NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
570755 | 2mhw | 19658 | cing | 4-filtered-FRED | STAR | entry | full | 317 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2mhw # This FRED archive file contains, for PDB entry <2mhw>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2mhw _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2mhw _Assembly.Number_of_components 1 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "not present" _Assembly.Molecular_mass 2616.13 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 $Antimicrobial_peptide A . 1 1 stop_ save_ save_Antimicrobial_peptide _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Antimicrobial peptide" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GIGGVLLSAGKAALKGLAKVLAEKYAN _Entity.Number_of_monomers 27 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 ILE . 1 1 3 GLY . 1 1 4 GLY . 1 1 5 VAL . 1 1 6 LEU . 1 1 7 LEU . 1 1 8 SER . 1 1 9 ALA . 1 1 10 GLY . 1 1 11 LYS . 1 1 12 ALA . 1 1 13 ALA . 1 1 14 LEU . 1 1 15 LYS . 1 1 16 GLY . 1 1 17 LEU . 1 1 18 ALA . 1 1 19 LYS . 1 1 20 VAL . 1 1 21 LEU . 1 1 22 ALA . 1 1 23 GLU . 1 1 24 LYS . 1 1 25 TYR . 1 1 26 ALA . 1 1 27 ASN . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 ILE 2 2 1 1 GLY 3 3 1 1 GLY 4 4 1 1 VAL 5 5 1 1 LEU 6 6 1 1 LEU 7 7 1 1 SER 8 8 1 1 ALA 9 9 1 1 GLY 10 10 1 1 LYS 11 11 1 1 ALA 12 12 1 1 ALA 13 13 1 1 LEU 14 14 1 1 LYS 15 15 1 1 GLY 16 16 1 1 LEU 17 17 1 1 ALA 18 18 1 1 LYS 19 19 1 1 VAL 20 20 1 1 LEU 21 21 1 1 ALA 22 22 1 1 GLU 23 23 1 1 LYS 24 24 1 1 TYR 25 25 1 1 ALA 26 26 1 1 ASN 27 27 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 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 GLY HA3 . 1 . HA2 1 1 1 1 2 1 1 2 ILE H . 2 . HN 1 1 2 1 1 1 1 1 GLY HA3 . 1 . HA2 1 1 2 1 2 1 1 5 VAL MG1 . 5 . HG11 1 1 3 1 1 1 1 2 ILE H . 2 . HN 1 1 3 1 2 1 1 2 ILE HA . 2 . HA 1 1 4 1 1 1 1 2 ILE H . 2 . HN 1 1 4 1 2 1 1 2 ILE HB . 2 . HB 1 1 5 1 1 1 1 2 ILE H . 2 . HN 1 1 5 1 2 1 1 2 ILE HG13 . 2 . HG12 1 1 6 1 1 1 1 2 ILE H . 2 . HN 1 1 6 1 2 1 1 2 ILE MG . 2 . HG21 1 1 7 1 1 1 1 2 ILE H . 2 . HN 1 1 7 1 2 1 1 3 GLY H . 3 . HN 1 1 8 1 1 1 1 2 ILE H . 2 . HN 1 1 8 1 2 1 1 3 GLY HA2 . 3 . HA2 1 1 9 1 1 1 1 2 ILE H . 2 . HN 1 1 9 1 2 1 1 5 VAL MG1 . 5 . HG11 1 1 10 1 1 1 1 2 ILE H . 2 . HN 1 1 10 1 2 1 1 6 LEU H . 6 . HN 1 1 11 1 1 1 1 2 ILE H . 2 . HN 1 1 11 1 2 1 1 7 LEU HG . 7 . HG 1 1 12 1 1 1 1 2 ILE HB . 2 . HB 1 1 12 1 2 1 1 5 VAL MG1 . 5 . HG11 1 1 13 1 1 1 1 2 ILE HG13 . 2 . HG12 1 1 13 1 2 1 1 5 VAL MG1 . 5 . HG11 1 1 14 1 1 1 1 2 ILE MG . 2 . HG21 1 1 14 1 2 1 1 3 GLY H . 3 . HN 1 1 15 1 1 1 1 2 ILE MG . 2 . HG21 1 1 15 1 2 1 1 3 GLY HA2 . 3 . HA2 1 1 16 1 1 1 1 2 ILE MG . 2 . HG21 1 1 16 1 2 1 1 4 GLY H . 4 . HN 1 1 17 1 1 1 1 3 GLY H . 3 . HN 1 1 17 1 2 1 1 3 GLY HA2 . 3 . HA2 1 1 18 1 1 1 1 3 GLY H . 3 . HN 1 1 18 1 2 1 1 4 GLY H . 4 . HN 1 1 19 1 1 1 1 3 GLY H . 3 . HN 1 1 19 1 2 1 1 7 LEU HG . 7 . HG 1 1 20 1 1 1 1 3 GLY HA2 . 3 . HA2 1 1 20 1 2 1 1 7 LEU H . 7 . HN 1 1 21 1 1 1 1 4 GLY H . 4 . HN 1 1 21 1 2 1 1 4 GLY HA2 . 4 . HA1 1 1 22 1 1 1 1 4 GLY H . 4 . HN 1 1 22 1 2 1 1 4 GLY HA3 . 4 . HA2 1 1 23 1 1 1 1 4 GLY H . 4 . HN 1 1 23 1 2 1 1 5 VAL H . 5 . HN 1 1 24 1 1 1 1 4 GLY HA2 . 4 . HA1 1 1 24 1 2 1 1 5 VAL H . 5 . HN 1 1 25 1 1 1 1 4 GLY HA3 . 4 . HA2 1 1 25 1 2 1 1 5 VAL H . 5 . HN 1 1 26 1 1 1 1 5 VAL C . 5 . C 1 1 26 1 2 1 1 7 LEU H . 7 . HN 1 1 27 1 1 1 1 5 VAL H . 5 . HN 1 1 27 1 2 1 1 5 VAL HA . 5 . HA 1 1 28 1 1 1 1 5 VAL H . 5 . HN 1 1 28 1 2 1 1 5 VAL HB . 5 . HB 1 1 29 1 1 1 1 5 VAL H . 5 . HN 1 1 29 1 2 1 1 5 VAL MG1 . 5 . HG11 1 1 30 1 1 1 1 5 VAL H . 5 . HN 1 1 30 1 2 1 1 6 LEU H . 6 . HN 1 1 31 1 1 1 1 5 VAL H . 5 . HN 1 1 31 1 2 1 1 6 LEU MD1 . 6 . HD11 1 1 32 1 1 1 1 5 VAL H . 5 . HN 1 1 32 1 2 1 1 7 LEU H . 7 . HN 1 1 33 1 1 1 1 5 VAL H . 5 . HN 1 1 33 1 2 1 1 7 LEU HB2 . 7 . HB1 1 1 34 1 1 1 1 5 VAL H . 5 . HN 1 1 34 1 2 1 1 7 LEU HG . 7 . HG 1 1 35 1 1 1 1 5 VAL HA . 5 . HA 1 1 35 1 2 1 1 5 VAL HB . 5 . HB 1 1 36 1 1 1 1 5 VAL HA . 5 . HA 1 1 36 1 2 1 1 5 VAL MG1 . 5 . HG11 1 1 37 1 1 1 1 5 VAL HA . 5 . HA 1 1 37 1 2 1 1 5 VAL MG2 . 5 . HG21 1 1 38 1 1 1 1 5 VAL HA . 5 . HA 1 1 38 1 2 1 1 7 LEU H . 7 . HN 1 1 39 1 1 1 1 5 VAL HB . 5 . HB 1 1 39 1 2 1 1 5 VAL MG1 . 5 . HG11 1 1 40 1 1 1 1 5 VAL HB . 5 . HB 1 1 40 1 2 1 1 5 VAL MG2 . 5 . HG21 1 1 41 1 1 1 1 5 VAL HB . 5 . HB 1 1 41 1 2 1 1 6 LEU H . 6 . HN 1 1 42 1 1 1 1 5 VAL MG1 . 5 . HG11 1 1 42 1 2 1 1 5 VAL MG2 . 5 . HG21 1 1 43 1 1 1 1 5 VAL MG1 . 5 . HG11 1 1 43 1 2 1 1 7 LEU H . 7 . HN 1 1 44 1 1 1 1 5 VAL MG1 . 5 . HG11 1 1 44 1 2 1 1 7 LEU HB2 . 7 . HB1 1 1 45 1 1 1 1 5 VAL MG1 . 5 . HG11 1 1 45 1 2 1 1 7 LEU HG . 7 . HG 1 1 46 1 1 1 1 5 VAL MG1 . 5 . HG11 1 1 46 1 2 1 1 8 SER H . 8 . HN 1 1 47 1 1 1 1 5 VAL MG2 . 5 . HG21 1 1 47 1 2 1 1 6 LEU H . 6 . HN 1 1 48 1 1 1 1 5 VAL MG2 . 5 . HG21 1 1 48 1 2 1 1 7 LEU H . 7 . HN 1 1 49 1 1 1 1 6 LEU H . 6 . HN 1 1 49 1 2 1 1 6 LEU MD1 . 6 . HD11 1 1 50 1 1 1 1 6 LEU H . 6 . HN 1 1 50 1 2 1 1 8 SER H . 8 . HN 1 1 51 1 1 1 1 6 LEU H . 6 . HN 1 1 51 1 2 1 1 10 GLY H . 10 . HN 1 1 52 1 1 1 1 6 LEU HA . 6 . HA 1 1 52 1 2 1 1 6 LEU HB2 . 6 . HB1 1 1 53 1 1 1 1 6 LEU HA . 6 . HA 1 1 53 1 2 1 1 6 LEU HB3 . 6 . HB2 1 1 54 1 1 1 1 6 LEU HB2 . 6 . HB1 1 1 54 1 2 1 1 7 LEU H . 7 . HN 1 1 55 1 1 1 1 6 LEU HB3 . 6 . HB2 1 1 55 1 2 1 1 6 LEU HG . 6 . HG 1 1 56 1 1 1 1 6 LEU MD2 . 6 . HD21 1 1 56 1 2 1 1 6 LEU HG . 6 . HG 1 1 57 1 1 1 1 6 LEU MD2 . 6 . HD21 1 1 57 1 2 1 1 7 LEU H . 7 . HN 1 1 58 1 1 1 1 6 LEU MD2 . 6 . HD21 1 1 58 1 2 1 1 10 GLY H . 10 . HN 1 1 59 1 1 1 1 7 LEU H . 7 . HN 1 1 59 1 2 1 1 7 LEU HB2 . 7 . HB1 1 1 60 1 1 1 1 7 LEU H . 7 . HN 1 1 60 1 2 1 1 7 LEU HB3 . 7 . HB2 1 1 61 1 1 1 1 7 LEU H . 7 . HN 1 1 61 1 2 1 1 7 LEU MD2 . 7 . HD21 1 1 62 1 1 1 1 7 LEU H . 7 . HN 1 1 62 1 2 1 1 7 LEU HG . 7 . HG 1 1 63 1 1 1 1 7 LEU H . 7 . HN 1 1 63 1 2 1 1 9 ALA MB . 9 . HB1 1 1 64 1 1 1 1 7 LEU HA . 7 . HA 1 1 64 1 2 1 1 7 LEU MD2 . 7 . HD21 1 1 65 1 1 1 1 7 LEU HB2 . 7 . HB1 1 1 65 1 2 1 1 7 LEU MD2 . 7 . HD21 1 1 66 1 1 1 1 7 LEU MD1 . 7 . HD11 1 1 66 1 2 1 1 8 SER HA . 8 . HA 1 1 67 1 1 1 1 7 LEU MD1 . 7 . HD11 1 1 67 1 2 1 1 10 GLY H . 10 . HN 1 1 68 1 1 1 1 7 LEU MD1 . 7 . HD11 1 1 68 1 2 1 1 11 LYS QE . 11 . HE2 1 1 69 1 1 1 1 7 LEU MD2 . 7 . HD21 1 1 69 1 2 1 1 7 LEU HG . 7 . HG 1 1 70 1 1 1 1 7 LEU MD2 . 7 . HD21 1 1 70 1 2 1 1 8 SER H . 8 . HN 1 1 71 1 1 1 1 7 LEU MD2 . 7 . HD21 1 1 71 1 2 1 1 10 GLY H . 10 . HN 1 1 72 1 1 1 1 8 SER H . 8 . HN 1 1 72 1 2 1 1 8 SER HA . 8 . HA 1 1 73 1 1 1 1 8 SER H . 8 . HN 1 1 73 1 2 1 1 9 ALA H . 9 . HN 1 1 74 1 1 1 1 8 SER H . 8 . HN 1 1 74 1 2 1 1 9 ALA MB . 9 . HB1 1 1 75 1 1 1 1 8 SER H . 8 . HN 1 1 75 1 2 1 1 10 GLY H . 10 . HN 1 1 76 1 1 1 1 8 SER H . 8 . HN 1 1 76 1 2 1 1 10 GLY QA . 10 . HA2 1 1 77 1 1 1 1 8 SER H . 8 . HN 1 1 77 1 2 1 1 11 LYS QD . 11 . HD2 1 1 78 1 1 1 1 8 SER H . 8 . HN 1 1 78 1 2 1 1 11 LYS QE . 11 . HE2 1 1 79 1 1 1 1 8 SER HA . 8 . HA 1 1 79 1 2 1 1 10 GLY QA . 10 . HA1 1 1 80 1 1 1 1 8 SER HB2 . 8 . HB2 1 1 80 1 2 1 1 11 LYS HG2 . 11 . HG1 1 1 81 1 1 1 1 8 SER HB2 . 8 . HB2 1 1 81 1 2 1 1 14 LEU QD . 14 . HD21 1 1 82 1 1 1 1 8 SER HB3 . 8 . HB1 1 1 82 1 2 1 1 11 LYS HG2 . 11 . HG1 1 1 83 1 1 1 1 9 ALA H . 9 . HN 1 1 83 1 2 1 1 9 ALA HA . 9 . HA 1 1 84 1 1 1 1 9 ALA H . 9 . HN 1 1 84 1 2 1 1 9 ALA MB . 9 . HB1 1 1 85 1 1 1 1 9 ALA H . 9 . HN 1 1 85 1 2 1 1 10 GLY H . 10 . HN 1 1 86 1 1 1 1 9 ALA HA . 9 . HA 1 1 86 1 2 1 1 9 ALA MB . 9 . HB1 1 1 87 1 1 1 1 9 ALA HA . 9 . HA 1 1 87 1 2 1 1 10 GLY H . 10 . HN 1 1 88 1 1 1 1 9 ALA MB . 9 . HB1 1 1 88 1 2 1 1 10 GLY H . 10 . HN 1 1 89 1 1 1 1 9 ALA MB . 9 . HB1 1 1 89 1 2 1 1 10 GLY QA . 10 . HA1 1 1 90 1 1 1 1 10 GLY H . 10 . HN 1 1 90 1 2 1 1 10 GLY QA . 10 . HA2 1 1 91 1 1 1 1 10 GLY H . 10 . HN 1 1 91 1 2 1 1 11 LYS H . 11 . HN 1 1 92 1 1 1 1 10 GLY H . 10 . HN 1 1 92 1 2 1 1 11 LYS QB . 11 . HB2 1 1 93 1 1 1 1 10 GLY H . 10 . HN 1 1 93 1 2 1 1 13 ALA H . 13 . HN 1 1 94 1 1 1 1 10 GLY QA . 10 . HA1 1 1 94 1 2 1 1 11 LYS H . 11 . HN 1 1 95 1 1 1 1 10 GLY QA . 10 . HA1 1 1 95 1 2 1 1 11 LYS QB . 11 . HB2 1 1 96 1 1 1 1 10 GLY QA . 10 . HA2 1 1 96 1 2 1 1 11 LYS QD . 11 . HD2 1 1 97 1 1 1 1 10 GLY QA . 10 . HA2 1 1 97 1 2 1 1 14 LEU QD . 14 . HD11 1 1 98 1 1 1 1 11 LYS H . 11 . HN 1 1 98 1 2 1 1 11 LYS HA . 11 . HA 1 1 99 1 1 1 1 11 LYS H . 11 . HN 1 1 99 1 2 1 1 11 LYS QD . 11 . HD2 1 1 100 1 1 1 1 11 LYS H . 11 . HN 1 1 100 1 2 1 1 11 LYS QE . 11 . HE2 1 1 101 1 1 1 1 11 LYS H . 11 . HN 1 1 101 1 2 1 1 11 LYS HG3 . 11 . HG2 1 1 102 1 1 1 1 11 LYS HA . 11 . HA 1 1 102 1 2 1 1 11 LYS QB . 11 . HB2 1 1 103 1 1 1 1 11 LYS HA . 11 . HA 1 1 103 1 2 1 1 11 LYS QD . 11 . HD2 1 1 104 1 1 1 1 11 LYS HA . 11 . HA 1 1 104 1 2 1 1 11 LYS HG3 . 11 . HG2 1 1 105 1 1 1 1 11 LYS HA . 11 . HA 1 1 105 1 2 1 1 12 ALA HA . 12 . HA 1 1 106 1 1 1 1 11 LYS HA . 11 . HA 1 1 106 1 2 1 1 13 ALA H . 13 . HN 1 1 107 1 1 1 1 11 LYS QB . 11 . HB2 1 1 107 1 2 1 1 11 LYS QD . 11 . HD2 1 1 108 1 1 1 1 11 LYS QB . 11 . HB2 1 1 108 1 2 1 1 11 LYS QE . 11 . HE2 1 1 109 1 1 1 1 11 LYS QB . 11 . HB1 1 1 109 1 2 1 1 11 LYS HG3 . 11 . HG2 1 1 110 1 1 1 1 11 LYS QB . 11 . HB2 1 1 110 1 2 1 1 12 ALA HA . 12 . HA 1 1 111 1 1 1 1 11 LYS QD . 11 . HD2 1 1 111 1 2 1 1 11 LYS QE . 11 . HE2 1 1 112 1 1 1 1 11 LYS QE . 11 . HE2 1 1 112 1 2 1 1 11 LYS HG3 . 11 . HG2 1 1 113 1 1 1 1 11 LYS QE . 11 . HE2 1 1 113 1 2 1 1 13 ALA H . 13 . HN 1 1 114 1 1 1 1 12 ALA H . 12 . HN 1 1 114 1 2 1 1 12 ALA HA . 12 . HA 1 1 115 1 1 1 1 12 ALA H . 12 . HN 1 1 115 1 2 1 1 13 ALA H . 13 . HN 1 1 116 1 1 1 1 12 ALA HA . 12 . HA 1 1 116 1 2 1 1 13 ALA H . 13 . HN 1 1 117 1 1 1 1 12 ALA MB . 12 . HB2 1 1 117 1 2 1 1 13 ALA HA . 13 . HA 1 1 118 1 1 1 1 13 ALA H . 13 . HN 1 1 118 1 2 1 1 13 ALA HA . 13 . HA 1 1 119 1 1 1 1 13 ALA H . 13 . HN 1 1 119 1 2 1 1 13 ALA MB . 13 . HB1 1 1 120 1 1 1 1 13 ALA H . 13 . HN 1 1 120 1 2 1 1 14 LEU H . 14 . HN 1 1 121 1 1 1 1 13 ALA H . 13 . HN 1 1 121 1 2 1 1 15 LYS QG . 15 . HG2 1 1 122 1 1 1 1 13 ALA H . 13 . HN 1 1 122 1 2 1 1 17 LEU HB2 . 17 . HB2 1 1 123 1 1 1 1 13 ALA MB . 13 . HB1 1 1 123 1 2 1 1 18 ALA HA . 18 . HA 1 1 124 1 1 1 1 14 LEU H . 14 . HN 1 1 124 1 2 1 1 14 LEU HA . 14 . HA 1 1 125 1 1 1 1 14 LEU H . 14 . HN 1 1 125 1 2 1 1 14 LEU HB2 . 14 . HB2 1 1 126 1 1 1 1 14 LEU H . 14 . HN 1 1 126 1 2 1 1 14 LEU QD . 14 . HD11 1 1 127 1 1 1 1 14 LEU QD . 14 . HD21 1 1 127 1 2 1 1 15 LYS QG . 15 . HG2 1 1 128 1 1 1 1 15 LYS H . 15 . HN 1 1 128 1 2 1 1 15 LYS HA . 15 . HA 1 1 129 1 1 1 1 15 LYS H . 15 . HN 1 1 129 1 2 1 1 15 LYS HB2 . 15 . HB2 1 1 130 1 1 1 1 15 LYS H . 15 . HN 1 1 130 1 2 1 1 15 LYS QD . 15 . HD2 1 1 131 1 1 1 1 15 LYS H . 15 . HN 1 1 131 1 2 1 1 15 LYS QG . 15 . HG2 1 1 132 1 1 1 1 15 LYS H . 15 . HN 1 1 132 1 2 1 1 16 GLY H . 16 . HN 1 1 133 1 1 1 1 15 LYS HA . 15 . HA 1 1 133 1 2 1 1 15 LYS HB2 . 15 . HB2 1 1 134 1 1 1 1 15 LYS HA . 15 . HA 1 1 134 1 2 1 1 15 LYS HB3 . 15 . HB1 1 1 135 1 1 1 1 15 LYS HA . 15 . HA 1 1 135 1 2 1 1 15 LYS QD . 15 . HD2 1 1 136 1 1 1 1 15 LYS HA . 15 . HA 1 1 136 1 2 1 1 15 LYS HE3 . 15 . HE2 1 1 137 1 1 1 1 15 LYS HA . 15 . HA 1 1 137 1 2 1 1 15 LYS QG . 15 . HG2 1 1 138 1 1 1 1 15 LYS HB2 . 15 . HB2 1 1 138 1 2 1 1 15 LYS QG . 15 . HG2 1 1 139 1 1 1 1 15 LYS HB3 . 15 . HB1 1 1 139 1 2 1 1 16 GLY QA . 16 . HA1 1 1 140 1 1 1 1 15 LYS QD . 15 . HD2 1 1 140 1 2 1 1 15 LYS QG . 15 . HG2 1 1 141 1 1 1 1 15 LYS HE3 . 15 . HE2 1 1 141 1 2 1 1 15 LYS QG . 15 . HG2 1 1 142 1 1 1 1 16 GLY H . 16 . HN 1 1 142 1 2 1 1 16 GLY QA . 16 . HA2 1 1 143 1 1 1 1 16 GLY H . 16 . HN 1 1 143 1 2 1 1 17 LEU H . 17 . HN 1 1 144 1 1 1 1 16 GLY H . 16 . HN 1 1 144 1 2 1 1 18 ALA H . 18 . HN 1 1 145 1 1 1 1 16 GLY H . 16 . HN 1 1 145 1 2 1 1 20 VAL QG . 20 . HG11 1 1 146 1 1 1 1 16 GLY QA . 16 . HA1 1 1 146 1 2 1 1 17 LEU HB2 . 17 . HB2 1 1 147 1 1 1 1 16 GLY QA . 16 . HA1 1 1 147 1 2 1 1 17 LEU QD . 17 . HD11 1 1 148 1 1 1 1 16 GLY QA . 16 . HA1 1 1 148 1 2 1 1 18 ALA H . 18 . HN 1 1 149 1 1 1 1 16 GLY QA . 16 . HA1 1 1 149 1 2 1 1 19 LYS H . 19 . HN 1 1 150 1 1 1 1 16 GLY QA . 16 . HA1 1 1 150 1 2 1 1 19 LYS QB . 19 . HB2 1 1 151 1 1 1 1 17 LEU H . 17 . HN 1 1 151 1 2 1 1 17 LEU HA . 17 . HA 1 1 152 1 1 1 1 17 LEU H . 17 . HN 1 1 152 1 2 1 1 17 LEU HB2 . 17 . HB2 1 1 153 1 1 1 1 17 LEU H . 17 . HN 1 1 153 1 2 1 1 17 LEU QD . 17 . HD11 1 1 154 1 1 1 1 17 LEU H . 17 . HN 1 1 154 1 2 1 1 19 LYS H . 19 . HN 1 1 155 1 1 1 1 17 LEU HA . 17 . HA 1 1 155 1 2 1 1 17 LEU QD . 17 . HD11 1 1 156 1 1 1 1 17 LEU HB3 . 17 . HB1 1 1 156 1 2 1 1 20 VAL HB . 20 . HB 1 1 157 1 1 1 1 17 LEU QD . 17 . HD11 1 1 157 1 2 1 1 17 LEU HG . 17 . HG 1 1 158 1 1 1 1 17 LEU QD . 17 . HD21 1 1 158 1 2 1 1 20 VAL HA . 20 . HA 1 1 159 1 1 1 1 17 LEU QD . 17 . HD21 1 1 159 1 2 1 1 20 VAL HB . 20 . HB 1 1 160 1 1 1 1 18 ALA H . 18 . HN 1 1 160 1 2 1 1 18 ALA HA . 18 . HA 1 1 161 1 1 1 1 18 ALA H . 18 . HN 1 1 161 1 2 1 1 19 LYS H . 19 . HN 1 1 162 1 1 1 1 18 ALA HA . 18 . HA 1 1 162 1 2 1 1 18 ALA MB . 18 . HB1 1 1 163 1 1 1 1 18 ALA HA . 18 . HA 1 1 163 1 2 1 1 20 VAL QG . 20 . HG11 1 1 164 1 1 1 1 18 ALA MB . 18 . HB1 1 1 164 1 2 1 1 19 LYS H . 19 . HN 1 1 165 1 1 1 1 18 ALA MB . 18 . HB1 1 1 165 1 2 1 1 21 LEU HG . 21 . HG 1 1 166 1 1 1 1 19 LYS H . 19 . HN 1 1 166 1 2 1 1 19 LYS HA . 19 . HA 1 1 167 1 1 1 1 19 LYS H . 19 . HN 1 1 167 1 2 1 1 19 LYS QB . 19 . HB2 1 1 168 1 1 1 1 19 LYS H . 19 . HN 1 1 168 1 2 1 1 19 LYS QD . 19 . HD2 1 1 169 1 1 1 1 19 LYS H . 19 . HN 1 1 169 1 2 1 1 19 LYS QE . 19 . HE2 1 1 170 1 1 1 1 19 LYS H . 19 . HN 1 1 170 1 2 1 1 19 LYS QG . 19 . HG2 1 1 171 1 1 1 1 19 LYS H . 19 . HN 1 1 171 1 2 1 1 20 VAL QG . 20 . HG11 1 1 172 1 1 1 1 19 LYS H . 19 . HN 1 1 172 1 2 1 1 21 LEU H . 21 . HN 1 1 173 1 1 1 1 19 LYS HA . 19 . HA 1 1 173 1 2 1 1 19 LYS QB . 19 . HB2 1 1 174 1 1 1 1 19 LYS QB . 19 . HB2 1 1 174 1 2 1 1 19 LYS QE . 19 . HE2 1 1 175 1 1 1 1 19 LYS QB . 19 . HB1 1 1 175 1 2 1 1 19 LYS QG . 19 . HG2 1 1 176 1 1 1 1 19 LYS QB . 19 . HB2 1 1 176 1 2 1 1 20 VAL H . 20 . HN 1 1 177 1 1 1 1 19 LYS QD . 19 . HD2 1 1 177 1 2 1 1 20 VAL QG . 20 . HG11 1 1 178 1 1 1 1 19 LYS QD . 19 . HD2 1 1 178 1 2 1 1 23 GLU QB . 23 . HB1 1 1 179 1 1 1 1 19 LYS QE . 19 . HE2 1 1 179 1 2 1 1 20 VAL QG . 20 . HG11 1 1 180 1 1 1 1 19 LYS QG . 19 . HG2 1 1 180 1 2 1 1 20 VAL QG . 20 . HG11 1 1 181 1 1 1 1 20 VAL H . 20 . HN 1 1 181 1 2 1 1 20 VAL HB . 20 . HB 1 1 182 1 1 1 1 20 VAL H . 20 . HN 1 1 182 1 2 1 1 20 VAL QG . 20 . HG11 1 1 183 1 1 1 1 20 VAL H . 20 . HN 1 1 183 1 2 1 1 21 LEU HA . 21 . HA 1 1 184 1 1 1 1 20 VAL H . 20 . HN 1 1 184 1 2 1 1 21 LEU HB2 . 21 . HB2 1 1 185 1 1 1 1 20 VAL HA . 20 . HA 1 1 185 1 2 1 1 20 VAL HB . 20 . HB 1 1 186 1 1 1 1 20 VAL HA . 20 . HA 1 1 186 1 2 1 1 20 VAL QG . 20 . HG11 1 1 187 1 1 1 1 20 VAL HA . 20 . HA 1 1 187 1 2 1 1 23 GLU H . 23 . HN 1 1 188 1 1 1 1 20 VAL HA . 20 . HA 1 1 188 1 2 1 1 23 GLU QB . 23 . HB1 1 1 189 1 1 1 1 20 VAL HA . 20 . HA 1 1 189 1 2 1 1 23 GLU HG2 . 23 . HG1 1 1 190 1 1 1 1 20 VAL HA . 20 . HA 1 1 190 1 2 1 1 24 LYS HG2 . 24 . HG2 1 1 191 1 1 1 1 20 VAL HB . 20 . HB 1 1 191 1 2 1 1 21 LEU H . 21 . HN 1 1 192 1 1 1 1 20 VAL HB . 20 . HB 1 1 192 1 2 1 1 24 LYS QD . 24 . HD2 1 1 193 1 1 1 1 20 VAL HB . 20 . HB 1 1 193 1 2 1 1 24 LYS HG2 . 24 . HG2 1 1 194 1 1 1 1 20 VAL HB . 20 . HB 1 1 194 1 2 1 1 24 LYS HG3 . 24 . HG1 1 1 195 1 1 1 1 20 VAL MG1 . 20 . HG11 1 1 195 1 2 1 1 20 VAL MG2 . 20 . HG21 1 1 196 1 1 1 1 20 VAL QG . 20 . HG11 1 1 196 1 2 1 1 21 LEU H . 21 . HN 1 1 197 1 1 1 1 20 VAL QG . 20 . HG11 1 1 197 1 2 1 1 21 LEU HA . 21 . HA 1 1 198 1 1 1 1 20 VAL QG . 20 . HG11 1 1 198 1 2 1 1 21 LEU HB2 . 21 . HB2 1 1 199 1 1 1 1 20 VAL QG . 20 . HG11 1 1 199 1 2 1 1 21 LEU MD2 . 21 . HD21 1 1 200 1 1 1 1 20 VAL QG . 20 . HG11 1 1 200 1 2 1 1 22 ALA H . 22 . HN 1 1 201 1 1 1 1 20 VAL QG . 20 . HG11 1 1 201 1 2 1 1 23 GLU QB . 23 . HB1 1 1 202 1 1 1 1 20 VAL QG . 20 . HG11 1 1 202 1 2 1 1 23 GLU HG2 . 23 . HG1 1 1 203 1 1 1 1 20 VAL QG . 20 . HG21 1 1 203 1 2 1 1 23 GLU HG3 . 23 . HG2 1 1 204 1 1 1 1 20 VAL QG . 20 . HG11 1 1 204 1 2 1 1 24 LYS HE3 . 24 . HE2 1 1 205 1 1 1 1 20 VAL QG . 20 . HG11 1 1 205 1 2 1 1 24 LYS HG2 . 24 . HG2 1 1 206 1 1 1 1 20 VAL QG . 20 . HG11 1 1 206 1 2 1 1 25 TYR HB3 . 25 . HB1 1 1 207 1 1 1 1 21 LEU H . 21 . HN 1 1 207 1 2 1 1 21 LEU HB2 . 21 . HB2 1 1 208 1 1 1 1 21 LEU H . 21 . HN 1 1 208 1 2 1 1 21 LEU MD2 . 21 . HD21 1 1 209 1 1 1 1 21 LEU H . 21 . HN 1 1 209 1 2 1 1 23 GLU HG2 . 23 . HG1 1 1 210 1 1 1 1 21 LEU HA . 21 . HA 1 1 210 1 2 1 1 21 LEU MD1 . 21 . HD11 1 1 211 1 1 1 1 21 LEU HA . 21 . HA 1 1 211 1 2 1 1 22 ALA H . 22 . HN 1 1 212 1 1 1 1 21 LEU HB2 . 21 . HB2 1 1 212 1 2 1 1 23 GLU HG3 . 23 . HG2 1 1 213 1 1 1 1 21 LEU HB3 . 21 . HB1 1 1 213 1 2 1 1 21 LEU HG . 21 . HG 1 1 214 1 1 1 1 21 LEU HB3 . 21 . HB1 1 1 214 1 2 1 1 23 GLU HG2 . 23 . HG1 1 1 215 1 1 1 1 21 LEU HB3 . 21 . HB1 1 1 215 1 2 1 1 23 GLU HG3 . 23 . HG2 1 1 216 1 1 1 1 21 LEU MD1 . 21 . HD11 1 1 216 1 2 1 1 23 GLU QB . 23 . HB1 1 1 217 1 1 1 1 21 LEU MD1 . 21 . HD11 1 1 217 1 2 1 1 25 TYR HB3 . 25 . HB1 1 1 218 1 1 1 1 21 LEU MD2 . 21 . HD21 1 1 218 1 2 1 1 25 TYR CE1 . 25 . CE1 1 1 219 1 1 1 1 21 LEU MD2 . 21 . HD21 1 1 219 1 2 1 1 25 TYR HB2 . 25 . HB2 1 1 220 1 1 1 1 21 LEU MD2 . 21 . HD21 1 1 220 1 2 1 1 25 TYR HB3 . 25 . HB1 1 1 221 1 1 1 1 21 LEU MD2 . 21 . HD21 1 1 221 1 2 1 1 25 TYR HD1 . 25 . HD1 1 1 222 1 1 1 1 21 LEU MD2 . 21 . HD21 1 1 222 1 2 1 1 25 TYR HE1 . 25 . HE1 1 1 223 1 1 1 1 21 LEU HG . 21 . HG 1 1 223 1 2 1 1 23 GLU HG3 . 23 . HG2 1 1 224 1 1 1 1 22 ALA H . 22 . HN 1 1 224 1 2 1 1 22 ALA MB . 22 . HB1 1 1 225 1 1 1 1 22 ALA H . 22 . HN 1 1 225 1 2 1 1 23 GLU H . 23 . HN 1 1 226 1 1 1 1 22 ALA H . 22 . HN 1 1 226 1 2 1 1 23 GLU QB . 23 . HB2 1 1 227 1 1 1 1 22 ALA H . 22 . HN 1 1 227 1 2 1 1 26 ALA H . 26 . HN 1 1 228 1 1 1 1 22 ALA HA . 22 . HA 1 1 228 1 2 1 1 22 ALA MB . 22 . HB1 1 1 229 1 1 1 1 22 ALA MB . 22 . HB1 1 1 229 1 2 1 1 23 GLU H . 23 . HN 1 1 230 1 1 1 1 22 ALA MB . 22 . HB1 1 1 230 1 2 1 1 23 GLU HG2 . 23 . HG1 1 1 231 1 1 1 1 22 ALA MB . 22 . HB1 1 1 231 1 2 1 1 23 GLU HG3 . 23 . HG2 1 1 232 1 1 1 1 23 GLU H . 23 . HN 1 1 232 1 2 1 1 23 GLU HA . 23 . HA 1 1 233 1 1 1 1 23 GLU H . 23 . HN 1 1 233 1 2 1 1 23 GLU QB . 23 . HB1 1 1 234 1 1 1 1 23 GLU H . 23 . HN 1 1 234 1 2 1 1 23 GLU HG2 . 23 . HG1 1 1 235 1 1 1 1 23 GLU H . 23 . HN 1 1 235 1 2 1 1 23 GLU HG3 . 23 . HG2 1 1 236 1 1 1 1 23 GLU H . 23 . HN 1 1 236 1 2 1 1 24 LYS HE3 . 24 . HE2 1 1 237 1 1 1 1 23 GLU H . 23 . HN 1 1 237 1 2 1 1 24 LYS HG2 . 24 . HG2 1 1 238 1 1 1 1 23 GLU HA . 23 . HA 1 1 238 1 2 1 1 23 GLU QB . 23 . HB2 1 1 239 1 1 1 1 23 GLU HA . 23 . HA 1 1 239 1 2 1 1 23 GLU HG2 . 23 . HG1 1 1 240 1 1 1 1 23 GLU HA . 23 . HA 1 1 240 1 2 1 1 23 GLU HG3 . 23 . HG2 1 1 241 1 1 1 1 23 GLU HA . 23 . HA 1 1 241 1 2 1 1 27 ASN HB2 . 27 . HB1 1 1 242 1 1 1 1 23 GLU HA . 23 . HA 1 1 242 1 2 1 1 27 ASN HB3 . 27 . HB2 1 1 243 1 1 1 1 23 GLU QB . 23 . HB2 1 1 243 1 2 1 1 23 GLU HG2 . 23 . HG1 1 1 244 1 1 1 1 23 GLU QB . 23 . HB1 1 1 244 1 2 1 1 23 GLU HG3 . 23 . HG2 1 1 245 1 1 1 1 23 GLU QB . 23 . HB2 1 1 245 1 2 1 1 24 LYS H . 24 . HN 1 1 246 1 1 1 1 23 GLU QB . 23 . HB1 1 1 246 1 2 1 1 24 LYS HB2 . 24 . HB1 1 1 247 1 1 1 1 23 GLU QB . 23 . HB1 1 1 247 1 2 1 1 24 LYS HB3 . 24 . HB2 1 1 248 1 1 1 1 23 GLU QB . 23 . HB2 1 1 248 1 2 1 1 24 LYS QD . 24 . HD2 1 1 249 1 1 1 1 23 GLU QB . 23 . HB2 1 1 249 1 2 1 1 24 LYS HG2 . 24 . HG2 1 1 250 1 1 1 1 23 GLU QB . 23 . HB1 1 1 250 1 2 1 1 25 TYR H . 25 . HN 1 1 251 1 1 1 1 23 GLU HG2 . 23 . HG1 1 1 251 1 2 1 1 24 LYS H . 24 . HN 1 1 252 1 1 1 1 23 GLU HG2 . 23 . HG1 1 1 252 1 2 1 1 24 LYS HG2 . 24 . HG2 1 1 253 1 1 1 1 23 GLU HG2 . 23 . HG1 1 1 253 1 2 1 1 26 ALA MB . 26 . HB1 1 1 254 1 1 1 1 23 GLU HG3 . 23 . HG2 1 1 254 1 2 1 1 24 LYS H . 24 . HN 1 1 255 1 1 1 1 23 GLU HG3 . 23 . HG2 1 1 255 1 2 1 1 24 LYS QD . 24 . HD2 1 1 256 1 1 1 1 23 GLU HG3 . 23 . HG2 1 1 256 1 2 1 1 24 LYS HG2 . 24 . HG2 1 1 257 1 1 1 1 24 LYS H . 24 . HN 1 1 257 1 2 1 1 24 LYS HA . 24 . HA 1 1 258 1 1 1 1 24 LYS H . 24 . HN 1 1 258 1 2 1 1 24 LYS HB2 . 24 . HB1 1 1 259 1 1 1 1 24 LYS H . 24 . HN 1 1 259 1 2 1 1 24 LYS HB3 . 24 . HB2 1 1 260 1 1 1 1 24 LYS H . 24 . HN 1 1 260 1 2 1 1 25 TYR HE1 . 25 . HE1 1 1 261 1 1 1 1 24 LYS HA . 24 . HA 1 1 261 1 2 1 1 24 LYS HE3 . 24 . HE2 1 1 262 1 1 1 1 24 LYS HA . 24 . HA 1 1 262 1 2 1 1 24 LYS HG2 . 24 . HG2 1 1 263 1 1 1 1 24 LYS HA . 24 . HA 1 1 263 1 2 1 1 25 TYR H . 25 . HN 1 1 264 1 1 1 1 24 LYS HA . 24 . HA 1 1 264 1 2 1 1 25 TYR HA . 25 . HA 1 1 265 1 1 1 1 24 LYS HB2 . 24 . HB1 1 1 265 1 2 1 1 25 TYR HA . 25 . HA 1 1 266 1 1 1 1 24 LYS HB2 . 24 . HB1 1 1 266 1 2 1 1 25 TYR HB2 . 25 . HB2 1 1 267 1 1 1 1 24 LYS HB2 . 24 . HB1 1 1 267 1 2 1 1 25 TYR HD1 . 25 . HD1 1 1 268 1 1 1 1 24 LYS HB2 . 24 . HB1 1 1 268 1 2 1 1 25 TYR HE1 . 25 . HE1 1 1 269 1 1 1 1 24 LYS HB3 . 24 . HB2 1 1 269 1 2 1 1 25 TYR HA . 25 . HA 1 1 270 1 1 1 1 24 LYS HB3 . 24 . HB2 1 1 270 1 2 1 1 25 TYR HB2 . 25 . HB2 1 1 271 1 1 1 1 24 LYS HB3 . 24 . HB2 1 1 271 1 2 1 1 25 TYR HD1 . 25 . HD1 1 1 272 1 1 1 1 24 LYS HB3 . 24 . HB2 1 1 272 1 2 1 1 25 TYR HE1 . 25 . HE1 1 1 273 1 1 1 1 24 LYS QD . 24 . HD2 1 1 273 1 2 1 1 24 LYS HG3 . 24 . HG1 1 1 274 1 1 1 1 24 LYS QD . 24 . HD2 1 1 274 1 2 1 1 25 TYR HD1 . 25 . HD1 1 1 275 1 1 1 1 24 LYS HE3 . 24 . HE2 1 1 275 1 2 1 1 24 LYS HG3 . 24 . HG1 1 1 276 1 1 1 1 24 LYS HG2 . 24 . HG2 1 1 276 1 2 1 1 25 TYR H . 25 . HN 1 1 277 1 1 1 1 24 LYS HG2 . 24 . HG2 1 1 277 1 2 1 1 25 TYR HD1 . 25 . HD1 1 1 278 1 1 1 1 24 LYS HG2 . 24 . HG2 1 1 278 1 2 1 1 25 TYR HE1 . 25 . HE1 1 1 279 1 1 1 1 24 LYS HG2 . 24 . HG2 1 1 279 1 2 1 1 27 ASN H . 27 . HN 1 1 280 1 1 1 1 24 LYS HG3 . 24 . HG1 1 1 280 1 2 1 1 25 TYR H . 25 . HN 1 1 281 1 1 1 1 24 LYS HG3 . 24 . HG1 1 1 281 1 2 1 1 25 TYR HE1 . 25 . HE1 1 1 282 1 1 1 1 25 TYR H . 25 . HN 1 1 282 1 2 1 1 25 TYR HA . 25 . HA 1 1 283 1 1 1 1 25 TYR H . 25 . HN 1 1 283 1 2 1 1 25 TYR HB2 . 25 . HB2 1 1 284 1 1 1 1 25 TYR H . 25 . HN 1 1 284 1 2 1 1 25 TYR HB3 . 25 . HB1 1 1 285 1 1 1 1 25 TYR H . 25 . HN 1 1 285 1 2 1 1 25 TYR HE1 . 25 . HE1 1 1 286 1 1 1 1 25 TYR H . 25 . HN 1 1 286 1 2 1 1 26 ALA H . 26 . HN 1 1 287 1 1 1 1 25 TYR H . 25 . HN 1 1 287 1 2 1 1 27 ASN H . 27 . HN 1 1 288 1 1 1 1 25 TYR HA . 25 . HA 1 1 288 1 2 1 1 25 TYR HB2 . 25 . HB2 1 1 289 1 1 1 1 25 TYR HA . 25 . HA 1 1 289 1 2 1 1 25 TYR HB3 . 25 . HB1 1 1 290 1 1 1 1 25 TYR HA . 25 . HA 1 1 290 1 2 1 1 25 TYR HE1 . 25 . HE1 1 1 291 1 1 1 1 25 TYR HA . 25 . HA 1 1 291 1 2 1 1 26 ALA H . 26 . HN 1 1 292 1 1 1 1 25 TYR HA . 25 . HA 1 1 292 1 2 1 1 27 ASN H . 27 . HN 1 1 293 1 1 1 1 25 TYR HB2 . 25 . HB2 1 1 293 1 2 1 1 25 TYR HD1 . 25 . HD1 1 1 294 1 1 1 1 25 TYR HB2 . 25 . HB2 1 1 294 1 2 1 1 26 ALA H . 26 . HN 1 1 295 1 1 1 1 25 TYR HB2 . 25 . HB2 1 1 295 1 2 1 1 26 ALA MB . 26 . HB1 1 1 296 1 1 1 1 25 TYR HB3 . 25 . HB1 1 1 296 1 2 1 1 25 TYR HD1 . 25 . HD1 1 1 297 1 1 1 1 25 TYR HB3 . 25 . HB1 1 1 297 1 2 1 1 25 TYR HE1 . 25 . HE1 1 1 298 1 1 1 1 25 TYR HB3 . 25 . HB1 1 1 298 1 2 1 1 26 ALA H . 26 . HN 1 1 299 1 1 1 1 25 TYR HD1 . 25 . HD1 1 1 299 1 2 1 1 26 ALA H . 26 . HN 1 1 300 1 1 1 1 25 TYR HD1 . 25 . HD1 1 1 300 1 2 1 1 26 ALA MB . 26 . HB1 1 1 301 1 1 1 1 25 TYR HD1 . 25 . HD1 1 1 301 1 2 1 1 27 ASN HB2 . 27 . HB1 1 1 302 1 1 1 1 25 TYR HD1 . 25 . HD1 1 1 302 1 2 1 1 27 ASN HB3 . 27 . HB2 1 1 303 1 1 1 1 25 TYR HE1 . 25 . HE1 1 1 303 1 2 1 1 26 ALA H . 26 . HN 1 1 304 1 1 1 1 25 TYR HE1 . 25 . HE1 1 1 304 1 2 1 1 26 ALA MB . 26 . HB1 1 1 305 1 1 1 1 26 ALA H . 26 . HN 1 1 305 1 2 1 1 26 ALA HA . 26 . HA 1 1 306 1 1 1 1 26 ALA H . 26 . HN 1 1 306 1 2 1 1 26 ALA MB . 26 . HB1 1 1 307 1 1 1 1 26 ALA H . 26 . HN 1 1 307 1 2 1 1 27 ASN H . 27 . HN 1 1 308 1 1 1 1 26 ALA HA . 26 . HA 1 1 308 1 2 1 1 26 ALA MB . 26 . HB1 1 1 309 1 1 1 1 26 ALA HA . 26 . HA 1 1 309 1 2 1 1 27 ASN H . 27 . HN 1 1 310 1 1 1 1 26 ALA MB . 26 . HB1 1 1 310 1 2 1 1 27 ASN H . 27 . HN 1 1 311 1 1 1 1 26 ALA MB . 26 . HB1 1 1 311 1 2 1 1 27 ASN HA . 27 . HA 1 1 312 1 1 1 1 26 ALA MB . 26 . HB1 1 1 312 1 2 1 1 27 ASN HB2 . 27 . HB1 1 1 313 1 1 1 1 27 ASN H . 27 . HN 1 1 313 1 2 1 1 27 ASN HA . 27 . HA 1 1 314 1 1 1 1 27 ASN H . 27 . HN 1 1 314 1 2 1 1 27 ASN HB2 . 27 . HB1 1 1 315 1 1 1 1 27 ASN H . 27 . HN 1 1 315 1 2 1 1 27 ASN HB3 . 27 . HB2 1 1 316 1 1 1 1 27 ASN HA . 27 . HA 1 1 316 1 2 1 1 27 ASN HB2 . 27 . HB1 1 1 317 1 1 1 1 27 ASN HA . 27 . HA 1 1 317 1 2 1 1 27 ASN HB3 . 27 . HB2 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 . . . . . 2.708 1.791 3.625 1 1 2 1 . . . . . 3.614 1.981 5.247 1 1 3 1 . . . . . 2.314 1.645 2.983 1 1 4 1 . . . . . 2.659 1.775 3.543 1 1 5 1 . . . . . 2.706 1.791 3.621 1 1 6 1 . . . . . 2.667 1.778 3.556 1 1 7 1 . . . . . 2.814 1.824 3.804 1 1 8 1 . . . . . 3.073 1.892 4.254 1 1 9 1 . . . . . 4.075 1.999 6.151 1 1 10 1 . . . . . 3.98 2.0 5.96 1 1 11 1 . . . . . 3.423 1.958 4.888 1 1 12 1 . . . . . 2.572 1.745 3.399 1 1 13 1 . . . . . 2.366 1.666 3.066 1 1 14 1 . . . . . 2.209 1.599 2.819 1 1 15 1 . . . . . 2.9 1.849 3.951 1 1 16 1 . . . . . 2.193 1.592 2.794 1 1 17 1 . . . . . 2.293 1.636 2.95 1 1 18 1 . . . . . 2.38 1.672 3.088 1 1 19 1 . . . . . 3.622 1.982 5.262 1 1 20 1 . . . . . 3.852 1.997 5.707 1 1 21 1 . . . . . 2.257 1.62 2.894 1 1 22 1 . . . . . 2.216 1.602 2.83 1 1 23 1 . . . . . 2.455 1.702 3.208 1 1 24 1 . . . . . 3.594 1.979 5.209 1 1 25 1 . . . . . 2.524 1.727 3.321 1 1 26 1 . . . . . 2.458 1.703 3.213 1 1 27 1 . . . . . 2.279 1.63 2.928 1 1 28 1 . . . . . 2.53 1.73 3.33 1 1 29 1 . . . . . 2.386 1.675 3.097 1 1 30 1 . . . . . 3.209 1.922 4.496 1 1 31 1 . . . . . 2.863 1.839 3.887 1 1 32 1 . . . . . 2.907 1.851 3.963 1 1 33 1 . . . . . 3.628 1.982 5.274 1 1 34 1 . . . . . 4.752 1.929 7.575 1 1 35 1 . . . . . 2.507 1.721 3.293 1 1 36 1 . . . . . 2.62 1.762 3.478 1 1 37 1 . . . . . 1.992 1.496 2.488 1 1 38 1 . . . . . 3.687 1.988 5.386 1 1 39 1 . . . . . 2.189 1.59 2.788 1 1 40 1 . . . . . 2.069 1.534 2.604 1 1 41 1 . . . . . 3.296 1.938 4.654 1 1 42 1 . . . . . 1.877 1.437 2.317 1 1 43 1 . . . . . 2.766 1.809 3.723 1 1 44 1 . . . . . 2.859 1.837 3.881 1 1 45 1 . . . . . 3.238 1.928 4.548 1 1 46 1 . . . . . 2.607 1.758 3.456 1 1 47 1 . . . . . 2.289 1.634 2.944 1 1 48 1 . . . . . 2.41 1.684 3.136 1 1 49 1 . . . . . 2.234 1.61 2.858 1 1 50 1 . . . . . 2.668 1.778 3.558 1 1 51 1 . . . . . 3.164 1.912 4.416 1 1 52 1 . . . . . 2.168 1.581 2.755 1 1 53 1 . . . . . 2.202 1.596 2.808 1 1 54 1 . . . . . 2.863 1.839 3.887 1 1 55 1 . . . . . 2.247 1.616 2.878 1 1 56 1 . . . . . 1.984 1.492 2.476 1 1 57 1 . . . . . 2.47 1.707 3.233 1 1 58 1 . . . . . 3.562 1.976 5.148 1 1 59 1 . . . . . 2.408 1.683 3.133 1 1 60 1 . . . . . 2.443 1.697 3.189 1 1 61 1 . . . . . 2.676 1.781 3.571 1 1 62 1 . . . . . 3.984 2.0 5.968 1 1 63 1 . . . . . 2.371 1.668 3.074 1 1 64 1 . . . . . 2.475 1.709 3.241 1 1 65 1 . . . . . 1.627 1.296 1.958 1 1 66 1 . . . . . 3.687 1.988 5.386 1 1 67 1 . . . . . 2.956 1.863 4.049 1 1 68 1 . . . . . 2.907 1.851 3.963 1 1 69 1 . . . . . 2.286 1.633 2.939 1 1 70 1 . . . . . 3.485 1.967 5.003 1 1 71 1 . . . . . 3.852 1.997 5.707 1 1 72 1 . . . . . 2.602 1.755 3.449 1 1 73 1 . . . . . 2.443 1.697 3.189 1 1 74 1 . . . . . 2.458 1.703 3.213 1 1 75 1 . . . . . 3.45 1.963 4.937 1 1 76 1 . . . . . 3.738 1.991 5.485 1 1 77 1 . . . . . 3.12 1.903 4.337 1 1 78 1 . . . . . 3.933 1.999 5.867 1 1 79 1 . . . . . 3.636 1.983 5.289 1 1 80 1 . . . . . 3.614 1.981 5.247 1 1 81 1 . . . . . 4.101 1.999 6.203 1 1 82 1 . . . . . 3.4 1.955 4.845 1 1 83 1 . . . . . 2.589 1.751 3.427 1 1 84 1 . . . . . 1.733 1.358 2.108 1 1 85 1 . . . . . 2.959 1.865 4.053 1 1 86 1 . . . . . 1.88 1.438 2.322 1 1 87 1 . . . . . 2.782 1.815 3.749 1 1 88 1 . . . . . 2.241 1.613 2.869 1 1 89 1 . . . . . 2.959 1.865 4.053 1 1 90 1 . . . . . 2.597 1.809 3.44 1 1 91 1 . . . . . 2.581 1.749 3.413 1 1 92 1 . . . . . 2.876 1.842 3.91 1 1 93 1 . . . . . 3.941 2.0 5.882 1 1 94 1 . . . . . 3.12 1.903 4.337 1 1 95 1 . . . . . 3.649 1.985 5.313 1 1 96 1 . . . . . 3.673 1.986 5.36 1 1 97 1 . . . . . 3.021 1.88 4.162 1 1 98 1 . . . . . 2.464 1.705 3.223 1 1 99 1 . . . . . 2.389 1.676 3.102 1 1 100 1 . . . . . 2.797 1.819 3.775 1 1 101 1 . . . . . 2.806 1.822 3.79 1 1 102 1 . . . . . 2.457 1.702 3.088 1 1 103 1 . . . . . 3.169 1.914 4.424 1 1 104 1 . . . . . 3.65 1.985 5.315 1 1 105 1 . . . . . 3.274 1.934 4.614 1 1 106 1 . . . . . 3.028 1.882 4.174 1 1 107 1 . . . . . 1.952 1.476 2.428 1 1 108 1 . . . . . 2.246 1.615 2.877 1 1 109 1 . . . . . 1.939 1.469 2.409 1 1 110 1 . . . . . 3.624 1.982 5.266 1 1 111 1 . . . . . 2.054 1.526 2.582 1 1 112 1 . . . . . 2.352 1.66 3.044 1 1 113 1 . . . . . 3.871 1.998 5.744 1 1 114 1 . . . . . 2.284 1.632 2.936 1 1 115 1 . . . . . 2.608 1.758 3.458 1 1 116 1 . . . . . 3.091 1.897 4.285 1 1 117 1 . . . . . 3.53 1.973 5.087 1 1 118 1 . . . . . 2.771 1.811 3.731 1 1 119 1 . . . . . 2.245 1.615 2.875 1 1 120 1 . . . . . 3.838 1.997 5.679 1 1 121 1 . . . . . 3.478 1.966 4.99 1 1 122 1 . . . . . 2.363 1.665 3.061 1 1 123 1 . . . . . 1.725 1.353 2.097 1 1 124 1 . . . . . 2.394 1.677 3.111 1 1 125 1 . . . . . 2.23 1.608 2.852 1 1 126 1 . . . . . 2.344 1.657 3.024 1 1 127 1 . . . . . 2.588 1.751 3.425 1 1 128 1 . . . . . 2.414 1.685 3.143 1 1 129 1 . . . . . 1.953 1.476 2.43 1 1 130 1 . . . . . 2.503 1.72 3.286 1 1 131 1 . . . . . 2.736 1.8 3.672 1 1 132 1 . . . . . 2.339 1.655 3.023 1 1 133 1 . . . . . 2.297 1.637 2.957 1 1 134 1 . . . . . 1.929 1.464 2.394 1 1 135 1 . . . . . 2.206 1.598 2.814 1 1 136 1 . . . . . 3.015 1.878 4.152 1 1 137 1 . . . . . 2.303 1.64 2.966 1 1 138 1 . . . . . 1.914 1.456 2.372 1 1 139 1 . . . . . 3.332 1.945 4.719 1 1 140 1 . . . . . 1.937 1.468 2.406 1 1 141 1 . . . . . 2.571 1.745 3.397 1 1 142 1 . . . . . 2.238 1.798 2.864 1 1 143 1 . . . . . 2.582 1.749 3.415 1 1 144 1 . . . . . 2.721 1.795 3.647 1 1 145 1 . . . . . 4.058 1.999 6.117 1 1 146 1 . . . . . 3.305 1.94 4.67 1 1 147 1 . . . . . 2.579 1.748 3.41 1 1 148 1 . . . . . 3.31 1.941 4.679 1 1 149 1 . . . . . 3.218 1.923 4.513 1 1 150 1 . . . . . 3.318 1.942 4.694 1 1 151 1 . . . . . 2.005 1.502 2.508 1 1 152 1 . . . . . 1.896 1.447 2.345 1 1 153 1 . . . . . 2.457 1.702 3.212 1 1 154 1 . . . . . 3.427 1.959 4.895 1 1 155 1 . . . . . 2.359 1.664 3.054 1 1 156 1 . . . . . 3.124 1.904 4.344 1 1 157 1 . . . . . 1.934 1.467 2.401 1 1 158 1 . . . . . 3.373 1.951 4.795 1 1 159 1 . . . . . 2.335 1.654 3.016 1 1 160 1 . . . . . 2.168 1.581 2.755 1 1 161 1 . . . . . 2.716 1.794 3.638 1 1 162 1 . . . . . 2.183 1.587 2.779 1 1 163 1 . . . . . 3.243 1.929 4.557 1 1 164 1 . . . . . 2.394 1.677 3.111 1 1 165 1 . . . . . 2.209 1.599 2.819 1 1 166 1 . . . . . 2.729 1.798 3.66 1 1 167 1 . . . . . 2.356 1.706 3.05 1 1 168 1 . . . . . 2.873 1.841 3.905 1 1 169 1 . . . . . 3.73 1.991 5.469 1 1 170 1 . . . . . 2.303 1.64 2.966 1 1 171 1 . . . . . 2.801 1.82 3.782 1 1 172 1 . . . . . 2.933 1.857 4.009 1 1 173 1 . . . . . 1.995 1.497 2.493 1 1 174 1 . . . . . . 1.755 2.297 1 1 175 1 . . . . . 2.216 1.602 2.83 1 1 176 1 . . . . . 2.616 1.761 3.471 1 1 177 1 . . . . . 2.855 1.836 3.874 1 1 178 1 . . . . . 3.933 1.999 5.867 1 1 179 1 . . . . . 3.741 1.992 5.49 1 1 180 1 . . . . . 2.25 1.926 2.883 1 1 181 1 . . . . . 2.865 1.839 3.891 1 1 182 1 . . . . . 2.355 1.661 3.049 1 1 183 1 . . . . . 3.279 1.935 4.623 1 1 184 1 . . . . . 2.586 1.75 3.422 1 1 185 1 . . . . . 2.825 1.827 3.823 1 1 186 1 . . . . . 2.682 1.836 3.581 1 1 187 1 . . . . . 3.169 1.914 4.424 1 1 188 1 . . . . . 3.342 1.958 4.738 1 1 189 1 . . . . . 3.663 1.986 5.34 1 1 190 1 . . . . . 3.467 1.965 4.969 1 1 191 1 . . . . . 2.662 1.776 3.548 1 1 192 1 . . . . . 3.293 1.938 4.648 1 1 193 1 . . . . . 3.4 1.955 4.845 1 1 194 1 . . . . . 3.284 1.936 4.632 1 1 195 1 . . . . . 2.054 1.526 2.582 1 1 196 1 . . . . . 2.419 1.688 3.15 1 1 197 1 . . . . . 2.294 1.636 2.952 1 1 198 1 . . . . . 2.41 1.684 3.136 1 1 199 1 . . . . . 1.835 1.414 2.256 1 1 200 1 . . . . . 3.084 1.895 4.273 1 1 201 1 . . . . . 3.223 1.925 4.521 1 1 202 1 . . . . . 3.415 1.957 4.873 1 1 203 1 . . . . . 3.391 1.993 4.828 1 1 204 1 . . . . . 4.954 1.886 8.022 1 1 205 1 . . . . . 2.914 1.853 3.975 1 1 206 1 . . . . . 4.08 1.999 6.161 1 1 207 1 . . . . . 1.895 1.446 2.344 1 1 208 1 . . . . . 2.038 1.519 2.557 1 1 209 1 . . . . . 4.324 1.987 6.661 1 1 210 1 . . . . . 2.378 1.671 3.085 1 1 211 1 . . . . . 2.724 1.796 3.652 1 1 212 1 . . . . . 3.489 1.967 5.011 1 1 213 1 . . . . . 2.474 1.709 3.239 1 1 214 1 . . . . . 3.329 1.944 4.714 1 1 215 1 . . . . . 3.683 1.988 5.378 1 1 216 1 . . . . . 3.965 2.0 5.93 1 1 217 1 . . . . . 2.647 1.771 3.523 1 1 218 1 . . . . . 3.561 1.976 5.146 1 1 219 1 . . . . . 3.218 1.923 4.513 1 1 220 1 . . . . . 2.595 1.753 3.437 1 1 221 1 . . . . . 3.365 1.949 4.781 1 1 222 1 . . . . . 3.243 1.929 4.557 1 1 223 1 . . . . . 4.371 1.983 6.759 1 1 224 1 . . . . . 1.881 1.439 2.323 1 1 225 1 . . . . . 2.776 1.812 3.74 1 1 226 1 . . . . . 3.8 1.996 5.605 1 1 227 1 . . . . . 2.983 1.87 4.096 1 1 228 1 . . . . . 1.613 1.288 1.938 1 1 229 1 . . . . . 2.339 1.655 3.023 1 1 230 1 . . . . . 2.812 1.824 3.8 1 1 231 1 . . . . . 2.964 1.866 4.062 1 1 232 1 . . . . . 2.365 1.666 3.064 1 1 233 1 . . . . . 2.69 1.785 3.595 1 1 234 1 . . . . . 3.028 1.882 4.174 1 1 235 1 . . . . . 3.102 1.9 4.304 1 1 236 1 . . . . . 3.751 1.993 5.509 1 1 237 1 . . . . . 4.542 1.963 7.121 1 1 238 1 . . . . . 2.168 1.641 2.755 1 1 239 1 . . . . . 2.672 1.78 3.564 1 1 240 1 . . . . . 2.729 1.798 3.66 1 1 241 1 . . . . . 3.556 1.976 5.136 1 1 242 1 . . . . . 3.521 1.972 5.07 1 1 243 1 . . . . . 2.464 1.726 3.223 1 1 244 1 . . . . . 2.584 1.75 3.39 1 1 245 1 . . . . . 3.314 1.941 3.866 1 1 246 1 . . . . . 3.749 1.992 5.506 1 1 247 1 . . . . . 3.228 1.926 4.53 1 1 248 1 . . . . . 3.105 1.964 4.31 1 1 249 1 . . . . . 2.501 1.789 3.283 1 1 250 1 . . . . . 3.243 1.929 4.557 1 1 251 1 . . . . . 3.442 1.961 4.923 1 1 252 1 . . . . . 3.169 1.914 4.424 1 1 253 1 . . . . . 3.319 1.942 4.696 1 1 254 1 . . . . . 3.371 1.951 4.791 1 1 255 1 . . . . . 3.091 1.897 4.285 1 1 256 1 . . . . . 2.762 1.809 3.715 1 1 257 1 . . . . . 2.291 1.635 2.947 1 1 258 1 . . . . . 2.614 1.76 3.468 1 1 259 1 . . . . . 2.533 1.731 3.335 1 1 260 1 . . . . . 3.637 1.983 5.291 1 1 261 1 . . . . . 3.435 1.96 4.91 1 1 262 1 . . . . . 2.485 1.713 3.257 1 1 263 1 . . . . . 2.657 1.775 3.539 1 1 264 1 . . . . . 3.204 1.921 4.487 1 1 265 1 . . . . . 2.941 1.86 4.022 1 1 266 1 . . . . . 3.043 1.885 4.201 1 1 267 1 . . . . . 3.268 1.933 4.603 1 1 268 1 . . . . . 4.237 1.993 6.481 1 1 269 1 . . . . . 3.209 1.922 4.496 1 1 270 1 . . . . . 3.714 1.989 5.439 1 1 271 1 . . . . . 3.043 1.885 4.201 1 1 272 1 . . . . . 3.682 1.988 5.376 1 1 273 1 . . . . . 1.934 1.467 2.401 1 1 274 1 . . . . . 3.914 1.999 5.829 1 1 275 1 . . . . . 2.644 1.77 3.518 1 1 276 1 . . . . . 3.975 2.0 5.95 1 1 277 1 . . . . . 3.889 1.999 5.779 1 1 278 1 . . . . . 4.25 1.992 6.508 1 1 279 1 . . . . . 3.531 1.973 5.089 1 1 280 1 . . . . . 3.253 1.931 4.575 1 1 281 1 . . . . . 3.466 1.964 4.968 1 1 282 1 . . . . . 2.882 1.844 3.92 1 1 283 1 . . . . . 2.581 1.749 3.413 1 1 284 1 . . . . . 2.528 1.729 3.327 1 1 285 1 . . . . . 3.654 1.985 5.323 1 1 286 1 . . . . . 2.153 1.574 2.732 1 1 287 1 . . . . . 3.541 1.974 5.108 1 1 288 1 . . . . . 2.732 1.799 3.665 1 1 289 1 . . . . . 2.564 1.742 3.386 1 1 290 1 . . . . . 3.622 1.982 5.262 1 1 291 1 . . . . . 3.467 1.965 4.969 1 1 292 1 . . . . . 4.021 2.0 6.042 1 1 293 1 . . . . . 2.382 1.673 3.091 1 1 294 1 . . . . . 2.663 1.777 3.549 1 1 295 1 . . . . . 3.066 1.891 4.241 1 1 296 1 . . . . . 2.643 1.77 3.516 1 1 297 1 . . . . . 3.658 1.985 5.331 1 1 298 1 . . . . . 2.452 1.7 3.204 1 1 299 1 . . . . . 2.924 1.856 3.992 1 1 300 1 . . . . . 3.42 1.958 4.882 1 1 301 1 . . . . . 3.635 1.983 5.287 1 1 302 1 . . . . . 3.742 1.991 5.493 1 1 303 1 . . . . . 3.618 1.982 5.254 1 1 304 1 . . . . . 4.09 1.999 6.181 1 1 305 1 . . . . . 2.524 1.728 3.32 1 1 306 1 . . . . . 1.905 1.452 2.358 1 1 307 1 . . . . . 2.684 1.784 3.584 1 1 308 1 . . . . . 1.794 1.392 2.196 1 1 309 1 . . . . . 2.878 1.843 3.913 1 1 310 1 . . . . . 2.193 1.592 2.794 1 1 311 1 . . . . . 3.441 1.961 4.921 1 1 312 1 . . . . . 3.372 1.951 4.793 1 1 313 1 . . . . . 2.618 1.761 3.475 1 1 314 1 . . . . . 2.629 1.765 3.493 1 1 315 1 . . . . . 2.726 1.797 3.655 1 1 316 1 . . . . . 2.833 1.83 3.836 1 1 317 1 . . . . . 2.646 1.771 3.521 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C 15.552 0.845 -0.304 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C 15.429 0.452 -1.759 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H 16.339 0.822 -3.593 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY H2 H 17.418 0.760 -2.290 1.00 . A A . 1 GLY H2 1 1 1 5 1 1 1 GLY H3 H 16.428 2.118 -2.508 1.00 . A A . 1 GLY H3 1 1 1 6 1 1 1 GLY HA2 H 14.460 0.758 -2.123 1.00 . A A . 1 GLY HA2 1 1 1 7 1 1 1 GLY HA3 H 15.512 -0.622 -1.839 1.00 . A A . 1 GLY HA3 1 1 1 8 1 1 1 GLY N N 16.475 1.082 -2.596 1.00 . A A . 1 GLY N 1 1 1 9 1 1 1 GLY O O 16.658 0.905 0.237 1.00 . A A . 1 GLY O 1 1 1 10 1 1 2 ILE C C 13.548 0.457 2.494 1.00 . A A . 2 ILE C 1 1 1 11 1 1 2 ILE CA C 14.384 1.477 1.730 1.00 . A A . 2 ILE CA 1 1 1 12 1 1 2 ILE CB C 13.783 2.885 1.928 1.00 . A A . 2 ILE CB 1 1 1 13 1 1 2 ILE CD1 C 14.134 5.357 1.393 1.00 . A A . 2 ILE CD1 1 1 1 14 1 1 2 ILE CG1 C 14.688 3.951 1.302 1.00 . A A . 2 ILE CG1 1 1 1 15 1 1 2 ILE CG2 C 13.554 3.159 3.403 1.00 . A A . 2 ILE CG2 1 1 1 16 1 1 2 ILE H H 13.577 1.096 -0.172 1.00 . A A . 2 ILE H 1 1 1 17 1 1 2 ILE HA H 15.394 1.475 2.110 1.00 . A A . 2 ILE HA 1 1 1 18 1 1 2 ILE HB H 12.822 2.908 1.436 1.00 . A A . 2 ILE HB 1 1 1 19 1 1 2 ILE HD11 H 14.821 6.045 0.923 1.00 . A A . 2 ILE HD11 1 1 1 20 1 1 2 ILE HD12 H 14.012 5.625 2.432 1.00 . A A . 2 ILE HD12 1 1 1 21 1 1 2 ILE HD13 H 13.178 5.403 0.893 1.00 . A A . 2 ILE HD13 1 1 1 22 1 1 2 ILE HG12 H 15.644 3.944 1.803 1.00 . A A . 2 ILE HG12 1 1 1 23 1 1 2 ILE HG13 H 14.832 3.721 0.256 1.00 . A A . 2 ILE HG13 1 1 1 24 1 1 2 ILE HG21 H 12.851 2.432 3.793 1.00 . A A . 2 ILE HG21 1 1 1 25 1 1 2 ILE HG22 H 13.153 4.154 3.527 1.00 . A A . 2 ILE HG22 1 1 1 26 1 1 2 ILE HG23 H 14.490 3.077 3.934 1.00 . A A . 2 ILE HG23 1 1 1 27 1 1 2 ILE N N 14.419 1.127 0.325 1.00 . A A . 2 ILE N 1 1 1 28 1 1 2 ILE O O 14.076 -0.430 3.166 1.00 . A A . 2 ILE O 1 1 1 29 1 1 3 GLY C C 9.936 0.254 3.047 1.00 . A A . 3 GLY C 1 1 1 30 1 1 3 GLY CA C 11.322 -0.333 2.985 1.00 . A A . 3 GLY CA 1 1 1 31 1 1 3 GLY H H 11.882 1.357 1.884 1.00 . A A . 3 GLY H 1 1 1 32 1 1 3 GLY HA2 H 11.301 -1.241 2.402 1.00 . A A . 3 GLY HA2 1 1 1 33 1 1 3 GLY HA3 H 11.656 -0.559 3.986 1.00 . A A . 3 GLY HA3 1 1 1 34 1 1 3 GLY N N 12.237 0.594 2.376 1.00 . A A . 3 GLY N 1 1 1 35 1 1 3 GLY O O 9.143 0.128 2.107 1.00 . A A . 3 GLY O 1 1 1 36 1 1 4 GLY C C 8.221 2.917 3.746 1.00 . A A . 