NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
428093 | 2i1t | 7273 | cing | 4-filtered-FRED | STAR | entry | full | 339 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2i1t # This FRED archive file contains, for PDB entry <2i1t>: # # - 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_2i1t _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2i1t _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3905.47 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_3 A . 1 1 stop_ save_ save_Jingzhaotoxin_3 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Jingzhaotoxin 3" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code DGECGGFWWKCGRGKPPCCKGYACSKTWGWCAVEAP _Entity.Number_of_monomers 36 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 ASP . 1 1 2 GLY . 1 1 3 GLU . 1 1 4 CYS . 1 1 5 GLY . 1 1 6 GLY . 1 1 7 PHE . 1 1 8 TRP . 1 1 9 TRP . 1 1 10 LYS . 1 1 11 CYS . 1 1 12 GLY . 1 1 13 ARG . 1 1 14 GLY . 1 1 15 LYS . 1 1 16 PRO . 1 1 17 PRO . 1 1 18 CYS . 1 1 19 CYS . 1 1 20 LYS . 1 1 21 GLY . 1 1 22 TYR . 1 1 23 ALA . 1 1 24 CYS . 1 1 25 SER . 1 1 26 LYS . 1 1 27 THR . 1 1 28 TRP . 1 1 29 GLY . 1 1 30 TRP . 1 1 31 CYS . 1 1 32 ALA . 1 1 33 VAL . 1 1 34 GLU . 1 1 35 ALA . 1 1 36 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 ASP 1 1 1 1 GLY 2 2 1 1 GLU 3 3 1 1 CYS 4 4 1 1 GLY 5 5 1 1 GLY 6 6 1 1 PHE 7 7 1 1 TRP 8 8 1 1 TRP 9 9 1 1 LYS 10 10 1 1 CYS 11 11 1 1 GLY 12 12 1 1 ARG 13 13 1 1 GLY 14 14 1 1 LYS 15 15 1 1 PRO 16 16 1 1 PRO 17 17 1 1 CYS 18 18 1 1 CYS 19 19 1 1 LYS 20 20 1 1 GLY 21 21 1 1 TYR 22 22 1 1 ALA 23 23 1 1 CYS 24 24 1 1 SER 25 25 1 1 LYS 26 26 1 1 THR 27 27 1 1 TRP 28 28 1 1 GLY 29 29 1 1 TRP 30 30 1 1 CYS 31 31 1 1 ALA 32 32 1 1 VAL 33 33 1 1 GLU 34 34 1 1 ALA 35 35 1 1 PRO 36 36 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 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 GLY H . 2 . HN 1 1 1 1 2 1 1 2 GLY QA . 2 . HA# 1 1 2 1 1 1 1 1 ASP HA . 1 . HA 1 1 2 1 2 1 1 2 GLY H . 2 . HN 1 1 3 1 1 1 1 2 GLY QA . 2 . HA# 1 1 3 1 2 1 1 3 GLU H . 3 . HN 1 1 4 1 1 1 1 3 GLU H . 3 . HN 1 1 4 1 2 1 1 3 GLU QB . 3 . HB# 1 1 5 1 1 1 1 3 GLU H . 3 . HN 1 1 5 1 2 1 1 3 GLU QG . 3 . HG# 1 1 6 1 1 1 1 3 GLU H . 3 . HN 1 1 6 1 2 1 1 4 CYS H . 4 . HN 1 1 7 1 1 1 1 3 GLU HA . 3 . HA 1 1 7 1 2 1 1 3 GLU QG . 3 . HG# 1 1 8 1 1 1 1 3 GLU HA . 3 . HA 1 1 8 1 2 1 1 17 PRO QG . 17 . HG# 1 1 9 1 1 1 1 3 GLU QB . 3 . HB# 1 1 9 1 2 1 1 4 CYS H . 4 . HN 1 1 10 1 1 1 1 3 GLU HA . 3 . HA 1 1 10 1 2 1 1 4 CYS H . 4 . HN 1 1 11 1 1 1 1 3 GLU QG . 3 . HG# 1 1 11 1 2 1 1 4 CYS H . 4 . HN 1 1 12 1 1 1 1 4 CYS H . 4 . HN 1 1 12 1 2 1 1 4 CYS QB . 4 . HB# 1 1 13 1 1 1 1 4 CYS HA . 4 . HA 1 1 13 1 2 1 1 17 PRO QG . 17 . HG# 1 1 14 1 1 1 1 4 CYS HA . 4 . HA 1 1 14 1 2 1 1 17 PRO QB . 17 . HB# 1 1 15 1 1 1 1 4 CYS HA . 4 . HA 1 1 15 1 2 1 1 19 CYS HA . 19 . HA 1 1 16 1 1 1 1 4 CYS QB . 4 . HB# 1 1 16 1 2 1 1 19 CYS QB . 19 . HB# 1 1 17 1 1 1 1 5 GLY H . 5 . HN 1 1 17 1 2 1 1 6 GLY H . 6 . HN 1 1 18 1 1 1 1 5 GLY H . 5 . HN 1 1 18 1 2 1 1 18 CYS HA . 18 . HA 1 1 19 1 1 1 1 4 CYS HA . 4 . HA 1 1 19 1 2 1 1 5 GLY H . 5 . HN 1 1 20 1 1 1 1 5 GLY H . 5 . HN 1 1 20 1 2 1 1 19 CYS QB . 19 . HB# 1 1 21 1 1 1 1 5 GLY H . 5 . HN 1 1 21 1 2 1 1 9 TRP QB . 9 . HB# 1 1 22 1 1 1 1 4 CYS QB . 4 . HB# 1 1 22 1 2 1 1 5 GLY H . 5 . HN 1 1 23 1 1 1 1 4 CYS H . 4 . HN 1 1 23 1 2 1 1 5 GLY H . 5 . HN 1 1 24 1 1 1 1 5 GLY QA . 5 . HA# 1 1 24 1 2 1 1 9 TRP QB . 9 . HB# 1 1 25 1 1 1 1 5 GLY QA . 5 . HA# 1 1 25 1 2 1 1 6 GLY QA . 6 . HA# 1 1 26 1 1 1 1 5 GLY QA . 5 . HA# 1 1 26 1 2 1 1 6 GLY H . 6 . HN 1 1 27 1 1 1 1 6 GLY H . 6 . HN 1 1 27 1 2 1 1 9 TRP QB . 9 . HB# 1 1 28 1 1 1 1 6 GLY QA . 6 . HA# 1 1 28 1 2 1 1 9 TRP QB . 9 . HB# 1 1 29 1 1 1 1 7 PHE H . 7 . HN 1 1 29 1 2 1 1 7 PHE QB . 7 . HB# 1 1 30 1 1 1 1 6 GLY H . 6 . HN 1 1 30 1 2 1 1 7 PHE H . 7 . HN 1 1 31 1 1 1 1 7 PHE H . 7 . HN 1 1 31 1 2 1 1 22 TYR QE . 22 . HE# 1 1 32 1 1 1 1 7 PHE H . 7 . HN 1 1 32 1 2 1 1 22 TYR QD . 22 . HD# 1 1 33 1 1 1 1 7 PHE H . 7 . HN 1 1 33 1 2 1 1 7 PHE QD . 7 . HD# 1 1 34 1 1 1 1 6 GLY QA . 6 . HA# 1 1 34 1 2 1 1 7 PHE H . 7 . HN 1 1 35 1 1 1 1 7 PHE QB . 7 . HB# 1 1 35 1 2 1 1 33 VAL QG . 33 . HG# 1 1 36 1 1 1 1 7 PHE QB . 7 . HB# 1 1 36 1 2 1 1 7 PHE QD . 7 . HD# 1 1 37 1 1 1 1 7 PHE QD . 7 . HD# 1 1 37 1 2 1 1 8 TRP QB . 8 . HB# 1 1 38 1 1 1 1 8 TRP H . 8 . HN 1 1 38 1 2 1 1 9 TRP H . 9 . HN 1 1 39 1 1 1 1 7 PHE H . 7 . HN 1 1 39 1 2 1 1 8 TRP H . 8 . HN 1 1 40 1 1 1 1 7 PHE HA . 7 . HA 1 1 40 1 2 1 1 8 TRP H . 8 . HN 1 1 41 1 1 1 1 8 TRP H . 8 . HN 1 1 41 1 2 1 1 8 TRP QB . 8 . HB# 1 1 42 1 1 1 1 7 PHE QB . 7 . HB# 1 1 42 1 2 1 1 8 TRP H . 8 . HN 1 1 43 1 1 1 1 8 TRP H . 8 . HN 1 1 43 1 2 1 1 32 ALA HA . 32 . HA 1 1 44 1 1 1 1 8 TRP HA . 8 . HA 1 1 44 1 2 1 1 32 ALA HA . 32 . HA 1 1 45 1 1 1 1 8 TRP QB . 8 . HB# 1 1 45 1 2 1 1 32 ALA MB . 32 . HB# 1 1 46 1 1 1 1 9 TRP H . 9 . HN 1 1 46 1 2 1 1 32 ALA HA . 32 . HA 1 1 47 1 1 1 1 8 TRP HA . 8 . HA 1 1 47 1 2 1 1 9 TRP H . 9 . HN 1 1 48 1 1 1 1 8 TRP QB . 8 . HB# 1 1 48 1 2 1 1 9 TRP H . 9 . HN 1 1 49 1 1 1 1 9 TRP H . 9 . HN 1 1 49 1 2 1 1 9 TRP QB . 9 . HB# 1 1 50 1 1 1 1 6 GLY H . 6 . HN 1 1 50 1 2 1 1 9 TRP H . 9 . HN 1 1 51 1 1 1 1 6 GLY QA . 6 . HA# 1 1 51 1 2 1 1 9 TRP HE1 . 9 . HE1 1 1 52 1 1 1 1 6 GLY H . 6 . HN 1 1 52 1 2 1 1 9 TRP HE1 . 9 . HE1 1 1 53 1 1 1 1 9 TRP HA . 9 . HA 1 1 53 1 2 1 1 9 TRP HE1 . 9 . HE1 1 1 54 1 1 1 1 9 TRP HA . 9 . HA 1 1 54 1 2 1 1 9 TRP HD1 . 9 . HD1 1 1 55 1 1 1 1 9 TRP HA . 9 . HA 1 1 55 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1 56 1 1 1 1 9 TRP QB . 9 . HB# 1 1 56 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1 57 1 1 1 1 6 GLY QA . 6 . HA# 1 1 57 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1 58 1 1 1 1 5 GLY QA . 5 . HA# 1 1 58 1 2 1 1 9 TRP HE3 . 9 . HE3 1 1 59 1 1 1 1 6 GLY QA . 6 . HA# 1 1 59 1 2 1 1 9 TRP HZ3 . 9 . HZ3 1 1 60 1 1 1 1 5 GLY QA . 5 . HA# 1 1 60 1 2 1 1 9 TRP HZ3 . 9 . HZ3 1 1 61 1 1 1 1 6 GLY H . 6 . HN 1 1 61 1 2 1 1 9 TRP HZ2 . 9 . HZ2 1 1 62 1 1 1 1 6 GLY QA . 6 . HA# 1 1 62 1 2 1 1 9 TRP HZ2 . 9 . HZ2 1 1 63 1 1 1 1 9 TRP HA . 9 . HA 1 1 63 1 2 1 1 10 LYS H . 10 . HN 1 1 64 1 1 1 1 9 TRP QB . 9 . HB# 1 1 64 1 2 1 1 10 LYS H . 10 . HN 1 1 65 1 1 1 1 10 LYS H . 10 . HN 1 1 65 1 2 1 1 10 LYS QB . 10 . HB# 1 1 66 1 1 1 1 10 LYS H . 10 . HN 1 1 66 1 2 1 1 10 LYS QG . 10 . HG# 1 1 67 1 1 1 1 10 LYS HA . 10 . HA 1 1 67 1 2 1 1 29 GLY QA . 29 . HA# 1 1 68 1 1 1 1 10 LYS HA . 10 . HA 1 1 68 1 2 1 1 10 LYS QG . 10 . HG# 1 1 69 1 1 1 1 11 CYS H . 11 . HN 1 1 69 1 2 1 1 30 TRP HA . 30 . HA 1 1 70 1 1 1 1 10 LYS HA . 10 . HA 1 1 70 1 2 1 1 11 CYS H . 11 . HN 1 1 71 1 1 1 1 10 LYS QB . 10 . HB# 1 1 71 1 2 1 1 11 CYS H . 11 . HN 1 1 72 1 1 1 1 10 LYS QG . 10 . HG# 1 1 72 1 2 1 1 11 CYS H . 11 . HN 1 1 73 1 1 1 1 11 CYS H . 11 . HN 1 1 73 1 2 1 1 29 GLY QA . 29 . HA# 1 1 74 1 1 1 1 11 CYS HA . 11 . HA 1 1 74 1 2 1 1 16 PRO QD . 16 . HD# 1 1 75 1 1 1 1 10 LYS QB . 10 . HB# 1 1 75 1 2 1 1 11 CYS HA . 11 . HA 1 1 76 1 1 1 1 10 LYS QG . 10 . HG# 1 1 76 1 2 1 1 11 CYS HA . 11 . HA 1 1 77 1 1 1 1 11 CYS QB . 11 . HB# 1 1 77 1 2 1 1 24 CYS QB . 24 . HB# 1 1 78 1 1 1 1 11 CYS HA . 11 . HA 1 1 78 1 2 1 1 12 GLY H . 12 . HN 1 1 79 1 1 1 1 11 CYS QB . 11 . HB# 1 1 79 1 2 1 1 12 GLY H . 12 . HN 1 1 80 1 1 1 1 12 GLY H . 12 . HN 1 1 80 1 2 1 1 15 LYS QG . 15 . HG# 1 1 81 1 1 1 1 12 GLY H . 12 . HN 1 1 81 1 2 1 1 15 LYS QB . 15 . HB# 1 1 82 1 1 1 1 12 GLY H . 12 . HN 1 1 82 1 2 1 1 15 LYS QD . 15 . HD# 1 1 83 1 1 1 1 12 GLY H . 12 . HN 1 1 83 1 2 1 1 15 LYS H . 15 . HN 1 1 84 1 1 1 1 12 GLY H . 12 . HN 1 1 84 1 2 1 1 13 ARG H . 13 . HN 1 1 85 1 1 1 1 11 CYS QB . 11 . HB# 1 1 85 1 2 1 1 12 GLY QA . 12 . HA# 1 1 86 1 1 1 1 12 GLY QA . 12 . HA# 1 1 86 1 2 1 1 15 LYS QG . 15 . HG# 1 1 87 1 1 1 1 12 GLY QA . 12 . HA# 1 1 87 1 2 1 1 15 LYS QD . 15 . HD# 1 1 88 1 1 1 1 12 GLY QA . 12 . HA# 1 1 88 1 2 1 1 13 ARG H . 13 . HN 1 1 89 1 1 1 1 13 ARG H . 13 . HN 1 1 89 1 2 1 1 13 ARG QD . 13 . HD# 1 1 90 1 1 1 1 13 ARG H . 13 . HN 1 1 90 1 2 1 1 13 ARG QG . 13 . HG# 1 1 91 1 1 1 1 13 ARG H . 13 . HN 1 1 91 1 2 1 1 13 ARG QB . 13 . HB# 1 1 92 1 1 1 1 13 ARG HA . 13 . HA 1 1 92 1 2 1 1 13 ARG QG . 13 . HG# 1 1 93 1 1 1 1 13 ARG H . 13 . HN 1 1 93 1 2 1 1 14 GLY H . 14 . HN 1 1 94 1 1 1 1 14 GLY H . 14 . HN 1 1 94 1 2 1 1 15 LYS H . 15 . HN 1 1 95 1 1 1 1 13 ARG HA . 13 . HA 1 1 95 1 2 1 1 14 GLY H . 14 . HN 1 1 96 1 1 1 1 13 ARG QB . 13 . HB# 1 1 96 1 2 1 1 14 GLY H . 14 . HN 1 1 97 1 1 1 1 13 ARG QG . 13 . HG# 1 1 97 1 2 1 1 14 GLY H . 14 . HN 1 1 98 1 1 1 1 13 ARG QD . 13 . HD# 1 1 98 1 2 1 1 14 GLY H . 14 . HN 1 1 99 1 1 1 1 13 ARG HA . 13 . HA 1 1 99 1 2 1 1 15 LYS H . 15 . HN 1 1 100 1 1 1 1 12 GLY QA . 12 . HA# 1 1 100 1 2 1 1 15 LYS H . 15 . HN 1 1 101 1 1 1 1 14 GLY QA . 14 . HA# 1 1 101 1 2 1 1 15 LYS H . 15 . HN 1 1 102 1 1 1 1 15 LYS H . 15 . HN 1 1 102 1 2 1 1 15 LYS QB . 15 . HB# 1 1 103 1 1 1 1 15 LYS H . 15 . HN 1 1 103 1 2 1 1 15 LYS QG . 15 . HG# 1 1 104 1 1 1 1 15 LYS H . 15 . HN 1 1 104 1 2 1 1 15 LYS QD . 15 . HD# 1 1 105 1 1 1 1 15 LYS HA . 15 . HA 1 1 105 1 2 1 1 16 PRO QD . 16 . HD# 1 1 106 1 1 1 1 15 LYS HA . 15 . HA 1 1 106 1 2 1 1 15 LYS QG . 15 . HG# 1 1 107 1 1 1 1 16 PRO HA . 16 . HA 1 1 107 1 2 1 1 16 PRO QG . 16 . HG# 1 1 108 1 1 1 1 16 PRO HA . 16 . HA 1 1 108 1 2 1 1 16 PRO QD . 16 . HD# 1 1 109 1 1 1 1 15 LYS QB . 15 . HB# 1 1 109 1 2 1 1 16 PRO QD . 16 . HD# 1 1 110 1 1 1 1 15 LYS QG . 15 . HG# 1 1 110 1 2 1 1 16 PRO QD . 16 . HD# 1 1 111 1 1 1 1 16 PRO HA . 16 . HA 1 1 111 1 2 1 1 17 PRO QD . 17 . HD# 1 1 112 1 1 1 1 17 PRO HA . 17 . HA 1 1 112 1 2 1 1 17 PRO QG . 17 . HG# 1 1 113 1 1 1 1 17 PRO HA . 17 . HA 1 1 113 1 2 1 1 17 PRO QD . 17 . HD# 1 1 114 1 1 1 1 18 CYS H . 18 . HN 1 1 114 1 2 1 1 18 CYS QB . 18 . HB# 1 1 115 1 1 1 1 17 PRO HA . 17 . HA 1 1 115 1 2 1 1 18 CYS H . 18 . HN 1 1 116 1 1 1 1 17 PRO QB . 17 . HB# 1 1 116 1 2 1 1 18 CYS H . 18 . HN 1 1 117 1 1 1 1 5 GLY QA . 5 . HA# 1 1 117 1 2 1 1 18 CYS H . 18 . HN 1 1 118 1 1 1 1 4 CYS HA . 4 . HA 1 1 118 1 2 1 1 18 CYS H . 18 . HN 1 1 119 1 1 1 1 18 CYS HA . 18 . HA 1 1 119 1 2 1 1 19 CYS QB . 19 . HB# 1 1 120 1 1 1 1 5 GLY QA . 5 . HA# 1 1 120 1 2 1 1 18 CYS HA . 18 . HA 1 1 121 1 1 1 1 18 CYS QB . 18 . HB# 1 1 121 1 2 1 1 31 CYS QB . 31 . HB# 1 1 122 1 1 1 1 17 PRO QB . 17 . HB# 1 1 122 1 2 1 1 18 CYS HA . 18 . HA 1 1 123 1 1 1 1 5 GLY H . 5 . HN 1 1 123 1 2 1 1 19 CYS H . 19 . HN 1 1 124 1 1 1 1 18 CYS H . 18 . HN 1 1 124 1 2 1 1 19 CYS H . 19 . HN 1 1 125 1 1 1 1 19 CYS H . 19 . HN 1 1 125 1 2 1 1 20 LYS H . 20 . HN 1 1 126 1 1 1 1 19 CYS H . 19 . HN 1 1 126 1 2 1 1 22 TYR QD . 22 . HD# 1 1 127 1 1 1 1 19 CYS H . 19 . HN 1 1 127 1 2 1 1 22 TYR QB . 22 . HB# 1 1 128 1 1 1 1 18 CYS HA . 18 . HA 1 1 128 1 2 1 1 19 CYS H . 19 . HN 1 1 129 1 1 1 1 19 CYS H . 19 . HN 1 1 129 1 2 1 1 19 CYS QB . 19 . HB# 1 1 130 1 1 1 1 18 CYS QB . 18 . HB# 1 1 130 1 2 1 1 19 CYS H . 19 . HN 1 1 131 1 1 1 1 4 CYS QB . 4 . HB# 1 1 131 1 2 1 1 19 CYS H . 19 . HN 1 1 132 1 1 1 1 5 GLY QA . 5 . HA# 1 1 132 1 2 1 1 19 CYS H . 19 . HN 1 1 133 1 1 1 1 4 CYS QB . 4 . HB# 1 1 133 1 2 1 1 19 CYS HA . 19 . HA 1 1 134 1 1 1 1 19 CYS HA . 19 . HA 1 1 134 1 2 1 1 20 LYS H . 20 . HN 1 1 135 1 1 1 1 20 LYS H . 20 . HN 1 1 135 1 2 1 1 22 TYR QD . 22 . HD# 1 1 136 1 1 1 1 20 LYS H . 20 . HN 1 1 136 1 2 1 1 20 LYS QB . 20 . HB# 1 1 137 1 1 1 1 20 LYS H . 20 . HN 1 1 137 1 2 1 1 20 LYS HA . 20 . HA 1 1 138 1 1 1 1 20 LYS H . 20 . HN 1 1 138 1 2 1 1 20 LYS QG . 20 . HG# 1 1 139 1 1 1 1 4 CYS QB . 4 . HB# 1 1 139 1 2 1 1 20 LYS H . 20 . HN 1 1 140 1 1 1 1 19 CYS QB . 19 . HB# 1 1 140 1 2 1 1 20 LYS H . 20 . HN 1 1 141 1 1 1 1 20 LYS HA . 20 . HA 1 1 141 1 2 1 1 20 LYS QG . 20 . HG# 1 1 142 1 1 1 1 21 GLY H . 21 . HN 1 1 142 1 2 1 1 22 TYR QD . 22 . HD# 1 1 143 1 1 1 1 20 LYS HA . 20 . HA 1 1 143 1 2 1 1 21 GLY H . 21 . HN 1 1 144 1 1 1 1 21 GLY H . 21 . HN 1 1 144 1 2 1 1 22 TYR QB . 22 . HB# 1 1 145 1 1 1 1 20 LYS QG . 20 . HG# 1 1 145 1 2 1 1 21 GLY H . 21 . HN 1 1 146 1 1 1 1 20 LYS QB . 20 . HB# 1 1 146 1 2 1 1 21 GLY H . 21 . HN 1 1 147 1 1 1 1 21 GLY H . 21 . HN 1 1 147 1 2 1 1 22 TYR H . 22 . HN 1 1 148 1 1 1 1 21 GLY QA . 21 . HA# 1 1 148 1 2 1 1 22 TYR H . 22 . HN 1 1 149 1 1 1 1 20 LYS H . 20 . HN 1 1 149 1 2 1 1 22 TYR H . 22 . HN 1 1 150 1 1 1 1 22 TYR H . 22 . HN 1 1 150 1 2 1 1 22 TYR QB . 22 . HB# 1 1 151 1 1 1 1 22 TYR H . 22 . HN 1 1 151 1 2 1 1 33 VAL QG . 33 . HG# 1 1 152 1 1 1 1 22 TYR H . 22 . HN 1 1 152 1 2 1 1 22 TYR QD . 22 . HD# 1 1 153 1 1 1 1 22 TYR H . 22 . HN 1 1 153 1 2 1 1 22 TYR QE . 22 . HE# 1 1 154 1 1 1 1 18 CYS QB . 18 . HB# 1 1 154 1 2 1 1 22 TYR H . 22 . HN 1 1 155 1 1 1 1 21 GLY QA . 21 . HA# 1 1 155 1 2 1 1 22 TYR HA . 22 . HA 1 1 156 1 1 1 1 22 TYR HA . 22 . HA 1 1 156 1 2 1 1 33 VAL HA . 33 . HA 1 1 157 1 1 1 1 22 TYR HA . 22 . HA 1 1 157 1 2 1 1 34 GLU QB . 34 . HB# 1 1 158 1 1 1 1 22 TYR HA . 22 . HA 1 1 158 1 2 1 1 34 GLU QG . 34 . HG# 1 1 159 1 1 1 1 22 TYR HA . 22 . HA 1 1 159 1 2 1 1 23 ALA MB . 23 . HB# 1 1 160 1 1 1 1 22 TYR HA . 22 . HA 1 1 160 1 2 1 1 33 VAL QG . 33 . HG# 1 1 161 1 1 1 1 6 GLY H . 6 . HN 1 1 161 1 2 1 1 22 TYR QD . 22 . HD# 1 1 162 1 1 1 1 22 TYR HA . 22 . HA 1 1 162 1 2 1 1 22 TYR QD . 22 . HD# 1 1 163 1 1 1 1 22 TYR QD . 22 . HD# 1 1 163 1 2 1 1 32 ALA HA . 32 . HA 1 1 164 1 1 1 1 22 TYR QD . 22 . HD# 1 1 164 1 2 1 1 33 VAL HA . 33 . HA 1 1 165 1 1 1 1 7 PHE HA . 7 . HA 1 1 165 1 2 1 1 22 TYR QD . 22 . HD# 1 1 166 1 1 1 1 22 TYR QB . 22 . HB# 1 1 166 1 2 1 1 22 TYR QD . 22 . HD# 1 1 167 1 1 1 1 21 GLY QA . 21 . HA# 1 1 167 1 2 1 1 22 TYR QD . 22 . HD# 1 1 168 1 1 1 1 19 CYS HA . 19 . HA 1 1 168 1 2 1 1 22 TYR QD . 22 . HD# 1 1 169 1 1 1 1 22 TYR QD . 22 . HD# 1 1 169 1 2 1 1 23 ALA MB . 23 . HB# 1 1 170 1 1 1 1 18 CYS QB . 18 . HB# 1 1 170 1 2 1 1 22 TYR QD . 22 . HD# 1 1 171 1 1 1 1 22 TYR QD . 22 . HD# 1 1 171 1 2 1 1 33 VAL HB . 33 . HB 1 1 172 1 1 1 1 19 CYS QB . 19 . HB# 1 1 172 1 2 1 1 22 TYR QD . 22 . HD# 1 1 173 1 1 1 1 22 TYR QD . 22 . HD# 1 1 173 1 2 1 1 32 ALA MB . 32 . HB# 1 1 174 1 1 1 1 22 TYR QD . 22 . HD# 1 1 174 1 2 1 1 33 VAL QG . 33 . HG# 1 1 175 1 1 1 1 19 CYS HA . 19 . HA 1 1 175 1 2 1 1 22 TYR QE . 22 . HE# 1 1 176 1 1 1 1 7 PHE HA . 7 . HA 1 1 176 1 2 1 1 22 TYR QE . 22 . HE# 1 1 177 1 1 1 1 7 PHE QB . 7 . HB# 1 1 177 1 2 1 1 22 TYR QE . 22 . HE# 1 1 178 1 1 1 1 19 CYS QB . 19 . HB# 1 1 178 1 2 1 1 22 TYR QE . 22 . HE# 1 1 179 1 1 1 1 22 TYR QE . 22 . HE# 1 1 179 1 2 1 1 32 ALA HA . 32 . HA 1 1 180 1 1 1 1 22 TYR QE . 22 . HE# 1 1 180 1 2 1 1 33 VAL QG . 33 . HG# 1 1 181 1 1 1 1 22 TYR QE . 22 . HE# 1 1 181 1 2 1 1 33 VAL HB . 33 . HB 1 1 182 1 1 1 1 22 TYR QE . 22 . HE# 1 1 182 1 2 1 1 33 VAL HA . 33 . HA 1 1 183 1 1 1 1 22 TYR HA . 22 . HA 1 1 183 1 2 1 1 22 TYR QE . 22 . HE# 1 1 184 1 1 1 1 22 TYR H . 22 . HN 1 1 184 1 2 1 1 23 ALA H . 23 . HN 1 1 185 1 1 1 1 23 ALA H . 23 . HN 1 1 185 1 2 1 1 32 ALA H . 32 . HN 1 1 186 1 1 1 1 22 TYR HA . 22 . HA 1 1 186 1 2 1 1 23 ALA H . 23 . HN 1 1 187 1 1 1 1 23 ALA H . 23 . HN 1 1 187 1 2 1 1 31 CYS HA . 31 . HA 1 1 188 1 1 1 1 23 ALA H . 23 . HN 1 1 188 1 2 1 1 34 GLU HA . 34 . HA 1 1 189 1 1 1 1 23 ALA H . 23 . HN 1 1 189 1 2 1 1 33 VAL HA . 33 . HA 1 1 190 1 1 1 1 22 TYR QB . 22 . HB# 1 1 190 1 2 1 1 23 ALA H . 23 . HN 1 1 191 1 1 1 1 23 ALA H . 23 . HN 1 1 191 1 2 1 1 31 CYS QB . 31 . HB# 1 1 192 1 1 1 1 23 ALA H . 23 . HN 1 1 192 1 2 1 1 23 ALA MB . 23 . HB# 1 1 193 1 1 1 1 23 ALA H . 23 . HN 1 1 193 1 2 1 1 32 ALA MB . 32 . HB# 1 1 194 1 1 1 1 23 ALA H . 23 . HN 1 1 194 1 2 1 1 33 VAL QG . 33 . HG# 1 1 195 1 1 1 1 18 CYS QB . 18 . HB# 1 1 195 1 2 1 1 23 ALA HA . 23 . HA 1 1 196 1 1 1 1 24 CYS H . 24 . HN 1 1 196 1 2 1 1 24 CYS QB . 24 . HB# 1 1 197 1 1 1 1 23 ALA MB . 23 . HB# 1 1 197 1 2 1 1 24 CYS H . 24 . HN 1 1 198 1 1 1 1 23 ALA HA . 23 . HA 1 1 198 1 2 1 1 24 CYS H . 24 . HN 1 1 199 1 1 1 1 24 CYS HA . 24 . HA 1 1 199 1 2 1 1 31 CYS QB . 31 . HB# 1 1 200 1 1 1 1 24 CYS HA . 24 . HA 1 1 200 1 2 1 1 25 SER QB . 25 . HB# 1 1 201 1 1 1 1 25 SER H . 25 . HN 1 1 201 1 2 1 1 29 GLY QA . 29 . HA# 1 1 202 1 1 1 1 25 SER H . 25 . HN 1 1 202 1 2 1 1 30 TRP H . 30 . HN 1 1 203 1 1 1 1 25 SER H . 25 . HN 1 1 203 1 2 1 1 25 SER QB . 25 . HB# 1 1 204 1 1 1 1 24 CYS HA . 24 . HA 1 1 204 1 2 1 1 25 SER H . 25 . HN 1 1 205 1 1 1 1 24 CYS QB . 24 . HB# 1 1 205 1 2 1 1 25 SER H . 25 . HN 1 1 206 1 1 1 1 25 SER H . 25 . HN 1 1 206 1 2 1 1 31 CYS HA . 31 . HA 1 1 207 1 1 1 1 25 SER QB . 25 . HB# 1 1 207 1 2 1 1 28 TRP QB . 28 . HB# 1 1 208 1 1 1 1 26 LYS H . 26 . HN 1 1 208 1 2 1 1 27 THR H . 27 . HN 1 1 209 1 1 1 1 26 LYS H . 26 . HN 1 1 209 1 2 1 1 28 TRP H . 28 . HN 1 1 210 1 1 1 1 26 LYS H . 26 . HN 1 1 210 1 2 1 1 26 LYS QB . 26 . HB# 1 1 211 1 1 1 1 26 LYS H . 26 . HN 1 1 211 1 2 1 1 26 LYS QD . 26 . HD# 1 1 212 1 1 1 1 26 LYS H . 26 . HN 1 1 212 1 2 1 1 26 LYS QG . 26 . HG# 1 1 213 1 1 1 1 25 SER HA . 25 . HA 1 1 213 1 2 1 1 26 LYS H . 26 . HN 1 1 214 1 1 1 1 13 ARG HA . 13 . HA 1 1 214 1 2 1 1 26 LYS H . 26 . HN 1 1 215 1 1 1 1 13 ARG QG . 13 . HG# 1 1 215 1 2 1 1 26 LYS H . 26 . HN 1 1 216 1 1 1 1 13 ARG QD . 13 . HD# 1 1 216 1 2 1 1 26 LYS H . 26 . HN 1 1 217 1 1 1 1 26 LYS HA . 26 . HA 1 1 217 1 2 1 1 26 LYS QG . 26 . HG# 1 1 218 1 1 1 1 26 LYS QB . 26 . HB# 1 1 218 1 2 1 1 27 THR H . 27 . HN 1 1 219 1 1 1 1 27 THR H . 27 . HN 1 1 219 1 2 1 1 28 TRP H . 28 . HN 1 1 220 1 1 1 1 26 LYS QG . 26 . HG# 1 1 220 1 2 1 1 27 THR H . 27 . HN 1 1 221 1 1 1 1 27 THR H . 27 . HN 1 1 221 1 2 1 1 27 THR MG . 27 . HG2# 1 1 222 1 1 1 1 26 LYS HA . 26 . HA 1 1 222 1 2 1 1 27 THR H . 27 . HN 1 1 223 1 1 1 1 27 THR H . 27 . HN 1 1 223 1 2 1 1 27 THR HB . 27 . HB 1 1 224 1 1 1 1 25 SER QB . 25 . HB# 1 1 224 1 2 1 1 27 THR H . 27 . HN 1 1 225 1 1 1 1 25 SER HA . 25 . HA 1 1 225 1 2 1 1 27 THR H . 27 . HN 1 1 226 1 1 1 1 27 THR HA . 27 . HA 1 1 226 1 2 1 1 27 THR MG . 27 . HG2# 1 1 227 1 1 1 1 27 THR HB . 27 . HB 1 1 227 1 2 1 1 28 TRP H . 28 . HN 1 1 228 1 1 1 1 27 THR MG . 27 . HG2# 1 1 228 1 2 1 1 28 TRP H . 28 . HN 1 1 229 1 1 1 1 27 THR HA . 27 . HA 1 1 229 1 2 1 1 28 TRP H . 28 . HN 1 1 230 1 1 1 1 25 SER QB . 25 . HB# 1 1 230 1 2 1 1 28 TRP H . 28 . HN 1 1 231 1 1 1 1 28 TRP H . 28 . HN 1 1 231 1 2 1 1 28 TRP QB . 28 . HB# 1 1 232 1 1 1 1 27 THR HB . 27 . HB 1 1 232 1 2 1 1 28 TRP HE1 . 28 . HE1 1 1 233 1 1 1 1 27 THR MG . 27 . HG2# 1 1 233 1 2 1 1 28 TRP HE1 . 28 . HE1 1 1 234 1 1 1 1 28 TRP HA . 28 . HA 1 1 234 1 2 1 1 28 TRP HE1 . 28 . HE1 1 1 235 1 1 1 1 28 TRP H . 28 . HN 1 1 235 1 2 1 1 29 GLY H . 29 . HN 1 1 236 1 1 1 1 29 GLY H . 29 . HN 1 1 236 1 2 1 1 30 TRP H . 30 . HN 1 1 237 1 1 1 1 28 TRP HA . 28 . HA 1 1 237 1 2 1 1 29 GLY H . 29 . HN 1 1 238 1 1 1 1 25 SER QB . 25 . HB# 1 1 238 1 2 1 1 29 GLY H . 29 . HN 1 1 239 1 1 1 1 25 SER HA . 25 . HA 1 1 239 1 2 1 1 29 GLY H . 29 . HN 1 1 240 1 1 1 1 28 TRP QB . 28 . HB# 1 1 240 1 2 1 1 29 GLY H . 29 . HN 1 1 241 1 1 1 1 27 THR H . 27 . HN 1 1 241 1 2 1 1 29 GLY H . 29 . HN 1 1 242 1 1 1 1 27 THR HB . 27 . HB 1 1 242 1 2 1 1 29 GLY H . 29 . HN 1 1 243 1 1 1 1 26 LYS QB . 26 . HB# 1 1 243 1 2 1 1 29 GLY H . 29 . HN 1 1 244 1 1 1 1 30 TRP H . 30 . HN 1 1 244 1 2 1 1 30 TRP QB . 30 . HB# 1 1 245 1 1 1 1 29 GLY QA . 29 . HA# 1 1 245 1 2 1 1 30 TRP H . 30 . HN 1 1 246 1 1 1 1 25 SER QB . 25 . HB# 1 1 246 1 2 1 1 30 TRP H . 30 . HN 1 1 247 1 1 1 1 25 SER HA . 25 . HA 1 1 247 1 2 1 1 30 TRP H . 30 . HN 1 1 248 1 1 1 1 10 LYS HA . 10 . HA 1 1 248 1 2 1 1 30 TRP H . 30 . HN 1 1 249 1 1 1 1 10 LYS HA . 10 . HA 1 1 249 1 2 1 1 30 TRP HA . 30 . HA 1 1 250 1 1 1 1 29 GLY QA . 29 . HA# 1 1 250 1 2 1 1 30 TRP HA . 30 . HA 1 1 251 1 1 1 1 25 SER QB . 25 . HB# 1 1 251 1 2 1 1 30 TRP HA . 30 . HA 1 1 252 1 1 1 1 11 CYS QB . 11 . HB# 1 1 252 1 2 1 1 30 TRP HA . 30 . HA 1 1 253 1 1 1 1 25 SER QB . 25 . HB# 1 1 253 1 2 1 1 30 TRP HE1 . 30 . HE1 1 1 254 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 254 1 2 1 1 32 ALA MB . 32 . HB# 1 1 255 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 255 1 2 1 1 31 CYS HA . 31 . HA 1 1 256 1 1 1 1 30 TRP HA . 30 . HA 1 1 256 1 2 1 1 30 TRP HD1 . 30 . HD1 1 1 257 1 1 1 1 29 GLY QA . 29 . HA# 1 1 257 1 2 1 1 30 TRP HE3 . 30 . HE3 1 1 258 1 1 1 1 29 GLY H . 29 . HN 1 1 258 1 2 1 1 30 TRP HE3 . 30 . HE3 1 1 259 1 1 1 1 28 TRP QB . 28 . HB# 1 1 259 1 2 1 1 30 TRP HH2 . 30 . HH2 1 1 260 1 1 1 1 28 TRP QB . 28 . HB# 1 1 260 1 2 1 1 30 TRP HZ2 . 30 . HZ2 1 1 261 1 1 1 1 30 TRP HD1 . 30 . HD1 1 1 261 1 2 1 1 31 CYS H . 31 . HN 1 1 262 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 262 1 2 1 1 31 CYS H . 31 . HN 1 1 263 1 1 1 1 9 TRP H . 9 . HN 1 1 263 1 2 1 1 31 CYS H . 31 . HN 1 1 264 1 1 1 1 9 TRP HA . 9 . HA 1 1 264 1 2 1 1 31 CYS H . 31 . HN 1 1 265 1 1 1 1 10 LYS HA . 10 . HA 1 1 265 1 2 1 1 31 CYS H . 31 . HN 1 1 266 1 1 1 1 11 CYS H . 11 . HN 1 1 266 1 2 1 1 31 CYS H . 31 . HN 1 1 267 1 1 1 1 11 CYS QB . 11 . HB# 1 1 267 1 2 1 1 31 CYS H . 31 . HN 1 1 268 1 1 1 1 30 TRP HA . 30 . HA 1 1 268 1 2 1 1 31 CYS H . 31 . HN 1 1 269 1 1 1 1 31 CYS H . 31 . HN 1 1 269 1 2 1 1 31 CYS QB . 31 . HB# 1 1 270 1 1 1 1 30 TRP QB . 30 . HB# 1 1 270 1 2 1 1 31 CYS H . 31 . HN 1 1 271 1 1 1 1 24 CYS QB . 24 . HB# 1 1 271 1 2 1 1 31 CYS HA . 31 . HA 1 1 272 1 1 1 1 24 CYS HA . 24 . HA 1 1 272 1 2 1 1 31 CYS HA . 31 . HA 1 1 273 1 1 1 1 11 CYS QB . 11 . HB# 1 1 273 1 2 1 1 31 CYS HA . 31 . HA 1 1 274 1 1 1 1 23 ALA MB . 23 . HB# 1 1 274 1 2 1 1 31 CYS HA . 31 . HA 1 1 275 1 1 1 1 30 TRP HE1 . 30 . HE1 1 1 275 1 2 1 1 32 ALA H . 32 . HN 1 1 276 1 1 1 1 32 ALA H . 32 . HN 1 1 276 1 2 1 1 33 VAL H . 33 . HN 1 1 277 1 1 1 1 22 TYR QD . 22 . HD# 1 1 277 1 2 1 1 32 ALA H . 32 . HN 1 1 278 1 1 1 1 24 CYS HA . 24 . HA 1 1 278 1 2 1 1 32 ALA H . 32 . HN 1 1 279 1 1 1 1 25 SER H . 25 . HN 1 1 279 1 2 1 1 32 ALA H . 32 . HN 1 1 280 1 1 1 1 30 TRP HD1 . 30 . HD1 1 1 280 1 2 1 1 32 ALA H . 32 . HN 1 1 281 1 1 1 1 31 CYS HA . 31 . HA 1 1 281 1 2 1 1 32 ALA H . 32 . HN 1 1 282 1 1 1 1 22 TYR HA . 22 . HA 1 1 282 1 2 1 1 32 ALA H . 32 . HN 1 1 283 1 1 1 1 22 TYR QB . 22 . HB# 1 1 283 1 2 1 1 32 ALA H . 32 . HN 1 1 284 1 1 1 1 31 CYS QB . 31 . HB# 1 1 284 1 2 1 1 32 ALA H . 32 . HN 1 1 285 1 1 1 1 32 ALA H . 32 . HN 1 1 285 1 2 1 1 32 ALA MB . 32 . HB# 1 1 286 1 1 1 1 7 PHE HA . 7 . HA 1 1 286 1 2 1 1 32 ALA HA . 32 . HA 1 1 287 1 1 1 1 32 ALA MB . 32 . HB# 1 1 287 1 2 1 1 33 VAL QG . 33 . HG# 1 1 288 1 1 1 1 22 TYR QB . 22 . HB# 1 1 288 1 2 1 1 33 VAL H . 33 . HN 1 1 289 1 1 1 1 22 TYR QD . 22 . HD# 1 1 289 1 2 1 1 33 VAL H . 33 . HN 1 1 290 1 1 1 1 22 TYR QE . 22 . HE# 1 1 290 1 2 1 1 33 VAL H . 33 . HN 1 1 291 1 1 1 1 32 ALA HA . 32 . HA 1 1 291 1 2 1 1 33 VAL H . 33 . HN 1 1 292 1 1 1 1 33 VAL H . 33 . HN 1 1 292 1 2 1 1 33 VAL HB . 33 . HB 1 1 293 1 1 1 1 32 ALA MB . 32 . HB# 1 1 293 1 2 1 1 33 VAL H . 33 . HN 1 1 294 1 1 1 1 33 VAL H . 33 . HN 1 1 294 1 2 1 1 33 VAL QG . 33 . HG# 1 1 295 1 1 1 1 22 TYR HA . 22 . HA 1 1 295 1 2 1 1 33 VAL H . 33 . HN 1 1 296 1 1 1 1 22 TYR QB . 22 . HB# 1 1 296 1 2 1 1 33 VAL HA . 33 . HA 1 1 297 1 1 1 1 22 TYR HA . 22 . HA 1 1 297 1 2 1 1 34 GLU H . 34 . HN 1 1 298 1 1 1 1 34 GLU H . 34 . HN 1 1 298 1 2 1 1 34 GLU QB . 34 . HB# 1 1 299 1 1 1 1 34 GLU H . 34 . HN 1 1 299 1 2 1 1 34 GLU QG . 34 . HG# 1 1 300 1 1 1 1 33 VAL HA . 33 . HA 1 1 300 1 2 1 1 34 GLU H . 34 . HN 1 1 301 1 1 1 1 33 VAL HB . 33 . HB 1 1 301 1 2 1 1 34 GLU H . 34 . HN 1 1 302 1 1 1 1 33 VAL QG . 33 . HG# 1 1 302 1 2 1 1 34 GLU H . 34 . HN 1 1 303 1 1 1 1 34 GLU HA . 34 . HA 1 1 303 1 2 1 1 34 GLU QG . 34 . HG# 1 1 304 1 1 1 1 34 GLU HA . 34 . HA 1 1 304 1 2 1 1 35 ALA H . 35 . HN 1 1 305 1 1 1 1 35 ALA H . 35 . HN 1 1 305 1 2 1 1 35 ALA MB . 35 . HB# 1 1 306 1 1 1 1 34 GLU QB . 34 . HB# 1 1 306 1 2 1 1 35 ALA H . 35 . HN 1 1 307 1 1 1 1 35 ALA HA . 35 . HA 1 1 307 1 2 1 1 36 PRO QD . 36 . HD# 1 1 308 1 1 1 1 36 PRO HA . 36 . HA 1 1 308 1 2 1 1 36 PRO QG . 36 . HG# 1 1 309 1 1 1 1 36 PRO HA . 36 . HA 1 1 309 1 2 1 1 36 PRO QD . 36 . 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 . . . . . 2.7 1.8 2.7 1 1 2 1 . . . . . 2.7 1.8 2.7 1 1 3 1 . . . . . 2.7 1.8 3.7 1 1 4 1 . . . . . 2.7 1.8 3.7 1 1 5 1 . . . . . 3.5 1.8 4.5 1 1 6 1 . . . . . 5.0 1.8 5.0 1 1 7 1 . . . . . 3.5 1.8 4.5 1 1 8 1 . . . . . 3.5 1.8 4.5 1 1 9 1 . . . . . 3.5 1.8 4.5 1 1 10 1 . . . . . 2.7 1.8 2.7 1 1 11 1 . . . . . 3.5 1.8 4.5 1 1 12 1 . . . . . 3.5 1.8 4.5 1 1 13 1 . . . . . 5.0 1.8 6.0 1 1 14 1 . . . . . 3.5 1.8 4.5 1 1 15 1 . . . . . 3.5 1.8 3.5 1 1 16 1 . . . . . 2.7 1.8 4.7 1 1 17 1 . . . . . 5.0 1.8 5.0 1 1 18 1 . . . . . 3.5 1.8 3.5 1 1 19 1 . . . . . 2.7 1.8 2.7 1 1 20 1 . . . . . 5.0 1.8 6.0 1 1 21 1 . . . . . 5.0 1.8 6.0 1 1 22 1 . . . . . 2.7 1.8 3.7 1 1 23 1 . . . . . 5.0 1.8 5.0 1 1 24 1 . . . . . 3.5 1.8 5.5 1 1 25 1 . . . . . 3.5 1.8 5.5 1 1 26 1 . . . . . 2.7 1.8 3.7 1 1 27 1 . . . . . 3.5 1.8 4.5 1 1 28 1 . . . . . 5.0 1.8 7.0 1 1 29 1 . . . . . 2.7 1.8 3.7 1 1 30 1 . . . . . 5.0 1.8 5.0 1 1 31 1 . . . . . 3.5 1.8 5.9 1 1 32 1 . . . . . 5.0 1.8 7.4 1 1 33 1 . . . . . 3.5 1.8 5.9 1 1 34 1 . . . . . 2.7 1.8 3.7 1 1 35 1 . . . . . 5.0 1.8 8.4 1 1 36 1 . . . . . 2.7 1.8 6.1 1 1 37 1 . . . . . 2.7 1.8 6.1 1 1 38 1 . . . . . 3.5 1.8 3.5 1 1 39 1 . . . . . 3.5 1.8 3.5 1 1 40 1 . . . . . 3.5 1.8 3.5 1 1 41 1 . . . . . 3.5 1.8 4.5 1 1 42 1 . . . . . 3.5 1.8 4.5 1 1 43 1 . . . . . 5.0 1.8 5.0 1 1 44 1 . . . . . 3.5 1.8 3.5 1 1 45 1 . . . . . 3.5 1.8 5.5 1 1 46 1 . . . . . 5.0 1.5 5.0 1 1 47 1 . . . . . 2.7 1.8 2.7 1 1 48 1 . . . . . 3.5 1.8 4.5 1 1 49 1 . . . . . 2.7 1.8 3.7 1 1 50 1 . . . . . 5.0 1.8 5.0 1 1 51 1 . . . . . 3.5 1.8 4.5 1 1 52 1 . . . . . 5.0 1.8 5.0 1 1 53 1 . . . . . 5.0 1.8 5.0 1 1 54 1 . . . . . 5.0 1.8 5.0 1 1 55 1 . . . . . 5.0 1.8 5.0 1 1 56 1 . . . . . 2.7 1.8 3.7 1 1 57 1 . . . . . 5.0 1.8 6.0 1 1 58 1 . . . . . 3.5 1.8 4.5 1 1 59 1 . . . . . 5.0 1.8 6.0 1 1 60 1 . . . . . 3.5 1.8 4.5 1 1 61 1 . . . . . 5.0 1.8 5.0 1 1 62 1 . . . . . 2.7 1.8 3.7 1 1 63 1 . . . . . 2.7 1.8 2.7 1 1 64 1 . . . . . 3.5 1.8 4.5 1 1 65 1 . . . . . 2.7 1.8 3.7 1 1 66 1 . . . . . 3.5 1.8 4.5 1 1 67 1 . . . . . 5.0 1.8 6.0 1 1 68 1 . . . . . 3.5 1.8 4.5 1 1 69 1 . . . . . 2.7 1.8 2.7 1 1 70 1 . . . . . 2.7 1.8 2.7 1 1 71 1 . . . . . 3.5 1.8 4.5 1 1 72 1 . . . . . 3.5 1.8 4.5 1 1 73 1 . . . . . 3.5 1.8 4.5 1 1 74 1 . . . . . 3.5 1.8 5.5 1 1 75 1 . . . . . 3.5 1.8 4.5 1 1 76 1 . . . . . 5.0 1.8 6.0 1 1 77 1 . . . . . 2.7 1.8 4.7 1 1 78 1 . . . . . 2.7 1.8 2.7 1 1 79 1 . . . . . 2.7 1.8 3.7 1 1 80 1 . . . . . 5.0 1.8 6.0 1 1 81 1 . . . . . 2.7 1.8 3.7 1 1 82 1 . . . . . 5.0 1.8 6.0 1 1 83 1 . . . . . 3.5 1.8 3.5 1 1 84 1 . . . . . 5.0 1.8 5.0 1 1 85 1 . . . . . 3.5 1.8 5.5 1 1 86 1 . . . . . 5.0 1.8 7.0 1 1 87 1 . . . . . 5.0 1.8 7.0 1 1 88 1 . . . . . 2.7 1.8 3.7 1 1 89 1 . . . . . 5.0 1.8 6.0 1 1 90 1 . . . . . 3.5 1.8 4.5 1 1 91 1 . . . . . 2.7 1.8 3.7 1 1 92 1 . . . . . 3.5 1.8 4.5 1 1 93 1 . . . . . 3.5 1.8 3.5 1 1 94 1 . . . . . 2.7 1.8 2.7 1 1 95 1 . . . . . 3.5 1.8 3.5 1 1 96 1 . . . . . 3.5 1.8 4.5 1 1 97 1 . . . . . 5.0 1.8 6.0 1 1 98 1 . . . . . 5.0 1.8 6.0 1 1 99 1 . . . . . 5.0 1.8 5.0 1 1 100 1 . . . . . 3.5 1.8 4.5 1 1 101 1 . . . . . 2.7 1.8 3.7 1 1 102 1 . . . . . 2.7 1.8 3.7 1 1 103 1 . . . . . 3.5 1.8 4.5 1 1 104 1 . . . . . 5.0 1.8 6.0 1 1 105 1 . . . . . 2.7 1.8 3.7 1 1 106 1 . . . . . 3.5 1.8 4.5 1 1 107 1 . . . . . 3.5 1.8 4.5 1 1 108 1 . . . . . 3.5 1.8 4.5 1 1 109 1 . . . . . 3.5 1.8 5.5 1 1 110 1 . . . . . 5.0 1.8 7.0 1 1 111 1 . . . . . 3.5 1.8 4.5 1 1 112 1 . . . . . 3.5 1.8 4.5 1 1 113 1 . . . . . 3.5 1.8 4.5 1 1 114 1 . . . . . 3.5 1.8 4.5 1 1 115 1 . . . . . 2.7 1.8 2.7 1 1 116 1 . . . . . 3.5 1.8 4.5 1 1 117 1 . . . . . 5.0 1.8 6.0 1 1 118 1 . . . . . 5.0 1.8 5.0 1 1 119 1 . . . . . 5.0 1.8 6.0 1 1 120 1 . . . . . 3.5 1.8 4.5 1 1 121 1 . . . . . 2.7 1.8 4.7 1 1 122 1 . . . . . 5.0 1.8 6.0 1 1 123 1 . . . . . 2.7 1.8 2.7 1 1 124 1 . . . . . 5.0 1.8 5.0 1 1 125 1 . . . . . 5.0 1.8 5.0 1 1 126 1 . . . . . 3.5 1.8 5.9 1 1 127 1 . . . . . 5.0 1.8 6.0 1 1 128 1 . . . . . 2.7 1.8 2.7 1 1 129 1 . . . . . 2.7 1.8 3.7 1 1 130 1 . . . . . 2.7 1.8 3.7 1 1 131 1 . . . . . 3.5 1.8 4.5 1 1 132 1 . . . . . 3.5 1.8 4.5 1 1 133 1 . . . . . 3.5 1.8 4.5 1 1 134 1 . . . . . 2.7 1.8 2.7 1 1 135 1 . . . . . 5.0 1.8 7.4 1 1 136 1 . . . . . 2.7 1.8 3.7 1 1 137 1 . . . . . 2.7 1.8 2.7 1 1 138 1 . . . . . 3.5 1.8 4.5 1 1 139 1 . . . . . 3.5 1.8 4.5 1 1 140 1 . . . . . 2.7 1.8 3.7 1 1 141 1 . . . . . 3.5 1.8 4.5 1 1 142 1 . . . . . 5.0 1.8 7.4 1 1 143 1 . . . . . 2.7 1.8 2.7 1 1 144 1 . . . . . 5.0 1.8 6.0 1 1 145 1 . . . . . 3.5 1.8 4.5 1 1 146 1 . . . . . 3.5 1.8 4.5 1 1 147 1 . . . . . 2.7 1.8 2.7 1 1 148 1 . . . . . 2.7 1.8 3.7 1 1 149 1 . . . . . 5.0 1.8 5.0 1 1 150 1 . . . . . 3.5 1.8 4.5 1 1 151 1 . . . . . 3.5 1.8 5.9 1 1 152 1 . . . . . 2.7 1.8 5.1 1 1 153 1 . . . . . 5.0 1.8 7.4 1 1 154 1 . . . . . 3.5 1.8 4.5 1 1 155 1 . . . . . 5.0 1.8 6.0 1 1 156 1 . . . . . 2.7 1.8 2.7 1 1 157 1 . . . . . 5.0 1.8 6.0 1 1 158 1 . . . . . 5.0 1.8 6.0 1 1 159 1 . . . . . 5.0 1.8 6.0 1 1 160 1 . . . . . 3.5 1.8 5.9 1 1 161 1 . . . . . 5.0 1.8 7.4 1 1 162 1 . . . . . 3.5 1.8 5.9 1 1 163 1 . . . . . 3.5 1.8 5.9 1 1 164 1 . . . . . 2.7 1.8 5.1 1 1 165 1 . . . . . 5.0 1.8 7.4 1 1 166 1 . . . . . 2.7 1.8 6.1 1 1 167 1 . . . . . 3.5 1.8 6.9 1 1 168 1 . . . . . 5.0 1.8 7.4 1 1 169 1 . . . . . 5.0 1.8 8.4 1 1 170 1 . . . . . 3.5 1.8 6.9 1 1 171 1 . . . . . 5.0 1.8 7.4 1 1 172 1 . . . . . 2.7 1.8 6.1 1 1 173 1 . . . . . 5.0 1.8 8.4 1 1 174 1 . . . . . 5.0 1.8 9.8 1 1 175 1 . . . . . 5.0 1.8 7.4 1 1 176 1 . . . . . 3.5 1.8 5.9 1 1 177 1 . . . . . 3.5 1.8 6.9 1 1 178 1 . . . . . 3.5 1.8 6.9 1 1 179 1 . . . . . 5.0 1.8 7.4 1 1 180 1 . . . . . 2.7 1.8 7.5 1 1 181 1 . . . . . 5.0 1.8 7.4 1 1 182 1 . . . . . 5.0 1.8 7.4 1 1 183 1 . . . . . 5.0 1.8 7.4 1 1 184 1 . . . . . 5.0 1.8 5.0 1 1 185 1 . . . . . 3.5 1.8 3.5 1 1 186 1 . . . . . 2.7 1.8 2.7 1 1 187 1 . . . . . 5.0 1.8 5.0 1 1 188 1 . . . . . 5.0 1.8 5.0 1 1 189 1 . . . . . 3.5 1.8 3.5 1 1 190 1 . . . . . 2.7 1.8 3.7 1 1 191 1 . . . . . 5.0 1.8 6.0 1 1 192 1 . . . . . 2.7 1.8 3.7 1 1 193 1 . . . . . 5.0 1.8 6.0 1 1 194 1 . . . . . 5.0 1.8 7.4 1 1 195 1 . . . . . 3.5 1.8 4.5 1 1 196 1 . . . . . 2.7 1.8 3.7 1 1 197 1 . . . . . 2.7 1.8 3.7 1 1 198 1 . . . . . 2.7 1.8 2.7 1 1 199 1 . . . . . 5.0 1.8 6.0 1 1 200 1 . . . . . 5.0 1.8 6.0 1 1 201 1 . . . . . 5.0 1.8 6.0 1 1 202 1 . . . . . 3.5 1.8 3.5 1 1 203 1 . . . . . 2.7 1.8 3.7 1 1 204 1 . . . . . 2.7 1.8 2.7 1 1 205 1 . . . . . 2.7 1.8 3.7 1 1 206 1 . . . . . 3.5 1.8 3.5 1 1 207 1 . . . . . 3.5 1.8 5.5 1 1 208 1 . . . . . 2.7 1.8 2.7 1 1 209 1 . . . . . 5.0 1.8 5.0 1 1 210 1 . . . . . 2.7 1.8 3.7 1 1 211 1 . . . . . 5.0 1.8 6.0 1 1 212 1 . . . . . 3.5 1.8 4.5 1 1 213 1 . . . . . 2.7 1.8 2.7 1 1 214 1 . . . . . 3.5 1.8 3.5 1 1 215 1 . . . . . 5.0 1.8 6.0 1 1 216 1 . . . . . 5.0 1.8 6.0 1 1 217 1 . . . . . 3.5 1.8 4.5 1 1 218 1 . . . . . 2.7 1.8 3.7 1 1 219 1 . . . . . 2.7 1.8 2.7 1 1 220 1 . . . . . 3.5 1.8 4.5 1 1 221 1 . . . . . 3.5 1.8 4.5 1 1 222 1 . . . . . 3.5 1.8 3.5 1 1 223 1 . . . . . 2.7 1.8 2.7 1 1 224 1 . . . . . 5.0 1.8 6.0 1 1 225 1 . . . . . 5.0 1.8 5.0 1 1 226 1 . . . . . 3.5 1.8 4.5 1 1 227 1 . . . . . 2.7 1.8 2.7 1 1 228 1 . . . . . 3.5 1.8 4.5 1 1 229 1 . . . . . 3.5 1.8 3.5 1 1 230 1 . . . . . 5.0 1.8 6.0 1 1 231 1 . . . . . 2.7 1.8 3.7 1 1 232 1 . . . . . 3.5 1.8 3.5 1 1 233 1 . . . . . 3.5 1.8 4.5 1 1 234 1 . . . . . 5.0 1.8 5.0 1 1 235 1 . . . . . 2.7 1.8 2.7 1 1 236 1 . . . . . 2.7 1.8 2.7 1 1 237 1 . . . . . 5.0 1.8 5.0 1 1 238 1 . . . . . 2.7 1.8 3.7 1 1 239 1 . . . . . 5.0 1.8 5.0 1 1 240 1 . . . . . 3.5 1.8 4.5 1 1 241 1 . . . . . 5.0 1.8 5.0 1 1 242 1 . . . . . 5.0 1.8 5.0 1 1 243 1 . . . . . 5.0 1.8 6.0 1 1 244 1 . . . . . 2.7 1.8 3.7 1 1 245 1 . . . . . 2.7 1.8 3.7 1 1 246 1 . . . . . 3.5 1.8 4.5 1 1 247 1 . . . . . 5.0 1.8 5.0 1 1 248 1 . . . . . 5.0 1.8 5.0 1 1 249 1 . . . . . 2.7 1.8 2.7 1 1 250 1 . . . . . 5.0 1.8 6.0 1 1 251 1 . . . . . 5.0 1.8 6.0 1 1 252 1 . . . . . 3.5 1.8 4.5 1 1 253 1 . . . . . 5.0 1.8 6.0 1 1 254 1 . . . . . 3.5 1.8 4.5 1 1 255 1 . . . . . 5.0 1.8 5.0 1 1 256 1 . . . . . 5.0 1.8 5.0 1 1 257 1 . . . . . 3.5 1.8 4.5 1 1 258 1 . . . . . 5.0 1.8 5.0 1 1 259 1 . . . . . 3.5 1.8 4.5 1 1 260 1 . . . . . 3.5 1.8 4.5 1 1 261 1 . . . . . 3.5 1.8 3.5 1 1 262 1 . . . . . 5.0 1.8 5.0 1 1 263 1 . . . . . 3.5 1.8 3.5 1 1 264 1 . . . . . 5.0 1.8 5.0 1 1 265 1 . . . . . 3.5 1.8 3.5 1 1 266 1 . . . . . 5.0 1.8 5.0 1 1 267 1 . . . . . 5.0 1.8 6.0 1 1 268 1 . . . . . 2.7 1.8 2.7 1 1 269 1 . . . . . 2.7 1.8 3.7 1 1 270 1 . . . . . 2.7 1.8 3.7 1 1 271 1 . . . . . 3.5 1.8 4.5 1 1 272 1 . . . . . 2.7 1.8 2.7 1 1 273 1 . . . . . 5.0 1.8 6.0 1 1 274 1 . . . . . 6.0 1.8 7.0 1 1 275 1 . . . . . 5.0 1.8 5.0 1 1 276 1 . . . . . 5.0 1.8 5.0 1 1 277 1 . . . . . 5.0 1.8 7.4 1 1 278 1 . . . . . 3.5 1.8 3.5 1 1 279 1 . . . . . 5.0 1.8 5.0 1 1 280 1 . . . . . 5.0 1.8 5.0 1 1 281 1 . . . . . 2.7 1.8 2.7 1 1 282 1 . . . . . 5.0 1.8 5.0 1 1 283 1 . . . . . 5.0 1.8 6.0 1 1 284 1 . . . . . 3.5 1.8 4.5 1 1 285 1 . . . . . 2.7 1.8 3.7 1 1 286 1 . . . . . 3.5 1.8 3.5 1 1 287 1 . . . . . 5.0 1.8 8.4 1 1 288 1 . . . . . 5.0 1.8 6.0 1 1 289 1 . . . . . 3.5 1.8 5.9 1 1 290 1 . . . . . 5.0 1.8 7.4 1 1 291 1 . . . . . 2.7 1.8 2.7 1 1 292 1 . . . . . 2.7 1.8 2.7 1 1 293 1 . . . . . 3.5 1.8 4.5 1 1 294 1 . . . . . 2.7 1.8 5.1 1 1 295 1 . . . . . 5.0 1.8 5.0 1 1 296 1 . . . . . 3.5 1.8 4.5 1 1 297 1 . . . . . 5.0 1.8 5.0 1 1 298 1 . . . . . 2.7 1.8 3.7 1 1 299 1 . . . . . 3.5 1.8 4.5 1 1 300 1 . . . . . 2.7 1.8 2.7 1 1 301 1 . . . . . 5.0 1.8 5.0 1 1 302 1 . . . . . 2.7 1.8 5.1 1 1 303 1 . . . . . 3.5 1.8 4.5 1 1 304 1 . . . . . 3.5 1.8 3.5 1 1 305 1 . . . . . 2.7 1.8 3.7 1 1 306 1 . . . . . 3.5 1.8 4.5 1 1 307 1 . . . . . 3.5 1.8 4.5 1 1 308 1 . . . . . 3.5 1.8 4.5 1 1 309 1 . . . . . 3.5 1.8 4.5 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 "general distance" _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 4 CYS SG . 4 . SG 1 2 1 1 2 1 1 19 CYS SG . 19 . SG 1 2 2 1 1 1 1 4 CYS SG . 4 . SG 1 2 2 1 2 1 1 19 CYS CB . 19 . CB 1 2 3 1 1 1 1 4 CYS CB . 4 . CB 1 2 3 1 2 1 1 19 CYS SG . 19 . SG 1 2 4 1 1 1 1 11 CYS SG . 11 . SG 1 2 4 1 2 1 1 24 CYS SG . 24 . SG 1 2 5 1 1 1 1 11 CYS SG . 11 . SG 1 2 5 1 2 1 1 24 CYS CB . 24 . CB 1 2 6 1 1 1 1 11 CYS CB . 11 . CB 1 2 6 1 2 1 1 24 CYS SG . 24 . SG 1 2 7 1 1 1 1 18 CYS SG . 18 . SG 1 2 7 1 2 1 1 31 CYS SG . 31 . SG 1 2 8 1 1 1 1 18 CYS SG . 18 . SG 1 2 8 1 2 1 1 31 CYS CB . 31 . CB 1 2 9 1 1 1 1 18 CYS CB . 18 . CB 1 2 9 1 2 1 1 31 CYS SG . 31 . 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_CNS/XPLOR_distance_constraints_4_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _Distance_constraint_list.Constraint_type "hydrogen 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 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 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 23 ALA O . 23 . O 1 3 1 1 2 1 1 32 ALA H . 32 . HN 1 3 2 1 1 1 1 23 ALA O . 23 . O 1 3 2 1 2 1 1 32 ALA N . 32 . N 1 3 3 1 1 1 1 23 ALA H . 23 . HN 1 3 3 1 2 1 1 32 ALA O . 32 . O 1 3 4 1 1 1 1 23 ALA N . 23 . N 1 3 4 1 2 1 1 32 ALA O . 32 . O 1 3 5 1 1 1 1 9 TRP O . 9 . O 1 3 5 1 2 1 1 31 CYS H . 31 . HN 1 3 6 1 1 1 1 9 TRP O . 9 . O 1 3 6 1 2 1 1 31 CYS N . 31 . N 1 3 7 1 1 1 1 9 TRP H . 9 . HN 1 3 7 1 2 1 1 31 CYS O . 31 . O 1 3 8 1 1 1 1 9 TRP N . 9 . N 1 3 8 1 2 1 1 31 CYS O . 31 . O 1 3 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 . . . . . 1.8 1.5 2.3 1 3 2 1 . . . . . 2.8 2.4 3.3 1 3 3 1 . . . . . 1.8 1.5 2.3 1 3 4 1 . . . . . 2.8 2.4 3.3 1 3 5 1 . . . . . 1.8 1.5 2.3 1 3 6 1 . . . . . 2.8 2.4 3.3 1 3 7 1 . . . . . 1.8 1.5 2.3 1 3 8 1 . . . . . 2.8 2.4 3.3 1 3 stop_ save_ save_CNS/XPLOR_dihedral_5 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 3 GLU C 1 1 4 CYS N 1 1 4 CYS CA 1 1 4 CYS C -150.0 -89.99999 . 3 . C . 4 . N . 4 . CA . 4 . C 1 1 2 . 1 1 6 GLY C 1 1 7 PHE N 1 1 7 PHE CA 1 1 7 PHE C -89.99999 -40.0 . 6 . C . 7 . N . 7 . CA . 7 . C 1 1 3 . 1 1 9 TRP C 1 1 10 LYS N 1 1 10 LYS CA 1 1 10 LYS C -150.0 -89.99999 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 4 . 1 1 10 LYS C 1 1 11 CYS N 1 1 11 CYS CA 1 1 11 CYS C -150.0 -89.99999 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 5 . 1 1 12 GLY C 1 1 13 ARG N 1 1 13 ARG CA 1 1 13 ARG C -89.99999 -40.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 6 . 1 1 17 PRO C 1 1 18 CYS N 1 1 18 CYS CA 1 1 18 CYS C -89.99999 -40.0 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 7 . 1 1 18 CYS C 1 1 19 CYS N 1 1 19 CYS CA 1 1 19 CYS C -89.99999 -40.0 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 8 . 1 1 19 CYS C 1 1 20 LYS N 1 1 20 LYS CA 1 1 20 LYS C -89.99999 -40.0 . 19 . C . 20 . N . 20 . CA . 20 . C 1 1 9 . 1 1 21 GLY C 1 1 22 TYR N 1 1 22 TYR CA 1 1 22 TYR C -150.0 -89.99999 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 10 . 1 1 22 TYR C 1 1 23 ALA N 1 1 23 ALA CA 1 1 23 ALA C -150.0 -89.99999 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 11 . 1 1 23 ALA C 1 1 24 CYS N 1 1 24 CYS CA 1 1 24 CYS C -150.0 -89.99999 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 12 . 1 1 29 GLY C 1 1 30 TRP N 1 1 30 TRP CA 1 1 30 TRP C -150.0 -89.99999 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 13 . 1 1 31 CYS C 1 1 32 ALA N 1 1 32 ALA CA 1 1 32 ALA C -150.0 -89.99999 . 31 . C . 32 . N . 32 . CA . 32 . C 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 ASP C C 12.905 9.124 -0.847 1.00 . A A . 1 ASP C 1 1 1 2 1 1 1 ASP CA C 13.469 10.547 -0.979 1.00 . A A . 1 ASP CA 1 1 1 3 1 1 1 ASP CB C 14.550 10.621 -2.074 1.00 . A A . 1 ASP CB 1 1 1 4 1 1 1 ASP CG C 15.850 9.947 -1.608 1.00 . A A . 1 ASP CG 1 1 1 5 1 1 1 ASP H1 H 14.792 11.755 0.105 1.00 . A A . 1 ASP H1 1 1 1 6 1 1 1 ASP H2 H 14.675 10.160 0.689 1.00 . A A . 1 ASP H2 1 1 1 7 1 1 1 ASP H3 H 13.422 11.269 0.980 1.00 . A A . 1 ASP H3 1 1 1 8 1 1 1 ASP HA H 12.671 11.234 -1.214 1.00 . A A . 1 ASP HA 1 1 1 9 1 1 1 ASP HB2 H 14.190 10.120 -2.963 1.00 . A A . 1 ASP HB2 1 1 1 10 1 1 1 ASP HB3 H 14.749 11.656 -2.307 1.00 . A A . 1 ASP HB3 1 1 1 11 1 1 1 ASP N N 14.142 10.964 0.295 1.00 . A A . 1 ASP N 1 1 1 12 1 1 1 ASP O O 13.315 8.211 -1.542 1.00 . A A . 1 ASP O 1 1 1 13 1 1 1 ASP OD1 O 16.648 10.618 -0.975 1.00 . A A . 1 ASP OD1 1 1 1 14 1 1 1 ASP OD2 O 16.027 8.778 -1.899 1.00 . A A . 1 ASP OD2 1 1 1 15 1 1 2 GLY C C 10.560 7.196 -1.028 1.00 . A A . 2 GLY C 1 1 1 16 1 1 2 GLY CA C 11.349 7.586 0.227 1.00 . A A . 2 GLY CA 1 1 1 17 1 1 2 GLY H H 11.645 9.691 0.582 1.00 . A A . 2 GLY H 1 1 1 18 1 1 2 GLY HA2 H 12.131 6.860 0.405 1.00 . A A . 2 GLY HA2 1 1 1 19 1 1 2 GLY HA3 H 10.680 7.608 1.075 1.00 . A A . 2 GLY HA3 1 1 1 20 1 1 2 GLY N N 11.959 8.937 0.040 1.00 . A A . 2 GLY N 1 1 1 21 1 1 2 GLY O O 9.886 8.013 -1.627 1.00 . A A . 2 GLY O 1 1 1 22 1 1 3 GLU C C 8.400 5.414 -2.356 1.00 . A A . 3 GLU C 1 1 1 23 1 1 3 GLU CA C 9.903 5.496 -2.645 1.00 . A A . 3 GLU CA 1 1 1 24 1 1 3 GLU CB C 10.468 4.110 -2.966 1.00 . A A . 3 GLU CB 1 1 1 25 1 1 3 GLU CD C 12.966 4.268 -2.906 1.00 . A A . 3 GLU CD 1 1 1 26 1 1 3 GLU CG C 11.734 4.253 -3.816 1.00 . A A . 3 GLU CG 1 1 1 27 1 1 3 GLU H H 11.194 5.314 -0.923 1.00 . A A . 3 GLU H 1 1 1 28 1 1 3 GLU HA H 10.088 6.165 -3.467 1.00 . A A . 3 GLU HA 1 1 1 29 1 1 3 GLU HB2 H 10.707 3.597 -2.046 1.00 . A A . 3 GLU HB2 1 1 1 30 1 1 3 GLU HB3 H 9.731 3.539 -3.514 1.00 . A A . 3 GLU HB3 1 1 1 31 1 1 3 GLU HG2 H 11.802 3.422 -4.503 1.00 . A A . 3 GLU HG2 1 1 1 32 1 1 3 GLU HG3 H 11.691 5.176 -4.375 1.00 . A A . 3 GLU HG3 1 1 1 33 1 1 3 GLU N N 10.644 5.951 -1.426 1.00 . A A . 3 GLU N 1 1 1 34 1 1 3 GLU O O 7.985 5.229 -1.227 1.00 . A A . 3 GLU O 1 1 1 35 1 1 3 GLU OE1 O 13.431 3.197 -2.554 1.00 . A A . 3 GLU OE1 1 1 1 36 1 1 3 GLU OE2 O 13.423 5.351 -2.578 1.00 . A A . 3 GLU OE2 1 1 1 37 1 1 4 CYS C C 5.469 4.595 -4.231 1.00 . A A . 4 CYS C 1 1 1 38 1 1 4 CYS CA C 6.107 5.489 -3.162 1.00 . A A . 4 CYS CA 1 1 1 39 1 1 4 CYS CB C 5.630 6.948 -3.263 1.00 . A A . 4 CYS CB 1 1 1 40 1 1 4 CYS H H 7.943 5.706 -4.269 1.00 . A A . 4 CYS H 1 1 1 41 1 1 4 CYS HA H 5.891 5.101 -2.178 1.00 . A A . 4 CYS HA 1 1 1 42 1 1 4 CYS HB2 H 5.265 7.265 -2.301 1.00 . A A . 4 CYS HB2 1 1 1 43 1 1 4 CYS HB3 H 6.462 7.571 -3.550 1.00 . A A . 4 CYS HB3 1 1 1 44 1 1 4 CYS N N 7.584 5.554 -3.370 1.00 . A A . 4 CYS N 1 1 1 45 1 1 4 CYS O O 5.990 4.441 -5.320 1.00 . A A . 4 CYS O 1 1 1 46 1 1 4 CYS SG S 4.302 7.124 -4.487 1.00 . A A . 4 CYS SG 1 1 1 47 1 1 5 GLY C C 2.651 3.914 -5.712 1.00 . A A . 5 GLY C 1 1 1 48 1 1 5 GLY CA C 3.664 3.108 -4.896 1.00 . A A . 5 GLY CA 1 1 1 49 1 1 5 GLY H H 3.955 4.142 -3.034 1.00 . A A . 5 GLY H 1 1 1 50 1 1 5 GLY HA2 H 4.400 2.674 -5.559 1.00 . A A . 5 GLY HA2 1 1 1 51 1 1 5 GLY HA3 H 3.151 2.323 -4.364 1.00 . A A . 5 GLY HA3 1 1 1 52 1 1 5 GLY N N 4.347 4.002 -3.918 1.00 . A A . 5 GLY N 1 1 1 53 1 1 5 GLY O O 3.003 4.839 -6.419 1.00 . A A . 5 GLY O 1 1 1 54 1 1 6 GLY C C -0.955 4.309 -5.565 1.00 . A A . 6 GLY C 1 1 1 55 1 1 6 GLY CA C 0.343 4.304 -6.375 1.00 . A A . 6 GLY CA 1 1 1 56 1 1 6 GLY H H 1.139 2.816 -5.037 1.00 . A A . 6 GLY H 1 1 1 57 1 1 6 GLY HA2 H 0.670 5.320 -6.545 1.00 . A A . 6 GLY HA2 1 1 1 58 1 1 6 GLY HA3 H 0.174 3.817 -7.322 1.00 . A A . 6 GLY HA3 1 1 1 59 1 1 6 GLY N N 1.394 3.566 -5.615 1.00 . A A . 6 GLY N 1 1 1 60 1 1 6 GLY O O -0.936 4.402 -4.353 1.00 . A A . 6 GLY O 1 1 1 61 1 1 7 PHE C C -3.790 2.762 -5.119 1.00 . A A . 7 PHE C 1 1 1 62 1 1 7 PHE CA C -3.384 4.195 -5.482 1.00 . A A . 7 PHE CA 1 1 1 63 1 1 7 PHE CB C -4.403 4.822 -6.439 1.00 . A A . 7 PHE CB 1 1 1 64 1 1 7 PHE CD1 C -5.933 5.370 -4.501 1.00 . A A . 7 PHE CD1 1 1 1 65 1 1 7 PHE CD2 C -6.876 4.319 -6.474 1.00 . A A . 7 PHE CD2 1 1 1 66 1 1 7 PHE CE1 C -7.198 5.380 -3.902 1.00 . A A . 7 PHE CE1 1 1 1 67 1 1 7 PHE CE2 C -8.141 4.330 -5.873 1.00 . A A . 7 PHE CE2 1 1 1 68 1 1 7 PHE CG C -5.771 4.839 -5.789 1.00 . A A . 7 PHE CG 1 1 1 69 1 1 7 PHE CZ C -8.302 4.859 -4.588 1.00 . A A . 7 PHE CZ 1 1 1 70 1 1 7 PHE H H -2.076 4.121 -7.199 1.00 . A A . 7 PHE H 1 1 1 71 1 1 7 PHE HA H -3.307 4.792 -4.592 1.00 . A A . 7 PHE HA 1 1 1 72 1 1 7 PHE HB2 H -4.102 5.833 -6.672 1.00 . A A . 7 PHE HB2 1 1 1 73 1 1 7 PHE HB3 H -4.445 4.241 -7.350 1.00 . A A . 7 PHE HB3 1 1 1 74 1 1 7 PHE HD1 H -5.082 5.771 -3.970 1.00 . A A . 7 PHE HD1 1 1 1 75 1 1 7 PHE HD2 H -6.752 3.911 -7.465 1.00 . A A . 7 PHE HD2 1 1 1 76 1 1 7 PHE HE1 H -7.323 5.788 -2.909 1.00 . A A . 7 PHE HE1 1 1 1 77 1 1 7 PHE HE2 H -8.992 3.930 -6.403 1.00 . A A . 7 PHE HE2 1 1 1 78 1 1 7 PHE HZ H -9.278 4.868 -4.126 1.00 . A A . 7 PHE HZ 1 1 1 79 1 1 7 PHE N N -2.084 4.202 -6.222 1.00 . A A . 7 PHE N 1 1 1 80 1 1 7 PHE O O -4.326 2.515 -4.059 1.00 . A A . 7 PHE O 1 1 1 81 1 1 8 TRP C C -2.814 -0.532 -6.221 1.00 . A A . 8 TRP C 1 1 1 82 1 1 8 TRP CA C -3.912 0.406 -5.707 1.00 . A A . 8 TRP CA 1 1 1 83 1 1 8 TRP CB C -5.229 0.183 -6.457 1.00 . A A . 8 TRP CB 1 1 1 84 1 1 8 TRP CD1 C -6.870 0.805 -4.638 1.00 . A A . 8 TRP CD1 1 1 1 85 1 1 8 TRP CD2 C -7.017 -1.358 -5.235 1.00 . A A . 8 TRP CD2 1 1 1 86 1 1 8 TRP CE2 C -7.981 -1.150 -4.221 1.00 . A A . 8 TRP CE2 1 1 1 87 1 1 8 TRP CE3 C -6.904 -2.647 -5.786 1.00 . A A . 8 TRP CE3 1 1 1 88 1 1 8 TRP CG C -6.325 -0.101 -5.481 1.00 . A A . 8 TRP CG 1 1 1 89 1 1 8 TRP CH2 C -8.677 -3.457 -4.330 1.00 . A A . 8 TRP CH2 1 1 1 90 1 1 8 TRP CZ2 C -8.803 -2.182 -3.771 1.00 . A A . 8 TRP CZ2 1 1 1 91 1 1 8 TRP CZ3 C -7.729 -3.689 -5.336 1.00 . A A . 8 TRP CZ3 1 1 1 92 1 1 8 TRP H H -3.110 2.052 -6.843 1.00 . A A . 8 TRP H 1 1 1 93 1 1 8 TRP HA H -4.061 0.263 -4.648 1.00 . A A . 8 TRP HA 1 1 1 94 1 1 8 TRP HB2 H -5.476 1.070 -7.023 1.00 . A A . 8 TRP HB2 1 1 1 95 1 1 8 TRP HB3 H -5.123 -0.654 -7.131 1.00 . A A . 8 TRP HB3 1 1 1 96 1 1 8 TRP HD1 H -6.584 1.843 -4.562 1.00 . A A . 8 TRP HD1 1 1 1 97 1 1 8 TRP HE1 H -8.400 0.619 -3.202 1.00 . A A . 8 TRP HE1 1 1 1 98 1 1 8 TRP HE3 H -6.176 -2.836 -6.563 1.00 . A A . 8 TRP HE3 1 1 1 99 1 1 8 TRP HH2 H -9.310 -4.262 -3.988 1.00 . A A . 8 TRP HH2 1 1 1 100 1 1 8 TRP HZ2 H -9.532 -1.998 -2.995 1.00 . A A . 8 TRP HZ2 1 1 1 101 1 1 8 TRP HZ3 H -7.634 -4.674 -5.768 1.00 . A A . 8 TRP HZ3 1 1 1 102 1 1 8 TRP N N -3.541 1.824 -5.993 1.00 . A A . 8 TRP N 1 1 1 103 1 1 8 TRP NE1 N -7.852 0.185 -3.888 1.00 . A A . 8 TRP NE1 1 1 1 104 1 1 8 TRP O O -2.993 -1.248 -7.191 1.00 . A A . 8 TRP O 1 1 1 105 1 1 9 TRP C C -0.547 -2.700 -5.195 1.00 . A A . 9 TRP C 1 1 1 106 1 1 9 TRP CA C -0.552 -1.414 -6.024 1.00 . A A . 9 TRP CA 1 1 1 107 1 1 9 TRP CB C 0.722 -0.600 -5.779 1.00 . A A . 9 TRP CB 1 1 1 108 1 1 9 TRP CD1 C -0.130 1.016 -7.541 1.00 . A A . 9 TRP CD1 1 1 1 109 1 1 9 TRP CD2 C 2.114 1.006 -7.386 1.00 . A A . 9 TRP CD2 1 1 1 110 1 1 9 TRP CE2 C 1.777 1.943 -8.391 1.00 . A A . 9 TRP CE2 1 1 1 111 1 1 9 TRP CE3 C 3.476 0.810 -7.095 1.00 . A A . 9 TRP CE3 1 1 1 112 1 1 9 TRP CG C 0.885 0.429 -6.859 1.00 . A A . 9 TRP CG 1 1 1 113 1 1 9 TRP CH2 C 4.100 2.457 -8.777 1.00 . A A . 9 TRP CH2 1 1 1 114 1 1 9 TRP CZ2 C 2.752 2.661 -9.079 1.00 . A A . 9 TRP CZ2 1 1 1 115 1 1 9 TRP CZ3 C 4.461 1.532 -7.788 1.00 . A A . 9 TRP CZ3 1 1 1 116 1 1 9 TRP H H -1.554 0.059 -4.798 1.00 . A A . 9 TRP H 1 1 1 117 1 1 9 TRP HA H -0.650 -1.644 -7.073 1.00 . A A . 9 TRP HA 1 1 1 118 1 1 9 TRP HB2 H 0.656 -0.105 -4.821 1.00 . A A . 9 TRP HB2 1 1 1 119 1 1 9 TRP HB3 H 1.577 -1.260 -5.783 1.00 . A A . 9 TRP HB3 1 1 1 120 1 1 9 TRP HD1 H -1.180 0.816 -7.401 1.00 . A A . 9 TRP HD1 1 1 1 121 1 1 9 TRP HE1 H -0.121 2.467 -9.064 1.00 . A A . 9 TRP HE1 1 1 1 122 1 1 9 TRP HE3 H 3.765 0.101 -6.334 1.00 . A A . 9 TRP HE3 1 1 1 123 1 1 9 TRP HH2 H 4.861 3.007 -9.306 1.00 . A A . 9 TRP HH2 1 1 1 124 1 1 9 TRP HZ2 H 2.466 3.374 -9.837 1.00 . A A . 9 TRP HZ2 1 1 1 125 1 1 9 TRP HZ3 H 5.504 1.377 -7.556 1.00 . A A . 9 TRP HZ3 1 1 1 126 1 1 9 TRP N N -1.673 -0.529 -5.577 1.00 . A A . 9 TRP N 1 1 1 127 1 1 9 TRP NE1 N 0.401 1.911 -8.448 1.00 . A A . 9 TRP NE1 1 1 1 128 1 1 9 TRP O O -1.205 -2.788 -4.182 1.00 . A A . 9 TRP O 1 1 1 129 1 1 10 LYS C C 1.355 -4.988 -3.838 1.00 . A A . 10 LYS C 1 1 1 130 1 1 10 LYS CA C 0.204 -4.982 -4.844 1.00 . A A . 10 LYS CA 1 1 1 131 1 1 10 LYS CB C 0.413 -6.084 -5.880 1.00 . A A . 10 LYS CB 1 1 1 132 1 1 10 LYS CD C -1.102 -6.603 -7.804 1.00 . A A . 10 LYS CD 1 1 1 133 1 1 10 LYS CE C -2.468 -7.170 -8.205 1.00 . A A . 10 LYS CE 1 1 1 134 1 1 10 LYS CG C -0.943 -6.673 -6.283 1.00 . A A . 10 LYS CG 1 1 1 135 1 1 10 LYS H H 0.701 -3.617 -6.445 1.00 . A A . 10 LYS H 1 1 1 136 1 1 10 LYS HA H -0.737 -5.129 -4.336 1.00 . A A . 10 LYS HA 1 1 1 137 1 1 10 LYS HB2 H 0.904 -5.670 -6.749 1.00 . A A . 10 LYS HB2 1 1 1 138 1 1 10 LYS HB3 H 1.030 -6.863 -5.454 1.00 . A A . 10 LYS HB3 1 1 1 139 1 1 10 LYS HD2 H -1.031 -5.574 -8.124 1.00 . A A . 10 LYS HD2 1 1 1 140 1 1 10 LYS HD3 H -0.321 -7.182 -8.275 1.00 . A A . 10 LYS HD3 1 1 1 141 1 1 10 LYS HE2 H -3.210 -6.926 -7.458 1.00 . A A . 10 LYS HE2 1 1 1 142 1 1 10 LYS HE3 H -2.765 -6.787 -9.169 1.00 . A A . 10 LYS HE3 1 1 1 143 1 1 10 LYS HG2 H -0.994 -7.704 -5.961 1.00 . A A . 10 LYS HG2 1 1 1 144 1 1 10 LYS HG3 H -1.734 -6.110 -5.813 1.00 . A A . 10 LYS HG3 1 1 1 145 1 1 10 LYS HZ1 H -1.482 -8.861 -8.925 1.00 . A A . 10 LYS HZ1 1 1 1 146 1 1 10 LYS HZ2 H -3.141 -9.092 -8.642 1.00 . A A . 10 LYS HZ2 1 1 1 147 1 1 10 LYS HZ3 H -2.057 -9.020 -7.338 1.00 . A A . 10 LYS HZ3 1 1 1 148 1 1 10 LYS N N 0.179 -3.702 -5.620 1.00 . A A . 10 LYS N 1 1 1 149 1 1 10 LYS NZ N -2.272 -8.648 -8.284 1.00 . A A . 10 LYS NZ 1 1 1 150 1 1 10 LYS O O 2.473 -4.631 -4.159 1.00 . A A . 10 LYS O 1 1 1 151 1 1 11 CYS C C 1.887 -6.558 -0.572 1.00 . A A . 11 CYS C 1 1 1 152 1 1 11 CYS CA C 2.168 -5.451 -1.599 1.00 . A A . 11 CYS CA 1 1 1 153 1 1 11 CYS CB C 2.149 -4.072 -0.932 1.00 . A A . 11 CYS CB 1 1 1 154 1 1 11 CYS H H 0.182 -5.695 -2.397 1.00 . A A . 11 CYS H 1 1 1 155 1 1 11 CYS HA H 3.119 -5.616 -2.079 1.00 . A A . 11 CYS HA 1 1 1 156 1 1 11 CYS HB2 H 2.972 -3.998 -0.238 1.00 . A A . 11 CYS HB2 1 1 1 157 1 1 11 CYS HB3 H 2.248 -3.306 -1.688 1.00 . A A . 11 CYS HB3 1 1 1 158 1 1 11 CYS N N 1.088 -5.403 -2.627 1.00 . A A . 11 CYS N 1 1 1 159 1 1 11 CYS O O 0.760 -6.994 -0.409 1.00 . A A . 11 CYS O 1 1 1 160 1 1 11 CYS SG S 0.590 -3.842 -0.044 1.00 . A A . 11 CYS SG 1 1 1 161 1 1 12 GLY C C 2.309 -7.447 2.484 1.00 . A A . 12 GLY C 1 1 1 162 1 1 12 GLY CA C 2.701 -8.083 1.147 1.00 . A A . 12 GLY CA 1 1 1 163 1 1 12 GLY H H 3.798 -6.639 -0.021 1.00 . A A . 12 GLY H 1 1 1 164 1 1 12 GLY HA2 H 1.915 -8.751 0.821 1.00 . A A . 12 GLY HA2 1 1 1 165 1 1 12 GLY HA3 H 3.618 -8.637 1.271 1.00 . A A . 12 GLY HA3 1 1 1 166 1 1 12 GLY N N 2.902 -7.010 0.126 1.00 . A A . 12 GLY N 1 1 1 167 1 1 12 GLY O O 1.272 -6.822 2.602 1.00 . A A . 12 GLY O 1 1 1 168 1 1 13 ARG C C 3.418 -5.567 4.908 1.00 . A A . 13 ARG C 1 1 1 169 1 1 13 ARG CA C 2.826 -6.984 4.824 1.00 . A A . 13 ARG CA 1 1 1 170 1 1 13 ARG CB C 3.500 -7.903 5.850 1.00 . A A . 13 ARG CB 1 1 1 171 1 1 13 ARG CD C 3.077 -10.292 5.208 1.00 . A A . 13 ARG CD 1 1 1 172 1 1 13 ARG CG C 2.626 -9.135 6.107 1.00 . A A . 13 ARG CG 1 1 1 173 1 1 13 ARG CZ C 5.313 -11.191 4.943 1.00 . A A . 13 ARG CZ 1 1 1 174 1 1 13 ARG H H 3.971 -8.093 3.365 1.00 . A A . 13 ARG H 1 1 1 175 1 1 13 ARG HA H 1.758 -6.960 4.990 1.00 . A A . 13 ARG HA 1 1 1 176 1 1 13 ARG HB2 H 4.463 -8.215 5.475 1.00 . A A . 13 ARG HB2 1 1 1 177 1 1 13 ARG HB3 H 3.636 -7.365 6.777 1.00 . A A . 13 ARG HB3 1 1 1 178 1 1 13 ARG HD2 H 2.367 -11.106 5.263 1.00 . A A . 13 ARG HD2 1 1 1 179 1 1 13 ARG HD3 H 3.185 -9.956 4.189 1.00 . A A . 13 ARG HD3 1 1 1 180 1 1 13 ARG HE H 4.584 -10.648 6.711 1.00 . A A . 13 ARG HE 1 1 1 181 1 1 13 ARG HG2 H 2.718 -9.428 7.143 1.00 . A A . 13 ARG HG2 1 1 1 182 1 1 13 ARG HG3 H 1.598 -8.897 5.892 1.00 . A A . 13 ARG HG3 1 1 1 183 1 1 13 ARG HH11 H 4.598 -13.064 4.982 1.00 . A A . 13 ARG HH11 1 1 1 184 1 1 13 ARG HH12 H 6.003 -12.820 3.998 1.00 . A A . 13 ARG HH12 1 1 1 185 1 1 13 ARG HH21 H 6.245 -9.432 4.720 1.00 . A A . 13 ARG HH21 1 1 1 186 1 1 13 ARG HH22 H 6.938 -10.759 3.850 1.00 . A A . 13 ARG HH22 1 1 1 187 1 1 13 ARG N N 3.138 -7.593 3.490 1.00 . A A . 13 ARG N 1 1 1 188 1 1 13 ARG NE N 4.399 -10.719 5.750 1.00 . A A . 13 ARG NE 1 1 1 189 1 1 13 ARG NH1 N 5.304 -12.457 4.615 1.00 . A A . 13 ARG NH1 1 1 1 190 1 1 13 ARG NH2 N 6.237 -10.399 4.466 1.00 . A A . 13 ARG NH2 1 1 1 191 1 1 13 ARG O O 3.780 -5.101 5.974 1.00 . A A . 13 ARG O 1 1 1 192 1 1 14 GLY C C 5.566 -3.581 3.326 1.00 . A A . 14 GLY C 1 1 1 193 1 1 14 GLY CA C 4.110 -3.514 3.797 1.00 . A A . 14 GLY CA 1 1 1 194 1 1 14 GLY H H 3.242 -5.286 2.946 1.00 . A A . 14 GLY H 1 1 1 195 1 1 14 GLY HA2 H 3.544 -2.881 3.128 1.00 . A A . 14 GLY HA2 1 1 1 196 1 1 14 GLY HA3 H 4.076 -3.108 4.795 1.00 . A A . 14 GLY HA3 1 1 1 197 1 1 14 GLY N N 3.531 -4.888 3.793 1.00 . A A . 14 GLY N 1 1 1 198 1 1 14 GLY O O 6.425 -2.889 3.840 1.00 . A A . 14 GLY O 1 1 1 199 1 1 15 LYS C C 7.623 -3.305 0.991 1.00 . A A . 15 LYS C 1 1 1 200 1 1 15 LYS CA C 7.254 -4.531 1.842 1.00 . A A . 15 LYS CA 1 1 1 201 1 1 15 LYS CB C 7.287 -5.815 1.003 1.00 . A A . 15 LYS CB 1 1 1 202 1 1 15 LYS CD C 9.522 -6.727 0.345 1.00 . A A . 15 LYS CD 1 1 1 203 1 1 15 LYS CE C 10.876 -6.288 0.914 1.00 . A A . 15 LYS CE 1 1 1 204 1 1 15 LYS CG C 8.462 -6.689 1.450 1.00 . A A . 15 LYS CG 1 1 1 205 1 1 15 LYS H H 5.140 -4.963 1.954 1.00 . A A . 15 LYS H 1 1 1 206 1 1 15 LYS HA H 7.936 -4.622 2.668 1.00 . A A . 15 LYS HA 1 1 1 207 1 1 15 LYS HB2 H 6.362 -6.359 1.137 1.00 . A A . 15 LYS HB2 1 1 1 208 1 1 15 LYS HB3 H 7.408 -5.562 -0.038 1.00 . A A . 15 LYS HB3 1 1 1 209 1 1 15 LYS HD2 H 9.603 -7.734 -0.038 1.00 . A A . 15 LYS HD2 1 1 1 210 1 1 15 LYS HD3 H 9.236 -6.061 -0.454 1.00 . A A . 15 LYS HD3 1 1 1 211 1 1 15 LYS HE2 H 11.010 -6.688 1.911 1.00 . A A . 15 LYS HE2 1 1 1 212 1 1 15 LYS HE3 H 11.678 -6.612 0.269 1.00 . A A . 15 LYS HE3 1 1 1 213 1 1 15 LYS HG2 H 8.894 -6.277 2.351 1.00 . A A . 15 LYS HG2 1 1 1 214 1 1 15 LYS HG3 H 8.112 -7.690 1.644 1.00 . A A . 15 LYS HG3 1 1 1 215 1 1 15 LYS HZ1 H 10.156 -4.491 1.691 1.00 . A A . 15 LYS HZ1 1 1 1 216 1 1 15 LYS HZ2 H 10.514 -4.433 0.030 1.00 . A A . 15 LYS HZ2 1 1 1 217 1 1 15 LYS HZ3 H 11.769 -4.424 1.174 1.00 . A A . 15 LYS HZ3 1 1 1 218 1 1 15 LYS N N 5.851 -4.415 2.351 1.00 . A A . 15 LYS N 1 1 1 219 1 1 15 LYS NZ N 10.824 -4.796 0.955 1.00 . A A . 15 LYS NZ 1 1 1 220 1 1 15 LYS O O 8.576 -2.615 1.297 1.00 . A A . 15 LYS O 1 1 1 221 1 1 16 PRO C C 6.674 -0.603 -0.226 1.00 . A A . 16 PRO C 1 1 1 222 1 1 16 PRO CA C 7.104 -1.900 -0.928 1.00 . A A . 16 PRO CA 1 1 1 223 1 1 16 PRO CB C 6.234 -2.177 -2.151 1.00 . A A . 16 PRO CB 1 1 1 224 1 1 16 PRO CD C 5.682 -3.840 -0.482 1.00 . A A . 16 PRO CD 1 1 1 225 1 1 16 PRO CG C 5.138 -3.068 -1.658 1.00 . A A . 16 PRO CG 1 1 1 226 1 1 16 PRO HA H 8.143 -1.858 -1.213 1.00 . A A . 16 PRO HA 1 1 1 227 1 1 16 PRO HB2 H 5.825 -1.253 -2.537 1.00 . A A . 16 PRO HB2 1 1 1 228 1 1 16 PRO HB3 H 6.805 -2.682 -2.914 1.00 . A A . 16 PRO HB3 1 1 1 229 1 1 16 PRO HD2 H 4.946 -3.895 0.307 1.00 . A A . 16 PRO HD2 1 1 1 230 1 1 16 PRO HD3 H 5.989 -4.827 -0.786 1.00 . A A . 16 PRO HD3 1 1 1 231 1 1 16 PRO HG2 H 4.291 -2.472 -1.350 1.00 . A A . 16 PRO HG2 1 1 1 232 1 1 16 PRO HG3 H 4.843 -3.754 -2.436 1.00 . A A . 16 PRO HG3 1 1 1 233 1 1 16 PRO N N 6.849 -3.063 -0.044 1.00 . A A . 16 PRO N 1 1 1 234 1 1 16 PRO O O 5.611 -0.551 0.367 1.00 . A A . 16 PRO O 1 1 1 235 1 1 17 PRO C C 6.095 2.433 -0.416 1.00 . A A . 17 PRO C 1 1 1 236 1 1 17 PRO CA C 7.210 1.700 0.340 1.00 . A A . 17 PRO CA 1 1 1 237 1 1 17 PRO CB C 8.528 2.466 0.244 1.00 . A A . 17 PRO CB 1 1 1 238 1 1 17 PRO CD C 8.812 0.423 -1.004 1.00 . A A . 17 PRO CD 1 1 1 239 1 1 17 PRO CG C 9.240 1.866 -0.925 1.00 . A A . 17 PRO CG 1 1 1 240 1 1 17 PRO HA H 6.941 1.556 1.374 1.00 . A A . 17 PRO HA 1 1 1 241 1 1 17 PRO HB2 H 8.338 3.517 0.074 1.00 . A A . 17 PRO HB2 1 1 1 242 1 1 17 PRO HB3 H 9.109 2.330 1.142 1.00 . A A . 17 PRO HB3 1 1 1 243 1 1 17 PRO HD2 H 8.698 0.119 -2.036 1.00 . A A . 17 PRO HD2 1 1 1 244 1 1 17 PRO HD3 H 9.518 -0.214 -0.495 1.00 . A A . 17 PRO HD3 1 1 1 245 1 1 17 PRO HG2 H 8.963 2.389 -1.831 1.00 . A A . 17 PRO HG2 1 1 1 246 1 1 17 PRO HG3 H 10.308 1.922 -0.778 1.00 . A A . 17 PRO HG3 1 1 1 247 1 1 17 PRO N N 7.516 0.399 -0.308 1.00 . A A . 17 PRO N 1 1 1 248 1 1 17 PRO O O 6.311 2.971 -1.485 1.00 . A A . 17 PRO O 1 1 1 249 1 1 18 CYS C C 3.956 4.687 -0.404 1.00 . A A . 18 CYS C 1 1 1 250 1 1 18 CYS CA C 3.779 3.168 -0.548 1.00 . A A . 18 CYS CA 1 1 1 251 1 1 18 CYS CB C 2.501 2.701 0.165 1.00 . A A . 18 CYS CB 1 1 1 252 1 1 18 CYS H H 4.756 2.023 0.997 1.00 . A A . 18 CYS H 1 1 1 253 1 1 18 CYS HA H 3.740 2.893 -1.589 1.00 . A A . 18 CYS HA 1 1 1 254 1 1 18 CYS HB2 H 2.587 2.889 1.224 1.00 . A A . 18 CYS HB2 1 1 1 255 1 1 18 CYS HB3 H 1.652 3.240 -0.229 1.00 . A A . 18 CYS HB3 1 1 1 256 1 1 18 CYS N N 4.905 2.461 0.135 1.00 . A A . 18 CYS N 1 1 1 257 1 1 18 CYS O O 4.878 5.151 0.241 1.00 . A A . 18 CYS O 1 1 1 258 1 1 18 CYS SG S 2.261 0.931 -0.111 1.00 . A A . 18 CYS SG 1 1 1 259 1 1 19 CYS C C 2.637 7.450 0.423 1.00 . A A . 19 CYS C 1 1 1 260 1 1 19 CYS CA C 3.225 6.950 -0.905 1.00 . A A . 19 CYS CA 1 1 1 261 1 1 19 CYS CB C 2.446 7.527 -2.098 1.00 . A A . 19 CYS CB 1 1 1 262 1 1 19 CYS H H 2.358 5.068 -1.524 1.00 . A A . 19 CYS H 1 1 1 263 1 1 19 CYS HA H 4.262 7.233 -0.976 1.00 . A A . 19 CYS HA 1 1 1 264 1 1 19 CYS HB2 H 1.401 7.596 -1.843 1.00 . A A . 19 CYS HB2 1 1 1 265 1 1 19 CYS HB3 H 2.823 8.512 -2.327 1.00 . A A . 19 CYS HB3 1 1 1 266 1 1 19 CYS N N 3.091 5.461 -1.005 1.00 . A A . 19 CYS N 1 1 1 267 1 1 19 CYS O O 1.883 6.755 1.078 1.00 . A A . 19 CYS O 1 1 1 268 1 1 19 CYS SG S 2.638 6.456 -3.552 1.00 . A A . 19 CYS SG 1 1 1 269 1 1 20 LYS C C 0.938 9.205 2.118 1.00 . A A . 20 LYS C 1 1 1 270 1 1 20 LYS CA C 2.472 9.204 2.114 1.00 . A A . 20 LYS CA 1 1 1 271 1 1 20 LYS CB C 3.014 10.638 2.187 1.00 . A A . 20 LYS CB 1 1 1 272 1 1 20 LYS CD C 2.840 12.609 3.717 1.00 . A A . 20 LYS CD 1 1 1 273 1 1 20 LYS CE C 2.546 13.018 5.165 1.00 . A A . 20 LYS CE 1 1 1 274 1 1 20 LYS CG C 3.051 11.096 3.648 1.00 . A A . 20 LYS CG 1 1 1 275 1 1 20 LYS H H 3.609 9.180 0.288 1.00 . A A . 20 LYS H 1 1 1 276 1 1 20 LYS HA H 2.850 8.630 2.940 1.00 . A A . 20 LYS HA 1 1 1 277 1 1 20 LYS HB2 H 4.013 10.667 1.775 1.00 . A A . 20 LYS HB2 1 1 1 278 1 1 20 LYS HB3 H 2.372 11.296 1.622 1.00 . A A . 20 LYS HB3 1 1 1 279 1 1 20 LYS HD2 H 3.731 13.114 3.373 1.00 . A A . 20 LYS HD2 1 1 1 280 1 1 20 LYS HD3 H 2.003 12.885 3.092 1.00 . A A . 20 LYS HD3 1 1 1 281 1 1 20 LYS HE2 H 1.766 12.392 5.579 1.00 . A A . 20 LYS HE2 1 1 1 282 1 1 20 LYS HE3 H 3.440 12.952 5.763 1.00 . A A . 20 LYS HE3 1 1 1 283 1 1 20 LYS HG2 H 2.270 10.596 4.201 1.00 . A A . 20 LYS HG2 1 1 1 284 1 1 20 LYS HG3 H 4.012 10.849 4.078 1.00 . A A . 20 LYS HG3 1 1 1 285 1 1 20 LYS HZ1 H 2.013 14.829 6.045 1.00 . A A . 20 LYS HZ1 1 1 1 286 1 1 20 LYS HZ2 H 1.156 14.473 4.623 1.00 . A A . 20 LYS HZ2 1 1 1 287 1 1 20 LYS HZ3 H 2.772 14.992 4.538 1.00 . A A . 20 LYS HZ3 1 1 1 288 1 1 20 LYS N N 2.993 8.649 0.827 1.00 . A A . 20 LYS N 1 1 1 289 1 1 20 LYS NZ N 2.087 14.435 5.086 1.00 . A A . 20 LYS NZ 1 1 1 290 1 1 20 LYS O O 0.308 9.734 1.220 1.00 . A A . 20 LYS O 1 1 1 291 1 1 21 GLY C C -1.667 7.191 2.702 1.00 . A A . 21 GLY C 1 1 1 292 1 1 21 GLY CA C -1.159 8.561 3.179 1.00 . A A . 21 GLY CA 1 1 1 293 1 1 21 GLY H H 0.864 8.181 3.823 1.00 . A A . 21 GLY H 1 1 1 294 1 1 21 GLY HA2 H -1.478 8.729 4.196 1.00 . A A . 21 GLY HA2 1 1 1 295 1 1 21 GLY HA3 H -1.568 9.332 2.543 1.00 . A A . 21 GLY HA3 1 1 1 296 1 1 21 GLY N N 0.335 8.606 3.117 1.00 . A A . 21 GLY N 1 1 1 297 1 1 21 GLY O O -2.791 6.812 2.978 1.00 . A A . 21 GLY O 1 1 1 298 1 1 22 TYR C C -0.843 4.009 2.464 1.00 . A A . 22 TYR C 1 1 1 299 1 1 22 TYR CA C -1.289 5.107 1.489 1.00 . A A . 22 TYR CA 1 1 1 300 1 1 22 TYR CB C -0.592 4.936 0.136 1.00 . A A . 22 TYR CB 1 1 1 301 1 1 22 TYR CD1 C -0.723 7.290 -0.777 1.00 . A A . 22 TYR CD1 1 1 1 302 1 1 22 TYR CD2 C -2.030 5.550 -1.844 1.00 . A A . 22 TYR CD2 1 1 1 303 1 1 22 TYR CE1 C -1.220 8.225 -1.691 1.00 . A A . 22 TYR CE1 1 1 1 304 1 1 22 TYR CE2 C -2.527 6.487 -2.758 1.00 . A A . 22 TYR CE2 1 1 1 305 1 1 22 TYR CG C -1.127 5.950 -0.852 1.00 . A A . 22 TYR CG 1 1 1 306 1 1 22 TYR CZ C -2.122 7.824 -2.681 1.00 . A A . 22 TYR CZ 1 1 1 307 1 1 22 TYR H H 0.044 6.773 1.775 1.00 . A A . 22 TYR H 1 1 1 308 1 1 22 TYR HA H -2.359 5.081 1.358 1.00 . A A . 22 TYR HA 1 1 1 309 1 1 22 TYR HB2 H 0.471 5.082 0.259 1.00 . A A . 22 TYR HB2 1 1 1 310 1 1 22 TYR HB3 H -0.774 3.940 -0.240 1.00 . A A . 22 TYR HB3 1 1 1 311 1 1 22 TYR HD1 H -0.027 7.602 -0.014 1.00 . A A . 22 TYR HD1 1 1 1 312 1 1 22 TYR HD2 H -2.345 4.518 -1.904 1.00 . A A . 22 TYR HD2 1 1 1 313 1 1 22 TYR HE1 H -0.909 9.257 -1.631 1.00 . A A . 22 TYR HE1 1 1 1 314 1 1 22 TYR HE2 H -3.223 6.179 -3.522 1.00 . A A . 22 TYR HE2 1 1 1 315 1 1 22 TYR HH H -3.486 9.014 -3.287 1.00 . A A . 22 TYR HH 1 1 1 316 1 1 22 TYR N N -0.854 6.448 1.989 1.00 . A A . 22 TYR N 1 1 1 317 1 1 22 TYR O O 0.232 4.070 3.031 1.00 . A A . 22 TYR O 1 1 1 318 1 1 22 TYR OH O -2.613 8.747 -3.582 1.00 . A A . 22 TYR OH 1 1 1 319 1 1 23 ALA C C -1.374 0.544 2.870 1.00 . A A . 23 ALA C 1 1 1 320 1 1 23 ALA CA C -1.295 1.893 3.591 1.00 . A A . 23 ALA CA 1 1 1 321 1 1 23 ALA CB C -2.329 1.960 4.717 1.00 . A A . 23 ALA CB 1 1 1 322 1 1 23 ALA H H -2.521 2.978 2.187 1.00 . A A . 23 ALA H 1 1 1 323 1 1 23 ALA HA H -0.305 2.049 3.993 1.00 . A A . 23 ALA HA 1 1 1 324 1 1 23 ALA HB1 H -3.203 1.390 4.437 1.00 . A A . 23 ALA HB1 1 1 1 325 1 1 23 ALA HB2 H -2.610 2.988 4.888 1.00 . A A . 23 ALA HB2 1 1 1 326 1 1 23 ALA HB3 H -1.906 1.547 5.620 1.00 . A A . 23 ALA HB3 1 1 1 327 1 1 23 ALA N N -1.662 3.004 2.658 1.00 . A A . 23 ALA N 1 1 1 328 1 1 23 ALA O O -2.266 0.308 2.076 1.00 . A A . 23 ALA O 1 1 1 329 1 1 24 CYS C C -1.292 -2.673 3.297 1.00 . A A . 24 CYS C 1 1 1 330 1 1 24 CYS CA C -0.462 -1.682 2.475 1.00 . A A . 24 CYS CA 1 1 1 331 1 1 24 CYS CB C 1.004 -2.120 2.415 1.00 . A A . 24 CYS CB 1 1 1 332 1 1 24 CYS H H 0.258 -0.126 3.788 1.00 . A A . 24 CYS H 1 1 1 333 1 1 24 CYS HA H -0.861 -1.599 1.477 1.00 . A A . 24 CYS HA 1 1 1 334 1 1 24 CYS HB2 H 1.531 -1.505 1.701 1.00 . A A . 24 CYS HB2 1 1 1 335 1 1 24 CYS HB3 H 1.452 -2.004 3.390 1.00 . A A . 24 CYS HB3 1 1 1 336 1 1 24 CYS N N -0.448 -0.342 3.143 1.00 . A A . 24 CYS N 1 1 1 337 1 1 24 CYS O O -1.528 -2.475 4.475 1.00 . A A . 24 CYS O 1 1 1 338 1 1 24 CYS SG S 1.115 -3.854 1.905 1.00 . A A . 24 CYS SG 1 1 1 339 1 1 25 SER C C -2.162 -6.164 3.029 1.00 . A A . 25 SER C 1 1 1 340 1 1 25 SER CA C -2.568 -4.737 3.408 1.00 . A A . 25 SER CA 1 1 1 341 1 1 25 SER CB C -4.007 -4.458 2.975 1.00 . A A . 25 SER CB 1 1 1 342 1 1 25 SER H H -1.542 -3.861 1.727 1.00 . A A . 25 SER H 1 1 1 343 1 1 25 SER HA H -2.476 -4.595 4.467 1.00 . A A . 25 SER HA 1 1 1 344 1 1 25 SER HB2 H -4.010 -4.012 1.992 1.00 . A A . 25 SER HB2 1 1 1 345 1 1 25 SER HB3 H -4.560 -5.388 2.947 1.00 . A A . 25 SER HB3 1 1 1 346 1 1 25 SER HG H -4.553 -2.676 3.533 1.00 . A A . 25 SER HG 1 1 1 347 1 1 25 SER N N -1.742 -3.733 2.676 1.00 . A A . 25 SER N 1 1 1 348 1 1 25 SER O O -2.192 -6.541 1.872 1.00 . A A . 25 SER O 1 1 1 349 1 1 25 SER OG O -4.609 -3.562 3.898 1.00 . A A . 25 SER OG 1 1 1 350 1 1 26 LYS C C -2.657 -9.226 3.454 1.00 . A A . 26 LYS C 1 1 1 351 1 1 26 LYS CA C -1.404 -8.376 3.712 1.00 . A A . 26 LYS CA 1 1 1 352 1 1 26 LYS CB C -0.651 -8.858 4.960 1.00 . A A . 26 LYS CB 1 1 1 353 1 1 26 LYS CD C -0.829 -9.290 7.422 1.00 . A A . 26 LYS CD 1 1 1 354 1 1 26 LYS CE C -0.852 -8.026 8.289 1.00 . A A . 26 LYS CE 1 1 1 355 1 1 26 LYS CG C -1.621 -9.046 6.134 1.00 . A A . 26 LYS CG 1 1 1 356 1 1 26 LYS H H -1.787 -6.633 4.927 1.00 . A A . 26 LYS H 1 1 1 357 1 1 26 LYS HA H -0.753 -8.409 2.857 1.00 . A A . 26 LYS HA 1 1 1 358 1 1 26 LYS HB2 H -0.168 -9.797 4.742 1.00 . A A . 26 LYS HB2 1 1 1 359 1 1 26 LYS HB3 H 0.093 -8.125 5.229 1.00 . A A . 26 LYS HB3 1 1 1 360 1 1 26 LYS HD2 H -1.278 -10.108 7.968 1.00 . A A . 26 LYS HD2 1 1 1 361 1 1 26 LYS HD3 H 0.191 -9.539 7.177 1.00 . A A . 26 LYS HD3 1 1 1 362 1 1 26 LYS HE2 H -1.596 -7.332 7.920 1.00 . A A . 26 LYS HE2 1 1 1 363 1 1 26 LYS HE3 H -1.051 -8.280 9.317 1.00 . A A . 26 LYS HE3 1 1 1 364 1 1 26 LYS HG2 H -2.228 -8.161 6.245 1.00 . A A . 26 LYS HG2 1 1 1 365 1 1 26 LYS HG3 H -2.258 -9.897 5.940 1.00 . A A . 26 LYS HG3 1 1 1 366 1 1 26 LYS HZ1 H 0.574 -6.578 8.742 1.00 . A A . 26 LYS HZ1 1 1 1 367 1 1 26 LYS HZ2 H 0.699 -7.203 7.167 1.00 . A A . 26 LYS HZ2 1 1 1 368 1 1 26 LYS HZ3 H 1.219 -8.127 8.496 1.00 . A A . 26 LYS HZ3 1 1 1 369 1 1 26 LYS N N -1.796 -6.962 4.004 1.00 . A A . 26 LYS N 1 1 1 370 1 1 26 LYS NZ N 0.512 -7.440 8.162 1.00 . A A . 26 LYS NZ 1 1 1 371 1 1 26 LYS O O -2.650 -10.119 2.629 1.00 . A A . 26 LYS O 1 1 1 372 1 1 27 THR C C -5.587 -9.369 2.563 1.00 . A A . 27 THR C 1 1 1 373 1 1 27 THR CA C -5.002 -9.713 3.936 1.00 . A A . 27 THR CA 1 1 1 374 1 1 27 THR CB C -5.955 -9.258 5.051 1.00 . A A . 27 THR CB 1 1 1 375 1 1 27 THR CG2 C -7.191 -10.161 5.072 1.00 . A A . 27 THR CG2 1 1 1 376 1 1 27 THR H H -3.712 -8.207 4.795 1.00 . A A . 27 THR H 1 1 1 377 1 1 27 THR HA H -4.817 -10.770 4.013 1.00 . A A . 27 THR HA 1 1 1 378 1 1 27 THR HB H -6.264 -8.239 4.869 1.00 . A A . 27 THR HB 1 1 1 379 1 1 27 THR HG1 H -5.438 -8.508 6.771 1.00 . A A . 27 THR HG1 1 1 1 380 1 1 27 THR HG21 H -7.776 -9.991 4.180 1.00 . A A . 27 THR HG21 1 1 1 381 1 1 27 THR HG22 H -7.789 -9.933 5.943 1.00 . A A . 27 THR HG22 1 1 1 382 1 1 27 THR HG23 H -6.882 -11.194 5.109 1.00 . A A . 27 THR HG23 1 1 1 383 1 1 27 THR N N -3.736 -8.940 4.145 1.00 . A A . 27 THR N 1 1 1 384 1 1 27 THR O O -6.098 -10.221 1.861 1.00 . A A . 27 THR O 1 1 1 385 1 1 27 THR OG1 O -5.292 -9.335 6.308 1.00 . A A . 27 THR OG1 1 1 1 386 1 1 28 TRP C C -5.021 -8.051 -0.241 1.00 . A A . 28 TRP C 1 1 1 387 1 1 28 TRP CA C -6.034 -7.693 0.853 1.00 . A A . 28 TRP CA 1 1 1 388 1 1 28 TRP CB C -6.194 -6.168 0.950 1.00 . A A . 28 TRP CB 1 1 1 389 1 1 28 TRP CD1 C -7.839 -6.669 2.827 1.00 . A A . 28 TRP CD1 1 1 1 390 1 1 28 TRP CD2 C -7.492 -4.466 2.533 1.00 . A A . 28 TRP CD2 1 1 1 391 1 1 28 TRP CE2 C -8.413 -4.595 3.599 1.00 . A A . 28 TRP CE2 1 1 1 392 1 1 28 TRP CE3 C -7.106 -3.170 2.144 1.00 . A A . 28 TRP CE3 1 1 1 393 1 1 28 TRP CG C -7.138 -5.798 2.059 1.00 . A A . 28 TRP CG 1 1 1 394 1 1 28 TRP CH2 C -8.538 -2.200 3.857 1.00 . A A . 28 TRP CH2 1 1 1 395 1 1 28 TRP CZ2 C -8.931 -3.479 4.257 1.00 . A A . 28 TRP CZ2 1 1 1 396 1 1 28 TRP CZ3 C -7.626 -2.046 2.804 1.00 . A A . 28 TRP CZ3 1 1 1 397 1 1 28 TRP H H -5.077 -7.461 2.769 1.00 . A A . 28 TRP H 1 1 1 398 1 1 28 TRP HA H -6.987 -8.156 0.655 1.00 . A A . 28 TRP HA 1 1 1 399 1 1 28 TRP HB2 H -5.231 -5.722 1.141 1.00 . A A . 28 TRP HB2 1 1 1 400 1 1 28 TRP HB3 H -6.578 -5.792 0.015 1.00 . A A . 28 TRP HB3 1 1 1 401 1 1 28 TRP HD1 H -7.811 -7.744 2.742 1.00 . A A . 28 TRP HD1 1 1 1 402 1 1 28 TRP HE1 H -9.182 -6.347 4.415 1.00 . A A . 28 TRP HE1 1 1 1 403 1 1 28 TRP HE3 H -6.404 -3.041 1.334 1.00 . A A . 28 TRP HE3 1 1 1 404 1 1 28 TRP HH2 H -8.934 -1.332 4.361 1.00 . A A . 28 TRP HH2 1 1 1 405 1 1 28 TRP HZ2 H -9.633 -3.604 5.068 1.00 . A A . 28 TRP HZ2 1 1 1 406 1 1 28 TRP HZ3 H -7.323 -1.056 2.497 1.00 . A A . 28 TRP HZ3 1 1 1 407 1 1 28 TRP N N -5.502 -8.120 2.180 1.00 . A A . 28 TRP N 1 1 1 408 1 1 28 TRP NE1 N -8.589 -5.955 3.741 1.00 . A A . 28 TRP NE1 1 1 1 409 1 1 28 TRP O O -5.380 -8.505 -1.312 1.00 . A A . 28 TRP O 1 1 1 410 1 1 29 GLY C C -2.338 -6.927 -1.792 1.00 . A A . 29 GLY C 1 1 1 411 1 1 29 GLY CA C -2.698 -8.173 -0.972 1.00 . A A . 29 GLY CA 1 1 1 412 1 1 29 GLY H H -3.496 -7.484 0.902 1.00 . A A . 29 GLY H 1 1 1 413 1 1 29 GLY HA2 H -1.817 -8.529 -0.457 1.00 . A A . 29 GLY HA2 1 1 1 414 1 1 29 GLY HA3 H -3.060 -8.944 -1.636 1.00 . A A . 29 GLY HA3 1 1 1 415 1 1 29 GLY N N -3.753 -7.849 0.030 1.00 . A A . 29 GLY N 1 1 1 416 1 1 29 GLY O O -1.728 -7.034 -2.840 1.00 . A A . 29 GLY O 1 1 1 417 1 1 30 TRP C C -2.190 -3.304 -1.184 1.00 . A A . 30 TRP C 1 1 1 418 1 1 30 TRP CA C -2.356 -4.516 -2.114 1.00 . A A . 30 TRP CA 1 1 1 419 1 1 30 TRP CB C -3.514 -4.318 -3.110 1.00 . A A . 30 TRP CB 1 1 1 420 1 1 30 TRP CD1 C -4.859 -2.530 -1.927 1.00 . A A . 30 TRP CD1 1 1 1 421 1 1 30 TRP CD2 C -5.989 -4.461 -2.149 1.00 . A A . 30 TRP CD2 1 1 1 422 1 1 30 TRP CE2 C -6.848 -3.563 -1.474 1.00 . A A . 30 TRP CE2 1 1 1 423 1 1 30 TRP CE3 C -6.465 -5.757 -2.418 1.00 . A A . 30 TRP CE3 1 1 1 424 1 1 30 TRP CG C -4.728 -3.786 -2.418 1.00 . A A . 30 TRP CG 1 1 1 425 1 1 30 TRP CH2 C -8.591 -5.225 -1.357 1.00 . A A . 30 TRP CH2 1 1 1 426 1 1 30 TRP CZ2 C -8.132 -3.934 -1.081 1.00 . A A . 30 TRP CZ2 1 1 1 427 1 1 30 TRP CZ3 C -7.758 -6.135 -2.025 1.00 . A A . 30 TRP CZ3 1 1 1 428 1 1 30 TRP H H -3.186 -5.669 -0.484 1.00 . A A . 30 TRP H 1 1 1 429 1 1 30 TRP HA H -1.440 -4.678 -2.660 1.00 . A A . 30 TRP HA 1 1 1 430 1 1 30 TRP HB2 H -3.209 -3.623 -3.877 1.00 . A A . 30 TRP HB2 1 1 1 431 1 1 30 TRP HB3 H -3.753 -5.267 -3.568 1.00 . A A . 30 TRP HB3 1 1 1 432 1 1 30 TRP HD1 H -4.103 -1.760 -1.963 1.00 . A A . 30 TRP HD1 1 1 1 433 1 1 30 TRP HE1 H -6.450 -1.591 -0.931 1.00 . A A . 30 TRP HE1 1 1 1 434 1 1 30 TRP HE3 H -5.831 -6.465 -2.932 1.00 . A A . 30 TRP HE3 1 1 1 435 1 1 30 TRP HH2 H -9.583 -5.521 -1.055 1.00 . A A . 30 TRP HH2 1 1 1 436 1 1 30 TRP HZ2 H -8.770 -3.230 -0.566 1.00 . A A . 30 TRP HZ2 1 1 1 437 1 1 30 TRP HZ3 H -8.114 -7.133 -2.237 1.00 . A A . 30 TRP HZ3 1 1 1 438 1 1 30 TRP N N -2.701 -5.746 -1.336 1.00 . A A . 30 TRP N 1 1 1 439 1 1 30 TRP NE1 N -6.110 -2.400 -1.361 1.00 . A A . 30 TRP NE1 1 1 1 440 1 1 30 TRP O O -2.371 -3.396 0.016 1.00 . A A . 30 TRP O 1 1 1 441 1 1 31 CYS C C -2.486 0.214 -1.493 1.00 . A A . 31 CYS C 1 1 1 442 1 1 31 CYS CA C -1.653 -0.937 -0.921 1.00 . A A . 31 CYS CA 1 1 1 443 1 1 31 CYS CB C -0.158 -0.620 -1.026 1.00 . A A . 31 CYS CB 1 1 1 444 1 1 31 CYS H H -1.710 -2.131 -2.712 1.00 . A A . 31 CYS H 1 1 1 445 1 1 31 CYS HA H -1.919 -1.123 0.108 1.00 . A A . 31 CYS HA 1 1 1 446 1 1 31 CYS HB2 H 0.418 -1.509 -0.816 1.00 . A A . 31 CYS HB2 1 1 1 447 1 1 31 CYS HB3 H 0.068 -0.275 -2.025 1.00 . A A . 31 CYS HB3 1 1 1 448 1 1 31 CYS N N -1.843 -2.171 -1.743 1.00 . A A . 31 CYS N 1 1 1 449 1 1 31 CYS O O -2.413 0.520 -2.671 1.00 . A A . 31 CYS O 1 1 1 450 1 1 31 CYS SG S 0.279 0.667 0.164 1.00 . A A . 31 CYS SG 1 1 1 451 1 1 32 ALA C C -4.321 3.010 -0.008 1.00 . A A . 32 ALA C 1 1 1 452 1 1 32 ALA CA C -4.116 1.996 -1.140 1.00 . A A . 32 ALA CA 1 1 1 453 1 1 32 ALA CB C -5.451 1.365 -1.551 1.00 . A A . 32 ALA CB 1 1 1 454 1 1 32 ALA H H -3.307 0.588 0.280 1.00 . A A . 32 ALA H 1 1 1 455 1 1 32 ALA HA H -3.654 2.472 -1.992 1.00 . A A . 32 ALA HA 1 1 1 456 1 1 32 ALA HB1 H -6.105 1.314 -0.694 1.00 . A A . 32 ALA HB1 1 1 1 457 1 1 32 ALA HB2 H -5.278 0.368 -1.930 1.00 . A A . 32 ALA HB2 1 1 1 458 1 1 32 ALA HB3 H -5.911 1.966 -2.321 1.00 . A A . 32 ALA HB3 1 1 1 459 1 1 32 ALA N N -3.273 0.857 -0.663 1.00 . A A . 32 ALA N 1 1 1 460 1 1 32 ALA O O -3.942 2.771 1.123 1.00 . A A . 32 ALA O 1 1 1 461 1 1 33 VAL C C -6.002 4.579 1.892 1.00 . A A . 33 VAL C 1 1 1 462 1 1 33 VAL CA C -5.152 5.173 0.760 1.00 . A A . 33 VAL CA 1 1 1 463 1 1 33 VAL CB C -5.904 6.320 0.070 1.00 . A A . 33 VAL CB 1 1 1 464 1 1 33 VAL CG1 C -6.267 7.391 1.104 1.00 . A A . 33 VAL CG1 1 1 1 465 1 1 33 VAL CG2 C -5.017 6.947 -1.009 1.00 . A A . 33 VAL CG2 1 1 1 466 1 1 33 VAL H H -5.218 4.309 -1.223 1.00 . A A . 33 VAL H 1 1 1 467 1 1 33 VAL HA H -4.210 5.531 1.146 1.00 . A A . 33 VAL HA 1 1 1 468 1 1 33 VAL HB H -6.808 5.937 -0.381 1.00 . A A . 33 VAL HB 1 1 1 469 1 1 33 VAL HG11 H -6.560 8.299 0.594 1.00 . A A . 33 VAL HG11 1 1 1 470 1 1 33 VAL HG12 H -5.411 7.592 1.730 1.00 . A A . 33 VAL HG12 1 1 1 471 1 1 33 VAL HG13 H -7.086 7.042 1.714 1.00 . A A . 33 VAL HG13 1 1 1 472 1 1 33 VAL HG21 H -5.566 7.726 -1.519 1.00 . A A . 33 VAL HG21 1 1 1 473 1 1 33 VAL HG22 H -4.725 6.190 -1.720 1.00 . A A . 33 VAL HG22 1 1 1 474 1 1 33 VAL HG23 H -4.136 7.371 -0.550 1.00 . A A . 33 VAL HG23 1 1 1 475 1 1 33 VAL N N -4.919 4.140 -0.304 1.00 . A A . 33 VAL N 1 1 1 476 1 1 33 VAL O O -6.953 3.859 1.651 1.00 . A A . 33 VAL O 1 1 1 477 1 1 34 GLU C C -7.669 5.223 4.548 1.00 . A A . 34 GLU C 1 1 1 478 1 1 34 GLU CA C -6.448 4.334 4.269 1.00 . A A . 34 GLU CA 1 1 1 479 1 1 34 GLU CB C -5.480 4.336 5.461 1.00 . A A . 34 GLU CB 1 1 1 480 1 1 34 GLU CD C -6.525 2.388 6.640 1.00 . A A . 34 GLU CD 1 1 1 481 1 1 34 GLU CG C -5.259 2.899 5.945 1.00 . A A . 34 GLU CG 1 1 1 482 1 1 34 GLU H H -4.893 5.461 3.287 1.00 . A A . 34 GLU H 1 1 1 483 1 1 34 GLU HA H -6.766 3.323 4.057 1.00 . A A . 34 GLU HA 1 1 1 484 1 1 34 GLU HB2 H -4.535 4.762 5.157 1.00 . A A . 34 GLU HB2 1 1 1 485 1 1 34 GLU HB3 H -5.897 4.923 6.264 1.00 . A A . 34 GLU HB3 1 1 1 486 1 1 34 GLU HG2 H -5.032 2.266 5.100 1.00 . A A . 34 GLU HG2 1 1 1 487 1 1 34 GLU HG3 H -4.435 2.877 6.641 1.00 . A A . 34 GLU HG3 1 1 1 488 1 1 34 GLU N N -5.663 4.879 3.120 1.00 . A A . 34 GLU N 1 1 1 489 1 1 34 GLU O O -7.716 5.943 5.530 1.00 . A A . 34 GLU O 1 1 1 490 1 1 34 GLU OE1 O -6.678 2.651 7.822 1.00 . A A . 34 GLU OE1 1 1 1 491 1 1 34 GLU OE2 O -7.323 1.742 5.978 1.00 . A A . 34 GLU OE2 1 1 1 492 1 1 35 ALA C C -10.700 5.470 5.088 1.00 . A A . 35 ALA C 1 1 1 493 1 1 35 ALA CA C -9.885 6.005 3.898 1.00 . A A . 35 ALA CA 1 1 1 494 1 1 35 ALA CB C -10.686 5.900 2.594 1.00 . A A . 35 ALA CB 1 1 1 495 1 1 35 ALA H H -8.595 4.581 2.910 1.00 . A A . 35 ALA H 1 1 1 496 1 1 35 ALA HA H -9.607 7.034 4.072 1.00 . A A . 35 ALA HA 1 1 1 497 1 1 35 ALA HB1 H -10.214 5.185 1.935 1.00 . A A . 35 ALA HB1 1 1 1 498 1 1 35 ALA HB2 H -10.719 6.865 2.112 1.00 . A A . 35 ALA HB2 1 1 1 499 1 1 35 ALA HB3 H -11.693 5.574 2.816 1.00 . A A . 35 ALA HB3 1 1 1 500 1 1 35 ALA N N -8.658 5.171 3.689 1.00 . A A . 35 ALA N 1 1 1 501 1 1 35 ALA O O -10.993 6.213 6.006 1.00 . A A . 35 ALA O 1 1 1 502 1 1 36 PRO C C -10.943 3.384 7.392 1.00 . A A . 36 PRO C 1 1 1 503 1 1 36 PRO CA C -11.823 3.584 6.147 1.00 . A A . 36 PRO CA 1 1 1 504 1 1 36 PRO CB C -12.272 2.244 5.571 1.00 . A A . 36 PRO CB 1 1 1 505 1 1 36 PRO CD C -10.736 3.222 3.982 1.00 . A A . 36 PRO CD 1 1 1 506 1 1 36 PRO CG C -11.269 1.916 4.511 1.00 . A A . 36 PRO CG 1 1 1 507 1 1 36 PRO HA H -12.682 4.190 6.382 1.00 . A A . 36 PRO HA 1 1 1 508 1 1 36 PRO HB2 H -12.272 1.485 6.342 1.00 . A A . 36 PRO HB2 1 1 1 509 1 1 36 PRO HB3 H -13.255 2.333 5.132 1.00 . A A . 36 PRO HB3 1 1 1 510 1 1 36 PRO HD2 H -9.669 3.152 3.819 1.00 . A A . 36 PRO HD2 1 1 1 511 1 1 36 PRO HD3 H -11.243 3.496 3.071 1.00 . A A . 36 PRO HD3 1 1 1 512 1 1 36 PRO HG2 H -10.465 1.331 4.936 1.00 . A A . 36 PRO HG2 1 1 1 513 1 1 36 PRO HG3 H -11.742 1.367 3.711 1.00 . A A . 36 PRO HG3 1 1 1 514 1 1 36 PRO N N -11.040 4.197 5.044 1.00 . A A . 36 PRO N 1 1 1 515 1 1 36 PRO O O -11.382 3.757 8.465 1.00 . A A . 36 PRO O 1 1 2 516 1 1 1 ASP C C 9.581 8.188 -7.936 1.00 . A A . 1 ASP C 1 1 2 517 1 1 1 ASP CA C 9.533 7.741 -9.405 1.00 . A A . 1 ASP CA 1 1 2 518 1 1 1 ASP CB C 8.667 8.697 -10.236 1.00 . A A . 1 ASP CB 1 1 2 519 1 1 1 ASP CG C 9.390 10.036 -10.400 1.00 . A A . 1 ASP CG 1 1 2 520 1 1 1 ASP H1 H 7.894 6.474 -9.155 1.00 . A A . 1 ASP H1 1 1 2 521 1 1 1 ASP H2 H 9.398 5.709 -8.961 1.00 . A A . 1 ASP H2 1 1 2 522 1 1 1 ASP H3 H 8.844 6.115 -10.514 1.00 . A A . 1 ASP H3 1 1 2 523 1 1 1 ASP HA H 10.529 7.699 -9.817 1.00 . A A . 1 ASP HA 1 1 2 524 1 1 1 ASP HB2 H 8.487 8.264 -11.210 1.00 . A A . 1 ASP HB2 1 1 2 525 1 1 1 ASP HB3 H 7.724 8.857 -9.735 1.00 . A A . 1 ASP HB3 1 1 2 526 1 1 1 ASP N N 8.866 6.409 -9.517 1.00 . A A . 1 ASP N 1 1 2 527 1 1 1 ASP O O 8.636 8.751 -7.417 1.00 . A A . 1 ASP O 1 1 2 528 1 1 1 ASP OD1 O 10.253 10.123 -11.259 1.00 . A A . 1 ASP OD1 1 1 2 529 1 1 1 ASP OD2 O 9.070 10.954 -9.660 1.00 . A A . 1 ASP OD2 1 1 2 530 1 1 2 GLY C C 10.888 7.084 -4.957 1.00 . A A . 2 GLY C 1 1 2 531 1 1 2 GLY CA C 10.804 8.337 -5.836 1.00 . A A . 2 GLY CA 1 1 2 532 1 1 2 GLY H H 11.427 7.479 -7.712 1.00 . A A . 2 GLY H 1 1 2 533 1 1 2 GLY HA2 H 11.700 8.929 -5.705 1.00 . A A . 2 GLY HA2 1 1 2 534 1 1 2 GLY HA3 H 9.942 8.917 -5.546 1.00 . A A . 2 GLY HA3 1 1 2 535 1 1 2 GLY N N 10.680 7.936 -7.269 1.00 . A A . 2 GLY N 1 1 2 536 1 1 2 GLY O O 11.564 6.127 -5.288 1.00 . A A . 2 GLY O 1 1 2 537 1 1 3 GLU C C 8.867 5.714 -2.250 1.00 . A A . 3 GLU C 1 1 2 538 1 1 3 GLU CA C 10.234 5.899 -2.925 1.00 . A A . 3 GLU CA 1 1 2 539 1 1 3 GLU CB C 11.330 6.209 -1.896 1.00 . A A . 3 GLU CB 1 1 2 540 1 1 3 GLU CD C 12.285 8.052 -0.495 1.00 . A A . 3 GLU CD 1 1 2 541 1 1 3 GLU CG C 11.012 7.517 -1.156 1.00 . A A . 3 GLU CG 1 1 2 542 1 1 3 GLU H H 9.668 7.870 -3.596 1.00 . A A . 3 GLU H 1 1 2 543 1 1 3 GLU HA H 10.493 5.010 -3.480 1.00 . A A . 3 GLU HA 1 1 2 544 1 1 3 GLU HB2 H 11.389 5.400 -1.181 1.00 . A A . 3 GLU HB2 1 1 2 545 1 1 3 GLU HB3 H 12.279 6.308 -2.400 1.00 . A A . 3 GLU HB3 1 1 2 546 1 1 3 GLU HG2 H 10.637 8.248 -1.858 1.00 . A A . 3 GLU HG2 1 1 2 547 1 1 3 GLU HG3 H 10.268 7.331 -0.397 1.00 . A A . 3 GLU HG3 1 1 2 548 1 1 3 GLU N N 10.204 7.085 -3.838 1.00 . A A . 3 GLU N 1 1 2 549 1 1 3 GLU O O 8.765 5.582 -1.043 1.00 . A A . 3 GLU O 1 1 2 550 1 1 3 GLU OE1 O 13.005 8.790 -1.150 1.00 . A A . 3 GLU OE1 1 1 2 551 1 1 3 GLU OE2 O 12.519 7.714 0.654 1.00 . A A . 3 GLU OE2 1 1 2 552 1 1 4 CYS C C 5.549 4.784 -3.464 1.00 . A A . 4 CYS C 1 1 2 553 1 1 4 CYS CA C 6.446 5.522 -2.458 1.00 . A A . 4 CYS CA 1 1 2 554 1 1 4 CYS CB C 5.946 6.950 -2.185 1.00 . A A . 4 CYS CB 1 1 2 555 1 1 4 CYS H H 7.928 5.801 -3.998 1.00 . A A . 4 CYS H 1 1 2 556 1 1 4 CYS HA H 6.496 4.970 -1.530 1.00 . A A . 4 CYS HA 1 1 2 557 1 1 4 CYS HB2 H 5.624 7.024 -1.158 1.00 . A A . 4 CYS HB2 1 1 2 558 1 1 4 CYS HB3 H 6.753 7.648 -2.354 1.00 . A A . 4 CYS HB3 1 1 2 559 1 1 4 CYS N N 7.815 5.698 -3.029 1.00 . A A . 4 CYS N 1 1 2 560 1 1 4 CYS O O 5.785 4.816 -4.658 1.00 . A A . 4 CYS O 1 1 2 561 1 1 4 CYS SG S 4.558 7.368 -3.275 1.00 . A A . 4 CYS SG 1 1 2 562 1 1 5 GLY C C 2.633 4.332 -4.571 1.00 . A A . 5 GLY C 1 1 2 563 1 1 5 GLY CA C 3.618 3.366 -3.902 1.00 . A A . 5 GLY CA 1 1 2 564 1 1 5 GLY H H 4.365 4.100 -2.024 1.00 . A A . 5 GLY H 1 1 2 565 1 1 5 GLY HA2 H 4.204 2.868 -4.658 1.00 . A A . 5 GLY HA2 1 1 2 566 1 1 5 GLY HA3 H 3.066 2.633 -3.334 1.00 . A A . 5 GLY HA3 1 1 2 567 1 1 5 GLY N N 4.529 4.113 -2.987 1.00 . A A . 5 GLY N 1 1 2 568 1 1 5 GLY O O 2.978 5.448 -4.913 1.00 . A A . 5 GLY O 1 1 2 569 1 1 6 GLY C C -0.970 4.581 -4.755 1.00 . A A . 6 GLY C 1 1 2 570 1 1 6 GLY CA C 0.397 4.794 -5.411 1.00 . A A . 6 GLY CA 1 1 2 571 1 1 6 GLY H H 1.157 3.005 -4.483 1.00 . A A . 6 GLY H 1 1 2 572 1 1 6 GLY HA2 H 0.697 5.826 -5.295 1.00 . A A . 6 GLY HA2 1 1 2 573 1 1 6 GLY HA3 H 0.331 4.556 -6.460 1.00 . A A . 6 GLY HA3 1 1 2 574 1 1 6 GLY N N 1.410 3.908 -4.763 1.00 . A A . 6 GLY N 1 1 2 575 1 1 6 GLY O O -1.065 4.231 -3.594 1.00 . A A . 6 GLY O 1 1 2 576 1 1 7 PHE C C -3.766 3.121 -4.820 1.00 . A A . 7 PHE C 1 1 2 577 1 1 7 PHE CA C -3.402 4.610 -4.918 1.00 . A A . 7 PHE CA 1 1 2 578 1 1 7 PHE CB C -4.343 5.326 -5.893 1.00 . A A . 7 PHE CB 1 1 2 579 1 1 7 PHE CD1 C -6.109 6.420 -4.463 1.00 . A A . 7 PHE CD1 1 1 2 580 1 1 7 PHE CD2 C -6.656 4.358 -5.616 1.00 . A A . 7 PHE CD2 1 1 2 581 1 1 7 PHE CE1 C -7.399 6.458 -3.921 1.00 . A A . 7 PHE CE1 1 1 2 582 1 1 7 PHE CE2 C -7.946 4.397 -5.073 1.00 . A A . 7 PHE CE2 1 1 2 583 1 1 7 PHE CG C -5.738 5.370 -5.311 1.00 . A A . 7 PHE CG 1 1 2 584 1 1 7 PHE CZ C -8.317 5.447 -4.225 1.00 . A A . 7 PHE CZ 1 1 2 585 1 1 7 PHE H H -1.928 5.076 -6.425 1.00 . A A . 7 PHE H 1 1 2 586 1 1 7 PHE HA H -3.464 5.069 -3.946 1.00 . A A . 7 PHE HA 1 1 2 587 1 1 7 PHE HB2 H -3.990 6.334 -6.058 1.00 . A A . 7 PHE HB2 1 1 2 588 1 1 7 PHE HB3 H -4.363 4.794 -6.833 1.00 . A A . 7 PHE HB3 1 1 2 589 1 1 7 PHE HD1 H -5.401 7.201 -4.228 1.00 . A A . 7 PHE HD1 1 1 2 590 1 1 7 PHE HD2 H -6.370 3.547 -6.270 1.00 . A A . 7 PHE HD2 1 1 2 591 1 1 7 PHE HE1 H -7.686 7.268 -3.267 1.00 . A A . 7 PHE HE1 1 1 2 592 1 1 7 PHE HE2 H -8.654 3.616 -5.307 1.00 . A A . 7 PHE HE2 1 1 2 593 1 1 7 PHE HZ H -9.312 5.475 -3.805 1.00 . A A . 7 PHE HZ 1 1 2 594 1 1 7 PHE N N -2.032 4.792 -5.492 1.00 . A A . 7 PHE N 1 1 2 595 1 1 7 PHE O O -4.529 2.724 -3.962 1.00 . A A . 7 PHE O 1 1 2 596 1 1 8 TRP C C -2.418 0.022 -6.252 1.00 . A A . 8 TRP C 1 1 2 597 1 1 8 TRP CA C -3.562 0.843 -5.641 1.00 . A A . 8 TRP CA 1 1 2 598 1 1 8 TRP CB C -4.847 0.700 -6.463 1.00 . A A . 8 TRP CB 1 1 2 599 1 1 8 TRP CD1 C -6.485 -0.350 -4.842 1.00 . A A . 8 TRP CD1 1 1 2 600 1 1 8 TRP CD2 C -5.770 -1.796 -6.411 1.00 . A A . 8 TRP CD2 1 1 2 601 1 1 8 TRP CE2 C -6.668 -2.509 -5.581 1.00 . A A . 8 TRP CE2 1 1 2 602 1 1 8 TRP CE3 C -5.173 -2.483 -7.485 1.00 . A A . 8 TRP CE3 1 1 2 603 1 1 8 TRP CG C -5.669 -0.428 -5.921 1.00 . A A . 8 TRP CG 1 1 2 604 1 1 8 TRP CH2 C -6.363 -4.518 -6.880 1.00 . A A . 8 TRP CH2 1 1 2 605 1 1 8 TRP CZ2 C -6.964 -3.852 -5.810 1.00 . A A . 8 TRP CZ2 1 1 2 606 1 1 8 TRP CZ3 C -5.468 -3.836 -7.716 1.00 . A A . 8 TRP CZ3 1 1 2 607 1 1 8 TRP H H -2.626 2.643 -6.378 1.00 . A A . 8 TRP H 1 1 2 608 1 1 8 TRP HA H -3.741 0.536 -4.623 1.00 . A A . 8 TRP HA 1 1 2 609 1 1 8 TRP HB2 H -5.416 1.618 -6.405 1.00 . A A . 8 TRP HB2 1 1 2 610 1 1 8 TRP HB3 H -4.597 0.499 -7.494 1.00 . A A . 8 TRP HB3 1 1 2 611 1 1 8 TRP HD1 H -6.646 0.531 -4.238 1.00 . A A . 8 TRP HD1 1 1 2 612 1 1 8 TRP HE1 H -7.711 -1.796 -3.924 1.00 . A A . 8 TRP HE1 1 1 2 613 1 1 8 TRP HE3 H -4.482 -1.965 -8.134 1.00 . A A . 8 TRP HE3 1 1 2 614 1 1 8 TRP HH2 H -6.586 -5.558 -7.063 1.00 . A A . 8 TRP HH2 1 1 2 615 1 1 8 TRP HZ2 H -7.654 -4.374 -5.162 1.00 . A A . 8 TRP HZ2 1 1 2 616 1 1 8 TRP HZ3 H -5.004 -4.352 -8.543 1.00 . A A . 8 TRP HZ3 1 1 2 617 1 1 8 TRP N N -3.236 2.301 -5.691 1.00 . A A . 8 TRP N 1 1 2 618 1 1 8 TRP NE1 N -7.076 -1.584 -4.641 1.00 . A A . 8 TRP NE1 1 1 2 619 1 1 8 TRP O O -2.549 -0.555 -7.317 1.00 . A A . 8 TRP O 1 1 2 620 1 1 9 TRP C C -0.084 -2.191 -5.429 1.00 . A A . 9 TRP C 1 1 2 621 1 1 9 TRP CA C -0.132 -0.817 -6.106 1.00 . A A . 9 TRP CA 1 1 2 622 1 1 9 TRP CB C 1.112 0.008 -5.745 1.00 . A A . 9 TRP CB 1 1 2 623 1 1 9 TRP CD1 C 0.168 1.850 -7.218 1.00 . A A . 9 TRP CD1 1 1 2 624 1 1 9 TRP CD2 C 2.404 1.965 -7.006 1.00 . A A . 9 TRP CD2 1 1 2 625 1 1 9 TRP CE2 C 2.016 3.043 -7.832 1.00 . A A . 9 TRP CE2 1 1 2 626 1 1 9 TRP CE3 C 3.772 1.810 -6.717 1.00 . A A . 9 TRP CE3 1 1 2 627 1 1 9 TRP CG C 1.211 1.220 -6.624 1.00 . A A . 9 TRP CG 1 1 2 628 1 1 9 TRP CH2 C 4.301 3.774 -8.055 1.00 . A A . 9 TRP CH2 1 1 2 629 1 1 9 TRP CZ2 C 2.946 3.938 -8.352 1.00 . A A . 9 TRP CZ2 1 1 2 630 1 1 9 TRP CZ3 C 4.715 2.711 -7.241 1.00 . A A . 9 TRP CZ3 1 1 2 631 1 1 9 TRP H H -1.217 0.438 -4.721 1.00 . A A . 9 TRP H 1 1 2 632 1 1 9 TRP HA H -0.207 -0.926 -7.177 1.00 . A A . 9 TRP HA 1 1 2 633 1 1 9 TRP HB2 H 1.046 0.322 -4.713 1.00 . A A . 9 TRP HB2 1 1 2 634 1 1 9 TRP HB3 H 1.994 -0.601 -5.875 1.00 . A A . 9 TRP HB3 1 1 2 635 1 1 9 TRP HD1 H -0.867 1.558 -7.144 1.00 . A A . 9 TRP HD1 1 1 2 636 1 1 9 TRP HE1 H 0.097 3.552 -8.453 1.00 . A A . 9 TRP HE1 1 1 2 637 1 1 9 TRP HE3 H 4.100 0.994 -6.091 1.00 . A A . 9 TRP HE3 1 1 2 638 1 1 9 TRP HH2 H 5.030 4.464 -8.455 1.00 . A A . 9 TRP HH2 1 1 2 639 1 1 9 TRP HZ2 H 2.619 4.758 -8.972 1.00 . A A . 9 TRP HZ2 1 1 2 640 1 1 9 TRP HZ3 H 5.762 2.584 -7.013 1.00 . A A . 9 TRP HZ3 1 1 2 641 1 1 9 TRP N N -1.296 -0.033 -5.577 1.00 . A A . 9 TRP N 1 1 2 642 1 1 9 TRP NE1 N 0.647 2.930 -7.934 1.00 . A A . 9 TRP NE1 1 1 2 643 1 1 9 TRP O O -0.869 -2.479 -4.548 1.00 . A A . 9 TRP O 1 1 2 644 1 1 10 LYS C C 1.846 -4.358 -3.986 1.00 . A A . 10 LYS C 1 1 2 645 1 1 10 LYS CA C 0.910 -4.394 -5.193 1.00 . A A . 10 LYS CA 1 1 2 646 1 1 10 LYS CB C 1.482 -5.323 -6.264 1.00 . A A . 10 LYS CB 1 1 2 647 1 1 10 LYS CD C -0.244 -5.302 -8.081 1.00 . A A . 10 LYS CD 1 1 2 648 1 1 10 LYS CE C -0.029 -6.057 -9.399 1.00 . A A . 10 LYS CE 1 1 2 649 1 1 10 LYS CG C 0.346 -6.111 -6.923 1.00 . A A . 10 LYS CG 1 1 2 650 1 1 10 LYS H H 1.455 -2.794 -6.540 1.00 . A A . 10 LYS H 1 1 2 651 1 1 10 LYS HA H -0.070 -4.730 -4.899 1.00 . A A . 10 LYS HA 1 1 2 652 1 1 10 LYS HB2 H 2.001 -4.737 -7.009 1.00 . A A . 10 LYS HB2 1 1 2 653 1 1 10 LYS HB3 H 2.175 -6.012 -5.803 1.00 . A A . 10 LYS HB3 1 1 2 654 1 1 10 LYS HD2 H -1.303 -5.160 -7.919 1.00 . A A . 10 LYS HD2 1 1 2 655 1 1 10 LYS HD3 H 0.244 -4.340 -8.136 1.00 . A A . 10 LYS HD3 1 1 2 656 1 1 10 LYS HE2 H -0.174 -7.118 -9.250 1.00 . A A . 10 LYS HE2 1 1 2 657 1 1 10 LYS HE3 H -0.698 -5.686 -10.158 1.00 . A A . 10 LYS HE3 1 1 2 658 1 1 10 LYS HG2 H 0.733 -7.049 -7.298 1.00 . A A . 10 LYS HG2 1 1 2 659 1 1 10 LYS HG3 H -0.425 -6.307 -6.194 1.00 . A A . 10 LYS HG3 1 1 2 660 1 1 10 LYS HZ1 H 1.592 -6.220 -10.698 1.00 . A A . 10 LYS HZ1 1 1 2 661 1 1 10 LYS HZ2 H 2.026 -6.155 -9.056 1.00 . A A . 10 LYS HZ2 1 1 2 662 1 1 10 LYS HZ3 H 1.525 -4.745 -9.864 1.00 . A A . 10 LYS HZ3 1 1 2 663 1 1 10 LYS N N 0.827 -3.042 -5.829 1.00 . A A . 10 LYS N 1 1 2 664 1 1 10 LYS NZ N 1.387 -5.773 -9.782 1.00 . A A . 10 LYS NZ 1 1 2 665 1 1 10 LYS O O 2.895 -3.741 -4.021 1.00 . A A . 10 LYS O 1 1 2 666 1 1 11 CYS C C 2.151 -6.328 -0.923 1.00 . A A . 11 CYS C 1 1 2 667 1 1 11 CYS CA C 2.346 -5.029 -1.711 1.00 . A A . 11 CYS CA 1 1 2 668 1 1 11 CYS CB C 1.887 -3.821 -0.892 1.00 . A A . 11 CYS CB 1 1 2 669 1 1 11 CYS H H 0.629 -5.511 -2.919 1.00 . A A . 11 CYS H 1 1 2 670 1 1 11 CYS HA H 3.378 -4.911 -2.000 1.00 . A A . 11 CYS HA 1 1 2 671 1 1 11 CYS HB2 H 2.128 -2.918 -1.427 1.00 . A A . 11 CYS HB2 1 1 2 672 1 1 11 CYS HB3 H 0.821 -3.880 -0.741 1.00 . A A . 11 CYS HB3 1 1 2 673 1 1 11 CYS N N 1.477 -5.019 -2.921 1.00 . A A . 11 CYS N 1 1 2 674 1 1 11 CYS O O 1.159 -7.019 -1.079 1.00 . A A . 11 CYS O 1 1 2 675 1 1 11 CYS SG S 2.719 -3.804 0.714 1.00 . A A . 11 CYS SG 1 1 2 676 1 1 12 GLY C C 2.559 -7.547 2.167 1.00 . A A . 12 GLY C 1 1 2 677 1 1 12 GLY CA C 2.965 -7.906 0.737 1.00 . A A . 12 GLY CA 1 1 2 678 1 1 12 GLY H H 3.870 -6.080 0.037 1.00 . A A . 12 GLY H 1 1 2 679 1 1 12 GLY HA2 H 2.216 -8.547 0.297 1.00 . A A . 12 GLY HA2 1 1 2 680 1 1 12 GLY HA3 H 3.914 -8.418 0.754 1.00 . A A . 12 GLY HA3 1 1 2 681 1 1 12 GLY N N 3.088 -6.659 -0.073 1.00 . A A . 12 GLY N 1 1 2 682 1 1 12 GLY O O 1.534 -6.933 2.392 1.00 . A A . 12 GLY O 1 1 2 683 1 1 13 ARG C C 3.640 -6.243 4.958 1.00 . A A . 13 ARG C 1 1 2 684 1 1 13 ARG CA C 3.022 -7.594 4.560 1.00 . A A . 13 ARG CA 1 1 2 685 1 1 13 ARG CB C 3.632 -8.735 5.388 1.00 . A A . 13 ARG CB 1 1 2 686 1 1 13 ARG CD C 2.324 -8.779 7.527 1.00 . A A . 13 ARG CD 1 1 2 687 1 1 13 ARG CG C 2.527 -9.456 6.166 1.00 . A A . 13 ARG CG 1 1 2 688 1 1 13 ARG CZ C 2.506 -9.613 9.798 1.00 . A A . 13 ARG CZ 1 1 2 689 1 1 13 ARG H H 4.181 -8.411 2.930 1.00 . A A . 13 ARG H 1 1 2 690 1 1 13 ARG HA H 1.951 -7.571 4.697 1.00 . A A . 13 ARG HA 1 1 2 691 1 1 13 ARG HB2 H 4.122 -9.436 4.729 1.00 . A A . 13 ARG HB2 1 1 2 692 1 1 13 ARG HB3 H 4.353 -8.332 6.084 1.00 . A A . 13 ARG HB3 1 1 2 693 1 1 13 ARG HD2 H 2.897 -7.865 7.581 1.00 . A A . 13 ARG HD2 1 1 2 694 1 1 13 ARG HD3 H 1.277 -8.575 7.691 1.00 . A A . 13 ARG HD3 1 1 2 695 1 1 13 ARG HE H 3.371 -10.520 8.255 1.00 . A A . 13 ARG HE 1 1 2 696 1 1 13 ARG HG2 H 1.606 -9.415 5.602 1.00 . A A . 13 ARG HG2 1 1 2 697 1 1 13 ARG HG3 H 2.809 -10.487 6.317 1.00 . A A . 13 ARG HG3 1 1 2 698 1 1 13 ARG HH11 H 4.098 -8.466 10.209 1.00 . A A . 13 ARG HH11 1 1 2 699 1 1 13 ARG HH12 H 3.037 -8.782 11.543 1.00 . A A . 13 ARG HH12 1 1 2 700 1 1 13 ARG HH21 H 0.843 -10.728 9.682 1.00 . A A . 13 ARG HH21 1 1 2 701 1 1 13 ARG HH22 H 1.192 -10.065 11.244 1.00 . A A . 13 ARG HH22 1 1 2 702 1 1 13 ARG N N 3.357 -7.921 3.137 1.00 . A A . 13 ARG N 1 1 2 703 1 1 13 ARG NE N 2.815 -9.762 8.536 1.00 . A A . 13 ARG NE 1 1 2 704 1 1 13 ARG NH1 N 3.273 -8.899 10.577 1.00 . A A . 13 ARG NH1 1 1 2 705 1 1 13 ARG NH2 N 1.429 -10.180 10.278 1.00 . A A . 13 ARG NH2 1 1 2 706 1 1 13 ARG O O 4.096 -6.061 6.072 1.00 . A A . 13 ARG O 1 1 2 707 1 1 14 GLY C C 5.720 -3.931 3.966 1.00 . A A . 14 GLY C 1 1 2 708 1 1 14 GLY CA C 4.239 -3.956 4.364 1.00 . A A . 14 GLY CA 1 1 2 709 1 1 14 GLY H H 3.282 -5.461 3.163 1.00 . A A . 14 GLY H 1 1 2 710 1 1 14 GLY HA2 H 3.706 -3.194 3.813 1.00 . A A . 14 GLY HA2 1 1 2 711 1 1 14 GLY HA3 H 4.152 -3.762 5.422 1.00 . A A . 14 GLY HA3 1 1 2 712 1 1 14 GLY N N 3.656 -5.293 4.052 1.00 . A A . 14 GLY N 1 1 2 713 1 1 14 GLY O O 6.529 -3.294 4.613 1.00 . A A . 14 GLY O 1 1 2 714 1 1 15 LYS C C 7.850 -3.306 1.738 1.00 . A A . 15 LYS C 1 1 2 715 1 1 15 LYS CA C 7.513 -4.619 2.465 1.00 . A A . 15 LYS CA 1 1 2 716 1 1 15 LYS CB C 7.657 -5.829 1.531 1.00 . A A . 15 LYS CB 1 1 2 717 1 1 15 LYS CD C 8.411 -7.371 3.357 1.00 . A A . 15 LYS CD 1 1 2 718 1 1 15 LYS CE C 9.639 -8.049 3.974 1.00 . A A . 15 LYS CE 1 1 2 719 1 1 15 LYS CG C 8.797 -6.728 2.021 1.00 . A A . 15 LYS CG 1 1 2 720 1 1 15 LYS H H 5.411 -5.118 2.394 1.00 . A A . 15 LYS H 1 1 2 721 1 1 15 LYS HA H 8.154 -4.740 3.318 1.00 . A A . 15 LYS HA 1 1 2 722 1 1 15 LYS HB2 H 6.734 -6.391 1.522 1.00 . A A . 15 LYS HB2 1 1 2 723 1 1 15 LYS HB3 H 7.878 -5.487 0.532 1.00 . A A . 15 LYS HB3 1 1 2 724 1 1 15 LYS HD2 H 8.041 -6.611 4.030 1.00 . A A . 15 LYS HD2 1 1 2 725 1 1 15 LYS HD3 H 7.642 -8.111 3.191 1.00 . A A . 15 LYS HD3 1 1 2 726 1 1 15 LYS HE2 H 9.332 -8.867 4.610 1.00 . A A . 15 LYS HE2 1 1 2 727 1 1 15 LYS HE3 H 10.304 -8.400 3.201 1.00 . A A . 15 LYS HE3 1 1 2 728 1 1 15 LYS HG2 H 8.982 -7.501 1.289 1.00 . A A . 15 LYS HG2 1 1 2 729 1 1 15 LYS HG3 H 9.690 -6.136 2.154 1.00 . A A . 15 LYS HG3 1 1 2 730 1 1 15 LYS HZ1 H 9.730 -6.766 5.615 1.00 . A A . 15 LYS HZ1 1 1 2 731 1 1 15 LYS HZ2 H 10.424 -6.129 4.200 1.00 . A A . 15 LYS HZ2 1 1 2 732 1 1 15 LYS HZ3 H 11.243 -7.324 5.088 1.00 . A A . 15 LYS HZ3 1 1 2 733 1 1 15 LYS N N 6.081 -4.614 2.904 1.00 . A A . 15 LYS N 1 1 2 734 1 1 15 LYS NZ N 10.310 -6.986 4.780 1.00 . A A . 15 LYS NZ 1 1 2 735 1 1 15 LYS O O 8.728 -2.579 2.164 1.00 . A A . 15 LYS O 1 1 2 736 1 1 16 PRO C C 6.784 -0.585 0.647 1.00 . A A . 16 PRO C 1 1 2 737 1 1 16 PRO CA C 7.366 -1.791 -0.108 1.00 . A A . 16 PRO CA 1 1 2 738 1 1 16 PRO CB C 6.608 -2.033 -1.412 1.00 . A A . 16 PRO CB 1 1 2 739 1 1 16 PRO CD C 6.061 -3.852 0.087 1.00 . A A . 16 PRO CD 1 1 2 740 1 1 16 PRO CG C 5.549 -3.032 -1.070 1.00 . A A . 16 PRO CG 1 1 2 741 1 1 16 PRO HA H 8.415 -1.652 -0.306 1.00 . A A . 16 PRO HA 1 1 2 742 1 1 16 PRO HB2 H 6.161 -1.112 -1.761 1.00 . A A . 16 PRO HB2 1 1 2 743 1 1 16 PRO HB3 H 7.270 -2.440 -2.161 1.00 . A A . 16 PRO HB3 1 1 2 744 1 1 16 PRO HD2 H 5.277 -4.016 0.812 1.00 . A A . 16 PRO HD2 1 1 2 745 1 1 16 PRO HD3 H 6.460 -4.790 -0.260 1.00 . A A . 16 PRO HD3 1 1 2 746 1 1 16 PRO HG2 H 4.639 -2.519 -0.785 1.00 . A A . 16 PRO HG2 1 1 2 747 1 1 16 PRO HG3 H 5.360 -3.675 -1.914 1.00 . A A . 16 PRO HG3 1 1 2 748 1 1 16 PRO N N 7.134 -3.036 0.667 1.00 . A A . 16 PRO N 1 1 2 749 1 1 16 PRO O O 5.666 -0.640 1.125 1.00 . A A . 16 PRO O 1 1 2 750 1 1 17 PRO C C 6.037 2.419 0.634 1.00 . A A . 17 PRO C 1 1 2 751 1 1 17 PRO CA C 7.117 1.691 1.444 1.00 . A A . 17 PRO CA 1 1 2 752 1 1 17 PRO CB C 8.388 2.532 1.550 1.00 . A A . 17 PRO CB 1 1 2 753 1 1 17 PRO CD C 8.923 0.614 0.188 1.00 . A A . 17 PRO CD 1 1 2 754 1 1 17 PRO CG C 9.255 2.064 0.425 1.00 . A A . 17 PRO CG 1 1 2 755 1 1 17 PRO HA H 6.753 1.447 2.429 1.00 . A A . 17 PRO HA 1 1 2 756 1 1 17 PRO HB2 H 8.155 3.582 1.439 1.00 . A A . 17 PRO HB2 1 1 2 757 1 1 17 PRO HB3 H 8.881 2.352 2.493 1.00 . A A . 17 PRO HB3 1 1 2 758 1 1 17 PRO HD2 H 8.937 0.392 -0.870 1.00 . A A . 17 PRO HD2 1 1 2 759 1 1 17 PRO HD3 H 9.610 -0.024 0.721 1.00 . A A . 17 PRO HD3 1 1 2 760 1 1 17 PRO HG2 H 9.046 2.644 -0.466 1.00 . A A . 17 PRO HG2 1 1 2 761 1 1 17 PRO HG3 H 10.296 2.160 0.693 1.00 . A A . 17 PRO HG3 1 1 2 762 1 1 17 PRO N N 7.567 0.467 0.733 1.00 . A A . 17 PRO N 1 1 2 763 1 1 17 PRO O O 6.322 3.067 -0.357 1.00 . A A . 17 PRO O 1 1 2 764 1 1 18 CYS C C 3.776 4.520 0.551 1.00 . A A . 18 CYS C 1 1 2 765 1 1 18 CYS CA C 3.695 3.006 0.313 1.00 . A A . 18 CYS CA 1 1 2 766 1 1 18 CYS CB C 2.397 2.432 0.891 1.00 . A A . 18 CYS CB 1 1 2 767 1 1 18 CYS H H 4.598 1.793 1.854 1.00 . A A . 18 CYS H 1 1 2 768 1 1 18 CYS HA H 3.758 2.788 -0.741 1.00 . A A . 18 CYS HA 1 1 2 769 1 1 18 CYS HB2 H 2.410 2.518 1.967 1.00 . A A . 18 CYS HB2 1 1 2 770 1 1 18 CYS HB3 H 1.554 2.979 0.494 1.00 . A A . 18 CYS HB3 1 1 2 771 1 1 18 CYS N N 4.799 2.319 1.052 1.00 . A A . 18 CYS N 1 1 2 772 1 1 18 CYS O O 4.480 4.981 1.430 1.00 . A A . 18 CYS O 1 1 2 773 1 1 18 CYS SG S 2.247 0.689 0.431 1.00 . A A . 18 CYS SG 1 1 2 774 1 1 19 CYS C C 2.456 7.182 1.283 1.00 . A A . 19 CYS C 1 1 2 775 1 1 19 CYS CA C 3.108 6.784 -0.049 1.00 . A A . 19 CYS CA 1 1 2 776 1 1 19 CYS CB C 2.326 7.360 -1.232 1.00 . A A . 19 CYS CB 1 1 2 777 1 1 19 CYS H H 2.508 4.904 -0.934 1.00 . A A . 19 CYS H 1 1 2 778 1 1 19 CYS HA H 4.129 7.130 -0.082 1.00 . A A . 19 CYS HA 1 1 2 779 1 1 19 CYS HB2 H 2.031 6.560 -1.896 1.00 . A A . 19 CYS HB2 1 1 2 780 1 1 19 CYS HB3 H 1.446 7.868 -0.868 1.00 . A A . 19 CYS HB3 1 1 2 781 1 1 19 CYS N N 3.065 5.297 -0.228 1.00 . A A . 19 CYS N 1 1 2 782 1 1 19 CYS O O 1.644 6.457 1.827 1.00 . A A . 19 CYS O 1 1 2 783 1 1 19 CYS SG S 3.368 8.534 -2.132 1.00 . A A . 19 CYS SG 1 1 2 784 1 1 20 LYS C C 0.714 8.767 3.082 1.00 . A A . 20 LYS C 1 1 2 785 1 1 20 LYS CA C 2.250 8.783 3.116 1.00 . A A . 20 LYS CA 1 1 2 786 1 1 20 LYS CB C 2.765 10.215 3.301 1.00 . A A . 20 LYS CB 1 1 2 787 1 1 20 LYS CD C 4.366 11.524 4.710 1.00 . A A . 20 LYS CD 1 1 2 788 1 1 20 LYS CE C 5.128 11.531 6.039 1.00 . A A . 20 LYS CE 1 1 2 789 1 1 20 LYS CG C 3.367 10.365 4.700 1.00 . A A . 20 LYS CG 1 1 2 790 1 1 20 LYS H H 3.489 8.876 1.358 1.00 . A A . 20 LYS H 1 1 2 791 1 1 20 LYS HA H 2.612 8.161 3.914 1.00 . A A . 20 LYS HA 1 1 2 792 1 1 20 LYS HB2 H 3.522 10.426 2.559 1.00 . A A . 20 LYS HB2 1 1 2 793 1 1 20 LYS HB3 H 1.946 10.909 3.187 1.00 . A A . 20 LYS HB3 1 1 2 794 1 1 20 LYS HD2 H 5.065 11.403 3.894 1.00 . A A . 20 LYS HD2 1 1 2 795 1 1 20 LYS HD3 H 3.838 12.458 4.595 1.00 . A A . 20 LYS HD3 1 1 2 796 1 1 20 LYS HE2 H 5.130 10.542 6.475 1.00 . A A . 20 LYS HE2 1 1 2 797 1 1 20 LYS HE3 H 6.138 11.879 5.891 1.00 . A A . 20 LYS HE3 1 1 2 798 1 1 20 LYS HG2 H 2.577 10.565 5.411 1.00 . A A . 20 LYS HG2 1 1 2 799 1 1 20 LYS HG3 H 3.874 9.452 4.973 1.00 . A A . 20 LYS HG3 1 1 2 800 1 1 20 LYS HZ1 H 4.375 13.425 6.470 1.00 . A A . 20 LYS HZ1 1 1 2 801 1 1 20 LYS HZ2 H 4.849 12.539 7.839 1.00 . A A . 20 LYS HZ2 1 1 2 802 1 1 20 LYS HZ3 H 3.404 12.152 7.032 1.00 . A A . 20 LYS HZ3 1 1 2 803 1 1 20 LYS N N 2.823 8.325 1.813 1.00 . A A . 20 LYS N 1 1 2 804 1 1 20 LYS NZ N 4.383 12.484 6.911 1.00 . A A . 20 LYS NZ 1 1 2 805 1 1 20 LYS O O 0.098 9.312 2.184 1.00 . A A . 20 LYS O 1 1 2 806 1 1 21 GLY C C -1.899 6.756 3.522 1.00 . A A . 21 GLY C 1 1 2 807 1 1 21 GLY CA C -1.396 8.087 4.100 1.00 . A A . 21 GLY CA 1 1 2 808 1 1 21 GLY H H 0.620 7.715 4.769 1.00 . A A . 21 GLY H 1 1 2 809 1 1 21 GLY HA2 H -1.726 8.180 5.125 1.00 . A A . 21 GLY HA2 1 1 2 810 1 1 21 GLY HA3 H -1.800 8.900 3.519 1.00 . A A . 21 GLY HA3 1 1 2 811 1 1 21 GLY N N 0.098 8.144 4.059 1.00 . A A . 21 GLY N 1 1 2 812 1 1 21 GLY O O -3.015 6.349 3.783 1.00 . A A . 21 GLY O 1 1 2 813 1 1 22 TYR C C -1.186 3.614 3.071 1.00 . A A . 22 TYR C 1 1 2 814 1 1 22 TYR CA C -1.541 4.778 2.139 1.00 . A A . 22 TYR CA 1 1 2 815 1 1 22 TYR CB C -0.777 4.647 0.813 1.00 . A A . 22 TYR CB 1 1 2 816 1 1 22 TYR CD1 C -2.136 6.706 0.183 1.00 . A A . 22 TYR CD1 1 1 2 817 1 1 22 TYR CD2 C -0.389 5.943 -1.316 1.00 . A A . 22 TYR CD2 1 1 2 818 1 1 22 TYR CE1 C -2.429 7.756 -0.694 1.00 . A A . 22 TYR CE1 1 1 2 819 1 1 22 TYR CE2 C -0.685 6.993 -2.193 1.00 . A A . 22 TYR CE2 1 1 2 820 1 1 22 TYR CG C -1.112 5.795 -0.126 1.00 . A A . 22 TYR CG 1 1 2 821 1 1 22 TYR CZ C -1.704 7.900 -1.883 1.00 . A A . 22 TYR CZ 1 1 2 822 1 1 22 TYR H H -0.200 6.423 2.533 1.00 . A A . 22 TYR H 1 1 2 823 1 1 22 TYR HA H -2.603 4.795 1.950 1.00 . A A . 22 TYR HA 1 1 2 824 1 1 22 TYR HB2 H 0.283 4.652 1.013 1.00 . A A . 22 TYR HB2 1 1 2 825 1 1 22 TYR HB3 H -1.045 3.713 0.341 1.00 . A A . 22 TYR HB3 1 1 2 826 1 1 22 TYR HD1 H -2.698 6.597 1.097 1.00 . A A . 22 TYR HD1 1 1 2 827 1 1 22 TYR HD2 H 0.399 5.245 -1.557 1.00 . A A . 22 TYR HD2 1 1 2 828 1 1 22 TYR HE1 H -3.215 8.455 -0.454 1.00 . A A . 22 TYR HE1 1 1 2 829 1 1 22 TYR HE2 H -0.125 7.106 -3.109 1.00 . A A . 22 TYR HE2 1 1 2 830 1 1 22 TYR HH H -2.714 8.649 -3.318 1.00 . A A . 22 TYR HH 1 1 2 831 1 1 22 TYR N N -1.094 6.077 2.736 1.00 . A A . 22 TYR N 1 1 2 832 1 1 22 TYR O O -0.221 3.669 3.810 1.00 . A A . 22 TYR O 1 1 2 833 1 1 22 TYR OH O -1.995 8.933 -2.748 1.00 . A A . 22 TYR OH 1 1 2 834 1 1 23 ALA C C -1.582 0.112 3.035 1.00 . A A . 23 ALA C 1 1 2 835 1 1 23 ALA CA C -1.685 1.377 3.897 1.00 . A A . 23 ALA CA 1 1 2 836 1 1 23 ALA CB C -2.886 1.289 4.841 1.00 . A A . 23 ALA CB 1 1 2 837 1 1 23 ALA H H -2.728 2.545 2.419 1.00 . A A . 23 ALA H 1 1 2 838 1 1 23 ALA HA H -0.778 1.524 4.462 1.00 . A A . 23 ALA HA 1 1 2 839 1 1 23 ALA HB1 H -2.747 0.466 5.528 1.00 . A A . 23 ALA HB1 1 1 2 840 1 1 23 ALA HB2 H -3.786 1.130 4.265 1.00 . A A . 23 ALA HB2 1 1 2 841 1 1 23 ALA HB3 H -2.975 2.211 5.397 1.00 . A A . 23 ALA HB3 1 1 2 842 1 1 23 ALA N N -1.961 2.560 3.030 1.00 . A A . 23 ALA N 1 1 2 843 1 1 23 ALA O O -2.303 -0.047 2.068 1.00 . A A . 23 ALA O 1 1 2 844 1 1 24 CYS C C -1.453 -3.135 3.095 1.00 . A A . 24 CYS C 1 1 2 845 1 1 24 CYS CA C -0.529 -2.034 2.568 1.00 . A A . 