NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
617125 | 5x37 | 36053 | cing | 4-filtered-FRED | STAR | entry | full | 798 |
data_FRED_restraints_with_modified_coordinates_PDB_code_5x37 # This FRED archive file contains, for PDB entry <5x37>: # # - 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_5x37 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 5x37 _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 3904.23 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 $Exoglucanase_1 A . 1 1 2 . 2 $ALPHA_D_MANNOSE B . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 MAN 1 MAN 1 1 stop_ save_ save_Exoglucanase_1 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Exoglucanase 1" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code TQSHYGQCGGIGYSGPTVCASGTTCQVLNPYYSQCL _Entity.Number_of_monomers 36 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 THR . 1 1 2 GLN . 1 1 3 SER . 1 1 4 HIS . 1 1 5 TYR . 1 1 6 GLY . 1 1 7 GLN . 1 1 8 CYS . 1 1 9 GLY . 1 1 10 GLY . 1 1 11 ILE . 1 1 12 GLY . 1 1 13 TYR . 1 1 14 SER . 1 1 15 GLY . 1 1 16 PRO . 1 1 17 THR . 1 1 18 VAL . 1 1 19 CYS . 1 1 20 ALA . 1 1 21 SER . 1 1 22 GLY . 1 1 23 THR . 1 1 24 THR . 1 1 25 CYS . 1 1 26 GLN . 1 1 27 VAL . 1 1 28 LEU . 1 1 29 ASN . 1 1 30 PRO . 1 1 31 TYR . 1 1 32 TYR . 1 1 33 SER . 1 1 34 GLN . 1 1 35 CYS . 1 1 36 LEU . 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 THR 1 1 1 1 GLN 2 2 1 1 SER 3 3 1 1 HIS 4 4 1 1 TYR 5 5 1 1 GLY 6 6 1 1 GLN 7 7 1 1 CYS 8 8 1 1 GLY 9 9 1 1 GLY 10 10 1 1 ILE 11 11 1 1 GLY 12 12 1 1 TYR 13 13 1 1 SER 14 14 1 1 GLY 15 15 1 1 PRO 16 16 1 1 THR 17 17 1 1 VAL 18 18 1 1 CYS 19 19 1 1 ALA 20 20 1 1 SER 21 21 1 1 GLY 22 22 1 1 THR 23 23 1 1 THR 24 24 1 1 CYS 25 25 1 1 GLN 26 26 1 1 VAL 27 27 1 1 LEU 28 28 1 1 ASN 29 29 1 1 PRO 30 30 1 1 TYR 31 31 1 1 TYR 32 32 1 1 SER 33 33 1 1 GLN 34 34 1 1 CYS 35 35 1 1 LEU 36 36 1 1 stop_ save_ save_ALPHA_D_MANNOSE _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "ALPHA D MANNOSE" _Entity.Type non-polymer 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 MAN $MAN 1 2 stop_ save_ save_MAN _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID MAN _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 2 . OR 1 1 5 2 . 3 . 1 1 5 3 . 4 . 1 1 5 4 . . . 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 2 . OR 1 1 15 2 . 3 . 1 1 15 3 . . . 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 2 . OR 1 1 23 2 . 3 . 1 1 23 3 . . . 1 1 24 1 2 . OR 1 1 24 2 . 3 . 1 1 24 3 . . . 1 1 25 1 2 . OR 1 1 25 2 . 3 . 1 1 25 3 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 2 . OR 1 1 29 2 . 3 . 1 1 29 3 . . . 1 1 30 1 2 . OR 1 1 30 2 . 3 . 1 1 30 3 . . . 1 1 31 1 . . . 1 1 32 1 2 . OR 1 1 32 2 . 3 . 1 1 32 3 . . . 1 1 33 1 2 . OR 1 1 33 2 . 3 . 1 1 33 3 . . . 1 1 34 1 2 . OR 1 1 34 2 . 3 . 1 1 34 3 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 2 . OR 1 1 38 2 . 3 . 1 1 38 3 . . . 1 1 39 1 2 . OR 1 1 39 2 . 3 . 1 1 39 3 . . . 1 1 40 1 2 . OR 1 1 40 2 . 3 . 1 1 40 3 . . . 1 1 41 1 2 . OR 1 1 41 2 . 3 . 1 1 41 3 . . . 1 1 42 1 . . . 1 1 43 1 2 . OR 1 1 43 2 . 3 . 1 1 43 3 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 2 . OR 1 1 47 2 . 3 . 1 1 47 3 . . . 1 1 48 1 . . . 1 1 49 1 2 . OR 1 1 49 2 . 3 . 1 1 49 3 . . . 1 1 50 1 . . . 1 1 51 1 2 . OR 1 1 51 2 . 3 . 1 1 51 3 . 4 . 1 1 51 4 . . . 1 1 52 1 . . . 1 1 53 1 2 . OR 1 1 53 2 . 3 . 1 1 53 3 . . . 1 1 54 1 2 . OR 1 1 54 2 . 3 . 1 1 54 3 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 2 . OR 1 1 59 2 . 3 . 1 1 59 3 . . . 1 1 60 1 . . . 1 1 61 1 2 . OR 1 1 61 2 . 3 . 1 1 61 3 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 2 . OR 1 1 65 2 . 3 . 1 1 65 3 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 2 . OR 1 1 68 2 . 3 . 1 1 68 3 . . . 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 2 . OR 1 1 80 2 . 3 . 1 1 80 3 . . . 1 1 81 1 . . . 1 1 82 1 2 . OR 1 1 82 2 . 3 . 1 1 82 3 . . . 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 2 . OR 1 1 93 2 . 3 . 1 1 93 3 . . . 1 1 94 1 . . . 1 1 95 1 2 . OR 1 1 95 2 . 3 . 1 1 95 3 . . . 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 2 . OR 1 1 105 2 . 3 . 1 1 105 3 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 2 . OR 1 1 108 2 . 3 . 1 1 108 3 . . . 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 2 . OR 1 1 118 2 . 3 . 1 1 118 3 . . . 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 2 . OR 1 1 144 2 . 3 . 1 1 144 3 . . . 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 2 . OR 1 1 163 2 . 3 . 1 1 163 3 . . . 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 2 . OR 1 1 170 2 . 3 . 1 1 170 3 . . . 1 1 171 1 . . . 1 1 172 1 2 . OR 1 1 172 2 . 3 . 1 1 172 3 . . . 1 1 173 1 2 . OR 1 1 173 2 . 3 . 1 1 173 3 . 4 . 1 1 173 4 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 2 . OR 1 1 176 2 . 3 . 1 1 176 3 . . . 1 1 177 1 2 . OR 1 1 177 2 . 3 . 1 1 177 3 . . . 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 2 . OR 1 1 191 2 . 3 . 1 1 191 3 . . . 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 2 . OR 1 1 224 2 . 3 . 1 1 224 3 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 2 . OR 1 1 227 2 . 3 . 1 1 227 3 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 2 . OR 1 1 232 2 . 3 . 1 1 232 3 . . . 1 1 233 1 2 . OR 1 1 233 2 . 3 . 1 1 233 3 . 4 . 1 1 233 4 . . . 1 1 234 1 2 . OR 1 1 234 2 . 3 . 1 1 234 3 . . . 1 1 235 1 2 . OR 1 1 235 2 . 3 . 1 1 235 3 . . . 1 1 236 1 . . . 1 1 237 1 2 . OR 1 1 237 2 . 3 . 1 1 237 3 . 4 . 1 1 237 4 . . . 1 1 238 1 2 . OR 1 1 238 2 . 3 . 1 1 238 3 . . . 1 1 239 1 . . . 1 1 240 1 2 . OR 1 1 240 2 . 3 . 1 1 240 3 . . . 1 1 241 1 2 . OR 1 1 241 2 . 3 . 1 1 241 3 . . . 1 1 242 1 2 . OR 1 1 242 2 . 3 . 1 1 242 3 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 2 . OR 1 1 248 2 . 3 . 1 1 248 3 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 2 . OR 1 1 252 2 . 3 . 1 1 252 3 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 2 . OR 1 1 258 2 . 3 . 1 1 258 3 . . . 1 1 259 1 . . . 1 1 260 1 2 . OR 1 1 260 2 . 3 . 1 1 260 3 . . . 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 2 . OR 1 1 277 2 . 3 . 1 1 277 3 . . . 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 2 . OR 1 1 285 2 . 3 . 1 1 285 3 . . . 1 1 286 1 2 . OR 1 1 286 2 . 3 . 1 1 286 3 . . . 1 1 287 1 2 . OR 1 1 287 2 . 3 . 1 1 287 3 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 2 . OR 1 1 291 2 . 3 . 1 1 291 3 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 2 . OR 1 1 297 2 . 3 . 1 1 297 3 . . . 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 2 . OR 1 1 312 2 . 3 . 1 1 312 3 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 2 . OR 1 1 320 2 . 3 . 1 1 320 3 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 2 . OR 1 1 327 2 . 3 . 1 1 327 3 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 2 . OR 1 1 330 2 . 3 . 1 1 330 3 . . . 1 1 331 1 2 . OR 1 1 331 2 . 3 . 1 1 331 3 . 4 . 1 1 331 4 . . . 1 1 332 1 . . . 1 1 333 1 2 . OR 1 1 333 2 . 3 . 1 1 333 3 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 2 . OR 1 1 340 2 . 3 . 1 1 340 3 . . . 1 1 341 1 2 . OR 1 1 341 2 . 3 . 1 1 341 3 . . . 1 1 342 1 2 . OR 1 1 342 2 . 3 . 1 1 342 3 . 4 . 1 1 342 4 . . . 1 1 343 1 2 . OR 1 1 343 2 . 3 . 1 1 343 3 . . . 1 1 344 1 2 . OR 1 1 344 2 . 3 . 1 1 344 3 . . . 1 1 345 1 2 . OR 1 1 345 2 . 3 . 1 1 345 3 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 2 . OR 1 1 351 2 . 3 . 1 1 351 3 . . . 1 1 352 1 . . . 1 1 353 1 2 . OR 1 1 353 2 . 3 . 1 1 353 3 . . . 1 1 354 1 2 . OR 1 1 354 2 . 3 . 1 1 354 3 . . . 1 1 355 1 2 . OR 1 1 355 2 . 3 . 1 1 355 3 . . . 1 1 356 1 2 . OR 1 1 356 2 . 3 . 1 1 356 3 . . . 1 1 357 1 2 . OR 1 1 357 2 . 3 . 1 1 357 3 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 2 . OR 1 1 360 2 . 3 . 1 1 360 3 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 2 . OR 1 1 363 2 . 3 . 1 1 363 3 . . . 1 1 364 1 . . . 1 1 365 1 . . . 1 1 366 1 . . . 1 1 367 1 . . . 1 1 368 1 . . . 1 1 369 1 . . . 1 1 370 1 . . . 1 1 371 1 . . . 1 1 372 1 . . . 1 1 373 1 . . . 1 1 374 1 2 . OR 1 1 374 2 . 3 . 1 1 374 3 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 2 . OR 1 1 379 2 . 3 . 1 1 379 3 . . . 1 1 380 1 2 . OR 1 1 380 2 . 3 . 1 1 380 3 . . . 1 1 381 1 . . . 1 1 382 1 2 . OR 1 1 382 2 . 3 . 1 1 382 3 . . . 1 1 383 1 2 . OR 1 1 383 2 . 3 . 1 1 383 3 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 2 . OR 1 1 387 2 . 3 . 1 1 387 3 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 2 . OR 1 1 391 2 . 3 . 1 1 391 3 . . . 1 1 392 1 . . . 1 1 393 1 . . . 1 1 394 1 . . . 1 1 395 1 . . . 1 1 396 1 . . . 1 1 397 1 . . . 1 1 398 1 . . . 1 1 399 1 . . . 1 1 400 1 . . . 1 1 401 1 . . . 1 1 402 1 . . . 1 1 403 1 . . . 1 1 404 1 . . . 1 1 405 1 . . . 1 1 406 1 . . . 1 1 407 1 2 . OR 1 1 407 2 . 3 . 1 1 407 3 . . . 1 1 408 1 . . . 1 1 409 1 . . . 1 1 410 1 . . . 1 1 411 1 . . . 1 1 412 1 . . . 1 1 413 1 . . . 1 1 414 1 . . . 1 1 415 1 . . . 1 1 416 1 . . . 1 1 417 1 . . . 1 1 418 1 . . . 1 1 419 1 . . . 1 1 420 1 . . . 1 1 421 1 . . . 1 1 422 1 . . . 1 1 423 1 . . . 1 1 424 1 . . . 1 1 425 1 . . . 1 1 426 1 . . . 1 1 427 1 . . . 1 1 428 1 . . . 1 1 429 1 . . . 1 1 430 1 . . . 1 1 431 1 . . . 1 1 432 1 . . . 1 1 433 1 . . . 1 1 434 1 . . . 1 1 435 1 . . . 1 1 436 1 . . . 1 1 437 1 . . . 1 1 438 1 . . . 1 1 439 1 . . . 1 1 440 1 . . . 1 1 441 1 . . . 1 1 442 1 . . . 1 1 443 1 . . . 1 1 444 1 . . . 1 1 445 1 . . . 1 1 446 1 . . . 1 1 447 1 . . . 1 1 448 1 . . . 1 1 449 1 . . . 1 1 450 1 . . . 1 1 451 1 . . . 1 1 452 1 . . . 1 1 453 1 . . . 1 1 454 1 . . . 1 1 455 1 . . . 1 1 456 1 . . . 1 1 457 1 . . . 1 1 458 1 . . . 1 1 459 1 . . . 1 1 460 1 . . . 1 1 461 1 . . . 1 1 462 1 . . . 1 1 463 1 . . . 1 1 464 1 . . . 1 1 465 1 . . . 1 1 466 1 2 . OR 1 1 466 2 . 3 . 1 1 466 3 . . . 1 1 467 1 . . . 1 1 468 1 . . . 1 1 469 1 . . . 1 1 470 1 . . . 1 1 471 1 . . . 1 1 472 1 . . . 1 1 473 1 . . . 1 1 474 1 . . . 1 1 475 1 . . . 1 1 476 1 . . . 1 1 477 1 . . . 1 1 478 1 . . . 1 1 479 1 . . . 1 1 480 1 . . . 1 1 481 1 . . . 1 1 482 1 . . . 1 1 483 1 . . . 1 1 484 1 . . . 1 1 485 1 . . . 1 1 486 1 . . . 1 1 487 1 . . . 1 1 488 1 . . . 1 1 489 1 . . . 1 1 490 1 . . . 1 1 491 1 . . . 1 1 492 1 . . . 1 1 493 1 . . . 1 1 494 1 . . . 1 1 495 1 . . . 1 1 496 1 . . . 1 1 497 1 . . . 1 1 498 1 . . . 1 1 499 1 . . . 1 1 500 1 . . . 1 1 501 1 . . . 1 1 502 1 . . . 1 1 503 1 2 . OR 1 1 503 2 . 3 . 1 1 503 3 . . . 1 1 504 1 . . . 1 1 505 1 . . . 1 1 506 1 . . . 1 1 507 1 . . . 1 1 508 1 . . . 1 1 509 1 . . . 1 1 510 1 . . . 1 1 511 1 . . . 1 1 512 1 . . . 1 1 513 1 . . . 1 1 514 1 2 . OR 1 1 514 2 . 3 . 1 1 514 3 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 2 . OR 1 1 519 2 . 3 . 1 1 519 3 . . . 1 1 520 1 2 . OR 1 1 520 2 . 3 . 1 1 520 3 . . . 1 1 521 1 . . . 1 1 522 1 . . . 1 1 523 1 . . . 1 1 524 1 . . . 1 1 525 1 . . . 1 1 526 1 . . . 1 1 527 1 2 . OR 1 1 527 2 . 3 . 1 1 527 3 . . . 1 1 528 1 . . . 1 1 529 1 . . . 1 1 530 1 . . . 1 1 531 1 . . . 1 1 532 1 . . . 1 1 533 1 . . . 1 1 534 1 2 . OR 1 1 534 2 . 3 . 1 1 534 3 . . . 1 1 535 1 . . . 1 1 536 1 2 . OR 1 1 536 2 . 3 . 1 1 536 3 . 4 . 1 1 536 4 . . . 1 1 537 1 . . . 1 1 538 1 2 . OR 1 1 538 2 . 3 . 1 1 538 3 . . . 1 1 539 1 . . . 1 1 540 1 2 . OR 1 1 540 2 . 3 . 1 1 540 3 . . . 1 1 541 1 . . . 1 1 542 1 . . . 1 1 543 1 . . . 1 1 544 1 2 . OR 1 1 544 2 . 3 . 1 1 544 3 . . . 1 1 545 1 . . . 1 1 546 1 . . . 1 1 547 1 . . . 1 1 548 1 . . . 1 1 549 1 2 . OR 1 1 549 2 . 3 . 1 1 549 3 . . . 1 1 550 1 . . . 1 1 551 1 . . . 1 1 552 1 . . . 1 1 553 1 . . . 1 1 554 1 . . . 1 1 555 1 . . . 1 1 556 1 2 . OR 1 1 556 2 . 3 . 1 1 556 3 . . . 1 1 557 1 2 . OR 1 1 557 2 . 3 . 1 1 557 3 . . . 1 1 558 1 . . . 1 1 559 1 . . . 1 1 560 1 . . . 1 1 561 1 . . . 1 1 562 1 . . . 1 1 563 1 . . . 1 1 564 1 . . . 1 1 565 1 . . . 1 1 566 1 . . . 1 1 567 1 . . . 1 1 568 1 . . . 1 1 569 1 . . . 1 1 570 1 . . . 1 1 571 1 . . . 1 1 572 1 . . . 1 1 573 1 . . . 1 1 574 1 . . . 1 1 575 1 . . . 1 1 576 1 2 . OR 1 1 576 2 . 3 . 1 1 576 3 . . . 1 1 577 1 . . . 1 1 578 1 . . . 1 1 579 1 . . . 1 1 580 1 2 . OR 1 1 580 2 . 3 . 1 1 580 3 . . . 1 1 581 1 . . . 1 1 582 1 2 . OR 1 1 582 2 . 3 . 1 1 582 3 . . . 1 1 583 1 . . . 1 1 584 1 . . . 1 1 585 1 . . . 1 1 586 1 . . . 1 1 587 1 . . . 1 1 588 1 . . . 1 1 589 1 . . . 1 1 590 1 . . . 1 1 591 1 . . . 1 1 592 1 . . . 1 1 593 1 . . . 1 1 594 1 . . . 1 1 595 1 . . . 1 1 596 1 . . . 1 1 597 1 . . . 1 1 598 1 . . . 1 1 599 1 . . . 1 1 600 1 . . . 1 1 601 1 . . . 1 1 602 1 . . . 1 1 603 1 . . . 1 1 604 1 . . . 1 1 605 1 . . . 1 1 606 1 . . . 1 1 607 1 . . . 1 1 608 1 . . . 1 1 609 1 . . . 1 1 610 1 . . . 1 1 611 1 . . . 1 1 612 1 . . . 1 1 613 1 . . . 1 1 614 1 . . . 1 1 615 1 . . . 1 1 616 1 . . . 1 1 617 1 . . . 1 1 618 1 . . . 1 1 619 1 . . . 1 1 620 1 . . . 1 1 621 1 . . . 1 1 622 1 . . . 1 1 623 1 . . . 1 1 624 1 . . . 1 1 625 1 . . . 1 1 626 1 . . . 1 1 627 1 . . . 1 1 628 1 . . . 1 1 629 1 . . . 1 1 630 1 . . . 1 1 631 1 . . . 1 1 632 1 . . . 1 1 633 1 . . . 1 1 634 1 . . . 1 1 635 1 . . . 1 1 636 1 . . . 1 1 637 1 . . . 1 1 638 1 . . . 1 1 639 1 . . . 1 1 640 1 . . . 1 1 641 1 . . . 1 1 642 1 . . . 1 1 643 1 . . . 1 1 644 1 . . . 1 1 645 1 . . . 1 1 646 1 . . . 1 1 647 1 . . . 1 1 648 1 . . . 1 1 649 1 . . . 1 1 650 1 . . . 1 1 651 1 . . . 1 1 652 1 . . . 1 1 653 1 . . . 1 1 654 1 . . . 1 1 655 1 . . . 1 1 656 1 . . . 1 1 657 1 . . . 1 1 658 1 . . . 1 1 659 1 . . . 1 1 660 1 . . . 1 1 661 1 . . . 1 1 662 1 . . . 1 1 663 1 . . . 1 1 664 1 . . . 1 1 665 1 . . . 1 1 666 1 . . . 1 1 667 1 . . . 1 1 668 1 . . . 1 1 669 1 . . . 1 1 670 1 . . . 1 1 671 1 . . . 1 1 672 1 . . . 1 1 673 1 . . . 1 1 674 1 . . . 1 1 675 1 . . . 1 1 676 1 . . . 1 1 677 1 . . . 1 1 678 1 . . . 1 1 679 1 . . . 1 1 680 1 . . . 1 1 681 1 . . . 1 1 682 1 . . . 1 1 683 1 . . . 1 1 684 1 . . . 1 1 685 1 . . . 1 1 686 1 . . . 1 1 687 1 . . . 1 1 688 1 . . . 1 1 689 1 . . . 1 1 690 1 . . . 1 1 691 1 . . . 1 1 692 1 . . . 1 1 693 1 . . . 1 1 694 1 . . . 1 1 695 1 . . . 1 1 696 1 2 . OR 1 1 696 2 . 3 . 1 1 696 3 . . . 1 1 697 1 . . . 1 1 698 1 . . . 1 1 699 1 . . . 1 1 700 1 . . . 1 1 701 1 . . . 1 1 702 1 . . . 1 1 703 1 . . . 1 1 704 1 . . . 1 1 705 1 . . . 1 1 706 1 . . . 1 1 707 1 . . . 1 1 708 1 . . . 1 1 709 1 . . . 1 1 710 1 . . . 1 1 711 1 . . . 1 1 712 1 . . . 1 1 713 1 . . . 1 1 714 1 . . . 1 1 715 1 . . . 1 1 716 1 . . . 1 1 717 1 . . . 1 1 718 1 . . . 1 1 719 1 . . . 1 1 720 1 . . . 1 1 721 1 . . . 1 1 722 1 . . . 1 1 723 1 . . . 1 1 724 1 . . . 1 1 725 1 . . . 1 1 726 1 . . . 1 1 727 1 . . . 1 1 728 1 . . . 1 1 729 1 . . . 1 1 730 1 . . . 1 1 731 1 . . . 1 1 732 1 . . . 1 1 733 1 . . . 1 1 734 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 THR HA . 1 . HA 1 1 1 1 2 1 1 1 THR HB . 1 . HB 1 1 2 1 1 1 1 1 THR HA . 1 . HA 1 1 2 1 2 1 1 1 THR MG . 1 . HG2* 1 1 3 1 1 1 1 1 THR HA . 1 . HA 1 1 3 1 2 1 1 2 GLN H . 2 . HN 1 1 4 1 1 1 1 1 THR HA . 1 . HA 1 1 4 1 2 1 1 2 GLN HB2 . 2 . HB2 1 1 4 1 2 1 1 16 PRO HB2 . 16 . HB2 1 1 5 2 1 1 1 1 THR HA . 1 . HA 1 1 5 2 2 1 1 19 CYS H . 19 . HN 1 1 5 3 1 1 1 2 GLN HE21 . 2 . HE21 1 1 5 3 2 1 1 3 SER HB2 . 3 . HB2 1 1 5 4 1 1 1 29 ASN H . 29 . HN 1 1 5 4 1 1 1 31 TYR H . 31 . HN 1 1 5 4 2 1 1 30 PRO HD3 . 30 . HD1 1 1 6 1 1 1 1 1 THR HA . 1 . HA 1 1 6 1 2 1 1 17 THR H . 17 . HN 1 1 6 1 2 1 1 21 SER H . 21 . HN 1 1 7 1 1 1 1 1 THR HA . 1 . HA 1 1 7 1 2 1 1 18 VAL HB . 18 . HB 1 1 8 1 1 1 1 1 THR HA . 1 . HA 1 1 8 1 2 1 1 18 VAL MG1 . 18 . HG1* 1 1 9 1 1 1 1 1 THR HA . 1 . HA 1 1 9 1 2 1 1 19 CYS HA . 19 . HA 1 1 10 1 1 1 1 1 THR HB . 1 . HB 1 1 10 1 2 1 1 2 GLN H . 2 . HN 1 1 11 1 1 1 1 1 THR HB . 1 . HB 1 1 11 1 1 1 1 18 VAL HA . 18 . HA 1 1 11 1 2 1 1 18 VAL HB . 18 . HB 1 1 12 1 1 1 1 1 THR HB . 1 . HB 1 1 12 1 1 1 1 18 VAL HA . 18 . HA 1 1 12 1 1 1 1 20 ALA HA . 20 . HA 1 1 12 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 13 1 1 1 1 1 THR HB . 1 . HB 1 1 13 1 2 1 1 20 ALA MB . 20 . HB* 1 1 14 1 1 1 1 1 THR MG . 1 . HG2* 1 1 14 1 2 1 1 2 GLN H . 2 . HN 1 1 15 2 1 1 1 1 THR MG . 1 . HG2* 1 1 15 2 2 1 1 3 SER HA . 3 . HA 1 1 15 3 1 1 1 30 PRO HB2 . 30 . HB2 1 1 15 3 2 1 1 31 TYR HA . 31 . HA 1 1 16 1 1 1 1 1 THR MG . 1 . HG2* 1 1 16 1 2 1 1 18 VAL HB . 18 . HB 1 1 17 1 1 1 1 1 THR MG . 1 . HG2* 1 1 17 1 2 1 1 18 VAL MG1 . 18 . HG1* 1 1 18 1 1 1 1 1 THR MG . 1 . HG2* 1 1 18 1 2 1 1 20 ALA H . 20 . HN 1 1 19 1 1 1 1 1 THR MG . 1 . HG2* 1 1 19 1 2 1 1 20 ALA HA . 20 . HA 1 1 20 1 1 1 1 1 THR MG . 1 . HG2* 1 1 20 1 2 1 1 21 SER H . 21 . HN 1 1 21 1 1 1 1 2 GLN H . 2 . HN 1 1 21 1 2 1 1 2 GLN HB2 . 2 . HB2 1 1 22 1 1 1 1 2 GLN H . 2 . HN 1 1 22 1 2 1 1 2 GLN HB3 . 2 . HB1 1 1 23 2 1 1 1 2 GLN HA . 2 . HA 1 1 23 2 2 1 1 2 GLN HB2 . 2 . HB2 1 1 23 3 1 1 1 28 LEU HA . 28 . HA 1 1 23 3 2 1 1 28 LEU HB3 . 28 . HB1 1 1 23 3 2 1 1 28 LEU HG . 28 . HG 1 1 24 2 1 1 1 2 GLN HA . 2 . HA 1 1 24 2 2 1 1 2 GLN HE21 . 2 . HE21 1 1 24 3 1 1 1 28 LEU HA . 28 . HA 1 1 24 3 2 1 1 29 ASN H . 29 . HN 1 1 25 2 1 1 1 2 GLN HA . 2 . HA 1 1 25 2 1 1 1 17 THR HA . 17 . HA 1 1 25 2 2 1 1 2 GLN HE22 . 2 . HE22 1 1 25 3 1 1 1 23 THR HA . 23 . HA 1 1 25 3 2 1 1 26 GLN HE21 . 26 . HE21 1 1 26 1 1 1 1 2 GLN HA . 2 . HA 1 1 26 1 2 1 1 3 SER H . 3 . HN 1 1 27 1 1 1 1 2 GLN QB . 2 . HB2 1 1 27 1 2 1 1 2 GLN HG3 . 2 . HG1 1 1 28 1 1 1 1 2 GLN QB . 2 . HB2 1 1 28 1 2 1 1 20 ALA H . 20 . HN 1 1 29 2 1 1 1 2 GLN HB2 . 2 . HB2 1 1 29 2 2 1 1 2 GLN HE21 . 2 . HE21 1 1 29 3 1 1 1 28 LEU HB3 . 28 . HB1 1 1 29 3 2 1 1 29 ASN H . 29 . HN 1 1 30 2 1 1 1 2 GLN HB2 . 2 . HB2 1 1 30 2 2 1 1 2 GLN HE22 . 2 . HE22 1 1 30 3 1 1 1 28 LEU HB3 . 28 . HB1 1 1 30 3 2 1 1 29 ASN HD22 . 29 . HD22 1 1 31 1 1 1 1 2 GLN HB2 . 2 . HB2 1 1 31 1 2 1 1 2 GLN HG2 . 2 . HG2 1 1 32 2 1 1 1 2 GLN HB2 . 2 . HB2 1 1 32 2 2 1 1 8 CYS HA . 8 . HA 1 1 32 3 1 1 1 28 LEU HB3 . 28 . HB1 1 1 32 3 1 1 1 28 LEU HG . 28 . HG 1 1 32 3 2 1 1 33 SER HA . 33 . HA 1 1 33 2 1 1 1 2 GLN HB2 . 2 . HB2 1 1 33 2 2 1 1 8 CYS HA . 8 . HA 1 1 33 3 1 1 1 28 LEU HG . 28 . HG 1 1 33 3 2 1 1 33 SER HA . 33 . HA 1 1 34 2 1 1 1 2 GLN HB2 . 2 . HB2 1 1 34 2 2 1 1 8 CYS HB3 . 8 . HB1 1 1 34 3 1 1 1 28 LEU HB3 . 28 . HB1 1 1 34 3 2 1 1 32 TYR HB2 . 32 . HB2 1 1 35 1 1 1 1 2 GLN HB2 . 2 . HB2 1 1 35 1 1 1 1 16 PRO HB2 . 16 . HB2 1 1 35 1 2 1 1 16 PRO HD2 . 16 . HD2 1 1 36 1 1 1 1 2 GLN HB2 . 2 . HB2 1 1 36 1 1 1 1 16 PRO HB2 . 16 . HB2 1 1 36 1 2 1 1 16 PRO HG2 . 16 . HG2 1 1 37 1 1 1 1 2 GLN HB2 . 2 . HB2 1 1 37 1 2 1 1 19 CYS HA . 19 . HA 1 1 38 2 1 1 1 2 GLN HB3 . 2 . HB1 1 1 38 2 2 1 1 2 GLN HE21 . 2 . HE21 1 1 38 3 1 1 1 28 LEU H . 28 . HN 1 1 38 3 2 1 1 28 LEU HB2 . 28 . HB2 1 1 39 2 1 1 1 2 GLN HB3 . 2 . HB1 1 1 39 2 2 1 1 2 GLN HE21 . 2 . HE21 1 1 39 3 1 1 1 28 LEU HB2 . 28 . HB2 1 1 39 3 2 1 1 29 ASN H . 29 . HN 1 1 40 2 1 1 1 2 GLN HB3 . 2 . HB1 1 1 40 2 2 1 1 2 GLN HE22 . 2 . HE22 1 1 40 3 1 1 1 26 GLN HB2 . 26 . HB2 1 1 40 3 2 1 1 26 GLN HE21 . 26 . HE21 1 1 41 2 1 1 1 2 GLN HB3 . 2 . HB1 1 1 41 2 2 1 1 2 GLN HG2 . 2 . HG2 1 1 41 3 1 1 1 30 PRO HB3 . 30 . HB1 1 1 41 3 2 1 1 30 PRO HG3 . 30 . HG1 1 1 42 1 1 1 1 2 GLN HB3 . 2 . HB1 1 1 42 1 2 1 1 3 SER H . 3 . HN 1 1 43 2 1 1 1 2 GLN HB3 . 2 . HB1 1 1 43 2 2 1 1 8 CYS HA . 8 . HA 1 1 43 3 1 1 1 28 LEU HB2 . 28 . HB2 1 1 43 3 2 1 1 33 SER HA . 33 . HA 1 1 44 1 1 1 1 2 GLN HB3 . 2 . HB1 1 1 44 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1 45 1 1 1 1 2 GLN HB3 . 2 . HB1 1 1 45 1 2 1 1 19 CYS HA . 19 . HA 1 1 46 1 1 1 1 2 GLN HB3 . 2 . HB1 1 1 46 1 1 1 1 34 GLN HB3 . 34 . HB1 1 1 46 1 2 1 1 35 CYS H . 35 . HN 1 1 47 2 1 1 1 2 GLN HE21 . 2 . HE21 1 1 47 2 2 1 1 2 GLN HG2 . 2 . HG2 1 1 47 3 1 1 1 26 GLN HG2 . 26 . HG2 1 1 47 3 2 1 1 27 VAL H . 27 . HN 1 1 48 1 1 1 1 2 GLN HE21 . 2 . HE21 1 1 48 1 2 1 1 2 GLN HG3 . 2 . HG1 1 1 49 2 1 1 1 2 GLN HE21 . 2 . HE21 1 1 49 2 2 1 1 3 SER HB2 . 3 . HB2 1 1 49 3 1 1 1 29 ASN H . 29 . HN 1 1 49 3 1 1 1 31 TYR H . 31 . HN 1 1 49 3 2 1 1 30 PRO HD3 . 30 . HD1 1 1 50 1 1 1 1 2 GLN HE21 . 2 . HE21 1 1 50 1 1 1 1 7 GLN H . 7 . HN 1 1 50 1 2 1 1 6 GLY HA3 . 6 . HA1 1 1 51 2 1 1 1 2 GLN HE21 . 2 . HE21 1 1 51 2 2 1 1 8 CYS H . 8 . HN 1 1 51 3 1 1 1 10 GLY H . 10 . HN 1 1 51 3 2 1 1 13 TYR H . 13 . HN 1 1 51 4 1 1 1 29 ASN H . 29 . HN 1 1 51 4 2 1 1 32 TYR H . 32 . HN 1 1 52 1 1 1 1 2 GLN HE21 . 2 . HE21 1 1 52 1 2 1 1 8 CYS HA . 8 . HA 1 1 53 2 1 1 1 2 GLN HE21 . 2 . HE21 1 1 53 2 2 1 1 8 CYS HB3 . 8 . HB1 1 1 53 3 1 1 1 10 GLY H . 10 . HN 1 1 53 3 2 1 1 13 TYR HB2 . 13 . HB2 1 1 54 2 1 1 1 2 GLN HE21 . 2 . HE21 1 1 54 2 2 1 1 8 CYS HB3 . 8 . HB1 1 1 54 3 1 1 1 10 GLY H . 10 . HN 1 1 54 3 2 1 1 33 SER HB2 . 33 . HB2 1 1 55 1 1 1 1 2 GLN HE21 . 2 . HE21 1 1 55 1 1 1 1 19 CYS H . 19 . HN 1 1 55 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 56 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1 56 1 2 1 1 2 GLN HG3 . 2 . HG1 1 1 57 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1 57 1 2 1 1 3 SER HB2 . 3 . HB2 1 1 58 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1 58 1 2 1 1 6 GLY HA3 . 6 . HA1 1 1 59 2 1 1 1 2 GLN HE22 . 2 . HE22 1 1 59 2 2 1 1 7 GLN HB2 . 7 . HB2 1 1 59 3 1 1 1 26 GLN HB3 . 26 . HB1 1 1 59 3 2 1 1 26 GLN HE21 . 26 . HE21 1 1 60 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1 60 1 2 1 1 7 GLN HB3 . 7 . HB1 1 1 61 2 1 1 1 2 GLN HE22 . 2 . HE22 1 1 61 2 2 1 1 7 GLN HG2 . 7 . HG2 1 1 61 3 1 1 1 28 LEU MD1 . 28 . HD1* 1 1 61 3 2 1 1 29 ASN HD22 . 29 . HD22 1 1 62 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1 62 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 63 1 1 1 1 2 GLN HE22 . 2 . HE22 1 1 63 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 64 1 1 1 1 2 GLN HG2 . 2 . HG2 1 1 64 1 2 1 1 3 SER H . 3 . HN 1 1 65 2 1 1 1 2 GLN HG2 . 2 . HG2 1 1 65 2 2 1 1 3 SER HB2 . 3 . HB2 1 1 65 3 1 1 1 30 PRO HB3 . 30 . HB1 1 1 65 3 2 1 1 30 PRO HD3 . 30 . HD1 1 1 66 1 1 1 1 2 GLN HG2 . 2 . HG2 1 1 66 1 2 1 1 6 GLY HA3 . 6 . HA1 1 1 67 1 1 1 1 2 GLN HG2 . 2 . HG2 1 1 67 1 2 1 1 6 GLY HA3 . 6 . HA1 1 1 67 1 2 1 1 16 PRO HD2 . 16 . HD2 1 1 68 2 1 1 1 2 GLN HG2 . 2 . HG2 1 1 68 2 2 1 1 8 CYS HA . 8 . HA 1 1 68 3 1 1 1 7 GLN HG3 . 7 . HG1 1 1 68 3 2 1 1 33 SER HA . 33 . HA 1 1 69 1 1 1 1 2 GLN HG2 . 2 . HG2 1 1 69 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 69 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 70 1 1 1 1 2 GLN HG3 . 2 . HG1 1 1 70 1 2 1 1 3 SER H . 3 . HN 1 1 71 1 1 1 1 2 GLN HG3 . 2 . HG1 1 1 71 1 2 1 1 6 GLY HA2 . 6 . HA2 1 1 72 1 1 1 1 2 GLN HG3 . 2 . HG1 1 1 72 1 2 1 1 6 GLY HA3 . 6 . HA1 1 1 73 1 1 1 1 2 GLN HG3 . 2 . HG1 1 1 73 1 2 1 1 8 CYS HA . 8 . HA 1 1 74 1 1 1 1 2 GLN HG3 . 2 . HG1 1 1 74 1 2 1 1 16 PRO HD2 . 16 . HD2 1 1 75 1 1 1 1 3 SER H . 3 . HN 1 1 75 1 2 1 1 3 SER QB . 3 . HB2 1 1 76 1 1 1 1 3 SER H . 3 . HN 1 1 76 1 1 1 1 4 HIS H . 4 . HN 1 1 76 1 2 1 1 3 SER HB2 . 3 . HB2 1 1 77 1 1 1 1 3 SER H . 3 . HN 1 1 77 1 1 1 1 4 HIS H . 4 . HN 1 1 77 1 2 1 1 3 SER HB3 . 3 . HB1 1 1 78 1 1 1 1 3 SER HA . 3 . HA 1 1 78 1 2 1 1 3 SER HB2 . 3 . HB2 1 1 79 1 1 1 1 3 SER HA . 3 . HA 1 1 79 1 2 1 1 3 SER HB3 . 3 . HB1 1 1 80 2 1 1 1 3 SER HA . 3 . HA 1 1 80 2 2 1 1 3 SER HB3 . 3 . HB1 1 1 80 3 1 1 1 10 GLY HA3 . 10 . HA1 1 1 80 3 2 1 1 31 TYR HA . 31 . HA 1 1 81 1 1 1 1 3 SER HA . 3 . HA 1 1 81 1 2 1 1 4 HIS H . 4 . HN 1 1 82 2 1 1 1 3 SER HA . 3 . HA 1 1 82 2 2 1 1 20 ALA MB . 20 . HB* 1 1 82 3 1 1 1 11 ILE HB . 11 . HB 1 1 82 3 2 1 1 31 TYR HA . 31 . HA 1 1 83 1 1 1 1 3 SER HA . 3 . HA 1 1 83 1 2 1 1 20 ALA MB . 20 . HB* 1 1 84 1 1 1 1 3 SER QB . 3 . HB2 1 1 84 1 2 1 1 4 HIS H . 4 . HN 1 1 85 1 1 1 1 4 HIS H . 4 . HN 1 1 85 1 2 1 1 4 HIS HA . 4 . HA 1 1 86 1 1 1 1 4 HIS H . 4 . HN 1 1 86 1 2 1 1 4 HIS HB2 . 4 . HB2 1 1 87 1 1 1 1 4 HIS H . 4 . HN 1 1 87 1 2 1 1 4 HIS HB3 . 4 . HB1 1 1 88 1 1 1 1 4 HIS H . 4 . HN 1 1 88 1 2 1 1 5 TYR H . 5 . HN 1 1 89 1 1 1 1 4 HIS H . 4 . HN 1 1 89 1 2 1 1 20 ALA MB . 20 . HB* 1 1 90 1 1 1 1 4 HIS H . 4 . HN 1 1 90 1 2 1 1 23 THR MG . 23 . HG2* 1 1 91 1 1 1 1 4 HIS HA . 4 . HA 1 1 91 1 2 1 1 4 HIS HB2 . 4 . HB2 1 1 92 1 1 1 1 4 HIS HA . 4 . HA 1 1 92 1 2 1 1 4 HIS HB2 . 4 . HB2 1 1 92 1 2 1 1 35 CYS HB3 . 35 . HB1 1 1 93 2 1 1 1 4 HIS HA . 4 . HA 1 1 93 2 2 1 1 4 HIS HB3 . 4 . HB1 1 1 93 3 1 1 1 5 TYR HA . 5 . HA 1 1 93 3 2 1 1 5 TYR HB3 . 5 . HB1 1 1 94 1 1 1 1 4 HIS HA . 4 . HA 1 1 94 1 2 1 1 4 HIS HD2 . 4 . HD2 1 1 95 2 1 1 1 4 HIS HA . 4 . HA 1 1 95 2 2 1 1 4 HIS HD2 . 4 . HD2 1 1 95 3 1 1 1 5 TYR HA . 5 . HA 1 1 95 3 2 1 1 5 TYR QD . 5 . HD* 1 1 96 1 1 1 1 4 HIS HA . 4 . HA 1 1 96 1 1 1 1 5 TYR HA . 5 . HA 1 1 96 1 2 1 1 5 TYR H . 5 . HN 1 1 97 1 1 1 1 4 HIS HA . 4 . HA 1 1 97 1 1 1 1 5 TYR HA . 5 . HA 1 1 97 1 1 1 1 6 GLY HA2 . 6 . HA2 1 1 97 1 2 1 1 35 CYS H . 35 . HN 1 1 98 1 1 1 1 4 HIS HA . 4 . HA 1 1 98 1 1 1 1 5 TYR HA . 5 . HA 1 1 98 1 2 1 1 35 CYS H . 35 . HN 1 1 99 1 1 1 1 4 HIS HA . 4 . HA 1 1 99 1 2 1 1 23 THR MG . 23 . HG2* 1 1 100 1 1 1 1 4 HIS HA . 4 . HA 1 1 100 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 101 1 1 1 1 4 HIS HA . 4 . HA 1 1 101 1 2 1 1 35 CYS HB3 . 35 . HB1 1 1 102 1 1 1 1 4 HIS HB2 . 4 . HB2 1 1 102 1 2 1 1 4 HIS HD2 . 4 . HD2 1 1 103 1 1 1 1 4 HIS HB2 . 4 . HB2 1 1 103 1 1 1 1 35 CYS HB3 . 35 . HB1 1 1 103 1 2 1 1 4 HIS HD2 . 4 . HD2 1 1 104 1 1 1 1 4 HIS HB2 . 4 . HB2 1 1 104 1 2 1 1 5 TYR H . 5 . HN 1 1 105 2 1 1 1 4 HIS HB2 . 4 . HB2 1 1 105 2 2 1 1 5 TYR QE . 5 . HE* 1 1 105 3 1 1 1 13 TYR HB3 . 13 . HB1 1 1 105 3 2 1 1 13 TYR QE . 13 . HE* 1 1 106 1 1 1 1 4 HIS HB2 . 4 . HB2 1 1 106 1 2 1 1 23 THR MG . 23 . HG2* 1 1 107 1 1 1 1 4 HIS HB3 . 4 . HB1 1 1 107 1 2 1 1 4 HIS HD2 . 4 . HD2 1 1 108 2 1 1 1 4 HIS HB3 . 4 . HB1 1 1 108 2 2 1 1 4 HIS HE1 . 4 . HE1 1 1 108 3 1 1 1 25 CYS HB2 . 25 . HB2 1 1 108 3 2 1 1 35 CYS H . 35 . HN 1 1 109 1 1 1 1 4 HIS HB3 . 4 . HB1 1 1 109 1 1 1 1 5 TYR HB3 . 5 . HB1 1 1 109 1 2 1 1 5 TYR H . 5 . HN 1 1 110 1 1 1 1 4 HIS HB3 . 4 . HB1 1 1 110 1 1 1 1 5 TYR HB3 . 5 . HB1 1 1 110 1 2 1 1 5 TYR QE . 5 . HE* 1 1 111 1 1 1 1 4 HIS HB3 . 4 . HB1 1 1 111 1 1 1 1 5 TYR HB3 . 5 . HB1 1 1 111 1 2 1 1 6 GLY H . 6 . HN 1 1 112 1 1 1 1 4 HIS HB3 . 4 . HB1 1 1 112 1 2 1 1 23 THR MG . 23 . HG2* 1 1 113 1 1 1 1 4 HIS HB3 . 4 . HB1 1 1 113 1 1 1 1 35 CYS HB2 . 35 . HB2 1 1 113 1 2 1 1 23 THR MG . 23 . HG2* 1 1 114 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 114 1 1 1 1 5 TYR QD . 5 . HD* 1 1 114 1 2 1 1 4 HIS HE1 . 4 . HE1 1 1 115 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 115 1 2 1 1 5 TYR H . 5 . HN 1 1 116 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 116 1 2 1 1 5 TYR HB2 . 5 . HB2 1 1 117 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 117 1 1 1 1 5 TYR QD . 5 . HD* 1 1 117 1 2 1 1 6 GLY H . 6 . HN 1 1 118 2 1 1 1 4 HIS HD2 . 4 . HD2 1 1 118 2 2 1 1 36 LEU QB . 36 . HB* 1 1 118 3 1 1 1 5 TYR QD . 5 . HD* 1 1 118 3 2 1 1 34 GLN HB2 . 34 . HB2 1 1 119 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 119 1 1 1 1 5 TYR QD . 5 . HD* 1 1 119 1 2 1 1 36 LEU MD2 . 36 . HD2* 1 1 120 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 120 1 1 1 1 5 TYR QD . 5 . HD* 1 1 120 1 2 1 1 36 LEU HG . 36 . HG 1 1 121 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 121 1 2 1 1 20 ALA MB . 20 . HB* 1 1 121 1 2 1 1 36 LEU HG . 36 . HG 1 1 122 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 122 1 2 1 1 23 THR HB . 23 . HB 1 1 123 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 123 1 2 1 1 23 THR MG . 23 . HG2* 1 1 124 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 124 1 2 1 1 34 GLN QG . 34 . HG* 1 1 125 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 125 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 126 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 126 1 2 1 1 36 LEU HA . 36 . HA 1 1 127 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 127 1 2 1 1 36 LEU QB . 36 . HB* 1 1 128 1 1 1 1 4 HIS HD2 . 4 . HD2 1 1 128 1 2 1 1 36 LEU MD2 . 36 . HD2* 1 1 129 1 1 1 1 4 HIS HE1 . 4 . HE1 1 1 129 1 2 1 1 5 TYR QE . 5 . HE* 1 1 130 1 1 1 1 4 HIS HE1 . 4 . HE1 1 1 130 1 2 1 1 23 THR MG . 23 . HG2* 1 1 131 1 1 1 1 4 HIS HE1 . 4 . HE1 1 1 131 1 1 1 1 35 CYS H . 35 . HN 1 1 131 1 2 1 1 36 LEU HA . 36 . HA 1 1 132 1 1 1 1 4 HIS HE1 . 4 . HE1 1 1 132 1 1 1 1 35 CYS H . 35 . HN 1 1 132 1 2 1 1 36 LEU MD2 . 36 . HD2* 1 1 133 1 1 1 1 5 TYR H . 5 . HN 1 1 133 1 2 1 1 5 TYR HB2 . 5 . HB2 1 1 134 1 1 1 1 5 TYR H . 5 . HN 1 1 134 1 2 1 1 5 TYR QD . 5 . HD* 1 1 135 1 1 1 1 5 TYR H . 5 . HN 1 1 135 1 2 1 1 6 GLY H . 6 . HN 1 1 136 1 1 1 1 5 TYR H . 5 . HN 1 1 136 1 2 1 1 23 THR MG . 23 . HG2* 1 1 137 1 1 1 1 5 TYR H . 5 . HN 1 1 137 1 2 1 1 34 GLN QG . 34 . HG* 1 1 138 1 1 1 1 5 TYR H . 5 . HN 1 1 138 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 139 1 1 1 1 5 TYR H . 5 . HN 1 1 139 1 2 1 1 35 CYS HB3 . 35 . HB1 1 1 140 1 1 1 1 5 TYR H . 5 . HN 1 1 140 1 2 1 1 36 LEU MD2 . 36 . HD2* 1 1 141 1 1 1 1 5 TYR HA . 5 . HA 1 1 141 1 2 1 1 5 TYR HB2 . 5 . HB2 1 1 142 1 1 1 1 5 TYR HA . 5 . HA 1 1 142 1 2 1 1 5 TYR QD . 5 . HD* 1 1 143 1 1 1 1 5 TYR HA . 5 . HA 1 1 143 1 2 1 1 5 TYR QE . 5 . HE* 1 1 144 2 1 1 1 5 TYR HA . 5 . HA 1 1 144 2 2 1 1 5 TYR QE . 5 . HE* 1 1 144 3 1 1 1 13 TYR QE . 13 . HE* 1 1 144 3 2 1 1 15 GLY HA2 . 15 . HA2 1 1 145 1 1 1 1 5 TYR HA . 5 . HA 1 1 145 1 2 1 1 5 TYR QE . 5 . HE* 1 1 145 1 2 1 1 32 TYR QE . 32 . HE* 1 1 146 1 1 1 1 5 TYR HA . 5 . HA 1 1 146 1 2 1 1 6 GLY H . 6 . HN 1 1 147 1 1 1 1 5 TYR HA . 5 . HA 1 1 147 1 1 1 1 6 GLY HA2 . 6 . HA2 1 1 147 1 2 1 1 6 GLY H . 6 . HN 1 1 148 1 1 1 1 5 TYR HA . 5 . HA 1 1 148 1 1 1 1 6 GLY HA2 . 6 . HA2 1 1 148 1 2 1 1 34 GLN HE21 . 34 . HE21 1 1 149 1 1 1 1 5 TYR HA . 5 . HA 1 1 149 1 2 1 1 34 GLN HE21 . 34 . HE21 1 1 150 1 1 1 1 5 TYR HA . 5 . HA 1 1 150 1 2 1 1 34 GLN HE22 . 34 . HE22 1 1 151 1 1 1 1 5 TYR HA . 5 . HA 1 1 151 1 2 1 1 34 GLN QG . 34 . HG* 1 1 152 1 1 1 1 5 TYR HB2 . 5 . HB2 1 1 152 1 2 1 1 5 TYR QD . 5 . HD* 1 1 153 1 1 1 1 5 TYR HB2 . 5 . HB2 1 1 153 1 2 1 1 6 GLY H . 6 . HN 1 1 154 1 1 1 1 5 TYR HB2 . 5 . HB2 1 1 154 1 2 1 1 34 GLN HE21 . 34 . HE21 1 1 155 1 1 1 1 5 TYR HB2 . 5 . HB2 1 1 155 1 2 1 1 34 GLN HE22 . 34 . HE22 1 1 156 1 1 1 1 5 TYR HB3 . 5 . HB1 1 1 156 1 2 1 1 5 TYR QD . 5 . HD* 1 1 157 1 1 1 1 5 TYR HB3 . 5 . HB1 1 1 157 1 2 1 1 34 GLN HE21 . 34 . HE21 1 1 158 1 1 1 1 5 TYR HB3 . 5 . HB1 1 1 158 1 2 1 1 34 GLN HE22 . 34 . HE22 1 1 159 1 1 1 1 5 TYR QD . 5 . HD* 1 1 159 1 2 1 1 34 GLN HE21 . 34 . HE21 1 1 160 1 1 1 1 5 TYR QD . 5 . HD* 1 1 160 1 2 1 1 34 GLN QG . 34 . HG* 1 1 161 1 1 1 1 5 TYR QD . 5 . HD* 1 1 161 1 2 1 1 36 LEU HA . 36 . HA 1 1 162 1 1 1 1 5 TYR QD . 5 . HD* 1 1 162 1 2 1 1 36 LEU MD2 . 36 . HD2* 1 1 163 2 1 1 1 5 TYR QE . 5 . HE* 1 1 163 2 2 1 1 34 GLN QG . 34 . HG* 1 1 163 3 1 1 1 7 GLN HB2 . 7 . HB2 1 1 163 3 1 1 1 16 PRO HG3 . 16 . HG1 1 1 163 3 2 1 1 13 TYR QE . 13 . HE* 1 1 164 1 1 1 1 5 TYR QE . 5 . HE* 1 1 164 1 2 1 1 36 LEU MD2 . 36 . HD2* 1 1 165 1 1 1 1 6 GLY H . 6 . HN 1 1 165 1 2 1 1 6 GLY HA3 . 6 . HA1 1 1 166 1 1 1 1 6 GLY H . 6 . HN 1 1 166 1 2 1 1 35 CYS H . 35 . HN 1 1 167 1 1 1 1 6 GLY H . 6 . HN 1 1 167 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 168 1 1 1 1 6 GLY H . 6 . HN 1 1 168 1 2 1 1 35 CYS HB3 . 35 . HB1 1 1 169 1 1 1 1 6 GLY HA2 . 6 . HA2 1 1 169 1 2 1 1 7 GLN H . 7 . HN 1 1 170 2 1 1 1 6 GLY HA2 . 6 . HA2 1 1 170 2 2 1 1 34 GLN QG . 34 . HG* 1 1 170 3 1 1 1 30 PRO HA . 30 . HA 1 1 170 3 2 1 1 30 PRO HG2 . 30 . HG2 1 1 171 1 1 1 1 6 GLY HA2 . 6 . HA2 1 1 171 1 2 1 1 34 GLN HB2 . 34 . HB2 1 1 172 2 1 1 1 7 GLN H . 7 . HN 1 1 172 2 2 1 1 7 GLN HB2 . 7 . HB2 1 1 172 3 1 1 1 26 GLN HB3 . 26 . HB1 1 1 172 3 2 1 1 27 VAL H . 27 . HN 1 1 173 2 1 1 1 7 GLN H . 7 . HN 1 1 173 2 2 1 1 7 GLN HB2 . 7 . HB2 1 1 173 3 1 1 1 26 GLN HB3 . 26 . HB1 1 1 173 3 2 1 1 27 VAL H . 27 . HN 1 1 173 4 1 1 1 30 PRO HG2 . 30 . HG2 1 1 173 4 2 1 1 31 TYR H . 31 . HN 1 1 174 1 1 1 1 7 GLN H . 7 . HN 1 1 174 1 2 1 1 7 GLN HB3 . 7 . HB1 1 1 175 1 1 1 1 7 GLN H . 7 . HN 1 1 175 1 2 1 1 32 TYR QE . 32 . HE* 1 1 176 2 1 1 1 7 GLN HA . 7 . HA 1 1 176 2 2 1 1 8 CYS HB3 . 8 . HB1 1 1 176 3 1 1 1 7 GLN HA . 7 . HA 1 1 176 3 1 1 1 9 GLY HA2 . 9 . HA2 1 1 176 3 2 1 1 33 SER HB2 . 33 . HB2 1 1 177 2 1 1 1 7 GLN HA . 7 . HA 1 1 177 2 1 1 1 9 GLY HA2 . 9 . HA2 1 1 177 2 2 1 1 13 TYR QD . 13 . HD1 1 1 177 3 1 1 1 7 GLN HA . 7 . HA 1 1 177 3 2 1 1 32 TYR QD . 32 . HD1 1 1 178 1 1 1 1 7 GLN HA . 7 . HA 1 1 178 1 2 1 1 7 GLN HB2 . 7 . HB2 1 1 179 1 1 1 1 7 GLN HA . 7 . HA 1 1 179 1 1 1 1 10 GLY HA2 . 10 . HA2 1 1 179 1 2 1 1 7 GLN HE21 . 7 . HE21 1 1 180 1 1 1 1 7 GLN HA . 7 . HA 1 1 180 1 2 1 1 7 GLN HG2 . 7 . HG2 1 1 181 1 1 1 1 7 GLN HA . 7 . HA 1 1 181 1 1 1 1 9 GLY HA2 . 9 . HA2 1 1 181 1 2 1 1 7 GLN HG2 . 7 . HG2 1 1 182 1 1 1 1 7 GLN HA . 7 . HA 1 1 182 1 2 1 1 7 GLN HG3 . 7 . HG1 1 1 183 1 1 1 1 7 GLN HA . 7 . HA 1 1 183 1 2 1 1 8 CYS H . 8 . HN 1 1 184 1 1 1 1 7 GLN HA . 7 . HA 1 1 184 1 2 1 1 9 GLY H . 9 . HN 1 1 184 1 2 1 1 33 SER H . 33 . HN 1 1 185 1 1 1 1 7 GLN HA . 7 . HA 1 1 185 1 1 1 1 10 GLY HA2 . 10 . HA2 1 1 185 1 2 1 1 33 SER H . 33 . HN 1 1 186 1 1 1 1 7 GLN HA . 7 . HA 1 1 186 1 2 1 1 13 TYR QE . 13 . HE* 1 1 187 1 1 1 1 7 GLN HA . 7 . HA 1 1 187 1 2 1 1 32 TYR QE . 32 . HE* 1 1 188 1 1 1 1 7 GLN HA . 7 . HA 1 1 188 1 2 1 1 34 GLN QG . 34 . HG* 1 1 189 1 1 1 1 7 GLN HA . 7 . HA 1 1 189 1 2 1 1 35 CYS H . 35 . HN 1 1 190 1 1 1 1 7 GLN HB2 . 7 . HB2 1 1 190 1 2 1 1 7 GLN HG2 . 7 . HG2 1 1 191 2 1 1 1 7 GLN HB2 . 7 . HB2 1 1 191 2 2 1 1 7 GLN HG3 . 7 . HG1 1 1 191 3 1 1 1 26 GLN HB3 . 26 . HB1 1 1 191 3 2 1 1 26 GLN HG2 . 26 . HG2 1 1 192 1 1 1 1 7 GLN HB2 . 7 . HB2 1 1 192 1 2 1 1 8 CYS H . 8 . HN 1 1 193 1 1 1 1 7 GLN HB2 . 7 . HB2 1 1 193 1 1 1 1 34 GLN QG . 34 . HG* 1 1 193 1 2 1 1 8 CYS H . 8 . HN 1 1 194 1 1 1 1 7 GLN HB2 . 7 . HB2 1 1 194 1 2 1 1 9 GLY H . 9 . HN 1 1 195 1 1 1 1 7 GLN HB2 . 7 . HB2 1 1 195 1 1 1 1 16 PRO HG3 . 16 . HG1 1 1 195 1 2 1 1 13 TYR QE . 13 . HE* 1 1 196 1 1 1 1 7 GLN HB2 . 7 . HB2 1 1 196 1 2 1 1 32 TYR QD . 32 . HD* 1 1 197 1 1 1 1 7 GLN HB2 . 7 . HB2 1 1 197 1 2 1 1 32 TYR QE . 32 . HE* 1 1 198 1 1 1 1 7 GLN HB3 . 7 . HB1 1 1 198 1 2 1 1 7 GLN HE21 . 7 . HE21 1 1 199 1 1 1 1 7 GLN HB3 . 7 . HB1 1 1 199 1 2 1 1 7 GLN HG3 . 7 . HG1 1 1 200 1 1 1 1 7 GLN HB3 . 7 . HB1 1 1 200 1 2 1 1 8 CYS H . 8 . HN 1 1 201 1 1 1 1 7 GLN HB3 . 7 . HB1 1 1 201 1 2 1 1 9 GLY H . 9 . HN 1 1 202 1 1 1 1 7 GLN HB3 . 7 . HB1 1 1 202 1 2 1 1 13 TYR QE . 13 . HE* 1 1 203 1 1 1 1 7 GLN HB3 . 7 . HB1 1 1 203 1 2 1 1 32 TYR QE . 32 . HE* 1 1 204 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1 204 1 2 1 1 7 GLN HG2 . 7 . HG2 1 1 205 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1 205 1 2 1 1 7 GLN HG3 . 7 . HG1 1 1 206 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1 206 1 2 1 1 8 CYS H . 8 . HN 1 1 206 1 2 1 1 13 TYR H . 13 . HN 1 1 206 1 2 1 1 32 TYR H . 32 . HN 1 1 207 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1 207 1 2 1 1 9 GLY H . 9 . HN 1 1 208 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1 208 1 2 1 1 10 GLY HA3 . 10 . HA1 1 1 209 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1 209 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1 210 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1 210 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1 210 1 2 1 1 32 TYR HB2 . 32 . HB2 1 1 211 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1 211 1 2 1 1 13 TYR HB3 . 13 . HB1 1 1 212 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1 212 1 2 1 1 13 TYR QD . 13 . HD* 1 1 212 1 2 1 1 32 TYR QD . 32 . HD* 1 1 213 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1 213 1 2 1 1 32 TYR HA . 32 . HA 1 1 214 1 1 1 1 7 GLN HE21 . 7 . HE21 1 1 214 1 2 1 1 33 SER H . 33 . HN 1 1 215 1 1 1 1 7 GLN HE22 . 7 . HE22 1 1 215 1 2 1 1 10 GLY HA2 . 10 . HA2 1 1 215 1 2 1 1 12 GLY HA3 . 12 . HA1 1 1 216 1 1 1 1 7 GLN HE22 . 7 . HE22 1 1 216 1 2 1 1 10 GLY HA3 . 10 . HA1 1 1 217 1 1 1 1 7 GLN HE22 . 7 . HE22 1 1 217 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1 218 1 1 1 1 7 GLN HE22 . 7 . HE22 1 1 218 1 2 1 1 13 TYR HB3 . 13 . HB1 1 1 219 1 1 1 1 7 GLN HE22 . 7 . HE22 1 1 219 1 2 1 1 32 TYR HA . 32 . HA 1 1 220 1 1 1 1 7 GLN HG2 . 7 . HG2 1 1 220 1 2 1 1 8 CYS H . 8 . HN 1 1 221 1 1 1 1 7 GLN HG2 . 7 . HG2 1 1 221 1 2 1 1 9 GLY H . 9 . HN 1 1 222 1 1 1 1 7 GLN HG2 . 7 . HG2 1 1 222 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1 223 1 1 1 1 7 GLN HG2 . 7 . HG2 1 1 223 1 2 1 1 13 TYR QE . 13 . HE* 1 1 224 2 1 1 1 7 GLN HG2 . 7 . HG2 1 1 224 2 2 1 1 33 SER H . 33 . HN 1 1 224 3 1 1 1 28 LEU MD1 . 28 . HD1* 1 1 224 3 2 1 1 33 SER H . 33 . HN 1 1 224 3 2 1 1 34 GLN HE22 . 34 . HE22 1 1 225 1 1 1 1 7 GLN HG3 . 7 . HG1 1 1 225 1 2 1 1 8 CYS H . 8 . HN 1 1 226 1 1 1 1 7 GLN HG3 . 7 . HG1 1 1 226 1 2 1 1 9 GLY H . 9 . HN 1 1 227 2 1 1 1 7 GLN HG3 . 7 . HG1 1 1 227 2 2 1 1 32 TYR HA . 32 . HA 1 1 227 3 1 1 1 26 GLN HA . 26 . HA 1 1 227 3 2 1 1 26 GLN HG2 . 26 . HG2 1 1 228 1 1 1 1 7 GLN HG3 . 7 . HG1 1 1 228 1 2 1 1 32 TYR QD . 32 . HD* 1 1 229 1 1 1 1 7 GLN HG3 . 7 . HG1 1 1 229 1 2 1 1 32 TYR QE . 32 . HE* 1 1 230 1 1 1 1 7 GLN HG3 . 7 . HG1 1 1 230 1 2 1 1 33 SER H . 33 . HN 1 1 231 1 1 1 1 8 CYS H . 8 . HN 1 1 231 1 2 1 1 8 CYS HB2 . 8 . HB2 1 1 232 2 1 1 1 8 CYS H . 8 . HN 1 1 232 2 2 1 1 8 CYS HB3 . 8 . HB1 1 1 232 3 1 1 1 13 TYR H . 13 . HN 1 1 232 3 2 1 1 13 TYR HB2 . 13 . HB2 1 1 233 2 1 1 1 8 CYS H . 8 . HN 1 1 233 2 2 1 1 8 CYS HB3 . 8 . HB1 1 1 233 3 1 1 1 13 TYR H . 13 . HN 1 1 233 3 2 1 1 13 TYR HB2 . 13 . HB2 1 1 233 4 1 1 1 32 TYR H . 32 . HN 1 1 233 4 2 1 1 32 TYR HB2 . 32 . HB2 1 1 234 2 1 1 1 8 CYS H . 8 . HN 1 1 234 2 2 1 1 8 CYS HB3 . 8 . HB1 1 1 234 2 2 1 1 33 SER HB2 . 33 . HB2 1 1 234 3 1 1 1 13 TYR H . 13 . HN 1 1 234 3 2 1 1 13 TYR HB2 . 13 . HB2 1 1 235 2 1 1 1 8 CYS H . 8 . HN 1 1 235 2 2 1 1 8 CYS HB3 . 8 . HB1 1 1 235 2 2 1 1 33 SER HB2 . 33 . HB2 1 1 235 3 1 1 1 32 TYR H . 32 . HN 1 1 235 3 2 1 1 32 TYR HB2 . 32 . HB2 1 1 236 1 1 1 1 8 CYS H . 8 . HN 1 1 236 1 2 1 1 9 GLY H . 9 . HN 1 1 237 2 1 1 1 8 CYS H . 8 . HN 1 1 237 2 2 1 1 9 GLY HA3 . 9 . HA1 1 1 237 3 1 1 1 10 GLY HA3 . 10 . HA1 1 1 237 3 1 2 2 1 MAN H62 . 101 . H62 1 1 237 3 2 1 1 13 TYR H . 13 . HN 1 1 237 4 1 1 1 10 GLY HA3 . 10 . HA1 1 1 237 4 2 1 1 32 TYR H . 32 . HN 1 1 238 2 1 1 1 8 CYS H . 8 . HN 1 1 238 2 2 1 1 9 GLY HA3 . 9 . HA1 1 1 238 3 1 1 1 10 GLY HA3 . 10 . HA1 1 1 238 3 2 1 1 32 TYR H . 32 . HN 1 1 239 1 1 1 1 8 CYS H . 8 . HN 1 1 239 1 1 1 1 13 TYR H . 13 . HN 1 1 239 1 2 1 1 13 TYR QD . 13 . HD* 1 1 240 2 1 1 1 8 CYS H . 8 . HN 1 1 240 2 1 1 1 13 TYR H . 13 . HN 1 1 240 2 2 1 1 13 TYR QD . 13 . HD* 1 1 240 3 1 1 1 32 TYR H . 32 . HN 1 1 240 3 2 1 1 32 TYR QD . 32 . HD* 1 1 241 2 1 1 1 8 CYS H . 8 . HN 1 1 241 2 2 1 1 17 THR HA . 17 . HA 1 1 241 3 1 1 1 13 TYR H . 13 . HN 1 1 241 3 2 1 1 14 SER HA . 14 . HA 1 1 242 2 1 1 1 8 CYS H . 8 . HN 1 1 242 2 2 1 1 33 SER HB3 . 33 . HB1 1 1 242 3 1 1 1 13 TYR H . 13 . HN 1 1 242 3 2 2 2 1 MAN H5 . 101 . H5 1 1 243 1 1 1 1 8 CYS H . 8 . HN 1 1 243 1 1 1 1 32 TYR H . 32 . HN 1 1 243 1 2 1 1 33 SER H . 33 . HN 1 1 244 1 1 1 1 8 CYS H . 8 . HN 1 1 244 1 2 1 1 34 GLN HA . 34 . HA 1 1 245 1 1 1 1 8 CYS HA . 8 . HA 1 1 245 1 2 1 1 8 CYS HB2 . 8 . HB2 1 1 246 1 1 1 1 8 CYS HA . 8 . HA 1 1 246 1 2 1 1 8 CYS HB3 . 8 . HB1 1 1 247 1 1 1 1 8 CYS HA . 8 . HA 1 1 247 1 2 1 1 9 GLY H . 9 . HN 1 1 248 2 1 1 1 8 CYS HA . 8 . HA 1 1 248 2 2 1 1 13 TYR QD . 13 . HD* 1 1 248 3 1 1 1 32 TYR QD . 32 . HD* 1 1 248 3 2 1 1 33 SER HA . 33 . HA 1 1 249 1 1 1 1 8 CYS HA . 8 . HA 1 1 249 1 2 1 1 13 TYR QE . 13 . HE* 1 1 250 1 1 1 1 8 CYS HA . 8 . HA 1 1 250 1 2 1 1 17 THR HA . 17 . HA 1 1 251 1 1 1 1 8 CYS HA . 8 . HA 1 1 251 1 2 1 1 17 THR MG . 17 . HG2* 1 1 252 2 1 1 1 8 CYS HA . 8 . HA 1 1 252 2 2 1 1 19 CYS HA . 19 . HA 1 1 252 3 1 1 1 26 GLN HA . 26 . HA 1 1 252 3 1 1 1 32 TYR HA . 32 . HA 1 1 252 3 2 1 1 33 SER HA . 33 . HA 1 1 253 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 253 1 2 1 1 17 THR HA . 17 . HA 1 1 254 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 254 1 2 1 1 17 THR HB . 17 . HB 1 1 254 1 2 1 1 25 CYS HA . 25 . HA 1 1 255 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 255 1 2 1 1 25 CYS HB2 . 25 . HB2 1 1 256 1 1 1 1 8 CYS HB2 . 8 . HB2 1 1 256 1 2 1 1 35 CYS HA . 35 . HA 1 1 257 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 257 1 1 1 1 13 TYR HB2 . 13 . HB2 1 1 257 1 2 1 1 13 TYR QE . 13 . HE* 1 1 258 2 1 1 1 8 CYS HB3 . 8 . HB1 1 1 258 2 2 1 1 17 THR HA . 17 . HA 1 1 258 3 1 1 1 13 TYR HB2 . 13 . HB2 1 1 258 3 2 1 1 14 SER HA . 14 . HA 1 1 258 3 2 2 2 1 MAN H1 . 101 . H1 1 1 259 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 259 1 2 1 1 25 CYS HB2 . 25 . HB2 1 1 260 2 1 1 1 8 CYS HB3 . 8 . HB1 1 1 260 2 1 1 1 33 SER HB2 . 33 . HB2 1 1 260 2 2 1 1 26 GLN H . 26 . HN 1 1 260 3 1 1 1 33 SER HB2 . 33 . HB2 1 1 260 3 2 1 1 34 GLN H . 34 . HN 1 1 261 1 1 1 1 8 CYS HB3 . 8 . HB1 1 1 261 1 2 1 1 35 CYS H . 35 . HN 1 1 262 1 1 1 1 9 GLY H . 9 . HN 1 1 262 1 2 1 1 9 GLY HA2 . 9 . HA2 1 1 263 1 1 1 1 9 GLY H . 9 . HN 1 1 263 1 2 1 1 9 GLY HA3 . 9 . HA1 1 1 264 1 1 1 1 9 GLY H . 9 . HN 1 1 264 1 2 1 1 10 GLY H . 10 . HN 1 1 265 1 1 1 1 9 GLY H . 9 . HN 1 1 265 1 1 1 1 33 SER H . 33 . HN 1 1 265 1 2 1 1 10 GLY H . 10 . HN 1 1 266 1 1 1 1 9 GLY H . 9 . HN 1 1 266 1 2 1 1 13 TYR QD . 13 . HD* 1 1 267 1 1 1 1 9 GLY H . 9 . HN 1 1 267 1 2 1 1 17 THR HB . 17 . HB 1 1 267 1 2 1 1 25 CYS HA . 25 . HA 1 1 267 1 2 1 1 32 TYR HA . 32 . HA 1 1 268 1 1 1 1 9 GLY H . 9 . HN 1 1 268 1 1 1 1 33 SER H . 33 . HN 1 1 268 1 2 1 1 33 SER HB3 . 33 . HB1 1 1 269 1 1 1 1 9 GLY H . 9 . HN 1 1 269 1 2 1 1 33 SER HB2 . 33 . HB2 1 1 270 1 1 1 1 9 GLY H . 9 . HN 1 1 270 1 2 1 1 33 SER HB3 . 33 . HB1 1 1 271 1 1 1 1 9 GLY HA2 . 9 . HA2 1 1 271 1 2 1 1 10 GLY H . 10 . HN 1 1 272 1 1 1 1 9 GLY HA2 . 9 . HA2 1 1 272 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1 273 1 1 1 1 9 GLY HA2 . 9 . HA2 1 1 273 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1 273 1 2 1 1 33 SER HB2 . 33 . HB2 1 1 274 1 1 1 1 9 GLY HA2 . 9 . HA2 1 1 274 1 2 1 1 13 TYR QD . 13 . HD* 1 1 275 1 1 1 1 9 GLY HA2 . 9 . HA2 1 1 275 1 2 1 1 17 THR MG . 17 . HG2* 1 1 276 1 1 1 1 9 GLY HA3 . 9 . HA1 1 1 276 1 2 1 1 10 GLY H . 10 . HN 1 1 277 2 1 1 1 9 GLY HA3 . 9 . HA1 1 1 277 2 1 1 1 10 GLY HA3 . 10 . HA1 1 1 277 2 2 1 1 33 SER HB2 . 33 . HB2 1 1 277 3 1 1 1 10 GLY HA3 . 10 . HA1 1 1 277 3 2 1 1 13 TYR HB2 . 13 . HB2 1 1 278 1 1 1 1 9 GLY HA3 . 9 . HA1 1 1 278 1 1 1 1 10 GLY HA3 . 10 . HA1 1 1 278 1 2 1 1 33 SER HB2 . 33 . HB2 1 1 279 1 1 1 1 9 GLY HA3 . 9 . HA1 1 1 279 1 2 1 1 13 TYR QD . 13 . HD* 1 1 280 1 1 1 1 9 GLY HA3 . 9 . HA1 1 1 280 1 2 1 1 17 THR MG . 17 . HG2* 1 1 281 1 1 1 1 10 GLY H . 10 . HN 1 1 281 1 2 1 1 10 GLY HA3 . 10 . HA1 1 1 282 1 1 1 1 10 GLY H . 10 . HN 1 1 282 1 2 1 1 13 TYR HB3 . 13 . HB1 1 1 283 1 1 1 1 10 GLY H . 10 . HN 1 1 283 1 2 1 1 13 TYR QD . 13 . HD* 1 1 284 1 1 1 1 10 GLY HA2 . 10 . HA2 1 1 284 1 2 1 1 11 ILE H . 11 . HN 1 1 285 2 1 1 1 10 GLY HA2 . 10 . HA2 1 1 285 2 2 1 1 27 VAL MG2 . 27 . HG2* 1 1 285 3 1 1 1 11 ILE MG . 11 . HG2* 1 1 285 3 2 1 1 12 GLY HA3 . 12 . HA1 1 1 286 2 1 1 1 10 GLY HA2 . 10 . HA2 1 1 286 2 1 1 1 12 GLY HA3 . 12 . HA1 1 1 286 2 2 1 1 13 TYR HB3 . 13 . HB1 1 1 286 3 1 1 1 12 GLY HA3 . 12 . HA1 1 1 286 3 2 1 1 31 TYR HB2 . 31 . HB2 1 1 287 2 1 1 1 10 GLY HA2 . 10 . HA2 1 1 287 2 2 1 1 33 SER H . 33 . HN 1 1 287 3 1 1 1 12 GLY HA3 . 12 . HA1 1 1 287 3 2 1 1 31 TYR QE . 31 . HE* 1 1 288 1 1 1 1 10 GLY HA3 . 10 . HA1 1 1 288 1 2 1 1 11 ILE H . 11 . HN 1 1 289 1 1 1 1 10 GLY HA3 . 10 . HA1 1 1 289 1 1 1 1 11 ILE HA . 11 . HA 1 1 289 1 2 1 1 11 ILE H . 11 . HN 1 1 290 1 1 1 1 10 GLY HA3 . 10 . HA1 1 1 290 1 1 1 1 11 ILE HA . 11 . HA 1 1 290 1 2 1 1 31 TYR QD . 31 . HD* 1 1 291 2 1 1 1 10 GLY HA3 . 10 . HA1 1 1 291 2 2 1 1 11 ILE HB . 11 . HB 1 1 291 3 1 1 1 20 ALA MB . 20 . HB* 1 1 291 3 2 1 1 21 SER QB . 21 . HB* 1 1 292 1 1 1 1 10 GLY HA3 . 10 . HA1 1 1 292 1 2 1 1 32 TYR H . 32 . HN 1 1 293 1 1 1 1 10 GLY HA3 . 10 . HA1 1 1 293 1 2 1 1 33 SER H . 33 . HN 1 1 294 1 1 1 1 11 ILE H . 11 . HN 1 1 294 1 2 1 1 11 ILE HB . 11 . HB 1 1 295 1 1 1 1 11 ILE H . 11 . HN 1 1 295 1 2 1 1 11 ILE MD . 11 . HD1* 1 1 296 1 1 1 1 11 ILE H . 11 . HN 1 1 296 1 2 1 1 11 ILE HG12 . 11 . HG12 1 1 297 2 1 1 1 11 ILE H . 11 . HN 1 1 297 2 2 1 1 11 ILE HG12 . 11 . HG12 1 1 297 3 1 1 1 17 THR H . 17 . HN 1 1 297 3 2 1 1 18 VAL MG2 . 18 . HG2* 1 1 298 1 1 1 1 11 ILE H . 11 . HN 1 1 298 1 2 1 1 11 ILE HG13 . 11 . HG11 1 1 299 1 1 1 1 11 ILE H . 11 . HN 1 1 299 1 2 1 1 11 ILE MG . 11 . HG2* 1 1 300 1 1 1 1 11 ILE H . 11 . HN 1 1 300 1 2 1 1 13 TYR HB3 . 13 . HB1 1 1 300 1 2 1 1 31 TYR HB2 . 31 . HB2 1 1 301 1 1 1 1 11 ILE H . 11 . HN 1 1 301 1 2 1 1 31 TYR HA . 31 . HA 1 1 302 1 1 1 1 11 ILE H . 11 . HN 1 1 302 1 2 1 1 31 TYR HB3 . 31 . HB1 1 1 303 1 1 1 1 11 ILE H . 11 . HN 1 1 303 1 2 1 1 31 TYR QD . 31 . HD* 1 1 304 1 1 1 1 11 ILE HA . 11 . HA 1 1 304 1 2 1 1 11 ILE HG12 . 11 . HG12 1 1 305 1 1 1 1 11 ILE HA . 11 . HA 1 1 305 1 2 1 1 11 ILE HG13 . 11 . HG11 1 1 306 1 1 1 1 11 ILE HA . 11 . HA 1 1 306 1 2 1 1 11 ILE MG . 11 . HG2* 1 1 307 1 1 1 1 11 ILE HA . 11 . HA 1 1 307 1 2 1 1 12 GLY H . 12 . HN 1 1 308 1 1 1 1 11 ILE HA . 11 . HA 1 1 308 1 1 1 1 12 GLY HA2 . 12 . HA2 1 1 308 1 2 1 1 12 GLY H . 12 . HN 1 1 309 1 1 1 1 11 ILE HA . 11 . HA 1 1 309 1 1 1 1 12 GLY HA2 . 12 . HA2 1 1 309 1 2 1 1 13 TYR H . 13 . HN 1 1 310 1 1 1 1 11 ILE HA . 11 . HA 1 1 310 1 1 2 2 1 MAN H2 . 101 . H2 1 1 310 1 2 1 1 13 TYR H . 13 . HN 1 1 311 1 1 1 1 11 ILE HB . 11 . HB 1 1 311 1 2 1 1 11 ILE MD . 11 . HD1* 1 1 312 2 1 1 1 11 ILE HB . 11 . HB 1 1 312 2 2 1 1 11 ILE MD . 11 . HD1* 1 1 312 3 1 1 1 20 ALA MB . 20 . HB* 1 1 312 3 2 1 1 23 THR MG . 23 . HG2* 1 1 313 1 1 1 1 11 ILE HB . 11 . HB 1 1 313 1 2 1 1 11 ILE HG13 . 11 . HG11 1 1 314 1 1 1 1 11 ILE HB . 11 . HB 1 1 314 1 2 1 1 11 ILE MG . 11 . HG2* 1 1 315 1 1 1 1 11 ILE HB . 11 . HB 1 1 315 1 2 1 1 31 TYR HA . 31 . HA 1 1 316 1 1 1 1 11 ILE HB . 11 . HB 1 1 316 1 2 1 1 31 TYR QD . 31 . HD* 1 1 317 1 1 1 1 11 ILE HB . 11 . HB 1 1 317 1 2 1 1 31 TYR QE . 31 . HE* 1 1 318 1 1 1 1 11 ILE MD . 11 . HD1* 1 1 318 1 2 1 1 11 ILE HG13 . 11 . HG11 1 1 319 1 1 1 1 11 ILE MD . 11 . HD1* 1 1 319 1 2 1 1 11 ILE MG . 11 . HG2* 1 1 320 2 1 1 1 11 ILE MD . 11 . HD1* 1 1 320 2 2 1 1 12 GLY H . 12 . HN 1 1 320 3 1 1 1 23 THR MG . 23 . HG2* 1 1 320 3 2 1 1 36 LEU H . 36 . HN 1 1 321 1 1 1 1 11 ILE MD . 11 . HD1* 1 1 321 1 2 1 1 27 VAL MG1 . 27 . HG1* 1 1 322 1 1 1 1 11 ILE MD . 11 . HD1* 1 1 322 1 2 1 1 30 PRO HA . 30 . HA 1 1 323 1 1 1 1 11 ILE MD . 11 . HD1* 1 1 323 1 2 1 1 30 PRO HB3 . 30 . HB1 1 1 324 1 1 1 1 11 ILE MD . 11 . HD1* 1 1 324 1 2 1 1 31 TYR HA . 31 . HA 1 1 325 1 1 1 1 11 ILE MD . 11 . HD1* 1 1 325 1 2 1 1 31 TYR QD . 31 . HD* 1 1 326 1 1 1 1 11 ILE MD . 11 . HD1* 1 1 326 1 2 1 1 31 TYR QE . 31 . HE* 1 1 327 2 1 1 1 11 ILE HG12 . 11 . HG12 1 1 327 2 2 1 1 12 GLY H . 12 . HN 1 1 327 3 1 1 1 36 LEU H . 36 . HN 1 1 327 3 2 1 1 36 LEU MD2 . 36 . HD2* 1 1 328 1 1 1 1 11 ILE HG13 . 11 . HG11 1 1 328 1 2 1 1 31 TYR HA . 31 . HA 1 1 329 1 1 1 1 11 ILE HG13 . 11 . HG11 1 1 329 1 2 1 1 31 TYR QD . 31 . HD* 1 1 330 2 1 1 1 11 ILE MG . 11 . HG2* 1 1 330 2 2 1 1 12 GLY H . 12 . HN 1 1 330 3 1 1 1 28 LEU MD2 . 28 . HD2* 1 1 330 3 2 1 1 34 GLN H . 34 . HN 1 1 331 2 1 1 1 11 ILE MG . 11 . HG2* 1 1 331 2 2 1 1 12 GLY H . 12 . HN 1 1 331 3 1 1 1 28 LEU MD2 . 28 . HD2* 1 1 331 3 2 1 1 34 GLN H . 34 . HN 1 1 331 4 1 1 1 36 LEU H . 36 . HN 1 1 331 4 2 1 1 36 LEU MD1 . 36 . HD1* 1 1 332 1 1 1 1 11 ILE MG . 11 . HG2* 1 1 332 1 2 1 1 12 GLY HA2 . 12 . HA2 1 1 333 2 1 1 1 11 ILE MG . 11 . HG2* 1 1 333 2 2 1 1 31 TYR QE . 31 . HE* 1 1 333 3 1 1 1 26 GLN HE22 . 26 . HE22 1 1 333 3 2 1 1 36 LEU MD1 . 36 . HD1* 1 1 334 1 1 1 1 11 ILE MG . 11 . HG2* 1 1 334 1 2 1 1 31 TYR HA . 31 . HA 1 1 335 1 1 1 1 11 ILE MG . 11 . HG2* 1 1 335 1 2 1 1 31 TYR QD . 31 . HD* 1 1 336 1 1 1 1 11 ILE MG . 11 . HG2* 1 1 336 1 2 1 1 31 TYR QE . 31 . HE* 1 1 337 1 1 1 1 12 GLY H . 12 . HN 1 1 337 1 2 1 1 12 GLY HA2 . 12 . HA2 1 1 338 1 1 1 1 12 GLY H . 12 . HN 1 1 338 1 2 1 1 12 GLY HA3 . 12 . HA1 1 1 339 1 1 1 1 12 GLY H . 12 . HN 1 1 339 1 2 1 1 13 TYR H . 13 . HN 1 1 340 2 1 1 1 12 GLY H . 12 . HN 1 1 340 2 2 1 1 13 TYR HB2 . 13 . HB2 1 1 340 3 1 1 1 33 SER HB2 . 33 . HB2 1 1 340 3 2 1 1 34 GLN H . 34 . HN 1 1 341 2 1 1 1 12 GLY H . 12 . HN 1 1 341 2 2 1 1 13 TYR HB3 . 13 . HB1 1 1 341 3 1 1 1 25 CYS HB3 . 25 . HB1 1 1 341 3 2 1 1 26 GLN H . 26 . HN 1 1 342 2 1 1 1 12 GLY H . 12 . HN 1 1 342 2 2 1 1 13 TYR HB3 . 13 . HB1 1 1 342 3 1 1 1 25 CYS HB3 . 25 . HB1 1 1 342 3 2 1 1 26 GLN H . 26 . HN 1 1 342 4 1 1 1 35 CYS HB3 . 35 . HB1 1 1 342 4 2 1 1 36 LEU H . 36 . HN 1 1 343 2 1 1 1 12 GLY H . 12 . HN 1 1 343 2 2 1 1 13 TYR HB3 . 13 . HB1 1 1 343 3 1 1 1 35 CYS HB3 . 35 . HB1 1 1 343 3 2 1 1 36 LEU H . 36 . HN 1 1 344 2 1 1 1 12 GLY H . 12 . HN 1 1 344 2 2 1 1 14 SER HA . 14 . HA 1 1 344 3 1 1 1 23 THR HA . 23 . HA 1 1 344 3 2 1 1 36 LEU H . 36 . HN 1 1 345 2 1 1 1 12 GLY H . 12 . HN 1 1 345 2 2 2 2 1 MAN H5 . 101 . H5 1 1 345 3 1 1 1 33 SER HB3 . 33 . HB1 1 1 345 3 2 1 1 34 GLN H . 34 . HN 1 1 346 1 1 1 1 12 GLY HA2 . 12 . HA2 1 1 346 1 2 1 1 13 TYR H . 13 . HN 1 1 347 1 1 1 1 12 GLY HA2 . 12 . HA2 1 1 347 1 1 2 2 1 MAN H3 . 101 . H3 1 1 347 1 1 2 2 1 MAN H61 . 101 . H61 1 1 347 1 2 2 2 1 MAN H4 . 101 . H4 1 1 348 1 1 1 1 12 GLY HA3 . 12 . HA1 1 1 348 1 2 2 2 1 MAN H3 . 101 . H3 1 1 348 1 2 2 2 1 MAN H61 . 101 . H61 1 1 349 1 1 1 1 13 TYR H . 13 . HN 1 1 349 1 2 1 1 13 TYR HA . 13 . HA 1 1 350 1 1 1 1 13 TYR H . 13 . HN 1 1 350 1 2 1 1 13 TYR HB3 . 13 . HB1 1 1 351 2 1 1 1 13 TYR H . 13 . HN 1 1 351 2 2 1 1 13 TYR HB3 . 13 . HB1 1 1 351 3 1 1 1 31 TYR HB2 . 31 . HB2 1 1 351 3 2 1 1 32 TYR H . 32 . HN 1 1 352 1 1 1 1 13 TYR HA . 13 . HA 1 1 352 1 2 1 1 13 TYR HB2 . 13 . HB2 1 1 353 2 1 1 1 13 TYR HA . 13 . HA 1 1 353 2 2 1 1 13 TYR HB2 . 13 . HB2 1 1 353 3 1 1 1 32 TYR HA . 32 . HA 1 1 353 3 2 1 1 32 TYR HB2 . 32 . HB2 1 1 354 2 1 1 1 13 TYR HA . 13 . HA 1 1 354 2 2 1 1 13 TYR HB3 . 13 . HB1 1 1 354 3 1 1 1 17 THR HB . 17 . HB 1 1 354 3 1 1 1 25 CYS HA . 25 . HA 1 1 354 3 2 1 1 25 CYS HB3 . 25 . HB1 1 1 355 2 1 1 1 13 TYR HA . 13 . HA 1 1 355 2 2 1 1 13 TYR HB3 . 13 . HB1 1 1 355 3 1 1 1 17 THR HB . 17 . HB 1 1 355 3 2 1 1 25 CYS HB3 . 25 . HB1 1 1 356 2 1 1 1 13 TYR HA . 13 . HA 1 1 356 2 2 1 1 13 TYR HB3 . 13 . HB1 1 1 356 3 1 1 1 25 CYS HA . 25 . HA 1 1 356 3 2 1 1 35 CYS HB3 . 35 . HB1 1 1 357 2 1 1 1 13 TYR HA . 13 . HA 1 1 357 2 2 1 1 13 TYR QD . 13 . HD* 1 1 357 3 1 1 1 32 TYR HA . 32 . HA 1 1 357 3 2 1 1 32 TYR QD . 32 . HD* 1 1 358 1 1 1 1 13 TYR HA . 13 . HA 1 1 358 1 2 1 1 14 SER H . 14 . HN 1 1 359 1 1 1 1 13 TYR HB2 . 13 . HB2 1 1 359 1 2 1 1 13 TYR QD . 13 . HD* 1 1 360 2 1 1 1 13 TYR HB2 . 13 . HB2 1 1 360 2 2 1 1 13 TYR QD . 13 . HD* 1 1 360 3 1 1 1 32 TYR HB2 . 32 . HB2 1 1 360 3 2 1 1 32 TYR QD . 32 . HD* 1 1 361 1 1 1 1 13 TYR HB2 . 13 . HB2 1 1 361 1 2 1 1 14 SER H . 14 . HN 1 1 362 1 1 1 1 13 TYR HB3 . 13 . HB1 1 1 362 1 2 1 1 13 TYR QD . 13 . HD* 1 1 363 2 1 1 1 13 TYR HB3 . 13 . HB1 1 1 363 2 2 1 1 14 SER H . 14 . HN 1 1 363 3 1 1 1 35 CYS H . 35 . HN 1 1 363 3 2 1 1 35 CYS HB3 . 35 . HB1 1 1 364 1 1 1 1 13 TYR QD . 13 . HD* 1 1 364 1 2 1 1 14 SER H . 14 . HN 1 1 365 1 1 1 1 13 TYR QD . 13 . HD* 1 1 365 1 2 1 1 14 SER HA . 14 . HA 1 1 365 1 2 1 1 17 THR HA . 17 . HA 1 1 366 1 1 1 1 13 TYR QD . 13 . HD* 1 1 366 1 2 1 1 15 GLY H . 15 . HN 1 1 367 1 1 1 1 13 TYR QD . 13 . HD* 1 1 367 1 2 1 1 17 THR MG . 17 . HG2* 1 1 368 1 1 1 1 13 TYR QE . 13 . HE* 1 1 368 1 2 1 1 14 SER HA . 14 . HA 1 1 368 1 2 1 1 17 THR HA . 17 . HA 1 1 369 1 1 1 1 13 TYR QE . 13 . HE* 1 1 369 1 2 1 1 15 GLY H . 15 . HN 1 1 370 1 1 1 1 13 TYR QE . 13 . HE* 1 1 370 1 2 1 1 15 GLY HA3 . 15 . HA1 1 1 371 1 1 1 1 13 TYR QE . 13 . HE* 1 1 371 1 2 1 1 16 PRO HA . 16 . HA 1 1 372 1 1 1 1 13 TYR QE . 13 . HE* 1 1 372 1 2 1 1 17 THR MG . 17 . HG2* 1 1 373 1 1 1 1 14 SER H . 14 . HN 1 1 373 1 2 1 1 14 SER HB2 . 14 . HB2 1 1 374 2 1 1 1 14 SER H . 14 . HN 1 1 374 2 2 1 1 14 SER HB2 . 14 . HB2 1 1 374 3 1 1 1 21 SER H . 21 . HN 1 1 374 3 2 1 1 21 SER QB . 21 . HB* 1 1 375 1 1 1 1 14 SER H . 14 . HN 1 1 375 1 2 1 1 14 SER HB3 . 14 . HB1 1 1 375 1 2 2 2 1 MAN H4 . 101 . H4 1 1 376 1 1 1 1 14 SER H . 14 . HN 1 1 376 1 2 1 1 15 GLY H . 15 . HN 1 1 377 1 1 1 1 14 SER H . 14 . HN 1 1 377 1 2 2 2 1 MAN H5 . 101 . H5 1 1 378 1 1 1 1 14 SER HA . 14 . HA 1 1 378 1 2 1 1 14 SER HB2 . 14 . HB2 1 1 378 1 2 2 2 1 MAN H62 . 101 . H62 1 1 379 2 1 1 1 14 SER HA . 14 . HA 1 1 379 2 1 2 2 1 MAN H1 . 101 . H1 1 1 379 2 2 1 1 14 SER HB3 . 14 . HB1 1 1 379 3 1 2 2 1 MAN H1 . 101 . H1 1 1 379 3 2 2 2 1 MAN H4 . 101 . H4 1 1 380 2 1 1 1 14 SER HA . 14 . HA 1 1 380 2 2 2 2 1 MAN H2 . 101 . H2 1 1 380 3 1 1 1 23 THR HA . 23 . HA 1 1 380 3 2 1 1 23 THR HB . 23 . HB 1 1 381 1 1 1 1 15 GLY H . 15 . HN 1 1 381 1 2 1 1 15 GLY HA3 . 15 . HA1 1 1 382 2 1 1 1 15 GLY HA2 . 15 . HA2 1 1 382 2 2 1 1 16 PRO QG . 16 . HG2 1 1 382 3 1 1 1 26 GLN HB3 . 26 . HB1 1 1 382 3 2 1 1 27 VAL HA . 27 . HA 1 1 383 2 1 1 1 15 GLY HA2 . 15 . HA2 1 1 383 2 2 1 1 16 PRO HG3 . 16 . HG1 1 1 383 3 1 1 1 26 GLN HB3 . 26 . HB1 1 1 383 3 2 1 1 27 VAL HA . 27 . HA 1 1 384 1 1 1 1 15 GLY HA3 . 15 . HA1 1 1 384 1 2 1 1 16 PRO QG . 16 . HG2 1 1 385 1 1 1 1 16 PRO HA . 16 . HA 1 1 385 1 2 1 1 16 PRO HB3 . 16 . HB1 1 1 386 1 1 1 1 16 PRO HA . 16 . HA 1 1 386 1 2 1 1 16 PRO HD2 . 16 . HD2 1 1 387 2 1 1 1 16 PRO HA . 16 . HA 1 1 387 2 2 1 1 16 PRO HD3 . 16 . HD1 1 1 387 3 1 1 1 19 CYS HB3 . 19 . HB1 1 1 387 3 2 1 1 24 THR HA . 24 . HA 1 1 388 1 1 1 1 16 PRO HA . 16 . HA 1 1 388 1 2 1 1 16 PRO HG2 . 16 . HG2 1 1 388 1 2 1 1 18 VAL HB . 18 . HB 1 1 389 1 1 1 1 16 PRO HA . 16 . HA 1 1 389 1 2 1 1 17 THR H . 17 . HN 1 1 390 1 1 1 1 16 PRO HA . 16 . HA 1 1 390 1 2 1 1 17 THR MG . 17 . HG2* 1 1 391 2 1 1 1 16 PRO HA . 16 . HA 1 1 391 2 2 1 1 17 THR MG . 17 . HG2* 1 1 391 3 1 1 1 36 LEU HA . 36 . HA 1 1 391 3 2 1 1 36 LEU HG . 36 . HG 1 1 392 1 1 1 1 16 PRO HA . 16 . HA 1 1 392 1 2 1 1 18 VAL H . 18 . HN 1 1 393 1 1 1 1 16 PRO HB2 . 16 . HB2 1 1 393 1 2 1 1 16 PRO HD3 . 16 . HD1 1 1 394 1 1 1 1 16 PRO HB2 . 16 . HB2 1 1 394 1 2 1 1 16 PRO HG2 . 16 . HG2 1 1 395 1 1 1 1 16 PRO HB2 . 16 . HB2 1 1 395 1 2 1 1 17 THR H . 17 . HN 1 1 396 1 1 1 1 16 PRO HB2 . 16 . HB2 1 1 396 1 2 1 1 18 VAL H . 18 . HN 1 1 397 1 1 1 1 16 PRO HB3 . 16 . HB1 1 1 397 1 2 1 1 16 PRO HD2 . 16 . HD2 1 1 398 1 1 1 1 16 PRO HB3 . 16 . HB1 1 1 398 1 2 1 1 16 PRO HD3 . 16 . HD1 1 1 399 1 1 1 1 16 PRO HB3 . 16 . HB1 1 1 399 1 2 1 1 16 PRO HG2 . 16 . HG2 1 1 400 1 1 1 1 16 PRO HB3 . 16 . HB1 1 1 400 1 2 1 1 17 THR H . 17 . HN 1 1 401 1 1 1 1 16 PRO HB3 . 16 . HB1 1 1 401 1 2 1 1 18 VAL H . 18 . HN 1 1 402 1 1 1 1 16 PRO HD2 . 16 . HD2 1 1 402 1 2 1 1 16 PRO HG2 . 16 . HG2 1 1 403 1 1 1 1 16 PRO HD3 . 16 . HD1 1 1 403 1 2 1 1 16 PRO HG2 . 16 . HG2 1 1 404 1 1 1 1 16 PRO HD3 . 16 . HD1 1 1 404 1 2 1 1 16 PRO QG . 16 . HG2 1 1 405 1 1 1 1 17 THR H . 17 . HN 1 1 405 1 2 1 1 17 THR HA . 17 . HA 1 1 406 1 1 1 1 17 THR H . 17 . HN 1 1 406 1 2 1 1 17 THR HB . 17 . HB 1 1 407 2 1 1 1 17 THR H . 17 . HN 1 1 407 2 2 1 1 17 THR MG . 17 . HG2* 1 1 407 3 1 1 1 20 ALA MB . 20 . HB* 1 1 407 3 2 1 1 21 SER H . 21 . HN 1 1 408 1 1 1 1 17 THR H . 17 . HN 1 1 408 1 2 1 1 18 VAL H . 18 . HN 1 1 409 1 1 1 1 17 THR H . 17 . HN 1 1 409 1 2 1 1 18 VAL HB . 18 . HB 1 1 410 1 1 1 1 17 THR H . 17 . HN 1 1 410 1 2 1 1 18 VAL MG2 . 18 . HG2* 1 1 411 1 1 1 1 17 THR HA . 17 . HA 1 1 411 1 2 1 1 17 THR HB . 17 . HB 1 1 412 1 1 1 1 17 THR HA . 17 . HA 1 1 412 1 2 1 1 17 THR MG . 17 . HG2* 1 1 413 1 1 1 1 17 THR HA . 17 . HA 1 1 413 1 2 1 1 18 VAL H . 18 . HN 1 1 414 1 1 1 1 17 THR HA . 17 . HA 1 1 414 1 1 1 1 19 CYS HA . 19 . HA 1 1 414 1 2 1 1 25 CYS HB2 . 25 . HB2 1 1 415 1 1 1 1 17 THR HA . 17 . HA 1 1 415 1 2 1 1 25 CYS HB2 . 25 . HB2 1 1 416 1 1 1 1 17 THR HB . 17 . HB 1 1 416 1 2 1 1 17 THR MG . 17 . HG2* 1 1 417 1 1 1 1 17 THR HB . 17 . HB 1 1 417 1 1 1 1 25 CYS HA . 25 . HA 1 1 417 1 2 1 1 25 CYS HB3 . 25 . HB1 1 1 418 1 1 1 1 17 THR MG . 17 . HG2* 1 1 418 1 2 1 1 18 VAL H . 18 . HN 1 1 419 1 1 1 1 18 VAL H . 18 . HN 1 1 419 1 2 1 1 18 VAL HB . 18 . HB 1 1 420 1 1 1 1 18 VAL H . 18 . HN 1 1 420 1 2 1 1 18 VAL MG2 . 18 . HG2* 1 1 421 1 1 1 1 18 VAL HA . 18 . HA 1 1 421 1 2 1 1 18 VAL QG . 18 . HG1* 1 1 422 1 1 1 1 18 VAL HA . 18 . HA 1 1 422 1 2 1 1 19 CYS H . 19 . HN 1 1 423 1 1 1 1 18 VAL MG1 . 18 . HG1* 1 1 423 1 2 1 1 19 CYS H . 19 . HN 1 1 424 1 1 1 1 19 CYS H . 19 . HN 1 1 424 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 425 1 1 1 1 19 CYS H . 19 . HN 1 1 425 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 426 1 1 1 1 19 CYS HA . 19 . HA 1 1 426 1 2 1 1 19 CYS HB2 . 19 . HB2 1 1 427 1 1 1 1 19 CYS HA . 19 . HA 1 1 427 1 2 1 1 19 CYS HB3 . 19 . HB1 1 1 428 1 1 1 1 19 CYS HA . 19 . HA 1 1 428 1 2 1 1 20 ALA H . 20 . HN 1 1 429 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 429 1 2 1 1 20 ALA H . 20 . HN 1 1 429 1 2 1 1 23 THR H . 23 . HN 1 1 430 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 430 1 1 1 1 26 GLN HG2 . 26 . HG2 1 1 430 1 2 1 1 24 THR H . 24 . HN 1 1 431 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 431 1 2 1 1 24 THR HA . 24 . HA 1 1 432 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 432 1 2 1 1 25 CYS H . 25 . HN 1 1 433 1 1 1 1 19 CYS HB2 . 19 . HB2 1 1 433 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 434 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1 434 1 2 1 1 20 ALA H . 20 . HN 1 1 435 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1 435 1 1 1 1 22 GLY HA2 . 22 . HA2 1 1 435 1 2 1 1 23 THR MG . 23 . HG2* 1 1 436 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1 436 1 2 1 1 23 THR MG . 23 . HG2* 1 1 437 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1 437 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 438 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1 438 1 2 1 1 35 CYS HB3 . 35 . HB1 1 1 439 1 1 1 1 19 CYS HB3 . 19 . HB1 1 1 439 1 2 1 1 36 LEU H . 36 . HN 1 1 440 1 1 1 1 20 ALA H . 20 . HN 1 1 440 1 2 1 1 20 ALA HA . 20 . HA 1 1 441 1 1 1 1 20 ALA H . 20 . HN 1 1 441 1 2 1 1 20 ALA MB . 20 . HB* 1 1 442 1 1 1 1 20 ALA H . 20 . HN 1 1 442 1 1 1 1 23 THR H . 23 . HN 1 1 442 1 2 1 1 21 SER H . 21 . HN 1 1 443 1 1 1 1 20 ALA H . 20 . HN 1 1 443 1 1 1 1 23 THR H . 23 . HN 1 1 443 1 2 1 1 23 THR HB . 23 . HB 1 1 444 1 1 1 1 20 ALA H . 20 . HN 1 1 444 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 445 1 1 1 1 20 ALA HA . 20 . HA 1 1 445 1 2 1 1 20 ALA MB . 20 . HB* 1 1 446 1 1 1 1 20 ALA HA . 20 . HA 1 1 446 1 2 1 1 21 SER H . 21 . HN 1 1 447 1 1 1 1 20 ALA MB . 20 . HB* 1 1 447 1 2 1 1 21 SER QB . 21 . HB* 1 1 448 1 1 1 1 21 SER H . 21 . HN 1 1 448 1 2 1 1 21 SER HA . 21 . HA 1 1 449 1 1 1 1 21 SER H . 21 . HN 1 1 449 1 2 1 1 21 SER QB . 21 . HB* 1 1 450 1 1 1 1 21 SER H . 21 . HN 1 1 450 1 2 1 1 22 GLY H . 22 . HN 1 1 451 1 1 1 1 21 SER HA . 21 . HA 1 1 451 1 2 1 1 21 SER QB . 21 . HB* 1 1 452 1 1 1 1 21 SER HA . 21 . HA 1 1 452 1 2 1 1 22 GLY H . 22 . HN 1 1 453 1 1 1 1 21 SER HA . 21 . HA 1 1 453 1 2 1 1 23 THR H . 23 . HN 1 1 454 1 1 1 1 21 SER QB . 21 . HB* 1 1 454 1 2 1 1 22 GLY H . 22 . HN 1 1 455 1 1 1 1 22 GLY H . 22 . HN 1 1 455 1 2 1 1 22 GLY HA2 . 22 . HA2 1 1 456 1 1 1 1 22 GLY H . 22 . HN 1 1 456 1 2 1 1 22 GLY HA3 . 22 . HA1 1 1 457 1 1 1 1 22 GLY H . 22 . HN 1 1 457 1 2 1 1 23 THR H . 23 . HN 1 1 458 1 1 1 1 22 GLY H . 22 . HN 1 1 458 1 1 1 1 25 CYS H . 25 . HN 1 1 458 1 2 1 1 24 THR MG . 24 . HG2* 1 1 459 1 1 1 1 22 GLY HA2 . 22 . HA2 1 1 459 1 2 1 1 23 THR H . 23 . HN 1 1 460 1 1 1 1 22 GLY HA3 . 22 . HA1 1 1 460 1 2 1 1 23 THR H . 23 . HN 1 1 461 1 1 1 1 22 GLY HA3 . 22 . HA1 1 1 461 1 2 1 1 23 THR MG . 23 . HG2* 1 1 462 1 1 1 1 23 THR H . 23 . HN 1 1 462 1 2 1 1 23 THR MG . 23 . HG2* 1 1 463 1 1 1 1 23 THR HA . 23 . HA 1 1 463 1 2 1 1 23 THR HB . 23 . HB 1 1 464 1 1 1 1 23 THR HA . 23 . HA 1 1 464 1 2 1 1 23 THR MG . 23 . HG2* 1 1 465 1 1 1 1 23 THR HA . 23 . HA 1 1 465 1 2 1 1 24 THR H . 24 . HN 1 1 466 2 1 1 1 23 THR HA . 23 . HA 1 1 466 2 2 1 1 36 LEU H . 36 . HN 1 1 466 3 1 1 1 28 LEU HA . 28 . HA 1 1 466 3 2 1 1 34 GLN H . 34 . HN 1 1 467 1 1 1 1 23 THR HA . 23 . HA 1 1 467 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 468 1 1 1 1 23 THR HB . 23 . HB 1 1 468 1 2 1 1 23 THR MG . 23 . HG2* 1 1 469 1 1 1 1 23 THR HB . 23 . HB 1 1 469 1 2 1 1 24 THR H . 24 . HN 1 1 470 1 1 1 1 23 THR HB . 23 . HB 1 1 470 1 2 1 1 24 THR HA . 24 . HA 1 1 470 1 2 1 1 36 LEU HA . 36 . HA 1 1 471 1 1 1 1 23 THR HB . 23 . HB 1 1 471 1 2 1 1 35 CYS HA . 35 . HA 1 1 472 1 1 1 1 23 THR HB . 23 . HB 1 1 472 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 473 1 1 1 1 23 THR HB . 23 . HB 1 1 473 1 2 1 1 35 CYS HB3 . 35 . HB1 1 1 474 1 1 1 1 23 THR MG . 23 . HG2* 1 1 474 1 2 1 1 24 THR H . 24 . HN 1 1 475 1 1 1 1 23 THR MG . 23 . HG2* 1 1 475 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 476 1 1 1 1 23 THR MG . 23 . HG2* 1 1 476 1 2 1 1 36 LEU HA . 36 . HA 1 1 477 1 1 1 1 24 THR H . 24 . HN 1 1 477 1 2 1 1 24 THR HA . 24 . HA 1 1 478 1 1 1 1 24 THR H . 24 . HN 1 1 478 1 2 1 1 24 THR HB . 24 . HB 1 1 479 1 1 1 1 24 THR H . 24 . HN 1 1 479 1 2 1 1 24 THR MG . 24 . HG2* 1 1 480 1 1 1 1 24 THR H . 24 . HN 1 1 480 1 2 1 1 25 CYS H . 25 . HN 1 1 481 1 1 1 1 24 THR H . 24 . HN 1 1 481 1 2 1 1 26 GLN HE21 . 26 . HE21 1 1 482 1 1 1 1 24 THR H . 24 . HN 1 1 482 1 2 1 1 35 CYS HA . 35 . HA 1 1 483 1 1 1 1 24 THR H . 24 . HN 1 1 483 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 484 1 1 1 1 24 THR H . 24 . HN 1 1 484 1 2 1 1 35 CYS HB3 . 35 . HB1 1 1 485 1 1 1 1 24 THR H . 24 . HN 1 1 485 1 2 1 1 36 LEU H . 36 . HN 1 1 486 1 1 1 1 24 THR H . 24 . HN 1 1 486 1 2 1 1 36 LEU QB . 36 . HB* 1 1 487 1 1 1 1 24 THR H . 24 . HN 1 1 487 1 2 1 1 36 LEU HG . 36 . HG 1 1 488 1 1 1 1 24 THR HA . 24 . HA 1 1 488 1 2 1 1 24 THR HB . 24 . HB 1 1 489 1 1 1 1 24 THR HA . 24 . HA 1 1 489 1 2 1 1 24 THR MG . 24 . HG2* 1 1 490 1 1 1 1 24 THR HA . 24 . HA 1 1 490 1 2 1 1 25 CYS H . 25 . HN 1 1 491 1 1 1 1 24 THR HA . 24 . HA 1 1 491 1 2 1 1 25 CYS HB3 . 25 . HB1 1 1 491 1 2 1 1 35 CYS HB3 . 35 . HB1 1 1 492 1 1 1 1 24 THR HB . 24 . HB 1 1 492 1 2 1 1 24 THR MG . 24 . HG2* 1 1 493 1 1 1 1 24 THR HB . 24 . HB 1 1 493 1 2 1 1 25 CYS H . 25 . HN 1 1 494 1 1 1 1 24 THR HB . 24 . HB 1 1 494 1 2 1 1 26 GLN HE21 . 26 . HE21 1 1 495 1 1 1 1 24 THR MG . 24 . HG2* 1 1 495 1 2 1 1 25 CYS H . 25 . HN 1 1 496 1 1 1 1 24 THR MG . 24 . HG2* 1 1 496 1 2 1 1 26 GLN HE21 . 26 . HE21 1 1 497 1 1 1 1 24 THR MG . 24 . HG2* 1 1 497 1 2 1 1 26 GLN HE22 . 26 . HE22 1 1 498 1 1 1 1 25 CYS H . 25 . HN 1 1 498 1 2 1 1 25 CYS HA . 25 . HA 1 1 499 1 1 1 1 25 CYS H . 25 . HN 1 1 499 1 2 1 1 25 CYS HB2 . 25 . HB2 1 1 500 1 1 1 1 25 CYS H . 25 . HN 1 1 500 1 2 1 1 25 CYS HB3 . 25 . HB1 1 1 501 1 1 1 1 25 CYS H . 25 . HN 1 1 501 1 2 1 1 26 GLN H . 26 . HN 1 1 501 1 2 1 1 36 LEU H . 36 . HN 1 1 502 1 1 1 1 25 CYS H . 25 . HN 1 1 502 1 2 1 1 35 CYS HA . 35 . HA 1 1 503 2 1 1 1 25 CYS HA . 25 . HA 1 1 503 2 1 1 1 26 GLN HA . 26 . HA 1 1 503 2 2 1 1 34 GLN H . 34 . HN 1 1 503 3 1 1 1 25 CYS HA . 25 . HA 1 1 503 3 2 1 1 36 LEU H . 36 . HN 1 1 504 1 1 1 1 25 CYS HA . 25 . HA 1 1 504 1 2 1 1 25 CYS HB2 . 25 . HB2 1 1 505 1 1 1 1 25 CYS HA . 25 . HA 1 1 505 1 2 1 1 25 CYS HB3 . 25 . HB1 1 1 506 1 1 1 1 25 CYS HA . 25 . HA 1 1 506 1 2 1 1 26 GLN H . 26 . HN 1 1 507 1 1 1 1 25 CYS HA . 25 . HA 1 1 507 1 2 1 1 35 CYS HA . 35 . HA 1 1 508 1 1 1 1 25 CYS HA . 25 . HA 1 1 508 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 509 1 1 1 1 25 CYS HB2 . 25 . HB2 1 1 509 1 2 1 1 26 GLN H . 26 . HN 1 1 510 1 1 1 1 25 CYS HB2 . 25 . HB2 1 1 510 1 2 1 1 26 GLN H . 26 . HN 1 1 510 1 2 1 1 36 LEU H . 36 . HN 1 1 511 1 1 1 1 25 CYS HB2 . 25 . HB2 1 1 511 1 2 1 1 35 CYS HA . 35 . HA 1 1 512 1 1 1 1 25 CYS HB3 . 25 . HB1 1 1 512 1 1 1 1 35 CYS HB3 . 35 . HB1 1 1 512 1 2 1 1 26 GLN H . 26 . HN 1 1 513 1 1 1 1 26 GLN H . 26 . HN 1 1 513 1 2 1 1 26 GLN HB2 . 26 . HB2 1 1 514 2 1 1 1 26 GLN H . 26 . HN 1 1 514 2 2 1 1 26 GLN HB2 . 26 . HB2 1 1 514 3 1 1 1 28 LEU HB2 . 28 . HB2 1 1 514 3 2 1 1 34 GLN H . 34 . HN 1 1 515 1 1 1 1 26 GLN H . 26 . HN 1 1 515 1 2 1 1 26 GLN HB3 . 26 . HB1 1 1 516 1 1 1 1 26 GLN H . 26 . HN 1 1 516 1 1 1 1 34 GLN H . 34 . HN 1 1 516 1 2 1 1 26 GLN HB3 . 26 . HB1 1 1 517 1 1 1 1 26 GLN H . 26 . HN 1 1 517 1 1 1 1 36 LEU H . 36 . HN 1 1 517 1 2 1 1 26 GLN HG2 . 26 . HG2 1 1 518 1 1 1 1 26 GLN H . 26 . HN 1 1 518 1 1 1 1 36 LEU H . 36 . HN 1 1 518 1 2 1 1 26 GLN HG3 . 26 . HG1 1 1 519 2 1 1 1 26 GLN H . 26 . HN 1 1 519 2 2 1 1 27 VAL H . 27 . HN 1 1 519 3 1 1 1 28 LEU H . 28 . HN 1 1 519 3 2 1 1 34 GLN H . 34 . HN 1 1 520 2 1 1 1 26 GLN H . 26 . HN 1 1 520 2 1 1 1 34 GLN H . 34 . HN 1 1 520 2 2 1 1 28 LEU MD2 . 28 . HD2* 1 1 520 2 2 1 1 36 LEU MD1 . 36 . HD1* 1 1 520 3 1 1 1 36 LEU H . 36 . HN 1 1 520 3 2 1 1 36 LEU MD1 . 36 . HD1* 1 1 521 1 1 1 1 26 GLN H . 26 . HN 1 1 521 1 1 1 1 34 GLN H . 34 . HN 1 1 521 1 1 1 1 36 LEU H . 36 . HN 1 1 521 1 2 1 1 35 CYS H . 35 . HN 1 1 522 1 1 1 1 26 GLN H . 26 . HN 1 1 522 1 1 1 1 36 LEU H . 36 . HN 1 1 522 1 2 1 1 34 GLN HA . 34 . HA 1 1 523 1 1 1 1 26 GLN H . 26 . HN 1 1 523 1 2 1 1 35 CYS HA . 35 . HA 1 1 524 1 1 1 1 26 GLN H . 26 . HN 1 1 524 1 1 1 1 36 LEU H . 36 . HN 1 1 524 1 2 1 1 36 LEU HG . 36 . HG 1 1 525 1 1 1 1 26 GLN HA . 26 . HA 1 1 525 1 2 1 1 26 GLN HB2 . 26 . HB2 1 1 526 1 1 1 1 26 GLN HA . 26 . HA 1 1 526 1 2 1 1 26 GLN HB3 . 26 . HB1 1 1 527 2 1 1 1 26 GLN HA . 26 . HA 1 1 527 2 2 1 1 26 GLN HE21 . 26 . HE21 1 1 527 3 1 1 1 29 ASN HD22 . 29 . HD22 1 1 527 3 2 1 1 32 TYR HA . 32 . HA 1 1 528 1 1 1 1 26 GLN HA . 26 . HA 1 1 528 1 2 1 1 26 GLN HG2 . 26 . HG2 1 1 529 1 1 1 1 26 GLN HA . 26 . HA 1 1 529 1 2 1 1 26 GLN HG3 . 26 . HG1 1 1 530 1 1 1 1 26 GLN HA . 26 . HA 1 1 530 1 2 1 1 27 VAL H . 27 . HN 1 1 531 1 1 1 1 26 GLN HA . 26 . HA 1 1 531 1 2 1 1 27 VAL MG2 . 27 . HG2* 1 1 532 1 1 1 1 26 GLN HB2 . 26 . HB2 1 1 532 1 2 1 1 26 GLN HE21 . 26 . HE21 1 1 533 1 1 1 1 26 GLN HB2 . 26 . HB2 1 1 533 1 2 1 1 26 GLN HG2 . 26 . HG2 1 1 534 2 1 1 1 26 GLN HB2 . 