4 GLY C 1 1 1 37 1 1 4 GLY CA C 8.372 1.544 4.354 1.00 . A A . 4 GLY CA 1 1 1 38 1 1 4 GLY H H 10.410 1.153 4.753 1.00 . A A . 4 GLY H 1 1 1 39 1 1 4 GLY HA2 H 7.632 0.888 3.927 1.00 . A A . 4 GLY HA2 1 1 1 40 1 1 4 GLY HA3 H 8.207 1.614 5.419 1.00 . A A . 4 GLY HA3 1 1 1 41 1 1 4 GLY N N 9.682 0.981 4.116 1.00 . A A . 4 GLY N 1 1 1 42 1 1 4 GLY O O 7.689 3.830 4.375 1.00 . A A . 4 GLY O 1 1 1 43 1 1 5 VAL C C 7.546 4.303 0.747 1.00 . A A . 5 VAL C 1 1 1 44 1 1 5 VAL CA C 8.637 4.328 1.820 1.00 . A A . 5 VAL CA 1 1 1 45 1 1 5 VAL CB C 10.020 4.668 1.206 1.00 . A A . 5 VAL CB 1 1 1 46 1 1 5 VAL CG1 C 10.641 3.448 0.540 1.00 . A A . 5 VAL CG1 1 1 1 47 1 1 5 VAL CG2 C 9.903 5.806 0.212 1.00 . A A . 5 VAL CG2 1 1 1 48 1 1 5 VAL H H 9.072 2.281 2.064 1.00 . A A . 5 VAL H 1 1 1 49 1 1 5 VAL HA H 8.393 5.091 2.544 1.00 . A A . 5 VAL HA 1 1 1 50 1 1 5 VAL HB H 10.676 4.984 2.004 1.00 . A A . 5 VAL HB 1 1 1 51 1 1 5 VAL HG11 H 11.609 3.710 0.136 1.00 . A A . 5 VAL HG11 1 1 1 52 1 1 5 VAL HG12 H 9.998 3.106 -0.258 1.00 . A A . 5 VAL HG12 1 1 1 53 1 1 5 VAL HG13 H 10.757 2.659 1.269 1.00 . A A . 5 VAL HG13 1 1 1 54 1 1 5 VAL HG21 H 9.432 6.654 0.686 1.00 . A A . 5 VAL HG21 1 1 1 55 1 1 5 VAL HG22 H 9.303 5.476 -0.628 1.00 . A A . 5 VAL HG22 1 1 1 56 1 1 5 VAL HG23 H 10.888 6.083 -0.135 1.00 . A A . 5 VAL HG23 1 1 1 57 1 1 5 VAL N N 8.688 3.059 2.517 1.00 . A A . 5 VAL N 1 1 1 58 1 1 5 VAL O O 6.686 5.184 0.700 1.00 . A A . 5 VAL O 1 1 1 59 1 1 6 LEU C C 7.023 1.823 -1.935 1.00 . A A . 6 LEU C 1 1 1 60 1 1 6 LEU CA C 6.598 3.045 -1.143 1.00 . A A . 6 LEU CA 1 1 1 61 1 1 6 LEU CB C 6.435 4.287 -2.064 1.00 . A A . 6 LEU CB 1 1 1 62 1 1 6 LEU CD1 C 8.926 4.434 -2.610 1.00 . A A . 6 LEU CD1 1 1 1 63 1 1 6 LEU CD2 C 7.304 3.719 -4.388 1.00 . A A . 6 LEU CD2 1 1 1 64 1 1 6 LEU CG C 7.511 4.576 -3.144 1.00 . A A . 6 LEU CG 1 1 1 65 1 1 6 LEU H H 8.299 2.612 0.027 1.00 . A A . 6 LEU H 1 1 1 66 1 1 6 LEU HA H 5.650 2.832 -0.666 1.00 . A A . 6 LEU HA 1 1 1 67 1 1 6 LEU HB2 H 5.489 4.192 -2.572 1.00 . A A . 6 LEU HB2 1 1 1 68 1 1 6 LEU HB3 H 6.380 5.152 -1.423 1.00 . A A . 6 LEU HB3 1 1 1 69 1 1 6 LEU HD11 H 9.633 4.558 -3.417 1.00 . A A . 6 LEU HD11 1 1 1 70 1 1 6 LEU HD12 H 9.048 3.456 -2.166 1.00 . A A . 6 LEU HD12 1 1 1 71 1 1 6 LEU HD13 H 9.102 5.189 -1.859 1.00 . A A . 6 LEU HD13 1 1 1 72 1 1 6 LEU HD21 H 7.368 2.675 -4.124 1.00 . A A . 6 LEU HD21 1 1 1 73 1 1 6 LEU HD22 H 8.066 3.952 -5.117 1.00 . A A . 6 LEU HD22 1 1 1 74 1 1 6 LEU HD23 H 6.330 3.926 -4.809 1.00 . A A . 6 LEU HD23 1 1 1 75 1 1 6 LEU HG H 7.400 5.606 -3.451 1.00 . A A . 6 LEU HG 1 1 1 76 1 1 6 LEU N N 7.585 3.266 -0.084 1.00 . A A . 6 LEU N 1 1 1 77 1 1 6 LEU O O 6.219 1.169 -2.597 1.00 . A A . 6 LEU O 1 1 1 78 1 1 7 LEU C C 8.402 -0.908 -2.122 1.00 . A A . 7 LEU C 1 1 1 79 1 1 7 LEU CA C 8.940 0.449 -2.568 1.00 . A A . 7 LEU CA 1 1 1 80 1 1 7 LEU CB C 10.458 0.516 -2.371 1.00 . A A . 7 LEU CB 1 1 1 81 1 1 7 LEU CD1 C 10.908 -1.552 -3.732 1.00 . A A . 7 LEU CD1 1 1 1 82 1 1 7 LEU CD2 C 11.150 0.737 -4.726 1.00 . A A . 7 LEU CD2 1 1 1 83 1 1 7 LEU CG C 11.299 -0.105 -3.479 1.00 . A A . 7 LEU CG 1 1 1 84 1 1 7 LEU H H 8.872 2.113 -1.274 1.00 . A A . 7 LEU H 1 1 1 85 1 1 7 LEU HA H 8.720 0.585 -3.615 1.00 . A A . 7 LEU HA 1 1 1 86 1 1 7 LEU HB2 H 10.739 1.557 -2.301 1.00 . A A . 7 LEU HB2 1 1 1 87 1 1 7 LEU HB3 H 10.704 0.027 -1.441 1.00 . A A . 7 LEU HB3 1 1 1 88 1 1 7 LEU HD11 H 9.833 -1.613 -3.870 1.00 . A A . 7 LEU HD11 1 1 1 89 1 1 7 LEU HD12 H 11.194 -2.157 -2.884 1.00 . A A . 7 LEU HD12 1 1 1 90 1 1 7 LEU HD13 H 11.406 -1.911 -4.620 1.00 . A A . 7 LEU HD13 1 1 1 91 1 1 7 LEU HD21 H 11.912 0.466 -5.443 1.00 . A A . 7 LEU HD21 1 1 1 92 1 1 7 LEU HD22 H 11.252 1.778 -4.455 1.00 . A A . 7 LEU HD22 1 1 1 93 1 1 7 LEU HD23 H 10.172 0.573 -5.156 1.00 . A A . 7 LEU HD23 1 1 1 94 1 1 7 LEU HG H 12.338 -0.085 -3.184 1.00 . A A . 7 LEU HG 1 1 1 95 1 1 7 LEU N N 8.313 1.538 -1.836 1.00 . A A . 7 LEU N 1 1 1 96 1 1 7 LEU O O 7.569 -1.509 -2.796 1.00 . A A . 7 LEU O 1 1 1 97 1 1 8 SER C C 7.230 -2.560 0.328 1.00 . A A . 8 SER C 1 1 1 98 1 1 8 SER CA C 8.471 -2.710 -0.512 1.00 . A A . 8 SER CA 1 1 1 99 1 1 8 SER CB C 9.608 -3.387 0.254 1.00 . A A . 8 SER CB 1 1 1 100 1 1 8 SER H H 9.412 -0.811 -0.396 1.00 . A A . 8 SER H 1 1 1 101 1 1 8 SER HA H 8.224 -3.298 -1.384 1.00 . A A . 8 SER HA 1 1 1 102 1 1 8 SER HB2 H 9.227 -4.267 0.752 1.00 . A A . 8 SER HB2 1 1 1 103 1 1 8 SER HB3 H 10.385 -3.674 -0.439 1.00 . A A . 8 SER HB3 1 1 1 104 1 1 8 SER HG H 9.851 -2.770 2.106 1.00 . A A . 8 SER HG 1 1 1 105 1 1 8 SER N N 8.857 -1.382 -0.972 1.00 . A A . 8 SER N 1 1 1 106 1 1 8 SER O O 6.510 -3.515 0.618 1.00 . A A . 8 SER O 1 1 1 107 1 1 8 SER OG O 10.161 -2.509 1.221 1.00 . A A . 8 SER OG 1 1 1 108 1 1 9 ALA C C 4.686 -1.182 0.037 1.00 . A A . 9 ALA C 1 1 1 109 1 1 9 ALA CA C 5.706 -0.863 1.129 1.00 . A A . 9 ALA CA 1 1 1 110 1 1 9 ALA CB C 5.790 0.630 1.379 1.00 . A A . 9 ALA CB 1 1 1 111 1 1 9 ALA H H 7.743 -0.682 0.694 1.00 . A A . 9 ALA H 1 1 1 112 1 1 9 ALA HA H 5.440 -1.365 2.048 1.00 . A A . 9 ALA HA 1 1 1 113 1 1 9 ALA HB1 H 6.414 1.079 0.610 1.00 . A A . 9 ALA HB1 1 1 1 114 1 1 9 ALA HB2 H 6.229 0.808 2.349 1.00 . A A . 9 ALA HB2 1 1 1 115 1 1 9 ALA HB3 H 4.801 1.063 1.342 1.00 . A A . 9 ALA HB3 1 1 1 116 1 1 9 ALA N N 7.000 -1.317 0.697 1.00 . A A . 9 ALA N 1 1 1 117 1 1 9 ALA O O 3.518 -1.450 0.313 1.00 . A A . 9 ALA O 1 1 1 118 1 1 10 GLY C C 4.302 -3.016 -2.578 1.00 . A A . 10 GLY C 1 1 1 119 1 1 10 GLY CA C 4.316 -1.529 -2.331 1.00 . A A . 10 GLY CA 1 1 1 120 1 1 10 GLY H H 6.109 -0.962 -1.370 1.00 . A A . 10 GLY H 1 1 1 121 1 1 10 GLY HA2 H 3.317 -1.200 -2.124 1.00 . A A . 10 GLY HA2 1 1 1 122 1 1 10 GLY HA3 H 4.681 -1.029 -3.217 1.00 . A A . 10 GLY HA3 1 1 1 123 1 1 10 GLY N N 5.161 -1.186 -1.211 1.00 . A A . 10 GLY N 1 1 1 124 1 1 10 GLY O O 3.273 -3.590 -2.918 1.00 . A A . 10 GLY O 1 1 1 125 1 1 11 LYS C C 4.611 -5.779 -1.522 1.00 . A A . 11 LYS C 1 1 1 126 1 1 11 LYS CA C 5.589 -5.083 -2.461 1.00 . A A . 11 LYS CA 1 1 1 127 1 1 11 LYS CB C 7.019 -5.468 -2.109 1.00 . A A . 11 LYS CB 1 1 1 128 1 1 11 LYS CD C 8.398 -4.551 -4.032 1.00 . A A . 11 LYS CD 1 1 1 129 1 1 11 LYS CE C 7.325 -3.977 -4.939 1.00 . A A . 11 LYS CE 1 1 1 130 1 1 11 LYS CG C 7.912 -5.792 -3.293 1.00 . A A . 11 LYS CG 1 1 1 131 1 1 11 LYS H H 6.254 -3.101 -2.211 1.00 . A A . 11 LYS H 1 1 1 132 1 1 11 LYS HA H 5.380 -5.393 -3.469 1.00 . A A . 11 LYS HA 1 1 1 133 1 1 11 LYS HB2 H 7.460 -4.636 -1.586 1.00 . A A . 11 LYS HB2 1 1 1 134 1 1 11 LYS HB3 H 6.999 -6.327 -1.459 1.00 . A A . 11 LYS HB3 1 1 1 135 1 1 11 LYS HD2 H 8.680 -3.800 -3.307 1.00 . A A . 11 LYS HD2 1 1 1 136 1 1 11 LYS HD3 H 9.258 -4.816 -4.630 1.00 . A A . 11 LYS HD3 1 1 1 137 1 1 11 LYS HE2 H 6.418 -3.879 -4.359 1.00 . A A . 11 LYS HE2 1 1 1 138 1 1 11 LYS HE3 H 7.642 -3.004 -5.282 1.00 . A A . 11 LYS HE3 1 1 1 139 1 1 11 LYS HG2 H 8.770 -6.343 -2.941 1.00 . A A . 11 LYS HG2 1 1 1 140 1 1 11 LYS HG3 H 7.348 -6.401 -3.972 1.00 . A A . 11 LYS HG3 1 1 1 141 1 1 11 LYS HZ1 H 7.890 -4.851 -6.756 1.00 . A A . 11 LYS HZ1 1 1 1 142 1 1 11 LYS HZ2 H 6.234 -4.504 -6.648 1.00 . A A . 11 LYS HZ2 1 1 1 143 1 1 11 LYS HZ3 H 6.882 -5.829 -5.812 1.00 . A A . 11 LYS HZ3 1 1 1 144 1 1 11 LYS N N 5.455 -3.637 -2.390 1.00 . A A . 11 LYS N 1 1 1 145 1 1 11 LYS NZ N 7.062 -4.850 -6.117 1.00 . A A . 11 LYS NZ 1 1 1 146 1 1 11 LYS O O 4.108 -6.859 -1.823 1.00 . A A . 11 LYS O 1 1 1 147 1 1 12 ALA C C 1.950 -5.557 0.006 1.00 . A A . 12 ALA C 1 1 1 148 1 1 12 ALA CA C 3.370 -5.696 0.549 1.00 . A A . 12 ALA CA 1 1 1 149 1 1 12 ALA CB C 3.498 -5.004 1.896 1.00 . A A . 12 ALA CB 1 1 1 150 1 1 12 ALA H H 4.796 -4.315 -0.177 1.00 . A A . 12 ALA H 1 1 1 151 1 1 12 ALA HA H 3.596 -6.741 0.679 1.00 . A A . 12 ALA HA 1 1 1 152 1 1 12 ALA HB1 H 2.818 -5.459 2.602 1.00 . A A . 12 ALA HB1 1 1 1 153 1 1 12 ALA HB2 H 3.257 -3.955 1.788 1.00 . A A . 12 ALA HB2 1 1 1 154 1 1 12 ALA HB3 H 4.512 -5.104 2.255 1.00 . A A . 12 ALA HB3 1 1 1 155 1 1 12 ALA N N 4.333 -5.153 -0.391 1.00 . A A . 12 ALA N 1 1 1 156 1 1 12 ALA O O 1.077 -6.388 0.278 1.00 . A A . 12 ALA O 1 1 1 157 1 1 13 ALA C C 0.084 -5.343 -2.383 1.00 . A A . 13 ALA C 1 1 1 158 1 1 13 ALA CA C 0.426 -4.261 -1.379 1.00 . A A . 13 ALA CA 1 1 1 159 1 1 13 ALA CB C 0.351 -2.881 -2.027 1.00 . A A . 13 ALA CB 1 1 1 160 1 1 13 ALA H H 2.471 -3.910 -0.992 1.00 . A A . 13 ALA H 1 1 1 161 1 1 13 ALA HA H -0.303 -4.292 -0.581 1.00 . A A . 13 ALA HA 1 1 1 162 1 1 13 ALA HB1 H 0.951 -2.869 -2.924 1.00 . A A . 13 ALA HB1 1 1 1 163 1 1 13 ALA HB2 H 0.724 -2.138 -1.337 1.00 . A A . 13 ALA HB2 1 1 1 164 1 1 13 ALA HB3 H -0.685 -2.655 -2.276 1.00 . A A . 13 ALA HB3 1 1 1 165 1 1 13 ALA N N 1.731 -4.514 -0.788 1.00 . A A . 13 ALA N 1 1 1 166 1 1 13 ALA O O -1.062 -5.767 -2.463 1.00 . A A . 13 ALA O 1 1 1 167 1 1 14 LEU C C 0.126 -8.034 -3.390 1.00 . A A . 14 LEU C 1 1 1 168 1 1 14 LEU CA C 0.935 -6.933 -4.046 1.00 . A A . 14 LEU CA 1 1 1 169 1 1 14 LEU CB C 2.292 -7.540 -4.416 1.00 . A A . 14 LEU CB 1 1 1 170 1 1 14 LEU CD1 C 2.901 -5.289 -5.420 1.00 . A A . 14 LEU CD1 1 1 1 171 1 1 14 LEU CD2 C 4.627 -7.048 -5.039 1.00 . A A . 14 LEU CD2 1 1 1 172 1 1 14 LEU CG C 3.181 -6.784 -5.407 1.00 . A A . 14 LEU CG 1 1 1 173 1 1 14 LEU H H 1.982 -5.387 -3.031 1.00 . A A . 14 LEU H 1 1 1 174 1 1 14 LEU HA H 0.432 -6.587 -4.935 1.00 . A A . 14 LEU HA 1 1 1 175 1 1 14 LEU HB2 H 2.854 -7.660 -3.502 1.00 . A A . 14 LEU HB2 1 1 1 176 1 1 14 LEU HB3 H 2.107 -8.524 -4.822 1.00 . A A . 14 LEU HB3 1 1 1 177 1 1 14 LEU HD11 H 3.090 -4.879 -4.439 1.00 . A A . 14 LEU HD11 1 1 1 178 1 1 14 LEU HD12 H 1.869 -5.118 -5.690 1.00 . A A . 14 LEU HD12 1 1 1 179 1 1 14 LEU HD13 H 3.546 -4.809 -6.141 1.00 . A A . 14 LEU HD13 1 1 1 180 1 1 14 LEU HD21 H 4.870 -8.078 -5.249 1.00 . A A . 14 LEU HD21 1 1 1 181 1 1 14 LEU HD22 H 4.759 -6.862 -3.977 1.00 . A A . 14 LEU HD22 1 1 1 182 1 1 14 LEU HD23 H 5.275 -6.395 -5.605 1.00 . A A . 14 LEU HD23 1 1 1 183 1 1 14 LEU HG H 3.014 -7.168 -6.402 1.00 . A A . 14 LEU HG 1 1 1 184 1 1 14 LEU N N 1.097 -5.811 -3.116 1.00 . A A . 14 LEU N 1 1 1 185 1 1 14 LEU O O -0.743 -8.656 -4.003 1.00 . A A . 14 LEU O 1 1 1 186 1 1 15 LYS C C -1.393 -8.957 -0.659 1.00 . A A . 15 LYS C 1 1 1 187 1 1 15 LYS CA C -0.114 -9.355 -1.388 1.00 . A A . 15 LYS CA 1 1 1 188 1 1 15 LYS CB C 0.946 -9.802 -0.398 1.00 . A A . 15 LYS CB 1 1 1 189 1 1 15 LYS CD C 2.279 -11.013 -2.121 1.00 . A A . 15 LYS CD 1 1 1 190 1 1 15 LYS CE C 3.593 -11.079 -2.867 1.00 . A A . 15 LYS CE 1 1 1 191 1 1 15 LYS CG C 2.303 -9.946 -1.051 1.00 . A A . 15 LYS CG 1 1 1 192 1 1 15 LYS H H 1.031 -7.628 -1.659 1.00 . A A . 15 LYS H 1 1 1 193 1 1 15 LYS HA H -0.304 -10.152 -2.079 1.00 . A A . 15 LYS HA 1 1 1 194 1 1 15 LYS HB2 H 1.023 -9.061 0.380 1.00 . A A . 15 LYS HB2 1 1 1 195 1 1 15 LYS HB3 H 0.663 -10.751 0.030 1.00 . A A . 15 LYS HB3 1 1 1 196 1 1 15 LYS HD2 H 2.085 -11.971 -1.665 1.00 . A A . 15 LYS HD2 1 1 1 197 1 1 15 LYS HD3 H 1.492 -10.771 -2.819 1.00 . A A . 15 LYS HD3 1 1 1 198 1 1 15 LYS HE2 H 3.728 -10.151 -3.398 1.00 . A A . 15 LYS HE2 1 1 1 199 1 1 15 LYS HE3 H 4.394 -11.209 -2.155 1.00 . A A . 15 LYS HE3 1 1 1 200 1 1 15 LYS HG2 H 2.561 -8.999 -1.516 1.00 . A A . 15 LYS HG2 1 1 1 201 1 1 15 LYS HG3 H 3.035 -10.204 -0.303 1.00 . A A . 15 LYS HG3 1 1 1 202 1 1 15 LYS HZ1 H 4.552 -12.252 -4.302 1.00 . A A . 15 LYS HZ1 1 1 1 203 1 1 15 LYS HZ2 H 2.888 -12.062 -4.572 1.00 . A A . 15 LYS HZ2 1 1 1 204 1 1 15 LYS HZ3 H 3.438 -13.105 -3.350 1.00 . A A . 15 LYS HZ3 1 1 1 205 1 1 15 LYS N N 0.425 -8.247 -2.119 1.00 . A A . 15 LYS N 1 1 1 206 1 1 15 LYS NZ N 3.618 -12.201 -3.838 1.00 . A A . 15 LYS NZ 1 1 1 207 1 1 15 LYS O O -2.487 -9.382 -1.025 1.00 . A A . 15 LYS O 1 1 1 208 1 1 16 GLY C C -2.725 -6.264 0.846 1.00 . A A . 16 GLY C 1 1 1 209 1 1 16 GLY CA C -2.368 -7.680 1.135 1.00 . A A . 16 GLY CA 1 1 1 210 1 1 16 GLY H H -0.357 -7.760 0.557 1.00 . A A . 16 GLY H 1 1 1 211 1 1 16 GLY HA2 H -3.214 -8.307 0.911 1.00 . A A . 16 GLY HA2 1 1 1 212 1 1 16 GLY HA3 H -2.142 -7.756 2.177 1.00 . A A . 16 GLY HA3 1 1 1 213 1 1 16 GLY N N -1.240 -8.129 0.365 1.00 . A A . 16 GLY N 1 1 1 214 1 1 16 GLY O O -3.811 -5.957 0.381 1.00 . A A . 16 GLY O 1 1 1 215 1 1 17 LEU C C -2.547 -3.304 0.065 1.00 . A A . 17 LEU C 1 1 1 216 1 1 17 LEU CA C -1.960 -3.991 1.291 1.00 . A A . 17 LEU CA 1 1 1 217 1 1 17 LEU CB C -0.661 -3.306 1.719 1.00 . A A . 17 LEU CB 1 1 1 218 1 1 17 LEU CD1 C -1.341 -3.140 4.138 1.00 . A A . 17 LEU CD1 1 1 1 219 1 1 17 LEU CD2 C 0.199 -4.978 3.415 1.00 . A A . 17 LEU CD2 1 1 1 220 1 1 17 LEU CG C -0.228 -3.534 3.177 1.00 . A A . 17 LEU CG 1 1 1 221 1 1 17 LEU H H -0.846 -5.749 1.222 1.00 . A A . 17 LEU H 1 1 1 222 1 1 17 LEU HA H -2.661 -3.890 2.093 1.00 . A A . 17 LEU HA 1 1 1 223 1 1 17 LEU HB2 H 0.131 -3.661 1.073 1.00 . A A . 17 LEU HB2 1 1 1 224 1 1 17 LEU HB3 H -0.783 -2.241 1.567 1.00 . A A . 17 LEU HB3 1 1 1 225 1 1 17 LEU HD11 H -2.220 -3.736 3.938 1.00 . A A . 17 LEU HD11 1 1 1 226 1 1 17 LEU HD12 H -1.579 -2.094 4.003 1.00 . A A . 17 LEU HD12 1 1 1 227 1 1 17 LEU HD13 H -1.016 -3.305 5.153 1.00 . A A . 17 LEU HD13 1 1 1 228 1 1 17 LEU HD21 H 0.466 -5.110 4.454 1.00 . A A . 17 LEU HD21 1 1 1 229 1 1 17 LEU HD22 H 1.053 -5.207 2.794 1.00 . A A . 17 LEU HD22 1 1 1 230 1 1 17 LEU HD23 H -0.617 -5.642 3.166 1.00 . A A . 17 LEU HD23 1 1 1 231 1 1 17 LEU HG H 0.622 -2.899 3.388 1.00 . A A . 17 LEU HG 1 1 1 232 1 1 17 LEU N N -1.750 -5.407 1.121 1.00 . A A . 17 LEU N 1 1 1 233 1 1 17 LEU O O -2.935 -2.149 0.138 1.00 . A A . 17 LEU O 1 1 1 234 1 1 18 ALA C C -4.867 -3.319 -1.796 1.00 . A A . 18 ALA C 1 1 1 235 1 1 18 ALA CA C -3.389 -3.391 -2.160 1.00 . A A . 18 ALA CA 1 1 1 236 1 1 18 ALA CB C -3.196 -4.120 -3.472 1.00 . A A . 18 ALA CB 1 1 1 237 1 1 18 ALA H H -2.244 -4.879 -1.150 1.00 . A A . 18 ALA H 1 1 1 238 1 1 18 ALA HA H -3.003 -2.388 -2.279 1.00 . A A . 18 ALA HA 1 1 1 239 1 1 18 ALA HB1 H -3.779 -5.028 -3.473 1.00 . A A . 18 ALA HB1 1 1 1 240 1 1 18 ALA HB2 H -2.151 -4.361 -3.596 1.00 . A A . 18 ALA HB2 1 1 1 241 1 1 18 ALA HB3 H -3.516 -3.477 -4.280 1.00 . A A . 18 ALA HB3 1 1 1 242 1 1 18 ALA N N -2.656 -3.986 -1.060 1.00 . A A . 18 ALA N 1 1 1 243 1 1 18 ALA O O -5.685 -2.754 -2.526 1.00 . A A . 18 ALA O 1 1 1 244 1 1 19 LYS C C -6.661 -2.390 0.497 1.00 . A A . 19 LYS C 1 1 1 245 1 1 19 LYS CA C -6.491 -3.800 -0.064 1.00 . A A . 19 LYS CA 1 1 1 246 1 1 19 LYS CB C -6.626 -4.897 1.015 1.00 . A A . 19 LYS CB 1 1 1 247 1 1 19 LYS CD C -6.576 -3.876 3.331 1.00 . A A . 19 LYS CD 1 1 1 248 1 1 19 LYS CE C -7.944 -4.458 3.636 1.00 . A A . 19 LYS CE 1 1 1 249 1 1 19 LYS CG C -5.824 -4.704 2.305 1.00 . A A . 19 LYS CG 1 1 1 250 1 1 19 LYS H H -4.535 -4.485 -0.192 1.00 . A A . 19 LYS H 1 1 1 251 1 1 19 LYS HA H -7.227 -3.964 -0.836 1.00 . A A . 19 LYS HA 1 1 1 252 1 1 19 LYS HB2 H -7.647 -4.983 1.279 1.00 . A A . 19 LYS HB2 1 1 1 253 1 1 19 LYS HB3 H -6.298 -5.825 0.578 1.00 . A A . 19 LYS HB3 1 1 1 254 1 1 19 LYS HD2 H -5.999 -3.831 4.243 1.00 . A A . 19 LYS HD2 1 1 1 255 1 1 19 LYS HD3 H -6.696 -2.883 2.928 1.00 . A A . 19 LYS HD3 1 1 1 256 1 1 19 LYS HE2 H -8.486 -4.555 2.708 1.00 . A A . 19 LYS HE2 1 1 1 257 1 1 19 LYS HE3 H -7.815 -5.433 4.083 1.00 . A A . 19 LYS HE3 1 1 1 258 1 1 19 LYS HG2 H -5.607 -5.671 2.733 1.00 . A A . 19 LYS HG2 1 1 1 259 1 1 19 LYS HG3 H -4.900 -4.199 2.065 1.00 . A A . 19 LYS HG3 1 1 1 260 1 1 19 LYS HZ1 H -8.895 -2.659 4.129 1.00 . A A . 19 LYS HZ1 1 1 1 261 1 1 19 LYS HZ2 H -8.203 -3.460 5.456 1.00 . A A . 19 LYS HZ2 1 1 1 262 1 1 19 LYS HZ3 H -9.644 -4.039 4.778 1.00 . A A . 19 LYS HZ3 1 1 1 263 1 1 19 LYS N N -5.196 -3.917 -0.653 1.00 . A A . 19 LYS N 1 1 1 264 1 1 19 LYS NZ N -8.723 -3.595 4.563 1.00 . A A . 19 LYS NZ 1 1 1 265 1 1 19 LYS O O -7.555 -1.654 0.084 1.00 . A A . 19 LYS O 1 1 1 266 1 1 20 VAL C C -5.571 0.399 1.206 1.00 . A A . 20 VAL C 1 1 1 267 1 1 20 VAL CA C -5.750 -0.768 2.131 1.00 . A A . 20 VAL CA 1 1 1 268 1 1 20 VAL CB C -4.621 -0.754 3.170 1.00 . A A . 20 VAL CB 1 1 1 269 1 1 20 VAL CG1 C -3.288 -0.707 2.464 1.00 . A A . 20 VAL CG1 1 1 1 270 1 1 20 VAL CG2 C -4.771 0.388 4.157 1.00 . A A . 20 VAL CG2 1 1 1 271 1 1 20 VAL H H -4.879 -2.547 1.373 1.00 . A A . 20 VAL H 1 1 1 272 1 1 20 VAL HA H -6.707 -0.709 2.632 1.00 . A A . 20 VAL HA 1 1 1 273 1 1 20 VAL HB H -4.666 -1.671 3.711 1.00 . A A . 20 VAL HB 1 1 1 274 1 1 20 VAL HG11 H -2.977 -1.724 2.240 1.00 . A A . 20 VAL HG11 1 1 1 275 1 1 20 VAL HG12 H -2.555 -0.224 3.088 1.00 . A A . 20 VAL HG12 1 1 1 276 1 1 20 VAL HG13 H -3.402 -0.161 1.523 1.00 . A A . 20 VAL HG13 1 1 1 277 1 1 20 VAL HG21 H -3.966 0.350 4.877 1.00 . A A . 20 VAL HG21 1 1 1 278 1 1 20 VAL HG22 H -5.716 0.300 4.670 1.00 . A A . 20 VAL HG22 1 1 1 279 1 1 20 VAL HG23 H -4.735 1.329 3.627 1.00 . A A . 20 VAL HG23 1 1 1 280 1 1 20 VAL N N -5.692 -1.998 1.330 1.00 . A A . 20 VAL N 1 1 1 281 1 1 20 VAL O O -5.926 1.540 1.468 1.00 . A A . 20 VAL O 1 1 1 282 1 1 21 LEU C C -6.026 1.708 -1.339 1.00 . A A . 21 LEU C 1 1 1 283 1 1 21 LEU CA C -4.786 0.909 -0.984 1.00 . A A . 21 LEU CA 1 1 1 284 1 1 21 LEU CB C -4.439 0.010 -2.110 1.00 . A A . 21 LEU CB 1 1 1 285 1 1 21 LEU CD1 C -3.439 1.684 -3.603 1.00 . A A . 21 LEU CD1 1 1 1 286 1 1 21 LEU CD2 C -2.057 0.575 -1.845 1.00 . A A . 21 LEU CD2 1 1 1 287 1 1 21 LEU CG C -3.193 0.395 -2.841 1.00 . A A . 21 LEU CG 1 1 1 288 1 1 21 LEU H H -4.616 -0.858 0.078 1.00 . A A . 21 LEU H 1 1 1 289 1 1 21 LEU HA H -3.962 1.565 -0.781 1.00 . A A . 21 LEU HA 1 1 1 290 1 1 21 LEU HB2 H -4.306 -0.986 -1.701 1.00 . A A . 21 LEU HB2 1 1 1 291 1 1 21 LEU HB3 H -5.272 0.000 -2.796 1.00 . A A . 21 LEU HB3 1 1 1 292 1 1 21 LEU HD11 H -2.522 2.012 -4.067 1.00 . A A . 21 LEU HD11 1 1 1 293 1 1 21 LEU HD12 H -3.789 2.440 -2.908 1.00 . A A . 21 LEU HD12 1 1 1 294 1 1 21 LEU HD13 H -4.193 1.519 -4.358 1.00 . A A . 21 LEU HD13 1 1 1 295 1 1 21 LEU HD21 H -1.149 0.154 -2.246 1.00 . A A . 21 LEU HD21 1 1 1 296 1 1 21 LEU HD22 H -2.316 0.079 -0.910 1.00 . A A . 21 LEU HD22 1 1 1 297 1 1 21 LEU HD23 H -1.914 1.636 -1.660 1.00 . A A . 21 LEU HD23 1 1 1 298 1 1 21 LEU HG H -2.941 -0.396 -3.524 1.00 . A A . 21 LEU HG 1 1 1 299 1 1 21 LEU N N -4.979 0.054 0.126 1.00 . A A . 21 LEU N 1 1 1 300 1 1 21 LEU O O -6.041 2.925 -1.233 1.00 . A A . 21 LEU O 1 1 1 301 1 1 22 ALA C C -9.042 2.362 -1.190 1.00 . A A . 22 ALA C 1 1 1 302 1 1 22 ALA CA C -8.297 1.587 -2.256 1.00 . A A . 22 ALA CA 1 1 1 303 1 1 22 ALA CB C -9.182 0.502 -2.819 1.00 . A A . 22 ALA CB 1 1 1 304 1 1 22 ALA H H -7.032 0.024 -1.566 1.00 . A A . 22 ALA H 1 1 1 305 1 1 22 ALA HA H -8.025 2.249 -3.060 1.00 . A A . 22 ALA HA 1 1 1 306 1 1 22 ALA HB1 H -8.658 -0.014 -3.607 1.00 . A A . 22 ALA HB1 1 1 1 307 1 1 22 ALA HB2 H -10.081 0.946 -3.212 1.00 . A A . 22 ALA HB2 1 1 1 308 1 1 22 ALA HB3 H -9.433 -0.193 -2.033 1.00 . A A . 22 ALA HB3 1 1 1 309 1 1 22 ALA N N -7.072 0.991 -1.705 1.00 . A A . 22 ALA N 1 1 1 310 1 1 22 ALA O O -10.045 3.026 -1.439 1.00 . A A . 22 ALA O 1 1 1 311 1 1 23 GLU C C -8.555 4.109 1.569 1.00 . A A . 23 GLU C 1 1 1 312 1 1 23 GLU CA C -9.100 2.742 1.204 1.00 . A A . 23 GLU CA 1 1 1 313 1 1 23 GLU CB C -8.707 1.762 2.275 1.00 . A A . 23 GLU CB 1 1 1 314 1 1 23 GLU CD C -9.560 -0.613 2.462 1.00 . A A . 23 GLU CD 1 1 1 315 1 1 23 GLU CG C -8.631 0.348 1.749 1.00 . A A . 23 GLU CG 1 1 1 316 1 1 23 GLU H H -7.644 1.790 0.056 1.00 . A A . 23 GLU H 1 1 1 317 1 1 23 GLU HA H -10.164 2.763 1.104 1.00 . A A . 23 GLU HA 1 1 1 318 1 1 23 GLU HB2 H -7.718 2.034 2.627 1.00 . A A . 23 GLU HB2 1 1 1 319 1 1 23 GLU HB3 H -9.407 1.804 3.090 1.00 . A A . 23 GLU HB3 1 1 1 320 1 1 23 GLU HG2 H -8.851 0.356 0.681 1.00 . A A . 23 GLU HG2 1 1 1 321 1 1 23 GLU HG3 H -7.611 0.007 1.868 1.00 . A A . 23 GLU HG3 1 1 1 322 1 1 23 GLU N N -8.505 2.249 -0.008 1.00 . A A . 23 GLU N 1 1 1 323 1 1 23 GLU O O -9.292 5.033 1.892 1.00 . A A . 23 GLU O 1 1 1 324 1 1 23 GLU OE1 O -9.149 -1.181 3.496 1.00 . A A . 23 GLU OE1 1 1 1 325 1 1 23 GLU OE2 O -10.699 -0.808 1.992 1.00 . A A . 23 GLU OE2 1 1 1 326 1 1 24 LYS C C -5.942 6.084 0.837 1.00 . A A . 24 LYS C 1 1 1 327 1 1 24 LYS CA C -6.490 5.335 2.031 1.00 . A A . 24 LYS CA 1 1 1 328 1 1 24 LYS CB C -5.327 4.854 2.875 1.00 . A A . 24 LYS CB 1 1 1 329 1 1 24 LYS CD C -6.275 3.530 4.868 1.00 . A A . 24 LYS CD 1 1 1 330 1 1 24 LYS CE C -7.682 4.094 4.780 1.00 . A A . 24 LYS CE 1 1 1 331 1 1 24 LYS CG C -5.570 3.492 3.517 1.00 . A A . 24 LYS CG 1 1 1 332 1 1 24 LYS H H -6.729 3.353 1.407 1.00 . A A . 24 LYS H 1 1 1 333 1 1 24 LYS HA H -7.118 5.981 2.612 1.00 . A A . 24 LYS HA 1 1 1 334 1 1 24 LYS HB2 H -4.454 4.774 2.242 1.00 . A A . 24 LYS HB2 1 1 1 335 1 1 24 LYS HB3 H -5.133 5.566 3.630 1.00 . A A . 24 LYS HB3 1 1 1 336 1 1 24 LYS HD2 H -6.337 2.513 5.241 1.00 . A A . 24 LYS HD2 1 1 1 337 1 1 24 LYS HD3 H -5.693 4.132 5.551 1.00 . A A . 24 LYS HD3 1 1 1 338 1 1 24 LYS HE2 H -7.626 5.172 4.816 1.00 . A A . 24 LYS HE2 1 1 1 339 1 1 24 LYS HE3 H -8.112 3.789 3.838 1.00 . A A . 24 LYS HE3 1 1 1 340 1 1 24 LYS HG2 H -6.189 2.915 2.836 1.00 . A A . 24 LYS HG2 1 1 1 341 1 1 24 LYS HG3 H -4.620 2.992 3.635 1.00 . A A . 24 LYS HG3 1 1 1 342 1 1 24 LYS HZ1 H -8.079 3.766 6.807 1.00 . A A . 24 LYS HZ1 1 1 1 343 1 1 24 LYS HZ2 H -8.749 2.599 5.775 1.00 . A A . 24 LYS HZ2 1 1 1 344 1 1 24 LYS HZ3 H -9.456 4.139 5.884 1.00 . A A . 24 LYS HZ3 1 1 1 345 1 1 24 LYS N N -7.237 4.161 1.628 1.00 . A A . 24 LYS N 1 1 1 346 1 1 24 LYS NZ N -8.551 3.617 5.888 1.00 . A A . 24 LYS NZ 1 1 1 347 1 1 24 LYS O O -6.172 7.276 0.649 1.00 . A A . 24 LYS O 1 1 1 348 1 1 25 TYR C C -5.172 6.105 -2.241 1.00 . A A . 25 TYR C 1 1 1 349 1 1 25 TYR CA C -4.363 5.869 -0.989 1.00 . A A . 25 TYR CA 1 1 1 350 1 1 25 TYR CB C -3.291 4.844 -1.304 1.00 . A A . 25 TYR CB 1 1 1 351 1 1 25 TYR CD1 C -3.268 3.446 0.676 1.00 . A A . 25 TYR CD1 1 1 1 352 1 1 25 TYR CD2 C -1.267 4.612 0.193 1.00 . A A . 25 TYR CD2 1 1 1 353 1 1 25 TYR CE1 C -2.705 2.885 1.761 1.00 . A A . 25 TYR CE1 1 1 1 354 1 1 25 TYR CE2 C -0.668 4.050 1.307 1.00 . A A . 25 TYR CE2 1 1 1 355 1 1 25 TYR CG C -2.584 4.308 -0.118 1.00 . A A . 25 TYR CG 1 1 1 356 1 1 25 TYR CZ C -1.396 3.178 2.093 1.00 . A A . 25 TYR CZ 1 1 1 357 1 1 25 TYR H H -5.236 4.366 0.151 1.00 . A A . 25 TYR H 1 1 1 358 1 1 25 TYR HA H -3.919 6.774 -0.626 1.00 . A A . 25 TYR HA 1 1 1 359 1 1 25 TYR HB2 H -3.777 3.999 -1.749 1.00 . A A . 25 TYR HB2 1 1 1 360 1 1 25 TYR HB3 H -2.576 5.247 -1.980 1.00 . A A . 25 TYR HB3 1 1 1 361 1 1 25 TYR HD1 H -4.305 3.230 0.429 1.00 . A A . 25 TYR HD1 1 1 1 362 1 1 25 TYR HD2 H -0.716 5.296 -0.432 1.00 . A A . 25 TYR HD2 1 1 1 363 1 1 25 TYR HE1 H -3.293 2.221 2.337 1.00 . A A . 25 TYR HE1 1 1 1 364 1 1 25 TYR HE2 H 0.355 4.290 1.555 1.00 . A A . 25 TYR HE2 1 1 1 365 1 1 25 TYR HH H -1.033 1.667 3.228 1.00 . A A . 25 TYR HH 1 1 1 366 1 1 25 TYR N N -5.208 5.336 0.043 1.00 . A A . 25 TYR N 1 1 1 367 1 1 25 TYR O O -5.251 7.215 -2.764 1.00 . A A . 25 TYR O 1 1 1 368 1 1 25 TYR OH O -0.817 2.603 3.205 1.00 . A A . 25 TYR OH 1 1 1 369 1 1 26 ALA C C -7.909 5.775 -3.553 1.00 . A A . 26 ALA C 1 1 1 370 1 1 26 ALA CA C -6.628 5.028 -3.871 1.00 . A A . 26 ALA CA 1 1 1 371 1 1 26 ALA CB C -6.926 3.603 -4.288 1.00 . A A . 26 ALA CB 1 1 1 372 1 1 26 ALA H H -5.635 4.147 -2.215 1.00 . A A . 26 ALA H 1 1 1 373 1 1 26 ALA HA H -6.107 5.525 -4.676 1.00 . A A . 26 ALA HA 1 1 1 374 1 1 26 ALA HB1 H -7.403 3.083 -3.461 1.00 . A A . 26 ALA HB1 1 1 1 375 1 1 26 ALA HB2 H -6.003 3.103 -4.540 1.00 . A A . 26 ALA HB2 1 1 1 376 1 1 26 ALA HB3 H -7.585 3.604 -5.142 1.00 . A A . 26 ALA HB3 1 1 1 377 1 1 26 ALA N N -5.770 5.013 -2.701 1.00 . A A . 26 ALA N 1 1 1 378 1 1 26 ALA O O -8.647 6.187 -4.447 1.00 . A A . 26 ALA O 1 1 1 379 1 1 27 ASN C C -9.315 8.083 -2.389 1.00 . A A . 27 ASN C 1 1 1 380 1 1 27 ASN CA C -9.257 6.706 -1.735 1.00 . A A . 27 ASN CA 1 1 1 381 1 1 27 ASN CB C -9.081 6.851 -0.231 1.00 . A A . 27 ASN CB 1 1 1 382 1 1 27 ASN CG C -10.174 7.673 0.426 1.00 . A A . 27 ASN CG 1 1 1 383 1 1 27 ASN H H -7.565 5.451 -1.617 1.00 . A A . 27 ASN H 1 1 1 384 1 1 27 ASN HA H -10.175 6.178 -1.937 1.00 . A A . 27 ASN HA 1 1 1 385 1 1 27 ASN HB2 H -9.075 5.864 0.218 1.00 . A A . 27 ASN HB2 1 1 1 386 1 1 27 ASN HB3 H -8.128 7.320 -0.032 1.00 . A A . 27 ASN HB3 1 1 1 387 1 1 27 ASN HD21 H -9.068 9.321 0.291 1.00 . A A . 27 ASN HD21 1 1 1 388 1 1 27 ASN HD22 H -10.628 9.515 1.019 1.00 . A A . 27 ASN HD22 1 1 1 389 1 1 27 ASN N N -8.153 5.914 -2.257 1.00 . A A . 27 ASN N 1 1 1 390 1 1 27 ASN ND2 N -9.935 8.965 0.594 1.00 . A A . 27 ASN ND2 1 1 1 391 1 1 27 ASN O O -10.263 8.340 -3.161 1.00 . A A . 27 ASN O 1 1 1 392 1 1 27 ASN OXT O -8.398 8.898 -2.148 1.00 . A A . 27 ASN OXT 1 1 1 393 1 1 27 ASN OD1 O -11.220 7.146 0.800 1.00 . A A . 27 ASN OD1 1 1 2 394 1 1 1 GLY C C 12.942 3.899 3.008 1.00 . A A . 1 GLY C 1 1 2 395 1 1 1 GLY CA C 13.684 3.525 1.741 1.00 . A A . 1 GLY CA 1 1 2 396 1 1 1 GLY H1 H 15.393 4.672 2.089 1.00 . A A . 1 GLY H1 1 1 2 397 1 1 1 GLY H2 H 15.631 3.385 1.006 1.00 . A A . 1 GLY H2 1 1 2 398 1 1 1 GLY H3 H 15.494 3.080 2.667 1.00 . A A . 1 GLY H3 1 1 2 399 1 1 1 GLY HA2 H 13.342 4.158 0.938 1.00 . A A . 1 GLY HA2 1 1 2 400 1 1 1 GLY HA3 H 13.459 2.498 1.499 1.00 . A A . 1 GLY HA3 1 1 2 401 1 1 1 GLY N N 15.151 3.677 1.884 1.00 . A A . 1 GLY N 1 1 2 402 1 1 1 GLY O O 13.547 4.055 4.070 1.00 . A A . 1 GLY O 1 1 2 403 1 1 2 ILE C C 10.020 3.164 4.489 1.00 . A A . 2 ILE C 1 1 2 404 1 1 2 ILE CA C 10.797 4.389 4.032 1.00 . A A . 2 ILE CA 1 1 2 405 1 1 2 ILE CB C 9.795 5.502 3.674 1.00 . A A . 2 ILE CB 1 1 2 406 1 1 2 ILE CD1 C 9.598 7.904 2.842 1.00 . A A . 2 ILE CD1 1 1 2 407 1 1 2 ILE CG1 C 10.524 6.787 3.283 1.00 . A A . 2 ILE CG1 1 1 2 408 1 1 2 ILE CG2 C 8.847 5.740 4.828 1.00 . A A . 2 ILE CG2 1 1 2 409 1 1 2 ILE H H 11.203 3.941 2.018 1.00 . A A . 2 ILE H 1 1 2 410 1 1 2 ILE HA H 11.431 4.736 4.835 1.00 . A A . 2 ILE HA 1 1 2 411 1 1 2 ILE HB H 9.209 5.163 2.831 1.00 . A A . 2 ILE HB 1 1 2 412 1 1 2 ILE HD11 H 9.047 7.593 1.968 1.00 . A A . 2 ILE HD11 1 1 2 413 1 1 2 ILE HD12 H 10.183 8.780 2.607 1.00 . A A . 2 ILE HD12 1 1 2 414 1 1 2 ILE HD13 H 8.909 8.135 3.641 1.00 . A A . 2 ILE HD13 1 1 2 415 1 1 2 ILE HG12 H 11.093 7.143 4.127 1.00 . A A . 2 ILE HG12 1 1 2 416 1 1 2 ILE HG13 H 11.197 6.573 2.464 1.00 . A A . 2 ILE HG13 1 1 2 417 1 1 2 ILE HG21 H 8.326 4.818 5.050 1.00 . A A . 2 ILE HG21 1 1 2 418 1 1 2 ILE HG22 H 8.136 6.505 4.559 1.00 . A A . 2 ILE HG22 1 1 2 419 1 1 2 ILE HG23 H 9.409 6.052 5.693 1.00 . A A . 2 ILE HG23 1 1 2 420 1 1 2 ILE N N 11.629 4.054 2.895 1.00 . A A . 2 ILE N 1 1 2 421 1 1 2 ILE O O 10.317 2.560 5.518 1.00 . A A . 2 ILE O 1 1 2 422 1 1 3 GLY C C 6.804 1.851 3.465 1.00 . A A . 3 GLY C 1 1 2 423 1 1 3 GLY CA C 8.211 1.663 3.980 1.00 . A A . 3 GLY CA 1 1 2 424 1 1 3 GLY H H 8.798 3.375 2.936 1.00 . A A . 3 GLY H 1 1 2 425 1 1 3 GLY HA2 H 8.656 0.811 3.500 1.00 . A A . 3 GLY HA2 1 1 2 426 1 1 3 GLY HA3 H 8.177 1.498 5.045 1.00 . A A . 3 GLY HA3 1 1 2 427 1 1 3 GLY N N 9.015 2.818 3.705 1.00 . A A . 3 GLY N 1 1 2 428 1 1 3 GLY O O 6.471 1.423 2.356 1.00 . A A . 3 GLY O 1 1 2 429 1 1 4 GLY C C 4.450 4.038 3.044 1.00 . A A . 4 GLY C 1 1 2 430 1 1 4 GLY CA C 4.620 2.797 3.894 1.00 . A A . 4 GLY CA 1 1 2 431 1 1 4 GLY H H 6.375 2.965 5.058 1.00 . A A . 4 GLY H 1 1 2 432 1 1 4 GLY HA2 H 4.252 1.945 3.348 1.00 . A A . 4 GLY HA2 1 1 2 433 1 1 4 GLY HA3 H 4.045 2.910 4.801 1.00 . A A . 4 GLY HA3 1 1 2 434 1 1 4 GLY N N 6.009 2.567 4.240 1.00 . A A . 4 GLY N 1 1 2 435 1 1 4 GLY O O 3.562 4.855 3.285 1.00 . A A . 4 GLY O 1 1 2 436 1 1 5 VAL C C 4.769 4.983 -0.203 1.00 . A A . 5 VAL C 1 1 2 437 1 1 5 VAL CA C 5.326 5.330 1.183 1.00 . A A . 5 VAL CA 1 1 2 438 1 1 5 VAL CB C 6.762 5.895 1.074 1.00 . A A . 5 VAL CB 1 1 2 439 1 1 5 VAL CG1 C 7.780 4.773 0.897 1.00 . A A . 5 VAL CG1 1 1 2 440 1 1 5 VAL CG2 C 6.869 6.886 -0.066 1.00 . A A . 5 VAL CG2 1 1 2 441 1 1 5 VAL H H 5.960 3.454 1.893 1.00 . A A . 5 VAL H 1 1 2 442 1 1 5 VAL HA H 4.697 6.087 1.631 1.00 . A A . 5 VAL HA 1 1 2 443 1 1 5 VAL HB H 6.990 6.415 1.993 1.00 . A A . 5 VAL HB 1 1 2 444 1 1 5 VAL HG11 H 7.595 4.261 -0.037 1.00 . A A . 5 VAL HG11 1 1 2 445 1 1 5 VAL HG12 H 7.689 4.072 1.714 1.00 . A A . 5 VAL HG12 1 1 2 446 1 1 5 VAL HG13 H 8.777 5.191 0.888 1.00 . A A . 5 VAL HG13 1 1 2 447 1 1 5 VAL HG21 H 6.707 6.364 -1.000 1.00 . A A . 5 VAL HG21 1 1 2 448 1 1 5 VAL HG22 H 7.852 7.329 -0.064 1.00 . A A . 5 VAL HG22 1 1 2 449 1 1 5 VAL HG23 H 6.122 7.655 0.055 1.00 . A A . 5 VAL HG23 1 1 2 450 1 1 5 VAL N N 5.312 4.169 2.051 1.00 . A A . 5 VAL N 1 1 2 451 1 1 5 VAL O O 3.865 5.650 -0.705 1.00 . A A . 5 VAL O 1 1 2 452 1 1 6 LEU C C 5.765 2.241 -2.453 1.00 . A A . 6 LEU C 1 1 2 453 1 1 6 LEU CA C 4.890 3.426 -2.099 1.00 . A A . 6 LEU CA 1 1 2 454 1 1 6 LEU CB C 4.951 4.531 -3.194 1.00 . A A . 6 LEU CB 1 1 2 455 1 1 6 LEU CD1 C 7.413 5.078 -2.768 1.00 . A A . 6 LEU CD1 1 1 2 456 1 1 6 LEU CD2 C 6.750 3.906 -4.884 1.00 . A A . 6 LEU CD2 1 1 2 457 1 1 6 LEU CG C 6.325 4.908 -3.816 1.00 . A A . 6 LEU CG 1 1 2 458 1 1 6 LEU H H 6.018 3.441 -0.314 1.00 . A A . 6 LEU H 1 1 2 459 1 1 6 LEU HA H 3.870 3.081 -2.001 1.00 . A A . 6 LEU HA 1 1 2 460 1 1 6 LEU HB2 H 4.307 4.221 -4.003 1.00 . A A . 6 LEU HB2 1 1 2 461 1 1 6 LEU HB3 H 4.532 5.429 -2.765 1.00 . A A . 6 LEU HB3 1 1 2 462 1 1 6 LEU HD11 H 7.481 4.178 -2.169 1.00 . A A . 6 LEU HD11 1 1 2 463 1 1 6 LEU HD12 H 7.171 5.914 -2.128 1.00 . A A . 6 LEU HD12 1 1 2 464 1 1 6 LEU HD13 H 8.360 5.258 -3.255 1.00 . A A . 6 LEU HD13 1 1 2 465 1 1 6 LEU HD21 H 7.721 4.180 -5.269 1.00 . A A . 6 LEU HD21 1 1 2 466 1 1 6 LEU HD22 H 6.030 3.910 -5.688 1.00 . A A . 6 LEU HD22 1 1 2 467 1 1 6 LEU HD23 H 6.800 2.919 -4.450 1.00 . A A . 6 LEU HD23 1 1 2 468 1 1 6 LEU HG H 6.215 5.866 -4.305 1.00 . A A . 6 LEU HG 1 1 2 469 1 1 6 LEU N N 5.313 3.923 -0.789 1.00 . A A . 6 LEU N 1 1 2 470 1 1 6 LEU O O 5.403 1.386 -3.260 1.00 . A A . 6 LEU O 1 1 2 471 1 1 7 LEU C C 7.371 -0.191 -1.628 1.00 . A A . 7 LEU C 1 1 2 472 1 1 7 LEU CA C 7.917 1.173 -2.040 1.00 . A A . 7 LEU CA 1 1 2 473 1 1 7 LEU CB C 9.197 1.496 -1.258 1.00 . A A . 7 LEU CB 1 1 2 474 1 1 7 LEU CD1 C 10.361 -0.624 -1.948 1.00 . A A . 7 LEU CD1 1 1 2 475 1 1 7 LEU CD2 C 10.795 1.542 -3.133 1.00 . A A . 7 LEU CD2 1 1 2 476 1 1 7 LEU CG C 10.479 0.886 -1.808 1.00 . A A . 7 LEU CG 1 1 2 477 1 1 7 LEU H H 7.141 2.954 -1.208 1.00 . A A . 7 LEU H 1 1 2 478 1 1 7 LEU HA H 8.144 1.153 -3.096 1.00 . A A . 7 LEU HA 1 1 2 479 1 1 7 LEU HB2 H 9.326 2.570 -1.258 1.00 . A A . 7 LEU HB2 1 1 2 480 1 1 7 LEU HB3 H 9.071 1.162 -0.239 1.00 . A A . 7 LEU HB3 1 1 2 481 1 1 7 LEU HD11 H 9.406 -0.865 -2.405 1.00 . A A . 7 LEU HD11 1 1 2 482 1 1 7 LEU HD12 H 10.414 -1.081 -0.971 1.00 . A A . 7 LEU HD12 1 1 2 483 1 1 7 LEU HD13 H 11.161 -0.996 -2.567 1.00 . A A . 7 LEU HD13 1 1 2 484 1 1 7 LEU HD21 H 10.683 2.611 -3.025 1.00 . A A . 7 LEU HD21 1 1 2 485 1 1 7 LEU HD22 H 10.108 1.181 -3.885 1.00 . A A . 7 LEU HD22 1 1 2 486 1 1 7 LEU HD23 H 11.808 1.309 -3.422 1.00 . A A . 7 LEU HD23 1 1 2 487 1 1 7 LEU HG H 11.291 1.097 -1.129 1.00 . A A . 7 LEU HG 1 1 2 488 1 1 7 LEU N N 6.927 2.215 -1.817 1.00 . A A . 7 LEU N 1 1 2 489 1 1 7 LEU O O 6.942 -0.980 -2.465 1.00 . A A . 7 LEU O 1 1 2 490 1 1 8 SER C C 5.459 -1.654 0.481 1.00 . A A . 8 SER C 1 1 2 491 1 1 8 SER CA C 6.914 -1.765 0.129 1.00 . A A . 8 SER CA 1 1 2 492 1 1 8 SER CB C 7.739 -2.268 1.305 1.00 . A A . 8 SER CB 1 1 2 493 1 1 8 SER H H 7.594 0.238 0.315 1.00 . A A . 8 SER H 1 1 2 494 1 1 8 SER HA H 7.014 -2.456 -0.697 1.00 . A A . 8 SER HA 1 1 2 495 1 1 8 SER HB2 H 7.285 -3.173 1.682 1.00 . A A . 8 SER HB2 1 1 2 496 1 1 8 SER HB3 H 8.743 -2.483 0.970 1.00 . A A . 8 SER HB3 1 1 2 497 1 1 8 SER HG H 7.222 -1.581 3.075 1.00 . A A . 8 SER HG 1 1 2 498 1 1 8 SER N N 7.361 -0.463 -0.335 1.00 . A A . 8 SER N 1 1 2 499 1 1 8 SER O O 4.742 -2.642 0.608 1.00 . A A . 8 SER O 1 1 2 500 1 1 8 SER OG O 7.800 -1.301 2.340 1.00 . A A . 8 SER OG 1 1 2 501 1 1 9 ALA C C 3.057 -0.527 -0.749 1.00 . A A . 9 ALA C 1 1 2 502 1 1 9 ALA CA C 3.653 -0.039 0.565 1.00 . A A . 9 ALA CA 1 1 2 503 1 1 9 ALA CB C 3.552 1.466 0.671 1.00 . A A . 9 ALA CB 1 1 2 504 1 1 9 ALA H H 5.708 0.291 0.771 1.00 . A A . 9 ALA H 1 1 2 505 1 1 9 ALA HA H 3.137 -0.489 1.398 1.00 . A A . 9 ALA HA 1 1 2 506 1 1 9 ALA HB1 H 2.583 1.792 0.327 1.00 . A A . 9 ALA HB1 1 1 2 507 1 1 9 ALA HB2 H 4.332 1.917 0.065 1.00 . A A . 9 ALA HB2 1 1 2 508 1 1 9 ALA HB3 H 3.689 1.761 1.701 1.00 . A A . 9 ALA HB3 1 1 2 509 1 1 9 ALA N N 5.045 -0.408 0.613 1.00 . A A . 9 ALA N 1 1 2 510 1 1 9 ALA O O 1.847 -0.679 -0.873 1.00 . A A . 9 ALA O 1 1 2 511 1 1 10 GLY C C 3.692 -2.840 -2.966 1.00 . A A . 10 GLY C 1 1 2 512 1 1 10 GLY CA C 3.505 -1.350 -2.973 1.00 . A A . 10 GLY CA 1 1 2 513 1 1 10 GLY H H 4.890 -0.553 -1.593 1.00 . A A . 10 GLY H 1 1 2 514 1 1 10 GLY HA2 H 2.469 -1.129 -3.125 1.00 . A A . 10 GLY HA2 1 1 2 515 1 1 10 GLY HA3 H 4.086 -0.930 -3.780 1.00 . A A . 10 GLY HA3 1 1 2 516 1 1 10 GLY N N 3.932 -0.767 -1.728 1.00 . A A . 10 GLY N 1 1 2 517 1 1 10 GLY O O 2.765 -3.594 -3.235 1.00 . A A . 10 GLY O 1 1 2 518 1 1 11 LYS C C 4.346 -5.499 -1.714 1.00 . A A . 11 LYS C 1 1 2 519 1 1 11 LYS CA C 5.267 -4.656 -2.580 1.00 . A A . 11 LYS CA 1 1 2 520 1 1 11 LYS CB C 6.650 -4.714 -2.036 1.00 . A A . 11 LYS CB 1 1 2 521 1 1 11 LYS CD C 8.926 -3.831 -2.244 1.00 . A A . 11 LYS CD 1 1 2 522 1 1 11 LYS CE C 9.157 -4.802 -1.114 1.00 . A A . 11 LYS CE 1 1 2 523 1 1 11 LYS CG C 7.710 -4.260 -3.008 1.00 . A A . 11 LYS CG 1 1 2 524 1 1 11 LYS H H 5.580 -2.591 -2.381 1.00 . A A . 11 LYS H 1 1 2 525 1 1 11 LYS HA H 5.268 -5.037 -3.583 1.00 . A A . 11 LYS HA 1 1 2 526 1 1 11 LYS HB2 H 6.690 -4.059 -1.175 1.00 . A A . 11 LYS HB2 1 1 2 527 1 1 11 LYS HB3 H 6.869 -5.725 -1.730 1.00 . A A . 11 LYS HB3 1 1 2 528 1 1 11 LYS HD2 H 9.784 -3.818 -2.899 1.00 . A A . 11 LYS HD2 1 1 2 529 1 1 11 LYS HD3 H 8.744 -2.847 -1.837 1.00 . A A . 11 LYS HD3 1 1 2 530 1 1 11 LYS HE2 H 8.273 -4.771 -0.482 1.00 . A A . 11 LYS HE2 1 1 2 531 1 1 11 LYS HE3 H 9.256 -5.795 -1.531 1.00 . A A . 11 LYS HE3 1 1 2 532 1 1 11 LYS HG2 H 7.972 -5.083 -3.652 1.00 . A A . 11 LYS HG2 1 1 2 533 1 1 11 LYS HG3 H 7.338 -3.430 -3.587 1.00 . A A . 11 LYS HG3 1 1 2 534 1 1 11 LYS HZ1 H 11.213 -4.489 -0.937 1.00 . A A . 11 LYS HZ1 1 1 2 535 1 1 11 LYS HZ2 H 10.507 -5.201 0.429 1.00 . A A . 11 LYS HZ2 1 1 2 536 1 1 11 LYS HZ3 H 10.291 -3.547 0.127 1.00 . A A . 11 LYS HZ3 1 1 2 537 1 1 11 LYS N N 4.894 -3.257 -2.620 1.00 . A A . 11 LYS N 1 1 2 538 1 1 11 LYS NZ N 10.374 -4.485 -0.317 1.00 . A A . 11 LYS NZ 1 1 2 539 1 1 11 LYS O O 3.848 -6.538 -2.148 1.00 . A A . 11 LYS O 1 1 2 540 1 1 12 ALA C C 1.828 -5.663 -0.071 1.00 . A A . 12 ALA C 1 1 2 541 1 1 12 ALA CA C 3.262 -5.792 0.412 1.00 . A A . 12 ALA CA 1 1 2 542 1 1 12 ALA CB C 3.412 -5.284 1.839 1.00 . A A . 12 ALA CB 1 1 2 543 1 1 12 ALA H H 4.574 -4.245 -0.175 1.00 . A A . 12 ALA H 1 1 2 544 1 1 12 ALA HA H 3.549 -6.834 0.385 1.00 . A A . 12 ALA HA 1 1 2 545 1 1 12 ALA HB1 H 4.444 -5.373 2.145 1.00 . A A . 12 ALA HB1 1 1 2 546 1 1 12 ALA HB2 H 2.791 -5.871 2.498 1.00 . A A . 12 ALA HB2 1 1 2 547 1 1 12 ALA HB3 H 3.111 -4.248 1.886 1.00 . A A . 12 ALA HB3 1 1 2 548 1 1 12 ALA N N 4.138 -5.071 -0.484 1.00 . A A . 12 ALA N 1 1 2 549 1 1 12 ALA O O 0.986 -6.519 0.202 1.00 . A A . 12 ALA O 1 1 2 550 1 1 13 ALA C C -0.170 -5.425 -2.364 1.00 . A A . 13 ALA C 1 1 2 551 1 1 13 ALA CA C 0.232 -4.359 -1.356 1.00 . A A . 13 ALA CA 1 1 2 552 1 1 13 ALA CB C 0.099 -2.974 -1.969 1.00 . A A . 13 ALA CB 1 1 2 553 1 1 13 ALA H H 2.307 -3.985 -1.048 1.00 . A A . 13 ALA H 1 1 2 554 1 1 13 ALA HA H -0.452 -4.415 -0.520 1.00 . A A . 13 ALA HA 1 1 2 555 1 1 13 ALA HB1 H -0.953 -2.760 -2.149 1.00 . A A . 13 ALA HB1 1 1 2 556 1 1 13 ALA HB2 H 0.640 -2.940 -2.903 1.00 . A A . 13 ALA HB2 1 1 2 557 1 1 13 ALA HB3 H 0.505 -2.241 -1.289 1.00 . A A . 13 ALA HB3 1 1 2 558 1 1 13 ALA N N 1.571 -4.605 -0.831 1.00 . A A . 13 ALA N 1 1 2 559 1 1 13 ALA O O -1.307 -5.892 -2.337 1.00 . A A . 13 ALA O 1 1 2 560 1 1 14 LEU C C -0.003 -8.124 -3.476 1.00 . A A . 14 LEU C 1 1 2 561 1 1 14 LEU CA C 0.464 -6.881 -4.209 1.00 . A A . 14 LEU CA 1 1 2 562 1 1 14 LEU CB C 1.681 -7.271 -5.070 1.00 . A A . 14 LEU CB 1 1 2 563 1 1 14 LEU CD1 C 1.515 -4.954 -6.092 1.00 . A A . 14 LEU CD1 1 1 2 564 1 1 14 LEU CD2 C 3.666 -5.754 -5.065 1.00 . A A . 14 LEU CD2 1 1 2 565 1 1 14 LEU CG C 2.416 -6.153 -5.824 1.00 . A A . 14 LEU CG 1 1 2 566 1 1 14 LEU H H 1.648 -5.407 -3.227 1.00 . A A . 14 LEU H 1 1 2 567 1 1 14 LEU HA H -0.333 -6.530 -4.851 1.00 . A A . 14 LEU HA 1 1 2 568 1 1 14 LEU HB2 H 2.399 -7.751 -4.422 1.00 . A A . 14 LEU HB2 1 1 2 569 1 1 14 LEU HB3 H 1.352 -7.999 -5.798 1.00 . A A . 14 LEU HB3 1 1 2 570 1 1 14 LEU HD11 H 0.670 -5.265 -6.689 1.00 . A A . 14 LEU HD11 1 1 2 571 1 1 14 LEU HD12 H 2.074 -4.197 -6.622 1.00 . A A . 14 LEU HD12 1 1 2 572 1 1 14 LEU HD13 H 1.164 -4.553 -5.153 1.00 . A A . 14 LEU HD13 1 1 2 573 1 1 14 LEU HD21 H 4.351 -6.589 -5.030 1.00 . A A . 14 LEU HD21 1 1 2 574 1 1 14 LEU HD22 H 3.401 -5.476 -4.050 1.00 . A A . 14 LEU HD22 1 1 2 575 1 1 14 LEU HD23 H 4.142 -4.918 -5.555 1.00 . A A . 14 LEU HD23 1 1 2 576 1 1 14 LEU HG H 2.730 -6.538 -6.784 1.00 . A A . 14 LEU HG 1 1 2 577 1 1 14 LEU N N 0.758 -5.827 -3.235 1.00 . A A . 14 LEU N 1 1 2 578 1 1 14 LEU O O -0.780 -8.921 -3.997 1.00 . A A . 14 LEU O 1 1 2 579 1 1 15 LYS C C -1.133 -9.218 -0.696 1.00 . A A . 15 LYS C 1 1 2 580 1 1 15 LYS CA C 0.171 -9.434 -1.462 1.00 . A A . 15 LYS CA 1 1 2 581 1 1 15 LYS CB C 1.322 -9.649 -0.481 1.00 . A A . 15 LYS CB 1 1 2 582 1 1 15 LYS CD C 2.963 -10.699 -2.054 1.00 . A A . 15 LYS CD 1 1 2 583 1 1 15 LYS CE C 2.995 -11.988 -1.267 1.00 . A A . 15 LYS CE 1 1 2 584 1 1 15 LYS CG C 2.685 -9.537 -1.137 1.00 . A A . 15 LYS CG 1 1 2 585 1 1 15 LYS H H 1.085 -7.601 -1.878 1.00 . A A . 15 LYS H 1 1 2 586 1 1 15 LYS HA H 0.091 -10.285 -2.107 1.00 . A A . 15 LYS HA 1 1 2 587 1 1 15 LYS HB2 H 1.261 -8.896 0.282 1.00 . A A . 15 LYS HB2 1 1 2 588 1 1 15 LYS HB3 H 1.236 -10.626 -0.033 1.00 . A A . 15 LYS HB3 1 1 2 589 1 1 15 LYS HD2 H 2.178 -10.745 -2.793 1.00 . A A . 15 LYS HD2 1 1 2 590 1 1 15 LYS HD3 H 3.917 -10.553 -2.538 1.00 . A A . 15 LYS HD3 1 1 2 591 1 1 15 LYS HE2 H 3.796 -11.934 -0.545 1.00 . A A . 15 LYS HE2 1 1 2 592 1 1 15 LYS HE3 H 2.055 -12.082 -0.753 1.00 . A A . 15 LYS HE3 1 1 2 593 1 1 15 LYS HG2 H 2.698 -8.641 -1.720 1.00 . A A . 15 LYS HG2 1 1 2 594 1 1 15 LYS HG3 H 3.448 -9.492 -0.375 1.00 . A A . 15 LYS HG3 1 1 2 595 1 1 15 LYS HZ1 H 2.413 -13.275 -2.802 1.00 . A A . 15 LYS HZ1 1 1 2 596 1 1 15 LYS HZ2 H 3.260 -14.034 -1.545 1.00 . A A . 15 LYS HZ2 1 1 2 597 1 1 15 LYS HZ3 H 4.092 -13.077 -2.670 1.00 . A A . 15 LYS HZ3 1 1 2 598 1 1 15 LYS N N 0.487 -8.282 -2.254 1.00 . A A . 15 LYS N 1 1 2 599 1 1 15 LYS NZ N 3.203 -13.174 -2.130 1.00 . A A . 15 LYS NZ 1 1 2 600 1 1 15 LYS O O -2.165 -9.813 -1.014 1.00 . A A . 15 LYS O 1 1 2 601 1 1 16 GLY C C -2.676 -6.625 0.860 1.00 . A A . 16 GLY C 1 1 2 602 1 1 16 GLY CA C -2.217 -8.024 1.106 1.00 . A A . 