24 CYS CA 1 1 2 846 1 1 24 CYS CB C 0.940 -2.432 2.739 1.00 . A A . 24 CYS CB 1 1 2 847 1 1 24 CYS H H -0.116 -0.629 4.155 1.00 . A A . 24 CYS H 1 1 2 848 1 1 24 CYS HA H -0.737 -1.838 1.527 1.00 . A A . 24 CYS HA 1 1 2 849 1 1 24 CYS HB2 H 1.566 -1.716 2.232 1.00 . A A . 24 CYS HB2 1 1 2 850 1 1 24 CYS HB3 H 1.185 -2.446 3.790 1.00 . A A . 24 CYS HB3 1 1 2 851 1 1 24 CYS N N -0.688 -0.781 3.374 1.00 . A A . 24 CYS N 1 1 2 852 1 1 24 CYS O O -1.908 -3.096 4.224 1.00 . A A . 24 CYS O 1 1 2 853 1 1 24 CYS SG S 1.219 -4.075 2.036 1.00 . A A . 24 CYS SG 1 1 2 854 1 1 25 SER C C -2.079 -6.577 2.220 1.00 . A A . 25 SER C 1 1 2 855 1 1 25 SER CA C -2.626 -5.233 2.708 1.00 . A A . 25 SER CA 1 1 2 856 1 1 25 SER CB C -3.977 -4.939 2.054 1.00 . A A . 25 SER CB 1 1 2 857 1 1 25 SER H H -1.350 -4.121 1.373 1.00 . A A . 25 SER H 1 1 2 858 1 1 25 SER HA H -2.731 -5.239 3.779 1.00 . A A . 25 SER HA 1 1 2 859 1 1 25 SER HB2 H -3.865 -4.923 0.981 1.00 . A A . 25 SER HB2 1 1 2 860 1 1 25 SER HB3 H -4.681 -5.713 2.328 1.00 . A A . 25 SER HB3 1 1 2 861 1 1 25 SER HG H -4.366 -3.053 1.763 1.00 . A A . 25 SER HG 1 1 2 862 1 1 25 SER N N -1.730 -4.118 2.277 1.00 . A A . 25 SER N 1 1 2 863 1 1 25 SER O O -2.147 -6.894 1.047 1.00 . A A . 25 SER O 1 1 2 864 1 1 25 SER OG O -4.453 -3.671 2.493 1.00 . A A . 25 SER OG 1 1 2 865 1 1 26 LYS C C -2.152 -9.674 2.386 1.00 . A A . 26 LYS C 1 1 2 866 1 1 26 LYS CA C -1.001 -8.708 2.698 1.00 . A A . 26 LYS CA 1 1 2 867 1 1 26 LYS CB C -0.166 -9.212 3.883 1.00 . A A . 26 LYS CB 1 1 2 868 1 1 26 LYS CD C -1.373 -10.787 5.409 1.00 . A A . 26 LYS CD 1 1 2 869 1 1 26 LYS CE C -2.034 -10.920 6.784 1.00 . A A . 26 LYS CE 1 1 2 870 1 1 26 LYS CG C -1.024 -9.320 5.149 1.00 . A A . 26 LYS CG 1 1 2 871 1 1 26 LYS H H -1.499 -7.098 4.052 1.00 . A A . 26 LYS H 1 1 2 872 1 1 26 LYS HA H -0.370 -8.596 1.831 1.00 . A A . 26 LYS HA 1 1 2 873 1 1 26 LYS HB2 H 0.238 -10.184 3.645 1.00 . A A . 26 LYS HB2 1 1 2 874 1 1 26 LYS HB3 H 0.644 -8.524 4.063 1.00 . A A . 26 LYS HB3 1 1 2 875 1 1 26 LYS HD2 H -2.053 -11.136 4.646 1.00 . A A . 26 LYS HD2 1 1 2 876 1 1 26 LYS HD3 H -0.471 -11.382 5.388 1.00 . A A . 26 LYS HD3 1 1 2 877 1 1 26 LYS HE2 H -2.636 -10.048 6.995 1.00 . A A . 26 LYS HE2 1 1 2 878 1 1 26 LYS HE3 H -2.639 -11.814 6.825 1.00 . A A . 26 LYS HE3 1 1 2 879 1 1 26 LYS HG2 H -0.471 -8.927 5.991 1.00 . A A . 26 LYS HG2 1 1 2 880 1 1 26 LYS HG3 H -1.932 -8.753 5.021 1.00 . A A . 26 LYS HG3 1 1 2 881 1 1 26 LYS HZ1 H -0.317 -10.169 7.695 1.00 . A A . 26 LYS HZ1 1 1 2 882 1 1 26 LYS HZ2 H -0.331 -11.861 7.529 1.00 . A A . 26 LYS HZ2 1 1 2 883 1 1 26 LYS HZ3 H -1.285 -11.114 8.718 1.00 . A A . 26 LYS HZ3 1 1 2 884 1 1 26 LYS N N -1.541 -7.373 3.112 1.00 . A A . 26 LYS N 1 1 2 885 1 1 26 LYS NZ N -0.907 -11.024 7.754 1.00 . A A . 26 LYS NZ 1 1 2 886 1 1 26 LYS O O -2.048 -10.511 1.510 1.00 . A A . 26 LYS O 1 1 2 887 1 1 27 THR C C -5.037 -10.116 1.458 1.00 . A A . 27 THR C 1 1 2 888 1 1 27 THR CA C -4.425 -10.447 2.824 1.00 . A A . 27 THR CA 1 1 2 889 1 1 27 THR CB C -5.432 -10.155 3.943 1.00 . A A . 27 THR CB 1 1 2 890 1 1 27 THR CG2 C -6.536 -11.220 3.932 1.00 . A A . 27 THR CG2 1 1 2 891 1 1 27 THR H H -3.310 -8.860 3.778 1.00 . A A . 27 THR H 1 1 2 892 1 1 27 THR HA H -4.122 -11.480 2.859 1.00 . A A . 27 THR HA 1 1 2 893 1 1 27 THR HB H -5.876 -9.183 3.783 1.00 . A A . 27 THR HB 1 1 2 894 1 1 27 THR HG1 H -4.903 -9.321 5.620 1.00 . A A . 27 THR HG1 1 1 2 895 1 1 27 THR HG21 H -6.798 -11.459 2.912 1.00 . A A . 27 THR HG21 1 1 2 896 1 1 27 THR HG22 H -7.408 -10.840 4.445 1.00 . A A . 27 THR HG22 1 1 2 897 1 1 27 THR HG23 H -6.185 -12.109 4.432 1.00 . A A . 27 THR HG23 1 1 2 898 1 1 27 THR N N -3.253 -9.550 3.087 1.00 . A A . 27 THR N 1 1 2 899 1 1 27 THR O O -5.479 -10.989 0.738 1.00 . A A . 27 THR O 1 1 2 900 1 1 27 THR OG1 O -4.768 -10.174 5.200 1.00 . A A . 27 THR OG1 1 1 2 901 1 1 28 TRP C C -4.566 -8.603 -1.308 1.00 . A A . 28 TRP C 1 1 2 902 1 1 28 TRP CA C -5.630 -8.448 -0.215 1.00 . A A . 28 TRP CA 1 1 2 903 1 1 28 TRP CB C -6.024 -6.973 -0.049 1.00 . A A . 28 TRP CB 1 1 2 904 1 1 28 TRP CD1 C -7.668 -7.828 1.693 1.00 . A A . 28 TRP CD1 1 1 2 905 1 1 28 TRP CD2 C -7.511 -5.584 1.668 1.00 . A A . 28 TRP CD2 1 1 2 906 1 1 28 TRP CE2 C -8.450 -5.917 2.672 1.00 . A A . 28 TRP CE2 1 1 2 907 1 1 28 TRP CE3 C -7.231 -4.225 1.447 1.00 . A A . 28 TRP CE3 1 1 2 908 1 1 28 TRP CG C -7.027 -6.815 1.058 1.00 . A A . 28 TRP CG 1 1 2 909 1 1 28 TRP CH2 C -8.795 -3.589 3.201 1.00 . A A . 28 TRP CH2 1 1 2 910 1 1 28 TRP CZ2 C -9.085 -4.934 3.433 1.00 . A A . 28 TRP CZ2 1 1 2 911 1 1 28 TRP CZ3 C -7.867 -3.233 2.211 1.00 . A A . 28 TRP CZ3 1 1 2 912 1 1 28 TRP H H -4.688 -8.176 1.706 1.00 . A A . 28 TRP H 1 1 2 913 1 1 28 TRP HA H -6.500 -9.041 -0.447 1.00 . A A . 28 TRP HA 1 1 2 914 1 1 28 TRP HB2 H -5.145 -6.393 0.183 1.00 . A A . 28 TRP HB2 1 1 2 915 1 1 28 TRP HB3 H -6.452 -6.615 -0.971 1.00 . A A . 28 TRP HB3 1 1 2 916 1 1 28 TRP HD1 H -7.540 -8.881 1.485 1.00 . A A . 28 TRP HD1 1 1 2 917 1 1 28 TRP HE1 H -9.082 -7.814 3.252 1.00 . A A . 28 TRP HE1 1 1 2 918 1 1 28 TRP HE3 H -6.517 -3.941 0.687 1.00 . A A . 28 TRP HE3 1 1 2 919 1 1 28 TRP HH2 H -9.283 -2.822 3.783 1.00 . A A . 28 TRP HH2 1 1 2 920 1 1 28 TRP HZ2 H -9.799 -5.213 4.193 1.00 . A A . 28 TRP HZ2 1 1 2 921 1 1 28 TRP HZ3 H -7.645 -2.192 2.032 1.00 . A A . 28 TRP HZ3 1 1 2 922 1 1 28 TRP N N -5.056 -8.856 1.104 1.00 . A A . 28 TRP N 1 1 2 923 1 1 28 TRP NE1 N -8.508 -7.295 2.652 1.00 . A A . 28 TRP NE1 1 1 2 924 1 1 28 TRP O O -4.851 -9.048 -2.404 1.00 . A A . 28 TRP O 1 1 2 925 1 1 29 GLY C C -1.890 -7.015 -2.625 1.00 . A A . 29 GLY C 1 1 2 926 1 1 29 GLY CA C -2.242 -8.379 -2.009 1.00 . A A . 29 GLY CA 1 1 2 927 1 1 29 GLY H H -3.139 -7.898 -0.112 1.00 . A A . 29 GLY H 1 1 2 928 1 1 29 GLY HA2 H -1.366 -8.785 -1.522 1.00 . A A . 29 GLY HA2 1 1 2 929 1 1 29 GLY HA3 H -2.555 -9.050 -2.794 1.00 . A A . 29 GLY HA3 1 1 2 930 1 1 29 GLY N N -3.340 -8.247 -1.008 1.00 . A A . 29 GLY N 1 1 2 931 1 1 29 GLY O O -1.220 -6.955 -3.638 1.00 . A A . 29 GLY O 1 1 2 932 1 1 30 TRP C C -1.922 -3.492 -1.551 1.00 . A A . 30 TRP C 1 1 2 933 1 1 30 TRP CA C -1.984 -4.587 -2.629 1.00 . A A . 30 TRP CA 1 1 2 934 1 1 30 TRP CB C -3.089 -4.305 -3.665 1.00 . A A . 30 TRP CB 1 1 2 935 1 1 30 TRP CD1 C -4.567 -2.712 -2.367 1.00 . A A . 30 TRP CD1 1 1 2 936 1 1 30 TRP CD2 C -5.620 -4.625 -2.904 1.00 . A A . 30 TRP CD2 1 1 2 937 1 1 30 TRP CE2 C -6.548 -3.835 -2.188 1.00 . A A . 30 TRP CE2 1 1 2 938 1 1 30 TRP CE3 C -6.036 -5.888 -3.361 1.00 . A A . 30 TRP CE3 1 1 2 939 1 1 30 TRP CG C -4.364 -3.892 -2.997 1.00 . A A . 30 TRP CG 1 1 2 940 1 1 30 TRP CH2 C -8.246 -5.534 -2.400 1.00 . A A . 30 TRP CH2 1 1 2 941 1 1 30 TRP CZ2 C -7.847 -4.278 -1.937 1.00 . A A . 30 TRP CZ2 1 1 2 942 1 1 30 TRP CZ3 C -7.344 -6.337 -3.111 1.00 . A A . 30 TRP CZ3 1 1 2 943 1 1 30 TRP H H -2.859 -5.972 -1.215 1.00 . A A . 30 TRP H 1 1 2 944 1 1 30 TRP HA H -1.033 -4.649 -3.133 1.00 . A A . 30 TRP HA 1 1 2 945 1 1 30 TRP HB2 H -2.764 -3.514 -4.323 1.00 . A A . 30 TRP HB2 1 1 2 946 1 1 30 TRP HB3 H -3.264 -5.198 -4.247 1.00 . A A . 30 TRP HB3 1 1 2 947 1 1 30 TRP HD1 H -3.836 -1.927 -2.253 1.00 . A A . 30 TRP HD1 1 1 2 948 1 1 30 TRP HE1 H -6.250 -1.939 -1.382 1.00 . A A . 30 TRP HE1 1 1 2 949 1 1 30 TRP HE3 H -5.350 -6.515 -3.909 1.00 . A A . 30 TRP HE3 1 1 2 950 1 1 30 TRP HH2 H -9.249 -5.884 -2.210 1.00 . A A . 30 TRP HH2 1 1 2 951 1 1 30 TRP HZ2 H -8.538 -3.654 -1.388 1.00 . A A . 30 TRP HZ2 1 1 2 952 1 1 30 TRP HZ3 H -7.656 -7.308 -3.468 1.00 . A A . 30 TRP HZ3 1 1 2 953 1 1 30 TRP N N -2.324 -5.920 -2.037 1.00 . A A . 30 TRP N 1 1 2 954 1 1 30 TRP NE1 N -5.857 -2.681 -1.881 1.00 . A A . 30 TRP NE1 1 1 2 955 1 1 30 TRP O O -2.183 -3.732 -0.388 1.00 . A A . 30 TRP O 1 1 2 956 1 1 31 CYS C C -2.364 0.015 -1.499 1.00 . A A . 31 CYS C 1 1 2 957 1 1 31 CYS CA C -1.509 -1.150 -0.985 1.00 . A A . 31 CYS CA 1 1 2 958 1 1 31 CYS CB C -0.030 -0.754 -0.939 1.00 . A A . 31 CYS CB 1 1 2 959 1 1 31 CYS H H -1.397 -2.132 -2.898 1.00 . A A . 31 CYS H 1 1 2 960 1 1 31 CYS HA H -1.840 -1.459 -0.005 1.00 . A A . 31 CYS HA 1 1 2 961 1 1 31 CYS HB2 H 0.578 -1.637 -0.831 1.00 . A A . 31 CYS HB2 1 1 2 962 1 1 31 CYS HB3 H 0.234 -0.243 -1.855 1.00 . A A . 31 CYS HB3 1 1 2 963 1 1 31 CYS N N -1.587 -2.288 -1.950 1.00 . A A . 31 CYS N 1 1 2 964 1 1 31 CYS O O -2.210 0.457 -2.624 1.00 . A A . 31 CYS O 1 1 2 965 1 1 31 CYS SG S 0.257 0.350 0.465 1.00 . A A . 31 CYS SG 1 1 2 966 1 1 32 ALA C C -4.329 2.641 0.016 1.00 . A A . 32 ALA C 1 1 2 967 1 1 32 ALA CA C -4.137 1.638 -1.126 1.00 . A A . 32 ALA CA 1 1 2 968 1 1 32 ALA CB C -5.470 0.984 -1.497 1.00 . A A . 32 ALA CB 1 1 2 969 1 1 32 ALA H H -3.368 0.130 0.213 1.00 . A A . 32 ALA H 1 1 2 970 1 1 32 ALA HA H -3.714 2.129 -1.989 1.00 . A A . 32 ALA HA 1 1 2 971 1 1 32 ALA HB1 H -6.190 1.750 -1.740 1.00 . A A . 32 ALA HB1 1 1 2 972 1 1 32 ALA HB2 H -5.831 0.403 -0.661 1.00 . A A . 32 ALA HB2 1 1 2 973 1 1 32 ALA HB3 H -5.328 0.338 -2.351 1.00 . A A . 32 ALA HB3 1 1 2 974 1 1 32 ALA N N -3.263 0.507 -0.688 1.00 . A A . 32 ALA N 1 1 2 975 1 1 32 ALA O O -3.839 2.448 1.111 1.00 . A A . 32 ALA O 1 1 2 976 1 1 33 VAL C C -6.189 4.166 1.921 1.00 . A A . 33 VAL C 1 1 2 977 1 1 33 VAL CA C -5.269 4.733 0.834 1.00 . A A . 33 VAL CA 1 1 2 978 1 1 33 VAL CB C -5.943 5.923 0.138 1.00 . A A . 33 VAL CB 1 1 2 979 1 1 33 VAL CG1 C -6.000 7.110 1.103 1.00 . A A . 33 VAL CG1 1 1 2 980 1 1 33 VAL CG2 C -5.145 6.326 -1.109 1.00 . A A . 33 VAL CG2 1 1 2 981 1 1 33 VAL H H -5.426 3.841 -1.128 1.00 . A A . 33 VAL H 1 1 2 982 1 1 33 VAL HA H -4.328 5.041 1.263 1.00 . A A . 33 VAL HA 1 1 2 983 1 1 33 VAL HB H -6.947 5.646 -0.150 1.00 . A A . 33 VAL HB 1 1 2 984 1 1 33 VAL HG11 H -6.857 7.005 1.752 1.00 . A A . 33 VAL HG11 1 1 2 985 1 1 33 VAL HG12 H -6.085 8.027 0.540 1.00 . A A . 33 VAL HG12 1 1 2 986 1 1 33 VAL HG13 H -5.099 7.134 1.698 1.00 . A A . 33 VAL HG13 1 1 2 987 1 1 33 VAL HG21 H -5.648 5.962 -1.991 1.00 . A A . 33 VAL HG21 1 1 2 988 1 1 33 VAL HG22 H -4.155 5.897 -1.057 1.00 . A A . 33 VAL HG22 1 1 2 989 1 1 33 VAL HG23 H -5.070 7.402 -1.156 1.00 . A A . 33 VAL HG23 1 1 2 990 1 1 33 VAL N N -5.041 3.711 -0.235 1.00 . A A . 33 VAL N 1 1 2 991 1 1 33 VAL O O -7.179 3.518 1.631 1.00 . A A . 33 VAL O 1 1 2 992 1 1 34 GLU C C -7.758 4.956 4.706 1.00 . A A . 34 GLU C 1 1 2 993 1 1 34 GLU CA C -6.736 3.889 4.280 1.00 . A A . 34 GLU CA 1 1 2 994 1 1 34 GLU CB C -5.771 3.554 5.428 1.00 . A A . 34 GLU CB 1 1 2 995 1 1 34 GLU CD C -4.907 4.878 7.373 1.00 . A A . 34 GLU CD 1 1 2 996 1 1 34 GLU CG C -4.981 4.803 5.846 1.00 . A A . 34 GLU CG 1 1 2 997 1 1 34 GLU H H -5.076 4.939 3.377 1.00 . A A . 34 GLU H 1 1 2 998 1 1 34 GLU HA H -7.247 2.994 3.962 1.00 . A A . 34 GLU HA 1 1 2 999 1 1 34 GLU HB2 H -6.335 3.188 6.273 1.00 . A A . 34 GLU HB2 1 1 2 1000 1 1 34 GLU HB3 H -5.081 2.790 5.101 1.00 . A A . 34 GLU HB3 1 1 2 1001 1 1 34 GLU HG2 H -3.982 4.747 5.439 1.00 . A A . 34 GLU HG2 1 1 2 1002 1 1 34 GLU HG3 H -5.474 5.685 5.467 1.00 . A A . 34 GLU HG3 1 1 2 1003 1 1 34 GLU N N -5.875 4.410 3.170 1.00 . A A . 34 GLU N 1 1 2 1004 1 1 34 GLU O O -7.883 5.282 5.872 1.00 . A A . 34 GLU O 1 1 2 1005 1 1 34 GLU OE1 O -3.977 4.316 7.929 1.00 . A A . 34 GLU OE1 1 1 2 1006 1 1 34 GLU OE2 O -5.779 5.498 7.960 1.00 . A A . 34 GLU OE2 1 1 2 1007 1 1 35 ALA C C -10.815 5.860 4.569 1.00 . A A . 35 ALA C 1 1 2 1008 1 1 35 ALA CA C -9.517 6.534 4.109 1.00 . A A . 35 ALA CA 1 1 2 1009 1 1 35 ALA CB C -9.744 7.318 2.813 1.00 . A A . 35 ALA CB 1 1 2 1010 1 1 35 ALA H H -8.383 5.212 2.834 1.00 . A A . 35 ALA H 1 1 2 1011 1 1 35 ALA HA H -9.139 7.192 4.876 1.00 . A A . 35 ALA HA 1 1 2 1012 1 1 35 ALA HB1 H -8.909 7.164 2.147 1.00 . A A . 35 ALA HB1 1 1 2 1013 1 1 35 ALA HB2 H -9.834 8.370 3.039 1.00 . A A . 35 ALA HB2 1 1 2 1014 1 1 35 ALA HB3 H -10.651 6.974 2.338 1.00 . A A . 35 ALA HB3 1 1 2 1015 1 1 35 ALA N N -8.496 5.495 3.766 1.00 . A A . 35 ALA N 1 1 2 1016 1 1 35 ALA O O -11.452 5.161 3.802 1.00 . A A . 35 ALA O 1 1 2 1017 1 1 36 PRO C C -13.653 6.147 5.778 1.00 . A A . 36 PRO C 1 1 2 1018 1 1 36 PRO CA C -12.403 5.488 6.378 1.00 . A A . 36 PRO CA 1 1 2 1019 1 1 36 PRO CB C -12.292 5.776 7.874 1.00 . A A . 36 PRO CB 1 1 2 1020 1 1 36 PRO CD C -10.460 6.918 6.802 1.00 . A A . 36 PRO CD 1 1 2 1021 1 1 36 PRO CG C -11.405 6.975 7.973 1.00 . A A . 36 PRO CG 1 1 2 1022 1 1 36 PRO HA H -12.416 4.424 6.208 1.00 . A A . 36 PRO HA 1 1 2 1023 1 1 36 PRO HB2 H -13.269 5.993 8.285 1.00 . A A . 36 PRO HB2 1 1 2 1024 1 1 36 PRO HB3 H -11.844 4.940 8.387 1.00 . A A . 36 PRO HB3 1 1 2 1025 1 1 36 PRO HD2 H -10.282 7.911 6.412 1.00 . A A . 36 PRO HD2 1 1 2 1026 1 1 36 PRO HD3 H -9.532 6.448 7.083 1.00 . A A . 36 PRO HD3 1 1 2 1027 1 1 36 PRO HG2 H -11.999 7.877 7.929 1.00 . A A . 36 PRO HG2 1 1 2 1028 1 1 36 PRO HG3 H -10.844 6.943 8.894 1.00 . A A . 36 PRO HG3 1 1 2 1029 1 1 36 PRO N N -11.166 6.090 5.813 1.00 . A A . 36 PRO N 1 1 2 1030 1 1 36 PRO O O -14.547 5.416 5.385 1.00 . A A . 36 PRO O 1 1 3 1031 1 1 1 ASP C C 13.446 3.160 -1.916 1.00 . A A . 1 ASP C 1 1 3 1032 1 1 1 ASP CA C 14.938 3.480 -1.749 1.00 . A A . 1 ASP CA 1 1 3 1033 1 1 1 ASP CB C 15.378 3.307 -0.289 1.00 . A A . 1 ASP CB 1 1 3 1034 1 1 1 ASP CG C 15.676 1.830 -0.010 1.00 . A A . 1 ASP CG 1 1 3 1035 1 1 1 ASP H1 H 15.033 5.087 -3.077 1.00 . A A . 1 ASP H1 1 1 3 1036 1 1 1 ASP H2 H 16.183 5.154 -1.830 1.00 . A A . 1 ASP H2 1 1 3 1037 1 1 1 ASP H3 H 14.555 5.519 -1.507 1.00 . A A . 1 ASP H3 1 1 3 1038 1 1 1 ASP HA H 15.531 2.844 -2.389 1.00 . A A . 1 ASP HA 1 1 3 1039 1 1 1 ASP HB2 H 16.268 3.892 -0.113 1.00 . A A . 1 ASP HB2 1 1 3 1040 1 1 1 ASP HB3 H 14.591 3.644 0.368 1.00 . A A . 1 ASP HB3 1 1 3 1041 1 1 1 ASP N N 15.198 4.919 -2.064 1.00 . A A . 1 ASP N 1 1 3 1042 1 1 1 ASP O O 12.736 2.921 -0.954 1.00 . A A . 1 ASP O 1 1 3 1043 1 1 1 ASP OD1 O 14.734 1.083 0.202 1.00 . A A . 1 ASP OD1 1 1 3 1044 1 1 1 ASP OD2 O 16.843 1.472 -0.012 1.00 . A A . 1 ASP OD2 1 1 3 1045 1 1 2 GLY C C 10.713 4.149 -3.359 1.00 . A A . 2 GLY C 1 1 3 1046 1 1 2 GLY CA C 11.526 2.851 -3.375 1.00 . A A . 2 GLY CA 1 1 3 1047 1 1 2 GLY H H 13.557 3.350 -3.894 1.00 . A A . 2 GLY H 1 1 3 1048 1 1 2 GLY HA2 H 11.418 2.368 -4.336 1.00 . A A . 2 GLY HA2 1 1 3 1049 1 1 2 GLY HA3 H 11.163 2.194 -2.599 1.00 . A A . 2 GLY HA3 1 1 3 1050 1 1 2 GLY N N 12.967 3.155 -3.135 1.00 . A A . 2 GLY N 1 1 3 1051 1 1 2 GLY O O 10.763 4.914 -2.414 1.00 . A A . 2 GLY O 1 1 3 1052 1 1 3 GLU C C 7.800 5.431 -3.736 1.00 . A A . 3 GLU C 1 1 3 1053 1 1 3 GLU CA C 9.134 5.644 -4.462 1.00 . A A . 3 GLU CA 1 1 3 1054 1 1 3 GLU CB C 8.903 5.899 -5.957 1.00 . A A . 3 GLU CB 1 1 3 1055 1 1 3 GLU CD C 8.550 7.786 -7.562 1.00 . A A . 3 GLU CD 1 1 3 1056 1 1 3 GLU CG C 9.288 7.342 -6.297 1.00 . A A . 3 GLU CG 1 1 3 1057 1 1 3 GLU H H 9.938 3.761 -5.149 1.00 . A A . 3 GLU H 1 1 3 1058 1 1 3 GLU HA H 9.667 6.473 -4.027 1.00 . A A . 3 GLU HA 1 1 3 1059 1 1 3 GLU HB2 H 9.510 5.219 -6.537 1.00 . A A . 3 GLU HB2 1 1 3 1060 1 1 3 GLU HB3 H 7.861 5.742 -6.193 1.00 . A A . 3 GLU HB3 1 1 3 1061 1 1 3 GLU HG2 H 9.018 7.989 -5.475 1.00 . A A . 3 GLU HG2 1 1 3 1062 1 1 3 GLU HG3 H 10.353 7.400 -6.465 1.00 . A A . 3 GLU HG3 1 1 3 1063 1 1 3 GLU N N 9.961 4.398 -4.404 1.00 . A A . 3 GLU N 1 1 3 1064 1 1 3 GLU O O 7.629 4.470 -3.008 1.00 . A A . 3 GLU O 1 1 3 1065 1 1 3 GLU OE1 O 7.408 8.203 -7.444 1.00 . A A . 3 GLU OE1 1 1 3 1066 1 1 3 GLU OE2 O 9.138 7.706 -8.628 1.00 . A A . 3 GLU OE2 1 1 3 1067 1 1 4 CYS C C 4.593 5.310 -4.115 1.00 . A A . 4 CYS C 1 1 3 1068 1 1 4 CYS CA C 5.533 6.163 -3.248 1.00 . A A . 4 CYS CA 1 1 3 1069 1 1 4 CYS CB C 4.999 7.594 -3.063 1.00 . A A . 4 CYS CB 1 1 3 1070 1 1 4 CYS H H 7.018 7.082 -4.521 1.00 . A A . 4 CYS H 1 1 3 1071 1 1 4 CYS HA H 5.667 5.700 -2.281 1.00 . A A . 4 CYS HA 1 1 3 1072 1 1 4 CYS HB2 H 4.727 7.739 -2.029 1.00 . A A . 4 CYS HB2 1 1 3 1073 1 1 4 CYS HB3 H 5.771 8.300 -3.329 1.00 . A A . 4 CYS HB3 1 1 3 1074 1 1 4 CYS N N 6.856 6.317 -3.930 1.00 . A A . 4 CYS N 1 1 3 1075 1 1 4 CYS O O 4.702 5.283 -5.329 1.00 . A A . 4 CYS O 1 1 3 1076 1 1 4 CYS SG S 3.542 7.877 -4.105 1.00 . A A . 4 CYS SG 1 1 3 1077 1 1 5 GLY C C 1.637 4.587 -4.894 1.00 . A A . 5 GLY C 1 1 3 1078 1 1 5 GLY CA C 2.737 3.738 -4.250 1.00 . A A . 5 GLY CA 1 1 3 1079 1 1 5 GLY H H 3.634 4.643 -2.518 1.00 . A A . 5 GLY H 1 1 3 1080 1 1 5 GLY HA2 H 3.280 3.206 -5.018 1.00 . A A . 5 GLY HA2 1 1 3 1081 1 1 5 GLY HA3 H 2.288 3.027 -3.573 1.00 . A A . 5 GLY HA3 1 1 3 1082 1 1 5 GLY N N 3.685 4.606 -3.492 1.00 . A A . 5 GLY N 1 1 3 1083 1 1 5 GLY O O 1.847 5.732 -5.249 1.00 . A A . 5 GLY O 1 1 3 1084 1 1 6 GLY C C -1.964 4.495 -4.925 1.00 . A A . 6 GLY C 1 1 3 1085 1 1 6 GLY CA C -0.659 4.793 -5.673 1.00 . A A . 6 GLY CA 1 1 3 1086 1 1 6 GLY H H 0.320 3.103 -4.761 1.00 . A A . 6 GLY H 1 1 3 1087 1 1 6 GLY HA2 H -0.446 5.851 -5.623 1.00 . A A . 6 GLY HA2 1 1 3 1088 1 1 6 GLY HA3 H -0.765 4.497 -6.706 1.00 . A A . 6 GLY HA3 1 1 3 1089 1 1 6 GLY N N 0.463 4.029 -5.050 1.00 . A A . 6 GLY N 1 1 3 1090 1 1 6 GLY O O -1.988 4.411 -3.712 1.00 . A A . 6 GLY O 1 1 3 1091 1 1 7 PHE C C -4.594 2.542 -4.833 1.00 . A A . 7 PHE C 1 1 3 1092 1 1 7 PHE CA C -4.363 4.055 -4.980 1.00 . A A . 7 PHE CA 1 1 3 1093 1 1 7 PHE CB C -5.416 4.680 -5.902 1.00 . A A . 7 PHE CB 1 1 3 1094 1 1 7 PHE CD1 C -4.478 7.025 -5.832 1.00 . A A . 7 PHE CD1 1 1 3 1095 1 1 7 PHE CD2 C -6.744 6.651 -5.052 1.00 . A A . 7 PHE CD2 1 1 3 1096 1 1 7 PHE CE1 C -4.603 8.388 -5.538 1.00 . A A . 7 PHE CE1 1 1 3 1097 1 1 7 PHE CE2 C -6.868 8.014 -4.759 1.00 . A A . 7 PHE CE2 1 1 3 1098 1 1 7 PHE CG C -5.550 6.154 -5.589 1.00 . A A . 7 PHE CG 1 1 3 1099 1 1 7 PHE CZ C -5.796 8.883 -5.002 1.00 . A A . 7 PHE CZ 1 1 3 1100 1 1 7 PHE H H -3.002 4.418 -6.619 1.00 . A A . 7 PHE H 1 1 3 1101 1 1 7 PHE HA H -4.402 4.532 -4.012 1.00 . A A . 7 PHE HA 1 1 3 1102 1 1 7 PHE HB2 H -5.112 4.556 -6.932 1.00 . A A . 7 PHE HB2 1 1 3 1103 1 1 7 PHE HB3 H -6.367 4.192 -5.745 1.00 . A A . 7 PHE HB3 1 1 3 1104 1 1 7 PHE HD1 H -3.558 6.644 -6.245 1.00 . A A . 7 PHE HD1 1 1 3 1105 1 1 7 PHE HD2 H -7.570 5.981 -4.864 1.00 . A A . 7 PHE HD2 1 1 3 1106 1 1 7 PHE HE1 H -3.775 9.058 -5.725 1.00 . A A . 7 PHE HE1 1 1 3 1107 1 1 7 PHE HE2 H -7.789 8.397 -4.346 1.00 . A A . 7 PHE HE2 1 1 3 1108 1 1 7 PHE HZ H -5.891 9.936 -4.776 1.00 . A A . 7 PHE HZ 1 1 3 1109 1 1 7 PHE N N -3.049 4.342 -5.642 1.00 . A A . 7 PHE N 1 1 3 1110 1 1 7 PHE O O -5.403 2.112 -4.032 1.00 . A A . 7 PHE O 1 1 3 1111 1 1 8 TRP C C -2.861 -0.462 -6.119 1.00 . A A . 8 TRP C 1 1 3 1112 1 1 8 TRP CA C -4.071 0.250 -5.491 1.00 . A A . 8 TRP CA 1 1 3 1113 1 1 8 TRP CB C -5.360 -0.049 -6.272 1.00 . A A . 8 TRP CB 1 1 3 1114 1 1 8 TRP CD1 C -5.174 -2.368 -5.244 1.00 . A A . 8 TRP CD1 1 1 3 1115 1 1 8 TRP CD2 C -7.027 -2.112 -6.492 1.00 . A A . 8 TRP CD2 1 1 3 1116 1 1 8 TRP CE2 C -7.055 -3.434 -5.991 1.00 . A A . 8 TRP CE2 1 1 3 1117 1 1 8 TRP CE3 C -8.089 -1.694 -7.314 1.00 . A A . 8 TRP CE3 1 1 3 1118 1 1 8 TRP CG C -5.823 -1.453 -6.006 1.00 . A A . 8 TRP CG 1 1 3 1119 1 1 8 TRP CH2 C -9.144 -3.878 -7.112 1.00 . A A . 8 TRP CH2 1 1 3 1120 1 1 8 TRP CZ2 C -8.098 -4.310 -6.293 1.00 . A A . 8 TRP CZ2 1 1 3 1121 1 1 8 TRP CZ3 C -9.141 -2.572 -7.620 1.00 . A A . 8 TRP CZ3 1 1 3 1122 1 1 8 TRP H H -3.246 2.101 -6.231 1.00 . A A . 8 TRP H 1 1 3 1123 1 1 8 TRP HA H -4.188 -0.044 -4.461 1.00 . A A . 8 TRP HA 1 1 3 1124 1 1 8 TRP HB2 H -6.130 0.643 -5.964 1.00 . A A . 8 TRP HB2 1 1 3 1125 1 1 8 TRP HB3 H -5.175 0.072 -7.328 1.00 . A A . 8 TRP HB3 1 1 3 1126 1 1 8 TRP HD1 H -4.240 -2.207 -4.726 1.00 . A A . 8 TRP HD1 1 1 3 1127 1 1 8 TRP HE1 H -5.653 -4.362 -4.761 1.00 . A A . 8 TRP HE1 1 1 3 1128 1 1 8 TRP HE3 H -8.096 -0.689 -7.711 1.00 . A A . 8 TRP HE3 1 1 3 1129 1 1 8 TRP HH2 H -9.955 -4.549 -7.351 1.00 . A A . 8 TRP HH2 1 1 3 1130 1 1 8 TRP HZ2 H -8.096 -5.315 -5.898 1.00 . A A . 8 TRP HZ2 1 1 3 1131 1 1 8 TRP HZ3 H -9.951 -2.241 -8.253 1.00 . A A . 8 TRP HZ3 1 1 3 1132 1 1 8 TRP N N -3.892 1.734 -5.593 1.00 . A A . 8 TRP N 1 1 3 1133 1 1 8 TRP NE1 N -5.904 -3.542 -5.236 1.00 . A A . 8 TRP NE1 1 1 3 1134 1 1 8 TRP O O -2.978 -1.148 -7.118 1.00 . A A . 8 TRP O 1 1 3 1135 1 1 9 TRP C C -0.197 -2.260 -5.326 1.00 . A A . 9 TRP C 1 1 3 1136 1 1 9 TRP CA C -0.470 -0.956 -6.086 1.00 . A A . 9 TRP CA 1 1 3 1137 1 1 9 TRP CB C 0.666 0.051 -5.853 1.00 . A A . 9 TRP CB 1 1 3 1138 1 1 9 TRP CD1 C -0.629 1.672 -7.324 1.00 . A A . 9 TRP CD1 1 1 3 1139 1 1 9 TRP CD2 C 1.580 2.095 -7.295 1.00 . A A . 9 TRP CD2 1 1 3 1140 1 1 9 TRP CE2 C 0.987 3.068 -8.134 1.00 . A A . 9 TRP CE2 1 1 3 1141 1 1 9 TRP CE3 C 2.973 2.142 -7.110 1.00 . A A . 9 TRP CE3 1 1 3 1142 1 1 9 TRP CG C 0.532 1.220 -6.786 1.00 . A A . 9 TRP CG 1 1 3 1143 1 1 9 TRP CH2 C 3.128 4.085 -8.568 1.00 . A A . 9 TRP CH2 1 1 3 1144 1 1 9 TRP CZ2 C 1.746 4.052 -8.763 1.00 . A A . 9 TRP CZ2 1 1 3 1145 1 1 9 TRP CZ3 C 3.741 3.130 -7.745 1.00 . A A . 9 TRP CZ3 1 1 3 1146 1 1 9 TRP H H -1.633 0.262 -4.730 1.00 . A A . 9 TRP H 1 1 3 1147 1 1 9 TRP HA H -0.584 -1.149 -7.141 1.00 . A A . 9 TRP HA 1 1 3 1148 1 1 9 TRP HB2 H 0.624 0.408 -4.832 1.00 . A A . 9 TRP HB2 1 1 3 1149 1 1 9 TRP HB3 H 1.615 -0.434 -6.022 1.00 . A A . 9 TRP HB3 1 1 3 1150 1 1 9 TRP HD1 H -1.606 1.248 -7.156 1.00 . A A . 9 TRP HD1 1 1 3 1151 1 1 9 TRP HE1 H -1.025 3.281 -8.620 1.00 . A A . 9 TRP HE1 1 1 3 1152 1 1 9 TRP HE3 H 3.454 1.411 -6.478 1.00 . A A . 9 TRP HE3 1 1 3 1153 1 1 9 TRP HH2 H 3.724 4.842 -9.054 1.00 . A A . 9 TRP HH2 1 1 3 1154 1 1 9 TRP HZ2 H 1.267 4.785 -9.392 1.00 . A A . 9 TRP HZ2 1 1 3 1155 1 1 9 TRP HZ3 H 4.811 3.158 -7.595 1.00 . A A . 9 TRP HZ3 1 1 3 1156 1 1 9 TRP N N -1.699 -0.297 -5.534 1.00 . A A . 9 TRP N 1 1 3 1157 1 1 9 TRP NE1 N -0.357 2.767 -8.119 1.00 . A A . 9 TRP NE1 1 1 3 1158 1 1 9 TRP O O -0.713 -2.469 -4.251 1.00 . A A . 9 TRP O 1 1 3 1159 1 1 10 LYS C C 2.116 -4.304 -4.269 1.00 . A A . 10 LYS C 1 1 3 1160 1 1 10 LYS CA C 0.883 -4.433 -5.166 1.00 . A A . 10 LYS CA 1 1 3 1161 1 1 10 LYS CB C 1.151 -5.457 -6.268 1.00 . A A . 10 LYS CB 1 1 3 1162 1 1 10 LYS CD C -1.124 -5.522 -7.322 1.00 . A A . 10 LYS CD 1 1 3 1163 1 1 10 LYS CE C -2.543 -5.955 -6.933 1.00 . A A . 10 LYS CE 1 1 3 1164 1 1 10 LYS CG C -0.101 -6.310 -6.498 1.00 . A A . 10 LYS CG 1 1 3 1165 1 1 10 LYS H H 1.006 -2.961 -6.749 1.00 . A A . 10 LYS H 1 1 3 1166 1 1 10 LYS HA H 0.027 -4.735 -4.584 1.00 . A A . 10 LYS HA 1 1 3 1167 1 1 10 LYS HB2 H 1.416 -4.943 -7.179 1.00 . A A . 10 LYS HB2 1 1 3 1168 1 1 10 LYS HB3 H 1.968 -6.096 -5.966 1.00 . A A . 10 LYS HB3 1 1 3 1169 1 1 10 LYS HD2 H -1.006 -4.466 -7.129 1.00 . A A . 10 LYS HD2 1 1 3 1170 1 1 10 LYS HD3 H -0.967 -5.716 -8.372 1.00 . A A . 10 LYS HD3 1 1 3 1171 1 1 10 LYS HE2 H -2.513 -6.884 -6.380 1.00 . A A . 10 LYS HE2 1 1 3 1172 1 1 10 LYS HE3 H -3.025 -5.186 -6.350 1.00 . A A . 10 LYS HE3 1 1 3 1173 1 1 10 LYS HG2 H 0.172 -7.209 -7.030 1.00 . A A . 10 LYS HG2 1 1 3 1174 1 1 10 LYS HG3 H -0.538 -6.575 -5.547 1.00 . A A . 10 LYS HG3 1 1 3 1175 1 1 10 LYS HZ1 H -3.228 -5.260 -8.776 1.00 . A A . 10 LYS HZ1 1 1 3 1176 1 1 10 LYS HZ2 H -4.254 -6.394 -8.037 1.00 . A A . 10 LYS HZ2 1 1 3 1177 1 1 10 LYS HZ3 H -2.810 -6.904 -8.770 1.00 . A A . 10 LYS HZ3 1 1 3 1178 1 1 10 LYS N N 0.600 -3.142 -5.874 1.00 . A A . 10 LYS N 1 1 3 1179 1 1 10 LYS NZ N -3.262 -6.142 -8.227 1.00 . A A . 10 LYS NZ 1 1 3 1180 1 1 10 LYS O O 3.139 -3.787 -4.678 1.00 . A A . 10 LYS O 1 1 3 1181 1 1 11 CYS C C 3.181 -5.889 -1.144 1.00 . A A . 11 CYS C 1 1 3 1182 1 1 11 CYS CA C 3.204 -4.717 -2.138 1.00 . A A . 11 CYS CA 1 1 3 1183 1 1 11 CYS CB C 3.078 -3.375 -1.409 1.00 . A A . 11 CYS CB 1 1 3 1184 1 1 11 CYS H H 1.202 -5.214 -2.756 1.00 . A A . 11 CYS H 1 1 3 1185 1 1 11 CYS HA H 4.116 -4.737 -2.715 1.00 . A A . 11 CYS HA 1 1 3 1186 1 1 11 CYS HB2 H 3.990 -3.172 -0.868 1.00 . A A . 11 CYS HB2 1 1 3 1187 1 1 11 CYS HB3 H 2.909 -2.590 -2.130 1.00 . A A . 11 CYS HB3 1 1 3 1188 1 1 11 CYS N N 2.032 -4.789 -3.056 1.00 . A A . 11 CYS N 1 1 3 1189 1 1 11 CYS O O 2.207 -6.613 -1.047 1.00 . A A . 11 CYS O 1 1 3 1190 1 1 11 CYS SG S 1.699 -3.418 -0.240 1.00 . A A . 11 CYS SG 1 1 3 1191 1 1 12 GLY C C 3.669 -6.750 1.904 1.00 . A A . 12 GLY C 1 1 3 1192 1 1 12 GLY CA C 4.298 -7.200 0.581 1.00 . A A . 12 GLY CA 1 1 3 1193 1 1 12 GLY H H 5.023 -5.482 -0.505 1.00 . A A . 12 GLY H 1 1 3 1194 1 1 12 GLY HA2 H 3.752 -8.047 0.189 1.00 . A A . 12 GLY HA2 1 1 3 1195 1 1 12 GLY HA3 H 5.325 -7.483 0.752 1.00 . A A . 12 GLY HA3 1 1 3 1196 1 1 12 GLY N N 4.249 -6.079 -0.407 1.00 . A A . 12 GLY N 1 1 3 1197 1 1 12 GLY O O 2.585 -6.199 1.929 1.00 . A A . 12 GLY O 1 1 3 1198 1 1 13 ARG C C 4.259 -5.143 4.675 1.00 . A A . 13 ARG C 1 1 3 1199 1 1 13 ARG CA C 3.793 -6.568 4.332 1.00 . A A . 13 ARG CA 1 1 3 1200 1 1 13 ARG CB C 4.357 -7.583 5.336 1.00 . A A . 13 ARG CB 1 1 3 1201 1 1 13 ARG CD C 3.917 -7.371 7.792 1.00 . A A . 13 ARG CD 1 1 3 1202 1 1 13 ARG CG C 3.336 -7.826 6.452 1.00 . A A . 13 ARG CG 1 1 3 1203 1 1 13 ARG CZ C 2.390 -7.476 9.676 1.00 . A A . 13 ARG CZ 1 1 3 1204 1 1 13 ARG H H 5.218 -7.427 2.957 1.00 . A A . 13 ARG H 1 1 3 1205 1 1 13 ARG HA H 2.714 -6.619 4.323 1.00 . A A . 13 ARG HA 1 1 3 1206 1 1 13 ARG HB2 H 4.563 -8.514 4.828 1.00 . A A . 13 ARG HB2 1 1 3 1207 1 1 13 ARG HB3 H 5.271 -7.198 5.763 1.00 . A A . 13 ARG HB3 1 1 3 1208 1 1 13 ARG HD2 H 4.966 -7.626 7.852 1.00 . A A . 13 ARG HD2 1 1 3 1209 1 1 13 ARG HD3 H 3.777 -6.310 7.922 1.00 . A A . 13 ARG HD3 1 1 3 1210 1 1 13 ARG HE H 3.191 -9.098 8.856 1.00 . A A . 13 ARG HE 1 1 3 1211 1 1 13 ARG HG2 H 2.436 -7.266 6.243 1.00 . A A . 13 ARG HG2 1 1 3 1212 1 1 13 ARG HG3 H 3.103 -8.878 6.500 1.00 . A A . 13 ARG HG3 1 1 3 1213 1 1 13 ARG HH11 H 3.939 -6.680 10.671 1.00 . A A . 13 ARG HH11 1 1 3 1214 1 1 13 ARG HH12 H 2.370 -6.253 11.266 1.00 . A A . 13 ARG HH12 1 1 3 1215 1 1 13 ARG HH21 H 0.665 -8.120 8.882 1.00 . A A . 13 ARG HH21 1 1 3 1216 1 1 13 ARG HH22 H 0.512 -7.070 10.251 1.00 . A A . 13 ARG HH22 1 1 3 1217 1 1 13 ARG N N 4.345 -6.982 3.004 1.00 . A A . 13 ARG N 1 1 3 1218 1 1 13 ARG NE N 3.140 -8.120 8.822 1.00 . A A . 13 ARG NE 1 1 3 1219 1 1 13 ARG NH1 N 2.942 -6.744 10.611 1.00 . A A . 13 ARG NH1 1 1 3 1220 1 1 13 ARG NH2 N 1.086 -7.561 9.597 1.00 . A A . 13 ARG NH2 1 1 3 1221 1 1 13 ARG O O 4.841 -4.902 5.718 1.00 . A A . 13 ARG O 1 1 3 1222 1 1 14 GLY C C 5.924 -2.629 3.768 1.00 . A A . 14 GLY C 1 1 3 1223 1 1 14 GLY CA C 4.429 -2.791 4.062 1.00 . A A . 14 GLY CA 1 1 3 1224 1 1 14 GLY H H 3.535 -4.419 2.969 1.00 . A A . 14 GLY H 1 1 3 1225 1 1 14 GLY HA2 H 3.864 -2.125 3.424 1.00 . A A . 14 GLY HA2 1 1 3 1226 1 1 14 GLY HA3 H 4.240 -2.545 5.095 1.00 . A A . 14 GLY HA3 1 1 3 1227 1 1 14 GLY N N 4.005 -4.200 3.801 1.00 . A A . 14 GLY N 1 1 3 1228 1 1 14 GLY O O 6.613 -1.885 4.438 1.00 . A A . 14 GLY O 1 1 3 1229 1 1 15 LYS C C 8.155 -1.873 1.696 1.00 . A A . 15 LYS C 1 1 3 1230 1 1 15 LYS CA C 7.886 -3.194 2.436 1.00 . A A . 15 LYS CA 1 1 3 1231 1 1 15 LYS CB C 8.212 -4.402 1.547 1.00 . A A . 15 LYS CB 1 1 3 1232 1 1 15 LYS CD C 8.232 -6.828 2.158 1.00 . A A . 15 LYS CD 1 1 3 1233 1 1 15 LYS CE C 8.356 -7.678 3.425 1.00 . A A . 15 LYS CE 1 1 3 1234 1 1 15 LYS CG C 8.916 -5.477 2.380 1.00 . A A . 15 LYS CG 1 1 3 1235 1 1 15 LYS H H 5.857 -3.911 2.241 1.00 . A A . 15 LYS H 1 1 3 1236 1 1 15 LYS HA H 8.473 -3.238 3.334 1.00 . A A . 15 LYS HA 1 1 3 1237 1 1 15 LYS HB2 H 7.298 -4.806 1.138 1.00 . A A . 15 LYS HB2 1 1 3 1238 1 1 15 LYS HB3 H 8.861 -4.093 0.742 1.00 . A A . 15 LYS HB3 1 1 3 1239 1 1 15 LYS HD2 H 7.187 -6.669 1.929 1.00 . A A . 15 LYS HD2 1 1 3 1240 1 1 15 LYS HD3 H 8.708 -7.339 1.336 1.00 . A A . 15 LYS HD3 1 1 3 1241 1 1 15 LYS HE2 H 9.346 -7.577 3.849 1.00 . A A . 15 LYS HE2 1 1 3 1242 1 1 15 LYS HE3 H 7.606 -7.387 4.147 1.00 . A A . 15 LYS HE3 1 1 3 1243 1 1 15 LYS HG2 H 9.951 -5.544 2.079 1.00 . A A . 15 LYS HG2 1 1 3 1244 1 1 15 LYS HG3 H 8.863 -5.216 3.428 1.00 . A A . 15 LYS HG3 1 1 3 1245 1 1 15 LYS HZ1 H 7.174 -9.155 2.548 1.00 . A A . 15 LYS HZ1 1 1 3 1246 1 1 15 LYS HZ2 H 8.175 -9.720 3.798 1.00 . A A . 15 LYS HZ2 1 1 3 1247 1 1 15 LYS HZ3 H 8.839 -9.350 2.279 1.00 . A A . 15 LYS HZ3 1 1 3 1248 1 1 15 LYS N N 6.432 -3.317 2.770 1.00 . A A . 15 LYS N 1 1 3 1249 1 1 15 LYS NZ N 8.118 -9.081 2.978 1.00 . A A . 15 LYS NZ 1 1 3 1250 1 1 15 LYS O O 8.910 -1.048 2.175 1.00 . A A . 15 LYS O 1 1 3 1251 1 1 16 PRO C C 6.965 0.704 0.436 1.00 . A A . 16 PRO C 1 1 3 1252 1 1 16 PRO CA C 7.699 -0.464 -0.239 1.00 . A A . 16 PRO CA 1 1 3 1253 1 1 16 PRO CB C 7.064 -0.803 -1.585 1.00 . A A . 16 PRO CB 1 1 3 1254 1 1 16 PRO CD C 6.598 -2.644 -0.094 1.00 . A A . 16 PRO CD 1 1 3 1255 1 1 16 PRO CG C 6.077 -1.886 -1.287 1.00 . A A . 16 PRO CG 1 1 3 1256 1 1 16 PRO HA H 8.746 -0.240 -0.367 1.00 . A A . 16 PRO HA 1 1 3 1257 1 1 16 PRO HB2 H 6.562 0.066 -1.992 1.00 . A A . 16 PRO HB2 1 1 3 1258 1 1 16 PRO HB3 H 7.811 -1.165 -2.274 1.00 . A A . 16 PRO HB3 1 1 3 1259 1 1 16 PRO HD2 H 5.789 -2.902 0.575 1.00 . A A . 16 PRO HD2 1 1 3 1260 1 1 16 PRO HD3 H 7.130 -3.530 -0.405 1.00 . A A . 16 PRO HD3 1 1 3 1261 1 1 16 PRO HG2 H 5.114 -1.452 -1.059 1.00 . A A . 16 PRO HG2 1 1 3 1262 1 1 16 PRO HG3 H 5.991 -2.552 -2.133 1.00 . A A . 16 PRO HG3 1 1 3 1263 1 1 16 PRO N N 7.524 -1.707 0.556 1.00 . A A . 16 PRO N 1 1 3 1264 1 1 16 PRO O O 5.884 0.526 0.967 1.00 . A A . 16 PRO O 1 1 3 1265 1 1 17 PRO C C 5.769 3.556 0.195 1.00 . A A . 17 PRO C 1 1 3 1266 1 1 17 PRO CA C 6.968 3.068 1.016 1.00 . A A . 17 PRO CA 1 1 3 1267 1 1 17 PRO CB C 8.099 4.094 0.996 1.00 . A A . 17 PRO CB 1 1 3 1268 1 1 17 PRO CD C 8.879 2.161 -0.221 1.00 . A A . 17 PRO CD 1 1 3 1269 1 1 17 PRO CG C 9.004 3.658 -0.112 1.00 . A A . 17 PRO CG 1 1 3 1270 1 1 17 PRO HA H 6.676 2.865 2.033 1.00 . A A . 17 PRO HA 1 1 3 1271 1 1 17 PRO HB2 H 7.703 5.081 0.793 1.00 . A A . 17 PRO HB2 1 1 3 1272 1 1 17 PRO HB3 H 8.632 4.088 1.931 1.00 . A A . 17 PRO HB3 1 1 3 1273 1 1 17 PRO HD2 H 8.889 1.855 -1.259 1.00 . A A . 17 PRO HD2 1 1 3 1274 1 1 17 PRO HD3 H 9.670 1.673 0.327 1.00 . A A . 17 PRO HD3 1 1 3 1275 1 1 17 PRO HG2 H 8.702 4.125 -1.038 1.00 . A A . 17 PRO HG2 1 1 3 1276 1 1 17 PRO HG3 H 10.024 3.921 0.120 1.00 . A A . 17 PRO HG3 1 1 3 1277 1 1 17 PRO N N 7.578 1.863 0.397 1.00 . A A . 17 PRO N 1 1 3 1278 1 1 17 PRO O O 5.929 4.178 -0.837 1.00 . A A . 17 PRO O 1 1 3 1279 1 1 18 CYS C C 3.230 5.273 0.029 1.00 . A A . 18 CYS C 1 1 3 1280 1 1 18 CYS CA C 3.364 3.752 -0.100 1.00 . A A . 18 CYS CA 1 1 3 1281 1 1 18 CYS CB C 2.173 3.054 0.560 1.00 . A A . 18 CYS CB 1 1 3 1282 1 1 18 CYS H H 4.466 2.792 1.489 1.00 . A A . 18 CYS H 1 1 3 1283 1 1 18 CYS HA H 3.432 3.465 -1.136 1.00 . A A . 18 CYS HA 1 1 3 1284 1 1 18 CYS HB2 H 2.303 3.047 1.631 1.00 . A A . 18 CYS HB2 1 1 3 1285 1 1 18 CYS HB3 H 1.263 3.577 0.309 1.00 . A A . 18 CYS HB3 1 1 3 1286 1 1 18 CYS N N 4.570 3.288 0.651 1.00 . A A . 18 CYS N 1 1 3 1287 1 1 18 CYS O O 3.818 5.881 0.904 1.00 . A A . 18 CYS O 1 1 3 1288 1 1 18 CYS SG S 2.066 1.354 -0.040 1.00 . A A . 18 CYS SG 1 1 3 1289 1 1 19 CYS C C 1.621 7.745 0.580 1.00 . A A . 19 CYS C 1 1 3 1290 1 1 19 CYS CA C 2.304 7.379 -0.742 1.00 . A A . 19 CYS CA 1 1 3 1291 1 1 19 CYS CB C 1.430 7.780 -1.933 1.00 . A A . 19 CYS CB 1 1 3 1292 1 1 19 CYS H H 1.995 5.391 -1.530 1.00 . A A . 19 CYS H 1 1 3 1293 1 1 19 CYS HA H 3.268 7.860 -0.815 1.00 . A A . 19 CYS HA 1 1 3 1294 1 1 19 CYS HB2 H 1.205 6.907 -2.527 1.00 . A A . 19 CYS HB2 1 1 3 1295 1 1 19 CYS HB3 H 0.512 8.218 -1.572 1.00 . A A . 19 CYS HB3 1 1 3 1296 1 1 19 CYS N N 2.464 5.897 -0.832 1.00 . A A . 19 CYS N 1 1 3 1297 1 1 19 CYS O O 0.831 6.987 1.110 1.00 . A A . 19 CYS O 1 1 3 1298 1 1 19 CYS SG S 2.313 8.990 -2.952 1.00 . A A . 19 CYS SG 1 1 3 1299 1 1 20 LYS C C -0.205 9.233 2.364 1.00 . A A . 20 LYS C 1 1 3 1300 1 1 20 LYS CA C 1.327 9.322 2.416 1.00 . A A . 20 LYS CA 1 1 3 1301 1 1 20 LYS CB C 1.774 10.774 2.618 1.00 . A A . 20 LYS CB 1 1 3 1302 1 1 20 LYS CD C 3.573 10.548 4.346 1.00 . A A . 20 LYS CD 1 1 3 1303 1 1 20 LYS CE C 3.572 9.213 5.099 1.00 . A A . 20 LYS CE 1 1 3 1304 1 1 20 LYS CG C 2.131 11.000 4.091 1.00 . A A . 20 LYS CG 1 1 3 1305 1 1 20 LYS H H 2.584 9.477 0.673 1.00 . A A . 20 LYS H 1 1 3 1306 1 1 20 LYS HA H 1.709 8.712 3.215 1.00 . A A . 20 LYS HA 1 1 3 1307 1 1 20 LYS HB2 H 2.639 10.975 2.002 1.00 . A A . 20 LYS HB2 1 1 3 1308 1 1 20 LYS HB3 H 0.971 11.441 2.338 1.00 . A A . 20 LYS HB3 1 1 3 1309 1 1 20 LYS HD2 H 4.083 10.427 3.401 1.00 . A A . 20 LYS HD2 1 1 3 1310 1 1 20 LYS HD3 H 4.083 11.293 4.937 1.00 . A A . 20 LYS HD3 1 1 3 1311 1 1 20 LYS HE2 H 2.648 8.681 4.920 1.00 . A A . 20 LYS HE2 1 1 3 1312 1 1 20 LYS HE3 H 4.417 8.612 4.800 1.00 . A A . 20 LYS HE3 1 1 3 1313 1 1 20 LYS HG2 H 2.035 12.051 4.327 1.00 . A A . 20 LYS HG2 1 1 3 1314 1 1 20 LYS HG3 H 1.460 10.429 4.716 1.00 . A A . 20 LYS HG3 1 1 3 1315 1 1 20 LYS HZ1 H 4.586 10.079 6.701 1.00 . A A . 20 LYS HZ1 1 1 3 1316 1 1 20 LYS HZ2 H 3.674 8.708 7.117 1.00 . A A . 20 LYS HZ2 1 1 3 1317 1 1 20 LYS HZ3 H 2.897 10.188 6.814 1.00 . A A . 20 LYS HZ3 1 1 3 1318 1 1 20 LYS N N 1.935 8.896 1.119 1.00 . A A . 20 LYS N 1 1 3 1319 1 1 20 LYS NZ N 3.691 9.575 6.541 1.00 . A A . 20 LYS NZ 1 1 3 1320 1 1 20 LYS O O -0.839 9.788 1.486 1.00 . A A . 20 LYS O 1 1 3 1321 1 1 21 GLY C C -2.694 6.968 2.943 1.00 . A A . 21 GLY C 1 1 3 1322 1 1 21 GLY CA C -2.288 8.400 3.319 1.00 . A A . 21 GLY CA 1 1 3 1323 1 1 21 GLY H H -0.264 8.095 3.996 1.00 . A A . 21 GLY H 1 1 3 1324 1 1 21 GLY HA2 H -2.654 8.629 4.309 1.00 . A A . 21 GLY HA2 1 1 3 1325 1 1 21 GLY HA3 H -2.719 9.087 2.608 1.00 . A A . 21 GLY HA3 1 1 3 1326 1 1 21 GLY N N -0.799 8.533 3.302 1.00 . A A . 21 GLY N 1 1 3 1327 1 1 21 GLY O O -3.723 6.480 3.369 1.00 . A A . 21 GLY O 1 1 3 1328 1 1 22 TYR C C -1.555 3.882 2.648 1.00 . A A . 22 TYR C 1 1 3 1329 1 1 22 TYR CA C -2.248 4.898 1.734 1.00 . A A . 22 TYR CA 1 1 3 1330 1 1 22 TYR CB C -1.745 4.746 0.290 1.00 . A A . 22 TYR CB 1 1 3 1331 1 1 22 TYR CD1 C -3.364 6.614 -0.281 1.00 . A A . 22 TYR CD1 1 1 3 1332 1 1 22 TYR CD2 C -1.368 6.338 -1.627 1.00 . A A . 22 TYR CD2 1 1 3 1333 1 1 22 TYR CE1 C -3.745 7.706 -1.070 1.00 . A A . 22 TYR CE1 1 1 3 1334 1 1 22 TYR CE2 C -1.753 7.429 -2.417 1.00 . A A . 22 TYR CE2 1 1 3 1335 1 1 22 TYR CG C -2.172 5.928 -0.558 1.00 . A A . 22 TYR CG 1 1 3 1336 1 1 22 TYR CZ C -2.940 8.113 -2.138 1.00 . A A . 22 TYR CZ 1 1 3 1337 1 1 22 TYR H H -1.078 6.707 1.806 1.00 . A A . 22 TYR H 1 1 3 1338 1 1 22 TYR HA H -3.318 4.757 1.765 1.00 . A A . 22 TYR HA 1 1 3 1339 1 1 22 TYR HB2 H -0.666 4.684 0.295 1.00 . A A . 22 TYR HB2 1 1 3 1340 1 1 22 TYR HB3 H -2.149 3.839 -0.134 1.00 . A A . 22 TYR HB3 1 1 3 1341 1 1 22 TYR HD1 H -3.987 6.301 0.541 1.00 . A A . 22 TYR HD1 1 1 3 1342 1 1 22 TYR HD2 H -0.450 5.812 -1.846 1.00 . A A . 22 TYR HD2 1 1 3 1343 1 1 22 TYR HE1 H -4.664 8.232 -0.855 1.00 . A A . 22 TYR HE1 1 1 3 1344 1 1 22 TYR HE2 H -1.128 7.744 -3.242 1.00 . A A . 22 TYR HE2 1 1 3 1345 1 1 22 TYR HH H -2.885 9.972 -2.564 1.00 . A A . 22 TYR HH 1 1 3 1346 1 1 22 TYR N N -1.899 6.294 2.143 1.00 . A A . 22 TYR N 1 1 3 1347 1 1 22 TYR O O -0.507 4.148 3.205 1.00 . A A . 22 TYR O 1 1 3 1348 1 1 22 TYR OH O -3.315 9.189 -2.915 1.00 . A A . 22 TYR OH 1 1 3 1349 1 1 23 ALA C C -1.424 0.342 2.905 1.00 . A A . 23 ALA C 1 1 3 1350 1 1 23 ALA CA C -1.526 1.667 3.669 1.00 . A A . 23 ALA CA 1 1 3 1351 1 1 23 ALA CB C -2.482 1.531 4.854 1.00 . A A . 23 ALA CB 1 1 3 1352 1 1 23 ALA H H -2.981 2.534 2.331 1.00 . A A . 23 ALA H 1 1 3 1353 1 1 23 ALA HA H -0.553 1.979 4.014 1.00 . A A . 23 ALA HA 1 1 3 1354 1 1 23 ALA HB1 H -2.458 2.435 5.443 1.00 . A A . 23 ALA HB1 1 1 3 1355 1 1 23 ALA HB2 H -2.181 0.693 5.466 1.00 . A A . 23 ALA HB2 1 1 3 1356 1 1 23 ALA HB3 H -3.487 1.366 4.489 1.00 . A A . 23 ALA HB3 1 1 3 1357 1 1 23 ALA N N -2.137 2.718 2.798 1.00 . A A . 23 ALA N 1 1 3 1358 1 1 23 ALA O O -2.260 0.029 2.077 1.00 . A A . 23 ALA O 1 1 3 1359 1 1 24 CYS C C -0.927 -2.871 3.255 1.00 . A A . 24 CYS C 1 1 3 1360 1 1 24 CYS CA C -0.250 -1.746 2.468 1.00 . A A . 24 CYS CA 1 1 3 1361 1 1 24 CYS CB C 1.260 -1.994 2.390 1.00 . A A . 24 CYS CB 1 1 3 1362 1 1 24 CYS H H 0.251 -0.166 3.853 1.00 . A A . 24 CYS H 1 1 3 1363 1 1 24 CYS HA H -0.664 -1.684 1.473 1.00 . A A . 24 CYS HA 1 1 3 1364 1 1 24 CYS HB2 H 1.770 -1.347 3.088 1.00 . A A . 24 CYS HB2 1 1 3 1365 1 1 24 CYS HB3 H 1.470 -3.024 2.636 1.00 . A A . 24 CYS HB3 1 1 3 1366 1 1 24 CYS N N -0.407 -0.439 3.179 1.00 . A A . 24 CYS N 1 1 3 1367 1 1 24 CYS O O -1.186 -2.747 4.439 1.00 . A A . 24 CYS O 1 1 3 1368 1 1 24 CYS SG S 1.844 -1.648 0.719 1.00 . A A . 24 CYS SG 1 1 3 1369 1 1 25 SER C C -1.198 -6.428 2.907 1.00 . A A . 25 SER C 1 1 3 1370 1 1 25 SER CA C -1.866 -5.110 3.299 1.00 . A A . 25 SER CA 1 1 3 1371 1 1 25 SER CB C -3.319 -5.084 2.829 1.00 . A A . 25 SER CB 1 1 3 1372 1 1 25 SER H H -0.988 -4.041 1.650 1.00 . A A . 25 SER H 1 1 3 1373 1 1 25 SER HA H -1.824 -4.973 4.363 1.00 . A A . 25 SER HA 1 1 3 1374 1 1 25 SER HB2 H -3.408 -4.457 1.958 1.00 . A A . 25 SER HB2 1 1 3 1375 1 1 25 SER HB3 H -3.632 -6.089 2.580 1.00 . A A . 25 SER HB3 1 1 3 1376 1 1 25 SER HG H -4.288 -3.633 3.693 1.00 . A A . 25 SER HG 1 1 3 1377 1 1 25 SER N N -1.210 -3.968 2.602 1.00 . A A . 25 SER N 1 1 3 1378 1 1 25 SER O O -1.144 -6.786 1.747 1.00 . A A . 25 SER O 1 1 3 1379 1 1 25 SER OG O -4.137 -4.564 3.869 1.00 . A A . 25 SER OG 1 1 3 1380 1 1 26 LYS C C -1.122 -9.500 3.209 1.00 . A A . 26 LYS C 1 1 3 1381 1 1 26 LYS CA C -0.048 -8.469 3.564 1.00 . A A . 26 LYS CA 1 1 3 1382 1 1 26 LYS CB C 0.678 -8.865 4.851 1.00 . A A . 26 LYS CB 1 1 3 1383 1 1 26 LYS CD C 1.109 -11.179 5.693 1.00 . A A . 26 LYS CD 1 1 3 1384 1 1 26 LYS CE C 2.211 -12.243 5.787 1.00 . A A . 26 LYS CE 1 1 3 1385 1 1 26 LYS CG C 1.479 -10.149 4.622 1.00 . A A . 26 LYS CG 1 1 3 1386 1 1 26 LYS H H -0.762 -6.850 4.800 1.00 . A A . 26 LYS H 1 1 3 1387 1 1 26 LYS HA H 0.655 -8.361 2.757 1.00 . A A . 26 LYS HA 1 1 3 1388 1 1 26 LYS HB2 H 1.348 -8.069 5.142 1.00 . A A . 26 LYS HB2 1 1 3 1389 1 1 26 LYS HB3 H -0.045 -9.028 5.637 1.00 . A A . 26 LYS HB3 1 1 3 1390 1 1 26 LYS HD2 H 1.002 -10.685 6.647 1.00 . A A . 26 LYS HD2 1 1 3 1391 1 1 26 LYS HD3 H 0.178 -11.653 5.427 1.00 . A A . 26 LYS HD3 1 1 3 1392 1 1 26 LYS HE2 H 1.892 -13.154 5.299 1.00 . A A . 26 LYS HE2 1 1 3 1393 1 1 26 LYS HE3 H 3.125 -11.878 5.345 1.00 . A A . 26 LYS HE3 1 1 3 1394 1 1 26 LYS HG2 H 1.251 -10.547 3.644 1.00 . A A . 26 LYS HG2 1 1 3 1395 1 1 26 LYS HG3 H 2.535 -9.929 4.684 1.00 . A A . 26 LYS HG3 1 1 3 1396 1 1 26 LYS HZ1 H 1.505 -12.764 7.678 1.00 . A A . 26 LYS HZ1 1 1 3 1397 1 1 26 LYS HZ2 H 2.739 -11.595 7.695 1.00 . A A . 26 LYS HZ2 1 1 3 1398 1 1 26 LYS HZ3 H 3.113 -13.224 7.387 1.00 . A A . 26 LYS HZ3 1 1 3 1399 1 1 26 LYS N N -0.700 -7.159 3.871 1.00 . A A . 26 LYS N 1 1 3 1400 1 1 26 LYS NZ N 2.406 -12.474 7.247 1.00 . A A . 26 LYS NZ 1 1 3 1401 1 1 26 LYS O O -0.974 -10.271 2.279 1.00 . A A . 26 LYS O 1 1 3 1402 1 1 27 THR C C -3.903 -10.196 2.270 1.00 . A A . 27 THR C 1 1 3 1403 1 1 27 THR CA C -3.318 -10.470 3.659 1.00 . A A . 27 THR CA 1 1 3 1404 1 1 27 THR CB C -4.371 -10.205 4.746 1.00 . A A . 27 THR CB 1 1 3 1405 1 1 27 THR CG2 C -5.425 -11.313 4.725 1.00 . A A . 27 THR CG2 1 1 3 1406 1 1 27 THR H H -2.298 -8.864 4.677 1.00 . A A . 27 THR H 1 1 3 1407 1 1 27 THR HA H -2.963 -11.483 3.725 1.00 . A A . 27 THR HA 1 1 3 1408 1 1 27 THR HB H -4.850 -9.255 4.559 1.00 . A A . 27 THR HB 1 1 3 1409 1 1 27 THR HG1 H -3.816 -9.285 6.370 1.00 . A A . 27 THR HG1 1 1 3 1410 1 1 27 THR HG21 H -4.956 -12.253 4.477 1.00 . A A . 27 THR HG21 1 1 3 1411 1 1 27 THR HG22 H -6.178 -11.080 3.986 1.00 . A A . 27 THR HG22 1 1 3 1412 1 1 27 THR HG23 H -5.888 -11.386 5.698 1.00 . A A . 27 THR HG23 1 1 3 1413 1 1 27 THR N N -2.209 -9.505 3.941 1.00 . A A . 27 THR N 1 1 3 1414 1 1 27 THR O O -4.215 -11.106 1.527 1.00 . A A . 27 THR O 1 1 3 1415 1 1 27 THR OG1 O -3.741 -10.176 6.021 1.00 . A A . 27 THR OG1 1 1 3 1416 1 1 28 TRP C C -3.496 -8.709 -0.480 1.00 . A A . 28 TRP C 1 1 3 1417 1 1 28 TRP CA C -4.597 -8.585 0.578 1.00 . A A . 28 TRP CA 1 1 3 1418 1 1 28 TRP CB C -5.063 -7.126 0.701 1.00 . A A . 28 TRP CB 1 1 3 1419 1 1 28 TRP CD1 C -6.662 -8.006 2.473 1.00 . A A . 28 TRP CD1 1 1 3 1420 1 1 28 TRP CD2 C -6.697 -5.762 2.308 1.00 . A A . 28 TRP CD2 1 1 3 1421 1 1 28 TRP CE2 C -7.616 -6.112 3.324 1.00 . A A . 28 TRP CE2 1 1 3 1422 1 1 28 TRP CE3 C -6.532 -4.399 2.004 1.00 . A A . 28 TRP CE3 1 1 3 1423 1 1 28 TRP CG C -6.096 -6.985 1.782 1.00 . A A . 28 TRP CG 1 1 3 1424 1 1 28 TRP CH2 C -8.170 -3.795 3.703 1.00 . A A . 28 TRP CH2 1 1 3 1425 1 1 28 TRP CZ2 C -8.345 -5.145 4.016 1.00 . A A . 28 TRP CZ2 1 1 3 1426 1 1 28 TRP CZ3 C -7.264 -3.422 2.699 1.00 . A A . 28 TRP CZ3 1 1 3 1427 1 1 28 TRP H H -3.774 -8.233 2.540 1.00 . A A . 28 TRP H 1 1 3 1428 1 1 28 TRP HA H -5.432 -9.222 0.331 1.00 . A A . 28 TRP HA 1 1 3 1429 1 1 28 TRP HB2 H -4.216 -6.501 0.935 1.00 . A A . 28 TRP HB2 1 1 3 1430 1 1 28 TRP HB3 H -5.486 -6.809 -0.239 1.00 . A A . 28 TRP HB3 1 1 3 1431 1 1 28 TRP HD1 H -6.444 -9.055 2.334 1.00 . A A . 28 TRP HD1 1 1 3 1432 1 1 28 TRP HE1 H -8.095 -8.016 4.014 1.00 . A A . 28 TRP HE1 1 1 3 1433 1 1 28 TRP HE3 H -5.837 -4.101 1.234 1.00 . A A . 28 TRP HE3 1 1 3 1434 1 1 28 TRP HH2 H -8.729 -3.042 4.233 1.00 . A A . 28 TRP HH2 1 1 3 1435 1 1 28 TRP HZ2 H -9.041 -5.437 4.788 1.00 . A A . 28 TRP HZ2 1 1 3 1436 1 1 28 TRP HZ3 H -7.131 -2.378 2.459 1.00 . A A . 28 TRP HZ3 1 1 3 1437 1 1 28 TRP N N -4.042 -8.941 1.920 1.00 . A A . 28 TRP N 1 1 3 1438 1 1 28 TRP NE1 N -7.557 -7.488 3.389 1.00 . A A . 28 TRP NE1 1 1 3 1439 1 1 28 TRP O O -3.696 -9.284 -1.533 1.00 . A A . 28 TRP O 1 1 3 1440 1 1 29 GLY C C -1.050 -6.958 -1.949 1.00 . A A . 29 GLY C 1 1 3 1441 1 1 29 GLY CA C -1.196 -8.268 -1.164 1.00 . A A . 29 GLY CA 1 1 3 1442 1 1 29 GLY H H -2.196 -7.732 0.666 1.00 . A A . 29 GLY H 1 1 3 1443 1 1 29 GLY HA2 H -0.281 -8.465 -0.623 1.00 . A A . 29 GLY HA2 1 1 3 1444 1 1 29 GLY HA3 H -1.380 -9.077 -1.855 1.00 . A A . 29 GLY HA3 1 1 3 1445 1 1 29 GLY N N -2.329 -8.182 -0.196 1.00 . A A . 29 GLY N 1 1 3 1446 1 1 29 GLY O O -0.423 -6.933 -2.992 1.00 . A A . 29 GLY O 1 1 3 1447 1 1 30 TRP C C -1.529 -3.370 -1.277 1.00 . A A . 30 TRP C 1 1 3 1448 1 1 30 TRP CA C -1.474 -4.581 -2.223 1.00 . A A . 30 TRP CA 1 1 3 1449 1 1 30 TRP CB C -2.641 -4.568 -3.229 1.00 . A A . 30 TRP CB 1 1 3 1450 1 1 30 TRP CD1 C -4.342 -3.188 -1.953 1.00 . A A . 30 TRP CD1 1 1 3 1451 1 1 30 TRP CD2 C -5.051 -5.286 -2.349 1.00 . A A . 30 TRP CD2 1 1 3 1452 1 1 30 TRP CE2 C -6.085 -4.633 -1.636 1.00 . A A . 30 TRP CE2 1 1 3 1453 1 1 30 TRP CE3 C -5.249 -6.627 -2.725 1.00 . A A . 30 TRP CE3 1 1 3 1454 1 1 30 TRP CG C -3.950 -4.349 -2.531 1.00 . A A . 30 TRP CG 1 1 3 1455 1 1 30 TRP CH2 C -7.454 -6.618 -1.690 1.00 . A A . 30 TRP CH2 1 1 3 1456 1 1 30 TRP CZ2 C -7.273 -5.286 -1.309 1.00 . A A . 30 TRP CZ2 1 1 3 1457 1 1 30 TRP CZ3 C -6.445 -7.287 -2.398 1.00 . A A . 30 TRP CZ3 1 1 3 1458 1 1 30 TRP H H -2.109 -5.894 -0.624 1.00 . A A . 30 TRP H 1 1 3 1459 1 1 30 TRP HA H -0.541 -4.574 -2.763 1.00 . A A . 30 TRP HA 1 1 3 1460 1 1 30 TRP HB2 H -2.485 -3.774 -3.944 1.00 . A A . 30 TRP HB2 1 1 3 1461 1 1 30 TRP HB3 H -2.670 -5.513 -3.751 1.00 . A A . 30 TRP HB3 1 1 3 1462 1 1 30 TRP HD1 H -3.761 -2.280 -1.910 1.00 . A A . 30 TRP HD1 1 1 3 1463 1 1 30 TRP HE1 H -6.107 -2.672 -0.939 1.00 . A A . 30 TRP HE1 1 1 3 1464 1 1 30 TRP HE3 H -4.478 -7.151 -3.270 1.00 . A A . 30 TRP HE3 1 1 3 1465 1 1 30 TRP HH2 H -8.371 -7.131 -1.442 1.00 . A A . 30 TRP HH2 1 1 3 1466 1 1 30 TRP HZ2 H -8.047 -4.767 -0.763 1.00 . A A . 30 TRP HZ2 1 1 3 1467 1 1 30 TRP HZ3 H -6.588 -8.317 -2.692 1.00 . A A . 30 TRP HZ3 1 1 3 1468 1 1 30 TRP N N -1.611 -5.868 -1.471 1.00 . A A . 30 TRP N 1 1 3 1469 1 1 30 TRP NE1 N -5.602 -3.359 -1.418 1.00 . A A . 30 TRP NE1 1 1 3 1470 1 1 30 TRP O O -1.615 -3.509 -0.074 1.00 . A A . 30 TRP O 1 1 3 1471 1 1 31 CYS C C -2.670 -0.043 -1.521 1.00 . A A . 31 CYS C 1 1 3 1472 1 1 31 CYS CA C -1.544 -0.942 -1.010 1.00 . A A . 31 CYS CA 1 1 3 1473 1 1 31 CYS CB C -0.191 -0.259 -1.216 1.00 . A A . 31 CYS CB 1 1 3 1474 1 1 31 CYS H H -1.430 -2.112 -2.808 1.00 . A A . 31 CYS H 1 1 3 1475 1 1 31 CYS HA H -1.688 -1.178 0.032 1.00 . A A . 31 CYS HA 1 1 3 1476 1 1 31 CYS HB2 H 0.594 -1.000 -1.224 1.00 . A A . 31 CYS HB2 1 1 3 1477 1 1 31 CYS HB3 H -0.192 0.274 -2.156 1.00 . A A . 31 CYS HB3 1 1 3 1478 1 1 31 CYS N N -1.489 -2.185 -1.834 1.00 . A A . 31 CYS N 1 1 3 1479 1 1 31 CYS O O -2.723 0.290 -2.691 1.00 . A A . 31 CYS O 1 1 3 1480 1 1 31 CYS SG S 0.105 0.909 0.129 1.00 . A A . 31 CYS SG 1 1 3 1481 1 1 32 ALA C C -4.906 2.380 -0.120 1.00 . A A . 32 ALA C 1 1 3 1482 1 1 32 ALA CA C -4.696 1.226 -1.105 1.00 . A A . 32 ALA CA 1 1 3 1483 1 1 32 ALA CB C -5.920 0.312 -1.139 1.00 . A A . 32 ALA CB 1 1 3 1484 1 1 32 ALA H H -3.506 0.067 0.280 1.00 . A A . 32 ALA H 1 1 3 1485 1 1 32 ALA HA H -4.500 1.611 -2.091 1.00 . A A . 32 ALA HA 1 1 3 1486 1 1 32 ALA HB1 H -5.700 -0.561 -1.736 1.00 . A A . 32 ALA HB1 1 1 3 1487 1 1 32 ALA HB2 H -6.754 0.843 -1.571 1.00 . A A . 32 ALA HB2 1 1 3 1488 1 1 32 ALA HB3 H -6.169 0.005 -0.133 1.00 . A A . 32 ALA HB3 1 1 3 1489 1 1 32 ALA N N -3.570 0.350 -0.659 1.00 . A A . 32 ALA N 1 1 3 1490 1 1 32 ALA O O -4.279 2.445 0.921 1.00 . A A . 32 ALA O 1 1 3 1491 1 1 33 VAL C C -6.885 4.005 1.666 1.00 . A A . 33 VAL C 1 1 3 1492 1 1 33 VAL CA C -6.045 4.454 0.463 1.00 . A A . 33 VAL CA 1 1 3 1493 1 1 33 VAL CB C -6.821 5.477 -0.378 1.00 . A A . 33 VAL CB 1 1 3 1494 1 1 33 VAL CG1 C -6.932 6.793 0.397 1.00 . A A . 33 VAL CG1 1 1 3 1495 1 1 33 VAL CG2 C -6.091 5.732 -1.703 1.00 . A A . 33 VAL CG2 1 1 3 1496 1 1 33 VAL H H -6.279 3.218 -1.292 1.00 . A A . 33 VAL H 1 1 3 1497 1 1 33 VAL HA H -5.113 4.881 0.797 1.00 . A A . 33 VAL HA 1 1 3 1498 1 1 33 VAL HB H -7.813 5.097 -0.580 1.00 . A A . 33 VAL HB 1 1 3 1499 1 1 33 VAL HG11 H -7.669 6.689 1.177 1.00 . A A . 33 VAL HG11 1 1 3 1500 1 1 33 VAL HG12 H -7.227 7.585 -0.276 1.00 . A A . 33 VAL HG12 1 1 3 1501 1 1 33 VAL HG13 H -5.975 7.033 0.836 1.00 . A A . 33 VAL HG13 1 1 3 1502 1 1 33 VAL HG21 H -6.071 6.792 -1.907 1.00 . A A . 33 VAL HG21 1 1 3 1503 1 1 33 VAL HG22 H -6.608 5.221 -2.502 1.00 . A A . 33 VAL HG22 1 1 3 1504 1 1 33 VAL HG23 H -5.079 5.360 -1.635 1.00 . A A . 33 VAL HG23 1 1 3 1505 1 1 33 VAL N N -5.788 3.293 -0.446 1.00 . A A . 33 VAL N 1 1 3 1506 1 1 33 VAL O O -7.730 3.136 1.554 1.00 . A A . 33 VAL O 1 1 3 1507 1 1 34 GLU C C -8.866 4.782 3.941 1.00 . A A . 34 GLU C 1 1 3 1508 1 1 34 GLU CA C -7.445 4.212 4.027 1.00 . A A . 34 GLU CA 1 1 3 1509 1 1 34 GLU CB C -6.685 4.827 5.206 1.00 . A A . 34 GLU CB 1 1 3 1510 1 1 34 GLU CD C -6.305 3.064 6.937 1.00 . A A . 34 GLU CD 1 1 3 1511 1 1 34 GLU CG C -5.682 3.810 5.755 1.00 . A A . 34 GLU CG 1 1 3 1512 1 1 34 GLU H H -5.975 5.296 2.874 1.00 . A A . 34 GLU H 1 1 3 1513 1 1 34 GLU HA H -7.477 3.138 4.129 1.00 . A A . 34 GLU HA 1 1 3 1514 1 1 34 GLU HB2 H -6.159 5.710 4.873 1.00 . A A . 34 GLU HB2 1 1 3 1515 1 1 34 GLU HB3 H -7.384 5.098 5.984 1.00 . A A . 34 GLU HB3 1 1 3 1516 1 1 34 GLU HG2 H -5.423 3.103 4.978 1.00 . A A . 34 GLU HG2 1 1 3 1517 1 1 34 GLU HG3 H -4.792 4.323 6.086 1.00 . A A . 34 GLU HG3 1 1 3 1518 1 1 34 GLU N N -6.660 4.597 2.813 1.00 . A A . 34 GLU N 1 1 3 1519 1 1 34 GLU O O -9.095 5.805 3.324 1.00 . A A . 34 GLU O 1 1 3 1520 1 1 34 GLU OE1 O -6.162 3.534 8.052 1.00 . A A . 34 GLU OE1 1 1 3 1521 1 1 34 GLU OE2 O -6.915 2.032 6.707 1.00 . A A . 34 GLU OE2 1 1 3 1522 1 1 35 ALA C C -11.358 5.944 5.286 1.00 . A A . 35 ALA C 1 1 3 1523 1 1 35 ALA CA C -11.233 4.620 4.514 1.00 . A A . 35 ALA CA 1 1 3 1524 1 1 35 ALA CB C -12.062 3.525 5.189 1.00 . A A . 35 ALA CB 1 1 3 1525 1 1 35 ALA H H -9.607 3.299 5.044 1.00 . A A . 35 ALA H 1 1 3 1526 1 1 35 ALA HA H -11.556 4.746 3.494 1.00 . A A . 35 ALA HA 1 1 3 1527 1 1 35 ALA HB1 H -13.055 3.899 5.393 1.00 . A A . 35 ALA HB1 1 1 3 1528 1 1 35 ALA HB2 H -11.591 3.233 6.116 1.00 . A A . 35 ALA HB2 1 1 3 1529 1 1 35 ALA HB3 H -12.130 2.669 4.533 1.00 . A A . 35 ALA HB3 1 1 3 1530 1 1 35 ALA N N -9.820 4.123 4.555 1.00 . A A . 35 ALA N 1 1 3 1531 1 1 35 ALA O O -11.151 5.979 6.485 1.00 . A A . 35 ALA O 1 1 3 1532 1 1 36 PRO C C -13.153 8.417 5.992 1.00 . A A . 36 PRO C 1 1 3 1533 1 1 36 PRO CA C -11.842 8.332 5.194 1.00 . A A . 36 PRO CA 1 1 3 1534 1 1 36 PRO CB C -11.865 9.285 4.003 1.00 . A A . 36 PRO CB 1 1 3 1535 1 1 36 PRO CD C -11.953 7.031 3.121 1.00 . A A . 36 PRO CD 1 1 3 1536 1 1 36 PRO CG C -12.339 8.463 2.847 1.00 . A A . 36 PRO CG 1 1 3 1537 1 1 36 PRO HA H -10.998 8.552 5.827 1.00 . A A . 36 PRO HA 1 1 3 1538 1 1 36 PRO HB2 H -12.547 10.103 4.192 1.00 . A A . 36 PRO HB2 1 1 3 1539 1 1 36 PRO HB3 H -10.872 9.662 3.805 1.00 . A A . 36 PRO HB3 1 1 3 1540 1 1 36 PRO HD2 H -12.770 6.368 2.864 1.00 . A A . 36 PRO HD2 1 1 3 1541 1 1 36 PRO HD3 H -11.063 6.765 2.573 1.00 . A A . 36 PRO HD3 1 1 3 1542 1 1 36 PRO HG2 H -13.411 8.545 2.755 1.00 . A A . 36 PRO HG2 1 1 3 1543 1 1 36 PRO HG3 H -11.863 8.797 1.937 1.00 . A A . 36 PRO HG3 1 1 3 1544 1 1 36 PRO N N -11.691 6.992 4.567 1.00 . A A . 36 PRO N 1 1 3 1545 1 1 36 PRO O O -13.141 9.035 7.040 1.00 . A A . 36 PRO O 1 1 4 1546 1 1 1 ASP C C 13.457 2.444 -1.732 1.00 . A A . 1 ASP C 1 1 4 1547 1 1 1 ASP CA C 13.495 1.928 -0.287 1.00 . A A . 1 ASP CA 1 1 4 1548 1 1 1 ASP CB C 14.708 2.488 0.463 1.00 . A A . 1 ASP CB 1 1 4 1549 1 1 1 ASP CG C 14.501 3.981 0.740 1.00 . A A . 1 ASP CG 1 1 4 1550 1 1 1 ASP H1 H 12.874 -0.005 -0.764 1.00 . A A . 1 ASP H1 1 1 4 1551 1 1 1 ASP H2 H 13.712 0.109 0.709 1.00 . A A . 1 ASP H2 1 1 4 1552 1 1 1 ASP H3 H 14.558 0.197 -0.762 1.00 . A A . 1 ASP H3 1 1 4 1553 1 1 1 ASP HA H 12.587 2.199 0.229 1.00 . A A . 1 ASP HA 1 1 4 1554 1 1 1 ASP HB2 H 14.826 1.962 1.400 1.00 . A A . 1 ASP HB2 1 1 4 1555 1 1 1 ASP HB3 H 15.597 2.355 -0.137 1.00 . A A . 1 ASP HB3 1 1 4 1556 1 1 1 ASP N N 13.673 0.445 -0.275 1.00 . A A . 1 ASP N 1 1 4 1557 1 1 1 ASP O O 14.483 2.707 -2.335 1.00 . A A . 1 ASP O 1 1 4 1558 1 1 1 ASP OD1 O 13.815 4.297 1.699 1.00 . A A . 1 ASP OD1 1 1 4 1559 1 1 1 ASP OD2 O 15.035 4.781 -0.009 1.00 . A A . 1 ASP OD2 1 1 4 1560 1 1 2 GLY C C 11.358 4.395 -3.698 1.00 . A A . 2 GLY C 1 1 4 1561 1 1 2 GLY CA C 12.160 3.091 -3.690 1.00 . A A . 2 GLY CA 1 1 4 1562 1 1 2 GLY H H 11.471 2.373 -1.779 1.00 . A A . 2 GLY H 1 1 4 1563 1 1 2 GLY HA2 H 13.146 3.270 -4.095 1.00 . A A . 2 GLY HA2 1 1 4 1564 1 1 2 GLY HA3 H 11.651 2.354 -4.291 1.00 . A A . 2 GLY HA3 1 1 4 1565 1 1 2 GLY N N 12.280 2.591 -2.287 1.00 . A A . 2 GLY N 1 1 4 1566 1 1 2 GLY O O 11.761 5.385 -3.119 1.00 . A A . 2 GLY O 1 1 4 1567 1 1 3 GLU C C 8.039 5.398 -3.697 1.00 . A A . 3 GLU C 1 1 4 1568 1 1 3 GLU CA C 9.383 5.635 -4.403 1.00 . A A . 3 GLU CA 1 1 4 1569 1 1 3 GLU CB C 9.174 5.907 -5.898 1.00 . A A . 3 GLU CB 1 1 4 1570 1 1 3 GLU CD C 9.897 7.686 -7.503 1.00 . A A . 3 GLU CD 1 1 4 1571 1 1 3 GLU CG C 9.215 7.415 -6.159 1.00 . A A . 3 GLU CG 1 1 4 1572 1 1 3 GLU H H 9.919 3.585 -4.809 1.00 . A A . 3 GLU H 1 1 4 1573 1 1 3 GLU HA H 9.902 6.463 -3.948 1.00 . A A . 3 GLU HA 1 1 4 1574 1 1 3 GLU HB2 H 9.957 5.421 -6.463 1.00 . A A . 3 GLU HB2 1 1 4 1575 1 1 3 GLU HB3 H 8.215 5.516 -6.205 1.00 . A A . 3 GLU HB3 1 1 4 1576 1 1 3 GLU HG2 H 8.208 7.804 -6.181 1.00 . A A . 3 GLU HG2 1 1 4 1577 1 1 3 GLU HG3 H 9.771 7.901 -5.372 1.00 . A A . 3 GLU HG3 1 1 4 1578 1 1 3 GLU N N 10.222 4.398 -4.351 1.00 . A A . 3 GLU N 1 1 4 1579 1 1 3 GLU O O 7.853 4.408 -3.016 1.00 . A A . 3 GLU O 1 1 4 1580 1 1 3 GLU OE1 O 9.198 7.724 -8.502 1.00 . A A . 3 GLU OE1 1 1 4 1581 1 1 3 GLU OE2 O 11.106 7.848 -7.511 1.00 . A A . 3 GLU OE2 1 1 4 1582 1 1 4 CYS C C 4.831 5.344 -4.114 1.00 . A A . 4 CYS C 1 1 4 1583 1 1 4 CYS CA C 5.776 6.132 -3.196 1.00 . A A . 4 CYS CA 1 1 4 1584 1 1 4 CYS CB C 5.271 7.564 -2.945 1.00 . A A . 4 CYS CB 1 1 4 1585 1 1 4 CYS H H 7.279 7.092 -4.409 1.00 . A A . 4 CYS H 1 1 4 1586 1 1 4 CYS HA H 5.893 5.621 -2.252 1.00 . A A . 4 CYS HA 1 1 4 1587 1 1 4 CYS HB2 H 4.982 7.662 -1.910 1.00 . A A . 4 CYS HB2 1 1 4 1588 1 1 4 CYS HB3 H 6.065 8.264 -3.159 1.00 . A A . 4 CYS HB3 1 1 4 1589 1 1 4 CYS N N 7.106 6.302 -3.857 1.00 . A A . 4 CYS N 1 1 4 1590 1 1 4 CYS O O 4.980 5.342 -5.323 1.00 . A A . 4 CYS O 1 1 4 1591 1 1 4 CYS SG S 3.842 7.941 -3.996 1.00 . A A . 4 CYS SG 1 1 4 1592 1 1 5 GLY C C 1.826 4.762 -4.952 1.00 . A A . 5 GLY C 1 1 4 1593 1 1 5 GLY CA C 2.916 3.858 -4.368 1.00 . A A . 5 GLY CA 1 1 4 1594 1 1 5 GLY H H 3.776 4.671 -2.573 1.00 . A A . 5 GLY H 1 1 4 1595 1 1 5 GLY HA2 H 3.456 3.380 -5.172 1.00 . A A . 5 GLY HA2 1 1 4 1596 1 1 5 GLY HA3 H 2.456 3.104 -3.747 1.00 . A A . 5 GLY HA3 1 1 4 1597 1 1 5 GLY N N 3.867 4.662 -3.545 1.00 . A A . 5 GLY N 1 1 4 1598 1 1 5 GLY O O 2.048 5.926 -5.223 1.00 . A A . 5 GLY O 1 1 4 1599 1 1 6 GLY C C -1.724 4.853 -4.868 1.00 . A A . 6 GLY C 1 1 4 1600 1 1 6 GLY CA C -0.464 5.043 -5.720 1.00 . A A . 6 GLY CA 1 1 4 1601 1 1 6 GLY H H 0.495 3.286 -4.926 1.00 . A A . 6 GLY H 1 1 4 1602 1 1 6 GLY HA2 H -0.180 6.085 -5.726 1.00 . A A . 6 GLY HA2 1 1 4 1603 1 1 6 GLY HA3 H -0.665 4.720 -6.731 1.00 . A A . 6 GLY HA3 1 1 4 1604 1 1 6 GLY N N 0.648 4.229 -5.150 1.00 . A A . 6 GLY N 1 1 4 1605 1 1 6 GLY O O -1.656 4.777 -3.656 1.00 . A A . 6 GLY O 1 1 4 1606 1 1 7 PHE C C -4.464 3.090 -4.547 1.00 . A A . 7 PHE C 1 1 4 1607 1 1 7 PHE CA C -4.144 4.585 -4.722 1.00 . A A . 7 PHE CA 1 1 4 1608 1 1 7 PHE CB C -5.234 5.303 -5.540 1.00 . A A . 7 PHE CB 1 1 4 1609 1 1 7 PHE CD1 C -4.944 4.517 -7.925 1.00 . A A . 7 PHE CD1 1 1 4 1610 1 1 7 PHE CD2 C -6.786 3.629 -6.623 1.00 . A A . 7 PHE CD2 1 1 4 1611 1 1 7 PHE CE1 C -5.344 3.742 -9.019 1.00 . A A . 7 PHE CE1 1 1 4 1612 1 1 7 PHE CE2 C -7.186 2.855 -7.719 1.00 . A A . 7 PHE CE2 1 1 4 1613 1 1 7 PHE CG C -5.664 4.462 -6.726 1.00 . A A . 7 PHE CG 1 1 4 1614 1 1 7 PHE CZ C -6.465 2.910 -8.917 1.00 . A A . 7 PHE CZ 1 1 4 1615 1 1 7 PHE H H -2.899 4.834 -6.472 1.00 . A A . 7 PHE H 1 1 4 1616 1 1 7 PHE HA H -4.056 5.050 -3.755 1.00 . A A . 7 PHE HA 1 1 4 1617 1 1 7 PHE HB2 H -6.089 5.485 -4.907 1.00 . A A . 7 PHE HB2 1 1 4 1618 1 1 7 PHE HB3 H -4.846 6.246 -5.895 1.00 . A A . 7 PHE HB3 1 1 4 1619 1 1 7 PHE HD1 H -4.079 5.160 -8.007 1.00 . A A . 7 PHE HD1 1 1 4 1620 1 1 7 PHE HD2 H -7.342 3.585 -5.699 1.00 . A A . 7 PHE HD2 1 1 4 1621 1 1 7 PHE HE1 H -4.788 3.785 -9.945 1.00 . A A . 7 PHE HE1 1 1 4 1622 1 1 7 PHE HE2 H -8.051 2.213 -7.639 1.00 . A A . 7 PHE HE2 1 1 4 1623 1 1 7 PHE HZ H -6.773 2.312 -9.761 1.00 . A A . 7 PHE HZ 1 1 4 1624 1 1 7 PHE N N -2.873 4.773 -5.494 1.00 . A A . 7 PHE N 1 1 4 1625 1 1 7 PHE O O -5.190 2.711 -3.648 1.00 . A A . 7 PHE O 1 1 4 1626 1 1 8 TRP C C -3.073 -0.020 -5.937 1.00 . A A . 8 TRP C 1 1 4 1627 1 1 8 TRP CA C -4.203 0.776 -5.269 1.00 . A A . 8 TRP CA 1 1 4 1628 1 1 8 TRP CB C -5.538 0.561 -5.990 1.00 . A A . 8 TRP CB 1 1 4 1629 1 1 8 TRP CD1 C -6.159 -1.583 -4.795 1.00 . A A . 8 TRP CD1 1 1 4 1630 1 1 8 TRP CD2 C -6.141 -1.808 -7.033 1.00 . A A . 8 TRP CD2 1 1 4 1631 1 1 8 TRP CE2 C -6.501 -3.069 -6.502 1.00 . A A . 8 TRP CE2 1 1 4 1632 1 1 8 TRP CE3 C -6.056 -1.677 -8.430 1.00 . A A . 8 TRP CE3 1 1 4 1633 1 1 8 TRP CG C -5.929 -0.882 -5.930 1.00 . A A . 8 TRP CG 1 1 4 1634 1 1 8 TRP CH2 C -6.679 -4.014 -8.715 1.00 . A A . 8 TRP CH2 1 1 4 1635 1 1 8 TRP CZ2 C -6.768 -4.161 -7.327 1.00 . A A . 8 TRP CZ2 1 1 4 1636 1 1 8 TRP CZ3 C -6.324 -2.775 -9.265 1.00 . A A . 8 TRP CZ3 1 1 4 1637 1 1 8 TRP H H -3.346 2.567 -6.111 1.00 . A A . 8 TRP H 1 1 4 1638 1 1 8 TRP HA H -4.293 0.497 -4.231 1.00 . A A . 8 TRP HA 1 1 4 1639 1 1 8 TRP HB2 H -6.302 1.158 -5.513 1.00 . A A . 8 TRP HB2 1 1 4 1640 1 1 8 TRP HB3 H -5.440 0.865 -7.021 1.00 . A A . 8 TRP HB3 1 1 4 1641 1 1 8 TRP HD1 H -6.090 -1.193 -3.790 1.00 . A A . 8 TRP HD1 1 1 4 1642 1 1 8 TRP HE1 H -6.714 -3.592 -4.496 1.00 . A A . 8 TRP HE1 1 1 4 1643 1 1 8 TRP HE3 H -5.784 -0.728 -8.865 1.00 . A A . 8 TRP HE3 1 1 4 1644 1 1 8 TRP HH2 H -6.884 -4.855 -9.361 1.00 . A A . 8 TRP HH2 1 1 4 1645 1 1 8 TRP HZ2 H -7.041 -5.114 -6.899 1.00 . A A . 8 TRP HZ2 1 1 4 1646 1 1 8 TRP HZ3 H -6.256 -2.663 -10.337 1.00 . A A . 8 TRP HZ3 1 1 4 1647 1 1 8 TRP N N -3.929 2.242 -5.393 1.00 . A A . 8 TRP N 1 1 4 1648 1 1 8 TRP NE1 N -6.498 -2.880 -5.133 1.00 . A A . 8 TRP NE1 1 1 4 1649 1 1 8 TRP O O -3.254 -0.638 -6.970 1.00 . A A . 8 TRP O 1 1 4 1650 1 1 9 TRP C C -0.564 -2.078 -5.202 1.00 . A A . 9 TRP C 1 1 4 1651 1 1 9 TRP CA C -0.745 -0.745 -5.936 1.00 . A A . 9 TRP CA 1 1 4 1652 1 1 9 TRP CB C 0.466 0.172 -5.720 1.00 . A A . 9 TRP CB 1 1 4 1653 1 1 9 TRP CD1 C -0.703 1.866 -7.209 1.00 . A A . 9 TRP CD1 1 1 4 1654 1 1 9 TRP CD2 C 1.535 2.076 -7.252 1.00 . A A . 9 TRP CD2 1 1 4 1655 1 1 9 TRP CE2 C 1.013 3.072 -8.110 1.00 . A A . 9 TRP CE2 1 1 4 1656 1 1 9 TRP CE3 C 2.932 1.995 -7.104 1.00 . A A . 9 TRP CE3 1 1 4 1657 1 1 9 TRP CG C 0.422 1.320 -6.688 1.00 . A A . 9 TRP CG 1 1 4 1658 1 1 9 TRP CH2 C 3.228 3.863 -8.637 1.00 . A A . 9 TRP CH2 1 1 4 1659 1 1 9 TRP CZ2 C 1.843 3.956 -8.795 1.00 . A A . 9 TRP CZ2 1 1 4 1660 1 1 9 TRP CZ3 C 3.772 2.884 -7.795 1.00 . A A . 9 TRP CZ3 1 1 4 1661 1 1 9 TRP H H -1.785 0.510 -4.518 1.00 . A A . 9 TRP H 1 1 4 1662 1 1 9 TRP HA H -0.898 -0.912 -6.990 1.00 . A A . 9 TRP HA 1 1 4 1663 1 1 9 TRP HB2 H 0.449 0.557 -4.709 1.00 . A A . 9 TRP HB2 1 1 4 1664 1 1 9 TRP HB3 H 1.375 -0.389 -5.871 1.00 . A A . 9 TRP HB3 1 1 4 1665 1 1 9 TRP HD1 H -1.712 1.544 -7.000 1.00 . A A . 9 TRP HD1 1 1 4 1666 1 1 9 TRP HE1 H -0.983 3.460 -8.552 1.00 . A A . 9 TRP HE1 1 1 4 1667 1 1 9 TRP HE3 H 3.362 1.243 -6.457 1.00 . A A . 9 TRP HE3 1 1 4 1668 1 1 9 TRP HH2 H 3.877 4.543 -9.166 1.00 . A A . 9 TRP HH2 1 1 4 1669 1 1 9 TRP HZ2 H 1.418 4.710 -9.439 1.00 . A A . 9 TRP HZ2 1 1 4 1670 1 1 9 TRP HZ3 H 4.841 2.816 -7.674 1.00 . A A . 9 TRP HZ3 1 1 4 1671 1 1 9 TRP N N -1.903 0.000 -5.349 1.00 . A A . 9 TRP N 1 1 4 1672 1 1 9 TRP NE1 N -0.353 2.902 -8.051 1.00 . A A . 9 TRP NE1 1 1 4 1673 1 1 9 TRP O O -1.236 -2.352 -4.230 1.00 . A A . 9 TRP O 1 1 4 1674 1 1 10 LYS C C 1.606 -4.089 -3.879 1.00 . A A . 10 LYS C 1 1 4 1675 1 1 10 LYS CA C 0.543 -4.226 -4.967 1.00 . A A . 10 LYS CA 1 1 4 1676 1 1 10 LYS CB C 1.024 -5.196 -6.043 1.00 . A A . 10 LYS CB 1 1 4 1677 1 1 10 LYS CD C 0.278 -6.940 -7.676 1.00 . A A . 10 LYS CD 1 1 4 1678 1 1 10 LYS CE C -0.595 -6.556 -8.878 1.00 . A A . 10 LYS CE 1 1 4 1679 1 1 10 LYS CG C -0.130 -6.114 -6.455 1.00 . A A . 10 LYS CG 1 1 4 1680 1 1 10 LYS H H 0.873 -2.681 -6.443 1.00 . A A . 10 LYS H 1 1 4 1681 1 1 10 LYS HA H -0.384 -4.577 -4.544 1.00 . A A . 10 LYS HA 1 1 4 1682 1 1 10 LYS HB2 H 1.375 -4.640 -6.899 1.00 . A A . 10 LYS HB2 1 1 4 1683 1 1 10 LYS HB3 H 1.833 -5.795 -5.646 1.00 . A A . 10 LYS HB3 1 1 4 1684 1 1 10 LYS HD2 H 1.315 -6.750 -7.911 1.00 . A A . 10 LYS HD2 1 1 4 1685 1 1 10 LYS HD3 H 0.146 -7.989 -7.459 1.00 . A A . 10 LYS HD3 1 1 4 1686 1 1 10 LYS HE2 H -0.637 -5.480 -8.979 1.00 . A A . 10 LYS HE2 1 1 4 1687 1 1 10 LYS HE3 H -0.210 -7.006 -9.778 1.00 . A A . 10 LYS HE3 1 1 4 1688 1 1 10 LYS HG2 H -0.368 -6.777 -5.637 1.00 . A A . 10 LYS HG2 1 1 4 1689 1 1 10 LYS HG3 H -0.996 -5.517 -6.700 1.00 . A A . 10 LYS HG3 1 1 4 1690 1 1 10 LYS HZ1 H -1.863 -8.073 -8.209 1.00 . A A . 10 LYS HZ1 1 1 4 1691 1 1 10 LYS HZ2 H -2.523 -7.111 -9.444 1.00 . A A . 10 LYS HZ2 1 1 4 1692 1 1 10 LYS HZ3 H -2.415 -6.507 -7.859 1.00 . A A . 10 LYS HZ3 1 1 4 1693 1 1 10 LYS N N 0.336 -2.915 -5.657 1.00 . A A . 10 LYS N 1 1 4 1694 1 1 10 LYS NZ N -1.950 -7.104 -8.574 1.00 . A A . 10 LYS NZ 1 1 4 1695 1 1 10 LYS O O 2.621 -3.445 -4.069 1.00 . A A . 10 LYS O 1 1 4 1696 1 1 11 CYS C C 2.324 -5.864 -0.772 1.00 . A A . 11 CYS C 1 1 4 1697 1 1 11 CYS CA C 2.380 -4.604 -1.644 1.00 . A A . 11 CYS CA 1 1 4 1698 1 1 11 CYS CB C 1.966 -3.363 -0.850 1.00 . A A . 11 CYS CB 1 1 4 1699 1 1 11 CYS H H 0.558 -5.211 -2.617 1.00 . A A . 11 CYS H 1 1 4 1700 1 1 11 CYS HA H 3.368 -4.470 -2.055 1.00 . A A . 11 CYS HA 1 1 4 1701 1 1 11 CYS HB2 H 2.168 -2.483 -1.438 1.00 . A A . 11 CYS HB2 1 1 4 1702 1 1 11 CYS HB3 H 0.909 -3.417 -0.636 1.00 . A A . 11 CYS HB3 1 1 4 1703 1 1 11 CYS N N 1.382 -4.694 -2.744 1.00 . A A . 11 CYS N 1 1 4 1704 1 1 11 CYS O O 1.359 -6.606 -0.799 1.00 . A A . 11 CYS O 1 1 4 1705 1 1 11 CYS SG S 2.885 -3.265 0.705 1.00 . A A . 11 CYS SG 1 1 4 1706 1 1 12 GLY C C 3.034 -6.890 2.319 1.00 . A A . 12 GLY C 1 1 4 1707 1 1 12 GLY CA C 3.360 -7.307 0.885 1.00 . A A . 12 GLY CA 1 1 4 1708 1 1 12 GLY H H 4.110 -5.486 0.010 1.00 . A A . 12 GLY H 1 1 4 1709 1 1 12 GLY HA2 H 2.622 -8.014 0.536 1.00 . A A . 12 GLY HA2 1 1 4 1710 1 1 12 GLY HA3 H 4.338 -7.760 0.858 1.00 . A A . 12 GLY HA3 1 1 4 1711 1 1 12 GLY N N 3.349 -6.103 0.005 1.00 . A A . 12 GLY N 1 1 4 1712 1 1 12 GLY O O 1.964 -6.382 2.596 1.00 . A A . 12 GLY O 1 1 4 1713 1 1 13 ARG C C 4.200 -5.259 4.903 1.00 . A A . 13 ARG C 1 1 4 1714 1 1 13 ARG CA C 3.704 -6.695 4.656 1.00 . A A . 13 ARG CA 1 1 4 1715 1 1 13 ARG CB C 4.504 -7.695 5.498 1.00 . A A . 13 ARG CB 1 1 4 1716 1 1 13 ARG CD C 3.159 -7.255 7.573 1.00 . A A . 13 ARG CD 1 1 4 1717 1 1 13 ARG CG C 3.598 -8.323 6.562 1.00 . A A . 13 ARG CG 1 1 4 1718 1 1 13 ARG CZ C 4.108 -7.086 9.801 1.00 . A A . 13 ARG CZ 1 1 4 1719 1 1 13 ARG H H 4.809 -7.498 2.982 1.00 . A A . 13 ARG H 1 1 4 1720 1 1 13 ARG HA H 2.653 -6.773 4.889 1.00 . A A . 13 ARG HA 1 1 4 1721 1 1 13 ARG HB2 H 4.897 -8.472 4.858 1.00 . A A . 13 ARG HB2 1 1 4 1722 1 1 13 ARG HB3 H 5.322 -7.183 5.983 1.00 . A A . 13 ARG HB3 1 1 4 1723 1 1 13 ARG HD2 H 2.957 -6.322 7.068 1.00 . A A . 13 ARG HD2 1 1 4 1724 1 1 13 ARG HD3 H 2.286 -7.587 8.113 1.00 . A A . 13 ARG HD3 1 1 4 1725 1 1 13 ARG HE H 5.221 -7.012 8.155 1.00 . A A . 13 ARG HE 1 1 4 1726 1 1 13 ARG HG2 H 2.725 -8.745 6.085 1.00 . A A . 13 ARG HG2 1 1 4 1727 1 1 13 ARG HG3 H 4.136 -9.103 7.079 1.00 . A A . 13 ARG HG3 1 1 4 1728 1 1 13 ARG HH11 H 3.158 -5.320 9.783 1.00 . A A . 13 ARG HH11 1 1 4 1729 1 1 13 ARG HH12 H 3.325 -6.064 11.339 1.00 . A A . 13 ARG HH12 1 1 4 1730 1 1 13 ARG HH21 H 5.013 -8.848 10.121 1.00 . A A . 13 ARG HH21 1 1 4 1731 1 1 13 ARG HH22 H 4.377 -8.065 11.530 1.00 . A A . 13 ARG HH22 1 1 4 1732 1 1 13 ARG N N 3.952 -7.093 3.234 1.00 . A A . 13 ARG N 1 1 4 1733 1 1 13 ARG NE N 4.311 -7.103 8.510 1.00 . A A . 13 ARG NE 1 1 4 1734 1 1 13 ARG NH1 N 3.481 -6.078 10.351 1.00 . A A . 13 ARG NH1 1 1 4 1735 1 1 13 ARG NH2 N 4.531 -8.077 10.542 1.00 . A A . 13 ARG NH2 1 1 4 1736 1 1 13 ARG O O 4.592 -4.913 6.001 1.00 . A A . 13 ARG O 1 1 4 1737 1 1 14 GLY C C 6.099 -2.897 3.523 1.00 . A A . 14 GLY C 1 1 4 1738 1 1 14 GLY CA C 4.666 -3.022 4.055 1.00 . A A . 14 GLY CA 1 1 4 1739 1 1 14 GLY H H 3.874 -4.727 3.013 1.00 . A A . 14 GLY H 1 1 4 1740 1 1 14 GLY HA2 H 4.016 -2.357 3.503 1.00 . A A . 14 GLY HA2 1 1 4 1741 1 1 14 GLY HA3 H 4.648 -2.756 5.101 1.00 . A A . 14 GLY HA3 1 1 4 1742 1 1 14 GLY N N 4.191 -4.428 3.889 1.00 . A A . 14 GLY N 1 1 4 1743 1 1 14 GLY O O 6.884 -2.114 4.024 1.00 . A A . 14 GLY O 1 1 4 1744 1 1 15 LYS C C 8.009 -2.260 1.168 1.00 . A A . 15 LYS C 1 1 4 1745 1 1 15 LYS CA C 7.828 -3.575 1.942 1.00 . A A . 15 LYS CA 1 1 4 1746 1 1 15 LYS CB C 7.968 -4.788 1.010 1.00 . A A . 15 LYS CB 1 1 4 1747 1 1 15 LYS CD C 8.852 -6.606 2.481 1.00 . A A . 15 LYS CD 1 1 4 1748 1 1 15 LYS CE C 10.134 -7.242 3.026 1.00 . A A . 15 LYS CE 1 1 4 1749 1 1 15 LYS CG C 9.212 -5.590 1.396 1.00 . A A . 15 LYS CG 1 1 4 1750 1 1 15 LYS H H 5.793 -4.279 2.118 1.00 . A A . 15 LYS H 1 1 4 1751 1 1 15 LYS HA H 8.553 -3.639 2.731 1.00 . A A . 15 LYS HA 1 1 4 1752 1 1 15 LYS HB2 H 7.093 -5.414 1.098 1.00 . A A . 15 LYS HB2 1 1 4 1753 1 1 15 LYS HB3 H 8.066 -4.448 -0.010 1.00 . A A . 15 LYS HB3 1 1 4 1754 1 1 15 LYS HD2 H 8.326 -6.105 3.282 1.00 . A A . 15 LYS HD2 1 1 4 1755 1 1 15 LYS HD3 H 8.221 -7.375 2.060 1.00 . A A . 15 LYS HD3 1 1 4 1756 1 1 15 LYS HE2 H 10.827 -7.437 2.219 1.00 . A A . 15 LYS HE2 1 1 4 1757 1 1 15 LYS HE3 H 10.586 -6.599 3.765 1.00 . A A . 15 LYS HE3 1 1 4 1758 1 1 15 LYS HG2 H 9.587 -6.109 0.525 1.00 . A A . 15 LYS HG2 1 1 4 1759 1 1 15 LYS HG3 H 9.971 -4.920 1.769 1.00 . A A . 15 LYS HG3 1 1 4 1760 1 1 15 LYS HZ1 H 8.958 -8.325 4.363 1.00 . A A . 15 LYS HZ1 1 1 4 1761 1 1 15 LYS HZ2 H 10.513 -8.968 4.127 1.00 . A A . 15 LYS HZ2 1 1 4 1762 1 1 15 LYS HZ3 H 9.322 -9.158 2.931 1.00 . A A . 15 LYS HZ3 1 1 4 1763 1 1 15 LYS N N 6.444 -3.656 2.507 1.00 . A A . 15 LYS N 1 1 4 1764 1 1 15 LYS NZ N 9.698 -8.519 3.659 1.00 . A A . 15 LYS NZ 1 1 4 1765 1 1 15 LYS O O 8.872 -1.470 1.497 1.00 . A A . 15 LYS O 1 1 4 1766 1 1 16 PRO C C 6.650 0.353 0.133 1.00 . A A . 16 PRO C 1 1 4 1767 1 1 16 PRO CA C 7.256 -0.823 -0.646 1.00 . A A . 16 PRO CA 1 1 4 1768 1 1 16 PRO CB C 6.412 -1.148 -1.876 1.00 . A A . 16 PRO CB 1 1 4 1769 1 1 16 PRO CD C 6.117 -2.959 -0.297 1.00 . A A . 16 PRO CD 1 1 4 1770 1 1 16 PRO CG C 5.458 -2.209 -1.426 1.00 . A A . 16 PRO CG 1 1 4 1771 1 1 16 PRO HA H 8.273 -0.615 -0.935 1.00 . A A . 16 PRO HA 1 1 4 1772 1 1 16 PRO HB2 H 5.874 -0.269 -2.204 1.00 . A A . 16 PRO HB2 1 1 4 1773 1 1 16 PRO HB3 H 7.035 -1.527 -2.671 1.00 . A A . 16 PRO HB3 1 1 4 1774 1 1 16 PRO HD2 H 5.409 -3.148 0.497 1.00 . A A . 16 PRO HD2 1 1 4 1775 1 1 16 PRO HD3 H 6.542 -3.882 -0.655 1.00 . A A . 16 PRO HD3 1 1 4 1776 1 1 16 PRO HG2 H 4.538 -1.753 -1.082 1.00 . A A . 16 PRO HG2 1 1 4 1777 1 1 16 PRO HG3 H 5.248 -2.886 -2.238 1.00 . A A . 16 PRO HG3 1 1 4 1778 1 1 16 PRO N N 7.182 -2.061 0.167 1.00 . A A . 16 PRO N 1 1 4 1779 1 1 16 PRO O O 5.569 0.236 0.678 1.00 . A A . 16 PRO O 1 1 4 1780 1 1 17 PRO C C 5.715 3.292 0.118 1.00 . A A . 17 PRO C 1 1 4 1781 1 1 17 PRO CA C 6.879 2.652 0.884 1.00 . A A . 17 PRO CA 1 1 4 1782 1 1 17 PRO CB C 8.096 3.576 0.913 1.00 . A A . 17 PRO CB 1 1 4 1783 1 1 17 PRO CD C 8.678 1.680 -0.463 1.00 . A A . 17 PRO CD 1 1 4 1784 1 1 17 PRO CG C 8.937 3.149 -0.246 1.00 . A A . 17 PRO CG 1 1 4 1785 1 1 17 PRO HA H 6.582 2.399 1.889 1.00 . A A . 17 PRO HA 1 1 4 1786 1 1 17 PRO HB2 H 7.785 4.606 0.798 1.00 . A A . 17 PRO HB2 1 1 4 1787 1 1 17 PRO HB3 H 8.643 3.448 1.834 1.00 . A A . 17 PRO HB3 1 1 4 1788 1 1 17 PRO HD2 H 8.643 1.456 -1.521 1.00 . A A . 17 PRO HD2 1 1 4 1789 1 1 17 PRO HD3 H 9.432 1.085 0.028 1.00 . A A . 17 PRO HD3 1 1 4 1790 1 1 17 PRO HG2 H 8.659 3.709 -1.127 1.00 . A A . 17 PRO HG2 1 1 4 1791 1 1 17 PRO HG3 H 9.981 3.305 -0.022 1.00 . A A . 17 PRO HG3 1 1 4 1792 1 1 17 PRO N N 7.367 1.452 0.163 1.00 . A A . 17 PRO N 1 1 4 1793 1 1 17 PRO O O 5.912 3.993 -0.857 1.00 . A A . 17 PRO O 1 1 4 1794 1 1 18 CYS C C 3.310 5.167 0.035 1.00 . A A . 18 CYS C 1 1 4 1795 1 1 18 CYS CA C 3.322 3.645 -0.153 1.00 . A A . 18 CYS CA 1 1 4 1796 1 1 18 CYS CB C 2.094 3.011 0.506 1.00 . A A . 18 CYS CB 1 1 4 1797 1 1 18 CYS H H 4.367 2.482 1.338 1.00 . A A . 18 CYS H 1 1 4 1798 1 1 18 CYS HA H 3.347 3.395 -1.201 1.00 . A A . 18 CYS HA 1 1 4 1799 1 1 18 CYS HB2 H 2.172 3.096 1.578 1.00 . A A . 18 CYS HB2 1 1 4 1800 1 1 18 CYS HB3 H 1.201 3.520 0.168 1.00 . A A . 18 CYS HB3 1 1 4 1801 1 1 18 CYS N N 4.501 3.052 0.551 1.00 . A A . 18 CYS N 1 1 4 1802 1 1 18 CYS O O 3.948 5.694 0.929 1.00 . A A . 18 CYS O 1 1 4 1803 1 1 18 CYS SG S 1.992 1.266 0.049 1.00 . A A . 18 CYS SG 1 1 4 1804 1 1 19 CYS C C 1.874 7.751 0.661 1.00 . A A . 19 CYS C 1 1 4 1805 1 1 19 CYS CA C 2.539 7.363 -0.666 1.00 . A A . 19 CYS CA 1 1 4 1806 1 1 19 CYS CB C 1.701 7.848 -1.856 1.00 . A A . 19 CYS CB 1 1 4 1807 1 1 19 CYS H H 2.084 5.426 -1.511 1.00 . A A . 19 CYS H 1 1 4 1808 1 1 19 CYS HA H 3.535 7.775 -0.724 1.00 . A A . 19 CYS HA 1 1 4 1809 1 1 19 CYS HB2 H 1.451 7.010 -2.488 1.00 . A A . 19 CYS HB2 1 1 4 1810 1 1 19 CYS HB3 H 0.795 8.310 -1.493 1.00 . A A . 19 CYS HB3 1 1 4 1811 1 1 19 CYS N N 2.590 5.874 -0.799 1.00 . A A . 19 CYS N 1 1 4 1812 1 1 19 CYS O O 1.120 6.984 1.234 1.00 . A A . 19 CYS O 1 1 4 1813 1 1 19 CYS SG S 2.649 9.061 -2.812 1.00 . A A . 19 CYS SG 1 1 4 1814 1 1 20 LYS C C 0.020 9.313 2.377 1.00 . A A . 20 LYS C 1 1 4 1815 1 1 20 LYS CA C 1.552 9.371 2.449 1.00 . A A . 20 LYS CA 1 1 4 1816 1 1 20 LYS CB C 2.029 10.812 2.649 1.00 . A A . 20 LYS CB 1 1 4 1817 1 1 20 LYS CD C 3.349 11.663 4.601 1.00 . A A . 20 LYS CD 1 1 4 1818 1 1 20 LYS CE C 3.271 13.156 4.937 1.00 . A A . 20 LYS CE 1 1 4 1819 1 1 20 LYS CG C 1.975 11.167 4.138 1.00 . A A . 20 LYS CG 1 1 4 1820 1 1 20 LYS H H 2.773 9.522 0.684 1.00 . A A . 20 LYS H 1 1 4 1821 1 1 20 LYS HA H 1.914 8.753 3.251 1.00 . A A . 20 LYS HA 1 1 4 1822 1 1 20 LYS HB2 H 3.044 10.907 2.291 1.00 . A A . 20 LYS HB2 1 1 4 1823 1 1 20 LYS HB3 H 1.388 11.484 2.097 1.00 . A A . 20 LYS HB3 1 1 4 1824 1 1 20 LYS HD2 H 3.653 11.111 5.479 1.00 . A A . 20 LYS HD2 1 1 4 1825 1 1 20 LYS HD3 H 4.071 11.510 3.813 1.00 . A A . 20 LYS HD3 1 1 4 1826 1 1 20 LYS HE2 H 2.316 13.388 5.388 1.00 . A A . 20 LYS HE2 1 1 4 1827 1 1 20 LYS HE3 H 4.077 13.433 5.598 1.00 . A A . 20 LYS HE3 1 1 4 1828 1 1 20 LYS HG2 H 1.239 11.941 4.296 1.00 . A A . 20 LYS HG2 1 1 4 1829 1 1 20 LYS HG3 H 1.701 10.292 4.707 1.00 . A A . 20 LYS HG3 1 1 4 1830 1 1 20 LYS HZ1 H 3.392 14.889 3.788 1.00 . A A . 20 LYS HZ1 1 1 4 1831 1 1 20 LYS HZ2 H 2.640 13.588 2.998 1.00 . A A . 20 LYS HZ2 1 1 4 1832 1 1 20 LYS HZ3 H 4.328 13.604 3.196 1.00 . A A . 20 LYS HZ3 1 1 4 1833 1 1 20 LYS N N 2.156 8.930 1.157 1.00 . A A . 20 LYS N 1 1 4 1834 1 1 20 LYS NZ N 3.419 13.862 3.632 1.00 . A A . 20 LYS NZ 1 1 4 1835 1 1 20 LYS O O -0.587 9.839 1.462 1.00 . A A . 20 LYS O 1 1 4 1836 1 1 21 GLY C C -2.512 7.145 2.909 1.00 . A A . 21 GLY C 1 1 4 1837 1 1 21 GLY CA C -2.093 8.560 3.326 1.00 . A A . 21 GLY CA 1 1 4 1838 1 1 21 GLY H H -0.088 8.248 4.052 1.00 . A A . 21 GLY H 1 1 4 1839 1 1 21 GLY HA2 H -2.471 8.768 4.318 1.00 . A A . 21 GLY HA2 1 1 4 1840 1 1 21 GLY HA3 H -2.506 9.274 2.630 1.00 . A A . 21 GLY HA3 1 1 4 1841 1 1 21 GLY N N -0.602 8.668 3.332 1.00 . A A . 21 GLY N 1 1 4 1842 1 1 21 GLY O O -3.562 6.664 3.291 1.00 . A A . 21 GLY O 1 1 4 1843 1 1 22 TYR C C -1.402 4.063 2.613 1.00 . A A . 22 TYR C 1 1 4 1844 1 1 22 TYR CA C -2.043 5.094 1.677 1.00 . A A . 22 TYR CA 1 1 4 1845 1 1 22 TYR CB C -1.462 4.967 0.262 1.00 . A A . 22 TYR CB 1 1 4 1846 1 1 22 TYR CD1 C -3.272 5.780 -1.302 1.00 . A A . 22 TYR CD1 1 1 4 1847 1 1 22 TYR CD2 C -1.408 7.249 -0.819 1.00 . A A . 22 TYR CD2 1 1 4 1848 1 1 22 TYR CE1 C -3.825 6.759 -2.140 1.00 . A A . 22 TYR CE1 1 1 4 1849 1 1 22 TYR CE2 C -1.958 8.227 -1.654 1.00 . A A . 22 TYR CE2 1 1 4 1850 1 1 22 TYR CG C -2.064 6.024 -0.641 1.00 . A A . 22 TYR CG 1 1 4 1851 1 1 22 TYR CZ C -3.167 7.982 -2.316 1.00 . A A . 22 TYR CZ 1 1 4 1852 1 1 22 TYR H H -0.859 6.889 1.830 1.00 . A A . 22 TYR H 1 1 4 1853 1 1 22 TYR HA H -3.113 4.962 1.649 1.00 . A A . 22 TYR HA 1 1 4 1854 1 1 22 TYR HB2 H -0.391 5.094 0.299 1.00 . A A . 22 TYR HB2 1 1 4 1855 1 1 22 TYR HB3 H -1.692 3.989 -0.133 1.00 . A A . 22 TYR HB3 1 1 4 1856 1 1 22 TYR HD1 H -3.781 4.838 -1.167 1.00 . A A . 22 TYR HD1 1 1 4 1857 1 1 22 TYR HD2 H -0.474 7.439 -0.309 1.00 . A A . 22 TYR HD2 1 1 4 1858 1 1 22 TYR HE1 H -4.758 6.571 -2.648 1.00 . A A . 22 TYR HE1 1 1 4 1859 1 1 22 TYR HE2 H -1.452 9.171 -1.789 1.00 . A A . 22 TYR HE2 1 1 4 1860 1 1 22 TYR HH H -3.370 8.806 -4.028 1.00 . A A . 22 TYR HH 1 1 4 1861 1 1 22 TYR N N -1.698 6.479 2.124 1.00 . A A . 22 TYR N 1 1 4 1862 1 1 22 TYR O O -0.294 4.240 3.084 1.00 . A A . 22 TYR O 1 1 4 1863 1 1 22 TYR OH O -3.711 8.946 -3.141 1.00 . A A . 22 TYR OH 1 1 4 1864 1 1 23 ALA C C -1.450 0.597 3.029 1.00 . A A . 23 ALA C 1 1 4 1865 1 1 23 ALA CA C -1.544 1.927 3.779 1.00 . A A . 23 ALA CA 1 1 4 1866 1 1 23 ALA CB C -2.546 1.823 4.933 1.00 . A A . 23 ALA CB 1 1 4 1867 1 1 23 ALA H H -2.982 2.867 2.481 1.00 . A A . 23 ALA H 1 1 4 1868 1 1 23 ALA HA H -0.576 2.217 4.158 1.00 . A A . 23 ALA HA 1 1 4 1869 1 1 23 ALA HB1 H -3.266 2.625 4.858 1.00 . A A . 23 ALA HB1 1 1 4 1870 1 1 23 ALA HB2 H -2.021 1.900 5.874 1.00 . A A . 23 ALA HB2 1 1 4 1871 1 1 23 ALA HB3 H -3.057 0.873 4.882 1.00 . A A . 23 ALA HB3 1 1 4 1872 1 1 23 ALA N N -2.095 2.985 2.879 1.00 . A A . 23 ALA N 1 1 4 1873 1 1 23 ALA O O -2.241 0.319 2.147 1.00 . A A . 23 ALA O 1 1 4 1874 1 1 24 CYS C C -1.178 -2.610 3.368 1.00 . A A . 24 CYS C 1 1 4 1875 1 1 24 CYS CA C -0.339 -1.536 2.668 1.00 . A A . 24 CYS CA 1 1 4 1876 1 1 24 CYS CB C 1.156 -1.864 2.763 1.00 . A A . 24 CYS CB 1 1 4 1877 1 1 24 CYS H H 0.135 0.024 4.083 1.00 . A A . 24 CYS H 1 1 4 1878 1 1 24 CYS HA H -0.632 -1.445 1.633 1.00 . A A . 24 CYS HA 1 1 4 1879 1 1 24 CYS HB2 H 1.716 -1.147 2.183 1.00 . A A . 24 CYS HB2 1 1 4 1880 1 1 24 CYS HB3 H 1.467 -1.815 3.795 1.00 . A A . 24 CYS HB3 1 1 4 1881 1 1 24 CYS N N -0.488 -0.224 3.369 1.00 . A A . 24 CYS N 1 1 4 1882 1 1 24 CYS O O -1.568 -2.461 4.512 1.00 . A A . 24 CYS O 1 1 4 1883 1 1 24 CYS SG S 1.468 -3.528 2.120 1.00 . A A . 24 CYS SG 1 1 4 1884 1 1 25 SER C C -1.732 -6.150 2.892 1.00 . A A . 25 SER C 1 1 4 1885 1 1 25 SER CA C -2.280 -4.775 3.288 1.00 . A A . 25 SER CA 1 1 4 1886 1 1 25 SER CB C -3.688 -4.577 2.719 1.00 . A A . 25 SER CB 1 1 4 1887 1 1 25 SER H H -1.134 -3.774 1.761 1.00 . A A . 25 SER H 1 1 4 1888 1 1 25 SER HA H -2.303 -4.679 4.358 1.00 . A A . 25 SER HA 1 1 4 1889 1 1 25 SER HB2 H -3.641 -4.519 1.645 1.00 . A A . 25 SER HB2 1 1 4 1890 1 1 25 SER HB3 H -4.311 -5.415 3.004 1.00 . A A . 25 SER HB3 1 1 4 1891 1 1 25 SER HG H -4.703 -3.571 4.043 1.00 . A A . 25 SER HG 1 1 4 1892 1 1 25 SER N N -1.460 -3.686 2.682 1.00 . A A . 25 SER N 1 1 4 1893 1 1 25 SER O O -1.956 -6.623 1.794 1.00 . A A . 25 SER O 1 1 4 1894 1 1 25 SER OG O -4.237 -3.367 3.229 1.00 . A A . 25 SER OG 1 1 4 1895 1 1 26 LYS C C -1.614 -9.169 3.364 1.00 . A A . 26 LYS C 1 1 4 1896 1 1 26 LYS CA C -0.470 -8.154 3.462 1.00 . A A . 26 LYS CA 1 1 4 1897 1 1 26 LYS CB C 0.463 -8.497 4.630 1.00 . A A . 26 LYS CB 1 1 4 1898 1 1 26 LYS CD C 1.903 -10.045 3.280 1.00 . A A . 26 LYS CD 1 1 4 1899 1 1 26 LYS CE C 1.822 -11.459 2.696 1.00 . A A . 26 LYS CE 1 1 4 1900 1 1 26 LYS CG C 0.972 -9.936 4.491 1.00 . A A . 26 LYS CG 1 1 4 1901 1 1 26 LYS H H -0.858 -6.401 4.664 1.00 . A A . 26 LYS H 1 1 4 1902 1 1 26 LYS HA H 0.086 -8.124 2.541 1.00 . A A . 26 LYS HA 1 1 4 1903 1 1 26 LYS HB2 H 1.303 -7.818 4.629 1.00 . A A . 26 LYS HB2 1 1 4 1904 1 1 26 LYS HB3 H -0.075 -8.397 5.561 1.00 . A A . 26 LYS HB3 1 1 4 1905 1 1 26 LYS HD2 H 1.604 -9.326 2.532 1.00 . A A . 26 LYS HD2 1 1 4 1906 1 1 26 LYS HD3 H 2.918 -9.843 3.588 1.00 . A A . 26 LYS HD3 1 1 4 1907 1 1 26 LYS HE2 H 2.813 -11.876 2.588 1.00 . A A . 26 LYS HE2 1 1 4 1908 1 1 26 LYS HE3 H 1.213 -12.090 3.324 1.00 . A A . 26 LYS HE3 1 1 4 1909 1 1 26 LYS HG2 H 1.510 -10.215 5.385 1.00 . A A . 26 LYS HG2 1 1 4 1910 1 1 26 LYS HG3 H 0.132 -10.603 4.356 1.00 . A A . 26 LYS HG3 1 1 4 1911 1 1 26 LYS HZ1 H 1.051 -12.229 0.921 1.00 . A A . 26 LYS HZ1 1 1 4 1912 1 1 26 LYS HZ2 H 1.782 -10.705 0.755 1.00 . A A . 26 LYS HZ2 1 1 4 1913 1 1 26 LYS HZ3 H 0.248 -10.842 1.475 1.00 . A A . 26 LYS HZ3 1 1 4 1914 1 1 26 LYS N N -1.021 -6.800 3.782 1.00 . A A . 26 LYS N 1 1 4 1915 1 1 26 LYS NZ N 1.177 -11.296 1.362 1.00 . A A . 26 LYS NZ 1 1 4 1916 1 1 26 LYS O O -1.588 -10.070 2.546 1.00 . A A . 26 LYS O 1 1 4 1917 1 1 27 THR C C -4.491 -9.883 2.803 1.00 . A A . 27 THR C 1 1 4 1918 1 1 27 THR CA C -3.782 -9.962 4.161 1.00 . A A . 27 THR CA 1 1 4 1919 1 1 27 THR CB C -4.721 -9.484 5.276 1.00 . A A . 27 THR CB 1 1 4 1920 1 1 27 THR CG2 C -5.859 -10.490 5.461 1.00 . A A . 27 THR CG2 1 1 4 1921 1 1 27 THR H H -2.610 -8.282 4.836 1.00 . A A . 27 THR H 1 1 4 1922 1 1 27 THR HA H -3.459 -10.969 4.357 1.00 . A A . 27 THR HA 1 1 4 1923 1 1 27 THR HB H -5.139 -8.524 5.007 1.00 . A A . 27 THR HB 1 1 4 1924 1 1 27 THR HG1 H -3.619 -10.216 6.708 1.00 . A A . 27 THR HG1 1 1 4 1925 1 1 27 THR HG21 H -6.455 -10.205 6.315 1.00 . A A . 27 THR HG21 1 1 4 1926 1 1 27 THR HG22 H -5.446 -11.475 5.620 1.00 . A A . 27 THR HG22 1 1 4 1927 1 1 27 THR HG23 H -6.479 -10.497 4.576 1.00 . A A . 27 THR HG23 1 1 4 1928 1 1 27 THR N N -2.620 -9.021 4.192 1.00 . A A . 27 THR N 1 1 4 1929 1 1 27 THR O O -4.946 -10.878 2.273 1.00 . A A . 27 THR O 1 1 4 1930 1 1 27 THR OG1 O -3.996 -9.358 6.494 1.00 . A A . 27 THR OG1 1 1 4 1931 1 1 28 TRP C C -4.257 -8.741 -0.212 1.00 . A A . 28 TRP C 1 1 4 1932 1 1 28 TRP CA C -5.267 -8.543 0.923 1.00 . A A . 28 TRP CA 1 1 4 1933 1 1 28 TRP CB C -5.818 -7.110 0.918 1.00 . A A . 28 TRP CB 1 1 4 1934 1 1 28 TRP CD1 C -7.276 -7.866 2.858 1.00 . A A . 28 TRP CD1 1 1 4 1935 1 1 28 TRP CD2 C -7.196 -5.627 2.648 1.00 . A A . 28 TRP CD2 1 1 4 1936 1 1 28 TRP CE2 C -8.031 -5.904 3.758 1.00 . A A . 28 TRP CE2 1 1 4 1937 1 1 28 TRP CE3 C -6.982 -4.283 2.301 1.00 . A A . 28 TRP CE3 1 1 4 1938 1 1 28 TRP CG C -6.725 -6.891 2.095 1.00 . A A . 28 TRP CG 1 1 4 1939 1 1 28 TRP CH2 C -8.407 -3.552 4.134 1.00 . A A . 28 TRP CH2 1 1 4 1940 1 1 28 TRP CZ2 C -8.632 -4.883 4.494 1.00 . A A . 28 TRP CZ2 1 1 4 1941 1 1 28 TRP CZ3 C -7.585 -3.251 3.040 1.00 . A A . 28 TRP CZ3 1 1 4 1942 1 1 28 TRP H H -4.212 -7.919 2.699 1.00 . A A . 28 TRP H 1 1 4 1943 1 1 28 TRP HA H -6.078 -9.250 0.831 1.00 . A A . 28 TRP HA 1 1 4 1944 1 1 28 TRP HB2 H -4.996 -6.413 0.968 1.00 . A A . 28 TRP HB2 1 1 4 1945 1 1 28 TRP HB3 H -6.368 -6.946 0.007 1.00 . A A . 28 TRP HB3 1 1 4 1946 1 1 28 TRP HD1 H -7.132 -8.928 2.721 1.00 . A A . 28 TRP HD1 1 1 4 1947 1 1 28 TRP HE1 H -8.548 -7.766 4.532 1.00 . A A . 28 TRP HE1 1 1 4 1948 1 1 28 TRP HE3 H -6.349 -4.040 1.459 1.00 . A A . 28 TRP HE3 1 1 4 1949 1 1 28 TRP HH2 H -8.868 -2.756 4.699 1.00 . A A . 28 TRP HH2 1 1 4 1950 1 1 28 TRP HZ2 H -9.265 -5.119 5.336 1.00 . A A . 28 TRP HZ2 1 1 4 1951 1 1 28 TRP HZ3 H -7.413 -2.222 2.763 1.00 . A A . 28 TRP HZ3 1 1 4 1952 1 1 28 TRP N N -4.587 -8.704 2.245 1.00 . A A . 28 TRP N 1 1 4 1953 1 1 28 TRP NE1 N -8.046 -7.281 3.845 1.00 . A A . 28 TRP NE1 1 1 4 1954 1 1 28 TRP O O -4.485 -9.506 -1.129 1.00 . A A . 28 TRP O 1 1 4 1955 1 1 29 GLY C C -1.874 -6.893 -1.962 1.00 . A A . 29 GLY C 1 1 4 1956 1 1 29 GLY CA C -2.095 -8.214 -1.208 1.00 . A A . 29 GLY CA 1 1 4 1957 1 1 29 GLY H H -2.973 -7.462 0.611 1.00 . A A . 29 GLY H 1 1 4 1958 1 1 29 GLY HA2 H -1.165 -8.521 -0.751 1.00 . A A . 29 GLY HA2 1 1 4 1959 1 1 29 GLY HA3 H -2.410 -8.972 -1.911 1.00 . A A . 29 GLY HA3 1 1 4 1960 1 1 29 GLY N N -3.135 -8.063 -0.147 1.00 . A A . 29 GLY N 1 1 4 1961 1 1 29 GLY O O -1.289 -6.886 -3.028 1.00 . A A . 29 GLY O 1 1 4 1962 1 1 30 TRP C C -2.003 -3.303 -1.163 1.00 . A A . 30 TRP C 1 1 4 1963 1 1 30 TRP CA C -2.107 -4.477 -2.150 1.00 . A A . 30 TRP CA 1 1 4 1964 1 1 30 TRP CB C -3.319 -4.324 -3.089 1.00 . A A . 30 TRP CB 1 1 4 1965 1 1 30 TRP CD1 C -4.801 -2.801 -1.705 1.00 . A A . 30 TRP CD1 1 1 4 1966 1 1 30 TRP CD2 C -5.743 -4.804 -2.099 1.00 . A A . 30 TRP CD2 1 1 4 1967 1 1 30 TRP CE2 C -6.668 -4.062 -1.327 1.00 . A A . 30 TRP CE2 1 1 4 1968 1 1 30 TRP CE3 C -6.098 -6.108 -2.485 1.00 . A A . 30 TRP CE3 1 1 4 1969 1 1 30 TRP CG C -4.561 -3.983 -2.320 1.00 . A A . 30 TRP CG 1 1 4 1970 1 1 30 TRP CH2 C -8.239 -5.891 -1.344 1.00 . A A . 30 TRP CH2 1 1 4 1971 1 1 30 TRP CZ2 C -7.901 -4.594 -0.952 1.00 . A A . 30 TRP CZ2 1 1 4 1972 1 1 30 TRP CZ3 C -7.340 -6.647 -2.110 1.00 . A A . 30 TRP CZ3 1 1 4 1973 1 1 30 TRP H H -2.787 -5.785 -0.564 1.00 . A A . 30 TRP H 1 1 4 1974 1 1 30 TRP HA H -1.208 -4.533 -2.739 1.00 . A A . 30 TRP HA 1 1 4 1975 1 1 30 TRP HB2 H -3.119 -3.538 -3.800 1.00 . A A . 30 TRP HB2 1 1 4 1976 1 1 30 TRP HB3 H -3.472 -5.251 -3.621 1.00 . A A . 30 TRP HB3 1 1 4 1977 1 1 30 TRP HD1 H -4.126 -1.959 -1.677 1.00 . A A . 30 TRP HD1 1 1 4 1978 1 1 30 TRP HE1 H -6.452 -2.123 -0.599 1.00 . A A . 30 TRP HE1 1 1 4 1979 1 1 30 TRP HE3 H -5.411 -6.700 -3.073 1.00 . A A . 30 TRP HE3 1 1 4 1980 1 1 30 TRP HH2 H -9.192 -6.310 -1.060 1.00 . A A . 30 TRP HH2 1 1 4 1981 1 1 30 TRP HZ2 H -8.591 -4.008 -0.361 1.00 . A A . 30 TRP HZ2 1 1 4 1982 1 1 30 TRP HZ3 H -7.602 -7.650 -2.413 1.00 . A A . 30 TRP HZ3 1 1 4 1983 1 1 30 TRP N N -2.322 -5.775 -1.431 1.00 . A A . 30 TRP N 1 1 4 1984 1 1 30 TRP NE1 N -6.045 -2.849 -1.111 1.00 . A A . 30 TRP NE1 1 1 4 1985 1 1 30 TRP O O -2.056 -3.483 0.037 1.00 . A A . 30 TRP O 1 1 4 1986 1 1 31 CYS C C -2.727 0.183 -1.246 1.00 . A A . 31 CYS C 1 1 4 1987 1 1 31 CYS CA C -1.749 -0.905 -0.788 1.00 . A A . 31 CYS CA 1 1 4 1988 1 1 31 CYS CB C -0.306 -0.419 -0.941 1.00 . A A . 31 CYS CB 1 1 4 1989 1 1 31 CYS H H -1.823 -1.992 -2.646 1.00 . A A . 31 CYS H 1 1 4 1990 1 1 31 CYS HA H -1.939 -1.175 0.238 1.00 . A A . 31 CYS HA 1 1 4 1991 1 1 31 CYS HB2 H 0.371 -1.249 -0.821 1.00 . A A . 31 CYS HB2 1 1 4 1992 1 1 31 CYS HB3 H -0.172 0.020 -1.919 1.00 . A A . 31 CYS HB3 1 1 4 1993 1 1 31 CYS N N -1.857 -2.103 -1.674 1.00 . A A . 31 CYS N 1 1 4 1994 1 1 31 CYS O O -2.728 0.587 -2.394 1.00 . A A . 31 CYS O 1 1 4 1995 1 1 31 CYS SG S 0.044 0.824 0.321 1.00 . A A . 31 CYS SG 1 1 4 1996 1 1 32 ALA C C -4.843 2.604 0.510 1.00 . A A . 32 ALA C 1 1 4 1997 1 1 32 ALA CA C -4.542 1.724 -0.711 1.00 . A A . 32 ALA CA 1 1 4 1998 1 1 32 ALA CB C -5.798 0.966 -1.144 1.00 . A A . 32 ALA CB 1 1 4 1999 1 1 32 ALA H H -3.526 0.311 0.569 1.00 . A A . 32 ALA H 1 1 4 2000 1 1 32 ALA HA H -4.171 2.324 -1.527 1.00 . A A . 32 ALA HA 1 1 4 2001 1 1 32 ALA HB1 H -5.598 0.434 -2.064 1.00 . A A . 32 ALA HB1 1 1 4 2002 1 1 32 ALA HB2 H -6.603 1.668 -1.302 1.00 . A A . 32 ALA HB2 1 1 4 2003 1 1 32 ALA HB3 H -6.078 0.262 -0.376 1.00 . A A . 32 ALA HB3 1 1 4 2004 1 1 32 ALA N N -3.555 0.658 -0.349 1.00 . A A . 32 ALA N 1 1 4 2005 1 1 32 ALA O O -4.408 2.317 1.610 1.00 . A A . 32 ALA O 1 1 4 2006 1 1 33 VAL C C -6.603 3.758 2.594 1.00 . A A . 33 VAL C 1 1 4 2007 1 1 33 VAL CA C -5.919 4.568 1.486 1.00 . A A . 33 VAL CA 1 1 4 2008 1 1 33 VAL CB C -6.873 5.636 0.932 1.00 . A A . 33 VAL CB 1 1 4 2009 1 1 33 VAL CG1 C -7.339 6.548 2.071 1.00 . A A . 33 VAL CG1 1 1 4 2010 1 1 33 VAL CG2 C -6.150 6.485 -0.119 1.00 . A A . 33 VAL CG2 1 1 4 2011 1 1 33 VAL H H -5.929 3.881 -0.567 1.00 . A A . 33 VAL H 1 1 4 2012 1 1 33 VAL HA H -5.023 5.036 1.863 1.00 . A A . 33 VAL HA 1 1 4 2013 1 1 33 VAL HB H -7.730 5.156 0.483 1.00 . A A . 33 VAL HB 1 1 4 2014 1 1 33 VAL HG11 H -8.267 6.172 2.477 1.00 . A A . 33 VAL HG11 1 1 4 2015 1 1 33 VAL HG12 H -7.491 7.548 1.693 1.00 . A A . 33 VAL HG12 1 1 4 2016 1 1 33 VAL HG13 H -6.589 6.567 2.847 1.00 . A A . 33 VAL HG13 1 1 4 2017 1 1 33 VAL HG21 H -5.211 6.833 0.284 1.00 . A A . 33 VAL HG21 1 1 4 2018 1 1 33 VAL HG22 H -6.766 7.331 -0.384 1.00 . A A . 33 VAL HG22 1 1 4 2019 1 1 33 VAL HG23 H -5.963 5.886 -0.998 1.00 . A A . 33 VAL HG23 1 1 4 2020 1 1 33 VAL N N -5.588 3.672 0.328 1.00 . A A . 33 VAL N 1 1 4 2021 1 1 33 VAL O O -7.488 2.962 2.338 1.00 . A A . 33 VAL O 1 1 4 2022 1 1 34 GLU C C -8.188 3.742 5.297 1.00 . A A . 34 GLU C 1 1 4 2023 1 1 34 GLU CA C -6.802 3.185 4.953 1.00 . A A . 34 GLU CA 1 1 4 2024 1 1 34 GLU CB C -5.834 3.366 6.127 1.00 . A A . 34 GLU CB 1 1 4 2025 1 1 34 GLU CD C -6.236 1.519 7.764 1.00 . A A . 34 GLU CD 1 1 4 2026 1 1 34 GLU CG C -5.350 1.996 6.613 1.00 . A A . 34 GLU CG 1 1 4 2027 1 1 34 GLU H H -5.470 4.592 3.998 1.00 . A A . 34 GLU H 1 1 4 2028 1 1 34 GLU HA H -6.874 2.144 4.699 1.00 . A A . 34 GLU HA 1 1 4 2029 1 1 34 GLU HB2 H -4.986 3.955 5.808 1.00 . A A . 34 GLU HB2 1 1 4 2030 1 1 34 GLU HB3 H -6.339 3.873 6.935 1.00 . A A . 34 GLU HB3 1 1 4 2031 1 1 34 GLU HG2 H -5.401 1.288 5.798 1.00 . A A . 34 GLU HG2 1 1 4 2032 1 1 34 GLU HG3 H -4.329 2.077 6.955 1.00 . A A . 34 GLU HG3 1 1 4 2033 1 1 34 GLU N N -6.189 3.949 3.821 1.00 . A A . 34 GLU N 1 1 4 2034 1 1 34 GLU O O -9.186 3.055 5.180 1.00 . A A . 34 GLU O 1 1 4 2035 1 1 34 GLU OE1 O -5.930 1.851 8.898 1.00 . A A . 34 GLU OE1 1 1 4 2036 1 1 34 GLU OE2 O -7.208 0.830 7.492 1.00 . A A . 34 GLU OE2 1 1 4 2037 1 1 35 ALA C C -9.940 6.703 5.102 1.00 . A A . 35 ALA C 1 1 4 2038 1 1 35 ALA CA C -9.573 5.582 6.085 1.00 . A A . 35 ALA CA 1 1 4 2039 1 1 35 ALA CB C -9.376 6.149 7.493 1.00 . A A . 35 ALA CB 1 1 4 2040 1 1 35 ALA H H -7.434 5.504 5.811 1.00 . A A . 35 ALA H 1 1 4 2041 1 1 35 ALA HA H -10.342 4.826 6.099 1.00 . A A . 35 ALA HA 1 1 4 2042 1 1 35 ALA HB1 H -9.508 5.361 8.220 1.00 . A A . 35 ALA HB1 1 1 4 2043 1 1 35 ALA HB2 H -10.102 6.928 7.671 1.00 . A A . 35 ALA HB2 1 1 4 2044 1 1 35 ALA HB3 H -8.381 6.558 7.580 1.00 . A A . 35 ALA HB3 1 1 4 2045 1 1 35 ALA N N -8.254 4.976 5.724 1.00 . A A . 35 ALA N 1 1 4 2046 1 1 35 ALA O O -9.071 7.361 4.563 1.00 . A A . 35 ALA O 1 1 4 2047 1 1 36 PRO C C -11.522 9.334 4.590 1.00 . A A . 36 PRO C 1 1 4 2048 1 1 36 PRO CA C -11.720 7.937 3.979 1.00 . A A . 36 PRO CA 1 1 4 2049 1 1 36 PRO CB C -13.204 7.612 3.823 1.00 . A A . 36 PRO CB 1 1 4 2050 1 1 36 PRO CD C -12.331 6.132 5.518 1.00 . A A . 36 PRO CD 1 1 4 2051 1 1 36 PRO CG C -13.570 6.857 5.061 1.00 . A A . 36 PRO CG 1 1 4 2052 1 1 36 PRO HA H -11.224 7.866 3.025 1.00 . A A . 36 PRO HA 1 1 4 2053 1 1 36 PRO HB2 H -13.782 8.524 3.750 1.00 . A A . 36 PRO HB2 1 1 4 2054 1 1 36 PRO HB3 H -13.364 6.994 2.953 1.00 . A A . 36 PRO HB3 1 1 4 2055 1 1 36 PRO HD2 H -12.257 6.156 6.598 1.00 . A A . 36 PRO HD2 1 1 4 2056 1 1 36 PRO HD3 H -12.332 5.115 5.159 1.00 . A A . 36 PRO HD3 1 1 4 2057 1 1 36 PRO HG2 H -13.902 7.545 5.825 1.00 . A A . 36 PRO HG2 1 1 4 2058 1 1 36 PRO HG3 H -14.348 6.143 4.840 1.00 . A A . 36 PRO HG3 1 1 4 2059 1 1 36 PRO N N -11.226 6.884 4.905 1.00 . A A . 36 PRO N 1 1 4 2060 1 1 36 PRO O O -11.875 9.516 5.745 1.00 . A A . 36 PRO O 1 1 5 2061 1 1 1 ASP C C 13.813 3.873 -1.044 1.00 . A A . 1 ASP C 1 1 5 2062 1 1 1 ASP CA C 13.955 2.368 -1.297 1.00 . A A . 1 ASP CA 1 1 5 2063 1 1 1 ASP CB C 13.899 1.595 0.025 1.00 . A A . 1 ASP CB 1 1 5 2064 1 1 1 ASP CG C 12.465 1.597 0.570 1.00 . A A . 1 ASP CG 1 1 5 2065 1 1 1 ASP H1 H 15.376 1.048 -2.068 1.00 . A A . 1 ASP H1 1 1 5 2066 1 1 1 ASP H2 H 16.041 2.356 -1.210 1.00 . A A . 1 ASP H2 1 1 5 2067 1 1 1 ASP H3 H 15.414 2.592 -2.771 1.00 . A A . 1 ASP H3 1 1 5 2068 1 1 1 ASP HA H 13.174 2.024 -1.957 1.00 . A A . 1 ASP HA 1 1 5 2069 1 1 1 ASP HB2 H 14.218 0.575 -0.140 1.00 . A A . 1 ASP HB2 1 1 5 2070 1 1 1 ASP HB3 H 14.557 2.064 0.744 1.00 . A A . 1 ASP HB3 1 1 5 2071 1 1 1 ASP N N 15.298 2.068 -1.880 1.00 . A A . 1 ASP N 1 1 5 2072 1 1 1 ASP O O 14.763 4.545 -0.687 1.00 . A A . 1 ASP O 1 1 5 2073 1 1 1 ASP OD1 O 12.113 2.546 1.255 1.00 . A A . 1 ASP OD1 1 1 5 2074 1 1 1 ASP OD2 O 11.746 0.649 0.297 1.00 . A A . 1 ASP OD2 1 1 5 2075 1 1 2 GLY C C 11.548 6.425 -2.127 1.00 . A A . 2 GLY C 1 1 5 2076 1 1 2 GLY CA C 12.405 5.859 -0.995 1.00 . A A . 2 GLY CA 1 1 5 2077 1 1 2 GLY H H 11.881 3.831 -1.508 1.00 . A A . 2 GLY H 1 1 5 2078 1 1 2 GLY HA2 H 11.895 5.999 -0.052 1.00 . A A . 2 GLY HA2 1 1 5 2079 1 1 2 GLY HA3 H 13.353 6.373 -0.972 1.00 . A A . 2 GLY HA3 1 1 5 2080 1 1 2 GLY N N 12.629 4.400 -1.224 1.00 . A A . 2 GLY N 1 1 5 2081 1 1 2 GLY O O 11.934 7.360 -2.803 1.00 . A A . 2 GLY O 1 1 5 2082 1 1 3 GLU C C 8.018 6.251 -2.992 1.00 . A A . 3 GLU C 1 1 5 2083 1 1 3 GLU CA C 9.488 6.355 -3.422 1.00 . A A . 3 GLU CA 1 1 5 2084 1 1 3 GLU CB C 9.781 5.452 -4.629 1.00 . A A . 3 GLU CB 1 1 5 2085 1 1 3 GLU CD C 9.952 3.035 -5.262 1.00 . A A . 3 GLU CD 1 1 5 2086 1 1 3 GLU CG C 9.207 4.050 -4.391 1.00 . A A . 3 GLU CG 1 1 5 2087 1 1 3 GLU H H 10.102 5.110 -1.776 1.00 . A A . 3 GLU H 1 1 5 2088 1 1 3 GLU HA H 9.726 7.373 -3.663 1.00 . A A . 3 GLU HA 1 1 5 2089 1 1 3 GLU HB2 H 9.331 5.880 -5.511 1.00 . A A . 3 GLU HB2 1 1 5 2090 1 1 3 GLU HB3 H 10.849 5.382 -4.770 1.00 . A A . 3 GLU HB3 1 1 5 2091 1 1 3 GLU HG2 H 9.324 3.784 -3.351 1.00 . A A . 3 GLU HG2 1 1 5 2092 1 1 3 GLU HG3 H 8.159 4.042 -4.651 1.00 . A A . 3 GLU HG3 1 1 5 2093 1 1 3 GLU N N 10.385 5.861 -2.336 1.00 . A A . 3 GLU N 1 1 5 2094 1 1 3 GLU O O 7.717 5.994 -1.842 1.00 . A A . 3 GLU O 1 1 5 2095 1 1 3 GLU OE1 O 9.525 2.820 -6.385 1.00 . A A . 3 GLU OE1 1 1 5 2096 1 1 3 GLU OE2 O 10.935 2.486 -4.790 1.00 . A A . 3 GLU OE2 1 1 5 2097 1 1 4 CYS C C 4.924 5.448 -4.541 1.00 . A A . 4 CYS C 1 1 5 2098 1 1 4 CYS CA C 5.655 6.363 -3.555 1.00 . A A . 4 CYS CA 1 1 5 2099 1 1 4 CYS CB C 5.133 7.806 -3.632 1.00 . A A . 4 CYS CB 1 1 5 2100 1 1 4 CYS H H 7.370 6.662 -4.828 1.00 . A A . 4 CYS H 1 1 5 2101 1 1 4 CYS HA H 5.540 5.991 -2.551 1.00 . A A . 4 CYS HA 1 1 5 2102 1 1 4 CYS HB2 H 4.903 8.151 -2.636 1.00 . A A . 4 CYS HB2 1 1 5 2103 1 1 4 CYS HB3 H 5.894 8.438 -4.062 1.00 . A A . 4 CYS HB3 1 1 5 2104 1 1 4 CYS N N 7.103 6.452 -3.909 1.00 . A A . 4 CYS N 1 1 5 2105 1 1 4 CYS O O 5.329 5.282 -5.677 1.00 . A A . 4 CYS O 1 1 5 2106 1 1 4 CYS SG S 3.634 7.892 -4.650 1.00 . A A . 4 CYS SG 1 1 5 2107 1 1 5 GLY C C 1.961 4.759 -5.687 1.00 . A A . 5 GLY C 1 1 5 2108 1 1 5 GLY CA C 3.061 3.953 -4.990 1.00 . A A . 5 GLY CA 1 1 5 2109 1 1 5 GLY H H 3.545 5.016 -3.189 1.00 . A A . 5 GLY H 1 1 5 2110 1 1 5 GLY HA2 H 3.718 3.515 -5.727 1.00 . A A . 5 GLY HA2 1 1 5 2111 1 1 5 GLY HA3 H 2.611 3.170 -4.397 1.00 . A A . 5 GLY HA3 1 1 5 2112 1 1 5 GLY N N 3.843 4.857 -4.105 1.00 . A A . 5 GLY N 1 1 5 2113 1 1 5 GLY O O 2.221 5.768 -6.313 1.00 . A A . 5 GLY O 1 1 5 2114 1 1 6 GLY C C -1.656 4.905 -5.365 1.00 . A A . 6 GLY C 1 1 5 2115 1 1 6 GLY CA C -0.394 5.060 -6.221 1.00 . A A . 6 GLY CA 1 1 5 2116 1 1 6 GLY H H 0.550 3.506 -5.062 1.00 . A A . 6 GLY H 1 1 5 2117 1 1 6 GLY HA2 H -0.137 6.105 -6.306 1.00 . A A . 6 GLY HA2 1 1 5 2118 1 1 6 GLY HA3 H -0.576 4.653 -7.203 1.00 . A A . 6 GLY HA3 1 1 5 2119 1 1 6 GLY N N 0.733 4.322 -5.574 1.00 . A A . 6 GLY N 1 1 5 2120 1 1 6 GLY O O -1.592 4.904 -4.150 1.00 . A A . 6 GLY O 1 1 5 2121 1 1 7 PHE C C -4.365 3.136 -4.958 1.00 . A A . 7 PHE C 1 1 5 2122 1 1 7 PHE CA C -4.071 4.617 -5.213 1.00 . A A . 7 PHE CA 1 1 5 2123 1 1 7 PHE CB C -5.163 5.236 -6.093 1.00 . A A . 7 PHE CB 1 1 5 2124 1 1 7 PHE CD1 C -4.104 7.433 -6.726 1.00 . A A . 7 PHE CD1 1 1 5 2125 1 1 7 PHE CD2 C -6.008 7.447 -5.224 1.00 . A A . 7 PHE CD2 1 1 5 2126 1 1 7 PHE CE1 C -4.036 8.829 -6.653 1.00 . A A . 7 PHE CE1 1 1 5 2127 1 1 7 PHE CE2 C -5.941 8.845 -5.150 1.00 . A A . 7 PHE CE2 1 1 5 2128 1 1 7 PHE CG C -5.089 6.741 -6.011 1.00 . A A . 7 PHE CG 1 1 5 2129 1 1 7 PHE CZ C -4.954 9.535 -5.865 1.00 . A A . 7 PHE CZ 1 1 5 2130 1 1 7 PHE H H -2.823 4.774 -6.969 1.00 . A A . 7 PHE H 1 1 5 2131 1 1 7 PHE HA H -4.008 5.147 -4.279 1.00 . A A . 7 PHE HA 1 1 5 2132 1 1 7 PHE HB2 H -5.020 4.922 -7.116 1.00 . A A . 7 PHE HB2 1 1 5 2133 1 1 7 PHE HB3 H -6.132 4.905 -5.749 1.00 . A A . 7 PHE HB3 1 1 5 2134 1 1 7 PHE HD1 H -3.395 6.889 -7.332 1.00 . A A . 7 PHE HD1 1 1 5 2135 1 1 7 PHE HD2 H -6.768 6.912 -4.672 1.00 . A A . 7 PHE HD2 1 1 5 2136 1 1 7 PHE HE1 H -3.275 9.362 -7.204 1.00 . A A . 7 PHE HE1 1 1 5 2137 1 1 7 PHE HE2 H -6.649 9.388 -4.543 1.00 . A A . 7 PHE HE2 1 1 5 2138 1 1 7 PHE HZ H -4.901 10.613 -5.809 1.00 . A A . 7 PHE HZ 1 1 5 2139 1 1 7 PHE N N -2.800 4.774 -5.989 1.00 . A A . 7 PHE N 1 1 5 2140 1 1 7 PHE O O -4.929 2.775 -3.945 1.00 . A A . 7 PHE O 1 1 5 2141 1 1 8 TRP C C -3.090 0.010 -6.294 1.00 . A A . 8 TRP C 1 1 5 2142 1 1 8 TRP CA C -4.244 0.821 -5.692 1.00 . A A . 8 TRP CA 1 1 5 2143 1 1 8 TRP CB C -5.554 0.560 -6.442 1.00 . A A . 8 TRP CB 1 1 5 2144 1 1 8 TRP CD1 C -5.729 -1.673 -5.257 1.00 . A A . 8 TRP CD1 1 1 5 2145 1 1 8 TRP CD2 C -7.733 -0.709 -5.595 1.00 . A A . 8 TRP CD2 1 1 5 2146 1 1 8 TRP CE2 C -7.978 -1.933 -4.931 1.00 . A A . 8 TRP CE2 1 1 5 2147 1 1 8 TRP CE3 C -8.836 0.098 -5.927 1.00 . A A . 8 TRP CE3 1 1 5 2148 1 1 8 TRP CG C -6.297 -0.564 -5.789 1.00 . A A . 8 TRP CG 1 1 5 2149 1 1 8 TRP CH2 C -10.356 -1.529 -4.947 1.00 . A A . 8 TRP CH2 1 1 5 2150 1 1 8 TRP CZ2 C -9.272 -2.344 -4.610 1.00 . A A . 8 TRP CZ2 1 1 5 2151 1 1 8 TRP CZ3 C -10.139 -0.311 -5.605 1.00 . A A . 8 TRP CZ3 1 1 5 2152 1 1 8 TRP H H -3.539 2.599 -6.683 1.00 . A A . 8 TRP H 1 1 5 2153 1 1 8 TRP HA H -4.364 0.587 -4.645 1.00 . A A . 8 TRP HA 1 1 5 2154 1 1 8 TRP HB2 H -6.164 1.450 -6.418 1.00 . A A . 8 TRP HB2 1 1 5 2155 1 1 8 TRP HB3 H -5.338 0.302 -7.466 1.00 . A A . 8 TRP HB3 1 1 5 2156 1 1 8 TRP HD1 H -4.671 -1.888 -5.232 1.00 . A A . 8 TRP HD1 1 1 5 2157 1 1 8 TRP HE1 H -6.583 -3.348 -4.308 1.00 . A A . 8 TRP HE1 1 1 5 2158 1 1 8 TRP HE3 H -8.678 1.039 -6.435 1.00 . A A . 8 TRP HE3 1 1 5 2159 1 1 8 TRP HH2 H -11.361 -1.839 -4.701 1.00 . A A . 8 TRP HH2 1 1 5 2160 1 1 8 TRP HZ2 H -9.434 -3.283 -4.102 1.00 . A A . 8 TRP HZ2 1 1 5 2161 1 1 8 TRP HZ3 H -10.979 0.316 -5.865 1.00 . A A . 8 TRP HZ3 1 1 5 2162 1 1 8 TRP N N -3.989 2.280 -5.873 1.00 . A A . 8 TRP N 1 1 5 2163 1 1 8 TRP NE1 N -6.727 -2.485 -4.748 1.00 . A A . 8 TRP NE1 1 1 5 2164 1 1 8 TRP O O -3.234 -0.642 -7.311 1.00 . A A . 8 TRP O 1 1 5 2165 1 1 9 TRP C C -0.584 -2.008 -5.406 1.00 . A A . 9 TRP C 1 1 5 2166 1 1 9 TRP CA C -0.763 -0.706 -6.194 1.00 . A A . 9 TRP CA 1 1 5 2167 1 1 9 TRP CB C 0.436 0.227 -5.986 1.00 . A A . 9 TRP CB 1 1 5 2168 1 1 9 TRP CD1 C -0.695 1.871 -7.556 1.00 . A A . 9 TRP CD1 1 1 5 2169 1 1 9 TRP CD2 C 1.549 2.030 -7.598 1.00 . A A . 9 TRP CD2 1 1 5 2170 1 1 9 TRP CE2 C 1.053 2.996 -8.504 1.00 . A A . 9 TRP CE2 1 1 5 2171 1 1 9 TRP CE3 C 2.942 1.925 -7.440 1.00 . A A . 9 TRP CE3 1 1 5 2172 1 1 9 TRP CG C 0.419 1.326 -7.005 1.00 . A A . 9 TRP CG 1 1 5 2173 1 1 9 TRP CH2 C 3.286 3.714 -9.056 1.00 . A A . 9 TRP CH2 1 1 5 2174 1 1 9 TRP CZ2 C 1.904 3.829 -9.224 1.00 . A A . 9 TRP CZ2 1 1 5 2175 1 1 9 TRP CZ3 C 3.804 2.763 -8.165 1.00 . A A . 9 TRP CZ3 1 1 5 2176 1 1 9 TRP H H -1.850 0.588 -4.848 1.00 . A A . 9 TRP H 1 1 5 2177 1 1 9 TRP HA H -0.888 -0.916 -7.244 1.00 . A A . 9 TRP HA 1 1 5 2178 1 1 9 TRP HB2 H 0.385 0.656 -4.995 1.00 . A A . 9 TRP HB2 1 1 5 2179 1 1 9 TRP HB3 H 1.352 -0.338 -6.083 1.00 . A A . 9 TRP HB3 1 1 5 2180 1 1 9 TRP HD1 H -1.711 1.581 -7.339 1.00 . A A . 9 TRP HD1 1 1 5 2181 1 1 9 TRP HE1 H -0.933 3.407 -8.975 1.00 . A A . 9 TRP HE1 1 1 5 2182 1 1 9 TRP HE3 H 3.351 1.196 -6.756 1.00 . A A . 9 TRP HE3 1 1 5 2183 1 1 9 TRP HH2 H 3.953 4.355 -9.611 1.00 . A A . 9 TRP HH2 1 1 5 2184 1 1 9 TRP HZ2 H 1.498 4.561 -9.903 1.00 . A A . 9 TRP HZ2 1 1 5 2185 1 1 9 TRP HZ3 H 4.871 2.677 -8.034 1.00 . A A . 9 TRP HZ3 1 1 5 2186 1 1 9 TRP N N -1.940 0.053 -5.667 1.00 . A A . 9 TRP N 1 1 5 2187 1 1 9 TRP NE1 N -0.317 2.859 -8.444 1.00 . A A . 9 TRP NE1 1 1 5 2188 1 1 9 TRP O O -1.292 -2.261 -4.452 1.00 . A A . 9 TRP O 1 1 5 2189 1 1 10 LYS C C 1.566 -3.937 -3.928 1.00 . A A . 10 LYS C 1 1 5 2190 1 1 10 LYS CA C 0.558 -4.125 -5.059 1.00 . A A . 10 LYS CA 1 1 5 2191 1 1 10 LYS CB C 1.114 -5.109 -6.086 1.00 . A A . 10 LYS CB 1 1 5 2192 1 1 10 LYS CD C 0.420 -6.669 -7.913 1.00 . A A . 10 LYS CD 1 1 5 2193 1 1 10 LYS CE C 1.043 -8.036 -7.610 1.00 . A A . 10 LYS CE 1 1 5 2194 1 1 10 LYS CG C -0.015 -6.001 -6.606 1.00 . A A . 10 LYS CG 1 1 5 2195 1 1 10 LYS H H 0.911 -2.620 -6.570 1.00 . A A . 10 LYS H 1 1 5 2196 1 1 10 LYS HA H -0.380 -4.488 -4.668 1.00 . A A . 10 LYS HA 1 1 5 2197 1 1 10 LYS HB2 H 1.554 -4.562 -6.906 1.00 . A A . 10 LYS HB2 1 1 5 2198 1 1 10 LYS HB3 H 1.869 -5.725 -5.617 1.00 . A A . 10 LYS HB3 1 1 5 2199 1 1 10 LYS HD2 H -0.440 -6.799 -8.553 1.00 . A A . 10 LYS HD2 1 1 5 2200 1 1 10 LYS HD3 H 1.149 -6.046 -8.409 1.00 . A A . 10 LYS HD3 1 1 5 2201 1 1 10 LYS HE2 H 1.586 -8.003 -6.674 1.00 . A A . 10 LYS HE2 1 1 5 2202 1 1 10 LYS HE3 H 0.281 -8.798 -7.576 1.00 . A A . 10 LYS HE3 1 1 5 2203 1 1 10 LYS HG2 H -0.242 -6.758 -5.868 1.00 . A A . 10 LYS HG2 1 1 5 2204 1 1 10 LYS HG3 H -0.893 -5.400 -6.785 1.00 . A A . 10 LYS HG3 1 1 5 2205 1 1 10 LYS HZ1 H 1.451 -8.264 -9.641 1.00 . A A . 10 LYS HZ1 1 1 5 2206 1 1 10 LYS HZ2 H 2.403 -9.241 -8.628 1.00 . A A . 10 LYS HZ2 1 1 5 2207 1 1 10 LYS HZ3 H 2.724 -7.577 -8.753 1.00 . A A . 10 LYS HZ3 1 1 5 2208 1 1 10 LYS N N 0.350 -2.840 -5.796 1.00 . A A . 10 LYS N 1 1 5 2209 1 1 10 LYS NZ N 1.976 -8.299 -8.744 1.00 . A A . 10 LYS NZ 1 1 5 2210 1 1 10 LYS O O 2.574 -3.274 -4.085 1.00 . A A . 