26 . HB2 1 1 534 2 2 1 1 26 GLN HG2 . 26 . HG2 1 1 534 3 1 1 1 30 PRO HB3 . 30 . HB1 1 1 534 3 2 1 1 30 PRO HG3 . 30 . HG1 1 1 535 1 1 1 1 26 GLN HB2 . 26 . HB2 1 1 535 1 2 1 1 26 GLN HG3 . 26 . HG1 1 1 536 2 1 1 1 26 GLN HB2 . 26 . HB2 1 1 536 2 2 1 1 36 LEU MD1 . 36 . HD1* 1 1 536 3 1 1 1 27 VAL HB . 27 . HB 1 1 536 3 2 1 1 27 VAL MG2 . 27 . HG2* 1 1 536 4 1 1 1 28 LEU HB2 . 28 . HB2 1 1 536 4 2 1 1 28 LEU MD2 . 28 . HD2* 1 1 537 1 1 1 1 26 GLN HB2 . 26 . HB2 1 1 537 1 1 1 1 28 LEU HB2 . 28 . HB2 1 1 537 1 1 1 1 34 GLN HB3 . 34 . HB1 1 1 537 1 2 1 1 34 GLN H . 34 . HN 1 1 538 2 1 1 1 26 GLN HB3 . 26 . HB1 1 1 538 2 2 1 1 26 GLN HG2 . 26 . HG2 1 1 538 3 1 1 1 30 PRO HB3 . 30 . HB1 1 1 538 3 2 1 1 30 PRO HG2 . 30 . HG2 1 1 539 1 1 1 1 26 GLN HB3 . 26 . HB1 1 1 539 1 2 1 1 26 GLN HG3 . 26 . HG1 1 1 540 2 1 1 1 26 GLN HB3 . 26 . HB1 1 1 540 2 1 1 1 34 GLN QG . 34 . HG* 1 1 540 2 2 1 1 34 GLN H . 34 . HN 1 1 540 3 1 1 1 34 GLN QG . 34 . HG* 1 1 540 3 2 1 1 36 LEU H . 36 . HN 1 1 541 1 1 1 1 26 GLN HB3 . 26 . HB1 1 1 541 1 2 1 1 36 LEU HG . 36 . HG 1 1 542 1 1 1 1 26 GLN HE21 . 26 . HE21 1 1 542 1 2 1 1 26 GLN HG2 . 26 . HG2 1 1 543 1 1 1 1 26 GLN HE21 . 26 . HE21 1 1 543 1 2 1 1 26 GLN HG3 . 26 . HG1 1 1 544 2 1 1 1 26 GLN HE21 . 26 . HE21 1 1 544 2 2 1 1 36 LEU MD1 . 36 . HD1* 1 1 544 3 1 1 1 28 LEU MD2 . 28 . HD2* 1 1 544 3 2 1 1 29 ASN HD22 . 29 . HD22 1 1 545 1 1 1 1 26 GLN HE21 . 26 . HE21 1 1 545 1 2 1 1 36 LEU H . 36 . HN 1 1 546 1 1 1 1 26 GLN HE21 . 26 . HE21 1 1 546 1 2 1 1 36 LEU QB . 36 . HB* 1 1 547 1 1 1 1 26 GLN HE22 . 26 . HE22 1 1 547 1 2 1 1 26 GLN HG2 . 26 . HG2 1 1 548 1 1 1 1 26 GLN HE22 . 26 . HE22 1 1 548 1 2 1 1 26 GLN HG3 . 26 . HG1 1 1 549 2 1 1 1 26 GLN HE22 . 26 . HE22 1 1 549 2 2 1 1 36 LEU H . 36 . HN 1 1 549 3 1 1 1 33 SER H . 33 . HN 1 1 549 3 2 1 1 34 GLN H . 34 . HN 1 1 550 1 1 1 1 26 GLN HE22 . 26 . HE22 1 1 550 1 1 1 1 34 GLN HE22 . 34 . HE22 1 1 550 1 2 1 1 36 LEU MD2 . 36 . HD2* 1 1 551 1 1 1 1 26 GLN HE22 . 26 . HE22 1 1 551 1 2 1 1 36 LEU QB . 36 . HB* 1 1 552 1 1 1 1 26 GLN HE22 . 26 . HE22 1 1 552 1 2 1 1 36 LEU MD1 . 36 . HD1* 1 1 553 1 1 1 1 26 GLN HG3 . 26 . HG1 1 1 553 1 2 1 1 27 VAL H . 27 . HN 1 1 554 1 1 1 1 26 GLN HG3 . 26 . HG1 1 1 554 1 2 1 1 36 LEU QB . 36 . HB* 1 1 555 1 1 1 1 26 GLN HG3 . 26 . HG1 1 1 555 1 2 1 1 36 LEU MD1 . 36 . HD1* 1 1 556 2 1 1 1 27 VAL H . 27 . HN 1 1 556 2 2 1 1 27 VAL HB . 27 . HB 1 1 556 3 1 1 1 28 LEU H . 28 . HN 1 1 556 3 2 1 1 28 LEU HB2 . 28 . HB2 1 1 557 2 1 1 1 27 VAL H . 27 . HN 1 1 557 2 2 1 1 27 VAL HB . 27 . HB 1 1 557 3 1 1 1 28 LEU H . 28 . HN 1 1 557 3 1 1 1 29 ASN H . 29 . HN 1 1 557 3 2 1 1 28 LEU HB2 . 28 . HB2 1 1 558 1 1 1 1 27 VAL H . 27 . HN 1 1 558 1 1 1 1 28 LEU H . 28 . HN 1 1 558 1 2 1 1 27 VAL MG1 . 27 . HG1* 1 1 559 1 1 1 1 27 VAL H . 27 . HN 1 1 559 1 2 1 1 27 VAL MG2 . 27 . HG2* 1 1 560 1 1 1 1 27 VAL H . 27 . HN 1 1 560 1 1 1 1 28 LEU H . 28 . HN 1 1 560 1 2 1 1 34 GLN H . 34 . HN 1 1 561 1 1 1 1 27 VAL HA . 27 . HA 1 1 561 1 2 1 1 27 VAL HB . 27 . HB 1 1 562 1 1 1 1 27 VAL HA . 27 . HA 1 1 562 1 2 1 1 27 VAL MG1 . 27 . HG1* 1 1 563 1 1 1 1 27 VAL HA . 27 . HA 1 1 563 1 2 1 1 27 VAL MG2 . 27 . HG2* 1 1 564 1 1 1 1 27 VAL HA . 27 . HA 1 1 564 1 2 1 1 28 LEU H . 28 . HN 1 1 565 1 1 1 1 27 VAL HA . 27 . HA 1 1 565 1 2 1 1 28 LEU HB3 . 28 . HB1 1 1 565 1 2 1 1 28 LEU HG . 28 . HG 1 1 566 1 1 1 1 27 VAL HA . 27 . HA 1 1 566 1 2 1 1 33 SER HA . 33 . HA 1 1 567 1 1 1 1 27 VAL HA . 27 . HA 1 1 567 1 2 1 1 33 SER HB3 . 33 . HB1 1 1 568 1 1 1 1 27 VAL HA . 27 . HA 1 1 568 1 2 1 1 34 GLN H . 34 . HN 1 1 569 1 1 1 1 27 VAL HB . 27 . HB 1 1 569 1 2 1 1 27 VAL MG1 . 27 . HG1* 1 1 570 1 1 1 1 27 VAL MG1 . 27 . HG1* 1 1 570 1 2 1 1 28 LEU H . 28 . HN 1 1 570 1 2 1 1 29 ASN H . 29 . HN 1 1 571 1 1 1 1 27 VAL MG1 . 27 . HG1* 1 1 571 1 2 1 1 28 LEU HA . 28 . HA 1 1 572 1 1 1 1 27 VAL MG1 . 27 . HG1* 1 1 572 1 2 1 1 29 ASN H . 29 . HN 1 1 573 1 1 1 1 27 VAL MG1 . 27 . HG1* 1 1 573 1 2 1 1 29 ASN HA . 29 . HA 1 1 574 1 1 1 1 27 VAL MG1 . 27 . HG1* 1 1 574 1 2 1 1 30 PRO HA . 30 . HA 1 1 575 1 1 1 1 27 VAL MG1 . 27 . HG1* 1 1 575 1 2 1 1 33 SER HA . 33 . HA 1 1 576 2 1 1 1 27 VAL MG2 . 27 . HG2* 1 1 576 2 2 1 1 33 SER HB2 . 33 . HB2 1 1 576 3 1 1 1 28 LEU MD2 . 28 . HD2* 1 1 576 3 2 1 1 32 TYR HB2 . 32 . HB2 1 1 577 1 1 1 1 27 VAL MG2 . 27 . HG2* 1 1 577 1 1 1 1 28 LEU MD2 . 28 . HD2* 1 1 577 1 2 1 1 33 SER HA . 33 . HA 1 1 578 1 1 1 1 27 VAL MG2 . 27 . HG2* 1 1 578 1 2 1 1 33 SER HB2 . 33 . HB2 1 1 579 1 1 1 1 27 VAL MG2 . 27 . HG2* 1 1 579 1 2 1 1 33 SER HB3 . 33 . HB1 1 1 580 2 1 1 1 28 LEU H . 28 . HN 1 1 580 2 1 1 1 29 ASN H . 29 . HN 1 1 580 2 2 1 1 28 LEU HB3 . 28 . HB1 1 1 580 3 1 1 1 28 LEU H . 28 . HN 1 1 580 3 2 1 1 28 LEU HG . 28 . HG 1 1 581 1 1 1 1 28 LEU H . 28 . HN 1 1 581 1 2 1 1 28 LEU HB3 . 28 . HB1 1 1 581 1 2 1 1 28 LEU HG . 28 . HG 1 1 582 2 1 1 1 28 LEU H . 28 . HN 1 1 582 2 2 1 1 28 LEU HG . 28 . HG 1 1 582 3 1 1 1 28 LEU HB3 . 28 . HB1 1 1 582 3 2 1 1 29 ASN H . 29 . HN 1 1 583 1 1 1 1 28 LEU H . 28 . HN 1 1 583 1 2 1 1 28 LEU MD1 . 28 . HD1* 1 1 584 1 1 1 1 28 LEU H . 28 . HN 1 1 584 1 1 1 1 29 ASN H . 29 . HN 1 1 584 1 2 1 1 32 TYR HB3 . 32 . HB1 1 1 585 1 1 1 1 28 LEU H . 28 . HN 1 1 585 1 1 1 1 29 ASN H . 29 . HN 1 1 585 1 2 1 1 32 TYR QD . 32 . HD* 1 1 586 1 1 1 1 28 LEU H . 28 . HN 1 1 586 1 1 1 1 31 TYR H . 31 . HN 1 1 586 1 2 1 1 32 TYR HB3 . 32 . HB1 1 1 587 1 1 1 1 28 LEU H . 28 . HN 1 1 587 1 2 1 1 33 SER HA . 33 . HA 1 1 588 1 1 1 1 28 LEU HA . 28 . HA 1 1 588 1 2 1 1 28 LEU HB2 . 28 . HB2 1 1 589 1 1 1 1 28 LEU HA . 28 . HA 1 1 589 1 2 1 1 28 LEU HB3 . 28 . HB1 1 1 589 1 2 1 1 28 LEU HG . 28 . HG 1 1 590 1 1 1 1 28 LEU HA . 28 . HA 1 1 590 1 2 1 1 28 LEU MD1 . 28 . HD1* 1 1 591 1 1 1 1 28 LEU HA . 28 . HA 1 1 591 1 2 1 1 28 LEU MD2 . 28 . HD2* 1 1 592 1 1 1 1 28 LEU HA . 28 . HA 1 1 592 1 2 1 1 32 TYR QD . 32 . HD* 1 1 593 1 1 1 1 28 LEU HB2 . 28 . HB2 1 1 593 1 2 1 1 28 LEU MD1 . 28 . HD1* 1 1 594 1 1 1 1 28 LEU HB2 . 28 . HB2 1 1 594 1 1 1 1 34 GLN HB3 . 34 . HB1 1 1 594 1 2 1 1 28 LEU MD1 . 28 . HD1* 1 1 595 1 1 1 1 28 LEU HB2 . 28 . HB2 1 1 595 1 2 1 1 29 ASN H . 29 . HN 1 1 596 1 1 1 1 28 LEU HB2 . 28 . HB2 1 1 596 1 1 1 1 30 PRO HG3 . 30 . HG1 1 1 596 1 2 1 1 29 ASN HA . 29 . HA 1 1 597 1 1 1 1 28 LEU HB2 . 28 . HB2 1 1 597 1 1 1 1 30 PRO HG3 . 30 . HG1 1 1 597 1 2 1 1 29 ASN QB . 29 . HB* 1 1 598 1 1 1 1 28 LEU HB2 . 28 . HB2 1 1 598 1 2 1 1 29 ASN HD21 . 29 . HD21 1 1 599 1 1 1 1 28 LEU HB2 . 28 . HB2 1 1 599 1 2 1 1 32 TYR HB3 . 32 . HB1 1 1 600 1 1 1 1 28 LEU HB2 . 28 . HB2 1 1 600 1 2 1 1 32 TYR QD . 32 . HD* 1 1 601 1 1 1 1 28 LEU HB2 . 28 . HB2 1 1 601 1 2 1 1 33 SER HA . 33 . HA 1 1 602 1 1 1 1 28 LEU HB3 . 28 . HB1 1 1 602 1 1 1 1 28 LEU HG . 28 . HG 1 1 602 1 2 1 1 32 TYR QD . 32 . HD* 1 1 603 1 1 1 1 28 LEU HB3 . 28 . HB1 1 1 603 1 1 1 1 28 LEU HG . 28 . HG 1 1 603 1 2 1 1 33 SER HA . 33 . HA 1 1 604 1 1 1 1 28 LEU HB3 . 28 . HB1 1 1 604 1 2 1 1 29 ASN HD21 . 29 . HD21 1 1 605 1 1 1 1 28 LEU HB3 . 28 . HB1 1 1 605 1 2 1 1 29 ASN HD22 . 29 . HD22 1 1 606 1 1 1 1 28 LEU MD1 . 28 . HD1* 1 1 606 1 2 1 1 32 TYR HB3 . 32 . HB1 1 1 607 1 1 1 1 28 LEU MD1 . 28 . HD1* 1 1 607 1 2 1 1 32 TYR QD . 32 . HD* 1 1 608 1 1 1 1 28 LEU MD1 . 28 . HD1* 1 1 608 1 2 1 1 32 TYR QE . 32 . HE* 1 1 609 1 1 1 1 28 LEU MD1 . 28 . HD1* 1 1 609 1 2 1 1 33 SER HA . 33 . HA 1 1 610 1 1 1 1 28 LEU MD1 . 28 . HD1* 1 1 610 1 2 1 1 34 GLN H . 34 . HN 1 1 611 1 1 1 1 28 LEU MD1 . 28 . HD1* 1 1 611 1 2 1 1 34 GLN HB2 . 34 . HB2 1 1 612 1 1 1 1 28 LEU MD1 . 28 . HD1* 1 1 612 1 1 1 1 36 LEU MD2 . 36 . HD2* 1 1 612 1 2 1 1 34 GLN HE21 . 34 . HE21 1 1 613 1 1 1 1 28 LEU MD2 . 28 . HD2* 1 1 613 1 2 1 1 29 ASN H . 29 . HN 1 1 614 1 1 1 1 28 LEU MD2 . 28 . HD2* 1 1 614 1 2 1 1 32 TYR QD . 32 . HD* 1 1 615 1 1 1 1 28 LEU MD2 . 28 . HD2* 1 1 615 1 2 1 1 32 TYR QE . 32 . HE* 1 1 616 1 1 1 1 29 ASN H . 29 . HN 1 1 616 1 2 1 1 29 ASN HA . 29 . HA 1 1 617 1 1 1 1 29 ASN H . 29 . HN 1 1 617 1 2 1 1 29 ASN QB . 29 . HB* 1 1 618 1 1 1 1 29 ASN H . 29 . HN 1 1 618 1 1 1 1 31 TYR H . 31 . HN 1 1 618 1 2 1 1 29 ASN QB . 29 . HB* 1 1 619 1 1 1 1 29 ASN H . 29 . HN 1 1 619 1 2 1 1 30 PRO HD2 . 30 . HD2 1 1 620 1 1 1 1 29 ASN H . 29 . HN 1 1 620 1 2 1 1 32 TYR HB3 . 32 . HB1 1 1 621 1 1 1 1 29 ASN HA . 29 . HA 1 1 621 1 2 1 1 29 ASN QB . 29 . HB* 1 1 622 1 1 1 1 29 ASN HA . 29 . HA 1 1 622 1 2 1 1 29 ASN HD21 . 29 . HD21 1 1 623 1 1 1 1 29 ASN HA . 29 . HA 1 1 623 1 2 1 1 30 PRO HD2 . 30 . HD2 1 1 624 1 1 1 1 29 ASN HA . 29 . HA 1 1 624 1 2 1 1 30 PRO HD3 . 30 . HD1 1 1 625 1 1 1 1 29 ASN HA . 29 . HA 1 1 625 1 2 1 1 30 PRO HG2 . 30 . HG2 1 1 626 1 1 1 1 29 ASN HA . 29 . HA 1 1 626 1 2 1 1 30 PRO HG3 . 30 . HG1 1 1 627 1 1 1 1 29 ASN QB . 29 . HB* 1 1 627 1 2 1 1 29 ASN HD21 . 29 . HD21 1 1 628 1 1 1 1 29 ASN QB . 29 . HB* 1 1 628 1 2 1 1 29 ASN HD22 . 29 . HD22 1 1 629 1 1 1 1 29 ASN QB . 29 . HB* 1 1 629 1 2 1 1 29 ASN HD22 . 29 . HD22 1 1 629 1 2 1 1 31 TYR QD . 31 . HD* 1 1 630 1 1 1 1 29 ASN QB . 29 . HB* 1 1 630 1 2 1 1 30 PRO HD2 . 30 . HD2 1 1 631 1 1 1 1 29 ASN QB . 29 . HB* 1 1 631 1 2 1 1 30 PRO HD3 . 30 . HD1 1 1 632 1 1 1 1 29 ASN QB . 29 . HB* 1 1 632 1 2 1 1 30 PRO HG2 . 30 . HG2 1 1 633 1 1 1 1 29 ASN QB . 29 . HB* 1 1 633 1 2 1 1 31 TYR H . 31 . HN 1 1 634 1 1 1 1 29 ASN QB . 29 . HB* 1 1 634 1 2 1 1 31 TYR QD . 31 . HD* 1 1 635 1 1 1 1 29 ASN QB . 29 . HB* 1 1 635 1 2 1 1 32 TYR H . 32 . HN 1 1 636 1 1 1 1 29 ASN HD21 . 29 . HD21 1 1 636 1 2 1 1 30 PRO HD2 . 30 . HD2 1 1 637 1 1 1 1 29 ASN HD21 . 29 . HD21 1 1 637 1 2 1 1 30 PRO HD3 . 30 . HD1 1 1 638 1 1 1 1 29 ASN HD21 . 29 . HD21 1 1 638 1 2 1 1 32 TYR HB2 . 32 . HB2 1 1 639 1 1 1 1 29 ASN HD21 . 29 . HD21 1 1 639 1 2 1 1 32 TYR HB3 . 32 . HB1 1 1 640 1 1 1 1 29 ASN HD22 . 29 . HD22 1 1 640 1 2 1 1 32 TYR HB2 . 32 . HB2 1 1 641 1 1 1 1 29 ASN HD22 . 29 . HD22 1 1 641 1 2 1 1 32 TYR HB3 . 32 . HB1 1 1 642 1 1 1 1 30 PRO HA . 30 . HA 1 1 642 1 2 1 1 30 PRO HB3 . 30 . HB1 1 1 643 1 1 1 1 30 PRO HB2 . 30 . HB2 1 1 643 1 2 1 1 30 PRO HD2 . 30 . HD2 1 1 644 1 1 1 1 30 PRO HB2 . 30 . HB2 1 1 644 1 2 1 1 31 TYR H . 31 . HN 1 1 645 1 1 1 1 30 PRO HB3 . 30 . HB1 1 1 645 1 2 1 1 30 PRO HD3 . 30 . HD1 1 1 646 1 1 1 1 30 PRO HB3 . 30 . HB1 1 1 646 1 2 1 1 30 PRO HG3 . 30 . HG1 1 1 647 1 1 1 1 30 PRO HB3 . 30 . HB1 1 1 647 1 2 1 1 31 TYR QD . 31 . HD* 1 1 648 1 1 1 1 30 PRO HB3 . 30 . HB1 1 1 648 1 2 1 1 31 TYR QE . 31 . HE* 1 1 649 1 1 1 1 30 PRO HD2 . 30 . HD2 1 1 649 1 2 1 1 30 PRO HG2 . 30 . HG2 1 1 650 1 1 1 1 30 PRO HD2 . 30 . HD2 1 1 650 1 2 1 1 30 PRO HG3 . 30 . HG1 1 1 651 1 1 1 1 30 PRO HD2 . 30 . HD2 1 1 651 1 2 1 1 31 TYR H . 31 . HN 1 1 652 1 1 1 1 30 PRO HD2 . 30 . HD2 1 1 652 1 2 1 1 31 TYR QD . 31 . HD* 1 1 653 1 1 1 1 30 PRO HD2 . 30 . HD2 1 1 653 1 2 1 1 31 TYR QE . 31 . HE* 1 1 654 1 1 1 1 30 PRO HD3 . 30 . HD1 1 1 654 1 2 1 1 30 PRO HG2 . 30 . HG2 1 1 655 1 1 1 1 30 PRO HD3 . 30 . HD1 1 1 655 1 2 1 1 30 PRO HG3 . 30 . HG1 1 1 656 1 1 1 1 30 PRO HD3 . 30 . HD1 1 1 656 1 2 1 1 31 TYR QD . 31 . HD* 1 1 657 1 1 1 1 30 PRO HG2 . 30 . HG2 1 1 657 1 2 1 1 31 TYR HA . 31 . HA 1 1 658 1 1 1 1 30 PRO HG2 . 30 . HG2 1 1 658 1 2 1 1 31 TYR QD . 31 . HD* 1 1 659 1 1 1 1 30 PRO HG2 . 30 . HG2 1 1 659 1 2 1 1 31 TYR QE . 31 . HE* 1 1 660 1 1 1 1 31 TYR H . 31 . HN 1 1 660 1 2 1 1 31 TYR HB2 . 31 . HB2 1 1 661 1 1 1 1 31 TYR H . 31 . HN 1 1 661 1 2 1 1 31 TYR HB3 . 31 . HB1 1 1 662 1 1 1 1 31 TYR H . 31 . HN 1 1 662 1 2 1 1 31 TYR QD . 31 . HD* 1 1 663 1 1 1 1 31 TYR H . 31 . HN 1 1 663 1 2 1 1 32 TYR H . 32 . HN 1 1 664 1 1 1 1 31 TYR HA . 31 . HA 1 1 664 1 2 1 1 31 TYR HB2 . 31 . HB2 1 1 665 1 1 1 1 31 TYR HA . 31 . HA 1 1 665 1 2 1 1 31 TYR HB3 . 31 . HB1 1 1 666 1 1 1 1 31 TYR HA . 31 . HA 1 1 666 1 2 1 1 31 TYR QD . 31 . HD* 1 1 667 1 1 1 1 31 TYR HA . 31 . HA 1 1 667 1 2 1 1 31 TYR QE . 31 . HE* 1 1 668 1 1 1 1 31 TYR HA . 31 . HA 1 1 668 1 2 1 1 32 TYR H . 32 . HN 1 1 669 1 1 1 1 31 TYR HB2 . 31 . HB2 1 1 669 1 2 1 1 31 TYR QD . 31 . HD* 1 1 670 1 1 1 1 31 TYR HB2 . 31 . HB2 1 1 670 1 2 1 1 31 TYR QE . 31 . HE* 1 1 671 1 1 1 1 31 TYR HB2 . 31 . HB2 1 1 671 1 1 1 1 32 TYR HB2 . 32 . HB2 1 1 671 1 2 1 1 32 TYR H . 32 . HN 1 1 672 1 1 1 1 31 TYR HB3 . 31 . HB1 1 1 672 1 2 1 1 31 TYR QD . 31 . HD* 1 1 673 1 1 1 1 31 TYR HB3 . 31 . HB1 1 1 673 1 2 1 1 32 TYR H . 32 . HN 1 1 674 1 1 1 1 31 TYR QD . 31 . HD* 1 1 674 1 2 1 1 32 TYR H . 32 . HN 1 1 675 1 1 1 1 32 TYR H . 32 . HN 1 1 675 1 2 1 1 32 TYR HB2 . 32 . HB2 1 1 676 1 1 1 1 32 TYR H . 32 . HN 1 1 676 1 2 1 1 32 TYR HB3 . 32 . HB1 1 1 677 1 1 1 1 32 TYR H . 32 . HN 1 1 677 1 2 1 1 32 TYR QD . 32 . HD* 1 1 678 1 1 1 1 32 TYR H . 32 . HN 1 1 678 1 2 1 1 33 SER H . 33 . HN 1 1 679 1 1 1 1 32 TYR HA . 32 . HA 1 1 679 1 2 1 1 32 TYR HB2 . 32 . HB2 1 1 680 1 1 1 1 32 TYR HA . 32 . HA 1 1 680 1 2 1 1 32 TYR QD . 32 . HD* 1 1 681 1 1 1 1 32 TYR HA . 32 . HA 1 1 681 1 2 1 1 32 TYR QE . 32 . HE* 1 1 682 1 1 1 1 32 TYR HA . 32 . HA 1 1 682 1 2 1 1 33 SER H . 33 . HN 1 1 683 1 1 1 1 32 TYR HB2 . 32 . HB2 1 1 683 1 2 1 1 32 TYR QD . 32 . HD* 1 1 684 1 1 1 1 32 TYR HB3 . 32 . HB1 1 1 684 1 2 1 1 32 TYR QD . 32 . HD* 1 1 685 1 1 1 1 32 TYR HB3 . 32 . HB1 1 1 685 1 2 1 1 33 SER H . 33 . HN 1 1 686 1 1 1 1 32 TYR QD . 32 . HD* 1 1 686 1 2 1 1 34 GLN HB2 . 34 . HB2 1 1 687 1 1 1 1 32 TYR QE . 32 . HE* 1 1 687 1 2 1 1 34 GLN HA . 34 . HA 1 1 688 1 1 1 1 32 TYR QE . 32 . HE* 1 1 688 1 2 1 1 34 GLN HB2 . 34 . HB2 1 1 689 1 1 1 1 32 TYR QE . 32 . HE* 1 1 689 1 2 1 1 34 GLN HB3 . 34 . HB1 1 1 690 1 1 1 1 32 TYR QE . 32 . HE* 1 1 690 1 2 1 1 34 GLN HE21 . 34 . HE21 1 1 691 1 1 1 1 33 SER H . 33 . HN 1 1 691 1 2 1 1 33 SER HB2 . 33 . HB2 1 1 692 1 1 1 1 33 SER H . 33 . HN 1 1 692 1 2 1 1 33 SER HB3 . 33 . HB1 1 1 693 1 1 1 1 33 SER H . 33 . HN 1 1 693 1 1 1 1 34 GLN HE22 . 34 . HE22 1 1 693 1 2 1 1 34 GLN HB3 . 34 . HB1 1 1 694 1 1 1 1 33 SER HA . 33 . HA 1 1 694 1 2 1 1 33 SER HB3 . 33 . HB1 1 1 695 1 1 1 1 33 SER HA . 33 . HA 1 1 695 1 2 1 1 34 GLN H . 34 . HN 1 1 696 2 1 1 1 33 SER HB2 . 33 . HB2 1 1 696 2 2 1 1 34 GLN H . 34 . HN 1 1 696 3 1 1 1 35 CYS HB3 . 35 . HB1 1 1 696 3 2 1 1 36 LEU H . 36 . HN 1 1 697 1 1 1 1 34 GLN H . 34 . HN 1 1 697 1 2 1 1 34 GLN HB2 . 34 . HB2 1 1 698 1 1 1 1 34 GLN H . 34 . HN 1 1 698 1 2 1 1 34 GLN HB3 . 34 . HB1 1 1 699 1 1 1 1 34 GLN H . 34 . HN 1 1 699 1 1 1 1 36 LEU H . 36 . HN 1 1 699 1 2 1 1 35 CYS H . 35 . HN 1 1 700 1 1 1 1 34 GLN HA . 34 . HA 1 1 700 1 2 1 1 35 CYS H . 35 . HN 1 1 701 1 1 1 1 34 GLN HB2 . 34 . HB2 1 1 701 1 2 1 1 34 GLN QG . 34 . HG* 1 1 702 1 1 1 1 34 GLN HB2 . 34 . HB2 1 1 702 1 2 1 1 35 CYS H . 35 . HN 1 1 703 1 1 1 1 34 GLN HB3 . 34 . HB1 1 1 703 1 2 1 1 36 LEU MD2 . 36 . HD2* 1 1 704 1 1 1 1 34 GLN HB3 . 34 . HB1 1 1 704 1 2 1 1 36 LEU HG . 36 . HG 1 1 705 1 1 1 1 34 GLN HE21 . 34 . HE21 1 1 705 1 2 1 1 34 GLN QG . 34 . HG* 1 1 706 1 1 1 1 34 GLN HE21 . 34 . HE21 1 1 706 1 2 1 1 36 LEU MD2 . 36 . HD2* 1 1 707 1 1 1 1 34 GLN HE22 . 34 . HE22 1 1 707 1 2 1 1 34 GLN QG . 34 . HG* 1 1 708 1 1 1 1 34 GLN QG . 34 . HG* 1 1 708 1 2 1 1 35 CYS H . 35 . HN 1 1 709 1 1 1 1 34 GLN QG . 34 . HG* 1 1 709 1 2 1 1 36 LEU MD2 . 36 . HD2* 1 1 710 1 1 1 1 34 GLN QG . 34 . HG* 1 1 710 1 2 1 1 36 LEU HG . 36 . HG 1 1 711 1 1 1 1 35 CYS H . 35 . HN 1 1 711 1 2 1 1 35 CYS HA . 35 . HA 1 1 712 1 1 1 1 35 CYS H . 35 . HN 1 1 712 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 713 1 1 1 1 35 CYS H . 35 . HN 1 1 713 1 2 1 1 35 CYS HB3 . 35 . HB1 1 1 714 1 1 1 1 35 CYS H . 35 . HN 1 1 714 1 2 1 1 36 LEU HG . 36 . HG 1 1 715 1 1 1 1 35 CYS HA . 35 . HA 1 1 715 1 2 1 1 35 CYS HB2 . 35 . HB2 1 1 716 1 1 1 1 35 CYS HA . 35 . HA 1 1 716 1 2 1 1 35 CYS HB3 . 35 . HB1 1 1 717 1 1 1 1 35 CYS HA . 35 . HA 1 1 717 1 2 1 1 36 LEU H . 36 . HN 1 1 718 1 1 1 1 35 CYS HA . 35 . HA 1 1 718 1 2 1 1 36 LEU QB . 36 . HB* 1 1 719 1 1 1 1 35 CYS HA . 35 . HA 1 1 719 1 2 1 1 36 LEU HG . 36 . HG 1 1 720 1 1 1 1 35 CYS HB2 . 35 . HB2 1 1 720 1 2 1 1 36 LEU H . 36 . HN 1 1 721 1 1 1 1 35 CYS HB2 . 35 . HB2 1 1 721 1 2 1 1 36 LEU HA . 36 . HA 1 1 722 1 1 1 1 36 LEU H . 36 . HN 1 1 722 1 2 1 1 36 LEU HA . 36 . HA 1 1 723 1 1 1 1 36 LEU H . 36 . HN 1 1 723 1 2 1 1 36 LEU QB . 36 . HB* 1 1 724 1 1 1 1 36 LEU H . 36 . HN 1 1 724 1 2 1 1 36 LEU HG . 36 . HG 1 1 725 1 1 1 1 36 LEU HA . 36 . HA 1 1 725 1 2 1 1 36 LEU QB . 36 . HB* 1 1 726 1 1 1 1 36 LEU HA . 36 . HA 1 1 726 1 2 1 1 36 LEU MD1 . 36 . HD1* 1 1 727 1 1 1 1 36 LEU HA . 36 . HA 1 1 727 1 2 1 1 36 LEU MD2 . 36 . HD2* 1 1 728 1 1 1 1 36 LEU HA . 36 . HA 1 1 728 1 2 1 1 36 LEU HG . 36 . HG 1 1 729 1 1 1 1 36 LEU QB . 36 . HB* 1 1 729 1 2 1 1 36 LEU MD1 . 36 . HD1* 1 1 730 1 1 1 1 36 LEU QB . 36 . HB* 1 1 730 1 2 1 1 36 LEU HG . 36 . HG 1 1 731 1 1 1 1 36 LEU MD1 . 36 . HD1* 1 1 731 1 2 1 1 36 LEU HG . 36 . HG 1 1 732 1 1 1 1 36 LEU MD2 . 36 . HD2* 1 1 732 1 2 1 1 36 LEU HG . 36 . HG 1 1 733 1 1 2 2 1 MAN H3 . 101 . H3 1 1 733 1 1 2 2 1 MAN H61 . 101 . H61 1 1 733 1 2 2 2 1 MAN H5 . 101 . H5 1 1 734 1 1 2 2 1 MAN H5 . 101 . H5 1 1 734 1 2 2 2 1 MAN H62 . 101 . H62 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 . . . . . 2.65 1.8 3.5 1 1 2 1 . . . . . 2.65 1.8 2.8 1 1 3 1 . . . . . 3.15 1.8 4.5 1 1 4 1 . . . . . 3.65 1.8 5.5 1 1 5 2 . . . . . 3.65 1.8 5.5 1 1 5 3 . . . . . 3.65 1.8 5.5 1 1 5 4 . . . . . 3.65 1.8 5.5 1 1 6 1 . . . . . 4.15 1.8 6.5 1 1 7 1 . . . . . 3.65 1.8 4.5 1 1 8 1 . . . . . 3.15 1.8 4.5 1 1 9 1 . . . . . 3.65 1.8 5.5 1 1 10 1 . . . . . 3.15 1.8 4.5 1 1 11 1 . . . . . 2.65 1.8 3.5 1 1 12 1 . . . . . 3.65 1.8 5.5 1 1 13 1 . . . . . 3.15 1.8 4.5 1 1 14 1 . . . . . 3.65 1.8 5.5 1 1 15 2 . . . . . 3.15 1.8 4.5 1 1 15 3 . . . . . 3.15 1.8 4.5 1 1 16 1 . . . . . 3.15 1.8 4.5 1 1 17 1 . . . . . 2.65 1.8 3.5 1 1 18 1 . . . . . 3.65 1.8 5.5 1 1 19 1 . . . . . 2.65 1.8 3.5 1 1 20 1 . . . . . 3.65 1.8 5.5 1 1 21 1 . . . . . 3.15 1.8 4.5 1 1 22 1 . . . . . 3.65 1.8 4.5 1 1 23 2 . . . . . 2.3 1.8 2.8 1 1 23 3 . . . . . 2.3 1.8 2.8 1 1 24 2 . . . . . 3.15 1.8 4.5 1 1 24 3 . . . . . 3.15 1.8 4.5 1 1 25 2 . . . . . 3.65 1.8 5.5 1 1 25 3 . . . . . 3.65 1.8 5.5 1 1 26 1 . . . . . 2.65 1.8 3.5 1 1 27 1 . . . . . 2.65 1.8 3.5 1 1 28 1 . . . . . 3.65 1.8 5.5 1 1 29 2 . . . . . 2.65 1.8 3.5 1 1 29 3 . . . . . 2.65 1.8 3.5 1 1 30 2 . . . . . 3.65 1.8 5.5 1 1 30 3 . . . . . 3.65 1.8 5.5 1 1 31 1 . . . . . 2.65 1.8 3.5 1 1 32 2 . . . . . 3.15 1.8 4.5 1 1 32 3 . . . . . 3.15 1.8 4.5 1 1 33 2 . . . . . 3.15 1.8 4.5 1 1 33 3 . . . . . 3.15 1.8 4.5 1 1 34 2 . . . . . 3.65 1.8 5.5 1 1 34 3 . . . . . 3.65 1.8 5.5 1 1 35 1 . . . . . 3.65 1.8 4.5 1 1 36 1 . . . . . 2.3 1.8 2.8 1 1 37 1 . . . . . 3.15 1.8 4.5 1 1 38 2 . . . . . 2.3 1.8 2.8 1 1 38 3 . . . . . 2.3 1.8 2.8 1 1 39 2 . . . . . 2.65 1.8 3.5 1 1 39 3 . . . . . 2.65 1.8 3.5 1 1 40 2 . . . . . 3.65 1.8 5.5 1 1 40 3 . . . . . 3.65 1.8 5.5 1 1 41 2 . . . . . 2.3 1.8 2.8 1 1 41 3 . . . . . 2.3 1.8 2.8 1 1 42 1 . . . . . 3.15 1.8 4.5 1 1 43 2 . . . . . 3.15 1.8 4.5 1 1 43 3 . . . . . 3.15 1.8 4.5 1 1 44 1 . . . . . 3.65 1.8 5.5 1 1 45 1 . . . . . 3.15 1.8 3.5 1 1 46 1 . . . . . 3.15 1.8 4.5 1 1 47 2 . . . . . 2.65 1.8 3.5 1 1 47 3 . . . . . 2.65 1.8 3.5 1 1 48 1 . . . . . 3.15 1.8 4.5 1 1 49 2 . . . . . 3.65 1.8 5.5 1 1 49 3 . . . . . 3.65 1.8 5.5 1 1 50 1 . . . . . 2.65 1.8 3.5 1 1 51 2 . . . . . 2.65 1.8 3.5 1 1 51 3 . . . . . 2.65 1.8 3.5 1 1 51 4 . . . . . 2.65 1.8 3.5 1 1 52 1 . . . . . 3.15 1.8 4.5 1 1 53 2 . . . . . 3.15 1.8 4.5 1 1 53 3 . . . . . 3.15 1.8 4.5 1 1 54 2 . . . . . 3.15 1.8 4.5 1 1 54 3 . . . . . 3.15 1.8 4.5 1 1 55 1 . . . . . 3.15 1.8 4.5 1 1 56 1 . . . . . 3.65 1.8 5.5 1 1 57 1 . . . . . 4.15 1.8 6.5 1 1 58 1 . . . . . 3.65 1.8 5.5 1 1 59 2 . . . . . 3.65 1.8 5.5 1 1 59 3 . . . . . 3.65 1.8 5.5 1 1 60 1 . . . . . 4.15 1.8 6.5 1 1 61 2 . . . . . 3.65 1.8 5.5 1 1 61 3 . . . . . 3.65 1.8 5.5 1 1 62 1 . . . . . 4.15 1.8 6.5 1 1 63 1 . . . . . 3.65 1.8 5.5 1 1 64 1 . . . . . 3.65 1.8 5.5 1 1 65 2 . . . . . 3.65 1.8 5.5 1 1 65 3 . . . . . 3.65 1.8 5.5 1 1 66 1 . . . . . 3.65 1.8 5.5 1 1 67 1 . . . . . 3.15 1.8 4.5 1 1 68 2 . . . . . 3.65 1.8 5.5 1 1 68 3 . . . . . 3.65 1.8 5.5 1 1 69 1 . . . . . 3.65 1.8 5.5 1 1 70 1 . . . . . 3.15 1.8 4.5 1 1 71 1 . . . . . 4.15 1.8 6.5 1 1 72 1 . . . . . 3.65 1.8 5.5 1 1 73 1 . . . . . 3.65 1.8 5.5 1 1 74 1 . . . . . 3.15 1.8 4.5 1 1 75 1 . . . . . 2.65 1.8 3.5 1 1 76 1 . . . . . 3.15 1.8 4.5 1 1 77 1 . . . . . 3.15 1.8 4.5 1 1 78 1 . . . . . 2.65 1.8 3.5 1 1 79 1 . . . . . 2.3 1.8 2.8 1 1 80 2 . . . . . 2.65 1.8 3.5 1 1 80 3 . . . . . 2.65 1.8 3.5 1 1 81 1 . . . . . 2.65 1.8 3.5 1 1 82 2 . . . . . . 1.8 2.8 1 1 82 3 . . . . . . 1.8 2.8 1 1 83 1 . . . . . 2.65 1.8 3.5 1 1 84 1 . . . . . 2.65 1.8 3.5 1 1 85 1 . . . . . 2.65 1.8 3.5 1 1 86 1 . . . . . 2.65 1.8 3.5 1 1 87 1 . . . . . 2.65 1.8 3.5 1 1 88 1 . . . . . 3.65 1.8 5.5 1 1 89 1 . . . . . 3.65 1.8 4.5 1 1 90 1 . . . . . 3.65 1.8 5.5 1 1 91 1 . . . . . 2.65 1.8 3.5 1 1 92 1 . . . . . 2.3 1.8 2.8 1 1 93 2 . . . . . 2.3 1.8 2.8 1 1 93 3 . . . . . 2.3 1.8 2.8 1 1 94 1 . . . . . 2.65 1.8 3.5 1 1 95 2 . . . . . 2.65 1.8 2.8 1 1 95 3 . . . . . 2.65 1.8 2.8 1 1 96 1 . . . . . 2.3 1.8 2.8 1 1 97 1 . . . . . 3.15 1.8 4.5 1 1 98 1 . . . . . 3.15 1.8 4.5 1 1 99 1 . . . . . 3.15 1.8 3.5 1 1 100 1 . . . . . 2.65 1.8 3.5 1 1 101 1 . . . . . 2.65 1.8 3.5 1 1 102 1 . . . . . 3.15 1.8 4.5 1 1 103 1 . . . . . 3.15 1.8 4.5 1 1 104 1 . . . . . 3.65 1.8 5.5 1 1 105 2 . . . . . 3.65 1.8 5.5 1 1 105 3 . . . . . 3.65 1.8 5.5 1 1 106 1 . . . . . 3.15 1.8 3.5 1 1 107 1 . . . . . 3.15 1.8 4.5 1 1 108 2 . . . . . 3.65 1.8 5.5 1 1 108 3 . . . . . 3.65 1.8 5.5 1 1 109 1 . . . . . 3.15 1.8 4.5 1 1 110 1 . . . . . 3.65 1.8 4.5 1 1 111 1 . . . . . 3.65 1.8 5.5 1 1 112 1 . . . . . 3.65 1.8 4.5 1 1 113 1 . . . . . 3.15 1.8 4.5 1 1 114 1 . . . . . 3.65 1.8 5.5 1 1 115 1 . . . . . 2.65 1.8 3.5 1 1 116 1 . . . . . 3.65 1.8 5.5 1 1 117 1 . . . . . 3.65 1.8 5.5 1 1 118 2 . . . . . 3.15 1.8 4.5 1 1 118 3 . . . . . 3.15 1.8 4.5 1 1 119 1 . . . . . 2.65 1.8 3.5 1 1 120 1 . . . . . 3.65 1.8 5.5 1 1 121 1 . . . . . 3.65 1.8 5.5 1 1 122 1 . . . . . 3.65 1.8 5.5 1 1 123 1 . . . . . 3.15 1.8 3.5 1 1 124 1 . . . . . 3.65 1.8 5.5 1 1 125 1 . . . . . 3.65 1.8 5.5 1 1 126 1 . . . . . 2.65 1.8 3.5 1 1 127 1 . . . . . 3.65 1.8 5.5 1 1 128 1 . . . . . 3.15 1.8 4.5 1 1 129 1 . . . . . 3.65 1.8 5.5 1 1 130 1 . . . . . 3.65 1.8 5.5 1 1 131 1 . . . . . 3.65 1.8 5.5 1 1 132 1 . . . . . 3.65 1.8 5.5 1 1 133 1 . . . . . 3.65 1.8 5.5 1 1 134 1 . . . . . 3.15 1.8 4.5 1 1 135 1 . . . . . 3.15 1.8 4.5 1 1 136 1 . . . . . 3.65 1.8 5.5 1 1 137 1 . . . . . 3.65 1.8 5.5 1 1 138 1 . . . . . 3.15 1.8 4.5 1 1 139 1 . . . . . 3.15 1.8 4.5 1 1 140 1 . . . . . 3.65 1.8 5.5 1 1 141 1 . . . . . 2.65 1.8 3.5 1 1 142 1 . . . . . 2.65 1.8 3.5 1 1 143 1 . . . . . 3.65 1.8 5.5 1 1 144 2 . . . . . 3.65 1.8 5.5 1 1 144 3 . . . . . 3.65 1.8 5.5 1 1 145 1 . . . . . 3.65 1.8 5.5 1 1 146 1 . . . . . 3.15 1.8 4.5 1 1 147 1 . . . . . 2.3 1.8 2.8 1 1 148 1 . . . . . 3.15 1.8 4.5 1 1 149 1 . . . . . 3.65 1.8 5.5 1 1 150 1 . . . . . 3.15 1.8 4.5 1 1 151 1 . . . . . 2.65 1.8 3.5 1 1 152 1 . . . . . 2.3 1.8 2.8 1 1 153 1 . . . . . 3.65 1.8 5.5 1 1 154 1 . . . . . 3.65 1.8 5.5 1 1 155 1 . . . . . 3.65 1.8 5.5 1 1 156 1 . . . . . 2.3 1.8 2.8 1 1 157 1 . . . . . 3.15 1.8 4.5 1 1 158 1 . . . . . 3.15 1.8 4.5 1 1 159 1 . . . . . 3.15 1.8 4.5 1 1 160 1 . . . . . 3.65 1.8 4.5 1 1 161 1 . . . . . 3.65 1.8 5.5 1 1 162 1 . . . . . 2.65 1.8 3.5 1 1 163 2 . . . . . 3.65 1.8 5.5 1 1 163 3 . . . . . 3.65 1.8 5.5 1 1 164 1 . . . . . 3.15 1.8 3.5 1 1 165 1 . . . . . 2.3 1.8 2.8 1 1 166 1 . . . . . 3.15 1.8 4.5 1 1 167 1 . . . . . 3.15 1.8 4.5 1 1 168 1 . . . . . 3.65 1.8 5.5 1 1 169 1 . . . . . 2.3 1.8 2.8 1 1 170 2 . . . . . 3.15 1.8 4.5 1 1 170 3 . . . . . 3.15 1.8 4.5 1 1 171 1 . . . . . 3.65 1.8 5.5 1 1 172 2 . . . . . 2.3 1.8 2.8 1 1 172 3 . . . . . 2.3 1.8 2.8 1 1 173 2 . . . . . 2.3 1.8 2.8 1 1 173 3 . . . . . 2.3 1.8 2.8 1 1 173 4 . . . . . 2.3 1.8 2.8 1 1 174 1 . . . . . 2.65 1.8 3.5 1 1 175 1 . . . . . 3.65 1.8 5.5 1 1 176 2 . . . . . 3.15 1.8 4.5 1 1 176 3 . . . . . 3.15 1.8 4.5 1 1 177 2 . . . . . 3.15 1.8 4.5 1 1 177 3 . . . . . 3.15 1.8 4.5 1 1 178 1 . . . . . 2.65 1.8 2.8 1 1 179 1 . . . . . 3.15 1.8 4.5 1 1 180 1 . . . . . 2.65 1.8 3.5 1 1 181 1 . . . . . 3.15 1.8 4.5 1 1 182 1 . . . . . 2.65 1.8 3.5 1 1 183 1 . . . . . 2.3 1.8 2.8 1 1 184 1 . . . . . 3.15 1.8 4.5 1 1 185 1 . . . . . 3.15 1.8 4.5 1 1 186 1 . . . . . 4.15 1.8 6.5 1 1 187 1 . . . . . 3.15 1.8 4.5 1 1 188 1 . . . . . 3.15 1.8 4.5 1 1 189 1 . . . . . 3.15 1.8 4.5 1 1 190 1 . . . . . 2.65 1.8 3.5 1 1 191 2 . . . . . 2.3 1.8 2.8 1 1 191 3 . . . . . 2.3 1.8 2.8 1 1 192 1 . . . . . 3.65 1.8 5.5 1 1 193 1 . . . . . 3.65 1.8 5.5 1 1 194 1 . . . . . 4.15 1.8 6.5 1 1 195 1 . . . . . 3.65 1.8 5.5 1 1 196 1 . . . . . 3.15 1.8 4.5 1 1 197 1 . . . . . 2.65 1.8 3.5 1 1 198 1 . . . . . 3.65 1.8 5.5 1 1 199 1 . . . . . 2.65 1.8 3.5 1 1 200 1 . . . . . 3.65 1.8 5.5 1 1 201 1 . . . . . 3.65 1.8 5.5 1 1 202 1 . . . . . 3.15 1.8 4.5 1 1 203 1 . . . . . 3.65 1.8 5.5 1 1 204 1 . . . . . 2.65 1.8 3.5 1 1 205 1 . . . . . 2.65 1.8 3.5 1 1 206 1 . . . . . 3.65 1.8 5.5 1 1 207 1 . . . . . 3.65 1.8 5.5 1 1 208 1 . . . . . 3.65 1.8 5.5 1 1 209 1 . . . . . 3.15 1.8 4.5 1 1 210 1 . . . . . 3.15 1.8 4.5 1 1 211 1 . . . . . 3.65 1.8 4.5 1 1 212 1 . . . . . 2.65 1.8 3.5 1 1 213 1 . . . . . 3.15 1.8 4.5 1 1 214 1 . . . . . 3.15 1.8 4.5 1 1 215 1 . . . . . 3.65 1.8 5.5 1 1 216 1 . . . . . 3.65 1.8 5.5 1 1 217 1 . . . . . 2.65 1.8 3.5 1 1 218 1 . . . . . 3.15 1.8 4.5 1 1 219 1 . . . . . 3.15 1.8 4.5 1 1 220 1 . . . . . 3.15 1.8 4.5 1 1 221 1 . . . . . 2.65 1.8 3.5 1 1 222 1 . . . . . 3.65 1.8 5.5 1 1 223 1 . . . . . 3.65 1.8 5.5 1 1 224 2 . . . . . 3.15 1.8 4.5 1 1 224 3 . . . . . 3.15 1.8 4.5 1 1 225 1 . . . . . 3.15 1.8 4.5 1 1 226 1 . . . . . 2.65 1.8 3.5 1 1 227 2 . . . . . 2.3 1.8 2.8 1 1 227 3 . . . . . 2.3 1.8 2.8 1 1 228 1 . . . . . 3.15 1.8 4.5 1 1 229 1 . . . . . 3.15 1.8 4.5 1 1 230 1 . . . . . 3.15 1.8 4.5 1 1 231 1 . . . . . 3.65 1.8 5.5 1 1 232 2 . . . . . 2.65 1.8 3.5 1 1 232 3 . . . . . 2.65 1.8 3.5 1 1 233 2 . . . . . 3.15 1.8 4.5 1 1 233 3 . . . . . 3.15 1.8 4.5 1 1 233 4 . . . . . 3.15 1.8 4.5 1 1 234 2 . . . . . 2.3 1.8 2.8 1 1 234 3 . . . . . 2.3 1.8 2.8 1 1 235 2 . . . . . 2.65 1.8 3.5 1 1 235 3 . . . . . 2.65 1.8 3.5 1 1 236 1 . . . . . 2.3 1.8 2.8 1 1 237 2 . . . . . 3.65 1.8 5.5 1 1 237 3 . . . . . 3.65 1.8 5.5 1 1 237 4 . . . . . 3.65 1.8 5.5 1 1 238 2 . . . . . 3.65 1.8 5.5 1 1 238 3 . . . . . 3.65 1.8 5.5 1 1 239 1 . . . . . 3.15 1.8 4.5 1 1 240 2 . . . . . 3.15 1.8 4.5 1 1 240 3 . . . . . 3.15 1.8 4.5 1 1 241 2 . . . . . 3.65 1.8 5.5 1 1 241 3 . . . . . 3.65 1.8 5.5 1 1 242 2 . . . . . 3.65 1.8 5.5 1 1 242 3 . . . . . 3.65 1.8 5.5 1 1 243 1 . . . . . 3.15 1.8 4.5 1 1 244 1 . . . . . 3.65 1.8 5.5 1 1 245 1 . . . . . . 1.8 2.8 1 1 246 1 . . . . . . 1.8 2.8 1 1 247 1 . . . . . 3.15 1.8 4.5 1 1 248 2 . . . . . 3.65 1.8 5.5 1 1 248 3 . . . . . 3.65 1.8 5.5 1 1 249 1 . . . . . 3.15 1.8 4.5 1 1 250 1 . . . . . 3.15 1.8 3.5 1 1 251 1 . . . . . 3.65 1.8 4.5 1 1 252 2 . . . . . 3.65 1.8 5.5 1 1 252 3 . . . . . 3.65 1.8 5.5 1 1 253 1 . . . . . 3.15 1.8 4.5 1 1 254 1 . . . . . 3.65 1.8 4.5 1 1 255 1 . . . . . 3.15 1.8 4.5 1 1 256 1 . . . . . 3.65 1.8 5.5 1 1 257 1 . . . . . 3.65 1.8 5.5 1 1 258 2 . . . . . 3.15 1.8 4.5 1 1 258 3 . . . . . 3.15 1.8 4.5 1 1 259 1 . . . . . 2.65 1.8 3.5 1 1 260 2 . . . . . 3.15 1.8 4.5 1 1 260 3 . . . . . 3.15 1.8 4.5 1 1 261 1 . . . . . 3.65 1.8 5.5 1 1 262 1 . . . . . 2.65 1.8 3.5 1 1 263 1 . . . . . 2.65 1.8 3.5 1 1 264 1 . . . . . 3.65 1.8 5.5 1 1 265 1 . . . . . 3.65 1.8 5.5 1 1 266 1 . . . . . 3.15 1.8 4.5 1 1 267 1 . . . . . 3.65 1.8 5.5 1 1 268 1 . . . . . 3.15 1.8 4.5 1 1 269 1 . . . . . 2.65 1.8 2.8 1 1 270 1 . . . . . 3.65 1.8 5.5 1 1 271 1 . . . . . 2.3 1.8 2.8 1 1 272 1 . . . . . 3.15 1.8 4.5 1 1 273 1 . . . . . 3.65 1.8 4.5 1 1 274 1 . . . . . 2.65 1.8 3.5 1 1 275 1 . . . . . 3.15 1.8 4.5 1 1 276 1 . . . . . 2.65 1.8 3.5 1 1 277 2 . . . . . 2.65 1.8 3.5 1 1 277 3 . . . . . 2.65 1.8 3.5 1 1 278 1 . . . . . 2.65 1.8 3.5 1 1 279 1 . . . . . 3.15 1.8 4.5 1 1 280 1 . . . . . 2.65 1.8 3.5 1 1 281 1 . . . . . 2.3 1.8 2.8 1 1 282 1 . . . . . 2.65 1.8 3.5 1 1 283 1 . . . . . 3.15 1.8 4.5 1 1 284 1 . . . . . 2.65 1.8 3.5 1 1 285 2 . . . . . 3.15 1.8 3.5 1 1 285 3 . . . . . 3.15 1.8 3.5 1 1 286 2 . . . . . 3.15 1.8 4.5 1 1 286 3 . . . . . 3.15 1.8 4.5 1 1 287 2 . . . . . 3.65 1.8 5.5 1 1 287 3 . . . . . 3.65 1.8 5.5 1 1 288 1 . . . . . 2.3 1.8 2.8 1 1 289 1 . . . . . 2.3 1.8 2.8 1 1 290 1 . . . . . 3.65 1.8 5.5 1 1 291 2 . . . . . 3.15 1.8 4.5 1 1 291 3 . . . . . 3.15 1.8 4.5 1 1 292 1 . . . . . 3.65 1.8 5.5 1 1 293 1 . . . . . 3.15 1.8 4.5 1 1 294 1 . . . . . 2.65 1.8 3.5 1 1 295 1 . . . . . 3.15 1.8 4.5 1 1 296 1 . . . . . 3.15 1.8 4.5 1 1 297 2 . . . . . 2.65 1.8 3.5 1 1 297 3 . . . . . 2.65 1.8 3.5 1 1 298 1 . . . . . 2.65 1.8 3.5 1 1 299 1 . . . . . 3.15 1.8 4.5 1 1 300 1 . . . . . 3.65 1.8 5.5 1 1 301 1 . . . . . 2.3 1.8 2.8 1 1 302 1 . . . . . 3.65 1.8 5.5 1 1 303 1 . . . . . 3.65 1.8 5.5 1 1 304 1 . . . . . 3.15 1.8 3.5 1 1 305 1 . . . . . 3.15 1.8 3.5 1 1 306 1 . . . . . 2.65 1.8 2.8 1 1 307 1 . . . . . 2.3 1.8 2.8 1 1 308 1 . . . . . 2.3 1.8 2.8 1 1 309 1 . . . . . 2.65 1.8 3.5 1 1 310 1 . . . . . 3.15 1.8 4.5 1 1 311 1 . . . . . 2.3 1.8 2.8 1 1 312 2 . . . . . 2.3 1.8 2.8 1 1 312 3 . . . . . 2.3 1.8 2.8 1 1 313 1 . . . . . 2.65 1.8 3.5 1 1 314 1 . . . . . 2.3 1.8 2.8 1 1 315 1 . . . . . 3.15 1.8 4.5 1 1 316 1 . . . . . 2.65 1.8 3.5 1 1 317 1 . . . . . 3.15 1.8 4.5 1 1 318 1 . . . . . 2.3 1.8 2.8 1 1 319 1 . . . . . 2.3 1.8 2.8 1 1 320 2 . . . . . 3.15 1.8 4.5 1 1 320 3 . . . . . 3.15 1.8 4.5 1 1 321 1 . . . . . 3.65 1.8 5.5 1 1 322 1 . . . . . 3.15 1.8 4.5 1 1 323 1 . . . . . 3.15 1.8 4.5 1 1 324 1 . . . . . 3.15 1.8 4.5 1 1 325 1 . . . . . 3.65 1.8 5.5 1 1 326 1 . . . . . 3.15 1.8 4.5 1 1 327 2 . . . . . 3.15 1.8 4.5 1 1 327 3 . . . . . 3.15 1.8 4.5 1 1 328 1 . . . . . 3.15 1.8 4.5 1 1 329 1 . . . . . 3.65 1.8 5.5 1 1 330 2 . . . . . 2.65 1.8 3.5 1 1 330 3 . . . . . 2.65 1.8 3.5 1 1 331 2 . . . . . 2.65 1.8 3.5 1 1 331 3 . . . . . 2.65 1.8 3.5 1 1 331 4 . . . . . 2.65 1.8 3.5 1 1 332 1 . . . . . 3.15 1.8 4.5 1 1 333 2 . . . . . 3.15 1.8 3.5 1 1 333 3 . . . . . 3.15 1.8 3.5 1 1 334 1 . . . . . 3.15 1.8 4.5 1 1 335 1 . . . . . 3.15 1.8 4.5 1 1 336 1 . . . . . 2.65 1.8 3.5 1 1 337 1 . . . . . 2.65 1.8 3.5 1 1 338 1 . . . . . 2.65 1.8 3.5 1 1 339 1 . . . . . 2.65 1.8 3.5 1 1 340 2 . . . . . 3.15 1.8 4.5 1 1 340 3 . . . . . 3.15 1.8 4.5 1 1 341 2 . . . . . 3.65 1.8 5.5 1 1 341 3 . . . . . 3.65 1.8 5.5 1 1 342 2 . . . . . 3.65 1.8 5.5 1 1 342 3 . . . . . 3.65 1.8 5.5 1 1 342 4 . . . . . 3.65 1.8 5.5 1 1 343 2 . . . . . 3.65 1.8 4.5 1 1 343 3 . . . . . 3.65 1.8 4.5 1 1 344 2 . . . . . 3.15 1.8 4.5 1 1 344 3 . . . . . 3.15 1.8 4.5 1 1 345 2 . . . . . 2.65 1.8 3.5 1 1 345 3 . . . . . 2.65 1.8 3.5 1 1 346 1 . . . . . 3.15 1.8 4.5 1 1 347 1 . . . . . 2.65 1.8 3.5 1 1 348 1 . . . . . 3.65 1.8 5.5 1 1 349 1 . . . . . 2.65 1.8 3.5 1 1 350 1 . . . . . 2.3 1.8 2.8 1 1 351 2 . . . . . 2.3 1.8 2.8 1 1 351 3 . . . . . 2.3 1.8 2.8 1 1 352 1 . . . . . 2.65 1.8 3.5 1 1 353 2 . . . . . 2.3 1.8 2.8 1 1 353 3 . . . . . 2.3 1.8 2.8 1 1 354 2 . . . . . 2.65 1.8 3.5 1 1 354 3 . . . . . 2.65 1.8 3.5 1 1 355 2 . . . . . 2.65 1.8 3.5 1 1 355 3 . . . . . 2.65 1.8 3.5 1 1 356 2 . . . . . 2.65 1.8 3.5 1 1 356 3 . . . . . 2.65 1.8 3.5 1 1 357 2 . . . . . 2.3 1.8 2.8 1 1 357 3 . . . . . 2.3 1.8 2.8 1 1 358 1 . . . . . 2.3 1.8 2.8 1 1 359 1 . . . . . 2.65 1.8 3.5 1 1 360 2 . . . . . 2.3 1.8 2.8 1 1 360 3 . . . . . 2.3 1.8 2.8 1 1 361 1 . . . . . 3.65 1.8 5.5 1 1 362 1 . . . . . 2.3 1.8 2.8 1 1 363 2 . . . . . 2.65 1.8 3.5 1 1 363 3 . . . . . 2.65 1.8 3.5 1 1 364 1 . . . . . 3.65 1.8 5.5 1 1 365 1 . . . . . 3.65 1.8 5.5 1 1 366 1 . . . . . 3.65 1.8 5.5 1 1 367 1 . . . . . 3.15 1.8 4.5 1 1 368 1 . . . . . 3.65 1.8 5.5 1 1 369 1 . . . . . 3.65 1.8 5.5 1 1 370 1 . . . . . 3.15 1.8 4.5 1 1 371 1 . . . . . 3.65 1.8 5.5 1 1 372 1 . . . . . 2.65 1.8 3.5 1 1 373 1 . . . . . 3.15 1.8 4.5 1 1 374 2 . . . . . 2.65 1.8 3.5 1 1 374 3 . . . . . 2.65 1.8 3.5 1 1 375 1 . . . . . 3.15 1.8 4.5 1 1 376 1 . . . . . 3.15 1.8 4.5 1 1 377 1 . . . . . 3.65 1.8 5.5 1 1 378 1 . . . . . 2.65 1.8 3.5 1 1 379 2 . . . . . 2.65 1.8 2.8 1 1 379 3 . . . . . 2.65 1.8 2.8 1 1 380 2 . . . . . 2.3 1.8 2.8 1 1 380 3 . . . . . 2.3 1.8 2.8 1 1 381 1 . . . . . 2.65 1.8 3.5 1 1 382 2 . . . . . 3.15 1.8 4.5 1 1 382 3 . . . . . 3.15 1.8 4.5 1 1 383 2 . . . . . 3.15 1.8 4.5 1 1 383 3 . . . . . 3.15 1.8 4.5 1 1 384 1 . . . . . 3.15 1.8 4.5 1 1 385 1 . . . . . 2.3 1.8 2.8 1 1 386 1 . . . . . 3.65 1.8 5.5 1 1 387 2 . . . . . 3.15 1.8 4.5 1 1 387 3 . . . . . 3.15 1.8 4.5 1 1 388 1 . . . . . 3.15 1.8 4.5 1 1 389 1 . . . . . 2.3 1.8 2.8 1 1 390 1 . . . . . 3.65 1.8 5.5 1 1 391 2 . . . . . 2.65 1.8 3.5 1 1 391 3 . . . . . 2.65 1.8 3.5 1 1 392 1 . . . . . 3.15 1.8 4.5 1 1 393 1 . . . . . 3.15 1.8 4.5 1 1 394 1 . . . . . 2.3 1.8 2.8 1 1 395 1 . . . . . 3.65 1.8 5.5 1 1 396 1 . . . . . 3.65 1.8 5.5 1 1 397 1 . . . . . 3.15 1.8 4.5 1 1 398 1 . . . . . 3.65 1.8 5.5 1 1 399 1 . . . . . 2.3 1.8 2.8 1 1 400 1 . . . . . 3.15 1.8 4.5 1 1 401 1 . . . . . 3.65 1.8 5.5 1 1 402 1 . . . . . 2.3 1.8 2.8 1 1 403 1 . . . . . 2.3 1.8 2.8 1 1 404 1 . . . . . 2.3 1.8 2.8 1 1 405 1 . . . . . 2.65 1.8 3.5 1 1 406 1 . . . . . 3.15 1.8 4.5 1 1 407 2 . . . . . 2.3 1.8 2.8 1 1 407 3 . . . . . 2.3 1.8 2.8 1 1 408 1 . . . . . 2.65 1.8 2.8 1 1 409 1 . . . . . 3.65 1.8 5.5 1 1 410 1 . . . . . 3.65 1.8 5.5 1 1 411 1 . . . . . 2.3 1.8 2.8 1 1 412 1 . . . . . 2.65 1.8 3.5 1 1 413 1 . . . . . 3.15 1.8 4.5 1 1 414 1 . . . . . 3.65 1.8 5.5 1 1 415 1 . . . . . 3.65 1.8 5.5 1 1 416 1 . . . . . 2.3 1.8 2.8 1 1 417 1 . . . . . 2.65 1.8 3.5 1 1 418 1 . . . . . 3.65 1.8 5.5 1 1 419 1 . . . . . 2.65 1.8 3.5 1 1 420 1 . . . . . 2.65 1.8 3.5 1 1 421 1 . . . . . 2.3 1.8 2.8 1 1 422 1 . . . . . 2.3 1.8 2.8 1 1 423 1 . . . . . 2.65 1.8 3.5 1 1 424 1 . . . . . 2.65 1.8 2.8 1 1 425 1 . . . . . 3.15 1.8 4.5 1 1 426 1 . . . . . 2.65 1.8 3.5 1 1 427 1 . . . . . 2.65 1.8 3.5 1 1 428 1 . . . . . 2.3 1.8 2.8 1 1 429 1 . . . . . 3.15 1.8 4.5 1 1 430 1 . . . . . 3.65 1.8 5.5 1 1 431 1 . . . . . 2.65 1.8 3.5 1 1 432 1 . . . . . 3.65 1.8 5.5 1 1 433 1 . . . . . 3.65 1.8 5.5 1 1 434 1 . . . . . 2.65 1.8 3.5 1 1 435 1 . . . . . 3.65 1.8 5.5 1 1 436 1 . . . . . 3.65 1.8 5.5 1 1 437 1 . . . . . 2.65 1.8 3.5 1 1 438 1 . . . . . 3.15 1.8 4.5 1 1 439 1 . . . . . 3.65 1.8 5.5 1 1 440 1 . . . . . 2.65 1.8 3.5 1 1 441 1 . . . . . 2.3 1.8 2.8 1 1 442 1 . . . . . 3.15 1.8 4.5 1 1 443 1 . . . . . 3.65 1.8 5.5 1 1 444 1 . . . . . 3.65 1.8 5.5 1 1 445 1 . . . . . 2.3 1.8 2.8 1 1 446 1 . . . . . 2.3 1.8 2.8 1 1 447 1 . . . . . 3.15 1.8 4.5 1 1 448 1 . . . . . 2.65 1.8 3.5 1 1 449 1 . . . . . 2.3 1.8 2.8 1 1 450 1 . . . . . 3.65 1.8 5.5 1 1 451 1 . . . . . 2.3 1.8 2.8 1 1 452 1 . . . . . 2.3 1.8 2.8 1 1 453 1 . . . . . 3.15 1.8 4.5 1 1 454 1 . . . . . 3.15 1.8 4.5 1 1 455 1 . . . . . 2.65 1.8 3.5 1 1 456 1 . . . . . 2.65 1.8 3.5 1 1 457 1 . . . . . 2.65 1.8 3.5 1 1 458 1 . . . . . 3.15 1.8 4.5 1 1 459 1 . . . . . 3.15 1.8 4.5 1 1 460 1 . . . . . 2.65 1.8 3.5 1 1 461 1 . . . . . 3.15 1.8 4.5 1 1 462 1 . . . . . 3.15 1.8 4.5 1 1 463 1 . . . . . 2.65 1.8 3.5 1 1 464 1 . . . . . 2.65 1.8 3.5 1 1 465 1 . . . . . 2.65 1.8 3.5 1 1 466 2 . . . . . 3.15 1.8 4.5 1 1 466 3 . . . . . 3.15 1.8 4.5 1 1 467 1 . . . . . 4.15 1.8 6.5 1 1 468 1 . . . . . 2.3 1.8 2.8 1 1 469 1 . . . . . 2.65 1.8 3.5 1 1 470 1 . . . . . 3.15 1.8 4.5 1 1 471 1 . . . . . 3.15 1.8 4.5 1 1 472 1 . . . . . 2.65 1.8 3.5 1 1 473 1 . . . . . 3.15 1.8 4.5 1 1 474 1 . . . . . 3.15 1.8 4.5 1 1 475 1 . . . . . 3.15 1.8 4.5 1 1 476 1 . . . . . 3.65 1.8 4.5 1 1 477 1 . . . . . 2.65 1.8 3.5 1 1 478 1 . . . . . 3.15 1.8 4.5 1 1 479 1 . . . . . 3.15 1.8 4.5 1 1 480 1 . . . . . 3.65 1.8 5.5 1 1 481 1 . . . . . 3.65 1.8 5.5 1 1 482 1 . . . . . 3.15 1.8 4.5 1 1 483 1 . . . . . 3.65 1.8 5.5 1 1 484 1 . . . . . 3.65 1.8 5.5 1 1 485 1 . . . . . 2.65 1.8 3.5 1 1 486 1 . . . . . 3.65 1.8 5.5 1 1 487 1 . . . . . 4.15 1.8 6.5 1 1 488 1 . . . . . 2.65 1.8 2.8 1 1 489 1 . . . . . 2.65 1.8 3.5 1 1 490 1 . . . . . . 1.8 2.8 1 1 491 1 . . . . . 3.15 1.8 4.5 1 1 492 1 . . . . . 2.3 1.8 2.8 1 1 493 1 . . . . . 2.65 1.8 3.5 1 1 494 1 . . . . . 3.65 1.8 5.5 1 1 495 1 . . . . . 3.15 1.8 4.5 1 1 496 1 . . . . . 3.65 1.8 5.5 1 1 497 1 . . . . . 3.65 1.8 5.5 1 1 498 1 . . . . . 2.65 1.8 3.5 1 1 499 1 . . . . . 2.65 1.8 3.5 1 1 500 1 . . . . . 2.65 1.8 2.8 1 1 501 1 . . . . . 3.15 1.8 4.5 1 1 502 1 . . . . . 3.65 1.8 5.5 1 1 503 2 . . . . . 2.65 1.8 3.5 1 1 503 3 . . . . . 2.65 1.8 3.5 1 1 504 1 . . . . . 2.65 1.8 2.8 1 1 505 1 . . . . . 2.65 1.8 3.5 1 1 506 1 . . . . . 2.3 1.8 2.8 1 1 507 1 . . . . . 2.65 1.8 3.5 1 1 508 1 . . . . . 3.65 1.8 5.5 1 1 509 1 . . . . . 3.65 1.8 5.5 1 1 510 1 . . . . . 3.15 1.8 4.5 1 1 511 1 . . . . . 3.65 1.8 5.5 1 1 512 1 . . . . . 3.65 1.8 5.5 1 1 513 1 . . . . . 2.65 1.8 3.5 1 1 514 2 . . . . . 2.65 1.8 3.5 1 1 514 3 . . . . . 2.65 1.8 3.5 1 1 515 1 . . . . . 3.15 1.8 4.5 1 1 516 1 . . . . . 3.15 1.8 4.5 1 1 517 1 . . . . . 3.15 1.8 4.5 1 1 518 1 . . . . . 3.15 1.8 4.5 1 1 519 2 . . . . . 2.65 1.8 3.5 1 1 519 3 . . . . . 2.65 1.8 3.5 1 1 520 2 . . . . . 3.15 1.8 4.5 1 1 520 3 . . . . . 3.15 1.8 4.5 1 1 521 1 . . . . . 3.15 1.8 4.5 1 1 522 1 . . . . . 3.65 1.8 5.5 1 1 523 1 . . . . . 2.65 1.8 3.5 1 1 524 1 . . . . . 3.15 1.8 4.5 1 1 525 1 . . . . . 2.65 1.8 3.5 1 1 526 1 . . . . . 2.65 1.8 2.8 1 1 527 2 . . . . . 3.65 1.8 5.5 1 1 527 3 . . . . . 3.65 1.8 5.5 1 1 528 1 . . . . . 2.65 1.8 3.5 1 1 529 1 . . . . . 3.15 1.8 4.5 1 1 530 1 . . . . . 2.3 1.8 2.8 1 1 531 1 . . . . . 3.15 1.8 3.5 1 1 532 1 . . . . . 3.65 1.8 5.5 1 1 533 1 . . . . . 2.65 1.8 3.5 1 1 534 2 . . . . . 2.3 1.8 2.8 1 1 534 3 . . . . . 2.3 1.8 2.8 1 1 535 1 . . . . . 2.65 1.8 3.5 1 1 536 2 . . . . . 2.3 1.8 2.8 1 1 536 3 . . . . . 2.3 1.8 2.8 1 1 536 4 . . . . . 2.3 1.8 2.8 1 1 537 1 . . . . . 2.65 1.8 3.5 1 1 538 2 . . . . . 2.3 1.8 2.8 1 1 538 3 . . . . . 2.3 1.8 2.8 1 1 539 1 . . . . . 2.65 1.8 3.5 1 1 540 2 . . . . . 3.15 1.8 4.5 1 1 540 3 . . . . . 3.15 1.8 4.5 1 1 541 1 . . . . . 3.65 1.8 5.5 1 1 542 1 . . . . . 3.15 1.8 4.5 1 1 543 1 . . . . . 3.15 1.8 4.5 1 1 544 2 . . . . . 3.65 1.8 5.5 1 1 544 3 . . . . . 3.65 1.8 5.5 1 1 545 1 . . . . . 3.65 1.8 5.5 1 1 546 1 . . . . . 3.65 1.8 5.5 1 1 547 1 . . . . . 3.65 1.8 5.5 1 1 548 1 . . . . . 3.65 1.8 5.5 1 1 549 2 . . . . . 3.65 1.8 5.5 1 1 549 3 . . . . . 3.65 1.8 5.5 1 1 550 1 . . . . . 3.65 1.8 5.5 1 1 551 1 . . . . . 3.15 1.8 4.5 1 1 552 1 . . . . . 3.65 1.8 5.5 1 1 553 1 . . . . . 3.65 1.8 5.5 1 1 554 1 . . . . . 3.15 1.8 4.5 1 1 555 1 . . . . . 3.15 1.8 4.5 1 1 556 2 . . . . . 2.65 1.8 3.5 1 1 556 3 . . . . . 2.65 1.8 3.5 1 1 557 2 . . . . . 2.3 1.8 2.8 1 1 557 3 . . . . . 2.3 1.8 2.8 1 1 558 1 . . . . . 2.65 1.8 3.5 1 1 559 1 . . . . . 2.3 1.8 2.8 1 1 560 1 . . . . . 3.15 1.8 4.5 1 1 561 1 . . . . . 2.65 1.8 3.5 1 1 562 1 . . . . . 2.65 1.8 2.8 1 1 563 1 . . . . . 2.3 1.8 2.8 1 1 564 1 . . . . . 2.3 1.8 2.8 1 1 565 1 . . . . . 3.65 1.8 5.5 1 1 566 1 . . . . . . 1.8 2.8 1 1 567 1 . . . . . 2.3 1.8 2.8 1 1 568 1 . . . . . 3.15 1.8 4.5 1 1 569 1 . . . . . 2.3 1.8 2.8 1 1 570 1 . . . . . 2.65 1.8 3.5 1 1 571 1 . . . . . 3.65 1.8 5.5 1 1 572 1 . . . . . 2.65 1.8 3.5 1 1 573 1 . . . . . 3.15 1.8 4.5 1 1 574 1 . . . . . 3.65 1.8 4.5 1 1 575 1 . . . . . 3.65 1.8 5.5 1 1 576 2 . . . . . 3.65 1.8 5.5 1 1 576 3 . . . . . 3.65 1.8 5.5 1 1 577 1 . . . . . 3.15 1.8 4.5 1 1 578 1 . . . . . 3.15 1.8 4.5 1 1 579 1 . . . . . 3.65 1.8 5.5 1 1 580 2 . . . . . 2.65 1.8 3.5 1 1 580 3 . . . . . 2.65 1.8 3.5 1 1 581 1 . . . . . 2.65 1.8 3.5 1 1 582 2 . . . . . 2.65 1.8 3.5 1 1 582 3 . . . . . 2.65 1.8 3.5 1 1 583 1 . . . . . 3.15 1.8 4.5 1 1 584 1 . . . . . 3.65 1.8 5.5 1 1 585 1 . . . . . 3.65 1.8 5.5 1 1 586 1 . . . . . 3.65 1.8 5.5 1 1 587 1 . . . . . 2.65 1.8 3.5 1 1 588 1 . . . . . 2.65 1.8 3.5 1 1 589 1 . . . . . 2.3 1.8 2.8 1 1 590 1 . . . . . 3.65 1.8 5.5 1 1 591 1 . . . . . 2.65 1.8 3.5 1 1 592 1 . . . . . 3.65 1.8 5.5 1 1 593 1 . . . . . 2.65 1.8 3.5 1 1 594 1 . . . . . 2.65 1.8 3.5 1 1 595 1 . . . . . 3.15 1.8 4.5 1 1 596 1 . . . . . 3.15 1.8 4.5 1 1 597 1 . . . . . 3.65 1.8 5.5 1 1 598 1 . . . . . 4.15 1.8 6.5 1 1 599 1 . . . . . 3.15 1.8 4.5 1 1 600 1 . . . . . 2.65 1.8 3.5 1 1 601 1 . . . . . 3.65 1.8 5.5 1 1 602 1 . . . . . 2.65 1.8 3.5 1 1 603 1 . . . . . 3.65 1.8 5.5 1 1 604 1 . . . . . 4.15 1.8 6.5 1 1 605 1 . . . . . 4.15 1.8 6.5 1 1 606 1 . . . . . 3.65 1.8 5.5 1 1 607 1 . . . . . 2.65 1.8 3.5 1 1 608 1 . . . . . 2.65 1.8 3.5 1 1 609 1 . . . . . 3.65 1.8 5.5 1 1 610 1 . . . . . 3.15 1.8 4.5 1 1 611 1 . . . . . 3.15 1.8 4.5 1 1 612 1 . . . . . 3.65 1.8 5.5 1 1 613 1 . . . . . 3.65 1.8 5.5 1 1 614 1 . . . . . 3.15 1.8 4.5 1 1 615 1 . . . . . 3.65 1.8 5.5 1 1 616 1 . . . . . 2.65 1.8 3.5 1 1 617 1 . . . . . 3.15 1.8 4.5 1 1 618 1 . . . . . 3.15 1.8 4.5 1 1 619 1 . . . . . 3.65 1.8 5.5 1 1 620 1 . . . . . 3.65 1.8 5.5 1 1 621 1 . . . . . 2.3 1.8 2.8 1 1 622 1 . . . . . 3.65 1.8 5.5 1 1 623 1 . . . . . 2.65 1.8 3.5 1 1 624 1 . . . . . 2.65 1.8 2.8 1 1 625 1 . . . . . 3.65 1.8 5.5 1 1 626 1 . . . . . 3.65 1.8 5.5 1 1 627 1 . . . . . 2.3 1.8 2.8 1 1 628 1 . . . . . 3.15 1.8 3.5 1 1 629 1 . . . . . 3.65 1.8 5.5 1 1 630 1 . . . . . 2.3 1.8 2.8 1 1 631 1 . . . . . 2.3 1.8 2.8 1 1 632 1 . . . . . 3.65 1.8 4.5 1 1 633 1 . . . . . 3.15 1.8 4.5 1 1 634 1 . . . . . 3.15 1.8 4.5 1 1 635 1 . . . . . 3.65 1.8 5.5 1 1 636 1 . . . . . 3.65 1.8 5.5 1 1 637 1 . . . . . 4.15 1.8 6.5 1 1 638 1 . . . . . 3.65 1.8 5.5 1 1 639 1 . . . . . 3.65 1.8 5.5 1 1 640 1 . . . . . 3.15 1.8 4.5 1 1 641 1 . . . . . 3.15 1.8 4.5 1 1 642 1 . . . . . 2.3 1.8 2.8 1 1 643 1 . . . . . 3.15 1.8 4.5 1 1 644 1 . . . . . 3.15 1.8 4.5 1 1 645 1 . . . . . 3.65 1.8 5.5 1 1 646 1 . . . . . 2.3 1.8 2.8 1 1 647 1 . . . . . 3.65 1.8 5.5 1 1 648 1 . . . . . 3.65 1.8 5.5 1 1 649 1 . . . . . 2.65 1.8 3.5 1 1 650 1 . . . . . 2.65 1.8 3.5 1 1 651 1 . . . . . 3.15 1.8 4.5 1 1 652 1 . . . . . 3.15 1.8 4.5 1 1 653 1 . . . . . 3.65 1.8 5.5 1 1 654 1 . . . . . 2.65 1.8 3.5 1 1 655 1 . . . . . 2.65 1.8 3.5 1 1 656 1 . . . . . 3.65 1.8 5.5 1 1 657 1 . . . . . 4.15 1.8 6.5 1 1 658 1 . . . . . 3.65 1.8 5.5 1 1 659 1 . . . . . 3.65 1.8 5.5 1 1 660 1 . . . . . 2.65 1.8 3.5 1 1 661 1 . . . . . 3.15 1.8 4.5 1 1 662 1 . . . . . 2.65 1.8 3.5 1 1 663 1 . . . . . 2.3 1.8 2.8 1 1 664 1 . . . . . 2.65 1.8 3.5 1 1 665 1 . . . . . 2.65 1.8 3.5 1 1 666 1 . . . . . 2.65 1.8 3.5 1 1 667 1 . . . . . 3.65 1.8 5.5 1 1 668 1 . . . . . 3.15 1.8 4.5 1 1 669 1 . . . . . 2.3 1.8 2.8 1 1 670 1 . . . . . 3.15 1.8 4.5 1 1 671 1 . . . . . 2.65 1.8 3.5 1 1 672 1 . . . . . 2.65 1.8 3.5 1 1 673 1 . . . . . 3.65 1.8 5.5 1 1 674 1 . . . . . 3.65 1.8 5.5 1 1 675 1 . . . . . 2.65 1.8 3.5 1 1 676 1 . . . . . 3.15 1.8 4.5 1 1 677 1 . . . . . 3.65 1.8 5.5 1 1 678 1 . . . . . 3.15 1.8 4.5 1 1 679 1 . . . . . 2.65 1.8 3.5 1 1 680 1 . . . . . 2.3 1.8 2.8 1 1 681 1 . . . . . 3.65 1.8 5.5 1 1 682 1 . . . . . 2.3 1.8 2.8 1 1 683 1 . . . . . 2.3 1.8 2.8 1 1 684 1 . . . . . 2.3 1.8 2.8 1 1 685 1 . . . . . 3.65 1.8 5.5 1 1 686 1 . . . . . 3.15 1.8 4.5 1 1 687 1 . . . . . 3.65 1.8 5.5 1 1 688 1 . . . . . 2.65 1.8 3.5 1 1 689 1 . . . . . 2.65 1.8 3.5 1 1 690 1 . . . . . 3.65 1.8 5.5 1 1 691 1 . . . . . 2.65 1.8 3.5 1 1 692 1 . . . . . 3.15 1.8 4.5 1 1 693 1 . . . . . 3.65 1.8 5.5 1 1 694 1 . . . . . 2.65 1.8 3.5 1 1 695 1 . . . . . 2.3 1.8 2.8 1 1 696 2 . . . . . 3.15 1.8 4.5 1 1 696 3 . . . . . 3.15 1.8 4.5 1 1 697 1 . . . . . 2.65 1.8 3.5 1 1 698 1 . . . . . 2.65 1.8 3.5 1 1 699 1 . . . . . 3.15 1.8 4.5 1 1 700 1 . . . . . 2.3 1.8 2.8 1 1 701 1 . . . . . 2.3 1.8 2.8 1 1 702 1 . . . . . 3.15 1.8 4.5 1 1 703 1 . . . . . 3.15 1.8 4.5 1 1 704 1 . . . . . 3.15 1.8 4.5 1 1 705 1 . . . . . 2.65 1.8 3.5 1 1 706 1 . . . . . 3.65 1.8 5.5 1 1 707 1 . . . . . 2.65 1.8 3.5 1 1 708 1 . . . . . 2.65 1.8 3.5 1 1 709 1 . . . . . 3.15 1.8 4.5 1 1 710 1 . . . . . 2.65 1.8 3.5 1 1 711 1 . . . . . 2.65 1.8 3.5 1 1 712 1 . . . . . 2.65 1.8 3.5 1 1 713 1 . . . . . 2.65 1.8 3.5 1 1 714 1 . . . . . 3.65 1.8 5.5 1 1 715 1 . . . . . 2.65 1.8 3.5 1 1 716 1 . . . . . 2.65 1.8 3.5 1 1 717 1 . . . . . 2.3 1.8 2.8 1 1 718 1 . . . . . 3.15 1.8 4.5 1 1 719 1 . . . . . 3.15 1.8 4.5 1 1 720 1 . . . . . 3.15 1.8 4.5 1 1 721 1 . . . . . 4.15 1.8 6.5 1 1 722 1 . . . . . 2.65 1.8 3.5 1 1 723 1 . . . . . 2.3 1.8 2.8 1 1 724 1 . . . . . 2.65 1.8 3.5 1 1 725 1 . . . . . 2.3 1.8 2.8 1 1 726 1 . . . . . 3.15 1.8 4.5 1 1 727 1 . . . . . 2.3 1.8 2.8 1 1 728 1 . . . . . 3.15 1.8 4.5 1 1 729 1 . . . . . 2.3 1.8 2.8 1 1 730 1 . . . . . 2.3 1.8 2.8 1 1 731 1 . . . . . 2.3 1.8 2.8 1 1 732 1 . . . . . 2.3 1.8 2.8 1 1 733 1 . . . . . 2.65 1.8 3.5 1 1 734 1 . . . . . 2.65 1.8 3.5 1 1 stop_ save_ save_CNS/XPLOR_dihedral_3 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 . 1 1 1 THR C 1 1 2 GLN N 1 1 2 GLN CA 1 1 2 GLN C -144.2 -66.99999 . 1 . C . 2 . N . 2 . CA . 2 . C 1 1 2 . 1 1 2 GLN N 1 1 2 GLN CA 1 1 2 GLN C 1 1 3 SER N 108.59999 170.59999 . 2 . N . 2 . CA . 2 . C . 3 . N 1 1 3 . 1 1 2 GLN C 1 1 3 SER N 1 1 3 SER CA 1 1 3 SER C -93.799995 -53.8 . 2 . C . 3 . N . 3 . CA . 3 . C 1 1 4 . 1 1 3 SER N 1 1 3 SER CA 1 1 3 SER C 1 1 4 HIS N 113.0 176.19998 . 3 . N . 3 . CA . 3 . C . 4 . N 1 1 5 . 1 1 4 HIS C 1 1 5 TYR N 1 1 5 TYR CA 1 1 5 TYR C 40.5 80.5 . 4 . C . 5 . N . 5 . CA . 5 . C 1 1 6 . 1 1 5 TYR N 1 1 5 TYR CA 1 1 5 TYR C 1 1 6 GLY N 7.8 58.4 . 5 . N . 5 . CA . 5 . C . 6 . N 1 1 7 . 1 1 9 GLY C 1 1 10 GLY N 1 1 10 GLY CA 1 1 10 GLY C -109.899994 -55.3 . 9 . C . 10 . N . 10 . CA . 10 . C 1 1 8 . 1 1 10 GLY N 1 1 10 GLY CA 1 1 10 GLY C 1 1 11 ILE N 132.0 207.0 . 10 . N . 10 . CA . 10 . C . 11 . N 1 1 9 . 1 1 10 GLY C 1 1 11 ILE N 1 1 11 ILE CA 1 1 11 ILE C -78.7 -38.699997 . 10 . C . 11 . N . 11 . CA . 11 . C 1 1 10 . 1 1 11 ILE N 1 1 11 ILE CA 1 1 11 ILE C 1 1 12 GLY N 113.6 153.6 . 11 . N . 11 . CA . 11 . C . 12 . N 1 1 11 . 1 1 11 ILE C 1 1 12 GLY N 1 1 12 GLY CA 1 1 12 GLY C 68.7 110.9 . 11 . C . 12 . N . 12 . CA . 12 . C 1 1 12 . 1 1 12 GLY N 1 1 12 GLY CA 1 1 12 GLY C 1 1 13 TYR N -26.2 22.0 . 12 . N . 12 . CA . 12 . C . 13 . N 1 1 13 . 1 1 12 GLY C 1 1 13 TYR N 1 1 13 TYR CA 1 1 13 TYR C -127.00001 -43.0 . 12 . C . 13 . N . 13 . CA . 13 . C 1 1 14 . 1 1 13 TYR N 1 1 13 TYR CA 1 1 13 TYR C 1 1 14 SER N 115.6 161.8 . 13 . N . 13 . CA . 13 . C . 14 . N 1 1 15 . 1 1 16 PRO C 1 1 17 THR N 1 1 17 THR CA 1 1 17 THR C -138.1 -60.5 . 16 . C . 17 . N . 17 . CA . 17 . C 1 1 16 . 1 1 17 THR N 1 1 17 THR CA 1 1 17 THR C 1 1 18 VAL N -31.5 32.3 . 17 . N . 17 . CA . 17 . C . 18 . N 1 1 17 . 1 1 17 THR C 1 1 18 VAL N 1 1 18 VAL CA 1 1 18 VAL C -109.7 -56.1 . 17 . C . 18 . N . 18 . CA . 18 . C 1 1 18 . 1 1 18 VAL N 1 1 18 VAL CA 1 1 18 VAL C 1 1 19 CYS N 110.2 150.2 . 18 . N . 18 . CA . 18 . C . 19 . N 1 1 19 . 1 1 18 VAL C 1 1 19 CYS N 1 1 19 CYS CA 1 1 19 CYS C -89.8 -49.8 . 18 . C . 19 . N . 19 . CA . 19 . C 1 1 20 . 1 1 19 CYS N 1 1 19 CYS CA 1 1 19 CYS C 1 1 20 ALA N 112.6 167.2 . 19 . N . 19 . CA . 19 . C . 20 . N 1 1 21 . 1 1 20 ALA C 1 1 21 SER N 1 1 21 SER CA 1 1 21 SER C -77.5 -37.5 . 20 . C . 21 . N . 21 . CA . 21 . C 1 1 22 . 1 1 21 SER N 1 1 21 SER CA 1 1 21 SER C 1 1 22 GLY N 112.6 152.6 . 21 . N . 21 . CA . 21 . C . 22 . N 1 1 23 . 1 1 21 SER C 1 1 22 GLY N 1 1 22 GLY CA 1 1 22 GLY C 70.1 110.1 . 21 . C . 22 . N . 22 . CA . 22 . C 1 1 24 . 1 1 22 GLY N 1 1 22 GLY CA 1 1 22 GLY C 1 1 23 THR N -19.899998 20.1 . 22 . N . 22 . CA . 22 . C . 23 . N 1 1 25 . 1 1 22 GLY C 1 1 23 THR N 1 1 23 THR CA 1 1 23 THR C -150.3 -110.3 . 22 . C . 23 . N . 23 . CA . 23 . C 1 1 26 . 1 1 23 THR N 1 1 23 THR CA 1 1 23 THR C 1 1 24 THR N 136.9 176.9 . 23 . N . 23 . CA . 23 . C . 24 . N 1 1 27 . 1 1 23 THR C 1 1 24 THR N 1 1 24 THR CA 1 1 24 THR C -157.4 -100.4 . 23 . C . 24 . N . 24 . CA . 24 . C 1 1 28 . 1 1 24 THR N 1 1 24 THR CA 1 1 24 THR C 1 1 25 CYS N 127.9 168.1 . 24 . N . 24 . CA . 24 . C . 25 . N 1 1 29 . 1 1 24 THR C 1 1 25 CYS N 1 1 25 CYS CA 1 1 25 CYS C -91.1 -51.1 . 24 . C . 25 . N . 25 . CA . 25 . C 1 1 30 . 1 1 25 CYS N 1 1 25 CYS CA 1 1 25 CYS C 1 1 26 GLN N 98.19999 164.4 . 25 . N . 25 . CA . 25 . C . 26 . N 1 1 31 . 1 1 25 CYS C 1 1 26 GLN N 1 1 26 GLN CA 1 1 26 GLN C -130.3 -51.1 . 25 . C . 26 . N . 26 . CA . 26 . C 1 1 32 . 1 1 26 GLN N 1 1 26 GLN CA 1 1 26 GLN C 1 1 27 VAL N 110.2 162.8 . 26 . N . 26 . CA . 26 . C . 27 . N 1 1 33 . 1 1 26 GLN C 1 1 27 VAL N 1 1 27 VAL CA 1 1 27 VAL C -105.0 -49.2 . 26 . C . 27 . N . 27 . CA . 27 . C 1 1 34 . 1 1 27 VAL N 1 1 27 VAL CA 1 1 27 VAL C 1 1 28 LEU N 94.3 167.1 . 27 . N . 27 . CA . 27 . C . 28 . N 1 1 35 . 1 1 29 ASN C 1 1 30 PRO N 1 1 30 PRO CA 1 1 30 PRO C -80.9 -40.9 . 29 . C . 30 . N . 30 . CA . 30 . C 1 1 36 . 1 1 30 PRO N 1 1 30 PRO CA 1 1 30 PRO C 1 1 31 TYR N -43.2 -3.2 . 30 . N . 30 . CA . 30 . C . 31 . N 1 1 37 . 1 1 30 PRO C 1 1 31 TYR N 1 1 31 TYR CA 1 1 31 TYR C -116.7 -76.7 . 30 . C . 31 . N . 31 . CA . 31 . C 1 1 38 . 1 1 31 TYR N 1 1 31 TYR CA 1 1 31 TYR C 1 1 32 TYR N -23.4 16.6 . 31 . N . 31 . CA . 31 . C . 32 . N 1 1 39 . 1 1 31 TYR C 1 1 32 TYR N 1 1 32 TYR CA 1 1 32 TYR C -90.7 -48.1 . 31 . C . 32 . N . 32 . CA . 32 . C 1 1 40 . 1 1 32 TYR N 1 1 32 TYR CA 1 1 32 TYR C 1 1 33 SER N 116.0 156.0 . 32 . N . 32 . CA . 32 . C . 33 . N 1 1 41 . 1 1 32 TYR C 1 1 33 SER N 1 1 33 SER CA 1 1 33 SER C -143.9 -88.3 . 32 . C . 33 . N . 33 . CA . 33 . C 1 1 42 . 1 1 33 SER N 1 1 33 SER CA 1 1 33 SER C 1 1 34 GLN N 112.0 157.0 . 33 . N . 33 . CA . 33 . C . 34 . N 1 1 43 . 1 1 33 SER C 1 1 34 GLN N 1 1 34 GLN CA 1 1 34 GLN C -153.5 -113.5 . 33 . C . 34 . N . 34 . CA . 34 . C 1 1 44 . 1 1 34 GLN N 1 1 34 GLN CA 1 1 34 GLN C 1 1 35 CYS N 117.8 167.2 . 34 . N . 34 . CA . 34 . C . 35 . N 1 1 45 . 1 1 34 GLN C 1 1 35 CYS N 1 1 35 CYS CA 1 1 35 CYS C -105.4 -60.999996 . 34 . C . 35 . N . 35 . CA . 35 . C 1 1 46 . 1 1 35 CYS N 1 1 35 CYS CA 1 1 35 CYS C 1 1 36 LEU N 104.3 155.9 . 35 . N . 35 . CA . 35 . C . 36 . N 1 1 47 . 1 1 4 HIS N 1 1 4 HIS CA 1 1 4 HIS CB 1 1 4 HIS CG 150.0 210.0 . 4 . N . 4 . CA . 4 . CB . 4 . CG 1 1 48 . 1 1 7 GLN N 1 1 7 GLN CA 1 1 7 GLN CB 1 1 7 GLN CG 150.0 210.0 . 7 . N . 7 . CA . 7 . CB . 7 . CG 1 1 49 . 1 1 8 CYS N 1 1 8 CYS CA 1 1 8 CYS CB 1 1 8 CYS SG 30.0 89.99999 . 8 . N . 8 . CA . 8 . CB . 8 . SG 1 1 50 . 1 1 11 ILE N 1 1 11 ILE CA 1 1 11 ILE CB 1 1 11 ILE CG1 -89.99999 -30.0 . 11 . N . 11 . CA . 11 . CB . 11 . CG1 1 1 51 . 1 1 11 ILE CA 1 1 11 ILE CB 1 1 11 ILE CG1 1 1 11 ILE CD1 150.0 210.0 . 11 . CA . 11 . CB . 11 . CG1 . 11 . CD1 1 1 52 . 1 1 13 TYR N 1 1 13 TYR CA 1 1 13 TYR CB 1 1 13 TYR CG 150.0 210.0 . 13 . N . 13 . CA . 13 . CB . 13 . CG 1 1 53 . 1 1 17 THR N 1 1 17 THR CA 1 1 17 THR CB 1 1 17 THR OG1 30.0 89.99999 . 17 . N . 17 . CA . 17 . CB . 17 . OG1 1 1 54 . 1 1 18 VAL N 1 1 18 VAL CA 1 1 18 VAL CB 1 1 18 VAL CG1 150.0 210.0 . 18 . N . 18 . CA . 18 . CB . 18 . CG1 1 1 55 . 1 1 19 CYS N 1 1 19 CYS CA 1 1 19 CYS CB 1 1 19 CYS SG -89.99999 -30.0 . 19 . N . 19 . CA . 19 . CB . 19 . SG 1 1 56 . 1 1 23 THR N 1 1 23 THR CA 1 1 23 THR CB 1 1 23 THR OG1 30.0 89.99999 . 23 . N . 23 . CA . 23 . CB . 23 . OG1 1 1 57 . 1 1 24 THR N 1 1 24 THR CA 1 1 24 THR CB 1 1 24 THR OG1 30.0 89.99999 . 24 . N . 24 . CA . 24 . CB . 24 . OG1 1 1 58 . 1 1 25 CYS N 1 1 25 CYS CA 1 1 25 CYS CB 1 1 25 CYS SG 150.0 210.0 . 25 . N . 25 . CA . 25 . CB . 25 . SG 1 1 59 . 1 1 26 GLN N 1 1 26 GLN CA 1 1 26 GLN CB 1 1 26 GLN CG -89.99999 -30.0 . 26 . N . 26 . CA . 26 . CB . 26 . CG 1 1 60 . 1 1 27 VAL N 1 1 27 VAL CA 1 1 27 VAL CB 1 1 27 VAL CG1 150.0 210.0 . 27 . N . 27 . CA . 27 . CB . 27 . CG1 1 1 61 . 1 1 31 TYR N 1 1 31 TYR CA 1 1 31 TYR CB 1 1 31 TYR CG -89.99999 -30.0 . 31 . N . 31 . CA . 31 . CB . 31 . CG 1 1 62 . 1 1 32 TYR N 1 1 32 TYR CA 1 1 32 TYR CB 1 1 32 TYR CG 150.0 210.0 . 32 . N . 32 . CA . 32 . CB . 32 . CG 1 1 63 . 1 1 33 SER N 1 1 33 SER CA 1 1 33 SER CB 1 1 33 SER OG -89.99999 -30.0 . 33 . N . 33 . CA . 33 . CB . 33 . OG 1 1 64 . 1 1 35 CYS N 1 1 35 CYS CA 1 1 35 CYS CB 1 1 35 CYS SG -89.99999 -30.0 . 35 . N . 35 . CA . 35 . CB . 35 . SG 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 THR C C -5.281 -5.564 4.359 1.00 . A A . 1 THR C 1 1 1 2 1 1 1 THR CA C -5.311 -7.070 4.188 1.00 . A A . 1 THR CA 1 1 1 3 1 1 1 THR CB C -6.295 -7.457 3.067 1.00 . A A . 1 THR CB 1 1 1 4 1 1 1 THR CG2 C -6.076 -8.891 2.615 1.00 . A A . 1 THR CG2 1 1 1 5 1 1 1 THR H1 H -6.699 -7.359 5.634 1.00 . A A . 1 THR H1 1 1 1 6 1 1 1 THR H2 H -5.156 -7.292 6.219 1.00 . A A . 1 THR H2 1 1 1 7 1 1 1 THR H3 H -5.690 -8.708 5.441 1.00 . A A . 1 THR H3 1 1 1 8 1 1 1 THR HA H -4.321 -7.424 3.936 1.00 . A A . 1 THR HA 1 1 1 9 1 1 1 THR HB H -6.141 -6.789 2.232 1.00 . A A . 1 THR HB 1 1 1 10 1 1 1 THR HG1 H -8.191 -8.030 3.230 1.00 . A A . 1 THR HG1 1 1 1 11 1 1 1 THR HG21 H -5.062 -9.010 2.258 1.00 . A A . 1 THR HG21 1 1 1 12 1 1 1 THR HG22 H -6.767 -9.124 1.820 1.00 . A A . 1 THR HG22 1 1 1 13 1 1 1 THR HG23 H -6.247 -9.557 3.447 1.00 . A A . 1 THR HG23 1 1 1 14 1 1 1 THR N N -5.727 -7.672 5.439 1.00 . A A . 1 THR N 1 1 1 15 1 1 1 THR O O -6.007 -5.026 5.196 1.00 . A A . 1 THR O 1 1 1 16 1 1 1 THR OG1 O -7.641 -7.303 3.547 1.00 . A A . 1 THR OG1 1 1 1 17 1 1 2 GLN C C -5.471 -2.751 3.018 1.00 . A A . 2 GLN C 1 1 1 18 1 1 2 GLN CA C -4.324 -3.465 3.744 1.00 . A A . 2 GLN CA 1 1 1 19 1 1 2 GLN CB C -2.940 -3.001 3.275 1.00 . A A . 2 GLN CB 1 1 1 20 1 1 2 GLN CD C -2.880 -0.785 4.554 1.00 . A A . 2 GLN CD 1 1 1 21 1 1 2 GLN CG C -2.212 -2.125 4.303 1.00 . A A . 2 GLN CG 1 1 1 22 1 1 2 GLN H H -3.911 -5.351 2.923 1.00 . A A . 2 GLN H 1 1 1 23 1 1 2 GLN HA H -4.427 -3.251 4.797 1.00 . A A . 2 GLN HA 1 1 1 24 1 1 2 GLN HB2 H -2.336 -3.875 3.081 1.00 . A A . 2 GLN HB2 1 1 1 25 1 1 2 GLN HB3 H -3.042 -2.444 2.356 1.00 . A A . 2 GLN HB3 1 1 1 26 1 1 2 GLN HE21 H -3.456 -0.678 2.676 1.00 . A A . 2 GLN HE21 1 1 1 27 1 1 2 GLN HE22 H -3.946 0.616 3.690 1.00 . A A . 2 GLN HE22 1 1 1 28 1 1 2 GLN HG2 H -2.185 -2.661 5.240 1.00 . A A . 2 GLN HG2 1 1 1 29 1 1 2 GLN HG3 H -1.199 -1.952 3.979 1.00 . A A . 2 GLN HG3 1 1 1 30 1 1 2 GLN N N -4.451 -4.887 3.604 1.00 . A A . 2 GLN N 1 1 1 31 1 1 2 GLN NE2 N -3.472 -0.227 3.548 1.00 . A A . 2 GLN NE2 1 1 1 32 1 1 2 GLN O O -5.832 -3.103 1.886 1.00 . A A . 2 GLN O 1 1 1 33 1 1 2 GLN OE1 O -2.819 -0.238 5.651 1.00 . A A . 2 GLN OE1 1 1 1 34 1 1 3 SER C C -6.891 0.001 2.150 1.00 . A A . 3 SER C 1 1 1 35 1 1 3 SER CA C -7.182 -1.040 3.255 1.00 . A A . 3 SER CA 1 1 1 36 1 1 3 SER CB C -7.784 -0.388 4.488 1.00 . A A . 3 SER CB 1 1 1 37 1 1 3 SER H H -5.650 -1.491 4.550 1.00 . A A . 3 SER H 1 1 1 38 1 1 3 SER HA H -7.906 -1.749 2.885 1.00 . A A . 3 SER HA 1 1 1 39 1 1 3 SER HB2 H -8.437 0.417 4.183 1.00 . A A . 3 SER HB2 1 1 1 40 1 1 3 SER HB3 H -8.347 -1.114 5.055 1.00 . A A . 3 SER HB3 1 1 1 41 1 1 3 SER HG H -6.694 1.094 5.173 1.00 . A A . 3 SER HG 1 1 1 42 1 1 3 SER N N -6.026 -1.776 3.689 1.00 . A A . 3 SER N 1 1 1 43 1 1 3 SER O O -5.735 0.395 1.898 1.00 . A A . 3 SER O 1 1 1 44 1 1 3 SER OG O -6.743 0.140 5.310 1.00 . A A . 3 SER OG 1 1 1 45 1 1 4 HIS C C -7.426 2.764 0.967 1.00 . A A . 4 HIS C 1 1 1 46 1 1 4 HIS CA C -7.925 1.411 0.427 1.00 . A A . 4 HIS CA 1 1 1 47 1 1 4 HIS CB C -9.347 1.542 -0.154 1.00 . A A . 4 HIS CB 1 1 1 48 1 1 4 HIS CD2 C -8.564 2.319 -2.503 1.00 . A A . 4 HIS CD2 1 1 1 49 1 1 4 HIS CE1 C -10.439 3.167 -3.206 1.00 . A A . 4 HIS CE1 1 1 1 50 1 1 4 HIS CG C -9.451 2.211 -1.499 1.00 . A A . 4 HIS CG 1 1 1 51 1 1 4 HIS H H -8.832 0.079 1.785 1.00 . A A . 4 HIS H 1 1 1 52 1 1 4 HIS HA H -7.257 1.055 -0.344 1.00 . A A . 4 HIS HA 1 1 1 53 1 1 4 HIS HB2 H -9.773 0.555 -0.255 1.00 . A A . 4 HIS HB2 1 1 1 54 1 1 4 HIS HB3 H -9.949 2.106 0.545 1.00 . A A . 4 HIS HB3 1 1 1 55 1 1 4 HIS HD1 H -11.464 2.826 -1.476 1.00 . A A . 4 HIS HD1 1 1 1 56 1 1 4 HIS HD2 H -7.534 1.992 -2.478 1.00 . A A . 4 HIS HD2 1 1 1 57 1 1 4 HIS HE1 H -11.186 3.633 -3.832 1.00 . A A . 4 HIS HE1 1 1 1 58 1 1 4 HIS HE2 H -8.956 2.698 -4.487 1.00 . A A . 4 HIS HE2 1 1 1 59 1 1 4 HIS N N -7.960 0.440 1.508 1.00 . A A . 4 HIS N 1 1 1 60 1 1 4 HIS ND1 N -10.615 2.758 -1.971 1.00 . A A . 4 HIS ND1 1 1 1 61 1 1 4 HIS NE2 N -9.199 2.912 -3.554 1.00 . A A . 4 HIS NE2 1 1 1 62 1 1 4 HIS O O -7.918 3.246 1.997 1.00 . A A . 4 HIS O 1 1 1 63 1 1 5 TYR C C -4.859 4.522 1.845 1.00 . A A . 5 TYR C 1 1 1 64 1 1 5 TYR CA C -5.793 4.620 0.644 1.00 . A A . 5 TYR CA 1 1 1 65 1 1 5 TYR CB C -6.795 5.791 0.763 1.00 . A A . 5 TYR CB 1 1 1 66 1 1 5 TYR CD1 C -8.421 5.787 -1.177 1.00 . A A . 5 TYR CD1 1 1 1 67 1 1 5 TYR CD2 C -6.563 7.269 -1.263 1.00 . A A . 5 TYR CD2 1 1 1 68 1 1 5 TYR CE1 C -8.836 6.233 -2.417 1.00 . A A . 5 TYR CE1 1 1 1 69 1 1 5 TYR CE2 C -6.974 7.723 -2.498 1.00 . A A . 5 TYR CE2 1 1 1 70 1 1 5 TYR CG C -7.277 6.293 -0.581 1.00 . A A . 5 TYR CG 1 1 1 71 1 1 5 TYR CZ C -8.111 7.202 -3.072 1.00 . A A . 5 TYR CZ 1 1 1 72 1 1 5 TYR H H -6.076 2.867 -0.509 1.00 . A A . 5 TYR H 1 1 1 73 1 1 5 TYR HA H -5.139 4.824 -0.192 1.00 . A A . 5 TYR HA 1 1 1 74 1 1 5 TYR HB2 H -7.655 5.462 1.328 1.00 . A A . 5 TYR HB2 1 1 1 75 1 1 5 TYR HB3 H -6.319 6.611 1.280 1.00 . A A . 5 TYR HB3 1 1 1 76 1 1 5 TYR HD1 H -8.989 5.028 -0.659 1.00 . A A . 5 TYR HD1 1 1 1 77 1 1 5 TYR HD2 H -5.671 7.677 -0.811 1.00 . A A . 5 TYR HD2 1 1 1 78 1 1 5 TYR HE1 H -9.729 5.824 -2.866 1.00 . A A . 5 TYR HE1 1 1 1 79 1 1 5 TYR HE2 H -6.405 8.484 -3.009 1.00 . A A . 5 TYR HE2 1 1 1 80 1 1 5 TYR HH H -7.735 7.719 -4.877 1.00 . A A . 5 TYR HH 1 1 1 81 1 1 5 TYR N N -6.427 3.332 0.285 1.00 . A A . 5 TYR N 1 1 1 82 1 1 5 TYR O O -4.482 5.527 2.444 1.00 . A A . 5 TYR O 1 1 1 83 1 1 5 TYR OH O -8.520 7.641 -4.315 1.00 . A A . 5 TYR OH 1 1 1 84 1 1 6 GLY C C -2.184 2.629 2.599 1.00 . A A . 6 GLY C 1 1 1 85 1 1 6 GLY CA C -3.477 3.122 3.199 1.00 . A A . 6 GLY CA 1 1 1 86 1 1 6 GLY H H -4.812 2.537 1.690 1.00 . A A . 6 GLY H 1 1 1 87 1 1 6 GLY HA2 H -3.303 4.064 3.699 1.00 . A A . 6 GLY HA2 1 1 1 88 1 1 6 GLY HA3 H -3.837 2.397 3.914 1.00 . A A . 6 GLY HA3 1 1 1 89 1 1 6 GLY N N -4.455 3.317 2.163 1.00 . A A . 6 GLY N 1 1 1 90 1 1 6 GLY O O -2.180 2.187 1.433 1.00 . A A . 6 GLY O 1 1 1 91 1 1 7 GLN C C 0.299 0.740 2.917 1.00 . A A . 7 GLN C 1 1 1 92 1 1 7 GLN CA C 0.192 2.252 2.874 1.00 . A A . 7 GLN CA 1 1 1 93 1 1 7 GLN CB C 1.348 2.912 3.651 1.00 . A A . 7 GLN CB 1 1 1 94 1 1 7 GLN CD C 3.871 3.295 3.798 1.00 . A A . 7 GLN CD 1 1 1 95 1 1 7 GLN CG C 2.743 2.526 3.131 1.00 . A A . 7 GLN CG 1 1 1 96 1 1 7 GLN H H -1.187 2.980 4.293 1.00 . A A . 7 GLN H 1 1 1 97 1 1 7 GLN HA H 0.248 2.555 1.839 1.00 . A A . 7 GLN HA 1 1 1 98 1 1 7 GLN HB2 H 1.248 3.985 3.583 1.00 . A A . 7 GLN HB2 1 1 1 99 1 1 7 GLN HB3 H 1.281 2.618 4.688 1.00 . A A . 7 GLN HB3 1 1 1 100 1 1 7 GLN HE21 H 5.132 1.826 3.457 1.00 . A A . 7 GLN HE21 1 1 1 101 1 1 7 GLN HE22 H 5.786 3.193 4.261 1.00 . A A . 7 GLN HE22 1 1 1 102 1 1 7 GLN HG2 H 2.893 1.475 3.339 1.00 . A A . 7 GLN HG2 1 1 1 103 1 1 7 GLN HG3 H 2.787 2.674 2.063 1.00 . A A . 7 GLN HG3 1 1 1 104 1 1 7 GLN N N -1.105 2.679 3.362 1.00 . A A . 7 GLN N 1 1 1 105 1 1 7 GLN NE2 N 5.034 2.716 3.845 1.00 . A A . 7 GLN NE2 1 1 1 106 1 1 7 GLN O O 0.246 0.141 3.984 1.00 . A A . 7 GLN O 1 1 1 107 1 1 7 GLN OE1 O 3.702 4.416 4.225 1.00 . A A . 7 GLN OE1 1 1 1 108 1 1 8 CYS C C 1.883 -1.855 1.917 1.00 . A A . 8 CYS C 1 1 1 109 1 1 8 CYS CA C 0.511 -1.292 1.615 1.00 . A A . 8 CYS CA 1 1 1 110 1 1 8 CYS CB C 0.063 -1.701 0.220 1.00 . A A . 8 CYS CB 1 1 1 111 1 1 8 CYS H H 0.523 0.713 0.956 1.00 . A A . 8 CYS H 1 1 1 112 1 1 8 CYS HA H -0.186 -1.716 2.320 1.00 . A A . 8 CYS HA 1 1 1 113 1 1 8 CYS HB2 H 0.289 -2.747 0.070 1.00 . A A . 8 CYS HB2 1 1 1 114 1 1 8 CYS HB3 H -1.004 -1.554 0.134 1.00 . A A . 8 CYS HB3 1 1 1 115 1 1 8 CYS N N 0.450 0.150 1.758 1.00 . A A . 8 CYS N 1 1 1 116 1 1 8 CYS O O 2.015 -2.762 2.715 1.00 . A A . 8 CYS O 1 1 1 117 1 1 8 CYS SG S 0.862 -0.763 -1.127 1.00 . A A . 8 CYS SG 1 1 1 118 1 1 9 GLY C C 5.242 -1.166 0.678 1.00 . A A . 9 GLY C 1 1 1 119 1 1 9 GLY CA C 4.207 -1.851 1.495 1.00 . A A . 9 GLY CA 1 1 1 120 1 1 9 GLY H H 2.768 -0.560 0.687 1.00 . A A . 9 GLY H 1 1 1 121 1 1 9 GLY HA2 H 4.474 -1.777 2.537 1.00 . A A . 9 GLY HA2 1 1 1 122 1 1 9 GLY HA3 H 4.188 -2.890 1.206 1.00 . A A . 9 GLY HA3 1 1 1 123 1 1 9 GLY N N 2.904 -1.314 1.296 1.00 . A A . 9 GLY N 1 1 1 124 1 1 9 GLY O O 5.410 -1.463 -0.492 1.00 . A A . 9 GLY O 1 1 1 125 1 1 10 GLY C C 8.255 0.037 1.328 1.00 . A A . 10 GLY C 1 1 1 126 1 1 10 GLY CA C 6.986 0.438 0.646 1.00 . A A . 10 GLY CA 1 1 1 127 1 1 10 GLY H H 5.672 -0.010 2.205 1.00 . A A . 10 GLY H 1 1 1 128 1 1 10 GLY HA2 H 7.018 0.155 -0.396 1.00 . A A . 10 GLY HA2 1 1 1 129 1 1 10 GLY HA3 H 6.861 1.507 0.735 1.00 . A A . 10 GLY HA3 1 1 1 130 1 1 10 GLY N N 5.896 -0.231 1.282 1.00 . A A . 10 GLY N 1 1 1 131 1 1 10 GLY O O 8.212 -0.799 2.256 1.00 . A A . 10 GLY O 1 1 1 132 1 1 11 ILE C C 10.618 0.714 3.009 1.00 . A A . 11 ILE C 1 1 1 133 1 1 11 ILE CA C 10.648 0.317 1.527 1.00 . A A . 11 ILE CA 1 1 1 134 1 1 11 ILE CB C 11.799 1.076 0.801 1.00 . A A . 11 ILE CB 1 1 1 135 1 1 11 ILE CD1 C 12.931 1.396 -1.475 1.00 . A A . 11 ILE CD1 1 1 1 136 1 1 11 ILE CG1 C 11.867 0.660 -0.678 1.00 . A A . 11 ILE CG1 1 1 1 137 1 1 11 ILE CG2 C 13.137 0.829 1.491 1.00 . A A . 11 ILE CG2 1 1 1 138 1 1 11 ILE H H 9.332 1.249 0.176 1.00 . A A . 11 ILE H 1 1 1 139 1 1 11 ILE HA H 10.825 -0.747 1.451 1.00 . A A . 11 ILE HA 1 1 1 140 1 1 11 ILE HB H 11.589 2.134 0.854 1.00 . A A . 11 ILE HB 1 1 1 141 1 1 11 ILE HD11 H 13.899 1.214 -1.034 1.00 . A A . 11 ILE HD11 1 1 1 142 1 1 11 ILE HD12 H 12.722 2.457 -1.463 1.00 . A A . 11 ILE HD12 1 1 1 143 1 1 11 ILE HD13 H 12.927 1.043 -2.495 1.00 . A A . 11 ILE HD13 1 1 1 144 1 1 11 ILE HG12 H 12.089 -0.396 -0.737 1.00 . A A . 11 ILE HG12 1 1 1 145 1 1 11 ILE HG13 H 10.910 0.848 -1.142 1.00 . A A . 11 ILE HG13 1 1 1 146 1 1 11 ILE HG21 H 13.365 -0.227 1.463 1.00 . A A . 11 ILE HG21 1 1 1 147 1 1 11 ILE HG22 H 13.082 1.160 2.517 1.00 . A A . 11 ILE HG22 1 1 1 148 1 1 11 ILE HG23 H 13.910 1.377 0.973 1.00 . A A . 11 ILE HG23 1 1 1 149 1 1 11 ILE N N 9.362 0.606 0.916 1.00 . A A . 11 ILE N 1 1 1 150 1 1 11 ILE O O 10.420 1.880 3.345 1.00 . A A . 11 ILE O 1 1 1 151 1 1 12 GLY C C 9.438 -0.311 5.939 1.00 . A A . 12 GLY C 1 1 1 152 1 1 12 GLY CA C 10.753 0.017 5.280 1.00 . A A . 12 GLY CA 1 1 1 153 1 1 12 GLY H H 10.827 -1.191 3.572 1.00 . A A . 12 GLY H 1 1 1 154 1 1 12 GLY HA2 H 11.535 -0.566 5.745 1.00 . A A . 12 GLY HA2 1 1 1 155 1 1 12 GLY HA3 H 10.965 1.065 5.427 1.00 . A A . 12 GLY HA3 1 1 1 156 1 1 12 GLY N N 10.743 -0.260 3.877 1.00 . A A . 12 GLY N 1 1 1 157 1 1 12 GLY O O 9.359 -0.382 7.165 1.00 . A A . 12 GLY O 1 1 1 158 1 1 13 TYR C C 6.989 -2.339 5.844 1.00 . A A . 13 TYR C 1 1 1 159 1 1 13 TYR CA C 7.102 -0.846 5.710 1.00 . A A . 13 TYR CA 1 1 1 160 1 1 13 TYR CB C 5.960 -0.311 4.832 1.00 . A A . 13 TYR CB 1 1 1 161 1 1 13 TYR CD1 C 3.849 -1.698 5.205 1.00 . A A . 13 TYR CD1 1 1 1 162 1 1 13 TYR CD2 C 3.948 0.476 6.171 1.00 . A A . 13 TYR CD2 1 1 1 163 1 1 13 TYR CE1 C 2.581 -1.879 5.727 1.00 . A A . 13 TYR CE1 1 1 1 164 1 1 13 TYR CE2 C 2.680 0.302 6.697 1.00 . A A . 13 TYR CE2 1 1 1 165 1 1 13 TYR CG C 4.558 -0.517 5.416 1.00 . A A . 13 TYR CG 1 1 1 166 1 1 13 TYR CZ C 2.003 -0.877 6.474 1.00 . A A . 13 TYR CZ 1 1 1 167 1 1 13 TYR H H 8.518 -0.486 4.173 1.00 . A A . 13 TYR H 1 1 1 168 1 1 13 TYR HA H 7.040 -0.394 6.687 1.00 . A A . 13 TYR HA 1 1 1 169 1 1 13 TYR HB2 H 6.099 0.749 4.679 1.00 . A A . 13 TYR HB2 1 1 1 170 1 1 13 TYR HB3 H 5.999 -0.811 3.875 1.00 . A A . 13 TYR HB3 1 1 1 171 1 1 13 TYR HD1 H 4.305 -2.482 4.620 1.00 . A A . 13 TYR HD1 1 1 1 172 1 1 13 TYR HD2 H 4.481 1.400 6.344 1.00 . A A . 13 TYR HD2 1 1 1 173 1 1 13 TYR HE1 H 2.056 -2.806 5.547 1.00 . A A . 13 TYR HE1 1 1 1 174 1 1 13 TYR HE2 H 2.227 1.088 7.282 1.00 . A A . 13 TYR HE2 1 1 1 175 1 1 13 TYR HH H 0.215 -0.294 6.664 1.00 . A A . 13 TYR HH 1 1 1 176 1 1 13 TYR N N 8.396 -0.522 5.148 1.00 . A A . 13 TYR N 1 1 1 177 1 1 13 TYR O O 6.957 -3.052 4.848 1.00 . A A . 13 TYR O 1 1 1 178 1 1 13 TYR OH O 0.730 -1.043 6.985 1.00 . A A . 13 TYR OH 1 1 1 179 1 1 14 SER C C 5.421 -4.471 7.851 1.00 . A A . 14 SER C 1 1 1 180 1 1 14 SER CA C 6.817 -4.194 7.344 1.00 . A A . 14 SER CA 1 1 1 181 1 1 14 SER CB C 7.859 -4.544 8.413 1.00 . A A . 14 SER CB 1 1 1 182 1 1 14 SER H H 6.923 -2.169 7.806 1.00 . A A . 14 SER H 1 1 1 183 1 1 14 SER HA H 7.003 -4.772 6.453 1.00 . A A . 14 SER HA 1 1 1 184 1 1 14 SER HB2 H 7.659 -3.954 9.295 1.00 . A A . 14 SER HB2 1 1 1 185 1 1 14 SER HB3 H 7.782 -5.592 8.664 1.00 . A A . 14 SER HB3 1 1 1 186 1 1 14 SER N N 6.918 -2.793 7.048 1.00 . A A . 14 SER N 1 1 1 187 1 1 14 SER O O 4.977 -3.846 8.821 1.00 . A A . 14 SER O 1 1 1 188 1 1 14 SER OG O 9.228 -4.257 7.961 1.00 . A A . 14 SER OG 1 1 1 189 1 1 15 GLY C C 2.636 -6.343 6.475 1.00 . A A . 15 GLY C 1 1 1 190 1 1 15 GLY CA C 3.386 -5.681 7.592 1.00 . A A . 15 GLY CA 1 1 1 191 1 1 15 GLY H H 5.077 -5.791 6.386 1.00 . A A . 15 GLY H 1 1 1 192 1 1 15 GLY HA2 H 3.429 -6.347 8.440 1.00 . A A . 15 GLY HA2 1 1 1 193 1 1 15 GLY HA3 H 2.867 -4.776 7.870 1.00 . A A . 15 GLY HA3 1 1 1 194 1 1 15 GLY N N 4.717 -5.347 7.185 1.00 . A A . 15 GLY N 1 1 1 195 1 1 15 GLY O O 3.270 -6.904 5.563 1.00 . A A . 15 GLY O 1 1 1 196 1 1 16 PRO C C 0.510 -6.044 4.192 1.00 . A A . 16 PRO C 1 1 1 197 1 1 16 PRO CA C 0.475 -6.894 5.460 1.00 . A A . 16 PRO CA 1 1 1 198 1 1 16 PRO CB C -0.949 -6.913 6.062 1.00 . A A . 16 PRO CB 1 1 1 199 1 1 16 PRO CD C 0.477 -5.662 7.531 1.00 . A A . 16 PRO CD 1 1 1 200 1 1 16 PRO CG C -0.788 -6.467 7.484 1.00 . A A . 16 PRO CG 1 1 1 201 1 1 16 PRO HA H 0.800 -7.898 5.235 1.00 . A A . 16 PRO HA 1 1 1 202 1 1 16 PRO HB2 H -1.581 -6.237 5.505 1.00 . A A . 16 PRO HB2 1 1 1 203 1 1 16 PRO HB3 H -1.354 -7.913 6.009 1.00 . A A . 16 PRO HB3 1 1 1 204 1 1 16 PRO HD2 H 0.279 -4.629 7.283 1.00 . A A . 16 PRO HD2 1 1 1 205 1 1 16 PRO HD3 H 0.942 -5.742 8.502 1.00 . A A . 