16 GLY CA 1 1 2 603 1 1 16 GLY H H -0.230 -7.886 0.476 1.00 . A A . 16 GLY H 1 1 2 604 1 1 16 GLY HA2 H -3.016 -8.706 0.875 1.00 . A A . 16 GLY HA2 1 1 2 605 1 1 16 GLY HA3 H -1.966 -8.114 2.144 1.00 . A A . 16 GLY HA3 1 1 2 606 1 1 16 GLY N N -1.066 -8.363 0.314 1.00 . A A . 16 GLY N 1 1 2 607 1 1 16 GLY O O -3.794 -6.369 0.427 1.00 . A A . 16 GLY O 1 1 2 608 1 1 17 LEU C C -2.654 -3.571 0.296 1.00 . A A . 17 LEU C 1 1 2 609 1 1 17 LEU CA C -2.006 -4.335 1.429 1.00 . A A . 17 LEU CA 1 1 2 610 1 1 17 LEU CB C -0.739 -3.614 1.888 1.00 . A A . 17 LEU CB 1 1 2 611 1 1 17 LEU CD1 C -1.432 -3.666 4.297 1.00 . A A . 17 LEU CD1 1 1 2 612 1 1 17 LEU CD2 C 0.218 -5.347 3.457 1.00 . A A . 17 LEU CD2 1 1 2 613 1 1 17 LEU CG C -0.291 -3.917 3.325 1.00 . A A . 17 LEU CG 1 1 2 614 1 1 17 LEU H H -0.811 -6.015 1.163 1.00 . A A . 17 LEU H 1 1 2 615 1 1 17 LEU HA H -2.689 -4.339 2.253 1.00 . A A . 17 LEU HA 1 1 2 616 1 1 17 LEU HB2 H 0.067 -3.881 1.215 1.00 . A A . 17 LEU HB2 1 1 2 617 1 1 17 LEU HB3 H -0.922 -2.551 1.816 1.00 . A A . 17 LEU HB3 1 1 2 618 1 1 17 LEU HD11 H -2.257 -4.323 4.062 1.00 . A A . 17 LEU HD11 1 1 2 619 1 1 17 LEU HD12 H -1.759 -2.638 4.210 1.00 . A A . 17 LEU HD12 1 1 2 620 1 1 17 LEU HD13 H -1.097 -3.855 5.304 1.00 . A A . 17 LEU HD13 1 1 2 621 1 1 17 LEU HD21 H 0.523 -5.527 4.476 1.00 . A A . 17 LEU HD21 1 1 2 622 1 1 17 LEU HD22 H 1.061 -5.490 2.798 1.00 . A A . 17 LEU HD22 1 1 2 623 1 1 17 LEU HD23 H -0.569 -6.036 3.191 1.00 . A A . 17 LEU HD23 1 1 2 624 1 1 17 LEU HG H 0.518 -3.251 3.588 1.00 . A A . 17 LEU HG 1 1 2 625 1 1 17 LEU N N -1.739 -5.723 1.141 1.00 . A A . 17 LEU N 1 1 2 626 1 1 17 LEU O O -2.970 -2.410 0.456 1.00 . A A . 17 LEU O 1 1 2 627 1 1 18 ALA C C -5.104 -3.360 -1.258 1.00 . A A . 18 ALA C 1 1 2 628 1 1 18 ALA CA C -3.690 -3.505 -1.835 1.00 . A A . 18 ALA CA 1 1 2 629 1 1 18 ALA CB C -3.691 -4.221 -3.169 1.00 . A A . 18 ALA CB 1 1 2 630 1 1 18 ALA H H -2.468 -5.067 -1.032 1.00 . A A . 18 ALA H 1 1 2 631 1 1 18 ALA HA H -3.261 -2.522 -1.980 1.00 . A A . 18 ALA HA 1 1 2 632 1 1 18 ALA HB1 H -2.711 -4.129 -3.616 1.00 . A A . 18 ALA HB1 1 1 2 633 1 1 18 ALA HB2 H -4.423 -3.764 -3.818 1.00 . A A . 18 ALA HB2 1 1 2 634 1 1 18 ALA HB3 H -3.930 -5.263 -3.028 1.00 . A A . 18 ALA HB3 1 1 2 635 1 1 18 ALA N N -2.865 -4.178 -0.848 1.00 . A A . 18 ALA N 1 1 2 636 1 1 18 ALA O O -5.888 -2.478 -1.663 1.00 . A A . 18 ALA O 1 1 2 637 1 1 19 LYS C C -6.825 -2.857 1.197 1.00 . A A . 19 LYS C 1 1 2 638 1 1 19 LYS CA C -6.601 -4.198 0.520 1.00 . A A . 19 LYS CA 1 1 2 639 1 1 19 LYS CB C -6.471 -5.277 1.585 1.00 . A A . 19 LYS CB 1 1 2 640 1 1 19 LYS CD C -5.025 -6.145 3.447 1.00 . A A . 19 LYS CD 1 1 2 641 1 1 19 LYS CE C -6.042 -6.458 4.529 1.00 . A A . 19 LYS CE 1 1 2 642 1 1 19 LYS CG C -5.427 -4.946 2.631 1.00 . A A . 19 LYS CG 1 1 2 643 1 1 19 LYS H H -4.671 -4.848 0.040 1.00 . A A . 19 LYS H 1 1 2 644 1 1 19 LYS HA H -7.423 -4.430 -0.137 1.00 . A A . 19 LYS HA 1 1 2 645 1 1 19 LYS HB2 H -7.408 -5.410 2.069 1.00 . A A . 19 LYS HB2 1 1 2 646 1 1 19 LYS HB3 H -6.176 -6.192 1.108 1.00 . A A . 19 LYS HB3 1 1 2 647 1 1 19 LYS HD2 H -4.933 -6.999 2.791 1.00 . A A . 19 LYS HD2 1 1 2 648 1 1 19 LYS HD3 H -4.074 -5.931 3.899 1.00 . A A . 19 LYS HD3 1 1 2 649 1 1 19 LYS HE2 H -7.025 -6.445 4.088 1.00 . A A . 19 LYS HE2 1 1 2 650 1 1 19 LYS HE3 H -5.837 -7.441 4.928 1.00 . A A . 19 LYS HE3 1 1 2 651 1 1 19 LYS HG2 H -4.558 -4.562 2.133 1.00 . A A . 19 LYS HG2 1 1 2 652 1 1 19 LYS HG3 H -5.824 -4.190 3.294 1.00 . A A . 19 LYS HG3 1 1 2 653 1 1 19 LYS HZ1 H -6.288 -4.527 5.289 1.00 . A A . 19 LYS HZ1 1 1 2 654 1 1 19 LYS HZ2 H -5.037 -5.403 6.029 1.00 . A A . 19 LYS HZ2 1 1 2 655 1 1 19 LYS HZ3 H -6.653 -5.757 6.399 1.00 . A A . 19 LYS HZ3 1 1 2 656 1 1 19 LYS N N -5.367 -4.194 -0.236 1.00 . A A . 19 LYS N 1 1 2 657 1 1 19 LYS NZ N -6.002 -5.467 5.636 1.00 . A A . 19 LYS NZ 1 1 2 658 1 1 19 LYS O O -7.947 -2.407 1.333 1.00 . A A . 19 LYS O 1 1 2 659 1 1 20 VAL C C -5.384 0.120 1.382 1.00 . A A . 20 VAL C 1 1 2 660 1 1 20 VAL CA C -5.723 -0.992 2.363 1.00 . A A . 20 VAL CA 1 1 2 661 1 1 20 VAL CB C -4.661 -1.025 3.473 1.00 . A A . 20 VAL CB 1 1 2 662 1 1 20 VAL CG1 C -3.283 -1.083 2.865 1.00 . A A . 20 VAL CG1 1 1 2 663 1 1 20 VAL CG2 C -4.801 0.144 4.432 1.00 . A A . 20 VAL CG2 1 1 2 664 1 1 20 VAL H H -4.877 -2.748 1.532 1.00 . A A . 20 VAL H 1 1 2 665 1 1 20 VAL HA H -6.693 -0.823 2.800 1.00 . A A . 20 VAL HA 1 1 2 666 1 1 20 VAL HB H -4.801 -1.927 4.023 1.00 . A A . 20 VAL HB 1 1 2 667 1 1 20 VAL HG11 H -3.305 -0.583 1.893 1.00 . A A . 20 VAL HG11 1 1 2 668 1 1 20 VAL HG12 H -3.000 -2.123 2.723 1.00 . A A . 20 VAL HG12 1 1 2 669 1 1 20 VAL HG13 H -2.574 -0.593 3.511 1.00 . A A . 20 VAL HG13 1 1 2 670 1 1 20 VAL HG21 H -5.764 0.101 4.914 1.00 . A A . 20 VAL HG21 1 1 2 671 1 1 20 VAL HG22 H -4.713 1.071 3.884 1.00 . A A . 20 VAL HG22 1 1 2 672 1 1 20 VAL HG23 H -4.021 0.093 5.179 1.00 . A A . 20 VAL HG23 1 1 2 673 1 1 20 VAL N N -5.729 -2.277 1.661 1.00 . A A . 20 VAL N 1 1 2 674 1 1 20 VAL O O -5.727 1.282 1.546 1.00 . A A . 20 VAL O 1 1 2 675 1 1 21 LEU C C -5.266 1.479 -1.255 1.00 . A A . 21 LEU C 1 1 2 676 1 1 21 LEU CA C -4.202 0.577 -0.678 1.00 . A A . 21 LEU CA 1 1 2 677 1 1 21 LEU CB C -3.726 -0.325 -1.759 1.00 . A A . 21 LEU CB 1 1 2 678 1 1 21 LEU CD1 C -2.250 1.116 -3.089 1.00 . A A . 21 LEU CD1 1 1 2 679 1 1 21 LEU CD2 C -1.422 0.082 -0.971 1.00 . A A . 21 LEU CD2 1 1 2 680 1 1 21 LEU CG C -2.315 -0.104 -2.190 1.00 . A A . 21 LEU CG 1 1 2 681 1 1 21 LEU H H -4.404 -1.227 0.358 1.00 . A A . 21 LEU H 1 1 2 682 1 1 21 LEU HA H -3.376 1.164 -0.314 1.00 . A A . 21 LEU HA 1 1 2 683 1 1 21 LEU HB2 H -3.817 -1.342 -1.399 1.00 . A A . 21 LEU HB2 1 1 2 684 1 1 21 LEU HB3 H -4.376 -0.201 -2.611 1.00 . A A . 21 LEU HB3 1 1 2 685 1 1 21 LEU HD11 H -2.692 1.961 -2.571 1.00 . A A . 21 LEU HD11 1 1 2 686 1 1 21 LEU HD12 H -2.799 0.925 -3.999 1.00 . A A . 21 LEU HD12 1 1 2 687 1 1 21 LEU HD13 H -1.222 1.336 -3.324 1.00 . A A . 21 LEU HD13 1 1 2 688 1 1 21 LEU HD21 H -1.809 -0.515 -0.149 1.00 . A A . 21 LEU HD21 1 1 2 689 1 1 21 LEU HD22 H -1.411 1.129 -0.687 1.00 . A A . 21 LEU HD22 1 1 2 690 1 1 21 LEU HD23 H -0.419 -0.239 -1.207 1.00 . A A . 21 LEU HD23 1 1 2 691 1 1 21 LEU HG H -2.000 -0.977 -2.728 1.00 . A A . 21 LEU HG 1 1 2 692 1 1 21 LEU N N -4.674 -0.281 0.376 1.00 . A A . 21 LEU N 1 1 2 693 1 1 21 LEU O O -5.220 2.694 -1.089 1.00 . A A . 21 LEU O 1 1 2 694 1 1 22 ALA C C -8.144 2.399 -1.712 1.00 . A A . 22 ALA C 1 1 2 695 1 1 22 ALA CA C -7.291 1.562 -2.647 1.00 . A A . 22 ALA CA 1 1 2 696 1 1 22 ALA CB C -8.151 0.562 -3.379 1.00 . A A . 22 ALA CB 1 1 2 697 1 1 22 ALA H H -6.230 -0.126 -1.886 1.00 . A A . 22 ALA H 1 1 2 698 1 1 22 ALA HA H -6.827 2.201 -3.377 1.00 . A A . 22 ALA HA 1 1 2 699 1 1 22 ALA HB1 H -7.536 -0.009 -4.053 1.00 . A A . 22 ALA HB1 1 1 2 700 1 1 22 ALA HB2 H -8.912 1.086 -3.936 1.00 . A A . 22 ALA HB2 1 1 2 701 1 1 22 ALA HB3 H -8.616 -0.100 -2.662 1.00 . A A . 22 ALA HB3 1 1 2 702 1 1 22 ALA N N -6.231 0.854 -1.906 1.00 . A A . 22 ALA N 1 1 2 703 1 1 22 ALA O O -9.011 3.170 -2.122 1.00 . A A . 22 ALA O 1 1 2 704 1 1 23 GLU C C -8.064 4.044 1.162 1.00 . A A . 23 GLU C 1 1 2 705 1 1 23 GLU CA C -8.616 2.737 0.641 1.00 . A A . 23 GLU CA 1 1 2 706 1 1 23 GLU CB C -8.494 1.695 1.709 1.00 . A A . 23 GLU CB 1 1 2 707 1 1 23 GLU CD C -9.924 -0.324 1.313 1.00 . A A . 23 GLU CD 1 1 2 708 1 1 23 GLU CG C -8.570 0.317 1.115 1.00 . A A . 23 GLU CG 1 1 2 709 1 1 23 GLU H H -7.047 1.701 -0.250 1.00 . A A . 23 GLU H 1 1 2 710 1 1 23 GLU HA H -9.641 2.839 0.350 1.00 . A A . 23 GLU HA 1 1 2 711 1 1 23 GLU HB2 H -7.522 1.804 2.184 1.00 . A A . 23 GLU HB2 1 1 2 712 1 1 23 GLU HB3 H -9.276 1.815 2.434 1.00 . A A . 23 GLU HB3 1 1 2 713 1 1 23 GLU HG2 H -8.369 0.398 0.049 1.00 . A A . 23 GLU HG2 1 1 2 714 1 1 23 GLU HG3 H -7.796 -0.295 1.557 1.00 . A A . 23 GLU HG3 1 1 2 715 1 1 23 GLU N N -7.847 2.228 -0.458 1.00 . A A . 23 GLU N 1 1 2 716 1 1 23 GLU O O -8.793 5.003 1.367 1.00 . A A . 23 GLU O 1 1 2 717 1 1 23 GLU OE1 O -10.233 -0.726 2.452 1.00 . A A . 23 GLU OE1 1 1 2 718 1 1 23 GLU OE2 O -10.693 -0.417 0.336 1.00 . A A . 23 GLU OE2 1 1 2 719 1 1 24 LYS C C -5.238 5.850 1.031 1.00 . A A . 24 LYS C 1 1 2 720 1 1 24 LYS CA C -6.060 5.116 2.065 1.00 . A A . 24 LYS CA 1 1 2 721 1 1 24 LYS CB C -5.119 4.548 3.105 1.00 . A A . 24 LYS CB 1 1 2 722 1 1 24 LYS CD C -6.561 3.275 4.813 1.00 . A A . 24 LYS CD 1 1 2 723 1 1 24 LYS CE C -7.810 4.056 4.463 1.00 . A A . 24 LYS CE 1 1 2 724 1 1 24 LYS CG C -5.576 3.204 3.654 1.00 . A A . 24 LYS CG 1 1 2 725 1 1 24 LYS H H -6.296 3.162 1.346 1.00 . A A . 24 LYS H 1 1 2 726 1 1 24 LYS HA H -6.752 5.790 2.531 1.00 . A A . 24 LYS HA 1 1 2 727 1 1 24 LYS HB2 H -4.148 4.411 2.650 1.00 . A A . 24 LYS HB2 1 1 2 728 1 1 24 LYS HB3 H -5.027 5.235 3.899 1.00 . A A . 24 LYS HB3 1 1 2 729 1 1 24 LYS HD2 H -6.849 2.257 5.060 1.00 . A A . 24 LYS HD2 1 1 2 730 1 1 24 LYS HD3 H -6.077 3.734 5.664 1.00 . A A . 24 LYS HD3 1 1 2 731 1 1 24 LYS HE2 H -7.550 5.100 4.371 1.00 . A A . 24 LYS HE2 1 1 2 732 1 1 24 LYS HE3 H -8.175 3.695 3.515 1.00 . A A . 24 LYS HE3 1 1 2 733 1 1 24 LYS HG2 H -6.056 2.668 2.844 1.00 . A A . 24 LYS HG2 1 1 2 734 1 1 24 LYS HG3 H -4.710 2.653 3.972 1.00 . A A . 24 LYS HG3 1 1 2 735 1 1 24 LYS HZ1 H -8.521 4.191 6.423 1.00 . A A . 24 LYS HZ1 1 1 2 736 1 1 24 LYS HZ2 H -9.203 2.920 5.528 1.00 . A A . 24 LYS HZ2 1 1 2 737 1 1 24 LYS HZ3 H -9.690 4.514 5.240 1.00 . A A . 24 LYS HZ3 1 1 2 738 1 1 24 LYS N N -6.782 4.001 1.482 1.00 . A A . 24 LYS N 1 1 2 739 1 1 24 LYS NZ N -8.878 3.912 5.483 1.00 . A A . 24 LYS NZ 1 1 2 740 1 1 24 LYS O O -5.314 7.067 0.873 1.00 . A A . 24 LYS O 1 1 2 741 1 1 25 TYR C C -3.934 5.869 -1.856 1.00 . A A . 25 TYR C 1 1 2 742 1 1 25 TYR CA C -3.383 5.549 -0.490 1.00 . A A . 25 TYR CA 1 1 2 743 1 1 25 TYR CB C -2.352 4.446 -0.643 1.00 . A A . 25 TYR CB 1 1 2 744 1 1 25 TYR CD1 C -2.772 3.049 1.289 1.00 . A A . 25 TYR CD1 1 1 2 745 1 1 25 TYR CD2 C -0.630 4.043 1.160 1.00 . A A . 25 TYR CD2 1 1 2 746 1 1 25 TYR CE1 C -2.447 2.445 2.444 1.00 . A A . 25 TYR CE1 1 1 2 747 1 1 25 TYR CE2 C -0.273 3.435 2.349 1.00 . A A . 25 TYR CE2 1 1 2 748 1 1 25 TYR CG C -1.898 3.850 0.632 1.00 . A A . 25 TYR CG 1 1 2 749 1 1 25 TYR CZ C -1.192 2.631 2.995 1.00 . A A . 25 TYR CZ 1 1 2 750 1 1 25 TYR H H -4.556 4.097 0.422 1.00 . A A . 25 TYR H 1 1 2 751 1 1 25 TYR HA H -2.945 6.410 -0.025 1.00 . A A . 25 TYR HA 1 1 2 752 1 1 25 TYR HB2 H -2.820 3.645 -1.178 1.00 . A A . 25 TYR HB2 1 1 2 753 1 1 25 TYR HB3 H -1.505 4.796 -1.182 1.00 . A A . 25 TYR HB3 1 1 2 754 1 1 25 TYR HD1 H -3.767 2.921 0.869 1.00 . A A . 25 TYR HD1 1 1 2 755 1 1 25 TYR HD2 H 0.074 4.676 0.640 1.00 . A A . 25 TYR HD2 1 1 2 756 1 1 25 TYR HE1 H -3.175 1.831 2.903 1.00 . A A . 25 TYR HE1 1 1 2 757 1 1 25 TYR HE2 H 0.711 3.589 2.766 1.00 . A A . 25 TYR HE2 1 1 2 758 1 1 25 TYR HH H -0.276 2.605 4.690 1.00 . A A . 25 TYR HH 1 1 2 759 1 1 25 TYR N N -4.437 5.065 0.353 1.00 . A A . 25 TYR N 1 1 2 760 1 1 25 TYR O O -3.840 6.993 -2.350 1.00 . A A . 25 TYR O 1 1 2 761 1 1 25 TYR OH O -0.854 2.016 4.179 1.00 . A A . 25 TYR OH 1 1 2 762 1 1 26 ALA C C -6.419 5.742 -3.655 1.00 . A A . 26 ALA C 1 1 2 763 1 1 26 ALA CA C -5.132 4.944 -3.760 1.00 . A A . 26 ALA CA 1 1 2 764 1 1 26 ALA CB C -5.405 3.555 -4.297 1.00 . A A . 26 ALA CB 1 1 2 765 1 1 26 ALA H H -4.536 3.949 -1.979 1.00 . A A . 26 ALA H 1 1 2 766 1 1 26 ALA HA H -4.447 5.447 -4.425 1.00 . A A . 26 ALA HA 1 1 2 767 1 1 26 ALA HB1 H -6.021 3.017 -3.584 1.00 . A A . 26 ALA HB1 1 1 2 768 1 1 26 ALA HB2 H -4.470 3.031 -4.428 1.00 . A A . 26 ALA HB2 1 1 2 769 1 1 26 ALA HB3 H -5.921 3.624 -5.242 1.00 . A A . 26 ALA HB3 1 1 2 770 1 1 26 ALA N N -4.515 4.834 -2.452 1.00 . A A . 26 ALA N 1 1 2 771 1 1 26 ALA O O -6.966 6.207 -4.653 1.00 . A A . 26 ALA O 1 1 2 772 1 1 27 ASN C C -8.008 8.058 -2.744 1.00 . A A . 27 ASN C 1 1 2 773 1 1 27 ASN CA C -8.051 6.682 -2.081 1.00 . A A . 27 ASN CA 1 1 2 774 1 1 27 ASN CB C -8.105 6.845 -0.573 1.00 . A A . 27 ASN CB 1 1 2 775 1 1 27 ASN CG C -9.268 7.698 -0.090 1.00 . A A . 27 ASN CG 1 1 2 776 1 1 27 ASN H H -6.433 5.375 -1.698 1.00 . A A . 27 ASN H 1 1 2 777 1 1 27 ASN HA H -8.933 6.157 -2.413 1.00 . A A . 27 ASN HA 1 1 2 778 1 1 27 ASN HB2 H -8.195 5.865 -0.125 1.00 . A A . 27 ASN HB2 1 1 2 779 1 1 27 ASN HB3 H -7.181 7.291 -0.233 1.00 . A A . 27 ASN HB3 1 1 2 780 1 1 27 ASN HD21 H -10.419 7.052 -1.577 1.00 . A A . 27 ASN HD21 1 1 2 781 1 1 27 ASN HD22 H -11.157 8.174 -0.483 1.00 . A A . 27 ASN HD22 1 1 2 782 1 1 27 ASN N N -6.888 5.868 -2.420 1.00 . A A . 27 ASN N 1 1 2 783 1 1 27 ASN ND2 N -10.391 7.636 -0.789 1.00 . A A . 27 ASN ND2 1 1 2 784 1 1 27 ASN O O -7.152 8.880 -2.362 1.00 . A A . 27 ASN O 1 1 2 785 1 1 27 ASN OXT O -8.852 8.312 -3.629 1.00 . A A . 27 ASN OXT 1 1 2 786 1 1 27 ASN OD1 O -9.159 8.392 0.919 1.00 . A A . 27 ASN OD1 1 1 3 787 1 1 1 GLY C C 16.026 0.725 0.300 1.00 . A A . 1 GLY C 1 1 3 788 1 1 1 GLY CA C 16.167 0.571 -1.193 1.00 . A A . 1 GLY CA 1 1 3 789 1 1 1 GLY H1 H 14.950 -1.109 -1.339 1.00 . A A . 1 GLY H1 1 1 3 790 1 1 1 GLY H2 H 16.599 -1.465 -1.169 1.00 . A A . 1 GLY H2 1 1 3 791 1 1 1 GLY H3 H 15.998 -0.905 -2.655 1.00 . A A . 1 GLY H3 1 1 3 792 1 1 1 GLY HA2 H 17.170 0.851 -1.482 1.00 . A A . 1 GLY HA2 1 1 3 793 1 1 1 GLY HA3 H 15.463 1.226 -1.683 1.00 . A A . 1 GLY HA3 1 1 3 794 1 1 1 GLY N N 15.911 -0.821 -1.621 1.00 . A A . 1 GLY N 1 1 3 795 1 1 1 GLY O O 17.002 0.620 1.038 1.00 . A A . 1 GLY O 1 1 3 796 1 1 2 ILE C C 13.574 -0.018 2.592 1.00 . A A . 2 ILE C 1 1 3 797 1 1 2 ILE CA C 14.533 1.086 2.163 1.00 . A A . 2 ILE CA 1 1 3 798 1 1 2 ILE CB C 13.919 2.457 2.507 1.00 . A A . 2 ILE CB 1 1 3 799 1 1 2 ILE CD1 C 14.304 4.971 2.385 1.00 . A A . 2 ILE CD1 1 1 3 800 1 1 2 ILE CG1 C 14.870 3.589 2.120 1.00 . A A . 2 ILE CG1 1 1 3 801 1 1 2 ILE CG2 C 13.570 2.518 3.978 1.00 . A A . 2 ILE CG2 1 1 3 802 1 1 2 ILE H H 14.076 1.117 0.115 1.00 . A A . 2 ILE H 1 1 3 803 1 1 2 ILE HA H 15.464 0.979 2.699 1.00 . A A . 2 ILE HA 1 1 3 804 1 1 2 ILE HB H 13.002 2.563 1.947 1.00 . A A . 2 ILE HB 1 1 3 805 1 1 2 ILE HD11 H 14.065 5.067 3.433 1.00 . A A . 2 ILE HD11 1 1 3 806 1 1 2 ILE HD12 H 13.408 5.112 1.797 1.00 . A A . 2 ILE HD12 1 1 3 807 1 1 2 ILE HD13 H 15.036 5.716 2.113 1.00 . A A . 2 ILE HD13 1 1 3 808 1 1 2 ILE HG12 H 15.788 3.491 2.678 1.00 . A A . 2 ILE HG12 1 1 3 809 1 1 2 ILE HG13 H 15.084 3.517 1.063 1.00 . A A . 2 ILE HG13 1 1 3 810 1 1 2 ILE HG21 H 12.864 1.730 4.201 1.00 . A A . 2 ILE HG21 1 1 3 811 1 1 2 ILE HG22 H 13.129 3.475 4.205 1.00 . A A . 2 ILE HG22 1 1 3 812 1 1 2 ILE HG23 H 14.462 2.379 4.566 1.00 . A A . 2 ILE HG23 1 1 3 813 1 1 2 ILE N N 14.809 0.982 0.751 1.00 . A A . 2 ILE N 1 1 3 814 1 1 2 ILE O O 13.987 -1.062 3.098 1.00 . A A . 2 ILE O 1 1 3 815 1 1 3 GLY C C 9.929 -0.081 2.824 1.00 . A A . 3 GLY C 1 1 3 816 1 1 3 GLY CA C 11.282 -0.737 2.709 1.00 . A A . 3 GLY CA 1 1 3 817 1 1 3 GLY H H 12.033 1.065 1.952 1.00 . A A . 3 GLY H 1 1 3 818 1 1 3 GLY HA2 H 11.242 -1.502 1.952 1.00 . A A . 3 GLY HA2 1 1 3 819 1 1 3 GLY HA3 H 11.534 -1.188 3.655 1.00 . A A . 3 GLY HA3 1 1 3 820 1 1 3 GLY N N 12.295 0.218 2.355 1.00 . A A . 3 GLY N 1 1 3 821 1 1 3 GLY O O 9.164 -0.030 1.855 1.00 . A A . 3 GLY O 1 1 3 822 1 1 4 GLY C C 8.320 2.527 3.766 1.00 . A A . 4 GLY C 1 1 3 823 1 1 4 GLY CA C 8.392 1.102 4.268 1.00 . A A . 4 GLY CA 1 1 3 824 1 1 4 GLY H H 10.384 0.517 4.665 1.00 . A A . 4 GLY H 1 1 3 825 1 1 4 GLY HA2 H 7.618 0.521 3.794 1.00 . A A . 4 GLY HA2 1 1 3 826 1 1 4 GLY HA3 H 8.231 1.099 5.336 1.00 . A A . 4 GLY HA3 1 1 3 827 1 1 4 GLY N N 9.675 0.492 3.987 1.00 . A A . 4 GLY N 1 1 3 828 1 1 4 GLY O O 7.824 3.420 4.453 1.00 . A A . 4 GLY O 1 1 3 829 1 1 5 VAL C C 7.836 4.148 0.813 1.00 . A A . 5 VAL C 1 1 3 830 1 1 5 VAL CA C 8.850 4.053 1.957 1.00 . A A . 5 VAL CA 1 1 3 831 1 1 5 VAL CB C 10.285 4.380 1.466 1.00 . A A . 5 VAL CB 1 1 3 832 1 1 5 VAL CG1 C 10.914 3.177 0.769 1.00 . A A . 5 VAL CG1 1 1 3 833 1 1 5 VAL CG2 C 10.276 5.579 0.538 1.00 . A A . 5 VAL CG2 1 1 3 834 1 1 5 VAL H H 9.156 1.971 2.052 1.00 . A A . 5 VAL H 1 1 3 835 1 1 5 VAL HA H 8.581 4.770 2.719 1.00 . A A . 5 VAL HA 1 1 3 836 1 1 5 VAL HB H 10.891 4.624 2.326 1.00 . A A . 5 VAL HB 1 1 3 837 1 1 5 VAL HG11 H 11.920 3.424 0.459 1.00 . A A . 5 VAL HG11 1 1 3 838 1 1 5 VAL HG12 H 10.325 2.912 -0.098 1.00 . A A . 5 VAL HG12 1 1 3 839 1 1 5 VAL HG13 H 10.943 2.339 1.451 1.00 . A A . 5 VAL HG13 1 1 3 840 1 1 5 VAL HG21 H 9.761 5.310 -0.377 1.00 . A A . 5 VAL HG21 1 1 3 841 1 1 5 VAL HG22 H 11.292 5.871 0.311 1.00 . A A . 5 VAL HG22 1 1 3 842 1 1 5 VAL HG23 H 9.760 6.400 1.012 1.00 . A A . 5 VAL HG23 1 1 3 843 1 1 5 VAL N N 8.812 2.735 2.559 1.00 . A A . 5 VAL N 1 1 3 844 1 1 5 VAL O O 6.986 5.037 0.797 1.00 . A A . 5 VAL O 1 1 3 845 1 1 6 LEU C C 7.386 1.917 -2.085 1.00 . A A . 6 LEU C 1 1 3 846 1 1 6 LEU CA C 7.001 3.120 -1.250 1.00 . A A . 6 LEU CA 1 1 3 847 1 1 6 LEU CB C 7.000 4.425 -2.100 1.00 . A A . 6 LEU CB 1 1 3 848 1 1 6 LEU CD1 C 9.529 4.415 -2.454 1.00 . A A . 6 LEU CD1 1 1 3 849 1 1 6 LEU CD2 C 8.003 3.891 -4.380 1.00 . A A . 6 LEU CD2 1 1 3 850 1 1 6 LEU CG C 8.171 4.684 -3.087 1.00 . A A . 6 LEU CG 1 1 3 851 1 1 6 LEU H H 8.601 2.512 -0.014 1.00 . A A . 6 LEU H 1 1 3 852 1 1 6 LEU HA H 6.006 2.956 -0.856 1.00 . A A . 6 LEU HA 1 1 3 853 1 1 6 LEU HB2 H 6.088 4.436 -2.674 1.00 . A A . 6 LEU HB2 1 1 3 854 1 1 6 LEU HB3 H 6.966 5.253 -1.410 1.00 . A A . 6 LEU HB3 1 1 3 855 1 1 6 LEU HD11 H 10.302 4.527 -3.200 1.00 . A A . 6 LEU HD11 1 1 3 856 1 1 6 LEU HD12 H 9.548 3.408 -2.057 1.00 . A A . 6 LEU HD12 1 1 3 857 1 1 6 LEU HD13 H 9.697 5.120 -1.652 1.00 . A A . 6 LEU HD13 1 1 3 858 1 1 6 LEU HD21 H 7.085 4.187 -4.869 1.00 . A A . 6 LEU HD21 1 1 3 859 1 1 6 LEU HD22 H 7.964 2.835 -4.150 1.00 . A A . 6 LEU HD22 1 1 3 860 1 1 6 LEU HD23 H 8.839 4.085 -5.034 1.00 . A A . 6 LEU HD23 1 1 3 861 1 1 6 LEU HG H 8.155 5.733 -3.353 1.00 . A A . 6 LEU HG 1 1 3 862 1 1 6 LEU N N 7.915 3.199 -0.110 1.00 . A A . 6 LEU N 1 1 3 863 1 1 6 LEU O O 6.588 1.374 -2.848 1.00 . A A . 6 LEU O 1 1 3 864 1 1 7 LEU C C 8.485 -0.914 -2.231 1.00 . A A . 7 LEU C 1 1 3 865 1 1 7 LEU CA C 9.192 0.379 -2.634 1.00 . A A . 7 LEU CA 1 1 3 866 1 1 7 LEU CB C 10.697 0.270 -2.357 1.00 . A A . 7 LEU CB 1 1 3 867 1 1 7 LEU CD1 C 10.946 -1.753 -3.837 1.00 . A A . 7 LEU CD1 1 1 3 868 1 1 7 LEU CD2 C 11.607 0.526 -4.639 1.00 . A A . 7 LEU CD2 1 1 3 869 1 1 7 LEU CG C 11.525 -0.402 -3.447 1.00 . A A . 7 LEU CG 1 1 3 870 1 1 7 LEU H H 9.215 2.028 -1.309 1.00 . A A . 7 LEU H 1 1 3 871 1 1 7 LEU HA H 9.040 0.546 -3.691 1.00 . A A . 7 LEU HA 1 1 3 872 1 1 7 LEU HB2 H 11.086 1.271 -2.232 1.00 . A A . 7 LEU HB2 1 1 3 873 1 1 7 LEU HB3 H 10.838 -0.276 -1.436 1.00 . A A . 7 LEU HB3 1 1 3 874 1 1 7 LEU HD11 H 11.417 -2.101 -4.743 1.00 . A A . 7 LEU HD11 1 1 3 875 1 1 7 LEU HD12 H 9.876 -1.651 -3.994 1.00 . A A . 7 LEU HD12 1 1 3 876 1 1 7 LEU HD13 H 11.122 -2.461 -3.042 1.00 . A A . 7 LEU HD13 1 1 3 877 1 1 7 LEU HD21 H 11.836 1.522 -4.287 1.00 . A A . 7 LEU HD21 1 1 3 878 1 1 7 LEU HD22 H 10.656 0.533 -5.153 1.00 . A A . 7 LEU HD22 1 1 3 879 1 1 7 LEU HD23 H 12.382 0.190 -5.310 1.00 . A A . 7 LEU HD23 1 1 3 880 1 1 7 LEU HG H 12.529 -0.561 -3.079 1.00 . A A . 7 LEU HG 1 1 3 881 1 1 7 LEU N N 8.637 1.515 -1.915 1.00 . A A . 7 LEU N 1 1 3 882 1 1 7 LEU O O 7.590 -1.386 -2.926 1.00 . A A . 7 LEU O 1 1 3 883 1 1 8 SER C C 7.088 -2.478 0.177 1.00 . A A . 8 SER C 1 1 3 884 1 1 8 SER CA C 8.304 -2.743 -0.665 1.00 . A A . 8 SER CA 1 1 3 885 1 1 8 SER CB C 9.356 -3.566 0.073 1.00 . A A . 8 SER CB 1 1 3 886 1 1 8 SER H H 9.450 -0.966 -0.485 1.00 . A A . 8 SER H 1 1 3 887 1 1 8 SER HA H 7.991 -3.272 -1.555 1.00 . A A . 8 SER HA 1 1 3 888 1 1 8 SER HB2 H 8.865 -4.232 0.771 1.00 . A A . 8 SER HB2 1 1 3 889 1 1 8 SER HB3 H 9.922 -4.145 -0.643 1.00 . A A . 8 SER HB3 1 1 3 890 1 1 8 SER HG H 11.079 -3.180 0.937 1.00 . A A . 8 SER HG 1 1 3 891 1 1 8 SER N N 8.852 -1.460 -1.088 1.00 . A A . 8 SER N 1 1 3 892 1 1 8 SER O O 6.285 -3.362 0.469 1.00 . A A . 8 SER O 1 1 3 893 1 1 8 SER OG O 10.239 -2.720 0.786 1.00 . A A . 8 SER OG 1 1 3 894 1 1 9 ALA C C 4.707 -0.805 -0.120 1.00 . A A . 9 ALA C 1 1 3 895 1 1 9 ALA CA C 5.739 -0.652 0.995 1.00 . A A . 9 ALA CA 1 1 3 896 1 1 9 ALA CB C 5.981 0.807 1.320 1.00 . A A . 9 ALA CB 1 1 3 897 1 1 9 ALA H H 7.785 -0.666 0.556 1.00 . A A . 9 ALA H 1 1 3 898 1 1 9 ALA HA H 5.407 -1.166 1.882 1.00 . A A . 9 ALA HA 1 1 3 899 1 1 9 ALA HB1 H 5.058 1.360 1.228 1.00 . A A . 9 ALA HB1 1 1 3 900 1 1 9 ALA HB2 H 6.720 1.205 0.629 1.00 . A A . 9 ALA HB2 1 1 3 901 1 1 9 ALA HB3 H 6.353 0.890 2.329 1.00 . A A . 9 ALA HB3 1 1 3 902 1 1 9 ALA N N 6.981 -1.226 0.554 1.00 . A A . 9 ALA N 1 1 3 903 1 1 9 ALA O O 3.509 -0.928 0.133 1.00 . A A . 9 ALA O 1 1 3 904 1 1 10 GLY C C 4.159 -2.491 -2.801 1.00 . A A . 10 GLY C 1 1 3 905 1 1 10 GLY CA C 4.327 -1.027 -2.499 1.00 . A A . 10 GLY CA 1 1 3 906 1 1 10 GLY H H 6.166 -0.721 -1.508 1.00 . A A . 10 GLY H 1 1 3 907 1 1 10 GLY HA2 H 3.368 -0.604 -2.281 1.00 . A A . 10 GLY HA2 1 1 3 908 1 1 10 GLY HA3 H 4.751 -0.534 -3.360 1.00 . A A . 10 GLY HA3 1 1 3 909 1 1 10 GLY N N 5.196 -0.827 -1.363 1.00 . A A . 10 GLY N 1 1 3 910 1 1 10 GLY O O 3.055 -2.961 -3.086 1.00 . A A . 10 GLY O 1 1 3 911 1 1 11 LYS C C 4.288 -5.321 -1.910 1.00 . A A . 11 LYS C 1 1 3 912 1 1 11 LYS CA C 5.269 -4.661 -2.868 1.00 . A A . 11 LYS CA 1 1 3 913 1 1 11 LYS CB C 6.673 -5.200 -2.622 1.00 . A A . 11 LYS CB 1 1 3 914 1 1 11 LYS CD C 8.161 -4.217 -4.434 1.00 . A A . 11 LYS CD 1 1 3 915 1 1 11 LYS CE C 7.177 -3.352 -5.201 1.00 . A A . 11 LYS CE 1 1 3 916 1 1 11 LYS CG C 7.500 -5.472 -3.871 1.00 . A A . 11 LYS CG 1 1 3 917 1 1 11 LYS H H 6.115 -2.759 -2.537 1.00 . A A . 11 LYS H 1 1 3 918 1 1 11 LYS HA H 4.970 -4.891 -3.873 1.00 . A A . 11 LYS HA 1 1 3 919 1 1 11 LYS HB2 H 7.202 -4.467 -2.035 1.00 . A A . 11 LYS HB2 1 1 3 920 1 1 11 LYS HB3 H 6.600 -6.116 -2.064 1.00 . A A . 11 LYS HB3 1 1 3 921 1 1 11 LYS HD2 H 8.566 -3.639 -3.618 1.00 . A A . 11 LYS HD2 1 1 3 922 1 1 11 LYS HD3 H 8.961 -4.512 -5.099 1.00 . A A . 11 LYS HD3 1 1 3 923 1 1 11 LYS HE2 H 6.261 -3.298 -4.631 1.00 . A A . 11 LYS HE2 1 1 3 924 1 1 11 LYS HE3 H 7.595 -2.359 -5.304 1.00 . A A . 11 LYS HE3 1 1 3 925 1 1 11 LYS HG2 H 8.270 -6.188 -3.626 1.00 . A A . 11 LYS HG2 1 1 3 926 1 1 11 LYS HG3 H 6.846 -5.890 -4.615 1.00 . A A . 11 LYS HG3 1 1 3 927 1 1 11 LYS HZ1 H 7.707 -3.778 -7.174 1.00 . A A . 11 LYS HZ1 1 1 3 928 1 1 11 LYS HZ2 H 6.067 -3.397 -6.969 1.00 . A A . 11 LYS HZ2 1 1 3 929 1 1 11 LYS HZ3 H 6.656 -4.915 -6.489 1.00 . A A . 11 LYS HZ3 1 1 3 930 1 1 11 LYS N N 5.264 -3.216 -2.710 1.00 . A A . 11 LYS N 1 1 3 931 1 1 11 LYS NZ N 6.880 -3.897 -6.550 1.00 . A A . 11 LYS NZ 1 1 3 932 1 1 11 LYS O O 3.687 -6.347 -2.226 1.00 . A A . 11 LYS O 1 1 3 933 1 1 12 ALA C C 1.760 -5.128 -0.212 1.00 . A A . 12 ALA C 1 1 3 934 1 1 12 ALA CA C 3.209 -5.248 0.246 1.00 . A A . 12 ALA CA 1 1 3 935 1 1 12 ALA CB C 3.414 -4.547 1.579 1.00 . A A . 12 ALA CB 1 1 3 936 1 1 12 ALA H H 4.632 -3.911 -0.547 1.00 . A A . 12 ALA H 1 1 3 937 1 1 12 ALA HA H 3.446 -6.291 0.376 1.00 . A A . 12 ALA HA 1 1 3 938 1 1 12 ALA HB1 H 2.800 -5.020 2.332 1.00 . A A . 12 ALA HB1 1 1 3 939 1 1 12 ALA HB2 H 3.132 -3.508 1.486 1.00 . A A . 12 ALA HB2 1 1 3 940 1 1 12 ALA HB3 H 4.452 -4.615 1.867 1.00 . A A . 12 ALA HB3 1 1 3 941 1 1 12 ALA N N 4.119 -4.721 -0.747 1.00 . A A . 12 ALA N 1 1 3 942 1 1 12 ALA O O 0.950 -6.017 0.040 1.00 . A A . 12 ALA O 1 1 3 943 1 1 13 ALA C C -0.271 -4.821 -2.468 1.00 . A A . 13 ALA C 1 1 3 944 1 1 13 ALA CA C 0.081 -3.825 -1.387 1.00 . A A . 13 ALA CA 1 1 3 945 1 1 13 ALA CB C -0.131 -2.407 -1.890 1.00 . A A . 13 ALA CB 1 1 3 946 1 1 13 ALA H H 2.134 -3.391 -1.118 1.00 . A A . 13 ALA H 1 1 3 947 1 1 13 ALA HA H -0.586 -3.981 -0.551 1.00 . A A . 13 ALA HA 1 1 3 948 1 1 13 ALA HB1 H 0.388 -2.276 -2.828 1.00 . A A . 13 ALA HB1 1 1 3 949 1 1 13 ALA HB2 H 0.251 -1.706 -1.164 1.00 . A A . 13 ALA HB2 1 1 3 950 1 1 13 ALA HB3 H -1.200 -2.235 -2.036 1.00 . A A . 13 ALA HB3 1 1 3 951 1 1 13 ALA N N 1.440 -4.043 -0.911 1.00 . A A . 13 ALA N 1 1 3 952 1 1 13 ALA O O -1.410 -5.268 -2.549 1.00 . A A . 13 ALA O 1 1 3 953 1 1 14 LEU C C -0.104 -7.449 -3.632 1.00 . A A . 14 LEU C 1 1 3 954 1 1 14 LEU CA C 0.532 -6.236 -4.286 1.00 . A A . 14 LEU CA 1 1 3 955 1 1 14 LEU CB C 1.878 -6.683 -4.856 1.00 . A A . 14 LEU CB 1 1 3 956 1 1 14 LEU CD1 C 2.148 -4.318 -5.739 1.00 . A A . 14 LEU CD1 1 1 3 957 1 1 14 LEU CD2 C 4.069 -5.907 -5.666 1.00 . A A . 14 LEU CD2 1 1 3 958 1 1 14 LEU CG C 2.574 -5.774 -5.870 1.00 . A A . 14 LEU CG 1 1 3 959 1 1 14 LEU H H 1.580 -4.708 -3.237 1.00 . A A . 14 LEU H 1 1 3 960 1 1 14 LEU HA H -0.102 -5.871 -5.078 1.00 . A A . 14 LEU HA 1 1 3 961 1 1 14 LEU HB2 H 2.554 -6.818 -4.026 1.00 . A A . 14 LEU HB2 1 1 3 962 1 1 14 LEU HB3 H 1.729 -7.646 -5.323 1.00 . A A . 14 LEU HB3 1 1 3 963 1 1 14 LEU HD11 H 2.390 -3.961 -4.749 1.00 . A A . 14 LEU HD11 1 1 3 964 1 1 14 LEU HD12 H 1.082 -4.239 -5.899 1.00 . A A . 14 LEU HD12 1 1 3 965 1 1 14 LEU HD13 H 2.669 -3.722 -6.474 1.00 . A A . 14 LEU HD13 1 1 3 966 1 1 14 LEU HD21 H 4.393 -6.880 -6.001 1.00 . A A . 14 LEU HD21 1 1 3 967 1 1 14 LEU HD22 H 4.290 -5.804 -4.610 1.00 . A A . 14 LEU HD22 1 1 3 968 1 1 14 LEU HD23 H 4.585 -5.140 -6.221 1.00 . A A . 14 LEU HD23 1 1 3 969 1 1 14 LEU HG H 2.342 -6.106 -6.872 1.00 . A A . 14 LEU HG 1 1 3 970 1 1 14 LEU N N 0.712 -5.176 -3.291 1.00 . A A . 14 LEU N 1 1 3 971 1 1 14 LEU O O -0.976 -8.108 -4.194 1.00 . A A . 14 LEU O 1 1 3 972 1 1 15 LYS C C -1.206 -8.674 -0.798 1.00 . A A . 15 LYS C 1 1 3 973 1 1 15 LYS CA C -0.015 -8.912 -1.720 1.00 . A A . 15 LYS CA 1 1 3 974 1 1 15 LYS CB C 1.190 -9.354 -0.912 1.00 . A A . 15 LYS CB 1 1 3 975 1 1 15 LYS CD C 2.320 -10.356 -2.887 1.00 . A A . 15 LYS CD 1 1 3 976 1 1 15 LYS CE C 3.532 -10.332 -3.794 1.00 . A A . 15 LYS CE 1 1 3 977 1 1 15 LYS CG C 2.452 -9.373 -1.746 1.00 . A A . 15 LYS CG 1 1 3 978 1 1 15 LYS H H 0.950 -7.079 -1.982 1.00 . A A . 15 LYS H 1 1 3 979 1 1 15 LYS HA H -0.243 -9.670 -2.444 1.00 . A A . 15 LYS HA 1 1 3 980 1 1 15 LYS HB2 H 1.331 -8.662 -0.098 1.00 . A A . 15 LYS HB2 1 1 3 981 1 1 15 LYS HB3 H 1.016 -10.344 -0.519 1.00 . A A . 15 LYS HB3 1 1 3 982 1 1 15 LYS HD2 H 2.199 -11.352 -2.489 1.00 . A A . 15 LYS HD2 1 1 3 983 1 1 15 LYS HD3 H 1.449 -10.086 -3.463 1.00 . A A . 15 LYS HD3 1 1 3 984 1 1 15 LYS HE2 H 3.401 -11.070 -4.571 1.00 . A A . 15 LYS HE2 1 1 3 985 1 1 15 LYS HE3 H 3.601 -9.351 -4.236 1.00 . A A . 15 LYS HE3 1 1 3 986 1 1 15 LYS HG2 H 2.602 -8.380 -2.159 1.00 . A A . 15 LYS HG2 1 1 3 987 1 1 15 LYS HG3 H 3.293 -9.650 -1.127 1.00 . A A . 15 LYS HG3 1 1 3 988 1 1 15 LYS HZ1 H 5.098 -9.783 -2.517 1.00 . A A . 15 LYS HZ1 1 1 3 989 1 1 15 LYS HZ2 H 5.547 -10.891 -3.723 1.00 . A A . 15 LYS HZ2 1 1 3 990 1 1 15 LYS HZ3 H 4.643 -11.412 -2.384 1.00 . A A . 15 LYS HZ3 1 1 3 991 1 1 15 LYS N N 0.347 -7.715 -2.419 1.00 . A A . 15 LYS N 1 1 3 992 1 1 15 LYS NZ N 4.791 -10.624 -3.055 1.00 . A A . 15 LYS NZ 1 1 3 993 1 1 15 LYS O O -2.305 -9.174 -1.035 1.00 . A A . 15 LYS O 1 1 3 994 1 1 16 GLY C C -2.548 -6.256 1.073 1.00 . A A . 16 GLY C 1 1 3 995 1 1 16 GLY CA C -2.007 -7.638 1.216 1.00 . A A . 16 GLY CA 1 1 3 996 1 1 16 GLY H H -0.114 -7.450 0.348 1.00 . A A . 16 GLY H 1 1 3 997 1 1 16 GLY HA2 H -2.805 -8.345 1.080 1.00 . A A . 16 GLY HA2 1 1 3 998 1 1 16 GLY HA3 H -1.609 -7.742 2.208 1.00 . A A . 16 GLY HA3 1 1 3 999 1 1 16 GLY N N -0.976 -7.907 0.258 1.00 . A A . 16 GLY N 1 1 3 1000 1 1 16 GLY O O -3.722 -6.060 0.786 1.00 . A A . 16 GLY O 1 1 3 1001 1 1 17 LEU C C -2.728 -3.243 0.358 1.00 . A A . 17 LEU C 1 1 3 1002 1 1 17 LEU CA C -1.977 -3.923 1.483 1.00 . A A . 17 LEU CA 1 1 3 1003 1 1 17 LEU CB C -0.771 -3.099 1.899 1.00 . A A . 17 LEU CB 1 1 3 1004 1 1 17 LEU CD1 C 0.667 -4.057 3.713 1.00 . A A . 17 LEU CD1 1 1 3 1005 1 1 17 LEU CD2 C -0.333 -1.758 3.975 1.00 . A A . 17 LEU CD2 1 1 3 1006 1 1 17 LEU CG C -0.508 -3.156 3.401 1.00 . A A . 17 LEU CG 1 1 3 1007 1 1 17 LEU H H -0.699 -5.551 1.238 1.00 . A A . 17 LEU H 1 1 3 1008 1 1 17 LEU HA H -2.636 -3.948 2.327 1.00 . A A . 17 LEU HA 1 1 3 1009 1 1 17 LEU HB2 H 0.106 -3.465 1.367 1.00 . A A . 17 LEU HB2 1 1 3 1010 1 1 17 LEU HB3 H -0.945 -2.070 1.624 1.00 . A A . 17 LEU HB3 1 1 3 1011 1 1 17 LEU HD11 H 1.551 -3.679 3.224 1.00 . A A . 17 LEU HD11 1 1 3 1012 1 1 17 LEU HD12 H 0.450 -5.054 3.350 1.00 . A A . 17 LEU HD12 1 1 3 1013 1 1 17 LEU HD13 H 0.825 -4.087 4.780 1.00 . A A . 17 LEU HD13 1 1 3 1014 1 1 17 LEU HD21 H 0.441 -1.237 3.432 1.00 . A A . 17 LEU HD21 1 1 3 1015 1 1 17 LEU HD22 H -0.060 -1.829 5.017 1.00 . A A . 17 LEU HD22 1 1 3 1016 1 1 17 LEU HD23 H -1.272 -1.214 3.883 1.00 . A A . 17 LEU HD23 1 1 3 1017 1 1 17 LEU HG H -1.374 -3.593 3.877 1.00 . A A . 17 LEU HG 1 1 3 1018 1 1 17 LEU N N -1.640 -5.304 1.251 1.00 . A A . 17 LEU N 1 1 3 1019 1 1 17 LEU O O -3.040 -2.070 0.462 1.00 . A A . 17 LEU O 1 1 3 1020 1 1 18 ALA C C -5.335 -3.250 -0.896 1.00 . A A . 18 ALA C 1 1 3 1021 1 1 18 ALA CA C -3.988 -3.346 -1.641 1.00 . A A . 18 ALA CA 1 1 3 1022 1 1 18 ALA CB C -4.116 -4.139 -2.926 1.00 . A A . 18 ALA CB 1 1 3 1023 1 1 18 ALA H H -2.575 -4.782 -0.928 1.00 . A A . 18 ALA H 1 1 3 1024 1 1 18 ALA HA H -3.633 -2.347 -1.888 1.00 . A A . 18 ALA HA 1 1 3 1025 1 1 18 ALA HB1 H -4.991 -3.808 -3.466 1.00 . A A . 18 ALA HB1 1 1 3 1026 1 1 18 ALA HB2 H -4.201 -5.191 -2.697 1.00 . A A . 18 ALA HB2 1 1 3 1027 1 1 18 ALA HB3 H -3.236 -3.965 -3.531 1.00 . A A . 18 ALA HB3 1 1 3 1028 1 1 18 ALA N N -3.015 -3.917 -0.732 1.00 . A A . 18 ALA N 1 1 3 1029 1 1 18 ALA O O -6.240 -2.487 -1.272 1.00 . A A . 18 ALA O 1 1 3 1030 1 1 19 LYS C C -6.745 -2.696 1.777 1.00 . A A . 19 LYS C 1 1 3 1031 1 1 19 LYS CA C -6.532 -4.043 1.113 1.00 . A A . 19 LYS CA 1 1 3 1032 1 1 19 LYS CB C -6.249 -5.117 2.168 1.00 . A A . 19 LYS CB 1 1 3 1033 1 1 19 LYS CD C -5.602 -3.954 4.322 1.00 . A A . 19 LYS CD 1 1 3 1034 1 1 19 LYS CE C -6.619 -4.690 5.176 1.00 . A A . 19 LYS CE 1 1 3 1035 1 1 19 LYS CG C -5.125 -4.796 3.152 1.00 . A A . 19 LYS CG 1 1 3 1036 1 1 19 LYS H H -4.635 -4.582 0.445 1.00 . A A . 19 LYS H 1 1 3 1037 1 1 19 LYS HA H -7.413 -4.315 0.553 1.00 . A A . 19 LYS HA 1 1 3 1038 1 1 19 LYS HB2 H -7.133 -5.295 2.729 1.00 . A A . 19 LYS HB2 1 1 3 1039 1 1 19 LYS HB3 H -5.974 -6.014 1.654 1.00 . A A . 19 LYS HB3 1 1 3 1040 1 1 19 LYS HD2 H -4.753 -3.693 4.935 1.00 . A A . 19 LYS HD2 1 1 3 1041 1 1 19 LYS HD3 H -6.053 -3.056 3.929 1.00 . A A . 19 LYS HD3 1 1 3 1042 1 1 19 LYS HE2 H -7.381 -5.101 4.531 1.00 . A A . 19 LYS HE2 1 1 3 1043 1 1 19 LYS HE3 H -6.119 -5.491 5.698 1.00 . A A . 19 LYS HE3 1 1 3 1044 1 1 19 LYS HG2 H -4.716 -5.718 3.532 1.00 . A A . 19 LYS HG2 1 1 3 1045 1 1 19 LYS HG3 H -4.358 -4.250 2.623 1.00 . A A . 19 LYS HG3 1 1 3 1046 1 1 19 LYS HZ1 H -7.761 -4.354 6.896 1.00 . A A . 19 LYS HZ1 1 1 3 1047 1 1 19 LYS HZ2 H -7.961 -3.174 5.697 1.00 . A A . 19 LYS HZ2 1 1 3 1048 1 1 19 LYS HZ3 H -6.548 -3.191 6.638 1.00 . A A . 19 LYS HZ3 1 1 3 1049 1 1 19 LYS N N -5.402 -4.007 0.215 1.00 . A A . 19 LYS N 1 1 3 1050 1 1 19 LYS NZ N -7.263 -3.792 6.171 1.00 . A A . 19 LYS NZ 1 1 3 1051 1 1 19 LYS O O -7.856 -2.342 2.124 1.00 . A A . 19 LYS O 1 1 3 1052 1 1 20 VAL C C -5.580 0.379 1.498 1.00 . A A . 20 VAL C 1 1 3 1053 1 1 20 VAL CA C -5.647 -0.662 2.604 1.00 . A A . 20 VAL CA 1 1 3 1054 1 1 20 VAL CB C -4.434 -0.480 3.522 1.00 . A A . 20 VAL CB 1 1 3 1055 1 1 20 VAL CG1 C -3.172 -0.513 2.700 1.00 . A A . 20 VAL CG1 1 1 3 1056 1 1 20 VAL CG2 C -4.531 0.789 4.349 1.00 . A A . 20 VAL CG2 1 1 3 1057 1 1 20 VAL H H -4.784 -2.427 1.784 1.00 . A A . 20 VAL H 1 1 3 1058 1 1 20 VAL HA H -6.541 -0.537 3.182 1.00 . A A . 20 VAL HA 1 1 3 1059 1 1 20 VAL HB H -4.407 -1.310 4.186 1.00 . A A . 20 VAL HB 1 1 3 1060 1 1 20 VAL HG11 H -2.891 -1.549 2.525 1.00 . A A . 20 VAL HG11 1 1 3 1061 1 1 20 VAL HG12 H -2.381 0.005 3.215 1.00 . A A . 20 VAL HG12 1 1 3 1062 1 1 20 VAL HG13 H -3.368 -0.038 1.737 1.00 . A A . 20 VAL HG13 1 1 3 1063 1 1 20 VAL HG21 H -4.551 1.646 3.694 1.00 . A A . 20 VAL HG21 1 1 3 1064 1 1 20 VAL HG22 H -3.675 0.858 5.004 1.00 . A A . 20 VAL HG22 1 1 3 1065 1 1 20 VAL HG23 H -5.435 0.766 4.940 1.00 . A A . 20 VAL HG23 1 1 3 1066 1 1 20 VAL N N -5.641 -2.004 2.009 1.00 . A A . 20 VAL N 1 1 3 1067 1 1 20 VAL O O -6.002 1.521 1.628 1.00 . A A . 20 VAL O 1 1 3 1068 1 1 21 LEU C C -6.024 1.481 -1.220 1.00 . A A . 21 LEU C 1 1 3 1069 1 1 21 LEU CA C -4.795 0.745 -0.754 1.00 . A A . 21 LEU CA 1 1 3 1070 1 1 21 LEU CB C -4.383 -0.196 -1.825 1.00 . A A . 21 LEU CB 1 1 3 1071 1 1 21 LEU CD1 C -3.244 1.293 -3.422 1.00 . A A . 21 LEU CD1 1 1 3 1072 1 1 21 LEU CD2 C -2.037 0.448 -1.402 1.00 . A A . 21 LEU CD2 1 1 3 1073 1 1 21 LEU CG C -3.072 0.122 -2.469 1.00 . A A . 21 LEU CG 1 1 3 1074 1 1 21 LEU H H -4.653 -0.972 0.434 1.00 . A A . 21 LEU H 1 1 3 1075 1 1 21 LEU HA H -3.995 1.443 -0.570 1.00 . A A . 21 LEU HA 1 1 3 1076 1 1 21 LEU HB2 H -4.316 -1.182 -1.383 1.00 . A A . 21 LEU HB2 1 1 3 1077 1 1 21 LEU HB3 H -5.155 -0.204 -2.579 1.00 . A A . 21 LEU HB3 1 1 3 1078 1 1 21 LEU HD11 H -3.915 1.012 -4.219 1.00 . A A . 21 LEU HD11 1 1 3 1079 1 1 21 LEU HD12 H -2.285 1.573 -3.832 1.00 . A A . 21 LEU HD12 1 1 3 1080 1 1 21 LEU HD13 H -3.666 2.132 -2.878 1.00 . A A . 21 LEU HD13 1 1 3 1081 1 1 21 LEU HD21 H -2.225 -0.163 -0.526 1.00 . A A . 21 LEU HD21 1 1 3 1082 1 1 21 LEU HD22 H -2.112 1.494 -1.136 1.00 . A A . 21 LEU HD22 1 1 3 1083 1 1 21 LEU HD23 H -1.046 0.241 -1.782 1.00 . A A . 21 LEU HD23 1 1 3 1084 1 1 21 LEU HG H -2.757 -0.748 -3.009 1.00 . A A . 21 LEU HG 1 1 3 1085 1 1 21 LEU N N -5.003 -0.053 0.425 1.00 . A A . 21 LEU N 1 1 3 1086 1 1 21 LEU O O -6.085 2.705 -1.159 1.00 . A A . 21 LEU O 1 1 3 1087 1 1 22 ALA C C -9.008 2.109 -1.298 1.00 . A A . 22 ALA C 1 1 3 1088 1 1 22 ALA CA C -8.231 1.243 -2.272 1.00 . A A . 22 ALA CA 1 1 3 1089 1 1 22 ALA CB C -9.097 0.105 -2.754 1.00 . A A . 22 ALA CB 1 1 3 1090 1 1 22 ALA H H -6.904 -0.259 -1.542 1.00 . A A . 22 ALA H 1 1 3 1091 1 1 22 ALA HA H -7.948 1.833 -3.128 1.00 . A A . 22 ALA HA 1 1 3 1092 1 1 22 ALA HB1 H -8.534 -0.509 -3.437 1.00 . A A . 22 ALA HB1 1 1 3 1093 1 1 22 ALA HB2 H -9.963 0.506 -3.255 1.00 . A A . 22 ALA HB2 1 1 3 1094 1 1 22 ALA HB3 H -9.409 -0.485 -1.903 1.00 . A A . 22 ALA HB3 1 1 3 1095 1 1 22 ALA N N -7.005 0.710 -1.652 1.00 . A A . 22 ALA N 1 1 3 1096 1 1 22 ALA O O -9.989 2.763 -1.640 1.00 . A A . 22 ALA O 1 1 3 1097 1 1 23 GLU C C -8.660 4.074 1.330 1.00 . A A . 23 GLU C 1 1 3 1098 1 1 23 GLU CA C -9.159 2.671 1.052 1.00 . A A . 23 GLU CA 1 1 3 1099 1 1 23 GLU CB C -8.758 1.781 2.186 1.00 . A A . 23 GLU CB 1 1 3 1100 1 1 23 GLU CD C -9.950 -0.429 2.287 1.00 . A A . 23 GLU CD 1 1 3 1101 1 1 23 GLU CG C -8.752 0.335 1.761 1.00 . A A . 23 GLU CG 1 1 3 1102 1 1 23 GLU H H -7.651 1.661 0.038 1.00 . A A . 23 GLU H 1 1 3 1103 1 1 23 GLU HA H -10.223 2.647 0.929 1.00 . A A . 23 GLU HA 1 1 3 1104 1 1 23 GLU HB2 H -7.750 2.049 2.485 1.00 . A A . 23 GLU HB2 1 1 3 1105 1 1 23 GLU HB3 H -9.432 1.908 3.013 1.00 . A A . 23 GLU HB3 1 1 3 1106 1 1 23 GLU HG2 H -8.757 0.300 0.674 1.00 . A A . 23 GLU HG2 1 1 3 1107 1 1 23 GLU HG3 H -7.835 -0.124 2.105 1.00 . A A . 23 GLU HG3 1 1 3 1108 1 1 23 GLU N N -8.517 2.100 -0.095 1.00 . A A . 23 GLU N 1 1 3 1109 1 1 23 GLU O O -9.427 5.004 1.542 1.00 . A A . 23 GLU O 1 1 3 1110 1 1 23 GLU OE1 O -10.080 -0.564 3.521 1.00 . A A . 23 GLU OE1 1 1 3 1111 1 1 23 GLU OE2 O -10.771 -0.892 1.468 1.00 . A A . 23 GLU OE2 1 1 3 1112 1 1 24 LYS C C -6.082 6.029 0.502 1.00 . A A . 24 LYS C 1 1 3 1113 1 1 24 LYS CA C -6.651 5.389 1.745 1.00 . A A . 24 LYS CA 1 1 3 1114 1 1 24 LYS CB C -5.498 5.035 2.662 1.00 . A A . 24 LYS CB 1 1 3 1115 1 1 24 LYS CD C -6.430 3.829 4.747 1.00 . A A . 24 LYS CD 1 1 3 1116 1 1 24 LYS CE C -7.812 4.454 4.632 1.00 . A A . 24 LYS CE 1 1 3 1117 1 1 24 LYS CG C -5.699 3.723 3.411 1.00 . A A . 24 LYS CG 1 1 3 1118 1 1 24 LYS H H -6.817 3.349 1.320 1.00 . A A . 24 LYS H 1 1 3 1119 1 1 24 LYS HA H -7.314 6.071 2.242 1.00 . A A . 24 LYS HA 1 1 3 1120 1 1 24 LYS HB2 H -4.605 4.943 2.061 1.00 . A A . 24 LYS HB2 1 1 3 1121 1 1 24 LYS HB3 H -5.360 5.815 3.355 1.00 . A A . 24 LYS HB3 1 1 3 1122 1 1 24 LYS HD2 H -6.541 2.823 5.142 1.00 . A A . 24 LYS HD2 1 1 3 1123 1 1 24 LYS HD3 H -5.831 4.418 5.427 1.00 . A A . 24 LYS HD3 1 1 3 1124 1 1 24 LYS HE2 H -8.186 4.266 3.637 1.00 . A A . 24 LYS HE2 1 1 3 1125 1 1 24 LYS HE3 H -8.464 3.987 5.354 1.00 . A A . 24 LYS HE3 1 1 3 1126 1 1 24 LYS HG2 H -6.270 3.057 2.768 1.00 . A A . 24 LYS HG2 1 1 3 1127 1 1 24 LYS HG3 H -4.730 3.285 3.585 1.00 . A A . 24 LYS HG3 1 1 3 1128 1 1 24 LYS HZ1 H -8.762 6.308 4.839 1.00 . A A . 24 LYS HZ1 1 1 3 1129 1 1 24 LYS HZ2 H -7.226 6.403 4.138 1.00 . A A . 24 LYS HZ2 1 1 3 1130 1 1 24 LYS HZ3 H -7.378 6.130 5.800 1.00 . A A . 24 LYS HZ3 1 1 3 1131 1 1 24 LYS N N -7.350 4.163 1.435 1.00 . A A . 24 LYS N 1 1 3 1132 1 1 24 LYS NZ N -7.792 5.923 4.866 1.00 . A A . 24 LYS NZ 1 1 3 1133 1 1 24 LYS O O -6.319 7.195 0.196 1.00 . A A . 24 LYS O 1 1 3 1134 1 1 25 TYR C C -5.218 5.768 -2.536 1.00 . A A . 25 TYR C 1 1 3 1135 1 1 25 TYR CA C -4.446 5.667 -1.243 1.00 . A A . 25 TYR CA 1 1 3 1136 1 1 25 TYR CB C -3.348 4.637 -1.430 1.00 . A A . 25 TYR CB 1 1 3 1137 1 1 25 TYR CD1 C -3.393 3.413 0.663 1.00 . A A . 25 TYR CD1 1 1 3 1138 1 1 25 TYR CD2 C -1.370 4.521 0.138 1.00 . A A . 25 TYR CD2 1 1 3 1139 1 1 25 TYR CE1 C -2.861 2.941 1.804 1.00 . A A . 25 TYR CE1 1 1 3 1140 1 1 25 TYR CE2 C -0.807 4.052 1.309 1.00 . A A . 25 TYR CE2 1 1 3 1141 1 1 25 TYR CG C -2.681 4.202 -0.182 1.00 . A A . 25 TYR CG 1 1 3 1142 1 1 25 TYR CZ C -1.561 3.256 2.143 1.00 . A A . 25 TYR CZ 1 1 3 1143 1 1 25 TYR H H -5.333 4.266 0.008 1.00 . A A . 25 TYR H 1 1 3 1144 1 1 25 TYR HA H -4.027 6.609 -0.955 1.00 . A A . 25 TYR HA 1 1 3 1145 1 1 25 TYR HB2 H -3.805 3.754 -1.825 1.00 . A A . 25 TYR HB2 1 1 3 1146 1 1 25 TYR HB3 H -2.609 4.996 -2.107 1.00 . A A . 25 TYR HB3 1 1 3 1147 1 1 25 TYR HD1 H -4.424 3.183 0.408 1.00 . A A . 25 TYR HD1 1 1 3 1148 1 1 25 TYR HD2 H -0.796 5.145 -0.530 1.00 . A A . 25 TYR HD2 1 1 3 1149 1 1 25 TYR HE1 H -3.466 2.331 2.420 1.00 . A A . 25 TYR HE1 1 1 3 1150 1 1 25 TYR HE2 H 0.210 4.308 1.563 1.00 . A A . 25 TYR HE2 1 1 3 1151 1 1 25 TYR HH H -1.243 1.838 3.403 1.00 . A A . 25 TYR HH 1 1 3 1152 1 1 25 TYR N N -5.314 5.221 -0.193 1.00 . A A . 25 TYR N 1 1 3 1153 1 1 25 TYR O O -5.319 6.827 -3.151 1.00 . A A . 25 TYR O 1 1 3 1154 1 1 25 TYR OH O -1.016 2.768 3.310 1.00 . A A . 25 TYR OH 1 1 3 1155 1 1 26 ALA C C -7.886 5.199 -3.944 1.00 . A A . 26 ALA C 1 1 3 1156 1 1 26 ALA CA C -6.553 4.504 -4.138 1.00 . A A . 26 ALA CA 1 1 3 1157 1 1 26 ALA CB C -6.760 3.040 -4.463 1.00 . A A . 26 ALA CB 1 1 3 1158 1 1 26 ALA H H -5.626 3.809 -2.364 1.00 . A A . 26 ALA H 1 1 3 1159 1 1 26 ALA HA H -6.015 4.969 -4.952 1.00 . A A . 26 ALA HA 1 1 3 1160 1 1 26 ALA HB1 H -5.805 2.578 -4.666 1.00 . A A . 