . A A . 6 MET HB3 1 1 15 6642 1 1 6 MET HE1 H -0.521 3.539 -10.178 1.00 . A A . 6 MET HE1 1 1 15 6643 1 1 6 MET HE2 H -1.223 4.730 -9.086 1.00 . A A . 6 MET HE2 1 1 15 6644 1 1 6 MET HE3 H -0.795 3.133 -8.478 1.00 . A A . 6 MET HE3 1 1 15 6645 1 1 6 MET HG2 H 0.420 3.683 -6.630 1.00 . A A . 6 MET HG2 1 1 15 6646 1 1 6 MET HG3 H 0.325 5.443 -6.702 1.00 . A A . 6 MET HG3 1 1 15 6647 1 1 6 MET N N 1.726 4.863 -3.950 1.00 . A A . 6 MET N 1 1 15 6648 1 1 6 MET O O 4.531 3.216 -5.413 1.00 . A A . 6 MET O 1 1 15 6649 1 1 6 MET SD S 1.140 4.518 -8.757 1.00 . A A . 6 MET SD 1 1 15 6650 1 1 7 ALA C C 5.525 1.470 -3.037 1.00 . A A . 7 ALA C 1 1 15 6651 1 1 7 ALA CA C 5.336 2.977 -2.831 1.00 . A A . 7 ALA CA 1 1 15 6652 1 1 7 ALA CB C 5.390 3.327 -1.341 1.00 . A A . 7 ALA CB 1 1 15 6653 1 1 7 ALA H H 3.280 3.604 -2.624 1.00 . A A . 7 ALA H 1 1 15 6654 1 1 7 ALA HA H 6.094 3.527 -3.367 1.00 . A A . 7 ALA HA 1 1 15 6655 1 1 7 ALA HB1 H 6.089 4.135 -1.187 1.00 . A A . 7 ALA HB1 1 1 15 6656 1 1 7 ALA HB2 H 5.711 2.462 -0.779 1.00 . A A . 7 ALA HB2 1 1 15 6657 1 1 7 ALA HB3 H 4.409 3.630 -1.006 1.00 . A A . 7 ALA HB3 1 1 15 6658 1 1 7 ALA N N 3.971 3.393 -3.286 1.00 . A A . 7 ALA N 1 1 15 6659 1 1 7 ALA O O 4.591 0.702 -2.931 1.00 . A A . 7 ALA O 1 1 15 6660 1 1 8 GLY C C 6.709 -1.182 -2.242 1.00 . A A . 8 GLY C 1 1 15 6661 1 1 8 GLY CA C 6.985 -0.415 -3.539 1.00 . A A . 8 GLY CA 1 1 15 6662 1 1 8 GLY H H 7.470 1.682 -3.404 1.00 . A A . 8 GLY H 1 1 15 6663 1 1 8 GLY HA2 H 6.334 -0.783 -4.321 1.00 . A A . 8 GLY HA2 1 1 15 6664 1 1 8 GLY HA3 H 8.014 -0.564 -3.828 1.00 . A A . 8 GLY HA3 1 1 15 6665 1 1 8 GLY N N 6.731 1.043 -3.326 1.00 . A A . 8 GLY N 1 1 15 6666 1 1 8 GLY O O 7.287 -0.898 -1.210 1.00 . A A . 8 GLY O 1 1 15 6667 1 1 9 CYS C C 6.428 -4.163 -0.967 1.00 . A A . 9 CYS C 1 1 15 6668 1 1 9 CYS CA C 5.508 -2.942 -1.062 1.00 . A A . 9 CYS CA 1 1 15 6669 1 1 9 CYS CB C 4.046 -3.368 -1.231 1.00 . A A . 9 CYS CB 1 1 15 6670 1 1 9 CYS H H 5.377 -2.359 -3.135 1.00 . A A . 9 CYS H 1 1 15 6671 1 1 9 CYS HA H 5.611 -2.329 -0.185 1.00 . A A . 9 CYS HA 1 1 15 6672 1 1 9 CYS HB2 H 3.406 -2.502 -1.147 1.00 . A A . 9 CYS HB2 1 1 15 6673 1 1 9 CYS HB3 H 3.913 -3.820 -2.203 1.00 . A A . 9 CYS HB3 1 1 15 6674 1 1 9 CYS N N 5.828 -2.151 -2.289 1.00 . A A . 9 CYS N 1 1 15 6675 1 1 9 CYS O O 7.309 -4.215 -0.131 1.00 . A A . 9 CYS O 1 1 15 6676 1 1 9 CYS SG S 3.609 -4.565 0.055 1.00 . A A . 9 CYS SG 1 1 15 6677 1 1 10 ASP C C 6.946 -7.115 -0.472 1.00 . A A . 10 ASP C 1 1 15 6678 1 1 10 ASP CA C 7.077 -6.374 -1.812 1.00 . A A . 10 ASP CA 1 1 15 6679 1 1 10 ASP CB C 8.514 -5.880 -2.026 1.00 . A A . 10 ASP CB 1 1 15 6680 1 1 10 ASP CG C 9.361 -7.007 -2.619 1.00 . A A . 10 ASP CG 1 1 15 6681 1 1 10 ASP H H 5.509 -5.057 -2.484 1.00 . A A . 10 ASP H 1 1 15 6682 1 1 10 ASP HA H 6.793 -7.025 -2.624 1.00 . A A . 10 ASP HA 1 1 15 6683 1 1 10 ASP HB2 H 8.507 -5.038 -2.704 1.00 . A A . 10 ASP HB2 1 1 15 6684 1 1 10 ASP HB3 H 8.936 -5.575 -1.080 1.00 . A A . 10 ASP HB3 1 1 15 6685 1 1 10 ASP N N 6.226 -5.139 -1.823 1.00 . A A . 10 ASP N 1 1 15 6686 1 1 10 ASP O O 7.567 -6.758 0.512 1.00 . A A . 10 ASP O 1 1 15 6687 1 1 10 ASP OD1 O 9.400 -7.117 -3.834 1.00 . A A . 10 ASP OD1 1 1 15 6688 1 1 10 ASP OD2 O 9.958 -7.741 -1.849 1.00 . A A . 10 ASP OD2 1 1 15 6689 1 1 11 GLY C C 4.482 -9.052 1.195 1.00 . A A . 11 GLY C 1 1 15 6690 1 1 11 GLY CA C 5.971 -8.923 0.837 1.00 . A A . 11 GLY CA 1 1 15 6691 1 1 11 GLY H H 5.658 -8.426 -1.238 1.00 . A A . 11 GLY H 1 1 15 6692 1 1 11 GLY HA2 H 6.396 -9.909 0.715 1.00 . A A . 11 GLY HA2 1 1 15 6693 1 1 11 GLY HA3 H 6.483 -8.412 1.639 1.00 . A A . 11 GLY HA3 1 1 15 6694 1 1 11 GLY N N 6.144 -8.152 -0.432 1.00 . A A . 11 GLY N 1 1 15 6695 1 1 11 GLY O O 4.122 -9.816 2.072 1.00 . A A . 11 GLY O 1 1 15 6696 1 1 12 LYS C C 1.869 -8.007 2.296 1.00 . A A . 12 LYS C 1 1 15 6697 1 1 12 LYS CA C 2.144 -8.389 0.832 1.00 . A A . 12 LYS CA 1 1 15 6698 1 1 12 LYS CB C 1.736 -9.848 0.577 1.00 . A A . 12 LYS CB 1 1 15 6699 1 1 12 LYS CD C 1.911 -11.803 -0.990 1.00 . A A . 12 LYS CD 1 1 15 6700 1 1 12 LYS CE C 2.339 -12.674 0.203 1.00 . A A . 12 LYS CE 1 1 15 6701 1 1 12 LYS CG C 2.314 -10.340 -0.757 1.00 . A A . 12 LYS CG 1 1 15 6702 1 1 12 LYS H H 3.928 -7.706 -0.165 1.00 . A A . 12 LYS H 1 1 15 6703 1 1 12 LYS HA H 1.597 -7.737 0.169 1.00 . A A . 12 LYS HA 1 1 15 6704 1 1 12 LYS HB2 H 2.109 -10.467 1.378 1.00 . A A . 12 LYS HB2 1 1 15 6705 1 1 12 LYS HB3 H 0.660 -9.916 0.544 1.00 . A A . 12 LYS HB3 1 1 15 6706 1 1 12 LYS HD2 H 0.839 -11.862 -1.109 1.00 . A A . 12 LYS HD2 1 1 15 6707 1 1 12 LYS HD3 H 2.391 -12.166 -1.886 1.00 . A A . 12 LYS HD3 1 1 15 6708 1 1 12 LYS HE2 H 1.839 -12.346 1.104 1.00 . A A . 12 LYS HE2 1 1 15 6709 1 1 12 LYS HE3 H 2.111 -13.710 0.006 1.00 . A A . 12 LYS HE3 1 1 15 6710 1 1 12 LYS HG2 H 1.932 -9.729 -1.561 1.00 . A A . 12 LYS HG2 1 1 15 6711 1 1 12 LYS HG3 H 3.391 -10.266 -0.732 1.00 . A A . 12 LYS HG3 1 1 15 6712 1 1 12 LYS HZ1 H 4.016 -11.591 0.806 1.00 . A A . 12 LYS HZ1 1 1 15 6713 1 1 12 LYS HZ2 H 4.253 -12.497 -0.612 1.00 . A A . 12 LYS HZ2 1 1 15 6714 1 1 12 LYS HZ3 H 4.210 -13.272 0.899 1.00 . A A . 12 LYS HZ3 1 1 15 6715 1 1 12 LYS N N 3.614 -8.315 0.530 1.00 . A A . 12 LYS N 1 1 15 6716 1 1 12 LYS NZ N 3.816 -12.495 0.332 1.00 . A A . 12 LYS NZ 1 1 15 6717 1 1 12 LYS O O 0.835 -8.339 2.846 1.00 . A A . 12 LYS O 1 1 15 6718 1 1 13 SER C C 3.682 -5.920 4.781 1.00 . A A . 13 SER C 1 1 15 6719 1 1 13 SER CA C 2.590 -6.916 4.357 1.00 . A A . 13 SER CA 1 1 15 6720 1 1 13 SER CB C 2.708 -8.221 5.151 1.00 . A A . 13 SER CB 1 1 15 6721 1 1 13 SER H H 3.612 -7.061 2.465 1.00 . A A . 13 SER H 1 1 15 6722 1 1 13 SER HA H 1.611 -6.485 4.496 1.00 . A A . 13 SER HA 1 1 15 6723 1 1 13 SER HB2 H 2.322 -9.039 4.564 1.00 . A A . 13 SER HB2 1 1 15 6724 1 1 13 SER HB3 H 3.749 -8.409 5.381 1.00 . A A . 13 SER HB3 1 1 15 6725 1 1 13 SER HG H 1.154 -8.630 6.248 1.00 . A A . 13 SER HG 1 1 15 6726 1 1 13 SER N N 2.788 -7.315 2.929 1.00 . A A . 13 SER N 1 1 15 6727 1 1 13 SER O O 4.272 -6.043 5.839 1.00 . A A . 13 SER O 1 1 15 6728 1 1 13 SER OG O 1.956 -8.112 6.352 1.00 . A A . 13 SER OG 1 1 15 6729 1 1 14 THR C C 4.446 -2.846 5.229 1.00 . A A . 14 THR C 1 1 15 6730 1 1 14 THR CA C 5.007 -3.932 4.299 1.00 . A A . 14 THR CA 1 1 15 6731 1 1 14 THR CB C 5.430 -3.332 2.950 1.00 . A A . 14 THR CB 1 1 15 6732 1 1 14 THR CG2 C 4.351 -2.372 2.436 1.00 . A A . 14 THR CG2 1 1 15 6733 1 1 14 THR H H 3.464 -4.863 3.112 1.00 . A A . 14 THR H 1 1 15 6734 1 1 14 THR HA H 5.850 -4.419 4.761 1.00 . A A . 14 THR HA 1 1 15 6735 1 1 14 THR HB H 5.565 -4.128 2.232 1.00 . A A . 14 THR HB 1 1 15 6736 1 1 14 THR HG1 H 7.187 -2.778 2.325 1.00 . A A . 14 THR HG1 1 1 15 6737 1 1 14 THR HG21 H 3.374 -2.783 2.644 1.00 . A A . 14 THR HG21 1 1 15 6738 1 1 14 THR HG22 H 4.466 -2.239 1.371 1.00 . A A . 14 THR HG22 1 1 15 6739 1 1 14 THR HG23 H 4.452 -1.418 2.932 1.00 . A A . 14 THR HG23 1 1 15 6740 1 1 14 THR N N 3.952 -4.938 3.958 1.00 . A A . 14 THR N 1 1 15 6741 1 1 14 THR O O 3.247 -2.706 5.386 1.00 . A A . 14 THR O 1 1 15 6742 1 1 14 THR OG1 O 6.653 -2.629 3.110 1.00 . A A . 14 THR OG1 1 1 15 6743 1 1 15 PHE C C 5.004 0.370 6.074 1.00 . A A . 15 PHE C 1 1 15 6744 1 1 15 PHE CA C 4.841 -0.992 6.756 1.00 . A A . 15 PHE CA 1 1 15 6745 1 1 15 PHE CB C 5.740 -1.098 7.994 1.00 . A A . 15 PHE CB 1 1 15 6746 1 1 15 PHE CD1 C 3.999 -2.538 9.124 1.00 . A A . 15 PHE CD1 1 1 15 6747 1 1 15 PHE CD2 C 5.029 -0.741 10.387 1.00 . A A . 15 PHE CD2 1 1 15 6748 1 1 15 PHE CE1 C 3.226 -2.878 10.239 1.00 . A A . 15 PHE CE1 1 1 15 6749 1 1 15 PHE CE2 C 4.255 -1.083 11.503 1.00 . A A . 15 PHE CE2 1 1 15 6750 1 1 15 PHE CG C 4.902 -1.468 9.198 1.00 . A A . 15 PHE CG 1 1 15 6751 1 1 15 PHE CZ C 3.353 -2.151 11.429 1.00 . A A . 15 PHE CZ 1 1 15 6752 1 1 15 PHE H H 6.272 -2.205 5.693 1.00 . A A . 15 PHE H 1 1 15 6753 1 1 15 PHE HA H 3.811 -1.154 7.032 1.00 . A A . 15 PHE HA 1 1 15 6754 1 1 15 PHE HB2 H 6.489 -1.859 7.831 1.00 . A A . 15 PHE HB2 1 1 15 6755 1 1 15 PHE HB3 H 6.223 -0.148 8.172 1.00 . A A . 15 PHE HB3 1 1 15 6756 1 1 15 PHE HD1 H 3.901 -3.099 8.207 1.00 . A A . 15 PHE HD1 1 1 15 6757 1 1 15 PHE HD2 H 5.725 0.083 10.445 1.00 . A A . 15 PHE HD2 1 1 15 6758 1 1 15 PHE HE1 H 2.529 -3.703 10.181 1.00 . A A . 15 PHE HE1 1 1 15 6759 1 1 15 PHE HE2 H 4.353 -0.521 12.421 1.00 . A A . 15 PHE HE2 1 1 15 6760 1 1 15 PHE HZ H 2.755 -2.414 12.289 1.00 . A A . 15 PHE HZ 1 1 15 6761 1 1 15 PHE N N 5.311 -2.075 5.840 1.00 . A A . 15 PHE N 1 1 15 6762 1 1 15 PHE O O 6.099 0.883 5.941 1.00 . A A . 15 PHE O 1 1 15 6763 1 1 16 CYS C C 3.959 3.415 5.977 1.00 . A A . 16 CYS C 1 1 15 6764 1 1 16 CYS CA C 3.992 2.277 4.945 1.00 . A A . 16 CYS CA 1 1 15 6765 1 1 16 CYS CB C 2.757 2.316 4.037 1.00 . A A . 16 CYS CB 1 1 15 6766 1 1 16 CYS H H 3.048 0.510 5.747 1.00 . A A . 16 CYS H 1 1 15 6767 1 1 16 CYS HA H 4.887 2.339 4.347 1.00 . A A . 16 CYS HA 1 1 15 6768 1 1 16 CYS HB2 H 1.865 2.246 4.641 1.00 . A A . 16 CYS HB2 1 1 15 6769 1 1 16 CYS HB3 H 2.747 3.243 3.483 1.00 . A A . 16 CYS HB3 1 1 15 6770 1 1 16 CYS N N 3.917 0.951 5.632 1.00 . A A . 16 CYS N 1 1 15 6771 1 1 16 CYS O O 4.545 3.309 7.039 1.00 . A A . 16 CYS O 1 1 15 6772 1 1 16 CYS SG S 2.808 0.927 2.878 1.00 . A A . 16 CYS SG 1 1 15 6773 1 1 17 CYS C C 2.255 5.307 7.788 1.00 . A A . 17 CYS C 1 1 15 6774 1 1 17 CYS CA C 3.222 5.641 6.641 1.00 . A A . 17 CYS CA 1 1 15 6775 1 1 17 CYS CB C 2.717 6.832 5.815 1.00 . A A . 17 CYS CB 1 1 15 6776 1 1 17 CYS H H 2.824 4.570 4.816 1.00 . A A . 17 CYS H 1 1 15 6777 1 1 17 CYS HA H 4.205 5.855 7.031 1.00 . A A . 17 CYS HA 1 1 15 6778 1 1 17 CYS HB2 H 1.939 6.499 5.144 1.00 . A A . 17 CYS HB2 1 1 15 6779 1 1 17 CYS HB3 H 2.320 7.587 6.479 1.00 . A A . 17 CYS HB3 1 1 15 6780 1 1 17 CYS N N 3.286 4.502 5.676 1.00 . A A . 17 CYS N 1 1 15 6781 1 1 17 CYS O O 2.600 4.582 8.701 1.00 . A A . 17 CYS O 1 1 15 6782 1 1 17 CYS SG S 4.078 7.531 4.855 1.00 . A A . 17 CYS SG 1 1 15 6783 1 1 18 SER C C -1.351 5.461 8.250 1.00 . A A . 18 SER C 1 1 15 6784 1 1 18 SER CA C 0.067 5.538 8.835 1.00 . A A . 18 SER CA 1 1 15 6785 1 1 18 SER CB C 0.193 6.715 9.805 1.00 . A A . 18 SER CB 1 1 15 6786 1 1 18 SER H H 0.796 6.408 7.003 1.00 . A A . 18 SER H 1 1 15 6787 1 1 18 SER HA H 0.318 4.617 9.337 1.00 . A A . 18 SER HA 1 1 15 6788 1 1 18 SER HB2 H 0.310 7.631 9.250 1.00 . A A . 18 SER HB2 1 1 15 6789 1 1 18 SER HB3 H -0.699 6.777 10.413 1.00 . A A . 18 SER HB3 1 1 15 6790 1 1 18 SER HG H 1.057 6.040 11.414 1.00 . A A . 18 SER HG 1 1 15 6791 1 1 18 SER N N 1.052 5.827 7.748 1.00 . A A . 18 SER N 1 1 15 6792 1 1 18 SER O O -2.211 6.262 8.568 1.00 . A A . 18 SER O 1 1 15 6793 1 1 18 SER OG O 1.334 6.523 10.633 1.00 . A A . 18 SER OG 1 1 15 6794 1 1 19 GLY C C -2.827 3.653 5.428 1.00 . A A . 19 GLY C 1 1 15 6795 1 1 19 GLY CA C -2.949 4.364 6.778 1.00 . A A . 19 GLY CA 1 1 15 6796 1 1 19 GLY H H -0.884 3.870 7.152 1.00 . A A . 19 GLY H 1 1 15 6797 1 1 19 GLY HA2 H -3.586 3.787 7.433 1.00 . A A . 19 GLY HA2 1 1 15 6798 1 1 19 GLY HA3 H -3.378 5.343 6.627 1.00 . A A . 19 GLY HA3 1 1 15 6799 1 1 19 GLY N N -1.596 4.501 7.394 1.00 . A A . 19 GLY N 1 1 15 6800 1 1 19 GLY O O -3.578 2.745 5.129 1.00 . A A . 19 GLY O 1 1 15 6801 1 1 20 TYR C C -1.496 1.901 3.443 1.00 . A A . 20 TYR C 1 1 15 6802 1 1 20 TYR CA C -1.700 3.412 3.277 1.00 . A A . 20 TYR CA 1 1 15 6803 1 1 20 TYR CB C -0.440 4.052 2.677 1.00 . A A . 20 TYR CB 1 1 15 6804 1 1 20 TYR CD1 C -1.904 6.057 2.185 1.00 . A A . 20 TYR CD1 1 1 15 6805 1 1 20 TYR CD2 C 0.450 6.413 2.647 1.00 . A A . 20 TYR CD2 1 1 15 6806 1 1 20 TYR CE1 C -2.080 7.434 2.017 1.00 . A A . 20 TYR CE1 1 1 15 6807 1 1 20 TYR CE2 C 0.271 7.792 2.481 1.00 . A A . 20 TYR CE2 1 1 15 6808 1 1 20 TYR CG C -0.639 5.544 2.500 1.00 . A A . 20 TYR CG 1 1 15 6809 1 1 20 TYR CZ C -0.993 8.302 2.166 1.00 . A A . 20 TYR CZ 1 1 15 6810 1 1 20 TYR H H -1.290 4.794 4.885 1.00 . A A . 20 TYR H 1 1 15 6811 1 1 20 TYR HA H -2.553 3.610 2.641 1.00 . A A . 20 TYR HA 1 1 15 6812 1 1 20 TYR HB2 H 0.396 3.878 3.336 1.00 . A A . 20 TYR HB2 1 1 15 6813 1 1 20 TYR HB3 H -0.237 3.603 1.716 1.00 . A A . 20 TYR HB3 1 1 15 6814 1 1 20 TYR HD1 H -2.742 5.389 2.073 1.00 . A A . 20 TYR HD1 1 1 15 6815 1 1 20 TYR HD2 H 1.425 6.020 2.891 1.00 . A A . 20 TYR HD2 1 1 15 6816 1 1 20 TYR HE1 H -3.057 7.828 1.774 1.00 . A A . 20 TYR HE1 1 1 15 6817 1 1 20 TYR HE2 H 1.111 8.462 2.595 1.00 . A A . 20 TYR HE2 1 1 15 6818 1 1 20 TYR HH H -1.150 9.851 1.058 1.00 . A A . 20 TYR HH 1 1 15 6819 1 1 20 TYR N N -1.882 4.060 4.614 1.00 . A A . 20 TYR N 1 1 15 6820 1 1 20 TYR O O -0.658 1.463 4.210 1.00 . A A . 20 TYR O 1 1 15 6821 1 1 20 TYR OH O -1.167 9.662 1.999 1.00 . A A . 20 TYR OH 1 1 15 6822 1 1 21 ASN C C -1.407 -0.943 1.607 1.00 . A A . 21 ASN C 1 1 15 6823 1 1 21 ASN CA C -2.105 -0.380 2.848 1.00 . A A . 21 ASN CA 1 1 15 6824 1 1 21 ASN CB C -3.534 -0.922 2.958 1.00 . A A . 21 ASN CB 1 1 15 6825 1 1 21 ASN CG C -3.536 -2.236 3.751 1.00 . A A . 21 ASN CG 1 1 15 6826 1 1 21 ASN H H -2.922 1.482 2.122 1.00 . A A . 21 ASN H 1 1 15 6827 1 1 21 ASN HA H -1.548 -0.631 3.737 1.00 . A A . 21 ASN HA 1 1 15 6828 1 1 21 ASN HB2 H -4.156 -0.196 3.463 1.00 . A A . 21 ASN HB2 1 1 15 6829 1 1 21 ASN HB3 H -3.925 -1.101 1.968 1.00 . A A . 21 ASN HB3 1 1 15 6830 1 1 21 ASN HD21 H -5.465 -2.589 3.434 1.00 . A A . 21 ASN HD21 1 1 15 6831 1 1 21 ASN HD22 H -4.654 -3.758 4.360 1.00 . A A . 21 ASN HD22 1 1 15 6832 1 1 21 ASN N N -2.254 1.105 2.732 1.00 . A A . 21 ASN N 1 1 15 6833 1 1 21 ASN ND2 N -4.644 -2.917 3.857 1.00 . A A . 21 ASN ND2 1 1 15 6834 1 1 21 ASN O O -1.386 -0.324 0.565 1.00 . A A . 21 ASN O 1 1 15 6835 1 1 21 ASN OD1 O -2.521 -2.647 4.281 1.00 . A A . 21 ASN OD1 1 1 15 6836 1 1 22 CYS C C -1.096 -3.558 -0.299 1.00 . A A . 22 CYS C 1 1 15 6837 1 1 22 CYS CA C -0.128 -2.719 0.545 1.00 . A A . 22 CYS CA 1 1 15 6838 1 1 22 CYS CB C 0.961 -3.605 1.157 1.00 . A A . 22 CYS CB 1 1 15 6839 1 1 22 CYS H H -0.864 -2.595 2.570 1.00 . A A . 22 CYS H 1 1 15 6840 1 1 22 CYS HA H 0.325 -1.947 -0.058 1.00 . A A . 22 CYS HA 1 1 15 6841 1 1 22 CYS HB2 H 1.765 -2.983 1.523 1.00 . A A . 22 CYS HB2 1 1 15 6842 1 1 22 CYS HB3 H 0.546 -4.171 1.977 1.00 . A A . 22 CYS HB3 1 1 15 6843 1 1 22 CYS N N -0.835 -2.114 1.716 1.00 . A A . 22 CYS N 1 1 15 6844 1 1 22 CYS O O -1.842 -4.369 0.218 1.00 . A A . 22 CYS O 1 1 15 6845 1 1 22 CYS SG S 1.605 -4.741 -0.097 1.00 . A A . 22 CYS SG 1 1 15 6846 1 1 23 SER C C -1.214 -5.375 -3.050 1.00 . A A . 23 SER C 1 1 15 6847 1 1 23 SER CA C -1.977 -4.165 -2.493 1.00 . A A . 23 SER CA 1 1 15 6848 1 1 23 SER CB C -2.376 -3.210 -3.623 1.00 . A A . 23 SER CB 1 1 15 6849 1 1 23 SER H H -0.456 -2.722 -1.987 1.00 . A A . 23 SER H 1 1 15 6850 1 1 23 SER HA H -2.856 -4.485 -1.953 1.00 . A A . 23 SER HA 1 1 15 6851 1 1 23 SER HB2 H -1.889 -2.260 -3.488 1.00 . A A . 23 SER HB2 1 1 15 6852 1 1 23 SER HB3 H -2.075 -3.633 -4.574 1.00 . A A . 23 SER HB3 1 1 15 6853 1 1 23 SER HG H -4.161 -3.493 -4.349 1.00 . A A . 23 SER HG 1 1 15 6854 1 1 23 SER N N -1.075 -3.373 -1.599 1.00 . A A . 23 SER N 1 1 15 6855 1 1 23 SER O O -0.129 -5.226 -3.578 1.00 . A A . 23 SER O 1 1 15 6856 1 1 23 SER OG O -3.786 -3.019 -3.601 1.00 . A A . 23 SER OG 1 1 15 6857 1 1 24 PRO C C -1.200 -7.869 -4.929 1.00 . A A . 24 PRO C 1 1 15 6858 1 1 24 PRO CA C -1.156 -7.787 -3.395 1.00 . A A . 24 PRO CA 1 1 15 6859 1 1 24 PRO CB C -1.996 -8.896 -2.766 1.00 . A A . 24 PRO CB 1 1 15 6860 1 1 24 PRO CD C -3.107 -6.805 -2.282 1.00 . A A . 24 PRO CD 1 1 15 6861 1 1 24 PRO CG C -3.333 -8.277 -2.510 1.00 . A A . 24 PRO CG 1 1 15 6862 1 1 24 PRO HA H -0.141 -7.851 -3.042 1.00 . A A . 24 PRO HA 1 1 15 6863 1 1 24 PRO HB2 H -2.089 -9.729 -3.450 1.00 . A A . 24 PRO HB2 1 1 15 6864 1 1 24 PRO HB3 H -1.554 -9.219 -1.836 1.00 . A A . 24 PRO HB3 1 1 15 6865 1 1 24 PRO HD2 H -3.884 -6.226 -2.763 1.00 . A A . 24 PRO HD2 1 1 15 6866 1 1 24 PRO HD3 H -3.066 -6.585 -1.227 1.00 . A A . 24 PRO HD3 1 1 15 6867 1 1 24 PRO HG2 H -3.975 -8.425 -3.367 1.00 . A A . 24 PRO HG2 1 1 15 6868 1 1 24 PRO HG3 H -3.781 -8.715 -1.633 1.00 . A A . 24 PRO HG3 1 1 15 6869 1 1 24 PRO N N -1.802 -6.540 -2.905 1.00 . A A . 24 PRO N 1 1 15 6870 1 1 24 PRO O O -0.378 -8.524 -5.542 1.00 . A A . 24 PRO O 1 1 15 6871 1 1 25 THR C C -1.390 -6.159 -7.679 1.00 . A A . 25 THR C 1 1 15 6872 1 1 25 THR CA C -2.249 -7.260 -7.042 1.00 . A A . 25 THR CA 1 1 15 6873 1 1 25 THR CB C -3.734 -7.034 -7.352 1.00 . A A . 25 THR CB 1 1 15 6874 1 1 25 THR CG2 C -3.976 -7.187 -8.855 1.00 . A A . 25 THR CG2 1 1 15 6875 1 1 25 THR H H -2.802 -6.696 -5.034 1.00 . A A . 25 THR H 1 1 15 6876 1 1 25 THR HA H -1.943 -8.227 -7.406 1.00 . A A . 25 THR HA 1 1 15 6877 1 1 25 THR HB H -4.019 -6.040 -7.046 1.00 . A A . 25 THR HB 1 1 15 6878 1 1 25 THR HG1 H -4.939 -7.545 -5.911 1.00 . A A . 25 THR HG1 1 1 15 6879 1 1 25 THR HG21 H -5.036 -7.281 -9.041 1.00 . A A . 25 THR HG21 1 1 15 6880 1 1 25 THR HG22 H -3.469 -8.069 -9.214 1.00 . A A . 25 THR HG22 1 1 15 6881 1 1 25 THR HG23 H -3.596 -6.317 -9.371 1.00 . A A . 25 THR HG23 1 1 15 6882 1 1 25 THR N N -2.150 -7.215 -5.550 1.00 . A A . 25 THR N 1 1 15 6883 1 1 25 THR O O -0.894 -6.311 -8.779 1.00 . A A . 25 THR O 1 1 15 6884 1 1 25 THR OG1 O -4.516 -7.990 -6.648 1.00 . A A . 25 THR OG1 1 1 15 6885 1 1 26 TRP C C 1.037 -3.965 -7.013 1.00 . A A . 26 TRP C 1 1 15 6886 1 1 26 TRP CA C -0.393 -3.938 -7.575 1.00 . A A . 26 TRP CA 1 1 15 6887 1 1 26 TRP CB C -1.104 -2.648 -7.155 1.00 . A A . 26 TRP CB 1 1 15 6888 1 1 26 TRP CD1 C -3.082 -3.467 -8.519 1.00 . A A . 26 TRP CD1 1 1 15 6889 1 1 26 TRP CD2 C -3.665 -1.957 -6.960 1.00 . A A . 26 TRP CD2 1 1 15 6890 1 1 26 TRP CE2 C -4.852 -2.323 -7.633 1.00 . A A . 26 TRP CE2 1 1 15 6891 1 1 26 TRP CE3 C -3.755 -1.012 -5.924 1.00 . A A . 26 TRP CE3 1 1 15 6892 1 1 26 TRP CG C -2.553 -2.698 -7.537 1.00 . A A . 26 TRP CG 1 1 15 6893 1 1 26 TRP CH2 C -6.159 -0.832 -6.260 1.00 . A A . 26 TRP CH2 1 1 15 6894 1 1 26 TRP CZ2 C -6.086 -1.771 -7.292 1.00 . A A . 26 TRP CZ2 1 1 15 6895 1 1 26 TRP CZ3 C -4.996 -0.454 -5.577 1.00 . A A . 26 TRP CZ3 1 1 15 6896 1 1 26 TRP H H -1.628 -4.950 -6.119 1.00 . A A . 26 TRP H 1 1 15 6897 1 1 26 TRP HA H -0.370 -4.007 -8.651 1.00 . A A . 26 TRP HA 1 1 15 6898 1 1 26 TRP HB2 H -1.020 -2.524 -6.086 1.00 . A A . 26 TRP HB2 1 1 15 6899 1 1 26 TRP HB3 H -0.634 -1.811 -7.647 1.00 . A A . 26 TRP HB3 1 1 15 6900 1 1 26 TRP HD1 H -2.529 -4.145 -9.152 1.00 . A A . 26 TRP HD1 1 1 15 6901 1 1 26 TRP HE1 H -5.060 -3.683 -9.194 1.00 . A A . 26 TRP HE1 1 1 15 6902 1 1 26 TRP HE3 H -2.864 -0.715 -5.392 1.00 . A A . 26 TRP HE3 1 1 15 6903 1 1 26 TRP HH2 H -7.111 -0.400 -5.989 1.00 . A A . 26 TRP HH2 1 1 15 6904 1 1 26 TRP HZ2 H -6.978 -2.066 -7.823 1.00 . A A . 26 TRP HZ2 1 1 15 6905 1 1 26 TRP HZ3 H -5.055 0.272 -4.778 1.00 . A A . 26 TRP HZ3 1 1 15 6906 1 1 26 TRP N N -1.215 -5.052 -7.001 1.00 . A A . 26 TRP N 1 1 15 6907 1 1 26 TRP NE1 N -4.443 -3.247 -8.572 1.00 . A A . 26 TRP NE1 1 1 15 6908 1 1 26 TRP O O 1.926 -3.333 -7.550 1.00 . A A . 26 TRP O 1 1 15 6909 1 1 27 LYS C C 3.085 -3.436 -4.734 1.00 . A A . 27 LYS C 1 1 15 6910 1 1 27 LYS CA C 2.628 -4.783 -5.331 1.00 . A A . 27 LYS CA 1 1 15 6911 1 1 27 LYS CB C 3.560 -5.217 -6.472 1.00 . A A . 27 LYS CB 1 1 15 6912 1 1 27 LYS CD C 6.043 -5.248 -6.151 1.00 . A A . 27 LYS CD 1 1 15 6913 1 1 27 LYS CE C 7.225 -6.223 -6.132 1.00 . A A . 27 LYS CE 1 1 15 6914 1 1 27 LYS CG C 4.739 -6.015 -5.905 1.00 . A A . 27 LYS CG 1 1 15 6915 1 1 27 LYS H H 0.524 -5.194 -5.532 1.00 . A A . 27 LYS H 1 1 15 6916 1 1 27 LYS HA H 2.632 -5.539 -4.562 1.00 . A A . 27 LYS HA 1 1 15 6917 1 1 27 LYS HB2 H 3.010 -5.836 -7.168 1.00 . A A . 27 LYS HB2 1 1 15 6918 1 1 27 LYS HB3 H 3.931 -4.344 -6.987 1.00 . A A . 27 LYS HB3 1 1 15 6919 1 1 27 LYS HD2 H 5.995 -4.756 -7.112 1.00 . A A . 27 LYS HD2 1 1 15 6920 1 1 27 LYS HD3 H 6.177 -4.509 -5.376 1.00 . A A . 27 LYS HD3 1 1 15 6921 1 1 27 LYS HE2 H 8.139 -5.698 -5.890 1.00 . A A . 27 LYS HE2 1 1 15 6922 1 1 27 LYS HE3 H 7.046 -7.017 -5.423 1.00 . A A . 27 LYS HE3 1 1 15 6923 1 1 27 LYS HG2 H 4.600 -6.160 -4.844 1.00 . A A . 27 LYS HG2 1 1 15 6924 1 1 27 LYS HG3 H 4.792 -6.975 -6.395 1.00 . A A . 27 LYS HG3 1 1 15 6925 1 1 27 LYS HZ1 H 7.348 -6.001 -8.202 1.00 . A A . 27 LYS HZ1 1 1 15 6926 1 1 27 LYS HZ2 H 6.448 -7.355 -7.702 1.00 . A A . 27 LYS HZ2 1 1 15 6927 1 1 27 LYS HZ3 H 8.144 -7.375 -7.605 1.00 . A A . 27 LYS HZ3 1 1 15 6928 1 1 27 LYS N N 1.261 -4.694 -5.942 1.00 . A A . 27 LYS N 1 1 15 6929 1 1 27 LYS NZ N 7.296 -6.780 -7.515 1.00 . A A . 27 LYS NZ 1 1 15 6930 1 1 27 LYS O O 4.249 -3.266 -4.423 1.00 . A A . 27 LYS O 1 1 15 6931 1 1 28 TRP C C 1.599 -0.726 -2.880 1.00 . A A . 28 TRP C 1 1 15 6932 1 1 28 TRP CA C 2.613 -1.182 -3.937 1.00 . A A . 28 TRP CA 1 1 15 6933 1 1 28 TRP CB C 2.731 -0.167 -5.092 1.00 . A A . 28 TRP CB 1 1 15 6934 1 1 28 TRP CD1 C 0.329 0.682 -5.050 1.00 . A A . 28 TRP CD1 1 1 15 6935 1 1 28 TRP CD2 C 0.991 0.016 -7.092 1.00 . A A . 28 TRP CD2 1 1 15 6936 1 1 28 TRP CE2 C -0.346 0.456 -7.224 1.00 . A A . 28 TRP CE2 1 1 15 6937 1 1 28 TRP CE3 C 1.650 -0.456 -8.238 1.00 . A A . 28 TRP CE3 1 1 15 6938 1 1 28 TRP CG C 1.396 0.157 -5.701 1.00 . A A . 28 TRP CG 1 1 15 6939 1 1 28 TRP CH2 C -0.334 -0.044 -9.584 1.00 . A A . 28 TRP CH2 1 1 15 6940 1 1 28 TRP CZ2 C -1.006 0.429 -8.453 1.00 . A A . 28 TRP CZ2 1 1 15 6941 1 1 28 TRP CZ3 C 0.992 -0.485 -9.476 1.00 . A A . 28 TRP CZ3 1 1 15 6942 1 1 28 TRP H H 1.251 -2.637 -4.779 1.00 . A A . 28 TRP H 1 1 15 6943 1 1 28 TRP HA H 3.581 -1.303 -3.472 1.00 . A A . 28 TRP HA 1 1 15 6944 1 1 28 TRP HB2 H 3.173 0.743 -4.718 1.00 . A A . 28 TRP HB2 1 1 15 6945 1 1 28 TRP HB3 H 3.377 -0.579 -5.855 1.00 . A A . 28 TRP HB3 1 1 15 6946 1 1 28 TRP HD1 H 0.289 0.920 -3.998 1.00 . A A . 28 TRP HD1 1 1 15 6947 1 1 28 TRP HE1 H -1.592 1.210 -5.735 1.00 . A A . 28 TRP HE1 1 1 15 6948 1 1 28 TRP HE3 H 2.673 -0.795 -8.165 1.00 . A A . 28 TRP HE3 1 1 15 6949 1 1 28 TRP HH2 H -0.835 -0.070 -10.540 1.00 . A A . 28 TRP HH2 1 1 15 6950 1 1 28 TRP HZ2 H -2.027 0.770 -8.531 1.00 . A A . 28 TRP HZ2 1 1 15 6951 1 1 28 TRP HZ3 H 1.511 -0.850 -10.351 1.00 . A A . 28 TRP HZ3 1 1 15 6952 1 1 28 TRP N N 2.191 -2.486 -4.545 1.00 . A A . 28 TRP N 1 1 15 6953 1 1 28 TRP NE1 N -0.706 0.853 -5.952 1.00 . A A . 28 TRP NE1 1 1 15 6954 1 1 28 TRP O O 0.498 -1.239 -2.801 1.00 . A A . 28 TRP O 1 1 15 6955 1 1 29 CYS C C 0.012 1.689 -1.584 1.00 . A A . 29 CYS C 1 1 15 6956 1 1 29 CYS CA C 1.038 0.716 -0.995 1.00 . A A . 29 CYS CA 1 1 15 6957 1 1 29 CYS CB C 1.928 1.423 0.031 1.00 . A A . 29 CYS CB 1 1 15 6958 1 1 29 CYS H H 2.865 0.621 -2.140 1.00 . A A . 29 CYS H 1 1 15 6959 1 1 29 CYS HA H 0.538 -0.119 -0.529 1.00 . A A . 29 CYS HA 1 1 15 6960 1 1 29 CYS HB2 H 2.914 0.984 0.016 1.00 . A A . 29 CYS HB2 1 1 15 6961 1 1 29 CYS HB3 H 1.996 2.473 -0.212 1.00 . A A . 29 CYS HB3 1 1 15 6962 1 1 29 CYS N N 1.971 0.229 -2.059 1.00 . A A . 29 CYS N 1 1 15 6963 1 1 29 CYS O O 0.343 2.557 -2.364 1.00 . A A . 29 CYS O 1 1 15 6964 1 1 29 CYS SG S 1.212 1.231 1.681 1.00 . A A . 29 CYS SG 1 1 15 6965 1 1 30 VAL C C -2.873 3.297 -0.591 1.00 . A A . 30 VAL C 1 1 15 6966 1 1 30 VAL CA C -2.309 2.439 -1.728 1.00 . A A . 30 VAL CA 1 1 15 6967 1 1 30 VAL CB C -3.390 1.494 -2.278 1.00 . A A . 30 VAL CB 1 1 15 6968 1 1 30 VAL CG1 C -2.808 0.636 -3.402 1.00 . A A . 30 VAL CG1 1 1 15 6969 1 1 30 VAL CG2 C -3.906 0.579 -1.158 1.00 . A A . 30 VAL CG2 1 1 15 6970 1 1 30 VAL H H -1.462 0.831 -0.574 1.00 . A A . 30 VAL H 1 1 15 6971 1 1 30 VAL HA H -1.931 3.067 -2.520 1.00 . A A . 30 VAL HA 1 1 15 6972 1 1 30 VAL HB H -4.210 2.080 -2.668 1.00 . A A . 30 VAL HB 1 1 15 6973 1 1 30 VAL HG11 H -3.054 1.079 -4.356 1.00 . A A . 30 VAL HG11 1 1 15 6974 1 1 30 VAL HG12 H -3.226 -0.358 -3.349 1.00 . A A . 30 VAL HG12 1 1 15 6975 1 1 30 VAL HG13 H -1.734 0.580 -3.298 1.00 . A A . 30 VAL HG13 1 1 15 6976 1 1 30 VAL HG21 H -3.334 -0.337 -1.150 1.00 . A A . 30 VAL HG21 1 1 15 6977 1 1 30 VAL HG22 H -4.948 0.351 -1.330 1.00 . A A . 30 VAL HG22 1 1 15 6978 1 1 30 VAL HG23 H -3.799 1.077 -0.206 1.00 . A A . 30 VAL HG23 1 1 15 6979 1 1 30 VAL N N -1.232 1.540 -1.207 1.00 . A A . 30 VAL N 1 1 15 6980 1 1 30 VAL O O -2.311 3.364 0.482 1.00 . A A . 30 VAL O 1 1 15 6981 1 1 31 TYR C C -5.540 3.950 1.122 1.00 . A A . 31 TYR C 1 1 15 6982 1 1 31 TYR CA C -4.597 4.793 0.250 1.00 . A A . 31 TYR CA 1 1 15 6983 1 1 31 TYR CB C -5.371 5.899 -0.485 1.00 . A A . 31 TYR CB 1 1 15 6984 1 1 31 TYR CD1 C -7.625 4.810 -0.824 1.00 . A A . 31 TYR CD1 1 1 15 6985 1 1 31 TYR CD2 C -6.231 5.224 -2.762 1.00 . A A . 