10 LYS O 1 1 5 2211 1 1 11 CYS C C 2.155 -5.625 -0.741 1.00 . A A . 11 CYS C 1 1 5 2212 1 1 11 CYS CA C 2.243 -4.392 -1.649 1.00 . A A . 11 CYS CA 1 1 5 2213 1 1 11 CYS CB C 1.781 -3.138 -0.907 1.00 . A A . 11 CYS CB 1 1 5 2214 1 1 11 CYS H H 0.489 -5.059 -2.694 1.00 . A A . 11 CYS H 1 1 5 2215 1 1 11 CYS HA H 3.248 -4.259 -2.013 1.00 . A A . 11 CYS HA 1 1 5 2216 1 1 11 CYS HB2 H 1.955 -2.275 -1.528 1.00 . A A . 11 CYS HB2 1 1 5 2217 1 1 11 CYS HB3 H 0.725 -3.221 -0.694 1.00 . A A . 11 CYS HB3 1 1 5 2218 1 1 11 CYS N N 1.304 -4.523 -2.791 1.00 . A A . 11 CYS N 1 1 5 2219 1 1 11 CYS O O 1.190 -6.368 -0.780 1.00 . A A . 11 CYS O 1 1 5 2220 1 1 11 CYS SG S 2.692 -2.954 0.643 1.00 . A A . 11 CYS SG 1 1 5 2221 1 1 12 GLY C C 2.676 -6.547 2.395 1.00 . A A . 12 GLY C 1 1 5 2222 1 1 12 GLY CA C 3.124 -7.009 1.006 1.00 . A A . 12 GLY CA 1 1 5 2223 1 1 12 GLY H H 3.907 -5.216 0.100 1.00 . A A . 12 GLY H 1 1 5 2224 1 1 12 GLY HA2 H 2.436 -7.750 0.630 1.00 . A A . 12 GLY HA2 1 1 5 2225 1 1 12 GLY HA3 H 4.114 -7.432 1.072 1.00 . A A . 12 GLY HA3 1 1 5 2226 1 1 12 GLY N N 3.147 -5.836 0.083 1.00 . A A . 12 GLY N 1 1 5 2227 1 1 12 GLY O O 1.573 -6.064 2.570 1.00 . A A . 12 GLY O 1 1 5 2228 1 1 13 ARG C C 3.591 -4.755 4.962 1.00 . A A . 13 ARG C 1 1 5 2229 1 1 13 ARG CA C 3.166 -6.225 4.762 1.00 . A A . 13 ARG CA 1 1 5 2230 1 1 13 ARG CB C 3.950 -7.159 5.698 1.00 . A A . 13 ARG CB 1 1 5 2231 1 1 13 ARG CD C 1.987 -7.190 7.273 1.00 . A A . 13 ARG CD 1 1 5 2232 1 1 13 ARG CG C 3.498 -6.966 7.152 1.00 . A A . 13 ARG CG 1 1 5 2233 1 1 13 ARG CZ C 1.627 -7.865 9.575 1.00 . A A . 13 ARG CZ 1 1 5 2234 1 1 13 ARG H H 4.415 -7.060 3.213 1.00 . A A . 13 ARG H 1 1 5 2235 1 1 13 ARG HA H 2.104 -6.337 4.930 1.00 . A A . 13 ARG HA 1 1 5 2236 1 1 13 ARG HB2 H 3.782 -8.183 5.402 1.00 . A A . 13 ARG HB2 1 1 5 2237 1 1 13 ARG HB3 H 5.004 -6.934 5.621 1.00 . A A . 13 ARG HB3 1 1 5 2238 1 1 13 ARG HD2 H 1.454 -6.514 6.618 1.00 . A A . 13 ARG HD2 1 1 5 2239 1 1 13 ARG HD3 H 1.738 -8.213 7.041 1.00 . A A . 13 ARG HD3 1 1 5 2240 1 1 13 ARG HE H 1.489 -5.973 8.979 1.00 . A A . 13 ARG HE 1 1 5 2241 1 1 13 ARG HG2 H 4.015 -7.675 7.782 1.00 . A A . 13 ARG HG2 1 1 5 2242 1 1 13 ARG HG3 H 3.737 -5.964 7.473 1.00 . A A . 13 ARG HG3 1 1 5 2243 1 1 13 ARG HH11 H 3.586 -7.774 9.993 1.00 . A A . 13 ARG HH11 1 1 5 2244 1 1 13 ARG HH12 H 2.692 -8.976 10.862 1.00 . A A . 13 ARG HH12 1 1 5 2245 1 1 13 ARG HH21 H -0.340 -8.180 9.360 1.00 . A A . 13 ARG HH21 1 1 5 2246 1 1 13 ARG HH22 H 0.460 -9.206 10.502 1.00 . A A . 13 ARG HH22 1 1 5 2247 1 1 13 ARG N N 3.529 -6.677 3.382 1.00 . A A . 13 ARG N 1 1 5 2248 1 1 13 ARG NE N 1.668 -6.895 8.698 1.00 . A A . 13 ARG NE 1 1 5 2249 1 1 13 ARG NH1 N 2.721 -8.233 10.190 1.00 . A A . 13 ARG NH1 1 1 5 2250 1 1 13 ARG NH2 N 0.494 -8.463 9.833 1.00 . A A . 13 ARG NH2 1 1 5 2251 1 1 13 ARG O O 3.765 -4.295 6.075 1.00 . A A . 13 ARG O 1 1 5 2252 1 1 14 GLY C C 5.654 -2.459 3.598 1.00 . A A . 14 GLY C 1 1 5 2253 1 1 14 GLY CA C 4.179 -2.593 3.998 1.00 . A A . 14 GLY CA 1 1 5 2254 1 1 14 GLY H H 3.617 -4.410 3.001 1.00 . A A . 14 GLY H 1 1 5 2255 1 1 14 GLY HA2 H 3.571 -1.987 3.340 1.00 . A A . 14 GLY HA2 1 1 5 2256 1 1 14 GLY HA3 H 4.053 -2.256 5.016 1.00 . A A . 14 GLY HA3 1 1 5 2257 1 1 14 GLY N N 3.761 -4.021 3.886 1.00 . A A . 14 GLY N 1 1 5 2258 1 1 14 GLY O O 6.378 -1.646 4.140 1.00 . A A . 14 GLY O 1 1 5 2259 1 1 15 LYS C C 7.759 -1.955 1.301 1.00 . A A . 15 LYS C 1 1 5 2260 1 1 15 LYS CA C 7.533 -3.172 2.218 1.00 . A A . 15 LYS CA 1 1 5 2261 1 1 15 LYS CB C 7.808 -4.484 1.472 1.00 . A A . 15 LYS CB 1 1 5 2262 1 1 15 LYS CD C 8.882 -6.062 3.095 1.00 . A A . 15 LYS CD 1 1 5 2263 1 1 15 LYS CE C 9.766 -7.300 2.911 1.00 . A A . 15 LYS CE 1 1 5 2264 1 1 15 LYS CG C 9.136 -5.076 1.950 1.00 . A A . 15 LYS CG 1 1 5 2265 1 1 15 LYS H H 5.501 -3.902 2.231 1.00 . A A . 15 LYS H 1 1 5 2266 1 1 15 LYS HA H 8.172 -3.106 3.077 1.00 . A A . 15 LYS HA 1 1 5 2267 1 1 15 LYS HB2 H 7.010 -5.186 1.669 1.00 . A A . 15 LYS HB2 1 1 5 2268 1 1 15 LYS HB3 H 7.865 -4.292 0.412 1.00 . A A . 15 LYS HB3 1 1 5 2269 1 1 15 LYS HD2 H 9.117 -5.587 4.038 1.00 . A A . 15 LYS HD2 1 1 5 2270 1 1 15 LYS HD3 H 7.845 -6.359 3.090 1.00 . A A . 15 LYS HD3 1 1 5 2271 1 1 15 LYS HE2 H 9.293 -8.167 3.352 1.00 . A A . 15 LYS HE2 1 1 5 2272 1 1 15 LYS HE3 H 9.961 -7.471 1.864 1.00 . A A . 15 LYS HE3 1 1 5 2273 1 1 15 LYS HG2 H 9.616 -5.590 1.130 1.00 . A A . 15 LYS HG2 1 1 5 2274 1 1 15 LYS HG3 H 9.779 -4.281 2.300 1.00 . A A . 15 LYS HG3 1 1 5 2275 1 1 15 LYS HZ1 H 11.442 -6.103 3.244 1.00 . A A . 15 LYS HZ1 1 1 5 2276 1 1 15 LYS HZ2 H 11.716 -7.764 3.480 1.00 . A A . 15 LYS HZ2 1 1 5 2277 1 1 15 LYS HZ3 H 10.852 -6.869 4.639 1.00 . A A . 15 LYS HZ3 1 1 5 2278 1 1 15 LYS N N 6.104 -3.252 2.653 1.00 . A A . 15 LYS N 1 1 5 2279 1 1 15 LYS NZ N 11.039 -6.985 3.622 1.00 . A A . 15 LYS NZ 1 1 5 2280 1 1 15 LYS O O 8.614 -1.135 1.578 1.00 . A A . 15 LYS O 1 1 5 2281 1 1 16 PRO C C 6.515 0.540 -0.090 1.00 . A A . 16 PRO C 1 1 5 2282 1 1 16 PRO CA C 7.109 -0.733 -0.708 1.00 . A A . 16 PRO CA 1 1 5 2283 1 1 16 PRO CB C 6.294 -1.183 -1.919 1.00 . A A . 16 PRO CB 1 1 5 2284 1 1 16 PRO CD C 5.932 -2.809 -0.167 1.00 . A A . 16 PRO CD 1 1 5 2285 1 1 16 PRO CG C 5.307 -2.168 -1.379 1.00 . A A . 16 PRO CG 1 1 5 2286 1 1 16 PRO HA H 8.138 -0.584 -0.988 1.00 . A A . 16 PRO HA 1 1 5 2287 1 1 16 PRO HB2 H 5.783 -0.337 -2.359 1.00 . A A . 16 PRO HB2 1 1 5 2288 1 1 16 PRO HB3 H 6.932 -1.659 -2.646 1.00 . A A . 16 PRO HB3 1 1 5 2289 1 1 16 PRO HD2 H 5.200 -2.923 0.619 1.00 . A A . 16 PRO HD2 1 1 5 2290 1 1 16 PRO HD3 H 6.367 -3.763 -0.422 1.00 . A A . 16 PRO HD3 1 1 5 2291 1 1 16 PRO HG2 H 4.395 -1.657 -1.101 1.00 . A A . 16 PRO HG2 1 1 5 2292 1 1 16 PRO HG3 H 5.095 -2.922 -2.121 1.00 . A A . 16 PRO HG3 1 1 5 2293 1 1 16 PRO N N 6.982 -1.870 0.242 1.00 . A A . 16 PRO N 1 1 5 2294 1 1 16 PRO O O 5.420 0.513 0.443 1.00 . A A . 16 PRO O 1 1 5 2295 1 1 17 PRO C C 5.647 3.491 -0.459 1.00 . A A . 17 PRO C 1 1 5 2296 1 1 17 PRO CA C 6.792 2.912 0.386 1.00 . A A . 17 PRO CA 1 1 5 2297 1 1 17 PRO CB C 8.033 3.802 0.315 1.00 . A A . 17 PRO CB 1 1 5 2298 1 1 17 PRO CD C 8.584 1.742 -0.802 1.00 . A A . 17 PRO CD 1 1 5 2299 1 1 17 PRO CG C 8.857 3.223 -0.787 1.00 . A A . 17 PRO CG 1 1 5 2300 1 1 17 PRO HA H 6.485 2.789 1.413 1.00 . A A . 17 PRO HA 1 1 5 2301 1 1 17 PRO HB2 H 7.751 4.821 0.085 1.00 . A A . 17 PRO HB2 1 1 5 2302 1 1 17 PRO HB3 H 8.580 3.762 1.244 1.00 . A A . 17 PRO HB3 1 1 5 2303 1 1 17 PRO HD2 H 8.564 1.371 -1.817 1.00 . A A . 17 PRO HD2 1 1 5 2304 1 1 17 PRO HD3 H 9.320 1.214 -0.215 1.00 . A A . 17 PRO HD3 1 1 5 2305 1 1 17 PRO HG2 H 8.569 3.666 -1.732 1.00 . A A . 17 PRO HG2 1 1 5 2306 1 1 17 PRO HG3 H 9.905 3.400 -0.600 1.00 . A A . 17 PRO HG3 1 1 5 2307 1 1 17 PRO N N 7.258 1.620 -0.178 1.00 . A A . 17 PRO N 1 1 5 2308 1 1 17 PRO O O 5.863 4.018 -1.534 1.00 . A A . 17 PRO O 1 1 5 2309 1 1 18 CYS C C 3.269 5.486 -0.623 1.00 . A A . 18 CYS C 1 1 5 2310 1 1 18 CYS CA C 3.270 3.957 -0.739 1.00 . A A . 18 CYS CA 1 1 5 2311 1 1 18 CYS CB C 2.021 3.355 -0.079 1.00 . A A . 18 CYS CB 1 1 5 2312 1 1 18 CYS H H 4.284 2.975 0.893 1.00 . A A . 18 CYS H 1 1 5 2313 1 1 18 CYS HA H 3.323 3.655 -1.773 1.00 . A A . 18 CYS HA 1 1 5 2314 1 1 18 CYS HB2 H 2.031 3.570 0.978 1.00 . A A . 18 CYS HB2 1 1 5 2315 1 1 18 CYS HB3 H 1.135 3.785 -0.524 1.00 . A A . 18 CYS HB3 1 1 5 2316 1 1 18 CYS N N 4.432 3.401 0.026 1.00 . A A . 18 CYS N 1 1 5 2317 1 1 18 CYS O O 3.978 6.052 0.188 1.00 . A A . 18 CYS O 1 1 5 2318 1 1 18 CYS SG S 2.004 1.562 -0.329 1.00 . A A . 18 CYS SG 1 1 5 2319 1 1 19 CYS C C 1.899 8.114 -0.007 1.00 . A A . 19 CYS C 1 1 5 2320 1 1 19 CYS CA C 2.447 7.655 -1.364 1.00 . A A . 19 CYS CA 1 1 5 2321 1 1 19 CYS CB C 1.513 8.091 -2.497 1.00 . A A . 19 CYS CB 1 1 5 2322 1 1 19 CYS H H 1.926 5.685 -2.079 1.00 . A A . 19 CYS H 1 1 5 2323 1 1 19 CYS HA H 3.433 8.063 -1.525 1.00 . A A . 19 CYS HA 1 1 5 2324 1 1 19 CYS HB2 H 1.149 7.221 -3.023 1.00 . A A . 19 CYS HB2 1 1 5 2325 1 1 19 CYS HB3 H 0.680 8.637 -2.085 1.00 . A A . 19 CYS HB3 1 1 5 2326 1 1 19 CYS N N 2.485 6.161 -1.430 1.00 . A A . 19 CYS N 1 1 5 2327 1 1 19 CYS O O 1.324 7.339 0.737 1.00 . A A . 19 CYS O 1 1 5 2328 1 1 19 CYS SG S 2.419 9.156 -3.649 1.00 . A A . 19 CYS SG 1 1 5 2329 1 1 20 LYS C C 0.046 9.825 1.667 1.00 . A A . 20 LYS C 1 1 5 2330 1 1 20 LYS CA C 1.578 9.884 1.628 1.00 . A A . 20 LYS CA 1 1 5 2331 1 1 20 LYS CB C 2.071 11.335 1.709 1.00 . A A . 20 LYS CB 1 1 5 2332 1 1 20 LYS CD C 4.158 10.658 2.927 1.00 . A A . 20 LYS CD 1 1 5 2333 1 1 20 LYS CE C 5.402 11.550 2.869 1.00 . A A . 20 LYS CE 1 1 5 2334 1 1 20 LYS CG C 2.899 11.530 2.985 1.00 . A A . 20 LYS CG 1 1 5 2335 1 1 20 LYS H H 2.550 9.969 -0.284 1.00 . A A . 20 LYS H 1 1 5 2336 1 1 20 LYS HA H 1.999 9.309 2.430 1.00 . A A . 20 LYS HA 1 1 5 2337 1 1 20 LYS HB2 H 2.685 11.556 0.847 1.00 . A A . 20 LYS HB2 1 1 5 2338 1 1 20 LYS HB3 H 1.225 12.004 1.728 1.00 . A A . 20 LYS HB3 1 1 5 2339 1 1 20 LYS HD2 H 4.203 10.035 3.808 1.00 . A A . 20 LYS HD2 1 1 5 2340 1 1 20 LYS HD3 H 4.125 10.034 2.047 1.00 . A A . 20 LYS HD3 1 1 5 2341 1 1 20 LYS HE2 H 5.329 12.239 2.038 1.00 . A A . 20 LYS HE2 1 1 5 2342 1 1 20 LYS HE3 H 5.521 12.088 3.797 1.00 . A A . 20 LYS HE3 1 1 5 2343 1 1 20 LYS HG2 H 3.185 12.569 3.070 1.00 . A A . 20 LYS HG2 1 1 5 2344 1 1 20 LYS HG3 H 2.309 11.248 3.842 1.00 . A A . 20 LYS HG3 1 1 5 2345 1 1 20 LYS HZ1 H 6.437 10.118 1.764 1.00 . A A . 20 LYS HZ1 1 1 5 2346 1 1 20 LYS HZ2 H 6.559 9.916 3.448 1.00 . A A . 20 LYS HZ2 1 1 5 2347 1 1 20 LYS HZ3 H 7.436 11.147 2.670 1.00 . A A . 20 LYS HZ3 1 1 5 2348 1 1 20 LYS N N 2.079 9.370 0.324 1.00 . A A . 20 LYS N 1 1 5 2349 1 1 20 LYS NZ N 6.544 10.612 2.674 1.00 . A A . 20 LYS NZ 1 1 5 2350 1 1 20 LYS O O -0.626 10.338 0.792 1.00 . A A . 20 LYS O 1 1 5 2351 1 1 21 GLY C C -2.475 7.712 2.303 1.00 . A A . 21 GLY C 1 1 5 2352 1 1 21 GLY CA C -1.993 9.095 2.780 1.00 . A A . 21 GLY CA 1 1 5 2353 1 1 21 GLY H H 0.060 8.789 3.364 1.00 . A A . 21 GLY H 1 1 5 2354 1 1 21 GLY HA2 H -2.287 9.240 3.810 1.00 . A A . 21 GLY HA2 1 1 5 2355 1 1 21 GLY HA3 H -2.448 9.859 2.169 1.00 . A A . 21 GLY HA3 1 1 5 2356 1 1 21 GLY N N -0.507 9.197 2.675 1.00 . A A . 21 GLY N 1 1 5 2357 1 1 21 GLY O O -3.664 7.462 2.230 1.00 . A A . 21 GLY O 1 1 5 2358 1 1 22 TYR C C -1.457 4.396 2.495 1.00 . A A . 22 TYR C 1 1 5 2359 1 1 22 TYR CA C -1.987 5.451 1.520 1.00 . A A . 22 TYR CA 1 1 5 2360 1 1 22 TYR CB C -1.346 5.273 0.139 1.00 . A A . 22 TYR CB 1 1 5 2361 1 1 22 TYR CD1 C -1.375 7.596 -0.841 1.00 . A A . 22 TYR CD1 1 1 5 2362 1 1 22 TYR CD2 C -2.945 5.958 -1.693 1.00 . A A . 22 TYR CD2 1 1 5 2363 1 1 22 TYR CE1 C -1.885 8.548 -1.728 1.00 . A A . 22 TYR CE1 1 1 5 2364 1 1 22 TYR CE2 C -3.455 6.912 -2.581 1.00 . A A . 22 TYR CE2 1 1 5 2365 1 1 22 TYR CG C -1.904 6.301 -0.821 1.00 . A A . 22 TYR CG 1 1 5 2366 1 1 22 TYR CZ C -2.925 8.206 -2.597 1.00 . A A . 22 TYR CZ 1 1 5 2367 1 1 22 TYR H H -0.621 7.030 2.051 1.00 . A A . 22 TYR H 1 1 5 2368 1 1 22 TYR HA H -3.061 5.388 1.441 1.00 . A A . 22 TYR HA 1 1 5 2369 1 1 22 TYR HB2 H -0.276 5.400 0.221 1.00 . A A . 22 TYR HB2 1 1 5 2370 1 1 22 TYR HB3 H -1.561 4.282 -0.232 1.00 . A A . 22 TYR HB3 1 1 5 2371 1 1 22 TYR HD1 H -0.572 7.862 -0.171 1.00 . A A . 22 TYR HD1 1 1 5 2372 1 1 22 TYR HD2 H -3.354 4.959 -1.682 1.00 . A A . 22 TYR HD2 1 1 5 2373 1 1 22 TYR HE1 H -1.477 9.549 -1.742 1.00 . A A . 22 TYR HE1 1 1 5 2374 1 1 22 TYR HE2 H -4.258 6.651 -3.251 1.00 . A A . 22 TYR HE2 1 1 5 2375 1 1 22 TYR HH H -4.033 9.709 -2.984 1.00 . A A . 22 TYR HH 1 1 5 2376 1 1 22 TYR N N -1.572 6.813 1.983 1.00 . A A . 22 TYR N 1 1 5 2377 1 1 22 TYR O O -0.434 4.586 3.126 1.00 . A A . 22 TYR O 1 1 5 2378 1 1 22 TYR OH O -3.426 9.147 -3.471 1.00 . A A . 22 TYR OH 1 1 5 2379 1 1 23 ALA C C -1.595 0.876 2.856 1.00 . A A . 23 ALA C 1 1 5 2380 1 1 23 ALA CA C -1.673 2.229 3.568 1.00 . A A . 23 ALA CA 1 1 5 2381 1 1 23 ALA CB C -2.719 2.196 4.685 1.00 . A A . 23 ALA CB 1 1 5 2382 1 1 23 ALA H H -2.966 3.157 2.110 1.00 . A A . 23 ALA H 1 1 5 2383 1 1 23 ALA HA H -0.710 2.493 3.974 1.00 . A A . 23 ALA HA 1 1 5 2384 1 1 23 ALA HB1 H -3.707 2.296 4.257 1.00 . A A . 23 ALA HB1 1 1 5 2385 1 1 23 ALA HB2 H -2.541 3.014 5.369 1.00 . A A . 23 ALA HB2 1 1 5 2386 1 1 23 ALA HB3 H -2.649 1.260 5.217 1.00 . A A . 23 ALA HB3 1 1 5 2387 1 1 23 ALA N N -2.142 3.291 2.628 1.00 . A A . 23 ALA N 1 1 5 2388 1 1 23 ALA O O -2.371 0.587 1.964 1.00 . A A . 23 ALA O 1 1 5 2389 1 1 24 CYS C C -1.376 -2.331 3.307 1.00 . A A . 24 CYS C 1 1 5 2390 1 1 24 CYS CA C -0.510 -1.288 2.594 1.00 . A A . 24 CYS CA 1 1 5 2391 1 1 24 CYS CB C 0.973 -1.632 2.746 1.00 . A A . 24 CYS CB 1 1 5 2392 1 1 24 CYS H H -0.046 0.312 3.964 1.00 . A A . 24 CYS H 1 1 5 2393 1 1 24 CYS HA H -0.770 -1.231 1.549 1.00 . A A . 24 CYS HA 1 1 5 2394 1 1 24 CYS HB2 H 1.567 -0.901 2.217 1.00 . A A . 24 CYS HB2 1 1 5 2395 1 1 24 CYS HB3 H 1.238 -1.620 3.792 1.00 . A A . 24 CYS HB3 1 1 5 2396 1 1 24 CYS N N -0.658 0.049 3.244 1.00 . A A . 24 CYS N 1 1 5 2397 1 1 24 CYS O O -1.808 -2.137 4.428 1.00 . A A . 24 CYS O 1 1 5 2398 1 1 24 CYS SG S 1.295 -3.274 2.064 1.00 . A A . 24 CYS SG 1 1 5 2399 1 1 25 SER C C -1.896 -5.888 2.973 1.00 . A A . 25 SER C 1 1 5 2400 1 1 25 SER CA C -2.471 -4.501 3.277 1.00 . A A . 25 SER CA 1 1 5 2401 1 1 25 SER CB C -3.849 -4.341 2.639 1.00 . A A . 25 SER CB 1 1 5 2402 1 1 25 SER H H -1.273 -3.564 1.752 1.00 . A A . 25 SER H 1 1 5 2403 1 1 25 SER HA H -2.542 -4.350 4.340 1.00 . A A . 25 SER HA 1 1 5 2404 1 1 25 SER HB2 H -4.118 -3.297 2.610 1.00 . A A . 25 SER HB2 1 1 5 2405 1 1 25 SER HB3 H -3.825 -4.731 1.630 1.00 . A A . 25 SER HB3 1 1 5 2406 1 1 25 SER HG H -5.341 -4.407 3.885 1.00 . A A . 25 SER HG 1 1 5 2407 1 1 25 SER N N -1.632 -3.436 2.654 1.00 . A A . 25 SER N 1 1 5 2408 1 1 25 SER O O -1.887 -6.327 1.840 1.00 . A A . 25 SER O 1 1 5 2409 1 1 25 SER OG O -4.806 -5.050 3.414 1.00 . A A . 25 SER OG 1 1 5 2410 1 1 26 LYS C C -1.986 -8.953 3.492 1.00 . A A . 26 LYS C 1 1 5 2411 1 1 26 LYS CA C -0.856 -7.947 3.753 1.00 . A A . 26 LYS CA 1 1 5 2412 1 1 26 LYS CB C -0.111 -8.293 5.046 1.00 . A A . 26 LYS CB 1 1 5 2413 1 1 26 LYS CD C 1.652 -9.704 3.963 1.00 . A A . 26 LYS CD 1 1 5 2414 1 1 26 LYS CE C 2.189 -11.132 3.806 1.00 . A A . 26 LYS CE 1 1 5 2415 1 1 26 LYS CG C 0.482 -9.704 4.949 1.00 . A A . 26 LYS CG 1 1 5 2416 1 1 26 LYS H H -1.442 -6.206 4.887 1.00 . A A . 26 LYS H 1 1 5 2417 1 1 26 LYS HA H -0.169 -7.934 2.926 1.00 . A A . 26 LYS HA 1 1 5 2418 1 1 26 LYS HB2 H 0.686 -7.581 5.202 1.00 . A A . 26 LYS HB2 1 1 5 2419 1 1 26 LYS HB3 H -0.796 -8.251 5.880 1.00 . A A . 26 LYS HB3 1 1 5 2420 1 1 26 LYS HD2 H 1.314 -9.339 3.004 1.00 . A A . 26 LYS HD2 1 1 5 2421 1 1 26 LYS HD3 H 2.438 -9.065 4.335 1.00 . A A . 26 LYS HD3 1 1 5 2422 1 1 26 LYS HE2 H 1.412 -11.851 4.029 1.00 . A A . 26 LYS HE2 1 1 5 2423 1 1 26 LYS HE3 H 2.566 -11.283 2.807 1.00 . A A . 26 LYS HE3 1 1 5 2424 1 1 26 LYS HG2 H 0.829 -10.016 5.923 1.00 . A A . 26 LYS HG2 1 1 5 2425 1 1 26 LYS HG3 H -0.279 -10.388 4.604 1.00 . A A . 26 LYS HG3 1 1 5 2426 1 1 26 LYS HZ1 H 4.044 -10.553 4.560 1.00 . A A . 26 LYS HZ1 1 1 5 2427 1 1 26 LYS HZ2 H 3.699 -12.204 4.757 1.00 . A A . 26 LYS HZ2 1 1 5 2428 1 1 26 LYS HZ3 H 2.942 -11.051 5.749 1.00 . A A . 26 LYS HZ3 1 1 5 2429 1 1 26 LYS N N -1.422 -6.582 3.981 1.00 . A A . 26 LYS N 1 1 5 2430 1 1 26 LYS NZ N 3.303 -11.242 4.792 1.00 . A A . 26 LYS NZ 1 1 5 2431 1 1 26 LYS O O -1.869 -9.823 2.650 1.00 . A A . 26 LYS O 1 1 5 2432 1 1 27 THR C C -4.825 -9.595 2.608 1.00 . A A . 27 THR C 1 1 5 2433 1 1 27 THR CA C -4.223 -9.782 4.005 1.00 . A A . 27 THR CA 1 1 5 2434 1 1 27 THR CB C -5.260 -9.414 5.076 1.00 . A A . 27 THR CB 1 1 5 2435 1 1 27 THR CG2 C -6.296 -10.534 5.189 1.00 . A A . 27 THR CG2 1 1 5 2436 1 1 27 THR H H -3.142 -8.124 4.878 1.00 . A A . 27 THR H 1 1 5 2437 1 1 27 THR HA H -3.899 -10.799 4.141 1.00 . A A . 27 THR HA 1 1 5 2438 1 1 27 THR HB H -5.759 -8.497 4.791 1.00 . A A . 27 THR HB 1 1 5 2439 1 1 27 THR HG1 H -4.046 -9.993 6.490 1.00 . A A . 27 THR HG1 1 1 5 2440 1 1 27 THR HG21 H -7.281 -10.104 5.309 1.00 . A A . 27 THR HG21 1 1 5 2441 1 1 27 THR HG22 H -6.066 -11.152 6.043 1.00 . A A . 27 THR HG22 1 1 5 2442 1 1 27 THR HG23 H -6.275 -11.138 4.293 1.00 . A A . 27 THR HG23 1 1 5 2443 1 1 27 THR N N -3.078 -8.836 4.209 1.00 . A A . 27 THR N 1 1 5 2444 1 1 27 THR O O -5.238 -10.542 1.967 1.00 . A A . 27 THR O 1 1 5 2445 1 1 27 THR OG1 O -4.615 -9.234 6.333 1.00 . A A . 27 THR OG1 1 1 5 2446 1 1 28 TRP C C -4.392 -8.332 -0.292 1.00 . A A . 28 TRP C 1 1 5 2447 1 1 28 TRP CA C -5.456 -8.107 0.787 1.00 . A A . 28 TRP CA 1 1 5 2448 1 1 28 TRP CB C -5.897 -6.639 0.823 1.00 . A A . 28 TRP CB 1 1 5 2449 1 1 28 TRP CD1 C -7.562 -7.443 2.563 1.00 . A A . 28 TRP CD1 1 1 5 2450 1 1 28 TRP CD2 C -7.587 -5.209 2.306 1.00 . A A . 28 TRP CD2 1 1 5 2451 1 1 28 TRP CE2 C -8.549 -5.517 3.297 1.00 . A A . 28 TRP CE2 1 1 5 2452 1 1 28 TRP CE3 C -7.406 -3.860 1.957 1.00 . A A . 28 TRP CE3 1 1 5 2453 1 1 28 TRP CG C -6.971 -6.450 1.856 1.00 . A A . 28 TRP CG 1 1 5 2454 1 1 28 TRP CH2 C -9.110 -3.187 3.559 1.00 . A A . 28 TRP CH2 1 1 5 2455 1 1 28 TRP CZ2 C -9.303 -4.522 3.919 1.00 . A A . 28 TRP CZ2 1 1 5 2456 1 1 28 TRP CZ3 C -8.163 -2.855 2.580 1.00 . A A . 28 TRP CZ3 1 1 5 2457 1 1 28 TRP H H -4.543 -7.632 2.682 1.00 . A A . 28 TRP H 1 1 5 2458 1 1 28 TRP HA H -6.309 -8.743 0.610 1.00 . A A . 28 TRP HA 1 1 5 2459 1 1 28 TRP HB2 H -5.052 -6.016 1.067 1.00 . A A . 28 TRP HB2 1 1 5 2460 1 1 28 TRP HB3 H -6.280 -6.357 -0.145 1.00 . A A . 28 TRP HB3 1 1 5 2461 1 1 28 TRP HD1 H -7.337 -8.496 2.475 1.00 . A A . 28 TRP HD1 1 1 5 2462 1 1 28 TRP HE1 H -9.053 -7.394 4.046 1.00 . A A . 28 TRP HE1 1 1 5 2463 1 1 28 TRP HE3 H -6.677 -3.593 1.205 1.00 . A A . 28 TRP HE3 1 1 5 2464 1 1 28 TRP HH2 H -9.690 -2.411 4.034 1.00 . A A . 28 TRP HH2 1 1 5 2465 1 1 28 TRP HZ2 H -10.032 -4.782 4.671 1.00 . A A . 28 TRP HZ2 1 1 5 2466 1 1 28 TRP HZ3 H -8.014 -1.821 2.303 1.00 . A A . 28 TRP HZ3 1 1 5 2467 1 1 28 TRP N N -4.878 -8.375 2.140 1.00 . A A . 28 TRP N 1 1 5 2468 1 1 28 TRP NE1 N -8.491 -6.891 3.421 1.00 . A A . 28 TRP NE1 1 1 5 2469 1 1 28 TRP O O -4.637 -8.989 -1.285 1.00 . A A . 28 TRP O 1 1 5 2470 1 1 29 GLY C C -1.889 -6.721 -1.919 1.00 . A A . 29 GLY C 1 1 5 2471 1 1 29 GLY CA C -2.119 -7.995 -1.096 1.00 . A A . 29 GLY CA 1 1 5 2472 1 1 29 GLY H H -3.038 -7.286 0.721 1.00 . A A . 29 GLY H 1 1 5 2473 1 1 29 GLY HA2 H -1.207 -8.253 -0.579 1.00 . A A . 29 GLY HA2 1 1 5 2474 1 1 29 GLY HA3 H -2.388 -8.801 -1.764 1.00 . A A . 29 GLY HA3 1 1 5 2475 1 1 29 GLY N N -3.211 -7.801 -0.095 1.00 . A A . 29 GLY N 1 1 5 2476 1 1 29 GLY O O -1.311 -6.774 -2.988 1.00 . A A . 29 GLY O 1 1 5 2477 1 1 30 TRP C C -1.969 -3.104 -1.283 1.00 . A A . 30 TRP C 1 1 5 2478 1 1 30 TRP CA C -2.089 -4.318 -2.219 1.00 . A A . 30 TRP CA 1 1 5 2479 1 1 30 TRP CB C -3.291 -4.200 -3.174 1.00 . A A . 30 TRP CB 1 1 5 2480 1 1 30 TRP CD1 C -4.824 -2.727 -1.801 1.00 . A A . 30 TRP CD1 1 1 5 2481 1 1 30 TRP CD2 C -5.725 -4.740 -2.242 1.00 . A A . 30 TRP CD2 1 1 5 2482 1 1 30 TRP CE2 C -6.678 -4.024 -1.480 1.00 . A A . 30 TRP CE2 1 1 5 2483 1 1 30 TRP CE3 C -6.050 -6.046 -2.653 1.00 . A A . 30 TRP CE3 1 1 5 2484 1 1 30 TRP CG C -4.552 -3.894 -2.427 1.00 . A A . 30 TRP CG 1 1 5 2485 1 1 30 TRP CH2 C -8.220 -5.879 -1.557 1.00 . A A . 30 TRP CH2 1 1 5 2486 1 1 30 TRP CZ2 C -7.910 -4.582 -1.138 1.00 . A A . 30 TRP CZ2 1 1 5 2487 1 1 30 TRP CZ3 C -7.290 -6.611 -2.312 1.00 . A A . 30 TRP CZ3 1 1 5 2488 1 1 30 TRP H H -2.771 -5.538 -0.570 1.00 . A A . 30 TRP H 1 1 5 2489 1 1 30 TRP HA H -1.184 -4.414 -2.799 1.00 . A A . 30 TRP HA 1 1 5 2490 1 1 30 TRP HB2 H -3.103 -3.408 -3.882 1.00 . A A . 30 TRP HB2 1 1 5 2491 1 1 30 TRP HB3 H -3.410 -5.130 -3.710 1.00 . A A . 30 TRP HB3 1 1 5 2492 1 1 30 TRP HD1 H -4.162 -1.876 -1.747 1.00 . A A . 30 TRP HD1 1 1 5 2493 1 1 30 TRP HE1 H -6.507 -2.092 -0.723 1.00 . A A . 30 TRP HE1 1 1 5 2494 1 1 30 TRP HE3 H -5.342 -6.618 -3.234 1.00 . A A . 30 TRP HE3 1 1 5 2495 1 1 30 TRP HH2 H -9.171 -6.318 -1.298 1.00 . A A . 30 TRP HH2 1 1 5 2496 1 1 30 TRP HZ2 H -8.623 -4.016 -0.557 1.00 . A A . 30 TRP HZ2 1 1 5 2497 1 1 30 TRP HZ3 H -7.532 -7.612 -2.634 1.00 . A A . 30 TRP HZ3 1 1 5 2498 1 1 30 TRP N N -2.316 -5.575 -1.440 1.00 . A A . 30 TRP N 1 1 5 2499 1 1 30 TRP NE1 N -6.078 -2.806 -1.235 1.00 . A A . 30 TRP NE1 1 1 5 2500 1 1 30 TRP O O -1.968 -3.239 -0.075 1.00 . A A . 30 TRP O 1 1 5 2501 1 1 31 CYS C C -2.690 0.397 -1.504 1.00 . A A . 31 CYS C 1 1 5 2502 1 1 31 CYS CA C -1.737 -0.693 -0.997 1.00 . A A . 31 CYS CA 1 1 5 2503 1 1 31 CYS CB C -0.280 -0.243 -1.151 1.00 . A A . 31 CYS CB 1 1 5 2504 1 1 31 CYS H H -1.866 -1.844 -2.816 1.00 . A A . 31 CYS H 1 1 5 2505 1 1 31 CYS HA H -1.944 -0.923 0.036 1.00 . A A . 31 CYS HA 1 1 5 2506 1 1 31 CYS HB2 H 0.375 -1.089 -1.010 1.00 . A A . 31 CYS HB2 1 1 5 2507 1 1 31 CYS HB3 H -0.132 0.168 -2.138 1.00 . A A . 31 CYS HB3 1 1 5 2508 1 1 31 CYS N N -1.863 -1.923 -1.840 1.00 . A A . 31 CYS N 1 1 5 2509 1 1 31 CYS O O -2.663 0.772 -2.662 1.00 . A A . 31 CYS O 1 1 5 2510 1 1 31 CYS SG S 0.103 1.022 0.086 1.00 . A A . 31 CYS SG 1 1 5 2511 1 1 32 ALA C C -4.794 2.876 0.168 1.00 . A A . 32 ALA C 1 1 5 2512 1 1 32 ALA CA C -4.491 1.974 -1.036 1.00 . A A . 32 ALA CA 1 1 5 2513 1 1 32 ALA CB C -5.748 1.224 -1.476 1.00 . A A . 32 ALA CB 1 1 5 2514 1 1 32 ALA H H -3.520 0.578 0.291 1.00 . A A . 32 ALA H 1 1 5 2515 1 1 32 ALA HA H -4.098 2.555 -1.856 1.00 . A A . 32 ALA HA 1 1 5 2516 1 1 32 ALA HB1 H -5.579 0.780 -2.446 1.00 . A A . 32 ALA HB1 1 1 5 2517 1 1 32 ALA HB2 H -6.577 1.912 -1.533 1.00 . A A . 32 ALA HB2 1 1 5 2518 1 1 32 ALA HB3 H -5.973 0.447 -0.760 1.00 . A A . 32 ALA HB3 1 1 5 2519 1 1 32 ALA N N -3.526 0.904 -0.635 1.00 . A A . 32 ALA N 1 1 5 2520 1 1 32 ALA O O -4.454 2.548 1.290 1.00 . A A . 32 ALA O 1 1 5 2521 1 1 33 VAL C C -6.547 4.151 2.163 1.00 . A A . 33 VAL C 1 1 5 2522 1 1 33 VAL CA C -5.753 4.917 1.098 1.00 . A A . 33 VAL CA 1 1 5 2523 1 1 33 VAL CB C -6.595 6.056 0.504 1.00 . A A . 33 VAL CB 1 1 5 2524 1 1 33 VAL CG1 C -7.085 6.972 1.629 1.00 . A A . 33 VAL CG1 1 1 5 2525 1 1 33 VAL CG2 C -5.740 6.873 -0.464 1.00 . A A . 33 VAL CG2 1 1 5 2526 1 1 33 VAL H H -5.701 4.247 -0.962 1.00 . A A . 33 VAL H 1 1 5 2527 1 1 33 VAL HA H -4.846 5.315 1.522 1.00 . A A . 33 VAL HA 1 1 5 2528 1 1 33 VAL HB H -7.445 5.642 -0.020 1.00 . A A . 33 VAL HB 1 1 5 2529 1 1 33 VAL HG11 H -6.260 7.216 2.281 1.00 . A A . 33 VAL HG11 1 1 5 2530 1 1 33 VAL HG12 H -7.854 6.469 2.195 1.00 . A A . 33 VAL HG12 1 1 5 2531 1 1 33 VAL HG13 H -7.488 7.880 1.204 1.00 . A A . 33 VAL HG13 1 1 5 2532 1 1 33 VAL HG21 H -4.770 7.050 -0.025 1.00 . A A . 33 VAL HG21 1 1 5 2533 1 1 33 VAL HG22 H -6.223 7.818 -0.662 1.00 . A A . 33 VAL HG22 1 1 5 2534 1 1 33 VAL HG23 H -5.623 6.328 -1.389 1.00 . A A . 33 VAL HG23 1 1 5 2535 1 1 33 VAL N N -5.432 4.004 -0.050 1.00 . A A . 33 VAL N 1 1 5 2536 1 1 33 VAL O O -7.357 3.298 1.849 1.00 . A A . 33 VAL O 1 1 5 2537 1 1 34 GLU C C -8.545 3.976 4.421 1.00 . A A . 34 GLU C 1 1 5 2538 1 1 34 GLU CA C -7.037 3.716 4.511 1.00 . A A . 34 GLU CA 1 1 5 2539 1 1 34 GLU CB C -6.468 4.270 5.819 1.00 . A A . 34 GLU CB 1 1 5 2540 1 1 34 GLU CD C -6.782 2.315 7.349 1.00 . A A . 34 GLU CD 1 1 5 2541 1 1 34 GLU CG C -5.755 3.148 6.577 1.00 . A A . 34 GLU CG 1 1 5 2542 1 1 34 GLU H H -5.643 5.123 3.645 1.00 . A A . 34 GLU H 1 1 5 2543 1 1 34 GLU HA H -6.839 2.657 4.446 1.00 . A A . 34 GLU HA 1 1 5 2544 1 1 34 GLU HB2 H -5.765 5.061 5.602 1.00 . A A . 34 GLU HB2 1 1 5 2545 1 1 34 GLU HB3 H -7.271 4.658 6.427 1.00 . A A . 34 GLU HB3 1 1 5 2546 1 1 34 GLU HG2 H -5.233 2.517 5.872 1.00 . A A . 34 GLU HG2 1 1 5 2547 1 1 34 GLU HG3 H -5.046 3.577 7.269 1.00 . A A . 34 GLU HG3 1 1 5 2548 1 1 34 GLU N N -6.309 4.438 3.420 1.00 . A A . 34 GLU N 1 1 5 2549 1 1 34 GLU O O -9.032 5.015 4.824 1.00 . A A . 34 GLU O 1 1 5 2550 1 1 34 GLU OE1 O -7.377 1.436 6.745 1.00 . A A . 34 GLU OE1 1 1 5 2551 1 1 34 GLU OE2 O -6.957 2.569 8.529 1.00 . A A . 34 GLU OE2 1 1 5 2552 1 1 35 ALA C C -11.450 2.998 5.127 1.00 . A A . 35 ALA C 1 1 5 2553 1 1 35 ALA CA C -10.760 3.205 3.766 1.00 . A A . 35 ALA CA 1 1 5 2554 1 1 35 ALA CB C -11.211 2.146 2.754 1.00 . A A . 35 ALA CB 1 1 5 2555 1 1 35 ALA H H -8.858 2.206 3.572 1.00 . A A . 35 ALA H 1 1 5 2556 1 1 35 ALA HA H -10.984 4.189 3.384 1.00 . A A . 35 ALA HA 1 1 5 2557 1 1 35 ALA HB1 H -12.168 1.746 3.051 1.00 . A A . 35 ALA HB1 1 1 5 2558 1 1 35 ALA HB2 H -10.484 1.348 2.716 1.00 . A A . 35 ALA HB2 1 1 5 2559 1 1 35 ALA HB3 H -11.298 2.597 1.775 1.00 . A A . 35 ALA HB3 1 1 5 2560 1 1 35 ALA N N -9.281 3.032 3.891 1.00 . A A . 35 ALA N 1 1 5 2561 1 1 35 ALA O O -12.160 3.873 5.585 1.00 . A A . 35 ALA O 1 1 5 2562 1 1 36 PRO C C -11.217 2.419 8.161 1.00 . A A . 36 PRO C 1 1 5 2563 1 1 36 PRO CA C -11.851 1.562 7.055 1.00 . A A . 36 PRO CA 1 1 5 2564 1 1 36 PRO CB C -11.564 0.078 7.274 1.00 . A A . 36 PRO CB 1 1 5 2565 1 1 36 PRO CD C -10.389 0.731 5.275 1.00 . A A . 36 PRO CD 1 1 5 2566 1 1 36 PRO CG C -10.348 -0.205 6.455 1.00 . A A . 36 PRO CG 1 1 5 2567 1 1 36 PRO HA H -12.917 1.726 7.012 1.00 . A A . 36 PRO HA 1 1 5 2568 1 1 36 PRO HB2 H -11.370 -0.116 8.322 1.00 . A A . 36 PRO HB2 1 1 5 2569 1 1 36 PRO HB3 H -12.391 -0.523 6.927 1.00 . A A . 36 PRO HB3 1 1 5 2570 1 1 36 PRO HD2 H -9.392 1.072 5.034 1.00 . A A . 36 PRO HD2 1 1 5 2571 1 1 36 PRO HD3 H -10.846 0.250 4.424 1.00 . A A . 36 PRO HD3 1 1 5 2572 1 1 36 PRO HG2 H -9.458 -0.026 7.042 1.00 . A A . 36 PRO HG2 1 1 5 2573 1 1 36 PRO HG3 H -10.365 -1.227 6.109 1.00 . A A . 36 PRO HG3 1 1 5 2574 1 1 36 PRO N N -11.226 1.850 5.738 1.00 . A A . 36 PRO N 1 1 5 2575 1 1 36 PRO O O -9.998 2.522 8.190 1.00 . A A . 36 PRO O 1 1 6 2576 1 1 1 ASP C C 11.204 10.791 -2.851 1.00 . A A . 1 ASP C 1 1 6 2577 1 1 1 ASP CA C 10.960 11.258 -4.292 1.00 . A A . 1 ASP CA 1 1 6 2578 1 1 1 ASP CB C 11.491 10.223 -5.289 1.00 . A A . 1 ASP CB 1 1 6 2579 1 1 1 ASP CG C 10.724 10.341 -6.608 1.00 . A A . 1 ASP CG 1 1 6 2580 1 1 1 ASP H1 H 11.564 12.808 -5.557 1.00 . A A . 1 ASP H1 1 1 6 2581 1 1 1 ASP H2 H 12.748 12.330 -4.433 1.00 . A A . 1 ASP H2 1 1 6 2582 1 1 1 ASP H3 H 11.419 13.262 -3.929 1.00 . A A . 1 ASP H3 1 1 6 2583 1 1 1 ASP HA H 9.908 11.423 -4.460 1.00 . A A . 1 ASP HA 1 1 6 2584 1 1 1 ASP HB2 H 12.543 10.399 -5.465 1.00 . A A . 1 ASP HB2 1 1 6 2585 1 1 1 ASP HB3 H 11.355 9.232 -4.885 1.00 . A A . 1 ASP HB3 1 1 6 2586 1 1 1 ASP N N 11.732 12.509 -4.575 1.00 . A A . 1 ASP N 1 1 6 2587 1 1 1 ASP O O 12.187 11.151 -2.230 1.00 . A A . 1 ASP O 1 1 6 2588 1 1 1 ASP OD1 O 9.662 9.750 -6.707 1.00 . A A . 1 ASP OD1 1 1 6 2589 1 1 1 ASP OD2 O 11.212 11.022 -7.495 1.00 . A A . 1 ASP OD2 1 1 6 2590 1 1 2 GLY C C 9.990 8.049 -0.803 1.00 . A A . 2 GLY C 1 1 6 2591 1 1 2 GLY CA C 10.487 9.496 -0.916 1.00 . A A . 2 GLY CA 1 1 6 2592 1 1 2 GLY H H 9.530 9.715 -2.837 1.00 . A A . 2 GLY H 1 1 6 2593 1 1 2 GLY HA2 H 11.533 9.539 -0.645 1.00 . A A . 2 GLY HA2 1 1 6 2594 1 1 2 GLY HA3 H 9.917 10.120 -0.243 1.00 . A A . 2 GLY HA3 1 1 6 2595 1 1 2 GLY N N 10.314 9.990 -2.317 1.00 . A A . 2 GLY N 1 1 6 2596 1 1 2 GLY O O 9.309 7.697 0.142 1.00 . A A . 2 GLY O 1 1 6 2597 1 1 3 GLU C C 8.361 5.680 -1.609 1.00 . A A . 3 GLU C 1 1 6 2598 1 1 3 GLU CA C 9.890 5.778 -1.735 1.00 . A A . 3 GLU CA 1 1 6 2599 1 1 3 GLU CB C 10.593 5.156 -0.520 1.00 . A A . 3 GLU CB 1 1 6 2600 1 1 3 GLU CD C 12.526 3.730 0.198 1.00 . A A . 3 GLU CD 1 1 6 2601 1 1 3 GLU CG C 11.734 4.256 -1.004 1.00 . A A . 3 GLU CG 1 1 6 2602 1 1 3 GLU H H 10.880 7.532 -2.506 1.00 . A A . 3 GLU H 1 1 6 2603 1 1 3 GLU HA H 10.217 5.280 -2.634 1.00 . A A . 3 GLU HA 1 1 6 2604 1 1 3 GLU HB2 H 10.991 5.939 0.108 1.00 . A A . 3 GLU HB2 1 1 6 2605 1 1 3 GLU HB3 H 9.886 4.566 0.044 1.00 . A A . 3 GLU HB3 1 1 6 2606 1 1 3 GLU HG2 H 11.323 3.424 -1.559 1.00 . A A . 3 GLU HG2 1 1 6 2607 1 1 3 GLU HG3 H 12.391 4.824 -1.644 1.00 . A A . 3 GLU HG3 1 1 6 2608 1 1 3 GLU N N 10.329 7.213 -1.762 1.00 . A A . 3 GLU N 1 1 6 2609 1 1 3 GLU O O 7.818 5.597 -0.522 1.00 . A A . 3 GLU O 1 1 6 2610 1 1 3 GLU OE1 O 13.381 4.453 0.680 1.00 . A A . 3 GLU OE1 1 1 6 2611 1 1 3 GLU OE2 O 12.265 2.612 0.611 1.00 . A A . 3 GLU OE2 1 1 6 2612 1 1 4 CYS C C 5.654 4.714 -3.818 1.00 . A A . 4 CYS C 1 1 6 2613 1 1 4 CYS CA C 6.175 5.612 -2.685 1.00 . A A . 4 CYS CA 1 1 6 2614 1 1 4 CYS CB C 5.703 7.063 -2.864 1.00 . A A . 4 CYS CB 1 1 6 2615 1 1 4 CYS H H 8.133 5.766 -3.583 1.00 . A A . 4 CYS H 1 1 6 2616 1 1 4 CYS HA H 5.846 5.235 -1.730 1.00 . A A . 4 CYS HA 1 1 6 2617 1 1 4 CYS HB2 H 5.465 7.480 -1.898 1.00 . A A . 4 CYS HB2 1 1 6 2618 1 1 4 CYS HB3 H 6.493 7.643 -3.315 1.00 . A A . 4 CYS HB3 1 1 6 2619 1 1 4 CYS N N 7.669 5.695 -2.722 1.00 . A A . 4 CYS N 1 1 6 2620 1 1 4 CYS O O 6.337 4.469 -4.796 1.00 . A A . 4 CYS O 1 1 6 2621 1 1 4 CYS SG S 4.231 7.133 -3.920 1.00 . A A . 4 CYS SG 1 1 6 2622 1 1 5 GLY C C 2.794 4.145 -5.518 1.00 . A A . 5 GLY C 1 1 6 2623 1 1 5 GLY CA C 3.852 3.357 -4.740 1.00 . A A . 5 GLY CA 1 1 6 2624 1 1 5 GLY H H 3.917 4.452 -2.894 1.00 . A A . 5 GLY H 1 1 6 2625 1 1 5 GLY HA2 H 4.629 3.028 -5.414 1.00 . A A . 5 GLY HA2 1 1 6 2626 1 1 5 GLY HA3 H 3.390 2.499 -4.277 1.00 . A A . 5 GLY HA3 1 1 6 2627 1 1 5 GLY N N 4.442 4.231 -3.688 1.00 . A A . 5 GLY N 1 1 6 2628 1 1 5 GLY O O 3.106 5.079 -6.234 1.00 . A A . 5 GLY O 1 1 6 2629 1 1 6 GLY C C -0.855 4.374 -5.313 1.00 . A A . 6 GLY C 1 1 6 2630 1 1 6 GLY CA C 0.456 4.499 -6.103 1.00 . A A . 6 GLY CA 1 1 6 2631 1 1 6 GLY H H 1.322 3.021 -4.796 1.00 . A A . 6 GLY H 1 1 6 2632 1 1 6 GLY HA2 H 0.724 5.541 -6.202 1.00 . A A . 6 GLY HA2 1 1 6 2633 1 1 6 GLY HA3 H 0.328 4.067 -7.083 1.00 . A A . 6 GLY HA3 1 1 6 2634 1 1 6 GLY N N 1.545 3.776 -5.379 1.00 . A A . 6 GLY N 1 1 6 2635 1 1 6 GLY O O -0.846 4.283 -4.101 1.00 . A A . 6 GLY O 1 1 6 2636 1 1 7 PHE C C -3.679 2.764 -5.108 1.00 . A A . 7 PHE C 1 1 6 2637 1 1 7 PHE CA C -3.291 4.238 -5.269 1.00 . A A . 7 PHE CA 1 1 6 2638 1 1 7 PHE CB C -4.315 4.973 -6.143 1.00 . A A . 7 PHE CB 1 1 6 2639 1 1 7 PHE CD1 C -6.400 4.643 -4.755 1.00 . A A . 7 PHE CD1 1 1 6 2640 1 1 7 PHE CD2 C -5.479 6.877 -4.964 1.00 . A A . 7 PHE CD2 1 1 6 2641 1 1 7 PHE CE1 C -7.424 5.141 -3.941 1.00 . A A . 7 PHE CE1 1 1 6 2642 1 1 7 PHE CE2 C -6.503 7.374 -4.148 1.00 . A A . 7 PHE CE2 1 1 6 2643 1 1 7 PHE CG C -5.426 5.511 -5.267 1.00 . A A . 7 PHE CG 1 1 6 2644 1 1 7 PHE CZ C -7.476 6.507 -3.637 1.00 . A A . 7 PHE CZ 1 1 6 2645 1 1 7 PHE H H -1.964 4.434 -6.968 1.00 . A A . 7 PHE H 1 1 6 2646 1 1 7 PHE HA H -3.229 4.711 -4.305 1.00 . A A . 7 PHE HA 1 1 6 2647 1 1 7 PHE HB2 H -3.832 5.790 -6.656 1.00 . A A . 7 PHE HB2 1 1 6 2648 1 1 7 PHE HB3 H -4.730 4.287 -6.868 1.00 . A A . 7 PHE HB3 1 1 6 2649 1 1 7 PHE HD1 H -6.360 3.589 -4.989 1.00 . A A . 7 PHE HD1 1 1 6 2650 1 1 7 PHE HD2 H -4.729 7.548 -5.357 1.00 . A A . 7 PHE HD2 1 1 6 2651 1 1 7 PHE HE1 H -8.173 4.471 -3.545 1.00 . A A . 7 PHE HE1 1 1 6 2652 1 1 7 PHE HE2 H -6.544 8.428 -3.914 1.00 . A A . 7 PHE HE2 1 1 6 2653 1 1 7 PHE HZ H -8.266 6.890 -3.008 1.00 . A A . 7 PHE HZ 1 1 6 2654 1 1 7 PHE N N -1.981 4.363 -5.990 1.00 . A A . 7 PHE N 1 1 6 2655 1 1 7 PHE O O -4.248 2.372 -4.109 1.00 . A A . 7 PHE O 1 1 6 2656 1 1 8 TRP C C -2.526 -0.332 -6.504 1.00 . A A . 8 TRP C 1 1 6 2657 1 1 8 TRP CA C -3.717 0.493 -5.994 1.00 . A A . 8 TRP CA 1 1 6 2658 1 1 8 TRP CB C -4.952 0.325 -6.893 1.00 . A A . 8 TRP CB 1 1 6 2659 1 1 8 TRP CD1 C -5.019 -2.038 -7.807 1.00 . A A . 8 TRP CD1 1 1 6 2660 1 1 8 TRP CD2 C -6.344 -1.774 -6.008 1.00 . A A . 8 TRP CD2 1 1 6 2661 1 1 8 TRP CE2 C -6.475 -3.123 -6.416 1.00 . A A . 8 TRP CE2 1 1 6 2662 1 1 8 TRP CE3 C -7.082 -1.347 -4.889 1.00 . A A . 8 TRP CE3 1 1 6 2663 1 1 8 TRP CG C -5.409 -1.105 -6.905 1.00 . A A . 8 TRP CG 1 1 6 2664 1 1 8 TRP CH2 C -8.034 -3.574 -4.634 1.00 . A A . 8 TRP CH2 1 1 6 2665 1 1 8 TRP CZ2 C -7.307 -4.014 -5.741 1.00 . A A . 8 TRP CZ2 1 1 6 2666 1 1 8 TRP CZ3 C -7.921 -2.243 -4.208 1.00 . A A . 8 TRP CZ3 1 1 6 2667 1 1 8 TRP H H -2.916 2.289 -6.877 1.00 . A A . 8 TRP H 1 1 6 2668 1 1 8 TRP HA H -3.956 0.224 -4.976 1.00 . A A . 8 TRP HA 1 1 6 2669 1 1 8 TRP HB2 H -5.751 0.948 -6.517 1.00 . A A . 8 TRP HB2 1 1 6 2670 1 1 8 TRP HB3 H -4.705 0.631 -7.897 1.00 . A A . 8 TRP HB3 1 1 6 2671 1 1 8 TRP HD1 H -4.326 -1.876 -8.619 1.00 . A A . 8 TRP HD1 1 1 6 2672 1 1 8 TRP HE1 H -5.534 -4.070 -8.016 1.00 . A A . 8 TRP HE1 1 1 6 2673 1 1 8 TRP HE3 H -7.001 -0.324 -4.552 1.00 . A A . 8 TRP HE3 1 1 6 2674 1 1 8 TRP HH2 H -8.682 -4.258 -4.106 1.00 . A A . 8 TRP HH2 1 1 6 2675 1 1 8 TRP HZ2 H -7.390 -5.039 -6.074 1.00 . A A . 8 TRP HZ2 1 1 6 2676 1 1 8 TRP HZ3 H -8.485 -1.904 -3.350 1.00 . A A . 8 TRP HZ3 1 1 6 2677 1 1 8 TRP N N -3.375 1.946 -6.083 1.00 . A A . 8 TRP N 1 1 6 2678 1 1 8 TRP NE1 N -5.647 -3.234 -7.515 1.00 . A A . 8 TRP NE1 1 1 6 2679 1 1 8 TRP O O -2.509 -0.800 -7.627 1.00 . A A . 8 TRP O 1 1 6 2680 1 1 9 TRP C C -0.246 -2.596 -5.359 1.00 . A A . 9 TRP C 1 1 6 2681 1 1 9 TRP CA C -0.307 -1.263 -6.109 1.00 . A A . 9 TRP CA 1 1 6 2682 1 1 9 TRP CB C 0.883 -0.369 -5.737 1.00 . A A . 9 TRP CB 1 1 6 2683 1 1 9 TRP CD1 C 0.045 1.333 -7.425 1.00 . A A . 9 TRP CD1 1 1 6 2684 1 1 9 TRP CD2 C 2.287 1.316 -7.250 1.00 . A A . 9 TRP CD2 1 1 6 2685 1 1 9 TRP CE2 C 1.957 2.301 -8.210 1.00 . A A . 9 TRP CE2 1 1 6 2686 1 1 9 TRP CE3 C 3.646 1.108 -6.955 1.00 . A A . 9 TRP CE3 1 1 6 2687 1 1 9 TRP CG C 1.054 0.713 -6.763 1.00 . A A . 9 TRP CG 1 1 6 2688 1 1 9 TRP CH2 C 4.282 2.838 -8.548 1.00 . A A . 9 TRP CH2 1 1 6 2689 1 1 9 TRP CZ2 C 2.936 3.053 -8.852 1.00 . A A . 9 TRP CZ2 1 1 6 2690 1 1 9 TRP CZ3 C 4.637 1.865 -7.602 1.00 . A A . 9 TRP CZ3 1 1 6 2691 1 1 9 TRP H H -1.546 -0.087 -4.789 1.00 . A A . 9 TRP H 1 1 6 2692 1 1 9 TRP HA H -0.322 -1.430 -7.175 1.00 . A A . 9 TRP HA 1 1 6 2693 1 1 9 TRP HB2 H 0.707 0.081 -4.771 1.00 . A A . 9 TRP HB2 1 1 6 2694 1 1 9 TRP HB3 H 1.782 -0.966 -5.694 1.00 . A A . 9 TRP HB3 1 1 6 2695 1 1 9 TRP HD1 H -1.005 1.126 -7.305 1.00 . A A . 9 TRP HD1 1 1 6 2696 1 1 9 TRP HE1 H 0.067 2.854 -8.877 1.00 . A A . 9 TRP HE1 1 1 6 2697 1 1 9 TRP HE3 H 3.931 0.362 -6.229 1.00 . A A . 9 TRP HE3 1 1 6 2698 1 1 9 TRP HH2 H 5.047 3.416 -9.042 1.00 . A A . 9 TRP HH2 1 1 6 2699 1 1 9 TRP HZ2 H 2.656 3.803 -9.575 1.00 . A A . 9 TRP HZ2 1 1 6 2700 1 1 9 TRP HZ3 H 5.675 1.701 -7.368 1.00 . A A . 9 TRP HZ3 1 1 6 2701 1 1 9 TRP N N -1.517 -0.489 -5.684 1.00 . A A . 9 TRP N 1 1 6 2702 1 1 9 TRP NE1 N 0.583 2.270 -8.283 1.00 . A A . 9 TRP NE1 1 1 6 2703 1 1 9 TRP O O -0.959 -2.807 -4.400 1.00 . A A . 9 TRP O 1 1 6 2704 1 1 10 LYS C C 1.777 -4.805 -4.029 1.00 . A A . 10 LYS C 1 1 6 2705 1 1 10 LYS CA C 0.682 -4.826 -5.093 1.00 . A A . 10 LYS CA 1 1 6 2706 1 1 10 LYS CB C 1.036 -5.843 -6.180 1.00 . A A . 10 LYS CB 1 1 6 2707 1 1 10 LYS CD C -0.227 -6.552 -8.221 1.00 . A A . 10 LYS CD 1 1 6 2708 1 1 10 LYS CE C -1.438 -5.788 -8.766 1.00 . A A . 10 LYS CE 1 1 6 2709 1 1 10 LYS CG C -0.241 -6.513 -6.691 1.00 . A A . 10 LYS CG 1 1 6 2710 1 1 10 LYS H H 1.158 -3.321 -6.570 1.00 . A A . 10 LYS H 1 1 6 2711 1 1 10 LYS HA H -0.268 -5.079 -4.650 1.00 . A A . 10 LYS HA 1 1 6 2712 1 1 10 LYS HB2 H 1.538 -5.340 -6.993 1.00 . A A . 10 LYS HB2 1 1 6 2713 1 1 10 LYS HB3 H 1.691 -6.595 -5.762 1.00 . A A . 10 LYS HB3 1 1 6 2714 1 1 10 LYS HD2 H 0.682 -6.094 -8.585 1.00 . A A . 10 LYS HD2 1 1 6 2715 1 1 10 LYS HD3 H -0.271 -7.578 -8.556 1.00 . A A . 10 LYS HD3 1 1 6 2716 1 1 10 LYS HE2 H -1.682 -4.959 -8.114 1.00 . A A . 10 LYS HE2 1 1 6 2717 1 1 10 LYS HE3 H -1.242 -5.435 -9.767 1.00 . A A . 10 LYS HE3 1 1 6 2718 1 1 10 LYS HG2 H -0.297 -7.519 -6.304 1.00 . A A . 10 LYS HG2 1 1 6 2719 1 1 10 LYS HG3 H -1.101 -5.949 -6.355 1.00 . A A . 10 LYS HG3 1 1 6 2720 1 1 10 LYS HZ1 H -2.721 -7.132 -7.821 1.00 . A A . 10 LYS HZ1 1 1 6 2721 1 1 10 LYS HZ2 H -2.294 -7.578 -9.403 1.00 . A A . 10 LYS HZ2 1 1 6 2722 1 1 10 LYS HZ3 H -3.415 -6.328 -9.142 1.00 . A A . 10 LYS HZ3 1 1 6 2723 1 1 10 LYS N N 0.593 -3.506 -5.790 1.00 . A A . 10 LYS N 1 1 6 2724 1 1 10 LYS NZ N -2.551 -6.781 -8.784 1.00 . A A . 10 LYS NZ 1 1 6 2725 1 1 10 LYS O O 2.861 -4.296 -4.248 1.00 . A A . 10 LYS O 1 1 6 2726 1 1 11 CYS C C 2.329 -6.633 -0.906 1.00 . A A . 11 CYS C 1 1 6 2727 1 1 11 CYS CA C 2.528 -5.398 -1.799 1.00 . A A . 11 CYS CA 1 1 6 2728 1 1 11 CYS CB C 2.313 -4.106 -1.005 1.00 . A A . 11 CYS CB 1 1 6 2729 1 1 11 CYS H H 0.626 -5.779 -2.734 1.00 . A A . 11 CYS H 1 1 6 2730 1 1 11 CYS HA H 3.515 -5.404 -2.233 1.00 . A A . 11 CYS HA 1 1 6 2731 1 1 11 CYS HB2 H 3.114 -3.987 -0.291 1.00 . A A . 11 CYS HB2 1 1 6 2732 1 1 11 CYS HB3 H 2.308 -3.264 -1.682 1.00 . A A . 11 CYS HB3 1 1 6 2733 1 1 11 CYS N N 1.504 -5.368 -2.880 1.00 . A A . 11 CYS N 1 1 6 2734 1 1 11 CYS O O 1.306 -7.291 -0.962 1.00 . A A . 11 CYS O 1 1 6 2735 1 1 11 CYS SG S 0.734 -4.179 -0.126 1.00 . A A . 11 CYS SG 1 1 6 2736 1 1 12 GLY C C 2.698 -7.670 2.204 1.00 . A A . 12 GLY C 1 1 6 2737 1 1 12 GLY CA C 3.170 -8.132 0.821 1.00 . A A . 12 GLY CA 1 1 6 2738 1 1 12 GLY H H 4.112 -6.399 -0.050 1.00 . A A . 12 GLY H 1 1 6 2739 1 1 12 GLY HA2 H 2.451 -8.824 0.407 1.00 . A A . 12 GLY HA2 1 1 6 2740 1 1 12 GLY HA3 H 4.127 -8.618 0.916 1.00 . A A . 12 GLY HA3 1 1 6 2741 1 1 12 GLY N N 3.298 -6.947 -0.080 1.00 . A A . 12 GLY N 1 1 6 2742 1 1 12 GLY O O 1.630 -7.105 2.345 1.00 . A A . 12 GLY O 1 1 6 2743 1 1 13 ARG C C 3.630 -6.043 4.875 1.00 . A A . 13 ARG C 1 1 6 2744 1 1 13 ARG CA C 3.102 -7.461 4.600 1.00 . A A . 13 ARG CA 1 1 6 2745 1 1 13 ARG CB C 3.759 -8.478 5.546 1.00 . A A . 13 ARG CB 1 1 6 2746 1 1 13 ARG CD C 2.111 -8.060 7.394 1.00 . A A . 13 ARG CD 1 1 6 2747 1 1 13 ARG CG C 2.695 -9.116 6.446 1.00 . A A . 13 ARG CG 1 1 6 2748 1 1 13 ARG CZ C 2.323 -7.722 9.787 1.00 . A A . 13 ARG CZ 1 1 6 2749 1 1 13 ARG H H 4.351 -8.349 3.078 1.00 . A A . 13 ARG H 1 1 6 2750 1 1 13 ARG HA H 2.029 -7.490 4.713 1.00 . A A . 13 ARG HA 1 1 6 2751 1 1 13 ARG HB2 H 4.245 -9.249 4.963 1.00 . A A . 13 ARG HB2 1 1 6 2752 1 1 13 ARG HB3 H 4.493 -7.978 6.159 1.00 . A A . 13 ARG HB3 1 1 6 2753 1 1 13 ARG HD2 H 2.326 -7.066 7.027 1.00 . A A . 13 ARG HD2 1 1 6 2754 1 1 13 ARG HD3 H 1.047 -8.200 7.500 1.00 . A A . 13 ARG HD3 1 1 6 2755 1 1 13 ARG HE H 3.581 -8.862 8.755 1.00 . A A . 13 ARG HE 1 1 6 2756 1 1 13 ARG HG2 H 1.905 -9.525 5.833 1.00 . A A . 13 ARG HG2 1 1 6 2757 1 1 13 ARG HG3 H 3.145 -9.908 7.026 1.00 . A A . 13 ARG HG3 1 1 6 2758 1 1 13 ARG HH11 H 3.156 -5.941 9.397 1.00 . A A . 13 ARG HH11 1 1 6 2759 1 1 13 ARG HH12 H 2.239 -6.032 10.864 1.00 . A A . 13 ARG HH12 1 1 6 2760 1 1 13 ARG HH21 H 1.384 -9.372 10.434 1.00 . A A . 13 ARG HH21 1 1 6 2761 1 1 13 ARG HH22 H 1.234 -7.979 11.452 1.00 . A A . 13 ARG HH22 1 1 6 2762 1 1 13 ARG N N 3.492 -7.897 3.221 1.00 . A A . 13 ARG N 1 1 6 2763 1 1 13 ARG NE N 2.787 -8.289 8.705 1.00 . A A . 13 ARG NE 1 1 6 2764 1 1 13 ARG NH1 N 2.593 -6.467 10.035 1.00 . A A . 13 ARG NH1 1 1 6 2765 1 1 13 ARG NH2 N 1.589 -8.411 10.622 1.00 . A A . 13 ARG NH2 1 1 6 2766 1 1 13 ARG O O 4.067 -5.735 5.970 1.00 . A A . 13 ARG O 1 1 6 2767 1 1 14 GLY C C 5.569 -3.705 3.666 1.00 . A A . 14 GLY C 1 1 6 2768 1 1 14 GLY CA C 4.097 -3.786 4.083 1.00 . A A . 14 GLY CA 1 1 6 2769 1 1 14 GLY H H 3.242 -5.447 3.017 1.00 . A A . 14 GLY H 1 1 6 2770 1 1 14 GLY HA2 H 3.512 -3.106 3.480 1.00 . A A . 14 GLY HA2 1 1 6 2771 1 1 14 GLY HA3 H 4.005 -3.511 5.124 1.00 . A A . 14 GLY HA3 1 1 6 2772 1 1 14 GLY N N 3.594 -5.179 3.889 1.00 . A A . 14 GLY N 1 1 6 2773 1 1 14 GLY O O 6.355 -3.010 4.279 1.00 . A A . 14 GLY O 1 1 6 2774 1 1 15 LYS C C 7.647 -3.115 1.334 1.00 . A A . 15 LYS C 1 1 6 2775 1 1 15 LYS CA C 7.374 -4.377 2.171 1.00 . A A . 15 LYS CA 1 1 6 2776 1 1 15 LYS CB C 7.575 -5.649 1.336 1.00 . A A . 15 LYS CB 1 1 6 2777 1 1 15 LYS CD C 9.420 -7.190 0.648 1.00 . A A . 15 LYS CD 1 1 6 2778 1 1 15 LYS CE C 10.938 -7.304 0.816 1.00 . A A . 15 LYS CE 1 1 6 2779 1 1 15 LYS CG C 8.832 -6.382 1.809 1.00 . A A . 15 LYS CG 1 1 6 2780 1 1 15 LYS H H 5.297 -4.970 2.148 1.00 . A A . 15 LYS H 1 1 6 2781 1 1 15 LYS HA H 8.028 -4.399 3.022 1.00 . A A . 15 LYS HA 1 1 6 2782 1 1 15 LYS HB2 H 6.716 -6.297 1.452 1.00 . A A . 15 LYS HB2 1 1 6 2783 1 1 15 LYS HB3 H 7.687 -5.383 0.296 1.00 . A A . 15 LYS HB3 1 1 6 2784 1 1 15 LYS HD2 H 8.984 -8.178 0.640 1.00 . A A . 15 LYS HD2 1 1 6 2785 1 1 15 LYS HD3 H 9.200 -6.691 -0.284 1.00 . A A . 15 LYS HD3 1 1 6 2786 1 1 15 LYS HE2 H 11.366 -6.332 1.017 1.00 . A A . 15 LYS HE2 1 1 6 2787 1 1 15 LYS HE3 H 11.179 -7.993 1.611 1.00 . A A . 15 LYS HE3 1 1 6 2788 1 1 15 LYS HG2 H 9.562 -5.663 2.153 1.00 . A A . 15 LYS HG2 1 1 6 2789 1 1 15 LYS HG3 H 8.577 -7.053 2.617 1.00 . A A . 15 LYS HG3 1 1 6 2790 1 1 15 LYS HZ1 H 11.200 -7.164 -1.247 1.00 . A A . 15 LYS HZ1 1 1 6 2791 1 1 15 LYS HZ2 H 10.985 -8.752 -0.682 1.00 . A A . 15 LYS HZ2 1 1 6 2792 1 1 15 LYS HZ3 H 12.466 -7.954 -0.441 1.00 . A A . 15 LYS HZ3 1 1 6 2793 1 1 15 LYS N N 5.949 -4.414 2.626 1.00 . A A . 15 LYS N 1 1 6 2794 1 1 15 LYS NZ N 11.434 -7.833 -0.487 1.00 . A A . 15 LYS NZ 1 1 6 2795 1 1 15 LYS O O 8.525 -2.343 1.666 1.00 . A A . 15 LYS O 1 1 6 2796 1 1 16 PRO C C 6.465 -0.505 0.073 1.00 . A A . 16 PRO C 1 1 6 2797 1 1 16 PRO CA C 7.059 -1.753 -0.598 1.00 . A A . 16 PRO CA 1 1 6 2798 1 1 16 PRO CB C 6.279 -2.117 -1.859 1.00 . A A . 16 PRO CB 1 1 6 2799 1 1 16 PRO CD C 5.807 -3.815 -0.196 1.00 . A A . 16 PRO CD 1 1 6 2800 1 1 16 PRO CG C 5.257 -3.114 -1.413 1.00 . A A . 16 PRO CG 1 1 6 2801 1 1 16 PRO HA H 8.100 -1.605 -0.837 1.00 . A A . 16 PRO HA 1 1 6 2802 1 1 16 PRO HB2 H 5.797 -1.238 -2.267 1.00 . A A . 16 PRO HB2 1 1 6 2803 1 1 16 PRO HB3 H 6.933 -2.562 -2.591 1.00 . A A . 16 PRO HB3 1 1 6 2804 1 1 16 PRO HD2 H 5.041 -3.915 0.560 1.00 . A A . 16 PRO HD2 1 1 6 2805 1 1 16 PRO HD3 H 6.205 -4.782 -0.461 1.00 . A A . 16 PRO HD3 1 1 6 2806 1 1 16 PRO HG2 H 4.336 -2.605 -1.162 1.00 . A A . 16 PRO HG2 1 1 6 2807 1 1 16 PRO HG3 H 5.078 -3.833 -2.197 1.00 . A A . 16 PRO HG3 1 1 6 2808 1 1 16 PRO N N 6.884 -2.940 0.277 1.00 . A A . 16 PRO N 1 1 6 2809 1 1 16 PRO O O 5.315 -0.510 0.473 1.00 . A A . 16 PRO O 1 1 6 2810 1 1 17 PRO C C 5.845 2.532 -0.110 1.00 . A A . 17 PRO C 1 1 6 2811 1 1 17 PRO CA C 6.814 1.786 0.814 1.00 . A A . 17 PRO CA 1 1 6 2812 1 1 17 PRO CB C 8.101 2.582 1.008 1.00 . A A . 17 PRO CB 1 1 6 2813 1 1 17 PRO CD C 8.667 0.615 -0.275 1.00 . A A . 17 PRO CD 1 1 6 2814 1 1 17 PRO CG C 9.042 2.053 -0.025 1.00 . A A . 17 PRO CG 1 1 6 2815 1 1 17 PRO HA H 6.355 1.588 1.768 1.00 . A A . 17 PRO HA 1 1 6 2816 1 1 17 PRO HB2 H 7.917 3.636 0.848 1.00 . A A . 17 PRO HB2 1 1 6 2817 1 1 17 PRO HB3 H 8.503 2.414 1.994 1.00 . A A . 17 PRO HB3 1 1 6 2818 1 1 17 PRO HD2 H 8.743 0.383 -1.329 1.00 . A A . 17 PRO HD2 1 1 6 2819 1 1 17 PRO HD3 H 9.290 -0.047 0.306 1.00 . A A . 17 PRO HD3 1 1 6 2820 1 1 17 PRO HG2 H 8.947 2.625 -0.938 1.00 . A A . 17 PRO HG2 1 1 6 2821 1 1 17 PRO HG3 H 10.056 2.105 0.338 1.00 . A A . 17 PRO HG3 1 1 6 2822 1 1 17 PRO N N 7.273 0.525 0.179 1.00 . A A . 17 PRO N 1 1 6 2823 1 1 17 PRO O O 6.216 2.987 -1.176 1.00 . A A . 17 PRO O 1 1 6 2824 1 1 18 CYS C C 3.709 4.893 -0.314 1.00 . A A . 18 CYS C 1 1 6 2825 1 1 18 CYS CA C 3.607 3.379 -0.549 1.00 . A A . 18 CYS CA 1 1 6 2826 1 1 18 CYS CB C 2.243 2.852 -0.095 1.00 . A A . 18 CYS CB 1 1 6 2827 1 1 18 CYS H H 4.337 2.285 1.159 1.00 . A A . 18 CYS H 1 1 6 2828 1 1 18 CYS HA H 3.763 3.148 -1.590 1.00 . A A . 18 CYS HA 1 1 6 2829 1 1 18 CYS HB2 H 2.104 3.062 0.954 1.00 . A A . 18 CYS HB2 1 1 6 2830 1 1 18 CYS HB3 H 1.462 3.334 -0.665 1.00 . A A . 18 CYS HB3 1 1 6 2831 1 1 18 CYS N N 4.607 2.659 0.296 1.00 . A A . 18 CYS N 1 1 6 2832 1 1 18 CYS O O 4.529 5.355 0.459 1.00 . A A . 18 CYS O 1 1 6 2833 1 1 18 CYS SG S 2.159 1.065 -0.362 1.00 . A A . 18 CYS SG 1 1 6 2834 1 1 19 CYS C C 2.366 7.532 0.591 1.00 . A A . 19 CYS C 1 1 6 2835 1 1 19 CYS CA C 2.932 7.153 -0.783 1.00 . A A . 19 CYS CA 1 1 6 2836 1 1 19 CYS CB C 2.059 7.732 -1.903 1.00 . A A . 19 CYS CB 1 1 6 2837 1 1 19 CYS H H 2.230 5.273 -1.589 1.00 . A A . 19 CYS H 1 1 6 2838 1 1 19 CYS HA H 3.943 7.510 -0.884 1.00 . A A . 19 CYS HA 1 1 6 2839 1 1 19 CYS HB2 H 1.527 6.932 -2.398 1.00 . A A . 19 CYS HB2 1 1 6 2840 1 1 19 CYS HB3 H 1.348 8.426 -1.481 1.00 . A A . 19 CYS HB3 1 1 6 2841 1 1 19 CYS N N 2.883 5.668 -0.972 1.00 . A A . 19 CYS N 1 1 6 2842 1 1 19 CYS O O 1.625 6.776 1.192 1.00 . A A . 19 CYS O 1 1 6 2843 1 1 19 CYS SG S 3.102 8.594 -3.101 1.00 . A A . 19 CYS SG 1 1 6 2844 1 1 20 LYS C C 0.665 9.074 2.445 1.00 . A A . 20 LYS C 1 1 6 2845 1 1 20 LYS CA C 2.200 9.126 2.428 1.00 . A A . 20 LYS CA 1 1 6 2846 1 1 20 LYS CB C 2.699 10.565 2.612 1.00 . A A . 20 LYS CB 1 1 6 2847 1 1 20 LYS CD C 4.914 11.464 3.370 1.00 . A A . 20 LYS CD 1 1 6 2848 1 1 20 LYS CE C 5.843 11.631 4.576 1.00 . A A . 20 LYS CE 1 1 6 2849 1 1 20 LYS CG C 3.703 10.614 3.770 1.00 . A A . 20 LYS CG 1 1 6 2850 1 1 20 LYS H H 3.313 9.278 0.593 1.00 . A A . 20 LYS H 1 1 6 2851 1 1 20 LYS HA H 2.605 8.494 3.198 1.00 . A A . 20 LYS HA 1 1 6 2852 1 1 20 LYS HB2 H 3.179 10.899 1.704 1.00 . A A . 20 LYS HB2 1 1 6 2853 1 1 20 LYS HB3 H 1.863 11.209 2.836 1.00 . A A . 20 LYS HB3 1 1 6 2854 1 1 20 LYS HD2 H 5.448 10.972 2.568 1.00 . A A . 20 LYS HD2 1 1 6 2855 1 1 20 LYS HD3 H 4.579 12.434 3.036 1.00 . A A . 20 LYS HD3 1 1 6 2856 1 1 20 LYS HE2 H 5.334 12.163 5.369 1.00 . A A . 20 LYS HE2 1 1 6 2857 1 1 20 LYS HE3 H 6.183 10.670 4.924 1.00 . A A . 20 LYS HE3 1 1 6 2858 1 1 20 LYS HG2 H 3.230 11.051 4.636 1.00 . A A . 20 LYS HG2 1 1 6 2859 1 1 20 LYS HG3 H 4.032 9.613 4.005 1.00 . A A . 20 LYS HG3 1 1 6 2860 1 1 20 LYS HZ1 H 7.483 11.901 3.321 1.00 . A A . 20 LYS HZ1 1 1 6 2861 1 1 20 LYS HZ2 H 7.660 12.610 4.855 1.00 . A A . 20 LYS HZ2 1 1 6 2862 1 1 20 LYS HZ3 H 6.656 13.336 3.691 1.00 . A A . 20 LYS HZ3 1 1 6 2863 1 1 20 LYS N N 2.713 8.693 1.093 1.00 . A A . 20 LYS N 1 1 6 2864 1 1 20 LYS NZ N 6.996 12.429 4.073 1.00 . A A . 20 LYS NZ 1 1 6 2865 1 1 20 LYS O O 0.006 9.694 1.631 1.00 . A A . 20 LYS O 1 1 6 2866 1 1 21 GLY C C -1.830 6.844 2.879 1.00 . A A . 21 GLY C 1 1 6 2867 1 1 21 GLY CA C -1.392 8.210 3.427 1.00 . A A . 21 GLY CA 1 1 6 2868 1 1 21 GLY H H 0.653 7.826 3.994 1.00 . A A . 21 GLY H 1 1 6 2869 1 1 21 GLY HA2 H -1.712 8.305 4.455 1.00 . A A . 21 GLY HA2 1 1 6 2870 1 1 21 GLY HA3 H -1.843 8.992 2.836 1.00 . A A . 21 GLY HA3 1 1 6 2871 1 1 21 GLY N N 0.097 8.325 3.358 1.00 . A A . 21 GLY N 1 1 6 2872 1 1 21 GLY O O -2.864 6.321 3.250 1.00 . A A . 21 GLY O 1 1 6 2873 1 1 22 TYR C C -0.811 3.818 2.314 1.00 . A A . 22 TYR C 1 1 6 2874 1 1 22 TYR CA C -1.396 4.925 1.431 1.00 . A A . 22 TYR CA 1 1 6 2875 1 1 22 TYR CB C -0.738 4.896 0.044 1.00 . A A . 22 TYR CB 1 1 6 2876 1 1 22 TYR CD1 C -0.967 7.260 -0.821 1.00 . A A . 22 TYR CD1 1 1 6 2877 1 1 22 TYR CD2 C -2.391 5.534 -1.752 1.00 . A A . 22 TYR CD2 1 1 6 2878 1 1 22 TYR CE1 C -1.561 8.206 -1.663 1.00 . A A . 22 TYR CE1 1 1 6 2879 1 1 22 TYR CE2 C -2.984 6.480 -2.594 1.00 . A A . 22 TYR CE2 1 1 6 2880 1 1 22 TYR CG C -1.383 5.922 -0.863 1.00 . A A . 22 TYR CG 1 1 6 2881 1 1 22 TYR CZ C -2.570 7.816 -2.551 1.00 . A A . 22 TYR CZ 1 1 6 2882 1 1 22 TYR H H -0.214 6.700 1.727 1.00 . A A . 22 TYR H 1 1 6 2883 1 1 22 TYR HA H -2.465 4.819 1.339 1.00 . A A . 22 TYR HA 1 1 6 2884 1 1 22 TYR HB2 H 0.314 5.115 0.142 1.00 . A A . 22 TYR HB2 1 1 6 2885 1 1 22 TYR HB3 H -0.859 3.912 -0.387 1.00 . A A . 22 TYR HB3 1 1 6 2886 1 1 22 TYR HD1 H -0.189 7.562 -0.135 1.00 . A A . 22 TYR HD1 1 1 6 2887 1 1 22 TYR HD2 H -2.712 4.503 -1.786 1.00 . A A . 22 TYR HD2 1 1 6 2888 1 1 22 TYR HE1 H -1.240 9.238 -1.630 1.00 . A A . 22 TYR HE1 1 1 6 2889 1 1 22 TYR HE2 H -3.763 6.181 -3.278 1.00 . A A . 22 TYR HE2 1 1 6 2890 1 1 22 TYR HH H -2.668 8.756 -4.210 1.00 . A A . 22 TYR HH 1 1 6 2891 1 1 22 TYR N N -1.043 6.260 2.005 1.00 . A A . 22 TYR N 1 1 6 2892 1 1 22 TYR O O 0.326 3.892 2.741 1.00 . A A . 22 TYR O 1 1 6 2893 1 1 22 TYR OH O -3.156 8.748 -3.384 1.00 . A A . 22 TYR OH 1 1 6 2894 1 1 23 ALA C C -1.162 0.345 2.711 1.00 . A A . 23 ALA C 1 1 6 2895 1 1 23 ALA CA C -1.062 1.682 3.452 1.00 . A A . 23 ALA CA 1 1 6 2896 1 1 23 ALA CB C -1.961 1.679 4.688 1.00 . A A . 23 ALA CB 1 1 6 2897 1 1 23 ALA H H -2.490 2.752 2.236 1.00 . A A . 23 ALA H 1 1 6 2898 1 1 23 ALA HA H -0.042 1.873 3.740 1.00 . A A . 23 ALA HA 1 1 6 2899 1 1 23 ALA HB1 H -1.802 2.587 5.250 1.00 . A A . 23 ALA HB1 1 1 6 2900 1 1 23 ALA HB2 H -1.719 0.827 5.307 1.00 . A A . 23 ALA HB2 1 1 6 2901 1 1 23 ALA HB3 H -2.994 1.621 4.382 1.00 . A A . 23 ALA HB3 1 1 6 2902 1 1 23 ALA N N -1.577 2.792 2.593 1.00 . A A . 23 ALA N 1 1 6 2903 1 1 23 ALA O O -2.050 0.136 1.905 1.00 . A A . 23 ALA O 1 1 6 2904 1 1 24 CYS C C -1.151 -2.871 3.082 1.00 . A A . 24 CYS C 1 1 6 2905 1 1 24 CYS CA C -0.288 -1.887 2.293 1.00 . A A . 24 CYS CA 1 1 6 2906 1 1 24 CYS CB C 1.171 -2.353 2.255 1.00 . A A . 24 CYS CB 1 1 6 2907 1 1 24 CYS H H 0.450 -0.366 3.634 1.00 . A A . 24 CYS H 1 1 6 2908 1 1 24 CYS HA H -0.665 -1.779 1.289 1.00 . A A . 24 CYS HA 1 1 6 2909 1 1 24 CYS HB2 H 1.708 -1.780 1.515 1.00 . A A . 24 CYS HB2 1 1 6 2910 1 1 24 CYS HB3 H 1.620 -2.200 3.224 1.00 . A A . 24 CYS HB3 1 1 6 2911 1 1 24 CYS N N -0.255 -0.561 2.981 1.00 . A A . 24 CYS N 1 1 6 2912 1 1 24 CYS O O -1.401 -2.694 4.261 1.00 . A A . 24 CYS O 1 1 6 2913 1 1 24 CYS SG S 1.252 -4.111 1.825 1.00 . A A . 24 CYS SG 1 1 6 2914 1 1 25 SER C C -2.056 -6.330 2.712 1.00 . A A . 25 SER C 1 1 6 2915 1 1 25 SER CA C -2.466 -4.914 3.119 1.00 . A A . 25 SER CA 1 1 6 2916 1 1 25 SER CB C -3.890 -4.609 2.650 1.00 . A A . 25 SER CB 1 1 6 2917 1 1 25 SER H H -1.394 -4.016 1.482 1.00 . A A . 25 SER H 1 1 6 2918 1 1 25 SER HA H -2.400 -4.798 4.183 1.00 . A A . 25 SER HA 1 1 6 2919 1 1 25 SER HB2 H -3.865 -4.217 1.647 1.00 . A A . 25 SER HB2 1 1 6 2920 1 1 25 SER HB3 H -4.475 -5.517 2.664 1.00 . A A . 25 SER HB3 1 1 6 2921 1 1 25 SER HG H -5.156 -4.078 4.031 1.00 . A A . 25 SER HG 1 1 6 2922 1 1 25 SER N N -1.611 -3.906 2.431 1.00 . A A . 25 SER N 1 1 6 2923 1 1 25 SER O O -2.222 -6.727 1.575 1.00 . A A . 25 SER O 1 1 6 2924 1 1 25 SER OG O -4.472 -3.643 3.516 1.00 . A A . 25 SER OG 1 1 6 2925 1 1 26 LYS C C -2.373 -9.356 3.081 1.00 . A A . 26 LYS C 1 1 6 2926 1 1 26 LYS CA C -1.124 -8.498 3.303 1.00 . A A . 26 LYS CA 1 1 6 2927 1 1 26 LYS CB C -0.336 -8.995 4.517 1.00 . A A . 26 LYS CB 1 1 6 2928 1 1 26 LYS CD C -0.149 -11.356 5.326 1.00 . A A . 26 LYS CD 1 1 6 2929 1 1 26 LYS CE C -1.509 -11.976 4.993 1.00 . A A . 26 LYS CE 1 1 6 2930 1 1 26 LYS CG C 0.254 -10.378 4.219 1.00 . A A . 26 LYS CG 1 1 6 2931 1 1 26 LYS H H -1.413 -6.756 4.547 1.00 . A A . 26 LYS H 1 1 6 2932 1 1 26 LYS HA H -0.500 -8.509 2.426 1.00 . A A . 26 LYS HA 1 1 6 2933 1 1 26 LYS HB2 H 0.464 -8.302 4.735 1.00 . A A . 26 LYS HB2 1 1 6 2934 1 1 26 LYS HB3 H -0.994 -9.064 5.371 1.00 . A A . 26 LYS HB3 1 1 6 2935 1 1 26 LYS HD2 H 0.595 -12.136 5.403 1.00 . A A . 26 LYS HD2 1 1 6 2936 1 1 26 LYS HD3 H -0.215 -10.829 6.267 1.00 . A A . 26 LYS HD3 1 1 6 2937 1 1 26 LYS HE2 H -2.225 -11.202 4.754 1.00 . A A . 26 LYS HE2 1 1 6 2938 1 1 26 LYS HE3 H -1.415 -12.671 4.173 1.00 . A A . 26 LYS HE3 1 1 6 2939 1 1 26 LYS HG2 H -0.121 -10.732 3.270 1.00 . A A . 26 LYS HG2 1 1 6 2940 1 1 26 LYS HG3 H 1.330 -10.308 4.177 1.00 . A A . 26 LYS HG3 1 1 6 2941 1 1 26 LYS HZ1 H -2.844 -13.153 6.075 1.00 . A A . 26 LYS HZ1 1 1 6 2942 1 1 26 LYS HZ2 H -1.992 -12.026 7.019 1.00 . A A . 26 LYS HZ2 1 1 6 2943 1 1 26 LYS HZ3 H -1.215 -13.430 6.456 1.00 . A A . 26 LYS HZ3 1 1 6 2944 1 1 26 LYS N N -1.531 -7.097 3.636 1.00 . A A . 26 LYS N 1 1 6 2945 1 1 26 LYS NZ N -1.921 -12.702 6.230 1.00 . A A . 26 LYS NZ 1 1 6 2946 1 1 26 LYS O O -2.421 -10.181 2.187 1.00 . A A . 26 LYS O 1 1 6 2947 1 1 27 THR C C -5.275 -9.649 2.359 1.00 . A A . 27 THR C 1 1 6 2948 1 1 27 THR CA C -4.656 -9.936 3.731 1.00 . A A . 27 THR CA 1 1 6 2949 1 1 27 THR CB C -5.585 -9.445 4.854 1.00 . A A . 27 THR CB 1 1 6 2950 1 1 27 THR CG2 C -6.799 -10.371 4.959 1.00 . A A . 27 THR CG2 1 1 6 2951 1 1 27 THR H H -3.318 -8.474 4.590 1.00 . A A . 27 THR H 1 1 6 2952 1 1 27 THR HA H -4.464 -10.989 3.843 1.00 . A A . 27 THR HA 1 1 6 2953 1 1 27 THR HB H -5.923 -8.443 4.630 1.00 . A A . 27 THR HB 1 1 6 2954 1 1 27 THR HG1 H -4.556 -10.332 6.253 1.00 . A A . 27 THR HG1 1 1 6 2955 1 1 27 THR HG21 H -7.419 -10.255 4.083 1.00 . A A . 27 THR HG21 1 1 6 2956 1 1 27 THR HG22 H -7.369 -10.116 5.841 1.00 . A A . 27 THR HG22 1 1 6 2957 1 1 27 THR HG23 H -6.466 -11.396 5.030 1.00 . A A . 27 THR HG23 1 1 6 2958 1 1 27 THR N N -3.389 -9.153 3.886 1.00 . A A . 27 THR N 1 1 6 2959 1 1 27 THR O O -5.791 -10.534 1.703 1.00 . A A . 27 THR O 1 1 6 2960 1 1 27 THR OG1 O -4.882 -9.442 6.091 1.00 . A A . 27 THR OG1 1 1 6 2961 1 1 28 TRP C C -4.774 -8.393 -0.511 1.00 . A A . 28 TRP C 1 1 6 2962 1 1 28 TRP CA C -5.784 -8.053 0.590 1.00 . A A . 28 TRP CA 1 1 6 2963 1 1 28 TRP CB C -6.022 -6.537 0.641 1.00 . A A . 28 TRP CB 1 1 6 2964 1 1 28 TRP CD1 C -7.642 -7.064 2.532 1.00 . A A . 28 TRP CD1 1 1 6 2965 1 1 28 TRP CD2 C -7.374 -4.856 2.197 1.00 . A A . 28 TRP CD2 1 1 6 2966 1 1 28 TRP CE2 C -8.287 -4.997 3.267 1.00 . A A . 28 TRP CE2 1 1 6 2967 1 1 28 TRP CE3 C -7.034 -3.556 1.783 1.00 . A A . 28 TRP CE3 1 1 6 2968 1 1 28 TRP CG C -6.975 -6.182 1.747 1.00 . A A . 28 TRP CG 1 1 6 2969 1 1 28 TRP CH2 C -8.493 -2.605 3.483 1.00 . A A . 28 TRP CH2 1 1 6 2970 1 1 28 TRP CZ2 C -8.842 -3.889 3.906 1.00 . A A . 28 TRP CZ2 1 1 6 2971 1 1 28 TRP CZ3 C -7.592 -2.438 2.423 1.00 . A A . 28 TRP CZ3 1 1 6 2972 1 1 28 TRP H H -4.785 -7.728 2.474 1.00 . A A . 28 TRP H 1 1 6 2973 1 1 28 TRP HA H -6.716 -8.570 0.423 1.00 . A A . 28 TRP HA 1 1 6 2974 1 1 28 TRP HB2 H -5.082 -6.035 0.810 1.00 . A A . 28 TRP HB2 1 1 6 2975 1 1 28 TRP HB3 H -6.433 -6.210 -0.300 1.00 . A A . 28 TRP HB3 1 1 6 2976 1 1 28 TRP HD1 H -7.575 -8.139 2.467 1.00 . A A . 28 TRP HD1 1 1 6 2977 1 1 28 TRP HE1 H -8.991 -6.762 4.120 1.00 . A A . 28 TRP HE1 1 1 6 2978 1 1 28 TRP HE3 H -6.340 -3.417 0.969 1.00 . A A . 28 TRP HE3 1 1 6 2979 1 1 28 TRP HH2 H -8.920 -1.741 3.971 1.00 . A A . 28 TRP HH2 1 1 6 2980 1 1 28 TRP HZ2 H -9.537 -4.023 4.721 1.00 . A A . 28 TRP HZ2 1 1 6 2981 1 1 28 TRP HZ3 H -7.322 -1.444 2.097 1.00 . A A . 28 TRP HZ3 1 1 6 2982 1 1 28 TRP N N -5.214 -8.416 1.924 1.00 . A A . 28 TRP N 1 1 6 2983 1 1 28 TRP NE1 N -8.415 -6.361 3.437 1.00 . A A . 28 TRP NE1 1 1 6 2984 1 1 28 TRP O O -5.130 -8.904 -1.557 1.00 . A A . 28 TRP O 1 1 6 2985 1 1 29 GLY C C -2.101 -7.143 -2.078 1.00 . A A . 29 GLY C 1 1 6 2986 1 1 29 GLY CA C -2.463 -8.411 -1.288 1.00 . A A . 29 GLY CA 1 1 6 2987 1 1 29 GLY H H -3.262 -7.701 0.578 1.00 . A A . 29 GLY H 1 1 6 2988 1 1 29 GLY HA2 H -1.582 -8.781 -0.784 1.00 . A A . 29 GLY HA2 1 1 6 2989 1 1 29 GLY HA3 H -2.828 -9.163 -1.972 1.00 . A A . 29 GLY HA3 1 1 6 2990 1 1 29 GLY N N -3.516 -8.110 -0.274 1.00 . A A . 29 GLY N 1 1 6 2991 1 1 29 GLY O O -1.469 -7.224 -3.116 1.00 . A A . 29 GLY O 1 1 6 2992 1 1 30 TRP C C -2.020 -3.527 -1.399 1.00 . A A . 30 TRP C 1 1 6 2993 1 1 30 TRP CA C -2.141 -4.725 -2.356 1.00 . A A . 30 TRP CA 1 1 6 2994 1 1 30 TRP CB C -3.281 -4.525 -3.371 1.00 . A A . 30 TRP CB 1 1 6 2995 1 1 30 TRP CD1 C -4.716 -2.846 -2.132 1.00 . A A . 30 TRP CD1 1 1 6 2996 1 1 30 TRP CD2 C -5.774 -4.802 -2.469 1.00 . A A . 30 TRP CD2 1 1 6 2997 1 1 30 TRP CE2 C -6.677 -3.966 -1.770 1.00 . A A . 30 TRP CE2 1 1 6 2998 1 1 30 TRP CE3 C -6.201 -6.098 -2.810 1.00 . A A . 30 TRP CE3 1 1 6 2999 1 1 30 TRP CG C -4.533 -4.070 -2.680 1.00 . A A . 30 TRP CG 1 1 6 3000 1 1 30 TRP CH2 C -8.363 -5.689 -1.767 1.00 . A A . 30 TRP CH2 1 1 6 3001 1 1 30 TRP CZ2 C -7.955 -4.399 -1.421 1.00 . A A . 30 TRP CZ2 1 1 6 3002 1 1 30 TRP CZ3 C -7.488 -6.538 -2.460 1.00 . A A . 30 TRP CZ3 1 1 6 3003 1 1 30 TRP H H -2.988 -5.919 -0.764 1.00 . A A . 30 TRP H 1 1 6 3004 1 1 30 TRP HA H -1.210 -4.860 -2.884 1.00 . A A . 30 TRP HA 1 1 6 3005 1 1 30 TRP HB2 H -2.988 -3.784 -4.096 1.00 . A A . 30 TRP HB2 1 1 6 3006 1 1 30 TRP HB3 H -3.474 -5.460 -3.876 1.00 . A A . 30 TRP HB3 1 1 6 3007 1 1 30 TRP HD1 H -3.990 -2.049 -2.117 1.00 . A A . 30 TRP HD1 1 1 6 3008 1 1 30 TRP HE1 H -6.359 -2.011 -1.126 1.00 . A A . 30 TRP HE1 1 1 6 3009 1 1 30 TRP HE3 H -5.534 -6.760 -3.343 1.00 . A A . 30 TRP HE3 1 1 6 3010 1 1 30 TRP HH2 H -9.351 -6.032 -1.500 1.00 . A A . 30 TRP HH2 1 1 6 3011 1 1 30 TRP HZ2 H -8.625 -3.742 -0.888 1.00 . A A . 30 TRP HZ2 1 1 6 3012 1 1 30 TRP HZ3 H -7.807 -7.535 -2.726 1.00 . A A . 30 TRP HZ3 1 1 6 3013 1 1 30 TRP N N -2.484 -5.976 -1.607 1.00 . A A . 30 TRP N 1 1 6 3014 1 1 30 TRP NE1 N -5.982 -2.786 -1.587 1.00 . A A . 30 TRP NE1 1 1 6 3015 1 1 30 TRP O O -2.198 -3.654 -0.204 1.00 . A A . 30 TRP O 1 1 6 3016 1 1 31 CYS C C -2.487 -0.027 -1.600 1.00 . A A . 31 CYS C 1 1 6 3017 1 1 31 CYS CA C -1.588 -1.149 -1.072 1.00 . A A . 31 CYS CA 1 1 6 3018 1 1 31 CYS CB C -0.114 -0.744 -1.179 1.00 . A A . 31 CYS CB 1 1 6 3019 1 1 31 CYS H H -1.594 -2.294 -2.898 1.00 . A A . 31 CYS H 1 1 6 3020 1 1 31 CYS HA H -1.833 -1.379 -0.048 1.00 . A A . 31 CYS HA 1 1 6 3021 1 1 31 CYS HB2 H 0.511 -1.583 -0.923 1.00 . A A . 31 CYS HB2 1 1 6 3022 1 1 31 CYS HB3 H 0.100 -0.426 -2.189 1.00 . A A . 31 CYS HB3 1 1 6 3023 1 1 31 CYS N N -1.723 -2.366 -1.930 1.00 . A A . 31 CYS N 1 1 6 3024 1 1 31 CYS O O -2.432 0.336 -2.760 1.00 . A A . 31 CYS O 1 1 6 3025 1 1 31 CYS SG S 0.219 0.620 -0.040 1.00 . A A . 31 CYS SG 1 1 6 3026 1 1 32 ALA C C -4.454 2.604 -0.011 1.00 . A A . 32 ALA C 1 1 6 3027 1 1 32 ALA CA C -4.217 1.637 -1.179 1.00 . A A . 32 ALA CA 1 1 6 3028 1 1 32 ALA CB C -5.519 0.947 -1.594 1.00 . A A . 32 ALA CB 1 1 6 3029 1 1 32 ALA H H -3.329 0.220 0.183 1.00 . A A . 32 ALA H 1 1 6 3030 1 1 32 ALA HA H -3.791 2.160 -2.021 1.00 . A A . 32 ALA HA 1 1 6 3031 1 1 32 ALA HB1 H -6.349 1.622 -1.444 1.00 . A A . 32 ALA HB1 1 1 6 3032 1 1 32 ALA HB2 H -5.665 0.059 -0.996 1.00 . A A . 32 ALA HB2 1 1 6 3033 1 1 32 ALA HB3 H -5.465 0.673 -2.637 1.00 . A A . 32 ALA HB3 1 1 6 3034 1 1 32 ALA N N -3.311 0.529 -0.747 1.00 . A A . 32 ALA N 1 1 6 3035 1 1 32 ALA O O -4.013 2.367 1.097 1.00 . A A . 32 ALA O 1 1 6 3036 1 1 33 VAL C C -6.209 4.017 1.980 1.00 . A A . 33 VAL C 1 1 6 3037 1 1 33 VAL CA C -5.403 4.677 0.853 1.00 . A A . 33 VAL CA 1 1 6 3038 1 1 33 VAL CB C -6.217 5.815 0.219 1.00 . A A . 33 VAL CB 1 1 6 3039 1 1 33 VAL CG1 C -6.586 6.838 1.295 1.00 . A A . 33 VAL CG1 1 1 6 3040 1 1 33 VAL CG2 C -5.386 6.507 -0.860 1.00 . A A . 33 VAL CG2 1 1 6 3041 1 1 33 VAL H H -5.487 3.868 -1.152 1.00 . A A . 33 VAL H 1 1 6 3042 1 1 33 VAL HA H -4.471 5.064 1.236 1.00 . A A . 33 VAL HA 1 1 6 3043 1 1 33 VAL HB H -7.119 5.411 -0.218 1.00 . A A . 33 VAL HB 1 1 6 3044 1 1 33 VAL HG11 H -7.249 6.383 2.015 1.00 . A A . 33 VAL HG11 1 1 6 3045 1 1 33 VAL HG12 H -7.079 7.682 0.837 1.00 . A A . 33 VAL HG12 1 1 6 3046 1 1 33 VAL HG13 H -5.688 7.176 1.795 1.00 . A A . 33 VAL HG13 1 1 6 3047 1 1 33 VAL HG21 H -4.412 6.753 -0.464 1.00 . A A . 33 VAL HG21 1 1 6 3048 1 1 33 VAL HG22 H -5.884 7.413 -1.174 1.00 . A A . 33 VAL HG22 1 1 6 3049 1 1 33 VAL HG23 H -5.274 5.847 -1.708 1.00 . A A . 33 VAL HG23 1 1 6 3050 1 1 33 VAL N N -5.145 3.695 -0.250 1.00 . A A . 33 VAL N 1 1 6 3051 1 1 33 VAL O O -7.061 3.183 1.739 1.00 . A A . 33 VAL O 1 1 6 3052 1 1 34 GLU C C -7.807 4.761 4.801 1.00 . A A . 34 GLU C 1 1 6 3053 1 1 34 GLU CA C -6.697 3.800 4.355 1.00 . A A . 34 GLU CA 1 1 6 3054 1 1 34 GLU CB C -5.654 3.611 5.462 1.00 . A A . 34 GLU CB 1 1 6 3055 1 1 34 GLU CD C -6.147 1.237 6.090 1.00 . A A . 34 GLU CD 1 1 6 3056 1 1 34 GLU CG C -5.129 2.173 5.433 1.00 . A A . 34 GLU CG 1 1 6 3057 1 1 34 GLU H H -5.260 5.073 3.373 1.00 . A A . 34 GLU H 1 1 6 3058 1 1 34 GLU HA H -7.118 2.846 4.075 1.00 . A A . 34 GLU HA 1 1 6 3059 1 1 34 GLU HB2 H -4.835 4.298 5.306 1.00 . A A . 34 GLU HB2 1 1 6 3060 1 1 34 GLU HB3 H -6.107 3.806 6.422 1.00 . A A . 34 GLU HB3 1 1 6 3061 1 1 34 GLU HG2 H -4.968 1.870 4.408 1.00 . A A . 34 GLU HG2 1 1 6 3062 1 1 34 GLU HG3 H -4.195 2.120 5.973 1.00 . A A . 34 GLU HG3 1 1 6 3063 1 1 34 GLU N N -5.946 4.393 3.208 1.00 . A A . 34 GLU N 1 1 6 3064 1 1 34 GLU O O -7.800 5.267 5.910 1.00 . A A . 34 GLU O 1 1 6 3065 1 1 34 GLU OE1 O -6.182 1.192 7.308 1.00 . A A . 34 GLU OE1 1 1 6 3066 1 1 34 GLU OE2 O -6.876 0.582 5.362 1.00 . A A . 34 GLU OE2 1 1 6 3067 1 1 35 ALA C C -11.131 5.161 4.679 1.00 . A A . 35 ALA C 1 1 6 3068 1 1 35 ALA CA C -9.872 5.953 4.299 1.00 . A A . 35 ALA CA 1 1 6 3069 1 1 35 ALA CB C -10.116 6.783 3.037 1.00 . A A . 35 ALA CB 1 1 6 3070 1 1 35 ALA H H -8.742 4.604 3.052 1.00 . A A . 35 ALA H 1 1 6 3071 1 1 35 ALA HA H -9.573 6.598 5.109 1.00 . A A . 35 ALA HA 1 1 6 3072 1 1 35 ALA HB1 H -9.174 7.158 2.666 1.00 . A A . 35 ALA HB1 1 1 6 3073 1 1 35 ALA HB2 H -10.768 7.611 3.271 1.00 . A A . 35 ALA HB2 1 1 6 3074 1 1 35 ALA HB3 H -10.578 6.163 2.282 1.00 . A A . 35 ALA HB3 1 1 6 3075 1 1 35 ALA N N -8.761 5.021 3.939 1.00 . A A . 35 ALA N 1 1 6 3076 1 1 35 ALA O O -11.726 4.507 3.842 1.00 . A A . 35 ALA O 1 1 6 3077 1 1 36 PRO C C -13.988 5.191 5.893 1.00 . A A . 36 PRO C 1 1 6 3078 1 1 36 PRO CA C -12.708 4.536 6.431 1.00 . A A . 36 PRO CA 1 1 6 3079 1 1 36 PRO CB C -12.614 4.679 7.950 1.00 . A A . 36 PRO CB 1 1 6 3080 1 1 36 PRO CD C -10.842 6.016 7.006 1.00 . A A . 36 PRO CD 1 1 6 3081 1 1 36 PRO CG C -11.791 5.906 8.172 1.00 . A A . 36 PRO CG 1 1 6 3082 1 1 36 PRO HA H -12.668 3.494 6.159 1.00 . A A . 36 PRO HA 1 1 6 3083 1 1 36 PRO HB2 H -13.601 4.804 8.374 1.00 . A A . 36 PRO HB2 1 1 6 3084 1 1 36 PRO HB3 H -12.122 3.822 8.380 1.00 . A A . 36 PRO HB3 1 1 6 3085 1 1 36 PRO HD2 H -10.718 7.051 6.716 1.00 . A A . 36 PRO HD2 1 1 6 3086 1 1 36 PRO HD3 H -9.890 5.571 7.247 1.00 . A A . 36 PRO HD3 1 1 6 3087 1 1 36 PRO HG2 H -12.430 6.777 8.214 1.00 . A A . 36 PRO HG2 1 1 6 3088 1 1 36 PRO HG3 H -11.229 5.814 9.088 1.00 . A A . 36 PRO HG3 1 1 6 3089 1 1 36 PRO N N -11.501 5.251 5.935 1.00 . A A . 36 PRO N 1 1 6 3090 1 1 36 PRO O O -14.857 4.461 5.444 1.00 . A A . 36 PRO O 1 1 7 3091 1 1 1 ASP C C 13.233 1.902 0.114 1.00 . A A . 1 ASP C 1 1 7 3092 1 1 1 ASP CA C 14.617 2.142 0.735 1.00 . A A . 1 ASP CA 1 1 7 3093 1 1 1 ASP CB C 15.693 1.356 -0.024 1.00 . A A . 1 ASP CB 1 1 7 3094 1 1 1 ASP CG C 16.953 2.216 -0.169 1.00 . A A . 1 ASP CG 1 1 7 3095 1 1 1 ASP H1 H 15.579 1.847 2.563 1.00 . A A . 1 ASP H1 1 1 7 3096 1 1 1 ASP H2 H 14.532 0.583 2.121 1.00 . A A . 1 ASP H2 1 1 7 3097 1 1 1 ASP H3 H 13.900 2.053 2.693 1.00 . A A . 1 ASP H3 1 1 7 3098 1 1 1 ASP HA H 14.854 3.195 0.724 1.00 . A A . 1 ASP HA 1 1 7 3099 1 1 1 ASP HB2 H 15.933 0.454 0.520 1.00 . A A . 1 ASP HB2 1 1 7 3100 1 1 1 ASP HB3 H 15.325 1.096 -1.005 1.00 . A A . 1 ASP HB3 1 1 7 3101 1 1 1 ASP N N 14.660 1.616 2.133 1.00 . A A . 1 ASP N 1 1 7 3102 1 1 1 ASP O O 12.361 1.310 0.726 1.00 . A A . 1 ASP O 1 1 7 3103 1 1 1 ASP OD1 O 17.048 2.935 -1.150 1.00 . A A . 1 ASP OD1 1 1 7 3104 1 1 1 ASP OD2 O 17.802 2.138 0.704 1.00 . A A . 1 ASP OD2 1 1 7 3105 1 1 2 GLY C C 10.991 3.516 -1.891 1.00 . A A . 2 GLY C 1 1 7 3106 1 1 2 GLY CA C 11.705 2.166 -1.766 1.00 . A A . 2 GLY CA 1 1 7 3107 1 1 2 GLY H H 13.745 2.834 -1.567 1.00 . A A . 2 GLY H 1 1 7 3108 1 1 2 GLY HA2 H 11.860 1.745 -2.749 1.00 . A A . 2 GLY HA2 1 1 7 3109 1 1 2 GLY HA3 H 11.097 1.496 -1.178 1.00 . A A . 2 GLY HA3 1 1 7 3110 1 1 2 GLY N N 13.027 2.360 -1.096 1.00 . A A . 2 GLY N 1 1 7 3111 1 1 2 GLY O O 10.988 4.314 -0.973 1.00 . A A . 2 GLY O 1 1 7 3112 1 1 3 GLU C C 8.193 4.931 -2.810 1.00 . A A . 3 GLU C 1 1 7 3113 1 1 3 GLU CA C 9.664 5.070 -3.221 1.00 . A A . 3 GLU CA 1 1 7 3114 1 1 3 GLU CB C 9.786 5.371 -4.721 1.00 . A A . 3 GLU CB 1 1 7 3115 1 1 3 GLU CD C 10.967 6.854 -6.353 1.00 . A A . 3 GLU CD 1 1 7 3116 1 1 3 GLU CG C 10.436 6.744 -4.921 1.00 . A A . 3 GLU CG 1 1 7 3117 1 1 3 GLU H H 10.401 3.110 -3.748 1.00 . A A . 3 GLU H 1 1 7 3118 1 1 3 GLU HA H 10.135 5.854 -2.649 1.00 . A A . 3 GLU HA 1 1 7 3119 1 1 3 GLU HB2 H 10.397 4.613 -5.191 1.00 . A A . 3 GLU HB2 1 1 7 3120 1 1 3 GLU HB3 H 8.805 5.372 -5.170 1.00 . A A . 3 GLU HB3 1 1 7 3121 1 1 3 GLU HG2 H 9.701 7.518 -4.748 1.00 . A A . 3 GLU HG2 1 1 7 3122 1 1 3 GLU HG3 H 11.254 6.862 -4.227 1.00 . A A . 3 GLU HG3 1 1 7 3123 1 1 3 GLU N N 10.384 3.772 -3.024 1.00 . A A . 3 GLU N 1 1 7 3124 1 1 3 GLU O O 7.806 3.967 -2.177 1.00 . A A . 3 GLU O 1 1 7 3125 1 1 3 GLU OE1 O 12.112 6.491 -6.570 1.00 . A A . 3 GLU OE1 1 1 7 3126 1 1 3 GLU OE2 O 10.220 7.299 -7.208 1.00 . A A . 3 GLU OE2 1 1 7 3127 1 1 4 CYS C C 5.138 5.055 -3.860 1.00 . A A . 4 CYS C 1 1 7 3128 1 1 4 CYS CA C 5.927 5.813 -2.786 1.00 . A A . 4 CYS CA 1 1 7 3129 1 1 4 CYS CB C 5.459 7.275 -2.678 1.00 . A A . 4 CYS CB 1 1 7 3130 1 1 4 CYS H H 7.709 6.657 -3.669 1.00 . A A . 4 CYS H 1 1 7 3131 1 1 4 CYS HA H 5.817 5.325 -1.829 1.00 . A A . 4 CYS HA 1 1 7 3132 1 1 4 CYS HB2 H 4.911 7.406 -1.760 1.00 . A A . 4 CYS HB2 1 1 7 3133 1 1 4 CYS HB3 H 6.322 7.927 -2.672 1.00 . A A . 4 CYS HB3 1 1 7 3134 1 1 4 CYS N N 7.372 5.888 -3.162 1.00 . A A . 4 CYS N 1 1 7 3135 1 1 4 CYS O O 5.495 5.048 -5.025 1.00 . A A . 4 CYS O 1 1 7 3136 1 1 4 CYS SG S 4.390 7.709 -4.081 1.00 . A A . 4 CYS SG 1 1 7 3137 1 1 5 GLY C C 2.259 4.589 -5.143 1.00 . A A . 5 GLY C 1 1 7 3138 1 1 5 GLY CA C 3.243 3.646 -4.443 1.00 . A A . 5 GLY CA 1 1 7 3139 1 1 5 GLY H H 3.811 4.436 -2.524 1.00 . A A . 5 GLY H 1 1 7 3140 1 1 5 GLY HA2 H 3.888 3.186 -5.175 1.00 . A A . 5 GLY HA2 1 1 7 3141 1 1 5 GLY HA3 H 2.690 2.881 -3.920 1.00 . A A . 5 GLY HA3 1 1 7 3142 1 1 5 GLY N N 4.069 4.414 -3.467 1.00 . A A . 5 GLY N 1 1 7 3143 1 1 5 GLY O O 2.620 5.670 -5.572 1.00 . A A . 5 GLY O 1 1 7 3144 1 1 6 GLY C C -1.366 4.830 -5.277 1.00 . A A . 6 GLY C 1 1 7 3145 1 1 6 GLY CA C 0.004 5.044 -5.938 1.00 . A A . 6 GLY CA 1 1 7 3146 1 1 6 GLY H H 0.761 3.307 -4.916 1.00 . A A . 6 GLY H 1 1 7 3147 1 1 6 GLY HA2 H 0.296 6.081 -5.846 1.00 . A A . 6 GLY HA2 1 1 7 3148 1 1 6 GLY HA3 H -0.056 4.778 -6.982 1.00 . A A . 6 GLY HA3 1 1 7 3149 1 1 6 GLY N N 1.022 4.183 -5.266 1.00 . A A . 6 GLY N 1 1 7 3150 1 1 6 GLY O O -1.457 4.582 -4.090 1.00 . A A . 6 GLY O 1 1 7 3151 1 1 7 PHE C C -4.103 3.244 -5.224 1.00 . A A . 7 PHE C 1 1 7 3152 1 1 7 PHE CA C -3.799 4.733 -5.454 1.00 . A A . 7 PHE CA 1 1 7 3153 1 1 7 PHE CB C -4.760 5.323 -6.494 1.00 . A A . 7 PHE CB 1 1 7 3154 1 1 7 PHE CD1 C -6.072 7.048 -5.200 1.00 . A A . 7 PHE CD1 1 1 7 3155 1 1 7 PHE CD2 C -7.159 4.965 -5.803 1.00 . A A . 7 PHE CD2 1 1 7 3156 1 1 7 PHE CE1 C -7.248 7.482 -4.577 1.00 . A A . 7 PHE CE1 1 1 7 3157 1 1 7 PHE CE2 C -8.336 5.400 -5.178 1.00 . A A . 7 PHE CE2 1 1 7 3158 1 1 7 PHE CG C -6.028 5.790 -5.814 1.00 . A A . 7 PHE CG 1 1 7 3159 1 1 7 PHE CZ C -8.380 6.657 -4.565 1.00 . A A . 7 PHE CZ 1 1 7 3160 1 1 7 PHE H H -2.329 5.126 -6.992 1.00 . A A . 7 PHE H 1 1 7 3161 1 1 7 PHE HA H -3.888 5.271 -4.526 1.00 . A A . 7 PHE HA 1 1 7 3162 1 1 7 PHE HB2 H -4.287 6.161 -6.984 1.00 . A A . 7 PHE HB2 1 1 7 3163 1 1 7 PHE HB3 H -5.003 4.569 -7.228 1.00 . A A . 7 PHE HB3 1 1 7 3164 1 1 7 PHE HD1 H -5.199 7.684 -5.208 1.00 . A A . 7 PHE HD1 1 1 7 3165 1 1 7 PHE HD2 H -7.127 3.996 -6.276 1.00 . A A . 7 PHE HD2 1 1 7 3166 1 1 7 PHE HE1 H -7.282 8.452 -4.101 1.00 . A A . 7 PHE HE1 1 1 7 3167 1 1 7 PHE HE2 H -9.209 4.765 -5.169 1.00 . A A . 7 PHE HE2 1 1 7 3168 1 1 7 PHE HZ H -9.286 6.992 -4.082 1.00 . A A . 7 PHE HZ 1 1 7 3169 1 1 7 PHE N N -2.430 4.925 -6.037 1.00 . A A . 7 PHE N 1 1 7 3170 1 1 7 PHE O O -4.841 2.893 -4.325 1.00 . A A . 7 PHE O 1 1 7 3171 1 1 8 TRP C C -2.632 0.085 -6.389 1.00 . A A . 8 TRP C 1 1 7 3172 1 1 8 TRP CA C -3.808 0.907 -5.843 1.00 . A A . 8 TRP CA 1 1 7 3173 1 1 8 TRP CB C -5.088 0.627 -6.640 1.00 . A A . 8 TRP CB 1 1 7 3174 1 1 8 TRP CD1 C -5.680 -1.535 -5.463 1.00 . A A . 8 TRP CD1 1 1 7 3175 1 1 8 TRP CD2 C -7.326 -0.007 -5.347 1.00 . A A . 8 TRP CD2 1 1 7 3176 1 1 8 TRP CE2 C -7.787 -1.153 -4.657 1.00 . A A . 8 TRP CE2 1 1 7 3177 1 1 8 TRP CE3 C -8.178 1.110 -5.420 1.00 . A A . 8 TRP CE3 1 1 7 3178 1 1 8 TRP CG C -5.986 -0.275 -5.849 1.00 . A A . 8 TRP CG 1 1 7 3179 1 1 8 TRP CH2 C -9.883 -0.072 -4.147 1.00 . A A . 8 TRP CH2 1 1 7 3180 1 1 8 TRP CZ2 C -9.048 -1.190 -4.063 1.00 . A A . 8 TRP CZ2 1 1 7 3181 1 1 8 TRP CZ3 C -9.450 1.076 -4.825 1.00 . A A . 8 TRP CZ3 1 1 7 3182 1 1 8 TRP H H -2.955 2.675 -6.746 1.00 . A A . 8 TRP H 1 1 7 3183 1 1 8 TRP HA H -3.968 0.683 -4.800 1.00 . A A . 8 TRP HA 1 1 7 3184 1 1 8 TRP HB2 H -5.600 1.558 -6.838 1.00 . A A . 8 TRP HB2 1 1 7 3185 1 1 8 TRP HB3 H -4.836 0.150 -7.576 1.00 . A A . 8 TRP HB3 1 1 7 3186 1 1 8 TRP HD1 H -4.755 -2.050 -5.675 1.00 . A A . 8 TRP HD1 1 1 7 3187 1 1 8 TRP HE1 H -6.785 -2.955 -4.369 1.00 . A A . 8 TRP HE1 1 1 7 3188 1 1 8 TRP HE3 H -7.854 2.000 -5.940 1.00 . A A . 8 TRP HE3 1 1 7 3189 1 1 8 TRP HH2 H -10.861 -0.093 -3.689 1.00 . A A . 8 TRP HH2 1 1 7 3190 1 1 8 TRP HZ2 H -9.378 -2.077 -3.543 1.00 . A A . 8 TRP HZ2 1 1 7 3191 1 1 8 TRP HZ3 H -10.095 1.938 -4.887 1.00 . A A . 8 TRP HZ3 1 1 7 3192 1 1 8 TRP N N -3.545 2.370 -6.026 1.00 . A A . 8 TRP N 1 1 7 3193 1 1 8 TRP NE1 N -6.748 -2.058 -4.758 1.00 . A A . 8 TRP NE1 1 1 7 3194 1 1 8 TRP O O -2.730 -0.551 -7.422 1.00 . A A . 8 TRP O 1 1 7 3195 1 1 9 TRP C C -0.216 -1.980 -5.344 1.00 . A A . 9 TRP C 1 1 7 3196 1 1 9 TRP CA C -0.332 -0.692 -6.162 1.00 . A A . 9 TRP CA 1 1 7 3197 1 1 9 TRP CB C 0.880 0.212 -5.907 1.00 . A A . 9 TRP CB 1 1 7 3198 1 1 9 TRP CD1 C -0.187 1.931 -7.444 1.00 . A A . 9 TRP CD1 1 1 7 3199 1 1 9 TRP CD2 C 2.054 2.086 -7.386 1.00 . A A . 9 TRP CD2 1 1 7 3200 1 1 9 TRP CE2 C 1.596 3.099 -8.261 1.00 . A A . 9 TRP CE2 1 1 7 3201 1 1 9 TRP CE3 C 3.440 1.970 -7.175 1.00 . A A . 9 TRP CE3 1 1 7 3202 1 1 9 TRP CG C 0.901 1.358 -6.876 1.00 . A A . 9 TRP CG 1 1 7 3203 1 1 9 TRP CH2 C 3.850 3.838 -8.682 1.00 . A A . 9 TRP CH2 1 1 7 3204 1 1 9 TRP CZ2 C 2.476 3.964 -8.902 1.00 . A A . 9 TRP CZ2 1 1 7 3205 1 1 9 TRP CZ3 C 4.330 2.842 -7.823 1.00 . A A . 9 TRP CZ3 1 1 7 3206 1 1 9 TRP H H -1.469 0.609 -4.860 1.00 . A A . 9 TRP H 1 1 7 3207 1 1 9 TRP HA H -0.414 -0.915 -7.213 1.00 . A A . 9 TRP HA 1 1 7 3208 1 1 9 TRP HB2 H 0.831 0.599 -4.900 1.00 . A A . 9 TRP HB2 1 1 7 3209 1 1 9 TRP HB3 H 1.784 -0.367 -6.020 1.00 . A A . 9 TRP HB3 1 1 7 3210 1 1 9 TRP HD1 H -1.210 1.633 -7.284 1.00 . A A . 9 TRP HD1 1 1 7 3211 1 1 9 TRP HE1 H -0.366 3.537 -8.791 1.00 . A A . 9 TRP HE1 1 1 7 3212 1 1 9 TRP HE3 H 3.822 1.205 -6.516 1.00 . A A . 9 TRP HE3 1 1 7 3213 1 1 9 TRP HH2 H 4.539 4.505 -9.177 1.00 . A A . 9 TRP HH2 1 1 7 3214 1 1 9 TRP HZ2 H 2.097 4.732 -9.556 1.00 . A A . 9 TRP HZ2 1 1 7 3215 1 1 9 TRP HZ3 H 5.392 2.746 -7.653 1.00 . A A . 9 TRP HZ3 1 1 7 3216 1 1 9 TRP N N -1.522 0.092 -5.693 1.00 . A A . 9 TRP N 1 1 7 3217 1 1 9 TRP NE1 N 0.227 2.961 -8.264 1.00 . A A . 9 TRP NE1 1 1 7 3218 1 1 9 TRP O O -0.958 -2.189 -4.407 1.00 . A A . 9 TRP O 1 1 7 3219 1 1 10 LYS C C 1.815 -3.909 -3.732 1.00 . A A . 10 LYS C 1 1 7 3220 1 1 10 LYS CA C 0.853 -4.115 -4.900 1.00 . A A . 10 LYS CA 1 1 7 3221 1 1 10 LYS CB C 1.425 -5.144 -5.873 1.00 . A A . 10 LYS CB 1 1 7 3222 1 1 10 LYS CD C 0.193 -6.042 -7.863 1.00 . A A . 10 LYS CD 1 1 7 3223 1 1 10 LYS CE C -0.218 -7.422 -8.392 1.00 . A A . 10 LYS CE 1 1 7 3224 1 1 10 LYS CG C 0.309 -6.087 -6.336 1.00 . A A . 10 LYS CG 1 1 7 3225 1 1 10 LYS H H 1.304 -2.661 -6.436 1.00 . A A . 10 LYS H 1 1 7 3226 1 1 10 LYS HA H -0.110 -4.443 -4.539 1.00 . A A . 10 LYS HA 1 1 7 3227 1 1 10 LYS HB2 H 1.854 -4.636 -6.723 1.00 . A A . 10 LYS HB2 1 1 7 3228 1 1 10 LYS HB3 H 2.194 -5.718 -5.373 1.00 . A A . 10 LYS HB3 1 1 7 3229 1 1 10 LYS HD2 H -0.552 -5.312 -8.146 1.00 . A A . 10 LYS HD2 1 1 7 3230 1 1 10 LYS HD3 H 1.146 -5.766 -8.290 1.00 . A A . 10 LYS HD3 1 1 7 3231 1 1 10 LYS HE2 H -0.046 -7.478 -9.459 1.00 . A A . 10 LYS HE2 1 1 7 3232 1 1 10 LYS HE3 H 0.329 -8.198 -7.881 1.00 . A A . 10 LYS HE3 1 1 7 3233 1 1 10 LYS HG2 H 0.539 -7.095 -6.023 1.00 . A A . 10 LYS HG2 1 1 7 3234 1 1 10 LYS HG3 H -0.627 -5.778 -5.899 1.00 . A A . 10 LYS HG3 1 1 7 3235 1 1 10 LYS HZ1 H -2.050 -8.403 -8.536 1.00 . A A . 10 LYS HZ1 1 1 7 3236 1 1 10 LYS HZ2 H -2.177 -6.711 -8.471 1.00 . A A . 10 LYS HZ2 1 1 7 3237 1 1 10 LYS HZ3 H -1.817 -7.594 -7.063 1.00 . A A . 10 LYS HZ3 1 1 7 3238 1 1 10 LYS N N 0.708 -2.846 -5.680 1.00 . A A . 10 LYS N 1 1 7 3239 1 1 10 LYS NZ N -1.675 -7.541 -8.093 1.00 . A A . 10 LYS NZ 1 1 7 3240 1 1 10 LYS O O 2.773 -3.164 -3.826 1.00 . A A . 10 LYS O 1 1 7 3241 1 1 11 CYS C C 2.454 -5.683 -0.599 1.00 . A A . 11 CYS C 1 1 7 3242 1 1 11 CYS CA C 2.458 -4.411 -1.448 1.00 . A A . 11 CYS CA 1 1 7 3243 1 1 11 CYS CB C 1.865 -3.239 -0.664 1.00 . A A . 11 CYS CB 1 1 7 3244 1 1 11 CYS H H 0.786 -5.158 -2.577 1.00 . A A . 11 CYS H 1 1 7 3245 1 1 11 CYS HA H 3.457 -4.174 -1.773 1.00 . A A . 11 CYS HA 1 1 7 3246 1 1 11 CYS HB2 H 1.919 -2.345 -1.262 1.00 . A A . 11 CYS HB2 1 1 7 3247 1 1 11 CYS HB3 H 0.834 -3.456 -0.432 1.00 . A A . 11 CYS HB3 1 1 7 3248 1 1 11 CYS N N 1.563 -4.563 -2.629 1.00 . A A . 11 CYS N 1 1 7 3249 1 1 11 CYS O O 1.545 -6.490 -0.675 1.00 . A A . 11 CYS O 1 1 7 3250 1 1 11 CYS SG S 2.786 -2.987 0.875 1.00 . A A . 11 CYS SG 1 1 7 3251 1 1 12 GLY C C 2.972 -6.697 2.480 1.00 . A A . 12 GLY C 1 1 7 3252 1 1 12 GLY CA C 3.515 -7.059 1.098 1.00 . A A . 12 GLY CA 1 1 7 3253 1 1 12 GLY H H 4.167 -5.179 0.271 1.00 . A A . 12 GLY H 1 1 7 3254 1 1 12 GLY HA2 H 2.916 -7.848 0.666 1.00 . A A . 12 GLY HA2 1 1 7 3255 1 1 12 GLY HA3 H 4.538 -7.388 1.190 1.00 . A A . 12 GLY HA3 1 1 7 3256 1 1 12 GLY N N 3.457 -5.854 0.222 1.00 . A A . 12 GLY N 1 1 7 3257 1 1 12 GLY O O 1.860 -6.219 2.610 1.00 . A A . 12 GLY O 1 1 7 3258 1 1 13 ARG C C 3.638 -5.109 5.210 1.00 . A A . 13 ARG C 1 1 7 3259 1 1 13 ARG CA C 3.276 -6.562 4.889 1.00 . A A . 13 ARG CA 1 1 7 3260 1 1 13 ARG CB C 4.007 -7.529 5.824 1.00 . A A . 13 ARG CB 1 1 7 3261 1 1 13 ARG CD C 3.397 -6.681 8.099 1.00 . A A . 13 ARG CD 1 1 7 3262 1 1 13 ARG CG C 3.152 -7.789 7.069 1.00 . A A . 13 ARG CG 1 1 7 3263 1 1 13 ARG CZ C 4.225 -7.310 10.291 1.00 . A A . 13 ARG CZ 1 1 7 3264 1 1 13 ARG H H 4.643 -7.287 3.382 1.00 . A A . 13 ARG H 1 1 7 3265 1 1 13 ARG HA H 2.214 -6.703 4.966 1.00 . A A . 13 ARG HA 1 1 7 3266 1 1 13 ARG HB2 H 4.185 -8.463 5.309 1.00 . A A . 13 ARG HB2 1 1 7 3267 1 1 13 ARG HB3 H 4.951 -7.097 6.123 1.00 . A A . 13 ARG HB3 1 1 7 3268 1 1 13 ARG HD2 H 4.394 -6.280 7.988 1.00 . A A . 13 ARG HD2 1 1 7 3269 1 1 13 ARG HD3 H 2.662 -5.900 7.990 1.00 . A A . 13 ARG HD3 1 1 7 3270 1 1 13 ARG HE H 2.407 -7.802 9.653 1.00 . A A . 13 ARG HE 1 1 7 3271 1 1 13 ARG HG2 H 2.108 -7.800 6.791 1.00 . A A . 13 ARG HG2 1 1 7 3272 1 1 13 ARG HG3 H 3.420 -8.742 7.497 1.00 . A A . 13 ARG HG3 1 1 7 3273 1 1 13 ARG HH11 H 4.055 -5.343 10.640 1.00 . A A . 13 ARG HH11 1 1 7 3274 1 1 13 ARG HH12 H 5.304 -6.154 11.523 1.00 . A A . 13 ARG HH12 1 1 7 3275 1 1 13 ARG HH21 H 4.625 -9.271 10.143 1.00 . A A . 13 ARG HH21 1 1 7 3276 1 1 13 ARG HH22 H 5.628 -8.383 11.241 1.00 . A A . 13 ARG HH22 1 1 7 3277 1 1 13 ARG N N 3.747 -6.909 3.512 1.00 . A A . 13 ARG N 1 1 7 3278 1 1 13 ARG NE N 3.244 -7.344 9.426 1.00 . A A . 13 ARG NE 1 1 7 3279 1 1 13 ARG NH1 N 4.554 -6.181 10.863 1.00 . A A . 13 ARG NH1 1 1 7 3280 1 1 13 ARG NH2 N 4.876 -8.407 10.581 1.00 . A A . 13 ARG NH2 1 1 7 3281 1 1 13 ARG O O 2.877 -4.394 5.835 1.00 . A A . 13 ARG O 1 1 7 3282 1 1 14 GLY C C 6.514 -2.984 4.270 1.00 . A A . 14 GLY C 1 1 7 3283 1 1 14 GLY CA C 5.218 -3.268 5.033 1.00 . A A . 14 GLY CA 1 1 7 3284 1 1 14 GLY H H 5.374 -5.276 4.271 1.00 . A A . 14 GLY H 1 1 7 3285 1 1 14 GLY HA2 H 4.444 -2.590 4.698 1.00 . A A . 14 GLY HA2 1 1 7 3286 1 1 14 GLY HA3 H 5.387 -3.127 6.089 1.00 . A A . 14 GLY HA3 1 1 7 3287 1 1 14 GLY N N 4.790 -4.673 4.776 1.00 . A A . 14 GLY N 1 1 7 3288 1 1 14 GLY O O 7.378 -2.272 4.748 1.00 . A A . 14 GLY O 1 1 7 3289 1 1 15 LYS C C 7.755 -2.055 1.408 1.00 . A A . 15 LYS C 1 1 7 3290 1 1 15 LYS CA C 7.908 -3.299 2.301 1.00 . A A . 15 LYS CA 1 1 7 3291 1 1 15 LYS CB C 8.123 -4.574 1.478 1.00 . A A . 15 LYS CB 1 1 7 3292 1 1 15 LYS CD C 9.865 -6.325 1.078 1.00 . A A . 15 LYS CD 1 1 7 3293 1 1 15 LYS CE C 11.377 -6.391 1.321 1.00 . A A . 15 LYS CE 1 1 7 3294 1 1 15 LYS CG C 9.210 -5.429 2.133 1.00 . A A . 15 LYS CG 1 1 7 3295 1 1 15 LYS H H 5.949 -4.111 2.723 1.00 . A A . 15 LYS H 1 1 7 3296 1 1 15 LYS HA H 8.737 -3.162 2.970 1.00 . A A . 15 LYS HA 1 1 7 3297 1 1 15 LYS HB2 H 7.200 -5.136 1.436 1.00 . A A . 15 LYS HB2 1 1 7 3298 1 1 15 LYS HB3 H 8.428 -4.310 0.476 1.00 . A A . 15 LYS HB3 1 1 7 3299 1 1 15 LYS HD2 H 9.444 -7.319 1.141 1.00 . A A . 15 LYS HD2 1 1 7 3300 1 1 15 LYS HD3 H 9.678 -5.920 0.094 1.00 . A A . 15 LYS HD3 1 1 7 3301 1 1 15 LYS HE2 H 11.873 -6.825 0.464 1.00 . A A . 15 LYS HE2 1 1 7 3302 1 1 15 LYS HE3 H 11.767 -5.407 1.524 1.00 . A A . 15 LYS HE3 1 1 7 3303 1 1 15 LYS HG2 H 9.958 -4.784 2.572 1.00 . A A . 15 LYS HG2 1 1 7 3304 1 1 15 LYS HG3 H 8.769 -6.044 2.902 1.00 . A A . 15 LYS HG3 1 1 7 3305 1 1 15 LYS HZ1 H 12.546 -7.528 2.616 1.00 . A A . 15 LYS HZ1 1 1 7 3306 1 1 15 LYS HZ2 H 10.970 -8.125 2.406 1.00 . A A . 15 LYS HZ2 1 1 7 3307 1 1 15 LYS HZ3 H 11.241 -6.752 3.371 1.00 . A A . 15 LYS HZ3 1 1 7 3308 1 1 15 LYS N N 6.660 -3.536 3.088 1.00 . A A . 15 LYS N 1 1 7 3309 1 1 15 LYS NZ N 11.545 -7.265 2.519 1.00 . A A . 15 LYS NZ 1 1 7 3310 1 1 15 LYS O O 8.389 -1.050 1.664 1.00 . A A . 15 LYS O 1 1 7 3311 1 1 16 PRO C C 5.773 0.034 0.168 1.00 . A A . 16 PRO C 1 1 7 3312 1 1 16 PRO CA C 6.692 -0.993 -0.510 1.00 . A A . 16 PRO CA 1 1 7 3313 1 1 16 PRO CB C 6.010 -1.615 -1.725 1.00 . A A . 16 PRO CB 1 1 7 3314 1 1 16 PRO CD C 6.114 -3.312 0.007 1.00 . A A . 16 PRO CD 1 1 7 3315 1 1 16 PRO CG C 5.351 -2.856 -1.211 1.00 . A A . 16 PRO CG 1 1 7 3316 1 1 16 PRO HA H 7.628 -0.545 -0.798 1.00 . A A . 16 PRO HA 1 1 7 3317 1 1 16 PRO HB2 H 5.272 -0.934 -2.127 1.00 . A A . 16 PRO HB2 1 1 7 3318 1 1 16 PRO HB3 H 6.739 -1.869 -2.477 1.00 . A A . 16 PRO HB3 1 1 7 3319 1 1 16 PRO HD2 H 5.433 -3.585 0.802 1.00 . A A . 16 PRO HD2 1 1 7 3320 1 1 16 PRO HD3 H 6.760 -4.138 -0.241 1.00 . A A . 16 PRO HD3 1 1 7 3321 1 1 16 PRO HG2 H 4.325 -2.642 -0.946 1.00 . A A . 16 PRO HG2 1 1 7 3322 1 1 16 PRO HG3 H 5.380 -3.626 -1.966 1.00 . A A . 16 PRO HG3 1 1 7 3323 1 1 16 PRO N N 6.916 -2.148 0.397 1.00 . A A . 16 PRO N 1 1 7 3324 1 1 16 PRO O O 4.611 -0.241 0.405 1.00 . A A . 16 PRO O 1 1 7 3325 1 1 17 PRO C C 4.618 2.954 0.131 1.00 . A A . 17 PRO C 1 1 7 3326 1 1 17 PRO CA C 5.539 2.248 1.135 1.00 . A A . 17 PRO CA 1 1 7 3327 1 1 17 PRO CB C 6.607 3.205 1.662 1.00 . A A . 17 PRO CB 1 1 7 3328 1 1 17 PRO CD C 7.715 1.600 0.218 1.00 . A A . 17 PRO CD 1 1 7 3329 1 1 17 PRO CG C 7.797 2.998 0.778 1.00 . A A . 17 PRO CG 1 1 7 3330 1 1 17 PRO HA H 4.969 1.843 1.955 1.00 . A A . 17 PRO HA 1 1 7 3331 1 1 17 PRO HB2 H 6.259 4.228 1.593 1.00 . A A . 17 PRO HB2 1 1 7 3332 1 1 17 PRO HB3 H 6.858 2.963 2.682 1.00 . A A . 17 PRO HB3 1 1 7 3333 1 1 17 PRO HD2 H 7.924 1.608 -0.844 1.00 . A A . 17 PRO HD2 1 1 7 3334 1 1 17 PRO HD3 H 8.397 0.944 0.734 1.00 . A A . 17 PRO HD3 1 1 7 3335 1 1 17 PRO HG2 H 7.785 3.721 -0.024 1.00 . A A . 17 PRO HG2 1 1 7 3336 1 1 17 PRO HG3 H 8.704 3.104 1.353 1.00 . A A . 17 PRO HG3 1 1 7 3337 1 1 17 PRO N N 6.326 1.184 0.466 1.00 . A A . 17 PRO N 1 1 7 3338 1 1 17 PRO O O 5.079 3.592 -0.795 1.00 . A A . 17 PRO O 1 1 7 3339 1 1 18 CYS C C 2.499 5.056 -0.434 1.00 . A A . 18 CYS C 1 1 7 3340 1 1 18 CYS CA C 2.374 3.539 -0.619 1.00 . A A . 18 CYS CA 1 1 7 3341 1 1 18 CYS CB C 0.970 3.059 -0.228 1.00 . A A . 18 CYS CB 1 1 7 3342 1 1 18 CYS H H 2.976 2.343 1.076 1.00 . A A . 18 CYS H 1 1 7 3343 1 1 18 CYS HA H 2.589 3.264 -1.640 1.00 . A A . 18 CYS HA 1 1 7 3344 1 1 18 CYS HB2 H 1.044 2.150 0.346 1.00 . A A . 18 CYS HB2 1 1 7 3345 1 1 18 CYS HB3 H 0.487 3.820 0.368 1.00 . A A . 18 CYS HB3 1 1 7 3346 1 1 18 CYS N N 3.322 2.854 0.318 1.00 . A A . 18 CYS N 1 1 7 3347 1 1 18 CYS O O 2.946 5.523 0.598 1.00 . A A . 18 CYS O 1 1 7 3348 1 1 18 CYS SG S -0.011 2.757 -1.723 1.00 . A A . 18 CYS SG 1 1 7 3349 1 1 19 CYS C C 1.391 7.818 -0.109 1.00 . A A . 19 CYS C 1 1 7 3350 1 1 19 CYS CA C 2.241 7.317 -1.284 1.00 . A A . 19 CYS CA 1 1 7 3351 1 1 19 CYS CB C 1.742 7.893 -2.611 1.00 . A A . 19 CYS CB 1 1 7 3352 1 1 19 CYS H H 1.773 5.437 -2.246 1.00 . A A . 19 CYS H 1 1 7 3353 1 1 19 CYS HA H 3.273 7.591 -1.134 1.00 . A A . 19 CYS HA 1 1 7 3354 1 1 19 CYS HB2 H 1.534 7.090 -3.301 1.00 . A A . 19 CYS HB2 1 1 7 3355 1 1 19 CYS HB3 H 0.841 8.465 -2.442 1.00 . A A . 19 CYS HB3 1 1 7 3356 1 1 19 CYS N N 2.123 5.831 -1.419 1.00 . A A . 19 CYS N 1 1 7 3357 1 1 19 CYS O O 0.416 7.197 0.269 1.00 . A A . 19 CYS O 1 1 7 3358 1 1 19 CYS SG S 3.018 8.976 -3.307 1.00 . A A . 19 CYS SG 1 1 7 3359 1 1 20 LYS C C -0.496 9.455 1.389 1.00 . A A . 20 LYS C 1 1 7 3360 1 1 20 LYS CA C 1.017 9.487 1.647 1.00 . A A . 20 LYS CA 1 1 7 3361 1 1 20 LYS CB C 1.505 10.933 1.793 1.00 . A A . 20 LYS CB 1 1 7 3362 1 1 20 LYS CD C 3.718 11.950 2.388 1.00 . A A . 20 LYS CD 1 1 7 3363 1 1 20 LYS CE C 4.749 11.168 1.567 1.00 . A A . 20 LYS CE 1 1 7 3364 1 1 20 LYS CG C 2.608 11.003 2.855 1.00 . A A . 20 LYS CG 1 1 7 3365 1 1 20 LYS H H 2.575 9.396 0.158 1.00 . A A . 20 LYS H 1 1 7 3366 1 1 20 LYS HA H 1.256 8.932 2.538 1.00 . A A . 20 LYS HA 1 1 7 3367 1 1 20 LYS HB2 H 1.894 11.279 0.846 1.00 . A A . 20 LYS HB2 1 1 7 3368 1 1 20 LYS HB3 H 0.680 11.562 2.093 1.00 . A A . 20 LYS HB3 1 1 7 3369 1 1 20 LYS HD2 H 3.291 12.733 1.778 1.00 . A A . 20 LYS HD2 1 1 7 3370 1 1 20 LYS HD3 H 4.205 12.388 3.247 1.00 . A A . 20 LYS HD3 1 1 7 3371 1 1 20 LYS HE2 H 5.315 10.507 2.208 1.00 . A A . 20 LYS HE2 1 1 7 3372 1 1 20 LYS HE3 H 4.261 10.606 0.785 1.00 . A A . 20 LYS HE3 1 1 7 3373 1 1 20 LYS HG2 H 2.191 11.368 3.782 1.00 . A A . 20 LYS HG2 1 1 7 3374 1 1 20 LYS HG3 H 3.020 10.016 3.012 1.00 . A A . 20 LYS HG3 1 1 7 3375 1 1 20 LYS HZ1 H 6.111 12.738 1.727 1.00 . A A . 20 LYS HZ1 1 1 7 3376 1 1 20 LYS HZ2 H 5.076 12.852 0.384 1.00 . A A . 20 LYS HZ2 1 1 7 3377 1 1 20 LYS HZ3 H 6.362 11.740 0.378 1.00 . A A . 20 LYS HZ3 1 1 7 3378 1 1 20 LYS N N 1.775 8.931 0.479 1.00 . A A . 20 LYS N 1 1 7 3379 1 1 20 LYS NZ N 5.641 12.202 0.969 1.00 . A A . 20 LYS NZ 1 1 7 3380 1 1 20 LYS O O -0.971 9.931 0.374 1.00 . A A . 20 LYS O 1 1 7 3381 1 1 21 GLY C C -3.147 7.368 1.833 1.00 . A A . 21 GLY C 1 1 7 3382 1 1 21 GLY CA C -2.731 8.815 2.119 1.00 . A A . 21 GLY CA 1 1 7 3383 1 1 21 GLY H H -0.839 8.512 3.107 1.00 . A A . 21 GLY H 1 1 7 3384 1 1 21 GLY HA2 H -3.220 9.160 3.018 1.00 . A A . 21 GLY HA2 1 1 7 3385 1 1 21 GLY HA3 H -3.024 9.441 1.289 1.00 . A A . 21 GLY HA3 1 1 7 3386 1 1 21 GLY N N -1.249 8.892 2.301 1.00 . A A . 21 GLY N 1 1 7 3387 1 1 21 GLY O O -4.248 6.961 2.148 1.00 . A A . 21 GLY O 1 1 7 3388 1 1 22 TYR C C -1.919 4.227 1.896 1.00 . A A . 22 TYR C 1 1 7 3389 1 1 22 TYR CA C -2.620 5.174 0.913 1.00 . A A . 22 TYR CA 1 1 7 3390 1 1 22 TYR CB C -2.108 4.930 -0.518 1.00 . A A . 22 TYR CB 1 1 7 3391 1 1 22 TYR CD1 C -3.636 6.731 -1.419 1.00 . A A . 22 TYR CD1 1 1 7 3392 1 1 22 TYR CD2 C -1.342 6.657 -2.191 1.00 . A A . 22 TYR CD2 1 1 7 3393 1 1 22 TYR CE1 C -3.875 7.845 -2.234 1.00 . A A . 22 TYR CE1 1 1 7 3394 1 1 22 TYR CE2 C -1.580 7.770 -3.004 1.00 . A A . 22 TYR CE2 1 1 7 3395 1 1 22 TYR CG C -2.370 6.136 -1.398 1.00 . A A . 22 TYR CG 1 1 7 3396 1 1 22 TYR CZ C -2.846 8.364 -3.027 1.00 . A A . 22 TYR CZ 1 1 7 3397 1 1 22 TYR H H -1.400 6.943 0.978 1.00 . A A . 22 TYR H 1 1 7 3398 1 1 22 TYR HA H -3.689 5.029 0.950 1.00 . A A . 22 TYR HA 1 1 7 3399 1 1 22 TYR HB2 H -1.045 4.739 -0.486 1.00 . A A . 22 TYR HB2 1 1 7 3400 1 1 22 TYR HB3 H -2.611 4.069 -0.934 1.00 . A A . 22 TYR HB3 1 1 7 3401 1 1 22 TYR HD1 H -4.430 6.331 -0.806 1.00 . A A . 22 TYR HD1 1 1 7 3402 1 1 22 TYR HD2 H -0.365 6.200 -2.176 1.00 . A A . 22 TYR HD2 1 1 7 3403 1 1 22 TYR HE1 H -4.852 8.303 -2.250 1.00 . A A . 22 TYR HE1 1 1 7 3404 1 1 22 TYR HE2 H -0.785 8.172 -3.616 1.00 . A A . 22 TYR HE2 1 1 7 3405 1 1 22 TYR HH H -2.878 10.252 -3.321 1.00 . A A . 22 TYR HH 1 1 7 3406 1 1 22 TYR N N -2.278 6.592 1.229 1.00 . A A . 22 TYR N 1 1 7 3407 1 1 22 TYR O O -0.724 4.315 2.110 1.00 . A A . 22 TYR O 1 1 7 3408 1 1 22 TYR OH O -3.080 9.463 -3.829 1.00 . A A . 22 TYR OH 1 1 7 3409 1 1 23 ALA C C -1.828 1.002 2.745 1.00 . A A . 23 ALA C 1 1 7 3410 1 1 23 ALA CA C -2.038 2.351 3.443 1.00 . A A . 23 ALA CA 1 1 7 3411 1 1 23 ALA CB C -3.053 2.214 4.582 1.00 . A A . 23 ALA CB 1 1 7 3412 1 1 23 ALA H H -3.612 3.266 2.287 1.00 . A A . 23 ALA H 1 1 7 3413 1 1 23 ALA HA H -1.104 2.733 3.822 1.00 . A A . 23 ALA HA 1 1 7 3414 1 1 23 ALA HB1 H -2.546 1.881 5.477 1.00 . A A . 23 ALA HB1 1 1 7 3415 1 1 23 ALA HB2 H -3.807 1.492 4.306 1.00 . A A . 23 ALA HB2 1 1 7 3416 1 1 23 ALA HB3 H -3.520 3.169 4.767 1.00 . A A . 23 ALA HB3 1 1 7 3417 1 1 23 ALA N N -2.653 3.319 2.485 1.00 . A A . 23 ALA N 1 1 7 3418 1 1 23 ALA O O -2.584 0.625 1.870 1.00 . A A . 23 ALA O 1 1 7 3419 1 1 24 CYS C C -1.313 -2.162 3.220 1.00 . A A . 24 CYS C 1 1 7 3420 1 1 24 CYS CA C -0.559 -1.056 2.475 1.00 . A A . 24 CYS CA 1 1 7 3421 1 1 24 CYS CB C 0.957 -1.268 2.571 1.00 . A A . 24 CYS CB 1 1 7 3422 1 1 24 CYS H H -0.211 0.591 3.833 1.00 . A A . 24 CYS H 1 1 7 3423 1 1 24 CYS HA H -0.863 -1.027 1.441 1.00 . A A . 24 CYS HA 1 1 7 3424 1 1 24 CYS HB2 H 1.450 -0.672 1.820 1.00 . A A . 24 CYS HB2 1 1 7 3425 1 1 24 CYS HB3 H 1.297 -0.965 3.550 1.00 . A A . 24 CYS HB3 1 1 7 3426 1 1 24 CYS N N -0.810 0.270 3.123 1.00 . A A . 24 CYS N 1 1 7 3427 1 1 24 CYS O O -1.691 -2.006 4.368 1.00 . A A . 24 CYS O 1 1 7 3428 1 1 24 CYS SG S 1.361 -3.014 2.307 1.00 . A A . 24 CYS SG 1 1 7 3429 1 1 25 SER C C -1.721 -5.755 2.791 1.00 . A A . 25 SER C 1 1 7 3430 1 1 25 SER CA C -2.275 -4.396 3.226 1.00 . A A . 25 SER CA 1 1 7 3431 1 1 25 SER CB C -3.727 -4.241 2.768 1.00 . A A . 25 SER CB 1 1 7 3432 1 1 25 SER H H -1.224 -3.370 1.645 1.00 . A A . 25 SER H 1 1 7 3433 1 1 25 SER HA H -2.222 -4.299 4.293 1.00 . A A . 25 SER HA 1 1 7 3434 1 1 25 SER HB2 H -3.807 -3.415 2.082 1.00 . A A . 25 SER HB2 1 1 7 3435 1 1 25 SER HB3 H -4.045 -5.148 2.273 1.00 . A A . 25 SER HB3 1 1 7 3436 1 1 25 SER HG H -5.093 -3.224 3.707 1.00 . A A . 25 SER HG 1 1 7 3437 1 1 25 SER N N -1.539 -3.275 2.569 1.00 . A A . 25 SER N 1 1 7 3438 1 1 25 SER O O -1.727 -6.092 1.623 1.00 . A A . 25 SER O 1 1 7 3439 1 1 25 SER OG O -4.551 -3.991 3.900 1.00 . A A . 25 SER OG 1 1 7 3440 1 1 26 LYS C C -1.898 -8.848 3.094 1.00 . A A . 26 LYS C 1 1 7 3441 1 1 26 LYS CA C -0.729 -7.901 3.385 1.00 . A A . 26 LYS CA 1 1 7 3442 1 1 26 LYS CB C 0.046 -8.364 4.626 1.00 . A A . 26 LYS CB 1 1 7 3443 1 1 26 LYS CD C 1.936 -9.829 3.877 1.00 . A A . 26 LYS CD 1 1 7 3444 1 1 26 LYS CE C 2.026 -10.829 2.719 1.00 . A A . 26 LYS CE 1 1 7 3445 1 1 26 LYS CG C 0.511 -9.813 4.440 1.00 . A A . 26 LYS CG 1 1 7 3446 1 1 26 LYS H H -1.280 -6.255 4.668 1.00 . A A . 26 LYS H 1 1 7 3447 1 1 26 LYS HA H -0.071 -7.841 2.537 1.00 . A A . 26 LYS HA 1 1 7 3448 1 1 26 LYS HB2 H 0.904 -7.725 4.769 1.00 . A A . 26 LYS HB2 1 1 7 3449 1 1 26 LYS HB3 H -0.594 -8.303 5.493 1.00 . A A . 26 LYS HB3 1 1 7 3450 1 1 26 LYS HD2 H 2.192 -8.843 3.521 1.00 . A A . 26 LYS HD2 1 1 7 3451 1 1 26 LYS HD3 H 2.625 -10.120 4.655 1.00 . A A . 26 LYS HD3 1 1 7 3452 1 1 26 LYS HE2 H 1.188 -10.702 2.047 1.00 . A A . 26 LYS HE2 1 1 7 3453 1 1 26 LYS HE3 H 2.957 -10.704 2.187 1.00 . A A . 26 LYS HE3 1 1 7 3454 1 1 26 LYS HG2 H 0.494 -10.319 5.394 1.00 . A A . 26 LYS HG2 1 1 7 3455 1 1 26 LYS HG3 H -0.151 -10.318 3.753 1.00 . A A . 26 LYS HG3 1 1 7 3456 1 1 26 LYS HZ1 H 2.248 -12.900 2.660 1.00 . A A . 26 LYS HZ1 1 1 7 3457 1 1 26 LYS HZ2 H 1.015 -12.367 3.699 1.00 . A A . 26 LYS HZ2 1 1 7 3458 1 1 26 LYS HZ3 H 2.645 -12.209 4.157 1.00 . A A . 26 LYS HZ3 1 1 7 3459 1 1 26 LYS N N -1.261 -6.547 3.732 1.00 . A A . 26 LYS N 1 1 7 3460 1 1 26 LYS NZ N 1.980 -12.178 3.358 1.00 . A A . 26 LYS NZ 1 1 7 3461 1 1 26 LYS O O -1.857 -9.629 2.161 1.00 . A A . 26 LYS O 1 1 7 3462 1 1 27 THR C C -4.700 -9.400 2.257 1.00 . A A . 27 THR C 1 1 7 3463 1 1 27 THR CA C -4.136 -9.646 3.657 1.00 . A A . 27 THR CA 1 1 7 3464 1 1 27 THR CB C -5.157 -9.233 4.727 1.00 . A A . 27 THR CB 1 1 7 3465 1 1 27 THR CG2 C -6.355 -10.184 4.689 1.00 . A A . 27 THR CG2 1 1 7 3466 1 1 27 THR H H -2.947 -8.122 4.617 1.00 . A A . 27 THR H 1 1 7 3467 1 1 27 THR HA H -3.869 -10.684 3.781 1.00 . A A . 27 THR HA 1 1 7 3468 1 1 27 THR HB H -5.498 -8.227 4.527 1.00 . A A . 27 THR HB 1 1 7 3469 1 1 27 THR HG1 H -4.934 -8.583 6.547 1.00 . A A . 27 THR HG1 1 1 7 3470 1 1 27 THR HG21 H -7.231 -9.647 4.357 1.00 . A A . 27 THR HG21 1 1 7 3471 1 1 27 THR HG22 H -6.530 -10.582 5.678 1.00 . A A . 27 THR HG22 1 1 7 3472 1 1 27 THR HG23 H -6.150 -10.996 4.006 1.00 . A A . 27 THR HG23 1 1 7 3473 1 1 27 THR N N -2.943 -8.769 3.882 1.00 . A A . 27 THR N 1 1 7 3474 1 1 27 THR O O -5.138 -10.313 1.582 1.00 . A A . 27 THR O 1 1 7 3475 1 1 27 THR OG1 O -4.551 -9.283 6.011 1.00 . A A . 27 THR OG1 1 1 7 3476 1 1 28 TRP C C -4.077 -8.048 -0.575 1.00 . A A . 28 TRP C 1 1 7 3477 1 1 28 TRP CA C -5.195 -7.842 0.456 1.00 . A A . 28 TRP CA 1 1 7 3478 1 1 28 TRP CB C -5.604 -6.361 0.514 1.00 . A A . 28 TRP CB 1 1 7 3479 1 1 28 TRP CD1 C -7.267 -7.098 2.296 1.00 . A A . 28 TRP CD1 1 1 7 3480 1 1 28 TRP CD2 C -7.189 -4.862 2.045 1.00 . A A . 28 TRP CD2 1 1 7 3481 1 1 28 TRP CE2 C -8.141 -5.127 3.059 1.00 . A A . 28 TRP CE2 1 1 7 3482 1 1 28 TRP CE3 C -6.952 -3.520 1.694 1.00 . A A . 28 TRP CE3 1 1 7 3483 1 1 28 TRP CG C -6.645 -6.132 1.577 1.00 . A A . 28 TRP CG 1 1 7 3484 1 1 28 TRP CH2 C -8.585 -2.773 3.339 1.00 . A A . 28 TRP CH2 1 1 7 3485 1 1 28 TRP CZ2 C -8.831 -4.099 3.701 1.00 . A A . 28 TRP CZ2 1 1 7 3486 1 1 28 TRP CZ3 C -7.646 -2.483 2.338 1.00 . A A . 28 TRP CZ3 1 1 7 3487 1 1 28 TRP H H -4.309 -7.456 2.381 1.00 . A A . 28 TRP H 1 1 7 3488 1 1 28 TRP HA H -6.048 -8.456 0.217 1.00 . A A . 28 TRP HA 1 1 7 3489 1 1 28 TRP HB2 H -4.736 -5.761 0.732 1.00 . A A . 28 TRP HB2 1 1 7 3490 1 1 28 TRP HB3 H -6.006 -6.067 -0.444 1.00 . A A . 28 TRP HB3 1 1 7 3491 1 1 28 TRP HD1 H -7.098 -8.160 2.201 1.00 . A A . 28 TRP HD1 1 1 7 3492 1 1 28 TRP HE1 H -8.722 -6.978 3.813 1.00 . A A . 28 TRP HE1 1 1 7 3493 1 1 28 TRP HE3 H -6.233 -3.287 0.923 1.00 . A A . 28 TRP HE3 1 1 7 3494 1 1 28 TRP HH2 H -9.114 -1.973 3.831 1.00 . A A . 28 TRP HH2 1 1 7 3495 1 1 28 TRP HZ2 H -9.553 -4.327 4.472 1.00 . A A . 28 TRP HZ2 1 1 7 3496 1 1 28 TRP HZ3 H -7.457 -1.456 2.061 1.00 . A A . 28 TRP HZ3 1 1 7 3497 1 1 28 TRP N N -4.677 -8.169 1.816 1.00 . A A . 28 TRP N 1 1 7 3498 1 1 28 TRP NE1 N -8.150 -6.500 3.177 1.00 . A A . 28 TRP NE1 1 1 7 3499 1 1 28 TRP O O -4.313 -8.505 -1.678 1.00 . A A . 28 TRP O 1 1 7 3500 1 1 29 GLY C C -1.460 -6.592 -1.933 1.00 . A A . 29 GLY C 1 1 7 3501 1 1 29 GLY CA C -1.711 -7.888 -1.151 1.00 . A A . 29 GLY CA 1 1 7 3502 1 1 29 GLY H H -2.701 -7.354 0.681 1.00 . A A . 29 GLY H 1 1 7 3503 1 1 29 GLY HA2 H -0.827 -8.143 -0.586 1.00 . A A . 29 GLY HA2 1 1 7 3504 1 1 29 GLY HA3 H -1.933 -8.683 -1.846 1.00 . A A . 29 GLY HA3 1 1 7 3505 1 1 29 GLY N N -2.860 -7.715 -0.213 1.00 . A A . 29 GLY N 1 1 7 3506 1 1 29 GLY O O -0.772 -6.599 -2.937 1.00 . A A . 29 GLY O 1 1 7 3507 1 1 30 TRP C C -1.850 -2.994 -1.272 1.00 . A A . 30 TRP C 1 1 7 3508 1 1 30 TRP CA C -1.771 -4.195 -2.227 1.00 . A A . 30 TRP CA 1 1 7 3509 1 1 30 TRP CB C -2.870 -4.147 -3.308 1.00 . A A . 30 TRP CB 1 1 7 3510 1 1 30 TRP CD1 C -4.538 -2.591 -2.210 1.00 . A A . 30 TRP CD1 1 1 7 3511 1 1 30 TRP CD2 C -5.381 -4.644 -2.573 1.00 . A A . 30 TRP CD2 1 1 7 3512 1 1 30 TRP CE2 C -6.405 -3.885 -1.960 1.00 . A A . 30 TRP CE2 1 1 7 3513 1 1 30 TRP CE3 C -5.657 -5.981 -2.910 1.00 . A A . 30 TRP CE3 1 1 7 3514 1 1 30 TRP CG C -4.201 -3.799 -2.713 1.00 . A A . 30 TRP CG 1 1 7 3515 1 1 30 TRP CH2 C -7.919 -5.761 -2.037 1.00 . A A . 30 TRP CH2 1 1 7 3516 1 1 30 TRP CZ2 C -7.661 -4.431 -1.694 1.00 . A A . 30 TRP CZ2 1 1 7 3517 1 1 30 TRP CZ3 C -6.920 -6.534 -2.644 1.00 . A A . 30 TRP CZ3 1 1 7 3518 1 1 30 TRP H H -2.549 -5.482 -0.673 1.00 . A A . 30 TRP H 1 1 7 3519 1 1 30 TRP HA H -0.804 -4.217 -2.702 1.00 . A A . 30 TRP HA 1 1 7 3520 1 1 30 TRP HB2 H -2.613 -3.404 -4.045 1.00 . A A . 30 TRP HB2 1 1 7 3521 1 1 30 TRP HB3 H -2.936 -5.113 -3.788 1.00 . A A . 30 TRP HB3 1 1 7 3522 1 1 30 TRP HD1 H -3.892 -1.727 -2.162 1.00 . A A . 30 TRP HD1 1 1 7 3523 1 1 30 TRP HE1 H -6.321 -1.897 -1.344 1.00 . A A . 30 TRP HE1 1 1 7 3524 1 1 30 TRP HE3 H -4.892 -6.585 -3.377 1.00 . A A . 30 TRP HE3 1 1 7 3525 1 1 30 TRP HH2 H -8.888 -6.191 -1.834 1.00 . A A . 30 TRP HH2 1 1 7 3526 1 1 30 TRP HZ2 H -8.427 -3.831 -1.227 1.00 . A A . 30 TRP HZ2 1 1 7 3527 1 1 30 TRP HZ3 H -7.122 -7.561 -2.908 1.00 . A A . 30 TRP HZ3 1 1 7 3528 1 1 30 TRP N N -2.001 -5.476 -1.489 1.00 . A A . 30 TRP N 1 1 7 3529 1 1 30 TRP NE1 N -5.840 -2.641 -1.758 1.00 . A A . 30 TRP NE1 1 1 7 3530 1 1 30 TRP O O -2.122 -3.143 -0.097 1.00 . A A . 30 TRP O 1 1 7 3531 1 1 31 CYS C C -2.588 0.481 -1.576 1.00 . A A . 31 CYS C 1 1 7 3532 1 1 31 CYS CA C -1.707 -0.587 -0.911 1.00 . A A . 31 CYS CA 1 1 7 3533 1 1 31 CYS CB C -0.254 -0.105 -0.729 1.00 . A A . 31 CYS CB 1 1 7 3534 1 1 31 CYS H H -1.427 -1.710 -2.732 1.00 . A A . 31 CYS H 1 1 7 3535 1 1 31 CYS HA H -2.119 -0.851 0.050 1.00 . A A . 31 CYS HA 1 1 7 3536 1 1 31 CYS HB2 H -0.199 0.538 0.137 1.00 . A A . 31 CYS HB2 1 1 7 3537 1 1 31 CYS HB3 H 0.388 -0.960 -0.574 1.00 . A A . 31 CYS HB3 1 1 7 3538 1 1 31 CYS N N -1.630 -1.803 -1.778 1.00 . A A . 31 CYS N 1 1 7 3539 1 1 31 CYS O O -2.396 0.841 -2.725 1.00 . A A . 31 CYS O 1 1 7 3540 1 1 31 CYS SG S 0.315 0.813 -2.185 1.00 . A A . 31 CYS SG 1 1 7 3541 1 1 32 ALA C C -5.000 2.928 -0.302 1.00 . A A . 32 ALA C 1 1 7 3542 1 1 32 ALA CA C -4.491 2.008 -1.421 1.00 . A A . 32 ALA CA 1 1 7 3543 1 1 32 ALA CB C -5.648 1.211 -2.029 1.00 . A A . 32 ALA CB 1 1 7 3544 1 1 32 ALA H H -3.698 0.649 0.062 1.00 . A A . 32 ALA H 1 1 7 3545 1 1 32 ALA HA H -3.994 2.586 -2.189 1.00 . A A . 32 ALA HA 1 1 7 3546 1 1 32 ALA HB1 H -6.241 0.777 -1.237 1.00 . A A . 32 ALA HB1 1 1 7 3547 1 1 32 ALA HB2 H -5.253 0.426 -2.655 1.00 . A A . 32 ALA HB2 1 1 7 3548 1 1 32 ALA HB3 H -6.266 1.869 -2.622 1.00 . A A . 32 ALA HB3 1 1 7 3549 1 1 32 ALA N N -3.564 0.972 -0.856 1.00 . A A . 32 ALA N 1 1 7 3550 1 1 32 ALA O O -4.621 2.782 0.843 1.00 . A A . 32 ALA O 1 1 7 3551 1 1 33 VAL C C -7.114 4.009 1.525 1.00 . A A . 33 VAL C 1 1 7 3552 1 1 33 VAL CA C -6.377 4.802 0.438 1.00 . A A . 33 VAL CA 1 1 7 3553 1 1 33 VAL CB C -7.355 5.759 -0.262 1.00 . A A . 33 VAL CB 1 1 7 3554 1 1 33 VAL CG1 C -7.793 6.840 0.728 1.00 . A A . 33 VAL CG1 1 1 7 3555 1 1 33 VAL CG2 C -6.682 6.430 -1.463 1.00 . A A . 33 VAL CG2 1 1 7 3556 1 1 33 VAL H H -6.147 3.971 -1.552 1.00 . A A . 33 VAL H 1 1 7 3557 1 1 33 VAL HA H -5.566 5.364 0.872 1.00 . A A . 33 VAL HA 1 1 7 3558 1 1 33 VAL HB H -8.221 5.205 -0.595 1.00 . A A . 33 VAL HB 1 1 7 3559 1 1 33 VAL HG11 H -8.240 7.662 0.190 1.00 . A A . 33 VAL HG11 1 1 7 3560 1 1 33 VAL HG12 H -6.932 7.195 1.276 1.00 . A A . 33 VAL HG12 1 1 7 3561 1 1 33 VAL HG13 H -8.511 6.426 1.419 1.00 . A A . 33 VAL HG13 1 1 7 3562 1 1 33 VAL HG21 H -7.411 6.584 -2.241 1.00 . A A . 33 VAL HG21 1 1 7 3563 1 1 33 VAL HG22 H -5.887 5.800 -1.833 1.00 . A A . 33 VAL HG22 1 1 7 3564 1 1 33 VAL HG23 H -6.273 7.383 -1.159 1.00 . A A . 33 VAL HG23 1 1 7 3565 1 1 33 VAL N N -5.854 3.873 -0.621 1.00 . A A . 33 VAL N 1 1 7 3566 1 1 33 VAL O O -7.877 3.106 1.236 1.00 . A A . 33 VAL O 1 1 7 3567 1 1 34 GLU C C -8.575 4.549 4.592 1.00 . A A . 34 GLU C 1 1 7 3568 1 1 34 GLU CA C -7.582 3.621 3.883 1.00 . A A . 34 GLU CA 1 1 7 3569 1 1 34 GLU CB C -6.462 3.192 4.837 1.00 . A A . 34 GLU CB 1 1 7 3570 1 1 34 GLU CD C -6.434 1.325 6.506 1.00 . A A . 34 GLU CD 1 1 7 3571 1 1 34 GLU CG C -6.497 1.671 5.016 1.00 . A A . 34 GLU CG 1 1 7 3572 1 1 34 GLU H H -6.278 5.083 2.976 1.00 . A A . 