26 ALA HB1 1 1 3 1161 1 1 26 ALA HB2 H -7.402 2.944 -5.326 1.00 . A A . 26 ALA HB2 1 1 3 1162 1 1 26 ALA HB3 H -7.219 2.552 -3.610 1.00 . A A . 26 ALA HB3 1 1 3 1163 1 1 26 ALA N N -5.759 4.620 -2.930 1.00 . A A . 26 ALA N 1 1 3 1164 1 1 26 ALA O O -8.599 5.489 -4.904 1.00 . A A . 26 ALA O 1 1 3 1165 1 1 27 ASN C C -9.520 7.469 -3.121 1.00 . A A . 27 ASN C 1 1 3 1166 1 1 27 ASN CA C -9.376 6.200 -2.288 1.00 . A A . 27 ASN CA 1 1 3 1167 1 1 27 ASN CB C -9.262 6.560 -0.816 1.00 . A A . 27 ASN CB 1 1 3 1168 1 1 27 ASN CG C -10.401 7.441 -0.333 1.00 . A A . 27 ASN CG 1 1 3 1169 1 1 27 ASN H H -7.636 5.048 -1.972 1.00 . A A . 27 ASN H 1 1 3 1170 1 1 27 ASN HA H -10.249 5.583 -2.433 1.00 . A A . 27 ASN HA 1 1 3 1171 1 1 27 ASN HB2 H -9.254 5.648 -0.232 1.00 . A A . 27 ASN HB2 1 1 3 1172 1 1 27 ASN HB3 H -8.328 7.081 -0.653 1.00 . A A . 27 ASN HB3 1 1 3 1173 1 1 27 ASN HD21 H -9.304 9.071 -0.638 1.00 . A A . 27 ASN HD21 1 1 3 1174 1 1 27 ASN HD22 H -10.904 9.339 -0.025 1.00 . A A . 27 ASN HD22 1 1 3 1175 1 1 27 ASN N N -8.207 5.427 -2.678 1.00 . A A . 27 ASN N 1 1 3 1176 1 1 27 ASN ND2 N -10.182 8.747 -0.332 1.00 . A A . 27 ASN ND2 1 1 3 1177 1 1 27 ASN O O -8.644 8.356 -3.023 1.00 . A A . 27 ASN O 1 1 3 1178 1 1 27 ASN OXT O -10.520 7.587 -3.857 1.00 . A A . 27 ASN OXT 1 1 3 1179 1 1 27 ASN OD1 O -11.460 6.951 0.055 1.00 . A A . 27 ASN OD1 1 1 4 1180 1 1 1 GLY C C 15.570 1.950 -1.016 1.00 . A A . 1 GLY C 1 1 4 1181 1 1 1 GLY CA C 15.379 2.093 -2.510 1.00 . A A . 1 GLY CA 1 1 4 1182 1 1 1 GLY H1 H 16.005 0.192 -3.092 1.00 . A A . 1 GLY H1 1 1 4 1183 1 1 1 GLY H2 H 17.258 1.325 -2.979 1.00 . A A . 1 GLY H2 1 1 4 1184 1 1 1 GLY H3 H 16.188 1.378 -4.294 1.00 . A A . 1 GLY H3 1 1 4 1185 1 1 1 GLY HA2 H 15.591 3.112 -2.795 1.00 . A A . 1 GLY HA2 1 1 4 1186 1 1 1 GLY HA3 H 14.350 1.867 -2.756 1.00 . A A . 1 GLY HA3 1 1 4 1187 1 1 1 GLY N N 16.268 1.185 -3.271 1.00 . A A . 1 GLY N 1 1 4 1188 1 1 1 GLY O O 16.647 1.567 -0.558 1.00 . A A . 1 GLY O 1 1 4 1189 1 1 2 ILE C C 13.920 0.877 1.644 1.00 . A A . 2 ILE C 1 1 4 1190 1 1 2 ILE CA C 14.594 2.157 1.189 1.00 . A A . 2 ILE CA 1 1 4 1191 1 1 2 ILE CB C 13.904 3.357 1.868 1.00 . A A . 2 ILE CB 1 1 4 1192 1 1 2 ILE CD1 C 16.065 4.717 1.731 1.00 . A A . 2 ILE CD1 1 1 4 1193 1 1 2 ILE CG1 C 14.572 4.673 1.466 1.00 . A A . 2 ILE CG1 1 1 4 1194 1 1 2 ILE CG2 C 13.909 3.181 3.372 1.00 . A A . 2 ILE CG2 1 1 4 1195 1 1 2 ILE H H 13.689 2.540 -0.670 1.00 . A A . 2 ILE H 1 1 4 1196 1 1 2 ILE HA H 15.633 2.140 1.487 1.00 . A A . 2 ILE HA 1 1 4 1197 1 1 2 ILE HB H 12.874 3.373 1.542 1.00 . A A . 2 ILE HB 1 1 4 1198 1 1 2 ILE HD11 H 16.557 3.930 1.178 1.00 . A A . 2 ILE HD11 1 1 4 1199 1 1 2 ILE HD12 H 16.249 4.583 2.789 1.00 . A A . 2 ILE HD12 1 1 4 1200 1 1 2 ILE HD13 H 16.454 5.674 1.416 1.00 . A A . 2 ILE HD13 1 1 4 1201 1 1 2 ILE HG12 H 14.415 4.836 0.410 1.00 . A A . 2 ILE HG12 1 1 4 1202 1 1 2 ILE HG13 H 14.112 5.479 2.018 1.00 . A A . 2 ILE HG13 1 1 4 1203 1 1 2 ILE HG21 H 13.388 2.262 3.615 1.00 . A A . 2 ILE HG21 1 1 4 1204 1 1 2 ILE HG22 H 13.406 4.017 3.834 1.00 . A A . 2 ILE HG22 1 1 4 1205 1 1 2 ILE HG23 H 14.925 3.126 3.725 1.00 . A A . 2 ILE HG23 1 1 4 1206 1 1 2 ILE N N 14.531 2.256 -0.251 1.00 . A A . 2 ILE N 1 1 4 1207 1 1 2 ILE O O 14.579 -0.122 1.934 1.00 . A A . 2 ILE O 1 1 4 1208 1 1 3 GLY C C 10.441 0.146 2.496 1.00 . A A . 3 GLY C 1 1 4 1209 1 1 3 GLY CA C 11.825 -0.238 2.030 1.00 . A A . 3 GLY CA 1 1 4 1210 1 1 3 GLY H H 12.141 1.768 1.518 1.00 . A A . 3 GLY H 1 1 4 1211 1 1 3 GLY HA2 H 11.749 -0.864 1.161 1.00 . A A . 3 GLY HA2 1 1 4 1212 1 1 3 GLY HA3 H 12.325 -0.784 2.816 1.00 . A A . 3 GLY HA3 1 1 4 1213 1 1 3 GLY N N 12.598 0.922 1.692 1.00 . A A . 3 GLY N 1 1 4 1214 1 1 3 GLY O O 9.501 0.208 1.694 1.00 . A A . 3 GLY O 1 1 4 1215 1 1 4 GLY C C 8.605 2.192 4.092 1.00 . A A . 4 GLY C 1 1 4 1216 1 1 4 GLY CA C 9.058 0.783 4.393 1.00 . A A . 4 GLY CA 1 1 4 1217 1 1 4 GLY H H 11.159 0.556 4.309 1.00 . A A . 4 GLY H 1 1 4 1218 1 1 4 GLY HA2 H 8.323 0.089 4.020 1.00 . A A . 4 GLY HA2 1 1 4 1219 1 1 4 GLY HA3 H 9.148 0.662 5.463 1.00 . A A . 4 GLY HA3 1 1 4 1220 1 1 4 GLY N N 10.339 0.485 3.776 1.00 . A A . 4 GLY N 1 1 4 1221 1 1 4 GLY O O 8.181 2.932 4.976 1.00 . A A . 4 GLY O 1 1 4 1222 1 1 5 VAL C C 7.201 3.846 1.396 1.00 . A A . 5 VAL C 1 1 4 1223 1 1 5 VAL CA C 8.375 3.885 2.376 1.00 . A A . 5 VAL CA 1 1 4 1224 1 1 5 VAL CB C 9.610 4.547 1.725 1.00 . A A . 5 VAL CB 1 1 4 1225 1 1 5 VAL CG1 C 10.412 3.523 0.925 1.00 . A A . 5 VAL CG1 1 1 4 1226 1 1 5 VAL CG2 C 9.191 5.700 0.839 1.00 . A A . 5 VAL CG2 1 1 4 1227 1 1 5 VAL H H 9.027 1.893 2.184 1.00 . A A . 5 VAL H 1 1 4 1228 1 1 5 VAL HA H 8.091 4.474 3.233 1.00 . A A . 5 VAL HA 1 1 4 1229 1 1 5 VAL HB H 10.241 4.933 2.510 1.00 . A A . 5 VAL HB 1 1 4 1230 1 1 5 VAL HG11 H 11.284 4.001 0.499 1.00 . A A . 5 VAL HG11 1 1 4 1231 1 1 5 VAL HG12 H 9.797 3.117 0.134 1.00 . A A . 5 VAL HG12 1 1 4 1232 1 1 5 VAL HG13 H 10.725 2.723 1.579 1.00 . A A . 5 VAL HG13 1 1 4 1233 1 1 5 VAL HG21 H 8.642 5.306 -0.007 1.00 . A A . 5 VAL HG21 1 1 4 1234 1 1 5 VAL HG22 H 10.067 6.228 0.493 1.00 . A A . 5 VAL HG22 1 1 4 1235 1 1 5 VAL HG23 H 8.557 6.369 1.399 1.00 . A A . 5 VAL HG23 1 1 4 1236 1 1 5 VAL N N 8.709 2.554 2.833 1.00 . A A . 5 VAL N 1 1 4 1237 1 1 5 VAL O O 6.161 4.459 1.631 1.00 . A A . 5 VAL O 1 1 4 1238 1 1 6 LEU C C 6.763 1.786 -1.590 1.00 . A A . 6 LEU C 1 1 4 1239 1 1 6 LEU CA C 6.363 2.953 -0.712 1.00 . A A . 6 LEU CA 1 1 4 1240 1 1 6 LEU CB C 6.188 4.263 -1.528 1.00 . A A . 6 LEU CB 1 1 4 1241 1 1 6 LEU CD1 C 8.648 4.432 -2.181 1.00 . A A . 6 LEU CD1 1 1 4 1242 1 1 6 LEU CD2 C 6.951 3.812 -3.912 1.00 . A A . 6 LEU CD2 1 1 4 1243 1 1 6 LEU CG C 7.212 4.607 -2.640 1.00 . A A . 6 LEU CG 1 1 4 1244 1 1 6 LEU H H 8.212 2.612 0.227 1.00 . A A . 6 LEU H 1 1 4 1245 1 1 6 LEU HA H 5.429 2.710 -0.225 1.00 . A A . 6 LEU HA 1 1 4 1246 1 1 6 LEU HB2 H 5.212 4.234 -1.986 1.00 . A A . 6 LEU HB2 1 1 4 1247 1 1 6 LEU HB3 H 6.197 5.075 -0.819 1.00 . A A . 6 LEU HB3 1 1 4 1248 1 1 6 LEU HD11 H 9.317 4.635 -3.003 1.00 . A A . 6 LEU HD11 1 1 4 1249 1 1 6 LEU HD12 H 8.795 3.418 -1.836 1.00 . A A . 6 LEU HD12 1 1 4 1250 1 1 6 LEU HD13 H 8.852 5.120 -1.372 1.00 . A A . 6 LEU HD13 1 1 4 1251 1 1 6 LEU HD21 H 7.020 2.756 -3.697 1.00 . A A . 6 LEU HD21 1 1 4 1252 1 1 6 LEU HD22 H 7.684 4.078 -4.660 1.00 . A A . 6 LEU HD22 1 1 4 1253 1 1 6 LEU HD23 H 5.960 4.041 -4.280 1.00 . A A . 6 LEU HD23 1 1 4 1254 1 1 6 LEU HG H 7.090 5.651 -2.888 1.00 . A A . 6 LEU HG 1 1 4 1255 1 1 6 LEU N N 7.375 3.097 0.322 1.00 . A A . 6 LEU N 1 1 4 1256 1 1 6 LEU O O 5.964 1.230 -2.336 1.00 . A A . 6 LEU O 1 1 4 1257 1 1 7 LEU C C 8.073 -1.010 -1.751 1.00 . A A . 7 LEU C 1 1 4 1258 1 1 7 LEU CA C 8.596 0.344 -2.233 1.00 . A A . 7 LEU CA 1 1 4 1259 1 1 7 LEU CB C 10.126 0.443 -2.171 1.00 . A A . 7 LEU CB 1 1 4 1260 1 1 7 LEU CD1 C 11.102 -1.803 -2.016 1.00 . A A . 7 LEU CD1 1 1 4 1261 1 1 7 LEU CD2 C 10.134 -1.045 -4.186 1.00 . A A . 7 LEU CD2 1 1 4 1262 1 1 7 LEU CG C 10.891 -0.627 -2.932 1.00 . A A . 7 LEU CG 1 1 4 1263 1 1 7 LEU H H 8.595 1.891 -0.822 1.00 . A A . 7 LEU H 1 1 4 1264 1 1 7 LEU HA H 8.286 0.480 -3.257 1.00 . A A . 7 LEU HA 1 1 4 1265 1 1 7 LEU HB2 H 10.421 1.407 -2.556 1.00 . A A . 7 LEU HB2 1 1 4 1266 1 1 7 LEU HB3 H 10.422 0.382 -1.134 1.00 . A A . 7 LEU HB3 1 1 4 1267 1 1 7 LEU HD11 H 10.140 -2.215 -1.759 1.00 . A A . 7 LEU HD11 1 1 4 1268 1 1 7 LEU HD12 H 11.590 -1.456 -1.115 1.00 . A A . 7 LEU HD12 1 1 4 1269 1 1 7 LEU HD13 H 11.707 -2.549 -2.503 1.00 . A A . 7 LEU HD13 1 1 4 1270 1 1 7 LEU HD21 H 10.649 -1.864 -4.662 1.00 . A A . 7 LEU HD21 1 1 4 1271 1 1 7 LEU HD22 H 10.076 -0.209 -4.866 1.00 . A A . 7 LEU HD22 1 1 4 1272 1 1 7 LEU HD23 H 9.132 -1.357 -3.911 1.00 . A A . 7 LEU HD23 1 1 4 1273 1 1 7 LEU HG H 11.857 -0.240 -3.225 1.00 . A A . 7 LEU HG 1 1 4 1274 1 1 7 LEU N N 8.026 1.414 -1.458 1.00 . A A . 7 LEU N 1 1 4 1275 1 1 7 LEU O O 7.351 -1.686 -2.479 1.00 . A A . 7 LEU O 1 1 4 1276 1 1 8 SER C C 6.609 -2.482 0.669 1.00 . A A . 8 SER C 1 1 4 1277 1 1 8 SER CA C 7.918 -2.694 -0.037 1.00 . A A . 8 SER CA 1 1 4 1278 1 1 8 SER CB C 8.943 -3.394 0.856 1.00 . A A . 8 SER CB 1 1 4 1279 1 1 8 SER H H 8.870 -0.789 0.086 1.00 . A A . 8 SER H 1 1 4 1280 1 1 8 SER HA H 7.727 -3.307 -0.907 1.00 . A A . 8 SER HA 1 1 4 1281 1 1 8 SER HB2 H 8.486 -4.265 1.298 1.00 . A A . 8 SER HB2 1 1 4 1282 1 1 8 SER HB3 H 9.787 -3.701 0.251 1.00 . A A . 8 SER HB3 1 1 4 1283 1 1 8 SER HG H 9.051 -2.830 2.740 1.00 . A A . 8 SER HG 1 1 4 1284 1 1 8 SER N N 8.383 -1.399 -0.521 1.00 . A A . 8 SER N 1 1 4 1285 1 1 8 SER O O 5.830 -3.405 0.889 1.00 . A A . 8 SER O 1 1 4 1286 1 1 8 SER OG O 9.409 -2.541 1.884 1.00 . A A . 8 SER OG 1 1 4 1287 1 1 9 ALA C C 4.136 -1.049 0.136 1.00 . A A . 9 ALA C 1 1 4 1288 1 1 9 ALA CA C 5.067 -0.736 1.305 1.00 . A A . 9 ALA CA 1 1 4 1289 1 1 9 ALA CB C 5.161 0.754 1.553 1.00 . A A . 9 ALA CB 1 1 4 1290 1 1 9 ALA H H 7.139 -0.612 1.038 1.00 . A A . 9 ALA H 1 1 4 1291 1 1 9 ALA HA H 4.714 -1.223 2.201 1.00 . A A . 9 ALA HA 1 1 4 1292 1 1 9 ALA HB1 H 4.192 1.209 1.420 1.00 . A A . 9 ALA HB1 1 1 4 1293 1 1 9 ALA HB2 H 5.874 1.186 0.852 1.00 . A A . 9 ALA HB2 1 1 4 1294 1 1 9 ALA HB3 H 5.508 0.925 2.562 1.00 . A A . 9 ALA HB3 1 1 4 1295 1 1 9 ALA N N 6.382 -1.227 0.990 1.00 . A A . 9 ALA N 1 1 4 1296 1 1 9 ALA O O 2.944 -1.294 0.316 1.00 . A A . 9 ALA O 1 1 4 1297 1 1 10 GLY C C 3.959 -2.970 -2.392 1.00 . A A . 10 GLY C 1 1 4 1298 1 1 10 GLY CA C 3.961 -1.470 -2.238 1.00 . A A . 10 GLY CA 1 1 4 1299 1 1 10 GLY H H 5.658 -0.805 -1.164 1.00 . A A . 10 GLY H 1 1 4 1300 1 1 10 GLY HA2 H 2.952 -1.130 -2.135 1.00 . A A . 10 GLY HA2 1 1 4 1301 1 1 10 GLY HA3 H 4.401 -1.027 -3.119 1.00 . A A . 10 GLY HA3 1 1 4 1302 1 1 10 GLY N N 4.710 -1.066 -1.071 1.00 . A A . 10 GLY N 1 1 4 1303 1 1 10 GLY O O 2.935 -3.572 -2.704 1.00 . A A . 10 GLY O 1 1 4 1304 1 1 11 LYS C C 4.265 -5.736 -1.326 1.00 . A A . 11 LYS C 1 1 4 1305 1 1 11 LYS CA C 5.289 -5.010 -2.193 1.00 . A A . 11 LYS CA 1 1 4 1306 1 1 11 LYS CB C 6.699 -5.358 -1.735 1.00 . A A . 11 LYS CB 1 1 4 1307 1 1 11 LYS CD C 8.247 -4.543 -3.566 1.00 . A A . 11 LYS CD 1 1 4 1308 1 1 11 LYS CE C 7.269 -3.958 -4.567 1.00 . A A . 11 LYS CE 1 1 4 1309 1 1 11 LYS CG C 7.663 -5.747 -2.841 1.00 . A A . 11 LYS CG 1 1 4 1310 1 1 11 LYS H H 5.901 -3.012 -1.953 1.00 . A A . 11 LYS H 1 1 4 1311 1 1 11 LYS HA H 5.160 -5.331 -3.210 1.00 . A A . 11 LYS HA 1 1 4 1312 1 1 11 LYS HB2 H 7.102 -4.488 -1.242 1.00 . A A . 11 LYS HB2 1 1 4 1313 1 1 11 LYS HB3 H 6.645 -6.173 -1.034 1.00 . A A . 11 LYS HB3 1 1 4 1314 1 1 11 LYS HD2 H 8.498 -3.786 -2.839 1.00 . A A . 11 LYS HD2 1 1 4 1315 1 1 11 LYS HD3 H 9.142 -4.852 -4.089 1.00 . A A . 11 LYS HD3 1 1 4 1316 1 1 11 LYS HE2 H 6.303 -3.878 -4.086 1.00 . A A . 11 LYS HE2 1 1 4 1317 1 1 11 LYS HE3 H 7.610 -2.975 -4.856 1.00 . A A . 11 LYS HE3 1 1 4 1318 1 1 11 LYS HG2 H 8.470 -6.320 -2.412 1.00 . A A . 11 LYS HG2 1 1 4 1319 1 1 11 LYS HG3 H 7.126 -6.354 -3.546 1.00 . A A . 11 LYS HG3 1 1 4 1320 1 1 11 LYS HZ1 H 6.401 -4.431 -6.415 1.00 . A A . 11 LYS HZ1 1 1 4 1321 1 1 11 LYS HZ2 H 6.896 -5.789 -5.520 1.00 . A A . 11 LYS HZ2 1 1 4 1322 1 1 11 LYS HZ3 H 8.047 -4.822 -6.304 1.00 . A A . 11 LYS HZ3 1 1 4 1323 1 1 11 LYS N N 5.117 -3.567 -2.153 1.00 . A A . 11 LYS N 1 1 4 1324 1 1 11 LYS NZ N 7.142 -4.810 -5.783 1.00 . A A . 11 LYS NZ 1 1 4 1325 1 1 11 LYS O O 3.750 -6.784 -1.712 1.00 . A A . 11 LYS O 1 1 4 1326 1 1 12 ALA C C 1.590 -5.604 0.169 1.00 . A A . 12 ALA C 1 1 4 1327 1 1 12 ALA CA C 3.000 -5.775 0.730 1.00 . A A . 12 ALA CA 1 1 4 1328 1 1 12 ALA CB C 3.106 -5.168 2.121 1.00 . A A . 12 ALA CB 1 1 4 1329 1 1 12 ALA H H 4.456 -4.368 0.120 1.00 . A A . 12 ALA H 1 1 4 1330 1 1 12 ALA HA H 3.217 -6.830 0.802 1.00 . A A . 12 ALA HA 1 1 4 1331 1 1 12 ALA HB1 H 2.437 -5.687 2.792 1.00 . A A . 12 ALA HB1 1 1 4 1332 1 1 12 ALA HB2 H 2.835 -4.124 2.081 1.00 . A A . 12 ALA HB2 1 1 4 1333 1 1 12 ALA HB3 H 4.121 -5.262 2.479 1.00 . A A . 12 ALA HB3 1 1 4 1334 1 1 12 ALA N N 3.982 -5.185 -0.159 1.00 . A A . 12 ALA N 1 1 4 1335 1 1 12 ALA O O 0.735 -6.481 0.320 1.00 . A A . 12 ALA O 1 1 4 1336 1 1 13 ALA C C -0.282 -5.158 -2.193 1.00 . A A . 13 ALA C 1 1 4 1337 1 1 13 ALA CA C 0.053 -4.191 -1.077 1.00 . A A . 13 ALA CA 1 1 4 1338 1 1 13 ALA CB C -0.035 -2.758 -1.581 1.00 . A A . 13 ALA CB 1 1 4 1339 1 1 13 ALA H H 2.091 -3.846 -0.628 1.00 . A A . 13 ALA H 1 1 4 1340 1 1 13 ALA HA H -0.680 -4.310 -0.290 1.00 . A A . 13 ALA HA 1 1 4 1341 1 1 13 ALA HB1 H -1.071 -2.525 -1.824 1.00 . A A . 13 ALA HB1 1 1 4 1342 1 1 13 ALA HB2 H 0.579 -2.648 -2.464 1.00 . A A . 13 ALA HB2 1 1 4 1343 1 1 13 ALA HB3 H 0.314 -2.083 -0.814 1.00 . A A . 13 ALA HB3 1 1 4 1344 1 1 13 ALA N N 1.361 -4.484 -0.506 1.00 . A A . 13 ALA N 1 1 4 1345 1 1 13 ALA O O -1.416 -5.617 -2.295 1.00 . A A . 13 ALA O 1 1 4 1346 1 1 14 LEU C C -0.068 -7.740 -3.558 1.00 . A A . 14 LEU C 1 1 4 1347 1 1 14 LEU CA C 0.522 -6.448 -4.098 1.00 . A A . 14 LEU CA 1 1 4 1348 1 1 14 LEU CB C 1.856 -6.773 -4.755 1.00 . A A . 14 LEU CB 1 1 4 1349 1 1 14 LEU CD1 C 4.213 -6.093 -5.026 1.00 . A A . 14 LEU CD1 1 1 4 1350 1 1 14 LEU CD2 C 2.423 -4.792 -6.181 1.00 . A A . 14 LEU CD2 1 1 4 1351 1 1 14 LEU CG C 2.791 -5.592 -4.941 1.00 . A A . 14 LEU CG 1 1 4 1352 1 1 14 LEU H H 1.603 -5.080 -2.890 1.00 . A A . 14 LEU H 1 1 4 1353 1 1 14 LEU HA H -0.148 -6.019 -4.827 1.00 . A A . 14 LEU HA 1 1 4 1354 1 1 14 LEU HB2 H 2.358 -7.511 -4.146 1.00 . A A . 14 LEU HB2 1 1 4 1355 1 1 14 LEU HB3 H 1.658 -7.206 -5.724 1.00 . A A . 14 LEU HB3 1 1 4 1356 1 1 14 LEU HD11 H 4.433 -6.668 -4.133 1.00 . A A . 14 LEU HD11 1 1 4 1357 1 1 14 LEU HD12 H 4.887 -5.252 -5.086 1.00 . A A . 14 LEU HD12 1 1 4 1358 1 1 14 LEU HD13 H 4.331 -6.717 -5.898 1.00 . A A . 14 LEU HD13 1 1 4 1359 1 1 14 LEU HD21 H 1.410 -4.432 -6.090 1.00 . A A . 14 LEU HD21 1 1 4 1360 1 1 14 LEU HD22 H 2.506 -5.422 -7.054 1.00 . A A . 14 LEU HD22 1 1 4 1361 1 1 14 LEU HD23 H 3.095 -3.950 -6.277 1.00 . A A . 14 LEU HD23 1 1 4 1362 1 1 14 LEU HG H 2.715 -4.940 -4.083 1.00 . A A . 14 LEU HG 1 1 4 1363 1 1 14 LEU N N 0.713 -5.491 -3.012 1.00 . A A . 14 LEU N 1 1 4 1364 1 1 14 LEU O O -0.774 -8.466 -4.258 1.00 . A A . 14 LEU O 1 1 4 1365 1 1 15 LYS C C -1.483 -9.010 -0.896 1.00 . A A . 15 LYS C 1 1 4 1366 1 1 15 LYS CA C -0.193 -9.237 -1.677 1.00 . A A . 15 LYS CA 1 1 4 1367 1 1 15 LYS CB C 0.915 -9.717 -0.751 1.00 . A A . 15 LYS CB 1 1 4 1368 1 1 15 LYS CD C 2.288 -10.634 -2.642 1.00 . A A . 15 LYS CD 1 1 4 1369 1 1 15 LYS CE C 1.898 -12.045 -2.272 1.00 . A A . 15 LYS CE 1 1 4 1370 1 1 15 LYS CG C 2.274 -9.734 -1.428 1.00 . A A . 15 LYS CG 1 1 4 1371 1 1 15 LYS H H 0.783 -7.389 -1.783 1.00 . A A . 15 LYS H 1 1 4 1372 1 1 15 LYS HA H -0.346 -9.972 -2.441 1.00 . A A . 15 LYS HA 1 1 4 1373 1 1 15 LYS HB2 H 0.967 -9.047 0.092 1.00 . A A . 15 LYS HB2 1 1 4 1374 1 1 15 LYS HB3 H 0.686 -10.713 -0.404 1.00 . A A . 15 LYS HB3 1 1 4 1375 1 1 15 LYS HD2 H 1.584 -10.250 -3.368 1.00 . A A . 15 LYS HD2 1 1 4 1376 1 1 15 LYS HD3 H 3.281 -10.641 -3.066 1.00 . A A . 15 LYS HD3 1 1 4 1377 1 1 15 LYS HE2 H 2.711 -12.498 -1.724 1.00 . A A . 15 LYS HE2 1 1 4 1378 1 1 15 LYS HE3 H 1.024 -11.994 -1.645 1.00 . A A . 15 LYS HE3 1 1 4 1379 1 1 15 LYS HG2 H 2.491 -8.735 -1.754 1.00 . A A . 15 LYS HG2 1 1 4 1380 1 1 15 LYS HG3 H 3.023 -10.066 -0.723 1.00 . A A . 15 LYS HG3 1 1 4 1381 1 1 15 LYS HZ1 H 1.300 -13.825 -3.174 1.00 . A A . 15 LYS HZ1 1 1 4 1382 1 1 15 LYS HZ2 H 2.446 -12.952 -4.069 1.00 . A A . 15 LYS HZ2 1 1 4 1383 1 1 15 LYS HZ3 H 0.833 -12.434 -4.022 1.00 . A A . 15 LYS HZ3 1 1 4 1384 1 1 15 LYS N N 0.242 -8.021 -2.300 1.00 . A A . 15 LYS N 1 1 4 1385 1 1 15 LYS NZ N 1.599 -12.870 -3.466 1.00 . A A . 15 LYS NZ 1 1 4 1386 1 1 15 LYS O O -2.548 -9.493 -1.286 1.00 . A A . 15 LYS O 1 1 4 1387 1 1 16 GLY C C -2.973 -6.565 0.872 1.00 . A A . 16 GLY C 1 1 4 1388 1 1 16 GLY CA C -2.519 -7.977 1.027 1.00 . A A . 16 GLY CA 1 1 4 1389 1 1 16 GLY H H -0.521 -7.846 0.413 1.00 . A A . 16 GLY H 1 1 4 1390 1 1 16 GLY HA2 H -3.325 -8.634 0.759 1.00 . A A . 16 GLY HA2 1 1 4 1391 1 1 16 GLY HA3 H -2.267 -8.134 2.058 1.00 . A A . 16 GLY HA3 1 1 4 1392 1 1 16 GLY N N -1.376 -8.269 0.201 1.00 . A A . 16 GLY N 1 1 4 1393 1 1 16 GLY O O -4.088 -6.287 0.440 1.00 . A A . 16 GLY O 1 1 4 1394 1 1 17 LEU C C -2.911 -3.509 0.344 1.00 . A A . 17 LEU C 1 1 4 1395 1 1 17 LEU CA C -2.344 -4.296 1.499 1.00 . A A . 17 LEU CA 1 1 4 1396 1 1 17 LEU CB C -1.157 -3.579 2.102 1.00 . A A . 17 LEU CB 1 1 4 1397 1 1 17 LEU CD1 C 0.102 -4.719 3.930 1.00 . A A . 17 LEU CD1 1 1 4 1398 1 1 17 LEU CD2 C -0.949 -2.464 4.332 1.00 . A A . 17 LEU CD2 1 1 4 1399 1 1 17 LEU CG C -1.049 -3.796 3.606 1.00 . A A . 17 LEU CG 1 1 4 1400 1 1 17 LEU H H -1.127 -5.971 1.299 1.00 . A A . 17 LEU H 1 1 4 1401 1 1 17 LEU HA H -3.094 -4.332 2.261 1.00 . A A . 17 LEU HA 1 1 4 1402 1 1 17 LEU HB2 H -0.247 -3.933 1.618 1.00 . A A . 17 LEU HB2 1 1 4 1403 1 1 17 LEU HB3 H -1.267 -2.521 1.917 1.00 . A A . 17 LEU HB3 1 1 4 1404 1 1 17 LEU HD11 H 0.166 -4.857 5.000 1.00 . A A . 17 LEU HD11 1 1 4 1405 1 1 17 LEU HD12 H 1.022 -4.293 3.563 1.00 . A A . 17 LEU HD12 1 1 4 1406 1 1 17 LEU HD13 H -0.072 -5.675 3.454 1.00 . A A . 17 LEU HD13 1 1 4 1407 1 1 17 LEU HD21 H -1.878 -1.913 4.190 1.00 . A A . 17 LEU HD21 1 1 4 1408 1 1 17 LEU HD22 H -0.126 -1.893 3.928 1.00 . A A . 17 LEU HD22 1 1 4 1409 1 1 17 LEU HD23 H -0.789 -2.637 5.384 1.00 . A A . 17 LEU HD23 1 1 4 1410 1 1 17 LEU HG H -1.953 -4.282 3.945 1.00 . A A . 17 LEU HG 1 1 4 1411 1 1 17 LEU N N -2.049 -5.675 1.216 1.00 . A A . 17 LEU N 1 1 4 1412 1 1 17 LEU O O -3.183 -2.336 0.493 1.00 . A A . 17 LEU O 1 1 4 1413 1 1 18 ALA C C -5.303 -3.261 -1.257 1.00 . A A . 18 ALA C 1 1 4 1414 1 1 18 ALA CA C -3.874 -3.398 -1.803 1.00 . A A . 18 ALA CA 1 1 4 1415 1 1 18 ALA CB C -3.847 -4.086 -3.152 1.00 . A A . 18 ALA CB 1 1 4 1416 1 1 18 ALA H H -2.673 -4.973 -1.007 1.00 . A A . 18 ALA H 1 1 4 1417 1 1 18 ALA HA H -3.435 -2.412 -1.916 1.00 . A A . 18 ALA HA 1 1 4 1418 1 1 18 ALA HB1 H -4.617 -3.667 -3.782 1.00 . A A . 18 ALA HB1 1 1 4 1419 1 1 18 ALA HB2 H -4.010 -5.146 -3.027 1.00 . A A . 18 ALA HB2 1 1 4 1420 1 1 18 ALA HB3 H -2.882 -3.912 -3.608 1.00 . A A . 18 ALA HB3 1 1 4 1421 1 1 18 ALA N N -3.081 -4.093 -0.814 1.00 . A A . 18 ALA N 1 1 4 1422 1 1 18 ALA O O -6.083 -2.398 -1.691 1.00 . A A . 18 ALA O 1 1 4 1423 1 1 19 LYS C C -7.066 -2.796 1.219 1.00 . A A . 19 LYS C 1 1 4 1424 1 1 19 LYS CA C -6.843 -4.104 0.484 1.00 . A A . 19 LYS CA 1 1 4 1425 1 1 19 LYS CB C -6.800 -5.279 1.470 1.00 . A A . 19 LYS CB 1 1 4 1426 1 1 19 LYS CD C -6.516 -4.299 3.800 1.00 . A A . 19 LYS CD 1 1 4 1427 1 1 19 LYS CE C -7.820 -4.910 4.295 1.00 . A A . 19 LYS CE 1 1 4 1428 1 1 19 LYS CG C -5.880 -5.110 2.681 1.00 . A A . 19 LYS CG 1 1 4 1429 1 1 19 LYS H H -4.895 -4.729 0.072 1.00 . A A . 19 LYS H 1 1 4 1430 1 1 19 LYS HA H -7.639 -4.261 -0.225 1.00 . A A . 19 LYS HA 1 1 4 1431 1 1 19 LYS HB2 H -7.784 -5.461 1.827 1.00 . A A . 19 LYS HB2 1 1 4 1432 1 1 19 LYS HB3 H -6.456 -6.140 0.930 1.00 . A A . 19 LYS HB3 1 1 4 1433 1 1 19 LYS HD2 H -5.824 -4.240 4.627 1.00 . A A . 19 LYS HD2 1 1 4 1434 1 1 19 LYS HD3 H -6.712 -3.307 3.423 1.00 . A A . 19 LYS HD3 1 1 4 1435 1 1 19 LYS HE2 H -8.280 -4.228 4.996 1.00 . A A . 19 LYS HE2 1 1 4 1436 1 1 19 LYS HE3 H -8.477 -5.049 3.449 1.00 . A A . 19 LYS HE3 1 1 4 1437 1 1 19 LYS HG2 H -5.622 -6.086 3.063 1.00 . A A . 19 LYS HG2 1 1 4 1438 1 1 19 LYS HG3 H -4.983 -4.601 2.356 1.00 . A A . 19 LYS HG3 1 1 4 1439 1 1 19 LYS HZ1 H -7.251 -6.923 4.284 1.00 . A A . 19 LYS HZ1 1 1 4 1440 1 1 19 LYS HZ2 H -8.516 -6.568 5.359 1.00 . A A . 19 LYS HZ2 1 1 4 1441 1 1 19 LYS HZ3 H -6.929 -6.123 5.746 1.00 . A A . 19 LYS HZ3 1 1 4 1442 1 1 19 LYS N N -5.586 -4.088 -0.228 1.00 . A A . 19 LYS N 1 1 4 1443 1 1 19 LYS NZ N -7.614 -6.220 4.967 1.00 . A A . 19 LYS NZ 1 1 4 1444 1 1 19 LYS O O -8.191 -2.393 1.447 1.00 . A A . 19 LYS O 1 1 4 1445 1 1 20 VAL C C -5.670 0.198 1.329 1.00 . A A . 20 VAL C 1 1 4 1446 1 1 20 VAL CA C -5.973 -0.908 2.336 1.00 . A A . 20 VAL CA 1 1 4 1447 1 1 20 VAL CB C -4.908 -0.883 3.442 1.00 . A A . 20 VAL CB 1 1 4 1448 1 1 20 VAL CG1 C -3.537 -0.946 2.830 1.00 . A A . 20 VAL CG1 1 1 4 1449 1 1 20 VAL CG2 C -5.055 0.323 4.353 1.00 . A A . 20 VAL CG2 1 1 4 1450 1 1 20 VAL H H -5.116 -2.672 1.516 1.00 . A A . 20 VAL H 1 1 4 1451 1 1 20 VAL HA H -6.936 -0.752 2.781 1.00 . A A . 20 VAL HA 1 1 4 1452 1 1 20 VAL HB H -5.037 -1.765 4.032 1.00 . A A . 20 VAL HB 1 1 4 1453 1 1 20 VAL HG11 H -3.529 -0.340 1.923 1.00 . A A . 20 VAL HG11 1 1 4 1454 1 1 20 VAL HG12 H -3.312 -1.979 2.569 1.00 . A A . 20 VAL HG12 1 1 4 1455 1 1 20 VAL HG13 H -2.805 -0.576 3.526 1.00 . A A . 20 VAL HG13 1 1 4 1456 1 1 20 VAL HG21 H -6.027 0.303 4.821 1.00 . A A . 20 VAL HG21 1 1 4 1457 1 1 20 VAL HG22 H -4.954 1.228 3.772 1.00 . A A . 20 VAL HG22 1 1 4 1458 1 1 20 VAL HG23 H -4.289 0.297 5.114 1.00 . A A . 20 VAL HG23 1 1 4 1459 1 1 20 VAL N N -5.968 -2.206 1.653 1.00 . A A . 20 VAL N 1 1 4 1460 1 1 20 VAL O O -6.098 1.337 1.443 1.00 . A A . 20 VAL O 1 1 4 1461 1 1 21 LEU C C -5.499 1.540 -1.328 1.00 . A A . 21 LEU C 1 1 4 1462 1 1 21 LEU CA C -4.432 0.673 -0.702 1.00 . A A . 21 LEU CA 1 1 4 1463 1 1 21 LEU CB C -3.890 -0.233 -1.754 1.00 . A A . 21 LEU CB 1 1 4 1464 1 1 21 LEU CD1 C -2.413 1.264 -3.026 1.00 . A A . 21 LEU CD1 1 1 4 1465 1 1 21 LEU CD2 C -1.619 0.228 -0.899 1.00 . A A . 21 LEU CD2 1 1 4 1466 1 1 21 LEU CG C -2.470 0.031 -2.145 1.00 . A A . 21 LEU CG 1 1 4 1467 1 1 21 LEU H H -4.596 -1.125 0.360 1.00 . A A . 21 LEU H 1 1 4 1468 1 1 21 LEU HA H -3.635 1.288 -0.323 1.00 . A A . 21 LEU HA 1 1 4 1469 1 1 21 LEU HB2 H -3.961 -1.245 -1.375 1.00 . A A . 21 LEU HB2 1 1 4 1470 1 1 21 LEU HB3 H -4.513 -0.151 -2.630 1.00 . A A . 21 LEU HB3 1 1 4 1471 1 1 21 LEU HD11 H -2.914 2.081 -2.519 1.00 . A A . 21 LEU HD11 1 1 4 1472 1 1 21 LEU HD12 H -2.915 1.060 -3.960 1.00 . A A . 21 LEU HD12 1 1 4 1473 1 1 21 LEU HD13 H -1.387 1.531 -3.212 1.00 . A A . 21 LEU HD13 1 1 4 1474 1 1 21 LEU HD21 H -0.593 -0.026 -1.117 1.00 . A A . 21 LEU HD21 1 1 4 1475 1 1 21 LEU HD22 H -1.995 -0.403 -0.103 1.00 . A A . 21 LEU HD22 1 1 4 1476 1 1 21 LEU HD23 H -1.676 1.267 -0.591 1.00 . A A . 21 LEU HD23 1 1 4 1477 1 1 21 LEU HG H -2.106 -0.825 -2.690 1.00 . A A . 21 LEU HG 1 1 4 1478 1 1 21 LEU N N -4.906 -0.191 0.353 1.00 . A A . 21 LEU N 1 1 4 1479 1 1 21 LEU O O -5.497 2.754 -1.166 1.00 . A A . 21 LEU O 1 1 4 1480 1 1 22 ALA C C -8.385 2.386 -1.948 1.00 . A A . 22 ALA C 1 1 4 1481 1 1 22 ALA CA C -7.448 1.570 -2.823 1.00 . A A . 22 ALA CA 1 1 4 1482 1 1 22 ALA CB C -8.234 0.544 -3.601 1.00 . A A . 22 ALA CB 1 1 4 1483 1 1 22 ALA H H -6.409 -0.088 -1.974 1.00 . A A . 22 ALA H 1 1 4 1484 1 1 22 ALA HA H -6.957 2.219 -3.529 1.00 . A A . 22 ALA HA 1 1 4 1485 1 1 22 ALA HB1 H -7.558 -0.052 -4.192 1.00 . A A . 22 ALA HB1 1 1 4 1486 1 1 22 ALA HB2 H -8.934 1.048 -4.249 1.00 . A A . 22 ALA HB2 1 1 4 1487 1 1 22 ALA HB3 H -8.769 -0.090 -2.910 1.00 . A A . 22 ALA HB3 1 1 4 1488 1 1 22 ALA N N -6.419 0.891 -2.015 1.00 . A A . 22 ALA N 1 1 4 1489 1 1 22 ALA O O -9.257 3.118 -2.412 1.00 . A A . 22 ALA O 1 1 4 1490 1 1 23 GLU C C -8.529 4.033 0.913 1.00 . A A . 23 GLU C 1 1 4 1491 1 1 23 GLU CA C -9.008 2.703 0.370 1.00 . A A . 23 GLU CA 1 1 4 1492 1 1 23 GLU CB C -8.909 1.651 1.432 1.00 . A A . 23 GLU CB 1 1 4 1493 1 1 23 GLU CD C -10.280 -0.353 0.712 1.00 . A A . 23 GLU CD 1 1 4 1494 1 1 23 GLU CG C -8.902 0.275 0.807 1.00 . A A . 23 GLU CG 1 1 4 1495 1 1 23 GLU H H -7.333 1.758 -0.426 1.00 . A A . 23 GLU H 1 1 4 1496 1 1 23 GLU HA H -10.017 2.767 0.016 1.00 . A A . 23 GLU HA 1 1 4 1497 1 1 23 GLU HB2 H -7.969 1.791 1.961 1.00 . A A . 23 GLU HB2 1 1 4 1498 1 1 23 GLU HB3 H -9.735 1.731 2.119 1.00 . A A . 23 GLU HB3 1 1 4 1499 1 1 23 GLU HG2 H -8.511 0.376 -0.198 1.00 . A A . 23 GLU HG2 1 1 4 1500 1 1 23 GLU HG3 H -8.232 -0.358 1.361 1.00 . A A . 23 GLU HG3 1 1 4 1501 1 1 23 GLU N N -8.153 2.232 -0.681 1.00 . A A . 23 GLU N 1 1 4 1502 1 1 23 GLU O O -9.288 4.980 1.065 1.00 . A A . 23 GLU O 1 1 4 1503 1 1 23 GLU OE1 O -10.721 -0.978 1.704 1.00 . A A . 23 GLU OE1 1 1 4 1504 1 1 23 GLU OE2 O -10.929 -0.238 -0.344 1.00 . A A . 23 GLU OE2 1 1 4 1505 1 1 24 LYS C C -5.739 5.892 0.882 1.00 . A A . 24 LYS C 1 1 4 1506 1 1 24 LYS CA C -6.595 5.163 1.894 1.00 . A A . 24 LYS CA 1 1 4 1507 1 1 24 LYS CB C -5.693 4.632 2.989 1.00 . A A . 24 LYS CB 1 1 4 1508 1 1 24 LYS CD C -7.138 3.292 4.657 1.00 . A A . 24 LYS CD 1 1 4 1509 1 1 24 LYS CE C -8.386 4.102 4.339 1.00 . A A . 24 LYS CE 1 1 4 1510 1 1 24 LYS CG C -6.125 3.271 3.516 1.00 . A A . 24 LYS CG 1 1 4 1511 1 1 24 LYS H H -6.756 3.195 1.200 1.00 . A A . 24 LYS H 1 1 4 1512 1 1 24 LYS HA H -7.321 5.832 2.311 1.00 . A A . 24 LYS HA 1 1 4 1513 1 1 24 LYS HB2 H -4.691 4.537 2.593 1.00 . A A . 24 LYS HB2 1 1 4 1514 1 1 24 LYS HB3 H -5.676 5.322 3.785 1.00 . A A . 24 LYS HB3 1 1 4 1515 1 1 24 LYS HD2 H -7.432 2.266 4.853 1.00 . A A . 24 LYS HD2 1 1 4 1516 1 1 24 LYS HD3 H -6.663 3.706 5.538 1.00 . A A . 24 LYS HD3 1 1 4 1517 1 1 24 LYS HE2 H -8.534 4.088 3.270 1.00 . A A . 24 LYS HE2 1 1 4 1518 1 1 24 LYS HE3 H -9.230 3.640 4.828 1.00 . A A . 24 LYS HE3 1 1 4 1519 1 1 24 LYS HG2 H -6.563 2.721 2.688 1.00 . A A . 24 LYS HG2 1 1 4 1520 1 1 24 LYS HG3 H -5.246 2.745 3.851 1.00 . A A . 24 LYS HG3 1 1 4 1521 1 1 24 LYS HZ1 H -9.086 6.074 4.443 1.00 . A A . 24 LYS HZ1 1 1 4 1522 1 1 24 LYS HZ2 H -7.397 5.946 4.427 1.00 . A A . 24 LYS HZ2 1 1 4 1523 1 1 24 LYS HZ3 H -8.256 5.561 5.833 1.00 . A A . 24 LYS HZ3 1 1 4 1524 1 1 24 LYS N N -7.266 4.025 1.300 1.00 . A A . 24 LYS N 1 1 4 1525 1 1 24 LYS NZ N -8.273 5.517 4.789 1.00 . A A . 24 LYS NZ 1 1 4 1526 1 1 24 LYS O O -5.876 7.091 0.650 1.00 . A A . 24 LYS O 1 1 4 1527 1 1 25 TYR C C -4.205 5.910 -1.888 1.00 . A A . 25 TYR C 1 1 4 1528 1 1 25 TYR CA C -3.751 5.615 -0.479 1.00 . A A . 25 TYR CA 1 1 4 1529 1 1 25 TYR CB C -2.684 4.537 -0.555 1.00 . A A . 25 TYR CB 1 1 4 1530 1 1 25 TYR CD1 C -3.237 3.111 1.325 1.00 . A A . 25 TYR CD1 1 1 4 1531 1 1 25 TYR CD2 C -1.081 4.078 1.342 1.00 . A A . 25 TYR CD2 1 1 4 1532 1 1 25 TYR CE1 C -2.980 2.469 2.479 1.00 . A A . 25 TYR CE1 1 1 4 1533 1 1 25 TYR CE2 C -0.795 3.434 2.532 1.00 . A A . 25 TYR CE2 1 1 4 1534 1 1 25 TYR CG C -2.320 3.917 0.739 1.00 . A A . 25 TYR CG 1 1 4 1535 1 1 25 TYR CZ C -1.758 2.623 3.100 1.00 . A A . 25 TYR CZ 1 1 4 1536 1 1 25 TYR H H -4.934 4.150 0.402 1.00 . A A . 25 TYR H 1 1 4 1537 1 1 25 TYR HA H -3.363 6.488 0.005 1.00 . A A . 25 TYR HA 1 1 4 1538 1 1 25 TYR HB2 H -3.086 3.738 -1.143 1.00 . A A . 25 TYR HB2 1 1 4 1539 1 1 25 TYR HB3 H -1.804 4.919 -1.015 1.00 . A A . 25 TYR HB3 1 1 4 1540 1 1 25 TYR HD1 H -4.210 3.007 0.850 1.00 . A A . 25 TYR HD1 1 1 4 1541 1 1 25 TYR HD2 H -0.343 4.717 0.882 1.00 . A A . 25 TYR HD2 1 1 4 1542 1 1 25 TYR HE1 H -3.740 1.854 2.883 1.00 . A A . 25 TYR HE1 1 1 4 1543 1 1 25 TYR HE2 H 0.166 3.562 3.006 1.00 . A A . 25 TYR HE2 1 1 4 1544 1 1 25 TYR HH H -1.806 1.053 4.222 1.00 . A A . 25 TYR HH 1 1 4 1545 1 1 25 TYR N N -4.850 5.117 0.299 1.00 . A A . 25 TYR N 1 1 4 1546 1 1 25 TYR O O -4.083 7.026 -2.395 1.00 . A A . 25 TYR O 1 1 4 1547 1 1 25 TYR OH O -1.490 1.962 4.281 1.00 . A A . 25 TYR OH 1 1 4 1548 1 1 26 ALA C C -6.534 5.726 -3.878 1.00 . A A . 26 ALA C 1 1 4 1549 1 1 26 ALA CA C -5.234 4.944 -3.869 1.00 . A A . 26 ALA CA 1 1 4 1550 1 1 26 ALA CB C -5.449 3.547 -4.408 1.00 . A A . 26 ALA CB 1 1 4 1551 1 1 26 ALA H H -4.768 3.984 -2.033 1.00 . A A . 26 ALA H 1 1 4 1552 1 1 26 ALA HA H -4.504 5.446 -4.484 1.00 . A A . 26 ALA HA 1 1 4 1553 1 1 26 ALA HB1 H -6.156 3.028 -3.774 1.00 . A A . 26 ALA HB1 1 1 4 1554 1 1 26 ALA HB2 H -4.509 3.014 -4.405 1.00 . A A . 26 ALA HB2 1 1 4 1555 1 1 26 ALA HB3 H -5.834 3.600 -5.414 1.00 . A A . 26 ALA HB3 1 1 4 1556 1 1 26 ALA N N -4.723 4.861 -2.515 1.00 . A A . 26 ALA N 1 1 4 1557 1 1 26 ALA O O -7.005 6.175 -4.927 1.00 . A A . 26 ALA O 1 1 4 1558 1 1 27 ASN C C -8.105 8.072 -3.065 1.00 . A A . 27 ASN C 1 1 4 1559 1 1 27 ASN CA C -8.285 6.678 -2.467 1.00 . A A . 27 ASN CA 1 1 4 1560 1 1 27 ASN CB C -8.535 6.796 -0.974 1.00 . A A . 27 ASN CB 1 1 4 1561 1 1 27 ASN CG C -9.755 7.644 -0.646 1.00 . A A . 27 ASN CG 1 1 4 1562 1 1 27 ASN H H -6.726 5.359 -1.928 1.00 . A A . 27 ASN H 1 1 4 1563 1 1 27 ASN HA H -9.132 6.200 -2.933 1.00 . A A . 27 ASN HA 1 1 4 1564 1 1 27 ASN HB2 H -8.675 5.805 -0.562 1.00 . A A . 27 ASN HB2 1 1 4 1565 1 1 27 ASN HB3 H -7.668 7.243 -0.509 1.00 . A A . 27 ASN HB3 1 1 4 1566 1 1 27 ASN HD21 H -10.720 6.965 -2.252 1.00 . A A . 27 ASN HD21 1 1 4 1567 1 1 27 ASN HD22 H -11.583 8.115 -1.283 1.00 . A A . 27 ASN HD22 1 1 4 1568 1 1 27 ASN N N -7.109 5.852 -2.691 1.00 . A A . 27 ASN N 1 1 4 1569 1 1 27 ASN ND2 N -10.789 7.563 -1.474 1.00 . A A . 27 ASN ND2 1 1 4 1570 1 1 27 ASN O O -7.279 8.845 -2.533 1.00 . A A . 27 ASN O 1 1 4 1571 1 1 27 ASN OXT O -8.796 8.391 -4.053 1.00 . A A . 27 ASN OXT 1 1 4 1572 1 1 27 ASN OD1 O -9.778 8.352 0.360 1.00 . A A . 27 ASN OD1 1 1 5 1573 1 1 1 GLY C C 15.120 3.991 -0.173 1.00 . A A . 1 GLY C 1 1 5 1574 1 1 1 GLY CA C 15.258 3.798 -1.666 1.00 . A A . 1 GLY CA 1 1 5 1575 1 1 1 GLY H1 H 15.697 4.907 -3.377 1.00 . A A . 1 GLY H1 1 1 5 1576 1 1 1 GLY H2 H 16.514 5.431 -1.986 1.00 . A A . 1 GLY H2 1 1 5 1577 1 1 1 GLY H3 H 14.866 5.777 -2.181 1.00 . A A . 1 GLY H3 1 1 5 1578 1 1 1 GLY HA2 H 14.322 3.433 -2.060 1.00 . A A . 1 GLY HA2 1 1 5 1579 1 1 1 GLY HA3 H 16.030 3.067 -1.859 1.00 . A A . 1 GLY HA3 1 1 5 1580 1 1 1 GLY N N 15.608 5.064 -2.350 1.00 . A A . 1 GLY N 1 1 5 1581 1 1 1 GLY O O 16.104 4.257 0.516 1.00 . A A . 1 GLY O 1 1 5 1582 1 1 2 ILE C C 13.447 2.713 2.433 1.00 . A A . 2 ILE C 1 1 5 1583 1 1 2 ILE CA C 13.630 4.057 1.742 1.00 . A A . 2 ILE CA 1 1 5 1584 1 1 2 ILE CB C 12.362 4.905 1.962 1.00 . A A . 2 ILE CB 1 1 5 1585 1 1 2 ILE CD1 C 13.688 7.079 2.171 1.00 . A A . 2 ILE CD1 1 1 5 1586 1 1 2 ILE CG1 C 12.564 6.343 1.470 1.00 . A A . 2 ILE CG1 1 1 5 1587 1 1 2 ILE CG2 C 11.962 4.873 3.423 1.00 . A A . 2 ILE CG2 1 1 5 1588 1 1 2 ILE H H 13.149 3.634 -0.265 1.00 . A A . 2 ILE H 1 1 5 1589 1 1 2 ILE HA H 14.471 4.572 2.180 1.00 . A A . 2 ILE HA 1 1 5 1590 1 1 2 ILE HB H 11.561 4.451 1.395 1.00 . A A . 2 ILE HB 1 1 5 1591 1 1 2 ILE HD11 H 14.618 6.554 2.010 1.00 . A A . 2 ILE HD11 1 1 5 1592 1 1 2 ILE HD12 H 13.482 7.127 3.228 1.00 . A A . 2 ILE HD12 1 1 5 1593 1 1 2 ILE HD13 H 13.764 8.079 1.773 1.00 . A A . 2 ILE HD13 1 1 5 1594 1 1 2 ILE HG12 H 12.790 6.326 0.416 1.00 . A A . 2 ILE HG12 1 1 5 1595 1 1 2 ILE HG13 H 11.652 6.901 1.629 1.00 . A A . 2 ILE HG13 1 1 5 1596 1 1 2 ILE HG21 H 11.845 3.841 3.730 1.00 . A A . 2 ILE HG21 1 1 5 1597 1 1 2 ILE HG22 H 11.028 5.398 3.554 1.00 . A A . 2 ILE HG22 1 1 5 1598 1 1 2 ILE HG23 H 12.733 5.340 4.016 1.00 . A A . 2 ILE HG23 1 1 5 1599 1 1 2 ILE N N 13.897 3.868 0.331 1.00 . A A . 2 ILE N 1 1 5 1600 1 1 2 ILE O O 14.202 2.346 3.336 1.00 . A A . 2 ILE O 1 1 5 1601 1 1 3 GLY C C 10.837 0.674 3.323 1.00 . A A . 3 GLY C 1 1 5 1602 1 1 3 GLY CA C 12.145 0.691 2.558 1.00 . A A . 3 GLY CA 1 1 5 1603 1 1 3 GLY H H 11.897 2.320 1.243 1.00 . A A . 3 GLY H 1 1 5 1604 1 1 3 GLY HA2 H 12.085 -0.019 1.758 1.00 . A A . 3 GLY HA2 1 1 5 1605 1 1 3 GLY HA3 H 12.948 0.406 3.222 1.00 . A A . 3 GLY HA3 1 1 5 1606 1 1 3 GLY N N 12.439 1.982 1.986 1.00 . A A . 3 GLY N 1 1 5 1607 1 1 3 GLY O O 10.278 -0.388 3.584 1.00 . A A . 3 GLY O 1 1 5 1608 1 1 4 GLY C C 8.358 3.220 3.958 1.00 . A A . 4 GLY C 1 1 5 1609 1 1 4 GLY CA C 9.088 1.969 4.375 1.00 . A A . 4 GLY CA 1 1 5 1610 1 1 4 GLY H H 10.855 2.659 3.461 1.00 . A A . 4 GLY H 1 1 5 1611 1 1 4 GLY HA2 H 8.482 1.110 4.143 1.00 . A A . 4 GLY HA2 1 1 5 1612 1 1 4 GLY HA3 H 9.269 2.003 5.439 1.00 . A A . 4 GLY HA3 1 1 5 1613 1 1 4 GLY N N 10.352 1.853 3.676 1.00 . A A . 4 GLY N 1 1 5 1614 1 1 4 GLY O O 8.226 4.166 4.736 1.00 . A A . 4 GLY O 1 1 5 1615 1 1 5 VAL C C 6.115 4.106 1.242 1.00 . A A . 5 VAL C 1 1 5 1616 1 1 5 VAL CA C 7.318 4.427 2.137 1.00 . A A . 5 VAL CA 1 1 5 1617 1 1 5 VAL CB C 8.403 5.186 1.346 1.00 . A A . 5 VAL CB 1 1 5 1618 1 1 5 VAL CG1 C 9.254 4.222 0.529 1.00 . A A . 5 VAL CG1 1 1 5 1619 1 1 5 VAL CG2 C 7.784 6.236 0.447 1.00 . A A . 5 VAL CG2 1 1 5 1620 1 1 5 VAL H H 7.953 2.422 2.171 1.00 . A A . 5 VAL H 1 1 5 1621 1 1 5 VAL HA H 6.990 5.063 2.947 1.00 . A A . 5 VAL HA 1 1 5 1622 1 1 5 VAL HB H 9.046 5.681 2.052 1.00 . A A . 5 VAL HB 1 1 5 1623 1 1 5 VAL HG11 H 9.999 4.776 -0.021 1.00 . A A . 5 VAL HG11 1 1 5 1624 1 1 5 VAL HG12 H 8.623 3.681 -0.161 1.00 . A A . 5 VAL HG12 1 1 5 1625 1 1 5 VAL HG13 H 9.742 3.522 1.192 1.00 . A A . 5 VAL HG13 1 1 5 1626 1 1 5 VAL HG21 H 7.225 5.735 -0.338 1.00 . A A . 5 VAL HG21 1 1 5 1627 1 1 5 VAL HG22 H 8.565 6.840 0.008 1.00 . A A . 5 VAL HG22 1 1 5 1628 1 1 5 VAL HG23 H 7.118 6.863 1.021 1.00 . A A . 5 VAL HG23 1 1 5 1629 1 1 5 VAL N N 7.898 3.236 2.716 1.00 . A A . 5 VAL N 1 1 5 1630 1 1 5 VAL O O 5.004 4.558 1.506 1.00 . A A . 5 VAL O 1 1 5 1631 1 1 6 LEU C C 5.818 1.910 -1.696 1.00 . A A . 6 LEU C 1 1 5 1632 1 1 6 LEU CA C 5.303 2.992 -0.774 1.00 . A A . 6 LEU CA 1 1 5 1633 1 1 6 LEU CB C 4.867 4.252 -1.571 1.00 . A A . 6 LEU CB 1 1 5 1634 1 1 6 LEU CD1 C 7.235 4.766 -2.385 1.00 . A A . 6 LEU CD1 1 1 5 1635 1 1 6 LEU CD2 C 5.524 3.930 -4.012 1.00 . A A . 6 LEU CD2 1 1 5 1636 1 1 6 LEU CG C 5.757 4.745 -2.746 1.00 . A A . 6 LEU CG 1 1 5 1637 1 1 6 LEU H H 7.218 2.897 0.112 1.00 . A A . 6 LEU H 1 1 5 1638 1 1 6 LEU HA H 4.451 2.605 -0.233 1.00 . A A . 6 LEU HA 1 1 5 1639 1 1 6 LEU HB2 H 3.884 4.059 -1.971 1.00 . A A . 6 LEU HB2 1 1 5 1640 1 1 6 LEU HB3 H 4.784 5.061 -0.862 1.00 . A A . 6 LEU HB3 1 1 5 1641 1 1 6 LEU HD11 H 7.818 5.013 -3.259 1.00 . A A . 6 LEU HD11 1 1 5 1642 1 1 6 LEU HD12 H 7.529 3.791 -2.017 1.00 . A A . 6 LEU HD12 1 1 5 1643 1 1 6 LEU HD13 H 7.408 5.503 -1.617 1.00 . A A . 6 LEU HD13 1 1 5 1644 1 1 6 LEU HD21 H 6.154 4.308 -4.804 1.00 . A A . 6 LEU HD21 1 1 5 1645 1 1 6 LEU HD22 H 4.488 4.009 -4.307 1.00 . A A . 6 LEU HD22 1 1 5 1646 1 1 6 LEU HD23 H 5.767 2.896 -3.820 1.00 . A A . 6 LEU HD23 1 1 5 1647 1 1 6 LEU HG H 5.477 5.766 -2.969 1.00 . A A . 6 LEU HG 1 1 5 1648 1 1 6 LEU N N 6.339 3.307 0.207 1.00 . A A . 6 LEU N 1 1 5 1649 1 1 6 LEU O O 5.061 1.228 -2.378 1.00 . A A . 6 LEU O 1 1 5 1650 1 1 7 LEU C C 7.592 -0.589 -2.107 1.00 . A A . 7 LEU C 1 1 5 1651 1 1 7 LEU CA C 7.811 0.852 -2.561 1.00 . A A . 7 LEU CA 1 1 5 1652 1 1 7 LEU CB C 9.295 1.237 -2.618 1.00 . A A . 7 LEU CB 1 1 5 1653 1 1 7 LEU CD1 C 10.635 -0.826 -2.662 1.00 . A A . 7 LEU CD1 1 1 5 1654 1 1 7 LEU CD2 C 9.450 -0.098 -4.736 1.00 . A A . 7 LEU CD2 1 1 5 1655 1 1 7 LEU CG C 10.187 0.356 -3.480 1.00 . A A . 7 LEU CG 1 1 5 1656 1 1 7 LEU H H 7.652 2.296 -1.050 1.00 . A A . 7 LEU H 1 1 5 1657 1 1 7 LEU HA H 7.390 0.966 -3.548 1.00 . A A . 7 LEU HA 1 1 5 1658 1 1 7 LEU HB2 H 9.366 2.251 -2.983 1.00 . A A . 7 LEU HB2 1 1 5 1659 1 1 7 LEU HB3 H 9.683 1.211 -1.609 1.00 . A A . 7 LEU HB3 1 1 5 1660 1 1 7 LEU HD11 H 11.033 -0.467 -1.724 1.00 . A A . 7 LEU HD11 1 1 5 1661 1 1 7 LEU HD12 H 11.391 -1.379 -3.197 1.00 . A A . 7 LEU HD12 1 1 5 1662 1 1 7 LEU HD13 H 9.784 -1.459 -2.468 1.00 . A A . 7 LEU HD13 1 1 5 1663 1 1 7 LEU HD21 H 8.511 -0.561 -4.451 1.00 . A A . 7 LEU HD21 1 1 5 1664 1 1 7 LEU HD22 H 10.057 -0.815 -5.272 1.00 . A A . 7 LEU HD22 1 1 5 1665 1 1 7 LEU HD23 H 9.254 0.753 -5.367 1.00 . A A . 7 LEU HD23 1 1 5 1666 1 1 7 LEU HG H 11.062 0.916 -3.778 1.00 . A A . 7 LEU HG 1 1 5 1667 1 1 7 LEU N N 7.127 1.762 -1.679 1.00 . A A . 7 LEU N 1 1 5 1668 1 1 7 LEU O O 7.043 -1.400 -2.847 1.00 . A A . 7 LEU O 1 1 5 1669 1 1 8 SER C C 6.485 -2.350 0.327 1.00 . A A . 8 SER C 1 1 5 1670 1 1 8 SER CA C 7.806 -2.267 -0.389 1.00 . A A . 8 SER CA 1 1 5 1671 1 1 8 SER CB C 8.956 -2.676 0.519 1.00 . A A . 8 SER CB 1 1 5 1672 1 1 8 SER H H 8.316 -0.205 -0.278 1.00 . A A . 8 SER H 1 1 5 1673 1 1 8 SER HA H 7.768 -2.922 -1.247 1.00 . A A . 8 SER HA 1 1 5 1674 1 1 8 SER HB2 H 8.728 -3.635 0.961 1.00 . A A . 8 SER HB2 1 1 5 1675 1 1 8 SER HB3 H 9.863 -2.750 -0.061 1.00 . A A . 8 SER HB3 1 1 5 1676 1 1 8 SER HG H 9.700 -2.093 2.238 1.00 . A A . 8 SER HG 1 1 5 1677 1 1 8 SER N N 7.970 -0.904 -0.879 1.00 . A A . 8 SER N 1 1 5 1678 1 1 8 SER O O 5.939 -3.425 0.577 1.00 . A A . 8 SER O 1 1 5 1679 1 1 8 SER OG O 9.142 -1.718 1.546 1.00 . A A . 8 SER OG 1 1 5 1680 1 1 9 ALA C C 3.782 -1.460 -0.231 1.00 . A A . 9 ALA C 1 1 5 1681 1 1 9 ALA CA C 4.604 -0.979 0.955 1.00 . A A . 9 ALA CA 1 1 5 1682 1 1 9 ALA CB C 4.380 0.496 1.222 1.00 . A A . 9 ALA CB 1 1 5 1683 1 1 9 ALA H H 6.598 -0.405 0.683 1.00 . A A . 9 ALA H 1 1 5 1684 1 1 9 ALA HA H 4.354 -1.546 1.841 1.00 . A A . 9 ALA HA 1 1 5 1685 1 1 9 ALA HB1 H 4.683 0.728 2.232 1.00 . A A . 9 ALA HB1 1 1 5 1686 1 1 9 ALA HB2 H 3.338 0.741 1.084 1.00 . A A . 9 ALA HB2 1 1 5 1687 1 1 9 ALA HB3 H 4.990 1.071 0.527 1.00 . A A . 9 ALA HB3 1 1 5 1688 1 1 9 ALA N N 5.990 -1.175 0.643 1.00 . A A . 9 ALA N 1 1 5 1689 1 1 9 ALA O O 2.690 -1.997 -0.072 1.00 . A A . 9 ALA O 1 1 5 1690 1 1 10 GLY C C 3.960 -3.279 -2.782 1.00 . A A . 10 GLY C 1 1 5 1691 1 1 10 GLY CA C 3.721 -1.802 -2.626 1.00 . A A . 10 GLY CA 1 1 5 1692 1 1 10 GLY H H 5.226 -0.838 -1.496 1.00 . A A . 10 GLY H 1 1 5 1693 1 1 10 GLY HA2 H 2.667 -1.628 -2.559 1.00 . A A . 10 GLY HA2 1 1 5 1694 1 1 10 GLY HA3 H 4.115 -1.289 -3.489 1.00 . A A . 10 GLY HA3 1 1 5 1695 1 1 10 GLY N N 4.355 -1.299 -1.430 1.00 . A A . 10 GLY N 1 1 5 1696 1 1 10 GLY O O 3.068 -4.021 -3.181 1.00 . A A . 10 GLY O 1 1 5 1697 1 1 11 LYS C C 4.580 -5.892 -1.545 1.00 . A A . 11 LYS C 1 1 5 1698 1 1 11 LYS CA C 5.543 -5.096 -2.415 1.00 . A A . 11 LYS CA 1 1 5 1699 1 1 11 LYS CB C 6.971 -5.233 -1.892 1.00 . A A . 11 LYS CB 1 1 5 1700 1 1 11 LYS CD C 8.428 -4.232 -3.718 1.00 . A A . 11 LYS CD 1 1 5 1701 1 1 11 LYS CE C 7.359 -3.784 -4.699 1.00 . A A . 11 LYS CE 1 1 5 1702 1 1 11 LYS CG C 8.025 -5.489 -2.957 1.00 . A A . 11 LYS CG 1 1 5 1703 1 1 11 LYS H H 5.862 -3.024 -2.248 1.00 . A A . 11 LYS H 1 1 5 1704 1 1 11 LYS HA H 5.498 -5.481 -3.420 1.00 . A A . 11 LYS HA 1 1 5 1705 1 1 11 LYS HB2 H 7.225 -4.309 -1.388 1.00 . A A . 11 LYS HB2 1 1 5 1706 1 1 11 LYS HB3 H 7.006 -6.044 -1.184 1.00 . A A . 11 LYS HB3 1 1 5 1707 1 1 11 LYS HD2 H 8.600 -3.437 -3.009 1.00 . A A . 11 LYS HD2 1 1 5 1708 1 1 11 LYS HD3 H 9.340 -4.431 -4.263 1.00 . A A . 11 LYS HD3 1 1 5 1709 1 1 11 LYS HE2 H 6.419 -3.721 -4.170 1.00 . A A . 11 LYS HE2 1 1 5 1710 1 1 11 LYS HE3 H 7.625 -2.809 -5.080 1.00 . A A . 11 LYS HE3 1 1 5 1711 1 1 11 LYS HG2 H 8.903 -5.904 -2.485 1.00 . A A . 11 LYS HG2 1 1 5 1712 1 1 11 LYS HG3 H 7.623 -6.204 -3.652 1.00 . A A . 11 LYS HG3 1 1 5 1713 1 1 11 LYS HZ1 H 7.044 -5.695 -5.496 1.00 . A A . 11 LYS HZ1 1 1 5 1714 1 1 11 LYS HZ2 H 8.071 -4.716 -6.428 1.00 . A A . 11 LYS HZ2 1 1 5 1715 1 1 11 LYS HZ3 H 6.398 -4.436 -6.433 1.00 . A A . 11 LYS HZ3 1 1 5 1716 1 1 11 LYS N N 5.175 -3.692 -2.453 1.00 . A A . 11 LYS N 1 1 5 1717 1 1 11 LYS NZ N 7.206 -4.724 -5.840 1.00 . A A . 11 LYS NZ 1 1 5 1718 1 1 11 LYS O O 4.231 -7.028 -1.862 1.00 . A A . 