31 TYR CD2 1 1 15 6986 1 1 31 TYR CE1 C -8.608 4.254 -1.649 1.00 . A A . 31 TYR CE1 1 1 15 6987 1 1 31 TYR CE2 C -7.213 4.669 -3.589 1.00 . A A . 31 TYR CE2 1 1 15 6988 1 1 31 TYR CG C -6.436 5.295 -1.379 1.00 . A A . 31 TYR CG 1 1 15 6989 1 1 31 TYR CZ C -8.402 4.184 -3.031 1.00 . A A . 31 TYR CZ 1 1 15 6990 1 1 31 TYR H H -4.418 3.868 -1.694 1.00 . A A . 31 TYR H 1 1 15 6991 1 1 31 TYR HA H -3.826 5.233 0.859 1.00 . A A . 31 TYR HA 1 1 15 6992 1 1 31 TYR HB2 H -5.840 6.548 0.239 1.00 . A A . 31 TYR HB2 1 1 15 6993 1 1 31 TYR HB3 H -4.684 6.475 -1.088 1.00 . A A . 31 TYR HB3 1 1 15 6994 1 1 31 TYR HD1 H -7.783 4.862 0.243 1.00 . A A . 31 TYR HD1 1 1 15 6995 1 1 31 TYR HD2 H -5.312 5.597 -3.191 1.00 . A A . 31 TYR HD2 1 1 15 6996 1 1 31 TYR HE1 H -9.527 3.880 -1.220 1.00 . A A . 31 TYR HE1 1 1 15 6997 1 1 31 TYR HE2 H -7.055 4.614 -4.656 1.00 . A A . 31 TYR HE2 1 1 15 6998 1 1 31 TYR HH H -9.950 4.344 -4.139 1.00 . A A . 31 TYR HH 1 1 15 6999 1 1 31 TYR N N -3.984 3.945 -0.820 1.00 . A A . 31 TYR N 1 1 15 7000 1 1 31 TYR O O -5.923 2.854 0.756 1.00 . A A . 31 TYR O 1 1 15 7001 1 1 31 TYR OH O -9.372 3.635 -3.847 1.00 . A A . 31 TYR OH 1 1 15 7002 1 1 32 ALA C C -8.246 4.312 3.128 1.00 . A A . 32 ALA C 1 1 15 7003 1 1 32 ALA CA C -6.841 3.697 3.166 1.00 . A A . 32 ALA CA 1 1 15 7004 1 1 32 ALA CB C -6.235 3.831 4.568 1.00 . A A . 32 ALA CB 1 1 15 7005 1 1 32 ALA H H -5.597 5.346 2.538 1.00 . A A . 32 ALA H 1 1 15 7006 1 1 32 ALA HA H -6.875 2.659 2.878 1.00 . A A . 32 ALA HA 1 1 15 7007 1 1 32 ALA HB1 H -5.918 2.858 4.916 1.00 . A A . 32 ALA HB1 1 1 15 7008 1 1 32 ALA HB2 H -6.976 4.230 5.244 1.00 . A A . 32 ALA HB2 1 1 15 7009 1 1 32 ALA HB3 H -5.385 4.495 4.533 1.00 . A A . 32 ALA HB3 1 1 15 7010 1 1 32 ALA N N -5.918 4.460 2.268 1.00 . A A . 32 ALA N 1 1 15 7011 1 1 32 ALA O O -8.523 5.199 2.342 1.00 . A A . 32 ALA O 1 1 15 7012 1 1 33 ARG C C -10.815 5.033 5.368 1.00 . A A . 33 ARG C 1 1 15 7013 1 1 33 ARG CA C -10.519 4.407 3.995 1.00 . A A . 33 ARG CA 1 1 15 7014 1 1 33 ARG CB C -11.437 3.207 3.729 1.00 . A A . 33 ARG CB 1 1 15 7015 1 1 33 ARG CD C -11.231 2.145 1.470 1.00 . A A . 33 ARG CD 1 1 15 7016 1 1 33 ARG CG C -11.926 3.246 2.278 1.00 . A A . 33 ARG CG 1 1 15 7017 1 1 33 ARG CZ C -12.438 0.057 1.224 1.00 . A A . 33 ARG CZ 1 1 15 7018 1 1 33 ARG H H -8.885 3.135 4.600 1.00 . A A . 33 ARG H 1 1 15 7019 1 1 33 ARG HA H -10.641 5.141 3.214 1.00 . A A . 33 ARG HA 1 1 15 7020 1 1 33 ARG HB2 H -10.891 2.291 3.902 1.00 . A A . 33 ARG HB2 1 1 15 7021 1 1 33 ARG HB3 H -12.287 3.248 4.393 1.00 . A A . 33 ARG HB3 1 1 15 7022 1 1 33 ARG HD2 H -10.644 2.581 0.672 1.00 . A A . 33 ARG HD2 1 1 15 7023 1 1 33 ARG HD3 H -10.607 1.541 2.111 1.00 . A A . 33 ARG HD3 1 1 15 7024 1 1 33 ARG HE H -12.996 1.727 0.307 1.00 . A A . 33 ARG HE 1 1 15 7025 1 1 33 ARG HG2 H -12.995 3.090 2.256 1.00 . A A . 33 ARG HG2 1 1 15 7026 1 1 33 ARG HG3 H -11.694 4.207 1.845 1.00 . A A . 33 ARG HG3 1 1 15 7027 1 1 33 ARG HH11 H -12.724 0.402 3.179 1.00 . A A . 33 ARG HH11 1 1 15 7028 1 1 33 ARG HH12 H -12.717 -1.264 2.707 1.00 . A A . 33 ARG HH12 1 1 15 7029 1 1 33 ARG HH21 H -12.174 -0.585 -0.655 1.00 . A A . 33 ARG HH21 1 1 15 7030 1 1 33 ARG HH22 H -12.406 -1.823 0.533 1.00 . A A . 33 ARG HH22 1 1 15 7031 1 1 33 ARG N N -9.133 3.849 3.975 1.00 . A A . 33 ARG N 1 1 15 7032 1 1 33 ARG NE N -12.340 1.321 0.911 1.00 . A A . 33 ARG NE 1 1 15 7033 1 1 33 ARG NH1 N -12.642 -0.297 2.467 1.00 . A A . 33 ARG NH1 1 1 15 7034 1 1 33 ARG NH2 N -12.330 -0.855 0.296 1.00 . A A . 33 ARG NH2 1 1 15 7035 1 1 33 ARG O O -11.597 4.504 6.137 1.00 . A A . 33 ARG O 1 1 15 7036 1 1 34 PRO C C -11.761 7.513 6.981 1.00 . A A . 34 PRO C 1 1 15 7037 1 1 34 PRO CA C -10.373 6.858 6.926 1.00 . A A . 34 PRO CA 1 1 15 7038 1 1 34 PRO CB C -9.268 7.913 6.933 1.00 . A A . 34 PRO CB 1 1 15 7039 1 1 34 PRO CD C -9.218 6.854 4.768 1.00 . A A . 34 PRO CD 1 1 15 7040 1 1 34 PRO CG C -8.949 8.147 5.492 1.00 . A A . 34 PRO CG 1 1 15 7041 1 1 34 PRO HA H -10.238 6.180 7.753 1.00 . A A . 34 PRO HA 1 1 15 7042 1 1 34 PRO HB2 H -9.623 8.824 7.397 1.00 . A A . 34 PRO HB2 1 1 15 7043 1 1 34 PRO HB3 H -8.397 7.542 7.449 1.00 . A A . 34 PRO HB3 1 1 15 7044 1 1 34 PRO HD2 H -9.650 7.049 3.796 1.00 . A A . 34 PRO HD2 1 1 15 7045 1 1 34 PRO HD3 H -8.311 6.277 4.674 1.00 . A A . 34 PRO HD3 1 1 15 7046 1 1 34 PRO HG2 H -9.579 8.933 5.098 1.00 . A A . 34 PRO HG2 1 1 15 7047 1 1 34 PRO HG3 H -7.909 8.416 5.382 1.00 . A A . 34 PRO HG3 1 1 15 7048 1 1 34 PRO N N -10.175 6.151 5.632 1.00 . A A . 34 PRO N 1 1 15 7049 1 1 34 PRO O O -12.128 8.173 6.020 1.00 . A A . 34 PRO O 1 1 15 7050 1 1 34 PRO OXT O -12.433 7.341 7.985 1.00 . A A . 34 PRO OXT 1 1 16 7051 1 1 1 GLY C C 9.483 7.009 4.767 1.00 . A A . 1 GLY C 1 1 16 7052 1 1 1 GLY CA C 10.376 8.242 4.602 1.00 . A A . 1 GLY CA 1 1 16 7053 1 1 1 GLY H1 H 10.802 9.651 3.128 1.00 . A A . 1 GLY H1 1 1 16 7054 1 1 1 GLY H2 H 9.194 9.104 3.120 1.00 . A A . 1 GLY H2 1 1 16 7055 1 1 1 GLY H3 H 10.435 8.109 2.524 1.00 . A A . 1 GLY H3 1 1 16 7056 1 1 1 GLY HA2 H 11.412 7.959 4.732 1.00 . A A . 1 GLY HA2 1 1 16 7057 1 1 1 GLY HA3 H 10.109 8.978 5.345 1.00 . A A . 1 GLY HA3 1 1 16 7058 1 1 1 GLY N N 10.188 8.820 3.240 1.00 . A A . 1 GLY N 1 1 16 7059 1 1 1 GLY O O 9.953 5.887 4.754 1.00 . A A . 1 GLY O 1 1 16 7060 1 1 2 CYS C C 6.663 5.644 3.730 1.00 . A A . 2 CYS C 1 1 16 7061 1 1 2 CYS CA C 7.260 6.056 5.085 1.00 . A A . 2 CYS CA 1 1 16 7062 1 1 2 CYS CB C 6.164 6.563 6.029 1.00 . A A . 2 CYS CB 1 1 16 7063 1 1 2 CYS H H 7.846 8.128 4.926 1.00 . A A . 2 CYS H 1 1 16 7064 1 1 2 CYS HA H 7.773 5.221 5.538 1.00 . A A . 2 CYS HA 1 1 16 7065 1 1 2 CYS HB2 H 5.539 5.736 6.331 1.00 . A A . 2 CYS HB2 1 1 16 7066 1 1 2 CYS HB3 H 6.619 7.006 6.904 1.00 . A A . 2 CYS HB3 1 1 16 7067 1 1 2 CYS N N 8.196 7.212 4.920 1.00 . A A . 2 CYS N 1 1 16 7068 1 1 2 CYS O O 7.085 6.110 2.688 1.00 . A A . 2 CYS O 1 1 16 7069 1 1 2 CYS SG S 5.152 7.806 5.183 1.00 . A A . 2 CYS SG 1 1 16 7070 1 1 3 GLY C C 4.081 5.396 1.954 1.00 . A A . 3 GLY C 1 1 16 7071 1 1 3 GLY CA C 5.051 4.322 2.463 1.00 . A A . 3 GLY CA 1 1 16 7072 1 1 3 GLY H H 5.362 4.410 4.595 1.00 . A A . 3 GLY H 1 1 16 7073 1 1 3 GLY HA2 H 5.821 4.153 1.723 1.00 . A A . 3 GLY HA2 1 1 16 7074 1 1 3 GLY HA3 H 4.507 3.406 2.634 1.00 . A A . 3 GLY HA3 1 1 16 7075 1 1 3 GLY N N 5.683 4.771 3.742 1.00 . A A . 3 GLY N 1 1 16 7076 1 1 3 GLY O O 3.816 6.377 2.626 1.00 . A A . 3 GLY O 1 1 16 7077 1 1 4 GLY C C 1.567 5.536 -0.683 1.00 . A A . 4 GLY C 1 1 16 7078 1 1 4 GLY CA C 2.601 6.227 0.209 1.00 . A A . 4 GLY CA 1 1 16 7079 1 1 4 GLY H H 3.780 4.421 0.245 1.00 . A A . 4 GLY H 1 1 16 7080 1 1 4 GLY HA2 H 2.095 6.731 1.021 1.00 . A A . 4 GLY HA2 1 1 16 7081 1 1 4 GLY HA3 H 3.149 6.950 -0.375 1.00 . A A . 4 GLY HA3 1 1 16 7082 1 1 4 GLY N N 3.550 5.217 0.768 1.00 . A A . 4 GLY N 1 1 16 7083 1 1 4 GLY O O 0.817 4.689 -0.236 1.00 . A A . 4 GLY O 1 1 16 7084 1 1 5 LEU C C 1.215 4.360 -3.903 1.00 . A A . 5 LEU C 1 1 16 7085 1 1 5 LEU CA C 0.525 5.271 -2.871 1.00 . A A . 5 LEU CA 1 1 16 7086 1 1 5 LEU CB C -0.166 6.446 -3.564 1.00 . A A . 5 LEU CB 1 1 16 7087 1 1 5 LEU CD1 C -2.392 7.539 -3.251 1.00 . A A . 5 LEU CD1 1 1 16 7088 1 1 5 LEU CD2 C -2.126 5.698 -4.921 1.00 . A A . 5 LEU CD2 1 1 16 7089 1 1 5 LEU CG C -1.680 6.220 -3.553 1.00 . A A . 5 LEU CG 1 1 16 7090 1 1 5 LEU H H 2.130 6.588 -2.277 1.00 . A A . 5 LEU H 1 1 16 7091 1 1 5 LEU HA H -0.200 4.706 -2.309 1.00 . A A . 5 LEU HA 1 1 16 7092 1 1 5 LEU HB2 H 0.067 7.361 -3.039 1.00 . A A . 5 LEU HB2 1 1 16 7093 1 1 5 LEU HB3 H 0.180 6.518 -4.585 1.00 . A A . 5 LEU HB3 1 1 16 7094 1 1 5 LEU HD11 H -3.456 7.367 -3.189 1.00 . A A . 5 LEU HD11 1 1 16 7095 1 1 5 LEU HD12 H -2.187 8.249 -4.038 1.00 . A A . 5 LEU HD12 1 1 16 7096 1 1 5 LEU HD13 H -2.036 7.931 -2.309 1.00 . A A . 5 LEU HD13 1 1 16 7097 1 1 5 LEU HD21 H -3.149 5.359 -4.861 1.00 . A A . 5 LEU HD21 1 1 16 7098 1 1 5 LEU HD22 H -1.491 4.876 -5.216 1.00 . A A . 5 LEU HD22 1 1 16 7099 1 1 5 LEU HD23 H -2.050 6.491 -5.651 1.00 . A A . 5 LEU HD23 1 1 16 7100 1 1 5 LEU HG H -1.930 5.495 -2.791 1.00 . A A . 5 LEU HG 1 1 16 7101 1 1 5 LEU N N 1.518 5.899 -1.944 1.00 . A A . 5 LEU N 1 1 16 7102 1 1 5 LEU O O 0.579 3.855 -4.808 1.00 . A A . 5 LEU O 1 1 16 7103 1 1 6 MET C C 4.394 2.538 -4.050 1.00 . A A . 6 MET C 1 1 16 7104 1 1 6 MET CA C 3.211 3.240 -4.734 1.00 . A A . 6 MET CA 1 1 16 7105 1 1 6 MET CB C 3.702 4.165 -5.851 1.00 . A A . 6 MET CB 1 1 16 7106 1 1 6 MET CE C 2.730 5.231 -9.166 1.00 . A A . 6 MET CE 1 1 16 7107 1 1 6 MET CG C 3.466 3.499 -7.208 1.00 . A A . 6 MET CG 1 1 16 7108 1 1 6 MET H H 2.996 4.536 -3.026 1.00 . A A . 6 MET H 1 1 16 7109 1 1 6 MET HA H 2.528 2.509 -5.138 1.00 . A A . 6 MET HA 1 1 16 7110 1 1 6 MET HB2 H 3.163 5.099 -5.809 1.00 . A A . 6 MET HB2 1 1 16 7111 1 1 6 MET HB3 H 4.758 4.352 -5.725 1.00 . A A . 6 MET HB3 1 1 16 7112 1 1 6 MET HE1 H 3.212 6.056 -8.661 1.00 . A A . 6 MET HE1 1 1 16 7113 1 1 6 MET HE2 H 1.983 5.615 -9.843 1.00 . A A . 6 MET HE2 1 1 16 7114 1 1 6 MET HE3 H 3.464 4.667 -9.726 1.00 . A A . 6 MET HE3 1 1 16 7115 1 1 6 MET HG2 H 4.301 3.708 -7.861 1.00 . A A . 6 MET HG2 1 1 16 7116 1 1 6 MET HG3 H 3.372 2.431 -7.077 1.00 . A A . 6 MET HG3 1 1 16 7117 1 1 6 MET N N 2.500 4.132 -3.767 1.00 . A A . 6 MET N 1 1 16 7118 1 1 6 MET O O 5.385 2.220 -4.682 1.00 . A A . 6 MET O 1 1 16 7119 1 1 6 MET SD S 1.945 4.151 -7.945 1.00 . A A . 6 MET SD 1 1 16 7120 1 1 7 ALA C C 5.420 0.105 -2.378 1.00 . A A . 7 ALA C 1 1 16 7121 1 1 7 ALA CA C 5.421 1.600 -2.046 1.00 . A A . 7 ALA CA 1 1 16 7122 1 1 7 ALA CB C 5.149 1.819 -0.554 1.00 . A A . 7 ALA CB 1 1 16 7123 1 1 7 ALA H H 3.486 2.547 -2.275 1.00 . A A . 7 ALA H 1 1 16 7124 1 1 7 ALA HA H 6.366 2.045 -2.318 1.00 . A A . 7 ALA HA 1 1 16 7125 1 1 7 ALA HB1 H 4.982 0.866 -0.075 1.00 . A A . 7 ALA HB1 1 1 16 7126 1 1 7 ALA HB2 H 4.275 2.440 -0.434 1.00 . A A . 7 ALA HB2 1 1 16 7127 1 1 7 ALA HB3 H 6.001 2.305 -0.102 1.00 . A A . 7 ALA HB3 1 1 16 7128 1 1 7 ALA N N 4.297 2.287 -2.764 1.00 . A A . 7 ALA N 1 1 16 7129 1 1 7 ALA O O 4.465 -0.593 -2.105 1.00 . A A . 7 ALA O 1 1 16 7130 1 1 8 GLY C C 6.136 -2.710 -2.147 1.00 . A A . 8 GLY C 1 1 16 7131 1 1 8 GLY CA C 6.558 -1.835 -3.334 1.00 . A A . 8 GLY CA 1 1 16 7132 1 1 8 GLY H H 7.238 0.205 -3.180 1.00 . A A . 8 GLY H 1 1 16 7133 1 1 8 GLY HA2 H 5.900 -2.027 -4.170 1.00 . A A . 8 GLY HA2 1 1 16 7134 1 1 8 GLY HA3 H 7.570 -2.082 -3.615 1.00 . A A . 8 GLY HA3 1 1 16 7135 1 1 8 GLY N N 6.484 -0.385 -2.969 1.00 . A A . 8 GLY N 1 1 16 7136 1 1 8 GLY O O 6.636 -2.566 -1.046 1.00 . A A . 8 GLY O 1 1 16 7137 1 1 9 CYS C C 5.248 -5.953 -1.513 1.00 . A A . 9 CYS C 1 1 16 7138 1 1 9 CYS CA C 4.749 -4.518 -1.278 1.00 . A A . 9 CYS CA 1 1 16 7139 1 1 9 CYS CB C 3.221 -4.458 -1.355 1.00 . A A . 9 CYS CB 1 1 16 7140 1 1 9 CYS H H 4.840 -3.710 -3.272 1.00 . A A . 9 CYS H 1 1 16 7141 1 1 9 CYS HA H 5.085 -4.155 -0.320 1.00 . A A . 9 CYS HA 1 1 16 7142 1 1 9 CYS HB2 H 2.912 -3.450 -1.589 1.00 . A A . 9 CYS HB2 1 1 16 7143 1 1 9 CYS HB3 H 2.874 -5.129 -2.126 1.00 . A A . 9 CYS HB3 1 1 16 7144 1 1 9 CYS N N 5.220 -3.617 -2.374 1.00 . A A . 9 CYS N 1 1 16 7145 1 1 9 CYS O O 4.670 -6.906 -1.022 1.00 . A A . 9 CYS O 1 1 16 7146 1 1 9 CYS SG S 2.512 -4.949 0.236 1.00 . A A . 9 CYS SG 1 1 16 7147 1 1 10 ASP C C 7.353 -8.137 -1.218 1.00 . A A . 10 ASP C 1 1 16 7148 1 1 10 ASP CA C 6.865 -7.481 -2.522 1.00 . A A . 10 ASP CA 1 1 16 7149 1 1 10 ASP CB C 8.034 -7.264 -3.488 1.00 . A A . 10 ASP CB 1 1 16 7150 1 1 10 ASP CG C 8.412 -8.594 -4.147 1.00 . A A . 10 ASP CG 1 1 16 7151 1 1 10 ASP H H 6.772 -5.329 -2.637 1.00 . A A . 10 ASP H 1 1 16 7152 1 1 10 ASP HA H 6.113 -8.096 -2.990 1.00 . A A . 10 ASP HA 1 1 16 7153 1 1 10 ASP HB2 H 7.742 -6.555 -4.250 1.00 . A A . 10 ASP HB2 1 1 16 7154 1 1 10 ASP HB3 H 8.884 -6.878 -2.944 1.00 . A A . 10 ASP HB3 1 1 16 7155 1 1 10 ASP N N 6.321 -6.112 -2.256 1.00 . A A . 10 ASP N 1 1 16 7156 1 1 10 ASP O O 7.464 -9.346 -1.134 1.00 . A A . 10 ASP O 1 1 16 7157 1 1 10 ASP OD1 O 7.777 -8.949 -5.126 1.00 . A A . 10 ASP OD1 1 1 16 7158 1 1 10 ASP OD2 O 9.331 -9.233 -3.661 1.00 . A A . 10 ASP OD2 1 1 16 7159 1 1 11 GLY C C 6.923 -8.541 1.868 1.00 . A A . 11 GLY C 1 1 16 7160 1 1 11 GLY CA C 8.105 -7.929 1.095 1.00 . A A . 11 GLY CA 1 1 16 7161 1 1 11 GLY H H 7.535 -6.381 -0.290 1.00 . A A . 11 GLY H 1 1 16 7162 1 1 11 GLY HA2 H 8.840 -8.696 0.899 1.00 . A A . 11 GLY HA2 1 1 16 7163 1 1 11 GLY HA3 H 8.551 -7.149 1.692 1.00 . A A . 11 GLY HA3 1 1 16 7164 1 1 11 GLY N N 7.636 -7.351 -0.202 1.00 . A A . 11 GLY N 1 1 16 7165 1 1 11 GLY O O 7.108 -9.124 2.919 1.00 . A A . 11 GLY O 1 1 16 7166 1 1 12 LYS C C 4.341 -8.379 3.452 1.00 . A A . 12 LYS C 1 1 16 7167 1 1 12 LYS CA C 4.507 -8.982 2.047 1.00 . A A . 12 LYS CA 1 1 16 7168 1 1 12 LYS CB C 4.754 -10.497 2.127 1.00 . A A . 12 LYS CB 1 1 16 7169 1 1 12 LYS CD C 5.558 -12.469 0.805 1.00 . A A . 12 LYS CD 1 1 16 7170 1 1 12 LYS CE C 7.050 -12.404 0.448 1.00 . A A . 12 LYS CE 1 1 16 7171 1 1 12 LYS CG C 4.939 -11.069 0.717 1.00 . A A . 12 LYS CG 1 1 16 7172 1 1 12 LYS H H 5.591 -7.935 0.512 1.00 . A A . 12 LYS H 1 1 16 7173 1 1 12 LYS HA H 3.622 -8.790 1.461 1.00 . A A . 12 LYS HA 1 1 16 7174 1 1 12 LYS HB2 H 5.642 -10.687 2.713 1.00 . A A . 12 LYS HB2 1 1 16 7175 1 1 12 LYS HB3 H 3.908 -10.974 2.596 1.00 . A A . 12 LYS HB3 1 1 16 7176 1 1 12 LYS HD2 H 5.442 -12.851 1.808 1.00 . A A . 12 LYS HD2 1 1 16 7177 1 1 12 LYS HD3 H 5.055 -13.127 0.112 1.00 . A A . 12 LYS HD3 1 1 16 7178 1 1 12 LYS HE2 H 7.394 -13.373 0.112 1.00 . A A . 12 LYS HE2 1 1 16 7179 1 1 12 LYS HE3 H 7.222 -11.660 -0.314 1.00 . A A . 12 LYS HE3 1 1 16 7180 1 1 12 LYS HG2 H 3.979 -11.130 0.226 1.00 . A A . 12 LYS HG2 1 1 16 7181 1 1 12 LYS HG3 H 5.592 -10.424 0.149 1.00 . A A . 12 LYS HG3 1 1 16 7182 1 1 12 LYS HZ1 H 8.727 -12.353 1.680 1.00 . A A . 12 LYS HZ1 1 1 16 7183 1 1 12 LYS HZ2 H 7.259 -12.435 2.526 1.00 . A A . 12 LYS HZ2 1 1 16 7184 1 1 12 LYS HZ3 H 7.745 -10.979 1.800 1.00 . A A . 12 LYS HZ3 1 1 16 7185 1 1 12 LYS N N 5.711 -8.413 1.356 1.00 . A A . 12 LYS N 1 1 16 7186 1 1 12 LYS NZ N 7.746 -12.013 1.709 1.00 . A A . 12 LYS NZ 1 1 16 7187 1 1 12 LYS O O 3.712 -8.967 4.314 1.00 . A A . 12 LYS O 1 1 16 7188 1 1 13 SER C C 5.410 -5.163 5.026 1.00 . A A . 13 SER C 1 1 16 7189 1 1 13 SER CA C 4.763 -6.559 5.031 1.00 . A A . 13 SER CA 1 1 16 7190 1 1 13 SER CB C 5.510 -7.483 6.000 1.00 . A A . 13 SER CB 1 1 16 7191 1 1 13 SER H H 5.385 -6.753 2.971 1.00 . A A . 13 SER H 1 1 16 7192 1 1 13 SER HA H 3.725 -6.490 5.317 1.00 . A A . 13 SER HA 1 1 16 7193 1 1 13 SER HB2 H 5.312 -8.511 5.749 1.00 . A A . 13 SER HB2 1 1 16 7194 1 1 13 SER HB3 H 6.573 -7.295 5.927 1.00 . A A . 13 SER HB3 1 1 16 7195 1 1 13 SER HG H 4.401 -7.889 7.547 1.00 . A A . 13 SER HG 1 1 16 7196 1 1 13 SER N N 4.892 -7.208 3.685 1.00 . A A . 13 SER N 1 1 16 7197 1 1 13 SER O O 6.037 -4.763 5.989 1.00 . A A . 13 SER O 1 1 16 7198 1 1 13 SER OG O 5.063 -7.230 7.327 1.00 . A A . 13 SER OG 1 1 16 7199 1 1 14 THR C C 5.112 -2.098 4.845 1.00 . A A . 14 THR C 1 1 16 7200 1 1 14 THR CA C 5.872 -3.049 3.905 1.00 . A A . 14 THR CA 1 1 16 7201 1 1 14 THR CB C 5.772 -2.590 2.437 1.00 . A A . 14 THR CB 1 1 16 7202 1 1 14 THR CG2 C 4.316 -2.625 1.956 1.00 . A A . 14 THR CG2 1 1 16 7203 1 1 14 THR H H 4.750 -4.756 3.189 1.00 . A A . 14 THR H 1 1 16 7204 1 1 14 THR HA H 6.910 -3.100 4.198 1.00 . A A . 14 THR HA 1 1 16 7205 1 1 14 THR HB H 6.364 -3.247 1.818 1.00 . A A . 14 THR HB 1 1 16 7206 1 1 14 THR HG1 H 6.523 -1.117 1.407 1.00 . A A . 14 THR HG1 1 1 16 7207 1 1 14 THR HG21 H 4.011 -1.635 1.656 1.00 . A A . 14 THR HG21 1 1 16 7208 1 1 14 THR HG22 H 3.678 -2.971 2.756 1.00 . A A . 14 THR HG22 1 1 16 7209 1 1 14 THR HG23 H 4.233 -3.296 1.115 1.00 . A A . 14 THR HG23 1 1 16 7210 1 1 14 THR N N 5.262 -4.417 3.954 1.00 . A A . 14 THR N 1 1 16 7211 1 1 14 THR O O 4.007 -1.677 4.560 1.00 . A A . 14 THR O 1 1 16 7212 1 1 14 THR OG1 O 6.274 -1.264 2.323 1.00 . A A . 14 THR OG1 1 1 16 7213 1 1 15 PHE C C 4.938 0.568 6.340 1.00 . A A . 15 PHE C 1 1 16 7214 1 1 15 PHE CA C 5.017 -0.844 6.933 1.00 . A A . 15 PHE CA 1 1 16 7215 1 1 15 PHE CB C 5.886 -0.860 8.198 1.00 . A A . 15 PHE CB 1 1 16 7216 1 1 15 PHE CD1 C 4.546 -2.802 9.105 1.00 . A A . 15 PHE CD1 1 1 16 7217 1 1 15 PHE CD2 C 5.061 -0.947 10.582 1.00 . A A . 15 PHE CD2 1 1 16 7218 1 1 15 PHE CE1 C 3.863 -3.441 10.147 1.00 . A A . 15 PHE CE1 1 1 16 7219 1 1 15 PHE CE2 C 4.378 -1.587 11.623 1.00 . A A . 15 PHE CE2 1 1 16 7220 1 1 15 PHE CG C 5.146 -1.553 9.322 1.00 . A A . 15 PHE CG 1 1 16 7221 1 1 15 PHE CZ C 3.778 -2.833 11.406 1.00 . A A . 15 PHE CZ 1 1 16 7222 1 1 15 PHE H H 6.591 -2.120 6.178 1.00 . A A . 15 PHE H 1 1 16 7223 1 1 15 PHE HA H 4.029 -1.211 7.160 1.00 . A A . 15 PHE HA 1 1 16 7224 1 1 15 PHE HB2 H 6.807 -1.386 7.998 1.00 . A A . 15 PHE HB2 1 1 16 7225 1 1 15 PHE HB3 H 6.111 0.155 8.492 1.00 . A A . 15 PHE HB3 1 1 16 7226 1 1 15 PHE HD1 H 4.610 -3.271 8.135 1.00 . A A . 15 PHE HD1 1 1 16 7227 1 1 15 PHE HD2 H 5.523 0.015 10.751 1.00 . A A . 15 PHE HD2 1 1 16 7228 1 1 15 PHE HE1 H 3.400 -4.402 9.980 1.00 . A A . 15 PHE HE1 1 1 16 7229 1 1 15 PHE HE2 H 4.313 -1.118 12.596 1.00 . A A . 15 PHE HE2 1 1 16 7230 1 1 15 PHE HZ H 3.251 -3.327 12.209 1.00 . A A . 15 PHE HZ 1 1 16 7231 1 1 15 PHE N N 5.701 -1.764 5.969 1.00 . A A . 15 PHE N 1 1 16 7232 1 1 15 PHE O O 5.919 1.286 6.285 1.00 . A A . 15 PHE O 1 1 16 7233 1 1 16 CYS C C 3.460 3.388 6.381 1.00 . A A . 16 CYS C 1 1 16 7234 1 1 16 CYS CA C 3.614 2.324 5.284 1.00 . A A . 16 CYS CA 1 1 16 7235 1 1 16 CYS CB C 2.349 2.230 4.425 1.00 . A A . 16 CYS CB 1 1 16 7236 1 1 16 CYS H H 3.001 0.359 5.939 1.00 . A A . 16 CYS H 1 1 16 7237 1 1 16 CYS HA H 4.463 2.553 4.659 1.00 . A A . 16 CYS HA 1 1 16 7238 1 1 16 CYS HB2 H 1.502 1.996 5.053 1.00 . A A . 16 CYS HB2 1 1 16 7239 1 1 16 CYS HB3 H 2.179 3.175 3.928 1.00 . A A . 16 CYS HB3 1 1 16 7240 1 1 16 CYS N N 3.773 0.963 5.888 1.00 . A A . 16 CYS N 1 1 16 7241 1 1 16 CYS O O 3.733 3.137 7.541 1.00 . A A . 16 CYS O 1 1 16 7242 1 1 16 CYS SG S 2.562 0.927 3.184 1.00 . A A . 16 CYS SG 1 1 16 7243 1 1 17 CYS C C 1.802 5.302 8.068 1.00 . A A . 17 CYS C 1 1 16 7244 1 1 17 CYS CA C 2.878 5.668 7.036 1.00 . A A . 17 CYS CA 1 1 16 7245 1 1 17 CYS CB C 2.464 6.910 6.239 1.00 . A A . 17 CYS CB 1 1 16 7246 1 1 17 CYS H H 2.836 4.757 5.078 1.00 . A A . 17 CYS H 1 1 16 7247 1 1 17 CYS HA H 3.814 5.852 7.533 1.00 . A A . 17 CYS HA 1 1 16 7248 1 1 17 CYS HB2 H 2.419 6.666 5.188 1.00 . A A . 17 CYS HB2 1 1 16 7249 1 1 17 CYS HB3 H 1.494 7.246 6.572 1.00 . A A . 17 CYS HB3 1 1 16 7250 1 1 17 CYS N N 3.039 4.579 6.021 1.00 . A A . 17 CYS N 1 1 16 7251 1 1 17 CYS O O 2.093 5.117 9.234 1.00 . A A . 17 CYS O 1 1 16 7252 1 1 17 CYS SG S 3.678 8.227 6.497 1.00 . A A . 17 CYS SG 1 1 16 7253 1 1 18 SER C C -1.858 4.626 7.854 1.00 . A A . 18 SER C 1 1 16 7254 1 1 18 SER CA C -0.537 4.850 8.601 1.00 . A A . 18 SER CA 1 1 16 7255 1 1 18 SER CB C -0.661 6.056 9.538 1.00 . A A . 18 SER CB 1 1 16 7256 1 1 18 SER H H 0.362 5.357 6.701 1.00 . A A . 18 SER H 1 1 16 7257 1 1 18 SER HA H -0.277 3.974 9.166 1.00 . A A . 18 SER HA 1 1 16 7258 1 1 18 SER HB2 H -0.036 6.858 9.183 1.00 . A A . 18 SER HB2 1 1 16 7259 1 1 18 SER HB3 H -1.691 6.389 9.562 1.00 . A A . 18 SER HB3 1 1 16 7260 1 1 18 SER HG H -0.999 5.311 11.305 1.00 . A A . 18 SER HG 1 1 16 7261 1 1 18 SER N N 0.565 5.200 7.645 1.00 . A A . 18 SER N 1 1 16 7262 1 1 18 SER O O -2.572 3.676 8.115 1.00 . A A . 18 SER O 1 1 16 7263 1 1 18 SER OG O -0.242 5.679 10.844 1.00 . A A . 18 SER OG 1 1 16 7264 1 1 19 GLY C C -3.156 4.769 4.776 1.00 . A A . 19 GLY C 1 1 16 7265 1 1 19 GLY CA C -3.456 5.345 6.162 1.00 . A A . 19 GLY CA 1 1 16 7266 1 1 19 GLY H H -1.587 6.244 6.741 1.00 . A A . 19 GLY H 1 1 16 7267 1 1 19 GLY HA2 H -4.121 4.680 6.693 1.00 . A A . 19 GLY HA2 1 1 16 7268 1 1 19 GLY HA3 H -3.925 6.310 6.053 1.00 . A A . 19 GLY HA3 1 1 16 7269 1 1 19 GLY N N -2.183 5.494 6.930 1.00 . A A . 19 GLY N 1 1 16 7270 1 1 19 GLY O O -3.845 5.056 3.817 1.00 . A A . 19 GLY O 1 1 16 7271 1 1 20 TYR C C -1.759 1.831 3.435 1.00 . A A . 20 TYR C 1 1 16 7272 1 1 20 TYR CA C -1.778 3.365 3.339 1.00 . A A . 20 TYR CA 1 1 16 7273 1 1 20 TYR CB C -0.377 3.897 3.018 1.00 . A A . 20 TYR CB 1 1 16 7274 1 1 20 TYR CD1 C -1.213 5.861 1.669 1.00 . A A . 20 TYR CD1 1 1 16 7275 1 1 20 TYR CD2 C 0.289 6.274 3.527 1.00 . A A . 20 TYR CD2 1 1 16 7276 1 1 20 TYR CE1 C -1.264 7.234 1.404 1.00 . A A . 20 TYR CE1 1 1 16 7277 1 1 20 TYR CE2 C 0.238 7.647 3.262 1.00 . A A . 20 TYR CE2 1 1 16 7278 1 1 20 TYR CG C -0.438 5.380 2.732 1.00 . A A . 20 TYR CG 1 1 16 7279 1 1 20 TYR CZ C -0.537 8.127 2.200 1.00 . A A . 20 TYR CZ 1 1 16 7280 1 1 20 TYR H H -1.585 3.754 5.453 1.00 . A A . 20 TYR H 1 1 16 7281 1 1 20 TYR HA H -2.477 3.691 2.581 1.00 . A A . 20 TYR HA 1 1 16 7282 1 1 20 TYR HB2 H 0.275 3.720 3.859 1.00 . A A . 20 TYR HB2 1 1 16 7283 1 1 20 TYR HB3 H 0.010 3.383 2.151 1.00 . A A . 20 TYR HB3 1 1 16 7284 1 1 20 TYR HD1 H -1.774 5.172 1.055 1.00 . A A . 20 TYR HD1 1 1 16 7285 1 1 20 TYR HD2 H 0.885 5.905 4.347 1.00 . A A . 20 TYR HD2 1 1 16 7286 1 1 20 TYR HE1 H -1.862 7.605 0.585 1.00 . A A . 20 TYR HE1 1 1 16 7287 1 1 20 TYR HE2 H 0.799 8.337 3.877 1.00 . A A . 20 TYR HE2 1 1 16 7288 1 1 20 TYR HH H -1.278 9.866 2.481 1.00 . A A . 20 TYR HH 1 1 16 7289 1 1 20 TYR N N -2.128 3.963 4.664 1.00 . A A . 20 TYR N 1 1 16 7290 1 1 20 TYR O O -1.007 1.260 4.204 1.00 . A A . 20 TYR O 1 1 16 7291 1 1 20 TYR OH O -0.584 9.482 1.938 1.00 . A A . 20 TYR OH 1 1 16 7292 1 1 21 ASN C C -2.037 -0.897 1.375 1.00 . A A . 21 ASN C 1 1 16 7293 1 1 21 ASN CA C -2.606 -0.336 2.684 1.00 . A A . 21 ASN CA 1 1 16 7294 1 1 21 ASN CB C -4.086 -0.702 2.822 1.00 . A A . 21 ASN CB 1 1 16 7295 1 1 21 ASN CG C -4.230 -1.931 3.724 1.00 . A A . 21 ASN CG 1 1 16 7296 1 1 21 ASN H H -3.166 1.649 2.040 1.00 . A A . 21 ASN H 1 1 16 7297 1 1 21 ASN HA H -2.049 -0.709 3.529 1.00 . A A . 21 ASN HA 1 1 16 7298 1 1 21 ASN HB2 H -4.624 0.128 3.256 1.00 . A A . 21 ASN HB2 1 1 16 7299 1 1 21 ASN HB3 H -4.494 -0.926 1.848 1.00 . A A . 21 ASN HB3 1 1 16 7300 1 1 21 ASN HD21 H -4.310 -3.214 2.209 1.00 . A A . 21 ASN HD21 1 1 16 7301 1 1 21 ASN HD22 H -4.422 -3.907 3.754 1.00 . A A . 21 ASN HD22 1 1 16 7302 1 1 21 ASN N N -2.575 1.163 2.654 1.00 . A A . 21 ASN N 1 1 16 7303 1 1 21 ASN ND2 N -4.328 -3.116 3.184 1.00 . A A . 21 ASN ND2 1 1 16 7304 1 1 21 ASN O O -1.856 -0.177 0.423 1.00 . A A . 21 ASN O 1 1 16 7305 1 1 21 ASN OD1 O -4.255 -1.811 4.932 1.00 . A A . 21 ASN OD1 1 1 16 7306 1 1 22 CYS C C -2.308 -3.226 -0.883 1.00 . A A . 22 CYS C 1 1 16 7307 1 1 22 CYS CA C -1.187 -2.751 0.051 1.00 . A A . 22 CYS CA 1 1 16 7308 1 1 22 CYS CB C -0.324 -3.933 0.498 1.00 . A A . 22 CYS CB 1 1 16 7309 1 1 22 CYS H H -1.903 -2.748 2.095 1.00 . A A . 22 CYS H 1 1 16 7310 1 1 22 CYS HA H -0.570 -2.020 -0.449 1.00 . A A . 22 CYS HA 1 1 16 7311 1 1 22 CYS HB2 H -0.721 -4.344 1.414 1.00 . A A . 22 CYS HB2 1 1 16 7312 1 1 22 CYS HB3 H -0.328 -4.693 -0.269 1.00 . A A . 22 CYS HB3 1 1 16 7313 1 1 22 CYS N N -1.751 -2.173 1.315 1.00 . A A . 22 CYS N 1 1 16 7314 1 1 22 CYS O O -3.326 -3.729 -0.442 1.00 . A A . 22 CYS O 1 1 16 7315 1 1 22 CYS SG S 1.372 -3.370 0.777 1.00 . A A . 22 CYS SG 1 1 16 7316 1 1 23 SER C C -2.912 -4.972 -3.572 1.00 . A A . 23 SER C 1 1 16 7317 1 1 23 SER CA C -3.164 -3.515 -3.153 1.00 . A A . 23 SER CA 1 1 16 7318 1 1 23 SER CB C -3.013 -2.582 -4.357 1.00 . A A . 23 SER CB 1 1 16 7319 1 1 23 SER H H -1.287 -2.668 -2.500 1.00 . A A . 23 SER H 1 1 16 7320 1 1 23 SER HA H -4.147 -3.410 -2.725 1.00 . A A . 23 SER HA 1 1 16 7321 1 1 23 SER HB2 H -2.481 -1.693 -4.065 1.00 . A A . 23 SER HB2 1 1 16 7322 1 1 23 SER HB3 H -2.463 -3.088 -5.138 1.00 . A A . 23 SER HB3 1 1 16 7323 1 1 23 SER HG H -4.522 -1.359 -4.466 1.00 . A A . 23 SER HG 1 1 16 7324 1 1 23 SER N N -2.120 -3.072 -2.173 1.00 . A A . 23 SER N 1 1 16 7325 1 1 23 SER O O -1.778 -5.410 -3.633 1.00 . A A . 23 SER O 1 1 16 7326 1 1 23 SER OG O -4.303 -2.220 -4.831 1.00 . A A . 23 SER OG 1 1 16 7327 1 1 24 PRO C C -3.409 -7.238 -5.716 1.00 . A A . 24 PRO C 1 1 16 7328 1 1 24 PRO CA C -3.879 -7.102 -4.256 1.00 . A A . 24 PRO CA 1 1 16 7329 1 1 24 PRO CB C -5.305 -7.626 -4.103 1.00 . A A . 24 PRO CB 1 1 16 7330 1 1 24 PRO CD C -5.383 -5.224 -3.791 1.00 . A A . 24 PRO CD 1 1 16 7331 1 1 24 PRO CG C -6.184 -6.422 -4.237 1.00 . A A . 24 PRO CG 1 1 16 7332 1 1 24 PRO HA H -3.220 -7.638 -3.596 1.00 . A A . 24 PRO HA 1 1 16 7333 1 1 24 PRO HB2 H -5.525 -8.343 -4.882 1.00 . A A . 