34 GLU H 1 1 7 3573 1 1 34 GLU HA H -8.091 2.751 3.501 1.00 . A A . 34 GLU HA 1 1 7 3574 1 1 34 GLU HB2 H -5.508 3.486 4.428 1.00 . A A . 34 GLU HB2 1 1 7 3575 1 1 34 GLU HB3 H -6.604 3.668 5.796 1.00 . A A . 34 GLU HB3 1 1 7 3576 1 1 34 GLU HG2 H -7.409 1.280 4.592 1.00 . A A . 34 GLU HG2 1 1 7 3577 1 1 34 GLU HG3 H -5.649 1.232 4.513 1.00 . A A . 34 GLU HG3 1 1 7 3578 1 1 34 GLU N N -6.894 4.347 2.771 1.00 . A A . 34 GLU N 1 1 7 3579 1 1 34 GLU O O -8.192 5.494 5.257 1.00 . A A . 34 GLU O 1 1 7 3580 1 1 34 GLU OE1 O -5.359 1.417 7.073 1.00 . A A . 34 GLU OE1 1 1 7 3581 1 1 34 GLU OE2 O -7.466 0.970 7.055 1.00 . A A . 34 GLU OE2 1 1 7 3582 1 1 35 ALA C C -10.847 4.961 6.645 1.00 . A A . 35 ALA C 1 1 7 3583 1 1 35 ALA CA C -10.887 5.135 5.115 1.00 . A A . 35 ALA CA 1 1 7 3584 1 1 35 ALA CB C -12.229 4.661 4.545 1.00 . A A . 35 ALA CB 1 1 7 3585 1 1 35 ALA H H -10.127 3.510 3.912 1.00 . A A . 35 ALA H 1 1 7 3586 1 1 35 ALA HA H -10.729 6.171 4.857 1.00 . A A . 35 ALA HA 1 1 7 3587 1 1 35 ALA HB1 H -12.992 4.743 5.305 1.00 . A A . 35 ALA HB1 1 1 7 3588 1 1 35 ALA HB2 H -12.144 3.631 4.229 1.00 . A A . 35 ALA HB2 1 1 7 3589 1 1 35 ALA HB3 H -12.495 5.275 3.699 1.00 . A A . 35 ALA HB3 1 1 7 3590 1 1 35 ALA N N -9.851 4.278 4.453 1.00 . A A . 35 ALA N 1 1 7 3591 1 1 35 ALA O O -10.737 5.936 7.362 1.00 . A A . 35 ALA O 1 1 7 3592 1 1 36 PRO C C -9.497 3.678 9.134 1.00 . A A . 36 PRO C 1 1 7 3593 1 1 36 PRO CA C -10.908 3.460 8.566 1.00 . A A . 36 PRO CA 1 1 7 3594 1 1 36 PRO CB C -11.320 1.994 8.676 1.00 . A A . 36 PRO CB 1 1 7 3595 1 1 36 PRO CD C -11.074 2.484 6.326 1.00 . A A . 36 PRO CD 1 1 7 3596 1 1 36 PRO CG C -10.963 1.391 7.356 1.00 . A A . 36 PRO CG 1 1 7 3597 1 1 36 PRO HA H -11.624 4.082 9.078 1.00 . A A . 36 PRO HA 1 1 7 3598 1 1 36 PRO HB2 H -10.773 1.511 9.474 1.00 . A A . 36 PRO HB2 1 1 7 3599 1 1 36 PRO HB3 H -12.383 1.913 8.844 1.00 . A A . 36 PRO HB3 1 1 7 3600 1 1 36 PRO HD2 H -10.279 2.398 5.598 1.00 . A A . 36 PRO HD2 1 1 7 3601 1 1 36 PRO HD3 H -12.038 2.452 5.842 1.00 . A A . 36 PRO HD3 1 1 7 3602 1 1 36 PRO HG2 H -9.951 1.013 7.388 1.00 . A A . 36 PRO HG2 1 1 7 3603 1 1 36 PRO HG3 H -11.649 0.594 7.116 1.00 . A A . 36 PRO HG3 1 1 7 3604 1 1 36 PRO N N -10.938 3.726 7.103 1.00 . A A . 36 PRO N 1 1 7 3605 1 1 36 PRO O O -9.400 4.163 10.248 1.00 . A A . 36 PRO O 1 1 8 3606 1 1 1 ASP C C 9.244 10.297 -3.294 1.00 . A A . 1 ASP C 1 1 8 3607 1 1 1 ASP CA C 8.152 11.082 -2.551 1.00 . A A . 1 ASP CA 1 1 8 3608 1 1 1 ASP CB C 7.224 10.126 -1.792 1.00 . A A . 1 ASP CB 1 1 8 3609 1 1 1 ASP CG C 7.901 9.659 -0.500 1.00 . A A . 1 ASP CG 1 1 8 3610 1 1 1 ASP H1 H 6.769 11.099 -4.116 1.00 . A A . 1 ASP H1 1 1 8 3611 1 1 1 ASP H2 H 7.847 12.413 -4.131 1.00 . A A . 1 ASP H2 1 1 8 3612 1 1 1 ASP H3 H 6.573 12.369 -3.008 1.00 . A A . 1 ASP H3 1 1 8 3613 1 1 1 ASP HA H 8.595 11.786 -1.864 1.00 . A A . 1 ASP HA 1 1 8 3614 1 1 1 ASP HB2 H 6.302 10.636 -1.552 1.00 . A A . 1 ASP HB2 1 1 8 3615 1 1 1 ASP HB3 H 7.008 9.269 -2.411 1.00 . A A . 1 ASP HB3 1 1 8 3616 1 1 1 ASP N N 7.269 11.794 -3.525 1.00 . A A . 1 ASP N 1 1 8 3617 1 1 1 ASP O O 9.065 9.890 -4.428 1.00 . A A . 1 ASP O 1 1 8 3618 1 1 1 ASP OD1 O 8.672 8.714 -0.565 1.00 . A A . 1 ASP OD1 1 1 8 3619 1 1 1 ASP OD2 O 7.635 10.254 0.534 1.00 . A A . 1 ASP OD2 1 1 8 3620 1 1 2 GLY C C 11.019 7.875 -3.565 1.00 . A A . 2 GLY C 1 1 8 3621 1 1 2 GLY CA C 11.476 9.314 -3.315 1.00 . A A . 2 GLY CA 1 1 8 3622 1 1 2 GLY H H 10.487 10.412 -1.744 1.00 . A A . 2 GLY H 1 1 8 3623 1 1 2 GLY HA2 H 11.730 9.783 -4.255 1.00 . A A . 2 GLY HA2 1 1 8 3624 1 1 2 GLY HA3 H 12.340 9.307 -2.670 1.00 . A A . 2 GLY HA3 1 1 8 3625 1 1 2 GLY N N 10.370 10.078 -2.657 1.00 . A A . 2 GLY N 1 1 8 3626 1 1 2 GLY O O 11.009 7.404 -4.686 1.00 . A A . 2 GLY O 1 1 8 3627 1 1 3 GLU C C 8.657 5.693 -2.431 1.00 . A A . 3 GLU C 1 1 8 3628 1 1 3 GLU CA C 10.165 5.770 -2.691 1.00 . A A . 3 GLU CA 1 1 8 3629 1 1 3 GLU CB C 10.945 4.961 -1.652 1.00 . A A . 3 GLU CB 1 1 8 3630 1 1 3 GLU CD C 13.105 4.624 -2.870 1.00 . A A . 3 GLU CD 1 1 8 3631 1 1 3 GLU CG C 11.834 3.938 -2.364 1.00 . A A . 3 GLU CG 1 1 8 3632 1 1 3 GLU H H 10.646 7.585 -1.632 1.00 . A A . 3 GLU H 1 1 8 3633 1 1 3 GLU HA H 10.395 5.413 -3.684 1.00 . A A . 3 GLU HA 1 1 8 3634 1 1 3 GLU HB2 H 11.561 5.627 -1.063 1.00 . A A . 3 GLU HB2 1 1 8 3635 1 1 3 GLU HB3 H 10.254 4.445 -1.003 1.00 . A A . 3 GLU HB3 1 1 8 3636 1 1 3 GLU HG2 H 12.098 3.151 -1.673 1.00 . A A . 3 GLU HG2 1 1 8 3637 1 1 3 GLU HG3 H 11.296 3.517 -3.201 1.00 . A A . 3 GLU HG3 1 1 8 3638 1 1 3 GLU N N 10.633 7.178 -2.524 1.00 . A A . 3 GLU N 1 1 8 3639 1 1 3 GLU O O 8.208 5.740 -1.300 1.00 . A A . 3 GLU O 1 1 8 3640 1 1 3 GLU OE1 O 14.064 4.685 -2.117 1.00 . A A . 3 GLU OE1 1 1 8 3641 1 1 3 GLU OE2 O 13.101 5.078 -4.004 1.00 . A A . 3 GLU OE2 1 1 8 3642 1 1 4 CYS C C 5.764 4.585 -4.349 1.00 . A A . 4 CYS C 1 1 8 3643 1 1 4 CYS CA C 6.387 5.516 -3.299 1.00 . A A . 4 CYS CA 1 1 8 3644 1 1 4 CYS CB C 5.905 6.965 -3.480 1.00 . A A . 4 CYS CB 1 1 8 3645 1 1 4 CYS H H 8.259 5.557 -4.375 1.00 . A A . 4 CYS H 1 1 8 3646 1 1 4 CYS HA H 6.145 5.173 -2.306 1.00 . A A . 4 CYS HA 1 1 8 3647 1 1 4 CYS HB2 H 5.709 7.398 -2.511 1.00 . A A . 4 CYS HB2 1 1 8 3648 1 1 4 CYS HB3 H 6.673 7.537 -3.976 1.00 . A A . 4 CYS HB3 1 1 8 3649 1 1 4 CYS N N 7.871 5.584 -3.474 1.00 . A A . 4 CYS N 1 1 8 3650 1 1 4 CYS O O 6.353 4.309 -5.378 1.00 . A A . 4 CYS O 1 1 8 3651 1 1 4 CYS SG S 4.385 7.016 -4.468 1.00 . A A . 4 CYS SG 1 1 8 3652 1 1 5 GLY C C 2.775 3.988 -5.770 1.00 . A A . 5 GLY C 1 1 8 3653 1 1 5 GLY CA C 3.887 3.210 -5.059 1.00 . A A . 5 GLY CA 1 1 8 3654 1 1 5 GLY H H 4.117 4.357 -3.263 1.00 . A A . 5 GLY H 1 1 8 3655 1 1 5 GLY HA2 H 4.603 2.848 -5.781 1.00 . A A . 5 GLY HA2 1 1 8 3656 1 1 5 GLY HA3 H 3.455 2.376 -4.526 1.00 . A A . 5 GLY HA3 1 1 8 3657 1 1 5 GLY N N 4.569 4.112 -4.092 1.00 . A A . 5 GLY N 1 1 8 3658 1 1 5 GLY O O 3.037 4.896 -6.538 1.00 . A A . 5 GLY O 1 1 8 3659 1 1 6 GLY C C -0.829 4.307 -5.246 1.00 . A A . 6 GLY C 1 1 8 3660 1 1 6 GLY CA C 0.400 4.357 -6.166 1.00 . A A . 6 GLY CA 1 1 8 3661 1 1 6 GLY H H 1.359 2.907 -4.892 1.00 . A A . 6 GLY H 1 1 8 3662 1 1 6 GLY HA2 H 0.680 5.385 -6.344 1.00 . A A . 6 GLY HA2 1 1 8 3663 1 1 6 GLY HA3 H 0.165 3.883 -7.104 1.00 . A A . 6 GLY HA3 1 1 8 3664 1 1 6 GLY N N 1.539 3.639 -5.516 1.00 . A A . 6 GLY N 1 1 8 3665 1 1 6 GLY O O -0.708 4.192 -4.041 1.00 . A A . 6 GLY O 1 1 8 3666 1 1 7 PHE C C -3.671 2.894 -4.690 1.00 . A A . 7 PHE C 1 1 8 3667 1 1 7 PHE CA C -3.254 4.344 -4.964 1.00 . A A . 7 PHE CA 1 1 8 3668 1 1 7 PHE CB C -4.328 5.069 -5.784 1.00 . A A . 7 PHE CB 1 1 8 3669 1 1 7 PHE CD1 C -4.618 7.298 -4.641 1.00 . A A . 7 PHE CD1 1 1 8 3670 1 1 7 PHE CD2 C -6.307 5.590 -4.308 1.00 . A A . 7 PHE CD2 1 1 8 3671 1 1 7 PHE CE1 C -5.336 8.170 -3.813 1.00 . A A . 7 PHE CE1 1 1 8 3672 1 1 7 PHE CE2 C -7.025 6.461 -3.481 1.00 . A A . 7 PHE CE2 1 1 8 3673 1 1 7 PHE CG C -5.103 6.008 -4.888 1.00 . A A . 7 PHE CG 1 1 8 3674 1 1 7 PHE CZ C -6.540 7.752 -3.233 1.00 . A A . 7 PHE CZ 1 1 8 3675 1 1 7 PHE H H -2.088 4.479 -6.779 1.00 . A A . 7 PHE H 1 1 8 3676 1 1 7 PHE HA H -3.092 4.862 -4.032 1.00 . A A . 7 PHE HA 1 1 8 3677 1 1 7 PHE HB2 H -3.857 5.633 -6.575 1.00 . A A . 7 PHE HB2 1 1 8 3678 1 1 7 PHE HB3 H -5.004 4.343 -6.214 1.00 . A A . 7 PHE HB3 1 1 8 3679 1 1 7 PHE HD1 H -3.690 7.620 -5.087 1.00 . A A . 7 PHE HD1 1 1 8 3680 1 1 7 PHE HD2 H -6.683 4.595 -4.499 1.00 . A A . 7 PHE HD2 1 1 8 3681 1 1 7 PHE HE1 H -4.961 9.163 -3.622 1.00 . A A . 7 PHE HE1 1 1 8 3682 1 1 7 PHE HE2 H -7.955 6.141 -3.033 1.00 . A A . 7 PHE HE2 1 1 8 3683 1 1 7 PHE HZ H -7.093 8.425 -2.595 1.00 . A A . 7 PHE HZ 1 1 8 3684 1 1 7 PHE N N -2.013 4.389 -5.806 1.00 . A A . 7 PHE N 1 1 8 3685 1 1 7 PHE O O -4.196 2.583 -3.640 1.00 . A A . 7 PHE O 1 1 8 3686 1 1 8 TRP C C -2.749 -0.334 -6.048 1.00 . A A . 8 TRP C 1 1 8 3687 1 1 8 TRP CA C -3.815 0.575 -5.418 1.00 . A A . 8 TRP CA 1 1 8 3688 1 1 8 TRP CB C -5.174 0.417 -6.116 1.00 . A A . 8 TRP CB 1 1 8 3689 1 1 8 TRP CD1 C -5.344 -1.832 -4.950 1.00 . A A . 8 TRP CD1 1 1 8 3690 1 1 8 TRP CD2 C -6.623 -1.713 -6.798 1.00 . A A . 8 TRP CD2 1 1 8 3691 1 1 8 TRP CE2 C -6.811 -3.005 -6.256 1.00 . A A . 8 TRP CE2 1 1 8 3692 1 1 8 TRP CE3 C -7.323 -1.377 -7.972 1.00 . A A . 8 TRP CE3 1 1 8 3693 1 1 8 TRP CG C -5.685 -0.985 -5.952 1.00 . A A . 8 TRP CG 1 1 8 3694 1 1 8 TRP CH2 C -8.349 -3.586 -8.022 1.00 . A A . 8 TRP CH2 1 1 8 3695 1 1 8 TRP CZ2 C -7.661 -3.934 -6.858 1.00 . A A . 8 TRP CZ2 1 1 8 3696 1 1 8 TRP CZ3 C -8.181 -2.308 -8.579 1.00 . A A . 8 TRP CZ3 1 1 8 3697 1 1 8 TRP H H -3.013 2.283 -6.462 1.00 . A A . 8 TRP H 1 1 8 3698 1 1 8 TRP HA H -3.914 0.363 -4.365 1.00 . A A . 8 TRP HA 1 1 8 3699 1 1 8 TRP HB2 H -5.882 1.105 -5.680 1.00 . A A . 8 TRP HB2 1 1 8 3700 1 1 8 TRP HB3 H -5.066 0.636 -7.168 1.00 . A A . 8 TRP HB3 1 1 8 3701 1 1 8 TRP HD1 H -4.661 -1.611 -4.145 1.00 . A A . 8 TRP HD1 1 1 8 3702 1 1 8 TRP HE1 H -5.936 -3.813 -4.548 1.00 . A A . 8 TRP HE1 1 1 8 3703 1 1 8 TRP HE3 H -7.202 -0.396 -8.407 1.00 . A A . 8 TRP HE3 1 1 8 3704 1 1 8 TRP HH2 H -9.009 -4.297 -8.493 1.00 . A A . 8 TRP HH2 1 1 8 3705 1 1 8 TRP HZ2 H -7.786 -4.915 -6.425 1.00 . A A . 8 TRP HZ2 1 1 8 3706 1 1 8 TRP HZ3 H -8.715 -2.042 -9.478 1.00 . A A . 8 TRP HZ3 1 1 8 3707 1 1 8 TRP N N -3.439 2.006 -5.625 1.00 . A A . 8 TRP N 1 1 8 3708 1 1 8 TRP NE1 N -6.010 -3.030 -5.133 1.00 . A A . 8 TRP NE1 1 1 8 3709 1 1 8 TRP O O -2.951 -0.916 -7.099 1.00 . A A . 8 TRP O 1 1 8 3710 1 1 9 TRP C C -0.443 -2.618 -5.144 1.00 . A A . 9 TRP C 1 1 8 3711 1 1 9 TRP CA C -0.514 -1.313 -5.949 1.00 . A A . 9 TRP CA 1 1 8 3712 1 1 9 TRP CB C 0.768 -0.488 -5.757 1.00 . A A . 9 TRP CB 1 1 8 3713 1 1 9 TRP CD1 C -0.170 1.189 -7.418 1.00 . A A . 9 TRP CD1 1 1 8 3714 1 1 9 TRP CD2 C 2.078 1.135 -7.408 1.00 . A A . 9 TRP CD2 1 1 8 3715 1 1 9 TRP CE2 C 1.697 2.109 -8.359 1.00 . A A . 9 TRP CE2 1 1 8 3716 1 1 9 TRP CE3 C 3.451 0.907 -7.208 1.00 . A A . 9 TRP CE3 1 1 8 3717 1 1 9 TRP CG C 0.875 0.565 -6.819 1.00 . A A . 9 TRP CG 1 1 8 3718 1 1 9 TRP CH2 C 3.999 2.595 -8.874 1.00 . A A . 9 TRP CH2 1 1 8 3719 1 1 9 TRP CZ2 C 2.640 2.833 -9.084 1.00 . A A . 9 TRP CZ2 1 1 8 3720 1 1 9 TRP CZ3 C 4.405 1.633 -7.940 1.00 . A A . 9 TRP CZ3 1 1 8 3721 1 1 9 TRP H H -1.480 0.033 -4.561 1.00 . A A . 9 TRP H 1 1 8 3722 1 1 9 TRP HA H -0.674 -1.521 -6.995 1.00 . A A . 9 TRP HA 1 1 8 3723 1 1 9 TRP HB2 H 0.747 -0.014 -4.788 1.00 . A A . 9 TRP HB2 1 1 8 3724 1 1 9 TRP HB3 H 1.627 -1.142 -5.815 1.00 . A A . 9 TRP HB3 1 1 8 3725 1 1 9 TRP HD1 H -1.213 1.003 -7.218 1.00 . A A . 9 TRP HD1 1 1 8 3726 1 1 9 TRP HE1 H -0.228 2.687 -8.897 1.00 . A A . 9 TRP HE1 1 1 8 3727 1 1 9 TRP HE3 H 3.774 0.167 -6.490 1.00 . A A . 9 TRP HE3 1 1 8 3728 1 1 9 TRP HH2 H 4.738 3.150 -9.434 1.00 . A A . 9 TRP HH2 1 1 8 3729 1 1 9 TRP HZ2 H 2.320 3.575 -9.797 1.00 . A A . 9 TRP HZ2 1 1 8 3730 1 1 9 TRP HZ3 H 5.455 1.452 -7.778 1.00 . A A . 9 TRP HZ3 1 1 8 3731 1 1 9 TRP N N -1.613 -0.450 -5.405 1.00 . A A . 9 TRP N 1 1 8 3732 1 1 9 TRP NE1 N 0.320 2.103 -8.330 1.00 . A A . 9 TRP NE1 1 1 8 3733 1 1 9 TRP O O -1.024 -2.725 -4.087 1.00 . A A . 9 TRP O 1 1 8 3734 1 1 10 LYS C C 1.545 -4.881 -3.921 1.00 . A A . 10 LYS C 1 1 8 3735 1 1 10 LYS CA C 0.346 -4.898 -4.868 1.00 . A A . 10 LYS CA 1 1 8 3736 1 1 10 LYS CB C 0.528 -5.994 -5.915 1.00 . A A . 10 LYS CB 1 1 8 3737 1 1 10 LYS CD C -1.422 -5.977 -7.485 1.00 . A A . 10 LYS CD 1 1 8 3738 1 1 10 LYS CE C -1.954 -7.063 -8.428 1.00 . A A . 10 LYS CE 1 1 8 3739 1 1 10 LYS CG C -0.827 -6.631 -6.234 1.00 . A A . 10 LYS CG 1 1 8 3740 1 1 10 LYS H H 0.724 -3.513 -6.488 1.00 . A A . 10 LYS H 1 1 8 3741 1 1 10 LYS HA H -0.565 -5.065 -4.315 1.00 . A A . 10 LYS HA 1 1 8 3742 1 1 10 LYS HB2 H 0.953 -5.568 -6.812 1.00 . A A . 10 LYS HB2 1 1 8 3743 1 1 10 LYS HB3 H 1.196 -6.750 -5.527 1.00 . A A . 10 LYS HB3 1 1 8 3744 1 1 10 LYS HD2 H -2.231 -5.321 -7.197 1.00 . A A . 10 LYS HD2 1 1 8 3745 1 1 10 LYS HD3 H -0.658 -5.406 -7.992 1.00 . A A . 10 LYS HD3 1 1 8 3746 1 1 10 LYS HE2 H -1.416 -7.987 -8.276 1.00 . A A . 10 LYS HE2 1 1 8 3747 1 1 10 LYS HE3 H -3.011 -7.210 -8.271 1.00 . A A . 10 LYS HE3 1 1 8 3748 1 1 10 LYS HG2 H -0.693 -7.688 -6.406 1.00 . A A . 10 LYS HG2 1 1 8 3749 1 1 10 LYS HG3 H -1.499 -6.485 -5.400 1.00 . A A . 10 LYS HG3 1 1 8 3750 1 1 10 LYS HZ1 H -2.195 -5.624 -9.916 1.00 . A A . 10 LYS HZ1 1 1 8 3751 1 1 10 LYS HZ2 H -2.079 -7.214 -10.500 1.00 . A A . 10 LYS HZ2 1 1 8 3752 1 1 10 LYS HZ3 H -0.691 -6.406 -9.949 1.00 . A A . 10 LYS HZ3 1 1 8 3753 1 1 10 LYS N N 0.259 -3.610 -5.631 1.00 . A A . 10 LYS N 1 1 8 3754 1 1 10 LYS NZ N -1.711 -6.536 -9.801 1.00 . A A . 10 LYS NZ 1 1 8 3755 1 1 10 LYS O O 2.628 -4.458 -4.284 1.00 . A A . 10 LYS O 1 1 8 3756 1 1 11 CYS C C 2.328 -6.526 -0.741 1.00 . A A . 11 CYS C 1 1 8 3757 1 1 11 CYS CA C 2.493 -5.370 -1.743 1.00 . A A . 11 CYS CA 1 1 8 3758 1 1 11 CYS CB C 2.435 -4.013 -1.035 1.00 . A A . 11 CYS CB 1 1 8 3759 1 1 11 CYS H H 0.482 -5.689 -2.447 1.00 . A A . 11 CYS H 1 1 8 3760 1 1 11 CYS HA H 3.426 -5.467 -2.276 1.00 . A A . 11 CYS HA 1 1 8 3761 1 1 11 CYS HB2 H 3.308 -3.896 -0.412 1.00 . A A . 11 CYS HB2 1 1 8 3762 1 1 11 CYS HB3 H 2.415 -3.225 -1.774 1.00 . A A . 11 CYS HB3 1 1 8 3763 1 1 11 CYS N N 1.361 -5.347 -2.713 1.00 . A A . 11 CYS N 1 1 8 3764 1 1 11 CYS O O 1.305 -7.187 -0.706 1.00 . A A . 11 CYS O 1 1 8 3765 1 1 11 CYS SG S 0.948 -3.913 -0.009 1.00 . A A . 11 CYS SG 1 1 8 3766 1 1 12 GLY C C 2.710 -7.344 2.401 1.00 . A A . 12 GLY C 1 1 8 3767 1 1 12 GLY CA C 3.242 -7.884 1.071 1.00 . A A . 12 GLY CA 1 1 8 3768 1 1 12 GLY H H 4.144 -6.228 0.022 1.00 . A A . 12 GLY H 1 1 8 3769 1 1 12 GLY HA2 H 2.575 -8.649 0.700 1.00 . A A . 12 GLY HA2 1 1 8 3770 1 1 12 GLY HA3 H 4.223 -8.306 1.225 1.00 . A A . 12 GLY HA3 1 1 8 3771 1 1 12 GLY N N 3.330 -6.774 0.071 1.00 . A A . 12 GLY N 1 1 8 3772 1 1 12 GLY O O 1.643 -6.763 2.461 1.00 . A A . 12 GLY O 1 1 8 3773 1 1 13 ARG C C 3.524 -5.592 5.045 1.00 . A A . 13 ARG C 1 1 8 3774 1 1 13 ARG CA C 2.995 -7.018 4.804 1.00 . A A . 13 ARG CA 1 1 8 3775 1 1 13 ARG CB C 3.587 -7.994 5.830 1.00 . A A . 13 ARG CB 1 1 8 3776 1 1 13 ARG CD C 2.582 -7.520 8.079 1.00 . A A . 13 ARG CD 1 1 8 3777 1 1 13 ARG CG C 2.507 -8.411 6.833 1.00 . A A . 13 ARG CG 1 1 8 3778 1 1 13 ARG CZ C 1.405 -7.731 10.192 1.00 . A A . 13 ARG CZ 1 1 8 3779 1 1 13 ARG H H 4.308 -7.996 3.394 1.00 . A A . 13 ARG H 1 1 8 3780 1 1 13 ARG HA H 1.919 -7.032 4.863 1.00 . A A . 13 ARG HA 1 1 8 3781 1 1 13 ARG HB2 H 3.959 -8.870 5.318 1.00 . A A . 13 ARG HB2 1 1 8 3782 1 1 13 ARG HB3 H 4.399 -7.515 6.356 1.00 . A A . 13 ARG HB3 1 1 8 3783 1 1 13 ARG HD2 H 3.612 -7.287 8.312 1.00 . A A . 13 ARG HD2 1 1 8 3784 1 1 13 ARG HD3 H 2.016 -6.614 7.928 1.00 . A A . 13 ARG HD3 1 1 8 3785 1 1 13 ARG HE H 1.990 -9.307 9.133 1.00 . A A . 13 ARG HE 1 1 8 3786 1 1 13 ARG HG2 H 1.532 -8.309 6.376 1.00 . A A . 13 ARG HG2 1 1 8 3787 1 1 13 ARG HG3 H 2.662 -9.440 7.121 1.00 . A A . 13 ARG HG3 1 1 8 3788 1 1 13 ARG HH11 H -0.341 -7.440 9.251 1.00 . A A . 13 ARG HH11 1 1 8 3789 1 1 13 ARG HH12 H -0.263 -6.851 10.878 1.00 . A A . 13 ARG HH12 1 1 8 3790 1 1 13 ARG HH21 H 3.018 -7.886 11.373 1.00 . A A . 13 ARG HH21 1 1 8 3791 1 1 13 ARG HH22 H 1.644 -7.104 12.081 1.00 . A A . 13 ARG HH22 1 1 8 3792 1 1 13 ARG N N 3.451 -7.527 3.470 1.00 . A A . 13 ARG N 1 1 8 3793 1 1 13 ARG NE N 1.969 -8.328 9.174 1.00 . A A . 13 ARG NE 1 1 8 3794 1 1 13 ARG NH1 N 0.171 -7.308 10.100 1.00 . A A . 13 ARG NH1 1 1 8 3795 1 1 13 ARG NH2 N 2.075 -7.561 11.303 1.00 . A A . 13 ARG NH2 1 1 8 3796 1 1 13 ARG O O 3.675 -5.163 6.174 1.00 . A A . 13 ARG O 1 1 8 3797 1 1 14 GLY C C 5.812 -3.425 3.765 1.00 . A A . 14 GLY C 1 1 8 3798 1 1 14 GLY CA C 4.332 -3.468 4.158 1.00 . A A . 14 GLY CA 1 1 8 3799 1 1 14 GLY H H 3.683 -5.222 3.094 1.00 . A A . 14 GLY H 1 1 8 3800 1 1 14 GLY HA2 H 3.771 -2.798 3.522 1.00 . A A . 14 GLY HA2 1 1 8 3801 1 1 14 GLY HA3 H 4.226 -3.161 5.187 1.00 . A A . 14 GLY HA3 1 1 8 3802 1 1 14 GLY N N 3.810 -4.858 3.993 1.00 . A A . 14 GLY N 1 1 8 3803 1 1 14 GLY O O 6.602 -2.728 4.376 1.00 . A A . 14 GLY O 1 1 8 3804 1 1 15 LYS C C 7.935 -2.969 1.405 1.00 . A A . 15 LYS C 1 1 8 3805 1 1 15 LYS CA C 7.628 -4.171 2.317 1.00 . A A . 15 LYS CA 1 1 8 3806 1 1 15 LYS CB C 7.823 -5.493 1.566 1.00 . A A . 15 LYS CB 1 1 8 3807 1 1 15 LYS CD C 9.011 -7.697 1.614 1.00 . A A . 15 LYS CD 1 1 8 3808 1 1 15 LYS CE C 8.163 -8.896 2.052 1.00 . A A . 15 LYS CE 1 1 8 3809 1 1 15 LYS CG C 8.625 -6.465 2.437 1.00 . A A . 15 LYS CG 1 1 8 3810 1 1 15 LYS H H 5.540 -4.720 2.277 1.00 . A A . 15 LYS H 1 1 8 3811 1 1 15 LYS HA H 8.269 -4.149 3.178 1.00 . A A . 15 LYS HA 1 1 8 3812 1 1 15 LYS HB2 H 6.860 -5.925 1.339 1.00 . A A . 15 LYS HB2 1 1 8 3813 1 1 15 LYS HB3 H 8.361 -5.310 0.648 1.00 . A A . 15 LYS HB3 1 1 8 3814 1 1 15 LYS HD2 H 8.839 -7.496 0.566 1.00 . A A . 15 LYS HD2 1 1 8 3815 1 1 15 LYS HD3 H 10.055 -7.921 1.770 1.00 . A A . 15 LYS HD3 1 1 8 3816 1 1 15 LYS HE2 H 8.735 -9.810 1.963 1.00 . A A . 15 LYS HE2 1 1 8 3817 1 1 15 LYS HE3 H 7.819 -8.764 3.065 1.00 . A A . 15 LYS HE3 1 1 8 3818 1 1 15 LYS HG2 H 9.521 -5.973 2.791 1.00 . A A . 15 LYS HG2 1 1 8 3819 1 1 15 LYS HG3 H 8.026 -6.771 3.281 1.00 . A A . 15 LYS HG3 1 1 8 3820 1 1 15 LYS HZ1 H 6.444 -8.047 1.235 1.00 . A A . 15 LYS HZ1 1 1 8 3821 1 1 15 LYS HZ2 H 6.405 -9.743 1.324 1.00 . A A . 15 LYS HZ2 1 1 8 3822 1 1 15 LYS HZ3 H 7.344 -8.974 0.135 1.00 . A A . 15 LYS HZ3 1 1 8 3823 1 1 15 LYS N N 6.195 -4.165 2.751 1.00 . A A . 15 LYS N 1 1 8 3824 1 1 15 LYS NZ N 7.003 -8.917 1.116 1.00 . A A . 15 LYS NZ 1 1 8 3825 1 1 15 LYS O O 8.821 -2.191 1.699 1.00 . A A . 15 LYS O 1 1 8 3826 1 1 16 PRO C C 6.873 -0.422 -0.052 1.00 . A A . 16 PRO C 1 1 8 3827 1 1 16 PRO CA C 7.411 -1.738 -0.634 1.00 . A A . 16 PRO CA 1 1 8 3828 1 1 16 PRO CB C 6.610 -2.157 -1.863 1.00 . A A . 16 PRO CB 1 1 8 3829 1 1 16 PRO CD C 6.113 -3.746 -0.108 1.00 . A A . 16 PRO CD 1 1 8 3830 1 1 16 PRO CG C 5.557 -3.086 -1.345 1.00 . A A . 16 PRO CG 1 1 8 3831 1 1 16 PRO HA H 8.455 -1.648 -0.886 1.00 . A A . 16 PRO HA 1 1 8 3832 1 1 16 PRO HB2 H 6.157 -1.294 -2.329 1.00 . A A . 16 PRO HB2 1 1 8 3833 1 1 16 PRO HB3 H 7.243 -2.676 -2.566 1.00 . A A . 16 PRO HB3 1 1 8 3834 1 1 16 PRO HD2 H 5.352 -3.813 0.657 1.00 . A A . 16 PRO HD2 1 1 8 3835 1 1 16 PRO HD3 H 6.506 -4.724 -0.341 1.00 . A A . 16 PRO HD3 1 1 8 3836 1 1 16 PRO HG2 H 4.666 -2.527 -1.097 1.00 . A A . 16 PRO HG2 1 1 8 3837 1 1 16 PRO HG3 H 5.329 -3.836 -2.085 1.00 . A A . 16 PRO HG3 1 1 8 3838 1 1 16 PRO N N 7.198 -2.856 0.322 1.00 . A A . 16 PRO N 1 1 8 3839 1 1 16 PRO O O 5.756 -0.370 0.427 1.00 . A A . 16 PRO O 1 1 8 3840 1 1 17 PRO C C 6.262 2.606 -0.498 1.00 . A A . 17 PRO C 1 1 8 3841 1 1 17 PRO CA C 7.290 1.933 0.424 1.00 . A A . 17 PRO CA 1 1 8 3842 1 1 17 PRO CB C 8.597 2.720 0.456 1.00 . A A . 17 PRO CB 1 1 8 3843 1 1 17 PRO CD C 9.054 0.627 -0.666 1.00 . A A . 17 PRO CD 1 1 8 3844 1 1 17 PRO CG C 9.472 2.072 -0.570 1.00 . A A . 17 PRO CG 1 1 8 3845 1 1 17 PRO HA H 6.896 1.834 1.422 1.00 . A A . 17 PRO HA 1 1 8 3846 1 1 17 PRO HB2 H 8.416 3.755 0.199 1.00 . A A . 17 PRO HB2 1 1 8 3847 1 1 17 PRO HB3 H 9.054 2.648 1.430 1.00 . A A . 17 PRO HB3 1 1 8 3848 1 1 17 PRO HD2 H 9.050 0.305 -1.700 1.00 . A A . 17 PRO HD2 1 1 8 3849 1 1 17 PRO HD3 H 9.707 0.003 -0.077 1.00 . A A . 17 PRO HD3 1 1 8 3850 1 1 17 PRO HG2 H 9.343 2.561 -1.526 1.00 . A A . 17 PRO HG2 1 1 8 3851 1 1 17 PRO HG3 H 10.505 2.130 -0.262 1.00 . A A . 17 PRO HG3 1 1 8 3852 1 1 17 PRO N N 7.693 0.605 -0.109 1.00 . A A . 17 PRO N 1 1 8 3853 1 1 17 PRO O O 6.564 2.978 -1.616 1.00 . A A . 17 PRO O 1 1 8 3854 1 1 18 CYS C C 4.062 4.943 -0.702 1.00 . A A . 18 CYS C 1 1 8 3855 1 1 18 CYS CA C 3.987 3.416 -0.849 1.00 . A A . 18 CYS CA 1 1 8 3856 1 1 18 CYS CB C 2.663 2.895 -0.283 1.00 . A A . 18 CYS CB 1 1 8 3857 1 1 18 CYS H H 4.838 2.456 0.878 1.00 . A A . 18 CYS H 1 1 8 3858 1 1 18 CYS HA H 4.082 3.129 -1.883 1.00 . A A . 18 CYS HA 1 1 8 3859 1 1 18 CYS HB2 H 2.618 3.106 0.776 1.00 . A A . 18 CYS HB2 1 1 8 3860 1 1 18 CYS HB3 H 1.840 3.386 -0.781 1.00 . A A . 18 CYS HB3 1 1 8 3861 1 1 18 CYS N N 5.049 2.765 -0.024 1.00 . A A . 18 CYS N 1 1 8 3862 1 1 18 CYS O O 4.907 5.469 -0.003 1.00 . A A . 18 CYS O 1 1 8 3863 1 1 18 CYS SG S 2.546 1.110 -0.547 1.00 . A A . 18 CYS SG 1 1 8 3864 1 1 19 CYS C C 2.628 7.592 0.108 1.00 . A A . 19 CYS C 1 1 8 3865 1 1 19 CYS CA C 3.188 7.151 -1.250 1.00 . A A . 19 CYS CA 1 1 8 3866 1 1 19 CYS CB C 2.289 7.646 -2.387 1.00 . A A . 19 CYS CB 1 1 8 3867 1 1 19 CYS H H 2.502 5.211 -1.908 1.00 . A A . 19 CYS H 1 1 8 3868 1 1 19 CYS HA H 4.189 7.528 -1.383 1.00 . A A . 19 CYS HA 1 1 8 3869 1 1 19 CYS HB2 H 1.789 6.805 -2.846 1.00 . A A . 19 CYS HB2 1 1 8 3870 1 1 19 CYS HB3 H 1.552 8.330 -1.993 1.00 . A A . 19 CYS HB3 1 1 8 3871 1 1 19 CYS N N 3.176 5.659 -1.354 1.00 . A A . 19 CYS N 1 1 8 3872 1 1 19 CYS O O 1.819 6.906 0.707 1.00 . A A . 19 CYS O 1 1 8 3873 1 1 19 CYS SG S 3.297 8.494 -3.627 1.00 . A A . 19 CYS SG 1 1 8 3874 1 1 20 LYS C C 1.042 9.322 1.926 1.00 . A A . 20 LYS C 1 1 8 3875 1 1 20 LYS CA C 2.575 9.231 1.915 1.00 . A A . 20 LYS CA 1 1 8 3876 1 1 20 LYS CB C 3.203 10.619 2.073 1.00 . A A . 20 LYS CB 1 1 8 3877 1 1 20 LYS CD C 4.613 11.815 3.762 1.00 . A A . 20 LYS CD 1 1 8 3878 1 1 20 LYS CE C 5.866 10.929 3.794 1.00 . A A . 20 LYS CE 1 1 8 3879 1 1 20 LYS CG C 3.369 10.944 3.560 1.00 . A A . 20 LYS CG 1 1 8 3880 1 1 20 LYS H H 3.719 9.251 0.094 1.00 . A A . 20 LYS H 1 1 8 3881 1 1 20 LYS HA H 2.918 8.584 2.703 1.00 . A A . 20 LYS HA 1 1 8 3882 1 1 20 LYS HB2 H 4.170 10.631 1.591 1.00 . A A . 20 LYS HB2 1 1 8 3883 1 1 20 LYS HB3 H 2.562 11.358 1.614 1.00 . A A . 20 LYS HB3 1 1 8 3884 1 1 20 LYS HD2 H 4.693 12.521 2.948 1.00 . A A . 20 LYS HD2 1 1 8 3885 1 1 20 LYS HD3 H 4.530 12.349 4.696 1.00 . A A . 20 LYS HD3 1 1 8 3886 1 1 20 LYS HE2 H 5.748 10.089 3.122 1.00 . A A . 20 LYS HE2 1 1 8 3887 1 1 20 LYS HE3 H 6.739 11.504 3.527 1.00 . A A . 20 LYS HE3 1 1 8 3888 1 1 20 LYS HG2 H 2.496 11.476 3.910 1.00 . A A . 20 LYS HG2 1 1 8 3889 1 1 20 LYS HG3 H 3.479 10.027 4.119 1.00 . A A . 20 LYS HG3 1 1 8 3890 1 1 20 LYS HZ1 H 5.162 9.856 5.437 1.00 . A A . 20 LYS HZ1 1 1 8 3891 1 1 20 LYS HZ2 H 5.999 11.277 5.845 1.00 . A A . 20 LYS HZ2 1 1 8 3892 1 1 20 LYS HZ3 H 6.853 9.907 5.318 1.00 . A A . 20 LYS HZ3 1 1 8 3893 1 1 20 LYS N N 3.063 8.729 0.596 1.00 . A A . 20 LYS N 1 1 8 3894 1 1 20 LYS NZ N 5.977 10.457 5.205 1.00 . A A . 20 LYS NZ 1 1 8 3895 1 1 20 LYS O O 0.452 10.086 1.184 1.00 . A A . 20 LYS O 1 1 8 3896 1 1 21 GLY C C -1.645 7.155 2.575 1.00 . A A . 21 GLY C 1 1 8 3897 1 1 21 GLY CA C -1.096 8.566 2.822 1.00 . A A . 21 GLY CA 1 1 8 3898 1 1 21 GLY H H 0.898 7.930 3.341 1.00 . A A . 21 GLY H 1 1 8 3899 1 1 21 GLY HA2 H -1.406 8.907 3.800 1.00 . A A . 21 GLY HA2 1 1 8 3900 1 1 21 GLY HA3 H -1.479 9.234 2.068 1.00 . A A . 21 GLY HA3 1 1 8 3901 1 1 21 GLY N N 0.399 8.540 2.759 1.00 . A A . 21 GLY N 1 1 8 3902 1 1 21 GLY O O -2.658 6.773 3.129 1.00 . A A . 21 GLY O 1 1 8 3903 1 1 22 TYR C C -0.753 3.985 2.365 1.00 . A A . 22 TYR C 1 1 8 3904 1 1 22 TYR CA C -1.462 4.995 1.452 1.00 . A A . 22 TYR CA 1 1 8 3905 1 1 22 TYR CB C -1.086 4.720 -0.015 1.00 . A A . 22 TYR CB 1 1 8 3906 1 1 22 TYR CD1 C -2.603 6.651 -0.640 1.00 . A A . 22 TYR CD1 1 1 8 3907 1 1 22 TYR CD2 C -0.637 6.218 -1.991 1.00 . A A . 22 TYR CD2 1 1 8 3908 1 1 22 TYR CE1 C -2.932 7.732 -1.470 1.00 . A A . 22 TYR CE1 1 1 8 3909 1 1 22 TYR CE2 C -0.968 7.297 -2.819 1.00 . A A . 22 TYR CE2 1 1 8 3910 1 1 22 TYR CG C -1.453 5.893 -0.901 1.00 . A A . 22 TYR CG 1 1 8 3911 1 1 22 TYR CZ C -2.115 8.055 -2.558 1.00 . A A . 22 TYR CZ 1 1 8 3912 1 1 22 TYR H H -0.176 6.719 1.309 1.00 . A A . 22 TYR H 1 1 8 3913 1 1 22 TYR HA H -2.532 4.930 1.576 1.00 . A A . 22 TYR HA 1 1 8 3914 1 1 22 TYR HB2 H -0.023 4.544 -0.081 1.00 . A A . 22 TYR HB2 1 1 8 3915 1 1 22 TYR HB3 H -1.612 3.839 -0.356 1.00 . A A . 22 TYR HB3 1 1 8 3916 1 1 22 TYR HD1 H -3.232 6.404 0.200 1.00 . A A . 22 TYR HD1 1 1 8 3917 1 1 22 TYR HD2 H 0.248 5.635 -2.195 1.00 . A A . 22 TYR HD2 1 1 8 3918 1 1 22 TYR HE1 H -3.818 8.316 -1.267 1.00 . A A . 22 TYR HE1 1 1 8 3919 1 1 22 TYR HE2 H -0.336 7.545 -3.659 1.00 . A A . 22 TYR HE2 1 1 8 3920 1 1 22 TYR HH H -1.639 9.441 -3.791 1.00 . A A . 22 TYR HH 1 1 8 3921 1 1 22 TYR N N -0.985 6.383 1.744 1.00 . A A . 22 TYR N 1 1 8 3922 1 1 22 TYR O O 0.380 4.183 2.764 1.00 . A A . 22 TYR O 1 1 8 3923 1 1 22 TYR OH O -2.444 9.120 -3.374 1.00 . A A . 22 TYR OH 1 1 8 3924 1 1 23 ALA C C -0.861 0.491 2.868 1.00 . A A . 23 ALA C 1 1 8 3925 1 1 23 ALA CA C -0.790 1.857 3.560 1.00 . A A . 23 ALA CA 1 1 8 3926 1 1 23 ALA CB C -1.629 1.855 4.839 1.00 . A A . 23 ALA CB 1 1 8 3927 1 1 23 ALA H H -2.320 2.764 2.341 1.00 . A A . 23 ALA H 1 1 8 3928 1 1 23 ALA HA H 0.232 2.115 3.788 1.00 . A A . 23 ALA HA 1 1 8 3929 1 1 23 ALA HB1 H -1.464 2.774 5.381 1.00 . A A . 23 ALA HB1 1 1 8 3930 1 1 23 ALA HB2 H -1.340 1.017 5.456 1.00 . A A . 23 ALA HB2 1 1 8 3931 1 1 23 ALA HB3 H -2.675 1.769 4.584 1.00 . A A . 23 ALA HB3 1 1 8 3932 1 1 23 ALA N N -1.413 2.901 2.686 1.00 . A A . 23 ALA N 1 1 8 3933 1 1 23 ALA O O -1.767 0.223 2.102 1.00 . A A . 23 ALA O 1 1 8 3934 1 1 24 CYS C C -0.732 -2.717 3.329 1.00 . A A . 24 CYS C 1 1 8 3935 1 1 24 CYS CA C 0.069 -1.727 2.481 1.00 . A A . 24 CYS CA 1 1 8 3936 1 1 24 CYS CB C 1.537 -2.150 2.391 1.00 . A A . 24 CYS CB 1 1 8 3937 1 1 24 CYS H H 0.808 -0.142 3.752 1.00 . A A . 24 CYS H 1 1 8 3938 1 1 24 CYS HA H -0.352 -1.657 1.491 1.00 . A A . 24 CYS HA 1 1 8 3939 1 1 24 CYS HB2 H 2.043 -1.532 1.667 1.00 . A A . 24 CYS HB2 1 1 8 3940 1 1 24 CYS HB3 H 2.000 -2.029 3.357 1.00 . A A . 24 CYS HB3 1 1 8 3941 1 1 24 CYS N N 0.086 -0.377 3.131 1.00 . A A . 24 CYS N 1 1 8 3942 1 1 24 CYS O O -0.929 -2.523 4.515 1.00 . A A . 24 CYS O 1 1 8 3943 1 1 24 CYS SG S 1.652 -3.886 1.883 1.00 . A A . 24 CYS SG 1 1 8 3944 1 1 25 SER C C -1.666 -6.203 2.994 1.00 . A A . 25 SER C 1 1 8 3945 1 1 25 SER CA C -2.006 -4.785 3.466 1.00 . A A . 25 SER CA 1 1 8 3946 1 1 25 SER CB C -3.462 -4.447 3.143 1.00 . A A . 25 SER CB 1 1 8 3947 1 1 25 SER H H -1.034 -3.895 1.762 1.00 . A A . 25 SER H 1 1 8 3948 1 1 25 SER HA H -1.837 -4.692 4.524 1.00 . A A . 25 SER HA 1 1 8 3949 1 1 25 SER HB2 H -3.576 -4.316 2.080 1.00 . A A . 25 SER HB2 1 1 8 3950 1 1 25 SER HB3 H -4.101 -5.257 3.472 1.00 . A A . 25 SER HB3 1 1 8 3951 1 1 25 SER HG H -4.277 -3.475 4.619 1.00 . A A . 25 SER HG 1 1 8 3952 1 1 25 SER N N -1.204 -3.772 2.719 1.00 . A A . 25 SER N 1 1 8 3953 1 1 25 SER O O -1.644 -6.483 1.810 1.00 . A A . 25 SER O 1 1 8 3954 1 1 25 SER OG O -3.824 -3.243 3.805 1.00 . A A . 25 SER OG 1 1 8 3955 1 1 26 LYS C C -2.397 -9.289 3.331 1.00 . A A . 26 LYS C 1 1 8 3956 1 1 26 LYS CA C -1.094 -8.508 3.535 1.00 . A A . 26 LYS CA 1 1 8 3957 1 1 26 LYS CB C -0.283 -9.074 4.709 1.00 . A A . 26 LYS CB 1 1 8 3958 1 1 26 LYS CD C 0.593 -10.990 3.342 1.00 . A A . 26 LYS CD 1 1 8 3959 1 1 26 LYS CE C 0.385 -12.481 3.049 1.00 . A A . 26 LYS CE 1 1 8 3960 1 1 26 LYS CG C -0.189 -10.602 4.601 1.00 . A A . 26 LYS CG 1 1 8 3961 1 1 26 LYS H H -1.452 -6.846 4.865 1.00 . A A . 26 LYS H 1 1 8 3962 1 1 26 LYS HA H -0.504 -8.526 2.635 1.00 . A A . 26 LYS HA 1 1 8 3963 1 1 26 LYS HB2 H 0.711 -8.653 4.691 1.00 . A A . 26 LYS HB2 1 1 8 3964 1 1 26 LYS HB3 H -0.766 -8.811 5.638 1.00 . A A . 26 LYS HB3 1 1 8 3965 1 1 26 LYS HD2 H 0.242 -10.404 2.505 1.00 . A A . 26 LYS HD2 1 1 8 3966 1 1 26 LYS HD3 H 1.645 -10.801 3.499 1.00 . A A . 26 LYS HD3 1 1 8 3967 1 1 26 LYS HE2 H 1.297 -12.918 2.670 1.00 . A A . 26 LYS HE2 1 1 8 3968 1 1 26 LYS HE3 H 0.061 -12.997 3.941 1.00 . A A . 26 LYS HE3 1 1 8 3969 1 1 26 LYS HG2 H 0.318 -10.992 5.472 1.00 . A A . 26 LYS HG2 1 1 8 3970 1 1 26 LYS HG3 H -1.183 -11.021 4.548 1.00 . A A . 26 LYS HG3 1 1 8 3971 1 1 26 LYS HZ1 H -0.352 -12.077 1.142 1.00 . A A . 26 LYS HZ1 1 1 8 3972 1 1 26 LYS HZ2 H -1.533 -12.033 2.363 1.00 . A A . 26 LYS HZ2 1 1 8 3973 1 1 26 LYS HZ3 H -0.930 -13.522 1.814 1.00 . A A . 26 LYS HZ3 1 1 8 3974 1 1 26 LYS N N -1.416 -7.099 3.918 1.00 . A A . 26 LYS N 1 1 8 3975 1 1 26 LYS NZ N -0.688 -12.531 2.014 1.00 . A A . 26 LYS NZ 1 1 8 3976 1 1 26 LYS O O -2.549 -10.013 2.365 1.00 . A A . 26 LYS O 1 1 8 3977 1 1 27 THR C C -5.307 -9.431 2.760 1.00 . A A . 27 THR C 1 1 8 3978 1 1 27 THR CA C -4.654 -9.837 4.084 1.00 . A A . 27 THR CA 1 1 8 3979 1 1 27 THR CB C -5.511 -9.369 5.270 1.00 . A A . 27 THR CB 1 1 8 3980 1 1 27 THR CG2 C -6.767 -10.238 5.375 1.00 . A A . 27 THR CG2 1 1 8 3981 1 1 27 THR H H -3.193 -8.524 4.984 1.00 . A A . 27 THR H 1 1 8 3982 1 1 27 THR HA H -4.512 -10.904 4.125 1.00 . A A . 27 THR HA 1 1 8 3983 1 1 27 THR HB H -5.805 -8.340 5.117 1.00 . A A . 27 THR HB 1 1 8 3984 1 1 27 THR HG1 H -4.944 -8.695 7.006 1.00 . A A . 27 THR HG1 1 1 8 3985 1 1 27 THR HG21 H -6.982 -10.680 4.413 1.00 . A A . 27 THR HG21 1 1 8 3986 1 1 27 THR HG22 H -7.602 -9.628 5.686 1.00 . A A . 27 THR HG22 1 1 8 3987 1 1 27 THR HG23 H -6.604 -11.021 6.101 1.00 . A A . 27 THR HG23 1 1 8 3988 1 1 27 THR N N -3.342 -9.127 4.226 1.00 . A A . 27 THR N 1 1 8 3989 1 1 27 THR O O -5.895 -10.242 2.069 1.00 . A A . 27 THR O 1 1 8 3990 1 1 27 THR OG1 O -4.761 -9.473 6.473 1.00 . A A . 27 THR OG1 1 1 8 3991 1 1 28 TRP C C -4.828 -8.020 -0.033 1.00 . A A . 28 TRP C 1 1 8 3992 1 1 28 TRP CA C -5.780 -7.690 1.122 1.00 . A A . 28 TRP CA 1 1 8 3993 1 1 28 TRP CB C -5.920 -6.169 1.293 1.00 . A A . 28 TRP CB 1 1 8 3994 1 1 28 TRP CD1 C -7.516 -6.748 3.187 1.00 . A A . 28 TRP CD1 1 1 8 3995 1 1 28 TRP CD2 C -7.069 -4.546 3.067 1.00 . A A . 28 TRP CD2 1 1 8 3996 1 1 28 TRP CE2 C -7.957 -4.725 4.154 1.00 . A A . 28 TRP CE2 1 1 8 3997 1 1 28 TRP CE3 C -6.632 -3.242 2.776 1.00 . A A . 28 TRP CE3 1 1 8 3998 1 1 28 TRP CG C -6.801 -5.848 2.468 1.00 . A A . 28 TRP CG 1 1 8 3999 1 1 28 TRP CH2 C -7.950 -2.359 4.624 1.00 . A A . 28 TRP CH2 1 1 8 4000 1 1 28 TRP CZ2 C -8.395 -3.648 4.927 1.00 . A A . 28 TRP CZ2 1 1 8 4001 1 1 28 TRP CZ3 C -7.072 -2.156 3.551 1.00 . A A . 28 TRP CZ3 1 1 8 4002 1 1 28 TRP H H -4.699 -7.554 2.981 1.00 . A A . 28 TRP H 1 1 8 4003 1 1 28 TRP HA H -6.747 -8.136 0.956 1.00 . A A . 28 TRP HA 1 1 8 4004 1 1 28 TRP HB2 H -4.944 -5.737 1.451 1.00 . A A . 28 TRP HB2 1 1 8 4005 1 1 28 TRP HB3 H -6.351 -5.750 0.397 1.00 . A A . 28 TRP HB3 1 1 8 4006 1 1 28 TRP HD1 H -7.546 -7.812 3.010 1.00 . A A . 28 TRP HD1 1 1 8 4007 1 1 28 TRP HE1 H -8.785 -6.503 4.849 1.00 . A A . 28 TRP HE1 1 1 8 4008 1 1 28 TRP HE3 H -5.954 -3.073 1.953 1.00 . A A . 28 TRP HE3 1 1 8 4009 1 1 28 TRP HH2 H -8.286 -1.521 5.215 1.00 . A A . 28 TRP HH2 1 1 8 4010 1 1 28 TRP HZ2 H -9.072 -3.811 5.751 1.00 . A A . 28 TRP HZ2 1 1 8 4011 1 1 28 TRP HZ3 H -6.730 -1.157 3.320 1.00 . A A . 28 TRP HZ3 1 1 8 4012 1 1 28 TRP N N -5.189 -8.177 2.405 1.00 . A A . 28 TRP N 1 1 8 4013 1 1 28 TRP NE1 N -8.197 -6.081 4.189 1.00 . A A . 28 TRP NE1 1 1 8 4014 1 1 28 TRP O O -5.247 -8.448 -1.091 1.00 . A A . 28 TRP O 1 1 8 4015 1 1 29 GLY C C -2.211 -6.892 -1.707 1.00 . A A . 29 GLY C 1 1 8 4016 1 1 29 GLY CA C -2.549 -8.146 -0.890 1.00 . A A . 29 GLY CA 1 1 8 4017 1 1 29 GLY H H -3.238 -7.496 1.043 1.00 . A A . 29 GLY H 1 1 8 4018 1 1 29 GLY HA2 H -1.648 -8.525 -0.431 1.00 . A A . 29 GLY HA2 1 1 8 4019 1 1 29 GLY HA3 H -2.955 -8.898 -1.551 1.00 . A A . 29 GLY HA3 1 1 8 4020 1 1 29 GLY N N -3.546 -7.834 0.176 1.00 . A A . 29 GLY N 1 1 8 4021 1 1 29 GLY O O -1.662 -6.993 -2.789 1.00 . A A . 29 GLY O 1 1 8 4022 1 1 30 TRP C C -1.946 -3.283 -1.070 1.00 . A A . 30 TRP C 1 1 8 4023 1 1 30 TRP CA C -2.191 -4.481 -1.995 1.00 . A A . 30 TRP CA 1 1 8 4024 1 1 30 TRP CB C -3.395 -4.249 -2.925 1.00 . A A . 30 TRP CB 1 1 8 4025 1 1 30 TRP CD1 C -4.643 -2.449 -1.653 1.00 . A A . 30 TRP CD1 1 1 8 4026 1 1 30 TRP CD2 C -5.830 -4.348 -1.848 1.00 . A A . 30 TRP CD2 1 1 8 4027 1 1 30 TRP CE2 C -6.632 -3.437 -1.123 1.00 . A A . 30 TRP CE2 1 1 8 4028 1 1 30 TRP CE3 C -6.351 -5.628 -2.111 1.00 . A A . 30 TRP CE3 1 1 8 4029 1 1 30 TRP CG C -4.565 -3.698 -2.167 1.00 . A A . 30 TRP CG 1 1 8 4030 1 1 30 TRP CH2 C -8.413 -5.055 -0.945 1.00 . A A . 30 TRP CH2 1 1 8 4031 1 1 30 TRP CZ2 C -7.909 -3.782 -0.675 1.00 . A A . 30 TRP CZ2 1 1 8 4032 1 1 30 TRP CZ3 C -7.635 -5.978 -1.662 1.00 . A A . 30 TRP CZ3 1 1 8 4033 1 1 30 TRP H H -2.957 -5.639 -0.336 1.00 . A A . 30 TRP H 1 1 8 4034 1 1 30 TRP HA H -1.307 -4.657 -2.590 1.00 . A A . 30 TRP HA 1 1 8 4035 1 1 30 TRP HB2 H -3.116 -3.550 -3.699 1.00 . A A . 30 TRP HB2 1 1 8 4036 1 1 30 TRP HB3 H -3.676 -5.186 -3.382 1.00 . A A . 30 TRP HB3 1 1 8 4037 1 1 30 TRP HD1 H -3.871 -1.697 -1.713 1.00 . A A . 30 TRP HD1 1 1 8 4038 1 1 30 TRP HE1 H -6.162 -1.485 -0.574 1.00 . A A . 30 TRP HE1 1 1 8 4039 1 1 30 TRP HE3 H -5.761 -6.345 -2.660 1.00 . A A . 30 TRP HE3 1 1 8 4040 1 1 30 TRP HH2 H -9.399 -5.330 -0.604 1.00 . A A . 30 TRP HH2 1 1 8 4041 1 1 30 TRP HZ2 H -8.504 -3.068 -0.124 1.00 . A A . 30 TRP HZ2 1 1 8 4042 1 1 30 TRP HZ3 H -8.028 -6.963 -1.870 1.00 . A A . 30 TRP HZ3 1 1 8 4043 1 1 30 TRP N N -2.520 -5.713 -1.213 1.00 . A A . 30 TRP N 1 1 8 4044 1 1 30 TRP NE1 N -5.863 -2.296 -1.029 1.00 . A A . 30 TRP NE1 1 1 8 4045 1 1 30 TRP O O -2.051 -3.380 0.137 1.00 . A A . 30 TRP O 1 1 8 4046 1 1 31 CYS C C -2.268 0.207 -1.279 1.00 . A A . 31 CYS C 1 1 8 4047 1 1 31 CYS CA C -1.349 -0.933 -0.833 1.00 . A A . 31 CYS CA 1 1 8 4048 1 1 31 CYS CB C 0.116 -0.591 -1.109 1.00 . A A . 31 CYS CB 1 1 8 4049 1 1 31 CYS H H -1.542 -2.113 -2.619 1.00 . A A . 31 CYS H 1 1 8 4050 1 1 31 CYS HA H -1.488 -1.139 0.215 1.00 . A A . 31 CYS HA 1 1 8 4051 1 1 31 CYS HB2 H 0.719 -1.483 -1.014 1.00 . A A . 31 CYS HB2 1 1 8 4052 1 1 31 CYS HB3 H 0.213 -0.199 -2.113 1.00 . A A . 31 CYS HB3 1 1 8 4053 1 1 31 CYS N N -1.616 -2.155 -1.644 1.00 . A A . 31 CYS N 1 1 8 4054 1 1 31 CYS O O -2.229 0.642 -2.419 1.00 . A A . 31 CYS O 1 1 8 4055 1 1 31 CYS SG S 0.684 0.648 0.078 1.00 . A A . 31 CYS SG 1 1 8 4056 1 1 32 ALA C C -4.306 2.656 0.520 1.00 . A A . 32 ALA C 1 1 8 4057 1 1 32 ALA CA C -4.025 1.806 -0.726 1.00 . A A . 32 ALA CA 1 1 8 4058 1 1 32 ALA CB C -5.304 1.115 -1.206 1.00 . A A . 32 ALA CB 1 1 8 4059 1 1 32 ALA H H -3.095 0.316 0.523 1.00 . A A . 32 ALA H 1 1 8 4060 1 1 32 ALA HA H -3.615 2.415 -1.518 1.00 . A A . 32 ALA HA 1 1 8 4061 1 1 32 ALA HB1 H -5.781 0.621 -0.372 1.00 . A A . 32 ALA HB1 1 1 8 4062 1 1 32 ALA HB2 H -5.056 0.386 -1.963 1.00 . A A . 32 ALA HB2 1 1 8 4063 1 1 32 ALA HB3 H -5.976 1.852 -1.621 1.00 . A A . 32 ALA HB3 1 1 8 4064 1 1 32 ALA N N -3.091 0.690 -0.384 1.00 . A A . 32 ALA N 1 1 8 4065 1 1 32 ALA O O -3.816 2.370 1.594 1.00 . A A . 32 ALA O 1 1 8 4066 1 1 33 VAL C C -6.076 3.746 2.671 1.00 . A A . 33 VAL C 1 1 8 4067 1 1 33 VAL CA C -5.396 4.570 1.567 1.00 . A A . 33 VAL CA 1 1 8 4068 1 1 33 VAL CB C -6.343 5.661 1.048 1.00 . A A . 33 VAL CB 1 1 8 4069 1 1 33 VAL CG1 C -6.715 6.600 2.197 1.00 . A A . 33 VAL CG1 1 1 8 4070 1 1 33 VAL CG2 C -5.650 6.469 -0.055 1.00 . A A . 33 VAL CG2 1 1 8 4071 1 1 33 VAL H H -5.472 3.910 -0.493 1.00 . A A . 33 VAL H 1 1 8 4072 1 1 33 VAL HA H -4.490 5.020 1.942 1.00 . A A . 33 VAL HA 1 1 8 4073 1 1 33 VAL HB H -7.239 5.203 0.653 1.00 . A A . 33 VAL HB 1 1 8 4074 1 1 33 VAL HG11 H -7.301 6.062 2.927 1.00 . A A . 33 VAL HG11 1 1 8 4075 1 1 33 VAL HG12 H -7.292 7.429 1.813 1.00 . A A . 33 VAL HG12 1 1 8 4076 1 1 33 VAL HG13 H -5.815 6.974 2.664 1.00 . A A . 33 VAL HG13 1 1 8 4077 1 1 33 VAL HG21 H -6.396 6.920 -0.693 1.00 . A A . 33 VAL HG21 1 1 8 4078 1 1 33 VAL HG22 H -5.023 5.815 -0.642 1.00 . A A . 33 VAL HG22 1 1 8 4079 1 1 33 VAL HG23 H -5.043 7.243 0.393 1.00 . A A . 33 VAL HG23 1 1 8 4080 1 1 33 VAL N N -5.088 3.700 0.384 1.00 . A A . 33 VAL N 1 1 8 4081 1 1 33 VAL O O -7.149 3.203 2.482 1.00 . A A . 33 VAL O 1 1 8 4082 1 1 34 GLU C C -7.367 3.487 5.408 1.00 . A A . 34 GLU C 1 1 8 4083 1 1 34 GLU CA C -6.044 2.859 4.946 1.00 . A A . 34 GLU CA 1 1 8 4084 1 1 34 GLU CB C -4.999 2.897 6.076 1.00 . A A . 34 GLU CB 1 1 8 4085 1 1 34 GLU CD C -3.146 4.566 6.326 1.00 . A A . 34 GLU CD 1 1 8 4086 1 1 34 GLU CG C -4.656 4.348 6.440 1.00 . A A . 34 GLU CG 1 1 8 4087 1 1 34 GLU H H -4.583 4.093 3.938 1.00 . A A . 34 GLU H 1 1 8 4088 1 1 34 GLU HA H -6.206 1.838 4.637 1.00 . A A . 34 GLU HA 1 1 8 4089 1 1 34 GLU HB2 H -5.397 2.394 6.946 1.00 . A A . 34 GLU HB2 1 1 8 4090 1 1 34 GLU HB3 H -4.103 2.388 5.751 1.00 . A A . 34 GLU HB3 1 1 8 4091 1 1 34 GLU HG2 H -5.167 5.020 5.766 1.00 . A A . 34 GLU HG2 1 1 8 4092 1 1 34 GLU HG3 H -4.971 4.549 7.453 1.00 . A A . 34 GLU HG3 1 1 8 4093 1 1 34 GLU N N -5.449 3.648 3.819 1.00 . A A . 34 GLU N 1 1 8 4094 1 1 34 GLU O O -7.399 4.601 5.896 1.00 . A A . 34 GLU O 1 1 8 4095 1 1 34 GLU OE1 O -2.689 4.843 5.228 1.00 . A A . 34 GLU OE1 1 1 8 4096 1 1 34 GLU OE2 O -2.471 4.451 7.336 1.00 . A A . 34 GLU OE2 1 1 8 4097 1 1 35 ALA C C -10.078 4.665 5.027 1.00 . A A . 35 ALA C 1 1 8 4098 1 1 35 ALA CA C -9.800 3.296 5.673 1.00 . A A . 35 ALA CA 1 1 8 4099 1 1 35 ALA CB C -9.724 3.417 7.200 1.00 . A A . 35 ALA CB 1 1 8 4100 1 1 35 ALA H H -8.398 1.876 4.855 1.00 . A A . 35 ALA H 1 1 8 4101 1 1 35 ALA HA H -10.575 2.594 5.404 1.00 . A A . 35 ALA HA 1 1 8 4102 1 1 35 ALA HB1 H -9.331 4.388 7.466 1.00 . A A . 35 ALA HB1 1 1 8 4103 1 1 35 ALA HB2 H -9.074 2.648 7.591 1.00 . A A . 35 ALA HB2 1 1 8 4104 1 1 35 ALA HB3 H -10.711 3.301 7.621 1.00 . A A . 35 ALA HB3 1 1 8 4105 1 1 35 ALA N N -8.459 2.768 5.252 1.00 . A A . 35 ALA N 1 1 8 4106 1 1 35 ALA O O -9.800 5.696 5.613 1.00 . A A . 35 ALA O 1 1 8 4107 1 1 36 PRO C C -12.125 6.607 3.745 1.00 . A A . 36 PRO C 1 1 8 4108 1 1 36 PRO CA C -10.934 5.886 3.099 1.00 . A A . 36 PRO CA 1 1 8 4109 1 1 36 PRO CB C -11.278 5.404 1.689 1.00 . A A . 36 PRO CB 1 1 8 4110 1 1 36 PRO CD C -10.990 3.436 3.057 1.00 . A A . 36 PRO CD 1 1 8 4111 1 1 36 PRO CG C -11.726 3.989 1.863 1.00 . A A . 36 PRO CG 1 1 8 4112 1 1 36 PRO HA H -10.071 6.531 3.066 1.00 . A A . 36 PRO HA 1 1 8 4113 1 1 36 PRO HB2 H -12.074 6.006 1.273 1.00 . A A . 36 PRO HB2 1 1 8 4114 1 1 36 PRO HB3 H -10.407 5.440 1.056 1.00 . A A . 36 PRO HB3 1 1 8 4115 1 1 36 PRO HD2 H -11.640 2.793 3.635 1.00 . A A . 36 PRO HD2 1 1 8 4116 1 1 36 PRO HD3 H -10.104 2.905 2.746 1.00 . A A . 36 PRO HD3 1 1 8 4117 1 1 36 PRO HG2 H -12.793 3.959 2.038 1.00 . A A . 36 PRO HG2 1 1 8 4118 1 1 36 PRO HG3 H -11.479 3.413 0.986 1.00 . A A . 36 PRO HG3 1 1 8 4119 1 1 36 PRO N N -10.620 4.629 3.831 1.00 . A A . 36 PRO N 1 1 8 4120 1 1 36 PRO O O -13.127 5.955 3.999 1.00 . A A . 36 PRO O 1 1 9 4121 1 1 1 ASP C C 11.141 11.151 -4.004 1.00 . A A . 1 ASP C 1 1 9 4122 1 1 1 ASP CA C 11.277 11.926 -5.323 1.00 . A A . 1 ASP CA 1 1 9 4123 1 1 1 ASP CB C 11.676 13.383 -5.062 1.00 . A A . 1 ASP CB 1 1 9 4124 1 1 1 ASP CG C 12.409 13.940 -6.285 1.00 . A A . 1 ASP CG 1 1 9 4125 1 1 1 ASP H1 H 9.626 11.036 -6.238 1.00 . A A . 1 ASP H1 1 1 9 4126 1 1 1 ASP H2 H 10.053 12.541 -6.898 1.00 . A A . 1 ASP H2 1 1 9 4127 1 1 1 ASP H3 H 9.261 12.463 -5.397 1.00 . A A . 1 ASP H3 1 1 9 4128 1 1 1 ASP HA H 12.009 11.453 -5.961 1.00 . A A . 1 ASP HA 1 1 9 4129 1 1 1 ASP HB2 H 10.789 13.972 -4.872 1.00 . A A . 1 ASP HB2 1 1 9 4130 1 1 1 ASP HB3 H 12.329 13.431 -4.203 1.00 . A A . 1 ASP HB3 1 1 9 4131 1 1 1 ASP N N 9.954 11.998 -6.016 1.00 . A A . 1 ASP N 1 1 9 4132 1 1 1 ASP O O 10.980 11.732 -2.946 1.00 . A A . 1 ASP O 1 1 9 4133 1 1 1 ASP OD1 O 11.742 14.453 -7.168 1.00 . A A . 1 ASP OD1 1 1 9 4134 1 1 1 ASP OD2 O 13.626 13.843 -6.316 1.00 . A A . 1 ASP OD2 1 1 9 4135 1 1 2 GLY C C 10.453 7.667 -3.152 1.00 . A A . 2 GLY C 1 1 9 4136 1 1 2 GLY CA C 11.079 9.026 -2.819 1.00 . A A . 2 GLY CA 1 1 9 4137 1 1 2 GLY H H 11.334 9.401 -4.929 1.00 . A A . 2 GLY H 1 1 9 4138 1 1 2 GLY HA2 H 12.058 8.874 -2.389 1.00 . A A . 2 GLY HA2 1 1 9 4139 1 1 2 GLY HA3 H 10.451 9.542 -2.110 1.00 . A A . 2 GLY HA3 1 1 9 4140 1 1 2 GLY N N 11.204 9.845 -4.064 1.00 . A A . 2 GLY N 1 1 9 4141 1 1 2 GLY O O 9.689 7.539 -4.093 1.00 . A A . 2 GLY O 1 1 9 4142 1 1 3 GLU C C 8.737 5.239 -2.158 1.00 . A A . 3 GLU C 1 1 9 4143 1 1 3 GLU CA C 10.191 5.298 -2.647 1.00 . A A . 3 GLU CA 1 1 9 4144 1 1 3 GLU CB C 11.074 4.324 -1.860 1.00 . A A . 3 GLU CB 1 1 9 4145 1 1 3 GLU CD C 12.183 2.081 -1.967 1.00 . A A . 3 GLU CD 1 1 9 4146 1 1 3 GLU CG C 11.547 3.205 -2.791 1.00 . A A . 3 GLU CG 1 1 9 4147 1 1 3 GLU H H 11.381 6.786 -1.630 1.00 . A A . 3 GLU H 1 1 9 4148 1 1 3 GLU HA H 10.240 5.070 -3.699 1.00 . A A . 3 GLU HA 1 1 9 4149 1 1 3 GLU HB2 H 11.931 4.852 -1.465 1.00 . A A . 3 GLU HB2 1 1 9 4150 1 1 3 GLU HB3 H 10.507 3.898 -1.047 1.00 . A A . 3 GLU HB3 1 1 9 4151 1 1 3 GLU HG2 H 10.703 2.814 -3.341 1.00 . A A . 3 GLU HG2 1 1 9 4152 1 1 3 GLU HG3 H 12.278 3.598 -3.482 1.00 . A A . 3 GLU HG3 1 1 9 4153 1 1 3 GLU N N 10.767 6.654 -2.383 1.00 . A A . 3 GLU N 1 1 9 4154 1 1 3 GLU O O 8.474 5.095 -0.977 1.00 . A A . 3 GLU O 1 1 9 4155 1 1 3 GLU OE1 O 13.238 2.313 -1.395 1.00 . A A . 3 GLU OE1 1 1 9 4156 1 1 3 GLU OE2 O 11.606 1.007 -1.923 1.00 . A A . 3 GLU OE2 1 1 9 4157 1 1 4 CYS C C 5.554 4.467 -3.670 1.00 . A A . 4 CYS C 1 1 9 4158 1 1 4 CYS CA C 6.356 5.314 -2.667 1.00 . A A . 4 CYS CA 1 1 9 4159 1 1 4 CYS CB C 5.910 6.785 -2.672 1.00 . A A . 4 CYS CB 1 1 9 4160 1 1 4 CYS H H 8.039 5.474 -4.004 1.00 . A A . 4 CYS H 1 1 9 4161 1 1 4 CYS HA H 6.255 4.906 -1.672 1.00 . A A . 4 CYS HA 1 1 9 4162 1 1 4 CYS HB2 H 5.692 7.094 -1.661 1.00 . A A . 4 CYS HB2 1 1 9 4163 1 1 4 CYS HB3 H 6.708 7.398 -3.065 1.00 . A A . 4 CYS HB3 1 1 9 4164 1 1 4 CYS N N 7.796 5.355 -3.061 1.00 . A A . 4 CYS N 1 1 9 4165 1 1 4 CYS O O 5.981 4.240 -4.787 1.00 . A A . 4 CYS O 1 1 9 4166 1 1 4 CYS SG S 4.428 7.008 -3.691 1.00 . A A . 4 CYS SG 1 1 9 4167 1 1 5 GLY C C 2.480 4.027 -4.839 1.00 . A A . 5 GLY C 1 1 9 4168 1 1 5 GLY CA C 3.560 3.162 -4.178 1.00 . A A . 5 GLY CA 1 1 9 4169 1 1 5 GLY H H 4.082 4.192 -2.370 1.00 . A A . 5 GLY H 1 1 9 4170 1 1 5 GLY HA2 H 4.188 2.721 -4.936 1.00 . A A . 5 GLY HA2 1 1 9 4171 1 1 5 GLY HA3 H 3.087 2.379 -3.602 1.00 . A A . 5 GLY HA3 1 1 9 4172 1 1 5 GLY N N 4.398 3.997 -3.271 1.00 . A A . 5 GLY N 1 1 9 4173 1 1 5 GLY O O 2.752 5.108 -5.329 1.00 . A A . 5 GLY O 1 1 9 4174 1 1 6 GLY C C -1.151 4.114 -4.699 1.00 . A A . 6 GLY C 1 1 9 4175 1 1 6 GLY CA C 0.147 4.335 -5.487 1.00 . A A . 6 GLY CA 1 1 9 4176 1 1 6 GLY H H 1.069 2.679 -4.462 1.00 . A A . 6 GLY H 1 1 9 4177 1 1 6 GLY HA2 H 0.401 5.386 -5.482 1.00 . A A . 6 GLY HA2 1 1 9 4178 1 1 6 GLY HA3 H 0.007 4.008 -6.506 1.00 . A A . 6 GLY HA3 1 1 9 4179 1 1 6 GLY N N 1.257 3.553 -4.859 1.00 . A A . 6 GLY N 1 1 9 4180 1 1 6 GLY O O -1.127 3.874 -3.508 1.00 . A A . 6 GLY O 1 1 9 4181 1 1 7 PHE C C -3.964 2.511 -4.559 1.00 . A A . 7 PHE C 1 1 9 4182 1 1 7 PHE CA C -3.591 4.000 -4.645 1.00 . A A . 7 PHE CA 1 1 9 4183 1 1 7 PHE CB C -4.624 4.764 -5.481 1.00 . A A . 7 PHE CB 1 1 9 4184 1 1 7 PHE CD1 C -6.258 5.625 -3.762 1.00 . A A . 7 PHE CD1 1 1 9 4185 1 1 7 PHE CD2 C -6.925 3.772 -5.175 1.00 . A A . 7 PHE CD2 1 1 9 4186 1 1 7 PHE CE1 C -7.502 5.583 -3.119 1.00 . A A . 7 PHE CE1 1 1 9 4187 1 1 7 PHE CE2 C -8.168 3.729 -4.533 1.00 . A A . 7 PHE CE2 1 1 9 4188 1 1 7 PHE CG C -5.969 4.721 -4.789 1.00 . A A . 7 PHE CG 1 1 9 4189 1 1 7 PHE CZ C -8.457 4.634 -3.505 1.00 . A A . 7 PHE CZ 1 1 9 4190 1 1 7 PHE H H -2.279 4.394 -6.318 1.00 . A A . 7 PHE H 1 1 9 4191 1 1 7 PHE HA H -3.543 4.423 -3.656 1.00 . A A . 7 PHE HA 1 1 9 4192 1 1 7 PHE HB2 H -4.309 5.792 -5.589 1.00 . A A . 7 PHE HB2 1 1 9 4193 1 1 7 PHE HB3 H -4.708 4.309 -6.456 1.00 . A A . 7 PHE HB3 1 1 9 4194 1 1 7 PHE HD1 H -5.522 6.358 -3.463 1.00 . A A . 7 PHE HD1 1 1 9 4195 1 1 7 PHE HD2 H -6.704 3.072 -5.968 1.00 . A A . 7 PHE HD2 1 1 9 4196 1 1 7 PHE HE1 H -7.725 6.281 -2.326 1.00 . A A . 7 PHE HE1 1 1 9 4197 1 1 7 PHE HE2 H -8.905 2.998 -4.831 1.00 . A A . 7 PHE HE2 1 1 9 4198 1 1 7 PHE HZ H -9.416 4.601 -3.010 1.00 . A A . 7 PHE HZ 1 1 9 4199 1 1 7 PHE N N -2.285 4.198 -5.357 1.00 . A A . 7 PHE N 1 1 9 4200 1 1 7 PHE O O -4.705 2.105 -3.683 1.00 . A A . 7 PHE O 1 1 9 4201 1 1 8 TRP C C -2.626 -0.589 -5.960 1.00 . A A . 8 TRP C 1 1 9 4202 1 1 8 TRP CA C -3.798 0.237 -5.409 1.00 . A A . 8 TRP CA 1 1 9 4203 1 1 8 TRP CB C -5.061 0.075 -6.276 1.00 . A A . 8 TRP CB 1 1 9 4204 1 1 8 TRP CD1 C -4.657 1.824 -8.070 1.00 . A A . 8 TRP CD1 1 1 9 4205 1 1 8 TRP CD2 C -4.689 -0.268 -8.895 1.00 . A A . 8 TRP CD2 1 1 9 4206 1 1 8 TRP CE2 C -4.456 0.599 -9.989 1.00 . A A . 8 TRP CE2 1 1 9 4207 1 1 8 TRP CE3 C -4.756 -1.650 -9.149 1.00 . A A . 8 TRP CE3 1 1 9 4208 1 1 8 TRP CG C -4.809 0.535 -7.684 1.00 . A A . 8 TRP CG 1 1 9 4209 1 1 8 TRP CH2 C -4.363 -1.264 -11.521 1.00 . A A . 8 TRP CH2 1 1 9 4210 1 1 8 TRP CZ2 C -4.294 0.113 -11.287 1.00 . A A . 8 TRP CZ2 1 1 9 4211 1 1 8 TRP CZ3 C -4.594 -2.143 -10.454 1.00 . A A . 8 TRP CZ3 1 1 9 4212 1 1 8 TRP H H -2.868 2.038 -6.151 1.00 . A A . 8 TRP H 1 1 9 4213 1 1 8 TRP HA H -4.013 -0.060 -4.394 1.00 . A A . 8 TRP HA 1 1 9 4214 1 1 8 TRP HB2 H -5.351 -0.965 -6.290 1.00 . A A . 8 TRP HB2 1 1 9 4215 1 1 8 TRP HB3 H -5.863 0.660 -5.847 1.00 . A A . 8 TRP HB3 1 1 9 4216 1 1 8 TRP HD1 H -4.693 2.683 -7.417 1.00 . A A . 8 TRP HD1 1 1 9 4217 1 1 8 TRP HE1 H -4.300 2.675 -9.962 1.00 . A A . 8 TRP HE1 1 1 9 4218 1 1 8 TRP HE3 H -4.932 -2.338 -8.334 1.00 . A A . 8 TRP HE3 1 1 9 4219 1 1 8 TRP HH2 H -4.240 -1.649 -12.522 1.00 . A A . 8 TRP HH2 1 1 9 4220 1 1 8 TRP HZ2 H -4.117 0.794 -12.106 1.00 . A A . 8 TRP HZ2 1 1 9 4221 1 1 8 TRP HZ3 H -4.647 -3.207 -10.638 1.00 . A A . 8 TRP HZ3 1 1 9 4222 1 1 8 TRP N N -3.463 1.695 -5.452 1.00 . A A . 8 TRP N 1 1 9 4223 1 1 8 TRP NE1 N -4.443 1.862 -9.435 1.00 . A A . 8 TRP NE1 1 1 9 4224 1 1 8 TRP O O -2.755 -1.302 -6.939 1.00 . A A . 8 TRP O 1 1 9 4225 1 1 9 TRP C C -0.213 -2.603 -5.055 1.00 . A A . 9 TRP C 1 1 9 4226 1 1 9 TRP CA C -0.296 -1.277 -5.813 1.00 . A A . 9 TRP CA 1 1 9 4227 1 1 9 TRP CB C 0.918 -0.392 -5.513 1.00 . A A . 9 TRP CB 1 1 9 4228 1 1 9 TRP CD1 C -0.118 1.338 -7.056 1.00 . A A . 9 TRP CD1 1 1 9 4229 1 1 9 TRP CD2 C 2.126 1.472 -6.984 1.00 . A A . 9 TRP CD2 1 1 9 4230 1 1 9 TRP CE2 C 1.682 2.489 -7.862 1.00 . A A . 9 TRP CE2 1 1 9 4231 1 1 9 TRP CE3 C 3.509 1.343 -6.768 1.00 . A A . 9 TRP CE3 1 1 9 4232 1 1 9 TRP CG C 0.963 0.756 -6.479 1.00 . A A . 9 TRP CG 1 1 9 4233 1 1 9 TRP CH2 C 3.944 3.208 -8.272 1.00 . A A . 9 TRP CH2 1 1 9 4234 1 1 9 TRP CZ2 C 2.573 3.347 -8.498 1.00 . A A . 9 TRP CZ2 1 1 9 4235 1 1 9 TRP CZ3 C 4.413 2.206 -7.410 1.00 . A A . 9 TRP CZ3 1 1 9 4236 1 1 9 TRP H H -1.404 0.077 -4.536 1.00 . A A . 9 TRP H 1 1 9 4237 1 1 9 TRP HA H -0.369 -1.457 -6.875 1.00 . A A . 9 TRP HA 1 1 9 4238 1 1 9 TRP HB2 H 0.843 -0.006 -4.505 1.00 . A A . 9 TRP HB2 1 1 9 4239 1 1 9 TRP HB3 H 1.824 -0.973 -5.606 1.00 . A A . 9 TRP HB3 1 1 9 4240 1 1 9 TRP HD1 H -1.145 1.049 -6.903 1.00 . A A . 9 TRP HD1 1 1 9 4241 1 1 9 TRP HE1 H -0.275 2.945 -8.404 1.00 . A A . 9 TRP HE1 1 1 9 4242 1 1 9 TRP HE3 H 3.879 0.575 -6.105 1.00 . A A . 9 TRP HE3 1 1 9 4243 1 1 9 TRP HH2 H 4.642 3.867 -8.764 1.00 . A A . 9 TRP HH2 1 1 9 4244 1 1 9 TRP HZ2 H 2.204 4.118 -9.153 1.00 . A A . 9 TRP HZ2 1 1 9 4245 1 1 9 TRP HZ3 H 5.473 2.099 -7.236 1.00 . A A . 9 TRP HZ3 1 1 9 4246 1 1 9 TRP N N -1.483 -0.501 -5.331 1.00 . A A . 9 TRP N 1 1 9 4247 1 1 9 TRP NE1 N 0.310 2.363 -7.874 1.00 . A A . 9 TRP NE1 1 1 9 4248 1 1 9 TRP O O -0.716 -2.718 -3.961 1.00 . A A . 9 TRP O 1 1 9 4249 1 1 10 LYS C C 1.696 -5.011 -4.015 1.00 . A A . 10 LYS C 1 1 9 4250 1 1 10 LYS CA C 0.462 -4.926 -4.911 1.00 . A A . 10 LYS CA 1 1 9 4251 1 1 10 LYS CB C 0.552 -5.985 -6.008 1.00 . A A . 10 LYS CB 1 1 9 4252 1 1 10 LYS CD C -1.178 -6.485 -7.749 1.00 . A A . 10 LYS CD 1 1 9 4253 1 1 10 LYS CE C -1.729 -5.089 -8.057 1.00 . A A . 10 LYS CE 1 1 9 4254 1 1 10 LYS CG C -0.835 -6.585 -6.261 1.00 . A A . 10 LYS CG 1 1 9 4255 1 1 10 LYS H H 0.788 -3.510 -6.516 1.00 . A A . 10 LYS H 1 1 9 4256 1 1 10 LYS HA H -0.432 -5.080 -4.330 1.00 . A A . 10 LYS HA 1 1 9 4257 1 1 10 LYS HB2 H 0.926 -5.532 -6.914 1.00 . A A . 10 LYS HB2 1 1 9 4258 1 1 10 LYS HB3 H 1.229 -6.768 -5.693 1.00 . A A . 10 LYS HB3 1 1 9 4259 1 1 10 LYS HD2 H -0.287 -6.658 -8.337 1.00 . A A . 10 LYS HD2 1 1 9 4260 1 1 10 LYS HD3 H -1.923 -7.226 -7.996 1.00 . A A . 10 LYS HD3 1 1 9 4261 1 1 10 LYS HE2 H -2.218 -4.679 -7.183 1.00 . A A . 10 LYS HE2 1 1 9 4262 1 1 10 LYS HE3 H -0.937 -4.436 -8.387 1.00 . A A . 10 LYS HE3 1 1 9 4263 1 1 10 LYS HG2 H -0.836 -7.622 -5.960 1.00 . A A . 10 LYS HG2 1 1 9 4264 1 1 10 LYS HG3 H -1.572 -6.043 -5.687 1.00 . A A . 10 LYS HG3 1 1 9 4265 1 1 10 LYS HZ1 H -3.498 -5.886 -8.817 1.00 . A A . 10 LYS HZ1 1 1 9 4266 1 1 10 LYS HZ2 H -2.247 -5.759 -9.961 1.00 . A A . 10 LYS HZ2 1 1 9 4267 1 1 10 LYS HZ3 H -3.089 -4.371 -9.462 1.00 . A A . 10 LYS HZ3 1 1 9 4268 1 1 10 LYS N N 0.395 -3.612 -5.624 1.00 . A A . 10 LYS N 1 1 9 4269 1 1 10 LYS NZ N -2.715 -5.293 -9.156 1.00 . A A . 10 LYS NZ 1 1 9 4270 1 1 10 LYS O O 2.800 -4.709 -4.425 1.00 . A A . 10 LYS O 1 1 9 4271 1 1 11 CYS C C 2.390 -6.703 -0.846 1.00 . A A . 11 CYS C 1 1 9 4272 1 1 11 CYS CA C 2.658 -5.580 -1.859 1.00 . A A . 11 CYS CA 1 1 9 4273 1 1 11 CYS CB C 2.772 -4.227 -1.153 1.00 . A A . 11 CYS CB 1 1 9 4274 1 1 11 CYS H H 0.609 -5.695 -2.499 1.00 . A A . 11 CYS H 1 1 9 4275 1 1 11 CYS HA H 3.559 -5.782 -2.415 1.00 . A A . 11 CYS HA 1 1 9 4276 1 1 11 CYS HB2 H 3.644 -4.225 -0.519 1.00 . A A . 11 CYS HB2 1 1 9 4277 1 1 11 CYS HB3 H 2.862 -3.443 -1.889 1.00 . A A . 11 CYS HB3 1 1 9 4278 1 1 11 CYS N N 1.508 -5.444 -2.795 1.00 . A A . 11 CYS N 1 1 9 4279 1 1 11 CYS O O 1.310 -7.263 -0.800 1.00 . A A . 11 CYS O 1 1 9 4280 1 1 11 CYS SG S 1.306 -3.927 -0.137 1.00 . A A . 11 CYS SG 1 1 9 4281 1 1 12 GLY C C 2.545 -7.521 2.251 1.00 . A A . 12 GLY C 1 1 9 4282 1 1 12 GLY CA C 3.164 -8.115 0.981 1.00 . A A . 12 GLY CA 1 1 9 4283 1 1 12 GLY H H 4.223 -6.568 -0.081 1.00 . A A . 12 GLY H 1 1 9 4284 1 1 12 GLY HA2 H 2.503 -8.871 0.577 1.00 . A A . 12 GLY HA2 1 1 9 4285 1 1 12 GLY HA3 H 4.115 -8.563 1.224 1.00 . A A . 12 GLY HA3 1 1 9 4286 1 1 12 GLY N N 3.363 -7.034 -0.031 1.00 . A A . 12 GLY N 1 1 9 4287 1 1 12 GLY O O 1.587 -6.771 2.191 1.00 . A A . 12 GLY O 1 1 9 4288 1 1 13 ARG C C 3.250 -5.971 5.022 1.00 . A A . 13 ARG C 1 1 9 4289 1 1 13 ARG CA C 2.540 -7.291 4.676 1.00 . A A . 13 ARG CA 1 1 9 4290 1 1 13 ARG CB C 2.830 -8.364 5.734 1.00 . A A . 13 ARG CB 1 1 9 4291 1 1 13 ARG CD C 2.336 -8.284 8.188 1.00 . A A . 13 ARG CD 1 1 9 4292 1 1 13 ARG CG C 1.720 -8.364 6.787 1.00 . A A . 13 ARG CG 1 1 9 4293 1 1 13 ARG CZ C 0.749 -9.488 9.572 1.00 . A A . 13 ARG CZ 1 1 9 4294 1 1 13 ARG H H 3.864 -8.446 3.420 1.00 . A A . 13 ARG H 1 1 9 4295 1 1 13 ARG HA H 1.475 -7.134 4.592 1.00 . A A . 13 ARG HA 1 1 9 4296 1 1 13 ARG HB2 H 2.875 -9.334 5.258 1.00 . A A . 13 ARG HB2 1 1 9 4297 1 1 13 ARG HB3 H 3.777 -8.153 6.210 1.00 . A A . 13 ARG HB3 1 1 9 4298 1 1 13 ARG HD2 H 3.416 -8.278 8.122 1.00 . A A . 13 ARG HD2 1 1 9 4299 1 1 13 ARG HD3 H 1.986 -7.404 8.705 1.00 . A A . 13 ARG HD3 1 1 9 4300 1 1 13 ARG HE H 2.391 -10.336 8.845 1.00 . A A . 13 ARG HE 1 1 9 4301 1 1 13 ARG HG2 H 1.073 -7.513 6.630 1.00 . A A . 13 ARG HG2 1 1 9 4302 1 1 13 ARG HG3 H 1.144 -9.274 6.702 1.00 . A A . 13 ARG HG3 1 1 9 4303 1 1 13 ARG HH11 H 1.476 -8.306 11.021 1.00 . A A . 13 ARG HH11 1 1 9 4304 1 1 13 ARG HH12 H -0.176 -8.790 11.210 1.00 . A A . 13 ARG HH12 1 1 9 4305 1 1 13 ARG HH21 H -0.242 -10.659 8.280 1.00 . A A . 13 ARG HH21 1 1 9 4306 1 1 13 ARG HH22 H -1.152 -10.126 9.654 1.00 . A A . 13 ARG HH22 1 1 9 4307 1 1 13 ARG N N 3.091 -7.844 3.399 1.00 . A A . 13 ARG N 1 1 9 4308 1 1 13 ARG NE N 1.865 -9.510 8.891 1.00 . A A . 13 ARG NE 1 1 9 4309 1 1 13 ARG NH1 N 0.677 -8.809 10.688 1.00 . A A . 13 ARG NH1 1 1 9 4310 1 1 13 ARG NH2 N -0.297 -10.142 9.134 1.00 . A A . 13 ARG NH2 1 1 9 4311 1 1 13 ARG O O 3.787 -5.807 6.103 1.00 . A A . 13 ARG O 1 1 9 4312 1 1 14 GLY C C 5.424 -3.841 4.043 1.00 . A A . 14 GLY C 1 1 9 4313 1 1 14 GLY CA C 3.929 -3.727 4.364 1.00 . A A . 14 GLY CA 1 1 9 4314 1 1 14 GLY H H 2.819 -5.192 3.242 1.00 . A A . 14 GLY H 1 1 9 4315 1 1 14 GLY HA2 H 3.483 -2.964 3.741 1.00 . A A . 14 GLY HA2 1 1 9 4316 1 1 14 GLY HA3 H 3.808 -3.459 5.403 1.00 . A A . 14 GLY HA3 1 1 9 4317 1 1 14 GLY N N 3.256 -5.034 4.105 1.00 . A A . 14 GLY N 1 1 9 4318 1 1 14 GLY O O 6.257 -3.326 4.763 1.00 . A A . 14 GLY O 1 1 9 4319 1 1 15 LYS C C 7.712 -3.395 1.869 1.00 . A A . 15 LYS C 1 1 9 4320 1 1 15 LYS CA C 7.213 -4.652 2.604 1.00 . A A . 15 LYS CA 1 1 9 4321 1 1 15 LYS CB C 7.291 -5.892 1.702 1.00 . A A . 15 LYS CB 1 1 9 4322 1 1 15 LYS CD C 9.396 -7.243 1.762 1.00 . A A . 15 LYS CD 1 1 9 4323 1 1 15 LYS CE C 10.316 -8.013 2.715 1.00 . A A . 15 LYS CE 1 1 9 4324 1 1 15 LYS CG C 8.039 -7.010 2.433 1.00 . A A . 15 LYS CG 1 1 9 4325 1 1 15 LYS H H 5.078 -4.915 2.401 1.00 . A A . 15 LYS H 1 1 9 4326 1 1 15 LYS HA H 7.798 -4.813 3.489 1.00 . A A . 15 LYS HA 1 1 9 4327 1 1 15 LYS HB2 H 6.293 -6.226 1.459 1.00 . A A . 15 LYS HB2 1 1 9 4328 1 1 15 LYS HB3 H 7.818 -5.645 0.794 1.00 . A A . 15 LYS HB3 1 1 9 4329 1 1 15 LYS HD2 H 9.255 -7.816 0.856 1.00 . A A . 15 LYS HD2 1 1 9 4330 1 1 15 LYS HD3 H 9.845 -6.292 1.521 1.00 . A A . 15 LYS HD3 1 1 9 4331 1 1 15 LYS HE2 H 10.184 -7.661 3.729 1.00 . A A . 15 LYS HE2 1 1 9 4332 1 1 15 LYS HE3 H 10.117 -9.072 2.655 1.00 . A A . 15 LYS HE3 1 1 9 4333 1 1 15 LYS HG2 H 8.191 -6.728 3.466 1.00 . A A . 15 LYS HG2 1 1 9 4334 1 1 15 LYS HG3 H 7.459 -7.920 2.389 1.00 . A A . 15 LYS HG3 1 1 9 4335 1 1 15 LYS HZ1 H 11.797 -8.030 1.248 1.00 . A A . 15 LYS HZ1 1 1 9 4336 1 1 15 LYS HZ2 H 12.382 -8.245 2.828 1.00 . A A . 15 LYS HZ2 1 1 9 4337 1 1 15 LYS HZ3 H 11.887 -6.705 2.306 1.00 . A A . 15 LYS HZ3 1 1 9 4338 1 1 15 LYS N N 5.768 -4.510 2.968 1.00 . A A . 15 LYS N 1 1 9 4339 1 1 15 LYS NZ N 11.700 -7.726 2.238 1.00 . A A . 15 LYS NZ 1 1 9 4340 1 1 15 LYS O O 8.609 -2.726 2.347 1.00 . A A . 15 LYS O 1 1 9 4341 1 1 16 PRO C C 6.941 -0.638 0.590 1.00 . A A . 16 PRO C 1 1 9 4342 1 1 16 PRO CA C 7.508 -1.912 -0.054 1.00 . A A . 16 PRO CA 1 1 9 4343 1 1 16 PRO CB C 6.873 -2.156 -1.419 1.00 . A A . 16 PRO CB 1 1 9 4344 1 1 16 PRO CD C 6.029 -3.854 0.088 1.00 . A A . 16 PRO CD 1 1 9 4345 1 1 16 PRO CG C 5.713 -3.061 -1.155 1.00 . A A . 16 PRO CG 1 1 9 4346 1 1 16 PRO HA H 8.581 -1.853 -0.147 1.00 . A A . 16 PRO HA 1 1 9 4347 1 1 16 PRO HB2 H 6.536 -1.222 -1.847 1.00 . A A . 16 PRO HB2 1 1 9 4348 1 1 16 PRO HB3 H 7.576 -2.640 -2.079 1.00 . A A . 16 PRO HB3 1 1 9 4349 1 1 16 PRO HD2 H 5.166 -3.904 0.736 1.00 . A A . 16 PRO HD2 1 1 9 4350 1 1 16 PRO HD3 H 6.368 -4.845 -0.170 1.00 . A A . 16 PRO HD3 1 1 9 4351 1 1 16 PRO HG2 H 4.819 -2.474 -1.002 1.00 . A A . 16 PRO HG2 1 1 9 4352 1 1 16 PRO HG3 H 5.573 -3.734 -1.988 1.00 . A A . 16 PRO HG3 1 1 9 4353 1 1 16 PRO N N 7.113 -3.107 0.735 1.00 . A A . 16 PRO N 1 1 9 4354 1 1 16 PRO O O 5.820 -0.635 1.066 1.00 . A A . 16 PRO O 1 1 9 4355 1 1 17 PRO C C 6.251 2.378 0.296 1.00 . A A . 17 PRO C 1 1 9 4356 1 1 17 PRO CA C 7.301 1.696 1.183 1.00 . A A . 17 PRO CA 1 1 9 4357 1 1 17 PRO CB C 8.583 2.521 1.231 1.00 . A A . 17 PRO CB 1 1 9 4358 1 1 17 PRO CD C 9.098 0.487 0.039 1.00 . A A . 17 PRO CD 1 1 9 4359 1 1 17 PRO CG C 9.454 1.945 0.160 1.00 . A A . 17 PRO CG 1 1 9 4360 1 1 17 PRO HA H 6.921 1.547 2.180 1.00 . A A . 17 PRO HA 1 1 9 4361 1 1 17 PRO HB2 H 8.367 3.561 1.024 1.00 . A A . 17 PRO HB2 1 1 9 4362 1 1 17 PRO HB3 H 9.062 2.419 2.191 1.00 . A A . 17 PRO HB3 1 1 9 4363 1 1 17 PRO HD2 H 9.111 0.179 -0.998 1.00 . A A . 17 PRO HD2 1 1 9 4364 1 1 17 PRO HD3 H 9.770 -0.120 0.625 1.00 . A A . 17 PRO HD3 1 1 9 4365 1 1 17 PRO HG2 H 9.267 2.452 -0.777 1.00 . A A . 17 PRO HG2 1 1 9 4366 1 1 17 PRO HG3 H 10.493 2.044 0.434 1.00 . A A . 17 PRO HG3 1 1 9 4367 1 1 17 PRO N N 7.736 0.406 0.588 1.00 . A A . 17 PRO N 1 1 9 4368 1 1 17 PRO O O 6.538 2.801 -0.808 1.00 . A A . 17 PRO O 1 1 9 4369 1 1 18 CYS C C 4.056 4.685 0.153 1.00 . A A . 18 CYS C 1 1 9 4370 1 1 18 CYS CA C 3.968 3.164 -0.023 1.00 . A A . 18 CYS CA 1 1 9 4371 1 1 18 CYS CB C 2.644 2.641 0.546 1.00 . A A . 18 CYS CB 1 1 9 4372 1 1 18 CYS H H 4.836 2.155 1.672 1.00 . A A . 18 CYS H 1 1 9 4373 1 1 18 CYS HA H 4.056 2.897 -1.063 1.00 . A A . 18 CYS HA 1 1 9 4374 1 1 18 CYS HB2 H 2.841 1.870 1.276 1.00 . A A . 18 CYS HB2 1 1 9 4375 1 1 18 CYS HB3 H 2.108 3.452 1.016 1.00 . A A . 18 CYS HB3 1 1 9 4376 1 1 18 CYS N N 5.039 2.498 0.780 1.00 . A A . 18 CYS N 1 1 9 4377 1 1 18 CYS O O 4.858 5.186 0.920 1.00 . A A . 18 CYS O 1 1 9 4378 1 1 18 CYS SG S 1.640 1.959 -0.796 1.00 . A A . 18 CYS SG 1 1 9 4379 1 1 19 CYS C C 2.686 7.304 0.966 1.00 . A A . 19 CYS C 1 1 9 4380 1 1 19 CYS CA C 3.252 6.913 -0.403 1.00 . A A . 19 CYS CA 1 1 9 4381 1 1 19 CYS CB C 2.358 7.441 -1.529 1.00 . A A . 19 CYS CB 1 1 9 4382 1 1 19 CYS H H 2.581 4.998 -1.145 1.00 . A A . 19 CYS H 1 1 9 4383 1 1 19 CYS HA H 4.257 7.286 -0.518 1.00 . A A . 19 CYS HA 1 1 9 4384 1 1 19 CYS HB2 H 1.898 6.611 -2.046 1.00 . A A . 19 CYS HB2 1 1 9 4385 1 1 19 CYS HB3 H 1.588 8.074 -1.113 1.00 . A A . 19 CYS HB3 1 1 9 4386 1 1 19 CYS N N 3.226 5.424 -0.542 1.00 . A A . 19 CYS N 1 1 9 4387 1 1 19 CYS O O 1.877 6.592 1.532 1.00 . A A . 19 CYS O 1 1 9 4388 1 1 19 CYS SG S 3.354 8.400 -2.697 1.00 . A A . 19 CYS SG 1 1 9 4389 1 1 20 LYS C C 1.057 8.830 2.859 1.00 . A A . 20 LYS C 1 1 9 4390 1 1 20 LYS CA C 2.593 8.838 2.851 1.00 . A A . 20 LYS CA 1 1 9 4391 1 1 20 LYS CB C 3.143 10.251 3.085 1.00 . A A . 20 LYS CB 1 1 9 4392 1 1 20 LYS CD C 3.643 12.251 1.667 1.00 . A A . 20 LYS CD 1 1 9 4393 1 1 20 LYS CE C 3.117 13.662 1.941 1.00 . A A . 20 LYS CE 1 1 9 4394 1 1 20 LYS CG C 2.576 11.219 2.044 1.00 . A A . 20 LYS CG 1 1 9 4395 1 1 20 LYS H H 3.769 8.969 1.047 1.00 . A A . 20 LYS H 1 1 9 4396 1 1 20 LYS HA H 2.971 8.174 3.608 1.00 . A A . 20 LYS HA 1 1 9 4397 1 1 20 LYS HB2 H 2.863 10.584 4.073 1.00 . A A . 20 LYS HB2 1 1 9 4398 1 1 20 LYS HB3 H 4.220 10.233 3.006 1.00 . A A . 20 LYS HB3 1 1 9 4399 1 1 20 LYS HD2 H 4.533 12.077 2.254 1.00 . A A . 20 LYS HD2 1 1 9 4400 1 1 20 LYS HD3 H 3.880 12.155 0.618 1.00 . A A . 20 LYS HD3 1 1 9 4401 1 1 20 LYS HE2 H 2.563 14.027 1.087 1.00 . A A . 20 LYS HE2 1 1 9 4402 1 1 20 LYS HE3 H 2.496 13.668 2.823 1.00 . A A . 20 LYS HE3 1 1 9 4403 1 1 20 LYS HG2 H 2.279 10.668 1.163 1.00 . A A . 20 LYS HG2 1 1 9 4404 1 1 20 LYS HG3 H 1.716 11.725 2.457 1.00 . A A . 20 LYS HG3 1 1 9 4405 1 1 20 LYS HZ1 H 4.969 14.410 1.348 1.00 . A A . 20 LYS HZ1 1 1 9 4406 1 1 20 LYS HZ2 H 4.826 14.159 3.023 1.00 . A A . 20 LYS HZ2 1 1 9 4407 1 1 20 LYS HZ3 H 4.059 15.486 2.292 1.00 . A A . 20 LYS HZ3 1 1 9 4408 1 1 20 LYS N N 3.108 8.417 1.511 1.00 . A A . 20 LYS N 1 1 9 4409 1 1 20 LYS NZ N 4.335 14.491 2.167 1.00 . A A . 20 LYS NZ 1 1 9 4410 1 1 20 LYS O O 0.416 9.461 2.038 1.00 . A A . 20 LYS O 1 1 9 4411 1 1 21 GLY C C -1.510 6.680 3.292 1.00 . A A . 21 GLY C 1 1 9 4412 1 1 21 GLY CA C -1.023 8.030 3.841 1.00 . A A . 21 GLY CA 1 1 9 4413 1 1 21 GLY H H 1.009 7.599 4.414 1.00 . A A . 21 GLY H 1 1 9 4414 1 1 21 GLY HA2 H -1.338 8.134 4.870 1.00 . A A . 21 GLY HA2 1 1 9 4415 1 1 21 GLY HA3 H -1.451 8.828 3.253 1.00 . A A . 21 GLY HA3 1 1 9 4416 1 1 21 GLY N N 0.468 8.104 3.775 1.00 . A A . 21 GLY N 1 1 9 4417 1 1 21 GLY O O -2.578 6.213 3.643 1.00 . A A . 21 GLY O 1 1 9 4418 1 1 22 TYR C C -0.627 3.585 2.742 1.00 . A A . 22 TYR C 1 1 9 4419 1 1 22 TYR CA C -1.155 4.729 1.866 1.00 . A A . 22 TYR CA 1 1 9 4420 1 1 22 TYR CB C -0.513 4.664 0.474 1.00 . A A . 22 TYR CB 1 1 9 4421 1 1 22 TYR CD1 C -0.658 7.036 -0.386 1.00 . A A . 22 TYR CD1 1 1 9 4422 1 1 22 TYR CD2 C -2.126 5.357 -1.338 1.00 . A A . 22 TYR CD2 1 1 9 4423 1 1 22 TYR CE1 C -1.209 8.000 -1.236 1.00 . A A . 22 TYR CE1 1 1 9 4424 1 1 22 TYR CE2 C -2.674 6.323 -2.190 1.00 . A A . 22 TYR CE2 1 1 9 4425 1 1 22 TYR CG C -1.118 5.712 -0.434 1.00 . A A . 22 TYR CG 1 1 9 4426 1 1 22 TYR CZ C -2.216 7.643 -2.140 1.00 . A A . 22 TYR CZ 1 1 9 4427 1 1 22 TYR H H 0.120 6.437 2.167 1.00 . A A . 22 TYR H 1 1 9 4428 1 1 22 TYR HA H -2.230 4.677 1.780 1.00 . A A . 22 TYR HA 1 1 9 4429 1 1 22 TYR HB2 H 0.549 4.837 0.562 1.00 . A A . 22 TYR HB2 1 1 9 4430 1 1 22 TYR HB3 H -0.681 3.685 0.051 1.00 . A A . 22 TYR HB3 1 1 9 4431 1 1 22 TYR HD1 H 0.119 7.312 0.309 1.00 . A A . 22 TYR HD1 1 1 9 4432 1 1 22 TYR HD2 H -2.483 4.340 -1.376 1.00 . A A . 22 TYR HD2 1 1 9 4433 1 1 22 TYR HE1 H -0.855 9.020 -1.198 1.00 . A A . 22 TYR HE1 1 1 9 4434 1 1 22 TYR HE2 H -3.452 6.050 -2.887 1.00 . A A . 22 TYR HE2 1 1 9 4435 1 1 22 TYR HH H -2.254 8.583 -3.801 1.00 . A A . 22 TYR HH 1 1 9 4436 1 1 22 TYR N N -0.737 6.046 2.436 1.00 . A A . 22 TYR N 1 1 9 4437 1 1 22 TYR O O 0.512 3.600 3.172 1.00 . A A . 22 TYR O 1 1 9 4438 1 1 22 TYR OH O -2.755 8.593 -2.983 1.00 . A A . 22 TYR OH 1 1 9 4439 1 1 23 ALA C C -1.122 0.133 3.054 1.00 . A A . 23 ALA C 1 1 9 4440 1 1 23 ALA CA C -0.996 1.443 3.842 1.00 . A A . 23 ALA CA 1 1 9 4441 1 1 23 ALA CB C -1.942 1.436 5.044 1.00 . A A . 23 ALA CB 1 1 9 4442 1 1 23 ALA H H -2.354 2.606 2.636 1.00 . A A . 23 ALA H 1 1 9 4443 1 1 23 ALA HA H 0.020 1.587 4.172 1.00 . A A . 23 ALA HA 1 1 9 4444 1 1 23 ALA HB1 H -1.684 2.245 5.710 1.00 . A A . 23 ALA HB1 1 1 9 4445 1 1 23 ALA HB2 H -1.849 0.496 5.568 1.00 . A A . 23 ALA HB2 1 1 9 4446 1 1 23 ALA HB3 H -2.959 1.559 4.702 1.00 . A A . 23 ALA HB3 1 1 9 4447 1 1 23 ALA N N -1.444 2.596 3.000 1.00 . A A . 23 ALA N 1 1 9 4448 1 1 23 ALA O O -1.978 -0.005 2.201 1.00 . A A . 23 ALA O 1 1 9 4449 1 1 24 CYS C C -1.301 -3.094 3.325 1.00 . A A . 24 CYS C 1 1 9 4450 1 1 24 CYS CA C -0.354 -2.132 2.602 1.00 . A A . 24 CYS CA 1 1 9 4451 1 1 24 CYS CB C 1.074 -2.687 2.603 1.00 . A A . 24 CYS CB 1 1 9 4452 1 1 24 CYS H H 0.401 -0.697 4.031 1.00 . A A . 24 CYS H 1 1 9 4453 1 1 24 CYS HA H -0.685 -1.972 1.589 1.00 . A A . 24 CYS HA 1 1 9 4454 1 1 24 CYS HB2 H 1.647 -2.214 3.385 1.00 . A A . 24 CYS HB2 1 1 9 4455 1 1 24 CYS HB3 H 1.045 -3.753 2.772 1.00 . A A . 24 CYS HB3 1 1 9 4456 1 1 24 CYS N N -0.279 -0.831 3.336 1.00 . A A . 24 CYS N 1 1 9 4457 1 1 24 CYS O O -1.629 -2.906 4.483 1.00 . A A . 24 CYS O 1 1 9 4458 1 1 24 CYS SG S 1.845 -2.353 1.006 1.00 . A A . 24 CYS SG 1 1 9 4459 1 1 25 SER C C -2.295 -6.526 2.924 1.00 . A A . 25 SER C 1 1 9 4460 1 1 25 SER CA C -2.683 -5.091 3.282 1.00 . A A . 25 SER CA 1 1 9 4461 1 1 25 SER CB C -4.058 -4.751 2.709 1.00 . A A . 25 SER CB 1 1 9 4462 1 1 25 SER H H -1.475 -4.245 1.713 1.00 . A A . 25 SER H 1 1 9 4463 1 1 25 SER HA H -2.689 -4.961 4.350 1.00 . A A . 25 SER HA 1 1 9 4464 1 1 25 SER HB2 H -4.082 -3.715 2.412 1.00 . A A . 25 SER HB2 1 1 9 4465 1 1 25 SER HB3 H -4.251 -5.374 1.845 1.00 . A A . 25 SER HB3 1 1 9 4466 1 1 25 SER HG H -5.352 -4.121 4.020 1.00 . A A . 25 SER HG 1 1 9 4467 1 1 25 SER N N -1.749 -4.120 2.646 1.00 . A A . 25 SER N 1 1 9 4468 1 1 25 SER O O -2.278 -6.903 1.770 1.00 . A A . 25 SER O 1 1 9 4469 1 1 25 SER OG O -5.049 -4.975 3.703 1.00 . A A . 25 SER OG 1 1 9 4470 1 1 26 LYS C C -2.890 -9.548 3.262 1.00 . A A . 26 LYS C 1 1 9 4471 1 1 26 LYS CA C -1.631 -8.757 3.633 1.00 . A A . 26 LYS CA 1 1 9 4472 1 1 26 LYS CB C -1.026 -9.285 4.937 1.00 . A A . 26 LYS CB 1 1 9 4473 1 1 26 LYS CD C 0.902 -10.479 3.868 1.00 . A A . 26 LYS CD 1 1 9 4474 1 1 26 LYS CE C 0.796 -11.276 2.563 1.00 . A A . 26 LYS CE 1 1 9 4475 1 1 26 LYS CG C -0.381 -10.654 4.687 1.00 . A A . 26 LYS CG 1 1 9 4476 1 1 26 LYS H H -2.028 -7.009 4.836 1.00 . A A . 26 LYS H 1 1 9 4477 1 1 26 LYS HA H -0.906 -8.810 2.838 1.00 . A A . 26 LYS HA 1 1 9 4478 1 1 26 LYS HB2 H -0.278 -8.593 5.293 1.00 . A A . 26 LYS HB2 1 1 9 4479 1 1 26 LYS HB3 H -1.803 -9.388 5.679 1.00 . A A . 26 LYS HB3 1 1 9 4480 1 1 26 LYS HD2 H 1.041 -9.431 3.639 1.00 . A A . 26 LYS HD2 1 1 9 4481 1 1 26 LYS HD3 H 1.746 -10.836 4.439 1.00 . A A . 26 LYS HD3 1 1 9 4482 1 1 26 LYS HE2 H -0.241 -11.483 2.334 1.00 . A A . 26 LYS HE2 1 1 9 4483 1 1 26 LYS HE3 H 1.259 -10.735 1.753 1.00 . A A . 26 LYS HE3 1 1 9 4484 1 1 26 LYS HG2 H -0.143 -11.116 5.634 1.00 . A A . 26 LYS HG2 1 1 9 4485 1 1 26 LYS HG3 H -1.070 -11.283 4.145 1.00 . A A . 26 LYS HG3 1 1 9 4486 1 1 26 LYS HZ1 H 2.535 -12.330 3.017 1.00 . A A . 26 LYS HZ1 1 1 9 4487 1 1 26 LYS HZ2 H 1.471 -13.158 1.982 1.00 . A A . 26 LYS HZ2 1 1 9 4488 1 1 26 LYS HZ3 H 1.121 -13.031 3.639 1.00 . A A . 26 LYS HZ3 1 1 9 4489 1 1 26 LYS N N -1.998 -7.335 3.912 1.00 . A A . 26 LYS N 1 1 9 4490 1 1 26 LYS NZ N 1.537 -12.544 2.820 1.00 . A A . 26 LYS NZ 1 1 9 4491 1 1 26 LYS O O -2.859 -10.415 2.410 1.00 . A A . 26 LYS O 1 1 9 4492 1 1 27 THR C C -5.690 -9.658 2.130 1.00 . A A . 27 THR C 1 1 9 4493 1 1 27 THR CA C -5.278 -9.951 3.574 1.00 . A A . 27 THR CA 1 1 9 4494 1 1 27 THR CB C -6.321 -9.388 4.551 1.00 . A A . 27 THR CB 1 1 9 4495 1 1 27 THR CG2 C -7.629 -10.174 4.418 1.00 . A A . 27 THR CG2 1 1 9 4496 1 1 27 THR H H -3.995 -8.526 4.563 1.00 . A A . 27 THR H 1 1 9 4497 1 1 27 THR HA H -5.164 -11.010 3.725 1.00 . A A . 27 THR HA 1 1 9 4498 1 1 27 THR HB H -6.509 -8.350 4.317 1.00 . A A . 27 THR HB 1 1 9 4499 1 1 27 THR HG1 H -5.774 -10.426 6.106 1.00 . A A . 27 THR HG1 1 1 9 4500 1 1 27 THR HG21 H -7.459 -11.204 4.695 1.00 . A A . 27 THR HG21 1 1 9 4501 1 1 27 THR HG22 H -7.974 -10.129 3.395 1.00 . A A . 27 THR HG22 1 1 9 4502 1 1 27 THR HG23 H -8.375 -9.742 5.069 1.00 . A A . 27 THR HG23 1 1 9 4503 1 1 27 THR N N -4.002 -9.237 3.890 1.00 . A A . 27 THR N 1 1 9 4504 1 1 27 THR O O -6.099 -10.539 1.398 1.00 . A A . 27 THR O 1 1 9 4505 1 1 27 THR OG1 O -5.838 -9.494 5.884 1.00 . A A . 27 THR OG1 1 1 9 4506 1 1 28 TRP C C -4.803 -8.373 -0.627 1.00 . A A . 28 TRP C 1 1 9 4507 1 1 28 TRP CA C -5.958 -8.045 0.326 1.00 . A A . 28 TRP CA 1 1 9 4508 1 1 28 TRP CB C -6.206 -6.531 0.360 1.00 . A A . 28 TRP CB 1 1 9 4509 1 1 28 TRP CD1 C -8.076 -7.058 2.000 1.00 . A A . 28 TRP CD1 1 1 9 4510 1 1 28 TRP CD2 C -7.542 -4.873 1.958 1.00 . A A . 28 TRP CD2 1 1 9 4511 1 1 28 TRP CE2 C -8.582 -5.020 2.906 1.00 . A A . 28 TRP CE2 1 1 9 4512 1 1 28 TRP CE3 C -7.023 -3.585 1.738 1.00 . A A . 28 TRP CE3 1 1 9 4513 1 1 28 TRP CG C -7.236 -6.181 1.398 1.00 . A A . 28 TRP CG 1 1 9 4514 1 1 28 TRP CH2 C -8.563 -2.656 3.378 1.00 . A A . 28 TRP CH2 1 1 9 4515 1 1 28 TRP CZ2 C -9.090 -3.927 3.609 1.00 . A A . 28 TRP CZ2 1 1 9 4516 1 1 28 TRP CZ3 C -7.531 -2.483 2.445 1.00 . A A . 28 TRP CZ3 1 1 9 4517 1 1 28 TRP H H -5.243 -7.736 2.338 1.00 . A A . 28 TRP H 1 1 9 4518 1 1 28 TRP HA H -6.854 -8.561 0.026 1.00 . A A . 28 TRP HA 1 1 9 4519 1 1 28 TRP HB2 H -5.284 -6.024 0.591 1.00 . A A . 28 TRP HB2 1 1 9 4520 1 1 28 TRP HB3 H -6.554 -6.209 -0.607 1.00 . A A . 28 TRP HB3 1 1 9 4521 1 1 28 TRP HD1 H -8.115 -8.121 1.817 1.00 . A A . 28 TRP HD1 1 1 9 4522 1 1 28 TRP HE1 H -9.560 -6.770 3.465 1.00 . A A . 28 TRP HE1 1 1 9 4523 1 1 28 TRP HE3 H -6.228 -3.442 1.023 1.00 . A A . 28 TRP HE3 1 1 9 4524 1 1 28 TRP HH2 H -8.950 -1.805 3.919 1.00 . A A . 28 TRP HH2 1 1 9 4525 1 1 28 TRP HZ2 H -9.885 -4.064 4.327 1.00 . A A . 28 TRP HZ2 1 1 9 4526 1 1 28 TRP HZ3 H -7.125 -1.498 2.269 1.00 . A A . 28 TRP HZ3 1 1 9 4527 1 1 28 TRP N N -5.579 -8.420 1.723 1.00 . A A . 28 TRP N 1 1 9 4528 1 1 28 TRP NE1 N -8.871 -6.369 2.897 1.00 . A A . 28 TRP NE1 1 1 9 4529 1 1 28 TRP O O -4.998 -8.966 -1.672 1.00 . A A . 28 TRP O 1 1 9 4530 1 1 29 GLY C C -1.972 -7.014 -1.873 1.00 . A A . 29 GLY C 1 1 9 4531 1 1 29 GLY CA C -2.419 -8.282 -1.129 1.00 . A A . 29 GLY CA 1 1 9 4532 1 1 29 GLY H H -3.476 -7.524 0.586 1.00 . A A . 29 GLY H 1 1 9 4533 1 1 29 GLY HA2 H -1.607 -8.639 -0.512 1.00 . A A . 29 GLY HA2 1 1 9 4534 1 1 29 GLY HA3 H -2.679 -9.040 -1.850 1.00 . A A . 29 GLY HA3 1 1 9 4535 1 1 29 GLY N N -3.602 -7.995 -0.264 1.00 . A A . 29 GLY N 1 1 9 4536 1 1 29 GLY O O -1.252 -7.095 -2.850 1.00 . A A . 29 GLY O 1 1 9 4537 1 1 30 TRP C C -1.881 -3.406 -1.154 1.00 . A A . 30 TRP C 1 1 9 4538 1 1 30 TRP CA C -1.955 -4.593 -2.128 1.00 . A A . 30 TRP CA 1 1 9 4539 1 1 30 TRP CB C -3.005 -4.365 -3.232 1.00 . A A . 30 TRP CB 1 1 9 4540 1 1 30 TRP CD1 C -4.569 -2.761 -2.048 1.00 . A A . 30 TRP CD1 1 1 9 4541 1 1 30 TRP CD2 C -5.574 -4.693 -2.612 1.00 . A A . 30 TRP CD2 1 1 9 4542 1 1 30 TRP CE2 C -6.550 -3.898 -1.965 1.00 . A A . 30 TRP CE2 1 1 9 4543 1 1 30 TRP CE3 C -5.955 -5.967 -3.072 1.00 . A A . 30 TRP CE3 1 1 9 4544 1 1 30 TRP CG C -4.321 -3.951 -2.646 1.00 . A A . 30 TRP CG 1 1 9 4545 1 1 30 TRP CH2 C -8.219 -5.616 -2.245 1.00 . A A . 30 TRP CH2 1 1 9 4546 1 1 30 TRP CZ2 C -7.855 -4.349 -1.781 1.00 . A A . 30 TRP CZ2 1 1 9 4547 1 1 30 TRP CZ3 C -7.270 -6.424 -2.889 1.00 . A A . 30 TRP CZ3 1 1 9 4548 1 1 30 TRP H H -2.955 -5.790 -0.631 1.00 . A A . 30 TRP H 1 1 9 4549 1 1 30 TRP HA H -0.988 -4.742 -2.581 1.00 . A A . 30 TRP HA 1 1 9 4550 1 1 30 TRP HB2 H -2.659 -3.592 -3.899 1.00 . A A . 30 TRP HB2 1 1 9 4551 1 1 30 TRP HB3 H -3.137 -5.279 -3.789 1.00 . A A . 30 TRP HB3 1 1 9 4552 1 1 30 TRP HD1 H -3.852 -1.968 -1.907 1.00 . A A . 30 TRP HD1 1 1 9 4553 1 1 30 TRP HE1 H -6.314 -1.986 -1.176 1.00 . A A . 30 TRP HE1 1 1 9 4554 1 1 30 TRP HE3 H -5.232 -6.596 -3.569 1.00 . A A . 30 TRP HE3 1 1 9 4555 1 1 30 TRP HH2 H -9.227 -5.972 -2.107 1.00 . A A . 30 TRP HH2 1 1 9 4556 1 1 30 TRP HZ2 H -8.581 -3.724 -1.284 1.00 . A A . 30 TRP HZ2 1 1 9 4557 1 1 30 TRP HZ3 H -7.553 -7.404 -3.246 1.00 . A A . 30 TRP HZ3 1 1 9 4558 1 1 30 TRP N N -2.379 -5.844 -1.425 1.00 . A A . 30 TRP N 1 1 9 4559 1 1 30 TRP NE1 N -5.885 -2.733 -1.639 1.00 . A A . 30 TRP NE1 1 1 9 4560 1 1 30 TRP O O -2.066 -3.553 0.037 1.00 . A A . 30 TRP O 1 1 9 4561 1 1 31 CYS C C -2.488 0.057 -1.263 1.00 . A A . 31 CYS C 1 1 9 4562 1 1 31 CYS CA C -1.504 -1.019 -0.799 1.00 . A A . 31 CYS CA 1 1 9 4563 1 1 31 CYS CB C -0.063 -0.526 -0.967 1.00 . A A . 31 CYS CB 1 1 9 4564 1 1 31 CYS H H -1.460 -2.148 -2.631 1.00 . A A . 31 CYS H 1 1 9 4565 1 1 31 CYS HA H -1.686 -1.277 0.233 1.00 . A A . 31 CYS HA 1 1 9 4566 1 1 31 CYS HB2 H 0.620 -1.328 -0.736 1.00 . A A . 31 CYS HB2 1 1 9 4567 1 1 31 CYS HB3 H 0.091 -0.205 -1.987 1.00 . A A . 31 CYS HB3 1 1 9 4568 1 1 31 CYS N N -1.605 -2.231 -1.665 1.00 . A A . 31 CYS N 1 1 9 4569 1 1 31 CYS O O -2.552 0.390 -2.438 1.00 . A A . 31 CYS O 1 1 9 4570 1 1 31 CYS SG S 0.236 0.861 0.152 1.00 . A A . 31 CYS SG 1 1 9 4571 1 1 32 ALA C C -4.308 2.711 0.425 1.00 . A A . 32 ALA C 1 1 9 4572 1 1 32 ALA CA C -4.234 1.668 -0.700 1.00 . A A . 32 ALA CA 1 1 9 4573 1 1 32 ALA CB C -5.572 0.937 -0.840 1.00 . A A . 32 ALA CB 1 1 9 4574 1 1 32 ALA H H -3.160 0.313 0.589 1.00 . A A . 32 ALA H 1 1 9 4575 1 1 32 ALA HA H -3.967 2.136 -1.634 1.00 . A A . 32 ALA HA 1 1 9 4576 1 1 32 ALA HB1 H -5.495 -0.045 -0.399 1.00 . A A . 32 ALA HB1 1 1 9 4577 1 1 32 ALA HB2 H -5.821 0.841 -1.887 1.00 . A A . 32 ALA HB2 1 1 9 4578 1 1 32 ALA HB3 H -6.344 1.499 -0.338 1.00 . A A . 32 ALA HB3 1 1 9 4579 1 1 32 ALA N N -3.247 0.603 -0.345 1.00 . A A . 32 ALA N 1 1 9 4580 1 1 32 ALA O O -3.701 2.551 1.467 1.00 . A A . 32 ALA O 1 1 9 4581 1 1 33 VAL C C -5.920 4.269 2.501 1.00 . A A . 33 VAL C 1 1 9 4582 1 1 33 VAL CA C -5.154 4.825 1.292 1.00 . A A . 33 VAL CA 1 1 9 4583 1 1 33 VAL CB C -5.927 5.990 0.657 1.00 . A A . 33 VAL CB 1 1 9 4584 1 1 33 VAL CG1 C -6.126 7.105 1.691 1.00 . A A . 33 VAL CG1 1 1 9 4585 1 1 33 VAL CG2 C -5.136 6.548 -0.529 1.00 . A A . 33 VAL CG2 1 1 9 4586 1 1 33 VAL H H -5.531 3.885 -0.621 1.00 . A A . 33 VAL H 1 1 9 4587 1 1 33 VAL HA H -4.173 5.156 1.592 1.00 . A A . 33 VAL HA 1 1 9 4588 1 1 33 VAL HB H -6.891 5.640 0.316 1.00 . A A . 33 VAL HB 1 1 9 4589 1 1 33 VAL HG11 H -5.271 7.766 1.676 1.00 . A A . 33 VAL HG11 1 1 9 4590 1 1 33 VAL HG12 H -6.228 6.672 2.676 1.00 . A A . 33 VAL HG12 1 1 9 4591 1 1 33 VAL HG13 H -7.017 7.664 1.450 1.00 . A A . 33 VAL HG13 1 1 9 4592 1 1 33 VAL HG21 H -4.161 6.869 -0.191 1.00 . A A . 33 VAL HG21 1 1 9 4593 1 1 33 VAL HG22 H -5.664 7.389 -0.952 1.00 . A A . 33 VAL HG22 1 1 9 4594 1 1 33 VAL HG23 H -5.022 5.779 -1.279 1.00 . A A . 33 VAL HG23 1 1 9 4595 1 1 33 VAL N N -5.046 3.776 0.225 1.00 . A A . 33 VAL N 1 1 9 4596 1 1 33 VAL O O -6.866 3.516 2.354 1.00 . A A . 33 VAL O 1 1 9 4597 1 1 34 GLU C C -7.587 4.802 5.055 1.00 . A A . 34 GLU C 1 1 9 4598 1 1 34 GLU CA C -6.213 4.136 4.918 1.00 . A A . 34 GLU CA 1 1 9 4599 1 1 34 GLU CB C -5.306 4.524 6.088 1.00 . A A . 34 GLU CB 1 1 9 4600 1 1 34 GLU CD C -3.397 3.687 7.468 1.00 . A A . 34 GLU CD 1 1 9 4601 1 1 34 GLU CG C -4.063 3.630 6.092 1.00 . A A . 34 GLU CG 1 1 9 4602 1 1 34 GLU H H -4.751 5.245 3.780 1.00 . A A . 34 GLU H 1 1 9 4603 1 1 34 GLU HA H -6.320 3.063 4.876 1.00 . A A . 34 GLU HA 1 1 9 4604 1 1 34 GLU HB2 H -5.008 5.558 5.985 1.00 . A A . 34 GLU HB2 1 1 9 4605 1 1 34 GLU HB3 H -5.842 4.395 7.017 1.00 . A A . 34 GLU HB3 1 1 9 4606 1 1 34 GLU HG2 H -4.352 2.614 5.871 1.00 . A A . 34 GLU HG2 1 1 9 4607 1 1 34 GLU HG3 H -3.368 3.977 5.342 1.00 . A A . 34 GLU HG3 1 1 9 4608 1 1 34 GLU N N -5.516 4.637 3.692 1.00 . A A . 34 GLU N 1 1 9 4609 1 1 34 GLU O O -7.689 5.993 5.286 1.00 . A A . 34 GLU O 1 1 9 4610 1 1 34 GLU OE1 O -2.573 4.564 7.670 1.00 . A A . 34 GLU OE1 1 1 9 4611 1 1 34 GLU OE2 O -3.720 2.850 8.296 1.00 . A A . 34 GLU OE2 1 1 9 4612 1 1 35 ALA C C -10.900 3.708 5.895 1.00 . A A . 35 ALA C 1 1 9 4613 1 1 35 ALA CA C -10.016 4.617 5.031 1.00 . A A . 35 ALA CA 1 1 9 4614 1 1 35 ALA CB C -10.549 4.678 3.598 1.00 . A A . 35 ALA CB 1 1 9 4615 1 1 35 ALA H H -8.533 3.083 4.724 1.00 . A A . 35 ALA H 1 1 9 4616 1 1 35 ALA HA H -9.971 5.610 5.448 1.00 . A A . 35 ALA HA 1 1 9 4617 1 1 35 ALA HB1 H -10.431 5.679 3.212 1.00 . A A . 35 ALA HB1 1 1 9 4618 1 1 35 ALA HB2 H -11.595 4.410 3.591 1.00 . A A . 35 ALA HB2 1 1 9 4619 1 1 35 ALA HB3 H -9.997 3.985 2.979 1.00 . A A . 35 ALA HB3 1 1 9 4620 1 1 35 ALA N N -8.644 4.039 4.911 1.00 . A A . 35 ALA N 1 1 9 4621 1 1 35 ALA O O -11.000 2.522 5.640 1.00 . A A . 35 ALA O 1 1 9 4622 1 1 36 PRO C C -13.714 3.149 7.098 1.00 . A A . 36 PRO C 1 1 9 4623 1 1 36 PRO CA C -12.402 3.521 7.805 1.00 . A A . 36 PRO CA 1 1 9 4624 1 1 36 PRO CB C -12.653 4.481 8.965 1.00 . A A . 36 PRO CB 1 1 9 4625 1 1 36 PRO CD C -11.451 5.715 7.270 1.00 . A A . 36 PRO CD 1 1 9 4626 1 1 36 PRO CG C -12.449 5.848 8.391 1.00 . A A . 36 PRO CG 1 1 9 4627 1 1 36 PRO HA H -11.897 2.637 8.162 1.00 . A A . 36 PRO HA 1 1 9 4628 1 1 36 PRO HB2 H -13.667 4.371 9.328 1.00 . A A . 36 PRO HB2 1 1 9 4629 1 1 36 PRO HB3 H -11.946 4.305 9.760 1.00 . A A . 36 PRO HB3 1 1 9 4630 1 1 36 PRO HD2 H -11.735 6.343 6.436 1.00 . A A . 36 PRO HD2 1 1 9 4631 1 1 36 PRO HD3 H -10.459 5.962 7.613 1.00 . A A . 36 PRO HD3 1 1 9 4632 1 1 36 PRO HG2 H -13.386 6.230 8.011 1.00 . A A . 36 PRO HG2 1 1 9 4633 1 1 36 PRO HG3 H -12.059 6.511 9.148 1.00 . A A . 36 PRO HG3 1 1 9 4634 1 1 36 PRO N N -11.517 4.295 6.895 1.00 . A A . 36 PRO N 1 1 9 4635 1 1 36 PRO O O -14.318 4.027 6.500 1.00 . A A . 36 PRO O 1 1 10 4636 1 1 1 ASP C C 13.359 9.250 -4.444 1.00 . A A . 1 ASP C 1 1 10 4637 1 1 1 ASP CA C 14.878 9.320 -4.253 1.00 . A A . 1 ASP CA 1 1 10 4638 1 1 1 ASP CB C 15.554 9.933 -5.486 1.00 . A A . 1 ASP CB 1 1 10 4639 1 1 1 ASP CG C 16.105 11.316 -5.135 1.00 . A A . 1 ASP CG 1 1 10 4640 1 1 1 ASP H1 H 15.018 7.456 -3.329 1.00 . A A . 1 ASP H1 1 1 10 4641 1 1 1 ASP H2 H 16.478 8.003 -4.002 1.00 . A A . 1 ASP H2 1 1 10 4642 1 1 1 ASP H3 H 15.245 7.409 -5.010 1.00 . A A . 1 ASP H3 1 1 10 4643 1 1 1 ASP HA H 15.121 9.899 -3.375 1.00 . A A . 1 ASP HA 1 1 10 4644 1 1 1 ASP HB2 H 16.363 9.293 -5.809 1.00 . A A . 1 ASP HB2 1 1 10 4645 1 1 1 ASP HB3 H 14.832 10.028 -6.283 1.00 . A A . 1 ASP HB3 1 1 10 4646 1 1 1 ASP N N 15.448 7.943 -4.141 1.00 . A A . 1 ASP N 1 1 10 4647 1 1 1 ASP O O 12.873 8.947 -5.519 1.00 . A A . 1 ASP O 1 1 10 4648 1 1 1 ASP OD1 O 15.354 12.273 -5.228 1.00 . A A . 1 ASP OD1 1 1 10 4649 1 1 1 ASP OD2 O 17.272 11.395 -4.780 1.00 . A A . 1 ASP OD2 1 1 10 4650 1 1 2 GLY C C 10.665 8.008 -3.590 1.00 . A A . 2 GLY C 1 1 10 4651 1 1 2 GLY CA C 11.116 9.468 -3.513 1.00 . A A . 2 GLY CA 1 1 10 4652 1 1 2 GLY H H 13.023 9.760 -2.550 1.00 . A A . 2 GLY H 1 1 10 4653 1 1 2 GLY HA2 H 10.676 9.938 -2.644 1.00 . A A . 2 GLY HA2 1 1 10 4654 1 1 2 GLY HA3 H 10.800 9.988 -4.404 1.00 . A A . 2 GLY HA3 1 1 10 4655 1 1 2 GLY N N 12.606 9.523 -3.404 1.00 . A A . 2 GLY N 1 1 10 4656 1 1 2 GLY O O 10.594 7.431 -4.659 1.00 . A A . 2 GLY O 1 1 10 4657 1 1 3 GLU C C 8.462 5.853 -2.039 1.00 . A A . 3 GLU C 1 1 10 4658 1 1 3 GLU CA C 9.928 5.974 -2.473 1.00 . A A . 3 GLU CA 1 1 10 4659 1 1 3 GLU CB C 10.852 5.270 -1.474 1.00 . A A . 3 GLU CB 1 1 10 4660 1 1 3 GLU CD C 12.908 3.859 -1.309 1.00 . A A . 3 GLU CD 1 1 10 4661 1 1 3 GLU CG C 11.754 4.285 -2.217 1.00 . A A . 3 GLU CG 1 1 10 4662 1 1 3 GLU H H 10.436 7.889 -1.617 1.00 . A A . 3 GLU H 1 1 10 4663 1 1 3 GLU HA H 10.062 5.548 -3.455 1.00 . A A . 3 GLU HA 1 1 10 4664 1 1 3 GLU HB2 H 11.460 6.005 -0.966 1.00 . A A . 3 GLU HB2 1 1 10 4665 1 1 3 GLU HB3 H 10.258 4.733 -0.748 1.00 . A A . 3 GLU HB3 1 1 10 4666 1 1 3 GLU HG2 H 11.179 3.415 -2.503 1.00 . A A . 3 GLU HG2 1 1 10 4667 1 1 3 GLU HG3 H 12.151 4.759 -3.102 1.00 . A A . 3 GLU HG3 1 1 10 4668 1 1 3 GLU N N 10.366 7.404 -2.466 1.00 . A A . 3 GLU N 1 1 10 4669 1 1 3 GLU O O 8.160 5.698 -0.870 1.00 . A A . 3 GLU O 1 1 10 4670 1 1 3 GLU OE1 O 13.932 4.524 -1.333 1.00 . A A . 3 GLU OE1 1 1 10 4671 1 1 3 GLU OE2 O 12.749 2.874 -0.602 1.00 . A A . 3 GLU OE2 1 1 10 4672 1 1 4 CYS C C 5.379 4.942 -3.689 1.00 . A A . 4 CYS C 1 1 10 4673 1 1 4 CYS CA C 6.101 5.787 -2.630 1.00 . A A . 4 CYS CA 1 1 10 4674 1 1 4 CYS CB C 5.569 7.230 -2.584 1.00 . A A . 4 CYS CB 1 1 10 4675 1 1 4 CYS H H 7.818 6.030 -3.914 1.00 . A A . 4 CYS H 1 1 10 4676 1 1 4 CYS HA H 5.995 5.330 -1.658 1.00 . A A . 4 CYS HA 1 1 10 4677 1 1 4 CYS HB2 H 5.153 7.420 -1.607 1.00 . A A . 4 CYS HB2 1 1 10 4678 1 1 4 CYS HB3 H 6.386 7.913 -2.760 1.00 . A A . 4 CYS HB3 1 1 10 4679 1 1 4 CYS N N 7.550 5.912 -2.978 1.00 . A A . 4 CYS N 1 1 10 4680 1 1 4 CYS O O 5.782 4.890 -4.837 1.00 . A A . 4 CYS O 1 1 10 4681 1 1 4 CYS SG S 4.284 7.494 -3.836 1.00 . A A . 4 CYS SG 1 1 10 4682 1 1 5 GLY C C 2.529 4.258 -5.013 1.00 . A A . 5 GLY C 1 1 10 4683 1 1 5 GLY CA C 3.572 3.419 -4.269 1.00 . A A . 5 GLY CA 1 1 10 4684 1 1 5 GLY H H 4.027 4.332 -2.376 1.00 . A A . 5 GLY H 1 1 10 4685 1 1 5 GLY HA2 H 4.263 2.991 -4.979 1.00 . A A . 5 GLY HA2 1 1 10 4686 1 1 5 GLY HA3 H 3.072 2.626 -3.732 1.00 . A A . 5 GLY HA3 1 1 10 4687 1 1 5 GLY N N 4.323 4.274 -3.305 1.00 . A A . 5 GLY N 1 1 10 4688 1 1 5 GLY O O 2.852 5.239 -5.658 1.00 . A A . 5 GLY O 1 1 10 4689 1 1 6 GLY C C -1.117 4.468 -4.853 1.00 . A A . 6 GLY C 1 1 10 4690 1 1 6 GLY CA C 0.199 4.636 -5.624 1.00 . A A . 6 GLY CA 1 1 10 4691 1 1 6 GLY H H 1.050 3.078 -4.406 1.00 . A A . 6 GLY H 1 1 10 4692 1 1 6 GLY HA2 H 0.467 5.681 -5.667 1.00 . A A . 6 GLY HA2 1 1 10 4693 1 1 6 GLY HA3 H 0.078 4.254 -6.626 1.00 . A A . 6 GLY HA3 1 1 10 4694 1 1 6 GLY N N 1.279 3.873 -4.929 1.00 . A A . 6 GLY N 1 1 10 4695 1 1 6 GLY O O -1.123 4.379 -3.640 1.00 . A A . 6 GLY O 1 1 10 4696 1 1 7 PHE C C -3.908 2.767 -4.704 1.00 . A A . 7 PHE C 1 1 10 4697 1 1 7 PHE CA C -3.548 4.255 -4.845 1.00 . A A . 7 PHE CA 1 1 10 4698 1 1 7 PHE CB C -4.572 4.976 -5.730 1.00 . A A . 7 PHE CB 1 1 10 4699 1 1 7 PHE CD1 C -4.524 7.307 -4.768 1.00 . A A . 7 PHE CD1 1 1 10 4700 1 1 7 PHE CD2 C -6.493 5.939 -4.405 1.00 . A A . 7 PHE CD2 1 1 10 4701 1 1 7 PHE CE1 C -5.114 8.349 -4.044 1.00 . A A . 7 PHE CE1 1 1 10 4702 1 1 7 PHE CE2 C -7.084 6.981 -3.681 1.00 . A A . 7 PHE CE2 1 1 10 4703 1 1 7 PHE CG C -5.212 6.101 -4.949 1.00 . A A . 7 PHE CG 1 1 10 4704 1 1 7 PHE CZ C -6.394 8.186 -3.500 1.00 . A A . 7 PHE CZ 1 1 10 4705 1 1 7 PHE H H -2.201 4.490 -6.522 1.00 . A A . 7 PHE H 1 1 10 4706 1 1 7 PHE HA H -3.513 4.719 -3.873 1.00 . A A . 7 PHE HA 1 1 10 4707 1 1 7 PHE HB2 H -4.079 5.379 -6.602 1.00 . A A . 7 PHE HB2 1 1 10 4708 1 1 7 PHE HB3 H -5.335 4.277 -6.039 1.00 . A A . 7 PHE HB3 1 1 10 4709 1 1 7 PHE HD1 H -3.536 7.433 -5.187 1.00 . A A . 7 PHE HD1 1 1 10 4710 1 1 7 PHE HD2 H -7.024 5.009 -4.544 1.00 . A A . 7 PHE HD2 1 1 10 4711 1 1 7 PHE HE1 H -4.584 9.279 -3.904 1.00 . A A . 7 PHE HE1 1 1 10 4712 1 1 7 PHE HE2 H -8.071 6.855 -3.261 1.00 . A A . 7 PHE HE2 1 1 10 4713 1 1 7 PHE HZ H -6.850 8.990 -2.940 1.00 . A A . 7 PHE HZ 1 1 10 4714 1 1 7 PHE N N -2.230 4.421 -5.543 1.00 . A A . 7 PHE N 1 1 10 4715 1 1 7 PHE O O -4.620 2.382 -3.797 1.00 . A A . 7 PHE O 1 1 10 4716 1 1 8 TRP C C -2.561 -0.335 -6.079 1.00 . A A . 8 TRP C 1 1 10 4717 1 1 8 TRP CA C -3.737 0.475 -5.514 1.00 . A A . 8 TRP CA 1 1 10 4718 1 1 8 TRP CB C -5.004 0.301 -6.363 1.00 . A A . 8 TRP CB 1 1 10 4719 1 1 8 TRP CD1 C -5.683 -1.925 -5.358 1.00 . A A . 8 TRP CD1 1 1 10 4720 1 1 8 TRP CD2 C -5.539 -1.988 -7.603 1.00 . A A . 8 TRP CD2 1 1 10 4721 1 1 8 TRP CE2 C -5.921 -3.284 -7.185 1.00 . A A . 8 TRP CE2 1 1 10 4722 1 1 8 TRP CE3 C -5.376 -1.756 -8.980 1.00 . A A . 8 TRP CE3 1 1 10 4723 1 1 8 TRP CG C -5.392 -1.143 -6.426 1.00 . A A . 8 TRP CG 1 1 10 4724 1 1 8 TRP CH2 C -5.971 -4.064 -9.467 1.00 . A A . 8 TRP CH2 1 1 10 4725 1 1 8 TRP CZ2 C -6.137 -4.313 -8.102 1.00 . A A . 8 TRP CZ2 1 1 10 4726 1 1 8 TRP CZ3 C -5.592 -2.788 -9.906 1.00 . A A . 8 TRP CZ3 1 1 10 4727 1 1 8 TRP H H -2.856 2.270 -6.317 1.00 . A A . 8 TRP H 1 1 10 4728 1 1 8 TRP HA H -3.936 0.188 -4.493 1.00 . A A . 8 TRP HA 1 1 10 4729 1 1 8 TRP HB2 H -5.810 0.869 -5.922 1.00 . A A . 8 TRP HB2 1 1 10 4730 1 1 8 TRP HB3 H -4.816 0.666 -7.363 1.00 . A A . 8 TRP HB3 1 1 10 4731 1 1 8 TRP HD1 H -5.671 -1.608 -4.325 1.00 . A A . 8 TRP HD1 1 1 10 4732 1 1 8 TRP HE1 H -6.243 -3.952 -5.236 1.00 . A A . 8 TRP HE1 1 1 10 4733 1 1 8 TRP HE3 H -5.084 -0.775 -9.328 1.00 . A A . 8 TRP HE3 1 1 10 4734 1 1 8 TRP HH2 H -6.136 -4.854 -10.185 1.00 . A A . 8 TRP HH2 1 1 10 4735 1 1 8 TRP HZ2 H -6.428 -5.295 -7.760 1.00 . A A . 8 TRP HZ2 1 1 10 4736 1 1 8 TRP HZ3 H -5.465 -2.597 -10.961 1.00 . A A . 8 TRP HZ3 1 1 10 4737 1 1 8 TRP N N -3.425 1.935 -5.593 1.00 . A A . 8 TRP N 1 1 10 4738 1 1 8 TRP NE1 N -5.996 -3.194 -5.809 1.00 . A A . 8 TRP NE1 1 1 10 4739 1 1 8 TRP O O -2.624 -0.871 -7.171 1.00 . A A . 8 TRP O 1 1 10 4740 1 1 9 TRP C C -0.204 -2.517 -5.072 1.00 . A A . 9 TRP C 1 1 10 4741 1 1 9 TRP CA C -0.286 -1.181 -5.816 1.00 . A A . 9 TRP CA 1 1 10 4742 1 1 9 TRP CB C 0.915 -0.287 -5.479 1.00 . A A . 9 TRP CB 1 1 10 4743 1 1 9 TRP CD1 C -0.056 1.446 -7.064 1.00 . A A . 9 TRP CD1 1 1 10 4744 1 1 9 TRP CD2 C 2.185 1.550 -6.933 1.00 . A A . 9 TRP CD2 1 1 10 4745 1 1 9 TRP CE2 C 1.779 2.563 -7.833 1.00 . A A . 9 TRP CE2 1 1 10 4746 1 1 9 TRP CE3 C 3.559 1.406 -6.676 1.00 . A A . 9 TRP CE3 1 1 10 4747 1 1 9 TRP CG C 1.000 0.853 -6.454 1.00 . A A . 9 TRP CG 1 1 10 4748 1 1 9 TRP CH2 C 4.061 3.249 -8.187 1.00 . A A . 9 TRP CH2 1 1 10 4749 1 1 9 TRP CZ2 C 2.701 3.403 -8.453 1.00 . A A . 9 TRP CZ2 1 1 10 4750 1 1 9 TRP CZ3 C 4.490 2.251 -7.301 1.00 . A A . 9 TRP CZ3 1 1 10 4751 1 1 9 TRP H H -1.460 0.030 -4.463 1.00 . A A . 9 TRP H 1 1 10 4752 1 1 9 TRP HA H -0.340 -1.343 -6.881 1.00 . A A . 9 TRP HA 1 1 10 4753 1 1 9 TRP HB2 H 0.799 0.107 -4.479 1.00 . A A . 9 TRP HB2 1 1 10 4754 1 1 9 TRP HB3 H 1.823 -0.870 -5.530 1.00 . A A . 9 TRP HB3 1 1 10 4755 1 1 9 TRP HD1 H -1.091 1.173 -6.935 1.00 . A A . 9 TRP HD1 1 1 10 4756 1 1 9 TRP HE1 H -0.154 3.041 -8.430 1.00 . A A . 9 TRP HE1 1 1 10 4757 1 1 9 TRP HE3 H 3.900 0.641 -5.994 1.00 . A A . 9 TRP HE3 1 1 10 4758 1 1 9 TRP HH2 H 4.782 3.894 -8.664 1.00 . A A . 9 TRP HH2 1 1 10 4759 1 1 9 TRP HZ2 H 2.363 4.171 -9.131 1.00 . A A . 9 TRP HZ2 1 1 10 4760 1 1 9 TRP HZ3 H 5.542 2.135 -7.094 1.00 . A A . 9 TRP HZ3 1 1 10 4761 1 1 9 TRP N N -1.483 -0.417 -5.338 1.00 . A A . 9 TRP N 1 1 10 4762 1 1 9 TRP NE1 N 0.408 2.458 -7.880 1.00 . A A . 9 TRP NE1 1 1 10 4763 1 1 9 TRP O O -0.777 -2.675 -4.019 1.00 . A A . 9 TRP O 1 1 10 4764 1 1 10 LYS C C 1.774 -4.869 -3.971 1.00 . A A . 10 LYS C 1 1 10 4765 1 1 10 LYS CA C 0.575 -4.813 -4.915 1.00 . A A . 10 LYS CA 1 1 10 4766 1 1 10 LYS CB C 0.739 -5.854 -6.023 1.00 . A A . 10 LYS CB 1 1 10 4767 1 1 10 LYS CD C -1.501 -5.518 -7.099 1.00 . A A . 10 LYS CD 1 1 10 4768 1 1 10 LYS CE C -2.841 -6.185 -7.431 1.00 . A A . 10 LYS CE 1 1 10 4769 1 1 10 LYS CG C -0.616 -6.501 -6.329 1.00 . A A . 10 LYS CG 1 1 10 4770 1 1 10 LYS H H 0.946 -3.353 -6.469 1.00 . A A . 10 LYS H 1 1 10 4771 1 1 10 LYS HA H -0.336 -5.004 -4.371 1.00 . A A . 10 LYS HA 1 1 10 4772 1 1 10 LYS HB2 H 1.126 -5.377 -6.910 1.00 . A A . 10 LYS HB2 1 1 10 4773 1 1 10 LYS HB3 H 1.432 -6.614 -5.693 1.00 . A A . 10 LYS HB3 1 1 10 4774 1 1 10 LYS HD2 H -1.676 -4.640 -6.492 1.00 . A A . 10 LYS HD2 1 1 10 4775 1 1 10 LYS HD3 H -1.009 -5.229 -8.016 1.00 . A A . 10 LYS HD3 1 1 10 4776 1 1 10 LYS HE2 H -2.729 -7.260 -7.448 1.00 . A A . 10 LYS HE2 1 1 10 4777 1 1 10 LYS HE3 H -3.594 -5.895 -6.713 1.00 . A A . 10 LYS HE3 1 1 10 4778 1 1 10 LYS HG2 H -0.461 -7.389 -6.926 1.00 . A A . 10 LYS HG2 1 1 10 4779 1 1 10 LYS HG3 H -1.102 -6.771 -5.404 1.00 . A A . 10 LYS HG3 1 1 10 4780 1 1 10 LYS HZ1 H -3.379 -4.652 -8.736 1.00 . A A . 10 LYS HZ1 1 1 10 4781 1 1 10 LYS HZ2 H -4.063 -6.161 -9.117 1.00 . A A . 10 LYS HZ2 1 1 10 4782 1 1 10 LYS HZ3 H -2.422 -5.861 -9.446 1.00 . A A . 10 LYS HZ3 1 1 10 4783 1 1 10 LYS N N 0.491 -3.488 -5.611 1.00 . A A . 10 LYS N 1 1 10 4784 1 1 10 LYS NZ N -3.204 -5.676 -8.784 1.00 . A A . 10 LYS NZ 1 1 10 4785 1 1 10 LYS O O 2.881 -4.518 -4.336 1.00 . A A . 10 LYS O 1 1 10 4786 1 1 11 CYS C C 2.444 -6.590 -0.806 1.00 . A A . 11 CYS C 1 1 10 4787 1 1 11 CYS CA C 2.691 -5.440 -1.795 1.00 . A A . 11 CYS CA 1 1 10 4788 1 1 11 CYS CB C 2.747 -4.094 -1.066 1.00 . A A . 11 CYS CB 1 1 10 4789 1 1 11 CYS H H 0.666 -5.624 -2.502 1.00 . A A . 11 CYS H 1 1 10 4790 1 1 11 CYS HA H 3.612 -5.606 -2.331 1.00 . A A . 11 CYS HA 1 1 10 4791 1 1 11 CYS HB2 H 3.629 -4.061 -0.444 1.00 . A A . 11 CYS HB2 1 1 10 4792 1 1 11 CYS HB3 H 2.792 -3.295 -1.790 1.00 . A A . 11 CYS HB3 1 1 10 4793 1 1 11 CYS N N 1.564 -5.331 -2.765 1.00 . A A . 11 CYS N 1 1 10 4794 1 1 11 CYS O O 1.368 -7.158 -0.757 1.00 . A A . 11 CYS O 1 1 10 4795 1 1 11 CYS SG S 1.287 -3.876 -0.022 1.00 . A A . 11 CYS SG 1 1 10 4796 1 1 12 GLY C C 2.757 -7.474 2.295 1.00 . A A . 12 GLY C 1 1 10 4797 1 1 12 GLY CA C 3.265 -8.040 0.968 1.00 . A A . 12 GLY CA 1 1 10 4798 1 1 12 GLY H H 4.291 -6.458 -0.076 1.00 . A A . 12 GLY H 1 1 10 4799 1 1 12 GLY HA2 H 2.555 -8.758 0.586 1.00 . A A . 12 GLY HA2 1 1 10 4800 1 1 12 GLY HA3 H 4.217 -8.524 1.131 1.00 . A A . 12 GLY HA3 1 1 10 4801 1 1 12 GLY N N 3.434 -6.932 -0.018 1.00 . A A . 12 GLY N 1 1 10 4802 1 1 12 GLY O O 1.679 -6.913 2.368 1.00 . A A . 12 GLY O 1 1 10 4803 1 1 13 ARG C C 3.601 -5.639 4.857 1.00 . A A . 13 ARG C 1 1 10 4804 1 1 13 ARG CA C 3.101 -7.083 4.676 1.00 . A A . 13 ARG CA 1 1 10 4805 1 1 13 ARG CB C 3.759 -8.019 5.698 1.00 . A A . 13 ARG CB 1 1 10 4806 1 1 13 ARG CD C 2.449 -7.325 7.714 1.00 . A A . 13 ARG CD 1 1 10 4807 1 1 13 ARG CG C 2.723 -8.467 6.731 1.00 . A A . 13 ARG CG 1 1 10 4808 1 1 13 ARG CZ C 1.135 -8.227 9.538 1.00 . A A . 13 ARG CZ 1 1 10 4809 1 1 13 ARG H H 4.392 -8.069 3.255 1.00 . A A . 13 ARG H 1 1 10 4810 1 1 13 ARG HA H 2.023 -7.126 4.774 1.00 . A A . 13 ARG HA 1 1 10 4811 1 1 13 ARG HB2 H 4.154 -8.886 5.187 1.00 . A A . 13 ARG HB2 1 1 10 4812 1 1 13 ARG HB3 H 4.563 -7.502 6.198 1.00 . A A . 13 ARG HB3 1 1 10 4813 1 1 13 ARG HD2 H 3.235 -7.271 8.454 1.00 . A A . 13 ARG HD2 1 1 10 4814 1 1 13 ARG HD3 H 2.361 -6.388 7.189 1.00 . A A . 13 ARG HD3 1 1 10 4815 1 1 13 ARG HE H 0.308 -7.485 7.891 1.00 . A A . 13 ARG HE 1 1 10 4816 1 1 13 ARG HG2 H 1.808 -8.738 6.228 1.00 . A A . 13 ARG HG2 1 1 10 4817 1 1 13 ARG HG3 H 3.102 -9.321 7.272 1.00 . A A . 13 ARG HG3 1 1 10 4818 1 1 13 ARG HH11 H 1.281 -6.484 10.521 1.00 . A A . 13 ARG HH11 1 1 10 4819 1 1 13 ARG HH12 H 1.201 -7.900 11.515 1.00 . A A . 13 ARG HH12 1 1 10 4820 1 1 13 ARG HH21 H 0.994 -10.098 8.829 1.00 . A A . 13 ARG HH21 1 1 10 4821 1 1 13 ARG HH22 H 1.037 -9.952 10.556 1.00 . A A . 13 ARG HH22 1 1 10 4822 1 1 13 ARG N N 3.528 -7.614 3.343 1.00 . A A . 13 ARG N 1 1 10 4823 1 1 13 ARG NE N 1.151 -7.673 8.356 1.00 . A A . 13 ARG NE 1 1 10 4824 1 1 13 ARG NH1 N 1.211 -7.478 10.609 1.00 . A A . 13 ARG NH1 1 1 10 4825 1 1 13 ARG NH2 N 1.048 -9.527 9.649 1.00 . A A . 13 ARG NH2 1 1 10 4826 1 1 13 ARG O O 4.061 -5.261 5.920 1.00 . A A . 13 ARG O 1 1 10 4827 1 1 14 GLY C C 5.496 -3.355 3.663 1.00 . A A . 14 GLY C 1 1 10 4828 1 1 14 GLY CA C 3.990 -3.420 3.936 1.00 . A A . 14 GLY CA 1 1 10 4829 1 1 14 GLY H H 3.145 -5.153 2.980 1.00 . A A . 14 GLY H 1 1 10 4830 1 1 14 GLY HA2 H 3.467 -2.810 3.214 1.00 . A A . 14 GLY HA2 1 1 10 4831 1 1 14 GLY HA3 H 3.793 -3.049 4.931 1.00 . A A . 14 GLY HA3 1 1 10 4832 1 1 14 GLY N N 3.517 -4.831 3.828 1.00 . A A . 14 GLY N 1 1 10 4833 1 1 14 GLY O O 6.199 -2.542 4.233 1.00 . A A . 14 GLY O 1 1 10 4834 1 1 15 LYS C C 7.834 -2.908 1.706 1.00 . A A . 15 LYS C 1 1 10 4835 1 1 15 LYS CA C 7.467 -4.181 2.485 1.00 . A A . 15 LYS CA 1 1 10 4836 1 1 15 LYS CB C 7.734 -5.438 1.649 1.00 . A A . 15 LYS CB 1 1 10 4837 1 1 15 LYS CD C 8.783 -7.634 2.231 1.00 . A A . 15 LYS CD 1 1 10 4838 1 1 15 LYS CE C 8.704 -8.226 0.820 1.00 . A A . 15 LYS CE 1 1 10 4839 1 1 15 LYS CG C 9.013 -6.122 2.144 1.00 . A A . 15 LYS CG 1 1 10 4840 1 1 15 LYS H H 5.416 -4.851 2.344 1.00 . A A . 15 LYS H 1 1 10 4841 1 1 15 LYS HA H 8.031 -4.228 3.397 1.00 . A A . 15 LYS HA 1 1 10 4842 1 1 15 LYS HB2 H 6.900 -6.119 1.743 1.00 . A A . 15 LYS HB2 1 1 10 4843 1 1 15 LYS HB3 H 7.857 -5.161 0.613 1.00 . A A . 15 LYS HB3 1 1 10 4844 1 1 15 LYS HD2 H 9.603 -8.089 2.769 1.00 . A A . 15 LYS HD2 1 1 10 4845 1 1 15 LYS HD3 H 7.859 -7.827 2.755 1.00 . A A . 15 LYS HD3 1 1 10 4846 1 1 15 LYS HE2 H 8.847 -7.449 0.081 1.00 . A A . 15 LYS HE2 1 1 10 4847 1 1 15 LYS HE3 H 9.442 -9.003 0.697 1.00 . A A . 15 LYS HE3 1 1 10 4848 1 1 15 LYS HG2 H 9.817 -5.918 1.453 1.00 . A A . 15 LYS HG2 1 1 10 4849 1 1 15 LYS HG3 H 9.271 -5.741 3.120 1.00 . A A . 15 LYS HG3 1 1 10 4850 1 1 15 LYS HZ1 H 6.629 -8.056 0.882 1.00 . A A . 15 LYS HZ1 1 1 10 4851 1 1 15 LYS HZ2 H 7.218 -9.557 1.419 1.00 . A A . 15 LYS HZ2 1 1 10 4852 1 1 15 LYS HZ3 H 7.196 -9.194 -0.241 1.00 . A A . 15 LYS HZ3 1 1 10 4853 1 1 15 LYS N N 6.001 -4.203 2.793 1.00 . A A . 15 LYS N 1 1 10 4854 1 1 15 LYS NZ N 7.333 -8.802 0.712 1.00 . A A . 15 LYS NZ 1 1 10 4855 1 1 15 LYS O O 8.695 -2.160 2.130 1.00 . A A . 15 LYS O 1 1 10 4856 1 1 16 PRO C C 6.822 -0.249 0.459 1.00 . A A . 16 PRO C 1 1 10 4857 1 1 16 PRO CA C 7.423 -1.483 -0.227 1.00 . A A . 16 PRO CA 1 1 10 4858 1 1 16 PRO CB C 6.710 -1.780 -1.542 1.00 . A A . 16 PRO CB 1 1 10 4859 1 1 16 PRO CD C 6.113 -3.534 0.012 1.00 . A A . 16 PRO CD 1 1 10 4860 1 1 16 PRO CG C 5.637 -2.759 -1.191 1.00 . A A . 16 PRO CG 1 1 10 4861 1 1 16 PRO HA H 8.480 -1.356 -0.394 1.00 . A A . 16 PRO HA 1 1 10 4862 1 1 16 PRO HB2 H 6.279 -0.874 -1.947 1.00 . A A . 16 PRO HB2 1 1 10 4863 1 1 16 PRO HB3 H 7.394 -2.222 -2.250 1.00 . A A . 16 PRO HB3 1 1 10 4864 1 1 16 PRO HD2 H 5.305 -3.676 0.715 1.00 . A A . 16 PRO HD2 1 1 10 4865 1 1 16 PRO HD3 H 6.528 -4.484 -0.288 1.00 . A A . 16 PRO HD3 1 1 10 4866 1 1 16 PRO HG2 H 4.723 -2.230 -0.952 1.00 . A A . 16 PRO HG2 1 1 10 4867 1 1 16 PRO HG3 H 5.467 -3.433 -2.015 1.00 . A A . 16 PRO HG3 1 1 10 4868 1 1 16 PRO N N 7.163 -2.690 0.596 1.00 . A A . 16 PRO N 1 1 10 4869 1 1 16 PRO O O 5.709 -0.300 0.952 1.00 . A A . 16 PRO O 1 1 10 4870 1 1 17 PRO C C 6.021 2.750 0.292 1.00 . A A . 17 PRO C 1 1 10 4871 1 1 17 PRO CA C 7.111 2.070 1.131 1.00 . A A . 17 PRO CA 1 1 10 4872 1 1 17 PRO CB C 8.366 2.937 1.193 1.00 . A A . 17 PRO CB 1 1 10 4873 1 1 17 PRO CD C 8.928 0.968 -0.086 1.00 . A A . 17 PRO CD 1 1 10 4874 1 1 17 PRO CG C 9.243 2.430 0.094 1.00 . A A . 17 PRO CG 1 1 10 4875 1 1 17 PRO HA H 6.753 1.870 2.128 1.00 . A A . 17 PRO HA 1 1 10 4876 1 1 17 PRO HB2 H 8.113 3.975 1.026 1.00 . A A . 17 PRO HB2 1 1 10 4877 1 1 17 PRO HB3 H 8.858 2.817 2.145 1.00 . A A . 17 PRO HB3 1 1 10 4878 1 1 17 PRO HD2 H 8.931 0.709 -1.136 1.00 . A A . 17 PRO HD2 1 1 10 4879 1 1 17 PRO HD3 H 9.631 0.358 0.459 1.00 . A A . 17 PRO HD3 1 1 10 4880 1 1 17 PRO HG2 H 9.039 2.970 -0.820 1.00 . A A . 17 PRO HG2 1 1 10 4881 1 1 17 PRO HG3 H 10.281 2.547 0.368 1.00 . A A . 17 PRO HG3 1 1 10 4882 1 1 17 PRO N N 7.579 0.820 0.482 1.00 . A A . 17 PRO N 1 1 10 4883 1 1 17 PRO O O 6.292 3.328 -0.744 1.00 . A A . 17 PRO O 1 1 10 4884 1 1 18 CYS C C 3.768 4.878 0.181 1.00 . A A . 18 CYS C 1 1 10 4885 1 1 18 CYS CA C 3.683 3.359 -0.017 1.00 . A A . 18 CYS CA 1 1 10 4886 1 1 18 CYS CB C 2.378 2.812 0.583 1.00 . A A . 18 CYS CB 1 1 10 4887 1 1 18 CYS H H 4.597 2.237 1.584 1.00 . A A . 18 CYS H 1 1 10 4888 1 1 18 CYS HA H 3.744 3.108 -1.063 1.00 . A A . 18 CYS HA 1 1 10 4889 1 1 18 CYS HB2 H 2.605 2.054 1.315 1.00 . A A . 18 CYS HB2 1 1 10 4890 1 1 18 CYS HB3 H 1.833 3.618 1.057 1.00 . A A . 18 CYS HB3 1 1 10 4891 1 1 18 CYS N N 4.789 2.698 0.743 1.00 . A A . 18 CYS N 1 1 10 4892 1 1 18 CYS O O 4.578 5.364 0.952 1.00 . A A . 18 CYS O 1 1 10 4893 1 1 18 CYS SG S 1.362 2.096 -0.731 1.00 . A A . 18 CYS SG 1 1 10 4894 1 1 19 CYS C C 2.234 7.485 0.977 1.00 . A A . 19 CYS C 1 1 10 4895 1 1 19 CYS CA C 2.987 7.122 -0.307 1.00 . A A . 19 CYS CA 1 1 10 4896 1 1 19 CYS CB C 2.303 7.745 -1.536 1.00 . A A . 19 CYS CB 1 1 10 4897 1 1 19 CYS H H 2.284 5.233 -1.097 1.00 . A A . 19 CYS H 1 1 10 4898 1 1 19 CYS HA H 4.012 7.456 -0.245 1.00 . A A . 19 CYS HA 1 1 10 4899 1 1 19 CYS HB2 H 1.241 7.812 -1.358 1.00 . A A . 19 CYS HB2 1 1 10 4900 1 1 19 CYS HB3 H 2.699 8.736 -1.697 1.00 . A A . 19 CYS HB3 1 1 10 4901 1 1 19 CYS N N 2.939 5.637 -0.491 1.00 . A A . 19 CYS N 1 1 10 4902 1 1 19 CYS O O 1.286 6.821 1.350 1.00 . A A . 19 CYS O 1 1 10 4903 1 1 19 CYS SG S 2.600 6.733 -3.014 1.00 . A A . 19 CYS SG 1 1 10 4904 1 1 20 LYS C C 0.460 8.895 2.798 1.00 . A A . 20 LYS C 1 1 10 4905 1 1 20 LYS CA C 1.989 8.911 2.947 1.00 . A A . 20 LYS CA 1 1 10 4906 1 1 20 LYS CB C 2.498 10.326 3.264 1.00 . A A . 20 LYS CB 1 1 10 4907 1 1 20 LYS CD C 2.750 12.647 2.364 1.00 . A A . 20 LYS CD 1 1 10 4908 1 1 20 LYS CE C 2.983 13.271 0.983 1.00 . A A . 20 LYS CE 1 1 10 4909 1 1 20 LYS CG C 1.997 11.323 2.212 1.00 . A A . 20 LYS CG 1 1 10 4910 1 1 20 LYS H H 3.442 9.021 1.357 1.00 . A A . 20 LYS H 1 1 10 4911 1 1 20 LYS HA H 2.287 8.240 3.735 1.00 . A A . 20 LYS HA 1 1 10 4912 1 1 20 LYS HB2 H 2.137 10.624 4.238 1.00 . A A . 20 LYS HB2 1 1 10 4913 1 1 20 LYS HB3 H 3.577 10.324 3.267 1.00 . A A . 20 LYS HB3 1 1 10 4914 1 1 20 LYS HD2 H 2.166 13.325 2.972 1.00 . A A . 20 LYS HD2 1 1 10 4915 1 1 20 LYS HD3 H 3.703 12.468 2.841 1.00 . A A . 20 LYS HD3 1 1 10 4916 1 1 20 LYS HE2 H 4.010 13.596 0.886 1.00 . A A . 20 LYS HE2 1 1 10 4917 1 1 20 LYS HE3 H 2.735 12.567 0.205 1.00 . A A . 20 LYS HE3 1 1 10 4918 1 1 20 LYS HG2 H 2.165 10.920 1.224 1.00 . A A . 20 LYS HG2 1 1 10 4919 1 1 20 LYS HG3 H 0.940 11.495 2.355 1.00 . A A . 20 LYS HG3 1 1 10 4920 1 1 20 LYS HZ1 H 1.078 14.115 1.033 1.00 . A A . 20 LYS HZ1 1 1 10 4921 1 1 20 LYS HZ2 H 2.167 14.920 0.007 1.00 . A A . 20 LYS HZ2 1 1 10 4922 1 1 20 LYS HZ3 H 2.289 15.103 1.693 1.00 . A A . 20 LYS HZ3 1 1 10 4923 1 1 20 LYS N N 2.664 8.516 1.669 1.00 . A A . 20 LYS N 1 1 10 4924 1 1 20 LYS NZ N 2.060 14.441 0.925 1.00 . A A . 20 LYS NZ 1 1 10 4925 1 1 20 LYS O O -0.096 9.487 1.891 1.00 . A A . 20 LYS O 1 1 10 4926 1 1 21 GLY C C -2.148 6.743 3.116 1.00 . A A . 21 GLY C 1 1 10 4927 1 1 21 GLY CA C -1.707 8.131 3.608 1.00 . A A . 21 GLY CA 1 1 10 4928 1 1 21 GLY H H 0.256 7.734 4.399 1.00 . A A . 21 GLY H 1 1 10 4929 1 1 21 GLY HA2 H -2.123 8.311 4.591 1.00 . A A . 21 GLY HA2 1 1 10 4930 1 1 21 GLY HA3 H -2.071 8.883 2.924 1.00 . A A . 21 GLY HA3 1 1 10 4931 1 1 21 GLY N N -0.218 8.205 3.684 1.00 . A A . 21 GLY N 1 1 10 4932 1 1 21 GLY O O -3.245 6.302 3.402 1.00 . A A . 21 GLY O 1 1 10 4933 1 1 22 TYR C C -1.086 3.604 2.745 1.00 . A A . 