11 LYS O 1 1 5 1719 1 1 12 ALA C C 1.766 -5.793 -0.172 1.00 . A A . 12 ALA C 1 1 5 1720 1 1 12 ALA CA C 3.170 -5.921 0.413 1.00 . A A . 12 ALA CA 1 1 5 1721 1 1 12 ALA CB C 3.236 -5.303 1.799 1.00 . A A . 12 ALA CB 1 1 5 1722 1 1 12 ALA H H 4.498 -4.404 -0.217 1.00 . A A . 12 ALA H 1 1 5 1723 1 1 12 ALA HA H 3.424 -6.969 0.493 1.00 . A A . 12 ALA HA 1 1 5 1724 1 1 12 ALA HB1 H 4.245 -5.378 2.176 1.00 . A A . 12 ALA HB1 1 1 5 1725 1 1 12 ALA HB2 H 2.563 -5.828 2.460 1.00 . A A . 12 ALA HB2 1 1 5 1726 1 1 12 ALA HB3 H 2.949 -4.263 1.743 1.00 . A A . 12 ALA HB3 1 1 5 1727 1 1 12 ALA N N 4.144 -5.292 -0.455 1.00 . A A . 12 ALA N 1 1 5 1728 1 1 12 ALA O O 0.911 -6.659 0.027 1.00 . A A . 12 ALA O 1 1 5 1729 1 1 13 ALA C C -0.132 -5.420 -2.583 1.00 . A A . 13 ALA C 1 1 5 1730 1 1 13 ALA CA C 0.229 -4.436 -1.479 1.00 . A A . 13 ALA CA 1 1 5 1731 1 1 13 ALA CB C 0.126 -3.002 -1.981 1.00 . A A . 13 ALA CB 1 1 5 1732 1 1 13 ALA H H 2.277 -4.097 -1.086 1.00 . A A . 13 ALA H 1 1 5 1733 1 1 13 ALA HA H -0.489 -4.552 -0.679 1.00 . A A . 13 ALA HA 1 1 5 1734 1 1 13 ALA HB1 H -0.918 -2.759 -2.167 1.00 . A A . 13 ALA HB1 1 1 5 1735 1 1 13 ALA HB2 H 0.687 -2.901 -2.898 1.00 . A A . 13 ALA HB2 1 1 5 1736 1 1 13 ALA HB3 H 0.525 -2.328 -1.237 1.00 . A A . 13 ALA HB3 1 1 5 1737 1 1 13 ALA N N 1.541 -4.716 -0.916 1.00 . A A . 13 ALA N 1 1 5 1738 1 1 13 ALA O O -1.307 -5.723 -2.766 1.00 . A A . 13 ALA O 1 1 5 1739 1 1 14 LEU C C -0.132 -8.110 -3.654 1.00 . A A . 14 LEU C 1 1 5 1740 1 1 14 LEU CA C 0.600 -6.961 -4.318 1.00 . A A . 14 LEU CA 1 1 5 1741 1 1 14 LEU CB C 1.878 -7.545 -4.949 1.00 . A A . 14 LEU CB 1 1 5 1742 1 1 14 LEU CD1 C 2.047 -5.362 -6.211 1.00 . A A . 14 LEU CD1 1 1 5 1743 1 1 14 LEU CD2 C 4.011 -6.253 -4.926 1.00 . A A . 14 LEU CD2 1 1 5 1744 1 1 14 LEU CG C 2.785 -6.605 -5.744 1.00 . A A . 14 LEU CG 1 1 5 1745 1 1 14 LEU H H 1.782 -5.593 -3.187 1.00 . A A . 14 LEU H 1 1 5 1746 1 1 14 LEU HA H -0.025 -6.539 -5.089 1.00 . A A . 14 LEU HA 1 1 5 1747 1 1 14 LEU HB2 H 2.471 -7.971 -4.154 1.00 . A A . 14 LEU HB2 1 1 5 1748 1 1 14 LEU HB3 H 1.579 -8.349 -5.607 1.00 . A A . 14 LEU HB3 1 1 5 1749 1 1 14 LEU HD11 H 2.716 -4.742 -6.789 1.00 . A A . 14 LEU HD11 1 1 5 1750 1 1 14 LEU HD12 H 1.695 -4.811 -5.350 1.00 . A A . 14 LEU HD12 1 1 5 1751 1 1 14 LEU HD13 H 1.205 -5.652 -6.823 1.00 . A A . 14 LEU HD13 1 1 5 1752 1 1 14 LEU HD21 H 3.711 -5.717 -4.036 1.00 . A A . 14 LEU HD21 1 1 5 1753 1 1 14 LEU HD22 H 4.677 -5.638 -5.511 1.00 . A A . 14 LEU HD22 1 1 5 1754 1 1 14 LEU HD23 H 4.520 -7.163 -4.635 1.00 . A A . 14 LEU HD23 1 1 5 1755 1 1 14 LEU HG H 3.125 -7.126 -6.628 1.00 . A A . 14 LEU HG 1 1 5 1756 1 1 14 LEU N N 0.866 -5.926 -3.317 1.00 . A A . 14 LEU N 1 1 5 1757 1 1 14 LEU O O -1.007 -8.747 -4.244 1.00 . A A . 14 LEU O 1 1 5 1758 1 1 15 LYS C C -1.510 -9.138 -0.896 1.00 . A A . 15 LYS C 1 1 5 1759 1 1 15 LYS CA C -0.262 -9.498 -1.695 1.00 . A A . 15 LYS CA 1 1 5 1760 1 1 15 LYS CB C 0.836 -9.982 -0.761 1.00 . A A . 15 LYS CB 1 1 5 1761 1 1 15 LYS CD C 2.149 -11.079 -2.578 1.00 . A A . 15 LYS CD 1 1 5 1762 1 1 15 LYS CE C 3.437 -11.048 -3.377 1.00 . A A . 15 LYS CE 1 1 5 1763 1 1 15 LYS CG C 2.177 -10.067 -1.453 1.00 . A A . 15 LYS CG 1 1 5 1764 1 1 15 LYS H H 0.864 -7.757 -1.958 1.00 . A A . 15 LYS H 1 1 5 1765 1 1 15 LYS HA H -0.478 -10.268 -2.409 1.00 . A A . 15 LYS HA 1 1 5 1766 1 1 15 LYS HB2 H 0.921 -9.284 0.055 1.00 . A A . 15 LYS HB2 1 1 5 1767 1 1 15 LYS HB3 H 0.577 -10.957 -0.380 1.00 . A A . 15 LYS HB3 1 1 5 1768 1 1 15 LYS HD2 H 2.012 -12.067 -2.164 1.00 . A A . 15 LYS HD2 1 1 5 1769 1 1 15 LYS HD3 H 1.326 -10.838 -3.231 1.00 . A A . 15 LYS HD3 1 1 5 1770 1 1 15 LYS HE2 H 3.523 -10.078 -3.840 1.00 . A A . 15 LYS HE2 1 1 5 1771 1 1 15 LYS HE3 H 4.268 -11.204 -2.707 1.00 . A A . 15 LYS HE3 1 1 5 1772 1 1 15 LYS HG2 H 2.405 -9.095 -1.869 1.00 . A A . 15 LYS HG2 1 1 5 1773 1 1 15 LYS HG3 H 2.932 -10.351 -0.734 1.00 . A A . 15 LYS HG3 1 1 5 1774 1 1 15 LYS HZ1 H 2.695 -11.917 -5.124 1.00 . A A . 15 LYS HZ1 1 1 5 1775 1 1 15 LYS HZ2 H 3.323 -13.033 -4.011 1.00 . A A . 15 LYS HZ2 1 1 5 1776 1 1 15 LYS HZ3 H 4.374 -12.077 -4.932 1.00 . A A . 15 LYS HZ3 1 1 5 1777 1 1 15 LYS N N 0.235 -8.360 -2.407 1.00 . A A . 15 LYS N 1 1 5 1778 1 1 15 LYS NZ N 3.459 -12.090 -4.434 1.00 . A A . 15 LYS NZ 1 1 5 1779 1 1 15 LYS O O -2.621 -9.556 -1.225 1.00 . A A . 15 LYS O 1 1 5 1780 1 1 16 GLY C C -2.766 -6.531 0.829 1.00 . A A . 16 GLY C 1 1 5 1781 1 1 16 GLY CA C -2.386 -7.961 1.019 1.00 . A A . 16 GLY CA 1 1 5 1782 1 1 16 GLY H H -0.428 -7.953 0.291 1.00 . A A . 16 GLY H 1 1 5 1783 1 1 16 GLY HA2 H -3.241 -8.583 0.818 1.00 . A A . 16 GLY HA2 1 1 5 1784 1 1 16 GLY HA3 H -2.085 -8.094 2.042 1.00 . A A . 16 GLY HA3 1 1 5 1785 1 1 16 GLY N N -1.310 -8.351 0.153 1.00 . A A . 16 GLY N 1 1 5 1786 1 1 16 GLY O O -3.862 -6.211 0.397 1.00 . A A . 16 GLY O 1 1 5 1787 1 1 17 LEU C C -2.582 -3.477 0.290 1.00 . A A . 17 LEU C 1 1 5 1788 1 1 17 LEU CA C -1.973 -4.286 1.422 1.00 . A A . 17 LEU CA 1 1 5 1789 1 1 17 LEU CB C -0.665 -3.646 1.889 1.00 . A A . 17 LEU CB 1 1 5 1790 1 1 17 LEU CD1 C -1.357 -3.621 4.306 1.00 . A A . 17 LEU CD1 1 1 5 1791 1 1 17 LEU CD2 C 0.123 -5.451 3.473 1.00 . A A . 17 LEU CD2 1 1 5 1792 1 1 17 LEU CG C -0.247 -3.982 3.331 1.00 . A A . 17 LEU CG 1 1 5 1793 1 1 17 LEU H H -0.877 -6.035 1.163 1.00 . A A . 17 LEU H 1 1 5 1794 1 1 17 LEU HA H -2.654 -4.253 2.244 1.00 . A A . 17 LEU HA 1 1 5 1795 1 1 17 LEU HB2 H 0.124 -3.966 1.219 1.00 . A A . 17 LEU HB2 1 1 5 1796 1 1 17 LEU HB3 H -0.776 -2.573 1.813 1.00 . A A . 17 LEU HB3 1 1 5 1797 1 1 17 LEU HD11 H -2.257 -4.153 4.037 1.00 . A A . 17 LEU HD11 1 1 5 1798 1 1 17 LEU HD12 H -1.545 -2.557 4.264 1.00 . A A . 17 LEU HD12 1 1 5 1799 1 1 17 LEU HD13 H -1.062 -3.896 5.308 1.00 . A A . 17 LEU HD13 1 1 5 1800 1 1 17 LEU HD21 H 0.409 -5.652 4.494 1.00 . A A . 17 LEU HD21 1 1 5 1801 1 1 17 LEU HD22 H 0.949 -5.681 2.817 1.00 . A A . 17 LEU HD22 1 1 5 1802 1 1 17 LEU HD23 H -0.727 -6.063 3.209 1.00 . A A . 17 LEU HD23 1 1 5 1803 1 1 17 LEU HG H 0.623 -3.393 3.590 1.00 . A A . 17 LEU HG 1 1 5 1804 1 1 17 LEU N N -1.784 -5.687 1.128 1.00 . A A . 17 LEU N 1 1 5 1805 1 1 17 LEU O O -2.819 -2.296 0.450 1.00 . A A . 17 LEU O 1 1 5 1806 1 1 18 ALA C C -5.068 -3.184 -1.217 1.00 . A A . 18 ALA C 1 1 5 1807 1 1 18 ALA CA C -3.661 -3.340 -1.814 1.00 . A A . 18 ALA CA 1 1 5 1808 1 1 18 ALA CB C -3.693 -4.008 -3.174 1.00 . A A . 18 ALA CB 1 1 5 1809 1 1 18 ALA H H -2.492 -4.961 -1.060 1.00 . A A . 18 ALA H 1 1 5 1810 1 1 18 ALA HA H -3.211 -2.362 -1.930 1.00 . A A . 18 ALA HA 1 1 5 1811 1 1 18 ALA HB1 H -2.726 -3.896 -3.643 1.00 . A A . 18 ALA HB1 1 1 5 1812 1 1 18 ALA HB2 H -4.444 -3.536 -3.786 1.00 . A A . 18 ALA HB2 1 1 5 1813 1 1 18 ALA HB3 H -3.922 -5.055 -3.059 1.00 . A A . 18 ALA HB3 1 1 5 1814 1 1 18 ALA N N -2.842 -4.061 -0.857 1.00 . A A . 18 ALA N 1 1 5 1815 1 1 18 ALA O O -5.845 -2.292 -1.597 1.00 . A A . 18 ALA O 1 1 5 1816 1 1 19 LYS C C -6.763 -2.748 1.293 1.00 . A A . 19 LYS C 1 1 5 1817 1 1 19 LYS CA C -6.566 -4.047 0.546 1.00 . A A . 19 LYS CA 1 1 5 1818 1 1 19 LYS CB C -6.495 -5.212 1.538 1.00 . A A . 19 LYS CB 1 1 5 1819 1 1 19 LYS CD C -5.964 -4.250 3.835 1.00 . A A . 19 LYS CD 1 1 5 1820 1 1 19 LYS CE C -7.182 -4.874 4.490 1.00 . A A . 19 LYS CE 1 1 5 1821 1 1 19 LYS CG C -5.458 -5.067 2.658 1.00 . A A . 19 LYS CG 1 1 5 1822 1 1 19 LYS H H -4.645 -4.694 0.053 1.00 . A A . 19 LYS H 1 1 5 1823 1 1 19 LYS HA H -7.388 -4.207 -0.134 1.00 . A A . 19 LYS HA 1 1 5 1824 1 1 19 LYS HB2 H -7.448 -5.341 1.985 1.00 . A A . 19 LYS HB2 1 1 5 1825 1 1 19 LYS HB3 H -6.243 -6.094 0.986 1.00 . A A . 19 LYS HB3 1 1 5 1826 1 1 19 LYS HD2 H -5.177 -4.172 4.568 1.00 . A A . 19 LYS HD2 1 1 5 1827 1 1 19 LYS HD3 H -6.220 -3.265 3.476 1.00 . A A . 19 LYS HD3 1 1 5 1828 1 1 19 LYS HE2 H -7.959 -4.983 3.747 1.00 . A A . 19 LYS HE2 1 1 5 1829 1 1 19 LYS HE3 H -6.912 -5.847 4.872 1.00 . A A . 19 LYS HE3 1 1 5 1830 1 1 19 LYS HG2 H -5.186 -6.049 3.009 1.00 . A A . 19 LYS HG2 1 1 5 1831 1 1 19 LYS HG3 H -4.588 -4.575 2.249 1.00 . A A . 19 LYS HG3 1 1 5 1832 1 1 19 LYS HZ1 H -6.940 -3.878 6.311 1.00 . A A . 19 LYS HZ1 1 1 5 1833 1 1 19 LYS HZ2 H -8.498 -4.509 6.071 1.00 . A A . 19 LYS HZ2 1 1 5 1834 1 1 19 LYS HZ3 H -8.011 -3.112 5.240 1.00 . A A . 19 LYS HZ3 1 1 5 1835 1 1 19 LYS N N -5.332 -4.033 -0.206 1.00 . A A . 19 LYS N 1 1 5 1836 1 1 19 LYS NZ N -7.694 -4.037 5.606 1.00 . A A . 19 LYS NZ 1 1 5 1837 1 1 19 LYS O O -7.879 -2.357 1.581 1.00 . A A . 19 LYS O 1 1 5 1838 1 1 20 VAL C C -5.334 0.238 1.400 1.00 . A A . 20 VAL C 1 1 5 1839 1 1 20 VAL CA C -5.618 -0.887 2.389 1.00 . A A . 20 VAL CA 1 1 5 1840 1 1 20 VAL CB C -4.514 -0.908 3.456 1.00 . A A . 20 VAL CB 1 1 5 1841 1 1 20 VAL CG1 C -3.157 -0.933 2.799 1.00 . A A . 20 VAL CG1 1 1 5 1842 1 1 20 VAL CG2 C -4.642 0.246 4.430 1.00 . A A . 20 VAL CG2 1 1 5 1843 1 1 20 VAL H H -4.803 -2.635 1.505 1.00 . A A . 20 VAL H 1 1 5 1844 1 1 20 VAL HA H -6.571 -0.724 2.870 1.00 . A A . 20 VAL HA 1 1 5 1845 1 1 20 VAL HB H -4.614 -1.819 4.000 1.00 . A A . 20 VAL HB 1 1 5 1846 1 1 20 VAL HG11 H -2.409 -0.573 3.482 1.00 . A A . 20 VAL HG11 1 1 5 1847 1 1 20 VAL HG12 H -3.184 -0.310 1.901 1.00 . A A . 20 VAL HG12 1 1 5 1848 1 1 20 VAL HG13 H -2.929 -1.958 2.507 1.00 . A A . 20 VAL HG13 1 1 5 1849 1 1 20 VAL HG21 H -3.844 0.195 5.156 1.00 . A A . 20 VAL HG21 1 1 5 1850 1 1 20 VAL HG22 H -5.594 0.185 4.935 1.00 . A A . 20 VAL HG22 1 1 5 1851 1 1 20 VAL HG23 H -4.580 1.178 3.889 1.00 . A A . 20 VAL HG23 1 1 5 1852 1 1 20 VAL N N -5.649 -2.166 1.686 1.00 . A A . 20 VAL N 1 1 5 1853 1 1 20 VAL O O -5.720 1.386 1.568 1.00 . A A . 20 VAL O 1 1 5 1854 1 1 21 LEU C C -5.282 1.630 -1.228 1.00 . A A . 21 LEU C 1 1 5 1855 1 1 21 LEU CA C -4.192 0.744 -0.671 1.00 . A A . 21 LEU CA 1 1 5 1856 1 1 21 LEU CB C -3.708 -0.139 -1.764 1.00 . A A . 21 LEU CB 1 1 5 1857 1 1 21 LEU CD1 C -2.275 1.348 -3.094 1.00 . A A . 21 LEU CD1 1 1 5 1858 1 1 21 LEU CD2 C -1.398 0.300 -1.006 1.00 . A A . 21 LEU CD2 1 1 5 1859 1 1 21 LEU CG C -2.307 0.114 -2.213 1.00 . A A . 21 LEU CG 1 1 5 1860 1 1 21 LEU H H -4.336 -1.076 0.351 1.00 . A A . 21 LEU H 1 1 5 1861 1 1 21 LEU HA H -3.376 1.346 -0.311 1.00 . A A . 21 LEU HA 1 1 5 1862 1 1 21 LEU HB2 H -3.771 -1.159 -1.410 1.00 . A A . 21 LEU HB2 1 1 5 1863 1 1 21 LEU HB3 H -4.369 -0.025 -2.612 1.00 . A A . 21 LEU HB3 1 1 5 1864 1 1 21 LEU HD11 H -1.254 1.592 -3.337 1.00 . A A . 21 LEU HD11 1 1 5 1865 1 1 21 LEU HD12 H -2.733 2.174 -2.563 1.00 . A A . 21 LEU HD12 1 1 5 1866 1 1 21 LEU HD13 H -2.828 1.156 -4.000 1.00 . A A . 21 LEU HD13 1 1 5 1867 1 1 21 LEU HD21 H -1.744 -0.334 -0.194 1.00 . A A . 21 LEU HD21 1 1 5 1868 1 1 21 LEU HD22 H -1.422 1.338 -0.693 1.00 . A A . 21 LEU HD22 1 1 5 1869 1 1 21 LEU HD23 H -0.388 0.028 -1.272 1.00 . A A . 21 LEU HD23 1 1 5 1870 1 1 21 LEU HG H -1.984 -0.747 -2.768 1.00 . A A . 21 LEU HG 1 1 5 1871 1 1 21 LEU N N -4.627 -0.138 0.381 1.00 . A A . 21 LEU N 1 1 5 1872 1 1 21 LEU O O -5.263 2.843 -1.044 1.00 . A A . 21 LEU O 1 1 5 1873 1 1 22 ALA C C -8.197 2.482 -1.671 1.00 . A A . 22 ALA C 1 1 5 1874 1 1 22 ALA CA C -7.310 1.688 -2.615 1.00 . A A . 22 ALA CA 1 1 5 1875 1 1 22 ALA CB C -8.137 0.678 -3.372 1.00 . A A . 22 ALA CB 1 1 5 1876 1 1 22 ALA H H -6.222 0.014 -1.865 1.00 . A A . 22 ALA H 1 1 5 1877 1 1 22 ALA HA H -6.859 2.354 -3.332 1.00 . A A . 22 ALA HA 1 1 5 1878 1 1 22 ALA HB1 H -8.886 1.193 -3.951 1.00 . A A . 22 ALA HB1 1 1 5 1879 1 1 22 ALA HB2 H -8.614 0.017 -2.664 1.00 . A A . 22 ALA HB2 1 1 5 1880 1 1 22 ALA HB3 H -7.498 0.109 -4.027 1.00 . A A . 22 ALA HB3 1 1 5 1881 1 1 22 ALA N N -6.237 0.995 -1.880 1.00 . A A . 22 ALA N 1 1 5 1882 1 1 22 ALA O O -9.090 3.222 -2.072 1.00 . A A . 22 ALA O 1 1 5 1883 1 1 23 GLU C C -8.198 4.087 1.213 1.00 . A A . 23 GLU C 1 1 5 1884 1 1 23 GLU CA C -8.699 2.763 0.681 1.00 . A A . 23 GLU CA 1 1 5 1885 1 1 23 GLU CB C -8.527 1.711 1.731 1.00 . A A . 23 GLU CB 1 1 5 1886 1 1 23 GLU CD C -9.884 -0.352 1.262 1.00 . A A . 23 GLU CD 1 1 5 1887 1 1 23 GLU CG C -8.544 0.336 1.116 1.00 . A A . 23 GLU CG 1 1 5 1888 1 1 23 GLU H H -7.081 1.806 -0.213 1.00 . A A . 23 GLU H 1 1 5 1889 1 1 23 GLU HA H -9.727 2.819 0.389 1.00 . A A . 23 GLU HA 1 1 5 1890 1 1 23 GLU HB2 H -7.560 1.860 2.205 1.00 . A A . 23 GLU HB2 1 1 5 1891 1 1 23 GLU HB3 H -9.312 1.784 2.464 1.00 . A A . 23 GLU HB3 1 1 5 1892 1 1 23 GLU HG2 H -8.315 0.438 0.058 1.00 . A A . 23 GLU HG2 1 1 5 1893 1 1 23 GLU HG3 H -7.763 -0.257 1.573 1.00 . A A . 23 GLU HG3 1 1 5 1894 1 1 23 GLU N N -7.902 2.302 -0.419 1.00 . A A . 23 GLU N 1 1 5 1895 1 1 23 GLU O O -8.954 5.026 1.433 1.00 . A A . 23 GLU O 1 1 5 1896 1 1 23 GLU OE1 O -10.206 -0.809 2.380 1.00 . A A . 23 GLU OE1 1 1 5 1897 1 1 23 GLU OE2 O -10.624 -0.442 0.261 1.00 . A A . 23 GLU OE2 1 1 5 1898 1 1 24 LYS C C -5.434 5.964 1.034 1.00 . A A . 24 LYS C 1 1 5 1899 1 1 24 LYS CA C -6.225 5.220 2.090 1.00 . A A . 24 LYS CA 1 1 5 1900 1 1 24 LYS CB C -5.254 4.682 3.120 1.00 . A A . 24 LYS CB 1 1 5 1901 1 1 24 LYS CD C -6.542 3.289 4.855 1.00 . A A . 24 LYS CD 1 1 5 1902 1 1 24 LYS CE C -7.889 3.917 4.568 1.00 . A A . 24 LYS CE 1 1 5 1903 1 1 24 LYS CG C -5.621 3.299 3.646 1.00 . A A . 24 LYS CG 1 1 5 1904 1 1 24 LYS H H -6.409 3.261 1.384 1.00 . A A . 24 LYS H 1 1 5 1905 1 1 24 LYS HA H -6.927 5.881 2.558 1.00 . A A . 24 LYS HA 1 1 5 1906 1 1 24 LYS HB2 H -4.276 4.615 2.663 1.00 . A A . 24 LYS HB2 1 1 5 1907 1 1 24 LYS HB3 H -5.203 5.358 3.928 1.00 . A A . 24 LYS HB3 1 1 5 1908 1 1 24 LYS HD2 H -6.705 2.254 5.137 1.00 . A A . 24 LYS HD2 1 1 5 1909 1 1 24 LYS HD3 H -6.067 3.820 5.668 1.00 . A A . 24 LYS HD3 1 1 5 1910 1 1 24 LYS HE2 H -7.745 4.963 4.339 1.00 . A A . 24 LYS HE2 1 1 5 1911 1 1 24 LYS HE3 H -8.316 3.417 3.714 1.00 . A A . 24 LYS HE3 1 1 5 1912 1 1 24 LYS HG2 H -6.110 2.755 2.843 1.00 . A A . 24 LYS HG2 1 1 5 1913 1 1 24 LYS HG3 H -4.710 2.785 3.907 1.00 . A A . 24 LYS HG3 1 1 5 1914 1 1 24 LYS HZ1 H -8.499 4.414 6.505 1.00 . A A . 24 LYS HZ1 1 1 5 1915 1 1 24 LYS HZ2 H -8.832 2.808 6.067 1.00 . A A . 24 LYS HZ2 1 1 5 1916 1 1 24 LYS HZ3 H -9.783 4.067 5.444 1.00 . A A . 24 LYS HZ3 1 1 5 1917 1 1 24 LYS N N -6.919 4.085 1.523 1.00 . A A . 24 LYS N 1 1 5 1918 1 1 24 LYS NZ N -8.814 3.794 5.724 1.00 . A A . 24 LYS NZ 1 1 5 1919 1 1 24 LYS O O -5.608 7.156 0.798 1.00 . A A . 24 LYS O 1 1 5 1920 1 1 25 TYR C C -4.039 6.009 -1.799 1.00 . A A . 25 TYR C 1 1 5 1921 1 1 25 TYR CA C -3.504 5.719 -0.421 1.00 . A A . 25 TYR CA 1 1 5 1922 1 1 25 TYR CB C -2.430 4.655 -0.559 1.00 . A A . 25 TYR CB 1 1 5 1923 1 1 25 TYR CD1 C -2.842 3.222 1.346 1.00 . A A . 25 TYR CD1 1 1 5 1924 1 1 25 TYR CD2 C -0.728 4.277 1.258 1.00 . A A . 25 TYR CD2 1 1 5 1925 1 1 25 TYR CE1 C -2.510 2.604 2.493 1.00 . A A . 25 TYR CE1 1 1 5 1926 1 1 25 TYR CE2 C -0.367 3.657 2.438 1.00 . A A . 25 TYR CE2 1 1 5 1927 1 1 25 TYR CG C -1.983 4.058 0.714 1.00 . A A . 25 TYR CG 1 1 5 1928 1 1 25 TYR CZ C -1.270 2.815 3.059 1.00 . A A . 25 TYR CZ 1 1 5 1929 1 1 25 TYR H H -4.614 4.236 0.524 1.00 . A A . 25 TYR H 1 1 5 1930 1 1 25 TYR HA H -3.101 6.596 0.045 1.00 . A A . 25 TYR HA 1 1 5 1931 1 1 25 TYR HB2 H -2.856 3.843 -1.115 1.00 . A A . 25 TYR HB2 1 1 5 1932 1 1 25 TYR HB3 H -1.583 5.041 -1.076 1.00 . A A . 25 TYR HB3 1 1 5 1933 1 1 25 TYR HD1 H -3.830 3.073 0.911 1.00 . A A . 25 TYR HD1 1 1 5 1934 1 1 25 TYR HD2 H -0.037 4.937 0.756 1.00 . A A . 25 TYR HD2 1 1 5 1935 1 1 25 TYR HE1 H -3.225 1.963 2.934 1.00 . A A . 25 TYR HE1 1 1 5 1936 1 1 25 TYR HE2 H 0.606 3.835 2.868 1.00 . A A . 25 TYR HE2 1 1 5 1937 1 1 25 TYR HH H -0.424 2.795 4.783 1.00 . A A . 25 TYR HH 1 1 5 1938 1 1 25 TYR N N -4.553 5.205 0.416 1.00 . A A . 25 TYR N 1 1 5 1939 1 1 25 TYR O O -4.017 7.141 -2.279 1.00 . A A . 25 TYR O 1 1 5 1940 1 1 25 TYR OH O -0.928 2.186 4.232 1.00 . A A . 25 TYR OH 1 1 5 1941 1 1 26 ALA C C -6.390 5.749 -3.739 1.00 . A A . 26 ALA C 1 1 5 1942 1 1 26 ALA CA C -5.076 4.999 -3.761 1.00 . A A . 26 ALA CA 1 1 5 1943 1 1 26 ALA CB C -5.273 3.593 -4.280 1.00 . A A . 26 ALA CB 1 1 5 1944 1 1 26 ALA H H -4.527 4.060 -1.939 1.00 . A A . 26 ALA H 1 1 5 1945 1 1 26 ALA HA H -4.375 5.513 -4.403 1.00 . A A . 26 ALA HA 1 1 5 1946 1 1 26 ALA HB1 H -4.317 3.099 -4.357 1.00 . A A . 26 ALA HB1 1 1 5 1947 1 1 26 ALA HB2 H -5.747 3.626 -5.248 1.00 . A A . 26 ALA HB2 1 1 5 1948 1 1 26 ALA HB3 H -5.902 3.045 -3.585 1.00 . A A . 26 ALA HB3 1 1 5 1949 1 1 26 ALA N N -4.524 4.939 -2.422 1.00 . A A . 26 ALA N 1 1 5 1950 1 1 26 ALA O O -6.865 6.241 -4.761 1.00 . A A . 26 ALA O 1 1 5 1951 1 1 27 ASN C C -8.088 7.973 -2.887 1.00 . A A . 27 ASN C 1 1 5 1952 1 1 27 ASN CA C -8.179 6.566 -2.302 1.00 . A A . 27 ASN CA 1 1 5 1953 1 1 27 ASN CB C -8.398 6.634 -0.801 1.00 . A A . 27 ASN CB 1 1 5 1954 1 1 27 ASN CG C -9.546 7.547 -0.403 1.00 . A A . 27 ASN CG 1 1 5 1955 1 1 27 ASN H H -6.565 5.301 -1.802 1.00 . A A . 27 ASN H 1 1 5 1956 1 1 27 ASN HA H -9.008 6.045 -2.756 1.00 . A A . 27 ASN HA 1 1 5 1957 1 1 27 ASN HB2 H -8.614 5.638 -0.441 1.00 . A A . 27 ASN HB2 1 1 5 1958 1 1 27 ASN HB3 H -7.487 6.981 -0.330 1.00 . A A . 27 ASN HB3 1 1 5 1959 1 1 27 ASN HD21 H -8.303 9.082 -0.192 1.00 . A A . 27 ASN HD21 1 1 5 1960 1 1 27 ASN HD22 H -9.975 9.412 0.120 1.00 . A A . 27 ASN HD22 1 1 5 1961 1 1 27 ASN N N -6.969 5.803 -2.551 1.00 . A A . 27 ASN N 1 1 5 1962 1 1 27 ASN ND2 N -9.246 8.804 -0.128 1.00 . A A . 27 ASN ND2 1 1 5 1963 1 1 27 ASN O O -7.236 8.758 -2.425 1.00 . A A . 27 ASN O 1 1 5 1964 1 1 27 ASN OXT O -8.880 8.293 -3.798 1.00 . A A . 27 ASN OXT 1 1 5 1965 1 1 27 ASN OD1 O -10.698 7.115 -0.324 1.00 . A A . 27 ASN OD1 1 1 6 1966 1 1 1 GLY C C 12.473 5.269 3.259 1.00 . A A . 1 GLY C 1 1 6 1967 1 1 1 GLY CA C 12.743 5.860 1.893 1.00 . A A . 1 GLY CA 1 1 6 1968 1 1 1 GLY H1 H 13.170 7.783 2.572 1.00 . A A . 1 GLY H1 1 1 6 1969 1 1 1 GLY H2 H 13.758 7.452 1.013 1.00 . A A . 1 GLY H2 1 1 6 1970 1 1 1 GLY H3 H 14.539 6.802 2.374 1.00 . A A . 1 GLY H3 1 1 6 1971 1 1 1 GLY HA2 H 11.802 6.142 1.441 1.00 . A A . 1 GLY HA2 1 1 6 1972 1 1 1 GLY HA3 H 13.222 5.115 1.274 1.00 . A A . 1 GLY HA3 1 1 6 1973 1 1 1 GLY N N 13.612 7.056 1.967 1.00 . A A . 1 GLY N 1 1 6 1974 1 1 1 GLY O O 13.354 5.258 4.119 1.00 . A A . 1 GLY O 1 1 6 1975 1 1 2 ILE C C 10.529 2.734 4.562 1.00 . A A . 2 ILE C 1 1 6 1976 1 1 2 ILE CA C 10.873 4.207 4.735 1.00 . A A . 2 ILE CA 1 1 6 1977 1 1 2 ILE CB C 9.646 4.928 5.327 1.00 . A A . 2 ILE CB 1 1 6 1978 1 1 2 ILE CD1 C 8.784 7.166 6.176 1.00 . A A . 2 ILE CD1 1 1 6 1979 1 1 2 ILE CG1 C 9.946 6.406 5.569 1.00 . A A . 2 ILE CG1 1 1 6 1980 1 1 2 ILE CG2 C 9.210 4.245 6.604 1.00 . A A . 2 ILE CG2 1 1 6 1981 1 1 2 ILE H H 10.593 4.832 2.749 1.00 . A A . 2 ILE H 1 1 6 1982 1 1 2 ILE HA H 11.699 4.307 5.427 1.00 . A A . 2 ILE HA 1 1 6 1983 1 1 2 ILE HB H 8.836 4.847 4.615 1.00 . A A . 2 ILE HB 1 1 6 1984 1 1 2 ILE HD11 H 8.512 6.713 7.119 1.00 . A A . 2 ILE HD11 1 1 6 1985 1 1 2 ILE HD12 H 7.942 7.131 5.503 1.00 . A A . 2 ILE HD12 1 1 6 1986 1 1 2 ILE HD13 H 9.072 8.193 6.340 1.00 . A A . 2 ILE HD13 1 1 6 1987 1 1 2 ILE HG12 H 10.786 6.492 6.240 1.00 . A A . 2 ILE HG12 1 1 6 1988 1 1 2 ILE HG13 H 10.188 6.872 4.624 1.00 . A A . 2 ILE HG13 1 1 6 1989 1 1 2 ILE HG21 H 8.961 3.217 6.383 1.00 . A A . 2 ILE HG21 1 1 6 1990 1 1 2 ILE HG22 H 8.347 4.749 7.006 1.00 . A A . 2 ILE HG22 1 1 6 1991 1 1 2 ILE HG23 H 10.017 4.276 7.318 1.00 . A A . 2 ILE HG23 1 1 6 1992 1 1 2 ILE N N 11.255 4.791 3.469 1.00 . A A . 2 ILE N 1 1 6 1993 1 1 2 ILE O O 11.309 1.847 4.903 1.00 . A A . 2 ILE O 1 1 6 1994 1 1 3 GLY C C 7.357 1.145 3.719 1.00 . A A . 3 GLY C 1 1 6 1995 1 1 3 GLY CA C 8.865 1.157 3.814 1.00 . A A . 3 GLY CA 1 1 6 1996 1 1 3 GLY H H 8.784 3.251 3.763 1.00 . A A . 3 GLY H 1 1 6 1997 1 1 3 GLY HA2 H 9.286 0.767 2.904 1.00 . A A . 3 GLY HA2 1 1 6 1998 1 1 3 GLY HA3 H 9.170 0.538 4.646 1.00 . A A . 3 GLY HA3 1 1 6 1999 1 1 3 GLY N N 9.349 2.497 4.016 1.00 . A A . 3 GLY N 1 1 6 2000 1 1 3 GLY O O 6.793 1.132 2.619 1.00 . A A . 3 GLY O 1 1 6 2001 1 1 4 GLY C C 4.697 2.616 4.644 1.00 . A A . 4 GLY C 1 1 6 2002 1 1 4 GLY CA C 5.261 1.243 4.939 1.00 . A A . 4 GLY CA 1 1 6 2003 1 1 4 GLY H H 7.232 1.288 5.704 1.00 . A A . 4 GLY H 1 1 6 2004 1 1 4 GLY HA2 H 4.873 0.540 4.220 1.00 . A A . 4 GLY HA2 1 1 6 2005 1 1 4 GLY HA3 H 4.949 0.943 5.929 1.00 . A A . 4 GLY HA3 1 1 6 2006 1 1 4 GLY N N 6.709 1.227 4.875 1.00 . A A . 4 GLY N 1 1 6 2007 1 1 4 GLY O O 3.814 3.106 5.342 1.00 . A A . 4 GLY O 1 1 6 2008 1 1 5 VAL C C 4.111 4.480 1.840 1.00 . A A . 5 VAL C 1 1 6 2009 1 1 5 VAL CA C 4.832 4.558 3.186 1.00 . A A . 5 VAL CA 1 1 6 2010 1 1 5 VAL CB C 6.060 5.494 3.095 1.00 . A A . 5 VAL CB 1 1 6 2011 1 1 5 VAL CG1 C 7.270 4.751 2.539 1.00 . A A . 5 VAL CG1 1 1 6 2012 1 1 5 VAL CG2 C 5.751 6.707 2.239 1.00 . A A . 5 VAL CG2 1 1 6 2013 1 1 5 VAL H H 5.940 2.773 3.112 1.00 . A A . 5 VAL H 1 1 6 2014 1 1 5 VAL HA H 4.155 4.959 3.927 1.00 . A A . 5 VAL HA 1 1 6 2015 1 1 5 VAL HB H 6.305 5.835 4.091 1.00 . A A . 5 VAL HB 1 1 6 2016 1 1 5 VAL HG11 H 8.129 5.409 2.537 1.00 . A A . 5 VAL HG11 1 1 6 2017 1 1 5 VAL HG12 H 7.063 4.423 1.531 1.00 . A A . 5 VAL HG12 1 1 6 2018 1 1 5 VAL HG13 H 7.479 3.888 3.158 1.00 . A A . 5 VAL HG13 1 1 6 2019 1 1 5 VAL HG21 H 5.602 6.385 1.215 1.00 . A A . 5 VAL HG21 1 1 6 2020 1 1 5 VAL HG22 H 6.577 7.403 2.284 1.00 . A A . 5 VAL HG22 1 1 6 2021 1 1 5 VAL HG23 H 4.853 7.184 2.600 1.00 . A A . 5 VAL HG23 1 1 6 2022 1 1 5 VAL N N 5.239 3.234 3.612 1.00 . A A . 5 VAL N 1 1 6 2023 1 1 5 VAL O O 3.015 5.011 1.679 1.00 . A A . 5 VAL O 1 1 6 2024 1 1 6 LEU C C 5.129 2.646 -1.168 1.00 . A A . 6 LEU C 1 1 6 2025 1 1 6 LEU CA C 4.176 3.557 -0.424 1.00 . A A . 6 LEU CA 1 1 6 2026 1 1 6 LEU CB C 3.909 4.883 -1.200 1.00 . A A . 6 LEU CB 1 1 6 2027 1 1 6 LEU CD1 C 6.286 5.787 -0.930 1.00 . A A . 6 LEU CD1 1 1 6 2028 1 1 6 LEU CD2 C 5.520 4.963 -3.174 1.00 . A A . 6 LEU CD2 1 1 6 2029 1 1 6 LEU CG C 5.098 5.628 -1.868 1.00 . A A . 6 LEU CG 1 1 6 2030 1 1 6 LEU H H 5.610 3.416 1.110 1.00 . A A . 6 LEU H 1 1 6 2031 1 1 6 LEU HA H 3.238 3.031 -0.290 1.00 . A A . 6 LEU HA 1 1 6 2032 1 1 6 LEU HB2 H 3.190 4.665 -1.976 1.00 . A A . 6 LEU HB2 1 1 6 2033 1 1 6 LEU HB3 H 3.444 5.567 -0.508 1.00 . A A . 6 LEU HB3 1 1 6 2034 1 1 6 LEU HD11 H 6.612 4.814 -0.591 1.00 . A A . 6 LEU HD11 1 1 6 2035 1 1 6 LEU HD12 H 5.992 6.384 -0.079 1.00 . A A . 6 LEU HD12 1 1 6 2036 1 1 6 LEU HD13 H 7.095 6.276 -1.450 1.00 . A A . 6 LEU HD13 1 1 6 2037 1 1 6 LEU HD21 H 6.336 5.520 -3.613 1.00 . A A . 6 LEU HD21 1 1 6 2038 1 1 6 LEU HD22 H 4.685 4.952 -3.859 1.00 . A A . 6 LEU HD22 1 1 6 2039 1 1 6 LEU HD23 H 5.841 3.952 -2.977 1.00 . A A . 6 LEU HD23 1 1 6 2040 1 1 6 LEU HG H 4.765 6.626 -2.116 1.00 . A A . 6 LEU HG 1 1 6 2041 1 1 6 LEU N N 4.738 3.794 0.901 1.00 . A A . 6 LEU N 1 1 6 2042 1 1 6 LEU O O 4.754 1.933 -2.092 1.00 . A A . 6 LEU O 1 1 6 2043 1 1 7 LEU C C 7.140 0.391 -1.165 1.00 . A A . 7 LEU C 1 1 6 2044 1 1 7 LEU CA C 7.438 1.880 -1.309 1.00 . A A . 7 LEU CA 1 1 6 2045 1 1 7 LEU CB C 8.785 2.215 -0.656 1.00 . A A . 7 LEU CB 1 1 6 2046 1 1 7 LEU CD1 C 10.055 0.491 -1.989 1.00 . A A . 7 LEU CD1 1 1 6 2047 1 1 7 LEU CD2 C 10.017 2.897 -2.678 1.00 . A A . 7 LEU CD2 1 1 6 2048 1 1 7 LEU CG C 10.016 1.937 -1.514 1.00 . A A . 7 LEU CG 1 1 6 2049 1 1 7 LEU H H 6.591 3.294 0.018 1.00 . A A . 7 LEU H 1 1 6 2050 1 1 7 LEU HA H 7.488 2.124 -2.359 1.00 . A A . 7 LEU HA 1 1 6 2051 1 1 7 LEU HB2 H 8.789 3.270 -0.420 1.00 . A A . 7 LEU HB2 1 1 6 2052 1 1 7 LEU HB3 H 8.874 1.653 0.260 1.00 . A A . 7 LEU HB3 1 1 6 2053 1 1 7 LEU HD11 H 9.077 0.213 -2.372 1.00 . A A . 7 LEU HD11 1 1 6 2054 1 1 7 LEU HD12 H 10.309 -0.154 -1.160 1.00 . A A . 7 LEU HD12 1 1 6 2055 1 1 7 LEU HD13 H 10.791 0.386 -2.769 1.00 . A A . 7 LEU HD13 1 1 6 2056 1 1 7 LEU HD21 H 9.791 3.887 -2.306 1.00 . A A . 7 LEU HD21 1 1 6 2057 1 1 7 LEU HD22 H 9.264 2.598 -3.392 1.00 . A A . 7 LEU HD22 1 1 6 2058 1 1 7 LEU HD23 H 10.987 2.899 -3.150 1.00 . A A . 7 LEU HD23 1 1 6 2059 1 1 7 LEU HG H 10.903 2.122 -0.928 1.00 . A A . 7 LEU HG 1 1 6 2060 1 1 7 LEU N N 6.378 2.680 -0.716 1.00 . A A . 7 LEU N 1 1 6 2061 1 1 7 LEU O O 6.696 -0.257 -2.111 1.00 . A A . 7 LEU O 1 1 6 2062 1 1 8 SER C C 5.775 -1.812 0.703 1.00 . A A . 8 SER C 1 1 6 2063 1 1 8 SER CA C 7.175 -1.582 0.213 1.00 . A A . 8 SER CA 1 1 6 2064 1 1 8 SER CB C 8.202 -2.174 1.172 1.00 . A A . 8 SER CB 1 1 6 2065 1 1 8 SER H H 7.561 0.429 0.794 1.00 . A A . 8 SER H 1 1 6 2066 1 1 8 SER HA H 7.280 -2.053 -0.756 1.00 . A A . 8 SER HA 1 1 6 2067 1 1 8 SER HB2 H 7.993 -3.226 1.296 1.00 . A A . 8 SER HB2 1 1 6 2068 1 1 8 SER HB3 H 9.192 -2.051 0.755 1.00 . A A . 8 SER HB3 1 1 6 2069 1 1 8 SER HG H 8.983 -1.730 2.918 1.00 . A A . 8 SER HG 1 1 6 2070 1 1 8 SER N N 7.352 -0.149 0.025 1.00 . A A . 8 SER N 1 1 6 2071 1 1 8 SER O O 5.245 -2.920 0.679 1.00 . A A . 8 SER O 1 1 6 2072 1 1 8 SER OG O 8.155 -1.542 2.438 1.00 . A A . 8 SER OG 1 1 6 2073 1 1 9 ALA C C 3.108 -0.977 -0.049 1.00 . A A . 9 ALA C 1 1 6 2074 1 1 9 ALA CA C 3.759 -0.605 1.278 1.00 . A A . 9 ALA CA 1 1 6 2075 1 1 9 ALA CB C 3.423 0.820 1.671 1.00 . A A . 9 ALA CB 1 1 6 2076 1 1 9 ALA H H 5.745 0.050 1.383 1.00 . A A . 9 ALA H 1 1 6 2077 1 1 9 ALA HA H 3.430 -1.277 2.058 1.00 . A A . 9 ALA HA 1 1 6 2078 1 1 9 ALA HB1 H 3.587 0.950 2.731 1.00 . A A . 9 ALA HB1 1 1 6 2079 1 1 9 ALA HB2 H 2.394 1.034 1.431 1.00 . A A . 9 ALA HB2 1 1 6 2080 1 1 9 ALA HB3 H 4.078 1.496 1.126 1.00 . A A . 9 ALA HB3 1 1 6 2081 1 1 9 ALA N N 5.186 -0.714 1.133 1.00 . A A . 9 ALA N 1 1 6 2082 1 1 9 ALA O O 1.978 -1.459 -0.086 1.00 . A A . 9 ALA O 1 1 6 2083 1 1 10 GLY C C 3.765 -2.606 -2.726 1.00 . A A . 10 GLY C 1 1 6 2084 1 1 10 GLY CA C 3.387 -1.176 -2.442 1.00 . A A . 10 GLY CA 1 1 6 2085 1 1 10 GLY H H 4.740 -0.340 -1.053 1.00 . A A . 10 GLY H 1 1 6 2086 1 1 10 GLY HA2 H 2.320 -1.086 -2.473 1.00 . A A . 10 GLY HA2 1 1 6 2087 1 1 10 GLY HA3 H 3.824 -0.539 -3.195 1.00 . A A . 10 GLY HA3 1 1 6 2088 1 1 10 GLY N N 3.853 -0.767 -1.140 1.00 . A A . 10 GLY N 1 1 6 2089 1 1 10 GLY O O 2.952 -3.385 -3.216 1.00 . A A . 10 GLY O 1 1 6 2090 1 1 11 LYS C C 4.649 -5.337 -1.843 1.00 . A A . 11 LYS C 1 1 6 2091 1 1 11 LYS CA C 5.525 -4.301 -2.546 1.00 . A A . 11 LYS CA 1 1 6 2092 1 1 11 LYS CB C 6.942 -4.361 -1.988 1.00 . A A . 11 LYS CB 1 1 6 2093 1 1 11 LYS CD C 8.305 -2.778 -3.429 1.00 . A A . 11 LYS CD 1 1 6 2094 1 1 11 LYS CE C 7.246 -2.267 -4.387 1.00 . A A . 11 LYS CE 1 1 6 2095 1 1 11 LYS CG C 8.058 -4.222 -3.012 1.00 . A A . 11 LYS CG 1 1 6 2096 1 1 11 LYS H H 5.588 -2.261 -2.011 1.00 . A A . 11 LYS H 1 1 6 2097 1 1 11 LYS HA H 5.552 -4.524 -3.601 1.00 . A A . 11 LYS HA 1 1 6 2098 1 1 11 LYS HB2 H 7.046 -3.551 -1.282 1.00 . A A . 11 LYS HB2 1 1 6 2099 1 1 11 LYS HB3 H 7.073 -5.298 -1.475 1.00 . A A . 11 LYS HB3 1 1 6 2100 1 1 11 LYS HD2 H 8.300 -2.156 -2.547 1.00 . A A . 11 LYS HD2 1 1 6 2101 1 1 11 LYS HD3 H 9.271 -2.715 -3.909 1.00 . A A . 11 LYS HD3 1 1 6 2102 1 1 11 LYS HE2 H 6.275 -2.515 -3.982 1.00 . A A . 11 LYS HE2 1 1 6 2103 1 1 11 LYS HE3 H 7.337 -1.193 -4.468 1.00 . A A . 11 LYS HE3 1 1 6 2104 1 1 11 LYS HG2 H 8.968 -4.620 -2.588 1.00 . A A . 11 LYS HG2 1 1 6 2105 1 1 11 LYS HG3 H 7.789 -4.798 -3.881 1.00 . A A . 11 LYS HG3 1 1 6 2106 1 1 11 LYS HZ1 H 6.631 -2.508 -6.368 1.00 . A A . 11 LYS HZ1 1 1 6 2107 1 1 11 LYS HZ2 H 7.298 -3.910 -5.686 1.00 . A A . 11 LYS HZ2 1 1 6 2108 1 1 11 LYS HZ3 H 8.305 -2.625 -6.147 1.00 . A A . 11 LYS HZ3 1 1 6 2109 1 1 11 LYS N N 4.999 -2.949 -2.384 1.00 . A A . 11 LYS N 1 1 6 2110 1 1 11 LYS NZ N 7.378 -2.870 -5.738 1.00 . A A . 11 LYS NZ 1 1 6 2111 1 1 11 LYS O O 4.487 -6.459 -2.322 1.00 . A A . 11 LYS O 1 1 6 2112 1 1 12 ALA C C 1.767 -5.677 -0.439 1.00 . A A . 12 ALA C 1 1 6 2113 1 1 12 ALA CA C 3.210 -5.847 0.027 1.00 . A A . 12 ALA CA 1 1 6 2114 1 1 12 ALA CB C 3.326 -5.591 1.520 1.00 . A A . 12 ALA CB 1 1 6 2115 1 1 12 ALA H H 4.301 -4.076 -0.332 1.00 . A A . 12 ALA H 1 1 6 2116 1 1 12 ALA HA H 3.522 -6.863 -0.167 1.00 . A A . 12 ALA HA 1 1 6 2117 1 1 12 ALA HB1 H 4.360 -5.679 1.821 1.00 . A A . 12 ALA HB1 1 1 6 2118 1 1 12 ALA HB2 H 2.731 -6.316 2.059 1.00 . A A . 12 ALA HB2 1 1 6 2119 1 1 12 ALA HB3 H 2.969 -4.595 1.742 1.00 . A A . 12 ALA HB3 1 1 6 2120 1 1 12 ALA N N 4.095 -4.963 -0.704 1.00 . A A . 12 ALA N 1 1 6 2121 1 1 12 ALA O O 0.940 -6.565 -0.249 1.00 . A A . 12 ALA O 1 1 6 2122 1 1 13 ALA C C -0.248 -5.176 -2.703 1.00 . A A . 13 ALA C 1 1 6 2123 1 1 13 ALA CA C 0.117 -4.265 -1.548 1.00 . A A . 13 ALA CA 1 1 6 2124 1 1 13 ALA CB C -0.068 -2.811 -1.958 1.00 . A A . 13 ALA CB 1 1 6 2125 1 1 13 ALA H H 2.169 -3.874 -1.201 1.00 . A A . 13 ALA H 1 1 6 2126 1 1 13 ALA HA H -0.563 -4.465 -0.731 1.00 . A A . 13 ALA HA 1 1 6 2127 1 1 13 ALA HB1 H 0.323 -2.165 -1.186 1.00 . A A . 13 ALA HB1 1 1 6 2128 1 1 13 ALA HB2 H -1.133 -2.611 -2.092 1.00 . A A . 13 ALA HB2 1 1 6 2129 1 1 13 ALA HB3 H 0.453 -2.626 -2.888 1.00 . A A . 13 ALA HB3 1 1 6 2130 1 1 13 ALA N N 1.468 -4.538 -1.064 1.00 . A A . 13 ALA N 1 1 6 2131 1 1 13 ALA O O -1.411 -5.543 -2.854 1.00 . A A . 13 ALA O 1 1 6 2132 1 1 14 LEU C C -0.101 -7.767 -4.010 1.00 . A A . 14 LEU C 1 1 6 2133 1 1 14 LEU CA C 0.498 -6.501 -4.597 1.00 . A A . 14 LEU CA 1 1 6 2134 1 1 14 LEU CB C 1.779 -6.888 -5.361 1.00 . A A . 14 LEU CB 1 1 6 2135 1 1 14 LEU CD1 C 1.811 -4.482 -6.177 1.00 . A A . 14 LEU CD1 1 1 6 2136 1 1 14 LEU CD2 C 3.854 -5.505 -5.134 1.00 . A A . 14 LEU CD2 1 1 6 2137 1 1 14 LEU CG C 2.618 -5.758 -5.977 1.00 . A A . 14 LEU CG 1 1 6 2138 1 1 14 LEU H H 1.643 -5.175 -3.387 1.00 . A A . 14 LEU H 1 1 6 2139 1 1 14 LEU HA H -0.208 -6.057 -5.281 1.00 . A A . 14 LEU HA 1 1 6 2140 1 1 14 LEU HB2 H 2.415 -7.431 -4.677 1.00 . A A . 14 LEU HB2 1 1 6 2141 1 1 14 LEU HB3 H 1.496 -7.562 -6.156 1.00 . A A . 14 LEU HB3 1 1 6 2142 1 1 14 LEU HD11 H 2.450 -3.713 -6.583 1.00 . A A . 14 LEU HD11 1 1 6 2143 1 1 14 LEU HD12 H 1.416 -4.152 -5.227 1.00 . A A . 14 LEU HD12 1 1 6 2144 1 1 14 LEU HD13 H 0.996 -4.673 -6.858 1.00 . A A . 14 LEU HD13 1 1 6 2145 1 1 14 LEU HD21 H 3.556 -5.224 -4.131 1.00 . A A . 14 LEU HD21 1 1 6 2146 1 1 14 LEU HD22 H 4.437 -4.710 -5.571 1.00 . A A . 14 LEU HD22 1 1 6 2147 1 1 14 LEU HD23 H 4.446 -6.407 -5.088 1.00 . A A . 14 LEU HD23 1 1 6 2148 1 1 14 LEU HG H 2.954 -6.080 -6.952 1.00 . A A . 14 LEU HG 1 1 6 2149 1 1 14 LEU N N 0.743 -5.550 -3.515 1.00 . A A . 14 LEU N 1 1 6 2150 1 1 14 LEU O O -0.894 -8.456 -4.648 1.00 . A A . 14 LEU O 1 1 6 2151 1 1 15 LYS C C -1.350 -8.989 -1.208 1.00 . A A . 15 LYS C 1 1 6 2152 1 1 15 LYS CA C -0.143 -9.255 -2.113 1.00 . A A . 15 LYS CA 1 1 6 2153 1 1 15 LYS CB C 1.028 -9.773 -1.290 1.00 . A A . 15 LYS CB 1 1 6 2154 1 1 15 LYS CD C 2.259 -10.709 -3.262 1.00 . A A . 15 LYS CD 1 1 6 2155 1 1 15 LYS CE C 2.135 -12.150 -2.817 1.00 . A A . 15 LYS CE 1 1 6 2156 1 1 15 LYS CG C 2.329 -9.783 -2.070 1.00 . A A . 15 LYS CG 1 1 6 2157 1 1 15 LYS H H 0.904 -7.455 -2.313 1.00 . A A . 15 LYS H 1 1 6 2158 1 1 15 LYS HA H -0.391 -9.982 -2.858 1.00 . A A . 15 LYS HA 1 1 6 2159 1 1 15 LYS HB2 H 1.155 -9.130 -0.436 1.00 . A A . 15 LYS HB2 1 1 6 2160 1 1 15 LYS HB3 H 0.816 -10.779 -0.957 1.00 . A A . 15 LYS HB3 1 1 6 2161 1 1 15 LYS HD2 H 1.394 -10.441 -3.851 1.00 . A A . 15 LYS HD2 1 1 6 2162 1 1 15 LYS HD3 H 3.154 -10.595 -3.853 1.00 . A A . 15 LYS HD3 1 1 6 2163 1 1 15 LYS HE2 H 2.932 -12.348 -2.121 1.00 . A A . 15 LYS HE2 1 1 6 2164 1 1 15 LYS HE3 H 1.185 -12.280 -2.323 1.00 . A A . 15 LYS HE3 1 1 6 2165 1 1 15 LYS HG2 H 2.511 -8.789 -2.428 1.00 . A A . 15 LYS HG2 1 1 6 2166 1 1 15 LYS HG3 H 3.133 -10.097 -1.423 1.00 . A A . 15 LYS HG3 1 1 6 2167 1 1 15 LYS HZ1 H 1.444 -12.947 -4.623 1.00 . A A . 15 LYS HZ1 1 1 6 2168 1 1 15 LYS HZ2 H 2.186 -14.083 -3.607 1.00 . A A . 15 LYS HZ2 1 1 6 2169 1 1 15 LYS HZ3 H 3.131 -12.969 -4.463 1.00 . A A . 15 LYS HZ3 1 1 6 2170 1 1 15 LYS N N 0.292 -8.059 -2.780 1.00 . A A . 15 LYS N 1 1 6 2171 1 1 15 LYS NZ N 2.228 -13.103 -3.953 1.00 . A A . 15 LYS NZ 1 1 6 2172 1 1 15 LYS O O -2.469 -9.406 -1.508 1.00 . A A . 15 LYS O 1 1 6 2173 1 1 16 GLY C C -2.608 -6.598 0.812 1.00 . A A . 16 GLY C 1 1 6 2174 1 1 16 GLY CA C -2.146 -8.016 0.856 1.00 . A A . 16 GLY CA 1 1 6 2175 1 1 16 GLY H H -0.235 -7.863 0.015 1.00 . A A . 16 GLY H 1 1 6 2176 1 1 16 GLY HA2 H -2.982 -8.664 0.660 1.00 . A A . 16 GLY HA2 1 1 6 2177 1 1 16 GLY HA3 H -1.773 -8.213 1.844 1.00 . A A . 16 GLY HA3 1 1 6 2178 1 1 16 GLY N N -1.109 -8.283 -0.106 1.00 . A A . 16 GLY N 1 1 6 2179 1 1 16 GLY O O -3.770 -6.313 0.555 1.00 . A A . 16 GLY O 1 1 6 2180 1 1 17 LEU C C -2.623 -3.541 0.336 1.00 . A A . 17 LEU C 1 1 6 2181 1 1 17 LEU CA C -1.898 -4.333 1.397 1.00 . A A . 17 LEU CA 1 1 6 2182 1 1 17 LEU CB C -0.645 -3.605 1.852 1.00 . A A . 17 LEU CB 1 1 6 2183 1 1 17 LEU CD1 C 0.693 -4.779 3.620 1.00 . A A . 17 LEU CD1 1 1 6 2184 1 1 17 LEU CD2 C -0.060 -2.401 3.967 1.00 . A A . 17 LEU CD2 1 1 6 2185 1 1 17 LEU CG C -0.386 -3.749 3.347 1.00 . A A . 17 LEU CG 1 1 6 2186 1 1 17 LEU H H -0.720 -6.012 1.030 1.00 . A A . 17 LEU H 1 1 6 2187 1 1 17 LEU HA H -2.547 -4.380 2.246 1.00 . A A . 17 LEU HA 1 1 6 2188 1 1 17 LEU HB2 H 0.207 -3.993 1.297 1.00 . A A . 17 LEU HB2 1 1 6 2189 1 1 17 LEU HB3 H -0.759 -2.555 1.627 1.00 . A A . 17 LEU HB3 1 1 6 2190 1 1 17 LEU HD11 H 0.377 -5.735 3.231 1.00 . A A . 17 LEU HD11 1 1 6 2191 1 1 17 LEU HD12 H 0.854 -4.858 4.686 1.00 . A A . 17 LEU HD12 1 1 6 2192 1 1 17 LEU HD13 H 1.610 -4.476 3.137 1.00 . A A . 17 LEU HD13 1 1 6 2193 1 1 17 LEU HD21 H 0.205 -2.533 5.006 1.00 . A A . 17 LEU HD21 1 1 6 2194 1 1 17 LEU HD22 H -0.935 -1.757 3.898 1.00 . A A . 17 LEU HD22 1 1 6 2195 1 1 17 LEU HD23 H 0.763 -1.946 3.438 1.00 . A A . 17 LEU HD23 1 1 6 2196 1 1 17 LEU HG H -1.293 -4.108 3.815 1.00 . A A . 17 LEU HG 1 1 6 2197 1 1 17 LEU N N -1.644 -5.713 1.061 1.00 . A A . 17 LEU N 1 1 6 2198 1 1 17 LEU O O -2.867 -2.362 0.518 1.00 . A A . 17 LEU O 1 1 6 2199 1 1 18 ALA C C -5.239 -3.292 -0.844 1.00 . A A . 18 ALA C 1 1 6 2200 1 1 18 ALA CA C -3.929 -3.466 -1.639 1.00 . A A . 18 ALA CA 1 1 6 2201 1 1 18 ALA CB C -4.155 -4.214 -2.934 1.00 . A A . 18 ALA CB 1 1 6 2202 1 1 18 ALA H H -2.577 -5.005 -1.037 1.00 . A A . 18 ALA H 1 1 6 2203 1 1 18 ALA HA H -3.514 -2.490 -1.875 1.00 . A A . 18 ALA HA 1 1 6 2204 1 1 18 ALA HB1 H -5.009 -3.797 -3.445 1.00 . A A . 18 ALA HB1 1 1 6 2205 1 1 18 ALA HB2 H -4.328 -5.258 -2.727 1.00 . A A . 18 ALA HB2 1 1 6 2206 1 1 18 ALA HB3 H -3.278 -4.106 -3.557 1.00 . A A . 18 ALA HB3 1 1 6 2207 1 1 18 ALA N N -2.965 -4.132 -0.784 1.00 . A A . 18 ALA N 1 1 6 2208 1 1 18 ALA O O -6.104 -2.463 -1.177 1.00 . A A . 18 ALA O 1 1 6 2209 1 1 19 LYS C C -6.507 -2.688 1.906 1.00 . A A . 19 LYS C 1 1 6 2210 1 1 19 LYS CA C -6.419 -4.035 1.202 1.00 . A A . 19 LYS CA 1 1 6 2211 1 1 19 LYS CB C -6.163 -5.156 2.211 1.00 . A A . 19 LYS CB 1 1 6 2212 1 1 19 LYS CD C -5.182 -4.229 4.347 1.00 . A A . 19 LYS CD 1 1 6 2213 1 1 19 LYS CE C -6.021 -5.052 5.311 1.00 . A A . 19 LYS CE 1 1 6 2214 1 1 19 LYS CG C -4.909 -4.978 3.058 1.00 . A A . 19 LYS CG 1 1 6 2215 1 1 19 LYS H H -4.593 -4.701 0.448 1.00 . A A . 19 LYS H 1 1 6 2216 1 1 19 LYS HA H -7.338 -4.232 0.675 1.00 . A A . 19 LYS HA 1 1 6 2217 1 1 19 LYS HB2 H -6.998 -5.240 2.862 1.00 . A A . 19 LYS HB2 1 1 6 2218 1 1 19 LYS HB3 H -6.047 -6.070 1.664 1.00 . A A . 19 LYS HB3 1 1 6 2219 1 1 19 LYS HD2 H -4.240 -3.988 4.821 1.00 . A A . 19 LYS HD2 1 1 6 2220 1 1 19 LYS HD3 H -5.708 -3.320 4.103 1.00 . A A . 19 LYS HD3 1 1 6 2221 1 1 19 LYS HE2 H -6.189 -4.472 6.207 1.00 . A A . 19 LYS HE2 1 1 6 2222 1 1 19 LYS HE3 H -6.968 -5.275 4.844 1.00 . A A . 19 LYS HE3 1 1 6 2223 1 1 19 LYS HG2 H -4.509 -5.952 3.301 1.00 . A A . 19 LYS HG2 1 1 6 2224 1 1 19 LYS HG3 H -4.185 -4.426 2.482 1.00 . A A . 19 LYS HG3 1 1 6 2225 1 1 19 LYS HZ1 H -5.451 -7.026 4.908 1.00 . A A . 19 LYS HZ1 1 1 6 2226 1 1 19 LYS HZ2 H -5.778 -6.721 6.546 1.00 . A A . 19 LYS HZ2 1 1 6 2227 1 1 19 LYS HZ3 H -4.334 -6.167 5.854 1.00 . A A . 19 LYS HZ3 1 1 6 2228 1 1 19 LYS N N -5.326 -4.064 0.257 1.00 . A A . 19 LYS N 1 1 6 2229 1 1 19 LYS NZ N -5.352 -6.330 5.681 1.00 . A A . 19 LYS NZ 1 1 6 2230 1 1 19 LYS O O -7.577 -2.252 2.289 1.00 . A A . 19 LYS O 1 1 6 2231 1 1 20 VAL C C -5.129 0.301 1.613 1.00 . A A . 20 VAL C 1 1 6 2232 1 1 20 VAL CA C -5.249 -0.739 2.718 1.00 . A A . 20 VAL CA 1 1 6 2233 1 1 20 VAL CB C -4.008 -0.634 3.610 1.00 . A A . 20 VAL CB 1 1 6 2234 1 1 20 VAL CG1 C -2.766 -0.792 2.769 1.00 . A A . 20 VAL CG1 1 1 6 2235 1 1 20 VAL CG2 C -3.982 0.665 4.393 1.00 . A A . 20 VAL CG2 1 1 6 2236 1 1 20 VAL H H -4.532 -2.569 1.886 1.00 . A A . 20 VAL H 1 1 6 2237 1 1 20 VAL HA H -6.120 -0.549 3.312 1.00 . A A . 20 VAL HA 1 1 6 2238 1 1 20 VAL HB H -4.039 -1.438 4.304 1.00 . A A . 20 VAL HB 1 1 6 2239 1 1 20 VAL HG11 H -2.923 -0.287 1.813 1.00 . A A . 20 VAL HG11 1 1 6 2240 1 1 20 VAL HG12 H -2.591 -1.851 2.584 1.00 . A A . 20 VAL HG12 1 1 6 2241 1 1 20 VAL HG13 H -1.920 -0.361 3.275 1.00 . A A . 20 VAL HG13 1 1 6 2242 1 1 20 VAL HG21 H -3.964 1.498 3.706 1.00 . A A . 20 VAL HG21 1 1 6 2243 1 1 20 VAL HG22 H -3.102 0.692 5.018 1.00 . A A . 20 VAL HG22 1 1 6 2244 1 1 20 VAL HG23 H -4.866 0.727 5.011 1.00 . A A . 20 VAL HG23 1 1 6 2245 1 1 20 VAL N N -5.352 -2.082 2.123 1.00 . A A . 20 VAL N 1 1 6 2246 1 1 20 VAL O O -5.492 1.458 1.743 1.00 . A A . 20 VAL O 1 1 6 2247 1 1 21 LEU C C -5.503 1.476 -1.084 1.00 . A A . 21 LEU C 1 1 6 2248 1 1 21 LEU CA C -4.322 0.645 -0.633 1.00 . A A . 21 LEU CA 1 1 6 2249 1 1 21 LEU CB C -3.997 -0.318 -1.715 1.00 . A A . 21 LEU CB 1 1 6 2250 1 1 21 LEU CD1 C -2.743 0.989 -3.380 1.00 . A A . 21 LEU CD1 1 1 6 2251 1 1 21 LEU CD2 C -1.615 0.200 -1.300 1.00 . A A . 21 LEU CD2 1 1 6 2252 1 1 21 LEU CG C -2.661 -0.126 -2.357 1.00 . A A . 21 LEU CG 1 1 6 2253 1 1 21 LEU H H -4.273 -1.087 0.547 1.00 . A A . 21 LEU H 1 1 6 2254 1 1 21 LEU HA H -3.470 1.276 -0.454 1.00 . A A . 21 LEU HA 1 1 6 2255 1 1 21 LEU HB2 H -4.026 -1.311 -1.281 1.00 . A A . 21 LEU HB2 1 1 6 2256 1 1 21 LEU HB3 H -4.766 -0.248 -2.468 1.00 . A A . 21 LEU HB3 1 1 6 2257 1 1 21 LEU HD11 H -1.760 1.197 -3.775 1.00 . A A . 21 LEU HD11 1 1 6 2258 1 1 21 LEU HD12 H -3.140 1.879 -2.903 1.00 . A A . 21 LEU HD12 1 1 6 2259 1 1 21 LEU HD13 H -3.403 0.690 -4.184 1.00 . A A . 21 LEU HD13 1 1 6 2260 1 1 21 LEU HD21 H -1.670 1.252 -1.050 1.00 . A A . 21 LEU HD21 1 1 6 2261 1 1 21 LEU HD22 H -0.631 -0.035 -1.675 1.00 . A A . 21 LEU HD22 1 1 6 2262 1 1 21 LEU HD23 H -1.818 -0.387 -0.411 1.00 . A A . 21 LEU HD23 1 1 6 2263 1 1 21 LEU HG H -2.396 -1.045 -2.839 1.00 . A A . 21 LEU HG 1 1 6 2264 1 1 21 LEU N N -4.577 -0.152 0.541 1.00 . A A . 21 LEU N 1 1 6 2265 1 1 21 LEU O O -5.478 2.700 -1.003 1.00 . A A . 21 LEU O 1 1 6 2266 1 1 22 ALA C C -8.455 2.313 -1.161 1.00 . A A . 22 ALA C 1 1 6 2267 1 1 22 ALA CA C -7.724 1.416 -2.144 1.00 . A A . 22 ALA CA 1 1 6 2268 1 1 22 ALA CB C -8.659 0.346 -2.640 1.00 . A A . 22 ALA CB 1 1 6 2269 1 1 22 ALA H H -6.507 -0.189 -1.438 1.00 . A A . 22 ALA H 1 1 6 2270 1 1 22 ALA HA H -7.402 1.997 -2.991 1.00 . A A . 22 ALA HA 1 1 6 2271 1 1 22 ALA HB1 H -9.535 0.808 -3.070 1.00 . A A . 