24 PRO HB2 1 1 16 7334 1 1 24 PRO HB3 H -5.439 -8.074 -3.131 1.00 . A A . 24 PRO HB3 1 1 16 7335 1 1 24 PRO HD2 H -5.540 -4.394 -4.465 1.00 . A A . 24 PRO HD2 1 1 16 7336 1 1 24 PRO HD3 H -5.646 -4.948 -2.781 1.00 . A A . 24 PRO HD3 1 1 16 7337 1 1 24 PRO HG2 H -6.485 -6.301 -5.269 1.00 . A A . 24 PRO HG2 1 1 16 7338 1 1 24 PRO HG3 H -7.054 -6.529 -3.609 1.00 . A A . 24 PRO HG3 1 1 16 7339 1 1 24 PRO N N -3.985 -5.678 -3.845 1.00 . A A . 24 PRO N 1 1 16 7340 1 1 24 PRO O O -2.864 -8.256 -6.099 1.00 . A A . 24 PRO O 1 1 16 7341 1 1 25 THR C C -2.053 -5.369 -8.279 1.00 . A A . 25 THR C 1 1 16 7342 1 1 25 THR CA C -3.211 -6.330 -7.968 1.00 . A A . 25 THR CA 1 1 16 7343 1 1 25 THR CB C -4.459 -5.947 -8.772 1.00 . A A . 25 THR CB 1 1 16 7344 1 1 25 THR CG2 C -4.195 -6.150 -10.267 1.00 . A A . 25 THR CG2 1 1 16 7345 1 1 25 THR H H -4.083 -5.430 -6.209 1.00 . A A . 25 THR H 1 1 16 7346 1 1 25 THR HA H -2.924 -7.340 -8.206 1.00 . A A . 25 THR HA 1 1 16 7347 1 1 25 THR HB H -4.700 -4.909 -8.593 1.00 . A A . 25 THR HB 1 1 16 7348 1 1 25 THR HG1 H -6.102 -6.251 -7.776 1.00 . A A . 25 THR HG1 1 1 16 7349 1 1 25 THR HG21 H -3.266 -5.672 -10.537 1.00 . A A . 25 THR HG21 1 1 16 7350 1 1 25 THR HG22 H -5.002 -5.715 -10.838 1.00 . A A . 25 THR HG22 1 1 16 7351 1 1 25 THR HG23 H -4.133 -7.207 -10.480 1.00 . A A . 25 THR HG23 1 1 16 7352 1 1 25 THR N N -3.631 -6.236 -6.533 1.00 . A A . 25 THR N 1 1 16 7353 1 1 25 THR O O -1.233 -5.642 -9.135 1.00 . A A . 25 THR O 1 1 16 7354 1 1 25 THR OG1 O -5.551 -6.764 -8.372 1.00 . A A . 25 THR OG1 1 1 16 7355 1 1 26 TRP C C 0.421 -3.706 -7.178 1.00 . A A . 26 TRP C 1 1 16 7356 1 1 26 TRP CA C -0.872 -3.277 -7.882 1.00 . A A . 26 TRP CA 1 1 16 7357 1 1 26 TRP CB C -1.356 -1.926 -7.344 1.00 . A A . 26 TRP CB 1 1 16 7358 1 1 26 TRP CD1 C -3.226 -2.156 -9.048 1.00 . A A . 26 TRP CD1 1 1 16 7359 1 1 26 TRP CD2 C -3.629 -0.553 -7.524 1.00 . A A . 26 TRP CD2 1 1 16 7360 1 1 26 TRP CE2 C -4.742 -0.574 -8.395 1.00 . A A . 26 TRP CE2 1 1 16 7361 1 1 26 TRP CE3 C -3.631 0.375 -6.470 1.00 . A A . 26 TRP CE3 1 1 16 7362 1 1 26 TRP CG C -2.681 -1.569 -7.955 1.00 . A A . 26 TRP CG 1 1 16 7363 1 1 26 TRP CH2 C -5.806 1.211 -7.172 1.00 . A A . 26 TRP CH2 1 1 16 7364 1 1 26 TRP CZ2 C -5.820 0.294 -8.226 1.00 . A A . 26 TRP CZ2 1 1 16 7365 1 1 26 TRP CZ3 C -4.712 1.251 -6.296 1.00 . A A . 26 TRP CZ3 1 1 16 7366 1 1 26 TRP H H -2.654 -4.045 -6.923 1.00 . A A . 26 TRP H 1 1 16 7367 1 1 26 TRP HA H -0.705 -3.203 -8.945 1.00 . A A . 26 TRP HA 1 1 16 7368 1 1 26 TRP HB2 H -1.459 -1.982 -6.272 1.00 . A A . 26 TRP HB2 1 1 16 7369 1 1 26 TRP HB3 H -0.632 -1.169 -7.594 1.00 . A A . 26 TRP HB3 1 1 16 7370 1 1 26 TRP HD1 H -2.780 -2.956 -9.619 1.00 . A A . 26 TRP HD1 1 1 16 7371 1 1 26 TRP HE1 H -5.050 -1.816 -10.037 1.00 . A A . 26 TRP HE1 1 1 16 7372 1 1 26 TRP HE3 H -2.794 0.413 -5.791 1.00 . A A . 26 TRP HE3 1 1 16 7373 1 1 26 TRP HH2 H -6.635 1.887 -7.034 1.00 . A A . 26 TRP HH2 1 1 16 7374 1 1 26 TRP HZ2 H -6.659 0.258 -8.905 1.00 . A A . 26 TRP HZ2 1 1 16 7375 1 1 26 TRP HZ3 H -4.703 1.960 -5.482 1.00 . A A . 26 TRP HZ3 1 1 16 7376 1 1 26 TRP N N -1.980 -4.250 -7.603 1.00 . A A . 26 TRP N 1 1 16 7377 1 1 26 TRP NE1 N -4.450 -1.570 -9.305 1.00 . A A . 26 TRP NE1 1 1 16 7378 1 1 26 TRP O O 1.502 -3.299 -7.560 1.00 . A A . 26 TRP O 1 1 16 7379 1 1 27 LYS C C 2.256 -3.881 -4.689 1.00 . A A . 27 LYS C 1 1 16 7380 1 1 27 LYS CA C 1.529 -5.020 -5.427 1.00 . A A . 27 LYS CA 1 1 16 7381 1 1 27 LYS CB C 2.435 -5.635 -6.506 1.00 . A A . 27 LYS CB 1 1 16 7382 1 1 27 LYS CD C 3.989 -7.151 -5.263 1.00 . A A . 27 LYS CD 1 1 16 7383 1 1 27 LYS CE C 3.879 -8.341 -4.305 1.00 . A A . 27 LYS CE 1 1 16 7384 1 1 27 LYS CG C 2.746 -7.092 -6.154 1.00 . A A . 27 LYS CG 1 1 16 7385 1 1 27 LYS H H -0.568 -4.849 -5.883 1.00 . A A . 27 LYS H 1 1 16 7386 1 1 27 LYS HA H 1.245 -5.785 -4.723 1.00 . A A . 27 LYS HA 1 1 16 7387 1 1 27 LYS HB2 H 1.932 -5.598 -7.461 1.00 . A A . 27 LYS HB2 1 1 16 7388 1 1 27 LYS HB3 H 3.357 -5.077 -6.564 1.00 . A A . 27 LYS HB3 1 1 16 7389 1 1 27 LYS HD2 H 4.869 -7.262 -5.880 1.00 . A A . 27 LYS HD2 1 1 16 7390 1 1 27 LYS HD3 H 4.065 -6.238 -4.691 1.00 . A A . 27 LYS HD3 1 1 16 7391 1 1 27 LYS HE2 H 4.181 -8.049 -3.309 1.00 . A A . 27 LYS HE2 1 1 16 7392 1 1 27 LYS HE3 H 2.872 -8.726 -4.298 1.00 . A A . 27 LYS HE3 1 1 16 7393 1 1 27 LYS HG2 H 1.906 -7.524 -5.631 1.00 . A A . 27 LYS HG2 1 1 16 7394 1 1 27 LYS HG3 H 2.930 -7.649 -7.060 1.00 . A A . 27 LYS HG3 1 1 16 7395 1 1 27 LYS HZ1 H 4.777 -10.221 -4.257 1.00 . A A . 27 LYS HZ1 1 1 16 7396 1 1 27 LYS HZ2 H 5.782 -8.990 -4.855 1.00 . A A . 27 LYS HZ2 1 1 16 7397 1 1 27 LYS HZ3 H 4.532 -9.615 -5.822 1.00 . A A . 27 LYS HZ3 1 1 16 7398 1 1 27 LYS N N 0.316 -4.533 -6.161 1.00 . A A . 27 LYS N 1 1 16 7399 1 1 27 LYS NZ N 4.813 -9.369 -4.851 1.00 . A A . 27 LYS NZ 1 1 16 7400 1 1 27 LYS O O 3.420 -4.007 -4.362 1.00 . A A . 27 LYS O 1 1 16 7401 1 1 28 TRP C C 1.308 -0.989 -2.679 1.00 . A A . 28 TRP C 1 1 16 7402 1 1 28 TRP CA C 2.277 -1.678 -3.654 1.00 . A A . 28 TRP CA 1 1 16 7403 1 1 28 TRP CB C 2.829 -0.699 -4.711 1.00 . A A . 28 TRP CB 1 1 16 7404 1 1 28 TRP CD1 C 0.664 0.608 -5.007 1.00 . A A . 28 TRP CD1 1 1 16 7405 1 1 28 TRP CD2 C 1.640 0.078 -6.960 1.00 . A A . 28 TRP CD2 1 1 16 7406 1 1 28 TRP CE2 C 0.465 0.796 -7.277 1.00 . A A . 28 TRP CE2 1 1 16 7407 1 1 28 TRP CE3 C 2.446 -0.375 -8.017 1.00 . A A . 28 TRP CE3 1 1 16 7408 1 1 28 TRP CG C 1.742 -0.039 -5.512 1.00 . A A . 28 TRP CG 1 1 16 7409 1 1 28 TRP CH2 C 0.916 0.601 -9.638 1.00 . A A . 28 TRP CH2 1 1 16 7410 1 1 28 TRP CZ2 C 0.103 1.058 -8.598 1.00 . A A . 28 TRP CZ2 1 1 16 7411 1 1 28 TRP CZ3 C 2.086 -0.114 -9.348 1.00 . A A . 28 TRP CZ3 1 1 16 7412 1 1 28 TRP H H 0.647 -2.696 -4.650 1.00 . A A . 28 TRP H 1 1 16 7413 1 1 28 TRP HA H 3.104 -2.091 -3.094 1.00 . A A . 28 TRP HA 1 1 16 7414 1 1 28 TRP HB2 H 3.405 0.065 -4.214 1.00 . A A . 28 TRP HB2 1 1 16 7415 1 1 28 TRP HB3 H 3.480 -1.242 -5.384 1.00 . A A . 28 TRP HB3 1 1 16 7416 1 1 28 TRP HD1 H 0.433 0.718 -3.960 1.00 . A A . 28 TRP HD1 1 1 16 7417 1 1 28 TRP HE1 H -0.931 1.599 -5.960 1.00 . A A . 28 TRP HE1 1 1 16 7418 1 1 28 TRP HE3 H 3.349 -0.925 -7.803 1.00 . A A . 28 TRP HE3 1 1 16 7419 1 1 28 TRP HH2 H 0.644 0.800 -10.664 1.00 . A A . 28 TRP HH2 1 1 16 7420 1 1 28 TRP HZ2 H -0.800 1.610 -8.815 1.00 . A A . 28 TRP HZ2 1 1 16 7421 1 1 28 TRP HZ3 H 2.713 -0.466 -10.153 1.00 . A A . 28 TRP HZ3 1 1 16 7422 1 1 28 TRP N N 1.591 -2.782 -4.400 1.00 . A A . 28 TRP N 1 1 16 7423 1 1 28 TRP NE1 N -0.095 1.097 -6.055 1.00 . A A . 28 TRP NE1 1 1 16 7424 1 1 28 TRP O O 0.109 -1.192 -2.731 1.00 . A A . 28 TRP O 1 1 16 7425 1 1 29 CYS C C 0.106 1.583 -1.448 1.00 . A A . 29 CYS C 1 1 16 7426 1 1 29 CYS CA C 0.960 0.503 -0.777 1.00 . A A . 29 CYS CA 1 1 16 7427 1 1 29 CYS CB C 1.918 1.133 0.237 1.00 . A A . 29 CYS CB 1 1 16 7428 1 1 29 CYS H H 2.802 -0.060 -1.749 1.00 . A A . 29 CYS H 1 1 16 7429 1 1 29 CYS HA H 0.327 -0.214 -0.279 1.00 . A A . 29 CYS HA 1 1 16 7430 1 1 29 CYS HB2 H 2.797 0.516 0.335 1.00 . A A . 29 CYS HB2 1 1 16 7431 1 1 29 CYS HB3 H 2.205 2.119 -0.101 1.00 . A A . 29 CYS HB3 1 1 16 7432 1 1 29 CYS N N 1.832 -0.190 -1.777 1.00 . A A . 29 CYS N 1 1 16 7433 1 1 29 CYS O O 0.568 2.322 -2.290 1.00 . A A . 29 CYS O 1 1 16 7434 1 1 29 CYS SG S 1.094 1.264 1.841 1.00 . A A . 29 CYS SG 1 1 16 7435 1 1 30 VAL C C -2.862 3.339 -0.509 1.00 . A A . 30 VAL C 1 1 16 7436 1 1 30 VAL CA C -2.072 2.680 -1.642 1.00 . A A . 30 VAL CA 1 1 16 7437 1 1 30 VAL CB C -3.021 1.885 -2.552 1.00 . A A . 30 VAL CB 1 1 16 7438 1 1 30 VAL CG1 C -2.232 1.259 -3.702 1.00 . A A . 30 VAL CG1 1 1 16 7439 1 1 30 VAL CG2 C -3.710 0.775 -1.746 1.00 . A A . 30 VAL CG2 1 1 16 7440 1 1 30 VAL H H -1.470 1.051 -0.378 1.00 . A A . 30 VAL H 1 1 16 7441 1 1 30 VAL HA H -1.533 3.417 -2.215 1.00 . A A . 30 VAL HA 1 1 16 7442 1 1 30 VAL HB H -3.769 2.551 -2.956 1.00 . A A . 30 VAL HB 1 1 16 7443 1 1 30 VAL HG11 H -2.417 1.814 -4.608 1.00 . A A . 30 VAL HG11 1 1 16 7444 1 1 30 VAL HG12 H -2.545 0.234 -3.837 1.00 . A A . 30 VAL HG12 1 1 16 7445 1 1 30 VAL HG13 H -1.179 1.285 -3.473 1.00 . A A . 30 VAL HG13 1 1 16 7446 1 1 30 VAL HG21 H -3.037 -0.065 -1.642 1.00 . A A . 30 VAL HG21 1 1 16 7447 1 1 30 VAL HG22 H -4.603 0.456 -2.260 1.00 . A A . 30 VAL HG22 1 1 16 7448 1 1 30 VAL HG23 H -3.972 1.148 -0.766 1.00 . A A . 30 VAL HG23 1 1 16 7449 1 1 30 VAL N N -1.139 1.666 -1.064 1.00 . A A . 30 VAL N 1 1 16 7450 1 1 30 VAL O O -2.693 2.999 0.643 1.00 . A A . 30 VAL O 1 1 16 7451 1 1 31 TYR C C -5.406 3.868 0.980 1.00 . A A . 31 TYR C 1 1 16 7452 1 1 31 TYR CA C -4.547 4.917 0.253 1.00 . A A . 31 TYR CA 1 1 16 7453 1 1 31 TYR CB C -5.439 5.939 -0.471 1.00 . A A . 31 TYR CB 1 1 16 7454 1 1 31 TYR CD1 C -7.594 4.684 -0.875 1.00 . A A . 31 TYR CD1 1 1 16 7455 1 1 31 TYR CD2 C -6.106 5.075 -2.749 1.00 . A A . 31 TYR CD2 1 1 16 7456 1 1 31 TYR CE1 C -8.481 4.007 -1.720 1.00 . A A . 31 TYR CE1 1 1 16 7457 1 1 31 TYR CE2 C -6.991 4.394 -3.593 1.00 . A A . 31 TYR CE2 1 1 16 7458 1 1 31 TYR CG C -6.406 5.219 -1.389 1.00 . A A . 31 TYR CG 1 1 16 7459 1 1 31 TYR CZ C -8.180 3.860 -3.080 1.00 . A A . 31 TYR CZ 1 1 16 7460 1 1 31 TYR H H -3.866 4.509 -1.760 1.00 . A A . 31 TYR H 1 1 16 7461 1 1 31 TYR HA H -3.899 5.420 0.955 1.00 . A A . 31 TYR HA 1 1 16 7462 1 1 31 TYR HB2 H -5.994 6.511 0.259 1.00 . A A . 31 TYR HB2 1 1 16 7463 1 1 31 TYR HB3 H -4.821 6.607 -1.054 1.00 . A A . 31 TYR HB3 1 1 16 7464 1 1 31 TYR HD1 H -7.829 4.797 0.174 1.00 . A A . 31 TYR HD1 1 1 16 7465 1 1 31 TYR HD2 H -5.189 5.486 -3.146 1.00 . A A . 31 TYR HD2 1 1 16 7466 1 1 31 TYR HE1 H -9.397 3.596 -1.323 1.00 . A A . 31 TYR HE1 1 1 16 7467 1 1 31 TYR HE2 H -6.759 4.284 -4.642 1.00 . A A . 31 TYR HE2 1 1 16 7468 1 1 31 TYR HH H -9.019 2.251 -3.678 1.00 . A A . 31 TYR HH 1 1 16 7469 1 1 31 TYR N N -3.736 4.259 -0.822 1.00 . A A . 31 TYR N 1 1 16 7470 1 1 31 TYR O O -5.675 2.801 0.456 1.00 . A A . 31 TYR O 1 1 16 7471 1 1 31 TYR OH O -9.050 3.185 -3.910 1.00 . A A . 31 TYR OH 1 1 16 7472 1 1 32 ALA C C -7.931 3.896 3.486 1.00 . A A . 32 ALA C 1 1 16 7473 1 1 32 ALA CA C -6.680 3.194 2.943 1.00 . A A . 32 ALA CA 1 1 16 7474 1 1 32 ALA CB C -5.791 2.707 4.090 1.00 . A A . 32 ALA CB 1 1 16 7475 1 1 32 ALA H H -5.609 5.031 2.578 1.00 . A A . 32 ALA H 1 1 16 7476 1 1 32 ALA HA H -6.960 2.361 2.314 1.00 . A A . 32 ALA HA 1 1 16 7477 1 1 32 ALA HB1 H -5.646 3.509 4.798 1.00 . A A . 32 ALA HB1 1 1 16 7478 1 1 32 ALA HB2 H -4.835 2.394 3.697 1.00 . A A . 32 ALA HB2 1 1 16 7479 1 1 32 ALA HB3 H -6.267 1.873 4.584 1.00 . A A . 32 ALA HB3 1 1 16 7480 1 1 32 ALA N N -5.837 4.165 2.179 1.00 . A A . 32 ALA N 1 1 16 7481 1 1 32 ALA O O -8.068 5.101 3.386 1.00 . A A . 32 ALA O 1 1 16 7482 1 1 33 ARG C C -10.144 3.612 6.129 1.00 . A A . 33 ARG C 1 1 16 7483 1 1 33 ARG CA C -10.090 3.774 4.604 1.00 . A A . 33 ARG CA 1 1 16 7484 1 1 33 ARG CB C -11.241 3.013 3.941 1.00 . A A . 33 ARG CB 1 1 16 7485 1 1 33 ARG CD C -12.866 3.029 2.038 1.00 . A A . 33 ARG CD 1 1 16 7486 1 1 33 ARG CG C -11.648 3.726 2.650 1.00 . A A . 33 ARG CG 1 1 16 7487 1 1 33 ARG CZ C -12.799 4.065 -0.157 1.00 . A A . 33 ARG CZ 1 1 16 7488 1 1 33 ARG H H -8.714 2.181 4.123 1.00 . A A . 33 ARG H 1 1 16 7489 1 1 33 ARG HA H -10.137 4.817 4.334 1.00 . A A . 33 ARG HA 1 1 16 7490 1 1 33 ARG HB2 H -10.924 2.005 3.713 1.00 . A A . 33 ARG HB2 1 1 16 7491 1 1 33 ARG HB3 H -12.086 2.981 4.613 1.00 . A A . 33 ARG HB3 1 1 16 7492 1 1 33 ARG HD2 H -12.571 2.097 1.577 1.00 . A A . 33 ARG HD2 1 1 16 7493 1 1 33 ARG HD3 H -13.619 2.855 2.792 1.00 . A A . 33 ARG HD3 1 1 16 7494 1 1 33 ARG HE H -14.158 4.542 1.213 1.00 . A A . 33 ARG HE 1 1 16 7495 1 1 33 ARG HG2 H -11.894 4.755 2.870 1.00 . A A . 33 ARG HG2 1 1 16 7496 1 1 33 ARG HG3 H -10.828 3.695 1.948 1.00 . A A . 33 ARG HG3 1 1 16 7497 1 1 33 ARG HH11 H -13.473 2.288 -0.797 1.00 . A A . 33 ARG HH11 1 1 16 7498 1 1 33 ARG HH12 H -12.483 3.161 -1.919 1.00 . A A . 33 ARG HH12 1 1 16 7499 1 1 33 ARG HH21 H -11.988 5.864 0.209 1.00 . A A . 33 ARG HH21 1 1 16 7500 1 1 33 ARG HH22 H -11.642 5.189 -1.349 1.00 . A A . 33 ARG HH22 1 1 16 7501 1 1 33 ARG N N -8.845 3.152 4.056 1.00 . A A . 33 ARG N 1 1 16 7502 1 1 33 ARG NE N -13.382 3.980 1.012 1.00 . A A . 33 ARG NE 1 1 16 7503 1 1 33 ARG NH1 N -12.928 3.096 -1.025 1.00 . A A . 33 ARG NH1 1 1 16 7504 1 1 33 ARG NH2 N -12.087 5.122 -0.455 1.00 . A A . 33 ARG NH2 1 1 16 7505 1 1 33 ARG O O -9.671 2.627 6.665 1.00 . A A . 33 ARG O 1 1 16 7506 1 1 34 PRO C C -11.893 3.522 8.697 1.00 . A A . 34 PRO C 1 1 16 7507 1 1 34 PRO CA C -10.849 4.561 8.263 1.00 . A A . 34 PRO CA 1 1 16 7508 1 1 34 PRO CB C -11.299 5.980 8.617 1.00 . A A . 34 PRO CB 1 1 16 7509 1 1 34 PRO CD C -11.320 5.811 6.208 1.00 . A A . 34 PRO CD 1 1 16 7510 1 1 34 PRO CG C -11.969 6.495 7.384 1.00 . A A . 34 PRO CG 1 1 16 7511 1 1 34 PRO HA H -9.893 4.355 8.718 1.00 . A A . 34 PRO HA 1 1 16 7512 1 1 34 PRO HB2 H -11.994 5.957 9.445 1.00 . A A . 34 PRO HB2 1 1 16 7513 1 1 34 PRO HB3 H -10.445 6.595 8.857 1.00 . A A . 34 PRO HB3 1 1 16 7514 1 1 34 PRO HD2 H -12.060 5.561 5.461 1.00 . A A . 34 PRO HD2 1 1 16 7515 1 1 34 PRO HD3 H -10.548 6.436 5.785 1.00 . A A . 34 PRO HD3 1 1 16 7516 1 1 34 PRO HG2 H -13.024 6.259 7.414 1.00 . A A . 34 PRO HG2 1 1 16 7517 1 1 34 PRO HG3 H -11.830 7.562 7.306 1.00 . A A . 34 PRO HG3 1 1 16 7518 1 1 34 PRO N N -10.727 4.593 6.781 1.00 . A A . 34 PRO N 1 1 16 7519 1 1 34 PRO O O -11.528 2.622 9.433 1.00 . A A . 34 PRO O 1 1 16 7520 1 1 34 PRO OXT O -13.036 3.642 8.283 1.00 . A A . 34 PRO OXT 1 1 17 7521 1 1 1 GLY C C 8.590 3.849 6.351 1.00 . A A . 1 GLY C 1 1 17 7522 1 1 1 GLY CA C 9.798 2.984 6.730 1.00 . A A . 1 GLY CA 1 1 17 7523 1 1 1 GLY H1 H 10.912 4.719 7.042 1.00 . A A . 1 GLY H1 1 1 17 7524 1 1 1 GLY H2 H 11.294 3.900 5.603 1.00 . A A . 1 GLY H2 1 1 17 7525 1 1 1 GLY H3 H 11.827 3.292 7.097 1.00 . A A . 1 GLY H3 1 1 17 7526 1 1 1 GLY HA2 H 9.851 2.131 6.069 1.00 . A A . 1 GLY HA2 1 1 17 7527 1 1 1 GLY HA3 H 9.685 2.644 7.748 1.00 . A A . 1 GLY HA3 1 1 17 7528 1 1 1 GLY N N 11.052 3.784 6.609 1.00 . A A . 1 GLY N 1 1 17 7529 1 1 1 GLY O O 7.687 4.044 7.142 1.00 . A A . 1 GLY O 1 1 17 7530 1 1 2 CYS C C 7.236 5.115 3.188 1.00 . A A . 2 CYS C 1 1 17 7531 1 1 2 CYS CA C 7.423 5.220 4.706 1.00 . A A . 2 CYS CA 1 1 17 7532 1 1 2 CYS CB C 7.811 6.647 5.106 1.00 . A A . 2 CYS CB 1 1 17 7533 1 1 2 CYS H H 9.311 4.191 4.529 1.00 . A A . 2 CYS H 1 1 17 7534 1 1 2 CYS HA H 6.518 4.928 5.218 1.00 . A A . 2 CYS HA 1 1 17 7535 1 1 2 CYS HB2 H 7.757 6.747 6.180 1.00 . A A . 2 CYS HB2 1 1 17 7536 1 1 2 CYS HB3 H 8.818 6.852 4.777 1.00 . A A . 2 CYS HB3 1 1 17 7537 1 1 2 CYS N N 8.570 4.366 5.146 1.00 . A A . 2 CYS N 1 1 17 7538 1 1 2 CYS O O 8.164 5.317 2.426 1.00 . A A . 2 CYS O 1 1 17 7539 1 1 2 CYS SG S 6.673 7.827 4.336 1.00 . A A . 2 CYS SG 1 1 17 7540 1 1 3 GLY C C 4.924 5.867 0.823 1.00 . A A . 3 GLY C 1 1 17 7541 1 1 3 GLY CA C 5.787 4.689 1.280 1.00 . A A . 3 GLY CA 1 1 17 7542 1 1 3 GLY H H 5.313 4.650 3.380 1.00 . A A . 3 GLY H 1 1 17 7543 1 1 3 GLY HA2 H 6.727 4.699 0.747 1.00 . A A . 3 GLY HA2 1 1 17 7544 1 1 3 GLY HA3 H 5.266 3.766 1.077 1.00 . A A . 3 GLY HA3 1 1 17 7545 1 1 3 GLY N N 6.043 4.804 2.746 1.00 . A A . 3 GLY N 1 1 17 7546 1 1 3 GLY O O 5.320 7.012 0.929 1.00 . A A . 3 GLY O 1 1 17 7547 1 1 4 GLY C C 1.634 6.102 -0.855 1.00 . A A . 4 GLY C 1 1 17 7548 1 1 4 GLY CA C 2.850 6.695 -0.140 1.00 . A A . 4 GLY CA 1 1 17 7549 1 1 4 GLY H H 3.450 4.661 0.251 1.00 . A A . 4 GLY H 1 1 17 7550 1 1 4 GLY HA2 H 2.522 7.273 0.712 1.00 . A A . 4 GLY HA2 1 1 17 7551 1 1 4 GLY HA3 H 3.387 7.335 -0.823 1.00 . A A . 4 GLY HA3 1 1 17 7552 1 1 4 GLY N N 3.747 5.594 0.321 1.00 . A A . 4 GLY N 1 1 17 7553 1 1 4 GLY O O 0.955 5.238 -0.330 1.00 . A A . 4 GLY O 1 1 17 7554 1 1 5 LEU C C 0.635 5.120 -3.965 1.00 . A A . 5 LEU C 1 1 17 7555 1 1 5 LEU CA C 0.180 6.027 -2.809 1.00 . A A . 5 LEU CA 1 1 17 7556 1 1 5 LEU CB C -0.541 7.263 -3.346 1.00 . A A . 5 LEU CB 1 1 17 7557 1 1 5 LEU CD1 C -2.601 8.442 -2.561 1.00 . A A . 5 LEU CD1 1 1 17 7558 1 1 5 LEU CD2 C -2.746 6.762 -4.408 1.00 . A A . 5 LEU CD2 1 1 17 7559 1 1 5 LEU CG C -2.044 7.121 -3.095 1.00 . A A . 5 LEU CG 1 1 17 7560 1 1 5 LEU H H 1.917 7.257 -2.450 1.00 . A A . 5 LEU H 1 1 17 7561 1 1 5 LEU HA H -0.475 5.483 -2.146 1.00 . A A . 5 LEU HA 1 1 17 7562 1 1 5 LEU HB2 H -0.171 8.144 -2.839 1.00 . A A . 5 LEU HB2 1 1 17 7563 1 1 5 LEU HB3 H -0.360 7.355 -4.406 1.00 . A A . 5 LEU HB3 1 1 17 7564 1 1 5 LEU HD11 H -1.856 8.924 -1.946 1.00 . A A . 5 LEU HD11 1 1 17 7565 1 1 5 LEU HD12 H -3.482 8.246 -1.969 1.00 . A A . 5 LEU HD12 1 1 17 7566 1 1 5 LEU HD13 H -2.857 9.086 -3.388 1.00 . A A . 5 LEU HD13 1 1 17 7567 1 1 5 LEU HD21 H -3.769 6.483 -4.203 1.00 . A A . 5 LEU HD21 1 1 17 7568 1 1 5 LEU HD22 H -2.234 5.934 -4.874 1.00 . A A . 5 LEU HD22 1 1 17 7569 1 1 5 LEU HD23 H -2.729 7.614 -5.070 1.00 . A A . 5 LEU HD23 1 1 17 7570 1 1 5 LEU HG H -2.215 6.340 -2.369 1.00 . A A . 5 LEU HG 1 1 17 7571 1 1 5 LEU N N 1.354 6.561 -2.050 1.00 . A A . 5 LEU N 1 1 17 7572 1 1 5 LEU O O -0.174 4.478 -4.610 1.00 . A A . 5 LEU O 1 1 17 7573 1 1 6 MET C C 3.829 3.663 -4.979 1.00 . A A . 6 MET C 1 1 17 7574 1 1 6 MET CA C 2.427 4.182 -5.328 1.00 . A A . 6 MET CA 1 1 17 7575 1 1 6 MET CB C 2.473 5.088 -6.564 1.00 . A A . 6 MET CB 1 1 17 7576 1 1 6 MET CE C -0.260 6.025 -9.262 1.00 . A A . 6 MET CE 1 1 17 7577 1 1 6 MET CG C 1.355 4.691 -7.532 1.00 . A A . 6 MET CG 1 1 17 7578 1 1 6 MET H H 2.553 5.572 -3.691 1.00 . A A . 6 MET H 1 1 17 7579 1 1 6 MET HA H 1.752 3.358 -5.499 1.00 . A A . 6 MET HA 1 1 17 7580 1 1 6 MET HB2 H 2.339 6.117 -6.261 1.00 . A A . 6 MET HB2 1 1 17 7581 1 1 6 MET HB3 H 3.427 4.980 -7.056 1.00 . A A . 6 MET HB3 1 1 17 7582 1 1 6 MET HE1 H -0.763 6.954 -9.493 1.00 . A A . 6 MET HE1 1 1 17 7583 1 1 6 MET HE2 H -0.880 5.197 -9.564 1.00 . A A . 6 MET HE2 1 1 17 7584 1 1 6 MET HE3 H 0.683 5.979 -9.788 1.00 . A A . 6 MET HE3 1 1 17 7585 1 1 6 MET HG2 H 1.754 4.627 -8.535 1.00 . A A . 6 MET HG2 1 1 17 7586 1 1 6 MET HG3 H 0.953 3.731 -7.244 1.00 . A A . 6 MET HG3 1 1 17 7587 1 1 6 MET N N 1.918 5.054 -4.226 1.00 . A A . 6 MET N 1 1 17 7588 1 1 6 MET O O 4.642 3.405 -5.848 1.00 . A A . 6 MET O 1 1 17 7589 1 1 6 MET SD S 0.043 5.936 -7.480 1.00 . A A . 6 MET SD 1 1 17 7590 1 1 7 ALA C C 5.490 1.477 -3.317 1.00 . A A . 7 ALA C 1 1 17 7591 1 1 7 ALA CA C 5.461 3.009 -3.288 1.00 . A A . 7 ALA CA 1 1 17 7592 1 1 7 ALA CB C 5.650 3.523 -1.861 1.00 . A A . 7 ALA CB 1 1 17 7593 1 1 7 ALA H H 3.440 3.721 -3.025 1.00 . A A . 7 ALA H 1 1 17 7594 1 1 7 ALA HA H 6.228 3.412 -3.930 1.00 . A A . 7 ALA HA 1 1 17 7595 1 1 7 ALA HB1 H 5.013 2.966 -1.188 1.00 . A A . 7 ALA HB1 1 1 17 7596 1 1 7 ALA HB2 H 5.390 4.570 -1.817 1.00 . A A . 7 ALA HB2 1 1 17 7597 1 1 7 ALA HB3 H 6.681 3.398 -1.566 1.00 . A A . 7 ALA HB3 1 1 17 7598 1 1 7 ALA N N 4.115 3.508 -3.707 1.00 . A A . 7 ALA N 1 1 17 7599 1 1 7 ALA O O 4.501 0.825 -3.051 1.00 . A A . 7 ALA O 1 1 17 7600 1 1 8 GLY C C 6.382 -1.188 -2.325 1.00 . A A . 8 GLY C 1 1 17 7601 1 1 8 GLY CA C 6.726 -0.588 -3.694 1.00 . A A . 8 GLY CA 1 1 17 7602 1 1 8 GLY H H 7.405 1.451 -3.852 1.00 . A A . 8 GLY H 1 1 17 7603 1 1 8 GLY HA2 H 6.040 -0.968 -4.438 1.00 . A A . 8 GLY HA2 1 1 17 7604 1 1 8 GLY HA3 H 7.734 -0.866 -3.959 1.00 . A A . 8 GLY HA3 1 1 17 7605 1 1 8 GLY N N 6.621 0.902 -3.641 1.00 . A A . 8 GLY N 1 1 17 7606 1 1 8 GLY O O 6.978 -0.847 -1.320 1.00 . A A . 8 GLY O 1 1 17 7607 1 1 9 CYS C C 5.104 -4.249 -1.088 1.00 . A A . 9 CYS C 1 1 17 7608 1 1 9 CYS CA C 5.035 -2.716 -0.985 1.00 . A A . 9 CYS CA 1 1 17 7609 1 1 9 CYS CB C 3.595 -2.254 -0.735 1.00 . A A . 9 CYS CB 1 1 17 7610 1 1 9 CYS H H 4.961 -2.341 -3.109 1.00 . A A . 9 CYS H 1 1 17 7611 1 1 9 CYS HA H 5.674 -2.365 -0.191 1.00 . A A . 9 CYS HA 1 1 17 7612 1 1 9 CYS HB2 H 3.329 -2.452 0.293 1.00 . A A . 9 CYS HB2 1 1 17 7613 1 1 9 CYS HB3 H 3.519 -1.193 -0.925 1.00 . A A . 9 CYS HB3 1 1 17 7614 1 1 9 CYS N N 5.424 -2.083 -2.283 1.00 . A A . 9 CYS N 1 1 17 7615 1 1 9 CYS O O 4.495 -4.953 -0.304 1.00 . A A . 9 CYS O 1 1 17 7616 1 1 9 CYS SG S 2.462 -3.145 -1.832 1.00 . A A . 9 CYS SG 1 1 17 7617 1 1 10 ASP C C 6.292 -6.926 -0.871 1.00 . A A . 10 ASP C 1 1 17 7618 1 1 10 ASP CA C 5.949 -6.256 -2.210 1.00 . A A . 10 ASP CA 1 1 17 7619 1 1 10 ASP CB C 7.078 -6.464 -3.226 1.00 . A A . 10 ASP CB 1 1 17 7620 1 1 10 ASP CG C 7.229 -7.958 -3.535 1.00 . A A . 10 ASP CG 1 1 17 7621 1 1 10 ASP H H 6.320 -4.180 -2.666 1.00 . A A . 10 ASP H 1 1 17 7622 1 1 10 ASP HA H 5.027 -6.656 -2.602 1.00 . A A . 10 ASP HA 1 1 17 7623 1 1 10 ASP HB2 H 6.843 -5.931 -4.137 1.00 . A A . 10 ASP HB2 1 1 17 7624 1 1 10 ASP HB3 H 8.004 -6.087 -2.819 1.00 . A A . 10 ASP HB3 1 1 17 7625 1 1 10 ASP N N 5.841 -4.769 -2.048 1.00 . A A . 10 ASP N 1 1 17 7626 1 1 10 ASP O O 7.407 -6.842 -0.389 1.00 . A A . 10 ASP O 1 1 17 7627 1 1 10 ASP OD1 O 6.517 -8.439 -4.401 1.00 . A A . 10 ASP OD1 1 1 17 7628 1 1 10 ASP OD2 O 8.057 -8.596 -2.905 1.00 . A A . 10 ASP OD2 1 1 17 7629 1 1 11 GLY C C 4.275 -8.292 1.837 1.00 . A A . 11 GLY C 1 1 17 7630 1 1 11 GLY CA C 5.577 -8.265 1.032 1.00 . A A . 11 GLY CA 1 1 17 7631 1 1 11 GLY H H 4.444 -7.635 -0.683 1.00 . A A . 11 GLY H 1 1 17 7632 1 1 11 GLY HA2 H 5.916 -9.277 0.856 1.00 . A A . 11 GLY HA2 1 1 17 7633 1 1 11 GLY HA3 H 6.327 -7.724 1.587 1.00 . A A . 11 GLY HA3 1 1 17 7634 1 1 11 GLY N N 5.333 -7.587 -0.272 1.00 . A A . 11 GLY N 1 1 17 7635 1 1 11 GLY O O 3.568 -7.304 1.923 1.00 . A A . 11 GLY O 1 1 17 7636 1 1 12 LYS C C 2.783 -8.657 4.507 1.00 . A A . 12 LYS C 1 1 17 7637 1 1 12 LYS CA C 2.694 -9.516 3.234 1.00 . A A . 12 LYS CA 1 1 17 7638 1 1 12 LYS CB C 2.559 -11.005 3.590 1.00 . A A . 12 LYS CB 1 1 17 7639 1 1 12 LYS CD C 4.514 -12.500 4.074 1.00 . A A . 12 LYS CD 1 1 17 7640 1 1 12 LYS CE C 5.743 -12.669 4.978 1.00 . A A . 12 LYS CE 1 1 17 7641 1 1 12 LYS CG C 3.612 -11.398 4.636 1.00 . A A . 12 LYS CG 1 1 17 7642 1 1 12 LYS H H 4.542 -10.196 2.343 1.00 . A A . 12 LYS H 1 1 17 7643 1 1 12 LYS HA H 1.849 -9.209 2.638 1.00 . A A . 12 LYS HA 1 1 17 7644 1 1 12 LYS HB2 H 1.573 -11.188 3.990 1.00 . A A . 12 LYS HB2 1 1 17 7645 1 1 12 LYS HB3 H 2.700 -11.600 2.701 1.00 . A A . 12 LYS HB3 1 1 17 7646 1 1 12 LYS HD2 H 3.965 -13.430 4.035 1.00 . A A . 12 LYS HD2 1 1 17 7647 1 1 12 LYS HD3 H 4.837 -12.229 3.080 1.00 . A A . 12 LYS HD3 1 1 17 7648 1 1 12 LYS HE2 H 5.466 -12.535 6.015 1.00 . A A . 12 LYS HE2 1 1 17 7649 1 1 12 LYS HE3 H 6.187 -13.642 4.831 1.00 . A A . 12 LYS HE3 1 1 17 7650 1 1 12 LYS HG2 H 4.213 -10.535 4.886 1.00 . A A . 12 LYS HG2 1 1 17 7651 1 1 12 LYS HG3 H 3.117 -11.760 5.525 1.00 . A A . 12 LYS HG3 1 1 17 7652 1 1 12 LYS HZ1 H 7.586 -11.703 5.077 1.00 . A A . 12 LYS HZ1 1 1 17 7653 1 1 12 LYS HZ2 H 6.281 -10.668 4.743 1.00 . A A . 12 LYS HZ2 1 1 17 7654 1 1 12 LYS HZ3 H 6.887 -11.695 3.532 1.00 . A A . 12 LYS HZ3 1 1 17 7655 1 1 12 LYS N N 3.954 -9.417 2.428 1.00 . A A . 12 LYS N 1 1 17 7656 1 1 12 LYS NZ N 6.695 -11.603 4.550 1.00 . A A . 12 LYS NZ 1 1 17 7657 1 1 12 LYS O O 1.788 -8.424 5.170 1.00 . A A . 12 LYS O 1 1 17 7658 1 1 13 SER C C 4.936 -6.099 5.796 1.00 . A A . 13 SER C 1 1 17 7659 1 1 13 SER CA C 4.104 -7.356 6.089 1.00 . A A . 13 SER CA 1 1 17 7660 1 1 13 SER CB C 4.819 -8.262 7.096 1.00 . A A . 13 SER CB 1 1 17 7661 1 1 13 SER H H 4.749 -8.393 4.312 1.00 . A A . 13 SER H 1 1 17 7662 1 1 13 SER HA H 3.133 -7.081 6.470 1.00 . A A . 13 SER HA 1 1 17 7663 1 1 13 SER HB2 H 4.683 -9.294 6.817 1.00 . A A . 13 SER HB2 1 1 17 7664 1 1 13 SER HB3 H 5.876 -8.031 7.102 1.00 . A A . 13 SER HB3 1 1 17 7665 1 1 13 SER HG H 4.673 -7.266 8.762 1.00 . A A . 13 SER HG 1 1 17 7666 1 1 13 SER N N 3.960 -8.192 4.857 1.00 . A A . 13 SER N 1 1 17 7667 1 1 13 SER O O 5.721 -5.660 6.618 1.00 . A A . 13 SER O 1 1 17 7668 1 1 13 SER OG O 4.269 -8.053 8.389 1.00 . A A . 13 SER OG 1 1 17 7669 1 1 14 THR C C 5.059 -3.102 5.178 1.00 . A A . 14 THR C 1 1 17 7670 1 1 14 THR CA C 5.539 -4.268 4.301 1.00 . A A . 14 THR CA 1 1 17 7671 1 1 14 THR CB C 5.263 -3.990 2.815 1.00 . A A . 14 THR CB 1 1 17 7672 1 1 14 THR CG2 C 3.801 -3.578 2.615 1.00 . A A . 14 THR CG2 1 1 17 7673 1 1 14 THR H H 4.119 -5.870 3.992 1.00 . A A . 14 THR H 1 1 17 7674 1 1 14 THR HA H 6.593 -4.437 4.454 1.00 . A A . 14 THR HA 1 1 17 7675 1 1 14 THR HB H 5.463 -4.881 2.237 1.00 . A A . 14 THR HB 1 1 17 7676 1 1 14 THR HG1 H 6.649 -3.280 1.649 1.00 . A A . 14 THR HG1 1 1 17 7677 1 1 14 THR HG21 H 3.188 -4.052 3.365 1.00 . A A . 