22 TYR C 1 1 10 4934 1 1 22 TYR CA C -1.700 4.699 1.863 1.00 . A A . 22 TYR CA 1 1 10 4935 1 1 22 TYR CB C -1.132 4.609 0.437 1.00 . A A . 22 TYR CB 1 1 10 4936 1 1 22 TYR CD1 C -2.692 6.539 -0.109 1.00 . A A . 22 TYR CD1 1 1 10 4937 1 1 22 TYR CD2 C -0.674 6.251 -1.419 1.00 . A A . 22 TYR CD2 1 1 10 4938 1 1 22 TYR CE1 C -3.028 7.662 -0.876 1.00 . A A . 22 TYR CE1 1 1 10 4939 1 1 22 TYR CE2 C -1.011 7.373 -2.186 1.00 . A A . 22 TYR CE2 1 1 10 4940 1 1 22 TYR CG C -1.512 5.832 -0.381 1.00 . A A . 22 TYR CG 1 1 10 4941 1 1 22 TYR CZ C -2.187 8.079 -1.915 1.00 . A A . 22 TYR CZ 1 1 10 4942 1 1 22 TYR H H -0.432 6.421 2.147 1.00 . A A . 22 TYR H 1 1 10 4943 1 1 22 TYR HA H -2.774 4.603 1.837 1.00 . A A . 22 TYR HA 1 1 10 4944 1 1 22 TYR HB2 H -0.056 4.536 0.486 1.00 . A A . 22 TYR HB2 1 1 10 4945 1 1 22 TYR HB3 H -1.525 3.726 -0.045 1.00 . A A . 22 TYR HB3 1 1 10 4946 1 1 22 TYR HD1 H -3.342 6.220 0.691 1.00 . A A . 22 TYR HD1 1 1 10 4947 1 1 22 TYR HD2 H 0.234 5.708 -1.630 1.00 . A A . 22 TYR HD2 1 1 10 4948 1 1 22 TYR HE1 H -3.937 8.206 -0.667 1.00 . A A . 22 TYR HE1 1 1 10 4949 1 1 22 TYR HE2 H -0.361 7.693 -2.988 1.00 . A A . 22 TYR HE2 1 1 10 4950 1 1 22 TYR HH H -2.061 9.946 -2.300 1.00 . A A . 22 TYR HH 1 1 10 4951 1 1 22 TYR N N -1.311 6.052 2.373 1.00 . A A . 22 TYR N 1 1 10 4952 1 1 22 TYR O O 0.070 3.668 3.117 1.00 . A A . 22 TYR O 1 1 10 4953 1 1 22 TYR OH O -2.518 9.185 -2.670 1.00 . A A . 22 TYR OH 1 1 10 4954 1 1 23 ALA C C -1.379 0.159 3.137 1.00 . A A . 23 ALA C 1 1 10 4955 1 1 23 ALA CA C -1.327 1.478 3.920 1.00 . A A . 23 ALA CA 1 1 10 4956 1 1 23 ALA CB C -2.258 1.424 5.132 1.00 . A A . 23 ALA CB 1 1 10 4957 1 1 23 ALA H H -2.780 2.562 2.750 1.00 . A A . 23 ALA H 1 1 10 4958 1 1 23 ALA HA H -0.319 1.690 4.236 1.00 . A A . 23 ALA HA 1 1 10 4959 1 1 23 ALA HB1 H -1.991 2.207 5.826 1.00 . A A . 23 ALA HB1 1 1 10 4960 1 1 23 ALA HB2 H -2.162 0.465 5.620 1.00 . A A . 23 ALA HB2 1 1 10 4961 1 1 23 ALA HB3 H -3.280 1.563 4.810 1.00 . A A . 23 ALA HB3 1 1 10 4962 1 1 23 ALA N N -1.854 2.592 3.071 1.00 . A A . 23 ALA N 1 1 10 4963 1 1 23 ALA O O -2.232 -0.032 2.288 1.00 . A A . 23 ALA O 1 1 10 4964 1 1 24 CYS C C -1.349 -3.082 3.393 1.00 . A A . 24 CYS C 1 1 10 4965 1 1 24 CYS CA C -0.471 -2.054 2.675 1.00 . A A . 24 CYS CA 1 1 10 4966 1 1 24 CYS CB C 0.989 -2.517 2.666 1.00 . A A . 24 CYS CB 1 1 10 4967 1 1 24 CYS H H 0.203 -0.572 4.098 1.00 . A A . 24 CYS H 1 1 10 4968 1 1 24 CYS HA H -0.815 -1.911 1.663 1.00 . A A . 24 CYS HA 1 1 10 4969 1 1 24 CYS HB2 H 1.547 -1.975 3.413 1.00 . A A . 24 CYS HB2 1 1 10 4970 1 1 24 CYS HB3 H 1.034 -3.575 2.882 1.00 . A A . 24 CYS HB3 1 1 10 4971 1 1 24 CYS N N -0.474 -0.749 3.411 1.00 . A A . 24 CYS N 1 1 10 4972 1 1 24 CYS O O -1.648 -2.950 4.565 1.00 . A A . 24 CYS O 1 1 10 4973 1 1 24 CYS SG S 1.711 -2.210 1.039 1.00 . A A . 24 CYS SG 1 1 10 4974 1 1 25 SER C C -2.102 -6.550 2.976 1.00 . A A . 25 SER C 1 1 10 4975 1 1 25 SER CA C -2.626 -5.152 3.314 1.00 . A A . 25 SER CA 1 1 10 4976 1 1 25 SER CB C -4.015 -4.938 2.707 1.00 . A A . 25 SER CB 1 1 10 4977 1 1 25 SER H H -1.509 -4.187 1.746 1.00 . A A . 25 SER H 1 1 10 4978 1 1 25 SER HA H -2.669 -5.017 4.380 1.00 . A A . 25 SER HA 1 1 10 4979 1 1 25 SER HB2 H -3.917 -4.619 1.683 1.00 . A A . 25 SER HB2 1 1 10 4980 1 1 25 SER HB3 H -4.566 -5.870 2.740 1.00 . A A . 25 SER HB3 1 1 10 4981 1 1 25 SER HG H -4.593 -3.102 2.990 1.00 . A A . 25 SER HG 1 1 10 4982 1 1 25 SER N N -1.765 -4.106 2.690 1.00 . A A . 25 SER N 1 1 10 4983 1 1 25 SER O O -2.174 -6.988 1.846 1.00 . A A . 25 SER O 1 1 10 4984 1 1 25 SER OG O -4.705 -3.939 3.448 1.00 . A A . 25 SER OG 1 1 10 4985 1 1 26 LYS C C -2.221 -9.586 3.381 1.00 . A A . 26 LYS C 1 1 10 4986 1 1 26 LYS CA C -1.058 -8.632 3.692 1.00 . A A . 26 LYS CA 1 1 10 4987 1 1 26 LYS CB C -0.352 -9.038 4.990 1.00 . A A . 26 LYS CB 1 1 10 4988 1 1 26 LYS CD C 1.345 -10.394 3.736 1.00 . A A . 26 LYS CD 1 1 10 4989 1 1 26 LYS CE C 1.982 -11.779 3.598 1.00 . A A . 26 LYS CE 1 1 10 4990 1 1 26 LYS CG C 0.276 -10.429 4.832 1.00 . A A . 26 LYS CG 1 1 10 4991 1 1 26 LYS H H -1.534 -6.875 4.855 1.00 . A A . 26 LYS H 1 1 10 4992 1 1 26 LYS HA H -0.355 -8.619 2.877 1.00 . A A . 26 LYS HA 1 1 10 4993 1 1 26 LYS HB2 H 0.422 -8.318 5.215 1.00 . A A . 26 LYS HB2 1 1 10 4994 1 1 26 LYS HB3 H -1.067 -9.059 5.798 1.00 . A A . 26 LYS HB3 1 1 10 4995 1 1 26 LYS HD2 H 0.888 -10.111 2.798 1.00 . A A . 26 LYS HD2 1 1 10 4996 1 1 26 LYS HD3 H 2.105 -9.675 3.998 1.00 . A A . 26 LYS HD3 1 1 10 4997 1 1 26 LYS HE2 H 2.791 -11.890 4.305 1.00 . A A . 26 LYS HE2 1 1 10 4998 1 1 26 LYS HE3 H 1.242 -12.551 3.746 1.00 . A A . 26 LYS HE3 1 1 10 4999 1 1 26 LYS HG2 H 0.730 -10.725 5.767 1.00 . A A . 26 LYS HG2 1 1 10 5000 1 1 26 LYS HG3 H -0.490 -11.140 4.564 1.00 . A A . 26 LYS HG3 1 1 10 5001 1 1 26 LYS HZ1 H 2.990 -12.734 2.044 1.00 . A A . 26 LYS HZ1 1 1 10 5002 1 1 26 LYS HZ2 H 3.160 -11.043 2.046 1.00 . A A . 26 LYS HZ2 1 1 10 5003 1 1 26 LYS HZ3 H 1.704 -11.753 1.533 1.00 . A A . 26 LYS HZ3 1 1 10 5004 1 1 26 LYS N N -1.580 -7.253 3.950 1.00 . A A . 26 LYS N 1 1 10 5005 1 1 26 LYS NZ N 2.497 -11.830 2.200 1.00 . A A . 26 LYS NZ 1 1 10 5006 1 1 26 LYS O O -2.105 -10.464 2.547 1.00 . A A . 26 LYS O 1 1 10 5007 1 1 27 THR C C -5.053 -10.053 2.363 1.00 . A A . 27 THR C 1 1 10 5008 1 1 27 THR CA C -4.526 -10.286 3.784 1.00 . A A . 27 THR CA 1 1 10 5009 1 1 27 THR CB C -5.579 -9.858 4.817 1.00 . A A . 27 THR CB 1 1 10 5010 1 1 27 THR CG2 C -6.763 -10.829 4.787 1.00 . A A . 27 THR CG2 1 1 10 5011 1 1 27 THR H H -3.403 -8.684 4.698 1.00 . A A . 27 THR H 1 1 10 5012 1 1 27 THR HA H -4.267 -11.322 3.924 1.00 . A A . 27 THR HA 1 1 10 5013 1 1 27 THR HB H -5.933 -8.865 4.581 1.00 . A A . 27 THR HB 1 1 10 5014 1 1 27 THR HG1 H -4.928 -8.951 6.412 1.00 . A A . 27 THR HG1 1 1 10 5015 1 1 27 THR HG21 H -6.445 -11.773 4.370 1.00 . A A . 27 THR HG21 1 1 10 5016 1 1 27 THR HG22 H -7.553 -10.416 4.179 1.00 . A A . 27 THR HG22 1 1 10 5017 1 1 27 THR HG23 H -7.127 -10.984 5.793 1.00 . A A . 27 THR HG23 1 1 10 5018 1 1 27 THR N N -3.339 -9.407 4.039 1.00 . A A . 27 THR N 1 1 10 5019 1 1 27 THR O O -5.475 -10.973 1.688 1.00 . A A . 27 THR O 1 1 10 5020 1 1 27 THR OG1 O -5.001 -9.860 6.116 1.00 . A A . 27 THR OG1 1 1 10 5021 1 1 28 TRP C C -4.400 -8.714 -0.485 1.00 . A A . 28 TRP C 1 1 10 5022 1 1 28 TRP CA C -5.524 -8.508 0.539 1.00 . A A . 28 TRP CA 1 1 10 5023 1 1 28 TRP CB C -5.951 -7.033 0.598 1.00 . A A . 28 TRP CB 1 1 10 5024 1 1 28 TRP CD1 C -7.655 -7.839 2.310 1.00 . A A . 28 TRP CD1 1 1 10 5025 1 1 28 TRP CD2 C -7.738 -5.615 1.984 1.00 . A A . 28 TRP CD2 1 1 10 5026 1 1 28 TRP CE2 C -8.723 -5.924 2.952 1.00 . A A . 28 TRP CE2 1 1 10 5027 1 1 28 TRP CE3 C -7.587 -4.270 1.600 1.00 . A A . 28 TRP CE3 1 1 10 5028 1 1 28 TRP CG C -7.067 -6.850 1.591 1.00 . A A . 28 TRP CG 1 1 10 5029 1 1 28 TRP CH2 C -9.368 -3.607 3.125 1.00 . A A . 28 TRP CH2 1 1 10 5030 1 1 28 TRP CZ2 C -9.530 -4.938 3.517 1.00 . A A . 28 TRP CZ2 1 1 10 5031 1 1 28 TRP CZ3 C -8.400 -3.273 2.168 1.00 . A A . 28 TRP CZ3 1 1 10 5032 1 1 28 TRP H H -4.681 -8.108 2.484 1.00 . A A . 28 TRP H 1 1 10 5033 1 1 28 TRP HA H -6.373 -9.126 0.294 1.00 . A A . 28 TRP HA 1 1 10 5034 1 1 28 TRP HB2 H -5.107 -6.428 0.895 1.00 . A A . 28 TRP HB2 1 1 10 5035 1 1 28 TRP HB3 H -6.287 -6.720 -0.378 1.00 . A A . 28 TRP HB3 1 1 10 5036 1 1 28 TRP HD1 H -7.398 -8.888 2.263 1.00 . A A . 28 TRP HD1 1 1 10 5037 1 1 28 TRP HE1 H -9.198 -7.791 3.738 1.00 . A A . 28 TRP HE1 1 1 10 5038 1 1 28 TRP HE3 H -6.844 -4.002 0.864 1.00 . A A . 28 TRP HE3 1 1 10 5039 1 1 28 TRP HH2 H -9.989 -2.838 3.557 1.00 . A A . 28 TRP HH2 1 1 10 5040 1 1 28 TRP HZ2 H -10.274 -5.200 4.254 1.00 . A A . 28 TRP HZ2 1 1 10 5041 1 1 28 TRP HZ3 H -8.277 -2.244 1.866 1.00 . A A . 28 TRP HZ3 1 1 10 5042 1 1 28 TRP N N -5.027 -8.826 1.913 1.00 . A A . 28 TRP N 1 1 10 5043 1 1 28 TRP NE1 N -8.630 -7.289 3.118 1.00 . A A . 28 TRP NE1 1 1 10 5044 1 1 28 TRP O O -4.586 -9.360 -1.499 1.00 . A A . 28 TRP O 1 1 10 5045 1 1 29 GLY C C -1.756 -7.048 -1.884 1.00 . A A . 29 GLY C 1 1 10 5046 1 1 29 GLY CA C -2.081 -8.359 -1.150 1.00 . A A . 29 GLY CA 1 1 10 5047 1 1 29 GLY H H -3.107 -7.680 0.617 1.00 . A A . 29 GLY H 1 1 10 5048 1 1 29 GLY HA2 H -1.214 -8.676 -0.588 1.00 . A A . 29 GLY HA2 1 1 10 5049 1 1 29 GLY HA3 H -2.326 -9.118 -1.878 1.00 . A A . 29 GLY HA3 1 1 10 5050 1 1 29 GLY N N -3.232 -8.183 -0.215 1.00 . A A . 29 GLY N 1 1 10 5051 1 1 29 GLY O O -1.055 -7.060 -2.879 1.00 . A A . 29 GLY O 1 1 10 5052 1 1 30 TRP C C -1.908 -3.445 -1.139 1.00 . A A . 30 TRP C 1 1 10 5053 1 1 30 TRP CA C -1.918 -4.633 -2.117 1.00 . A A . 30 TRP CA 1 1 10 5054 1 1 30 TRP CB C -2.999 -4.480 -3.207 1.00 . A A . 30 TRP CB 1 1 10 5055 1 1 30 TRP CD1 C -4.581 -2.847 -2.096 1.00 . A A . 30 TRP CD1 1 1 10 5056 1 1 30 TRP CD2 C -5.537 -4.842 -2.495 1.00 . A A . 30 TRP CD2 1 1 10 5057 1 1 30 TRP CE2 C -6.521 -4.034 -1.878 1.00 . A A . 30 TRP CE2 1 1 10 5058 1 1 30 TRP CE3 C -5.889 -6.156 -2.852 1.00 . A A . 30 TRP CE3 1 1 10 5059 1 1 30 TRP CG C -4.310 -4.065 -2.615 1.00 . A A . 30 TRP CG 1 1 10 5060 1 1 30 TRP CH2 C -8.140 -5.818 -1.988 1.00 . A A . 30 TRP CH2 1 1 10 5061 1 1 30 TRP CZ2 C -7.807 -4.511 -1.626 1.00 . A A . 30 TRP CZ2 1 1 10 5062 1 1 30 TRP CZ3 C -7.183 -6.640 -2.601 1.00 . A A . 30 TRP CZ3 1 1 10 5063 1 1 30 TRP H H -2.795 -5.910 -0.606 1.00 . A A . 30 TRP H 1 1 10 5064 1 1 30 TRP HA H -0.950 -4.714 -2.589 1.00 . A A . 30 TRP HA 1 1 10 5065 1 1 30 TRP HB2 H -2.683 -3.732 -3.919 1.00 . A A . 30 TRP HB2 1 1 10 5066 1 1 30 TRP HB3 H -3.121 -5.424 -3.718 1.00 . A A . 30 TRP HB3 1 1 10 5067 1 1 30 TRP HD1 H -3.885 -2.024 -2.030 1.00 . A A . 30 TRP HD1 1 1 10 5068 1 1 30 TRP HE1 H -6.326 -2.065 -1.231 1.00 . A A . 30 TRP HE1 1 1 10 5069 1 1 30 TRP HE3 H -5.158 -6.797 -3.325 1.00 . A A . 30 TRP HE3 1 1 10 5070 1 1 30 TRP HH2 H -9.133 -6.194 -1.798 1.00 . A A . 30 TRP HH2 1 1 10 5071 1 1 30 TRP HZ2 H -8.540 -3.874 -1.154 1.00 . A A . 30 TRP HZ2 1 1 10 5072 1 1 30 TRP HZ3 H -7.444 -7.650 -2.880 1.00 . A A . 30 TRP HZ3 1 1 10 5073 1 1 30 TRP N N -2.238 -5.917 -1.415 1.00 . A A . 30 TRP N 1 1 10 5074 1 1 30 TRP NE1 N -5.887 -2.829 -1.653 1.00 . A A . 30 TRP NE1 1 1 10 5075 1 1 30 TRP O O -2.148 -3.596 0.041 1.00 . A A . 30 TRP O 1 1 10 5076 1 1 31 CYS C C -2.593 -0.011 -1.275 1.00 . A A . 31 CYS C 1 1 10 5077 1 1 31 CYS CA C -1.589 -1.048 -0.770 1.00 . A A . 31 CYS CA 1 1 10 5078 1 1 31 CYS CB C -0.162 -0.506 -0.899 1.00 . A A . 31 CYS CB 1 1 10 5079 1 1 31 CYS H H -1.443 -2.178 -2.596 1.00 . A A . 31 CYS H 1 1 10 5080 1 1 31 CYS HA H -1.795 -1.307 0.256 1.00 . A A . 31 CYS HA 1 1 10 5081 1 1 31 CYS HB2 H 0.542 -1.286 -0.669 1.00 . A A . 31 CYS HB2 1 1 10 5082 1 1 31 CYS HB3 H 0.002 -0.163 -1.911 1.00 . A A . 31 CYS HB3 1 1 10 5083 1 1 31 CYS N N -1.628 -2.264 -1.639 1.00 . A A . 31 CYS N 1 1 10 5084 1 1 31 CYS O O -2.609 0.336 -2.442 1.00 . A A . 31 CYS O 1 1 10 5085 1 1 31 CYS SG S 0.078 0.876 0.243 1.00 . A A . 31 CYS SG 1 1 10 5086 1 1 32 ALA C C -4.689 2.485 0.347 1.00 . A A . 32 ALA C 1 1 10 5087 1 1 32 ALA CA C -4.435 1.506 -0.806 1.00 . A A . 32 ALA CA 1 1 10 5088 1 1 32 ALA CB C -5.702 0.709 -1.124 1.00 . A A . 32 ALA CB 1 1 10 5089 1 1 32 ALA H H -3.385 0.188 0.535 1.00 . A A . 32 ALA H 1 1 10 5090 1 1 32 ALA HA H -4.104 2.039 -1.683 1.00 . A A . 32 ALA HA 1 1 10 5091 1 1 32 ALA HB1 H -6.533 1.388 -1.245 1.00 . A A . 32 ALA HB1 1 1 10 5092 1 1 32 ALA HB2 H -5.910 0.027 -0.312 1.00 . A A . 32 ALA HB2 1 1 10 5093 1 1 32 ALA HB3 H -5.557 0.150 -2.034 1.00 . A A . 32 ALA HB3 1 1 10 5094 1 1 32 ALA N N -3.426 0.486 -0.399 1.00 . A A . 32 ALA N 1 1 10 5095 1 1 32 ALA O O -4.176 2.314 1.439 1.00 . A A . 32 ALA O 1 1 10 5096 1 1 33 VAL C C -6.649 3.848 2.275 1.00 . A A . 33 VAL C 1 1 10 5097 1 1 33 VAL CA C -5.762 4.494 1.204 1.00 . A A . 33 VAL CA 1 1 10 5098 1 1 33 VAL CB C -6.499 5.660 0.528 1.00 . A A . 33 VAL CB 1 1 10 5099 1 1 33 VAL CG1 C -6.582 6.841 1.499 1.00 . A A . 33 VAL CG1 1 1 10 5100 1 1 33 VAL CG2 C -5.749 6.099 -0.736 1.00 . A A . 33 VAL CG2 1 1 10 5101 1 1 33 VAL H H -5.877 3.620 -0.771 1.00 . A A . 33 VAL H 1 1 10 5102 1 1 33 VAL HA H -4.839 4.846 1.641 1.00 . A A . 33 VAL HA 1 1 10 5103 1 1 33 VAL HB H -7.499 5.347 0.262 1.00 . A A . 33 VAL HB 1 1 10 5104 1 1 33 VAL HG11 H -7.392 6.680 2.194 1.00 . A A . 33 VAL HG11 1 1 10 5105 1 1 33 VAL HG12 H -6.757 7.752 0.947 1.00 . A A . 33 VAL HG12 1 1 10 5106 1 1 33 VAL HG13 H -5.651 6.927 2.044 1.00 . A A . 33 VAL HG13 1 1 10 5107 1 1 33 VAL HG21 H -6.305 5.793 -1.609 1.00 . A A . 33 VAL HG21 1 1 10 5108 1 1 33 VAL HG22 H -4.772 5.640 -0.754 1.00 . A A . 33 VAL HG22 1 1 10 5109 1 1 33 VAL HG23 H -5.640 7.174 -0.738 1.00 . A A . 33 VAL HG23 1 1 10 5110 1 1 33 VAL N N -5.475 3.505 0.116 1.00 . A A . 33 VAL N 1 1 10 5111 1 1 33 VAL O O -7.831 3.644 2.072 1.00 . A A . 33 VAL O 1 1 10 5112 1 1 34 GLU C C -7.690 3.970 5.256 1.00 . A A . 34 GLU C 1 1 10 5113 1 1 34 GLU CA C -6.896 2.893 4.503 1.00 . A A . 34 GLU CA 1 1 10 5114 1 1 34 GLU CB C -5.877 2.214 5.428 1.00 . A A . 34 GLU CB 1 1 10 5115 1 1 34 GLU CD C -6.847 -0.091 5.572 1.00 . A A . 34 GLU CD 1 1 10 5116 1 1 34 GLU CG C -5.697 0.751 5.014 1.00 . A A . 34 GLU CG 1 1 10 5117 1 1 34 GLU H H -5.130 3.700 3.554 1.00 . A A . 34 GLU H 1 1 10 5118 1 1 34 GLU HA H -7.566 2.154 4.089 1.00 . A A . 34 GLU HA 1 1 10 5119 1 1 34 GLU HB2 H -4.930 2.729 5.360 1.00 . A A . 34 GLU HB2 1 1 10 5120 1 1 34 GLU HB3 H -6.236 2.255 6.448 1.00 . A A . 34 GLU HB3 1 1 10 5121 1 1 34 GLU HG2 H -5.689 0.681 3.934 1.00 . A A . 34 GLU HG2 1 1 10 5122 1 1 34 GLU HG3 H -4.761 0.380 5.403 1.00 . A A . 34 GLU HG3 1 1 10 5123 1 1 34 GLU N N -6.085 3.525 3.415 1.00 . A A . 34 GLU N 1 1 10 5124 1 1 34 GLU O O -7.223 4.533 6.230 1.00 . A A . 34 GLU O 1 1 10 5125 1 1 34 GLU OE1 O -6.778 -0.456 6.735 1.00 . A A . 34 GLU OE1 1 1 10 5126 1 1 34 GLU OE2 O -7.779 -0.354 4.830 1.00 . A A . 34 GLU OE2 1 1 10 5127 1 1 35 ALA C C -11.214 5.018 5.256 1.00 . A A . 35 ALA C 1 1 10 5128 1 1 35 ALA CA C -9.720 5.302 5.479 1.00 . A A . 35 ALA CA 1 1 10 5129 1 1 35 ALA CB C -9.322 6.620 4.811 1.00 . A A . 35 ALA CB 1 1 10 5130 1 1 35 ALA H H -9.235 3.794 4.016 1.00 . A A . 35 ALA H 1 1 10 5131 1 1 35 ALA HA H -9.497 5.341 6.534 1.00 . A A . 35 ALA HA 1 1 10 5132 1 1 35 ALA HB1 H -9.082 6.439 3.774 1.00 . A A . 35 ALA HB1 1 1 10 5133 1 1 35 ALA HB2 H -8.460 7.032 5.313 1.00 . A A . 35 ALA HB2 1 1 10 5134 1 1 35 ALA HB3 H -10.144 7.319 4.874 1.00 . A A . 35 ALA HB3 1 1 10 5135 1 1 35 ALA N N -8.886 4.259 4.805 1.00 . A A . 35 ALA N 1 1 10 5136 1 1 35 ALA O O -11.587 4.428 4.260 1.00 . A A . 35 ALA O 1 1 10 5137 1 1 36 PRO C C -14.099 6.154 5.020 1.00 . A A . 36 PRO C 1 1 10 5138 1 1 36 PRO CA C -13.491 5.243 6.098 1.00 . A A . 36 PRO CA 1 1 10 5139 1 1 36 PRO CB C -14.000 5.618 7.488 1.00 . A A . 36 PRO CB 1 1 10 5140 1 1 36 PRO CD C -11.651 6.174 7.421 1.00 . A A . 36 PRO CD 1 1 10 5141 1 1 36 PRO CG C -12.972 6.554 8.039 1.00 . A A . 36 PRO CG 1 1 10 5142 1 1 36 PRO HA H -13.712 4.208 5.891 1.00 . A A . 36 PRO HA 1 1 10 5143 1 1 36 PRO HB2 H -14.959 6.111 7.415 1.00 . A A . 36 PRO HB2 1 1 10 5144 1 1 36 PRO HB3 H -14.071 4.741 8.113 1.00 . A A . 36 PRO HB3 1 1 10 5145 1 1 36 PRO HD2 H -11.077 7.061 7.185 1.00 . A A . 36 PRO HD2 1 1 10 5146 1 1 36 PRO HD3 H -11.095 5.526 8.079 1.00 . A A . 36 PRO HD3 1 1 10 5147 1 1 36 PRO HG2 H -13.224 7.573 7.780 1.00 . A A . 36 PRO HG2 1 1 10 5148 1 1 36 PRO HG3 H -12.913 6.450 9.112 1.00 . A A . 36 PRO HG3 1 1 10 5149 1 1 36 PRO N N -12.021 5.454 6.195 1.00 . A A . 36 PRO N 1 1 10 5150 1 1 36 PRO O O -14.851 5.648 4.203 1.00 . A A . 36 PRO O 1 1 11 5151 1 1 1 ASP C C 12.167 10.788 -5.202 1.00 . A A . 1 ASP C 1 1 11 5152 1 1 1 ASP CA C 13.586 10.985 -5.750 1.00 . A A . 1 ASP CA 1 1 11 5153 1 1 1 ASP CB C 14.314 12.094 -4.984 1.00 . A A . 1 ASP CB 1 1 11 5154 1 1 1 ASP CG C 15.077 11.488 -3.804 1.00 . A A . 1 ASP CG 1 1 11 5155 1 1 1 ASP H1 H 13.022 10.761 -7.745 1.00 . A A . 1 ASP H1 1 1 11 5156 1 1 1 ASP H2 H 14.498 11.573 -7.532 1.00 . A A . 1 ASP H2 1 1 11 5157 1 1 1 ASP H3 H 13.032 12.370 -7.208 1.00 . A A . 1 ASP H3 1 1 11 5158 1 1 1 ASP HA H 14.146 10.064 -5.684 1.00 . A A . 1 ASP HA 1 1 11 5159 1 1 1 ASP HB2 H 15.008 12.591 -5.647 1.00 . A A . 1 ASP HB2 1 1 11 5160 1 1 1 ASP HB3 H 13.593 12.808 -4.616 1.00 . A A . 1 ASP HB3 1 1 11 5161 1 1 1 ASP N N 13.530 11.459 -7.166 1.00 . A A . 1 ASP N 1 1 11 5162 1 1 1 ASP O O 11.442 11.741 -4.980 1.00 . A A . 1 ASP O 1 1 11 5163 1 1 1 ASP OD1 O 14.479 11.342 -2.749 1.00 . A A . 1 ASP OD1 1 1 11 5164 1 1 1 ASP OD2 O 16.246 11.181 -3.976 1.00 . A A . 1 ASP OD2 1 1 11 5165 1 1 2 GLY C C 10.164 7.785 -4.360 1.00 . A A . 2 GLY C 1 1 11 5166 1 1 2 GLY CA C 10.396 9.295 -4.454 1.00 . A A . 2 GLY CA 1 1 11 5167 1 1 2 GLY H H 12.371 8.810 -5.172 1.00 . A A . 2 GLY H 1 1 11 5168 1 1 2 GLY HA2 H 10.299 9.738 -3.473 1.00 . A A . 2 GLY HA2 1 1 11 5169 1 1 2 GLY HA3 H 9.664 9.728 -5.119 1.00 . A A . 2 GLY HA3 1 1 11 5170 1 1 2 GLY N N 11.768 9.560 -4.985 1.00 . A A . 2 GLY N 1 1 11 5171 1 1 2 GLY O O 10.038 7.108 -5.364 1.00 . A A . 2 GLY O 1 1 11 5172 1 1 3 GLU C C 8.461 5.496 -2.492 1.00 . A A . 3 GLU C 1 1 11 5173 1 1 3 GLU CA C 9.885 5.781 -3.001 1.00 . A A . 3 GLU CA 1 1 11 5174 1 1 3 GLU CB C 10.944 5.321 -1.986 1.00 . A A . 3 GLU CB 1 1 11 5175 1 1 3 GLU CD C 12.035 6.423 -0.021 1.00 . A A . 3 GLU CD 1 1 11 5176 1 1 3 GLU CG C 10.699 5.977 -0.620 1.00 . A A . 3 GLU CG 1 1 11 5177 1 1 3 GLU H H 10.211 7.823 -2.373 1.00 . A A . 3 GLU H 1 1 11 5178 1 1 3 GLU HA H 10.046 5.279 -3.943 1.00 . A A . 3 GLU HA 1 1 11 5179 1 1 3 GLU HB2 H 10.894 4.247 -1.881 1.00 . A A . 3 GLU HB2 1 1 11 5180 1 1 3 GLU HB3 H 11.924 5.597 -2.344 1.00 . A A . 3 GLU HB3 1 1 11 5181 1 1 3 GLU HG2 H 10.054 6.834 -0.739 1.00 . A A . 3 GLU HG2 1 1 11 5182 1 1 3 GLU HG3 H 10.233 5.264 0.042 1.00 . A A . 3 GLU HG3 1 1 11 5183 1 1 3 GLU N N 10.107 7.254 -3.164 1.00 . A A . 3 GLU N 1 1 11 5184 1 1 3 GLU O O 8.270 4.872 -1.466 1.00 . A A . 3 GLU O 1 1 11 5185 1 1 3 GLU OE1 O 12.481 7.510 -0.355 1.00 . A A . 3 GLU OE1 1 1 11 5186 1 1 3 GLU OE2 O 12.593 5.671 0.763 1.00 . A A . 3 GLU OE2 1 1 11 5187 1 1 4 CYS C C 5.333 4.806 -3.813 1.00 . A A . 4 CYS C 1 1 11 5188 1 1 4 CYS CA C 6.050 5.690 -2.781 1.00 . A A . 4 CYS CA 1 1 11 5189 1 1 4 CYS CB C 5.411 7.085 -2.675 1.00 . A A . 4 CYS CB 1 1 11 5190 1 1 4 CYS H H 7.636 6.434 -4.043 1.00 . A A . 4 CYS H 1 1 11 5191 1 1 4 CYS HA H 6.041 5.211 -1.814 1.00 . A A . 4 CYS HA 1 1 11 5192 1 1 4 CYS HB2 H 5.041 7.229 -1.672 1.00 . A A . 4 CYS HB2 1 1 11 5193 1 1 4 CYS HB3 H 6.158 7.835 -2.886 1.00 . A A . 4 CYS HB3 1 1 11 5194 1 1 4 CYS N N 7.460 5.941 -3.213 1.00 . A A . 4 CYS N 1 1 11 5195 1 1 4 CYS O O 5.699 4.764 -4.973 1.00 . A A . 4 CYS O 1 1 11 5196 1 1 4 CYS SG S 4.037 7.261 -3.846 1.00 . A A . 4 CYS SG 1 1 11 5197 1 1 5 GLY C C 2.557 4.025 -5.135 1.00 . A A . 5 GLY C 1 1 11 5198 1 1 5 GLY CA C 3.571 3.204 -4.329 1.00 . A A . 5 GLY CA 1 1 11 5199 1 1 5 GLY H H 4.046 4.144 -2.453 1.00 . A A . 5 GLY H 1 1 11 5200 1 1 5 GLY HA2 H 4.270 2.731 -5.001 1.00 . A A . 5 GLY HA2 1 1 11 5201 1 1 5 GLY HA3 H 3.047 2.447 -3.762 1.00 . A A . 5 GLY HA3 1 1 11 5202 1 1 5 GLY N N 4.316 4.095 -3.390 1.00 . A A . 5 GLY N 1 1 11 5203 1 1 5 GLY O O 2.894 5.033 -5.726 1.00 . A A . 5 GLY O 1 1 11 5204 1 1 6 GLY C C -1.076 4.215 -5.212 1.00 . A A . 6 GLY C 1 1 11 5205 1 1 6 GLY CA C 0.275 4.344 -5.929 1.00 . A A . 6 GLY CA 1 1 11 5206 1 1 6 GLY H H 1.074 2.779 -4.681 1.00 . A A . 6 GLY H 1 1 11 5207 1 1 6 GLY HA2 H 0.554 5.386 -5.991 1.00 . A A . 6 GLY HA2 1 1 11 5208 1 1 6 GLY HA3 H 0.194 3.933 -6.924 1.00 . A A . 6 GLY HA3 1 1 11 5209 1 1 6 GLY N N 1.318 3.596 -5.164 1.00 . A A . 6 GLY N 1 1 11 5210 1 1 6 GLY O O -1.145 4.262 -3.999 1.00 . A A . 6 GLY O 1 1 11 5211 1 1 7 PHE C C -3.816 2.441 -5.018 1.00 . A A . 7 PHE C 1 1 11 5212 1 1 7 PHE CA C -3.496 3.914 -5.304 1.00 . A A . 7 PHE CA 1 1 11 5213 1 1 7 PHE CB C -4.497 4.496 -6.308 1.00 . A A . 7 PHE CB 1 1 11 5214 1 1 7 PHE CD1 C -4.927 6.883 -5.612 1.00 . A A . 7 PHE CD1 1 1 11 5215 1 1 7 PHE CD2 C -6.548 5.183 -5.005 1.00 . A A . 7 PHE CD2 1 1 11 5216 1 1 7 PHE CE1 C -5.710 7.856 -4.979 1.00 . A A . 7 PHE CE1 1 1 11 5217 1 1 7 PHE CE2 C -7.330 6.157 -4.373 1.00 . A A . 7 PHE CE2 1 1 11 5218 1 1 7 PHE CG C -5.344 5.547 -5.625 1.00 . A A . 7 PHE CG 1 1 11 5219 1 1 7 PHE CZ C -6.911 7.493 -4.359 1.00 . A A . 7 PHE CZ 1 1 11 5220 1 1 7 PHE H H -2.070 4.011 -6.927 1.00 . A A . 7 PHE H 1 1 11 5221 1 1 7 PHE HA H -3.526 4.481 -4.390 1.00 . A A . 7 PHE HA 1 1 11 5222 1 1 7 PHE HB2 H -3.961 4.946 -7.132 1.00 . A A . 7 PHE HB2 1 1 11 5223 1 1 7 PHE HB3 H -5.135 3.708 -6.681 1.00 . A A . 7 PHE HB3 1 1 11 5224 1 1 7 PHE HD1 H -3.999 7.165 -6.089 1.00 . A A . 7 PHE HD1 1 1 11 5225 1 1 7 PHE HD2 H -6.872 4.154 -5.015 1.00 . A A . 7 PHE HD2 1 1 11 5226 1 1 7 PHE HE1 H -5.388 8.887 -4.969 1.00 . A A . 7 PHE HE1 1 1 11 5227 1 1 7 PHE HE2 H -8.257 5.878 -3.895 1.00 . A A . 7 PHE HE2 1 1 11 5228 1 1 7 PHE HZ H -7.516 8.244 -3.872 1.00 . A A . 7 PHE HZ 1 1 11 5229 1 1 7 PHE N N -2.149 4.050 -5.950 1.00 . A A . 7 PHE N 1 1 11 5230 1 1 7 PHE O O -4.472 2.121 -4.047 1.00 . A A . 7 PHE O 1 1 11 5231 1 1 8 TRP C C -2.455 -0.743 -6.143 1.00 . A A . 8 TRP C 1 1 11 5232 1 1 8 TRP CA C -3.641 0.095 -5.642 1.00 . A A . 8 TRP CA 1 1 11 5233 1 1 8 TRP CB C -4.904 -0.191 -6.464 1.00 . A A . 8 TRP CB 1 1 11 5234 1 1 8 TRP CD1 C -5.357 -2.560 -5.695 1.00 . A A . 8 TRP CD1 1 1 11 5235 1 1 8 TRP CD2 C -7.013 -1.138 -5.146 1.00 . A A . 8 TRP CD2 1 1 11 5236 1 1 8 TRP CE2 C -7.393 -2.412 -4.660 1.00 . A A . 8 TRP CE2 1 1 11 5237 1 1 8 TRP CE3 C -7.888 -0.059 -4.930 1.00 . A A . 8 TRP CE3 1 1 11 5238 1 1 8 TRP CG C -5.714 -1.258 -5.797 1.00 . A A . 8 TRP CG 1 1 11 5239 1 1 8 TRP CH2 C -9.456 -1.523 -3.779 1.00 . A A . 8 TRP CH2 1 1 11 5240 1 1 8 TRP CZ2 C -8.598 -2.607 -3.986 1.00 . A A . 8 TRP CZ2 1 1 11 5241 1 1 8 TRP CZ3 C -9.102 -0.251 -4.250 1.00 . A A . 8 TRP CZ3 1 1 11 5242 1 1 8 TRP H H -2.838 1.832 -6.636 1.00 . A A . 8 TRP H 1 1 11 5243 1 1 8 TRP HA H -3.825 -0.100 -4.597 1.00 . A A . 8 TRP HA 1 1 11 5244 1 1 8 TRP HB2 H -5.495 0.711 -6.537 1.00 . A A . 8 TRP HB2 1 1 11 5245 1 1 8 TRP HB3 H -4.625 -0.517 -7.454 1.00 . A A . 8 TRP HB3 1 1 11 5246 1 1 8 TRP HD1 H -4.445 -2.993 -6.077 1.00 . A A . 8 TRP HD1 1 1 11 5247 1 1 8 TRP HE1 H -6.337 -4.203 -4.812 1.00 . A A . 8 TRP HE1 1 1 11 5248 1 1 8 TRP HE3 H -7.625 0.925 -5.289 1.00 . A A . 8 TRP HE3 1 1 11 5249 1 1 8 TRP HH2 H -10.390 -1.666 -3.256 1.00 . A A . 8 TRP HH2 1 1 11 5250 1 1 8 TRP HZ2 H -8.865 -3.589 -3.624 1.00 . A A . 8 TRP HZ2 1 1 11 5251 1 1 8 TRP HZ3 H -9.767 0.584 -4.089 1.00 . A A . 8 TRP HZ3 1 1 11 5252 1 1 8 TRP N N -3.362 1.547 -5.859 1.00 . A A . 8 TRP N 1 1 11 5253 1 1 8 TRP NE1 N -6.352 -3.245 -5.019 1.00 . A A . 8 TRP NE1 1 1 11 5254 1 1 8 TRP O O -2.555 -1.459 -7.123 1.00 . A A . 8 TRP O 1 1 11 5255 1 1 9 TRP C C -0.056 -2.748 -5.127 1.00 . A A . 9 TRP C 1 1 11 5256 1 1 9 TRP CA C -0.129 -1.434 -5.908 1.00 . A A . 9 TRP CA 1 1 11 5257 1 1 9 TRP CB C 1.072 -0.536 -5.587 1.00 . A A . 9 TRP CB 1 1 11 5258 1 1 9 TRP CD1 C 0.136 1.095 -7.288 1.00 . A A . 9 TRP CD1 1 1 11 5259 1 1 9 TRP CD2 C 2.366 1.273 -7.060 1.00 . A A . 9 TRP CD2 1 1 11 5260 1 1 9 TRP CE2 C 1.976 2.232 -8.023 1.00 . A A . 9 TRP CE2 1 1 11 5261 1 1 9 TRP CE3 C 3.733 1.183 -6.733 1.00 . A A . 9 TRP CE3 1 1 11 5262 1 1 9 TRP CG C 1.177 0.563 -6.603 1.00 . A A . 9 TRP CG 1 1 11 5263 1 1 9 TRP CH2 C 4.253 2.971 -8.305 1.00 . A A . 9 TRP CH2 1 1 11 5264 1 1 9 TRP CZ2 C 2.901 3.071 -8.640 1.00 . A A . 9 TRP CZ2 1 1 11 5265 1 1 9 TRP CZ3 C 4.669 2.027 -7.355 1.00 . A A . 9 TRP CZ3 1 1 11 5266 1 1 9 TRP H H -1.277 -0.064 -4.691 1.00 . A A . 9 TRP H 1 1 11 5267 1 1 9 TRP HA H -0.170 -1.629 -6.969 1.00 . A A . 9 TRP HA 1 1 11 5268 1 1 9 TRP HB2 H 0.945 -0.102 -4.605 1.00 . A A . 9 TRP HB2 1 1 11 5269 1 1 9 TRP HB3 H 1.976 -1.127 -5.602 1.00 . A A . 9 TRP HB3 1 1 11 5270 1 1 9 TRP HD1 H -0.896 0.796 -7.194 1.00 . A A . 9 TRP HD1 1 1 11 5271 1 1 9 TRP HE1 H 0.060 2.624 -8.733 1.00 . A A . 9 TRP HE1 1 1 11 5272 1 1 9 TRP HE3 H 4.063 0.459 -6.003 1.00 . A A . 9 TRP HE3 1 1 11 5273 1 1 9 TRP HH2 H 4.975 3.616 -8.780 1.00 . A A . 9 TRP HH2 1 1 11 5274 1 1 9 TRP HZ2 H 2.573 3.797 -9.366 1.00 . A A . 9 TRP HZ2 1 1 11 5275 1 1 9 TRP HZ3 H 5.714 1.952 -7.098 1.00 . A A . 9 TRP HZ3 1 1 11 5276 1 1 9 TRP N N -1.331 -0.651 -5.475 1.00 . A A . 9 TRP N 1 1 11 5277 1 1 9 TRP NE1 N 0.610 2.082 -8.129 1.00 . A A . 9 TRP NE1 1 1 11 5278 1 1 9 TRP O O -0.683 -2.896 -4.101 1.00 . A A . 9 TRP O 1 1 11 5279 1 1 10 LYS C C 1.916 -4.999 -3.857 1.00 . A A . 10 LYS C 1 1 11 5280 1 1 10 LYS CA C 0.780 -5.014 -4.879 1.00 . A A . 10 LYS CA 1 1 11 5281 1 1 10 LYS CB C 1.068 -6.065 -5.952 1.00 . A A . 10 LYS CB 1 1 11 5282 1 1 10 LYS CD C -0.383 -6.560 -7.929 1.00 . A A . 10 LYS CD 1 1 11 5283 1 1 10 LYS CE C -1.863 -6.412 -8.303 1.00 . A A . 10 LYS CE 1 1 11 5284 1 1 10 LYS CG C -0.244 -6.706 -6.410 1.00 . A A . 10 LYS CG 1 1 11 5285 1 1 10 LYS H H 1.186 -3.576 -6.441 1.00 . A A . 10 LYS H 1 1 11 5286 1 1 10 LYS HA H -0.156 -5.234 -4.393 1.00 . A A . 10 LYS HA 1 1 11 5287 1 1 10 LYS HB2 H 1.559 -5.596 -6.791 1.00 . A A . 10 LYS HB2 1 1 11 5288 1 1 10 LYS HB3 H 1.713 -6.827 -5.539 1.00 . A A . 10 LYS HB3 1 1 11 5289 1 1 10 LYS HD2 H 0.160 -5.687 -8.258 1.00 . A A . 10 LYS HD2 1 1 11 5290 1 1 10 LYS HD3 H 0.021 -7.437 -8.412 1.00 . A A . 10 LYS HD3 1 1 11 5291 1 1 10 LYS HE2 H -1.999 -6.582 -9.362 1.00 . A A . 10 LYS HE2 1 1 11 5292 1 1 10 LYS HE3 H -2.465 -7.102 -7.730 1.00 . A A . 10 LYS HE3 1 1 11 5293 1 1 10 LYS HG2 H -0.241 -7.753 -6.146 1.00 . A A . 10 LYS HG2 1 1 11 5294 1 1 10 LYS HG3 H -1.073 -6.214 -5.925 1.00 . A A . 10 LYS HG3 1 1 11 5295 1 1 10 LYS HZ1 H -1.474 -4.363 -8.283 1.00 . A A . 10 LYS HZ1 1 1 11 5296 1 1 10 LYS HZ2 H -2.317 -4.922 -6.917 1.00 . A A . 10 LYS HZ2 1 1 11 5297 1 1 10 LYS HZ3 H -3.120 -4.754 -8.405 1.00 . A A . 10 LYS HZ3 1 1 11 5298 1 1 10 LYS N N 0.693 -3.708 -5.606 1.00 . A A . 10 LYS N 1 1 11 5299 1 1 10 LYS NZ N -2.221 -5.007 -7.950 1.00 . A A . 10 LYS NZ 1 1 11 5300 1 1 10 LYS O O 3.011 -4.544 -4.135 1.00 . A A . 10 LYS O 1 1 11 5301 1 1 11 CYS C C 2.498 -6.743 -0.695 1.00 . A A . 11 CYS C 1 1 11 5302 1 1 11 CYS CA C 2.726 -5.551 -1.635 1.00 . A A . 11 CYS CA 1 1 11 5303 1 1 11 CYS CB C 2.604 -4.222 -0.882 1.00 . A A . 11 CYS CB 1 1 11 5304 1 1 11 CYS H H 0.777 -5.880 -2.490 1.00 . A A . 11 CYS H 1 1 11 5305 1 1 11 CYS HA H 3.694 -5.623 -2.103 1.00 . A A . 11 CYS HA 1 1 11 5306 1 1 11 CYS HB2 H 3.413 -4.137 -0.172 1.00 . A A . 11 CYS HB2 1 1 11 5307 1 1 11 CYS HB3 H 2.657 -3.405 -1.586 1.00 . A A . 11 CYS HB3 1 1 11 5308 1 1 11 CYS N N 1.663 -5.510 -2.681 1.00 . A A . 11 CYS N 1 1 11 5309 1 1 11 CYS O O 1.391 -7.235 -0.559 1.00 . A A . 11 CYS O 1 1 11 5310 1 1 11 CYS SG S 1.025 -4.158 -0.002 1.00 . A A . 11 CYS SG 1 1 11 5311 1 1 12 GLY C C 2.930 -7.853 2.262 1.00 . A A . 12 GLY C 1 1 11 5312 1 1 12 GLY CA C 3.381 -8.365 0.891 1.00 . A A . 12 GLY CA 1 1 11 5313 1 1 12 GLY H H 4.416 -6.795 -0.167 1.00 . A A . 12 GLY H 1 1 11 5314 1 1 12 GLY HA2 H 2.644 -9.050 0.499 1.00 . A A . 12 GLY HA2 1 1 11 5315 1 1 12 GLY HA3 H 4.328 -8.871 0.994 1.00 . A A . 12 GLY HA3 1 1 11 5316 1 1 12 GLY N N 3.535 -7.208 -0.042 1.00 . A A . 12 GLY N 1 1 11 5317 1 1 12 GLY O O 1.877 -7.258 2.394 1.00 . A A . 12 GLY O 1 1 11 5318 1 1 13 ARG C C 3.917 -6.171 4.877 1.00 . A A . 13 ARG C 1 1 11 5319 1 1 13 ARG CA C 3.353 -7.586 4.648 1.00 . A A . 13 ARG CA 1 1 11 5320 1 1 13 ARG CB C 3.997 -8.587 5.618 1.00 . A A . 13 ARG CB 1 1 11 5321 1 1 13 ARG CD C 2.212 -8.621 7.379 1.00 . A A . 13 ARG CD 1 1 11 5322 1 1 13 ARG CG C 2.910 -9.437 6.285 1.00 . A A . 13 ARG CG 1 1 11 5323 1 1 13 ARG CZ C 2.225 -9.167 9.742 1.00 . A A . 13 ARG CZ 1 1 11 5324 1 1 13 ARG H H 4.573 -8.546 3.145 1.00 . A A . 13 ARG H 1 1 11 5325 1 1 13 ARG HA H 2.280 -7.588 4.771 1.00 . A A . 13 ARG HA 1 1 11 5326 1 1 13 ARG HB2 H 4.672 -9.232 5.072 1.00 . A A . 13 ARG HB2 1 1 11 5327 1 1 13 ARG HB3 H 4.547 -8.053 6.377 1.00 . A A . 13 ARG HB3 1 1 11 5328 1 1 13 ARG HD2 H 2.315 -7.563 7.180 1.00 . A A . 13 ARG HD2 1 1 11 5329 1 1 13 ARG HD3 H 1.170 -8.892 7.440 1.00 . A A . 13 ARG HD3 1 1 11 5330 1 1 13 ARG HE H 3.885 -9.086 8.654 1.00 . A A . 13 ARG HE 1 1 11 5331 1 1 13 ARG HG2 H 2.186 -9.740 5.542 1.00 . A A . 13 ARG HG2 1 1 11 5332 1 1 13 ARG HG3 H 3.360 -10.314 6.725 1.00 . A A . 13 ARG HG3 1 1 11 5333 1 1 13 ARG HH11 H 1.806 -11.087 9.345 1.00 . A A . 13 ARG HH11 1 1 11 5334 1 1 13 ARG HH12 H 1.166 -10.474 10.833 1.00 . A A . 13 ARG HH12 1 1 11 5335 1 1 13 ARG HH21 H 2.486 -7.290 10.398 1.00 . A A . 13 ARG HH21 1 1 11 5336 1 1 13 ARG HH22 H 1.551 -8.320 11.431 1.00 . A A . 13 ARG HH22 1 1 11 5337 1 1 13 ARG N N 3.724 -8.070 3.281 1.00 . A A . 13 ARG N 1 1 11 5338 1 1 13 ARG NE N 2.911 -8.984 8.644 1.00 . A A . 13 ARG NE 1 1 11 5339 1 1 13 ARG NH1 N 1.691 -10.334 9.994 1.00 . A A . 13 ARG NH1 1 1 11 5340 1 1 13 ARG NH2 N 2.076 -8.183 10.590 1.00 . A A . 13 ARG NH2 1 1 11 5341 1 1 13 ARG O O 4.298 -5.816 5.978 1.00 . A A . 13 ARG O 1 1 11 5342 1 1 14 GLY C C 5.969 -3.942 3.503 1.00 . A A . 14 GLY C 1 1 11 5343 1 1 14 GLY CA C 4.514 -3.980 3.986 1.00 . A A . 14 GLY CA 1 1 11 5344 1 1 14 GLY H H 3.663 -5.670 2.966 1.00 . A A . 14 GLY H 1 1 11 5345 1 1 14 GLY HA2 H 3.918 -3.298 3.394 1.00 . A A . 14 GLY HA2 1 1 11 5346 1 1 14 GLY HA3 H 4.475 -3.682 5.023 1.00 . A A . 14 GLY HA3 1 1 11 5347 1 1 14 GLY N N 3.974 -5.364 3.841 1.00 . A A . 14 GLY N 1 1 11 5348 1 1 14 GLY O O 6.808 -3.290 4.096 1.00 . A A . 14 GLY O 1 1 11 5349 1 1 15 LYS C C 7.982 -3.347 1.141 1.00 . A A . 15 LYS C 1 1 11 5350 1 1 15 LYS CA C 7.679 -4.643 1.911 1.00 . A A . 15 LYS CA 1 1 11 5351 1 1 15 LYS CB C 7.771 -5.865 0.988 1.00 . A A . 15 LYS CB 1 1 11 5352 1 1 15 LYS CD C 8.698 -8.174 0.743 1.00 . A A . 15 LYS CD 1 1 11 5353 1 1 15 LYS CE C 10.136 -8.265 0.219 1.00 . A A . 15 LYS CE 1 1 11 5354 1 1 15 LYS CG C 8.568 -6.973 1.680 1.00 . A A . 15 LYS CG 1 1 11 5355 1 1 15 LYS H H 5.581 -5.157 1.971 1.00 . A A . 15 LYS H 1 1 11 5356 1 1 15 LYS HA H 8.369 -4.755 2.724 1.00 . A A . 15 LYS HA 1 1 11 5357 1 1 15 LYS HB2 H 6.775 -6.225 0.764 1.00 . A A . 15 LYS HB2 1 1 11 5358 1 1 15 LYS HB3 H 8.266 -5.588 0.070 1.00 . A A . 15 LYS HB3 1 1 11 5359 1 1 15 LYS HD2 H 8.453 -9.079 1.281 1.00 . A A . 15 LYS HD2 1 1 11 5360 1 1 15 LYS HD3 H 8.021 -8.058 -0.091 1.00 . A A . 15 LYS HD3 1 1 11 5361 1 1 15 LYS HE2 H 10.437 -7.317 -0.210 1.00 . A A . 15 LYS HE2 1 1 11 5362 1 1 15 LYS HE3 H 10.808 -8.549 1.013 1.00 . A A . 15 LYS HE3 1 1 11 5363 1 1 15 LYS HG2 H 9.552 -6.603 1.932 1.00 . A A . 15 LYS HG2 1 1 11 5364 1 1 15 LYS HG3 H 8.057 -7.275 2.581 1.00 . A A . 15 LYS HG3 1 1 11 5365 1 1 15 LYS HZ1 H 9.461 -9.040 -1.594 1.00 . A A . 15 LYS HZ1 1 1 11 5366 1 1 15 LYS HZ2 H 9.770 -10.218 -0.409 1.00 . A A . 15 LYS HZ2 1 1 11 5367 1 1 15 LYS HZ3 H 11.060 -9.460 -1.213 1.00 . A A . 15 LYS HZ3 1 1 11 5368 1 1 15 LYS N N 6.275 -4.637 2.431 1.00 . A A . 15 LYS N 1 1 11 5369 1 1 15 LYS NZ N 10.105 -9.325 -0.828 1.00 . A A . 15 LYS NZ 1 1 11 5370 1 1 15 LYS O O 8.892 -2.623 1.499 1.00 . A A . 15 LYS O 1 1 11 5371 1 1 16 PRO C C 6.901 -0.630 0.047 1.00 . A A . 16 PRO C 1 1 11 5372 1 1 16 PRO CA C 7.411 -1.867 -0.709 1.00 . A A . 16 PRO CA 1 1 11 5373 1 1 16 PRO CB C 6.575 -2.128 -1.959 1.00 . A A . 16 PRO CB 1 1 11 5374 1 1 16 PRO CD C 6.097 -3.907 -0.389 1.00 . A A . 16 PRO CD 1 1 11 5375 1 1 16 PRO CG C 5.527 -3.106 -1.533 1.00 . A A . 16 PRO CG 1 1 11 5376 1 1 16 PRO HA H 8.449 -1.754 -0.975 1.00 . A A . 16 PRO HA 1 1 11 5377 1 1 16 PRO HB2 H 6.118 -1.209 -2.302 1.00 . A A . 16 PRO HB2 1 1 11 5378 1 1 16 PRO HB3 H 7.186 -2.558 -2.737 1.00 . A A . 16 PRO HB3 1 1 11 5379 1 1 16 PRO HD2 H 5.353 -4.042 0.384 1.00 . A A . 16 PRO HD2 1 1 11 5380 1 1 16 PRO HD3 H 6.463 -4.860 -0.736 1.00 . A A . 16 PRO HD3 1 1 11 5381 1 1 16 PRO HG2 H 4.642 -2.576 -1.210 1.00 . A A . 16 PRO HG2 1 1 11 5382 1 1 16 PRO HG3 H 5.284 -3.766 -2.350 1.00 . A A . 16 PRO HG3 1 1 11 5383 1 1 16 PRO N N 7.211 -3.091 0.108 1.00 . A A . 16 PRO N 1 1 11 5384 1 1 16 PRO O O 5.844 -0.670 0.650 1.00 . A A . 16 PRO O 1 1 11 5385 1 1 17 PRO C C 6.139 2.386 -0.049 1.00 . A A . 17 PRO C 1 1 11 5386 1 1 17 PRO CA C 7.291 1.688 0.687 1.00 . A A . 17 PRO CA 1 1 11 5387 1 1 17 PRO CB C 8.566 2.527 0.630 1.00 . A A . 17 PRO CB 1 1 11 5388 1 1 17 PRO CD C 8.959 0.557 -0.712 1.00 . A A . 17 PRO CD 1 1 11 5389 1 1 17 PRO CG C 9.324 2.011 -0.552 1.00 . A A . 17 PRO CG 1 1 11 5390 1 1 17 PRO HA H 7.026 1.490 1.713 1.00 . A A . 17 PRO HA 1 1 11 5391 1 1 17 PRO HB2 H 8.321 3.572 0.496 1.00 . A A . 17 PRO HB2 1 1 11 5392 1 1 17 PRO HB3 H 9.148 2.390 1.529 1.00 . A A . 17 PRO HB3 1 1 11 5393 1 1 17 PRO HD2 H 8.848 0.309 -1.759 1.00 . A A . 17 PRO HD2 1 1 11 5394 1 1 17 PRO HD3 H 9.702 -0.074 -0.248 1.00 . A A . 17 PRO HD3 1 1 11 5395 1 1 17 PRO HG2 H 9.042 2.563 -1.438 1.00 . A A . 17 PRO HG2 1 1 11 5396 1 1 17 PRO HG3 H 10.384 2.103 -0.380 1.00 . A A . 17 PRO HG3 1 1 11 5397 1 1 17 PRO N N 7.673 0.429 -0.008 1.00 . A A . 17 PRO N 1 1 11 5398 1 1 17 PRO O O 6.281 2.815 -1.179 1.00 . A A . 17 PRO O 1 1 11 5399 1 1 18 CYS C C 3.915 4.695 0.132 1.00 . A A . 18 CYS C 1 1 11 5400 1 1 18 CYS CA C 3.831 3.173 -0.068 1.00 . A A . 18 CYS CA 1 1 11 5401 1 1 18 CYS CB C 2.588 2.606 0.624 1.00 . A A . 18 CYS CB 1 1 11 5402 1 1 18 CYS H H 4.908 2.146 1.497 1.00 . A A . 18 CYS H 1 1 11 5403 1 1 18 CYS HA H 3.806 2.934 -1.118 1.00 . A A . 18 CYS HA 1 1 11 5404 1 1 18 CYS HB2 H 2.673 2.737 1.690 1.00 . A A . 18 CYS HB2 1 1 11 5405 1 1 18 CYS HB3 H 1.709 3.125 0.268 1.00 . A A . 18 CYS HB3 1 1 11 5406 1 1 18 CYS N N 4.998 2.501 0.587 1.00 . A A . 18 CYS N 1 1 11 5407 1 1 18 CYS O O 4.844 5.198 0.737 1.00 . A A . 18 CYS O 1 1 11 5408 1 1 18 CYS SG S 2.432 0.845 0.247 1.00 . A A . 18 CYS SG 1 1 11 5409 1 1 19 CYS C C 2.294 7.328 1.092 1.00 . A A . 19 CYS C 1 1 11 5410 1 1 19 CYS CA C 2.985 6.920 -0.216 1.00 . A A . 19 CYS CA 1 1 11 5411 1 1 19 CYS CB C 2.222 7.496 -1.422 1.00 . A A . 19 CYS CB 1 1 11 5412 1 1 19 CYS H H 2.216 5.002 -0.860 1.00 . A A . 19 CYS H 1 1 11 5413 1 1 19 CYS HA H 4.002 7.275 -0.224 1.00 . A A . 19 CYS HA 1 1 11 5414 1 1 19 CYS HB2 H 1.172 7.548 -1.186 1.00 . A A . 19 CYS HB2 1 1 11 5415 1 1 19 CYS HB3 H 2.589 8.490 -1.632 1.00 . A A . 19 CYS HB3 1 1 11 5416 1 1 19 CYS N N 2.954 5.429 -0.376 1.00 . A A . 19 CYS N 1 1 11 5417 1 1 19 CYS O O 1.598 6.541 1.709 1.00 . A A . 19 CYS O 1 1 11 5418 1 1 19 CYS SG S 2.455 6.449 -2.886 1.00 . A A . 19 CYS SG 1 1 11 5419 1 1 20 LYS C C 0.320 8.878 2.697 1.00 . A A . 20 LYS C 1 1 11 5420 1 1 20 LYS CA C 1.845 9.024 2.786 1.00 . A A . 20 LYS CA 1 1 11 5421 1 1 20 LYS CB C 2.238 10.499 2.920 1.00 . A A . 20 LYS CB 1 1 11 5422 1 1 20 LYS CD C 3.075 11.888 4.832 1.00 . A A . 20 LYS CD 1 1 11 5423 1 1 20 LYS CE C 2.526 13.285 5.144 1.00 . A A . 20 LYS CE 1 1 11 5424 1 1 20 LYS CG C 1.940 10.983 4.343 1.00 . A A . 20 LYS CG 1 1 11 5425 1 1 20 LYS H H 3.047 9.166 1.009 1.00 . A A . 20 LYS H 1 1 11 5426 1 1 20 LYS HA H 2.229 8.466 3.618 1.00 . A A . 20 LYS HA 1 1 11 5427 1 1 20 LYS HB2 H 3.293 10.611 2.716 1.00 . A A . 20 LYS HB2 1 1 11 5428 1 1 20 LYS HB3 H 1.672 11.091 2.214 1.00 . A A . 20 LYS HB3 1 1 11 5429 1 1 20 LYS HD2 H 3.513 11.463 5.724 1.00 . A A . 20 LYS HD2 1 1 11 5430 1 1 20 LYS HD3 H 3.830 11.964 4.064 1.00 . A A . 20 LYS HD3 1 1 11 5431 1 1 20 LYS HE2 H 3.326 14.012 5.127 1.00 . A A . 20 LYS HE2 1 1 11 5432 1 1 20 LYS HE3 H 1.758 13.554 4.436 1.00 . A A . 20 LYS HE3 1 1 11 5433 1 1 20 LYS HG2 H 1.011 11.535 4.347 1.00 . A A . 20 LYS HG2 1 1 11 5434 1 1 20 LYS HG3 H 1.853 10.131 5.001 1.00 . A A . 20 LYS HG3 1 1 11 5435 1 1 20 LYS HZ1 H 1.152 12.510 6.506 1.00 . A A . 20 LYS HZ1 1 1 11 5436 1 1 20 LYS HZ2 H 1.605 14.118 6.815 1.00 . A A . 20 LYS HZ2 1 1 11 5437 1 1 20 LYS HZ3 H 2.673 12.848 7.177 1.00 . A A . 20 LYS HZ3 1 1 11 5438 1 1 20 LYS N N 2.483 8.556 1.520 1.00 . A A . 20 LYS N 1 1 11 5439 1 1 20 LYS NZ N 1.945 13.181 6.514 1.00 . A A . 20 LYS NZ 1 1 11 5440 1 1 20 LYS O O -0.308 9.382 1.784 1.00 . A A . 20 LYS O 1 1 11 5441 1 1 21 GLY C C -2.080 6.592 3.060 1.00 . A A . 21 GLY C 1 1 11 5442 1 1 21 GLY CA C -1.752 7.986 3.610 1.00 . A A . 21 GLY CA 1 1 11 5443 1 1 21 GLY H H 0.260 7.778 4.352 1.00 . A A . 21 GLY H 1 1 11 5444 1 1 21 GLY HA2 H -2.142 8.080 4.614 1.00 . A A . 21 GLY HA2 1 1 11 5445 1 1 21 GLY HA3 H -2.205 8.733 2.978 1.00 . A A . 21 GLY HA3 1 1 11 5446 1 1 21 GLY N N -0.272 8.182 3.635 1.00 . A A . 21 GLY N 1 1 11 5447 1 1 21 GLY O O -3.117 6.031 3.361 1.00 . A A . 21 GLY O 1 1 11 5448 1 1 22 TYR C C -0.849 3.602 2.590 1.00 . A A . 22 TYR C 1 1 11 5449 1 1 22 TYR CA C -1.461 4.677 1.686 1.00 . A A . 22 TYR CA 1 1 11 5450 1 1 22 TYR CB C -0.771 4.672 0.317 1.00 . A A . 22 TYR CB 1 1 11 5451 1 1 22 TYR CD1 C -1.112 7.029 -0.522 1.00 . A A . 22 TYR CD1 1 1 11 5452 1 1 22 TYR CD2 C -2.380 5.235 -1.546 1.00 . A A . 22 TYR CD2 1 1 11 5453 1 1 22 TYR CE1 C -1.723 7.951 -1.378 1.00 . A A . 22 TYR CE1 1 1 11 5454 1 1 22 TYR CE2 C -2.993 6.158 -2.403 1.00 . A A . 22 TYR CE2 1 1 11 5455 1 1 22 TYR CG C -1.438 5.669 -0.606 1.00 . A A . 22 TYR CG 1 1 11 5456 1 1 22 TYR CZ C -2.665 7.517 -2.319 1.00 . A A . 22 TYR CZ 1 1 11 5457 1 1 22 TYR H H -0.381 6.505 2.031 1.00 . A A . 22 TYR H 1 1 11 5458 1 1 22 TYR HA H -2.521 4.511 1.568 1.00 . A A . 22 TYR HA 1 1 11 5459 1 1 22 TYR HB2 H 0.269 4.935 0.438 1.00 . A A . 22 TYR HB2 1 1 11 5460 1 1 22 TYR HB3 H -0.842 3.685 -0.115 1.00 . A A . 22 TYR HB3 1 1 11 5461 1 1 22 TYR HD1 H -0.386 7.365 0.204 1.00 . A A . 22 TYR HD1 1 1 11 5462 1 1 22 TYR HD2 H -2.633 4.188 -1.612 1.00 . A A . 22 TYR HD2 1 1 11 5463 1 1 22 TYR HE1 H -1.471 8.999 -1.312 1.00 . A A . 22 TYR HE1 1 1 11 5464 1 1 22 TYR HE2 H -3.718 5.823 -3.128 1.00 . A A . 22 TYR HE2 1 1 11 5465 1 1 22 TYR HH H -3.146 9.306 -2.805 1.00 . A A . 22 TYR HH 1 1 11 5466 1 1 22 TYR N N -1.206 6.034 2.258 1.00 . A A . 22 TYR N 1 1 11 5467 1 1 22 TYR O O 0.287 3.706 3.012 1.00 . A A . 22 TYR O 1 1 11 5468 1 1 22 TYR OH O -3.270 8.424 -3.167 1.00 . A A . 22 TYR OH 1 1 11 5469 1 1 23 ALA C C -1.099 0.142 2.989 1.00 . A A . 23 ALA C 1 1 11 5470 1 1 23 ALA CA C -1.068 1.472 3.749 1.00 . A A . 23 ALA CA 1 1 11 5471 1 1 23 ALA CB C -2.013 1.430 4.952 1.00 . A A . 23 ALA CB 1 1 11 5472 1 1 23 ALA H H -2.502 2.506 2.519 1.00 . A A . 23 ALA H 1 1 11 5473 1 1 23 ALA HA H -0.064 1.698 4.073 1.00 . A A . 23 ALA HA 1 1 11 5474 1 1 23 ALA HB1 H -2.442 0.443 5.039 1.00 . A A . 23 ALA HB1 1 1 11 5475 1 1 23 ALA HB2 H -2.801 2.155 4.818 1.00 . A A . 23 ALA HB2 1 1 11 5476 1 1 23 ALA HB3 H -1.459 1.662 5.851 1.00 . A A . 23 ALA HB3 1 1 11 5477 1 1 23 ALA N N -1.594 2.567 2.879 1.00 . A A . 23 ALA N 1 1 11 5478 1 1 23 ALA O O -1.988 -0.106 2.196 1.00 . A A . 23 ALA O 1 1 11 5479 1 1 24 CYS C C -0.898 -3.068 3.307 1.00 . A A . 24 CYS C 1 1 11 5480 1 1 24 CYS CA C -0.105 -2.027 2.517 1.00 . A A . 24 CYS CA 1 1 11 5481 1 1 24 CYS CB C 1.378 -2.408 2.445 1.00 . A A . 24 CYS CB 1 1 11 5482 1 1 24 CYS H H 0.570 -0.486 3.872 1.00 . A A . 24 CYS H 1 1 11 5483 1 1 24 CYS HA H -0.507 -1.924 1.522 1.00 . A A . 24 CYS HA 1 1 11 5484 1 1 24 CYS HB2 H 1.874 -1.780 1.721 1.00 . A A . 24 CYS HB2 1 1 11 5485 1 1 24 CYS HB3 H 1.831 -2.268 3.414 1.00 . A A . 24 CYS HB3 1 1 11 5486 1 1 24 CYS N N -0.135 -0.711 3.227 1.00 . A A . 24 CYS N 1 1 11 5487 1 1 24 CYS O O -1.151 -2.907 4.487 1.00 . A A . 24 CYS O 1 1 11 5488 1 1 24 CYS SG S 1.549 -4.141 1.948 1.00 . A A . 24 CYS SG 1 1 11 5489 1 1 25 SER C C -1.704 -6.578 2.879 1.00 . A A . 25 SER C 1 1 11 5490 1 1 25 SER CA C -2.089 -5.179 3.364 1.00 . A A . 25 SER CA 1 1 11 5491 1 1 25 SER CB C -3.546 -4.873 3.018 1.00 . A A . 25 SER CB 1 1 11 5492 1 1 25 SER H H -1.087 -4.228 1.708 1.00 . A A . 25 SER H 1 1 11 5493 1 1 25 SER HA H -1.946 -5.102 4.423 1.00 . A A . 25 SER HA 1 1 11 5494 1 1 25 SER HB2 H -3.602 -4.439 2.033 1.00 . A A . 25 SER HB2 1 1 11 5495 1 1 25 SER HB3 H -4.120 -5.789 3.039 1.00 . A A . 25 SER HB3 1 1 11 5496 1 1 25 SER HG H -4.011 -3.070 3.584 1.00 . A A . 25 SER HG 1 1 11 5497 1 1 25 SER N N -1.300 -4.128 2.660 1.00 . A A . 25 SER N 1 1 11 5498 1 1 25 SER O O -1.801 -6.887 1.708 1.00 . A A . 25 SER O 1 1 11 5499 1 1 25 SER OG O -4.067 -3.950 3.965 1.00 . A A . 25 SER OG 1 1 11 5500 1 1 26 LYS C C -2.196 -9.617 3.097 1.00 . A A . 26 LYS C 1 1 11 5501 1 1 26 LYS CA C -0.917 -8.824 3.394 1.00 . A A . 26 LYS CA 1 1 11 5502 1 1 26 LYS CB C -0.183 -9.397 4.610 1.00 . A A . 26 LYS CB 1 1 11 5503 1 1 26 LYS CD C -0.486 -11.733 5.458 1.00 . A A . 26 LYS CD 1 1 11 5504 1 1 26 LYS CE C -1.841 -12.254 4.963 1.00 . A A . 26 LYS CE 1 1 11 5505 1 1 26 LYS CG C 0.161 -10.871 4.369 1.00 . A A . 26 LYS CG 1 1 11 5506 1 1 26 LYS H H -1.230 -7.155 4.724 1.00 . A A . 26 LYS H 1 1 11 5507 1 1 26 LYS HA H -0.269 -8.817 2.535 1.00 . A A . 26 LYS HA 1 1 11 5508 1 1 26 LYS HB2 H 0.728 -8.839 4.771 1.00 . A A . 26 LYS HB2 1 1 11 5509 1 1 26 LYS HB3 H -0.813 -9.314 5.484 1.00 . A A . 26 LYS HB3 1 1 11 5510 1 1 26 LYS HD2 H 0.161 -12.566 5.689 1.00 . A A . 26 LYS HD2 1 1 11 5511 1 1 26 LYS HD3 H -0.637 -11.136 6.346 1.00 . A A . 26 LYS HD3 1 1 11 5512 1 1 26 LYS HE2 H -2.636 -11.597 5.286 1.00 . A A . 26 LYS HE2 1 1 11 5513 1 1 26 LYS HE3 H -1.839 -12.343 3.888 1.00 . A A . 26 LYS HE3 1 1 11 5514 1 1 26 LYS HG2 H -0.208 -11.176 3.400 1.00 . A A . 26 LYS HG2 1 1 11 5515 1 1 26 LYS HG3 H 1.232 -11.002 4.402 1.00 . A A . 26 LYS HG3 1 1 11 5516 1 1 26 LYS HZ1 H -1.226 -14.223 5.263 1.00 . A A . 26 LYS HZ1 1 1 11 5517 1 1 26 LYS HZ2 H -2.910 -14.006 5.308 1.00 . A A . 26 LYS HZ2 1 1 11 5518 1 1 26 LYS HZ3 H -1.954 -13.512 6.621 1.00 . A A . 26 LYS HZ3 1 1 11 5519 1 1 26 LYS N N -1.287 -7.429 3.784 1.00 . A A . 26 LYS N 1 1 11 5520 1 1 26 LYS NZ N -1.994 -13.601 5.586 1.00 . A A . 26 LYS NZ 1 1 11 5521 1 1 26 LYS O O -2.264 -10.369 2.142 1.00 . A A . 26 LYS O 1 1 11 5522 1 1 27 THR C C -5.096 -9.737 2.324 1.00 . A A . 27 THR C 1 1 11 5523 1 1 27 THR CA C -4.510 -10.151 3.677 1.00 . A A . 27 THR CA 1 1 11 5524 1 1 27 THR CB C -5.429 -9.705 4.824 1.00 . A A . 27 THR CB 1 1 11 5525 1 1 27 THR CG2 C -6.779 -10.419 4.711 1.00 . A A . 27 THR CG2 1 1 11 5526 1 1 27 THR H H -3.129 -8.810 4.655 1.00 . A A . 27 THR H 1 1 11 5527 1 1 27 THR HA H -4.363 -11.216 3.714 1.00 . A A . 27 THR HA 1 1 11 5528 1 1 27 THR HB H -5.587 -8.637 4.768 1.00 . A A . 27 THR HB 1 1 11 5529 1 1 27 THR HG1 H -4.485 -9.224 6.455 1.00 . A A . 27 THR HG1 1 1 11 5530 1 1 27 THR HG21 H -7.352 -10.252 5.612 1.00 . A A . 27 THR HG21 1 1 11 5531 1 1 27 THR HG22 H -6.617 -11.477 4.578 1.00 . A A . 27 THR HG22 1 1 11 5532 1 1 27 THR HG23 H -7.322 -10.029 3.862 1.00 . A A . 27 THR HG23 1 1 11 5533 1 1 27 THR N N -3.214 -9.434 3.904 1.00 . A A . 27 THR N 1 1 11 5534 1 1 27 THR O O -5.615 -10.553 1.587 1.00 . A A . 27 THR O 1 1 11 5535 1 1 27 THR OG1 O -4.826 -10.033 6.068 1.00 . A A . 27 THR OG1 1 1 11 5536 1 1 28 TRP C C -4.524 -8.308 -0.423 1.00 . A A . 28 TRP C 1 1 11 5537 1 1 28 TRP CA C -5.534 -7.990 0.683 1.00 . A A . 28 TRP CA 1 1 11 5538 1 1 28 TRP CB C -5.686 -6.468 0.828 1.00 . A A . 28 TRP CB 1 1 11 5539 1 1 28 TRP CD1 C -7.252 -7.000 2.766 1.00 . A A . 28 TRP CD1 1 1 11 5540 1 1 28 TRP CD2 C -6.890 -4.795 2.507 1.00 . A A . 28 TRP CD2 1 1 11 5541 1 1 28 TRP CE2 C -7.762 -4.936 3.610 1.00 . A A . 28 TRP CE2 1 1 11 5542 1 1 28 TRP CE3 C -6.504 -3.497 2.127 1.00 . A A . 28 TRP CE3 1 1 11 5543 1 1 28 TRP CG C -6.576 -6.119 1.988 1.00 . A A . 28 TRP CG 1 1 11 5544 1 1 28 TRP CH2 C -7.841 -2.547 3.927 1.00 . A A . 28 TRP CH2 1 1 11 5545 1 1 28 TRP CZ2 C -8.234 -3.830 4.316 1.00 . A A . 28 TRP CZ2 1 1 11 5546 1 1 28 TRP CZ3 C -6.978 -2.380 2.835 1.00 . A A . 28 TRP CZ3 1 1 11 5547 1 1 28 TRP H H -4.567 -7.844 2.607 1.00 . A A . 28 TRP H 1 1 11 5548 1 1 28 TRP HA H -6.489 -8.442 0.470 1.00 . A A . 28 TRP HA 1 1 11 5549 1 1 28 TRP HB2 H -4.715 -6.027 0.984 1.00 . A A . 28 TRP HB2 1 1 11 5550 1 1 28 TRP HB3 H -6.113 -6.068 -0.078 1.00 . A A . 28 TRP HB3 1 1 11 5551 1 1 28 TRP HD1 H -7.242 -8.074 2.654 1.00 . A A . 28 TRP HD1 1 1 11 5552 1 1 28 TRP HE1 H -8.516 -6.700 4.423 1.00 . A A . 28 TRP HE1 1 1 11 5553 1 1 28 TRP HE3 H -5.840 -3.357 1.288 1.00 . A A . 28 TRP HE3 1 1 11 5554 1 1 28 TRP HH2 H -8.201 -1.686 4.467 1.00 . A A . 28 TRP HH2 1 1 11 5555 1 1 28 TRP HZ2 H -8.899 -3.964 5.155 1.00 . A A . 28 TRP HZ2 1 1 11 5556 1 1 28 TRP HZ3 H -6.675 -1.388 2.536 1.00 . A A . 28 TRP HZ3 1 1 11 5557 1 1 28 TRP N N -5.000 -8.475 1.994 1.00 . A A . 28 TRP N 1 1 11 5558 1 1 28 TRP NE1 N -7.950 -6.298 3.731 1.00 . A A . 28 TRP NE1 1 1 11 5559 1 1 28 TRP O O -4.888 -8.671 -1.527 1.00 . A A . 28 TRP O 1 1 11 5560 1 1 29 GLY C C -1.839 -7.176 -1.906 1.00 . A A . 29 GLY C 1 1 11 5561 1 1 29 GLY CA C -2.197 -8.454 -1.136 1.00 . A A . 29 GLY CA 1 1 11 5562 1 1 29 GLY H H -2.997 -7.874 0.772 1.00 . A A . 29 GLY H 1 1 11 5563 1 1 29 GLY HA2 H -1.318 -8.827 -0.633 1.00 . A A . 29 GLY HA2 1 1 11 5564 1 1 29 GLY HA3 H -2.556 -9.198 -1.831 1.00 . A A . 29 GLY HA3 1 1 11 5565 1 1 29 GLY N N -3.255 -8.169 -0.126 1.00 . A A . 29 GLY N 1 1 11 5566 1 1 29 GLY O O -1.201 -7.238 -2.940 1.00 . A A . 29 GLY O 1 1 11 5567 1 1 30 TRP C C -1.792 -3.568 -1.182 1.00 . A A . 30 TRP C 1 1 11 5568 1 1 30 TRP CA C -1.892 -4.755 -2.151 1.00 . A A . 30 TRP CA 1 1 11 5569 1 1 30 TRP CB C -3.021 -4.553 -3.181 1.00 . A A . 30 TRP CB 1 1 11 5570 1 1 30 TRP CD1 C -4.412 -2.750 -2.066 1.00 . A A . 30 TRP CD1 1 1 11 5571 1 1 30 TRP CD2 C -5.524 -4.692 -2.277 1.00 . A A . 30 TRP CD2 1 1 11 5572 1 1 30 TRP CE2 C -6.405 -3.785 -1.643 1.00 . A A . 30 TRP CE2 1 1 11 5573 1 1 30 TRP CE3 C -5.987 -5.997 -2.532 1.00 . A A . 30 TRP CE3 1 1 11 5574 1 1 30 TRP CG C -4.259 -4.014 -2.528 1.00 . A A . 30 TRP CG 1 1 11 5575 1 1 30 TRP CH2 C -8.142 -5.453 -1.536 1.00 . A A . 30 TRP CH2 1 1 11 5576 1 1 30 TRP CZ2 C -7.699 -4.156 -1.275 1.00 . A A . 30 TRP CZ2 1 1 11 5577 1 1 30 TRP CZ3 C -7.287 -6.373 -2.164 1.00 . A A . 30 TRP CZ3 1 1 11 5578 1 1 30 TRP H H -2.741 -5.975 -0.578 1.00 . A A . 30 TRP H 1 1 11 5579 1 1 30 TRP HA H -0.953 -4.877 -2.669 1.00 . A A . 30 TRP HA 1 1 11 5580 1 1 30 TRP HB2 H -2.691 -3.859 -3.939 1.00 . A A . 30 TRP HB2 1 1 11 5581 1 1 30 TRP HB3 H -3.249 -5.502 -3.647 1.00 . A A . 30 TRP HB3 1 1 11 5582 1 1 30 TRP HD1 H -3.661 -1.976 -2.098 1.00 . A A . 30 TRP HD1 1 1 11 5583 1 1 30 TRP HE1 H -6.036 -1.802 -1.129 1.00 . A A . 30 TRP HE1 1 1 11 5584 1 1 30 TRP HE3 H -5.337 -6.711 -3.014 1.00 . A A . 30 TRP HE3 1 1 11 5585 1 1 30 TRP HH2 H -9.141 -5.750 -1.256 1.00 . A A . 30 TRP HH2 1 1 11 5586 1 1 30 TRP HZ2 H -8.352 -3.444 -0.792 1.00 . A A . 30 TRP HZ2 1 1 11 5587 1 1 30 TRP HZ3 H -7.634 -7.375 -2.365 1.00 . A A . 30 TRP HZ3 1 1 11 5588 1 1 30 TRP N N -2.233 -6.017 -1.421 1.00 . A A . 30 TRP N 1 1 11 5589 1 1 30 TRP NE1 N -5.679 -2.618 -1.535 1.00 . A A . 30 TRP NE1 1 1 11 5590 1 1 30 TRP O O -2.048 -3.693 0.001 1.00 . A A . 30 TRP O 1 1 11 5591 1 1 31 CYS C C -2.199 -0.076 -1.377 1.00 . A A . 31 CYS C 1 1 11 5592 1 1 31 CYS CA C -1.322 -1.201 -0.822 1.00 . A A . 31 CYS CA 1 1 11 5593 1 1 31 CYS CB C 0.154 -0.797 -0.862 1.00 . A A . 31 CYS CB 1 1 11 5594 1 1 31 CYS H H -1.248 -2.342 -2.646 1.00 . A A . 31 CYS H 1 1 11 5595 1 1 31 CYS HA H -1.611 -1.437 0.190 1.00 . A A . 31 CYS HA 1 1 11 5596 1 1 31 CYS HB2 H 0.773 -1.647 -0.617 1.00 . A A . 31 CYS HB2 1 1 11 5597 1 1 31 CYS HB3 H 0.406 -0.439 -1.850 1.00 . A A . 31 CYS HB3 1 1 11 5598 1 1 31 CYS N N -1.433 -2.413 -1.687 1.00 . A A . 31 CYS N 1 1 11 5599 1 1 31 CYS O O -2.088 0.302 -2.531 1.00 . A A . 31 CYS O 1 1 11 5600 1 1 31 CYS SG S 0.444 0.519 0.341 1.00 . A A . 31 CYS SG 1 1 11 5601 1 1 32 ALA C C -4.206 2.548 0.142 1.00 . A A . 32 ALA C 1 1 11 5602 1 1 32 ALA CA C -3.960 1.571 -1.014 1.00 . A A . 32 ALA CA 1 1 11 5603 1 1 32 ALA CB C -5.265 0.884 -1.433 1.00 . A A . 32 ALA CB 1 1 11 5604 1 1 32 ALA H H -3.128 0.135 0.366 1.00 . A A . 32 ALA H 1 1 11 5605 1 1 32 ALA HA H -3.525 2.083 -1.857 1.00 . A A . 32 ALA HA 1 1 11 5606 1 1 32 ALA HB1 H -5.726 0.429 -0.570 1.00 . A A . 32 ALA HB1 1 1 11 5607 1 1 32 ALA HB2 H -5.050 0.125 -2.170 1.00 . A A . 32 ALA HB2 1 1 11 5608 1 1 32 ALA HB3 H -5.936 1.617 -1.857 1.00 . A A . 32 ALA HB3 1 1 11 5609 1 1 32 ALA N N -3.067 0.462 -0.558 1.00 . A A . 32 ALA N 1 1 11 5610 1 1 32 ALA O O -3.679 2.379 1.223 1.00 . A A . 32 ALA O 1 1 11 5611 1 1 33 VAL C C -5.924 3.842 2.224 1.00 . A A . 33 VAL C 1 1 11 5612 1 1 33 VAL CA C -5.278 4.554 1.026 1.00 . A A . 33 VAL CA 1 1 11 5613 1 1 33 VAL CB C -6.240 5.585 0.425 1.00 . A A . 33 VAL CB 1 1 11 5614 1 1 33 VAL CG1 C -6.658 6.591 1.501 1.00 . A A . 33 VAL CG1 1 1 11 5615 1 1 33 VAL CG2 C -5.543 6.335 -0.714 1.00 . A A . 33 VAL CG2 1 1 11 5616 1 1 33 VAL H H -5.419 3.687 -0.952 1.00 . A A . 33 VAL H 1 1 11 5617 1 1 33 VAL HA H -4.363 5.040 1.328 1.00 . A A . 33 VAL HA 1 1 11 5618 1 1 33 VAL HB H -7.117 5.082 0.043 1.00 . A A . 33 VAL HB 1 1 11 5619 1 1 33 VAL HG11 H -7.361 6.126 2.176 1.00 . A A . 33 VAL HG11 1 1 11 5620 1 1 33 VAL HG12 H -7.120 7.448 1.035 1.00 . A A . 33 VAL HG12 1 1 11 5621 1 1 33 VAL HG13 H -5.786 6.909 2.054 1.00 . A A . 33 VAL HG13 1 1 11 5622 1 1 33 VAL HG21 H -6.095 7.234 -0.945 1.00 . A A . 33 VAL HG21 1 1 11 5623 1 1 33 VAL HG22 H -5.501 5.703 -1.589 1.00 . A A . 33 VAL HG22 1 1 11 5624 1 1 33 VAL HG23 H -4.539 6.597 -0.411 1.00 . A A . 33 VAL HG23 1 1 11 5625 1 1 33 VAL N N -5.002 3.570 -0.073 1.00 . A A . 33 VAL N 1 1 11 5626 1 1 33 VAL O O -6.515 2.788 2.085 1.00 . A A . 33 VAL O 1 1 11 5627 1 1 34 GLU C C -7.931 3.672 4.486 1.00 . A A . 34 GLU C 1 1 11 5628 1 1 34 GLU CA C -6.402 3.776 4.620 1.00 . A A . 34 GLU CA 1 1 11 5629 1 1 34 GLU CB C -6.011 4.696 5.784 1.00 . A A . 34 GLU CB 1 1 11 5630 1 1 34 GLU CD C -4.000 5.952 6.593 1.00 . A A . 34 GLU CD 1 1 11 5631 1 1 34 GLU CG C -4.498 4.619 6.022 1.00 . A A . 34 GLU CG 1 1 11 5632 1 1 34 GLU H H -5.320 5.261 3.482 1.00 . A A . 34 GLU H 1 1 11 5633 1 1 34 GLU HA H -5.977 2.798 4.770 1.00 . A A . 34 GLU HA 1 1 11 5634 1 1 34 GLU HB2 H -6.287 5.713 5.546 1.00 . A A . 34 GLU HB2 1 1 11 5635 1 1 34 GLU HB3 H -6.531 4.383 6.677 1.00 . A A . 34 GLU HB3 1 1 11 5636 1 1 34 GLU HG2 H -4.287 3.825 6.724 1.00 . A A . 34 GLU HG2 1 1 11 5637 1 1 34 GLU HG3 H -3.995 4.419 5.090 1.00 . A A . 34 GLU HG3 1 1 11 5638 1 1 34 GLU N N -5.806 4.413 3.401 1.00 . A A . 34 GLU N 1 1 11 5639 1 1 34 GLU O O -8.451 2.659 4.058 1.00 . A A . 34 GLU O 1 1 11 5640 1 1 34 GLU OE1 O -4.074 6.945 5.886 1.00 . A A . 34 GLU OE1 1 1 11 5641 1 1 34 GLU OE2 O -3.549 5.956 7.727 1.00 . A A . 34 GLU OE2 1 1 11 5642 1 1 35 ALA C C -10.735 6.063 4.995 1.00 . A A . 35 ALA C 1 1 11 5643 1 1 35 ALA CA C -10.146 4.668 4.741 1.00 . A A . 35 ALA CA 1 1 11 5644 1 1 35 ALA CB C -10.603 3.692 5.829 1.00 . A A . 35 ALA CB 1 1 11 5645 1 1 35 ALA H H -8.212 5.513 5.186 1.00 . A A . 35 ALA H 1 1 11 5646 1 1 35 ALA HA H -10.444 4.303 3.771 1.00 . A A . 35 ALA HA 1 1 11 5647 1 1 35 ALA HB1 H -10.360 2.684 5.534 1.00 . A A . 35 ALA HB1 1 1 11 5648 1 1 35 ALA HB2 H -11.671 3.781 5.966 1.00 . A A . 35 ALA HB2 1 1 11 5649 1 1 35 ALA HB3 H -10.101 3.927 6.757 1.00 . A A . 35 ALA HB3 1 1 11 5650 1 1 35 ALA N N -8.654 4.708 4.846 1.00 . A A . 35 ALA N 1 1 11 5651 1 1 35 ALA O O -10.319 6.748 5.911 1.00 . A A . 35 ALA O 1 1 11 5652 1 1 36 PRO C C -13.269 7.790 5.542 1.00 . A A . 36 PRO C 1 1 11 5653 1 1 36 PRO CA C -12.340 7.770 4.320 1.00 . A A . 36 PRO CA 1 1 11 5654 1 1 36 PRO CB C -13.134 7.925 3.027 1.00 . A A . 36 PRO CB 1 1 11 5655 1 1 36 PRO CD C -12.247 5.677 3.048 1.00 . A A . 36 PRO CD 1 1 11 5656 1 1 36 PRO CG C -13.389 6.529 2.554 1.00 . A A . 36 PRO CG 1 1 11 5657 1 1 36 PRO HA H -11.597 8.548 4.393 1.00 . A A . 36 PRO HA 1 1 11 5658 1 1 36 PRO HB2 H -14.069 8.436 3.220 1.00 . A A . 36 PRO HB2 1 1 11 5659 1 1 36 PRO HB3 H -12.556 8.462 2.291 1.00 . A A . 36 PRO HB3 1 1 11 5660 1 1 36 PRO HD2 H -12.610 4.715 3.380 1.00 . A A . 36 PRO HD2 1 1 11 5661 1 1 36 PRO HD3 H -11.503 5.557 2.276 1.00 . A A . 36 PRO HD3 1 1 11 5662 1 1 36 PRO HG2 H -14.324 6.169 2.961 1.00 . A A . 36 PRO HG2 1 1 11 5663 1 1 36 PRO HG3 H -13.420 6.504 1.477 1.00 . A A . 36 PRO HG3 1 1 11 5664 1 1 36 PRO N N -11.690 6.441 4.175 1.00 . A A . 36 PRO N 1 1 11 5665 1 1 36 PRO O O -13.183 8.736 6.309 1.00 . A A . 36 PRO O 1 1 12 5666 1 1 1 ASP C C 12.423 10.479 -3.717 1.00 . A A . 1 ASP C 1 1 12 5667 1 1 1 ASP CA C 13.946 10.559 -3.550 1.00 . A A . 1 ASP CA 1 1 12 5668 1 1 1 ASP CB C 14.520 11.733 -4.352 1.00 . A A . 1 ASP CB 1 1 12 5669 1 1 1 ASP CG C 14.168 13.050 -3.656 1.00 . A A . 1 ASP CG 1 1 12 5670 1 1 1 ASP H1 H 15.616 9.372 -3.936 1.00 . A A . 1 ASP H1 1 1 12 5671 1 1 1 ASP H2 H 14.423 9.302 -5.146 1.00 . A A . 1 ASP H2 1 1 12 5672 1 1 1 ASP H3 H 14.191 8.493 -3.670 1.00 . A A . 1 ASP H3 1 1 12 5673 1 1 1 ASP HA H 14.202 10.667 -2.508 1.00 . A A . 1 ASP HA 1 1 12 5674 1 1 1 ASP HB2 H 15.595 11.635 -4.416 1.00 . A A . 1 ASP HB2 1 1 12 5675 1 1 1 ASP HB3 H 14.100 11.730 -5.346 1.00 . A A . 1 ASP HB3 1 1 12 5676 1 1 1 ASP N N 14.593 9.340 -4.119 1.00 . A A . 1 ASP N 1 1 12 5677 1 1 1 ASP O O 11.880 10.847 -4.744 1.00 . A A . 1 ASP O 1 1 12 5678 1 1 1 ASP OD1 O 14.902 13.441 -2.763 1.00 . A A . 1 ASP OD1 1 1 12 5679 1 1 1 ASP OD2 O 13.169 13.645 -4.026 1.00 . A A . 1 ASP OD2 1 1 12 5680 1 1 2 GLY C C 9.847 8.445 -3.097 1.00 . A A . 2 GLY C 1 1 12 5681 1 1 2 GLY CA C 10.244 9.893 -2.803 1.00 . A A . 2 GLY CA 1 1 12 5682 1 1 2 GLY H H 12.191 9.709 -1.897 1.00 . A A . 2 GLY H 1 1 12 5683 1 1 2 GLY HA2 H 9.805 10.204 -1.866 1.00 . A A . 2 GLY HA2 1 1 12 5684 1 1 2 GLY HA3 H 9.884 10.528 -3.599 1.00 . A A . 2 GLY HA3 1 1 12 5685 1 1 2 GLY N N 11.730 10.000 -2.713 1.00 . A A . 2 GLY N 1 1 12 5686 1 1 2 GLY O O 9.376 8.128 -4.174 1.00 . A A . 2 GLY O 1 1 12 5687 1 1 3 GLU C C 8.175 5.925 -2.032 1.00 . A A . 3 GLU C 1 1 12 5688 1 1 3 GLU CA C 9.659 6.133 -2.357 1.00 . A A . 3 GLU CA 1 1 12 5689 1 1 3 GLU CB C 10.543 5.341 -1.391 1.00 . A A . 3 GLU CB 1 1 12 5690 1 1 3 GLU CD C 12.694 4.089 -1.172 1.00 . A A . 3 GLU CD 1 1 12 5691 1 1 3 GLU CG C 11.696 4.694 -2.162 1.00 . A A . 3 GLU CG 1 1 12 5692 1 1 3 GLU H H 10.406 7.850 -1.283 1.00 . A A . 3 GLU H 1 1 12 5693 1 1 3 GLU HA H 9.866 5.838 -3.374 1.00 . A A . 3 GLU HA 1 1 12 5694 1 1 3 GLU HB2 H 10.942 6.008 -0.638 1.00 . A A . 3 GLU HB2 1 1 12 5695 1 1 3 GLU HB3 H 9.957 4.572 -0.912 1.00 . A A . 3 GLU HB3 1 1 12 5696 1 1 3 GLU HG2 H 11.307 3.916 -2.804 1.00 . A A . 3 GLU HG2 1 1 12 5697 1 1 3 GLU HG3 H 12.193 5.442 -2.761 1.00 . A A . 3 GLU HG3 1 1 12 5698 1 1 3 GLU N N 10.029 7.566 -2.143 1.00 . A A . 3 GLU N 1 1 12 5699 1 1 3 GLU O O 7.795 5.775 -0.885 1.00 . A A . 3 GLU O 1 1 12 5700 1 1 3 GLU OE1 O 13.601 4.798 -0.768 1.00 . A A . 3 GLU OE1 1 1 12 5701 1 1 3 GLU OE2 O 12.533 2.927 -0.834 1.00 . A A . 3 GLU OE2 1 1 12 5702 1 1 4 CYS C C 5.254 4.844 -3.873 1.00 . A A . 4 CYS C 1 1 12 5703 1 1 4 CYS CA C 5.869 5.738 -2.790 1.00 . A A . 4 CYS CA 1 1 12 5704 1 1 4 CYS CB C 5.286 7.157 -2.830 1.00 . A A . 4 CYS CB 1 1 12 5705 1 1 4 CYS H H 7.661 6.055 -3.950 1.00 . A A . 4 CYS H 1 1 12 5706 1 1 4 CYS HA H 5.708 5.305 -1.814 1.00 . A A . 4 CYS HA 1 1 12 5707 1 1 4 CYS HB2 H 5.080 7.483 -1.821 1.00 . A A . 4 CYS HB2 1 1 12 5708 1 1 4 CYS HB3 H 6.005 7.825 -3.279 1.00 . A A . 4 CYS HB3 1 1 12 5709 1 1 4 CYS N N 7.332 5.925 -3.035 1.00 . A A . 4 CYS N 1 1 12 5710 1 1 4 CYS O O 5.794 4.698 -4.955 1.00 . A A . 4 CYS O 1 1 12 5711 1 1 4 CYS SG S 3.751 7.195 -3.791 1.00 . A A . 4 CYS SG 1 1 12 5712 1 1 5 GLY C C 2.409 4.173 -5.357 1.00 . A A . 5 GLY C 1 1 12 5713 1 1 5 GLY CA C 3.457 3.367 -4.583 1.00 . A A . 5 GLY CA 1 1 12 5714 1 1 5 GLY H H 3.711 4.387 -2.710 1.00 . A A . 5 GLY H 1 1 12 5715 1 1 5 GLY HA2 H 4.196 2.978 -5.269 1.00 . A A . 5 GLY HA2 1 1 12 5716 1 1 5 GLY HA3 H 2.972 2.548 -4.072 1.00 . A A . 5 GLY HA3 1 1 12 5717 1 1 5 GLY N N 4.124 4.248 -3.585 1.00 . A A . 5 GLY N 1 1 12 5718 1 1 5 GLY O O 2.718 5.173 -5.976 1.00 . A A . 5 GLY O 1 1 12 5719 1 1 6 GLY C C -1.246 4.266 -5.352 1.00 . A A . 6 GLY C 1 1 12 5720 1 1 6 GLY CA C 0.099 4.476 -6.059 1.00 . A A . 6 GLY CA 1 1 12 5721 1 1 6 GLY H H 0.953 2.929 -4.824 1.00 . A A . 6 GLY H 1 1 12 5722 1 1 6 GLY HA2 H 0.339 5.531 -6.078 1.00 . A A . 6 GLY HA2 1 1 12 5723 1 1 6 GLY HA3 H 0.035 4.107 -7.070 1.00 . A A . 6 GLY HA3 1 1 12 5724 1 1 6 GLY N N 1.174 3.741 -5.327 1.00 . A A . 6 GLY N 1 1 12 5725 1 1 6 GLY O O -1.303 4.084 -4.150 1.00 . A A . 6 GLY O 1 1 12 5726 1 1 7 PHE C C -3.966 2.606 -5.246 1.00 . A A . 7 PHE C 1 1 12 5727 1 1 7 PHE CA C -3.677 4.095 -5.464 1.00 . A A . 7 PHE CA 1 1 12 5728 1 1 7 PHE CB C -4.677 4.703 -6.456 1.00 . A A . 7 PHE CB 1 1 12 5729 1 1 7 PHE CD1 C -6.505 4.787 -4.716 1.00 . A A . 7 PHE CD1 1 1 12 5730 1 1 7 PHE CD2 C -6.980 3.753 -6.857 1.00 . A A . 7 PHE CD2 1 1 12 5731 1 1 7 PHE CE1 C -7.809 4.509 -4.292 1.00 . A A . 7 PHE CE1 1 1 12 5732 1 1 7 PHE CE2 C -8.286 3.477 -6.435 1.00 . A A . 7 PHE CE2 1 1 12 5733 1 1 7 PHE CG C -6.090 4.409 -6.000 1.00 . A A . 7 PHE CG 1 1 12 5734 1 1 7 PHE CZ C -8.699 3.854 -5.151 1.00 . A A . 7 PHE CZ 1 1 12 5735 1 1 7 PHE H H -2.258 4.440 -7.058 1.00 . A A . 7 PHE H 1 1 12 5736 1 1 7 PHE HA H -3.730 4.621 -4.526 1.00 . A A . 7 PHE HA 1 1 12 5737 1 1 7 PHE HB2 H -4.529 5.772 -6.507 1.00 . A A . 7 PHE HB2 1 1 12 5738 1 1 7 PHE HB3 H -4.519 4.273 -7.434 1.00 . A A . 7 PHE HB3 1 1 12 5739 1 1 7 PHE HD1 H -5.817 5.293 -4.053 1.00 . A A . 7 PHE HD1 1 1 12 5740 1 1 7 PHE HD2 H -6.662 3.463 -7.849 1.00 . A A . 7 PHE HD2 1 1 12 5741 1 1 7 PHE HE1 H -8.129 4.800 -3.302 1.00 . A A . 7 PHE HE1 1 1 12 5742 1 1 7 PHE HE2 H -8.973 2.973 -7.097 1.00 . A A . 7 PHE HE2 1 1 12 5743 1 1 7 PHE HZ H -9.707 3.639 -4.824 1.00 . A A . 7 PHE HZ 1 1 12 5744 1 1 7 PHE N N -2.330 4.290 -6.090 1.00 . A A . 7 PHE N 1 1 12 5745 1 1 7 PHE O O -4.474 2.215 -4.217 1.00 . A A . 7 PHE O 1 1 12 5746 1 1 8 TRP C C -2.701 -0.483 -6.558 1.00 . A A . 8 TRP C 1 1 12 5747 1 1 8 TRP CA C -3.905 0.316 -6.048 1.00 . A A . 8 TRP CA 1 1 12 5748 1 1 8 TRP CB C -5.158 0.032 -6.884 1.00 . A A . 8 TRP CB 1 1 12 5749 1 1 8 TRP CD1 C -6.329 -1.549 -5.292 1.00 . A A . 8 TRP CD1 1 1 12 5750 1 1 8 TRP CD2 C -5.796 -2.525 -7.248 1.00 . A A . 8 TRP CD2 1 1 12 5751 1 1 8 TRP CE2 C -6.435 -3.513 -6.462 1.00 . A A . 8 TRP CE2 1 1 12 5752 1 1 8 TRP CE3 C -5.359 -2.885 -8.535 1.00 . A A . 8 TRP CE3 1 1 12 5753 1 1 8 TRP CG C -5.739 -1.287 -6.483 1.00 . A A . 8 TRP CG 1 1 12 5754 1 1 8 TRP CH2 C -6.193 -5.151 -8.217 1.00 . A A . 8 TRP CH2 1 1 12 5755 1 1 8 TRP CZ2 C -6.633 -4.811 -6.936 1.00 . A A . 8 TRP CZ2 1 1 12 5756 1 1 8 TRP CZ3 C -5.557 -4.189 -9.016 1.00 . A A . 8 TRP CZ3 1 1 12 5757 1 1 8 TRP H H -3.241 2.120 -7.027 1.00 . A A . 8 TRP H 1 1 12 5758 1 1 8 TRP HA H -4.094 0.080 -5.011 1.00 . A A . 8 TRP HA 1 1 12 5759 1 1 8 TRP HB2 H -5.886 0.813 -6.715 1.00 . A A . 8 TRP HB2 1 1 12 5760 1 1 8 TRP HB3 H -4.894 0.007 -7.930 1.00 . A A . 8 TRP HB3 1 1 12 5761 1 1 8 TRP HD1 H -6.457 -0.843 -4.483 1.00 . A A . 8 TRP HD1 1 1 12 5762 1 1 8 TRP HE1 H -7.196 -3.313 -4.530 1.00 . A A . 8 TRP HE1 1 1 12 5763 1 1 8 TRP HE3 H -4.869 -2.152 -9.159 1.00 . A A . 8 TRP HE3 1 1 12 5764 1 1 8 TRP HH2 H -6.342 -6.152 -8.591 1.00 . A A . 8 TRP HH2 1 1 12 5765 1 1 8 TRP HZ2 H -7.124 -5.547 -6.314 1.00 . A A . 8 TRP HZ2 1 1 12 5766 1 1 8 TRP HZ3 H -5.218 -4.454 -10.006 1.00 . A A . 8 TRP HZ3 1 1 12 5767 1 1 8 TRP N N -3.649 1.779 -6.205 1.00 . A A . 8 TRP N 1 1 12 5768 1 1 8 TRP NE1 N -6.741 -2.870 -5.277 1.00 . A A . 8 TRP NE1 1 1 12 5769 1 1 8 TRP O O -2.731 -1.069 -7.624 1.00 . A A . 8 TRP O 1 1 12 5770 1 1 9 TRP C C -0.329 -2.571 -5.449 1.00 . A A . 9 TRP C 1 1 12 5771 1 1 9 TRP CA C -0.412 -1.249 -6.213 1.00 . A A . 9 TRP CA 1 1 12 5772 1 1 9 TRP CB C 0.759 -0.333 -5.837 1.00 . A A . 9 TRP CB 1 1 12 5773 1 1 9 TRP CD1 C -0.156 1.379 -7.471 1.00 . A A . 9 TRP CD1 1 1 12 5774 1 1 9 TRP CD2 C 2.083 1.451 -7.296 1.00 . A A . 9 TRP CD2 1 1 12 5775 1 1 9 TRP CE2 C 1.713 2.451 -8.224 1.00 . A A . 9 TRP CE2 1 1 12 5776 1 1 9 TRP CE3 C 3.450 1.288 -7.008 1.00 . A A . 9 TRP CE3 1 1 12 5777 1 1 9 TRP CG C 0.878 0.784 -6.829 1.00 . A A . 9 TRP CG 1 1 12 5778 1 1 9 TRP CH2 C 4.013 3.091 -8.542 1.00 . A A . 9 TRP CH2 1 1 12 5779 1 1 9 TRP CZ2 C 2.661 3.264 -8.840 1.00 . A A . 9 TRP CZ2 1 1 12 5780 1 1 9 TRP CZ3 C 4.407 2.106 -7.629 1.00 . A A . 9 TRP CZ3 1 1 12 5781 1 1 9 TRP H H -1.644 -0.015 -4.941 1.00 . A A . 9 TRP H 1 1 12 5782 1 1 9 TRP HA H -0.420 -1.425 -7.278 1.00 . A A . 9 TRP HA 1 1 12 5783 1 1 9 TRP HB2 H 0.590 0.082 -4.854 1.00 . A A . 9 TRP HB2 1 1 12 5784 1 1 9 TRP HB3 H 1.675 -0.904 -5.831 1.00 . A A . 9 TRP HB3 1 1 12 5785 1 1 9 TRP HD1 H -1.199 1.125 -7.356 1.00 . A A . 9 TRP HD1 1 1 12 5786 1 1 9 TRP HE1 H -0.201 2.948 -8.871 1.00 . A A . 9 TRP HE1 1 1 12 5787 1 1 9 TRP HE3 H 3.764 0.530 -6.306 1.00 . A A . 9 TRP HE3 1 1 12 5788 1 1 9 TRP HH2 H 4.754 3.715 -9.017 1.00 . A A . 9 TRP HH2 1 1 12 5789 1 1 9 TRP HZ2 H 2.349 4.025 -9.537 1.00 . A A . 9 TRP HZ2 1 1 12 5790 1 1 9 TRP HZ3 H 5.453 1.974 -7.399 1.00 . A A . 9 TRP HZ3 1 1 12 5791 1 1 9 TRP N N -1.637 -0.500 -5.795 1.00 . A A . 9 TRP N 1 1 12 5792 1 1 9 TRP NE1 N 0.340 2.367 -8.297 1.00 . A A . 9 TRP NE1 1 1 12 5793 1 1 9 TRP O O -1.116 -2.831 -4.563 1.00 . A A . 9 TRP O 1 1 12 5794 1 1 10 LYS C C 1.654 -4.567 -3.847 1.00 . A A . 10 LYS C 1 1 12 5795 1 1 10 LYS CA C 0.738 -4.716 -5.056 1.00 . A A . 10 LYS CA 1 1 12 5796 1 1 10 LYS CB C 1.353 -5.692 -6.056 1.00 . A A . 10 LYS CB 1 1 12 5797 1 1 10 LYS CD C 0.305 -6.275 -8.254 1.00 . A A . 10 LYS CD 1 1 12 5798 1 1 10 LYS CE C -0.420 -4.973 -8.618 1.00 . A A . 10 LYS CE 1 1 12 5799 1 1 10 LYS CG C 0.242 -6.494 -6.739 1.00 . A A . 10 LYS CG 1 1 12 5800 1 1 10 LYS H H 1.248 -3.187 -6.495 1.00 . A A . 10 LYS H 1 1 12 5801 1 1 10 LYS HA H -0.236 -5.065 -4.749 1.00 . A A . 10 LYS HA 1 1 12 5802 1 1 10 LYS HB2 H 1.915 -5.142 -6.796 1.00 . A A . 10 LYS HB2 1 1 12 5803 1 1 10 LYS HB3 H 2.013 -6.370 -5.533 1.00 . A A . 10 LYS HB3 1 1 12 5804 1 1 10 LYS HD2 H 1.337 -6.212 -8.564 1.00 . A A . 10 LYS HD2 1 1 12 5805 1 1 10 LYS HD3 H -0.171 -7.103 -8.757 1.00 . A A . 10 LYS HD3 1 1 12 5806 1 1 10 LYS HE2 H -0.930 -4.572 -7.752 1.00 . A A . 10 LYS HE2 1 1 12 5807 1 1 10 LYS HE3 H 0.280 -4.252 -9.010 1.00 . A A . 10 LYS HE3 1 1 12 5808 1 1 10 LYS HG2 H 0.372 -7.544 -6.520 1.00 . A A . 10 LYS HG2 1 1 12 5809 1 1 10 LYS HG3 H -0.718 -6.166 -6.370 1.00 . A A . 10 LYS HG3 1 1 12 5810 1 1 10 LYS HZ1 H -0.904 -5.766 -10.484 1.00 . A A . 10 LYS HZ1 1 1 12 5811 1 1 10 LYS HZ2 H -1.925 -4.507 -9.980 1.00 . A A . 10 LYS HZ2 1 1 12 5812 1 1 10 LYS HZ3 H -2.073 -6.051 -9.289 1.00 . A A . 10 LYS HZ3 1 1 12 5813 1 1 10 LYS N N 0.618 -3.412 -5.778 1.00 . A A . 10 LYS N 1 1 12 5814 1 1 10 LYS NZ N -1.404 -5.353 -9.671 1.00 . A A . 10 LYS NZ 1 1 12 5815 1 1 10 LYS O O 2.680 -3.914 -3.907 1.00 . A A . 10 LYS O 1 1 12 5816 1 1 11 CYS C C 1.980 -6.333 -0.670 1.00 . A A . 11 CYS C 1 1 12 5817 1 1 11 CYS CA C 2.145 -5.078 -1.531 1.00 . A A . 11 CYS CA 1 1 12 5818 1 1 11 CYS CB C 1.633 -3.840 -0.794 1.00 . A A . 11 CYS CB 1 1 12 5819 1 1 11 CYS H H 0.469 -5.700 -2.726 1.00 . A A . 11 CYS H 1 1 12 5820 1 1 11 CYS HA H 3.176 -4.943 -1.814 1.00 . A A . 11 CYS HA 1 1 12 5821 1 1 11 CYS HB2 H 1.805 -2.967 -1.401 1.00 . A A . 11 CYS HB2 1 1 12 5822 1 1 11 CYS HB3 H 0.575 -3.948 -0.608 1.00 . A A . 11 CYS HB3 1 1 12 5823 1 1 11 CYS N N 1.295 -5.174 -2.747 1.00 . A A . 11 CYS N 1 1 12 5824 1 1 11 CYS O O 1.010 -7.059 -0.791 1.00 . A A . 11 CYS O 1 1 12 5825 1 1 11 CYS SG S 2.504 -3.652 0.782 1.00 . A A . 11 CYS SG 1 1 12 5826 1 1 12 GLY C C 2.565 -7.315 2.524 1.00 . A A . 12 GLY C 1 1 12 5827 1 1 12 GLY CA C 2.825 -7.777 1.091 1.00 . A A . 12 GLY CA 1 1 12 5828 1 1 12 GLY H H 3.680 -5.972 0.286 1.00 . A A . 12 GLY H 1 1 12 5829 1 1 12 GLY HA2 H 2.015 -8.411 0.761 1.00 . A A . 12 GLY HA2 1 1 12 5830 1 1 12 GLY HA3 H 3.753 -8.326 1.056 1.00 . A A . 12 GLY HA3 1 1 12 5831 1 1 12 GLY N N 2.918 -6.581 0.206 1.00 . A A . 12 GLY N 1 1 12 5832 1 1 12 GLY O O 1.547 -6.717 2.815 1.00 . A A . 12 GLY O 1 1 12 5833 1 1 13 ARG C C 3.891 -5.732 5.045 1.00 . A A . 13 ARG C 1 1 12 5834 1 1 13 ARG CA C 3.293 -7.136 4.842 1.00 . A A . 13 ARG CA 1 1 12 5835 1 1 13 ARG CB C 4.048 -8.169 5.689 1.00 . A A . 13 ARG CB 1 1 12 5836 1 1 13 ARG CD C 2.567 -9.929 6.682 1.00 . A A . 13 ARG CD 1 1 12 5837 1 1 13 ARG CG C 3.443 -9.562 5.481 1.00 . A A . 13 ARG CG 1 1 12 5838 1 1 13 ARG CZ C 2.793 -12.162 7.600 1.00 . A A . 13 ARG CZ 1 1 12 5839 1 1 13 ARG H H 4.299 -8.051 3.162 1.00 . A A . 13 ARG H 1 1 12 5840 1 1 13 ARG HA H 2.245 -7.139 5.101 1.00 . A A . 13 ARG HA 1 1 12 5841 1 1 13 ARG HB2 H 5.087 -8.182 5.394 1.00 . A A . 13 ARG HB2 1 1 12 5842 1 1 13 ARG HB3 H 3.974 -7.899 6.732 1.00 . A A . 13 ARG HB3 1 1 12 5843 1 1 13 ARG HD2 H 3.060 -9.649 7.605 1.00 . A A . 13 ARG HD2 1 1 12 5844 1 1 13 ARG HD3 H 1.605 -9.449 6.608 1.00 . A A . 13 ARG HD3 1 1 12 5845 1 1 13 ARG HE H 2.014 -11.817 5.805 1.00 . A A . 13 ARG HE 1 1 12 5846 1 1 13 ARG HG2 H 2.841 -9.565 4.584 1.00 . A A . 13 ARG HG2 1 1 12 5847 1 1 13 ARG HG3 H 4.237 -10.286 5.384 1.00 . A A . 13 ARG HG3 1 1 12 5848 1 1 13 ARG HH11 H 1.058 -12.002 8.591 1.00 . A A . 13 ARG HH11 1 1 12 5849 1 1 13 ARG HH12 H 2.269 -12.975 9.357 1.00 . A A . 13 ARG HH12 1 1 12 5850 1 1 13 ARG HH21 H 4.617 -12.497 6.840 1.00 . A A . 13 ARG HH21 1 1 12 5851 1 1 13 ARG HH22 H 4.291 -13.255 8.362 1.00 . A A . 13 ARG HH22 1 1 12 5852 1 1 13 ARG N N 3.481 -7.576 3.422 1.00 . A A . 13 ARG N 1 1 12 5853 1 1 13 ARG NE N 2.408 -11.409 6.604 1.00 . A A . 13 ARG NE 1 1 12 5854 1 1 13 ARG NH1 N 1.976 -12.398 8.594 1.00 . A A . 13 ARG NH1 1 1 12 5855 1 1 13 ARG NH2 N 3.993 -12.680 7.601 1.00 . A A . 13 ARG NH2 1 1 12 5856 1 1 13 ARG O O 4.332 -5.389 6.128 1.00 . A A . 13 ARG O 1 1 12 5857 1 1 14 GLY C C 5.887 -3.513 3.527 1.00 . A A . 14 GLY C 1 1 12 5858 1 1 14 GLY CA C 4.477 -3.548 4.133 1.00 . A A . 14 GLY CA 1 1 12 5859 1 1 14 GLY H H 3.551 -5.220 3.151 1.00 . A A . 14 GLY H 1 1 12 5860 1 1 14 GLY HA2 H 3.842 -2.850 3.607 1.00 . A A . 14 GLY HA2 1 1 12 5861 1 1 14 GLY HA3 H 4.530 -3.269 5.175 1.00 . A A . 14 GLY HA3 1 1 12 5862 1 1 14 GLY N N 3.909 -4.922 4.011 1.00 . A A . 14 GLY N 1 1 12 5863 1 1 14 GLY O O 6.752 -2.805 4.006 1.00 . A A . 14 GLY O 1 1 12 5864 1 1 15 LYS C C 7.670 -2.992 1.003 1.00 . A A . 15 LYS C 1 1 12 5865 1 1 15 LYS CA C 7.483 -4.263 1.846 1.00 . A A . 15 LYS CA 1 1 12 5866 1 1 15 LYS CB C 7.542 -5.522 0.969 1.00 . A A . 15 LYS CB 1 1 12 5867 1 1 15 LYS CD C 8.055 -7.785 1.917 1.00 . A A . 15 LYS CD 1 1 12 5868 1 1 15 LYS CE C 8.606 -8.917 1.044 1.00 . A A . 15 LYS CE 1 1 12 5869 1 1 15 LYS CG C 8.656 -6.447 1.470 1.00 . A A . 15 LYS CG 1 1 12 5870 1 1 15 LYS H H 5.412 -4.828 2.105 1.00 . A A . 15 LYS H 1 1 12 5871 1 1 15 LYS HA H 8.241 -4.313 2.606 1.00 . A A . 15 LYS HA 1 1 12 5872 1 1 15 LYS HB2 H 6.594 -6.039 1.016 1.00 . A A . 15 LYS HB2 1 1 12 5873 1 1 15 LYS HB3 H 7.748 -5.239 -0.052 1.00 . A A . 15 LYS HB3 1 1 12 5874 1 1 15 LYS HD2 H 8.316 -7.966 2.950 1.00 . A A . 15 LYS HD2 1 1 12 5875 1 1 15 LYS HD3 H 6.980 -7.748 1.818 1.00 . A A . 15 LYS HD3 1 1 12 5876 1 1 15 LYS HE2 H 7.806 -9.380 0.483 1.00 . A A . 15 LYS HE2 1 1 12 5877 1 1 15 LYS HE3 H 9.366 -8.542 0.377 1.00 . A A . 15 LYS HE3 1 1 12 5878 1 1 15 LYS HG2 H 9.363 -6.620 0.673 1.00 . A A . 15 LYS HG2 1 1 12 5879 1 1 15 LYS HG3 H 9.161 -5.987 2.305 1.00 . A A . 15 LYS HG3 1 1 12 5880 1 1 15 LYS HZ1 H 9.551 -10.719 1.479 1.00 . A A . 15 LYS HZ1 1 1 12 5881 1 1 15 LYS HZ2 H 8.480 -10.190 2.688 1.00 . A A . 15 LYS HZ2 1 1 12 5882 1 1 15 LYS HZ3 H 9.996 -9.443 2.504 1.00 . A A . 15 LYS HZ3 1 1 12 5883 1 1 15 LYS N N 6.125 -4.266 2.479 1.00 . A A . 15 LYS N 1 1 12 5884 1 1 15 LYS NZ N 9.203 -9.891 2.000 1.00 . A A . 15 LYS NZ 1 1 12 5885 1 1 15 LYS O O 8.558 -2.206 1.271 1.00 . A A . 15 LYS O 1 1 12 5886 1 1 16 PRO C C 6.354 -0.392 -0.111 1.00 . A A . 16 PRO C 1 1 12 5887 1 1 16 PRO CA C 6.895 -1.622 -0.856 1.00 . A A . 16 PRO CA 1 1 12 5888 1 1 16 PRO CB C 6.003 -1.979 -2.041 1.00 . A A . 16 PRO CB 1 1 12 5889 1 1 16 PRO CD C 5.721 -3.713 -0.378 1.00 . A A . 16 PRO CD 1 1 12 5890 1 1 16 PRO CG C 5.040 -2.995 -1.516 1.00 . A A . 16 PRO CG 1 1 12 5891 1 1 16 PRO HA H 7.908 -1.457 -1.189 1.00 . A A . 16 PRO HA 1 1 12 5892 1 1 16 PRO HB2 H 5.474 -1.101 -2.388 1.00 . A A . 16 PRO HB2 1 1 12 5893 1 1 16 PRO HB3 H 6.591 -2.405 -2.839 1.00 . A A . 16 PRO HB3 1 1 12 5894 1 1 16 PRO HD2 H 5.036 -3.854 0.446 1.00 . A A . 16 PRO HD2 1 1 12 5895 1 1 16 PRO HD3 H 6.117 -4.661 -0.708 1.00 . A A . 16 PRO HD3 1 1 12 5896 1 1 16 PRO HG2 H 4.145 -2.504 -1.161 1.00 . A A . 16 PRO HG2 1 1 12 5897 1 1 16 PRO HG3 H 4.791 -3.702 -2.292 1.00 . A A . 16 PRO HG3 1 1 12 5898 1 1 16 PRO N N 6.817 -2.820 0.015 1.00 . A A . 16 PRO N 1 1 12 5899 1 1 16 PRO O O 5.267 -0.430 0.433 1.00 . A A . 16 PRO O 1 1 12 5900 1 1 17 PRO C C 5.581 2.599 -0.167 1.00 . A A . 17 PRO C 1 1 12 5901 1 1 17 PRO CA C 6.729 1.911 0.588 1.00 . A A . 17 PRO CA 1 1 12 5902 1 1 17 PRO CB C 7.996 2.764 0.564 1.00 . A A . 17 PRO CB 1 1 12 5903 1 1 17 PRO CD C 8.460 0.791 -0.738 1.00 . A A . 17 PRO CD 1 1 12 5904 1 1 17 PRO CG C 8.779 2.257 -0.603 1.00 . A A . 17 PRO CG 1 1 12 5905 1 1 17 PRO HA H 6.444 1.704 1.606 1.00 . A A . 17 PRO HA 1 1 12 5906 1 1 17 PRO HB2 H 7.743 3.807 0.427 1.00 . A A . 17 PRO HB2 1 1 12 5907 1 1 17 PRO HB3 H 8.557 2.628 1.474 1.00 . A A . 17 PRO HB3 1 1 12 5908 1 1 17 PRO HD2 H 8.417 0.508 -1.780 1.00 . A A . 17 PRO HD2 1 1 12 5909 1 1 17 PRO HD3 H 9.185 0.194 -0.208 1.00 . A A . 17 PRO HD3 1 1 12 5910 1 1 17 PRO HG2 H 8.488 2.787 -1.500 1.00 . A A . 17 PRO HG2 1 1 12 5911 1 1 17 PRO HG3 H 9.836 2.383 -0.424 1.00 . A A . 17 PRO HG3 1 1 12 5912 1 1 17 PRO N N 7.137 0.661 -0.107 1.00 . A A . 17 PRO N 1 1 12 5913 1 1 17 PRO O O 5.760 3.104 -1.258 1.00 . A A . 17 PRO O 1 1 12 5914 1 1 18 CYS C C 3.259 4.789 0.018 1.00 . A A . 18 CYS C 1 1 12 5915 1 1 18 CYS CA C 3.240 3.278 -0.255 1.00 . A A . 18 CYS CA 1 1 12 5916 1 1 18 CYS CB C 1.998 2.631 0.370 1.00 . A A . 18 CYS CB 1 1 12 5917 1 1 18 CYS H H 4.292 2.207 1.296 1.00 . A A . 18 CYS H 1 1 12 5918 1 1 18 CYS HA H 3.261 3.085 -1.315 1.00 . A A . 18 CYS HA 1 1 12 5919 1 1 18 CYS HB2 H 2.026 2.751 1.443 1.00 . A A . 18 CYS HB2 1 1 12 5920 1 1 18 CYS HB3 H 1.110 3.106 -0.020 1.00 . A A . 18 CYS HB3 1 1 12 5921 1 1 18 CYS N N 4.407 2.621 0.416 1.00 . A A . 18 CYS N 1 1 12 5922 1 1 18 CYS O O 3.914 5.254 0.932 1.00 . A A . 18 CYS O 1 1 12 5923 1 1 18 CYS SG S 1.961 0.868 -0.035 1.00 . A A . 18 CYS SG 1 1 12 5924 1 1 19 CYS C C 1.929 7.389 0.797 1.00 . A A . 19 CYS C 1 1 12 5925 1 1 19 CYS CA C 2.522 7.039 -0.573 1.00 . A A . 19 CYS CA 1 1 12 5926 1 1 19 CYS CB C 1.624 7.582 -1.688 1.00 . A A . 19 CYS CB 1 1 12 5927 1 1 19 CYS H H 2.034 5.152 -1.505 1.00 . A A . 19 CYS H 1 1 12 5928 1 1 19 CYS HA H 3.515 7.450 -0.668 1.00 . A A . 19 CYS HA 1 1 12 5929 1 1 19 CYS HB2 H 1.169 6.758 -2.216 1.00 . A A . 19 CYS HB2 1 1 12 5930 1 1 19 CYS HB3 H 0.853 8.203 -1.258 1.00 . A A . 19 CYS HB3 1 1 12 5931 1 1 19 CYS N N 2.548 5.554 -0.774 1.00 . A A . 19 CYS N 1 1 12 5932 1 1 19 CYS O O 1.096 6.673 1.322 1.00 . A A . 19 CYS O 1 1 12 5933 1 1 19 CYS SG S 2.612 8.564 -2.841 1.00 . A A . 19 CYS SG 1 1 12 5934 1 1 20 LYS C C 0.294 9.000 2.660 1.00 . A A . 20 LYS C 1 1 12 5935 1 1 20 LYS CA C 1.823 8.900 2.706 1.00 . A A . 20 LYS CA 1 1 12 5936 1 1 20 LYS CB C 2.445 10.273 2.978 1.00 . A A . 20 LYS CB 1 1 12 5937 1 1 20 LYS CD C 3.591 11.158 5.022 1.00 . A A . 20 LYS CD 1 1 12 5938 1 1 20 LYS CE C 3.907 10.450 6.345 1.00 . A A . 20 LYS CE 1 1 12 5939 1 1 20 LYS CG C 2.268 10.629 4.459 1.00 . A A . 20 LYS CG 1 1 12 5940 1 1 20 LYS H H 3.025 9.041 0.928 1.00 . A A . 20 LYS H 1 1 12 5941 1 1 20 LYS HA H 2.135 8.200 3.459 1.00 . A A . 20 LYS HA 1 1 12 5942 1 1 20 LYS HB2 H 3.497 10.246 2.737 1.00 . A A . 20 LYS HB2 1 1 12 5943 1 1 20 LYS HB3 H 1.954 11.018 2.370 1.00 . A A . 20 LYS HB3 1 1 12 5944 1 1 20 LYS HD2 H 4.384 10.966 4.315 1.00 . A A . 20 LYS HD2 1 1 12 5945 1 1 20 LYS HD3 H 3.511 12.220 5.195 1.00 . A A . 20 LYS HD3 1 1 12 5946 1 1 20 LYS HE2 H 3.556 9.428 6.315 1.00 . A A . 20 LYS HE2 1 1 12 5947 1 1 20 LYS HE3 H 4.966 10.478 6.543 1.00 . A A . 20 LYS HE3 1 1 12 5948 1 1 20 LYS HG2 H 1.507 11.389 4.556 1.00 . A A . 20 LYS HG2 1 1 12 5949 1 1 20 LYS HG3 H 1.970 9.749 5.008 1.00 . A A . 20 LYS HG3 1 1 12 5950 1 1 20 LYS HZ1 H 2.158 11.242 7.158 1.00 . A A . 20 LYS HZ1 1 1 12 5951 1 1 20 LYS HZ2 H 3.540 12.197 7.419 1.00 . A A . 20 LYS HZ2 1 1 12 5952 1 1 20 LYS HZ3 H 3.308 10.772 8.313 1.00 . A A . 20 LYS HZ3 1 1 12 5953 1 1 20 LYS N N 2.354 8.487 1.375 1.00 . A A . 20 LYS N 1 1 12 5954 1 1 20 LYS NZ N 3.174 11.224 7.387 1.00 . A A . 20 LYS NZ 1 1 12 5955 1 1 20 LYS O O -0.265 9.718 1.851 1.00 . A A . 20 LYS O 1 1 12 5956 1 1 21 GLY C C -2.424 6.955 3.058 1.00 . A A . 21 GLY C 1 1 12 5957 1 1 21 GLY CA C -1.874 8.311 3.522 1.00 . A A . 21 GLY CA 1 1 12 5958 1 1 21 GLY H H 0.096 7.700 4.150 1.00 . A A . 21 GLY H 1 1 12 5959 1 1 21 GLY HA2 H -2.222 8.520 4.523 1.00 . A A . 21 GLY HA2 1 1 12 5960 1 1 21 GLY HA3 H -2.220 9.084 2.853 1.00 . A A . 21 GLY HA3 1 1 12 5961 1 1 21 GLY N N -0.380 8.276 3.516 1.00 . A A . 21 GLY N 1 1 12 5962 1 1 21 GLY O O -3.521 6.570 3.419 1.00 . A A . 21 GLY O 1 1 12 5963 1 1 22 TYR C C -1.733 3.800 2.761 1.00 . A A . 22 TYR C 1 1 12 5964 1 1 22 TYR CA C -2.149 4.896 1.773 1.00 . A A . 22 TYR CA 1 1 12 5965 1 1 22 TYR CB C -1.452 4.673 0.421 1.00 . A A . 22 TYR CB 1 1 12 5966 1 1 22 TYR CD1 C -2.789 6.721 -0.286 1.00 . A A . 22 TYR CD1 1 1 12 5967 1 1 22 TYR CD2 C -1.069 5.866 -1.764 1.00 . A A . 22 TYR CD2 1 1 12 5968 1 1 22 TYR CE1 C -3.076 7.734 -1.209 1.00 . A A . 22 TYR CE1 1 1 12 5969 1 1 22 TYR CE2 C -1.358 6.877 -2.686 1.00 . A A . 22 TYR CE2 1 1 12 5970 1 1 22 TYR CG C -1.781 5.784 -0.563 1.00 . A A . 22 TYR CG 1 1 12 5971 1 1 22 TYR CZ C -2.361 7.811 -2.410 1.00 . A A . 22 TYR CZ 1 1 12 5972 1 1 22 TYR H H -0.793 6.559 1.984 1.00 . A A . 22 TYR H 1 1 12 5973 1 1 22 TYR HA H -3.220 4.901 1.641 1.00 . A A . 22 TYR HA 1 1 12 5974 1 1 22 TYR HB2 H -0.383 4.644 0.575 1.00 . A A . 22 TYR HB2 1 1 12 5975 1 1 22 TYR HB3 H -1.775 3.728 0.010 1.00 . A A . 22 TYR HB3 1 1 12 5976 1 1 22 TYR HD1 H -3.343 6.664 0.639 1.00 . A A . 22 TYR HD1 1 1 12 5977 1 1 22 TYR HD2 H -0.292 5.146 -1.980 1.00 . A A . 22 TYR HD2 1 1 12 5978 1 1 22 TYR HE1 H -3.850 8.455 -0.996 1.00 . A A . 22 TYR HE1 1 1 12 5979 1 1 22 TYR HE2 H -0.806 6.937 -3.612 1.00 . A A . 22 TYR HE2 1 1 12 5980 1 1 22 TYR HH H -3.206 8.430 -4.006 1.00 . A A . 22 TYR HH 1 1 12 5981 1 1 22 TYR N N -1.671 6.228 2.262 1.00 . A A . 22 TYR N 1 1 12 5982 1 1 22 TYR O O -0.835 3.982 3.561 1.00 . A A . 22 TYR O 1 1 12 5983 1 1 22 TYR OH O -2.647 8.806 -3.321 1.00 . A A . 22 TYR OH 1 1 12 5984 1 1 23 ALA C C -1.884 0.236 2.863 1.00 . A A . 23 ALA C 1 1 12 5985 1 1 23 ALA CA C -2.027 1.551 3.638 1.00 . A A . 23 ALA CA 1 1 12 5986 1 1 23 ALA CB C -3.197 1.470 4.620 1.00 . A A . 23 ALA CB 1 1 12 5987 1 1 23 ALA H H -3.099 2.542 2.052 1.00 . A A . 23 ALA H 1 1 12 5988 1 1 23 ALA HA H -1.116 1.777 4.167 1.00 . A A . 23 ALA HA 1 1 12 5989 1 1 23 ALA HB1 H -3.345 2.434 5.083 1.00 . A A . 23 ALA HB1 1 1 12 5990 1 1 23 ALA HB2 H -2.977 0.736 5.381 1.00 . A A . 23 ALA HB2 1 1 12 5991 1 1 23 ALA HB3 H -4.094 1.184 4.090 1.00 . A A . 23 ALA HB3 1 1 12 5992 1 1 23 ALA N N -2.380 2.665 2.708 1.00 . A A . 23 ALA N 1 1 12 5993 1 1 23 ALA O O -2.595 -0.013 1.908 1.00 . A A . 23 ALA O 1 1 12 5994 1 1 24 CYS C C -1.660 -2.989 3.180 1.00 . A A . 24 CYS C 1 1 12 5995 1 1 24 CYS CA C -0.764 -1.907 2.567 1.00 . A A . 24 CYS CA 1 1 12 5996 1 1 24 CYS CB C 0.715 -2.242 2.778 1.00 . A A . 24 CYS CB 1 1 12 5997 1 1 24 CYS H H -0.409 -0.377 4.049 1.00 . A A . 24 CYS H 1 1 12 5998 1 1 24 CYS HA H -0.972 -1.801 1.515 1.00 . A A . 24 CYS HA 1 1 12 5999 1 1 24 CYS HB2 H 1.322 -1.534 2.236 1.00 . A A . 24 CYS HB2 1 1 12 6000 1 1 24 CYS HB3 H 0.949 -2.188 3.830 1.00 . A A . 24 CYS HB3 1 1 12 6001 1 1 24 CYS N N -0.967 -0.604 3.274 1.00 . A A . 24 CYS N 1 1 12 6002 1 1 24 CYS O O -2.167 -2.842 4.278 1.00 . A A . 24 CYS O 1 1 12 6003 1 1 24 CYS SG S 1.062 -3.914 2.171 1.00 . A A . 24 CYS SG 1 1 12 6004 1 1 25 SER C C -2.124 -6.537 2.703 1.00 . A A . 25 SER C 1 1 12 6005 1 1 25 SER CA C -2.730 -5.162 3.007 1.00 . A A . 25 SER CA 1 1 12 6006 1 1 25 SER CB C -4.069 -4.991 2.290 1.00 . A A . 25 SER CB 1 1 12 6007 1 1 25 SER H H -1.448 -4.163 1.591 1.00 . A A . 25 SER H 1 1 12 6008 1 1 25 SER HA H -2.868 -5.044 4.067 1.00 . A A . 25 SER HA 1 1 12 6009 1 1 25 SER HB2 H -3.899 -4.782 1.246 1.00 . A A . 25 SER HB2 1 1 12 6010 1 1 25 SER HB3 H -4.645 -5.903 2.382 1.00 . A A . 25 SER HB3 1 1 12 6011 1 1 25 SER HG H -4.730 -3.158 2.272 1.00 . A A . 25 SER HG 1 1 12 6012 1 1 25 SER N N -1.864 -4.072 2.474 1.00 . A A . 25 SER N 1 1 12 6013 1 1 25 SER O O -2.335 -7.096 1.646 1.00 . A A . 25 SER O 1 1 12 6014 1 1 25 SER OG O -4.781 -3.906 2.873 1.00 . A A . 25 SER OG 1 1 12 6015 1 1 26 LYS C C -1.869 -9.497 3.196 1.00 . A A . 26 LYS C 1 1 12 6016 1 1 26 LYS CA C -0.770 -8.445 3.401 1.00 . A A . 26 LYS CA 1 1 12 6017 1 1 26 LYS CB C 0.045 -8.759 4.664 1.00 . A A . 26 LYS CB 1 1 12 6018 1 1 26 LYS CD C -0.212 -7.567 6.858 1.00 . A A . 26 LYS CD 1 1 12 6019 1 1 26 LYS CE C -1.191 -6.398 7.024 1.00 . A A . 26 LYS CE 1 1 12 6020 1 1 26 LYS CG C -0.823 -8.618 5.923 1.00 . A A . 26 LYS CG 1 1 12 6021 1 1 26 LYS H H -1.224 -6.624 4.478 1.00 . A A . 26 LYS H 1 1 12 6022 1 1 26 LYS HA H -0.119 -8.417 2.544 1.00 . A A . 26 LYS HA 1 1 12 6023 1 1 26 LYS HB2 H 0.416 -9.770 4.602 1.00 . A A . 26 LYS HB2 1 1 12 6024 1 1 26 LYS HB3 H 0.876 -8.077 4.725 1.00 . A A . 26 LYS HB3 1 1 12 6025 1 1 26 LYS HD2 H -0.016 -8.015 7.821 1.00 . A A . 26 LYS HD2 1 1 12 6026 1 1 26 LYS HD3 H 0.714 -7.202 6.435 1.00 . A A . 26 LYS HD3 1 1 12 6027 1 1 26 LYS HE2 H -0.834 -5.534 6.482 1.00 . A A . 26 LYS HE2 1 1 12 6028 1 1 26 LYS HE3 H -2.173 -6.678 6.682 1.00 . A A . 26 LYS HE3 1 1 12 6029 1 1 26 LYS HG2 H -1.819 -8.311 5.645 1.00 . A A . 26 LYS HG2 1 1 12 6030 1 1 26 LYS HG3 H -0.869 -9.566 6.436 1.00 . A A . 26 LYS HG3 1 1 12 6031 1 1 26 LYS HZ1 H -1.908 -5.364 8.681 1.00 . A A . 26 LYS HZ1 1 1 12 6032 1 1 26 LYS HZ2 H -0.274 -5.813 8.801 1.00 . A A . 26 LYS HZ2 1 1 12 6033 1 1 26 LYS HZ3 H -1.496 -6.978 9.002 1.00 . A A . 26 LYS HZ3 1 1 12 6034 1 1 26 LYS N N -1.379 -7.093 3.630 1.00 . A A . 26 LYS N 1 1 12 6035 1 1 26 LYS NZ N -1.220 -6.117 8.488 1.00 . A A . 26 LYS NZ 1 1 12 6036 1 1 26 LYS O O -1.693 -10.454 2.466 1.00 . A A . 26 LYS O 1 1 12 6037 1 1 27 THR C C -4.757 -10.165 2.299 1.00 . A A . 27 THR C 1 1 12 6038 1 1 27 THR CA C -4.121 -10.297 3.686 1.00 . A A . 27 THR CA 1 1 12 6039 1 1 27 THR CB C -5.135 -9.923 4.778 1.00 . A A . 27 THR CB 1 1 12 6040 1 1 27 THR CG2 C -6.166 -11.044 4.931 1.00 . A A . 27 THR CG2 1 1 12 6041 1 1 27 THR H H -3.107 -8.536 4.412 1.00 . A A . 27 THR H 1 1 12 6042 1 1 27 THR HA H -3.768 -11.301 3.840 1.00 . A A . 27 THR HA 1 1 12 6043 1 1 27 THR HB H -5.643 -9.011 4.499 1.00 . A A . 27 THR HB 1 1 12 6044 1 1 27 THR HG1 H -4.518 -8.802 6.245 1.00 . A A . 27 THR HG1 1 1 12 6045 1 1 27 THR HG21 H -5.755 -11.828 5.550 1.00 . A A . 27 THR HG21 1 1 12 6046 1 1 27 THR HG22 H -6.413 -11.443 3.959 1.00 . A A . 27 THR HG22 1 1 12 6047 1 1 27 THR HG23 H -7.057 -10.648 5.395 1.00 . A A . 27 THR HG23 1 1 12 6048 1 1 27 THR N N -2.998 -9.320 3.834 1.00 . A A . 27 THR N 1 1 12 6049 1 1 27 THR O O -5.128 -11.145 1.682 1.00 . A A . 27 THR O 1 1 12 6050 1 1 27 THR OG1 O -4.458 -9.733 6.014 1.00 . A A . 27 THR OG1 1 1 12 6051 1 1 28 TRP C C -4.427 -8.963 -0.624 1.00 . A A . 28 TRP C 1 1 12 6052 1 1 28 TRP CA C -5.490 -8.749 0.460 1.00 . A A . 28 TRP CA 1 1 12 6053 1 1 28 TRP CB C -5.989 -7.297 0.455 1.00 . A A . 28 TRP CB 1 1 12 6054 1 1 28 TRP CD1 C -7.546 -8.061 2.314 1.00 . A A . 28 TRP CD1 1 1 12 6055 1 1 28 TRP CD2 C -7.603 -5.834 1.994 1.00 . A A . 28 TRP CD2 1 1 12 6056 1 1 28 TRP CE2 C -8.505 -6.119 3.046 1.00 . A A . 28 TRP CE2 1 1 12 6057 1 1 28 TRP CE3 C -7.454 -4.493 1.595 1.00 . A A . 28 TRP CE3 1 1 12 6058 1 1 28 TRP CG C -7.003 -7.086 1.545 1.00 . A A . 28 TRP CG 1 1 12 6059 1 1 28 TRP CH2 C -9.073 -3.787 3.272 1.00 . A A . 28 TRP CH2 1 1 12 6060 1 1 28 TRP CZ2 C -9.231 -5.112 3.681 1.00 . A A . 28 TRP CZ2 1 1 12 6061 1 1 28 TRP CZ3 C -8.185 -3.476 2.231 1.00 . A A . 28 TRP CZ3 1 1 12 6062 1 1 28 TRP H H -4.571 -8.188 2.329 1.00 . A A . 28 TRP H 1 1 12 6063 1 1 28 TRP HA H -6.318 -9.425 0.312 1.00 . A A . 28 TRP HA 1 1 12 6064 1 1 28 TRP HB2 H -5.152 -6.633 0.612 1.00 . A A . 28 TRP HB2 1 1 12 6065 1 1 28 TRP HB3 H -6.440 -7.078 -0.500 1.00 . A A . 28 TRP HB3 1 1 12 6066 1 1 28 TRP HD1 H -7.319 -9.114 2.246 1.00 . A A . 28 TRP HD1 1 1 12 6067 1 1 28 TRP HE1 H -8.954 -7.974 3.876 1.00 . A A . 28 TRP HE1 1 1 12 6068 1 1 28 TRP HE3 H -6.774 -4.243 0.794 1.00 . A A . 28 TRP HE3 1 1 12 6069 1 1 28 TRP HH2 H -9.632 -3.001 3.758 1.00 . A A . 28 TRP HH2 1 1 12 6070 1 1 28 TRP HZ2 H -9.914 -5.355 4.482 1.00 . A A . 28 TRP HZ2 1 1 12 6071 1 1 28 TRP HZ3 H -8.065 -2.450 1.917 1.00 . A A . 28 TRP HZ3 1 1 12 6072 1 1 28 TRP N N -4.881 -8.958 1.809 1.00 . A A . 28 TRP N 1 1 12 6073 1 1 28 TRP NE1 N -8.431 -7.486 3.206 1.00 . A A . 28 TRP NE1 1 1 12 6074 1 1 28 TRP O O -4.641 -9.682 -1.581 1.00 . A A . 28 TRP O 1 1 12 6075 1 1 29 GLY C C -1.906 -7.227 -2.219 1.00 . A A . 29 GLY C 1 1 12 6076 1 1 29 GLY CA C -2.181 -8.534 -1.461 1.00 . A A . 29 GLY CA 1 1 12 6077 1 1 29 GLY H H -3.129 -7.796 0.329 1.00 . A A . 29 GLY H 1 1 12 6078 1 1 29 GLY HA2 H -1.282 -8.840 -0.948 1.00 . A A . 29 GLY HA2 1 1 12 6079 1 1 29 GLY HA3 H -2.463 -9.298 -2.169 1.00 . A A . 29 GLY HA3 1 1 12 6080 1 1 29 GLY N N -3.277 -8.359 -0.463 1.00 . A A . 29 GLY N 1 1 12 6081 1 1 29 GLY O O -1.249 -7.238 -3.244 1.00 . A A . 29 GLY O 1 1 12 6082 1 1 30 TRP C C -2.075 -3.632 -1.486 1.00 . A A . 30 TRP C 1 1 12 6083 1 1 30 TRP CA C -2.109 -4.818 -2.461 1.00 . A A . 30 TRP CA 1 1 12 6084 1 1 30 TRP CB C -3.237 -4.680 -3.501 1.00 . A A . 30 TRP CB 1 1 12 6085 1 1 30 TRP CD1 C -4.774 -3.032 -2.352 1.00 . A A . 30 TRP CD1 1 1 12 6086 1 1 30 TRP CD2 C -5.738 -5.039 -2.664 1.00 . A A . 30 TRP CD2 1 1 12 6087 1 1 30 TRP CE2 C -6.694 -4.223 -2.017 1.00 . A A . 30 TRP CE2 1 1 12 6088 1 1 30 TRP CE3 C -6.098 -6.362 -2.980 1.00 . A A . 30 TRP CE3 1 1 12 6089 1 1 30 TRP CG C -4.522 -4.261 -2.857 1.00 . A A . 30 TRP CG 1 1 12 6090 1 1 30 TRP CH2 C -8.308 -6.014 -2.017 1.00 . A A . 30 TRP CH2 1 1 12 6091 1 1 30 TRP CZ2 C -7.965 -4.700 -1.696 1.00 . A A . 30 TRP CZ2 1 1 12 6092 1 1 30 TRP CZ3 C -7.377 -6.845 -2.658 1.00 . A A . 30 TRP CZ3 1 1 12 6093 1 1 30 TRP H H -2.901 -6.093 -0.903 1.00 . A A . 30 TRP H 1 1 12 6094 1 1 30 TRP HA H -1.162 -4.887 -2.972 1.00 . A A . 30 TRP HA 1 1 12 6095 1 1 30 TRP HB2 H -2.955 -3.942 -4.235 1.00 . A A . 30 TRP HB2 1 1 12 6096 1 1 30 TRP HB3 H -3.381 -5.631 -3.995 1.00 . A A . 30 TRP HB3 1 1 12 6097 1 1 30 TRP HD1 H -4.079 -2.206 -2.335 1.00 . A A . 30 TRP HD1 1 1 12 6098 1 1 30 TRP HE1 H -6.481 -2.239 -1.419 1.00 . A A . 30 TRP HE1 1 1 12 6099 1 1 30 TRP HE3 H -5.388 -7.009 -3.473 1.00 . A A . 30 TRP HE3 1 1 12 6100 1 1 30 TRP HH2 H -9.289 -6.390 -1.774 1.00 . A A . 30 TRP HH2 1 1 12 6101 1 1 30 TRP HZ2 H -8.679 -4.057 -1.203 1.00 . A A . 30 TRP HZ2 1 1 12 6102 1 1 30 TRP HZ3 H -7.645 -7.861 -2.907 1.00 . A A . 30 TRP HZ3 1 1 12 6103 1 1 30 TRP N N -2.381 -6.100 -1.737 1.00 . A A . 30 TRP N 1 1 12 6104 1 1 30 TRP NE1 N -6.058 -3.011 -1.846 1.00 . A A . 30 TRP NE1 1 1 12 6105 1 1 30 TRP O O -2.273 -3.788 -0.295 1.00 . A A . 30 TRP O 1 1 12 6106 1 1 31 CYS C C -2.679 -0.153 -1.677 1.00 . A A . 31 CYS C 1 1 12 6107 1 1 31 CYS CA C -1.762 -1.244 -1.115 1.00 . A A . 31 CYS CA 1 1 12 6108 1 1 31 CYS CB C -0.301 -0.790 -1.158 1.00 . A A . 31 CYS CB 1 1 12 6109 1 1 31 CYS H H -1.663 -2.361 -2.955 1.00 . A A . 31 CYS H 1 1 12 6110 1 1 31 CYS HA H -2.044 -1.494 -0.105 1.00 . A A . 31 CYS HA 1 1 12 6111 1 1 31 CYS HB2 H 0.347 -1.650 -1.070 1.00 . A A . 31 CYS HB2 1 1 12 6112 1 1 31 CYS HB3 H -0.106 -0.288 -2.095 1.00 . A A . 31 CYS HB3 1 1 12 6113 1 1 31 CYS N N -1.819 -2.452 -1.991 1.00 . A A . 31 CYS N 1 1 12 6114 1 1 31 CYS O O -2.627 0.166 -2.851 1.00 . A A . 31 CYS O 1 1 12 6115 1 1 31 CYS SG S 0.025 0.346 0.210 1.00 . A A . 31 CYS SG 1 1 12 6116 1 1 32 ALA C C -4.765 2.480 -0.221 1.00 . A A . 32 ALA C 1 1 12 6117 1 1 32 ALA CA C -4.446 1.484 -1.339 1.00 . A A . 32 ALA CA 1 1 12 6118 1 1 32 ALA CB C -5.713 0.741 -1.771 1.00 . A A . 32 ALA CB 1 1 12 6119 1 1 32 ALA H H -3.545 0.138 0.090 1.00 . A A . 32 ALA H 1 1 12 6120 1 1 32 ALA HA H -4.016 1.996 -2.185 1.00 . A A . 32 ALA HA 1 1 12 6121 1 1 32 ALA HB1 H -6.107 0.188 -0.931 1.00 . A A . 32 ALA HB1 1 1 12 6122 1 1 32 ALA HB2 H -5.473 0.057 -2.572 1.00 . A A . 32 ALA HB2 1 1 12 6123 1 1 32 ALA HB3 H -6.449 1.452 -2.112 1.00 . A A . 32 ALA HB3 1 1 12 6124 1 1 32 ALA N N -3.520 0.416 -0.850 1.00 . A A . 32 ALA N 1 1 12 6125 1 1 32 ALA O O -4.295 2.351 0.892 1.00 . A A . 32 ALA O 1 1 12 6126 1 1 33 VAL C C -6.860 3.862 1.567 1.00 . A A . 33 VAL C 1 1 12 6127 1 1 33 VAL CA C -5.922 4.487 0.526 1.00 . A A . 33 VAL CA 1 1 12 6128 1 1 33 VAL CB C -6.634 5.619 -0.227 1.00 . A A . 33 VAL CB 1 1 12 6129 1 1 33 VAL CG1 C -6.925 6.770 0.741 1.00 . A A . 33 VAL CG1 1 1 12 6130 1 1 33 VAL CG2 C -5.744 6.130 -1.367 1.00 . A A . 33 VAL CG2 1 1 12 6131 1 1 33 VAL H H -5.932 3.554 -1.422 1.00 . A A . 33 VAL H 1 1 12 6132 1 1 33 VAL HA H -5.031 4.865 1.003 1.00 . A A . 33 VAL HA 1 1 12 6133 1 1 33 VAL HB H -7.565 5.250 -0.632 1.00 . A A . 33 VAL HB 1 1 12 6134 1 1 33 VAL HG11 H -7.228 7.641 0.183 1.00 . A A . 33 VAL HG11 1 1 12 6135 1 1 33 VAL HG12 H -6.033 6.997 1.308 1.00 . A A . 33 VAL HG12 1 1 12 6136 1 1 33 VAL HG13 H -7.715 6.481 1.417 1.00 . A A . 33 VAL HG13 1 1 12 6137 1 1 33 VAL HG21 H -4.806 5.595 -1.360 1.00 . A A . 33 VAL HG21 1 1 12 6138 1 1 33 VAL HG22 H -5.557 7.185 -1.235 1.00 . A A . 33 VAL HG22 1 1 12 6139 1 1 33 VAL HG23 H -6.244 5.969 -2.310 1.00 . A A . 33 VAL HG23 1 1 12 6140 1 1 33 VAL N N -5.565 3.475 -0.514 1.00 . A A . 33 VAL N 1 1 12 6141 1 1 33 VAL O O -7.876 3.282 1.228 1.00 . A A . 33 VAL O 1 1 12 6142 1 1 34 GLU C C -8.462 4.399 4.359 1.00 . A A . 34 GLU C 1 1 12 6143 1 1 34 GLU CA C -7.396 3.389 3.898 1.00 . A A . 34 GLU CA 1 1 12 6144 1 1 34 GLU CB C -6.445 3.030 5.048 1.00 . A A . 34 GLU CB 1 1 12 6145 1 1 34 GLU CD C -6.158 4.431 7.106 1.00 . A A . 34 GLU CD 1 1 12 6146 1 1 34 GLU CG C -5.797 4.296 5.624 1.00 . A A . 34 GLU CG 1 1 12 6147 1 1 34 GLU H H -5.702 4.449 3.074 1.00 . A A . 34 GLU H 1 1 12 6148 1 1 34 GLU HA H -7.874 2.495 3.533 1.00 . A A . 34 GLU HA 1 1 12 6149 1 1 34 GLU HB2 H -7.001 2.526 5.827 1.00 . A A . 34 GLU HB2 1 1 12 6150 1 1 34 GLU HB3 H -5.672 2.372 4.680 1.00 . A A . 34 GLU HB3 1 1 12 6151 1 1 34 GLU HG2 H -4.724 4.228 5.519 1.00 . A A . 34 GLU HG2 1 1 12 6152 1 1 34 GLU HG3 H -6.156 5.163 5.088 1.00 . A A . 34 GLU HG3 1 1 12 6153 1 1 34 GLU N N -6.525 3.976 2.828 1.00 . A A . 34 GLU N 1 1 12 6154 1 1 34 GLU O O -9.443 4.027 4.973 1.00 . A A . 34 GLU O 1 1 12 6155 1 1 34 GLU OE1 O -7.313 4.694 7.395 1.00 . A A . 34 GLU OE1 1 1 12 6156 1 1 34 GLU OE2 O -5.271 4.267 7.927 1.00 . A A . 34 GLU OE2 1 1 12 6157 1 1 35 ALA C C -9.479 6.700 5.999 1.00 . A A . 35 ALA C 1 1 12 6158 1 1 35 ALA CA C -9.275 6.712 4.474 1.00 . A A . 35 ALA CA 1 1 12 6159 1 1 35 ALA CB C -10.570 6.345 3.740 1.00 . A A . 35 ALA CB 1 1 12 6160 1 1 35 ALA H H -7.479 5.942 3.565 1.00 . A A . 35 ALA H 1 1 12 6161 1 1 35 ALA HA H -8.942 7.688 4.154 1.00 . A A . 35 ALA HA 1 1 12 6162 1 1 35 ALA HB1 H -10.796 7.105 3.006 1.00 . A A . 35 ALA HB1 1 1 12 6163 1 1 35 ALA HB2 H -11.382 6.278 4.448 1.00 . A A . 35 ALA HB2 1 1 12 6164 1 1 35 ALA HB3 H -10.447 5.393 3.245 1.00 . A A . 35 ALA HB3 1 1 12 6165 1 1 35 ALA N N -8.277 5.671 4.062 1.00 . A A . 35 ALA N 1 1 12 6166 1 1 35 ALA O O -10.425 6.119 6.496 1.00 . A A . 35 ALA O 1 1 12 6167 1 1 36 PRO C C -9.818 8.318 8.617 1.00 . A A . 36 PRO C 1 1 12 6168 1 1 36 PRO CA C -8.653 7.419 8.176 1.00 . A A . 36 PRO CA 1 1 12 6169 1 1 36 PRO CB C -7.305 8.019 8.579 1.00 . A A . 36 PRO CB 1 1 12 6170 1 1 36 PRO CD C -7.408 8.079 6.171 1.00 . A A . 36 PRO CD 1 1 12 6171 1 1 36 PRO CG C -6.849 8.785 7.380 1.00 . A A . 36 PRO CG 1 1 12 6172 1 1 36 PRO HA H -8.757 6.432 8.596 1.00 . A A . 36 PRO HA 1 1 12 6173 1 1 36 PRO HB2 H -7.426 8.678 9.427 1.00 . A A . 36 PRO HB2 1 1 12 6174 1 1 36 PRO HB3 H -6.598 7.235 8.807 1.00 . A A . 36 PRO HB3 1 1 12 6175 1 1 36 PRO HD2 H -7.709 8.797 5.420 1.00 . A A . 36 PRO HD2 1 1 12 6176 1 1 36 PRO HD3 H -6.687 7.384 5.770 1.00 . A A . 36 PRO HD3 1 1 12 6177 1 1 36 PRO HG2 H -7.223 9.798 7.425 1.00 . A A . 36 PRO HG2 1 1 12 6178 1 1 36 PRO HG3 H -5.771 8.789 7.332 1.00 . A A . 36 PRO HG3 1 1 12 6179 1 1 36 PRO N N -8.576 7.351 6.693 1.00 . A A . 36 PRO N 1 1 12 6180 1 1 36 PRO O O -10.717 7.804 9.262 1.00 . A A . 36 PRO O 1 1 13 6181 1 1 1 ASP C C 13.279 9.945 -3.167 1.00 . A A . 1 ASP C 1 1 13 6182 1 1 1 ASP CA C 14.482 10.406 -2.331 1.00 . A A . 1 ASP CA 1 1 13 6183 1 1 1 ASP CB C 14.026 10.997 -0.987 1.00 . A A . 1 ASP CB 1 1 13 6184 1 1 1 ASP CG C 12.811 11.911 -1.196 1.00 . A A . 1 ASP CG 1 1 13 6185 1 1 1 ASP H1 H 15.605 11.169 -3.914 1.00 . A A . 1 ASP H1 1 1 13 6186 1 1 1 ASP H2 H 15.971 11.867 -2.411 1.00 . A A . 1 ASP H2 1 1 13 6187 1 1 1 ASP H3 H 14.541 12.293 -3.223 1.00 . A A . 1 ASP H3 1 1 13 6188 1 1 1 ASP HA H 15.152 9.580 -2.156 1.00 . A A . 1 ASP HA 1 1 13 6189 1 1 1 ASP HB2 H 13.759 10.194 -0.316 1.00 . A A . 1 ASP HB2 1 1 13 6190 1 1 1 ASP HB3 H 14.833 11.570 -0.557 1.00 . A A . 1 ASP HB3 1 1 13 6191 1 1 1 ASP N N 15.203 11.518 -3.021 1.00 . A A . 1 ASP N 1 1 13 6192 1 1 1 ASP O O 12.850 10.623 -4.082 1.00 . A A . 1 ASP O 1 1 13 6193 1 1 1 ASP OD1 O 13.015 13.073 -1.510 1.00 . A A . 1 ASP OD1 1 1 13 6194 1 1 1 ASP OD2 O 11.700 11.434 -1.035 1.00 . A A . 1 ASP OD2 1 1 13 6195 1 1 2 GLY C C 11.037 6.998 -2.988 1.00 . A A . 2 GLY C 1 1 13 6196 1 1 2 GLY CA C 11.558 8.288 -3.628 1.00 . A A . 2 GLY CA 1 1 13 6197 1 1 2 GLY H H 13.093 8.267 -2.113 1.00 . A A . 2 GLY H 1 1 13 6198 1 1 2 GLY HA2 H 10.778 9.034 -3.626 1.00 . A A . 2 GLY HA2 1 1 13 6199 1 1 2 GLY HA3 H 11.858 8.083 -4.644 1.00 . A A . 2 GLY HA3 1 1 13 6200 1 1 2 GLY N N 12.731 8.796 -2.855 1.00 . A A . 2 GLY N 1 1 13 6201 1 1 2 GLY O O 11.572 5.928 -3.208 1.00 . A A . 2 GLY O 1 1 13 6202 1 1 3 GLU C C 7.901 5.907 -1.581 1.00 . A A . 3 GLU C 1 1 13 6203 1 1 3 GLU CA C 9.432 5.872 -1.541 1.00 . A A . 3 GLU CA 1 1 13 6204 1 1 3 GLU CB C 9.950 5.915 -0.102 1.00 . A A . 3 GLU CB 1 1 13 6205 1 1 3 GLU CD C 11.731 4.981 1.380 1.00 . A A . 3 GLU CD 1 1 13 6206 1 1 3 GLU CG C 10.914 4.752 0.107 1.00 . A A . 3 GLU CG 1 1 13 6207 1 1 3 GLU H H 9.581 7.968 -2.037 1.00 . A A . 3 GLU H 1 1 13 6208 1 1 3 GLU HA H 9.795 4.984 -2.033 1.00 . A A . 3 GLU HA 1 1 13 6209 1 1 3 GLU HB2 H 10.464 6.850 0.070 1.00 . A A . 3 GLU HB2 1 1 13 6210 1 1 3 GLU HB3 H 9.123 5.823 0.586 1.00 . A A . 3 GLU HB3 1 1 13 6211 1 1 3 GLU HG2 H 10.351 3.835 0.195 1.00 . A A . 3 GLU HG2 1 1 13 6212 1 1 3 GLU HG3 H 11.580 4.685 -0.741 1.00 . A A . 3 GLU HG3 1 1 13 6213 1 1 3 GLU N N 9.995 7.093 -2.197 1.00 . A A . 3 GLU N 1 1 13 6214 1 1 3 GLU O O 7.240 6.129 -0.582 1.00 . A A . 3 GLU O 1 1 13 6215 1 1 3 GLU OE1 O 12.731 5.677 1.305 1.00 . A A . 3 GLU OE1 1 1 13 6216 1 1 3 GLU OE2 O 11.343 4.455 2.412 1.00 . A A . 3 GLU OE2 1 1 13 6217 1 1 4 CYS C C 5.404 4.779 -4.013 1.00 . A A . 4 CYS C 1 1 13 6218 1 1 4 CYS CA C 5.850 5.703 -2.875 1.00 . A A . 4 CYS CA 1 1 13 6219 1 1 4 CYS CB C 5.494 7.163 -3.181 1.00 . A A . 4 CYS CB 1 1 13 6220 1 1 4 CYS H H 7.902 5.509 -3.520 1.00 . A A . 4 CYS H 1 1 13 6221 1 1 4 CYS HA H 5.389 5.402 -1.948 1.00 . A A . 4 CYS HA 1 1 13 6222 1 1 4 CYS HB2 H 5.306 7.683 -2.255 1.00 . A A . 4 CYS HB2 1 1 13 6223 1 1 4 CYS HB3 H 6.319 7.631 -3.693 1.00 . A A . 4 CYS HB3 1 1 13 6224 1 1 4 CYS N N 7.340 5.687 -2.738 1.00 . A A . 4 CYS N 1 1 13 6225 1 1 4 CYS O O 6.149 4.497 -4.931 1.00 . A A . 4 CYS O 1 1 13 6226 1 1 4 CYS SG S 4.014 7.251 -4.223 1.00 . A A . 4 CYS SG 1 1 13 6227 1 1 5 GLY C C 2.542 4.166 -5.773 1.00 . A A . 5 GLY C 1 1 13 6228 1 1 5 GLY CA C 3.650 3.428 -5.019 1.00 . A A . 5 GLY CA 1 1 13 6229 1 1 5 GLY H H 3.605 4.576 -3.208 1.00 . A A . 5 GLY H 1 1 13 6230 1 1 5 GLY HA2 H 4.447 3.165 -5.700 1.00 . A A . 5 GLY HA2 1 1 13 6231 1 1 5 GLY HA3 H 3.245 2.533 -4.572 1.00 . A A . 5 GLY HA3 1 1 13 6232 1 1 5 GLY N N 4.181 4.320 -3.954 1.00 . A A . 5 GLY N 1 1 13 6233 1 1 5 GLY O O 2.803 5.072 -6.542 1.00 . A A . 5 GLY O 1 1 13 6234 1 1 6 GLY C C -1.093 4.362 -5.372 1.00 . A A . 6 GLY C 1 1 13 6235 1 1 6 GLY CA C 0.171 4.468 -6.238 1.00 . A A . 6 GLY CA 1 1 13 6236 1 1 6 GLY H H 1.131 3.060 -4.923 1.00 . A A . 6 GLY H 1 1 13 6237 1 1 6 GLY HA2 H 0.417 5.509 -6.396 1.00 . A A . 6 GLY HA2 1 1 13 6238 1 1 6 GLY HA3 H -0.007 3.995 -7.190 1.00 . A A . 6 GLY HA3 1 1 13 6239 1 1 6 GLY N N 1.309 3.789 -5.550 1.00 . A A . 6 GLY N 1 1 13 6240 1 1 6 GLY O O -1.020 4.104 -4.184 1.00 . A A . 6 GLY O 1 1 13 6241 1 1 7 PHE C C -3.982 3.005 -5.019 1.00 . A A . 7 PHE C 1 1 13 6242 1 1 7 PHE CA C -3.523 4.466 -5.169 1.00 . A A . 7 PHE CA 1 1 13 6243 1 1 7 PHE CB C -4.556 5.297 -5.952 1.00 . A A . 7 PHE CB 1 1 13 6244 1 1 7 PHE CD1 C -6.053 3.693 -7.206 1.00 . A A . 7 PHE CD1 1 1 13 6245 1 1 7 PHE CD2 C -4.276 4.812 -8.418 1.00 . A A . 7 PHE CD2 1 1 13 6246 1 1 7 PHE CE1 C -6.439 3.036 -8.381 1.00 . A A . 7 PHE CE1 1 1 13 6247 1 1 7 PHE CE2 C -4.663 4.155 -9.592 1.00 . A A . 7 PHE CE2 1 1 13 6248 1 1 7 PHE CG C -4.970 4.582 -7.223 1.00 . A A . 7 PHE CG 1 1 13 6249 1 1 7 PHE CZ C -5.744 3.268 -9.573 1.00 . A A . 7 PHE CZ 1 1 13 6250 1 1 7 PHE H H -2.280 4.760 -6.915 1.00 . A A . 7 PHE H 1 1 13 6251 1 1 7 PHE HA H -3.380 4.901 -4.192 1.00 . A A . 7 PHE HA 1 1 13 6252 1 1 7 PHE HB2 H -5.427 5.456 -5.335 1.00 . A A . 7 PHE HB2 1 1 13 6253 1 1 7 PHE HB3 H -4.124 6.253 -6.208 1.00 . A A . 7 PHE HB3 1 1 13 6254 1 1 7 PHE HD1 H -6.591 3.514 -6.287 1.00 . A A . 7 PHE HD1 1 1 13 6255 1 1 7 PHE HD2 H -3.440 5.497 -8.432 1.00 . A A . 7 PHE HD2 1 1 13 6256 1 1 7 PHE HE1 H -7.273 2.350 -8.367 1.00 . A A . 7 PHE HE1 1 1 13 6257 1 1 7 PHE HE2 H -4.126 4.335 -10.512 1.00 . A A . 7 PHE HE2 1 1 13 6258 1 1 7 PHE HZ H -6.042 2.761 -10.479 1.00 . A A . 7 PHE HZ 1 1 13 6259 1 1 7 PHE N N -2.250 4.557 -5.958 1.00 . A A . 7 PHE N 1 1 13 6260 1 1 7 PHE O O -4.758 2.686 -4.141 1.00 . A A . 7 PHE O 1 1 13 6261 1 1 8 TRP C C -2.824 -0.207 -6.365 1.00 . A A . 8 TRP C 1 1 13 6262 1 1 8 TRP CA C -3.915 0.683 -5.759 1.00 . A A . 8 TRP CA 1 1 13 6263 1 1 8 TRP CB C -5.226 0.579 -6.550 1.00 . A A . 8 TRP CB 1 1 13 6264 1 1 8 TRP CD1 C -6.046 -1.424 -5.231 1.00 . A A . 8 TRP CD1 1 1 13 6265 1 1 8 TRP CD2 C -6.206 -1.723 -7.455 1.00 . A A . 8 TRP CD2 1 1 13 6266 1 1 8 TRP CE2 C -6.693 -2.906 -6.850 1.00 . A A . 8 TRP CE2 1 1 13 6267 1 1 8 TRP CE3 C -6.198 -1.650 -8.859 1.00 . A A . 8 TRP CE3 1 1 13 6268 1 1 8 TRP CG C -5.801 -0.798 -6.407 1.00 . A A . 8 TRP CG 1 1 13 6269 1 1 8 TRP CH2 C -7.139 -3.890 -9.008 1.00 . A A . 8 TRP CH2 1 1 13 6270 1 1 8 TRP CZ2 C -7.155 -3.979 -7.614 1.00 . A A . 8 TRP CZ2 1 1 13 6271 1 1 8 TRP CZ3 C -6.662 -2.728 -9.630 1.00 . A A . 8 TRP CZ3 1 1 13 6272 1 1 8 TRP H H -2.881 2.396 -6.564 1.00 . A A . 8 TRP H 1 1 13 6273 1 1 8 TRP HA H -4.086 0.417 -4.728 1.00 . A A . 8 TRP HA 1 1 13 6274 1 1 8 TRP HB2 H -5.931 1.302 -6.171 1.00 . A A . 8 TRP HB2 1 1 13 6275 1 1 8 TRP HB3 H -5.032 0.779 -7.593 1.00 . A A . 8 TRP HB3 1 1 13 6276 1 1 8 TRP HD1 H -5.860 -1.014 -4.249 1.00 . A A . 