16 PRO HD3 1 1 1 206 1 1 16 PRO HG2 H -1.631 -5.859 7.772 1.00 . A A . 16 PRO HG2 1 1 1 207 1 1 16 PRO HG3 H -0.710 -7.328 8.131 1.00 . A A . 16 PRO HG3 1 1 1 208 1 1 16 PRO N N 1.298 -6.301 6.500 1.00 . A A . 16 PRO N 1 1 1 209 1 1 16 PRO O O -0.129 -4.994 4.114 1.00 . A A . 16 PRO O 1 1 1 210 1 1 17 THR C C 0.394 -6.091 0.968 1.00 . A A . 17 THR C 1 1 1 211 1 1 17 THR CA C 1.472 -5.769 2.007 1.00 . A A . 17 THR CA 1 1 1 212 1 1 17 THR CB C 2.888 -6.067 1.473 1.00 . A A . 17 THR CB 1 1 1 213 1 1 17 THR CG2 C 3.937 -5.385 2.342 1.00 . A A . 17 THR CG2 1 1 1 214 1 1 17 THR H H 1.724 -7.355 3.328 1.00 . A A . 17 THR H 1 1 1 215 1 1 17 THR HA H 1.417 -4.716 2.242 1.00 . A A . 17 THR HA 1 1 1 216 1 1 17 THR HB H 2.974 -5.708 0.459 1.00 . A A . 17 THR HB 1 1 1 217 1 1 17 THR HG1 H 3.064 -7.843 0.614 1.00 . A A . 17 THR HG1 1 1 1 218 1 1 17 THR HG21 H 3.723 -4.329 2.406 1.00 . A A . 17 THR HG21 1 1 1 219 1 1 17 THR HG22 H 4.918 -5.528 1.914 1.00 . A A . 17 THR HG22 1 1 1 220 1 1 17 THR HG23 H 3.913 -5.811 3.333 1.00 . A A . 17 THR HG23 1 1 1 221 1 1 17 THR N N 1.264 -6.493 3.227 1.00 . A A . 17 THR N 1 1 1 222 1 1 17 THR O O 0.285 -5.434 -0.072 1.00 . A A . 17 THR O 1 1 1 223 1 1 17 THR OG1 O 3.119 -7.493 1.512 1.00 . A A . 17 THR OG1 1 1 1 224 1 1 18 VAL C C -2.703 -6.609 0.691 1.00 . A A . 18 VAL C 1 1 1 225 1 1 18 VAL CA C -1.494 -7.497 0.397 1.00 . A A . 18 VAL CA 1 1 1 226 1 1 18 VAL CB C -1.874 -8.993 0.606 1.00 . A A . 18 VAL CB 1 1 1 227 1 1 18 VAL CG1 C -3.030 -9.405 -0.300 1.00 . A A . 18 VAL CG1 1 1 1 228 1 1 18 VAL CG2 C -0.667 -9.889 0.360 1.00 . A A . 18 VAL CG2 1 1 1 229 1 1 18 VAL H H -0.219 -7.595 2.087 1.00 . A A . 18 VAL H 1 1 1 230 1 1 18 VAL HA H -1.189 -7.346 -0.628 1.00 . A A . 18 VAL HA 1 1 1 231 1 1 18 VAL HB H -2.186 -9.120 1.632 1.00 . A A . 18 VAL HB 1 1 1 232 1 1 18 VAL HG11 H -2.743 -9.278 -1.333 1.00 . A A . 18 VAL HG11 1 1 1 233 1 1 18 VAL HG12 H -3.891 -8.789 -0.088 1.00 . A A . 18 VAL HG12 1 1 1 234 1 1 18 VAL HG13 H -3.279 -10.441 -0.120 1.00 . A A . 18 VAL HG13 1 1 1 235 1 1 18 VAL HG21 H -0.327 -9.758 -0.657 1.00 . A A . 18 VAL HG21 1 1 1 236 1 1 18 VAL HG22 H -0.942 -10.921 0.518 1.00 . A A . 18 VAL HG22 1 1 1 237 1 1 18 VAL HG23 H 0.126 -9.619 1.040 1.00 . A A . 18 VAL HG23 1 1 1 238 1 1 18 VAL N N -0.395 -7.104 1.257 1.00 . A A . 18 VAL N 1 1 1 239 1 1 18 VAL O O -3.156 -6.523 1.844 1.00 . A A . 18 VAL O 1 1 1 240 1 1 19 CYS C C -5.637 -5.834 -0.288 1.00 . A A . 19 CYS C 1 1 1 241 1 1 19 CYS CA C -4.328 -5.060 -0.191 1.00 . A A . 19 CYS CA 1 1 1 242 1 1 19 CYS CB C -4.261 -3.954 -1.261 1.00 . A A . 19 CYS CB 1 1 1 243 1 1 19 CYS H H -2.832 -6.088 -1.221 1.00 . A A . 19 CYS H 1 1 1 244 1 1 19 CYS HA H -4.272 -4.602 0.785 1.00 . A A . 19 CYS HA 1 1 1 245 1 1 19 CYS HB2 H -4.333 -4.363 -2.260 1.00 . A A . 19 CYS HB2 1 1 1 246 1 1 19 CYS HB3 H -5.080 -3.266 -1.098 1.00 . A A . 19 CYS HB3 1 1 1 247 1 1 19 CYS N N -3.204 -5.956 -0.322 1.00 . A A . 19 CYS N 1 1 1 248 1 1 19 CYS O O -5.643 -7.027 -0.619 1.00 . A A . 19 CYS O 1 1 1 249 1 1 19 CYS SG S -2.730 -2.969 -1.196 1.00 . A A . 19 CYS SG 1 1 1 250 1 1 20 ALA C C -8.432 -5.998 -1.489 1.00 . A A . 20 ALA C 1 1 1 251 1 1 20 ALA CA C -8.040 -5.789 -0.024 1.00 . A A . 20 ALA CA 1 1 1 252 1 1 20 ALA CB C -9.067 -4.921 0.690 1.00 . A A . 20 ALA CB 1 1 1 253 1 1 20 ALA H H -6.640 -4.263 0.394 1.00 . A A . 20 ALA H 1 1 1 254 1 1 20 ALA HA H -7.995 -6.749 0.468 1.00 . A A . 20 ALA HA 1 1 1 255 1 1 20 ALA HB1 H -9.116 -3.956 0.209 1.00 . A A . 20 ALA HB1 1 1 1 256 1 1 20 ALA HB2 H -8.774 -4.794 1.722 1.00 . A A . 20 ALA HB2 1 1 1 257 1 1 20 ALA HB3 H -10.035 -5.398 0.646 1.00 . A A . 20 ALA HB3 1 1 1 258 1 1 20 ALA N N -6.728 -5.184 0.062 1.00 . A A . 20 ALA N 1 1 1 259 1 1 20 ALA O O -7.920 -5.293 -2.387 1.00 . A A . 20 ALA O 1 1 1 260 1 1 21 SER C C -10.270 -6.082 -3.830 1.00 . A A . 21 SER C 1 1 1 261 1 1 21 SER CA C -9.784 -7.300 -3.050 1.00 . A A . 21 SER CA 1 1 1 262 1 1 21 SER CB C -10.888 -8.351 -2.950 1.00 . A A . 21 SER CB 1 1 1 263 1 1 21 SER H H -9.675 -7.461 -0.967 1.00 . A A . 21 SER H 1 1 1 264 1 1 21 SER HA H -8.953 -7.734 -3.581 1.00 . A A . 21 SER HA 1 1 1 265 1 1 21 SER HB2 H -11.722 -7.944 -2.399 1.00 . A A . 21 SER HB2 1 1 1 266 1 1 21 SER HB3 H -11.211 -8.631 -3.941 1.00 . A A . 21 SER HB3 1 1 1 267 1 1 21 SER HG H -11.056 -10.216 -2.474 1.00 . A A . 21 SER HG 1 1 1 268 1 1 21 SER N N -9.318 -6.949 -1.722 1.00 . A A . 21 SER N 1 1 1 269 1 1 21 SER O O -11.174 -5.352 -3.387 1.00 . A A . 21 SER O 1 1 1 270 1 1 21 SER OG O -10.415 -9.517 -2.279 1.00 . A A . 21 SER OG 1 1 1 271 1 1 22 GLY C C -9.102 -3.557 -5.658 1.00 . A A . 22 GLY C 1 1 1 272 1 1 22 GLY CA C -10.013 -4.754 -5.793 1.00 . A A . 22 GLY CA 1 1 1 273 1 1 22 GLY H H -8.882 -6.424 -5.211 1.00 . A A . 22 GLY H 1 1 1 274 1 1 22 GLY HA2 H -9.995 -5.095 -6.818 1.00 . A A . 22 GLY HA2 1 1 1 275 1 1 22 GLY HA3 H -11.020 -4.462 -5.539 1.00 . A A . 22 GLY HA3 1 1 1 276 1 1 22 GLY N N -9.628 -5.840 -4.948 1.00 . A A . 22 GLY N 1 1 1 277 1 1 22 GLY O O -9.149 -2.641 -6.485 1.00 . A A . 22 GLY O 1 1 1 278 1 1 23 THR C C -5.944 -2.887 -4.720 1.00 . A A . 23 THR C 1 1 1 279 1 1 23 THR CA C -7.362 -2.438 -4.452 1.00 . A A . 23 THR CA 1 1 1 280 1 1 23 THR CB C -7.497 -1.781 -3.052 1.00 . A A . 23 THR CB 1 1 1 281 1 1 23 THR CG2 C -8.871 -1.172 -2.895 1.00 . A A . 23 THR CG2 1 1 1 282 1 1 23 THR H H -8.252 -4.302 -4.017 1.00 . A A . 23 THR H 1 1 1 283 1 1 23 THR HA H -7.615 -1.706 -5.206 1.00 . A A . 23 THR HA 1 1 1 284 1 1 23 THR HB H -6.763 -0.992 -2.972 1.00 . A A . 23 THR HB 1 1 1 285 1 1 23 THR HG1 H -7.366 -3.638 -2.332 1.00 . A A . 23 THR HG1 1 1 1 286 1 1 23 THR HG21 H -9.622 -1.941 -3.007 1.00 . A A . 23 THR HG21 1 1 1 287 1 1 23 THR HG22 H -9.016 -0.414 -3.650 1.00 . A A . 23 THR HG22 1 1 1 288 1 1 23 THR HG23 H -8.958 -0.725 -1.917 1.00 . A A . 23 THR HG23 1 1 1 289 1 1 23 THR N N -8.274 -3.543 -4.641 1.00 . A A . 23 THR N 1 1 1 290 1 1 23 THR O O -5.556 -3.983 -4.329 1.00 . A A . 23 THR O 1 1 1 291 1 1 23 THR OG1 O -7.286 -2.733 -1.997 1.00 . A A . 23 THR OG1 1 1 1 292 1 1 24 THR C C -2.807 -1.686 -5.047 1.00 . A A . 24 THR C 1 1 1 293 1 1 24 THR CA C -3.873 -2.437 -5.815 1.00 . A A . 24 THR CA 1 1 1 294 1 1 24 THR CB C -3.697 -2.199 -7.334 1.00 . A A . 24 THR CB 1 1 1 295 1 1 24 THR CG2 C -4.523 -3.186 -8.127 1.00 . A A . 24 THR CG2 1 1 1 296 1 1 24 THR H H -5.546 -1.177 -5.622 1.00 . A A . 24 THR H 1 1 1 297 1 1 24 THR HA H -3.760 -3.494 -5.625 1.00 . A A . 24 THR HA 1 1 1 298 1 1 24 THR HB H -2.654 -2.328 -7.584 1.00 . A A . 24 THR HB 1 1 1 299 1 1 24 THR HG1 H -4.829 -0.561 -7.116 1.00 . A A . 24 THR HG1 1 1 1 300 1 1 24 THR HG21 H -5.565 -3.064 -7.873 1.00 . A A . 24 THR HG21 1 1 1 301 1 1 24 THR HG22 H -4.208 -4.190 -7.887 1.00 . A A . 24 THR HG22 1 1 1 302 1 1 24 THR HG23 H -4.386 -3.004 -9.183 1.00 . A A . 24 THR HG23 1 1 1 303 1 1 24 THR N N -5.198 -2.073 -5.396 1.00 . A A . 24 THR N 1 1 1 304 1 1 24 THR O O -2.934 -0.492 -4.811 1.00 . A A . 24 THR O 1 1 1 305 1 1 24 THR OG1 O -4.098 -0.843 -7.690 1.00 . A A . 24 THR OG1 1 1 1 306 1 1 25 CYS C C 0.187 -1.049 -4.997 1.00 . A A . 25 CYS C 1 1 1 307 1 1 25 CYS CA C -0.665 -1.779 -3.969 1.00 . A A . 25 CYS CA 1 1 1 308 1 1 25 CYS CB C 0.167 -2.847 -3.229 1.00 . A A . 25 CYS CB 1 1 1 309 1 1 25 CYS H H -1.771 -3.352 -4.811 1.00 . A A . 25 CYS H 1 1 1 310 1 1 25 CYS HA H -1.050 -1.065 -3.255 1.00 . A A . 25 CYS HA 1 1 1 311 1 1 25 CYS HB2 H -0.463 -3.343 -2.505 1.00 . A A . 25 CYS HB2 1 1 1 312 1 1 25 CYS HB3 H 0.517 -3.575 -3.947 1.00 . A A . 25 CYS HB3 1 1 1 313 1 1 25 CYS N N -1.781 -2.386 -4.645 1.00 . A A . 25 CYS N 1 1 1 314 1 1 25 CYS O O 0.971 -1.663 -5.730 1.00 . A A . 25 CYS O 1 1 1 315 1 1 25 CYS SG S 1.626 -2.197 -2.332 1.00 . A A . 25 CYS SG 1 1 1 316 1 1 26 GLN C C 1.787 1.802 -5.348 1.00 . A A . 26 GLN C 1 1 1 317 1 1 26 GLN CA C 0.713 1.031 -6.049 1.00 . A A . 26 GLN CA 1 1 1 318 1 1 26 GLN CB C -0.207 1.986 -6.796 1.00 . A A . 26 GLN CB 1 1 1 319 1 1 26 GLN CD C -2.112 2.265 -8.403 1.00 . A A . 26 GLN CD 1 1 1 320 1 1 26 GLN CG C -1.295 1.296 -7.590 1.00 . A A . 26 GLN CG 1 1 1 321 1 1 26 GLN H H -0.683 0.670 -4.525 1.00 . A A . 26 GLN H 1 1 1 322 1 1 26 GLN HA H 1.170 0.362 -6.763 1.00 . A A . 26 GLN HA 1 1 1 323 1 1 26 GLN HB2 H -0.679 2.643 -6.080 1.00 . A A . 26 GLN HB2 1 1 1 324 1 1 26 GLN HB3 H 0.384 2.581 -7.476 1.00 . A A . 26 GLN HB3 1 1 1 325 1 1 26 GLN HE21 H -3.676 1.086 -8.252 1.00 . A A . 26 GLN HE21 1 1 1 326 1 1 26 GLN HE22 H -3.906 2.544 -9.164 1.00 . A A . 26 GLN HE22 1 1 1 327 1 1 26 GLN HG2 H -0.842 0.581 -8.261 1.00 . A A . 26 GLN HG2 1 1 1 328 1 1 26 GLN HG3 H -1.951 0.779 -6.904 1.00 . A A . 26 GLN HG3 1 1 1 329 1 1 26 GLN N N -0.015 0.235 -5.105 1.00 . A A . 26 GLN N 1 1 1 330 1 1 26 GLN NE2 N -3.352 1.937 -8.626 1.00 . A A . 26 GLN NE2 1 1 1 331 1 1 26 GLN O O 1.523 2.516 -4.374 1.00 . A A . 26 GLN O 1 1 1 332 1 1 26 GLN OE1 O -1.610 3.315 -8.845 1.00 . A A . 26 GLN OE1 1 1 1 333 1 1 27 VAL C C 4.084 3.772 -5.793 1.00 . A A . 27 VAL C 1 1 1 334 1 1 27 VAL CA C 4.110 2.349 -5.256 1.00 . A A . 27 VAL CA 1 1 1 335 1 1 27 VAL CB C 5.446 1.657 -5.634 1.00 . A A . 27 VAL CB 1 1 1 336 1 1 27 VAL CG1 C 6.622 2.312 -4.935 1.00 . A A . 27 VAL CG1 1 1 1 337 1 1 27 VAL CG2 C 5.397 0.168 -5.317 1.00 . A A . 27 VAL CG2 1 1 1 338 1 1 27 VAL H H 3.129 1.059 -6.585 1.00 . A A . 27 VAL H 1 1 1 339 1 1 27 VAL HA H 4.001 2.366 -4.181 1.00 . A A . 27 VAL HA 1 1 1 340 1 1 27 VAL HB H 5.585 1.771 -6.698 1.00 . A A . 27 VAL HB 1 1 1 341 1 1 27 VAL HG11 H 7.532 1.801 -5.214 1.00 . A A . 27 VAL HG11 1 1 1 342 1 1 27 VAL HG12 H 6.487 2.247 -3.866 1.00 . A A . 27 VAL HG12 1 1 1 343 1 1 27 VAL HG13 H 6.685 3.349 -5.229 1.00 . A A . 27 VAL HG13 1 1 1 344 1 1 27 VAL HG21 H 5.216 0.029 -4.261 1.00 . A A . 27 VAL HG21 1 1 1 345 1 1 27 VAL HG22 H 6.338 -0.290 -5.584 1.00 . A A . 27 VAL HG22 1 1 1 346 1 1 27 VAL HG23 H 4.600 -0.294 -5.881 1.00 . A A . 27 VAL HG23 1 1 1 347 1 1 27 VAL N N 2.987 1.651 -5.816 1.00 . A A . 27 VAL N 1 1 1 348 1 1 27 VAL O O 4.363 4.003 -6.976 1.00 . A A . 27 VAL O 1 1 1 349 1 1 28 LEU C C 4.863 6.801 -5.202 1.00 . A A . 28 LEU C 1 1 1 350 1 1 28 LEU CA C 3.546 6.087 -5.370 1.00 . A A . 28 LEU CA 1 1 1 351 1 1 28 LEU CB C 2.475 6.799 -4.526 1.00 . A A . 28 LEU CB 1 1 1 352 1 1 28 LEU CD1 C 0.141 7.009 -3.640 1.00 . A A . 28 LEU CD1 1 1 1 353 1 1 28 LEU CD2 C 0.516 5.939 -5.855 1.00 . A A . 28 LEU CD2 1 1 1 354 1 1 28 LEU CG C 1.084 6.153 -4.467 1.00 . A A . 28 LEU CG 1 1 1 355 1 1 28 LEU H H 3.487 4.454 -4.030 1.00 . A A . 28 LEU H 1 1 1 356 1 1 28 LEU HA H 3.248 6.113 -6.408 1.00 . A A . 28 LEU HA 1 1 1 357 1 1 28 LEU HB2 H 2.849 6.876 -3.515 1.00 . A A . 28 LEU HB2 1 1 1 358 1 1 28 LEU HB3 H 2.362 7.798 -4.920 1.00 . A A . 28 LEU HB3 1 1 1 359 1 1 28 LEU HD11 H -0.836 6.552 -3.619 1.00 . A A . 28 LEU HD11 1 1 1 360 1 1 28 LEU HD12 H 0.068 7.992 -4.082 1.00 . A A . 28 LEU HD12 1 1 1 361 1 1 28 LEU HD13 H 0.520 7.095 -2.633 1.00 . A A . 28 LEU HD13 1 1 1 362 1 1 28 LEU HD21 H 0.441 6.893 -6.354 1.00 . A A . 28 LEU HD21 1 1 1 363 1 1 28 LEU HD22 H -0.463 5.492 -5.770 1.00 . A A . 28 LEU HD22 1 1 1 364 1 1 28 LEU HD23 H 1.169 5.283 -6.411 1.00 . A A . 28 LEU HD23 1 1 1 365 1 1 28 LEU HG H 1.167 5.194 -3.976 1.00 . A A . 28 LEU HG 1 1 1 366 1 1 28 LEU N N 3.685 4.702 -4.958 1.00 . A A . 28 LEU N 1 1 1 367 1 1 28 LEU O O 5.310 7.539 -6.075 1.00 . A A . 28 LEU O 1 1 1 368 1 1 29 ASN C C 7.668 6.035 -3.345 1.00 . A A . 29 ASN C 1 1 1 369 1 1 29 ASN CA C 6.732 7.167 -3.719 1.00 . A A . 29 ASN CA 1 1 1 370 1 1 29 ASN CB C 6.540 8.104 -2.503 1.00 . A A . 29 ASN CB 1 1 1 371 1 1 29 ASN CG C 5.510 9.202 -2.703 1.00 . A A . 29 ASN CG 1 1 1 372 1 1 29 ASN H H 5.107 5.895 -3.456 1.00 . A A . 29 ASN H 1 1 1 373 1 1 29 ASN HA H 7.119 7.719 -4.562 1.00 . A A . 29 ASN HA 1 1 1 374 1 1 29 ASN HB2 H 6.245 7.514 -1.650 1.00 . A A . 29 ASN HB2 1 1 1 375 1 1 29 ASN HB3 H 7.490 8.568 -2.285 1.00 . A A . 29 ASN HB3 1 1 1 376 1 1 29 ASN HD21 H 5.097 9.264 -0.747 1.00 . A A . 29 ASN HD21 1 1 1 377 1 1 29 ASN HD22 H 4.219 10.340 -1.746 1.00 . A A . 29 ASN HD22 1 1 1 378 1 1 29 ASN N N 5.480 6.554 -4.082 1.00 . A A . 29 ASN N 1 1 1 379 1 1 29 ASN ND2 N 4.893 9.634 -1.634 1.00 . A A . 29 ASN ND2 1 1 1 380 1 1 29 ASN O O 7.194 4.916 -3.175 1.00 . A A . 29 ASN O 1 1 1 381 1 1 29 ASN OD1 O 5.284 9.674 -3.813 1.00 . A A . 29 ASN OD1 1 1 1 382 1 1 30 PRO C C 9.572 4.445 -1.586 1.00 . A A . 30 PRO C 1 1 1 383 1 1 30 PRO CA C 9.964 5.222 -2.849 1.00 . A A . 30 PRO CA 1 1 1 384 1 1 30 PRO CB C 11.259 5.998 -2.606 1.00 . A A . 30 PRO CB 1 1 1 385 1 1 30 PRO CD C 9.674 7.574 -3.428 1.00 . A A . 30 PRO CD 1 1 1 386 1 1 30 PRO CG C 11.128 7.204 -3.458 1.00 . A A . 30 PRO CG 1 1 1 387 1 1 30 PRO HA H 10.106 4.525 -3.661 1.00 . A A . 30 PRO HA 1 1 1 388 1 1 30 PRO HB2 H 11.330 6.253 -1.559 1.00 . A A . 30 PRO HB2 1 1 1 389 1 1 30 PRO HB3 H 12.108 5.398 -2.895 1.00 . A A . 30 PRO HB3 1 1 1 390 1 1 30 PRO HD2 H 9.485 8.248 -2.606 1.00 . A A . 30 PRO HD2 1 1 1 391 1 1 30 PRO HD3 H 9.366 8.019 -4.362 1.00 . A A . 30 PRO HD3 1 1 1 392 1 1 30 PRO HG2 H 11.733 8.003 -3.054 1.00 . A A . 30 PRO HG2 1 1 1 393 1 1 30 PRO HG3 H 11.434 6.973 -4.467 1.00 . A A . 30 PRO HG3 1 1 1 394 1 1 30 PRO N N 8.995 6.277 -3.207 1.00 . A A . 30 PRO N 1 1 1 395 1 1 30 PRO O O 9.757 3.229 -1.509 1.00 . A A . 30 PRO O 1 1 1 396 1 1 31 TYR C C 7.141 4.357 0.739 1.00 . A A . 31 TYR C 1 1 1 397 1 1 31 TYR CA C 8.653 4.447 0.612 1.00 . A A . 31 TYR CA 1 1 1 398 1 1 31 TYR CB C 9.245 5.178 1.828 1.00 . A A . 31 TYR CB 1 1 1 399 1 1 31 TYR CD1 C 11.273 6.523 1.150 1.00 . A A . 31 TYR CD1 1 1 1 400 1 1 31 TYR CD2 C 11.628 4.445 2.240 1.00 . A A . 31 TYR CD2 1 1 1 401 1 1 31 TYR CE1 C 12.631 6.710 1.054 1.00 . A A . 31 TYR CE1 1 1 1 402 1 1 31 TYR CE2 C 12.991 4.626 2.152 1.00 . A A . 31 TYR CE2 1 1 1 403 1 1 31 TYR CG C 10.745 5.386 1.745 1.00 . A A . 31 TYR CG 1 1 1 404 1 1 31 TYR CZ C 13.486 5.759 1.557 1.00 . A A . 31 TYR CZ 1 1 1 405 1 1 31 TYR H H 8.885 6.097 -0.694 1.00 . A A . 31 TYR H 1 1 1 406 1 1 31 TYR HA H 9.068 3.451 0.577 1.00 . A A . 31 TYR HA 1 1 1 407 1 1 31 TYR HB2 H 8.778 6.147 1.923 1.00 . A A . 31 TYR HB2 1 1 1 408 1 1 31 TYR HB3 H 9.037 4.602 2.718 1.00 . A A . 31 TYR HB3 1 1 1 409 1 1 31 TYR HD1 H 10.602 7.271 0.757 1.00 . A A . 31 TYR HD1 1 1 1 410 1 1 31 TYR HD2 H 11.236 3.553 2.706 1.00 . A A . 31 TYR HD2 1 1 1 411 1 1 31 TYR HE1 H 13.016 7.602 0.584 1.00 . A A . 31 TYR HE1 1 1 1 412 1 1 31 TYR HE2 H 13.661 3.877 2.548 1.00 . A A . 31 TYR HE2 1 1 1 413 1 1 31 TYR HH H 15.037 6.850 1.733 1.00 . A A . 31 TYR HH 1 1 1 414 1 1 31 TYR N N 9.025 5.130 -0.603 1.00 . A A . 31 TYR N 1 1 1 415 1 1 31 TYR O O 6.615 3.446 1.380 1.00 . A A . 31 TYR O 1 1 1 416 1 1 31 TYR OH O 14.845 5.942 1.463 1.00 . A A . 31 TYR OH 1 1 1 417 1 1 32 TYR C C 4.360 4.481 -0.932 1.00 . A A . 32 TYR C 1 1 1 418 1 1 32 TYR CA C 4.997 5.269 0.204 1.00 . A A . 32 TYR CA 1 1 1 419 1 1 32 TYR CB C 4.441 6.689 0.253 1.00 . A A . 32 TYR CB 1 1 1 420 1 1 32 TYR CD1 C 2.675 6.655 2.037 1.00 . A A . 32 TYR CD1 1 1 1 421 1 1 32 TYR CD2 C 1.957 6.966 -0.212 1.00 . A A . 32 TYR CD2 1 1 1 422 1 1 32 TYR CE1 C 1.375 6.740 2.474 1.00 . A A . 32 TYR CE1 1 1 1 423 1 1 32 TYR CE2 C 0.644 7.049 0.224 1.00 . A A . 32 TYR CE2 1 1 1 424 1 1 32 TYR CG C 2.995 6.768 0.696 1.00 . A A . 32 TYR CG 1 1 1 425 1 1 32 TYR CZ C 0.364 6.933 1.572 1.00 . A A . 32 TYR CZ 1 1 1 426 1 1 32 TYR H H 6.891 5.957 -0.420 1.00 . A A . 32 TYR H 1 1 1 427 1 1 32 TYR HA H 4.744 4.775 1.131 1.00 . A A . 32 TYR HA 1 1 1 428 1 1 32 TYR HB2 H 5.030 7.280 0.938 1.00 . A A . 32 TYR HB2 1 1 1 429 1 1 32 TYR HB3 H 4.503 7.123 -0.734 1.00 . A A . 32 TYR HB3 1 1 1 430 1 1 32 TYR HD1 H 3.470 6.502 2.751 1.00 . A A . 32 TYR HD1 1 1 1 431 1 1 32 TYR HD2 H 2.178 7.052 -1.266 1.00 . A A . 32 TYR HD2 1 1 1 432 1 1 32 TYR HE1 H 1.154 6.650 3.527 1.00 . A A . 32 TYR HE1 1 1 1 433 1 1 32 TYR HE2 H -0.156 7.202 -0.486 1.00 . A A . 32 TYR HE2 1 1 1 434 1 1 32 TYR HH H -0.876 7.561 2.837 1.00 . A A . 32 TYR HH 1 1 1 435 1 1 32 TYR N N 6.435 5.272 0.110 1.00 . A A . 32 TYR N 1 1 1 436 1 1 32 TYR O O 4.462 4.847 -2.104 1.00 . A A . 32 TYR O 1 1 1 437 1 1 32 TYR OH O -0.937 7.035 2.027 1.00 . A A . 32 TYR OH 1 1 1 438 1 1 33 SER C C 1.552 2.569 -0.977 1.00 . A A . 33 SER C 1 1 1 439 1 1 33 SER CA C 2.961 2.644 -1.526 1.00 . A A . 33 SER CA 1 1 1 440 1 1 33 SER CB C 3.592 1.267 -1.662 1.00 . A A . 33 SER CB 1 1 1 441 1 1 33 SER H H 3.730 3.131 0.344 1.00 . A A . 33 SER H 1 1 1 442 1 1 33 SER HA H 2.955 3.155 -2.477 1.00 . A A . 33 SER HA 1 1 1 443 1 1 33 SER HB2 H 3.493 0.729 -0.731 1.00 . A A . 33 SER HB2 1 1 1 444 1 1 33 SER HB3 H 3.102 0.718 -2.454 1.00 . A A . 33 SER HB3 1 1 1 445 1 1 33 SER HG H 5.216 2.328 -1.926 1.00 . A A . 33 SER HG 1 1 1 446 1 1 33 SER N N 3.716 3.422 -0.590 1.00 . A A . 33 SER N 1 1 1 447 1 1 33 SER O O 1.387 2.367 0.213 1.00 . A A . 33 SER O 1 1 1 448 1 1 33 SER OG O 4.967 1.400 -1.982 1.00 . A A . 33 SER OG 1 1 1 449 1 1 34 GLN C C -1.731 1.918 -2.089 1.00 . A A . 34 GLN C 1 1 1 450 1 1 34 GLN CA C -0.800 2.867 -1.339 1.00 . A A . 34 GLN CA 1 1 1 451 1 1 34 GLN CB C -1.232 4.328 -1.523 1.00 . A A . 34 GLN CB 1 1 1 452 1 1 34 GLN CD C -2.962 6.129 -1.260 1.00 . A A . 34 GLN CD 1 1 1 453 1 1 34 GLN CG C -2.655 4.651 -1.126 1.00 . A A . 34 GLN CG 1 1 1 454 1 1 34 GLN H H 0.738 2.770 -2.774 1.00 . A A . 34 GLN H 1 1 1 455 1 1 34 GLN HA H -0.827 2.637 -0.284 1.00 . A A . 34 GLN HA 1 1 1 456 1 1 34 GLN HB2 H -0.578 4.956 -0.935 1.00 . A A . 34 GLN HB2 1 1 1 457 1 1 34 GLN HB3 H -1.103 4.585 -2.563 1.00 . A A . 34 GLN HB3 1 1 1 458 1 1 34 GLN HE21 H -2.408 6.456 0.607 1.00 . A A . 34 GLN HE21 1 1 1 459 1 1 34 GLN HE22 H -2.954 7.822 -0.281 1.00 . A A . 34 GLN HE22 1 1 1 460 1 1 34 GLN HG2 H -3.329 4.095 -1.760 1.00 . A A . 34 GLN HG2 1 1 1 461 1 1 34 GLN HG3 H -2.807 4.358 -0.096 1.00 . A A . 34 GLN HG3 1 1 1 462 1 1 34 GLN N N 0.567 2.746 -1.804 1.00 . A A . 34 GLN N 1 1 1 463 1 1 34 GLN NE2 N -2.756 6.864 -0.217 1.00 . A A . 34 GLN NE2 1 1 1 464 1 1 34 GLN O O -1.545 1.682 -3.285 1.00 . A A . 34 GLN O 1 1 1 465 1 1 34 GLN OE1 O -3.388 6.602 -2.301 1.00 . A A . 34 GLN OE1 1 1 1 466 1 1 35 CYS C C -4.751 1.334 -2.659 1.00 . A A . 35 CYS C 1 1 1 467 1 1 35 CYS CA C -3.680 0.491 -1.990 1.00 . A A . 35 CYS CA 1 1 1 468 1 1 35 CYS CB C -4.333 -0.418 -0.960 1.00 . A A . 35 CYS CB 1 1 1 469 1 1 35 CYS H H -2.752 1.492 -0.411 1.00 . A A . 35 CYS H 1 1 1 470 1 1 35 CYS HA H -3.184 -0.114 -2.733 1.00 . A A . 35 CYS HA 1 1 1 471 1 1 35 CYS HB2 H -4.957 0.151 -0.291 1.00 . A A . 35 CYS HB2 1 1 1 472 1 1 35 CYS HB3 H -4.961 -1.100 -1.505 1.00 . A A . 35 CYS HB3 1 1 1 473 1 1 35 CYS N N -2.697 1.350 -1.380 1.00 . A A . 35 CYS N 1 1 1 474 1 1 35 CYS O O -5.556 1.995 -1.981 1.00 . A A . 35 CYS O 1 1 1 475 1 1 35 CYS SG S -3.184 -1.412 0.027 1.00 . A A . 35 CYS SG 1 1 1 476 1 1 36 LEU C C -6.572 1.079 -5.467 1.00 . A A . 36 LEU C 1 1 1 477 1 1 36 LEU CA C -5.683 2.056 -4.753 1.00 . A A . 36 LEU CA 1 1 1 478 1 1 36 LEU CB C -4.969 2.983 -5.739 1.00 . A A . 36 LEU CB 1 1 1 479 1 1 36 LEU CD1 C -3.474 4.956 -6.160 1.00 . A A . 36 LEU CD1 1 1 1 480 1 1 36 LEU CD2 C -5.150 5.021 -4.315 1.00 . A A . 36 LEU CD2 1 1 1 481 1 1 36 LEU CG C -4.200 4.139 -5.104 1.00 . A A . 36 LEU CG 1 1 1 482 1 1 36 LEU H H -4.037 0.819 -4.414 1.00 . A A . 36 LEU H 1 1 1 483 1 1 36 LEU HA H -6.296 2.649 -4.092 1.00 . A A . 36 LEU HA 1 1 1 484 1 1 36 LEU HB2 H -4.275 2.391 -6.318 1.00 . A A . 36 LEU HB2 1 1 1 485 1 1 36 LEU HB3 H -5.705 3.401 -6.408 1.00 . A A . 36 LEU HB3 1 1 1 486 1 1 36 LEU HD11 H -2.778 4.324 -6.688 1.00 . A A . 36 LEU HD11 1 1 1 487 1 1 36 LEU HD12 H -2.940 5.765 -5.685 1.00 . A A . 36 LEU HD12 1 1 1 488 1 1 36 LEU HD13 H -4.194 5.360 -6.857 1.00 . A A . 36 LEU HD13 1 1 1 489 1 1 36 LEU HD21 H -5.589 4.459 -3.503 1.00 . A A . 36 LEU HD21 1 1 1 490 1 1 36 LEU HD22 H -5.935 5.377 -4.965 1.00 . A A . 36 LEU HD22 1 1 1 491 1 1 36 LEU HD23 H -4.609 5.865 -3.914 1.00 . A A . 36 LEU HD23 1 1 1 492 1 1 36 LEU HG H -3.463 3.744 -4.420 1.00 . A A . 36 LEU HG 1 1 1 493 1 1 36 LEU N N -4.736 1.339 -3.952 1.00 . A A . 36 LEU N 1 1 1 494 1 1 36 LEU O O -6.057 0.290 -6.283 1.00 . A A . 36 LEU O 1 1 1 495 1 1 36 LEU OXT O -7.781 1.078 -5.214 1.00 . A A . 36 LEU OXT 1 1 1 496 2 2 1 MAN C1 C 9.822 -5.313 7.225 1.00 . B A . 101 MAN C1 1 1 1 497 2 2 1 MAN C2 C 11.293 -4.998 6.944 1.00 . B A . 101 MAN C2 1 1 1 498 2 2 1 MAN C3 C 11.399 -3.863 5.924 1.00 . B A . 101 MAN C3 1 1 1 499 2 2 1 MAN C4 C 10.667 -4.250 4.644 1.00 . B A . 101 MAN C4 1 1 1 500 2 2 1 MAN C5 C 9.209 -4.624 4.969 1.00 . B A . 101 MAN C5 1 1 1 501 2 2 1 MAN C6 C 8.464 -5.194 3.762 1.00 . B A . 101 MAN C6 1 1 1 502 2 2 1 MAN H1 H 9.811 -6.214 7.855 1.00 . B A . 101 MAN H1 1 1 1 503 2 2 1 MAN H2 H 11.794 -4.678 7.871 1.00 . B A . 101 MAN H2 1 1 1 504 2 2 1 MAN H3 H 10.943 -2.949 6.331 1.00 . B A . 101 MAN H3 1 1 1 505 2 2 1 MAN H4 H 11.151 -5.116 4.173 1.00 . B A . 101 MAN H4 1 1 1 506 2 2 1 MAN H5 H 8.674 -3.737 5.338 1.00 . B A . 101 MAN H5 1 1 1 507 2 2 1 MAN H61 H 7.437 -5.384 4.101 1.00 . B A . 101 MAN H61 1 1 1 508 2 2 1 MAN H62 H 8.908 -6.152 3.456 1.00 . B A . 101 MAN H62 1 1 1 509 2 2 1 MAN HO2 H 11.413 -6.441 5.644 1.00 . B A . 101 MAN HO2 1 1 1 510 2 2 1 MAN HO3 H 13.129 -4.493 5.328 1.00 . B A . 101 MAN HO3 1 1 1 511 2 2 1 MAN HO4 H 10.148 -3.432 2.985 1.00 . B A . 101 MAN HO4 1 1 1 512 2 2 1 MAN HO6 H 7.747 -3.596 2.946 1.00 . B A . 101 MAN HO6 1 1 1 513 2 2 1 MAN O2 O 11.927 -6.156 6.413 1.00 . B A . 101 MAN O2 1 1 1 514 2 2 1 MAN O3 O 12.762 -3.650 5.610 1.00 . B A . 101 MAN O3 1 1 1 515 2 2 1 MAN O4 O 10.693 -3.152 3.733 1.00 . B A . 101 MAN O4 1 1 1 516 2 2 1 MAN O5 O 9.169 -5.648 5.994 1.00 . B A . 101 MAN O5 1 1 1 517 2 2 1 MAN O6 O 8.407 -4.256 2.692 1.00 . B A . 101 MAN O6 1 1 2 518 1 1 1 THR C C -5.439 -5.906 4.428 1.00 . A A . 1 THR C 1 1 2 519 1 1 1 THR CA C -5.534 -7.406 4.170 1.00 . A A . 1 THR CA 1 1 2 520 1 1 1 THR CB C -6.157 -7.714 2.795 1.00 . A A . 1 THR CB 1 1 2 521 1 1 1 THR CG2 C -5.798 -9.120 2.344 1.00 . A A . 1 THR CG2 1 1 2 522 1 1 1 THR H1 H -6.370 -9.064 5.111 1.00 . A A . 1 THR H1 1 1 2 523 1 1 1 THR H2 H -7.259 -7.625 5.177 1.00 . A A . 1 THR H2 1 1 2 524 1 1 1 THR H3 H -5.885 -7.798 6.149 1.00 . A A . 1 THR H3 1 1 2 525 1 1 1 THR HA H -4.531 -7.808 4.207 1.00 . A A . 1 THR HA 1 1 2 526 1 1 1 THR HB H -5.777 -7.003 2.076 1.00 . A A . 1 THR HB 1 1 2 527 1 1 1 THR HG1 H -7.984 -8.011 2.103 1.00 . A A . 1 THR HG1 1 1 2 528 1 1 1 THR HG21 H -4.725 -9.214 2.268 1.00 . A A . 1 THR HG21 1 1 2 529 1 1 1 THR HG22 H -6.244 -9.316 1.381 1.00 . A A . 1 THR HG22 1 1 2 530 1 1 1 THR HG23 H -6.171 -9.833 3.064 1.00 . A A . 1 THR HG23 1 1 2 531 1 1 1 THR N N -6.304 -8.034 5.228 1.00 . A A . 1 THR N 1 1 2 532 1 1 1 THR O O -6.167 -5.380 5.278 1.00 . A A . 1 THR O 1 1 2 533 1 1 1 THR OG1 O -7.584 -7.584 2.872 1.00 . A A . 1 THR OG1 1 1 2 534 1 1 2 GLN C C -5.379 -2.940 3.314 1.00 . A A . 2 GLN C 1 1 2 535 1 1 2 GLN CA C -4.295 -3.833 3.977 1.00 . A A . 2 GLN CA 1 1 2 536 1 1 2 GLN CB C -2.845 -3.491 3.548 1.00 . A A . 2 GLN CB 1 1 2 537 1 1 2 GLN CD C -2.718 -0.984 4.085 1.00 . A A . 2 GLN CD 1 1 2 538 1 1 2 GLN CG C -2.183 -2.368 4.369 1.00 . A A . 2 GLN CG 1 1 2 539 1 1 2 GLN H H -4.071 -5.665 2.981 1.00 . A A . 2 GLN H 1 1 2 540 1 1 2 GLN HA H -4.379 -3.710 5.047 1.00 . A A . 2 GLN HA 1 1 2 541 1 1 2 GLN HB2 H -2.245 -4.383 3.656 1.00 . A A . 2 GLN HB2 1 1 2 542 1 1 2 GLN HB3 H -2.849 -3.205 2.508 1.00 . A A . 2 GLN HB3 1 1 2 543 1 1 2 GLN HE21 H -2.931 -1.406 2.167 1.00 . A A . 2 GLN HE21 1 1 2 544 1 1 2 GLN HE22 H -3.420 0.155 2.660 1.00 . A A . 2 GLN HE22 1 1 2 545 1 1 2 GLN HG2 H -2.356 -2.574 5.415 1.00 . A A . 2 GLN HG2 1 1 2 546 1 1 2 GLN HG3 H -1.117 -2.380 4.187 1.00 . A A . 2 GLN HG3 1 1 2 547 1 1 2 GLN N N -4.557 -5.226 3.719 1.00 . A A . 2 GLN N 1 1 2 548 1 1 2 GLN NE2 N -3.044 -0.724 2.863 1.00 . A A . 2 GLN NE2 1 1 2 549 1 1 2 GLN O O -5.780 -3.160 2.157 1.00 . A A . 2 GLN O 1 1 2 550 1 1 2 GLN OE1 O -2.781 -0.135 4.965 1.00 . A A . 2 GLN OE1 1 1 2 551 1 1 3 SER C C -6.719 -0.180 2.511 1.00 . A A . 3 SER C 1 1 2 552 1 1 3 SER CA C -6.946 -1.072 3.766 1.00 . A A . 3 SER CA 1 1 2 553 1 1 3 SER CB C -7.166 -0.182 4.984 1.00 . A A . 3 SER CB 1 1 2 554 1 1 3 SER H H -5.425 -1.849 4.965 1.00 . A A . 3 SER H 1 1 2 555 1 1 3 SER HA H -7.841 -1.659 3.634 1.00 . A A . 3 SER HA 1 1 2 556 1 1 3 SER HB2 H -6.344 0.514 5.071 1.00 . A A . 3 SER HB2 1 1 2 557 1 1 3 SER HB3 H -8.091 0.363 4.874 1.00 . A A . 3 SER HB3 1 1 2 558 1 1 3 SER HG H -8.158 -1.219 6.289 1.00 . A A . 3 SER HG 1 1 2 559 1 1 3 SER N N -5.842 -1.976 4.086 1.00 . A A . 3 SER N 1 1 2 560 1 1 3 SER O O -5.583 0.139 2.120 1.00 . A A . 3 SER O 1 1 2 561 1 1 3 SER OG O -7.233 -0.969 6.171 1.00 . A A . 3 SER OG 1 1 2 562 1 1 4 HIS C C -7.306 2.482 1.217 1.00 . A A . 4 HIS C 1 1 2 563 1 1 4 HIS CA C -7.826 1.125 0.765 1.00 . A A . 4 HIS CA 1 1 2 564 1 1 4 HIS CB C -9.264 1.253 0.224 1.00 . A A . 4 HIS CB 1 1 2 565 1 1 4 HIS CD2 C -8.477 2.103 -2.104 1.00 . A A . 4 HIS CD2 1 1 2 566 1 1 4 HIS CE1 C -10.410 2.629 -2.935 1.00 . A A . 4 HIS CE1 1 1 2 567 1 1 4 HIS CG C -9.393 1.878 -1.144 1.00 . A A . 4 HIS CG 1 1 2 568 1 1 4 HIS H H -8.686 -0.023 2.300 1.00 . A A . 4 HIS H 1 1 2 569 1 1 4 HIS HA H -7.180 0.712 0.005 1.00 . A A . 4 HIS HA 1 1 2 570 1 1 4 HIS HB2 H -9.710 0.271 0.172 1.00 . A A . 4 HIS HB2 1 1 2 571 1 1 4 HIS HB3 H -9.835 1.852 0.917 1.00 . A A . 4 HIS HB3 1 1 2 572 1 1 4 HIS HD1 H -11.466 2.175 -1.237 1.00 . A A . 4 HIS HD1 1 1 2 573 1 1 4 HIS HD2 H -7.411 1.949 -2.014 1.00 . A A . 4 HIS HD2 1 1 2 574 1 1 4 HIS HE1 H -11.181 2.956 -3.616 1.00 . A A . 4 HIS HE1 1 1 2 575 1 1 4 HIS HE2 H -8.808 2.225 -4.089 1.00 . A A . 4 HIS HE2 1 1 2 576 1 1 4 HIS N N -7.823 0.250 1.920 1.00 . A A . 4 HIS N 1 1 2 577 1 1 4 HIS ND1 N -10.594 2.227 -1.692 1.00 . A A . 4 HIS ND1 1 1 2 578 1 1 4 HIS NE2 N -9.126 2.559 -3.208 1.00 . A A . 4 HIS NE2 1 1 2 579 1 1 4 HIS O O -7.711 2.971 2.262 1.00 . A A . 4 HIS O 1 1 2 580 1 1 5 TYR C C -4.687 4.194 1.880 1.00 . A A . 5 TYR C 1 1 2 581 1 1 5 TYR CA C -5.711 4.318 0.760 1.00 . A A . 5 TYR CA 1 1 2 582 1 1 5 TYR CB C -6.685 5.488 0.999 1.00 . A A . 5 TYR CB 1 1 2 583 1 1 5 TYR CD1 C -8.596 5.569 -0.654 1.00 . A A . 5 TYR CD1 1 1 2 584 1 1 5 TYR CD2 C -6.694 6.941 -1.050 1.00 . A A . 5 TYR CD2 1 1 2 585 1 1 5 TYR CE1 C -9.184 6.057 -1.805 1.00 . A A . 5 TYR CE1 1 1 2 586 1 1 5 TYR CE2 C -7.271 7.430 -2.196 1.00 . A A . 5 TYR CE2 1 1 2 587 1 1 5 TYR CG C -7.342 6.005 -0.258 1.00 . A A . 5 TYR CG 1 1 2 588 1 1 5 TYR CZ C -8.514 6.987 -2.571 1.00 . A A . 5 TYR CZ 1 1 2 589 1 1 5 TYR H H -6.091 2.595 -0.378 1.00 . A A . 5 TYR H 1 1 2 590 1 1 5 TYR HA H -5.137 4.536 -0.130 1.00 . A A . 5 TYR HA 1 1 2 591 1 1 5 TYR HB2 H -7.468 5.163 1.669 1.00 . A A . 5 TYR HB2 1 1 2 592 1 1 5 TYR HB3 H -6.148 6.305 1.458 1.00 . A A . 5 TYR HB3 1 1 2 593 1 1 5 TYR HD1 H -9.114 4.840 -0.049 1.00 . A A . 5 TYR HD1 1 1 2 594 1 1 5 TYR HD2 H -5.714 7.288 -0.754 1.00 . A A . 5 TYR HD2 1 1 2 595 1 1 5 TYR HE1 H -10.162 5.709 -2.101 1.00 . A A . 5 TYR HE1 1 1 2 596 1 1 5 TYR HE2 H -6.747 8.158 -2.796 1.00 . A A . 5 TYR HE2 1 1 2 597 1 1 5 TYR HH H -10.013 7.690 -3.500 1.00 . A A . 5 TYR HH 1 1 2 598 1 1 5 TYR N N -6.377 3.042 0.450 1.00 . A A . 5 TYR N 1 1 2 599 1 1 5 TYR O O -4.095 5.181 2.303 1.00 . A A . 5 TYR O 1 1 2 600 1 1 5 TYR OH O -9.094 7.479 -3.720 1.00 . A A . 5 TYR OH 1 1 2 601 1 1 6 GLY C C -2.101 2.442 2.651 1.00 . A A . 6 GLY C 1 1 2 602 1 1 6 GLY CA C -3.427 2.776 3.296 1.00 . A A . 6 GLY CA 1 1 2 603 1 1 6 GLY H H -4.933 2.226 1.942 1.00 . A A . 6 GLY H 1 1 2 604 1 1 6 GLY HA2 H -3.328 3.680 3.879 1.00 . A A . 6 GLY HA2 1 1 2 605 1 1 6 GLY HA3 H -3.721 1.961 3.940 1.00 . A A . 6 GLY HA3 1 1 2 606 1 1 6 GLY N N -4.431 2.987 2.302 1.00 . A A . 6 GLY N 1 1 2 607 1 1 6 GLY O O -2.067 2.054 1.461 1.00 . A A . 6 GLY O 1 1 2 608 1 1 7 GLN C C 0.466 0.755 2.898 1.00 . A A . 7 GLN C 1 1 2 609 1 1 7 GLN CA C 0.312 2.269 2.936 1.00 . A A . 7 GLN CA 1 1 2 610 1 1 7 GLN CB C 1.371 2.918 3.832 1.00 . A A . 7 GLN CB 1 1 2 611 1 1 7 GLN CD C 3.791 3.359 4.377 1.00 . A A . 7 GLN CD 1 1 2 612 1 1 7 GLN CG C 2.828 2.617 3.461 1.00 . A A . 7 GLN CG 1 1 2 613 1 1 7 GLN H H -1.146 2.971 4.303 1.00 . A A . 7 GLN H 1 1 2 614 1 1 7 GLN HA H 0.412 2.646 1.929 1.00 . A A . 7 GLN HA 1 1 2 615 1 1 7 GLN HB2 H 1.239 3.990 3.799 1.00 . A A . 7 GLN HB2 1 1 2 616 1 1 7 GLN HB3 H 1.208 2.586 4.846 1.00 . A A . 7 GLN HB3 1 1 2 617 1 1 7 GLN HE21 H 5.205 3.547 2.953 1.00 . A A . 7 GLN HE21 1 1 2 618 1 1 7 GLN HE22 H 5.541 4.224 4.487 1.00 . A A . 7 GLN HE22 1 1 2 619 1 1 7 GLN HG2 H 2.984 1.556 3.590 1.00 . A A . 7 GLN HG2 1 1 2 620 1 1 7 GLN HG3 H 3.023 2.872 2.431 1.00 . A A . 7 GLN HG3 1 1 2 621 1 1 7 GLN N N -1.026 2.607 3.398 1.00 . A A . 7 GLN N 1 1 2 622 1 1 7 GLN NE2 N 4.944 3.732 3.883 1.00 . A A . 7 GLN NE2 1 1 2 623 1 1 7 GLN O O 0.439 0.093 3.930 1.00 . A A . 7 GLN O 1 1 2 624 1 1 7 GLN OE1 O 3.480 3.609 5.533 1.00 . A A . 7 GLN OE1 1 1 2 625 1 1 8 CYS C C 2.022 -1.814 1.601 1.00 . A A . 8 CYS C 1 1 2 626 1 1 8 CYS CA C 0.647 -1.200 1.491 1.00 . A A . 8 CYS CA 1 1 2 627 1 1 8 CYS CB C 0.046 -1.531 0.144 1.00 . A A . 8 CYS CB 1 1 2 628 1 1 8 CYS H H 0.674 0.841 0.943 1.00 . A A . 8 CYS H 1 1 2 629 1 1 8 CYS HA H 0.024 -1.668 2.237 1.00 . A A . 8 CYS HA 1 1 2 630 1 1 8 CYS HB2 H 0.240 -2.568 -0.084 1.00 . A A . 8 CYS HB2 1 1 2 631 1 1 8 CYS HB3 H -1.020 -1.368 0.178 1.00 . A A . 8 CYS HB3 1 1 2 632 1 1 8 CYS N N 0.609 0.233 1.711 1.00 . A A . 8 CYS N 1 1 2 633 1 1 8 CYS O O 2.156 -2.891 2.123 1.00 . A A . 8 CYS O 1 1 2 634 1 1 8 CYS SG S 0.717 -0.529 -1.224 1.00 . A A . 8 CYS SG 1 1 2 635 1 1 9 GLY C C 5.401 -1.056 0.494 1.00 . A A . 9 GLY C 1 1 2 636 1 1 9 GLY CA C 4.321 -1.820 1.148 1.00 . A A . 9 GLY CA 1 1 2 637 1 1 9 GLY H H 2.946 -0.245 0.781 1.00 . A A . 9 GLY H 1 1 2 638 1 1 9 GLY HA2 H 4.616 -2.001 2.168 1.00 . A A . 9 GLY HA2 1 1 2 639 1 1 9 GLY HA3 H 4.217 -2.771 0.647 1.00 . A A . 9 GLY HA3 1 1 2 640 1 1 9 GLY N N 3.045 -1.156 1.126 1.00 . A A . 9 GLY N 1 1 2 641 1 1 9 GLY O O 5.804 -1.372 -0.623 1.00 . A A . 9 GLY O 1 1 2 642 1 1 10 GLY C C 8.141 0.436 1.559 1.00 . A A . 10 GLY C 1 1 2 643 1 1 10 GLY CA C 6.961 0.700 0.681 1.00 . A A . 10 GLY CA 1 1 2 644 1 1 10 GLY H H 5.474 0.164 2.037 1.00 . A A . 10 GLY H 1 1 2 645 1 1 10 GLY HA2 H 7.182 0.406 -0.335 1.00 . A A . 10 GLY HA2 1 1 2 646 1 1 10 GLY HA3 H 6.728 1.754 0.717 1.00 . A A . 10 GLY HA3 1 1 2 647 1 1 10 GLY N N 5.855 -0.053 1.163 1.00 . A A . 10 GLY N 1 1 2 648 1 1 10 GLY O O 7.989 -0.218 2.602 1.00 . A A . 10 GLY O 1 1 2 649 1 1 11 ILE C C 10.295 1.409 3.327 1.00 . A A . 11 ILE C 1 1 2 650 1 1 11 ILE CA C 10.503 0.768 1.956 1.00 . A A . 11 ILE CA 1 1 2 651 1 1 11 ILE CB C 11.717 1.418 1.243 1.00 . A A . 11 ILE CB 1 1 2 652 1 1 11 ILE CD1 C 13.075 1.355 -0.923 1.00 . A A . 11 ILE CD1 1 1 2 653 1 1 11 ILE CG1 C 11.951 0.747 -0.117 1.00 . A A . 11 ILE CG1 1 1 2 654 1 1 11 ILE CG2 C 12.973 1.338 2.111 1.00 . A A . 11 ILE CG2 1 1 2 655 1 1 11 ILE H H 9.337 1.416 0.322 1.00 . A A . 11 ILE H 1 1 2 656 1 1 11 ILE HA H 10.688 -0.289 2.084 1.00 . A A . 11 ILE HA 1 1 2 657 1 1 11 ILE HB H 11.487 2.460 1.077 1.00 . A A . 11 ILE HB 1 1 2 658 1 1 11 ILE HD11 H 13.173 0.835 -1.864 1.00 . A A . 11 ILE HD11 1 1 2 659 1 1 11 ILE HD12 H 13.999 1.271 -0.369 1.00 . A A . 11 ILE HD12 1 1 2 660 1 1 11 ILE HD13 H 12.859 2.396 -1.107 1.00 . A A . 11 ILE HD13 1 1 2 661 1 1 11 ILE HG12 H 12.186 -0.296 0.040 1.00 . A A . 11 ILE HG12 1 1 2 662 1 1 11 ILE HG13 H 11.046 0.815 -0.702 1.00 . A A . 11 ILE HG13 1 1 2 663 1 1 11 ILE HG21 H 12.799 1.861 3.039 1.00 . A A . 11 ILE HG21 1 1 2 664 1 1 11 ILE HG22 H 13.806 1.785 1.590 1.00 . A A . 11 ILE HG22 1 1 2 665 1 1 11 ILE HG23 H 13.191 0.301 2.319 1.00 . A A . 11 ILE HG23 1 1 2 666 1 1 11 ILE N N 9.293 0.921 1.168 1.00 . A A . 11 ILE N 1 1 2 667 1 1 11 ILE O O 9.924 2.574 3.424 1.00 . A A . 11 ILE O 1 1 2 668 1 1 12 GLY C C 9.037 0.498 6.313 1.00 . A A . 12 GLY C 1 1 2 669 1 1 12 GLY CA C 10.251 1.138 5.693 1.00 . A A . 12 GLY CA 1 1 2 670 1 1 12 GLY H H 10.748 -0.299 4.231 1.00 . A A . 12 GLY H 1 1 2 671 1 1 12 GLY HA2 H 11.119 0.951 6.308 1.00 . A A . 12 GLY HA2 1 1 2 672 1 1 12 GLY HA3 H 10.085 2.204 5.633 1.00 . A A . 12 GLY HA3 1 1 2 673 1 1 12 GLY N N 10.471 0.634 4.364 1.00 . A A . 12 GLY N 1 1 2 674 1 1 12 GLY O O 8.949 0.346 7.533 1.00 . A A . 12 GLY O 1 1 2 675 1 1 13 TYR C C 7.043 -2.066 5.721 1.00 . A A . 13 TYR C 1 1 2 676 1 1 13 TYR CA C 6.909 -0.568 5.917 1.00 . A A . 13 TYR CA 1 1 2 677 1 1 13 TYR CB C 5.691 -0.023 5.126 1.00 . A A . 13 TYR CB 1 1 2 678 1 1 13 TYR CD1 C 3.567 -0.139 6.516 1.00 . A A . 13 TYR CD1 1 1 2 679 1 1 13 TYR CD2 C 3.870 -1.759 4.813 1.00 . A A . 13 TYR CD2 1 1 2 680 1 1 13 TYR CE1 C 2.351 -0.717 6.845 1.00 . A A . 13 TYR CE1 1 1 2 681 1 1 13 TYR CE2 C 2.668 -2.337 5.132 1.00 . A A . 13 TYR CE2 1 1 2 682 1 1 13 TYR CG C 4.346 -0.652 5.495 1.00 . A A . 13 TYR CG 1 1 2 683 1 1 13 TYR CZ C 1.911 -1.821 6.144 1.00 . A A . 13 TYR CZ 1 1 2 684 1 1 13 TYR H H 8.276 0.165 4.507 1.00 . A A . 13 TYR H 1 1 2 685 1 1 13 TYR HA H 6.775 -0.352 6.966 1.00 . A A . 13 TYR HA 1 1 2 686 1 1 13 TYR HB2 H 5.609 1.041 5.292 1.00 . A A . 13 TYR HB2 1 1 2 687 1 1 13 TYR HB3 H 5.861 -0.197 4.074 1.00 . A A . 13 TYR HB3 1 1 2 688 1 1 13 TYR HD1 H 3.919 0.725 7.059 1.00 . A A . 13 TYR HD1 1 1 2 689 1 1 13 TYR HD2 H 4.468 -2.177 4.020 1.00 . A A . 13 TYR HD2 1 1 2 690 1 1 13 TYR HE1 H 1.756 -0.304 7.645 1.00 . A A . 13 TYR HE1 1 1 2 691 1 1 13 TYR HE2 H 2.324 -3.202 4.583 1.00 . A A . 13 TYR HE2 1 1 2 692 1 1 13 TYR HH H 0.651 -3.227 5.944 1.00 . A A . 13 TYR HH 1 1 2 693 1 1 13 TYR N N 8.123 0.072 5.476 1.00 . A A . 13 TYR N 1 1 2 694 1 1 13 TYR O O 7.763 -2.515 4.819 1.00 . A A . 13 TYR O 1 1 2 695 1 1 13 TYR OH O 0.692 -2.399 6.441 1.00 . A A . 13 TYR OH 1 1 2 696 1 1 14 SER C C 5.200 -4.837 7.225 1.00 . A A . 14 SER C 1 1 2 697 1 1 14 SER CA C 6.374 -4.262 6.455 1.00 . A A . 14 SER CA 1 1 2 698 1 1 14 SER CB C 7.721 -4.880 6.847 1.00 . A A . 14 SER CB 1 1 2 699 1 1 14 SER H H 5.951 -2.437 7.354 1.00 . A A . 14 SER H 1 1 2 700 1 1 14 SER HA H 6.194 -4.456 5.407 1.00 . A A . 14 SER HA 1 1 2 701 1 1 14 SER HB2 H 7.597 -5.949 6.934 1.00 . A A . 14 SER HB2 1 1 2 702 1 1 14 SER HB3 H 8.432 -4.665 6.064 1.00 . A A . 14 SER HB3 1 1 2 703 1 1 14 SER N N 6.411 -2.829 6.580 1.00 . A A . 14 SER N 1 1 2 704 1 1 14 SER O O 4.678 -4.190 8.154 1.00 . A A . 14 SER O 1 1 2 705 1 1 14 SER OG O 8.218 -4.356 8.110 1.00 . A A . 14 SER OG 1 1 2 706 1 1 15 GLY C C 2.550 -6.925 6.417 1.00 . A A . 15 GLY C 1 1 2 707 1 1 15 GLY CA C 3.613 -6.623 7.455 1.00 . A A . 15 GLY CA 1 1 2 708 1 1 15 GLY H H 5.205 -6.476 6.095 1.00 . A A . 15 GLY H 1 1 2 709 1 1 15 GLY HA2 H 3.924 -7.532 7.948 1.00 . A A . 15 GLY HA2 1 1 2 710 1 1 15 GLY HA3 H 3.210 -5.941 8.188 1.00 . A A . 15 GLY HA3 1 1 2 711 1 1 15 GLY N N 4.759 -6.004 6.833 1.00 . A A . 15 GLY N 1 1 2 712 1 1 15 GLY O O 2.833 -7.629 5.438 1.00 . A A . 15 GLY O 1 1 2 713 1 1 16 PRO C C 0.561 -5.740 4.357 1.00 . A A . 16 PRO C 1 1 2 714 1 1 16 PRO CA C 0.282 -6.592 5.581 1.00 . A A . 16 PRO CA 1 1 2 715 1 1 16 PRO CB C -1.012 -6.125 6.276 1.00 . A A . 16 PRO CB 1 1 2 716 1 1 16 PRO CD C 0.866 -5.560 7.673 1.00 . A A . 16 PRO CD 1 1 2 717 1 1 16 PRO CG C -0.620 -5.765 7.674 1.00 . A A . 16 PRO CG 1 1 2 718 1 1 16 PRO HA H 0.202 -7.627 5.285 1.00 . A A . 16 PRO HA 1 1 2 719 1 1 16 PRO HB2 H -1.408 -5.267 5.752 1.00 . A A . 16 PRO HB2 1 1 2 720 1 1 16 PRO HB3 H -1.740 -6.922 6.264 1.00 . A A . 16 PRO HB3 1 1 2 721 1 1 16 PRO HD2 H 1.089 -4.520 7.483 1.00 . A A . 16 PRO HD2 1 1 2 722 1 1 16 PRO HD3 H 1.286 -5.883 8.614 1.00 . A A . 16 PRO HD3 1 1 2 723 1 1 16 PRO HG2 H -1.120 -4.855 7.970 1.00 . A A . 16 PRO HG2 1 1 2 724 1 1 16 PRO HG3 H -0.889 -6.564 8.350 1.00 . A A . 16 PRO HG3 1 1 2 725 1 1 16 PRO N N 1.324 -6.395 6.564 1.00 . A A . 16 PRO N 1 1 2 726 1 1 16 PRO O O 0.379 -4.522 4.385 1.00 . A A . 16 PRO O 1 1 2 727 1 1 17 THR C C 0.379 -5.888 1.056 1.00 . A A . 17 THR C 1 1 2 728 1 1 17 THR CA C 1.438 -5.702 2.123 1.00 . A A . 17 THR CA 1 1 2 729 1 1 17 THR CB C 2.786 -6.229 1.630 1.00 . A A . 17 THR CB 1 1 2 730 1 1 17 THR CG2 C 3.922 -5.651 2.455 1.00 . A A . 17 THR CG2 1 1 2 731 1 1 17 THR H H 1.303 -7.322 3.396 1.00 . A A . 17 THR H 1 1 2 732 1 1 17 THR HA H 1.548 -4.647 2.325 1.00 . A A . 17 THR HA 1 1 2 733 1 1 17 THR HB H 2.910 -5.942 0.597 1.00 . A A . 17 THR HB 1 1 2 734 1 1 17 THR HG1 H 3.382 -8.010 1.039 1.00 . A A . 17 THR HG1 1 1 2 735 1 1 17 THR HG21 H 3.798 -5.941 3.487 1.00 . A A . 17 THR HG21 1 1 2 736 1 1 17 THR HG22 H 3.898 -4.572 2.382 1.00 . A A . 17 THR HG22 1 1 2 737 1 1 17 THR HG23 H 4.864 -6.021 2.081 1.00 . A A . 17 THR HG23 1 1 2 738 1 1 17 THR N N 1.087 -6.365 3.341 1.00 . A A . 17 THR N 1 1 2 739 1 1 17 THR O O 0.296 -5.118 0.084 1.00 . A A . 17 THR O 1 1 2 740 1 1 17 THR OG1 O 2.796 -7.671 1.725 1.00 . A A . 17 THR OG1 1 1 2 741 1 1 18 VAL C C -2.708 -6.440 0.633 1.00 . A A . 18 VAL C 1 1 2 742 1 1 18 VAL CA C -1.457 -7.218 0.297 1.00 . A A . 18 VAL CA 1 1 2 743 1 1 18 VAL CB C -1.748 -8.731 0.289 1.00 . A A . 18 VAL CB 1 1 2 744 1 1 18 VAL CG1 C -2.813 -9.085 -0.736 1.00 . A A . 18 VAL CG1 1 1 2 745 1 1 18 VAL CG2 C -0.475 -9.491 0.005 1.00 . A A . 18 VAL CG2 1 1 2 746 1 1 18 VAL H H -0.302 -7.449 2.035 1.00 . A A . 18 VAL H 1 1 2 747 1 1 18 VAL HA H -1.116 -6.924 -0.685 1.00 . A A . 18 VAL HA 1 1 2 748 1 1 18 VAL HB H -2.100 -9.019 1.268 1.00 . A A . 18 VAL HB 1 1 2 749 1 1 18 VAL HG11 H -3.729 -8.566 -0.498 1.00 . A A . 18 VAL HG11 1 1 2 750 1 1 18 VAL HG12 H -2.983 -10.151 -0.710 1.00 . A A . 18 VAL HG12 1 1 2 751 1 1 18 VAL HG13 H -2.477 -8.795 -1.720 1.00 . A A . 18 VAL HG13 1 1 2 752 1 1 18 VAL HG21 H -0.688 -10.548 -0.020 1.00 . A A . 18 VAL HG21 1 1 2 753 1 1 18 VAL HG22 H 0.248 -9.280 0.779 1.00 . A A . 18 VAL HG22 1 1 2 754 1 1 18 VAL HG23 H -0.076 -9.180 -0.949 1.00 . A A . 18 VAL HG23 1 1 2 755 1 1 18 VAL N N -0.422 -6.901 1.233 1.00 . A A . 18 VAL N 1 1 2 756 1 1 18 VAL O O -3.211 -6.508 1.761 1.00 . A A . 18 VAL O 1 1 2 757 1 1 19 CYS C C -5.620 -5.716 -0.270 1.00 . A A . 19 CYS C 1 1 2 758 1 1 19 CYS CA C -4.350 -4.882 -0.186 1.00 . A A . 19 CYS CA 1 1 2 759 1 1 19 CYS CB C -4.340 -3.833 -1.292 1.00 . A A . 19 CYS CB 1 1 2 760 1 1 19 CYS H H -2.750 -5.740 -1.205 1.00 . A A . 19 CYS H 1 1 2 761 1 1 19 CYS HA H -4.306 -4.377 0.768 1.00 . A A . 19 CYS HA 1 1 2 762 1 1 19 CYS HB2 H -4.480 -4.308 -2.252 1.00 . A A . 19 CYS HB2 1 1 2 763 1 1 19 CYS HB3 H -5.142 -3.128 -1.123 1.00 . A A . 19 CYS HB3 1 1 2 764 1 1 19 CYS N N -3.189 -5.716 -0.328 1.00 . A A . 19 CYS N 1 1 2 765 1 1 19 CYS O O -5.574 -6.908 -0.629 1.00 . A A . 19 CYS O 1 1 2 766 1 1 19 CYS SG S -2.799 -2.877 -1.371 1.00 . A A . 19 CYS SG 1 1 2 767 1 1 20 ALA C C -8.376 -5.981 -1.473 1.00 . A A . 20 ALA C 1 1 2 768 1 1 20 ALA CA C -8.025 -5.769 0.001 1.00 . A A . 20 ALA CA 1 1 2 769 1 1 20 ALA CB C -9.090 -4.932 0.697 1.00 . A A . 20 ALA CB 1 1 2 770 1 1 20 ALA H H -6.684 -4.206 0.461 1.00 . A A . 20 ALA H 1 1 2 771 1 1 20 ALA HA H -7.952 -6.728 0.494 1.00 . A A . 20 ALA HA 1 1 2 772 1 1 20 ALA HB1 H -8.808 -4.777 1.729 1.00 . A A . 20 ALA HB1 1 1 2 773 1 1 20 ALA HB2 H -10.039 -5.443 0.656 1.00 . A A . 20 ALA HB2 1 1 2 774 1 1 20 ALA HB3 H -9.173 -3.974 0.202 1.00 . A A . 20 ALA HB3 1 1 2 775 1 1 20 ALA N N -6.735 -5.119 0.101 1.00 . A A . 20 ALA N 1 1 2 776 1 1 20 ALA O O -7.946 -5.194 -2.331 1.00 . A A . 20 ALA O 1 1 2 777 1 1 21 SER C C -10.208 -6.163 -3.776 1.00 . A A . 21 SER C 1 1 2 778 1 1 21 SER CA C -9.499 -7.354 -3.128 1.00 . A A . 21 SER CA 1 1 2 779 1 1 21 SER CB C -10.397 -8.584 -3.126 1.00 . A A . 21 SER CB 1 1 2 780 1 1 21 SER H H -9.382 -7.655 -1.061 1.00 . A A . 21 SER H 1 1 2 781 1 1 21 SER HA H -8.602 -7.579 -3.685 1.00 . A A . 21 SER HA 1 1 2 782 1 1 21 SER HB2 H -11.323 -8.353 -2.621 1.00 . A A . 21 SER HB2 1 1 2 783 1 1 21 SER HB3 H -10.607 -8.882 -4.142 1.00 . A A . 21 SER HB3 1 1 2 784 1 1 21 SER HG H -8.935 -9.838 -2.942 1.00 . A A . 21 SER HG 1 1 2 785 1 1 21 SER N N -9.106 -7.039 -1.769 1.00 . A A . 21 SER N 1 1 2 786 1 1 21 SER O O -11.179 -5.621 -3.227 1.00 . A A . 21 SER O 1 1 2 787 1 1 21 SER OG O -9.754 -9.662 -2.455 1.00 . A A . 21 SER OG 1 1 2 788 1 1 22 GLY C C -9.334 -3.406 -5.498 1.00 . A A . 22 GLY C 1 1 2 789 1 1 22 GLY CA C -10.238 -4.603 -5.581 1.00 . A A . 22 GLY CA 1 1 2 790 1 1 22 GLY H H -8.887 -6.174 -5.246 1.00 . A A . 22 GLY H 1 1 2 791 1 1 22 GLY HA2 H -10.373 -4.870 -6.617 1.00 . A A . 22 GLY HA2 1 1 2 792 1 1 22 GLY HA3 H -11.195 -4.355 -5.147 1.00 . A A . 22 GLY HA3 1 1 2 793 1 1 22 GLY N N -9.683 -5.726 -4.883 1.00 . A A . 22 GLY N 1 1 2 794 1 1 22 GLY O O -9.492 -2.433 -6.245 1.00 . A A . 22 GLY O 1 1 2 795 1 1 23 THR C C -6.048 -2.907 -4.760 1.00 . A A . 23 THR C 1 1 2 796 1 1 23 THR CA C -7.440 -2.395 -4.442 1.00 . A A . 23 THR CA 1 1 2 797 1 1 23 THR CB C -7.507 -1.745 -3.029 1.00 . A A . 23 THR CB 1 1 2 798 1 1 23 THR CG2 C -8.903 -1.224 -2.769 1.00 . A A . 23 THR CG2 1 1 2 799 1 1 23 THR H H -8.288 -4.259 -4.025 1.00 . A A . 23 THR H 1 1 2 800 1 1 23 THR HA H -7.690 -1.651 -5.183 1.00 . A A . 23 THR HA 1 1 2 801 1 1 23 THR HB H -6.821 -0.912 -2.983 1.00 . A A . 23 THR HB 1 1 2 802 1 1 23 THR HG1 H -7.428 -3.580 -2.287 1.00 . A A . 23 THR HG1 1 1 2 803 1 1 23 THR HG21 H -8.952 -0.789 -1.782 1.00 . A A . 23 THR HG21 1 1 2 804 1 1 23 THR HG22 H -9.605 -2.041 -2.840 1.00 . A A . 23 THR HG22 1 1 2 805 1 1 23 THR HG23 H -9.151 -0.474 -3.506 1.00 . A A . 23 THR HG23 1 1 2 806 1 1 23 THR N N -8.380 -3.464 -4.595 1.00 . A A . 23 THR N 1 1 2 807 1 1 23 THR O O -5.718 -4.064 -4.460 1.00 . A A . 23 THR O 1 1 2 808 1 1 23 THR OG1 O -7.185 -2.687 -2.000 1.00 . A A . 23 THR OG1 1 1 2 809 1 1 24 THR C C -2.878 -1.682 -5.120 1.00 . A A . 24 THR C 1 1 2 810 1 1 24 THR CA C -3.961 -2.485 -5.830 1.00 . A A . 24 THR CA 1 1 2 811 1 1 24 THR CB C -3.854 -2.305 -7.362 1.00 . A A . 24 THR CB 1 1 2 812 1 1 24 THR CG2 C -4.720 -3.331 -8.087 1.00 . A A . 24 THR CG2 1 1 2 813 1 1 24 THR H H -5.567 -1.170 -5.579 1.00 . A A . 24 THR H 1 1 2 814 1 1 24 THR HA H -3.833 -3.533 -5.606 1.00 . A A . 24 THR HA 1 1 2 815 1 1 24 THR HB H -2.824 -2.446 -7.647 1.00 . A A . 24 THR HB 1 1 2 816 1 1 24 THR HG1 H -4.975 -0.641 -7.159 1.00 . A A . 24 THR HG1 1 1 2 817 1 1 24 THR HG21 H -4.627 -3.197 -9.154 1.00 . A A . 24 THR HG21 1 1 2 818 1 1 24 THR HG22 H -5.752 -3.195 -7.796 1.00 . A A . 24 THR HG22 1 1 2 819 1 1 24 THR HG23 H -4.406 -4.328 -7.818 1.00 . A A . 24 THR HG23 1 1 2 820 1 1 24 THR N N -5.267 -2.092 -5.391 1.00 . A A . 24 THR N 1 1 2 821 1 1 24 THR O O -3.050 -0.493 -4.875 1.00 . A A . 24 THR O 1 1 2 822 1 1 24 THR OG1 O -4.271 -0.969 -7.742 1.00 . A A . 24 THR OG1 1 1 2 823 1 1 25 CYS C C 0.127 -0.910 -5.139 1.00 . A A . 25 CYS C 1 1 2 824 1 1 25 CYS CA C -0.692 -1.644 -4.109 1.00 . A A . 25 CYS CA 1 1 2 825 1 1 25 CYS CB C 0.191 -2.638 -3.332 1.00 . A A . 25 CYS CB 1 1 2 826 1 1 25 CYS H H -1.675 -3.276 -4.986 1.00 . A A . 25 CYS H 1 1 2 827 1 1 25 CYS HA H -1.115 -0.928 -3.421 1.00 . A A . 25 CYS HA 1 1 2 828 1 1 25 CYS HB2 H -0.409 -3.159 -2.601 1.00 . A A . 25 CYS HB2 1 1 2 829 1 1 25 CYS HB3 H 0.604 -3.352 -4.028 1.00 . A A . 25 CYS HB3 1 1 2 830 1 1 25 CYS N N -1.784 -2.324 -4.775 1.00 . A A . 25 CYS N 1 1 2 831 1 1 25 CYS O O 0.883 -1.515 -5.900 1.00 . A A . 25 CYS O 1 1 2 832 1 1 25 CYS SG S 1.597 -1.878 -2.441 1.00 . A A . 25 CYS SG 1 1 2 833 1 1 26 GLN C C 1.739 1.962 -5.504 1.00 . A A . 26 GLN C 1 1 2 834 1 1 26 GLN CA C 0.641 1.158 -6.169 1.00 . A A . 26 GLN CA 1 1 2 835 1 1 26 GLN CB C -0.322 2.010 -7.001 1.00 . A A . 26 GLN CB 1 1 2 836 1 1 26 GLN CD C -2.231 1.930 -8.713 1.00 . A A . 26 GLN CD 1 1 2 837 1 1 26 GLN CG C -1.286 1.147 -7.823 1.00 . A A . 26 GLN CG 1 1 2 838 1 1 26 GLN H H -0.697 0.819 -4.605 1.00 . A A . 26 GLN H 1 1 2 839 1 1 26 GLN HA H 1.124 0.451 -6.826 1.00 . A A . 26 GLN HA 1 1 2 840 1 1 26 GLN HB2 H -0.895 2.644 -6.340 1.00 . A A . 26 GLN HB2 1 1 2 841 1 1 26 GLN HB3 H 0.246 2.626 -7.682 1.00 . A A . 26 GLN HB3 1 1 2 842 1 1 26 GLN HE21 H -3.587 0.496 -8.553 1.00 . A A . 26 GLN HE21 1 1 2 843 1 1 26 GLN HE22 H -4.037 1.805 -9.566 1.00 . A A . 26 GLN HE22 1 1 2 844 1 1 26 GLN HG2 H -0.706 0.491 -8.454 1.00 . A A . 26 GLN HG2 1 1 2 845 1 1 26 GLN HG3 H -1.872 0.549 -7.140 1.00 . A A . 26 GLN HG3 1 1 2 846 1 1 26 GLN N N -0.064 0.376 -5.215 1.00 . A A . 26 GLN N 1 1 2 847 1 1 26 GLN NE2 N -3.394 1.375 -8.963 1.00 . A A . 26 GLN NE2 1 1 2 848 1 1 26 GLN O O 1.493 2.761 -4.575 1.00 . A A . 26 GLN O 1 1 2 849 1 1 26 GLN OE1 O -1.913 3.029 -9.183 1.00 . A A . 26 GLN OE1 1 1 2 850 1 1 27 VAL C C 4.221 3.739 -6.010 1.00 . A A . 27 VAL C 1 1 2 851 1 1 27 VAL CA C 4.137 2.341 -5.436 1.00 . A A . 27 VAL CA 1 1 2 852 1 1 27 VAL CB C 5.415 1.530 -5.819 1.00 . A A . 27 VAL CB 1 1 2 853 1 1 27 VAL CG1 C 6.685 2.204 -5.318 1.00 . A A . 27 VAL CG1 1 1 2 854 1 1 27 VAL CG2 C 5.329 0.116 -5.278 1.00 . A A . 27 VAL CG2 1 1 2 855 1 1 27 VAL H H 3.051 1.028 -6.648 1.00 . A A . 27 VAL H 1 1 2 856 1 1 27 VAL HA H 4.068 2.401 -4.361 1.00 . A A . 27 VAL HA 1 1 2 857 1 1 27 VAL HB H 5.468 1.473 -6.897 1.00 . A A . 27 VAL HB 1 1 2 858 1 1 27 VAL HG11 H 6.647 2.283 -4.242 1.00 . A A . 27 VAL HG11 1 1 2 859 1 1 27 VAL HG12 H 6.766 3.190 -5.750 1.00 . A A . 27 VAL HG12 1 1 2 860 1 1 27 VAL HG13 H 7.544 1.614 -5.603 1.00 . A A . 27 VAL HG13 1 1 2 861 1 1 27 VAL HG21 H 5.272 0.151 -4.200 1.00 . A A . 27 VAL HG21 1 1 2 862 1 1 27 VAL HG22 H 6.204 -0.443 -5.575 1.00 . A A . 27 VAL HG22 1 1 2 863 1 1 27 VAL HG23 H 4.442 -0.363 -5.666 1.00 . A A . 27 VAL HG23 1 1 2 864 1 1 27 VAL N N 2.948 1.696 -5.937 1.00 . A A . 27 VAL N 1 1 2 865 1 1 27 VAL O O 4.484 3.918 -7.201 1.00 . A A . 27 VAL O 1 1 2 866 1 1 28 LEU C C 5.376 6.655 -5.389 1.00 . A A . 28 LEU C 1 1 2 867 1 1 28 LEU CA C 3.984 6.092 -5.611 1.00 . A A . 28 LEU CA 1 1 2 868 1 1 28 LEU CB C 2.926 6.901 -4.852 1.00 . A A . 28 LEU CB 1 1 2 869 1 1 28 LEU CD1 C 0.520 7.307 -4.223 1.00 . A A . 28 LEU CD1 1 1 2 870 1 1 28 LEU CD2 C 1.054 6.193 -6.396 1.00 . A A . 28 LEU CD2 1 1 2 871 1 1 28 LEU CG C 1.479 6.378 -4.946 1.00 . A A . 28 LEU CG 1 1 2 872 1 1 28 LEU H H 3.766 4.501 -4.246 1.00 . A A . 28 LEU H 1 1 2 873 1 1 28 LEU HA H 3.765 6.114 -6.668 1.00 . A A . 28 LEU HA 1 1 2 874 1 1 28 LEU HB2 H 3.209 6.931 -3.810 1.00 . A A . 28 LEU HB2 1 1 2 875 1 1 28 LEU HB3 H 2.936 7.909 -5.234 1.00 . A A . 28 LEU HB3 1 1 2 876 1 1 28 LEU HD11 H 0.566 8.290 -4.668 1.00 . A A . 28 LEU HD11 1 1 2 877 1 1 28 LEU HD12 H 0.798 7.368 -3.181 1.00 . A A . 28 LEU HD12 1 1 2 878 1 1 28 LEU HD13 H -0.485 6.920 -4.305 1.00 . A A . 28 LEU HD13 1 1 2 879 1 1 28 LEU HD21 H 1.682 5.450 -6.863 1.00 . A A . 28 LEU HD21 1 1 2 880 1 1 28 LEU HD22 H 1.165 7.131 -6.918 1.00 . A A . 28 LEU HD22 1 1 2 881 1 1 28 LEU HD23 H 0.023 5.874 -6.434 1.00 . A A . 28 LEU HD23 1 1 2 882 1 1 28 LEU HG H 1.428 5.420 -4.452 1.00 . A A . 28 LEU HG 1 1 2 883 1 1 28 LEU N N 3.963 4.716 -5.183 1.00 . A A . 28 LEU N 1 1 2 884 1 1 28 LEU O O 5.954 7.311 -6.259 1.00 . A A . 28 LEU O 1 1 2 885 1 1 29 ASN C C 7.939 5.460 -3.432 1.00 . A A . 29 ASN C 1 1 2 886 1 1 29 ASN CA C 7.277 6.736 -3.879 1.00 . A A . 29 ASN CA 1 1 2 887 1 1 29 ASN CB C 7.306 7.736 -2.698 1.00 . A A . 29 ASN CB 1 1 2 888 1 1 29 ASN CG C 6.619 9.062 -2.939 1.00 . A A . 29 ASN CG 1 1 2 889 1 1 29 ASN H H 5.426 5.797 -3.604 1.00 . A A . 29 ASN H 1 1 2 890 1 1 29 ASN HA H 7.778 7.145 -4.742 1.00 . A A . 29 ASN HA 1 1 2 891 1 1 29 ASN HB2 H 6.829 7.272 -1.848 1.00 . A A . 29 ASN HB2 1 1 2 892 1 1 29 ASN HB3 H 8.339 7.924 -2.447 1.00 . A A . 29 ASN HB3 1 1 2 893 1 1 29 ASN HD21 H 6.344 9.251 -1.000 1.00 . A A . 29 ASN HD21 1 1 2 894 1 1 29 ASN HD22 H 5.734 10.542 -1.968 1.00 . A A . 29 ASN HD22 1 1 2 895 1 1 29 ASN N N 5.922 6.355 -4.245 1.00 . A A . 29 ASN N 1 1 2 896 1 1 29 ASN ND2 N 6.190 9.679 -1.874 1.00 . A A . 29 ASN ND2 1 1 2 897 1 1 29 ASN O O 7.230 4.490 -3.197 1.00 . A A . 29 ASN O 1 1 2 898 1 1 29 ASN OD1 O 6.515 9.546 -4.073 1.00 . A A . 29 ASN OD1 1 1 2 899 1 1 30 PRO C C 9.427 3.714 -1.468 1.00 . A A . 30 PRO C 1 1 2 900 1 1 30 PRO CA C 9.954 4.182 -2.828 1.00 . A A . 30 PRO CA 1 1 2 901 1 1 30 PRO CB C 11.423 4.605 -2.710 1.00 . A A . 30 PRO CB 1 1 2 902 1 1 30 PRO CD C 10.255 6.478 -3.591 1.00 . A A . 30 PRO CD 1 1 2 903 1 1 30 PRO CG C 11.558 5.738 -3.660 1.00 . A A . 30 PRO CG 1 1 2 904 1 1 30 PRO HA H 9.857 3.383 -3.547 1.00 . A A . 30 PRO HA 1 1 2 905 1 1 30 PRO HB2 H 11.633 4.907 -1.695 1.00 . A A . 30 PRO HB2 1 1 2 906 1 1 30 PRO HB3 H 12.065 3.782 -2.987 1.00 . A A . 30 PRO HB3 1 1 2 907 1 1 30 PRO HD2 H 10.290 7.202 -2.792 1.00 . A A . 30 PRO HD2 1 1 2 908 1 1 30 PRO HD3 H 10.025 6.956 -4.530 1.00 . A A . 30 PRO HD3 1 1 2 909 1 1 30 PRO HG2 H 12.373 6.376 -3.353 1.00 . A A . 30 PRO HG2 1 1 2 910 1 1 30 PRO HG3 H 11.727 5.366 -4.659 1.00 . A A . 30 PRO HG3 1 1 2 911 1 1 30 PRO N N 9.280 5.403 -3.286 1.00 . A A . 30 PRO N 1 1 2 912 1 1 30 PRO O O 9.328 2.507 -1.205 1.00 . A A . 30 PRO O 1 1 2 913 1 1 31 TYR C C 7.059 4.406 0.755 1.00 . A A . 31 TYR C 1 1 2 914 1 1 31 TYR CA C 8.584 4.311 0.705 1.00 . A A . 31 TYR CA 1 1 2 915 1 1 31 TYR CB C 9.165 5.310 1.728 1.00 . A A . 31 TYR CB 1 1 2 916 1 1 31 TYR CD1 C 10.996 6.777 0.781 1.00 . A A . 31 TYR CD1 1 1 2 917 1 1 31 TYR CD2 C 11.631 4.823 1.972 1.00 . A A . 31 TYR CD2 1 1 2 918 1 1 31 TYR CE1 C 12.317 7.072 0.544 1.00 . A A . 31 TYR CE1 1 1 2 919 1 1 31 TYR CE2 C 12.956 5.115 1.743 1.00 . A A . 31 TYR CE2 1 1 2 920 1 1 31 TYR CG C 10.629 5.642 1.501 1.00 . A A . 31 TYR CG 1 1 2 921 1 1 31 TYR CZ C 13.293 6.236 1.026 1.00 . A A . 31 TYR CZ 1 1 2 922 1 1 31 TYR H H 9.122 5.604 -0.883 1.00 . A A . 31 TYR H 1 1 2 923 1 1 31 TYR HA H 8.919 3.317 0.960 1.00 . A A . 31 TYR HA 1 1 2 924 1 1 31 TYR HB2 H 8.606 6.231 1.688 1.00 . A A . 31 TYR HB2 1 1 2 925 1 1 31 TYR HB3 H 9.072 4.889 2.718 1.00 . A A . 31 TYR HB3 1 1 2 926 1 1 31 TYR HD1 H 10.225 7.432 0.405 1.00 . A A . 31 TYR HD1 1 1 2 927 1 1 31 TYR HD2 H 11.364 3.940 2.537 1.00 . A A . 31 TYR HD2 1 1 2 928 1 1 31 TYR HE1 H 12.582 7.957 -0.014 1.00 . A A . 31 TYR HE1 1 1 2 929 1 1 31 TYR HE2 H 13.725 4.457 2.119 1.00 . A A . 31 TYR HE2 1 1 2 930 1 1 31 TYR HH H 15.026 5.715 0.451 1.00 . A A . 31 TYR HH 1 1 2 931 1 1 31 TYR N N 9.057 4.665 -0.616 1.00 . A A . 31 TYR N 1 1 2 932 1 1 31 TYR O O 6.400 3.678 1.503 1.00 . A A . 31 TYR O 1 1 2 933 1 1 31 TYR OH O 14.614 6.522 0.782 1.00 . A A . 31 TYR OH 1 1 2 934 1 1 32 TYR C C 4.406 4.542 -1.143 1.00 . A A . 32 TYR C 1 1 2 935 1 1 32 TYR CA C 5.062 5.409 -0.084 1.00 . A A . 32 TYR CA 1 1 2 936 1 1 32 TYR CB C 4.632 6.868 -0.221 1.00 . A A . 32 TYR CB 1 1 2 937 1 1 32 TYR CD1 C 2.238 7.450 -0.793 1.00 . A A . 32 TYR CD1 1 1 2 938 1 1 32 TYR CD2 C 2.781 6.933 1.469 1.00 . A A . 32 TYR CD2 1 1 2 939 1 1 32 TYR CE1 C 0.921 7.648 -0.426 1.00 . A A . 32 TYR CE1 1 1 2 940 1 1 32 TYR CE2 C 1.475 7.126 1.838 1.00 . A A . 32 TYR CE2 1 1 2 941 1 1 32 TYR CG C 3.190 7.093 0.152 1.00 . A A . 32 TYR CG 1 1 2 942 1 1 32 TYR CZ C 0.550 7.482 0.893 1.00 . A A . 32 TYR CZ 1 1 2 943 1 1 32 TYR H H 7.045 5.792 -0.674 1.00 . A A . 32 TYR H 1 1 2 944 1 1 32 TYR HA H 4.720 5.049 0.876 1.00 . A A . 32 TYR HA 1 1 2 945 1 1 32 TYR HB2 H 5.233 7.485 0.429 1.00 . A A . 32 TYR HB2 1 1 2 946 1 1 32 TYR HB3 H 4.763 7.188 -1.244 1.00 . A A . 32 TYR HB3 1 1 2 947 1 1 32 TYR HD1 H 2.537 7.577 -1.823 1.00 . A A . 32 TYR HD1 1 1 2 948 1 1 32 TYR HD2 H 3.512 6.651 2.211 1.00 . A A . 32 TYR HD2 1 1 2 949 1 1 32 TYR HE1 H 0.186 7.924 -1.167 1.00 . A A . 32 TYR HE1 1 1 2 950 1 1 32 TYR HE2 H 1.179 6.998 2.869 1.00 . A A . 32 TYR HE2 1 1 2 951 1 1 32 TYR HH H -1.333 7.335 0.573 1.00 . A A . 32 TYR HH 1 1 2 952 1 1 32 TYR N N 6.491 5.259 -0.071 1.00 . A A . 32 TYR N 1 1 2 953 1 1 32 TYR O O 4.585 4.754 -2.343 1.00 . A A . 32 TYR O 1 1 2 954 1 1 32 TYR OH O -0.752 7.674 1.265 1.00 . A A . 32 TYR OH 1 1 2 955 1 1 33 SER C C 1.503 2.729 -1.037 1.00 . A A . 33 SER C 1 1 2 956 1 1 33 SER CA C 2.891 2.787 -1.606 1.00 . A A . 33 SER CA 1 1 2 957 1 1 33 SER CB C 3.526 1.403 -1.677 1.00 . A A . 33 SER CB 1 1 2 958 1 1 33 SER H H 3.548 3.459 0.243 1.00 . A A . 33 SER H 1 1 2 959 1 1 33 SER HA H 2.872 3.243 -2.583 1.00 . A A . 33 SER HA 1 1 2 960 1 1 33 SER HB2 H 3.444 0.921 -0.714 1.00 . A A . 33 SER HB2 1 1 2 961 1 1 33 SER HB3 H 3.020 0.809 -2.423 1.00 . A A . 33 SER HB3 1 1 2 962 1 1 33 SER HG H 5.102 2.424 -2.217 1.00 . A A . 33 SER HG 1 1 2 963 1 1 33 SER N N 3.642 3.613 -0.719 1.00 . A A . 33 SER N 1 1 2 964 1 1 33 SER O O 1.352 2.498 0.156 1.00 . A A . 33 SER O 1 1 2 965 1 1 33 SER OG O 4.896 1.503 -2.025 1.00 . A A . 33 SER OG 1 1 2 966 1 1 34 GLN C C -1.755 2.130 -2.126 1.00 . A A . 34 GLN C 1 1 2 967 1 1 34 GLN CA C -0.838 3.057 -1.353 1.00 . A A . 34 GLN CA 1 1 2 968 1 1 34 GLN CB C -1.302 4.527 -1.417 1.00 . A A . 34 GLN CB 1 1 2 969 1 1 34 GLN CD C -3.122 6.233 -1.029 1.00 . A A . 34 GLN CD 1 1 2 970 1 1 34 GLN CG C -2.774 4.761 -1.127 1.00 . A A . 34 GLN CG 1 1 2 971 1 1 34 GLN H H 0.673 3.055 -2.811 1.00 . A A . 34 GLN H 1 1 2 972 1 1 34 GLN HA H -0.834 2.747 -0.317 1.00 . A A . 34 GLN HA 1 1 2 973 1 1 34 GLN HB2 H -0.733 5.101 -0.703 1.00 . A A . 34 GLN HB2 1 1 2 974 1 1 34 GLN HB3 H -1.090 4.905 -2.406 1.00 . A A . 34 GLN HB3 1 1 2 975 1 1 34 GLN HE21 H -3.032 6.172 0.956 1.00 . A A . 34 GLN HE21 1 1 2 976 1 1 34 GLN HE22 H -3.437 7.693 0.275 1.00 . A A . 34 GLN HE22 1 1 2 977 1 1 34 GLN HG2 H -3.361 4.316 -1.917 1.00 . A A . 34 GLN HG2 1 1 2 978 1 1 34 GLN HG3 H -3.015 4.284 -0.187 1.00 . A A . 34 GLN HG3 1 1 2 979 1 1 34 GLN N N 0.516 2.968 -1.840 1.00 . A A . 34 GLN N 1 1 2 980 1 1 34 GLN NE2 N -3.193 6.747 0.172 1.00 . A A . 34 GLN NE2 1 1 2 981 1 1 34 GLN O O -1.585 1.952 -3.334 1.00 . A A . 34 GLN O 1 1 2 982 1 1 34 GLN OE1 O -3.405 6.881 -2.021 1.00 . A A . 34 GLN OE1 1 1 2 983 1 1 35 CYS C C -4.701 1.491 -2.704 1.00 . A A . 35 CYS C 1 1 2 984 1 1 35 CYS CA C -3.642 0.643 -2.049 1.00 . A A . 35 CYS CA 1 1 2 985 1 1 35 CYS CB C -4.296 -0.283 -1.038 1.00 . A A . 35 CYS CB 1 1 2 986 1 1 35 CYS H H -2.685 1.573 -0.446 1.00 . A A . 35 CYS H 1 1 2 987 1 1 35 CYS HA H -3.143 0.049 -2.800 1.00 . A A . 35 CYS HA 1 1 2 988 1 1 35 CYS HB2 H -4.877 0.282 -0.326 1.00 . A A . 35 CYS HB2 1 1 2 989 1 1 35 CYS HB3 H -4.963 -0.931 -1.580 1.00 . A A . 35 CYS HB3 1 1 2 990 1 1 35 CYS N N -2.670 1.491 -1.422 1.00 . A A . 35 CYS N 1 1 2 991 1 1 35 CYS O O -5.470 2.179 -2.017 1.00 . A A . 35 CYS O 1 1 2 992 1 1 35 CYS SG S -3.146 -1.329 -0.121 1.00 . A A . 35 CYS SG 1 1 2 993 1 1 36 LEU C C -6.604 1.185 -5.394 1.00 . A A . 36 LEU C 1 1 2 994 1 1 36 LEU CA C -5.664 2.188 -4.781 1.00 . A A . 36 LEU CA 1 1 2 995 1 1 36 LEU CB C -4.950 3.025 -5.852 1.00 . A A . 36 LEU CB 1 1 2 996 1 1 36 LEU CD1 C -3.289 4.820 -6.452 1.00 . A A . 36 LEU CD1 1 1 2 997 1 1 36 LEU CD2 C -4.812 5.152 -4.510 1.00 . A A . 36 LEU CD2 1 1 2 998 1 1 36 LEU CG C -4.021 4.132 -5.316 1.00 . A A . 36 LEU CG 1 1 2 999 1 1 36 LEU H H -4.050 0.919 -4.463 1.00 . A A . 36 LEU H 1 1 2 1000 1 1 36 LEU HA H -6.226 2.837 -4.126 1.00 . A A . 36 LEU HA 1 1 2 1001 1 1 36 LEU HB2 H -4.365 2.356 -6.465 1.00 . A A . 36 LEU HB2 1 1 2 1002 1 1 36 LEU HB3 H -5.700 3.489 -6.474 1.00 . A A . 36 LEU HB3 1 1 2 1003 1 1 36 LEU HD11 H -2.711 4.092 -7.003 1.00 . A A . 36 LEU HD11 1 1 2 1004 1 1 36 LEU HD12 H -2.627 5.571 -6.045 1.00 . A A . 36 LEU HD12 1 1 2 1005 1 1 36 LEU HD13 H -4.005 5.288 -7.109 1.00 . A A . 36 LEU HD13 1 1 2 1006 1 1 36 LEU HD21 H -4.144 5.926 -4.163 1.00 . A A . 36 LEU HD21 1 1 2 1007 1 1 36 LEU HD22 H -5.270 4.672 -3.659 1.00 . A A . 36 LEU HD22 1 1 2 1008 1 1 36 LEU HD23 H -5.576 5.593 -5.135 1.00 . A A . 36 LEU HD23 1 1 2 1009 1 1 36 LEU HG H -3.284 3.685 -4.666 1.00 . A A . 36 LEU HG 1 1 2 1010 1 1 36 LEU N N -4.715 1.472 -3.991 1.00 . A A . 36 LEU N 1 1 2 1011 1 1 36 LEU O O -6.133 0.331 -6.185 1.00 . A A . 36 LEU O 1 1 2 1012 1 1 36 LEU OXT O -7.793 1.195 -5.048 1.00 . A A . 36 LEU OXT 1 1 2 1013 2 2 1 MAN C1 C 9.560 -4.714 8.301 1.00 . B A . 101 MAN C1 1 1 2 1014 2 2 1 MAN C2 C 10.033 -4.288 9.717 1.00 . B A . 101 MAN C2 1 1 2 1015 2 2 1 MAN C3 C 10.093 -2.779 9.829 1.00 . B A . 101 MAN C3 1 1 2 1016 2 2 1 MAN C4 C 10.995 -2.237 8.721 1.00 . B A . 101 MAN C4 1 1 2 1017 2 2 1 MAN C5 C 10.452 -2.668 7.359 1.00 . B A . 101 MAN C5 1 1 2 1018 2 2 1 MAN C6 C 11.289 -2.175 6.190 1.00 . B A . 101 MAN C6 1 1 2 1019 2 2 1 MAN H1 H 9.650 -5.807 8.232 1.00 . B A . 101 MAN H1 1 1 2 1020 2 2 1 MAN H2 H 9.319 -4.667 10.464 1.00 . B A . 101 MAN H2 1 1 2 1021 2 2 1 MAN H3 H 9.081 -2.362 9.728 1.00 . B A . 101 MAN H3 1 1 2 1022 2 2 1 MAN H4 H 11.996 -2.673 8.857 1.00 . B A . 101 MAN H4 1 1 2 1023 2 2 1 MAN H5 H 9.429 -2.268 7.279 1.00 . B A . 101 MAN H5 1 1 2 1024 2 2 1 MAN H61 H 12.283 -2.637 6.267 1.00 . B A . 101 MAN H61 1 1 2 1025 2 2 1 MAN H62 H 11.423 -1.088 6.285 1.00 . B A . 101 MAN H62 1 1 2 1026 2 2 1 MAN HO2 H 11.271 -5.749 9.981 1.00 . B A . 101 MAN HO2 1 1 2 1027 2 2 1 MAN HO3 H 11.549 -2.886 11.054 1.00 . B A . 101 MAN HO3 1 1 2 1028 2 2 1 MAN HO4 H 10.178 -0.465 8.675 1.00 . B A . 101 MAN HO4 1 1 2 1029 2 2 1 MAN HO6 H 9.751 -2.747 5.074 1.00 . B A . 101 MAN HO6 1 1 2 1030 2 2 1 MAN O2 O 11.328 -4.787 9.988 1.00 . B A . 101 MAN O2 1 1 2 1031 2 2 1 MAN O3 O 10.684 -2.450 11.079 1.00 . B A . 101 MAN O3 1 1 2 1032 2 2 1 MAN O4 O 11.066 -0.824 8.807 1.00 . B A . 101 MAN O4 1 1 2 1033 2 2 1 MAN O5 O 10.413 -4.116 7.298 1.00 . B A . 101 MAN O5 1 1 2 1034 2 2 1 MAN O6 O 10.674 -2.496 4.931 1.00 . B A . 101 MAN O6 1 1 3 1035 1 1 1 THR C C -5.686 -6.229 4.152 1.00 . A A . 1 THR C 1 1 3 1036 1 1 1 THR CA C -5.859 -7.681 3.726 1.00 . A A . 1 THR CA 1 1 3 1037 1 1 1 THR CB C -6.764 -7.765 2.489 1.00 . A A . 1 THR CB 1 1 3 1038 1 1 1 THR CG2 C -6.669 -9.138 1.834 1.00 . A A . 1 THR CG2 1 1 3 1039 1 1 1 THR H1 H -6.580 -9.426 4.561 1.00 . A A . 1 THR H1 1 1 3 1040 1 1 1 THR H2 H -7.388 -8.007 4.974 1.00 . A A . 1 THR H2 1 1 3 1041 1 1 1 THR H3 H -5.883 -8.333 5.671 1.00 . A A . 1 THR H3 1 1 3 1042 1 1 1 THR HA H -4.895 -8.105 3.489 1.00 . A A . 1 THR HA 1 1 3 1043 1 1 1 THR HB H -6.450 -7.007 1.785 1.00 . A A . 1 THR HB 1 1 3 1044 1 1 1 THR HG1 H -8.727 -7.980 2.301 1.00 . A A . 1 THR HG1 1 1 3 1045 1 1 1 THR HG21 H -7.326 -9.171 0.978 1.00 . A A . 1 THR HG21 1 1 3 1046 1 1 1 THR HG22 H -6.961 -9.899 2.543 1.00 . A A . 1 THR HG22 1 1 3 1047 1 1 1 THR HG23 H -5.653 -9.316 1.515 1.00 . A A . 1 THR HG23 1 1 3 1048 1 1 1 THR N N -6.452 -8.427 4.808 1.00 . A A . 1 THR N 1 1 3 1049 1 1 1 THR O O -6.273 -5.800 5.152 1.00 . A A . 1 THR O 1 1 3 1050 1 1 1 THR OG1 O -8.123 -7.501 2.884 1.00 . A A . 1 THR OG1 1 1 3 1051 1 1 2 GLN C C -5.794 -3.251 3.163 1.00 . A A . 2 GLN C 1 1 3 1052 1 1 2 GLN CA C -4.635 -4.104 3.753 1.00 . A A . 2 GLN CA 1 1 3 1053 1 1 2 GLN CB C -3.273 -3.693 3.179 1.00 . A A . 2 GLN CB 1 1 3 1054 1 1 2 GLN CD C -3.214 -1.431 4.291 1.00 . A A . 2 GLN CD 1 1 3 1055 1 1 2 GLN CG C -2.478 -2.698 4.028 1.00 . A A . 2 GLN CG 1 1 3 1056 1 1 2 GLN H H -4.402 -5.886 2.669 1.00 . A A . 2 GLN H 1 1 3 1057 1 1 2 GLN HA H -4.628 -3.998 4.827 1.00 . A A . 2 GLN HA 1 1 3 1058 1 1 2 GLN HB2 H -2.671 -4.581 3.053 1.00 . A A . 2 GLN HB2 1 1 3 1059 1 1 2 GLN HB3 H -3.435 -3.250 2.207 1.00 . A A . 2 GLN HB3 1 1 3 1060 1 1 2 GLN HE21 H -2.633 -0.765 2.570 1.00 . A A . 2 GLN HE21 1 1 3 1061 1 1 2 GLN HE22 H -3.653 0.279 3.494 1.00 . A A . 2 GLN HE22 1 1 3 1062 1 1 2 GLN HG2 H -2.247 -3.157 4.977 1.00 . A A . 2 GLN HG2 1 1 3 1063 1 1 2 GLN HG3 H -1.556 -2.468 3.517 1.00 . A A . 2 GLN HG3 1 1 3 1064 1 1 2 GLN N N -4.875 -5.490 3.438 1.00 . A A . 2 GLN N 1 1 3 1065 1 1 2 GLN NE2 N -3.155 -0.552 3.372 1.00 . A A . 2 GLN NE2 1 1 3 1066 1 1 2 GLN O O -6.333 -3.576 2.097 1.00 . A A . 2 GLN O 1 1 3 1067 1 1 2 GLN OE1 O -3.904 -1.282 5.300 1.00 . A A . 2 GLN OE1 1 1 3 1068 1 1 3 SER C C -6.954 -0.311 2.421 1.00 . A A . 3 SER C 1 1 3 1069 1 1 3 SER CA C -7.287 -1.347 3.518 1.00 . A A . 3 SER CA 1 1 3 1070 1 1 3 SER CB C -7.759 -0.640 4.787 1.00 . A A . 3 SER CB 1 1 3 1071 1 1 3 SER H H -5.621 -1.935 4.643 1.00 . A A . 3 SER H 1 1 3 1072 1 1 3 SER HA H -8.089 -1.981 3.173 1.00 . A A . 3 SER HA 1 1 3 1073 1 1 3 SER HB2 H -6.979 0.020 5.139 1.00 . A A . 3 SER HB2 1 1 3 1074 1 1 3 SER HB3 H -8.650 -0.068 4.580 1.00 . A A . 3 SER HB3 1 1 3 1075 1 1 3 SER HG H -8.741 -1.205 6.360 1.00 . A A . 3 SER HG 1 1 3 1076 1 1 3 SER N N -6.154 -2.193 3.859 1.00 . A A . 3 SER N 1 1 3 1077 1 1 3 SER O O -5.777 -0.030 2.120 1.00 . A A . 3 SER O 1 1 3 1078 1 1 3 SER OG O -8.049 -1.587 5.805 1.00 . A A . 3 SER OG 1 1 3 1079 1 1 4 HIS C C -7.368 2.568 1.404 1.00 . A A . 4 HIS C 1 1 3 1080 1 1 4 HIS CA C -7.882 1.260 0.793 1.00 . A A . 4 HIS CA 1 1 3 1081 1 1 4 HIS CB C -9.272 1.471 0.140 1.00 . A A . 4 HIS CB 1 1 3 1082 1 1 4 HIS CD2 C -8.325 2.261 -2.139 1.00 . A A . 4 HIS CD2 1 1 3 1083 1 1 4 HIS CE1 C -10.094 3.264 -2.916 1.00 . A A . 4 HIS CE1 1 1 3 1084 1 1 4 HIS CG C -9.266 2.189 -1.187 1.00 . A A . 4 HIS CG 1 1 3 1085 1 1 4 HIS H H -8.897 0.057 2.193 1.00 . A A . 4 HIS H 1 1 3 1086 1 1 4 HIS HA H -7.183 0.900 0.053 1.00 . A A . 4 HIS HA 1 1 3 1087 1 1 4 HIS HB2 H -9.736 0.509 -0.015 1.00 . A A . 4 HIS HB2 1 1 3 1088 1 1 4 HIS HB3 H -9.884 2.040 0.823 1.00 . A A . 4 HIS HB3 1 1 3 1089 1 1 4 HIS HD1 H -11.220 2.970 -1.235 1.00 . A A . 4 HIS HD1 1 1 3 1090 1 1 4 HIS HD2 H -7.323 1.862 -2.072 1.00 . A A . 4 HIS HD2 1 1 3 1091 1 1 4 HIS HE1 H -10.772 3.799 -3.564 1.00 . A A . 4 HIS HE1 1 1 3 1092 1 1 4 HIS HE2 H -8.588 2.636 -4.112 1.00 . A A . 4 HIS HE2 1 1 3 1093 1 1 4 HIS N N -7.999 0.276 1.856 1.00 . A A . 4 HIS N 1 1 3 1094 1 1 4 HIS ND1 N -10.363 2.834 -1.701 1.00 . A A . 4 HIS ND1 1 1 3 1095 1 1 4 HIS NE2 N -8.854 2.925 -3.207 1.00 . A A . 4 HIS NE2 1 1 3 1096 1 1 4 HIS O O -7.811 2.954 2.481 1.00 . A A . 4 HIS O 1 1 3 1097 1 1 5 TYR C C -4.843 4.256 2.370 1.00 . A A . 5 TYR C 1 1 3 1098 1 1 5 TYR CA C -5.783 4.473 1.196 1.00 . A A . 5 TYR CA 1 1 3 1099 1 1 5 TYR CB C -6.796 5.596 1.486 1.00 . A A . 5 TYR CB 1 1 3 1100 1 1 5 TYR CD1 C -8.710 5.790 -0.134 1.00 . A A . 5 TYR CD1 1 1 3 1101 1 1 5 TYR CD2 C -6.744 7.059 -0.556 1.00 . A A . 5 TYR CD2 1 1 3 1102 1 1 5 TYR CE1 C -9.284 6.301 -1.275 1.00 . A A . 5 TYR CE1 1 1 3 1103 1 1 5 TYR CE2 C -7.312 7.576 -1.699 1.00 . A A . 5 TYR CE2 1 1 3 1104 1 1 5 TYR CG C -7.434 6.159 0.245 1.00 . A A . 5 TYR CG 1 1 3 1105 1 1 5 TYR CZ C -8.582 7.193 -2.054 1.00 . A A . 5 TYR CZ 1 1 3 1106 1 1 5 TYR H H -6.074 2.824 -0.112 1.00 . A A . 5 TYR H 1 1 3 1107 1 1 5 TYR HA H -5.152 4.785 0.375 1.00 . A A . 5 TYR HA 1 1 3 1108 1 1 5 TYR HB2 H -7.579 5.205 2.119 1.00 . A A . 5 TYR HB2 1 1 3 1109 1 1 5 TYR HB3 H -6.292 6.399 2.002 1.00 . A A . 5 TYR HB3 1 1 3 1110 1 1 5 TYR HD1 H -9.259 5.091 0.478 1.00 . A A . 5 TYR HD1 1 1 3 1111 1 1 5 TYR HD2 H -5.746 7.354 -0.271 1.00 . A A . 5 TYR HD2 1 1 3 1112 1 1 5 TYR HE1 H -10.282 6.000 -1.554 1.00 . A A . 5 TYR HE1 1 1 3 1113 1 1 5 TYR HE2 H -6.760 8.274 -2.311 1.00 . A A . 5 TYR HE2 1 1 3 1114 1 1 5 TYR HH H -8.516 7.724 -3.912 1.00 . A A . 5 TYR HH 1 1 3 1115 1 1 5 TYR N N -6.407 3.210 0.730 1.00 . A A . 5 TYR N 1 1 3 1116 1 1 5 TYR O O -4.506 5.192 3.109 1.00 . A A . 5 TYR O 1 1 3 1117 1 1 5 TYR OH O -9.157 7.701 -3.192 1.00 . A A . 5 TYR OH 1 1 3 1118 1 1 6 GLY C C -2.136 2.304 2.837 1.00 . A A . 6 GLY C 1 1 3 1119 1 1 6 GLY CA C -3.409 2.752 3.501 1.00 . A A . 6 GLY CA 1 1 3 1120 1 1 6 GLY H H -4.735 2.333 1.936 1.00 . A A . 6 GLY H 1 1 3 1121 1 1 6 GLY HA2 H -3.219 3.650 4.070 1.00 . A A . 6 GLY HA2 1 1 3 1122 1 1 6 GLY HA3 H -3.766 1.972 4.157 1.00 . A A . 6 GLY HA3 1 1 3 1123 1 1 6 GLY N N -4.391 3.046 2.513 1.00 . A A . 6 GLY N 1 1 3 1124 1 1 6 GLY O O -2.185 1.764 1.712 1.00 . A A . 6 GLY O 1 1 3 1125 1 1 7 GLN C C 0.400 0.613 2.993 1.00 . A A . 7 GLN C 1 1 3 1126 1 1 7 GLN CA C 0.271 2.141 2.965 1.00 . A A . 7 GLN CA 1 1 3 1127 1 1 7 GLN CB C 1.391 2.819 3.772 1.00 . A A . 7 GLN CB 1 1 3 1128 1 1 7 GLN CD C 3.863 3.219 4.121 1.00 . A A . 7 GLN CD 1 1 3 1129 1 1 7 GLN CG C 2.806 2.463 3.336 1.00 . A A . 7 GLN CG 1 1 3 1130 1 1 7 GLN H H -1.065 2.997 4.349 1.00 . A A . 7 GLN H 1 1 3 1131 1 1 7 GLN HA H 0.327 2.469 1.938 1.00 . A A . 7 GLN HA 1 1 3 1132 1 1 7 GLN HB2 H 1.278 3.891 3.683 1.00 . A A . 7 GLN HB2 1 1 3 1133 1 1 7 GLN HB3 H 1.277 2.547 4.811 1.00 . A A . 7 GLN HB3 1 1 3 1134 1 1 7 GLN HE21 H 5.151 3.142 2.598 1.00 . A A . 7 GLN HE21 1 1 3 1135 1 1 7 GLN HE22 H 5.694 3.929 4.013 1.00 . A A . 7 GLN HE22 1 1 3 1136 1 1 7 GLN HG2 H 2.954 1.404 3.484 1.00 . A A . 7 GLN HG2 1 1 3 1137 1 1 7 GLN HG3 H 2.917 2.698 2.287 1.00 . A A . 7 GLN HG3 1 1 3 1138 1 1 7 GLN N N -1.022 2.540 3.480 1.00 . A A . 7 GLN N 1 1 3 1139 1 1 7 GLN NE2 N 4.998 3.445 3.518 1.00 . A A . 7 GLN NE2 1 1 3 1140 1 1 7 GLN O O 0.273 -0.002 4.043 1.00 . A A . 7 GLN O 1 1 3 1141 1 1 7 GLN OE1 O 3.656 3.589 5.275 1.00 . A A . 7 GLN OE1 1 1 3 1142 1 1 8 CYS C C 2.123 -1.920 1.939 1.00 . A A . 8 CYS C 1 1 3 1143 1 1 8 CYS CA C 0.718 -1.419 1.693 1.00 . A A . 8 CYS CA 1 1 3 1144 1 1 8 CYS CB C 0.219 -1.857 0.316 1.00 . A A . 8 CYS CB 1 1 3 1145 1 1 8 CYS H H 0.736 0.588 1.035 1.00 . A A . 8 CYS H 1 1 3 1146 1 1 8 CYS HA H 0.073 -1.854 2.441 1.00 . A A . 8 CYS HA 1 1 3 1147 1 1 8 CYS HB2 H 0.503 -2.885 0.149 1.00 . A A . 8 CYS HB2 1 1 3 1148 1 1 8 CYS HB3 H -0.857 -1.774 0.283 1.00 . A A . 8 CYS HB3 1 1 3 1149 1 1 8 CYS N N 0.623 0.028 1.833 1.00 . A A . 8 CYS N 1 1 3 1150 1 1 8 CYS O O 2.318 -2.927 2.596 1.00 . A A . 8 CYS O 1 1 3 1151 1 1 8 CYS SG S 0.897 -0.866 -1.065 1.00 . A A . 8 CYS SG 1 1 3 1152 1 1 9 GLY C C 5.452 -0.963 0.811 1.00 . A A . 9 GLY C 1 1 3 1153 1 1 9 GLY CA C 4.446 -1.662 1.652 1.00 . A A . 9 GLY CA 1 1 3 1154 1 1 9 GLY H H 2.916 -0.448 0.858 1.00 . A A . 9 GLY H 1 1 3 1155 1 1 9 GLY HA2 H 4.688 -1.478 2.687 1.00 . A A . 9 GLY HA2 1 1 3 1156 1 1 9 GLY HA3 H 4.507 -2.724 1.464 1.00 . A A . 9 GLY HA3 1 1 3 1157 1 1 9 GLY N N 3.108 -1.227 1.419 1.00 . A A . 9 GLY N 1 1 3 1158 1 1 9 GLY O O 5.643 -1.300 -0.346 1.00 . A A . 9 GLY O 1 1 3 1159 1 1 10 GLY C C 8.415 0.341 1.416 1.00 . A A . 10 GLY C 1 1 3 1160 1 1 10 GLY CA C 7.144 0.693 0.714 1.00 . A A . 10 GLY CA 1 1 3 1161 1 1 10 GLY H H 5.843 0.281 2.289 1.00 . A A . 10 GLY H 1 1 3 1162 1 1 10 GLY HA2 H 7.186 0.375 -0.319 1.00 . A A . 