14 THR HG21 1 1 17 7678 1 1 14 THR HG22 H 3.472 -3.885 1.634 1.00 . A A . 14 THR HG22 1 1 17 7679 1 1 14 THR HG23 H 3.715 -2.504 2.703 1.00 . A A . 14 THR HG23 1 1 17 7680 1 1 14 THR N N 4.763 -5.506 4.636 1.00 . A A . 14 THR N 1 1 17 7681 1 1 14 THR O O 3.916 -3.058 5.596 1.00 . A A . 14 THR O 1 1 17 7682 1 1 14 THR OG1 O 6.112 -2.941 2.369 1.00 . A A . 14 THR OG1 1 1 17 7683 1 1 15 PHE C C 5.436 0.278 5.487 1.00 . A A . 15 PHE C 1 1 17 7684 1 1 15 PHE CA C 5.522 -1.006 6.320 1.00 . A A . 15 PHE CA 1 1 17 7685 1 1 15 PHE CB C 6.623 -0.891 7.377 1.00 . A A . 15 PHE CB 1 1 17 7686 1 1 15 PHE CD1 C 5.016 -1.220 9.299 1.00 . A A . 15 PHE CD1 1 1 17 7687 1 1 15 PHE CD2 C 6.975 -2.643 9.159 1.00 . A A . 15 PHE CD2 1 1 17 7688 1 1 15 PHE CE1 C 4.621 -1.878 10.470 1.00 . A A . 15 PHE CE1 1 1 17 7689 1 1 15 PHE CE2 C 6.580 -3.300 10.331 1.00 . A A . 15 PHE CE2 1 1 17 7690 1 1 15 PHE CG C 6.193 -1.603 8.642 1.00 . A A . 15 PHE CG 1 1 17 7691 1 1 15 PHE CZ C 5.403 -2.917 10.986 1.00 . A A . 15 PHE CZ 1 1 17 7692 1 1 15 PHE H H 6.841 -2.221 5.119 1.00 . A A . 15 PHE H 1 1 17 7693 1 1 15 PHE HA H 4.575 -1.205 6.797 1.00 . A A . 15 PHE HA 1 1 17 7694 1 1 15 PHE HB2 H 7.532 -1.343 7.002 1.00 . A A . 15 PHE HB2 1 1 17 7695 1 1 15 PHE HB3 H 6.806 0.150 7.596 1.00 . A A . 15 PHE HB3 1 1 17 7696 1 1 15 PHE HD1 H 4.412 -0.418 8.899 1.00 . A A . 15 PHE HD1 1 1 17 7697 1 1 15 PHE HD2 H 7.883 -2.938 8.654 1.00 . A A . 15 PHE HD2 1 1 17 7698 1 1 15 PHE HE1 H 3.714 -1.582 10.975 1.00 . A A . 15 PHE HE1 1 1 17 7699 1 1 15 PHE HE2 H 7.184 -4.101 10.730 1.00 . A A . 15 PHE HE2 1 1 17 7700 1 1 15 PHE HZ H 5.099 -3.425 11.889 1.00 . A A . 15 PHE HZ 1 1 17 7701 1 1 15 PHE N N 5.925 -2.163 5.463 1.00 . A A . 15 PHE N 1 1 17 7702 1 1 15 PHE O O 6.368 0.645 4.795 1.00 . A A . 15 PHE O 1 1 17 7703 1 1 16 CYS C C 4.317 3.447 5.713 1.00 . A A . 16 CYS C 1 1 17 7704 1 1 16 CYS CA C 4.158 2.234 4.780 1.00 . A A . 16 CYS CA 1 1 17 7705 1 1 16 CYS CB C 2.737 2.164 4.205 1.00 . A A . 16 CYS CB 1 1 17 7706 1 1 16 CYS H H 3.589 0.647 6.128 1.00 . A A . 16 CYS H 1 1 17 7707 1 1 16 CYS HA H 4.878 2.278 3.979 1.00 . A A . 16 CYS HA 1 1 17 7708 1 1 16 CYS HB2 H 2.404 1.137 4.191 1.00 . A A . 16 CYS HB2 1 1 17 7709 1 1 16 CYS HB3 H 2.070 2.750 4.821 1.00 . A A . 16 CYS HB3 1 1 17 7710 1 1 16 CYS N N 4.321 0.966 5.558 1.00 . A A . 16 CYS N 1 1 17 7711 1 1 16 CYS O O 4.941 3.356 6.754 1.00 . A A . 16 CYS O 1 1 17 7712 1 1 16 CYS SG S 2.737 2.823 2.518 1.00 . A A . 16 CYS SG 1 1 17 7713 1 1 17 CYS C C 2.697 5.892 7.173 1.00 . A A . 17 CYS C 1 1 17 7714 1 1 17 CYS CA C 3.891 5.792 6.216 1.00 . A A . 17 CYS CA 1 1 17 7715 1 1 17 CYS CB C 3.918 6.982 5.250 1.00 . A A . 17 CYS CB 1 1 17 7716 1 1 17 CYS H H 3.269 4.635 4.504 1.00 . A A . 17 CYS H 1 1 17 7717 1 1 17 CYS HA H 4.810 5.756 6.774 1.00 . A A . 17 CYS HA 1 1 17 7718 1 1 17 CYS HB2 H 4.095 6.628 4.246 1.00 . A A . 17 CYS HB2 1 1 17 7719 1 1 17 CYS HB3 H 2.970 7.498 5.287 1.00 . A A . 17 CYS HB3 1 1 17 7720 1 1 17 CYS N N 3.764 4.581 5.349 1.00 . A A . 17 CYS N 1 1 17 7721 1 1 17 CYS O O 2.838 5.729 8.370 1.00 . A A . 17 CYS O 1 1 17 7722 1 1 17 CYS SG S 5.241 8.119 5.730 1.00 . A A . 17 CYS SG 1 1 17 7723 1 1 18 SER C C -0.958 6.331 6.669 1.00 . A A . 18 SER C 1 1 17 7724 1 1 18 SER CA C 0.313 6.278 7.524 1.00 . A A . 18 SER CA 1 1 17 7725 1 1 18 SER CB C 0.492 7.590 8.292 1.00 . A A . 18 SER CB 1 1 17 7726 1 1 18 SER H H 1.444 6.287 5.685 1.00 . A A . 18 SER H 1 1 17 7727 1 1 18 SER HA H 0.267 5.451 8.217 1.00 . A A . 18 SER HA 1 1 17 7728 1 1 18 SER HB2 H -0.396 7.795 8.867 1.00 . A A . 18 SER HB2 1 1 17 7729 1 1 18 SER HB3 H 1.337 7.501 8.962 1.00 . A A . 18 SER HB3 1 1 17 7730 1 1 18 SER HG H -0.071 9.215 7.376 1.00 . A A . 18 SER HG 1 1 17 7731 1 1 18 SER N N 1.525 6.160 6.652 1.00 . A A . 18 SER N 1 1 17 7732 1 1 18 SER O O -1.068 7.129 5.757 1.00 . A A . 18 SER O 1 1 17 7733 1 1 18 SER OG O 0.709 8.655 7.372 1.00 . A A . 18 SER OG 1 1 17 7734 1 1 19 GLY C C -2.941 4.879 4.779 1.00 . A A . 19 GLY C 1 1 17 7735 1 1 19 GLY CA C -3.187 5.485 6.167 1.00 . A A . 19 GLY CA 1 1 17 7736 1 1 19 GLY H H -1.806 4.856 7.700 1.00 . A A . 19 GLY H 1 1 17 7737 1 1 19 GLY HA2 H -3.932 4.900 6.688 1.00 . A A . 19 GLY HA2 1 1 17 7738 1 1 19 GLY HA3 H -3.542 6.498 6.055 1.00 . A A . 19 GLY HA3 1 1 17 7739 1 1 19 GLY N N -1.918 5.488 6.960 1.00 . A A . 19 GLY N 1 1 17 7740 1 1 19 GLY O O -3.689 5.126 3.851 1.00 . A A . 19 GLY O 1 1 17 7741 1 1 20 TYR C C -1.364 1.964 3.461 1.00 . A A . 20 TYR C 1 1 17 7742 1 1 20 TYR CA C -1.615 3.467 3.297 1.00 . A A . 20 TYR CA 1 1 17 7743 1 1 20 TYR CB C -0.353 4.167 2.781 1.00 . A A . 20 TYR CB 1 1 17 7744 1 1 20 TYR CD1 C -1.704 5.914 1.549 1.00 . A A . 20 TYR CD1 1 1 17 7745 1 1 20 TYR CD2 C 0.101 6.639 2.998 1.00 . A A . 20 TYR CD2 1 1 17 7746 1 1 20 TYR CE1 C -1.984 7.248 1.230 1.00 . A A . 20 TYR CE1 1 1 17 7747 1 1 20 TYR CE2 C -0.179 7.972 2.678 1.00 . A A . 20 TYR CE2 1 1 17 7748 1 1 20 TYR CG C -0.661 5.609 2.434 1.00 . A A . 20 TYR CG 1 1 17 7749 1 1 20 TYR CZ C -1.222 8.278 1.794 1.00 . A A . 20 TYR CZ 1 1 17 7750 1 1 20 TYR H H -1.314 3.899 5.387 1.00 . A A . 20 TYR H 1 1 17 7751 1 1 20 TYR HA H -2.434 3.640 2.619 1.00 . A A . 20 TYR HA 1 1 17 7752 1 1 20 TYR HB2 H 0.412 4.137 3.543 1.00 . A A . 20 TYR HB2 1 1 17 7753 1 1 20 TYR HB3 H 0.003 3.657 1.897 1.00 . A A . 20 TYR HB3 1 1 17 7754 1 1 20 TYR HD1 H -2.292 5.122 1.114 1.00 . A A . 20 TYR HD1 1 1 17 7755 1 1 20 TYR HD2 H 0.906 6.405 3.679 1.00 . A A . 20 TYR HD2 1 1 17 7756 1 1 20 TYR HE1 H -2.787 7.483 0.548 1.00 . A A . 20 TYR HE1 1 1 17 7757 1 1 20 TYR HE2 H 0.409 8.768 3.114 1.00 . A A . 20 TYR HE2 1 1 17 7758 1 1 20 TYR HH H -0.826 9.898 0.865 1.00 . A A . 20 TYR HH 1 1 17 7759 1 1 20 TYR N N -1.903 4.088 4.626 1.00 . A A . 20 TYR N 1 1 17 7760 1 1 20 TYR O O -0.597 1.544 4.307 1.00 . A A . 20 TYR O 1 1 17 7761 1 1 20 TYR OH O -1.498 9.592 1.479 1.00 . A A . 20 TYR OH 1 1 17 7762 1 1 21 ASN C C -1.219 -0.874 1.458 1.00 . A A . 21 ASN C 1 1 17 7763 1 1 21 ASN CA C -1.811 -0.325 2.759 1.00 . A A . 21 ASN CA 1 1 17 7764 1 1 21 ASN CB C -3.212 -0.892 2.998 1.00 . A A . 21 ASN CB 1 1 17 7765 1 1 21 ASN CG C -3.107 -2.267 3.659 1.00 . A A . 21 ASN CG 1 1 17 7766 1 1 21 ASN H H -2.618 1.519 1.983 1.00 . A A . 21 ASN H 1 1 17 7767 1 1 21 ASN HA H -1.168 -0.564 3.591 1.00 . A A . 21 ASN HA 1 1 17 7768 1 1 21 ASN HB2 H -3.764 -0.224 3.643 1.00 . A A . 21 ASN HB2 1 1 17 7769 1 1 21 ASN HB3 H -3.728 -0.987 2.054 1.00 . A A . 21 ASN HB3 1 1 17 7770 1 1 21 ASN HD21 H -2.859 -1.529 5.486 1.00 . A A . 21 ASN HD21 1 1 17 7771 1 1 21 ASN HD22 H -2.859 -3.222 5.381 1.00 . A A . 21 ASN HD22 1 1 17 7772 1 1 21 ASN N N -2.006 1.154 2.658 1.00 . A A . 21 ASN N 1 1 17 7773 1 1 21 ASN ND2 N -2.926 -2.345 4.949 1.00 . A A . 21 ASN ND2 1 1 17 7774 1 1 21 ASN O O -1.222 -0.211 0.443 1.00 . A A . 21 ASN O 1 1 17 7775 1 1 21 ASN OD1 O -3.191 -3.280 2.994 1.00 . A A . 21 ASN OD1 1 1 17 7776 1 1 22 CYS C C -1.178 -3.392 -0.580 1.00 . A A . 22 CYS C 1 1 17 7777 1 1 22 CYS CA C -0.111 -2.660 0.242 1.00 . A A . 22 CYS CA 1 1 17 7778 1 1 22 CYS CB C 0.952 -3.641 0.743 1.00 . A A . 22 CYS CB 1 1 17 7779 1 1 22 CYS H H -0.716 -2.596 2.314 1.00 . A A . 22 CYS H 1 1 17 7780 1 1 22 CYS HA H 0.355 -1.888 -0.349 1.00 . A A . 22 CYS HA 1 1 17 7781 1 1 22 CYS HB2 H 1.744 -3.092 1.231 1.00 . A A . 22 CYS HB2 1 1 17 7782 1 1 22 CYS HB3 H 0.505 -4.329 1.444 1.00 . A A . 22 CYS HB3 1 1 17 7783 1 1 22 CYS N N -0.710 -2.077 1.481 1.00 . A A . 22 CYS N 1 1 17 7784 1 1 22 CYS O O -2.011 -4.102 -0.047 1.00 . A A . 22 CYS O 1 1 17 7785 1 1 22 CYS SG S 1.635 -4.565 -0.656 1.00 . A A . 22 CYS SG 1 1 17 7786 1 1 23 SER C C -1.483 -5.027 -3.545 1.00 . A A . 23 SER C 1 1 17 7787 1 1 23 SER CA C -2.154 -3.892 -2.756 1.00 . A A . 23 SER CA 1 1 17 7788 1 1 23 SER CB C -2.651 -2.796 -3.703 1.00 . A A . 23 SER CB 1 1 17 7789 1 1 23 SER H H -0.467 -2.639 -2.278 1.00 . A A . 23 SER H 1 1 17 7790 1 1 23 SER HA H -2.975 -4.273 -2.169 1.00 . A A . 23 SER HA 1 1 17 7791 1 1 23 SER HB2 H -2.194 -1.855 -3.441 1.00 . A A . 23 SER HB2 1 1 17 7792 1 1 23 SER HB3 H -2.384 -3.051 -4.720 1.00 . A A . 23 SER HB3 1 1 17 7793 1 1 23 SER HG H -4.303 -1.772 -3.787 1.00 . A A . 23 SER HG 1 1 17 7794 1 1 23 SER N N -1.152 -3.217 -1.878 1.00 . A A . 23 SER N 1 1 17 7795 1 1 23 SER O O -0.403 -4.852 -4.073 1.00 . A A . 23 SER O 1 1 17 7796 1 1 23 SER OG O -4.063 -2.678 -3.584 1.00 . A A . 23 SER OG 1 1 17 7797 1 1 24 PRO C C -1.750 -7.158 -5.845 1.00 . A A . 24 PRO C 1 1 17 7798 1 1 24 PRO CA C -1.598 -7.334 -4.326 1.00 . A A . 24 PRO CA 1 1 17 7799 1 1 24 PRO CB C -2.455 -8.495 -3.830 1.00 . A A . 24 PRO CB 1 1 17 7800 1 1 24 PRO CD C -3.448 -6.456 -2.978 1.00 . A A . 24 PRO CD 1 1 17 7801 1 1 24 PRO CG C -3.745 -7.874 -3.394 1.00 . A A . 24 PRO CG 1 1 17 7802 1 1 24 PRO HA H -0.569 -7.498 -4.063 1.00 . A A . 24 PRO HA 1 1 17 7803 1 1 24 PRO HB2 H -2.627 -9.202 -4.630 1.00 . A A . 24 PRO HB2 1 1 17 7804 1 1 24 PRO HB3 H -1.979 -8.982 -2.993 1.00 . A A . 24 PRO HB3 1 1 17 7805 1 1 24 PRO HD2 H -4.209 -5.786 -3.353 1.00 . A A . 24 PRO HD2 1 1 17 7806 1 1 24 PRO HD3 H -3.375 -6.384 -1.904 1.00 . A A . 24 PRO HD3 1 1 17 7807 1 1 24 PRO HG2 H -4.449 -7.879 -4.215 1.00 . A A . 24 PRO HG2 1 1 17 7808 1 1 24 PRO HG3 H -4.153 -8.420 -2.557 1.00 . A A . 24 PRO HG3 1 1 17 7809 1 1 24 PRO N N -2.146 -6.160 -3.594 1.00 . A A . 24 PRO N 1 1 17 7810 1 1 24 PRO O O -0.914 -7.596 -6.612 1.00 . A A . 24 PRO O 1 1 17 7811 1 1 25 THR C C -2.112 -5.225 -8.289 1.00 . A A . 25 THR C 1 1 17 7812 1 1 25 THR CA C -3.034 -6.326 -7.747 1.00 . A A . 25 THR CA 1 1 17 7813 1 1 25 THR CB C -4.505 -5.905 -7.875 1.00 . A A . 25 THR CB 1 1 17 7814 1 1 25 THR CG2 C -4.889 -5.792 -9.353 1.00 . A A . 25 THR CG2 1 1 17 7815 1 1 25 THR H H -3.471 -6.190 -5.637 1.00 . A A . 25 THR H 1 1 17 7816 1 1 25 THR HA H -2.869 -7.246 -8.280 1.00 . A A . 25 THR HA 1 1 17 7817 1 1 25 THR HB H -4.647 -4.947 -7.398 1.00 . A A . 25 THR HB 1 1 17 7818 1 1 25 THR HG1 H -5.690 -6.482 -6.446 1.00 . A A . 25 THR HG1 1 1 17 7819 1 1 25 THR HG21 H -3.997 -5.818 -9.962 1.00 . A A . 25 THR HG21 1 1 17 7820 1 1 25 THR HG22 H -5.409 -4.860 -9.518 1.00 . A A . 25 THR HG22 1 1 17 7821 1 1 25 THR HG23 H -5.533 -6.616 -9.622 1.00 . A A . 25 THR HG23 1 1 17 7822 1 1 25 THR N N -2.813 -6.527 -6.279 1.00 . A A . 25 THR N 1 1 17 7823 1 1 25 THR O O -1.646 -5.294 -9.410 1.00 . A A . 25 THR O 1 1 17 7824 1 1 25 THR OG1 O -5.330 -6.874 -7.245 1.00 . A A . 25 THR OG1 1 1 17 7825 1 1 26 TRP C C 0.463 -3.282 -7.446 1.00 . A A . 26 TRP C 1 1 17 7826 1 1 26 TRP CA C -0.971 -3.093 -7.968 1.00 . A A . 26 TRP CA 1 1 17 7827 1 1 26 TRP CB C -1.596 -1.819 -7.391 1.00 . A A . 26 TRP CB 1 1 17 7828 1 1 26 TRP CD1 C -4.050 -2.185 -6.901 1.00 . A A . 26 TRP CD1 1 1 17 7829 1 1 26 TRP CD2 C -3.703 -1.307 -8.943 1.00 . A A . 26 TRP CD2 1 1 17 7830 1 1 26 TRP CE2 C -5.101 -1.461 -8.798 1.00 . A A . 26 TRP CE2 1 1 17 7831 1 1 26 TRP CE3 C -3.217 -0.769 -10.148 1.00 . A A . 26 TRP CE3 1 1 17 7832 1 1 26 TRP CG C -3.057 -1.774 -7.723 1.00 . A A . 26 TRP CG 1 1 17 7833 1 1 26 TRP CH2 C -5.487 -0.563 -11.004 1.00 . A A . 26 TRP CH2 1 1 17 7834 1 1 26 TRP CZ2 C -5.987 -1.096 -9.812 1.00 . A A . 26 TRP CZ2 1 1 17 7835 1 1 26 TRP CZ3 C -4.105 -0.401 -11.171 1.00 . A A . 26 TRP CZ3 1 1 17 7836 1 1 26 TRP H H -2.249 -4.180 -6.606 1.00 . A A . 26 TRP H 1 1 17 7837 1 1 26 TRP HA H -0.971 -3.043 -9.046 1.00 . A A . 26 TRP HA 1 1 17 7838 1 1 26 TRP HB2 H -1.468 -1.810 -6.319 1.00 . A A . 26 TRP HB2 1 1 17 7839 1 1 26 TRP HB3 H -1.106 -0.959 -7.819 1.00 . A A . 26 TRP HB3 1 1 17 7840 1 1 26 TRP HD1 H -3.917 -2.592 -5.911 1.00 . A A . 26 TRP HD1 1 1 17 7841 1 1 26 TRP HE1 H -6.139 -2.222 -7.159 1.00 . A A . 26 TRP HE1 1 1 17 7842 1 1 26 TRP HE3 H -2.154 -0.641 -10.288 1.00 . A A . 26 TRP HE3 1 1 17 7843 1 1 26 TRP HH2 H -6.165 -0.277 -11.793 1.00 . A A . 26 TRP HH2 1 1 17 7844 1 1 26 TRP HZ2 H -7.052 -1.223 -9.677 1.00 . A A . 26 TRP HZ2 1 1 17 7845 1 1 26 TRP HZ3 H -3.721 0.011 -12.092 1.00 . A A . 26 TRP HZ3 1 1 17 7846 1 1 26 TRP N N -1.856 -4.211 -7.503 1.00 . A A . 26 TRP N 1 1 17 7847 1 1 26 TRP NE1 N -5.262 -2.002 -7.538 1.00 . A A . 26 TRP NE1 1 1 17 7848 1 1 26 TRP O O 1.400 -2.725 -7.986 1.00 . A A . 26 TRP O 1 1 17 7849 1 1 27 LYS C C 2.594 -3.086 -5.155 1.00 . A A . 27 LYS C 1 1 17 7850 1 1 27 LYS CA C 1.995 -4.333 -5.831 1.00 . A A . 27 LYS CA 1 1 17 7851 1 1 27 LYS CB C 2.865 -4.782 -7.014 1.00 . A A . 27 LYS CB 1 1 17 7852 1 1 27 LYS CD C 2.908 -7.162 -6.228 1.00 . A A . 27 LYS CD 1 1 17 7853 1 1 27 LYS CE C 3.808 -8.388 -6.044 1.00 . A A . 27 LYS CE 1 1 17 7854 1 1 27 LYS CG C 3.767 -5.944 -6.582 1.00 . A A . 27 LYS CG 1 1 17 7855 1 1 27 LYS H H -0.143 -4.508 -6.002 1.00 . A A . 27 LYS H 1 1 17 7856 1 1 27 LYS HA H 1.934 -5.135 -5.114 1.00 . A A . 27 LYS HA 1 1 17 7857 1 1 27 LYS HB2 H 2.229 -5.104 -7.825 1.00 . A A . 27 LYS HB2 1 1 17 7858 1 1 27 LYS HB3 H 3.479 -3.958 -7.343 1.00 . A A . 27 LYS HB3 1 1 17 7859 1 1 27 LYS HD2 H 2.372 -6.968 -5.309 1.00 . A A . 27 LYS HD2 1 1 17 7860 1 1 27 LYS HD3 H 2.203 -7.351 -7.023 1.00 . A A . 27 LYS HD3 1 1 17 7861 1 1 27 LYS HE2 H 4.848 -8.091 -6.040 1.00 . A A . 27 LYS HE2 1 1 17 7862 1 1 27 LYS HE3 H 3.560 -8.903 -5.129 1.00 . A A . 27 LYS HE3 1 1 17 7863 1 1 27 LYS HG2 H 4.434 -6.198 -7.392 1.00 . A A . 27 LYS HG2 1 1 17 7864 1 1 27 LYS HG3 H 4.344 -5.649 -5.718 1.00 . A A . 27 LYS HG3 1 1 17 7865 1 1 27 LYS HZ1 H 2.510 -9.499 -7.238 1.00 . A A . 27 LYS HZ1 1 1 17 7866 1 1 27 LYS HZ2 H 4.079 -10.142 -7.134 1.00 . A A . 27 LYS HZ2 1 1 17 7867 1 1 27 LYS HZ3 H 3.782 -8.771 -8.092 1.00 . A A . 27 LYS HZ3 1 1 17 7868 1 1 27 LYS N N 0.633 -4.072 -6.408 1.00 . A A . 27 LYS N 1 1 17 7869 1 1 27 LYS NZ N 3.524 -9.266 -7.215 1.00 . A A . 27 LYS NZ 1 1 17 7870 1 1 27 LYS O O 3.765 -3.073 -4.819 1.00 . A A . 27 LYS O 1 1 17 7871 1 1 28 TRP C C 1.426 -0.349 -3.138 1.00 . A A . 28 TRP C 1 1 17 7872 1 1 28 TRP CA C 2.381 -0.847 -4.234 1.00 . A A . 28 TRP CA 1 1 17 7873 1 1 28 TRP CB C 2.618 0.214 -5.328 1.00 . A A . 28 TRP CB 1 1 17 7874 1 1 28 TRP CD1 C 0.271 1.186 -5.327 1.00 . A A . 28 TRP CD1 1 1 17 7875 1 1 28 TRP CD2 C 0.995 0.667 -7.390 1.00 . A A . 28 TRP CD2 1 1 17 7876 1 1 28 TRP CE2 C -0.308 1.198 -7.538 1.00 . A A . 28 TRP CE2 1 1 17 7877 1 1 28 TRP CE3 C 1.680 0.259 -8.547 1.00 . A A . 28 TRP CE3 1 1 17 7878 1 1 28 TRP CG C 1.338 0.663 -5.973 1.00 . A A . 28 TRP CG 1 1 17 7879 1 1 28 TRP CH2 C -0.214 0.912 -9.931 1.00 . A A . 28 TRP CH2 1 1 17 7880 1 1 28 TRP CZ2 C -0.908 1.321 -8.791 1.00 . A A . 28 TRP CZ2 1 1 17 7881 1 1 28 TRP CZ3 C 1.078 0.383 -9.810 1.00 . A A . 28 TRP CZ3 1 1 17 7882 1 1 28 TRP H H 0.869 -2.075 -5.171 1.00 . A A . 28 TRP H 1 1 17 7883 1 1 28 TRP HA H 3.328 -1.106 -3.783 1.00 . A A . 28 TRP HA 1 1 17 7884 1 1 28 TRP HB2 H 3.105 1.070 -4.887 1.00 . A A . 28 TRP HB2 1 1 17 7885 1 1 28 TRP HB3 H 3.267 -0.205 -6.084 1.00 . A A . 28 TRP HB3 1 1 17 7886 1 1 28 TRP HD1 H 0.190 1.330 -4.261 1.00 . A A . 28 TRP HD1 1 1 17 7887 1 1 28 TRP HE1 H -1.580 1.888 -6.047 1.00 . A A . 28 TRP HE1 1 1 17 7888 1 1 28 TRP HE3 H 2.676 -0.150 -8.465 1.00 . A A . 28 TRP HE3 1 1 17 7889 1 1 28 TRP HH2 H -0.671 1.004 -10.906 1.00 . A A . 28 TRP HH2 1 1 17 7890 1 1 28 TRP HZ2 H -1.905 1.731 -8.878 1.00 . A A . 28 TRP HZ2 1 1 17 7891 1 1 28 TRP HZ3 H 1.614 0.067 -10.694 1.00 . A A . 28 TRP HZ3 1 1 17 7892 1 1 28 TRP N N 1.816 -2.052 -4.920 1.00 . A A . 28 TRP N 1 1 17 7893 1 1 28 TRP NE1 N -0.706 1.499 -6.255 1.00 . A A . 28 TRP NE1 1 1 17 7894 1 1 28 TRP O O 0.271 -0.732 -3.084 1.00 . A A . 28 TRP O 1 1 17 7895 1 1 29 CYS C C -0.036 1.931 -1.677 1.00 . A A . 29 CYS C 1 1 17 7896 1 1 29 CYS CA C 1.059 1.002 -1.137 1.00 . A A . 29 CYS CA 1 1 17 7897 1 1 29 CYS CB C 2.017 1.769 -0.221 1.00 . A A . 29 CYS CB 1 1 17 7898 1 1 29 CYS H H 2.852 0.762 -2.312 1.00 . A A . 29 CYS H 1 1 17 7899 1 1 29 CYS HA H 0.619 0.180 -0.597 1.00 . A A . 29 CYS HA 1 1 17 7900 1 1 29 CYS HB2 H 3.012 1.363 -0.321 1.00 . A A . 29 CYS HB2 1 1 17 7901 1 1 29 CYS HB3 H 2.025 2.811 -0.501 1.00 . A A . 29 CYS HB3 1 1 17 7902 1 1 29 CYS N N 1.914 0.486 -2.252 1.00 . A A . 29 CYS N 1 1 17 7903 1 1 29 CYS O O 0.203 2.756 -2.534 1.00 . A A . 29 CYS O 1 1 17 7904 1 1 29 CYS SG S 1.479 1.612 1.500 1.00 . A A . 29 CYS SG 1 1 17 7905 1 1 30 VAL C C -3.169 3.135 -0.404 1.00 . A A . 30 VAL C 1 1 17 7906 1 1 30 VAL CA C -2.370 2.655 -1.622 1.00 . A A . 30 VAL CA 1 1 17 7907 1 1 30 VAL CB C -3.237 1.753 -2.516 1.00 . A A . 30 VAL CB 1 1 17 7908 1 1 30 VAL CG1 C -2.397 1.218 -3.676 1.00 . A A . 30 VAL CG1 1 1 17 7909 1 1 30 VAL CG2 C -3.784 0.572 -1.701 1.00 . A A . 30 VAL CG2 1 1 17 7910 1 1 30 VAL H H -1.388 1.123 -0.472 1.00 . A A . 30 VAL H 1 1 17 7911 1 1 30 VAL HA H -2.003 3.496 -2.188 1.00 . A A . 30 VAL HA 1 1 17 7912 1 1 30 VAL HB H -4.061 2.329 -2.910 1.00 . A A . 30 VAL HB 1 1 17 7913 1 1 30 VAL HG11 H -1.834 0.356 -3.347 1.00 . A A . 30 VAL HG11 1 1 17 7914 1 1 30 VAL HG12 H -1.717 1.986 -4.011 1.00 . A A . 30 VAL HG12 1 1 17 7915 1 1 30 VAL HG13 H -3.048 0.932 -4.489 1.00 . A A . 30 VAL HG13 1 1 17 7916 1 1 30 VAL HG21 H -3.513 -0.354 -2.186 1.00 . A A . 30 VAL HG21 1 1 17 7917 1 1 30 VAL HG22 H -4.860 0.645 -1.642 1.00 . A A . 30 VAL HG22 1 1 17 7918 1 1 30 VAL HG23 H -3.367 0.592 -0.707 1.00 . A A . 30 VAL HG23 1 1 17 7919 1 1 30 VAL N N -1.234 1.796 -1.166 1.00 . A A . 30 VAL N 1 1 17 7920 1 1 30 VAL O O -2.808 2.863 0.721 1.00 . A A . 30 VAL O 1 1 17 7921 1 1 31 TYR C C -5.778 3.148 1.221 1.00 . A A . 31 TYR C 1 1 17 7922 1 1 31 TYR CA C -5.065 4.324 0.541 1.00 . A A . 31 TYR CA 1 1 17 7923 1 1 31 TYR CB C -6.082 5.300 -0.057 1.00 . A A . 31 TYR CB 1 1 17 7924 1 1 31 TYR CD1 C -6.146 6.916 1.880 1.00 . A A . 31 TYR CD1 1 1 17 7925 1 1 31 TYR CD2 C -5.372 7.708 -0.277 1.00 . A A . 31 TYR CD2 1 1 17 7926 1 1 31 TYR CE1 C -5.939 8.189 2.422 1.00 . A A . 31 TYR CE1 1 1 17 7927 1 1 31 TYR CE2 C -5.166 8.983 0.265 1.00 . A A . 31 TYR CE2 1 1 17 7928 1 1 31 TYR CG C -5.863 6.675 0.529 1.00 . A A . 31 TYR CG 1 1 17 7929 1 1 31 TYR CZ C -5.448 9.223 1.615 1.00 . A A . 31 TYR CZ 1 1 17 7930 1 1 31 TYR H H -4.529 4.045 -1.535 1.00 . A A . 31 TYR H 1 1 17 7931 1 1 31 TYR HA H -4.435 4.838 1.250 1.00 . A A . 31 TYR HA 1 1 17 7932 1 1 31 TYR HB2 H -5.956 5.342 -1.129 1.00 . A A . 31 TYR HB2 1 1 17 7933 1 1 31 TYR HB3 H -7.083 4.967 0.175 1.00 . A A . 31 TYR HB3 1 1 17 7934 1 1 31 TYR HD1 H -6.525 6.119 2.503 1.00 . A A . 31 TYR HD1 1 1 17 7935 1 1 31 TYR HD2 H -5.153 7.522 -1.319 1.00 . A A . 31 TYR HD2 1 1 17 7936 1 1 31 TYR HE1 H -6.158 8.375 3.463 1.00 . A A . 31 TYR HE1 1 1 17 7937 1 1 31 TYR HE2 H -4.787 9.780 -0.358 1.00 . A A . 31 TYR HE2 1 1 17 7938 1 1 31 TYR HH H -6.074 10.957 2.110 1.00 . A A . 31 TYR HH 1 1 17 7939 1 1 31 TYR N N -4.250 3.839 -0.617 1.00 . A A . 31 TYR N 1 1 17 7940 1 1 31 TYR O O -6.307 2.269 0.565 1.00 . A A . 31 TYR O 1 1 17 7941 1 1 31 TYR OH O -5.244 10.478 2.151 1.00 . A A . 31 TYR OH 1 1 17 7942 1 1 32 ALA C C -7.787 2.504 3.876 1.00 . A A . 32 ALA C 1 1 17 7943 1 1 32 ALA CA C -6.470 2.012 3.264 1.00 . A A . 32 ALA CA 1 1 17 7944 1 1 32 ALA CB C -5.488 1.600 4.363 1.00 . A A . 32 ALA CB 1 1 17 7945 1 1 32 ALA H H -5.360 3.850 3.037 1.00 . A A . 32 ALA H 1 1 17 7946 1 1 32 ALA HA H -6.651 1.181 2.601 1.00 . A A . 32 ALA HA 1 1 17 7947 1 1 32 ALA HB1 H -4.495 1.518 3.946 1.00 . A A . 32 ALA HB1 1 1 17 7948 1 1 32 ALA HB2 H -5.787 0.647 4.773 1.00 . A A . 32 ALA HB2 1 1 17 7949 1 1 32 ALA HB3 H -5.489 2.345 5.146 1.00 . A A . 32 ALA HB3 1 1 17 7950 1 1 32 ALA N N -5.794 3.128 2.532 1.00 . A A . 32 ALA N 1 1 17 7951 1 1 32 ALA O O -7.799 3.388 4.714 1.00 . A A . 32 ALA O 1 1 17 7952 1 1 33 ARG C C -11.317 1.363 3.658 1.00 . A A . 33 ARG C 1 1 17 7953 1 1 33 ARG CA C -10.215 2.373 4.018 1.00 . A A . 33 ARG CA 1 1 17 7954 1 1 33 ARG CB C -10.496 3.736 3.369 1.00 . A A . 33 ARG CB 1 1 17 7955 1 1 33 ARG CD C -12.221 3.533 1.563 1.00 . A A . 33 ARG CD 1 1 17 7956 1 1 33 ARG CG C -10.718 3.566 1.861 1.00 . A A . 33 ARG CG 1 1 17 7957 1 1 33 ARG CZ C -12.208 3.718 -0.853 1.00 . A A . 33 ARG CZ 1 1 17 7958 1 1 33 ARG H H -8.861 1.230 2.787 1.00 . A A . 33 ARG H 1 1 17 7959 1 1 33 ARG HA H -10.150 2.487 5.089 1.00 . A A . 33 ARG HA 1 1 17 7960 1 1 33 ARG HB2 H -11.376 4.171 3.816 1.00 . A A . 33 ARG HB2 1 1 17 7961 1 1 33 ARG HB3 H -9.651 4.389 3.532 1.00 . A A . 33 ARG HB3 1 1 17 7962 1 1 33 ARG HD2 H -12.553 2.513 1.427 1.00 . A A . 33 ARG HD2 1 1 17 7963 1 1 33 ARG HD3 H -12.773 4.005 2.359 1.00 . A A . 33 ARG HD3 1 1 17 7964 1 1 33 ARG HE H -12.620 5.257 0.336 1.00 . A A . 33 ARG HE 1 1 17 7965 1 1 33 ARG HG2 H -10.264 4.395 1.336 1.00 . A A . 33 ARG HG2 1 1 17 7966 1 1 33 ARG HG3 H -10.269 2.642 1.530 1.00 . A A . 33 ARG HG3 1 1 17 7967 1 1 33 ARG HH11 H -14.088 3.026 -0.957 1.00 . A A . 33 ARG HH11 1 1 17 7968 1 1 33 ARG HH12 H -13.067 2.621 -2.296 1.00 . A A . 33 ARG HH12 1 1 17 7969 1 1 33 ARG HH21 H -10.288 4.269 -1.015 1.00 . A A . 33 ARG HH21 1 1 17 7970 1 1 33 ARG HH22 H -10.908 3.327 -2.328 1.00 . A A . 33 ARG HH22 1 1 17 7971 1 1 33 ARG N N -8.896 1.938 3.463 1.00 . A A . 33 ARG N 1 1 17 7972 1 1 33 ARG NE N -12.382 4.307 0.301 1.00 . A A . 33 ARG NE 1 1 17 7973 1 1 33 ARG NH1 N -13.199 3.072 -1.412 1.00 . A A . 33 ARG NH1 1 1 17 7974 1 1 33 ARG NH2 N -11.044 3.776 -1.445 1.00 . A A . 33 ARG NH2 1 1 17 7975 1 1 33 ARG O O -11.226 0.677 2.656 1.00 . A A . 33 ARG O 1 1 17 7976 1 1 34 PRO C C -14.330 0.857 3.087 1.00 . A A . 34 PRO C 1 1 17 7977 1 1 34 PRO CA C -13.466 0.378 4.262 1.00 . A A . 34 PRO CA 1 1 17 7978 1 1 34 PRO CB C -14.246 0.433 5.575 1.00 . A A . 34 PRO CB 1 1 17 7979 1 1 34 PRO CD C -12.508 2.100 5.720 1.00 . A A . 34 PRO CD 1 1 17 7980 1 1 34 PRO CG C -13.904 1.760 6.173 1.00 . A A . 34 PRO CG 1 1 17 7981 1 1 34 PRO HA H -13.107 -0.624 4.088 1.00 . A A . 34 PRO HA 1 1 17 7982 1 1 34 PRO HB2 H -15.308 0.368 5.381 1.00 . A A . 34 PRO HB2 1 1 17 7983 1 1 34 PRO HB3 H -13.932 -0.362 6.233 1.00 . A A . 34 PRO HB3 1 1 17 7984 1 1 34 PRO HD2 H -12.427 3.158 5.510 1.00 . A A . 34 PRO HD2 1 1 17 7985 1 1 34 PRO HD3 H -11.785 1.801 6.463 1.00 . A A . 34 PRO HD3 1 1 17 7986 1 1 34 PRO HG2 H -14.600 2.511 5.827 1.00 . A A . 34 PRO HG2 1 1 17 7987 1 1 34 PRO HG3 H -13.930 1.698 7.250 1.00 . A A . 34 PRO HG3 1 1 17 7988 1 1 34 PRO N N -12.328 1.309 4.493 1.00 . A A . 34 PRO N 1 1 17 7989 1 1 34 PRO O O -14.699 2.022 3.076 1.00 . A A . 34 PRO O 1 1 17 7990 1 1 34 PRO OXT O -14.608 0.049 2.217 1.00 . A A . 34 PRO OXT 1 1 18 7991 1 1 1 GLY C C 10.199 7.180 5.375 1.00 . A A . 1 GLY C 1 1 18 7992 1 1 1 GLY CA C 11.037 8.370 5.856 1.00 . A A . 1 GLY CA 1 1 18 7993 1 1 1 GLY H1 H 12.528 8.736 7.265 1.00 . A A . 1 GLY H1 1 1 18 7994 1 1 1 GLY H2 H 12.663 7.231 6.491 1.00 . A A . 1 GLY H2 1 1 18 7995 1 1 1 GLY H3 H 11.480 7.473 7.685 1.00 . A A . 1 GLY H3 1 1 18 7996 1 1 1 GLY HA2 H 10.387 9.128 6.271 1.00 . A A . 1 GLY HA2 1 1 18 7997 1 1 1 GLY HA3 H 11.582 8.782 5.021 1.00 . A A . 1 GLY HA3 1 1 18 7998 1 1 1 GLY N N 12.000 7.918 6.903 1.00 . A A . 1 GLY N 1 1 18 7999 1 1 1 GLY O O 10.728 6.160 4.975 1.00 . A A . 1 GLY O 1 1 18 8000 1 1 2 CYS C C 7.806 6.237 3.431 1.00 . A A . 2 CYS C 1 1 18 8001 1 1 2 CYS CA C 8.013 6.183 4.956 1.00 . A A . 2 CYS CA 1 1 18 8002 1 1 2 CYS CB C 6.686 6.387 5.698 1.00 . A A . 2 CYS CB 1 1 18 8003 1 1 2 CYS H H 8.494 8.140 5.737 1.00 . A A . 2 CYS H 1 1 18 8004 1 1 2 CYS HA H 8.444 5.235 5.237 1.00 . A A . 2 CYS HA 1 1 18 8005 1 1 2 CYS HB2 H 6.008 5.586 5.445 1.00 . A A . 2 CYS HB2 1 1 18 8006 1 1 2 CYS HB3 H 6.868 6.380 6.763 1.00 . A A . 2 CYS HB3 1 1 18 8007 1 1 2 CYS N N 8.895 7.306 5.410 1.00 . A A . 2 CYS N 1 1 18 8008 1 1 2 CYS O O 8.426 7.025 2.741 1.00 . A A . 2 CYS O 1 1 18 8009 1 1 2 CYS SG S 5.951 7.971 5.222 1.00 . A A . 2 CYS SG 1 1 18 8010 1 1 3 GLY C C 5.659 6.445 1.053 1.00 . A A . 3 GLY C 1 1 18 8011 1 1 3 GLY CA C 6.703 5.386 1.427 1.00 . A A . 3 GLY CA 1 1 18 8012 1 1 3 GLY H H 6.462 4.766 3.479 1.00 . A A . 3 GLY H 1 1 18 8013 1 1 3 GLY HA2 H 7.628 5.595 0.911 1.00 . A A . 3 GLY HA2 1 1 18 8014 1 1 3 GLY HA3 H 6.340 4.413 1.131 1.00 . A A . 3 GLY HA3 1 1 18 8015 1 1 3 GLY N N 6.944 5.397 2.904 1.00 . A A . 3 GLY N 1 1 18 8016 1 1 3 GLY O O 5.901 7.632 1.168 1.00 . A A . 3 GLY O 1 1 18 8017 1 1 4 GLY C C 2.282 6.262 -0.470 1.00 . A A . 4 GLY C 1 1 18 8018 1 1 4 GLY CA C 3.442 7.001 0.208 1.00 . A A . 4 GLY CA 1 1 18 8019 1 1 4 GLY H H 4.336 5.061 0.510 1.00 . A A . 4 GLY H 1 1 18 8020 1 1 4 GLY HA2 H 3.079 7.508 1.091 1.00 . A A . 4 GLY HA2 1 1 18 8021 1 1 4 GLY HA3 H 3.854 7.723 -0.479 1.00 . A A . 