22 ALA HB1 1 1 6 2272 1 1 22 ALA HB2 H -8.949 -0.282 -1.812 1.00 . A A . 22 ALA HB2 1 1 6 2273 1 1 22 ALA HB3 H -8.159 -0.246 -3.390 1.00 . A A . 22 ALA HB3 1 1 6 2274 1 1 22 ALA N N -6.538 0.786 -1.529 1.00 . A A . 22 ALA N 1 1 6 2275 1 1 22 ALA O O -9.428 2.990 -1.488 1.00 . A A . 22 ALA O 1 1 6 2276 1 1 23 GLU C C -8.003 4.229 1.458 1.00 . A A . 23 GLU C 1 1 6 2277 1 1 23 GLU CA C -8.563 2.859 1.190 1.00 . A A . 23 GLU CA 1 1 6 2278 1 1 23 GLU CB C -8.163 1.930 2.293 1.00 . A A . 23 GLU CB 1 1 6 2279 1 1 23 GLU CD C -9.624 -0.105 2.376 1.00 . A A . 23 GLU CD 1 1 6 2280 1 1 23 GLU CG C -8.327 0.493 1.869 1.00 . A A . 23 GLU CG 1 1 6 2281 1 1 23 GLU H H -7.083 1.857 0.160 1.00 . A A . 23 GLU H 1 1 6 2282 1 1 23 GLU HA H -9.629 2.873 1.084 1.00 . A A . 23 GLU HA 1 1 6 2283 1 1 23 GLU HB2 H -7.114 2.099 2.511 1.00 . A A . 23 GLU HB2 1 1 6 2284 1 1 23 GLU HB3 H -8.748 2.116 3.172 1.00 . A A . 23 GLU HB3 1 1 6 2285 1 1 23 GLU HG2 H -8.319 0.463 0.778 1.00 . A A . 23 GLU HG2 1 1 6 2286 1 1 23 GLU HG3 H -7.481 -0.077 2.224 1.00 . A A . 23 GLU HG3 1 1 6 2287 1 1 23 GLU N N -7.952 2.289 0.035 1.00 . A A . 23 GLU N 1 1 6 2288 1 1 23 GLU O O -8.719 5.200 1.691 1.00 . A A . 23 GLU O 1 1 6 2289 1 1 23 GLU OE1 O -9.702 -0.433 3.579 1.00 . A A . 23 GLU OE1 1 1 6 2290 1 1 23 GLU OE2 O -10.585 -0.210 1.587 1.00 . A A . 23 GLU OE2 1 1 6 2291 1 1 24 LYS C C -5.297 5.999 0.573 1.00 . A A . 24 LYS C 1 1 6 2292 1 1 24 LYS CA C -5.903 5.398 1.820 1.00 . A A . 24 LYS CA 1 1 6 2293 1 1 24 LYS CB C -4.789 4.953 2.741 1.00 . A A . 24 LYS CB 1 1 6 2294 1 1 24 LYS CD C -6.237 3.683 4.438 1.00 . A A . 24 LYS CD 1 1 6 2295 1 1 24 LYS CE C -6.307 5.012 5.151 1.00 . A A . 24 LYS CE 1 1 6 2296 1 1 24 LYS CG C -5.088 3.632 3.445 1.00 . A A . 24 LYS CG 1 1 6 2297 1 1 24 LYS H H -6.218 3.390 1.377 1.00 . A A . 24 LYS H 1 1 6 2298 1 1 24 LYS HA H -6.514 6.120 2.318 1.00 . A A . 24 LYS HA 1 1 6 2299 1 1 24 LYS HB2 H -3.891 4.825 2.155 1.00 . A A . 24 LYS HB2 1 1 6 2300 1 1 24 LYS HB3 H -4.620 5.704 3.464 1.00 . A A . 24 LYS HB3 1 1 6 2301 1 1 24 LYS HD2 H -7.165 3.529 3.903 1.00 . A A . 24 LYS HD2 1 1 6 2302 1 1 24 LYS HD3 H -6.104 2.884 5.159 1.00 . A A . 24 LYS HD3 1 1 6 2303 1 1 24 LYS HE2 H -5.391 5.167 5.703 1.00 . A A . 24 LYS HE2 1 1 6 2304 1 1 24 LYS HE3 H -6.410 5.775 4.393 1.00 . A A . 24 LYS HE3 1 1 6 2305 1 1 24 LYS HG2 H -5.380 2.930 2.673 1.00 . A A . 24 LYS HG2 1 1 6 2306 1 1 24 LYS HG3 H -4.197 3.274 3.942 1.00 . A A . 24 LYS HG3 1 1 6 2307 1 1 24 LYS HZ1 H -7.409 4.321 6.786 1.00 . A A . 24 LYS HZ1 1 1 6 2308 1 1 24 LYS HZ2 H -8.357 4.998 5.551 1.00 . A A . 24 LYS HZ2 1 1 6 2309 1 1 24 LYS HZ3 H -7.459 6.006 6.578 1.00 . A A . 24 LYS HZ3 1 1 6 2310 1 1 24 LYS N N -6.692 4.234 1.520 1.00 . A A . 24 LYS N 1 1 6 2311 1 1 24 LYS NZ N -7.463 5.090 6.080 1.00 . A A . 24 LYS NZ 1 1 6 2312 1 1 24 LYS O O -5.507 7.160 0.237 1.00 . A A . 24 LYS O 1 1 6 2313 1 1 25 TYR C C -4.299 5.608 -2.467 1.00 . A A . 25 TYR C 1 1 6 2314 1 1 25 TYR CA C -3.610 5.559 -1.124 1.00 . A A . 25 TYR CA 1 1 6 2315 1 1 25 TYR CB C -2.505 4.523 -1.208 1.00 . A A . 25 TYR CB 1 1 6 2316 1 1 25 TYR CD1 C -2.659 3.345 0.901 1.00 . A A . 25 TYR CD1 1 1 6 2317 1 1 25 TYR CD2 C -0.651 4.531 0.507 1.00 . A A . 25 TYR CD2 1 1 6 2318 1 1 25 TYR CE1 C -2.204 2.933 2.100 1.00 . A A . 25 TYR CE1 1 1 6 2319 1 1 25 TYR CE2 C -0.165 4.123 1.736 1.00 . A A . 25 TYR CE2 1 1 6 2320 1 1 25 TYR CG C -1.918 4.146 0.096 1.00 . A A . 25 TYR CG 1 1 6 2321 1 1 25 TYR CZ C -0.950 3.312 2.533 1.00 . A A . 25 TYR CZ 1 1 6 2322 1 1 25 TYR H H -4.596 4.203 0.105 1.00 . A A . 25 TYR H 1 1 6 2323 1 1 25 TYR HA H -3.203 6.513 -0.850 1.00 . A A . 25 TYR HA 1 1 6 2324 1 1 25 TYR HB2 H -2.935 3.623 -1.598 1.00 . A A . 25 TYR HB2 1 1 6 2325 1 1 25 TYR HB3 H -1.728 4.859 -1.853 1.00 . A A . 25 TYR HB3 1 1 6 2326 1 1 25 TYR HD1 H -3.661 3.063 0.573 1.00 . A A . 25 TYR HD1 1 1 6 2327 1 1 25 TYR HD2 H -0.052 5.164 -0.134 1.00 . A A . 25 TYR HD2 1 1 6 2328 1 1 25 TYR HE1 H -2.830 2.313 2.682 1.00 . A A . 25 TYR HE1 1 1 6 2329 1 1 25 TYR HE2 H 0.818 4.429 2.061 1.00 . A A . 25 TYR HE2 1 1 6 2330 1 1 25 TYR HH H -0.016 3.619 4.192 1.00 . A A . 25 TYR HH 1 1 6 2331 1 1 25 TYR N N -4.535 5.156 -0.099 1.00 . A A . 25 TYR N 1 1 6 2332 1 1 25 TYR O O -4.362 6.643 -3.125 1.00 . A A . 25 TYR O 1 1 6 2333 1 1 25 TYR OH O -0.486 2.890 3.760 1.00 . A A . 25 TYR OH 1 1 6 2334 1 1 26 ALA C C -6.848 5.003 -4.030 1.00 . A A . 26 ALA C 1 1 6 2335 1 1 26 ALA CA C -5.524 4.276 -4.109 1.00 . A A . 26 ALA CA 1 1 6 2336 1 1 26 ALA CB C -5.750 2.800 -4.369 1.00 . A A . 26 ALA CB 1 1 6 2337 1 1 26 ALA H H -4.708 3.652 -2.255 1.00 . A A . 26 ALA H 1 1 6 2338 1 1 26 ALA HA H -4.925 4.686 -4.909 1.00 . A A . 26 ALA HA 1 1 6 2339 1 1 26 ALA HB1 H -4.795 2.301 -4.456 1.00 . A A . 26 ALA HB1 1 1 6 2340 1 1 26 ALA HB2 H -6.314 2.673 -5.280 1.00 . A A . 26 ALA HB2 1 1 6 2341 1 1 26 ALA HB3 H -6.301 2.376 -3.535 1.00 . A A . 26 ALA HB3 1 1 6 2342 1 1 26 ALA N N -4.808 4.441 -2.855 1.00 . A A . 26 ALA N 1 1 6 2343 1 1 26 ALA O O -7.509 5.251 -5.039 1.00 . A A . 26 ALA O 1 1 6 2344 1 1 27 ASN C C -8.348 7.461 -3.170 1.00 . A A . 27 ASN C 1 1 6 2345 1 1 27 ASN CA C -8.422 6.084 -2.512 1.00 . A A . 27 ASN CA 1 1 6 2346 1 1 27 ASN CB C -8.559 6.234 -1.006 1.00 . A A . 27 ASN CB 1 1 6 2347 1 1 27 ASN CG C -9.829 6.959 -0.600 1.00 . A A . 27 ASN CG 1 1 6 2348 1 1 27 ASN H H -6.692 4.969 -2.045 1.00 . A A . 27 ASN H 1 1 6 2349 1 1 27 ASN HA H -9.279 5.553 -2.896 1.00 . A A . 27 ASN HA 1 1 6 2350 1 1 27 ASN HB2 H -8.556 5.251 -0.552 1.00 . A A . 27 ASN HB2 1 1 6 2351 1 1 27 ASN HB3 H -7.709 6.789 -0.630 1.00 . A A . 27 ASN HB3 1 1 6 2352 1 1 27 ASN HD21 H -8.865 8.693 -0.592 1.00 . A A . 27 ASN HD21 1 1 6 2353 1 1 27 ASN HD22 H -10.540 8.761 -0.173 1.00 . A A . 27 ASN HD22 1 1 6 2354 1 1 27 ASN N N -7.234 5.302 -2.800 1.00 . A A . 27 ASN N 1 1 6 2355 1 1 27 ASN ND2 N -9.737 8.267 -0.440 1.00 . A A . 27 ASN ND2 1 1 6 2356 1 1 27 ASN O O -7.575 8.317 -2.685 1.00 . A A . 27 ASN O 1 1 6 2357 1 1 27 ASN OXT O -9.070 7.688 -4.161 1.00 . A A . 27 ASN OXT 1 1 6 2358 1 1 27 ASN OD1 O -10.883 6.347 -0.424 1.00 . A A . 27 ASN OD1 1 1 7 2359 1 1 1 GLY C C 13.472 4.485 2.640 1.00 . A A . 1 GLY C 1 1 7 2360 1 1 1 GLY CA C 13.786 5.063 1.282 1.00 . A A . 1 GLY CA 1 1 7 2361 1 1 1 GLY H1 H 14.362 6.931 1.996 1.00 . A A . 1 GLY H1 1 1 7 2362 1 1 1 GLY H2 H 14.928 6.591 0.432 1.00 . A A . 1 GLY H2 1 1 7 2363 1 1 1 GLY H3 H 15.649 5.850 1.777 1.00 . A A . 1 GLY H3 1 1 7 2364 1 1 1 GLY HA2 H 12.872 5.417 0.830 1.00 . A A . 1 GLY HA2 1 1 7 2365 1 1 1 GLY HA3 H 14.211 4.289 0.660 1.00 . A A . 1 GLY HA3 1 1 7 2366 1 1 1 GLY N N 14.747 6.186 1.376 1.00 . A A . 1 GLY N 1 1 7 2367 1 1 1 GLY O O 14.260 4.626 3.576 1.00 . A A . 1 GLY O 1 1 7 2368 1 1 2 ILE C C 11.439 1.852 3.869 1.00 . A A . 2 ILE C 1 1 7 2369 1 1 2 ILE CA C 11.871 3.302 4.022 1.00 . A A . 2 ILE CA 1 1 7 2370 1 1 2 ILE CB C 10.669 4.101 4.564 1.00 . A A . 2 ILE CB 1 1 7 2371 1 1 2 ILE CD1 C 9.878 6.415 5.270 1.00 . A A . 2 ILE CD1 1 1 7 2372 1 1 2 ILE CG1 C 11.031 5.573 4.772 1.00 . A A . 2 ILE CG1 1 1 7 2373 1 1 2 ILE CG2 C 10.165 3.471 5.848 1.00 . A A . 2 ILE CG2 1 1 7 2374 1 1 2 ILE H H 11.774 3.688 1.962 1.00 . A A . 2 ILE H 1 1 7 2375 1 1 2 ILE HA H 12.680 3.366 4.732 1.00 . A A . 2 ILE HA 1 1 7 2376 1 1 2 ILE HB H 9.874 4.035 3.835 1.00 . A A . 2 ILE HB 1 1 7 2377 1 1 2 ILE HD11 H 10.208 7.433 5.409 1.00 . A A . 2 ILE HD11 1 1 7 2378 1 1 2 ILE HD12 H 9.521 6.018 6.210 1.00 . A A . 2 ILE HD12 1 1 7 2379 1 1 2 ILE HD13 H 9.079 6.391 4.544 1.00 . A A . 2 ILE HD13 1 1 7 2380 1 1 2 ILE HG12 H 11.832 5.647 5.490 1.00 . A A . 2 ILE HG12 1 1 7 2381 1 1 2 ILE HG13 H 11.355 5.987 3.828 1.00 . A A . 2 ILE HG13 1 1 7 2382 1 1 2 ILE HG21 H 10.943 3.501 6.593 1.00 . A A . 2 ILE HG21 1 1 7 2383 1 1 2 ILE HG22 H 9.896 2.442 5.648 1.00 . A A . 2 ILE HG22 1 1 7 2384 1 1 2 ILE HG23 H 9.301 4.011 6.199 1.00 . A A . 2 ILE HG23 1 1 7 2385 1 1 2 ILE N N 12.324 3.834 2.756 1.00 . A A . 2 ILE N 1 1 7 2386 1 1 2 ILE O O 12.139 0.927 4.279 1.00 . A A . 2 ILE O 1 1 7 2387 1 1 3 GLY C C 8.179 0.493 3.126 1.00 . A A . 3 GLY C 1 1 7 2388 1 1 3 GLY CA C 9.685 0.382 3.126 1.00 . A A . 3 GLY CA 1 1 7 2389 1 1 3 GLY H H 9.808 2.457 2.914 1.00 . A A . 3 GLY H 1 1 7 2390 1 1 3 GLY HA2 H 10.013 -0.060 2.200 1.00 . A A . 3 GLY HA2 1 1 7 2391 1 1 3 GLY HA3 H 9.993 -0.244 3.948 1.00 . A A . 3 GLY HA3 1 1 7 2392 1 1 3 GLY N N 10.278 1.679 3.267 1.00 . A A . 3 GLY N 1 1 7 2393 1 1 3 GLY O O 7.544 0.510 2.063 1.00 . A A . 3 GLY O 1 1 7 2394 1 1 4 GLY C C 5.706 2.189 4.215 1.00 . A A . 4 GLY C 1 1 7 2395 1 1 4 GLY CA C 6.182 0.776 4.461 1.00 . A A . 4 GLY CA 1 1 7 2396 1 1 4 GLY H H 8.194 0.722 5.099 1.00 . A A . 4 GLY H 1 1 7 2397 1 1 4 GLY HA2 H 5.706 0.116 3.754 1.00 . A A . 4 GLY HA2 1 1 7 2398 1 1 4 GLY HA3 H 5.903 0.481 5.463 1.00 . A A . 4 GLY HA3 1 1 7 2399 1 1 4 GLY N N 7.618 0.660 4.312 1.00 . A A . 4 GLY N 1 1 7 2400 1 1 4 GLY O O 4.909 2.736 4.973 1.00 . A A . 4 GLY O 1 1 7 2401 1 1 5 VAL C C 5.015 4.143 1.517 1.00 . A A . 5 VAL C 1 1 7 2402 1 1 5 VAL CA C 5.887 4.141 2.772 1.00 . A A . 5 VAL CA 1 1 7 2403 1 1 5 VAL CB C 7.176 4.973 2.557 1.00 . A A . 5 VAL CB 1 1 7 2404 1 1 5 VAL CG1 C 8.255 4.149 1.857 1.00 . A A . 5 VAL CG1 1 1 7 2405 1 1 5 VAL CG2 C 6.878 6.224 1.760 1.00 . A A . 5 VAL CG2 1 1 7 2406 1 1 5 VAL H H 6.845 2.274 2.593 1.00 . A A . 5 VAL H 1 1 7 2407 1 1 5 VAL HA H 5.329 4.585 3.583 1.00 . A A . 5 VAL HA 1 1 7 2408 1 1 5 VAL HB H 7.552 5.270 3.524 1.00 . A A . 5 VAL HB 1 1 7 2409 1 1 5 VAL HG11 H 9.154 4.742 1.762 1.00 . A A . 5 VAL HG11 1 1 7 2410 1 1 5 VAL HG12 H 7.907 3.855 0.877 1.00 . A A . 5 VAL HG12 1 1 7 2411 1 1 5 VAL HG13 H 8.467 3.262 2.438 1.00 . A A . 5 VAL HG13 1 1 7 2412 1 1 5 VAL HG21 H 6.059 6.758 2.218 1.00 . A A . 5 VAL HG21 1 1 7 2413 1 1 5 VAL HG22 H 6.611 5.941 0.749 1.00 . A A . 5 VAL HG22 1 1 7 2414 1 1 5 VAL HG23 H 7.755 6.857 1.736 1.00 . A A . 5 VAL HG23 1 1 7 2415 1 1 5 VAL N N 6.220 2.780 3.149 1.00 . A A . 5 VAL N 1 1 7 2416 1 1 5 VAL O O 3.952 4.760 1.486 1.00 . A A . 5 VAL O 1 1 7 2417 1 1 6 LEU C C 5.529 2.287 -1.614 1.00 . A A . 6 LEU C 1 1 7 2418 1 1 6 LEU CA C 4.743 3.248 -0.747 1.00 . A A . 6 LEU CA 1 1 7 2419 1 1 6 LEU CB C 4.487 4.604 -1.470 1.00 . A A . 6 LEU CB 1 1 7 2420 1 1 6 LEU CD1 C 6.946 5.303 -1.464 1.00 . A A . 6 LEU CD1 1 1 7 2421 1 1 6 LEU CD2 C 5.852 4.629 -3.620 1.00 . A A . 6 LEU CD2 1 1 7 2422 1 1 6 LEU CG C 5.647 5.277 -2.253 1.00 . A A . 6 LEU CG 1 1 7 2423 1 1 6 LEU H H 6.319 2.957 0.619 1.00 . A A . 6 LEU H 1 1 7 2424 1 1 6 LEU HA H 3.789 2.790 -0.508 1.00 . A A . 6 LEU HA 1 1 7 2425 1 1 6 LEU HB2 H 3.676 4.451 -2.166 1.00 . A A . 6 LEU HB2 1 1 7 2426 1 1 6 LEU HB3 H 4.149 5.306 -0.721 1.00 . A A . 6 LEU HB3 1 1 7 2427 1 1 6 LEU HD11 H 6.817 5.914 -0.582 1.00 . A A . 6 LEU HD11 1 1 7 2428 1 1 6 LEU HD12 H 7.732 5.715 -2.079 1.00 . A A . 6 LEU HD12 1 1 7 2429 1 1 6 LEU HD13 H 7.208 4.298 -1.169 1.00 . A A . 6 LEU HD13 1 1 7 2430 1 1 6 LEU HD21 H 6.686 5.101 -4.120 1.00 . A A . 6 LEU HD21 1 1 7 2431 1 1 6 LEU HD22 H 4.959 4.752 -4.214 1.00 . A A . 6 LEU HD22 1 1 7 2432 1 1 6 LEU HD23 H 6.059 3.576 -3.492 1.00 . A A . 6 LEU HD23 1 1 7 2433 1 1 6 LEU HG H 5.372 6.307 -2.430 1.00 . A A . 6 LEU HG 1 1 7 2434 1 1 6 LEU N N 5.469 3.417 0.508 1.00 . A A . 6 LEU N 1 1 7 2435 1 1 6 LEU O O 4.994 1.634 -2.506 1.00 . A A . 6 LEU O 1 1 7 2436 1 1 7 LEU C C 7.391 -0.122 -1.819 1.00 . A A . 7 LEU C 1 1 7 2437 1 1 7 LEU CA C 7.742 1.351 -2.026 1.00 . A A . 7 LEU CA 1 1 7 2438 1 1 7 LEU CB C 9.175 1.628 -1.561 1.00 . A A . 7 LEU CB 1 1 7 2439 1 1 7 LEU CD1 C 10.128 -0.043 -3.188 1.00 . A A . 7 LEU CD1 1 1 7 2440 1 1 7 LEU CD2 C 10.223 2.420 -3.656 1.00 . A A . 7 LEU CD2 1 1 7 2441 1 1 7 LEU CG C 10.268 1.350 -2.588 1.00 . A A . 7 LEU CG 1 1 7 2442 1 1 7 LEU H H 7.160 2.795 -0.592 1.00 . A A . 7 LEU H 1 1 7 2443 1 1 7 LEU HA H 7.664 1.583 -3.077 1.00 . A A . 7 LEU HA 1 1 7 2444 1 1 7 LEU HB2 H 9.243 2.673 -1.296 1.00 . A A . 7 LEU HB2 1 1 7 2445 1 1 7 LEU HB3 H 9.372 1.032 -0.684 1.00 . A A . 7 LEU HB3 1 1 7 2446 1 1 7 LEU HD11 H 9.097 -0.202 -3.487 1.00 . A A . 7 LEU HD11 1 1 7 2447 1 1 7 LEU HD12 H 10.402 -0.782 -2.450 1.00 . A A . 7 LEU HD12 1 1 7 2448 1 1 7 LEU HD13 H 10.772 -0.135 -4.048 1.00 . A A . 7 LEU HD13 1 1 7 2449 1 1 7 LEU HD21 H 9.358 2.265 -4.282 1.00 . A A . 7 LEU HD21 1 1 7 2450 1 1 7 LEU HD22 H 11.120 2.377 -4.255 1.00 . A A . 7 LEU HD22 1 1 7 2451 1 1 7 LEU HD23 H 10.147 3.386 -3.175 1.00 . A A . 7 LEU HD23 1 1 7 2452 1 1 7 LEU HG H 11.230 1.407 -2.099 1.00 . A A . 7 LEU HG 1 1 7 2453 1 1 7 LEU N N 6.818 2.214 -1.307 1.00 . A A . 7 LEU N 1 1 7 2454 1 1 7 LEU O O 6.791 -0.751 -2.688 1.00 . A A . 7 LEU O 1 1 7 2455 1 1 8 SER C C 6.156 -2.218 0.254 1.00 . A A . 8 SER C 1 1 7 2456 1 1 8 SER CA C 7.488 -2.085 -0.424 1.00 . A A . 8 SER CA 1 1 7 2457 1 1 8 SER CB C 8.591 -2.752 0.391 1.00 . A A . 8 SER CB 1 1 7 2458 1 1 8 SER H H 8.072 -0.103 0.066 1.00 . A A . 8 SER H 1 1 7 2459 1 1 8 SER HA H 7.425 -2.566 -1.391 1.00 . A A . 8 SER HA 1 1 7 2460 1 1 8 SER HB2 H 8.332 -3.797 0.530 1.00 . A A . 8 SER HB2 1 1 7 2461 1 1 8 SER HB3 H 9.525 -2.681 -0.150 1.00 . A A . 8 SER HB3 1 1 7 2462 1 1 8 SER HG H 8.551 -2.792 2.351 1.00 . A A . 8 SER HG 1 1 7 2463 1 1 8 SER N N 7.729 -0.668 -0.658 1.00 . A A . 8 SER N 1 1 7 2464 1 1 8 SER O O 5.609 -3.299 0.405 1.00 . A A . 8 SER O 1 1 7 2465 1 1 8 SER OG O 8.750 -2.140 1.655 1.00 . A A . 8 SER OG 1 1 7 2466 1 1 9 ALA C C 3.467 -1.292 -0.331 1.00 . A A . 9 ALA C 1 1 7 2467 1 1 9 ALA CA C 4.249 -0.906 0.921 1.00 . A A . 9 ALA CA 1 1 7 2468 1 1 9 ALA CB C 4.005 0.537 1.302 1.00 . A A . 9 ALA CB 1 1 7 2469 1 1 9 ALA H H 6.252 -0.311 0.786 1.00 . A A . 9 ALA H 1 1 7 2470 1 1 9 ALA HA H 3.973 -1.545 1.746 1.00 . A A . 9 ALA HA 1 1 7 2471 1 1 9 ALA HB1 H 4.224 0.673 2.350 1.00 . A A . 9 ALA HB1 1 1 7 2472 1 1 9 ALA HB2 H 2.979 0.803 1.100 1.00 . A A . 9 ALA HB2 1 1 7 2473 1 1 9 ALA HB3 H 4.672 1.165 0.716 1.00 . A A . 9 ALA HB3 1 1 7 2474 1 1 9 ALA N N 5.650 -1.071 0.650 1.00 . A A . 9 ALA N 1 1 7 2475 1 1 9 ALA O O 2.325 -1.731 -0.258 1.00 . A A . 9 ALA O 1 1 7 2476 1 1 10 GLY C C 3.905 -3.064 -2.962 1.00 . A A . 10 GLY C 1 1 7 2477 1 1 10 GLY CA C 3.558 -1.613 -2.729 1.00 . A A . 10 GLY CA 1 1 7 2478 1 1 10 GLY H H 5.015 -0.712 -1.488 1.00 . A A . 10 GLY H 1 1 7 2479 1 1 10 GLY HA2 H 2.488 -1.506 -2.690 1.00 . A A . 10 GLY HA2 1 1 7 2480 1 1 10 GLY HA3 H 3.951 -1.021 -3.540 1.00 . A A . 10 GLY HA3 1 1 7 2481 1 1 10 GLY N N 4.123 -1.141 -1.487 1.00 . A A . 10 GLY N 1 1 7 2482 1 1 10 GLY O O 3.054 -3.866 -3.335 1.00 . A A . 10 GLY O 1 1 7 2483 1 1 11 LYS C C 4.905 -5.734 -1.898 1.00 . A A . 11 LYS C 1 1 7 2484 1 1 11 LYS CA C 5.670 -4.763 -2.801 1.00 . A A . 11 LYS CA 1 1 7 2485 1 1 11 LYS CB C 7.142 -4.773 -2.413 1.00 . A A . 11 LYS CB 1 1 7 2486 1 1 11 LYS CD C 8.328 -3.361 -4.153 1.00 . A A . 11 LYS CD 1 1 7 2487 1 1 11 LYS CE C 7.170 -2.931 -5.029 1.00 . A A . 11 LYS CE 1 1 7 2488 1 1 11 LYS CG C 8.121 -4.754 -3.574 1.00 . A A . 11 LYS CG 1 1 7 2489 1 1 11 LYS H H 5.785 -2.690 -2.426 1.00 . A A . 11 LYS H 1 1 7 2490 1 1 11 LYS HA H 5.573 -5.083 -3.826 1.00 . A A . 11 LYS HA 1 1 7 2491 1 1 11 LYS HB2 H 7.324 -3.895 -1.813 1.00 . A A . 11 LYS HB2 1 1 7 2492 1 1 11 LYS HB3 H 7.336 -5.653 -1.825 1.00 . A A . 11 LYS HB3 1 1 7 2493 1 1 11 LYS HD2 H 8.427 -2.658 -3.341 1.00 . A A . 11 LYS HD2 1 1 7 2494 1 1 11 LYS HD3 H 9.233 -3.363 -4.743 1.00 . A A . 11 LYS HD3 1 1 7 2495 1 1 11 LYS HE2 H 6.261 -3.010 -4.451 1.00 . A A . 11 LYS HE2 1 1 7 2496 1 1 11 LYS HE3 H 7.320 -1.906 -5.329 1.00 . A A . 11 LYS HE3 1 1 7 2497 1 1 11 LYS HG2 H 9.071 -5.131 -3.230 1.00 . A A . 11 LYS HG2 1 1 7 2498 1 1 11 LYS HG3 H 7.736 -5.399 -4.342 1.00 . A A . 11 LYS HG3 1 1 7 2499 1 1 11 LYS HZ1 H 6.268 -3.430 -6.846 1.00 . A A . 11 LYS HZ1 1 1 7 2500 1 1 11 LYS HZ2 H 6.838 -4.767 -5.973 1.00 . A A . 11 LYS HZ2 1 1 7 2501 1 1 11 LYS HZ3 H 7.934 -3.761 -6.789 1.00 . A A . 11 LYS HZ3 1 1 7 2502 1 1 11 LYS N N 5.162 -3.397 -2.697 1.00 . A A . 11 LYS N 1 1 7 2503 1 1 11 LYS NZ N 7.045 -3.780 -6.242 1.00 . A A . 11 LYS NZ 1 1 7 2504 1 1 11 LYS O O 4.945 -6.944 -2.100 1.00 . A A . 11 LYS O 1 1 7 2505 1 1 12 ALA C C 1.950 -5.862 -0.431 1.00 . A A . 12 ALA C 1 1 7 2506 1 1 12 ALA CA C 3.408 -6.006 -0.009 1.00 . A A . 12 ALA CA 1 1 7 2507 1 1 12 ALA CB C 3.587 -5.605 1.446 1.00 . A A . 12 ALA CB 1 1 7 2508 1 1 12 ALA H H 4.406 -4.258 -0.656 1.00 . A A . 12 ALA H 1 1 7 2509 1 1 12 ALA HA H 3.703 -7.039 -0.113 1.00 . A A . 12 ALA HA 1 1 7 2510 1 1 12 ALA HB1 H 4.614 -5.759 1.741 1.00 . A A . 12 ALA HB1 1 1 7 2511 1 1 12 ALA HB2 H 2.941 -6.210 2.065 1.00 . A A . 12 ALA HB2 1 1 7 2512 1 1 12 ALA HB3 H 3.330 -4.564 1.567 1.00 . A A . 12 ALA HB3 1 1 7 2513 1 1 12 ALA N N 4.270 -5.206 -0.866 1.00 . A A . 12 ALA N 1 1 7 2514 1 1 12 ALA O O 1.122 -6.730 -0.145 1.00 . A A . 12 ALA O 1 1 7 2515 1 1 13 ALA C C -0.239 -5.525 -2.505 1.00 . A A . 13 ALA C 1 1 7 2516 1 1 13 ALA CA C 0.282 -4.476 -1.547 1.00 . A A . 13 ALA CA 1 1 7 2517 1 1 13 ALA CB C 0.167 -3.095 -2.173 1.00 . A A . 13 ALA CB 1 1 7 2518 1 1 13 ALA H H 2.353 -4.133 -1.335 1.00 . A A . 13 ALA H 1 1 7 2519 1 1 13 ALA HA H -0.341 -4.487 -0.667 1.00 . A A . 13 ALA HA 1 1 7 2520 1 1 13 ALA HB1 H 0.650 -3.092 -3.137 1.00 . A A . 13 ALA HB1 1 1 7 2521 1 1 13 ALA HB2 H 0.643 -2.371 -1.530 1.00 . A A . 13 ALA HB2 1 1 7 2522 1 1 13 ALA HB3 H -0.888 -2.838 -2.289 1.00 . A A . 13 ALA HB3 1 1 7 2523 1 1 13 ALA N N 1.645 -4.764 -1.118 1.00 . A A . 13 ALA N 1 1 7 2524 1 1 13 ALA O O -1.335 -6.046 -2.305 1.00 . A A . 13 ALA O 1 1 7 2525 1 1 14 LEU C C -0.159 -8.229 -3.797 1.00 . A A . 14 LEU C 1 1 7 2526 1 1 14 LEU CA C 0.097 -6.880 -4.480 1.00 . A A . 14 LEU CA 1 1 7 2527 1 1 14 LEU CB C 1.033 -7.044 -5.701 1.00 . A A . 14 LEU CB 1 1 7 2528 1 1 14 LEU CD1 C 3.093 -5.607 -5.676 1.00 . A A . 14 LEU CD1 1 1 7 2529 1 1 14 LEU CD2 C 2.990 -7.576 -4.155 1.00 . A A . 14 LEU CD2 1 1 7 2530 1 1 14 LEU CG C 2.562 -7.017 -5.502 1.00 . A A . 14 LEU CG 1 1 7 2531 1 1 14 LEU H H 1.405 -5.411 -3.662 1.00 . A A . 14 LEU H 1 1 7 2532 1 1 14 LEU HA H -0.861 -6.536 -4.850 1.00 . A A . 14 LEU HA 1 1 7 2533 1 1 14 LEU HB2 H 0.790 -7.981 -6.172 1.00 . A A . 14 LEU HB2 1 1 7 2534 1 1 14 LEU HB3 H 0.784 -6.253 -6.393 1.00 . A A . 14 LEU HB3 1 1 7 2535 1 1 14 LEU HD11 H 2.842 -5.248 -6.662 1.00 . A A . 14 LEU HD11 1 1 7 2536 1 1 14 LEU HD12 H 4.167 -5.611 -5.556 1.00 . A A . 14 LEU HD12 1 1 7 2537 1 1 14 LEU HD13 H 2.651 -4.960 -4.934 1.00 . A A . 14 LEU HD13 1 1 7 2538 1 1 14 LEU HD21 H 2.707 -8.614 -4.087 1.00 . A A . 14 LEU HD21 1 1 7 2539 1 1 14 LEU HD22 H 2.511 -7.016 -3.361 1.00 . A A . 14 LEU HD22 1 1 7 2540 1 1 14 LEU HD23 H 4.063 -7.488 -4.053 1.00 . A A . 14 LEU HD23 1 1 7 2541 1 1 14 LEU HG H 3.015 -7.630 -6.270 1.00 . A A . 14 LEU HG 1 1 7 2542 1 1 14 LEU N N 0.538 -5.863 -3.532 1.00 . A A . 14 LEU N 1 1 7 2543 1 1 14 LEU O O -0.754 -9.125 -4.396 1.00 . A A . 14 LEU O 1 1 7 2544 1 1 15 LYS C C -1.268 -9.217 -0.875 1.00 . A A . 15 LYS C 1 1 7 2545 1 1 15 LYS CA C -0.070 -9.534 -1.766 1.00 . A A . 15 LYS CA 1 1 7 2546 1 1 15 LYS CB C 1.107 -9.921 -0.882 1.00 . A A . 15 LYS CB 1 1 7 2547 1 1 15 LYS CD C 2.335 -11.153 -2.672 1.00 . A A . 15 LYS CD 1 1 7 2548 1 1 15 LYS CE C 2.056 -12.489 -2.011 1.00 . A A . 15 LYS CE 1 1 7 2549 1 1 15 LYS CG C 2.403 -10.050 -1.643 1.00 . A A . 15 LYS CG 1 1 7 2550 1 1 15 LYS H H 0.896 -7.712 -2.173 1.00 . A A . 15 LYS H 1 1 7 2551 1 1 15 LYS HA H -0.298 -10.344 -2.428 1.00 . A A . 15 LYS HA 1 1 7 2552 1 1 15 LYS HB2 H 1.235 -9.158 -0.134 1.00 . A A . 15 LYS HB2 1 1 7 2553 1 1 15 LYS HB3 H 0.896 -10.865 -0.401 1.00 . A A . 15 LYS HB3 1 1 7 2554 1 1 15 LYS HD2 H 1.535 -10.919 -3.360 1.00 . A A . 15 LYS HD2 1 1 7 2555 1 1 15 LYS HD3 H 3.274 -11.204 -3.203 1.00 . A A . 15 LYS HD3 1 1 7 2556 1 1 15 LYS HE2 H 2.864 -12.714 -1.330 1.00 . A A . 15 LYS HE2 1 1 7 2557 1 1 15 LYS HE3 H 1.140 -12.395 -1.456 1.00 . A A . 15 LYS HE3 1 1 7 2558 1 1 15 LYS HG2 H 2.577 -9.126 -2.147 1.00 . A A . 15 LYS HG2 1 1 7 2559 1 1 15 LYS HG3 H 3.208 -10.252 -0.951 1.00 . A A . 15 LYS HG3 1 1 7 2560 1 1 15 LYS HZ1 H 1.836 -14.512 -2.495 1.00 . A A . 15 LYS HZ1 1 1 7 2561 1 1 15 LYS HZ2 H 2.767 -13.639 -3.607 1.00 . A A . 15 LYS HZ2 1 1 7 2562 1 1 15 LYS HZ3 H 1.080 -13.460 -3.587 1.00 . A A . 15 LYS HZ3 1 1 7 2563 1 1 15 LYS N N 0.294 -8.378 -2.554 1.00 . A A . 15 LYS N 1 1 7 2564 1 1 15 LYS NZ N 1.927 -13.601 -2.992 1.00 . A A . 15 LYS NZ 1 1 7 2565 1 1 15 LYS O O -2.387 -9.678 -1.121 1.00 . A A . 15 LYS O 1 1 7 2566 1 1 16 GLY C C -2.460 -6.622 0.933 1.00 . A A . 16 GLY C 1 1 7 2567 1 1 16 GLY CA C -2.044 -8.045 1.091 1.00 . A A . 16 GLY CA 1 1 7 2568 1 1 16 GLY H H -0.137 -7.997 0.233 1.00 . A A . 16 GLY H 1 1 7 2569 1 1 16 GLY HA2 H -2.901 -8.677 0.936 1.00 . A A . 16 GLY HA2 1 1 7 2570 1 1 16 GLY HA3 H -1.684 -8.183 2.092 1.00 . A A . 16 GLY HA3 1 1 7 2571 1 1 16 GLY N N -1.019 -8.416 0.154 1.00 . A A . 16 GLY N 1 1 7 2572 1 1 16 GLY O O -3.610 -6.317 0.643 1.00 . A A . 16 GLY O 1 1 7 2573 1 1 17 LEU C C -2.356 -3.588 0.269 1.00 . A A . 17 LEU C 1 1 7 2574 1 1 17 LEU CA C -1.651 -4.351 1.367 1.00 . A A . 17 LEU CA 1 1 7 2575 1 1 17 LEU CB C -0.354 -3.658 1.762 1.00 . A A . 17 LEU CB 1 1 7 2576 1 1 17 LEU CD1 C 0.980 -4.773 3.562 1.00 . A A . 17 LEU CD1 1 1 7 2577 1 1 17 LEU CD2 C 0.296 -2.366 3.808 1.00 . A A . 17 LEU CD2 1 1 7 2578 1 1 17 LEU CG C -0.077 -3.735 3.260 1.00 . A A . 17 LEU CG 1 1 7 2579 1 1 17 LEU H H -0.550 -6.092 1.082 1.00 . A A . 17 LEU H 1 1 7 2580 1 1 17 LEU HA H -2.286 -4.319 2.230 1.00 . A A . 17 LEU HA 1 1 7 2581 1 1 17 LEU HB2 H 0.467 -4.122 1.224 1.00 . A A . 17 LEU HB2 1 1 7 2582 1 1 17 LEU HB3 H -0.416 -2.619 1.478 1.00 . A A . 17 LEU HB3 1 1 7 2583 1 1 17 LEU HD11 H 0.633 -5.740 3.224 1.00 . A A . 17 LEU HD11 1 1 7 2584 1 1 17 LEU HD12 H 1.158 -4.804 4.628 1.00 . A A . 17 LEU HD12 1 1 7 2585 1 1 17 LEU HD13 H 1.894 -4.516 3.050 1.00 . A A . 17 LEU HD13 1 1 7 2586 1 1 17 LEU HD21 H 1.114 -1.955 3.239 1.00 . A A . 17 LEU HD21 1 1 7 2587 1 1 17 LEU HD22 H 0.588 -2.462 4.843 1.00 . A A . 17 LEU HD22 1 1 7 2588 1 1 17 LEU HD23 H -0.568 -1.706 3.735 1.00 . A A . 17 LEU HD23 1 1 7 2589 1 1 17 LEU HG H -0.986 -4.048 3.758 1.00 . A A . 17 LEU HG 1 1 7 2590 1 1 17 LEU N N -1.460 -5.757 1.110 1.00 . A A . 17 LEU N 1 1 7 2591 1 1 17 LEU O O -2.555 -2.396 0.389 1.00 . A A . 17 LEU O 1 1 7 2592 1 1 18 ALA C C -4.968 -3.307 -0.927 1.00 . A A . 18 ALA C 1 1 7 2593 1 1 18 ALA CA C -3.661 -3.558 -1.704 1.00 . A A . 18 ALA CA 1 1 7 2594 1 1 18 ALA CB C -3.897 -4.346 -2.975 1.00 . A A . 18 ALA CB 1 1 7 2595 1 1 18 ALA H H -2.387 -5.130 -1.019 1.00 . A A . 18 ALA H 1 1 7 2596 1 1 18 ALA HA H -3.210 -2.607 -1.969 1.00 . A A . 18 ALA HA 1 1 7 2597 1 1 18 ALA HB1 H -4.108 -5.375 -2.733 1.00 . A A . 18 ALA HB1 1 1 7 2598 1 1 18 ALA HB2 H -3.015 -4.285 -3.593 1.00 . A A . 18 ALA HB2 1 1 7 2599 1 1 18 ALA HB3 H -4.736 -3.920 -3.508 1.00 . A A . 18 ALA HB3 1 1 7 2600 1 1 18 ALA N N -2.733 -4.225 -0.813 1.00 . A A . 18 ALA N 1 1 7 2601 1 1 18 ALA O O -5.780 -2.434 -1.278 1.00 . A A . 18 ALA O 1 1 7 2602 1 1 19 LYS C C -6.240 -2.578 1.769 1.00 . A A . 19 LYS C 1 1 7 2603 1 1 19 LYS CA C -6.186 -3.953 1.121 1.00 . A A . 19 LYS CA 1 1 7 2604 1 1 19 LYS CB C -5.972 -5.038 2.176 1.00 . A A . 19 LYS CB 1 1 7 2605 1 1 19 LYS CD C -5.024 -4.057 4.302 1.00 . A A . 19 LYS CD 1 1 7 2606 1 1 19 LYS CE C -5.971 -4.793 5.232 1.00 . A A . 19 LYS CE 1 1 7 2607 1 1 19 LYS CG C -4.732 -4.858 3.050 1.00 . A A . 19 LYS CG 1 1 7 2608 1 1 19 LYS H H -4.380 -4.695 0.407 1.00 . A A . 19 LYS H 1 1 7 2609 1 1 19 LYS HA H -7.108 -4.144 0.593 1.00 . A A . 19 LYS HA 1 1 7 2610 1 1 19 LYS HB2 H -6.825 -5.073 2.812 1.00 . A A . 19 LYS HB2 1 1 7 2611 1 1 19 LYS HB3 H -5.872 -5.975 1.670 1.00 . A A . 19 LYS HB3 1 1 7 2612 1 1 19 LYS HD2 H -4.096 -3.866 4.823 1.00 . A A . 19 LYS HD2 1 1 7 2613 1 1 19 LYS HD3 H -5.473 -3.123 4.003 1.00 . A A . 19 LYS HD3 1 1 7 2614 1 1 19 LYS HE2 H -6.252 -4.129 6.035 1.00 . A A . 19 LYS HE2 1 1 7 2615 1 1 19 LYS HE3 H -6.851 -5.075 4.674 1.00 . A A . 19 LYS HE3 1 1 7 2616 1 1 19 LYS HG2 H -4.362 -5.830 3.336 1.00 . A A . 19 LYS HG2 1 1 7 2617 1 1 19 LYS HG3 H -3.981 -4.341 2.474 1.00 . A A . 19 LYS HG3 1 1 7 2618 1 1 19 LYS HZ1 H -6.084 -6.629 6.221 1.00 . A A . 19 LYS HZ1 1 1 7 2619 1 1 19 LYS HZ2 H -4.674 -5.754 6.560 1.00 . A A . 19 LYS HZ2 1 1 7 2620 1 1 19 LYS HZ3 H -4.841 -6.548 5.071 1.00 . A A . 19 LYS HZ3 1 1 7 2621 1 1 19 LYS N N -5.090 -4.045 0.190 1.00 . A A . 19 LYS N 1 1 7 2622 1 1 19 LYS NZ N -5.350 -6.015 5.810 1.00 . A A . 19 LYS NZ 1 1 7 2623 1 1 19 LYS O O -7.307 -2.068 2.068 1.00 . A A . 19 LYS O 1 1 7 2624 1 1 20 VAL C C -4.709 0.330 1.484 1.00 . A A . 20 VAL C 1 1 7 2625 1 1 20 VAL CA C -4.889 -0.698 2.593 1.00 . A A . 20 VAL CA 1 1 7 2626 1 1 20 VAL CB C -3.645 -0.673 3.487 1.00 . A A . 20 VAL CB 1 1 7 2627 1 1 20 VAL CG1 C -2.407 -0.812 2.636 1.00 . A A . 20 VAL CG1 1 1 7 2628 1 1 20 VAL CG2 C -3.588 0.574 4.345 1.00 . A A . 20 VAL CG2 1 1 7 2629 1 1 20 VAL H H -4.263 -2.559 1.780 1.00 . A A . 20 VAL H 1 1 7 2630 1 1 20 VAL HA H -5.748 -0.460 3.187 1.00 . A A . 20 VAL HA 1 1 7 2631 1 1 20 VAL HB H -3.693 -1.522 4.131 1.00 . A A . 20 VAL HB 1 1 7 2632 1 1 20 VAL HG11 H -2.569 -0.302 1.685 1.00 . A A . 20 VAL HG11 1 1 7 2633 1 1 20 VAL HG12 H -2.225 -1.867 2.444 1.00 . A A . 20 VAL HG12 1 1 7 2634 1 1 20 VAL HG13 H -1.562 -0.379 3.143 1.00 . A A . 20 VAL HG13 1 1 7 2635 1 1 20 VAL HG21 H -2.711 0.539 4.972 1.00 . A A . 20 VAL HG21 1 1 7 2636 1 1 20 VAL HG22 H -4.472 0.624 4.963 1.00 . A A . 20 VAL HG22 1 1 7 2637 1 1 20 VAL HG23 H -3.543 1.445 3.708 1.00 . A A . 20 VAL HG23 1 1 7 2638 1 1 20 VAL N N -5.061 -2.030 2.002 1.00 . A A . 20 VAL N 1 1 7 2639 1 1 20 VAL O O -4.988 1.512 1.618 1.00 . A A . 20 VAL O 1 1 7 2640 1 1 21 LEU C C -5.077 1.494 -1.219 1.00 . A A . 21 LEU C 1 1 7 2641 1 1 21 LEU CA C -3.935 0.606 -0.784 1.00 . A A . 21 LEU CA 1 1 7 2642 1 1 21 LEU CB C -3.679 -0.384 -1.859 1.00 . A A . 21 LEU CB 1 1 7 2643 1 1 21 LEU CD1 C -2.455 0.948 -3.529 1.00 . A A . 21 LEU CD1 1 1 7 2644 1 1 21 LEU CD2 C -1.261 0.008 -1.548 1.00 . A A . 21 LEU CD2 1 1 7 2645 1 1 21 LEU CG C -2.369 -0.222 -2.566 1.00 . A A . 21 LEU CG 1 1 7 2646 1 1 21 LEU H H -3.955 -1.116 0.406 1.00 . A A . 21 LEU H 1 1 7 2647 1 1 21 LEU HA H -3.048 1.196 -0.627 1.00 . A A . 21 LEU HA 1 1 7 2648 1 1 21 LEU HB2 H -3.710 -1.365 -1.402 1.00 . A A . 21 LEU HB2 1 1 7 2649 1 1 21 LEU HB3 H -4.481 -0.312 -2.578 1.00 . A A . 21 LEU HB3 1 1 7 2650 1 1 21 LEU HD11 H -3.184 0.731 -4.295 1.00 . A A . 21 LEU HD11 1 1 7 2651 1 1 21 LEU HD12 H -1.491 1.119 -3.981 1.00 . A A . 21 LEU HD12 1 1 7 2652 1 1 21 LEU HD13 H -2.763 1.833 -2.982 1.00 . A A . 21 LEU HD13 1 1 7 2653 1 1 21 LEU HD21 H -1.504 -0.519 -0.630 1.00 . A A . 21 LEU HD21 1 1 7 2654 1 1 21 LEU HD22 H -1.172 1.067 -1.346 1.00 . A A . 21 LEU HD22 1 1 7 2655 1 1 21 LEU HD23 H -0.329 -0.365 -1.943 1.00 . A A . 21 LEU HD23 1 1 7 2656 1 1 21 LEU HG H -2.169 -1.129 -3.106 1.00 . A A . 21 LEU HG 1 1 7 2657 1 1 21 LEU N N -4.205 -0.164 0.401 1.00 . A A . 21 LEU N 1 1 7 2658 1 1 21 LEU O O -4.978 2.717 -1.177 1.00 . A A . 21 LEU O 1 1 7 2659 1 1 22 ALA C C -7.973 2.493 -1.200 1.00 . A A . 22 ALA C 1 1 7 2660 1 1 22 ALA CA C -7.335 1.540 -2.197 1.00 . A A . 22 ALA CA 1 1 7 2661 1 1 22 ALA CB C -8.350 0.516 -2.640 1.00 . A A . 22 ALA CB 1 1 7 2662 1 1 22 ALA H H -6.182 -0.119 -1.510 1.00 . A A . 22 ALA H 1 1 7 2663 1 1 22 ALA HA H -7.016 2.091 -3.065 1.00 . A A . 22 ALA HA 1 1 7 2664 1 1 22 ALA HB1 H -7.898 -0.147 -3.360 1.00 . A A . 22 ALA HB1 1 1 7 2665 1 1 22 ALA HB2 H -9.192 1.018 -3.088 1.00 . A A . 22 ALA HB2 1 1 7 2666 1 1 22 ALA HB3 H -8.679 -0.052 -1.783 1.00 . A A . 22 ALA HB3 1 1 7 2667 1 1 22 ALA N N -6.164 0.855 -1.617 1.00 . A A . 22 ALA N 1 1 7 2668 1 1 22 ALA O O -8.921 3.219 -1.494 1.00 . A A . 22 ALA O 1 1 7 2669 1 1 23 GLU C C -7.235 4.409 1.412 1.00 . A A . 23 GLU C 1 1 7 2670 1 1 23 GLU CA C -7.938 3.094 1.151 1.00 . A A . 23 GLU CA 1 1 7 2671 1 1 23 GLU CB C -7.651 2.145 2.271 1.00 . A A . 23 GLU CB 1 1 7 2672 1 1 23 GLU CD C -9.216 0.177 2.257 1.00 . A A . 23 GLU CD 1 1 7 2673 1 1 23 GLU CG C -7.873 0.720 1.826 1.00 . A A . 23 GLU CG 1 1 7 2674 1 1 23 GLU H H -6.607 1.912 0.072 1.00 . A A . 23 GLU H 1 1 7 2675 1 1 23 GLU HA H -8.995 3.234 1.056 1.00 . A A . 23 GLU HA 1 1 7 2676 1 1 23 GLU HB2 H -6.608 2.254 2.554 1.00 . A A . 23 GLU HB2 1 1 7 2677 1 1 23 GLU HB3 H -8.286 2.358 3.111 1.00 . A A . 23 GLU HB3 1 1 7 2678 1 1 23 GLU HG2 H -7.825 0.697 0.741 1.00 . A A . 23 GLU HG2 1 1 7 2679 1 1 23 GLU HG3 H -7.070 0.105 2.207 1.00 . A A . 23 GLU HG3 1 1 7 2680 1 1 23 GLU N N -7.426 2.440 -0.021 1.00 . A A . 23 GLU N 1 1 7 2681 1 1 23 GLU O O -7.852 5.430 1.683 1.00 . A A . 23 GLU O 1 1 7 2682 1 1 23 GLU OE1 O -9.416 -0.033 3.473 1.00 . A A . 23 GLU OE1 1 1 7 2683 1 1 23 GLU OE2 O -10.072 -0.063 1.385 1.00 . A A . 23 GLU OE2 1 1 7 2684 1 1 24 LYS C C -4.426 6.010 0.482 1.00 . A A . 24 LYS C 1 1 7 2685 1 1 24 LYS CA C -5.029 5.417 1.741 1.00 . A A . 24 LYS CA 1 1 7 2686 1 1 24 LYS CB C -3.900 4.873 2.592 1.00 . A A . 24 LYS CB 1 1 7 2687 1 1 24 LYS CD C -4.850 3.846 4.738 1.00 . A A . 24 LYS CD 1 1 7 2688 1 1 24 LYS CE C -6.083 4.720 4.711 1.00 . A A . 24 LYS CE 1 1 7 2689 1 1 24 LYS CG C -4.272 3.609 3.356 1.00 . A A . 24 LYS CG 1 1 7 2690 1 1 24 LYS H H -5.513 3.433 1.284 1.00 . A A . 24 LYS H 1 1 7 2691 1 1 24 LYS HA H -5.562 6.172 2.284 1.00 . A A . 24 LYS HA 1 1 7 2692 1 1 24 LYS HB2 H -3.067 4.642 1.946 1.00 . A A . 24 LYS HB2 1 1 7 2693 1 1 24 LYS HB3 H -3.599 5.617 3.276 1.00 . A A . 24 LYS HB3 1 1 7 2694 1 1 24 LYS HD2 H -5.126 2.879 5.147 1.00 . A A . 24 LYS HD2 1 1 7 2695 1 1 24 LYS HD3 H -4.098 4.305 5.364 1.00 . A A . 24 LYS HD3 1 1 7 2696 1 1 24 LYS HE2 H -5.813 5.693 4.324 1.00 . A A . 24 LYS HE2 1 1 7 2697 1 1 24 LYS HE3 H -6.804 4.262 4.056 1.00 . A A . 24 LYS HE3 1 1 7 2698 1 1 24 LYS HG2 H -5.007 3.066 2.771 1.00 . A A . 24 LYS HG2 1 1 7 2699 1 1 24 LYS HG3 H -3.392 3.000 3.454 1.00 . A A . 24 LYS HG3 1 1 7 2700 1 1 24 LYS HZ1 H -7.512 5.508 6.016 1.00 . A A . 24 LYS HZ1 1 1 7 2701 1 1 24 LYS HZ2 H -5.978 5.302 6.714 1.00 . A A . 24 LYS HZ2 1 1 7 2702 1 1 24 LYS HZ3 H -6.975 3.955 6.434 1.00 . A A . 24 LYS HZ3 1 1 7 2703 1 1 24 LYS N N -5.916 4.311 1.444 1.00 . A A . 24 LYS N 1 1 7 2704 1 1 24 LYS NZ N -6.678 4.883 6.062 1.00 . A A . 24 LYS NZ 1 1 7 2705 1 1 24 LYS O O -4.490 7.208 0.228 1.00 . A A . 24 LYS O 1 1 7 2706 1 1 25 TYR C C -3.742 5.654 -2.627 1.00 . A A . 25 TYR C 1 1 7 2707 1 1 25 TYR CA C -2.945 5.480 -1.361 1.00 . A A . 25 TYR CA 1 1 7 2708 1 1 25 TYR CB C -1.966 4.340 -1.585 1.00 . A A . 25 TYR CB 1 1 7 2709 1 1 25 TYR CD1 C -2.030 3.138 0.516 1.00 . A A . 25 TYR CD1 1 1 7 2710 1 1 25 TYR CD2 C 0.058 4.060 -0.102 1.00 . A A . 25 TYR CD2 1 1 7 2711 1 1 25 TYR CE1 C -1.495 2.619 1.638 1.00 . A A . 25 TYR CE1 1 1 7 2712 1 1 25 TYR CE2 C 0.630 3.545 1.047 1.00 . A A . 25 TYR CE2 1 1 7 2713 1 1 25 TYR CG C -1.287 3.854 -0.362 1.00 . A A . 25 TYR CG 1 1 7 2714 1 1 25 TYR CZ C -0.157 2.820 1.923 1.00 . A A . 25 TYR CZ 1 1 7 2715 1 1 25 TYR H H -3.964 4.176 -0.101 1.00 . A A . 25 TYR H 1 1 7 2716 1 1 25 TYR HA H -2.419 6.375 -1.091 1.00 . A A . 25 TYR HA 1 1 7 2717 1 1 25 TYR HB2 H -2.525 3.501 -1.947 1.00 . A A . 25 TYR HB2 1 1 7 2718 1 1 25 TYR HB3 H -1.230 4.619 -2.299 1.00 . A A . 25 TYR HB3 1 1 7 2719 1 1 25 TYR HD1 H -3.088 3.000 0.306 1.00 . A A . 25 TYR HD1 1 1 7 2720 1 1 25 TYR HD2 H 0.655 4.629 -0.799 1.00 . A A . 25 TYR HD2 1 1 7 2721 1 1 25 TYR HE1 H -2.130 2.068 2.281 1.00 . A A . 25 TYR HE1 1 1 7 2722 1 1 25 TYR HE2 H 1.679 3.708 1.253 1.00 . A A . 25 TYR HE2 1 1 7 2723 1 1 25 TYR HH H 0.961 2.950 3.480 1.00 . A A . 25 TYR HH 1 1 7 2724 1 1 25 TYR N N -3.819 5.124 -0.278 1.00 . A A . 25 TYR N 1 1 7 2725 1 1 25 TYR O O -3.720 6.699 -3.280 1.00 . A A . 25 TYR O 1 1 7 2726 1 1 25 TYR OH O 0.392 2.292 3.069 1.00 . A A . 25 TYR OH 1 1 7 2727 1 1 26 ALA C C -6.547 5.360 -3.861 1.00 . A A . 26 ALA C 1 1 7 2728 1 1 26 ALA CA C -5.298 4.540 -4.126 1.00 . A A . 26 ALA CA 1 1 7 2729 1 1 26 ALA CB C -5.656 3.106 -4.447 1.00 . A A . 26 ALA CB 1 1 7 2730 1 1 26 ALA H H -4.382 3.767 -2.378 1.00 . A A . 26 ALA H 1 1 7 2731 1 1 26 ALA HA H -4.762 4.962 -4.964 1.00 . A A . 26 ALA HA 1 1 7 2732 1 1 26 ALA HB1 H -4.757 2.550 -4.664 1.00 . A A . 26 ALA HB1 1 1 7 2733 1 1 26 ALA HB2 H -6.316 3.078 -5.300 1.00 . A A . 26 ALA HB2 1 1 7 2734 1 1 26 ALA HB3 H -6.150 2.668 -3.589 1.00 . A A . 26 ALA HB3 1 1 7 2735 1 1 26 ALA N N -4.440 4.577 -2.962 1.00 . A A . 26 ALA N 1 1 7 2736 1 1 26 ALA O O -7.305 5.678 -4.774 1.00 . A A . 26 ALA O 1 1 7 2737 1 1 27 ASN C C -7.868 7.821 -2.996 1.00 . A A . 27 ASN C 1 1 7 2738 1 1 27 ASN CA C -7.797 6.568 -2.131 1.00 . A A . 27 ASN CA 1 1 7 2739 1 1 27 ASN CB C -7.520 6.962 -0.685 1.00 . A A . 27 ASN CB 1 1 7 2740 1 1 27 ASN CG C -8.515 7.978 -0.140 1.00 . A A . 27 ASN CG 1 1 7 2741 1 1 27 ASN H H -6.164 5.242 -1.907 1.00 . A A . 27 ASN H 1 1 7 2742 1 1 27 ASN HA H -8.739 6.047 -2.183 1.00 . A A . 27 ASN HA 1 1 7 2743 1 1 27 ASN HB2 H -7.560 6.073 -0.070 1.00 . A A . 27 ASN HB2 1 1 7 2744 1 1 27 ASN HB3 H -6.526 7.380 -0.620 1.00 . A A . 27 ASN HB3 1 1 7 2745 1 1 27 ASN HD21 H -7.309 9.478 -0.649 1.00 . A A . 27 ASN HD21 1 1 7 2746 1 1 27 ASN HD22 H -8.818 9.931 0.078 1.00 . A A . 27 ASN HD22 1 1 7 2747 1 1 27 ASN N N -6.747 5.662 -2.584 1.00 . A A . 27 ASN N 1 1 7 2748 1 1 27 ASN ND2 N -8.179 9.256 -0.239 1.00 . A A . 27 ASN ND2 1 1 7 2749 1 1 27 ASN O O -8.834 7.956 -3.776 1.00 . A A . 27 ASN O 1 1 7 2750 1 1 27 ASN OXT O -6.953 8.662 -2.905 1.00 . A A . 27 ASN OXT 1 1 7 2751 1 1 27 ASN OD1 O -9.565 7.615 0.390 1.00 . A A . 27 ASN OD1 1 1 8 2752 1 1 1 GLY C C 12.743 2.534 3.132 1.00 . A A . 1 GLY C 1 1 8 2753 1 1 1 GLY CA C 13.247 2.434 1.705 1.00 . A A . 1 GLY CA 1 1 8 2754 1 1 1 GLY H1 H 14.701 3.237 0.450 1.00 . A A . 1 GLY H1 1 1 8 2755 1 1 1 GLY H2 H 15.186 3.101 2.070 1.00 . A A . 1 GLY H2 1 1 8 2756 1 1 1 GLY H3 H 14.111 4.325 1.608 1.00 . A A . 1 GLY H3 1 1 8 2757 1 1 1 GLY HA2 H 12.442 2.685 1.031 1.00 . A A . 1 GLY HA2 1 1 8 2758 1 1 1 GLY HA3 H 13.559 1.418 1.513 1.00 . A A . 1 GLY HA3 1 1 8 2759 1 1 1 GLY N N 14.390 3.337 1.440 1.00 . A A . 1 GLY N 1 1 8 2760 1 1 1 GLY O O 13.471 2.229 4.077 1.00 . A A . 1 GLY O 1 1 8 2761 1 1 2 ILE C C 9.886 1.901 4.739 1.00 . A A . 2 ILE C 1 1 8 2762 1 1 2 ILE CA C 10.868 3.048 4.586 1.00 . A A . 2 ILE CA 1 1 8 2763 1 1 2 ILE CB C 10.112 4.385 4.766 1.00 . A A . 2 ILE CB 1 1 8 2764 1 1 2 ILE CD1 C 12.179 5.491 5.782 1.00 . A A . 2 ILE CD1 1 1 8 2765 1 1 2 ILE CG1 C 11.083 5.568 4.739 1.00 . A A . 2 ILE CG1 1 1 8 2766 1 1 2 ILE CG2 C 9.301 4.372 6.048 1.00 . A A . 2 ILE CG2 1 1 8 2767 1 1 2 ILE H H 10.991 3.256 2.496 1.00 . A A . 2 ILE H 1 1 8 2768 1 1 2 ILE HA H 11.632 2.973 5.346 1.00 . A A . 2 ILE HA 1 1 8 2769 1 1 2 ILE HB H 9.420 4.486 3.942 1.00 . A A . 2 ILE HB 1 1 8 2770 1 1 2 ILE HD11 H 11.735 5.441 6.765 1.00 . A A . 2 ILE HD11 1 1 8 2771 1 1 2 ILE HD12 H 12.804 6.367 5.712 1.00 . A A . 2 ILE HD12 1 1 8 2772 1 1 2 ILE HD13 H 12.776 4.607 5.612 1.00 . A A . 2 ILE HD13 1 1 8 2773 1 1 2 ILE HG12 H 11.553 5.610 3.767 1.00 . A A . 2 ILE HG12 1 1 8 2774 1 1 2 ILE HG13 H 10.532 6.481 4.904 1.00 . A A . 2 ILE HG13 1 1 8 2775 1 1 2 ILE HG21 H 8.564 3.581 5.988 1.00 . A A . 2 ILE HG21 1 1 8 2776 1 1 2 ILE HG22 H 8.808 5.321 6.170 1.00 . A A . 2 ILE HG22 1 1 8 2777 1 1 2 ILE HG23 H 9.957 4.190 6.884 1.00 . A A . 2 ILE HG23 1 1 8 2778 1 1 2 ILE N N 11.501 2.974 3.285 1.00 . A A . 2 ILE N 1 1 8 2779 1 1 2 ILE O O 10.155 0.913 5.419 1.00 . A A . 2 ILE O 1 1 8 2780 1 1 3 GLY C C 6.432 1.496 3.590 1.00 . A A . 3 GLY C 1 1 8 2781 1 1 3 GLY CA C 7.761 1.002 4.098 1.00 . A A . 3 GLY CA 1 1 8 2782 1 1 3 GLY H H 8.572 2.868 3.602 1.00 . A A . 3 GLY H 1 1 8 2783 1 1 3 GLY HA2 H 8.103 0.195 3.472 1.00 . A A . 3 GLY HA2 1 1 8 2784 1 1 3 GLY HA3 H 7.641 0.641 5.108 1.00 . A A . 3 GLY HA3 1 1 8 2785 1 1 3 GLY N N 8.750 2.039 4.084 1.00 . A A . 3 GLY N 1 1 8 2786 1 1 3 GLY O O 6.136 1.391 2.395 1.00 . A A . 3 GLY O 1 1 8 2787 1 1 4 GLY C C 4.374 3.922 3.446 1.00 . A A . 4 GLY C 1 1 8 2788 1 1 4 GLY CA C 4.336 2.586 4.155 1.00 . A A . 4 GLY CA 1 1 8 2789 1 1 4 GLY H H 6.024 2.255 5.388 1.00 . A A . 4 GLY H 1 1 8 2790 1 1 4 GLY HA2 H 3.855 1.861 3.517 1.00 . A A . 4 GLY HA2 1 1 8 2791 1 1 4 GLY HA3 H 3.763 2.688 5.065 1.00 . A A . 4 GLY HA3 1 1 8 2792 1 1 4 GLY N N 5.667 2.107 4.485 1.00 . A A . 4 GLY N 1 1 8 2793 1 1 4 GLY O O 3.610 4.834 3.763 1.00 . A A . 4 GLY O 1 1 8 2794 1 1 5 VAL C C 5.104 5.028 0.269 1.00 . A A . 5 VAL C 1 1 8 2795 1 1 5 VAL CA C 5.474 5.250 1.737 1.00 . A A . 5 VAL CA 1 1 8 2796 1 1 5 VAL CB C 6.935 5.736 1.880 1.00 . A A . 5 VAL CB 1 1 8 2797 1 1 5 VAL CG1 C 7.903 4.560 1.844 1.00 . A A . 5 VAL CG1 1 1 8 2798 1 1 5 VAL CG2 C 7.280 6.740 0.799 1.00 . A A . 5 VAL CG2 1 1 8 2799 1 1 5 VAL H H 5.842 3.256 2.293 1.00 . A A . 5 VAL H 1 1 8 2800 1 1 5 VAL HA H 4.826 6.008 2.151 1.00 . A A . 5 VAL HA 1 1 8 2801 1 1 5 VAL HB H 7.037 6.223 2.838 1.00 . A A . 5 VAL HB 1 1 8 2802 1 1 5 VAL HG11 H 7.643 3.860 2.625 1.00 . A A . 5 VAL HG11 1 1 8 2803 1 1 5 VAL HG12 H 8.913 4.917 2.002 1.00 . A A . 5 VAL HG12 1 1 8 2804 1 1 5 VAL HG13 H 7.838 4.068 0.885 1.00 . A A . 5 VAL HG13 1 1 8 2805 1 1 5 VAL HG21 H 7.266 6.242 -0.162 1.00 . A A . 5 VAL HG21 1 1 8 2806 1 1 5 VAL HG22 H 8.263 7.147 0.983 1.00 . A A . 5 VAL HG22 1 1 8 2807 1 1 5 VAL HG23 H 6.551 7.536 0.804 1.00 . A A . 5 VAL HG23 1 1 8 2808 1 1 5 VAL N N 5.279 4.031 2.494 1.00 . A A . 5 VAL N 1 1 8 2809 1 1 5 VAL O O 4.288 5.761 -0.295 1.00 . A A . 5 VAL O 1 1 8 2810 1 1 6 LEU C C 6.207 2.337 -1.985 1.00 . A A . 6 LEU C 1 1 8 2811 1 1 6 LEU CA C 5.416 3.595 -1.699 1.00 . A A . 6 LEU CA 1 1 8 2812 1 1 6 LEU CB C 5.759 4.735 -2.704 1.00 . A A . 6 LEU CB 1 1 8 2813 1 1 6 LEU CD1 C 8.166 5.015 -1.900 1.00 . A A . 6 LEU CD1 1 1 8 2814 1 1 6 LEU CD2 C 7.716 3.964 -4.136 1.00 . A A . 6 LEU CD2 1 1 8 2815 1 1 6 LEU CG C 7.239 4.979 -3.102 1.00 . A A . 6 LEU CG 1 1 8 2816 1 1 6 LEU H H 6.283 3.434 0.216 1.00 . A A . 6 LEU H 1 1 8 2817 1 1 6 LEU HA H 4.363 3.363 -1.779 1.00 . A A . 6 LEU HA 1 1 8 2818 1 1 6 LEU HB2 H 5.212 4.544 -3.613 1.00 . A A . 6 LEU HB2 1 1 8 2819 1 1 6 LEU HB3 H 5.382 5.655 -2.281 1.00 . A A . 6 LEU HB3 1 1 8 2820 1 1 6 LEU HD11 H 8.011 4.131 -1.295 1.00 . A A . 6 LEU HD11 1 1 8 2821 1 1 6 LEU HD12 H 7.955 5.895 -1.308 1.00 . A A . 6 LEU HD12 1 1 8 2822 1 1 6 LEU HD13 H 9.191 5.044 -2.237 1.00 . A A . 6 LEU HD13 1 1 8 2823 1 1 6 LEU HD21 H 7.103 4.038 -5.020 1.00 . A A . 6 LEU HD21 1 1 8 2824 1 1 6 LEU HD22 H 7.639 2.968 -3.726 1.00 . A A . 6 LEU HD22 1 1 8 2825 1 1 6 LEU HD23 H 8.746 4.170 -4.393 1.00 . A A . 6 LEU HD23 1 1 8 2826 1 1 6 LEU HG H 7.297 5.954 -3.567 1.00 . A A . 6 LEU HG 1 1 8 2827 1 1 6 LEU N N 5.676 3.983 -0.314 1.00 . A A . 6 LEU N 1 1 8 2828 1 1 6 LEU O O 5.878 1.553 -2.868 1.00 . A A . 6 LEU O 1 1 8 2829 1 1 7 LEU C C 7.435 -0.290 -1.078 1.00 . A A . 