10 GLY HA2 1 1 3 1163 1 1 10 GLY HA3 H 6.998 1.762 0.767 1.00 . A A . 10 GLY HA3 1 1 3 1164 1 1 10 GLY N N 6.074 0.019 1.377 1.00 . A A . 10 GLY N 1 1 3 1165 1 1 10 GLY O O 8.368 -0.425 2.396 1.00 . A A . 10 GLY O 1 1 3 1166 1 1 11 ILE C C 10.801 0.992 3.076 1.00 . A A . 11 ILE C 1 1 3 1167 1 1 11 ILE CA C 10.822 0.586 1.590 1.00 . A A . 11 ILE CA 1 1 3 1168 1 1 11 ILE CB C 11.988 1.314 0.855 1.00 . A A . 11 ILE CB 1 1 3 1169 1 1 11 ILE CD1 C 13.109 1.568 -1.438 1.00 . A A . 11 ILE CD1 1 1 3 1170 1 1 11 ILE CG1 C 12.056 0.857 -0.611 1.00 . A A . 11 ILE CG1 1 1 3 1171 1 1 11 ILE CG2 C 13.327 1.054 1.558 1.00 . A A . 11 ILE CG2 1 1 3 1172 1 1 11 ILE H H 9.499 1.455 0.174 1.00 . A A . 11 ILE H 1 1 3 1173 1 1 11 ILE HA H 10.983 -0.480 1.532 1.00 . A A . 11 ILE HA 1 1 3 1174 1 1 11 ILE HB H 11.794 2.375 0.881 1.00 . A A . 11 ILE HB 1 1 3 1175 1 1 11 ILE HD11 H 13.092 1.182 -2.446 1.00 . A A . 11 ILE HD11 1 1 3 1176 1 1 11 ILE HD12 H 14.082 1.394 -1.000 1.00 . A A . 11 ILE HD12 1 1 3 1177 1 1 11 ILE HD13 H 12.903 2.628 -1.454 1.00 . A A . 11 ILE HD13 1 1 3 1178 1 1 11 ILE HG12 H 12.274 -0.200 -0.641 1.00 . A A . 11 ILE HG12 1 1 3 1179 1 1 11 ILE HG13 H 11.096 1.029 -1.075 1.00 . A A . 11 ILE HG13 1 1 3 1180 1 1 11 ILE HG21 H 14.114 1.586 1.045 1.00 . A A . 11 ILE HG21 1 1 3 1181 1 1 11 ILE HG22 H 13.538 -0.004 1.536 1.00 . A A . 11 ILE HG22 1 1 3 1182 1 1 11 ILE HG23 H 13.270 1.391 2.582 1.00 . A A . 11 ILE HG23 1 1 3 1183 1 1 11 ILE N N 9.529 0.868 0.961 1.00 . A A . 11 ILE N 1 1 3 1184 1 1 11 ILE O O 10.563 2.157 3.413 1.00 . A A . 11 ILE O 1 1 3 1185 1 1 12 GLY C C 9.718 -0.125 6.055 1.00 . A A . 12 GLY C 1 1 3 1186 1 1 12 GLY CA C 11.010 0.258 5.360 1.00 . A A . 12 GLY CA 1 1 3 1187 1 1 12 GLY H H 11.044 -0.913 3.618 1.00 . A A . 12 GLY H 1 1 3 1188 1 1 12 GLY HA2 H 11.821 -0.310 5.791 1.00 . A A . 12 GLY HA2 1 1 3 1189 1 1 12 GLY HA3 H 11.196 1.310 5.525 1.00 . A A . 12 GLY HA3 1 1 3 1190 1 1 12 GLY N N 10.966 0.010 3.943 1.00 . A A . 12 GLY N 1 1 3 1191 1 1 12 GLY O O 9.697 -0.321 7.271 1.00 . A A . 12 GLY O 1 1 3 1192 1 1 13 TYR C C 7.201 -2.046 6.165 1.00 . A A . 13 TYR C 1 1 3 1193 1 1 13 TYR CA C 7.350 -0.558 5.862 1.00 . A A . 13 TYR CA 1 1 3 1194 1 1 13 TYR CB C 6.206 -0.075 4.932 1.00 . A A . 13 TYR CB 1 1 3 1195 1 1 13 TYR CD1 C 4.109 0.483 6.252 1.00 . A A . 13 TYR CD1 1 1 3 1196 1 1 13 TYR CD2 C 4.185 -1.606 5.119 1.00 . A A . 13 TYR CD2 1 1 3 1197 1 1 13 TYR CE1 C 2.849 0.176 6.729 1.00 . A A . 13 TYR CE1 1 1 3 1198 1 1 13 TYR CE2 C 2.932 -1.914 5.586 1.00 . A A . 13 TYR CE2 1 1 3 1199 1 1 13 TYR CG C 4.802 -0.401 5.441 1.00 . A A . 13 TYR CG 1 1 3 1200 1 1 13 TYR CZ C 2.267 -1.025 6.389 1.00 . A A . 13 TYR CZ 1 1 3 1201 1 1 13 TYR H H 8.752 -0.189 4.317 1.00 . A A . 13 TYR H 1 1 3 1202 1 1 13 TYR HA H 7.292 -0.007 6.787 1.00 . A A . 13 TYR HA 1 1 3 1203 1 1 13 TYR HB2 H 6.273 0.997 4.821 1.00 . A A . 13 TYR HB2 1 1 3 1204 1 1 13 TYR HB3 H 6.327 -0.533 3.962 1.00 . A A . 13 TYR HB3 1 1 3 1205 1 1 13 TYR HD1 H 4.570 1.425 6.512 1.00 . A A . 13 TYR HD1 1 1 3 1206 1 1 13 TYR HD2 H 4.707 -2.312 4.491 1.00 . A A . 13 TYR HD2 1 1 3 1207 1 1 13 TYR HE1 H 2.324 0.876 7.362 1.00 . A A . 13 TYR HE1 1 1 3 1208 1 1 13 TYR HE2 H 2.480 -2.858 5.315 1.00 . A A . 13 TYR HE2 1 1 3 1209 1 1 13 TYR HH H 0.417 -0.647 6.604 1.00 . A A . 13 TYR HH 1 1 3 1210 1 1 13 TYR N N 8.651 -0.261 5.292 1.00 . A A . 13 TYR N 1 1 3 1211 1 1 13 TYR O O 7.564 -2.901 5.339 1.00 . A A . 13 TYR O 1 1 3 1212 1 1 13 TYR OH O 1.022 -1.347 6.877 1.00 . A A . 13 TYR OH 1 1 3 1213 1 1 14 SER C C 4.910 -3.791 8.118 1.00 . A A . 14 SER C 1 1 3 1214 1 1 14 SER CA C 6.389 -3.686 7.756 1.00 . A A . 14 SER CA 1 1 3 1215 1 1 14 SER CB C 7.235 -4.018 8.982 1.00 . A A . 14 SER CB 1 1 3 1216 1 1 14 SER H H 6.415 -1.604 7.933 1.00 . A A . 14 SER H 1 1 3 1217 1 1 14 SER HA H 6.625 -4.371 6.955 1.00 . A A . 14 SER HA 1 1 3 1218 1 1 14 SER HB2 H 6.886 -3.399 9.793 1.00 . A A . 14 SER HB2 1 1 3 1219 1 1 14 SER HB3 H 7.101 -5.059 9.237 1.00 . A A . 14 SER HB3 1 1 3 1220 1 1 14 SER N N 6.659 -2.337 7.325 1.00 . A A . 14 SER N 1 1 3 1221 1 1 14 SER O O 4.446 -3.135 9.064 1.00 . A A . 14 SER O 1 1 3 1222 1 1 14 SER OG O 8.644 -3.763 8.725 1.00 . A A . 14 SER OG 1 1 3 1223 1 1 15 GLY C C 2.126 -5.560 6.549 1.00 . A A . 15 GLY C 1 1 3 1224 1 1 15 GLY CA C 2.759 -4.711 7.615 1.00 . A A . 15 GLY CA 1 1 3 1225 1 1 15 GLY H H 4.550 -5.055 6.609 1.00 . A A . 15 GLY H 1 1 3 1226 1 1 15 GLY HA2 H 2.607 -5.159 8.586 1.00 . A A . 15 GLY HA2 1 1 3 1227 1 1 15 GLY HA3 H 2.296 -3.735 7.596 1.00 . A A . 15 GLY HA3 1 1 3 1228 1 1 15 GLY N N 4.169 -4.560 7.366 1.00 . A A . 15 GLY N 1 1 3 1229 1 1 15 GLY O O 2.853 -6.261 5.837 1.00 . A A . 15 GLY O 1 1 3 1230 1 1 16 PRO C C 0.361 -5.731 3.992 1.00 . A A . 16 PRO C 1 1 3 1231 1 1 16 PRO CA C 0.095 -6.293 5.377 1.00 . A A . 16 PRO CA 1 1 3 1232 1 1 16 PRO CB C -1.395 -6.130 5.740 1.00 . A A . 16 PRO CB 1 1 3 1233 1 1 16 PRO CD C -0.126 -4.667 7.151 1.00 . A A . 16 PRO CD 1 1 3 1234 1 1 16 PRO CG C -1.416 -5.424 7.058 1.00 . A A . 16 PRO CG 1 1 3 1235 1 1 16 PRO HA H 0.378 -7.336 5.411 1.00 . A A . 16 PRO HA 1 1 3 1236 1 1 16 PRO HB2 H -1.884 -5.546 4.974 1.00 . A A . 16 PRO HB2 1 1 3 1237 1 1 16 PRO HB3 H -1.860 -7.102 5.804 1.00 . A A . 16 PRO HB3 1 1 3 1238 1 1 16 PRO HD2 H -0.224 -3.693 6.695 1.00 . A A . 16 PRO HD2 1 1 3 1239 1 1 16 PRO HD3 H 0.193 -4.575 8.178 1.00 . A A . 16 PRO HD3 1 1 3 1240 1 1 16 PRO HG2 H -2.254 -4.745 7.100 1.00 . A A . 16 PRO HG2 1 1 3 1241 1 1 16 PRO HG3 H -1.484 -6.147 7.858 1.00 . A A . 16 PRO HG3 1 1 3 1242 1 1 16 PRO N N 0.799 -5.512 6.388 1.00 . A A . 16 PRO N 1 1 3 1243 1 1 16 PRO O O -0.024 -4.613 3.688 1.00 . A A . 16 PRO O 1 1 3 1244 1 1 17 THR C C 0.318 -6.308 0.817 1.00 . A A . 17 THR C 1 1 3 1245 1 1 17 THR CA C 1.386 -6.017 1.874 1.00 . A A . 17 THR CA 1 1 3 1246 1 1 17 THR CB C 2.759 -6.574 1.474 1.00 . A A . 17 THR CB 1 1 3 1247 1 1 17 THR CG2 C 3.875 -5.844 2.209 1.00 . A A . 17 THR CG2 1 1 3 1248 1 1 17 THR H H 1.262 -7.400 3.442 1.00 . A A . 17 THR H 1 1 3 1249 1 1 17 THR HA H 1.476 -4.943 1.952 1.00 . A A . 17 THR HA 1 1 3 1250 1 1 17 THR HB H 2.889 -6.446 0.410 1.00 . A A . 17 THR HB 1 1 3 1251 1 1 17 THR HG1 H 2.995 -8.077 2.729 1.00 . A A . 17 THR HG1 1 1 3 1252 1 1 17 THR HG21 H 3.732 -5.947 3.275 1.00 . A A . 17 THR HG21 1 1 3 1253 1 1 17 THR HG22 H 3.853 -4.796 1.950 1.00 . A A . 17 THR HG22 1 1 3 1254 1 1 17 THR HG23 H 4.831 -6.265 1.933 1.00 . A A . 17 THR HG23 1 1 3 1255 1 1 17 THR N N 1.015 -6.491 3.173 1.00 . A A . 17 THR N 1 1 3 1256 1 1 17 THR O O 0.244 -5.624 -0.212 1.00 . A A . 17 THR O 1 1 3 1257 1 1 17 THR OG1 O 2.815 -7.978 1.784 1.00 . A A . 17 THR OG1 1 1 3 1258 1 1 18 VAL C C -2.810 -6.810 0.501 1.00 . A A . 18 VAL C 1 1 3 1259 1 1 18 VAL CA C -1.582 -7.638 0.156 1.00 . A A . 18 VAL CA 1 1 3 1260 1 1 18 VAL CB C -1.927 -9.156 0.171 1.00 . A A . 18 VAL CB 1 1 3 1261 1 1 18 VAL CG1 C -3.110 -9.457 -0.747 1.00 . A A . 18 VAL CG1 1 1 3 1262 1 1 18 VAL CG2 C -0.719 -9.975 -0.258 1.00 . A A . 18 VAL CG2 1 1 3 1263 1 1 18 VAL H H -0.385 -7.832 1.886 1.00 . A A . 18 VAL H 1 1 3 1264 1 1 18 VAL HA H -1.257 -7.360 -0.836 1.00 . A A . 18 VAL HA 1 1 3 1265 1 1 18 VAL HB H -2.192 -9.439 1.180 1.00 . A A . 18 VAL HB 1 1 3 1266 1 1 18 VAL HG11 H -3.322 -10.515 -0.736 1.00 . A A . 18 VAL HG11 1 1 3 1267 1 1 18 VAL HG12 H -2.870 -9.148 -1.754 1.00 . A A . 18 VAL HG12 1 1 3 1268 1 1 18 VAL HG13 H -3.977 -8.911 -0.405 1.00 . A A . 18 VAL HG13 1 1 3 1269 1 1 18 VAL HG21 H -0.957 -11.028 -0.215 1.00 . A A . 18 VAL HG21 1 1 3 1270 1 1 18 VAL HG22 H 0.111 -9.763 0.399 1.00 . A A . 18 VAL HG22 1 1 3 1271 1 1 18 VAL HG23 H -0.449 -9.711 -1.269 1.00 . A A . 18 VAL HG23 1 1 3 1272 1 1 18 VAL N N -0.504 -7.308 1.066 1.00 . A A . 18 VAL N 1 1 3 1273 1 1 18 VAL O O -3.332 -6.872 1.631 1.00 . A A . 18 VAL O 1 1 3 1274 1 1 19 CYS C C -5.672 -5.934 -0.499 1.00 . A A . 19 CYS C 1 1 3 1275 1 1 19 CYS CA C -4.380 -5.170 -0.272 1.00 . A A . 19 CYS CA 1 1 3 1276 1 1 19 CYS CB C -4.272 -4.006 -1.253 1.00 . A A . 19 CYS CB 1 1 3 1277 1 1 19 CYS H H -2.820 -6.058 -1.327 1.00 . A A . 19 CYS H 1 1 3 1278 1 1 19 CYS HA H -4.363 -4.779 0.733 1.00 . A A . 19 CYS HA 1 1 3 1279 1 1 19 CYS HB2 H -4.359 -4.376 -2.264 1.00 . A A . 19 CYS HB2 1 1 3 1280 1 1 19 CYS HB3 H -5.072 -3.306 -1.061 1.00 . A A . 19 CYS HB3 1 1 3 1281 1 1 19 CYS N N -3.252 -6.042 -0.445 1.00 . A A . 19 CYS N 1 1 3 1282 1 1 19 CYS O O -5.657 -7.059 -1.012 1.00 . A A . 19 CYS O 1 1 3 1283 1 1 19 CYS SG S -2.699 -3.090 -1.125 1.00 . A A . 19 CYS SG 1 1 3 1284 1 1 20 ALA C C -8.367 -6.052 -1.754 1.00 . A A . 20 ALA C 1 1 3 1285 1 1 20 ALA CA C -8.088 -5.929 -0.267 1.00 . A A . 20 ALA CA 1 1 3 1286 1 1 20 ALA CB C -9.144 -5.055 0.396 1.00 . A A . 20 ALA CB 1 1 3 1287 1 1 20 ALA H H -6.707 -4.502 0.417 1.00 . A A . 20 ALA H 1 1 3 1288 1 1 20 ALA HA H -8.108 -6.907 0.188 1.00 . A A . 20 ALA HA 1 1 3 1289 1 1 20 ALA HB1 H -8.943 -4.985 1.455 1.00 . A A . 20 ALA HB1 1 1 3 1290 1 1 20 ALA HB2 H -10.121 -5.486 0.240 1.00 . A A . 20 ALA HB2 1 1 3 1291 1 1 20 ALA HB3 H -9.114 -4.067 -0.042 1.00 . A A . 20 ALA HB3 1 1 3 1292 1 1 20 ALA N N -6.775 -5.353 -0.068 1.00 . A A . 20 ALA N 1 1 3 1293 1 1 20 ALA O O -7.973 -5.169 -2.531 1.00 . A A . 20 ALA O 1 1 3 1294 1 1 21 SER C C -10.128 -6.185 -4.095 1.00 . A A . 21 SER C 1 1 3 1295 1 1 21 SER CA C -9.336 -7.374 -3.538 1.00 . A A . 21 SER CA 1 1 3 1296 1 1 21 SER CB C -10.143 -8.662 -3.635 1.00 . A A . 21 SER CB 1 1 3 1297 1 1 21 SER H H -9.266 -7.815 -1.491 1.00 . A A . 21 SER H 1 1 3 1298 1 1 21 SER HA H -8.418 -7.485 -4.096 1.00 . A A . 21 SER HA 1 1 3 1299 1 1 21 SER HB2 H -11.113 -8.517 -3.183 1.00 . A A . 21 SER HB2 1 1 3 1300 1 1 21 SER HB3 H -10.266 -8.933 -4.672 1.00 . A A . 21 SER HB3 1 1 3 1301 1 1 21 SER HG H -8.571 -9.761 -3.343 1.00 . A A . 21 SER HG 1 1 3 1302 1 1 21 SER N N -9.005 -7.136 -2.150 1.00 . A A . 21 SER N 1 1 3 1303 1 1 21 SER O O -11.195 -5.837 -3.575 1.00 . A A . 21 SER O 1 1 3 1304 1 1 21 SER OG O -9.460 -9.719 -2.962 1.00 . A A . 21 SER OG 1 1 3 1305 1 1 22 GLY C C -9.367 -3.165 -5.426 1.00 . A A . 22 GLY C 1 1 3 1306 1 1 22 GLY CA C -10.204 -4.390 -5.671 1.00 . A A . 22 GLY CA 1 1 3 1307 1 1 22 GLY H H -8.773 -5.913 -5.524 1.00 . A A . 22 GLY H 1 1 3 1308 1 1 22 GLY HA2 H -10.325 -4.517 -6.736 1.00 . A A . 22 GLY HA2 1 1 3 1309 1 1 22 GLY HA3 H -11.173 -4.243 -5.217 1.00 . A A . 22 GLY HA3 1 1 3 1310 1 1 22 GLY N N -9.598 -5.567 -5.118 1.00 . A A . 22 GLY N 1 1 3 1311 1 1 22 GLY O O -9.633 -2.104 -5.983 1.00 . A A . 22 GLY O 1 1 3 1312 1 1 23 THR C C -6.055 -2.708 -4.721 1.00 . A A . 23 THR C 1 1 3 1313 1 1 23 THR CA C -7.443 -2.215 -4.368 1.00 . A A . 23 THR CA 1 1 3 1314 1 1 23 THR CB C -7.500 -1.679 -2.901 1.00 . A A . 23 THR CB 1 1 3 1315 1 1 23 THR CG2 C -8.892 -1.182 -2.572 1.00 . A A . 23 THR CG2 1 1 3 1316 1 1 23 THR H H -8.210 -4.140 -4.119 1.00 . A A . 23 THR H 1 1 3 1317 1 1 23 THR HA H -7.705 -1.422 -5.053 1.00 . A A . 23 THR HA 1 1 3 1318 1 1 23 THR HB H -6.811 -0.851 -2.808 1.00 . A A . 23 THR HB 1 1 3 1319 1 1 23 THR HG1 H -7.427 -3.558 -2.292 1.00 . A A . 23 THR HG1 1 1 3 1320 1 1 23 THR HG21 H -9.600 -1.989 -2.687 1.00 . A A . 23 THR HG21 1 1 3 1321 1 1 23 THR HG22 H -9.152 -0.375 -3.241 1.00 . A A . 23 THR HG22 1 1 3 1322 1 1 23 THR HG23 H -8.914 -0.824 -1.553 1.00 . A A . 23 THR HG23 1 1 3 1323 1 1 23 THR N N -8.364 -3.293 -4.596 1.00 . A A . 23 THR N 1 1 3 1324 1 1 23 THR O O -5.727 -3.866 -4.461 1.00 . A A . 23 THR O 1 1 3 1325 1 1 23 THR OG1 O -7.145 -2.694 -1.959 1.00 . A A . 23 THR OG1 1 1 3 1326 1 1 24 THR C C -2.860 -1.607 -5.045 1.00 . A A . 24 THR C 1 1 3 1327 1 1 24 THR CA C -3.977 -2.310 -5.786 1.00 . A A . 24 THR CA 1 1 3 1328 1 1 24 THR CB C -3.842 -2.107 -7.314 1.00 . A A . 24 THR CB 1 1 3 1329 1 1 24 THR CG2 C -4.683 -3.128 -8.057 1.00 . A A . 24 THR CG2 1 1 3 1330 1 1 24 THR H H -5.550 -0.948 -5.477 1.00 . A A . 24 THR H 1 1 3 1331 1 1 24 THR HA H -3.900 -3.369 -5.587 1.00 . A A . 24 THR HA 1 1 3 1332 1 1 24 THR HB H -2.806 -2.237 -7.589 1.00 . A A . 24 THR HB 1 1 3 1333 1 1 24 THR HG1 H -4.836 -0.392 -6.999 1.00 . A A . 24 THR HG1 1 1 3 1334 1 1 24 THR HG21 H -5.722 -2.995 -7.794 1.00 . A A . 24 THR HG21 1 1 3 1335 1 1 24 THR HG22 H -4.370 -4.123 -7.777 1.00 . A A . 24 THR HG22 1 1 3 1336 1 1 24 THR HG23 H -4.561 -2.997 -9.122 1.00 . A A . 24 THR HG23 1 1 3 1337 1 1 24 THR N N -5.270 -1.884 -5.333 1.00 . A A . 24 THR N 1 1 3 1338 1 1 24 THR O O -2.931 -0.405 -4.819 1.00 . A A . 24 THR O 1 1 3 1339 1 1 24 THR OG1 O -4.265 -0.771 -7.692 1.00 . A A . 24 THR OG1 1 1 3 1340 1 1 25 CYS C C 0.136 -1.050 -5.010 1.00 . A A . 25 CYS C 1 1 3 1341 1 1 25 CYS CA C -0.706 -1.771 -3.970 1.00 . A A . 25 CYS CA 1 1 3 1342 1 1 25 CYS CB C 0.116 -2.855 -3.247 1.00 . A A . 25 CYS CB 1 1 3 1343 1 1 25 CYS H H -1.881 -3.323 -4.782 1.00 . A A . 25 CYS H 1 1 3 1344 1 1 25 CYS HA H -1.067 -1.048 -3.253 1.00 . A A . 25 CYS HA 1 1 3 1345 1 1 25 CYS HB2 H -0.509 -3.339 -2.512 1.00 . A A . 25 CYS HB2 1 1 3 1346 1 1 25 CYS HB3 H 0.439 -3.586 -3.971 1.00 . A A . 25 CYS HB3 1 1 3 1347 1 1 25 CYS N N -1.856 -2.354 -4.634 1.00 . A A . 25 CYS N 1 1 3 1348 1 1 25 CYS O O 0.884 -1.679 -5.775 1.00 . A A . 25 CYS O 1 1 3 1349 1 1 25 CYS SG S 1.603 -2.239 -2.377 1.00 . A A . 25 CYS SG 1 1 3 1350 1 1 26 GLN C C 1.771 1.791 -5.428 1.00 . A A . 26 GLN C 1 1 3 1351 1 1 26 GLN CA C 0.636 1.048 -6.069 1.00 . A A . 26 GLN CA 1 1 3 1352 1 1 26 GLN CB C -0.329 2.031 -6.735 1.00 . A A . 26 GLN CB 1 1 3 1353 1 1 26 GLN CD C -2.395 2.347 -8.158 1.00 . A A . 26 GLN CD 1 1 3 1354 1 1 26 GLN CG C -1.445 1.360 -7.516 1.00 . A A . 26 GLN CG 1 1 3 1355 1 1 26 GLN H H -0.654 0.688 -4.463 1.00 . A A . 26 GLN H 1 1 3 1356 1 1 26 GLN HA H 1.031 0.389 -6.827 1.00 . A A . 26 GLN HA 1 1 3 1357 1 1 26 GLN HB2 H -0.778 2.650 -5.973 1.00 . A A . 26 GLN HB2 1 1 3 1358 1 1 26 GLN HB3 H 0.228 2.660 -7.414 1.00 . A A . 26 GLN HB3 1 1 3 1359 1 1 26 GLN HE21 H -3.841 1.030 -8.024 1.00 . A A . 26 GLN HE21 1 1 3 1360 1 1 26 GLN HE22 H -4.278 2.548 -8.717 1.00 . A A . 26 GLN HE22 1 1 3 1361 1 1 26 GLN HG2 H -1.008 0.753 -8.295 1.00 . A A . 26 GLN HG2 1 1 3 1362 1 1 26 GLN HG3 H -2.005 0.727 -6.845 1.00 . A A . 26 GLN HG3 1 1 3 1363 1 1 26 GLN N N -0.045 0.243 -5.095 1.00 . A A . 26 GLN N 1 1 3 1364 1 1 26 GLN NE2 N -3.618 1.943 -8.322 1.00 . A A . 26 GLN NE2 1 1 3 1365 1 1 26 GLN O O 1.689 2.198 -4.263 1.00 . A A . 26 GLN O 1 1 3 1366 1 1 26 GLN OE1 O -2.015 3.472 -8.521 1.00 . A A . 26 GLN OE1 1 1 3 1367 1 1 27 VAL C C 3.800 4.147 -6.020 1.00 . A A . 27 VAL C 1 1 3 1368 1 1 27 VAL CA C 3.976 2.662 -5.711 1.00 . A A . 27 VAL CA 1 1 3 1369 1 1 27 VAL CB C 5.260 2.135 -6.413 1.00 . A A . 27 VAL CB 1 1 3 1370 1 1 27 VAL CG1 C 6.492 2.908 -5.978 1.00 . A A . 27 VAL CG1 1 1 3 1371 1 1 27 VAL CG2 C 5.450 0.656 -6.139 1.00 . A A . 27 VAL CG2 1 1 3 1372 1 1 27 VAL H H 2.826 1.598 -7.081 1.00 . A A . 27 VAL H 1 1 3 1373 1 1 27 VAL HA H 4.062 2.497 -4.645 1.00 . A A . 27 VAL HA 1 1 3 1374 1 1 27 VAL HB H 5.138 2.267 -7.478 1.00 . A A . 27 VAL HB 1 1 3 1375 1 1 27 VAL HG11 H 6.358 3.955 -6.208 1.00 . A A . 27 VAL HG11 1 1 3 1376 1 1 27 VAL HG12 H 7.355 2.535 -6.507 1.00 . A A . 27 VAL HG12 1 1 3 1377 1 1 27 VAL HG13 H 6.640 2.791 -4.915 1.00 . A A . 27 VAL HG13 1 1 3 1378 1 1 27 VAL HG21 H 5.547 0.496 -5.075 1.00 . A A . 27 VAL HG21 1 1 3 1379 1 1 27 VAL HG22 H 6.340 0.306 -6.640 1.00 . A A . 27 VAL HG22 1 1 3 1380 1 1 27 VAL HG23 H 4.590 0.117 -6.505 1.00 . A A . 27 VAL HG23 1 1 3 1381 1 1 27 VAL N N 2.820 1.954 -6.168 1.00 . A A . 27 VAL N 1 1 3 1382 1 1 27 VAL O O 3.746 4.545 -7.180 1.00 . A A . 27 VAL O 1 1 3 1383 1 1 28 LEU C C 4.918 6.994 -5.141 1.00 . A A . 28 LEU C 1 1 3 1384 1 1 28 LEU CA C 3.539 6.373 -5.156 1.00 . A A . 28 LEU CA 1 1 3 1385 1 1 28 LEU CB C 2.654 7.016 -4.078 1.00 . A A . 28 LEU CB 1 1 3 1386 1 1 28 LEU CD1 C 0.821 5.338 -3.625 1.00 . A A . 28 LEU CD1 1 1 3 1387 1 1 28 LEU CD2 C 0.362 7.781 -3.449 1.00 . A A . 28 LEU CD2 1 1 3 1388 1 1 28 LEU CG C 1.154 6.711 -4.153 1.00 . A A . 28 LEU CG 1 1 3 1389 1 1 28 LEU H H 3.621 4.543 -4.093 1.00 . A A . 28 LEU H 1 1 3 1390 1 1 28 LEU HA H 3.088 6.560 -6.120 1.00 . A A . 28 LEU HA 1 1 3 1391 1 1 28 LEU HB2 H 3.013 6.679 -3.117 1.00 . A A . 28 LEU HB2 1 1 3 1392 1 1 28 LEU HB3 H 2.786 8.085 -4.125 1.00 . A A . 28 LEU HB3 1 1 3 1393 1 1 28 LEU HD11 H -0.240 5.161 -3.728 1.00 . A A . 28 LEU HD11 1 1 3 1394 1 1 28 LEU HD12 H 1.095 5.288 -2.581 1.00 . A A . 28 LEU HD12 1 1 3 1395 1 1 28 LEU HD13 H 1.371 4.593 -4.181 1.00 . A A . 28 LEU HD13 1 1 3 1396 1 1 28 LEU HD21 H 0.658 7.828 -2.411 1.00 . A A . 28 LEU HD21 1 1 3 1397 1 1 28 LEU HD22 H -0.691 7.560 -3.533 1.00 . A A . 28 LEU HD22 1 1 3 1398 1 1 28 LEU HD23 H 0.589 8.718 -3.935 1.00 . A A . 28 LEU HD23 1 1 3 1399 1 1 28 LEU HG H 0.862 6.718 -5.193 1.00 . A A . 28 LEU HG 1 1 3 1400 1 1 28 LEU N N 3.648 4.941 -4.992 1.00 . A A . 28 LEU N 1 1 3 1401 1 1 28 LEU O O 5.227 7.876 -5.927 1.00 . A A . 28 LEU O 1 1 3 1402 1 1 29 ASN C C 7.858 5.645 -3.722 1.00 . A A . 29 ASN C 1 1 3 1403 1 1 29 ASN CA C 7.126 6.943 -4.025 1.00 . A A . 29 ASN CA 1 1 3 1404 1 1 29 ASN CB C 7.308 7.890 -2.784 1.00 . A A . 29 ASN CB 1 1 3 1405 1 1 29 ASN CG C 6.737 9.317 -2.856 1.00 . A A . 29 ASN CG 1 1 3 1406 1 1 29 ASN H H 5.408 5.807 -3.630 1.00 . A A . 29 ASN H 1 1 3 1407 1 1 29 ASN HA H 7.502 7.398 -4.931 1.00 . A A . 29 ASN HA 1 1 3 1408 1 1 29 ASN HB2 H 6.847 7.422 -1.930 1.00 . A A . 29 ASN HB2 1 1 3 1409 1 1 29 ASN HB3 H 8.367 7.961 -2.588 1.00 . A A . 29 ASN HB3 1 1 3 1410 1 1 29 ASN HD21 H 5.322 8.774 -4.093 1.00 . A A . 29 ASN HD21 1 1 3 1411 1 1 29 ASN HD22 H 5.308 10.425 -3.618 1.00 . A A . 29 ASN HD22 1 1 3 1412 1 1 29 ASN N N 5.726 6.532 -4.215 1.00 . A A . 29 ASN N 1 1 3 1413 1 1 29 ASN ND2 N 5.700 9.528 -3.591 1.00 . A A . 29 ASN ND2 1 1 3 1414 1 1 29 ASN O O 7.189 4.656 -3.473 1.00 . A A . 29 ASN O 1 1 3 1415 1 1 29 ASN OD1 O 7.270 10.236 -2.222 1.00 . A A . 29 ASN OD1 1 1 3 1416 1 1 30 PRO C C 9.548 3.836 -1.946 1.00 . A A . 30 PRO C 1 1 3 1417 1 1 30 PRO CA C 9.922 4.341 -3.354 1.00 . A A . 30 PRO CA 1 1 3 1418 1 1 30 PRO CB C 11.402 4.754 -3.397 1.00 . A A . 30 PRO CB 1 1 3 1419 1 1 30 PRO CD C 10.147 6.685 -4.030 1.00 . A A . 30 PRO CD 1 1 3 1420 1 1 30 PRO CG C 11.434 5.957 -4.277 1.00 . A A . 30 PRO CG 1 1 3 1421 1 1 30 PRO HA H 9.727 3.564 -4.079 1.00 . A A . 30 PRO HA 1 1 3 1422 1 1 30 PRO HB2 H 11.739 4.983 -2.397 1.00 . A A . 30 PRO HB2 1 1 3 1423 1 1 30 PRO HB3 H 11.995 3.949 -3.806 1.00 . A A . 30 PRO HB3 1 1 3 1424 1 1 30 PRO HD2 H 10.265 7.365 -3.201 1.00 . A A . 30 PRO HD2 1 1 3 1425 1 1 30 PRO HD3 H 9.825 7.215 -4.913 1.00 . A A . 30 PRO HD3 1 1 3 1426 1 1 30 PRO HG2 H 12.273 6.583 -4.011 1.00 . A A . 30 PRO HG2 1 1 3 1427 1 1 30 PRO HG3 H 11.506 5.660 -5.313 1.00 . A A . 30 PRO HG3 1 1 3 1428 1 1 30 PRO N N 9.206 5.592 -3.693 1.00 . A A . 30 PRO N 1 1 3 1429 1 1 30 PRO O O 9.559 2.638 -1.662 1.00 . A A . 30 PRO O 1 1 3 1430 1 1 31 TYR C C 7.317 4.448 0.438 1.00 . A A . 31 TYR C 1 1 3 1431 1 1 31 TYR CA C 8.834 4.402 0.276 1.00 . A A . 31 TYR CA 1 1 3 1432 1 1 31 TYR CB C 9.481 5.386 1.257 1.00 . A A . 31 TYR CB 1 1 3 1433 1 1 31 TYR CD1 C 11.588 6.304 0.213 1.00 . A A . 31 TYR CD1 1 1 3 1434 1 1 31 TYR CD2 C 11.811 4.725 1.973 1.00 . A A . 31 TYR CD2 1 1 3 1435 1 1 31 TYR CE1 C 12.952 6.387 0.105 1.00 . A A . 31 TYR CE1 1 1 3 1436 1 1 31 TYR CE2 C 13.184 4.804 1.869 1.00 . A A . 31 TYR CE2 1 1 3 1437 1 1 31 TYR CG C 10.988 5.472 1.147 1.00 . A A . 31 TYR CG 1 1 3 1438 1 1 31 TYR CZ C 13.747 5.638 0.932 1.00 . A A . 31 TYR CZ 1 1 3 1439 1 1 31 TYR H H 9.218 5.697 -1.360 1.00 . A A . 31 TYR H 1 1 3 1440 1 1 31 TYR HA H 9.200 3.409 0.489 1.00 . A A . 31 TYR HA 1 1 3 1441 1 1 31 TYR HB2 H 9.083 6.372 1.069 1.00 . A A . 31 TYR HB2 1 1 3 1442 1 1 31 TYR HB3 H 9.231 5.094 2.265 1.00 . A A . 31 TYR HB3 1 1 3 1443 1 1 31 TYR HD1 H 10.960 6.893 -0.440 1.00 . A A . 31 TYR HD1 1 1 3 1444 1 1 31 TYR HD2 H 11.365 4.070 2.706 1.00 . A A . 31 TYR HD2 1 1 3 1445 1 1 31 TYR HE1 H 13.396 7.040 -0.630 1.00 . A A . 31 TYR HE1 1 1 3 1446 1 1 31 TYR HE2 H 13.809 4.213 2.521 1.00 . A A . 31 TYR HE2 1 1 3 1447 1 1 31 TYR HH H 15.482 4.838 0.875 1.00 . A A . 31 TYR HH 1 1 3 1448 1 1 31 TYR N N 9.203 4.761 -1.073 1.00 . A A . 31 TYR N 1 1 3 1449 1 1 31 TYR O O 6.743 3.744 1.272 1.00 . A A . 31 TYR O 1 1 3 1450 1 1 31 TYR OH O 15.114 5.730 0.823 1.00 . A A . 31 TYR OH 1 1 3 1451 1 1 32 TYR C C 4.571 4.408 -1.259 1.00 . A A . 32 TYR C 1 1 3 1452 1 1 32 TYR CA C 5.233 5.382 -0.297 1.00 . A A . 32 TYR CA 1 1 3 1453 1 1 32 TYR CB C 4.814 6.829 -0.636 1.00 . A A . 32 TYR CB 1 1 3 1454 1 1 32 TYR CD1 C 2.496 6.313 0.300 1.00 . A A . 32 TYR CD1 1 1 3 1455 1 1 32 TYR CD2 C 2.950 8.521 -0.459 1.00 . A A . 32 TYR CD2 1 1 3 1456 1 1 32 TYR CE1 C 1.225 6.693 0.659 1.00 . A A . 32 TYR CE1 1 1 3 1457 1 1 32 TYR CE2 C 1.672 8.907 -0.108 1.00 . A A . 32 TYR CE2 1 1 3 1458 1 1 32 TYR CG C 3.388 7.221 -0.263 1.00 . A A . 32 TYR CG 1 1 3 1459 1 1 32 TYR CZ C 0.817 7.991 0.455 1.00 . A A . 32 TYR CZ 1 1 3 1460 1 1 32 TYR H H 7.162 5.731 -1.068 1.00 . A A . 32 TYR H 1 1 3 1461 1 1 32 TYR HA H 4.930 5.158 0.714 1.00 . A A . 32 TYR HA 1 1 3 1462 1 1 32 TYR HB2 H 5.478 7.534 -0.159 1.00 . A A . 32 TYR HB2 1 1 3 1463 1 1 32 TYR HB3 H 4.904 6.952 -1.705 1.00 . A A . 32 TYR HB3 1 1 3 1464 1 1 32 TYR HD1 H 2.817 5.294 0.462 1.00 . A A . 32 TYR HD1 1 1 3 1465 1 1 32 TYR HD2 H 3.623 9.237 -0.907 1.00 . A A . 32 TYR HD2 1 1 3 1466 1 1 32 TYR HE1 H 0.548 5.969 1.087 1.00 . A A . 32 TYR HE1 1 1 3 1467 1 1 32 TYR HE2 H 1.351 9.925 -0.270 1.00 . A A . 32 TYR HE2 1 1 3 1468 1 1 32 TYR HH H -0.875 8.848 0.105 1.00 . A A . 32 TYR HH 1 1 3 1469 1 1 32 TYR N N 6.667 5.247 -0.378 1.00 . A A . 32 TYR N 1 1 3 1470 1 1 32 TYR O O 4.674 4.555 -2.463 1.00 . A A . 32 TYR O 1 1 3 1471 1 1 32 TYR OH O -0.456 8.375 0.838 1.00 . A A . 32 TYR OH 1 1 3 1472 1 1 33 SER C C 1.804 2.383 -0.895 1.00 . A A . 33 SER C 1 1 3 1473 1 1 33 SER CA C 3.131 2.568 -1.575 1.00 . A A . 33 SER CA 1 1 3 1474 1 1 33 SER CB C 3.881 1.245 -1.744 1.00 . A A . 33 SER CB 1 1 3 1475 1 1 33 SER H H 3.832 3.351 0.220 1.00 . A A . 33 SER H 1 1 3 1476 1 1 33 SER HA H 2.973 3.040 -2.534 1.00 . A A . 33 SER HA 1 1 3 1477 1 1 33 SER HB2 H 3.847 0.663 -0.835 1.00 . A A . 33 SER HB2 1 1 3 1478 1 1 33 SER HB3 H 3.416 0.706 -2.556 1.00 . A A . 33 SER HB3 1 1 3 1479 1 1 33 SER HG H 5.317 2.343 -2.523 1.00 . A A . 33 SER HG 1 1 3 1480 1 1 33 SER N N 3.874 3.470 -0.751 1.00 . A A . 33 SER N 1 1 3 1481 1 1 33 SER O O 1.767 2.124 0.304 1.00 . A A . 33 SER O 1 1 3 1482 1 1 33 SER OG O 5.238 1.479 -2.107 1.00 . A A . 33 SER OG 1 1 3 1483 1 1 34 GLN C C -1.571 1.754 -1.827 1.00 . A A . 34 GLN C 1 1 3 1484 1 1 34 GLN CA C -0.575 2.559 -1.009 1.00 . A A . 34 GLN CA 1 1 3 1485 1 1 34 GLN CB C -1.023 4.023 -0.841 1.00 . A A . 34 GLN CB 1 1 3 1486 1 1 34 GLN CD C -2.767 5.679 -0.151 1.00 . A A . 34 GLN CD 1 1 3 1487 1 1 34 GLN CG C -2.417 4.224 -0.299 1.00 . A A . 34 GLN CG 1 1 3 1488 1 1 34 GLN H H 0.819 2.623 -2.594 1.00 . A A . 34 GLN H 1 1 3 1489 1 1 34 GLN HA H -0.496 2.116 -0.029 1.00 . A A . 34 GLN HA 1 1 3 1490 1 1 34 GLN HB2 H -0.340 4.496 -0.152 1.00 . A A . 34 GLN HB2 1 1 3 1491 1 1 34 GLN HB3 H -0.944 4.537 -1.786 1.00 . A A . 34 GLN HB3 1 1 3 1492 1 1 34 GLN HE21 H -2.113 5.699 1.710 1.00 . A A . 34 GLN HE21 1 1 3 1493 1 1 34 GLN HE22 H -2.729 7.186 1.093 1.00 . A A . 34 GLN HE22 1 1 3 1494 1 1 34 GLN HG2 H -3.122 3.765 -0.976 1.00 . A A . 34 GLN HG2 1 1 3 1495 1 1 34 GLN HG3 H -2.487 3.748 0.668 1.00 . A A . 34 GLN HG3 1 1 3 1496 1 1 34 GLN N N 0.737 2.545 -1.614 1.00 . A A . 34 GLN N 1 1 3 1497 1 1 34 GLN NE2 N -2.514 6.234 0.993 1.00 . A A . 34 GLN NE2 1 1 3 1498 1 1 34 GLN O O -1.448 1.666 -3.055 1.00 . A A . 34 GLN O 1 1 3 1499 1 1 34 GLN OE1 O -3.279 6.295 -1.059 1.00 . A A . 34 GLN OE1 1 1 3 1500 1 1 35 CYS C C -4.577 1.335 -2.366 1.00 . A A . 35 CYS C 1 1 3 1501 1 1 35 CYS CA C -3.557 0.387 -1.776 1.00 . A A . 35 CYS CA 1 1 3 1502 1 1 35 CYS CB C -4.244 -0.528 -0.775 1.00 . A A . 35 CYS CB 1 1 3 1503 1 1 35 CYS H H -2.523 1.187 -0.161 1.00 . A A . 35 CYS H 1 1 3 1504 1 1 35 CYS HA H -3.121 -0.212 -2.561 1.00 . A A . 35 CYS HA 1 1 3 1505 1 1 35 CYS HB2 H -4.832 0.054 -0.085 1.00 . A A . 35 CYS HB2 1 1 3 1506 1 1 35 CYS HB3 H -4.908 -1.173 -1.327 1.00 . A A . 35 CYS HB3 1 1 3 1507 1 1 35 CYS N N -2.519 1.140 -1.140 1.00 . A A . 35 CYS N 1 1 3 1508 1 1 35 CYS O O -5.326 2.012 -1.627 1.00 . A A . 35 CYS O 1 1 3 1509 1 1 35 CYS SG S -3.113 -1.586 0.167 1.00 . A A . 35 CYS SG 1 1 3 1510 1 1 36 LEU C C -6.340 1.322 -5.208 1.00 . A A . 36 LEU C 1 1 3 1511 1 1 36 LEU CA C -5.469 2.229 -4.390 1.00 . A A . 36 LEU CA 1 1 3 1512 1 1 36 LEU CB C -4.717 3.232 -5.272 1.00 . A A . 36 LEU CB 1 1 3 1513 1 1 36 LEU CD1 C -3.159 5.179 -5.515 1.00 . A A . 36 LEU CD1 1 1 3 1514 1 1 36 LEU CD2 C -4.763 5.110 -3.610 1.00 . A A . 36 LEU CD2 1 1 3 1515 1 1 36 LEU CG C -3.880 4.279 -4.532 1.00 . A A . 36 LEU CG 1 1 3 1516 1 1 36 LEU H H -3.908 0.892 -4.158 1.00 . A A . 36 LEU H 1 1 3 1517 1 1 36 LEU HA H -6.091 2.763 -3.688 1.00 . A A . 36 LEU HA 1 1 3 1518 1 1 36 LEU HB2 H -4.062 2.677 -5.928 1.00 . A A . 36 LEU HB2 1 1 3 1519 1 1 36 LEU HB3 H -5.441 3.754 -5.878 1.00 . A A . 36 LEU HB3 1 1 3 1520 1 1 36 LEU HD11 H -2.507 4.586 -6.140 1.00 . A A . 36 LEU HD11 1 1 3 1521 1 1 36 LEU HD12 H -2.575 5.909 -4.975 1.00 . A A . 36 LEU HD12 1 1 3 1522 1 1 36 LEU HD13 H -3.883 5.688 -6.134 1.00 . A A . 36 LEU HD13 1 1 3 1523 1 1 36 LEU HD21 H -5.211 4.471 -2.861 1.00 . A A . 36 LEU HD21 1 1 3 1524 1 1 36 LEU HD22 H -5.543 5.585 -4.184 1.00 . A A . 36 LEU HD22 1 1 3 1525 1 1 36 LEU HD23 H -4.163 5.864 -3.123 1.00 . A A . 36 LEU HD23 1 1 3 1526 1 1 36 LEU HG H -3.137 3.779 -3.928 1.00 . A A . 36 LEU HG 1 1 3 1527 1 1 36 LEU N N -4.567 1.422 -3.652 1.00 . A A . 36 LEU N 1 1 3 1528 1 1 36 LEU O O -5.825 0.659 -6.129 1.00 . A A . 36 LEU O 1 1 3 1529 1 1 36 LEU OXT O -7.536 1.228 -4.914 1.00 . A A . 36 LEU OXT 1 1 3 1530 2 2 1 MAN C1 C 9.470 -4.085 9.822 1.00 . B A . 101 MAN C1 1 1 3 1531 2 2 1 MAN C2 C 9.156 -3.191 11.050 1.00 . B A . 101 MAN C2 1 1 3 1532 2 2 1 MAN C3 C 9.503 -1.739 10.750 1.00 . B A . 101 MAN C3 1 1 3 1533 2 2 1 MAN C4 C 10.966 -1.646 10.325 1.00 . B A . 101 MAN C4 1 1 3 1534 2 2 1 MAN C5 C 11.218 -2.566 9.134 1.00 . B A . 101 MAN C5 1 1 3 1535 2 2 1 MAN C6 C 12.662 -2.594 8.694 1.00 . B A . 101 MAN C6 1 1 3 1536 2 2 1 MAN H1 H 9.321 -5.139 10.100 1.00 . B A . 101 MAN H1 1 1 3 1537 2 2 1 MAN H2 H 8.091 -3.243 11.317 1.00 . B A . 101 MAN H2 1 1 3 1538 2 2 1 MAN H3 H 8.848 -1.380 9.942 1.00 . B A . 101 MAN H3 1 1 3 1539 2 2 1 MAN H4 H 11.601 -1.976 11.161 1.00 . B A . 101 MAN H4 1 1 3 1540 2 2 1 MAN H5 H 10.583 -2.243 8.294 1.00 . B A . 101 MAN H5 1 1 3 1541 2 2 1 MAN H61 H 13.279 -2.814 9.576 1.00 . B A . 101 MAN H61 1 1 3 1542 2 2 1 MAN H62 H 12.938 -1.592 8.331 1.00 . B A . 101 MAN H62 1 1 3 1543 2 2 1 MAN HO2 H 9.740 -2.934 12.836 1.00 . B A . 101 MAN HO2 1 1 3 1544 2 2 1 MAN HO3 H 9.479 -0.051 11.738 1.00 . B A . 101 MAN HO3 1 1 3 1545 2 2 1 MAN HO4 H 11.170 0.240 10.749 1.00 . B A . 101 MAN HO4 1 1 3 1546 2 2 1 MAN HO6 H 11.972 -3.896 7.426 1.00 . B A . 101 MAN HO6 1 1 3 1547 2 2 1 MAN O2 O 9.922 -3.598 12.158 1.00 . B A . 101 MAN O2 1 1 3 1548 2 2 1 MAN O3 O 9.321 -0.981 11.943 1.00 . B A . 101 MAN O3 1 1 3 1549 2 2 1 MAN O4 O 11.279 -0.319 9.973 1.00 . B A . 101 MAN O4 1 1 3 1550 2 2 1 MAN O5 O 10.851 -3.935 9.472 1.00 . B A . 101 MAN O5 1 1 3 1551 2 2 1 MAN O6 O 12.851 -3.571 7.666 1.00 . B A . 101 MAN O6 1 1 4 1552 1 1 1 THR C C -5.183 -5.816 4.253 1.00 . A A . 1 THR C 1 1 4 1553 1 1 1 THR CA C -5.198 -7.288 3.866 1.00 . A A . 1 THR CA 1 1 4 1554 1 1 1 THR CB C -6.025 -7.503 2.603 1.00 . A A . 1 THR CB 1 1 4 1555 1 1 1 THR CG2 C -5.744 -8.867 1.984 1.00 . A A . 1 THR CG2 1 1 4 1556 1 1 1 THR H1 H -6.776 -7.760 5.017 1.00 . A A . 1 THR H1 1 1 4 1557 1 1 1 THR H2 H -5.302 -7.814 5.828 1.00 . A A . 1 THR H2 1 1 4 1558 1 1 1 THR H3 H -5.724 -9.071 4.765 1.00 . A A . 1 THR H3 1 1 4 1559 1 1 1 THR HA H -4.187 -7.628 3.696 1.00 . A A . 1 THR HA 1 1 4 1560 1 1 1 THR HB H -5.776 -6.727 1.893 1.00 . A A . 1 THR HB 1 1 4 1561 1 1 1 THR HG1 H -7.936 -7.850 2.267 1.00 . A A . 1 THR HG1 1 1 4 1562 1 1 1 THR HG21 H -6.010 -9.642 2.686 1.00 . A A . 1 THR HG21 1 1 4 1563 1 1 1 THR HG22 H -4.694 -8.941 1.744 1.00 . A A . 1 THR HG22 1 1 4 1564 1 1 1 THR HG23 H -6.326 -8.979 1.080 1.00 . A A . 1 THR HG23 1 1 4 1565 1 1 1 THR N N -5.781 -8.050 4.938 1.00 . A A . 1 THR N 1 1 4 1566 1 1 1 THR O O -5.889 -5.418 5.188 1.00 . A A . 1 THR O 1 1 4 1567 1 1 1 THR OG1 O -7.415 -7.398 2.941 1.00 . A A . 1 THR OG1 1 1 4 1568 1 1 2 GLN C C -5.331 -2.781 3.192 1.00 . A A . 2 GLN C 1 1 4 1569 1 1 2 GLN CA C -4.240 -3.625 3.916 1.00 . A A . 2 GLN CA 1 1 4 1570 1 1 2 GLN CB C -2.792 -3.188 3.601 1.00 . A A . 2 GLN CB 1 1 4 1571 1 1 2 GLN CD C -2.832 -0.694 4.145 1.00 . A A . 2 GLN CD 1 1 4 1572 1 1 2 GLN CG C -2.250 -2.041 4.467 1.00 . A A . 2 GLN CG 1 1 4 1573 1 1 2 GLN H H -3.862 -5.385 2.821 1.00 . A A . 2 GLN H 1 1 4 1574 1 1 2 GLN HA H -4.415 -3.545 4.979 1.00 . A A . 2 GLN HA 1 1 4 1575 1 1 2 GLN HB2 H -2.153 -4.046 3.755 1.00 . A A . 2 GLN HB2 1 1 4 1576 1 1 2 GLN HB3 H -2.725 -2.911 2.561 1.00 . A A . 2 GLN HB3 1 1 4 1577 1 1 2 GLN HE21 H -2.878 -1.120 2.218 1.00 . A A . 2 GLN HE21 1 1 4 1578 1 1 2 GLN HE22 H -3.504 0.402 2.675 1.00 . A A . 2 GLN HE22 1 1 4 1579 1 1 2 GLN HG2 H -2.479 -2.262 5.499 1.00 . A A . 2 GLN HG2 1 1 4 1580 1 1 2 GLN HG3 H -1.175 -1.996 4.352 1.00 . A A . 2 GLN HG3 1 1 4 1581 1 1 2 GLN N N -4.384 -5.021 3.574 1.00 . A A . 2 GLN N 1 1 4 1582 1 1 2 GLN NE2 N -3.081 -0.450 2.903 1.00 . A A . 2 GLN NE2 1 1 4 1583 1 1 2 GLN O O -5.728 -3.093 2.063 1.00 . A A . 2 GLN O 1 1 4 1584 1 1 2 GLN OE1 O -3.010 0.147 5.014 1.00 . A A . 2 GLN OE1 1 1 4 1585 1 1 3 SER C C -6.668 0.035 2.261 1.00 . A A . 3 SER C 1 1 4 1586 1 1 3 SER CA C -6.938 -0.916 3.470 1.00 . A A . 3 SER CA 1 1 4 1587 1 1 3 SER CB C -7.321 -0.092 4.685 1.00 . A A . 3 SER CB 1 1 4 1588 1 1 3 SER H H -5.365 -1.492 4.712 1.00 . A A . 3 SER H 1 1 4 1589 1 1 3 SER HA H -7.775 -1.559 3.245 1.00 . A A . 3 SER HA 1 1 4 1590 1 1 3 SER HB2 H -6.584 0.681 4.838 1.00 . A A . 3 SER HB2 1 1 4 1591 1 1 3 SER HB3 H -8.295 0.351 4.533 1.00 . A A . 3 SER HB3 1 1 4 1592 1 1 3 SER HG H -8.272 -0.878 6.182 1.00 . A A . 3 SER HG 1 1 4 1593 1 1 3 SER N N -5.799 -1.745 3.870 1.00 . A A . 3 SER N 1 1 4 1594 1 1 3 SER O O -5.519 0.373 1.932 1.00 . A A . 3 SER O 1 1 4 1595 1 1 3 SER OG O -7.370 -0.926 5.840 1.00 . A A . 3 SER OG 1 1 4 1596 1 1 4 HIS C C -7.226 2.776 1.006 1.00 . A A . 4 HIS C 1 1 4 1597 1 1 4 HIS CA C -7.715 1.411 0.507 1.00 . A A . 4 HIS CA 1 1 4 1598 1 1 4 HIS CB C -9.136 1.512 -0.088 1.00 . A A . 4 HIS CB 1 1 4 1599 1 1 4 HIS CD2 C -8.482 2.527 -2.422 1.00 . A A . 4 HIS CD2 1 1 4 1600 1 1 4 HIS CE1 C -10.390 3.498 -2.857 1.00 . A A . 4 HIS CE1 1 1 4 1601 1 1 4 HIS CG C -9.302 2.323 -1.357 1.00 . A A . 4 HIS CG 1 1 4 1602 1 1 4 HIS H H -8.632 0.197 1.972 1.00 . A A . 4 HIS H 1 1 4 1603 1 1 4 HIS HA H -7.033 1.028 -0.237 1.00 . A A . 4 HIS HA 1 1 4 1604 1 1 4 HIS HB2 H -9.501 0.520 -0.301 1.00 . A A . 4 HIS HB2 1 1 4 1605 1 1 4 HIS HB3 H -9.779 1.950 0.663 1.00 . A A . 4 HIS HB3 1 1 4 1606 1 1 4 HIS HD1 H -11.273 2.972 -1.091 1.00 . A A . 4 HIS HD1 1 1 4 1607 1 1 4 HIS HD2 H -7.465 2.175 -2.521 1.00 . A A . 4 HIS HD2 1 1 4 1608 1 1 4 HIS HE1 H -11.169 4.061 -3.347 1.00 . A A . 4 HIS HE1 1 1 4 1609 1 1 4 HIS HE2 H -9.006 3.259 -4.312 1.00 . A A . 4 HIS HE2 1 1 4 1610 1 1 4 HIS N N -7.753 0.487 1.640 1.00 . A A . 4 HIS N 1 1 4 1611 1 1 4 HIS ND1 N -10.476 2.948 -1.669 1.00 . A A . 4 HIS ND1 1 1 4 1612 1 1 4 HIS NE2 N -9.187 3.262 -3.340 1.00 . A A . 4 HIS NE2 1 1 4 1613 1 1 4 HIS O O -7.702 3.268 2.036 1.00 . A A . 4 HIS O 1 1 4 1614 1 1 5 TYR C C -4.698 4.506 1.860 1.00 . A A . 5 TYR C 1 1 4 1615 1 1 5 TYR CA C -5.616 4.636 0.649 1.00 . A A . 5 TYR CA 1 1 4 1616 1 1 5 TYR CB C -6.607 5.812 0.799 1.00 . A A . 5 TYR CB 1 1 4 1617 1 1 5 TYR CD1 C -6.373 7.043 -1.376 1.00 . A A . 5 TYR CD1 1 1 4 1618 1 1 5 TYR CD2 C -8.463 6.021 -0.898 1.00 . A A . 5 TYR CD2 1 1 4 1619 1 1 5 TYR CE1 C -6.853 7.482 -2.589 1.00 . A A . 5 TYR CE1 1 1 4 1620 1 1 5 TYR CE2 C -8.955 6.465 -2.111 1.00 . A A . 5 TYR CE2 1 1 4 1621 1 1 5 TYR CG C -7.165 6.301 -0.513 1.00 . A A . 5 TYR CG 1 1 4 1622 1 1 5 TYR CZ C -8.143 7.192 -2.952 1.00 . A A . 5 TYR CZ 1 1 4 1623 1 1 5 TYR H H -5.936 2.910 -0.529 1.00 . A A . 5 TYR H 1 1 4 1624 1 1 5 TYR HA H -4.960 4.845 -0.185 1.00 . A A . 5 TYR HA 1 1 4 1625 1 1 5 TYR HB2 H -7.434 5.503 1.421 1.00 . A A . 5 TYR HB2 1 1 4 1626 1 1 5 TYR HB3 H -6.095 6.636 1.276 1.00 . A A . 5 TYR HB3 1 1 4 1627 1 1 5 TYR HD1 H -5.357 7.270 -1.090 1.00 . A A . 5 TYR HD1 1 1 4 1628 1 1 5 TYR HD2 H -9.099 5.452 -0.234 1.00 . A A . 5 TYR HD2 1 1 4 1629 1 1 5 TYR HE1 H -6.219 8.058 -3.246 1.00 . A A . 5 TYR HE1 1 1 4 1630 1 1 5 TYR HE2 H -9.970 6.238 -2.399 1.00 . A A . 5 TYR HE2 1 1 4 1631 1 1 5 TYR HH H -9.494 7.994 -4.077 1.00 . A A . 5 TYR HH 1 1 4 1632 1 1 5 TYR N N -6.258 3.355 0.289 1.00 . A A . 5 TYR N 1 1 4 1633 1 1 5 TYR O O -4.322 5.494 2.478 1.00 . A A . 5 TYR O 1 1 4 1634 1 1 5 TYR OH O -8.616 7.606 -4.178 1.00 . A A . 5 TYR OH 1 1 4 1635 1 1 6 GLY C C -2.083 2.565 2.614 1.00 . A A . 6 GLY C 1 1 4 1636 1 1 6 GLY CA C -3.380 3.058 3.213 1.00 . A A . 6 GLY CA 1 1 4 1637 1 1 6 GLY H H -4.712 2.532 1.689 1.00 . A A . 6 GLY H 1 1 4 1638 1 1 6 GLY HA2 H -3.204 3.980 3.747 1.00 . A A . 6 GLY HA2 1 1 4 1639 1 1 6 GLY HA3 H -3.760 2.310 3.891 1.00 . A A . 6 GLY HA3 1 1 4 1640 1 1 6 GLY N N -4.332 3.294 2.171 1.00 . A A . 6 GLY N 1 1 4 1641 1 1 6 GLY O O -2.068 2.134 1.443 1.00 . A A . 6 GLY O 1 1 4 1642 1 1 7 GLN C C 0.404 0.654 3.048 1.00 . A A . 7 GLN C 1 1 4 1643 1 1 7 GLN CA C 0.284 2.168 2.944 1.00 . A A . 7 GLN CA 1 1 4 1644 1 1 7 GLN CB C 1.384 2.863 3.763 1.00 . A A . 7 GLN CB 1 1 4 1645 1 1 7 GLN CD C 3.851 3.246 4.199 1.00 . A A . 7 GLN CD 1 1 4 1646 1 1 7 GLN CG C 2.818 2.497 3.368 1.00 . A A . 7 GLN CG 1 1 4 1647 1 1 7 GLN H H -1.139 2.897 4.317 1.00 . A A . 7 GLN H 1 1 4 1648 1 1 7 GLN HA H 0.387 2.451 1.907 1.00 . A A . 7 GLN HA 1 1 4 1649 1 1 7 GLN HB2 H 1.275 3.930 3.647 1.00 . A A . 7 GLN HB2 1 1 4 1650 1 1 7 GLN HB3 H 1.249 2.614 4.805 1.00 . A A . 7 GLN HB3 1 1 4 1651 1 1 7 GLN HE21 H 5.224 3.191 2.731 1.00 . A A . 7 GLN HE21 1 1 4 1652 1 1 7 GLN HE22 H 5.697 3.948 4.184 1.00 . A A . 7 GLN HE22 1 1 4 1653 1 1 7 GLN HG2 H 2.962 1.435 3.518 1.00 . A A . 7 GLN HG2 1 1 4 1654 1 1 7 GLN HG3 H 2.971 2.736 2.326 1.00 . A A . 7 GLN HG3 1 1 4 1655 1 1 7 GLN N N -1.026 2.599 3.390 1.00 . A A . 7 GLN N 1 1 4 1656 1 1 7 GLN NE2 N 5.017 3.483 3.644 1.00 . A A . 7 GLN NE2 1 1 4 1657 1 1 7 GLN O O 0.444 0.103 4.143 1.00 . A A . 7 GLN O 1 1 4 1658 1 1 7 GLN OE1 O 3.596 3.607 5.340 1.00 . A A . 7 GLN OE1 1 1 4 1659 1 1 8 CYS C C 1.927 -1.951 2.188 1.00 . A A . 8 CYS C 1 1 4 1660 1 1 8 CYS CA C 0.543 -1.454 1.821 1.00 . A A . 8 CYS CA 1 1 4 1661 1 1 8 CYS CB C 0.144 -1.919 0.427 1.00 . A A . 8 CYS CB 1 1 4 1662 1 1 8 CYS H H 0.410 0.517 1.068 1.00 . A A . 8 CYS H 1 1 4 1663 1 1 8 CYS HA H -0.154 -1.873 2.532 1.00 . A A . 8 CYS HA 1 1 4 1664 1 1 8 CYS HB2 H 0.502 -2.925 0.269 1.00 . A A . 8 CYS HB2 1 1 4 1665 1 1 8 CYS HB3 H -0.933 -1.902 0.342 1.00 . A A . 8 CYS HB3 1 1 4 1666 1 1 8 CYS N N 0.445 0.002 1.904 1.00 . A A . 8 CYS N 1 1 4 1667 1 1 8 CYS O O 2.071 -2.945 2.886 1.00 . A A . 8 CYS O 1 1 4 1668 1 1 8 CYS SG S 0.817 -0.869 -0.906 1.00 . A A . 8 CYS SG 1 1 4 1669 1 1 9 GLY C C 5.307 -1.260 1.095 1.00 . A A . 9 GLY C 1 1 4 1670 1 1 9 GLY CA C 4.268 -1.673 2.077 1.00 . A A . 9 GLY CA 1 1 4 1671 1 1 9 GLY H H 2.790 -0.513 1.120 1.00 . A A . 9 GLY H 1 1 4 1672 1 1 9 GLY HA2 H 4.514 -1.216 3.023 1.00 . A A . 9 GLY HA2 1 1 4 1673 1 1 9 GLY HA3 H 4.297 -2.745 2.193 1.00 . A A . 9 GLY HA3 1 1 4 1674 1 1 9 GLY N N 2.947 -1.268 1.723 1.00 . A A . 9 GLY N 1 1 4 1675 1 1 9 GLY O O 5.495 -1.904 0.062 1.00 . A A . 9 GLY O 1 1 4 1676 1 1 10 GLY C C 8.292 0.131 1.442 1.00 . A A . 10 GLY C 1 1 4 1677 1 1 10 GLY CA C 7.053 0.281 0.614 1.00 . A A . 10 GLY CA 1 1 4 1678 1 1 10 GLY H H 5.690 0.326 2.193 1.00 . A A . 10 GLY H 1 1 4 1679 1 1 10 GLY HA2 H 7.129 -0.311 -0.287 1.00 . A A . 10 GLY HA2 1 1 4 1680 1 1 10 GLY HA3 H 6.924 1.322 0.358 1.00 . A A . 10 GLY HA3 1 1 4 1681 1 1 10 GLY N N 5.943 -0.170 1.391 1.00 . A A . 10 GLY N 1 1 4 1682 1 1 10 GLY O O 8.339 -0.723 2.334 1.00 . A A . 10 GLY O 1 1 4 1683 1 1 11 ILE C C 10.071 1.489 3.409 1.00 . A A . 11 ILE C 1 1 4 1684 1 1 11 ILE CA C 10.453 0.900 2.037 1.00 . A A . 11 ILE CA 1 1 4 1685 1 1 11 ILE CB C 11.633 1.696 1.422 1.00 . A A . 11 ILE CB 1 1 4 1686 1 1 11 ILE CD1 C 13.013 1.994 -0.720 1.00 . A A . 11 ILE CD1 1 1 4 1687 1 1 11 ILE CG1 C 11.933 1.202 -0.004 1.00 . A A . 11 ILE CG1 1 1 4 1688 1 1 11 ILE CG2 C 12.877 1.547 2.301 1.00 . A A . 11 ILE CG2 1 1 4 1689 1 1 11 ILE H H 9.231 1.557 0.444 1.00 . A A . 11 ILE H 1 1 4 1690 1 1 11 ILE HA H 10.735 -0.136 2.169 1.00 . A A . 11 ILE HA 1 1 4 1691 1 1 11 ILE HB H 11.366 2.743 1.385 1.00 . A A . 11 ILE HB 1 1 4 1692 1 1 11 ILE HD11 H 12.721 3.032 -0.782 1.00 . A A . 11 ILE HD11 1 1 4 1693 1 1 11 ILE HD12 H 13.133 1.598 -1.717 1.00 . A A . 11 ILE HD12 1 1 4 1694 1 1 11 ILE HD13 H 13.943 1.907 -0.180 1.00 . A A . 11 ILE HD13 1 1 4 1695 1 1 11 ILE HG12 H 12.259 0.173 0.037 1.00 . A A . 11 ILE HG12 1 1 4 1696 1 1 11 ILE HG13 H 11.032 1.264 -0.595 1.00 . A A . 11 ILE HG13 1 1 4 1697 1 1 11 ILE HG21 H 13.692 2.103 1.860 1.00 . A A . 11 ILE HG21 1 1 4 1698 1 1 11 ILE HG22 H 13.147 0.503 2.365 1.00 . A A . 11 ILE HG22 1 1 4 1699 1 1 11 ILE HG23 H 12.669 1.930 3.288 1.00 . A A . 11 ILE HG23 1 1 4 1700 1 1 11 ILE N N 9.283 0.932 1.197 1.00 . A A . 11 ILE N 1 1 4 1701 1 1 11 ILE O O 9.494 2.576 3.487 1.00 . A A . 11 ILE O 1 1 4 1702 1 1 12 GLY C C 8.766 0.517 6.346 1.00 . A A . 12 GLY C 1 1 4 1703 1 1 12 GLY CA C 9.991 1.208 5.783 1.00 . A A . 12 GLY CA 1 1 4 1704 1 1 12 GLY H H 10.763 -0.123 4.337 1.00 . A A . 12 GLY H 1 1 4 1705 1 1 12 GLY HA2 H 10.828 1.026 6.437 1.00 . A A . 12 GLY HA2 1 1 4 1706 1 1 12 GLY HA3 H 9.802 2.271 5.745 1.00 . A A . 12 GLY HA3 1 1 4 1707 1 1 12 GLY N N 10.325 0.751 4.456 1.00 . A A . 12 GLY N 1 1 4 1708 1 1 12 GLY O O 8.577 0.465 7.561 1.00 . A A . 12 GLY O 1 1 4 1709 1 1 13 TYR C C 6.657 -2.084 5.354 1.00 . A A . 13 TYR C 1 1 4 1710 1 1 13 TYR CA C 6.724 -0.681 5.916 1.00 . A A . 13 TYR CA 1 1 4 1711 1 1 13 TYR CB C 5.479 0.134 5.471 1.00 . A A . 13 TYR CB 1 1 4 1712 1 1 13 TYR CD1 C 3.375 0.296 6.915 1.00 . A A . 13 TYR CD1 1 1 4 1713 1 1 13 TYR CD2 C 3.594 -1.603 5.495 1.00 . A A . 13 TYR CD2 1 1 4 1714 1 1 13 TYR CE1 C 2.151 -0.187 7.355 1.00 . A A . 13 TYR CE1 1 1 4 1715 1 1 13 TYR CE2 C 2.387 -2.089 5.927 1.00 . A A . 13 TYR CE2 1 1 4 1716 1 1 13 TYR CG C 4.121 -0.404 5.973 1.00 . A A . 13 TYR CG 1 1 4 1717 1 1 13 TYR CZ C 1.664 -1.381 6.854 1.00 . A A . 13 TYR CZ 1 1 4 1718 1 1 13 TYR H H 8.167 -0.039 4.525 1.00 . A A . 13 TYR H 1 1 4 1719 1 1 13 TYR HA H 6.738 -0.730 6.995 1.00 . A A . 13 TYR HA 1 1 4 1720 1 1 13 TYR HB2 H 5.580 1.146 5.835 1.00 . A A . 13 TYR HB2 1 1 4 1721 1 1 13 TYR HB3 H 5.450 0.156 4.392 1.00 . A A . 13 TYR HB3 1 1 4 1722 1 1 13 TYR HD1 H 3.756 1.228 7.303 1.00 . A A . 13 TYR HD1 1 1 4 1723 1 1 13 TYR HD2 H 4.160 -2.170 4.771 1.00 . A A . 13 TYR HD2 1 1 4 1724 1 1 13 TYR HE1 H 1.585 0.369 8.088 1.00 . A A . 13 TYR HE1 1 1 4 1725 1 1 13 TYR HE2 H 2.027 -3.025 5.519 1.00 . A A . 13 TYR HE2 1 1 4 1726 1 1 13 TYR HH H -0.207 -1.176 7.151 1.00 . A A . 13 TYR HH 1 1 4 1727 1 1 13 TYR N N 7.945 -0.035 5.481 1.00 . A A . 13 TYR N 1 1 4 1728 1 1 13 TYR O O 6.678 -2.276 4.146 1.00 . A A . 13 TYR O 1 1 4 1729 1 1 13 TYR OH O 0.451 -1.869 7.288 1.00 . A A . 13 TYR OH 1 1 4 1730 1 1 14 SER C C 5.457 -5.078 6.816 1.00 . A A . 14 SER C 1 1 4 1731 1 1 14 SER CA C 6.409 -4.407 5.844 1.00 . A A . 14 SER CA 1 1 4 1732 1 1 14 SER CB C 7.762 -5.106 5.798 1.00 . A A . 14 SER CB 1 1 4 1733 1 1 14 SER H H 6.649 -2.833 7.177 1.00 . A A . 14 SER H 1 1 4 1734 1 1 14 SER HA H 5.967 -4.425 4.858 1.00 . A A . 14 SER HA 1 1 4 1735 1 1 14 SER HB2 H 8.250 -4.986 6.754 1.00 . A A . 14 SER HB2 1 1 4 1736 1 1 14 SER HB3 H 7.611 -6.156 5.594 1.00 . A A . 14 SER HB3 1 1 4 1737 1 1 14 SER N N 6.574 -3.036 6.220 1.00 . A A . 14 SER N 1 1 4 1738 1 1 14 SER O O 5.747 -5.204 8.003 1.00 . A A . 14 SER O 1 1 4 1739 1 1 14 SER OG O 8.581 -4.536 4.738 1.00 . A A . 14 SER OG 1 1 4 1740 1 1 15 GLY C C 2.272 -6.685 6.217 1.00 . A A . 15 GLY C 1 1 4 1741 1 1 15 GLY CA C 3.287 -6.067 7.124 1.00 . A A . 15 GLY CA 1 1 4 1742 1 1 15 GLY H H 4.105 -5.277 5.377 1.00 . A A . 15 GLY H 1 1 4 1743 1 1 15 GLY HA2 H 3.742 -6.826 7.742 1.00 . A A . 15 GLY HA2 1 1 4 1744 1 1 15 GLY HA3 H 2.811 -5.322 7.743 1.00 . A A . 15 GLY HA3 1 1 4 1745 1 1 15 GLY N N 4.302 -5.432 6.325 1.00 . A A . 15 GLY N 1 1 4 1746 1 1 15 GLY O O 2.623 -7.577 5.448 1.00 . A A . 15 GLY O 1 1 4 1747 1 1 16 PRO C C 0.267 -5.989 3.970 1.00 . A A . 16 PRO C 1 1 4 1748 1 1 16 PRO CA C 0.036 -6.710 5.290 1.00 . A A . 16 PRO CA 1 1 4 1749 1 1 16 PRO CB C -1.327 -6.320 5.891 1.00 . A A . 16 PRO CB 1 1 4 1750 1 1 16 PRO CD C 0.440 -5.282 7.185 1.00 . A A . 16 PRO CD 1 1 4 1751 1 1 16 PRO CG C -1.027 -5.630 7.189 1.00 . A A . 16 PRO CG 1 1 4 1752 1 1 16 PRO HA H 0.105 -7.777 5.141 1.00 . A A . 16 PRO HA 1 1 4 1753 1 1 16 PRO HB2 H -1.846 -5.665 5.206 1.00 . A A . 16 PRO HB2 1 1 4 1754 1 1 16 PRO HB3 H -1.916 -7.211 6.049 1.00 . A A . 16 PRO HB3 1 1 4 1755 1 1 16 PRO HD2 H 0.592 -4.268 6.845 1.00 . A A . 16 PRO HD2 1 1 4 1756 1 1 16 PRO HD3 H 0.850 -5.416 8.176 1.00 . A A . 16 PRO HD3 1 1 4 1757 1 1 16 PRO HG2 H -1.619 -4.729 7.267 1.00 . A A . 16 PRO HG2 1 1 4 1758 1 1 16 PRO HG3 H -1.253 -6.289 8.014 1.00 . A A . 16 PRO HG3 1 1 4 1759 1 1 16 PRO N N 1.014 -6.249 6.244 1.00 . A A . 16 PRO N 1 1 4 1760 1 1 16 PRO O O -0.229 -4.897 3.753 1.00 . A A . 16 PRO O 1 1 4 1761 1 1 17 THR C C 0.440 -6.181 0.811 1.00 . A A . 17 THR C 1 1 4 1762 1 1 17 THR CA C 1.467 -5.965 1.914 1.00 . A A . 17 THR CA 1 1 4 1763 1 1 17 THR CB C 2.878 -6.437 1.526 1.00 . A A . 17 THR CB 1 1 4 1764 1 1 17 THR CG2 C 3.915 -5.708 2.370 1.00 . A A . 17 THR CG2 1 1 4 1765 1 1 17 THR H H 1.450 -7.456 3.351 1.00 . A A . 17 THR H 1 1 4 1766 1 1 17 THR HA H 1.515 -4.902 2.100 1.00 . A A . 17 THR HA 1 1 4 1767 1 1 17 THR HB H 3.050 -6.217 0.482 1.00 . A A . 17 THR HB 1 1 4 1768 1 1 17 THR HG1 H 3.101 -8.283 0.888 1.00 . A A . 17 THR HG1 1 1 4 1769 1 1 17 THR HG21 H 3.830 -4.650 2.183 1.00 . A A . 17 THR HG21 1 1 4 1770 1 1 17 THR HG22 H 4.910 -6.049 2.130 1.00 . A A . 17 THR HG22 1 1 4 1771 1 1 17 THR HG23 H 3.707 -5.888 3.416 1.00 . A A . 17 THR HG23 1 1 4 1772 1 1 17 THR N N 1.077 -6.570 3.143 1.00 . A A . 17 THR N 1 1 4 1773 1 1 17 THR O O 0.387 -5.433 -0.167 1.00 . A A . 17 THR O 1 1 4 1774 1 1 17 THR OG1 O 2.996 -7.866 1.752 1.00 . A A . 17 THR OG1 1 1 4 1775 1 1 18 VAL C C -2.652 -6.553 0.469 1.00 . A A . 18 VAL C 1 1 4 1776 1 1 18 VAL CA C -1.468 -7.421 0.060 1.00 . A A . 18 VAL CA 1 1 4 1777 1 1 18 VAL CB C -1.890 -8.916 0.018 1.00 . A A . 18 VAL CB 1 1 4 1778 1 1 18 VAL CG1 C -3.044 -9.129 -0.961 1.00 . A A . 18 VAL CG1 1 1 4 1779 1 1 18 VAL CG2 C -0.710 -9.787 -0.377 1.00 . A A . 18 VAL CG2 1 1 4 1780 1 1 18 VAL H H -0.256 -7.771 1.758 1.00 . A A . 18 VAL H 1 1 4 1781 1 1 18 VAL HA H -1.134 -7.114 -0.920 1.00 . A A . 18 VAL HA 1 1 4 1782 1 1 18 VAL HB H -2.218 -9.210 1.004 1.00 . A A . 18 VAL HB 1 1 4 1783 1 1 18 VAL HG11 H -2.728 -8.841 -1.952 1.00 . A A . 18 VAL HG11 1 1 4 1784 1 1 18 VAL HG12 H -3.884 -8.518 -0.666 1.00 . A A . 18 VAL HG12 1 1 4 1785 1 1 18 VAL HG13 H -3.335 -10.168 -0.959 1.00 . A A . 18 VAL HG13 1 1 4 1786 1 1 18 VAL HG21 H 0.100 -9.638 0.322 1.00 . A A . 18 VAL HG21 1 1 4 1787 1 1 18 VAL HG22 H -0.383 -9.525 -1.374 1.00 . A A . 18 VAL HG22 1 1 4 1788 1 1 18 VAL HG23 H -1.011 -10.824 -0.360 1.00 . A A . 18 VAL HG23 1 1 4 1789 1 1 18 VAL N N -0.388 -7.185 0.982 1.00 . A A . 18 VAL N 1 1 4 1790 1 1 18 VAL O O -3.064 -6.546 1.642 1.00 . A A . 18 VAL O 1 1 4 1791 1 1 19 CYS C C -5.572 -5.708 -0.287 1.00 . A A . 19 CYS C 1 1 4 1792 1 1 19 CYS CA C -4.271 -4.942 -0.233 1.00 . A A . 19 CYS CA 1 1 4 1793 1 1 19 CYS CB C -4.268 -3.834 -1.270 1.00 . A A . 19 CYS CB 1 1 4 1794 1 1 19 CYS H H -2.798 -5.873 -1.369 1.00 . A A . 19 CYS H 1 1 4 1795 1 1 19 CYS HA H -4.156 -4.498 0.743 1.00 . A A . 19 CYS HA 1 1 4 1796 1 1 19 CYS HB2 H -4.413 -4.253 -2.254 1.00 . A A . 19 CYS HB2 1 1 4 1797 1 1 19 CYS HB3 H -5.076 -3.151 -1.052 1.00 . A A . 19 CYS HB3 1 1 4 1798 1 1 19 CYS N N -3.165 -5.821 -0.462 1.00 . A A . 19 CYS N 1 1 4 1799 1 1 19 CYS O O -5.614 -6.856 -0.751 1.00 . A A . 19 CYS O 1 1 4 1800 1 1 19 CYS SG S -2.728 -2.876 -1.279 1.00 . A A . 19 CYS SG 1 1 4 1801 1 1 20 ALA C C -8.426 -5.845 -1.218 1.00 . A A . 20 ALA C 1 1 4 1802 1 1 20 ALA CA C -7.927 -5.709 0.212 1.00 . A A . 20 ALA CA 1 1 4 1803 1 1 20 ALA CB C -8.893 -4.909 1.062 1.00 . A A . 20 ALA CB 1 1 4 1804 1 1 20 ALA H H -6.497 -4.227 0.654 1.00 . A A . 20 ALA H 1 1 4 1805 1 1 20 ALA HA H -7.833 -6.699 0.632 1.00 . A A . 20 ALA HA 1 1 4 1806 1 1 20 ALA HB1 H -8.543 -4.892 2.084 1.00 . A A . 20 ALA HB1 1 1 4 1807 1 1 20 ALA HB2 H -9.876 -5.351 1.020 1.00 . A A . 20 ALA HB2 1 1 4 1808 1 1 20 ALA HB3 H -8.932 -3.899 0.689 1.00 . A A . 20 ALA HB3 1 1 4 1809 1 1 20 ALA N N -6.617 -5.106 0.230 1.00 . A A . 20 ALA N 1 1 4 1810 1 1 20 ALA O O -8.027 -5.065 -2.108 1.00 . A A . 20 ALA O 1 1 4 1811 1 1 21 SER C C -10.427 -5.964 -3.399 1.00 . A A . 21 SER C 1 1 4 1812 1 1 21 SER CA C -9.798 -7.171 -2.715 1.00 . A A . 21 SER CA 1 1 4 1813 1 1 21 SER CB C -10.805 -8.286 -2.518 1.00 . A A . 21 SER CB 1 1 4 1814 1 1 21 SER H H -9.589 -7.364 -0.670 1.00 . A A . 21 SER H 1 1 4 1815 1 1 21 SER HA H -8.991 -7.546 -3.325 1.00 . A A . 21 SER HA 1 1 4 1816 1 1 21 SER HB2 H -11.665 -7.903 -1.988 1.00 . A A . 21 SER HB2 1 1 4 1817 1 1 21 SER HB3 H -11.112 -8.685 -3.473 1.00 . A A . 21 SER HB3 1 1 4 1818 1 1 21 SER HG H -9.261 -9.332 -1.962 1.00 . A A . 21 SER HG 1 1 4 1819 1 1 21 SER N N -9.271 -6.825 -1.425 1.00 . A A . 21 SER N 1 1 4 1820 1 1 21 SER O O -11.312 -5.299 -2.840 1.00 . A A . 21 SER O 1 1 4 1821 1 1 21 SER OG O -10.203 -9.330 -1.751 1.00 . A A . 21 SER OG 1 1 4 1822 1 1 22 GLY C C -9.358 -3.442 -5.381 1.00 . A A . 22 GLY C 1 1 4 1823 1 1 22 GLY CA C -10.401 -4.530 -5.306 1.00 . A A . 22 GLY CA 1 1 4 1824 1 1 22 GLY H H -9.233 -6.226 -4.971 1.00 . A A . 22 GLY H 1 1 4 1825 1 1 22 GLY HA2 H -10.659 -4.847 -6.306 1.00 . A A . 22 GLY HA2 1 1 4 1826 1 1 22 GLY HA3 H -11.281 -4.138 -4.821 1.00 . A A . 22 GLY HA3 1 1 4 1827 1 1 22 GLY N N -9.932 -5.662 -4.575 1.00 . A A . 22 GLY N 1 1 4 1828 1 1 22 GLY O O -9.406 -2.583 -6.267 1.00 . A A . 22 GLY O 1 1 4 1829 1 1 23 THR C C -5.987 -3.068 -4.695 1.00 . A A . 23 THR C 1 1 4 1830 1 1 23 THR CA C -7.368 -2.469 -4.467 1.00 . A A . 23 THR CA 1 1 4 1831 1 1 23 THR CB C -7.420 -1.622 -3.170 1.00 . A A . 23 THR CB 1 1 4 1832 1 1 23 THR CG2 C -8.677 -0.781 -3.161 1.00 . A A . 23 THR CG2 1 1 4 1833 1 1 23 THR H H -8.363 -4.216 -3.838 1.00 . A A . 23 THR H 1 1 4 1834 1 1 23 THR HA H -7.574 -1.815 -5.302 1.00 . A A . 23 THR HA 1 1 4 1835 1 1 23 THR HB H -6.564 -0.963 -3.132 1.00 . A A . 23 THR HB 1 1 4 1836 1 1 23 THR HG1 H -7.531 -3.391 -2.249 1.00 . A A . 23 THR HG1 1 1 4 1837 1 1 23 THR HG21 H -8.719 -0.196 -2.254 1.00 . A A . 23 THR HG21 1 1 4 1838 1 1 23 THR HG22 H -9.542 -1.425 -3.225 1.00 . A A . 23 THR HG22 1 1 4 1839 1 1 23 THR HG23 H -8.666 -0.118 -4.012 1.00 . A A . 23 THR HG23 1 1 4 1840 1 1 23 THR N N -8.398 -3.480 -4.488 1.00 . A A . 23 THR N 1 1 4 1841 1 1 23 THR O O -5.730 -4.217 -4.314 1.00 . A A . 23 THR O 1 1 4 1842 1 1 23 THR OG1 O -7.410 -2.463 -1.996 1.00 . A A . 23 THR OG1 1 1 4 1843 1 1 24 THR C C -2.751 -1.926 -4.924 1.00 . A A . 24 THR C 1 1 4 1844 1 1 24 THR CA C -3.795 -2.745 -5.657 1.00 . A A . 24 THR CA 1 1 4 1845 1 1 24 THR CB C -3.547 -2.657 -7.186 1.00 . A A . 24 THR CB 1 1 4 1846 1 1 24 THR CG2 C -4.286 -3.756 -7.918 1.00 . A A . 24 THR CG2 1 1 4 1847 1 1 24 THR H H -5.372 -1.380 -5.559 1.00 . A A . 24 THR H 1 1 4 1848 1 1 24 THR HA H -3.703 -3.779 -5.360 1.00 . A A . 24 THR HA 1 1 4 1849 1 1 24 THR HB H -2.486 -2.773 -7.358 1.00 . A A . 24 THR HB 1 1 4 1850 1 1 24 THR HG1 H -4.567 -0.925 -7.089 1.00 . A A . 24 THR HG1 1 1 4 1851 1 1 24 THR HG21 H -4.091 -3.681 -8.978 1.00 . A A . 24 THR HG21 1 1 4 1852 1 1 24 THR HG22 H -5.345 -3.647 -7.736 1.00 . A A . 24 THR HG22 1 1 4 1853 1 1 24 THR HG23 H -3.958 -4.719 -7.556 1.00 . A A . 24 THR HG23 1 1 4 1854 1 1 24 THR N N -5.124 -2.305 -5.323 1.00 . A A . 24 THR N 1 1 4 1855 1 1 24 THR O O -2.950 -0.739 -4.678 1.00 . A A . 24 THR O 1 1 4 1856 1 1 24 THR OG1 O -3.956 -1.361 -7.711 1.00 . A A . 24 THR OG1 1 1 4 1857 1 1 25 CYS C C 0.253 -1.143 -4.932 1.00 . A A . 25 CYS C 1 1 4 1858 1 1 25 CYS CA C -0.582 -1.876 -3.898 1.00 . A A . 25 CYS CA 1 1 4 1859 1 1 25 CYS CB C 0.271 -2.891 -3.111 1.00 . A A . 25 CYS CB 1 1 4 1860 1 1 25 CYS H H -1.564 -3.500 -4.790 1.00 . A A . 25 CYS H 1 1 4 1861 1 1 25 CYS HA H -1.010 -1.157 -3.215 1.00 . A A . 25 CYS HA 1 1 4 1862 1 1 25 CYS HB2 H -0.357 -3.397 -2.394 1.00 . A A . 25 CYS HB2 1 1 4 1863 1 1 25 CYS HB3 H 0.670 -3.616 -3.804 1.00 . A A . 25 CYS HB3 1 1 4 1864 1 1 25 CYS N N -1.664 -2.547 -4.575 1.00 . A A . 25 CYS N 1 1 4 1865 1 1 25 CYS O O 1.044 -1.749 -5.653 1.00 . A A . 25 CYS O 1 1 4 1866 1 1 25 CYS SG S 1.678 -2.168 -2.190 1.00 . A A . 25 CYS SG 1 1 4 1867 1 1 26 GLN C C 1.821 1.727 -5.374 1.00 . A A . 26 GLN C 1 1 4 1868 1 1 26 GLN CA C 0.730 0.920 -6.034 1.00 . A A . 26 GLN CA 1 1 4 1869 1 1 26 GLN CB C -0.233 1.824 -6.805 1.00 . A A . 26 GLN CB 1 1 4 1870 1 1 26 GLN CD C -2.222 1.940 -8.385 1.00 . A A . 26 GLN CD 1 1 4 1871 1 1 26 GLN CG C -1.291 1.052 -7.582 1.00 . A A . 26 GLN CG 1 1 4 1872 1 1 26 GLN H H -0.623 0.577 -4.467 1.00 . A A . 26 GLN H 1 1 4 1873 1 1 26 GLN HA H 1.191 0.232 -6.729 1.00 . A A . 26 GLN HA 1 1 4 1874 1 1 26 GLN HB2 H -0.732 2.478 -6.106 1.00 . A A . 26 GLN HB2 1 1 4 1875 1 1 26 GLN HB3 H 0.335 2.420 -7.503 1.00 . A A . 26 GLN HB3 1 1 4 1876 1 1 26 GLN HE21 H -3.664 0.631 -8.145 1.00 . A A . 26 GLN HE21 1 1 4 1877 1 1 26 GLN HE22 H -4.083 2.036 -9.056 1.00 . A A . 26 GLN HE22 1 1 4 1878 1 1 26 GLN HG2 H -0.797 0.374 -8.260 1.00 . A A . 26 GLN HG2 1 1 4 1879 1 1 26 GLN HG3 H -1.878 0.479 -6.879 1.00 . A A . 26 GLN HG3 1 1 4 1880 1 1 26 GLN N N 0.030 0.136 -5.059 1.00 . A A . 26 GLN N 1 1 4 1881 1 1 26 GLN NE2 N -3.438 1.498 -8.549 1.00 . A A . 26 GLN NE2 1 1 4 1882 1 1 26 GLN O O 1.583 2.437 -4.385 1.00 . A A . 26 GLN O 1 1 4 1883 1 1 26 GLN OE1 O -1.844 3.028 -8.850 1.00 . A A . 26 GLN OE1 1 1 4 1884 1 1 27 VAL C C 4.090 3.743 -5.913 1.00 . A A . 27 VAL C 1 1 4 1885 1 1 27 VAL CA C 4.139 2.326 -5.377 1.00 . A A . 27 VAL CA 1 1 4 1886 1 1 27 VAL CB C 5.478 1.645 -5.771 1.00 . A A . 27 VAL CB 1 1 4 1887 1 1 27 VAL CG1 C 6.668 2.386 -5.174 1.00 . A A . 27 VAL CG1 1 1 4 1888 1 1 27 VAL CG2 C 5.487 0.184 -5.334 1.00 . A A . 27 VAL CG2 1 1 4 1889 1 1 27 VAL H H 3.130 1.019 -6.670 1.00 . A A . 27 VAL H 1 1 4 1890 1 1 27 VAL HA H 4.055 2.350 -4.300 1.00 . A A . 27 VAL HA 1 1 4 1891 1 1 27 VAL HB H 5.567 1.677 -6.847 1.00 . A A . 27 VAL HB 1 1 4 1892 1 1 27 VAL HG11 H 6.675 3.405 -5.531 1.00 . A A . 27 VAL HG11 1 1 4 1893 1 1 27 VAL HG12 H 7.585 1.897 -5.465 1.00 . A A . 27 VAL HG12 1 1 4 1894 1 1 27 VAL HG13 H 6.588 2.386 -4.098 1.00 . A A . 27 VAL HG13 1 1 4 1895 1 1 27 VAL HG21 H 5.383 0.130 -4.261 1.00 . A A . 27 VAL HG21 1 1 4 1896 1 1 27 VAL HG22 H 6.416 -0.280 -5.629 1.00 . A A . 27 VAL HG22 1 1 4 1897 1 1 27 VAL HG23 H 4.662 -0.337 -5.798 1.00 . A A . 27 VAL HG23 1 1 4 1898 1 1 27 VAL N N 3.008 1.605 -5.892 1.00 . A A . 27 VAL N 1 1 4 1899 1 1 27 VAL O O 4.306 3.978 -7.110 1.00 . A A . 27 VAL O 1 1 4 1900 1 1 28 LEU C C 4.964 6.711 -5.290 1.00 . A A . 28 LEU C 1 1 4 1901 1 1 28 LEU CA C 3.622 6.053 -5.437 1.00 . A A . 28 LEU CA 1 1 4 1902 1 1 28 LEU CB C 2.600 6.763 -4.535 1.00 . A A . 28 LEU CB 1 1 4 1903 1 1 28 LEU CD1 C 0.297 6.953 -3.560 1.00 . A A . 28 LEU CD1 1 1 4 1904 1 1 28 LEU CD2 C 0.607 5.893 -5.797 1.00 . A A . 28 LEU CD2 1 1 4 1905 1 1 28 LEU CG C 1.216 6.112 -4.427 1.00 . A A . 28 LEU CG 1 1 4 1906 1 1 28 LEU H H 3.581 4.404 -4.123 1.00 . A A . 28 LEU H 1 1 4 1907 1 1 28 LEU HA H 3.294 6.111 -6.464 1.00 . A A . 28 LEU HA 1 1 4 1908 1 1 28 LEU HB2 H 3.016 6.825 -3.541 1.00 . A A . 28 LEU HB2 1 1 4 1909 1 1 28 LEU HB3 H 2.472 7.768 -4.909 1.00 . A A . 28 LEU HB3 1 1 4 1910 1 1 28 LEU HD11 H 0.221 7.944 -3.978 1.00 . A A . 28 LEU HD11 1 1 4 1911 1 1 28 LEU HD12 H 0.692 7.010 -2.557 1.00 . A A . 28 LEU HD12 1 1 4 1912 1 1 28 LEU HD13 H -0.685 6.502 -3.533 1.00 . A A . 28 LEU HD13 1 1 4 1913 1 1 28 LEU HD21 H 0.538 6.838 -6.315 1.00 . A A . 28 LEU HD21 1 1 4 1914 1 1 28 LEU HD22 H -0.381 5.472 -5.681 1.00 . A A . 28 LEU HD22 1 1 4 1915 1 1 28 LEU HD23 H 1.226 5.211 -6.359 1.00 . A A . 28 LEU HD23 1 1 4 1916 1 1 28 LEU HG H 1.326 5.152 -3.944 1.00 . A A . 28 LEU HG 1 1 4 1917 1 1 28 LEU N N 3.746 4.664 -5.054 1.00 . A A . 28 LEU N 1 1 4 1918 1 1 28 LEU O O 5.514 7.287 -6.232 1.00 . A A . 28 LEU O 1 1 4 1919 1 1 29 ASN C C 7.684 5.984 -3.401 1.00 . A A . 29 ASN C 1 1 4 1920 1 1 29 ASN CA C 6.785 7.139 -3.782 1.00 . A A . 29 ASN CA 1 1 4 1921 1 1 29 ASN CB C 6.630 8.111 -2.595 1.00 . A A . 29 ASN CB 1 1 4 1922 1 1 29 ASN CG C 5.694 9.278 -2.864 1.00 . A A . 29 ASN CG 1 1 4 1923 1 1 29 ASN H H 5.092 5.979 -3.457 1.00 . A A . 29 ASN H 1 1 4 1924 1 1 29 ASN HA H 7.183 7.658 -4.641 1.00 . A A . 29 ASN HA 1 1 4 1925 1 1 29 ASN HB2 H 6.265 7.569 -1.737 1.00 . A A . 29 ASN HB2 1 1 4 1926 1 1 29 ASN HB3 H 7.608 8.508 -2.364 1.00 . A A . 29 ASN HB3 1 1 4 1927 1 1 29 ASN HD21 H 5.160 9.343 -0.954 1.00 . A A . 29 ASN HD21 1 1 4 1928 1 1 29 ASN HD22 H 4.399 10.487 -1.987 1.00 . A A . 29 ASN HD22 1 1 4 1929 1 1 29 ASN N N 5.517 6.561 -4.127 1.00 . A A . 29 ASN N 1 1 4 1930 1 1 29 ASN ND2 N 5.027 9.747 -1.839 1.00 . A A . 29 ASN ND2 1 1 4 1931 1 1 29 ASN O O 7.168 4.900 -3.145 1.00 . A A . 29 ASN O 1 1 4 1932 1 1 29 ASN OD1 O 5.576 9.757 -3.989 1.00 . A A . 29 ASN OD1 1 1 4 1933 1 1 30 PRO C C 9.604 4.325 -1.735 1.00 . A A . 30 PRO C 1 1 4 1934 1 1 30 PRO CA C 9.956 5.074 -3.031 1.00 . A A . 30 PRO CA 1 1 4 1935 1 1 30 PRO CB C 11.298 5.794 -2.904 1.00 . A A . 30 PRO CB 1 1 4 1936 1 1 30 PRO CD C 9.740 7.423 -3.635 1.00 . A A . 30 PRO CD 1 1 4 1937 1 1 30 PRO CG C 11.153 6.960 -3.815 1.00 . A A . 30 PRO CG 1 1 4 1938 1 1 30 PRO HA H 10.004 4.360 -3.839 1.00 . A A . 30 PRO HA 1 1 4 1939 1 1 30 PRO HB2 H 11.449 6.101 -1.879 1.00 . A A . 30 PRO HB2 1 1 4 1940 1 1 30 PRO HB3 H 12.101 5.144 -3.220 1.00 . A A . 30 PRO HB3 1 1 4 1941 1 1 30 PRO HD2 H 9.677 8.099 -2.796 1.00 . A A . 30 PRO HD2 1 1 4 1942 1 1 30 PRO HD3 H 9.359 7.893 -4.529 1.00 . A A . 30 PRO HD3 1 1 4 1943 1 1 30 PRO HG2 H 11.846 7.741 -3.545 1.00 . A A . 30 PRO HG2 1 1 4 1944 1 1 30 PRO HG3 H 11.312 6.649 -4.836 1.00 . A A . 30 PRO HG3 1 1 4 1945 1 1 30 PRO N N 9.016 6.164 -3.353 1.00 . A A . 30 PRO N 1 1 4 1946 1 1 30 PRO O O 9.671 3.084 -1.684 1.00 . A A . 30 PRO O 1 1 4 1947 1 1 31 TYR C C 7.338 4.264 0.650 1.00 . A A . 31 TYR C 1 1 4 1948 1 1 31 TYR CA C 8.856 4.410 0.544 1.00 . A A . 31 TYR CA 1 1 4 1949 1 1 31 TYR CB C 9.344 5.251 1.748 1.00 . A A . 31 TYR CB 1 1 4 1950 1 1 31 TYR CD1 C 11.379 6.560 0.998 1.00 . A A . 31 TYR CD1 1 1 4 1951 1 1 31 TYR CD2 C 11.679 4.882 2.650 1.00 . A A . 31 TYR CD2 1 1 4 1952 1 1 31 TYR CE1 C 12.717 6.860 1.051 1.00 . A A . 31 TYR CE1 1 1 4 1953 1 1 31 TYR CE2 C 13.027 5.177 2.707 1.00 . A A . 31 TYR CE2 1 1 4 1954 1 1 31 TYR CG C 10.832 5.564 1.792 1.00 . A A . 31 TYR CG 1 1 4 1955 1 1 31 TYR CZ C 13.537 6.168 1.905 1.00 . A A . 31 TYR CZ 1 1 4 1956 1 1 31 TYR H H 9.144 6.033 -0.773 1.00 . A A . 31 TYR H 1 1 4 1957 1 1 31 TYR HA H 9.327 3.440 0.585 1.00 . A A . 31 TYR HA 1 1 4 1958 1 1 31 TYR HB2 H 8.816 6.192 1.769 1.00 . A A . 31 TYR HB2 1 1 4 1959 1 1 31 TYR HB3 H 9.098 4.712 2.651 1.00 . A A . 31 TYR HB3 1 1 4 1960 1 1 31 TYR HD1 H 10.736 7.102 0.322 1.00 . A A . 31 TYR HD1 1 1 4 1961 1 1 31 TYR HD2 H 11.275 4.101 3.278 1.00 . A A . 31 TYR HD2 1 1 4 1962 1 1 31 TYR HE1 H 13.116 7.641 0.422 1.00 . A A . 31 TYR HE1 1 1 4 1963 1 1 31 TYR HE2 H 13.675 4.633 3.378 1.00 . A A . 31 TYR HE2 1 1 4 1964 1 1 31 TYR HH H 15.380 5.646 1.888 1.00 . A A . 31 TYR HH 1 1 4 1965 1 1 31 TYR N N 9.205 5.055 -0.701 1.00 . A A . 31 TYR N 1 1 4 1966 1 1 31 TYR O O 6.829 3.347 1.305 1.00 . A A . 31 TYR O 1 1 4 1967 1 1 31 TYR OH O 14.882 6.473 1.956 1.00 . A A . 31 TYR OH 1 1 4 1968 1 1 32 TYR C C 4.508 4.284 -1.018 1.00 . A A . 32 TYR C 1 1 4 1969 1 1 32 TYR CA C 5.174 5.092 0.093 1.00 . A A . 32 TYR CA 1 1 4 1970 1 1 32 TYR CB C 4.574 6.485 0.191 1.00 . A A . 32 TYR CB 1 1 4 1971 1 1 32 TYR CD1 C 2.069 6.674 -0.109 1.00 . A A . 32 TYR CD1 1 1 4 1972 1 1 32 TYR CD2 C 2.931 6.247 2.064 1.00 . A A . 32 TYR CD2 1 1 4 1973 1 1 32 TYR CE1 C 0.788 6.638 0.401 1.00 . A A . 32 TYR CE1 1 1 4 1974 1 1 32 TYR CE2 C 1.659 6.213 2.577 1.00 . A A . 32 TYR CE2 1 1 4 1975 1 1 32 TYR CG C 3.163 6.477 0.717 1.00 . A A . 32 TYR CG 1 1 4 1976 1 1 32 TYR CZ C 0.589 6.407 1.749 1.00 . A A . 32 TYR CZ 1 1 4 1977 1 1 32 TYR H H 7.052 5.803 -0.571 1.00 . A A . 32 TYR H 1 1 4 1978 1 1 32 TYR HA H 4.962 4.580 1.021 1.00 . A A . 32 TYR HA 1 1 4 1979 1 1 32 TYR HB2 H 5.177 7.083 0.858 1.00 . A A . 32 TYR HB2 1 1 4 1980 1 1 32 TYR HB3 H 4.564 6.934 -0.790 1.00 . A A . 32 TYR HB3 1 1 4 1981 1 1 32 TYR HD1 H 2.223 6.853 -1.164 1.00 . A A . 32 TYR HD1 1 1 4 1982 1 1 32 TYR HD2 H 3.775 6.096 2.720 1.00 . A A . 32 TYR HD2 1 1 4 1983 1 1 32 TYR HE1 H -0.056 6.796 -0.254 1.00 . A A . 32 TYR HE1 1 1 4 1984 1 1 32 TYR HE2 H 1.508 6.031 3.629 1.00 . A A . 32 TYR HE2 1 1 4 1985 1 1 32 TYR HH H -0.721 6.838 3.098 1.00 . A A . 32 TYR HH 1 1 4 1986 1 1 32 TYR N N 6.608 5.136 -0.008 1.00 . A A . 32 TYR N 1 1 4 1987 1 1 32 TYR O O 4.519 4.674 -2.192 1.00 . A A . 32 TYR O 1 1 4 1988 1 1 32 TYR OH O -0.692 6.352 2.264 1.00 . A A . 32 TYR OH 1 1 4 1989 1 1 33 SER C C 1.708 2.407 -0.966 1.00 . A A . 33 SER C 1 1 4 1990 1 1 33 SER CA C 3.106 2.426 -1.546 1.00 . A A . 33 SER CA 1 1 4 1991 1 1 33 SER CB C 3.689 1.020 -1.654 1.00 . A A . 33 SER CB 1 1 4 1992 1 1 33 SER H H 3.955 2.907 0.281 1.00 . A A . 33 SER H 1 1 4 1993 1 1 33 SER HA H 3.089 2.908 -2.512 1.00 . A A . 33 SER HA 1 1 4 1994 1 1 33 SER HB2 H 3.586 0.512 -0.707 1.00 . A A . 33 SER HB2 1 1 4 1995 1 1 33 SER HB3 H 3.164 0.471 -2.423 1.00 . A A . 33 SER HB3 1 1 4 1996 1 1 33 SER HG H 5.285 1.962 -2.315 1.00 . A A . 33 SER HG 1 1 4 1997 1 1 33 SER N N 3.897 3.211 -0.648 1.00 . A A . 33 SER N 1 1 4 1998 1 1 33 SER O O 1.559 2.203 0.236 1.00 . A A . 33 SER O 1 1 4 1999 1 1 33 SER OG O 5.067 1.079 -1.998 1.00 . A A . 33 SER OG 1 1 4 2000 1 1 34 GLN C C -1.601 1.906 -2.053 1.00 . A A . 34 GLN C 1 1 4 2001 1 1 34 GLN CA C -0.641 2.795 -1.282 1.00 . A A . 34 GLN CA 1 1 4 2002 1 1 34 GLN CB C -1.046 4.265 -1.400 1.00 . A A . 34 GLN CB 1 1 4 2003 1 1 34 GLN CD C -2.735 6.076 -0.922 1.00 . A A . 34 GLN CD 1 1 4 2004 1 1 34 GLN CG C -2.427 4.595 -0.877 1.00 . A A . 34 GLN CG 1 1 4 2005 1 1 34 GLN H H 0.865 2.691 -2.746 1.00 . A A . 34 GLN H 1 1 4 2006 1 1 34 GLN HA H -0.657 2.516 -0.239 1.00 . A A . 34 GLN HA 1 1 4 2007 1 1 34 GLN HB2 H -0.331 4.857 -0.848 1.00 . A A . 34 GLN HB2 1 1 4 2008 1 1 34 GLN HB3 H -0.999 4.548 -2.442 1.00 . A A . 34 GLN HB3 1 1 4 2009 1 1 34 GLN HE21 H -2.017 6.326 0.913 1.00 . A A . 34 GLN HE21 1 1 4 2010 1 1 34 GLN HE22 H -2.621 7.728 0.137 1.00 . A A . 34 GLN HE22 1 1 4 2011 1 1 34 GLN HG2 H -3.153 4.076 -1.486 1.00 . A A . 34 GLN HG2 1 1 4 2012 1 1 34 GLN HG3 H -2.506 4.251 0.143 1.00 . A A . 34 GLN HG3 1 1 4 2013 1 1 34 GLN N N 0.712 2.644 -1.773 1.00 . A A . 34 GLN N 1 1 4 2014 1 1 34 GLN NE2 N -2.433 6.768 0.135 1.00 . A A . 34 GLN NE2 1 1 4 2015 1 1 34 GLN O O -1.416 1.685 -3.250 1.00 . A A . 34 GLN O 1 1 4 2016 1 1 34 GLN OE1 O -3.252 6.590 -1.905 1.00 . A A . 34 GLN OE1 1 1 4 2017 1 1 35 CYS C C -4.610 1.409 -2.701 1.00 . A A . 35 CYS C 1 1 4 2018 1 1 35 CYS CA C -3.584 0.558 -1.994 1.00 . A A . 35 CYS CA 1 1 4 2019 1 1 35 CYS CB C -4.265 -0.326 -0.984 1.00 . A A . 35 CYS CB 1 1 4 2020 1 1 35 CYS H H -2.644 1.519 -0.399 1.00 . A A . 35 CYS H 1 1 4 2021 1 1 35 CYS HA H -3.089 -0.067 -2.723 1.00 . A A . 35 CYS HA 1 1 4 2022 1 1 35 CYS HB2 H -4.866 0.266 -0.314 1.00 . A A . 35 CYS HB2 1 1 4 2023 1 1 35 CYS HB3 H -4.921 -0.987 -1.524 1.00 . A A . 35 CYS HB3 1 1 4 2024 1 1 35 CYS N N -2.590 1.376 -1.368 1.00 . A A . 35 CYS N 1 1 4 2025 1 1 35 CYS O O -5.406 2.129 -2.058 1.00 . A A . 35 CYS O 1 1 4 2026 1 1 35 CYS SG S -3.127 -1.351 -0.024 1.00 . A A . 35 CYS SG 1 1 4 2027 1 1 36 LEU C C -6.224 0.986 -5.639 1.00 . A A . 36 LEU C 1 1 4 2028 1 1 36 LEU CA C -5.477 2.029 -4.853 1.00 . A A . 36 LEU CA 1 1 4 2029 1 1 36 LEU CB C -4.724 2.977 -5.788 1.00 . A A . 36 LEU CB 1 1 4 2030 1 1 36 LEU CD1 C -3.173 4.910 -6.152 1.00 . A A . 36 LEU CD1 1 1 4 2031 1 1 36 LEU CD2 C -4.857 5.007 -4.322 1.00 . A A . 36 LEU CD2 1 1 4 2032 1 1 36 LEU CG C -3.930 4.102 -5.115 1.00 . A A . 36 LEU CG 1 1 4 2033 1 1 36 LEU H H -3.902 0.765 -4.418 1.00 . A A . 36 LEU H 1 1 4 2034 1 1 36 LEU HA H -6.173 2.590 -4.247 1.00 . A A . 36 LEU HA 1 1 4 2035 1 1 36 LEU HB2 H -4.039 2.387 -6.380 1.00 . A A . 36 LEU HB2 1 1 4 2036 1 1 36 LEU HB3 H -5.445 3.428 -6.453 1.00 . A A . 36 LEU HB3 1 1 4 2037 1 1 36 LEU HD11 H -2.476 4.270 -6.672 1.00 . A A . 36 LEU HD11 1 1 4 2038 1 1 36 LEU HD12 H -2.637 5.712 -5.665 1.00 . A A . 36 LEU HD12 1 1 4 2039 1 1 36 LEU HD13 H -3.874 5.326 -6.859 1.00 . A A . 36 LEU HD13 1 1 4 2040 1 1 36 LEU HD21 H -5.343 4.439 -3.544 1.00 . A A . 36 LEU HD21 1 1 4 2041 1 1 36 LEU HD22 H -5.607 5.421 -4.981 1.00 . A A . 36 LEU HD22 1 1 4 2042 1 1 36 LEU HD23 H -4.286 5.809 -3.877 1.00 . A A . 36 LEU HD23 1 1 4 2043 1 1 36 LEU HG H -3.211 3.670 -4.436 1.00 . A A . 36 LEU HG 1 1 4 2044 1 1 36 LEU N N -4.577 1.342 -3.992 1.00 . A A . 36 LEU N 1 1 4 2045 1 1 36 LEU O O -7.428 0.879 -5.488 1.00 . A A . 36 LEU O 1 1 4 2046 1 1 36 LEU OXT O -5.569 0.175 -6.325 1.00 . A A . 36 LEU OXT 1 1 4 2047 2 2 1 MAN C1 C 9.868 -5.070 4.700 1.00 . B A . 101 MAN C1 1 1 4 2048 2 2 1 MAN C2 C 10.748 -4.493 5.835 1.00 . B A . 101 MAN C2 1 1 4 2049 2 2 1 MAN C3 C 10.976 -3.003 5.599 1.00 . B A . 101 MAN C3 1 1 4 2050 2 2 1 MAN C4 C 11.616 -2.826 4.244 1.00 . B A . 101 MAN C4 1 1 4 2051 2 2 1 MAN C5 C 10.711 -3.405 3.149 1.00 . B A . 101 MAN C5 1 1 4 2052 2 2 1 MAN C6 C 11.358 -3.360 1.789 1.00 . B A . 101 MAN C6 1 1 4 2053 2 2 1 MAN H1 H 9.836 -6.167 4.762 1.00 . B A . 101 MAN H1 1 1 4 2054 2 2 1 MAN H2 H 10.250 -4.629 6.806 1.00 . B A . 101 MAN H2 1 1 4 2055 2 2 1 MAN H3 H 10.015 -2.467 5.615 1.00 . B A . 101 MAN H3 1 1 4 2056 2 2 1 MAN H4 H 12.555 -3.397 4.291 1.00 . B A . 101 MAN H4 1 1 4 2057 2 2 1 MAN H5 H 9.761 -2.847 3.142 1.00 . B A . 101 MAN H5 1 1 4 2058 2 2 1 MAN H61 H 11.637 -2.318 1.579 1.00 . B A . 101 MAN H61 1 1 4 2059 2 2 1 MAN H62 H 10.637 -3.677 1.021 1.00 . B A . 101 MAN H62 1 1 4 2060 2 2 1 MAN HO2 H 12.514 -4.718 6.547 1.00 . B A . 101 MAN HO2 1 1 4 2061 2 2 1 MAN HO3 H 12.049 -1.571 6.328 1.00 . B A . 101 MAN HO3 1 1 4 2062 2 2 1 MAN HO4 H 12.480 -1.442 3.251 1.00 . B A . 101 MAN HO4 1 1 4 2063 2 2 1 MAN HO6 H 12.245 -4.996 2.278 1.00 . B A . 101 MAN HO6 1 1 4 2064 2 2 1 MAN O2 O 12.012 -5.136 5.839 1.00 . B A . 101 MAN O2 1 1 4 2065 2 2 1 MAN O3 O 11.877 -2.492 6.566 1.00 . B A . 101 MAN O3 1 1 4 2066 2 2 1 MAN O4 O 11.903 -1.455 4.024 1.00 . B A . 101 MAN O4 1 1 4 2067 2 2 1 MAN O5 O 10.483 -4.807 3.431 1.00 . B A . 101 MAN O5 1 1 4 2068 2 2 1 MAN O6 O 12.499 -4.210 1.774 1.00 . B A . 101 MAN O6 1 1 5 2069 1 1 1 THR C C -5.325 -5.717 4.667 1.00 . A A . 1 THR C 1 1 5 2070 1 1 1 THR CA C -5.273 -7.251 4.573 1.00 . A A . 1 THR CA 1 1 5 2071 1 1 1 THR CB C -6.535 -7.823 3.934 1.00 . A A . 1 THR CB 1 1 5 2072 1 1 1 THR CG2 C -6.545 -7.589 2.438 1.00 . A A . 1 THR CG2 1 1 5 2073 1 1 1 THR H1 H -5.207 -8.832 5.814 1.00 . A A . 1 THR H1 1 1 5 2074 1 1 1 THR H2 H -5.992 -7.467 6.455 1.00 . A A . 1 THR H2 1 1 5 2075 1 1 1 THR H3 H -4.309 -7.516 6.389 1.00 . A A . 1 THR H3 1 1 5 2076 1 1 1 THR HA H -4.409 -7.551 3.999 1.00 . A A . 1 THR HA 1 1 5 2077 1 1 1 THR HB H -7.404 -7.369 4.389 1.00 . A A . 1 THR HB 1 1 5 2078 1 1 1 THR HG1 H -6.970 -9.697 3.448 1.00 . A A . 1 THR HG1 1 1 5 2079 1 1 1 THR HG21 H -6.502 -6.527 2.239 1.00 . A A . 1 THR HG21 1 1 5 2080 1 1 1 THR HG22 H -7.449 -8.000 2.013 1.00 . A A . 1 THR HG22 1 1 5 2081 1 1 1 THR HG23 H -5.687 -8.070 1.991 1.00 . A A . 1 THR HG23 1 1 5 2082 1 1 1 THR N N -5.180 -7.796 5.900 1.00 . A A . 1 THR N 1 1 5 2083 1 1 1 THR O O -5.968 -5.175 5.567 1.00 . A A . 1 THR O 1 1 5 2084 1 1 1 THR OG1 O -6.532 -9.241 4.180 1.00 . A A . 1 THR OG1 1 1 5 2085 1 1 2 GLN C C -5.647 -2.978 2.935 1.00 . A A . 2 GLN C 1 1 5 2086 1 1 2 GLN CA C -4.555 -3.585 3.832 1.00 . A A . 2 GLN CA 1 1 5 2087 1 1 2 GLN CB C -3.135 -3.133 3.436 1.00 . A A . 2 GLN CB 1 1 5 2088 1 1 2 GLN CD C -3.229 -0.699 4.222 1.00 . A A . 2 GLN CD 1 1 5 2089 1 1 2 GLN CG C -2.545 -2.040 4.345 1.00 . A A . 2 GLN CG 1 1 5 2090 1 1 2 GLN H H -4.165 -5.488 3.041 1.00 . A A . 2 GLN H 1 1 5 2091 1 1 2 GLN HA H -4.754 -3.288 4.850 1.00 . A A . 2 GLN HA 1 1 5 2092 1 1 2 GLN HB2 H -2.484 -3.994 3.486 1.00 . A A . 2 GLN HB2 1 1 5 2093 1 1 2 GLN HB3 H -3.152 -2.771 2.420 1.00 . A A . 2 GLN HB3 1 1 5 2094 1 1 2 GLN HE21 H -3.439 -0.952 2.292 1.00 . A A . 2 GLN HE21 1 1 5 2095 1 1 2 GLN HE22 H -4.107 0.490 2.937 1.00 . A A . 2 GLN HE22 1 1 5 2096 1 1 2 GLN HG2 H -2.620 -2.361 5.373 1.00 . A A . 2 GLN HG2 1 1 5 2097 1 1 2 GLN HG3 H -1.505 -1.916 4.089 1.00 . A A . 2 GLN HG3 1 1 5 2098 1 1 2 GLN N N -4.632 -5.028 3.780 1.00 . A A . 2 GLN N 1 1 5 2099 1 1 2 GLN NE2 N -3.615 -0.351 3.047 1.00 . A A . 2 GLN NE2 1 1 5 2100 1 1 2 GLN O O -5.889 -3.453 1.830 1.00 . A A . 2 GLN O 1 1 5 2101 1 1 2 GLN OE1 O -3.342 0.047 5.185 1.00 . A A . 2 GLN OE1 1 1 5 2102 1 1 3 SER C C -7.066 -0.154 1.866 1.00 . A A . 3 SER C 1 1 5 2103 1 1 3 SER CA C -7.438 -1.361 2.759 1.00 . A A . 3 SER CA 1 1 5 2104 1 1 3 SER CB C -8.472 -0.992 3.818 1.00 . A A . 