4 GLY HA3 1 1 18 8022 1 1 4 GLY N N 4.504 6.023 0.598 1.00 . A A . 4 GLY N 1 1 18 8023 1 1 4 GLY O O 1.598 5.467 0.149 1.00 . A A . 4 GLY O 1 1 18 8024 1 1 5 LEU C C 1.495 4.869 -3.534 1.00 . A A . 5 LEU C 1 1 18 8025 1 1 5 LEU CA C 0.946 5.830 -2.464 1.00 . A A . 5 LEU CA 1 1 18 8026 1 1 5 LEU CB C 0.139 6.958 -3.116 1.00 . A A . 5 LEU CB 1 1 18 8027 1 1 5 LEU CD1 C -2.041 8.123 -2.731 1.00 . A A . 5 LEU CD1 1 1 18 8028 1 1 5 LEU CD2 C -1.990 5.932 -3.936 1.00 . A A . 5 LEU CD2 1 1 18 8029 1 1 5 LEU CG C -1.350 6.760 -2.817 1.00 . A A . 5 LEU CG 1 1 18 8030 1 1 5 LEU H H 2.627 7.161 -2.212 1.00 . A A . 5 LEU H 1 1 18 8031 1 1 5 LEU HA H 0.322 5.292 -1.767 1.00 . A A . 5 LEU HA 1 1 18 8032 1 1 5 LEU HB2 H 0.464 7.909 -2.719 1.00 . A A . 5 LEU HB2 1 1 18 8033 1 1 5 LEU HB3 H 0.296 6.942 -4.184 1.00 . A A . 5 LEU HB3 1 1 18 8034 1 1 5 LEU HD11 H -2.961 8.098 -3.298 1.00 . A A . 5 LEU HD11 1 1 18 8035 1 1 5 LEU HD12 H -1.390 8.884 -3.136 1.00 . A A . 5 LEU HD12 1 1 18 8036 1 1 5 LEU HD13 H -2.261 8.349 -1.699 1.00 . A A . 5 LEU HD13 1 1 18 8037 1 1 5 LEU HD21 H -1.620 4.918 -3.890 1.00 . A A . 5 LEU HD21 1 1 18 8038 1 1 5 LEU HD22 H -1.737 6.364 -4.894 1.00 . A A . 5 LEU HD22 1 1 18 8039 1 1 5 LEU HD23 H -3.063 5.930 -3.814 1.00 . A A . 5 LEU HD23 1 1 18 8040 1 1 5 LEU HG H -1.461 6.241 -1.876 1.00 . A A . 5 LEU HG 1 1 18 8041 1 1 5 LEU N N 2.060 6.518 -1.737 1.00 . A A . 5 LEU N 1 1 18 8042 1 1 5 LEU O O 0.754 4.353 -4.349 1.00 . A A . 5 LEU O 1 1 18 8043 1 1 6 MET C C 4.586 2.954 -3.938 1.00 . A A . 6 MET C 1 1 18 8044 1 1 6 MET CA C 3.374 3.685 -4.540 1.00 . A A . 6 MET CA 1 1 18 8045 1 1 6 MET CB C 3.801 4.579 -5.707 1.00 . A A . 6 MET CB 1 1 18 8046 1 1 6 MET CE C 3.594 3.741 -9.735 1.00 . A A . 6 MET CE 1 1 18 8047 1 1 6 MET CG C 3.692 3.803 -7.021 1.00 . A A . 6 MET CG 1 1 18 8048 1 1 6 MET H H 3.364 5.038 -2.863 1.00 . A A . 6 MET H 1 1 18 8049 1 1 6 MET HA H 2.635 2.973 -4.872 1.00 . A A . 6 MET HA 1 1 18 8050 1 1 6 MET HB2 H 3.159 5.446 -5.748 1.00 . A A . 6 MET HB2 1 1 18 8051 1 1 6 MET HB3 H 4.823 4.895 -5.564 1.00 . A A . 6 MET HB3 1 1 18 8052 1 1 6 MET HE1 H 2.554 3.603 -9.995 1.00 . A A . 6 MET HE1 1 1 18 8053 1 1 6 MET HE2 H 4.007 2.802 -9.402 1.00 . A A . 6 MET HE2 1 1 18 8054 1 1 6 MET HE3 H 4.144 4.089 -10.598 1.00 . A A . 6 MET HE3 1 1 18 8055 1 1 6 MET HG2 H 4.523 3.118 -7.105 1.00 . A A . 6 MET HG2 1 1 18 8056 1 1 6 MET HG3 H 2.764 3.250 -7.036 1.00 . A A . 6 MET HG3 1 1 18 8057 1 1 6 MET N N 2.784 4.618 -3.531 1.00 . A A . 6 MET N 1 1 18 8058 1 1 6 MET O O 5.559 2.682 -4.617 1.00 . A A . 6 MET O 1 1 18 8059 1 1 6 MET SD S 3.724 4.965 -8.409 1.00 . A A . 6 MET SD 1 1 18 8060 1 1 7 ALA C C 5.705 0.457 -2.483 1.00 . A A . 7 ALA C 1 1 18 8061 1 1 7 ALA CA C 5.669 1.915 -2.015 1.00 . A A . 7 ALA CA 1 1 18 8062 1 1 7 ALA CB C 5.390 1.987 -0.510 1.00 . A A . 7 ALA CB 1 1 18 8063 1 1 7 ALA H H 3.730 2.857 -2.142 1.00 . A A . 7 ALA H 1 1 18 8064 1 1 7 ALA HA H 6.601 2.407 -2.242 1.00 . A A . 7 ALA HA 1 1 18 8065 1 1 7 ALA HB1 H 5.477 1.000 -0.081 1.00 . A A . 7 ALA HB1 1 1 18 8066 1 1 7 ALA HB2 H 4.392 2.363 -0.344 1.00 . A A . 7 ALA HB2 1 1 18 8067 1 1 7 ALA HB3 H 6.106 2.647 -0.043 1.00 . A A . 7 ALA HB3 1 1 18 8068 1 1 7 ALA N N 4.527 2.631 -2.666 1.00 . A A . 7 ALA N 1 1 18 8069 1 1 7 ALA O O 4.727 -0.256 -2.374 1.00 . A A . 7 ALA O 1 1 18 8070 1 1 8 GLY C C 6.561 -2.359 -2.339 1.00 . A A . 8 GLY C 1 1 18 8071 1 1 8 GLY CA C 6.922 -1.402 -3.480 1.00 . A A . 8 GLY CA 1 1 18 8072 1 1 8 GLY H H 7.598 0.606 -3.080 1.00 . A A . 8 GLY H 1 1 18 8073 1 1 8 GLY HA2 H 6.237 -1.551 -4.305 1.00 . A A . 8 GLY HA2 1 1 18 8074 1 1 8 GLY HA3 H 7.929 -1.604 -3.809 1.00 . A A . 8 GLY HA3 1 1 18 8075 1 1 8 GLY N N 6.823 0.010 -3.002 1.00 . A A . 8 GLY N 1 1 18 8076 1 1 8 GLY O O 7.238 -2.416 -1.330 1.00 . A A . 8 GLY O 1 1 18 8077 1 1 9 CYS C C 5.650 -5.445 -1.683 1.00 . A A . 9 CYS C 1 1 18 8078 1 1 9 CYS CA C 5.071 -4.048 -1.418 1.00 . A A . 9 CYS CA 1 1 18 8079 1 1 9 CYS CB C 3.540 -4.056 -1.480 1.00 . A A . 9 CYS CB 1 1 18 8080 1 1 9 CYS H H 4.961 -3.027 -3.313 1.00 . A A . 9 CYS H 1 1 18 8081 1 1 9 CYS HA H 5.395 -3.690 -0.455 1.00 . A A . 9 CYS HA 1 1 18 8082 1 1 9 CYS HB2 H 3.162 -3.107 -1.127 1.00 . A A . 9 CYS HB2 1 1 18 8083 1 1 9 CYS HB3 H 3.222 -4.209 -2.501 1.00 . A A . 9 CYS HB3 1 1 18 8084 1 1 9 CYS N N 5.492 -3.099 -2.491 1.00 . A A . 9 CYS N 1 1 18 8085 1 1 9 CYS O O 6.675 -5.805 -1.134 1.00 . A A . 9 CYS O 1 1 18 8086 1 1 9 CYS SG S 2.890 -5.386 -0.440 1.00 . A A . 9 CYS SG 1 1 18 8087 1 1 10 ASP C C 5.813 -8.376 -1.533 1.00 . A A . 10 ASP C 1 1 18 8088 1 1 10 ASP CA C 5.511 -7.605 -2.831 1.00 . A A . 10 ASP CA 1 1 18 8089 1 1 10 ASP CB C 6.788 -7.386 -3.654 1.00 . A A . 10 ASP CB 1 1 18 8090 1 1 10 ASP CG C 6.418 -6.971 -5.081 1.00 . A A . 10 ASP CG 1 1 18 8091 1 1 10 ASP H H 4.187 -5.908 -2.949 1.00 . A A . 10 ASP H 1 1 18 8092 1 1 10 ASP HA H 4.785 -8.142 -3.422 1.00 . A A . 10 ASP HA 1 1 18 8093 1 1 10 ASP HB2 H 7.382 -6.609 -3.195 1.00 . A A . 10 ASP HB2 1 1 18 8094 1 1 10 ASP HB3 H 7.358 -8.302 -3.684 1.00 . A A . 10 ASP HB3 1 1 18 8095 1 1 10 ASP N N 5.006 -6.228 -2.521 1.00 . A A . 10 ASP N 1 1 18 8096 1 1 10 ASP O O 6.931 -8.796 -1.294 1.00 . A A . 10 ASP O 1 1 18 8097 1 1 10 ASP OD1 O 6.153 -5.798 -5.288 1.00 . A A . 10 ASP OD1 1 1 18 8098 1 1 10 ASP OD2 O 6.408 -7.835 -5.942 1.00 . A A . 10 ASP OD2 1 1 18 8099 1 1 11 GLY C C 3.694 -9.516 1.271 1.00 . A A . 11 GLY C 1 1 18 8100 1 1 11 GLY CA C 5.042 -9.294 0.585 1.00 . A A . 11 GLY CA 1 1 18 8101 1 1 11 GLY H H 3.931 -8.212 -0.902 1.00 . A A . 11 GLY H 1 1 18 8102 1 1 11 GLY HA2 H 5.509 -10.246 0.379 1.00 . A A . 11 GLY HA2 1 1 18 8103 1 1 11 GLY HA3 H 5.678 -8.708 1.232 1.00 . A A . 11 GLY HA3 1 1 18 8104 1 1 11 GLY N N 4.823 -8.560 -0.694 1.00 . A A . 11 GLY N 1 1 18 8105 1 1 11 GLY O O 2.690 -9.757 0.624 1.00 . A A . 11 GLY O 1 1 18 8106 1 1 12 LYS C C 2.090 -8.451 4.260 1.00 . A A . 12 LYS C 1 1 18 8107 1 1 12 LYS CA C 2.374 -9.631 3.309 1.00 . A A . 12 LYS CA 1 1 18 8108 1 1 12 LYS CB C 2.560 -10.938 4.089 1.00 . A A . 12 LYS CB 1 1 18 8109 1 1 12 LYS CD C 4.806 -11.643 4.944 1.00 . A A . 12 LYS CD 1 1 18 8110 1 1 12 LYS CE C 5.847 -11.439 6.050 1.00 . A A . 12 LYS CE 1 1 18 8111 1 1 12 LYS CG C 3.591 -10.751 5.210 1.00 . A A . 12 LYS CG 1 1 18 8112 1 1 12 LYS H H 4.484 -9.238 3.069 1.00 . A A . 12 LYS H 1 1 18 8113 1 1 12 LYS HA H 1.562 -9.743 2.609 1.00 . A A . 12 LYS HA 1 1 18 8114 1 1 12 LYS HB2 H 1.614 -11.233 4.517 1.00 . A A . 12 LYS HB2 1 1 18 8115 1 1 12 LYS HB3 H 2.903 -11.709 3.413 1.00 . A A . 12 LYS HB3 1 1 18 8116 1 1 12 LYS HD2 H 4.495 -12.677 4.928 1.00 . A A . 12 LYS HD2 1 1 18 8117 1 1 12 LYS HD3 H 5.242 -11.384 3.991 1.00 . A A . 12 LYS HD3 1 1 18 8118 1 1 12 LYS HE2 H 5.356 -11.272 7.000 1.00 . A A . 12 LYS HE2 1 1 18 8119 1 1 12 LYS HE3 H 6.503 -12.293 6.111 1.00 . A A . 12 LYS HE3 1 1 18 8120 1 1 12 LYS HG2 H 3.904 -9.717 5.244 1.00 . A A . 12 LYS HG2 1 1 18 8121 1 1 12 LYS HG3 H 3.148 -11.023 6.156 1.00 . A A . 12 LYS HG3 1 1 18 8122 1 1 12 LYS HZ1 H 7.001 -10.366 4.685 1.00 . A A . 12 LYS HZ1 1 1 18 8123 1 1 12 LYS HZ2 H 7.405 -10.081 6.310 1.00 . A A . 12 LYS HZ2 1 1 18 8124 1 1 12 LYS HZ3 H 5.996 -9.398 5.650 1.00 . A A . 12 LYS HZ3 1 1 18 8125 1 1 12 LYS N N 3.661 -9.432 2.573 1.00 . A A . 12 LYS N 1 1 18 8126 1 1 12 LYS NZ N 6.620 -10.230 5.643 1.00 . A A . 12 LYS NZ 1 1 18 8127 1 1 12 LYS O O 0.984 -8.298 4.745 1.00 . A A . 12 LYS O 1 1 18 8128 1 1 13 SER C C 3.923 -5.384 5.194 1.00 . A A . 13 SER C 1 1 18 8129 1 1 13 SER CA C 2.852 -6.455 5.439 1.00 . A A . 13 SER CA 1 1 18 8130 1 1 13 SER CB C 2.964 -7.031 6.855 1.00 . A A . 13 SER CB 1 1 18 8131 1 1 13 SER H H 3.952 -7.752 4.122 1.00 . A A . 13 SER H 1 1 18 8132 1 1 13 SER HA H 1.866 -6.041 5.287 1.00 . A A . 13 SER HA 1 1 18 8133 1 1 13 SER HB2 H 3.308 -8.051 6.807 1.00 . A A . 13 SER HB2 1 1 18 8134 1 1 13 SER HB3 H 3.668 -6.444 7.429 1.00 . A A . 13 SER HB3 1 1 18 8135 1 1 13 SER HG H 1.540 -7.847 7.903 1.00 . A A . 13 SER HG 1 1 18 8136 1 1 13 SER N N 3.072 -7.616 4.526 1.00 . A A . 13 SER N 1 1 18 8137 1 1 13 SER O O 4.665 -5.014 6.087 1.00 . A A . 13 SER O 1 1 18 8138 1 1 13 SER OG O 1.685 -6.999 7.477 1.00 . A A . 13 SER OG 1 1 18 8139 1 1 14 THR C C 4.813 -2.601 4.572 1.00 . A A . 14 THR C 1 1 18 8140 1 1 14 THR CA C 5.030 -3.829 3.672 1.00 . A A . 14 THR CA 1 1 18 8141 1 1 14 THR CB C 4.813 -3.470 2.192 1.00 . A A . 14 THR CB 1 1 18 8142 1 1 14 THR CG2 C 3.439 -2.814 2.001 1.00 . A A . 14 THR CG2 1 1 18 8143 1 1 14 THR H H 3.400 -5.200 3.283 1.00 . A A . 14 THR H 1 1 18 8144 1 1 14 THR HA H 6.023 -4.227 3.809 1.00 . A A . 14 THR HA 1 1 18 8145 1 1 14 THR HB H 4.860 -4.369 1.596 1.00 . A A . 14 THR HB 1 1 18 8146 1 1 14 THR HG1 H 5.701 -1.731 2.215 1.00 . A A . 14 THR HG1 1 1 18 8147 1 1 14 THR HG21 H 3.443 -1.833 2.452 1.00 . A A . 14 THR HG21 1 1 18 8148 1 1 14 THR HG22 H 2.682 -3.423 2.470 1.00 . A A . 14 THR HG22 1 1 18 8149 1 1 14 THR HG23 H 3.227 -2.723 0.946 1.00 . A A . 14 THR HG23 1 1 18 8150 1 1 14 THR N N 4.008 -4.882 3.984 1.00 . A A . 14 THR N 1 1 18 8151 1 1 14 THR O O 3.695 -2.283 4.939 1.00 . A A . 14 THR O 1 1 18 8152 1 1 14 THR OG1 O 5.832 -2.571 1.768 1.00 . A A . 14 THR OG1 1 1 18 8153 1 1 15 PHE C C 5.452 0.542 4.978 1.00 . A A . 15 PHE C 1 1 18 8154 1 1 15 PHE CA C 5.713 -0.715 5.819 1.00 . A A . 15 PHE CA 1 1 18 8155 1 1 15 PHE CB C 7.036 -0.598 6.585 1.00 . A A . 15 PHE CB 1 1 18 8156 1 1 15 PHE CD1 C 6.777 -2.611 8.083 1.00 . A A . 15 PHE CD1 1 1 18 8157 1 1 15 PHE CD2 C 6.805 -0.405 9.091 1.00 . A A . 15 PHE CD2 1 1 18 8158 1 1 15 PHE CE1 C 6.617 -3.188 9.348 1.00 . A A . 15 PHE CE1 1 1 18 8159 1 1 15 PHE CE2 C 6.646 -0.983 10.356 1.00 . A A . 15 PHE CE2 1 1 18 8160 1 1 15 PHE CG C 6.871 -1.220 7.953 1.00 . A A . 15 PHE CG 1 1 18 8161 1 1 15 PHE CZ C 6.552 -2.374 10.485 1.00 . A A . 15 PHE CZ 1 1 18 8162 1 1 15 PHE H H 6.760 -2.189 4.634 1.00 . A A . 15 PHE H 1 1 18 8163 1 1 15 PHE HA H 4.903 -0.870 6.515 1.00 . A A . 15 PHE HA 1 1 18 8164 1 1 15 PHE HB2 H 7.815 -1.114 6.045 1.00 . A A . 15 PHE HB2 1 1 18 8165 1 1 15 PHE HB3 H 7.299 0.443 6.693 1.00 . A A . 15 PHE HB3 1 1 18 8166 1 1 15 PHE HD1 H 6.828 -3.240 7.206 1.00 . A A . 15 PHE HD1 1 1 18 8167 1 1 15 PHE HD2 H 6.878 0.667 8.993 1.00 . A A . 15 PHE HD2 1 1 18 8168 1 1 15 PHE HE1 H 6.544 -4.261 9.447 1.00 . A A . 15 PHE HE1 1 1 18 8169 1 1 15 PHE HE2 H 6.595 -0.355 11.234 1.00 . A A . 15 PHE HE2 1 1 18 8170 1 1 15 PHE HZ H 6.428 -2.819 11.461 1.00 . A A . 15 PHE HZ 1 1 18 8171 1 1 15 PHE N N 5.868 -1.914 4.936 1.00 . A A . 15 PHE N 1 1 18 8172 1 1 15 PHE O O 6.159 0.824 4.030 1.00 . A A . 15 PHE O 1 1 18 8173 1 1 16 CYS C C 4.018 3.736 5.504 1.00 . A A . 16 CYS C 1 1 18 8174 1 1 16 CYS CA C 4.097 2.528 4.556 1.00 . A A . 16 CYS CA 1 1 18 8175 1 1 16 CYS CB C 2.729 2.242 3.929 1.00 . A A . 16 CYS CB 1 1 18 8176 1 1 16 CYS H H 3.878 1.030 6.092 1.00 . A A . 16 CYS H 1 1 18 8177 1 1 16 CYS HA H 4.828 2.703 3.783 1.00 . A A . 16 CYS HA 1 1 18 8178 1 1 16 CYS HB2 H 2.005 2.062 4.711 1.00 . A A . 16 CYS HB2 1 1 18 8179 1 1 16 CYS HB3 H 2.416 3.090 3.339 1.00 . A A . 16 CYS HB3 1 1 18 8180 1 1 16 CYS N N 4.432 1.289 5.325 1.00 . A A . 16 CYS N 1 1 18 8181 1 1 16 CYS O O 4.508 3.692 6.617 1.00 . A A . 16 CYS O 1 1 18 8182 1 1 16 CYS SG S 2.841 0.779 2.868 1.00 . A A . 16 CYS SG 1 1 18 8183 1 1 17 CYS C C 2.137 5.841 6.943 1.00 . A A . 17 CYS C 1 1 18 8184 1 1 17 CYS CA C 3.296 6.020 5.951 1.00 . A A . 17 CYS CA 1 1 18 8185 1 1 17 CYS CB C 3.033 7.196 5.002 1.00 . A A . 17 CYS CB 1 1 18 8186 1 1 17 CYS H H 3.018 4.829 4.170 1.00 . A A . 17 CYS H 1 1 18 8187 1 1 17 CYS HA H 4.219 6.179 6.484 1.00 . A A . 17 CYS HA 1 1 18 8188 1 1 17 CYS HB2 H 2.173 6.977 4.387 1.00 . A A . 17 CYS HB2 1 1 18 8189 1 1 17 CYS HB3 H 2.842 8.089 5.580 1.00 . A A . 17 CYS HB3 1 1 18 8190 1 1 17 CYS N N 3.406 4.815 5.071 1.00 . A A . 17 CYS N 1 1 18 8191 1 1 17 CYS O O 2.331 5.391 8.057 1.00 . A A . 17 CYS O 1 1 18 8192 1 1 17 CYS SG S 4.475 7.463 3.941 1.00 . A A . 17 CYS SG 1 1 18 8193 1 1 18 SER C C -1.532 6.017 6.636 1.00 . A A . 18 SER C 1 1 18 8194 1 1 18 SER CA C -0.240 6.033 7.458 1.00 . A A . 18 SER CA 1 1 18 8195 1 1 18 SER CB C -0.199 7.253 8.380 1.00 . A A . 18 SER CB 1 1 18 8196 1 1 18 SER H H 0.804 6.541 5.645 1.00 . A A . 18 SER H 1 1 18 8197 1 1 18 SER HA H -0.151 5.127 8.038 1.00 . A A . 18 SER HA 1 1 18 8198 1 1 18 SER HB2 H 0.661 7.858 8.146 1.00 . A A . 18 SER HB2 1 1 18 8199 1 1 18 SER HB3 H -1.097 7.840 8.239 1.00 . A A . 18 SER HB3 1 1 18 8200 1 1 18 SER HG H 0.803 6.579 9.907 1.00 . A A . 18 SER HG 1 1 18 8201 1 1 18 SER N N 0.936 6.185 6.547 1.00 . A A . 18 SER N 1 1 18 8202 1 1 18 SER O O -1.789 6.912 5.851 1.00 . A A . 18 SER O 1 1 18 8203 1 1 18 SER OG O -0.111 6.817 9.731 1.00 . A A . 18 SER OG 1 1 18 8204 1 1 19 GLY C C -3.345 4.324 4.635 1.00 . A A . 19 GLY C 1 1 18 8205 1 1 19 GLY CA C -3.614 4.917 6.026 1.00 . A A . 19 GLY CA 1 1 18 8206 1 1 19 GLY H H -2.108 4.290 7.435 1.00 . A A . 19 GLY H 1 1 18 8207 1 1 19 GLY HA2 H -4.316 4.287 6.556 1.00 . A A . 19 GLY HA2 1 1 18 8208 1 1 19 GLY HA3 H -4.034 5.906 5.915 1.00 . A A . 19 GLY HA3 1 1 18 8209 1 1 19 GLY N N -2.341 5.002 6.803 1.00 . A A . 19 GLY N 1 1 18 8210 1 1 19 GLY O O -4.128 4.501 3.721 1.00 . A A . 19 GLY O 1 1 18 8211 1 1 20 TYR C C -1.797 1.500 3.256 1.00 . A A . 20 TYR C 1 1 18 8212 1 1 20 TYR CA C -1.931 3.022 3.133 1.00 . A A . 20 TYR CA 1 1 18 8213 1 1 20 TYR CB C -0.591 3.635 2.711 1.00 . A A . 20 TYR CB 1 1 18 8214 1 1 20 TYR CD1 C -1.664 5.423 1.286 1.00 . A A . 20 TYR CD1 1 1 18 8215 1 1 20 TYR CD2 C -0.064 6.083 2.983 1.00 . A A . 20 TYR CD2 1 1 18 8216 1 1 20 TYR CE1 C -1.832 6.763 0.922 1.00 . A A . 20 TYR CE1 1 1 18 8217 1 1 20 TYR CE2 C -0.231 7.424 2.618 1.00 . A A . 20 TYR CE2 1 1 18 8218 1 1 20 TYR CG C -0.780 5.083 2.318 1.00 . A A . 20 TYR CG 1 1 18 8219 1 1 20 TYR CZ C -1.116 7.764 1.587 1.00 . A A . 20 TYR CZ 1 1 18 8220 1 1 20 TYR H H -1.627 3.491 5.214 1.00 . A A . 20 TYR H 1 1 18 8221 1 1 20 TYR HA H -2.695 3.276 2.414 1.00 . A A . 20 TYR HA 1 1 18 8222 1 1 20 TYR HB2 H 0.106 3.575 3.533 1.00 . A A . 20 TYR HB2 1 1 18 8223 1 1 20 TYR HB3 H -0.197 3.086 1.867 1.00 . A A . 20 TYR HB3 1 1 18 8224 1 1 20 TYR HD1 H -2.217 4.651 0.774 1.00 . A A . 20 TYR HD1 1 1 18 8225 1 1 20 TYR HD2 H 0.616 5.821 3.779 1.00 . A A . 20 TYR HD2 1 1 18 8226 1 1 20 TYR HE1 H -2.514 7.024 0.126 1.00 . A A . 20 TYR HE1 1 1 18 8227 1 1 20 TYR HE2 H 0.322 8.196 3.132 1.00 . A A . 20 TYR HE2 1 1 18 8228 1 1 20 TYR HH H -0.627 9.292 0.551 1.00 . A A . 20 TYR HH 1 1 18 8229 1 1 20 TYR N N -2.245 3.623 4.465 1.00 . A A . 20 TYR N 1 1 18 8230 1 1 20 TYR O O -1.088 0.998 4.109 1.00 . A A . 20 TYR O 1 1 18 8231 1 1 20 TYR OH O -1.279 9.086 1.225 1.00 . A A . 20 TYR OH 1 1 18 8232 1 1 21 ASN C C -1.648 -1.254 1.220 1.00 . A A . 21 ASN C 1 1 18 8233 1 1 21 ASN CA C -2.375 -0.726 2.460 1.00 . A A . 21 ASN CA 1 1 18 8234 1 1 21 ASN CB C -3.825 -1.216 2.488 1.00 . A A . 21 ASN CB 1 1 18 8235 1 1 21 ASN CG C -4.272 -1.433 3.937 1.00 . A A . 21 ASN CG 1 1 18 8236 1 1 21 ASN H H -3.024 1.194 1.723 1.00 . A A . 21 ASN H 1 1 18 8237 1 1 21 ASN HA H -1.858 -1.037 3.353 1.00 . A A . 21 ASN HA 1 1 18 8238 1 1 21 ASN HB2 H -4.463 -0.479 2.022 1.00 . A A . 21 ASN HB2 1 1 18 8239 1 1 21 ASN HB3 H -3.900 -2.148 1.948 1.00 . A A . 21 ASN HB3 1 1 18 8240 1 1 21 ASN HD21 H -5.198 -3.147 3.547 1.00 . A A . 21 ASN HD21 1 1 18 8241 1 1 21 ASN HD22 H -5.256 -2.642 5.166 1.00 . A A . 21 ASN HD22 1 1 18 8242 1 1 21 ASN N N -2.465 0.765 2.406 1.00 . A A . 21 ASN N 1 1 18 8243 1 1 21 ASN ND2 N -4.966 -2.496 4.242 1.00 . A A . 21 ASN ND2 1 1 18 8244 1 1 21 ASN O O -1.434 -0.535 0.269 1.00 . A A . 21 ASN O 1 1 18 8245 1 1 21 ASN OD1 O -3.988 -0.627 4.802 1.00 . A A . 21 ASN OD1 1 1 18 8246 1 1 22 CYS C C -1.545 -3.635 -0.971 1.00 . A A . 22 CYS C 1 1 18 8247 1 1 22 CYS CA C -0.546 -3.075 0.047 1.00 . A A . 22 CYS CA 1 1 18 8248 1 1 22 CYS CB C 0.327 -4.195 0.623 1.00 . A A . 22 CYS CB 1 1 18 8249 1 1 22 CYS H H -1.449 -3.068 2.009 1.00 . A A . 22 CYS H 1 1 18 8250 1 1 22 CYS HA H 0.079 -2.324 -0.411 1.00 . A A . 22 CYS HA 1 1 18 8251 1 1 22 CYS HB2 H 1.183 -3.763 1.120 1.00 . A A . 22 CYS HB2 1 1 18 8252 1 1 22 CYS HB3 H -0.249 -4.768 1.335 1.00 . A A . 22 CYS HB3 1 1 18 8253 1 1 22 CYS N N -1.267 -2.505 1.226 1.00 . A A . 22 CYS N 1 1 18 8254 1 1 22 CYS O O -2.482 -4.327 -0.620 1.00 . A A . 22 CYS O 1 1 18 8255 1 1 22 CYS SG S 0.893 -5.283 -0.709 1.00 . A A . 22 CYS SG 1 1 18 8256 1 1 23 SER C C -1.603 -4.976 -4.077 1.00 . A A . 23 SER C 1 1 18 8257 1 1 23 SER CA C -2.274 -3.846 -3.285 1.00 . A A . 23 SER CA 1 1 18 8258 1 1 23 SER CB C -2.546 -2.647 -4.195 1.00 . A A . 23 SER CB 1 1 18 8259 1 1 23 SER H H -0.579 -2.779 -2.485 1.00 . A A . 23 SER H 1 1 18 8260 1 1 23 SER HA H -3.194 -4.189 -2.841 1.00 . A A . 23 SER HA 1 1 18 8261 1 1 23 SER HB2 H -2.315 -1.734 -3.674 1.00 . A A . 23 SER HB2 1 1 18 8262 1 1 23 SER HB3 H -1.926 -2.719 -5.081 1.00 . A A . 23 SER HB3 1 1 18 8263 1 1 23 SER HG H -4.054 -3.329 -5.221 1.00 . A A . 23 SER HG 1 1 18 8264 1 1 23 SER N N -1.345 -3.338 -2.231 1.00 . A A . 23 SER N 1 1 18 8265 1 1 23 SER O O -0.461 -4.855 -4.473 1.00 . A A . 23 SER O 1 1 18 8266 1 1 23 SER OG O -3.919 -2.642 -4.563 1.00 . A A . 23 SER OG 1 1 18 8267 1 1 24 PRO C C -1.790 -6.903 -6.554 1.00 . A A . 24 PRO C 1 1 18 8268 1 1 24 PRO CA C -1.804 -7.200 -5.047 1.00 . A A . 24 PRO CA 1 1 18 8269 1 1 24 PRO CB C -2.783 -8.325 -4.724 1.00 . A A . 24 PRO CB 1 1 18 8270 1 1 24 PRO CD C -3.721 -6.271 -3.837 1.00 . A A . 24 PRO CD 1 1 18 8271 1 1 24 PRO CG C -4.066 -7.643 -4.365 1.00 . A A . 24 PRO CG 1 1 18 8272 1 1 24 PRO HA H -0.818 -7.459 -4.701 1.00 . A A . 24 PRO HA 1 1 18 8273 1 1 24 PRO HB2 H -2.922 -8.959 -5.591 1.00 . A A . 24 PRO HB2 1 1 18 8274 1 1 24 PRO HB3 H -2.426 -8.905 -3.888 1.00 . A A . 24 PRO HB3 1 1 18 8275 1 1 24 PRO HD2 H -4.386 -5.529 -4.256 1.00 . A A . 24 PRO HD2 1 1 18 8276 1 1 24 PRO HD3 H -3.767 -6.258 -2.759 1.00 . A A . 24 PRO HD3 1 1 18 8277 1 1 24 PRO HG2 H -4.692 -7.554 -5.242 1.00 . A A . 24 PRO HG2 1 1 18 8278 1 1 24 PRO HG3 H -4.580 -8.205 -3.601 1.00 . A A . 24 PRO HG3 1 1 18 8279 1 1 24 PRO N N -2.340 -6.043 -4.287 1.00 . A A . 24 PRO N 1 1 18 8280 1 1 24 PRO O O -0.918 -7.352 -7.273 1.00 . A A . 24 PRO O 1 1 18 8281 1 1 25 THR C C -1.736 -4.779 -8.837 1.00 . A A . 25 THR C 1 1 18 8282 1 1 25 THR CA C -2.806 -5.820 -8.491 1.00 . A A . 25 THR CA 1 1 18 8283 1 1 25 THR CB C -4.215 -5.250 -8.718 1.00 . A A . 25 THR CB 1 1 18 8284 1 1 25 THR CG2 C -4.390 -4.865 -10.190 1.00 . A A . 25 THR CG2 1 1 18 8285 1 1 25 THR H H -3.442 -5.805 -6.429 1.00 . A A . 25 THR H 1 1 18 8286 1 1 25 THR HA H -2.671 -6.707 -9.082 1.00 . A A . 25 THR HA 1 1 18 8287 1 1 25 THR HB H -4.350 -4.373 -8.104 1.00 . A A . 25 THR HB 1 1 18 8288 1 1 25 THR HG1 H -5.062 -6.993 -8.935 1.00 . A A . 25 THR HG1 1 1 18 8289 1 1 25 THR HG21 H -4.172 -3.814 -10.315 1.00 . A A . 25 THR HG21 1 1 18 8290 1 1 25 THR HG22 H -5.408 -5.058 -10.494 1.00 . A A . 25 THR HG22 1 1 18 8291 1 1 25 THR HG23 H -3.716 -5.448 -10.799 1.00 . A A . 25 THR HG23 1 1 18 8292 1 1 25 THR N N -2.752 -6.152 -7.032 1.00 . A A . 25 THR N 1 1 18 8293 1 1 25 THR O O -1.035 -4.904 -9.824 1.00 . A A . 25 THR O 1 1 18 8294 1 1 25 THR OG1 O -5.186 -6.229 -8.365 1.00 . A A . 25 THR OG1 1 1 18 8295 1 1 26 TRP C C 0.764 -3.078 -7.654 1.00 . A A . 26 TRP C 1 1 18 8296 1 1 26 TRP CA C -0.580 -2.702 -8.297 1.00 . A A . 26 TRP CA 1 1 18 8297 1 1 26 TRP CB C -1.145 -1.427 -7.666 1.00 . A A . 26 TRP CB 1 1 18 8298 1 1 26 TRP CD1 C -3.673 -1.357 -7.663 1.00 . A A . 26 TRP CD1 1 1 18 8299 1 1 26 TRP CD2 C -2.788 -0.579 -9.578 1.00 . A A . 26 TRP CD2 1 1 18 8300 1 1 26 TRP CE2 C -4.193 -0.489 -9.715 1.00 . A A . 26 TRP CE2 1 1 18 8301 1 1 26 TRP CE3 C -1.988 -0.150 -10.651 1.00 . A A . 26 TRP CE3 1 1 18 8302 1 1 26 TRP CG C -2.483 -1.133 -8.266 1.00 . A A . 26 TRP CG 1 1 18 8303 1 1 26 TRP CH2 C -3.974 0.432 -11.933 1.00 . A A . 26 TRP CH2 1 1 18 8304 1 1 26 TRP CZ2 C -4.784 0.009 -10.875 1.00 . A A . 26 TRP CZ2 1 1 18 8305 1 1 26 TRP CZ3 C -2.578 0.353 -11.822 1.00 . A A . 26 TRP CZ3 1 1 18 8306 1 1 26 TRP H H -2.184 -3.692 -7.242 1.00 . A A . 26 TRP H 1 1 18 8307 1 1 26 TRP HA H -0.458 -2.559 -9.358 1.00 . A A . 26 TRP HA 1 1 18 8308 1 1 26 TRP HB2 H -1.248 -1.566 -6.599 1.00 . A A . 26 TRP HB2 1 1 18 8309 1 1 26 TRP HB3 H -0.476 -0.606 -7.859 1.00 . A A . 26 TRP HB3 1 1 18 8310 1 1 26 TRP HD1 H -3.808 -1.769 -6.674 1.00 . A A . 26 TRP HD1 1 1 18 8311 1 1 26 TRP HE1 H -5.645 -1.038 -8.326 1.00 . A A . 26 TRP HE1 1 1 18 8312 1 1 26 TRP HE3 H -0.913 -0.206 -10.574 1.00 . A A . 26 TRP HE3 1 1 18 8313 1 1 26 TRP HH2 H -4.422 0.820 -12.836 1.00 . A A . 26 TRP HH2 1 1 18 8314 1 1 26 TRP HZ2 H -5.859 0.068 -10.956 1.00 . A A . 26 TRP HZ2 1 1 18 8315 1 1 26 TRP HZ3 H -1.955 0.680 -12.640 1.00 . A A . 26 TRP HZ3 1 1 18 8316 1 1 26 TRP N N -1.606 -3.760 -8.030 1.00 . A A . 26 TRP N 1 1 18 8317 1 1 26 TRP NE1 N -4.688 -0.977 -8.522 1.00 . A A . 26 TRP NE1 1 1 18 8318 1 1 26 TRP O O 1.785 -2.492 -7.956 1.00 . A A . 26 TRP O 1 1 18 8319 1 1 27 LYS C C 2.678 -3.395 -5.266 1.00 . A A . 27 LYS C 1 1 18 8320 1 1 27 LYS CA C 2.028 -4.511 -6.104 1.00 . A A . 27 LYS CA 1 1 18 8321 1 1 27 LYS CB C 2.962 -4.958 -7.238 1.00 . A A . 27 LYS CB 1 1 18 8322 1 1 27 LYS CD C 3.169 -7.325 -6.442 1.00 . A A . 27 LYS CD 1 1 18 8323 1 1 27 LYS CE C 1.986 -7.691 -5.537 1.00 . A A . 27 LYS CE 1 1 18 8324 1 1 27 LYS CG C 2.687 -6.424 -7.584 1.00 . A A . 27 LYS CG 1 1 18 8325 1 1 27 LYS H H -0.074 -4.513 -6.561 1.00 . A A . 27 LYS H 1 1 18 8326 1 1 27 LYS HA H 1.813 -5.355 -5.470 1.00 . A A . 27 LYS HA 1 1 18 8327 1 1 27 LYS HB2 H 2.792 -4.346 -8.111 1.00 . A A . 27 LYS HB2 1 1 18 8328 1 1 27 LYS HB3 H 3.988 -4.853 -6.920 1.00 . A A . 27 LYS HB3 1 1 18 8329 1 1 27 LYS HD2 H 3.601 -8.226 -6.853 1.00 . A A . 27 LYS HD2 1 1 18 8330 1 1 27 LYS HD3 H 3.915 -6.802 -5.862 1.00 . A A . 27 LYS HD3 1 1 18 8331 1 1 27 LYS HE2 H 2.161 -7.334 -4.532 1.00 . A A . 27 LYS HE2 1 1 18 8332 1 1 27 LYS HE3 H 1.070 -7.276 -5.929 1.00 . A A . 27 LYS HE3 1 1 18 8333 1 1 27 LYS HG2 H 1.625 -6.566 -7.733 1.00 . A A . 27 LYS HG2 1 1 18 8334 1 1 27 LYS HG3 H 3.215 -6.684 -8.490 1.00 . A A . 27 LYS HG3 1 1 18 8335 1 1 27 LYS HZ1 H 2.808 -9.572 -5.186 1.00 . A A . 27 LYS HZ1 1 1 18 8336 1 1 27 LYS HZ2 H 1.776 -9.508 -6.534 1.00 . A A . 27 LYS HZ2 1 1 18 8337 1 1 27 LYS HZ3 H 1.129 -9.499 -4.964 1.00 . A A . 27 LYS HZ3 1 1 18 8338 1 1 27 LYS N N 0.765 -4.059 -6.777 1.00 . A A . 27 LYS N 1 1 18 8339 1 1 27 LYS NZ N 1.920 -9.180 -5.557 1.00 . A A . 27 LYS NZ 1 1 18 8340 1 1 27 LYS O O 3.843 -3.483 -4.925 1.00 . A A . 27 LYS O 1 1 18 8341 1 1 28 TRP C C 1.523 -0.738 -3.057 1.00 . A A . 28 TRP C 1 1 18 8342 1 1 28 TRP CA C 2.551 -1.288 -4.057 1.00 . A A . 28 TRP CA 1 1 18 8343 1 1 28 TRP CB C 3.064 -0.202 -5.025 1.00 . A A . 28 TRP CB 1 1 18 8344 1 1 28 TRP CD1 C 0.879 1.089 -5.234 1.00 . A A . 28 TRP CD1 1 1 18 8345 1 1 28 TRP CD2 C 1.817 0.631 -7.223 1.00 . A A . 28 TRP CD2 1 1 18 8346 1 1 28 TRP CE2 C 0.630 1.348 -7.493 1.00 . A A . 28 TRP CE2 1 1 18 8347 1 1 28 TRP CE3 C 2.603 0.220 -8.311 1.00 . A A . 28 TRP CE3 1 1 18 8348 1 1 28 TRP CG C 1.952 0.470 -5.781 1.00 . A A . 28 TRP CG 1 1 18 8349 1 1 28 TRP CH2 C 1.030 1.231 -9.869 1.00 . A A . 28 TRP CH2 1 1 18 8350 1 1 28 TRP CZ2 C 0.236 1.647 -8.798 1.00 . A A . 28 TRP CZ2 1 1 18 8351 1 1 28 TRP CZ3 C 2.213 0.519 -9.626 1.00 . A A . 28 TRP CZ3 1 1 18 8352 1 1 28 TRP H H 1.001 -2.315 -5.160 1.00 . A A . 28 TRP H 1 1 18 8353 1 1 28 TRP HA H 3.389 -1.696 -3.511 1.00 . A A . 28 TRP HA 1 1 18 8354 1 1 28 TRP HB2 H 3.600 0.544 -4.459 1.00 . A A . 28 TRP HB2 1 1 18 8355 1 1 28 TRP HB3 H 3.745 -0.658 -5.730 1.00 . A A . 28 TRP HB3 1 1 18 8356 1 1 28 TRP HD1 H 0.668 1.164 -4.179 1.00 . A A . 28 TRP HD1 1 1 18 8357 1 1 28 TRP HE1 H -0.745 2.094 -6.124 1.00 . A A . 28 TRP HE1 1 1 18 8358 1 1 28 TRP HE3 H 3.514 -0.328 -8.132 1.00 . A A . 28 TRP HE3 1 1 18 8359 1 1 28 TRP HH2 H 0.734 1.458 -10.882 1.00 . A A . 28 TRP HH2 1 1 18 8360 1 1 28 TRP HZ2 H -0.677 2.197 -8.978 1.00 . A A . 28 TRP HZ2 1 1 18 8361 1 1 28 TRP HZ3 H 2.826 0.197 -10.455 1.00 . A A . 28 TRP HZ3 1 1 18 8362 1 1 28 TRP N N 1.944 -2.366 -4.902 1.00 . A A . 28 TRP N 1 1 18 8363 1 1 28 TRP NE1 N 0.093 1.605 -6.250 1.00 . A A . 28 TRP NE1 1 1 18 8364 1 1 28 TRP O O 0.337 -0.998 -3.162 1.00 . A A . 28 TRP O 1 1 18 8365 1 1 29 CYS C C 0.099 1.595 -1.653 1.00 . A A . 29 CYS C 1 1 18 8366 1 1 29 CYS CA C 1.043 0.553 -1.042 1.00 . A A . 