7 LEU C 1 1 8 2830 1 1 7 LEU CA C 8.157 1.031 -1.339 1.00 . A A . 7 LEU CA 1 1 8 2831 1 1 7 LEU CB C 9.348 1.194 -0.388 1.00 . A A . 7 LEU CB 1 1 8 2832 1 1 7 LEU CD1 C 10.443 -0.920 -1.186 1.00 . A A . 7 LEU CD1 1 1 8 2833 1 1 7 LEU CD2 C 11.186 1.307 -2.038 1.00 . A A . 7 LEU CD2 1 1 8 2834 1 1 7 LEU CG C 10.648 0.545 -0.849 1.00 . A A . 7 LEU CG 1 1 8 2835 1 1 7 LEU H H 7.434 2.833 -0.500 1.00 . A A . 7 LEU H 1 1 8 2836 1 1 7 LEU HA H 8.521 1.032 -2.355 1.00 . A A . 7 LEU HA 1 1 8 2837 1 1 7 LEU HB2 H 9.539 2.251 -0.276 1.00 . A A . 7 LEU HB2 1 1 8 2838 1 1 7 LEU HB3 H 9.080 0.782 0.573 1.00 . A A . 7 LEU HB3 1 1 8 2839 1 1 7 LEU HD11 H 10.375 -1.495 -0.277 1.00 . A A . 7 LEU HD11 1 1 8 2840 1 1 7 LEU HD12 H 11.270 -1.276 -1.783 1.00 . A A . 7 LEU HD12 1 1 8 2841 1 1 7 LEU HD13 H 9.517 -1.032 -1.746 1.00 . A A . 7 LEU HD13 1 1 8 2842 1 1 7 LEU HD21 H 10.594 1.078 -2.910 1.00 . A A . 7 LEU HD21 1 1 8 2843 1 1 7 LEU HD22 H 12.216 1.036 -2.213 1.00 . A A . 7 LEU HD22 1 1 8 2844 1 1 7 LEU HD23 H 11.116 2.366 -1.830 1.00 . A A . 7 LEU HD23 1 1 8 2845 1 1 7 LEU HG H 11.376 0.608 -0.055 1.00 . A A . 7 LEU HG 1 1 8 2846 1 1 7 LEU N N 7.253 2.159 -1.191 1.00 . A A . 7 LEU N 1 1 8 2847 1 1 7 LEU O O 7.113 -1.025 -2.009 1.00 . A A . 7 LEU O 1 1 8 2848 1 1 8 SER C C 5.026 -1.608 0.592 1.00 . A A . 8 SER C 1 1 8 2849 1 1 8 SER CA C 6.506 -1.853 0.501 1.00 . A A . 8 SER CA 1 1 8 2850 1 1 8 SER CB C 7.049 -2.470 1.782 1.00 . A A . 8 SER CB 1 1 8 2851 1 1 8 SER H H 7.312 0.074 0.888 1.00 . A A . 8 SER H 1 1 8 2852 1 1 8 SER HA H 6.690 -2.528 -0.323 1.00 . A A . 8 SER HA 1 1 8 2853 1 1 8 SER HB2 H 6.498 -3.377 1.991 1.00 . A A . 8 SER HB2 1 1 8 2854 1 1 8 SER HB3 H 8.094 -2.711 1.644 1.00 . A A . 8 SER HB3 1 1 8 2855 1 1 8 SER HG H 7.054 -2.068 3.699 1.00 . A A . 8 SER HG 1 1 8 2856 1 1 8 SER N N 7.151 -0.588 0.180 1.00 . A A . 8 SER N 1 1 8 2857 1 1 8 SER O O 4.213 -2.528 0.605 1.00 . A A . 8 SER O 1 1 8 2858 1 1 8 SER OG O 6.921 -1.581 2.875 1.00 . A A . 8 SER OG 1 1 8 2859 1 1 9 ALA C C 3.009 -0.288 -1.062 1.00 . A A . 9 ALA C 1 1 8 2860 1 1 9 ALA CA C 3.385 0.159 0.343 1.00 . A A . 9 ALA CA 1 1 8 2861 1 1 9 ALA CB C 3.398 1.667 0.442 1.00 . A A . 9 ALA CB 1 1 8 2862 1 1 9 ALA H H 5.389 0.313 0.926 1.00 . A A . 9 ALA H 1 1 8 2863 1 1 9 ALA HA H 2.685 -0.240 1.061 1.00 . A A . 9 ALA HA 1 1 8 2864 1 1 9 ALA HB1 H 4.313 2.039 -0.010 1.00 . A A . 9 ALA HB1 1 1 8 2865 1 1 9 ALA HB2 H 3.365 1.958 1.481 1.00 . A A . 9 ALA HB2 1 1 8 2866 1 1 9 ALA HB3 H 2.545 2.071 -0.079 1.00 . A A . 9 ALA HB3 1 1 8 2867 1 1 9 ALA N N 4.706 -0.328 0.647 1.00 . A A . 9 ALA N 1 1 8 2868 1 1 9 ALA O O 1.838 -0.300 -1.440 1.00 . A A . 9 ALA O 1 1 8 2869 1 1 10 GLY C C 3.891 -2.773 -2.988 1.00 . A A . 10 GLY C 1 1 8 2870 1 1 10 GLY CA C 3.798 -1.272 -3.112 1.00 . A A . 10 GLY CA 1 1 8 2871 1 1 10 GLY H H 4.960 -0.457 -1.549 1.00 . A A . 10 GLY H 1 1 8 2872 1 1 10 GLY HA2 H 2.817 -1.009 -3.460 1.00 . A A . 10 GLY HA2 1 1 8 2873 1 1 10 GLY HA3 H 4.536 -0.930 -3.820 1.00 . A A . 10 GLY HA3 1 1 8 2874 1 1 10 GLY N N 4.031 -0.634 -1.845 1.00 . A A . 10 GLY N 1 1 8 2875 1 1 10 GLY O O 2.914 -3.486 -3.203 1.00 . A A . 10 GLY O 1 1 8 2876 1 1 11 LYS C C 4.334 -5.453 -1.713 1.00 . A A . 11 LYS C 1 1 8 2877 1 1 11 LYS CA C 5.398 -4.638 -2.437 1.00 . A A . 11 LYS CA 1 1 8 2878 1 1 11 LYS CB C 6.667 -4.716 -1.643 1.00 . A A . 11 LYS CB 1 1 8 2879 1 1 11 LYS CD C 8.963 -3.862 -1.457 1.00 . A A . 11 LYS CD 1 1 8 2880 1 1 11 LYS CE C 8.940 -4.652 -0.164 1.00 . A A . 11 LYS CE 1 1 8 2881 1 1 11 LYS CG C 7.922 -4.382 -2.410 1.00 . A A . 11 LYS CG 1 1 8 2882 1 1 11 LYS H H 5.772 -2.571 -2.358 1.00 . A A . 11 LYS H 1 1 8 2883 1 1 11 LYS HA H 5.567 -5.054 -3.410 1.00 . A A . 11 LYS HA 1 1 8 2884 1 1 11 LYS HB2 H 6.588 -4.007 -0.829 1.00 . A A . 11 LYS HB2 1 1 8 2885 1 1 11 LYS HB3 H 6.767 -5.713 -1.237 1.00 . A A . 11 LYS HB3 1 1 8 2886 1 1 11 LYS HD2 H 9.940 -3.945 -1.911 1.00 . A A . 11 LYS HD2 1 1 8 2887 1 1 11 LYS HD3 H 8.742 -2.827 -1.241 1.00 . A A . 11 LYS HD3 1 1 8 2888 1 1 11 LYS HE2 H 9.503 -4.116 0.587 1.00 . A A . 11 LYS HE2 1 1 8 2889 1 1 11 LYS HE3 H 7.900 -4.735 0.146 1.00 . A A . 11 LYS HE3 1 1 8 2890 1 1 11 LYS HG2 H 8.293 -5.271 -2.894 1.00 . A A . 11 LYS HG2 1 1 8 2891 1 1 11 LYS HG3 H 7.699 -3.623 -3.143 1.00 . A A . 11 LYS HG3 1 1 8 2892 1 1 11 LYS HZ1 H 9.168 -6.450 -1.206 1.00 . A A . 11 LYS HZ1 1 1 8 2893 1 1 11 LYS HZ2 H 9.224 -6.623 0.474 1.00 . A A . 11 LYS HZ2 1 1 8 2894 1 1 11 LYS HZ3 H 10.553 -5.965 -0.355 1.00 . A A . 11 LYS HZ3 1 1 8 2895 1 1 11 LYS N N 5.069 -3.226 -2.580 1.00 . A A . 11 LYS N 1 1 8 2896 1 1 11 LYS NZ N 9.510 -6.016 -0.324 1.00 . A A . 11 LYS NZ 1 1 8 2897 1 1 11 LYS O O 3.833 -6.452 -2.229 1.00 . A A . 11 LYS O 1 1 8 2898 1 1 12 ALA C C 1.669 -5.625 -0.232 1.00 . A A . 12 ALA C 1 1 8 2899 1 1 12 ALA CA C 3.077 -5.792 0.308 1.00 . A A . 12 ALA CA 1 1 8 2900 1 1 12 ALA CB C 3.158 -5.345 1.759 1.00 . A A . 12 ALA CB 1 1 8 2901 1 1 12 ALA H H 4.405 -4.218 -0.146 1.00 . A A . 12 ALA H 1 1 8 2902 1 1 12 ALA HA H 3.355 -6.835 0.258 1.00 . A A . 12 ALA HA 1 1 8 2903 1 1 12 ALA HB1 H 4.168 -5.470 2.120 1.00 . A A . 12 ALA HB1 1 1 8 2904 1 1 12 ALA HB2 H 2.485 -5.940 2.355 1.00 . A A . 12 ALA HB2 1 1 8 2905 1 1 12 ALA HB3 H 2.877 -4.304 1.830 1.00 . A A . 12 ALA HB3 1 1 8 2906 1 1 12 ALA N N 4.012 -5.045 -0.502 1.00 . A A . 12 ALA N 1 1 8 2907 1 1 12 ALA O O 0.814 -6.492 -0.051 1.00 . A A . 12 ALA O 1 1 8 2908 1 1 13 ALA C C -0.309 -5.152 -2.538 1.00 . A A . 13 ALA C 1 1 8 2909 1 1 13 ALA CA C 0.114 -4.207 -1.436 1.00 . A A . 13 ALA CA 1 1 8 2910 1 1 13 ALA CB C 0.001 -2.767 -1.904 1.00 . A A . 13 ALA CB 1 1 8 2911 1 1 13 ALA H H 2.202 -3.942 -1.163 1.00 . A A . 13 ALA H 1 1 8 2912 1 1 13 ALA HA H -0.571 -4.334 -0.608 1.00 . A A . 13 ALA HA 1 1 8 2913 1 1 13 ALA HB1 H 0.449 -2.113 -1.171 1.00 . A A . 13 ALA HB1 1 1 8 2914 1 1 13 ALA HB2 H -1.053 -2.510 -2.020 1.00 . A A . 13 ALA HB2 1 1 8 2915 1 1 13 ALA HB3 H 0.509 -2.653 -2.851 1.00 . A A . 13 ALA HB3 1 1 8 2916 1 1 13 ALA N N 1.446 -4.530 -0.945 1.00 . A A . 13 ALA N 1 1 8 2917 1 1 13 ALA O O -1.473 -5.533 -2.599 1.00 . A A . 13 ALA O 1 1 8 2918 1 1 14 LEU C C -0.343 -7.731 -3.839 1.00 . A A . 14 LEU C 1 1 8 2919 1 1 14 LEU CA C 0.306 -6.509 -4.456 1.00 . A A . 14 LEU CA 1 1 8 2920 1 1 14 LEU CB C 1.543 -6.981 -5.244 1.00 . A A . 14 LEU CB 1 1 8 2921 1 1 14 LEU CD1 C 1.628 -4.640 -6.203 1.00 . A A . 14 LEU CD1 1 1 8 2922 1 1 14 LEU CD2 C 3.650 -5.644 -5.106 1.00 . A A . 14 LEU CD2 1 1 8 2923 1 1 14 LEU CG C 2.407 -5.916 -5.931 1.00 . A A . 14 LEU CG 1 1 8 2924 1 1 14 LEU H H 1.544 -5.205 -3.316 1.00 . A A . 14 LEU H 1 1 8 2925 1 1 14 LEU HA H -0.395 -6.039 -5.132 1.00 . A A . 14 LEU HA 1 1 8 2926 1 1 14 LEU HB2 H 2.178 -7.526 -4.563 1.00 . A A . 14 LEU HB2 1 1 8 2927 1 1 14 LEU HB3 H 1.203 -7.672 -6.006 1.00 . A A . 14 LEU HB3 1 1 8 2928 1 1 14 LEU HD11 H 2.282 -3.910 -6.655 1.00 . A A . 14 LEU HD11 1 1 8 2929 1 1 14 LEU HD12 H 1.238 -4.251 -5.274 1.00 . A A . 14 LEU HD12 1 1 8 2930 1 1 14 LEU HD13 H 0.810 -4.854 -6.876 1.00 . A A . 14 LEU HD13 1 1 8 2931 1 1 14 LEU HD21 H 4.304 -4.972 -5.641 1.00 . A A . 14 LEU HD21 1 1 8 2932 1 1 14 LEU HD22 H 4.163 -6.576 -4.912 1.00 . A A . 14 LEU HD22 1 1 8 2933 1 1 14 LEU HD23 H 3.365 -5.193 -4.163 1.00 . A A . 14 LEU HD23 1 1 8 2934 1 1 14 LEU HG H 2.732 -6.303 -6.886 1.00 . A A . 14 LEU HG 1 1 8 2935 1 1 14 LEU N N 0.630 -5.554 -3.395 1.00 . A A . 14 LEU N 1 1 8 2936 1 1 14 LEU O O -1.211 -8.365 -4.439 1.00 . A A . 14 LEU O 1 1 8 2937 1 1 15 LYS C C -1.557 -8.929 -1.026 1.00 . A A . 15 LYS C 1 1 8 2938 1 1 15 LYS CA C -0.384 -9.233 -1.953 1.00 . A A . 15 LYS CA 1 1 8 2939 1 1 15 LYS CB C 0.784 -9.796 -1.159 1.00 . A A . 15 LYS CB 1 1 8 2940 1 1 15 LYS CD C 1.929 -10.785 -3.158 1.00 . A A . 15 LYS CD 1 1 8 2941 1 1 15 LYS CE C 1.607 -12.194 -2.705 1.00 . A A . 15 LYS CE 1 1 8 2942 1 1 15 LYS CG C 2.060 -9.852 -1.973 1.00 . A A . 15 LYS CG 1 1 8 2943 1 1 15 LYS H H 0.725 -7.466 -2.165 1.00 . A A . 15 LYS H 1 1 8 2944 1 1 15 LYS HA H -0.675 -9.948 -2.697 1.00 . A A . 15 LYS HA 1 1 8 2945 1 1 15 LYS HB2 H 0.957 -9.157 -0.309 1.00 . A A . 15 LYS HB2 1 1 8 2946 1 1 15 LYS HB3 H 0.543 -10.793 -0.820 1.00 . A A . 15 LYS HB3 1 1 8 2947 1 1 15 LYS HD2 H 1.134 -10.424 -3.792 1.00 . A A . 15 LYS HD2 1 1 8 2948 1 1 15 LYS HD3 H 2.859 -10.791 -3.706 1.00 . A A . 15 LYS HD3 1 1 8 2949 1 1 15 LYS HE2 H 0.786 -12.135 -2.013 1.00 . A A . 15 LYS HE2 1 1 8 2950 1 1 15 LYS HE3 H 1.322 -12.786 -3.565 1.00 . A A . 15 LYS HE3 1 1 8 2951 1 1 15 LYS HG2 H 2.259 -8.864 -2.341 1.00 . A A . 15 LYS HG2 1 1 8 2952 1 1 15 LYS HG3 H 2.873 -10.182 -1.343 1.00 . A A . 15 LYS HG3 1 1 8 2953 1 1 15 LYS HZ1 H 3.546 -12.982 -2.698 1.00 . A A . 15 LYS HZ1 1 1 8 2954 1 1 15 LYS HZ2 H 2.480 -13.759 -1.632 1.00 . A A . 15 LYS HZ2 1 1 8 2955 1 1 15 LYS HZ3 H 3.103 -12.231 -1.245 1.00 . A A . 15 LYS HZ3 1 1 8 2956 1 1 15 LYS N N 0.077 -8.047 -2.623 1.00 . A A . 15 LYS N 1 1 8 2957 1 1 15 LYS NZ N 2.762 -12.838 -2.024 1.00 . A A . 15 LYS NZ 1 1 8 2958 1 1 15 LYS O O -2.700 -9.291 -1.307 1.00 . A A . 15 LYS O 1 1 8 2959 1 1 16 GLY C C -2.693 -6.512 0.986 1.00 . A A . 16 GLY C 1 1 8 2960 1 1 16 GLY CA C -2.270 -7.935 1.050 1.00 . A A . 16 GLY CA 1 1 8 2961 1 1 16 GLY H H -0.376 -7.840 0.167 1.00 . A A . 16 GLY H 1 1 8 2962 1 1 16 GLY HA2 H -3.125 -8.566 0.887 1.00 . A A . 16 GLY HA2 1 1 8 2963 1 1 16 GLY HA3 H -1.876 -8.122 2.032 1.00 . A A . 16 GLY HA3 1 1 8 2964 1 1 16 GLY N N -1.267 -8.234 0.066 1.00 . A A . 16 GLY N 1 1 8 2965 1 1 16 GLY O O -3.832 -6.202 0.666 1.00 . A A . 16 GLY O 1 1 8 2966 1 1 17 LEU C C -2.616 -3.472 0.466 1.00 . A A . 17 LEU C 1 1 8 2967 1 1 17 LEU CA C -1.904 -4.255 1.556 1.00 . A A . 17 LEU CA 1 1 8 2968 1 1 17 LEU CB C -0.579 -3.579 1.923 1.00 . A A . 17 LEU CB 1 1 8 2969 1 1 17 LEU CD1 C -1.087 -3.341 4.381 1.00 . A A . 17 LEU CD1 1 1 8 2970 1 1 17 LEU CD2 C 0.216 -5.315 3.590 1.00 . A A . 17 LEU CD2 1 1 8 2971 1 1 17 LEU CG C -0.077 -3.840 3.357 1.00 . A A . 17 LEU CG 1 1 8 2972 1 1 17 LEU H H -0.799 -5.996 1.261 1.00 . A A . 17 LEU H 1 1 8 2973 1 1 17 LEU HA H -2.526 -4.232 2.431 1.00 . A A . 17 LEU HA 1 1 8 2974 1 1 17 LEU HB2 H 0.178 -3.918 1.227 1.00 . A A . 17 LEU HB2 1 1 8 2975 1 1 17 LEU HB3 H -0.710 -2.512 1.806 1.00 . A A . 17 LEU HB3 1 1 8 2976 1 1 17 LEU HD11 H -1.221 -2.275 4.265 1.00 . A A . 17 LEU HD11 1 1 8 2977 1 1 17 LEU HD12 H -0.725 -3.554 5.377 1.00 . A A . 17 LEU HD12 1 1 8 2978 1 1 17 LEU HD13 H -2.033 -3.839 4.227 1.00 . A A . 17 LEU HD13 1 1 8 2979 1 1 17 LEU HD21 H -0.681 -5.892 3.421 1.00 . A A . 17 LEU HD21 1 1 8 2980 1 1 17 LEU HD22 H 0.550 -5.459 4.606 1.00 . A A . 17 LEU HD22 1 1 8 2981 1 1 17 LEU HD23 H 0.988 -5.642 2.907 1.00 . A A . 17 LEU HD23 1 1 8 2982 1 1 17 LEU HG H 0.843 -3.293 3.508 1.00 . A A . 17 LEU HG 1 1 8 2983 1 1 17 LEU N N -1.710 -5.656 1.255 1.00 . A A . 17 LEU N 1 1 8 2984 1 1 17 LEU O O -2.856 -2.293 0.626 1.00 . A A . 17 LEU O 1 1 8 2985 1 1 18 ALA C C -5.229 -3.242 -0.820 1.00 . A A . 18 ALA C 1 1 8 2986 1 1 18 ALA CA C -3.876 -3.391 -1.540 1.00 . A A . 18 ALA CA 1 1 8 2987 1 1 18 ALA CB C -4.023 -4.097 -2.872 1.00 . A A . 18 ALA CB 1 1 8 2988 1 1 18 ALA H H -2.600 -4.964 -0.879 1.00 . A A . 18 ALA H 1 1 8 2989 1 1 18 ALA HA H -3.451 -2.409 -1.723 1.00 . A A . 18 ALA HA 1 1 8 2990 1 1 18 ALA HB1 H -4.872 -3.694 -3.401 1.00 . A A . 18 ALA HB1 1 1 8 2991 1 1 18 ALA HB2 H -4.159 -5.158 -2.712 1.00 . A A . 18 ALA HB2 1 1 8 2992 1 1 18 ALA HB3 H -3.125 -3.927 -3.455 1.00 . A A . 18 ALA HB3 1 1 8 2993 1 1 18 ALA N N -2.959 -4.076 -0.651 1.00 . A A . 18 ALA N 1 1 8 2994 1 1 18 ALA O O -6.068 -2.403 -1.180 1.00 . A A . 18 ALA O 1 1 8 2995 1 1 19 LYS C C -6.669 -2.695 1.836 1.00 . A A . 19 LYS C 1 1 8 2996 1 1 19 LYS CA C -6.513 -4.033 1.146 1.00 . A A . 19 LYS CA 1 1 8 2997 1 1 19 LYS CB C -6.276 -5.126 2.188 1.00 . A A . 19 LYS CB 1 1 8 2998 1 1 19 LYS CD C -5.304 -4.125 4.313 1.00 . A A . 19 LYS CD 1 1 8 2999 1 1 19 LYS CE C -6.300 -4.812 5.223 1.00 . A A . 19 LYS CE 1 1 8 3000 1 1 19 LYS CG C -5.033 -4.936 3.058 1.00 . A A . 19 LYS CG 1 1 8 3001 1 1 19 LYS H H -4.652 -4.683 0.460 1.00 . A A . 19 LYS H 1 1 8 3002 1 1 19 LYS HA H -7.404 -4.262 0.582 1.00 . A A . 19 LYS HA 1 1 8 3003 1 1 19 LYS HB2 H -7.121 -5.185 2.826 1.00 . A A . 19 LYS HB2 1 1 8 3004 1 1 19 LYS HB3 H -6.159 -6.053 1.667 1.00 . A A . 19 LYS HB3 1 1 8 3005 1 1 19 LYS HD2 H -4.377 -3.988 4.849 1.00 . A A . 19 LYS HD2 1 1 8 3006 1 1 19 LYS HD3 H -5.699 -3.164 4.018 1.00 . A A . 19 LYS HD3 1 1 8 3007 1 1 19 LYS HE2 H -7.262 -4.830 4.734 1.00 . A A . 19 LYS HE2 1 1 8 3008 1 1 19 LYS HE3 H -5.968 -5.825 5.397 1.00 . A A . 19 LYS HE3 1 1 8 3009 1 1 19 LYS HG2 H -4.658 -5.904 3.347 1.00 . A A . 19 LYS HG2 1 1 8 3010 1 1 19 LYS HG3 H -4.286 -4.423 2.472 1.00 . A A . 19 LYS HG3 1 1 8 3011 1 1 19 LYS HZ1 H -7.158 -4.581 7.112 1.00 . A A . 19 LYS HZ1 1 1 8 3012 1 1 19 LYS HZ2 H -6.697 -3.118 6.387 1.00 . A A . 19 LYS HZ2 1 1 8 3013 1 1 19 LYS HZ3 H -5.522 -4.145 7.044 1.00 . A A . 19 LYS HZ3 1 1 8 3014 1 1 19 LYS N N -5.372 -4.039 0.252 1.00 . A A . 19 LYS N 1 1 8 3015 1 1 19 LYS NZ N -6.430 -4.115 6.529 1.00 . A A . 19 LYS NZ 1 1 8 3016 1 1 19 LYS O O -7.751 -2.319 2.256 1.00 . A A . 19 LYS O 1 1 8 3017 1 1 20 VAL C C -5.319 0.308 1.515 1.00 . A A . 20 VAL C 1 1 8 3018 1 1 20 VAL CA C -5.479 -0.723 2.628 1.00 . A A . 20 VAL CA 1 1 8 3019 1 1 20 VAL CB C -4.289 -0.634 3.594 1.00 . A A . 20 VAL CB 1 1 8 3020 1 1 20 VAL CG1 C -2.995 -0.711 2.825 1.00 . A A . 20 VAL CG1 1 1 8 3021 1 1 20 VAL CG2 C -4.351 0.608 4.463 1.00 . A A . 20 VAL CG2 1 1 8 3022 1 1 20 VAL H H -4.708 -2.527 1.818 1.00 . A A . 20 VAL H 1 1 8 3023 1 1 20 VAL HA H -6.391 -0.535 3.171 1.00 . A A . 20 VAL HA 1 1 8 3024 1 1 20 VAL HB H -4.329 -1.490 4.229 1.00 . A A . 20 VAL HB 1 1 8 3025 1 1 20 VAL HG11 H -2.187 -0.311 3.416 1.00 . A A . 20 VAL HG11 1 1 8 3026 1 1 20 VAL HG12 H -3.102 -0.148 1.899 1.00 . A A . 20 VAL HG12 1 1 8 3027 1 1 20 VAL HG13 H -2.790 -1.754 2.580 1.00 . A A . 20 VAL HG13 1 1 8 3028 1 1 20 VAL HG21 H -3.507 0.618 5.138 1.00 . A A . 20 VAL HG21 1 1 8 3029 1 1 20 VAL HG22 H -5.267 0.601 5.035 1.00 . A A . 20 VAL HG22 1 1 8 3030 1 1 20 VAL HG23 H -4.322 1.488 3.839 1.00 . A A . 20 VAL HG23 1 1 8 3031 1 1 20 VAL N N -5.542 -2.062 2.050 1.00 . A A . 20 VAL N 1 1 8 3032 1 1 20 VAL O O -5.768 1.442 1.589 1.00 . A A . 20 VAL O 1 1 8 3033 1 1 21 LEU C C -5.453 1.490 -1.230 1.00 . A A . 21 LEU C 1 1 8 3034 1 1 21 LEU CA C -4.306 0.683 -0.657 1.00 . A A . 21 LEU CA 1 1 8 3035 1 1 21 LEU CB C -3.832 -0.263 -1.704 1.00 . A A . 21 LEU CB 1 1 8 3036 1 1 21 LEU CD1 C -2.480 1.173 -3.170 1.00 . A A . 21 LEU CD1 1 1 8 3037 1 1 21 LEU CD2 C -1.505 0.274 -1.052 1.00 . A A . 21 LEU CD2 1 1 8 3038 1 1 21 LEU CG C -2.452 -0.005 -2.212 1.00 . A A . 21 LEU CG 1 1 8 3039 1 1 21 LEU H H -4.325 -1.055 0.515 1.00 . A A . 21 LEU H 1 1 8 3040 1 1 21 LEU HA H -3.497 1.339 -0.387 1.00 . A A . 21 LEU HA 1 1 8 3041 1 1 21 LEU HB2 H -3.857 -1.257 -1.278 1.00 . A A . 21 LEU HB2 1 1 8 3042 1 1 21 LEU HB3 H -4.520 -0.224 -2.536 1.00 . A A . 21 LEU HB3 1 1 8 3043 1 1 21 LEU HD11 H -1.479 1.398 -3.499 1.00 . A A . 21 LEU HD11 1 1 8 3044 1 1 21 LEU HD12 H -2.900 2.033 -2.660 1.00 . A A . 21 LEU HD12 1 1 8 3045 1 1 21 LEU HD13 H -3.097 0.930 -4.022 1.00 . A A . 21 LEU HD13 1 1 8 3046 1 1 21 LEU HD21 H -1.589 1.316 -0.762 1.00 . A A . 21 LEU HD21 1 1 8 3047 1 1 21 LEU HD22 H -0.489 0.061 -1.350 1.00 . A A . 21 LEU HD22 1 1 8 3048 1 1 21 LEU HD23 H -1.778 -0.354 -0.211 1.00 . A A . 21 LEU HD23 1 1 8 3049 1 1 21 LEU HG H -2.126 -0.888 -2.727 1.00 . A A . 21 LEU HG 1 1 8 3050 1 1 21 LEU N N -4.651 -0.128 0.486 1.00 . A A . 21 LEU N 1 1 8 3051 1 1 21 LEU O O -5.476 2.711 -1.131 1.00 . A A . 21 LEU O 1 1 8 3052 1 1 22 ALA C C -8.409 2.218 -1.627 1.00 . A A . 22 ALA C 1 1 8 3053 1 1 22 ALA CA C -7.528 1.393 -2.545 1.00 . A A . 22 ALA CA 1 1 8 3054 1 1 22 ALA CB C -8.343 0.307 -3.196 1.00 . A A . 22 ALA CB 1 1 8 3055 1 1 22 ALA H H -6.373 -0.190 -1.703 1.00 . A A . 22 ALA H 1 1 8 3056 1 1 22 ALA HA H -7.123 2.020 -3.320 1.00 . A A . 22 ALA HA 1 1 8 3057 1 1 22 ALA HB1 H -9.156 0.750 -3.746 1.00 . A A . 22 ALA HB1 1 1 8 3058 1 1 22 ALA HB2 H -8.733 -0.349 -2.431 1.00 . A A . 22 ALA HB2 1 1 8 3059 1 1 22 ALA HB3 H -7.713 -0.255 -3.869 1.00 . A A . 22 ALA HB3 1 1 8 3060 1 1 22 ALA N N -6.412 0.783 -1.796 1.00 . A A . 22 ALA N 1 1 8 3061 1 1 22 ALA O O -9.335 2.917 -2.045 1.00 . A A . 22 ALA O 1 1 8 3062 1 1 23 GLU C C -8.341 3.987 1.151 1.00 . A A . 23 GLU C 1 1 8 3063 1 1 23 GLU CA C -8.822 2.620 0.724 1.00 . A A . 23 GLU CA 1 1 8 3064 1 1 23 GLU CB C -8.570 1.643 1.828 1.00 . A A . 23 GLU CB 1 1 8 3065 1 1 23 GLU CD C -9.880 -0.472 1.460 1.00 . A A . 23 GLU CD 1 1 8 3066 1 1 23 GLU CG C -8.554 0.235 1.290 1.00 . A A . 23 GLU CG 1 1 8 3067 1 1 23 GLU H H -7.212 1.670 -0.184 1.00 . A A . 23 GLU H 1 1 8 3068 1 1 23 GLU HA H -9.865 2.627 0.478 1.00 . A A . 23 GLU HA 1 1 8 3069 1 1 23 GLU HB2 H -7.592 1.854 2.255 1.00 . A A . 23 GLU HB2 1 1 8 3070 1 1 23 GLU HB3 H -9.330 1.729 2.584 1.00 . A A . 23 GLU HB3 1 1 8 3071 1 1 23 GLU HG2 H -8.326 0.287 0.232 1.00 . A A . 23 GLU HG2 1 1 8 3072 1 1 23 GLU HG3 H -7.766 -0.317 1.779 1.00 . A A . 23 GLU HG3 1 1 8 3073 1 1 23 GLU N N -8.060 2.125 -0.381 1.00 . A A . 23 GLU N 1 1 8 3074 1 1 23 GLU O O -9.120 4.910 1.349 1.00 . A A . 23 GLU O 1 1 8 3075 1 1 23 GLU OE1 O -10.439 -0.434 2.570 1.00 . A A . 23 GLU OE1 1 1 8 3076 1 1 23 GLU OE2 O -10.373 -1.071 0.478 1.00 . A A . 23 GLU OE2 1 1 8 3077 1 1 24 LYS C C -5.610 5.905 0.726 1.00 . A A . 24 LYS C 1 1 8 3078 1 1 24 LYS CA C -6.355 5.230 1.855 1.00 . A A . 24 LYS CA 1 1 8 3079 1 1 24 LYS CB C -5.348 4.802 2.899 1.00 . A A . 24 LYS CB 1 1 8 3080 1 1 24 LYS CD C -6.607 3.514 4.754 1.00 . A A . 24 LYS CD 1 1 8 3081 1 1 24 LYS CE C -7.972 4.116 4.456 1.00 . A A . 24 LYS CE 1 1 8 3082 1 1 24 LYS CG C -5.674 3.462 3.544 1.00 . A A . 24 LYS CG 1 1 8 3083 1 1 24 LYS H H -6.520 3.218 1.314 1.00 . A A . 24 LYS H 1 1 8 3084 1 1 24 LYS HA H -7.059 5.913 2.290 1.00 . A A . 24 LYS HA 1 1 8 3085 1 1 24 LYS HB2 H -4.380 4.718 2.424 1.00 . A A . 24 LYS HB2 1 1 8 3086 1 1 24 LYS HB3 H -5.293 5.543 3.645 1.00 . A A . 24 LYS HB3 1 1 8 3087 1 1 24 LYS HD2 H -6.756 2.493 5.091 1.00 . A A . 24 LYS HD2 1 1 8 3088 1 1 24 LYS HD3 H -6.132 4.085 5.536 1.00 . A A . 24 LYS HD3 1 1 8 3089 1 1 24 LYS HE2 H -8.228 3.880 3.434 1.00 . A A . 24 LYS HE2 1 1 8 3090 1 1 24 LYS HE3 H -8.699 3.670 5.118 1.00 . A A . 24 LYS HE3 1 1 8 3091 1 1 24 LYS HG2 H -6.140 2.835 2.790 1.00 . A A . 24 LYS HG2 1 1 8 3092 1 1 24 LYS HG3 H -4.747 3.002 3.848 1.00 . A A . 24 LYS HG3 1 1 8 3093 1 1 24 LYS HZ1 H -8.942 5.970 4.354 1.00 . A A . 24 LYS HZ1 1 1 8 3094 1 1 24 LYS HZ2 H -7.281 6.051 4.035 1.00 . A A . 24 LYS HZ2 1 1 8 3095 1 1 24 LYS HZ3 H -7.826 5.848 5.625 1.00 . A A . 24 LYS HZ3 1 1 8 3096 1 1 24 LYS N N -7.045 4.040 1.408 1.00 . A A . 24 LYS N 1 1 8 3097 1 1 24 LYS NZ N -8.005 5.597 4.628 1.00 . A A . 24 LYS NZ 1 1 8 3098 1 1 24 LYS O O -5.817 7.072 0.409 1.00 . A A . 24 LYS O 1 1 8 3099 1 1 25 TYR C C -4.314 5.812 -2.138 1.00 . A A . 25 TYR C 1 1 8 3100 1 1 25 TYR CA C -3.718 5.606 -0.764 1.00 . A A . 25 TYR CA 1 1 8 3101 1 1 25 TYR CB C -2.634 4.550 -0.884 1.00 . A A . 25 TYR CB 1 1 8 3102 1 1 25 TYR CD1 C -2.955 3.192 1.098 1.00 . A A . 25 TYR CD1 1 1 8 3103 1 1 25 TYR CD2 C -0.869 4.291 0.909 1.00 . A A . 25 TYR CD2 1 1 8 3104 1 1 25 TYR CE1 C -2.579 2.632 2.260 1.00 . A A . 25 TYR CE1 1 1 8 3105 1 1 25 TYR CE2 C -0.462 3.732 2.109 1.00 . A A . 25 TYR CE2 1 1 8 3106 1 1 25 TYR CG C -2.135 4.023 0.408 1.00 . A A . 25 TYR CG 1 1 8 3107 1 1 25 TYR CZ C -1.328 2.890 2.782 1.00 . A A . 25 TYR CZ 1 1 8 3108 1 1 25 TYR H H -4.739 4.170 0.340 1.00 . A A . 25 TYR H 1 1 8 3109 1 1 25 TYR HA H -3.311 6.513 -0.368 1.00 . A A . 25 TYR HA 1 1 8 3110 1 1 25 TYR HB2 H -3.064 3.707 -1.384 1.00 . A A . 25 TYR HB2 1 1 8 3111 1 1 25 TYR HB3 H -1.812 4.924 -1.445 1.00 . A A . 25 TYR HB3 1 1 8 3112 1 1 25 TYR HD1 H -3.949 2.998 0.700 1.00 . A A . 25 TYR HD1 1 1 8 3113 1 1 25 TYR HD2 H -0.209 4.951 0.363 1.00 . A A . 25 TYR HD2 1 1 8 3114 1 1 25 TYR HE1 H -3.267 1.996 2.749 1.00 . A A . 25 TYR HE1 1 1 8 3115 1 1 25 TYR HE2 H 0.521 3.946 2.505 1.00 . A A . 25 TYR HE2 1 1 8 3116 1 1 25 TYR HH H -0.689 2.988 4.600 1.00 . A A . 25 TYR HH 1 1 8 3117 1 1 25 TYR N N -4.722 5.126 0.145 1.00 . A A . 25 TYR N 1 1 8 3118 1 1 25 TYR O O -4.303 6.911 -2.697 1.00 . A A . 25 TYR O 1 1 8 3119 1 1 25 TYR OH O -0.948 2.306 3.969 1.00 . A A . 25 TYR OH 1 1 8 3120 1 1 26 ALA C C -6.798 5.390 -3.912 1.00 . A A . 26 ALA C 1 1 8 3121 1 1 26 ALA CA C -5.454 4.692 -3.976 1.00 . A A . 26 ALA CA 1 1 8 3122 1 1 26 ALA CB C -5.618 3.255 -4.429 1.00 . A A . 26 ALA CB 1 1 8 3123 1 1 26 ALA H H -4.800 3.862 -2.137 1.00 . A A . 26 ALA H 1 1 8 3124 1 1 26 ALA HA H -4.811 5.205 -4.674 1.00 . A A . 26 ALA HA 1 1 8 3125 1 1 26 ALA HB1 H -6.206 2.719 -3.694 1.00 . A A . 26 ALA HB1 1 1 8 3126 1 1 26 ALA HB2 H -4.644 2.795 -4.515 1.00 . A A . 26 ALA HB2 1 1 8 3127 1 1 26 ALA HB3 H -6.121 3.228 -5.382 1.00 . A A . 26 ALA HB3 1 1 8 3128 1 1 26 ALA N N -4.830 4.709 -2.668 1.00 . A A . 26 ALA N 1 1 8 3129 1 1 26 ALA O O -7.391 5.730 -4.934 1.00 . A A . 26 ALA O 1 1 8 3130 1 1 27 ASN C C -8.489 7.670 -3.101 1.00 . A A . 27 ASN C 1 1 8 3131 1 1 27 ASN CA C -8.475 6.321 -2.388 1.00 . A A . 27 ASN CA 1 1 8 3132 1 1 27 ASN CB C -8.546 6.537 -0.885 1.00 . A A . 27 ASN CB 1 1 8 3133 1 1 27 ASN CG C -9.729 7.382 -0.450 1.00 . A A . 27 ASN CG 1 1 8 3134 1 1 27 ASN H H -6.782 5.142 -1.937 1.00 . A A . 27 ASN H 1 1 8 3135 1 1 27 ASN HA H -9.330 5.742 -2.702 1.00 . A A . 27 ASN HA 1 1 8 3136 1 1 27 ASN HB2 H -8.613 5.574 -0.398 1.00 . A A . 27 ASN HB2 1 1 8 3137 1 1 27 ASN HB3 H -7.637 7.025 -0.559 1.00 . A A . 27 ASN HB3 1 1 8 3138 1 1 27 ASN HD21 H -8.715 8.010 1.141 1.00 . A A . 27 ASN HD21 1 1 8 3139 1 1 27 ASN HD22 H -10.322 8.636 0.975 1.00 . A A . 27 ASN HD22 1 1 8 3140 1 1 27 ASN N N -7.269 5.560 -2.685 1.00 . A A . 27 ASN N 1 1 8 3141 1 1 27 ASN ND2 N -9.574 8.078 0.665 1.00 . A A . 27 ASN ND2 1 1 8 3142 1 1 27 ASN O O -9.171 7.794 -4.139 1.00 . A A . 27 ASN O 1 1 8 3143 1 1 27 ASN OXT O -7.819 8.605 -2.614 1.00 . A A . 27 ASN OXT 1 1 8 3144 1 1 27 ASN OD1 O -10.771 7.401 -1.100 1.00 . A A . 27 ASN OD1 1 1 9 3145 1 1 1 GLY C C 14.559 1.434 0.912 1.00 . A A . 1 GLY C 1 1 9 3146 1 1 1 GLY CA C 14.917 1.511 -0.555 1.00 . A A . 1 GLY CA 1 1 9 3147 1 1 1 GLY H1 H 15.748 3.420 -0.495 1.00 . A A . 1 GLY H1 1 1 9 3148 1 1 1 GLY H2 H 16.262 2.493 -1.818 1.00 . A A . 1 GLY H2 1 1 9 3149 1 1 1 GLY H3 H 16.871 2.171 -0.268 1.00 . A A . 1 GLY H3 1 1 9 3150 1 1 1 GLY HA2 H 14.047 1.830 -1.112 1.00 . A A . 1 GLY HA2 1 1 9 3151 1 1 1 GLY HA3 H 15.214 0.530 -0.896 1.00 . A A . 1 GLY HA3 1 1 9 3152 1 1 1 GLY N N 16.025 2.463 -0.803 1.00 . A A . 1 GLY N 1 1 9 3153 1 1 1 GLY O O 15.358 0.975 1.727 1.00 . A A . 1 GLY O 1 1 9 3154 1 1 2 ILE C C 11.901 0.799 2.865 1.00 . A A . 2 ILE C 1 1 9 3155 1 1 2 ILE CA C 12.924 1.898 2.636 1.00 . A A . 2 ILE CA 1 1 9 3156 1 1 2 ILE CB C 12.304 3.260 3.011 1.00 . A A . 2 ILE CB 1 1 9 3157 1 1 2 ILE CD1 C 14.602 4.147 3.665 1.00 . A A . 2 ILE CD1 1 1 9 3158 1 1 2 ILE CG1 C 13.336 4.380 2.867 1.00 . A A . 2 ILE CG1 1 1 9 3159 1 1 2 ILE CG2 C 11.741 3.219 4.415 1.00 . A A . 2 ILE CG2 1 1 9 3160 1 1 2 ILE H H 12.751 2.221 0.565 1.00 . A A . 2 ILE H 1 1 9 3161 1 1 2 ILE HA H 13.782 1.722 3.269 1.00 . A A . 2 ILE HA 1 1 9 3162 1 1 2 ILE HB H 11.487 3.451 2.334 1.00 . A A . 2 ILE HB 1 1 9 3163 1 1 2 ILE HD11 H 15.280 4.976 3.516 1.00 . A A . 2 ILE HD11 1 1 9 3164 1 1 2 ILE HD12 H 15.073 3.235 3.334 1.00 . A A . 2 ILE HD12 1 1 9 3165 1 1 2 ILE HD13 H 14.356 4.068 4.712 1.00 . A A . 2 ILE HD13 1 1 9 3166 1 1 2 ILE HG12 H 13.610 4.473 1.825 1.00 . A A . 2 ILE HG12 1 1 9 3167 1 1 2 ILE HG13 H 12.898 5.309 3.201 1.00 . A A . 2 ILE HG13 1 1 9 3168 1 1 2 ILE HG21 H 10.970 2.460 4.460 1.00 . A A . 2 ILE HG21 1 1 9 3169 1 1 2 ILE HG22 H 11.319 4.180 4.661 1.00 . A A . 2 ILE HG22 1 1 9 3170 1 1 2 ILE HG23 H 12.528 2.978 5.113 1.00 . A A . 2 ILE HG23 1 1 9 3171 1 1 2 ILE N N 13.363 1.891 1.258 1.00 . A A . 2 ILE N 1 1 9 3172 1 1 2 ILE O O 12.221 -0.270 3.379 1.00 . A A . 2 ILE O 1 1 9 3173 1 1 3 GLY C C 8.255 0.680 2.394 1.00 . A A . 3 GLY C 1 1 9 3174 1 1 3 GLY CA C 9.631 0.086 2.591 1.00 . A A . 3 GLY CA 1 1 9 3175 1 1 3 GLY H H 10.471 1.943 2.081 1.00 . A A . 3 GLY H 1 1 9 3176 1 1 3 GLY HA2 H 9.791 -0.678 1.850 1.00 . A A . 3 GLY HA2 1 1 9 3177 1 1 3 GLY HA3 H 9.686 -0.359 3.573 1.00 . A A . 3 GLY HA3 1 1 9 3178 1 1 3 GLY N N 10.672 1.064 2.459 1.00 . A A . 3 GLY N 1 1 9 3179 1 1 3 GLY O O 7.707 0.640 1.287 1.00 . A A . 3 GLY O 1 1 9 3180 1 1 4 GLY C C 6.281 3.144 2.693 1.00 . A A . 4 GLY C 1 1 9 3181 1 1 4 GLY CA C 6.372 1.819 3.427 1.00 . A A . 4 GLY CA 1 1 9 3182 1 1 4 GLY H H 8.273 1.387 4.266 1.00 . A A . 4 GLY H 1 1 9 3183 1 1 4 GLY HA2 H 5.727 1.104 2.942 1.00 . A A . 4 GLY HA2 1 1 9 3184 1 1 4 GLY HA3 H 6.035 1.957 4.443 1.00 . A A . 4 GLY HA3 1 1 9 3185 1 1 4 GLY N N 7.726 1.287 3.449 1.00 . A A . 4 GLY N 1 1 9 3186 1 1 4 GLY O O 5.342 3.915 2.884 1.00 . A A . 4 GLY O 1 1 9 3187 1 1 5 VAL C C 6.577 4.430 -0.253 1.00 . A A . 5 VAL C 1 1 9 3188 1 1 5 VAL CA C 7.340 4.604 1.064 1.00 . A A . 5 VAL CA 1 1 9 3189 1 1 5 VAL CB C 8.823 4.962 0.802 1.00 . A A . 5 VAL CB 1 1 9 3190 1 1 5 VAL CG1 C 9.653 3.700 0.557 1.00 . A A . 5 VAL CG1 1 1 9 3191 1 1 5 VAL CG2 C 8.943 5.905 -0.372 1.00 . A A . 5 VAL CG2 1 1 9 3192 1 1 5 VAL H H 7.967 2.726 1.747 1.00 . A A . 5 VAL H 1 1 9 3193 1 1 5 VAL HA H 6.892 5.406 1.628 1.00 . A A . 5 VAL HA 1 1 9 3194 1 1 5 VAL HB H 9.214 5.460 1.680 1.00 . A A . 5 VAL HB 1 1 9 3195 1 1 5 VAL HG11 H 10.690 3.974 0.400 1.00 . A A . 5 VAL HG11 1 1 9 3196 1 1 5 VAL HG12 H 9.277 3.184 -0.318 1.00 . A A . 5 VAL HG12 1 1 9 3197 1 1 5 VAL HG13 H 9.581 3.045 1.414 1.00 . A A . 5 VAL HG13 1 1 9 3198 1 1 5 VAL HG21 H 8.652 5.379 -1.273 1.00 . A A . 5 VAL HG21 1 1 9 3199 1 1 5 VAL HG22 H 9.966 6.245 -0.464 1.00 . A A . 5 VAL HG22 1 1 9 3200 1 1 5 VAL HG23 H 8.291 6.751 -0.221 1.00 . A A . 5 VAL HG23 1 1 9 3201 1 1 5 VAL N N 7.265 3.394 1.852 1.00 . A A . 5 VAL N 1 1 9 3202 1 1 5 VAL O O 5.762 5.271 -0.633 1.00 . A A . 5 VAL O 1 1 9 3203 1 1 6 LEU C C 6.737 1.629 -2.644 1.00 . A A . 6 LEU C 1 1 9 3204 1 1 6 LEU CA C 6.183 2.960 -2.180 1.00 . A A . 6 LEU CA 1 1 9 3205 1 1 6 LEU CB C 6.382 4.069 -3.252 1.00 . A A . 6 LEU CB 1 1 9 3206 1 1 6 LEU CD1 C 8.931 4.019 -3.100 1.00 . A A . 6 LEU CD1 1 1 9 3207 1 1 6 LEU CD2 C 7.793 3.128 -5.146 1.00 . A A . 6 LEU CD2 1 1 9 3208 1 1 6 LEU CG C 7.728 4.151 -4.019 1.00 . A A . 6 LEU CG 1 1 9 3209 1 1 6 LEU H H 7.444 2.662 -0.515 1.00 . A A . 6 LEU H 1 1 9 3210 1 1 6 LEU HA H 5.125 2.842 -1.988 1.00 . A A . 6 LEU HA 1 1 9 3211 1 1 6 LEU HB2 H 5.600 3.954 -3.988 1.00 . A A . 6 LEU HB2 1 1 9 3212 1 1 6 LEU HB3 H 6.233 5.016 -2.758 1.00 . A A . 6 LEU HB3 1 1 9 3213 1 1 6 LEU HD11 H 8.875 3.078 -2.568 1.00 . A A . 6 LEU HD11 1 1 9 3214 1 1 6 LEU HD12 H 8.932 4.831 -2.388 1.00 . A A . 6 LEU HD12 1 1 9 3215 1 1 6 LEU HD13 H 9.837 4.048 -3.685 1.00 . A A . 6 LEU HD13 1 1 9 3216 1 1 6 LEU HD21 H 7.677 2.134 -4.735 1.00 . A A . 6 LEU HD21 1 1 9 3217 1 1 6 LEU HD22 H 8.746 3.202 -5.645 1.00 . A A . 6 LEU HD22 1 1 9 3218 1 1 6 LEU HD23 H 6.999 3.318 -5.853 1.00 . A A . 6 LEU HD23 1 1 9 3219 1 1 6 LEU HG H 7.788 5.129 -4.475 1.00 . A A . 6 LEU HG 1 1 9 3220 1 1 6 LEU N N 6.823 3.304 -0.910 1.00 . A A . 6 LEU N 1 1 9 3221 1 1 6 LEU O O 6.124 0.913 -3.432 1.00 . A A . 6 LEU O 1 1 9 3222 1 1 7 LEU C C 7.898 -1.142 -2.014 1.00 . A A . 7 LEU C 1 1 9 3223 1 1 7 LEU CA C 8.628 0.117 -2.486 1.00 . A A . 7 LEU CA 1 1 9 3224 1 1 7 LEU CB C 10.060 0.222 -1.946 1.00 . A A . 7 LEU CB 1 1 9 3225 1 1 7 LEU CD1 C 10.831 -1.892 -0.979 1.00 . A A . 7 LEU CD1 1 1 9 3226 1 1 7 LEU CD2 C 10.585 -1.717 -3.451 1.00 . A A . 7 LEU CD2 1 1 9 3227 1 1 7 LEU CG C 10.960 -0.985 -2.170 1.00 . A A . 7 LEU CG 1 1 9 3228 1 1 7 LEU H H 8.300 1.908 -1.445 1.00 . A A . 7 LEU H 1 1 9 3229 1 1 7 LEU HA H 8.672 0.090 -3.560 1.00 . A A . 7 LEU HA 1 1 9 3230 1 1 7 LEU HB2 H 10.530 1.080 -2.401 1.00 . A A . 7 LEU HB2 1 1 9 3231 1 1 7 LEU HB3 H 10.000 0.393 -0.880 1.00 . A A . 7 LEU HB3 1 1 9 3232 1 1 7 LEU HD11 H 11.114 -1.348 -0.093 1.00 . A A . 7 LEU HD11 1 1 9 3233 1 1 7 LEU HD12 H 11.464 -2.757 -1.104 1.00 . A A . 7 LEU HD12 1 1 9 3234 1 1 7 LEU HD13 H 9.797 -2.197 -0.893 1.00 . A A . 7 LEU HD13 1 1 9 3235 1 1 7 LEU HD21 H 9.534 -1.999 -3.403 1.00 . A A . 7 LEU HD21 1 1 9 3236 1 1 7 LEU HD22 H 11.190 -2.606 -3.550 1.00 . A A . 7 LEU HD22 1 1 9 3237 1 1 7 LEU HD23 H 10.744 -1.070 -4.298 1.00 . A A . 7 LEU HD23 1 1 9 3238 1 1 7 LEU HG H 11.988 -0.663 -2.244 1.00 . A A . 7 LEU HG 1 1 9 3239 1 1 7 LEU N N 7.903 1.306 -2.108 1.00 . A A . 7 LEU N 1 1 9 3240 1 1 7 LEU O O 7.353 -1.884 -2.829 1.00 . A A . 7 LEU O 1 1 9 3241 1 1 8 SER C C 5.773 -2.227 0.126 1.00 . A A . 8 SER C 1 1 9 3242 1 1 8 SER CA C 7.185 -2.587 -0.238 1.00 . A A . 8 SER CA 1 1 9 3243 1 1 8 SER CB C 7.924 -3.232 0.926 1.00 . A A . 8 SER CB 1 1 9 3244 1 1 8 SER H H 8.193 -0.716 -0.076 1.00 . A A . 8 SER H 1 1 9 3245 1 1 8 SER HA H 7.154 -3.283 -1.063 1.00 . A A . 8 SER HA 1 1 9 3246 1 1 8 SER HB2 H 7.379 -4.110 1.237 1.00 . A A . 8 SER HB2 1 1 9 3247 1 1 8 SER HB3 H 8.912 -3.521 0.597 1.00 . A A . 8 SER HB3 1 1 9 3248 1 1 8 SER HG H 8.546 -2.772 2.729 1.00 . A A . 8 SER HG 1 1 9 3249 1 1 8 SER N N 7.844 -1.381 -0.717 1.00 . A A . 8 SER N 1 1 9 3250 1 1 8 SER O O 4.905 -3.081 0.287 1.00 . A A . 8 SER O 1 1 9 3251 1 1 8 SER OG O 8.043 -2.343 2.016 1.00 . A A . 8 SER OG 1 1 9 3252 1 1 9 ALA C C 3.586 -0.764 -1.126 1.00 . A A . 9 ALA C 1 1 9 3253 1 1 9 ALA CA C 4.258 -0.339 0.176 1.00 . A A . 9 ALA CA 1 1 9 3254 1 1 9 ALA CB C 4.400 1.167 0.243 1.00 . A A . 9 ALA CB 1 1 9 3255 1 1 9 ALA H H 6.344 -0.342 0.367 1.00 . A A . 9 ALA H 1 1 9 3256 1 1 9 ALA HA H 3.679 -0.679 1.021 1.00 . A A . 9 ALA HA 1 1 9 3257 1 1 9 ALA HB1 H 4.559 1.468 1.268 1.00 . A A . 9 ALA HB1 1 1 9 3258 1 1 9 ALA HB2 H 3.508 1.637 -0.144 1.00 . A A . 9 ALA HB2 1 1 9 3259 1 1 9 ALA HB3 H 5.260 1.463 -0.352 1.00 . A A . 9 ALA HB3 1 1 9 3260 1 1 9 ALA N N 5.570 -0.928 0.231 1.00 . A A . 9 ALA N 1 1 9 3261 1 1 9 ALA O O 2.363 -0.757 -1.243 1.00 . A A . 9 ALA O 1 1 9 3262 1 1 10 GLY C C 3.953 -3.210 -3.286 1.00 . A A . 10 GLY C 1 1 9 3263 1 1 10 GLY CA C 3.911 -1.702 -3.328 1.00 . A A . 10 GLY CA 1 1 9 3264 1 1 10 GLY H H 5.390 -1.003 -1.996 1.00 . A A . 10 GLY H 1 1 9 3265 1 1 10 GLY HA2 H 2.896 -1.385 -3.467 1.00 . A A . 10 GLY HA2 1 1 9 3266 1 1 10 GLY HA3 H 4.511 -1.357 -4.157 1.00 . A A . 10 GLY HA3 1 1 9 3267 1 1 10 GLY N N 4.415 -1.126 -2.109 1.00 . A A . 10 GLY N 1 1 9 3268 1 1 10 GLY O O 2.934 -3.872 -3.451 1.00 . A A . 10 GLY O 1 1 9 3269 1 1 11 LYS C C 4.402 -5.923 -2.096 1.00 . A A . 11 LYS C 1 1 9 3270 1 1 11 LYS CA C 5.391 -5.169 -2.973 1.00 . A A . 11 LYS CA 1 1 9 3271 1 1 11 LYS CB C 6.770 -5.360 -2.421 1.00 . A A . 11 LYS CB 1 1 9 3272 1 1 11 LYS CD C 9.129 -4.694 -2.675 1.00 . A A . 11 LYS CD 1 1 9 3273 1 1 11 LYS CE C 9.290 -5.536 -1.435 1.00 . A A . 11 LYS CE 1 1 9 3274 1 1 11 LYS CG C 7.880 -5.095 -3.411 1.00 . A A . 11 LYS CG 1 1 9 3275 1 1 11 LYS H H 5.905 -3.133 -2.865 1.00 . A A . 11 LYS H 1 1 9 3276 1 1 11 LYS HA H 5.356 -5.565 -3.973 1.00 . A A . 11 LYS HA 1 1 9 3277 1 1 11 LYS HB2 H 6.889 -4.666 -1.599 1.00 . A A . 11 LYS HB2 1 1 9 3278 1 1 11 LYS HB3 H 6.867 -6.371 -2.052 1.00 . A A . 11 LYS HB3 1 1 9 3279 1 1 11 LYS HD2 H 9.988 -4.825 -3.318 1.00 . A A . 11 LYS HD2 1 1 9 3280 1 1 11 LYS HD3 H 9.034 -3.658 -2.386 1.00 . A A . 11 LYS HD3 1 1 9 3281 1 1 11 LYS HE2 H 10.063 -5.108 -0.813 1.00 . A A . 11 LYS HE2 1 1 9 3282 1 1 11 LYS HE3 H 8.335 -5.507 -0.911 1.00 . A A . 11 LYS HE3 1 1 9 3283 1 1 11 LYS HG2 H 8.074 -5.989 -3.979 1.00 . A A . 11 LYS HG2 1 1 9 3284 1 1 11 LYS HG3 H 7.587 -4.292 -4.065 1.00 . A A . 11 LYS HG3 1 1 9 3285 1 1 11 LYS HZ1 H 8.843 -7.415 -2.250 1.00 . A A . 11 LYS HZ1 1 1 9 3286 1 1 11 LYS HZ2 H 9.828 -7.478 -0.873 1.00 . A A . 11 LYS HZ2 1 1 9 3287 1 1 11 LYS HZ3 H 10.482 -6.989 -2.357 1.00 . A A . 11 LYS HZ3 1 1 9 3288 1 1 11 LYS N N 5.142 -3.737 -3.027 1.00 . A A . 11 LYS N 1 1 9 3289 1 1 11 LYS NZ N 9.633 -6.952 -1.750 1.00 . A A . 11 LYS NZ 1 1 9 3290 1 1 11 LYS O O 3.768 -6.879 -2.538 1.00 . A A . 11 LYS O 1 1 9 3291 1 1 12 ALA C C 1.945 -5.929 -0.326 1.00 . A A . 12 ALA C 1 1 9 3292 1 1 12 ALA CA C 3.388 -6.181 0.067 1.00 . A A . 12 ALA CA 1 1 9 3293 1 1 12 ALA CB C 3.654 -5.729 1.495 1.00 . A A . 12 ALA CB 1 1 9 3294 1 1 12 ALA H H 4.778 -4.718 -0.549 1.00 . A A . 12 ALA H 1 1 9 3295 1 1 12 ALA HA H 3.591 -7.242 0.003 1.00 . A A . 12 ALA HA 1 1 9 3296 1 1 12 ALA HB1 H 3.031 -6.292 2.174 1.00 . A A . 12 ALA HB1 1 1 9 3297 1 1 12 ALA HB2 H 3.428 -4.676 1.586 1.00 . A A . 12 ALA HB2 1 1 9 3298 1 1 12 ALA HB3 H 4.694 -5.896 1.737 1.00 . A A . 12 ALA HB3 1 1 9 3299 1 1 12 ALA N N 4.277 -5.506 -0.851 1.00 . A A . 12 ALA N 1 1 9 3300 1 1 12 ALA O O 1.057 -6.727 -0.029 1.00 . A A . 12 ALA O 1 1 9 3301 1 1 13 ALA C C -0.176 -5.444 -2.468 1.00 . A A . 13 ALA C 1 1 9 3302 1 1 13 ALA CA C 0.374 -4.460 -1.450 1.00 . A A . 13 ALA CA 1 1 9 3303 1 1 13 ALA CB C 0.306 -3.043 -1.994 1.00 . A A . 13 ALA CB 1 1 9 3304 1 1 13 ALA H H 2.487 -4.264 -1.287 1.00 . A A . 13 ALA H 1 1 9 3305 1 1 13 ALA HA H -0.256 -4.503 -0.571 1.00 . A A . 13 ALA HA 1 1 9 3306 1 1 13 ALA HB1 H 0.768 -3.006 -2.968 1.00 . A A . 13 ALA HB1 1 1 9 3307 1 1 13 ALA HB2 H 0.828 -2.374 -1.323 1.00 . A A . 13 ALA HB2 1 1 9 3308 1 1 13 ALA HB3 H -0.737 -2.735 -2.073 1.00 . A A . 13 ALA HB3 1 1 9 3309 1 1 13 ALA N N 1.721 -4.829 -1.033 1.00 . A A . 13 ALA N 1 1 9 3310 1 1 13 ALA O O -1.340 -5.825 -2.383 1.00 . A A . 13 ALA O 1 1 9 3311 1 1 14 LEU C C -0.361 -8.074 -3.711 1.00 . A A . 14 LEU C 1 1 9 3312 1 1 14 LEU CA C 0.212 -6.859 -4.412 1.00 . A A . 14 LEU CA 1 1 9 3313 1 1 14 LEU CB C 1.339 -7.344 -5.343 1.00 . A A . 14 LEU CB 1 1 9 3314 1 1 14 LEU CD1 C 1.371 -4.984 -6.260 1.00 . A A . 14 LEU CD1 1 1 9 3315 1 1 14 LEU CD2 C 3.481 -6.064 -5.428 1.00 . A A . 14 LEU CD2 1 1 9 3316 1 1 14 LEU CG C 2.143 -6.285 -6.105 1.00 . A A . 14 LEU CG 1 1 9 3317 1 1 14 LEU H H 1.586 -5.555 -3.433 1.00 . A A . 14 LEU H 1 1 9 3318 1 1 14 LEU HA H -0.564 -6.395 -5.003 1.00 . A A . 14 LEU HA 1 1 9 3319 1 1 14 LEU HB2 H 2.034 -7.913 -4.745 1.00 . A A . 14 LEU HB2 1 1 9 3320 1 1 14 LEU HB3 H 0.900 -8.010 -6.069 1.00 . A A . 14 LEU HB3 1 1 9 3321 1 1 14 LEU HD11 H 1.111 -4.602 -5.284 1.00 . A A . 14 LEU HD11 1 1 9 3322 1 1 14 LEU HD12 H 0.471 -5.165 -6.828 1.00 . A A . 14 LEU HD12 1 1 9 3323 1 1 14 LEU HD13 H 1.986 -4.261 -6.777 1.00 . A A . 14 LEU HD13 1 1 9 3324 1 1 14 LEU HD21 H 4.051 -5.330 -5.977 1.00 . A A . 14 LEU HD21 1 1 9 3325 1 1 14 LEU HD22 H 4.025 -6.997 -5.395 1.00 . A A . 14 LEU HD22 1 1 9 3326 1 1 14 LEU HD23 H 3.321 -5.713 -4.416 1.00 . A A . 14 LEU HD23 1 1 9 3327 1 1 14 LEU HG H 2.341 -6.659 -7.099 1.00 . A A . 14 LEU HG 1 1 9 3328 1 1 14 LEU N N 0.662 -5.887 -3.411 1.00 . A A . 14 LEU N 1 1 9 3329 1 1 14 LEU O O -1.244 -8.755 -4.229 1.00 . A A . 14 LEU O 1 1 9 3330 1 1 15 LYS C C -1.373 -9.149 -0.793 1.00 . A A . 15 LYS C 1 1 9 3331 1 1 15 LYS CA C -0.250 -9.492 -1.770 1.00 . A A . 15 LYS CA 1 1 9 3332 1 1 15 LYS CB C 0.970 -10.021 -1.032 1.00 . A A . 15 LYS CB 1 1 9 3333 1 1 15 LYS CD C 1.918 -11.078 -3.105 1.00 . A A . 15 LYS CD 1 1 9 3334 1 1 15 LYS CE C 1.501 -12.450 -2.627 1.00 . A A . 15 LYS CE 1 1 9 3335 1 1 15 LYS CG C 2.182 -10.151 -1.938 1.00 . A A . 15 LYS CG 1 1 9 3336 1 1 15 LYS H H 0.797 -7.713 -2.119 1.00 . A A . 15 LYS H 1 1 9 3337 1 1 15 LYS HA H -0.586 -10.234 -2.467 1.00 . A A . 15 LYS HA 1 1 9 3338 1 1 15 LYS HB2 H 1.213 -9.335 -0.241 1.00 . A A . 15 LYS HB2 1 1 9 3339 1 1 15 LYS HB3 H 0.743 -10.992 -0.616 1.00 . A A . 15 LYS HB3 1 1 9 3340 1 1 15 LYS HD2 H 1.122 -10.658 -3.705 1.00 . A A . 15 LYS HD2 1 1 9 3341 1 1 15 LYS HD3 H 2.816 -11.166 -3.699 1.00 . A A . 15 LYS HD3 1 1 9 3342 1 1 15 LYS HE2 H 2.363 -12.948 -2.204 1.00 . A A . 15 LYS HE2 1 1 9 3343 1 1 15 LYS HE3 H 0.751 -12.323 -1.865 1.00 . A A . 15 LYS HE3 1 1 9 3344 1 1 15 LYS HG2 H 2.403 -9.177 -2.331 1.00 . A A . 15 LYS HG2 1 1 9 3345 1 1 15 LYS HG3 H 3.021 -10.521 -1.368 1.00 . A A . 15 LYS HG3 1 1 9 3346 1 1 15 LYS HZ1 H 1.661 -13.379 -4.488 1.00 . A A . 15 LYS HZ1 1 1 9 3347 1 1 15 LYS HZ2 H 0.098 -12.825 -4.124 1.00 . A A . 15 LYS HZ2 1 1 9 3348 1 1 15 LYS HZ3 H 0.698 -14.225 -3.375 1.00 . A A . 15 LYS HZ3 1 1 9 3349 1 1 15 LYS N N 0.143 -8.332 -2.514 1.00 . A A . 15 LYS N 1 1 9 3350 1 1 15 LYS NZ N 0.951 -13.276 -3.729 1.00 . A A . 15 LYS NZ 1 1 9 3351 1 1 15 LYS O O -2.518 -9.561 -0.978 1.00 . A A . 15 LYS O 1 1 9 3352 1 1 16 GLY C C -2.397 -6.552 1.073 1.00 . A A . 16 GLY C 1 1 9 3353 1 1 16 GLY CA C -2.010 -7.983 1.216 1.00 . A A . 16 GLY CA 1 1 9 3354 1 1 16 GLY H H -0.141 -7.991 0.279 1.00 . A A . 16 GLY H 1 1 9 3355 1 1 16 GLY HA2 H -2.886 -8.597 1.110 1.00 . A A . 16 GLY HA2 1 1 9 3356 1 1 16 GLY HA3 H -1.600 -8.117 2.197 1.00 . A A . 16 GLY HA3 1 1 9 3357 1 1 16 GLY N N -1.038 -8.377 0.233 1.00 . A A . 16 GLY N 1 1 9 3358 1 1 16 GLY O O -3.530 -6.219 0.754 1.00 . A A . 16 GLY O 1 1 9 3359 1 1 17 LEU C C -2.253 -3.514 0.487 1.00 . A A . 17 LEU C 1 1 9 3360 1 1 17 LEU CA C -1.542 -4.306 1.573 1.00 . A A . 17 LEU CA 1 1 9 3361 1 1 17 LEU CB C -0.199 -3.648 1.904 1.00 . A A . 17 LEU CB 1 1 9 3362 1 1 17 LEU CD1 C -0.671 -3.501 4.368 1.00 . A A . 17 LEU CD1 1 1 9 3363 1 1 17 LEU CD2 C 0.724 -5.383 3.493 1.00 . A A . 17 LEU CD2 1 1 9 3364 1 1 17 LEU CG C 0.346 -3.920 3.317 1.00 . A A . 17 LEU CG 1 1 9 3365 1 1 17 LEU H H -0.483 -6.074 1.265 1.00 . A A . 17 LEU H 1 1 9 3366 1 1 17 LEU HA H -2.146 -4.259 2.455 1.00 . A A . 17 LEU HA 1 1 9 3367 1 1 17 LEU HB2 H 0.534 -3.991 1.182 1.00 . A A . 17 LEU HB2 1 1 9 3368 1 1 17 LEU HB3 H -0.323 -2.578 1.796 1.00 . A A . 17 LEU HB3 1 1 9 3369 1 1 17 LEU HD11 H -0.265 -3.674 5.353 1.00 . A A . 17 LEU HD11 1 1 9 3370 1 1 17 LEU HD12 H -1.575 -4.081 4.246 1.00 . A A . 17 LEU HD12 1 1 9 3371 1 1 17 LEU HD13 H -0.902 -2.452 4.252 1.00 . A A . 17 LEU HD13 1 1 9 3372 1 1 17 LEU HD21 H 1.504 -5.639 2.793 1.00 . A A . 17 LEU HD21 1 1 9 3373 1 1 17 LEU HD22 H -0.141 -6.001 3.309 1.00 . A A . 17 LEU HD22 1 1 9 3374 1 1 17 LEU HD23 H 1.076 -5.547 4.501 1.00 . A A . 17 LEU HD23 1 1 9 3375 1 1 17 LEU HG H 1.236 -3.326 3.466 1.00 . A A . 17 LEU HG 1 1 9 3376 1 1 17 LEU N N -1.386 -5.715 1.290 1.00 . A A . 17 LEU N 1 1 9 3377 1 1 17 LEU O O -2.471 -2.331 0.651 1.00 . A A . 17 LEU O 1 1 9 3378 1 1 18 ALA C C -4.859 -3.208 -0.808 1.00 . A A . 18 ALA C 1 1 9 3379 1 1 18 ALA CA C -3.510 -3.391 -1.517 1.00 . A A . 18 ALA CA 1 1 9 3380 1 1 18 ALA CB C -3.665 -4.074 -2.860 1.00 . A A . 18 ALA CB 1 1 9 3381 1 1 18 ALA H H -2.300 -5.018 -0.844 1.00 . A A . 18 ALA H 1 1 9 3382 1 1 18 ALA HA H -3.056 -2.421 -1.683 1.00 . A A . 18 ALA HA 1 1 9 3383 1 1 18 ALA HB1 H -4.495 -3.635 -3.391 1.00 . A A . 