3 SER CB 1 1 5 2105 1 1 3 SER H H -6.012 -1.547 4.268 1.00 . A A . 3 SER H 1 1 5 2106 1 1 3 SER HA H -7.873 -2.122 2.128 1.00 . A A . 3 SER HA 1 1 5 2107 1 1 3 SER HB2 H -9.203 -0.321 3.389 1.00 . A A . 3 SER HB2 1 1 5 2108 1 1 3 SER HB3 H -8.964 -1.887 4.170 1.00 . A A . 3 SER HB3 1 1 5 2109 1 1 3 SER HG H -8.180 0.554 4.956 1.00 . A A . 3 SER HG 1 1 5 2110 1 1 3 SER N N -6.300 -1.959 3.426 1.00 . A A . 3 SER N 1 1 5 2111 1 1 3 SER O O -5.909 0.258 1.793 1.00 . A A . 3 SER O 1 1 5 2112 1 1 3 SER OG O -7.843 -0.352 4.921 1.00 . A A . 3 SER OG 1 1 5 2113 1 1 4 HIS C C -7.357 2.735 1.038 1.00 . A A . 4 HIS C 1 1 5 2114 1 1 4 HIS CA C -7.893 1.514 0.271 1.00 . A A . 4 HIS CA 1 1 5 2115 1 1 4 HIS CB C -9.260 1.820 -0.373 1.00 . A A . 4 HIS CB 1 1 5 2116 1 1 4 HIS CD2 C -8.538 3.022 -2.564 1.00 . A A . 4 HIS CD2 1 1 5 2117 1 1 4 HIS CE1 C -10.010 4.637 -2.515 1.00 . A A . 4 HIS CE1 1 1 5 2118 1 1 4 HIS CG C -9.271 2.880 -1.435 1.00 . A A . 4 HIS CG 1 1 5 2119 1 1 4 HIS H H -8.955 0.001 1.290 1.00 . A A . 4 HIS H 1 1 5 2120 1 1 4 HIS HA H -7.191 1.238 -0.501 1.00 . A A . 4 HIS HA 1 1 5 2121 1 1 4 HIS HB2 H -9.657 0.922 -0.817 1.00 . A A . 4 HIS HB2 1 1 5 2122 1 1 4 HIS HB3 H -9.933 2.135 0.410 1.00 . A A . 4 HIS HB3 1 1 5 2123 1 1 4 HIS HD1 H -10.876 4.067 -0.769 1.00 . A A . 4 HIS HD1 1 1 5 2124 1 1 4 HIS HD2 H -7.726 2.386 -2.887 1.00 . A A . 4 HIS HD2 1 1 5 2125 1 1 4 HIS HE1 H -10.596 5.506 -2.770 1.00 . A A . 4 HIS HE1 1 1 5 2126 1 1 4 HIS HE2 H -8.878 4.314 -4.173 1.00 . A A . 4 HIS HE2 1 1 5 2127 1 1 4 HIS N N -8.055 0.382 1.180 1.00 . A A . 4 HIS N 1 1 5 2128 1 1 4 HIS ND1 N -10.178 3.910 -1.443 1.00 . A A . 4 HIS ND1 1 1 5 2129 1 1 4 HIS NE2 N -9.020 4.125 -3.217 1.00 . A A . 4 HIS NE2 1 1 5 2130 1 1 4 HIS O O -7.892 3.089 2.089 1.00 . A A . 4 HIS O 1 1 5 2131 1 1 5 TYR C C -4.878 4.202 2.419 1.00 . A A . 5 TYR C 1 1 5 2132 1 1 5 TYR CA C -5.643 4.510 1.140 1.00 . A A . 5 TYR CA 1 1 5 2133 1 1 5 TYR CB C -6.561 5.740 1.279 1.00 . A A . 5 TYR CB 1 1 5 2134 1 1 5 TYR CD1 C -5.914 7.851 0.099 1.00 . A A . 5 TYR CD1 1 1 5 2135 1 1 5 TYR CD2 C -7.154 6.237 -1.119 1.00 . A A . 5 TYR CD2 1 1 5 2136 1 1 5 TYR CE1 C -5.861 8.662 -1.008 1.00 . A A . 5 TYR CE1 1 1 5 2137 1 1 5 TYR CE2 C -7.113 7.047 -2.236 1.00 . A A . 5 TYR CE2 1 1 5 2138 1 1 5 TYR CG C -6.558 6.627 0.064 1.00 . A A . 5 TYR CG 1 1 5 2139 1 1 5 TYR CZ C -6.460 8.258 -2.174 1.00 . A A . 5 TYR CZ 1 1 5 2140 1 1 5 TYR H H -5.904 2.979 -0.317 1.00 . A A . 5 TYR H 1 1 5 2141 1 1 5 TYR HA H -4.867 4.767 0.434 1.00 . A A . 5 TYR HA 1 1 5 2142 1 1 5 TYR HB2 H -7.574 5.405 1.443 1.00 . A A . 5 TYR HB2 1 1 5 2143 1 1 5 TYR HB3 H -6.238 6.327 2.126 1.00 . A A . 5 TYR HB3 1 1 5 2144 1 1 5 TYR HD1 H -5.443 8.164 1.020 1.00 . A A . 5 TYR HD1 1 1 5 2145 1 1 5 TYR HD2 H -7.667 5.287 -1.162 1.00 . A A . 5 TYR HD2 1 1 5 2146 1 1 5 TYR HE1 H -5.352 9.614 -0.959 1.00 . A A . 5 TYR HE1 1 1 5 2147 1 1 5 TYR HE2 H -7.585 6.725 -3.152 1.00 . A A . 5 TYR HE2 1 1 5 2148 1 1 5 TYR HH H -5.445 9.256 -3.377 1.00 . A A . 5 TYR HH 1 1 5 2149 1 1 5 TYR N N -6.284 3.340 0.515 1.00 . A A . 5 TYR N 1 1 5 2150 1 1 5 TYR O O -5.210 4.688 3.499 1.00 . A A . 5 TYR O 1 1 5 2151 1 1 5 TYR OH O -6.390 9.063 -3.290 1.00 . A A . 5 TYR OH 1 1 5 2152 1 1 6 GLY C C -1.749 2.475 2.809 1.00 . A A . 6 GLY C 1 1 5 2153 1 1 6 GLY CA C -3.030 3.004 3.377 1.00 . A A . 6 GLY CA 1 1 5 2154 1 1 6 GLY H H -3.726 2.920 1.427 1.00 . A A . 6 GLY H 1 1 5 2155 1 1 6 GLY HA2 H -2.837 3.881 3.979 1.00 . A A . 6 GLY HA2 1 1 5 2156 1 1 6 GLY HA3 H -3.487 2.236 3.984 1.00 . A A . 6 GLY HA3 1 1 5 2157 1 1 6 GLY N N -3.903 3.347 2.290 1.00 . A A . 6 GLY N 1 1 5 2158 1 1 6 GLY O O -1.756 1.999 1.653 1.00 . A A . 6 GLY O 1 1 5 2159 1 1 7 GLN C C 0.634 0.564 3.116 1.00 . A A . 7 GLN C 1 1 5 2160 1 1 7 GLN CA C 0.625 2.087 3.093 1.00 . A A . 7 GLN CA 1 1 5 2161 1 1 7 GLN CB C 1.791 2.665 3.921 1.00 . A A . 7 GLN CB 1 1 5 2162 1 1 7 GLN CD C 4.318 2.902 4.237 1.00 . A A . 7 GLN CD 1 1 5 2163 1 1 7 GLN CG C 3.191 2.298 3.398 1.00 . A A . 7 GLN CG 1 1 5 2164 1 1 7 GLN H H -0.719 2.979 4.451 1.00 . A A . 7 GLN H 1 1 5 2165 1 1 7 GLN HA H 0.727 2.404 2.065 1.00 . A A . 7 GLN HA 1 1 5 2166 1 1 7 GLN HB2 H 1.711 3.741 3.927 1.00 . A A . 7 GLN HB2 1 1 5 2167 1 1 7 GLN HB3 H 1.705 2.306 4.937 1.00 . A A . 7 GLN HB3 1 1 5 2168 1 1 7 GLN HE21 H 5.582 2.994 2.672 1.00 . A A . 7 GLN HE21 1 1 5 2169 1 1 7 GLN HE22 H 6.192 3.504 4.182 1.00 . A A . 7 GLN HE22 1 1 5 2170 1 1 7 GLN HG2 H 3.286 1.222 3.424 1.00 . A A . 7 GLN HG2 1 1 5 2171 1 1 7 GLN HG3 H 3.285 2.636 2.377 1.00 . A A . 7 GLN HG3 1 1 5 2172 1 1 7 GLN N N -0.659 2.574 3.558 1.00 . A A . 7 GLN N 1 1 5 2173 1 1 7 GLN NE2 N 5.453 3.163 3.630 1.00 . A A . 7 GLN NE2 1 1 5 2174 1 1 7 GLN O O 0.513 -0.047 4.165 1.00 . A A . 7 GLN O 1 1 5 2175 1 1 7 GLN OE1 O 4.166 3.122 5.426 1.00 . A A . 7 GLN OE1 1 1 5 2176 1 1 8 CYS C C 2.084 -2.090 1.857 1.00 . A A . 8 CYS C 1 1 5 2177 1 1 8 CYS CA C 0.709 -1.465 1.795 1.00 . A A . 8 CYS CA 1 1 5 2178 1 1 8 CYS CB C 0.045 -1.810 0.478 1.00 . A A . 8 CYS CB 1 1 5 2179 1 1 8 CYS H H 0.805 0.553 1.157 1.00 . A A . 8 CYS H 1 1 5 2180 1 1 8 CYS HA H 0.112 -1.891 2.586 1.00 . A A . 8 CYS HA 1 1 5 2181 1 1 8 CYS HB2 H 0.207 -2.856 0.262 1.00 . A A . 8 CYS HB2 1 1 5 2182 1 1 8 CYS HB3 H -1.016 -1.624 0.540 1.00 . A A . 8 CYS HB3 1 1 5 2183 1 1 8 CYS N N 0.737 -0.017 1.954 1.00 . A A . 8 CYS N 1 1 5 2184 1 1 8 CYS O O 2.251 -3.171 2.380 1.00 . A A . 8 CYS O 1 1 5 2185 1 1 8 CYS SG S 0.693 -0.844 -0.935 1.00 . A A . 8 CYS SG 1 1 5 2186 1 1 9 GLY C C 5.371 -1.189 0.574 1.00 . A A . 9 GLY C 1 1 5 2187 1 1 9 GLY CA C 4.379 -2.007 1.322 1.00 . A A . 9 GLY CA 1 1 5 2188 1 1 9 GLY H H 2.907 -0.541 0.935 1.00 . A A . 9 GLY H 1 1 5 2189 1 1 9 GLY HA2 H 4.723 -2.115 2.340 1.00 . A A . 9 GLY HA2 1 1 5 2190 1 1 9 GLY HA3 H 4.320 -2.985 0.866 1.00 . A A . 9 GLY HA3 1 1 5 2191 1 1 9 GLY N N 3.072 -1.421 1.327 1.00 . A A . 9 GLY N 1 1 5 2192 1 1 9 GLY O O 5.530 -1.331 -0.645 1.00 . A A . 9 GLY O 1 1 5 2193 1 1 10 GLY C C 8.318 0.104 1.330 1.00 . A A . 10 GLY C 1 1 5 2194 1 1 10 GLY CA C 7.024 0.496 0.698 1.00 . A A . 10 GLY CA 1 1 5 2195 1 1 10 GLY H H 5.759 -0.177 2.211 1.00 . A A . 10 GLY H 1 1 5 2196 1 1 10 GLY HA2 H 7.066 0.318 -0.367 1.00 . A A . 10 GLY HA2 1 1 5 2197 1 1 10 GLY HA3 H 6.842 1.543 0.889 1.00 . A A . 10 GLY HA3 1 1 5 2198 1 1 10 GLY N N 5.979 -0.288 1.265 1.00 . A A . 10 GLY N 1 1 5 2199 1 1 10 GLY O O 8.322 -0.756 2.225 1.00 . A A . 10 GLY O 1 1 5 2200 1 1 11 ILE C C 10.703 0.804 2.965 1.00 . A A . 11 ILE C 1 1 5 2201 1 1 11 ILE CA C 10.700 0.403 1.485 1.00 . A A . 11 ILE CA 1 1 5 2202 1 1 11 ILE CB C 11.854 1.144 0.756 1.00 . A A . 11 ILE CB 1 1 5 2203 1 1 11 ILE CD1 C 12.855 1.656 -1.543 1.00 . A A . 11 ILE CD1 1 1 5 2204 1 1 11 ILE CG1 C 11.821 0.867 -0.755 1.00 . A A . 11 ILE CG1 1 1 5 2205 1 1 11 ILE CG2 C 13.208 0.727 1.344 1.00 . A A . 11 ILE CG2 1 1 5 2206 1 1 11 ILE H H 9.338 1.393 0.212 1.00 . A A . 11 ILE H 1 1 5 2207 1 1 11 ILE HA H 10.853 -0.664 1.410 1.00 . A A . 11 ILE HA 1 1 5 2208 1 1 11 ILE HB H 11.734 2.204 0.923 1.00 . A A . 11 ILE HB 1 1 5 2209 1 1 11 ILE HD11 H 12.711 2.713 -1.373 1.00 . A A . 11 ILE HD11 1 1 5 2210 1 1 11 ILE HD12 H 12.742 1.450 -2.597 1.00 . A A . 11 ILE HD12 1 1 5 2211 1 1 11 ILE HD13 H 13.847 1.372 -1.223 1.00 . A A . 11 ILE HD13 1 1 5 2212 1 1 11 ILE HG12 H 12.007 -0.183 -0.925 1.00 . A A . 11 ILE HG12 1 1 5 2213 1 1 11 ILE HG13 H 10.843 1.123 -1.138 1.00 . A A . 11 ILE HG13 1 1 5 2214 1 1 11 ILE HG21 H 14.003 1.236 0.821 1.00 . A A . 11 ILE HG21 1 1 5 2215 1 1 11 ILE HG22 H 13.334 -0.340 1.242 1.00 . A A . 11 ILE HG22 1 1 5 2216 1 1 11 ILE HG23 H 13.238 0.989 2.392 1.00 . A A . 11 ILE HG23 1 1 5 2217 1 1 11 ILE N N 9.403 0.711 0.914 1.00 . A A . 11 ILE N 1 1 5 2218 1 1 11 ILE O O 10.483 1.971 3.307 1.00 . A A . 11 ILE O 1 1 5 2219 1 1 12 GLY C C 9.637 -0.223 5.939 1.00 . A A . 12 GLY C 1 1 5 2220 1 1 12 GLY CA C 10.926 0.107 5.229 1.00 . A A . 12 GLY CA 1 1 5 2221 1 1 12 GLY H H 10.910 -1.092 3.498 1.00 . A A . 12 GLY H 1 1 5 2222 1 1 12 GLY HA2 H 11.724 -0.478 5.663 1.00 . A A . 12 GLY HA2 1 1 5 2223 1 1 12 GLY HA3 H 11.144 1.156 5.373 1.00 . A A . 12 GLY HA3 1 1 5 2224 1 1 12 GLY N N 10.861 -0.166 3.822 1.00 . A A . 12 GLY N 1 1 5 2225 1 1 12 GLY O O 9.591 -0.231 7.172 1.00 . A A . 12 GLY O 1 1 5 2226 1 1 13 TYR C C 7.283 -2.317 6.088 1.00 . A A . 13 TYR C 1 1 5 2227 1 1 13 TYR CA C 7.312 -0.839 5.764 1.00 . A A . 13 TYR CA 1 1 5 2228 1 1 13 TYR CB C 6.153 -0.461 4.828 1.00 . A A . 13 TYR CB 1 1 5 2229 1 1 13 TYR CD1 C 4.172 0.132 6.288 1.00 . A A . 13 TYR CD1 1 1 5 2230 1 1 13 TYR CD2 C 4.060 -1.889 5.040 1.00 . A A . 13 TYR CD2 1 1 5 2231 1 1 13 TYR CE1 C 2.914 -0.108 6.798 1.00 . A A . 13 TYR CE1 1 1 5 2232 1 1 13 TYR CE2 C 2.805 -2.139 5.551 1.00 . A A . 13 TYR CE2 1 1 5 2233 1 1 13 TYR CG C 4.768 -0.747 5.398 1.00 . A A . 13 TYR CG 1 1 5 2234 1 1 13 TYR CZ C 2.236 -1.243 6.427 1.00 . A A . 13 TYR CZ 1 1 5 2235 1 1 13 TYR H H 8.694 -0.507 4.201 1.00 . A A . 13 TYR H 1 1 5 2236 1 1 13 TYR HA H 7.219 -0.287 6.688 1.00 . A A . 13 TYR HA 1 1 5 2237 1 1 13 TYR HB2 H 6.204 0.598 4.622 1.00 . A A . 13 TYR HB2 1 1 5 2238 1 1 13 TYR HB3 H 6.256 -1.001 3.900 1.00 . A A . 13 TYR HB3 1 1 5 2239 1 1 13 TYR HD1 H 4.705 1.026 6.577 1.00 . A A . 13 TYR HD1 1 1 5 2240 1 1 13 TYR HD2 H 4.510 -2.594 4.357 1.00 . A A . 13 TYR HD2 1 1 5 2241 1 1 13 TYR HE1 H 2.470 0.591 7.490 1.00 . A A . 13 TYR HE1 1 1 5 2242 1 1 13 TYR HE2 H 2.273 -3.033 5.258 1.00 . A A . 13 TYR HE2 1 1 5 2243 1 1 13 TYR HH H 0.430 -0.732 6.660 1.00 . A A . 13 TYR HH 1 1 5 2244 1 1 13 TYR N N 8.595 -0.502 5.180 1.00 . A A . 13 TYR N 1 1 5 2245 1 1 13 TYR O O 7.866 -3.142 5.356 1.00 . A A . 13 TYR O 1 1 5 2246 1 1 13 TYR OH O 0.977 -1.480 6.930 1.00 . A A . 13 TYR OH 1 1 5 2247 1 1 14 SER C C 5.155 -4.283 8.116 1.00 . A A . 14 SER C 1 1 5 2248 1 1 14 SER CA C 6.575 -4.001 7.629 1.00 . A A . 14 SER CA 1 1 5 2249 1 1 14 SER CB C 7.610 -4.153 8.754 1.00 . A A . 14 SER CB 1 1 5 2250 1 1 14 SER H H 6.182 -1.970 7.709 1.00 . A A . 14 SER H 1 1 5 2251 1 1 14 SER HA H 6.831 -4.667 6.820 1.00 . A A . 14 SER HA 1 1 5 2252 1 1 14 SER HB2 H 7.245 -3.657 9.641 1.00 . A A . 14 SER HB2 1 1 5 2253 1 1 14 SER HB3 H 7.786 -5.199 8.952 1.00 . A A . 14 SER HB3 1 1 5 2254 1 1 14 SER N N 6.637 -2.651 7.170 1.00 . A A . 14 SER N 1 1 5 2255 1 1 14 SER O O 4.767 -3.857 9.205 1.00 . A A . 14 SER O 1 1 5 2256 1 1 14 SER OG O 8.863 -3.532 8.313 1.00 . A A . 14 SER OG 1 1 5 2257 1 1 15 GLY C C 2.234 -5.966 6.593 1.00 . A A . 15 GLY C 1 1 5 2258 1 1 15 GLY CA C 2.987 -5.187 7.657 1.00 . A A . 15 GLY CA 1 1 5 2259 1 1 15 GLY H H 4.677 -5.210 6.399 1.00 . A A . 15 GLY H 1 1 5 2260 1 1 15 GLY HA2 H 2.977 -5.747 8.579 1.00 . A A . 15 GLY HA2 1 1 5 2261 1 1 15 GLY HA3 H 2.493 -4.240 7.814 1.00 . A A . 15 GLY HA3 1 1 5 2262 1 1 15 GLY N N 4.353 -4.918 7.280 1.00 . A A . 15 GLY N 1 1 5 2263 1 1 15 GLY O O 2.822 -6.855 5.955 1.00 . A A . 15 GLY O 1 1 5 2264 1 1 16 PRO C C 0.319 -5.775 4.008 1.00 . A A . 16 PRO C 1 1 5 2265 1 1 16 PRO CA C 0.114 -6.345 5.401 1.00 . A A . 16 PRO CA 1 1 5 2266 1 1 16 PRO CB C -1.327 -6.083 5.874 1.00 . A A . 16 PRO CB 1 1 5 2267 1 1 16 PRO CD C 0.184 -4.613 7.050 1.00 . A A . 16 PRO CD 1 1 5 2268 1 1 16 PRO CG C -1.217 -5.141 7.034 1.00 . A A . 16 PRO CG 1 1 5 2269 1 1 16 PRO HA H 0.311 -7.405 5.405 1.00 . A A . 16 PRO HA 1 1 5 2270 1 1 16 PRO HB2 H -1.895 -5.647 5.064 1.00 . A A . 16 PRO HB2 1 1 5 2271 1 1 16 PRO HB3 H -1.784 -7.016 6.171 1.00 . A A . 16 PRO HB3 1 1 5 2272 1 1 16 PRO HD2 H 0.244 -3.680 6.509 1.00 . A A . 16 PRO HD2 1 1 5 2273 1 1 16 PRO HD3 H 0.517 -4.491 8.069 1.00 . A A . 16 PRO HD3 1 1 5 2274 1 1 16 PRO HG2 H -1.920 -4.330 6.921 1.00 . A A . 16 PRO HG2 1 1 5 2275 1 1 16 PRO HG3 H -1.419 -5.685 7.944 1.00 . A A . 16 PRO HG3 1 1 5 2276 1 1 16 PRO N N 0.938 -5.662 6.375 1.00 . A A . 16 PRO N 1 1 5 2277 1 1 16 PRO O O -0.138 -4.672 3.701 1.00 . A A . 16 PRO O 1 1 5 2278 1 1 17 THR C C 0.236 -6.409 0.852 1.00 . A A . 17 THR C 1 1 5 2279 1 1 17 THR CA C 1.328 -6.066 1.865 1.00 . A A . 17 THR CA 1 1 5 2280 1 1 17 THR CB C 2.669 -6.664 1.451 1.00 . A A . 17 THR CB 1 1 5 2281 1 1 17 THR CG2 C 3.778 -6.114 2.330 1.00 . A A . 17 THR CG2 1 1 5 2282 1 1 17 THR H H 1.311 -7.410 3.447 1.00 . A A . 17 THR H 1 1 5 2283 1 1 17 THR HA H 1.440 -4.992 1.904 1.00 . A A . 17 THR HA 1 1 5 2284 1 1 17 THR HB H 2.872 -6.407 0.423 1.00 . A A . 17 THR HB 1 1 5 2285 1 1 17 THR HG1 H 3.346 -8.377 2.153 1.00 . A A . 17 THR HG1 1 1 5 2286 1 1 17 THR HG21 H 3.574 -6.374 3.358 1.00 . A A . 17 THR HG21 1 1 5 2287 1 1 17 THR HG22 H 3.805 -5.038 2.235 1.00 . A A . 17 THR HG22 1 1 5 2288 1 1 17 THR HG23 H 4.727 -6.533 2.032 1.00 . A A . 17 THR HG23 1 1 5 2289 1 1 17 THR N N 0.993 -6.519 3.181 1.00 . A A . 17 THR N 1 1 5 2290 1 1 17 THR O O 0.265 -5.954 -0.306 1.00 . A A . 17 THR O 1 1 5 2291 1 1 17 THR OG1 O 2.611 -8.088 1.600 1.00 . A A . 17 THR OG1 1 1 5 2292 1 1 18 VAL C C -2.933 -6.586 0.635 1.00 . A A . 18 VAL C 1 1 5 2293 1 1 18 VAL CA C -1.829 -7.590 0.451 1.00 . A A . 18 VAL CA 1 1 5 2294 1 1 18 VAL CB C -2.365 -9.002 0.814 1.00 . A A . 18 VAL CB 1 1 5 2295 1 1 18 VAL CG1 C -3.552 -9.395 -0.064 1.00 . A A . 18 VAL CG1 1 1 5 2296 1 1 18 VAL CG2 C -1.268 -10.023 0.686 1.00 . A A . 18 VAL CG2 1 1 5 2297 1 1 18 VAL H H -0.659 -7.553 2.198 1.00 . A A . 18 VAL H 1 1 5 2298 1 1 18 VAL HA H -1.509 -7.588 -0.580 1.00 . A A . 18 VAL HA 1 1 5 2299 1 1 18 VAL HB H -2.695 -8.983 1.842 1.00 . A A . 18 VAL HB 1 1 5 2300 1 1 18 VAL HG11 H -3.908 -10.371 0.229 1.00 . A A . 18 VAL HG11 1 1 5 2301 1 1 18 VAL HG12 H -3.238 -9.422 -1.097 1.00 . A A . 18 VAL HG12 1 1 5 2302 1 1 18 VAL HG13 H -4.343 -8.671 0.053 1.00 . A A . 18 VAL HG13 1 1 5 2303 1 1 18 VAL HG21 H -0.431 -9.712 1.294 1.00 . A A . 18 VAL HG21 1 1 5 2304 1 1 18 VAL HG22 H -0.965 -10.104 -0.348 1.00 . A A . 18 VAL HG22 1 1 5 2305 1 1 18 VAL HG23 H -1.621 -10.979 1.036 1.00 . A A . 18 VAL HG23 1 1 5 2306 1 1 18 VAL N N -0.714 -7.213 1.281 1.00 . A A . 18 VAL N 1 1 5 2307 1 1 18 VAL O O -3.395 -6.362 1.763 1.00 . A A . 18 VAL O 1 1 5 2308 1 1 19 CYS C C -5.712 -5.782 -0.614 1.00 . A A . 19 CYS C 1 1 5 2309 1 1 19 CYS CA C -4.417 -5.043 -0.383 1.00 . A A . 19 CYS CA 1 1 5 2310 1 1 19 CYS CB C -4.233 -3.938 -1.420 1.00 . A A . 19 CYS CB 1 1 5 2311 1 1 19 CYS H H -2.903 -6.173 -1.287 1.00 . A A . 19 CYS H 1 1 5 2312 1 1 19 CYS HA H -4.435 -4.606 0.604 1.00 . A A . 19 CYS HA 1 1 5 2313 1 1 19 CYS HB2 H -4.234 -4.362 -2.413 1.00 . A A . 19 CYS HB2 1 1 5 2314 1 1 19 CYS HB3 H -5.050 -3.233 -1.327 1.00 . A A . 19 CYS HB3 1 1 5 2315 1 1 19 CYS N N -3.333 -5.975 -0.429 1.00 . A A . 19 CYS N 1 1 5 2316 1 1 19 CYS O O -5.711 -6.873 -1.201 1.00 . A A . 19 CYS O 1 1 5 2317 1 1 19 CYS SG S -2.694 -2.996 -1.215 1.00 . A A . 19 CYS SG 1 1 5 2318 1 1 20 ALA C C -8.449 -5.964 -1.738 1.00 . A A . 20 ALA C 1 1 5 2319 1 1 20 ALA CA C -8.119 -5.776 -0.266 1.00 . A A . 20 ALA CA 1 1 5 2320 1 1 20 ALA CB C -9.133 -4.862 0.391 1.00 . A A . 20 ALA CB 1 1 5 2321 1 1 20 ALA H H -6.677 -4.386 0.397 1.00 . A A . 20 ALA H 1 1 5 2322 1 1 20 ALA HA H -8.147 -6.734 0.230 1.00 . A A . 20 ALA HA 1 1 5 2323 1 1 20 ALA HB1 H -10.118 -5.295 0.299 1.00 . A A . 20 ALA HB1 1 1 5 2324 1 1 20 ALA HB2 H -9.115 -3.900 -0.100 1.00 . A A . 20 ALA HB2 1 1 5 2325 1 1 20 ALA HB3 H -8.889 -4.738 1.435 1.00 . A A . 20 ALA HB3 1 1 5 2326 1 1 20 ALA N N -6.791 -5.219 -0.112 1.00 . A A . 20 ALA N 1 1 5 2327 1 1 20 ALA O O -7.971 -5.195 -2.588 1.00 . A A . 20 ALA O 1 1 5 2328 1 1 21 SER C C -10.284 -6.084 -4.047 1.00 . A A . 21 SER C 1 1 5 2329 1 1 21 SER CA C -9.599 -7.278 -3.392 1.00 . A A . 21 SER CA 1 1 5 2330 1 1 21 SER CB C -10.484 -8.514 -3.408 1.00 . A A . 21 SER CB 1 1 5 2331 1 1 21 SER H H -9.595 -7.523 -1.314 1.00 . A A . 21 SER H 1 1 5 2332 1 1 21 SER HA H -8.689 -7.493 -3.934 1.00 . A A . 21 SER HA 1 1 5 2333 1 1 21 SER HB2 H -11.383 -8.314 -2.846 1.00 . A A . 21 SER HB2 1 1 5 2334 1 1 21 SER HB3 H -10.740 -8.767 -4.427 1.00 . A A . 21 SER HB3 1 1 5 2335 1 1 21 SER HG H -10.313 -9.923 -2.069 1.00 . A A . 21 SER HG 1 1 5 2336 1 1 21 SER N N -9.231 -6.967 -2.036 1.00 . A A . 21 SER N 1 1 5 2337 1 1 21 SER O O -11.317 -5.600 -3.570 1.00 . A A . 21 SER O 1 1 5 2338 1 1 21 SER OG O -9.793 -9.616 -2.818 1.00 . A A . 21 SER OG 1 1 5 2339 1 1 22 GLY C C -9.253 -3.264 -5.607 1.00 . A A . 22 GLY C 1 1 5 2340 1 1 22 GLY CA C -10.188 -4.435 -5.767 1.00 . A A . 22 GLY CA 1 1 5 2341 1 1 22 GLY H H -8.900 -6.057 -5.476 1.00 . A A . 22 GLY H 1 1 5 2342 1 1 22 GLY HA2 H -10.314 -4.643 -6.818 1.00 . A A . 22 GLY HA2 1 1 5 2343 1 1 22 GLY HA3 H -11.145 -4.176 -5.339 1.00 . A A . 22 GLY HA3 1 1 5 2344 1 1 22 GLY N N -9.692 -5.605 -5.112 1.00 . A A . 22 GLY N 1 1 5 2345 1 1 22 GLY O O -9.373 -2.266 -6.329 1.00 . A A . 22 GLY O 1 1 5 2346 1 1 23 THR C C -5.955 -2.911 -4.743 1.00 . A A . 23 THR C 1 1 5 2347 1 1 23 THR CA C -7.338 -2.337 -4.461 1.00 . A A . 23 THR CA 1 1 5 2348 1 1 23 THR CB C -7.392 -1.713 -3.029 1.00 . A A . 23 THR CB 1 1 5 2349 1 1 23 THR CG2 C -8.705 -1.006 -2.794 1.00 . A A . 23 THR CG2 1 1 5 2350 1 1 23 THR H H -8.304 -4.166 -4.094 1.00 . A A . 23 THR H 1 1 5 2351 1 1 23 THR HA H -7.531 -1.565 -5.191 1.00 . A A . 23 THR HA 1 1 5 2352 1 1 23 THR HB H -6.595 -0.989 -2.947 1.00 . A A . 23 THR HB 1 1 5 2353 1 1 23 THR HG1 H -7.438 -3.578 -2.362 1.00 . A A . 23 THR HG1 1 1 5 2354 1 1 23 THR HG21 H -9.518 -1.707 -2.904 1.00 . A A . 23 THR HG21 1 1 5 2355 1 1 23 THR HG22 H -8.814 -0.204 -3.508 1.00 . A A . 23 THR HG22 1 1 5 2356 1 1 23 THR HG23 H -8.711 -0.605 -1.793 1.00 . A A . 23 THR HG23 1 1 5 2357 1 1 23 THR N N -8.333 -3.366 -4.666 1.00 . A A . 23 THR N 1 1 5 2358 1 1 23 THR O O -5.673 -4.066 -4.403 1.00 . A A . 23 THR O 1 1 5 2359 1 1 23 THR OG1 O -7.214 -2.705 -2.009 1.00 . A A . 23 THR OG1 1 1 5 2360 1 1 24 THR C C -2.738 -1.817 -5.006 1.00 . A A . 24 THR C 1 1 5 2361 1 1 24 THR CA C -3.811 -2.584 -5.749 1.00 . A A . 24 THR CA 1 1 5 2362 1 1 24 THR CB C -3.612 -2.448 -7.274 1.00 . A A . 24 THR CB 1 1 5 2363 1 1 24 THR CG2 C -4.368 -3.544 -8.011 1.00 . A A . 24 THR CG2 1 1 5 2364 1 1 24 THR H H -5.390 -1.214 -5.580 1.00 . A A . 24 THR H 1 1 5 2365 1 1 24 THR HA H -3.726 -3.629 -5.491 1.00 . A A . 24 THR HA 1 1 5 2366 1 1 24 THR HB H -2.558 -2.545 -7.483 1.00 . A A . 24 THR HB 1 1 5 2367 1 1 24 THR HG1 H -4.695 -0.746 -7.116 1.00 . A A . 24 THR HG1 1 1 5 2368 1 1 24 THR HG21 H -5.423 -3.466 -7.789 1.00 . A A . 24 THR HG21 1 1 5 2369 1 1 24 THR HG22 H -4.006 -4.510 -7.692 1.00 . A A . 24 THR HG22 1 1 5 2370 1 1 24 THR HG23 H -4.217 -3.437 -9.075 1.00 . A A . 24 THR HG23 1 1 5 2371 1 1 24 THR N N -5.124 -2.141 -5.369 1.00 . A A . 24 THR N 1 1 5 2372 1 1 24 THR O O -2.882 -0.618 -4.776 1.00 . A A . 24 THR O 1 1 5 2373 1 1 24 THR OG1 O -4.060 -1.137 -7.741 1.00 . A A . 24 THR OG1 1 1 5 2374 1 1 25 CYS C C 0.281 -1.152 -4.930 1.00 . A A . 25 CYS C 1 1 5 2375 1 1 25 CYS CA C -0.593 -1.859 -3.916 1.00 . A A . 25 CYS CA 1 1 5 2376 1 1 25 CYS CB C 0.222 -2.900 -3.111 1.00 . A A . 25 CYS CB 1 1 5 2377 1 1 25 CYS H H -1.597 -3.452 -4.832 1.00 . A A . 25 CYS H 1 1 5 2378 1 1 25 CYS HA H -1.012 -1.126 -3.242 1.00 . A A . 25 CYS HA 1 1 5 2379 1 1 25 CYS HB2 H -0.441 -3.404 -2.423 1.00 . A A . 25 CYS HB2 1 1 5 2380 1 1 25 CYS HB3 H 0.642 -3.624 -3.793 1.00 . A A . 25 CYS HB3 1 1 5 2381 1 1 25 CYS N N -1.681 -2.497 -4.621 1.00 . A A . 25 CYS N 1 1 5 2382 1 1 25 CYS O O 1.090 -1.773 -5.616 1.00 . A A . 25 CYS O 1 1 5 2383 1 1 25 CYS SG S 1.596 -2.216 -2.112 1.00 . A A . 25 CYS SG 1 1 5 2384 1 1 26 GLN C C 1.852 1.705 -5.333 1.00 . A A . 26 GLN C 1 1 5 2385 1 1 26 GLN CA C 0.807 0.891 -6.040 1.00 . A A . 26 GLN CA 1 1 5 2386 1 1 26 GLN CB C -0.117 1.793 -6.858 1.00 . A A . 26 GLN CB 1 1 5 2387 1 1 26 GLN CD C -2.019 1.935 -8.519 1.00 . A A . 26 GLN CD 1 1 5 2388 1 1 26 GLN CG C -1.173 1.032 -7.650 1.00 . A A . 26 GLN CG 1 1 5 2389 1 1 26 GLN H H -0.603 0.578 -4.521 1.00 . A A . 26 GLN H 1 1 5 2390 1 1 26 GLN HA H 1.299 0.199 -6.706 1.00 . A A . 26 GLN HA 1 1 5 2391 1 1 26 GLN HB2 H -0.618 2.475 -6.187 1.00 . A A . 26 GLN HB2 1 1 5 2392 1 1 26 GLN HB3 H 0.483 2.365 -7.551 1.00 . A A . 26 GLN HB3 1 1 5 2393 1 1 26 GLN HE21 H -3.540 0.687 -8.350 1.00 . A A . 26 GLN HE21 1 1 5 2394 1 1 26 GLN HE22 H -3.836 2.091 -9.302 1.00 . A A . 26 GLN HE22 1 1 5 2395 1 1 26 GLN HG2 H -0.686 0.306 -8.282 1.00 . A A . 26 GLN HG2 1 1 5 2396 1 1 26 GLN HG3 H -1.821 0.520 -6.953 1.00 . A A . 26 GLN HG3 1 1 5 2397 1 1 26 GLN N N 0.067 0.124 -5.083 1.00 . A A . 26 GLN N 1 1 5 2398 1 1 26 GLN NE2 N -3.245 1.537 -8.749 1.00 . A A . 26 GLN NE2 1 1 5 2399 1 1 26 GLN O O 1.579 2.312 -4.291 1.00 . A A . 26 GLN O 1 1 5 2400 1 1 26 GLN OE1 O -1.560 2.987 -8.995 1.00 . A A . 26 GLN OE1 1 1 5 2401 1 1 27 VAL C C 3.985 3.896 -5.729 1.00 . A A . 27 VAL C 1 1 5 2402 1 1 27 VAL CA C 4.124 2.442 -5.299 1.00 . A A . 27 VAL CA 1 1 5 2403 1 1 27 VAL CB C 5.494 1.850 -5.737 1.00 . A A . 27 VAL CB 1 1 5 2404 1 1 27 VAL CG1 C 6.645 2.548 -5.038 1.00 . A A . 27 VAL CG1 1 1 5 2405 1 1 27 VAL CG2 C 5.541 0.353 -5.454 1.00 . A A . 27 VAL CG2 1 1 5 2406 1 1 27 VAL H H 3.194 1.235 -6.718 1.00 . A A . 27 VAL H 1 1 5 2407 1 1 27 VAL HA H 4.029 2.382 -4.225 1.00 . A A . 27 VAL HA 1 1 5 2408 1 1 27 VAL HB H 5.604 1.995 -6.801 1.00 . A A . 27 VAL HB 1 1 5 2409 1 1 27 VAL HG11 H 6.537 2.436 -3.970 1.00 . A A . 27 VAL HG11 1 1 5 2410 1 1 27 VAL HG12 H 6.638 3.598 -5.293 1.00 . A A . 27 VAL HG12 1 1 5 2411 1 1 27 VAL HG13 H 7.577 2.104 -5.352 1.00 . A A . 27 VAL HG13 1 1 5 2412 1 1 27 VAL HG21 H 5.413 0.183 -4.395 1.00 . A A . 27 VAL HG21 1 1 5 2413 1 1 27 VAL HG22 H 6.495 -0.043 -5.769 1.00 . A A . 27 VAL HG22 1 1 5 2414 1 1 27 VAL HG23 H 4.747 -0.142 -5.994 1.00 . A A . 27 VAL HG23 1 1 5 2415 1 1 27 VAL N N 3.035 1.712 -5.876 1.00 . A A . 27 VAL N 1 1 5 2416 1 1 27 VAL O O 4.298 4.263 -6.871 1.00 . A A . 27 VAL O 1 1 5 2417 1 1 28 LEU C C 4.442 6.884 -5.035 1.00 . A A . 28 LEU C 1 1 5 2418 1 1 28 LEU CA C 3.144 6.089 -5.126 1.00 . A A . 28 LEU CA 1 1 5 2419 1 1 28 LEU CB C 2.108 6.601 -4.087 1.00 . A A . 28 LEU CB 1 1 5 2420 1 1 28 LEU CD1 C 0.190 8.070 -3.383 1.00 . A A . 28 LEU CD1 1 1 5 2421 1 1 28 LEU CD2 C 1.981 9.047 -4.798 1.00 . A A . 28 LEU CD2 1 1 5 2422 1 1 28 LEU CG C 1.193 7.786 -4.487 1.00 . A A . 28 LEU CG 1 1 5 2423 1 1 28 LEU H H 3.260 4.335 -3.948 1.00 . A A . 28 LEU H 1 1 5 2424 1 1 28 LEU HA H 2.731 6.166 -6.119 1.00 . A A . 28 LEU HA 1 1 5 2425 1 1 28 LEU HB2 H 1.485 5.773 -3.782 1.00 . A A . 28 LEU HB2 1 1 5 2426 1 1 28 LEU HB3 H 2.674 6.909 -3.219 1.00 . A A . 28 LEU HB3 1 1 5 2427 1 1 28 LEU HD11 H 0.715 8.317 -2.472 1.00 . A A . 28 LEU HD11 1 1 5 2428 1 1 28 LEU HD12 H -0.425 7.198 -3.220 1.00 . A A . 28 LEU HD12 1 1 5 2429 1 1 28 LEU HD13 H -0.437 8.901 -3.670 1.00 . A A . 28 LEU HD13 1 1 5 2430 1 1 28 LEU HD21 H 2.540 9.346 -3.924 1.00 . A A . 28 LEU HD21 1 1 5 2431 1 1 28 LEU HD22 H 1.299 9.834 -5.082 1.00 . A A . 28 LEU HD22 1 1 5 2432 1 1 28 LEU HD23 H 2.664 8.851 -5.612 1.00 . A A . 28 LEU HD23 1 1 5 2433 1 1 28 LEU HG H 0.630 7.502 -5.364 1.00 . A A . 28 LEU HG 1 1 5 2434 1 1 28 LEU N N 3.446 4.699 -4.840 1.00 . A A . 28 LEU N 1 1 5 2435 1 1 28 LEU O O 4.777 7.685 -5.916 1.00 . A A . 28 LEU O 1 1 5 2436 1 1 29 ASN C C 7.409 6.164 -3.457 1.00 . A A . 29 ASN C 1 1 5 2437 1 1 29 ASN CA C 6.419 7.270 -3.717 1.00 . A A . 29 ASN CA 1 1 5 2438 1 1 29 ASN CB C 6.309 8.175 -2.472 1.00 . A A . 29 ASN CB 1 1 5 2439 1 1 29 ASN CG C 5.304 9.302 -2.604 1.00 . A A . 29 ASN CG 1 1 5 2440 1 1 29 ASN H H 4.890 5.907 -3.375 1.00 . A A . 29 ASN H 1 1 5 2441 1 1 29 ASN HA H 6.716 7.849 -4.578 1.00 . A A . 29 ASN HA 1 1 5 2442 1 1 29 ASN HB2 H 6.035 7.572 -1.621 1.00 . A A . 29 ASN HB2 1 1 5 2443 1 1 29 ASN HB3 H 7.283 8.606 -2.288 1.00 . A A . 29 ASN HB3 1 1 5 2444 1 1 29 ASN HD21 H 3.888 8.220 -1.741 1.00 . A A . 29 ASN HD21 1 1 5 2445 1 1 29 ASN HD22 H 3.454 9.824 -2.199 1.00 . A A . 29 ASN HD22 1 1 5 2446 1 1 29 ASN N N 5.166 6.623 -3.993 1.00 . A A . 29 ASN N 1 1 5 2447 1 1 29 ASN ND2 N 4.099 9.086 -2.142 1.00 . A A . 29 ASN ND2 1 1 5 2448 1 1 29 ASN O O 6.976 5.049 -3.222 1.00 . A A . 29 ASN O 1 1 5 2449 1 1 29 ASN OD1 O 5.623 10.366 -3.089 1.00 . A A . 29 ASN OD1 1 1 5 2450 1 1 30 PRO C C 9.544 4.561 -2.002 1.00 . A A . 30 PRO C 1 1 5 2451 1 1 30 PRO CA C 9.756 5.384 -3.278 1.00 . A A . 30 PRO CA 1 1 5 2452 1 1 30 PRO CB C 11.059 6.172 -3.202 1.00 . A A . 30 PRO CB 1 1 5 2453 1 1 30 PRO CD C 9.360 7.741 -3.734 1.00 . A A . 30 PRO CD 1 1 5 2454 1 1 30 PRO CG C 10.788 7.389 -4.004 1.00 . A A . 30 PRO CG 1 1 5 2455 1 1 30 PRO HA H 9.791 4.712 -4.124 1.00 . A A . 30 PRO HA 1 1 5 2456 1 1 30 PRO HB2 H 11.278 6.407 -2.171 1.00 . A A . 30 PRO HB2 1 1 5 2457 1 1 30 PRO HB3 H 11.861 5.589 -3.627 1.00 . A A . 30 PRO HB3 1 1 5 2458 1 1 30 PRO HD2 H 9.279 8.375 -2.863 1.00 . A A . 30 PRO HD2 1 1 5 2459 1 1 30 PRO HD3 H 8.910 8.216 -4.594 1.00 . A A . 30 PRO HD3 1 1 5 2460 1 1 30 PRO HG2 H 11.440 8.191 -3.689 1.00 . A A . 30 PRO HG2 1 1 5 2461 1 1 30 PRO HG3 H 10.932 7.177 -5.052 1.00 . A A . 30 PRO HG3 1 1 5 2462 1 1 30 PRO N N 8.735 6.427 -3.481 1.00 . A A . 30 PRO N 1 1 5 2463 1 1 30 PRO O O 9.819 3.357 -1.981 1.00 . A A . 30 PRO O 1 1 5 2464 1 1 31 TYR C C 7.317 4.346 0.557 1.00 . A A . 31 TYR C 1 1 5 2465 1 1 31 TYR CA C 8.817 4.483 0.282 1.00 . A A . 31 TYR CA 1 1 5 2466 1 1 31 TYR CB C 9.518 5.184 1.467 1.00 . A A . 31 TYR CB 1 1 5 2467 1 1 31 TYR CD1 C 11.586 6.388 0.629 1.00 . A A . 31 TYR CD1 1 1 5 2468 1 1 31 TYR CD2 C 11.859 4.362 1.834 1.00 . A A . 31 TYR CD2 1 1 5 2469 1 1 31 TYR CE1 C 12.955 6.489 0.476 1.00 . A A . 31 TYR CE1 1 1 5 2470 1 1 31 TYR CE2 C 13.222 4.455 1.692 1.00 . A A . 31 TYR CE2 1 1 5 2471 1 1 31 TYR CG C 11.017 5.315 1.311 1.00 . A A . 31 TYR CG 1 1 5 2472 1 1 31 TYR CZ C 13.766 5.514 1.013 1.00 . A A . 31 TYR CZ 1 1 5 2473 1 1 31 TYR H H 8.867 6.158 -1.006 1.00 . A A . 31 TYR H 1 1 5 2474 1 1 31 TYR HA H 9.239 3.495 0.175 1.00 . A A . 31 TYR HA 1 1 5 2475 1 1 31 TYR HB2 H 9.117 6.177 1.591 1.00 . A A . 31 TYR HB2 1 1 5 2476 1 1 31 TYR HB3 H 9.331 4.618 2.367 1.00 . A A . 31 TYR HB3 1 1 5 2477 1 1 31 TYR HD1 H 10.941 7.146 0.209 1.00 . A A . 31 TYR HD1 1 1 5 2478 1 1 31 TYR HD2 H 11.429 3.531 2.373 1.00 . A A . 31 TYR HD2 1 1 5 2479 1 1 31 TYR HE1 H 13.386 7.324 -0.055 1.00 . A A . 31 TYR HE1 1 1 5 2480 1 1 31 TYR HE2 H 13.857 3.690 2.114 1.00 . A A . 31 TYR HE2 1 1 5 2481 1 1 31 TYR HH H 15.429 4.744 0.504 1.00 . A A . 31 TYR HH 1 1 5 2482 1 1 31 TYR N N 9.058 5.197 -0.949 1.00 . A A . 31 TYR N 1 1 5 2483 1 1 31 TYR O O 6.890 3.432 1.252 1.00 . A A . 31 TYR O 1 1 5 2484 1 1 31 TYR OH O 15.136 5.593 0.864 1.00 . A A . 31 TYR OH 1 1 5 2485 1 1 32 TYR C C 4.385 4.378 -0.884 1.00 . A A . 32 TYR C 1 1 5 2486 1 1 32 TYR CA C 5.087 5.149 0.236 1.00 . A A . 32 TYR CA 1 1 5 2487 1 1 32 TYR CB C 4.442 6.531 0.410 1.00 . A A . 32 TYR CB 1 1 5 2488 1 1 32 TYR CD1 C 1.957 6.738 -0.005 1.00 . A A . 32 TYR CD1 1 1 5 2489 1 1 32 TYR CD2 C 2.684 6.078 2.162 1.00 . A A . 32 TYR CD2 1 1 5 2490 1 1 32 TYR CE1 C 0.646 6.640 0.403 1.00 . A A . 32 TYR CE1 1 1 5 2491 1 1 32 TYR CE2 C 1.373 5.984 2.580 1.00 . A A . 32 TYR CE2 1 1 5 2492 1 1 32 TYR CG C 3.000 6.458 0.865 1.00 . A A . 32 TYR CG 1 1 5 2493 1 1 32 TYR CZ C 0.358 6.263 1.698 1.00 . A A . 32 TYR CZ 1 1 5 2494 1 1 32 TYR H H 6.893 5.960 -0.523 1.00 . A A . 32 TYR H 1 1 5 2495 1 1 32 TYR HA H 4.947 4.593 1.151 1.00 . A A . 32 TYR HA 1 1 5 2496 1 1 32 TYR HB2 H 5.001 7.153 1.093 1.00 . A A . 32 TYR HB2 1 1 5 2497 1 1 32 TYR HB3 H 4.438 6.993 -0.565 1.00 . A A . 32 TYR HB3 1 1 5 2498 1 1 32 TYR HD1 H 2.184 7.035 -1.018 1.00 . A A . 32 TYR HD1 1 1 5 2499 1 1 32 TYR HD2 H 3.485 5.860 2.854 1.00 . A A . 32 TYR HD2 1 1 5 2500 1 1 32 TYR HE1 H -0.152 6.865 -0.289 1.00 . A A . 32 TYR HE1 1 1 5 2501 1 1 32 TYR HE2 H 1.145 5.691 3.593 1.00 . A A . 32 TYR HE2 1 1 5 2502 1 1 32 TYR HH H -1.016 6.475 3.008 1.00 . A A . 32 TYR HH 1 1 5 2503 1 1 32 TYR N N 6.515 5.240 0.022 1.00 . A A . 32 TYR N 1 1 5 2504 1 1 32 TYR O O 4.312 4.848 -2.021 1.00 . A A . 32 TYR O 1 1 5 2505 1 1 32 TYR OH O -0.956 6.145 2.103 1.00 . A A . 32 TYR OH 1 1 5 2506 1 1 33 SER C C 1.629 2.466 -0.901 1.00 . A A . 33 SER C 1 1 5 2507 1 1 33 SER CA C 3.029 2.499 -1.477 1.00 . A A . 33 SER CA 1 1 5 2508 1 1 33 SER CB C 3.587 1.086 -1.625 1.00 . A A . 33 SER CB 1 1 5 2509 1 1 33 SER H H 3.955 2.898 0.349 1.00 . A A . 33 SER H 1 1 5 2510 1 1 33 SER HA H 3.021 3.007 -2.429 1.00 . A A . 33 SER HA 1 1 5 2511 1 1 33 SER HB2 H 3.475 0.554 -0.693 1.00 . A A . 33 SER HB2 1 1 5 2512 1 1 33 SER HB3 H 3.051 0.565 -2.405 1.00 . A A . 33 SER HB3 1 1 5 2513 1 1 33 SER HG H 5.349 0.267 -1.730 1.00 . A A . 33 SER HG 1 1 5 2514 1 1 33 SER N N 3.832 3.255 -0.552 1.00 . A A . 33 SER N 1 1 5 2515 1 1 33 SER O O 1.483 2.294 0.304 1.00 . A A . 33 SER O 1 1 5 2516 1 1 33 SER OG O 4.965 1.120 -1.964 1.00 . A A . 33 SER OG 1 1 5 2517 1 1 34 GLN C C -1.662 1.827 -1.994 1.00 . A A . 34 GLN C 1 1 5 2518 1 1 34 GLN CA C -0.729 2.747 -1.230 1.00 . A A . 34 GLN CA 1 1 5 2519 1 1 34 GLN CB C -1.191 4.204 -1.368 1.00 . A A . 34 GLN CB 1 1 5 2520 1 1 34 GLN CD C -2.975 5.937 -0.936 1.00 . A A . 34 GLN CD 1 1 5 2521 1 1 34 GLN CG C -2.566 4.490 -0.791 1.00 . A A . 34 GLN CG 1 1 5 2522 1 1 34 GLN H H 0.777 2.634 -2.694 1.00 . A A . 34 GLN H 1 1 5 2523 1 1 34 GLN HA H -0.740 2.484 -0.183 1.00 . A A . 34 GLN HA 1 1 5 2524 1 1 34 GLN HB2 H -0.477 4.838 -0.865 1.00 . A A . 34 GLN HB2 1 1 5 2525 1 1 34 GLN HB3 H -1.203 4.460 -2.417 1.00 . A A . 34 GLN HB3 1 1 5 2526 1 1 34 GLN HE21 H -2.185 6.379 0.821 1.00 . A A . 34 GLN HE21 1 1 5 2527 1 1 34 GLN HE22 H -2.918 7.682 -0.037 1.00 . A A . 34 GLN HE22 1 1 5 2528 1 1 34 GLN HG2 H -3.289 3.874 -1.305 1.00 . A A . 34 GLN HG2 1 1 5 2529 1 1 34 GLN HG3 H -2.561 4.234 0.258 1.00 . A A . 34 GLN HG3 1 1 5 2530 1 1 34 GLN N N 0.626 2.629 -1.720 1.00 . A A . 34 GLN N 1 1 5 2531 1 1 34 GLN NE2 N -2.668 6.738 0.039 1.00 . A A . 34 GLN NE2 1 1 5 2532 1 1 34 GLN O O -1.474 1.606 -3.195 1.00 . A A . 34 GLN O 1 1 5 2533 1 1 34 GLN OE1 O -3.577 6.325 -1.918 1.00 . A A . 34 GLN OE1 1 1 5 2534 1 1 35 CYS C C -4.655 1.348 -2.617 1.00 . A A . 35 CYS C 1 1 5 2535 1 1 35 CYS CA C -3.629 0.452 -1.933 1.00 . A A . 35 CYS CA 1 1 5 2536 1 1 35 CYS CB C -4.323 -0.458 -0.929 1.00 . A A . 35 CYS CB 1 1 5 2537 1 1 35 CYS H H -2.656 1.346 -0.323 1.00 . A A . 35 CYS H 1 1 5 2538 1 1 35 CYS HA H -3.144 -0.154 -2.683 1.00 . A A . 35 CYS HA 1 1 5 2539 1 1 35 CYS HB2 H -4.933 0.111 -0.247 1.00 . A A . 35 CYS HB2 1 1 5 2540 1 1 35 CYS HB3 H -4.968 -1.116 -1.484 1.00 . A A . 35 CYS HB3 1 1 5 2541 1 1 35 CYS N N -2.629 1.258 -1.298 1.00 . A A . 35 CYS N 1 1 5 2542 1 1 35 CYS O O -5.468 2.025 -1.948 1.00 . A A . 35 CYS O 1 1 5 2543 1 1 35 CYS SG S -3.206 -1.496 0.052 1.00 . A A . 35 CYS SG 1 1 5 2544 1 1 36 LEU C C -6.356 1.144 -5.458 1.00 . A A . 36 LEU C 1 1 5 2545 1 1 36 LEU CA C -5.468 2.127 -4.756 1.00 . A A . 36 LEU CA 1 1 5 2546 1 1 36 LEU CB C -4.697 2.987 -5.772 1.00 . A A . 36 LEU CB 1 1 5 2547 1 1 36 LEU CD1 C -3.110 4.861 -6.281 1.00 . A A . 36 LEU CD1 1 1 5 2548 1 1 36 LEU CD2 C -4.890 5.173 -4.576 1.00 . A A . 36 LEU CD2 1 1 5 2549 1 1 36 LEU CG C -3.925 4.177 -5.197 1.00 . A A . 36 LEU CG 1 1 5 2550 1 1 36 LEU H H -3.859 0.869 -4.354 1.00 . A A . 36 LEU H 1 1 5 2551 1 1 36 LEU HA H -6.073 2.764 -4.130 1.00 . A A . 36 LEU HA 1 1 5 2552 1 1 36 LEU HB2 H -3.997 2.346 -6.288 1.00 . A A . 36 LEU HB2 1 1 5 2553 1 1 36 LEU HB3 H -5.408 3.363 -6.494 1.00 . A A . 36 LEU HB3 1 1 5 2554 1 1 36 LEU HD11 H -3.775 5.233 -7.046 1.00 . A A . 36 LEU HD11 1 1 5 2555 1 1 36 LEU HD12 H -2.419 4.154 -6.716 1.00 . A A . 36 LEU HD12 1 1 5 2556 1 1 36 LEU HD13 H -2.560 5.686 -5.852 1.00 . A A . 36 LEU HD13 1 1 5 2557 1 1 36 LEU HD21 H -5.434 4.705 -3.770 1.00 . A A . 36 LEU HD21 1 1 5 2558 1 1 36 LEU HD22 H -5.588 5.519 -5.325 1.00 . A A . 36 LEU HD22 1 1 5 2559 1 1 36 LEU HD23 H -4.333 6.014 -4.191 1.00 . A A . 36 LEU HD23 1 1 5 2560 1 1 36 LEU HG H -3.253 3.833 -4.427 1.00 . A A . 36 LEU HG 1 1 5 2561 1 1 36 LEU N N -4.570 1.391 -3.914 1.00 . A A . 36 LEU N 1 1 5 2562 1 1 36 LEU O O -7.562 1.141 -5.198 1.00 . A A . 36 LEU O 1 1 5 2563 1 1 36 LEU OXT O -5.818 0.284 -6.199 1.00 . A A . 36 LEU OXT 1 1 5 2564 2 2 1 MAN C1 C 9.883 -3.561 9.255 1.00 . B A . 101 MAN C1 1 1 5 2565 2 2 1 MAN C2 C 11.006 -2.610 8.782 1.00 . B A . 101 MAN C2 1 1 5 2566 2 2 1 MAN C3 C 11.616 -3.140 7.485 1.00 . B A . 101 MAN C3 1 1 5 2567 2 2 1 MAN C4 C 12.122 -4.554 7.703 1.00 . B A . 101 MAN C4 1 1 5 2568 2 2 1 MAN C5 C 10.985 -5.445 8.214 1.00 . B A . 101 MAN C5 1 1 5 2569 2 2 1 MAN C6 C 11.446 -6.823 8.592 1.00 . B A . 101 MAN C6 1 1 5 2570 2 2 1 MAN H1 H 9.515 -3.165 10.213 1.00 . B A . 101 MAN H1 1 1 5 2571 2 2 1 MAN H2 H 10.590 -1.612 8.577 1.00 . B A . 101 MAN H2 1 1 5 2572 2 2 1 MAN H3 H 10.845 -3.148 6.700 1.00 . B A . 101 MAN H3 1 1 5 2573 2 2 1 MAN H4 H 12.926 -4.552 8.455 1.00 . B A . 101 MAN H4 1 1 5 2574 2 2 1 MAN H5 H 10.161 -5.510 7.488 1.00 . B A . 101 MAN H5 1 1 5 2575 2 2 1 MAN H61 H 12.354 -6.708 9.198 1.00 . B A . 101 MAN H61 1 1 5 2576 2 2 1 MAN H62 H 11.716 -7.366 7.673 1.00 . B A . 101 MAN H62 1 1 5 2577 2 2 1 MAN HO2 H 12.301 -3.435 9.972 1.00 . B A . 101 MAN HO2 1 1 5 2578 2 2 1 MAN HO3 H 13.326 -2.362 7.880 1.00 . B A . 101 MAN HO3 1 1 5 2579 2 2 1 MAN HO4 H 13.378 -4.479 6.245 1.00 . B A . 101 MAN HO4 1 1 5 2580 2 2 1 MAN HO6 H 9.742 -6.851 9.516 1.00 . B A . 101 MAN HO6 1 1 5 2581 2 2 1 MAN O2 O 12.032 -2.533 9.755 1.00 . B A . 101 MAN O2 1 1 5 2582 2 2 1 MAN O3 O 12.728 -2.330 7.120 1.00 . B A . 101 MAN O3 1 1 5 2583 2 2 1 MAN O4 O 12.634 -5.045 6.484 1.00 . B A . 101 MAN O4 1 1 5 2584 2 2 1 MAN O5 O 10.421 -4.872 9.427 1.00 . B A . 101 MAN O5 1 1 5 2585 2 2 1 MAN O6 O 10.427 -7.504 9.326 1.00 . B A . 101 MAN O6 1 1 6 2586 1 1 1 THR C C -5.813 -6.036 4.224 1.00 . A A . 1 THR C 1 1 6 2587 1 1 1 THR CA C -5.998 -7.486 3.808 1.00 . A A . 1 THR CA 1 1 6 2588 1 1 1 THR CB C -6.914 -7.580 2.577 1.00 . A A . 1 THR CB 1 1 6 2589 1 1 1 THR CG2 C -6.860 -8.973 1.961 1.00 . A A . 1 THR CG2 1 1 6 2590 1 1 1 THR H1 H -7.505 -7.844 5.139 1.00 . A A . 1 THR H1 1 1 6 2591 1 1 1 THR H2 H -5.957 -8.163 5.734 1.00 . A A . 1 THR H2 1 1 6 2592 1 1 1 THR H3 H -6.678 -9.237 4.644 1.00 . A A . 1 THR H3 1 1 6 2593 1 1 1 THR HA H -5.035 -7.907 3.563 1.00 . A A . 1 THR HA 1 1 6 2594 1 1 1 THR HB H -6.581 -6.856 1.849 1.00 . A A . 1 THR HB 1 1 6 2595 1 1 1 THR HG1 H -8.870 -7.631 2.291 1.00 . A A . 1 THR HG1 1 1 6 2596 1 1 1 THR HG21 H -7.500 -9.010 1.092 1.00 . A A . 1 THR HG21 1 1 6 2597 1 1 1 THR HG22 H -7.195 -9.703 2.684 1.00 . A A . 1 THR HG22 1 1 6 2598 1 1 1 THR HG23 H -5.845 -9.195 1.669 1.00 . A A . 1 THR HG23 1 1 6 2599 1 1 1 THR N N -6.574 -8.237 4.902 1.00 . A A . 1 THR N 1 1 6 2600 1 1 1 THR O O -6.544 -5.542 5.087 1.00 . A A . 1 THR O 1 1 6 2601 1 1 1 THR OG1 O -8.273 -7.272 2.964 1.00 . A A . 1 THR OG1 1 1 6 2602 1 1 2 GLN C C -5.598 -3.093 3.292 1.00 . A A . 2 GLN C 1 1 6 2603 1 1 2 GLN CA C -4.526 -3.995 3.947 1.00 . A A . 2 GLN CA 1 1 6 2604 1 1 2 GLN CB C -3.120 -3.682 3.421 1.00 . A A . 2 GLN CB 1 1 6 2605 1 1 2 GLN CD C -2.930 -1.364 4.402 1.00 . A A . 2 GLN CD 1 1 6 2606 1 1 2 GLN CG C -2.302 -2.707 4.269 1.00 . A A . 2 GLN CG 1 1 6 2607 1 1 2 GLN H H -4.299 -5.833 2.952 1.00 . A A . 2 GLN H 1 1 6 2608 1 1 2 GLN HA H -4.557 -3.867 5.018 1.00 . A A . 2 GLN HA 1 1 6 2609 1 1 2 GLN HB2 H -2.563 -4.605 3.352 1.00 . A A . 2 GLN HB2 1 1 6 2610 1 1 2 GLN HB3 H -3.216 -3.264 2.430 1.00 . A A . 2 GLN HB3 1 1 6 2611 1 1 2 GLN HE21 H -2.096 -0.839 2.733 1.00 . A A . 2 GLN HE21 1 1 6 2612 1 1 2 GLN HE22 H -3.066 0.360 3.498 1.00 . A A . 2 GLN HE22 1 1 6 2613 1 1 2 GLN HG2 H -2.178 -3.119 5.260 1.00 . A A . 2 GLN HG2 1 1 6 2614 1 1 2 GLN HG3 H -1.328 -2.587 3.817 1.00 . A A . 2 GLN HG3 1 1 6 2615 1 1 2 GLN N N -4.840 -5.376 3.636 1.00 . A A . 2 GLN N 1 1 6 2616 1 1 2 GLN NE2 N -2.676 -0.534 3.462 1.00 . A A . 2 GLN NE2 1 1 6 2617 1 1 2 GLN O O -6.081 -3.388 2.196 1.00 . A A . 2 GLN O 1 1 6 2618 1 1 2 GLN OE1 O -3.682 -1.094 5.337 1.00 . A A . 2 GLN OE1 1 1 6 2619 1 1 3 SER C C -6.690 -0.157 2.453 1.00 . A A . 3 SER C 1 1 6 2620 1 1 3 SER CA C -7.045 -1.191 3.543 1.00 . A A . 3 SER CA 1 1 6 2621 1 1 3 SER CB C -7.641 -0.525 4.771 1.00 . A A . 3 SER CB 1 1 6 2622 1 1 3 SER H H -5.436 -1.762 4.745 1.00 . A A . 3 SER H 1 1 6 2623 1 1 3 SER HA H -7.802 -1.845 3.135 1.00 . A A . 3 SER HA 1 1 6 2624 1 1 3 SER HB2 H -6.896 0.103 5.237 1.00 . A A . 3 SER HB2 1 1 6 2625 1 1 3 SER HB3 H -8.497 0.068 4.486 1.00 . A A . 3 SER HB3 1 1 6 2626 1 1 3 SER HG H -7.987 -1.146 6.588 1.00 . A A . 3 SER HG 1 1 6 2627 1 1 3 SER N N -5.948 -2.028 3.951 1.00 . A A . 3 SER N 1 1 6 2628 1 1 3 SER O O -5.517 0.194 2.227 1.00 . A A . 3 SER O 1 1 6 2629 1 1 3 SER OG O -8.063 -1.523 5.703 1.00 . A A . 3 SER OG 1 1 6 2630 1 1 4 HIS C C -7.164 2.608 1.258 1.00 . A A . 4 HIS C 1 1 6 2631 1 1 4 HIS CA C -7.675 1.281 0.712 1.00 . A A . 4 HIS CA 1 1 6 2632 1 1 4 HIS CB C -9.096 1.436 0.138 1.00 . A A . 4 HIS CB 1 1 6 2633 1 1 4 HIS CD2 C -8.419 2.303 -2.211 1.00 . A A . 4 HIS CD2 1 1 6 2634 1 1 4 HIS CE1 C -10.228 3.417 -2.673 1.00 . A A . 4 HIS CE1 1 1 6 2635 1 1 4 HIS CG C -9.226 2.220 -1.137 1.00 . A A . 4 HIS CG 1 1 6 2636 1 1 4 HIS H H -8.625 -0.004 2.065 1.00 . A A . 4 HIS H 1 1 6 2637 1 1 4 HIS HA H -7.017 0.916 -0.062 1.00 . A A . 4 HIS HA 1 1 6 2638 1 1 4 HIS HB2 H -9.498 0.454 -0.054 1.00 . A A . 4 HIS HB2 1 1 6 2639 1 1 4 HIS HB3 H -9.711 1.915 0.886 1.00 . A A . 4 HIS HB3 1 1 6 2640 1 1 4 HIS HD1 H -11.131 3.091 -0.878 1.00 . A A . 4 HIS HD1 1 1 6 2641 1 1 4 HIS HD2 H -7.434 1.864 -2.296 1.00 . A A . 4 HIS HD2 1 1 6 2642 1 1 4 HIS HE1 H -10.959 4.009 -3.202 1.00 . A A . 4 HIS HE1 1 1 6 2643 1 1 4 HIS HE2 H -8.939 2.870 -4.115 1.00 . A A . 4 HIS HE2 1 1 6 2644 1 1 4 HIS N N -7.737 0.315 1.793 1.00 . A A . 4 HIS N 1 1 6 2645 1 1 4 HIS ND1 N -10.349 2.938 -1.458 1.00 . A A . 4 HIS ND1 1 1 6 2646 1 1 4 HIS NE2 N -9.062 3.046 -3.153 1.00 . A A . 4 HIS NE2 1 1 6 2647 1 1 4 HIS O O -7.607 3.045 2.301 1.00 . A A . 4 HIS O 1 1 6 2648 1 1 5 TYR C C -4.516 4.276 2.028 1.00 . A A . 5 TYR C 1 1 6 2649 1 1 5 TYR CA C -5.546 4.469 0.931 1.00 . A A . 5 TYR CA 1 1 6 2650 1 1 5 TYR CB C -6.518 5.607 1.297 1.00 . A A . 5 TYR CB 1 1 6 2651 1 1 5 TYR CD1 C -6.784 6.755 -0.917 1.00 . A A . 5 TYR CD1 1 1 6 2652 1 1 5 TYR CD2 C -8.731 5.922 0.161 1.00 . A A . 5 TYR CD2 1 1 6 2653 1 1 5 TYR CE1 C -7.550 7.222 -1.957 1.00 . A A . 5 TYR CE1 1 1 6 2654 1 1 5 TYR CE2 C -9.503 6.383 -0.874 1.00 . A A . 5 TYR CE2 1 1 6 2655 1 1 5 TYR CG C -7.360 6.097 0.156 1.00 . A A . 5 TYR CG 1 1 6 2656 1 1 5 TYR CZ C -8.910 7.033 -1.930 1.00 . A A . 5 TYR CZ 1 1 6 2657 1 1 5 TYR H H -5.897 2.765 -0.275 1.00 . A A . 5 TYR H 1 1 6 2658 1 1 5 TYR HA H -4.991 4.764 0.050 1.00 . A A . 5 TYR HA 1 1 6 2659 1 1 5 TYR HB2 H -7.191 5.245 2.059 1.00 . A A . 5 TYR HB2 1 1 6 2660 1 1 5 TYR HB3 H -5.953 6.442 1.685 1.00 . A A . 5 TYR HB3 1 1 6 2661 1 1 5 TYR HD1 H -5.714 6.897 -0.930 1.00 . A A . 5 TYR HD1 1 1 6 2662 1 1 5 TYR HD2 H -9.193 5.411 0.993 1.00 . A A . 5 TYR HD2 1 1 6 2663 1 1 5 TYR HE1 H -7.082 7.733 -2.785 1.00 . A A . 5 TYR HE1 1 1 6 2664 1 1 5 TYR HE2 H -10.572 6.234 -0.856 1.00 . A A . 5 TYR HE2 1 1 6 2665 1 1 5 TYR HH H -10.439 7.941 -2.546 1.00 . A A . 5 TYR HH 1 1 6 2666 1 1 5 TYR N N -6.208 3.201 0.551 1.00 . A A . 5 TYR N 1 1 6 2667 1 1 5 TYR O O -3.940 5.240 2.524 1.00 . A A . 5 TYR O 1 1 6 2668 1 1 5 TYR OH O -9.686 7.501 -2.964 1.00 . A A . 5 TYR OH 1 1 6 2669 1 1 6 GLY C C -1.974 2.350 2.667 1.00 . A A . 6 GLY C 1 1 6 2670 1 1 6 GLY CA C -3.241 2.790 3.337 1.00 . A A . 6 GLY CA 1 1 6 2671 1 1 6 GLY H H -4.748 2.305 1.970 1.00 . A A . 6 GLY H 1 1 6 2672 1 1 6 GLY HA2 H -3.050 3.697 3.889 1.00 . A A . 6 GLY HA2 1 1 6 2673 1 1 6 GLY HA3 H -3.573 2.016 4.013 1.00 . A A . 6 GLY HA3 1 1 6 2674 1 1 6 GLY N N -4.251 3.050 2.370 1.00 . A A . 6 GLY N 1 1 6 2675 1 1 6 GLY O O -2.006 1.912 1.501 1.00 . A A . 6 GLY O 1 1 6 2676 1 1 7 GLN C C 0.483 0.496 2.848 1.00 . A A . 7 GLN C 1 1 6 2677 1 1 7 GLN CA C 0.398 2.019 2.855 1.00 . A A . 7 GLN CA 1 1 6 2678 1 1 7 GLN CB C 1.548 2.640 3.651 1.00 . A A . 7 GLN CB 1 1 6 2679 1 1 7 GLN CD C 4.052 2.916 3.912 1.00 . A A . 7 GLN CD 1 1 6 2680 1 1 7 GLN CG C 2.928 2.202 3.181 1.00 . A A . 7 GLN CG 1 1 6 2681 1 1 7 GLN H H -0.936 2.806 4.281 1.00 . A A . 7 GLN H 1 1 6 2682 1 1 7 GLN HA H 0.457 2.359 1.830 1.00 . A A . 7 GLN HA 1 1 6 2683 1 1 7 GLN HB2 H 1.488 3.714 3.570 1.00 . A A . 7 GLN HB2 1 1 6 2684 1 1 7 GLN HB3 H 1.443 2.359 4.688 1.00 . A A . 7 GLN HB3 1 1 6 2685 1 1 7 GLN HE21 H 5.300 2.776 2.340 1.00 . A A . 7 GLN HE21 1 1 6 2686 1 1 7 GLN HE22 H 5.889 3.569 3.732 1.00 . A A . 7 GLN HE22 1 1 6 2687 1 1 7 GLN HG2 H 2.987 1.139 3.370 1.00 . A A . 7 GLN HG2 1 1 6 2688 1 1 7 GLN HG3 H 3.015 2.375 2.118 1.00 . A A . 7 GLN HG3 1 1 6 2689 1 1 7 GLN N N -0.877 2.443 3.370 1.00 . A A . 7 GLN N 1 1 6 2690 1 1 7 GLN NE2 N 5.173 3.090 3.260 1.00 . A A . 7 GLN NE2 1 1 6 2691 1 1 7 GLN O O 0.353 -0.147 3.886 1.00 . A A . 7 GLN O 1 1 6 2692 1 1 7 GLN OE1 O 3.913 3.306 5.067 1.00 . A A . 7 GLN OE1 1 1 6 2693 1 1 8 CYS C C 2.087 -2.075 1.782 1.00 . A A . 8 CYS C 1 1 6 2694 1 1 8 CYS CA C 0.722 -1.497 1.479 1.00 . A A . 8 CYS CA 1 1 6 2695 1 1 8 CYS CB C 0.309 -1.842 0.052 1.00 . A A . 8 CYS CB 1 1 6 2696 1 1 8 CYS H H 0.779 0.539 0.901 1.00 . A A . 8 CYS H 1 1 6 2697 1 1 8 CYS HA H 0.006 -1.948 2.149 1.00 . A A . 8 CYS HA 1 1 6 2698 1 1 8 CYS HB2 H 0.533 -2.881 -0.137 1.00 . A A . 8 CYS HB2 1 1 6 2699 1 1 8 CYS HB3 H -0.754 -1.683 -0.056 1.00 . A A . 8 CYS HB3 1 1 6 2700 1 1 8 CYS N N 0.672 -0.056 1.676 1.00 . A A . 8 CYS N 1 1 6 2701 1 1 8 CYS O O 2.210 -3.005 2.552 1.00 . A A . 8 CYS O 1 1 6 2702 1 1 8 CYS SG S 1.155 -0.852 -1.234 1.00 . A A . 8 CYS SG 1 1 6 2703 1 1 9 GLY C C 5.442 -1.305 0.610 1.00 . A A . 9 GLY C 1 1 6 2704 1 1 9 GLY CA C 4.413 -2.057 1.376 1.00 . A A . 9 GLY CA 1 1 6 2705 1 1 9 GLY H H 2.967 -0.772 0.569 1.00 . A A . 9 GLY H 1 1 6 2706 1 1 9 GLY HA2 H 4.654 -2.011 2.426 1.00 . A A . 9 GLY HA2 1 1 6 2707 1 1 9 GLY HA3 H 4.424 -3.087 1.054 1.00 . A A . 9 GLY HA3 1 1 6 2708 1 1 9 GLY N N 3.107 -1.527 1.177 1.00 . A A . 9 GLY N 1 1 6 2709 1 1 9 GLY O O 5.762 -1.654 -0.523 1.00 . A A . 9 GLY O 1 1 6 2710 1 1 10 GLY C C 8.207 0.304 1.450 1.00 . A A . 10 GLY C 1 1 6 2711 1 1 10 GLY CA C 6.978 0.506 0.621 1.00 . A A . 10 GLY CA 1 1 6 2712 1 1 10 GLY H H 5.577 -0.009 2.084 1.00 . A A . 10 GLY H 1 1 6 2713 1 1 10 GLY HA2 H 7.150 0.169 -0.391 1.00 . A A . 10 GLY HA2 1 1 6 2714 1 1 10 GLY HA3 H 6.720 1.555 0.622 1.00 . A A . 10 GLY HA3 1 1 6 2715 1 1 10 GLY N N 5.915 -0.256 1.200 1.00 . A A . 10 GLY N 1 1 6 2716 1 1 10 GLY O O 8.139 -0.418 2.463 1.00 . A A . 10 GLY O 1 1 6 2717 1 1 11 ILE C C 10.367 1.337 3.233 1.00 . A A . 11 ILE C 1 1 6 2718 1 1 11 ILE CA C 10.552 0.778 1.813 1.00 . A A . 11 ILE CA 1 1 6 2719 1 1 11 ILE CB C 11.725 1.527 1.118 1.00 . A A . 11 ILE CB 1 1 6 2720 1 1 11 ILE CD1 C 12.913 1.857 -1.126 1.00 . A A . 11 ILE CD1 1 1 6 2721 1 1 11 ILE CG1 C 11.858 1.092 -0.346 1.00 . A A . 11 ILE CG1 1 1 6 2722 1 1 11 ILE CG2 C 13.034 1.265 1.864 1.00 . A A . 11 ILE CG2 1 1 6 2723 1 1 11 ILE H H 9.291 1.476 0.264 1.00 . A A . 11 ILE H 1 1 6 2724 1 1 11 ILE HA H 10.789 -0.274 1.877 1.00 . A A . 11 ILE HA 1 1 6 2725 1 1 11 ILE HB H 11.518 2.586 1.153 1.00 . A A . 11 ILE HB 1 1 6 2726 1 1 11 ILE HD11 H 12.952 1.488 -2.141 1.00 . A A . 11 ILE HD11 1 1 6 2727 1 1 11 ILE HD12 H 13.876 1.723 -0.655 1.00 . A A . 11 ILE HD12 1 1 6 2728 1 1 11 ILE HD13 H 12.660 2.906 -1.134 1.00 . A A . 11 ILE HD13 1 1 6 2729 1 1 11 ILE HG12 H 12.122 0.046 -0.379 1.00 . A A . 11 ILE HG12 1 1 6 2730 1 1 11 ILE HG13 H 10.908 1.235 -0.839 1.00 . A A . 11 ILE HG13 1 1 6 2731 1 1 11 ILE HG21 H 13.836 1.794 1.373 1.00 . A A . 11 ILE HG21 1 1 6 2732 1 1 11 ILE HG22 H 13.244 0.206 1.862 1.00 . A A . 11 ILE HG22 1 1 6 2733 1 1 11 ILE HG23 H 12.943 1.613 2.882 1.00 . A A . 11 ILE HG23 1 1 6 2734 1 1 11 ILE N N 9.309 0.918 1.070 1.00 . A A . 11 ILE N 1 1 6 2735 1 1 11 ILE O O 10.172 2.545 3.424 1.00 . A A . 11 ILE O 1 1 6 2736 1 1 12 GLY C C 8.941 0.334 6.148 1.00 . A A . 12 GLY C 1 1 6 2737 1 1 12 GLY CA C 10.233 0.860 5.564 1.00 . A A . 12 GLY CA 1 1 6 2738 1 1 12 GLY H H 10.566 -0.485 3.990 1.00 . A A . 12 GLY H 1 1 6 2739 1 1 12 GLY HA2 H 11.060 0.497 6.157 1.00 . A A . 12 GLY HA2 1 1 6 2740 1 1 12 GLY HA3 H 10.215 1.938 5.608 1.00 . A A . 12 GLY HA3 1 1 6 2741 1 1 12 GLY N N 10.417 0.462 4.202 1.00 . A A . 12 GLY N 1 1 6 2742 1 1 12 GLY O O 8.780 0.297 7.366 1.00 . A A . 12 GLY O 1 1 6 2743 1 1 13 TYR C C 6.864 -2.128 5.901 1.00 . A A . 13 TYR C 1 1 6 2744 1 1 13 TYR CA C 6.768 -0.622 5.788 1.00 . A A . 13 TYR CA 1 1 6 2745 1 1 13 TYR CB C 5.566 -0.229 4.898 1.00 . A A . 13 TYR CB 1 1 6 2746 1 1 13 TYR CD1 C 3.687 -1.935 5.145 1.00 . A A . 13 TYR CD1 1 1 6 2747 1 1 13 TYR CD2 C 3.524 0.097 6.370 1.00 . A A . 13 TYR CD2 1 1 6 2748 1 1 13 TYR CE1 C 2.506 -2.373 5.701 1.00 . A A . 13 TYR CE1 1 1 6 2749 1 1 13 TYR CE2 C 2.333 -0.332 6.923 1.00 . A A . 13 TYR CE2 1 1 6 2750 1 1 13 TYR CG C 4.224 -0.693 5.470 1.00 . A A . 13 TYR CG 1 1 6 2751 1 1 13 TYR CZ C 1.834 -1.570 6.586 1.00 . A A . 13 TYR CZ 1 1 6 2752 1 1 13 TYR H H 8.202 -0.072 4.332 1.00 . A A . 13 TYR H 1 1 6 2753 1 1 13 TYR HA H 6.623 -0.215 6.777 1.00 . A A . 13 TYR HA 1 1 6 2754 1 1 13 TYR HB2 H 5.535 0.846 4.793 1.00 . A A . 13 TYR HB2 1 1 6 2755 1 1 13 TYR HB3 H 5.687 -0.680 3.923 1.00 . A A . 13 TYR HB3 1 1 6 2756 1 1 13 TYR HD1 H 4.214 -2.569 4.447 1.00 . A A . 13 TYR HD1 1 1 6 2757 1 1 13 TYR HD2 H 3.921 1.068 6.627 1.00 . A A . 13 TYR HD2 1 1 6 2758 1 1 13 TYR HE1 H 2.109 -3.342 5.434 1.00 . A A . 13 TYR HE1 1 1 6 2759 1 1 13 TYR HE2 H 1.804 0.302 7.620 1.00 . A A . 13 TYR HE2 1 1 6 2760 1 1 13 TYR HH H -0.013 -1.338 7.091 1.00 . A A . 13 TYR HH 1 1 6 2761 1 1 13 TYR N N 8.021 -0.090 5.299 1.00 . A A . 13 TYR N 1 1 6 2762 1 1 13 TYR O O 7.445 -2.796 5.021 1.00 . A A . 13 TYR O 1 1 6 2763 1 1 13 TYR OH O 0.665 -2.020 7.162 1.00 . A A . 13 TYR OH 1 1 6 2764 1 1 14 SER C C 4.917 -4.433 7.713 1.00 . A A . 14 SER C 1 1 6 2765 1 1 14 SER CA C 6.306 -4.070 7.218 1.00 . A A . 14 SER CA 1 1 6 2766 1 1 14 SER CB C 7.334 -4.381 8.298 1.00 . A A . 14 SER CB 1 1 6 2767 1 1 14 SER H H 5.905 -2.078 7.647 1.00 . A A . 14 SER H 1 1 6 2768 1 1 14 SER HA H 6.552 -4.603 6.311 1.00 . A A . 14 SER HA 1 1 6 2769 1 1 14 SER HB2 H 6.902 -4.185 9.268 1.00 . A A . 14 SER HB2 1 1 6 2770 1 1 14 SER HB3 H 7.627 -5.417 8.225 1.00 . A A . 14 SER HB3 1 1 6 2771 1 1 14 SER N N 6.320 -2.654 6.966 1.00 . A A . 14 SER N 1 1 6 2772 1 1 14 SER O O 4.332 -3.692 8.522 1.00 . A A . 14 SER O 1 1 6 2773 1 1 14 SER OG O 8.496 -3.551 8.104 1.00 . A A . 14 SER OG 1 1 6 2774 1 1 15 GLY C C 2.253 -6.487 6.539 1.00 . A A . 15 GLY C 1 1 6 2775 1 1 15 GLY CA C 3.061 -5.903 7.660 1.00 . A A . 15 GLY CA 1 1 6 2776 1 1 15 GLY H H 4.822 -6.040 6.534 1.00 . A A . 15 GLY H 1 1 6 2777 1 1 15 GLY HA2 H 3.165 -6.637 8.446 1.00 . A A . 15 GLY HA2 1 1 6 2778 1 1 15 GLY HA3 H 2.550 -5.035 8.045 1.00 . A A . 15 GLY HA3 1 1 6 2779 1 1 15 GLY N N 4.365 -5.504 7.220 1.00 . A A . 15 GLY N 1 1 6 2780 1 1 15 GLY O O 2.810 -7.194 5.701 1.00 . A A . 15 GLY O 1 1 6 2781 1 1 16 PRO C C 0.337 -6.073 4.096 1.00 . A A . 16 PRO C 1 1 6 2782 1 1 16 PRO CA C 0.075 -6.741 5.443 1.00 . A A . 16 PRO CA 1 1 6 2783 1 1 16 PRO CB C -1.356 -6.424 5.938 1.00 . A A . 16 PRO CB 1 1 6 2784 1 1 16 PRO CD C 0.197 -5.361 7.412 1.00 . A A . 16 PRO CD 1 1 6 2785 1 1 16 PRO CG C -1.193 -5.916 7.333 1.00 . A A . 16 PRO CG 1 1 6 2786 1 1 16 PRO HA H 0.199 -7.809 5.344 1.00 . A A . 16 PRO HA 1 1 6 2787 1 1 16 PRO HB2 H -1.800 -5.677 5.297 1.00 . A A . 16 PRO HB2 1 1 6 2788 1 1 16 PRO HB3 H -1.959 -7.320 5.913 1.00 . A A . 16 PRO HB3 1 1 6 2789 1 1 16 PRO HD2 H 0.218 -4.329 7.094 1.00 . A A . 16 PRO HD2 1 1 6 2790 1 1 16 PRO HD3 H 0.579 -5.461 8.416 1.00 . A A . 16 PRO HD3 1 1 6 2791 1 1 16 PRO HG2 H -1.918 -5.141 7.530 1.00 . A A . 16 PRO HG2 1 1 6 2792 1 1 16 PRO HG3 H -1.314 -6.727 8.036 1.00 . A A . 16 PRO HG3 1 1 6 2793 1 1 16 PRO N N 0.943 -6.215 6.483 1.00 . A A . 16 PRO N 1 1 6 2794 1 1 16 PRO O O -0.070 -4.945 3.858 1.00 . A A . 16 PRO O 1 1 6 2795 1 1 17 THR C C 0.348 -6.606 0.879 1.00 . A A . 17 THR C 1 1 6 2796 1 1 17 THR CA C 1.389 -6.238 1.952 1.00 . A A . 17 THR CA 1 1 6 2797 1 1 17 THR CB C 2.799 -6.708 1.561 1.00 . A A . 17 THR CB 1 1 6 2798 1 1 17 THR CG2 C 3.852 -5.910 2.314 1.00 . A A . 17 THR CG2 1 1 6 2799 1 1 17 THR H H 1.398 -7.641 3.487 1.00 . A A . 17 THR H 1 1 6 2800 1 1 17 THR HA H 1.411 -5.161 2.039 1.00 . A A . 17 THR HA 1 1 6 2801 1 1 17 THR HB H 2.931 -6.565 0.499 1.00 . A A . 17 THR HB 1 1 6 2802 1 1 17 THR HG1 H 2.829 -8.608 1.049 1.00 . A A . 17 THR HG1 1 1 6 2803 1 1 17 THR HG21 H 4.835 -6.235 2.008 1.00 . A A . 17 THR HG21 1 1 6 2804 1 1 17 THR HG22 H 3.736 -6.072 3.375 1.00 . A A . 17 THR HG22 1 1 6 2805 1 1 17 THR HG23 H 3.735 -4.859 2.097 1.00 . A A . 17 THR HG23 1 1 6 2806 1 1 17 THR N N 1.047 -6.759 3.244 1.00 . A A . 17 THR N 1 1 6 2807 1 1 17 THR O O 0.478 -6.231 -0.305 1.00 . A A . 17 THR O 1 1 6 2808 1 1 17 THR OG1 O 2.944 -8.119 1.873 1.00 . A A . 17 THR OG1 1 1 6 2809 1 1 18 VAL C C -2.938 -6.812 0.684 1.00 . A A . 18 VAL C 1 1 6 2810 1 1 18 VAL CA C -1.747 -7.706 0.393 1.00 . A A . 18 VAL CA 1 1 6 2811 1 1 18 VAL CB C -2.161 -9.197 0.548 1.00 . A A . 18 VAL CB 1 1 6 2812 1 1 18 VAL CG1 C -3.245 -9.574 -0.456 1.00 . A A . 18 VAL CG1 1 1 6 2813 1 1 18 VAL CG2 C -0.955 -10.109 0.392 1.00 . A A . 18 VAL CG2 1 1 6 2814 1 1 18 VAL H H -0.723 -7.618 2.222 1.00 . A A . 18 VAL H 1 1 6 2815 1 1 18 VAL HA H -1.410 -7.530 -0.619 1.00 . A A . 18 VAL HA 1 1 6 2816 1 1 18 VAL HB H -2.571 -9.337 1.538 1.00 . A A . 18 VAL HB 1 1 6 2817 1 1 18 VAL HG11 H -2.872 -9.429 -1.460 1.00 . A A . 18 VAL HG11 1 1 6 2818 1 1 18 VAL HG12 H -4.110 -8.948 -0.300 1.00 . A A . 18 VAL HG12 1 1 6 2819 1 1 18 VAL HG13 H -3.522 -10.610 -0.321 1.00 . A A . 18 VAL HG13 1 1 6 2820 1 1 18 VAL HG21 H -1.263 -11.138 0.510 1.00 . A A . 18 VAL HG21 1 1 6 2821 1 1 18 VAL HG22 H -0.218 -9.864 1.142 1.00 . A A . 18 VAL HG22 1 1 6 2822 1 1 18 VAL HG23 H -0.528 -9.972 -0.590 1.00 . A A . 18 VAL HG23 1 1 6 2823 1 1 18 VAL N N -0.673 -7.335 1.282 1.00 . A A . 18 VAL N 1 1 6 2824 1 1 18 VAL O O -3.518 -6.866 1.771 1.00 . A A . 18 VAL O 1 1 6 2825 1 1 19 CYS C C -5.711 -5.745 -0.267 1.00 . A A . 19 CYS C 1 1 6 2826 1 1 19 CYS CA C -4.362 -5.044 -0.104 1.00 . A A . 19 CYS CA 1 1 6 2827 1 1 19 CYS CB C -4.216 -3.915 -1.122 1.00 . A A . 19 CYS CB 1 1 6 2828 1 1 19 CYS H H -2.786 -6.004 -1.106 1.00 . A A . 19 CYS H 1 1 6 2829 1 1 19 CYS HA H -4.303 -4.625 0.890 1.00 . A A . 19 CYS HA 1 1 6 2830 1 1 19 CYS HB2 H -4.323 -4.318 -2.118 1.00 . A A . 19 CYS HB2 1 1 6 2831 1 1 19 CYS HB3 H -4.994 -3.186 -0.953 1.00 . A A . 19 CYS HB3 1 1 6 2832 1 1 19 CYS N N -3.276 -5.985 -0.258 1.00 . A A . 19 CYS N 1 1 6 2833 1 1 19 CYS O O -5.769 -6.909 -0.692 1.00 . A A . 19 CYS O 1 1 6 2834 1 1 19 CYS SG S -2.613 -3.048 -1.053 1.00 . A A . 19 CYS SG 1 1 6 2835 1 1 20 ALA C C -8.469 -5.852 -1.473 1.00 . A A . 20 ALA C 1 1 6 2836 1 1 20 ALA CA C -8.126 -5.568 -0.019 1.00 . A A . 20 ALA CA 1 1 6 2837 1 1 20 ALA CB C -9.119 -4.577 0.576 1.00 . A A . 20 ALA CB 1 1 6 2838 1 1 20 ALA H H -6.647 -4.164 0.494 1.00 . A A . 20 ALA H 1 1 6 2839 1 1 20 ALA HA H -8.190 -6.490 0.540 1.00 . A A . 20 ALA HA 1 1 6 2840 1 1 20 ALA HB1 H -10.116 -4.988 0.522 1.00 . A A . 20 ALA HB1 1 1 6 2841 1 1 20 ALA HB2 H -9.084 -3.652 0.019 1.00 . A A . 20 ALA HB2 1 1 6 2842 1 1 20 ALA HB3 H -8.863 -4.385 1.607 1.00 . A A . 20 ALA HB3 1 1 6 2843 1 1 20 ALA N N -6.774 -5.057 0.102 1.00 . A A . 20 ALA N 1 1 6 2844 1 1 20 ALA O O -7.886 -5.249 -2.394 1.00 . A A . 20 ALA O 1 1 6 2845 1 1 21 SER C C -10.385 -5.951 -3.748 1.00 . A A . 21 SER C 1 1 6 2846 1 1 21 SER CA C -9.839 -7.148 -2.971 1.00 . A A . 21 SER CA 1 1 6 2847 1 1 21 SER CB C -10.872 -8.254 -2.805 1.00 . A A . 21 SER CB 1 1 6 2848 1 1 21 SER H H -9.805 -7.209 -0.906 1.00 . A A . 21 SER H 1 1 6 2849 1 1 21 SER HA H -8.995 -7.549 -3.511 1.00 . A A . 21 SER HA 1 1 6 2850 1 1 21 SER HB2 H -11.486 -8.313 -3.692 1.00 . A A . 21 SER HB2 1 1 6 2851 1 1 21 SER HB3 H -10.369 -9.196 -2.645 1.00 . A A . 21 SER HB3 1 1 6 2852 1 1 21 SER HG H -12.374 -7.329 -1.930 1.00 . A A . 21 SER HG 1 1 6 2853 1 1 21 SER N N -9.384 -6.760 -1.669 1.00 . A A . 21 SER N 1 1 6 2854 1 1 21 SER O O -11.398 -5.349 -3.371 1.00 . A A . 21 SER O 1 1 6 2855 1 1 21 SER OG O -11.713 -7.987 -1.671 1.00 . A A . 21 SER OG 1 1 6 2856 1 1 22 GLY C C -9.094 -3.317 -5.450 1.00 . A A . 22 GLY C 1 1 6 2857 1 1 22 GLY CA C -10.058 -4.471 -5.599 1.00 . A A . 22 GLY CA 1 1 6 2858 1 1 22 GLY H H -8.866 -6.086 -5.023 1.00 . A A . 22 GLY H 1 1 6 2859 1 1 22 GLY HA2 H -10.082 -4.780 -6.633 1.00 . A A . 22 GLY HA2 1 1 6 2860 1 1 22 GLY HA3 H -11.044 -4.147 -5.300 1.00 . A A . 22 GLY HA3 1 1 6 2861 1 1 22 GLY N N -9.679 -5.589 -4.790 1.00 . A A . 22 GLY N 1 1 6 2862 1 1 22 GLY O O -9.151 -2.353 -6.208 1.00 . A A . 22 GLY O 1 1 6 2863 1 1 23 THR C C -5.833 -2.879 -4.600 1.00 . A A . 23 THR C 1 1 6 2864 1 1 23 THR CA C -7.234 -2.362 -4.287 1.00 . A A . 23 THR CA 1 1 6 2865 1 1 23 THR CB C -7.311 -1.770 -2.850 1.00 . A A . 23 THR CB 1 1 6 2866 1 1 23 THR CG2 C -8.700 -1.215 -2.578 1.00 . A A . 23 THR CG2 1 1 6 2867 1 1 23 THR H H -8.170 -4.210 -3.925 1.00 . A A . 23 THR H 1 1 6 2868 1 1 23 THR HA H -7.462 -1.582 -5.000 1.00 . A A . 23 THR HA 1 1 6 2869 1 1 23 THR HB H -6.597 -0.966 -2.759 1.00 . A A . 23 THR HB 1 1 6 2870 1 1 23 THR HG1 H -7.283 -3.632 -2.226 1.00 . A A . 23 THR HG1 1 1 6 2871 1 1 23 THR HG21 H -9.429 -2.006 -2.679 1.00 . A A . 23 THR HG21 1 1 6 2872 1 1 23 THR HG22 H -8.920 -0.427 -3.283 1.00 . A A . 23 THR HG22 1 1 6 2873 1 1 23 THR HG23 H -8.736 -0.821 -1.574 1.00 . A A . 23 THR HG23 1 1 6 2874 1 1 23 THR N N -8.200 -3.410 -4.495 1.00 . A A . 23 THR N 1 1 6 2875 1 1 23 THR O O -5.486 -4.028 -4.260 1.00 . A A . 23 THR O 1 1 6 2876 1 1 23 THR OG1 O -7.027 -2.768 -1.872 1.00 . A A . 23 THR OG1 1 1 6 2877 1 1 24 THR C C -2.634 -1.757 -4.940 1.00 . A A . 24 THR C 1 1 6 2878 1 1 24 THR CA C -3.735 -2.490 -5.675 1.00 . A A . 24 THR CA 1 1 6 2879 1 1 24 THR CB C -3.575 -2.290 -7.199 1.00 . A A . 24 THR CB 1 1 6 2880 1 1 24 THR CG2 C -4.377 -3.319 -7.969 1.00 . A A . 24 THR CG2 1 1 6 2881 1 1 24 THR H H -5.336 -1.145 -5.411 1.00 . A A . 24 THR H 1 1 6 2882 1 1 24 THR HA H -3.645 -3.546 -5.468 1.00 . A A . 24 THR HA 1 1 6 2883 1 1 24 THR HB H -2.529 -2.409 -7.433 1.00 . A A . 24 THR HB 1 1 6 2884 1 1 24 THR HG1 H -4.676 -0.635 -6.972 1.00 . A A . 24 THR HG1 1 1 6 2885 1 1 24 THR HG21 H -4.267 -3.143 -9.029 1.00 . A A . 24 THR HG21 1 1 6 2886 1 1 24 THR HG22 H -5.419 -3.244 -7.694 1.00 . A A . 24 THR HG22 1 1 6 2887 1 1 24 THR HG23 H -4.013 -4.309 -7.730 1.00 . A A . 24 THR HG23 1 1 6 2888 1 1 24 THR N N -5.043 -2.072 -5.239 1.00 . A A . 24 THR N 1 1 6 2889 1 1 24 THR O O -2.788 -0.590 -4.598 1.00 . A A . 24 THR O 1 1 6 2890 1 1 24 THR OG1 O -3.995 -0.956 -7.588 1.00 . A A . 24 THR OG1 1 1 6 2891 1 1 25 CYS C C 0.350 -1.046 -5.094 1.00 . A A . 25 CYS C 1 1 6 2892 1 1 25 CYS CA C -0.407 -1.832 -4.046 1.00 . A A . 25 CYS CA 1 1 6 2893 1 1 25 CYS CB C 0.499 -2.898 -3.398 1.00 . A A . 25 CYS CB 1 1 6 2894 1 1 25 CYS H H -1.485 -3.377 -4.971 1.00 . A A . 25 CYS H 1 1 6 2895 1 1 25 CYS HA H -0.773 -1.153 -3.290 1.00 . A A . 25 CYS HA 1 1 6 2896 1 1 25 CYS HB2 H -0.084 -3.469 -2.691 1.00 . A A . 25 CYS HB2 1 1 6 2897 1 1 25 CYS HB3 H 0.867 -3.562 -4.167 1.00 . A A . 25 CYS HB3 1 1 6 2898 1 1 25 CYS N N -1.544 -2.439 -4.687 1.00 . A A . 25 CYS N 1 1 6 2899 1 1 25 CYS O O 1.040 -1.616 -5.950 1.00 . A A . 25 CYS O 1 1 6 2900 1 1 25 CYS SG S 1.949 -2.229 -2.494 1.00 . A A . 25 CYS SG 1 1 6 2901 1 1 26 GLN C C 1.895 1.854 -5.447 1.00 . A A . 26 GLN C 1 1 6 2902 1 1 26 GLN CA C 0.773 1.080 -6.067 1.00 . A A . 26 GLN CA 1 1 6 2903 1 1 26 GLN CB C -0.244 2.017 -6.698 1.00 . A A . 26 GLN CB 1 1 6 2904 1 1 26 GLN CD C -2.283 2.250 -8.152 1.00 . A A . 26 GLN CD 1 1 6 2905 1 1 26 GLN CG C -1.352 1.299 -7.447 1.00 . A A . 26 GLN CG 1 1 6 2906 1 1 26 GLN H H -0.437 0.648 -4.420 1.00 . A A . 26 GLN H 1 1 6 2907 1 1 26 GLN HA H 1.181 0.447 -6.841 1.00 . A A . 26 GLN HA 1 1 6 2908 1 1 26 GLN HB2 H -0.695 2.609 -5.916 1.00 . A A . 26 GLN HB2 1 1 6 2909 1 1 26 GLN HB3 H 0.263 2.675 -7.385 1.00 . A A . 26 GLN HB3 1 1 6 2910 1 1 26 GLN HE21 H -3.782 0.988 -7.926 1.00 . A A . 26 GLN HE21 1 1 6 2911 1 1 26 GLN HE22 H -4.154 2.469 -8.740 1.00 . A A . 26 GLN HE22 1 1 6 2912 1 1 26 GLN HG2 H -0.908 0.647 -8.185 1.00 . A A . 26 GLN HG2 1 1 6 2913 1 1 26 GLN HG3 H -1.921 0.712 -6.743 1.00 . A A . 26 GLN HG3 1 1 6 2914 1 1 26 GLN N N 0.151 0.239 -5.097 1.00 . A A . 26 GLN N 1 1 6 2915 1 1 26 GLN NE2 N -3.525 1.866 -8.290 1.00 . A A . 26 GLN NE2 1 1 6 2916 1 1 26 GLN O O 1.746 2.433 -4.367 1.00 . A A . 26 GLN O 1 1 6 2917 1 1 26 GLN OE1 O -1.882 3.337 -8.570 1.00 . A A . 26 GLN OE1 1 1 6 2918 1 1 27 VAL C C 4.067 4.009 -6.115 1.00 . A A . 27 VAL C 1 1 6 2919 1 1 27 VAL CA C 4.162 2.571 -5.637 1.00 . A A . 27 VAL CA 1 1 6 2920 1 1 27 VAL CB C 5.488 1.924 -6.127 1.00 . A A . 27 VAL CB 1 1 6 2921 1 1 27 VAL CG1 C 6.704 2.683 -5.614 1.00 . A A . 27 VAL CG1 1 1 6 2922 1 1 27 VAL CG2 C 5.562 0.473 -5.695 1.00 . A A . 27 VAL CG2 1 1 6 2923 1 1 27 VAL H H 3.081 1.338 -6.939 1.00 . A A . 27 VAL H 1 1 6 2924 1 1 27 VAL HA H 4.143 2.558 -4.557 1.00 . A A . 27 VAL HA 1 1 6 2925 1 1 27 VAL HB H 5.506 1.955 -7.205 1.00 . A A . 27 VAL HB 1 1 6 2926 1 1 27 VAL HG11 H 7.606 2.209 -5.972 1.00 . A A . 27 VAL HG11 1 1 6 2927 1 1 27 VAL HG12 H 6.701 2.682 -4.534 1.00 . A A . 27 VAL HG12 1 1 6 2928 1 1 27 VAL HG13 H 6.667 3.702 -5.971 1.00 . A A . 27 VAL HG13 1 1 6 2929 1 1 27 VAL HG21 H 6.485 0.039 -6.047 1.00 . A A . 27 VAL HG21 1 1 6 2930 1 1 27 VAL HG22 H 4.723 -0.071 -6.106 1.00 . A A . 27 VAL HG22 1 1 6 2931 1 1 27 VAL HG23 H 5.530 0.423 -4.616 1.00 . A A . 27 VAL HG23 1 1 6 2932 1 1 27 VAL N N 3.016 1.847 -6.102 1.00 . A A . 27 VAL N 1 1 6 2933 1 1 27 VAL O O 4.300 4.309 -7.293 1.00 . A A . 27 VAL O 1 1 6 2934 1 1 28 LEU C C 4.943 6.877 -5.420 1.00 . A A . 28 LEU C 1 1 6 2935 1 1 28 LEU CA C 3.574 6.284 -5.554 1.00 . A A . 28 LEU CA 1 1 6 2936 1 1 28 LEU CB C 2.588 7.035 -4.643 1.00 . A A . 28 LEU CB 1 1 6 2937 1 1 28 LEU CD1 C 0.638 5.474 -4.304 1.00 . A A . 28 LEU CD1 1 1 6 2938 1 1 28 LEU CD2 C 0.289 7.940 -4.356 1.00 . A A . 28 LEU CD2 1 1 6 2939 1 1 28 LEU CG C 1.099 6.788 -4.884 1.00 . A A . 28 LEU CG 1 1 6 2940 1 1 28 LEU H H 3.383 4.564 -4.348 1.00 . A A . 28 LEU H 1 1 6 2941 1 1 28 LEU HA H 3.241 6.388 -6.577 1.00 . A A . 28 LEU HA 1 1 6 2942 1 1 28 LEU HB2 H 2.803 6.722 -3.632 1.00 . A A . 28 LEU HB2 1 1 6 2943 1 1 28 LEU HB3 H 2.775 8.097 -4.699 1.00 . A A . 28 LEU HB3 1 1 6 2944 1 1 28 LEU HD11 H 0.816 5.484 -3.239 1.00 . A A . 28 LEU HD11 1 1 6 2945 1 1 28 LEU HD12 H 1.200 4.670 -4.756 1.00 . A A . 28 LEU HD12 1 1 6 2946 1 1 28 LEU HD13 H -0.416 5.342 -4.496 1.00 . A A . 28 LEU HD13 1 1 6 2947 1 1 28 LEU HD21 H 0.467 8.052 -3.297 1.00 . A A . 28 LEU HD21 1 1 6 2948 1 1 28 LEU HD22 H -0.758 7.763 -4.549 1.00 . A A . 28 LEU HD22 1 1 6 2949 1 1 28 LEU HD23 H 0.621 8.826 -4.878 1.00 . A A . 28 LEU HD23 1 1 6 2950 1 1 28 LEU HG H 0.937 6.737 -5.951 1.00 . A A . 28 LEU HG 1 1 6 2951 1 1 28 LEU N N 3.643 4.879 -5.239 1.00 . A A . 28 LEU N 1 1 6 2952 1 1 28 LEU O O 5.537 7.370 -6.384 1.00 . A A . 28 LEU O 1 1 6 2953 1 1 29 ASN C C 7.680 6.137 -3.660 1.00 . A A . 29 ASN C 1 1 6 2954 1 1 29 ASN CA C 6.746 7.301 -3.912 1.00 . A A . 29 ASN CA 1 1 6 2955 1 1 29 ASN CB C 6.625 8.119 -2.620 1.00 . A A . 29 ASN CB 1 1 6 2956 1 1 29 ASN CG C 5.647 9.290 -2.644 1.00 . A A . 29 ASN CG 1 1 6 2957 1 1 29 ASN H H 5.015 6.194 -3.582 1.00 . A A . 29 ASN H 1 1 6 2958 1 1 29 ASN HA H 7.101 7.927 -4.716 1.00 . A A . 29 ASN HA 1 1 6 2959 1 1 29 ASN HB2 H 6.345 7.463 -1.811 1.00 . A A . 29 ASN HB2 1 1 6 2960 1 1 29 ASN HB3 H 7.610 8.512 -2.414 1.00 . A A . 29 ASN HB3 1 1 6 2961 1 1 29 ASN HD21 H 6.695 10.186 -1.253 1.00 . A A . 29 ASN HD21 1 1 6 2962 1 1 29 ASN HD22 H 5.286 11.017 -1.773 1.00 . A A . 29 ASN HD22 1 1 6 2963 1 1 29 ASN N N 5.473 6.742 -4.257 1.00 . A A . 29 ASN N 1 1 6 2964 1 1 29 ASN ND2 N 5.901 10.254 -1.824 1.00 . A A . 29 ASN ND2 1 1 6 2965 1 1 29 ASN O O 7.201 5.018 -3.501 1.00 . A A . 29 ASN O 1 1 6 2966 1 1 29 ASN OD1 O 4.659 9.307 -3.370 1.00 . A A . 29 ASN OD1 1 1 6 2967 1 1 30 PRO C C 9.675 4.509 -2.047 1.00 . A A . 30 PRO C 1 1 6 2968 1 1 30 PRO CA C 9.973 5.269 -3.346 1.00 . A A . 30 PRO CA 1 1 6 2969 1 1 30 PRO CB C 11.318 5.991 -3.240 1.00 . A A . 30 PRO CB 1 1 6 2970 1 1 30 PRO CD C 9.704 7.645 -3.811 1.00 . A A . 30 PRO CD 1 1 6 2971 1 1 30 PRO CG C 11.131 7.235 -4.028 1.00 . A A . 30 PRO CG 1 1 6 2972 1 1 30 PRO HA H 9.997 4.569 -4.168 1.00 . A A . 30 PRO HA 1 1 6 2973 1 1 30 PRO HB2 H 11.530 6.206 -2.203 1.00 . A A . 30 PRO HB2 1 1 6 2974 1 1 30 PRO HB3 H 12.101 5.373 -3.656 1.00 . A A . 30 PRO HB3 1 1 6 2975 1 1 30 PRO HD2 H 9.633 8.268 -2.933 1.00 . A A . 30 PRO HD2 1 1 6 2976 1 1 30 PRO HD3 H 9.311 8.159 -4.675 1.00 . A A . 30 PRO HD3 1 1 6 2977 1 1 30 PRO HG2 H 11.806 8.000 -3.673 1.00 . A A . 30 PRO HG2 1 1 6 2978 1 1 30 PRO HG3 H 11.310 7.033 -5.074 1.00 . A A . 30 PRO HG3 1 1 6 2979 1 1 30 PRO N N 9.014 6.354 -3.599 1.00 . A A . 30 PRO N 1 1 6 2980 1 1 30 PRO O O 9.813 3.282 -1.983 1.00 . A A . 30 PRO O 1 1 6 2981 1 1 31 TYR C C 7.460 4.460 0.433 1.00 . A A . 31 TYR C 1 1 6 2982 1 1 31 TYR CA C 8.965 4.569 0.240 1.00 . A A . 31 TYR CA 1 1 6 2983 1 1 31 TYR CB C 9.569 5.368 1.419 1.00 . A A . 31 TYR CB 1 1 6 2984 1 1 31 TYR CD1 C 11.516 6.727 0.529 1.00 . A A . 31 TYR CD1 1 1 6 2985 1 1 31 TYR CD2 C 11.989 4.871 1.930 1.00 . A A . 31 TYR CD2 1 1 6 2986 1 1 31 TYR CE1 C 12.856 6.989 0.405 1.00 . A A . 31 TYR CE1 1 1 6 2987 1 1 31 TYR CE2 C 13.337 5.129 1.813 1.00 . A A . 31 TYR CE2 1 1 6 2988 1 1 31 TYR CG C 11.055 5.659 1.293 1.00 . A A . 31 TYR CG 1 1 6 2989 1 1 31 TYR CZ C 13.763 6.187 1.048 1.00 . A A . 31 TYR CZ 1 1 6 2990 1 1 31 TYR H H 9.148 6.197 -1.090 1.00 . A A . 31 TYR H 1 1 6 2991 1 1 31 TYR HA H 9.405 3.582 0.228 1.00 . A A . 31 TYR HA 1 1 6 2992 1 1 31 TYR HB2 H 9.053 6.308 1.527 1.00 . A A . 31 TYR HB2 1 1 6 2993 1 1 31 TYR HB3 H 9.424 4.798 2.325 1.00 . A A . 31 TYR HB3 1 1 6 2994 1 1 31 TYR HD1 H 10.805 7.358 0.019 1.00 . A A . 31 TYR HD1 1 1 6 2995 1 1 31 TYR HD2 H 11.652 4.042 2.534 1.00 . A A . 31 TYR HD2 1 1 6 2996 1 1 31 TYR HE1 H 13.190 7.824 -0.194 1.00 . A A . 31 TYR HE1 1 1 6 2997 1 1 31 TYR HE2 H 14.050 4.496 2.317 1.00 . A A . 31 TYR HE2 1 1 6 2998 1 1 31 TYR HH H 15.229 7.399 1.034 1.00 . A A . 31 TYR HH 1 1 6 2999 1 1 31 TYR N N 9.256 5.223 -1.014 1.00 . A A . 31 TYR N 1 1 6 3000 1 1 31 TYR O O 6.973 3.553 1.110 1.00 . A A . 31 TYR O 1 1 6 3001 1 1 31 TYR OH O 15.113 6.444 0.921 1.00 . A A . 31 TYR OH 1 1 6 3002 1 1 32 TYR C C 4.580 4.526 -1.120 1.00 . A A . 32 TYR C 1 1 6 3003 1 1 32 TYR CA C 5.282 5.322 -0.020 1.00 . A A . 32 TYR CA 1 1 6 3004 1 1 32 TYR CB C 4.677 6.719 0.121 1.00 . A A . 32 TYR CB 1 1 6 3005 1 1 32 TYR CD1 C 3.020 6.269 1.933 1.00 . A A . 32 TYR CD1 1 1 6 3006 1 1 32 TYR CD2 C 2.182 6.983 -0.182 1.00 . A A . 32 TYR CD2 1 1 6 3007 1 1 32 TYR CE1 C 1.747 6.186 2.425 1.00 . A A . 32 TYR CE1 1 1 6 3008 1 1 32 TYR CE2 C 0.896 6.906 0.314 1.00 . A A . 32 TYR CE2 1 1 6 3009 1 1 32 TYR CG C 3.266 6.664 0.627 1.00 . A A . 32 TYR CG 1 1 6 3010 1 1 32 TYR CZ C 0.688 6.503 1.620 1.00 . A A . 32 TYR CZ 1 1 6 3011 1 1 32 TYR H H 7.136 6.038 -0.738 1.00 . A A . 32 TYR H 1 1 6 3012 1 1 32 TYR HA H 5.104 4.791 0.905 1.00 . A A . 32 TYR HA 1 1 6 3013 1 1 32 TYR HB2 H 5.264 7.320 0.799 1.00 . A A . 32 TYR HB2 1 1 6 3014 1 1 32 TYR HB3 H 4.653 7.196 -0.848 1.00 . A A . 32 TYR HB3 1 1 6 3015 1 1 32 TYR HD1 H 3.856 6.019 2.570 1.00 . A A . 32 TYR HD1 1 1 6 3016 1 1 32 TYR HD2 H 2.351 7.296 -1.203 1.00 . A A . 32 TYR HD2 1 1 6 3017 1 1 32 TYR HE1 H 1.584 5.876 3.446 1.00 . A A . 32 TYR HE1 1 1 6 3018 1 1 32 TYR HE2 H 0.055 7.154 -0.318 1.00 . A A . 32 TYR HE2 1 1 6 3019 1 1 32 TYR HH H -0.570 6.746 3.027 1.00 . A A . 32 TYR HH 1 1 6 3020 1 1 32 TYR N N 6.711 5.356 -0.178 1.00 . A A . 32 TYR N 1 1 6 3021 1 1 32 TYR O O 4.567 4.920 -2.288 1.00 . A A . 32 TYR O 1 1 6 3022 1 1 32 TYR OH O -0.590 6.415 2.119 1.00 . A A . 32 TYR OH 1 1 6 3023 1 1 33 SER C C 1.799 2.534 -1.009 1.00 . A A . 33 SER C 1 1 6 3024 1 1 33 SER CA C 3.181 2.655 -1.637 1.00 . A A . 33 SER CA 1 1 6 3025 1 1 33 SER CB C 3.832 1.287 -1.811 1.00 . A A . 33 SER CB 1 1 6 3026 1 1 33 SER H H 4.041 3.157 0.189 1.00 . A A . 33 SER H 1 1 6 3027 1 1 33 SER HA H 3.113 3.165 -2.587 1.00 . A A . 33 SER HA 1 1 6 3028 1 1 33 SER HB2 H 3.775 0.738 -0.883 1.00 . A A . 33 SER HB2 1 1 6 3029 1 1 33 SER HB3 H 3.317 0.742 -2.589 1.00 . A A . 33 SER HB3 1 1 6 3030 1 1 33 SER HG H 5.347 2.291 -2.576 1.00 . A A . 33 SER HG 1 1 6 3031 1 1 33 SER N N 3.972 3.450 -0.741 1.00 . A A . 33 SER N 1 1 6 3032 1 1 33 SER O O 1.697 2.211 0.169 1.00 . A A . 33 SER O 1 1 6 3033 1 1 33 SER OG O 5.198 1.426 -2.178 1.00 . A A . 33 SER OG 1 1 6 3034 1 1 34 GLN C C -1.524 1.922 -1.960 1.00 . A A . 34 GLN C 1 1 6 3035 1 1 34 GLN CA C -0.580 2.862 -1.219 1.00 . A A . 34 GLN CA 1 1 6 3036 1 1 34 GLN CB C -1.068 4.318 -1.310 1.00 . A A . 34 GLN CB 1 1 6 3037 1 1 34 GLN CD C -2.844 6.034 -0.805 1.00 . A A . 34 GLN CD 1 1 6 3038 1 1 34 GLN CG C -2.446 4.573 -0.747 1.00 . A A . 34 GLN CG 1 1 6 3039 1 1 34 GLN H H 0.884 2.889 -2.740 1.00 . A A . 34 GLN H 1 1 6 3040 1 1 34 GLN HA H -0.542 2.578 -0.178 1.00 . A A . 34 GLN HA 1 1 6 3041 1 1 34 GLN HB2 H -0.378 4.942 -0.764 1.00 . A A . 34 GLN HB2 1 1 6 3042 1 1 34 GLN HB3 H -1.065 4.616 -2.348 1.00 . A A . 34 GLN HB3 1 1 6 3043 1 1 34 GLN HE21 H -2.027 6.363 0.970 1.00 . A A . 34 GLN HE21 1 1 6 3044 1 1 34 GLN HE22 H -2.783 7.712 0.216 1.00 . A A . 34 GLN HE22 1 1 6 3045 1 1 34 GLN HG2 H -3.164 3.998 -1.314 1.00 . A A . 34 GLN HG2 1 1 6 3046 1 1 34 GLN HG3 H -2.465 4.248 0.283 1.00 . A A . 34 GLN HG3 1 1 6 3047 1 1 34 GLN N N 0.765 2.788 -1.767 1.00 . A A . 34 GLN N 1 1 6 3048 1 1 34 GLN NE2 N -2.518 6.769 0.216 1.00 . A A . 34 GLN NE2 1 1 6 3049 1 1 34 GLN O O -1.357 1.695 -3.159 1.00 . A A . 