29 CYS CA 1 1 18 8367 1 1 29 CYS CB C 1.939 1.199 0.017 1.00 . A A . 29 CYS CB 1 1 18 8368 1 1 29 CYS H H 2.938 0.178 -2.003 1.00 . A A . 29 CYS H 1 1 18 8369 1 1 29 CYS HA H 0.476 -0.246 -0.597 1.00 . A A . 29 CYS HA 1 1 18 8370 1 1 29 CYS HB2 H 2.923 0.760 -0.027 1.00 . A A . 29 CYS HB2 1 1 18 8371 1 1 29 CYS HB3 H 2.007 2.260 -0.165 1.00 . A A . 29 CYS HB3 1 1 18 8372 1 1 29 CYS N N 1.977 0.002 -2.073 1.00 . A A . 29 CYS N 1 1 18 8373 1 1 29 CYS O O 0.512 2.479 -2.376 1.00 . A A . 29 CYS O 1 1 18 8374 1 1 29 CYS SG S 1.231 0.917 1.658 1.00 . A A . 29 CYS SG 1 1 18 8375 1 1 30 VAL C C -3.082 2.931 -0.739 1.00 . A A . 30 VAL C 1 1 18 8376 1 1 30 VAL CA C -2.177 2.458 -1.881 1.00 . A A . 30 VAL CA 1 1 18 8377 1 1 30 VAL CB C -2.989 1.675 -2.923 1.00 . A A . 30 VAL CB 1 1 18 8378 1 1 30 VAL CG1 C -2.079 1.263 -4.080 1.00 . A A . 30 VAL CG1 1 1 18 8379 1 1 30 VAL CG2 C -3.596 0.418 -2.285 1.00 . A A . 30 VAL CG2 1 1 18 8380 1 1 30 VAL H H -1.462 0.768 -0.753 1.00 . A A . 30 VAL H 1 1 18 8381 1 1 30 VAL HA H -1.686 3.298 -2.346 1.00 . A A . 30 VAL HA 1 1 18 8382 1 1 30 VAL HB H -3.782 2.304 -3.302 1.00 . A A . 30 VAL HB 1 1 18 8383 1 1 30 VAL HG11 H -2.674 1.097 -4.967 1.00 . A A . 30 VAL HG11 1 1 18 8384 1 1 30 VAL HG12 H -1.556 0.354 -3.822 1.00 . A A . 30 VAL HG12 1 1 18 8385 1 1 30 VAL HG13 H -1.362 2.048 -4.269 1.00 . A A . 30 VAL HG13 1 1 18 8386 1 1 30 VAL HG21 H -4.092 0.686 -1.363 1.00 . A A . 30 VAL HG21 1 1 18 8387 1 1 30 VAL HG22 H -2.812 -0.296 -2.077 1.00 . A A . 30 VAL HG22 1 1 18 8388 1 1 30 VAL HG23 H -4.311 -0.021 -2.963 1.00 . A A . 30 VAL HG23 1 1 18 8389 1 1 30 VAL N N -1.169 1.489 -1.348 1.00 . A A . 30 VAL N 1 1 18 8390 1 1 30 VAL O O -2.962 2.476 0.380 1.00 . A A . 30 VAL O 1 1 18 8391 1 1 31 TYR C C -5.739 3.170 0.632 1.00 . A A . 31 TYR C 1 1 18 8392 1 1 31 TYR CA C -4.901 4.328 0.071 1.00 . A A . 31 TYR CA 1 1 18 8393 1 1 31 TYR CB C -5.801 5.365 -0.607 1.00 . A A . 31 TYR CB 1 1 18 8394 1 1 31 TYR CD1 C -5.782 7.385 0.904 1.00 . A A . 31 TYR CD1 1 1 18 8395 1 1 31 TYR CD2 C -7.704 5.907 0.955 1.00 . A A . 31 TYR CD2 1 1 18 8396 1 1 31 TYR CE1 C -6.380 8.196 1.874 1.00 . A A . 31 TYR CE1 1 1 18 8397 1 1 31 TYR CE2 C -8.302 6.718 1.927 1.00 . A A . 31 TYR CE2 1 1 18 8398 1 1 31 TYR CG C -6.444 6.240 0.443 1.00 . A A . 31 TYR CG 1 1 18 8399 1 1 31 TYR CZ C -7.640 7.863 2.386 1.00 . A A . 31 TYR CZ 1 1 18 8400 1 1 31 TYR H H -4.071 4.188 -1.921 1.00 . A A . 31 TYR H 1 1 18 8401 1 1 31 TYR HA H -4.330 4.795 0.857 1.00 . A A . 31 TYR HA 1 1 18 8402 1 1 31 TYR HB2 H -5.208 5.978 -1.271 1.00 . A A . 31 TYR HB2 1 1 18 8403 1 1 31 TYR HB3 H -6.569 4.860 -1.172 1.00 . A A . 31 TYR HB3 1 1 18 8404 1 1 31 TYR HD1 H -4.811 7.642 0.508 1.00 . A A . 31 TYR HD1 1 1 18 8405 1 1 31 TYR HD2 H -8.216 5.023 0.602 1.00 . A A . 31 TYR HD2 1 1 18 8406 1 1 31 TYR HE1 H -5.869 9.079 2.229 1.00 . A A . 31 TYR HE1 1 1 18 8407 1 1 31 TYR HE2 H -9.274 6.460 2.322 1.00 . A A . 31 TYR HE2 1 1 18 8408 1 1 31 TYR HH H -7.940 8.357 4.206 1.00 . A A . 31 TYR HH 1 1 18 8409 1 1 31 TYR N N -3.989 3.835 -1.010 1.00 . A A . 31 TYR N 1 1 18 8410 1 1 31 TYR O O -6.240 2.341 -0.105 1.00 . A A . 31 TYR O 1 1 18 8411 1 1 31 TYR OH O -8.230 8.663 3.343 1.00 . A A . 31 TYR OH 1 1 18 8412 1 1 32 ALA C C -8.059 2.529 3.009 1.00 . A A . 32 ALA C 1 1 18 8413 1 1 32 ALA CA C -6.688 2.008 2.555 1.00 . A A . 32 ALA CA 1 1 18 8414 1 1 32 ALA CB C -5.862 1.553 3.760 1.00 . A A . 32 ALA CB 1 1 18 8415 1 1 32 ALA H H -5.471 3.791 2.503 1.00 . A A . 32 ALA H 1 1 18 8416 1 1 32 ALA HA H -6.807 1.191 1.862 1.00 . A A . 32 ALA HA 1 1 18 8417 1 1 32 ALA HB1 H -5.897 2.311 4.529 1.00 . A A . 32 ALA HB1 1 1 18 8418 1 1 32 ALA HB2 H -4.837 1.396 3.456 1.00 . A A . 32 ALA HB2 1 1 18 8419 1 1 32 ALA HB3 H -6.268 0.630 4.146 1.00 . A A . 32 ALA HB3 1 1 18 8420 1 1 32 ALA N N -5.888 3.110 1.933 1.00 . A A . 32 ALA N 1 1 18 8421 1 1 32 ALA O O -8.234 3.707 3.257 1.00 . A A . 32 ALA O 1 1 18 8422 1 1 33 ARG C C -11.009 1.056 4.507 1.00 . A A . 33 ARG C 1 1 18 8423 1 1 33 ARG CA C -10.395 2.089 3.549 1.00 . A A . 33 ARG CA 1 1 18 8424 1 1 33 ARG CB C -11.215 2.169 2.256 1.00 . A A . 33 ARG CB 1 1 18 8425 1 1 33 ARG CD C -12.924 3.792 3.104 1.00 . A A . 33 ARG CD 1 1 18 8426 1 1 33 ARG CG C -11.791 3.578 2.093 1.00 . A A . 33 ARG CG 1 1 18 8427 1 1 33 ARG CZ C -15.102 3.744 2.040 1.00 . A A . 33 ARG CZ 1 1 18 8428 1 1 33 ARG H H -8.863 0.711 2.908 1.00 . A A . 33 ARG H 1 1 18 8429 1 1 33 ARG HA H -10.350 3.060 4.016 1.00 . A A . 33 ARG HA 1 1 18 8430 1 1 33 ARG HB2 H -10.579 1.941 1.412 1.00 . A A . 33 ARG HB2 1 1 18 8431 1 1 33 ARG HB3 H -12.024 1.455 2.298 1.00 . A A . 33 ARG HB3 1 1 18 8432 1 1 33 ARG HD2 H -13.246 2.844 3.512 1.00 . A A . 33 ARG HD2 1 1 18 8433 1 1 33 ARG HD3 H -12.603 4.453 3.894 1.00 . A A . 33 ARG HD3 1 1 18 8434 1 1 33 ARG HE H -13.940 5.357 2.026 1.00 . A A . 33 ARG HE 1 1 18 8435 1 1 33 ARG HG2 H -11.013 4.307 2.265 1.00 . A A . 33 ARG HG2 1 1 18 8436 1 1 33 ARG HG3 H -12.178 3.695 1.093 1.00 . A A . 33 ARG HG3 1 1 18 8437 1 1 33 ARG HH11 H -16.007 4.153 3.781 1.00 . A A . 33 ARG HH11 1 1 18 8438 1 1 33 ARG HH12 H -16.907 3.159 2.687 1.00 . A A . 33 ARG HH12 1 1 18 8439 1 1 33 ARG HH21 H -14.448 3.176 0.231 1.00 . A A . 33 ARG HH21 1 1 18 8440 1 1 33 ARG HH22 H -16.023 2.605 0.670 1.00 . A A . 33 ARG HH22 1 1 18 8441 1 1 33 ARG N N -9.031 1.654 3.115 1.00 . A A . 33 ARG N 1 1 18 8442 1 1 33 ARG NE N -14.025 4.427 2.325 1.00 . A A . 33 ARG NE 1 1 18 8443 1 1 33 ARG NH1 N -16.083 3.681 2.903 1.00 . A A . 33 ARG NH1 1 1 18 8444 1 1 33 ARG NH2 N -15.199 3.127 0.890 1.00 . A A . 33 ARG NH2 1 1 18 8445 1 1 33 ARG O O -11.151 -0.100 4.156 1.00 . A A . 33 ARG O 1 1 18 8446 1 1 34 PRO C C -13.399 0.207 6.273 1.00 . A A . 34 PRO C 1 1 18 8447 1 1 34 PRO CA C -11.979 0.610 6.701 1.00 . A A . 34 PRO CA 1 1 18 8448 1 1 34 PRO CB C -12.008 1.460 7.971 1.00 . A A . 34 PRO CB 1 1 18 8449 1 1 34 PRO CD C -11.228 2.885 6.195 1.00 . A A . 34 PRO CD 1 1 18 8450 1 1 34 PRO CG C -12.005 2.873 7.486 1.00 . A A . 34 PRO CG 1 1 18 8451 1 1 34 PRO HA H -11.366 -0.264 6.856 1.00 . A A . 34 PRO HA 1 1 18 8452 1 1 34 PRO HB2 H -12.907 1.255 8.539 1.00 . A A . 34 PRO HB2 1 1 18 8453 1 1 34 PRO HB3 H -11.131 1.272 8.571 1.00 . A A . 34 PRO HB3 1 1 18 8454 1 1 34 PRO HD2 H -11.658 3.595 5.501 1.00 . A A . 34 PRO HD2 1 1 18 8455 1 1 34 PRO HD3 H -10.189 3.111 6.380 1.00 . A A . 34 PRO HD3 1 1 18 8456 1 1 34 PRO HG2 H -13.019 3.206 7.313 1.00 . A A . 34 PRO HG2 1 1 18 8457 1 1 34 PRO HG3 H -11.521 3.512 8.208 1.00 . A A . 34 PRO HG3 1 1 18 8458 1 1 34 PRO N N -11.363 1.512 5.689 1.00 . A A . 34 PRO N 1 1 18 8459 1 1 34 PRO O O -13.652 -0.981 6.187 1.00 . A A . 34 PRO O 1 1 18 8460 1 1 34 PRO OXT O -14.205 1.092 6.034 1.00 . A A . 34 PRO OXT 1 1 19 8461 1 1 1 GLY C C 8.632 4.398 6.260 1.00 . A A . 1 GLY C 1 1 19 8462 1 1 1 GLY CA C 9.863 3.623 6.735 1.00 . A A . 1 GLY CA 1 1 19 8463 1 1 1 GLY H1 H 11.380 4.488 5.596 1.00 . A A . 1 GLY H1 1 1 19 8464 1 1 1 GLY H2 H 11.843 4.096 7.183 1.00 . A A . 1 GLY H2 1 1 19 8465 1 1 1 GLY H3 H 10.858 5.448 6.893 1.00 . A A . 1 GLY H3 1 1 19 8466 1 1 1 GLY HA2 H 9.981 2.729 6.140 1.00 . A A . 1 GLY HA2 1 1 19 8467 1 1 1 GLY HA3 H 9.736 3.351 7.771 1.00 . A A . 1 GLY HA3 1 1 19 8468 1 1 1 GLY N N 11.078 4.478 6.591 1.00 . A A . 1 GLY N 1 1 19 8469 1 1 1 GLY O O 7.743 4.701 7.036 1.00 . A A . 1 GLY O 1 1 19 8470 1 1 2 CYS C C 7.248 5.233 2.952 1.00 . A A . 2 CYS C 1 1 19 8471 1 1 2 CYS CA C 7.404 5.482 4.460 1.00 . A A . 2 CYS CA 1 1 19 8472 1 1 2 CYS CB C 7.733 6.952 4.734 1.00 . A A . 2 CYS CB 1 1 19 8473 1 1 2 CYS H H 9.306 4.468 4.389 1.00 . A A . 2 CYS H 1 1 19 8474 1 1 2 CYS HA H 6.504 5.203 4.983 1.00 . A A . 2 CYS HA 1 1 19 8475 1 1 2 CYS HB2 H 8.430 7.017 5.556 1.00 . A A . 2 CYS HB2 1 1 19 8476 1 1 2 CYS HB3 H 8.173 7.394 3.853 1.00 . A A . 2 CYS HB3 1 1 19 8477 1 1 2 CYS N N 8.575 4.722 4.992 1.00 . A A . 2 CYS N 1 1 19 8478 1 1 2 CYS O O 8.129 5.537 2.169 1.00 . A A . 2 CYS O 1 1 19 8479 1 1 2 CYS SG S 6.219 7.847 5.161 1.00 . A A . 2 CYS SG 1 1 19 8480 1 1 3 GLY C C 5.147 5.580 0.462 1.00 . A A . 3 GLY C 1 1 19 8481 1 1 3 GLY CA C 5.902 4.408 1.095 1.00 . A A . 3 GLY CA 1 1 19 8482 1 1 3 GLY H H 5.439 4.449 3.195 1.00 . A A . 3 GLY H 1 1 19 8483 1 1 3 GLY HA2 H 6.854 4.283 0.600 1.00 . A A . 3 GLY HA2 1 1 19 8484 1 1 3 GLY HA3 H 5.318 3.508 0.988 1.00 . A A . 3 GLY HA3 1 1 19 8485 1 1 3 GLY N N 6.130 4.683 2.545 1.00 . A A . 3 GLY N 1 1 19 8486 1 1 3 GLY O O 5.739 6.566 0.066 1.00 . A A . 3 GLY O 1 1 19 8487 1 1 4 GLY C C 1.909 6.006 -1.094 1.00 . A A . 4 GLY C 1 1 19 8488 1 1 4 GLY CA C 3.045 6.587 -0.245 1.00 . A A . 4 GLY CA 1 1 19 8489 1 1 4 GLY H H 3.389 4.674 0.691 1.00 . A A . 4 GLY H 1 1 19 8490 1 1 4 GLY HA2 H 2.630 7.202 0.540 1.00 . A A . 4 GLY HA2 1 1 19 8491 1 1 4 GLY HA3 H 3.684 7.189 -0.873 1.00 . A A . 4 GLY HA3 1 1 19 8492 1 1 4 GLY N N 3.843 5.479 0.363 1.00 . A A . 4 GLY N 1 1 19 8493 1 1 4 GLY O O 1.186 5.128 -0.660 1.00 . A A . 4 GLY O 1 1 19 8494 1 1 5 LEU C C 1.235 5.058 -4.286 1.00 . A A . 5 LEU C 1 1 19 8495 1 1 5 LEU CA C 0.659 5.973 -3.189 1.00 . A A . 5 LEU CA 1 1 19 8496 1 1 5 LEU CB C 0.020 7.222 -3.811 1.00 . A A . 5 LEU CB 1 1 19 8497 1 1 5 LEU CD1 C -2.133 5.985 -4.172 1.00 . A A . 5 LEU CD1 1 1 19 8498 1 1 5 LEU CD2 C -1.750 7.231 -2.037 1.00 . A A . 5 LEU CD2 1 1 19 8499 1 1 5 LEU CG C -1.492 7.227 -3.546 1.00 . A A . 5 LEU CG 1 1 19 8500 1 1 5 LEU H H 2.345 7.200 -2.625 1.00 . A A . 5 LEU H 1 1 19 8501 1 1 5 LEU HA H -0.073 5.438 -2.607 1.00 . A A . 5 LEU HA 1 1 19 8502 1 1 5 LEU HB2 H 0.463 8.107 -3.375 1.00 . A A . 5 LEU HB2 1 1 19 8503 1 1 5 LEU HB3 H 0.195 7.222 -4.877 1.00 . A A . 5 LEU HB3 1 1 19 8504 1 1 5 LEU HD11 H -1.892 5.945 -5.224 1.00 . A A . 5 LEU HD11 1 1 19 8505 1 1 5 LEU HD12 H -3.206 6.032 -4.051 1.00 . A A . 5 LEU HD12 1 1 19 8506 1 1 5 LEU HD13 H -1.755 5.099 -3.684 1.00 . A A . 5 LEU HD13 1 1 19 8507 1 1 5 LEU HD21 H -2.750 7.591 -1.843 1.00 . A A . 5 LEU HD21 1 1 19 8508 1 1 5 LEU HD22 H -1.036 7.880 -1.551 1.00 . A A . 5 LEU HD22 1 1 19 8509 1 1 5 LEU HD23 H -1.647 6.229 -1.649 1.00 . A A . 5 LEU HD23 1 1 19 8510 1 1 5 LEU HG H -1.927 8.113 -3.988 1.00 . A A . 5 LEU HG 1 1 19 8511 1 1 5 LEU N N 1.749 6.492 -2.301 1.00 . A A . 5 LEU N 1 1 19 8512 1 1 5 LEU O O 0.497 4.452 -5.040 1.00 . A A . 5 LEU O 1 1 19 8513 1 1 6 MET C C 4.440 3.426 -4.882 1.00 . A A . 6 MET C 1 1 19 8514 1 1 6 MET CA C 3.153 4.070 -5.421 1.00 . A A . 6 MET CA 1 1 19 8515 1 1 6 MET CB C 3.463 5.005 -6.596 1.00 . A A . 6 MET CB 1 1 19 8516 1 1 6 MET CE C 0.854 5.620 -8.473 1.00 . A A . 6 MET CE 1 1 19 8517 1 1 6 MET CG C 3.157 4.291 -7.915 1.00 . A A . 6 MET CG 1 1 19 8518 1 1 6 MET H H 3.118 5.442 -3.759 1.00 . A A . 6 MET H 1 1 19 8519 1 1 6 MET HA H 2.455 3.309 -5.729 1.00 . A A . 6 MET HA 1 1 19 8520 1 1 6 MET HB2 H 2.854 5.894 -6.517 1.00 . A A . 6 MET HB2 1 1 19 8521 1 1 6 MET HB3 H 4.507 5.280 -6.573 1.00 . A A . 6 MET HB3 1 1 19 8522 1 1 6 MET HE1 H 0.171 5.129 -9.151 1.00 . A A . 6 MET HE1 1 1 19 8523 1 1 6 MET HE2 H 0.581 6.657 -8.378 1.00 . A A . 6 MET HE2 1 1 19 8524 1 1 6 MET HE3 H 0.807 5.147 -7.501 1.00 . A A . 6 MET HE3 1 1 19 8525 1 1 6 MET HG2 H 4.056 3.831 -8.295 1.00 . A A . 6 MET HG2 1 1 19 8526 1 1 6 MET HG3 H 2.406 3.532 -7.749 1.00 . A A . 6 MET HG3 1 1 19 8527 1 1 6 MET N N 2.540 4.949 -4.378 1.00 . A A . 6 MET N 1 1 19 8528 1 1 6 MET O O 5.405 3.249 -5.602 1.00 . A A . 6 MET O 1 1 19 8529 1 1 6 MET SD S 2.539 5.493 -9.120 1.00 . A A . 6 MET SD 1 1 19 8530 1 1 7 ALA C C 5.825 0.994 -3.516 1.00 . A A . 7 ALA C 1 1 19 8531 1 1 7 ALA CA C 5.675 2.437 -3.024 1.00 . A A . 7 ALA CA 1 1 19 8532 1 1 7 ALA CB C 5.440 2.472 -1.512 1.00 . A A . 7 ALA CB 1 1 19 8533 1 1 7 ALA H H 3.663 3.222 -3.059 1.00 . A A . 7 ALA H 1 1 19 8534 1 1 7 ALA HA H 6.556 3.008 -3.270 1.00 . A A . 7 ALA HA 1 1 19 8535 1 1 7 ALA HB1 H 6.385 2.599 -1.005 1.00 . A A . 7 ALA HB1 1 1 19 8536 1 1 7 ALA HB2 H 4.983 1.545 -1.196 1.00 . A A . 7 ALA HB2 1 1 19 8537 1 1 7 ALA HB3 H 4.787 3.297 -1.267 1.00 . A A . 7 ALA HB3 1 1 19 8538 1 1 7 ALA N N 4.456 3.072 -3.618 1.00 . A A . 7 ALA N 1 1 19 8539 1 1 7 ALA O O 5.192 0.582 -4.466 1.00 . A A . 7 ALA O 1 1 19 8540 1 1 8 GLY C C 6.577 -2.112 -2.110 1.00 . A A . 8 GLY C 1 1 19 8541 1 1 8 GLY CA C 6.859 -1.192 -3.298 1.00 . A A . 8 GLY CA 1 1 19 8542 1 1 8 GLY H H 7.168 0.582 -2.114 1.00 . A A . 8 GLY H 1 1 19 8543 1 1 8 GLY HA2 H 6.178 -1.424 -4.105 1.00 . A A . 8 GLY HA2 1 1 19 8544 1 1 8 GLY HA3 H 7.874 -1.336 -3.628 1.00 . A A . 8 GLY HA3 1 1 19 8545 1 1 8 GLY N N 6.664 0.225 -2.875 1.00 . A A . 8 GLY N 1 1 19 8546 1 1 8 GLY O O 7.431 -2.340 -1.274 1.00 . A A . 8 GLY O 1 1 19 8547 1 1 9 CYS C C 5.754 -4.881 -1.030 1.00 . A A . 9 CYS C 1 1 19 8548 1 1 9 CYS CA C 5.028 -3.536 -0.892 1.00 . A A . 9 CYS CA 1 1 19 8549 1 1 9 CYS CB C 3.508 -3.713 -0.982 1.00 . A A . 9 CYS CB 1 1 19 8550 1 1 9 CYS H H 4.710 -2.428 -2.715 1.00 . A A . 9 CYS H 1 1 19 8551 1 1 9 CYS HA H 5.284 -3.071 0.043 1.00 . A A . 9 CYS HA 1 1 19 8552 1 1 9 CYS HB2 H 3.245 -4.090 -1.959 1.00 . A A . 9 CYS HB2 1 1 19 8553 1 1 9 CYS HB3 H 3.180 -4.411 -0.226 1.00 . A A . 9 CYS HB3 1 1 19 8554 1 1 9 CYS N N 5.381 -2.634 -2.029 1.00 . A A . 9 CYS N 1 1 19 8555 1 1 9 CYS O O 6.743 -5.124 -0.365 1.00 . A A . 9 CYS O 1 1 19 8556 1 1 9 CYS SG S 2.703 -2.114 -0.718 1.00 . A A . 9 CYS SG 1 1 19 8557 1 1 10 ASP C C 6.138 -7.800 -0.750 1.00 . A A . 10 ASP C 1 1 19 8558 1 1 10 ASP CA C 5.926 -7.082 -2.093 1.00 . A A . 10 ASP CA 1 1 19 8559 1 1 10 ASP CB C 7.269 -6.775 -2.766 1.00 . A A . 10 ASP CB 1 1 19 8560 1 1 10 ASP CG C 7.868 -8.063 -3.339 1.00 . A A . 10 ASP CG 1 1 19 8561 1 1 10 ASP H H 4.479 -5.515 -2.415 1.00 . A A . 10 ASP H 1 1 19 8562 1 1 10 ASP HA H 5.324 -7.692 -2.747 1.00 . A A . 10 ASP HA 1 1 19 8563 1 1 10 ASP HB2 H 7.117 -6.062 -3.564 1.00 . A A . 10 ASP HB2 1 1 19 8564 1 1 10 ASP HB3 H 7.949 -6.358 -2.037 1.00 . A A . 10 ASP HB3 1 1 19 8565 1 1 10 ASP N N 5.274 -5.746 -1.893 1.00 . A A . 10 ASP N 1 1 19 8566 1 1 10 ASP O O 7.247 -8.145 -0.389 1.00 . A A . 10 ASP O 1 1 19 8567 1 1 10 ASP OD1 O 7.219 -8.682 -4.167 1.00 . A A . 10 ASP OD1 1 1 19 8568 1 1 10 ASP OD2 O 8.967 -8.409 -2.939 1.00 . A A . 10 ASP OD2 1 1 19 8569 1 1 11 GLY C C 4.098 -8.277 2.240 1.00 . A A . 11 GLY C 1 1 19 8570 1 1 11 GLY CA C 5.218 -8.725 1.299 1.00 . A A . 11 GLY CA 1 1 19 8571 1 1 11 GLY H H 4.194 -7.744 -0.321 1.00 . A A . 11 GLY H 1 1 19 8572 1 1 11 GLY HA2 H 5.156 -9.793 1.145 1.00 . A A . 11 GLY HA2 1 1 19 8573 1 1 11 GLY HA3 H 6.173 -8.479 1.740 1.00 . A A . 11 GLY HA3 1 1 19 8574 1 1 11 GLY N N 5.080 -8.029 -0.012 1.00 . A A . 11 GLY N 1 1 19 8575 1 1 11 GLY O O 3.754 -7.110 2.295 1.00 . A A . 11 GLY O 1 1 19 8576 1 1 12 LYS C C 3.000 -8.068 5.154 1.00 . A A . 12 LYS C 1 1 19 8577 1 1 12 LYS CA C 2.433 -8.816 3.932 1.00 . A A . 12 LYS CA 1 1 19 8578 1 1 12 LYS CB C 1.787 -10.144 4.354 1.00 . A A . 12 LYS CB 1 1 19 8579 1 1 12 LYS CD C 3.077 -12.290 4.399 1.00 . A A . 12 LYS CD 1 1 19 8580 1 1 12 LYS CE C 4.386 -12.901 4.909 1.00 . A A . 12 LYS CE 1 1 19 8581 1 1 12 LYS CG C 2.788 -10.988 5.153 1.00 . A A . 12 LYS CG 1 1 19 8582 1 1 12 LYS H H 3.829 -10.125 2.925 1.00 . A A . 12 LYS H 1 1 19 8583 1 1 12 LYS HA H 1.703 -8.202 3.428 1.00 . A A . 12 LYS HA 1 1 19 8584 1 1 12 LYS HB2 H 0.921 -9.941 4.965 1.00 . A A . 12 LYS HB2 1 1 19 8585 1 1 12 LYS HB3 H 1.484 -10.688 3.472 1.00 . A A . 12 LYS HB3 1 1 19 8586 1 1 12 LYS HD2 H 2.267 -12.987 4.563 1.00 . A A . 12 LYS HD2 1 1 19 8587 1 1 12 LYS HD3 H 3.165 -12.083 3.344 1.00 . A A . 12 LYS HD3 1 1 19 8588 1 1 12 LYS HE2 H 4.427 -12.854 5.989 1.00 . A A . 12 LYS HE2 1 1 19 8589 1 1 12 LYS HE3 H 4.480 -13.922 4.573 1.00 . A A . 12 LYS HE3 1 1 19 8590 1 1 12 LYS HG2 H 3.706 -10.433 5.281 1.00 . A A . 12 LYS HG2 1 1 19 8591 1 1 12 LYS HG3 H 2.370 -11.220 6.121 1.00 . A A . 12 LYS HG3 1 1 19 8592 1 1 12 LYS HZ1 H 5.423 -11.103 4.698 1.00 . A A . 12 LYS HZ1 1 1 19 8593 1 1 12 LYS HZ2 H 5.345 -12.028 3.275 1.00 . A A . 12 LYS HZ2 1 1 19 8594 1 1 12 LYS HZ3 H 6.393 -12.485 4.533 1.00 . A A . 12 LYS HZ3 1 1 19 8595 1 1 12 LYS N N 3.530 -9.192 2.985 1.00 . A A . 12 LYS N 1 1 19 8596 1 1 12 LYS NZ N 5.468 -12.066 4.308 1.00 . A A . 12 LYS NZ 1 1 19 8597 1 1 12 LYS O O 2.258 -7.539 5.960 1.00 . A A . 12 LYS O 1 1 19 8598 1 1 13 SER C C 5.425 -5.905 6.021 1.00 . A A . 13 SER C 1 1 19 8599 1 1 13 SER CA C 4.918 -7.294 6.449 1.00 . A A . 13 SER CA 1 1 19 8600 1 1 13 SER CB C 6.084 -8.180 6.895 1.00 . A A . 13 SER CB 1 1 19 8601 1 1 13 SER H H 4.886 -8.438 4.624 1.00 . A A . 13 SER H 1 1 19 8602 1 1 13 SER HA H 4.204 -7.200 7.250 1.00 . A A . 13 SER HA 1 1 19 8603 1 1 13 SER HB2 H 6.325 -8.883 6.115 1.00 . A A . 13 SER HB2 1 1 19 8604 1 1 13 SER HB3 H 6.951 -7.561 7.095 1.00 . A A . 13 SER HB3 1 1 19 8605 1 1 13 SER HG H 6.030 -8.398 8.828 1.00 . A A . 13 SER HG 1 1 19 8606 1 1 13 SER N N 4.307 -8.013 5.289 1.00 . A A . 13 SER N 1 1 19 8607 1 1 13 SER O O 5.992 -5.179 6.815 1.00 . A A . 13 SER O 1 1 19 8608 1 1 13 SER OG O 5.713 -8.891 8.068 1.00 . A A . 13 SER OG 1 1 19 8609 1 1 14 THR C C 4.904 -3.075 5.009 1.00 . A A . 14 THR C 1 1 19 8610 1 1 14 THR CA C 5.695 -4.189 4.309 1.00 . A A . 14 THR CA 1 1 19 8611 1 1 14 THR CB C 5.438 -4.177 2.794 1.00 . A A . 14 THR CB 1 1 19 8612 1 1 14 THR CG2 C 3.934 -4.080 2.513 1.00 . A A . 14 THR CG2 1 1 19 8613 1 1 14 THR H H 4.765 -6.127 4.153 1.00 . A A . 14 THR H 1 1 19 8614 1 1 14 THR HA H 6.751 -4.076 4.503 1.00 . A A . 14 THR HA 1 1 19 8615 1 1 14 THR HB H 5.821 -5.088 2.359 1.00 . A A . 14 THR HB 1 1 19 8616 1 1 14 THR HG1 H 6.844 -3.392 1.701 1.00 . A A . 14 THR HG1 1 1 19 8617 1 1 14 THR HG21 H 3.384 -4.513 3.335 1.00 . A A . 14 THR HG21 1 1 19 8618 1 1 14 THR HG22 H 3.704 -4.614 1.603 1.00 . A A . 14 THR HG22 1 1 19 8619 1 1 14 THR HG23 H 3.655 -3.042 2.401 1.00 . A A . 14 THR HG23 1 1 19 8620 1 1 14 THR N N 5.225 -5.530 4.778 1.00 . A A . 14 THR N 1 1 19 8621 1 1 14 THR O O 3.735 -3.232 5.314 1.00 . A A . 14 THR O 1 1 19 8622 1 1 14 THR OG1 O 6.102 -3.063 2.214 1.00 . A A . 14 THR OG1 1 1 19 8623 1 1 15 PHE C C 4.885 0.434 5.097 1.00 . A A . 15 PHE C 1 1 19 8624 1 1 15 PHE CA C 4.818 -0.836 5.949 1.00 . A A . 15 PHE CA 1 1 19 8625 1 1 15 PHE CB C 5.549 -0.635 7.279 1.00 . A A . 15 PHE CB 1 1 19 8626 1 1 15 PHE CD1 C 3.883 -1.534 8.943 1.00 . A A . 15 PHE CD1 1 1 19 8627 1 1 15 PHE CD2 C 4.246 0.862 8.834 1.00 . A A . 15 PHE CD2 1 1 19 8628 1 1 15 PHE CE1 C 2.941 -1.345 9.960 1.00 . A A . 15 PHE CE1 1 1 19 8629 1 1 15 PHE CE2 C 3.305 1.050 9.853 1.00 . A A . 15 PHE CE2 1 1 19 8630 1 1 15 PHE CG C 4.536 -0.430 8.380 1.00 . A A . 15 PHE CG 1 1 19 8631 1 1 15 PHE CZ C 2.652 -0.053 10.416 1.00 . A A . 15 PHE CZ 1 1 19 8632 1 1 15 PHE H H 6.475 -1.853 5.015 1.00 . A A . 15 PHE H 1 1 19 8633 1 1 15 PHE HA H 3.790 -1.107 6.133 1.00 . A A . 15 PHE HA 1 1 19 8634 1 1 15 PHE HB2 H 6.149 -1.507 7.498 1.00 . A A . 15 PHE HB2 1 1 19 8635 1 1 15 PHE HB3 H 6.187 0.233 7.212 1.00 . A A . 15 PHE HB3 1 1 19 8636 1 1 15 PHE HD1 H 4.106 -2.530 8.591 1.00 . A A . 15 PHE HD1 1 1 19 8637 1 1 15 PHE HD2 H 4.750 1.713 8.400 1.00 . A A . 15 PHE HD2 1 1 19 8638 1 1 15 PHE HE1 H 2.437 -2.196 10.395 1.00 . A A . 15 PHE HE1 1 1 19 8639 1 1 15 PHE HE2 H 3.081 2.047 10.204 1.00 . A A . 15 PHE HE2 1 1 19 8640 1 1 15 PHE HZ H 1.925 0.092 11.201 1.00 . A A . 15 PHE HZ 1 1 19 8641 1 1 15 PHE N N 5.533 -1.956 5.268 1.00 . A A . 15 PHE N 1 1 19 8642 1 1 15 PHE O O 5.948 0.867 4.690 1.00 . A A . 15 PHE O 1 1 19 8643 1 1 16 CYS C C 3.929 3.507 4.905 1.00 . A A . 16 CYS C 1 1 19 8644 1 1 16 CYS CA C 3.733 2.276 4.005 1.00 . A A . 16 CYS CA 1 1 19 8645 1 1 16 CYS CB C 2.347 2.292 3.348 1.00 . A A . 16 CYS CB 1 1 19 8646 1 1 16 CYS H H 2.914 0.658 5.172 1.00 . A A . 16 CYS H 1 1 19 8647 1 1 16 CYS HA H 4.499 2.239 3.247 1.00 . A A . 16 CYS HA 1 1 19 8648 1 1 16 CYS HB2 H 1.597 2.487 4.100 1.00 . A A . 16 CYS HB2 1 1 19 8649 1 1 16 CYS HB3 H 2.314 3.069 2.598 1.00 . A A . 16 CYS HB3 1 1 19 8650 1 1 16 CYS N N 3.753 1.031 4.829 1.00 . A A . 16 CYS N 1 1 19 8651 1 1 16 CYS O O 4.505 3.415 5.973 1.00 . A A . 16 CYS O 1 1 19 8652 1 1 16 CYS SG S 2.020 0.689 2.571 1.00 . A A . 16 CYS SG 1 1 19 8653 1 1 17 CYS C C 2.588 5.907 6.442 1.00 . A A . 17 CYS C 1 1 19 8654 1 1 17 CYS CA C 3.628 5.888 5.311 1.00 . A A . 17 CYS CA 1 1 19 8655 1 1 17 CYS CB C 3.418 7.060 4.342 1.00 . A A . 17 CYS CB 1 1 19 8656 1 1 17 CYS H H 3.005 4.710 3.614 1.00 . A A . 17 CYS H 1 1 19 8657 1 1 17 CYS HA H 4.625 5.927 5.723 1.00 . A A . 17 CYS HA 1 1 19 8658 1 1 17 CYS HB2 H 2.724 6.766 3.567 1.00 . A A . 17 CYS HB2 1 1 19 8659 1 1 17 CYS HB3 H 3.017 7.906 4.880 1.00 . A A . 17 CYS HB3 1 1 19 8660 1 1 17 CYS N N 3.462 4.657 4.480 1.00 . A A . 17 CYS N 1 1 19 8661 1 1 17 CYS O O 2.812 5.357 7.503 1.00 . A A . 17 CYS O 1 1 19 8662 1 1 17 CYS SG S 4.997 7.520 3.587 1.00 . A A . 17 CYS SG 1 1 19 8663 1 1 18 SER C C -0.986 6.451 6.639 1.00 . A A . 18 SER C 1 1 19 8664 1 1 18 SER CA C 0.400 6.579 7.280 1.00 . A A . 18 SER CA 1 1 19 8665 1 1 18 SER CB C 0.568 7.947 7.943 1.00 . A A . 18 SER CB 1 1 19 8666 1 1 18 SER H H 1.295 6.962 5.359 1.00 . A A . 18 SER H 1 1 19 8667 1 1 18 SER HA H 0.554 5.795 8.006 1.00 . A A . 18 SER HA 1 1 19 8668 1 1 18 SER HB2 H 1.030 8.631 7.252 1.00 . A A . 18 SER HB2 1 1 19 8669 1 1 18 SER HB3 H -0.404 8.330 8.228 1.00 . A A . 18 SER HB3 1 1 19 8670 1 1 18 SER HG H 2.307 7.930 8.818 1.00 . A A . 18 SER HG 1 1 19 8671 1 1 18 SER N N 1.454 6.529 6.223 1.00 . A A . 18 SER N 1 1 19 8672 1 1 18 SER O O -1.350 7.224 5.771 1.00 . A A . 18 SER O 1 1 19 8673 1 1 18 SER OG O 1.394 7.814 9.093 1.00 . A A . 18 SER OG 1 1 19 8674 1 1 19 GLY C C -2.988 4.809 5.014 1.00 . A A . 19 GLY C 1 1 19 8675 1 1 19 GLY CA C -3.115 5.287 6.466 1.00 . A A . 19 GLY CA 1 1 19 8676 1 1 19 GLY H H -1.436 4.864 7.750 1.00 . A A . 19 GLY H 1 1 19 8677 1 1 19 GLY HA2 H -3.657 4.549 7.042 1.00 . A A . 19 GLY HA2 1 1 19 8678 1 1 19 GLY HA3 H -3.651 6.223 6.487 1.00 . A A . 19 GLY HA3 1 1 19 8679 1 1 19 GLY N N -1.755 5.476 7.055 1.00 . A A . 19 GLY N 1 1 19 8680 1 1 19 GLY O O -3.777 5.173 4.163 1.00 . A A . 19 GLY O 1 1 19 8681 1 1 20 TYR C C -1.647 1.972 3.334 1.00 . A A . 20 TYR C 1 1 19 8682 1 1 20 TYR CA C -1.814 3.496 3.331 1.00 . A A . 20 TYR CA 1 1 19 8683 1 1 20 TYR CB C -0.529 4.163 2.827 1.00 . A A . 20 TYR CB 1 1 19 8684 1 1 20 TYR CD1 C -1.863 5.859 1.509 1.00 . A A . 20 TYR CD1 1 1 19 8685 1 1 20 TYR CD2 C -0.001 6.628 2.856 1.00 . A A . 20 TYR CD2 1 1 19 8686 1 1 20 TYR CE1 C -2.111 7.174 1.100 1.00 . A A . 20 TYR CE1 1 1 19 8687 1 1 20 TYR CE2 C -0.249 7.944 2.448 1.00 . A A . 20 TYR CE2 1 1 19 8688 1 1 20 TYR CG C -0.807 5.585 2.388 1.00 . A A . 20 TYR CG 1 1 19 8689 1 1 20 TYR CZ C -1.305 8.217 1.569 1.00 . A A . 20 TYR CZ 1 1 19 8690 1 1 20 TYR H H -1.373 3.718 5.430 1.00 . A A . 20 TYR H 1 1 19 8691 1 1 20 TYR HA H -2.651 3.788 2.712 1.00 . A A . 20 TYR HA 1 1 19 8692 1 1 20 TYR HB2 H 0.205 4.171 3.620 1.00 . A A . 20 TYR HB2 1 1 19 8693 1 1 20 TYR HB3 H -0.141 3.601 1.989 1.00 . A A . 20 TYR HB3 1 1 19 8694 1 1 20 TYR HD1 H -2.486 5.057 1.147 1.00 . A A . 20 TYR HD1 1 1 19 8695 1 1 20 TYR HD2 H 0.814 6.418 3.533 1.00 . A A . 20 TYR HD2 1 1 19 8696 1 1 20 TYR HE1 H -2.924 7.383 0.422 1.00 . A A . 20 TYR HE1 1 1 19 8697 1 1 20 TYR HE2 H 0.375 8.748 2.809 1.00 . A A . 20 TYR HE2 1 1 19 8698 1 1 20 TYR HH H -2.463 9.726 1.376 1.00 . A A . 20 TYR HH 1 1 19 8699 1 1 20 TYR N N -1.996 3.998 4.726 1.00 . A A . 20 TYR N 1 1 19 8700 1 1 20 TYR O O -0.732 1.442 3.937 1.00 . A A . 20 TYR O 1 1 19 8701 1 1 20 TYR OH O -1.550 9.515 1.165 1.00 . A A . 20 TYR OH 1 1 19 8702 1 1 21 ASN C C -1.698 -0.631 1.298 1.00 . A A . 21 ASN C 1 1 19 8703 1 1 21 ASN CA C -2.399 -0.224 2.598 1.00 . A A . 21 ASN CA 1 1 19 8704 1 1 21 ASN CB C -3.844 -0.737 2.625 1.00 . A A . 21 ASN CB 1 1 19 8705 1 1 21 ASN CG C -3.939 -2.004 3.485 1.00 . A A . 21 ASN CG 1 1 19 8706 1 1 21 ASN H H -3.235 1.718 2.166 1.00 . A A . 21 ASN H 1 1 19 8707 1 1 21 ASN HA H -1.851 -0.593 3.448 1.00 . A A . 21 ASN HA 1 1 19 8708 1 1 21 ASN HB2 H -4.486 0.024 3.042 1.00 . A A . 21 ASN HB2 1 1 19 8709 1 1 21 ASN HB3 H -4.164 -0.965 1.619 1.00 . A A . 21 ASN HB3 1 1 19 8710 1 1 21 ASN HD21 H -5.800 -1.634 4.073 1.00 . A A . 21 ASN HD21 1 1 19 8711 1 1 21 ASN HD22 H -5.116 -3.061 4.687 1.00 . A A . 21 ASN HD22 1 1 19 8712 1 1 21 ASN N N -2.514 1.267 2.654 1.00 . A A . 21 ASN N 1 1 19 8713 1 1 21 ASN ND2 N -5.043 -2.254 4.136 1.00 . A A . 21 ASN ND2 1 1 19 8714 1 1 21 ASN O O -1.186 0.203 0.586 1.00 . A A . 