18 ALA HB1 1 1 9 3384 1 1 18 ALA HB2 H -3.837 -5.129 -2.716 1.00 . A A . 18 ALA HB2 1 1 9 3385 1 1 18 ALA HB3 H -2.759 -3.923 -3.431 1.00 . A A . 18 ALA HB3 1 1 9 3386 1 1 18 ALA N N -2.622 -4.111 -0.623 1.00 . A A . 18 ALA N 1 1 9 3387 1 1 18 ALA O O -5.661 -2.327 -1.153 1.00 . A A . 18 ALA O 1 1 9 3388 1 1 19 LYS C C -6.309 -2.671 1.830 1.00 . A A . 19 LYS C 1 1 9 3389 1 1 19 LYS CA C -6.194 -4.001 1.113 1.00 . A A . 19 LYS CA 1 1 9 3390 1 1 19 LYS CB C -6.017 -5.135 2.128 1.00 . A A . 19 LYS CB 1 1 9 3391 1 1 19 LYS CD C -5.216 -4.192 4.340 1.00 . A A . 19 LYS CD 1 1 9 3392 1 1 19 LYS CE C -6.194 -4.958 5.216 1.00 . A A . 19 LYS CE 1 1 9 3393 1 1 19 LYS CG C -4.842 -4.970 3.093 1.00 . A A . 19 LYS CG 1 1 9 3394 1 1 19 LYS H H -4.334 -4.680 0.463 1.00 . A A . 19 LYS H 1 1 9 3395 1 1 19 LYS HA H -7.078 -4.179 0.522 1.00 . A A . 19 LYS HA 1 1 9 3396 1 1 19 LYS HB2 H -6.907 -5.229 2.699 1.00 . A A . 19 LYS HB2 1 1 9 3397 1 1 19 LYS HB3 H -5.852 -6.040 1.579 1.00 . A A . 19 LYS HB3 1 1 9 3398 1 1 19 LYS HD2 H -4.320 -3.988 4.909 1.00 . A A . 19 LYS HD2 1 1 9 3399 1 1 19 LYS HD3 H -5.669 -3.262 4.032 1.00 . A A . 19 LYS HD3 1 1 9 3400 1 1 19 LYS HE2 H -6.474 -4.334 6.050 1.00 . A A . 19 LYS HE2 1 1 9 3401 1 1 19 LYS HE3 H -7.072 -5.193 4.632 1.00 . A A . 19 LYS HE3 1 1 9 3402 1 1 19 LYS HG2 H -4.488 -5.946 3.385 1.00 . A A . 19 LYS HG2 1 1 9 3403 1 1 19 LYS HG3 H -4.054 -4.441 2.579 1.00 . A A . 19 LYS HG3 1 1 9 3404 1 1 19 LYS HZ1 H -6.300 -6.728 6.318 1.00 . A A . 19 LYS HZ1 1 1 9 3405 1 1 19 LYS HZ2 H -4.765 -6.014 6.322 1.00 . A A . 19 LYS HZ2 1 1 9 3406 1 1 19 LYS HZ3 H -5.311 -6.839 4.945 1.00 . A A . 19 LYS HZ3 1 1 9 3407 1 1 19 LYS N N -5.038 -4.022 0.247 1.00 . A A . 19 LYS N 1 1 9 3408 1 1 19 LYS NZ N -5.602 -6.220 5.735 1.00 . A A . 19 LYS NZ 1 1 9 3409 1 1 19 LYS O O -7.390 -2.243 2.207 1.00 . A A . 19 LYS O 1 1 9 3410 1 1 20 VAL C C -4.840 0.289 1.643 1.00 . A A . 20 VAL C 1 1 9 3411 1 1 20 VAL CA C -5.049 -0.777 2.718 1.00 . A A . 20 VAL CA 1 1 9 3412 1 1 20 VAL CB C -3.863 -0.765 3.696 1.00 . A A . 20 VAL CB 1 1 9 3413 1 1 20 VAL CG1 C -2.562 -0.849 2.936 1.00 . A A . 20 VAL CG1 1 1 9 3414 1 1 20 VAL CG2 C -3.894 0.438 4.620 1.00 . A A . 20 VAL CG2 1 1 9 3415 1 1 20 VAL H H -4.338 -2.579 1.855 1.00 . A A . 20 VAL H 1 1 9 3416 1 1 20 VAL HA H -5.957 -0.575 3.263 1.00 . A A . 20 VAL HA 1 1 9 3417 1 1 20 VAL HB H -3.934 -1.648 4.294 1.00 . A A . 20 VAL HB 1 1 9 3418 1 1 20 VAL HG11 H -1.751 -0.498 3.550 1.00 . A A . 20 VAL HG11 1 1 9 3419 1 1 20 VAL HG12 H -2.641 -0.243 2.032 1.00 . A A . 20 VAL HG12 1 1 9 3420 1 1 20 VAL HG13 H -2.386 -1.885 2.651 1.00 . A A . 20 VAL HG13 1 1 9 3421 1 1 20 VAL HG21 H -4.826 0.446 5.168 1.00 . A A . 20 VAL HG21 1 1 9 3422 1 1 20 VAL HG22 H -3.813 1.344 4.035 1.00 . A A . 20 VAL HG22 1 1 9 3423 1 1 20 VAL HG23 H -3.068 0.382 5.312 1.00 . A A . 20 VAL HG23 1 1 9 3424 1 1 20 VAL N N -5.157 -2.089 2.090 1.00 . A A . 20 VAL N 1 1 9 3425 1 1 20 VAL O O -5.250 1.433 1.755 1.00 . A A . 20 VAL O 1 1 9 3426 1 1 21 LEU C C -4.906 1.570 -1.055 1.00 . A A . 21 LEU C 1 1 9 3427 1 1 21 LEU CA C -3.799 0.692 -0.514 1.00 . A A . 21 LEU CA 1 1 9 3428 1 1 21 LEU CB C -3.388 -0.250 -1.592 1.00 . A A . 21 LEU CB 1 1 9 3429 1 1 21 LEU CD1 C -2.063 1.179 -3.088 1.00 . A A . 21 LEU CD1 1 1 9 3430 1 1 21 LEU CD2 C -1.032 0.226 -1.027 1.00 . A A . 21 LEU CD2 1 1 9 3431 1 1 21 LEU CG C -2.023 -0.015 -2.155 1.00 . A A . 21 LEU CG 1 1 9 3432 1 1 21 LEU H H -3.892 -1.076 0.603 1.00 . A A . 21 LEU H 1 1 9 3433 1 1 21 LEU HA H -2.952 1.296 -0.232 1.00 . A A . 21 LEU HA 1 1 9 3434 1 1 21 LEU HB2 H -3.425 -1.248 -1.175 1.00 . A A . 21 LEU HB2 1 1 9 3435 1 1 21 LEU HB3 H -4.109 -0.183 -2.393 1.00 . A A . 21 LEU HB3 1 1 9 3436 1 1 21 LEU HD11 H -2.463 2.030 -2.551 1.00 . A A . 21 LEU HD11 1 1 9 3437 1 1 21 LEU HD12 H -2.699 0.955 -3.931 1.00 . A A . 21 LEU HD12 1 1 9 3438 1 1 21 LEU HD13 H -1.067 1.405 -3.433 1.00 . A A . 21 LEU HD13 1 1 9 3439 1 1 21 LEU HD21 H -1.019 1.283 -0.782 1.00 . A A . 21 LEU HD21 1 1 9 3440 1 1 21 LEU HD22 H -0.047 -0.092 -1.332 1.00 . A A . 21 LEU HD22 1 1 9 3441 1 1 21 LEU HD23 H -1.346 -0.338 -0.153 1.00 . A A . 21 LEU HD23 1 1 9 3442 1 1 21 LEU HG H -1.731 -0.896 -2.700 1.00 . A A . 21 LEU HG 1 1 9 3443 1 1 21 LEU N N -4.181 -0.138 0.605 1.00 . A A . 21 LEU N 1 1 9 3444 1 1 21 LEU O O -4.868 2.787 -0.918 1.00 . A A . 21 LEU O 1 1 9 3445 1 1 22 ALA C C -7.824 2.456 -1.407 1.00 . A A . 22 ALA C 1 1 9 3446 1 1 22 ALA CA C -6.988 1.612 -2.351 1.00 . A A . 22 ALA CA 1 1 9 3447 1 1 22 ALA CB C -7.863 0.590 -3.032 1.00 . A A . 22 ALA CB 1 1 9 3448 1 1 22 ALA H H -5.901 -0.053 -1.576 1.00 . A A . 22 ALA H 1 1 9 3449 1 1 22 ALA HA H -6.555 2.240 -3.108 1.00 . A A . 22 ALA HA 1 1 9 3450 1 1 22 ALA HB1 H -8.277 -0.073 -2.289 1.00 . A A . 22 ALA HB1 1 1 9 3451 1 1 22 ALA HB2 H -7.272 0.026 -3.736 1.00 . A A . 22 ALA HB2 1 1 9 3452 1 1 22 ALA HB3 H -8.661 1.094 -3.553 1.00 . A A . 22 ALA HB3 1 1 9 3453 1 1 22 ALA N N -5.898 0.925 -1.633 1.00 . A A . 22 ALA N 1 1 9 3454 1 1 22 ALA O O -8.716 3.201 -1.802 1.00 . A A . 22 ALA O 1 1 9 3455 1 1 23 GLU C C -7.712 4.135 1.440 1.00 . A A . 23 GLU C 1 1 9 3456 1 1 23 GLU CA C -8.242 2.805 0.954 1.00 . A A . 23 GLU CA 1 1 9 3457 1 1 23 GLU CB C -8.043 1.770 2.016 1.00 . A A . 23 GLU CB 1 1 9 3458 1 1 23 GLU CD C -9.511 -0.198 1.471 1.00 . A A . 23 GLU CD 1 1 9 3459 1 1 23 GLU CG C -8.119 0.389 1.418 1.00 . A A . 23 GLU CG 1 1 9 3460 1 1 23 GLU H H -6.652 1.831 0.025 1.00 . A A . 23 GLU H 1 1 9 3461 1 1 23 GLU HA H -9.280 2.865 0.698 1.00 . A A . 23 GLU HA 1 1 9 3462 1 1 23 GLU HB2 H -7.052 1.906 2.440 1.00 . A A . 23 GLU HB2 1 1 9 3463 1 1 23 GLU HB3 H -8.794 1.874 2.782 1.00 . A A . 23 GLU HB3 1 1 9 3464 1 1 23 GLU HG2 H -7.820 0.463 0.378 1.00 . A A . 23 GLU HG2 1 1 9 3465 1 1 23 GLU HG3 H -7.415 -0.251 1.924 1.00 . A A . 23 GLU HG3 1 1 9 3466 1 1 23 GLU N N -7.484 2.314 -0.163 1.00 . A A . 23 GLU N 1 1 9 3467 1 1 23 GLU O O -8.457 5.077 1.677 1.00 . A A . 23 GLU O 1 1 9 3468 1 1 23 GLU OE1 O -9.884 -0.758 2.524 1.00 . A A . 23 GLU OE1 1 1 9 3469 1 1 23 GLU OE2 O -10.241 -0.111 0.463 1.00 . A A . 23 GLU OE2 1 1 9 3470 1 1 24 LYS C C -4.946 5.988 1.099 1.00 . A A . 24 LYS C 1 1 9 3471 1 1 24 LYS CA C -5.687 5.271 2.203 1.00 . A A . 24 LYS CA 1 1 9 3472 1 1 24 LYS CB C -4.671 4.741 3.196 1.00 . A A . 24 LYS CB 1 1 9 3473 1 1 24 LYS CD C -5.925 3.430 5.024 1.00 . A A . 24 LYS CD 1 1 9 3474 1 1 24 LYS CE C -7.209 4.195 4.791 1.00 . A A . 24 LYS CE 1 1 9 3475 1 1 24 LYS CG C -5.045 3.382 3.782 1.00 . A A . 24 LYS CG 1 1 9 3476 1 1 24 LYS H H -5.919 3.301 1.548 1.00 . A A . 24 LYS H 1 1 9 3477 1 1 24 LYS HA H -6.362 5.945 2.693 1.00 . A A . 24 LYS HA 1 1 9 3478 1 1 24 LYS HB2 H -3.723 4.637 2.689 1.00 . A A . 24 LYS HB2 1 1 9 3479 1 1 24 LYS HB3 H -4.561 5.439 3.977 1.00 . A A . 24 LYS HB3 1 1 9 3480 1 1 24 LYS HD2 H -6.176 2.408 5.287 1.00 . A A . 24 LYS HD2 1 1 9 3481 1 1 24 LYS HD3 H -5.375 3.890 5.831 1.00 . A A . 24 LYS HD3 1 1 9 3482 1 1 24 LYS HE2 H -6.971 5.239 4.643 1.00 . A A . 24 LYS HE2 1 1 9 3483 1 1 24 LYS HE3 H -7.676 3.804 3.904 1.00 . A A . 24 LYS HE3 1 1 9 3484 1 1 24 LYS HG2 H -5.573 2.821 3.016 1.00 . A A . 24 LYS HG2 1 1 9 3485 1 1 24 LYS HG3 H -4.138 2.859 4.028 1.00 . A A . 24 LYS HG3 1 1 9 3486 1 1 24 LYS HZ1 H -8.499 3.094 6.009 1.00 . A A . 24 LYS HZ1 1 1 9 3487 1 1 24 LYS HZ2 H -8.964 4.711 5.802 1.00 . A A . 24 LYS HZ2 1 1 9 3488 1 1 24 LYS HZ3 H -7.667 4.325 6.826 1.00 . A A . 24 LYS HZ3 1 1 9 3489 1 1 24 LYS N N -6.417 4.130 1.692 1.00 . A A . 24 LYS N 1 1 9 3490 1 1 24 LYS NZ N -8.149 4.074 5.934 1.00 . A A . 24 LYS NZ 1 1 9 3491 1 1 24 LYS O O -5.105 7.186 0.864 1.00 . A A . 24 LYS O 1 1 9 3492 1 1 25 TYR C C -3.750 5.954 -1.826 1.00 . A A . 25 TYR C 1 1 9 3493 1 1 25 TYR CA C -3.128 5.686 -0.475 1.00 . A A . 25 TYR CA 1 1 9 3494 1 1 25 TYR CB C -2.078 4.602 -0.646 1.00 . A A . 25 TYR CB 1 1 9 3495 1 1 25 TYR CD1 C -2.415 3.186 1.291 1.00 . A A . 25 TYR CD1 1 1 9 3496 1 1 25 TYR CD2 C -0.305 4.240 1.120 1.00 . A A . 25 TYR CD2 1 1 9 3497 1 1 25 TYR CE1 C -2.041 2.579 2.430 1.00 . A A . 25 TYR CE1 1 1 9 3498 1 1 25 TYR CE2 C 0.097 3.630 2.296 1.00 . A A . 25 TYR CE2 1 1 9 3499 1 1 25 TYR CG C -1.580 4.016 0.619 1.00 . A A . 25 TYR CG 1 1 9 3500 1 1 25 TYR CZ C -0.783 2.793 2.950 1.00 . A A . 25 TYR CZ 1 1 9 3501 1 1 25 TYR H H -4.191 4.243 0.570 1.00 . A A . 25 TYR H 1 1 9 3502 1 1 25 TYR HA H -2.686 6.567 -0.056 1.00 . A A . 25 TYR HA 1 1 9 3503 1 1 25 TYR HB2 H -2.542 3.790 -1.168 1.00 . A A . 25 TYR HB2 1 1 9 3504 1 1 25 TYR HB3 H -1.251 4.966 -1.206 1.00 . A A . 25 TYR HB3 1 1 9 3505 1 1 25 TYR HD1 H -3.415 3.031 0.896 1.00 . A A . 25 TYR HD1 1 1 9 3506 1 1 25 TYR HD2 H 0.368 4.899 0.593 1.00 . A A . 25 TYR HD2 1 1 9 3507 1 1 25 TYR HE1 H -2.740 1.943 2.906 1.00 . A A . 25 TYR HE1 1 1 9 3508 1 1 25 TYR HE2 H 1.087 3.807 2.691 1.00 . A A . 25 TYR HE2 1 1 9 3509 1 1 25 TYR HH H -0.011 2.818 4.712 1.00 . A A . 25 TYR HH 1 1 9 3510 1 1 25 TYR N N -4.126 5.205 0.437 1.00 . A A . 25 TYR N 1 1 9 3511 1 1 25 TYR O O -3.746 7.075 -2.334 1.00 . A A . 25 TYR O 1 1 9 3512 1 1 25 TYR OH O -0.406 2.168 4.114 1.00 . A A . 25 TYR OH 1 1 9 3513 1 1 26 ALA C C -6.261 5.662 -3.587 1.00 . A A . 26 ALA C 1 1 9 3514 1 1 26 ALA CA C -4.942 4.925 -3.691 1.00 . A A . 26 ALA CA 1 1 9 3515 1 1 26 ALA CB C -5.164 3.517 -4.192 1.00 . A A . 26 ALA CB 1 1 9 3516 1 1 26 ALA H H -4.287 4.015 -1.886 1.00 . A A . 26 ALA H 1 1 9 3517 1 1 26 ALA HA H -4.288 5.441 -4.382 1.00 . A A . 26 ALA HA 1 1 9 3518 1 1 26 ALA HB1 H -5.619 3.546 -5.168 1.00 . A A . 26 ALA HB1 1 1 9 3519 1 1 26 ALA HB2 H -5.816 3.000 -3.500 1.00 . A A . 26 ALA HB2 1 1 9 3520 1 1 26 ALA HB3 H -4.217 3.000 -4.246 1.00 . A A . 26 ALA HB3 1 1 9 3521 1 1 26 ALA N N -4.300 4.880 -2.388 1.00 . A A . 26 ALA N 1 1 9 3522 1 1 26 ALA O O -6.858 6.053 -4.590 1.00 . A A . 26 ALA O 1 1 9 3523 1 1 27 ASN C C -7.818 7.976 -2.703 1.00 . A A . 27 ASN C 1 1 9 3524 1 1 27 ASN CA C -7.871 6.613 -2.013 1.00 . A A . 27 ASN CA 1 1 9 3525 1 1 27 ASN CB C -7.911 6.789 -0.504 1.00 . A A . 27 ASN CB 1 1 9 3526 1 1 27 ASN CG C -8.934 7.809 -0.035 1.00 . A A . 27 ASN CG 1 1 9 3527 1 1 27 ASN H H -6.252 5.316 -1.626 1.00 . A A . 27 ASN H 1 1 9 3528 1 1 27 ASN HA H -8.759 6.090 -2.330 1.00 . A A . 27 ASN HA 1 1 9 3529 1 1 27 ASN HB2 H -8.154 5.835 -0.051 1.00 . A A . 27 ASN HB2 1 1 9 3530 1 1 27 ASN HB3 H -6.927 7.089 -0.161 1.00 . A A . 27 ASN HB3 1 1 9 3531 1 1 27 ASN HD21 H -10.306 6.381 0.119 1.00 . A A . 27 ASN HD21 1 1 9 3532 1 1 27 ASN HD22 H -10.824 7.980 0.545 1.00 . A A . 27 ASN HD22 1 1 9 3533 1 1 27 ASN N N -6.715 5.798 -2.351 1.00 . A A . 27 ASN N 1 1 9 3534 1 1 27 ASN ND2 N -10.143 7.346 0.235 1.00 . A A . 27 ASN ND2 1 1 9 3535 1 1 27 ASN O O -6.875 8.748 -2.430 1.00 . A A . 27 ASN O 1 1 9 3536 1 1 27 ASN OXT O -8.727 8.276 -3.512 1.00 . A A . 27 ASN OXT 1 1 9 3537 1 1 27 ASN OD1 O -8.642 8.998 0.088 1.00 . A A . 27 ASN OD1 1 1 10 3538 1 1 1 GLY C C 14.805 0.665 1.362 1.00 . A A . 1 GLY C 1 1 10 3539 1 1 1 GLY CA C 15.328 0.269 -0.001 1.00 . A A . 1 GLY CA 1 1 10 3540 1 1 1 GLY H1 H 17.104 1.346 0.155 1.00 . A A . 1 GLY H1 1 1 10 3541 1 1 1 GLY H2 H 17.134 0.138 -1.036 1.00 . A A . 1 GLY H2 1 1 10 3542 1 1 1 GLY H3 H 17.249 -0.283 0.601 1.00 . A A . 1 GLY H3 1 1 10 3543 1 1 1 GLY HA2 H 14.890 0.918 -0.746 1.00 . A A . 1 GLY HA2 1 1 10 3544 1 1 1 GLY HA3 H 15.036 -0.749 -0.207 1.00 . A A . 1 GLY HA3 1 1 10 3545 1 1 1 GLY N N 16.804 0.373 -0.078 1.00 . A A . 1 GLY N 1 1 10 3546 1 1 1 GLY O O 15.411 0.333 2.383 1.00 . A A . 1 GLY O 1 1 10 3547 1 1 2 ILE C C 12.056 0.851 3.106 1.00 . A A . 2 ILE C 1 1 10 3548 1 1 2 ILE CA C 13.110 1.833 2.635 1.00 . A A . 2 ILE CA 1 1 10 3549 1 1 2 ILE CB C 12.465 3.223 2.475 1.00 . A A . 2 ILE CB 1 1 10 3550 1 1 2 ILE CD1 C 14.666 4.383 3.040 1.00 . A A . 2 ILE CD1 1 1 10 3551 1 1 2 ILE CG1 C 13.507 4.269 2.073 1.00 . A A . 2 ILE CG1 1 1 10 3552 1 1 2 ILE CG2 C 11.758 3.623 3.752 1.00 . A A . 2 ILE CG2 1 1 10 3553 1 1 2 ILE H H 13.214 1.582 0.551 1.00 . A A . 2 ILE H 1 1 10 3554 1 1 2 ILE HA H 13.897 1.899 3.372 1.00 . A A . 2 ILE HA 1 1 10 3555 1 1 2 ILE HB H 11.721 3.157 1.696 1.00 . A A . 2 ILE HB 1 1 10 3556 1 1 2 ILE HD11 H 15.166 3.428 3.115 1.00 . A A . 2 ILE HD11 1 1 10 3557 1 1 2 ILE HD12 H 14.296 4.673 4.010 1.00 . A A . 2 ILE HD12 1 1 10 3558 1 1 2 ILE HD13 H 15.362 5.127 2.682 1.00 . A A . 2 ILE HD13 1 1 10 3559 1 1 2 ILE HG12 H 13.903 4.014 1.103 1.00 . A A . 2 ILE HG12 1 1 10 3560 1 1 2 ILE HG13 H 13.028 5.236 2.017 1.00 . A A . 2 ILE HG13 1 1 10 3561 1 1 2 ILE HG21 H 11.285 4.582 3.617 1.00 . A A . 2 ILE HG21 1 1 10 3562 1 1 2 ILE HG22 H 12.474 3.677 4.559 1.00 . A A . 2 ILE HG22 1 1 10 3563 1 1 2 ILE HG23 H 11.007 2.878 3.981 1.00 . A A . 2 ILE HG23 1 1 10 3564 1 1 2 ILE N N 13.683 1.375 1.391 1.00 . A A . 2 ILE N 1 1 10 3565 1 1 2 ILE O O 12.283 0.045 4.006 1.00 . A A . 2 ILE O 1 1 10 3566 1 1 3 GLY C C 8.491 0.665 2.611 1.00 . A A . 3 GLY C 1 1 10 3567 1 1 3 GLY CA C 9.840 0.012 2.759 1.00 . A A . 3 GLY CA 1 1 10 3568 1 1 3 GLY H H 10.764 1.629 1.810 1.00 . A A . 3 GLY H 1 1 10 3569 1 1 3 GLY HA2 H 9.912 -0.814 2.075 1.00 . A A . 3 GLY HA2 1 1 10 3570 1 1 3 GLY HA3 H 9.948 -0.352 3.770 1.00 . A A . 3 GLY HA3 1 1 10 3571 1 1 3 GLY N N 10.901 0.926 2.473 1.00 . A A . 3 GLY N 1 1 10 3572 1 1 3 GLY O O 7.848 0.564 1.563 1.00 . A A . 3 GLY O 1 1 10 3573 1 1 4 GLY C C 6.746 3.356 2.990 1.00 . A A . 4 GLY C 1 1 10 3574 1 1 4 GLY CA C 6.787 2.008 3.681 1.00 . A A . 4 GLY CA 1 1 10 3575 1 1 4 GLY H H 8.735 1.559 4.369 1.00 . A A . 4 GLY H 1 1 10 3576 1 1 4 GLY HA2 H 6.085 1.347 3.201 1.00 . A A . 4 GLY HA2 1 1 10 3577 1 1 4 GLY HA3 H 6.497 2.136 4.714 1.00 . A A . 4 GLY HA3 1 1 10 3578 1 1 4 GLY N N 8.104 1.404 3.635 1.00 . A A . 4 GLY N 1 1 10 3579 1 1 4 GLY O O 6.001 4.253 3.389 1.00 . A A . 4 GLY O 1 1 10 3580 1 1 5 VAL C C 6.662 4.661 0.007 1.00 . A A . 5 VAL C 1 1 10 3581 1 1 5 VAL CA C 7.615 4.729 1.199 1.00 . A A . 5 VAL CA 1 1 10 3582 1 1 5 VAL CB C 9.070 5.021 0.749 1.00 . A A . 5 VAL CB 1 1 10 3583 1 1 5 VAL CG1 C 9.760 3.753 0.258 1.00 . A A . 5 VAL CG1 1 1 10 3584 1 1 5 VAL CG2 C 9.097 6.090 -0.324 1.00 . A A . 5 VAL CG2 1 1 10 3585 1 1 5 VAL H H 8.112 2.744 1.678 1.00 . A A . 5 VAL H 1 1 10 3586 1 1 5 VAL HA H 7.295 5.531 1.848 1.00 . A A . 5 VAL HA 1 1 10 3587 1 1 5 VAL HB H 9.618 5.391 1.605 1.00 . A A . 5 VAL HB 1 1 10 3588 1 1 5 VAL HG11 H 9.724 3.003 1.033 1.00 . A A . 5 VAL HG11 1 1 10 3589 1 1 5 VAL HG12 H 10.793 3.971 0.020 1.00 . A A . 5 VAL HG12 1 1 10 3590 1 1 5 VAL HG13 H 9.256 3.383 -0.623 1.00 . A A . 5 VAL HG13 1 1 10 3591 1 1 5 VAL HG21 H 8.566 6.964 0.023 1.00 . A A . 5 VAL HG21 1 1 10 3592 1 1 5 VAL HG22 H 8.620 5.703 -1.215 1.00 . A A . 5 VAL HG22 1 1 10 3593 1 1 5 VAL HG23 H 10.121 6.351 -0.547 1.00 . A A . 5 VAL HG23 1 1 10 3594 1 1 5 VAL N N 7.551 3.497 1.952 1.00 . A A . 5 VAL N 1 1 10 3595 1 1 5 VAL O O 5.847 5.557 -0.196 1.00 . A A . 5 VAL O 1 1 10 3596 1 1 6 LEU C C 6.380 2.032 -2.569 1.00 . A A . 6 LEU C 1 1 10 3597 1 1 6 LEU CA C 5.879 3.288 -1.882 1.00 . A A . 6 LEU CA 1 1 10 3598 1 1 6 LEU CB C 5.809 4.484 -2.877 1.00 . A A . 6 LEU CB 1 1 10 3599 1 1 6 LEU CD1 C 8.346 4.619 -3.161 1.00 . A A . 6 LEU CD1 1 1 10 3600 1 1 6 LEU CD2 C 6.922 3.796 -5.062 1.00 . A A . 6 LEU CD2 1 1 10 3601 1 1 6 LEU CG C 6.993 4.724 -3.854 1.00 . A A . 6 LEU CG 1 1 10 3602 1 1 6 LEU H H 7.431 2.899 -0.504 1.00 . A A . 6 LEU H 1 1 10 3603 1 1 6 LEU HA H 4.887 3.095 -1.495 1.00 . A A . 6 LEU HA 1 1 10 3604 1 1 6 LEU HB2 H 4.919 4.359 -3.474 1.00 . A A . 6 LEU HB2 1 1 10 3605 1 1 6 LEU HB3 H 5.688 5.381 -2.287 1.00 . A A . 6 LEU HB3 1 1 10 3606 1 1 6 LEU HD11 H 8.456 5.433 -2.458 1.00 . A A . 6 LEU HD11 1 1 10 3607 1 1 6 LEU HD12 H 9.135 4.667 -3.895 1.00 . A A . 6 LEU HD12 1 1 10 3608 1 1 6 LEU HD13 H 8.406 3.680 -2.627 1.00 . A A . 6 LEU HD13 1 1 10 3609 1 1 6 LEU HD21 H 6.968 2.769 -4.730 1.00 . A A . 6 LEU HD21 1 1 10 3610 1 1 6 LEU HD22 H 7.752 4.001 -5.722 1.00 . A A . 6 LEU HD22 1 1 10 3611 1 1 6 LEU HD23 H 5.994 3.964 -5.591 1.00 . A A . 6 LEU HD23 1 1 10 3612 1 1 6 LEU HG H 6.915 5.736 -4.226 1.00 . A A . 6 LEU HG 1 1 10 3613 1 1 6 LEU N N 6.753 3.563 -0.740 1.00 . A A . 6 LEU N 1 1 10 3614 1 1 6 LEU O O 5.646 1.336 -3.264 1.00 . A A . 6 LEU O 1 1 10 3615 1 1 7 LEU C C 7.752 -0.693 -2.536 1.00 . A A . 7 LEU C 1 1 10 3616 1 1 7 LEU CA C 8.350 0.648 -2.955 1.00 . A A . 7 LEU CA 1 1 10 3617 1 1 7 LEU CB C 9.835 0.703 -2.587 1.00 . A A . 7 LEU CB 1 1 10 3618 1 1 7 LEU CD1 C 10.319 -1.229 -4.120 1.00 . A A . 7 LEU CD1 1 1 10 3619 1 1 7 LEU CD2 C 10.944 1.114 -4.762 1.00 . A A . 7 LEU CD2 1 1 10 3620 1 1 7 LEU CG C 10.791 0.129 -3.621 1.00 . A A . 7 LEU CG 1 1 10 3621 1 1 7 LEU H H 8.150 2.352 -1.727 1.00 . A A . 7 LEU H 1 1 10 3622 1 1 7 LEU HA H 8.252 0.754 -4.025 1.00 . A A . 7 LEU HA 1 1 10 3623 1 1 7 LEU HB2 H 10.106 1.739 -2.438 1.00 . A A . 7 LEU HB2 1 1 10 3624 1 1 7 LEU HB3 H 9.980 0.170 -1.658 1.00 . A A . 7 LEU HB3 1 1 10 3625 1 1 7 LEU HD11 H 10.429 -1.958 -3.330 1.00 . A A . 7 LEU HD11 1 1 10 3626 1 1 7 LEU HD12 H 10.904 -1.529 -4.975 1.00 . A A . 7 LEU HD12 1 1 10 3627 1 1 7 LEU HD13 H 9.271 -1.166 -4.397 1.00 . A A . 7 LEU HD13 1 1 10 3628 1 1 7 LEU HD21 H 11.788 0.831 -5.376 1.00 . A A . 7 LEU HD21 1 1 10 3629 1 1 7 LEU HD22 H 11.104 2.101 -4.353 1.00 . A A . 7 LEU HD22 1 1 10 3630 1 1 7 LEU HD23 H 10.045 1.114 -5.361 1.00 . A A . 7 LEU HD23 1 1 10 3631 1 1 7 LEU HG H 11.760 -0.001 -3.164 1.00 . A A . 7 LEU HG 1 1 10 3632 1 1 7 LEU N N 7.654 1.757 -2.329 1.00 . A A . 7 LEU N 1 1 10 3633 1 1 7 LEU O O 7.029 -1.331 -3.302 1.00 . A A . 7 LEU O 1 1 10 3634 1 1 8 SER C C 6.246 -2.224 -0.177 1.00 . A A . 8 SER C 1 1 10 3635 1 1 8 SER CA C 7.568 -2.415 -0.859 1.00 . A A . 8 SER CA 1 1 10 3636 1 1 8 SER CB C 8.580 -3.082 0.060 1.00 . A A . 8 SER CB 1 1 10 3637 1 1 8 SER H H 8.500 -0.519 -0.690 1.00 . A A . 8 SER H 1 1 10 3638 1 1 8 SER HA H 7.416 -3.033 -1.733 1.00 . A A . 8 SER HA 1 1 10 3639 1 1 8 SER HB2 H 8.161 -4.011 0.421 1.00 . A A . 8 SER HB2 1 1 10 3640 1 1 8 SER HB3 H 9.484 -3.286 -0.493 1.00 . A A . 8 SER HB3 1 1 10 3641 1 1 8 SER HG H 9.301 -2.796 1.861 1.00 . A A . 8 SER HG 1 1 10 3642 1 1 8 SER N N 8.030 -1.114 -1.313 1.00 . A A . 8 SER N 1 1 10 3643 1 1 8 SER O O 5.489 -3.162 0.049 1.00 . A A . 8 SER O 1 1 10 3644 1 1 8 SER OG O 8.894 -2.255 1.160 1.00 . A A . 8 SER OG 1 1 10 3645 1 1 9 ALA C C 3.757 -0.858 -0.752 1.00 . A A . 9 ALA C 1 1 10 3646 1 1 9 ALA CA C 4.666 -0.494 0.416 1.00 . A A . 9 ALA CA 1 1 10 3647 1 1 9 ALA CB C 4.730 1.008 0.602 1.00 . A A . 9 ALA CB 1 1 10 3648 1 1 9 ALA H H 6.743 -0.346 0.219 1.00 . A A . 9 ALA H 1 1 10 3649 1 1 9 ALA HA H 4.305 -0.951 1.324 1.00 . A A . 9 ALA HA 1 1 10 3650 1 1 9 ALA HB1 H 5.470 1.415 -0.085 1.00 . A A . 9 ALA HB1 1 1 10 3651 1 1 9 ALA HB2 H 5.020 1.233 1.618 1.00 . A A . 9 ALA HB2 1 1 10 3652 1 1 9 ALA HB3 H 3.765 1.445 0.393 1.00 . A A . 9 ALA HB3 1 1 10 3653 1 1 9 ALA N N 5.994 -0.972 0.142 1.00 . A A . 9 ALA N 1 1 10 3654 1 1 9 ALA O O 2.549 -1.028 -0.588 1.00 . A A . 9 ALA O 1 1 10 3655 1 1 10 GLY C C 3.697 -2.908 -3.276 1.00 . A A . 10 GLY C 1 1 10 3656 1 1 10 GLY CA C 3.639 -1.410 -3.102 1.00 . A A . 10 GLY CA 1 1 10 3657 1 1 10 GLY H H 5.337 -0.800 -2.004 1.00 . A A . 10 GLY H 1 1 10 3658 1 1 10 GLY HA2 H 2.614 -1.109 -3.006 1.00 . A A . 10 GLY HA2 1 1 10 3659 1 1 10 GLY HA3 H 4.071 -0.939 -3.973 1.00 . A A . 10 GLY HA3 1 1 10 3660 1 1 10 GLY N N 4.368 -0.987 -1.934 1.00 . A A . 10 GLY N 1 1 10 3661 1 1 10 GLY O O 2.686 -3.560 -3.498 1.00 . A A . 10 GLY O 1 1 10 3662 1 1 11 LYS C C 4.304 -5.702 -2.317 1.00 . A A . 11 LYS C 1 1 10 3663 1 1 11 LYS CA C 5.128 -4.870 -3.283 1.00 . A A . 11 LYS CA 1 1 10 3664 1 1 11 LYS CB C 6.579 -5.097 -3.019 1.00 . A A . 11 LYS CB 1 1 10 3665 1 1 11 LYS CD C 8.844 -4.393 -3.633 1.00 . A A . 11 LYS CD 1 1 10 3666 1 1 11 LYS CE C 9.216 -5.409 -2.579 1.00 . A A . 11 LYS CE 1 1 10 3667 1 1 11 LYS CG C 7.480 -4.715 -4.168 1.00 . A A . 11 LYS CG 1 1 10 3668 1 1 11 LYS H H 5.662 -2.863 -2.960 1.00 . A A . 11 LYS H 1 1 10 3669 1 1 11 LYS HA H 4.902 -5.168 -4.292 1.00 . A A . 11 LYS HA 1 1 10 3670 1 1 11 LYS HB2 H 6.855 -4.485 -2.169 1.00 . A A . 11 LYS HB2 1 1 10 3671 1 1 11 LYS HB3 H 6.742 -6.139 -2.780 1.00 . A A . 11 LYS HB3 1 1 10 3672 1 1 11 LYS HD2 H 9.565 -4.415 -4.437 1.00 . A A . 11 LYS HD2 1 1 10 3673 1 1 11 LYS HD3 H 8.812 -3.410 -3.183 1.00 . A A . 11 LYS HD3 1 1 10 3674 1 1 11 LYS HE2 H 8.434 -5.377 -1.817 1.00 . A A . 11 LYS HE2 1 1 10 3675 1 1 11 LYS HE3 H 9.234 -6.389 -3.029 1.00 . A A . 11 LYS HE3 1 1 10 3676 1 1 11 LYS HG2 H 7.554 -5.546 -4.849 1.00 . A A . 11 LYS HG2 1 1 10 3677 1 1 11 LYS HG3 H 7.077 -3.848 -4.672 1.00 . A A . 11 LYS HG3 1 1 10 3678 1 1 11 LYS HZ1 H 10.832 -5.925 -1.357 1.00 . A A . 11 LYS HZ1 1 1 10 3679 1 1 11 LYS HZ2 H 10.501 -4.266 -1.386 1.00 . A A . 11 LYS HZ2 1 1 10 3680 1 1 11 LYS HZ3 H 11.259 -4.995 -2.710 1.00 . A A . 11 LYS HZ3 1 1 10 3681 1 1 11 LYS N N 4.890 -3.447 -3.148 1.00 . A A . 11 LYS N 1 1 10 3682 1 1 11 LYS NZ N 10.542 -5.127 -1.965 1.00 . A A . 11 LYS NZ 1 1 10 3683 1 1 11 LYS O O 3.676 -6.679 -2.709 1.00 . A A . 11 LYS O 1 1 10 3684 1 1 12 ALA C C 2.058 -5.862 -0.348 1.00 . A A . 12 ALA C 1 1 10 3685 1 1 12 ALA CA C 3.537 -6.049 -0.064 1.00 . A A . 12 ALA CA 1 1 10 3686 1 1 12 ALA CB C 3.886 -5.597 1.346 1.00 . A A . 12 ALA CB 1 1 10 3687 1 1 12 ALA H H 4.852 -4.553 -0.776 1.00 . A A . 12 ALA H 1 1 10 3688 1 1 12 ALA HA H 3.781 -7.094 -0.157 1.00 . A A . 12 ALA HA 1 1 10 3689 1 1 12 ALA HB1 H 3.305 -6.163 2.061 1.00 . A A . 12 ALA HB1 1 1 10 3690 1 1 12 ALA HB2 H 3.662 -4.547 1.452 1.00 . A A . 12 ALA HB2 1 1 10 3691 1 1 12 ALA HB3 H 4.938 -5.762 1.527 1.00 . A A . 12 ALA HB3 1 1 10 3692 1 1 12 ALA N N 4.314 -5.329 -1.052 1.00 . A A . 12 ALA N 1 1 10 3693 1 1 12 ALA O O 1.227 -6.686 0.029 1.00 . A A . 12 ALA O 1 1 10 3694 1 1 13 ALA C C -0.123 -5.492 -2.473 1.00 . A A . 13 ALA C 1 1 10 3695 1 1 13 ALA CA C 0.368 -4.500 -1.432 1.00 . A A . 13 ALA CA 1 1 10 3696 1 1 13 ALA CB C 0.201 -3.074 -1.934 1.00 . A A . 13 ALA CB 1 1 10 3697 1 1 13 ALA H H 2.477 -4.197 -1.358 1.00 . A A . 13 ALA H 1 1 10 3698 1 1 13 ALA HA H -0.237 -4.614 -0.543 1.00 . A A . 13 ALA HA 1 1 10 3699 1 1 13 ALA HB1 H 0.646 -2.392 -1.226 1.00 . A A . 13 ALA HB1 1 1 10 3700 1 1 13 ALA HB2 H -0.859 -2.850 -2.035 1.00 . A A . 13 ALA HB2 1 1 10 3701 1 1 13 ALA HB3 H 0.686 -2.970 -2.893 1.00 . A A . 13 ALA HB3 1 1 10 3702 1 1 13 ALA N N 1.748 -4.792 -1.060 1.00 . A A . 13 ALA N 1 1 10 3703 1 1 13 ALA O O -1.287 -5.880 -2.457 1.00 . A A . 13 ALA O 1 1 10 3704 1 1 14 LEU C C -0.155 -8.150 -3.595 1.00 . A A . 14 LEU C 1 1 10 3705 1 1 14 LEU CA C 0.481 -6.986 -4.324 1.00 . A A . 14 LEU CA 1 1 10 3706 1 1 14 LEU CB C 1.761 -7.517 -4.994 1.00 . A A . 14 LEU CB 1 1 10 3707 1 1 14 LEU CD1 C 2.020 -5.182 -5.976 1.00 . A A . 14 LEU CD1 1 1 10 3708 1 1 14 LEU CD2 C 3.972 -6.740 -5.791 1.00 . A A . 14 LEU CD2 1 1 10 3709 1 1 14 LEU CG C 2.474 -6.634 -6.027 1.00 . A A . 14 LEU CG 1 1 10 3710 1 1 14 LEU H H 1.671 -5.505 -3.369 1.00 . A A . 14 LEU H 1 1 10 3711 1 1 14 LEU HA H -0.195 -6.605 -5.073 1.00 . A A . 14 LEU HA 1 1 10 3712 1 1 14 LEU HB2 H 2.474 -7.729 -4.211 1.00 . A A . 14 LEU HB2 1 1 10 3713 1 1 14 LEU HB3 H 1.513 -8.452 -5.476 1.00 . A A . 14 LEU HB3 1 1 10 3714 1 1 14 LEU HD11 H 2.215 -4.780 -4.994 1.00 . A A . 14 LEU HD11 1 1 10 3715 1 1 14 LEU HD12 H 0.962 -5.128 -6.187 1.00 . A A . 14 LEU HD12 1 1 10 3716 1 1 14 LEU HD13 H 2.562 -4.608 -6.713 1.00 . A A . 14 LEU HD13 1 1 10 3717 1 1 14 LEU HD21 H 4.181 -6.566 -4.738 1.00 . A A . 14 LEU HD21 1 1 10 3718 1 1 14 LEU HD22 H 4.490 -6.004 -6.387 1.00 . A A . 14 LEU HD22 1 1 10 3719 1 1 14 LEU HD23 H 4.309 -7.730 -6.061 1.00 . A A . 14 LEU HD23 1 1 10 3720 1 1 14 LEU HG H 2.270 -7.012 -7.019 1.00 . A A . 14 LEU HG 1 1 10 3721 1 1 14 LEU N N 0.781 -5.920 -3.359 1.00 . A A . 14 LEU N 1 1 10 3722 1 1 14 LEU O O -1.059 -8.815 -4.099 1.00 . A A . 14 LEU O 1 1 10 3723 1 1 15 LYS C C -1.203 -9.168 -0.676 1.00 . A A . 15 LYS C 1 1 10 3724 1 1 15 LYS CA C -0.050 -9.512 -1.611 1.00 . A A . 15 LYS CA 1 1 10 3725 1 1 15 LYS CB C 1.162 -9.964 -0.813 1.00 . A A . 15 LYS CB 1 1 10 3726 1 1 15 LYS CD C 2.181 -11.199 -2.722 1.00 . A A . 15 LYS CD 1 1 10 3727 1 1 15 LYS CE C 1.962 -12.541 -2.062 1.00 . A A . 15 LYS CE 1 1 10 3728 1 1 15 LYS CG C 2.397 -10.129 -1.679 1.00 . A A . 15 LYS CG 1 1 10 3729 1 1 15 LYS H H 1.009 -7.762 -2.023 1.00 . A A . 15 LYS H 1 1 10 3730 1 1 15 LYS HA H -0.340 -10.299 -2.280 1.00 . A A . 15 LYS HA 1 1 10 3731 1 1 15 LYS HB2 H 1.375 -9.224 -0.062 1.00 . A A . 15 LYS HB2 1 1 10 3732 1 1 15 LYS HB3 H 0.944 -10.907 -0.341 1.00 . A A . 15 LYS HB3 1 1 10 3733 1 1 15 LYS HD2 H 1.308 -10.937 -3.303 1.00 . A A . 15 LYS HD2 1 1 10 3734 1 1 15 LYS HD3 H 3.048 -11.253 -3.362 1.00 . A A . 15 LYS HD3 1 1 10 3735 1 1 15 LYS HE2 H 2.810 -12.739 -1.433 1.00 . A A . 15 LYS HE2 1 1 10 3736 1 1 15 LYS HE3 H 1.067 -12.487 -1.454 1.00 . A A . 15 LYS HE3 1 1 10 3737 1 1 15 LYS HG2 H 2.594 -9.198 -2.182 1.00 . A A . 15 LYS HG2 1 1 10 3738 1 1 15 LYS HG3 H 3.237 -10.401 -1.057 1.00 . A A . 15 LYS HG3 1 1 10 3739 1 1 15 LYS HZ1 H 0.981 -13.463 -3.658 1.00 . A A . 15 LYS HZ1 1 1 10 3740 1 1 15 LYS HZ2 H 1.682 -14.551 -2.560 1.00 . A A . 15 LYS HZ2 1 1 10 3741 1 1 15 LYS HZ3 H 2.662 -13.700 -3.651 1.00 . A A . 15 LYS HZ3 1 1 10 3742 1 1 15 LYS N N 0.345 -8.381 -2.392 1.00 . A A . 15 LYS N 1 1 10 3743 1 1 15 LYS NZ N 1.811 -13.637 -3.051 1.00 . A A . 15 LYS NZ 1 1 10 3744 1 1 15 LYS O O -2.333 -9.611 -0.876 1.00 . A A . 15 LYS O 1 1 10 3745 1 1 16 GLY C C -2.347 -6.596 1.167 1.00 . A A . 16 GLY C 1 1 10 3746 1 1 16 GLY CA C -1.890 -8.008 1.321 1.00 . A A . 16 GLY CA 1 1 10 3747 1 1 16 GLY H H -0.022 -7.955 0.382 1.00 . A A . 16 GLY H 1 1 10 3748 1 1 16 GLY HA2 H -2.739 -8.666 1.231 1.00 . A A . 16 GLY HA2 1 1 10 3749 1 1 16 GLY HA3 H -1.467 -8.111 2.302 1.00 . A A . 16 GLY HA3 1 1 10 3750 1 1 16 GLY N N -0.907 -8.371 0.340 1.00 . A A . 16 GLY N 1 1 10 3751 1 1 16 GLY O O -3.514 -6.314 0.912 1.00 . A A . 16 GLY O 1 1 10 3752 1 1 17 LEU C C -2.321 -3.570 0.483 1.00 . A A . 17 LEU C 1 1 10 3753 1 1 17 LEU CA C -1.577 -4.314 1.573 1.00 . A A . 17 LEU CA 1 1 10 3754 1 1 17 LEU CB C -0.260 -3.607 1.890 1.00 . A A . 17 LEU CB 1 1 10 3755 1 1 17 LEU CD1 C -0.751 -3.654 4.347 1.00 . A A . 17 LEU CD1 1 1 10 3756 1 1 17 LEU CD2 C 0.868 -5.302 3.386 1.00 . A A . 17 LEU CD2 1 1 10 3757 1 1 17 LEU CG C 0.314 -3.888 3.285 1.00 . A A . 17 LEU CG 1 1 10 3758 1 1 17 LEU H H -0.449 -6.026 1.226 1.00 . A A . 17 LEU H 1 1 10 3759 1 1 17 LEU HA H -2.178 -4.280 2.458 1.00 . A A . 17 LEU HA 1 1 10 3760 1 1 17 LEU HB2 H 0.474 -3.903 1.145 1.00 . A A . 17 LEU HB2 1 1 10 3761 1 1 17 LEU HB3 H -0.432 -2.541 1.809 1.00 . A A . 17 LEU HB3 1 1 10 3762 1 1 17 LEU HD11 H -0.341 -3.865 5.324 1.00 . A A . 17 LEU HD11 1 1 10 3763 1 1 17 LEU HD12 H -1.594 -4.305 4.161 1.00 . A A . 17 LEU HD12 1 1 10 3764 1 1 17 LEU HD13 H -1.079 -2.624 4.309 1.00 . A A . 17 LEU HD13 1 1 10 3765 1 1 17 LEU HD21 H 1.257 -5.464 4.381 1.00 . A A . 17 LEU HD21 1 1 10 3766 1 1 17 LEU HD22 H 1.662 -5.432 2.664 1.00 . A A . 17 LEU HD22 1 1 10 3767 1 1 17 LEU HD23 H 0.080 -6.014 3.188 1.00 . A A . 17 LEU HD23 1 1 10 3768 1 1 17 LEU HG H 1.124 -3.198 3.472 1.00 . A A . 17 LEU HG 1 1 10 3769 1 1 17 LEU N N -1.366 -5.713 1.302 1.00 . A A . 17 LEU N 1 1 10 3770 1 1 17 LEU O O -2.579 -2.393 0.626 1.00 . A A . 17 LEU O 1 1 10 3771 1 1 18 ALA C C -4.926 -3.358 -0.811 1.00 . A A . 18 ALA C 1 1 10 3772 1 1 18 ALA CA C -3.579 -3.547 -1.523 1.00 . A A . 18 ALA CA 1 1 10 3773 1 1 18 ALA CB C -3.738 -4.297 -2.830 1.00 . A A . 18 ALA CB 1 1 10 3774 1 1 18 ALA H H -2.304 -5.104 -0.813 1.00 . A A . 18 ALA H 1 1 10 3775 1 1 18 ALA HA H -3.152 -2.576 -1.741 1.00 . A A . 18 ALA HA 1 1 10 3776 1 1 18 ALA HB1 H -4.594 -3.914 -3.361 1.00 . A A . 18 ALA HB1 1 1 10 3777 1 1 18 ALA HB2 H -3.866 -5.350 -2.636 1.00 . A A . 18 ALA HB2 1 1 10 3778 1 1 18 ALA HB3 H -2.848 -4.142 -3.428 1.00 . A A . 18 ALA HB3 1 1 10 3779 1 1 18 ALA N N -2.666 -4.208 -0.611 1.00 . A A . 18 ALA N 1 1 10 3780 1 1 18 ALA O O -5.732 -2.482 -1.173 1.00 . A A . 18 ALA O 1 1 10 3781 1 1 19 LYS C C -6.396 -2.757 1.793 1.00 . A A . 19 LYS C 1 1 10 3782 1 1 19 LYS CA C -6.279 -4.114 1.110 1.00 . A A . 19 LYS CA 1 1 10 3783 1 1 19 LYS CB C -6.135 -5.205 2.168 1.00 . A A . 19 LYS CB 1 1 10 3784 1 1 19 LYS CD C -4.352 -5.730 3.864 1.00 . A A . 19 LYS CD 1 1 10 3785 1 1 19 LYS CE C -4.887 -7.146 3.922 1.00 . A A . 19 LYS CE 1 1 10 3786 1 1 19 LYS CG C -5.430 -4.756 3.443 1.00 . A A . 19 LYS CG 1 1 10 3787 1 1 19 LYS H H -4.407 -4.826 0.479 1.00 . A A . 19 LYS H 1 1 10 3788 1 1 19 LYS HA H -7.153 -4.305 0.516 1.00 . A A . 19 LYS HA 1 1 10 3789 1 1 19 LYS HB2 H -7.102 -5.575 2.428 1.00 . A A . 19 LYS HB2 1 1 10 3790 1 1 19 LYS HB3 H -5.565 -6.005 1.737 1.00 . A A . 19 LYS HB3 1 1 10 3791 1 1 19 LYS HD2 H -3.544 -5.688 3.149 1.00 . A A . 19 LYS HD2 1 1 10 3792 1 1 19 LYS HD3 H -3.988 -5.450 4.842 1.00 . A A . 19 LYS HD3 1 1 10 3793 1 1 19 LYS HE2 H -5.530 -7.287 3.065 1.00 . A A . 19 LYS HE2 1 1 10 3794 1 1 19 LYS HE3 H -4.060 -7.838 3.874 1.00 . A A . 19 LYS HE3 1 1 10 3795 1 1 19 LYS HG2 H -4.976 -3.794 3.261 1.00 . A A . 19 LYS HG2 1 1 10 3796 1 1 19 LYS HG3 H -6.159 -4.669 4.235 1.00 . A A . 19 LYS HG3 1 1 10 3797 1 1 19 LYS HZ1 H -5.095 -7.194 5.999 1.00 . A A . 19 LYS HZ1 1 1 10 3798 1 1 19 LYS HZ2 H -5.968 -8.403 5.191 1.00 . A A . 19 LYS HZ2 1 1 10 3799 1 1 19 LYS HZ3 H -6.525 -6.800 5.177 1.00 . A A . 19 LYS HZ3 1 1 10 3800 1 1 19 LYS N N -5.109 -4.161 0.254 1.00 . A A . 19 LYS N 1 1 10 3801 1 1 19 LYS NZ N -5.673 -7.402 5.156 1.00 . A A . 19 LYS NZ 1 1 10 3802 1 1 19 LYS O O -7.482 -2.300 2.099 1.00 . A A . 19 LYS O 1 1 10 3803 1 1 20 VAL C C -4.886 0.197 1.664 1.00 . A A . 20 VAL C 1 1 10 3804 1 1 20 VAL CA C -5.146 -0.867 2.724 1.00 . A A . 20 VAL CA 1 1 10 3805 1 1 20 VAL CB C -3.993 -0.885 3.730 1.00 . A A . 20 VAL CB 1 1 10 3806 1 1 20 VAL CG1 C -2.689 -1.013 2.995 1.00 . A A . 20 VAL CG1 1 1 10 3807 1 1 20 VAL CG2 C -4.005 0.325 4.647 1.00 . A A . 20 VAL CG2 1 1 10 3808 1 1 20 VAL H H -4.414 -2.654 1.869 1.00 . A A . 20 VAL H 1 1 10 3809 1 1 20 VAL HA H -6.065 -0.660 3.244 1.00 . A A . 20 VAL HA 1 1 10 3810 1 1 20 VAL HB H -4.102 -1.764 4.326 1.00 . A A . 20 VAL HB 1 1 10 3811 1 1 20 VAL HG11 H -2.478 -2.068 2.833 1.00 . A A . 20 VAL HG11 1 1 10 3812 1 1 20 VAL HG12 H -1.902 -0.557 3.563 1.00 . A A . 20 VAL HG12 1 1 10 3813 1 1 20 VAL HG13 H -2.786 -0.524 2.023 1.00 . A A . 20 VAL HG13 1 1 10 3814 1 1 20 VAL HG21 H -3.845 1.220 4.064 1.00 . A A . 20 VAL HG21 1 1 10 3815 1 1 20 VAL HG22 H -3.220 0.229 5.383 1.00 . A A . 20 VAL HG22 1 1 10 3816 1 1 20 VAL HG23 H -4.961 0.387 5.147 1.00 . A A . 20 VAL HG23 1 1 10 3817 1 1 20 VAL N N -5.243 -2.176 2.088 1.00 . A A . 20 VAL N 1 1 10 3818 1 1 20 VAL O O -5.198 1.370 1.804 1.00 . A A . 20 VAL O 1 1 10 3819 1 1 21 LEU C C -4.981 1.451 -1.045 1.00 . A A . 21 LEU C 1 1 10 3820 1 1 21 LEU CA C -3.886 0.558 -0.513 1.00 . A A . 21 LEU CA 1 1 10 3821 1 1 21 LEU CB C -3.501 -0.390 -1.593 1.00 . A A . 21 LEU CB 1 1 10 3822 1 1 21 LEU CD1 C -2.085 0.956 -3.082 1.00 . A A . 21 LEU CD1 1 1 10 3823 1 1 21 LEU CD2 C -1.143 -0.002 -0.975 1.00 . A A . 21 LEU CD2 1 1 10 3824 1 1 21 LEU CG C -2.117 -0.220 -2.123 1.00 . A A . 21 LEU CG 1 1 10 3825 1 1 21 LEU H H -4.032 -1.207 0.604 1.00 . A A . 21 LEU H 1 1 10 3826 1 1 21 LEU HA H -3.027 1.148 -0.240 1.00 . A A . 21 LEU HA 1 1 10 3827 1 1 21 LEU HB2 H -3.591 -1.391 -1.194 1.00 . A A . 21 LEU HB2 1 1 10 3828 1 1 21 LEU HB3 H -4.201 -0.278 -2.407 1.00 . A A . 21 LEU HB3 1 1 10 3829 1 1 21 LEU HD11 H -1.067 1.150 -3.384 1.00 . A A . 21 LEU HD11 1 1 10 3830 1 1 21 LEU HD12 H -2.492 1.827 -2.584 1.00 . A A . 21 LEU HD12 1 1 10 3831 1 1 21 LEU HD13 H -2.684 0.728 -3.951 1.00 . A A . 21 LEU HD13 1 1 10 3832 1 1 21 LEU HD21 H -0.155 -0.322 -1.271 1.00 . A A . 21 LEU HD21 1 1 10 3833 1 1 21 LEU HD22 H -1.473 -0.572 -0.113 1.00 . A A . 21 LEU HD22 1 1 10 3834 1 1 21 LEU HD23 H -1.121 1.051 -0.723 1.00 . A A . 21 LEU HD23 1 1 10 3835 1 1 21 LEU HG H -1.857 -1.124 -2.640 1.00 . A A . 21 LEU HG 1 1 10 3836 1 1 21 LEU N N -4.278 -0.256 0.613 1.00 . A A . 21 LEU N 1 1 10 3837 1 1 21 LEU O O -4.908 2.670 -0.944 1.00 . A A . 21 LEU O 1 1 10 3838 1 1 22 ALA C C -7.880 2.385 -1.310 1.00 . A A . 22 ALA C 1 1 10 3839 1 1 22 ALA CA C -7.110 1.502 -2.275 1.00 . A A . 22 ALA CA 1 1 10 3840 1 1 22 ALA CB C -8.037 0.480 -2.890 1.00 . A A . 22 ALA CB 1 1 10 3841 1 1 22 ALA H H -6.008 -0.161 -1.530 1.00 . A A . 22 ALA H 1 1 10 3842 1 1 22 ALA HA H -6.704 2.106 -3.067 1.00 . A A . 22 ALA HA 1 1 10 3843 1 1 22 ALA HB1 H -8.839 0.984 -3.399 1.00 . A A . 22 ALA HB1 1 1 10 3844 1 1 22 ALA HB2 H -8.438 -0.150 -2.111 1.00 . A A . 22 ALA HB2 1 1 10 3845 1 1 22 ALA HB3 H -7.483 -0.121 -3.594 1.00 . A A . 22 ALA HB3 1 1 10 3846 1 1 22 ALA N N -5.999 0.815 -1.593 1.00 . A A . 22 ALA N 1 1 10 3847 1 1 22 ALA O O -8.797 3.120 -1.668 1.00 . A A . 22 ALA O 1 1 10 3848 1 1 23 GLU C C -7.534 4.165 1.453 1.00 . A A . 23 GLU C 1 1 10 3849 1 1 23 GLU CA C -8.138 2.837 1.046 1.00 . A A . 23 GLU CA 1 1 10 3850 1 1 23 GLU CB C -7.929 1.835 2.135 1.00 . A A . 23 GLU CB 1 1 10 3851 1 1 23 GLU CD C -9.439 -0.148 1.852 1.00 . A A . 23 GLU CD 1 1 10 3852 1 1 23 GLU CG C -8.069 0.434 1.599 1.00 . A A . 23 GLU CG 1 1 10 3853 1 1 23 GLU H H -6.648 1.764 0.073 1.00 . A A . 23 GLU H 1 1 10 3854 1 1 23 GLU HA H -9.183 2.931 0.838 1.00 . A A . 23 GLU HA 1 1 10 3855 1 1 23 GLU HB2 H -6.918 1.949 2.518 1.00 . A A . 23 GLU HB2 1 1 10 3856 1 1 23 GLU HB3 H -8.645 1.988 2.925 1.00 . A A . 23 GLU HB3 1 1 10 3857 1 1 23 GLU HG2 H -7.900 0.469 0.528 1.00 . A A . 23 GLU HG2 1 1 10 3858 1 1 23 GLU HG3 H -7.301 -0.188 2.041 1.00 . A A . 23 GLU HG3 1 1 10 3859 1 1 23 GLU N N -7.469 2.276 -0.086 1.00 . A A . 23 GLU N 1 1 10 3860 1 1 23 GLU O O -8.222 5.162 1.611 1.00 . A A . 23 GLU O 1 1 10 3861 1 1 23 GLU OE1 O -9.749 -0.457 3.020 1.00 . A A . 23 GLU OE1 1 1 10 3862 1 1 23 GLU OE2 O -10.208 -0.311 0.881 1.00 . A A . 23 GLU OE2 1 1 10 3863 1 1 24 LYS C C -4.709 5.905 1.072 1.00 . A A . 24 LYS C 1 1 10 3864 1 1 24 LYS CA C -5.466 5.235 2.190 1.00 . A A . 24 LYS CA 1 1 10 3865 1 1 24 LYS CB C -4.454 4.698 3.180 1.00 . A A . 24 LYS CB 1 1 10 3866 1 1 24 LYS CD C -5.735 3.461 5.041 1.00 . A A . 24 LYS CD 1 1 10 3867 1 1 24 LYS CE C -7.036 4.205 4.800 1.00 . A A . 24 LYS CE 1 1 10 3868 1 1 24 LYS CG C -4.860 3.369 3.798 1.00 . A A . 24 LYS CG 1 1 10 3869 1 1 24 LYS H H -5.779 3.255 1.589 1.00 . A A . 24 LYS H 1 1 10 3870 1 1 24 LYS HA H -6.112 5.941 2.674 1.00 . A A . 24 LYS HA 1 1 10 3871 1 1 24 LYS HB2 H -3.517 4.551 2.660 1.00 . A A . 24 LYS HB2 1 1 10 3872 1 1 24 LYS HB3 H -4.308 5.410 3.941 1.00 . A A . 24 LYS HB3 1 1 10 3873 1 1 24 LYS HD2 H -5.973 2.451 5.351 1.00 . A A . 24 LYS HD2 1 1 10 3874 1 1 24 LYS HD3 H -5.181 3.961 5.823 1.00 . A A . 24 LYS HD3 1 1 10 3875 1 1 24 LYS HE2 H -6.834 5.265 4.796 1.00 . A A . 24 LYS HE2 1 1 10 3876 1 1 24 LYS HE3 H -7.424 3.907 3.840 1.00 . A A . 24 LYS HE3 1 1 10 3877 1 1 24 LYS HG2 H -5.408 2.812 3.045 1.00 . A A . 24 LYS HG2 1 1 10 3878 1 1 24 LYS HG3 H -3.967 2.823 4.048 1.00 . A A . 24 LYS HG3 1 1 10 3879 1 1 24 LYS HZ1 H -8.434 2.950 5.717 1.00 . A A . 24 LYS HZ1 1 1 10 3880 1 1 24 LYS HZ2 H -8.833 4.595 5.803 1.00 . A A . 24 LYS HZ2 1 1 10 3881 1 1 24 LYS HZ3 H -7.610 3.965 6.794 1.00 . A A . 24 LYS HZ3 1 1 10 3882 1 1 24 LYS N N -6.241 4.109 1.709 1.00 . A A . 24 LYS N 1 1 10 3883 1 1 24 LYS NZ N -8.046 3.909 5.850 1.00 . A A . 24 LYS NZ 1 1 10 3884 1 1 24 LYS O O -4.752 7.120 0.886 1.00 . A A . 24 LYS O 1 1 10 3885 1 1 25 TYR C C -3.647 5.788 -1.913 1.00 . A A . 25 TYR C 1 1 10 3886 1 1 25 TYR CA C -3.001 5.488 -0.587 1.00 . A A . 25 TYR CA 1 1 10 3887 1 1 25 TYR CB C -2.020 4.350 -0.788 1.00 . A A . 25 TYR CB 1 1 10 3888 1 1 25 TYR CD1 C -2.343 2.992 1.189 1.00 . A A . 25 TYR CD1 1 1 10 3889 1 1 25 TYR CD2 C -0.185 3.914 0.891 1.00 . A A . 25 TYR CD2 1 1 10 3890 1 1 25 TYR CE1 C -1.950 2.382 2.319 1.00 . A A . 25 TYR CE1 1 1 10 3891 1 1 25 TYR CE2 C 0.242 3.301 2.055 1.00 . A A . 25 TYR CE2 1 1 10 3892 1 1 25 TYR CG C -1.494 3.759 0.460 1.00 . A A . 25 TYR CG 1 1 10 3893 1 1 25 TYR CZ C -0.653 2.529 2.771 1.00 . A A . 25 TYR CZ 1 1 10 3894 1 1 25 TYR H H -4.154 4.112 0.456 1.00 . A A . 25 TYR H 1 1 10 3895 1 1 25 TYR HA H -2.500 6.345 -0.184 1.00 . A A . 25 TYR HA 1 1 10 3896 1 1 25 TYR HB2 H -2.548 3.554 -1.275 1.00 . A A . 25 TYR HB2 1 1 10 3897 1 1 25 TYR HB3 H -1.204 4.665 -1.391 1.00 . A A . 25 TYR HB3 1 1 10 3898 1 1 25 TYR HD1 H -3.371 2.896 0.848 1.00 . A A . 25 TYR HD1 1 1 10 3899 1 1 25 TYR HD2 H 0.497 4.522 0.314 1.00 . A A . 25 TYR HD2 1 1 10 3900 1 1 25 TYR HE1 H -2.662 1.798 2.840 1.00 . A A . 25 TYR HE1 1 1 10 3901 1 1 25 TYR HE2 H 1.259 3.426 2.396 1.00 . A A . 25 TYR HE2 1 1 10 3902 1 1 25 TYR HH H -0.475 0.957 3.867 1.00 . A A . 25 TYR HH 1 1 10 3903 1 1 25 TYR N N -3.998 5.068 0.353 1.00 . A A . 25 TYR N 1 1 10 3904 1 1 25 TYR O O -3.547 6.893 -2.448 1.00 . A A . 25 TYR O 1 1 10 3905 1 1 25 TYR OH O -0.250 1.897 3.924 1.00 . A A . 25 TYR OH 1 1 10 3906 1 1 26 ALA C C -6.246 5.754 -3.507 1.00 . A A . 26 ALA C 1 1 10 3907 1 1 26 ALA CA C -5.031 4.861 -3.685 1.00 . A A . 26 ALA CA 1 1 10 3908 1 1 26 ALA CB C -5.447 3.481 -4.134 1.00 . A A . 26 ALA CB 1 1 10 3909 1 1 26 ALA H H -4.323 3.893 -1.933 1.00 . A A . 26 ALA H 1 1 10 3910 1 1 26 ALA HA H -4.371 5.286 -4.428 1.00 . A A . 26 ALA HA 1 1 10 3911 1 1 26 ALA HB1 H -6.005 3.552 -5.052 1.00 . A A . 26 ALA HB1 1 1 10 3912 1 1 26 ALA HB2 H -6.062 3.034 -3.364 1.00 . A A . 26 ALA HB2 1 1 10 3913 1 1 26 ALA HB3 H -4.566 2.876 -4.286 1.00 . A A . 26 ALA HB3 1 1 10 3914 1 1 26 ALA N N -4.311 4.761 -2.431 1.00 . A A . 26 ALA N 1 1 10 3915 1 1 26 ALA O O -6.841 6.216 -4.478 1.00 . A A . 26 ALA O 1 1 10 3916 1 1 27 ASN C C -7.491 8.235 -2.560 1.00 . A A . 27 ASN C 1 1 10 3917 1 1 27 ASN CA C -7.640 6.895 -1.842 1.00 . A A . 27 ASN CA 1 1 10 3918 1 1 27 ASN CB C -7.539 7.091 -0.333 1.00 . A A . 27 ASN CB 1 1 10 3919 1 1 27 ASN CG C -8.344 8.273 0.181 1.00 . A A . 27 ASN CG 1 1 10 3920 1 1 27 ASN H H -6.168 5.408 -1.544 1.00 . A A . 27 ASN H 1 1 10 3921 1 1 27 ASN HA H -8.603 6.471 -2.079 1.00 . A A . 27 ASN HA 1 1 10 3922 1 1 27 ASN HB2 H -7.892 6.194 0.157 1.00 . A A . 27 ASN HB2 1 1 10 3923 1 1 27 ASN HB3 H -6.499 7.236 -0.073 1.00 . A A . 27 ASN HB3 1 1 10 3924 1 1 27 ASN HD21 H -6.743 9.444 0.083 1.00 . A A . 27 ASN HD21 1 1 10 3925 1 1 27 ASN HD22 H -8.192 10.192 0.655 1.00 . A A . 27 ASN HD22 1 1 10 3926 1 1 27 ASN N N -6.610 5.944 -2.244 1.00 . A A . 27 ASN N 1 1 10 3927 1 1 27 ASN ND2 N -7.697 9.419 0.321 1.00 . A A . 27 ASN ND2 1 1 10 3928 1 1 27 ASN O O -8.376 8.580 -3.374 1.00 . A A . 27 ASN O 1 1 10 3929 1 1 27 ASN OXT O -6.474 8.926 -2.331 1.00 . A A . 27 ASN OXT 1 1 10 3930 1 1 27 ASN OD1 O -9.532 8.150 0.476 1.00 . A A . 27 ASN OD1 1 1 stop_ save_
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