34 GLN O 1 1 6 3050 1 1 34 GLN OE1 O -3.436 6.501 -1.771 1.00 . A A . 34 GLN OE1 1 1 6 3051 1 1 35 CYS C C -4.555 1.326 -2.473 1.00 . A A . 35 CYS C 1 1 6 3052 1 1 35 CYS CA C -3.467 0.488 -1.822 1.00 . A A . 35 CYS CA 1 1 6 3053 1 1 35 CYS CB C -4.104 -0.413 -0.770 1.00 . A A . 35 CYS CB 1 1 6 3054 1 1 35 CYS H H -2.504 1.483 -0.264 1.00 . A A . 35 CYS H 1 1 6 3055 1 1 35 CYS HA H -2.993 -0.130 -2.570 1.00 . A A . 35 CYS HA 1 1 6 3056 1 1 35 CYS HB2 H -4.668 0.190 -0.077 1.00 . A A . 35 CYS HB2 1 1 6 3057 1 1 35 CYS HB3 H -4.792 -1.060 -1.285 1.00 . A A . 35 CYS HB3 1 1 6 3058 1 1 35 CYS N N -2.472 1.344 -1.236 1.00 . A A . 35 CYS N 1 1 6 3059 1 1 35 CYS O O -5.390 1.937 -1.782 1.00 . A A . 35 CYS O 1 1 6 3060 1 1 35 CYS SG S -2.947 -1.456 0.169 1.00 . A A . 35 CYS SG 1 1 6 3061 1 1 36 LEU C C -6.322 1.062 -5.287 1.00 . A A . 36 LEU C 1 1 6 3062 1 1 36 LEU CA C -5.504 2.080 -4.544 1.00 . A A . 36 LEU CA 1 1 6 3063 1 1 36 LEU CB C -4.859 3.079 -5.509 1.00 . A A . 36 LEU CB 1 1 6 3064 1 1 36 LEU CD1 C -3.500 5.143 -5.933 1.00 . A A . 36 LEU CD1 1 1 6 3065 1 1 36 LEU CD2 C -5.191 5.126 -4.101 1.00 . A A . 36 LEU CD2 1 1 6 3066 1 1 36 LEU CG C -4.174 4.292 -4.870 1.00 . A A . 36 LEU CG 1 1 6 3067 1 1 36 LEU H H -3.793 0.917 -4.234 1.00 . A A . 36 LEU H 1 1 6 3068 1 1 36 LEU HA H -6.154 2.606 -3.862 1.00 . A A . 36 LEU HA 1 1 6 3069 1 1 36 LEU HB2 H -4.123 2.548 -6.095 1.00 . A A . 36 LEU HB2 1 1 6 3070 1 1 36 LEU HB3 H -5.624 3.442 -6.177 1.00 . A A . 36 LEU HB3 1 1 6 3071 1 1 36 LEU HD11 H -2.763 4.550 -6.454 1.00 . A A . 36 LEU HD11 1 1 6 3072 1 1 36 LEU HD12 H -3.018 5.988 -5.465 1.00 . A A . 36 LEU HD12 1 1 6 3073 1 1 36 LEU HD13 H -4.240 5.496 -6.638 1.00 . A A . 36 LEU HD13 1 1 6 3074 1 1 36 LEU HD21 H -5.617 4.538 -3.302 1.00 . A A . 36 LEU HD21 1 1 6 3075 1 1 36 LEU HD22 H -5.980 5.444 -4.766 1.00 . A A . 36 LEU HD22 1 1 6 3076 1 1 36 LEU HD23 H -4.702 5.993 -3.683 1.00 . A A . 36 LEU HD23 1 1 6 3077 1 1 36 LEU HG H -3.418 3.952 -4.177 1.00 . A A . 36 LEU HG 1 1 6 3078 1 1 36 LEU N N -4.520 1.388 -3.764 1.00 . A A . 36 LEU N 1 1 6 3079 1 1 36 LEU O O -7.473 0.853 -4.915 1.00 . A A . 36 LEU O 1 1 6 3080 1 1 36 LEU OXT O -5.767 0.383 -6.184 1.00 . A A . 36 LEU OXT 1 1 6 3081 2 2 1 MAN C1 C 9.499 -3.783 9.022 1.00 . B A . 101 MAN C1 1 1 6 3082 2 2 1 MAN C2 C 10.415 -2.544 9.005 1.00 . B A . 101 MAN C2 1 1 6 3083 2 2 1 MAN C3 C 11.052 -2.414 7.635 1.00 . B A . 101 MAN C3 1 1 6 3084 2 2 1 MAN C4 C 11.856 -3.665 7.355 1.00 . B A . 101 MAN C4 1 1 6 3085 2 2 1 MAN C5 C 10.910 -4.876 7.385 1.00 . B A . 101 MAN C5 1 1 6 3086 2 2 1 MAN C6 C 11.608 -6.185 7.142 1.00 . B A . 101 MAN C6 1 1 6 3087 2 2 1 MAN H1 H 9.080 -3.836 10.037 1.00 . B A . 101 MAN H1 1 1 6 3088 2 2 1 MAN H2 H 9.791 -1.660 9.196 1.00 . B A . 101 MAN H2 1 1 6 3089 2 2 1 MAN H3 H 10.243 -2.329 6.896 1.00 . B A . 101 MAN H3 1 1 6 3090 2 2 1 MAN H4 H 12.593 -3.789 8.164 1.00 . B A . 101 MAN H4 1 1 6 3091 2 2 1 MAN H5 H 10.107 -4.740 6.645 1.00 . B A . 101 MAN H5 1 1 6 3092 2 2 1 MAN H61 H 12.497 -6.242 7.788 1.00 . B A . 101 MAN H61 1 1 6 3093 2 2 1 MAN H62 H 11.938 -6.168 6.094 1.00 . B A . 101 MAN H62 1 1 6 3094 2 2 1 MAN HO2 H 10.995 -2.722 10.836 1.00 . B A . 101 MAN HO2 1 1 6 3095 2 2 1 MAN HO3 H 12.241 -1.225 6.693 1.00 . B A . 101 MAN HO3 1 1 6 3096 2 2 1 MAN HO4 H 13.133 -2.799 6.160 1.00 . B A . 101 MAN HO4 1 1 6 3097 2 2 1 MAN HO6 H 10.214 -7.134 8.121 1.00 . B A . 101 MAN HO6 1 1 6 3098 2 2 1 MAN O2 O 11.439 -2.659 9.982 1.00 . B A . 101 MAN O2 1 1 6 3099 2 2 1 MAN O3 O 11.893 -1.285 7.590 1.00 . B A . 101 MAN O3 1 1 6 3100 2 2 1 MAN O4 O 12.529 -3.549 6.102 1.00 . B A . 101 MAN O4 1 1 6 3101 2 2 1 MAN O5 O 10.264 -4.958 8.690 1.00 . B A . 101 MAN O5 1 1 6 3102 2 2 1 MAN O6 O 10.728 -7.300 7.322 1.00 . B A . 101 MAN O6 1 1 7 3103 1 1 1 THR C C -5.372 -5.888 4.891 1.00 . A A . 1 THR C 1 1 7 3104 1 1 1 THR CA C -5.386 -7.428 4.763 1.00 . A A . 1 THR CA 1 1 7 3105 1 1 1 THR CB C -6.598 -7.934 3.971 1.00 . A A . 1 THR CB 1 1 7 3106 1 1 1 THR CG2 C -6.466 -7.608 2.503 1.00 . A A . 1 THR CG2 1 1 7 3107 1 1 1 THR H1 H -4.575 -7.798 6.617 1.00 . A A . 1 THR H1 1 1 7 3108 1 1 1 THR H2 H -5.575 -9.035 5.992 1.00 . A A . 1 THR H2 1 1 7 3109 1 1 1 THR H3 H -6.250 -7.605 6.588 1.00 . A A . 1 THR H3 1 1 7 3110 1 1 1 THR HA H -4.476 -7.753 4.279 1.00 . A A . 1 THR HA 1 1 7 3111 1 1 1 THR HB H -7.505 -7.506 4.368 1.00 . A A . 1 THR HB 1 1 7 3112 1 1 1 THR HG1 H -7.050 -9.759 3.340 1.00 . A A . 1 THR HG1 1 1 7 3113 1 1 1 THR HG21 H -5.571 -8.069 2.112 1.00 . A A . 1 THR HG21 1 1 7 3114 1 1 1 THR HG22 H -6.403 -6.538 2.374 1.00 . A A . 1 THR HG22 1 1 7 3115 1 1 1 THR HG23 H -7.325 -7.989 1.972 1.00 . A A . 1 THR HG23 1 1 7 3116 1 1 1 THR N N -5.439 -8.010 6.082 1.00 . A A . 1 THR N 1 1 7 3117 1 1 1 THR O O -6.035 -5.331 5.775 1.00 . A A . 1 THR O 1 1 7 3118 1 1 1 THR OG1 O -6.646 -9.360 4.122 1.00 . A A . 1 THR OG1 1 1 7 3119 1 1 2 GLN C C -5.558 -3.048 3.349 1.00 . A A . 2 GLN C 1 1 7 3120 1 1 2 GLN CA C -4.461 -3.773 4.170 1.00 . A A . 2 GLN CA 1 1 7 3121 1 1 2 GLN CB C -3.026 -3.386 3.754 1.00 . A A . 2 GLN CB 1 1 7 3122 1 1 2 GLN CD C -3.063 -0.865 4.113 1.00 . A A . 2 GLN CD 1 1 7 3123 1 1 2 GLN CG C -2.445 -2.176 4.502 1.00 . A A . 2 GLN CG 1 1 7 3124 1 1 2 GLN H H -4.164 -5.664 3.295 1.00 . A A . 2 GLN H 1 1 7 3125 1 1 2 GLN HA H -4.610 -3.532 5.211 1.00 . A A . 2 GLN HA 1 1 7 3126 1 1 2 GLN HB2 H -2.380 -4.233 3.931 1.00 . A A . 2 GLN HB2 1 1 7 3127 1 1 2 GLN HB3 H -3.016 -3.178 2.696 1.00 . A A . 2 GLN HB3 1 1 7 3128 1 1 2 GLN HE21 H -3.118 -1.417 2.220 1.00 . A A . 2 GLN HE21 1 1 7 3129 1 1 2 GLN HE22 H -3.794 0.112 2.583 1.00 . A A . 2 GLN HE22 1 1 7 3130 1 1 2 GLN HG2 H -2.605 -2.317 5.561 1.00 . A A . 2 GLN HG2 1 1 7 3131 1 1 2 GLN HG3 H -1.383 -2.130 4.310 1.00 . A A . 2 GLN HG3 1 1 7 3132 1 1 2 GLN N N -4.619 -5.209 4.043 1.00 . A A . 2 GLN N 1 1 7 3133 1 1 2 GLN NE2 N -3.335 -0.706 2.858 1.00 . A A . 2 GLN NE2 1 1 7 3134 1 1 2 GLN O O -5.831 -3.406 2.198 1.00 . A A . 2 GLN O 1 1 7 3135 1 1 2 GLN OE1 O -3.214 0.041 4.934 1.00 . A A . 2 GLN OE1 1 1 7 3136 1 1 3 SER C C -6.970 -0.295 2.320 1.00 . A A . 3 SER C 1 1 7 3137 1 1 3 SER CA C -7.321 -1.351 3.406 1.00 . A A . 3 SER CA 1 1 7 3138 1 1 3 SER CB C -8.077 -0.699 4.554 1.00 . A A . 3 SER CB 1 1 7 3139 1 1 3 SER H H -5.839 -1.768 4.836 1.00 . A A . 3 SER H 1 1 7 3140 1 1 3 SER HA H -7.975 -2.089 2.967 1.00 . A A . 3 SER HA 1 1 7 3141 1 1 3 SER HB2 H -7.461 0.073 4.990 1.00 . A A . 3 SER HB2 1 1 7 3142 1 1 3 SER HB3 H -8.995 -0.266 4.188 1.00 . A A . 3 SER HB3 1 1 7 3143 1 1 3 SER HG H -8.119 -1.310 6.407 1.00 . A A . 3 SER HG 1 1 7 3144 1 1 3 SER N N -6.167 -2.056 3.958 1.00 . A A . 3 SER N 1 1 7 3145 1 1 3 SER O O -5.805 0.053 2.085 1.00 . A A . 3 SER O 1 1 7 3146 1 1 3 SER OG O -8.386 -1.663 5.552 1.00 . A A . 3 SER OG 1 1 7 3147 1 1 4 HIS C C -7.300 2.497 1.171 1.00 . A A . 4 HIS C 1 1 7 3148 1 1 4 HIS CA C -7.892 1.197 0.623 1.00 . A A . 4 HIS CA 1 1 7 3149 1 1 4 HIS CB C -9.291 1.450 0.033 1.00 . A A . 4 HIS CB 1 1 7 3150 1 1 4 HIS CD2 C -8.367 2.261 -2.250 1.00 . A A . 4 HIS CD2 1 1 7 3151 1 1 4 HIS CE1 C -10.219 3.026 -3.088 1.00 . A A . 4 HIS CE1 1 1 7 3152 1 1 4 HIS CG C -9.322 2.117 -1.313 1.00 . A A . 4 HIS CG 1 1 7 3153 1 1 4 HIS H H -8.905 -0.054 1.971 1.00 . A A . 4 HIS H 1 1 7 3154 1 1 4 HIS HA H -7.249 0.797 -0.147 1.00 . A A . 4 HIS HA 1 1 7 3155 1 1 4 HIS HB2 H -9.802 0.505 -0.070 1.00 . A A . 4 HIS HB2 1 1 7 3156 1 1 4 HIS HB3 H -9.847 2.068 0.723 1.00 . A A . 4 HIS HB3 1 1 7 3157 1 1 4 HIS HD1 H -11.346 2.663 -1.429 1.00 . A A . 4 HIS HD1 1 1 7 3158 1 1 4 HIS HD2 H -7.328 1.984 -2.148 1.00 . A A . 4 HIS HD2 1 1 7 3159 1 1 4 HIS HE1 H -10.939 3.464 -3.761 1.00 . A A . 4 HIS HE1 1 1 7 3160 1 1 4 HIS HE2 H -8.642 2.514 -4.236 1.00 . A A . 4 HIS HE2 1 1 7 3161 1 1 4 HIS N N -8.005 0.225 1.691 1.00 . A A . 4 HIS N 1 1 7 3162 1 1 4 HIS ND1 N -10.467 2.616 -1.870 1.00 . A A . 4 HIS ND1 1 1 7 3163 1 1 4 HIS NE2 N -8.945 2.819 -3.348 1.00 . A A . 4 HIS NE2 1 1 7 3164 1 1 4 HIS O O -7.706 2.962 2.229 1.00 . A A . 4 HIS O 1 1 7 3165 1 1 5 TYR C C -4.587 4.140 1.910 1.00 . A A . 5 TYR C 1 1 7 3166 1 1 5 TYR CA C -5.609 4.286 0.785 1.00 . A A . 5 TYR CA 1 1 7 3167 1 1 5 TYR CB C -6.557 5.484 1.018 1.00 . A A . 5 TYR CB 1 1 7 3168 1 1 5 TYR CD1 C -6.681 6.425 -1.319 1.00 . A A . 5 TYR CD1 1 1 7 3169 1 1 5 TYR CD2 C -8.708 5.740 -0.281 1.00 . A A . 5 TYR CD2 1 1 7 3170 1 1 5 TYR CE1 C -7.376 6.797 -2.449 1.00 . A A . 5 TYR CE1 1 1 7 3171 1 1 5 TYR CE2 C -9.412 6.111 -1.409 1.00 . A A . 5 TYR CE2 1 1 7 3172 1 1 5 TYR CG C -7.332 5.889 -0.218 1.00 . A A . 5 TYR CG 1 1 7 3173 1 1 5 TYR CZ C -8.739 6.638 -2.491 1.00 . A A . 5 TYR CZ 1 1 7 3174 1 1 5 TYR H H -6.004 2.563 -0.356 1.00 . A A . 5 TYR H 1 1 7 3175 1 1 5 TYR HA H -5.026 4.495 -0.100 1.00 . A A . 5 TYR HA 1 1 7 3176 1 1 5 TYR HB2 H -7.266 5.223 1.788 1.00 . A A . 5 TYR HB2 1 1 7 3177 1 1 5 TYR HB3 H -5.979 6.335 1.346 1.00 . A A . 5 TYR HB3 1 1 7 3178 1 1 5 TYR HD1 H -5.608 6.549 -1.285 1.00 . A A . 5 TYR HD1 1 1 7 3179 1 1 5 TYR HD2 H -9.232 5.328 0.569 1.00 . A A . 5 TYR HD2 1 1 7 3180 1 1 5 TYR HE1 H -6.850 7.213 -3.295 1.00 . A A . 5 TYR HE1 1 1 7 3181 1 1 5 TYR HE2 H -10.484 5.985 -1.437 1.00 . A A . 5 TYR HE2 1 1 7 3182 1 1 5 TYR HH H -9.034 6.574 -4.389 1.00 . A A . 5 TYR HH 1 1 7 3183 1 1 5 TYR N N -6.312 3.031 0.454 1.00 . A A . 5 TYR N 1 1 7 3184 1 1 5 TYR O O -3.987 5.127 2.349 1.00 . A A . 5 TYR O 1 1 7 3185 1 1 5 TYR OH O -9.439 7.010 -3.628 1.00 . A A . 5 TYR OH 1 1 7 3186 1 1 6 GLY C C -2.027 2.298 2.634 1.00 . A A . 6 GLY C 1 1 7 3187 1 1 6 GLY CA C -3.312 2.705 3.315 1.00 . A A . 6 GLY CA 1 1 7 3188 1 1 6 GLY H H -4.877 2.183 1.995 1.00 . A A . 6 GLY H 1 1 7 3189 1 1 6 GLY HA2 H -3.150 3.614 3.878 1.00 . A A . 6 GLY HA2 1 1 7 3190 1 1 6 GLY HA3 H -3.618 1.916 3.985 1.00 . A A . 6 GLY HA3 1 1 7 3191 1 1 6 GLY N N -4.346 2.932 2.335 1.00 . A A . 6 GLY N 1 1 7 3192 1 1 6 GLY O O -2.033 2.031 1.414 1.00 . A A . 6 GLY O 1 1 7 3193 1 1 7 GLN C C 0.446 0.332 2.824 1.00 . A A . 7 GLN C 1 1 7 3194 1 1 7 GLN CA C 0.335 1.847 2.828 1.00 . A A . 7 GLN CA 1 1 7 3195 1 1 7 GLN CB C 1.494 2.499 3.610 1.00 . A A . 7 GLN CB 1 1 7 3196 1 1 7 GLN CD C 3.995 2.864 3.881 1.00 . A A . 7 GLN CD 1 1 7 3197 1 1 7 GLN CG C 2.904 2.116 3.129 1.00 . A A . 7 GLN CG 1 1 7 3198 1 1 7 GLN H H -1.010 2.402 4.346 1.00 . A A . 7 GLN H 1 1 7 3199 1 1 7 GLN HA H 0.362 2.185 1.803 1.00 . A A . 7 GLN HA 1 1 7 3200 1 1 7 GLN HB2 H 1.402 3.574 3.536 1.00 . A A . 7 GLN HB2 1 1 7 3201 1 1 7 GLN HB3 H 1.405 2.217 4.648 1.00 . A A . 7 GLN HB3 1 1 7 3202 1 1 7 GLN HE21 H 5.283 2.765 2.338 1.00 . A A . 7 GLN HE21 1 1 7 3203 1 1 7 GLN HE22 H 5.846 3.540 3.747 1.00 . A A . 7 GLN HE22 1 1 7 3204 1 1 7 GLN HG2 H 3.045 1.058 3.297 1.00 . A A . 7 GLN HG2 1 1 7 3205 1 1 7 GLN HG3 H 2.993 2.324 2.073 1.00 . A A . 7 GLN HG3 1 1 7 3206 1 1 7 GLN N N -0.945 2.232 3.380 1.00 . A A . 7 GLN N 1 1 7 3207 1 1 7 GLN NE2 N 5.133 3.073 3.256 1.00 . A A . 7 GLN NE2 1 1 7 3208 1 1 7 GLN O O 0.353 -0.303 3.864 1.00 . A A . 7 GLN O 1 1 7 3209 1 1 7 GLN OE1 O 3.819 3.240 5.036 1.00 . A A . 7 GLN OE1 1 1 7 3210 1 1 8 CYS C C 2.066 -2.213 1.784 1.00 . A A . 8 CYS C 1 1 7 3211 1 1 8 CYS CA C 0.692 -1.664 1.465 1.00 . A A . 8 CYS CA 1 1 7 3212 1 1 8 CYS CB C 0.293 -2.018 0.039 1.00 . A A . 8 CYS CB 1 1 7 3213 1 1 8 CYS H H 0.703 0.356 0.860 1.00 . A A . 8 CYS H 1 1 7 3214 1 1 8 CYS HA H -0.021 -2.124 2.135 1.00 . A A . 8 CYS HA 1 1 7 3215 1 1 8 CYS HB2 H 0.618 -3.023 -0.180 1.00 . A A . 8 CYS HB2 1 1 7 3216 1 1 8 CYS HB3 H -0.781 -1.960 -0.058 1.00 . A A . 8 CYS HB3 1 1 7 3217 1 1 8 CYS N N 0.618 -0.223 1.649 1.00 . A A . 8 CYS N 1 1 7 3218 1 1 8 CYS O O 2.205 -3.155 2.542 1.00 . A A . 8 CYS O 1 1 7 3219 1 1 8 CYS SG S 1.023 -0.908 -1.223 1.00 . A A . 8 CYS SG 1 1 7 3220 1 1 9 GLY C C 5.408 -1.389 0.676 1.00 . A A . 9 GLY C 1 1 7 3221 1 1 9 GLY CA C 4.388 -2.128 1.454 1.00 . A A . 9 GLY CA 1 1 7 3222 1 1 9 GLY H H 2.932 -0.871 0.617 1.00 . A A . 9 GLY H 1 1 7 3223 1 1 9 GLY HA2 H 4.617 -2.037 2.504 1.00 . A A . 9 GLY HA2 1 1 7 3224 1 1 9 GLY HA3 H 4.417 -3.171 1.176 1.00 . A A . 9 GLY HA3 1 1 7 3225 1 1 9 GLY N N 3.079 -1.629 1.219 1.00 . A A . 9 GLY N 1 1 7 3226 1 1 9 GLY O O 5.716 -1.745 -0.451 1.00 . A A . 9 GLY O 1 1 7 3227 1 1 10 GLY C C 8.173 0.233 1.500 1.00 . A A . 10 GLY C 1 1 7 3228 1 1 10 GLY CA C 6.948 0.419 0.664 1.00 . A A . 10 GLY CA 1 1 7 3229 1 1 10 GLY H H 5.524 -0.054 2.116 1.00 . A A . 10 GLY H 1 1 7 3230 1 1 10 GLY HA2 H 7.125 0.063 -0.340 1.00 . A A . 10 GLY HA2 1 1 7 3231 1 1 10 GLY HA3 H 6.691 1.467 0.646 1.00 . A A . 10 GLY HA3 1 1 7 3232 1 1 10 GLY N N 5.881 -0.329 1.250 1.00 . A A . 10 GLY N 1 1 7 3233 1 1 10 GLY O O 8.132 -0.536 2.482 1.00 . A A . 10 GLY O 1 1 7 3234 1 1 11 ILE C C 10.220 1.388 3.341 1.00 . A A . 11 ILE C 1 1 7 3235 1 1 11 ILE CA C 10.464 0.813 1.936 1.00 . A A . 11 ILE CA 1 1 7 3236 1 1 11 ILE CB C 11.635 1.574 1.252 1.00 . A A . 11 ILE CB 1 1 7 3237 1 1 11 ILE CD1 C 12.884 1.847 -0.968 1.00 . A A . 11 ILE CD1 1 1 7 3238 1 1 11 ILE CG1 C 11.836 1.074 -0.187 1.00 . A A . 11 ILE CG1 1 1 7 3239 1 1 11 ILE CG2 C 12.928 1.392 2.057 1.00 . A A . 11 ILE CG2 1 1 7 3240 1 1 11 ILE H H 9.210 1.479 0.371 1.00 . A A . 11 ILE H 1 1 7 3241 1 1 11 ILE HA H 10.719 -0.233 2.028 1.00 . A A . 11 ILE HA 1 1 7 3242 1 1 11 ILE HB H 11.394 2.626 1.229 1.00 . A A . 11 ILE HB 1 1 7 3243 1 1 11 ILE HD11 H 13.833 1.787 -0.454 1.00 . A A . 11 ILE HD11 1 1 7 3244 1 1 11 ILE HD12 H 12.584 2.881 -1.048 1.00 . A A . 11 ILE HD12 1 1 7 3245 1 1 11 ILE HD13 H 12.983 1.426 -1.957 1.00 . A A . 11 ILE HD13 1 1 7 3246 1 1 11 ILE HG12 H 12.143 0.040 -0.164 1.00 . A A . 11 ILE HG12 1 1 7 3247 1 1 11 ILE HG13 H 10.901 1.151 -0.721 1.00 . A A . 11 ILE HG13 1 1 7 3248 1 1 11 ILE HG21 H 13.731 1.933 1.578 1.00 . A A . 11 ILE HG21 1 1 7 3249 1 1 11 ILE HG22 H 13.177 0.342 2.099 1.00 . A A . 11 ILE HG22 1 1 7 3250 1 1 11 ILE HG23 H 12.783 1.770 3.058 1.00 . A A . 11 ILE HG23 1 1 7 3251 1 1 11 ILE N N 9.240 0.903 1.163 1.00 . A A . 11 ILE N 1 1 7 3252 1 1 11 ILE O O 9.696 2.497 3.488 1.00 . A A . 11 ILE O 1 1 7 3253 1 1 12 GLY C C 9.077 0.453 6.330 1.00 . A A . 12 GLY C 1 1 7 3254 1 1 12 GLY CA C 10.346 1.019 5.716 1.00 . A A . 12 GLY CA 1 1 7 3255 1 1 12 GLY H H 10.893 -0.288 4.150 1.00 . A A . 12 GLY H 1 1 7 3256 1 1 12 GLY HA2 H 11.195 0.692 6.298 1.00 . A A . 12 GLY HA2 1 1 7 3257 1 1 12 GLY HA3 H 10.294 2.097 5.747 1.00 . A A . 12 GLY HA3 1 1 7 3258 1 1 12 GLY N N 10.526 0.600 4.344 1.00 . A A . 12 GLY N 1 1 7 3259 1 1 12 GLY O O 8.866 0.538 7.549 1.00 . A A . 12 GLY O 1 1 7 3260 1 1 13 TYR C C 7.058 -2.200 5.930 1.00 . A A . 13 TYR C 1 1 7 3261 1 1 13 TYR CA C 6.979 -0.684 5.954 1.00 . A A . 13 TYR CA 1 1 7 3262 1 1 13 TYR CB C 5.824 -0.200 5.045 1.00 . A A . 13 TYR CB 1 1 7 3263 1 1 13 TYR CD1 C 3.602 0.218 6.201 1.00 . A A . 13 TYR CD1 1 1 7 3264 1 1 13 TYR CD2 C 3.920 -1.896 5.155 1.00 . A A . 13 TYR CD2 1 1 7 3265 1 1 13 TYR CE1 C 2.336 -0.163 6.587 1.00 . A A . 13 TYR CE1 1 1 7 3266 1 1 13 TYR CE2 C 2.655 -2.284 5.544 1.00 . A A . 13 TYR CE2 1 1 7 3267 1 1 13 TYR CG C 4.421 -0.636 5.477 1.00 . A A . 13 TYR CG 1 1 7 3268 1 1 13 TYR CZ C 1.868 -1.413 6.256 1.00 . A A . 13 TYR CZ 1 1 7 3269 1 1 13 TYR H H 8.474 -0.200 4.550 1.00 . A A . 13 TYR H 1 1 7 3270 1 1 13 TYR HA H 6.800 -0.344 6.962 1.00 . A A . 13 TYR HA 1 1 7 3271 1 1 13 TYR HB2 H 5.830 0.879 5.013 1.00 . A A . 13 TYR HB2 1 1 7 3272 1 1 13 TYR HB3 H 5.994 -0.578 4.047 1.00 . A A . 13 TYR HB3 1 1 7 3273 1 1 13 TYR HD1 H 3.968 1.199 6.463 1.00 . A A . 13 TYR HD1 1 1 7 3274 1 1 13 TYR HD2 H 4.541 -2.579 4.595 1.00 . A A . 13 TYR HD2 1 1 7 3275 1 1 13 TYR HE1 H 1.715 0.519 7.148 1.00 . A A . 13 TYR HE1 1 1 7 3276 1 1 13 TYR HE2 H 2.289 -3.266 5.284 1.00 . A A . 13 TYR HE2 1 1 7 3277 1 1 13 TYR HH H 0.017 -1.167 6.183 1.00 . A A . 13 TYR HH 1 1 7 3278 1 1 13 TYR N N 8.237 -0.129 5.502 1.00 . A A . 13 TYR N 1 1 7 3279 1 1 13 TYR O O 7.673 -2.786 5.031 1.00 . A A . 13 TYR O 1 1 7 3280 1 1 13 TYR OH O 0.599 -1.790 6.639 1.00 . A A . 13 TYR OH 1 1 7 3281 1 1 14 SER C C 5.014 -4.566 7.573 1.00 . A A . 14 SER C 1 1 7 3282 1 1 14 SER CA C 6.357 -4.250 6.949 1.00 . A A . 14 SER CA 1 1 7 3283 1 1 14 SER CB C 7.520 -4.831 7.767 1.00 . A A . 14 SER CB 1 1 7 3284 1 1 14 SER H H 6.030 -2.320 7.624 1.00 . A A . 14 SER H 1 1 7 3285 1 1 14 SER HA H 6.385 -4.631 5.938 1.00 . A A . 14 SER HA 1 1 7 3286 1 1 14 SER HB2 H 7.473 -5.910 7.736 1.00 . A A . 14 SER HB2 1 1 7 3287 1 1 14 SER HB3 H 8.453 -4.497 7.336 1.00 . A A . 14 SER HB3 1 1 7 3288 1 1 14 SER N N 6.458 -2.821 6.896 1.00 . A A . 14 SER N 1 1 7 3289 1 1 14 SER O O 4.571 -3.836 8.476 1.00 . A A . 14 SER O 1 1 7 3290 1 1 14 SER OG O 7.453 -4.395 9.144 1.00 . A A . 14 SER OG 1 1 7 3291 1 1 15 GLY C C 2.174 -6.512 6.540 1.00 . A A . 15 GLY C 1 1 7 3292 1 1 15 GLY CA C 3.044 -5.897 7.600 1.00 . A A . 15 GLY CA 1 1 7 3293 1 1 15 GLY H H 4.684 -6.098 6.328 1.00 . A A . 15 GLY H 1 1 7 3294 1 1 15 GLY HA2 H 3.162 -6.593 8.417 1.00 . A A . 15 GLY HA2 1 1 7 3295 1 1 15 GLY HA3 H 2.580 -4.992 7.959 1.00 . A A . 15 GLY HA3 1 1 7 3296 1 1 15 GLY N N 4.334 -5.561 7.073 1.00 . A A . 15 GLY N 1 1 7 3297 1 1 15 GLY O O 2.648 -7.377 5.796 1.00 . A A . 15 GLY O 1 1 7 3298 1 1 16 PRO C C 0.246 -5.948 4.086 1.00 . A A . 16 PRO C 1 1 7 3299 1 1 16 PRO CA C 0.011 -6.615 5.426 1.00 . A A . 16 PRO CA 1 1 7 3300 1 1 16 PRO CB C -1.391 -6.273 5.952 1.00 . A A . 16 PRO CB 1 1 7 3301 1 1 16 PRO CD C 0.261 -5.066 7.239 1.00 . A A . 16 PRO CD 1 1 7 3302 1 1 16 PRO CG C -1.186 -5.457 7.192 1.00 . A A . 16 PRO CG 1 1 7 3303 1 1 16 PRO HA H 0.117 -7.685 5.332 1.00 . A A . 16 PRO HA 1 1 7 3304 1 1 16 PRO HB2 H -1.931 -5.719 5.200 1.00 . A A . 16 PRO HB2 1 1 7 3305 1 1 16 PRO HB3 H -1.928 -7.183 6.171 1.00 . A A . 16 PRO HB3 1 1 7 3306 1 1 16 PRO HD2 H 0.400 -4.084 6.810 1.00 . A A . 16 PRO HD2 1 1 7 3307 1 1 16 PRO HD3 H 0.612 -5.093 8.260 1.00 . A A . 16 PRO HD3 1 1 7 3308 1 1 16 PRO HG2 H -1.811 -4.577 7.163 1.00 . A A . 16 PRO HG2 1 1 7 3309 1 1 16 PRO HG3 H -1.435 -6.063 8.047 1.00 . A A . 16 PRO HG3 1 1 7 3310 1 1 16 PRO N N 0.911 -6.092 6.426 1.00 . A A . 16 PRO N 1 1 7 3311 1 1 16 PRO O O -0.223 -4.843 3.843 1.00 . A A . 16 PRO O 1 1 7 3312 1 1 17 THR C C 0.215 -6.325 0.948 1.00 . A A . 17 THR C 1 1 7 3313 1 1 17 THR CA C 1.331 -6.062 1.957 1.00 . A A . 17 THR CA 1 1 7 3314 1 1 17 THR CB C 2.677 -6.626 1.469 1.00 . A A . 17 THR CB 1 1 7 3315 1 1 17 THR CG2 C 3.805 -6.112 2.354 1.00 . A A . 17 THR CG2 1 1 7 3316 1 1 17 THR H H 1.393 -7.457 3.513 1.00 . A A . 17 THR H 1 1 7 3317 1 1 17 THR HA H 1.434 -4.992 2.070 1.00 . A A . 17 THR HA 1 1 7 3318 1 1 17 THR HB H 2.851 -6.303 0.453 1.00 . A A . 17 THR HB 1 1 7 3319 1 1 17 THR HG1 H 3.270 -8.404 0.861 1.00 . A A . 17 THR HG1 1 1 7 3320 1 1 17 THR HG21 H 3.837 -5.034 2.303 1.00 . A A . 17 THR HG21 1 1 7 3321 1 1 17 THR HG22 H 4.748 -6.523 2.028 1.00 . A A . 17 THR HG22 1 1 7 3322 1 1 17 THR HG23 H 3.616 -6.413 3.374 1.00 . A A . 17 THR HG23 1 1 7 3323 1 1 17 THR N N 1.006 -6.595 3.251 1.00 . A A . 17 THR N 1 1 7 3324 1 1 17 THR O O 0.118 -5.659 -0.093 1.00 . A A . 17 THR O 1 1 7 3325 1 1 17 THR OG1 O 2.652 -8.070 1.526 1.00 . A A . 17 THR OG1 1 1 7 3326 1 1 18 VAL C C -2.896 -6.642 0.708 1.00 . A A . 18 VAL C 1 1 7 3327 1 1 18 VAL CA C -1.756 -7.612 0.423 1.00 . A A . 18 VAL CA 1 1 7 3328 1 1 18 VAL CB C -2.238 -9.076 0.637 1.00 . A A . 18 VAL CB 1 1 7 3329 1 1 18 VAL CG1 C -3.407 -9.413 -0.286 1.00 . A A . 18 VAL CG1 1 1 7 3330 1 1 18 VAL CG2 C -1.092 -10.059 0.417 1.00 . A A . 18 VAL CG2 1 1 7 3331 1 1 18 VAL H H -0.492 -7.770 2.103 1.00 . A A . 18 VAL H 1 1 7 3332 1 1 18 VAL HA H -1.445 -7.490 -0.605 1.00 . A A . 18 VAL HA 1 1 7 3333 1 1 18 VAL HB H -2.580 -9.173 1.656 1.00 . A A . 18 VAL HB 1 1 7 3334 1 1 18 VAL HG11 H -4.225 -8.737 -0.088 1.00 . A A . 18 VAL HG11 1 1 7 3335 1 1 18 VAL HG12 H -3.726 -10.428 -0.104 1.00 . A A . 18 VAL HG12 1 1 7 3336 1 1 18 VAL HG13 H -3.093 -9.311 -1.314 1.00 . A A . 18 VAL HG13 1 1 7 3337 1 1 18 VAL HG21 H -0.724 -9.963 -0.593 1.00 . A A . 18 VAL HG21 1 1 7 3338 1 1 18 VAL HG22 H -1.448 -11.066 0.579 1.00 . A A . 18 VAL HG22 1 1 7 3339 1 1 18 VAL HG23 H -0.295 -9.844 1.114 1.00 . A A . 18 VAL HG23 1 1 7 3340 1 1 18 VAL N N -0.633 -7.284 1.265 1.00 . A A . 18 VAL N 1 1 7 3341 1 1 18 VAL O O -3.359 -6.515 1.862 1.00 . A A . 18 VAL O 1 1 7 3342 1 1 19 CYS C C -5.718 -5.709 -0.362 1.00 . A A . 19 CYS C 1 1 7 3343 1 1 19 CYS CA C -4.390 -4.999 -0.218 1.00 . A A . 19 CYS CA 1 1 7 3344 1 1 19 CYS CB C -4.252 -3.951 -1.320 1.00 . A A . 19 CYS CB 1 1 7 3345 1 1 19 CYS H H -2.925 -6.108 -1.198 1.00 . A A . 19 CYS H 1 1 7 3346 1 1 19 CYS HA H -4.337 -4.510 0.743 1.00 . A A . 19 CYS HA 1 1 7 3347 1 1 19 CYS HB2 H -4.383 -4.425 -2.282 1.00 . A A . 19 CYS HB2 1 1 7 3348 1 1 19 CYS HB3 H -5.029 -3.211 -1.190 1.00 . A A . 19 CYS HB3 1 1 7 3349 1 1 19 CYS N N -3.324 -5.958 -0.317 1.00 . A A . 19 CYS N 1 1 7 3350 1 1 19 CYS O O -5.762 -6.866 -0.813 1.00 . A A . 19 CYS O 1 1 7 3351 1 1 19 CYS SG S -2.654 -3.083 -1.339 1.00 . A A . 19 CYS SG 1 1 7 3352 1 1 20 ALA C C -8.448 -5.825 -1.564 1.00 . A A . 20 ALA C 1 1 7 3353 1 1 20 ALA CA C -8.118 -5.595 -0.096 1.00 . A A . 20 ALA CA 1 1 7 3354 1 1 20 ALA CB C -9.136 -4.661 0.533 1.00 . A A . 20 ALA CB 1 1 7 3355 1 1 20 ALA H H -6.664 -4.156 0.431 1.00 . A A . 20 ALA H 1 1 7 3356 1 1 20 ALA HA H -8.138 -6.537 0.428 1.00 . A A . 20 ALA HA 1 1 7 3357 1 1 20 ALA HB1 H -8.903 -4.518 1.578 1.00 . A A . 20 ALA HB1 1 1 7 3358 1 1 20 ALA HB2 H -10.121 -5.092 0.432 1.00 . A A . 20 ALA HB2 1 1 7 3359 1 1 20 ALA HB3 H -9.111 -3.709 0.023 1.00 . A A . 20 ALA HB3 1 1 7 3360 1 1 20 ALA N N -6.785 -5.045 0.030 1.00 . A A . 20 ALA N 1 1 7 3361 1 1 20 ALA O O -7.913 -5.118 -2.451 1.00 . A A . 20 ALA O 1 1 7 3362 1 1 21 SER C C -10.315 -5.913 -3.844 1.00 . A A . 21 SER C 1 1 7 3363 1 1 21 SER CA C -9.682 -7.123 -3.171 1.00 . A A . 21 SER CA 1 1 7 3364 1 1 21 SER CB C -10.609 -8.340 -3.155 1.00 . A A . 21 SER CB 1 1 7 3365 1 1 21 SER H H -9.660 -7.341 -1.101 1.00 . A A . 21 SER H 1 1 7 3366 1 1 21 SER HA H -8.785 -7.379 -3.714 1.00 . A A . 21 SER HA 1 1 7 3367 1 1 21 SER HB2 H -11.141 -8.394 -4.093 1.00 . A A . 21 SER HB2 1 1 7 3368 1 1 21 SER HB3 H -10.020 -9.235 -3.013 1.00 . A A . 21 SER HB3 1 1 7 3369 1 1 21 SER HG H -12.117 -7.469 -2.245 1.00 . A A . 21 SER HG 1 1 7 3370 1 1 21 SER N N -9.281 -6.805 -1.832 1.00 . A A . 21 SER N 1 1 7 3371 1 1 21 SER O O -11.252 -5.295 -3.306 1.00 . A A . 21 SER O 1 1 7 3372 1 1 21 SER OG O -11.560 -8.245 -2.097 1.00 . A A . 21 SER OG 1 1 7 3373 1 1 22 GLY C C -9.242 -3.235 -5.599 1.00 . A A . 22 GLY C 1 1 7 3374 1 1 22 GLY CA C -10.226 -4.375 -5.674 1.00 . A A . 22 GLY CA 1 1 7 3375 1 1 22 GLY H H -8.981 -6.033 -5.311 1.00 . A A . 22 GLY H 1 1 7 3376 1 1 22 GLY HA2 H -10.381 -4.642 -6.708 1.00 . A A . 22 GLY HA2 1 1 7 3377 1 1 22 GLY HA3 H -11.164 -4.055 -5.244 1.00 . A A . 22 GLY HA3 1 1 7 3378 1 1 22 GLY N N -9.748 -5.527 -4.961 1.00 . A A . 22 GLY N 1 1 7 3379 1 1 22 GLY O O -9.271 -2.324 -6.413 1.00 . A A . 22 GLY O 1 1 7 3380 1 1 23 THR C C -5.996 -2.824 -4.816 1.00 . A A . 23 THR C 1 1 7 3381 1 1 23 THR CA C -7.363 -2.255 -4.476 1.00 . A A . 23 THR CA 1 1 7 3382 1 1 23 THR CB C -7.376 -1.645 -3.045 1.00 . A A . 23 THR CB 1 1 7 3383 1 1 23 THR CG2 C -8.761 -1.123 -2.720 1.00 . A A . 23 THR CG2 1 1 7 3384 1 1 23 THR H H -8.371 -4.045 -4.005 1.00 . A A . 23 THR H 1 1 7 3385 1 1 23 THR HA H -7.590 -1.477 -5.192 1.00 . A A . 23 THR HA 1 1 7 3386 1 1 23 THR HB H -6.680 -0.821 -2.996 1.00 . A A . 23 THR HB 1 1 7 3387 1 1 23 THR HG1 H -7.319 -3.497 -2.364 1.00 . A A . 23 THR HG1 1 1 7 3388 1 1 23 THR HG21 H -8.768 -0.711 -1.723 1.00 . A A . 23 THR HG21 1 1 7 3389 1 1 23 THR HG22 H -9.465 -1.939 -2.778 1.00 . A A . 23 THR HG22 1 1 7 3390 1 1 23 THR HG23 H -9.032 -0.357 -3.432 1.00 . A A . 23 THR HG23 1 1 7 3391 1 1 23 THR N N -8.360 -3.285 -4.628 1.00 . A A . 23 THR N 1 1 7 3392 1 1 23 THR O O -5.723 -3.997 -4.534 1.00 . A A . 23 THR O 1 1 7 3393 1 1 23 THR OG1 O -7.026 -2.624 -2.065 1.00 . A A . 23 THR OG1 1 1 7 3394 1 1 24 THR C C -2.768 -1.719 -5.156 1.00 . A A . 24 THR C 1 1 7 3395 1 1 24 THR CA C -3.874 -2.482 -5.865 1.00 . A A . 24 THR CA 1 1 7 3396 1 1 24 THR CB C -3.740 -2.338 -7.403 1.00 . A A . 24 THR CB 1 1 7 3397 1 1 24 THR CG2 C -4.569 -3.395 -8.117 1.00 . A A . 24 THR CG2 1 1 7 3398 1 1 24 THR H H -5.422 -1.098 -5.611 1.00 . A A . 24 THR H 1 1 7 3399 1 1 24 THR HA H -3.790 -3.530 -5.619 1.00 . A A . 24 THR HA 1 1 7 3400 1 1 24 THR HB H -2.700 -2.471 -7.663 1.00 . A A . 24 THR HB 1 1 7 3401 1 1 24 THR HG1 H -4.802 -0.634 -7.210 1.00 . A A . 24 THR HG1 1 1 7 3402 1 1 24 THR HG21 H -5.606 -3.287 -7.835 1.00 . A A . 24 THR HG21 1 1 7 3403 1 1 24 THR HG22 H -4.218 -4.377 -7.840 1.00 . A A . 24 THR HG22 1 1 7 3404 1 1 24 THR HG23 H -4.471 -3.269 -9.185 1.00 . A A . 24 THR HG23 1 1 7 3405 1 1 24 THR N N -5.168 -2.037 -5.435 1.00 . A A . 24 THR N 1 1 7 3406 1 1 24 THR O O -2.905 -0.527 -4.908 1.00 . A A . 24 THR O 1 1 7 3407 1 1 24 THR OG1 O -4.163 -1.009 -7.839 1.00 . A A . 24 THR OG1 1 1 7 3408 1 1 25 CYS C C 0.195 -0.981 -5.190 1.00 . A A . 25 CYS C 1 1 7 3409 1 1 25 CYS CA C -0.576 -1.777 -4.155 1.00 . A A . 25 CYS CA 1 1 7 3410 1 1 25 CYS CB C 0.329 -2.831 -3.487 1.00 . A A . 25 CYS CB 1 1 7 3411 1 1 25 CYS H H -1.663 -3.366 -5.000 1.00 . A A . 25 CYS H 1 1 7 3412 1 1 25 CYS HA H -0.953 -1.099 -3.405 1.00 . A A . 25 CYS HA 1 1 7 3413 1 1 25 CYS HB2 H -0.253 -3.371 -2.755 1.00 . A A . 25 CYS HB2 1 1 7 3414 1 1 25 CYS HB3 H 0.680 -3.521 -4.240 1.00 . A A . 25 CYS HB3 1 1 7 3415 1 1 25 CYS N N -1.705 -2.405 -4.803 1.00 . A A . 25 CYS N 1 1 7 3416 1 1 25 CYS O O 0.855 -1.550 -6.073 1.00 . A A . 25 CYS O 1 1 7 3417 1 1 25 CYS SG S 1.796 -2.158 -2.620 1.00 . A A . 25 CYS SG 1 1 7 3418 1 1 26 GLN C C 1.776 1.975 -5.412 1.00 . A A . 26 GLN C 1 1 7 3419 1 1 26 GLN CA C 0.697 1.171 -6.080 1.00 . A A . 26 GLN CA 1 1 7 3420 1 1 26 GLN CB C -0.302 2.066 -6.807 1.00 . A A . 26 GLN CB 1 1 7 3421 1 1 26 GLN CD C -2.202 2.177 -8.473 1.00 . A A . 26 GLN CD 1 1 7 3422 1 1 26 GLN CG C -1.308 1.289 -7.642 1.00 . A A . 26 GLN CG 1 1 7 3423 1 1 26 GLN H H -0.522 0.729 -4.453 1.00 . A A . 26 GLN H 1 1 7 3424 1 1 26 GLN HA H 1.165 0.525 -6.806 1.00 . A A . 26 GLN HA 1 1 7 3425 1 1 26 GLN HB2 H -0.843 2.643 -6.073 1.00 . A A . 26 GLN HB2 1 1 7 3426 1 1 26 GLN HB3 H 0.236 2.740 -7.455 1.00 . A A . 26 GLN HB3 1 1 7 3427 1 1 26 GLN HE21 H -3.660 0.863 -8.312 1.00 . A A . 26 GLN HE21 1 1 7 3428 1 1 26 GLN HE22 H -4.028 2.286 -9.220 1.00 . A A . 26 GLN HE22 1 1 7 3429 1 1 26 GLN HG2 H -0.774 0.628 -8.308 1.00 . A A . 26 GLN HG2 1 1 7 3430 1 1 26 GLN HG3 H -1.925 0.700 -6.979 1.00 . A A . 26 GLN HG3 1 1 7 3431 1 1 26 GLN N N 0.047 0.317 -5.145 1.00 . A A . 26 GLN N 1 1 7 3432 1 1 26 GLN NE2 N -3.413 1.734 -8.696 1.00 . A A . 26 GLN NE2 1 1 7 3433 1 1 26 GLN O O 1.550 2.622 -4.384 1.00 . A A . 26 GLN O 1 1 7 3434 1 1 26 GLN OE1 O -1.804 3.264 -8.914 1.00 . A A . 26 GLN OE1 1 1 7 3435 1 1 27 VAL C C 4.005 4.064 -5.934 1.00 . A A . 27 VAL C 1 1 7 3436 1 1 27 VAL CA C 4.083 2.621 -5.462 1.00 . A A . 27 VAL CA 1 1 7 3437 1 1 27 VAL CB C 5.405 1.964 -5.944 1.00 . A A . 27 VAL CB 1 1 7 3438 1 1 27 VAL CG1 C 6.622 2.661 -5.360 1.00 . A A . 27 VAL CG1 1 1 7 3439 1 1 27 VAL CG2 C 5.419 0.483 -5.593 1.00 . A A . 27 VAL CG2 1 1 7 3440 1 1 27 VAL H H 3.036 1.388 -6.798 1.00 . A A . 27 VAL H 1 1 7 3441 1 1 27 VAL HA H 4.039 2.589 -4.383 1.00 . A A . 27 VAL HA 1 1 7 3442 1 1 27 VAL HB H 5.454 2.054 -7.019 1.00 . A A . 27 VAL HB 1 1 7 3443 1 1 27 VAL HG11 H 6.618 3.699 -5.657 1.00 . A A . 27 VAL HG11 1 1 7 3444 1 1 27 VAL HG12 H 7.522 2.186 -5.722 1.00 . A A . 27 VAL HG12 1 1 7 3445 1 1 27 VAL HG13 H 6.587 2.596 -4.282 1.00 . A A . 27 VAL HG13 1 1 7 3446 1 1 27 VAL HG21 H 5.325 0.366 -4.524 1.00 . A A . 27 VAL HG21 1 1 7 3447 1 1 27 VAL HG22 H 6.350 0.045 -5.923 1.00 . A A . 27 VAL HG22 1 1 7 3448 1 1 27 VAL HG23 H 4.592 -0.008 -6.084 1.00 . A A . 27 VAL HG23 1 1 7 3449 1 1 27 VAL N N 2.943 1.916 -5.978 1.00 . A A . 27 VAL N 1 1 7 3450 1 1 27 VAL O O 4.142 4.344 -7.127 1.00 . A A . 27 VAL O 1 1 7 3451 1 1 28 LEU C C 4.922 7.040 -5.256 1.00 . A A . 28 LEU C 1 1 7 3452 1 1 28 LEU CA C 3.579 6.359 -5.357 1.00 . A A . 28 LEU CA 1 1 7 3453 1 1 28 LEU CB C 2.559 7.033 -4.431 1.00 . A A . 28 LEU CB 1 1 7 3454 1 1 28 LEU CD1 C 0.238 7.207 -3.502 1.00 . A A . 28 LEU CD1 1 1 7 3455 1 1 28 LEU CD2 C 0.561 6.476 -5.847 1.00 . A A . 28 LEU CD2 1 1 7 3456 1 1 28 LEU CG C 1.139 6.450 -4.448 1.00 . A A . 28 LEU CG 1 1 7 3457 1 1 28 LEU H H 3.651 4.665 -4.088 1.00 . A A . 28 LEU H 1 1 7 3458 1 1 28 LEU HA H 3.231 6.423 -6.376 1.00 . A A . 28 LEU HA 1 1 7 3459 1 1 28 LEU HB2 H 2.935 6.968 -3.420 1.00 . A A . 28 LEU HB2 1 1 7 3460 1 1 28 LEU HB3 H 2.497 8.077 -4.702 1.00 . A A . 28 LEU HB3 1 1 7 3461 1 1 28 LEU HD11 H -0.760 6.794 -3.540 1.00 . A A . 28 LEU HD11 1 1 7 3462 1 1 28 LEU HD12 H 0.210 8.250 -3.782 1.00 . A A . 28 LEU HD12 1 1 7 3463 1 1 28 LEU HD13 H 0.628 7.110 -2.500 1.00 . A A . 28 LEU HD13 1 1 7 3464 1 1 28 LEU HD21 H 0.556 7.495 -6.205 1.00 . A A . 28 LEU HD21 1 1 7 3465 1 1 28 LEU HD22 H -0.449 6.096 -5.813 1.00 . A A . 28 LEU HD22 1 1 7 3466 1 1 28 LEU HD23 H 1.160 5.859 -6.498 1.00 . A A . 28 LEU HD23 1 1 7 3467 1 1 28 LEU HG H 1.177 5.423 -4.117 1.00 . A A . 28 LEU HG 1 1 7 3468 1 1 28 LEU N N 3.727 4.958 -5.022 1.00 . A A . 28 LEU N 1 1 7 3469 1 1 28 LEU O O 5.366 7.726 -6.185 1.00 . A A . 28 LEU O 1 1 7 3470 1 1 29 ASN C C 7.777 6.144 -3.648 1.00 . A A . 29 ASN C 1 1 7 3471 1 1 29 ASN CA C 6.896 7.338 -3.891 1.00 . A A . 29 ASN CA 1 1 7 3472 1 1 29 ASN CB C 6.910 8.222 -2.621 1.00 . A A . 29 ASN CB 1 1 7 3473 1 1 29 ASN CG C 5.972 9.409 -2.639 1.00 . A A . 29 ASN CG 1 1 7 3474 1 1 29 ASN H H 5.211 6.160 -3.509 1.00 . A A . 29 ASN H 1 1 7 3475 1 1 29 ASN HA H 7.234 7.897 -4.750 1.00 . A A . 29 ASN HA 1 1 7 3476 1 1 29 ASN HB2 H 6.680 7.619 -1.756 1.00 . A A . 29 ASN HB2 1 1 7 3477 1 1 29 ASN HB3 H 7.918 8.596 -2.516 1.00 . A A . 29 ASN HB3 1 1 7 3478 1 1 29 ASN HD21 H 5.880 9.383 -0.663 1.00 . A A . 29 ASN HD21 1 1 7 3479 1 1 29 ASN HD22 H 4.938 10.597 -1.435 1.00 . A A . 29 ASN HD22 1 1 7 3480 1 1 29 ASN N N 5.583 6.796 -4.159 1.00 . A A . 29 ASN N 1 1 7 3481 1 1 29 ASN ND2 N 5.558 9.839 -1.469 1.00 . A A . 29 ASN ND2 1 1 7 3482 1 1 29 ASN O O 7.247 5.072 -3.415 1.00 . A A . 29 ASN O 1 1 7 3483 1 1 29 ASN OD1 O 5.656 9.964 -3.687 1.00 . A A . 29 ASN OD1 1 1 7 3484 1 1 30 PRO C C 9.739 4.399 -2.133 1.00 . A A . 30 PRO C 1 1 7 3485 1 1 30 PRO CA C 10.030 5.148 -3.442 1.00 . A A . 30 PRO CA 1 1 7 3486 1 1 30 PRO CB C 11.400 5.820 -3.380 1.00 . A A . 30 PRO CB 1 1 7 3487 1 1 30 PRO CD C 9.871 7.523 -3.981 1.00 . A A . 30 PRO CD 1 1 7 3488 1 1 30 PRO CG C 11.251 7.008 -4.253 1.00 . A A . 30 PRO CG 1 1 7 3489 1 1 30 PRO HA H 10.006 4.445 -4.260 1.00 . A A . 30 PRO HA 1 1 7 3490 1 1 30 PRO HB2 H 11.620 6.097 -2.359 1.00 . A A . 30 PRO HB2 1 1 7 3491 1 1 30 PRO HB3 H 12.155 5.146 -3.752 1.00 . A A . 30 PRO HB3 1 1 7 3492 1 1 30 PRO HD2 H 9.885 8.186 -3.131 1.00 . A A . 30 PRO HD2 1 1 7 3493 1 1 30 PRO HD3 H 9.458 8.018 -4.846 1.00 . A A . 30 PRO HD3 1 1 7 3494 1 1 30 PRO HG2 H 11.994 7.749 -3.996 1.00 . A A . 30 PRO HG2 1 1 7 3495 1 1 30 PRO HG3 H 11.344 6.720 -5.289 1.00 . A A . 30 PRO HG3 1 1 7 3496 1 1 30 PRO N N 9.116 6.282 -3.675 1.00 . A A . 30 PRO N 1 1 7 3497 1 1 30 PRO O O 9.859 3.174 -2.064 1.00 . A A . 30 PRO O 1 1 7 3498 1 1 31 TYR C C 7.541 4.384 0.383 1.00 . A A . 31 TYR C 1 1 7 3499 1 1 31 TYR CA C 9.059 4.502 0.170 1.00 . A A . 31 TYR CA 1 1 7 3500 1 1 31 TYR CB C 9.664 5.343 1.318 1.00 . A A . 31 TYR CB 1 1 7 3501 1 1 31 TYR CD1 C 12.045 4.888 2.087 1.00 . A A . 31 TYR CD1 1 1 7 3502 1 1 31 TYR CD2 C 11.725 6.482 0.355 1.00 . A A . 31 TYR CD2 1 1 7 3503 1 1 31 TYR CE1 C 13.414 5.106 2.030 1.00 . A A . 31 TYR CE1 1 1 7 3504 1 1 31 TYR CE2 C 13.081 6.701 0.292 1.00 . A A . 31 TYR CE2 1 1 7 3505 1 1 31 TYR CG C 11.177 5.573 1.250 1.00 . A A . 31 TYR CG 1 1 7 3506 1 1 31 TYR CZ C 13.921 6.016 1.125 1.00 . A A . 31 TYR CZ 1 1 7 3507 1 1 31 TYR H H 9.276 6.100 -1.217 1.00 . A A . 31 TYR H 1 1 7 3508 1 1 31 TYR HA H 9.511 3.522 0.184 1.00 . A A . 31 TYR HA 1 1 7 3509 1 1 31 TYR HB2 H 9.192 6.313 1.318 1.00 . A A . 31 TYR HB2 1 1 7 3510 1 1 31 TYR HB3 H 9.443 4.853 2.255 1.00 . A A . 31 TYR HB3 1 1 7 3511 1 1 31 TYR HD1 H 11.643 4.176 2.793 1.00 . A A . 31 TYR HD1 1 1 7 3512 1 1 31 TYR HD2 H 11.070 7.025 -0.307 1.00 . A A . 31 TYR HD2 1 1 7 3513 1 1 31 TYR HE1 H 14.075 4.565 2.689 1.00 . A A . 31 TYR HE1 1 1 7 3514 1 1 31 TYR HE2 H 13.483 7.410 -0.417 1.00 . A A . 31 TYR HE2 1 1 7 3515 1 1 31 TYR HH H 15.679 5.367 0.952 1.00 . A A . 31 TYR HH 1 1 7 3516 1 1 31 TYR N N 9.347 5.129 -1.106 1.00 . A A . 31 TYR N 1 1 7 3517 1 1 31 TYR O O 7.068 3.510 1.112 1.00 . A A . 31 TYR O 1 1 7 3518 1 1 31 TYR OH O 15.282 6.242 1.059 1.00 . A A . 31 TYR OH 1 1 7 3519 1 1 32 TYR C C 4.609 4.440 -1.134 1.00 . A A . 32 TYR C 1 1 7 3520 1 1 32 TYR CA C 5.342 5.256 -0.068 1.00 . A A . 32 TYR CA 1 1 7 3521 1 1 32 TYR CB C 4.794 6.681 0.013 1.00 . A A . 32 TYR CB 1 1 7 3522 1 1 32 TYR CD1 C 2.360 7.275 -0.396 1.00 . A A . 32 TYR CD1 1 1 7 3523 1 1 32 TYR CD2 C 2.963 6.321 1.704 1.00 . A A . 32 TYR CD2 1 1 7 3524 1 1 32 TYR CE1 C 1.046 7.350 0.023 1.00 . A A . 32 TYR CE1 1 1 7 3525 1 1 32 TYR CE2 C 1.652 6.390 2.117 1.00 . A A . 32 TYR CE2 1 1 7 3526 1 1 32 TYR CG C 3.344 6.761 0.443 1.00 . A A . 32 TYR CG 1 1 7 3527 1 1 32 TYR CZ C 0.704 6.907 1.276 1.00 . A A . 32 TYR CZ 1 1 7 3528 1 1 32 TYR H H 7.199 5.872 -0.886 1.00 . A A . 32 TYR H 1 1 7 3529 1 1 32 TYR HA H 5.159 4.775 0.883 1.00 . A A . 32 TYR HA 1 1 7 3530 1 1 32 TYR HB2 H 5.379 7.250 0.720 1.00 . A A . 32 TYR HB2 1 1 7 3531 1 1 32 TYR HB3 H 4.872 7.142 -0.962 1.00 . A A . 32 TYR HB3 1 1 7 3532 1 1 32 TYR HD1 H 2.621 7.623 -1.386 1.00 . A A . 32 TYR HD1 1 1 7 3533 1 1 32 TYR HD2 H 3.713 5.915 2.366 1.00 . A A . 32 TYR HD2 1 1 7 3534 1 1 32 TYR HE1 H 0.283 7.748 -0.629 1.00 . A A . 32 TYR HE1 1 1 7 3535 1 1 32 TYR HE2 H 1.376 6.043 3.101 1.00 . A A . 32 TYR HE2 1 1 7 3536 1 1 32 TYR HH H -1.166 6.874 0.917 1.00 . A A . 32 TYR HH 1 1 7 3537 1 1 32 TYR N N 6.783 5.256 -0.251 1.00 . A A . 32 TYR N 1 1 7 3538 1 1 32 TYR O O 4.566 4.829 -2.305 1.00 . A A . 32 TYR O 1 1 7 3539 1 1 32 TYR OH O -0.601 6.984 1.691 1.00 . A A . 32 TYR OH 1 1 7 3540 1 1 33 SER C C 1.804 2.464 -0.986 1.00 . A A . 33 SER C 1 1 7 3541 1 1 33 SER CA C 3.194 2.559 -1.595 1.00 . A A . 33 SER CA 1 1 7 3542 1 1 33 SER CB C 3.840 1.182 -1.726 1.00 . A A . 33 SER CB 1 1 7 3543 1 1 33 SER H H 4.050 3.112 0.219 1.00 . A A . 33 SER H 1 1 7 3544 1 1 33 SER HA H 3.132 3.038 -2.560 1.00 . A A . 33 SER HA 1 1 7 3545 1 1 33 SER HB2 H 3.759 0.652 -0.788 1.00 . A A . 33 SER HB2 1 1 7 3546 1 1 33 SER HB3 H 3.338 0.626 -2.504 1.00 . A A . 33 SER HB3 1 1 7 3547 1 1 33 SER HG H 5.462 0.606 -2.673 1.00 . A A . 33 SER HG 1 1 7 3548 1 1 33 SER N N 3.985 3.381 -0.718 1.00 . A A . 33 SER N 1 1 7 3549 1 1 33 SER O O 1.677 2.156 0.192 1.00 . A A . 33 SER O 1 1 7 3550 1 1 33 SER OG O 5.214 1.311 -2.068 1.00 . A A . 33 SER OG 1 1 7 3551 1 1 34 GLN C C -1.514 1.931 -2.055 1.00 . A A . 34 GLN C 1 1 7 3552 1 1 34 GLN CA C -0.565 2.817 -1.255 1.00 . A A . 34 GLN CA 1 1 7 3553 1 1 34 GLN CB C -1.012 4.294 -1.268 1.00 . A A . 34 GLN CB 1 1 7 3554 1 1 34 GLN CD C -2.833 6.002 -1.018 1.00 . A A . 34 GLN CD 1 1 7 3555 1 1 34 GLN CG C -2.496 4.534 -1.055 1.00 . A A . 34 GLN CG 1 1 7 3556 1 1 34 GLN H H 0.937 2.853 -2.726 1.00 . A A . 34 GLN H 1 1 7 3557 1 1 34 GLN HA H -0.555 2.476 -0.231 1.00 . A A . 34 GLN HA 1 1 7 3558 1 1 34 GLN HB2 H -0.487 4.811 -0.478 1.00 . A A . 34 GLN HB2 1 1 7 3559 1 1 34 GLN HB3 H -0.724 4.746 -2.206 1.00 . A A . 34 GLN HB3 1 1 7 3560 1 1 34 GLN HE21 H -2.798 6.018 0.967 1.00 . A A . 34 GLN HE21 1 1 7 3561 1 1 34 GLN HE22 H -3.152 7.515 0.187 1.00 . A A . 34 GLN HE22 1 1 7 3562 1 1 34 GLN HG2 H -3.042 4.074 -1.865 1.00 . A A . 34 GLN HG2 1 1 7 3563 1 1 34 GLN HG3 H -2.785 4.083 -0.117 1.00 . A A . 34 GLN HG3 1 1 7 3564 1 1 34 GLN N N 0.792 2.736 -1.759 1.00 . A A . 34 GLN N 1 1 7 3565 1 1 34 GLN NE2 N -2.931 6.557 0.156 1.00 . A A . 34 GLN NE2 1 1 7 3566 1 1 34 GLN O O -1.356 1.775 -3.258 1.00 . A A . 34 GLN O 1 1 7 3567 1 1 34 GLN OE1 O -3.070 6.615 -2.037 1.00 . A A . 34 GLN OE1 1 1 7 3568 1 1 35 CYS C C -4.525 1.366 -2.648 1.00 . A A . 35 CYS C 1 1 7 3569 1 1 35 CYS CA C -3.455 0.499 -2.007 1.00 . A A . 35 CYS CA 1 1 7 3570 1 1 35 CYS CB C -4.105 -0.438 -1.002 1.00 . A A . 35 CYS CB 1 1 7 3571 1 1 35 CYS H H -2.494 1.411 -0.389 1.00 . A A . 35 CYS H 1 1 7 3572 1 1 35 CYS HA H -2.970 -0.091 -2.770 1.00 . A A . 35 CYS HA 1 1 7 3573 1 1 35 CYS HB2 H -4.669 0.140 -0.287 1.00 . A A . 35 CYS HB2 1 1 7 3574 1 1 35 CYS HB3 H -4.786 -1.073 -1.543 1.00 . A A . 35 CYS HB3 1 1 7 3575 1 1 35 CYS N N -2.465 1.321 -1.366 1.00 . A A . 35 CYS N 1 1 7 3576 1 1 35 CYS O O -5.347 1.991 -1.947 1.00 . A A . 35 CYS O 1 1 7 3577 1 1 35 CYS SG S -2.946 -1.504 -0.102 1.00 . A A . 35 CYS SG 1 1 7 3578 1 1 36 LEU C C -6.343 1.182 -5.426 1.00 . A A . 36 LEU C 1 1 7 3579 1 1 36 LEU CA C -5.441 2.159 -4.728 1.00 . A A . 36 LEU CA 1 1 7 3580 1 1 36 LEU CB C -4.738 3.075 -5.735 1.00 . A A . 36 LEU CB 1 1 7 3581 1 1 36 LEU CD1 C -3.220 5.008 -6.238 1.00 . A A . 36 LEU CD1 1 1 7 3582 1 1 36 LEU CD2 C -4.796 5.142 -4.324 1.00 . A A . 36 LEU CD2 1 1 7 3583 1 1 36 LEU CG C -3.912 4.221 -5.141 1.00 . A A . 36 LEU CG 1 1 7 3584 1 1 36 LEU H H -3.795 0.924 -4.423 1.00 . A A . 36 LEU H 1 1 7 3585 1 1 36 LEU HA H -6.038 2.757 -4.057 1.00 . A A . 36 LEU HA 1 1 7 3586 1 1 36 LEU HB2 H -4.082 2.462 -6.336 1.00 . A A . 36 LEU HB2 1 1 7 3587 1 1 36 LEU HB3 H -5.492 3.502 -6.381 1.00 . A A . 36 LEU HB3 1 1 7 3588 1 1 36 LEU HD11 H -2.554 4.356 -6.785 1.00 . A A . 36 LEU HD11 1 1 7 3589 1 1 36 LEU HD12 H -2.655 5.816 -5.794 1.00 . A A . 36 LEU HD12 1 1 7 3590 1 1 36 LEU HD13 H -3.959 5.416 -6.911 1.00 . A A . 36 LEU HD13 1 1 7 3591 1 1 36 LEU HD21 H -5.588 5.533 -4.945 1.00 . A A . 36 LEU HD21 1 1 7 3592 1 1 36 LEU HD22 H -4.201 5.960 -3.947 1.00 . A A . 36 LEU HD22 1 1 7 3593 1 1 36 LEU HD23 H -5.221 4.602 -3.491 1.00 . A A . 36 LEU HD23 1 1 7 3594 1 1 36 LEU HG H -3.154 3.813 -4.487 1.00 . A A . 36 LEU HG 1 1 7 3595 1 1 36 LEU N N -4.496 1.427 -3.945 1.00 . A A . 36 LEU N 1 1 7 3596 1 1 36 LEU O O -5.857 0.418 -6.288 1.00 . A A . 36 LEU O 1 1 7 3597 1 1 36 LEU OXT O -7.539 1.143 -5.102 1.00 . A A . 36 LEU OXT 1 1 7 3598 2 2 1 MAN C1 C 8.625 -4.658 9.843 1.00 . B A . 101 MAN C1 1 1 7 3599 2 2 1 MAN C2 C 8.356 -4.609 11.377 1.00 . B A . 101 MAN C2 1 1 7 3600 2 2 1 MAN C3 C 8.593 -3.208 11.954 1.00 . B A . 101 MAN C3 1 1 7 3601 2 2 1 MAN C4 C 8.339 -2.116 10.911 1.00 . B A . 101 MAN C4 1 1 7 3602 2 2 1 MAN C5 C 9.266 -2.327 9.675 1.00 . B A . 101 MAN C5 1 1 7 3603 2 2 1 MAN C6 C 10.545 -1.511 9.752 1.00 . B A . 101 MAN C6 1 1 7 3604 2 2 1 MAN H1 H 8.945 -5.690 9.634 1.00 . B A . 101 MAN H1 1 1 7 3605 2 2 1 MAN H2 H 7.316 -4.913 11.569 1.00 . B A . 101 MAN H2 1 1 7 3606 2 2 1 MAN H3 H 7.888 -3.114 12.792 1.00 . B A . 101 MAN H3 1 1 7 3607 2 2 1 MAN H4 H 8.592 -1.148 11.368 1.00 . B A . 101 MAN H4 1 1 7 3608 2 2 1 MAN H5 H 8.714 -2.045 8.766 1.00 . B A . 101 MAN H5 1 1 7 3609 2 2 1 MAN H61 H 11.122 -1.725 8.842 1.00 . B A . 101 MAN H61 1 1 7 3610 2 2 1 MAN H62 H 11.138 -1.837 10.618 1.00 . B A . 101 MAN H62 1 1 7 3611 2 2 1 MAN HO2 H 9.113 -6.367 11.705 1.00 . B A . 101 MAN HO2 1 1 7 3612 2 2 1 MAN HO3 H 9.947 -3.988 12.970 1.00 . B A . 101 MAN HO3 1 1 7 3613 2 2 1 MAN HO4 H 6.762 -2.964 10.128 1.00 . B A . 101 MAN HO4 1 1 7 3614 2 2 1 MAN HO6 H 9.715 0.122 9.060 1.00 . B A . 101 MAN HO6 1 1 7 3615 2 2 1 MAN O2 O 9.278 -5.476 12.034 1.00 . B A . 101 MAN O2 1 1 7 3616 2 2 1 MAN O3 O 9.915 -3.168 12.458 1.00 . B A . 101 MAN O3 1 1 7 3617 2 2 1 MAN O4 O 6.959 -2.104 10.519 1.00 . B A . 101 MAN O4 1 1 7 3618 2 2 1 MAN O5 O 9.653 -3.738 9.530 1.00 . B A . 101 MAN O5 1 1 7 3619 2 2 1 MAN O6 O 10.265 -0.115 9.820 1.00 . B A . 101 MAN O6 1 1 8 3620 1 1 1 THR C C -5.384 -5.572 4.855 1.00 . A A . 1 THR C 1 1 8 3621 1 1 1 THR CA C -5.487 -7.096 4.728 1.00 . A A . 1 THR CA 1 1 8 3622 1 1 1 THR CB C -6.846 -7.508 4.160 1.00 . A A . 1 THR CB 1 1 8 3623 1 1 1 THR CG2 C -6.933 -7.170 2.694 1.00 . A A . 1 THR CG2 1 1 8 3624 1 1 1 THR H1 H -6.084 -7.279 6.650 1.00 . A A . 1 THR H1 1 1 8 3625 1 1 1 THR H2 H -4.422 -7.468 6.450 1.00 . A A . 1 THR H2 1 1 8 3626 1 1 1 THR H3 H -5.510 -8.698 5.967 1.00 . A A . 1 THR H3 1 1 8 3627 1 1 1 THR HA H -4.700 -7.468 4.089 1.00 . A A . 1 THR HA 1 1 8 3628 1 1 1 THR HB H -7.631 -7.001 4.701 1.00 . A A . 1 THR HB 1 1 8 3629 1 1 1 THR HG1 H -7.142 -9.345 3.461 1.00 . A A . 1 THR HG1 1 1 8 3630 1 1 1 THR HG21 H -6.836 -6.102 2.565 1.00 . A A . 1 THR HG21 1 1 8 3631 1 1 1 THR HG22 H -7.882 -7.501 2.301 1.00 . A A . 1 THR HG22 1 1 8 3632 1 1 1 THR HG23 H -6.134 -7.666 2.164 1.00 . A A . 1 THR HG23 1 1 8 3633 1 1 1 THR N N -5.348 -7.675 6.032 1.00 . A A . 1 THR N 1 1 8 3634 1 1 1 THR O O -6.057 -4.973 5.689 1.00 . A A . 1 THR O 1 1 8 3635 1 1 1 THR OG1 O -6.987 -8.930 4.321 1.00 . A A . 1 THR OG1 1 1 8 3636 1 1 2 GLN C C -5.357 -2.768 3.342 1.00 . A A . 2 GLN C 1 1 8 3637 1 1 2 GLN CA C -4.289 -3.547 4.138 1.00 . A A . 2 GLN CA 1 1 8 3638 1 1 2 GLN CB C -2.847 -3.273 3.655 1.00 . A A . 2 GLN CB 1 1 8 3639 1 1 2 GLN CD C -2.654 -0.758 4.077 1.00 . A A . 2 GLN CD 1 1 8 3640 1 1 2 GLN CG C -2.127 -2.133 4.395 1.00 . A A . 2 GLN CG 1 1 8 3641 1 1 2 GLN H H -4.123 -5.464 3.306 1.00 . A A . 2 GLN H 1 1 8 3642 1 1 2 GLN HA H -4.374 -3.282 5.181 1.00 . A A . 2 GLN HA 1 1 8 3643 1 1 2 GLN HB2 H -2.272 -4.179 3.779 1.00 . A A . 2 GLN HB2 1 1 8 3644 1 1 2 GLN HB3 H -2.877 -3.039 2.601 1.00 . A A . 2 GLN HB3 1 1 8 3645 1 1 2 GLN HE21 H -2.932 -1.271 2.194 1.00 . A A . 2 GLN HE21 1 1 8 3646 1 1 2 GLN HE22 H -3.411 0.313 2.618 1.00 . A A . 2 GLN HE22 1 1 8 3647 1 1 2 GLN HG2 H -2.243 -2.294 5.457 1.00 . A A . 2 GLN HG2 1 1 8 3648 1 1 2 GLN HG3 H -1.076 -2.173 4.148 1.00 . A A . 2 GLN HG3 1 1 8 3649 1 1 2 GLN N N -4.554 -4.960 4.036 1.00 . A A . 2 GLN N 1 1 8 3650 1 1 2 GLN NE2 N -3.019 -0.551 2.854 1.00 . A A . 2 GLN NE2 1 1 8 3651 1 1 2 GLN O O -5.715 -3.145 2.217 1.00 . A A . 2 GLN O 1 1 8 3652 1 1 2 GLN OE1 O -2.660 0.141 4.930 1.00 . A A . 2 GLN OE1 1 1 8 3653 1 1 3 SER C C -6.618 -0.031 2.221 1.00 . A A . 3 SER C 1 1 8 3654 1 1 3 SER CA C -6.971 -0.940 3.425 1.00 . A A . 3 SER CA 1 1 8 3655 1 1 3 SER CB C -7.557 -0.105 4.562 1.00 . A A . 3 SER CB 1 1 8 3656 1 1 3 SER H H -5.475 -1.442 4.800 1.00 . A A . 3 SER H 1 1 8 3657 1 1 3 SER HA H -7.732 -1.641 3.121 1.00 . A A . 3 SER HA 1 1 8 3658 1 1 3 SER HB2 H -6.833 0.631 4.879 1.00 . A A . 3 SER HB2 1 1 8 3659 1 1 3 SER HB3 H -8.454 0.390 4.224 1.00 . A A . 3 SER HB3 1 1 8 3660 1 1 3 SER HG H -8.680 -0.553 6.075 1.00 . A A . 3 SER HG 1 1 8 3661 1 1 3 SER N N -5.859 -1.718 3.944 1.00 . A A . 3 SER N 1 1 8 3662 1 1 3 SER O O -5.449 0.282 1.943 1.00 . A A . 3 SER O 1 1 8 3663 1 1 3 SER OG O -7.886 -0.934 5.676 1.00 . A A . 3 SER OG 1 1 8 3664 1 1 4 HIS C C -7.014 2.609 0.855 1.00 . A A . 4 HIS C 1 1 8 3665 1 1 4 HIS CA C -7.565 1.264 0.380 1.00 . A A . 4 HIS CA 1 1 8 3666 1 1 4 HIS CB C -8.977 1.433 -0.228 1.00 . A A . 4 HIS CB 1 1 8 3667 1 1 4 HIS CD2 C -8.103 1.972 -2.610 1.00 . A A . 4 HIS CD2 1 1 8 3668 1 1 4 HIS CE1 C -9.919 2.805 -3.457 1.00 . A A . 4 HIS CE1 1 1 8 3669 1 1 4 HIS CG C -9.021 1.989 -1.629 1.00 . A A . 4 HIS CG 1 1 8 3670 1 1 4 HIS H H -8.543 0.075 1.810 1.00 . A A . 4 HIS H 1 1 8 3671 1 1 4 HIS HA H -6.905 0.826 -0.353 1.00 . A A . 4 HIS HA 1 1 8 3672 1 1 4 HIS HB2 H -9.468 0.471 -0.246 1.00 . A A . 4 HIS HB2 1 1 8 3673 1 1 4 HIS HB3 H -9.544 2.094 0.410 1.00 . A A . 4 HIS HB3 1 1 8 3674 1 1 4 HIS HD1 H -11.008 2.700 -1.738 1.00 . A A . 4 HIS HD1 1 1 8 3675 1 1 4 HIS HD2 H -7.085 1.623 -2.519 1.00 . A A . 4 HIS HD2 1 1 8 3676 1 1 4 HIS HE1 H -10.631 3.234 -4.146 1.00 . A A . 4 HIS HE1 1 1 8 3677 1 1 4 HIS HE2 H -8.428 2.062 -4.604 1.00 . A A . 4 HIS HE2 1 1 8 3678 1 1 4 HIS N N -7.656 0.386 1.524 1.00 . A A . 4 HIS N 1 1 8 3679 1 1 4 HIS ND1 N -10.148 2.526 -2.191 1.00 . A A . 4 HIS ND1 1 1 8 3680 1 1 4 HIS NE2 N -8.678 2.475 -3.737 1.00 . A A . 4 HIS NE2 1 1 8 3681 1 1 4 HIS O O -7.410 3.095 1.913 1.00 . A A . 4 HIS O 1 1 8 3682 1 1 5 TYR C C -4.450 4.321 1.612 1.00 . A A . 5 TYR C 1 1 8 3683 1 1 5 TYR CA C -5.404 4.438 0.420 1.00 . A A . 5 TYR CA 1 1 8 3684 1 1 5 TYR CB C -6.391 5.605 0.600 1.00 . A A . 5 TYR CB 1 1 8 3685 1 1 5 TYR CD1 C -8.475 5.621 -0.804 1.00 . A A . 5 TYR CD1 1 1 8 3686 1 1 5 TYR CD2 C -6.529 6.672 -1.674 1.00 . A A . 5 TYR CD2 1 1 8 3687 1 1 5 TYR CE1 C -9.168 5.955 -1.944 1.00 . A A . 5 TYR CE1 1 1 8 3688 1 1 5 TYR CE2 C -7.216 7.011 -2.819 1.00 . A A . 5 TYR CE2 1 1 8 3689 1 1 5 TYR CG C -7.148 5.973 -0.649 1.00 . A A . 5 TYR CG 1 1 8 3690 1 1 5 TYR CZ C -8.536 6.649 -2.947 1.00 . A A . 5 TYR CZ 1 1 8 3691 1 1 5 TYR H H -5.772 2.708 -0.723 1.00 . A A . 5 TYR H 1 1 8 3692 1 1 5 TYR HA H -4.780 4.649 -0.438 1.00 . A A . 5 TYR HA 1 1 8 3693 1 1 5 TYR HB2 H -7.116 5.337 1.353 1.00 . A A . 5 TYR HB2 1 1 8 3694 1 1 5 TYR HB3 H -5.845 6.477 0.930 1.00 . A A . 5 TYR HB3 1 1 8 3695 1 1 5 TYR HD1 H -8.970 5.077 -0.013 1.00 . A A . 5 TYR HD1 1 1 8 3696 1 1 5 TYR HD2 H -5.491 6.952 -1.567 1.00 . A A . 5 TYR HD2 1 1 8 3697 1 1 5 TYR HE1 H -10.204 5.671 -2.046 1.00 . A A . 5 TYR HE1 1 1 8 3698 1 1 5 TYR HE2 H -6.718 7.557 -3.607 1.00 . A A . 5 TYR HE2 1 1 8 3699 1 1 5 TYR HH H -10.066 7.363 -3.779 1.00 . A A . 5 TYR HH 1 1 8 3700 1 1 5 TYR N N -6.067 3.161 0.100 1.00 . A A . 5 TYR N 1 1 8 3701 1 1 5 TYR O O -4.035 5.322 2.190 1.00 . A A . 5 TYR O 1 1 8 3702 1 1 5 TYR OH O -9.231 6.981 -4.085 1.00 . A A . 5 TYR OH 1 1 8 3703 1 1 6 GLY C C -1.802 2.405 2.434 1.00 . A A . 6 GLY C 1 1 8 3704 1 1 6 GLY CA C -3.116 2.907 2.987 1.00 . A A . 6 GLY CA 1 1 8 3705 1 1 6 GLY H H -4.460 2.340 1.475 1.00 . A A . 6 GLY H 1 1 8 3706 1 1 6 GLY HA2 H -2.952 3.852 3.482 1.00 . A A . 6 GLY HA2 1 1 8 3707 1 1 6 GLY HA3 H -3.501 2.187 3.695 1.00 . A A . 6 GLY HA3 1 1 8 3708 1 1 6 GLY N N -4.076 3.111 1.939 1.00 . A A . 6 GLY N 1 1 8 3709 1 1 6 GLY O O -1.754 1.952 1.274 1.00 . A A . 6 GLY O 1 1 8 3710 1 1 7 GLN C C 0.640 0.482 2.863 1.00 . A A . 7 GLN C 1 1 8 3711 1 1 7 GLN CA C 0.572 2.007 2.843 1.00 . A A . 7 GLN CA 1 1 8 3712 1 1 7 GLN CB C 1.663 2.608 3.735 1.00 . A A . 7 GLN CB 1 1 8 3713 1 1 7 GLN CD C 4.136 2.870 4.221 1.00 . A A . 7 GLN CD 1 1 8 3714 1 1 7 GLN CG C 3.090 2.273 3.297 1.00 . A A . 7 GLN CG 1 1 8 3715 1 1 7 GLN H H -0.879 2.811 4.154 1.00 . A A . 7 GLN H 1 1 8 3716 1 1 7 GLN HA H 0.729 2.335 1.826 1.00 . A A . 7 GLN HA 1 1 8 3717 1 1 7 GLN HB2 H 1.557 3.682 3.737 1.00 . A A . 7 GLN HB2 1 1 8 3718 1 1 7 GLN HB3 H 1.525 2.244 4.743 1.00 . A A . 7 GLN HB3 1 1 8 3719 1 1 7 GLN HE21 H 5.497 3.040 2.743 1.00 . A A . 7 GLN HE21 1 1 8 3720 1 1 7 GLN HE22 H 5.994 3.512 4.301 1.00 . A A . 7 GLN HE22 1 1 8 3721 1 1 7 GLN HG2 H 3.207 1.199 3.295 1.00 . A A . 7 GLN HG2 1 1 8 3722 1 1 7 GLN HG3 H 3.253 2.649 2.298 1.00 . A A . 7 GLN HG3 1 1 8 3723 1 1 7 GLN N N -0.753 2.462 3.247 1.00 . A A . 7 GLN N 1 1 8 3724 1 1 7 GLN NE2 N 5.300 3.173 3.694 1.00 . A A . 7 GLN NE2 1 1 8 3725 1 1 7 GLN O O 0.580 -0.135 3.918 1.00 . A A . 7 GLN O 1 1 8 3726 1 1 7 GLN OE1 O 3.891 3.057 5.405 1.00 . A A . 7 GLN OE1 1 1 8 3727 1 1 8 CYS C C 2.135 -2.171 1.609 1.00 . A A . 8 CYS C 1 1 8 3728 1 1 8 CYS CA C 0.752 -1.544 1.529 1.00 . A A . 8 CYS CA 1 1 8 3729 1 1 8 CYS CB C 0.117 -1.880 0.200 1.00 . A A . 8 CYS CB 1 1 8 3730 1 1 8 CYS H H 0.820 0.481 0.904 1.00 . A A . 8 CYS H 1 1 8 3731 1 1 8 CYS HA H 0.133 -1.971 2.303 1.00 . A A . 8 CYS HA 1 1 8 3732 1 1 8 CYS HB2 H 0.298 -2.921 -0.027 1.00 . A A . 8 CYS HB2 1 1 8 3733 1 1 8 CYS HB3 H -0.946 -1.703 0.258 1.00 . A A . 8 CYS HB3 1 1 8 3734 1 1 8 CYS N N 0.757 -0.095 1.698 1.00 . A A . 8 CYS N 1 1 8 3735 1 1 8 CYS O O 2.278 -3.311 2.022 1.00 . A A . 8 CYS O 1 1 8 3736 1 1 8 CYS SG S 0.773 -0.885 -1.188 1.00 . A A . 8 CYS SG 1 1 8 3737 1 1 9 GLY C C 5.479 -1.160 0.578 1.00 . A A . 9 GLY C 1 1 8 3738 1 1 9 GLY CA C 4.462 -2.031 1.225 1.00 . A A . 9 GLY CA 1 1 8 3739 1 1 9 GLY H H 2.998 -0.542 0.878 1.00 . A A . 9 GLY H 1 1 8 3740 1 1 9 GLY HA2 H 4.752 -2.200 2.252 1.00 . A A . 9 GLY HA2 1 1 8 3741 1 1 9 GLY HA3 H 4.435 -2.981 0.712 1.00 . A A . 9 GLY HA3 1 1 8 3742 1 1 9 GLY N N 3.148 -1.452 1.204 1.00 . A A . 9 GLY N 1 1 8 3743 1 1 9 GLY O O 5.893 -1.399 -0.557 1.00 . A A . 9 GLY O 1 1 8 3744 1 1 10 GLY C C 8.184 0.394 1.441 1.00 . A A . 10 GLY C 1 1 8 3745 1 1 10 GLY CA C 6.886 0.735 0.781 1.00 . A A . 10 GLY CA 1 1 8 3746 1 1 10 GLY H H 5.489 0.013 2.168 1.00 . A A . 10 GLY H 1 1 8 3747 1 1 10 GLY HA2 H 6.974 0.613 -0.289 1.00 . A A . 10 GLY HA2 1 1 8 3748 1 1 10 GLY HA3 H 6.631 1.759 1.012 1.00 . A A . 10 GLY HA3 1 1 8 3749 1 1 10 GLY N N 5.864 -0.135 1.276 1.00 . A A . 10 GLY N 1 1 8 3750 1 1 10 GLY O O 8.212 -0.512 2.281 1.00 . A A . 10 GLY O 1 1 8 3751 1 1 11 ILE C C 10.524 1.097 3.187 1.00 . A A . 11 ILE C 1 1 8 3752 1 1 11 ILE CA C 10.557 0.830 1.679 1.00 . A A . 11 ILE CA 1 1 8 3753 1 1 11 ILE CB C 11.666 1.699 1.018 1.00 . A A . 11 ILE CB 1 1 8 3754 1 1 11 ILE CD1 C 12.712 2.301 -1.245 1.00 . A A . 11 ILE CD1 1 1 8 3755 1 1 11 ILE CG1 C 11.703 1.450 -0.497 1.00 . A A . 11 ILE CG1 1 1 8 3756 1 1 11 ILE CG2 C 13.031 1.392 1.642 1.00 . A A . 11 ILE CG2 1 1 8 3757 1 1 11 ILE H H 9.149 1.805 0.433 1.00 . A A . 11 ILE H 1 1 8 3758 1 1 11 ILE HA H 10.785 -0.213 1.518 1.00 . A A . 11 ILE HA 1 1 8 3759 1 1 11 ILE HB H 11.441 2.740 1.199 1.00 . A A . 11 ILE HB 1 1 8 3760 1 1 11 ILE HD11 H 12.669 2.063 -2.298 1.00 . A A . 11 ILE HD11 1 1 8 3761 1 1 11 ILE HD12 H 13.703 2.094 -0.870 1.00 . A A . 11 ILE HD12 1 1 8 3762 1 1 11 ILE HD13 H 12.481 3.346 -1.102 1.00 . A A . 11 ILE HD13 1 1 8 3763 1 1 11 ILE HG12 H 11.954 0.416 -0.678 1.00 . A A . 11 ILE HG12 1 1 8 3764 1 1 11 ILE HG13 H 10.725 1.651 -0.908 1.00 . A A . 11 ILE HG13 1 1 8 3765 1 1 11 ILE HG21 H 13.787 2.006 1.175 1.00 . A A . 11 ILE HG21 1 1 8 3766 1 1 11 ILE HG22 H 13.270 0.350 1.489 1.00 . A A . 11 ILE HG22 1 1 8 3767 1 1 11 ILE HG23 H 12.992 1.605 2.701 1.00 . A A . 11 ILE HG23 1 1 8 3768 1 1 11 ILE N N 9.243 1.090 1.096 1.00 . A A . 11 ILE N 1 1 8 3769 1 1 11 ILE O O 10.299 2.228 3.625 1.00 . A A . 11 ILE O 1 1 8 3770 1 1 12 GLY C C 9.409 -0.377 6.008 1.00 . A A . 12 GLY C 1 1 8 3771 1 1 12 GLY CA C 10.673 0.183 5.395 1.00 . A A . 12 GLY CA 1 1 8 3772 1 1 12 GLY H H 10.800 -0.838 3.559 1.00 . A A . 12 GLY H 1 1 8 3773 1 1 12 GLY HA2 H 11.522 -0.347 5.801 1.00 . A A . 12 GLY HA2 1 1 8 3774 1 1 12 GLY HA3 H 10.750 1.229 5.651 1.00 . A A . 12 GLY HA3 1 1 8 3775 1 1 12 GLY N N 10.683 0.049 3.962 1.00 . A A . 12 GLY N 1 1 8 3776 1 1 12 GLY O O 9.365 -0.653 7.202 1.00 . A A . 12 GLY O 1 1 8 3777 1 1 13 TYR C C 7.173 -2.602 5.690 1.00 . A A . 13 TYR C 1 1 8 3778 1 1 13 TYR CA C 7.133 -1.082 5.691 1.00 . A A . 13 TYR CA 1 1 8 3779 1 1 13 TYR CB C 5.946 -0.563 4.854 1.00 . A A . 13 TYR CB 1 1 8 3780 1 1 13 TYR CD1 C 3.882 -2.060 5.043 1.00 . A A . 13 TYR CD1 1 1 8 3781 1 1 13 TYR CD2 C 3.950 -0.054 6.328 1.00 . A A . 13 TYR CD2 1 1 8 3782 1 1 13 TYR CE1 C 2.627 -2.350 5.559 1.00 . A A . 13 TYR CE1 1 1 8 3783 1 1 13 TYR CE2 C 2.702 -0.335 6.847 1.00 . A A . 13 TYR CE2 1 1 8 3784 1 1 13 TYR CG C 4.566 -0.903 5.421 1.00 . A A . 13 TYR CG 1 1 8 3785 1 1 13 TYR CZ C 2.044 -1.480 6.464 1.00 . A A . 13 TYR CZ 1 1 8 3786 1 1 13 TYR H H 8.487 -0.364 4.241 1.00 . A A . 13 TYR H 1 1 8 3787 1 1 13 TYR HA H 7.022 -0.744 6.710 1.00 . A A . 13 TYR HA 1 1 8 3788 1 1 13 TYR HB2 H 6.014 0.512 4.787 1.00 . A A . 13 TYR HB2 1 1 8 3789 1 1 13 TYR HB3 H 6.011 -0.976 3.858 1.00 . A A . 13 TYR HB3 1 1 8 3790 1 1 13 TYR HD1 H 4.342 -2.737 4.340 1.00 . A A . 13 TYR HD1 1 1 8 3791 1 1 13 TYR HD2 H 4.463 0.847 6.630 1.00 . A A . 13 TYR HD2 1 1 8 3792 1 1 13 TYR HE1 H 2.120 -3.253 5.250 1.00 . A A . 13 TYR HE1 1 1 8 3793 1 1 13 TYR HE2 H 2.247 0.345 7.552 1.00 . A A . 13 TYR HE2 1 1 8 3794 1 1 13 TYR HH H 0.258 -0.965 6.745 1.00 . A A . 13 TYR HH 1 1 8 3795 1 1 13 TYR N N 8.388 -0.565 5.197 1.00 . A A . 13 TYR N 1 1 8 3796 1 1 13 TYR O O 7.679 -3.227 4.750 1.00 . A A . 13 TYR O 1 1 8 3797 1 1 13 TYR OH O 0.784 -1.741 6.973 1.00 . A A . 13 TYR OH 1 1 8 3798 1 1 14 SER C C 5.299 -4.949 7.550 1.00 . A A . 14 SER C 1 1 8 3799 1 1 14 SER CA C 6.628 -4.594 6.906 1.00 . A A . 14 SER CA 1 1 8 3800 1 1 14 SER CB C 7.804 -5.003 7.808 1.00 . A A . 14 SER CB 1 1 8 3801 1 1 14 SER H H 6.296 -2.628 7.456 1.00 . A A . 14 SER H 1 1 8 3802 1 1 14 SER HA H 6.726 -5.077 5.946 1.00 . A A . 14 SER HA 1 1 8 3803 1 1 14 SER HB2 H 7.738 -6.060 8.025 1.00 . A A . 14 SER HB2 1 1 8 3804 1 1 14 SER HB3 H 8.734 -4.790 7.303 1.00 . A A . 14 SER HB3 1 1 8 3805 1 1 14 SER N N 6.670 -3.174 6.731 1.00 . A A . 14 SER N 1 1 8 3806 1 1 14 SER O O 4.894 -4.301 8.527 1.00 . A A . 14 SER O 1 1 8 3807 1 1 14 SER OG O 7.762 -4.252 9.051 1.00 . A A . 14 SER OG 1 1 8 3808 1 1 15 GLY C C 2.292 -6.633 6.542 1.00 . A A . 15 GLY C 1 1 8 3809 1 1 15 GLY CA C 3.336 -6.291 7.582 1.00 . A A . 15 GLY CA 1 1 8 3810 1 1 15 GLY H H 4.898 -6.354 6.177 1.00 . A A . 15 GLY H 1 1 8 3811 1 1 15 GLY HA2 H 3.497 -7.144 8.224 1.00 . A A . 15 GLY HA2 1 1 8 3812 1 1 15 GLY HA3 H 2.987 -5.461 8.178 1.00 . A A . 15 GLY HA3 1 1 8 3813 1 1 15 GLY N N 4.592 -5.906 6.996 1.00 . A A . 15 GLY N 1 1 8 3814 1 1 15 GLY O O 2.556 -7.463 5.667 1.00 . A A . 15 GLY O 1 1 8 3815 1 1 16 PRO C C 0.334 -5.747 4.260 1.00 . A A . 16 PRO C 1 1 8 3816 1 1 16 PRO CA C 0.024 -6.287 5.653 1.00 . A A . 16 PRO CA 1 1 8 3817 1 1 16 PRO CB C -1.199 -5.564 6.242 1.00 . A A . 16 PRO CB 1 1 8 3818 1 1 16 PRO CD C 0.692 -5.013 7.588 1.00 . A A . 16 PRO CD 1 1 8 3819 1 1 16 PRO CG C -0.794 -5.171 7.619 1.00 . A A . 16 PRO CG 1 1 8 3820 1 1 16 PRO HA H -0.175 -7.345 5.594 1.00 . A A . 16 PRO HA 1 1 8 3821 1 1 16 PRO HB2 H -1.425 -4.696 5.640 1.00 . A A . 16 PRO HB2 1 1 8 3822 1 1 16 PRO HB3 H -2.050 -6.227 6.255 1.00 . A A . 16 PRO HB3 1 1 8 3823 1 1 16 PRO HD2 H 0.966 -4.017 7.274 1.00 . A A . 16 PRO HD2 1 1 8 3824 1 1 16 PRO HD3 H 1.094 -5.238 8.564 1.00 . A A . 16 PRO HD3 1 1 8 3825 1 1 16 PRO HG2 H -1.264 -4.237 7.887 1.00 . A A . 16 PRO HG2 1 1 8 3826 1 1 16 PRO HG3 H -1.071 -5.948 8.317 1.00 . A A . 16 PRO HG3 1 1 8 3827 1 1 16 PRO N N 1.099 -6.019 6.601 1.00 . A A . 16 PRO N 1 1 8 3828 1 1 16 PRO O O 0.189 -4.559 3.993 1.00 . A A . 16 PRO O 1 1 8 3829 1 1 17 THR C C 0.013 -6.524 1.075 1.00 . A A . 17 THR C 1 1 8 3830 1 1 17 THR CA C 1.147 -6.238 2.063 1.00 . A A . 17 THR CA 1 1 8 3831 1 1 17 THR CB C 2.439 -6.957 1.652 1.00 . A A . 17 THR CB 1 1 8 3832 1 1 17 THR CG2 C 3.650 -6.289 2.288 1.00 . A A . 17 THR CG2 1 1 8 3833 1 1 17 THR H H 0.932 -7.545 3.669 1.00 . A A . 17 THR H 1 1 8 3834 1 1 17 THR HA H 1.340 -5.175 2.063 1.00 . A A . 17 THR HA 1 1 8 3835 1 1 17 THR HB H 2.533 -6.925 0.577 1.00 . A A . 17 THR HB 1 1 8 3836 1 1 17 THR HG1 H 3.184 -8.529 2.564 1.00 . A A . 17 THR HG1 1 1 8 3837 1 1 17 THR HG21 H 3.548 -6.316 3.362 1.00 . A A . 17 THR HG21 1 1 8 3838 1 1 17 THR HG22 H 3.705 -5.259 1.964 1.00 . A A . 17 THR HG22 1 1 8 3839 1 1 17 THR HG23 H 4.549 -6.812 1.996 1.00 . A A . 17 THR HG23 1 1 8 3840 1 1 17 THR N N 0.794 -6.613 3.402 1.00 . A A . 17 THR N 1 1 8 3841 1 1 17 THR O O -0.022 -5.982 -0.042 1.00 . A A . 17 THR O 1 1 8 3842 1 1 17 THR OG1 O 2.370 -8.338 2.079 1.00 . A A . 17 THR OG1 1 1 8 3843 1 1 18 VAL C C -3.149 -6.655 0.851 1.00 . A A . 18 VAL C 1 1 8 3844 1 1 18 VAL CA C -2.063 -7.703 0.663 1.00 . A A . 18 VAL CA 1 1 8 3845 1 1 18 VAL CB C -2.627 -9.117 1.009 1.00 . A A . 18 VAL CB 1 1 8 3846 1 1 18 VAL CG1 C -3.832 -9.464 0.140 1.00 . A A . 18 VAL CG1 1 1 8 3847 1 1 18 VAL CG2 C -1.545 -10.180 0.854 1.00 . A A . 18 VAL CG2 1 1 8 3848 1 1 18 VAL H H -0.853 -7.743 2.391 1.00 . A A . 18 VAL H 1 1 8 3849 1 1 18 VAL HA H -1.739 -7.693 -0.367 1.00 . A A . 18 VAL HA 1 1 8 3850 1 1 18 VAL HB H -2.947 -9.108 2.040 1.00 . A A . 18 VAL HB 1 1 8 3851 1 1 18 VAL HG11 H -3.535 -9.463 -0.898 1.00 . A A . 18 VAL HG11 1 1 8 3852 1 1 18 VAL HG12 H -4.608 -8.728 0.291 1.00 . A A . 18 VAL HG12 1 1 8 3853 1 1 18 VAL HG13 H -4.204 -10.442 0.409 1.00 . A A . 18 VAL HG13 1 1 8 3854 1 1 18 VAL HG21 H -1.192 -10.184 -0.166 1.00 . A A . 18 VAL HG21 1 1 8 3855 1 1 18 VAL HG22 H -1.954 -11.151 1.095 1.00 . A A . 18 VAL HG22 1 1 8 3856 1 1 18 VAL HG23 H -0.721 -9.962 1.517 1.00 . A A . 18 VAL HG23 1 1 8 3857 1 1 18 VAL N N -0.923 -7.359 1.489 1.00 . A A . 18 VAL N 1 1 8 3858 1 1 18 VAL O O -3.602 -6.416 1.974 1.00 . A A . 18 VAL O 1 1 8 3859 1 1 19 CYS C C -5.941 -5.622 -0.262 1.00 . A A . 19 CYS C 1 1 8 3860 1 1 19 CYS CA C -4.554 -4.997 -0.197 1.00 . A A . 19 CYS CA 1 1 8 3861 1 1 19 CYS CB C -4.346 -4.019 -1.350 1.00 . A A . 19 CYS CB 1 1 8 3862 1 1 19 CYS H H -3.136 -6.252 -1.090 1.00 . A A . 19 CYS H 1 1 8 3863 1 1 19 CYS HA H -4.458 -4.462 0.735 1.00 . A A . 19 CYS HA 1 1 8 3864 1 1 19 CYS HB2 H -4.419 -4.548 -2.289 1.00 . A A . 19 CYS HB2 1 1 8 3865 1 1 19 CYS HB3 H -5.117 -3.265 -1.316 1.00 . A A . 19 CYS HB3 1 1 8 3866 1 1 19 CYS N N -3.536 -6.025 -0.227 1.00 . A A . 19 CYS N 1 1 8 3867 1 1 19 CYS O O -6.074 -6.821 -0.537 1.00 . A A . 19 CYS O 1 1 8 3868 1 1 19 CYS SG S -2.739 -3.163 -1.318 1.00 . A A . 19 CYS SG 1 1 8 3869 1 1 20 ALA C C -8.823 -5.655 -1.392 1.00 . A A . 20 ALA C 1 1 8 3870 1 1 20 ALA CA C -8.347 -5.282 0.011 1.00 . A A . 20 ALA CA 1 1 8 3871 1 1 20 ALA CB C -9.251 -4.218 0.620 1.00 . A A . 20 ALA CB 1 1 8 3872 1 1 20 ALA H H -6.783 -3.885 0.231 1.00 . A A . 20 ALA H 1 1 8 3873 1 1 20 ALA HA H -8.403 -6.162 0.633 1.00 . A A . 20 ALA HA 1 1 8 3874 1 1 20 ALA HB1 H -9.241 -3.334 -0.002 1.00 . A A . 20 ALA HB1 1 1 8 3875 1 1 20 ALA HB2 H -8.895 -3.966 1.609 1.00 . A A . 20 ALA HB2 1 1 8 3876 1 1 20 ALA HB3 H -10.260 -4.598 0.690 1.00 . A A . 20 ALA HB3 1 1 8 3877 1 1 20 ALA N N -6.962 -4.826 0.014 1.00 . A A . 20 ALA N 1 1 8 3878 1 1 20 ALA O O -8.153 -5.341 -2.399 1.00 . A A . 20 ALA O 1 1 8 3879 1 1 21 SER C C -10.759 -5.649 -3.689 1.00 . A A . 21 SER C 1 1 8 3880 1 1 21 SER CA C -10.572 -6.782 -2.671 1.00 . A A . 21 SER CA 1 1 8 3881 1 1 21 SER CB C -11.917 -7.408 -2.321 1.00 . A A . 21 SER CB 1 1 8 3882 1 1 21 SER H H -10.449 -6.520 -0.620 1.00 . A A . 21 SER H 1 1 8 3883 1 1 21 SER HA H -9.943 -7.550 -3.091 1.00 . A A . 21 SER HA 1 1 8 3884 1 1 21 SER HB2 H -12.605 -6.634 -2.011 1.00 . A A . 21 SER HB2 1 1 8 3885 1 1 21 SER HB3 H -12.313 -7.925 -3.183 1.00 . A A . 21 SER HB3 1 1 8 3886 1 1 21 SER HG H -12.626 -8.603 -0.929 1.00 . A A . 21 SER HG 1 1 8 3887 1 1 21 SER N N -9.966 -6.311 -1.446 1.00 . A A . 21 SER N 1 1 8 3888 1 1 21 SER O O -11.504 -4.686 -3.445 1.00 . A A . 21 SER O 1 1 8 3889 1 1 21 SER OG O -11.755 -8.346 -1.258 1.00 . A A . 21 SER OG 1 1 8 3890 1 1 22 GLY C C -9.125 -3.685 -5.784 1.00 . A A . 22 GLY C 1 1 8 3891 1 1 22 GLY CA C -10.169 -4.777 -5.842 1.00 . A A . 22 GLY CA 1 1 8 3892 1 1 22 GLY H H -9.380 -6.464 -4.876 1.00 . A A . 22 GLY H 1 1 8 3893 1 1 22 GLY HA2 H -10.083 -5.291 -6.787 1.00 . A A . 22 GLY HA2 1 1 8 3894 1 1 22 GLY HA3 H -11.148 -4.327 -5.778 1.00 . A A . 22 GLY HA3 1 1 8 3895 1 1 22 GLY N N -10.035 -5.738 -4.782 1.00 . A A . 22 GLY N 1 1 8 3896 1 1 22 GLY O O -9.102 -2.801 -6.638 1.00 . A A . 22 GLY O 1 1 8 3897 1 1 23 THR C C -5.863 -3.247 -4.928 1.00 . A A . 23 THR C 1 1 8 3898 1 1 23 THR CA C -7.256 -2.697 -4.674 1.00 . A A . 23 THR CA 1 1 8 3899 1 1 23 THR CB C -7.331 -1.971 -3.304 1.00 . A A . 23 THR CB 1 1 8 3900 1 1 23 THR CG2 C -8.696 -1.351 -3.114 1.00 . A A . 23 THR CG2 1 1 8 3901 1 1 23 THR H H -8.262 -4.484 -4.171 1.00 . A A . 23 THR H 1 1 8 3902 1 1 23 THR HA H -7.462 -1.977 -5.451 1.00 . A A . 23 THR HA 1 1 8 3903 1 1 23 THR HB H -6.591 -1.186 -3.276 1.00 . A A . 23 THR HB 1 1 8 3904 1 1 23 THR HG1 H -7.436 -3.752 -2.467 1.00 . A A . 23 THR HG1 1 1 8 3905 1 1 23 THR HG21 H -8.746 -0.875 -2.146 1.00 . A A . 23 THR HG21 1 1 8 3906 1 1 23 THR HG22 H -9.446 -2.123 -3.186 1.00 . A A . 23 THR HG22 1 1 8 3907 1 1 23 THR HG23 H -8.867 -0.613 -3.885 1.00 . A A . 23 THR HG23 1 1 8 3908 1 1 23 THR N N -8.254 -3.730 -4.801 1.00 . A A . 23 THR N 1 1 8 3909 1 1 23 THR O O -5.535 -4.379 -4.529 1.00 . A A . 23 THR O 1 1 8 3910 1 1 23 THR OG1 O -7.094 -2.877 -2.230 1.00 . A A . 23 THR OG1 1 1 8 3911 1 1 24 THR C C -2.683 -2.063 -5.221 1.00 . A A . 24 THR C 1 1 8 3912 1 1 24 THR CA C -3.737 -2.889 -5.938 1.00 . A A . 24 THR CA 1 1 8 3913 1 1 24 THR CB C -3.538 -2.816 -7.463 1.00 . A A . 24 THR CB 1 1 8 3914 1 1 24 THR CG2 C -4.297 -3.934 -8.167 1.00 . A A . 24 THR CG2 1 1 8 3915 1 1 24 THR H H -5.350 -1.561 -5.824 1.00 . A A . 24 THR H 1 1 8 3916 1 1 24 THR HA H -3.633 -3.920 -5.636 1.00 . A A . 24 THR HA 1 1 8 3917 1 1 24 THR HB H -2.484 -2.932 -7.657 1.00 . A A . 24 THR HB 1 1 8 3918 1 1 24 THR HG1 H -4.685 -1.169 -7.455 1.00 . A A . 24 THR HG1 1 1 8 3919 1 1 24 THR HG21 H -4.159 -3.853 -9.235 1.00 . A A . 24 THR HG21 1 1 8 3920 1 1 24 THR HG22 H -5.346 -3.852 -7.930 1.00 . A A . 24 THR HG22 1 1 8 3921 1 1 24 THR HG23 H -3.927 -4.890 -7.827 1.00 . A A . 24 THR HG23 1 1 8 3922 1 1 24 THR N N -5.057 -2.470 -5.582 1.00 . A A . 24 THR N 1 1 8 3923 1 1 24 THR O O -2.865 -0.876 -5.015 1.00 . A A . 24 THR O 1 1 8 3924 1 1 24 THR OG1 O -3.953 -1.523 -7.988 1.00 . A A . 24 THR OG1 1 1 8 3925 1 1 25 CYS C C 0.328 -1.326 -5.174 1.00 . A A . 25 CYS C 1 1 8 3926 1 1 25 CYS CA C -0.548 -2.002 -4.144 1.00 . A A . 25 CYS CA 1 1 8 3927 1 1 25 CYS CB C 0.276 -2.989 -3.311 1.00 . A A . 25 CYS CB 1 1 8 3928 1 1 25 CYS H H -1.509 -3.644 -5.019 1.00 . A A . 25 CYS H 1 1 8 3929 1 1 25 CYS HA H -0.978 -1.254 -3.493 1.00 . A A . 25 CYS HA 1 1 8 3930 1 1 25 CYS HB2 H -0.370 -3.466 -2.588 1.00 . A A . 25 CYS HB2 1 1 8 3931 1 1 25 CYS HB3 H 0.684 -3.742 -3.969 1.00 . A A . 25 CYS HB3 1 1 8 3932 1 1 25 CYS N N -1.616 -2.689 -4.824 1.00 . A A . 25 CYS N 1 1 8 3933 1 1 25 CYS O O 0.980 -1.994 -5.972 1.00 . A A . 25 CYS O 1 1 8 3934 1 1 25 CYS SG S 1.665 -2.237 -2.394 1.00 . A A . 25 CYS SG 1 1 8 3935 1 1 26 GLN C C 2.008 1.665 -5.424 1.00 . A A . 26 GLN C 1 1 8 3936 1 1 26 GLN CA C 1.094 0.717 -6.153 1.00 . A A . 26 GLN CA 1 1 8 3937 1 1 26 GLN CB C 0.188 1.498 -7.094 1.00 . A A . 26 GLN CB 1 1 8 3938 1 1 26 GLN CD C -1.714 1.430 -8.736 1.00 . A A . 26 GLN CD 1 1 8 3939 1 1 26 GLN CG C -0.816 0.634 -7.831 1.00 . A A . 26 GLN CG 1 1 8 3940 1 1 26 GLN H H -0.243 0.484 -4.562 1.00 . A A . 26 GLN H 1 1 8 3941 1 1 26 GLN HA H 1.685 0.022 -6.729 1.00 . A A . 26 GLN HA 1 1 8 3942 1 1 26 GLN HB2 H -0.357 2.232 -6.518 1.00 . A A . 26 GLN HB2 1 1 8 3943 1 1 26 GLN HB3 H 0.795 2.011 -7.824 1.00 . A A . 26 GLN HB3 1 1 8 3944 1 1 26 GLN HE21 H -3.185 0.154 -8.411 1.00 . A A . 26 GLN HE21 1 1 8 3945 1 1 26 GLN HE22 H -3.546 1.462 -9.468 1.00 . A A . 26 GLN HE22 1 1 8 3946 1 1 26 GLN HG2 H -0.280 -0.089 -8.427 1.00 . A A . 26 GLN HG2 1 1 8 3947 1 1 26 GLN HG3 H -1.426 0.119 -7.103 1.00 . A A . 26 GLN HG3 1 1 8 3948 1 1 26 GLN N N 0.310 -0.024 -5.200 1.00 . A A . 26 GLN N 1 1 8 3949 1 1 26 GLN NE2 N -2.926 0.977 -8.886 1.00 . A A . 26 GLN NE2 1 1 8 3950 1 1 26 GLN O O 1.613 2.270 -4.433 1.00 . A A . 26 GLN O 1 1 8 3951 1 1 26 GLN OE1 O -1.321 2.468 -9.290 1.00 . A A . 26 GLN OE1 1 1 8 3952 1 1 27 VAL C C 3.778 4.109 -5.658 1.00 . A A . 27 VAL C 1 1 8 3953 1 1 27 VAL CA C 4.175 2.676 -5.305 1.00 . A A . 27 VAL CA 1 1 8 3954 1 1 27 VAL CB C 5.604 2.381 -5.837 1.00 . A A . 27 VAL CB 1 1 8 3955 1 1 27 VAL CG1 C 6.625 3.297 -5.188 1.00 . A A . 27 VAL CG1 1 1 8 3956 1 1 27 VAL CG2 C 5.976 0.921 -5.603 1.00 . A A . 27 VAL CG2 1 1 8 3957 1 1 27 VAL H H 3.467 1.268 -6.687 1.00 . A A . 27 VAL H 1 1 8 3958 1 1 27 VAL HA H 4.152 2.541 -4.234 1.00 . A A . 27 VAL HA 1 1 8 3959 1 1 27 VAL HB H 5.613 2.567 -6.899 1.00 . A A . 27 VAL HB 1 1 8 3960 1 1 27 VAL HG11 H 6.640 3.124 -4.122 1.00 . A A . 27 VAL HG11 1 1 8 3961 1 1 27 VAL HG12 H 6.349 4.325 -5.376 1.00 . A A . 27 VAL HG12 1 1 8 3962 1 1 27 VAL HG13 H 7.602 3.105 -5.602 1.00 . A A . 27 VAL HG13 1 1 8 3963 1 1 27 VAL HG21 H 5.270 0.282 -6.110 1.00 . A A . 27 VAL HG21 1 1 8 3964 1 1 27 VAL HG22 H 5.959 0.711 -4.544 1.00 . A A . 27 VAL HG22 1 1 8 3965 1 1 27 VAL HG23 H 6.967 0.736 -5.989 1.00 . A A . 27 VAL HG23 1 1 8 3966 1 1 27 VAL N N 3.209 1.782 -5.891 1.00 . A A . 27 VAL N 1 1 8 3967 1 1 27 VAL O O 3.660 4.450 -6.827 1.00 . A A . 27 VAL O 1 1 8 3968 1 1 28 LEU C C 4.343 7.185 -4.824 1.00 . A A . 28 LEU C 1 1 8 3969 1 1 28 LEU CA C 3.111 6.286 -4.920 1.00 . A A . 28 LEU CA 1 1 8 3970 1 1 28 LEU CB C 2.010 6.693 -3.900 1.00 . A A . 28 LEU CB 1 1 8 3971 1 1 28 LEU CD1 C -0.034 8.005 -3.223 1.00 . A A . 28 LEU CD1 1 1 8 3972 1 1 28 LEU CD2 C 1.805 9.205 -4.368 1.00 . A A . 28 LEU CD2 1 1 8 3973 1 1 28 LEU CG C 1.065 7.879 -4.261 1.00 . A A . 28 LEU CG 1 1 8 3974 1 1 28 LEU H H 3.668 4.615 -3.746 1.00 . A A . 28 LEU H 1 1 8 3975 1 1 28 LEU HA H 2.716 6.333 -5.925 1.00 . A A . 28 LEU HA 1 1 8 3976 1 1 28 LEU HB2 H 1.394 5.825 -3.713 1.00 . A A . 28 LEU HB2 1 1 8 3977 1 1 28 LEU HB3 H 2.520 6.942 -2.982 1.00 . A A . 28 LEU HB3 1 1 8 3978 1 1 28 LEU HD11 H -0.610 7.093 -3.192 1.00 . A A . 28 LEU HD11 1 1 8 3979 1 1 28 LEU HD12 H -0.678 8.831 -3.485 1.00 . A A . 28 LEU HD12 1 1 8 3980 1 1 28 LEU HD13 H 0.405 8.187 -2.254 1.00 . A A . 28 LEU HD13 1 1 8 3981 1 1 28 LEU HD21 H 1.109 9.987 -4.634 1.00 . A A . 28 LEU HD21 1 1 8 3982 1 1 28 LEU HD22 H 2.575 9.131 -5.119 1.00 . A A . 28 LEU HD22 1 1 8 3983 1 1 28 LEU HD23 H 2.259 9.439 -3.416 1.00 . A A . 28 LEU HD23 1 1 8 3984 1 1 28 LEU HG H 0.593 7.665 -5.209 1.00 . A A . 28 LEU HG 1 1 8 3985 1 1 28 LEU N N 3.533 4.925 -4.669 1.00 . A A . 28 LEU N 1 1 8 3986 1 1 28 LEU O O 4.576 8.037 -5.676 1.00 . A A . 28 LEU O 1 1 8 3987 1 1 29 ASN C C 7.413 6.644 -3.228 1.00 . A A . 29 ASN C 1 1 8 3988 1 1 29 ASN CA C 6.367 7.683 -3.573 1.00 . A A . 29 ASN CA 1 1 8 3989 1 1 29 ASN CB C 6.232 8.686 -2.402 1.00 . A A . 29 ASN CB 1 1 8 3990 1 1 29 ASN CG C 5.161 9.732 -2.582 1.00 . A A . 29 ASN CG 1 1 8 3991 1 1 29 ASN H H 4.930 6.211 -3.192 1.00 . A A . 29 ASN H 1 1 8 3992 1 1 29 ASN HA H 6.646 8.194 -4.483 1.00 . A A . 29 ASN HA 1 1 8 3993 1 1 29 ASN HB2 H 6.013 8.143 -1.496 1.00 . A A . 