21 ASN O 1 1 19 8715 1 1 21 ASN OD1 O -3.003 -2.778 3.562 1.00 . A A . 21 ASN OD1 1 1 19 8716 1 1 22 CYS C C -1.995 -3.024 -1.209 1.00 . A A . 22 CYS C 1 1 19 8717 1 1 22 CYS CA C -0.991 -2.340 -0.277 1.00 . A A . 22 CYS CA 1 1 19 8718 1 1 22 CYS CB C 0.088 -3.330 0.166 1.00 . A A . 22 CYS CB 1 1 19 8719 1 1 22 CYS H H -2.083 -2.562 1.574 1.00 . A A . 22 CYS H 1 1 19 8720 1 1 22 CYS HA H -0.534 -1.498 -0.772 1.00 . A A . 22 CYS HA 1 1 19 8721 1 1 22 CYS HB2 H -0.316 -3.996 0.911 1.00 . A A . 22 CYS HB2 1 1 19 8722 1 1 22 CYS HB3 H 0.422 -3.902 -0.688 1.00 . A A . 22 CYS HB3 1 1 19 8723 1 1 22 CYS N N -1.666 -1.901 0.984 1.00 . A A . 22 CYS N 1 1 19 8724 1 1 22 CYS O O -2.829 -3.798 -0.775 1.00 . A A . 22 CYS O 1 1 19 8725 1 1 22 CYS SG S 1.488 -2.422 0.864 1.00 . A A . 22 CYS SG 1 1 19 8726 1 1 23 SER C C -2.336 -4.769 -3.868 1.00 . A A . 23 SER C 1 1 19 8727 1 1 23 SER CA C -2.863 -3.391 -3.452 1.00 . A A . 23 SER CA 1 1 19 8728 1 1 23 SER CB C -2.919 -2.457 -4.662 1.00 . A A . 23 SER CB 1 1 19 8729 1 1 23 SER H H -1.232 -2.128 -2.816 1.00 . A A . 23 SER H 1 1 19 8730 1 1 23 SER HA H -3.843 -3.479 -3.011 1.00 . A A . 23 SER HA 1 1 19 8731 1 1 23 SER HB2 H -2.870 -1.432 -4.334 1.00 . A A . 23 SER HB2 1 1 19 8732 1 1 23 SER HB3 H -2.081 -2.665 -5.314 1.00 . A A . 23 SER HB3 1 1 19 8733 1 1 23 SER HG H -3.979 -3.315 -6.050 1.00 . A A . 23 SER HG 1 1 19 8734 1 1 23 SER N N -1.916 -2.750 -2.489 1.00 . A A . 23 SER N 1 1 19 8735 1 1 23 SER O O -1.150 -4.939 -4.077 1.00 . A A . 23 SER O 1 1 19 8736 1 1 23 SER OG O -4.141 -2.670 -5.358 1.00 . A A . 23 SER OG 1 1 19 8737 1 1 24 PRO C C -2.442 -7.153 -5.850 1.00 . A A . 24 PRO C 1 1 19 8738 1 1 24 PRO CA C -2.860 -7.092 -4.372 1.00 . A A . 24 PRO CA 1 1 19 8739 1 1 24 PRO CB C -4.136 -7.898 -4.125 1.00 . A A . 24 PRO CB 1 1 19 8740 1 1 24 PRO CD C -4.685 -5.584 -3.742 1.00 . A A . 24 PRO CD 1 1 19 8741 1 1 24 PRO CG C -5.245 -6.901 -4.213 1.00 . A A . 24 PRO CG 1 1 19 8742 1 1 24 PRO HA H -2.068 -7.460 -3.741 1.00 . A A . 24 PRO HA 1 1 19 8743 1 1 24 PRO HB2 H -4.251 -8.660 -4.884 1.00 . A A . 24 PRO HB2 1 1 19 8744 1 1 24 PRO HB3 H -4.117 -8.343 -3.143 1.00 . A A . 24 PRO HB3 1 1 19 8745 1 1 24 PRO HD2 H -5.098 -4.769 -4.321 1.00 . A A . 24 PRO HD2 1 1 19 8746 1 1 24 PRO HD3 H -4.880 -5.443 -2.691 1.00 . A A . 24 PRO HD3 1 1 19 8747 1 1 24 PRO HG2 H -5.587 -6.816 -5.236 1.00 . A A . 24 PRO HG2 1 1 19 8748 1 1 24 PRO HG3 H -6.061 -7.197 -3.573 1.00 . A A . 24 PRO HG3 1 1 19 8749 1 1 24 PRO N N -3.240 -5.711 -3.975 1.00 . A A . 24 PRO N 1 1 19 8750 1 1 24 PRO O O -1.691 -8.022 -6.248 1.00 . A A . 24 PRO O 1 1 19 8751 1 1 25 THR C C -1.511 -5.183 -8.437 1.00 . A A . 25 THR C 1 1 19 8752 1 1 25 THR CA C -2.554 -6.261 -8.116 1.00 . A A . 25 THR CA 1 1 19 8753 1 1 25 THR CB C -3.861 -5.977 -8.869 1.00 . A A . 25 THR CB 1 1 19 8754 1 1 25 THR CG2 C -3.640 -6.189 -10.368 1.00 . A A . 25 THR CG2 1 1 19 8755 1 1 25 THR H H -3.531 -5.554 -6.324 1.00 . A A . 25 THR H 1 1 19 8756 1 1 25 THR HA H -2.179 -7.232 -8.392 1.00 . A A . 25 THR HA 1 1 19 8757 1 1 25 THR HB H -4.161 -4.955 -8.696 1.00 . A A . 25 THR HB 1 1 19 8758 1 1 25 THR HG1 H -4.613 -7.757 -8.604 1.00 . A A . 25 THR HG1 1 1 19 8759 1 1 25 THR HG21 H -3.388 -7.223 -10.551 1.00 . A A . 25 THR HG21 1 1 19 8760 1 1 25 THR HG22 H -2.834 -5.555 -10.708 1.00 . A A . 25 THR HG22 1 1 19 8761 1 1 25 THR HG23 H -4.545 -5.939 -10.903 1.00 . A A . 25 THR HG23 1 1 19 8762 1 1 25 THR N N -2.924 -6.243 -6.665 1.00 . A A . 25 THR N 1 1 19 8763 1 1 25 THR O O -0.637 -5.385 -9.258 1.00 . A A . 25 THR O 1 1 19 8764 1 1 25 THR OG1 O -4.881 -6.856 -8.408 1.00 . A A . 25 THR OG1 1 1 19 8765 1 1 26 TRP C C 0.703 -3.173 -7.353 1.00 . A A . 26 TRP C 1 1 19 8766 1 1 26 TRP CA C -0.621 -2.940 -8.097 1.00 . A A . 26 TRP CA 1 1 19 8767 1 1 26 TRP CB C -1.286 -1.648 -7.609 1.00 . A A . 26 TRP CB 1 1 19 8768 1 1 26 TRP CD1 C -3.069 -2.082 -9.362 1.00 . A A . 26 TRP CD1 1 1 19 8769 1 1 26 TRP CD2 C -3.783 -0.728 -7.713 1.00 . A A . 26 TRP CD2 1 1 19 8770 1 1 26 TRP CE2 C -4.867 -0.887 -8.609 1.00 . A A . 26 TRP CE2 1 1 19 8771 1 1 26 TRP CE3 C -3.973 0.084 -6.582 1.00 . A A . 26 TRP CE3 1 1 19 8772 1 1 26 TRP CG C -2.652 -1.500 -8.213 1.00 . A A . 26 TRP CG 1 1 19 8773 1 1 26 TRP CH2 C -6.266 0.542 -7.262 1.00 . A A . 26 TRP CH2 1 1 19 8774 1 1 26 TRP CZ2 C -6.094 -0.262 -8.390 1.00 . A A . 26 TRP CZ2 1 1 19 8775 1 1 26 TRP CZ3 C -5.207 0.715 -6.358 1.00 . A A . 26 TRP CZ3 1 1 19 8776 1 1 26 TRP H H -2.321 -3.896 -7.161 1.00 . A A . 26 TRP H 1 1 19 8777 1 1 26 TRP HA H -0.438 -2.875 -9.158 1.00 . A A . 26 TRP HA 1 1 19 8778 1 1 26 TRP HB2 H -1.368 -1.668 -6.534 1.00 . A A . 26 TRP HB2 1 1 19 8779 1 1 26 TRP HB3 H -0.677 -0.811 -7.903 1.00 . A A . 26 TRP HB3 1 1 19 8780 1 1 26 TRP HD1 H -2.474 -2.728 -9.992 1.00 . A A . 26 TRP HD1 1 1 19 8781 1 1 26 TRP HE1 H -4.919 -2.011 -10.359 1.00 . A A . 26 TRP HE1 1 1 19 8782 1 1 26 TRP HE3 H -3.164 0.222 -5.881 1.00 . A A . 26 TRP HE3 1 1 19 8783 1 1 26 TRP HH2 H -7.213 1.029 -7.084 1.00 . A A . 26 TRP HH2 1 1 19 8784 1 1 26 TRP HZ2 H -6.906 -0.400 -9.089 1.00 . A A . 26 TRP HZ2 1 1 19 8785 1 1 26 TRP HZ3 H -5.342 1.337 -5.485 1.00 . A A . 26 TRP HZ3 1 1 19 8786 1 1 26 TRP N N -1.602 -4.038 -7.810 1.00 . A A . 26 TRP N 1 1 19 8787 1 1 26 TRP NE1 N -4.382 -1.722 -9.594 1.00 . A A . 26 TRP NE1 1 1 19 8788 1 1 26 TRP O O 1.731 -2.643 -7.733 1.00 . A A . 26 TRP O 1 1 19 8789 1 1 27 LYS C C 2.523 -2.987 -4.859 1.00 . A A . 27 LYS C 1 1 19 8790 1 1 27 LYS CA C 1.933 -4.253 -5.519 1.00 . A A . 27 LYS CA 1 1 19 8791 1 1 27 LYS CB C 2.926 -4.847 -6.532 1.00 . A A . 27 LYS CB 1 1 19 8792 1 1 27 LYS CD C 4.001 -6.833 -5.452 1.00 . A A . 27 LYS CD 1 1 19 8793 1 1 27 LYS CE C 4.866 -7.912 -6.115 1.00 . A A . 27 LYS CE 1 1 19 8794 1 1 27 LYS CG C 2.915 -6.375 -6.429 1.00 . A A . 27 LYS CG 1 1 19 8795 1 1 27 LYS H H -0.159 -4.373 -6.022 1.00 . A A . 27 LYS H 1 1 19 8796 1 1 27 LYS HA H 1.720 -4.987 -4.760 1.00 . A A . 27 LYS HA 1 1 19 8797 1 1 27 LYS HB2 H 2.642 -4.555 -7.532 1.00 . A A . 27 LYS HB2 1 1 19 8798 1 1 27 LYS HB3 H 3.919 -4.482 -6.319 1.00 . A A . 27 LYS HB3 1 1 19 8799 1 1 27 LYS HD2 H 4.621 -5.991 -5.179 1.00 . A A . 27 LYS HD2 1 1 19 8800 1 1 27 LYS HD3 H 3.538 -7.242 -4.565 1.00 . A A . 27 LYS HD3 1 1 19 8801 1 1 27 LYS HE2 H 5.141 -8.667 -5.391 1.00 . A A . 27 LYS HE2 1 1 19 8802 1 1 27 LYS HE3 H 4.340 -8.359 -6.945 1.00 . A A . 27 LYS HE3 1 1 19 8803 1 1 27 LYS HG2 H 1.948 -6.705 -6.075 1.00 . A A . 27 LYS HG2 1 1 19 8804 1 1 27 LYS HG3 H 3.105 -6.801 -7.403 1.00 . A A . 27 LYS HG3 1 1 19 8805 1 1 27 LYS HZ1 H 6.751 -7.879 -7.002 1.00 . A A . 27 LYS HZ1 1 1 19 8806 1 1 27 LYS HZ2 H 6.525 -6.686 -5.814 1.00 . A A . 27 LYS HZ2 1 1 19 8807 1 1 27 LYS HZ3 H 5.804 -6.515 -7.344 1.00 . A A . 27 LYS HZ3 1 1 19 8808 1 1 27 LYS N N 0.685 -3.962 -6.301 1.00 . A A . 27 LYS N 1 1 19 8809 1 1 27 LYS NZ N 6.077 -7.193 -6.606 1.00 . A A . 27 LYS NZ 1 1 19 8810 1 1 27 LYS O O 3.627 -3.023 -4.350 1.00 . A A . 27 LYS O 1 1 19 8811 1 1 28 TRP C C 1.387 -0.129 -3.110 1.00 . A A . 28 TRP C 1 1 19 8812 1 1 28 TRP CA C 2.364 -0.662 -4.168 1.00 . A A . 28 TRP CA 1 1 19 8813 1 1 28 TRP CB C 2.630 0.371 -5.282 1.00 . A A . 28 TRP CB 1 1 19 8814 1 1 28 TRP CD1 C 0.295 1.371 -5.364 1.00 . A A . 28 TRP CD1 1 1 19 8815 1 1 28 TRP CD2 C 1.075 0.804 -7.393 1.00 . A A . 28 TRP CD2 1 1 19 8816 1 1 28 TRP CE2 C -0.214 1.348 -7.592 1.00 . A A . 28 TRP CE2 1 1 19 8817 1 1 28 TRP CE3 C 1.791 0.364 -8.520 1.00 . A A . 28 TRP CE3 1 1 19 8818 1 1 28 TRP CG C 1.373 0.820 -5.968 1.00 . A A . 28 TRP CG 1 1 19 8819 1 1 28 TRP CH2 C -0.048 1.016 -9.977 1.00 . A A . 28 TRP CH2 1 1 19 8820 1 1 28 TRP CZ2 C -0.773 1.457 -8.866 1.00 . A A . 28 TRP CZ2 1 1 19 8821 1 1 28 TRP CZ3 C 1.232 0.471 -9.805 1.00 . A A . 28 TRP CZ3 1 1 19 8822 1 1 28 TRP H H 0.909 -1.863 -5.225 1.00 . A A . 28 TRP H 1 1 19 8823 1 1 28 TRP HA H 3.303 -0.912 -3.690 1.00 . A A . 28 TRP HA 1 1 19 8824 1 1 28 TRP HB2 H 3.110 1.234 -4.849 1.00 . A A . 28 TRP HB2 1 1 19 8825 1 1 28 TRP HB3 H 3.293 -0.068 -6.013 1.00 . A A . 28 TRP HB3 1 1 19 8826 1 1 28 TRP HD1 H 0.185 1.536 -4.304 1.00 . A A . 28 TRP HD1 1 1 19 8827 1 1 28 TRP HE1 H -1.523 2.083 -6.154 1.00 . A A . 28 TRP HE1 1 1 19 8828 1 1 28 TRP HE3 H 2.778 -0.056 -8.399 1.00 . A A . 28 TRP HE3 1 1 19 8829 1 1 28 TRP HH2 H -0.473 1.096 -10.967 1.00 . A A . 28 TRP HH2 1 1 19 8830 1 1 28 TRP HZ2 H -1.760 1.877 -8.993 1.00 . A A . 28 TRP HZ2 1 1 19 8831 1 1 28 TRP HZ3 H 1.791 0.131 -10.664 1.00 . A A . 28 TRP HZ3 1 1 19 8832 1 1 28 TRP N N 1.806 -1.883 -4.832 1.00 . A A . 28 TRP N 1 1 19 8833 1 1 28 TRP NE1 N -0.648 1.679 -6.327 1.00 . A A . 28 TRP NE1 1 1 19 8834 1 1 28 TRP O O 0.215 -0.462 -3.109 1.00 . A A . 28 TRP O 1 1 19 8835 1 1 29 CYS C C -0.080 2.156 -1.681 1.00 . A A . 29 CYS C 1 1 19 8836 1 1 29 CYS CA C 0.988 1.213 -1.113 1.00 . A A . 29 CYS CA 1 1 19 8837 1 1 29 CYS CB C 1.912 1.977 -0.161 1.00 . A A . 29 CYS CB 1 1 19 8838 1 1 29 CYS H H 2.824 0.906 -2.206 1.00 . A A . 29 CYS H 1 1 19 8839 1 1 29 CYS HA H 0.521 0.399 -0.584 1.00 . A A . 29 CYS HA 1 1 19 8840 1 1 29 CYS HB2 H 2.551 2.635 -0.727 1.00 . A A . 29 CYS HB2 1 1 19 8841 1 1 29 CYS HB3 H 1.315 2.557 0.529 1.00 . A A . 29 CYS HB3 1 1 19 8842 1 1 29 CYS N N 1.873 0.674 -2.194 1.00 . A A . 29 CYS N 1 1 19 8843 1 1 29 CYS O O 0.184 2.971 -2.543 1.00 . A A . 29 CYS O 1 1 19 8844 1 1 29 CYS SG S 2.932 0.807 0.772 1.00 . A A . 29 CYS SG 1 1 19 8845 1 1 30 VAL C C -3.239 3.349 -0.433 1.00 . A A . 30 VAL C 1 1 19 8846 1 1 30 VAL CA C -2.404 2.921 -1.643 1.00 . A A . 30 VAL CA 1 1 19 8847 1 1 30 VAL CB C -3.246 2.051 -2.588 1.00 . A A . 30 VAL CB 1 1 19 8848 1 1 30 VAL CG1 C -2.437 1.716 -3.839 1.00 . A A . 30 VAL CG1 1 1 19 8849 1 1 30 VAL CG2 C -3.653 0.752 -1.881 1.00 . A A . 30 VAL CG2 1 1 19 8850 1 1 30 VAL H H -1.451 1.384 -0.478 1.00 . A A . 30 VAL H 1 1 19 8851 1 1 30 VAL HA H -2.024 3.783 -2.167 1.00 . A A . 30 VAL HA 1 1 19 8852 1 1 30 VAL HB H -4.133 2.598 -2.875 1.00 . A A . 30 VAL HB 1 1 19 8853 1 1 30 VAL HG11 H -1.681 2.472 -3.994 1.00 . A A . 30 VAL HG11 1 1 19 8854 1 1 30 VAL HG12 H -3.094 1.686 -4.694 1.00 . A A . 30 VAL HG12 1 1 19 8855 1 1 30 VAL HG13 H -1.962 0.754 -3.715 1.00 . A A . 30 VAL HG13 1 1 19 8856 1 1 30 VAL HG21 H -2.770 0.171 -1.657 1.00 . A A . 30 VAL HG21 1 1 19 8857 1 1 30 VAL HG22 H -4.305 0.182 -2.525 1.00 . A A . 30 VAL HG22 1 1 19 8858 1 1 30 VAL HG23 H -4.171 0.989 -0.963 1.00 . A A . 30 VAL HG23 1 1 19 8859 1 1 30 VAL N N -1.283 2.046 -1.180 1.00 . A A . 30 VAL N 1 1 19 8860 1 1 30 VAL O O -2.946 2.976 0.684 1.00 . A A . 30 VAL O 1 1 19 8861 1 1 31 TYR C C -5.697 3.316 1.231 1.00 . A A . 31 TYR C 1 1 19 8862 1 1 31 TYR CA C -5.122 4.546 0.522 1.00 . A A . 31 TYR CA 1 1 19 8863 1 1 31 TYR CB C -6.245 5.400 -0.078 1.00 . A A . 31 TYR CB 1 1 19 8864 1 1 31 TYR CD1 C -5.641 7.636 0.924 1.00 . A A . 31 TYR CD1 1 1 19 8865 1 1 31 TYR CD2 C -5.473 7.350 -1.479 1.00 . A A . 31 TYR CD2 1 1 19 8866 1 1 31 TYR CE1 C -5.204 8.960 0.797 1.00 . A A . 31 TYR CE1 1 1 19 8867 1 1 31 TYR CE2 C -5.036 8.674 -1.605 1.00 . A A . 31 TYR CE2 1 1 19 8868 1 1 31 TYR CG C -5.776 6.830 -0.215 1.00 . A A . 31 TYR CG 1 1 19 8869 1 1 31 TYR CZ C -4.900 9.479 -0.467 1.00 . A A . 31 TYR CZ 1 1 19 8870 1 1 31 TYR H H -4.508 4.405 -1.549 1.00 . A A . 31 TYR H 1 1 19 8871 1 1 31 TYR HA H -4.536 5.136 1.212 1.00 . A A . 31 TYR HA 1 1 19 8872 1 1 31 TYR HB2 H -6.511 5.013 -1.051 1.00 . A A . 31 TYR HB2 1 1 19 8873 1 1 31 TYR HB3 H -7.108 5.366 0.570 1.00 . A A . 31 TYR HB3 1 1 19 8874 1 1 31 TYR HD1 H -5.875 7.235 1.899 1.00 . A A . 31 TYR HD1 1 1 19 8875 1 1 31 TYR HD2 H -5.577 6.730 -2.357 1.00 . A A . 31 TYR HD2 1 1 19 8876 1 1 31 TYR HE1 H -5.099 9.580 1.674 1.00 . A A . 31 TYR HE1 1 1 19 8877 1 1 31 TYR HE2 H -4.802 9.075 -2.582 1.00 . A A . 31 TYR HE2 1 1 19 8878 1 1 31 TYR HH H -3.517 10.774 -0.714 1.00 . A A . 31 TYR HH 1 1 19 8879 1 1 31 TYR N N -4.279 4.118 -0.638 1.00 . A A . 31 TYR N 1 1 19 8880 1 1 31 TYR O O -6.174 2.392 0.598 1.00 . A A . 31 TYR O 1 1 19 8881 1 1 31 TYR OH O -4.469 10.785 -0.592 1.00 . A A . 31 TYR OH 1 1 19 8882 1 1 32 ALA C C -7.668 2.312 3.599 1.00 . A A . 32 ALA C 1 1 19 8883 1 1 32 ALA CA C -6.180 2.117 3.290 1.00 . A A . 32 ALA CA 1 1 19 8884 1 1 32 ALA CB C -5.361 2.063 4.582 1.00 . A A . 32 ALA CB 1 1 19 8885 1 1 32 ALA H H -5.251 4.048 3.026 1.00 . A A . 32 ALA H 1 1 19 8886 1 1 32 ALA HA H -6.030 1.212 2.722 1.00 . A A . 32 ALA HA 1 1 19 8887 1 1 32 ALA HB1 H -5.525 1.114 5.072 1.00 . A A . 32 ALA HB1 1 1 19 8888 1 1 32 ALA HB2 H -5.669 2.863 5.239 1.00 . A A . 32 ALA HB2 1 1 19 8889 1 1 32 ALA HB3 H -4.312 2.171 4.349 1.00 . A A . 32 ALA HB3 1 1 19 8890 1 1 32 ALA N N -5.647 3.293 2.539 1.00 . A A . 32 ALA N 1 1 19 8891 1 1 32 ALA O O -8.040 3.114 4.434 1.00 . A A . 32 ALA O 1 1 19 8892 1 1 33 ARG C C -10.719 0.415 2.767 1.00 . A A . 33 ARG C 1 1 19 8893 1 1 33 ARG CA C -9.991 1.712 3.165 1.00 . A A . 33 ARG CA 1 1 19 8894 1 1 33 ARG CB C -10.430 2.881 2.276 1.00 . A A . 33 ARG CB 1 1 19 8895 1 1 33 ARG CD C -11.699 4.178 4.000 1.00 . A A . 33 ARG CD 1 1 19 8896 1 1 33 ARG CG C -11.817 3.366 2.706 1.00 . A A . 33 ARG CG 1 1 19 8897 1 1 33 ARG CZ C -14.007 4.770 4.442 1.00 . A A . 33 ARG CZ 1 1 19 8898 1 1 33 ARG H H -8.193 0.942 2.252 1.00 . A A . 33 ARG H 1 1 19 8899 1 1 33 ARG HA H -10.180 1.945 4.200 1.00 . A A . 33 ARG HA 1 1 19 8900 1 1 33 ARG HB2 H -9.721 3.691 2.372 1.00 . A A . 33 ARG HB2 1 1 19 8901 1 1 33 ARG HB3 H -10.467 2.558 1.247 1.00 . A A . 33 ARG HB3 1 1 19 8902 1 1 33 ARG HD2 H -11.776 3.526 4.860 1.00 . A A . 33 ARG HD2 1 1 19 8903 1 1 33 ARG HD3 H -10.768 4.723 4.020 1.00 . A A . 33 ARG HD3 1 1 19 8904 1 1 33 ARG HE H -12.728 6.024 3.581 1.00 . A A . 33 ARG HE 1 1 19 8905 1 1 33 ARG HG2 H -12.238 3.986 1.927 1.00 . A A . 33 ARG HG2 1 1 19 8906 1 1 33 ARG HG3 H -12.460 2.515 2.875 1.00 . A A . 33 ARG HG3 1 1 19 8907 1 1 33 ARG HH11 H -13.384 4.740 6.347 1.00 . A A . 33 ARG HH11 1 1 19 8908 1 1 33 ARG HH12 H -15.047 4.321 6.097 1.00 . A A . 33 ARG HH12 1 1 19 8909 1 1 33 ARG HH21 H -14.901 4.714 2.648 1.00 . A A . 33 ARG HH21 1 1 19 8910 1 1 33 ARG HH22 H -15.907 4.306 3.997 1.00 . A A . 33 ARG HH22 1 1 19 8911 1 1 33 ARG N N -8.522 1.579 2.923 1.00 . A A . 33 ARG N 1 1 19 8912 1 1 33 ARG NE N -12.846 5.129 3.964 1.00 . A A . 33 ARG NE 1 1 19 8913 1 1 33 ARG NH1 N -14.159 4.598 5.729 1.00 . A A . 33 ARG NH1 1 1 19 8914 1 1 33 ARG NH2 N -15.017 4.582 3.633 1.00 . A A . 33 ARG NH2 1 1 19 8915 1 1 33 ARG O O -11.488 0.400 1.824 1.00 . A A . 33 ARG O 1 1 19 8916 1 1 34 PRO C C -12.572 -1.928 3.639 1.00 . A A . 34 PRO C 1 1 19 8917 1 1 34 PRO CA C -11.091 -1.950 3.231 1.00 . A A . 34 PRO CA 1 1 19 8918 1 1 34 PRO CB C -10.298 -2.926 4.096 1.00 . A A . 34 PRO CB 1 1 19 8919 1 1 34 PRO CD C -9.539 -0.704 4.658 1.00 . A A . 34 PRO CD 1 1 19 8920 1 1 34 PRO CG C -9.735 -2.095 5.204 1.00 . A A . 34 PRO CG 1 1 19 8921 1 1 34 PRO HA H -10.987 -2.211 2.189 1.00 . A A . 34 PRO HA 1 1 19 8922 1 1 34 PRO HB2 H -10.951 -3.692 4.492 1.00 . A A . 34 PRO HB2 1 1 19 8923 1 1 34 PRO HB3 H -9.497 -3.371 3.526 1.00 . A A . 34 PRO HB3 1 1 19 8924 1 1 34 PRO HD2 H -9.806 0.036 5.402 1.00 . A A . 34 PRO HD2 1 1 19 8925 1 1 34 PRO HD3 H -8.520 -0.565 4.332 1.00 . A A . 34 PRO HD3 1 1 19 8926 1 1 34 PRO HG2 H -10.426 -2.074 6.035 1.00 . A A . 34 PRO HG2 1 1 19 8927 1 1 34 PRO HG3 H -8.786 -2.498 5.521 1.00 . A A . 34 PRO HG3 1 1 19 8928 1 1 34 PRO N N -10.450 -0.636 3.508 1.00 . A A . 34 PRO N 1 1 19 8929 1 1 34 PRO O O -13.387 -2.381 2.852 1.00 . A A . 34 PRO O 1 1 19 8930 1 1 34 PRO OXT O -12.864 -1.457 4.728 1.00 . A A . 34 PRO OXT 1 1 20 8931 1 1 1 GLY C C 9.310 5.801 1.244 1.00 . A A . 1 GLY C 1 1 20 8932 1 1 1 GLY CA C 10.436 6.350 0.362 1.00 . A A . 1 GLY CA 1 1 20 8933 1 1 1 GLY H1 H 11.795 5.415 1.638 1.00 . A A . 1 GLY H1 1 1 20 8934 1 1 1 GLY H2 H 12.507 6.141 0.277 1.00 . A A . 1 GLY H2 1 1 20 8935 1 1 1 GLY H3 H 11.657 4.679 0.115 1.00 . A A . 1 GLY H3 1 1 20 8936 1 1 1 GLY HA2 H 10.597 7.394 0.591 1.00 . A A . 1 GLY HA2 1 1 20 8937 1 1 1 GLY HA3 H 10.157 6.248 -0.675 1.00 . A A . 1 GLY HA3 1 1 20 8938 1 1 1 GLY N N 11.693 5.588 0.618 1.00 . A A . 1 GLY N 1 1 20 8939 1 1 1 GLY O O 9.054 4.612 1.270 1.00 . A A . 1 GLY O 1 1 20 8940 1 1 2 CYS C C 6.277 5.861 2.009 1.00 . A A . 2 CYS C 1 1 20 8941 1 1 2 CYS CA C 7.517 6.202 2.847 1.00 . A A . 2 CYS CA 1 1 20 8942 1 1 2 CYS CB C 7.229 7.388 3.772 1.00 . A A . 2 CYS CB 1 1 20 8943 1 1 2 CYS H H 8.860 7.617 1.919 1.00 . A A . 2 CYS H 1 1 20 8944 1 1 2 CYS HA H 7.825 5.347 3.428 1.00 . A A . 2 CYS HA 1 1 20 8945 1 1 2 CYS HB2 H 8.162 7.832 4.086 1.00 . A A . 2 CYS HB2 1 1 20 8946 1 1 2 CYS HB3 H 6.641 8.123 3.243 1.00 . A A . 2 CYS HB3 1 1 20 8947 1 1 2 CYS N N 8.634 6.664 1.962 1.00 . A A . 2 CYS N 1 1 20 8948 1 1 2 CYS O O 6.181 6.233 0.853 1.00 . A A . 2 CYS O 1 1 20 8949 1 1 2 CYS SG S 6.315 6.814 5.226 1.00 . A A . 2 CYS SG 1 1 20 8950 1 1 3 GLY C C 3.423 6.046 1.272 1.00 . A A . 3 GLY C 1 1 20 8951 1 1 3 GLY CA C 4.094 4.784 1.826 1.00 . A A . 3 GLY CA 1 1 20 8952 1 1 3 GLY H H 5.434 4.863 3.515 1.00 . A A . 3 GLY H 1 1 20 8953 1 1 3 GLY HA2 H 4.357 4.126 1.010 1.00 . A A . 3 GLY HA2 1 1 20 8954 1 1 3 GLY HA3 H 3.407 4.277 2.486 1.00 . A A . 3 GLY HA3 1 1 20 8955 1 1 3 GLY N N 5.330 5.153 2.583 1.00 . A A . 3 GLY N 1 1 20 8956 1 1 3 GLY O O 2.990 6.906 2.013 1.00 . A A . 3 GLY O 1 1 20 8957 1 1 4 GLY C C 1.811 6.931 -1.821 1.00 . A A . 4 GLY C 1 1 20 8958 1 1 4 GLY CA C 2.698 7.360 -0.648 1.00 . A A . 4 GLY CA 1 1 20 8959 1 1 4 GLY H H 3.697 5.448 -0.602 1.00 . A A . 4 GLY H 1 1 20 8960 1 1 4 GLY HA2 H 2.095 7.868 0.091 1.00 . A A . 4 GLY HA2 1 1 20 8961 1 1 4 GLY HA3 H 3.466 8.029 -1.008 1.00 . A A . 4 GLY HA3 1 1 20 8962 1 1 4 GLY N N 3.338 6.157 -0.031 1.00 . A A . 4 GLY N 1 1 20 8963 1 1 4 GLY O O 1.873 7.504 -2.893 1.00 . A A . 4 GLY O 1 1 20 8964 1 1 5 LEU C C 0.856 4.749 -3.857 1.00 . A A . 5 LEU C 1 1 20 8965 1 1 5 LEU CA C 0.077 5.419 -2.704 1.00 . A A . 5 LEU CA 1 1 20 8966 1 1 5 LEU CB C -0.688 6.648 -3.209 1.00 . A A . 5 LEU CB 1 1 20 8967 1 1 5 LEU CD1 C -2.959 7.687 -3.108 1.00 . A A . 5 LEU CD1 1 1 20 8968 1 1 5 LEU CD2 C -2.606 5.580 -4.407 1.00 . A A . 5 LEU CD2 1 1 20 8969 1 1 5 LEU CG C -2.191 6.365 -3.159 1.00 . A A . 5 LEU CG 1 1 20 8970 1 1 5 LEU H H 0.973 5.483 -0.742 1.00 . A A . 5 LEU H 1 1 20 8971 1 1 5 LEU HA H -0.622 4.713 -2.287 1.00 . A A . 5 LEU HA 1 1 20 8972 1 1 5 LEU HB2 H -0.460 7.498 -2.583 1.00 . A A . 5 LEU HB2 1 1 20 8973 1 1 5 LEU HB3 H -0.398 6.862 -4.227 1.00 . A A . 5 LEU HB3 1 1 20 8974 1 1 5 LEU HD11 H -2.547 8.372 -3.835 1.00 . A A . 5 LEU HD11 1 1 20 8975 1 1 5 LEU HD12 H -2.873 8.115 -2.120 1.00 . A A . 5 LEU HD12 1 1 20 8976 1 1 5 LEU HD13 H -4.001 7.508 -3.333 1.00 . A A . 5 LEU HD13 1 1 20 8977 1 1 5 LEU HD21 H -3.543 5.966 -4.781 1.00 . A A . 5 LEU HD21 1 1 20 8978 1 1 5 LEU HD22 H -2.722 4.537 -4.153 1.00 . A A . 5 LEU HD22 1 1 20 8979 1 1 5 LEU HD23 H -1.846 5.683 -5.167 1.00 . A A . 5 LEU HD23 1 1 20 8980 1 1 5 LEU HG H -2.417 5.786 -2.276 1.00 . A A . 5 LEU HG 1 1 20 8981 1 1 5 LEU N N 0.991 5.920 -1.619 1.00 . A A . 5 LEU N 1 1 20 8982 1 1 5 LEU O O 0.260 4.214 -4.773 1.00 . A A . 5 LEU O 1 1 20 8983 1 1 6 MET C C 4.308 3.608 -4.363 1.00 . A A . 6 MET C 1 1 20 8984 1 1 6 MET CA C 2.959 4.103 -4.908 1.00 . A A . 6 MET CA 1 1 20 8985 1 1 6 MET CB C 3.164 5.196 -5.961 1.00 . A A . 6 MET CB 1 1 20 8986 1 1 6 MET CE C 2.504 5.190 -9.934 1.00 . A A . 6 MET CE 1 1 20 8987 1 1 6 MET CG C 2.437 4.805 -7.248 1.00 . A A . 6 MET CG 1 1 20 8988 1 1 6 MET H H 2.635 5.177 -3.071 1.00 . A A . 6 MET H 1 1 20 8989 1 1 6 MET HA H 2.403 3.282 -5.333 1.00 . A A . 6 MET HA 1 1 20 8990 1 1 6 MET HB2 H 2.767 6.130 -5.591 1.00 . A A . 6 MET HB2 1 1 20 8991 1 1 6 MET HB3 H 4.218 5.307 -6.165 1.00 . A A . 6 MET HB3 1 1 20 8992 1 1 6 MET HE1 H 1.523 4.758 -10.078 1.00 . A A . 6 MET HE1 1 1 20 8993 1 1 6 MET HE2 H 3.232 4.400 -9.849 1.00 . A A . 6 MET HE2 1 1 20 8994 1 1 6 MET HE3 H 2.755 5.819 -10.777 1.00 . A A . 6 MET HE3 1 1 20 8995 1 1 6 MET HG2 H 2.912 3.938 -7.682 1.00 . A A . 6 MET HG2 1 1 20 8996 1 1 6 MET HG3 H 1.405 4.576 -7.024 1.00 . A A . 6 MET HG3 1 1 20 8997 1 1 6 MET N N 2.168 4.756 -3.819 1.00 . A A . 6 MET N 1 1 20 8998 1 1 6 MET O O 5.282 3.516 -5.087 1.00 . A A . 6 MET O 1 1 20 8999 1 1 6 MET SD S 2.507 6.182 -8.421 1.00 . A A . 6 MET SD 1 1 20 9000 1 1 7 ALA C C 5.759 1.286 -2.607 1.00 . A A . 7 ALA C 1 1 20 9001 1 1 7 ALA CA C 5.654 2.811 -2.494 1.00 . A A . 7 ALA CA 1 1 20 9002 1 1 7 ALA CB C 5.591 3.236 -1.027 1.00 . A A . 7 ALA CB 1 1 20 9003 1 1 7 ALA H H 3.572 3.376 -2.528 1.00 . A A . 7 ALA H 1 1 20 9004 1 1 7 ALA HA H 6.494 3.282 -2.978 1.00 . A A . 7 ALA HA 1 1 20 9005 1 1 7 ALA HB1 H 5.646 4.312 -0.962 1.00 . A A . 7 ALA HB1 1 1 20 9006 1 1 7 ALA HB2 H 6.421 2.800 -0.490 1.00 . A A . 7 ALA HB2 1 1 20 9007 1 1 7 ALA HB3 H 4.662 2.896 -0.592 1.00 . A A . 7 ALA HB3 1 1 20 9008 1 1 7 ALA N N 4.371 3.293 -3.091 1.00 . A A . 7 ALA N 1 1 20 9009 1 1 7 ALA O O 4.781 0.579 -2.464 1.00 . A A . 7 ALA O 1 1 20 9010 1 1 8 GLY C C 6.642 -1.391 -1.702 1.00 . A A . 8 GLY C 1 1 20 9011 1 1 8 GLY CA C 7.125 -0.700 -2.982 1.00 . A A . 8 GLY CA 1 1 20 9012 1 1 8 GLY H H 7.711 1.374 -2.966 1.00 . A A . 8 GLY H 1 1 20 9013 1 1 8 GLY HA2 H 6.557 -1.064 -3.826 1.00 . A A . 8 GLY HA2 1 1 20 9014 1 1 8 GLY HA3 H 8.171 -0.921 -3.132 1.00 . A A . 8 GLY HA3 1 1 20 9015 1 1 8 GLY N N 6.941 0.779 -2.858 1.00 . A A . 8 GLY N 1 1 20 9016 1 1 8 GLY O O 7.152 -1.145 -0.625 1.00 . A A . 8 GLY O 1 1 20 9017 1 1 9 CYS C C 5.205 -4.484 -0.789 1.00 . A A . 9 CYS C 1 1 20 9018 1 1 9 CYS CA C 5.137 -2.959 -0.605 1.00 . A A . 9 CYS CA 1 1 20 9019 1 1 9 CYS CB C 3.683 -2.488 -0.471 1.00 . A A . 9 CYS CB 1 1 20 9020 1 1 9 CYS H H 5.263 -2.431 -2.694 1.00 . A A . 9 CYS H 1 1 20 9021 1 1 9 CYS HA H 5.695 -2.666 0.269 1.00 . A A . 9 CYS HA 1 1 20 9022 1 1 9 CYS HB2 H 3.310 -2.745 0.509 1.00 . A A . 9 CYS HB2 1 1 20 9023 1 1 9 CYS HB3 H 3.640 -1.416 -0.600 1.00 . A A . 9 CYS HB3 1 1 20 9024 1 1 9 CYS N N 5.659 -2.252 -1.814 1.00 . A A . 9 CYS N 1 1 20 9025 1 1 9 CYS O O 4.417 -5.215 -0.219 1.00 . A A . 9 CYS O 1 1 20 9026 1 1 9 CYS SG S 2.655 -3.287 -1.733 1.00 . A A . 9 CYS SG 1 1 20 9027 1 1 10 ASP C C 6.315 -7.179 -0.439 1.00 . A A . 10 ASP C 1 1 20 9028 1 1 10 ASP CA C 6.261 -6.447 -1.789 1.00 . A A . 10 ASP CA 1 1 20 9029 1 1 10 ASP CB C 7.571 -6.635 -2.566 1.00 . A A . 10 ASP CB 1 1 20 9030 1 1 10 ASP CG C 7.936 -8.122 -2.623 1.00 . A A . 10 ASP CG 1 1 20 9031 1 1 10 ASP H H 6.770 -4.360 -2.019 1.00 . A A . 10 ASP H 1 1 20 9032 1 1 10 ASP HA H 5.431 -6.807 -2.376 1.00 . A A . 10 ASP HA 1 1 20 9033 1 1 10 ASP HB2 H 7.447 -6.256 -3.571 1.00 . A A . 10 ASP HB2 1 1 20 9034 1 1 10 ASP HB3 H 8.364 -6.091 -2.073 1.00 . A A . 10 ASP HB3 1 1 20 9035 1 1 10 ASP N N 6.142 -4.969 -1.574 1.00 . A A . 10 ASP N 1 1 20 9036 1 1 10 ASP O O 7.265 -7.053 0.310 1.00 . A A . 10 ASP O 1 1 20 9037 1 1 10 ASP OD1 O 7.216 -8.867 -3.269 1.00 . A A . 10 ASP OD1 1 1 20 9038 1 1 10 ASP OD2 O 8.930 -8.490 -2.018 1.00 . A A . 10 ASP OD2 1 1 20 9039 1 1 11 GLY C C 3.841 -8.633 1.737 1.00 . A A . 11 GLY C 1 1 20 9040 1 1 11 GLY CA C 5.261 -8.671 1.170 1.00 . A A . 11 GLY CA 1 1 20 9041 1 1 11 GLY H H 4.534 -8.011 -0.744 1.00 . A A . 11 GLY H 1 1 20 9042 1 1 11 GLY HA2 H 5.561 -9.697 1.008 1.00 . A A . 11 GLY HA2 1 1 20 9043 1 1 11 GLY HA3 H 5.936 -8.201 1.870 1.00 . A A . 11 GLY HA3 1 1 20 9044 1 1 11 GLY N N 5.291 -7.934 -0.126 1.00 . A A . 11 GLY N 1 1 20 9045 1 1 11 GLY O O 3.179 -7.612 1.707 1.00 . A A . 11 GLY O 1 1 20 9046 1 1 12 LYS C C 1.909 -8.973 4.143 1.00 . A A . 12 LYS C 1 1 20 9047 1 1 12 LYS CA C 1.984 -9.773 2.829 1.00 . A A . 12 LYS CA 1 1 20 9048 1 1 12 LYS CB C 1.690 -11.259 3.081 1.00 . A A . 12 LYS CB 1 1 20 9049 1 1 12 LYS CD C 3.289 -13.084 3.714 1.00 . A A . 12 LYS CD 1 1 20 9050 1 1 12 LYS CE C 4.778 -13.045 4.086 1.00 . A A . 12 LYS CE 1 1 20 9051 1 1 12 LYS CG C 2.609 -11.795 4.187 1.00 . A A . 12 LYS CG 1 1 20 9052 1 1 12 LYS H H 3.923 -10.547 2.266 1.00 . A A . 12 LYS H 1 1 20 9053 1 1 12 LYS HA H 1.276 -9.382 2.116 1.00 . A A . 12 LYS HA 1 1 20 9054 1 1 12 LYS HB2 H 0.660 -11.373 3.385 1.00 . A A . 12 LYS HB2 1 1 20 9055 1 1 12 LYS HB3 H 1.860 -11.817 2.172 1.00 . A A . 12 LYS HB3 1 1 20 9056 1 1 12 LYS HD2 H 2.819 -13.932 4.191 1.00 . A A . 12 LYS HD2 1 1 20 9057 1 1 12 LYS HD3 H 3.189 -13.173 2.643 1.00 . A A . 12 LYS HD3 1 1 20 9058 1 1 12 LYS HE2 H 4.937 -12.370 4.916 1.00 . A A . 12 LYS HE2 1 1 20 9059 1 1 12 LYS HE3 H 5.125 -14.035 4.339 1.00 . A A . 