8 TRP HD1 1 1 13 6277 1 1 8 TRP HE1 H -6.839 -3.331 -4.816 1.00 . A A . 8 TRP HE1 1 1 13 6278 1 1 8 TRP HE3 H -5.832 -0.759 -9.348 1.00 . A A . 8 TRP HE3 1 1 13 6279 1 1 8 TRP HH2 H -7.496 -4.715 -9.606 1.00 . A A . 8 TRP HH2 1 1 13 6280 1 1 8 TRP HZ2 H -7.522 -4.872 -7.129 1.00 . A A . 8 TRP HZ2 1 1 13 6281 1 1 8 TRP HZ3 H -6.652 -2.662 -10.707 1.00 . A A . 8 TRP HZ3 1 1 13 6282 1 1 8 TRP N N -3.508 2.120 -5.864 1.00 . A A . 8 TRP N 1 1 13 6283 1 1 8 TRP NE1 N -6.575 -2.675 -5.495 1.00 . A A . 8 TRP NE1 1 1 13 6284 1 1 8 TRP O O -2.979 -0.760 -7.440 1.00 . A A . 8 TRP O 1 1 13 6285 1 1 9 TRP C C -0.534 -2.512 -5.449 1.00 . A A . 9 TRP C 1 1 13 6286 1 1 9 TRP CA C -0.592 -1.181 -6.206 1.00 . A A . 9 TRP CA 1 1 13 6287 1 1 9 TRP CB C 0.679 -0.359 -5.948 1.00 . A A . 9 TRP CB 1 1 13 6288 1 1 9 TRP CD1 C -0.217 1.331 -7.618 1.00 . A A . 9 TRP CD1 1 1 13 6289 1 1 9 TRP CD2 C 2.025 1.358 -7.466 1.00 . A A . 9 TRP CD2 1 1 13 6290 1 1 9 TRP CE2 C 1.666 2.345 -8.414 1.00 . A A . 9 TRP CE2 1 1 13 6291 1 1 9 TRP CE3 C 3.392 1.175 -7.187 1.00 . A A . 9 TRP CE3 1 1 13 6292 1 1 9 TRP CG C 0.810 0.729 -6.971 1.00 . A A . 9 TRP CG 1 1 13 6293 1 1 9 TRP CH2 C 3.977 2.927 -8.771 1.00 . A A . 9 TRP CH2 1 1 13 6294 1 1 9 TRP CZ2 C 2.625 3.121 -9.060 1.00 . A A . 9 TRP CZ2 1 1 13 6295 1 1 9 TRP CZ3 C 4.360 1.955 -7.838 1.00 . A A . 9 TRP CZ3 1 1 13 6296 1 1 9 TRP H H -1.614 0.124 -4.822 1.00 . A A . 9 TRP H 1 1 13 6297 1 1 9 TRP HA H -0.711 -1.353 -7.265 1.00 . A A . 9 TRP HA 1 1 13 6298 1 1 9 TRP HB2 H 0.624 0.085 -4.963 1.00 . A A . 9 TRP HB2 1 1 13 6299 1 1 9 TRP HB3 H 1.542 -1.004 -6.000 1.00 . A A . 9 TRP HB3 1 1 13 6300 1 1 9 TRP HD1 H -1.264 1.101 -7.490 1.00 . A A . 9 TRP HD1 1 1 13 6301 1 1 9 TRP HE1 H -0.241 2.865 -9.057 1.00 . A A . 9 TRP HE1 1 1 13 6302 1 1 9 TRP HE3 H 3.697 0.427 -6.469 1.00 . A A . 9 TRP HE3 1 1 13 6303 1 1 9 TRP HH2 H 4.726 3.525 -9.269 1.00 . A A . 9 TRP HH2 1 1 13 6304 1 1 9 TRP HZ2 H 2.321 3.871 -9.770 1.00 . A A . 9 TRP HZ2 1 1 13 6305 1 1 9 TRP HZ3 H 5.406 1.809 -7.615 1.00 . A A . 9 TRP HZ3 1 1 13 6306 1 1 9 TRP N N -1.713 -0.338 -5.682 1.00 . A A . 9 TRP N 1 1 13 6307 1 1 9 TRP NE1 N 0.291 2.287 -8.475 1.00 . A A . 9 TRP NE1 1 1 13 6308 1 1 9 TRP O O -1.192 -2.689 -4.445 1.00 . A A . 9 TRP O 1 1 13 6309 1 1 10 LYS C C 1.474 -4.761 -4.202 1.00 . A A . 10 LYS C 1 1 13 6310 1 1 10 LYS CA C 0.339 -4.772 -5.225 1.00 . A A . 10 LYS CA 1 1 13 6311 1 1 10 LYS CB C 0.644 -5.794 -6.320 1.00 . A A . 10 LYS CB 1 1 13 6312 1 1 10 LYS CD C -0.634 -6.596 -8.313 1.00 . A A . 10 LYS CD 1 1 13 6313 1 1 10 LYS CE C -1.810 -7.468 -8.766 1.00 . A A . 10 LYS CE 1 1 13 6314 1 1 10 LYS CG C -0.657 -6.448 -6.788 1.00 . A A . 10 LYS CG 1 1 13 6315 1 1 10 LYS H H 0.769 -3.288 -6.737 1.00 . A A . 10 LYS H 1 1 13 6316 1 1 10 LYS HA H -0.597 -5.012 -4.747 1.00 . A A . 10 LYS HA 1 1 13 6317 1 1 10 LYS HB2 H 1.124 -5.299 -7.150 1.00 . A A . 10 LYS HB2 1 1 13 6318 1 1 10 LYS HB3 H 1.305 -6.553 -5.925 1.00 . A A . 10 LYS HB3 1 1 13 6319 1 1 10 LYS HD2 H -0.712 -5.619 -8.769 1.00 . A A . 10 LYS HD2 1 1 13 6320 1 1 10 LYS HD3 H 0.293 -7.060 -8.616 1.00 . A A . 10 LYS HD3 1 1 13 6321 1 1 10 LYS HE2 H -1.631 -7.843 -9.765 1.00 . A A . 10 LYS HE2 1 1 13 6322 1 1 10 LYS HE3 H -1.958 -8.286 -8.079 1.00 . A A . 10 LYS HE3 1 1 13 6323 1 1 10 LYS HG2 H -0.751 -7.423 -6.332 1.00 . A A . 10 LYS HG2 1 1 13 6324 1 1 10 LYS HG3 H -1.494 -5.833 -6.501 1.00 . A A . 10 LYS HG3 1 1 13 6325 1 1 10 LYS HZ1 H -2.784 -5.698 -9.283 1.00 . A A . 10 LYS HZ1 1 1 13 6326 1 1 10 LYS HZ2 H -3.236 -6.323 -7.769 1.00 . A A . 10 LYS HZ2 1 1 13 6327 1 1 10 LYS HZ3 H -3.804 -7.049 -9.195 1.00 . A A . 10 LYS HZ3 1 1 13 6328 1 1 10 LYS N N 0.246 -3.451 -5.923 1.00 . A A . 10 LYS N 1 1 13 6329 1 1 10 LYS NZ N -2.997 -6.566 -8.752 1.00 . A A . 10 LYS NZ 1 1 13 6330 1 1 10 LYS O O 2.563 -4.286 -4.475 1.00 . A A . 10 LYS O 1 1 13 6331 1 1 11 CYS C C 2.118 -6.545 -1.077 1.00 . A A . 11 CYS C 1 1 13 6332 1 1 11 CYS CA C 2.307 -5.333 -1.999 1.00 . A A . 11 CYS CA 1 1 13 6333 1 1 11 CYS CB C 2.169 -4.022 -1.214 1.00 . A A . 11 CYS CB 1 1 13 6334 1 1 11 CYS H H 0.355 -5.683 -2.842 1.00 . A A . 11 CYS H 1 1 13 6335 1 1 11 CYS HA H 3.272 -5.376 -2.477 1.00 . A A . 11 CYS HA 1 1 13 6336 1 1 11 CYS HB2 H 2.965 -3.953 -0.491 1.00 . A A . 11 CYS HB2 1 1 13 6337 1 1 11 CYS HB3 H 2.231 -3.188 -1.898 1.00 . A A . 11 CYS HB3 1 1 13 6338 1 1 11 CYS N N 1.236 -5.295 -3.034 1.00 . A A . 11 CYS N 1 1 13 6339 1 1 11 CYS O O 1.026 -7.067 -0.940 1.00 . A A . 11 CYS O 1 1 13 6340 1 1 11 CYS SG S 0.577 -3.980 -0.358 1.00 . A A . 11 CYS SG 1 1 13 6341 1 1 12 GLY C C 2.718 -7.673 1.883 1.00 . A A . 12 GLY C 1 1 13 6342 1 1 12 GLY CA C 3.061 -8.164 0.475 1.00 . A A . 12 GLY CA 1 1 13 6343 1 1 12 GLY H H 4.042 -6.551 -0.567 1.00 . A A . 12 GLY H 1 1 13 6344 1 1 12 GLY HA2 H 2.282 -8.825 0.122 1.00 . A A . 12 GLY HA2 1 1 13 6345 1 1 12 GLY HA3 H 4.002 -8.694 0.500 1.00 . A A . 12 GLY HA3 1 1 13 6346 1 1 12 GLY N N 3.174 -6.990 -0.442 1.00 . A A . 12 GLY N 1 1 13 6347 1 1 12 GLY O O 1.682 -7.073 2.102 1.00 . A A . 12 GLY O 1 1 13 6348 1 1 13 ARG C C 3.895 -6.042 4.437 1.00 . A A . 13 ARG C 1 1 13 6349 1 1 13 ARG CA C 3.314 -7.450 4.233 1.00 . A A . 13 ARG CA 1 1 13 6350 1 1 13 ARG CB C 4.018 -8.472 5.134 1.00 . A A . 13 ARG CB 1 1 13 6351 1 1 13 ARG CD C 2.636 -9.742 6.789 1.00 . A A . 13 ARG CD 1 1 13 6352 1 1 13 ARG CG C 3.397 -8.439 6.534 1.00 . A A . 13 ARG CG 1 1 13 6353 1 1 13 ARG CZ C 2.940 -10.964 8.861 1.00 . A A . 13 ARG CZ 1 1 13 6354 1 1 13 ARG H H 4.414 -8.393 2.632 1.00 . A A . 13 ARG H 1 1 13 6355 1 1 13 ARG HA H 2.252 -7.449 4.431 1.00 . A A . 13 ARG HA 1 1 13 6356 1 1 13 ARG HB2 H 3.903 -9.461 4.712 1.00 . A A . 13 ARG HB2 1 1 13 6357 1 1 13 ARG HB3 H 5.067 -8.230 5.200 1.00 . A A . 13 ARG HB3 1 1 13 6358 1 1 13 ARG HD2 H 1.644 -9.685 6.362 1.00 . A A . 13 ARG HD2 1 1 13 6359 1 1 13 ARG HD3 H 3.175 -10.581 6.378 1.00 . A A . 13 ARG HD3 1 1 13 6360 1 1 13 ARG HE H 2.217 -9.115 8.808 1.00 . A A . 13 ARG HE 1 1 13 6361 1 1 13 ARG HG2 H 4.181 -8.328 7.270 1.00 . A A . 13 ARG HG2 1 1 13 6362 1 1 13 ARG HG3 H 2.715 -7.605 6.607 1.00 . A A . 13 ARG HG3 1 1 13 6363 1 1 13 ARG HH11 H 4.877 -10.716 8.405 1.00 . A A . 13 ARG HH11 1 1 13 6364 1 1 13 ARG HH12 H 4.499 -12.145 9.307 1.00 . A A . 13 ARG HH12 1 1 13 6365 1 1 13 ARG HH21 H 1.093 -11.472 9.453 1.00 . A A . 13 ARG HH21 1 1 13 6366 1 1 13 ARG HH22 H 2.351 -12.574 9.901 1.00 . A A . 13 ARG HH22 1 1 13 6367 1 1 13 ARG N N 3.582 -7.914 2.837 1.00 . A A . 13 ARG N 1 1 13 6368 1 1 13 ARG NE N 2.557 -9.862 8.272 1.00 . A A . 13 ARG NE 1 1 13 6369 1 1 13 ARG NH1 N 4.205 -11.302 8.857 1.00 . A A . 13 ARG NH1 1 1 13 6370 1 1 13 ARG NH2 N 2.059 -11.730 9.450 1.00 . A A . 13 ARG NH2 1 1 13 6371 1 1 13 ARG O O 4.622 -5.788 5.381 1.00 . A A . 13 ARG O 1 1 13 6372 1 1 14 GLY C C 5.554 -3.690 3.157 1.00 . A A . 14 GLY C 1 1 13 6373 1 1 14 GLY CA C 4.114 -3.738 3.674 1.00 . A A . 14 GLY CA 1 1 13 6374 1 1 14 GLY H H 3.000 -5.357 2.799 1.00 . A A . 14 GLY H 1 1 13 6375 1 1 14 GLY HA2 H 3.497 -3.066 3.094 1.00 . A A . 14 GLY HA2 1 1 13 6376 1 1 14 GLY HA3 H 4.097 -3.436 4.711 1.00 . A A . 14 GLY HA3 1 1 13 6377 1 1 14 GLY N N 3.582 -5.128 3.552 1.00 . A A . 14 GLY N 1 1 13 6378 1 1 14 GLY O O 6.395 -3.005 3.709 1.00 . A A . 14 GLY O 1 1 13 6379 1 1 15 LYS C C 7.502 -3.132 0.739 1.00 . A A . 15 LYS C 1 1 13 6380 1 1 15 LYS CA C 7.239 -4.413 1.549 1.00 . A A . 15 LYS CA 1 1 13 6381 1 1 15 LYS CB C 7.329 -5.661 0.661 1.00 . A A . 15 LYS CB 1 1 13 6382 1 1 15 LYS CD C 9.571 -6.770 0.728 1.00 . A A . 15 LYS CD 1 1 13 6383 1 1 15 LYS CE C 10.618 -6.342 1.761 1.00 . A A . 15 LYS CE 1 1 13 6384 1 1 15 LYS CG C 8.177 -6.728 1.359 1.00 . A A . 15 LYS CG 1 1 13 6385 1 1 15 LYS H H 5.152 -4.960 1.674 1.00 . A A . 15 LYS H 1 1 13 6386 1 1 15 LYS HA H 7.948 -4.490 2.350 1.00 . A A . 15 LYS HA 1 1 13 6387 1 1 15 LYS HB2 H 6.336 -6.049 0.483 1.00 . A A . 15 LYS HB2 1 1 13 6388 1 1 15 LYS HB3 H 7.787 -5.400 -0.281 1.00 . A A . 15 LYS HB3 1 1 13 6389 1 1 15 LYS HD2 H 9.783 -7.775 0.394 1.00 . A A . 15 LYS HD2 1 1 13 6390 1 1 15 LYS HD3 H 9.605 -6.097 -0.116 1.00 . A A . 15 LYS HD3 1 1 13 6391 1 1 15 LYS HE2 H 10.358 -5.379 2.182 1.00 . A A . 15 LYS HE2 1 1 13 6392 1 1 15 LYS HE3 H 10.703 -7.082 2.540 1.00 . A A . 15 LYS HE3 1 1 13 6393 1 1 15 LYS HG2 H 8.263 -6.489 2.411 1.00 . A A . 15 LYS HG2 1 1 13 6394 1 1 15 LYS HG3 H 7.706 -7.693 1.248 1.00 . A A . 15 LYS HG3 1 1 13 6395 1 1 15 LYS HZ1 H 12.096 -7.158 0.540 1.00 . A A . 15 LYS HZ1 1 1 13 6396 1 1 15 LYS HZ2 H 12.673 -6.018 1.657 1.00 . A A . 15 LYS HZ2 1 1 13 6397 1 1 15 LYS HZ3 H 11.822 -5.504 0.280 1.00 . A A . 15 LYS HZ3 1 1 13 6398 1 1 15 LYS N N 5.847 -4.414 2.101 1.00 . A A . 15 LYS N 1 1 13 6399 1 1 15 LYS NZ N 11.897 -6.249 1.002 1.00 . A A . 15 LYS NZ 1 1 13 6400 1 1 15 LYS O O 8.393 -2.372 1.072 1.00 . A A . 15 LYS O 1 1 13 6401 1 1 16 PRO C C 6.330 -0.482 -0.427 1.00 . A A . 16 PRO C 1 1 13 6402 1 1 16 PRO CA C 6.884 -1.721 -1.148 1.00 . A A . 16 PRO CA 1 1 13 6403 1 1 16 PRO CB C 6.055 -2.040 -2.389 1.00 . A A . 16 PRO CB 1 1 13 6404 1 1 16 PRO CD C 5.629 -3.786 -0.769 1.00 . A A . 16 PRO CD 1 1 13 6405 1 1 16 PRO CG C 5.036 -3.034 -1.932 1.00 . A A . 16 PRO CG 1 1 13 6406 1 1 16 PRO HA H 7.917 -1.581 -1.417 1.00 . A A . 16 PRO HA 1 1 13 6407 1 1 16 PRO HB2 H 5.574 -1.144 -2.759 1.00 . A A . 16 PRO HB2 1 1 13 6408 1 1 16 PRO HB3 H 6.677 -2.476 -3.154 1.00 . A A . 16 PRO HB3 1 1 13 6409 1 1 16 PRO HD2 H 4.892 -3.921 0.011 1.00 . A A . 16 PRO HD2 1 1 13 6410 1 1 16 PRO HD3 H 6.021 -4.737 -1.091 1.00 . A A . 16 PRO HD3 1 1 13 6411 1 1 16 PRO HG2 H 4.138 -2.517 -1.620 1.00 . A A . 16 PRO HG2 1 1 13 6412 1 1 16 PRO HG3 H 4.806 -3.721 -2.731 1.00 . A A . 16 PRO HG3 1 1 13 6413 1 1 16 PRO N N 6.720 -2.927 -0.298 1.00 . A A . 16 PRO N 1 1 13 6414 1 1 16 PRO O O 5.231 -0.513 0.096 1.00 . A A . 16 PRO O 1 1 13 6415 1 1 17 PRO C C 5.625 2.551 -0.592 1.00 . A A . 17 PRO C 1 1 13 6416 1 1 17 PRO CA C 6.689 1.829 0.244 1.00 . A A . 17 PRO CA 1 1 13 6417 1 1 17 PRO CB C 7.975 2.646 0.320 1.00 . A A . 17 PRO CB 1 1 13 6418 1 1 17 PRO CD C 8.448 0.691 -1.025 1.00 . A A . 17 PRO CD 1 1 13 6419 1 1 17 PRO CG C 8.836 2.128 -0.789 1.00 . A A . 17 PRO CG 1 1 13 6420 1 1 17 PRO HA H 6.322 1.627 1.238 1.00 . A A . 17 PRO HA 1 1 13 6421 1 1 17 PRO HB2 H 7.760 3.697 0.174 1.00 . A A . 17 PRO HB2 1 1 13 6422 1 1 17 PRO HB3 H 8.464 2.490 1.268 1.00 . A A . 17 PRO HB3 1 1 13 6423 1 1 17 PRO HD2 H 8.408 0.481 -2.084 1.00 . A A . 17 PRO HD2 1 1 13 6424 1 1 17 PRO HD3 H 9.140 0.026 -0.531 1.00 . A A . 17 PRO HD3 1 1 13 6425 1 1 17 PRO HG2 H 8.668 2.709 -1.686 1.00 . A A . 17 PRO HG2 1 1 13 6426 1 1 17 PRO HG3 H 9.874 2.180 -0.504 1.00 . A A . 17 PRO HG3 1 1 13 6427 1 1 17 PRO N N 7.113 0.572 -0.421 1.00 . A A . 17 PRO N 1 1 13 6428 1 1 17 PRO O O 5.862 2.923 -1.725 1.00 . A A . 17 PRO O 1 1 13 6429 1 1 18 CYS C C 3.449 4.966 -0.539 1.00 . A A . 18 CYS C 1 1 13 6430 1 1 18 CYS CA C 3.365 3.451 -0.782 1.00 . A A . 18 CYS CA 1 1 13 6431 1 1 18 CYS CB C 2.058 2.885 -0.214 1.00 . A A . 18 CYS CB 1 1 13 6432 1 1 18 CYS H H 4.295 2.439 0.879 1.00 . A A . 18 CYS H 1 1 13 6433 1 1 18 CYS HA H 3.433 3.233 -1.836 1.00 . A A . 18 CYS HA 1 1 13 6434 1 1 18 CYS HB2 H 2.265 2.334 0.691 1.00 . A A . 18 CYS HB2 1 1 13 6435 1 1 18 CYS HB3 H 1.379 3.697 0.007 1.00 . A A . 18 CYS HB3 1 1 13 6436 1 1 18 CYS N N 4.456 2.749 -0.035 1.00 . A A . 18 CYS N 1 1 13 6437 1 1 18 CYS O O 4.210 5.425 0.293 1.00 . A A . 18 CYS O 1 1 13 6438 1 1 18 CYS SG S 1.295 1.778 -1.428 1.00 . A A . 18 CYS SG 1 1 13 6439 1 1 19 CYS C C 2.140 7.599 0.302 1.00 . A A . 19 CYS C 1 1 13 6440 1 1 19 CYS CA C 2.714 7.226 -1.068 1.00 . A A . 19 CYS CA 1 1 13 6441 1 1 19 CYS CB C 1.844 7.801 -2.190 1.00 . A A . 19 CYS CB 1 1 13 6442 1 1 19 CYS H H 2.074 5.347 -1.924 1.00 . A A . 19 CYS H 1 1 13 6443 1 1 19 CYS HA H 3.725 7.591 -1.163 1.00 . A A . 19 CYS HA 1 1 13 6444 1 1 19 CYS HB2 H 1.336 6.999 -2.702 1.00 . A A . 19 CYS HB2 1 1 13 6445 1 1 19 CYS HB3 H 1.116 8.480 -1.770 1.00 . A A . 19 CYS HB3 1 1 13 6446 1 1 19 CYS N N 2.678 5.741 -1.258 1.00 . A A . 19 CYS N 1 1 13 6447 1 1 19 CYS O O 1.279 6.917 0.826 1.00 . A A . 19 CYS O 1 1 13 6448 1 1 19 CYS SG S 2.891 8.695 -3.366 1.00 . A A . 19 CYS SG 1 1 13 6449 1 1 20 LYS C C 0.588 9.217 2.212 1.00 . A A . 20 LYS C 1 1 13 6450 1 1 20 LYS CA C 2.118 9.101 2.226 1.00 . A A . 20 LYS CA 1 1 13 6451 1 1 20 LYS CB C 2.766 10.468 2.478 1.00 . A A . 20 LYS CB 1 1 13 6452 1 1 20 LYS CD C 3.759 10.798 4.754 1.00 . A A . 20 LYS CD 1 1 13 6453 1 1 20 LYS CE C 4.419 12.176 4.881 1.00 . A A . 20 LYS CE 1 1 13 6454 1 1 20 LYS CG C 2.483 10.916 3.916 1.00 . A A . 20 LYS CG 1 1 13 6455 1 1 20 LYS H H 3.318 9.194 0.443 1.00 . A A . 20 LYS H 1 1 13 6456 1 1 20 LYS HA H 2.436 8.403 2.978 1.00 . A A . 20 LYS HA 1 1 13 6457 1 1 20 LYS HB2 H 3.833 10.392 2.328 1.00 . A A . 20 LYS HB2 1 1 13 6458 1 1 20 LYS HB3 H 2.357 11.193 1.791 1.00 . A A . 20 LYS HB3 1 1 13 6459 1 1 20 LYS HD2 H 3.510 10.426 5.738 1.00 . A A . 20 LYS HD2 1 1 13 6460 1 1 20 LYS HD3 H 4.445 10.116 4.276 1.00 . A A . 20 LYS HD3 1 1 13 6461 1 1 20 LYS HE2 H 5.045 12.371 4.020 1.00 . A A . 20 LYS HE2 1 1 13 6462 1 1 20 LYS HE3 H 3.670 12.945 4.985 1.00 . A A . 20 LYS HE3 1 1 13 6463 1 1 20 LYS HG2 H 2.147 11.942 3.912 1.00 . A A . 20 LYS HG2 1 1 13 6464 1 1 20 LYS HG3 H 1.716 10.288 4.344 1.00 . A A . 20 LYS HG3 1 1 13 6465 1 1 20 LYS HZ1 H 5.895 11.290 6.059 1.00 . A A . 20 LYS HZ1 1 1 13 6466 1 1 20 LYS HZ2 H 4.624 11.985 6.947 1.00 . A A . 20 LYS HZ2 1 1 13 6467 1 1 20 LYS HZ3 H 5.798 12.976 6.223 1.00 . A A . 20 LYS HZ3 1 1 13 6468 1 1 20 LYS N N 2.620 8.672 0.886 1.00 . A A . 20 LYS N 1 1 13 6469 1 1 20 LYS NZ N 5.246 12.101 6.120 1.00 . A A . 20 LYS NZ 1 1 13 6470 1 1 20 LYS O O 0.027 10.104 1.595 1.00 . A A . 20 LYS O 1 1 13 6471 1 1 21 GLY C C -2.132 6.958 2.577 1.00 . A A . 21 GLY C 1 1 13 6472 1 1 21 GLY CA C -1.579 8.349 2.908 1.00 . A A . 21 GLY CA 1 1 13 6473 1 1 21 GLY H H 0.391 7.606 3.361 1.00 . A A . 21 GLY H 1 1 13 6474 1 1 21 GLY HA2 H -1.911 8.646 3.892 1.00 . A A . 21 GLY HA2 1 1 13 6475 1 1 21 GLY HA3 H -1.938 9.058 2.177 1.00 . A A . 21 GLY HA3 1 1 13 6476 1 1 21 GLY N N -0.086 8.314 2.880 1.00 . A A . 21 GLY N 1 1 13 6477 1 1 21 GLY O O -3.104 6.518 3.160 1.00 . A A . 21 GLY O 1 1 13 6478 1 1 22 TYR C C -1.301 3.838 2.123 1.00 . A A . 22 TYR C 1 1 13 6479 1 1 22 TYR CA C -2.012 4.900 1.273 1.00 . A A . 22 TYR CA 1 1 13 6480 1 1 22 TYR CB C -1.662 4.711 -0.213 1.00 . A A . 22 TYR CB 1 1 13 6481 1 1 22 TYR CD1 C -3.159 6.688 -0.738 1.00 . A A . 22 TYR CD1 1 1 13 6482 1 1 22 TYR CD2 C -1.131 6.380 -2.029 1.00 . A A . 22 TYR CD2 1 1 13 6483 1 1 22 TYR CE1 C -3.457 7.838 -1.481 1.00 . A A . 22 TYR CE1 1 1 13 6484 1 1 22 TYR CE2 C -1.429 7.529 -2.772 1.00 . A A . 22 TYR CE2 1 1 13 6485 1 1 22 TYR CG C -1.994 5.957 -1.013 1.00 . A A . 22 TYR CG 1 1 13 6486 1 1 22 TYR CZ C -2.590 8.258 -2.497 1.00 . A A . 22 TYR CZ 1 1 13 6487 1 1 22 TYR H H -0.740 6.643 1.187 1.00 . A A . 22 TYR H 1 1 13 6488 1 1 22 TYR HA H -3.080 4.836 1.409 1.00 . A A . 22 TYR HA 1 1 13 6489 1 1 22 TYR HB2 H -0.606 4.504 -0.306 1.00 . A A . 22 TYR HB2 1 1 13 6490 1 1 22 TYR HB3 H -2.222 3.877 -0.608 1.00 . A A . 22 TYR HB3 1 1 13 6491 1 1 22 TYR HD1 H -3.828 6.365 0.046 1.00 . A A . 22 TYR HD1 1 1 13 6492 1 1 22 TYR HD2 H -0.234 5.817 -2.242 1.00 . A A . 22 TYR HD2 1 1 13 6493 1 1 22 TYR HE1 H -4.354 8.400 -1.269 1.00 . A A . 22 TYR HE1 1 1 13 6494 1 1 22 TYR HE2 H -0.761 7.853 -3.556 1.00 . A A . 22 TYR HE2 1 1 13 6495 1 1 22 TYR HH H -3.200 9.115 -4.092 1.00 . A A . 22 TYR HH 1 1 13 6496 1 1 22 TYR N N -1.522 6.265 1.644 1.00 . A A . 22 TYR N 1 1 13 6497 1 1 22 TYR O O -0.122 3.946 2.405 1.00 . A A . 22 TYR O 1 1 13 6498 1 1 22 TYR OH O -2.884 9.392 -3.228 1.00 . A A . 22 TYR OH 1 1 13 6499 1 1 23 ALA C C -1.462 0.393 2.620 1.00 . A A . 23 ALA C 1 1 13 6500 1 1 23 ALA CA C -1.389 1.736 3.356 1.00 . A A . 23 ALA CA 1 1 13 6501 1 1 23 ALA CB C -2.222 1.689 4.639 1.00 . A A . 23 ALA CB 1 1 13 6502 1 1 23 ALA H H -2.959 2.750 2.281 1.00 . A A . 23 ALA H 1 1 13 6503 1 1 23 ALA HA H -0.366 1.983 3.590 1.00 . A A . 23 ALA HA 1 1 13 6504 1 1 23 ALA HB1 H -1.626 1.275 5.439 1.00 . A A . 23 ALA HB1 1 1 13 6505 1 1 23 ALA HB2 H -3.092 1.071 4.482 1.00 . A A . 23 ALA HB2 1 1 13 6506 1 1 23 ALA HB3 H -2.533 2.690 4.905 1.00 . A A . 23 ALA HB3 1 1 13 6507 1 1 23 ALA N N -2.012 2.814 2.528 1.00 . A A . 23 ALA N 1 1 13 6508 1 1 23 ALA O O -2.361 0.154 1.836 1.00 . A A . 23 ALA O 1 1 13 6509 1 1 24 CYS C C -1.334 -2.827 3.004 1.00 . A A . 24 CYS C 1 1 13 6510 1 1 24 CYS CA C -0.532 -1.814 2.182 1.00 . A A . 24 CYS CA 1 1 13 6511 1 1 24 CYS CB C 0.941 -2.229 2.093 1.00 . A A . 24 CYS CB 1 1 13 6512 1 1 24 CYS H H 0.193 -0.269 3.505 1.00 . A A . 24 CYS H 1 1 13 6513 1 1 24 CYS HA H -0.948 -1.720 1.193 1.00 . A A . 24 CYS HA 1 1 13 6514 1 1 24 CYS HB2 H 1.441 -1.614 1.361 1.00 . A A . 24 CYS HB2 1 1 13 6515 1 1 24 CYS HB3 H 1.409 -2.094 3.056 1.00 . A A . 24 CYS HB3 1 1 13 6516 1 1 24 CYS N N -0.521 -0.484 2.868 1.00 . A A . 24 CYS N 1 1 13 6517 1 1 24 CYS O O -1.567 -2.642 4.184 1.00 . A A . 24 CYS O 1 1 13 6518 1 1 24 CYS SG S 1.070 -3.969 1.601 1.00 . A A . 24 CYS SG 1 1 13 6519 1 1 25 SER C C -2.071 -6.334 2.771 1.00 . A A . 25 SER C 1 1 13 6520 1 1 25 SER CA C -2.561 -4.923 3.108 1.00 . A A . 25 SER CA 1 1 13 6521 1 1 25 SER CB C -3.999 -4.725 2.626 1.00 . A A . 25 SER CB 1 1 13 6522 1 1 25 SER H H -1.565 -4.013 1.428 1.00 . A A . 25 SER H 1 1 13 6523 1 1 25 SER HA H -2.509 -4.756 4.166 1.00 . A A . 25 SER HA 1 1 13 6524 1 1 25 SER HB2 H -4.019 -4.693 1.549 1.00 . A A . 25 SER HB2 1 1 13 6525 1 1 25 SER HB3 H -4.608 -5.549 2.971 1.00 . A A . 25 SER HB3 1 1 13 6526 1 1 25 SER HG H -4.993 -3.691 3.942 1.00 . A A . 25 SER HG 1 1 13 6527 1 1 25 SER N N -1.764 -3.893 2.380 1.00 . A A . 25 SER N 1 1 13 6528 1 1 25 SER O O -2.335 -6.852 1.703 1.00 . A A . 25 SER O 1 1 13 6529 1 1 25 SER OG O -4.501 -3.498 3.140 1.00 . A A . 25 SER OG 1 1 13 6530 1 1 26 LYS C C -2.058 -9.323 3.324 1.00 . A A . 26 LYS C 1 1 13 6531 1 1 26 LYS CA C -0.872 -8.350 3.423 1.00 . A A . 26 LYS CA 1 1 13 6532 1 1 26 LYS CB C 0.042 -8.687 4.616 1.00 . A A . 26 LYS CB 1 1 13 6533 1 1 26 LYS CD C -1.206 -8.005 6.685 1.00 . A A . 26 LYS CD 1 1 13 6534 1 1 26 LYS CE C -1.918 -8.517 7.940 1.00 . A A . 26 LYS CE 1 1 13 6535 1 1 26 LYS CG C -0.767 -9.191 5.821 1.00 . A A . 26 LYS CG 1 1 13 6536 1 1 26 LYS H H -1.171 -6.524 4.535 1.00 . A A . 26 LYS H 1 1 13 6537 1 1 26 LYS HA H -0.300 -8.374 2.509 1.00 . A A . 26 LYS HA 1 1 13 6538 1 1 26 LYS HB2 H 0.742 -9.450 4.319 1.00 . A A . 26 LYS HB2 1 1 13 6539 1 1 26 LYS HB3 H 0.584 -7.798 4.903 1.00 . A A . 26 LYS HB3 1 1 13 6540 1 1 26 LYS HD2 H -0.339 -7.428 6.971 1.00 . A A . 26 LYS HD2 1 1 13 6541 1 1 26 LYS HD3 H -1.884 -7.381 6.121 1.00 . A A . 26 LYS HD3 1 1 13 6542 1 1 26 LYS HE2 H -2.563 -7.749 8.343 1.00 . A A . 26 LYS HE2 1 1 13 6543 1 1 26 LYS HE3 H -2.487 -9.406 7.715 1.00 . A A . 26 LYS HE3 1 1 13 6544 1 1 26 LYS HG2 H -1.635 -9.731 5.480 1.00 . A A . 26 LYS HG2 1 1 13 6545 1 1 26 LYS HG3 H -0.150 -9.849 6.414 1.00 . A A . 26 LYS HG3 1 1 13 6546 1 1 26 LYS HZ1 H -0.230 -8.002 9.051 1.00 . A A . 26 LYS HZ1 1 1 13 6547 1 1 26 LYS HZ2 H -0.249 -9.619 8.529 1.00 . A A . 26 LYS HZ2 1 1 13 6548 1 1 26 LYS HZ3 H -1.244 -9.128 9.814 1.00 . A A . 26 LYS HZ3 1 1 13 6549 1 1 26 LYS N N -1.367 -6.962 3.680 1.00 . A A . 26 LYS N 1 1 13 6550 1 1 26 LYS NZ N -0.827 -8.841 8.906 1.00 . A A . 26 LYS NZ 1 1 13 6551 1 1 26 LYS O O -2.013 -10.300 2.600 1.00 . A A . 26 LYS O 1 1 13 6552 1 1 27 THR C C -4.983 -9.869 2.625 1.00 . A A . 27 THR C 1 1 13 6553 1 1 27 THR CA C -4.322 -9.938 4.006 1.00 . A A . 27 THR CA 1 1 13 6554 1 1 27 THR CB C -5.273 -9.389 5.081 1.00 . A A . 27 THR CB 1 1 13 6555 1 1 27 THR CG2 C -6.498 -10.299 5.201 1.00 . A A . 27 THR CG2 1 1 13 6556 1 1 27 THR H H -3.120 -8.252 4.616 1.00 . A A . 27 THR H 1 1 13 6557 1 1 27 THR HA H -4.047 -10.951 4.239 1.00 . A A . 27 THR HA 1 1 13 6558 1 1 27 THR HB H -5.596 -8.395 4.805 1.00 . A A . 27 THR HB 1 1 13 6559 1 1 27 THR HG1 H -4.744 -8.474 6.716 1.00 . A A . 27 THR HG1 1 1 13 6560 1 1 27 THR HG21 H -7.299 -9.761 5.686 1.00 . A A . 27 THR HG21 1 1 13 6561 1 1 27 THR HG22 H -6.244 -11.171 5.788 1.00 . A A . 27 THR HG22 1 1 13 6562 1 1 27 THR HG23 H -6.816 -10.609 4.217 1.00 . A A . 27 THR HG23 1 1 13 6563 1 1 27 THR N N -3.118 -9.049 4.047 1.00 . A A . 27 THR N 1 1 13 6564 1 1 27 THR O O -5.431 -10.867 2.092 1.00 . A A . 27 THR O 1 1 13 6565 1 1 27 THR OG1 O -4.596 -9.340 6.330 1.00 . A A . 27 THR OG1 1 1 13 6566 1 1 28 TRP C C -4.640 -8.820 -0.394 1.00 . A A . 28 TRP C 1 1 13 6567 1 1 28 TRP CA C -5.678 -8.551 0.700 1.00 . A A . 28 TRP CA 1 1 13 6568 1 1 28 TRP CB C -6.164 -7.098 0.632 1.00 . A A . 28 TRP CB 1 1 13 6569 1 1 28 TRP CD1 C -7.698 -7.714 2.560 1.00 . A A . 28 TRP CD1 1 1 13 6570 1 1 28 TRP CD2 C -7.479 -5.491 2.295 1.00 . A A . 28 TRP CD2 1 1 13 6571 1 1 28 TRP CE2 C -8.348 -5.686 3.393 1.00 . A A . 28 TRP CE2 1 1 13 6572 1 1 28 TRP CE3 C -7.174 -4.173 1.915 1.00 . A A . 28 TRP CE3 1 1 13 6573 1 1 28 TRP CG C -7.077 -6.794 1.783 1.00 . A A . 28 TRP CG 1 1 13 6574 1 1 28 TRP CH2 C -8.584 -3.306 3.699 1.00 . A A . 28 TRP CH2 1 1 13 6575 1 1 28 TRP CZ2 C -8.895 -4.610 4.090 1.00 . A A . 28 TRP CZ2 1 1 13 6576 1 1 28 TRP CZ3 C -7.724 -3.086 2.613 1.00 . A A . 28 TRP CZ3 1 1 13 6577 1 1 28 TRP H H -4.674 -7.912 2.503 1.00 . A A . 28 TRP H 1 1 13 6578 1 1 28 TRP HA H -6.513 -9.226 0.601 1.00 . A A . 28 TRP HA 1 1 13 6579 1 1 28 TRP HB2 H -5.315 -6.434 0.667 1.00 . A A . 28 TRP HB2 1 1 13 6580 1 1 28 TRP HB3 H -6.696 -6.944 -0.293 1.00 . A A . 28 TRP HB3 1 1 13 6581 1 1 28 TRP HD1 H -7.618 -8.785 2.454 1.00 . A A . 28 TRP HD1 1 1 13 6582 1 1 28 TRP HE1 H -8.989 -7.491 4.206 1.00 . A A . 28 TRP HE1 1 1 13 6583 1 1 28 TRP HE3 H -6.511 -3.995 1.080 1.00 . A A . 28 TRP HE3 1 1 13 6584 1 1 28 TRP HH2 H -9.004 -2.467 4.233 1.00 . A A . 28 TRP HH2 1 1 13 6585 1 1 28 TRP HZ2 H -9.558 -4.783 4.924 1.00 . A A . 28 TRP HZ2 1 1 13 6586 1 1 28 TRP HZ3 H -7.483 -2.077 2.313 1.00 . A A . 28 TRP HZ3 1 1 13 6587 1 1 28 TRP N N -5.045 -8.698 2.048 1.00 . A A . 28 TRP N 1 1 13 6588 1 1 28 TRP NE1 N -8.447 -7.056 3.518 1.00 . A A . 28 TRP NE1 1 1 13 6589 1 1 28 TRP O O -4.879 -9.579 -1.313 1.00 . A A . 28 TRP O 1 1 13 6590 1 1 29 GLY C C -2.139 -7.129 -2.092 1.00 . A A . 29 GLY C 1 1 13 6591 1 1 29 GLY CA C -2.419 -8.423 -1.310 1.00 . A A . 29 GLY CA 1 1 13 6592 1 1 29 GLY H H -3.320 -7.607 0.465 1.00 . A A . 29 GLY H 1 1 13 6593 1 1 29 GLY HA2 H -1.515 -8.742 -0.813 1.00 . A A . 29 GLY HA2 1 1 13 6594 1 1 29 GLY HA3 H -2.734 -9.192 -2.000 1.00 . A A . 29 GLY HA3 1 1 13 6595 1 1 29 GLY N N -3.486 -8.207 -0.291 1.00 . A A . 29 GLY N 1 1 13 6596 1 1 29 GLY O O -1.500 -7.164 -3.127 1.00 . A A . 29 GLY O 1 1 13 6597 1 1 30 TRP C C -2.271 -3.517 -1.404 1.00 . A A . 30 TRP C 1 1 13 6598 1 1 30 TRP CA C -2.321 -4.718 -2.361 1.00 . A A . 30 TRP CA 1 1 13 6599 1 1 30 TRP CB C -3.463 -4.584 -3.386 1.00 . A A . 30 TRP CB 1 1 13 6600 1 1 30 TRP CD1 C -4.965 -2.908 -2.235 1.00 . A A . 30 TRP CD1 1 1 13 6601 1 1 30 TRP CD2 C -5.943 -4.917 -2.483 1.00 . A A . 30 TRP CD2 1 1 13 6602 1 1 30 TRP CE2 C -6.882 -4.084 -1.828 1.00 . A A . 30 TRP CE2 1 1 13 6603 1 1 30 TRP CE3 C -6.316 -6.244 -2.763 1.00 . A A . 30 TRP CE3 1 1 13 6604 1 1 30 TRP CG C -4.731 -4.147 -2.723 1.00 . A A . 30 TRP CG 1 1 13 6605 1 1 30 TRP CH2 C -8.500 -5.870 -1.752 1.00 . A A . 30 TRP CH2 1 1 13 6606 1 1 30 TRP CZ2 C -8.144 -4.551 -1.466 1.00 . A A . 30 TRP CZ2 1 1 13 6607 1 1 30 TRP CZ3 C -7.586 -6.716 -2.399 1.00 . A A . 30 TRP CZ3 1 1 13 6608 1 1 30 TRP H H -3.100 -5.965 -0.773 1.00 . A A . 30 TRP H 1 1 13 6609 1 1 30 TRP HA H -1.380 -4.799 -2.883 1.00 . A A . 30 TRP HA 1 1 13 6610 1 1 30 TRP HB2 H -3.184 -3.855 -4.132 1.00 . A A . 30 TRP HB2 1 1 13 6611 1 1 30 TRP HB3 H -3.621 -5.539 -3.866 1.00 . A A . 30 TRP HB3 1 1 13 6612 1 1 30 TRP HD1 H -4.269 -2.083 -2.252 1.00 . A A . 30 TRP HD1 1 1 13 6613 1 1 30 TRP HE1 H -6.646 -2.092 -1.277 1.00 . A A . 30 TRP HE1 1 1 13 6614 1 1 30 TRP HE3 H -5.620 -6.903 -3.261 1.00 . A A . 30 TRP HE3 1 1 13 6615 1 1 30 TRP HH2 H -9.476 -6.239 -1.475 1.00 . A A . 30 TRP HH2 1 1 13 6616 1 1 30 TRP HZ2 H -8.844 -3.896 -0.967 1.00 . A A . 30 TRP HZ2 1 1 13 6617 1 1 30 TRP HZ3 H -7.864 -7.737 -2.620 1.00 . A A . 30 TRP HZ3 1 1 13 6618 1 1 30 TRP N N -2.594 -5.989 -1.616 1.00 . A A . 30 TRP N 1 1 13 6619 1 1 30 TRP NE1 N -6.236 -2.872 -1.698 1.00 . A A . 30 TRP NE1 1 1 13 6620 1 1 30 TRP O O -2.493 -3.646 -0.216 1.00 . A A . 30 TRP O 1 1 13 6621 1 1 31 CYS C C -2.835 -0.035 -1.638 1.00 . A A . 31 CYS C 1 1 13 6622 1 1 31 CYS CA C -1.920 -1.122 -1.072 1.00 . A A . 31 CYS CA 1 1 13 6623 1 1 31 CYS CB C -0.453 -0.673 -1.126 1.00 . A A . 31 CYS CB 1 1 13 6624 1 1 31 CYS H H -1.822 -2.276 -2.888 1.00 . A A . 31 CYS H 1 1 13 6625 1 1 31 CYS HA H -2.195 -1.354 -0.056 1.00 . A A . 31 CYS HA 1 1 13 6626 1 1 31 CYS HB2 H 0.151 -1.346 -0.538 1.00 . A A . 31 CYS HB2 1 1 13 6627 1 1 31 CYS HB3 H -0.112 -0.684 -2.150 1.00 . A A . 31 CYS HB3 1 1 13 6628 1 1 31 CYS N N -1.986 -2.347 -1.924 1.00 . A A . 31 CYS N 1 1 13 6629 1 1 31 CYS O O -2.793 0.275 -2.815 1.00 . A A . 31 CYS O 1 1 13 6630 1 1 31 CYS SG S -0.302 1.005 -0.461 1.00 . A A . 31 CYS SG 1 1 13 6631 1 1 32 ALA C C -4.822 2.647 -0.161 1.00 . A A . 32 ALA C 1 1 13 6632 1 1 32 ALA CA C -4.584 1.624 -1.278 1.00 . A A . 32 ALA CA 1 1 13 6633 1 1 32 ALA CB C -5.884 0.900 -1.638 1.00 . A A . 32 ALA CB 1 1 13 6634 1 1 32 ALA H H -3.666 0.279 0.139 1.00 . A A . 32 ALA H 1 1 13 6635 1 1 32 ALA HA H -4.179 2.111 -2.152 1.00 . A A . 32 ALA HA 1 1 13 6636 1 1 32 ALA HB1 H -5.713 -0.167 -1.646 1.00 . A A . 32 ALA HB1 1 1 13 6637 1 1 32 ALA HB2 H -6.213 1.217 -2.615 1.00 . A A . 32 ALA HB2 1 1 13 6638 1 1 32 ALA HB3 H -6.642 1.137 -0.909 1.00 . A A . 32 ALA HB3 1 1 13 6639 1 1 32 ALA N N -3.659 0.548 -0.804 1.00 . A A . 32 ALA N 1 1 13 6640 1 1 32 ALA O O -4.188 2.603 0.875 1.00 . A A . 32 ALA O 1 1 13 6641 1 1 33 VAL C C -6.784 3.963 1.851 1.00 . A A . 33 VAL C 1 1 13 6642 1 1 33 VAL CA C -6.009 4.597 0.690 1.00 . A A . 33 VAL CA 1 1 13 6643 1 1 33 VAL CB C -6.853 5.684 0.009 1.00 . A A . 33 VAL CB 1 1 13 6644 1 1 33 VAL CG1 C -6.920 6.913 0.918 1.00 . A A . 33 VAL CG1 1 1 13 6645 1 1 33 VAL CG2 C -6.217 6.085 -1.330 1.00 . A A . 33 VAL CG2 1 1 13 6646 1 1 33 VAL H H -6.232 3.583 -1.208 1.00 . A A . 33 VAL H 1 1 13 6647 1 1 33 VAL HA H -5.083 5.021 1.046 1.00 . A A . 33 VAL HA 1 1 13 6648 1 1 33 VAL HB H -7.852 5.310 -0.163 1.00 . A A . 33 VAL HB 1 1 13 6649 1 1 33 VAL HG11 H -5.938 7.357 0.995 1.00 . A A . 33 VAL HG11 1 1 13 6650 1 1 33 VAL HG12 H -7.259 6.617 1.900 1.00 . A A . 33 VAL HG12 1 1 13 6651 1 1 33 VAL HG13 H -7.608 7.633 0.502 1.00 . A A . 33 VAL HG13 1 1 13 6652 1 1 33 VAL HG21 H -6.839 5.739 -2.142 1.00 . A A . 33 VAL HG21 1 1 13 6653 1 1 33 VAL HG22 H -5.239 5.639 -1.412 1.00 . A A . 33 VAL HG22 1 1 13 6654 1 1 33 VAL HG23 H -6.128 7.160 -1.379 1.00 . A A . 33 VAL HG23 1 1 13 6655 1 1 33 VAL N N -5.732 3.568 -0.365 1.00 . A A . 33 VAL N 1 1 13 6656 1 1 33 VAL O O -7.850 3.406 1.667 1.00 . A A . 33 VAL O 1 1 13 6657 1 1 34 GLU C C -7.976 4.427 4.803 1.00 . A A . 34 GLU C 1 1 13 6658 1 1 34 GLU CA C -6.949 3.446 4.226 1.00 . A A . 34 GLU CA 1 1 13 6659 1 1 34 GLU CB C -5.841 3.168 5.247 1.00 . A A . 34 GLU CB 1 1 13 6660 1 1 34 GLU CD C -6.721 1.078 6.302 1.00 . A A . 34 GLU CD 1 1 13 6661 1 1 34 GLU CG C -5.638 1.657 5.388 1.00 . A A . 34 GLU CG 1 1 13 6662 1 1 34 GLU H H -5.390 4.497 3.165 1.00 . A A . 34 GLU H 1 1 13 6663 1 1 34 GLU HA H -7.430 2.521 3.947 1.00 . A A . 34 GLU HA 1 1 13 6664 1 1 34 GLU HB2 H -4.920 3.625 4.915 1.00 . A A . 34 GLU HB2 1 1 13 6665 1 1 34 GLU HB3 H -6.122 3.581 6.205 1.00 . A A . 34 GLU HB3 1 1 13 6666 1 1 34 GLU HG2 H -5.702 1.194 4.415 1.00 . A A . 34 GLU HG2 1 1 13 6667 1 1 34 GLU HG3 H -4.666 1.462 5.817 1.00 . A A . 34 GLU HG3 1 1 13 6668 1 1 34 GLU N N -6.251 4.044 3.045 1.00 . A A . 34 GLU N 1 1 13 6669 1 1 34 GLU O O -7.993 5.597 4.463 1.00 . A A . 34 GLU O 1 1 13 6670 1 1 34 GLU OE1 O -6.507 1.059 7.503 1.00 . A A . 34 GLU OE1 1 1 13 6671 1 1 34 GLU OE2 O -7.747 0.666 5.786 1.00 . A A . 34 GLU OE2 1 1 13 6672 1 1 35 ALA C C -9.590 5.038 7.779 1.00 . A A . 35 ALA C 1 1 13 6673 1 1 35 ALA CA C -9.868 4.848 6.281 1.00 . A A . 35 ALA CA 1 1 13 6674 1 1 35 ALA CB C -11.196 4.120 6.070 1.00 . A A . 35 ALA CB 1 1 13 6675 1 1 35 ALA H H -8.798 3.008 5.930 1.00 . A A . 35 ALA H 1 1 13 6676 1 1 35 ALA HA H -9.886 5.800 5.775 1.00 . A A . 35 ALA HA 1 1 13 6677 1 1 35 ALA HB1 H -11.112 3.105 6.432 1.00 . A A . 35 ALA HB1 1 1 13 6678 1 1 35 ALA HB2 H -11.437 4.108 5.018 1.00 . A A . 35 ALA HB2 1 1 13 6679 1 1 35 ALA HB3 H -11.977 4.633 6.613 1.00 . A A . 35 ALA HB3 1 1 13 6680 1 1 35 ALA N N -8.835 3.954 5.674 1.00 . A A . 35 ALA N 1 1 13 6681 1 1 35 ALA O O -9.393 4.075 8.497 1.00 . A A . 35 ALA O 1 1 13 6682 1 1 36 PRO C C -10.542 6.210 10.499 1.00 . A A . 36 PRO C 1 1 13 6683 1 1 36 PRO CA C -9.334 6.599 9.634 1.00 . A A . 36 PRO CA 1 1 13 6684 1 1 36 PRO CB C -9.121 8.111 9.636 1.00 . A A . 36 PRO CB 1 1 13 6685 1 1 36 PRO CD C -9.816 7.494 7.406 1.00 . A A . 36 PRO CD 1 1 13 6686 1 1 36 PRO CG C -9.841 8.607 8.422 1.00 . A A . 36 PRO CG 1 1 13 6687 1 1 36 PRO HA H -8.443 6.100 9.979 1.00 . A A . 36 PRO HA 1 1 13 6688 1 1 36 PRO HB2 H -9.541 8.548 10.532 1.00 . A A . 36 PRO HB2 1 1 13 6689 1 1 36 PRO HB3 H -8.069 8.342 9.561 1.00 . A A . 36 PRO HB3 1 1 13 6690 1 1 36 PRO HD2 H -10.764 7.437 6.887 1.00 . A A . 36 PRO HD2 1 1 13 6691 1 1 36 PRO HD3 H -9.007 7.637 6.707 1.00 . A A . 36 PRO HD3 1 1 13 6692 1 1 36 PRO HG2 H -10.862 8.855 8.678 1.00 . A A . 36 PRO HG2 1 1 13 6693 1 1 36 PRO HG3 H -9.338 9.474 8.024 1.00 . A A . 36 PRO HG3 1 1 13 6694 1 1 36 PRO N N -9.587 6.282 8.204 1.00 . A A . 36 PRO N 1 1 13 6695 1 1 36 PRO O O -11.653 6.569 10.136 1.00 . A A . 36 PRO O 1 1 14 6696 1 1 1 ASP C C 13.517 8.816 -1.942 1.00 . A A . 1 ASP C 1 1 14 6697 1 1 1 ASP CA C 14.643 9.482 -2.748 1.00 . A A . 1 ASP CA 1 1 14 6698 1 1 1 ASP CB C 14.792 8.823 -4.128 1.00 . A A . 1 ASP CB 1 1 14 6699 1 1 1 ASP CG C 14.757 7.297 -3.992 1.00 . A A . 1 ASP CG 1 1 14 6700 1 1 1 ASP H1 H 16.122 8.266 -1.910 1.00 . A A . 1 ASP H1 1 1 14 6701 1 1 1 ASP H2 H 15.958 9.778 -1.155 1.00 . A A . 1 ASP H2 1 1 14 6702 1 1 1 ASP H3 H 16.723 9.662 -2.667 1.00 . A A . 1 ASP H3 1 1 14 6703 1 1 1 ASP HA H 14.443 10.534 -2.864 1.00 . A A . 1 ASP HA 1 1 14 6704 1 1 1 ASP HB2 H 13.982 9.146 -4.766 1.00 . A A . 1 ASP HB2 1 1 14 6705 1 1 1 ASP HB3 H 15.733 9.121 -4.568 1.00 . A A . 1 ASP HB3 1 1 14 6706 1 1 1 ASP N N 15.961 9.281 -2.068 1.00 . A A . 1 ASP N 1 1 14 6707 1 1 1 ASP O O 13.743 7.877 -1.199 1.00 . A A . 1 ASP O 1 1 14 6708 1 1 1 ASP OD1 O 15.794 6.723 -3.698 1.00 . A A . 1 ASP OD1 1 1 14 6709 1 1 1 ASP OD2 O 13.694 6.728 -4.182 1.00 . A A . 1 ASP OD2 1 1 14 6710 1 1 2 GLY C C 10.364 7.779 -2.266 1.00 . A A . 2 GLY C 1 1 14 6711 1 1 2 GLY CA C 11.162 8.696 -1.336 1.00 . A A . 2 GLY CA 1 1 14 6712 1 1 2 GLY H H 12.149 10.051 -2.691 1.00 . A A . 2 GLY H 1 1 14 6713 1 1 2 GLY HA2 H 11.539 8.126 -0.499 1.00 . A A . 2 GLY HA2 1 1 14 6714 1 1 2 GLY HA3 H 10.519 9.483 -0.973 1.00 . A A . 2 GLY HA3 1 1 14 6715 1 1 2 GLY N N 12.306 9.296 -2.087 1.00 . A A . 2 GLY N 1 1 14 6716 1 1 2 GLY O O 9.602 8.237 -3.097 1.00 . A A . 2 GLY O 1 1 14 6717 1 1 3 GLU C C 8.307 5.478 -2.604 1.00 . A A . 3 GLU C 1 1 14 6718 1 1 3 GLU CA C 9.786 5.529 -3.008 1.00 . A A . 3 GLU CA 1 1 14 6719 1 1 3 GLU CB C 10.454 4.170 -2.784 1.00 . A A . 3 GLU CB 1 1 14 6720 1 1 3 GLU CD C 12.571 2.912 -3.218 1.00 . A A . 3 GLU CD 1 1 14 6721 1 1 3 GLU CG C 11.654 4.028 -3.723 1.00 . A A . 3 GLU CG 1 1 14 6722 1 1 3 GLU H H 11.154 6.143 -1.454 1.00 . A A . 3 GLU H 1 1 14 6723 1 1 3 GLU HA H 9.880 5.818 -4.043 1.00 . A A . 3 GLU HA 1 1 14 6724 1 1 3 GLU HB2 H 10.788 4.098 -1.758 1.00 . A A . 3 GLU HB2 1 1 14 6725 1 1 3 GLU HB3 H 9.746 3.382 -2.988 1.00 . A A . 3 GLU HB3 1 1 14 6726 1 1 3 GLU HG2 H 11.306 3.788 -4.716 1.00 . A A . 3 GLU HG2 1 1 14 6727 1 1 3 GLU HG3 H 12.203 4.957 -3.749 1.00 . A A . 3 GLU HG3 1 1 14 6728 1 1 3 GLU N N 10.534 6.485 -2.132 1.00 . A A . 3 GLU N 1 1 14 6729 1 1 3 GLU O O 7.977 5.323 -1.441 1.00 . A A . 3 GLU O 1 1 14 6730 1 1 3 GLU OE1 O 12.301 1.763 -3.528 1.00 . A A . 3 GLU OE1 1 1 14 6731 1 1 3 GLU OE2 O 13.530 3.225 -2.530 1.00 . A A . 3 GLU OE2 1 1 14 6732 1 1 4 CYS C C 5.227 4.671 -4.260 1.00 . A A . 4 CYS C 1 1 14 6733 1 1 4 CYS CA C 5.954 5.568 -3.245 1.00 . A A . 4 CYS CA 1 1 14 6734 1 1 4 CYS CB C 5.493 7.034 -3.343 1.00 . A A . 4 CYS CB 1 1 14 6735 1 1 4 CYS H H 7.712 5.732 -4.483 1.00 . A A . 4 CYS H 1 1 14 6736 1 1 4 CYS HA H 5.798 5.201 -2.242 1.00 . A A . 4 CYS HA 1 1 14 6737 1 1 4 CYS HB2 H 5.264 7.400 -2.354 1.00 . A A . 4 CYS HB2 1 1 14 6738 1 1 4 CYS HB3 H 6.287 7.629 -3.766 1.00 . A A . 4 CYS HB3 1 1 14 6739 1 1 4 CYS N N 7.418 5.607 -3.556 1.00 . A A . 4 CYS N 1 1 14 6740 1 1 4 CYS O O 5.734 4.392 -5.330 1.00 . A A . 4 CYS O 1 1 14 6741 1 1 4 CYS SG S 4.017 7.175 -4.385 1.00 . A A . 4 CYS SG 1 1 14 6742 1 1 5 GLY C C 2.204 4.164 -5.569 1.00 . A A . 5 GLY C 1 1 14 6743 1 1 5 GLY CA C 3.279 3.341 -4.853 1.00 . A A . 5 GLY CA 1 1 14 6744 1 1 5 GLY H H 3.661 4.454 -3.060 1.00 . A A . 5 GLY H 1 1 14 6745 1 1 5 GLY HA2 H 3.954 2.912 -5.577 1.00 . A A . 5 GLY HA2 1 1 14 6746 1 1 5 GLY HA3 H 2.805 2.551 -4.288 1.00 . A A . 5 GLY HA3 1 1 14 6747 1 1 5 GLY N N 4.044 4.219 -3.924 1.00 . A A . 5 GLY N 1 1 14 6748 1 1 5 GLY O O 2.493 5.161 -6.204 1.00 . A A . 5 GLY O 1 1 14 6749 1 1 6 GLY C C -1.434 4.318 -5.334 1.00 . A A . 6 GLY C 1 1 14 6750 1 1 6 GLY CA C -0.141 4.499 -6.139 1.00 . A A . 6 GLY CA 1 1 14 6751 1 1 6 GLY H H 0.762 2.944 -4.954 1.00 . A A . 6 GLY H 1 1 14 6752 1 1 6 GLY HA2 H 0.113 5.548 -6.188 1.00 . A A . 6 GLY HA2 1 1 14 6753 1 1 6 GLY HA3 H -0.285 4.117 -7.137 1.00 . A A . 6 GLY HA3 1 1 14 6754 1 1 6 GLY N N 0.965 3.750 -5.471 1.00 . A A . 6 GLY N 1 1 14 6755 1 1 6 GLY O O -1.398 4.065 -4.145 1.00 . A A . 6 GLY O 1 1 14 6756 1 1 7 PHE C C -4.180 2.797 -4.989 1.00 . A A . 7 PHE C 1 1 14 6757 1 1 7 PHE CA C -3.868 4.281 -5.227 1.00 . A A . 7 PHE CA 1 1 14 6758 1 1 7 PHE CB C -4.940 4.921 -6.115 1.00 . A A . 7 PHE CB 1 1 14 6759 1 1 7 PHE CD1 C -6.897 4.755 -4.531 1.00 . A A . 7 PHE CD1 1 1 14 6760 1 1 7 PHE CD2 C -6.071 6.953 -5.138 1.00 . A A . 7 PHE CD2 1 1 14 6761 1 1 7 PHE CE1 C -7.872 5.345 -3.717 1.00 . A A . 7 PHE CE1 1 1 14 6762 1 1 7 PHE CE2 C -7.047 7.543 -4.324 1.00 . A A . 7 PHE CE2 1 1 14 6763 1 1 7 PHE CG C -5.997 5.558 -5.241 1.00 . A A . 7 PHE CG 1 1 14 6764 1 1 7 PHE CZ C -7.947 6.739 -3.615 1.00 . A A . 7 PHE CZ 1 1 14 6765 1 1 7 PHE H H -2.583 4.648 -6.928 1.00 . A A . 7 PHE H 1 1 14 6766 1 1 7 PHE HA H -3.821 4.799 -4.286 1.00 . A A . 7 PHE HA 1 1 14 6767 1 1 7 PHE HB2 H -4.486 5.675 -6.742 1.00 . A A . 7 PHE HB2 1 1 14 6768 1 1 7 PHE HB3 H -5.396 4.163 -6.735 1.00 . A A . 7 PHE HB3 1 1 14 6769 1 1 7 PHE HD1 H -6.840 3.679 -4.611 1.00 . A A . 7 PHE HD1 1 1 14 6770 1 1 7 PHE HD2 H -5.377 7.574 -5.685 1.00 . A A . 7 PHE HD2 1 1 14 6771 1 1 7 PHE HE1 H -8.565 4.724 -3.170 1.00 . A A . 7 PHE HE1 1 1 14 6772 1 1 7 PHE HE2 H -7.105 8.618 -4.244 1.00 . A A . 7 PHE HE2 1 1 14 6773 1 1 7 PHE HZ H -8.699 7.193 -2.987 1.00 . A A . 7 PHE HZ 1 1 14 6774 1 1 7 PHE N N -2.576 4.445 -5.968 1.00 . A A . 7 PHE N 1 1 14 6775 1 1 7 PHE O O -4.716 2.431 -3.964 1.00 . A A . 7 PHE O 1 1 14 6776 1 1 8 TRP C C -2.983 -0.333 -6.350 1.00 . A A . 8 TRP C 1 1 14 6777 1 1 8 TRP CA C -4.128 0.492 -5.749 1.00 . A A . 8 TRP CA 1 1 14 6778 1 1 8 TRP CB C -5.448 0.245 -6.490 1.00 . A A . 8 TRP CB 1 1 14 6779 1 1 8 TRP CD1 C -6.147 -1.847 -5.241 1.00 . A A . 8 TRP CD1 1 1 14 6780 1 1 8 TRP CD2 C -5.939 -2.186 -7.455 1.00 . A A . 8 TRP CD2 1 1 14 6781 1 1 8 TRP CE2 C -6.328 -3.423 -6.890 1.00 . A A . 8 TRP CE2 1 1 14 6782 1 1 8 TRP CE3 C -5.737 -2.127 -8.847 1.00 . A A . 8 TRP CE3 1 1 14 6783 1 1 8 TRP CG C -5.829 -1.201 -6.389 1.00 . A A . 8 TRP CG 1 1 14 6784 1 1 8 TRP CH2 C -6.310 -4.484 -9.057 1.00 . A A . 8 TRP CH2 1 1 14 6785 1 1 8 TRP CZ2 C -6.512 -4.561 -7.677 1.00 . A A . 8 TRP CZ2 1 1 14 6786 1 1 8 TRP CZ3 C -5.923 -3.270 -9.641 1.00 . A A . 8 TRP CZ3 1 1 14 6787 1 1 8 TRP H H -3.420 2.267 -6.745 1.00 . A A . 8 TRP H 1 1 14 6788 1 1 8 TRP HA H -4.245 0.258 -4.702 1.00 . A A . 8 TRP HA 1 1 14 6789 1 1 8 TRP HB2 H -6.225 0.851 -6.047 1.00 . A A . 8 TRP HB2 1 1 14 6790 1 1 8 TRP HB3 H -5.331 0.514 -7.529 1.00 . A A . 8 TRP HB3 1 1 14 6791 1 1 8 TRP HD1 H -6.167 -1.405 -4.256 1.00 . A A . 8 TRP HD1 1 1 14 6792 1 1 8 TRP HE1 H -6.704 -3.847 -4.885 1.00 . A A . 8 TRP HE1 1 1 14 6793 1 1 8 TRP HE3 H -5.437 -1.198 -9.308 1.00 . A A . 8 TRP HE3 1 1 14 6794 1 1 8 TRP HH2 H -6.451 -5.359 -9.674 1.00 . A A . 8 TRP HH2 1 1 14 6795 1 1 8 TRP HZ2 H -6.812 -5.495 -7.223 1.00 . A A . 8 TRP HZ2 1 1 14 6796 1 1 8 TRP HZ3 H -5.766 -3.213 -10.709 1.00 . A A . 8 TRP HZ3 1 1 14 6797 1 1 8 TRP N N -3.851 1.948 -5.926 1.00 . A A . 8 TRP N 1 1 14 6798 1 1 8 TRP NE1 N -6.442 -3.165 -5.539 1.00 . A A . 8 TRP NE1 1 1 14 6799 1 1 8 TRP O O -3.092 -0.876 -7.435 1.00 . A A . 8 TRP O 1 1 14 6800 1 1 9 TRP C C -0.614 -2.522 -5.382 1.00 . A A . 9 TRP C 1 1 14 6801 1 1 9 TRP CA C -0.715 -1.207 -6.159 1.00 . A A . 9 TRP CA 1 1 14 6802 1 1 9 TRP CB C 0.511 -0.321 -5.901 1.00 . A A . 9 TRP CB 1 1 14 6803 1 1 9 TRP CD1 C -0.490 1.374 -7.507 1.00 . A A . 9 TRP CD1 1 1 14 6804 1 1 9 TRP CD2 C 1.756 1.448 -7.456 1.00 . A A . 9 TRP CD2 1 1 14 6805 1 1 9 TRP CE2 C 1.334 2.440 -8.373 1.00 . A A . 9 TRP CE2 1 1 14 6806 1 1 9 TRP CE3 C 3.138 1.291 -7.242 1.00 . A A . 9 TRP CE3 1 1 14 6807 1 1 9 TRP CG C 0.577 0.784 -6.915 1.00 . A A . 9 TRP CG 1 1 14 6808 1 1 9 TRP CH2 C 3.613 3.079 -8.825 1.00 . A A . 9 TRP CH2 1 1 14 6809 1 1 9 TRP CZ2 C 2.246 3.246 -9.049 1.00 . A A . 9 TRP CZ2 1 1 14 6810 1 1 9 TRP CZ3 C 4.059 2.103 -7.924 1.00 . A A . 9 TRP CZ3 1 1 14 6811 1 1 9 TRP H H -1.823 0.028 -4.775 1.00 . A A . 9 TRP H 1 1 14 6812 1 1 9 TRP HA H -0.821 -1.399 -7.215 1.00 . A A . 9 TRP HA 1 1 14 6813 1 1 9 TRP HB2 H 0.442 0.108 -4.911 1.00 . A A . 9 TRP HB2 1 1 14 6814 1 1 9 TRP HB3 H 1.407 -0.921 -5.967 1.00 . A A . 9 TRP HB3 1 1 14 6815 1 1 9 TRP HD1 H -1.524 1.120 -7.336 1.00 . A A . 9 TRP HD1 1 1 14 6816 1 1 9 TRP HE1 H -0.612 2.929 -8.919 1.00 . A A . 9 TRP HE1 1 1 14 6817 1 1 9 TRP HE3 H 3.491 0.541 -6.549 1.00 . A A . 9 TRP HE3 1 1 14 6818 1 1 9 TRP HH2 H 4.326 3.699 -9.347 1.00 . A A . 9 TRP HH2 1 1 14 6819 1 1 9 TRP HZ2 H 1.895 3.999 -9.737 1.00 . A A . 9 TRP HZ2 1 1 14 6820 1 1 9 TRP HZ3 H 5.116 1.974 -7.752 1.00 . A A . 9 TRP HZ3 1 1 14 6821 1 1 9 TRP N N -1.882 -0.422 -5.647 1.00 . A A . 9 TRP N 1 1 14 6822 1 1 9 TRP NE1 N -0.040 2.353 -8.370 1.00 . A A . 9 TRP NE1 1 1 14 6823 1 1 9 TRP O O -1.106 -2.628 -4.279 1.00 . A A . 9 TRP O 1 1 14 6824 1 1 10 LYS C C 1.359 -4.880 -4.342 1.00 . A A . 10 LYS C 1 1 14 6825 1 1 10 LYS CA C 0.105 -4.832 -5.209 1.00 . A A . 10 LYS CA 1 1 14 6826 1 1 10 LYS CB C 0.183 -5.910 -6.289 1.00 . A A . 10 LYS CB 1 1 14 6827 1 1 10 LYS CD C -1.747 -5.916 -7.887 1.00 . A A . 10 LYS CD 1 1 14 6828 1 1 10 LYS CE C -2.998 -5.068 -7.628 1.00 . A A . 10 LYS CE 1 1 14 6829 1 1 10 LYS CG C -1.217 -6.469 -6.560 1.00 . A A . 10 LYS CG 1 1 14 6830 1 1 10 LYS H H 0.391 -3.435 -6.837 1.00 . A A . 10 LYS H 1 1 14 6831 1 1 10 LYS HA H -0.776 -4.985 -4.603 1.00 . A A . 10 LYS HA 1 1 14 6832 1 1 10 LYS HB2 H 0.588 -5.484 -7.195 1.00 . A A . 10 LYS HB2 1 1 14 6833 1 1 10 LYS HB3 H 0.827 -6.708 -5.947 1.00 . A A . 10 LYS HB3 1 1 14 6834 1 1 10 LYS HD2 H -0.987 -5.306 -8.353 1.00 . A A . 10 LYS HD2 1 1 14 6835 1 1 10 LYS HD3 H -2.000 -6.736 -8.541 1.00 . A A . 10 LYS HD3 1 1 14 6836 1 1 10 LYS HE2 H -3.854 -5.503 -8.127 1.00 . A A . 10 LYS HE2 1 1 14 6837 1 1 10 LYS HE3 H -3.185 -4.986 -6.567 1.00 . A A . 10 LYS HE3 1 1 14 6838 1 1 10 LYS HG2 H -1.167 -7.546 -6.613 1.00 . A A . 10 LYS HG2 1 1 14 6839 1 1 10 LYS HG3 H -1.881 -6.178 -5.760 1.00 . A A . 10 LYS HG3 1 1 14 6840 1 1 10 LYS HZ1 H -3.412 -3.044 -7.890 1.00 . A A . 10 LYS HZ1 1 1 14 6841 1 1 10 LYS HZ2 H -2.688 -3.781 -9.237 1.00 . A A . 10 LYS HZ2 1 1 14 6842 1 1 10 LYS HZ3 H -1.758 -3.409 -7.865 1.00 . A A . 10 LYS HZ3 1 1 14 6843 1 1 10 LYS N N 0.004 -3.529 -5.940 1.00 . A A . 10 LYS N 1 1 14 6844 1 1 10 LYS NZ N -2.690 -3.725 -8.197 1.00 . A A . 10 LYS NZ 1 1 14 6845 1 1 10 LYS O O 2.450 -4.576 -4.790 1.00 . A A . 10 LYS O 1 1 14 6846 1 1 11 CYS C C 2.166 -6.479 -1.156 1.00 . A A . 11 CYS C 1 1 14 6847 1 1 11 CYS CA C 2.391 -5.381 -2.204 1.00 . A A . 11 CYS CA 1 1 14 6848 1 1 11 CYS CB C 2.513 -4.004 -1.540 1.00 . A A . 11 CYS CB 1 1 14 6849 1 1 11 CYS H H 0.324 -5.537 -2.779 1.00 . A A . 11 CYS H 1 1 14 6850 1 1 11 CYS HA H 3.274 -5.591 -2.783 1.00 . A A . 11 CYS HA 1 1 14 6851 1 1 11 CYS HB2 H 3.444 -3.952 -0.996 1.00 . A A . 11 CYS HB2 1 1 14 6852 1 1 11 CYS HB3 H 2.498 -3.238 -2.300 1.00 . A A . 11 CYS HB3 1 1 14 6853 1 1 11 CYS N N 1.211 -5.282 -3.107 1.00 . A A . 11 CYS N 1 1 14 6854 1 1 11 CYS O O 1.065 -6.975 -0.991 1.00 . A A . 11 CYS O 1 1 14 6855 1 1 11 CYS SG S 1.141 -3.735 -0.394 1.00 . A A . 11 CYS SG 1 1 14 6856 1 1 12 GLY C C 2.476 -7.308 1.876 1.00 . A A . 12 GLY C 1 1 14 6857 1 1 12 GLY CA C 3.043 -7.926 0.595 1.00 . A A . 12 GLY CA 1 1 14 6858 1 1 12 GLY H H 4.073 -6.448 -0.590 1.00 . A A . 12 GLY H 1 1 14 6859 1 1 12 GLY HA2 H 2.370 -8.689 0.233 1.00 . A A . 12 GLY HA2 1 1 14 6860 1 1 12 GLY HA3 H 4.006 -8.365 0.807 1.00 . A A . 12 GLY HA3 1 1 14 6861 1 1 12 GLY N N 3.197 -6.862 -0.442 1.00 . A A . 12 GLY N 1 1 14 6862 1 1 12 GLY O O 1.409 -6.722 1.872 1.00 . A A . 12 GLY O 1 1 14 6863 1 1 13 ARG C C 3.218 -5.387 4.404 1.00 . A A . 13 ARG C 1 1 14 6864 1 1 13 ARG CA C 2.701 -6.827 4.254 1.00 . A A . 13 ARG CA 1 1 14 6865 1 1 13 ARG CB C 3.273 -7.725 5.356 1.00 . A A . 13 ARG CB 1 1 14 6866 1 1 13 ARG CD C 3.188 -6.892 7.722 1.00 . A A . 13 ARG CD 1 1 14 6867 1 1 13 ARG CG C 2.406 -7.610 6.617 1.00 . A A . 13 ARG CG 1 1 14 6868 1 1 13 ARG CZ C 3.863 -8.438 9.465 1.00 . A A . 13 ARG CZ 1 1 14 6869 1 1 13 ARG H H 4.050 -7.890 2.946 1.00 . A A . 13 ARG H 1 1 14 6870 1 1 13 ARG HA H 1.623 -6.844 4.289 1.00 . A A . 13 ARG HA 1 1 14 6871 1 1 13 ARG HB2 H 3.281 -8.752 5.018 1.00 . A A . 13 ARG HB2 1 1 14 6872 1 1 13 ARG HB3 H 4.281 -7.416 5.586 1.00 . A A . 13 ARG HB3 1 1 14 6873 1 1 13 ARG HD2 H 4.245 -6.888 7.492 1.00 . A A . 13 ARG HD2 1 1 14 6874 1 1 13 ARG HD3 H 2.827 -5.883 7.844 1.00 . A A . 13 ARG HD3 1 1 14 6875 1 1 13 ARG HE H 2.045 -7.636 9.389 1.00 . A A . 13 ARG HE 1 1 14 6876 1 1 13 ARG HG2 H 1.511 -7.051 6.387 1.00 . A A . 13 ARG HG2 1 1 14 6877 1 1 13 ARG HG3 H 2.135 -8.598 6.957 1.00 . A A . 13 ARG HG3 1 1 14 6878 1 1 13 ARG HH11 H 4.075 -9.553 7.812 1.00 . A A . 13 ARG HH11 1 1 14 6879 1 1 13 ARG HH12 H 5.107 -9.975 9.135 1.00 . A A . 13 ARG HH12 1 1 14 6880 1 1 13 ARG HH21 H 3.872 -7.498 11.236 1.00 . A A . 13 ARG HH21 1 1 14 6881 1 1 13 ARG HH22 H 4.994 -8.808 11.079 1.00 . A A . 13 ARG HH22 1 1 14 6882 1 1 13 ARG N N 3.190 -7.424 2.972 1.00 . A A . 13 ARG N 1 1 14 6883 1 1 13 ARG NE N 2.923 -7.682 8.957 1.00 . A A . 13 ARG NE 1 1 14 6884 1 1 13 ARG NH1 N 4.389 -9.398 8.748 1.00 . A A . 13 ARG NH1 1 1 14 6885 1 1 13 ARG NH2 N 4.275 -8.232 10.689 1.00 . A A . 13 ARG NH2 1 1 14 6886 1 1 13 ARG O O 3.348 -4.878 5.502 1.00 . A A . 13 ARG O 1 1 14 6887 1 1 14 GLY C C 5.523 -3.296 3.107 1.00 . A A . 14 GLY C 1 1 14 6888 1 1 14 GLY CA C 4.016 -3.326 3.383 1.00 . A A . 14 GLY CA 1 1 14 6889 1 1 14 GLY H H 3.398 -5.151 2.434 1.00 . A A . 14 GLY H 1 1 14 6890 1 1 14 GLY HA2 H 3.504 -2.723 2.648 1.00 . A A . 14 GLY HA2 1 1 14 6891 1 1 14 GLY HA3 H 3.827 -2.927 4.368 1.00 . A A . 14 GLY HA3 1 1 14 6892 1 1 14 GLY N N 3.511 -4.726 3.309 1.00 . A A . 14 GLY N 1 1 14 6893 1 1 14 GLY O O 6.240 -2.485 3.662 1.00 . A A . 14 GLY O 1 1 14 6894 1 1 15 LYS C C 7.839 -2.902 1.132 1.00 . A A . 15 LYS C 1 1 14 6895 1 1 15 LYS CA C 7.475 -4.161 1.935 1.00 . A A . 15 LYS CA 1 1 14 6896 1 1 15 LYS CB C 7.736 -5.436 1.121 1.00 . A A . 15 LYS CB 1 1 14 6897 1 1 15 LYS CD C 8.672 -6.839 2.978 1.00 . A A . 15 LYS CD 1 1 14 6898 1 1 15 LYS CE C 9.900 -6.793 3.893 1.00 . A A . 15 LYS CE 1 1 14 6899 1 1 15 LYS CG C 8.991 -6.136 1.654 1.00 . A A . 15 LYS CG 1 1 14 6900 1 1 15 LYS H H 5.415 -4.804 1.802 1.00 . A A . 15 LYS H 1 1 14 6901 1 1 15 LYS HA H 8.041 -4.190 2.848 1.00 . A A . 15 LYS HA 1 1 14 6902 1 1 15 LYS HB2 H 6.888 -6.100 1.208 1.00 . A A . 15 LYS HB2 1 1 14 6903 1 1 15 LYS HB3 H 7.886 -5.178 0.084 1.00 . A A . 15 LYS HB3 1 1 14 6904 1 1 15 LYS HD2 H 7.843 -6.339 3.459 1.00 . A A . 15 LYS HD2 1 1 14 6905 1 1 15 LYS HD3 H 8.409 -7.868 2.783 1.00 . A A . 15 LYS HD3 1 1 14 6906 1 1 15 LYS HE2 H 10.567 -7.612 3.664 1.00 . A A . 15 LYS HE2 1 1 14 6907 1 1 15 LYS HE3 H 10.412 -5.850 3.789 1.00 . A A . 15 LYS HE3 1 1 14 6908 1 1 15 LYS HG2 H 9.329 -6.865 0.932 1.00 . A A . 15 LYS HG2 1 1 14 6909 1 1 15 LYS HG3 H 9.769 -5.405 1.816 1.00 . A A . 15 LYS HG3 1 1 14 6910 1 1 15 LYS HZ1 H 8.727 -6.134 5.485 1.00 . A A . 15 LYS HZ1 1 1 14 6911 1 1 15 LYS HZ2 H 10.149 -6.935 5.956 1.00 . A A . 15 LYS HZ2 1 1 14 6912 1 1 15 LYS HZ3 H 8.830 -7.822 5.356 1.00 . A A . 15 LYS HZ3 1 1 14 6913 1 1 15 LYS N N 6.011 -4.163 2.247 1.00 . A A . 15 LYS N 1 1 14 6914 1 1 15 LYS NZ N 9.361 -6.931 5.276 1.00 . A A . 15 LYS NZ 1 1 14 6915 1 1 15 LYS O O 8.710 -2.152 1.534 1.00 . A A . 15 LYS O 1 1 14 6916 1 1 16 PRO C C 6.754 -0.267 -0.161 1.00 . A A . 16 PRO C 1 1 14 6917 1 1 16 PRO CA C 7.398 -1.502 -0.809 1.00 . A A . 16 PRO CA 1 1 14 6918 1 1 16 PRO CB C 6.711 -1.839 -2.129 1.00 . A A . 16 PRO CB 1 1 14 6919 1 1 16 PRO CD C 6.090 -3.548 -0.525 1.00 . A A . 16 PRO CD 1 1 14 6920 1 1 16 PRO CG C 5.645 -2.829 -1.775 1.00 . A A . 16 PRO CG 1 1 14 6921 1 1 16 PRO HA H 8.455 -1.354 -0.964 1.00 . A A . 16 PRO HA 1 1 14 6922 1 1 16 PRO HB2 H 6.272 -0.949 -2.561 1.00 . A A . 16 PRO HB2 1 1 14 6923 1 1 16 PRO HB3 H 7.414 -2.285 -2.816 1.00 . A A . 16 PRO HB3 1 1 14 6924 1 1 16 PRO HD2 H 5.268 -3.635 0.173 1.00 . A A . 16 PRO HD2 1 1 14 6925 1 1 16 PRO HD3 H 6.487 -4.520 -0.768 1.00 . A A . 16 PRO HD3 1 1 14 6926 1 1 16 PRO HG2 H 4.712 -2.311 -1.591 1.00 . A A . 16 PRO HG2 1 1 14 6927 1 1 16 PRO HG3 H 5.521 -3.538 -2.577 1.00 . A A . 16 PRO HG3 1 1 14 6928 1 1 16 PRO N N 7.147 -2.696 0.032 1.00 . A A . 16 PRO N 1 1 14 6929 1 1 16 PRO O O 5.609 -0.317 0.250 1.00 . A A . 16 PRO O 1 1 14 6930 1 1 17 PRO C C 5.935 2.704 -0.371 1.00 . A A . 17 PRO C 1 1 14 6931 1 1 17 PRO CA C 6.995 2.054 0.529 1.00 . A A . 17 PRO CA 1 1 14 6932 1 1 17 PRO CB C 8.237 2.936 0.640 1.00 . A A . 17 PRO CB 1 1 14 6933 1 1 17 PRO CD C 8.895 0.948 -0.553 1.00 . A A . 17 PRO CD 1 1 14 6934 1 1 17 PRO CG C 9.167 2.423 -0.412 1.00 . A A . 17 PRO CG 1 1 14 6935 1 1 17 PRO HA H 6.593 1.858 1.511 1.00 . A A . 17 PRO HA 1 1 14 6936 1 1 17 PRO HB2 H 7.982 3.967 0.451 1.00 . A A . 17 PRO HB2 1 1 14 6937 1 1 17 PRO HB3 H 8.688 2.829 1.615 1.00 . A A . 17 PRO HB3 1 1 14 6938 1 1 17 PRO HD2 H 8.984 0.645 -1.588 1.00 . A A . 17 PRO HD2 1 1 14 6939 1 1 17 PRO HD3 H 9.563 0.376 0.070 1.00 . A A . 17 PRO HD3 1 1 14 6940 1 1 17 PRO HG2 H 8.974 2.929 -1.347 1.00 . A A . 17 PRO HG2 1 1 14 6941 1 1 17 PRO HG3 H 10.191 2.577 -0.109 1.00 . A A . 17 PRO HG3 1 1 14 6942 1 1 17 PRO N N 7.510 0.801 -0.084 1.00 . A A . 17 PRO N 1 1 14 6943 1 1 17 PRO O O 6.209 3.076 -1.496 1.00 . A A . 17 PRO O 1 1 14 6944 1 1 18 CYS C C 3.724 5.010 -0.572 1.00 . A A . 18 CYS C 1 1 14 6945 1 1 18 CYS CA C 3.646 3.479 -0.689 1.00 . A A . 18 CYS CA 1 1 14 6946 1 1 18 CYS CB C 2.333 2.962 -0.089 1.00 . A A . 18 CYS CB 1 1 14 6947 1 1 18 CYS H H 4.538 2.541 1.032 1.00 . A A . 18 CYS H 1 1 14 6948 1 1 18 CYS HA H 3.724 3.174 -1.720 1.00 . A A . 18 CYS HA 1 1 14 6949 1 1 18 CYS HB2 H 2.345 3.102 0.981 1.00 . A A . 18 CYS HB2 1 1 14 6950 1 1 18 CYS HB3 H 1.504 3.509 -0.514 1.00 . A A . 18 CYS HB3 1 1 14 6951 1 1 18 CYS N N 4.730 2.847 0.125 1.00 . A A . 18 CYS N 1 1 14 6952 1 1 18 CYS O O 4.595 5.545 0.090 1.00 . A A . 18 CYS O 1 1 14 6953 1 1 18 CYS SG S 2.145 1.202 -0.463 1.00 . A A . 18 CYS SG 1 1 14 6954 1 1 19 CYS C C 2.325 7.676 0.231 1.00 . A A . 19 CYS C 1 1 14 6955 1 1 19 CYS CA C 2.849 7.210 -1.132 1.00 . A A . 19 CYS CA 1 1 14 6956 1 1 19 CYS CB C 1.930 7.692 -2.258 1.00 . A A . 19 CYS CB 1 1 14 6957 1 1 19 CYS H H 2.131 5.263 -1.738 1.00 . A A . 19 CYS H 1 1 14 6958 1 1 19 CYS HA H 3.850 7.576 -1.292 1.00 . A A . 19 CYS HA 1 1 14 6959 1 1 19 CYS HB2 H 1.457 6.844 -2.729 1.00 . A A . 19 CYS HB2 1 1 14 6960 1 1 19 CYS HB3 H 1.171 8.343 -1.848 1.00 . A A . 19 CYS HB3 1 1 14 6961 1 1 19 CYS N N 2.824 5.715 -1.210 1.00 . A A . 19 CYS N 1 1 14 6962 1 1 19 CYS O O 1.714 6.920 0.962 1.00 . A A . 19 CYS O 1 1 14 6963 1 1 19 CYS SG S 2.904 8.600 -3.484 1.00 . A A . 19 CYS SG 1 1 14 6964 1 1 20 LYS C C 0.563 9.358 1.975 1.00 . A A . 20 LYS C 1 1 14 6965 1 1 20 LYS CA C 2.092 9.442 1.891 1.00 . A A . 20 LYS CA 1 1 14 6966 1 1 20 LYS CB C 2.566 10.899 1.945 1.00 . A A . 20 LYS CB 1 1 14 6967 1 1 20 LYS CD C 4.067 10.525 3.915 1.00 . A A . 20 LYS CD 1 1 14 6968 1 1 20 LYS CE C 4.977 11.472 4.705 1.00 . A A . 20 LYS CE 1 1 14 6969 1 1 20 LYS CG C 2.847 11.294 3.398 1.00 . A A . 20 LYS CG 1 1 14 6970 1 1 20 LYS H H 3.067 9.501 -0.024 1.00 . A A . 20 LYS H 1 1 14 6971 1 1 20 LYS HA H 2.543 8.883 2.689 1.00 . A A . 20 LYS HA 1 1 14 6972 1 1 20 LYS HB2 H 3.470 11.006 1.360 1.00 . A A . 20 LYS HB2 1 1 14 6973 1 1 20 LYS HB3 H 1.798 11.542 1.540 1.00 . A A . 20 LYS HB3 1 1 14 6974 1 1 20 LYS HD2 H 3.739 9.721 4.558 1.00 . A A . 20 LYS HD2 1 1 14 6975 1 1 20 LYS HD3 H 4.617 10.117 3.080 1.00 . A A . 20 LYS HD3 1 1 14 6976 1 1 20 LYS HE2 H 6.008 11.154 4.626 1.00 . A A . 20 LYS HE2 1 1 14 6977 1 1 20 LYS HE3 H 4.868 12.484 4.349 1.00 . A A . 20 LYS HE3 1 1 14 6978 1 1 20 LYS HG2 H 3.039 12.356 3.451 1.00 . A A . 20 LYS HG2 1 1 14 6979 1 1 20 LYS HG3 H 1.989 11.055 4.009 1.00 . A A . 20 LYS HG3 1 1 14 6980 1 1 20 LYS HZ1 H 3.524 11.704 6.180 1.00 . A A . 20 LYS HZ1 1 1 14 6981 1 1 20 LYS HZ2 H 5.112 11.969 6.723 1.00 . A A . 20 LYS HZ2 1 1 14 6982 1 1 20 LYS HZ3 H 4.562 10.388 6.436 1.00 . A A . 20 LYS HZ3 1 1 14 6983 1 1 20 LYS N N 2.567 8.917 0.578 1.00 . A A . 20 LYS N 1 1 14 6984 1 1 20 LYS NZ N 4.508 11.374 6.117 1.00 . A A . 20 LYS NZ 1 1 14 6985 1 1 20 LYS O O -0.145 9.939 1.173 1.00 . A A . 20 LYS O 1 1 14 6986 1 1 21 GLY C C -1.894 7.140 2.513 1.00 . A A . 21 GLY C 1 1 14 6987 1 1 21 GLY CA C -1.428 8.490 3.082 1.00 . A A . 21 GLY CA 1 1 14 6988 1 1 21 GLY H H 0.648 8.168 3.566 1.00 . A A . 21 GLY H 1 1 14 6989 1 1 21 GLY HA2 H -1.692 8.547 4.128 1.00 . A A . 21 GLY HA2 1 1 14 6990 1 1 21 GLY HA3 H -1.918 9.289 2.546 1.00 . A A . 21 GLY HA3 1 1 14 6991 1 1 21 GLY N N 0.054 8.630 2.938 1.00 . A A . 21 GLY N 1 1 14 6992 1 1 21 GLY O O -3.071 6.835 2.517 1.00 . A A . 21 GLY O 1 1 14 6993 1 1 22 TYR C C -0.825 3.879 2.345 1.00 . A A . 22 TYR C 1 1 14 6994 1 1 22 TYR CA C -1.372 5.001 1.455 1.00 . A A . 22 TYR CA 1 1 14 6995 1 1 22 TYR CB C -0.719 4.945 0.068 1.00 . A A . 22 TYR CB 1 1 14 6996 1 1 22 TYR CD1 C -0.992 7.353 -0.653 1.00 . A A . 22 TYR CD1 1 1 14 6997 1 1 22 TYR CD2 C -2.182 5.628 -1.870 1.00 . A A . 22 TYR CD2 1 1 14 6998 1 1 22 TYR CE1 C -1.538 8.327 -1.497 1.00 . A A . 22 TYR CE1 1 1 14 6999 1 1 22 TYR CE2 C -2.728 6.604 -2.714 1.00 . A A . 22 TYR CE2 1 1 14 7000 1 1 22 TYR CG C -1.315 6.003 -0.838 1.00 . A A . 22 TYR CG 1 1 14 7001 1 1 22 TYR CZ C -2.407 7.952 -2.527 1.00 . A A . 22 TYR CZ 1 1 14 7002 1 1 22 TYR H H -0.040 6.590 2.026 1.00 . A A . 22 TYR H 1 1 14 7003 1 1 22 TYR HA H -2.445 4.925 1.363 1.00 . A A . 22 TYR HA 1 1 14 7004 1 1 22 TYR HB2 H 0.342 5.116 0.167 1.00 . A A . 22 TYR HB2 1 1 14 7005 1 1 22 TYR HB3 H -0.884 3.969 -0.364 1.00 . A A . 22 TYR HB3 1 1 14 7006 1 1 22 TYR HD1 H -0.323 7.644 0.141 1.00 . A A . 22 TYR HD1 1 1 14 7007 1 1 22 TYR HD2 H -2.430 4.587 -2.015 1.00 . A A . 22 TYR HD2 1 1 14 7008 1 1 22 TYR HE1 H -1.289 9.368 -1.352 1.00 . A A . 22 TYR HE1 1 1 14 7009 1 1 22 TYR HE2 H -3.399 6.314 -3.509 1.00 . A A . 22 TYR HE2 1 1 14 7010 1 1 22 TYR HH H -3.750 9.243 -2.952 1.00 . A A . 22 TYR HH 1 1 14 7011 1 1 22 TYR N N -0.983 6.328 2.022 1.00 . A A . 22 TYR N 1 1 14 7012 1 1 22 TYR O O 0.327 3.898 2.739 1.00 . A A . 22 TYR O 1 1 14 7013 1 1 22 TYR OH O -2.946 8.912 -3.360 1.00 . A A . 22 TYR OH 1 1 14 7014 1 1 23 ALA C C -1.279 0.445 2.795 1.00 . A A . 23 ALA C 1 1 14 7015 1 1 23 ALA CA C -1.167 1.783 3.536 1.00 . A A . 23 ALA CA 1 1 14 7016 1 1 23 ALA CB C -2.099 1.801 4.750 1.00 . A A . 23 ALA CB 1 1 14 7017 1 1 23 ALA H H -2.564 2.913 2.337 1.00 . A A . 23 ALA H 1 1 14 7018 1 1 23 ALA HA H -0.151 1.954 3.852 1.00 . A A . 23 ALA HA 1 1 14 7019 1 1 23 ALA HB1 H -2.207 2.815 5.106 1.00 . A A . 23 ALA HB1 1 1 14 7020 1 1 23 ALA HB2 H -1.680 1.188 5.533 1.00 . A A . 23 ALA HB2 1 1 14 7021 1 1 23 ALA HB3 H -3.067 1.413 4.467 1.00 . A A . 23 ALA HB3 1 1 14 7022 1 1 23 ALA N N -1.640 2.905 2.666 1.00 . A A . 23 ALA N 1 1 14 7023 1 1 23 ALA O O -2.199 0.226 2.028 1.00 . A A . 23 ALA O 1 1 14 7024 1 1 24 CYS C C -1.221 -2.771 3.180 1.00 . A A . 24 CYS C 1 1 14 7025 1 1 24 CYS CA C -0.402 -1.785 2.345 1.00 . A A . 24 CYS CA 1 1 14 7026 1 1 24 CYS CB C 1.051 -2.257 2.242 1.00 . A A . 24 CYS CB 1 1 14 7027 1 1 24 CYS H H 0.375 -0.254 3.656 1.00 . A A . 24 CYS H 1 1 14 7028 1 1 24 CYS HA H -0.829 -1.685 1.360 1.00 . A A . 24 CYS HA 1 1 14 7029 1 1 24 CYS HB2 H 1.668 -1.689 2.920 1.00 . A A . 24 CYS HB2 1 1 14 7030 1 1 24 CYS HB3 H 1.108 -3.306 2.497 1.00 . A A . 24 CYS HB3 1 1 14 7031 1 1 24 CYS N N -0.351 -0.454 3.028 1.00 . A A . 24 CYS N 1 1 14 7032 1 1 24 CYS O O -1.430 -2.574 4.364 1.00 . A A . 24 CYS O 1 1 14 7033 1 1 24 CYS SG S 1.645 -2.023 0.551 1.00 . A A . 24 CYS SG 1 1 14 7034 1 1 25 SER C C -2.066 -6.255 2.962 1.00 . A A . 25 SER C 1 1 14 7035 1 1 25 SER CA C -2.494 -4.831 3.325 1.00 . A A . 25 SER CA 1 1 14 7036 1 1 25 SER CB C -3.939 -4.580 2.896 1.00 . A A . 25 SER CB 1 1 14 7037 1 1 25 SER H H -1.505 -3.966 1.618 1.00 . A A . 25 SER H 1 1 14 7038 1 1 25 SER HA H -2.395 -4.673 4.383 1.00 . A A . 25 SER HA 1 1 14 7039 1 1 25 SER HB2 H -3.973 -4.375 1.839 1.00 . A A . 25 SER HB2 1 1 14 7040 1 1 25 SER HB3 H -4.534 -5.460 3.108 1.00 . A A . 25 SER HB3 1 1 14 7041 1 1 25 SER HG H -4.556 -2.734 2.988 1.00 . A A . 25 SER HG 1 1 14 7042 1 1 25 SER N N -1.685 -3.832 2.573 1.00 . A A . 25 SER N 1 1 14 7043 1 1 25 SER O O -2.058 -6.634 1.808 1.00 . A A . 25 SER O 1 1 14 7044 1 1 25 SER OG O -4.452 -3.462 3.609 1.00 . A A . 25 SER OG 1 1 14 7045 1 1 26 LYS C C -2.563 -9.296 3.376 1.00 . A A . 26 LYS C 1 1 14 7046 1 1 26 LYS CA C -1.315 -8.457 3.667 1.00 . A A . 26 LYS CA 1 1 14 7047 1 1 26 LYS CB C -0.613 -8.942 4.940 1.00 . A A . 26 LYS CB 1 1 14 7048 1 1 26 LYS CD C 1.076 -10.720 5.454 1.00 . A A . 26 LYS CD 1 1 14 7049 1 1 26 LYS CE C 0.893 -11.709 6.609 1.00 . A A . 26 LYS CE 1 1 14 7050 1 1 26 LYS CG C -0.282 -10.433 4.809 1.00 . A A . 26 LYS CG 1 1 14 7051 1 1 26 LYS H H -1.748 -6.721 4.871 1.00 . A A . 26 LYS H 1 1 14 7052 1 1 26 LYS HA H -0.636 -8.492 2.833 1.00 . A A . 26 LYS HA 1 1 14 7053 1 1 26 LYS HB2 H 0.298 -8.380 5.084 1.00 . A A . 26 LYS HB2 1 1 14 7054 1 1 26 LYS HB3 H -1.266 -8.793 5.789 1.00 . A A . 26 LYS HB3 1 1 14 7055 1 1 26 LYS HD2 H 1.741 -11.144 4.717 1.00 . A A . 26 LYS HD2 1 1 14 7056 1 1 26 LYS HD3 H 1.497 -9.802 5.833 1.00 . A A . 26 LYS HD3 1 1 14 7057 1 1 26 LYS HE2 H 0.302 -11.261 7.397 1.00 . A A . 26 LYS HE2 1 1 14 7058 1 1 26 LYS HE3 H 0.426 -12.615 6.257 1.00 . A A . 26 LYS HE3 1 1 14 7059 1 1 26 LYS HG2 H -1.047 -11.015 5.302 1.00 . A A . 26 LYS HG2 1 1 14 7060 1 1 26 LYS HG3 H -0.244 -10.702 3.764 1.00 . A A . 26 LYS HG3 1 1 14 7061 1 1 26 LYS HZ1 H 2.225 -12.677 7.882 1.00 . A A . 26 LYS HZ1 1 1 14 7062 1 1 26 LYS HZ2 H 2.718 -11.119 7.419 1.00 . A A . 26 LYS HZ2 1 1 14 7063 1 1 26 LYS HZ3 H 2.833 -12.411 6.321 1.00 . A A . 26 LYS HZ3 1 1 14 7064 1 1 26 LYS N N -1.723 -7.049 3.946 1.00 . A A . 26 LYS N 1 1 14 7065 1 1 26 LYS NZ N 2.271 -12.002 7.094 1.00 . A A . 26 LYS NZ 1 1 14 7066 1 1 26 LYS O O -2.573 -10.122 2.485 1.00 . A A . 26 LYS O 1 1 14 7067 1 1 27 THR C C -5.460 -9.478 2.511 1.00 . A A . 27 THR C 1 1 14 7068 1 1 27 THR CA C -4.890 -9.831 3.890 1.00 . A A . 27 THR CA 1 1 14 7069 1 1 27 THR CB C -5.848 -9.382 5.003 1.00 . A A . 27 THR CB 1 1 14 7070 1 1 27 THR CG2 C -7.064 -10.310 5.036 1.00 . A A . 27 THR CG2 1 1 14 7071 1 1 27 THR H H -3.582 -8.387 4.822 1.00 . A A . 27 THR H 1 1 14 7072 1 1 27 THR HA H -4.708 -10.889 3.961 1.00 . A A . 27 THR HA 1 1 14 7073 1 1 27 THR HB H -6.182 -8.371 4.810 1.00 . A A . 27 THR HB 1 1 14 7074 1 1 27 THR HG1 H -5.206 -8.559 6.647 1.00 . A A . 27 THR HG1 1 1 14 7075 1 1 27 THR HG21 H -6.736 -11.336 4.953 1.00 . A A . 27 THR HG21 1 1 14 7076 1 1 27 THR HG22 H -7.719 -10.073 4.210 1.00 . A A . 27 THR HG22 1 1 14 7077 1 1 27 THR HG23 H -7.595 -10.174 5.966 1.00 . A A . 27 THR HG23 1 1 14 7078 1 1 27 THR N N -3.622 -9.069 4.120 1.00 . A A . 27 THR N 1 1 14 7079 1 1 27 THR O O -5.969 -10.327 1.806 1.00 . A A . 27 THR O 1 1 14 7080 1 1 27 THR OG1 O -5.181 -9.436 6.257 1.00 . A A . 27 THR OG1 1 1 14 7081 1 1 28 TRP C C -4.857 -8.142 -0.291 1.00 . A A . 28 TRP C 1 1 14 7082 1 1 28 TRP CA C -5.890 -7.809 0.788 1.00 . A A . 28 TRP CA 1 1 14 7083 1 1 28 TRP CB C -6.092 -6.290 0.885 1.00 . A A . 28 TRP CB 1 1 14 7084 1 1 28 TRP CD1 C -7.796 -6.862 2.681 1.00 . A A . 28 TRP CD1 1 1 14 7085 1 1 28 TRP CD2 C -7.581 -4.645 2.359 1.00 . A A . 28 TRP CD2 1 1 14 7086 1 1 28 TRP CE2 C -8.549 -4.819 3.379 1.00 . A A . 28 TRP CE2 1 1 14 7087 1 1 28 TRP CE3 C -7.262 -3.335 1.964 1.00 . A A . 28 TRP CE3 1 1 14 7088 1 1 28 TRP CG C -7.115 -5.960 1.934 1.00 . A A . 28 TRP CG 1 1 14 7089 1 1 28 TRP CH2 C -8.847 -2.434 3.579 1.00 . A A . 28 TRP CH2 1 1 14 7090 1 1 28 TRP CZ2 C -9.176 -3.729 3.983 1.00 . A A . 28 TRP CZ2 1 1 14 7091 1 1 28 TRP CZ3 C -7.893 -2.236 2.573 1.00 . A A . 28 TRP CZ3 1 1 14 7092 1 1 28 TRP H H -4.944 -7.570 2.713 1.00 . A A . 28 TRP H 1 1 14 7093 1 1 28 TRP HA H -6.829 -8.298 0.578 1.00 . A A . 28 TRP HA 1 1 14 7094 1 1 28 TRP HB2 H -5.155 -5.821 1.141 1.00 . A A . 28 TRP HB2 1 1 14 7095 1 1 28 TRP HB3 H -6.427 -5.914 -0.070 1.00 . A A . 28 TRP HB3 1 1 14 7096 1 1 28 TRP HD1 H -7.691 -7.934 2.621 1.00 . A A . 28 TRP HD1 1 1 14 7097 1 1 28 TRP HE1 H -9.236 -6.609 4.190 1.00 . A A . 28 TRP HE1 1 1 14 7098 1 1 28 TRP HE3 H -6.528 -3.170 1.191 1.00 . A A . 28 TRP HE3 1 1 14 7099 1 1 28 TRP HH2 H -9.330 -1.587 4.042 1.00 . A A . 28 TRP HH2 1 1 14 7100 1 1 28 TRP HZ2 H -9.912 -3.888 4.758 1.00 . A A . 28 TRP HZ2 1 1 14 7101 1 1 28 TRP HZ3 H -7.640 -1.232 2.261 1.00 . A A . 28 TRP HZ3 1 1 14 7102 1 1 28 TRP N N -5.367 -8.229 2.125 1.00 . A A . 28 TRP N 1 1 14 7103 1 1 28 TRP NE1 N -8.639 -6.187 3.541 1.00 . A A . 28 TRP NE1 1 1 14 7104 1 1 28 TRP O O -5.184 -8.679 -1.333 1.00 . A A . 28 TRP O 1 1 14 7105 1 1 29 GLY C C -2.190 -6.877 -1.848 1.00 . A A . 29 GLY C 1 1 14 7106 1 1 29 GLY CA C -2.534 -8.128 -1.028 1.00 . A A . 29 GLY CA 1 1 14 7107 1 1 29 GLY H H -3.378 -7.407 0.813 1.00 . A A . 29 GLY H 1 1 14 7108 1 1 29 GLY HA2 H -1.651 -8.464 -0.503 1.00 . A A . 29 GLY HA2 1 1 14 7109 1 1 29 GLY HA3 H -2.868 -8.908 -1.697 1.00 . A A . 29 GLY HA3 1 1 14 7110 1 1 29 GLY N N -3.609 -7.832 -0.038 1.00 . A A . 29 GLY N 1 1 14 7111 1 1 29 GLY O O -1.562 -6.974 -2.885 1.00 . A A . 29 GLY O 1 1 14 7112 1 1 30 TRP C C -2.130 -3.242 -1.276 1.00 . A A . 30 TRP C 1 1 14 7113 1 1 30 TRP CA C -2.255 -4.470 -2.189 1.00 . A A . 30 TRP CA 1 1 14 7114 1 1 30 TRP CB C -3.400 -4.309 -3.206 1.00 . A A . 30 TRP CB 1 1 14 7115 1 1 30 TRP CD1 C -4.838 -2.559 -2.068 1.00 . A A . 30 TRP CD1 1 1 14 7116 1 1 30 TRP CD2 C -5.890 -4.535 -2.290 1.00 . A A . 30 TRP CD2 1 1 14 7117 1 1 30 TRP CE2 C -6.797 -3.661 -1.647 1.00 . A A . 30 TRP CE2 1 1 14 7118 1 1 30 TRP CE3 C -6.312 -5.851 -2.551 1.00 . A A . 30 TRP CE3 1 1 14 7119 1 1 30 TRP CG C -4.649 -3.813 -2.541 1.00 . A A . 30 TRP CG 1 1 14 7120 1 1 30 TRP CH2 C -8.478 -5.386 -1.544 1.00 . A A . 30 TRP CH2 1 1 14 7121 1 1 30 TRP CZ2 C -8.075 -4.075 -1.277 1.00 . A A . 30 TRP CZ2 1 1 14 7122 1 1 30 TRP CZ3 C -7.598 -6.273 -2.180 1.00 . A A . 30 TRP CZ3 1 1 14 7123 1 1 30 TRP H H -3.087 -5.631 -0.561 1.00 . A A . 30 TRP H 1 1 14 7124 1 1 30 TRP HA H -1.326 -4.616 -2.719 1.00 . A A . 30 TRP HA 1 1 14 7125 1 1 30 TRP HB2 H -3.101 -3.603 -3.967 1.00 . A A . 30 TRP HB2 1 1 14 7126 1 1 30 TRP HB3 H -3.597 -5.264 -3.670 1.00 . A A . 30 TRP HB3 1 1 14 7127 1 1 30 TRP HD1 H -4.114 -1.760 -2.097 1.00 . A A . 30 TRP HD1 1 1 14 7128 1 1 30 TRP HE1 H -6.490 -1.669 -1.121 1.00 . A A . 30 TRP HE1 1 1 14 7129 1 1 30 TRP HE3 H -5.640 -6.543 -3.040 1.00 . A A . 30 TRP HE3 1 1 14 7130 1 1 30 TRP HH2 H -9.466 -5.714 -1.262 1.00 . A A . 30 TRP HH2 1 1 14 7131 1 1 30 TRP HZ2 H -8.751 -3.388 -0.787 1.00 . A A . 30 TRP HZ2 1 1 14 7132 1 1 30 TRP HZ3 H -7.912 -7.286 -2.385 1.00 . A A . 30 TRP HZ3 1 1 14 7133 1 1 30 TRP N N -2.585 -5.702 -1.404 1.00 . A A . 30 TRP N 1 1 14 7134 1 1 30 TRP NE1 N -6.108 -2.470 -1.533 1.00 . A A . 30 TRP NE1 1 1 14 7135 1 1 30 TRP O O -2.275 -3.328 -0.072 1.00 . A A . 30 TRP O 1 1 14 7136 1 1 31 CYS C C -2.719 0.208 -1.526 1.00 . A A . 31 CYS C 1 1 14 7137 1 1 31 CYS CA C -1.714 -0.847 -1.057 1.00 . A A . 31 CYS CA 1 1 14 7138 1 1 31 CYS CB C -0.286 -0.368 -1.326 1.00 . A A . 31 CYS CB 1 1 14 7139 1 1 31 CYS H H -1.752 -2.067 -2.831 1.00 . A A . 31 CYS H 1 1 14 7140 1 1 31 CYS HA H -1.844 -1.051 -0.006 1.00 . A A . 31 CYS HA 1 1 14 7141 1 1 31 CYS HB2 H 0.386 -1.212 -1.310 1.00 . A A . 31 CYS HB2 1 1 14 7142 1 1 31 CYS HB3 H -0.242 0.108 -2.294 1.00 . A A . 31 CYS HB3 1 1 14 7143 1 1 31 CYS N N -1.860 -2.098 -1.857 1.00 . A A . 31 CYS N 1 1 14 7144 1 1 31 CYS O O -2.807 0.516 -2.702 1.00 . A A . 31 CYS O 1 1 14 7145 1 1 31 CYS SG S 0.205 0.818 -0.051 1.00 . A A . 31 CYS SG 1 1 14 7146 1 1 32 ALA C C -4.631 2.820 0.167 1.00 . A A . 32 ALA C 1 1 14 7147 1 1 32 ALA CA C -4.469 1.815 -0.980 1.00 . A A . 32 ALA CA 1 1 14 7148 1 1 32 ALA CB C -5.774 1.054 -1.226 1.00 . A A . 32 ALA CB 1 1 14 7149 1 1 32 ALA H H -3.368 0.501 0.331 1.00 . A A . 32 ALA H 1 1 14 7150 1 1 32 ALA HA H -4.162 2.322 -1.878 1.00 . A A . 32 ALA HA 1 1 14 7151 1 1 32 ALA HB1 H -5.668 0.432 -2.103 1.00 . A A . 32 ALA HB1 1 1 14 7152 1 1 32 ALA HB2 H -6.577 1.759 -1.380 1.00 . A A . 32 ALA HB2 1 1 14 7153 1 1 32 ALA HB3 H -5.997 0.433 -0.371 1.00 . A A . 32 ALA HB3 1 1 14 7154 1 1 32 ALA N N -3.469 0.767 -0.609 1.00 . A A . 32 ALA N 1 1 14 7155 1 1 32 ALA O O -4.207 2.576 1.283 1.00 . A A . 32 ALA O 1 1 14 7156 1 1 33 VAL C C -6.350 4.427 2.074 1.00 . A A . 33 VAL C 1 1 14 7157 1 1 33 VAL CA C -5.430 4.975 0.979 1.00 . A A . 33 VAL CA 1 1 14 7158 1 1 33 VAL CB C -6.078 6.185 0.293 1.00 . A A . 33 VAL CB 1 1 14 7159 1 1 33 VAL CG1 C -6.323 7.292 1.323 1.00 . A A . 33 VAL CG1 1 1 14 7160 1 1 33 VAL CG2 C -5.149 6.717 -0.801 1.00 . A A . 33 VAL CG2 1 1 14 7161 1 1 33 VAL H H -5.574 4.126 -1.004 1.00 . A A . 33 VAL H 1 1 14 7162 1 1 33 VAL HA H -4.476 5.258 1.397 1.00 . A A . 33 VAL HA 1 1 14 7163 1 1 33 VAL HB H -7.020 5.889 -0.147 1.00 . A A . 33 VAL HB 1 1 14 7164 1 1 33 VAL HG11 H -7.343 7.238 1.673 1.00 . A A . 33 VAL HG11 1 1 14 7165 1 1 33 VAL HG12 H -6.150 8.256 0.865 1.00 . A A . 33 VAL HG12 1 1 14 7166 1 1 33 VAL HG13 H -5.649 7.164 2.156 1.00 . A A . 33 VAL HG13 1 1 14 7167 1 1 33 VAL HG21 H -5.680 6.753 -1.739 1.00 . A A . 33 VAL HG21 1 1 14 7168 1 1 33 VAL HG22 H -4.296 6.063 -0.895 1.00 . A A . 33 VAL HG22 1 1 14 7169 1 1 33 VAL HG23 H -4.812 7.710 -0.539 1.00 . A A . 33 VAL HG23 1 1 14 7170 1 1 33 VAL N N -5.241 3.951 -0.097 1.00 . A A . 33 VAL N 1 1 14 7171 1 1 33 VAL O O -7.266 3.670 1.806 1.00 . A A . 33 VAL O 1 1 14 7172 1 1 34 GLU C C -8.312 5.073 4.430 1.00 . A A . 34 GLU C 1 1 14 7173 1 1 34 GLU CA C -6.980 4.313 4.421 1.00 . A A . 34 GLU CA 1 1 14 7174 1 1 34 GLU CB C -6.185 4.592 5.702 1.00 . A A . 34 GLU CB 1 1 14 7175 1 1 34 GLU CD C -5.654 2.908 7.474 1.00 . A A . 34 GLU CD 1 1 14 7176 1 1 34 GLU CG C -5.329 3.372 6.052 1.00 . A A . 34 GLU CG 1 1 14 7177 1 1 34 GLU H H -5.375 5.420 3.495 1.00 . A A . 34 GLU H 1 1 14 7178 1 1 34 GLU HA H -7.153 3.253 4.318 1.00 . A A . 34 GLU HA 1 1 14 7179 1 1 34 GLU HB2 H -5.546 5.449 5.548 1.00 . A A . 34 GLU HB2 1 1 14 7180 1 1 34 GLU HB3 H -6.870 4.794 6.512 1.00 . A A . 34 GLU HB3 1 1 14 7181 1 1 34 GLU HG2 H -5.540 2.572 5.354 1.00 . A A . 34 GLU HG2 1 1 14 7182 1 1 34 GLU HG3 H -4.284 3.636 5.990 1.00 . A A . 34 GLU HG3 1 1 14 7183 1 1 34 GLU N N -6.117 4.807 3.305 1.00 . A A . 34 GLU N 1 1 14 7184 1 1 34 GLU O O -8.482 6.039 5.151 1.00 . A A . 34 GLU O 1 1 14 7185 1 1 34 GLU OE1 O -6.600 2.150 7.627 1.00 . A A . 34 GLU OE1 1 1 14 7186 1 1 34 GLU OE2 O -4.954 3.320 8.385 1.00 . A A . 34 GLU OE2 1 1 14 7187 1 1 35 ALA C C -11.322 5.177 4.922 1.00 . A A . 35 ALA C 1 1 14 7188 1 1 35 ALA CA C -10.582 5.335 3.582 1.00 . A A . 35 ALA CA 1 1 14 7189 1 1 35 ALA CB C -11.356 4.658 2.443 1.00 . A A . 35 ALA CB 1 1 14 7190 1 1 35 ALA H H -9.091 3.863 3.059 1.00 . A A . 35 ALA H 1 1 14 7191 1 1 35 ALA HA H -10.446 6.381 3.356 1.00 . A A . 35 ALA HA 1 1 14 7192 1 1 35 ALA HB1 H -10.970 3.663 2.284 1.00 . A A . 35 ALA HB1 1 1 14 7193 1 1 35 ALA HB2 H -11.245 5.238 1.539 1.00 . A A . 35 ALA HB2 1 1 14 7194 1 1 35 ALA HB3 H -12.403 4.599 2.705 1.00 . A A . 35 ALA HB3 1 1 14 7195 1 1 35 ALA N N -9.256 4.643 3.630 1.00 . A A . 35 ALA N 1 1 14 7196 1 1 35 ALA O O -11.666 6.165 5.544 1.00 . A A . 35 ALA O 1 1 14 7197 1 1 36 PRO C C -11.331 4.047 7.810 1.00 . A A . 36 PRO C 1 1 14 7198 1 1 36 PRO CA C -12.240 3.692 6.623 1.00 . A A . 36 PRO CA 1 1 14 7199 1 1 36 PRO CB C -12.535 2.194 6.586 1.00 . A A . 36 PRO CB 1 1 14 7200 1 1 36 PRO CD C -11.167 2.689 4.662 1.00 . A A . 36 PRO CD 1 1 14 7201 1 1 36 PRO CG C -11.505 1.620 5.666 1.00 . A A . 36 PRO CG 1 1 14 7202 1 1 36 PRO HA H -13.162 4.249 6.668 1.00 . A A . 36 PRO HA 1 1 14 7203 1 1 36 PRO HB2 H -12.438 1.769 7.576 1.00 . A A . 36 PRO HB2 1 1 14 7204 1 1 36 PRO HB3 H -13.522 2.014 6.192 1.00 . A A . 36 PRO HB3 1 1 14 7205 1 1 36 PRO HD2 H -10.110 2.674 4.438 1.00 . A A . 36 PRO HD2 1 1 14 7206 1 1 36 PRO HD3 H -11.750 2.563 3.763 1.00 . A A . 36 PRO HD3 1 1 14 7207 1 1 36 PRO HG2 H -10.623 1.344 6.228 1.00 . A A . 36 PRO HG2 1 1 14 7208 1 1 36 PRO HG3 H -11.905 0.756 5.158 1.00 . A A . 36 PRO HG3 1 1 14 7209 1 1 36 PRO N N -11.540 3.945 5.335 1.00 . A A . 36 PRO N 1 1 14 7210 1 1 36 PRO O O -11.819 4.674 8.734 1.00 . A A . 36 PRO O 1 1 15 7211 1 1 1 ASP C C 12.275 6.707 2.091 1.00 . A A . 1 ASP C 1 1 15 7212 1 1 1 ASP CA C 13.340 5.614 2.225 1.00 . A A . 1 ASP CA 1 1 15 7213 1 1 1 ASP CB C 12.748 4.373 2.899 1.00 . A A . 1 ASP CB 1 1 15 7214 1 1 1 ASP CG C 13.321 3.114 2.245 1.00 . A A . 1 ASP CG 1 1 15 7215 1 1 1 ASP H1 H 15.110 5.284 3.279 1.00 . A A . 1 ASP H1 1 1 15 7216 1 1 1 ASP H2 H 14.044 6.370 4.039 1.00 . A A . 1 ASP H2 1 1 15 7217 1 1 1 ASP H3 H 14.944 6.865 2.684 1.00 . A A . 1 ASP H3 1 1 15 7218 1 1 1 ASP HA H 13.732 5.352 1.254 1.00 . A A . 1 ASP HA 1 1 15 7219 1 1 1 ASP HB2 H 12.998 4.381 3.950 1.00 . A A . 1 ASP HB2 1 1 15 7220 1 1 1 ASP HB3 H 11.674 4.378 2.785 1.00 . A A . 1 ASP HB3 1 1 15 7221 1 1 1 ASP N N 14.443 6.068 3.126 1.00 . A A . 1 ASP N 1 1 15 7222 1 1 1 ASP O O 11.920 7.364 3.053 1.00 . A A . 1 ASP O 1 1 15 7223 1 1 1 ASP OD1 O 12.754 2.671 1.258 1.00 . A A . 1 ASP OD1 1 1 15 7224 1 1 1 ASP OD2 O 14.317 2.614 2.742 1.00 . A A . 1 ASP OD2 1 1 15 7225 1 1 2 GLY C C 10.215 7.889 -0.749 1.00 . A A . 2 GLY C 1 1 15 7226 1 1 2 GLY CA C 10.719 7.947 0.695 1.00 . A A . 2 GLY CA 1 1 15 7227 1 1 2 GLY H H 12.067 6.357 0.146 1.00 . A A . 2 GLY H 1 1 15 7228 1 1 2 GLY HA2 H 9.895 7.772 1.371 1.00 . A A . 2 GLY HA2 1 1 15 7229 1 1 2 GLY HA3 H 11.140 8.922 0.885 1.00 . A A . 2 GLY HA3 1 1 15 7230 1 1 2 GLY N N 11.763 6.902 0.903 1.00 . A A . 2 GLY N 1 1 15 7231 1 1 2 GLY O O 10.436 8.797 -1.528 1.00 . A A . 2 GLY O 1 1 15 7232 1 1 3 GLU C C 7.504 6.464 -2.490 1.00 . A A . 3 GLU C 1 1 15 7233 1 1 3 GLU CA C 9.020 6.700 -2.504 1.00 . A A . 3 GLU CA 1 1 15 7234 1 1 3 GLU CB C 9.750 5.490 -3.093 1.00 . A A . 3 GLU CB 1 1 15 7235 1 1 3 GLU CD C 10.450 4.863 -5.409 1.00 . A A . 3 GLU CD 1 1 15 7236 1 1 3 GLU CG C 10.560 5.929 -4.315 1.00 . A A . 3 GLU CG 1 1 15 7237 1 1 3 GLU H H 9.378 6.107 -0.460 1.00 . A A . 3 GLU H 1 1 15 7238 1 1 3 GLU HA H 9.256 7.583 -3.072 1.00 . A A . 3 GLU HA 1 1 15 7239 1 1 3 GLU HB2 H 10.415 5.072 -2.351 1.00 . A A . 3 GLU HB2 1 1 15 7240 1 1 3 GLU HB3 H 9.029 4.743 -3.390 1.00 . A A . 3 GLU HB3 1 1 15 7241 1 1 3 GLU HG2 H 10.172 6.867 -4.686 1.00 . A A . 3 GLU HG2 1 1 15 7242 1 1 3 GLU HG3 H 11.595 6.051 -4.037 1.00 . A A . 3 GLU HG3 1 1 15 7243 1 1 3 GLU N N 9.540 6.825 -1.108 1.00 . A A . 3 GLU N 1 1 15 7244 1 1 3 GLU O O 6.900 6.307 -1.446 1.00 . A A . 3 GLU O 1 1 15 7245 1 1 3 GLU OE1 O 9.492 4.912 -6.165 1.00 . A A . 3 GLU OE1 1 1 15 7246 1 1 3 GLU OE2 O 11.325 4.015 -5.472 1.00 . A A . 3 GLU OE2 1 1 15 7247 1 1 4 CYS C C 5.071 5.229 -4.827 1.00 . A A . 4 CYS C 1 1 15 7248 1 1 4 CYS CA C 5.415 6.220 -3.710 1.00 . A A . 4 CYS CA 1 1 15 7249 1 1 4 CYS CB C 4.817 7.603 -4.003 1.00 . A A . 4 CYS CB 1 1 15 7250 1 1 4 CYS H H 7.400 6.575 -4.474 1.00 . A A . 4 CYS H 1 1 15 7251 1 1 4 CYS HA H 5.050 5.859 -2.762 1.00 . A A . 4 CYS HA 1 1 15 7252 1 1 4 CYS HB2 H 4.579 8.090 -3.071 1.00 . A A . 4 CYS HB2 1 1 15 7253 1 1 4 CYS HB3 H 5.537 8.195 -4.544 1.00 . A A . 4 CYS HB3 1 1 15 7254 1 1 4 CYS N N 6.890 6.443 -3.647 1.00 . A A . 4 CYS N 1 1 15 7255 1 1 4 CYS O O 5.809 5.064 -5.779 1.00 . A A . 4 CYS O 1 1 15 7256 1 1 4 CYS SG S 3.306 7.442 -4.995 1.00 . A A . 4 CYS SG 1 1 15 7257 1 1 5 GLY C C 2.286 4.183 -6.474 1.00 . A A . 5 GLY C 1 1 15 7258 1 1 5 GLY CA C 3.508 3.614 -5.752 1.00 . A A . 5 GLY CA 1 1 15 7259 1 1 5 GLY H H 3.364 4.756 -3.938 1.00 . A A . 5 GLY H 1 1 15 7260 1 1 5 GLY HA2 H 4.311 3.459 -6.457 1.00 . A A . 5 GLY HA2 1 1 15 7261 1 1 5 GLY HA3 H 3.245 2.678 -5.285 1.00 . A A . 5 GLY HA3 1 1 15 7262 1 1 5 GLY N N 3.940 4.586 -4.711 1.00 . A A . 5 GLY N 1 1 15 7263 1 1 5 GLY O O 2.407 5.020 -7.347 1.00 . A A . 5 GLY O 1 1 15 7264 1 1 6 GLY C C -1.276 4.239 -5.734 1.00 . A A . 6 GLY C 1 1 15 7265 1 1 6 GLY CA C -0.127 4.261 -6.749 1.00 . A A . 6 GLY CA 1 1 15 7266 1 1 6 GLY H H 1.048 3.075 -5.391 1.00 . A A . 6 GLY H 1 1 15 7267 1 1 6 GLY HA2 H 0.039 5.274 -7.088 1.00 . A A . 6 GLY HA2 1 1 15 7268 1 1 6 GLY HA3 H -0.384 3.638 -7.590 1.00 . A A . 6 GLY HA3 1 1 15 7269 1 1 6 GLY N N 1.113 3.744 -6.102 1.00 . A A . 6 GLY N 1 1 15 7270 1 1 6 GLY O O -1.056 4.291 -4.538 1.00 . A A . 6 GLY O 1 1 15 7271 1 1 7 PHE C C -4.028 2.700 -4.895 1.00 . A A . 7 PHE C 1 1 15 7272 1 1 7 PHE CA C -3.663 4.143 -5.262 1.00 . A A . 7 PHE CA 1 1 15 7273 1 1 7 PHE CB C -4.810 4.828 -6.020 1.00 . A A . 7 PHE CB 1 1 15 7274 1 1 7 PHE CD1 C -3.475 6.969 -5.806 1.00 . A A . 7 PHE CD1 1 1 15 7275 1 1 7 PHE CD2 C -4.775 6.599 -7.820 1.00 . A A . 7 PHE CD2 1 1 15 7276 1 1 7 PHE CE1 C -3.043 8.199 -6.309 1.00 . A A . 7 PHE CE1 1 1 15 7277 1 1 7 PHE CE2 C -4.342 7.831 -8.324 1.00 . A A . 7 PHE CE2 1 1 15 7278 1 1 7 PHE CG C -4.343 6.166 -6.561 1.00 . A A . 7 PHE CG 1 1 15 7279 1 1 7 PHE CZ C -3.476 8.631 -7.568 1.00 . A A . 7 PHE CZ 1 1 15 7280 1 1 7 PHE H H -2.645 4.127 -7.169 1.00 . A A . 7 PHE H 1 1 15 7281 1 1 7 PHE HA H -3.433 4.697 -4.369 1.00 . A A . 7 PHE HA 1 1 15 7282 1 1 7 PHE HB2 H -5.124 4.200 -6.839 1.00 . A A . 7 PHE HB2 1 1 15 7283 1 1 7 PHE HB3 H -5.641 4.984 -5.348 1.00 . A A . 7 PHE HB3 1 1 15 7284 1 1 7 PHE HD1 H -3.140 6.636 -4.835 1.00 . A A . 7 PHE HD1 1 1 15 7285 1 1 7 PHE HD2 H -5.443 5.982 -8.402 1.00 . A A . 7 PHE HD2 1 1 15 7286 1 1 7 PHE HE1 H -2.375 8.817 -5.727 1.00 . A A . 7 PHE HE1 1 1 15 7287 1 1 7 PHE HE2 H -4.676 8.165 -9.294 1.00 . A A . 7 PHE HE2 1 1 15 7288 1 1 7 PHE HZ H -3.141 9.581 -7.957 1.00 . A A . 7 PHE HZ 1 1 15 7289 1 1 7 PHE N N -2.495 4.166 -6.200 1.00 . A A . 7 PHE N 1 1 15 7290 1 1 7 PHE O O -4.511 2.434 -3.813 1.00 . A A . 7 PHE O 1 1 15 7291 1 1 8 TRP C C -3.034 -0.560 -6.102 1.00 . A A . 8 TRP C 1 1 15 7292 1 1 8 TRP CA C -4.116 0.345 -5.492 1.00 . A A . 8 TRP CA 1 1 15 7293 1 1 8 TRP CB C -5.477 0.108 -6.157 1.00 . A A . 8 TRP CB 1 1 15 7294 1 1 8 TRP CD1 C -5.798 -2.195 -5.149 1.00 . A A . 8 TRP CD1 1 1 15 7295 1 1 8 TRP CD2 C -7.574 -0.851 -4.828 1.00 . A A . 8 TRP CD2 1 1 15 7296 1 1 8 TRP CE2 C -7.889 -2.091 -4.223 1.00 . A A . 8 TRP CE2 1 1 15 7297 1 1 8 TRP CE3 C -8.533 0.178 -4.768 1.00 . A A . 8 TRP CE3 1 1 15 7298 1 1 8 TRP CG C -6.241 -0.941 -5.408 1.00 . A A . 8 TRP CG 1 1 15 7299 1 1 8 TRP CH2 C -10.050 -1.272 -3.531 1.00 . A A . 8 TRP CH2 1 1 15 7300 1 1 8 TRP CZ2 C -9.110 -2.304 -3.582 1.00 . A A . 8 TRP CZ2 1 1 15 7301 1 1 8 TRP CZ3 C -9.763 -0.033 -4.121 1.00 . A A . 8 TRP CZ3 1 1 15 7302 1 1 8 TRP H H -3.400 2.013 -6.651 1.00 . A A . 8 TRP H 1 1 15 7303 1 1 8 TRP HA H -4.189 0.186 -4.426 1.00 . A A . 8 TRP HA 1 1 15 7304 1 1 8 TRP HB2 H -6.041 1.029 -6.155 1.00 . A A . 8 TRP HB2 1 1 15 7305 1 1 8 TRP HB3 H -5.328 -0.217 -7.176 1.00 . A A . 8 TRP HB3 1 1 15 7306 1 1 8 TRP HD1 H -4.840 -2.596 -5.443 1.00 . A A . 8 TRP HD1 1 1 15 7307 1 1 8 TRP HE1 H -6.706 -3.804 -4.138 1.00 . A A . 8 TRP HE1 1 1 15 7308 1 1 8 TRP HE3 H -8.321 1.135 -5.219 1.00 . A A . 8 TRP HE3 1 1 15 7309 1 1 8 TRP HH2 H -10.998 -1.428 -3.038 1.00 . A A . 8 TRP HH2 1 1 15 7310 1 1 8 TRP HZ2 H -9.327 -3.259 -3.128 1.00 . A A . 8 TRP HZ2 1 1 15 7311 1 1 8 TRP HZ3 H -10.491 0.763 -4.082 1.00 . A A . 8 TRP HZ3 1 1 15 7312 1 1 8 TRP N N -3.793 1.772 -5.785 1.00 . A A . 8 TRP N 1 1 15 7313 1 1 8 TRP NE1 N -6.776 -2.876 -4.447 1.00 . A A . 8 TRP NE1 1 1 15 7314 1 1 8 TRP O O -3.275 -1.284 -7.052 1.00 . A A . 8 TRP O 1 1 15 7315 1 1 9 TRP C C -0.565 -2.619 -5.255 1.00 . A A . 9 TRP C 1 1 15 7316 1 1 9 TRP CA C -0.731 -1.364 -6.114 1.00 . A A . 9 TRP CA 1 1 15 7317 1 1 9 TRP CB C 0.524 -0.486 -6.037 1.00 . A A . 9 TRP CB 1 1 15 7318 1 1 9 TRP CD1 C -0.563 0.973 -7.805 1.00 . A A . 9 TRP CD1 1 1 15 7319 1 1 9 TRP CD2 C 1.681 1.121 -7.818 1.00 . A A . 9 TRP CD2 1 1 15 7320 1 1 9 TRP CE2 C 1.210 1.979 -8.837 1.00 . A A . 9 TRP CE2 1 1 15 7321 1 1 9 TRP CE3 C 3.071 1.030 -7.618 1.00 . A A . 9 TRP CE3 1 1 15 7322 1 1 9 TRP CG C 0.536 0.492 -7.173 1.00 . A A . 9 TRP CG 1 1 15 7323 1 1 9 TRP CH2 C 3.459 2.624 -9.417 1.00 . A A . 9 TRP CH2 1 1 15 7324 1 1 9 TRP CZ2 C 2.081 2.723 -9.627 1.00 . A A . 9 TRP CZ2 1 1 15 7325 1 1 9 TRP CZ3 C 3.954 1.779 -8.415 1.00 . A A . 9 TRP CZ3 1 1 15 7326 1 1 9 TRP H H -1.670 0.080 -4.798 1.00 . A A . 9 TRP H 1 1 15 7327 1 1 9 TRP HA H -0.933 -1.632 -7.140 1.00 . A A . 9 TRP HA 1 1 15 7328 1 1 9 TRP HB2 H 0.528 0.053 -5.101 1.00 . A A . 9 TRP HB2 1 1 15 7329 1 1 9 TRP HB3 H 1.403 -1.111 -6.094 1.00 . A A . 9 TRP HB3 1 1 15 7330 1 1 9 TRP HD1 H -1.586 0.712 -7.577 1.00 . A A . 9 TRP HD1 1 1 15 7331 1 1 9 TRP HE1 H -0.763 2.339 -9.393 1.00 . A A . 9 TRP HE1 1 1 15 7332 1 1 9 TRP HE3 H 3.463 0.381 -6.849 1.00 . A A . 9 TRP HE3 1 1 15 7333 1 1 9 TRP HH2 H 4.140 3.198 -10.027 1.00 . A A . 9 TRP HH2 1 1 15 7334 1 1 9 TRP HZ2 H 1.694 3.376 -10.392 1.00 . A A . 9 TRP HZ2 1 1 15 7335 1 1 9 TRP HZ3 H 5.019 1.704 -8.255 1.00 . A A . 9 TRP HZ3 1 1 15 7336 1 1 9 TRP N N -1.839 -0.515 -5.564 1.00 . A A . 9 TRP N 1 1 15 7337 1 1 9 TRP NE1 N -0.163 1.852 -8.792 1.00 . A A . 9 TRP NE1 1 1 15 7338 1 1 9 TRP O O -0.903 -2.619 -4.097 1.00 . A A . 9 TRP O 1 1 15 7339 1 1 10 LYS C C 1.452 -4.959 -4.279 1.00 . A A . 10 LYS C 1 1 15 7340 1 1 10 LYS CA C 0.105 -4.938 -4.996 1.00 . A A . 10 LYS CA 1 1 15 7341 1 1 10 LYS CB C 0.030 -6.091 -5.991 1.00 . A A . 10 LYS CB 1 1 15 7342 1 1 10 LYS CD C -1.861 -6.755 -7.495 1.00 . A A . 10 LYS CD 1 1 15 7343 1 1 10 LYS CE C -1.804 -8.224 -7.931 1.00 . A A . 10 LYS CE 1 1 15 7344 1 1 10 LYS CG C -1.400 -6.633 -6.039 1.00 . A A . 10 LYS CG 1 1 15 7345 1 1 10 LYS H H 0.213 -3.677 -6.752 1.00 . A A . 10 LYS H 1 1 15 7346 1 1 10 LYS HA H -0.697 -5.021 -4.282 1.00 . A A . 10 LYS HA 1 1 15 7347 1 1 10 LYS HB2 H 0.323 -5.741 -6.970 1.00 . A A . 10 LYS HB2 1 1 15 7348 1 1 10 LYS HB3 H 0.702 -6.878 -5.676 1.00 . A A . 10 LYS HB3 1 1 15 7349 1 1 10 LYS HD2 H -2.874 -6.392 -7.582 1.00 . A A . 10 LYS HD2 1 1 15 7350 1 1 10 LYS HD3 H -1.213 -6.168 -8.128 1.00 . A A . 10 LYS HD3 1 1 15 7351 1 1 10 LYS HE2 H -1.723 -8.290 -9.007 1.00 . A A . 10 LYS HE2 1 1 15 7352 1 1 10 LYS HE3 H -0.968 -8.722 -7.462 1.00 . A A . 10 LYS HE3 1 1 15 7353 1 1 10 LYS HG2 H -1.431 -7.606 -5.568 1.00 . A A . 10 LYS HG2 1 1 15 7354 1 1 10 LYS HG3 H -2.058 -5.958 -5.511 1.00 . A A . 10 LYS HG3 1 1 15 7355 1 1 10 LYS HZ1 H -3.577 -8.182 -6.820 1.00 . A A . 10 LYS HZ1 1 1 15 7356 1 1 10 LYS HZ2 H -2.886 -9.726 -6.971 1.00 . A A . 10 LYS HZ2 1 1 15 7357 1 1 10 LYS HZ3 H -3.695 -9.025 -8.289 1.00 . A A . 10 LYS HZ3 1 1 15 7358 1 1 10 LYS N N -0.055 -3.689 -5.809 1.00 . A A . 10 LYS N 1 1 15 7359 1 1 10 LYS NZ N -3.087 -8.834 -7.466 1.00 . A A . 10 LYS NZ 1 1 15 7360 1 1 10 LYS O O 2.483 -4.666 -4.857 1.00 . A A . 10 LYS O 1 1 15 7361 1 1 11 CYS C C 2.633 -6.443 -1.146 1.00 . A A . 11 CYS C 1 1 15 7362 1 1 11 CYS CA C 2.723 -5.380 -2.249 1.00 . A A . 11 CYS CA 1 1 15 7363 1 1 11 CYS CB C 2.894 -3.986 -1.640 1.00 . A A . 11 CYS CB 1 1 15 7364 1 1 11 CYS H H 0.604 -5.561 -2.585 1.00 . A A . 11 CYS H 1 1 15 7365 1 1 11 CYS HA H 3.542 -5.598 -2.916 1.00 . A A . 11 CYS HA 1 1 15 7366 1 1 11 CYS HB2 H 3.836 -3.938 -1.119 1.00 . A A . 11 CYS HB2 1 1 15 7367 1 1 11 CYS HB3 H 2.881 -3.247 -2.426 1.00 . A A . 11 CYS HB3 1 1 15 7368 1 1 11 CYS N N 1.450 -5.319 -3.021 1.00 . A A . 11 CYS N 1 1 15 7369 1 1 11 CYS O O 1.602 -7.059 -0.945 1.00 . A A . 11 CYS O 1 1 15 7370 1 1 11 CYS SG S 1.554 -3.647 -0.473 1.00 . A A . 11 CYS SG 1 1 15 7371 1 1 12 GLY C C 3.035 -7.030 1.916 1.00 . A A . 12 GLY C 1 1 15 7372 1 1 12 GLY CA C 3.687 -7.657 0.681 1.00 . A A . 12 GLY CA 1 1 15 7373 1 1 12 GLY H H 4.521 -6.135 -0.595 1.00 . A A . 12 GLY H 1 1 15 7374 1 1 12 GLY HA2 H 3.122 -8.523 0.369 1.00 . A A . 12 GLY HA2 1 1 15 7375 1 1 12 GLY HA3 H 4.698 -7.949 0.921 1.00 . A A . 12 GLY HA3 1 1 15 7376 1 1 12 GLY N N 3.706 -6.650 -0.421 1.00 . A A . 12 GLY N 1 1 15 7377 1 1 12 GLY O O 1.898 -6.601 1.873 1.00 . A A . 12 GLY O 1 1 15 7378 1 1 13 ARG C C 3.430 -4.827 4.218 1.00 . A A . 13 ARG C 1 1 15 7379 1 1 13 ARG CA C 3.173 -6.337 4.238 1.00 . A A . 13 ARG CA 1 1 15 7380 1 1 13 ARG CB C 3.900 -6.999 5.413 1.00 . A A . 13 ARG CB 1 1 15 7381 1 1 13 ARG CD C 3.430 -5.807 7.565 1.00 . A A . 13 ARG CD 1 1 15 7382 1 1 13 ARG CG C 3.004 -6.963 6.654 1.00 . A A . 13 ARG CG 1 1 15 7383 1 1 13 ARG CZ C 3.583 -6.234 9.948 1.00 . A A . 13 ARG CZ 1 1 15 7384 1 1 13 ARG H H 4.670 -7.299 3.016 1.00 . A A . 13 ARG H 1 1 15 7385 1 1 13 ARG HA H 2.120 -6.533 4.295 1.00 . A A . 13 ARG HA 1 1 15 7386 1 1 13 ARG HB2 H 4.128 -8.026 5.162 1.00 . A A . 13 ARG HB2 1 1 15 7387 1 1 13 ARG HB3 H 4.816 -6.467 5.617 1.00 . A A . 13 ARG HB3 1 1 15 7388 1 1 13 ARG HD2 H 4.509 -5.769 7.642 1.00 . A A . 13 ARG HD2 1 1 15 7389 1 1 13 ARG HD3 H 3.045 -4.872 7.190 1.00 . A A . 13 ARG HD3 1 1 15 7390 1 1 13 ARG HE H 1.853 -6.232 8.970 1.00 . A A . 13 ARG HE 1 1 15 7391 1 1 13 ARG HG2 H 1.977 -6.823 6.352 1.00 . A A . 13 ARG HG2 1 1 15 7392 1 1 13 ARG HG3 H 3.096 -7.895 7.191 1.00 . A A . 13 ARG HG3 1 1 15 7393 1 1 13 ARG HH11 H 4.405 -7.965 9.359 1.00 . A A . 13 ARG HH11 1 1 15 7394 1 1 13 ARG HH12 H 4.960 -7.353 10.881 1.00 . A A . 13 ARG HH12 1 1 15 7395 1 1 13 ARG HH21 H 2.939 -4.531 10.789 1.00 . A A . 13 ARG HH21 1 1 15 7396 1 1 13 ARG HH22 H 4.129 -5.409 11.692 1.00 . A A . 13 ARG HH22 1 1 15 7397 1 1 13 ARG N N 3.750 -6.959 3.008 1.00 . A A . 13 ARG N 1 1 15 7398 1 1 13 ARG NE N 2.823 -6.117 8.891 1.00 . A A . 13 ARG NE 1 1 15 7399 1 1 13 ARG NH1 N 4.377 -7.265 10.072 1.00 . A A . 13 ARG NH1 1 1 15 7400 1 1 13 ARG NH2 N 3.547 -5.320 10.882 1.00 . A A . 13 ARG NH2 1 1 15 7401 1 1 13 ARG O O 2.588 -4.039 4.607 1.00 . A A . 13 ARG O 1 1 15 7402 1 1 14 GLY C C 6.262 -2.795 2.974 1.00 . A A . 14 GLY C 1 1 15 7403 1 1 14 GLY CA C 4.919 -2.977 3.687 1.00 . A A . 14 GLY CA 1 1 15 7404 1 1 14 GLY H H 5.235 -5.093 3.446 1.00 . A A . 14 GLY H 1 1 15 7405 1 1 14 GLY HA2 H 4.145 -2.456 3.142 1.00 . A A . 14 GLY HA2 1 1 15 7406 1 1 14 GLY HA3 H 4.988 -2.575 4.688 1.00 . A A . 14 GLY HA3 1 1 15 7407 1 1 14 GLY N N 4.585 -4.429 3.756 1.00 . A A . 14 GLY N 1 1 15 7408 1 1 14 GLY O O 7.057 -1.954 3.348 1.00 . A A . 14 GLY O 1 1 15 7409 1 1 15 LYS C C 7.857 -2.169 0.376 1.00 . A A . 15 LYS C 1 1 15 7410 1 1 15 LYS CA C 7.831 -3.453 1.230 1.00 . A A . 15 LYS CA 1 1 15 7411 1 1 15 LYS CB C 7.953 -4.715 0.367 1.00 . A A . 15 LYS CB 1 1 15 7412 1 1 15 LYS CD C 8.186 -7.163 0.826 1.00 . A A . 15 LYS CD 1 1 15 7413 1 1 15 LYS CE C 8.634 -7.626 -0.566 1.00 . A A . 15 LYS CE 1 1 15 7414 1 1 15 LYS CG C 8.762 -5.774 1.118 1.00 . A A . 15 LYS CG 1 1 15 7415 1 1 15 LYS H H 5.869 -4.264 1.678 1.00 . A A . 15 LYS H 1 1 15 7416 1 1 15 LYS HA H 8.637 -3.427 1.939 1.00 . A A . 15 LYS HA 1 1 15 7417 1 1 15 LYS HB2 H 6.966 -5.099 0.152 1.00 . A A . 15 LYS HB2 1 1 15 7418 1 1 15 LYS HB3 H 8.454 -4.471 -0.557 1.00 . A A . 15 LYS HB3 1 1 15 7419 1 1 15 LYS HD2 H 8.540 -7.862 1.569 1.00 . A A . 15 LYS HD2 1 1 15 7420 1 1 15 LYS HD3 H 7.107 -7.120 0.860 1.00 . A A . 15 LYS HD3 1 1 15 7421 1 1 15 LYS HE2 H 9.515 -7.080 -0.875 1.00 . A A . 15 LYS HE2 1 1 15 7422 1 1 15 LYS HE3 H 8.832 -8.686 -0.562 1.00 . A A . 15 LYS HE3 1 1 15 7423 1 1 15 LYS HG2 H 9.792 -5.736 0.796 1.00 . A A . 15 LYS HG2 1 1 15 7424 1 1 15 LYS HG3 H 8.710 -5.582 2.180 1.00 . A A . 15 LYS HG3 1 1 15 7425 1 1 15 LYS HZ1 H 7.626 -7.810 -2.379 1.00 . A A . 15 LYS HZ1 1 1 15 7426 1 1 15 LYS HZ2 H 7.437 -6.296 -1.635 1.00 . A A . 15 LYS HZ2 1 1 15 7427 1 1 15 LYS HZ3 H 6.602 -7.650 -1.038 1.00 . A A . 15 LYS HZ3 1 1 15 7428 1 1 15 LYS N N 6.526 -3.583 1.957 1.00 . A A . 15 LYS N 1 1 15 7429 1 1 15 LYS NZ N 7.489 -7.322 -1.472 1.00 . A A . 15 LYS NZ 1 1 15 7430 1 1 15 LYS O O 8.574 -1.242 0.699 1.00 . A A . 15 LYS O 1 1 15 7431 1 1 16 PRO C C 6.240 0.180 -0.856 1.00 . A A . 16 PRO C 1 1 15 7432 1 1 16 PRO CA C 7.016 -0.943 -1.556 1.00 . A A . 16 PRO CA 1 1 15 7433 1 1 16 PRO CB C 6.270 -1.432 -2.794 1.00 . A A . 16 PRO CB 1 1 15 7434 1 1 16 PRO CD C 6.174 -3.203 -1.152 1.00 . A A . 16 PRO CD 1 1 15 7435 1 1 16 PRO CG C 5.447 -2.584 -2.319 1.00 . A A . 16 PRO CG 1 1 15 7436 1 1 16 PRO HA H 8.009 -0.621 -1.823 1.00 . A A . 16 PRO HA 1 1 15 7437 1 1 16 PRO HB2 H 5.636 -0.648 -3.181 1.00 . A A . 16 PRO HB2 1 1 15 7438 1 1 16 PRO HB3 H 6.968 -1.763 -3.548 1.00 . A A . 16 PRO HB3 1 1 15 7439 1 1 16 PRO HD2 H 5.477 -3.483 -0.373 1.00 . A A . 16 PRO HD2 1 1 15 7440 1 1 16 PRO HD3 H 6.750 -4.056 -1.472 1.00 . A A . 16 PRO HD3 1 1 15 7441 1 1 16 PRO HG2 H 4.475 -2.233 -2.005 1.00 . A A . 16 PRO HG2 1 1 15 7442 1 1 16 PRO HG3 H 5.342 -3.313 -3.109 1.00 . A A . 16 PRO HG3 1 1 15 7443 1 1 16 PRO N N 7.070 -2.143 -0.680 1.00 . A A . 16 PRO N 1 1 15 7444 1 1 16 PRO O O 5.119 -0.023 -0.426 1.00 . A A . 16 PRO O 1 1 15 7445 1 1 17 PRO C C 5.140 3.112 -0.949 1.00 . A A . 17 PRO C 1 1 15 7446 1 1 17 PRO CA C 6.228 2.481 -0.071 1.00 . A A . 17 PRO CA 1 1 15 7447 1 1 17 PRO CB C 7.380 3.460 0.137 1.00 . A A . 17 PRO CB 1 1 15 7448 1 1 17 PRO CD C 8.220 1.651 -1.231 1.00 . A A . 17 PRO CD 1 1 15 7449 1 1 17 PRO CG C 8.379 3.118 -0.924 1.00 . A A . 17 PRO CG 1 1 15 7450 1 1 17 PRO HA H 5.822 2.187 0.884 1.00 . A A . 17 PRO HA 1 1 15 7451 1 1 17 PRO HB2 H 7.034 4.478 0.016 1.00 . A A . 17 PRO HB2 1 1 15 7452 1 1 17 PRO HB3 H 7.818 3.325 1.112 1.00 . A A . 17 PRO HB3 1 1 15 7453 1 1 17 PRO HD2 H 8.296 1.479 -2.297 1.00 . A A . 17 PRO HD2 1 1 15 7454 1 1 17 PRO HD3 H 8.956 1.071 -0.698 1.00 . A A . 17 PRO HD3 1 1 15 7455 1 1 17 PRO HG2 H 8.186 3.708 -1.811 1.00 . A A . 17 PRO HG2 1 1 15 7456 1 1 17 PRO HG3 H 9.378 3.309 -0.566 1.00 . A A . 17 PRO HG3 1 1 15 7457 1 1 17 PRO N N 6.869 1.325 -0.746 1.00 . A A . 17 PRO N 1 1 15 7458 1 1 17 PRO O O 5.430 3.841 -1.878 1.00 . A A . 17 PRO O 1 1 15 7459 1 1 18 CYS C C 2.831 5.002 -1.235 1.00 . A A . 18 CYS C 1 1 15 7460 1 1 18 CYS CA C 2.784 3.478 -1.439 1.00 . A A . 18 CYS CA 1 1 15 7461 1 1 18 CYS CB C 1.487 2.888 -0.865 1.00 . A A . 18 CYS CB 1 1 15 7462 1 1 18 CYS H H 3.680 2.286 0.121 1.00 . A A . 18 CYS H 1 1 15 7463 1 1 18 CYS HA H 2.882 3.230 -2.485 1.00 . A A . 18 CYS HA 1 1 15 7464 1 1 18 CYS HB2 H 1.689 1.916 -0.442 1.00 . A A . 18 CYS HB2 1 1 15 7465 1 1 18 CYS HB3 H 1.109 3.541 -0.090 1.00 . A A . 18 CYS HB3 1 1 15 7466 1 1 18 CYS N N 3.890 2.860 -0.644 1.00 . A A . 18 CYS N 1 1 15 7467 1 1 18 CYS O O 3.492 5.486 -0.335 1.00 . A A . 18 CYS O 1 1 15 7468 1 1 18 CYS SG S 0.239 2.727 -2.173 1.00 . A A . 18 CYS SG 1 1 15 7469 1 1 19 CYS C C 1.813 7.650 -0.465 1.00 . A A . 19 CYS C 1 1 15 7470 1 1 19 CYS CA C 2.189 7.255 -1.898 1.00 . A A . 19 CYS CA 1 1 15 7471 1 1 19 CYS CB C 1.161 7.800 -2.892 1.00 . A A . 19 CYS CB 1 1 15 7472 1 1 19 CYS H H 1.638 5.360 -2.788 1.00 . A A . 19 CYS H 1 1 15 7473 1 1 19 CYS HA H 3.168 7.633 -2.141 1.00 . A A . 19 CYS HA 1 1 15 7474 1 1 19 CYS HB2 H 0.630 6.979 -3.350 1.00 . A A . 19 CYS HB2 1 1 15 7475 1 1 19 CYS HB3 H 0.461 8.437 -2.371 1.00 . A A . 19 CYS HB3 1 1 15 7476 1 1 19 CYS N N 2.156 5.764 -2.061 1.00 . A A . 19 CYS N 1 1 15 7477 1 1 19 CYS O O 1.054 6.963 0.192 1.00 . A A . 19 CYS O 1 1 15 7478 1 1 19 CYS SG S 2.015 8.758 -4.169 1.00 . A A . 19 CYS SG 1 1 15 7479 1 1 20 LYS C C 0.511 9.197 1.627 1.00 . A A . 20 LYS C 1 1 15 7480 1 1 20 LYS CA C 2.028 9.187 1.415 1.00 . A A . 20 LYS CA 1 1 15 7481 1 1 20 LYS CB C 2.610 10.599 1.545 1.00 . A A . 20 LYS CB 1 1 15 7482 1 1 20 LYS CD C 4.442 11.892 2.657 1.00 . A A . 20 LYS CD 1 1 15 7483 1 1 20 LYS CE C 5.450 11.723 3.801 1.00 . A A . 20 LYS CE 1 1 15 7484 1 1 20 LYS CG C 4.021 10.516 2.132 1.00 . A A . 20 LYS CG 1 1 15 7485 1 1 20 LYS H H 2.962 9.273 -0.523 1.00 . A A . 20 LYS H 1 1 15 7486 1 1 20 LYS HA H 2.500 8.530 2.126 1.00 . A A . 20 LYS HA 1 1 15 7487 1 1 20 LYS HB2 H 2.650 11.063 0.569 1.00 . A A . 20 LYS HB2 1 1 15 7488 1 1 20 LYS HB3 H 1.983 11.188 2.199 1.00 . A A . 20 LYS HB3 1 1 15 7489 1 1 20 LYS HD2 H 4.898 12.456 1.856 1.00 . A A . 20 LYS HD2 1 1 15 7490 1 1 20 LYS HD3 H 3.573 12.420 3.020 1.00 . A A . 20 LYS HD3 1 1 15 7491 1 1 20 LYS HE2 H 5.988 10.790 3.692 1.00 . A A . 20 LYS HE2 1 1 15 7492 1 1 20 LYS HE3 H 6.137 12.553 3.822 1.00 . A A . 20 LYS HE3 1 1 15 7493 1 1 20 LYS HG2 H 4.030 9.802 2.943 1.00 . A A . 20 LYS HG2 1 1 15 7494 1 1 20 LYS HG3 H 4.712 10.198 1.366 1.00 . A A . 20 LYS HG3 1 1 15 7495 1 1 20 LYS HZ1 H 5.244 11.530 5.865 1.00 . A A . 20 LYS HZ1 1 1 15 7496 1 1 20 LYS HZ2 H 3.911 10.958 4.982 1.00 . A A . 20 LYS HZ2 1 1 15 7497 1 1 20 LYS HZ3 H 4.160 12.630 5.163 1.00 . A A . 20 LYS HZ3 1 1 15 7498 1 1 20 LYS N N 2.347 8.746 0.023 1.00 . A A . 20 LYS N 1 1 15 7499 1 1 20 LYS NZ N 4.629 11.709 5.046 1.00 . A A . 20 LYS NZ 1 1 15 7500 1 1 20 LYS O O -0.220 9.867 0.920 1.00 . A A . 20 LYS O 1 1 15 7501 1 1 21 GLY C C -1.936 6.954 2.490 1.00 . A A . 21 GLY C 1 1 15 7502 1 1 21 GLY CA C -1.436 8.364 2.826 1.00 . A A . 21 GLY CA 1 1 15 7503 1 1 21 GLY H H 0.646 7.890 3.116 1.00 . A A . 21 GLY H 1 1 15 7504 1 1 21 GLY HA2 H -1.635 8.583 3.867 1.00 . A A . 21 GLY HA2 1 1 15 7505 1 1 21 GLY HA3 H -1.944 9.083 2.202 1.00 . A A . 21 GLY HA3 1 1 15 7506 1 1 21 GLY N N 0.035 8.435 2.577 1.00 . A A . 21 GLY N 1 1 15 7507 1 1 21 GLY O O -2.933 6.502 3.018 1.00 . A A . 21 GLY O 1 1 15 7508 1 1 22 TYR C C -0.810 3.866 2.026 1.00 . A A . 22 TYR C 1 1 15 7509 1 1 22 TYR CA C -1.659 4.873 1.248 1.00 . A A . 22 TYR CA 1 1 15 7510 1 1 22 TYR CB C -1.376 4.749 -0.255 1.00 . A A . 22 TYR CB 1 1 15 7511 1 1 22 TYR CD1 C -2.082 7.058 -1.008 1.00 . A A . 22 TYR CD1 1 1 15 7512 1 1 22 TYR CD2 C -3.326 5.136 -1.806 1.00 . A A . 22 TYR CD2 1 1 15 7513 1 1 22 TYR CE1 C -2.922 7.905 -1.737 1.00 . A A . 22 TYR CE1 1 1 15 7514 1 1 22 TYR CE2 C -4.165 5.983 -2.536 1.00 . A A . 22 TYR CE2 1 1 15 7515 1 1 22 TYR CG C -2.283 5.670 -1.040 1.00 . A A . 22 TYR CG 1 1 15 7516 1 1 22 TYR CZ C -3.964 7.368 -2.502 1.00 . A A . 22 TYR CZ 1 1 15 7517 1 1 22 TYR H H -0.440 6.641 1.210 1.00 . A A . 22 TYR H 1 1 15 7518 1 1 22 TYR HA H -2.709 4.724 1.444 1.00 . A A . 22 TYR HA 1 1 15 7519 1 1 22 TYR HB2 H -0.347 5.009 -0.447 1.00 . A A . 22 TYR HB2 1 1 15 7520 1 1 22 TYR HB3 H -1.549 3.728 -0.565 1.00 . A A . 22 TYR HB3 1 1 15 7521 1 1 22 TYR HD1 H -1.278 7.473 -0.420 1.00 . A A . 22 TYR HD1 1 1 15 7522 1 1 22 TYR HD2 H -3.480 4.068 -1.832 1.00 . A A . 22 TYR HD2 1 1 15 7523 1 1 22 TYR HE1 H -2.767 8.973 -1.712 1.00 . A A . 22 TYR HE1 1 1 15 7524 1 1 22 TYR HE2 H -4.971 5.569 -3.125 1.00 . A A . 22 TYR HE2 1 1 15 7525 1 1 22 TYR HH H -4.248 8.815 -3.720 1.00 . A A . 22 TYR HH 1 1 15 7526 1 1 22 TYR N N -1.243 6.255 1.618 1.00 . A A . 22 TYR N 1 1 15 7527 1 1 22 TYR O O 0.399 3.984 2.094 1.00 . A A . 22 TYR O 1 1 15 7528 1 1 22 TYR OH O -4.795 8.203 -3.222 1.00 . A A . 22 TYR OH 1 1 15 7529 1 1 23 ALA C C -0.759 0.493 2.719 1.00 . A A . 23 ALA C 1 1 15 7530 1 1 23 ALA CA C -0.655 1.863 3.390 1.00 . A A . 23 ALA CA 1 1 15 7531 1 1 23 ALA CB C -1.308 1.832 4.773 1.00 . A A . 23 ALA CB 1 1 15 7532 1 1 23 ALA H H -2.405 2.802 2.547 1.00 . A A . 23 ALA H 1 1 15 7533 1 1 23 ALA HA H 0.378 2.161 3.478 1.00 . A A . 23 ALA HA 1 1 15 7534 1 1 23 ALA HB1 H -2.154 1.160 4.757 1.00 . A A . 23 ALA HB1 1 1 15 7535 1 1 23 ALA HB2 H -1.643 2.825 5.033 1.00 . A A . 23 ALA HB2 1 1 15 7536 1 1 23 ALA HB3 H -0.590 1.491 5.503 1.00 . A A . 23 ALA HB3 1 1 15 7537 1 1 23 ALA N N -1.429 2.878 2.615 1.00 . A A . 23 ALA N 1 1 15 7538 1 1 23 ALA O O -1.712 0.210 2.015 1.00 . A A . 23 ALA O 1 1 15 7539 1 1 24 CYS C C -0.579 -2.685 3.246 1.00 . A A . 24 CYS C 1 1 15 7540 1 1 24 CYS CA C 0.161 -1.720 2.316 1.00 . A A . 24 CYS CA 1 1 15 7541 1 1 24 CYS CB C 1.622 -2.153 2.154 1.00 . A A . 24 CYS CB 1 1 15 7542 1 1 24 CYS H H 0.960 -0.113 3.514 1.00 . A A . 24 CYS H 1 1 15 7543 1 1 24 CYS HA H -0.327 -1.675 1.352 1.00 . A A . 24 CYS HA 1 1 15 7544 1 1 24 CYS HB2 H 2.251 -1.552 2.791 1.00 . A A . 24 CYS HB2 1 1 15 7545 1 1 24 CYS HB3 H 1.721 -3.193 2.427 1.00 . A A . 24 CYS HB3 1 1 15 7546 1 1 24 CYS N N 0.207 -0.363 2.937 1.00 . A A . 24 CYS N 1 1 15 7547 1 1 24 CYS O O -0.583 -2.517 4.452 1.00 . A A . 24 CYS O 1 1 15 7548 1 1 24 CYS SG S 2.131 -1.937 0.433 1.00 . A A . 24 CYS SG 1 1 15 7549 1 1 25 SER C C -1.498 -6.088 3.269 1.00 . A A . 25 SER C 1 1 15 7550 1 1 25 SER CA C -1.961 -4.656 3.544 1.00 . A A . 25 SER CA 1 1 15 7551 1 1 25 SER CB C -3.425 -4.480 3.144 1.00 . A A . 25 SER CB 1 1 15 7552 1 1 25 SER H H -1.200 -3.797 1.720 1.00 . A A . 25 SER H 1 1 15 7553 1 1 25 SER HA H -1.838 -4.416 4.584 1.00 . A A . 25 SER HA 1 1 15 7554 1 1 25 SER HB2 H -3.489 -4.237 2.096 1.00 . A A . 25 SER HB2 1 1 15 7555 1 1 25 SER HB3 H -3.961 -5.401 3.329 1.00 . A A . 25 SER HB3 1 1 15 7556 1 1 25 SER HG H -4.753 -3.777 4.379 1.00 . A A . 25 SER HG 1 1 15 7557 1 1 25 SER N N -1.212 -3.687 2.695 1.00 . A A . 25 SER N 1 1 15 7558 1 1 25 SER O O -1.429 -6.520 2.133 1.00 . A A . 25 SER O 1 1 15 7559 1 1 25 SER OG O -3.997 -3.424 3.904 1.00 . A A . 25 SER OG 1 1 15 7560 1 1 26 LYS C C -1.970 -9.114 3.762 1.00 . A A . 26 LYS C 1 1 15 7561 1 1 26 LYS CA C -0.756 -8.247 4.111 1.00 . A A . 26 LYS CA 1 1 15 7562 1 1 26 LYS CB C -0.154 -8.671 5.455 1.00 . A A . 26 LYS CB 1 1 15 7563 1 1 26 LYS CD C 0.522 -10.854 6.479 1.00 . A A . 26 LYS CD 1 1 15 7564 1 1 26 LYS CE C -0.414 -12.013 6.119 1.00 . A A . 26 LYS CE 1 1 15 7565 1 1 26 LYS CG C 0.688 -9.935 5.264 1.00 . A A . 26 LYS CG 1 1 15 7566 1 1 26 LYS H H -1.271 -6.461 5.210 1.00 . A A . 26 LYS H 1 1 15 7567 1 1 26 LYS HA H -0.012 -8.308 3.336 1.00 . A A . 26 LYS HA 1 1 15 7568 1 1 26 LYS HB2 H 0.469 -7.876 5.838 1.00 . A A . 26 LYS HB2 1 1 15 7569 1 1 26 LYS HB3 H -0.949 -8.873 6.159 1.00 . A A . 26 LYS HB3 1 1 15 7570 1 1 26 LYS HD2 H 1.486 -11.243 6.768 1.00 . A A . 26 LYS HD2 1 1 15 7571 1 1 26 LYS HD3 H 0.100 -10.293 7.300 1.00 . A A . 26 LYS HD3 1 1 15 7572 1 1 26 LYS HE2 H -1.216 -11.663 5.484 1.00 . A A . 26 LYS HE2 1 1 15 7573 1 1 26 LYS HE3 H 0.137 -12.803 5.632 1.00 . A A . 26 LYS HE3 1 1 15 7574 1 1 26 LYS HG2 H 0.364 -10.451 4.372 1.00 . A A . 26 LYS HG2 1 1 15 7575 1 1 26 LYS HG3 H 1.726 -9.659 5.164 1.00 . A A . 26 LYS HG3 1 1 15 7576 1 1 26 LYS HZ1 H -1.551 -13.335 7.258 1.00 . A A . 26 LYS HZ1 1 1 15 7577 1 1 26 LYS HZ2 H -1.522 -11.748 7.865 1.00 . A A . 26 LYS HZ2 1 1 15 7578 1 1 26 LYS HZ3 H -0.168 -12.758 8.052 1.00 . A A . 26 LYS HZ3 1 1 15 7579 1 1 26 LYS N N -1.197 -6.832 4.304 1.00 . A A . 26 LYS N 1 1 15 7580 1 1 26 LYS NZ N -0.954 -12.499 7.421 1.00 . A A . 26 LYS NZ 1 1 15 7581 1 1 26 LYS O O -1.912 -9.954 2.883 1.00 . A A . 26 LYS O 1 1 15 7582 1 1 27 THR C C -4.862 -9.317 2.779 1.00 . A A . 27 THR C 1 1 15 7583 1 1 27 THR CA C -4.311 -9.688 4.161 1.00 . A A . 27 THR CA 1 1 15 7584 1 1 27 THR CB C -5.307 -9.289 5.257 1.00 . A A . 27 THR CB 1 1 15 7585 1 1 27 THR CG2 C -6.532 -10.206 5.202 1.00 . A A . 27 THR CG2 1 1 15 7586 1 1 27 THR H H -3.077 -8.209 5.135 1.00 . A A . 27 THR H 1 1 15 7587 1 1 27 THR HA H -4.106 -10.744 4.211 1.00 . A A . 27 THR HA 1 1 15 7588 1 1 27 THR HB H -5.622 -8.267 5.105 1.00 . A A . 27 THR HB 1 1 15 7589 1 1 27 THR HG1 H -4.863 -8.609 7.025 1.00 . A A . 27 THR HG1 1 1 15 7590 1 1 27 THR HG21 H -7.213 -9.946 5.999 1.00 . A A . 27 THR HG21 1 1 15 7591 1 1 27 THR HG22 H -6.218 -11.234 5.317 1.00 . A A . 27 THR HG22 1 1 15 7592 1 1 27 THR HG23 H -7.030 -10.087 4.251 1.00 . A A . 27 THR HG23 1 1 15 7593 1 1 27 THR N N -3.068 -8.899 4.441 1.00 . A A . 27 THR N 1 1 15 7594 1 1 27 THR O O -5.345 -10.160 2.048 1.00 . A A . 27 THR O 1 1 15 7595 1 1 27 THR OG1 O -4.685 -9.411 6.530 1.00 . A A . 27 THR OG1 1 1 15 7596 1 1 28 TRP C C -4.264 -7.962 0.006 1.00 . A A . 28 TRP C 1 1 15 7597 1 1 28 TRP CA C -5.297 -7.621 1.084 1.00 . A A . 28 TRP CA 1 1 15 7598 1 1 28 TRP CB C -5.475 -6.097 1.183 1.00 . A A . 28 TRP CB 1 1 15 7599 1 1 28 TRP CD1 C -7.135 -6.617 3.038 1.00 . A A . 28 TRP CD1 1 1 15 7600 1 1 28 TRP CD2 C -6.931 -4.411 2.644 1.00 . A A . 28 TRP CD2 1 1 15 7601 1 1 28 TRP CE2 C -7.871 -4.554 3.691 1.00 . A A . 28 TRP CE2 1 1 15 7602 1 1 28 TRP CE3 C -6.623 -3.111 2.205 1.00 . A A . 28 TRP CE3 1 1 15 7603 1 1 28 TRP CG C -6.473 -5.738 2.247 1.00 . A A . 28 TRP CG 1 1 15 7604 1 1 28 TRP CH2 C -8.167 -2.164 3.830 1.00 . A A . 28 TRP CH2 1 1 15 7605 1 1 28 TRP CZ2 C -8.484 -3.448 4.279 1.00 . A A . 28 TRP CZ2 1 1 15 7606 1 1 28 TRP CZ3 C -7.239 -1.996 2.794 1.00 . A A . 28 TRP CZ3 1 1 15 7607 1 1 28 TRP H H -4.387 -7.402 3.028 1.00 . A A . 28 TRP H 1 1 15 7608 1 1 28 TRP HA H -6.242 -8.092 0.867 1.00 . A A . 28 TRP HA 1 1 15 7609 1 1 28 TRP HB2 H -4.526 -5.644 1.420 1.00 . A A . 28 TRP HB2 1 1 15 7610 1 1 28 TRP HB3 H -5.819 -5.719 0.233 1.00 . A A . 28 TRP HB3 1 1 15 7611 1 1 28 TRP HD1 H -7.031 -7.693 3.007 1.00 . A A . 28 TRP HD1 1 1 15 7612 1 1 28 TRP HE1 H -8.540 -6.318 4.573 1.00 . A A . 28 TRP HE1 1 1 15 7613 1 1 28 TRP HE3 H -5.907 -2.970 1.406 1.00 . A A . 28 TRP HE3 1 1 15 7614 1 1 28 TRP HH2 H -8.639 -1.303 4.279 1.00 . A A . 28 TRP HH2 1 1 15 7615 1 1 28 TRP HZ2 H -9.200 -3.584 5.077 1.00 . A A . 28 TRP HZ2 1 1 15 7616 1 1 28 TRP HZ3 H -6.995 -1.002 2.447 1.00 . A A . 28 TRP HZ3 1 1 15 7617 1 1 28 TRP N N -4.786 -8.059 2.420 1.00 . A A . 28 TRP N 1 1 15 7618 1 1 28 TRP NE1 N -7.958 -5.916 3.897 1.00 . A A . 