29 ASN HB2 1 1 8 3994 1 1 29 ASN HB3 H 7.178 9.192 -2.278 1.00 . A A . 29 ASN HB3 1 1 8 3995 1 1 29 ASN HD21 H 3.964 8.788 -1.307 1.00 . A A . 29 ASN HD21 1 1 8 3996 1 1 29 ASN HD22 H 3.356 10.253 -1.968 1.00 . A A . 29 ASN HD22 1 1 8 3997 1 1 29 ASN N N 5.135 6.952 -3.809 1.00 . A A . 29 ASN N 1 1 8 3998 1 1 29 ASN ND2 N 4.053 9.567 -1.895 1.00 . A A . 29 ASN ND2 1 1 8 3999 1 1 29 ASN O O 7.028 5.521 -2.952 1.00 . A A . 29 ASN O 1 1 8 4000 1 1 29 ASN OD1 O 5.368 10.733 -3.265 1.00 . A A . 29 ASN OD1 1 1 8 4001 1 1 30 PRO C C 9.532 5.100 -1.699 1.00 . A A . 30 PRO C 1 1 8 4002 1 1 30 PRO CA C 9.811 5.991 -2.923 1.00 . A A . 30 PRO CA 1 1 8 4003 1 1 30 PRO CB C 11.029 6.880 -2.677 1.00 . A A . 30 PRO CB 1 1 8 4004 1 1 30 PRO CD C 9.317 8.315 -3.506 1.00 . A A . 30 PRO CD 1 1 8 4005 1 1 30 PRO CG C 10.797 8.051 -3.559 1.00 . A A . 30 PRO CG 1 1 8 4006 1 1 30 PRO HA H 9.997 5.361 -3.780 1.00 . A A . 30 PRO HA 1 1 8 4007 1 1 30 PRO HB2 H 11.066 7.165 -1.635 1.00 . A A . 30 PRO HB2 1 1 8 4008 1 1 30 PRO HB3 H 11.933 6.355 -2.945 1.00 . A A . 30 PRO HB3 1 1 8 4009 1 1 30 PRO HD2 H 9.109 9.010 -2.707 1.00 . A A . 30 PRO HD2 1 1 8 4010 1 1 30 PRO HD3 H 8.952 8.699 -4.447 1.00 . A A . 30 PRO HD3 1 1 8 4011 1 1 30 PRO HG2 H 11.350 8.903 -3.193 1.00 . A A . 30 PRO HG2 1 1 8 4012 1 1 30 PRO HG3 H 11.095 7.817 -4.570 1.00 . A A . 30 PRO HG3 1 1 8 4013 1 1 30 PRO N N 8.738 6.974 -3.212 1.00 . A A . 30 PRO N 1 1 8 4014 1 1 30 PRO O O 9.743 3.883 -1.747 1.00 . A A . 30 PRO O 1 1 8 4015 1 1 31 TYR C C 7.258 4.636 0.689 1.00 . A A . 31 TYR C 1 1 8 4016 1 1 31 TYR CA C 8.750 4.908 0.564 1.00 . A A . 31 TYR CA 1 1 8 4017 1 1 31 TYR CB C 9.223 5.637 1.832 1.00 . A A . 31 TYR CB 1 1 8 4018 1 1 31 TYR CD1 C 11.362 6.865 1.277 1.00 . A A . 31 TYR CD1 1 1 8 4019 1 1 31 TYR CD2 C 11.481 4.997 2.741 1.00 . A A . 31 TYR CD2 1 1 8 4020 1 1 31 TYR CE1 C 12.720 7.051 1.399 1.00 . A A . 31 TYR CE1 1 1 8 4021 1 1 31 TYR CE2 C 12.840 5.176 2.864 1.00 . A A . 31 TYR CE2 1 1 8 4022 1 1 31 TYR CG C 10.718 5.833 1.945 1.00 . A A . 31 TYR CG 1 1 8 4023 1 1 31 TYR CZ C 13.452 6.205 2.191 1.00 . A A . 31 TYR CZ 1 1 8 4024 1 1 31 TYR H H 8.892 6.660 -0.626 1.00 . A A . 31 TYR H 1 1 8 4025 1 1 31 TYR HA H 9.279 3.970 0.495 1.00 . A A . 31 TYR HA 1 1 8 4026 1 1 31 TYR HB2 H 8.766 6.615 1.863 1.00 . A A . 31 TYR HB2 1 1 8 4027 1 1 31 TYR HB3 H 8.895 5.078 2.697 1.00 . A A . 31 TYR HB3 1 1 8 4028 1 1 31 TYR HD1 H 10.782 7.528 0.653 1.00 . A A . 31 TYR HD1 1 1 8 4029 1 1 31 TYR HD2 H 10.998 4.188 3.269 1.00 . A A . 31 TYR HD2 1 1 8 4030 1 1 31 TYR HE1 H 13.205 7.858 0.871 1.00 . A A . 31 TYR HE1 1 1 8 4031 1 1 31 TYR HE2 H 13.419 4.513 3.487 1.00 . A A . 31 TYR HE2 1 1 8 4032 1 1 31 TYR HH H 15.215 5.515 2.282 1.00 . A A . 31 TYR HH 1 1 8 4033 1 1 31 TYR N N 9.045 5.689 -0.620 1.00 . A A . 31 TYR N 1 1 8 4034 1 1 31 TYR O O 6.847 3.663 1.319 1.00 . A A . 31 TYR O 1 1 8 4035 1 1 31 TYR OH O 14.813 6.393 2.324 1.00 . A A . 31 TYR OH 1 1 8 4036 1 1 32 TYR C C 4.408 4.487 -0.898 1.00 . A A . 32 TYR C 1 1 8 4037 1 1 32 TYR CA C 5.024 5.295 0.250 1.00 . A A . 32 TYR CA 1 1 8 4038 1 1 32 TYR CB C 4.308 6.639 0.408 1.00 . A A . 32 TYR CB 1 1 8 4039 1 1 32 TYR CD1 C 1.831 6.739 -0.029 1.00 . A A . 32 TYR CD1 1 1 8 4040 1 1 32 TYR CD2 C 2.557 6.092 2.136 1.00 . A A . 32 TYR CD2 1 1 8 4041 1 1 32 TYR CE1 C 0.527 6.586 0.364 1.00 . A A . 32 TYR CE1 1 1 8 4042 1 1 32 TYR CE2 C 1.246 5.942 2.538 1.00 . A A . 32 TYR CE2 1 1 8 4043 1 1 32 TYR CG C 2.870 6.496 0.845 1.00 . A A . 32 TYR CG 1 1 8 4044 1 1 32 TYR CZ C 0.237 6.189 1.648 1.00 . A A . 32 TYR CZ 1 1 8 4045 1 1 32 TYR H H 6.814 6.196 -0.441 1.00 . A A . 32 TYR H 1 1 8 4046 1 1 32 TYR HA H 4.871 4.733 1.159 1.00 . A A . 32 TYR HA 1 1 8 4047 1 1 32 TYR HB2 H 4.824 7.282 1.106 1.00 . A A . 32 TYR HB2 1 1 8 4048 1 1 32 TYR HB3 H 4.301 7.124 -0.556 1.00 . A A . 32 TYR HB3 1 1 8 4049 1 1 32 TYR HD1 H 2.056 7.054 -1.036 1.00 . A A . 32 TYR HD1 1 1 8 4050 1 1 32 TYR HD2 H 3.358 5.899 2.835 1.00 . A A . 32 TYR HD2 1 1 8 4051 1 1 32 TYR HE1 H -0.273 6.783 -0.334 1.00 . A A . 32 TYR HE1 1 1 8 4052 1 1 32 TYR HE2 H 1.018 5.635 3.549 1.00 . A A . 32 TYR HE2 1 1 8 4053 1 1 32 TYR HH H -1.180 6.358 2.929 1.00 . A A . 32 TYR HH 1 1 8 4054 1 1 32 TYR N N 6.445 5.475 0.109 1.00 . A A . 32 TYR N 1 1 8 4055 1 1 32 TYR O O 4.350 4.956 -2.030 1.00 . A A . 32 TYR O 1 1 8 4056 1 1 32 TYR OH O -1.073 6.023 2.030 1.00 . A A . 32 TYR OH 1 1 8 4057 1 1 33 SER C C 1.743 2.477 -1.051 1.00 . A A . 33 SER C 1 1 8 4058 1 1 33 SER CA C 3.165 2.538 -1.553 1.00 . A A . 33 SER CA 1 1 8 4059 1 1 33 SER CB C 3.753 1.136 -1.675 1.00 . A A . 33 SER CB 1 1 8 4060 1 1 33 SER H H 4.031 2.961 0.304 1.00 . A A . 33 SER H 1 1 8 4061 1 1 33 SER HA H 3.187 3.046 -2.506 1.00 . A A . 33 SER HA 1 1 8 4062 1 1 33 SER HB2 H 3.652 0.618 -0.732 1.00 . A A . 33 SER HB2 1 1 8 4063 1 1 33 SER HB3 H 3.220 0.596 -2.445 1.00 . A A . 33 SER HB3 1 1 8 4064 1 1 33 SER HG H 5.329 0.411 -2.550 1.00 . A A . 33 SER HG 1 1 8 4065 1 1 33 SER N N 3.906 3.327 -0.594 1.00 . A A . 33 SER N 1 1 8 4066 1 1 33 SER O O 1.539 2.271 0.135 1.00 . A A . 33 SER O 1 1 8 4067 1 1 33 SER OG O 5.125 1.191 -2.021 1.00 . A A . 33 SER OG 1 1 8 4068 1 1 34 GLN C C -1.476 1.805 -2.276 1.00 . A A . 34 GLN C 1 1 8 4069 1 1 34 GLN CA C -0.581 2.759 -1.493 1.00 . A A . 34 GLN CA 1 1 8 4070 1 1 34 GLN CB C -1.034 4.210 -1.677 1.00 . A A . 34 GLN CB 1 1 8 4071 1 1 34 GLN CD C -2.811 5.958 -1.311 1.00 . A A . 34 GLN CD 1 1 8 4072 1 1 34 GLN CG C -2.448 4.491 -1.234 1.00 . A A . 34 GLN CG 1 1 8 4073 1 1 34 GLN H H 0.984 2.670 -2.877 1.00 . A A . 34 GLN H 1 1 8 4074 1 1 34 GLN HA H -0.635 2.520 -0.442 1.00 . A A . 34 GLN HA 1 1 8 4075 1 1 34 GLN HB2 H -0.373 4.847 -1.108 1.00 . A A . 34 GLN HB2 1 1 8 4076 1 1 34 GLN HB3 H -0.945 4.469 -2.722 1.00 . A A . 34 GLN HB3 1 1 8 4077 1 1 34 GLN HE21 H -2.231 6.231 0.562 1.00 . A A . 34 GLN HE21 1 1 8 4078 1 1 34 GLN HE22 H -2.832 7.621 -0.248 1.00 . A A . 34 GLN HE22 1 1 8 4079 1 1 34 GLN HG2 H -3.124 3.939 -1.871 1.00 . A A . 34 GLN HG2 1 1 8 4080 1 1 34 GLN HG3 H -2.561 4.159 -0.214 1.00 . A A . 34 GLN HG3 1 1 8 4081 1 1 34 GLN N N 0.788 2.650 -1.910 1.00 . A A . 34 GLN N 1 1 8 4082 1 1 34 GLN NE2 N -2.607 6.668 -0.239 1.00 . A A . 34 GLN NE2 1 1 8 4083 1 1 34 GLN O O -1.245 1.557 -3.461 1.00 . A A . 34 GLN O 1 1 8 4084 1 1 34 GLN OE1 O -3.288 6.437 -2.327 1.00 . A A . 34 GLN OE1 1 1 8 4085 1 1 35 CYS C C -4.437 1.262 -2.972 1.00 . A A . 35 CYS C 1 1 8 4086 1 1 35 CYS CA C -3.426 0.397 -2.242 1.00 . A A . 35 CYS CA 1 1 8 4087 1 1 35 CYS CB C -4.157 -0.472 -1.232 1.00 . A A . 35 CYS CB 1 1 8 4088 1 1 35 CYS H H -2.522 1.372 -0.629 1.00 . A A . 35 CYS H 1 1 8 4089 1 1 35 CYS HA H -2.914 -0.235 -2.952 1.00 . A A . 35 CYS HA 1 1 8 4090 1 1 35 CYS HB2 H -4.770 0.145 -0.596 1.00 . A A . 35 CYS HB2 1 1 8 4091 1 1 35 CYS HB3 H -4.807 -1.124 -1.789 1.00 . A A . 35 CYS HB3 1 1 8 4092 1 1 35 CYS N N -2.459 1.237 -1.598 1.00 . A A . 35 CYS N 1 1 8 4093 1 1 35 CYS O O -5.147 2.069 -2.344 1.00 . A A . 35 CYS O 1 1 8 4094 1 1 35 CYS SG S -3.091 -1.509 -0.189 1.00 . A A . 35 CYS SG 1 1 8 4095 1 1 36 LEU C C -6.293 0.803 -5.800 1.00 . A A . 36 LEU C 1 1 8 4096 1 1 36 LEU CA C -5.387 1.808 -5.126 1.00 . A A . 36 LEU CA 1 1 8 4097 1 1 36 LEU CB C -4.619 2.635 -6.164 1.00 . A A . 36 LEU CB 1 1 8 4098 1 1 36 LEU CD1 C -2.957 4.434 -6.715 1.00 . A A . 36 LEU CD1 1 1 8 4099 1 1 36 LEU CD2 C -4.587 4.785 -4.864 1.00 . A A . 36 LEU CD2 1 1 8 4100 1 1 36 LEU CG C -3.737 3.759 -5.603 1.00 . A A . 36 LEU CG 1 1 8 4101 1 1 36 LEU H H -3.869 0.461 -4.686 1.00 . A A . 36 LEU H 1 1 8 4102 1 1 36 LEU HA H -5.988 2.465 -4.516 1.00 . A A . 36 LEU HA 1 1 8 4103 1 1 36 LEU HB2 H -3.991 1.960 -6.728 1.00 . A A . 36 LEU HB2 1 1 8 4104 1 1 36 LEU HB3 H -5.336 3.075 -6.840 1.00 . A A . 36 LEU HB3 1 1 8 4105 1 1 36 LEU HD11 H -2.332 3.707 -7.213 1.00 . A A . 36 LEU HD11 1 1 8 4106 1 1 36 LEU HD12 H -2.338 5.214 -6.295 1.00 . A A . 36 LEU HD12 1 1 8 4107 1 1 36 LEU HD13 H -3.647 4.865 -7.425 1.00 . A A . 36 LEU HD13 1 1 8 4108 1 1 36 LEU HD21 H -3.951 5.576 -4.492 1.00 . A A . 36 LEU HD21 1 1 8 4109 1 1 36 LEU HD22 H -5.084 4.314 -4.029 1.00 . A A . 36 LEU HD22 1 1 8 4110 1 1 36 LEU HD23 H -5.321 5.203 -5.536 1.00 . A A . 36 LEU HD23 1 1 8 4111 1 1 36 LEU HG H -3.030 3.340 -4.902 1.00 . A A . 36 LEU HG 1 1 8 4112 1 1 36 LEU N N -4.486 1.105 -4.263 1.00 . A A . 36 LEU N 1 1 8 4113 1 1 36 LEU O O -7.499 0.788 -5.483 1.00 . A A . 36 LEU O 1 1 8 4114 1 1 36 LEU OXT O -5.780 -0.047 -6.583 1.00 . A A . 36 LEU OXT 1 1 8 4115 2 2 1 MAN C1 C 8.873 -4.472 9.867 1.00 . B A . 101 MAN C1 1 1 8 4116 2 2 1 MAN C2 C 8.577 -3.838 11.252 1.00 . B A . 101 MAN C2 1 1 8 4117 2 2 1 MAN C3 C 9.851 -3.371 11.920 1.00 . B A . 101 MAN C3 1 1 8 4118 2 2 1 MAN C4 C 10.592 -2.331 11.036 1.00 . B A . 101 MAN C4 1 1 8 4119 2 2 1 MAN C5 C 10.256 -2.538 9.539 1.00 . B A . 101 MAN C5 1 1 8 4120 2 2 1 MAN C6 C 11.354 -2.060 8.608 1.00 . B A . 101 MAN C6 1 1 8 4121 2 2 1 MAN H1 H 9.005 -5.551 10.027 1.00 . B A . 101 MAN H1 1 1 8 4122 2 2 1 MAN H2 H 7.894 -2.986 11.127 1.00 . B A . 101 MAN H2 1 1 8 4123 2 2 1 MAN H3 H 9.547 -2.879 12.855 1.00 . B A . 101 MAN H3 1 1 8 4124 2 2 1 MAN H4 H 11.673 -2.467 11.183 1.00 . B A . 101 MAN H4 1 1 8 4125 2 2 1 MAN H5 H 9.324 -1.997 9.315 1.00 . B A . 101 MAN H5 1 1 8 4126 2 2 1 MAN H61 H 11.522 -0.994 8.813 1.00 . B A . 101 MAN H61 1 1 8 4127 2 2 1 MAN H62 H 10.989 -2.135 7.572 1.00 . B A . 101 MAN H62 1 1 8 4128 2 2 1 MAN HO2 H 8.665 -5.532 12.133 1.00 . B A . 101 MAN HO2 1 1 8 4129 2 2 1 MAN HO3 H 10.946 -4.885 11.389 1.00 . B A . 101 MAN HO3 1 1 8 4130 2 2 1 MAN HO4 H 10.731 -0.412 10.884 1.00 . B A . 101 MAN HO4 1 1 8 4131 2 2 1 MAN HO6 H 12.295 -3.697 9.093 1.00 . B A . 101 MAN HO6 1 1 8 4132 2 2 1 MAN O2 O 8.005 -4.831 12.072 1.00 . B A . 101 MAN O2 1 1 8 4133 2 2 1 MAN O3 O 10.674 -4.482 12.222 1.00 . B A . 101 MAN O3 1 1 8 4134 2 2 1 MAN O4 O 10.223 -1.025 11.430 1.00 . B A . 101 MAN O4 1 1 8 4135 2 2 1 MAN O5 O 10.086 -3.931 9.296 1.00 . B A . 101 MAN O5 1 1 8 4136 2 2 1 MAN O6 O 12.550 -2.819 8.780 1.00 . B A . 101 MAN O6 1 1 9 4137 1 1 1 THR C C -6.244 -5.705 5.027 1.00 . A A . 1 THR C 1 1 9 4138 1 1 1 THR CA C -6.589 -7.204 4.945 1.00 . A A . 1 THR CA 1 1 9 4139 1 1 1 THR CB C -7.716 -7.451 3.932 1.00 . A A . 1 THR CB 1 1 9 4140 1 1 1 THR CG2 C -7.175 -7.461 2.524 1.00 . A A . 1 THR CG2 1 1 9 4141 1 1 1 THR H1 H -7.863 -7.070 6.536 1.00 . A A . 1 THR H1 1 1 9 4142 1 1 1 THR H2 H -6.286 -7.537 6.946 1.00 . A A . 1 THR H2 1 1 9 4143 1 1 1 THR H3 H -7.335 -8.630 6.176 1.00 . A A . 1 THR H3 1 1 9 4144 1 1 1 THR HA H -5.712 -7.770 4.661 1.00 . A A . 1 THR HA 1 1 9 4145 1 1 1 THR HB H -8.465 -6.682 4.029 1.00 . A A . 1 THR HB 1 1 9 4146 1 1 1 THR HG1 H -9.218 -8.725 3.924 1.00 . A A . 1 THR HG1 1 1 9 4147 1 1 1 THR HG21 H -6.429 -8.236 2.428 1.00 . A A . 1 THR HG21 1 1 9 4148 1 1 1 THR HG22 H -6.734 -6.500 2.300 1.00 . A A . 1 THR HG22 1 1 9 4149 1 1 1 THR HG23 H -7.982 -7.657 1.834 1.00 . A A . 1 THR HG23 1 1 9 4150 1 1 1 THR N N -7.044 -7.638 6.245 1.00 . A A . 1 THR N 1 1 9 4151 1 1 1 THR O O -6.805 -4.986 5.865 1.00 . A A . 1 THR O 1 1 9 4152 1 1 1 THR OG1 O -8.290 -8.747 4.196 1.00 . A A . 1 THR OG1 1 1 9 4153 1 1 2 GLN C C -5.930 -3.018 3.426 1.00 . A A . 2 GLN C 1 1 9 4154 1 1 2 GLN CA C -4.904 -3.854 4.241 1.00 . A A . 2 GLN CA 1 1 9 4155 1 1 2 GLN CB C -3.474 -3.757 3.676 1.00 . A A . 2 GLN CB 1 1 9 4156 1 1 2 GLN CD C -3.171 -1.253 3.908 1.00 . A A . 2 GLN CD 1 1 9 4157 1 1 2 GLN CG C -2.610 -2.607 4.198 1.00 . A A . 2 GLN CG 1 1 9 4158 1 1 2 GLN H H -4.897 -5.816 3.528 1.00 . A A . 2 GLN H 1 1 9 4159 1 1 2 GLN HA H -4.921 -3.524 5.270 1.00 . A A . 2 GLN HA 1 1 9 4160 1 1 2 GLN HB2 H -2.955 -4.678 3.901 1.00 . A A . 2 GLN HB2 1 1 9 4161 1 1 2 GLN HB3 H -3.545 -3.664 2.602 1.00 . A A . 2 GLN HB3 1 1 9 4162 1 1 2 GLN HE21 H -2.389 -1.328 2.128 1.00 . A A . 2 GLN HE21 1 1 9 4163 1 1 2 GLN HE22 H -3.296 0.090 2.495 1.00 . A A . 2 GLN HE22 1 1 9 4164 1 1 2 GLN HG2 H -2.526 -2.710 5.270 1.00 . A A . 2 GLN HG2 1 1 9 4165 1 1 2 GLN HG3 H -1.624 -2.682 3.766 1.00 . A A . 2 GLN HG3 1 1 9 4166 1 1 2 GLN N N -5.322 -5.240 4.205 1.00 . A A . 2 GLN N 1 1 9 4167 1 1 2 GLN NE2 N -2.921 -0.779 2.741 1.00 . A A . 2 GLN NE2 1 1 9 4168 1 1 2 GLN O O -6.338 -3.412 2.328 1.00 . A A . 2 GLN O 1 1 9 4169 1 1 2 GLN OE1 O -3.890 -0.667 4.721 1.00 . A A . 2 GLN OE1 1 1 9 4170 1 1 3 SER C C -6.961 -0.210 2.235 1.00 . A A . 3 SER C 1 1 9 4171 1 1 3 SER CA C -7.400 -1.075 3.438 1.00 . A A . 3 SER CA 1 1 9 4172 1 1 3 SER CB C -7.932 -0.168 4.549 1.00 . A A . 3 SER CB 1 1 9 4173 1 1 3 SER H H -5.876 -1.584 4.786 1.00 . A A . 3 SER H 1 1 9 4174 1 1 3 SER HA H -8.207 -1.725 3.134 1.00 . A A . 3 SER HA 1 1 9 4175 1 1 3 SER HB2 H -7.171 0.546 4.828 1.00 . A A . 3 SER HB2 1 1 9 4176 1 1 3 SER HB3 H -8.804 0.358 4.190 1.00 . A A . 3 SER HB3 1 1 9 4177 1 1 3 SER HG H -8.596 -0.290 6.363 1.00 . A A . 3 SER HG 1 1 9 4178 1 1 3 SER N N -6.334 -1.901 3.979 1.00 . A A . 3 SER N 1 1 9 4179 1 1 3 SER O O -5.760 0.045 2.009 1.00 . A A . 3 SER O 1 1 9 4180 1 1 3 SER OG O -8.295 -0.923 5.698 1.00 . A A . 3 SER OG 1 1 9 4181 1 1 4 HIS C C -7.247 2.464 0.889 1.00 . A A . 4 HIS C 1 1 9 4182 1 1 4 HIS CA C -7.769 1.134 0.355 1.00 . A A . 4 HIS CA 1 1 9 4183 1 1 4 HIS CB C -9.130 1.330 -0.342 1.00 . A A . 4 HIS CB 1 1 9 4184 1 1 4 HIS CD2 C -8.161 2.395 -2.527 1.00 . A A . 4 HIS CD2 1 1 9 4185 1 1 4 HIS CE1 C -10.032 3.065 -3.399 1.00 . A A . 4 HIS CE1 1 1 9 4186 1 1 4 HIS CG C -9.143 2.075 -1.660 1.00 . A A . 4 HIS CG 1 1 9 4187 1 1 4 HIS H H -8.875 -0.009 1.721 1.00 . A A . 4 HIS H 1 1 9 4188 1 1 4 HIS HA H -7.065 0.695 -0.335 1.00 . A A . 4 HIS HA 1 1 9 4189 1 1 4 HIS HB2 H -9.586 0.367 -0.512 1.00 . A A . 4 HIS HB2 1 1 9 4190 1 1 4 HIS HB3 H -9.755 1.881 0.344 1.00 . A A . 4 HIS HB3 1 1 9 4191 1 1 4 HIS HD1 H -11.209 2.419 -1.866 1.00 . A A . 4 HIS HD1 1 1 9 4192 1 1 4 HIS HD2 H -7.107 2.200 -2.395 1.00 . A A . 4 HIS HD2 1 1 9 4193 1 1 4 HIS HE1 H -10.753 3.499 -4.075 1.00 . A A . 4 HIS HE1 1 1 9 4194 1 1 4 HIS HE2 H -8.368 2.965 -4.511 1.00 . A A . 4 HIS HE2 1 1 9 4195 1 1 4 HIS N N -7.956 0.249 1.487 1.00 . A A . 4 HIS N 1 1 9 4196 1 1 4 HIS ND1 N -10.300 2.512 -2.239 1.00 . A A . 4 HIS ND1 1 1 9 4197 1 1 4 HIS NE2 N -8.741 3.007 -3.598 1.00 . A A . 4 HIS NE2 1 1 9 4198 1 1 4 HIS O O -7.748 2.961 1.902 1.00 . A A . 4 HIS O 1 1 9 4199 1 1 5 TYR C C -4.557 4.080 1.730 1.00 . A A . 5 TYR C 1 1 9 4200 1 1 5 TYR CA C -5.533 4.254 0.568 1.00 . A A . 5 TYR CA 1 1 9 4201 1 1 5 TYR CB C -6.483 5.433 0.853 1.00 . A A . 5 TYR CB 1 1 9 4202 1 1 5 TYR CD1 C -6.852 6.483 -1.411 1.00 . A A . 5 TYR CD1 1 1 9 4203 1 1 5 TYR CD2 C -8.734 5.612 -0.250 1.00 . A A . 5 TYR CD2 1 1 9 4204 1 1 5 TYR CE1 C -7.673 6.877 -2.448 1.00 . A A . 5 TYR CE1 1 1 9 4205 1 1 5 TYR CE2 C -9.557 5.999 -1.279 1.00 . A A . 5 TYR CE2 1 1 9 4206 1 1 5 TYR CG C -7.370 5.843 -0.296 1.00 . A A . 5 TYR CG 1 1 9 4207 1 1 5 TYR CZ C -9.026 6.629 -2.373 1.00 . A A . 5 TYR CZ 1 1 9 4208 1 1 5 TYR H H -5.892 2.523 -0.577 1.00 . A A . 5 TYR H 1 1 9 4209 1 1 5 TYR HA H -4.937 4.500 -0.299 1.00 . A A . 5 TYR HA 1 1 9 4210 1 1 5 TYR HB2 H -7.125 5.165 1.678 1.00 . A A . 5 TYR HB2 1 1 9 4211 1 1 5 TYR HB3 H -5.890 6.288 1.143 1.00 . A A . 5 TYR HB3 1 1 9 4212 1 1 5 TYR HD1 H -5.789 6.671 -1.462 1.00 . A A . 5 TYR HD1 1 1 9 4213 1 1 5 TYR HD2 H -9.153 5.114 0.611 1.00 . A A . 5 TYR HD2 1 1 9 4214 1 1 5 TYR HE1 H -7.256 7.375 -3.310 1.00 . A A . 5 TYR HE1 1 1 9 4215 1 1 5 TYR HE2 H -10.618 5.808 -1.224 1.00 . A A . 5 TYR HE2 1 1 9 4216 1 1 5 TYR HH H -10.610 7.473 -3.010 1.00 . A A . 5 TYR HH 1 1 9 4217 1 1 5 TYR N N -6.229 2.996 0.219 1.00 . A A . 5 TYR N 1 1 9 4218 1 1 5 TYR O O -3.912 5.040 2.160 1.00 . A A . 5 TYR O 1 1 9 4219 1 1 5 TYR OH O -9.850 7.017 -3.394 1.00 . A A . 5 TYR OH 1 1 9 4220 1 1 6 GLY C C -2.100 2.257 2.612 1.00 . A A . 6 GLY C 1 1 9 4221 1 1 6 GLY CA C -3.421 2.617 3.208 1.00 . A A . 6 GLY CA 1 1 9 4222 1 1 6 GLY H H -4.905 2.125 1.799 1.00 . A A . 6 GLY H 1 1 9 4223 1 1 6 GLY HA2 H -3.308 3.509 3.807 1.00 . A A . 6 GLY HA2 1 1 9 4224 1 1 6 GLY HA3 H -3.760 1.802 3.829 1.00 . A A . 6 GLY HA3 1 1 9 4225 1 1 6 GLY N N -4.377 2.865 2.167 1.00 . A A . 6 GLY N 1 1 9 4226 1 1 6 GLY O O -2.037 1.919 1.408 1.00 . A A . 6 GLY O 1 1 9 4227 1 1 7 GLN C C 0.385 0.437 2.927 1.00 . A A . 7 GLN C 1 1 9 4228 1 1 7 GLN CA C 0.248 1.954 2.919 1.00 . A A . 7 GLN CA 1 1 9 4229 1 1 7 GLN CB C 1.341 2.617 3.751 1.00 . A A . 7 GLN CB 1 1 9 4230 1 1 7 GLN CD C 3.791 2.991 4.151 1.00 . A A . 7 GLN CD 1 1 9 4231 1 1 7 GLN CG C 2.760 2.315 3.285 1.00 . A A . 7 GLN CG 1 1 9 4232 1 1 7 GLN H H -1.154 2.584 4.337 1.00 . A A . 7 GLN H 1 1 9 4233 1 1 7 GLN HA H 0.322 2.294 1.896 1.00 . A A . 7 GLN HA 1 1 9 4234 1 1 7 GLN HB2 H 1.203 3.687 3.719 1.00 . A A . 7 GLN HB2 1 1 9 4235 1 1 7 GLN HB3 H 1.246 2.284 4.774 1.00 . A A . 7 GLN HB3 1 1 9 4236 1 1 7 GLN HE21 H 5.155 3.087 2.669 1.00 . A A . 7 GLN HE21 1 1 9 4237 1 1 7 GLN HE22 H 5.596 3.701 4.198 1.00 . A A . 7 GLN HE22 1 1 9 4238 1 1 7 GLN HG2 H 2.922 1.249 3.322 1.00 . A A . 7 GLN HG2 1 1 9 4239 1 1 7 GLN HG3 H 2.875 2.659 2.267 1.00 . A A . 7 GLN HG3 1 1 9 4240 1 1 7 GLN N N -1.056 2.316 3.396 1.00 . A A . 7 GLN N 1 1 9 4241 1 1 7 GLN NE2 N 4.938 3.281 3.605 1.00 . A A . 7 GLN NE2 1 1 9 4242 1 1 7 GLN O O 0.305 -0.198 3.973 1.00 . A A . 7 GLN O 1 1 9 4243 1 1 7 GLN OE1 O 3.556 3.228 5.330 1.00 . A A . 7 GLN OE1 1 1 9 4244 1 1 8 CYS C C 2.047 -2.067 1.893 1.00 . A A . 8 CYS C 1 1 9 4245 1 1 8 CYS CA C 0.661 -1.561 1.578 1.00 . A A . 8 CYS CA 1 1 9 4246 1 1 8 CYS CB C 0.280 -1.928 0.155 1.00 . A A . 8 CYS CB 1 1 9 4247 1 1 8 CYS H H 0.625 0.463 0.967 1.00 . A A . 8 CYS H 1 1 9 4248 1 1 8 CYS HA H -0.044 -2.031 2.248 1.00 . A A . 8 CYS HA 1 1 9 4249 1 1 8 CYS HB2 H 0.591 -2.943 -0.044 1.00 . A A . 8 CYS HB2 1 1 9 4250 1 1 8 CYS HB3 H -0.792 -1.856 0.044 1.00 . A A . 8 CYS HB3 1 1 9 4251 1 1 8 CYS N N 0.558 -0.119 1.756 1.00 . A A . 8 CYS N 1 1 9 4252 1 1 8 CYS O O 2.205 -3.072 2.555 1.00 . A A . 8 CYS O 1 1 9 4253 1 1 8 CYS SG S 1.046 -0.850 -1.109 1.00 . A A . 8 CYS SG 1 1 9 4254 1 1 9 GLY C C 5.341 -1.124 0.747 1.00 . A A . 9 GLY C 1 1 9 4255 1 1 9 GLY CA C 4.381 -1.794 1.659 1.00 . A A . 9 GLY CA 1 1 9 4256 1 1 9 GLY H H 2.870 -0.565 0.894 1.00 . A A . 9 GLY H 1 1 9 4257 1 1 9 GLY HA2 H 4.642 -1.561 2.681 1.00 . A A . 9 GLY HA2 1 1 9 4258 1 1 9 GLY HA3 H 4.442 -2.862 1.509 1.00 . A A . 9 GLY HA3 1 1 9 4259 1 1 9 GLY N N 3.046 -1.367 1.427 1.00 . A A . 9 GLY N 1 1 9 4260 1 1 9 GLY O O 5.473 -1.503 -0.404 1.00 . A A . 9 GLY O 1 1 9 4261 1 1 10 GLY C C 8.293 0.331 1.123 1.00 . A A . 10 GLY C 1 1 9 4262 1 1 10 GLY CA C 6.973 0.586 0.480 1.00 . A A . 10 GLY CA 1 1 9 4263 1 1 10 GLY H H 5.761 0.214 2.138 1.00 . A A . 10 GLY H 1 1 9 4264 1 1 10 GLY HA2 H 6.977 0.219 -0.536 1.00 . A A . 10 GLY HA2 1 1 9 4265 1 1 10 GLY HA3 H 6.782 1.649 0.483 1.00 . A A . 10 GLY HA3 1 1 9 4266 1 1 10 GLY N N 5.957 -0.089 1.231 1.00 . A A . 10 GLY N 1 1 9 4267 1 1 10 GLY O O 8.372 -0.506 2.044 1.00 . A A . 10 GLY O 1 1 9 4268 1 1 11 ILE C C 10.546 1.301 2.760 1.00 . A A . 11 ILE C 1 1 9 4269 1 1 11 ILE CA C 10.625 0.862 1.296 1.00 . A A . 11 ILE CA 1 1 9 4270 1 1 11 ILE CB C 11.701 1.705 0.560 1.00 . A A . 11 ILE CB 1 1 9 4271 1 1 11 ILE CD1 C 12.704 2.185 -1.736 1.00 . A A . 11 ILE CD1 1 1 9 4272 1 1 11 ILE CG1 C 11.758 1.327 -0.924 1.00 . A A . 11 ILE CG1 1 1 9 4273 1 1 11 ILE CG2 C 13.068 1.507 1.207 1.00 . A A . 11 ILE CG2 1 1 9 4274 1 1 11 ILE H H 9.207 1.658 -0.046 1.00 . A A . 11 ILE H 1 1 9 4275 1 1 11 ILE HA H 10.895 -0.183 1.252 1.00 . A A . 11 ILE HA 1 1 9 4276 1 1 11 ILE HB H 11.436 2.749 0.646 1.00 . A A . 11 ILE HB 1 1 9 4277 1 1 11 ILE HD11 H 12.691 1.865 -2.767 1.00 . A A . 11 ILE HD11 1 1 9 4278 1 1 11 ILE HD12 H 13.704 2.085 -1.339 1.00 . A A . 11 ILE HD12 1 1 9 4279 1 1 11 ILE HD13 H 12.394 3.218 -1.673 1.00 . A A . 11 ILE HD13 1 1 9 4280 1 1 11 ILE HG12 H 12.078 0.300 -1.016 1.00 . A A . 11 ILE HG12 1 1 9 4281 1 1 11 ILE HG13 H 10.770 1.427 -1.348 1.00 . A A . 11 ILE HG13 1 1 9 4282 1 1 11 ILE HG21 H 13.340 0.462 1.166 1.00 . A A . 11 ILE HG21 1 1 9 4283 1 1 11 ILE HG22 H 13.030 1.830 2.236 1.00 . A A . 11 ILE HG22 1 1 9 4284 1 1 11 ILE HG23 H 13.801 2.091 0.672 1.00 . A A . 11 ILE HG23 1 1 9 4285 1 1 11 ILE N N 9.319 1.019 0.691 1.00 . A A . 11 ILE N 1 1 9 4286 1 1 11 ILE O O 10.114 2.415 3.058 1.00 . A A . 11 ILE O 1 1 9 4287 1 1 12 GLY C C 9.610 0.238 5.747 1.00 . A A . 12 GLY C 1 1 9 4288 1 1 12 GLY CA C 10.856 0.744 5.056 1.00 . A A . 12 GLY CA 1 1 9 4289 1 1 12 GLY H H 11.119 -0.502 3.379 1.00 . A A . 12 GLY H 1 1 9 4290 1 1 12 GLY HA2 H 11.724 0.314 5.533 1.00 . A A . 12 GLY HA2 1 1 9 4291 1 1 12 GLY HA3 H 10.897 1.818 5.154 1.00 . A A . 12 GLY HA3 1 1 9 4292 1 1 12 GLY N N 10.875 0.409 3.658 1.00 . A A . 12 GLY N 1 1 9 4293 1 1 12 GLY O O 9.518 0.271 6.978 1.00 . A A . 12 GLY O 1 1 9 4294 1 1 13 TYR C C 7.550 -2.274 5.563 1.00 . A A . 13 TYR C 1 1 9 4295 1 1 13 TYR CA C 7.435 -0.770 5.523 1.00 . A A . 13 TYR CA 1 1 9 4296 1 1 13 TYR CB C 6.221 -0.346 4.667 1.00 . A A . 13 TYR CB 1 1 9 4297 1 1 13 TYR CD1 C 4.012 0.087 5.818 1.00 . A A . 13 TYR CD1 1 1 9 4298 1 1 13 TYR CD2 C 4.391 -2.112 5.023 1.00 . A A . 13 TYR CD2 1 1 9 4299 1 1 13 TYR CE1 C 2.769 -0.293 6.279 1.00 . A A . 13 TYR CE1 1 1 9 4300 1 1 13 TYR CE2 C 3.148 -2.502 5.488 1.00 . A A . 13 TYR CE2 1 1 9 4301 1 1 13 TYR CG C 4.848 -0.802 5.185 1.00 . A A . 13 TYR CG 1 1 9 4302 1 1 13 TYR CZ C 2.342 -1.583 6.109 1.00 . A A . 13 TYR CZ 1 1 9 4303 1 1 13 TYR H H 8.789 -0.249 3.998 1.00 . A A . 13 TYR H 1 1 9 4304 1 1 13 TYR HA H 7.318 -0.390 6.527 1.00 . A A . 13 TYR HA 1 1 9 4305 1 1 13 TYR HB2 H 6.204 0.733 4.618 1.00 . A A . 13 TYR HB2 1 1 9 4306 1 1 13 TYR HB3 H 6.350 -0.728 3.665 1.00 . A A . 13 TYR HB3 1 1 9 4307 1 1 13 TYR HD1 H 4.345 1.105 5.952 1.00 . A A . 13 TYR HD1 1 1 9 4308 1 1 13 TYR HD2 H 5.030 -2.831 4.532 1.00 . A A . 13 TYR HD2 1 1 9 4309 1 1 13 TYR HE1 H 2.130 0.423 6.773 1.00 . A A . 13 TYR HE1 1 1 9 4310 1 1 13 TYR HE2 H 2.815 -3.520 5.352 1.00 . A A . 13 TYR HE2 1 1 9 4311 1 1 13 TYR HH H 0.457 -1.387 6.134 1.00 . A A . 13 TYR HH 1 1 9 4312 1 1 13 TYR N N 8.660 -0.235 4.973 1.00 . A A . 13 TYR N 1 1 9 4313 1 1 13 TYR O O 8.036 -2.896 4.603 1.00 . A A . 13 TYR O 1 1 9 4314 1 1 13 TYR OH O 1.099 -1.955 6.576 1.00 . A A . 13 TYR OH 1 1 9 4315 1 1 14 SER C C 5.898 -4.701 7.513 1.00 . A A . 14 SER C 1 1 9 4316 1 1 14 SER CA C 7.161 -4.275 6.790 1.00 . A A . 14 SER CA 1 1 9 4317 1 1 14 SER CB C 8.404 -4.694 7.582 1.00 . A A . 14 SER CB 1 1 9 4318 1 1 14 SER H H 6.780 -2.322 7.392 1.00 . A A . 14 SER H 1 1 9 4319 1 1 14 SER HA H 7.188 -4.724 5.809 1.00 . A A . 14 SER HA 1 1 9 4320 1 1 14 SER HB2 H 8.253 -4.362 8.597 1.00 . A A . 14 SER HB2 1 1 9 4321 1 1 14 SER HB3 H 8.500 -5.767 7.561 1.00 . A A . 14 SER HB3 1 1 9 4322 1 1 14 SER N N 7.131 -2.854 6.644 1.00 . A A . 14 SER N 1 1 9 4323 1 1 14 SER O O 5.750 -4.438 8.707 1.00 . A A . 14 SER O 1 1 9 4324 1 1 14 SER OG O 9.609 -4.077 7.025 1.00 . A A . 14 SER OG 1 1 9 4325 1 1 15 GLY C C 2.814 -6.325 6.406 1.00 . A A . 15 GLY C 1 1 9 4326 1 1 15 GLY CA C 3.732 -5.679 7.405 1.00 . A A . 15 GLY CA 1 1 9 4327 1 1 15 GLY H H 5.105 -5.488 5.849 1.00 . A A . 15 GLY H 1 1 9 4328 1 1 15 GLY HA2 H 3.938 -6.376 8.205 1.00 . A A . 15 GLY HA2 1 1 9 4329 1 1 15 GLY HA3 H 3.251 -4.800 7.808 1.00 . A A . 15 GLY HA3 1 1 9 4330 1 1 15 GLY N N 4.973 -5.288 6.800 1.00 . A A . 15 GLY N 1 1 9 4331 1 1 15 GLY O O 3.302 -6.929 5.436 1.00 . A A . 15 GLY O 1 1 9 4332 1 1 16 PRO C C 0.408 -6.095 4.373 1.00 . A A . 16 PRO C 1 1 9 4333 1 1 16 PRO CA C 0.507 -6.811 5.709 1.00 . A A . 16 PRO CA 1 1 9 4334 1 1 16 PRO CB C -0.824 -6.695 6.479 1.00 . A A . 16 PRO CB 1 1 9 4335 1 1 16 PRO CD C 0.837 -5.369 7.608 1.00 . A A . 16 PRO CD 1 1 9 4336 1 1 16 PRO CG C -0.481 -6.059 7.794 1.00 . A A . 16 PRO CG 1 1 9 4337 1 1 16 PRO HA H 0.742 -7.851 5.541 1.00 . A A . 16 PRO HA 1 1 9 4338 1 1 16 PRO HB2 H -1.508 -6.081 5.913 1.00 . A A . 16 PRO HB2 1 1 9 4339 1 1 16 PRO HB3 H -1.250 -7.677 6.614 1.00 . A A . 16 PRO HB3 1 1 9 4340 1 1 16 PRO HD2 H 0.684 -4.358 7.257 1.00 . A A . 16 PRO HD2 1 1 9 4341 1 1 16 PRO HD3 H 1.400 -5.379 8.530 1.00 . A A . 16 PRO HD3 1 1 9 4342 1 1 16 PRO HG2 H -1.242 -5.343 8.065 1.00 . A A . 16 PRO HG2 1 1 9 4343 1 1 16 PRO HG3 H -0.400 -6.817 8.558 1.00 . A A . 16 PRO HG3 1 1 9 4344 1 1 16 PRO N N 1.489 -6.185 6.579 1.00 . A A . 16 PRO N 1 1 9 4345 1 1 16 PRO O O -0.154 -5.008 4.272 1.00 . A A . 16 PRO O 1 1 9 4346 1 1 17 THR C C -0.262 -6.447 1.253 1.00 . A A . 17 THR C 1 1 9 4347 1 1 17 THR CA C 1.002 -6.124 2.051 1.00 . A A . 17 THR CA 1 1 9 4348 1 1 17 THR CB C 2.234 -6.639 1.305 1.00 . A A . 17 THR CB 1 1 9 4349 1 1 17 THR CG2 C 3.492 -5.932 1.775 1.00 . A A . 17 THR CG2 1 1 9 4350 1 1 17 THR H H 1.441 -7.549 3.505 1.00 . A A . 17 THR H 1 1 9 4351 1 1 17 THR HA H 1.101 -5.052 2.147 1.00 . A A . 17 THR HA 1 1 9 4352 1 1 17 THR HB H 2.096 -6.469 0.247 1.00 . A A . 17 THR HB 1 1 9 4353 1 1 17 THR HG1 H 2.738 -8.442 0.740 1.00 . A A . 17 THR HG1 1 1 9 4354 1 1 17 THR HG21 H 3.648 -6.130 2.825 1.00 . A A . 17 THR HG21 1 1 9 4355 1 1 17 THR HG22 H 3.379 -4.868 1.625 1.00 . A A . 17 THR HG22 1 1 9 4356 1 1 17 THR HG23 H 4.336 -6.289 1.206 1.00 . A A . 17 THR HG23 1 1 9 4357 1 1 17 THR N N 0.976 -6.694 3.369 1.00 . A A . 17 THR N 1 1 9 4358 1 1 17 THR O O -0.540 -5.814 0.235 1.00 . A A . 17 THR O 1 1 9 4359 1 1 17 THR OG1 O 2.361 -8.060 1.541 1.00 . A A . 17 THR OG1 1 1 9 4360 1 1 18 VAL C C -3.316 -6.799 1.093 1.00 . A A . 18 VAL C 1 1 9 4361 1 1 18 VAL CA C -2.228 -7.869 1.023 1.00 . A A . 18 VAL CA 1 1 9 4362 1 1 18 VAL CB C -2.772 -9.203 1.613 1.00 . A A . 18 VAL CB 1 1 9 4363 1 1 18 VAL CG1 C -3.964 -9.716 0.811 1.00 . A A . 18 VAL CG1 1 1 9 4364 1 1 18 VAL CG2 C -1.674 -10.258 1.674 1.00 . A A . 18 VAL CG2 1 1 9 4365 1 1 18 VAL H H -0.767 -7.830 2.572 1.00 . A A . 18 VAL H 1 1 9 4366 1 1 18 VAL HA H -1.963 -8.029 -0.012 1.00 . A A . 18 VAL HA 1 1 9 4367 1 1 18 VAL HB H -3.110 -9.005 2.619 1.00 . A A . 18 VAL HB 1 1 9 4368 1 1 18 VAL HG11 H -4.751 -8.975 0.827 1.00 . A A . 18 VAL HG11 1 1 9 4369 1 1 18 VAL HG12 H -4.325 -10.638 1.243 1.00 . A A . 18 VAL HG12 1 1 9 4370 1 1 18 VAL HG13 H -3.661 -9.896 -0.210 1.00 . A A . 18 VAL HG13 1 1 9 4371 1 1 18 VAL HG21 H -1.296 -10.438 0.679 1.00 . A A . 18 VAL HG21 1 1 9 4372 1 1 18 VAL HG22 H -2.077 -11.175 2.078 1.00 . A A . 18 VAL HG22 1 1 9 4373 1 1 18 VAL HG23 H -0.870 -9.907 2.306 1.00 . A A . 18 VAL HG23 1 1 9 4374 1 1 18 VAL N N -1.027 -7.423 1.722 1.00 . A A . 18 VAL N 1 1 9 4375 1 1 18 VAL O O -3.894 -6.554 2.163 1.00 . A A . 18 VAL O 1 1 9 4376 1 1 19 CYS C C -5.987 -5.718 -0.280 1.00 . A A . 19 CYS C 1 1 9 4377 1 1 19 CYS CA C -4.587 -5.127 -0.122 1.00 . A A . 19 CYS CA 1 1 9 4378 1 1 19 CYS CB C -4.284 -4.177 -1.304 1.00 . A A . 19 CYS CB 1 1 9 4379 1 1 19 CYS H H -3.118 -6.436 -0.853 1.00 . A A . 19 CYS H 1 1 9 4380 1 1 19 CYS HA H -4.551 -4.558 0.796 1.00 . A A . 19 CYS HA 1 1 9 4381 1 1 19 CYS HB2 H -4.345 -4.707 -2.242 1.00 . A A . 19 CYS HB2 1 1 9 4382 1 1 19 CYS HB3 H -5.028 -3.393 -1.308 1.00 . A A . 19 CYS HB3 1 1 9 4383 1 1 19 CYS N N -3.592 -6.180 -0.036 1.00 . A A . 19 CYS N 1 1 9 4384 1 1 19 CYS O O -6.145 -6.921 -0.571 1.00 . A A . 19 CYS O 1 1 9 4385 1 1 19 CYS SG S -2.642 -3.370 -1.258 1.00 . A A . 19 CYS SG 1 1 9 4386 1 1 20 ALA C C -8.679 -5.630 -1.652 1.00 . A A . 20 ALA C 1 1 9 4387 1 1 20 ALA CA C -8.384 -5.251 -0.203 1.00 . A A . 20 ALA CA 1 1 9 4388 1 1 20 ALA CB C -9.269 -4.092 0.234 1.00 . A A . 20 ALA CB 1 1 9 4389 1 1 20 ALA H H -6.780 -3.975 0.254 1.00 . A A . 20 ALA H 1 1 9 4390 1 1 20 ALA HA H -8.586 -6.098 0.434 1.00 . A A . 20 ALA HA 1 1 9 4391 1 1 20 ALA HB1 H -9.064 -3.850 1.266 1.00 . A A . 20 ALA HB1 1 1 9 4392 1 1 20 ALA HB2 H -10.308 -4.364 0.126 1.00 . A A . 20 ALA HB2 1 1 9 4393 1 1 20 ALA HB3 H -9.060 -3.232 -0.386 1.00 . A A . 20 ALA HB3 1 1 9 4394 1 1 20 ALA N N -6.991 -4.884 -0.050 1.00 . A A . 20 ALA N 1 1 9 4395 1 1 20 ALA O O -7.988 -5.174 -2.580 1.00 . A A . 20 ALA O 1 1 9 4396 1 1 21 SER C C -10.433 -5.768 -4.058 1.00 . A A . 21 SER C 1 1 9 4397 1 1 21 SER CA C -10.054 -6.932 -3.145 1.00 . A A . 21 SER CA 1 1 9 4398 1 1 21 SER CB C -11.208 -7.916 -3.002 1.00 . A A . 21 SER CB 1 1 9 4399 1 1 21 SER H H -10.207 -6.759 -1.073 1.00 . A A . 21 SER H 1 1 9 4400 1 1 21 SER HA H -9.206 -7.449 -3.566 1.00 . A A . 21 SER HA 1 1 9 4401 1 1 21 SER HB2 H -12.087 -7.395 -2.655 1.00 . A A . 21 SER HB2 1 1 9 4402 1 1 21 SER HB3 H -11.411 -8.375 -3.958 1.00 . A A . 21 SER HB3 1 1 9 4403 1 1 21 SER HG H -9.907 -8.941 -1.968 1.00 . A A . 21 SER HG 1 1 9 4404 1 1 21 SER N N -9.681 -6.451 -1.841 1.00 . A A . 21 SER N 1 1 9 4405 1 1 21 SER O O -11.343 -4.982 -3.751 1.00 . A A . 21 SER O 1 1 9 4406 1 1 21 SER OG O -10.870 -8.935 -2.066 1.00 . A A . 21 SER OG 1 1 9 4407 1 1 22 GLY C C -8.956 -3.429 -5.910 1.00 . A A . 22 GLY C 1 1 9 4408 1 1 22 GLY CA C -9.942 -4.565 -6.063 1.00 . A A . 22 GLY CA 1 1 9 4409 1 1 22 GLY H H -8.956 -6.257 -5.297 1.00 . A A . 22 GLY H 1 1 9 4410 1 1 22 GLY HA2 H -9.881 -4.960 -7.065 1.00 . A A . 22 GLY HA2 1 1 9 4411 1 1 22 GLY HA3 H -10.940 -4.188 -5.895 1.00 . A A . 22 GLY HA3 1 1 9 4412 1 1 22 GLY N N -9.691 -5.626 -5.131 1.00 . A A . 22 GLY N 1 1 9 4413 1 1 22 GLY O O -8.900 -2.528 -6.748 1.00 . A A . 22 GLY O 1 1 9 4414 1 1 23 THR C C -5.801 -2.974 -4.865 1.00 . A A . 23 THR C 1 1 9 4415 1 1 23 THR CA C -7.197 -2.419 -4.647 1.00 . A A . 23 THR CA 1 1 9 4416 1 1 23 THR CB C -7.332 -1.768 -3.238 1.00 . A A . 23 THR CB 1 1 9 4417 1 1 23 THR CG2 C -8.736 -1.228 -3.040 1.00 . A A . 23 THR CG2 1 1 9 4418 1 1 23 THR H H -8.211 -4.209 -4.226 1.00 . A A . 23 THR H 1 1 9 4419 1 1 23 THR HA H -7.376 -1.666 -5.402 1.00 . A A . 23 THR HA 1 1 9 4420 1 1 23 THR HB H -6.637 -0.946 -3.164 1.00 . A A . 23 THR HB 1 1 9 4421 1 1 23 THR HG1 H -7.263 -3.606 -2.514 1.00 . A A . 23 THR HG1 1 1 9 4422 1 1 23 THR HG21 H -9.449 -2.033 -3.133 1.00 . A A . 23 THR HG21 1 1 9 4423 1 1 23 THR HG22 H -8.937 -0.474 -3.787 1.00 . A A . 23 THR HG22 1 1 9 4424 1 1 23 THR HG23 H -8.815 -0.792 -2.055 1.00 . A A . 23 THR HG23 1 1 9 4425 1 1 23 THR N N -8.165 -3.462 -4.862 1.00 . A A . 23 THR N 1 1 9 4426 1 1 23 THR O O -5.493 -4.093 -4.432 1.00 . A A . 23 THR O 1 1 9 4427 1 1 23 THR OG1 O -7.060 -2.713 -2.198 1.00 . A A . 23 THR OG1 1 1 9 4428 1 1 24 THR C C -2.582 -1.842 -5.227 1.00 . A A . 24 THR C 1 1 9 4429 1 1 24 THR CA C -3.660 -2.691 -5.883 1.00 . A A . 24 THR CA 1 1 9 4430 1 1 24 THR CB C -3.471 -2.706 -7.417 1.00 . A A . 24 THR CB 1 1 9 4431 1 1 24 THR CG2 C -4.318 -3.803 -8.057 1.00 . A A . 24 THR CG2 1 1 9 4432 1 1 24 THR H H -5.261 -1.329 -5.829 1.00 . A A . 24 THR H 1 1 9 4433 1 1 24 THR HA H -3.573 -3.705 -5.522 1.00 . A A . 24 THR HA 1 1 9 4434 1 1 24 THR HB H -2.429 -2.896 -7.626 1.00 . A A . 24 THR HB 1 1 9 4435 1 1 24 THR HG1 H -4.539 -1.012 -7.448 1.00 . A A . 24 THR HG1 1 1 9 4436 1 1 24 THR HG21 H -4.020 -4.764 -7.665 1.00 . A A . 24 THR HG21 1 1 9 4437 1 1 24 THR HG22 H -4.181 -3.792 -9.128 1.00 . A A . 24 THR HG22 1 1 9 4438 1 1 24 THR HG23 H -5.359 -3.630 -7.828 1.00 . A A . 24 THR HG23 1 1 9 4439 1 1 24 THR N N -4.977 -2.231 -5.544 1.00 . A A . 24 THR N 1 1 9 4440 1 1 24 THR O O -2.673 -0.621 -5.207 1.00 . A A . 24 THR O 1 1 9 4441 1 1 24 THR OG1 O -3.837 -1.416 -7.981 1.00 . A A . 24 THR OG1 1 1 9 4442 1 1 25 CYS C C 0.357 -1.123 -5.125 1.00 . A A . 25 CYS C 1 1 9 4443 1 1 25 CYS CA C -0.470 -1.826 -4.049 1.00 . A A . 25 CYS CA 1 1 9 4444 1 1 25 CYS CB C 0.395 -2.849 -3.290 1.00 . A A . 25 CYS CB 1 1 9 4445 1 1 25 CYS H H -1.625 -3.473 -4.648 1.00 . A A . 25 CYS H 1 1 9 4446 1 1 25 CYS HA H -0.843 -1.091 -3.352 1.00 . A A . 25 CYS HA 1 1 9 4447 1 1 25 CYS HB2 H -0.210 -3.334 -2.539 1.00 . A A . 25 CYS HB2 1 1 9 4448 1 1 25 CYS HB3 H 0.753 -3.590 -3.989 1.00 . A A . 25 CYS HB3 1 1 9 4449 1 1 25 CYS N N -1.597 -2.492 -4.664 1.00 . A A . 25 CYS N 1 1 9 4450 1 1 25 CYS O O 0.937 -1.776 -6.012 1.00 . A A . 25 CYS O 1 1 9 4451 1 1 25 CYS SG S 1.847 -2.135 -2.446 1.00 . A A . 25 CYS SG 1 1 9 4452 1 1 26 GLN C C 2.075 1.898 -5.369 1.00 . A A . 26 GLN C 1 1 9 4453 1 1 26 GLN CA C 1.090 0.975 -6.057 1.00 . A A . 26 GLN CA 1 1 9 4454 1 1 26 GLN CB C 0.142 1.747 -6.977 1.00 . A A . 26 GLN CB 1 1 9 4455 1 1 26 GLN CD C -1.619 1.574 -8.796 1.00 . A A . 26 GLN CD 1 1 9 4456 1 1 26 GLN CG C -0.738 0.834 -7.820 1.00 . A A . 26 GLN CG 1 1 9 4457 1 1 26 GLN H H -0.175 0.669 -4.421 1.00 . A A . 26 GLN H 1 1 9 4458 1 1 26 GLN HA H 1.659 0.283 -6.658 1.00 . A A . 26 GLN HA 1 1 9 4459 1 1 26 GLN HB2 H -0.491 2.374 -6.367 1.00 . A A . 26 GLN HB2 1 1 9 4460 1 1 26 GLN HB3 H 0.720 2.370 -7.641 1.00 . A A . 26 GLN HB3 1 1 9 4461 1 1 26 GLN HE21 H -2.982 0.144 -8.679 1.00 . A A . 26 GLN HE21 1 1 9 4462 1 1 26 GLN HE22 H -3.322 1.462 -9.752 1.00 . A A . 26 GLN HE22 1 1 9 4463 1 1 26 GLN HG2 H -0.106 0.160 -8.376 1.00 . A A . 26 GLN HG2 1 1 9 4464 1 1 26 GLN HG3 H -1.366 0.259 -7.154 1.00 . A A . 26 GLN HG3 1 1 9 4465 1 1 26 GLN N N 0.355 0.190 -5.100 1.00 . A A . 26 GLN N 1 1 9 4466 1 1 26 GLN NE2 N -2.752 1.008 -9.098 1.00 . A A . 26 GLN NE2 1 1 9 4467 1 1 26 GLN O O 1.755 2.535 -4.356 1.00 . A A . 26 GLN O 1 1 9 4468 1 1 26 GLN OE1 O -1.276 2.655 -9.280 1.00 . A A . 26 GLN OE1 1 1 9 4469 1 1 27 VAL C C 4.149 4.203 -5.777 1.00 . A A . 27 VAL C 1 1 9 4470 1 1 27 VAL CA C 4.352 2.746 -5.367 1.00 . A A . 27 VAL CA 1 1 9 4471 1 1 27 VAL CB C 5.726 2.232 -5.906 1.00 . A A . 27 VAL CB 1 1 9 4472 1 1 27 VAL CG1 C 6.891 3.029 -5.355 1.00 . A A . 27 VAL CG1 1 1 9 4473 1 1 27 VAL CG2 C 5.910 0.756 -5.598 1.00 . A A . 27 VAL CG2 1 1 9 4474 1 1 27 VAL H H 3.460 1.423 -6.714 1.00 . A A . 27 VAL H 1 1 9 4475 1 1 27 VAL HA H 4.342 2.661 -4.291 1.00 . A A . 27 VAL HA 1 1 9 4476 1 1 27 VAL HB H 5.726 2.349 -6.979 1.00 . A A . 27 VAL HB 1 1 9 4477 1 1 27 VAL HG11 H 6.786 4.066 -5.637 1.00 . A A . 27 VAL HG11 1 1 9 4478 1 1 27 VAL HG12 H 7.817 2.646 -5.758 1.00 . A A . 27 VAL HG12 1 1 9 4479 1 1 27 VAL HG13 H 6.909 2.950 -4.278 1.00 . A A . 27 VAL HG13 1 1 9 4480 1 1 27 VAL HG21 H 6.858 0.421 -5.994 1.00 . A A . 27 VAL HG21 1 1 9 4481 1 1 27 VAL HG22 H 5.110 0.187 -6.047 1.00 . A A . 27 VAL HG22 1 1 9 4482 1 1 27 VAL HG23 H 5.896 0.615 -4.529 1.00 . A A . 27 VAL HG23 1 1 9 4483 1 1 27 VAL N N 3.271 1.941 -5.902 1.00 . A A . 27 VAL N 1 1 9 4484 1 1 27 VAL O O 4.359 4.564 -6.939 1.00 . A A . 27 VAL O 1 1 9 4485 1 1 28 LEU C C 4.750 7.176 -4.986 1.00 . A A . 28 LEU C 1 1 9 4486 1 1 28 LEU CA C 3.446 6.434 -5.142 1.00 . A A . 28 LEU CA 1 1 9 4487 1 1 28 LEU CB C 2.403 7.038 -4.186 1.00 . A A . 28 LEU CB 1 1 9 4488 1 1 28 LEU CD1 C 0.103 7.159 -3.212 1.00 . A A . 28 LEU CD1 1 1 9 4489 1 1 28 LEU CD2 C 0.400 6.346 -5.544 1.00 . A A . 28 LEU CD2 1 1 9 4490 1 1 28 LEU CG C 1.011 6.394 -4.156 1.00 . A A . 28 LEU CG 1 1 9 4491 1 1 28 LEU H H 3.509 4.670 -3.952 1.00 . A A . 28 LEU H 1 1 9 4492 1 1 28 LEU HA H 3.103 6.525 -6.161 1.00 . A A . 28 LEU HA 1 1 9 4493 1 1 28 LEU HB2 H 2.810 6.997 -3.186 1.00 . A A . 28 LEU HB2 1 1 9 4494 1 1 28 LEU HB3 H 2.279 8.077 -4.454 1.00 . A A . 28 LEU HB3 1 1 9 4495 1 1 28 LEU HD11 H 0.516 7.135 -2.214 1.00 . A A . 28 LEU HD11 1 1 9 4496 1 1 28 LEU HD12 H -0.877 6.706 -3.210 1.00 . A A . 28 LEU HD12 1 1 9 4497 1 1 28 LEU HD13 H 0.022 8.183 -3.543 1.00 . A A . 28 LEU HD13 1 1 9 4498 1 1 28 LEU HD21 H 1.022 5.737 -6.183 1.00 . A A . 28 LEU HD21 1 1 9 4499 1 1 28 LEU HD22 H 0.338 7.347 -5.945 1.00 . A A . 28 LEU HD22 1 1 9 4500 1 1 28 LEU HD23 H -0.587 5.912 -5.480 1.00 . A A . 28 LEU HD23 1 1 9 4501 1 1 28 LEU HG H 1.102 5.385 -3.783 1.00 . A A . 28 LEU HG 1 1 9 4502 1 1 28 LEU N N 3.680 5.019 -4.854 1.00 . A A . 28 LEU N 1 1 9 4503 1 1 28 LEU O O 5.140 7.991 -5.826 1.00 . A A . 28 LEU O 1 1 9 4504 1 1 29 ASN C C 7.544 6.198 -3.295 1.00 . A A . 29 ASN C 1 1 9 4505 1 1 29 ASN CA C 6.698 7.400 -3.580 1.00 . A A . 29 ASN CA 1 1 9 4506 1 1 29 ASN CB C 6.609 8.253 -2.303 1.00 . A A . 29 ASN CB 1 1 9 4507 1 1 29 ASN CG C 5.698 9.456 -2.389 1.00 . A A . 29 ASN CG 1 1 9 4508 1 1 29 ASN H H 5.065 6.158 -3.327 1.00 . A A . 29 ASN H 1 1 9 4509 1 1 29 ASN HA H 7.090 7.976 -4.405 1.00 . A A . 29 ASN HA 1 1 9 4510 1 1 29 ASN HB2 H 6.249 7.624 -1.503 1.00 . A A . 29 ASN HB2 1 1 9 4511 1 1 29 ASN HB3 H 7.608 8.590 -2.068 1.00 . A A . 29 ASN HB3 1 1 9 4512 1 1 29 ASN HD21 H 5.285 9.295 -0.467 1.00 . A A . 29 ASN HD21 1 1 9 4513 1 1 29 ASN HD22 H 4.497 10.585 -1.289 1.00 . A A . 29 ASN HD22 1 1 9 4514 1 1 29 ASN N N 5.417 6.856 -3.924 1.00 . A A . 29 ASN N 1 1 9 4515 1 1 29 ASN ND2 N 5.105 9.816 -1.278 1.00 . A A . 29 ASN ND2 1 1 9 4516 1 1 29 ASN O O 6.982 5.132 -3.101 1.00 . A A . 29 ASN O 1 1 9 4517 1 1 29 ASN OD1 O 5.531 10.060 -3.442 1.00 . A A . 29 ASN OD1 1 1 9 4518 1 1 30 PRO C C 9.379 4.448 -1.668 1.00 . A A . 30 PRO C 1 1 9 4519 1 1 30 PRO CA C 9.734 5.140 -2.987 1.00 . A A . 30 PRO CA 1 1 9 4520 1 1 30 PRO CB C 11.144 5.735 -2.911 1.00 . A A . 30 PRO CB 1 1 9 4521 1 1 30 PRO CD C 9.673 7.531 -3.449 1.00 . A A . 30 PRO CD 1 1 9 4522 1 1 30 PRO CG C 11.057 7.001 -3.682 1.00 . A A . 30 PRO CG 1 1 9 4523 1 1 30 PRO HA H 9.678 4.426 -3.794 1.00 . A A . 30 PRO HA 1 1 9 4524 1 1 30 PRO HB2 H 11.400 5.914 -1.878 1.00 . A A . 30 PRO HB2 1 1 9 4525 1 1 30 PRO HB3 H 11.858 5.054 -3.350 1.00 . A A . 30 PRO HB3 1 1 9 4526 1 1 30 PRO HD2 H 9.653 8.149 -2.565 1.00 . A A . 30 PRO HD2 1 1 9 4527 1 1 30 PRO HD3 H 9.312 8.088 -4.300 1.00 . A A . 30 PRO HD3 1 1 9 4528 1 1 30 PRO HG2 H 11.792 7.698 -3.307 1.00 . A A . 30 PRO HG2 1 1 9 4529 1 1 30 PRO HG3 H 11.221 6.813 -4.733 1.00 . A A . 30 PRO HG3 1 1 9 4530 1 1 30 PRO N N 8.879 6.305 -3.245 1.00 . A A . 30 PRO N 1 1 9 4531 1 1 30 PRO O O 9.337 3.215 -1.581 1.00 . A A . 30 PRO O 1 1 9 4532 1 1 31 TYR C C 7.287 4.508 0.847 1.00 . A A . 31 TYR C 1 1 9 4533 1 1 31 TYR CA C 8.798 4.631 0.625 1.00 . A A . 31 TYR CA 1 1 9 4534 1 1 31 TYR CB C 9.436 5.481 1.749 1.00 . A A . 31 TYR CB 1 1 9 4535 1 1 31 TYR CD1 C 11.583 6.451 0.781 1.00 . A A . 31 TYR CD1 1 1 9 4536 1 1 31 TYR CD2 C 11.769 4.857 2.529 1.00 . A A . 31 TYR CD2 1 1 9 4537 1 1 31 TYR CE1 C 12.956 6.554 0.722 1.00 . A A . 31 TYR CE1 1 1 9 4538 1 1 31 TYR CE2 C 13.143 4.953 2.478 1.00 . A A . 31 TYR CE2 1 1 9 4539 1 1 31 TYR CG C 10.961 5.597 1.683 1.00 . A A . 31 TYR CG 1 1 9 4540 1 1 31 TYR CZ C 13.731 5.802 1.573 1.00 . A A . 31 TYR CZ 1 1 9 4541 1 1 31 TYR H H 9.061 6.203 -0.767 1.00 . A A . 31 TYR H 1 1 9 4542 1 1 31 TYR HA H 9.245 3.649 0.651 1.00 . A A . 31 TYR HA 1 1 9 4543 1 1 31 TYR HB2 H 9.035 6.483 1.706 1.00 . A A . 31 TYR HB2 1 1 9 4544 1 1 31 TYR HB3 H 9.175 5.047 2.702 1.00 . A A . 31 TYR HB3 1 1 9 4545 1 1 31 TYR HD1 H 10.972 7.035 0.111 1.00 . A A . 31 TYR HD1 1 1 9 4546 1 1 31 TYR HD2 H 11.306 4.188 3.240 1.00 . A A . 31 TYR HD2 1 1 9 4547 1 1 31 TYR HE1 H 13.417 7.223 0.012 1.00 . A A . 31 TYR HE1 1 1 9 4548 1 1 31 TYR HE2 H 13.749 4.360 3.147 1.00 . A A . 31 TYR HE2 1 1 9 4549 1 1 31 TYR HH H 15.438 4.990 1.537 1.00 . A A . 31 TYR HH 1 1 9 4550 1 1 31 TYR N N 9.086 5.230 -0.647 1.00 . A A . 31 TYR N 1 1 9 4551 1 1 31 TYR O O 6.828 3.589 1.537 1.00 . A A . 31 TYR O 1 1 9 4552 1 1 31 TYR OH O 15.106 5.899 1.518 1.00 . A A . 31 TYR OH 1 1 9 4553 1 1 32 TYR C C 4.440 4.516 -0.791 1.00 . A A . 32 TYR C 1 1 9 4554 1 1 32 TYR CA C 5.075 5.281 0.372 1.00 . A A . 32 TYR CA 1 1 9 4555 1 1 32 TYR CB C 4.409 6.651 0.565 1.00 . A A . 32 TYR CB 1 1 9 4556 1 1 32 TYR CD1 C 1.900 6.651 0.183 1.00 . A A . 32 TYR CD1 1 1 9 4557 1 1 32 TYR CD2 C 2.711 6.334 2.398 1.00 . A A . 32 TYR CD2 1 1 9 4558 1 1 32 TYR CE1 C 0.601 6.536 0.643 1.00 . A A . 32 TYR CE1 1 1 9 4559 1 1 32 TYR CE2 C 1.420 6.222 2.865 1.00 . A A . 32 TYR CE2 1 1 9 4560 1 1 32 TYR CG C 2.977 6.550 1.053 1.00 . A A . 32 TYR CG 1 1 9 4561 1 1 32 TYR CZ C 0.369 6.319 1.985 1.00 . A A . 32 TYR CZ 1 1 9 4562 1 1 32 TYR H H 6.901 6.103 -0.289 1.00 . A A . 32 TYR H 1 1 9 4563 1 1 32 TYR HA H 4.900 4.695 1.262 1.00 . A A . 32 TYR HA 1 1 9 4564 1 1 32 TYR HB2 H 4.971 7.219 1.292 1.00 . A A . 32 TYR HB2 1 1 9 4565 1 1 32 TYR HB3 H 4.406 7.181 -0.376 1.00 . A A . 32 TYR HB3 1 1 9 4566 1 1 32 TYR HD1 H 2.087 6.819 -0.869 1.00 . A A . 32 TYR HD1 1 1 9 4567 1 1 32 TYR HD2 H 3.541 6.259 3.086 1.00 . A A . 32 TYR HD2 1 1 9 4568 1 1 32 TYR HE1 H -0.227 6.622 -0.044 1.00 . A A . 32 TYR HE1 1 1 9 4569 1 1 32 TYR HE2 H 1.238 6.052 3.916 1.00 . A A . 32 TYR HE2 1 1 9 4570 1 1 32 TYR HH H -1.368 5.496 1.960 1.00 . A A . 32 TYR HH 1 1 9 4571 1 1 32 TYR N N 6.507 5.383 0.243 1.00 . A A . 32 TYR N 1 1 9 4572 1 1 32 TYR O O 4.403 5.008 -1.930 1.00 . A A . 32 TYR O 1 1 9 4573 1 1 32 TYR OH O -0.925 6.194 2.451 1.00 . A A . 32 TYR OH 1 1 9 4574 1 1 33 SER C C 1.742 2.470 -0.942 1.00 . A A . 33 SER C 1 1 9 4575 1 1 33 SER CA C 3.158 2.622 -1.470 1.00 . A A . 33 SER CA 1 1 9 4576 1 1 33 SER CB C 3.833 1.268 -1.695 1.00 . A A . 33 SER CB 1 1 9 4577 1 1 33 SER H H 3.966 3.024 0.408 1.00 . A A . 33 SER H 1 1 9 4578 1 1 33 SER HA H 3.132 3.187 -2.390 1.00 . A A . 33 SER HA 1 1 9 4579 1 1 33 SER HB2 H 3.769 0.679 -0.793 1.00 . A A . 33 SER HB2 1 1 9 4580 1 1 33 SER HB3 H 3.341 0.751 -2.505 1.00 . A A . 33 SER HB3 1 1 9 4581 1 1 33 SER HG H 5.511 0.717 -2.582 1.00 . A A . 33 SER HG 1 1 9 4582 1 1 33 SER N N 3.887 3.384 -0.497 1.00 . A A . 33 SER N 1 1 9 4583 1 1 33 SER O O 1.558 2.157 0.235 1.00 . A A . 33 SER O 1 1 9 4584 1 1 33 SER OG O 5.203 1.448 -2.036 1.00 . A A . 33 SER OG 1 1 9 4585 1 1 34 GLN C C -1.471 1.785 -2.154 1.00 . A A . 34 GLN C 1 1 9 4586 1 1 34 GLN CA C -0.614 2.741 -1.344 1.00 . A A . 34 GLN CA 1 1 9 4587 1 1 34 GLN CB C -1.110 4.190 -1.474 1.00 . A A . 34 GLN CB 1 1 9 4588 1 1 34 GLN CD C -2.940 5.908 -1.221 1.00 . A A . 34 GLN CD 1 1 9 4589 1 1 34 GLN CG C -2.579 4.430 -1.183 1.00 . A A . 34 GLN CG 1 1 9 4590 1 1 34 GLN H H 0.969 2.819 -2.732 1.00 . A A . 34 GLN H 1 1 9 4591 1 1 34 GLN HA H -0.658 2.460 -0.304 1.00 . A A . 34 GLN HA 1 1 9 4592 1 1 34 GLN HB2 H -0.543 4.790 -0.780 1.00 . A A . 34 GLN HB2 1 1 9 4593 1 1 34 GLN HB3 H -0.900 4.527 -2.479 1.00 . A A . 34 GLN HB3 1 1 9 4594 1 1 34 GLN HE21 H -2.727 6.069 0.747 1.00 . A A . 34 GLN HE21 1 1 9 4595 1 1 34 GLN HE22 H -3.135 7.505 -0.096 1.00 . A A . 34 GLN HE22 1 1 9 4596 1 1 34 GLN HG2 H -3.171 3.908 -1.923 1.00 . A A . 34 GLN HG2 1 1 9 4597 1 1 34 GLN HG3 H -2.805 4.045 -0.199 1.00 . A A . 34 GLN HG3 1 1 9 4598 1 1 34 GLN N N 0.768 2.700 -1.773 1.00 . A A . 34 GLN N 1 1 9 4599 1 1 34 GLN NE2 N -2.937 6.546 -0.084 1.00 . A A . 34 GLN NE2 1 1 9 4600 1 1 34 GLN O O -1.225 1.581 -3.336 1.00 . A A . 34 GLN O 1 1 9 4601 1 1 34 GLN OE1 O -3.278 6.456 -2.255 1.00 . A A . 34 GLN OE1 1 1 9 4602 1 1 35 CYS C C -4.412 1.161 -2.859 1.00 . A A . 35 CYS C 1 1 9 4603 1 1 35 CYS CA C -3.367 0.303 -2.176 1.00 . A A . 35 CYS CA 1 1 9 4604 1 1 35 CYS CB C -4.056 -0.640 -1.189 1.00 . A A . 35 CYS CB 1 1 9 4605 1 1 35 CYS H H -2.519 1.260 -0.530 1.00 . A A . 35 CYS H 1 1 9 4606 1 1 35 CYS HA H -2.836 -0.279 -2.915 1.00 . A A . 35 CYS HA 1 1 9 4607 1 1 35 CYS HB2 H -4.665 -0.061 -0.511 1.00 . A A . 35 CYS HB2 1 1 9 4608 1 1 35 CYS HB3 H -4.693 -1.297 -1.754 1.00 . A A . 35 CYS HB3 1 1 9 4609 1 1 35 CYS N N -2.432 1.159 -1.501 1.00 . A A . 35 CYS N 1 1 9 4610 1 1 35 CYS O O -5.242 1.801 -2.183 1.00 . A A . 35 CYS O 1 1 9 4611 1 1 35 CYS SG S -2.931 -1.662 -0.188 1.00 . A A . 35 CYS SG 1 1 9 4612 1 1 36 LEU C C -6.203 0.948 -5.587 1.00 . A A . 36 LEU C 1 1 9 4613 1 1 36 LEU CA C -5.264 1.937 -4.976 1.00 . A A . 36 LEU CA 1 1 9 4614 1 1 36 LEU CB C -4.547 2.729 -6.079 1.00 . A A . 36 LEU CB 1 1 9 4615 1 1 36 LEU CD1 C -2.974 4.526 -6.818 1.00 . A A . 36 LEU CD1 1 1 9 4616 1 1 36 LEU CD2 C -4.431 4.894 -4.832 1.00 . A A . 36 LEU CD2 1 1 9 4617 1 1 36 LEU CG C -3.637 3.868 -5.620 1.00 . A A . 36 LEU CG 1 1 9 4618 1 1 36 LEU H H -3.621 0.725 -4.622 1.00 . A A . 36 LEU H 1 1 9 4619 1 1 36 LEU HA H -5.822 2.616 -4.350 1.00 . A A . 36 LEU HA 1 1 9 4620 1 1 36 LEU HB2 H -3.949 2.036 -6.653 1.00 . A A . 36 LEU HB2 1 1 9 4621 1 1 36 LEU HB3 H -5.299 3.143 -6.734 1.00 . A A . 36 LEU HB3 1 1 9 4622 1 1 36 LEU HD11 H -2.349 5.340 -6.489 1.00 . A A . 36 LEU HD11 1 1 9 4623 1 1 36 LEU HD12 H -3.735 4.898 -7.487 1.00 . A A . 36 LEU HD12 1 1 9 4624 1 1 36 LEU HD13 H -2.371 3.796 -7.338 1.00 . A A . 36 LEU HD13 1 1 9 4625 1 1 36 LEU HD21 H -3.780 5.706 -4.542 1.00 . A A . 36 LEU HD21 1 1 9 4626 1 1 36 LEU HD22 H -4.841 4.436 -3.946 1.00 . A A . 36 LEU HD22 1 1 9 4627 1 1 36 LEU HD23 H -5.233 5.280 -5.444 1.00 . A A . 36 LEU HD23 1 1 9 4628 1 1 36 LEU HG H -2.860 3.473 -4.981 1.00 . A A . 36 LEU HG 1 1 9 4629 1 1 36 LEU N N -4.336 1.219 -4.158 1.00 . A A . 36 LEU N 1 1 9 4630 1 1 36 LEU O O -7.342 0.864 -5.136 1.00 . A A . 36 LEU O 1 1 9 4631 1 1 36 LEU OXT O -5.771 0.184 -6.487 1.00 . A A . 36 LEU OXT 1 1 9 4632 2 2 1 MAN C1 C 10.817 -4.610 7.529 1.00 . B A . 101 MAN C1 1 1 9 4633 2 2 1 MAN C2 C 10.901 -4.561 9.096 1.00 . B A . 101 MAN C2 1 1 9 4634 2 2 1 MAN C3 C 11.707 -3.350 9.582 1.00 . B A . 101 MAN C3 1 1 9 4635 2 2 1 MAN C4 C 11.520 -2.150 8.649 1.00 . B A . 101 MAN C4 1 1 9 4636 2 2 1 MAN C5 C 11.961 -2.508 7.195 1.00 . B A . 101 MAN C5 1 1 9 4637 2 2 1 MAN C6 C 13.352 -2.001 6.833 1.00 . B A . 101 MAN C6 1 1 9 4638 2 2 1 MAN H1 H 10.882 -5.667 7.232 1.00 . B A . 101 MAN H1 1 1 9 4639 2 2 1 MAN H2 H 9.894 -4.532 9.533 1.00 . B A . 101 MAN H2 1 1 9 4640 2 2 1 MAN H3 H 11.311 -3.126 10.584 1.00 . B A . 101 MAN H3 1 1 9 4641 2 2 1 MAN H4 H 12.144 -1.320 9.010 1.00 . B A . 101 MAN H4 1 1 9 4642 2 2 1 MAN H5 H 11.222 -2.044 6.526 1.00 . B A . 101 MAN H5 1 1 9 4643 2 2 1 MAN H61 H 13.377 -0.924 7.049 1.00 . B A . 101 MAN H61 1 1 9 4644 2 2 1 MAN H62 H 13.520 -2.133 5.755 1.00 . B A . 101 MAN H62 1 1 9 4645 2 2 1 MAN HO2 H 11.101 -6.496 9.239 1.00 . B A . 101 MAN HO2 1 1 9 4646 2 2 1 MAN HO3 H 12.976 -4.592 10.161 1.00 . B A . 101 MAN HO3 1 1 9 4647 2 2 1 MAN HO4 H 10.039 -0.996 8.067 1.00 . B A . 101 MAN HO4 1 1 9 4648 2 2 1 MAN HO6 H 13.905 -3.207 8.255 1.00 . B A . 101 MAN HO6 1 1 9 4649 2 2 1 MAN O2 O 11.586 -5.722 9.548 1.00 . B A . 101 MAN O2 1 1 9 4650 2 2 1 MAN O3 O 13.062 -3.740 9.706 1.00 . B A . 101 MAN O3 1 1 9 4651 2 2 1 MAN O4 O 10.153 -1.754 8.659 1.00 . B A . 101 MAN O4 1 1 9 4652 2 2 1 MAN O5 O 11.950 -3.957 6.976 1.00 . B A . 101 MAN O5 1 1 9 4653 2 2 1 MAN O6 O 14.353 -2.672 7.581 1.00 . B A . 101 MAN O6 1 1 10 4654 1 1 1 THR C C -5.483 -5.841 4.894 1.00 . A A . 1 THR C 1 1 10 4655 1 1 1 THR CA C -5.590 -7.343 4.624 1.00 . A A . 1 THR CA 1 1 10 4656 1 1 1 THR CB C -6.999 -7.691 4.136 1.00 . A A . 1 THR CB 1 1 10 4657 1 1 1 THR CG2 C -7.214 -7.202 2.718 1.00 . A A . 1 THR CG2 1 1 10 4658 1 1 1 THR H1 H -5.410 -9.079 5.643 1.00 . A A . 1 THR H1 1 1 10 4659 1 1 1 THR H2 H -6.048 -7.790 6.545 1.00 . A A . 1 THR H2 1 1 10 4660 1 1 1 THR H3 H -4.395 -7.845 6.215 1.00 . A A . 1 THR H3 1 1 10 4661 1 1 1 THR HA H -4.870 -7.634 3.872 1.00 . A A . 1 THR HA 1 1 10 4662 1 1 1 THR HB H -7.724 -7.231 4.792 1.00 . A A . 1 THR HB 1 1 10 4663 1 1 1 THR HG1 H -7.786 -9.377 3.489 1.00 . A A . 1 THR HG1 1 1 10 4664 1 1 1 THR HG21 H -7.085 -6.131 2.680 1.00 . A A . 1 THR HG21 1 1 10 4665 1 1 1 THR HG22 H -8.216 -7.454 2.400 1.00 . A A . 1 THR HG22 1 1 10 4666 1 1 1 THR HG23 H -6.499 -7.672 2.059 1.00 . A A . 1 THR HG23 1 1 10 4667 1 1 1 THR N N -5.335 -8.061 5.839 1.00 . A A . 1 THR N 1 1 10 4668 1 1 1 THR O O -6.165 -5.306 5.774 1.00 . A A . 1 THR O 1 1 10 4669 1 1 1 THR OG1 O -7.151 -9.119 4.166 1.00 . A A . 1 THR OG1 1 1 10 4670 1 1 2 GLN C C -5.437 -3.034 3.395 1.00 . A A . 2 GLN C 1 1 10 4671 1 1 2 GLN CA C -4.433 -3.758 4.325 1.00 . A A . 2 GLN CA 1 1 10 4672 1 1 2 GLN CB C -2.946 -3.425 4.029 1.00 . A A . 2 GLN CB 1 1 10 4673 1 1 2 GLN CD C -2.973 -0.881 4.267 1.00 . A A . 2 GLN CD 1 1 10 4674 1 1 2 GLN CG C -2.406 -2.187 4.763 1.00 . A A . 2 GLN CG 1 1 10 4675 1 1 2 GLN H H -4.162 -5.633 3.424 1.00 . A A . 2 GLN H 1 1 10 4676 1 1 2 GLN HA H -4.676 -3.519 5.349 1.00 . A A . 2 GLN HA 1 1 10 4677 1 1 2 GLN HB2 H -2.350 -4.276 4.326 1.00 . A A . 2 GLN HB2 1 1 10 4678 1 1 2 GLN HB3 H -2.828 -3.281 2.966 1.00 . A A . 2 GLN HB3 1 1 10 4679 1 1 2 GLN HE21 H -3.014 -1.549 2.406 1.00 . A A . 2 GLN HE21 1 1 10 4680 1 1 2 GLN HE22 H -3.620 0.033 2.656 1.00 . A A . 2 GLN HE22 1 1 10 4681 1 1 2 GLN HG2 H -2.674 -2.285 5.805 1.00 . A A . 2 GLN HG2 1 1 10 4682 1 1 2 GLN HG3 H -1.327 -2.169 4.690 1.00 . A A . 2 GLN HG3 1 1 10 4683 1 1 2 GLN N N -4.640 -5.170 4.151 1.00 . A A . 2 GLN N 1 1 10 4684 1 1 2 GLN NE2 N -3.214 -0.791 2.996 1.00 . A A . 2 GLN NE2 1 1 10 4685 1 1 2 GLN O O -5.634 -3.438 2.245 1.00 . A A . 2 GLN O 1 1 10 4686 1 1 2 GLN OE1 O -3.149 0.064 5.027 1.00 . A A . 2 GLN OE1 1 1 10 4687 1 1 3 SER C C -6.830 -0.247 2.220 1.00 . A A . 3 SER C 1 1 10 4688 1 1 3 SER CA C -7.189 -1.369 3.232 1.00 . A A . 3 SER CA 1 1 10 4689 1 1 3 SER CB C -8.143 -0.869 4.300 1.00 . A A . 3 SER CB 1 1 10 4690 1 1 3 SER H H -5.799 -1.624 4.763 1.00 . A A . 3 SER H 1 1 10 4691 1 1 3 SER HA H -7.710 -2.146 2.693 1.00 . A A . 3 SER HA 1 1 10 4692 1 1 3 SER HB2 H -8.852 -0.182 3.862 1.00 . A A . 3 SER HB2 1 1 10 4693 1 1 3 SER HB3 H -8.669 -1.704 4.738 1.00 . A A . 3 SER HB3 1 1 10 4694 1 1 3 SER HG H -7.224 0.698 5.025 1.00 . A A . 3 SER HG 1 1 10 4695 1 1 3 SER N N -6.070 -2.006 3.902 1.00 . A A . 3 SER N 1 1 10 4696 1 1 3 SER O O -5.680 0.217 2.122 1.00 . A A . 3 SER O 1 1 10 4697 1 1 3 SER OG O -7.417 -0.199 5.329 1.00 . A A . 3 SER OG 1 1 10 4698 1 1 4 HIS C C -7.351 2.530 1.114 1.00 . A A . 4 HIS C 1 1 10 4699 1 1 4 HIS CA C -7.783 1.216 0.465 1.00 . A A . 4 HIS CA 1 1 10 4700 1 1 4 HIS CB C -9.172 1.366 -0.186 1.00 . A A . 4 HIS CB 1 1 10 4701 1 1 4 HIS CD2 C -8.472 2.478 -2.425 1.00 . A A . 4 HIS CD2 1 1 10 4702 1 1 4 HIS CE1 C -10.119 3.883 -2.606 1.00 . A A . 4 HIS CE1 1 1 10 4703 1 1 4 HIS CG C -9.253 2.329 -1.337 1.00 . A A . 4 HIS CG 1 1 10 4704 1 1 4 HIS H H -8.716 -0.282 1.611 1.00 . A A . 4 HIS H 1 1 10 4705 1 1 4 HIS HA H -7.068 0.931 -0.292 1.00 . A A . 4 HIS HA 1 1 10 4706 1 1 4 HIS HB2 H -9.510 0.403 -0.536 1.00 . A A . 4 HIS HB2 1 1 10 4707 1 1 4 HIS HB3 H -9.861 1.702 0.574 1.00 . A A . 4 HIS HB3 1 1 10 4708 1 1 4 HIS HD1 H -11.023 3.345 -0.857 1.00 . A A . 4 HIS HD1 1 1 10 4709 1 1 4 HIS HD2 H -7.561 1.932 -2.625 1.00 . A A . 4 HIS HD2 1 1 10 4710 1 1 4 HIS HE1 H -10.770 4.658 -2.980 1.00 . A A . 4 HIS HE1 1 1 10 4711 1 1 4 HIS HE2 H -8.917 3.504 -4.175 1.00 . A A . 4 HIS HE2 1 1 10 4712 1 1 4 HIS N N -7.851 0.166 1.472 1.00 . A A . 4 HIS N 1 1 10 4713 1 1 4 HIS ND1 N -10.271 3.226 -1.484 1.00 . A A . 4 HIS ND1 1 1 10 4714 1 1 4 HIS NE2 N -9.034 3.451 -3.200 1.00 . A A . 4 HIS NE2 1 1 10 4715 1 1 4 HIS O O -7.899 2.918 2.141 1.00 . A A . 4 HIS O 1 1 10 4716 1 1 5 TYR C C -4.736 4.204 2.114 1.00 . A A . 5 TYR C 1 1 10 4717 1 1 5 TYR CA C -5.734 4.434 0.989 1.00 . A A . 5 TYR CA 1 1 10 4718 1 1 5 TYR CB C -6.735 5.550 1.349 1.00 . A A . 5 TYR CB 1 1 10 4719 1 1 5 TYR CD1 C -6.564 7.082 -0.642 1.00 . A A . 5 TYR CD1 1 1 10 4720 1 1 5 TYR CD2 C -8.684 6.150 -0.125 1.00 . A A . 5 TYR CD2 1 1 10 4721 1 1 5 TYR CE1 C -7.108 7.759 -1.712 1.00 . A A . 5 TYR CE1 1 1 10 4722 1 1 5 TYR CE2 C -9.238 6.822 -1.195 1.00 . A A . 5 TYR CE2 1 1 10 4723 1 1 5 TYR CG C -7.342 6.266 0.168 1.00 . A A . 5 TYR CG 1 1 10 4724 1 1 5 TYR CZ C -8.446 7.622 -1.985 1.00 . A A . 5 TYR CZ 1 1 10 4725 1 1 5 TYR H H -5.993 2.797 -0.332 1.00 . A A . 5 TYR H 1 1 10 4726 1 1 5 TYR HA H -5.138 4.770 0.151 1.00 . A A . 5 TYR HA 1 1 10 4727 1 1 5 TYR HB2 H -7.548 5.100 1.897 1.00 . A A . 5 TYR HB2 1 1 10 4728 1 1 5 TYR HB3 H -6.242 6.276 1.978 1.00 . A A . 5 TYR HB3 1 1 10 4729 1 1 5 TYR HD1 H -5.511 7.182 -0.422 1.00 . A A . 5 TYR HD1 1 1 10 4730 1 1 5 TYR HD2 H -9.305 5.522 0.495 1.00 . A A . 5 TYR HD2 1 1 10 4731 1 1 5 TYR HE1 H -6.484 8.389 -2.328 1.00 . A A . 5 TYR HE1 1 1 10 4732 1 1 5 TYR HE2 H -10.290 6.717 -1.413 1.00 . A A . 5 TYR HE2 1 1 10 4733 1 1 5 TYR HH H -8.411 8.195 -3.814 1.00 . A A . 5 TYR HH 1 1 10 4734 1 1 5 TYR N N -6.355 3.179 0.500 1.00 . A A . 5 TYR N 1 1 10 4735 1 1 5 TYR O O -4.188 5.151 2.676 1.00 . A A . 5 TYR O 1 1 10 4736 1 1 5 TYR OH O -8.999 8.286 -3.056 1.00 . A A . 5 TYR OH 1 1 10 4737 1 1 6 GLY C C -2.144 2.346 2.723 1.00 . A A . 6 GLY C 1 1 10 4738 1 1 6 GLY CA C -3.459 2.664 3.382 1.00 . A A . 6 GLY CA 1 1 10 4739 1 1 6 GLY H H -4.924 2.236 1.943 1.00 . A A . 6 GLY H 1 1 10 4740 1 1 6 GLY HA2 H -3.339 3.512 4.039 1.00 . A A . 6 GLY HA2 1 1 10 4741 1 1 6 GLY HA3 H -3.776 1.807 3.955 1.00 . A A . 6 GLY HA3 1 1 10 4742 1 1 6 GLY N N -4.451 2.966 2.395 1.00 . A A . 6 GLY N 1 1 10 4743 1 1 6 GLY O O -2.122 1.973 1.527 1.00 . A A . 6 GLY O 1 1 10 4744 1 1 7 GLN C C 0.443 0.695 2.916 1.00 . A A . 7 GLN C 1 1 10 4745 1 1 7 GLN CA C 0.257 2.204 2.965 1.00 . A A . 7 GLN CA 1 1 10 4746 1 1 7 GLN CB C 1.321 2.880 3.852 1.00 . A A . 7 GLN CB 1 1 10 4747 1 1 7 GLN CD C 3.757 3.427 4.282 1.00 . A A . 7 GLN CD 1 1 10 4748 1 1 7 GLN CG C 2.765 2.703 3.383 1.00 . A A . 7 GLN CG 1 1 10 4749 1 1 7 GLN H H -1.157 2.742 4.409 1.00 . A A . 7 GLN H 1 1 10 4750 1 1 7 GLN HA H 0.315 2.605 1.963 1.00 . A A . 7 GLN HA 1 1 10 4751 1 1 7 GLN HB2 H 1.115 3.939 3.900 1.00 . A A . 7 GLN HB2 1 1 10 4752 1 1 7 GLN HB3 H 1.245 2.472 4.848 1.00 . A A . 7 GLN HB3 1 1 10 4753 1 1 7 GLN HE21 H 5.062 3.696 2.780 1.00 . A A . 7 GLN HE21 1 1 10 4754 1 1 7 GLN HE22 H 5.532 4.294 4.303 1.00 . A A . 7 GLN HE22 1 1 10 4755 1 1 7 GLN HG2 H 3.006 1.650 3.381 1.00 . A A . 7 GLN HG2 1 1 10 4756 1 1 7 GLN HG3 H 2.856 3.092 2.380 1.00 . A A . 7 GLN HG3 1 1 10 4757 1 1 7 GLN N N -1.063 2.480 3.467 1.00 . A A . 7 GLN N 1 1 10 4758 1 1 7 GLN NE2 N 4.871 3.842 3.731 1.00 . A A . 7 GLN NE2 1 1 10 4759 1 1 7 GLN O O 0.463 0.034 3.941 1.00 . A A . 7 GLN O 1 1 10 4760 1 1 7 GLN OE1 O 3.521 3.601 5.475 1.00 . A A . 7 GLN OE1 1 1 10 4761 1 1 8 CYS C C 2.004 -1.831 1.709 1.00 . A A . 8 CYS C 1 1 10 4762 1 1 8 CYS CA C 0.619 -1.270 1.507 1.00 . A A . 8 CYS CA 1 1 10 4763 1 1 8 CYS CB C 0.133 -1.614 0.115 1.00 . A A . 8 CYS CB 1 1 10 4764 1 1 8 CYS H H 0.597 0.775 0.951 1.00 . A A . 8 CYS H 1 1 10 4765 1 1 8 CYS HA H -0.049 -1.736 2.215 1.00 . A A . 8 CYS HA 1 1 10 4766 1 1 8 CYS HB2 H 0.291 -2.667 -0.065 1.00 . A A . 8 CYS HB2 1 1 10 4767 1 1 8 CYS HB3 H -0.922 -1.398 0.048 1.00 . A A . 8 CYS HB3 1 1 10 4768 1 1 8 CYS N N 0.555 0.169 1.722 1.00 . A A . 8 CYS N 1 1 10 4769 1 1 8 CYS O O 2.168 -3.027 1.896 1.00 . A A . 8 CYS O 1 1 10 4770 1 1 8 CYS SG S 0.970 -0.690 -1.216 1.00 . A A . 8 CYS SG 1 1 10 4771 1 1 9 GLY C C 5.325 -1.001 0.876 1.00 . A A . 9 GLY C 1 1 10 4772 1 1 9 GLY CA C 4.319 -1.516 1.830 1.00 . A A . 9 GLY CA 1 1 10 4773 1 1 9 GLY H H 2.835 -0.069 1.394 1.00 . A A . 9 GLY H 1 1 10 4774 1 1 9 GLY HA2 H 4.643 -1.224 2.815 1.00 . A A . 9 GLY HA2 1 1 10 4775 1 1 9 GLY HA3 H 4.296 -2.595 1.770 1.00 . A A . 9 GLY HA3 1 1 10 4776 1 1 9 GLY N N 3.005 -1.006 1.616 1.00 . A A . 9 GLY N 1 1 10 4777 1 1 9 GLY O O 5.575 -1.599 -0.179 1.00 . A A . 9 GLY O 1 1 10 4778 1 1 10 GLY C C 8.211 0.363 1.256 1.00 . A A . 10 GLY C 1 1 10 4779 1 1 10 GLY CA C 6.972 0.641 0.478 1.00 . A A . 10 GLY CA 1 1 10 4780 1 1 10 GLY H H 5.586 0.578 2.026 1.00 . A A . 10 GLY H 1 1 10 4781 1 1 10 GLY HA2 H 7.013 0.167 -0.491 1.00 . A A . 10 GLY HA2 1 1 10 4782 1 1 10 GLY HA3 H 6.859 1.708 0.364 1.00 . A A . 10 GLY HA3 1 1 10 4783 1 1 10 GLY N N 5.883 0.111 1.220 1.00 . A A . 10 GLY N 1 1 10 4784 1 1 10 GLY O O 8.168 -0.446 2.201 1.00 . A A . 10 GLY O 1 1 10 4785 1 1 11 ILE C C 10.296 1.359 3.107 1.00 . A A . 11 ILE C 1 1 10 4786 1 1 11 ILE CA C 10.510 0.814 1.686 1.00 . A A . 11 ILE CA 1 1 10 4787 1 1 11 ILE CB C 11.723 1.499 1.007 1.00 . A A . 11 ILE CB 1 1 10 4788 1 1 11 ILE CD1 C 12.976 1.632 -1.226 1.00 . A A . 11 ILE CD1 1 1 10 4789 1 1 11 ILE CG1 C 11.899 0.947 -0.417 1.00 . A A . 11 ILE CG1 1 1 10 4790 1 1 11 ILE CG2 C 12.995 1.264 1.832 1.00 . A A . 11 ILE CG2 1 1 10 4791 1 1 11 ILE H H 9.289 1.590 0.144 1.00 . A A . 11 ILE H 1 1 10 4792 1 1 11 ILE HA H 10.690 -0.248 1.757 1.00 . A A . 11 ILE HA 1 1 10 4793 1 1 11 ILE HB H 11.537 2.562 0.954 1.00 . A A . 11 ILE HB 1 1 10 4794 1 1 11 ILE HD11 H 12.731 2.676 -1.342 1.00 . A A . 11 ILE HD11 1 1 10 4795 1 1 11 ILE HD12 H 13.049 1.164 -2.195 1.00 . A A . 11 ILE HD12 1 1 10 4796 1 1 11 ILE HD13 H 13.918 1.541 -0.706 1.00 . A A . 11 ILE HD13 1 1 10 4797 1 1 11 ILE HG12 H 12.150 -0.100 -0.361 1.00 . A A . 11 ILE HG12 1 1 10 4798 1 1 11 ILE HG13 H 10.966 1.053 -0.949 1.00 . A A . 11 ILE HG13 1 1 10 4799 1 1 11 ILE HG21 H 13.180 0.203 1.915 1.00 . A A . 11 ILE HG21 1 1 10 4800 1 1 11 ILE HG22 H 12.868 1.688 2.817 1.00 . A A . 11 ILE HG22 1 1 10 4801 1 1 11 ILE HG23 H 13.833 1.740 1.344 1.00 . A A . 11 ILE HG23 1 1 10 4802 1 1 11 ILE N N 9.295 0.994 0.924 1.00 . A A . 11 ILE N 1 1 10 4803 1 1 11 ILE O O 9.938 2.520 3.295 1.00 . A A . 11 ILE O 1 1 10 4804 1 1 12 GLY C C 8.982 0.254 6.036 1.00 . A A . 12 GLY C 1 1 10 4805 1 1 12 GLY CA C 10.237 0.859 5.448 1.00 . A A . 12 GLY CA 1 1 10 4806 1 1 12 GLY H H 10.582 -0.456 3.842 1.00 . A A . 12 GLY H 1 1 10 4807 1 1 12 GLY HA2 H 11.097 0.524 6.009 1.00 . A A . 12 GLY HA2 1 1 10 4808 1 1 12 GLY HA3 H 10.168 1.934 5.517 1.00 . A A . 12 GLY HA3 1 1 10 4809 1 1 12 GLY N N 10.410 0.485 4.072 1.00 . A A . 12 GLY N 1 1 10 4810 1 1 12 GLY O O 8.922 -0.024 7.227 1.00 . A A . 12 GLY O 1 1 10 4811 1 1 13 TYR C C 6.691 -2.039 5.282 1.00 . A A . 13 TYR C 1 1 10 4812 1 1 13 TYR CA C 6.758 -0.585 5.674 1.00 . A A . 13 TYR CA 1 1 10 4813 1 1 13 TYR CB C 5.530 0.173 5.132 1.00 . A A . 13 TYR CB 1 1 10 4814 1 1 13 TYR CD1 C 3.568 0.381 6.739 1.00 . A A . 13 TYR CD1 1 1 10 4815 1 1 13 TYR CD2 C 3.529 -1.432 5.199 1.00 . A A . 13 TYR CD2 1 1 10 4816 1 1 13 TYR CE1 C 2.349 -0.034 7.250 1.00 . A A . 13 TYR CE1 1 1 10 4817 1 1 13 TYR CE2 C 2.323 -1.853 5.705 1.00 . A A . 13 TYR CE2 1 1 10 4818 1 1 13 TYR CG C 4.182 -0.305 5.702 1.00 . A A . 13 TYR CG 1 1 10 4819 1 1 13 TYR CZ C 1.733 -1.150 6.730 1.00 . A A . 13 TYR CZ 1 1 10 4820 1 1 13 TYR H H 8.124 0.135 4.235 1.00 . A A . 13 TYR H 1 1 10 4821 1 1 13 TYR HA H 6.768 -0.515 6.751 1.00 . A A . 13 TYR HA 1 1 10 4822 1 1 13 TYR HB2 H 5.637 1.219 5.379 1.00 . A A . 13 TYR HB2 1 1 10 4823 1 1 13 TYR HB3 H 5.500 0.077 4.058 1.00 . A A . 13 TYR HB3 1 1 10 4824 1 1 13 TYR HD1 H 4.051 1.258 7.144 1.00 . A A . 13 TYR HD1 1 1 10 4825 1 1 13 TYR HD2 H 3.985 -1.997 4.401 1.00 . A A . 13 TYR HD2 1 1 10 4826 1 1 13 TYR HE1 H 1.884 0.512 8.056 1.00 . A A . 13 TYR HE1 1 1 10 4827 1 1 13 TYR HE2 H 1.848 -2.732 5.290 1.00 . A A . 13 TYR HE2 1 1 10 4828 1 1 13 TYR HH H 0.467 -2.514 7.174 1.00 . A A . 13 TYR HH 1 1 10 4829 1 1 13 TYR N N 8.001 -0.016 5.197 1.00 . A A . 13 TYR N 1 1 10 4830 1 1 13 TYR O O 6.705 -2.379 4.095 1.00 . A A . 13 TYR O 1 1 10 4831 1 1 13 TYR OH O 0.507 -1.554 7.226 1.00 . A A . 13 TYR OH 1 1 10 4832 1 1 14 SER C C 5.419 -4.794 6.931 1.00 . A A . 14 SER C 1 1 10 4833 1 1 14 SER CA C 6.586 -4.302 6.090 1.00 . A A . 14 SER CA 1 1 10 4834 1 1 14 SER CB C 7.925 -5.003 6.487 1.00 . A A . 14 SER CB 1 1 10 4835 1 1 14 SER H H 6.739 -2.537 7.180 1.00 . A A . 14 SER H 1 1 10 4836 1 1 14 SER HA H 6.368 -4.496 5.050 1.00 . A A . 14 SER HA 1 1 10 4837 1 1 14 SER HB2 H 8.286 -4.578 7.411 1.00 . A A . 14 SER HB2 1 1 10 4838 1 1 14 SER HB3 H 7.735 -6.056 6.633 1.00 . A A . 14 SER HB3 1 1 10 4839 1 1 14 SER N N 6.686 -2.877 6.261 1.00 . A A . 14 SER N 1 1 10 4840 1 1 14 SER O O 4.939 -4.059 7.808 1.00 . A A . 14 SER O 1 1 10 4841 1 1 14 SER OG O 8.978 -4.856 5.459 1.00 . A A . 14 SER OG 1 1 10 4842 1 1 15 GLY C C 2.606 -6.657 6.500 1.00 . A A . 15 GLY C 1 1 10 4843 1 1 15 GLY CA C 3.815 -6.501 7.394 1.00 . A A . 15 GLY CA 1 1 10 4844 1 1 15 GLY H H 5.314 -6.527 5.933 1.00 . A A . 15 GLY H 1 1 10 4845 1 1 15 GLY HA2 H 4.085 -7.460 7.813 1.00 . A A . 15 GLY HA2 1 1 10 4846 1 1 15 GLY HA3 H 3.587 -5.814 8.192 1.00 . A A . 15 GLY HA3 1 1 10 4847 1 1 15 GLY N N 4.937 -5.981 6.655 1.00 . A A . 15 GLY N 1 1 10 4848 1 1 15 GLY O O 2.671 -7.423 5.522 1.00 . A A . 15 GLY O 1 1 10 4849 1 1 16 PRO C C 0.530 -5.437 4.567 1.00 . A A . 16 PRO C 1 1 10 4850 1 1 16 PRO CA C 0.279 -6.004 5.956 1.00 . A A . 16 PRO CA 1 1 10 4851 1 1 16 PRO CB C -0.748 -5.148 6.721 1.00 . A A . 16 PRO CB 1 1 10 4852 1 1 16 PRO CD C 1.307 -4.993 7.889 1.00 . A A . 16 PRO CD 1 1 10 4853 1 1 16 PRO CG C -0.176 -5.012 8.085 1.00 . A A . 16 PRO CG 1 1 10 4854 1 1 16 PRO HA H -0.069 -7.021 5.878 1.00 . A A . 16 PRO HA 1 1 10 4855 1 1 16 PRO HB2 H -0.847 -4.187 6.236 1.00 . A A . 16 PRO HB2 1 1 10 4856 1 1 16 PRO HB3 H -1.707 -5.645 6.741 1.00 . A A . 16 PRO HB3 1 1 10 4857 1 1 16 PRO HD2 H 1.609 -3.997 7.597 1.00 . A A . 16 PRO HD2 1 1 10 4858 1 1 16 PRO HD3 H 1.809 -5.323 8.785 1.00 . A A . 16 PRO HD3 1 1 10 4859 1 1 16 PRO HG2 H -0.514 -4.092 8.537 1.00 . A A . 16 PRO HG2 1 1 10 4860 1 1 16 PRO HG3 H -0.465 -5.857 8.692 1.00 . A A . 16 PRO HG3 1 1 10 4861 1 1 16 PRO N N 1.487 -5.933 6.776 1.00 . A A . 16 PRO N 1 1 10 4862 1 1 16 PRO O O 0.543 -4.225 4.366 1.00 . A A . 16 PRO O 1 1 10 4863 1 1 17 THR C C 0.029 -6.334 1.311 1.00 . A A . 17 THR C 1 1 10 4864 1 1 17 THR CA C 1.126 -5.944 2.300 1.00 . A A . 17 THR CA 1 1 10 4865 1 1 17 THR CB C 2.468 -6.597 1.921 1.00 . A A . 17 THR CB 1 1 10 4866 1 1 17 THR CG2 C 3.632 -5.875 2.600 1.00 . A A . 17 THR CG2 1 1 10 4867 1 1 17 THR H H 0.770 -7.268 3.877 1.00 . A A . 17 THR H 1 1 10 4868 1 1 17 THR HA H 1.259 -4.873 2.273 1.00 . A A . 17 THR HA 1 1 10 4869 1 1 17 THR HB H 2.590 -6.549 0.849 1.00 . A A . 17 THR HB 1 1 10 4870 1 1 17 THR HG1 H 2.677 -7.988 3.282 1.00 . A A . 17 THR HG1 1 1 10 4871 1 1 17 THR HG21 H 3.505 -5.925 3.671 1.00 . A A . 17 THR HG21 1 1 10 4872 1 1 17 THR HG22 H 3.642 -4.838 2.298 1.00 . A A . 17 THR HG22 1 1 10 4873 1 1 17 THR HG23 H 4.564 -6.345 2.324 1.00 . A A . 17 THR HG23 1 1 10 4874 1 1 17 THR N N 0.786 -6.316 3.642 1.00 . A A . 17 THR N 1 1 10 4875 1 1 17 THR O O -0.048 -5.798 0.201 1.00 . A A . 17 THR O 1 1 10 4876 1 1 17 THR OG1 O 2.455 -7.983 2.342 1.00 . A A . 17 THR OG1 1 1 10 4877 1 1 18 VAL C C -3.064 -6.711 0.974 1.00 . A A . 18 VAL C 1 1 10 4878 1 1 18 VAL CA C -1.919 -7.710 0.903 1.00 . A A . 18 VAL CA 1 1 10 4879 1 1 18 VAL CB C -2.418 -9.115 1.357 1.00 . A A . 18 VAL CB 1 1 10 4880 1 1 18 VAL CG1 C -3.594 -9.585 0.510 1.00 . A A . 18 VAL CG1 1 1 10 4881 1 1 18 VAL CG2 C -1.284 -10.133 1.295 1.00 . A A . 18 VAL CG2 1 1 10 4882 1 1 18 VAL H H -0.719 -7.623 2.627 1.00 . A A . 18 VAL H 1 1 10 4883 1 1 18 VAL HA H -1.567 -7.775 -0.117 1.00 . A A . 18 VAL HA 1 1 10 4884 1 1 18 VAL HB H -2.750 -9.039 2.381 1.00 . A A . 18 VAL HB 1 1 10 4885 1 1 18 VAL HG11 H -3.284 -9.647 -0.521 1.00 . A A . 18 VAL HG11 1 1 10 4886 1 1 18 VAL HG12 H -4.404 -8.876 0.597 1.00 . A A . 18 VAL HG12 1 1 10 4887 1 1 18 VAL HG13 H -3.923 -10.558 0.848 1.00 . A A . 18 VAL HG13 1 1 10 4888 1 1 18 VAL HG21 H -1.645 -11.093 1.634 1.00 . A A . 18 VAL HG21 1 1 10 4889 1 1 18 VAL HG22 H -0.467 -9.808 1.923 1.00 . A A . 18 VAL HG22 1 1 10 4890 1 1 18 VAL HG23 H -0.938 -10.223 0.274 1.00 . A A . 18 VAL HG23 1 1 10 4891 1 1 18 VAL N N -0.825 -7.250 1.728 1.00 . A A . 18 VAL N 1 1 10 4892 1 1 18 VAL O O -3.650 -6.506 2.044 1.00 . A A . 18 VAL O 1 1 10 4893 1 1 19 CYS C C -5.755 -5.850 -0.421 1.00 . A A . 19 CYS C 1 1 10 4894 1 1 19 CYS CA C -4.435 -5.116 -0.195 1.00 . A A . 19 CYS CA 1 1 10 4895 1 1 19 CYS CB C -4.202 -4.086 -1.316 1.00 . A A . 19 CYS CB 1 1 10 4896 1 1 19 CYS H H -2.825 -6.254 -0.939 1.00 . A A . 19 CYS H 1 1 10 4897 1 1 19 CYS HA H -4.480 -4.603 0.754 1.00 . A A . 19 CYS HA 1 1 10 4898 1 1 19 CYS HB2 H -4.198 -4.574 -2.279 1.00 . A A . 19 CYS HB2 1 1 10 4899 1 1 19 CYS HB3 H -5.003 -3.360 -1.290 1.00 . A A . 19 CYS HB3 1 1 10 4900 1 1 19 CYS N N -3.350 -6.072 -0.131 1.00 . A A . 19 CYS N 1 1 10 4901 1 1 19 CYS O O -5.770 -7.046 -0.789 1.00 . A A . 19 CYS O 1 1 10 4902 1 1 19 CYS SG S -2.641 -3.158 -1.182 1.00 . A A . 19 CYS SG 1 1 10 4903 1 1 20 ALA C C -8.425 -5.978 -1.872 1.00 . A A . 20 ALA C 1 1 10 4904 1 1 20 ALA CA C -8.161 -5.736 -0.391 1.00 . A A . 20 ALA CA 1 1 10 4905 1 1 20 ALA CB C -9.211 -4.819 0.191 1.00 . A A . 20 ALA CB 1 1 10 4906 1 1 20 ALA H H -6.774 -4.231 0.099 1.00 . A A . 20 ALA H 1 1 10 4907 1 1 20 ALA HA H -8.193 -6.677 0.137 1.00 . A A . 20 ALA HA 1 1 10 4908 1 1 20 ALA HB1 H -9.177 -3.870 -0.323 1.00 . A A . 20 ALA HB1 1 1 10 4909 1 1 20 ALA HB2 H -9.018 -4.666 1.241 1.00 . A A . 20 ALA HB2 1 1 10 4910 1 1 20 ALA HB3 H -10.187 -5.263 0.060 1.00 . A A . 20 ALA HB3 1 1 10 4911 1 1 20 ALA N N -6.849 -5.162 -0.202 1.00 . A A . 20 ALA N 1 1 10 4912 1 1 20 ALA O O -7.809 -5.326 -2.741 1.00 . A A . 20 ALA O 1 1 10 4913 1 1 21 SER C C -10.320 -6.010 -4.163 1.00 . A A . 21 SER C 1 1 10 4914 1 1 21 SER CA C -9.648 -7.219 -3.514 1.00 . A A . 21 SER CA 1 1 10 4915 1 1 21 SER CB C -10.543 -8.450 -3.508 1.00 . A A . 21 SER CB 1 1 10 4916 1 1 21 SER H H -9.737 -7.435 -1.467 1.00 . A A . 21 SER H 1 1 10 4917 1 1 21 SER HA H -8.743 -7.447 -4.056 1.00 . A A . 21 SER HA 1 1 10 4918 1 1 21 SER HB2 H -11.100 -8.492 -4.433 1.00 . A A . 21 SER HB2 1 1 10 4919 1 1 21 SER HB3 H -9.940 -9.338 -3.404 1.00 . A A . 21 SER HB3 1 1 10 4920 1 1 21 SER HG H -12.015 -9.175 -2.469 1.00 . A A . 21 SER HG 1 1 10 4921 1 1 21 SER N N -9.284 -6.911 -2.165 1.00 . A A . 21 SER N 1 1 10 4922 1 1 21 SER O O -11.315 -5.486 -3.649 1.00 . A A . 21 SER O 1 1 10 4923 1 1 21 SER OG O -11.462 -8.386 -2.419 1.00 . A A . 21 SER OG 1 1 10 4924 1 1 22 GLY C C -9.315 -3.187 -5.722 1.00 . A A . 22 GLY C 1 1 10 4925 1 1 22 GLY CA C -10.232 -4.373 -5.905 1.00 . A A . 22 GLY CA 1 1 10 4926 1 1 22 GLY H H -8.922 -5.976 -5.584 1.00 . A A . 22 GLY H 1 1 10 4927 1 1 22 GLY HA2 H -10.325 -4.590 -6.960 1.00 . A A . 22 GLY HA2 1 1 10 4928 1 1 22 GLY HA3 H -11.203 -4.130 -5.505 1.00 . A A . 22 GLY HA3 1 1 10 4929 1 1 22 GLY N N -9.725 -5.533 -5.232 1.00 . A A . 22 GLY N 1 1 10 4930 1 1 22 GLY O O -9.531 -2.126 -6.304 1.00 . A A . 22 GLY O 1 1 10 4931 1 1 23 THR C C -5.963 -2.844 -5.010 1.00 . A A . 23 THR C 1 1 10 4932 1 1 23 THR CA C -7.333 -2.302 -4.683 1.00 . A A . 23 THR CA 1 1 10 4933 1 1 23 THR CB C -7.364 -1.753 -3.225 1.00 . A A . 23 THR CB 1 1 10 4934 1 1 23 THR CG2 C -8.718 -1.150 -2.907 1.00 . A A . 23 THR CG2 1 1 10 4935 1 1 23 THR H H -8.182 -4.211 -4.446 1.00 . A A . 