12 LYS HE3 1 1 20 9060 1 1 12 LYS HG2 H 3.361 -11.056 4.419 1.00 . A A . 12 LYS HG2 1 1 20 9061 1 1 12 LYS HG3 H 2.024 -12.003 5.070 1.00 . A A . 12 LYS HG3 1 1 20 9062 1 1 12 LYS HZ1 H 5.763 -11.556 3.007 1.00 . A A . 12 LYS HZ1 1 1 20 9063 1 1 12 LYS HZ2 H 4.866 -12.625 2.038 1.00 . A A . 12 LYS HZ2 1 1 20 9064 1 1 12 LYS HZ3 H 6.343 -13.120 2.712 1.00 . A A . 12 LYS HZ3 1 1 20 9065 1 1 12 LYS N N 3.368 -9.739 2.254 1.00 . A A . 12 LYS N 1 1 20 9066 1 1 12 LYS NZ N 5.489 -12.549 2.869 1.00 . A A . 12 LYS NZ 1 1 20 9067 1 1 12 LYS O O 0.838 -8.763 4.681 1.00 . A A . 12 LYS O 1 1 20 9068 1 1 13 SER C C 4.009 -6.578 5.868 1.00 . A A . 13 SER C 1 1 20 9069 1 1 13 SER CA C 3.009 -7.743 5.940 1.00 . A A . 13 SER CA 1 1 20 9070 1 1 13 SER CB C 3.413 -8.744 7.026 1.00 . A A . 13 SER CB 1 1 20 9071 1 1 13 SER H H 3.885 -8.701 4.219 1.00 . A A . 13 SER H 1 1 20 9072 1 1 13 SER HA H 2.015 -7.372 6.135 1.00 . A A . 13 SER HA 1 1 20 9073 1 1 13 SER HB2 H 2.941 -9.693 6.837 1.00 . A A . 13 SER HB2 1 1 20 9074 1 1 13 SER HB3 H 4.488 -8.873 7.016 1.00 . A A . 13 SER HB3 1 1 20 9075 1 1 13 SER HG H 3.749 -7.853 8.723 1.00 . A A . 13 SER HG 1 1 20 9076 1 1 13 SER N N 3.031 -8.525 4.665 1.00 . A A . 13 SER N 1 1 20 9077 1 1 13 SER O O 4.784 -6.354 6.779 1.00 . A A . 13 SER O 1 1 20 9078 1 1 13 SER OG O 2.992 -8.258 8.294 1.00 . A A . 13 SER OG 1 1 20 9079 1 1 14 THR C C 4.457 -3.483 5.490 1.00 . A A . 14 THR C 1 1 20 9080 1 1 14 THR CA C 4.932 -4.677 4.644 1.00 . A A . 14 THR CA 1 1 20 9081 1 1 14 THR CB C 4.915 -4.331 3.147 1.00 . A A . 14 THR CB 1 1 20 9082 1 1 14 THR CG2 C 3.571 -3.701 2.767 1.00 . A A . 14 THR CG2 1 1 20 9083 1 1 14 THR H H 3.351 -6.036 4.070 1.00 . A A . 14 THR H 1 1 20 9084 1 1 14 THR HA H 5.927 -4.970 4.940 1.00 . A A . 14 THR HA 1 1 20 9085 1 1 14 THR HB H 5.060 -5.232 2.569 1.00 . A A . 14 THR HB 1 1 20 9086 1 1 14 THR HG1 H 6.491 -3.779 2.145 1.00 . A A . 14 THR HG1 1 1 20 9087 1 1 14 THR HG21 H 3.201 -4.162 1.865 1.00 . A A . 14 THR HG21 1 1 20 9088 1 1 14 THR HG22 H 3.704 -2.642 2.603 1.00 . A A . 14 THR HG22 1 1 20 9089 1 1 14 THR HG23 H 2.861 -3.854 3.567 1.00 . A A . 14 THR HG23 1 1 20 9090 1 1 14 THR N N 3.988 -5.834 4.788 1.00 . A A . 14 THR N 1 1 20 9091 1 1 14 THR O O 3.481 -3.571 6.214 1.00 . A A . 14 THR O 1 1 20 9092 1 1 14 THR OG1 O 5.966 -3.416 2.862 1.00 . A A . 14 THR OG1 1 1 20 9093 1 1 15 PHE C C 4.735 0.089 5.328 1.00 . A A . 15 PHE C 1 1 20 9094 1 1 15 PHE CA C 4.741 -1.171 6.203 1.00 . A A . 15 PHE CA 1 1 20 9095 1 1 15 PHE CB C 5.797 -1.057 7.305 1.00 . A A . 15 PHE CB 1 1 20 9096 1 1 15 PHE CD1 C 4.075 -1.256 9.140 1.00 . A A . 15 PHE CD1 1 1 20 9097 1 1 15 PHE CD2 C 5.995 -2.738 9.176 1.00 . A A . 15 PHE CD2 1 1 20 9098 1 1 15 PHE CE1 C 3.593 -1.851 10.312 1.00 . A A . 15 PHE CE1 1 1 20 9099 1 1 15 PHE CE2 C 5.513 -3.333 10.348 1.00 . A A . 15 PHE CE2 1 1 20 9100 1 1 15 PHE CG C 5.277 -1.699 8.571 1.00 . A A . 15 PHE CG 1 1 20 9101 1 1 15 PHE CZ C 4.312 -2.890 10.915 1.00 . A A . 15 PHE CZ 1 1 20 9102 1 1 15 PHE H H 5.929 -2.322 4.818 1.00 . A A . 15 PHE H 1 1 20 9103 1 1 15 PHE HA H 3.768 -1.324 6.643 1.00 . A A . 15 PHE HA 1 1 20 9104 1 1 15 PHE HB2 H 6.700 -1.561 6.991 1.00 . A A . 15 PHE HB2 1 1 20 9105 1 1 15 PHE HB3 H 6.013 -0.017 7.493 1.00 . A A . 15 PHE HB3 1 1 20 9106 1 1 15 PHE HD1 H 3.521 -0.455 8.674 1.00 . A A . 15 PHE HD1 1 1 20 9107 1 1 15 PHE HD2 H 6.921 -3.079 8.737 1.00 . A A . 15 PHE HD2 1 1 20 9108 1 1 15 PHE HE1 H 2.668 -1.510 10.749 1.00 . A A . 15 PHE HE1 1 1 20 9109 1 1 15 PHE HE2 H 6.067 -4.134 10.814 1.00 . A A . 15 PHE HE2 1 1 20 9110 1 1 15 PHE HZ H 3.940 -3.349 11.819 1.00 . A A . 15 PHE HZ 1 1 20 9111 1 1 15 PHE N N 5.144 -2.369 5.405 1.00 . A A . 15 PHE N 1 1 20 9112 1 1 15 PHE O O 5.517 0.220 4.403 1.00 . A A . 15 PHE O 1 1 20 9113 1 1 16 CYS C C 3.799 3.496 5.758 1.00 . A A . 16 CYS C 1 1 20 9114 1 1 16 CYS CA C 3.781 2.278 4.819 1.00 . A A . 16 CYS CA 1 1 20 9115 1 1 16 CYS CB C 2.452 2.179 4.063 1.00 . A A . 16 CYS CB 1 1 20 9116 1 1 16 CYS H H 3.241 0.882 6.373 1.00 . A A . 16 CYS H 1 1 20 9117 1 1 16 CYS HA H 4.601 2.334 4.120 1.00 . A A . 16 CYS HA 1 1 20 9118 1 1 16 CYS HB2 H 1.645 2.049 4.768 1.00 . A A . 16 CYS HB2 1 1 20 9119 1 1 16 CYS HB3 H 2.291 3.083 3.493 1.00 . A A . 16 CYS HB3 1 1 20 9120 1 1 16 CYS N N 3.855 1.016 5.620 1.00 . A A . 16 CYS N 1 1 20 9121 1 1 16 CYS O O 4.184 3.390 6.907 1.00 . A A . 16 CYS O 1 1 20 9122 1 1 16 CYS SG S 2.507 0.760 2.938 1.00 . A A . 16 CYS SG 1 1 20 9123 1 1 17 CYS C C 2.220 5.829 7.140 1.00 . A A . 17 CYS C 1 1 20 9124 1 1 17 CYS CA C 3.401 5.864 6.161 1.00 . A A . 17 CYS CA 1 1 20 9125 1 1 17 CYS CB C 3.294 7.062 5.211 1.00 . A A . 17 CYS CB 1 1 20 9126 1 1 17 CYS H H 3.089 4.719 4.353 1.00 . A A . 17 CYS H 1 1 20 9127 1 1 17 CYS HA H 4.326 5.917 6.708 1.00 . A A . 17 CYS HA 1 1 20 9128 1 1 17 CYS HB2 H 3.218 6.710 4.194 1.00 . A A . 17 CYS HB2 1 1 20 9129 1 1 17 CYS HB3 H 2.417 7.641 5.458 1.00 . A A . 17 CYS HB3 1 1 20 9130 1 1 17 CYS N N 3.393 4.650 5.283 1.00 . A A . 17 CYS N 1 1 20 9131 1 1 17 CYS O O 2.385 5.531 8.307 1.00 . A A . 17 CYS O 1 1 20 9132 1 1 17 CYS SG S 4.767 8.104 5.377 1.00 . A A . 17 CYS SG 1 1 20 9133 1 1 18 SER C C -1.450 5.976 6.768 1.00 . A A . 18 SER C 1 1 20 9134 1 1 18 SER CA C -0.157 6.126 7.581 1.00 . A A . 18 SER CA 1 1 20 9135 1 1 18 SER CB C -0.126 7.483 8.291 1.00 . A A . 18 SER CB 1 1 20 9136 1 1 18 SER H H 0.928 6.375 5.736 1.00 . A A . 18 SER H 1 1 20 9137 1 1 18 SER HA H -0.072 5.332 8.305 1.00 . A A . 18 SER HA 1 1 20 9138 1 1 18 SER HB2 H -1.003 7.587 8.907 1.00 . A A . 18 SER HB2 1 1 20 9139 1 1 18 SER HB3 H 0.757 7.541 8.913 1.00 . A A . 18 SER HB3 1 1 20 9140 1 1 18 SER HG H -0.958 8.973 7.354 1.00 . A A . 18 SER HG 1 1 20 9141 1 1 18 SER N N 1.034 6.135 6.677 1.00 . A A . 18 SER N 1 1 20 9142 1 1 18 SER O O -1.732 6.761 5.882 1.00 . A A . 18 SER O 1 1 20 9143 1 1 18 SER OG O -0.109 8.526 7.324 1.00 . A A . 18 SER OG 1 1 20 9144 1 1 19 GLY C C -3.240 4.255 4.912 1.00 . A A . 19 GLY C 1 1 20 9145 1 1 19 GLY CA C -3.519 4.763 6.331 1.00 . A A . 19 GLY CA 1 1 20 9146 1 1 19 GLY H H -1.987 4.358 7.793 1.00 . A A . 19 GLY H 1 1 20 9147 1 1 19 GLY HA2 H -4.121 4.038 6.858 1.00 . A A . 19 GLY HA2 1 1 20 9148 1 1 19 GLY HA3 H -4.055 5.699 6.273 1.00 . A A . 19 GLY HA3 1 1 20 9149 1 1 19 GLY N N -2.237 4.973 7.071 1.00 . A A . 19 GLY N 1 1 20 9150 1 1 19 GLY O O -3.985 4.537 3.994 1.00 . A A . 19 GLY O 1 1 20 9151 1 1 20 TYR C C -1.721 1.456 3.401 1.00 . A A . 20 TYR C 1 1 20 9152 1 1 20 TYR CA C -1.861 2.983 3.359 1.00 . A A . 20 TYR CA 1 1 20 9153 1 1 20 TYR CB C -0.526 3.629 2.969 1.00 . A A . 20 TYR CB 1 1 20 9154 1 1 20 TYR CD1 C -1.792 5.699 2.243 1.00 . A A . 20 TYR CD1 1 1 20 9155 1 1 20 TYR CD2 C 0.328 5.963 3.384 1.00 . A A . 20 TYR CD2 1 1 20 9156 1 1 20 TYR CE1 C -1.914 7.090 2.147 1.00 . A A . 20 TYR CE1 1 1 20 9157 1 1 20 TYR CE2 C 0.206 7.354 3.289 1.00 . A A . 20 TYR CE2 1 1 20 9158 1 1 20 TYR CG C -0.670 5.133 2.862 1.00 . A A . 20 TYR CG 1 1 20 9159 1 1 20 TYR CZ C -0.914 7.918 2.670 1.00 . A A . 20 TYR CZ 1 1 20 9160 1 1 20 TYR H H -1.588 3.291 5.477 1.00 . A A . 20 TYR H 1 1 20 9161 1 1 20 TYR HA H -2.629 3.272 2.658 1.00 . A A . 20 TYR HA 1 1 20 9162 1 1 20 TYR HB2 H 0.215 3.394 3.719 1.00 . A A . 20 TYR HB2 1 1 20 9163 1 1 20 TYR HB3 H -0.204 3.234 2.016 1.00 . A A . 20 TYR HB3 1 1 20 9164 1 1 20 TYR HD1 H -2.564 5.061 1.840 1.00 . A A . 20 TYR HD1 1 1 20 9165 1 1 20 TYR HD2 H 1.193 5.529 3.862 1.00 . A A . 20 TYR HD2 1 1 20 9166 1 1 20 TYR HE1 H -2.780 7.525 1.671 1.00 . A A . 20 TYR HE1 1 1 20 9167 1 1 20 TYR HE2 H 0.977 7.992 3.693 1.00 . A A . 20 TYR HE2 1 1 20 9168 1 1 20 TYR HH H -0.633 9.566 1.748 1.00 . A A . 20 TYR HH 1 1 20 9169 1 1 20 TYR N N -2.177 3.508 4.722 1.00 . A A . 20 TYR N 1 1 20 9170 1 1 20 TYR O O -1.038 0.913 4.249 1.00 . A A . 20 TYR O 1 1 20 9171 1 1 20 TYR OH O -1.034 9.290 2.576 1.00 . A A . 20 TYR OH 1 1 20 9172 1 1 21 ASN C C -1.501 -1.190 1.221 1.00 . A A . 21 ASN C 1 1 20 9173 1 1 21 ASN CA C -2.261 -0.731 2.467 1.00 . A A . 21 ASN CA 1 1 20 9174 1 1 21 ASN CB C -3.708 -1.228 2.429 1.00 . A A . 21 ASN CB 1 1 20 9175 1 1 21 ASN CG C -3.808 -2.578 3.143 1.00 . A A . 21 ASN CG 1 1 20 9176 1 1 21 ASN H H -2.900 1.226 1.814 1.00 . A A . 21 ASN H 1 1 20 9177 1 1 21 ASN HA H -1.769 -1.088 3.357 1.00 . A A . 21 ASN HA 1 1 20 9178 1 1 21 ASN HB2 H -4.347 -0.511 2.923 1.00 . A A . 21 ASN HB2 1 1 20 9179 1 1 21 ASN HB3 H -4.022 -1.342 1.402 1.00 . A A . 21 ASN HB3 1 1 20 9180 1 1 21 ASN HD21 H -4.598 -1.809 4.796 1.00 . A A . 21 ASN HD21 1 1 20 9181 1 1 21 ASN HD22 H -4.367 -3.490 4.816 1.00 . A A . 21 ASN HD22 1 1 20 9182 1 1 21 ASN N N -2.360 0.764 2.489 1.00 . A A . 21 ASN N 1 1 20 9183 1 1 21 ASN ND2 N -4.298 -2.630 4.352 1.00 . A A . 21 ASN ND2 1 1 20 9184 1 1 21 ASN O O -1.395 -0.468 0.255 1.00 . A A . 21 ASN O 1 1 20 9185 1 1 21 ASN OD1 O -3.439 -3.597 2.594 1.00 . A A . 21 ASN OD1 1 1 20 9186 1 1 22 CYS C C -1.129 -3.594 -0.942 1.00 . A A . 22 CYS C 1 1 20 9187 1 1 22 CYS CA C -0.203 -2.876 0.048 1.00 . A A . 22 CYS CA 1 1 20 9188 1 1 22 CYS CB C 0.830 -3.849 0.620 1.00 . A A . 22 CYS CB 1 1 20 9189 1 1 22 CYS H H -1.062 -2.952 2.029 1.00 . A A . 22 CYS H 1 1 20 9190 1 1 22 CYS HA H 0.300 -2.057 -0.439 1.00 . A A . 22 CYS HA 1 1 20 9191 1 1 22 CYS HB2 H 1.562 -3.298 1.191 1.00 . A A . 22 CYS HB2 1 1 20 9192 1 1 22 CYS HB3 H 0.335 -4.561 1.265 1.00 . A A . 22 CYS HB3 1 1 20 9193 1 1 22 CYS N N -0.967 -2.383 1.236 1.00 . A A . 22 CYS N 1 1 20 9194 1 1 22 CYS O O -1.981 -4.375 -0.560 1.00 . A A . 22 CYS O 1 1 20 9195 1 1 22 CYS SG S 1.654 -4.728 -0.731 1.00 . A A . 22 CYS SG 1 1 20 9196 1 1 23 SER C C -0.999 -5.130 -3.925 1.00 . A A . 23 SER C 1 1 20 9197 1 1 23 SER CA C -1.799 -4.008 -3.250 1.00 . A A . 23 SER CA 1 1 20 9198 1 1 23 SER CB C -2.145 -2.914 -4.264 1.00 . A A . 23 SER CB 1 1 20 9199 1 1 23 SER H H -0.249 -2.714 -2.495 1.00 . A A . 23 SER H 1 1 20 9200 1 1 23 SER HA H -2.699 -4.398 -2.804 1.00 . A A . 23 SER HA 1 1 20 9201 1 1 23 SER HB2 H -1.351 -2.188 -4.303 1.00 . A A . 23 SER HB2 1 1 20 9202 1 1 23 SER HB3 H -2.273 -3.359 -5.243 1.00 . A A . 23 SER HB3 1 1 20 9203 1 1 23 SER HG H -3.977 -2.341 -4.587 1.00 . A A . 23 SER HG 1 1 20 9204 1 1 23 SER N N -0.951 -3.339 -2.216 1.00 . A A . 23 SER N 1 1 20 9205 1 1 23 SER O O 0.109 -4.910 -4.374 1.00 . A A . 23 SER O 1 1 20 9206 1 1 23 SER OG O -3.348 -2.270 -3.865 1.00 . A A . 23 SER OG 1 1 20 9207 1 1 24 PRO C C -0.875 -7.339 -6.128 1.00 . A A . 24 PRO C 1 1 20 9208 1 1 24 PRO CA C -0.914 -7.473 -4.598 1.00 . A A . 24 PRO CA 1 1 20 9209 1 1 24 PRO CB C -1.786 -8.654 -4.177 1.00 . A A . 24 PRO CB 1 1 20 9210 1 1 24 PRO CD C -2.919 -6.647 -3.454 1.00 . A A . 24 PRO CD 1 1 20 9211 1 1 24 PRO CG C -3.135 -8.067 -3.911 1.00 . A A . 24 PRO CG 1 1 20 9212 1 1 24 PRO HA H 0.080 -7.592 -4.203 1.00 . A A . 24 PRO HA 1 1 20 9213 1 1 24 PRO HB2 H -1.841 -9.381 -4.976 1.00 . A A . 24 PRO HB2 1 1 20 9214 1 1 24 PRO HB3 H -1.397 -9.109 -3.280 1.00 . A A . 24 PRO HB3 1 1 20 9215 1 1 24 PRO HD2 H -3.673 -5.997 -3.876 1.00 . A A . 24 PRO HD2 1 1 20 9216 1 1 24 PRO HD3 H -2.924 -6.590 -2.377 1.00 . A A . 24 PRO HD3 1 1 20 9217 1 1 24 PRO HG2 H -3.727 -8.079 -4.815 1.00 . A A . 24 PRO HG2 1 1 20 9218 1 1 24 PRO HG3 H -3.634 -8.626 -3.134 1.00 . A A . 24 PRO HG3 1 1 20 9219 1 1 24 PRO N N -1.588 -6.302 -3.972 1.00 . A A . 24 PRO N 1 1 20 9220 1 1 24 PRO O O 0.000 -7.879 -6.780 1.00 . A A . 24 PRO O 1 1 20 9221 1 1 25 THR C C -0.910 -5.321 -8.623 1.00 . A A . 25 THR C 1 1 20 9222 1 1 25 THR CA C -1.835 -6.467 -8.191 1.00 . A A . 25 THR CA 1 1 20 9223 1 1 25 THR CB C -3.294 -6.144 -8.538 1.00 . A A . 25 THR CB 1 1 20 9224 1 1 25 THR CG2 C -3.454 -6.028 -10.055 1.00 . A A . 25 THR CG2 1 1 20 9225 1 1 25 THR H H -2.509 -6.207 -6.159 1.00 . A A . 25 THR H 1 1 20 9226 1 1 25 THR HA H -1.539 -7.383 -8.670 1.00 . A A . 25 THR HA 1 1 20 9227 1 1 25 THR HB H -3.575 -5.209 -8.078 1.00 . A A . 25 THR HB 1 1 20 9228 1 1 25 THR HG1 H -4.563 -6.872 -7.253 1.00 . A A . 25 THR HG1 1 1 20 9229 1 1 25 THR HG21 H -4.487 -5.822 -10.293 1.00 . A A . 25 THR HG21 1 1 20 9230 1 1 25 THR HG22 H -3.156 -6.956 -10.521 1.00 . A A . 25 THR HG22 1 1 20 9231 1 1 25 THR HG23 H -2.832 -5.225 -10.423 1.00 . A A . 25 THR HG23 1 1 20 9232 1 1 25 THR N N -1.814 -6.630 -6.705 1.00 . A A . 25 THR N 1 1 20 9233 1 1 25 THR O O -0.281 -5.382 -9.663 1.00 . A A . 25 THR O 1 1 20 9234 1 1 25 THR OG1 O -4.135 -7.182 -8.054 1.00 . A A . 25 THR OG1 1 1 20 9235 1 1 26 TRP C C 1.438 -3.253 -7.551 1.00 . A A . 26 TRP C 1 1 20 9236 1 1 26 TRP CA C 0.052 -3.121 -8.204 1.00 . A A . 26 TRP CA 1 1 20 9237 1 1 26 TRP CB C -0.672 -1.878 -7.675 1.00 . A A . 26 TRP CB 1 1 20 9238 1 1 26 TRP CD1 C -2.534 -2.469 -9.304 1.00 . A A . 26 TRP CD1 1 1 20 9239 1 1 26 TRP CD2 C -3.204 -1.056 -7.687 1.00 . A A . 26 TRP CD2 1 1 20 9240 1 1 26 TRP CE2 C -4.330 -1.297 -8.509 1.00 . A A . 26 TRP CE2 1 1 20 9241 1 1 26 TRP CE3 C -3.358 -0.193 -6.590 1.00 . A A . 26 TRP CE3 1 1 20 9242 1 1 26 TRP CG C -2.075 -1.813 -8.209 1.00 . A A . 26 TRP CG 1 1 20 9243 1 1 26 TRP CH2 C -5.700 0.155 -7.153 1.00 . A A . 26 TRP CH2 1 1 20 9244 1 1 26 TRP CZ2 C -5.565 -0.702 -8.249 1.00 . A A . 26 TRP CZ2 1 1 20 9245 1 1 26 TRP CZ3 C -4.599 0.408 -6.325 1.00 . A A . 26 TRP CZ3 1 1 20 9246 1 1 26 TRP H H -1.348 -4.252 -7.007 1.00 . A A . 26 TRP H 1 1 20 9247 1 1 26 TRP HA H 0.151 -3.054 -9.276 1.00 . A A . 26 TRP HA 1 1 20 9248 1 1 26 TRP HB2 H -0.704 -1.914 -6.596 1.00 . A A . 26 TRP HB2 1 1 20 9249 1 1 26 TRP HB3 H -0.132 -0.998 -7.985 1.00 . A A . 26 TRP HB3 1 1 20 9250 1 1 26 TRP HD1 H -1.953 -3.125 -9.933 1.00 . A A . 26 TRP HD1 1 1 20 9251 1 1 26 TRP HE1 H -4.439 -2.514 -10.194 1.00 . A A . 26 TRP HE1 1 1 20 9252 1 1 26 TRP HE3 H -2.516 0.009 -5.945 1.00 . A A . 26 TRP HE3 1 1 20 9253 1 1 26 TRP HH2 H -6.652 0.620 -6.945 1.00 . A A . 26 TRP HH2 1 1 20 9254 1 1 26 TRP HZ2 H -6.410 -0.901 -8.890 1.00 . A A . 26 TRP HZ2 1 1 20 9255 1 1 26 TRP HZ3 H -4.705 1.071 -5.477 1.00 . A A . 26 TRP HZ3 1 1 20 9256 1 1 26 TRP N N -0.827 -4.278 -7.837 1.00 . A A . 26 TRP N 1 1 20 9257 1 1 26 TRP NE1 N -3.872 -2.166 -9.477 1.00 . A A . 26 TRP NE1 1 1 20 9258 1 1 26 TRP O O 2.363 -2.548 -7.910 1.00 . A A . 26 TRP O 1 1 20 9259 1 1 27 LYS C C 3.334 -3.117 -5.094 1.00 . A A . 27 LYS C 1 1 20 9260 1 1 27 LYS CA C 2.901 -4.355 -5.906 1.00 . A A . 27 LYS CA 1 1 20 9261 1 1 27 LYS CB C 3.917 -4.659 -7.018 1.00 . A A . 27 LYS CB 1 1 20 9262 1 1 27 LYS CD C 5.117 -6.452 -5.744 1.00 . A A . 27 LYS CD 1 1 20 9263 1 1 27 LYS CE C 4.693 -7.801 -5.153 1.00 . A A . 27 LYS CE 1 1 20 9264 1 1 27 LYS CG C 4.277 -6.148 -6.989 1.00 . A A . 27 LYS CG 1 1 20 9265 1 1 27 LYS H H 0.819 -4.700 -6.332 1.00 . A A . 27 LYS H 1 1 20 9266 1 1 27 LYS HA H 2.832 -5.207 -5.248 1.00 . A A . 27 LYS HA 1 1 20 9267 1 1 27 LYS HB2 H 3.488 -4.414 -7.978 1.00 . A A . 27 LYS HB2 1 1 20 9268 1 1 27 LYS HB3 H 4.810 -4.073 -6.862 1.00 . A A . 27 LYS HB3 1 1 20 9269 1 1 27 LYS HD2 H 6.163 -6.490 -6.016 1.00 . A A . 27 LYS HD2 1 1 20 9270 1 1 27 LYS HD3 H 4.965 -5.676 -5.008 1.00 . A A . 27 LYS HD3 1 1 20 9271 1 1 27 LYS HE2 H 4.855 -7.808 -4.085 1.00 . A A . 27 LYS HE2 1 1 20 9272 1 1 27 LYS HE3 H 3.656 -8.001 -5.379 1.00 . A A . 27 LYS HE3 1 1 20 9273 1 1 27 LYS HG2 H 3.370 -6.736 -6.966 1.00 . A A . 27 LYS HG2 1 1 20 9274 1 1 27 LYS HG3 H 4.844 -6.398 -7.873 1.00 . A A . 27 LYS HG3 1 1 20 9275 1 1 27 LYS HZ1 H 5.433 -8.760 -6.849 1.00 . A A . 27 LYS HZ1 1 1 20 9276 1 1 27 LYS HZ2 H 5.310 -9.763 -5.484 1.00 . A A . 27 LYS HZ2 1 1 20 9277 1 1 27 LYS HZ3 H 6.561 -8.617 -5.590 1.00 . A A . 27 LYS HZ3 1 1 20 9278 1 1 27 LYS N N 1.585 -4.149 -6.597 1.00 . A A . 27 LYS N 1 1 20 9279 1 1 27 LYS NZ N 5.565 -8.811 -5.820 1.00 . A A . 27 LYS NZ 1 1 20 9280 1 1 27 LYS O O 4.460 -3.049 -4.635 1.00 . A A . 27 LYS O 1 1 20 9281 1 1 28 TRP C C 1.768 -0.592 -3.068 1.00 . A A . 28 TRP C 1 1 20 9282 1 1 28 TRP CA C 2.863 -0.957 -4.079 1.00 . A A . 28 TRP CA 1 1 20 9283 1 1 28 TRP CB C 3.124 0.187 -5.080 1.00 . A A . 28 TRP CB 1 1 20 9284 1 1 28 TRP CD1 C 0.710 0.988 -5.208 1.00 . A A . 28 TRP CD1 1 1 20 9285 1 1 28 TRP CD2 C 1.658 0.745 -7.231 1.00 . A A . 28 TRP CD2 1 1 20 9286 1 1 28 TRP CE2 C 0.336 1.192 -7.454 1.00 . A A . 28 TRP CE2 1 1 20 9287 1 1 28 TRP CE3 C 2.476 0.514 -8.353 1.00 . A A . 28 TRP CE3 1 1 20 9288 1 1 28 TRP CG C 1.872 0.613 -5.796 1.00 . A A . 28 TRP CG 1 1 20 9289 1 1 28 TRP CH2 C 0.667 1.172 -9.843 1.00 . A A . 28 TRP CH2 1 1 20 9290 1 1 28 TRP CZ2 C -0.159 1.405 -8.741 1.00 . A A . 28 TRP CZ2 1 1 20 9291 1 1 28 TRP CZ3 C 1.982 0.727 -9.650 1.00 . A A . 28 TRP CZ3 1 1 20 9292 1 1 28 TRP H H 1.553 -2.221 -5.244 1.00 . A A . 28 TRP H 1 1 20 9293 1 1 28 TRP HA H 3.776 -1.176 -3.547 1.00 . A A . 28 TRP HA 1 1 20 9294 1 1 28 TRP HB2 H 3.525 1.034 -4.546 1.00 . A A . 28 TRP HB2 1 1 20 9295 1 1 28 TRP HB3 H 3.853 -0.144 -5.806 1.00 . A A . 28 TRP HB3 1 1 20 9296 1 1 28 TRP HD1 H 0.522 1.013 -4.147 1.00 . A A . 28 TRP HD1 1 1 20 9297 1 1 28 TRP HE1 H -1.120 1.625 -6.031 1.00 . A A . 28 TRP HE1 1 1 20 9298 1 1 28 TRP HE3 H 3.491 0.173 -8.214 1.00 . A A . 28 TRP HE3 1 1 20 9299 1 1 28 TRP HH2 H 0.293 1.334 -10.843 1.00 . A A . 28 TRP HH2 1 1 20 9300 1 1 28 TRP HZ2 H -1.173 1.748 -8.884 1.00 . A A . 28 TRP HZ2 1 1 20 9301 1 1 28 TRP HZ3 H 2.620 0.548 -10.503 1.00 . A A . 28 TRP HZ3 1 1 20 9302 1 1 28 TRP N N 2.463 -2.152 -4.888 1.00 . A A . 28 TRP N 1 1 20 9303 1 1 28 TRP NE1 N -0.201 1.325 -6.191 1.00 . A A . 28 TRP NE1 1 1 20 9304 1 1 28 TRP O O 0.653 -1.074 -3.141 1.00 . A A . 28 TRP O 1 1 20 9305 1 1 29 CYS C C 0.074 1.642 -1.677 1.00 . A A . 29 CYS C 1 1 20 9306 1 1 29 CYS CA C 1.084 0.653 -1.086 1.00 . A A . 29 CYS CA 1 1 20 9307 1 1 29 CYS CB C 1.896 1.314 0.030 1.00 . A A . 29 CYS CB 1 1 20 9308 1 1 29 CYS H H 2.999 0.619 -2.079 1.00 . A A . 29 CYS H 1 1 20 9309 1 1 29 CYS HA H 0.577 -0.218 -0.702 1.00 . A A . 29 CYS HA 1 1 20 9310 1 1 29 CYS HB2 H 2.870 0.848 0.092 1.00 . A A . 29 CYS HB2 1 1 20 9311 1 1 29 CYS HB3 H 2.014 2.366 -0.185 1.00 . A A . 29 CYS HB3 1 1 20 9312 1 1 29 CYS N N 2.089 0.252 -2.117 1.00 . A A . 29 CYS N 1 1 20 9313 1 1 29 CYS O O 0.415 2.477 -2.484 1.00 . A A . 29 CYS O 1 1 20 9314 1 1 29 CYS SG S 1.033 1.115 1.607 1.00 . A A . 29 CYS SG 1 1 20 9315 1 1 30 VAL C C -2.914 3.185 -0.635 1.00 . A A . 30 VAL C 1 1 20 9316 1 1 30 VAL CA C -2.219 2.471 -1.798 1.00 . A A . 30 VAL CA 1 1 20 9317 1 1 30 VAL CB C -3.210 1.574 -2.558 1.00 . A A . 30 VAL CB 1 1 20 9318 1 1 30 VAL CG1 C -2.486 0.868 -3.705 1.00 . A A . 30 VAL CG1 1 1 20 9319 1 1 30 VAL CG2 C -3.803 0.521 -1.612 1.00 . A A . 30 VAL CG2 1 1 20 9320 1 1 30 VAL H H -1.412 0.859 -0.618 1.00 . A A . 30 VAL H 1 1 20 9321 1 1 30 VAL HA H -1.785 3.192 -2.474 1.00 . A A . 30 VAL HA 1 1 20 9322 1 1 30 VAL HB H -4.005 2.184 -2.962 1.00 . A A . 30 VAL HB 1 1 20 9323 1 1 30 VAL HG11 H -3.114 0.083 -4.097 1.00 . A A . 30 VAL HG11 1 1 20 9324 1 1 30 VAL HG12 H -1.561 0.443 -3.343 1.00 . A A . 30 VAL HG12 1 1 20 9325 1 1 30 VAL HG13 H -2.272 1.582 -4.487 1.00 . A A . 30 VAL HG13 1 1 20 9326 1 1 30 VAL HG21 H -3.149 -0.337 -1.572 1.00 . A A . 30 VAL HG21 1 1 20 9327 1 1 30 VAL HG22 H -4.774 0.217 -1.976 1.00 . A A . 30 VAL HG22 1 1 20 9328 1 1 30 VAL HG23 H -3.907 0.941 -0.623 1.00 . A A . 30 VAL HG23 1 1 20 9329 1 1 30 VAL N N -1.167 1.546 -1.273 1.00 . A A . 30 VAL N 1 1 20 9330 1 1 30 VAL O O -2.471 3.118 0.493 1.00 . A A . 30 VAL O 1 1 20 9331 1 1 31 TYR C C -5.833 3.694 0.768 1.00 . A A . 31 TYR C 1 1 20 9332 1 1 31 TYR CA C -4.723 4.583 0.193 1.00 . A A . 31 TYR CA 1 1 20 9333 1 1 31 TYR CB C -5.310 5.835 -0.469 1.00 . A A . 31 TYR CB 1 1 20 9334 1 1 31 TYR CD1 C -5.369 6.975 1.784 1.00 . A A . 31 TYR CD1 1 1 20 9335 1 1 31 TYR CD2 C -7.290 7.182 0.319 1.00 . A A . 31 TYR CD2 1 1 20 9336 1 1 31 TYR CE1 C -6.016 7.761 2.743 1.00 . A A . 31 TYR CE1 1 1 20 9337 1 1 31 TYR CE2 C -7.938 7.968 1.279 1.00 . A A . 31 TYR CE2 1 1 20 9338 1 1 31 TYR CG C -6.007 6.685 0.570 1.00 . A A . 31 TYR CG 1 1 20 9339 1 1 31 TYR CZ C -7.300 8.257 2.492 1.00 . A A . 31 TYR CZ 1 1 20 9340 1 1 31 TYR H H -4.339 3.905 -1.821 1.00 . A A . 31 TYR H 1 1 20 9341 1 1 31 TYR HA H -4.033 4.869 0.970 1.00 . A A . 31 TYR HA 1 1 20 9342 1 1 31 TYR HB2 H -4.514 6.406 -0.924 1.00 . A A . 31 TYR HB2 1 1 20 9343 1 1 31 TYR HB3 H -6.020 5.542 -1.228 1.00 . A A . 31 TYR HB3 1 1 20 9344 1 1 31 TYR HD1 H -4.380 6.592 1.979 1.00 . A A . 31 TYR HD1 1 1 20 9345 1 1 31 TYR HD2 H -7.782 6.960 -0.616 1.00 . A A . 31 TYR HD2 1 1 20 9346 1 1 31 TYR HE1 H -5.523 7.984 3.678 1.00 . A A . 31 TYR HE1 1 1 20 9347 1 1 31 TYR HE2 H -8.928 8.352 1.085 1.00 . A A . 31 TYR HE2 1 1 20 9348 1 1 31 TYR HH H -8.332 8.441 4.087 1.00 . A A . 31 TYR HH 1 1 20 9349 1 1 31 TYR N N -3.999 3.867 -0.902 1.00 . A A . 31 TYR N 1 1 20 9350 1 1 31 TYR O O -6.594 3.085 0.037 1.00 . A A . 31 TYR O 1 1 20 9351 1 1 31 TYR OH O -7.938 9.030 3.439 1.00 . A A . 31 TYR OH 1 1 20 9352 1 1 32 ALA C C -8.187 3.631 3.121 1.00 . A A . 32 ALA C 1 1 20 9353 1 1 32 ALA CA C -6.985 2.770 2.709 1.00 . A A . 32 ALA CA 1 1 20 9354 1 1 32 ALA CB C -6.316 2.155 3.941 1.00 . A A . 32 ALA CB 1 1 20 9355 1 1 32 ALA H H -5.301 4.121 2.637 1.00 . A A . 32 ALA H 1 1 20 9356 1 1 32 ALA HA H -7.296 1.990 2.033 1.00 . A A . 32 ALA HA 1 1 20 9357 1 1 32 ALA HB1 H -5.251 2.081 3.776 1.00 . A A . 32 ALA HB1 1 1 20 9358 1 1 32 ALA HB2 H -6.721 1.169 4.115 1.00 . A A . 32 ALA HB2 1 1 20 9359 1 1 32 ALA HB3 H -6.505 2.779 4.803 1.00 . A A . 32 ALA HB3 1 1 20 9360 1 1 32 ALA N N -5.927 3.619 2.073 1.00 . A A . 32 ALA N 1 1 20 9361 1 1 32 ALA O O -8.194 4.835 2.936 1.00 . A A . 32 ALA O 1 1 20 9362 1 1 33 ARG C C -11.254 2.969 5.102 1.00 . A A . 33 ARG C 1 1 20 9363 1 1 33 ARG CA C -10.410 3.791 4.110 1.00 . A A . 33 ARG CA 1 1 20 9364 1 1 33 ARG CB C -11.189 4.079 2.819 1.00 . A A . 33 ARG CB 1 1 20 9365 1 1 33 ARG CD C -12.559 6.142 2.461 1.00 . A A . 33 ARG CD 1 1 20 9366 1 1 33 ARG CG C -11.136 5.577 2.507 1.00 . A A . 33 ARG CG 1 1 20 9367 1 1 33 ARG CZ C -13.698 6.353 4.592 1.00 . A A . 33 ARG CZ 1 1 20 9368 1 1 33 ARG H H -9.168 2.049 3.820 1.00 . A A . 33 ARG H 1 1 20 9369 1 1 33 ARG HA H -10.108 4.720 4.567 1.00 . A A . 33 ARG HA 1 1 20 9370 1 1 33 ARG HB2 H -10.748 3.527 2.002 1.00 . A A . 33 ARG HB2 1 1 20 9371 1 1 33 ARG HB3 H -12.217 3.776 2.945 1.00 . A A . 33 ARG HB3 1 1 20 9372 1 1 33 ARG HD2 H -12.647 6.871 1.667 1.00 . A A . 33 ARG HD2 1 1 20 9373 1 1 33 ARG HD3 H -13.275 5.347 2.323 1.00 . A A . 33 ARG HD3 1 1 20 9374 1 1 33 ARG HE H -12.197 7.542 4.059 1.00 . A A . 33 ARG HE 1 1 20 9375 1 1 33 ARG HG2 H -10.570 6.087 3.274 1.00 . A A . 33 ARG HG2 1 1 20 9376 1 1 33 ARG HG3 H -10.661 5.729 1.550 1.00 . A A . 33 ARG HG3 1 1 20 9377 1 1 33 ARG HH11 H -15.199 7.153 3.529 1.00 . A A . 33 ARG HH11 1 1 20 9378 1 1 33 ARG HH12 H -15.671 6.284 4.951 1.00 . A A . 33 ARG HH12 1 1 20 9379 1 1 33 ARG HH21 H -12.416 5.451 5.842 1.00 . A A . 33 ARG HH21 1 1 20 9380 1 1 33 ARG HH22 H -14.092 5.318 6.264 1.00 . A A . 33 ARG HH22 1 1 20 9381 1 1 33 ARG N N -9.202 3.018 3.680 1.00 . A A . 33 ARG N 1 1 20 9382 1 1 33 ARG NE N -12.764 6.789 3.788 1.00 . A A . 33 ARG NE 1 1 20 9383 1 1 33 ARG NH1 N -14.954 6.618 4.338 1.00 . A A . 33 ARG NH1 1 1 20 9384 1 1 33 ARG NH2 N -13.377 5.653 5.649 1.00 . A A . 33 ARG NH2 1 1 20 9385 1 1 33 ARG O O -11.418 3.374 6.237 1.00 . A A . 33 ARG O 1 1 20 9386 1 1 34 PRO C C -11.711 0.288 6.602 1.00 . A A . 34 PRO C 1 1 20 9387 1 1 34 PRO CA C -12.589 0.976 5.546 1.00 . A A . 34 PRO CA 1 1 20 9388 1 1 34 PRO CB C -13.206 -0.047 4.594 1.00 . A A . 34 PRO CB 1 1 20 9389 1 1 34 PRO CD C -11.631 1.254 3.309 1.00 . A A . 34 PRO CD 1 1 20 9390 1 1 34 PRO CG C -12.272 -0.104 3.429 1.00 . A A . 34 PRO CG 1 1 20 9391 1 1 34 PRO HA H -13.368 1.556 6.017 1.00 . A A . 34 PRO HA 1 1 20 9392 1 1 34 PRO HB2 H -13.272 -1.014 5.075 1.00 . A A . 34 PRO HB2 1 1 20 9393 1 1 34 PRO HB3 H -14.181 0.281 4.270 1.00 . A A . 34 PRO HB3 1 1 20 9394 1 1 34 PRO HD2 H -10.591 1.154 3.034 1.00 . A A . 34 PRO HD2 1 1 20 9395 1 1 34 PRO HD3 H -12.159 1.858 2.589 1.00 . A A . 34 PRO HD3 1 1 20 9396 1 1 34 PRO HG2 H -11.517 -0.859 3.600 1.00 . A A . 34 PRO HG2 1 1 20 9397 1 1 34 PRO HG3 H -12.821 -0.327 2.526 1.00 . A A . 34 PRO HG3 1 1 20 9398 1 1 34 PRO N N -11.765 1.836 4.655 1.00 . A A . 34 PRO N 1 1 20 9399 1 1 34 PRO O O -12.080 0.328 7.764 1.00 . A A . 34 PRO O 1 1 20 9400 1 1 34 PRO OXT O -10.685 -0.262 6.231 1.00 . A A . 34 PRO OXT 1 1 stop_ save_
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