28 TRP NE1 1 1 15 7619 1 1 28 TRP O O -4.592 -8.499 -1.035 1.00 . A A . 28 TRP O 1 1 15 7620 1 1 29 GLY C C -1.655 -6.728 -1.604 1.00 . A A . 29 GLY C 1 1 15 7621 1 1 29 GLY CA C -1.940 -7.956 -0.730 1.00 . A A . 29 GLY CA 1 1 15 7622 1 1 29 GLY H H -2.782 -7.226 1.110 1.00 . A A . 29 GLY H 1 1 15 7623 1 1 29 GLY HA2 H -1.039 -8.237 -0.204 1.00 . A A . 29 GLY HA2 1 1 15 7624 1 1 29 GLY HA3 H -2.254 -8.773 -1.362 1.00 . A A . 29 GLY HA3 1 1 15 7625 1 1 29 GLY N N -3.015 -7.654 0.259 1.00 . A A . 29 GLY N 1 1 15 7626 1 1 29 GLY O O -1.063 -6.847 -2.660 1.00 . A A . 29 GLY O 1 1 15 7627 1 1 30 TRP C C -1.674 -3.078 -1.138 1.00 . A A . 30 TRP C 1 1 15 7628 1 1 30 TRP CA C -1.795 -4.334 -2.016 1.00 . A A . 30 TRP CA 1 1 15 7629 1 1 30 TRP CB C -2.982 -4.243 -2.993 1.00 . A A . 30 TRP CB 1 1 15 7630 1 1 30 TRP CD1 C -4.399 -2.495 -1.837 1.00 . A A . 30 TRP CD1 1 1 15 7631 1 1 30 TRP CD2 C -5.431 -4.486 -1.982 1.00 . A A . 30 TRP CD2 1 1 15 7632 1 1 30 TRP CE2 C -6.325 -3.612 -1.321 1.00 . A A . 30 TRP CE2 1 1 15 7633 1 1 30 TRP CE3 C -5.843 -5.812 -2.203 1.00 . A A . 30 TRP CE3 1 1 15 7634 1 1 30 TRP CG C -4.213 -3.755 -2.294 1.00 . A A . 30 TRP CG 1 1 15 7635 1 1 30 TRP CH2 C -7.978 -5.354 -1.124 1.00 . A A . 30 TRP CH2 1 1 15 7636 1 1 30 TRP CZ2 C -7.584 -4.035 -0.895 1.00 . A A . 30 TRP CZ2 1 1 15 7637 1 1 30 TRP CZ3 C -7.110 -6.243 -1.777 1.00 . A A . 30 TRP CZ3 1 1 15 7638 1 1 30 TRP H H -2.535 -5.463 -0.327 1.00 . A A . 30 TRP H 1 1 15 7639 1 1 30 TRP HA H -0.883 -4.471 -2.574 1.00 . A A . 30 TRP HA 1 1 15 7640 1 1 30 TRP HB2 H -2.738 -3.562 -3.792 1.00 . A A . 30 TRP HB2 1 1 15 7641 1 1 30 TRP HB3 H -3.175 -5.222 -3.410 1.00 . A A . 30 TRP HB3 1 1 15 7642 1 1 30 TRP HD1 H -3.686 -1.689 -1.909 1.00 . A A . 30 TRP HD1 1 1 15 7643 1 1 30 TRP HE1 H -6.021 -1.609 -0.843 1.00 . A A . 30 TRP HE1 1 1 15 7644 1 1 30 TRP HE3 H -5.181 -6.503 -2.703 1.00 . A A . 30 TRP HE3 1 1 15 7645 1 1 30 TRP HH2 H -8.950 -5.692 -0.798 1.00 . A A . 30 TRP HH2 1 1 15 7646 1 1 30 TRP HZ2 H -8.248 -3.347 -0.394 1.00 . A A . 30 TRP HZ2 1 1 15 7647 1 1 30 TRP HZ3 H -7.417 -7.263 -1.952 1.00 . A A . 30 TRP HZ3 1 1 15 7648 1 1 30 TRP N N -2.063 -5.549 -1.184 1.00 . A A . 30 TRP N 1 1 15 7649 1 1 30 TRP NE1 N -5.648 -2.412 -1.254 1.00 . A A . 30 TRP NE1 1 1 15 7650 1 1 30 TRP O O -1.834 -3.133 0.066 1.00 . A A . 30 TRP O 1 1 15 7651 1 1 31 CYS C C -2.325 0.338 -1.431 1.00 . A A . 31 CYS C 1 1 15 7652 1 1 31 CYS CA C -1.277 -0.677 -0.964 1.00 . A A . 31 CYS CA 1 1 15 7653 1 1 31 CYS CB C 0.160 -0.170 -1.197 1.00 . A A . 31 CYS CB 1 1 15 7654 1 1 31 CYS H H -1.292 -1.928 -2.714 1.00 . A A . 31 CYS H 1 1 15 7655 1 1 31 CYS HA H -1.419 -0.883 0.085 1.00 . A A . 31 CYS HA 1 1 15 7656 1 1 31 CYS HB2 H 0.451 0.459 -0.371 1.00 . A A . 31 CYS HB2 1 1 15 7657 1 1 31 CYS HB3 H 0.827 -1.016 -1.249 1.00 . A A . 31 CYS HB3 1 1 15 7658 1 1 31 CYS N N -1.403 -1.943 -1.743 1.00 . A A . 31 CYS N 1 1 15 7659 1 1 31 CYS O O -2.413 0.684 -2.598 1.00 . A A . 31 CYS O 1 1 15 7660 1 1 31 CYS SG S 0.287 0.781 -2.738 1.00 . A A . 31 CYS SG 1 1 15 7661 1 1 32 ALA C C -4.452 2.671 0.403 1.00 . A A . 32 ALA C 1 1 15 7662 1 1 32 ALA CA C -4.190 1.794 -0.830 1.00 . A A . 32 ALA CA 1 1 15 7663 1 1 32 ALA CB C -5.426 0.959 -1.169 1.00 . A A . 32 ALA CB 1 1 15 7664 1 1 32 ALA H H -3.018 0.484 0.418 1.00 . A A . 32 ALA H 1 1 15 7665 1 1 32 ALA HA H -3.904 2.399 -1.680 1.00 . A A . 32 ALA HA 1 1 15 7666 1 1 32 ALA HB1 H -5.142 0.146 -1.822 1.00 . A A . 32 ALA HB1 1 1 15 7667 1 1 32 ALA HB2 H -6.155 1.581 -1.666 1.00 . A A . 32 ALA HB2 1 1 15 7668 1 1 32 ALA HB3 H -5.852 0.559 -0.261 1.00 . A A . 32 ALA HB3 1 1 15 7669 1 1 32 ALA N N -3.123 0.799 -0.506 1.00 . A A . 32 ALA N 1 1 15 7670 1 1 32 ALA O O -3.831 2.493 1.433 1.00 . A A . 32 ALA O 1 1 15 7671 1 1 33 VAL C C -6.349 3.644 2.594 1.00 . A A . 33 VAL C 1 1 15 7672 1 1 33 VAL CA C -5.651 4.471 1.506 1.00 . A A . 33 VAL CA 1 1 15 7673 1 1 33 VAL CB C -6.569 5.592 0.999 1.00 . A A . 33 VAL CB 1 1 15 7674 1 1 33 VAL CG1 C -7.005 6.468 2.176 1.00 . A A . 33 VAL CG1 1 1 15 7675 1 1 33 VAL CG2 C -5.814 6.454 -0.015 1.00 . A A . 33 VAL CG2 1 1 15 7676 1 1 33 VAL H H -5.863 3.732 -0.518 1.00 . A A . 33 VAL H 1 1 15 7677 1 1 33 VAL HA H -4.733 4.893 1.888 1.00 . A A . 33 VAL HA 1 1 15 7678 1 1 33 VAL HB H -7.441 5.158 0.530 1.00 . A A . 33 VAL HB 1 1 15 7679 1 1 33 VAL HG11 H -6.150 6.997 2.568 1.00 . A A . 33 VAL HG11 1 1 15 7680 1 1 33 VAL HG12 H -7.431 5.849 2.951 1.00 . A A . 33 VAL HG12 1 1 15 7681 1 1 33 VAL HG13 H -7.745 7.181 1.839 1.00 . A A . 33 VAL HG13 1 1 15 7682 1 1 33 VAL HG21 H -4.754 6.403 0.186 1.00 . A A . 33 VAL HG21 1 1 15 7683 1 1 33 VAL HG22 H -6.147 7.479 0.067 1.00 . A A . 33 VAL HG22 1 1 15 7684 1 1 33 VAL HG23 H -6.012 6.092 -1.012 1.00 . A A . 33 VAL HG23 1 1 15 7685 1 1 33 VAL N N -5.365 3.605 0.317 1.00 . A A . 33 VAL N 1 1 15 7686 1 1 33 VAL O O -7.438 3.139 2.397 1.00 . A A . 33 VAL O 1 1 15 7687 1 1 34 GLU C C -7.617 3.378 5.359 1.00 . A A . 34 GLU C 1 1 15 7688 1 1 34 GLU CA C -6.342 2.699 4.841 1.00 . A A . 34 GLU CA 1 1 15 7689 1 1 34 GLU CB C -5.275 2.626 5.944 1.00 . A A . 34 GLU CB 1 1 15 7690 1 1 34 GLU CD C -3.473 4.323 6.322 1.00 . A A . 34 GLU CD 1 1 15 7691 1 1 34 GLU CG C -4.968 4.029 6.482 1.00 . A A . 34 GLU CG 1 1 15 7692 1 1 34 GLU H H -4.843 3.912 3.866 1.00 . A A . 34 GLU H 1 1 15 7693 1 1 34 GLU HA H -6.570 1.702 4.493 1.00 . A A . 34 GLU HA 1 1 15 7694 1 1 34 GLU HB2 H -5.636 2.003 6.750 1.00 . A A . 34 GLU HB2 1 1 15 7695 1 1 34 GLU HB3 H -4.372 2.195 5.538 1.00 . A A . 34 GLU HB3 1 1 15 7696 1 1 34 GLU HG2 H -5.541 4.762 5.931 1.00 . A A . 34 GLU HG2 1 1 15 7697 1 1 34 GLU HG3 H -5.232 4.080 7.528 1.00 . A A . 34 GLU HG3 1 1 15 7698 1 1 34 GLU N N -5.723 3.499 3.737 1.00 . A A . 34 GLU N 1 1 15 7699 1 1 34 GLU O O -7.761 4.586 5.287 1.00 . A A . 34 GLU O 1 1 15 7700 1 1 34 GLU OE1 O -2.716 3.942 7.200 1.00 . A A . 34 GLU OE1 1 1 15 7701 1 1 34 GLU OE2 O -3.112 4.923 5.323 1.00 . A A . 34 GLU OE2 1 1 15 7702 1 1 35 ALA C C -10.472 4.115 5.376 1.00 . A A . 35 ALA C 1 1 15 7703 1 1 35 ALA CA C -9.826 3.170 6.407 1.00 . A A . 35 ALA CA 1 1 15 7704 1 1 35 ALA CB C -9.430 3.929 7.677 1.00 . A A . 35 ALA CB 1 1 15 7705 1 1 35 ALA H H -8.394 1.633 5.916 1.00 . A A . 35 ALA H 1 1 15 7706 1 1 35 ALA HA H -10.508 2.373 6.656 1.00 . A A . 35 ALA HA 1 1 15 7707 1 1 35 ALA HB1 H -8.907 3.259 8.345 1.00 . A A . 35 ALA HB1 1 1 15 7708 1 1 35 ALA HB2 H -10.318 4.303 8.164 1.00 . A A . 35 ALA HB2 1 1 15 7709 1 1 35 ALA HB3 H -8.786 4.755 7.418 1.00 . A A . 35 ALA HB3 1 1 15 7710 1 1 35 ALA N N -8.543 2.601 5.876 1.00 . A A . 35 ALA N 1 1 15 7711 1 1 35 ALA O O -10.609 5.300 5.622 1.00 . A A . 35 ALA O 1 1 15 7712 1 1 36 PRO C C -12.919 4.751 3.556 1.00 . A A . 36 PRO C 1 1 15 7713 1 1 36 PRO CA C -11.485 4.353 3.168 1.00 . A A . 36 PRO CA 1 1 15 7714 1 1 36 PRO CB C -11.481 3.406 1.969 1.00 . A A . 36 PRO CB 1 1 15 7715 1 1 36 PRO CD C -10.719 2.137 3.878 1.00 . A A . 36 PRO CD 1 1 15 7716 1 1 36 PRO CG C -11.441 2.033 2.560 1.00 . A A . 36 PRO CG 1 1 15 7717 1 1 36 PRO HA H -10.897 5.228 2.946 1.00 . A A . 36 PRO HA 1 1 15 7718 1 1 36 PRO HB2 H -12.380 3.540 1.383 1.00 . A A . 36 PRO HB2 1 1 15 7719 1 1 36 PRO HB3 H -10.606 3.573 1.362 1.00 . A A . 36 PRO HB3 1 1 15 7720 1 1 36 PRO HD2 H -11.190 1.503 4.617 1.00 . A A . 36 PRO HD2 1 1 15 7721 1 1 36 PRO HD3 H -9.678 1.879 3.761 1.00 . A A . 36 PRO HD3 1 1 15 7722 1 1 36 PRO HG2 H -12.447 1.669 2.714 1.00 . A A . 36 PRO HG2 1 1 15 7723 1 1 36 PRO HG3 H -10.904 1.366 1.904 1.00 . A A . 36 PRO HG3 1 1 15 7724 1 1 36 PRO N N -10.848 3.554 4.249 1.00 . A A . 36 PRO N 1 1 15 7725 1 1 36 PRO O O -13.251 5.915 3.401 1.00 . A A . 36 PRO O 1 1 16 7726 1 1 1 ASP C C 11.232 10.284 -3.605 1.00 . A A . 1 ASP C 1 1 16 7727 1 1 1 ASP CA C 10.750 11.040 -2.360 1.00 . A A . 1 ASP CA 1 1 16 7728 1 1 1 ASP CB C 10.229 12.431 -2.741 1.00 . A A . 1 ASP CB 1 1 16 7729 1 1 1 ASP CG C 9.219 12.907 -1.693 1.00 . A A . 1 ASP CG 1 1 16 7730 1 1 1 ASP H1 H 11.532 11.649 -0.523 1.00 . A A . 1 ASP H1 1 1 16 7731 1 1 1 ASP H2 H 12.540 11.987 -1.848 1.00 . A A . 1 ASP H2 1 1 16 7732 1 1 1 ASP H3 H 12.406 10.399 -1.263 1.00 . A A . 1 ASP H3 1 1 16 7733 1 1 1 ASP HA H 9.975 10.481 -1.859 1.00 . A A . 1 ASP HA 1 1 16 7734 1 1 1 ASP HB2 H 11.056 13.125 -2.788 1.00 . A A . 1 ASP HB2 1 1 16 7735 1 1 1 ASP HB3 H 9.747 12.382 -3.704 1.00 . A A . 1 ASP HB3 1 1 16 7736 1 1 1 ASP N N 11.893 11.288 -1.428 1.00 . A A . 1 ASP N 1 1 16 7737 1 1 1 ASP O O 12.409 10.261 -3.911 1.00 . A A . 1 ASP O 1 1 16 7738 1 1 1 ASP OD1 O 8.045 12.619 -1.856 1.00 . A A . 1 ASP OD1 1 1 16 7739 1 1 1 ASP OD2 O 9.637 13.551 -0.745 1.00 . A A . 1 ASP OD2 1 1 16 7740 1 1 2 GLY C C 10.508 7.399 -5.307 1.00 . A A . 2 GLY C 1 1 16 7741 1 1 2 GLY CA C 10.721 8.899 -5.542 1.00 . A A . 2 GLY CA 1 1 16 7742 1 1 2 GLY H H 9.384 9.692 -4.048 1.00 . A A . 2 GLY H 1 1 16 7743 1 1 2 GLY HA2 H 10.116 9.223 -6.378 1.00 . A A . 2 GLY HA2 1 1 16 7744 1 1 2 GLY HA3 H 11.763 9.080 -5.762 1.00 . A A . 2 GLY HA3 1 1 16 7745 1 1 2 GLY N N 10.326 9.660 -4.319 1.00 . A A . 2 GLY N 1 1 16 7746 1 1 2 GLY O O 10.029 6.691 -6.173 1.00 . A A . 2 GLY O 1 1 16 7747 1 1 3 GLU C C 9.289 5.197 -3.228 1.00 . A A . 3 GLU C 1 1 16 7748 1 1 3 GLU CA C 10.677 5.454 -3.843 1.00 . A A . 3 GLU CA 1 1 16 7749 1 1 3 GLU CB C 11.796 5.101 -2.848 1.00 . A A . 3 GLU CB 1 1 16 7750 1 1 3 GLU CD C 11.979 5.110 -0.348 1.00 . A A . 3 GLU CD 1 1 16 7751 1 1 3 GLU CG C 11.674 5.963 -1.583 1.00 . A A . 3 GLU CG 1 1 16 7752 1 1 3 GLU H H 11.241 7.505 -3.460 1.00 . A A . 3 GLU H 1 1 16 7753 1 1 3 GLU HA H 10.795 4.875 -4.744 1.00 . A A . 3 GLU HA 1 1 16 7754 1 1 3 GLU HB2 H 11.720 4.058 -2.580 1.00 . A A . 3 GLU HB2 1 1 16 7755 1 1 3 GLU HB3 H 12.755 5.282 -3.310 1.00 . A A . 3 GLU HB3 1 1 16 7756 1 1 3 GLU HG2 H 12.374 6.783 -1.638 1.00 . A A . 3 GLU HG2 1 1 16 7757 1 1 3 GLU HG3 H 10.669 6.355 -1.508 1.00 . A A . 3 GLU HG3 1 1 16 7758 1 1 3 GLU N N 10.858 6.911 -4.140 1.00 . A A . 3 GLU N 1 1 16 7759 1 1 3 GLU O O 9.165 4.628 -2.158 1.00 . A A . 3 GLU O 1 1 16 7760 1 1 3 GLU OE1 O 11.064 4.482 0.155 1.00 . A A . 3 GLU OE1 1 1 16 7761 1 1 3 GLU OE2 O 13.122 5.101 0.074 1.00 . A A . 3 GLU OE2 1 1 16 7762 1 1 4 CYS C C 6.028 4.581 -4.373 1.00 . A A . 4 CYS C 1 1 16 7763 1 1 4 CYS CA C 6.862 5.393 -3.368 1.00 . A A . 4 CYS CA 1 1 16 7764 1 1 4 CYS CB C 6.292 6.806 -3.153 1.00 . A A . 4 CYS CB 1 1 16 7765 1 1 4 CYS H H 8.364 6.062 -4.763 1.00 . A A . 4 CYS H 1 1 16 7766 1 1 4 CYS HA H 6.908 4.874 -2.423 1.00 . A A . 4 CYS HA 1 1 16 7767 1 1 4 CYS HB2 H 5.882 6.876 -2.158 1.00 . A A . 4 CYS HB2 1 1 16 7768 1 1 4 CYS HB3 H 7.090 7.528 -3.257 1.00 . A A . 4 CYS HB3 1 1 16 7769 1 1 4 CYS N N 8.242 5.611 -3.902 1.00 . A A . 4 CYS N 1 1 16 7770 1 1 4 CYS O O 6.311 4.566 -5.557 1.00 . A A . 4 CYS O 1 1 16 7771 1 1 4 CYS SG S 4.990 7.176 -4.360 1.00 . A A . 4 CYS SG 1 1 16 7772 1 1 5 GLY C C 3.155 3.974 -5.544 1.00 . A A . 5 GLY C 1 1 16 7773 1 1 5 GLY CA C 4.165 3.078 -4.820 1.00 . A A . 5 GLY CA 1 1 16 7774 1 1 5 GLY H H 4.808 3.919 -2.949 1.00 . A A . 5 GLY H 1 1 16 7775 1 1 5 GLY HA2 H 4.797 2.590 -5.546 1.00 . A A . 5 GLY HA2 1 1 16 7776 1 1 5 GLY HA3 H 3.633 2.335 -4.248 1.00 . A A . 5 GLY HA3 1 1 16 7777 1 1 5 GLY N N 5.011 3.898 -3.904 1.00 . A A . 5 GLY N 1 1 16 7778 1 1 5 GLY O O 3.522 4.891 -6.254 1.00 . A A . 5 GLY O 1 1 16 7779 1 1 6 GLY C C -0.456 4.506 -5.238 1.00 . A A . 6 GLY C 1 1 16 7780 1 1 6 GLY CA C 0.843 4.534 -6.054 1.00 . A A . 6 GLY CA 1 1 16 7781 1 1 6 GLY H H 1.614 2.958 -4.801 1.00 . A A . 6 GLY H 1 1 16 7782 1 1 6 GLY HA2 H 1.196 5.551 -6.142 1.00 . A A . 6 GLY HA2 1 1 16 7783 1 1 6 GLY HA3 H 0.655 4.134 -7.038 1.00 . A A . 6 GLY HA3 1 1 16 7784 1 1 6 GLY N N 1.884 3.707 -5.375 1.00 . A A . 6 GLY N 1 1 16 7785 1 1 6 GLY O O -0.430 4.508 -4.020 1.00 . A A . 6 GLY O 1 1 16 7786 1 1 7 PHE C C -3.338 3.008 -4.899 1.00 . A A . 7 PHE C 1 1 16 7787 1 1 7 PHE CA C -2.894 4.452 -5.163 1.00 . A A . 7 PHE CA 1 1 16 7788 1 1 7 PHE CB C -3.892 5.170 -6.084 1.00 . A A . 7 PHE CB 1 1 16 7789 1 1 7 PHE CD1 C -5.802 5.578 -4.480 1.00 . A A . 7 PHE CD1 1 1 16 7790 1 1 7 PHE CD2 C -6.128 4.022 -6.312 1.00 . A A . 7 PHE CD2 1 1 16 7791 1 1 7 PHE CE1 C -7.112 5.340 -4.047 1.00 . A A . 7 PHE CE1 1 1 16 7792 1 1 7 PHE CE2 C -7.437 3.784 -5.878 1.00 . A A . 7 PHE CE2 1 1 16 7793 1 1 7 PHE CG C -5.309 4.918 -5.614 1.00 . A A . 7 PHE CG 1 1 16 7794 1 1 7 PHE CZ C -7.930 4.444 -4.745 1.00 . A A . 7 PHE CZ 1 1 16 7795 1 1 7 PHE H H -1.582 4.478 -6.879 1.00 . A A . 7 PHE H 1 1 16 7796 1 1 7 PHE HA H -2.809 4.984 -4.233 1.00 . A A . 7 PHE HA 1 1 16 7797 1 1 7 PHE HB2 H -3.692 6.231 -6.069 1.00 . A A . 7 PHE HB2 1 1 16 7798 1 1 7 PHE HB3 H -3.779 4.801 -7.094 1.00 . A A . 7 PHE HB3 1 1 16 7799 1 1 7 PHE HD1 H -5.171 6.269 -3.941 1.00 . A A . 7 PHE HD1 1 1 16 7800 1 1 7 PHE HD2 H -5.748 3.512 -7.186 1.00 . A A . 7 PHE HD2 1 1 16 7801 1 1 7 PHE HE1 H -7.492 5.848 -3.172 1.00 . A A . 7 PHE HE1 1 1 16 7802 1 1 7 PHE HE2 H -8.068 3.093 -6.417 1.00 . A A . 7 PHE HE2 1 1 16 7803 1 1 7 PHE HZ H -8.940 4.261 -4.411 1.00 . A A . 7 PHE HZ 1 1 16 7804 1 1 7 PHE N N -1.588 4.479 -5.898 1.00 . A A . 7 PHE N 1 1 16 7805 1 1 7 PHE O O -3.870 2.699 -3.851 1.00 . A A . 7 PHE O 1 1 16 7806 1 1 8 TRP C C -2.450 -0.228 -6.197 1.00 . A A . 8 TRP C 1 1 16 7807 1 1 8 TRP CA C -3.535 0.701 -5.642 1.00 . A A . 8 TRP CA 1 1 16 7808 1 1 8 TRP CB C -4.849 0.556 -6.421 1.00 . A A . 8 TRP CB 1 1 16 7809 1 1 8 TRP CD1 C -4.985 -1.729 -5.313 1.00 . A A . 8 TRP CD1 1 1 16 7810 1 1 8 TRP CD2 C -6.806 -1.246 -6.544 1.00 . A A . 8 TRP CD2 1 1 16 7811 1 1 8 TRP CE2 C -7.015 -2.534 -5.995 1.00 . A A . 8 TRP CE2 1 1 16 7812 1 1 8 TRP CE3 C -7.813 -0.705 -7.365 1.00 . A A . 8 TRP CE3 1 1 16 7813 1 1 8 TRP CG C -5.508 -0.755 -6.099 1.00 . A A . 8 TRP CG 1 1 16 7814 1 1 8 TRP CH2 C -9.169 -2.706 -7.067 1.00 . A A . 8 TRP CH2 1 1 16 7815 1 1 8 TRP CZ2 C -8.180 -3.258 -6.250 1.00 . A A . 8 TRP CZ2 1 1 16 7816 1 1 8 TRP CZ3 C -8.987 -1.431 -7.624 1.00 . A A . 8 TRP CZ3 1 1 16 7817 1 1 8 TRP H H -2.698 2.400 -6.676 1.00 . A A . 8 TRP H 1 1 16 7818 1 1 8 TRP HA H -3.702 0.500 -4.596 1.00 . A A . 8 TRP HA 1 1 16 7819 1 1 8 TRP HB2 H -5.515 1.363 -6.151 1.00 . A A . 8 TRP HB2 1 1 16 7820 1 1 8 TRP HB3 H -4.644 0.603 -7.480 1.00 . A A . 8 TRP HB3 1 1 16 7821 1 1 8 TRP HD1 H -4.028 -1.691 -4.818 1.00 . A A . 8 TRP HD1 1 1 16 7822 1 1 8 TRP HE1 H -5.739 -3.615 -4.755 1.00 . A A . 8 TRP HE1 1 1 16 7823 1 1 8 TRP HE3 H -7.682 0.275 -7.799 1.00 . A A . 8 TRP HE3 1 1 16 7824 1 1 8 TRP HH2 H -10.074 -3.258 -7.269 1.00 . A A . 8 TRP HH2 1 1 16 7825 1 1 8 TRP HZ2 H -8.316 -4.238 -5.819 1.00 . A A . 8 TRP HZ2 1 1 16 7826 1 1 8 TRP HZ3 H -9.753 -1.006 -8.255 1.00 . A A . 8 TRP HZ3 1 1 16 7827 1 1 8 TRP N N -3.127 2.125 -5.839 1.00 . A A . 8 TRP N 1 1 16 7828 1 1 8 TRP NE1 N -5.878 -2.784 -5.256 1.00 . A A . 8 TRP NE1 1 1 16 7829 1 1 8 TRP O O -2.602 -0.828 -7.247 1.00 . A A . 8 TRP O 1 1 16 7830 1 1 9 TRP C C -0.259 -2.543 -5.185 1.00 . A A . 9 TRP C 1 1 16 7831 1 1 9 TRP CA C -0.238 -1.229 -5.972 1.00 . A A . 9 TRP CA 1 1 16 7832 1 1 9 TRP CB C 1.046 -0.435 -5.694 1.00 . A A . 9 TRP CB 1 1 16 7833 1 1 9 TRP CD1 C 0.191 1.327 -7.313 1.00 . A A . 9 TRP CD1 1 1 16 7834 1 1 9 TRP CD2 C 2.435 1.197 -7.285 1.00 . A A . 9 TRP CD2 1 1 16 7835 1 1 9 TRP CE2 C 2.093 2.208 -8.217 1.00 . A A . 9 TRP CE2 1 1 16 7836 1 1 9 TRP CE3 C 3.798 0.921 -7.081 1.00 . A A . 9 TRP CE3 1 1 16 7837 1 1 9 TRP CG C 1.206 0.649 -6.723 1.00 . A A . 9 TRP CG 1 1 16 7838 1 1 9 TRP CH2 C 4.414 2.631 -8.702 1.00 . A A . 9 TRP CH2 1 1 16 7839 1 1 9 TRP CZ2 C 3.065 2.916 -8.917 1.00 . A A . 9 TRP CZ2 1 1 16 7840 1 1 9 TRP CZ3 C 4.781 1.635 -7.787 1.00 . A A . 9 TRP CZ3 1 1 16 7841 1 1 9 TRP H H -1.253 0.152 -4.656 1.00 . A A . 9 TRP H 1 1 16 7842 1 1 9 TRP HA H -0.334 -1.421 -7.029 1.00 . A A . 9 TRP HA 1 1 16 7843 1 1 9 TRP HB2 H 0.989 0.011 -4.712 1.00 . A A . 9 TRP HB2 1 1 16 7844 1 1 9 TRP HB3 H 1.896 -1.098 -5.739 1.00 . A A . 9 TRP HB3 1 1 16 7845 1 1 9 TRP HD1 H -0.860 1.171 -7.127 1.00 . A A . 9 TRP HD1 1 1 16 7846 1 1 9 TRP HE1 H 0.193 2.860 -8.753 1.00 . A A . 9 TRP HE1 1 1 16 7847 1 1 9 TRP HE3 H 4.092 0.155 -6.377 1.00 . A A . 9 TRP HE3 1 1 16 7848 1 1 9 TRP HH2 H 5.174 3.176 -9.241 1.00 . A A . 9 TRP HH2 1 1 16 7849 1 1 9 TRP HZ2 H 2.777 3.684 -9.619 1.00 . A A . 9 TRP HZ2 1 1 16 7850 1 1 9 TRP HZ3 H 5.822 1.419 -7.620 1.00 . A A . 9 TRP HZ3 1 1 16 7851 1 1 9 TRP N N -1.350 -0.344 -5.497 1.00 . A A . 9 TRP N 1 1 16 7852 1 1 9 TRP NE1 N 0.717 2.245 -8.199 1.00 . A A . 9 TRP NE1 1 1 16 7853 1 1 9 TRP O O -0.766 -2.599 -4.088 1.00 . A A . 9 TRP O 1 1 16 7854 1 1 10 LYS C C 1.485 -5.090 -4.132 1.00 . A A . 10 LYS C 1 1 16 7855 1 1 10 LYS CA C 0.244 -4.914 -5.006 1.00 . A A . 10 LYS CA 1 1 16 7856 1 1 10 LYS CB C 0.219 -5.990 -6.088 1.00 . A A . 10 LYS CB 1 1 16 7857 1 1 10 LYS CD C -1.804 -5.547 -7.486 1.00 . A A . 10 LYS CD 1 1 16 7858 1 1 10 LYS CE C -2.913 -6.318 -8.211 1.00 . A A . 10 LYS CE 1 1 16 7859 1 1 10 LYS CG C -1.227 -6.409 -6.361 1.00 . A A . 10 LYS CG 1 1 16 7860 1 1 10 LYS H H 0.663 -3.549 -6.634 1.00 . A A . 10 LYS H 1 1 16 7861 1 1 10 LYS HA H -0.648 -4.984 -4.404 1.00 . A A . 10 LYS HA 1 1 16 7862 1 1 10 LYS HB2 H 0.665 -5.603 -6.991 1.00 . A A . 10 LYS HB2 1 1 16 7863 1 1 10 LYS HB3 H 0.782 -6.848 -5.748 1.00 . A A . 10 LYS HB3 1 1 16 7864 1 1 10 LYS HD2 H -2.213 -4.638 -7.068 1.00 . A A . 10 LYS HD2 1 1 16 7865 1 1 10 LYS HD3 H -1.023 -5.300 -8.189 1.00 . A A . 10 LYS HD3 1 1 16 7866 1 1 10 LYS HE2 H -2.763 -7.384 -8.098 1.00 . A A . 10 LYS HE2 1 1 16 7867 1 1 10 LYS HE3 H -3.881 -6.032 -7.829 1.00 . A A . 10 LYS HE3 1 1 16 7868 1 1 10 LYS HG2 H -1.249 -7.449 -6.653 1.00 . A A . 10 LYS HG2 1 1 16 7869 1 1 10 LYS HG3 H -1.816 -6.272 -5.467 1.00 . A A . 10 LYS HG3 1 1 16 7870 1 1 10 LYS HZ1 H -3.575 -6.337 -10.184 1.00 . A A . 10 LYS HZ1 1 1 16 7871 1 1 10 LYS HZ2 H -1.886 -6.270 -10.022 1.00 . A A . 10 LYS HZ2 1 1 16 7872 1 1 10 LYS HZ3 H -2.827 -4.888 -9.723 1.00 . A A . 10 LYS HZ3 1 1 16 7873 1 1 10 LYS N N 0.267 -3.607 -5.738 1.00 . A A . 10 LYS N 1 1 16 7874 1 1 10 LYS NZ N -2.791 -5.923 -9.643 1.00 . A A . 10 LYS NZ 1 1 16 7875 1 1 10 LYS O O 2.601 -4.883 -4.571 1.00 . A A . 10 LYS O 1 1 16 7876 1 1 11 CYS C C 2.111 -6.792 -0.949 1.00 . A A . 11 CYS C 1 1 16 7877 1 1 11 CYS CA C 2.450 -5.717 -1.994 1.00 . A A . 11 CYS CA 1 1 16 7878 1 1 11 CYS CB C 2.708 -4.363 -1.326 1.00 . A A . 11 CYS CB 1 1 16 7879 1 1 11 CYS H H 0.384 -5.671 -2.584 1.00 . A A . 11 CYS H 1 1 16 7880 1 1 11 CYS HA H 3.311 -6.013 -2.570 1.00 . A A . 11 CYS HA 1 1 16 7881 1 1 11 CYS HB2 H 3.610 -4.421 -0.738 1.00 . A A . 11 CYS HB2 1 1 16 7882 1 1 11 CYS HB3 H 2.824 -3.606 -2.086 1.00 . A A . 11 CYS HB3 1 1 16 7883 1 1 11 CYS N N 1.292 -5.494 -2.903 1.00 . A A . 11 CYS N 1 1 16 7884 1 1 11 CYS O O 0.991 -7.264 -0.873 1.00 . A A . 11 CYS O 1 1 16 7885 1 1 11 CYS SG S 1.326 -3.923 -0.247 1.00 . A A . 11 CYS SG 1 1 16 7886 1 1 12 GLY C C 2.495 -7.523 2.233 1.00 . A A . 12 GLY C 1 1 16 7887 1 1 12 GLY CA C 2.803 -8.215 0.903 1.00 . A A . 12 GLY CA 1 1 16 7888 1 1 12 GLY H H 3.962 -6.780 -0.215 1.00 . A A . 12 GLY H 1 1 16 7889 1 1 12 GLY HA2 H 1.960 -8.821 0.605 1.00 . A A . 12 GLY HA2 1 1 16 7890 1 1 12 GLY HA3 H 3.675 -8.840 1.020 1.00 . A A . 12 GLY HA3 1 1 16 7891 1 1 12 GLY N N 3.069 -7.178 -0.139 1.00 . A A . 12 GLY N 1 1 16 7892 1 1 12 GLY O O 1.505 -6.826 2.364 1.00 . A A . 12 GLY O 1 1 16 7893 1 1 13 ARG C C 3.810 -5.674 4.569 1.00 . A A . 13 ARG C 1 1 16 7894 1 1 13 ARG CA C 3.115 -7.047 4.545 1.00 . A A . 13 ARG CA 1 1 16 7895 1 1 13 ARG CB C 3.745 -8.008 5.565 1.00 . A A . 13 ARG CB 1 1 16 7896 1 1 13 ARG CD C 1.964 -7.322 7.208 1.00 . A A . 13 ARG CD 1 1 16 7897 1 1 13 ARG CG C 3.469 -7.536 7.001 1.00 . A A . 13 ARG CG 1 1 16 7898 1 1 13 ARG CZ C 0.706 -6.271 8.996 1.00 . A A . 13 ARG CZ 1 1 16 7899 1 1 13 ARG H H 4.133 -8.262 3.081 1.00 . A A . 13 ARG H 1 1 16 7900 1 1 13 ARG HA H 2.057 -6.941 4.737 1.00 . A A . 13 ARG HA 1 1 16 7901 1 1 13 ARG HB2 H 3.330 -8.995 5.429 1.00 . A A . 13 ARG HB2 1 1 16 7902 1 1 13 ARG HB3 H 4.813 -8.046 5.404 1.00 . A A . 13 ARG HB3 1 1 16 7903 1 1 13 ARG HD2 H 1.585 -6.604 6.495 1.00 . A A . 13 ARG HD2 1 1 16 7904 1 1 13 ARG HD3 H 1.436 -8.258 7.120 1.00 . A A . 13 ARG HD3 1 1 16 7905 1 1 13 ARG HE H 2.596 -6.841 9.214 1.00 . A A . 13 ARG HE 1 1 16 7906 1 1 13 ARG HG2 H 3.822 -8.284 7.695 1.00 . A A . 13 ARG HG2 1 1 16 7907 1 1 13 ARG HG3 H 3.989 -6.608 7.181 1.00 . A A . 13 ARG HG3 1 1 16 7908 1 1 13 ARG HH11 H 0.896 -4.624 7.868 1.00 . A A . 13 ARG HH11 1 1 16 7909 1 1 13 ARG HH12 H -0.541 -4.709 8.832 1.00 . A A . 13 ARG HH12 1 1 16 7910 1 1 13 ARG HH21 H 0.256 -7.796 10.217 1.00 . A A . 13 ARG HH21 1 1 16 7911 1 1 13 ARG HH22 H -0.904 -6.510 10.166 1.00 . A A . 13 ARG HH22 1 1 16 7912 1 1 13 ARG N N 3.340 -7.704 3.217 1.00 . A A . 13 ARG N 1 1 16 7913 1 1 13 ARG NE N 1.836 -6.796 8.598 1.00 . A A . 13 ARG NE 1 1 16 7914 1 1 13 ARG NH1 N 0.323 -5.110 8.528 1.00 . A A . 13 ARG NH1 1 1 16 7915 1 1 13 ARG NH2 N -0.039 -6.909 9.860 1.00 . A A . 13 ARG NH2 1 1 16 7916 1 1 13 ARG O O 4.370 -5.264 5.570 1.00 . A A . 13 ARG O 1 1 16 7917 1 1 14 GLY C C 5.888 -3.773 2.938 1.00 . A A . 14 GLY C 1 1 16 7918 1 1 14 GLY CA C 4.439 -3.622 3.420 1.00 . A A . 14 GLY CA 1 1 16 7919 1 1 14 GLY H H 3.327 -5.304 2.672 1.00 . A A . 14 GLY H 1 1 16 7920 1 1 14 GLY HA2 H 3.899 -2.980 2.738 1.00 . A A . 14 GLY HA2 1 1 16 7921 1 1 14 GLY HA3 H 4.435 -3.182 4.405 1.00 . A A . 14 GLY HA3 1 1 16 7922 1 1 14 GLY N N 3.781 -4.959 3.468 1.00 . A A . 14 GLY N 1 1 16 7923 1 1 14 GLY O O 6.766 -3.054 3.375 1.00 . A A . 14 GLY O 1 1 16 7924 1 1 15 LYS C C 7.972 -3.652 0.717 1.00 . A A . 15 LYS C 1 1 16 7925 1 1 15 LYS CA C 7.537 -4.885 1.524 1.00 . A A . 15 LYS CA 1 1 16 7926 1 1 15 LYS CB C 7.486 -6.140 0.636 1.00 . A A . 15 LYS CB 1 1 16 7927 1 1 15 LYS CD C 7.977 -7.576 2.630 1.00 . A A . 15 LYS CD 1 1 16 7928 1 1 15 LYS CE C 7.967 -9.098 2.799 1.00 . A A . 15 LYS CE 1 1 16 7929 1 1 15 LYS CG C 8.410 -7.221 1.205 1.00 . A A . 15 LYS CG 1 1 16 7930 1 1 15 LYS H H 5.415 -5.259 1.697 1.00 . A A . 15 LYS H 1 1 16 7931 1 1 15 LYS HA H 8.212 -5.046 2.343 1.00 . A A . 15 LYS HA 1 1 16 7932 1 1 15 LYS HB2 H 6.474 -6.515 0.601 1.00 . A A . 15 LYS HB2 1 1 16 7933 1 1 15 LYS HB3 H 7.809 -5.885 -0.362 1.00 . A A . 15 LYS HB3 1 1 16 7934 1 1 15 LYS HD2 H 8.670 -7.138 3.335 1.00 . A A . 15 LYS HD2 1 1 16 7935 1 1 15 LYS HD3 H 6.987 -7.188 2.813 1.00 . A A . 15 LYS HD3 1 1 16 7936 1 1 15 LYS HE2 H 8.291 -9.579 1.886 1.00 . A A . 15 LYS HE2 1 1 16 7937 1 1 15 LYS HE3 H 8.601 -9.388 3.622 1.00 . A A . 15 LYS HE3 1 1 16 7938 1 1 15 LYS HG2 H 8.355 -8.101 0.582 1.00 . A A . 15 LYS HG2 1 1 16 7939 1 1 15 LYS HG3 H 9.426 -6.853 1.220 1.00 . A A . 15 LYS HG3 1 1 16 7940 1 1 15 LYS HZ1 H 6.474 -10.472 3.269 1.00 . A A . 15 LYS HZ1 1 1 16 7941 1 1 15 LYS HZ2 H 5.949 -9.186 2.291 1.00 . A A . 15 LYS HZ2 1 1 16 7942 1 1 15 LYS HZ3 H 6.235 -8.936 3.947 1.00 . A A . 15 LYS HZ3 1 1 16 7943 1 1 15 LYS N N 6.141 -4.697 2.037 1.00 . A A . 15 LYS N 1 1 16 7944 1 1 15 LYS NZ N 6.550 -9.448 3.100 1.00 . A A . 15 LYS NZ 1 1 16 7945 1 1 15 LYS O O 8.934 -2.997 1.071 1.00 . A A . 15 LYS O 1 1 16 7946 1 1 16 PRO C C 7.124 -0.894 -0.463 1.00 . A A . 16 PRO C 1 1 16 7947 1 1 16 PRO CA C 7.547 -2.184 -1.182 1.00 . A A . 16 PRO CA 1 1 16 7948 1 1 16 PRO CB C 6.708 -2.412 -2.436 1.00 . A A . 16 PRO CB 1 1 16 7949 1 1 16 PRO CD C 6.068 -4.098 -0.827 1.00 . A A . 16 PRO CD 1 1 16 7950 1 1 16 PRO CG C 5.577 -3.286 -1.997 1.00 . A A . 16 PRO CG 1 1 16 7951 1 1 16 PRO HA H 8.594 -2.160 -1.434 1.00 . A A . 16 PRO HA 1 1 16 7952 1 1 16 PRO HB2 H 6.333 -1.468 -2.811 1.00 . A A . 16 PRO HB2 1 1 16 7953 1 1 16 PRO HB3 H 7.290 -2.914 -3.193 1.00 . A A . 16 PRO HB3 1 1 16 7954 1 1 16 PRO HD2 H 5.307 -4.157 -0.060 1.00 . A A . 16 PRO HD2 1 1 16 7955 1 1 16 PRO HD3 H 6.362 -5.086 -1.146 1.00 . A A . 16 PRO HD3 1 1 16 7956 1 1 16 PRO HG2 H 4.736 -2.675 -1.697 1.00 . A A . 16 PRO HG2 1 1 16 7957 1 1 16 PRO HG3 H 5.287 -3.946 -2.800 1.00 . A A . 16 PRO HG3 1 1 16 7958 1 1 16 PRO N N 7.238 -3.363 -0.335 1.00 . A A . 16 PRO N 1 1 16 7959 1 1 16 PRO O O 6.079 -0.851 0.160 1.00 . A A . 16 PRO O 1 1 16 7960 1 1 17 PRO C C 6.520 2.146 -0.620 1.00 . A A . 17 PRO C 1 1 16 7961 1 1 17 PRO CA C 7.665 1.416 0.092 1.00 . A A . 17 PRO CA 1 1 16 7962 1 1 17 PRO CB C 8.973 2.188 -0.048 1.00 . A A . 17 PRO CB 1 1 16 7963 1 1 17 PRO CD C 9.230 0.142 -1.298 1.00 . A A . 17 PRO CD 1 1 16 7964 1 1 17 PRO CG C 9.654 1.586 -1.235 1.00 . A A . 17 PRO CG 1 1 16 7965 1 1 17 PRO HA H 7.434 1.269 1.135 1.00 . A A . 17 PRO HA 1 1 16 7966 1 1 17 PRO HB2 H 8.771 3.237 -0.219 1.00 . A A . 17 PRO HB2 1 1 16 7967 1 1 17 PRO HB3 H 9.582 2.060 0.834 1.00 . A A . 17 PRO HB3 1 1 16 7968 1 1 17 PRO HD2 H 9.090 -0.164 -2.326 1.00 . A A . 17 PRO HD2 1 1 16 7969 1 1 17 PRO HD3 H 9.955 -0.487 -0.807 1.00 . A A . 17 PRO HD3 1 1 16 7970 1 1 17 PRO HG2 H 9.351 2.103 -2.135 1.00 . A A . 17 PRO HG2 1 1 16 7971 1 1 17 PRO HG3 H 10.725 1.646 -1.116 1.00 . A A . 17 PRO HG3 1 1 16 7972 1 1 17 PRO N N 7.956 0.113 -0.566 1.00 . A A . 17 PRO N 1 1 16 7973 1 1 17 PRO O O 6.637 2.534 -1.768 1.00 . A A . 17 PRO O 1 1 16 7974 1 1 18 CYS C C 4.438 4.571 -0.417 1.00 . A A . 18 CYS C 1 1 16 7975 1 1 18 CYS CA C 4.262 3.055 -0.569 1.00 . A A . 18 CYS CA 1 1 16 7976 1 1 18 CYS CB C 3.025 2.578 0.197 1.00 . A A . 18 CYS CB 1 1 16 7977 1 1 18 CYS H H 5.349 2.021 0.984 1.00 . A A . 18 CYS H 1 1 16 7978 1 1 18 CYS HA H 4.175 2.787 -1.609 1.00 . A A . 18 CYS HA 1 1 16 7979 1 1 18 CYS HB2 H 3.191 2.692 1.259 1.00 . A A . 18 CYS HB2 1 1 16 7980 1 1 18 CYS HB3 H 2.170 3.167 -0.099 1.00 . A A . 18 CYS HB3 1 1 16 7981 1 1 18 CYS N N 5.416 2.340 0.059 1.00 . A A . 18 CYS N 1 1 16 7982 1 1 18 CYS O O 5.375 5.036 0.209 1.00 . A A . 18 CYS O 1 1 16 7983 1 1 18 CYS SG S 2.715 0.838 -0.182 1.00 . A A . 18 CYS SG 1 1 16 7984 1 1 19 CYS C C 2.995 7.315 0.429 1.00 . A A . 19 CYS C 1 1 16 7985 1 1 19 CYS CA C 3.669 6.834 -0.864 1.00 . A A . 19 CYS CA 1 1 16 7986 1 1 19 CYS CB C 2.961 7.411 -2.100 1.00 . A A . 19 CYS CB 1 1 16 7987 1 1 19 CYS H H 2.798 4.953 -1.477 1.00 . A A . 19 CYS H 1 1 16 7988 1 1 19 CYS HA H 4.707 7.124 -0.870 1.00 . A A . 19 CYS HA 1 1 16 7989 1 1 19 CYS HB2 H 1.896 7.432 -1.926 1.00 . A A . 19 CYS HB2 1 1 16 7990 1 1 19 CYS HB3 H 3.313 8.417 -2.277 1.00 . A A . 19 CYS HB3 1 1 16 7991 1 1 19 CYS N N 3.547 5.347 -0.981 1.00 . A A . 19 CYS N 1 1 16 7992 1 1 19 CYS O O 2.256 6.582 1.063 1.00 . A A . 19 CYS O 1 1 16 7993 1 1 19 CYS SG S 3.310 6.387 -3.556 1.00 . A A . 19 CYS SG 1 1 16 7994 1 1 20 LYS C C 1.120 8.987 2.044 1.00 . A A . 20 LYS C 1 1 16 7995 1 1 20 LYS CA C 2.652 9.072 2.091 1.00 . A A . 20 LYS CA 1 1 16 7996 1 1 20 LYS CB C 3.108 10.534 2.164 1.00 . A A . 20 LYS CB 1 1 16 7997 1 1 20 LYS CD C 3.694 11.462 4.416 1.00 . A A . 20 LYS CD 1 1 16 7998 1 1 20 LYS CE C 3.182 11.312 5.851 1.00 . A A . 20 LYS CE 1 1 16 7999 1 1 20 LYS CG C 2.551 11.186 3.434 1.00 . A A . 20 LYS CG 1 1 16 8000 1 1 20 LYS H H 3.866 9.097 0.315 1.00 . A A . 20 LYS H 1 1 16 8001 1 1 20 LYS HA H 3.033 8.532 2.939 1.00 . A A . 20 LYS HA 1 1 16 8002 1 1 20 LYS HB2 H 4.189 10.573 2.181 1.00 . A A . 20 LYS HB2 1 1 16 8003 1 1 20 LYS HB3 H 2.743 11.067 1.298 1.00 . A A . 20 LYS HB3 1 1 16 8004 1 1 20 LYS HD2 H 4.496 10.759 4.243 1.00 . A A . 20 LYS HD2 1 1 16 8005 1 1 20 LYS HD3 H 4.059 12.468 4.269 1.00 . A A . 20 LYS HD3 1 1 16 8006 1 1 20 LYS HE2 H 2.375 12.008 6.035 1.00 . A A . 20 LYS HE2 1 1 16 8007 1 1 20 LYS HE3 H 2.856 10.300 6.030 1.00 . A A . 20 LYS HE3 1 1 16 8008 1 1 20 LYS HG2 H 2.065 12.115 3.178 1.00 . A A . 20 LYS HG2 1 1 16 8009 1 1 20 LYS HG3 H 1.837 10.521 3.896 1.00 . A A . 20 LYS HG3 1 1 16 8010 1 1 20 LYS HZ1 H 4.689 12.593 6.510 1.00 . A A . 20 LYS HZ1 1 1 16 8011 1 1 20 LYS HZ2 H 5.118 10.950 6.530 1.00 . A A . 20 LYS HZ2 1 1 16 8012 1 1 20 LYS HZ3 H 4.073 11.572 7.715 1.00 . A A . 20 LYS HZ3 1 1 16 8013 1 1 20 LYS N N 3.259 8.536 0.833 1.00 . A A . 20 LYS N 1 1 16 8014 1 1 20 LYS NZ N 4.354 11.632 6.716 1.00 . A A . 20 LYS NZ 1 1 16 8015 1 1 20 LYS O O 0.492 9.462 1.116 1.00 . A A . 20 LYS O 1 1 16 8016 1 1 21 GLY C C -1.399 6.873 2.589 1.00 . A A . 21 GLY C 1 1 16 8017 1 1 21 GLY CA C -0.972 8.264 3.070 1.00 . A A . 21 GLY CA 1 1 16 8018 1 1 21 GLY H H 1.048 8.009 3.777 1.00 . A A . 21 GLY H 1 1 16 8019 1 1 21 GLY HA2 H -1.324 8.418 4.079 1.00 . A A . 21 GLY HA2 1 1 16 8020 1 1 21 GLY HA3 H -1.405 9.013 2.422 1.00 . A A . 21 GLY HA3 1 1 16 8021 1 1 21 GLY N N 0.517 8.384 3.042 1.00 . A A . 21 GLY N 1 1 16 8022 1 1 21 GLY O O -2.469 6.398 2.922 1.00 . A A . 21 GLY O 1 1 16 8023 1 1 22 TYR C C -0.319 3.777 2.203 1.00 . A A . 22 TYR C 1 1 16 8024 1 1 22 TYR CA C -0.935 4.856 1.305 1.00 . A A . 22 TYR CA 1 1 16 8025 1 1 22 TYR CB C -0.342 4.768 -0.106 1.00 . A A . 22 TYR CB 1 1 16 8026 1 1 22 TYR CD1 C -0.242 7.127 -1.001 1.00 . A A . 22 TYR CD1 1 1 16 8027 1 1 22 TYR CD2 C -2.023 5.670 -1.761 1.00 . A A . 22 TYR CD2 1 1 16 8028 1 1 22 TYR CE1 C -0.736 8.156 -1.810 1.00 . A A . 22 TYR CE1 1 1 16 8029 1 1 22 TYR CE2 C -2.518 6.700 -2.570 1.00 . A A . 22 TYR CE2 1 1 16 8030 1 1 22 TYR CG C -0.884 5.883 -0.976 1.00 . A A . 22 TYR CG 1 1 16 8031 1 1 22 TYR CZ C -1.875 7.942 -2.594 1.00 . A A . 22 TYR CZ 1 1 16 8032 1 1 22 TYR H H 0.281 6.616 1.555 1.00 . A A . 22 TYR H 1 1 16 8033 1 1 22 TYR HA H -2.007 4.741 1.263 1.00 . A A . 22 TYR HA 1 1 16 8034 1 1 22 TYR HB2 H 0.732 4.851 -0.047 1.00 . A A . 22 TYR HB2 1 1 16 8035 1 1 22 TYR HB3 H -0.604 3.815 -0.543 1.00 . A A . 22 TYR HB3 1 1 16 8036 1 1 22 TYR HD1 H 0.635 7.295 -0.396 1.00 . A A . 22 TYR HD1 1 1 16 8037 1 1 22 TYR HD2 H -2.519 4.712 -1.742 1.00 . A A . 22 TYR HD2 1 1 16 8038 1 1 22 TYR HE1 H -0.240 9.116 -1.828 1.00 . A A . 22 TYR HE1 1 1 16 8039 1 1 22 TYR HE2 H -3.397 6.535 -3.175 1.00 . A A . 22 TYR HE2 1 1 16 8040 1 1 22 TYR HH H -2.000 8.840 -4.275 1.00 . A A . 22 TYR HH 1 1 16 8041 1 1 22 TYR N N -0.575 6.215 1.809 1.00 . A A . 22 TYR N 1 1 16 8042 1 1 22 TYR O O 0.866 3.790 2.482 1.00 . A A . 22 TYR O 1 1 16 8043 1 1 22 TYR OH O -2.363 8.957 -3.393 1.00 . A A . 22 TYR OH 1 1 16 8044 1 1 23 ALA C C -0.791 0.393 2.836 1.00 . A A . 23 ALA C 1 1 16 8045 1 1 23 ALA CA C -0.596 1.749 3.523 1.00 . A A . 23 ALA CA 1 1 16 8046 1 1 23 ALA CB C -1.432 1.827 4.801 1.00 . A A . 23 ALA CB 1 1 16 8047 1 1 23 ALA H H -2.064 2.856 2.399 1.00 . A A . 23 ALA H 1 1 16 8048 1 1 23 ALA HA H 0.446 1.910 3.752 1.00 . A A . 23 ALA HA 1 1 16 8049 1 1 23 ALA HB1 H -2.362 1.296 4.656 1.00 . A A . 23 ALA HB1 1 1 16 8050 1 1 23 ALA HB2 H -1.641 2.861 5.032 1.00 . A A . 23 ALA HB2 1 1 16 8051 1 1 23 ALA HB3 H -0.885 1.380 5.617 1.00 . A A . 23 ALA HB3 1 1 16 8052 1 1 23 ALA N N -1.118 2.842 2.647 1.00 . A A . 23 ALA N 1 1 16 8053 1 1 23 ALA O O -1.708 0.213 2.056 1.00 . A A . 23 ALA O 1 1 16 8054 1 1 24 CYS C C -0.975 -2.814 3.308 1.00 . A A . 24 CYS C 1 1 16 8055 1 1 24 CYS CA C -0.075 -1.904 2.469 1.00 . A A . 24 CYS CA 1 1 16 8056 1 1 24 CYS CB C 1.343 -2.475 2.404 1.00 . A A . 24 CYS CB 1 1 16 8057 1 1 24 CYS H H 0.795 -0.393 3.747 1.00 . A A . 24 CYS H 1 1 16 8058 1 1 24 CYS HA H -0.476 -1.796 1.473 1.00 . A A . 24 CYS HA 1 1 16 8059 1 1 24 CYS HB2 H 1.981 -1.946 3.097 1.00 . A A . 24 CYS HB2 1 1 16 8060 1 1 24 CYS HB3 H 1.322 -3.523 2.664 1.00 . A A . 24 CYS HB3 1 1 16 8061 1 1 24 CYS N N 0.064 -0.561 3.116 1.00 . A A . 24 CYS N 1 1 16 8062 1 1 24 CYS O O -1.168 -2.600 4.491 1.00 . A A . 24 CYS O 1 1 16 8063 1 1 24 CYS SG S 1.994 -2.286 0.730 1.00 . A A . 24 CYS SG 1 1 16 8064 1 1 25 SER C C -2.089 -6.217 3.112 1.00 . A A . 25 SER C 1 1 16 8065 1 1 25 SER CA C -2.428 -4.760 3.441 1.00 . A A . 25 SER CA 1 1 16 8066 1 1 25 SER CB C -3.839 -4.418 2.957 1.00 . A A . 25 SER CB 1 1 16 8067 1 1 25 SER H H -1.364 -3.975 1.740 1.00 . A A . 25 SER H 1 1 16 8068 1 1 25 SER HA H -2.354 -4.588 4.500 1.00 . A A . 25 SER HA 1 1 16 8069 1 1 25 SER HB2 H -3.789 -3.971 1.979 1.00 . A A . 25 SER HB2 1 1 16 8070 1 1 25 SER HB3 H -4.428 -5.324 2.905 1.00 . A A . 25 SER HB3 1 1 16 8071 1 1 25 SER HG H -5.222 -3.914 4.229 1.00 . A A . 25 SER HG 1 1 16 8072 1 1 25 SER N N -1.533 -3.829 2.697 1.00 . A A . 25 SER N 1 1 16 8073 1 1 25 SER O O -2.276 -6.666 1.998 1.00 . A A . 25 SER O 1 1 16 8074 1 1 25 SER OG O -4.436 -3.501 3.865 1.00 . A A . 25 SER OG 1 1 16 8075 1 1 26 LYS C C -2.568 -9.200 3.638 1.00 . A A . 26 LYS C 1 1 16 8076 1 1 26 LYS CA C -1.276 -8.396 3.822 1.00 . A A . 26 LYS CA 1 1 16 8077 1 1 26 LYS CB C -0.517 -8.865 5.067 1.00 . A A . 26 LYS CB 1 1 16 8078 1 1 26 LYS CD C 1.199 -10.595 5.639 1.00 . A A . 26 LYS CD 1 1 16 8079 1 1 26 LYS CE C 1.104 -11.924 6.395 1.00 . A A . 26 LYS CE 1 1 16 8080 1 1 26 LYS CG C -0.114 -10.333 4.896 1.00 . A A . 26 LYS CG 1 1 16 8081 1 1 26 LYS H H -1.470 -6.577 4.969 1.00 . A A . 26 LYS H 1 1 16 8082 1 1 26 LYS HA H -0.649 -8.487 2.951 1.00 . A A . 26 LYS HA 1 1 16 8083 1 1 26 LYS HB2 H 0.366 -8.259 5.199 1.00 . A A . 26 LYS HB2 1 1 16 8084 1 1 26 LYS HB3 H -1.155 -8.768 5.934 1.00 . A A . 26 LYS HB3 1 1 16 8085 1 1 26 LYS HD2 H 2.009 -10.641 4.927 1.00 . A A . 26 LYS HD2 1 1 16 8086 1 1 26 LYS HD3 H 1.381 -9.797 6.341 1.00 . A A . 26 LYS HD3 1 1 16 8087 1 1 26 LYS HE2 H 0.599 -11.781 7.341 1.00 . A A . 26 LYS HE2 1 1 16 8088 1 1 26 LYS HE3 H 0.588 -12.661 5.799 1.00 . A A . 26 LYS HE3 1 1 16 8089 1 1 26 LYS HG2 H -0.890 -10.967 5.298 1.00 . A A . 26 LYS HG2 1 1 16 8090 1 1 26 LYS HG3 H 0.021 -10.549 3.846 1.00 . A A . 26 LYS HG3 1 1 16 8091 1 1 26 LYS HZ1 H 3.046 -11.573 7.066 1.00 . A A . 26 LYS HZ1 1 1 16 8092 1 1 26 LYS HZ2 H 2.955 -12.582 5.702 1.00 . A A . 26 LYS HZ2 1 1 16 8093 1 1 26 LYS HZ3 H 2.536 -13.181 7.234 1.00 . A A . 26 LYS HZ3 1 1 16 8094 1 1 26 LYS N N -1.606 -6.960 4.076 1.00 . A A . 26 LYS N 1 1 16 8095 1 1 26 LYS NZ N 2.517 -12.347 6.615 1.00 . A A . 26 LYS NZ 1 1 16 8096 1 1 26 LYS O O -2.634 -10.109 2.831 1.00 . A A . 26 LYS O 1 1 16 8097 1 1 27 THR C C -5.456 -9.427 2.834 1.00 . A A . 27 THR C 1 1 16 8098 1 1 27 THR CA C -4.903 -9.589 4.252 1.00 . A A . 27 THR CA 1 1 16 8099 1 1 27 THR CB C -5.845 -8.920 5.267 1.00 . A A . 27 THR CB 1 1 16 8100 1 1 27 THR CG2 C -7.082 -9.793 5.481 1.00 . A A . 27 THR CG2 1 1 16 8101 1 1 27 THR H H -3.514 -8.120 5.013 1.00 . A A . 27 THR H 1 1 16 8102 1 1 27 THR HA H -4.780 -10.630 4.493 1.00 . A A . 27 THR HA 1 1 16 8103 1 1 27 THR HB H -6.154 -7.955 4.888 1.00 . A A . 27 THR HB 1 1 16 8104 1 1 27 THR HG1 H -4.778 -9.586 6.758 1.00 . A A . 27 THR HG1 1 1 16 8105 1 1 27 THR HG21 H -7.252 -10.400 4.604 1.00 . A A . 27 THR HG21 1 1 16 8106 1 1 27 THR HG22 H -7.943 -9.163 5.652 1.00 . A A . 27 THR HG22 1 1 16 8107 1 1 27 THR HG23 H -6.928 -10.432 6.337 1.00 . A A . 27 THR HG23 1 1 16 8108 1 1 27 THR N N -3.598 -8.862 4.377 1.00 . A A . 27 THR N 1 1 16 8109 1 1 27 THR O O -5.953 -10.364 2.239 1.00 . A A . 27 THR O 1 1 16 8110 1 1 27 THR OG1 O -5.171 -8.745 6.508 1.00 . A A . 27 THR OG1 1 1 16 8111 1 1 28 TRP C C -4.788 -8.360 -0.110 1.00 . A A . 28 TRP C 1 1 16 8112 1 1 28 TRP CA C -5.873 -7.994 0.910 1.00 . A A . 28 TRP CA 1 1 16 8113 1 1 28 TRP CB C -6.191 -6.495 0.856 1.00 . A A . 28 TRP CB 1 1 16 8114 1 1 28 TRP CD1 C -7.953 -7.003 2.614 1.00 . A A . 28 TRP CD1 1 1 16 8115 1 1 28 TRP CD2 C -7.509 -4.805 2.441 1.00 . A A . 28 TRP CD2 1 1 16 8116 1 1 28 TRP CE2 C -8.493 -4.945 3.448 1.00 . A A . 28 TRP CE2 1 1 16 8117 1 1 28 TRP CE3 C -7.055 -3.509 2.134 1.00 . A A . 28 TRP CE3 1 1 16 8118 1 1 28 TRP CG C -7.179 -6.129 1.927 1.00 . A A . 28 TRP CG 1 1 16 8119 1 1 28 TRP CH2 C -8.544 -2.562 3.810 1.00 . A A . 28 TRP CH2 1 1 16 8120 1 1 28 TRP CZ2 C -9.007 -3.840 4.128 1.00 . A A . 28 TRP CZ2 1 1 16 8121 1 1 28 TRP CZ3 C -7.571 -2.396 2.815 1.00 . A A . 28 TRP CZ3 1 1 16 8122 1 1 28 TRP H H -4.952 -7.508 2.799 1.00 . A A . 28 TRP H 1 1 16 8123 1 1 28 TRP HA H -6.767 -8.571 0.731 1.00 . A A . 28 TRP HA 1 1 16 8124 1 1 28 TRP HB2 H -5.281 -5.930 1.004 1.00 . A A . 28 TRP HB2 1 1 16 8125 1 1 28 TRP HB3 H -6.604 -6.253 -0.110 1.00 . A A . 28 TRP HB3 1 1 16 8126 1 1 28 TRP HD1 H -7.960 -8.075 2.482 1.00 . A A . 28 TRP HD1 1 1 16 8127 1 1 28 TRP HE1 H -9.369 -6.701 4.142 1.00 . A A . 28 TRP HE1 1 1 16 8128 1 1 28 TRP HE3 H -6.306 -3.371 1.369 1.00 . A A . 28 TRP HE3 1 1 16 8129 1 1 28 TRP HH2 H -8.937 -1.701 4.331 1.00 . A A . 28 TRP HH2 1 1 16 8130 1 1 28 TRP HZ2 H -9.756 -3.972 4.894 1.00 . A A . 28 TRP HZ2 1 1 16 8131 1 1 28 TRP HZ3 H -7.215 -1.405 2.571 1.00 . A A . 28 TRP HZ3 1 1 16 8132 1 1 28 TRP N N -5.362 -8.241 2.293 1.00 . A A . 28 TRP N 1 1 16 8133 1 1 28 TRP NE1 N -8.726 -6.302 3.520 1.00 . A A . 28 TRP NE1 1 1 16 8134 1 1 28 TRP O O -4.993 -9.189 -0.975 1.00 . A A . 28 TRP O 1 1 16 8135 1 1 29 GLY C C -2.105 -6.831 -1.751 1.00 . A A . 29 GLY C 1 1 16 8136 1 1 29 GLY CA C -2.515 -8.071 -0.940 1.00 . A A . 29 GLY CA 1 1 16 8137 1 1 29 GLY H H -3.489 -7.102 0.720 1.00 . A A . 29 GLY H 1 1 16 8138 1 1 29 GLY HA2 H -1.664 -8.421 -0.375 1.00 . A A . 29 GLY HA2 1 1 16 8139 1 1 29 GLY HA3 H -2.832 -8.847 -1.620 1.00 . A A . 29 GLY HA3 1 1 16 8140 1 1 29 GLY N N -3.629 -7.755 0.003 1.00 . A A . 29 GLY N 1 1 16 8141 1 1 29 GLY O O -1.500 -6.959 -2.799 1.00 . A A . 29 GLY O 1 1 16 8142 1 1 30 TRP C C -1.783 -3.213 -1.152 1.00 . A A . 30 TRP C 1 1 16 8143 1 1 30 TRP CA C -2.008 -4.424 -2.071 1.00 . A A . 30 TRP CA 1 1 16 8144 1 1 30 TRP CB C -3.152 -4.172 -3.069 1.00 . A A . 30 TRP CB 1 1 16 8145 1 1 30 TRP CD1 C -4.531 -2.500 -1.760 1.00 . A A . 30 TRP CD1 1 1 16 8146 1 1 30 TRP CD2 C -5.656 -4.396 -2.196 1.00 . A A . 30 TRP CD2 1 1 16 8147 1 1 30 TRP CE2 C -6.534 -3.559 -1.470 1.00 . A A . 30 TRP CE2 1 1 16 8148 1 1 30 TRP CE3 C -6.123 -5.661 -2.598 1.00 . A A . 30 TRP CE3 1 1 16 8149 1 1 30 TRP CG C -4.387 -3.703 -2.363 1.00 . A A . 30 TRP CG 1 1 16 8150 1 1 30 TRP CH2 C -8.281 -5.217 -1.562 1.00 . A A . 30 TRP CH2 1 1 16 8151 1 1 30 TRP CZ2 C -7.831 -3.959 -1.155 1.00 . A A . 30 TRP CZ2 1 1 16 8152 1 1 30 TRP CZ3 C -7.429 -6.067 -2.282 1.00 . A A . 30 TRP CZ3 1 1 16 8153 1 1 30 TRP H H -2.892 -5.539 -0.441 1.00 . A A . 30 TRP H 1 1 16 8154 1 1 30 TRP HA H -1.103 -4.630 -2.617 1.00 . A A . 30 TRP HA 1 1 16 8155 1 1 30 TRP HB2 H -2.847 -3.421 -3.780 1.00 . A A . 30 TRP HB2 1 1 16 8156 1 1 30 TRP HB3 H -3.372 -5.090 -3.596 1.00 . A A . 30 TRP HB3 1 1 16 8157 1 1 30 TRP HD1 H -3.774 -1.733 -1.701 1.00 . A A . 30 TRP HD1 1 1 16 8158 1 1 30 TRP HE1 H -6.153 -1.648 -0.736 1.00 . A A . 30 TRP HE1 1 1 16 8159 1 1 30 TRP HE3 H -5.473 -6.322 -3.152 1.00 . A A . 30 TRP HE3 1 1 16 8160 1 1 30 TRP HH2 H -9.284 -5.533 -1.323 1.00 . A A . 30 TRP HH2 1 1 16 8161 1 1 30 TRP HZ2 H -8.482 -3.301 -0.600 1.00 . A A . 30 TRP HZ2 1 1 16 8162 1 1 30 TRP HZ3 H -7.780 -7.039 -2.596 1.00 . A A . 30 TRP HZ3 1 1 16 8163 1 1 30 TRP N N -2.412 -5.637 -1.292 1.00 . A A . 30 TRP N 1 1 16 8164 1 1 30 TRP NE1 N -5.800 -2.416 -1.228 1.00 . A A . 30 TRP NE1 1 1 16 8165 1 1 30 TRP O O -1.834 -3.320 0.057 1.00 . A A . 30 TRP O 1 1 16 8166 1 1 31 CYS C C -2.198 0.302 -1.405 1.00 . A A . 31 CYS C 1 1 16 8167 1 1 31 CYS CA C -1.292 -0.834 -0.923 1.00 . A A . 31 CYS CA 1 1 16 8168 1 1 31 CYS CB C 0.173 -0.469 -1.160 1.00 . A A . 31 CYS CB 1 1 16 8169 1 1 31 CYS H H -1.499 -2.013 -2.709 1.00 . A A . 31 CYS H 1 1 16 8170 1 1 31 CYS HA H -1.459 -1.030 0.123 1.00 . A A . 31 CYS HA 1 1 16 8171 1 1 31 CYS HB2 H 0.772 -1.367 -1.176 1.00 . A A . 31 CYS HB2 1 1 16 8172 1 1 31 CYS HB3 H 0.268 0.045 -2.106 1.00 . A A . 31 CYS HB3 1 1 16 8173 1 1 31 CYS N N -1.530 -2.064 -1.732 1.00 . A A . 31 CYS N 1 1 16 8174 1 1 31 CYS O O -2.232 0.624 -2.580 1.00 . A A . 31 CYS O 1 1 16 8175 1 1 31 CYS SG S 0.742 0.614 0.171 1.00 . A A . 31 CYS SG 1 1 16 8176 1 1 32 ALA C C -3.994 3.011 0.273 1.00 . A A . 32 ALA C 1 1 16 8177 1 1 32 ALA CA C -3.832 2.030 -0.894 1.00 . A A . 32 ALA CA 1 1 16 8178 1 1 32 ALA CB C -5.169 1.366 -1.229 1.00 . A A . 32 ALA CB 1 1 16 8179 1 1 32 ALA H H -2.872 0.623 0.435 1.00 . A A . 32 ALA H 1 1 16 8180 1 1 32 ALA HA H -3.446 2.541 -1.762 1.00 . A A . 32 ALA HA 1 1 16 8181 1 1 32 ALA HB1 H -5.889 2.123 -1.503 1.00 . A A . 32 ALA HB1 1 1 16 8182 1 1 32 ALA HB2 H -5.528 0.822 -0.368 1.00 . A A . 32 ALA HB2 1 1 16 8183 1 1 32 ALA HB3 H -5.035 0.682 -2.056 1.00 . A A . 32 ALA HB3 1 1 16 8184 1 1 32 ALA N N -2.927 0.906 -0.503 1.00 . A A . 32 ALA N 1 1 16 8185 1 1 32 ALA O O -3.515 2.771 1.365 1.00 . A A . 32 ALA O 1 1 16 8186 1 1 33 VAL C C -5.549 4.451 2.352 1.00 . A A . 33 VAL C 1 1 16 8187 1 1 33 VAL CA C -4.864 5.116 1.148 1.00 . A A . 33 VAL CA 1 1 16 8188 1 1 33 VAL CB C -5.766 6.210 0.559 1.00 . A A . 33 VAL CB 1 1 16 8189 1 1 33 VAL CG1 C -6.033 7.282 1.619 1.00 . A A . 33 VAL CG1 1 1 16 8190 1 1 33 VAL CG2 C -5.077 6.858 -0.646 1.00 . A A . 33 VAL CG2 1 1 16 8191 1 1 33 VAL H H -5.046 4.282 -0.840 1.00 . A A . 33 VAL H 1 1 16 8192 1 1 33 VAL HA H -3.916 5.540 1.443 1.00 . A A . 33 VAL HA 1 1 16 8193 1 1 33 VAL HB H -6.703 5.770 0.248 1.00 . A A . 33 VAL HB 1 1 16 8194 1 1 33 VAL HG11 H -6.689 6.884 2.379 1.00 . A A . 33 VAL HG11 1 1 16 8195 1 1 33 VAL HG12 H -6.499 8.138 1.154 1.00 . A A . 33 VAL HG12 1 1 16 8196 1 1 33 VAL HG13 H -5.100 7.582 2.070 1.00 . A A . 33 VAL HG13 1 1 16 8197 1 1 33 VAL HG21 H -5.823 7.160 -1.366 1.00 . A A . 33 VAL HG21 1 1 16 8198 1 1 33 VAL HG22 H -4.404 6.149 -1.101 1.00 . A A . 33 VAL HG22 1 1 16 8199 1 1 33 VAL HG23 H -4.522 7.725 -0.320 1.00 . A A . 33 VAL HG23 1 1 16 8200 1 1 33 VAL N N -4.667 4.116 0.050 1.00 . A A . 33 VAL N 1 1 16 8201 1 1 33 VAL O O -6.287 3.495 2.206 1.00 . A A . 33 VAL O 1 1 16 8202 1 1 34 GLU C C -7.390 4.840 4.892 1.00 . A A . 34 GLU C 1 1 16 8203 1 1 34 GLU CA C -5.943 4.348 4.750 1.00 . A A . 34 GLU CA 1 1 16 8204 1 1 34 GLU CB C -5.085 4.821 5.931 1.00 . A A . 34 GLU CB 1 1 16 8205 1 1 34 GLU CD C -5.826 3.134 7.622 1.00 . A A . 34 GLU CD 1 1 16 8206 1 1 34 GLU CG C -4.652 3.611 6.761 1.00 . A A . 34 GLU CG 1 1 16 8207 1 1 34 GLU H H -4.710 5.722 3.632 1.00 . A A . 34 GLU H 1 1 16 8208 1 1 34 GLU HA H -5.919 3.271 4.687 1.00 . A A . 34 GLU HA 1 1 16 8209 1 1 34 GLU HB2 H -4.209 5.333 5.556 1.00 . A A . 34 GLU HB2 1 1 16 8210 1 1 34 GLU HB3 H -5.660 5.493 6.549 1.00 . A A . 34 GLU HB3 1 1 16 8211 1 1 34 GLU HG2 H -4.340 2.814 6.101 1.00 . A A . 34 GLU HG2 1 1 16 8212 1 1 34 GLU HG3 H -3.829 3.891 7.400 1.00 . A A . 34 GLU HG3 1 1 16 8213 1 1 34 GLU N N -5.308 4.952 3.539 1.00 . A A . 34 GLU N 1 1 16 8214 1 1 34 GLU O O -7.647 5.893 5.446 1.00 . A A . 34 GLU O 1 1 16 8215 1 1 34 GLU OE1 O -6.028 3.703 8.682 1.00 . A A . 34 GLU OE1 1 1 16 8216 1 1 34 GLU OE2 O -6.504 2.208 7.204 1.00 . A A . 34 GLU OE2 1 1 16 8217 1 1 35 ALA C C -10.692 3.271 4.434 1.00 . A A . 35 ALA C 1 1 16 8218 1 1 35 ALA CA C -9.769 4.498 4.486 1.00 . A A . 35 ALA CA 1 1 16 8219 1 1 35 ALA CB C -10.006 5.394 3.269 1.00 . A A . 35 ALA CB 1 1 16 8220 1 1 35 ALA H H -8.101 3.240 3.945 1.00 . A A . 35 ALA H 1 1 16 8221 1 1 35 ALA HA H -9.936 5.058 5.393 1.00 . A A . 35 ALA HA 1 1 16 8222 1 1 35 ALA HB1 H -9.303 6.213 3.284 1.00 . A A . 35 ALA HB1 1 1 16 8223 1 1 35 ALA HB2 H -11.013 5.782 3.299 1.00 . A A . 35 ALA HB2 1 1 16 8224 1 1 35 ALA HB3 H -9.869 4.817 2.367 1.00 . A A . 35 ALA HB3 1 1 16 8225 1 1 35 ALA N N -8.334 4.082 4.389 1.00 . A A . 35 ALA N 1 1 16 8226 1 1 35 ALA O O -10.372 2.283 3.797 1.00 . A A . 35 ALA O 1 1 16 8227 1 1 36 PRO C C -13.506 2.131 3.773 1.00 . A A . 36 PRO C 1 1 16 8228 1 1 36 PRO CA C -12.801 2.265 5.130 1.00 . A A . 36 PRO CA 1 1 16 8229 1 1 36 PRO CB C -13.786 2.683 6.220 1.00 . A A . 36 PRO CB 1 1 16 8230 1 1 36 PRO CD C -12.271 4.532 5.893 1.00 . A A . 36 PRO CD 1 1 16 8231 1 1 36 PRO CG C -13.679 4.173 6.290 1.00 . A A . 36 PRO CG 1 1 16 8232 1 1 36 PRO HA H -12.321 1.339 5.403 1.00 . A A . 36 PRO HA 1 1 16 8233 1 1 36 PRO HB2 H -14.791 2.388 5.950 1.00 . A A . 36 PRO HB2 1 1 16 8234 1 1 36 PRO HB3 H -13.508 2.248 7.167 1.00 . A A . 36 PRO HB3 1 1 16 8235 1 1 36 PRO HD2 H -12.266 5.432 5.292 1.00 . A A . 36 PRO HD2 1 1 16 8236 1 1 36 PRO HD3 H -11.648 4.655 6.767 1.00 . A A . 36 PRO HD3 1 1 16 8237 1 1 36 PRO HG2 H -14.386 4.626 5.607 1.00 . A A . 36 PRO HG2 1 1 16 8238 1 1 36 PRO HG3 H -13.869 4.511 7.296 1.00 . A A . 36 PRO HG3 1 1 16 8239 1 1 36 PRO N N -11.815 3.379 5.105 1.00 . A A . 36 PRO N 1 1 16 8240 1 1 36 PRO O O -13.669 1.010 3.323 1.00 . A A . 36 PRO O 1 1 17 8241 1 1 1 ASP C C 12.695 8.999 -3.842 1.00 . A A . 1 ASP C 1 1 17 8242 1 1 1 ASP CA C 13.870 8.959 -4.829 1.00 . A A . 1 ASP CA 1 1 17 8243 1 1 1 ASP CB C 14.527 7.574 -4.830 1.00 . A A . 1 ASP CB 1 1 17 8244 1 1 1 ASP CG C 14.553 7.020 -6.255 1.00 . A A . 1 ASP CG 1 1 17 8245 1 1 1 ASP H1 H 14.564 10.868 -4.353 1.00 . A A . 1 ASP H1 1 1 17 8246 1 1 1 ASP H2 H 15.731 9.868 -5.074 1.00 . A A . 1 ASP H2 1 1 17 8247 1 1 1 ASP H3 H 15.287 9.628 -3.452 1.00 . A A . 1 ASP H3 1 1 17 8248 1 1 1 ASP HA H 13.532 9.208 -5.823 1.00 . A A . 1 ASP HA 1 1 17 8249 1 1 1 ASP HB2 H 15.538 7.656 -4.457 1.00 . A A . 1 ASP HB2 1 1 17 8250 1 1 1 ASP HB3 H 13.963 6.907 -4.197 1.00 . A A . 1 ASP HB3 1 1 17 8251 1 1 1 ASP N N 14.944 9.902 -4.395 1.00 . A A . 1 ASP N 1 1 17 8252 1 1 1 ASP O O 12.874 8.852 -2.647 1.00 . A A . 1 ASP O 1 1 17 8253 1 1 1 ASP OD1 O 13.587 6.384 -6.642 1.00 . A A . 1 ASP OD1 1 1 17 8254 1 1 1 ASP OD2 O 15.542 7.241 -6.937 1.00 . A A . 1 ASP OD2 1 1 17 8255 1 1 2 GLY C C 9.967 7.845 -2.939 1.00 . A A . 2 GLY C 1 1 17 8256 1 1 2 GLY CA C 10.305 9.252 -3.438 1.00 . A A . 2 GLY CA 1 1 17 8257 1 1 2 GLY H H 11.382 9.313 -5.304 1.00 . A A . 2 GLY H 1 1 17 8258 1 1 2 GLY HA2 H 10.521 9.891 -2.594 1.00 . A A . 2 GLY HA2 1 1 17 8259 1 1 2 GLY HA3 H 9.462 9.648 -3.983 1.00 . A A . 2 GLY HA3 1 1 17 8260 1 1 2 GLY N N 11.498 9.198 -4.337 1.00 . A A . 2 GLY N 1 1 17 8261 1 1 2 GLY O O 9.859 6.912 -3.713 1.00 . A A . 2 GLY O 1 1 17 8262 1 1 3 GLU C C 7.936 6.138 -1.054 1.00 . A A . 3 GLU C 1 1 17 8263 1 1 3 GLU CA C 9.459 6.339 -1.094 1.00 . A A . 3 GLU CA 1 1 17 8264 1 1 3 GLU CB C 10.064 6.317 0.319 1.00 . A A . 3 GLU CB 1 1 17 8265 1 1 3 GLU CD C 10.517 8.264 1.830 1.00 . A A . 3 GLU CD 1 1 17 8266 1 1 3 GLU CG C 9.422 7.405 1.193 1.00 . A A . 3 GLU CG 1 1 17 8267 1 1 3 GLU H H 9.885 8.456 -1.048 1.00 . A A . 3 GLU H 1 1 17 8268 1 1 3 GLU HA H 9.914 5.568 -1.696 1.00 . A A . 3 GLU HA 1 1 17 8269 1 1 3 GLU HB2 H 9.893 5.349 0.767 1.00 . A A . 3 GLU HB2 1 1 17 8270 1 1 3 GLU HB3 H 11.128 6.494 0.253 1.00 . A A . 3 GLU HB3 1 1 17 8271 1 1 3 GLU HG2 H 8.786 8.028 0.581 1.00 . A A . 3 GLU HG2 1 1 17 8272 1 1 3 GLU HG3 H 8.833 6.941 1.969 1.00 . A A . 3 GLU HG3 1 1 17 8273 1 1 3 GLU N N 9.794 7.686 -1.649 1.00 . A A . 3 GLU N 1 1 17 8274 1 1 3 GLU O O 7.366 5.814 -0.029 1.00 . A A . 3 GLU O 1 1 17 8275 1 1 3 GLU OE1 O 10.958 9.202 1.185 1.00 . A A . 3 GLU OE1 1 1 17 8276 1 1 3 GLU OE2 O 10.897 7.971 2.952 1.00 . A A . 3 GLU OE2 1 1 17 8277 1 1 4 CYS C C 5.404 5.239 -3.385 1.00 . A A . 4 CYS C 1 1 17 8278 1 1 4 CYS CA C 5.791 6.147 -2.211 1.00 . A A . 4 CYS CA 1 1 17 8279 1 1 4 CYS CB C 5.227 7.564 -2.391 1.00 . A A . 4 CYS CB 1 1 17 8280 1 1 4 CYS H H 7.755 6.583 -2.983 1.00 . A A . 4 CYS H 1 1 17 8281 1 1 4 CYS HA H 5.439 5.728 -1.281 1.00 . A A . 4 CYS HA 1 1 17 8282 1 1 4 CYS HB2 H 4.965 7.966 -1.425 1.00 . A A . 4 CYS HB2 1 1 17 8283 1 1 4 CYS HB3 H 5.976 8.192 -2.847 1.00 . A A . 4 CYS HB3 1 1 17 8284 1 1 4 CYS N N 7.275 6.327 -2.170 1.00 . A A . 4 CYS N 1 1 17 8285 1 1 4 CYS O O 6.138 5.099 -4.345 1.00 . A A . 4 CYS O 1 1 17 8286 1 1 4 CYS SG S 3.748 7.533 -3.441 1.00 . A A . 4 CYS SG 1 1 17 8287 1 1 5 GLY C C 2.712 4.440 -5.217 1.00 . A A . 5 GLY C 1 1 17 8288 1 1 5 GLY CA C 3.796 3.729 -4.408 1.00 . A A . 5 GLY CA 1 1 17 8289 1 1 5 GLY H H 3.678 4.762 -2.528 1.00 . A A . 5 GLY H 1 1 17 8290 1 1 5 GLY HA2 H 4.633 3.490 -5.048 1.00 . A A . 5 GLY HA2 1 1 17 8291 1 1 5 GLY HA3 H 3.390 2.821 -3.989 1.00 . A A . 5 GLY HA3 1 1 17 8292 1 1 5 GLY N N 4.250 4.626 -3.309 1.00 . A A . 5 GLY N 1 1 17 8293 1 1 5 GLY O O 2.984 5.383 -5.935 1.00 . A A . 5 GLY O 1 1 17 8294 1 1 6 GLY C C -0.951 4.438 -5.131 1.00 . A A . 6 GLY C 1 1 17 8295 1 1 6 GLY CA C 0.380 4.646 -5.867 1.00 . A A . 6 GLY CA 1 1 17 8296 1 1 6 GLY H H 1.295 3.234 -4.520 1.00 . A A . 6 GLY H 1 1 17 8297 1 1 6 GLY HA2 H 0.584 5.704 -5.960 1.00 . A A . 6 GLY HA2 1 1 17 8298 1 1 6 GLY HA3 H 0.317 4.208 -6.851 1.00 . A A . 6 GLY HA3 1 1 17 8299 1 1 6 GLY N N 1.487 3.996 -5.107 1.00 . A A . 6 GLY N 1 1 17 8300 1 1 6 GLY O O -0.978 4.167 -3.945 1.00 . A A . 6 GLY O 1 1 17 8301 1 1 7 PHE C C -3.733 2.886 -5.064 1.00 . A A . 7 PHE C 1 1 17 8302 1 1 7 PHE CA C -3.394 4.379 -5.182 1.00 . A A . 7 PHE CA 1 1 17 8303 1 1 7 PHE CB C -4.384 5.095 -6.109 1.00 . A A . 7 PHE CB 1 1 17 8304 1 1 7 PHE CD1 C -6.363 5.709 -4.664 1.00 . A A . 7 PHE CD1 1 1 17 8305 1 1 7 PHE CD2 C -6.557 3.811 -6.160 1.00 . A A . 7 PHE CD2 1 1 17 8306 1 1 7 PHE CE1 C -7.676 5.498 -4.225 1.00 . A A . 7 PHE CE1 1 1 17 8307 1 1 7 PHE CE2 C -7.869 3.600 -5.722 1.00 . A A . 7 PHE CE2 1 1 17 8308 1 1 7 PHE CG C -5.801 4.866 -5.631 1.00 . A A . 7 PHE CG 1 1 17 8309 1 1 7 PHE CZ C -8.430 4.443 -4.756 1.00 . A A . 7 PHE CZ 1 1 17 8310 1 1 7 PHE H H -2.001 4.787 -6.782 1.00 . A A . 7 PHE H 1 1 17 8311 1 1 7 PHE HA H -3.405 4.837 -4.209 1.00 . A A . 7 PHE HA 1 1 17 8312 1 1 7 PHE HB2 H -4.173 6.153 -6.107 1.00 . A A . 7 PHE HB2 1 1 17 8313 1 1 7 PHE HB3 H -4.279 4.711 -7.113 1.00 . A A . 7 PHE HB3 1 1 17 8314 1 1 7 PHE HD1 H -5.782 6.524 -4.254 1.00 . A A . 7 PHE HD1 1 1 17 8315 1 1 7 PHE HD2 H -6.126 3.161 -6.906 1.00 . A A . 7 PHE HD2 1 1 17 8316 1 1 7 PHE HE1 H -8.110 6.149 -3.480 1.00 . A A . 7 PHE HE1 1 1 17 8317 1 1 7 PHE HE2 H -8.451 2.787 -6.131 1.00 . A A . 7 PHE HE2 1 1 17 8318 1 1 7 PHE HZ H -9.442 4.280 -4.419 1.00 . A A . 7 PHE HZ 1 1 17 8319 1 1 7 PHE N N -2.053 4.567 -5.831 1.00 . A A . 7 PHE N 1 1 17 8320 1 1 7 PHE O O -4.379 2.467 -4.124 1.00 . A A . 7 PHE O 1 1 17 8321 1 1 8 TRP C C -2.385 -0.178 -6.435 1.00 . A A . 8 TRP C 1 1 17 8322 1 1 8 TRP CA C -3.596 0.621 -5.938 1.00 . A A . 8 TRP CA 1 1 17 8323 1 1 8 TRP CB C -4.817 0.413 -6.844 1.00 . A A . 8 TRP CB 1 1 17 8324 1 1 8 TRP CD1 C -5.382 -1.867 -5.902 1.00 . A A . 8 TRP CD1 1 1 17 8325 1 1 8 TRP CD2 C -5.227 -1.875 -8.148 1.00 . A A . 8 TRP CD2 1 1 17 8326 1 1 8 TRP CE2 C -5.542 -3.197 -7.757 1.00 . A A . 8 TRP CE2 1 1 17 8327 1 1 8 TRP CE3 C -5.072 -1.609 -9.521 1.00 . A A . 8 TRP CE3 1 1 17 8328 1 1 8 TRP CG C -5.130 -1.049 -6.950 1.00 . A A . 8 TRP CG 1 1 17 8329 1 1 8 TRP CH2 C -5.544 -3.938 -10.054 1.00 . A A . 8 TRP CH2 1 1 17 8330 1 1 8 TRP CZ2 C -5.701 -4.219 -8.694 1.00 . A A . 8 TRP CZ2 1 1 17 8331 1 1 8 TRP CZ3 C -5.231 -2.635 -10.467 1.00 . A A . 8 TRP CZ3 1 1 17 8332 1 1 8 TRP H H -2.782 2.445 -6.753 1.00 . A A . 8 TRP H 1 1 17 8333 1 1 8 TRP HA H -3.839 0.336 -4.925 1.00 . A A . 8 TRP HA 1 1 17 8334 1 1 8 TRP HB2 H -5.668 0.930 -6.423 1.00 . A A . 8 TRP HB2 1 1 17 8335 1 1 8 TRP HB3 H -4.606 0.809 -7.825 1.00 . A A . 8 TRP HB3 1 1 17 8336 1 1 8 TRP HD1 H -5.390 -1.573 -4.864 1.00 . A A . 8 TRP HD1 1 1 17 8337 1 1 8 TRP HE1 H -5.836 -3.921 -5.825 1.00 . A A . 8 TRP HE1 1 1 17 8338 1 1 8 TRP HE3 H -4.832 -0.610 -9.850 1.00 . A A . 8 TRP HE3 1 1 17 8339 1 1 8 TRP HH2 H -5.666 -4.723 -10.785 1.00 . A A . 8 TRP HH2 1 1 17 8340 1 1 8 TRP HZ2 H -5.944 -5.222 -8.370 1.00 . A A . 8 TRP HZ2 1 1 17 8341 1 1 8 TRP HZ3 H -5.112 -2.421 -11.518 1.00 . A A . 8 TRP HZ3 1 1 17 8342 1 1 8 TRP N N -3.303 2.084 -6.005 1.00 . A A . 8 TRP N 1 1 17 8343 1 1 8 TRP NE1 N -5.626 -3.142 -6.380 1.00 . A A . 8 TRP NE1 1 1 17 8344 1 1 8 TRP O O -2.350 -0.653 -7.555 1.00 . A A . 8 TRP O 1 1 17 8345 1 1 9 TRP C C -0.127 -2.419 -5.249 1.00 . A A . 9 TRP C 1 1 17 8346 1 1 9 TRP CA C -0.160 -1.082 -5.997 1.00 . A A . 9 TRP CA 1 1 17 8347 1 1 9 TRP CB C 1.013 -0.184 -5.578 1.00 . A A . 9 TRP CB 1 1 17 8348 1 1 9 TRP CD1 C 0.206 1.504 -7.294 1.00 . A A . 9 TRP CD1 1 1 17 8349 1 1 9 TRP CD2 C 2.429 1.594 -6.967 1.00 . A A . 9 TRP CD2 1 1 17 8350 1 1 9 TRP CE2 C 2.114 2.581 -7.931 1.00 . A A . 9 TRP CE2 1 1 17 8351 1 1 9 TRP CE3 C 3.772 1.447 -6.584 1.00 . A A . 9 TRP CE3 1 1 17 8352 1 1 9 TRP CG C 1.197 0.922 -6.575 1.00 . A A . 9 TRP CG 1 1 17 8353 1 1 9 TRP CH2 C 4.426 3.236 -8.101 1.00 . A A . 9 TRP CH2 1 1 17 8354 1 1 9 TRP CZ2 C 3.097 3.393 -8.492 1.00 . A A . 9 TRP CZ2 1 1 17 8355 1 1 9 TRP CZ3 C 4.764 2.264 -7.150 1.00 . A A . 9 TRP CZ3 1 1 17 8356 1 1 9 TRP H H -1.443 0.077 -4.702 1.00 . A A . 9 TRP H 1 1 17 8357 1 1 9 TRP HA H -0.142 -1.244 -7.064 1.00 . A A . 9 TRP HA 1 1 17 8358 1 1 9 TRP HB2 H 0.809 0.245 -4.606 1.00 . A A . 9 TRP HB2 1 1 17 8359 1 1 9 TRP HB3 H 1.919 -0.771 -5.523 1.00 . A A . 9 TRP HB3 1 1 17 8360 1 1 9 TRP HD1 H -0.838 1.244 -7.249 1.00 . A A . 9 TRP HD1 1 1 17 8361 1 1 9 TRP HE1 H 0.247 3.054 -8.715 1.00 . A A . 9 TRP HE1 1 1 17 8362 1 1 9 TRP HE3 H 4.043 0.701 -5.852 1.00 . A A . 9 TRP HE3 1 1 17 8363 1 1 9 TRP HH2 H 5.195 3.860 -8.532 1.00 . A A . 9 TRP HH2 1 1 17 8364 1 1 9 TRP HZ2 H 2.826 4.143 -9.219 1.00 . A A . 9 TRP HZ2 1 1 17 8365 1 1 9 TRP HZ3 H 5.792 2.145 -6.847 1.00 . A A . 9 TRP HZ3 1 1 17 8366 1 1 9 TRP N N -1.387 -0.320 -5.599 1.00 . A A . 9 TRP N 1 1 17 8367 1 1 9 TRP NE1 N 0.751 2.484 -8.097 1.00 . A A . 9 TRP NE1 1 1 17 8368 1 1 9 TRP O O -0.731 -2.563 -4.209 1.00 . A A . 9 TRP O 1 1 17 8369 1 1 10 LYS C C 1.757 -4.795 -4.078 1.00 . A A . 10 LYS C 1 1 17 8370 1 1 10 LYS CA C 0.595 -4.730 -5.069 1.00 . A A . 10 LYS CA 1 1 17 8371 1 1 10 LYS CB C 0.789 -5.775 -6.167 1.00 . A A . 10 LYS CB 1 1 17 8372 1 1 10 LYS CD C -0.772 -6.159 -8.089 1.00 . A A . 10 LYS CD 1 1 17 8373 1 1 10 LYS CE C -0.674 -7.517 -8.790 1.00 . A A . 10 LYS CE 1 1 17 8374 1 1 10 LYS CG C -0.571 -6.341 -6.581 1.00 . A A . 10 LYS CG 1 1 17 8375 1 1 10 LYS H H 1.035 -3.282 -6.616 1.00 . A A . 10 LYS H 1 1 17 8376 1 1 10 LYS HA H -0.338 -4.909 -4.560 1.00 . A A . 10 LYS HA 1 1 17 8377 1 1 10 LYS HB2 H 1.272 -5.317 -7.016 1.00 . A A . 10 LYS HB2 1 1 17 8378 1 1 10 LYS HB3 H 1.411 -6.576 -5.789 1.00 . A A . 10 LYS HB3 1 1 17 8379 1 1 10 LYS HD2 H -1.746 -5.727 -8.271 1.00 . A A . 10 LYS HD2 1 1 17 8380 1 1 10 LYS HD3 H -0.009 -5.500 -8.477 1.00 . A A . 10 LYS HD3 1 1 17 8381 1 1 10 LYS HE2 H -0.394 -7.384 -9.827 1.00 . A A . 10 LYS HE2 1 1 17 8382 1 1 10 LYS HE3 H 0.039 -8.151 -8.286 1.00 . A A . 10 LYS HE3 1 1 17 8383 1 1 10 LYS HG2 H -0.612 -7.392 -6.336 1.00 . A A . 10 LYS HG2 1 1 17 8384 1 1 10 LYS HG3 H -1.354 -5.819 -6.051 1.00 . A A . 10 LYS HG3 1 1 17 8385 1 1 10 LYS HZ1 H -2.295 -8.235 -7.692 1.00 . A A . 10 LYS HZ1 1 1 17 8386 1 1 10 LYS HZ2 H -2.052 -9.032 -9.172 1.00 . A A . 10 LYS HZ2 1 1 17 8387 1 1 10 LYS HZ3 H -2.729 -7.473 -9.145 1.00 . A A . 10 LYS HZ3 1 1 17 8388 1 1 10 LYS N N 0.558 -3.407 -5.769 1.00 . A A . 10 LYS N 1 1 17 8389 1 1 10 LYS NZ N -2.041 -8.108 -8.692 1.00 . A A . 10 LYS NZ 1 1 17 8390 1 1 10 LYS O O 2.875 -4.429 -4.390 1.00 . A A . 10 LYS O 1 1 17 8391 1 1 11 CYS C C 2.292 -6.549 -0.909 1.00 . A A . 11 CYS C 1 1 17 8392 1 1 11 CYS CA C 2.581 -5.386 -1.871 1.00 . A A . 11 CYS CA 1 1 17 8393 1 1 11 CYS CB C 2.577 -4.047 -1.125 1.00 . A A . 11 CYS CB 1 1 17 8394 1 1 11 CYS H H 0.593 -5.574 -2.669 1.00 . A A . 11 CYS H 1 1 17 8395 1 1 11 CYS HA H 3.529 -5.533 -2.365 1.00 . A A . 11 CYS HA 1 1 17 8396 1 1 11 CYS HB2 H 3.438 -3.997 -0.478 1.00 . A A . 11 CYS HB2 1 1 17 8397 1 1 11 CYS HB3 H 2.618 -3.239 -1.839 1.00 . A A . 11 CYS HB3 1 1 17 8398 1 1 11 CYS N N 1.498 -5.275 -2.888 1.00 . A A . 11 CYS N 1 1 17 8399 1 1 11 CYS O O 1.196 -7.079 -0.874 1.00 . A A . 11 CYS O 1 1 17 8400 1 1 11 CYS SG S 1.078 -3.890 -0.129 1.00 . A A . 11 CYS SG 1 1 17 8401 1 1 12 GLY C C 2.511 -7.506 2.149 1.00 . A A . 12 GLY C 1 1 17 8402 1 1 12 GLY CA C 3.051 -8.067 0.834 1.00 . A A . 12 GLY CA 1 1 17 8403 1 1 12 GLY H H 4.140 -6.502 -0.172 1.00 . A A . 12 GLY H 1 1 17 8404 1 1 12 GLY HA2 H 2.342 -8.769 0.419 1.00 . A A . 12 GLY HA2 1 1 17 8405 1 1 12 GLY HA3 H 3.989 -8.568 1.018 1.00 . A A . 12 GLY HA3 1 1 17 8406 1 1 12 GLY N N 3.267 -6.946 -0.128 1.00 . A A . 12 GLY N 1 1 17 8407 1 1 12 GLY O O 1.402 -7.006 2.212 1.00 . A A . 12 GLY O 1 1 17 8408 1 1 13 ARG C C 3.256 -5.543 4.636 1.00 . A A . 13 ARG C 1 1 17 8409 1 1 13 ARG CA C 2.839 -7.019 4.512 1.00 . A A . 13 ARG CA 1 1 17 8410 1 1 13 ARG CB C 3.553 -7.875 5.566 1.00 . A A . 13 ARG CB 1 1 17 8411 1 1 13 ARG CD C 2.333 -10.064 5.561 1.00 . A A . 13 ARG CD 1 1 17 8412 1 1 13 ARG CG C 2.531 -8.740 6.309 1.00 . A A . 13 ARG CG 1 1 17 8413 1 1 13 ARG CZ C 4.347 -11.285 4.982 1.00 . A A . 13 ARG CZ 1 1 17 8414 1 1 13 ARG H H 4.188 -7.963 3.115 1.00 . A A . 13 ARG H 1 1 17 8415 1 1 13 ARG HA H 1.769 -7.120 4.614 1.00 . A A . 13 ARG HA 1 1 17 8416 1 1 13 ARG HB2 H 4.280 -8.511 5.082 1.00 . A A . 13 ARG HB2 1 1 17 8417 1 1 13 ARG HB3 H 4.056 -7.231 6.272 1.00 . A A . 13 ARG HB3 1 1 17 8418 1 1 13 ARG HD2 H 1.422 -10.546 5.892 1.00 . A A . 13 ARG HD2 1 1 17 8419 1 1 13 ARG HD3 H 2.305 -9.895 4.496 1.00 . A A . 13 ARG HD3 1 1 17 8420 1 1 13 ARG HE H 3.678 -11.148 6.850 1.00 . A A . 13 ARG HE 1 1 17 8421 1 1 13 ARG HG2 H 2.889 -8.940 7.308 1.00 . A A . 13 ARG HG2 1 1 17 8422 1 1 13 ARG HG3 H 1.588 -8.215 6.364 1.00 . A A . 13 ARG HG3 1 1 17 8423 1 1 13 ARG HH11 H 3.021 -12.503 4.101 1.00 . A A . 13 ARG HH11 1 1 17 8424 1 1 13 ARG HH12 H 4.588 -12.444 3.363 1.00 . A A . 13 ARG HH12 1 1 17 8425 1 1 13 ARG HH21 H 5.868 -10.163 5.649 1.00 . A A . 13 ARG HH21 1 1 17 8426 1 1 13 ARG HH22 H 6.202 -11.113 4.242 1.00 . A A . 13 ARG HH22 1 1 17 8427 1 1 13 ARG N N 3.294 -7.567 3.197 1.00 . A A . 13 ARG N 1 1 17 8428 1 1 13 ARG NE N 3.519 -10.894 5.916 1.00 . A A . 13 ARG NE 1 1 17 8429 1 1 13 ARG NH1 N 3.955 -12.145 4.079 1.00 . A A . 13 ARG NH1 1 1 17 8430 1 1 13 ARG NH2 N 5.567 -10.817 4.956 1.00 . A A . 13 ARG NH2 1 1 17 8431 1 1 13 ARG O O 3.480 -5.042 5.723 1.00 . A A . 13 ARG O 1 1 17 8432 1 1 14 GLY C C 5.249 -3.283 3.216 1.00 . A A . 14 GLY C 1 1 17 8433 1 1 14 GLY CA C 3.764 -3.411 3.566 1.00 . A A . 14 GLY CA 1 1 17 8434 1 1 14 GLY H H 3.174 -5.270 2.665 1.00 . A A . 14 GLY H 1 1 17 8435 1 1 14 GLY HA2 H 3.176 -2.852 2.851 1.00 . A A . 14 GLY HA2 1 1 17 8436 1 1 14 GLY HA3 H 3.596 -3.015 4.555 1.00 . A A . 14 GLY HA3 1 1 17 8437 1 1 14 GLY N N 3.360 -4.845 3.527 1.00 . A A . 14 GLY N 1 1 17 8438 1 1 14 GLY O O 5.945 -2.439 3.752 1.00 . A A . 14 GLY O 1 1 17 8439 1 1 15 LYS C C 7.492 -2.675 1.272 1.00 . A A . 15 LYS C 1 1 17 8440 1 1 15 LYS CA C 7.191 -4.026 1.942 1.00 . A A . 15 LYS CA 1 1 17 8441 1 1 15 LYS CB C 7.434 -5.193 0.977 1.00 . A A . 15 LYS CB 1 1 17 8442 1 1 15 LYS CD C 7.470 -7.208 2.459 1.00 . A A . 15 LYS CD 1 1 17 8443 1 1 15 LYS CE C 7.349 -6.711 3.903 1.00 . A A . 15 LYS CE 1 1 17 8444 1 1 15 LYS CG C 8.331 -6.235 1.650 1.00 . A A . 15 LYS CG 1 1 17 8445 1 1 15 LYS H H 5.165 -4.781 1.900 1.00 . A A . 15 LYS H 1 1 17 8446 1 1 15 LYS HA H 7.804 -4.146 2.815 1.00 . A A . 15 LYS HA 1 1 17 8447 1 1 15 LYS HB2 H 6.491 -5.647 0.712 1.00 . A A . 15 LYS HB2 1 1 17 8448 1 1 15 LYS HB3 H 7.922 -4.828 0.084 1.00 . A A . 15 LYS HB3 1 1 17 8449 1 1 15 LYS HD2 H 6.486 -7.272 2.016 1.00 . A A . 15 LYS HD2 1 1 17 8450 1 1 15 LYS HD3 H 7.931 -8.184 2.453 1.00 . A A . 15 LYS HD3 1 1 17 8451 1 1 15 LYS HE2 H 8.308 -6.364 4.261 1.00 . A A . 15 LYS HE2 1 1 17 8452 1 1 15 LYS HE3 H 6.615 -5.924 3.970 1.00 . A A . 15 LYS HE3 1 1 17 8453 1 1 15 LYS HG2 H 8.878 -6.779 0.894 1.00 . A A . 15 LYS HG2 1 1 17 8454 1 1 15 LYS HG3 H 9.027 -5.738 2.310 1.00 . A A . 15 LYS HG3 1 1 17 8455 1 1 15 LYS HZ1 H 6.083 -8.336 4.216 1.00 . A A . 15 LYS HZ1 1 1 17 8456 1 1 15 LYS HZ2 H 6.627 -7.596 5.644 1.00 . A A . 15 LYS HZ2 1 1 17 8457 1 1 15 LYS HZ3 H 7.674 -8.588 4.747 1.00 . A A . 15 LYS HZ3 1 1 17 8458 1 1 15 LYS N N 5.744 -4.109 2.321 1.00 . A A . 15 LYS N 1 1 17 8459 1 1 15 LYS NZ N 6.899 -7.898 4.686 1.00 . A A . 15 LYS NZ 1 1 17 8460 1 1 15 LYS O O 8.283 -1.903 1.780 1.00 . A A . 15 LYS O 1 1 17 8461 1 1 16 PRO C C 6.326 -0.009 0.185 1.00 . A A . 16 PRO C 1 1 17 8462 1 1 16 PRO CA C 7.041 -1.143 -0.563 1.00 . A A . 16 PRO CA 1 1 17 8463 1 1 16 PRO CB C 6.393 -1.390 -1.921 1.00 . A A . 16 PRO CB 1 1 17 8464 1 1 16 PRO CD C 5.877 -3.293 -0.520 1.00 . A A . 16 PRO CD 1 1 17 8465 1 1 16 PRO CG C 5.381 -2.466 -1.679 1.00 . A A . 16 PRO CG 1 1 17 8466 1 1 16 PRO HA H 8.091 -0.930 -0.682 1.00 . A A . 16 PRO HA 1 1 17 8467 1 1 16 PRO HB2 H 5.910 -0.488 -2.275 1.00 . A A . 16 PRO HB2 1 1 17 8468 1 1 16 PRO HB3 H 7.128 -1.729 -2.634 1.00 . A A . 16 PRO HB3 1 1 17 8469 1 1 16 PRO HD2 H 5.060 -3.541 0.143 1.00 . A A . 16 PRO HD2 1 1 17 8470 1 1 16 PRO HD3 H 6.367 -4.185 -0.873 1.00 . A A . 16 PRO HD3 1 1 17 8471 1 1 16 PRO HG2 H 4.425 -2.021 -1.436 1.00 . A A . 16 PRO HG2 1 1 17 8472 1 1 16 PRO HG3 H 5.286 -3.088 -2.556 1.00 . A A . 16 PRO HG3 1 1 17 8473 1 1 16 PRO N N 6.842 -2.423 0.160 1.00 . A A . 16 PRO N 1 1 17 8474 1 1 16 PRO O O 5.160 -0.133 0.515 1.00 . A A . 16 PRO O 1 1 17 8475 1 1 17 PRO C C 5.450 2.943 0.261 1.00 . A A . 17 PRO C 1 1 17 8476 1 1 17 PRO CA C 6.452 2.212 1.160 1.00 . A A . 17 PRO CA 1 1 17 8477 1 1 17 PRO CB C 7.657 3.095 1.480 1.00 . A A . 17 PRO CB 1 1 17 8478 1 1 17 PRO CD C 8.449 1.299 0.076 1.00 . A A . 17 PRO CD 1 1 17 8479 1 1 17 PRO CG C 8.679 2.742 0.449 1.00 . A A . 17 PRO CG 1 1 17 8480 1 1 17 PRO HA H 5.979 1.886 2.072 1.00 . A A . 17 PRO HA 1 1 17 8481 1 1 17 PRO HB2 H 7.386 4.139 1.406 1.00 . A A . 17 PRO HB2 1 1 17 8482 1 1 17 PRO HB3 H 8.034 2.872 2.466 1.00 . A A . 17 PRO HB3 1 1 17 8483 1 1 17 PRO HD2 H 8.603 1.155 -0.986 1.00 . A A . 17 PRO HD2 1 1 17 8484 1 1 17 PRO HD3 H 9.096 0.650 0.646 1.00 . A A . 17 PRO HD3 1 1 17 8485 1 1 17 PRO HG2 H 8.560 3.375 -0.418 1.00 . A A . 17 PRO HG2 1 1 17 8486 1 1 17 PRO HG3 H 9.672 2.858 0.858 1.00 . A A . 17 PRO HG3 1 1 17 8487 1 1 17 PRO N N 7.043 1.059 0.436 1.00 . A A . 17 PRO N 1 1 17 8488 1 1 17 PRO O O 5.813 3.511 -0.752 1.00 . A A . 17 PRO O 1 1 17 8489 1 1 18 CYS C C 3.139 5.119 0.118 1.00 . A A . 18 CYS C 1 1 17 8490 1 1 18 CYS CA C 3.159 3.622 -0.206 1.00 . A A . 18 CYS CA 1 1 17 8491 1 1 18 CYS CB C 1.826 2.974 0.177 1.00 . A A . 18 CYS CB 1 1 17 8492 1 1 18 CYS H H 3.925 2.460 1.446 1.00 . A A . 18 CYS H 1 1 17 8493 1 1 18 CYS HA H 3.355 3.463 -1.254 1.00 . A A . 18 CYS HA 1 1 17 8494 1 1 18 CYS HB2 H 1.658 3.092 1.238 1.00 . A A . 18 CYS HB2 1 1 17 8495 1 1 18 CYS HB3 H 1.025 3.451 -0.368 1.00 . A A . 18 CYS HB3 1 1 17 8496 1 1 18 CYS N N 4.191 2.929 0.625 1.00 . A A . 18 CYS N 1 1 17 8497 1 1 18 CYS O O 3.779 5.569 1.051 1.00 . A A . 18 CYS O 1 1 17 8498 1 1 18 CYS SG S 1.866 1.211 -0.233 1.00 . A A . 18 CYS SG 1 1 17 8499 1 1 19 CYS C C 1.701 7.614 1.001 1.00 . A A . 19 CYS C 1 1 17 8500 1 1 19 CYS CA C 2.342 7.366 -0.369 1.00 . A A . 19 CYS CA 1 1 17 8501 1 1 19 CYS CB C 1.478 7.953 -1.487 1.00 . A A . 19 CYS CB 1 1 17 8502 1 1 19 CYS H H 1.895 5.511 -1.385 1.00 . A A . 19 CYS H 1 1 17 8503 1 1 19 CYS HA H 3.333 7.795 -0.404 1.00 . A A . 19 CYS HA 1 1 17 8504 1 1 19 CYS HB2 H 0.999 7.152 -2.032 1.00 . A A . 19 CYS HB2 1 1 17 8505 1 1 19 CYS HB3 H 0.724 8.596 -1.061 1.00 . A A . 19 CYS HB3 1 1 17 8506 1 1 19 CYS N N 2.406 5.895 -0.642 1.00 . A A . 19 CYS N 1 1 17 8507 1 1 19 CYS O O 0.863 6.852 1.447 1.00 . A A . 19 CYS O 1 1 17 8508 1 1 19 CYS SG S 2.520 8.909 -2.617 1.00 . A A . 19 CYS SG 1 1 17 8509 1 1 20 LYS C C -0.005 8.939 2.993 1.00 . A A . 20 LYS C 1 1 17 8510 1 1 20 LYS CA C 1.531 8.964 3.026 1.00 . A A . 20 LYS CA 1 1 17 8511 1 1 20 LYS CB C 2.050 10.361 3.391 1.00 . A A . 20 LYS CB 1 1 17 8512 1 1 20 LYS CD C 2.770 12.100 1.741 1.00 . A A . 20 LYS CD 1 1 17 8513 1 1 20 LYS CE C 2.355 12.739 0.413 1.00 . A A . 20 LYS CE 1 1 17 8514 1 1 20 LYS CG C 1.565 11.392 2.365 1.00 . A A . 20 LYS CG 1 1 17 8515 1 1 20 LYS H H 2.787 9.252 1.297 1.00 . A A . 20 LYS H 1 1 17 8516 1 1 20 LYS HA H 1.897 8.246 3.740 1.00 . A A . 20 LYS HA 1 1 17 8517 1 1 20 LYS HB2 H 1.686 10.633 4.371 1.00 . A A . 20 LYS HB2 1 1 17 8518 1 1 20 LYS HB3 H 3.130 10.350 3.402 1.00 . A A . 20 LYS HB3 1 1 17 8519 1 1 20 LYS HD2 H 3.128 12.864 2.415 1.00 . A A . 20 LYS HD2 1 1 17 8520 1 1 20 LYS HD3 H 3.556 11.381 1.561 1.00 . A A . 20 LYS HD3 1 1 17 8521 1 1 20 LYS HE2 H 2.434 12.017 -0.390 1.00 . A A . 20 LYS HE2 1 1 17 8522 1 1 20 LYS HE3 H 1.349 13.121 0.477 1.00 . A A . 20 LYS HE3 1 1 17 8523 1 1 20 LYS HG2 H 1.000 10.893 1.590 1.00 . A A . 20 LYS HG2 1 1 17 8524 1 1 20 LYS HG3 H 0.938 12.120 2.854 1.00 . A A . 20 LYS HG3 1 1 17 8525 1 1 20 LYS HZ1 H 3.070 14.368 -0.669 1.00 . A A . 20 LYS HZ1 1 1 17 8526 1 1 20 LYS HZ2 H 4.280 13.478 0.124 1.00 . A A . 20 LYS HZ2 1 1 17 8527 1 1 20 LYS HZ3 H 3.265 14.515 1.009 1.00 . A A . 20 LYS HZ3 1 1 17 8528 1 1 20 LYS N N 2.101 8.664 1.675 1.00 . A A . 20 LYS N 1 1 17 8529 1 1 20 LYS NZ N 3.316 13.860 0.204 1.00 . A A . 20 LYS NZ 1 1 17 8530 1 1 20 LYS O O -0.630 9.493 2.107 1.00 . A A . 20 LYS O 1 1 17 8531 1 1 21 GLY C C -2.550 6.821 3.468 1.00 . A A . 21 GLY C 1 1 17 8532 1 1 21 GLY CA C -2.102 8.193 3.985 1.00 . A A . 21 GLY CA 1 1 17 8533 1 1 21 GLY H H -0.083 7.831 4.640 1.00 . A A . 21 GLY H 1 1 17 8534 1 1 21 GLY HA2 H -2.444 8.327 5.001 1.00 . A A . 21 GLY HA2 1 1 17 8535 1 1 21 GLY HA3 H -2.524 8.965 3.358 1.00 . A A . 21 GLY HA3 1 1 17 8536 1 1 21 GLY N N -0.611 8.280 3.949 1.00 . A A . 21 GLY N 1 1 17 8537 1 1 21 GLY O O -3.593 6.321 3.845 1.00 . A A . 21 GLY O 1 1 17 8538 1 1 22 TYR C C -1.568 3.756 2.951 1.00 . A A . 22 TYR C 1 1 17 8539 1 1 22 TYR CA C -2.147 4.867 2.065 1.00 . A A . 22 TYR CA 1 1 17 8540 1 1 22 TYR CB C -1.524 4.791 0.662 1.00 . A A . 22 TYR CB 1 1 17 8541 1 1 22 TYR CD1 C -3.107 6.715 0.142 1.00 . A A . 22 TYR CD1 1 1 17 8542 1 1 22 TYR CD2 C -1.337 6.185 -1.429 1.00 . A A . 22 TYR CD2 1 1 17 8543 1 1 22 TYR CE1 C -3.534 7.755 -0.693 1.00 . A A . 22 TYR CE1 1 1 17 8544 1 1 22 TYR CE2 C -1.767 7.223 -2.262 1.00 . A A . 22 TYR CE2 1 1 17 8545 1 1 22 TYR CG C -2.006 5.927 -0.225 1.00 . A A . 22 TYR CG 1 1 17 8546 1 1 22 TYR CZ C -2.864 8.009 -1.895 1.00 . A A . 22 TYR CZ 1 1 17 8547 1 1 22 TYR H H -0.934 6.631 2.321 1.00 . A A . 22 TYR H 1 1 17 8548 1 1 22 TYR HA H -3.220 4.775 1.999 1.00 . A A . 22 TYR HA 1 1 17 8549 1 1 22 TYR HB2 H -0.450 4.842 0.749 1.00 . A A . 22 TYR HB2 1 1 17 8550 1 1 22 TYR HB3 H -1.796 3.849 0.207 1.00 . A A . 22 TYR HB3 1 1 17 8551 1 1 22 TYR HD1 H -3.627 6.521 1.068 1.00 . A A . 22 TYR HD1 1 1 17 8552 1 1 22 TYR HD2 H -0.489 5.580 -1.712 1.00 . A A . 22 TYR HD2 1 1 17 8553 1 1 22 TYR HE1 H -4.381 8.360 -0.410 1.00 . A A . 22 TYR HE1 1 1 17 8554 1 1 22 TYR HE2 H -1.248 7.419 -3.191 1.00 . A A . 22 TYR HE2 1 1 17 8555 1 1 22 TYR HH H -2.849 9.840 -2.437 1.00 . A A . 22 TYR HH 1 1 17 8556 1 1 22 TYR N N -1.769 6.209 2.609 1.00 . A A . 22 TYR N 1 1 17 8557 1 1 22 TYR O O -0.565 3.940 3.615 1.00 . A A . 22 TYR O 1 1 17 8558 1 1 22 TYR OH O -3.287 9.032 -2.719 1.00 . A A . 22 TYR OH 1 1 17 8559 1 1 23 ALA C C -1.720 0.170 2.966 1.00 . A A . 23 ALA C 1 1 17 8560 1 1 23 ALA CA C -1.678 1.467 3.779 1.00 . A A . 23 ALA CA 1 1 17 8561 1 1 23 ALA CB C -2.627 1.381 4.977 1.00 . A A . 23 ALA CB 1 1 17 8562 1 1 23 ALA H H -2.991 2.480 2.400 1.00 . A A . 23 ALA H 1 1 17 8563 1 1 23 ALA HA H -0.673 1.668 4.117 1.00 . A A . 23 ALA HA 1 1 17 8564 1 1 23 ALA HB1 H -2.053 1.260 5.883 1.00 . A A . 23 ALA HB1 1 1 17 8565 1 1 23 ALA HB2 H -3.288 0.536 4.855 1.00 . A A . 23 ALA HB2 1 1 17 8566 1 1 23 ALA HB3 H -3.211 2.289 5.040 1.00 . A A . 23 ALA HB3 1 1 17 8567 1 1 23 ALA N N -2.188 2.603 2.952 1.00 . A A . 23 ALA N 1 1 17 8568 1 1 23 ALA O O -2.539 0.010 2.081 1.00 . A A . 23 ALA O 1 1 17 8569 1 1 24 CYS C C -1.758 -3.064 3.189 1.00 . A A . 24 CYS C 1 1 17 8570 1 1 24 CYS CA C -0.839 -2.051 2.504 1.00 . A A . 24 CYS CA 1 1 17 8571 1 1 24 CYS CB C 0.612 -2.541 2.535 1.00 . A A . 24 CYS CB 1 1 17 8572 1 1 24 CYS H H -0.195 -0.609 3.980 1.00 . A A . 24 CYS H 1 1 17 8573 1 1 24 CYS HA H -1.150 -1.891 1.484 1.00 . A A . 24 CYS HA 1 1 17 8574 1 1 24 CYS HB2 H 1.152 -2.028 3.315 1.00 . A A . 24 CYS HB2 1 1 17 8575 1 1 24 CYS HB3 H 0.629 -3.605 2.726 1.00 . A A . 24 CYS HB3 1 1 17 8576 1 1 24 CYS N N -0.845 -0.760 3.260 1.00 . A A . 24 CYS N 1 1 17 8577 1 1 24 CYS O O -2.124 -2.906 4.340 1.00 . A A . 24 CYS O 1 1 17 8578 1 1 24 CYS SG S 1.395 -2.207 0.942 1.00 . A A . 24 CYS SG 1 1 17 8579 1 1 25 SER C C -2.473 -6.534 2.847 1.00 . A A . 25 SER C 1 1 17 8580 1 1 25 SER CA C -3.026 -5.130 3.096 1.00 . A A . 25 SER CA 1 1 17 8581 1 1 25 SER CB C -4.379 -4.948 2.403 1.00 . A A . 25 SER CB 1 1 17 8582 1 1 25 SER H H -1.823 -4.208 1.564 1.00 . A A . 25 SER H 1 1 17 8583 1 1 25 SER HA H -3.133 -4.956 4.151 1.00 . A A . 25 SER HA 1 1 17 8584 1 1 25 SER HB2 H -4.270 -4.289 1.560 1.00 . A A . 25 SER HB2 1 1 17 8585 1 1 25 SER HB3 H -4.739 -5.910 2.063 1.00 . A A . 25 SER HB3 1 1 17 8586 1 1 25 SER HG H -5.901 -5.078 3.611 1.00 . A A . 25 SER HG 1 1 17 8587 1 1 25 SER N N -2.132 -4.103 2.490 1.00 . A A . 25 SER N 1 1 17 8588 1 1 25 SER O O -2.623 -7.087 1.776 1.00 . A A . 25 SER O 1 1 17 8589 1 1 25 SER OG O -5.304 -4.382 3.324 1.00 . A A . 25 SER OG 1 1 17 8590 1 1 26 LYS C C -2.411 -9.484 3.347 1.00 . A A . 26 LYS C 1 1 17 8591 1 1 26 LYS CA C -1.283 -8.492 3.668 1.00 . A A . 26 LYS CA 1 1 17 8592 1 1 26 LYS CB C -0.629 -8.830 5.013 1.00 . A A . 26 LYS CB 1 1 17 8593 1 1 26 LYS CD C -1.013 -9.054 7.475 1.00 . A A . 26 LYS CD 1 1 17 8594 1 1 26 LYS CE C -1.828 -10.002 8.365 1.00 . A A . 26 LYS CE 1 1 17 8595 1 1 26 LYS CG C -1.695 -8.918 6.113 1.00 . A A . 26 LYS CG 1 1 17 8596 1 1 26 LYS H H -1.735 -6.644 4.690 1.00 . A A . 26 LYS H 1 1 17 8597 1 1 26 LYS HA H -0.543 -8.503 2.886 1.00 . A A . 26 LYS HA 1 1 17 8598 1 1 26 LYS HB2 H -0.120 -9.777 4.933 1.00 . A A . 26 LYS HB2 1 1 17 8599 1 1 26 LYS HB3 H 0.081 -8.060 5.268 1.00 . A A . 26 LYS HB3 1 1 17 8600 1 1 26 LYS HD2 H -0.017 -9.450 7.343 1.00 . A A . 26 LYS HD2 1 1 17 8601 1 1 26 LYS HD3 H -0.955 -8.084 7.946 1.00 . A A . 26 LYS HD3 1 1 17 8602 1 1 26 LYS HE2 H -2.258 -10.796 7.769 1.00 . A A . 26 LYS HE2 1 1 17 8603 1 1 26 LYS HE3 H -1.205 -10.412 9.144 1.00 . A A . 26 LYS HE3 1 1 17 8604 1 1 26 LYS HG2 H -2.302 -8.024 6.100 1.00 . A A . 26 LYS HG2 1 1 17 8605 1 1 26 LYS HG3 H -2.321 -9.781 5.939 1.00 . A A . 26 LYS HG3 1 1 17 8606 1 1 26 LYS HZ1 H -3.496 -8.763 8.202 1.00 . A A . 26 LYS HZ1 1 1 17 8607 1 1 26 LYS HZ2 H -2.469 -8.376 9.500 1.00 . A A . 26 LYS HZ2 1 1 17 8608 1 1 26 LYS HZ3 H -3.487 -9.732 9.593 1.00 . A A . 26 LYS HZ3 1 1 17 8609 1 1 26 LYS N N -1.840 -7.113 3.835 1.00 . A A . 26 LYS N 1 1 17 8610 1 1 26 LYS NZ N -2.901 -9.154 8.961 1.00 . A A . 26 LYS NZ 1 1 17 8611 1 1 26 LYS O O -2.222 -10.436 2.613 1.00 . A A . 26 LYS O 1 1 17 8612 1 1 27 THR C C -5.220 -10.015 2.182 1.00 . A A . 27 THR C 1 1 17 8613 1 1 27 THR CA C -4.737 -10.174 3.628 1.00 . A A . 27 THR CA 1 1 17 8614 1 1 27 THR CB C -5.835 -9.736 4.606 1.00 . A A . 27 THR CB 1 1 17 8615 1 1 27 THR CG2 C -6.978 -10.756 4.590 1.00 . A A . 27 THR CG2 1 1 17 8616 1 1 27 THR H H -3.700 -8.480 4.476 1.00 . A A . 27 THR H 1 1 17 8617 1 1 27 THR HA H -4.457 -11.193 3.821 1.00 . A A . 27 THR HA 1 1 17 8618 1 1 27 THR HB H -6.217 -8.768 4.308 1.00 . A A . 27 THR HB 1 1 17 8619 1 1 27 THR HG1 H -5.508 -8.786 6.276 1.00 . A A . 27 THR HG1 1 1 17 8620 1 1 27 THR HG21 H -6.891 -11.385 3.716 1.00 . A A . 27 THR HG21 1 1 17 8621 1 1 27 THR HG22 H -7.923 -10.235 4.564 1.00 . A A . 27 THR HG22 1 1 17 8622 1 1 27 THR HG23 H -6.929 -11.367 5.479 1.00 . A A . 27 THR HG23 1 1 17 8623 1 1 27 THR N N -3.582 -9.258 3.892 1.00 . A A . 27 THR N 1 1 17 8624 1 1 27 THR O O -5.560 -10.980 1.523 1.00 . A A . 27 THR O 1 1 17 8625 1 1 27 THR OG1 O -5.292 -9.652 5.920 1.00 . A A . 27 THR OG1 1 1 17 8626 1 1 28 TRP C C -4.560 -8.822 -0.690 1.00 . A A . 28 TRP C 1 1 17 8627 1 1 28 TRP CA C -5.714 -8.568 0.286 1.00 . A A . 28 TRP CA 1 1 17 8628 1 1 28 TRP CB C -6.146 -7.098 0.236 1.00 . A A . 28 TRP CB 1 1 17 8629 1 1 28 TRP CD1 C -7.917 -7.792 1.919 1.00 . A A . 28 TRP CD1 1 1 17 8630 1 1 28 TRP CD2 C -7.837 -5.565 1.606 1.00 . A A . 28 TRP CD2 1 1 17 8631 1 1 28 TRP CE2 C -8.854 -5.807 2.558 1.00 . A A . 28 TRP CE2 1 1 17 8632 1 1 28 TRP CE3 C -7.583 -4.234 1.229 1.00 . A A . 28 TRP CE3 1 1 17 8633 1 1 28 TRP CG C -7.253 -6.842 1.215 1.00 . A A . 28 TRP CG 1 1 17 8634 1 1 28 TRP CH2 C -9.332 -3.448 2.729 1.00 . A A . 28 TRP CH2 1 1 17 8635 1 1 28 TRP CZ2 C -9.595 -4.764 3.115 1.00 . A A . 28 TRP CZ2 1 1 17 8636 1 1 28 TRP CZ3 C -8.326 -3.182 1.789 1.00 . A A . 28 TRP CZ3 1 1 17 8637 1 1 28 TRP H H -4.972 -8.048 2.245 1.00 . A A . 28 TRP H 1 1 17 8638 1 1 28 TRP HA H -6.550 -9.208 0.052 1.00 . A A . 28 TRP HA 1 1 17 8639 1 1 28 TRP HB2 H -5.303 -6.469 0.478 1.00 . A A . 28 TRP HB2 1 1 17 8640 1 1 28 TRP HB3 H -6.489 -6.862 -0.760 1.00 . A A . 28 TRP HB3 1 1 17 8641 1 1 28 TRP HD1 H -7.732 -8.853 1.870 1.00 . A A . 28 TRP HD1 1 1 17 8642 1 1 28 TRP HE1 H -9.468 -7.639 3.331 1.00 . A A . 28 TRP HE1 1 1 17 8643 1 1 28 TRP HE3 H -6.810 -4.019 0.507 1.00 . A A . 28 TRP HE3 1 1 17 8644 1 1 28 TRP HH2 H -9.899 -2.636 3.156 1.00 . A A . 28 TRP HH2 1 1 17 8645 1 1 28 TRP HZ2 H -10.369 -4.974 3.838 1.00 . A A . 28 TRP HZ2 1 1 17 8646 1 1 28 TRP HZ3 H -8.123 -2.164 1.491 1.00 . A A . 28 TRP HZ3 1 1 17 8647 1 1 28 TRP N N -5.252 -8.804 1.690 1.00 . A A . 28 TRP N 1 1 17 8648 1 1 28 TRP NE1 N -8.860 -7.177 2.720 1.00 . A A . 28 TRP NE1 1 1 17 8649 1 1 28 TRP O O -4.689 -9.582 -1.632 1.00 . A A . 28 TRP O 1 1 17 8650 1 1 29 GLY C C -1.898 -7.108 -2.100 1.00 . A A . 29 GLY C 1 1 17 8651 1 1 29 GLY CA C -2.254 -8.403 -1.353 1.00 . A A . 29 GLY CA 1 1 17 8652 1 1 29 GLY H H -3.357 -7.603 0.317 1.00 . A A . 29 GLY H 1 1 17 8653 1 1 29 GLY HA2 H -1.407 -8.714 -0.757 1.00 . A A . 29 GLY HA2 1 1 17 8654 1 1 29 GLY HA3 H -2.482 -9.174 -2.072 1.00 . A A . 29 GLY HA3 1 1 17 8655 1 1 29 GLY N N -3.432 -8.199 -0.459 1.00 . A A . 29 GLY N 1 1 17 8656 1 1 29 GLY O O -1.200 -7.147 -3.097 1.00 . A A . 29 GLY O 1 1 17 8657 1 1 30 TRP C C -1.968 -3.495 -1.394 1.00 . A A . 30 TRP C 1 1 17 8658 1 1 30 TRP CA C -2.004 -4.692 -2.356 1.00 . A A . 30 TRP CA 1 1 17 8659 1 1 30 TRP CB C -3.078 -4.512 -3.441 1.00 . A A . 30 TRP CB 1 1 17 8660 1 1 30 TRP CD1 C -4.778 -3.105 -2.194 1.00 . A A . 30 TRP CD1 1 1 17 8661 1 1 30 TRP CD2 C -5.596 -5.106 -2.814 1.00 . A A . 30 TRP CD2 1 1 17 8662 1 1 30 TRP CE2 C -6.640 -4.432 -2.140 1.00 . A A . 30 TRP CE2 1 1 17 8663 1 1 30 TRP CE3 C -5.853 -6.396 -3.312 1.00 . A A . 30 TRP CE3 1 1 17 8664 1 1 30 TRP CG C -4.422 -4.244 -2.832 1.00 . A A . 30 TRP CG 1 1 17 8665 1 1 30 TRP CH2 C -8.133 -6.297 -2.465 1.00 . A A . 30 TRP CH2 1 1 17 8666 1 1 30 TRP CZ2 C -7.895 -5.015 -1.964 1.00 . A A . 30 TRP CZ2 1 1 17 8667 1 1 30 TRP CZ3 C -7.114 -6.986 -3.138 1.00 . A A . 30 TRP CZ3 1 1 17 8668 1 1 30 TRP H H -2.907 -5.932 -0.828 1.00 . A A . 30 TRP H 1 1 17 8669 1 1 30 TRP HA H -1.039 -4.796 -2.826 1.00 . A A . 30 TRP HA 1 1 17 8670 1 1 30 TRP HB2 H -2.806 -3.683 -4.075 1.00 . A A . 30 TRP HB2 1 1 17 8671 1 1 30 TRP HB3 H -3.132 -5.411 -4.038 1.00 . A A . 30 TRP HB3 1 1 17 8672 1 1 30 TRP HD1 H -4.141 -2.250 -2.030 1.00 . A A . 30 TRP HD1 1 1 17 8673 1 1 30 TRP HE1 H -6.588 -2.530 -1.292 1.00 . A A . 30 TRP HE1 1 1 17 8674 1 1 30 TRP HE3 H -5.074 -6.936 -3.830 1.00 . A A . 30 TRP HE3 1 1 17 8675 1 1 30 TRP HH2 H -9.101 -6.756 -2.335 1.00 . A A . 30 TRP HH2 1 1 17 8676 1 1 30 TRP HZ2 H -8.676 -4.480 -1.445 1.00 . A A . 30 TRP HZ2 1 1 17 8677 1 1 30 TRP HZ3 H -7.301 -7.979 -3.524 1.00 . A A . 30 TRP HZ3 1 1 17 8678 1 1 30 TRP N N -2.352 -5.960 -1.640 1.00 . A A . 30 TRP N 1 1 17 8679 1 1 30 TRP NE1 N -6.091 -3.216 -1.780 1.00 . A A . 30 TRP NE1 1 1 17 8680 1 1 30 TRP O O -2.026 -3.648 -0.191 1.00 . A A . 30 TRP O 1 1 17 8681 1 1 31 CYS C C -2.765 -0.012 -1.620 1.00 . A A . 31 CYS C 1 1 17 8682 1 1 31 CYS CA C -1.807 -1.078 -1.082 1.00 . A A . 31 CYS CA 1 1 17 8683 1 1 31 CYS CB C -0.362 -0.588 -1.192 1.00 . A A . 31 CYS CB 1 1 17 8684 1 1 31 CYS H H -1.814 -2.215 -2.906 1.00 . A A . 31 CYS H 1 1 17 8685 1 1 31 CYS HA H -2.039 -1.316 -0.056 1.00 . A A . 31 CYS HA 1 1 17 8686 1 1 31 CYS HB2 H 0.310 -1.430 -1.124 1.00 . A A . 31 CYS HB2 1 1 17 8687 1 1 31 CYS HB3 H -0.222 -0.094 -2.143 1.00 . A A . 31 CYS HB3 1 1 17 8688 1 1 31 CYS N N -1.862 -2.303 -1.931 1.00 . A A . 31 CYS N 1 1 17 8689 1 1 31 CYS O O -2.763 0.303 -2.797 1.00 . A A . 31 CYS O 1 1 17 8690 1 1 31 CYS SG S -0.013 0.575 0.149 1.00 . A A . 31 CYS SG 1 1 17 8691 1 1 32 ALA C C -4.779 2.599 -0.053 1.00 . A A . 32 ALA C 1 1 17 8692 1 1 32 ALA CA C -4.529 1.611 -1.200 1.00 . A A . 32 ALA CA 1 1 17 8693 1 1 32 ALA CB C -5.812 0.859 -1.568 1.00 . A A . 32 ALA CB 1 1 17 8694 1 1 32 ALA H H -3.545 0.283 0.183 1.00 . A A . 32 ALA H 1 1 17 8695 1 1 32 ALA HA H -4.145 2.130 -2.063 1.00 . A A . 32 ALA HA 1 1 17 8696 1 1 32 ALA HB1 H -6.636 1.554 -1.621 1.00 . A A . 32 ALA HB1 1 1 17 8697 1 1 32 ALA HB2 H -6.018 0.109 -0.819 1.00 . A A . 32 ALA HB2 1 1 17 8698 1 1 32 ALA HB3 H -5.683 0.381 -2.529 1.00 . A A . 32 ALA HB3 1 1 17 8699 1 1 32 ALA N N -3.572 0.552 -0.760 1.00 . A A . 32 ALA N 1 1 17 8700 1 1 32 ALA O O -4.175 2.500 0.998 1.00 . A A . 32 ALA O 1 1 17 8701 1 1 33 VAL C C -6.744 3.860 1.965 1.00 . A A . 33 VAL C 1 1 17 8702 1 1 33 VAL CA C -5.940 4.540 0.849 1.00 . A A . 33 VAL CA 1 1 17 8703 1 1 33 VAL CB C -6.756 5.671 0.198 1.00 . A A . 33 VAL CB 1 1 17 8704 1 1 33 VAL CG1 C -6.842 6.857 1.165 1.00 . A A . 33 VAL CG1 1 1 17 8705 1 1 33 VAL CG2 C -6.077 6.130 -1.099 1.00 . A A . 33 VAL CG2 1 1 17 8706 1 1 33 VAL H H -6.137 3.613 -1.097 1.00 . A A . 33 VAL H 1 1 17 8707 1 1 33 VAL HA H -5.015 4.933 1.241 1.00 . A A . 33 VAL HA 1 1 17 8708 1 1 33 VAL HB H -7.751 5.315 -0.021 1.00 . A A . 33 VAL HB 1 1 17 8709 1 1 33 VAL HG11 H -6.773 6.499 2.182 1.00 . A A . 33 VAL HG11 1 1 17 8710 1 1 33 VAL HG12 H -7.785 7.366 1.026 1.00 . A A . 33 VAL HG12 1 1 17 8711 1 1 33 VAL HG13 H -6.031 7.543 0.969 1.00 . A A . 33 VAL HG13 1 1 17 8712 1 1 33 VAL HG21 H -6.613 5.730 -1.945 1.00 . A A . 33 VAL HG21 1 1 17 8713 1 1 33 VAL HG22 H -5.059 5.774 -1.118 1.00 . A A . 33 VAL HG22 1 1 17 8714 1 1 33 VAL HG23 H -6.082 7.210 -1.147 1.00 . A A . 33 VAL HG23 1 1 17 8715 1 1 33 VAL N N -5.661 3.550 -0.243 1.00 . A A . 33 VAL N 1 1 17 8716 1 1 33 VAL O O -7.960 3.812 1.931 1.00 . A A . 33 VAL O 1 1 17 8717 1 1 34 GLU C C -6.715 3.462 5.353 1.00 . A A . 34 GLU C 1 1 17 8718 1 1 34 GLU CA C -6.777 2.628 4.065 1.00 . A A . 34 GLU CA 1 1 17 8719 1 1 34 GLU CB C -6.034 1.300 4.244 1.00 . A A . 34 GLU CB 1 1 17 8720 1 1 34 GLU CD C -5.862 -1.023 3.326 1.00 . A A . 34 GLU CD 1 1 17 8721 1 1 34 GLU CG C -6.231 0.427 2.999 1.00 . A A . 34 GLU CG 1 1 17 8722 1 1 34 GLU H H -5.086 3.365 2.945 1.00 . A A . 34 GLU H 1 1 17 8723 1 1 34 GLU HA H -7.800 2.438 3.795 1.00 . A A . 34 GLU HA 1 1 17 8724 1 1 34 GLU HB2 H -4.981 1.495 4.385 1.00 . A A . 34 GLU HB2 1 1 17 8725 1 1 34 GLU HB3 H -6.424 0.785 5.108 1.00 . A A . 34 GLU HB3 1 1 17 8726 1 1 34 GLU HG2 H -7.265 0.473 2.686 1.00 . A A . 34 GLU HG2 1 1 17 8727 1 1 34 GLU HG3 H -5.598 0.787 2.202 1.00 . A A . 34 GLU HG3 1 1 17 8728 1 1 34 GLU N N -6.066 3.321 2.947 1.00 . A A . 34 GLU N 1 1 17 8729 1 1 34 GLU O O -7.617 3.417 6.170 1.00 . A A . 34 GLU O 1 1 17 8730 1 1 34 GLU OE1 O -6.606 -1.656 4.056 1.00 . A A . 34 GLU OE1 1 1 17 8731 1 1 34 GLU OE2 O -4.838 -1.476 2.840 1.00 . A A . 34 GLU OE2 1 1 17 8732 1 1 35 ALA C C -6.230 6.415 6.575 1.00 . A A . 35 ALA C 1 1 17 8733 1 1 35 ALA CA C -5.545 5.056 6.780 1.00 . A A . 35 ALA CA 1 1 17 8734 1 1 35 ALA CB C -4.042 5.245 7.001 1.00 . A A . 35 ALA CB 1 1 17 8735 1 1 35 ALA H H -4.949 4.241 4.871 1.00 . A A . 35 ALA H 1 1 17 8736 1 1 35 ALA HA H -5.977 4.541 7.624 1.00 . A A . 35 ALA HA 1 1 17 8737 1 1 35 ALA HB1 H -3.708 6.132 6.481 1.00 . A A . 35 ALA HB1 1 1 17 8738 1 1 35 ALA HB2 H -3.510 4.385 6.624 1.00 . A A . 35 ALA HB2 1 1 17 8739 1 1 35 ALA HB3 H -3.846 5.354 8.057 1.00 . A A . 35 ALA HB3 1 1 17 8740 1 1 35 ALA N N -5.661 4.220 5.543 1.00 . A A . 35 ALA N 1 1 17 8741 1 1 35 ALA O O -6.365 6.877 5.457 1.00 . A A . 35 ALA O 1 1 17 8742 1 1 36 PRO C C -6.324 9.439 7.232 1.00 . A A . 36 PRO C 1 1 17 8743 1 1 36 PRO CA C -7.321 8.334 7.610 1.00 . A A . 36 PRO CA 1 1 17 8744 1 1 36 PRO CB C -7.850 8.532 9.030 1.00 . A A . 36 PRO CB 1 1 17 8745 1 1 36 PRO CD C -6.515 6.524 9.050 1.00 . A A . 36 PRO CD 1 1 17 8746 1 1 36 PRO CG C -6.969 7.690 9.892 1.00 . A A . 36 PRO CG 1 1 17 8747 1 1 36 PRO HA H -8.141 8.306 6.911 1.00 . A A . 36 PRO HA 1 1 17 8748 1 1 36 PRO HB2 H -7.778 9.573 9.313 1.00 . A A . 36 PRO HB2 1 1 17 8749 1 1 36 PRO HB3 H -8.872 8.192 9.101 1.00 . A A . 36 PRO HB3 1 1 17 8750 1 1 36 PRO HD2 H -5.486 6.275 9.275 1.00 . A A . 36 PRO HD2 1 1 17 8751 1 1 36 PRO HD3 H -7.157 5.672 9.204 1.00 . A A . 36 PRO HD3 1 1 17 8752 1 1 36 PRO HG2 H -6.116 8.267 10.221 1.00 . A A . 36 PRO HG2 1 1 17 8753 1 1 36 PRO HG3 H -7.523 7.328 10.745 1.00 . A A . 36 PRO HG3 1 1 17 8754 1 1 36 PRO N N -6.641 7.013 7.669 1.00 . A A . 36 PRO N 1 1 17 8755 1 1 36 PRO O O -5.273 9.508 7.852 1.00 . A A . 36 PRO O 1 1 18 8756 1 1 1 ASP C C 10.834 10.846 -2.833 1.00 . A A . 1 ASP C 1 1 18 8757 1 1 1 ASP CA C 9.687 11.672 -2.240 1.00 . A A . 1 ASP CA 1 1 18 8758 1 1 1 ASP CB C 9.292 12.803 -3.196 1.00 . A A . 1 ASP CB 1 1 18 8759 1 1 1 ASP CG C 7.808 13.135 -3.015 1.00 . A A . 1 ASP CG 1 1 18 8760 1 1 1 ASP H1 H 10.412 11.641 -0.283 1.00 . A A . 1 ASP H1 1 1 18 8761 1 1 1 ASP H2 H 9.345 12.925 -0.605 1.00 . A A . 1 ASP H2 1 1 18 8762 1 1 1 ASP H3 H 10.941 12.973 -1.191 1.00 . A A . 1 ASP H3 1 1 18 8763 1 1 1 ASP HA H 8.834 11.044 -2.043 1.00 . A A . 1 ASP HA 1 1 18 8764 1 1 1 ASP HB2 H 9.887 13.679 -2.983 1.00 . A A . 1 ASP HB2 1 1 18 8765 1 1 1 ASP HB3 H 9.467 12.489 -4.215 1.00 . A A . 1 ASP HB3 1 1 18 8766 1 1 1 ASP N N 10.130 12.354 -0.985 1.00 . A A . 1 ASP N 1 1 18 8767 1 1 1 ASP O O 11.990 11.219 -2.747 1.00 . A A . 1 ASP O 1 1 18 8768 1 1 1 ASP OD1 O 6.994 12.494 -3.660 1.00 . A A . 1 ASP OD1 1 1 18 8769 1 1 1 ASP OD2 O 7.510 14.025 -2.234 1.00 . A A . 1 ASP OD2 1 1 18 8770 1 1 2 GLY C C 11.061 7.446 -4.232 1.00 . A A . 2 GLY C 1 1 18 8771 1 1 2 GLY CA C 11.589 8.868 -4.034 1.00 . A A . 2 GLY CA 1 1 18 8772 1 1 2 GLY H H 9.583 9.446 -3.491 1.00 . A A . 2 GLY H 1 1 18 8773 1 1 2 GLY HA2 H 11.883 9.279 -4.990 1.00 . A A . 2 GLY HA2 1 1 18 8774 1 1 2 GLY HA3 H 12.442 8.842 -3.376 1.00 . A A . 2 GLY HA3 1 1 18 8775 1 1 2 GLY N N 10.522 9.724 -3.434 1.00 . A A . 2 GLY N 1 1 18 8776 1 1 2 GLY O O 10.773 7.031 -5.339 1.00 . A A . 2 GLY O 1 1 18 8777 1 1 3 GLU C C 8.993 5.197 -2.741 1.00 . A A . 3 GLU C 1 1 18 8778 1 1 3 GLU CA C 10.425 5.293 -3.285 1.00 . A A . 3 GLU CA 1 1 18 8779 1 1 3 GLU CB C 11.388 4.444 -2.448 1.00 . A A . 3 GLU CB 1 1 18 8780 1 1 3 GLU CD C 12.989 2.528 -2.623 1.00 . A A . 3 GLU CD 1 1 18 8781 1 1 3 GLU CG C 11.716 3.153 -3.202 1.00 . A A . 3 GLU CG 1 1 18 8782 1 1 3 GLU H H 11.171 7.053 -2.285 1.00 . A A . 3 GLU H 1 1 18 8783 1 1 3 GLU HA H 10.454 4.971 -4.314 1.00 . A A . 3 GLU HA 1 1 18 8784 1 1 3 GLU HB2 H 12.299 5.001 -2.274 1.00 . A A . 3 GLU HB2 1 1 18 8785 1 1 3 GLU HB3 H 10.929 4.200 -1.502 1.00 . A A . 3 GLU HB3 1 1 18 8786 1 1 3 GLU HG2 H 10.894 2.459 -3.099 1.00 . A A . 3 GLU HG2 1 1 18 8787 1 1 3 GLU HG3 H 11.870 3.376 -4.248 1.00 . A A . 3 GLU HG3 1 1 18 8788 1 1 3 GLU N N 10.933 6.694 -3.166 1.00 . A A . 3 GLU N 1 1 18 8789 1 1 3 GLU O O 8.778 5.031 -1.554 1.00 . A A . 3 GLU O 1 1 18 8790 1 1 3 GLU OE1 O 14.061 2.874 -3.092 1.00 . A A . 3 GLU OE1 1 1 18 8791 1 1 3 GLU OE2 O 12.868 1.713 -1.723 1.00 . A A . 3 GLU OE2 1 1 18 8792 1 1 4 CYS C C 5.776 4.387 -4.167 1.00 . A A . 4 CYS C 1 1 18 8793 1 1 4 CYS CA C 6.593 5.210 -3.160 1.00 . A A . 4 CYS CA 1 1 18 8794 1 1 4 CYS CB C 6.109 6.670 -3.078 1.00 . A A . 4 CYS CB 1 1 18 8795 1 1 4 CYS H H 8.219 5.431 -4.558 1.00 . A A . 4 CYS H 1 1 18 8796 1 1 4 CYS HA H 6.542 4.756 -2.181 1.00 . A A . 4 CYS HA 1 1 18 8797 1 1 4 CYS HB2 H 5.770 6.874 -2.076 1.00 . A A . 4 CYS HB2 1 1 18 8798 1 1 4 CYS HB3 H 6.932 7.329 -3.314 1.00 . A A . 4 CYS HB3 1 1 18 8799 1 1 4 CYS N N 8.015 5.298 -3.608 1.00 . A A . 4 CYS N 1 1 18 8800 1 1 4 CYS O O 6.122 4.292 -5.330 1.00 . A A . 4 CYS O 1 1 18 8801 1 1 4 CYS SG S 4.747 6.974 -4.239 1.00 . A A . 4 CYS SG 1 1 18 8802 1 1 5 GLY C C 2.842 3.852 -5.352 1.00 . A A . 5 GLY C 1 1 18 8803 1 1 5 GLY CA C 3.862 2.960 -4.640 1.00 . A A . 5 GLY CA 1 1 18 8804 1 1 5 GLY H H 4.448 3.874 -2.784 1.00 . A A . 5 GLY H 1 1 18 8805 1 1 5 GLY HA2 H 4.495 2.480 -5.370 1.00 . A A . 5 GLY HA2 1 1 18 8806 1 1 5 GLY HA3 H 3.340 2.209 -4.068 1.00 . A A . 5 GLY HA3 1 1 18 8807 1 1 5 GLY N N 4.701 3.785 -3.723 1.00 . A A . 5 GLY N 1 1 18 8808 1 1 5 GLY O O 3.192 4.842 -5.966 1.00 . A A . 5 GLY O 1 1 18 8809 1 1 6 GLY C C -0.751 4.295 -5.096 1.00 . A A . 6 GLY C 1 1 18 8810 1 1 6 GLY CA C 0.527 4.323 -5.942 1.00 . A A . 6 GLY CA 1 1 18 8811 1 1 6 GLY H H 1.330 2.699 -4.774 1.00 . A A . 6 GLY H 1 1 18 8812 1 1 6 GLY HA2 H 0.875 5.341 -6.043 1.00 . A A . 6 GLY HA2 1 1 18 8813 1 1 6 GLY HA3 H 0.319 3.915 -6.917 1.00 . A A . 6 GLY HA3 1 1 18 8814 1 1 6 GLY N N 1.583 3.505 -5.273 1.00 . A A . 6 GLY N 1 1 18 8815 1 1 6 GLY O O -0.696 4.196 -3.884 1.00 . A A . 6 GLY O 1 1 18 8816 1 1 7 PHE C C -3.647 2.911 -4.701 1.00 . A A . 7 PHE C 1 1 18 8817 1 1 7 PHE CA C -3.181 4.355 -4.947 1.00 . A A . 7 PHE CA 1 1 18 8818 1 1 7 PHE CB C -4.195 5.108 -5.817 1.00 . A A . 7 PHE CB 1 1 18 8819 1 1 7 PHE CD1 C -5.771 5.578 -3.898 1.00 . A A . 7 PHE CD1 1 1 18 8820 1 1 7 PHE CD2 C -6.630 4.443 -5.861 1.00 . A A . 7 PHE CD2 1 1 18 8821 1 1 7 PHE CE1 C -7.038 5.513 -3.306 1.00 . A A . 7 PHE CE1 1 1 18 8822 1 1 7 PHE CE2 C -7.898 4.379 -5.269 1.00 . A A . 7 PHE CE2 1 1 18 8823 1 1 7 PHE CG C -5.567 5.044 -5.177 1.00 . A A . 7 PHE CG 1 1 18 8824 1 1 7 PHE CZ C -8.101 4.912 -3.990 1.00 . A A . 7 PHE CZ 1 1 18 8825 1 1 7 PHE H H -1.918 4.453 -6.699 1.00 . A A . 7 PHE H 1 1 18 8826 1 1 7 PHE HA H -3.057 4.867 -4.009 1.00 . A A . 7 PHE HA 1 1 18 8827 1 1 7 PHE HB2 H -3.890 6.141 -5.910 1.00 . A A . 7 PHE HB2 1 1 18 8828 1 1 7 PHE HB3 H -4.234 4.657 -6.798 1.00 . A A . 7 PHE HB3 1 1 18 8829 1 1 7 PHE HD1 H -4.952 6.043 -3.369 1.00 . A A . 7 PHE HD1 1 1 18 8830 1 1 7 PHE HD2 H -6.475 4.032 -6.847 1.00 . A A . 7 PHE HD2 1 1 18 8831 1 1 7 PHE HE1 H -7.195 5.925 -2.319 1.00 . A A . 7 PHE HE1 1 1 18 8832 1 1 7 PHE HE2 H -8.718 3.916 -5.797 1.00 . A A . 7 PHE HE2 1 1 18 8833 1 1 7 PHE HZ H -9.078 4.862 -3.534 1.00 . A A . 7 PHE HZ 1 1 18 8834 1 1 7 PHE N N -1.898 4.377 -5.721 1.00 . A A . 7 PHE N 1 1 18 8835 1 1 7 PHE O O -4.335 2.637 -3.737 1.00 . A A . 7 PHE O 1 1 18 8836 1 1 8 TRP C C -2.666 -0.365 -5.990 1.00 . A A . 8 TRP C 1 1 18 8837 1 1 8 TRP CA C -3.709 0.575 -5.375 1.00 . A A . 8 TRP CA 1 1 18 8838 1 1 8 TRP CB C -5.054 0.470 -6.103 1.00 . A A . 8 TRP CB 1 1 18 8839 1 1 8 TRP CD1 C -6.116 -1.709 -5.376 1.00 . A A . 8 TRP CD1 1 1 18 8840 1 1 8 TRP CD2 C -6.965 0.072 -4.294 1.00 . A A . 8 TRP CD2 1 1 18 8841 1 1 8 TRP CE2 C -7.643 -1.066 -3.798 1.00 . A A . 8 TRP CE2 1 1 18 8842 1 1 8 TRP CE3 C -7.314 1.333 -3.773 1.00 . A A . 8 TRP CE3 1 1 18 8843 1 1 8 TRP CG C -6.001 -0.362 -5.297 1.00 . A A . 8 TRP CG 1 1 18 8844 1 1 8 TRP CH2 C -8.965 0.301 -2.312 1.00 . A A . 8 TRP CH2 1 1 18 8845 1 1 8 TRP CZ2 C -8.631 -0.958 -2.817 1.00 . A A . 8 TRP CZ2 1 1 18 8846 1 1 8 TRP CZ3 C -8.308 1.444 -2.788 1.00 . A A . 8 TRP CZ3 1 1 18 8847 1 1 8 TRP H H -2.733 2.241 -6.334 1.00 . A A . 8 TRP H 1 1 18 8848 1 1 8 TRP HA H -3.840 0.357 -4.327 1.00 . A A . 8 TRP HA 1 1 18 8849 1 1 8 TRP HB2 H -5.469 1.457 -6.233 1.00 . A A . 8 TRP HB2 1 1 18 8850 1 1 8 TRP HB3 H -4.907 0.012 -7.068 1.00 . A A . 8 TRP HB3 1 1 18 8851 1 1 8 TRP HD1 H -5.542 -2.350 -6.028 1.00 . A A . 8 TRP HD1 1 1 18 8852 1 1 8 TRP HE1 H -7.368 -3.056 -4.350 1.00 . A A . 8 TRP HE1 1 1 18 8853 1 1 8 TRP HE3 H -6.814 2.218 -4.134 1.00 . A A . 8 TRP HE3 1 1 18 8854 1 1 8 TRP HH2 H -9.729 0.393 -1.553 1.00 . A A . 8 TRP HH2 1 1 18 8855 1 1 8 TRP HZ2 H -9.135 -1.842 -2.454 1.00 . A A . 8 TRP HZ2 1 1 18 8856 1 1 8 TRP HZ3 H -8.569 2.416 -2.395 1.00 . A A . 8 TRP HZ3 1 1 18 8857 1 1 8 TRP N N -3.284 1.996 -5.562 1.00 . A A . 8 TRP N 1 1 18 8858 1 1 8 TRP NE1 N -7.090 -2.127 -4.487 1.00 . A A . 8 TRP NE1 1 1 18 8859 1 1 8 TRP O O -2.909 -1.020 -6.987 1.00 . A A . 8 TRP O 1 1 18 8860 1 1 9 TRP C C -0.422 -2.650 -5.179 1.00 . A A . 9 TRP C 1 1 18 8861 1 1 9 TRP CA C -0.419 -1.318 -5.937 1.00 . A A . 9 TRP CA 1 1 18 8862 1 1 9 TRP CB C 0.887 -0.549 -5.697 1.00 . A A . 9 TRP CB 1 1 18 8863 1 1 9 TRP CD1 C -0.009 1.210 -7.295 1.00 . A A . 9 TRP CD1 1 1 18 8864 1 1 9 TRP CD2 C 2.238 1.135 -7.261 1.00 . A A . 9 TRP CD2 1 1 18 8865 1 1 9 TRP CE2 C 1.875 2.150 -8.178 1.00 . A A . 9 TRP CE2 1 1 18 8866 1 1 9 TRP CE3 C 3.606 0.887 -7.056 1.00 . A A . 9 TRP CE3 1 1 18 8867 1 1 9 TRP CG C 1.022 0.552 -6.710 1.00 . A A . 9 TRP CG 1 1 18 8868 1 1 9 TRP CH2 C 4.187 2.636 -8.648 1.00 . A A . 9 TRP CH2 1 1 18 8869 1 1 9 TRP CZ2 C 2.833 2.893 -8.863 1.00 . A A . 9 TRP CZ2 1 1 18 8870 1 1 9 TRP CZ3 C 4.574 1.634 -7.747 1.00 . A A . 9 TRP CZ3 1 1 18 8871 1 1 9 TRP H H -1.330 0.112 -4.595 1.00 . A A . 9 TRP H 1 1 18 8872 1 1 9 TRP HA H -0.562 -1.487 -6.993 1.00 . A A . 9 TRP HA 1 1 18 8873 1 1 9 TRP HB2 H 0.877 -0.120 -4.705 1.00 . A A . 9 TRP HB2 1 1 18 8874 1 1 9 TRP HB3 H 1.725 -1.223 -5.787 1.00 . A A . 9 TRP HB3 1 1 18 8875 1 1 9 TRP HD1 H -1.056 1.025 -7.114 1.00 . A A . 9 TRP HD1 1 1 18 8876 1 1 9 TRP HE1 H -0.039 2.764 -8.713 1.00 . A A . 9 TRP HE1 1 1 18 8877 1 1 9 TRP HE3 H 3.914 0.118 -6.364 1.00 . A A . 9 TRP HE3 1 1 18 8878 1 1 9 TRP HH2 H 4.936 3.207 -9.176 1.00 . A A . 9 TRP HH2 1 1 18 8879 1 1 9 TRP HZ2 H 2.528 3.666 -9.550 1.00 . A A . 9 TRP HZ2 1 1 18 8880 1 1 9 TRP HZ3 H 5.620 1.438 -7.581 1.00 . A A . 9 TRP HZ3 1 1 18 8881 1 1 9 TRP N N -1.498 -0.429 -5.397 1.00 . A A . 9 TRP N 1 1 18 8882 1 1 9 TRP NE1 N 0.497 2.154 -8.165 1.00 . A A . 9 TRP NE1 1 1 18 8883 1 1 9 TRP O O -0.960 -2.745 -4.099 1.00 . A A . 9 TRP O 1 1 18 8884 1 1 10 LYS C C 1.378 -5.160 -4.131 1.00 . A A . 10 LYS C 1 1 18 8885 1 1 10 LYS CA C 0.154 -5.006 -5.032 1.00 . A A . 10 LYS CA 1 1 18 8886 1 1 10 LYS CB C 0.192 -6.062 -6.133 1.00 . A A . 10 LYS CB 1 1 18 8887 1 1 10 LYS CD C -1.812 -5.655 -7.574 1.00 . A A . 10 LYS CD 1 1 18 8888 1 1 10 LYS CE C -1.165 -6.035 -8.911 1.00 . A A . 10 LYS CE 1 1 18 8889 1 1 10 LYS CG C -1.230 -6.524 -6.455 1.00 . A A . 10 LYS CG 1 1 18 8890 1 1 10 LYS H H 0.578 -3.595 -6.618 1.00 . A A . 10 LYS H 1 1 18 8891 1 1 10 LYS HA H -0.751 -5.115 -4.453 1.00 . A A . 10 LYS HA 1 1 18 8892 1 1 10 LYS HB2 H 0.650 -5.645 -7.016 1.00 . A A . 10 LYS HB2 1 1 18 8893 1 1 10 LYS HB3 H 0.774 -6.909 -5.793 1.00 . A A . 10 LYS HB3 1 1 18 8894 1 1 10 LYS HD2 H -2.880 -5.810 -7.631 1.00 . A A . 10 LYS HD2 1 1 18 8895 1 1 10 LYS HD3 H -1.612 -4.614 -7.363 1.00 . A A . 10 LYS HD3 1 1 18 8896 1 1 10 LYS HE2 H -1.026 -5.154 -9.522 1.00 . A A . 10 LYS HE2 1 1 18 8897 1 1 10 LYS HE3 H -0.223 -6.532 -8.746 1.00 . A A . 10 LYS HE3 1 1 18 8898 1 1 10 LYS HG2 H -1.210 -7.556 -6.773 1.00 . A A . 10 LYS HG2 1 1 18 8899 1 1 10 LYS HG3 H -1.847 -6.432 -5.572 1.00 . A A . 10 LYS HG3 1 1 18 8900 1 1 10 LYS HZ1 H -3.037 -6.485 -9.712 1.00 . A A . 10 LYS HZ1 1 1 18 8901 1 1 10 LYS HZ2 H -2.275 -7.799 -8.947 1.00 . A A . 10 LYS HZ2 1 1 18 8902 1 1 10 LYS HZ3 H -1.748 -7.278 -10.476 1.00 . A A . 10 LYS HZ3 1 1 18 8903 1 1 10 LYS N N 0.157 -3.683 -5.737 1.00 . A A . 10 LYS N 1 1 18 8904 1 1 10 LYS NZ N -2.129 -6.970 -9.559 1.00 . A A . 10 LYS NZ 1 1 18 8905 1 1 10 LYS O O 2.501 -4.947 -4.550 1.00 . A A . 10 LYS O 1 1 18 8906 1 1 11 CYS C C 1.964 -6.819 -0.919 1.00 . A A . 11 CYS C 1 1 18 8907 1 1 11 CYS CA C 2.308 -5.755 -1.971 1.00 . A A . 11 CYS CA 1 1 18 8908 1 1 11 CYS CB C 2.546 -4.391 -1.319 1.00 . A A . 11 CYS CB 1 1 18 8909 1 1 11 CYS H H 0.253 -5.736 -2.599 1.00 . A A . 11 CYS H 1 1 18 8910 1 1 11 CYS HA H 3.182 -6.052 -2.530 1.00 . A A . 11 CYS HA 1 1 18 8911 1 1 11 CYS HB2 H 3.431 -4.439 -0.704 1.00 . A A . 11 CYS HB2 1 1 18 8912 1 1 11 CYS HB3 H 2.682 -3.645 -2.087 1.00 . A A . 11 CYS HB3 1 1 18 8913 1 1 11 CYS N N 1.165 -5.554 -2.903 1.00 . A A . 11 CYS N 1 1 18 8914 1 1 11 CYS O O 0.874 -7.365 -0.908 1.00 . A A . 11 CYS O 1 1 18 8915 1 1 11 CYS SG S 1.134 -3.938 -0.287 1.00 . A A . 11 CYS SG 1 1 18 8916 1 1 12 GLY C C 2.241 -7.433 2.331 1.00 . A A . 12 GLY C 1 1 18 8917 1 1 12 GLY CA C 2.613 -8.137 1.024 1.00 . A A . 12 GLY CA 1 1 18 8918 1 1 12 GLY H H 3.751 -6.661 -0.057 1.00 . A A . 12 GLY H 1 1 18 8919 1 1 12 GLY HA2 H 1.798 -8.774 0.711 1.00 . A A . 12 GLY HA2 1 1 18 8920 1 1 12 GLY HA3 H 3.499 -8.734 1.180 1.00 . A A . 12 GLY HA3 1 1 18 8921 1 1 12 GLY N N 2.883 -7.115 -0.031 1.00 . A A . 12 GLY N 1 1 18 8922 1 1 12 GLY O O 1.290 -6.673 2.387 1.00 . A A . 12 GLY O 1 1 18 8923 1 1 13 ARG C C 3.465 -5.694 4.803 1.00 . A A . 13 ARG C 1 1 18 8924 1 1 13 ARG CA C 2.692 -7.020 4.694 1.00 . A A . 13 ARG CA 1 1 18 8925 1 1 13 ARG CB C 3.169 -8.021 5.752 1.00 . A A . 13 ARG CB 1 1 18 8926 1 1 13 ARG CD C 3.150 -7.185 8.116 1.00 . A A . 13 ARG CD 1 1 18 8927 1 1 13 ARG CG C 2.324 -7.873 7.023 1.00 . A A . 13 ARG CG 1 1 18 8928 1 1 13 ARG CZ C 5.212 -8.400 8.519 1.00 . A A . 13 ARG CZ 1 1 18 8929 1 1 13 ARG H H 3.750 -8.289 3.305 1.00 . A A . 13 ARG H 1 1 18 8930 1 1 13 ARG HA H 1.632 -6.847 4.798 1.00 . A A . 13 ARG HA 1 1 18 8931 1 1 13 ARG HB2 H 3.065 -9.027 5.368 1.00 . A A . 13 ARG HB2 1 1 18 8932 1 1 13 ARG HB3 H 4.205 -7.833 5.987 1.00 . A A . 13 ARG HB3 1 1 18 8933 1 1 13 ARG HD2 H 3.814 -6.452 7.680 1.00 . A A . 13 ARG HD2 1 1 18 8934 1 1 13 ARG HD3 H 2.500 -6.720 8.841 1.00 . A A . 13 ARG HD3 1 1 18 8935 1 1 13 ARG HE H 3.488 -8.907 9.367 1.00 . A A . 13 ARG HE 1 1 18 8936 1 1 13 ARG HG2 H 1.450 -7.277 6.804 1.00 . A A . 13 ARG HG2 1 1 18 8937 1 1 13 ARG HG3 H 2.020 -8.849 7.367 1.00 . A A . 13 ARG HG3 1 1 18 8938 1 1 13 ARG HH11 H 5.740 -6.871 9.706 1.00 . A A . 13 ARG HH11 1 1 18 8939 1 1 13 ARG HH12 H 7.044 -7.676 8.899 1.00 . A A . 13 ARG HH12 1 1 18 8940 1 1 13 ARG HH21 H 4.983 -9.960 7.281 1.00 . A A . 13 ARG HH21 1 1 18 8941 1 1 13 ARG HH22 H 6.615 -9.432 7.526 1.00 . A A . 13 ARG HH22 1 1 18 8942 1 1 13 ARG N N 2.988 -7.676 3.381 1.00 . A A . 13 ARG N 1 1 18 8943 1 1 13 ARG NE N 3.932 -8.279 8.760 1.00 . A A . 13 ARG NE 1 1 18 8944 1 1 13 ARG NH1 N 6.065 -7.585 9.086 1.00 . A A . 13 ARG NH1 1 1 18 8945 1 1 13 ARG NH2 N 5.636 -9.337 7.712 1.00 . A A . 13 ARG NH2 1 1 18 8946 1 1 13 ARG O O 4.187 -5.459 5.756 1.00 . A A . 13 ARG O 1 1 18 8947 1 1 14 GLY C C 5.510 -3.734 3.463 1.00 . A A . 14 GLY C 1 1 18 8948 1 1 14 GLY CA C 4.046 -3.524 3.867 1.00 . A A . 14 GLY CA 1 1 18 8949 1 1 14 GLY H H 2.738 -5.039 3.071 1.00 . A A . 14 GLY H 1 1 18 8950 1 1 14 GLY HA2 H 3.579 -2.833 3.181 1.00 . A A . 14 GLY HA2 1 1 18 8951 1 1 14 GLY HA3 H 4.007 -3.117 4.866 1.00 . A A . 14 GLY HA3 1 1 18 8952 1 1 14 GLY N N 3.322 -4.828 3.830 1.00 . A A . 14 GLY N 1 1 18 8953 1 1 14 GLY O O 6.403 -3.116 4.010 1.00 . A A . 14 GLY O 1 1 18 8954 1 1 15 LYS C C 7.707 -3.636 1.295 1.00 . A A . 15 LYS C 1 1 18 8955 1 1 15 LYS CA C 7.170 -4.850 2.069 1.00 . A A . 15 LYS CA 1 1 18 8956 1 1 15 LYS CB C 7.105 -6.093 1.171 1.00 . A A . 15 LYS CB 1 1 18 8957 1 1 15 LYS CD C 8.764 -7.865 0.579 1.00 . A A . 15 LYS CD 1 1 18 8958 1 1 15 LYS CE C 9.971 -7.012 0.171 1.00 . A A . 15 LYS CE 1 1 18 8959 1 1 15 LYS CG C 8.021 -7.185 1.730 1.00 . A A . 15 LYS CG 1 1 18 8960 1 1 15 LYS H H 5.022 -5.087 2.082 1.00 . A A . 15 LYS H 1 1 18 8961 1 1 15 LYS HA H 7.792 -5.047 2.921 1.00 . A A . 15 LYS HA 1 1 18 8962 1 1 15 LYS HB2 H 6.091 -6.459 1.135 1.00 . A A . 15 LYS HB2 1 1 18 8963 1 1 15 LYS HB3 H 7.430 -5.833 0.175 1.00 . A A . 15 LYS HB3 1 1 18 8964 1 1 15 LYS HD2 H 9.101 -8.840 0.894 1.00 . A A . 15 LYS HD2 1 1 18 8965 1 1 15 LYS HD3 H 8.099 -7.969 -0.267 1.00 . A A . 15 LYS HD3 1 1 18 8966 1 1 15 LYS HE2 H 9.640 -6.095 -0.296 1.00 . A A . 15 LYS HE2 1 1 18 8967 1 1 15 LYS HE3 H 10.585 -6.797 1.030 1.00 . A A . 15 LYS HE3 1 1 18 8968 1 1 15 LYS HG2 H 8.735 -6.744 2.411 1.00 . A A . 15 LYS HG2 1 1 18 8969 1 1 15 LYS HG3 H 7.427 -7.919 2.255 1.00 . A A . 15 LYS HG3 1 1 18 8970 1 1 15 LYS HZ1 H 11.525 -7.301 -1.186 1.00 . A A . 15 LYS HZ1 1 1 18 8971 1 1 15 LYS HZ2 H 10.097 -8.136 -1.581 1.00 . A A . 15 LYS HZ2 1 1 18 8972 1 1 15 LYS HZ3 H 11.094 -8.696 -0.324 1.00 . A A . 15 LYS HZ3 1 1 18 8973 1 1 15 LYS N N 5.760 -4.600 2.510 1.00 . A A . 15 LYS N 1 1 18 8974 1 1 15 LYS NZ N 10.728 -7.849 -0.803 1.00 . A A . 15 LYS NZ 1 1 18 8975 1 1 15 LYS O O 8.699 -3.050 1.686 1.00 . A A . 15 LYS O 1 1 18 8976 1 1 16 PRO C C 7.049 -0.818 0.104 1.00 . A A . 16 PRO C 1 1 18 8977 1 1 16 PRO CA C 7.444 -2.126 -0.598 1.00 . A A . 16 PRO CA 1 1 18 8978 1 1 16 PRO CB C 6.661 -2.304 -1.895 1.00 . A A . 16 PRO CB 1 1 18 8979 1 1 16 PRO CD C 5.828 -3.938 -0.314 1.00 . A A . 16 PRO CD 1 1 18 8980 1 1 16 PRO CG C 5.461 -3.116 -1.522 1.00 . A A . 16 PRO CG 1 1 18 8981 1 1 16 PRO HA H 8.503 -2.155 -0.793 1.00 . A A . 16 PRO HA 1 1 18 8982 1 1 16 PRO HB2 H 6.360 -1.342 -2.285 1.00 . A A . 16 PRO HB2 1 1 18 8983 1 1 16 PRO HB3 H 7.255 -2.836 -2.621 1.00 . A A . 16 PRO HB3 1 1 18 8984 1 1 16 PRO HD2 H 5.030 -3.917 0.415 1.00 . A A . 16 PRO HD2 1 1 18 8985 1 1 16 PRO HD3 H 6.055 -4.953 -0.599 1.00 . A A . 16 PRO HD3 1 1 18 8986 1 1 16 PRO HG2 H 4.634 -2.461 -1.287 1.00 . A A . 16 PRO HG2 1 1 18 8987 1 1 16 PRO HG3 H 5.193 -3.770 -2.337 1.00 . A A . 16 PRO HG3 1 1 18 8988 1 1 16 PRO N N 7.028 -3.288 0.225 1.00 . A A . 16 PRO N 1 1 18 8989 1 1 16 PRO O O 6.009 -0.746 0.732 1.00 . A A . 16 PRO O 1 1 18 8990 1 1 17 PRO C C 6.525 2.244 -0.144 1.00 . A A . 17 PRO C 1 1 18 8991 1 1 17 PRO CA C 7.624 1.489 0.614 1.00 . A A . 17 PRO CA 1 1 18 8992 1 1 17 PRO CB C 8.957 2.225 0.506 1.00 . A A . 17 PRO CB 1 1 18 8993 1 1 17 PRO CD C 9.169 0.176 -0.756 1.00 . A A . 17 PRO CD 1 1 18 8994 1 1 17 PRO CG C 9.653 1.601 -0.660 1.00 . A A . 17 PRO CG 1 1 18 8995 1 1 17 PRO HA H 7.354 1.363 1.650 1.00 . A A . 17 PRO HA 1 1 18 8996 1 1 17 PRO HB2 H 8.789 3.279 0.327 1.00 . A A . 17 PRO HB2 1 1 18 8997 1 1 17 PRO HB3 H 9.538 2.083 1.403 1.00 . A A . 17 PRO HB3 1 1 18 8998 1 1 17 PRO HD2 H 9.014 -0.101 -1.790 1.00 . A A . 17 PRO HD2 1 1 18 8999 1 1 17 PRO HD3 H 9.869 -0.494 -0.284 1.00 . A A . 17 PRO HD3 1 1 18 9000 1 1 17 PRO HG2 H 9.407 2.139 -1.567 1.00 . A A . 17 PRO HG2 1 1 18 9001 1 1 17 PRO HG3 H 10.721 1.612 -0.503 1.00 . A A . 17 PRO HG3 1 1 18 9002 1 1 17 PRO N N 7.895 0.177 -0.022 1.00 . A A . 17 PRO N 1 1 18 9003 1 1 17 PRO O O 6.780 2.875 -1.153 1.00 . A A . 17 PRO O 1 1 18 9004 1 1 18 CYS C C 4.404 4.440 -0.177 1.00 . A A . 18 CYS C 1 1 18 9005 1 1 18 CYS CA C 4.200 2.928 -0.350 1.00 . A A . 18 CYS CA 1 1 18 9006 1 1 18 CYS CB C 2.908 2.472 0.340 1.00 . A A . 18 CYS CB 1 1 18 9007 1 1 18 CYS H H 5.126 1.688 1.158 1.00 . A A . 18 CYS H 1 1 18 9008 1 1 18 CYS HA H 4.173 2.668 -1.395 1.00 . A A . 18 CYS HA 1 1 18 9009 1 1 18 CYS HB2 H 3.125 1.667 1.026 1.00 . A A . 18 CYS HB2 1 1 18 9010 1 1 18 CYS HB3 H 2.475 3.300 0.882 1.00 . A A . 18 CYS HB3 1 1 18 9011 1 1 18 CYS N N 5.307 2.196 0.339 1.00 . A A . 18 CYS N 1 1 18 9012 1 1 18 CYS O O 5.325 4.874 0.493 1.00 . A A . 18 CYS O 1 1 18 9013 1 1 18 CYS SG S 1.733 1.892 -0.906 1.00 . A A . 18 CYS SG 1 1 18 9014 1 1 19 CYS C C 3.126 7.180 0.719 1.00 . A A . 19 CYS C 1 1 18 9015 1 1 19 CYS CA C 3.723 6.726 -0.619 1.00 . A A . 19 CYS CA 1 1 18 9016 1 1 19 CYS CB C 2.967 7.364 -1.796 1.00 . A A . 19 CYS CB 1 1 18 9017 1 1 19 CYS H H 2.821 4.879 -1.298 1.00 . A A . 19 CYS H 1 1 18 9018 1 1 19 CYS HA H 4.767 6.992 -0.668 1.00 . A A . 19 CYS HA 1 1 18 9019 1 1 19 CYS HB2 H 1.926 7.480 -1.532 1.00 . A A . 19 CYS HB2 1 1 18 9020 1 1 19 CYS HB3 H 3.390 8.335 -2.007 1.00 . A A . 19 CYS HB3 1 1 18 9021 1 1 19 CYS N N 3.559 5.245 -0.767 1.00 . A A . 19 CYS N 1 1 18 9022 1 1 19 CYS O O 2.350 6.468 1.331 1.00 . A A . 19 CYS O 1 1 18 9023 1 1 19 CYS SG S 3.095 6.319 -3.274 1.00 . A A . 19 CYS SG 1 1 18 9024 1 1 20 LYS C C 1.426 8.864 2.468 1.00 . A A . 20 LYS C 1 1 18 9025 1 1 20 LYS CA C 2.960 8.846 2.489 1.00 . A A . 20 LYS CA 1 1 18 9026 1 1 20 LYS CB C 3.515 10.265 2.642 1.00 . A A . 20 LYS CB 1 1 18 9027 1 1 20 LYS CD C 3.007 12.269 4.055 1.00 . A A . 20 LYS CD 1 1 18 9028 1 1 20 LYS CE C 1.590 12.546 3.538 1.00 . A A . 20 LYS CE 1 1 18 9029 1 1 20 LYS CG C 3.267 10.760 4.070 1.00 . A A . 20 LYS CG 1 1 18 9030 1 1 20 LYS H H 4.131 8.896 0.683 1.00 . A A . 20 LYS H 1 1 18 9031 1 1 20 LYS HA H 3.319 8.227 3.292 1.00 . A A . 20 LYS HA 1 1 18 9032 1 1 20 LYS HB2 H 4.577 10.261 2.439 1.00 . A A . 20 LYS HB2 1 1 18 9033 1 1 20 LYS HB3 H 3.017 10.923 1.943 1.00 . A A . 20 LYS HB3 1 1 18 9034 1 1 20 LYS HD2 H 3.109 12.661 5.058 1.00 . A A . 20 LYS HD2 1 1 18 9035 1 1 20 LYS HD3 H 3.724 12.752 3.407 1.00 . A A . 20 LYS HD3 1 1 18 9036 1 1 20 LYS HE2 H 1.618 13.281 2.747 1.00 . A A . 20 LYS HE2 1 1 18 9037 1 1 20 LYS HE3 H 1.132 11.633 3.186 1.00 . A A . 20 LYS HE3 1 1 18 9038 1 1 20 LYS HG2 H 2.408 10.252 4.484 1.00 . A A . 20 LYS HG2 1 1 18 9039 1 1 20 LYS HG3 H 4.136 10.554 4.679 1.00 . A A . 20 LYS HG3 1 1 18 9040 1 1 20 LYS HZ1 H -0.143 13.272 4.436 1.00 . A A . 20 LYS HZ1 1 1 18 9041 1 1 20 LYS HZ2 H 1.290 13.947 5.051 1.00 . A A . 20 LYS HZ2 1 1 18 9042 1 1 20 LYS HZ3 H 0.841 12.363 5.474 1.00 . A A . 20 LYS HZ3 1 1 18 9043 1 1 20 LYS N N 3.494 8.349 1.186 1.00 . A A . 20 LYS N 1 1 18 9044 1 1 20 LYS NZ N 0.838 13.071 4.713 1.00 . A A . 20 LYS NZ 1 1 18 9045 1 1 20 LYS O O 0.817 9.525 1.649 1.00 . A A . 20 LYS O 1 1 18 9046 1 1 21 GLY C C -1.213 6.765 2.857 1.00 . A A . 21 GLY C 1 1 18 9047 1 1 21 GLY CA C -0.693 8.103 3.404 1.00 . A A . 21 GLY CA 1 1 18 9048 1 1 21 GLY H H 1.317 7.613 4.013 1.00 . A A . 21 GLY H 1 1 18 9049 1 1 21 GLY HA2 H -1.024 8.226 4.426 1.00 . A A . 21 GLY HA2 1 1 18 9050 1 1 21 GLY HA3 H -1.087 8.909 2.802 1.00 . A A . 21 GLY HA3 1 1 18 9051 1 1 21 GLY N N 0.801 8.138 3.365 1.00 . A A . 21 GLY N 1 1 18 9052 1 1 21 GLY O O -2.366 6.426 3.043 1.00 . A A . 21 GLY O 1 1 18 9053 1 1 22 TYR C C -0.336 3.539 2.510 1.00 . A A . 22 TYR C 1 1 18 9054 1 1 22 TYR CA C -0.840 4.689 1.630 1.00 . A A . 22 TYR CA 1 1 18 9055 1 1 22 TYR CB C -0.225 4.599 0.229 1.00 . A A . 22 TYR CB 1 1 18 9056 1 1 22 TYR CD1 C -0.194 7.016 -0.512 1.00 . A A . 22 TYR CD1 1 1 18 9057 1 1 22 TYR CD2 C -1.755 5.492 -1.567 1.00 . A A . 22 TYR CD2 1 1 18 9058 1 1 22 TYR CE1 C -0.666 8.059 -1.314 1.00 . A A . 22 TYR CE1 1 1 18 9059 1 1 22 TYR CE2 C -2.226 6.538 -2.371 1.00 . A A . 22 TYR CE2 1 1 18 9060 1 1 22 TYR CG C -0.739 5.730 -0.636 1.00 . A A . 22 TYR CG 1 1 18 9061 1 1 22 TYR CZ C -1.682 7.820 -2.244 1.00 . A A . 22 TYR CZ 1 1 18 9062 1 1 22 TYR H H 0.544 6.286 2.043 1.00 . A A . 22 TYR H 1 1 18 9063 1 1 22 TYR HA H -1.917 4.664 1.561 1.00 . A A . 22 TYR HA 1 1 18 9064 1 1 22 TYR HB2 H 0.851 4.667 0.305 1.00 . A A . 22 TYR HB2 1 1 18 9065 1 1 22 TYR HB3 H -0.492 3.655 -0.221 1.00 . A A . 22 TYR HB3 1 1 18 9066 1 1 22 TYR HD1 H 0.589 7.203 0.206 1.00 . A A . 22 TYR HD1 1 1 18 9067 1 1 22 TYR HD2 H -2.176 4.503 -1.665 1.00 . A A . 22 TYR HD2 1 1 18 9068 1 1 22 TYR HE1 H -0.246 9.049 -1.215 1.00 . A A . 22 TYR HE1 1 1 18 9069 1 1 22 TYR HE2 H -3.012 6.355 -3.089 1.00 . A A . 22 TYR HE2 1 1 18 9070 1 1 22 TYR HH H -2.957 9.183 -2.644 1.00 . A A . 22 TYR HH 1 1 18 9071 1 1 22 TYR N N -0.381 6.000 2.184 1.00 . A A . 22 TYR N 1 1 18 9072 1 1 22 TYR O O 0.828 3.478 2.859 1.00 . A A . 22 TYR O 1 1 18 9073 1 1 22 TYR OH O -2.146 8.850 -3.036 1.00 . A A . 22 TYR OH 1 1 18 9074 1 1 23 ALA C C -0.987 0.161 2.970 1.00 . A A . 23 ALA C 1 1 18 9075 1 1 23 ALA CA C -0.792 1.479 3.724 1.00 . A A . 23 ALA CA 1 1 18 9076 1 1 23 ALA CB C -1.714 1.539 4.944 1.00 . A A . 23 ALA CB 1 1 18 9077 1 1 23 ALA H H -2.137 2.705 2.569 1.00 . A A . 23 ALA H 1 1 18 9078 1 1 23 ALA HA H 0.235 1.587 4.033 1.00 . A A . 23 ALA HA 1 1 18 9079 1 1 23 ALA HB1 H -1.336 2.268 5.646 1.00 . A A . 23 ALA HB1 1 1 18 9080 1 1 23 ALA HB2 H -1.750 0.569 5.418 1.00 . A A . 23 ALA HB2 1 1 18 9081 1 1 23 ALA HB3 H -2.709 1.823 4.631 1.00 . A A . 23 ALA HB3 1 1 18 9082 1 1 23 ALA N N -1.206 2.631 2.867 1.00 . A A . 23 ALA N 1 1 18 9083 1 1 23 ALA O O -1.895 0.022 2.171 1.00 . A A . 23 ALA O 1 1 18 9084 1 1 24 CYS C C -1.204 -3.047 3.324 1.00 . A A . 24 CYS C 1 1 18 9085 1 1 24 CYS CA C -0.285 -2.123 2.525 1.00 . A A . 24 CYS CA 1 1 18 9086 1 1 24 CYS CB C 1.130 -2.705 2.466 1.00 . A A . 24 CYS CB 1 1 18 9087 1 1 24 CYS H H 0.573 -0.676 3.876 1.00 . A A . 24 CYS H 1 1 18 9088 1 1 24 CYS HA H -0.668 -1.979 1.527 1.00 . A A . 24 CYS HA 1 1 18 9089 1 1 24 CYS HB2 H 1.748 -2.233 3.214 1.00 . A A . 24 CYS HB2 1 1 18 9090 1 1 24 CYS HB3 H 1.088 -3.769 2.650 1.00 . A A . 24 CYS HB3 1 1 18 9091 1 1 24 CYS N N -0.146 -0.810 3.223 1.00 . A A . 24 CYS N 1 1 18 9092 1 1 24 CYS O O -1.411 -2.858 4.509 1.00 . A A . 24 CYS O 1 1 18 9093 1 1 24 CYS SG S 1.837 -2.410 0.831 1.00 . A A . 24 CYS SG 1 1 18 9094 1 1 25 SER C C -2.266 -6.432 3.121 1.00 . A A . 25 SER C 1 1 18 9095 1 1 25 SER CA C -2.668 -4.979 3.398 1.00 . A A . 25 SER CA 1 1 18 9096 1 1 25 SER CB C -4.058 -4.689 2.834 1.00 . A A . 25 SER CB 1 1 18 9097 1 1 25 SER H H -1.577 -4.168 1.727 1.00 . A A . 25 SER H 1 1 18 9098 1 1 25 SER HA H -2.655 -4.782 4.455 1.00 . A A . 25 SER HA 1 1 18 9099 1 1 25 SER HB2 H -3.972 -4.354 1.813 1.00 . A A . 25 SER HB2 1 1 18 9100 1 1 25 SER HB3 H -4.654 -5.591 2.866 1.00 . A A . 25 SER HB3 1 1 18 9101 1 1 25 SER HG H -4.534 -2.831 3.167 1.00 . A A . 25 SER HG 1 1 18 9102 1 1 25 SER N N -1.758 -4.041 2.683 1.00 . A A . 25 SER N 1 1 18 9103 1 1 25 SER O O -2.300 -6.891 1.997 1.00 . A A . 25 SER O 1 1 18 9104 1 1 25 SER OG O -4.675 -3.671 3.611 1.00 . A A . 25 SER OG 1 1 18 9105 1 1 26 LYS C C -2.732 -9.425 3.605 1.00 . A A . 26 LYS C 1 1 18 9106 1 1 26 LYS CA C -1.495 -8.588 3.957 1.00 . A A . 26 LYS CA 1 1 18 9107 1 1 26 LYS CB C -0.906 -9.019 5.306 1.00 . A A . 26 LYS CB 1 1 18 9108 1 1 26 LYS CD C -1.482 -11.176 6.440 1.00 . A A . 26 LYS CD 1 1 18 9109 1 1 26 LYS CE C -1.953 -12.569 6.007 1.00 . A A . 26 LYS CE 1 1 18 9110 1 1 26 LYS CG C -0.666 -10.535 5.314 1.00 . A A . 26 LYS CG 1 1 18 9111 1 1 26 LYS H H -1.874 -6.761 5.044 1.00 . A A . 26 LYS H 1 1 18 9112 1 1 26 LYS HA H -0.751 -8.673 3.184 1.00 . A A . 26 LYS HA 1 1 18 9113 1 1 26 LYS HB2 H 0.032 -8.508 5.467 1.00 . A A . 26 LYS HB2 1 1 18 9114 1 1 26 LYS HB3 H -1.595 -8.763 6.096 1.00 . A A . 26 LYS HB3 1 1 18 9115 1 1 26 LYS HD2 H -0.868 -11.263 7.324 1.00 . A A . 26 LYS HD2 1 1 18 9116 1 1 26 LYS HD3 H -2.342 -10.559 6.658 1.00 . A A . 26 LYS HD3 1 1 18 9117 1 1 26 LYS HE2 H -2.219 -12.565 4.958 1.00 . A A . 26 LYS HE2 1 1 18 9118 1 1 26 LYS HE3 H -1.185 -13.301 6.198 1.00 . A A . 26 LYS HE3 1 1 18 9119 1 1 26 LYS HG2 H -0.969 -10.953 4.364 1.00 . A A . 26 LYS HG2 1 1 18 9120 1 1 26 LYS HG3 H 0.383 -10.732 5.475 1.00 . A A . 26 LYS HG3 1 1 18 9121 1 1 26 LYS HZ1 H -3.908 -12.181 6.612 1.00 . A A . 26 LYS HZ1 1 1 18 9122 1 1 26 LYS HZ2 H -2.902 -12.762 7.852 1.00 . A A . 26 LYS HZ2 1 1 18 9123 1 1 26 LYS HZ3 H -3.484 -13.822 6.658 1.00 . A A . 26 LYS HZ3 1 1 18 9124 1 1 26 LYS N N -1.890 -7.156 4.146 1.00 . A A . 26 LYS N 1 1 18 9125 1 1 26 LYS NZ N -3.153 -12.854 6.846 1.00 . A A . 26 LYS NZ 1 1 18 9126 1 1 26 LYS O O -2.670 -10.332 2.796 1.00 . A A . 26 LYS O 1 1 18 9127 1 1 27 THR C C -5.629 -9.530 2.517 1.00 . A A . 27 THR C 1 1 18 9128 1 1 27 THR CA C -5.110 -9.879 3.915 1.00 . A A . 27 THR CA 1 1 18 9129 1 1 27 THR CB C -6.117 -9.429 4.984 1.00 . A A . 27 THR CB 1 1 18 9130 1 1 27 THR CG2 C -7.344 -10.343 4.952 1.00 . A A . 27 THR CG2 1 1 18 9131 1 1 27 THR H H -3.873 -8.377 4.850 1.00 . A A . 27 THR H 1 1 18 9132 1 1 27 THR HA H -4.935 -10.938 3.997 1.00 . A A . 27 THR HA 1 1 18 9133 1 1 27 THR HB H -6.428 -8.413 4.781 1.00 . A A . 27 THR HB 1 1 18 9134 1 1 27 THR HG1 H -5.175 -10.384 6.399 1.00 . A A . 27 THR HG1 1 1 18 9135 1 1 27 THR HG21 H -7.072 -11.323 5.316 1.00 . A A . 27 THR HG21 1 1 18 9136 1 1 27 THR HG22 H -7.707 -10.424 3.937 1.00 . A A . 27 THR HG22 1 1 18 9137 1 1 27 THR HG23 H -8.118 -9.928 5.580 1.00 . A A . 27 THR HG23 1 1 18 9138 1 1 27 THR N N -3.854 -9.117 4.207 1.00 . A A . 27 THR N 1 1 18 9139 1 1 27 THR O O -6.098 -10.382 1.788 1.00 . A A . 27 THR O 1 1 18 9140 1 1 27 THR OG1 O -5.512 -9.493 6.271 1.00 . A A . 27 THR OG1 1 1 18 9141 1 1 28 TRP C C -4.990 -8.214 -0.271 1.00 . A A . 28 TRP C 1 1 18 9142 1 1 28 TRP CA C -6.033 -7.854 0.792 1.00 . A A . 28 TRP CA 1 1 18 9143 1 1 28 TRP CB C -6.217 -6.332 0.880 1.00 . A A . 28 TRP CB 1 1 18 9144 1 1 28 TRP CD1 C -7.972 -6.877 2.636 1.00 . A A . 28 TRP CD1 1 1 18 9145 1 1 28 TRP CD2 C -7.635 -4.665 2.400 1.00 . A A . 28 TRP CD2 1 1 18 9146 1 1 28 TRP CE2 C -8.622 -4.824 3.402 1.00 . A A . 28 TRP CE2 1 1 18 9147 1 1 28 TRP CE3 C -7.243 -3.359 2.060 1.00 . A A . 28 TRP CE3 1 1 18 9148 1 1 28 TRP CG C -7.235 -5.985 1.929 1.00 . A A . 28 TRP CG 1 1 18 9149 1 1 28 TRP CH2 C -8.795 -2.436 3.692 1.00 . A A . 28 TRP CH2 1 1 18 9150 1 1 28 TRP CZ2 C -9.198 -3.727 4.043 1.00 . A A . 28 TRP CZ2 1 1 18 9151 1 1 28 TRP CZ3 C -7.820 -2.252 2.702 1.00 . A A . 28 TRP CZ3 1 1 18 9152 1 1 28 TRP H H -5.165 -7.613 2.753 1.00 . A A . 28 TRP H 1 1 18 9153 1 1 28 TRP HA H -6.978 -8.326 0.568 1.00 . A A . 28 TRP HA 1 1 18 9154 1 1 28 TRP HB2 H -5.274 -5.873 1.132 1.00 . A A . 28 TRP HB2 1 1 18 9155 1 1 28 TRP HB3 H -6.548 -5.957 -0.075 1.00 . A A . 28 TRP HB3 1 1 18 9156 1 1 28 TRP HD1 H -7.922 -7.950 2.535 1.00 . A A . 28 TRP HD1 1 1 18 9157 1 1 28 TRP HE1 H -9.415 -6.602 4.138 1.00 . A A . 28 TRP HE1 1 1 18 9158 1 1 28 TRP HE3 H -6.492 -3.206 1.299 1.00 . A A . 28 TRP HE3 1 1 18 9159 1 1 28 TRP HH2 H -9.236 -1.583 4.182 1.00 . A A . 28 TRP HH2 1 1 18 9160 1 1 28 TRP HZ2 H -9.948 -3.875 4.805 1.00 . A A . 28 TRP HZ2 1 1 18 9161 1 1 28 TRP HZ3 H -7.512 -1.253 2.433 1.00 . A A . 28 TRP HZ3 1 1 18 9162 1 1 28 TRP N N -5.547 -8.277 2.143 1.00 . A A . 28 TRP N 1 1 18 9163 1 1 28 TRP NE1 N -8.788 -6.190 3.512 1.00 . A A . 28 TRP NE1 1 1 18 9164 1 1 28 TRP O O -5.305 -8.807 -1.286 1.00 . A A . 28 TRP O 1 1 18 9165 1 1 29 GLY C C -2.256 -6.952 -1.808 1.00 . A A . 29 GLY C 1 1 18 9166 1 1 29 GLY CA C -2.666 -8.195 -1.007 1.00 . A A . 29 GLY CA 1 1 18 9167 1 1 29 GLY H H -3.528 -7.402 0.800 1.00 . A A . 29 GLY H 1 1 18 9168 1 1 29 GLY HA2 H -1.807 -8.569 -0.468 1.00 . A A . 29 GLY HA2 1 1 18 9169 1 1 29 GLY HA3 H -3.015 -8.956 -1.689 1.00 . A A . 29 GLY HA3 1 1 18 9170 1 1 29 GLY N N -3.750 -7.870 -0.033 1.00 . A A . 29 GLY N 1 1 18 9171 1 1 29 GLY O O -1.635 -7.067 -2.849 1.00 . A A . 29 GLY O 1 1 18 9172 1 1 30 TRP C C -1.982 -3.342 -1.162 1.00 . A A . 30 TRP C 1 1 18 9173 1 1 30 TRP CA C -2.185 -4.538 -2.105 1.00 . A A . 30 TRP CA 1 1 18 9174 1 1 30 TRP CB C -3.328 -4.287 -3.107 1.00 . A A . 30 TRP CB 1 1 18 9175 1 1 30 TRP CD1 C -4.661 -2.523 -1.872 1.00 . A A . 30 TRP CD1 1 1 18 9176 1 1 30 TRP CD2 C -5.825 -4.422 -2.186 1.00 . A A . 30 TRP CD2 1 1 18 9177 1 1 30 TRP CE2 C -6.674 -3.532 -1.488 1.00 . A A . 30 TRP CE2 1 1 18 9178 1 1 30 TRP CE3 C -6.323 -5.696 -2.513 1.00 . A A . 30 TRP CE3 1 1 18 9179 1 1 30 TRP CG C -4.546 -3.758 -2.410 1.00 . A A . 30 TRP CG 1 1 18 9180 1 1 30 TRP CH2 C -8.453 -5.162 -1.458 1.00 . A A . 30 TRP CH2 1 1 18 9181 1 1 30 TRP CZ2 C -7.973 -3.893 -1.125 1.00 . A A . 30 TRP CZ2 1 1 18 9182 1 1 30 TRP CZ3 C -7.629 -6.062 -2.151 1.00 . A A . 30 TRP CZ3 1 1 18 9183 1 1 30 TRP H H -3.075 -5.681 -0.499 1.00 . A A . 30 TRP H 1 1 18 9184 1 1 30 TRP HA H -1.270 -4.726 -2.646 1.00 . A A . 30 TRP HA 1 1 18 9185 1 1 30 TRP HB2 H -3.005 -3.569 -3.846 1.00 . A A . 30 TRP HB2 1 1 18 9186 1 1 30 TRP HB3 H -3.576 -5.215 -3.603 1.00 . A A . 30 TRP HB3 1 1 18 9187 1 1 30 TRP HD1 H -3.893 -1.766 -1.868 1.00 . A A . 30 TRP HD1 1 1 18 9188 1 1 30 TRP HE1 H -6.249 -1.593 -0.860 1.00 . A A . 30 TRP HE1 1 1 18 9189 1 1 30 TRP HE3 H -5.697 -6.396 -3.046 1.00 . A A . 30 TRP HE3 1 1 18 9190 1 1 30 TRP HH2 H -9.456 -5.449 -1.182 1.00 . A A . 30 TRP HH2 1 1 18 9191 1 1 30 TRP HZ2 H -8.602 -3.198 -0.591 1.00 . A A . 30 TRP HZ2 1 1 18 9192 1 1 30 TRP HZ3 H -8.003 -7.042 -2.408 1.00 . A A . 30 TRP HZ3 1 1 18 9193 1 1 30 TRP N N -2.581 -5.765 -1.344 1.00 . A A . 30 TRP N 1 1 18 9194 1 1 30 TRP NE1 N -5.917 -2.391 -1.318 1.00 . A A . 30 TRP NE1 1 1 18 9195 1 1 30 TRP O O -2.128 -3.453 0.040 1.00 . A A . 30 TRP O 1 1 18 9196 1 1 31 CYS C C -2.333 0.157 -1.351 1.00 . A A . 31 CYS C 1 1 18 9197 1 1 31 CYS CA C -1.427 -0.981 -0.876 1.00 . A A . 31 CYS CA 1 1 18 9198 1 1 31 CYS CB C 0.039 -0.602 -1.085 1.00 . A A . 31 CYS CB 1 1 18 9199 1 1 31 CYS H H -1.543 -2.145 -2.684 1.00 . A A . 31 CYS H 1 1 18 9200 1 1 31 CYS HA H -1.608 -1.199 0.165 1.00 . A A . 31 CYS HA 1 1 18 9201 1 1 31 CYS HB2 H 0.662 -1.472 -0.955 1.00 . A A . 31 CYS HB2 1 1 18 9202 1 1 31 CYS HB3 H 0.173 -0.210 -2.082 1.00 . A A . 31 CYS HB3 1 1 18 9203 1 1 31 CYS N N -1.647 -2.200 -1.712 1.00 . A A . 31 CYS N 1 1 18 9204 1 1 31 CYS O O -2.380 0.477 -2.526 1.00 . A A . 31 CYS O 1 1 18 9205 1 1 31 CYS SG S 0.508 0.661 0.121 1.00 . A A . 31 CYS SG 1 1 18 9206 1 1 32 ALA C C -4.029 2.918 0.329 1.00 . A A . 32 ALA C 1 1 18 9207 1 1 32 ALA CA C -3.945 1.902 -0.818 1.00 . A A . 32 ALA CA 1 1 18 9208 1 1 32 ALA CB C -5.307 1.254 -1.077 1.00 . A A . 32 ALA CB 1 1 18 9209 1 1 32 ALA H H -2.975 0.493 0.499 1.00 . A A . 32 ALA H 1 1 18 9210 1 1 32 ALA HA H -3.589 2.382 -1.716 1.00 . A A . 32 ALA HA 1 1 18 9211 1 1 32 ALA HB1 H -5.593 0.663 -0.220 1.00 . A A . 32 ALA HB1 1 1 18 9212 1 1 32 ALA HB2 H -5.244 0.620 -1.948 1.00 . A A . 32 ALA HB2 1 1 18 9213 1 1 32 ALA HB3 H -6.045 2.025 -1.245 1.00 . A A . 32 ALA HB3 1 1 18 9214 1 1 32 ALA N N -3.042 0.773 -0.440 1.00 . A A . 32 ALA N 1 1 18 9215 1 1 32 ALA O O -3.566 2.665 1.425 1.00 . A A . 32 ALA O 1 1 18 9216 1 1 33 VAL C C -5.522 4.563 2.349 1.00 . A A . 33 VAL C 1 1 18 9217 1 1 33 VAL CA C -4.725 5.108 1.156 1.00 . A A . 33 VAL CA 1 1 18 9218 1 1 33 VAL CB C -5.463 6.289 0.511 1.00 . A A . 33 VAL CB 1 1 18 9219 1 1 33 VAL CG1 C -5.623 7.417 1.532 1.00 . A A . 33 VAL CG1 1 1 18 9220 1 1 33 VAL CG2 C -4.660 6.815 -0.680 1.00 . A A . 33 VAL CG2 1 1 18 9221 1 1 33 VAL H H -4.975 4.245 -0.812 1.00 . A A . 33 VAL H 1 1 18 9222 1 1 33 VAL HA H -3.743 5.420 1.475 1.00 . A A . 33 VAL HA 1 1 18 9223 1 1 33 VAL HB H -6.438 5.965 0.176 1.00 . A A . 33 VAL HB 1 1 18 9224 1 1 33 VAL HG11 H -5.900 8.328 1.022 1.00 . A A . 33 VAL HG11 1 1 18 9225 1 1 33 VAL HG12 H -4.690 7.566 2.055 1.00 . A A . 33 VAL HG12 1 1 18 9226 1 1 33 VAL HG13 H -6.394 7.155 2.242 1.00 . A A . 33 VAL HG13 1 1 18 9227 1 1 33 VAL HG21 H -3.718 7.214 -0.330 1.00 . A A . 33 VAL HG21 1 1 18 9228 1 1 33 VAL HG22 H -5.219 7.595 -1.175 1.00 . A A . 33 VAL HG22 1 1 18 9229 1 1 33 VAL HG23 H -4.474 6.011 -1.374 1.00 . A A . 33 VAL HG23 1 1 18 9230 1 1 33 VAL N N -4.613 4.067 0.081 1.00 . A A . 33 VAL N 1 1 18 9231 1 1 33 VAL O O -6.305 3.641 2.215 1.00 . A A . 33 VAL O 1 1 18 9232 1 1 34 GLU C C -7.340 5.490 4.950 1.00 . A A . 34 GLU C 1 1 18 9233 1 1 34 GLU CA C -6.072 4.650 4.719 1.00 . A A . 34 GLU CA 1 1 18 9234 1 1 34 GLU CB C -5.091 4.813 5.886 1.00 . A A . 34 GLU CB 1 1 18 9235 1 1 34 GLU CD C -5.527 2.491 6.723 1.00 . A A . 34 GLU CD 1 1 18 9236 1 1 34 GLU CG C -4.452 3.459 6.216 1.00 . A A . 34 GLU CG 1 1 18 9237 1 1 34 GLU H H -4.694 5.876 3.596 1.00 . A A . 34 GLU H 1 1 18 9238 1 1 34 GLU HA H -6.331 3.611 4.603 1.00 . A A . 34 GLU HA 1 1 18 9239 1 1 34 GLU HB2 H -4.319 5.518 5.611 1.00 . A A . 34 GLU HB2 1 1 18 9240 1 1 34 GLU HB3 H -5.618 5.180 6.753 1.00 . A A . 34 GLU HB3 1 1 18 9241 1 1 34 GLU HG2 H -3.993 3.052 5.327 1.00 . A A . 34 GLU HG2 1 1 18 9242 1 1 34 GLU HG3 H -3.702 3.590 6.981 1.00 . A A . 34 GLU HG3 1 1 18 9243 1 1 34 GLU N N -5.328 5.132 3.515 1.00 . A A . 34 GLU N 1 1 18 9244 1 1 34 GLU O O -7.748 5.712 6.075 1.00 . A A . 34 GLU O 1 1 18 9245 1 1 34 GLU OE1 O -5.905 2.610 7.877 1.00 . A A . 34 GLU OE1 1 1 18 9246 1 1 34 GLU OE2 O -5.951 1.649 5.948 1.00 . A A . 34 GLU OE2 1 1 18 9247 1 1 35 ALA C C -10.384 5.868 4.520 1.00 . A A . 35 ALA C 1 1 18 9248 1 1 35 ALA CA C -9.218 6.757 4.053 1.00 . A A . 35 ALA CA 1 1 18 9249 1 1 35 ALA CB C -9.501 7.348 2.669 1.00 . A A . 35 ALA CB 1 1 18 9250 1 1 35 ALA H H -7.633 5.748 2.997 1.00 . A A . 35 ALA H 1 1 18 9251 1 1 35 ALA HA H -9.052 7.552 4.762 1.00 . A A . 35 ALA HA 1 1 18 9252 1 1 35 ALA HB1 H -10.254 6.758 2.169 1.00 . A A . 35 ALA HB1 1 1 18 9253 1 1 35 ALA HB2 H -8.594 7.344 2.082 1.00 . A A . 35 ALA HB2 1 1 18 9254 1 1 35 ALA HB3 H -9.855 8.363 2.778 1.00 . A A . 35 ALA HB3 1 1 18 9255 1 1 35 ALA N N -7.972 5.945 3.894 1.00 . A A . 35 ALA N 1 1 18 9256 1 1 35 ALA O O -11.044 6.192 5.489 1.00 . A A . 35 ALA O 1 1 18 9257 1 1 36 PRO C C -11.340 3.051 5.469 1.00 . A A . 36 PRO C 1 1 18 9258 1 1 36 PRO CA C -11.706 3.844 4.204 1.00 . A A . 36 PRO CA 1 1 18 9259 1 1 36 PRO CB C -11.834 2.918 2.997 1.00 . A A . 36 PRO CB 1 1 18 9260 1 1 36 PRO CD C -9.873 4.286 2.642 1.00 . A A . 36 PRO CD 1 1 18 9261 1 1 36 PRO CG C -10.492 2.947 2.338 1.00 . A A . 36 PRO CG 1 1 18 9262 1 1 36 PRO HA H -12.625 4.388 4.349 1.00 . A A . 36 PRO HA 1 1 18 9263 1 1 36 PRO HB2 H -12.077 1.915 3.321 1.00 . A A . 36 PRO HB2 1 1 18 9264 1 1 36 PRO HB3 H -12.586 3.288 2.318 1.00 . A A . 36 PRO HB3 1 1 18 9265 1 1 36 PRO HD2 H -8.821 4.169 2.863 1.00 . A A . 36 PRO HD2 1 1 18 9266 1 1 36 PRO HD3 H -10.014 4.965 1.815 1.00 . A A . 36 PRO HD3 1 1 18 9267 1 1 36 PRO HG2 H -9.872 2.155 2.734 1.00 . A A . 36 PRO HG2 1 1 18 9268 1 1 36 PRO HG3 H -10.603 2.831 1.271 1.00 . A A . 36 PRO HG3 1 1 18 9269 1 1 36 PRO N N -10.606 4.768 3.824 1.00 . A A . 36 PRO N 1 1 18 9270 1 1 36 PRO O O -10.177 2.701 5.618 1.00 . A A . 36 PRO O 1 1 19 9271 1 1 1 ASP C C 13.423 4.811 0.347 1.00 . A A . 1 ASP C 1 1 19 9272 1 1 1 ASP CA C 14.517 3.791 -0.001 1.00 . A A . 1 ASP CA 1 1 19 9273 1 1 1 ASP CB C 13.898 2.409 -0.295 1.00 . A A . 1 ASP CB 1 1 19 9274 1 1 1 ASP CG C 13.198 1.848 0.951 1.00 . A A . 1 ASP CG 1 1 19 9275 1 1 1 ASP H1 H 15.924 2.685 1.086 1.00 . A A . 1 ASP H1 1 1 19 9276 1 1 1 ASP H2 H 14.898 3.637 2.048 1.00 . A A . 1 ASP H2 1 1 19 9277 1 1 1 ASP H3 H 16.151 4.363 1.163 1.00 . A A . 1 ASP H3 1 1 19 9278 1 1 1 ASP HA H 15.076 4.125 -0.862 1.00 . A A . 1 ASP HA 1 1 19 9279 1 1 1 ASP HB2 H 13.173 2.511 -1.092 1.00 . A A . 1 ASP HB2 1 1 19 9280 1 1 1 ASP HB3 H 14.676 1.727 -0.607 1.00 . A A . 1 ASP HB3 1 1 19 9281 1 1 1 ASP N N 15.442 3.602 1.162 1.00 . A A . 1 ASP N 1 1 19 9282 1 1 1 ASP O O 12.791 4.729 1.385 1.00 . A A . 1 ASP O 1 1 19 9283 1 1 1 ASP OD1 O 13.888 1.351 1.826 1.00 . A A . 1 ASP OD1 1 1 19 9284 1 1 1 ASP OD2 O 11.981 1.915 1.000 1.00 . A A . 1 ASP OD2 1 1 19 9285 1 1 2 GLY C C 11.303 7.012 -1.506 1.00 . A A . 2 GLY C 1 1 19 9286 1 1 2 GLY CA C 12.149 6.805 -0.247 1.00 . A A . 2 GLY CA 1 1 19 9287 1 1 2 GLY H H 13.724 5.815 -1.341 1.00 . A A . 2 GLY H 1 1 19 9288 1 1 2 GLY HA2 H 11.516 6.474 0.563 1.00 . A A . 2 GLY HA2 1 1 19 9289 1 1 2 GLY HA3 H 12.621 7.739 0.021 1.00 . A A . 2 GLY HA3 1 1 19 9290 1 1 2 GLY N N 13.199 5.772 -0.514 1.00 . A A . 2 GLY N 1 1 19 9291 1 1 2 GLY O O 11.375 8.041 -2.151 1.00 . A A . 2 GLY O 1 1 19 9292 1 1 3 GLU C C 8.159 6.026 -2.696 1.00 . A A . 3 GLU C 1 1 19 9293 1 1 3 GLU CA C 9.641 6.162 -3.073 1.00 . A A . 3 GLU CA 1 1 19 9294 1 1 3 GLU CB C 10.076 5.005 -3.980 1.00 . A A . 3 GLU CB 1 1 19 9295 1 1 3 GLU CD C 9.021 5.468 -6.205 1.00 . A A . 3 GLU CD 1 1 19 9296 1 1 3 GLU CG C 10.323 5.527 -5.400 1.00 . A A . 3 GLU CG 1 1 19 9297 1 1 3 GLU H H 10.461 5.219 -1.317 1.00 . A A . 3 GLU H 1 1 19 9298 1 1 3 GLU HA H 9.819 7.100 -3.564 1.00 . A A . 3 GLU HA 1 1 19 9299 1 1 3 GLU HB2 H 10.987 4.570 -3.595 1.00 . A A . 3 GLU HB2 1 1 19 9300 1 1 3 GLU HB3 H 9.301 4.254 -4.006 1.00 . A A . 3 GLU HB3 1 1 19 9301 1 1 3 GLU HG2 H 10.671 6.550 -5.353 1.00 . A A . 3 GLU HG2 1 1 19 9302 1 1 3 GLU HG3 H 11.068 4.916 -5.883 1.00 . A A . 3 GLU HG3 1 1 19 9303 1 1 3 GLU N N 10.499 6.037 -1.856 1.00 . A A . 3 GLU N 1 1 19 9304 1 1 3 GLU O O 7.827 5.642 -1.594 1.00 . A A . 3 GLU O 1 1 19 9305 1 1 3 GLU OE1 O 8.617 4.373 -6.564 1.00 . A A . 3 GLU OE1 1 1 19 9306 1 1 3 GLU OE2 O 8.450 6.519 -6.449 1.00 . A A . 3 GLU OE2 1 1 19 9307 1 1 4 CYS C C 5.135 5.301 -4.337 1.00 . A A . 4 CYS C 1 1 19 9308 1 1 4 CYS CA C 5.807 6.217 -3.307 1.00 . A A . 4 CYS CA 1 1 19 9309 1 1 4 CYS CB C 5.259 7.654 -3.376 1.00 . A A . 4 CYS CB 1 1 19 9310 1 1 4 CYS H H 7.561 6.643 -4.491 1.00 . A A . 4 CYS H 1 1 19 9311 1 1 4 CYS HA H 5.666 5.822 -2.313 1.00 . A A . 4 CYS HA 1 1 19 9312 1 1 4 CYS HB2 H 4.905 7.945 -2.400 1.00 . A A . 4 CYS HB2 1 1 19 9313 1 1 4 CYS HB3 H 6.051 8.322 -3.679 1.00 . A A . 4 CYS HB3 1 1 19 9314 1 1 4 CYS N N 7.269 6.336 -3.607 1.00 . A A . 4 CYS N 1 1 19 9315 1 1 4 CYS O O 5.618 5.134 -5.444 1.00 . A A . 4 CYS O 1 1 19 9316 1 1 4 CYS SG S 3.889 7.775 -4.561 1.00 . A A . 4 CYS SG 1 1 19 9317 1 1 5 GLY C C 2.225 4.578 -5.656 1.00 . A A . 5 GLY C 1 1 19 9318 1 1 5 GLY CA C 3.315 3.798 -4.918 1.00 . A A . 5 GLY CA 1 1 19 9319 1 1 5 GLY H H 3.665 4.858 -3.082 1.00 . A A . 5 GLY H 1 1 19 9320 1 1 5 GLY HA2 H 4.018 3.395 -5.631 1.00 . A A . 5 GLY HA2 1 1 19 9321 1 1 5 GLY HA3 H 2.861 2.991 -4.362 1.00 . A A . 5 GLY HA3 1 1 19 9322 1 1 5 GLY N N 4.029 4.706 -3.977 1.00 . A A . 5 GLY N 1 1 19 9323 1 1 5 GLY O O 2.496 5.551 -6.335 1.00 . A A . 5 GLY O 1 1 19 9324 1 1 6 GLY C C -1.372 4.821 -5.316 1.00 . A A . 6 GLY C 1 1 19 9325 1 1 6 GLY CA C -0.126 4.866 -6.208 1.00 . A A . 6 GLY CA 1 1 19 9326 1 1 6 GLY H H 0.805 3.371 -4.969 1.00 . A A . 6 GLY H 1 1 19 9327 1 1 6 GLY HA2 H 0.156 5.895 -6.387 1.00 . A A . 6 GLY HA2 1 1 19 9328 1 1 6 GLY HA3 H -0.339 4.382 -7.147 1.00 . A A . 6 GLY HA3 1 1 19 9329 1 1 6 GLY N N 0.993 4.157 -5.524 1.00 . A A . 6 GLY N 1 1 19 9330 1 1 6 GLY O O -1.273 4.784 -4.104 1.00 . A A . 6 GLY O 1 1 19 9331 1 1 7 PHE C C -4.200 3.303 -4.799 1.00 . A A . 7 PHE C 1 1 19 9332 1 1 7 PHE CA C -3.797 4.762 -5.085 1.00 . A A . 7 PHE CA 1 1 19 9333 1 1 7 PHE CB C -4.861 5.498 -5.927 1.00 . A A . 7 PHE CB 1 1 19 9334 1 1 7 PHE CD1 C -5.185 3.979 -7.921 1.00 . A A . 7 PHE CD1 1 1 19 9335 1 1 7 PHE CD2 C -6.963 4.146 -6.279 1.00 . A A . 7 PHE CD2 1 1 19 9336 1 1 7 PHE CE1 C -5.955 3.072 -8.660 1.00 . A A . 7 PHE CE1 1 1 19 9337 1 1 7 PHE CE2 C -7.731 3.239 -7.018 1.00 . A A . 7 PHE CE2 1 1 19 9338 1 1 7 PHE CG C -5.689 4.515 -6.730 1.00 . A A . 7 PHE CG 1 1 19 9339 1 1 7 PHE CZ C -7.227 2.702 -8.208 1.00 . A A . 7 PHE CZ 1 1 19 9340 1 1 7 PHE H H -2.598 4.838 -6.884 1.00 . A A . 7 PHE H 1 1 19 9341 1 1 7 PHE HA H -3.648 5.287 -4.154 1.00 . A A . 7 PHE HA 1 1 19 9342 1 1 7 PHE HB2 H -5.511 6.054 -5.268 1.00 . A A . 7 PHE HB2 1 1 19 9343 1 1 7 PHE HB3 H -4.368 6.183 -6.601 1.00 . A A . 7 PHE HB3 1 1 19 9344 1 1 7 PHE HD1 H -4.204 4.264 -8.270 1.00 . A A . 7 PHE HD1 1 1 19 9345 1 1 7 PHE HD2 H -7.351 4.560 -5.360 1.00 . A A . 7 PHE HD2 1 1 19 9346 1 1 7 PHE HE1 H -5.565 2.659 -9.578 1.00 . A A . 7 PHE HE1 1 1 19 9347 1 1 7 PHE HE2 H -8.713 2.953 -6.669 1.00 . A A . 7 PHE HE2 1 1 19 9348 1 1 7 PHE HZ H -7.820 2.002 -8.777 1.00 . A A . 7 PHE HZ 1 1 19 9349 1 1 7 PHE N N -2.543 4.814 -5.904 1.00 . A A . 7 PHE N 1 1 19 9350 1 1 7 PHE O O -4.984 3.039 -3.908 1.00 . A A . 7 PHE O 1 1 19 9351 1 1 8 TRP C C -2.944 0.013 -5.924 1.00 . A A . 8 TRP C 1 1 19 9352 1 1 8 TRP CA C -4.017 0.923 -5.309 1.00 . A A . 8 TRP CA 1 1 19 9353 1 1 8 TRP CB C -5.367 0.720 -6.003 1.00 . A A . 8 TRP CB 1 1 19 9354 1 1 8 TRP CD1 C -5.855 -1.684 -5.384 1.00 . A A . 8 TRP CD1 1 1 19 9355 1 1 8 TRP CD2 C -7.274 -0.231 -4.416 1.00 . A A . 8 TRP CD2 1 1 19 9356 1 1 8 TRP CE2 C -7.658 -1.522 -3.986 1.00 . A A . 8 TRP CE2 1 1 19 9357 1 1 8 TRP CE3 C -8.011 0.871 -3.947 1.00 . A A . 8 TRP CE3 1 1 19 9358 1 1 8 TRP CG C -6.128 -0.359 -5.302 1.00 . A A . 8 TRP CG 1 1 19 9359 1 1 8 TRP CH2 C -9.458 -0.607 -2.665 1.00 . A A . 8 TRP CH2 1 1 19 9360 1 1 8 TRP CZ2 C -8.736 -1.714 -3.122 1.00 . A A . 8 TRP CZ2 1 1 19 9361 1 1 8 TRP CZ3 C -9.095 0.682 -3.077 1.00 . A A . 8 TRP CZ3 1 1 19 9362 1 1 8 TRP H H -3.038 2.593 -6.255 1.00 . A A . 8 TRP H 1 1 19 9363 1 1 8 TRP HA H -4.113 0.728 -4.252 1.00 . A A . 8 TRP HA 1 1 19 9364 1 1 8 TRP HB2 H -5.931 1.640 -5.965 1.00 . A A . 8 TRP HB2 1 1 19 9365 1 1 8 TRP HB3 H -5.207 0.439 -7.033 1.00 . A A . 8 TRP HB3 1 1 19 9366 1 1 8 TRP HD1 H -5.059 -2.128 -5.963 1.00 . A A . 8 TRP HD1 1 1 19 9367 1 1 8 TRP HE1 H -6.785 -3.348 -4.488 1.00 . A A . 8 TRP HE1 1 1 19 9368 1 1 8 TRP HE3 H -7.739 1.869 -4.259 1.00 . A A . 8 TRP HE3 1 1 19 9369 1 1 8 TRP HH2 H -10.294 -0.746 -1.996 1.00 . A A . 8 TRP HH2 1 1 19 9370 1 1 8 TRP HZ2 H -9.012 -2.710 -2.808 1.00 . A A . 8 TRP HZ2 1 1 19 9371 1 1 8 TRP HZ3 H -9.655 1.537 -2.723 1.00 . A A . 8 TRP HZ3 1 1 19 9372 1 1 8 TRP N N -3.668 2.359 -5.543 1.00 . A A . 8 TRP N 1 1 19 9373 1 1 8 TRP NE1 N -6.763 -2.373 -4.602 1.00 . A A . 8 TRP NE1 1 1 19 9374 1 1 8 TRP O O -3.187 -0.687 -6.890 1.00 . A A . 8 TRP O 1 1 19 9375 1 1 9 TRP C C -0.564 -2.139 -5.124 1.00 . A A . 9 TRP C 1 1 19 9376 1 1 9 TRP CA C -0.661 -0.834 -5.922 1.00 . A A . 9 TRP CA 1 1 19 9377 1 1 9 TRP CB C 0.614 0.002 -5.767 1.00 . A A . 9 TRP CB 1 1 19 9378 1 1 9 TRP CD1 C -0.435 1.619 -7.423 1.00 . A A . 9 TRP CD1 1 1 19 9379 1 1 9 TRP CD2 C 1.811 1.735 -7.400 1.00 . A A . 9 TRP CD2 1 1 19 9380 1 1 9 TRP CE2 C 1.362 2.681 -8.350 1.00 . A A . 9 TRP CE2 1 1 19 9381 1 1 9 TRP CE3 C 3.196 1.611 -7.196 1.00 . A A . 9 TRP CE3 1 1 19 9382 1 1 9 TRP CG C 0.651 1.072 -6.820 1.00 . A A . 9 TRP CG 1 1 19 9383 1 1 9 TRP CH2 C 3.624 3.341 -8.854 1.00 . A A . 9 TRP CH2 1 1 19 9384 1 1 9 TRP CZ2 C 2.252 3.476 -9.071 1.00 . A A . 9 TRP CZ2 1 1 19 9385 1 1 9 TRP CZ3 C 4.096 2.410 -7.920 1.00 . A A . 9 TRP CZ3 1 1 19 9386 1 1 9 TRP H H -1.585 0.599 -4.596 1.00 . A A . 9 TRP H 1 1 19 9387 1 1 9 TRP HA H -0.837 -1.046 -6.965 1.00 . A A . 9 TRP HA 1 1 19 9388 1 1 9 TRP HB2 H 0.624 0.463 -4.790 1.00 . A A . 9 TRP HB2 1 1 19 9389 1 1 9 TRP HB3 H 1.480 -0.635 -5.873 1.00 . A A . 9 TRP HB3 1 1 19 9390 1 1 9 TRP HD1 H -1.461 1.353 -7.227 1.00 . A A . 9 TRP HD1 1 1 19 9391 1 1 9 TRP HE1 H -0.600 3.112 -8.892 1.00 . A A . 9 TRP HE1 1 1 19 9392 1 1 9 TRP HE3 H 3.571 0.895 -6.477 1.00 . A A . 9 TRP HE3 1 1 19 9393 1 1 9 TRP HH2 H 4.320 3.953 -9.408 1.00 . A A . 9 TRP HH2 1 1 19 9394 1 1 9 TRP HZ2 H 1.882 4.194 -9.788 1.00 . A A . 9 TRP HZ2 1 1 19 9395 1 1 9 TRP HZ3 H 5.156 2.309 -7.753 1.00 . A A . 9 TRP HZ3 1 1 19 9396 1 1 9 TRP N N -1.758 0.025 -5.372 1.00 . A A . 9 TRP N 1 1 19 9397 1 1 9 TRP NE1 N -0.012 2.570 -8.329 1.00 . A A . 9 TRP NE1 1 1 19 9398 1 1 9 TRP O O -1.240 -2.313 -4.133 1.00 . A A . 9 TRP O 1 1 19 9399 1 1 10 LYS C C 1.543 -4.314 -3.819 1.00 . A A . 10 LYS C 1 1 19 9400 1 1 10 LYS CA C 0.383 -4.358 -4.812 1.00 . A A . 10 LYS CA 1 1 19 9401 1 1 10 LYS CB C 0.654 -5.414 -5.880 1.00 . A A . 10 LYS CB 1 1 19 9402 1 1 10 LYS CD C -0.749 -6.146 -7.821 1.00 . A A . 10 LYS CD 1 1 19 9403 1 1 10 LYS CE C -0.605 -7.602 -8.280 1.00 . A A . 10 LYS CE 1 1 19 9404 1 1 10 LYS CG C -0.665 -6.071 -6.293 1.00 . A A . 10 LYS CG 1 1 19 9405 1 1 10 LYS H H 0.795 -2.906 -6.360 1.00 . A A . 10 LYS H 1 1 19 9406 1 1 10 LYS HA H -0.539 -4.585 -4.300 1.00 . A A . 10 LYS HA 1 1 19 9407 1 1 10 LYS HB2 H 1.116 -4.947 -6.737 1.00 . A A . 10 LYS HB2 1 1 19 9408 1 1 10 LYS HB3 H 1.318 -6.166 -5.477 1.00 . A A . 10 LYS HB3 1 1 19 9409 1 1 10 LYS HD2 H -1.704 -5.759 -8.147 1.00 . A A . 10 LYS HD2 1 1 19 9410 1 1 10 LYS HD3 H 0.044 -5.553 -8.255 1.00 . A A . 10 LYS HD3 1 1 19 9411 1 1 10 LYS HE2 H -1.146 -8.259 -7.614 1.00 . A A . 10 LYS HE2 1 1 19 9412 1 1 10 LYS HE3 H -0.963 -7.713 -9.291 1.00 . A A . 10 LYS HE3 1 1 19 9413 1 1 10 LYS HG2 H -0.714 -7.067 -5.879 1.00 . A A . 10 LYS HG2 1 1 19 9414 1 1 10 LYS HG3 H -1.490 -5.484 -5.918 1.00 . A A . 10 LYS HG3 1 1 19 9415 1 1 10 LYS HZ1 H 1.178 -7.877 -7.233 1.00 . A A . 10 LYS HZ1 1 1 19 9416 1 1 10 LYS HZ2 H 1.378 -7.174 -8.767 1.00 . A A . 10 LYS HZ2 1 1 19 9417 1 1 10 LYS HZ3 H 1.041 -8.832 -8.628 1.00 . A A . 10 LYS HZ3 1 1 19 9418 1 1 10 LYS N N 0.262 -3.061 -5.552 1.00 . A A . 10 LYS N 1 1 19 9419 1 1 10 LYS NZ N 0.858 -7.892 -8.223 1.00 . A A . 10 LYS NZ 1 1 19 9420 1 1 10 LYS O O 2.640 -3.903 -4.149 1.00 . A A . 10 LYS O 1 1 19 9421 1 1 11 CYS C C 2.186 -5.895 -0.581 1.00 . A A . 11 CYS C 1 1 19 9422 1 1 11 CYS CA C 2.401 -4.759 -1.594 1.00 . A A . 11 CYS CA 1 1 19 9423 1 1 11 CYS CB C 2.325 -3.390 -0.907 1.00 . A A . 11 CYS CB 1 1 19 9424 1 1 11 CYS H H 0.423 -5.091 -2.373 1.00 . A A . 11 CYS H 1 1 19 9425 1 1 11 CYS HA H 3.354 -4.871 -2.087 1.00 . A A . 11 CYS HA 1 1 19 9426 1 1 11 CYS HB2 H 3.171 -3.273 -0.247 1.00 . A A . 11 CYS HB2 1 1 19 9427 1 1 11 CYS HB3 H 2.341 -2.612 -1.656 1.00 . A A . 11 CYS HB3 1 1 19 9428 1 1 11 CYS N N 1.311 -4.753 -2.609 1.00 . A A . 11 CYS N 1 1 19 9429 1 1 11 CYS O O 1.089 -6.397 -0.424 1.00 . A A . 11 CYS O 1 1 19 9430 1 1 11 CYS SG S 0.796 -3.268 0.052 1.00 . A A . 11 CYS SG 1 1 19 9431 1 1 12 GLY C C 2.836 -6.790 2.494 1.00 . A A . 12 GLY C 1 1 19 9432 1 1 12 GLY CA C 3.090 -7.399 1.112 1.00 . A A . 12 GLY CA 1 1 19 9433 1 1 12 GLY H H 4.101 -5.877 -0.037 1.00 . A A . 12 GLY H 1 1 19 9434 1 1 12 GLY HA2 H 2.264 -8.038 0.838 1.00 . A A . 12 GLY HA2 1 1 19 9435 1 1 12 GLY HA3 H 4.001 -7.977 1.140 1.00 . A A . 12 GLY HA3 1 1 19 9436 1 1 12 GLY N N 3.228 -6.300 0.106 1.00 . A A . 12 GLY N 1 1 19 9437 1 1 12 GLY O O 1.851 -6.111 2.708 1.00 . A A . 12 GLY O 1 1 19 9438 1 1 13 ARG C C 4.236 -5.069 4.878 1.00 . A A . 13 ARG C 1 1 19 9439 1 1 13 ARG CA C 3.551 -6.445 4.800 1.00 . A A . 13 ARG CA 1 1 19 9440 1 1 13 ARG CB C 4.234 -7.446 5.740 1.00 . A A . 13 ARG CB 1 1 19 9441 1 1 13 ARG CD C 2.878 -8.190 7.711 1.00 . A A . 13 ARG CD 1 1 19 9442 1 1 13 ARG CG C 3.860 -7.136 7.193 1.00 . A A . 13 ARG CG 1 1 19 9443 1 1 13 ARG CZ C 3.512 -9.103 9.872 1.00 . A A . 13 ARG CZ 1 1 19 9444 1 1 13 ARG H H 4.515 -7.565 3.227 1.00 . A A . 13 ARG H 1 1 19 9445 1 1 13 ARG HA H 2.502 -6.362 5.046 1.00 . A A . 13 ARG HA 1 1 19 9446 1 1 13 ARG HB2 H 3.913 -8.448 5.491 1.00 . A A . 13 ARG HB2 1 1 19 9447 1 1 13 ARG HB3 H 5.305 -7.374 5.623 1.00 . A A . 13 ARG HB3 1 1 19 9448 1 1 13 ARG HD2 H 1.872 -7.955 7.392 1.00 . A A . 13 ARG HD2 1 1 19 9449 1 1 13 ARG HD3 H 3.163 -9.173 7.371 1.00 . A A . 13 ARG HD3 1 1 19 9450 1 1 13 ARG HE H 2.658 -7.319 9.670 1.00 . A A . 13 ARG HE 1 1 19 9451 1 1 13 ARG HG2 H 4.754 -7.146 7.801 1.00 . A A . 13 ARG HG2 1 1 19 9452 1 1 13 ARG HG3 H 3.400 -6.161 7.247 1.00 . A A . 13 ARG HG3 1 1 19 9453 1 1 13 ARG HH11 H 5.313 -8.945 9.002 1.00 . A A . 13 ARG HH11 1 1 19 9454 1 1 13 ARG HH12 H 5.163 -10.199 10.187 1.00 . A A . 13 ARG HH12 1 1 19 9455 1 1 13 ARG HH21 H 1.839 -9.490 10.907 1.00 . A A . 13 ARG HH21 1 1 19 9456 1 1 13 ARG HH22 H 3.194 -10.508 11.268 1.00 . A A . 13 ARG HH22 1 1 19 9457 1 1 13 ARG N N 3.727 -7.020 3.429 1.00 . A A . 13 ARG N 1 1 19 9458 1 1 13 ARG NE N 2.984 -8.114 9.198 1.00 . A A . 13 ARG NE 1 1 19 9459 1 1 13 ARG NH1 N 4.760 -9.442 9.670 1.00 . A A . 13 ARG NH1 1 1 19 9460 1 1 13 ARG NH2 N 2.792 -9.750 10.751 1.00 . A A . 13 ARG NH2 1 1 19 9461 1 1 13 ARG O O 4.907 -4.749 5.843 1.00 . A A . 13 ARG O 1 1 19 9462 1 1 14 GLY C C 6.083 -2.989 3.179 1.00 . A A . 14 GLY C 1 1 19 9463 1 1 14 GLY CA C 4.712 -2.906 3.859 1.00 . A A . 14 GLY CA 1 1 19 9464 1 1 14 GLY H H 3.531 -4.534 3.095 1.00 . A A . 14 GLY H 1 1 19 9465 1 1 14 GLY HA2 H 4.082 -2.212 3.320 1.00 . A A . 14 GLY HA2 1 1 19 9466 1 1 14 GLY HA3 H 4.837 -2.565 4.875 1.00 . A A . 14 GLY HA3 1 1 19 9467 1 1 14 GLY N N 4.072 -4.255 3.862 1.00 . A A . 14 GLY N 1 1 19 9468 1 1 14 GLY O O 7.036 -2.370 3.617 1.00 . A A . 14 GLY O 1 1 19 9469 1 1 15 LYS C C 7.762 -2.603 0.558 1.00 . A A . 15 LYS C 1 1 19 9470 1 1 15 LYS CA C 7.504 -3.863 1.401 1.00 . A A . 15 LYS CA 1 1 19 9471 1 1 15 LYS CB C 7.389 -5.112 0.515 1.00 . A A . 15 LYS CB 1 1 19 9472 1 1 15 LYS CD C 7.609 -7.595 0.708 1.00 . A A . 15 LYS CD 1 1 19 9473 1 1 15 LYS CE C 8.665 -8.698 0.834 1.00 . A A . 15 LYS CE 1 1 19 9474 1 1 15 LYS CG C 8.218 -6.251 1.116 1.00 . A A . 15 LYS CG 1 1 19 9475 1 1 15 LYS H H 5.408 -4.231 1.775 1.00 . A A . 15 LYS H 1 1 19 9476 1 1 15 LYS HA H 8.295 -3.995 2.113 1.00 . A A . 15 LYS HA 1 1 19 9477 1 1 15 LYS HB2 H 6.354 -5.415 0.452 1.00 . A A . 15 LYS HB2 1 1 19 9478 1 1 15 LYS HB3 H 7.758 -4.887 -0.473 1.00 . A A . 15 LYS HB3 1 1 19 9479 1 1 15 LYS HD2 H 6.772 -7.820 1.353 1.00 . A A . 15 LYS HD2 1 1 19 9480 1 1 15 LYS HD3 H 7.270 -7.539 -0.316 1.00 . A A . 15 LYS HD3 1 1 19 9481 1 1 15 LYS HE2 H 9.188 -8.823 -0.104 1.00 . A A . 15 LYS HE2 1 1 19 9482 1 1 15 LYS HE3 H 9.360 -8.467 1.626 1.00 . A A . 15 LYS HE3 1 1 19 9483 1 1 15 LYS HG2 H 9.233 -6.188 0.750 1.00 . A A . 15 LYS HG2 1 1 19 9484 1 1 15 LYS HG3 H 8.218 -6.170 2.193 1.00 . A A . 15 LYS HG3 1 1 19 9485 1 1 15 LYS HZ1 H 7.133 -10.069 0.481 1.00 . A A . 15 LYS HZ1 1 1 19 9486 1 1 15 LYS HZ2 H 7.494 -9.840 2.126 1.00 . A A . 15 LYS HZ2 1 1 19 9487 1 1 15 LYS HZ3 H 8.535 -10.753 1.144 1.00 . A A . 15 LYS HZ3 1 1 19 9488 1 1 15 LYS N N 6.190 -3.745 2.111 1.00 . A A . 15 LYS N 1 1 19 9489 1 1 15 LYS NZ N 7.898 -9.933 1.171 1.00 . A A . 15 LYS NZ 1 1 19 9490 1 1 15 LYS O O 8.693 -1.867 0.831 1.00 . A A . 15 LYS O 1 1 19 9491 1 1 16 PRO C C 6.606 0.068 -0.528 1.00 . A A . 16 PRO C 1 1 19 9492 1 1 16 PRO CA C 7.067 -1.181 -1.295 1.00 . A A . 16 PRO CA 1 1 19 9493 1 1 16 PRO CB C 6.135 -1.469 -2.468 1.00 . A A . 16 PRO CB 1 1 19 9494 1 1 16 PRO CD C 5.782 -3.210 -0.832 1.00 . A A . 16 PRO CD 1 1 19 9495 1 1 16 PRO CG C 5.116 -2.421 -1.929 1.00 . A A . 16 PRO CG 1 1 19 9496 1 1 16 PRO HA H 8.083 -1.074 -1.639 1.00 . A A . 16 PRO HA 1 1 19 9497 1 1 16 PRO HB2 H 5.659 -0.557 -2.803 1.00 . A A . 16 PRO HB2 1 1 19 9498 1 1 16 PRO HB3 H 6.679 -1.930 -3.278 1.00 . A A . 16 PRO HB3 1 1 19 9499 1 1 16 PRO HD2 H 5.104 -3.351 -0.001 1.00 . A A . 16 PRO HD2 1 1 19 9500 1 1 16 PRO HD3 H 6.130 -4.160 -1.205 1.00 . A A . 16 PRO HD3 1 1 19 9501 1 1 16 PRO HG2 H 4.273 -1.871 -1.531 1.00 . A A . 16 PRO HG2 1 1 19 9502 1 1 16 PRO HG3 H 4.786 -3.090 -2.709 1.00 . A A . 16 PRO HG3 1 1 19 9503 1 1 16 PRO N N 6.923 -2.379 -0.430 1.00 . A A . 16 PRO N 1 1 19 9504 1 1 16 PRO O O 5.563 0.049 0.101 1.00 . A A . 16 PRO O 1 1 19 9505 1 1 17 PRO C C 5.889 3.083 -0.602 1.00 . A A . 17 PRO C 1 1 19 9506 1 1 17 PRO CA C 7.044 2.368 0.116 1.00 . A A . 17 PRO CA 1 1 19 9507 1 1 17 PRO CB C 8.327 3.192 0.046 1.00 . A A . 17 PRO CB 1 1 19 9508 1 1 17 PRO CD C 8.666 1.234 -1.327 1.00 . A A . 17 PRO CD 1 1 19 9509 1 1 17 PRO CG C 9.052 2.683 -1.160 1.00 . A A . 17 PRO CG 1 1 19 9510 1 1 17 PRO HA H 6.788 2.165 1.143 1.00 . A A . 17 PRO HA 1 1 19 9511 1 1 17 PRO HB2 H 8.094 4.241 -0.066 1.00 . A A . 17 PRO HB2 1 1 19 9512 1 1 17 PRO HB3 H 8.926 3.033 0.931 1.00 . A A . 17 PRO HB3 1 1 19 9513 1 1 17 PRO HD2 H 8.529 0.999 -2.375 1.00 . A A . 17 PRO HD2 1 1 19 9514 1 1 17 PRO HD3 H 9.412 0.589 -0.888 1.00 . A A . 17 PRO HD3 1 1 19 9515 1 1 17 PRO HG2 H 8.757 3.252 -2.033 1.00 . A A . 17 PRO HG2 1 1 19 9516 1 1 17 PRO HG3 H 10.119 2.764 -1.013 1.00 . A A . 17 PRO HG3 1 1 19 9517 1 1 17 PRO N N 7.396 1.114 -0.596 1.00 . A A . 17 PRO N 1 1 19 9518 1 1 17 PRO O O 6.046 3.583 -1.700 1.00 . A A . 17 PRO O 1 1 19 9519 1 1 18 CYS C C 3.707 5.340 -0.496 1.00 . A A . 18 CYS C 1 1 19 9520 1 1 18 CYS CA C 3.564 3.818 -0.631 1.00 . A A . 18 CYS CA 1 1 19 9521 1 1 18 CYS CB C 2.326 3.327 0.130 1.00 . A A . 18 CYS CB 1 1 19 9522 1 1 18 CYS H H 4.629 2.720 0.895 1.00 . A A . 18 CYS H 1 1 19 9523 1 1 18 CYS HA H 3.491 3.538 -1.670 1.00 . A A . 18 CYS HA 1 1 19 9524 1 1 18 CYS HB2 H 2.428 3.561 1.179 1.00 . A A . 18 CYS HB2 1 1 19 9525 1 1 18 CYS HB3 H 1.445 3.818 -0.263 1.00 . A A . 18 CYS HB3 1 1 19 9526 1 1 18 CYS N N 4.731 3.132 0.012 1.00 . A A . 18 CYS N 1 1 19 9527 1 1 18 CYS O O 4.660 5.831 0.082 1.00 . A A . 18 CYS O 1 1 19 9528 1 1 18 CYS SG S 2.150 1.540 -0.070 1.00 . A A . 18 CYS SG 1 1 19 9529 1 1 19 CYS C C 2.212 8.060 0.382 1.00 . A A . 19 CYS C 1 1 19 9530 1 1 19 CYS CA C 2.856 7.581 -0.925 1.00 . A A . 19 CYS CA 1 1 19 9531 1 1 19 CYS CB C 2.081 8.132 -2.134 1.00 . A A . 19 CYS CB 1 1 19 9532 1 1 19 CYS H H 2.014 5.670 -1.485 1.00 . A A . 19 CYS H 1 1 19 9533 1 1 19 CYS HA H 3.885 7.900 -0.973 1.00 . A A . 19 CYS HA 1 1 19 9534 1 1 19 CYS HB2 H 1.034 8.200 -1.885 1.00 . A A . 19 CYS HB2 1 1 19 9535 1 1 19 CYS HB3 H 2.453 9.118 -2.376 1.00 . A A . 19 CYS HB3 1 1 19 9536 1 1 19 CYS N N 2.770 6.088 -1.024 1.00 . A A . 19 CYS N 1 1 19 9537 1 1 19 CYS O O 1.310 7.430 0.904 1.00 . A A . 19 CYS O 1 1 19 9538 1 1 19 CYS SG S 2.286 7.043 -3.570 1.00 . A A . 19 CYS SG 1 1 19 9539 1 1 20 LYS C C 0.579 9.793 2.104 1.00 . A A . 20 LYS C 1 1 19 9540 1 1 20 LYS CA C 2.109 9.698 2.194 1.00 . A A . 20 LYS CA 1 1 19 9541 1 1 20 LYS CB C 2.726 11.092 2.365 1.00 . A A . 20 LYS CB 1 1 19 9542 1 1 20 LYS CD C 3.046 12.806 4.164 1.00 . A A . 20 LYS CD 1 1 19 9543 1 1 20 LYS CE C 4.096 13.141 5.232 1.00 . A A . 20 LYS CE 1 1 19 9544 1 1 20 LYS CG C 3.106 11.310 3.833 1.00 . A A . 20 LYS CG 1 1 19 9545 1 1 20 LYS H H 3.409 9.644 0.478 1.00 . A A . 20 LYS H 1 1 19 9546 1 1 20 LYS HA H 2.398 9.066 3.016 1.00 . A A . 20 LYS HA 1 1 19 9547 1 1 20 LYS HB2 H 3.610 11.172 1.747 1.00 . A A . 20 LYS HB2 1 1 19 9548 1 1 20 LYS HB3 H 2.007 11.841 2.065 1.00 . A A . 20 LYS HB3 1 1 19 9549 1 1 20 LYS HD2 H 3.243 13.381 3.270 1.00 . A A . 20 LYS HD2 1 1 19 9550 1 1 20 LYS HD3 H 2.064 13.051 4.541 1.00 . A A . 20 LYS HD3 1 1 19 9551 1 1 20 LYS HE2 H 3.612 13.398 6.163 1.00 . A A . 20 LYS HE2 1 1 19 9552 1 1 20 LYS HE3 H 4.767 12.309 5.373 1.00 . A A . 20 LYS HE3 1 1 19 9553 1 1 20 LYS HG2 H 2.416 10.773 4.467 1.00 . A A . 20 LYS HG2 1 1 19 9554 1 1 20 LYS HG3 H 4.107 10.945 4.002 1.00 . A A . 20 LYS HG3 1 1 19 9555 1 1 20 LYS HZ1 H 4.179 15.085 4.482 1.00 . A A . 20 LYS HZ1 1 1 19 9556 1 1 20 LYS HZ2 H 5.343 14.035 3.823 1.00 . A A . 20 LYS HZ2 1 1 19 9557 1 1 20 LYS HZ3 H 5.534 14.638 5.399 1.00 . A A . 20 LYS HZ3 1 1 19 9558 1 1 20 LYS N N 2.678 9.166 0.916 1.00 . A A . 20 LYS N 1 1 19 9559 1 1 20 LYS NZ N 4.845 14.313 4.692 1.00 . A A . 20 LYS NZ 1 1 19 9560 1 1 20 LYS O O 0.041 10.498 1.271 1.00 . A A . 20 LYS O 1 1 19 9561 1 1 21 GLY C C -2.154 7.708 2.637 1.00 . A A . 21 GLY C 1 1 19 9562 1 1 21 GLY CA C -1.613 9.113 2.922 1.00 . A A . 21 GLY CA 1 1 19 9563 1 1 21 GLY H H 0.341 8.513 3.608 1.00 . A A . 21 GLY H 1 1 19 9564 1 1 21 GLY HA2 H -1.983 9.455 3.877 1.00 . A A . 21 GLY HA2 1 1 19 9565 1 1 21 GLY HA3 H -1.944 9.786 2.145 1.00 . A A . 21 GLY HA3 1 1 19 9566 1 1 21 GLY N N -0.118 9.079 2.952 1.00 . A A . 21 GLY N 1 1 19 9567 1 1 21 GLY O O -3.181 7.315 3.161 1.00 . A A . 21 GLY O 1 1 19 9568 1 1 22 TYR C C -1.290 4.549 2.431 1.00 . A A . 22 TYR C 1 1 19 9569 1 1 22 TYR CA C -1.955 5.566 1.494 1.00 . A A . 22 TYR CA 1 1 19 9570 1 1 22 TYR CB C -1.540 5.296 0.039 1.00 . A A . 22 TYR CB 1 1 19 9571 1 1 22 TYR CD1 C -3.038 7.226 -0.644 1.00 . A A . 22 TYR CD1 1 1 19 9572 1 1 22 TYR CD2 C -0.993 6.835 -1.886 1.00 . A A . 22 TYR CD2 1 1 19 9573 1 1 22 TYR CE1 C -3.330 8.317 -1.471 1.00 . A A . 22 TYR CE1 1 1 19 9574 1 1 22 TYR CE2 C -1.286 7.926 -2.712 1.00 . A A . 22 TYR CE2 1 1 19 9575 1 1 22 TYR CG C -1.867 6.483 -0.849 1.00 . A A . 22 TYR CG 1 1 19 9576 1 1 22 TYR CZ C -2.455 8.666 -2.504 1.00 . A A . 22 TYR CZ 1 1 19 9577 1 1 22 TYR H H -0.652 7.283 1.400 1.00 . A A . 22 TYR H 1 1 19 9578 1 1 22 TYR HA H -3.029 5.512 1.586 1.00 . A A . 22 TYR HA 1 1 19 9579 1 1 22 TYR HB2 H -0.478 5.105 0.001 1.00 . A A . 22 TYR HB2 1 1 19 9580 1 1 22 TYR HB3 H -2.068 4.426 -0.323 1.00 . A A . 22 TYR HB3 1 1 19 9581 1 1 22 TYR HD1 H -3.715 6.958 0.153 1.00 . A A . 22 TYR HD1 1 1 19 9582 1 1 22 TYR HD2 H -0.091 6.265 -2.047 1.00 . A A . 22 TYR HD2 1 1 19 9583 1 1 22 TYR HE1 H -4.233 8.890 -1.310 1.00 . A A . 22 TYR HE1 1 1 19 9584 1 1 22 TYR HE2 H -0.610 8.196 -3.511 1.00 . A A . 22 TYR HE2 1 1 19 9585 1 1 22 TYR HH H -2.306 10.516 -2.949 1.00 . A A . 22 TYR HH 1 1 19 9586 1 1 22 TYR N N -1.475 6.948 1.812 1.00 . A A . 22 TYR N 1 1 19 9587 1 1 22 TYR O O -0.191 4.760 2.910 1.00 . A A . 22 TYR O 1 1 19 9588 1 1 22 TYR OH O -2.743 9.743 -3.318 1.00 . A A . 22 TYR OH 1 1 19 9589 1 1 23 ALA C C -1.367 1.045 2.888 1.00 . A A . 23 ALA C 1 1 19 9590 1 1 23 ALA CA C -1.374 2.407 3.591 1.00 . A A . 23 ALA CA 1 1 19 9591 1 1 23 ALA CB C -2.302 2.379 4.807 1.00 . A A . 23 ALA CB 1 1 19 9592 1 1 23 ALA H H -2.835 3.309 2.286 1.00 . A A . 23 ALA H 1 1 19 9593 1 1 23 ALA HA H -0.377 2.680 3.895 1.00 . A A . 23 ALA HA 1 1 19 9594 1 1 23 ALA HB1 H -1.709 2.367 5.710 1.00 . A A . 23 ALA HB1 1 1 19 9595 1 1 23 ALA HB2 H -2.919 1.493 4.769 1.00 . A A . 23 ALA HB2 1 1 19 9596 1 1 23 ALA HB3 H -2.930 3.257 4.802 1.00 . A A . 23 ALA HB3 1 1 19 9597 1 1 23 ALA N N -1.952 3.450 2.689 1.00 . A A . 23 ALA N 1 1 19 9598 1 1 23 ALA O O -2.241 0.739 2.097 1.00 . A A . 23 ALA O 1 1 19 9599 1 1 24 CYS C C -1.062 -2.154 3.355 1.00 . A A . 24 CYS C 1 1 19 9600 1 1 24 CYS CA C -0.310 -1.117 2.519 1.00 . A A . 24 CYS CA 1 1 19 9601 1 1 24 CYS CB C 1.184 -1.451 2.454 1.00 . A A . 24 CYS CB 1 1 19 9602 1 1 24 CYS H H 0.309 0.498 3.810 1.00 . A A . 24 CYS H 1 1 19 9603 1 1 24 CYS HA H -0.720 -1.071 1.523 1.00 . A A . 24 CYS HA 1 1 19 9604 1 1 24 CYS HB2 H 1.660 -0.811 1.728 1.00 . A A . 24 CYS HB2 1 1 19 9605 1 1 24 CYS HB3 H 1.628 -1.287 3.423 1.00 . A A . 24 CYS HB3 1 1 19 9606 1 1 24 CYS N N -0.383 0.227 3.170 1.00 . A A . 24 CYS N 1 1 19 9607 1 1 24 CYS O O -1.306 -1.965 4.533 1.00 . A A . 24 CYS O 1 1 19 9608 1 1 24 CYS SG S 1.418 -3.181 1.972 1.00 . A A . 24 CYS SG 1 1 19 9609 1 1 25 SER C C -1.697 -5.699 3.048 1.00 . A A . 25 SER C 1 1 19 9610 1 1 25 SER CA C -2.175 -4.309 3.481 1.00 . A A . 25 SER CA 1 1 19 9611 1 1 25 SER CB C -3.641 -4.106 3.093 1.00 . A A . 25 SER CB 1 1 19 9612 1 1 25 SER H H -1.224 -3.368 1.796 1.00 . A A . 25 SER H 1 1 19 9613 1 1 25 SER HA H -2.057 -4.187 4.541 1.00 . A A . 25 SER HA 1 1 19 9614 1 1 25 SER HB2 H -3.716 -3.945 2.031 1.00 . A A . 25 SER HB2 1 1 19 9615 1 1 25 SER HB3 H -4.210 -4.987 3.361 1.00 . A A . 25 SER HB3 1 1 19 9616 1 1 25 SER HG H -4.136 -2.225 3.169 1.00 . A A . 25 SER HG 1 1 19 9617 1 1 25 SER N N -1.433 -3.248 2.745 1.00 . A A . 25 SER N 1 1 19 9618 1 1 25 SER O O -1.855 -6.085 1.909 1.00 . A A . 25 SER O 1 1 19 9619 1 1 25 SER OG O -4.157 -2.969 3.775 1.00 . A A . 25 SER OG 1 1 19 9620 1 1 26 LYS C C -1.876 -8.751 3.442 1.00 . A A . 26 LYS C 1 1 19 9621 1 1 26 LYS CA C -0.660 -7.829 3.591 1.00 . A A . 26 LYS CA 1 1 19 9622 1 1 26 LYS CB C 0.232 -8.280 4.752 1.00 . A A . 26 LYS CB 1 1 19 9623 1 1 26 LYS CD C 2.111 -9.927 4.528 1.00 . A A . 26 LYS CD 1 1 19 9624 1 1 26 LYS CE C 2.491 -10.819 3.340 1.00 . A A . 26 LYS CE 1 1 19 9625 1 1 26 LYS CG C 0.590 -9.762 4.585 1.00 . A A . 26 LYS CG 1 1 19 9626 1 1 26 LYS H H -1.015 -6.126 4.872 1.00 . A A . 26 LYS H 1 1 19 9627 1 1 26 LYS HA H -0.094 -7.804 2.676 1.00 . A A . 26 LYS HA 1 1 19 9628 1 1 26 LYS HB2 H 1.137 -7.689 4.761 1.00 . A A . 26 LYS HB2 1 1 19 9629 1 1 26 LYS HB3 H -0.293 -8.142 5.686 1.00 . A A . 26 LYS HB3 1 1 19 9630 1 1 26 LYS HD2 H 2.573 -8.958 4.410 1.00 . A A . 26 LYS HD2 1 1 19 9631 1 1 26 LYS HD3 H 2.458 -10.383 5.443 1.00 . A A . 26 LYS HD3 1 1 19 9632 1 1 26 LYS HE2 H 1.947 -10.517 2.455 1.00 . A A . 26 LYS HE2 1 1 19 9633 1 1 26 LYS HE3 H 3.553 -10.774 3.160 1.00 . A A . 26 LYS HE3 1 1 19 9634 1 1 26 LYS HG2 H 0.199 -10.321 5.423 1.00 . A A . 26 LYS HG2 1 1 19 9635 1 1 26 LYS HG3 H 0.155 -10.136 3.671 1.00 . A A . 26 LYS HG3 1 1 19 9636 1 1 26 LYS HZ1 H 1.065 -12.275 3.782 1.00 . A A . 26 LYS HZ1 1 1 19 9637 1 1 26 LYS HZ2 H 2.502 -12.419 4.679 1.00 . A A . 26 LYS HZ2 1 1 19 9638 1 1 26 LYS HZ3 H 2.465 -12.883 3.046 1.00 . A A . 26 LYS HZ3 1 1 19 9639 1 1 26 LYS N N -1.126 -6.456 3.953 1.00 . A A . 26 LYS N 1 1 19 9640 1 1 26 LYS NZ N 2.102 -12.204 3.743 1.00 . A A . 26 LYS NZ 1 1 19 9641 1 1 26 LYS O O -1.935 -9.577 2.551 1.00 . A A . 26 LYS O 1 1 19 9642 1 1 27 THR C C -4.799 -9.159 2.885 1.00 . A A . 27 THR C 1 1 19 9643 1 1 27 THR CA C -4.090 -9.436 4.214 1.00 . A A . 27 THR CA 1 1 19 9644 1 1 27 THR CB C -4.972 -8.997 5.393 1.00 . A A . 27 THR CB 1 1 19 9645 1 1 27 THR CG2 C -6.106 -10.004 5.590 1.00 . A A . 27 THR CG2 1 1 19 9646 1 1 27 THR H H -2.781 -7.909 4.997 1.00 . A A . 27 THR H 1 1 19 9647 1 1 27 THR HA H -3.842 -10.480 4.301 1.00 . A A . 27 THR HA 1 1 19 9648 1 1 27 THR HB H -5.393 -8.025 5.184 1.00 . A A . 27 THR HB 1 1 19 9649 1 1 27 THR HG1 H -4.178 -8.013 6.874 1.00 . A A . 27 THR HG1 1 1 19 9650 1 1 27 THR HG21 H -5.690 -10.978 5.803 1.00 . A A . 27 THR HG21 1 1 19 9651 1 1 27 THR HG22 H -6.702 -10.057 4.690 1.00 . A A . 27 THR HG22 1 1 19 9652 1 1 27 THR HG23 H -6.728 -9.690 6.415 1.00 . A A . 27 THR HG23 1 1 19 9653 1 1 27 THR N N -2.854 -8.593 4.303 1.00 . A A . 27 THR N 1 1 19 9654 1 1 27 THR O O -5.286 -10.059 2.228 1.00 . A A . 27 THR O 1 1 19 9655 1 1 27 THR OG1 O -4.189 -8.927 6.578 1.00 . A A . 27 THR OG1 1 1 19 9656 1 1 28 TRP C C -4.541 -7.839 0.037 1.00 . A A . 28 TRP C 1 1 19 9657 1 1 28 TRP CA C -5.502 -7.547 1.196 1.00 . A A . 28 TRP CA 1 1 19 9658 1 1 28 TRP CB C -5.786 -6.039 1.298 1.00 . A A . 28 TRP CB 1 1 19 9659 1 1 28 TRP CD1 C -7.257 -6.686 3.270 1.00 . A A . 28 TRP CD1 1 1 19 9660 1 1 28 TRP CD2 C -7.209 -4.464 2.917 1.00 . A A . 28 TRP CD2 1 1 19 9661 1 1 28 TRP CE2 C -8.050 -4.684 4.034 1.00 . A A . 28 TRP CE2 1 1 19 9662 1 1 28 TRP CE3 C -7.012 -3.139 2.487 1.00 . A A . 28 TRP CE3 1 1 19 9663 1 1 28 TRP CG C -6.712 -5.754 2.448 1.00 . A A . 28 TRP CG 1 1 19 9664 1 1 28 TRP CH2 C -8.467 -2.320 4.260 1.00 . A A . 28 TRP CH2 1 1 19 9665 1 1 28 TRP CZ2 C -8.672 -3.629 4.701 1.00 . A A . 28 TRP CZ2 1 1 19 9666 1 1 28 TRP CZ3 C -7.639 -2.074 3.156 1.00 . A A . 28 TRP CZ3 1 1 19 9667 1 1 28 TRP H H -4.432 -7.215 3.038 1.00 . A A . 28 TRP H 1 1 19 9668 1 1 28 TRP HA H -6.426 -8.091 1.071 1.00 . A A . 28 TRP HA 1 1 19 9669 1 1 28 TRP HB2 H -4.858 -5.513 1.452 1.00 . A A . 28 TRP HB2 1 1 19 9670 1 1 28 TRP HB3 H -6.240 -5.697 0.382 1.00 . A A . 28 TRP HB3 1 1 19 9671 1 1 28 TRP HD1 H -7.098 -7.752 3.203 1.00 . A A . 28 TRP HD1 1 1 19 9672 1 1 28 TRP HE1 H -8.547 -6.500 4.922 1.00 . A A . 28 TRP HE1 1 1 19 9673 1 1 28 TRP HE3 H -6.377 -2.939 1.637 1.00 . A A . 28 TRP HE3 1 1 19 9674 1 1 28 TRP HH2 H -8.945 -1.498 4.772 1.00 . A A . 28 TRP HH2 1 1 19 9675 1 1 28 TRP HZ2 H -9.310 -3.824 5.550 1.00 . A A . 28 TRP HZ2 1 1 19 9676 1 1 28 TRP HZ3 H -7.482 -1.060 2.819 1.00 . A A . 28 TRP HZ3 1 1 19 9677 1 1 28 TRP N N -4.843 -7.912 2.488 1.00 . A A . 28 TRP N 1 1 19 9678 1 1 28 TRP NE1 N -8.045 -6.052 4.210 1.00 . A A . 28 TRP NE1 1 1 19 9679 1 1 28 TRP O O -4.941 -8.310 -1.012 1.00 . A A . 28 TRP O 1 1 19 9680 1 1 29 GLY C C -1.997 -6.565 -1.653 1.00 . A A . 29 GLY C 1 1 19 9681 1 1 29 GLY CA C -2.259 -7.833 -0.831 1.00 . A A . 29 GLY CA 1 1 19 9682 1 1 29 GLY H H -2.984 -7.199 1.092 1.00 . A A . 29 GLY H 1 1 19 9683 1 1 29 GLY HA2 H -1.337 -8.154 -0.367 1.00 . A A . 29 GLY HA2 1 1 19 9684 1 1 29 GLY HA3 H -2.620 -8.612 -1.485 1.00 . A A . 29 GLY HA3 1 1 19 9685 1 1 29 GLY N N -3.274 -7.570 0.233 1.00 . A A . 29 GLY N 1 1 19 9686 1 1 29 GLY O O -1.399 -6.630 -2.711 1.00 . A A . 29 GLY O 1 1 19 9687 1 1 30 TRP C C -2.071 -2.936 -1.051 1.00 . A A . 30 TRP C 1 1 19 9688 1 1 30 TRP CA C -2.179 -4.160 -1.973 1.00 . A A . 30 TRP CA 1 1 19 9689 1 1 30 TRP CB C -3.373 -4.041 -2.938 1.00 . A A . 30 TRP CB 1 1 19 9690 1 1 30 TRP CD1 C -4.797 -2.302 -1.777 1.00 . A A . 30 TRP CD1 1 1 19 9691 1 1 30 TRP CD2 C -5.798 -4.315 -1.874 1.00 . A A . 30 TRP CD2 1 1 19 9692 1 1 30 TRP CE2 C -6.691 -3.447 -1.204 1.00 . A A . 30 TRP CE2 1 1 19 9693 1 1 30 TRP CE3 C -6.190 -5.650 -2.069 1.00 . A A . 30 TRP CE3 1 1 19 9694 1 1 30 TRP CG C -4.598 -3.565 -2.220 1.00 . A A . 30 TRP CG 1 1 19 9695 1 1 30 TRP CH2 C -8.308 -5.218 -0.949 1.00 . A A . 30 TRP CH2 1 1 19 9696 1 1 30 TRP CZ2 C -7.933 -3.889 -0.745 1.00 . A A . 30 TRP CZ2 1 1 19 9697 1 1 30 TRP CZ3 C -7.440 -6.098 -1.610 1.00 . A A . 30 TRP CZ3 1 1 19 9698 1 1 30 TRP H H -2.902 -5.365 -0.328 1.00 . A A . 30 TRP H 1 1 19 9699 1 1 30 TRP HA H -1.268 -4.263 -2.542 1.00 . A A . 30 TRP HA 1 1 19 9700 1 1 30 TRP HB2 H -3.127 -3.342 -3.723 1.00 . A A . 30 TRP HB2 1 1 19 9701 1 1 30 TRP HB3 H -3.570 -5.009 -3.378 1.00 . A A . 30 TRP HB3 1 1 19 9702 1 1 30 TRP HD1 H -4.100 -1.483 -1.874 1.00 . A A . 30 TRP HD1 1 1 19 9703 1 1 30 TRP HE1 H -6.413 -1.432 -0.759 1.00 . A A . 30 TRP HE1 1 1 19 9704 1 1 30 TRP HE3 H -5.529 -6.335 -2.578 1.00 . A A . 30 TRP HE3 1 1 19 9705 1 1 30 TRP HH2 H -9.266 -5.568 -0.596 1.00 . A A . 30 TRP HH2 1 1 19 9706 1 1 30 TRP HZ2 H -8.598 -3.208 -0.236 1.00 . A A . 30 TRP HZ2 1 1 19 9707 1 1 30 TRP HZ3 H -7.732 -7.126 -1.765 1.00 . A A . 30 TRP HZ3 1 1 19 9708 1 1 30 TRP N N -2.427 -5.410 -1.189 1.00 . A A . 30 TRP N 1 1 19 9709 1 1 30 TRP NE1 N -6.033 -2.233 -1.168 1.00 . A A . 30 TRP NE1 1 1 19 9710 1 1 30 TRP O O -2.238 -3.031 0.151 1.00 . A A . 30 TRP O 1 1 19 9711 1 1 31 CYS C C -2.594 0.534 -1.383 1.00 . A A . 31 CYS C 1 1 19 9712 1 1 31 CYS CA C -1.667 -0.542 -0.816 1.00 . A A . 31 CYS CA 1 1 19 9713 1 1 31 CYS CB C -0.201 -0.122 -0.965 1.00 . A A . 31 CYS CB 1 1 19 9714 1 1 31 CYS H H -1.674 -1.750 -2.589 1.00 . A A . 31 CYS H 1 1 19 9715 1 1 31 CYS HA H -1.895 -0.733 0.220 1.00 . A A . 31 CYS HA 1 1 19 9716 1 1 31 CYS HB2 H 0.440 -0.961 -0.753 1.00 . A A . 31 CYS HB2 1 1 19 9717 1 1 31 CYS HB3 H -0.025 0.218 -1.975 1.00 . A A . 31 CYS HB3 1 1 19 9718 1 1 31 CYS N N -1.794 -1.789 -1.620 1.00 . A A . 31 CYS N 1 1 19 9719 1 1 31 CYS O O -2.498 0.904 -2.538 1.00 . A A . 31 CYS O 1 1 19 9720 1 1 31 CYS SG S 0.173 1.218 0.188 1.00 . A A . 31 CYS SG 1 1 19 9721 1 1 32 ALA C C -4.629 3.155 0.024 1.00 . A A . 32 ALA C 1 1 19 9722 1 1 32 ALA CA C -4.432 2.091 -1.060 1.00 . A A . 32 ALA CA 1 1 19 9723 1 1 32 ALA CB C -5.742 1.354 -1.341 1.00 . A A . 32 ALA CB 1 1 19 9724 1 1 32 ALA H H -3.546 0.719 0.349 1.00 . A A . 32 ALA H 1 1 19 9725 1 1 32 ALA HA H -4.059 2.543 -1.967 1.00 . A A . 32 ALA HA 1 1 19 9726 1 1 32 ALA HB1 H -6.498 2.065 -1.638 1.00 . A A . 32 ALA HB1 1 1 19 9727 1 1 32 ALA HB2 H -6.062 0.837 -0.447 1.00 . A A . 32 ALA HB2 1 1 19 9728 1 1 32 ALA HB3 H -5.588 0.638 -2.134 1.00 . A A . 32 ALA HB3 1 1 19 9729 1 1 32 ALA N N -3.491 1.036 -0.577 1.00 . A A . 32 ALA N 1 1 19 9730 1 1 32 ALA O O -4.035 3.087 1.082 1.00 . A A . 32 ALA O 1 1 19 9731 1 1 33 VAL C C -6.335 4.609 2.052 1.00 . A A . 33 VAL C 1 1 19 9732 1 1 33 VAL CA C -5.690 5.209 0.794 1.00 . A A . 33 VAL CA 1 1 19 9733 1 1 33 VAL CB C -6.641 6.219 0.131 1.00 . A A . 33 VAL CB 1 1 19 9734 1 1 33 VAL CG1 C -6.777 7.451 1.027 1.00 . A A . 33 VAL CG1 1 1 19 9735 1 1 33 VAL CG2 C -6.088 6.652 -1.232 1.00 . A A . 33 VAL CG2 1 1 19 9736 1 1 33 VAL H H -5.927 4.170 -1.089 1.00 . A A . 33 VAL H 1 1 19 9737 1 1 33 VAL HA H -4.759 5.693 1.045 1.00 . A A . 33 VAL HA 1 1 19 9738 1 1 33 VAL HB H -7.612 5.762 0.000 1.00 . A A . 33 VAL HB 1 1 19 9739 1 1 33 VAL HG11 H -5.798 7.869 1.214 1.00 . A A . 33 VAL HG11 1 1 19 9740 1 1 33 VAL HG12 H -7.232 7.167 1.966 1.00 . A A . 33 VAL HG12 1 1 19 9741 1 1 33 VAL HG13 H -7.395 8.187 0.536 1.00 . A A . 33 VAL HG13 1 1 19 9742 1 1 33 VAL HG21 H -6.777 6.359 -2.010 1.00 . A A . 33 VAL HG21 1 1 19 9743 1 1 33 VAL HG22 H -5.132 6.177 -1.401 1.00 . A A . 33 VAL HG22 1 1 19 9744 1 1 33 VAL HG23 H -5.963 7.724 -1.247 1.00 . A A . 33 VAL HG23 1 1 19 9745 1 1 33 VAL N N -5.457 4.138 -0.229 1.00 . A A . 33 VAL N 1 1 19 9746 1 1 33 VAL O O -6.956 3.564 1.998 1.00 . A A . 33 VAL O 1 1 19 9747 1 1 34 GLU C C -8.292 4.509 4.272 1.00 . A A . 34 GLU C 1 1 19 9748 1 1 34 GLU CA C -6.785 4.740 4.452 1.00 . A A . 34 GLU CA 1 1 19 9749 1 1 34 GLU CB C -6.536 5.835 5.497 1.00 . A A . 34 GLU CB 1 1 19 9750 1 1 34 GLU CD C -5.118 4.428 7.018 1.00 . A A . 34 GLU CD 1 1 19 9751 1 1 34 GLU CG C -5.141 5.665 6.113 1.00 . A A . 34 GLU CG 1 1 19 9752 1 1 34 GLU H H -5.676 6.102 3.192 1.00 . A A . 34 GLU H 1 1 19 9753 1 1 34 GLU HA H -6.296 3.826 4.752 1.00 . A A . 34 GLU HA 1 1 19 9754 1 1 34 GLU HB2 H -6.603 6.803 5.023 1.00 . A A . 34 GLU HB2 1 1 19 9755 1 1 34 GLU HB3 H -7.280 5.764 6.276 1.00 . A A . 34 GLU HB3 1 1 19 9756 1 1 34 GLU HG2 H -4.410 5.548 5.325 1.00 . A A . 34 GLU HG2 1 1 19 9757 1 1 34 GLU HG3 H -4.900 6.540 6.699 1.00 . A A . 34 GLU HG3 1 1 19 9758 1 1 34 GLU N N -6.185 5.264 3.181 1.00 . A A . 34 GLU N 1 1 19 9759 1 1 34 GLU O O -9.079 5.437 4.292 1.00 . A A . 34 GLU O 1 1 19 9760 1 1 34 GLU OE1 O -5.901 4.385 7.956 1.00 . A A . 34 GLU OE1 1 1 19 9761 1 1 34 GLU OE2 O -4.316 3.545 6.760 1.00 . A A . 34 GLU OE2 1 1 19 9762 1 1 35 ALA C C -10.430 1.491 4.163 1.00 . A A . 35 ALA C 1 1 19 9763 1 1 35 ALA CA C -10.147 2.976 3.896 1.00 . A A . 35 ALA CA 1 1 19 9764 1 1 35 ALA CB C -10.428 3.314 2.431 1.00 . A A . 35 ALA CB 1 1 19 9765 1 1 35 ALA H H -8.041 2.545 4.070 1.00 . A A . 35 ALA H 1 1 19 9766 1 1 35 ALA HA H -10.748 3.598 4.539 1.00 . A A . 35 ALA HA 1 1 19 9767 1 1 35 ALA HB1 H -11.466 3.114 2.207 1.00 . A A . 35 ALA HB1 1 1 19 9768 1 1 35 ALA HB2 H -9.800 2.707 1.794 1.00 . A A . 35 ALA HB2 1 1 19 9769 1 1 35 ALA HB3 H -10.215 4.358 2.255 1.00 . A A . 35 ALA HB3 1 1 19 9770 1 1 35 ALA N N -8.695 3.275 4.088 1.00 . A A . 35 ALA N 1 1 19 9771 1 1 35 ALA O O -9.589 0.647 3.914 1.00 . A A . 35 ALA O 1 1 19 9772 1 1 36 PRO C C -12.225 -0.973 3.656 1.00 . A A . 36 PRO C 1 1 19 9773 1 1 36 PRO CA C -12.019 -0.180 4.958 1.00 . A A . 36 PRO CA 1 1 19 9774 1 1 36 PRO CB C -13.333 -0.017 5.727 1.00 . A A . 36 PRO CB 1 1 19 9775 1 1 36 PRO CD C -12.680 2.178 4.988 1.00 . A A . 36 PRO CD 1 1 19 9776 1 1 36 PRO CG C -13.870 1.308 5.294 1.00 . A A . 36 PRO CG 1 1 19 9777 1 1 36 PRO HA H -11.284 -0.661 5.583 1.00 . A A . 36 PRO HA 1 1 19 9778 1 1 36 PRO HB2 H -14.021 -0.810 5.466 1.00 . A A . 36 PRO HB2 1 1 19 9779 1 1 36 PRO HB3 H -13.148 -0.012 6.790 1.00 . A A . 36 PRO HB3 1 1 19 9780 1 1 36 PRO HD2 H -12.891 2.823 4.144 1.00 . A A . 36 PRO HD2 1 1 19 9781 1 1 36 PRO HD3 H -12.404 2.761 5.852 1.00 . A A . 36 PRO HD3 1 1 19 9782 1 1 36 PRO HG2 H -14.480 1.187 4.408 1.00 . A A . 36 PRO HG2 1 1 19 9783 1 1 36 PRO HG3 H -14.450 1.750 6.088 1.00 . A A . 36 PRO HG3 1 1 19 9784 1 1 36 PRO N N -11.616 1.221 4.659 1.00 . A A . 36 PRO N 1 1 19 9785 1 1 36 PRO O O -11.386 -1.807 3.361 1.00 . A A . 36 PRO O 1 1 20 9786 1 1 1 ASP C C 11.817 9.244 -6.080 1.00 . A A . 1 ASP C 1 1 20 9787 1 1 1 ASP CA C 12.689 9.439 -7.331 1.00 . A A . 1 ASP CA 1 1 20 9788 1 1 1 ASP CB C 11.851 9.308 -8.610 1.00 . A A . 1 ASP CB 1 1 20 9789 1 1 1 ASP CG C 12.125 10.499 -9.532 1.00 . A A . 1 ASP CG 1 1 20 9790 1 1 1 ASP H1 H 13.239 7.426 -7.409 1.00 . A A . 1 ASP H1 1 1 20 9791 1 1 1 ASP H2 H 14.364 8.421 -6.613 1.00 . A A . 1 ASP H2 1 1 20 9792 1 1 1 ASP H3 H 14.249 8.452 -8.306 1.00 . A A . 1 ASP H3 1 1 20 9793 1 1 1 ASP HA H 13.171 10.404 -7.304 1.00 . A A . 1 ASP HA 1 1 20 9794 1 1 1 ASP HB2 H 12.112 8.392 -9.118 1.00 . A A . 1 ASP HB2 1 1 20 9795 1 1 1 ASP HB3 H 10.802 9.290 -8.354 1.00 . A A . 1 ASP HB3 1 1 20 9796 1 1 1 ASP N N 13.712 8.352 -7.422 1.00 . A A . 1 ASP N 1 1 20 9797 1 1 1 ASP O O 10.631 8.980 -6.169 1.00 . A A . 1 ASP O 1 1 20 9798 1 1 1 ASP OD1 O 13.033 10.401 -10.341 1.00 . A A . 1 ASP OD1 1 1 20 9799 1 1 1 ASP OD2 O 11.420 11.489 -9.414 1.00 . A A . 1 ASP OD2 1 1 20 9800 1 1 2 GLY C C 11.258 7.716 -3.472 1.00 . A A . 2 GLY C 1 1 20 9801 1 1 2 GLY CA C 11.618 9.194 -3.652 1.00 . A A . 2 GLY CA 1 1 20 9802 1 1 2 GLY H H 13.356 9.584 -4.866 1.00 . A A . 2 GLY H 1 1 20 9803 1 1 2 GLY HA2 H 12.211 9.527 -2.812 1.00 . A A . 2 GLY HA2 1 1 20 9804 1 1 2 GLY HA3 H 10.710 9.778 -3.705 1.00 . A A . 2 GLY HA3 1 1 20 9805 1 1 2 GLY N N 12.401 9.373 -4.913 1.00 . A A . 2 GLY N 1 1 20 9806 1 1 2 GLY O O 11.925 6.838 -3.987 1.00 . A A . 2 GLY O 1 1 20 9807 1 1 3 GLU C C 8.318 5.941 -2.109 1.00 . A A . 3 GLU C 1 1 20 9808 1 1 3 GLU CA C 9.795 6.014 -2.526 1.00 . A A . 3 GLU CA 1 1 20 9809 1 1 3 GLU CB C 10.709 5.500 -1.406 1.00 . A A . 3 GLU CB 1 1 20 9810 1 1 3 GLU CD C 12.729 4.088 -0.984 1.00 . A A . 3 GLU CD 1 1 20 9811 1 1 3 GLU CG C 11.547 4.330 -1.926 1.00 . A A . 3 GLU CG 1 1 20 9812 1 1 3 GLU H H 9.685 8.160 -2.337 1.00 . A A . 3 GLU H 1 1 20 9813 1 1 3 GLU HA H 9.958 5.438 -3.423 1.00 . A A . 3 GLU HA 1 1 20 9814 1 1 3 GLU HB2 H 11.363 6.296 -1.081 1.00 . A A . 3 GLU HB2 1 1 20 9815 1 1 3 GLU HB3 H 10.108 5.166 -0.573 1.00 . A A . 3 GLU HB3 1 1 20 9816 1 1 3 GLU HG2 H 10.936 3.441 -1.974 1.00 . A A . 3 GLU HG2 1 1 20 9817 1 1 3 GLU HG3 H 11.920 4.564 -2.913 1.00 . A A . 3 GLU HG3 1 1 20 9818 1 1 3 GLU N N 10.205 7.434 -2.742 1.00 . A A . 3 GLU N 1 1 20 9819 1 1 3 GLU O O 7.993 5.909 -0.936 1.00 . A A . 3 GLU O 1 1 20 9820 1 1 3 GLU OE1 O 12.553 3.366 -0.016 1.00 . A A . 3 GLU OE1 1 1 20 9821 1 1 3 GLU OE2 O 13.791 4.630 -1.245 1.00 . A A . 3 GLU OE2 1 1 20 9822 1 1 4 CYS C C 5.229 5.000 -3.790 1.00 . A A . 4 CYS C 1 1 20 9823 1 1 4 CYS CA C 5.966 5.842 -2.741 1.00 . A A . 4 CYS CA 1 1 20 9824 1 1 4 CYS CB C 5.478 7.298 -2.750 1.00 . A A . 4 CYS CB 1 1 20 9825 1 1 4 CYS H H 7.713 5.942 -4.003 1.00 . A A . 4 CYS H 1 1 20 9826 1 1 4 CYS HA H 5.827 5.419 -1.759 1.00 . A A . 4 CYS HA 1 1 20 9827 1 1 4 CYS HB2 H 5.372 7.641 -1.734 1.00 . A A . 4 CYS HB2 1 1 20 9828 1 1 4 CYS HB3 H 6.202 7.913 -3.261 1.00 . A A . 4 CYS HB3 1 1 20 9829 1 1 4 CYS N N 7.424 5.915 -3.068 1.00 . A A . 4 CYS N 1 1 20 9830 1 1 4 CYS O O 5.654 4.889 -4.927 1.00 . A A . 4 CYS O 1 1 20 9831 1 1 4 CYS SG S 3.876 7.431 -3.591 1.00 . A A . 4 CYS SG 1 1 20 9832 1 1 5 GLY C C 2.227 4.429 -4.991 1.00 . A A . 5 GLY C 1 1 20 9833 1 1 5 GLY CA C 3.342 3.581 -4.367 1.00 . A A . 5 GLY CA 1 1 20 9834 1 1 5 GLY H H 3.806 4.529 -2.495 1.00 . A A . 5 GLY H 1 1 20 9835 1 1 5 GLY HA2 H 3.996 3.213 -5.142 1.00 . A A . 5 GLY HA2 1 1 20 9836 1 1 5 GLY HA3 H 2.901 2.749 -3.840 1.00 . A A . 5 GLY HA3 1 1 20 9837 1 1 5 GLY N N 4.124 4.416 -3.412 1.00 . A A . 5 GLY N 1 1 20 9838 1 1 5 GLY O O 2.467 5.512 -5.493 1.00 . A A . 5 GLY O 1 1 20 9839 1 1 6 GLY C C -1.404 4.431 -4.743 1.00 . A A . 6 GLY C 1 1 20 9840 1 1 6 GLY CA C -0.126 4.711 -5.546 1.00 . A A . 6 GLY CA 1 1 20 9841 1 1 6 GLY H H 0.849 3.068 -4.551 1.00 . A A . 6 GLY H 1 1 20 9842 1 1 6 GLY HA2 H 0.101 5.768 -5.514 1.00 . A A . 6 GLY HA2 1 1 20 9843 1 1 6 GLY HA3 H -0.273 4.409 -6.572 1.00 . A A . 6 GLY HA3 1 1 20 9844 1 1 6 GLY N N 1.012 3.942 -4.960 1.00 . A A . 6 GLY N 1 1 20 9845 1 1 6 GLY O O -1.349 4.100 -3.573 1.00 . A A . 6 GLY O 1 1 20 9846 1 1 7 PHE C C -4.122 2.795 -4.542 1.00 . A A . 7 PHE C 1 1 20 9847 1 1 7 PHE CA C -3.839 4.302 -4.635 1.00 . A A . 7 PHE CA 1 1 20 9848 1 1 7 PHE CB C -4.918 5.007 -5.467 1.00 . A A . 7 PHE CB 1 1 20 9849 1 1 7 PHE CD1 C -6.719 5.653 -3.816 1.00 . A A . 7 PHE CD1 1 1 20 9850 1 1 7 PHE CD2 C -7.088 3.734 -5.253 1.00 . A A . 7 PHE CD2 1 1 20 9851 1 1 7 PHE CE1 C -7.973 5.450 -3.224 1.00 . A A . 7 PHE CE1 1 1 20 9852 1 1 7 PHE CE2 C -8.340 3.532 -4.661 1.00 . A A . 7 PHE CE2 1 1 20 9853 1 1 7 PHE CG C -6.276 4.793 -4.831 1.00 . A A . 7 PHE CG 1 1 20 9854 1 1 7 PHE CZ C -8.783 4.389 -3.648 1.00 . A A . 7 PHE CZ 1 1 20 9855 1 1 7 PHE H H -2.570 4.826 -6.304 1.00 . A A . 7 PHE H 1 1 20 9856 1 1 7 PHE HA H -3.800 4.733 -3.648 1.00 . A A . 7 PHE HA 1 1 20 9857 1 1 7 PHE HB2 H -4.703 6.065 -5.510 1.00 . A A . 7 PHE HB2 1 1 20 9858 1 1 7 PHE HB3 H -4.923 4.600 -6.469 1.00 . A A . 7 PHE HB3 1 1 20 9859 1 1 7 PHE HD1 H -6.094 6.472 -3.489 1.00 . A A . 7 PHE HD1 1 1 20 9860 1 1 7 PHE HD2 H -6.748 3.072 -6.035 1.00 . A A . 7 PHE HD2 1 1 20 9861 1 1 7 PHE HE1 H -8.315 6.113 -2.442 1.00 . A A . 7 PHE HE1 1 1 20 9862 1 1 7 PHE HE2 H -8.967 2.715 -4.988 1.00 . A A . 7 PHE HE2 1 1 20 9863 1 1 7 PHE HZ H -9.750 4.233 -3.190 1.00 . A A . 7 PHE HZ 1 1 20 9864 1 1 7 PHE N N -2.553 4.561 -5.362 1.00 . A A . 7 PHE N 1 1 20 9865 1 1 7 PHE O O -4.754 2.335 -3.610 1.00 . A A . 7 PHE O 1 1 20 9866 1 1 8 TRP C C -2.753 -0.194 -6.140 1.00 . A A . 8 TRP C 1 1 20 9867 1 1 8 TRP CA C -3.915 0.550 -5.461 1.00 . A A . 8 TRP CA 1 1 20 9868 1 1 8 TRP CB C -5.239 0.357 -6.216 1.00 . A A . 8 TRP CB 1 1 20 9869 1 1 8 TRP CD1 C -5.452 -2.030 -5.384 1.00 . A A . 8 TRP CD1 1 1 20 9870 1 1 8 TRP CD2 C -6.028 -1.811 -7.549 1.00 . A A . 8 TRP CD2 1 1 20 9871 1 1 8 TRP CE2 C -6.186 -3.179 -7.222 1.00 . A A . 8 TRP CE2 1 1 20 9872 1 1 8 TRP CE3 C -6.327 -1.406 -8.862 1.00 . A A . 8 TRP CE3 1 1 20 9873 1 1 8 TRP CG C -5.554 -1.103 -6.366 1.00 . A A . 8 TRP CG 1 1 20 9874 1 1 8 TRP CH2 C -6.922 -3.689 -9.464 1.00 . A A . 8 TRP CH2 1 1 20 9875 1 1 8 TRP CZ2 C -6.629 -4.111 -8.164 1.00 . A A . 8 TRP CZ2 1 1 20 9876 1 1 8 TRP CZ3 C -6.772 -2.341 -9.813 1.00 . A A . 8 TRP CZ3 1 1 20 9877 1 1 8 TRP H H -3.165 2.416 -6.244 1.00 . A A . 8 TRP H 1 1 20 9878 1 1 8 TRP HA H -4.023 0.217 -4.441 1.00 . A A . 8 TRP HA 1 1 20 9879 1 1 8 TRP HB2 H -6.035 0.838 -5.666 1.00 . A A . 8 TRP HB2 1 1 20 9880 1 1 8 TRP HB3 H -5.160 0.809 -7.193 1.00 . A A . 8 TRP HB3 1 1 20 9881 1 1 8 TRP HD1 H -5.130 -1.840 -4.372 1.00 . A A . 8 TRP HD1 1 1 20 9882 1 1 8 TRP HE1 H -5.837 -4.102 -5.387 1.00 . A A . 8 TRP HE1 1 1 20 9883 1 1 8 TRP HE3 H -6.216 -0.369 -9.143 1.00 . A A . 8 TRP HE3 1 1 20 9884 1 1 8 TRP HH2 H -7.265 -4.403 -10.199 1.00 . A A . 8 TRP HH2 1 1 20 9885 1 1 8 TRP HZ2 H -6.741 -5.149 -7.890 1.00 . A A . 8 TRP HZ2 1 1 20 9886 1 1 8 TRP HZ3 H -7.001 -2.017 -10.818 1.00 . A A . 8 TRP HZ3 1 1 20 9887 1 1 8 TRP N N -3.667 2.024 -5.500 1.00 . A A . 8 TRP N 1 1 20 9888 1 1 8 TRP NE1 N -5.824 -3.262 -5.893 1.00 . A A . 8 TRP NE1 1 1 20 9889 1 1 8 TRP O O -2.872 -0.682 -7.249 1.00 . A A . 8 TRP O 1 1 20 9890 1 1 9 TRP C C -0.278 -2.350 -5.355 1.00 . A A . 9 TRP C 1 1 20 9891 1 1 9 TRP CA C -0.443 -0.989 -6.045 1.00 . A A . 9 TRP CA 1 1 20 9892 1 1 9 TRP CB C 0.756 -0.077 -5.747 1.00 . A A . 9 TRP CB 1 1 20 9893 1 1 9 TRP CD1 C -0.349 1.700 -7.192 1.00 . A A . 9 TRP CD1 1 1 20 9894 1 1 9 TRP CD2 C 1.893 1.867 -7.170 1.00 . A A . 9 TRP CD2 1 1 20 9895 1 1 9 TRP CE2 C 1.413 2.911 -7.994 1.00 . A A . 9 TRP CE2 1 1 20 9896 1 1 9 TRP CE3 C 3.282 1.751 -6.990 1.00 . A A . 9 TRP CE3 1 1 20 9897 1 1 9 TRP CG C 0.753 1.110 -6.667 1.00 . A A . 9 TRP CG 1 1 20 9898 1 1 9 TRP CH2 C 3.654 3.682 -8.426 1.00 . A A . 9 TRP CH2 1 1 20 9899 1 1 9 TRP CZ2 C 2.276 3.810 -8.613 1.00 . A A . 9 TRP CZ2 1 1 20 9900 1 1 9 TRP CZ3 C 4.156 2.655 -7.617 1.00 . A A . 9 TRP CZ3 1 1 20 9901 1 1 9 TRP H H -1.566 0.123 -4.574 1.00 . A A . 9 TRP H 1 1 20 9902 1 1 9 TRP HA H -0.559 -1.116 -7.111 1.00 . A A . 9 TRP HA 1 1 20 9903 1 1 9 TRP HB2 H 0.700 0.268 -4.725 1.00 . A A . 9 TRP HB2 1 1 20 9904 1 1 9 TRP HB3 H 1.672 -0.632 -5.885 1.00 . A A . 9 TRP HB3 1 1 20 9905 1 1 9 TRP HD1 H -1.368 1.388 -7.026 1.00 . A A . 9 TRP HD1 1 1 20 9906 1 1 9 TRP HE1 H -0.561 3.359 -8.468 1.00 . A A . 9 TRP HE1 1 1 20 9907 1 1 9 TRP HE3 H 3.680 0.964 -6.369 1.00 . A A . 9 TRP HE3 1 1 20 9908 1 1 9 TRP HH2 H 4.331 4.375 -8.905 1.00 . A A . 9 TRP HH2 1 1 20 9909 1 1 9 TRP HZ2 H 1.881 4.601 -9.229 1.00 . A A . 9 TRP HZ2 1 1 20 9910 1 1 9 TRP HZ3 H 5.220 2.560 -7.471 1.00 . A A . 9 TRP HZ3 1 1 20 9911 1 1 9 TRP N N -1.630 -0.279 -5.467 1.00 . A A . 9 TRP N 1 1 20 9912 1 1 9 TRP NE1 N 0.044 2.766 -7.977 1.00 . A A . 9 TRP NE1 1 1 20 9913 1 1 9 TRP O O -1.033 -2.688 -4.468 1.00 . A A . 9 TRP O 1 1 20 9914 1 1 10 LYS C C 1.830 -4.373 -3.908 1.00 . A A . 10 LYS C 1 1 20 9915 1 1 10 LYS CA C 0.873 -4.475 -5.096 1.00 . A A . 10 LYS CA 1 1 20 9916 1 1 10 LYS CB C 1.473 -5.386 -6.164 1.00 . A A . 10 LYS CB 1 1 20 9917 1 1 10 LYS CD C 0.140 -5.690 -8.265 1.00 . A A . 10 LYS CD 1 1 20 9918 1 1 10 LYS CE C -0.944 -4.605 -8.270 1.00 . A A . 10 LYS CE 1 1 20 9919 1 1 10 LYS CG C 0.360 -6.197 -6.836 1.00 . A A . 10 LYS CG 1 1 20 9920 1 1 10 LYS H H 1.295 -2.854 -6.469 1.00 . A A . 10 LYS H 1 1 20 9921 1 1 10 LYS HA H -0.081 -4.863 -4.775 1.00 . A A . 10 LYS HA 1 1 20 9922 1 1 10 LYS HB2 H 1.987 -4.788 -6.901 1.00 . A A . 10 LYS HB2 1 1 20 9923 1 1 10 LYS HB3 H 2.175 -6.062 -5.697 1.00 . A A . 10 LYS HB3 1 1 20 9924 1 1 10 LYS HD2 H 1.065 -5.279 -8.647 1.00 . A A . 10 LYS HD2 1 1 20 9925 1 1 10 LYS HD3 H -0.173 -6.511 -8.893 1.00 . A A . 10 LYS HD3 1 1 20 9926 1 1 10 LYS HE2 H -1.829 -4.964 -8.779 1.00 . A A . 10 LYS HE2 1 1 20 9927 1 1 10 LYS HE3 H -1.186 -4.309 -7.261 1.00 . A A . 10 LYS HE3 1 1 20 9928 1 1 10 LYS HG2 H 0.646 -7.239 -6.864 1.00 . A A . 10 LYS HG2 1 1 20 9929 1 1 10 LYS HG3 H -0.555 -6.092 -6.272 1.00 . A A . 10 LYS HG3 1 1 20 9930 1 1 10 LYS HZ1 H 0.532 -3.159 -8.546 1.00 . A A . 10 LYS HZ1 1 1 20 9931 1 1 10 LYS HZ2 H -1.022 -2.662 -9.017 1.00 . A A . 10 LYS HZ2 1 1 20 9932 1 1 10 LYS HZ3 H -0.143 -3.742 -9.990 1.00 . A A . 10 LYS HZ3 1 1 20 9933 1 1 10 LYS N N 0.692 -3.137 -5.750 1.00 . A A . 10 LYS N 1 1 20 9934 1 1 10 LYS NZ N -0.349 -3.455 -9.012 1.00 . A A . 10 LYS NZ 1 1 20 9935 1 1 10 LYS O O 2.891 -3.784 -4.002 1.00 . A A . 10 LYS O 1 1 20 9936 1 1 11 CYS C C 2.121 -6.150 -0.721 1.00 . A A . 11 CYS C 1 1 20 9937 1 1 11 CYS CA C 2.351 -4.914 -1.599 1.00 . A A . 11 CYS CA 1 1 20 9938 1 1 11 CYS CB C 1.949 -3.640 -0.852 1.00 . A A . 11 CYS CB 1 1 20 9939 1 1 11 CYS H H 0.613 -5.434 -2.752 1.00 . A A . 11 CYS H 1 1 20 9940 1 1 11 CYS HA H 3.382 -4.853 -1.908 1.00 . A A . 11 CYS HA 1 1 20 9941 1 1 11 CYS HB2 H 2.147 -2.783 -1.477 1.00 . A A . 11 CYS HB2 1 1 20 9942 1 1 11 CYS HB3 H 0.896 -3.679 -0.618 1.00 . A A . 11 CYS HB3 1 1 20 9943 1 1 11 CYS N N 1.465 -4.956 -2.796 1.00 . A A . 11 CYS N 1 1 20 9944 1 1 11 CYS O O 1.111 -6.824 -0.830 1.00 . A A . 11 CYS O 1 1 20 9945 1 1 11 CYS SG S 2.900 -3.496 0.679 1.00 . A A . 11 CYS SG 1 1 20 9946 1 1 12 GLY C C 2.463 -7.126 2.447 1.00 . A A . 12 GLY C 1 1 20 9947 1 1 12 GLY CA C 2.885 -7.619 1.062 1.00 . A A . 12 GLY CA 1 1 20 9948 1 1 12 GLY H H 3.842 -5.877 0.234 1.00 . A A . 12 GLY H 1 1 20 9949 1 1 12 GLY HA2 H 2.128 -8.281 0.665 1.00 . A A . 12 GLY HA2 1 1 20 9950 1 1 12 GLY HA3 H 3.823 -8.146 1.140 1.00 . A A . 12 GLY HA3 1 1 20 9951 1 1 12 GLY N N 3.045 -6.443 0.159 1.00 . A A . 12 GLY N 1 1 20 9952 1 1 12 GLY O O 1.429 -6.500 2.601 1.00 . A A . 12 GLY O 1 1 20 9953 1 1 13 ARG C C 3.521 -5.522 5.086 1.00 . A A . 13 ARG C 1 1 20 9954 1 1 13 ARG CA C 2.909 -6.912 4.832 1.00 . A A . 13 ARG CA 1 1 20 9955 1 1 13 ARG CB C 3.520 -7.953 5.776 1.00 . A A . 13 ARG CB 1 1 20 9956 1 1 13 ARG CD C 2.714 -7.326 8.066 1.00 . A A . 13 ARG CD 1 1 20 9957 1 1 13 ARG CG C 2.522 -8.288 6.889 1.00 . A A . 13 ARG CG 1 1 20 9958 1 1 13 ARG CZ C 2.824 -8.375 10.256 1.00 . A A . 13 ARG CZ 1 1 20 9959 1 1 13 ARG H H 4.091 -7.881 3.304 1.00 . A A . 13 ARG H 1 1 20 9960 1 1 13 ARG HA H 1.836 -6.881 4.957 1.00 . A A . 13 ARG HA 1 1 20 9961 1 1 13 ARG HB2 H 3.753 -8.850 5.219 1.00 . A A . 13 ARG HB2 1 1 20 9962 1 1 13 ARG HB3 H 4.424 -7.557 6.212 1.00 . A A . 13 ARG HB3 1 1 20 9963 1 1 13 ARG HD2 H 3.766 -7.156 8.244 1.00 . A A . 13 ARG HD2 1 1 20 9964 1 1 13 ARG HD3 H 2.207 -6.394 7.876 1.00 . A A . 13 ARG HD3 1 1 20 9965 1 1 13 ARG HE H 1.127 -8.198 9.237 1.00 . A A . 13 ARG HE 1 1 20 9966 1 1 13 ARG HG2 H 1.516 -8.195 6.508 1.00 . A A . 13 ARG HG2 1 1 20 9967 1 1 13 ARG HG3 H 2.687 -9.301 7.223 1.00 . A A . 13 ARG HG3 1 1 20 9968 1 1 13 ARG HH11 H 4.091 -9.481 9.162 1.00 . A A . 13 ARG HH11 1 1 20 9969 1 1 13 ARG HH12 H 4.419 -9.432 10.861 1.00 . A A . 13 ARG HH12 1 1 20 9970 1 1 13 ARG HH21 H 1.729 -7.359 11.593 1.00 . A A . 13 ARG HH21 1 1 20 9971 1 1 13 ARG HH22 H 3.080 -8.229 12.240 1.00 . A A . 13 ARG HH22 1 1 20 9972 1 1 13 ARG N N 3.258 -7.385 3.454 1.00 . A A . 13 ARG N 1 1 20 9973 1 1 13 ARG NE N 2.091 -8.016 9.234 1.00 . A A . 13 ARG NE 1 1 20 9974 1 1 13 ARG NH1 N 3.859 -9.157 10.078 1.00 . A A . 13 ARG NH1 1 1 20 9975 1 1 13 ARG NH2 N 2.522 -7.955 11.457 1.00 . A A . 13 ARG NH2 1 1 20 9976 1 1 13 ARG O O 3.870 -5.185 6.202 1.00 . A A . 13 ARG O 1 1 20 9977 1 1 14 GLY C C 5.705 -3.353 3.760 1.00 . A A . 14 GLY C 1 1 20 9978 1 1 14 GLY CA C 4.245 -3.353 4.232 1.00 . A A . 14 GLY CA 1 1 20 9979 1 1 14 GLY H H 3.370 -5.007 3.167 1.00 . A A . 14 GLY H 1 1 20 9980 1 1 14 GLY HA2 H 3.679 -2.641 3.651 1.00 . A A . 14 GLY HA2 1 1 20 9981 1 1 14 GLY HA3 H 4.209 -3.076 5.274 1.00 . A A . 14 GLY HA3 1 1 20 9982 1 1 14 GLY N N 3.656 -4.715 4.057 1.00 . A A . 14 GLY N 1 1 20 9983 1 1 14 GLY O O 6.547 -2.694 4.341 1.00 . A A . 14 GLY O 1 1 20 9984 1 1 15 LYS C C 7.746 -2.830 1.426 1.00 . A A . 15 LYS C 1 1 20 9985 1 1 15 LYS CA C 7.420 -4.117 2.204 1.00 . A A . 15 LYS CA 1 1 20 9986 1 1 15 LYS CB C 7.504 -5.352 1.299 1.00 . A A . 15 LYS CB 1 1 20 9987 1 1 15 LYS CD C 7.370 -7.811 1.751 1.00 . A A . 15 LYS CD 1 1 20 9988 1 1 15 LYS CE C 8.270 -8.741 0.927 1.00 . A A . 15 LYS CE 1 1 20 9989 1 1 15 LYS CG C 8.125 -6.517 2.073 1.00 . A A . 15 LYS CG 1 1 20 9990 1 1 15 LYS H H 5.317 -4.604 2.257 1.00 . A A . 15 LYS H 1 1 20 9991 1 1 15 LYS HA H 8.102 -4.227 3.027 1.00 . A A . 15 LYS HA 1 1 20 9992 1 1 15 LYS HB2 H 6.512 -5.625 0.971 1.00 . A A . 15 LYS HB2 1 1 20 9993 1 1 15 LYS HB3 H 8.118 -5.127 0.439 1.00 . A A . 15 LYS HB3 1 1 20 9994 1 1 15 LYS HD2 H 7.089 -8.302 2.671 1.00 . A A . 15 LYS HD2 1 1 20 9995 1 1 15 LYS HD3 H 6.483 -7.577 1.182 1.00 . A A . 15 LYS HD3 1 1 20 9996 1 1 15 LYS HE2 H 7.679 -9.523 0.470 1.00 . A A . 15 LYS HE2 1 1 20 9997 1 1 15 LYS HE3 H 8.797 -8.180 0.172 1.00 . A A . 15 LYS HE3 1 1 20 9998 1 1 15 LYS HG2 H 9.163 -6.625 1.790 1.00 . A A . 15 LYS HG2 1 1 20 9999 1 1 15 LYS HG3 H 8.061 -6.321 3.133 1.00 . A A . 15 LYS HG3 1 1 20 10000 1 1 15 LYS HZ1 H 8.764 -9.497 2.811 1.00 . A A . 15 LYS HZ1 1 1 20 10001 1 1 15 LYS HZ2 H 10.029 -8.660 2.043 1.00 . A A . 15 LYS HZ2 1 1 20 10002 1 1 15 LYS HZ3 H 9.605 -10.223 1.529 1.00 . A A . 15 LYS HZ3 1 1 20 10003 1 1 15 LYS N N 6.011 -4.082 2.712 1.00 . A A . 15 LYS N 1 1 20 10004 1 1 15 LYS NZ N 9.239 -9.325 1.901 1.00 . A A . 15 LYS NZ 1 1 20 10005 1 1 15 LYS O O 8.594 -2.066 1.845 1.00 . A A . 15 LYS O 1 1 20 10006 1 1 16 PRO C C 6.735 -0.169 0.238 1.00 . A A . 16 PRO C 1 1 20 10007 1 1 16 PRO CA C 7.282 -1.403 -0.494 1.00 . A A . 16 PRO CA 1 1 20 10008 1 1 16 PRO CB C 6.492 -1.674 -1.772 1.00 . A A . 16 PRO CB 1 1 20 10009 1 1 16 PRO CD C 6.019 -3.484 -0.253 1.00 . A A . 16 PRO CD 1 1 20 10010 1 1 16 PRO CG C 5.438 -2.657 -1.371 1.00 . A A . 16 PRO CG 1 1 20 10011 1 1 16 PRO HA H 8.328 -1.286 -0.720 1.00 . A A . 16 PRO HA 1 1 20 10012 1 1 16 PRO HB2 H 6.039 -0.760 -2.133 1.00 . A A . 16 PRO HB2 1 1 20 10013 1 1 16 PRO HB3 H 7.131 -2.103 -2.527 1.00 . A A . 16 PRO HB3 1 1 20 10014 1 1 16 PRO HD2 H 5.262 -3.715 0.484 1.00 . A A . 16 PRO HD2 1 1 20 10015 1 1 16 PRO HD3 H 6.463 -4.388 -0.638 1.00 . A A . 16 PRO HD3 1 1 20 10016 1 1 16 PRO HG2 H 4.557 -2.133 -1.028 1.00 . A A . 16 PRO HG2 1 1 20 10017 1 1 16 PRO HG3 H 5.191 -3.295 -2.205 1.00 . A A . 16 PRO HG3 1 1 20 10018 1 1 16 PRO N N 7.056 -2.623 0.325 1.00 . A A . 16 PRO N 1 1 20 10019 1 1 16 PRO O O 5.644 -0.209 0.779 1.00 . A A . 16 PRO O 1 1 20 10020 1 1 17 PRO C C 5.971 2.833 0.140 1.00 . A A . 17 PRO C 1 1 20 10021 1 1 17 PRO CA C 7.092 2.136 0.921 1.00 . A A . 17 PRO CA 1 1 20 10022 1 1 17 PRO CB C 8.361 2.986 0.930 1.00 . A A . 17 PRO CB 1 1 20 10023 1 1 17 PRO CD C 8.837 1.021 -0.385 1.00 . A A . 17 PRO CD 1 1 20 10024 1 1 17 PRO CG C 9.176 2.479 -0.216 1.00 . A A . 17 PRO CG 1 1 20 10025 1 1 17 PRO HA H 6.781 1.931 1.933 1.00 . A A . 17 PRO HA 1 1 20 10026 1 1 17 PRO HB2 H 8.113 4.029 0.785 1.00 . A A . 17 PRO HB2 1 1 20 10027 1 1 17 PRO HB3 H 8.899 2.851 1.854 1.00 . A A . 17 PRO HB3 1 1 20 10028 1 1 17 PRO HD2 H 8.792 0.764 -1.436 1.00 . A A . 17 PRO HD2 1 1 20 10029 1 1 17 PRO HD3 H 9.555 0.401 0.128 1.00 . A A . 17 PRO HD3 1 1 20 10030 1 1 17 PRO HG2 H 8.927 3.025 -1.115 1.00 . A A . 17 PRO HG2 1 1 20 10031 1 1 17 PRO HG3 H 10.228 2.584 0.002 1.00 . A A . 17 PRO HG3 1 1 20 10032 1 1 17 PRO N N 7.512 0.887 0.240 1.00 . A A . 17 PRO N 1 1 20 10033 1 1 17 PRO O O 6.215 3.506 -0.843 1.00 . A A . 17 PRO O 1 1 20 10034 1 1 18 CYS C C 3.651 4.860 0.156 1.00 . A A . 18 CYS C 1 1 20 10035 1 1 18 CYS CA C 3.607 3.353 -0.130 1.00 . A A . 18 CYS CA 1 1 20 10036 1 1 18 CYS CB C 2.334 2.721 0.451 1.00 . A A . 18 CYS CB 1 1 20 10037 1 1 18 CYS H H 4.573 2.143 1.376 1.00 . A A . 18 CYS H 1 1 20 10038 1 1 18 CYS HA H 3.663 3.165 -1.190 1.00 . A A . 18 CYS HA 1 1 20 10039 1 1 18 CYS HB2 H 2.364 2.769 1.529 1.00 . A A . 18 CYS HB2 1 1 20 10040 1 1 18 CYS HB3 H 1.469 3.256 0.091 1.00 . A A . 18 CYS HB3 1 1 20 10041 1 1 18 CYS N N 4.744 2.684 0.577 1.00 . A A . 18 CYS N 1 1 20 10042 1 1 18 CYS O O 4.397 5.311 1.006 1.00 . A A . 18 CYS O 1 1 20 10043 1 1 18 CYS SG S 2.226 0.991 -0.069 1.00 . A A . 18 CYS SG 1 1 20 10044 1 1 19 CYS C C 2.449 7.422 1.146 1.00 . A A . 19 CYS C 1 1 20 10045 1 1 19 CYS CA C 2.892 7.125 -0.293 1.00 . A A . 19 CYS CA 1 1 20 10046 1 1 19 CYS CB C 1.916 7.733 -1.302 1.00 . A A . 19 CYS CB 1 1 20 10047 1 1 19 CYS H H 2.276 5.271 -1.228 1.00 . A A . 19 CYS H 1 1 20 10048 1 1 19 CYS HA H 3.884 7.513 -0.462 1.00 . A A . 19 CYS HA 1 1 20 10049 1 1 19 CYS HB2 H 1.406 6.945 -1.834 1.00 . A A . 19 CYS HB2 1 1 20 10050 1 1 19 CYS HB3 H 1.193 8.345 -0.782 1.00 . A A . 19 CYS HB3 1 1 20 10051 1 1 19 CYS N N 2.870 5.648 -0.542 1.00 . A A . 19 CYS N 1 1 20 10052 1 1 19 CYS O O 1.642 6.711 1.715 1.00 . A A . 19 CYS O 1 1 20 10053 1 1 19 CYS SG S 2.834 8.758 -2.480 1.00 . A A . 19 CYS SG 1 1 20 10054 1 1 20 LYS C C 1.092 8.894 3.299 1.00 . A A . 20 LYS C 1 1 20 10055 1 1 20 LYS CA C 2.617 8.820 3.142 1.00 . A A . 20 LYS CA 1 1 20 10056 1 1 20 LYS CB C 3.256 10.188 3.394 1.00 . A A . 20 LYS CB 1 1 20 10057 1 1 20 LYS CD C 5.097 11.259 4.710 1.00 . A A . 20 LYS CD 1 1 20 10058 1 1 20 LYS CE C 5.037 12.031 6.033 1.00 . A A . 20 LYS CE 1 1 20 10059 1 1 20 LYS CG C 4.038 10.153 4.710 1.00 . A A . 20 LYS CG 1 1 20 10060 1 1 20 LYS H H 3.638 9.009 1.255 1.00 . A A . 20 LYS H 1 1 20 10061 1 1 20 LYS HA H 3.028 8.094 3.821 1.00 . A A . 20 LYS HA 1 1 20 10062 1 1 20 LYS HB2 H 3.930 10.427 2.583 1.00 . A A . 20 LYS HB2 1 1 20 10063 1 1 20 LYS HB3 H 2.485 10.941 3.455 1.00 . A A . 20 LYS HB3 1 1 20 10064 1 1 20 LYS HD2 H 6.077 10.817 4.596 1.00 . A A . 20 LYS HD2 1 1 20 10065 1 1 20 LYS HD3 H 4.911 11.937 3.891 1.00 . A A . 20 LYS HD3 1 1 20 10066 1 1 20 LYS HE2 H 4.782 11.364 6.843 1.00 . A A . 20 LYS HE2 1 1 20 10067 1 1 20 LYS HE3 H 5.981 12.517 6.227 1.00 . A A . 20 LYS HE3 1 1 20 10068 1 1 20 LYS HG2 H 3.357 10.305 5.535 1.00 . A A . 20 LYS HG2 1 1 20 10069 1 1 20 LYS HG3 H 4.522 9.194 4.816 1.00 . A A . 20 LYS HG3 1 1 20 10070 1 1 20 LYS HZ1 H 3.884 13.632 6.702 1.00 . A A . 20 LYS HZ1 1 1 20 10071 1 1 20 LYS HZ2 H 3.061 12.576 5.656 1.00 . A A . 20 LYS HZ2 1 1 20 10072 1 1 20 LYS HZ3 H 4.210 13.664 5.036 1.00 . A A . 20 LYS HZ3 1 1 20 10073 1 1 20 LYS N N 2.984 8.465 1.736 1.00 . A A . 20 LYS N 1 1 20 10074 1 1 20 LYS NZ N 3.968 13.053 5.842 1.00 . A A . 20 LYS NZ 1 1 20 10075 1 1 20 LYS O O 0.428 9.672 2.641 1.00 . A A . 20 LYS O 1 1 20 10076 1 1 21 GLY C C -1.542 6.764 3.852 1.00 . A A . 21 GLY C 1 1 20 10077 1 1 21 GLY CA C -0.942 8.081 4.366 1.00 . A A . 21 GLY CA 1 1 20 10078 1 1 21 GLY H H 1.098 7.455 4.674 1.00 . A A . 21 GLY H 1 1 20 10079 1 1 21 GLY HA2 H -1.157 8.187 5.421 1.00 . A A . 21 GLY HA2 1 1 20 10080 1 1 21 GLY HA3 H -1.380 8.907 3.827 1.00 . A A . 21 GLY HA3 1 1 20 10081 1 1 21 GLY N N 0.539 8.077 4.162 1.00 . A A . 21 GLY N 1 1 20 10082 1 1 21 GLY O O -2.615 6.365 4.262 1.00 . A A . 21 GLY O 1 1 20 10083 1 1 22 TYR C C -0.923 3.633 3.294 1.00 . A A . 22 TYR C 1 1 20 10084 1 1 22 TYR CA C -1.386 4.800 2.416 1.00 . A A . 22 TYR CA 1 1 20 10085 1 1 22 TYR CB C -0.784 4.665 1.009 1.00 . A A . 22 TYR CB 1 1 20 10086 1 1 22 TYR CD1 C -2.253 6.684 0.513 1.00 . A A . 22 TYR CD1 1 1 20 10087 1 1 22 TYR CD2 C -0.804 5.823 -1.228 1.00 . A A . 22 TYR CD2 1 1 20 10088 1 1 22 TYR CE1 C -2.711 7.678 -0.361 1.00 . A A . 22 TYR CE1 1 1 20 10089 1 1 22 TYR CE2 C -1.263 6.815 -2.101 1.00 . A A . 22 TYR CE2 1 1 20 10090 1 1 22 TYR CG C -1.296 5.753 0.079 1.00 . A A . 22 TYR CG 1 1 20 10091 1 1 22 TYR CZ C -2.216 7.743 -1.667 1.00 . A A . 22 TYR CZ 1 1 20 10092 1 1 22 TYR H H 0.001 6.430 2.641 1.00 . A A . 22 TYR H 1 1 20 10093 1 1 22 TYR HA H -2.464 4.823 2.357 1.00 . A A . 22 TYR HA 1 1 20 10094 1 1 22 TYR HB2 H 0.291 4.737 1.075 1.00 . A A . 22 TYR HB2 1 1 20 10095 1 1 22 TYR HB3 H -1.049 3.700 0.602 1.00 . A A . 22 TYR HB3 1 1 20 10096 1 1 22 TYR HD1 H -2.638 6.636 1.521 1.00 . A A . 22 TYR HD1 1 1 20 10097 1 1 22 TYR HD2 H -0.067 5.108 -1.568 1.00 . A A . 22 TYR HD2 1 1 20 10098 1 1 22 TYR HE1 H -3.446 8.393 -0.026 1.00 . A A . 22 TYR HE1 1 1 20 10099 1 1 22 TYR HE2 H -0.881 6.866 -3.111 1.00 . A A . 22 TYR HE2 1 1 20 10100 1 1 22 TYR HH H -3.433 8.369 -2.997 1.00 . A A . 22 TYR HH 1 1 20 10101 1 1 22 TYR N N -0.857 6.089 2.959 1.00 . A A . 22 TYR N 1 1 20 10102 1 1 22 TYR O O 0.061 3.728 4.004 1.00 . A A . 22 TYR O 1 1 20 10103 1 1 22 TYR OH O -2.671 8.719 -2.530 1.00 . A A . 22 TYR OH 1 1 20 10104 1 1 23 ALA C C -1.266 0.084 3.194 1.00 . A A . 23 ALA C 1 1 20 10105 1 1 23 ALA CA C -1.236 1.346 4.059 1.00 . A A . 23 ALA CA 1 1 20 10106 1 1 23 ALA CB C -2.284 1.262 5.170 1.00 . A A . 23 ALA CB 1 1 20 10107 1 1 23 ALA H H -2.409 2.481 2.654 1.00 . A A . 23 ALA H 1 1 20 10108 1 1 23 ALA HA H -0.254 1.486 4.485 1.00 . A A . 23 ALA HA 1 1 20 10109 1 1 23 ALA HB1 H -1.858 1.625 6.094 1.00 . A A . 23 ALA HB1 1 1 20 10110 1 1 23 ALA HB2 H -2.596 0.235 5.294 1.00 . A A . 23 ALA HB2 1 1 20 10111 1 1 23 ALA HB3 H -3.137 1.868 4.906 1.00 . A A . 23 ALA HB3 1 1 20 10112 1 1 23 ALA N N -1.624 2.531 3.242 1.00 . A A . 23 ALA N 1 1 20 10113 1 1 23 ALA O O -2.015 -0.004 2.239 1.00 . A A . 23 ALA O 1 1 20 10114 1 1 24 CYS C C -1.449 -3.153 3.246 1.00 . A A . 24 CYS C 1 1 20 10115 1 1 24 CYS CA C -0.430 -2.143 2.710 1.00 . A A . 24 CYS CA 1 1 20 10116 1 1 24 CYS CB C 0.988 -2.687 2.867 1.00 . A A . 24 CYS CB 1 1 20 10117 1 1 24 CYS H H 0.138 -0.791 4.292 1.00 . A A . 24 CYS H 1 1 20 10118 1 1 24 CYS HA H -0.626 -1.927 1.671 1.00 . A A . 24 CYS HA 1 1 20 10119 1 1 24 CYS HB2 H 1.352 -2.458 3.857 1.00 . A A . 24 CYS HB2 1 1 20 10120 1 1 24 CYS HB3 H 0.979 -3.757 2.725 1.00 . A A . 24 CYS HB3 1 1 20 10121 1 1 24 CYS N N -0.456 -0.888 3.518 1.00 . A A . 24 CYS N 1 1 20 10122 1 1 24 CYS O O -1.984 -2.996 4.328 1.00 . A A . 24 CYS O 1 1 20 10123 1 1 24 CYS SG S 2.068 -1.923 1.634 1.00 . A A . 24 CYS SG 1 1 20 10124 1 1 25 SER C C -2.136 -6.620 2.742 1.00 . A A . 25 SER C 1 1 20 10125 1 1 25 SER CA C -2.705 -5.211 2.940 1.00 . A A . 25 SER CA 1 1 20 10126 1 1 25 SER CB C -3.934 -4.994 2.057 1.00 . A A . 25 SER CB 1 1 20 10127 1 1 25 SER H H -1.275 -4.286 1.621 1.00 . A A . 25 SER H 1 1 20 10128 1 1 25 SER HA H -2.965 -5.053 3.974 1.00 . A A . 25 SER HA 1 1 20 10129 1 1 25 SER HB2 H -3.695 -5.251 1.037 1.00 . A A . 25 SER HB2 1 1 20 10130 1 1 25 SER HB3 H -4.738 -5.630 2.406 1.00 . A A . 25 SER HB3 1 1 20 10131 1 1 25 SER HG H -4.276 -3.266 1.231 1.00 . A A . 25 SER HG 1 1 20 10132 1 1 25 SER N N -1.720 -4.187 2.490 1.00 . A A . 25 SER N 1 1 20 10133 1 1 25 SER O O -2.112 -7.142 1.644 1.00 . A A . 25 SER O 1 1 20 10134 1 1 25 SER OG O -4.328 -3.629 2.117 1.00 . A A . 25 SER OG 1 1 20 10135 1 1 26 LYS C C -2.191 -9.622 3.281 1.00 . A A . 26 LYS C 1 1 20 10136 1 1 26 LYS CA C -1.107 -8.614 3.696 1.00 . A A . 26 LYS CA 1 1 20 10137 1 1 26 LYS CB C -0.590 -8.931 5.104 1.00 . A A . 26 LYS CB 1 1 20 10138 1 1 26 LYS CD C 0.429 -10.702 6.539 1.00 . A A . 26 LYS CD 1 1 20 10139 1 1 26 LYS CE C -0.404 -11.945 6.868 1.00 . A A . 26 LYS CE 1 1 20 10140 1 1 26 LYS CG C 0.156 -10.266 5.097 1.00 . A A . 26 LYS CG 1 1 20 10141 1 1 26 LYS H H -1.705 -6.789 4.676 1.00 . A A . 26 LYS H 1 1 20 10142 1 1 26 LYS HA H -0.289 -8.630 2.994 1.00 . A A . 26 LYS HA 1 1 20 10143 1 1 26 LYS HB2 H 0.080 -8.147 5.423 1.00 . A A . 26 LYS HB2 1 1 20 10144 1 1 26 LYS HB3 H -1.424 -8.991 5.787 1.00 . A A . 26 LYS HB3 1 1 20 10145 1 1 26 LYS HD2 H 1.478 -10.930 6.651 1.00 . A A . 26 LYS HD2 1 1 20 10146 1 1 26 LYS HD3 H 0.161 -9.902 7.214 1.00 . A A . 26 LYS HD3 1 1 20 10147 1 1 26 LYS HE2 H -1.194 -12.071 6.138 1.00 . A A . 26 LYS HE2 1 1 20 10148 1 1 26 LYS HE3 H 0.225 -12.822 6.896 1.00 . A A . 26 LYS HE3 1 1 20 10149 1 1 26 LYS HG2 H -0.448 -11.013 4.601 1.00 . A A . 26 LYS HG2 1 1 20 10150 1 1 26 LYS HG3 H 1.092 -10.154 4.573 1.00 . A A . 26 LYS HG3 1 1 20 10151 1 1 26 LYS HZ1 H -0.217 -11.444 8.884 1.00 . A A . 26 LYS HZ1 1 1 20 10152 1 1 26 LYS HZ2 H -1.473 -12.540 8.553 1.00 . A A . 26 LYS HZ2 1 1 20 10153 1 1 26 LYS HZ3 H -1.654 -10.896 8.165 1.00 . A A . 26 LYS HZ3 1 1 20 10154 1 1 26 LYS N N -1.676 -7.235 3.804 1.00 . A A . 26 LYS N 1 1 20 10155 1 1 26 LYS NZ N -0.981 -11.686 8.219 1.00 . A A . 26 LYS NZ 1 1 20 10156 1 1 26 LYS O O -1.913 -10.602 2.613 1.00 . A A . 26 LYS O 1 1 20 10157 1 1 27 THR C C -5.057 -10.039 1.902 1.00 . A A . 27 THR C 1 1 20 10158 1 1 27 THR CA C -4.528 -10.334 3.311 1.00 . A A . 27 THR CA 1 1 20 10159 1 1 27 THR CB C -5.627 -10.081 4.351 1.00 . A A . 27 THR CB 1 1 20 10160 1 1 27 THR CG2 C -6.759 -11.095 4.165 1.00 . A A . 27 THR CG2 1 1 20 10161 1 1 27 THR H H -3.615 -8.595 4.214 1.00 . A A . 27 THR H 1 1 20 10162 1 1 27 THR HA H -4.190 -11.353 3.378 1.00 . A A . 27 THR HA 1 1 20 10163 1 1 27 THR HB H -6.020 -9.083 4.220 1.00 . A A . 27 THR HB 1 1 20 10164 1 1 27 THR HG1 H -5.430 -9.503 6.197 1.00 . A A . 27 THR HG1 1 1 20 10165 1 1 27 THR HG21 H -6.377 -11.979 3.675 1.00 . A A . 27 THR HG21 1 1 20 10166 1 1 27 THR HG22 H -7.539 -10.657 3.559 1.00 . A A . 27 THR HG22 1 1 20 10167 1 1 27 THR HG23 H -7.163 -11.364 5.130 1.00 . A A . 27 THR HG23 1 1 20 10168 1 1 27 THR N N -3.420 -9.389 3.675 1.00 . A A . 27 THR N 1 1 20 10169 1 1 27 THR O O -5.426 -10.938 1.170 1.00 . A A . 27 THR O 1 1 20 10170 1 1 27 THR OG1 O -5.082 -10.214 5.656 1.00 . A A . 27 THR OG1 1 1 20 10171 1 1 28 TRP C C -4.536 -8.647 -0.891 1.00 . A A . 28 TRP C 1 1 20 10172 1 1 28 TRP CA C -5.623 -8.425 0.167 1.00 . A A . 28 TRP CA 1 1 20 10173 1 1 28 TRP CB C -5.992 -6.937 0.257 1.00 . A A . 28 TRP CB 1 1 20 10174 1 1 28 TRP CD1 C -7.688 -7.688 1.996 1.00 . A A . 28 TRP CD1 1 1 20 10175 1 1 28 TRP CD2 C -7.523 -5.448 1.851 1.00 . A A . 28 TRP CD2 1 1 20 10176 1 1 28 TRP CE2 C -8.488 -5.725 2.848 1.00 . A A . 28 TRP CE2 1 1 20 10177 1 1 28 TRP CE3 C -7.234 -4.102 1.565 1.00 . A A . 28 TRP CE3 1 1 20 10178 1 1 28 TRP CG C -7.026 -6.713 1.323 1.00 . A A . 28 TRP CG 1 1 20 10179 1 1 28 TRP CH2 C -8.845 -3.373 3.240 1.00 . A A . 28 TRP CH2 1 1 20 10180 1 1 28 TRP CZ2 C -9.142 -4.705 3.537 1.00 . A A . 28 TRP CZ2 1 1 20 10181 1 1 28 TRP CZ3 C -7.893 -3.072 2.256 1.00 . A A . 28 TRP CZ3 1 1 20 10182 1 1 28 TRP H H -4.808 -8.083 2.138 1.00 . A A . 28 TRP H 1 1 20 10183 1 1 28 TRP HA H -6.500 -9.008 -0.067 1.00 . A A . 28 TRP HA 1 1 20 10184 1 1 28 TRP HB2 H -5.108 -6.365 0.490 1.00 . A A . 28 TRP HB2 1 1 20 10185 1 1 28 TRP HB3 H -6.384 -6.611 -0.694 1.00 . A A . 28 TRP HB3 1 1 20 10186 1 1 28 TRP HD1 H -7.559 -8.750 1.851 1.00 . A A . 28 TRP HD1 1 1 20 10187 1 1 28 TRP HE1 H -9.141 -7.586 3.513 1.00 . A A . 28 TRP HE1 1 1 20 10188 1 1 28 TRP HE3 H -6.503 -3.859 0.808 1.00 . A A . 28 TRP HE3 1 1 20 10189 1 1 28 TRP HH2 H -9.348 -2.577 3.768 1.00 . A A . 28 TRP HH2 1 1 20 10190 1 1 28 TRP HZ2 H -9.876 -4.942 4.294 1.00 . A A . 28 TRP HZ2 1 1 20 10191 1 1 28 TRP HZ3 H -7.664 -2.041 2.027 1.00 . A A . 28 TRP HZ3 1 1 20 10192 1 1 28 TRP N N -5.106 -8.788 1.525 1.00 . A A . 28 TRP N 1 1 20 10193 1 1 28 TRP NE1 N -8.549 -7.101 2.901 1.00 . A A . 28 TRP NE1 1 1 20 10194 1 1 28 TRP O O -4.799 -9.169 -1.958 1.00 . A A . 28 TRP O 1 1 20 10195 1 1 29 GLY C C -1.870 -7.141 -2.293 1.00 . A A . 29 GLY C 1 1 20 10196 1 1 29 GLY CA C -2.206 -8.456 -1.574 1.00 . A A . 29 GLY CA 1 1 20 10197 1 1 29 GLY H H -3.137 -7.851 0.276 1.00 . A A . 29 GLY H 1 1 20 10198 1 1 29 GLY HA2 H -1.331 -8.807 -1.046 1.00 . A A . 29 GLY HA2 1 1 20 10199 1 1 29 GLY HA3 H -2.499 -9.195 -2.305 1.00 . A A . 29 GLY HA3 1 1 20 10200 1 1 29 GLY N N -3.320 -8.262 -0.597 1.00 . A A . 29 GLY N 1 1 20 10201 1 1 29 GLY O O -1.217 -7.149 -3.320 1.00 . A A . 29 GLY O 1 1 20 10202 1 1 30 TRP C C -1.899 -3.574 -1.412 1.00 . A A . 30 TRP C 1 1 20 10203 1 1 30 TRP CA C -1.984 -4.715 -2.442 1.00 . A A . 30 TRP CA 1 1 20 10204 1 1 30 TRP CB C -3.119 -4.499 -3.460 1.00 . A A . 30 TRP CB 1 1 20 10205 1 1 30 TRP CD1 C -4.614 -2.920 -2.166 1.00 . A A . 30 TRP CD1 1 1 20 10206 1 1 30 TRP CD2 C -5.635 -4.860 -2.663 1.00 . A A . 30 TRP CD2 1 1 20 10207 1 1 30 TRP CE2 C -6.572 -4.075 -1.952 1.00 . A A . 30 TRP CE2 1 1 20 10208 1 1 30 TRP CE3 C -6.032 -6.139 -3.099 1.00 . A A . 30 TRP CE3 1 1 20 10209 1 1 30 TRP CG C -4.394 -4.104 -2.781 1.00 . A A . 30 TRP CG 1 1 20 10210 1 1 30 TRP CH2 C -8.239 -5.812 -2.122 1.00 . A A . 30 TRP CH2 1 1 20 10211 1 1 30 TRP CZ2 C -7.860 -4.543 -1.681 1.00 . A A . 30 TRP CZ2 1 1 20 10212 1 1 30 TRP CZ3 C -7.328 -6.610 -2.829 1.00 . A A . 30 TRP CZ3 1 1 20 10213 1 1 30 TRP H H -2.819 -6.022 -0.940 1.00 . A A . 30 TRP H 1 1 20 10214 1 1 30 TRP HA H -1.048 -4.795 -2.969 1.00 . A A . 30 TRP HA 1 1 20 10215 1 1 30 TRP HB2 H -2.835 -3.721 -4.149 1.00 . A A . 30 TRP HB2 1 1 20 10216 1 1 30 TRP HB3 H -3.280 -5.414 -4.010 1.00 . A A . 30 TRP HB3 1 1 20 10217 1 1 30 TRP HD1 H -3.896 -2.119 -2.071 1.00 . A A . 30 TRP HD1 1 1 20 10218 1 1 30 TRP HE1 H -6.300 -2.162 -1.179 1.00 . A A . 30 TRP HE1 1 1 20 10219 1 1 30 TRP HE3 H -5.335 -6.763 -3.642 1.00 . A A . 30 TRP HE3 1 1 20 10220 1 1 30 TRP HH2 H -9.234 -6.179 -1.916 1.00 . A A . 30 TRP HH2 1 1 20 10221 1 1 30 TRP HZ2 H -8.559 -3.925 -1.137 1.00 . A A . 30 TRP HZ2 1 1 20 10222 1 1 30 TRP HZ3 H -7.625 -7.592 -3.167 1.00 . A A . 30 TRP HZ3 1 1 20 10223 1 1 30 TRP N N -2.300 -6.015 -1.771 1.00 . A A . 30 TRP N 1 1 20 10224 1 1 30 TRP NE1 N -5.899 -2.905 -1.670 1.00 . A A . 30 TRP NE1 1 1 20 10225 1 1 30 TRP O O -2.097 -3.777 -0.231 1.00 . A A . 30 TRP O 1 1 20 10226 1 1 31 CYS C C -2.503 -0.129 -1.343 1.00 . A A . 31 CYS C 1 1 20 10227 1 1 31 CYS CA C -1.501 -1.212 -0.930 1.00 . A A . 31 CYS CA 1 1 20 10228 1 1 31 CYS CB C -0.068 -0.692 -1.082 1.00 . A A . 31 CYS CB 1 1 20 10229 1 1 31 CYS H H -1.457 -2.248 -2.819 1.00 . A A . 31 CYS H 1 1 20 10230 1 1 31 CYS HA H -1.675 -1.524 0.092 1.00 . A A . 31 CYS HA 1 1 20 10231 1 1 31 CYS HB2 H 0.626 -1.514 -1.004 1.00 . A A . 31 CYS HB2 1 1 20 10232 1 1 31 CYS HB3 H 0.043 -0.215 -2.045 1.00 . A A . 31 CYS HB3 1 1 20 10233 1 1 31 CYS N N -1.604 -2.380 -1.862 1.00 . A A . 31 CYS N 1 1 20 10234 1 1 31 CYS O O -2.638 0.187 -2.511 1.00 . A A . 31 CYS O 1 1 20 10235 1 1 31 CYS SG S 0.285 0.512 0.223 1.00 . A A . 31 CYS SG 1 1 20 10236 1 1 32 ALA C C -4.247 2.556 0.390 1.00 . A A . 32 ALA C 1 1 20 10237 1 1 32 ALA CA C -4.193 1.510 -0.730 1.00 . A A . 32 ALA CA 1 1 20 10238 1 1 32 ALA CB C -5.535 0.781 -0.855 1.00 . A A . 32 ALA CB 1 1 20 10239 1 1 32 ALA H H -3.072 0.175 0.539 1.00 . A A . 32 ALA H 1 1 20 10240 1 1 32 ALA HA H -3.941 1.978 -1.667 1.00 . A A . 32 ALA HA 1 1 20 10241 1 1 32 ALA HB1 H -5.648 0.093 -0.032 1.00 . A A . 32 ALA HB1 1 1 20 10242 1 1 32 ALA HB2 H -5.561 0.234 -1.787 1.00 . A A . 32 ALA HB2 1 1 20 10243 1 1 32 ALA HB3 H -6.339 1.501 -0.838 1.00 . A A . 32 ALA HB3 1 1 20 10244 1 1 32 ALA N N -3.201 0.445 -0.395 1.00 . A A . 32 ALA N 1 1 20 10245 1 1 32 ALA O O -3.542 2.456 1.374 1.00 . A A . 32 ALA O 1 1 20 10246 1 1 33 VAL C C -5.949 4.057 2.516 1.00 . A A . 33 VAL C 1 1 20 10247 1 1 33 VAL CA C -5.180 4.608 1.309 1.00 . A A . 33 VAL CA 1 1 20 10248 1 1 33 VAL CB C -5.939 5.779 0.672 1.00 . A A . 33 VAL CB 1 1 20 10249 1 1 33 VAL CG1 C -5.833 7.008 1.583 1.00 . A A . 33 VAL CG1 1 1 20 10250 1 1 33 VAL CG2 C -5.333 6.115 -0.694 1.00 . A A . 33 VAL CG2 1 1 20 10251 1 1 33 VAL H H -5.644 3.614 -0.555 1.00 . A A . 33 VAL H 1 1 20 10252 1 1 33 VAL HA H -4.193 4.929 1.609 1.00 . A A . 33 VAL HA 1 1 20 10253 1 1 33 VAL HB H -6.979 5.511 0.552 1.00 . A A . 33 VAL HB 1 1 20 10254 1 1 33 VAL HG11 H -6.700 7.060 2.221 1.00 . A A . 33 VAL HG11 1 1 20 10255 1 1 33 VAL HG12 H -5.778 7.901 0.975 1.00 . A A . 33 VAL HG12 1 1 20 10256 1 1 33 VAL HG13 H -4.943 6.932 2.188 1.00 . A A . 33 VAL HG13 1 1 20 10257 1 1 33 VAL HG21 H -5.886 5.605 -1.468 1.00 . A A . 33 VAL HG21 1 1 20 10258 1 1 33 VAL HG22 H -4.302 5.794 -0.718 1.00 . A A . 33 VAL HG22 1 1 20 10259 1 1 33 VAL HG23 H -5.381 7.181 -0.859 1.00 . A A . 33 VAL HG23 1 1 20 10260 1 1 33 VAL N N -5.081 3.556 0.247 1.00 . A A . 33 VAL N 1 1 20 10261 1 1 33 VAL O O -6.790 3.188 2.382 1.00 . A A . 33 VAL O 1 1 20 10262 1 1 34 GLU C C -7.850 4.493 4.899 1.00 . A A . 34 GLU C 1 1 20 10263 1 1 34 GLU CA C -6.375 4.066 4.916 1.00 . A A . 34 GLU CA 1 1 20 10264 1 1 34 GLU CB C -5.644 4.713 6.095 1.00 . A A . 34 GLU CB 1 1 20 10265 1 1 34 GLU CD C -3.628 4.553 7.567 1.00 . A A . 34 GLU CD 1 1 20 10266 1 1 34 GLU CG C -4.264 4.071 6.261 1.00 . A A . 34 GLU CG 1 1 20 10267 1 1 34 GLU H H -4.981 5.259 3.772 1.00 . A A . 34 GLU H 1 1 20 10268 1 1 34 GLU HA H -6.299 2.993 4.984 1.00 . A A . 34 GLU HA 1 1 20 10269 1 1 34 GLU HB2 H -5.530 5.772 5.908 1.00 . A A . 34 GLU HB2 1 1 20 10270 1 1 34 GLU HB3 H -6.218 4.568 6.998 1.00 . A A . 34 GLU HB3 1 1 20 10271 1 1 34 GLU HG2 H -4.368 2.996 6.285 1.00 . A A . 34 GLU HG2 1 1 20 10272 1 1 34 GLU HG3 H -3.633 4.351 5.432 1.00 . A A . 34 GLU HG3 1 1 20 10273 1 1 34 GLU N N -5.664 4.559 3.693 1.00 . A A . 34 GLU N 1 1 20 10274 1 1 34 GLU O O -8.695 3.847 5.487 1.00 . A A . 34 GLU O 1 1 20 10275 1 1 34 GLU OE1 O -2.955 5.569 7.534 1.00 . A A . 34 GLU OE1 1 1 20 10276 1 1 34 GLU OE2 O -3.826 3.895 8.578 1.00 . A A . 34 GLU OE2 1 1 20 10277 1 1 35 ALA C C -10.455 5.030 3.420 1.00 . A A . 35 ALA C 1 1 20 10278 1 1 35 ALA CA C -9.581 6.048 4.168 1.00 . A A . 35 ALA CA 1 1 20 10279 1 1 35 ALA CB C -9.529 7.371 3.398 1.00 . A A . 35 ALA CB 1 1 20 10280 1 1 35 ALA H H -7.463 6.078 3.762 1.00 . A A . 35 ALA H 1 1 20 10281 1 1 35 ALA HA H -9.963 6.217 5.162 1.00 . A A . 35 ALA HA 1 1 20 10282 1 1 35 ALA HB1 H -9.044 7.213 2.446 1.00 . A A . 35 ALA HB1 1 1 20 10283 1 1 35 ALA HB2 H -8.972 8.098 3.969 1.00 . A A . 35 ALA HB2 1 1 20 10284 1 1 35 ALA HB3 H -10.533 7.733 3.234 1.00 . A A . 35 ALA HB3 1 1 20 10285 1 1 35 ALA N N -8.163 5.576 4.226 1.00 . A A . 35 ALA N 1 1 20 10286 1 1 35 ALA O O -9.980 4.329 2.547 1.00 . A A . 35 ALA O 1 1 20 10287 1 1 36 PRO C C -12.993 4.488 1.716 1.00 . A A . 36 PRO C 1 1 20 10288 1 1 36 PRO CA C -12.668 4.043 3.149 1.00 . A A . 36 PRO CA 1 1 20 10289 1 1 36 PRO CB C -13.905 4.123 4.041 1.00 . A A . 36 PRO CB 1 1 20 10290 1 1 36 PRO CD C -12.359 5.796 4.834 1.00 . A A . 36 PRO CD 1 1 20 10291 1 1 36 PRO CG C -13.821 5.461 4.702 1.00 . A A . 36 PRO CG 1 1 20 10292 1 1 36 PRO HA H -12.274 3.041 3.156 1.00 . A A . 36 PRO HA 1 1 20 10293 1 1 36 PRO HB2 H -14.803 4.049 3.445 1.00 . A A . 36 PRO HB2 1 1 20 10294 1 1 36 PRO HB3 H -13.883 3.341 4.785 1.00 . A A . 36 PRO HB3 1 1 20 10295 1 1 36 PRO HD2 H -12.195 6.850 4.655 1.00 . A A . 36 PRO HD2 1 1 20 10296 1 1 36 PRO HD3 H -11.991 5.512 5.808 1.00 . A A . 36 PRO HD3 1 1 20 10297 1 1 36 PRO HG2 H -14.321 6.204 4.094 1.00 . A A . 36 PRO HG2 1 1 20 10298 1 1 36 PRO HG3 H -14.274 5.418 5.681 1.00 . A A . 36 PRO HG3 1 1 20 10299 1 1 36 PRO N N -11.712 4.984 3.792 1.00 . A A . 36 PRO N 1 1 20 10300 1 1 36 PRO O O -13.170 3.619 0.876 1.00 . A A . 36 PRO O 1 1 stop_ save_
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