23 THR H 1 1 10 4936 1 1 23 THR HA H -7.559 -1.500 -5.370 1.00 . A A . 23 THR HA 1 1 10 4937 1 1 23 THR HB H -6.613 -0.983 -3.126 1.00 . A A . 23 THR HB 1 1 10 4938 1 1 23 THR HG1 H -7.377 -3.636 -2.634 1.00 . A A . 23 THR HG1 1 1 10 4939 1 1 23 THR HG21 H -8.911 -0.323 -3.574 1.00 . A A . 23 THR HG21 1 1 10 4940 1 1 23 THR HG22 H -8.715 -0.803 -1.886 1.00 . A A . 23 THR HG22 1 1 10 4941 1 1 23 THR HG23 H -9.484 -1.901 -3.031 1.00 . A A . 23 THR HG23 1 1 10 4942 1 1 23 THR N N -8.303 -3.350 -4.899 1.00 . A A . 23 THR N 1 1 10 4943 1 1 23 THR O O -5.721 -4.035 -4.856 1.00 . A A . 23 THR O 1 1 10 4944 1 1 23 THR OG1 O -7.080 -2.789 -2.274 1.00 . A A . 23 THR OG1 1 1 10 4945 1 1 24 THR C C -2.725 -1.724 -5.070 1.00 . A A . 24 THR C 1 1 10 4946 1 1 24 THR CA C -3.782 -2.476 -5.833 1.00 . A A . 24 THR CA 1 1 10 4947 1 1 24 THR CB C -3.541 -2.320 -7.347 1.00 . A A . 24 THR CB 1 1 10 4948 1 1 24 THR CG2 C -4.409 -3.274 -8.129 1.00 . A A . 24 THR CG2 1 1 10 4949 1 1 24 THR H H -5.311 -1.071 -5.623 1.00 . A A . 24 THR H 1 1 10 4950 1 1 24 THR HA H -3.712 -3.526 -5.591 1.00 . A A . 24 THR HA 1 1 10 4951 1 1 24 THR HB H -2.503 -2.535 -7.558 1.00 . A A . 24 THR HB 1 1 10 4952 1 1 24 THR HG1 H -4.419 -0.541 -7.114 1.00 . A A . 24 THR HG1 1 1 10 4953 1 1 24 THR HG21 H -4.184 -4.289 -7.837 1.00 . A A . 24 THR HG21 1 1 10 4954 1 1 24 THR HG22 H -4.231 -3.147 -9.185 1.00 . A A . 24 THR HG22 1 1 10 4955 1 1 24 THR HG23 H -5.442 -3.060 -7.905 1.00 . A A . 24 THR HG23 1 1 10 4956 1 1 24 THR N N -5.092 -2.023 -5.482 1.00 . A A . 24 THR N 1 1 10 4957 1 1 24 THR O O -2.838 -0.514 -4.882 1.00 . A A . 24 THR O 1 1 10 4958 1 1 24 THR OG1 O -3.833 -0.975 -7.758 1.00 . A A . 24 THR OG1 1 1 10 4959 1 1 25 CYS C C 0.183 -1.080 -5.013 1.00 . A A . 25 CYS C 1 1 10 4960 1 1 25 CYS CA C -0.618 -1.804 -3.950 1.00 . A A . 25 CYS CA 1 1 10 4961 1 1 25 CYS CB C 0.258 -2.840 -3.231 1.00 . A A . 25 CYS CB 1 1 10 4962 1 1 25 CYS H H -1.768 -3.410 -4.663 1.00 . A A . 25 CYS H 1 1 10 4963 1 1 25 CYS HA H -0.993 -1.087 -3.236 1.00 . A A . 25 CYS HA 1 1 10 4964 1 1 25 CYS HB2 H -0.331 -3.337 -2.474 1.00 . A A . 25 CYS HB2 1 1 10 4965 1 1 25 CYS HB3 H 0.602 -3.567 -3.951 1.00 . A A . 25 CYS HB3 1 1 10 4966 1 1 25 CYS N N -1.738 -2.430 -4.591 1.00 . A A . 25 CYS N 1 1 10 4967 1 1 25 CYS O O 0.857 -1.713 -5.843 1.00 . A A . 25 CYS O 1 1 10 4968 1 1 25 CYS SG S 1.731 -2.132 -2.410 1.00 . A A . 25 CYS SG 1 1 10 4969 1 1 26 GLN C C 1.795 1.848 -5.387 1.00 . A A . 26 GLN C 1 1 10 4970 1 1 26 GLN CA C 0.712 1.015 -6.027 1.00 . A A . 26 GLN CA 1 1 10 4971 1 1 26 GLN CB C -0.279 1.866 -6.834 1.00 . A A . 26 GLN CB 1 1 10 4972 1 1 26 GLN CD C -2.140 1.862 -8.582 1.00 . A A . 26 GLN CD 1 1 10 4973 1 1 26 GLN CG C -1.152 1.036 -7.775 1.00 . A A . 26 GLN CG 1 1 10 4974 1 1 26 GLN H H -0.538 0.668 -4.400 1.00 . A A . 26 GLN H 1 1 10 4975 1 1 26 GLN HA H 1.193 0.324 -6.703 1.00 . A A . 26 GLN HA 1 1 10 4976 1 1 26 GLN HB2 H -0.922 2.401 -6.150 1.00 . A A . 26 GLN HB2 1 1 10 4977 1 1 26 GLN HB3 H 0.274 2.578 -7.430 1.00 . A A . 26 GLN HB3 1 1 10 4978 1 1 26 GLN HE21 H -3.569 1.509 -7.268 1.00 . A A . 26 GLN HE21 1 1 10 4979 1 1 26 GLN HE22 H -4.030 2.486 -8.591 1.00 . A A . 26 GLN HE22 1 1 10 4980 1 1 26 GLN HG2 H -0.513 0.509 -8.468 1.00 . A A . 26 GLN HG2 1 1 10 4981 1 1 26 GLN HG3 H -1.704 0.318 -7.186 1.00 . A A . 26 GLN HG3 1 1 10 4982 1 1 26 GLN N N 0.042 0.214 -5.054 1.00 . A A . 26 GLN N 1 1 10 4983 1 1 26 GLN NE2 N -3.351 1.966 -8.106 1.00 . A A . 26 GLN NE2 1 1 10 4984 1 1 26 GLN O O 1.581 2.501 -4.354 1.00 . A A . 26 GLN O 1 1 10 4985 1 1 26 GLN OE1 O -1.816 2.351 -9.666 1.00 . A A . 26 GLN OE1 1 1 10 4986 1 1 27 VAL C C 4.051 3.928 -6.001 1.00 . A A . 27 VAL C 1 1 10 4987 1 1 27 VAL CA C 4.125 2.492 -5.508 1.00 . A A . 27 VAL CA 1 1 10 4988 1 1 27 VAL CB C 5.429 1.815 -6.031 1.00 . A A . 27 VAL CB 1 1 10 4989 1 1 27 VAL CG1 C 6.672 2.540 -5.540 1.00 . A A . 27 VAL CG1 1 1 10 4990 1 1 27 VAL CG2 C 5.475 0.347 -5.625 1.00 . A A . 27 VAL CG2 1 1 10 4991 1 1 27 VAL H H 3.037 1.234 -6.788 1.00 . A A . 27 VAL H 1 1 10 4992 1 1 27 VAL HA H 4.124 2.475 -4.429 1.00 . A A . 27 VAL HA 1 1 10 4993 1 1 27 VAL HB H 5.418 1.865 -7.110 1.00 . A A . 27 VAL HB 1 1 10 4994 1 1 27 VAL HG11 H 7.556 2.040 -5.911 1.00 . A A . 27 VAL HG11 1 1 10 4995 1 1 27 VAL HG12 H 6.683 2.537 -4.460 1.00 . A A . 27 VAL HG12 1 1 10 4996 1 1 27 VAL HG13 H 6.657 3.559 -5.898 1.00 . A A . 27 VAL HG13 1 1 10 4997 1 1 27 VAL HG21 H 5.457 0.273 -4.547 1.00 . A A . 27 VAL HG21 1 1 10 4998 1 1 27 VAL HG22 H 6.381 -0.104 -6.002 1.00 . A A . 27 VAL HG22 1 1 10 4999 1 1 27 VAL HG23 H 4.619 -0.167 -6.034 1.00 . A A . 27 VAL HG23 1 1 10 5000 1 1 27 VAL N N 2.959 1.781 -5.978 1.00 . A A . 27 VAL N 1 1 10 5001 1 1 27 VAL O O 4.134 4.191 -7.212 1.00 . A A . 27 VAL O 1 1 10 5002 1 1 28 LEU C C 5.037 6.954 -5.192 1.00 . A A . 28 LEU C 1 1 10 5003 1 1 28 LEU CA C 3.714 6.238 -5.433 1.00 . A A . 28 LEU CA 1 1 10 5004 1 1 28 LEU CB C 2.578 6.863 -4.617 1.00 . A A . 28 LEU CB 1 1 10 5005 1 1 28 LEU CD1 C 0.168 6.869 -3.892 1.00 . A A . 28 LEU CD1 1 1 10 5006 1 1 28 LEU CD2 C 0.727 6.409 -6.270 1.00 . A A . 28 LEU CD2 1 1 10 5007 1 1 28 LEU CG C 1.182 6.244 -4.829 1.00 . A A . 28 LEU CG 1 1 10 5008 1 1 28 LEU H H 3.782 4.558 -4.150 1.00 . A A . 28 LEU H 1 1 10 5009 1 1 28 LEU HA H 3.472 6.301 -6.483 1.00 . A A . 28 LEU HA 1 1 10 5010 1 1 28 LEU HB2 H 2.835 6.761 -3.575 1.00 . A A . 28 LEU HB2 1 1 10 5011 1 1 28 LEU HB3 H 2.520 7.915 -4.856 1.00 . A A . 28 LEU HB3 1 1 10 5012 1 1 28 LEU HD11 H 0.464 6.669 -2.874 1.00 . A A . 28 LEU HD11 1 1 10 5013 1 1 28 LEU HD12 H -0.806 6.440 -4.072 1.00 . A A . 28 LEU HD12 1 1 10 5014 1 1 28 LEU HD13 H 0.134 7.936 -4.055 1.00 . A A . 28 LEU HD13 1 1 10 5015 1 1 28 LEU HD21 H -0.259 5.983 -6.388 1.00 . A A . 28 LEU HD21 1 1 10 5016 1 1 28 LEU HD22 H 1.420 5.908 -6.928 1.00 . A A . 28 LEU HD22 1 1 10 5017 1 1 28 LEU HD23 H 0.694 7.461 -6.510 1.00 . A A . 28 LEU HD23 1 1 10 5018 1 1 28 LEU HG H 1.232 5.187 -4.608 1.00 . A A . 28 LEU HG 1 1 10 5019 1 1 28 LEU N N 3.842 4.837 -5.091 1.00 . A A . 28 LEU N 1 1 10 5020 1 1 28 LEU O O 5.363 7.929 -5.850 1.00 . A A . 28 LEU O 1 1 10 5021 1 1 29 ASN C C 7.879 5.693 -3.492 1.00 . A A . 29 ASN C 1 1 10 5022 1 1 29 ASN CA C 7.118 6.924 -3.904 1.00 . A A . 29 ASN CA 1 1 10 5023 1 1 29 ASN CB C 7.106 7.928 -2.718 1.00 . A A . 29 ASN CB 1 1 10 5024 1 1 29 ASN CG C 6.389 9.235 -2.995 1.00 . A A . 29 ASN CG 1 1 10 5025 1 1 29 ASN H H 5.466 5.667 -3.728 1.00 . A A . 29 ASN H 1 1 10 5026 1 1 29 ASN HA H 7.566 7.365 -4.783 1.00 . A A . 29 ASN HA 1 1 10 5027 1 1 29 ASN HB2 H 6.661 7.463 -1.854 1.00 . A A . 29 ASN HB2 1 1 10 5028 1 1 29 ASN HB3 H 8.133 8.155 -2.477 1.00 . A A . 29 ASN HB3 1 1 10 5029 1 1 29 ASN HD21 H 4.699 8.510 -2.277 1.00 . A A . 29 ASN HD21 1 1 10 5030 1 1 29 ASN HD22 H 4.639 10.131 -2.854 1.00 . A A . 29 ASN HD22 1 1 10 5031 1 1 29 ASN N N 5.783 6.446 -4.243 1.00 . A A . 29 ASN N 1 1 10 5032 1 1 29 ASN ND2 N 5.123 9.296 -2.676 1.00 . A A . 29 ASN ND2 1 1 10 5033 1 1 29 ASN O O 7.243 4.679 -3.250 1.00 . A A . 29 ASN O 1 1 10 5034 1 1 29 ASN OD1 O 6.988 10.199 -3.468 1.00 . A A . 29 ASN OD1 1 1 10 5035 1 1 30 PRO C C 9.534 3.961 -1.652 1.00 . A A . 30 PRO C 1 1 10 5036 1 1 30 PRO CA C 9.994 4.537 -2.995 1.00 . A A . 30 PRO CA 1 1 10 5037 1 1 30 PRO CB C 11.429 5.061 -2.886 1.00 . A A . 30 PRO CB 1 1 10 5038 1 1 30 PRO CD C 10.107 6.869 -3.693 1.00 . A A . 30 PRO CD 1 1 10 5039 1 1 30 PRO CG C 11.464 6.235 -3.799 1.00 . A A . 30 PRO CG 1 1 10 5040 1 1 30 PRO HA H 9.937 3.769 -3.749 1.00 . A A . 30 PRO HA 1 1 10 5041 1 1 30 PRO HB2 H 11.629 5.348 -1.864 1.00 . A A . 30 PRO HB2 1 1 10 5042 1 1 30 PRO HB3 H 12.127 4.297 -3.195 1.00 . A A . 30 PRO HB3 1 1 10 5043 1 1 30 PRO HD2 H 10.094 7.585 -2.884 1.00 . A A . 30 PRO HD2 1 1 10 5044 1 1 30 PRO HD3 H 9.822 7.340 -4.621 1.00 . A A . 30 PRO HD3 1 1 10 5045 1 1 30 PRO HG2 H 12.230 6.926 -3.480 1.00 . A A . 30 PRO HG2 1 1 10 5046 1 1 30 PRO HG3 H 11.649 5.908 -4.812 1.00 . A A . 30 PRO HG3 1 1 10 5047 1 1 30 PRO N N 9.222 5.724 -3.390 1.00 . A A . 30 PRO N 1 1 10 5048 1 1 30 PRO O O 9.443 2.738 -1.470 1.00 . A A . 30 PRO O 1 1 10 5049 1 1 31 TYR C C 7.273 4.409 0.705 1.00 . A A . 31 TYR C 1 1 10 5050 1 1 31 TYR CA C 8.800 4.379 0.584 1.00 . A A . 31 TYR CA 1 1 10 5051 1 1 31 TYR CB C 9.395 5.307 1.656 1.00 . A A . 31 TYR CB 1 1 10 5052 1 1 31 TYR CD1 C 11.804 4.823 2.293 1.00 . A A . 31 TYR CD1 1 1 10 5053 1 1 31 TYR CD2 C 11.388 6.553 0.716 1.00 . A A . 31 TYR CD2 1 1 10 5054 1 1 31 TYR CE1 C 13.160 5.071 2.206 1.00 . A A . 31 TYR CE1 1 1 10 5055 1 1 31 TYR CE2 C 12.735 6.804 0.620 1.00 . A A . 31 TYR CE2 1 1 10 5056 1 1 31 TYR CG C 10.894 5.559 1.551 1.00 . A A . 31 TYR CG 1 1 10 5057 1 1 31 TYR CZ C 13.619 6.063 1.365 1.00 . A A . 31 TYR CZ 1 1 10 5058 1 1 31 TYR H H 9.248 5.790 -0.935 1.00 . A A . 31 TYR H 1 1 10 5059 1 1 31 TYR HA H 9.172 3.379 0.747 1.00 . A A . 31 TYR HA 1 1 10 5060 1 1 31 TYR HB2 H 8.901 6.266 1.603 1.00 . A A . 31 TYR HB2 1 1 10 5061 1 1 31 TYR HB3 H 9.203 4.875 2.626 1.00 . A A . 31 TYR HB3 1 1 10 5062 1 1 31 TYR HD1 H 11.441 4.044 2.947 1.00 . A A . 31 TYR HD1 1 1 10 5063 1 1 31 TYR HD2 H 10.691 7.135 0.130 1.00 . A A . 31 TYR HD2 1 1 10 5064 1 1 31 TYR HE1 H 13.857 4.489 2.790 1.00 . A A . 31 TYR HE1 1 1 10 5065 1 1 31 TYR HE2 H 13.091 7.582 -0.039 1.00 . A A . 31 TYR HE2 1 1 10 5066 1 1 31 TYR HH H 15.400 5.474 1.076 1.00 . A A . 31 TYR HH 1 1 10 5067 1 1 31 TYR N N 9.207 4.834 -0.722 1.00 . A A . 31 TYR N 1 1 10 5068 1 1 31 TYR O O 6.675 3.633 1.463 1.00 . A A . 31 TYR O 1 1 10 5069 1 1 31 TYR OH O 14.973 6.319 1.276 1.00 . A A . 31 TYR OH 1 1 10 5070 1 1 32 TYR C C 4.522 4.539 -1.057 1.00 . A A . 32 TYR C 1 1 10 5071 1 1 32 TYR CA C 5.205 5.383 0.013 1.00 . A A . 32 TYR CA 1 1 10 5072 1 1 32 TYR CB C 4.762 6.842 -0.068 1.00 . A A . 32 TYR CB 1 1 10 5073 1 1 32 TYR CD1 C 2.829 6.946 1.536 1.00 . A A . 32 TYR CD1 1 1 10 5074 1 1 32 TYR CD2 C 2.405 7.415 -0.757 1.00 . A A . 32 TYR CD2 1 1 10 5075 1 1 32 TYR CE1 C 1.503 7.171 1.829 1.00 . A A . 32 TYR CE1 1 1 10 5076 1 1 32 TYR CE2 C 1.079 7.637 -0.469 1.00 . A A . 32 TYR CE2 1 1 10 5077 1 1 32 TYR CG C 3.303 7.065 0.239 1.00 . A A . 32 TYR CG 1 1 10 5078 1 1 32 TYR CZ C 0.636 7.514 0.819 1.00 . A A . 32 TYR CZ 1 1 10 5079 1 1 32 TYR H H 7.144 5.833 -0.674 1.00 . A A . 32 TYR H 1 1 10 5080 1 1 32 TYR HA H 4.905 4.995 0.976 1.00 . A A . 32 TYR HA 1 1 10 5081 1 1 32 TYR HB2 H 5.342 7.444 0.613 1.00 . A A . 32 TYR HB2 1 1 10 5082 1 1 32 TYR HB3 H 4.928 7.186 -1.077 1.00 . A A . 32 TYR HB3 1 1 10 5083 1 1 32 TYR HD1 H 3.516 6.672 2.324 1.00 . A A . 32 TYR HD1 1 1 10 5084 1 1 32 TYR HD2 H 2.753 7.513 -1.774 1.00 . A A . 32 TYR HD2 1 1 10 5085 1 1 32 TYR HE1 H 1.148 7.071 2.843 1.00 . A A . 32 TYR HE1 1 1 10 5086 1 1 32 TYR HE2 H 0.386 7.901 -1.255 1.00 . A A . 32 TYR HE2 1 1 10 5087 1 1 32 TYR HH H -1.209 7.326 0.419 1.00 . A A . 32 TYR HH 1 1 10 5088 1 1 32 TYR N N 6.639 5.278 -0.048 1.00 . A A . 32 TYR N 1 1 10 5089 1 1 32 TYR O O 4.593 4.849 -2.250 1.00 . A A . 32 TYR O 1 1 10 5090 1 1 32 TYR OH O -0.678 7.750 1.104 1.00 . A A . 32 TYR OH 1 1 10 5091 1 1 33 SER C C 1.688 2.604 -0.906 1.00 . A A . 33 SER C 1 1 10 5092 1 1 33 SER CA C 3.059 2.723 -1.520 1.00 . A A . 33 SER CA 1 1 10 5093 1 1 33 SER CB C 3.730 1.352 -1.657 1.00 . A A . 33 SER CB 1 1 10 5094 1 1 33 SER H H 3.788 3.338 0.317 1.00 . A A . 33 SER H 1 1 10 5095 1 1 33 SER HA H 2.989 3.208 -2.483 1.00 . A A . 33 SER HA 1 1 10 5096 1 1 33 SER HB2 H 3.691 0.837 -0.709 1.00 . A A . 33 SER HB2 1 1 10 5097 1 1 33 SER HB3 H 3.211 0.770 -2.405 1.00 . A A . 33 SER HB3 1 1 10 5098 1 1 33 SER HG H 5.424 0.664 -2.389 1.00 . A A . 33 SER HG 1 1 10 5099 1 1 33 SER N N 3.818 3.552 -0.636 1.00 . A A . 33 SER N 1 1 10 5100 1 1 33 SER O O 1.586 2.367 0.291 1.00 . A A . 33 SER O 1 1 10 5101 1 1 33 SER OG O 5.088 1.497 -2.047 1.00 . A A . 33 SER OG 1 1 10 5102 1 1 34 GLN C C -1.621 1.897 -1.957 1.00 . A A . 34 GLN C 1 1 10 5103 1 1 34 GLN CA C -0.692 2.819 -1.159 1.00 . A A . 34 GLN CA 1 1 10 5104 1 1 34 GLN CB C -1.184 4.289 -1.162 1.00 . A A . 34 GLN CB 1 1 10 5105 1 1 34 GLN CD C -3.050 5.949 -0.816 1.00 . A A . 34 GLN CD 1 1 10 5106 1 1 34 GLN CG C -2.656 4.488 -0.850 1.00 . A A . 34 GLN CG 1 1 10 5107 1 1 34 GLN H H 0.803 2.867 -2.653 1.00 . A A . 34 GLN H 1 1 10 5108 1 1 34 GLN HA H -0.663 2.473 -0.137 1.00 . A A . 34 GLN HA 1 1 10 5109 1 1 34 GLN HB2 H -0.622 4.825 -0.412 1.00 . A A . 34 GLN HB2 1 1 10 5110 1 1 34 GLN HB3 H -0.969 4.741 -2.120 1.00 . A A . 34 GLN HB3 1 1 10 5111 1 1 34 GLN HE21 H -2.825 6.022 1.152 1.00 . A A . 34 GLN HE21 1 1 10 5112 1 1 34 GLN HE22 H -3.346 7.474 0.391 1.00 . A A . 34 GLN HE22 1 1 10 5113 1 1 34 GLN HG2 H -3.246 3.989 -1.605 1.00 . A A . 34 GLN HG2 1 1 10 5114 1 1 34 GLN HG3 H -2.868 4.051 0.115 1.00 . A A . 34 GLN HG3 1 1 10 5115 1 1 34 GLN N N 0.661 2.783 -1.681 1.00 . A A . 34 GLN N 1 1 10 5116 1 1 34 GLN NE2 N -3.065 6.535 0.348 1.00 . A A . 34 GLN NE2 1 1 10 5117 1 1 34 GLN O O -1.443 1.730 -3.165 1.00 . A A . 34 GLN O 1 1 10 5118 1 1 34 GLN OE1 O -3.389 6.532 -1.826 1.00 . A A . 34 GLN OE1 1 1 10 5119 1 1 35 CYS C C -4.593 1.290 -2.576 1.00 . A A . 35 CYS C 1 1 10 5120 1 1 35 CYS CA C -3.538 0.416 -1.925 1.00 . A A . 35 CYS CA 1 1 10 5121 1 1 35 CYS CB C -4.216 -0.544 -0.946 1.00 . A A . 35 CYS CB 1 1 10 5122 1 1 35 CYS H H -2.605 1.322 -0.291 1.00 . A A . 35 CYS H 1 1 10 5123 1 1 35 CYS HA H -3.031 -0.156 -2.689 1.00 . A A . 35 CYS HA 1 1 10 5124 1 1 35 CYS HB2 H -4.849 -0.004 -0.258 1.00 . A A . 35 CYS HB2 1 1 10 5125 1 1 35 CYS HB3 H -4.842 -1.195 -1.530 1.00 . A A . 35 CYS HB3 1 1 10 5126 1 1 35 CYS N N -2.565 1.250 -1.269 1.00 . A A . 35 CYS N 1 1 10 5127 1 1 35 CYS O O -5.450 1.885 -1.887 1.00 . A A . 35 CYS O 1 1 10 5128 1 1 35 CYS SG S -3.093 -1.592 0.031 1.00 . A A . 35 CYS SG 1 1 10 5129 1 1 36 LEU C C -6.146 1.183 -5.546 1.00 . A A . 36 LEU C 1 1 10 5130 1 1 36 LEU CA C -5.421 2.143 -4.654 1.00 . A A . 36 LEU CA 1 1 10 5131 1 1 36 LEU CB C -4.718 3.232 -5.467 1.00 . A A . 36 LEU CB 1 1 10 5132 1 1 36 LEU CD1 C -3.388 5.347 -5.589 1.00 . A A . 36 LEU CD1 1 1 10 5133 1 1 36 LEU CD2 C -5.293 5.161 -3.989 1.00 . A A . 36 LEU CD2 1 1 10 5134 1 1 36 LEU CG C -4.159 4.410 -4.673 1.00 . A A . 36 LEU CG 1 1 10 5135 1 1 36 LEU H H -3.767 0.941 -4.324 1.00 . A A . 36 LEU H 1 1 10 5136 1 1 36 LEU HA H -6.138 2.599 -3.991 1.00 . A A . 36 LEU HA 1 1 10 5137 1 1 36 LEU HB2 H -3.897 2.775 -5.999 1.00 . A A . 36 LEU HB2 1 1 10 5138 1 1 36 LEU HB3 H -5.419 3.617 -6.192 1.00 . A A . 36 LEU HB3 1 1 10 5139 1 1 36 LEU HD11 H -3.001 6.174 -5.014 1.00 . A A . 36 LEU HD11 1 1 10 5140 1 1 36 LEU HD12 H -4.047 5.719 -6.358 1.00 . A A . 36 LEU HD12 1 1 10 5141 1 1 36 LEU HD13 H -2.568 4.812 -6.047 1.00 . A A . 36 LEU HD13 1 1 10 5142 1 1 36 LEU HD21 H -6.002 5.493 -4.732 1.00 . A A . 36 LEU HD21 1 1 10 5143 1 1 36 LEU HD22 H -4.891 6.020 -3.473 1.00 . A A . 36 LEU HD22 1 1 10 5144 1 1 36 LEU HD23 H -5.789 4.520 -3.275 1.00 . A A . 36 LEU HD23 1 1 10 5145 1 1 36 LEU HG H -3.484 4.048 -3.910 1.00 . A A . 36 LEU HG 1 1 10 5146 1 1 36 LEU N N -4.500 1.405 -3.858 1.00 . A A . 36 LEU N 1 1 10 5147 1 1 36 LEU O O -7.355 1.044 -5.401 1.00 . A A . 36 LEU O 1 1 10 5148 1 1 36 LEU OXT O -5.491 0.480 -6.326 1.00 . A A . 36 LEU OXT 1 1 10 5149 2 2 1 MAN C1 C 9.231 -3.529 5.089 1.00 . B A . 101 MAN C1 1 1 10 5150 2 2 1 MAN C2 C 10.140 -3.458 3.850 1.00 . B A . 101 MAN C2 1 1 10 5151 2 2 1 MAN C3 C 11.586 -3.779 4.226 1.00 . B A . 101 MAN C3 1 1 10 5152 2 2 1 MAN C4 C 12.031 -2.860 5.354 1.00 . B A . 101 MAN C4 1 1 10 5153 2 2 1 MAN C5 C 11.097 -3.024 6.551 1.00 . B A . 101 MAN C5 1 1 10 5154 2 2 1 MAN C6 C 11.434 -2.090 7.691 1.00 . B A . 101 MAN C6 1 1 10 5155 2 2 1 MAN H1 H 8.269 -3.098 4.777 1.00 . B A . 101 MAN H1 1 1 10 5156 2 2 1 MAN H2 H 9.777 -4.206 3.130 1.00 . B A . 101 MAN H2 1 1 10 5157 2 2 1 MAN H3 H 11.628 -4.827 4.557 1.00 . B A . 101 MAN H3 1 1 10 5158 2 2 1 MAN H4 H 11.958 -1.821 5.003 1.00 . B A . 101 MAN H4 1 1 10 5159 2 2 1 MAN H5 H 11.059 -4.061 6.915 1.00 . B A . 101 MAN H5 1 1 10 5160 2 2 1 MAN H61 H 11.647 -1.099 7.265 1.00 . B A . 101 MAN H61 1 1 10 5161 2 2 1 MAN H62 H 12.351 -2.446 8.181 1.00 . B A . 101 MAN H62 1 1 10 5162 2 2 1 MAN HO2 H 9.144 -1.982 3.068 1.00 . B A . 101 MAN HO2 1 1 10 5163 2 2 1 MAN HO3 H 13.304 -3.858 3.345 1.00 . B A . 101 MAN HO3 1 1 10 5164 2 2 1 MAN HO4 H 13.948 -2.993 4.979 1.00 . B A . 101 MAN HO4 1 1 10 5165 2 2 1 MAN HO6 H 9.737 -1.370 8.257 1.00 . B A . 101 MAN HO6 1 1 10 5166 2 2 1 MAN O2 O 10.073 -2.157 3.273 1.00 . B A . 101 MAN O2 1 1 10 5167 2 2 1 MAN O3 O 12.422 -3.560 3.094 1.00 . B A . 101 MAN O3 1 1 10 5168 2 2 1 MAN O4 O 13.361 -3.142 5.726 1.00 . B A . 101 MAN O4 1 1 10 5169 2 2 1 MAN O5 O 9.748 -2.707 6.144 1.00 . B A . 101 MAN O5 1 1 10 5170 2 2 1 MAN O6 O 10.361 -2.013 8.624 1.00 . B A . 101 MAN O6 1 1 11 5171 1 1 1 THR C C -5.845 -5.881 4.728 1.00 . A A . 1 THR C 1 1 11 5172 1 1 1 THR CA C -6.086 -7.370 4.477 1.00 . A A . 1 THR CA 1 1 11 5173 1 1 1 THR CB C -7.581 -7.635 4.199 1.00 . A A . 1 THR CB 1 1 11 5174 1 1 1 THR CG2 C -8.017 -6.939 2.930 1.00 . A A . 1 THR CG2 1 1 11 5175 1 1 1 THR H1 H -4.647 -8.006 5.795 1.00 . A A . 1 THR H1 1 1 11 5176 1 1 1 THR H2 H -5.912 -9.118 5.504 1.00 . A A . 1 THR H2 1 1 11 5177 1 1 1 THR H3 H -6.176 -7.745 6.458 1.00 . A A . 1 THR H3 1 1 11 5178 1 1 1 THR HA H -5.503 -7.687 3.625 1.00 . A A . 1 THR HA 1 1 11 5179 1 1 1 THR HB H -8.161 -7.260 5.029 1.00 . A A . 1 THR HB 1 1 11 5180 1 1 1 THR HG1 H -7.450 -9.321 3.202 1.00 . A A . 1 THR HG1 1 1 11 5181 1 1 1 THR HG21 H -7.885 -5.872 3.043 1.00 . A A . 1 THR HG21 1 1 11 5182 1 1 1 THR HG22 H -9.055 -7.160 2.730 1.00 . A A . 1 THR HG22 1 1 11 5183 1 1 1 THR HG23 H -7.404 -7.290 2.113 1.00 . A A . 1 THR HG23 1 1 11 5184 1 1 1 THR N N -5.668 -8.118 5.634 1.00 . A A . 1 THR N 1 1 11 5185 1 1 1 THR O O -6.404 -5.304 5.660 1.00 . A A . 1 THR O 1 1 11 5186 1 1 1 THR OG1 O -7.807 -9.058 4.062 1.00 . A A . 1 THR OG1 1 1 11 5187 1 1 2 GLN C C -5.775 -3.053 3.365 1.00 . A A . 2 GLN C 1 1 11 5188 1 1 2 GLN CA C -4.679 -3.884 4.073 1.00 . A A . 2 GLN CA 1 1 11 5189 1 1 2 GLN CB C -3.282 -3.625 3.482 1.00 . A A . 2 GLN CB 1 1 11 5190 1 1 2 GLN CD C -3.101 -1.212 4.235 1.00 . A A . 2 GLN CD 1 1 11 5191 1 1 2 GLN CG C -2.446 -2.554 4.200 1.00 . A A . 2 GLN CG 1 1 11 5192 1 1 2 GLN H H -4.590 -5.771 3.178 1.00 . A A . 2 GLN H 1 1 11 5193 1 1 2 GLN HA H -4.684 -3.648 5.127 1.00 . A A . 2 GLN HA 1 1 11 5194 1 1 2 GLN HB2 H -2.723 -4.548 3.507 1.00 . A A . 2 GLN HB2 1 1 11 5195 1 1 2 GLN HB3 H -3.402 -3.324 2.451 1.00 . A A . 2 GLN HB3 1 1 11 5196 1 1 2 GLN HE21 H -2.396 -0.837 2.462 1.00 . A A . 2 GLN HE21 1 1 11 5197 1 1 2 GLN HE22 H -3.388 0.388 3.167 1.00 . A A . 2 GLN HE22 1 1 11 5198 1 1 2 GLN HG2 H -2.280 -2.869 5.219 1.00 . A A . 2 GLN HG2 1 1 11 5199 1 1 2 GLN HG3 H -1.493 -2.467 3.700 1.00 . A A . 2 GLN HG3 1 1 11 5200 1 1 2 GLN N N -5.006 -5.276 3.920 1.00 . A A . 2 GLN N 1 1 11 5201 1 1 2 GLN NE2 N -2.938 -0.477 3.196 1.00 . A A . 2 GLN NE2 1 1 11 5202 1 1 2 GLN O O -6.344 -3.487 2.350 1.00 . A A . 2 GLN O 1 1 11 5203 1 1 2 GLN OE1 O -3.818 -0.869 5.182 1.00 . A A . 2 GLN OE1 1 1 11 5204 1 1 3 SER C C -6.726 -0.072 2.330 1.00 . A A . 3 SER C 1 1 11 5205 1 1 3 SER CA C -7.132 -1.057 3.453 1.00 . A A . 3 SER CA 1 1 11 5206 1 1 3 SER CB C -7.662 -0.298 4.659 1.00 . A A . 3 SER CB 1 1 11 5207 1 1 3 SER H H -5.478 -1.553 4.619 1.00 . A A . 3 SER H 1 1 11 5208 1 1 3 SER HA H -7.924 -1.697 3.096 1.00 . A A . 3 SER HA 1 1 11 5209 1 1 3 SER HB2 H -6.892 0.368 5.017 1.00 . A A . 3 SER HB2 1 1 11 5210 1 1 3 SER HB3 H -8.542 0.266 4.384 1.00 . A A . 3 SER HB3 1 1 11 5211 1 1 3 SER HG H -8.902 -1.490 5.540 1.00 . A A . 3 SER HG 1 1 11 5212 1 1 3 SER N N -6.050 -1.895 3.896 1.00 . A A . 3 SER N 1 1 11 5213 1 1 3 SER O O -5.539 0.265 2.142 1.00 . A A . 3 SER O 1 1 11 5214 1 1 3 SER OG O -7.997 -1.200 5.708 1.00 . A A . 3 SER OG 1 1 11 5215 1 1 4 HIS C C -7.042 2.652 1.069 1.00 . A A . 4 HIS C 1 1 11 5216 1 1 4 HIS CA C -7.598 1.341 0.513 1.00 . A A . 4 HIS CA 1 1 11 5217 1 1 4 HIS CB C -8.990 1.563 -0.115 1.00 . A A . 4 HIS CB 1 1 11 5218 1 1 4 HIS CD2 C -8.458 2.380 -2.530 1.00 . A A . 4 HIS CD2 1 1 11 5219 1 1 4 HIS CE1 C -9.775 4.115 -2.564 1.00 . A A . 4 HIS CE1 1 1 11 5220 1 1 4 HIS CG C -9.045 2.472 -1.316 1.00 . A A . 4 HIS CG 1 1 11 5221 1 1 4 HIS H H -8.630 0.045 1.811 1.00 . A A . 4 HIS H 1 1 11 5222 1 1 4 HIS HA H -6.929 0.945 -0.234 1.00 . A A . 4 HIS HA 1 1 11 5223 1 1 4 HIS HB2 H -9.392 0.608 -0.418 1.00 . A A . 4 HIS HB2 1 1 11 5224 1 1 4 HIS HB3 H -9.638 1.980 0.642 1.00 . A A . 4 HIS HB3 1 1 11 5225 1 1 4 HIS HD1 H -10.395 3.928 -0.629 1.00 . A A . 4 HIS HD1 1 1 11 5226 1 1 4 HIS HD2 H -7.741 1.632 -2.836 1.00 . A A . 4 HIS HD2 1 1 11 5227 1 1 4 HIS HE1 H -10.312 4.992 -2.895 1.00 . A A . 4 HIS HE1 1 1 11 5228 1 1 4 HIS HE2 H -8.990 3.359 -4.269 1.00 . A A . 4 HIS HE2 1 1 11 5229 1 1 4 HIS N N -7.732 0.378 1.598 1.00 . A A . 4 HIS N 1 1 11 5230 1 1 4 HIS ND1 N -9.853 3.574 -1.374 1.00 . A A . 4 HIS ND1 1 1 11 5231 1 1 4 HIS NE2 N -8.930 3.410 -3.287 1.00 . A A . 4 HIS NE2 1 1 11 5232 1 1 4 HIS O O -7.486 3.114 2.106 1.00 . A A . 4 HIS O 1 1 11 5233 1 1 5 TYR C C -4.429 4.309 1.987 1.00 . A A . 5 TYR C 1 1 11 5234 1 1 5 TYR CA C -5.371 4.455 0.802 1.00 . A A . 5 TYR CA 1 1 11 5235 1 1 5 TYR CB C -6.320 5.666 0.931 1.00 . A A . 5 TYR CB 1 1 11 5236 1 1 5 TYR CD1 C -7.049 5.799 -1.465 1.00 . A A . 5 TYR CD1 1 1 11 5237 1 1 5 TYR CD2 C -6.060 7.730 -0.508 1.00 . A A . 5 TYR CD2 1 1 11 5238 1 1 5 TYR CE1 C -7.182 6.456 -2.664 1.00 . A A . 5 TYR CE1 1 1 11 5239 1 1 5 TYR CE2 C -6.196 8.401 -1.708 1.00 . A A . 5 TYR CE2 1 1 11 5240 1 1 5 TYR CG C -6.489 6.412 -0.371 1.00 . A A . 5 TYR CG 1 1 11 5241 1 1 5 TYR CZ C -6.757 7.752 -2.785 1.00 . A A . 5 TYR CZ 1 1 11 5242 1 1 5 TYR H H -5.726 2.758 -0.427 1.00 . A A . 5 TYR H 1 1 11 5243 1 1 5 TYR HA H -4.711 4.652 -0.031 1.00 . A A . 5 TYR HA 1 1 11 5244 1 1 5 TYR HB2 H -7.294 5.312 1.239 1.00 . A A . 5 TYR HB2 1 1 11 5245 1 1 5 TYR HB3 H -5.930 6.351 1.671 1.00 . A A . 5 TYR HB3 1 1 11 5246 1 1 5 TYR HD1 H -7.387 4.777 -1.377 1.00 . A A . 5 TYR HD1 1 1 11 5247 1 1 5 TYR HD2 H -5.622 8.230 0.343 1.00 . A A . 5 TYR HD2 1 1 11 5248 1 1 5 TYR HE1 H -7.628 5.945 -3.504 1.00 . A A . 5 TYR HE1 1 1 11 5249 1 1 5 TYR HE2 H -5.858 9.422 -1.798 1.00 . A A . 5 TYR HE2 1 1 11 5250 1 1 5 TYR HH H -6.091 8.899 -4.186 1.00 . A A . 5 TYR HH 1 1 11 5251 1 1 5 TYR N N -6.039 3.203 0.391 1.00 . A A . 5 TYR N 1 1 11 5252 1 1 5 TYR O O -3.883 5.298 2.484 1.00 . A A . 5 TYR O 1 1 11 5253 1 1 5 TYR OH O -6.898 8.400 -3.999 1.00 . A A . 5 TYR OH 1 1 11 5254 1 1 6 GLY C C -1.890 2.475 2.804 1.00 . A A . 6 GLY C 1 1 11 5255 1 1 6 GLY CA C -3.213 2.862 3.426 1.00 . A A . 6 GLY CA 1 1 11 5256 1 1 6 GLY H H -4.685 2.345 2.013 1.00 . A A . 6 GLY H 1 1 11 5257 1 1 6 GLY HA2 H -3.086 3.769 3.998 1.00 . A A . 6 GLY HA2 1 1 11 5258 1 1 6 GLY HA3 H -3.547 2.067 4.075 1.00 . A A . 6 GLY HA3 1 1 11 5259 1 1 6 GLY N N -4.189 3.097 2.398 1.00 . A A . 6 GLY N 1 1 11 5260 1 1 6 GLY O O -1.857 2.103 1.608 1.00 . A A . 6 GLY O 1 1 11 5261 1 1 7 GLN C C 0.615 0.659 3.098 1.00 . A A . 7 GLN C 1 1 11 5262 1 1 7 GLN CA C 0.496 2.175 3.087 1.00 . A A . 7 GLN CA 1 1 11 5263 1 1 7 GLN CB C 1.615 2.833 3.926 1.00 . A A . 7 GLN CB 1 1 11 5264 1 1 7 GLN CD C 4.123 3.248 4.271 1.00 . A A . 7 GLN CD 1 1 11 5265 1 1 7 GLN CG C 3.046 2.561 3.423 1.00 . A A . 7 GLN CG 1 1 11 5266 1 1 7 GLN H H -0.914 2.844 4.502 1.00 . A A . 7 GLN H 1 1 11 5267 1 1 7 GLN HA H 0.566 2.511 2.062 1.00 . A A . 7 GLN HA 1 1 11 5268 1 1 7 GLN HB2 H 1.460 3.901 3.926 1.00 . A A . 7 GLN HB2 1 1 11 5269 1 1 7 GLN HB3 H 1.539 2.471 4.940 1.00 . A A . 7 GLN HB3 1 1 11 5270 1 1 7 GLN HE21 H 5.392 3.435 2.714 1.00 . A A . 7 GLN HE21 1 1 11 5271 1 1 7 GLN HE22 H 5.934 4.033 4.211 1.00 . A A . 7 GLN HE22 1 1 11 5272 1 1 7 GLN HG2 H 3.220 1.495 3.456 1.00 . A A . 7 GLN HG2 1 1 11 5273 1 1 7 GLN HG3 H 3.131 2.899 2.400 1.00 . A A . 7 GLN HG3 1 1 11 5274 1 1 7 GLN N N -0.819 2.549 3.570 1.00 . A A . 7 GLN N 1 1 11 5275 1 1 7 GLN NE2 N 5.238 3.598 3.669 1.00 . A A . 7 GLN NE2 1 1 11 5276 1 1 7 GLN O O 0.630 0.043 4.146 1.00 . A A . 7 GLN O 1 1 11 5277 1 1 7 GLN OE1 O 3.954 3.457 5.466 1.00 . A A . 7 GLN OE1 1 1 11 5278 1 1 8 CYS C C 2.081 -1.943 1.938 1.00 . A A . 8 CYS C 1 1 11 5279 1 1 8 CYS CA C 0.693 -1.365 1.772 1.00 . A A . 8 CYS CA 1 1 11 5280 1 1 8 CYS CB C 0.121 -1.755 0.422 1.00 . A A . 8 CYS CB 1 1 11 5281 1 1 8 CYS H H 0.664 0.652 1.126 1.00 . A A . 8 CYS H 1 1 11 5282 1 1 8 CYS HA H 0.056 -1.785 2.535 1.00 . A A . 8 CYS HA 1 1 11 5283 1 1 8 CYS HB2 H 0.312 -2.803 0.243 1.00 . A A . 8 CYS HB2 1 1 11 5284 1 1 8 CYS HB3 H -0.946 -1.583 0.423 1.00 . A A . 8 CYS HB3 1 1 11 5285 1 1 8 CYS N N 0.660 0.082 1.926 1.00 . A A . 8 CYS N 1 1 11 5286 1 1 8 CYS O O 2.239 -3.031 2.455 1.00 . A A . 8 CYS O 1 1 11 5287 1 1 8 CYS SG S 0.830 -0.812 -0.973 1.00 . A A . 8 CYS SG 1 1 11 5288 1 1 9 GLY C C 5.395 -1.064 0.739 1.00 . A A . 9 GLY C 1 1 11 5289 1 1 9 GLY CA C 4.411 -1.757 1.617 1.00 . A A . 9 GLY CA 1 1 11 5290 1 1 9 GLY H H 2.923 -0.353 1.092 1.00 . A A . 9 GLY H 1 1 11 5291 1 1 9 GLY HA2 H 4.737 -1.659 2.641 1.00 . A A . 9 GLY HA2 1 1 11 5292 1 1 9 GLY HA3 H 4.388 -2.805 1.357 1.00 . A A . 9 GLY HA3 1 1 11 5293 1 1 9 GLY N N 3.089 -1.225 1.502 1.00 . A A . 9 GLY N 1 1 11 5294 1 1 9 GLY O O 5.626 -1.473 -0.400 1.00 . A A . 9 GLY O 1 1 11 5295 1 1 10 GLY C C 8.210 0.541 1.348 1.00 . A A . 10 GLY C 1 1 11 5296 1 1 10 GLY CA C 6.966 0.707 0.550 1.00 . A A . 10 GLY CA 1 1 11 5297 1 1 10 GLY H H 5.619 0.349 2.099 1.00 . A A . 10 GLY H 1 1 11 5298 1 1 10 GLY HA2 H 7.096 0.283 -0.435 1.00 . A A . 10 GLY HA2 1 1 11 5299 1 1 10 GLY HA3 H 6.730 1.758 0.477 1.00 . A A . 10 GLY HA3 1 1 11 5300 1 1 10 GLY N N 5.913 0.016 1.228 1.00 . A A . 10 GLY N 1 1 11 5301 1 1 10 GLY O O 8.189 -0.197 2.355 1.00 . A A . 10 GLY O 1 1 11 5302 1 1 11 ILE C C 10.260 1.687 3.119 1.00 . A A . 11 ILE C 1 1 11 5303 1 1 11 ILE CA C 10.511 1.101 1.721 1.00 . A A . 11 ILE CA 1 1 11 5304 1 1 11 ILE CB C 11.672 1.851 1.011 1.00 . A A . 11 ILE CB 1 1 11 5305 1 1 11 ILE CD1 C 12.894 2.024 -1.239 1.00 . A A . 11 ILE CD1 1 1 11 5306 1 1 11 ILE CG1 C 11.869 1.282 -0.402 1.00 . A A . 11 ILE CG1 1 1 11 5307 1 1 11 ILE CG2 C 12.965 1.724 1.816 1.00 . A A . 11 ILE CG2 1 1 11 5308 1 1 11 ILE H H 9.253 1.723 0.140 1.00 . A A . 11 ILE H 1 1 11 5309 1 1 11 ILE HA H 10.766 0.057 1.831 1.00 . A A . 11 ILE HA 1 1 11 5310 1 1 11 ILE HB H 11.416 2.898 0.934 1.00 . A A . 11 ILE HB 1 1 11 5311 1 1 11 ILE HD11 H 12.578 3.050 -1.362 1.00 . A A . 11 ILE HD11 1 1 11 5312 1 1 11 ILE HD12 H 12.980 1.553 -2.206 1.00 . A A . 11 ILE HD12 1 1 11 5313 1 1 11 ILE HD13 H 13.847 2.000 -0.737 1.00 . A A . 11 ILE HD13 1 1 11 5314 1 1 11 ILE HG12 H 12.193 0.255 -0.320 1.00 . A A . 11 ILE HG12 1 1 11 5315 1 1 11 ILE HG13 H 10.924 1.311 -0.926 1.00 . A A . 11 ILE HG13 1 1 11 5316 1 1 11 ILE HG21 H 12.817 2.146 2.799 1.00 . A A . 11 ILE HG21 1 1 11 5317 1 1 11 ILE HG22 H 13.760 2.252 1.310 1.00 . A A . 11 ILE HG22 1 1 11 5318 1 1 11 ILE HG23 H 13.230 0.681 1.909 1.00 . A A . 11 ILE HG23 1 1 11 5319 1 1 11 ILE N N 9.279 1.181 0.959 1.00 . A A . 11 ILE N 1 1 11 5320 1 1 11 ILE O O 9.780 2.809 3.253 1.00 . A A . 11 ILE O 1 1 11 5321 1 1 12 GLY C C 9.008 0.693 6.067 1.00 . A A . 12 GLY C 1 1 11 5322 1 1 12 GLY CA C 10.252 1.340 5.480 1.00 . A A . 12 GLY CA 1 1 11 5323 1 1 12 GLY H H 10.888 0.004 3.982 1.00 . A A . 12 GLY H 1 1 11 5324 1 1 12 GLY HA2 H 11.102 1.085 6.095 1.00 . A A . 12 GLY HA2 1 1 11 5325 1 1 12 GLY HA3 H 10.121 2.412 5.483 1.00 . A A . 12 GLY HA3 1 1 11 5326 1 1 12 GLY N N 10.506 0.899 4.134 1.00 . A A . 12 GLY N 1 1 11 5327 1 1 12 GLY O O 8.717 0.857 7.254 1.00 . A A . 12 GLY O 1 1 11 5328 1 1 13 TYR C C 7.200 -2.204 5.375 1.00 . A A . 13 TYR C 1 1 11 5329 1 1 13 TYR CA C 7.082 -0.726 5.703 1.00 . A A . 13 TYR CA 1 1 11 5330 1 1 13 TYR CB C 5.833 -0.127 5.018 1.00 . A A . 13 TYR CB 1 1 11 5331 1 1 13 TYR CD1 C 3.943 -1.852 5.184 1.00 . A A . 13 TYR CD1 1 1 11 5332 1 1 13 TYR CD2 C 3.734 0.175 6.409 1.00 . A A . 13 TYR CD2 1 1 11 5333 1 1 13 TYR CE1 C 2.707 -2.269 5.652 1.00 . A A . 13 TYR CE1 1 1 11 5334 1 1 13 TYR CE2 C 2.505 -0.237 6.885 1.00 . A A . 13 TYR CE2 1 1 11 5335 1 1 13 TYR CG C 4.480 -0.619 5.555 1.00 . A A . 13 TYR CG 1 1 11 5336 1 1 13 TYR CZ C 1.994 -1.457 6.505 1.00 . A A . 13 TYR CZ 1 1 11 5337 1 1 13 TYR H H 8.541 -0.136 4.308 1.00 . A A . 13 TYR H 1 1 11 5338 1 1 13 TYR HA H 6.999 -0.598 6.771 1.00 . A A . 13 TYR HA 1 1 11 5339 1 1 13 TYR HB2 H 5.855 0.946 5.135 1.00 . A A . 13 TYR HB2 1 1 11 5340 1 1 13 TYR HB3 H 5.875 -0.361 3.964 1.00 . A A . 13 TYR HB3 1 1 11 5341 1 1 13 TYR HD1 H 4.504 -2.494 4.520 1.00 . A A . 13 TYR HD1 1 1 11 5342 1 1 13 TYR HD2 H 4.131 1.133 6.708 1.00 . A A . 13 TYR HD2 1 1 11 5343 1 1 13 TYR HE1 H 2.309 -3.227 5.353 1.00 . A A . 13 TYR HE1 1 1 11 5344 1 1 13 TYR HE2 H 1.947 0.402 7.553 1.00 . A A . 13 TYR HE2 1 1 11 5345 1 1 13 TYR HH H 0.153 -1.136 6.709 1.00 . A A . 13 TYR HH 1 1 11 5346 1 1 13 TYR N N 8.279 -0.043 5.251 1.00 . A A . 13 TYR N 1 1 11 5347 1 1 13 TYR O O 7.635 -2.569 4.277 1.00 . A A . 13 TYR O 1 1 11 5348 1 1 13 TYR OH O 0.747 -1.853 6.959 1.00 . A A . 13 TYR OH 1 1 11 5349 1 1 14 SER C C 5.722 -5.016 7.079 1.00 . A A . 14 SER C 1 1 11 5350 1 1 14 SER CA C 6.818 -4.464 6.196 1.00 . A A . 14 SER CA 1 1 11 5351 1 1 14 SER CB C 8.185 -5.054 6.566 1.00 . A A . 14 SER CB 1 1 11 5352 1 1 14 SER H H 6.530 -2.662 7.181 1.00 . A A . 14 SER H 1 1 11 5353 1 1 14 SER HA H 6.585 -4.705 5.169 1.00 . A A . 14 SER HA 1 1 11 5354 1 1 14 SER HB2 H 8.490 -4.656 7.522 1.00 . A A . 14 SER HB2 1 1 11 5355 1 1 14 SER HB3 H 8.104 -6.129 6.638 1.00 . A A . 14 SER HB3 1 1 11 5356 1 1 14 SER N N 6.831 -3.025 6.320 1.00 . A A . 14 SER N 1 1 11 5357 1 1 14 SER O O 5.860 -5.069 8.303 1.00 . A A . 14 SER O 1 1 11 5358 1 1 14 SER OG O 9.165 -4.727 5.547 1.00 . A A . 14 SER OG 1 1 11 5359 1 1 15 GLY C C 2.481 -6.396 6.229 1.00 . A A . 15 GLY C 1 1 11 5360 1 1 15 GLY CA C 3.493 -5.849 7.186 1.00 . A A . 15 GLY CA 1 1 11 5361 1 1 15 GLY H H 4.559 -5.291 5.493 1.00 . A A . 15 GLY H 1 1 11 5362 1 1 15 GLY HA2 H 3.812 -6.623 7.870 1.00 . A A . 15 GLY HA2 1 1 11 5363 1 1 15 GLY HA3 H 3.053 -5.031 7.737 1.00 . A A . 15 GLY HA3 1 1 11 5364 1 1 15 GLY N N 4.622 -5.356 6.469 1.00 . A A . 15 GLY N 1 1 11 5365 1 1 15 GLY O O 2.864 -7.115 5.302 1.00 . A A . 15 GLY O 1 1 11 5366 1 1 16 PRO C C 0.273 -5.878 4.128 1.00 . A A . 16 PRO C 1 1 11 5367 1 1 16 PRO CA C 0.142 -6.529 5.499 1.00 . A A . 16 PRO CA 1 1 11 5368 1 1 16 PRO CB C -1.165 -6.080 6.182 1.00 . A A . 16 PRO CB 1 1 11 5369 1 1 16 PRO CD C 0.652 -5.245 7.480 1.00 . A A . 16 PRO CD 1 1 11 5370 1 1 16 PRO CG C -0.770 -5.705 7.568 1.00 . A A . 16 PRO CG 1 1 11 5371 1 1 16 PRO HA H 0.153 -7.604 5.391 1.00 . A A . 16 PRO HA 1 1 11 5372 1 1 16 PRO HB2 H -1.569 -5.233 5.649 1.00 . A A . 16 PRO HB2 1 1 11 5373 1 1 16 PRO HB3 H -1.882 -6.887 6.179 1.00 . A A . 16 PRO HB3 1 1 11 5374 1 1 16 PRO HD2 H 0.701 -4.195 7.230 1.00 . A A . 16 PRO HD2 1 1 11 5375 1 1 16 PRO HD3 H 1.163 -5.441 8.411 1.00 . A A . 16 PRO HD3 1 1 11 5376 1 1 16 PRO HG2 H -1.401 -4.907 7.930 1.00 . A A . 16 PRO HG2 1 1 11 5377 1 1 16 PRO HG3 H -0.847 -6.566 8.213 1.00 . A A . 16 PRO HG3 1 1 11 5378 1 1 16 PRO N N 1.194 -6.076 6.400 1.00 . A A . 16 PRO N 1 1 11 5379 1 1 16 PRO O O -0.099 -4.725 3.937 1.00 . A A . 16 PRO O 1 1 11 5380 1 1 17 THR C C -0.134 -6.435 0.985 1.00 . A A . 17 THR C 1 1 11 5381 1 1 17 THR CA C 1.040 -6.085 1.887 1.00 . A A . 17 THR CA 1 1 11 5382 1 1 17 THR CB C 2.362 -6.600 1.302 1.00 . A A . 17 THR CB 1 1 11 5383 1 1 17 THR CG2 C 3.553 -5.910 1.954 1.00 . A A . 17 THR CG2 1 1 11 5384 1 1 17 THR H H 1.163 -7.501 3.410 1.00 . A A . 17 THR H 1 1 11 5385 1 1 17 THR HA H 1.103 -5.008 1.964 1.00 . A A . 17 THR HA 1 1 11 5386 1 1 17 THR HB H 2.371 -6.395 0.241 1.00 . A A . 17 THR HB 1 1 11 5387 1 1 17 THR HG1 H 3.112 -8.176 2.209 1.00 . A A . 17 THR HG1 1 1 11 5388 1 1 17 THR HG21 H 3.534 -6.095 3.019 1.00 . A A . 17 THR HG21 1 1 11 5389 1 1 17 THR HG22 H 3.503 -4.847 1.770 1.00 . A A . 17 THR HG22 1 1 11 5390 1 1 17 THR HG23 H 4.467 -6.305 1.539 1.00 . A A . 17 THR HG23 1 1 11 5391 1 1 17 THR N N 0.842 -6.596 3.204 1.00 . A A . 17 THR N 1 1 11 5392 1 1 17 THR O O -0.320 -5.829 -0.069 1.00 . A A . 17 THR O 1 1 11 5393 1 1 17 THR OG1 O 2.462 -8.023 1.509 1.00 . A A . 17 THR OG1 1 1 11 5394 1 1 18 VAL C C -3.223 -6.813 0.846 1.00 . A A . 18 VAL C 1 1 11 5395 1 1 18 VAL CA C -2.106 -7.832 0.668 1.00 . A A . 18 VAL CA 1 1 11 5396 1 1 18 VAL CB C -2.621 -9.229 1.124 1.00 . A A . 18 VAL CB 1 1 11 5397 1 1 18 VAL CG1 C -3.802 -9.681 0.265 1.00 . A A . 18 VAL CG1 1 1 11 5398 1 1 18 VAL CG2 C -1.506 -10.261 1.080 1.00 . A A . 18 VAL CG2 1 1 11 5399 1 1 18 VAL H H -0.711 -7.839 2.268 1.00 . A A . 18 VAL H 1 1 11 5400 1 1 18 VAL HA H -1.838 -7.881 -0.376 1.00 . A A . 18 VAL HA 1 1 11 5401 1 1 18 VAL HB H -2.970 -9.138 2.142 1.00 . A A . 18 VAL HB 1 1 11 5402 1 1 18 VAL HG11 H -4.136 -10.655 0.594 1.00 . A A . 18 VAL HG11 1 1 11 5403 1 1 18 VAL HG12 H -3.496 -9.739 -0.769 1.00 . A A . 18 VAL HG12 1 1 11 5404 1 1 18 VAL HG13 H -4.609 -8.971 0.360 1.00 . A A . 18 VAL HG13 1 1 11 5405 1 1 18 VAL HG21 H -1.141 -10.351 0.068 1.00 . A A . 18 VAL HG21 1 1 11 5406 1 1 18 VAL HG22 H -1.885 -11.218 1.409 1.00 . A A . 18 VAL HG22 1 1 11 5407 1 1 18 VAL HG23 H -0.699 -9.950 1.727 1.00 . A A . 18 VAL HG23 1 1 11 5408 1 1 18 VAL N N -0.931 -7.408 1.416 1.00 . A A . 18 VAL N 1 1 11 5409 1 1 18 VAL O O -3.789 -6.679 1.940 1.00 . A A . 18 VAL O 1 1 11 5410 1 1 19 CYS C C -5.913 -5.746 -0.448 1.00 . A A . 19 CYS C 1 1 11 5411 1 1 19 CYS CA C -4.567 -5.096 -0.174 1.00 . A A . 19 CYS CA 1 1 11 5412 1 1 19 CYS CB C -4.291 -4.002 -1.211 1.00 . A A . 19 CYS CB 1 1 11 5413 1 1 19 CYS H H -3.032 -6.251 -1.038 1.00 . A A . 19 CYS H 1 1 11 5414 1 1 19 CYS HA H -4.582 -4.652 0.810 1.00 . A A . 19 CYS HA 1 1 11 5415 1 1 19 CYS HB2 H -4.293 -4.439 -2.198 1.00 . A A . 19 CYS HB2 1 1 11 5416 1 1 19 CYS HB3 H -5.078 -3.264 -1.150 1.00 . A A . 19 CYS HB3 1 1 11 5417 1 1 19 CYS N N -3.522 -6.096 -0.202 1.00 . A A . 19 CYS N 1 1 11 5418 1 1 19 CYS O O -5.970 -6.859 -1.002 1.00 . A A . 19 CYS O 1 1 11 5419 1 1 19 CYS SG S -2.701 -3.137 -0.992 1.00 . A A . 19 CYS SG 1 1 11 5420 1 1 20 ALA C C -8.641 -5.783 -1.718 1.00 . A A . 20 ALA C 1 1 11 5421 1 1 20 ALA CA C -8.352 -5.526 -0.245 1.00 . A A . 20 ALA CA 1 1 11 5422 1 1 20 ALA CB C -9.338 -4.510 0.316 1.00 . A A . 20 ALA CB 1 1 11 5423 1 1 20 ALA H H -6.848 -4.224 0.444 1.00 . A A . 20 ALA H 1 1 11 5424 1 1 20 ALA HA H -8.475 -6.451 0.297 1.00 . A A . 20 ALA HA 1 1 11 5425 1 1 20 ALA HB1 H -9.115 -4.335 1.357 1.00 . A A . 20 ALA HB1 1 1 11 5426 1 1 20 ALA HB2 H -10.343 -4.894 0.219 1.00 . A A . 20 ALA HB2 1 1 11 5427 1 1 20 ALA HB3 H -9.255 -3.584 -0.235 1.00 . A A . 20 ALA HB3 1 1 11 5428 1 1 20 ALA N N -6.982 -5.069 -0.038 1.00 . A A . 20 ALA N 1 1 11 5429 1 1 20 ALA O O -8.028 -5.161 -2.599 1.00 . A A . 20 ALA O 1 1 11 5430 1 1 21 SER C C -10.435 -5.871 -4.137 1.00 . A A . 21 SER C 1 1 11 5431 1 1 21 SER CA C -9.924 -7.065 -3.317 1.00 . A A . 21 SER CA 1 1 11 5432 1 1 21 SER CB C -10.954 -8.185 -3.271 1.00 . A A . 21 SER CB 1 1 11 5433 1 1 21 SER H H -10.028 -7.093 -1.221 1.00 . A A . 21 SER H 1 1 11 5434 1 1 21 SER HA H -9.033 -7.441 -3.797 1.00 . A A . 21 SER HA 1 1 11 5435 1 1 21 SER HB2 H -11.842 -7.834 -2.768 1.00 . A A . 21 SER HB2 1 1 11 5436 1 1 21 SER HB3 H -11.197 -8.483 -4.280 1.00 . A A . 21 SER HB3 1 1 11 5437 1 1 21 SER HG H -9.961 -9.009 -1.790 1.00 . A A . 21 SER HG 1 1 11 5438 1 1 21 SER N N -9.561 -6.677 -1.976 1.00 . A A . 21 SER N 1 1 11 5439 1 1 21 SER O O -11.492 -5.279 -3.847 1.00 . A A . 21 SER O 1 1 11 5440 1 1 21 SER OG O -10.448 -9.314 -2.567 1.00 . A A . 21 SER OG 1 1 11 5441 1 1 22 GLY C C -9.066 -3.260 -5.768 1.00 . A A . 22 GLY C 1 1 11 5442 1 1 22 GLY CA C -10.014 -4.405 -5.970 1.00 . A A . 22 GLY CA 1 1 11 5443 1 1 22 GLY H H -8.835 -6.001 -5.308 1.00 . A A . 22 GLY H 1 1 11 5444 1 1 22 GLY HA2 H -9.993 -4.713 -7.005 1.00 . A A . 22 GLY HA2 1 1 11 5445 1 1 22 GLY HA3 H -11.010 -4.075 -5.714 1.00 . A A . 22 GLY HA3 1 1 11 5446 1 1 22 GLY N N -9.672 -5.514 -5.138 1.00 . A A . 22 GLY N 1 1 11 5447 1 1 22 GLY O O -9.069 -2.302 -6.534 1.00 . A A . 22 GLY O 1 1 11 5448 1 1 23 THR C C -5.901 -2.908 -4.717 1.00 . A A . 23 THR C 1 1 11 5449 1 1 23 THR CA C -7.279 -2.317 -4.498 1.00 . A A . 23 THR CA 1 1 11 5450 1 1 23 THR CB C -7.407 -1.696 -3.072 1.00 . A A . 23 THR CB 1 1 11 5451 1 1 23 THR CG2 C -8.796 -1.121 -2.868 1.00 . A A . 23 THR CG2 1 1 11 5452 1 1 23 THR H H -8.290 -4.121 -4.143 1.00 . A A . 23 THR H 1 1 11 5453 1 1 23 THR HA H -7.433 -1.547 -5.240 1.00 . A A . 23 THR HA 1 1 11 5454 1 1 23 THR HB H -6.690 -0.895 -2.975 1.00 . A A . 23 THR HB 1 1 11 5455 1 1 23 THR HG1 H -7.361 -3.552 -2.409 1.00 . A A . 23 THR HG1 1 1 11 5456 1 1 23 THR HG21 H -9.528 -1.904 -3.003 1.00 . A A . 23 THR HG21 1 1 11 5457 1 1 23 THR HG22 H -8.973 -0.331 -3.583 1.00 . A A . 23 THR HG22 1 1 11 5458 1 1 23 THR HG23 H -8.877 -0.725 -1.867 1.00 . A A . 23 THR HG23 1 1 11 5459 1 1 23 THR N N -8.254 -3.341 -4.741 1.00 . A A . 23 THR N 1 1 11 5460 1 1 23 THR O O -5.637 -4.045 -4.313 1.00 . A A . 23 THR O 1 1 11 5461 1 1 23 THR OG1 O -7.167 -2.672 -2.054 1.00 . A A . 23 THR OG1 1 1 11 5462 1 1 24 THR C C -2.674 -1.880 -5.013 1.00 . A A . 24 THR C 1 1 11 5463 1 1 24 THR CA C -3.754 -2.683 -5.699 1.00 . A A . 24 THR CA 1 1 11 5464 1 1 24 THR CB C -3.540 -2.682 -7.231 1.00 . A A . 24 THR CB 1 1 11 5465 1 1 24 THR CG2 C -4.386 -3.767 -7.896 1.00 . A A . 24 THR CG2 1 1 11 5466 1 1 24 THR H H -5.301 -1.271 -5.637 1.00 . A A . 24 THR H 1 1 11 5467 1 1 24 THR HA H -3.708 -3.705 -5.357 1.00 . A A . 24 THR HA 1 1 11 5468 1 1 24 THR HB H -2.496 -2.878 -7.426 1.00 . A A . 24 THR HB 1 1 11 5469 1 1 24 THR HG1 H -4.511 -0.942 -7.191 1.00 . A A . 24 THR HG1 1 1 11 5470 1 1 24 THR HG21 H -4.229 -3.751 -8.964 1.00 . A A . 24 THR HG21 1 1 11 5471 1 1 24 THR HG22 H -5.430 -3.590 -7.683 1.00 . A A . 24 THR HG22 1 1 11 5472 1 1 24 THR HG23 H -4.099 -4.733 -7.506 1.00 . A A . 24 THR HG23 1 1 11 5473 1 1 24 THR N N -5.055 -2.187 -5.368 1.00 . A A . 24 THR N 1 1 11 5474 1 1 24 THR O O -2.762 -0.657 -4.929 1.00 . A A . 24 THR O 1 1 11 5475 1 1 24 THR OG1 O -3.883 -1.381 -7.788 1.00 . A A . 24 THR OG1 1 1 11 5476 1 1 25 CYS C C 0.281 -1.249 -4.910 1.00 . A A . 25 CYS C 1 1 11 5477 1 1 25 CYS CA C -0.571 -1.919 -3.853 1.00 . A A . 25 CYS CA 1 1 11 5478 1 1 25 CYS CB C 0.260 -2.942 -3.055 1.00 . A A . 25 CYS CB 1 1 11 5479 1 1 25 CYS H H -1.701 -3.538 -4.564 1.00 . A A . 25 CYS H 1 1 11 5480 1 1 25 CYS HA H -0.956 -1.167 -3.180 1.00 . A A . 25 CYS HA 1 1 11 5481 1 1 25 CYS HB2 H -0.378 -3.424 -2.328 1.00 . A A . 25 CYS HB2 1 1 11 5482 1 1 25 CYS HB3 H 0.645 -3.687 -3.737 1.00 . A A . 25 CYS HB3 1 1 11 5483 1 1 25 CYS N N -1.686 -2.558 -4.498 1.00 . A A . 25 CYS N 1 1 11 5484 1 1 25 CYS O O 0.945 -1.915 -5.720 1.00 . A A . 25 CYS O 1 1 11 5485 1 1 25 CYS SG S 1.680 -2.223 -2.151 1.00 . A A . 25 CYS SG 1 1 11 5486 1 1 26 GLN C C 1.977 1.617 -5.244 1.00 . A A . 26 GLN C 1 1 11 5487 1 1 26 GLN CA C 0.949 0.778 -5.931 1.00 . A A . 26 GLN CA 1 1 11 5488 1 1 26 GLN CB C 0.040 1.649 -6.796 1.00 . A A . 26 GLN CB 1 1 11 5489 1 1 26 GLN CD C -1.771 1.725 -8.554 1.00 . A A . 26 GLN CD 1 1 11 5490 1 1 26 GLN CG C -0.995 0.864 -7.584 1.00 . A A . 26 GLN CG 1 1 11 5491 1 1 26 GLN H H -0.377 0.535 -4.344 1.00 . A A . 26 GLN H 1 1 11 5492 1 1 26 GLN HA H 1.458 0.070 -6.568 1.00 . A A . 26 GLN HA 1 1 11 5493 1 1 26 GLN HB2 H -0.477 2.350 -6.157 1.00 . A A . 26 GLN HB2 1 1 11 5494 1 1 26 GLN HB3 H 0.649 2.204 -7.493 1.00 . A A . 26 GLN HB3 1 1 11 5495 1 1 26 GLN HE21 H -3.336 0.535 -8.381 1.00 . A A . 26 GLN HE21 1 1 11 5496 1 1 26 GLN HE22 H -3.534 1.875 -9.441 1.00 . A A . 26 GLN HE22 1 1 11 5497 1 1 26 GLN HG2 H -0.494 0.085 -8.136 1.00 . A A . 26 GLN HG2 1 1 11 5498 1 1 26 GLN HG3 H -1.690 0.417 -6.888 1.00 . A A . 26 GLN HG3 1 1 11 5499 1 1 26 GLN N N 0.205 0.043 -4.970 1.00 . A A . 26 GLN N 1 1 11 5500 1 1 26 GLN NE2 N -2.994 1.347 -8.819 1.00 . A A . 26 GLN NE2 1 1 11 5501 1 1 26 GLN O O 1.663 2.362 -4.303 1.00 . A A . 26 GLN O 1 1 11 5502 1 1 26 GLN OE1 O -1.256 2.728 -9.078 1.00 . A A . 26 GLN OE1 1 1 11 5503 1 1 27 VAL C C 4.127 3.657 -5.713 1.00 . A A . 27 VAL C 1 1 11 5504 1 1 27 VAL CA C 4.293 2.246 -5.170 1.00 . A A . 27 VAL CA 1 1 11 5505 1 1 27 VAL CB C 5.652 1.634 -5.608 1.00 . A A . 27 VAL CB 1 1 11 5506 1 1 27 VAL CG1 C 6.828 2.451 -5.099 1.00 . A A . 27 VAL CG1 1 1 11 5507 1 1 27 VAL CG2 C 5.758 0.204 -5.108 1.00 . A A . 27 VAL CG2 1 1 11 5508 1 1 27 VAL H H 3.387 0.787 -6.357 1.00 . A A . 27 VAL H 1 1 11 5509 1 1 27 VAL HA H 4.231 2.265 -4.091 1.00 . A A . 27 VAL HA 1 1 11 5510 1 1 27 VAL HB H 5.690 1.614 -6.687 1.00 . A A . 27 VAL HB 1 1 11 5511 1 1 27 VAL HG11 H 7.752 2.004 -5.434 1.00 . A A . 27 VAL HG11 1 1 11 5512 1 1 27 VAL HG12 H 6.808 2.471 -4.019 1.00 . A A . 27 VAL HG12 1 1 11 5513 1 1 27 VAL HG13 H 6.754 3.460 -5.476 1.00 . A A . 27 VAL HG13 1 1 11 5514 1 1 27 VAL HG21 H 5.738 0.202 -4.028 1.00 . A A . 27 VAL HG21 1 1 11 5515 1 1 27 VAL HG22 H 6.675 -0.245 -5.458 1.00 . A A . 27 VAL HG22 1 1 11 5516 1 1 27 VAL HG23 H 4.915 -0.362 -5.476 1.00 . A A . 27 VAL HG23 1 1 11 5517 1 1 27 VAL N N 3.199 1.460 -5.670 1.00 . A A . 27 VAL N 1 1 11 5518 1 1 27 VAL O O 4.355 3.912 -6.903 1.00 . A A . 27 VAL O 1 1 11 5519 1 1 28 LEU C C 4.649 6.688 -5.240 1.00 . A A . 28 LEU C 1 1 11 5520 1 1 28 LEU CA C 3.352 5.896 -5.262 1.00 . A A . 28 LEU CA 1 1 11 5521 1 1 28 LEU CB C 2.310 6.470 -4.266 1.00 . A A . 28 LEU CB 1 1 11 5522 1 1 28 LEU CD1 C 0.334 7.923 -3.723 1.00 . A A . 28 LEU CD1 1 1 11 5523 1 1 28 LEU CD2 C 2.308 8.956 -4.792 1.00 . A A . 28 LEU CD2 1 1 11 5524 1 1 28 LEU CG C 1.470 7.694 -4.705 1.00 . A A . 28 LEU CG 1 1 11 5525 1 1 28 LEU H H 3.541 4.267 -3.936 1.00 . A A . 28 LEU H 1 1 11 5526 1 1 28 LEU HA H 2.939 5.888 -6.260 1.00 . A A . 28 LEU HA 1 1 11 5527 1 1 28 LEU HB2 H 1.637 5.680 -3.974 1.00 . A A . 28 LEU HB2 1 1 11 5528 1 1 28 LEU HB3 H 2.862 6.758 -3.382 1.00 . A A . 28 LEU HB3 1 1 11 5529 1 1 28 LEU HD11 H -0.303 7.050 -3.696 1.00 . A A . 28 LEU HD11 1 1 11 5530 1 1 28 LEU HD12 H -0.243 8.779 -4.039 1.00 . A A . 28 LEU HD12 1 1 11 5531 1 1 28 LEU HD13 H 0.739 8.105 -2.740 1.00 . A A . 28 LEU HD13 1 1 11 5532 1 1 28 LEU HD21 H 3.108 8.803 -5.498 1.00 . A A . 28 LEU HD21 1 1 11 5533 1 1 28 LEU HD22 H 2.723 9.191 -3.823 1.00 . A A . 28 LEU HD22 1 1 11 5534 1 1 28 LEU HD23 H 1.688 9.775 -5.127 1.00 . A A . 28 LEU HD23 1 1 11 5535 1 1 28 LEU HG H 1.039 7.494 -5.675 1.00 . A A . 28 LEU HG 1 1 11 5536 1 1 28 LEU N N 3.661 4.538 -4.872 1.00 . A A . 28 LEU N 1 1 11 5537 1 1 28 LEU O O 4.975 7.422 -6.184 1.00 . A A . 28 LEU O 1 1 11 5538 1 1 29 ASN C C 7.577 5.962 -3.514 1.00 . A A . 29 ASN C 1 1 11 5539 1 1 29 ASN CA C 6.670 7.095 -3.941 1.00 . A A . 29 ASN CA 1 1 11 5540 1 1 29 ASN CB C 6.576 8.125 -2.793 1.00 . A A . 29 ASN CB 1 1 11 5541 1 1 29 ASN CG C 5.645 9.292 -3.043 1.00 . A A . 29 ASN CG 1 1 11 5542 1 1 29 ASN H H 5.091 5.818 -3.515 1.00 . A A . 29 ASN H 1 1 11 5543 1 1 29 ASN HA H 7.030 7.558 -4.848 1.00 . A A . 29 ASN HA 1 1 11 5544 1 1 29 ASN HB2 H 6.246 7.621 -1.899 1.00 . A A . 29 ASN HB2 1 1 11 5545 1 1 29 ASN HB3 H 7.568 8.516 -2.620 1.00 . A A . 29 ASN HB3 1 1 11 5546 1 1 29 ASN HD21 H 5.244 9.412 -1.115 1.00 . A A . 29 ASN HD21 1 1 11 5547 1 1 29 ASN HD22 H 4.452 10.559 -2.128 1.00 . A A . 29 ASN HD22 1 1 11 5548 1 1 29 ASN N N 5.387 6.477 -4.184 1.00 . A A . 29 ASN N 1 1 11 5549 1 1 29 ASN ND2 N 5.058 9.799 -1.994 1.00 . A A . 29 ASN ND2 1 1 11 5550 1 1 29 ASN O O 7.068 4.903 -3.198 1.00 . A A . 29 ASN O 1 1 11 5551 1 1 29 ASN OD1 O 5.465 9.735 -4.161 1.00 . A A . 29 ASN OD1 1 1 11 5552 1 1 30 PRO C C 9.505 4.412 -1.742 1.00 . A A . 30 PRO C 1 1 11 5553 1 1 30 PRO CA C 9.839 5.057 -3.096 1.00 . A A . 30 PRO CA 1 1 11 5554 1 1 30 PRO CB C 11.190 5.764 -3.031 1.00 . A A . 30 PRO CB 1 1 11 5555 1 1 30 PRO CD C 9.647 7.365 -3.853 1.00 . A A . 30 PRO CD 1 1 11 5556 1 1 30 PRO CG C 11.054 6.867 -4.012 1.00 . A A . 30 PRO CG 1 1 11 5557 1 1 30 PRO HA H 9.871 4.287 -3.852 1.00 . A A . 30 PRO HA 1 1 11 5558 1 1 30 PRO HB2 H 11.354 6.138 -2.032 1.00 . A A . 30 PRO HB2 1 1 11 5559 1 1 30 PRO HB3 H 11.984 5.086 -3.303 1.00 . A A . 30 PRO HB3 1 1 11 5560 1 1 30 PRO HD2 H 9.598 8.101 -3.064 1.00 . A A . 30 PRO HD2 1 1 11 5561 1 1 30 PRO HD3 H 9.271 7.774 -4.779 1.00 . A A . 30 PRO HD3 1 1 11 5562 1 1 30 PRO HG2 H 11.764 7.651 -3.798 1.00 . A A . 30 PRO HG2 1 1 11 5563 1 1 30 PRO HG3 H 11.200 6.490 -5.012 1.00 . A A . 30 PRO HG3 1 1 11 5564 1 1 30 PRO N N 8.911 6.139 -3.480 1.00 . A A . 30 PRO N 1 1 11 5565 1 1 30 PRO O O 9.537 3.185 -1.602 1.00 . A A . 30 PRO O 1 1 11 5566 1 1 31 TYR C C 7.365 4.491 0.714 1.00 . A A . 31 TYR C 1 1 11 5567 1 1 31 TYR CA C 8.877 4.645 0.543 1.00 . A A . 31 TYR CA 1 1 11 5568 1 1 31 TYR CB C 9.408 5.559 1.673 1.00 . A A . 31 TYR CB 1 1 11 5569 1 1 31 TYR CD1 C 11.899 5.273 2.090 1.00 . A A . 31 TYR CD1 1 1 11 5570 1 1 31 TYR CD2 C 11.170 7.193 0.894 1.00 . A A . 31 TYR CD2 1 1 11 5571 1 1 31 TYR CE1 C 13.210 5.706 1.981 1.00 . A A . 31 TYR CE1 1 1 11 5572 1 1 31 TYR CE2 C 12.466 7.627 0.780 1.00 . A A . 31 TYR CE2 1 1 11 5573 1 1 31 TYR CG C 10.857 6.010 1.545 1.00 . A A . 31 TYR CG 1 1 11 5574 1 1 31 TYR CZ C 13.483 6.887 1.323 1.00 . A A . 31 TYR CZ 1 1 11 5575 1 1 31 TYR H H 9.101 6.184 -0.897 1.00 . A A . 31 TYR H 1 1 11 5576 1 1 31 TYR HA H 9.356 3.682 0.620 1.00 . A A . 31 TYR HA 1 1 11 5577 1 1 31 TYR HB2 H 8.794 6.444 1.740 1.00 . A A . 31 TYR HB2 1 1 11 5578 1 1 31 TYR HB3 H 9.317 5.019 2.604 1.00 . A A . 31 TYR HB3 1 1 11 5579 1 1 31 TYR HD1 H 11.676 4.348 2.602 1.00 . A A . 31 TYR HD1 1 1 11 5580 1 1 31 TYR HD2 H 10.377 7.784 0.466 1.00 . A A . 31 TYR HD2 1 1 11 5581 1 1 31 TYR HE1 H 14.010 5.122 2.411 1.00 . A A . 31 TYR HE1 1 1 11 5582 1 1 31 TYR HE2 H 12.682 8.552 0.267 1.00 . A A . 31 TYR HE2 1 1 11 5583 1 1 31 TYR HH H 14.754 8.296 1.257 1.00 . A A . 31 TYR HH 1 1 11 5584 1 1 31 TYR N N 9.166 5.216 -0.750 1.00 . A A . 31 TYR N 1 1 11 5585 1 1 31 TYR O O 6.889 3.625 1.450 1.00 . A A . 31 TYR O 1 1 11 5586 1 1 31 TYR OH O 14.780 7.333 1.200 1.00 . A A . 31 TYR OH 1 1 11 5587 1 1 32 TYR C C 4.501 4.413 -0.926 1.00 . A A . 32 TYR C 1 1 11 5588 1 1 32 TYR CA C 5.173 5.281 0.150 1.00 . A A . 32 TYR CA 1 1 11 5589 1 1 32 TYR CB C 4.615 6.702 0.135 1.00 . A A . 32 TYR CB 1 1 11 5590 1 1 32 TYR CD1 C 2.175 7.093 -0.316 1.00 . A A . 32 TYR CD1 1 1 11 5591 1 1 32 TYR CD2 C 2.839 6.669 1.925 1.00 . A A . 32 TYR CD2 1 1 11 5592 1 1 32 TYR CE1 C 0.872 7.223 0.093 1.00 . A A . 32 TYR CE1 1 1 11 5593 1 1 32 TYR CE2 C 1.531 6.792 2.345 1.00 . A A . 32 TYR CE2 1 1 11 5594 1 1 32 TYR CG C 3.181 6.819 0.586 1.00 . A A . 32 TYR CG 1 1 11 5595 1 1 32 TYR CZ C 0.553 7.077 1.423 1.00 . A A . 32 TYR CZ 1 1 11 5596 1 1 32 TYR H H 7.035 5.955 -0.581 1.00 . A A . 32 TYR H 1 1 11 5597 1 1 32 TYR HA H 4.945 4.849 1.112 1.00 . A A . 32 TYR HA 1 1 11 5598 1 1 32 TYR HB2 H 5.214 7.346 0.760 1.00 . A A . 32 TYR HB2 1 1 11 5599 1 1 32 TYR HB3 H 4.653 7.058 -0.885 1.00 . A A . 32 TYR HB3 1 1 11 5600 1 1 32 TYR HD1 H 2.420 7.213 -1.361 1.00 . A A . 32 TYR HD1 1 1 11 5601 1 1 32 TYR HD2 H 3.615 6.447 2.644 1.00 . A A . 32 TYR HD2 1 1 11 5602 1 1 32 TYR HE1 H 0.103 7.433 -0.635 1.00 . A A . 32 TYR HE1 1 1 11 5603 1 1 32 TYR HE2 H 1.283 6.677 3.390 1.00 . A A . 32 TYR HE2 1 1 11 5604 1 1 32 TYR HH H -1.279 7.018 1.042 1.00 . A A . 32 TYR HH 1 1 11 5605 1 1 32 TYR N N 6.610 5.315 0.028 1.00 . A A . 32 TYR N 1 1 11 5606 1 1 32 TYR O O 4.487 4.766 -2.107 1.00 . A A . 32 TYR O 1 1 11 5607 1 1 32 TYR OH O -0.752 7.214 1.825 1.00 . A A . 32 TYR OH 1 1 11 5608 1 1 33 SER C C 1.715 2.496 -0.849 1.00 . A A . 33 SER C 1 1 11 5609 1 1 33 SER CA C 3.115 2.524 -1.405 1.00 . A A . 33 SER CA 1 1 11 5610 1 1 33 SER CB C 3.693 1.117 -1.496 1.00 . A A . 33 SER CB 1 1 11 5611 1 1 33 SER H H 3.966 3.077 0.424 1.00 . A A . 33 SER H 1 1 11 5612 1 1 33 SER HA H 3.106 2.994 -2.376 1.00 . A A . 33 SER HA 1 1 11 5613 1 1 33 SER HB2 H 3.638 0.646 -0.526 1.00 . A A . 33 SER HB2 1 1 11 5614 1 1 33 SER HB3 H 3.124 0.540 -2.209 1.00 . A A . 33 SER HB3 1 1 11 5615 1 1 33 SER HG H 5.435 0.283 -1.750 1.00 . A A . 33 SER HG 1 1 11 5616 1 1 33 SER N N 3.897 3.346 -0.513 1.00 . A A . 33 SER N 1 1 11 5617 1 1 33 SER O O 1.548 2.386 0.361 1.00 . A A . 33 SER O 1 1 11 5618 1 1 33 SER OG O 5.044 1.149 -1.910 1.00 . A A . 33 SER OG 1 1 11 5619 1 1 34 GLN C C -1.554 1.798 -2.018 1.00 . A A . 34 GLN C 1 1 11 5620 1 1 34 GLN CA C -0.629 2.731 -1.244 1.00 . A A . 34 GLN CA 1 1 11 5621 1 1 34 GLN CB C -1.047 4.205 -1.390 1.00 . A A . 34 GLN CB 1 1 11 5622 1 1 34 GLN CD C -2.794 5.982 -1.140 1.00 . A A . 34 GLN CD 1 1 11 5623 1 1 34 GLN CG C -2.506 4.498 -1.139 1.00 . A A . 34 GLN CG 1 1 11 5624 1 1 34 GLN H H 0.912 2.575 -2.660 1.00 . A A . 34 GLN H 1 1 11 5625 1 1 34 GLN HA H -0.667 2.473 -0.197 1.00 . A A . 34 GLN HA 1 1 11 5626 1 1 34 GLN HB2 H -0.472 4.796 -0.695 1.00 . A A . 34 GLN HB2 1 1 11 5627 1 1 34 GLN HB3 H -0.807 4.532 -2.392 1.00 . A A . 34 GLN HB3 1 1 11 5628 1 1 34 GLN HE21 H -2.718 6.049 0.846 1.00 . A A . 34 GLN HE21 1 1 11 5629 1 1 34 GLN HE22 H -3.012 7.542 0.010 1.00 . A A . 34 GLN HE22 1 1 11 5630 1 1 34 GLN HG2 H -3.102 4.022 -1.904 1.00 . A A . 34 GLN HG2 1 1 11 5631 1 1 34 GLN HG3 H -2.766 4.094 -0.171 1.00 . A A . 34 GLN HG3 1 1 11 5632 1 1 34 GLN N N 0.736 2.603 -1.690 1.00 . A A . 34 GLN N 1 1 11 5633 1 1 34 GLN NE2 N -2.845 6.574 0.025 1.00 . A A . 34 GLN NE2 1 1 11 5634 1 1 34 GLN O O -1.342 1.561 -3.206 1.00 . A A . 34 GLN O 1 1 11 5635 1 1 34 GLN OE1 O -3.052 6.578 -2.173 1.00 . A A . 34 GLN OE1 1 1 11 5636 1 1 35 CYS C C -4.521 1.241 -2.699 1.00 . A A . 35 CYS C 1 1 11 5637 1 1 35 CYS CA C -3.508 0.378 -1.963 1.00 . A A . 35 CYS CA 1 1 11 5638 1 1 35 CYS CB C -4.232 -0.493 -0.940 1.00 . A A . 35 CYS CB 1 1 11 5639 1 1 35 CYS H H -2.592 1.345 -0.358 1.00 . A A . 35 CYS H 1 1 11 5640 1 1 35 CYS HA H -3.001 -0.256 -2.674 1.00 . A A . 35 CYS HA 1 1 11 5641 1 1 35 CYS HB2 H -4.849 0.129 -0.310 1.00 . A A . 35 CYS HB2 1 1 11 5642 1 1 35 CYS HB3 H -4.874 -1.163 -1.486 1.00 . A A . 35 CYS HB3 1 1 11 5643 1 1 35 CYS N N -2.532 1.222 -1.328 1.00 . A A . 35 CYS N 1 1 11 5644 1 1 35 CYS O O -5.367 1.912 -2.070 1.00 . A A . 35 CYS O 1 1 11 5645 1 1 35 CYS SG S -3.153 -1.497 0.128 1.00 . A A . 35 CYS SG 1 1 11 5646 1 1 36 LEU C C -6.140 1.006 -5.590 1.00 . A A . 36 LEU C 1 1 11 5647 1 1 36 LEU CA C -5.265 1.990 -4.865 1.00 . A A . 36 LEU CA 1 1 11 5648 1 1 36 LEU CB C -4.451 2.826 -5.865 1.00 . A A . 36 LEU CB 1 1 11 5649 1 1 36 LEU CD1 C -2.754 4.609 -6.341 1.00 . A A . 36 LEU CD1 1 1 11 5650 1 1 36 LEU CD2 C -4.473 4.975 -4.585 1.00 . A A . 36 LEU CD2 1 1 11 5651 1 1 36 LEU CG C -3.591 3.945 -5.266 1.00 . A A . 36 LEU CG 1 1 11 5652 1 1 36 LEU H H -3.677 0.736 -4.406 1.00 . A A . 36 LEU H 1 1 11 5653 1 1 36 LEU HA H -5.887 2.646 -4.273 1.00 . A A . 36 LEU HA 1 1 11 5654 1 1 36 LEU HB2 H -3.799 2.157 -6.405 1.00 . A A . 36 LEU HB2 1 1 11 5655 1 1 36 LEU HB3 H -5.140 3.271 -6.566 1.00 . A A . 36 LEU HB3 1 1 11 5656 1 1 36 LEU HD11 H -3.407 5.032 -7.089 1.00 . A A . 36 LEU HD11 1 1 11 5657 1 1 36 LEU HD12 H -2.101 3.881 -6.799 1.00 . A A . 36 LEU HD12 1 1 11 5658 1 1 36 LEU HD13 H -2.160 5.395 -5.899 1.00 . A A . 36 LEU HD13 1 1 11 5659 1 1 36 LEU HD21 H -5.019 4.511 -3.777 1.00 . A A . 36 LEU HD21 1 1 11 5660 1 1 36 LEU HD22 H -5.171 5.382 -5.302 1.00 . A A . 36 LEU HD22 1 1 11 5661 1 1 36 LEU HD23 H -3.859 5.773 -4.192 1.00 . A A . 36 LEU HD23 1 1 11 5662 1 1 36 LEU HG H -2.923 3.529 -4.526 1.00 . A A . 36 LEU HG 1 1 11 5663 1 1 36 LEU N N -4.399 1.262 -3.989 1.00 . A A . 36 LEU N 1 1 11 5664 1 1 36 LEU O O -5.607 0.211 -6.399 1.00 . A A . 36 LEU O 1 1 11 5665 1 1 36 LEU OXT O -7.352 1.008 -5.362 1.00 . A A . 36 LEU OXT 1 1 11 5666 2 2 1 MAN C1 C 10.477 -5.024 5.933 1.00 . B A . 101 MAN C1 1 1 11 5667 2 2 1 MAN C2 C 11.003 -3.943 6.892 1.00 . B A . 101 MAN C2 1 1 11 5668 2 2 1 MAN C3 C 11.045 -2.607 6.165 1.00 . B A . 101 MAN C3 1 1 11 5669 2 2 1 MAN C4 C 11.912 -2.732 4.928 1.00 . B A . 101 MAN C4 1 1 11 5670 2 2 1 MAN C5 C 11.392 -3.855 4.017 1.00 . B A . 101 MAN C5 1 1 11 5671 2 2 1 MAN C6 C 12.301 -4.110 2.818 1.00 . B A . 101 MAN C6 1 1 11 5672 2 2 1 MAN H1 H 10.544 -6.020 6.390 1.00 . B A . 101 MAN H1 1 1 11 5673 2 2 1 MAN H2 H 10.342 -3.835 7.763 1.00 . B A . 101 MAN H2 1 1 11 5674 2 2 1 MAN H3 H 10.036 -2.305 5.843 1.00 . B A . 101 MAN H3 1 1 11 5675 2 2 1 MAN H4 H 12.937 -2.987 5.232 1.00 . B A . 101 MAN H4 1 1 11 5676 2 2 1 MAN H5 H 10.372 -3.625 3.677 1.00 . B A . 101 MAN H5 1 1 11 5677 2 2 1 MAN H61 H 11.910 -4.979 2.270 1.00 . B A . 101 MAN H61 1 1 11 5678 2 2 1 MAN H62 H 13.302 -4.365 3.191 1.00 . B A . 101 MAN H62 1 1 11 5679 2 2 1 MAN HO2 H 12.632 -3.469 7.781 1.00 . B A . 101 MAN HO2 1 1 11 5680 2 2 1 MAN HO3 H 11.775 -0.863 6.422 1.00 . B A . 101 MAN HO3 1 1 11 5681 2 2 1 MAN HO4 H 12.440 -1.681 3.445 1.00 . B A . 101 MAN HO4 1 1 11 5682 2 2 1 MAN HO6 H 11.512 -2.883 1.547 1.00 . B A . 101 MAN HO6 1 1 11 5683 2 2 1 MAN O2 O 12.318 -4.247 7.305 1.00 . B A . 101 MAN O2 1 1 11 5684 2 2 1 MAN O3 O 11.637 -1.625 6.998 1.00 . B A . 101 MAN O3 1 1 11 5685 2 2 1 MAN O4 O 11.911 -1.497 4.235 1.00 . B A . 101 MAN O4 1 1 11 5686 2 2 1 MAN O5 O 11.334 -5.089 4.775 1.00 . B A . 101 MAN O5 1 1 11 5687 2 2 1 MAN O6 O 12.382 -2.970 1.956 1.00 . B A . 101 MAN O6 1 1 12 5688 1 1 1 THR C C -5.643 -6.198 4.768 1.00 . A A . 1 THR C 1 1 12 5689 1 1 1 THR CA C -5.658 -7.699 4.457 1.00 . A A . 1 THR CA 1 1 12 5690 1 1 1 THR CB C -6.938 -8.067 3.683 1.00 . A A . 1 THR CB 1 1 12 5691 1 1 1 THR CG2 C -6.847 -7.588 2.255 1.00 . A A . 1 THR CG2 1 1 12 5692 1 1 1 THR H1 H -6.500 -8.163 6.247 1.00 . A A . 1 THR H1 1 1 12 5693 1 1 1 THR H2 H -4.809 -8.132 6.253 1.00 . A A . 1 THR H2 1 1 12 5694 1 1 1 THR H3 H -5.631 -9.440 5.524 1.00 . A A . 1 THR H3 1 1 12 5695 1 1 1 THR HA H -4.789 -7.965 3.876 1.00 . A A . 1 THR HA 1 1 12 5696 1 1 1 THR HB H -7.791 -7.611 4.163 1.00 . A A . 1 THR HB 1 1 12 5697 1 1 1 THR HG1 H -7.142 -9.806 2.758 1.00 . A A . 1 THR HG1 1 1 12 5698 1 1 1 THR HG21 H -6.005 -8.061 1.768 1.00 . A A . 1 THR HG21 1 1 12 5699 1 1 1 THR HG22 H -6.716 -6.517 2.241 1.00 . A A . 1 THR HG22 1 1 12 5700 1 1 1 THR HG23 H -7.753 -7.846 1.732 1.00 . A A . 1 THR HG23 1 1 12 5701 1 1 1 THR N N -5.648 -8.418 5.709 1.00 . A A . 1 THR N 1 1 12 5702 1 1 1 THR O O -6.189 -5.782 5.783 1.00 . A A . 1 THR O 1 1 12 5703 1 1 1 THR OG1 O -7.090 -9.501 3.674 1.00 . A A . 1 THR OG1 1 1 12 5704 1 1 2 GLN C C -6.115 -3.318 3.406 1.00 . A A . 2 GLN C 1 1 12 5705 1 1 2 GLN CA C -4.914 -3.971 4.140 1.00 . A A . 2 GLN CA 1 1 12 5706 1 1 2 GLN CB C -3.561 -3.471 3.580 1.00 . A A . 2 GLN CB 1 1 12 5707 1 1 2 GLN CD C -3.758 -1.037 4.298 1.00 . A A . 2 GLN CD 1 1 12 5708 1 1 2 GLN CG C -2.922 -2.281 4.320 1.00 . A A . 2 GLN CG 1 1 12 5709 1 1 2 GLN H H -4.545 -5.780 3.143 1.00 . A A . 2 GLN H 1 1 12 5710 1 1 2 GLN HA H -4.977 -3.765 5.199 1.00 . A A . 2 GLN HA 1 1 12 5711 1 1 2 GLN HB2 H -2.858 -4.289 3.603 1.00 . A A . 2 GLN HB2 1 1 12 5712 1 1 2 GLN HB3 H -3.709 -3.185 2.549 1.00 . A A . 2 GLN HB3 1 1 12 5713 1 1 2 GLN HE21 H -2.947 -0.521 2.604 1.00 . A A . 2 GLN HE21 1 1 12 5714 1 1 2 GLN HE22 H -4.160 0.540 3.226 1.00 . A A . 2 GLN HE22 1 1 12 5715 1 1 2 GLN HG2 H -2.770 -2.558 5.352 1.00 . A A . 2 GLN HG2 1 1 12 5716 1 1 2 GLN HG3 H -1.966 -2.067 3.866 1.00 . A A . 2 GLN HG3 1 1 12 5717 1 1 2 GLN N N -4.995 -5.405 3.935 1.00 . A A . 2 GLN N 1 1 12 5718 1 1 2 GLN NE2 N -3.601 -0.259 3.286 1.00 . A A . 2 GLN NE2 1 1 12 5719 1 1 2 GLN O O -6.635 -3.881 2.443 1.00 . A A . 2 GLN O 1 1 12 5720 1 1 2 GLN OE1 O -4.578 -0.798 5.189 1.00 . A A . 2 GLN OE1 1 1 12 5721 1 1 3 SER C C -7.314 -0.486 2.198 1.00 . A A . 3 SER C 1 1 12 5722 1 1 3 SER CA C -7.702 -1.490 3.310 1.00 . A A . 3 SER CA 1 1 12 5723 1 1 3 SER CB C -8.434 -0.763 4.437 1.00 . A A . 3 SER CB 1 1 12 5724 1 1 3 SER H H -6.041 -1.715 4.577 1.00 . A A . 3 SER H 1 1 12 5725 1 1 3 SER HA H -8.366 -2.237 2.902 1.00 . A A . 3 SER HA 1 1 12 5726 1 1 3 SER HB2 H -7.798 0.012 4.838 1.00 . A A . 3 SER HB2 1 1 12 5727 1 1 3 SER HB3 H -9.340 -0.322 4.049 1.00 . A A . 3 SER HB3 1 1 12 5728 1 1 3 SER HG H -8.114 -2.372 5.486 1.00 . A A . 3 SER HG 1 1 12 5729 1 1 3 SER N N -6.546 -2.166 3.864 1.00 . A A . 3 SER N 1 1 12 5730 1 1 3 SER O O -6.135 -0.235 1.935 1.00 . A A . 3 SER O 1 1 12 5731 1 1 3 SER OG O -8.774 -1.664 5.480 1.00 . A A . 3 SER OG 1 1 12 5732 1 1 4 HIS C C -7.680 2.383 1.117 1.00 . A A . 4 HIS C 1 1 12 5733 1 1 4 HIS CA C -8.156 1.048 0.505 1.00 . A A . 4 HIS CA 1 1 12 5734 1 1 4 HIS CB C -9.510 1.213 -0.223 1.00 . A A . 4 HIS CB 1 1 12 5735 1 1 4 HIS CD2 C -8.478 2.319 -2.340 1.00 . A A . 4 HIS CD2 1 1 12 5736 1 1 4 HIS CE1 C -10.316 3.031 -3.258 1.00 . A A . 4 HIS CE1 1 1 12 5737 1 1 4 HIS CG C -9.490 1.990 -1.514 1.00 . A A . 4 HIS CG 1 1 12 5738 1 1 4 HIS H H -9.229 -0.189 1.825 1.00 . A A . 4 HIS H 1 1 12 5739 1 1 4 HIS HA H -7.415 0.681 -0.190 1.00 . A A . 4 HIS HA 1 1 12 5740 1 1 4 HIS HB2 H -9.904 0.235 -0.452 1.00 . A A . 4 HIS HB2 1 1 12 5741 1 1 4 HIS HB3 H -10.196 1.708 0.447 1.00 . A A . 4 HIS HB3 1 1 12 5742 1 1 4 HIS HD1 H -11.549 2.395 -1.770 1.00 . A A . 4 HIS HD1 1 1 12 5743 1 1 4 HIS HD2 H -7.428 2.115 -2.182 1.00 . A A . 4 HIS HD2 1 1 12 5744 1 1 4 HIS HE1 H -11.004 3.482 -3.954 1.00 . A A . 4 HIS HE1 1 1 12 5745 1 1 4 HIS HE2 H -8.571 3.057 -4.277 1.00 . A A . 4 HIS HE2 1 1 12 5746 1 1 4 HIS N N -8.320 0.073 1.565 1.00 . A A . 4 HIS N 1 1 12 5747 1 1 4 HIS ND1 N -10.629 2.458 -2.119 1.00 . A A . 4 HIS ND1 1 1 12 5748 1 1 4 HIS NE2 N -9.021 2.959 -3.407 1.00 . A A . 4 HIS NE2 1 1 12 5749 1 1 4 HIS O O -8.193 2.810 2.163 1.00 . A A . 4 HIS O 1 1 12 5750 1 1 5 TYR C C -5.263 4.109 2.187 1.00 . A A . 5 TYR C 1 1 12 5751 1 1 5 TYR CA C -6.073 4.269 0.907 1.00 . A A . 5 TYR CA 1 1 12 5752 1 1 5 TYR CB C -7.058 5.449 1.022 1.00 . A A . 5 TYR CB 1 1 12 5753 1 1 5 TYR CD1 C -9.095 5.654 -0.440 1.00 . A A . 5 TYR CD1 1 1 12 5754 1 1 5 TYR CD2 C -7.010 6.397 -1.302 1.00 . A A . 5 TYR CD2 1 1 12 5755 1 1 5 TYR CE1 C -9.715 6.014 -1.615 1.00 . A A . 5 TYR CE1 1 1 12 5756 1 1 5 TYR CE2 C -7.622 6.759 -2.480 1.00 . A A . 5 TYR CE2 1 1 12 5757 1 1 5 TYR CG C -7.733 5.841 -0.264 1.00 . A A . 5 TYR CG 1 1 12 5758 1 1 5 TYR CZ C -8.975 6.565 -2.634 1.00 . A A . 5 TYR CZ 1 1 12 5759 1 1 5 TYR H H -6.324 2.580 -0.341 1.00 . A A . 5 TYR H 1 1 12 5760 1 1 5 TYR HA H -5.354 4.498 0.134 1.00 . A A . 5 TYR HA 1 1 12 5761 1 1 5 TYR HB2 H -7.830 5.186 1.724 1.00 . A A . 5 TYR HB2 1 1 12 5762 1 1 5 TYR HB3 H -6.523 6.311 1.396 1.00 . A A . 5 TYR HB3 1 1 12 5763 1 1 5 TYR HD1 H -9.673 5.221 0.362 1.00 . A A . 5 TYR HD1 1 1 12 5764 1 1 5 TYR HD2 H -5.947 6.550 -1.182 1.00 . A A . 5 TYR HD2 1 1 12 5765 1 1 5 TYR HE1 H -10.778 5.858 -1.730 1.00 . A A . 5 TYR HE1 1 1 12 5766 1 1 5 TYR HE2 H -7.037 7.191 -3.277 1.00 . A A . 5 TYR HE2 1 1 12 5767 1 1 5 TYR HH H -10.460 7.294 -3.595 1.00 . A A . 5 TYR HH 1 1 12 5768 1 1 5 TYR N N -6.689 3.001 0.470 1.00 . A A . 5 TYR N 1 1 12 5769 1 1 5 TYR O O -5.568 4.712 3.211 1.00 . A A . 5 TYR O 1 1 12 5770 1 1 5 TYR OH O -9.589 6.931 -3.809 1.00 . A A . 5 TYR OH 1 1 12 5771 1 1 6 GLY C C -2.089 2.498 2.719 1.00 . A A . 6 GLY C 1 1 12 5772 1 1 6 GLY CA C -3.389 3.045 3.233 1.00 . A A . 6 GLY CA 1 1 12 5773 1 1 6 GLY H H -4.128 2.731 1.312 1.00 . A A . 6 GLY H 1 1 12 5774 1 1 6 GLY HA2 H -3.224 3.986 3.737 1.00 . A A . 6 GLY HA2 1 1 12 5775 1 1 6 GLY HA3 H -3.821 2.333 3.921 1.00 . A A . 6 GLY HA3 1 1 12 5776 1 1 6 GLY N N -4.283 3.251 2.128 1.00 . A A . 6 GLY N 1 1 12 5777 1 1 6 GLY O O -2.080 1.867 1.635 1.00 . A A . 6 GLY O 1 1 12 5778 1 1 7 GLN C C 0.377 0.748 3.115 1.00 . A A . 7 GLN C 1 1 12 5779 1 1 7 GLN CA C 0.301 2.269 3.032 1.00 . A A . 7 GLN CA 1 1 12 5780 1 1 7 GLN CB C 1.419 2.913 3.876 1.00 . A A . 7 GLN CB 1 1 12 5781 1 1 7 GLN CD C 3.916 3.161 4.312 1.00 . A A . 7 GLN CD 1 1 12 5782 1 1 7 GLN CG C 2.840 2.533 3.439 1.00 . A A . 7 GLN CG 1 1 12 5783 1 1 7 GLN H H -1.096 3.246 4.271 1.00 . A A . 7 GLN H 1 1 12 5784 1 1 7 GLN HA H 0.433 2.563 2.001 1.00 . A A . 7 GLN HA 1 1 12 5785 1 1 7 GLN HB2 H 1.327 3.989 3.818 1.00 . A A . 7 GLN HB2 1 1 12 5786 1 1 7 GLN HB3 H 1.288 2.612 4.905 1.00 . A A . 7 GLN HB3 1 1 12 5787 1 1 7 GLN HE21 H 5.244 3.235 2.802 1.00 . A A . 7 GLN HE21 1 1 12 5788 1 1 7 GLN HE22 H 5.774 3.830 4.301 1.00 . A A . 7 GLN HE22 1 1 12 5789 1 1 7 GLN HG2 H 2.937 1.459 3.504 1.00 . A A . 7 GLN HG2 1 1 12 5790 1 1 7 GLN HG3 H 2.990 2.841 2.415 1.00 . A A . 7 GLN HG3 1 1 12 5791 1 1 7 GLN N N -1.009 2.737 3.437 1.00 . A A . 7 GLN N 1 1 12 5792 1 1 7 GLN NE2 N 5.068 3.426 3.749 1.00 . A A . 7 GLN NE2 1 1 12 5793 1 1 7 GLN O O 0.246 0.168 4.195 1.00 . A A . 7 GLN O 1 1 12 5794 1 1 7 GLN OE1 O 3.703 3.405 5.494 1.00 . A A . 7 GLN OE1 1 1 12 5795 1 1 8 CYS C C 2.100 -1.752 2.192 1.00 . A A . 8 CYS C 1 1 12 5796 1 1 8 CYS CA C 0.683 -1.313 1.883 1.00 . A A . 8 CYS CA 1 1 12 5797 1 1 8 CYS CB C 0.235 -1.803 0.500 1.00 . A A . 8 CYS CB 1 1 12 5798 1 1 8 CYS H H 0.621 0.669 1.158 1.00 . A A . 8 CYS H 1 1 12 5799 1 1 8 CYS HA H 0.027 -1.736 2.629 1.00 . A A . 8 CYS HA 1 1 12 5800 1 1 8 CYS HB2 H 0.563 -2.821 0.362 1.00 . A A . 8 CYS HB2 1 1 12 5801 1 1 8 CYS HB3 H -0.844 -1.772 0.447 1.00 . A A . 8 CYS HB3 1 1 12 5802 1 1 8 CYS N N 0.562 0.128 1.976 1.00 . A A . 8 CYS N 1 1 12 5803 1 1 8 CYS O O 2.314 -2.675 2.959 1.00 . A A . 8 CYS O 1 1 12 5804 1 1 8 CYS SG S 0.891 -0.815 -0.901 1.00 . A A . 8 CYS SG 1 1 12 5805 1 1 9 GLY C C 5.382 -0.965 0.851 1.00 . A A . 9 GLY C 1 1 12 5806 1 1 9 GLY CA C 4.427 -1.428 1.892 1.00 . A A . 9 GLY CA 1 1 12 5807 1 1 9 GLY H H 2.861 -0.357 0.987 1.00 . A A . 9 GLY H 1 1 12 5808 1 1 9 GLY HA2 H 4.710 -0.951 2.818 1.00 . A A . 9 GLY HA2 1 1 12 5809 1 1 9 GLY HA3 H 4.510 -2.499 2.000 1.00 . A A . 9 GLY HA3 1 1 12 5810 1 1 9 GLY N N 3.071 -1.078 1.615 1.00 . A A . 9 GLY N 1 1 12 5811 1 1 9 GLY O O 5.392 -1.471 -0.261 1.00 . A A . 9 GLY O 1 1 12 5812 1 1 10 GLY C C 8.508 0.159 0.952 1.00 . A A . 10 GLY C 1 1 12 5813 1 1 10 GLY CA C 7.188 0.509 0.339 1.00 . A A . 10 GLY CA 1 1 12 5814 1 1 10 GLY H H 6.034 0.448 2.074 1.00 . A A . 10 GLY H 1 1 12 5815 1 1 10 GLY HA2 H 7.091 0.049 -0.633 1.00 . A A . 10 GLY HA2 1 1 12 5816 1 1 10 GLY HA3 H 7.120 1.582 0.244 1.00 . A A . 10 GLY HA3 1 1 12 5817 1 1 10 GLY N N 6.146 0.032 1.196 1.00 . A A . 10 GLY N 1 1 12 5818 1 1 10 GLY O O 8.565 -0.731 1.825 1.00 . A A . 10 GLY O 1 1 12 5819 1 1 11 ILE C C 10.826 1.041 2.610 1.00 . A A . 11 ILE C 1 1 12 5820 1 1 11 ILE CA C 10.856 0.586 1.148 1.00 . A A . 11 ILE CA 1 1 12 5821 1 1 11 ILE CB C 12.003 1.310 0.378 1.00 . A A . 11 ILE CB 1 1 12 5822 1 1 11 ILE CD1 C 13.085 1.518 -1.942 1.00 . A A . 11 ILE CD1 1 1 12 5823 1 1 11 ILE CG1 C 12.053 0.816 -1.079 1.00 . A A . 11 ILE CG1 1 1 12 5824 1 1 11 ILE CG2 C 13.356 1.074 1.070 1.00 . A A . 11 ILE CG2 1 1 12 5825 1 1 11 ILE H H 9.475 1.498 -0.162 1.00 . A A . 11 ILE H 1 1 12 5826 1 1 11 ILE HA H 11.028 -0.480 1.124 1.00 . A A . 11 ILE HA 1 1 12 5827 1 1 11 ILE HB H 11.799 2.370 0.383 1.00 . A A . 11 ILE HB 1 1 12 5828 1 1 11 ILE HD11 H 14.070 1.371 -1.526 1.00 . A A . 11 ILE HD11 1 1 12 5829 1 1 11 ILE HD12 H 12.864 2.575 -1.975 1.00 . A A . 11 ILE HD12 1 1 12 5830 1 1 11 ILE HD13 H 13.054 1.115 -2.944 1.00 . A A . 11 ILE HD13 1 1 12 5831 1 1 11 ILE HG12 H 12.292 -0.237 -1.084 1.00 . A A . 11 ILE HG12 1 1 12 5832 1 1 11 ILE HG13 H 11.082 0.962 -1.531 1.00 . A A . 11 ILE HG13 1 1 12 5833 1 1 11 ILE HG21 H 14.134 1.588 0.526 1.00 . A A . 11 ILE HG21 1 1 12 5834 1 1 11 ILE HG22 H 13.568 0.015 1.089 1.00 . A A . 11 ILE HG22 1 1 12 5835 1 1 11 ILE HG23 H 13.311 1.449 2.081 1.00 . A A . 11 ILE HG23 1 1 12 5836 1 1 11 ILE N N 9.561 0.824 0.550 1.00 . A A . 11 ILE N 1 1 12 5837 1 1 11 ILE O O 10.457 2.172 2.913 1.00 . A A . 11 ILE O 1 1 12 5838 1 1 12 GLY C C 9.899 0.149 5.639 1.00 . A A . 12 GLY C 1 1 12 5839 1 1 12 GLY CA C 11.173 0.478 4.896 1.00 . A A . 12 GLY CA 1 1 12 5840 1 1 12 GLY H H 11.329 -0.777 3.218 1.00 . A A . 12 GLY H 1 1 12 5841 1 1 12 GLY HA2 H 11.984 -0.067 5.356 1.00 . A A . 12 GLY HA2 1 1 12 5842 1 1 12 GLY HA3 H 11.365 1.536 4.991 1.00 . A A . 12 GLY HA3 1 1 12 5843 1 1 12 GLY N N 11.128 0.139 3.502 1.00 . A A . 12 GLY N 1 1 12 5844 1 1 12 GLY O O 9.832 0.324 6.851 1.00 . A A . 12 GLY O 1 1 12 5845 1 1 13 TYR C C 7.393 -2.177 5.477 1.00 . A A . 13 TYR C 1 1 12 5846 1 1 13 TYR CA C 7.650 -0.686 5.602 1.00 . A A . 13 TYR CA 1 1 12 5847 1 1 13 TYR CB C 6.456 0.110 5.028 1.00 . A A . 13 TYR CB 1 1 12 5848 1 1 13 TYR CD1 C 4.297 -1.207 5.342 1.00 . A A . 13 TYR CD1 1 1 12 5849 1 1 13 TYR CD2 C 4.724 0.610 6.814 1.00 . A A . 13 TYR CD2 1 1 12 5850 1 1 13 TYR CE1 C 3.117 -1.473 5.990 1.00 . A A . 13 TYR CE1 1 1 12 5851 1 1 13 TYR CE2 C 3.536 0.352 7.468 1.00 . A A . 13 TYR CE2 1 1 12 5852 1 1 13 TYR CG C 5.130 -0.165 5.740 1.00 . A A . 13 TYR CG 1 1 12 5853 1 1 13 TYR CZ C 2.737 -0.693 7.048 1.00 . A A . 13 TYR CZ 1 1 12 5854 1 1 13 TYR H H 8.979 -0.464 3.976 1.00 . A A . 13 TYR H 1 1 12 5855 1 1 13 TYR HA H 7.759 -0.444 6.648 1.00 . A A . 13 TYR HA 1 1 12 5856 1 1 13 TYR HB2 H 6.664 1.165 5.111 1.00 . A A . 13 TYR HB2 1 1 12 5857 1 1 13 TYR HB3 H 6.337 -0.142 3.984 1.00 . A A . 13 TYR HB3 1 1 12 5858 1 1 13 TYR HD1 H 4.591 -1.832 4.512 1.00 . A A . 13 TYR HD1 1 1 12 5859 1 1 13 TYR HD2 H 5.352 1.427 7.136 1.00 . A A . 13 TYR HD2 1 1 12 5860 1 1 13 TYR HE1 H 2.497 -2.291 5.655 1.00 . A A . 13 TYR HE1 1 1 12 5861 1 1 13 TYR HE2 H 3.237 0.969 8.302 1.00 . A A . 13 TYR HE2 1 1 12 5862 1 1 13 TYR HH H 1.064 -0.150 7.823 1.00 . A A . 13 TYR HH 1 1 12 5863 1 1 13 TYR N N 8.892 -0.332 4.945 1.00 . A A . 13 TYR N 1 1 12 5864 1 1 13 TYR O O 7.625 -2.768 4.413 1.00 . A A . 13 TYR O 1 1 12 5865 1 1 13 TYR OH O 1.559 -0.969 7.712 1.00 . A A . 13 TYR OH 1 1 12 5866 1 1 14 SER C C 5.269 -4.289 7.355 1.00 . A A . 14 SER C 1 1 12 5867 1 1 14 SER CA C 6.572 -4.163 6.574 1.00 . A A . 14 SER CA 1 1 12 5868 1 1 14 SER CB C 7.694 -4.964 7.251 1.00 . A A . 14 SER CB 1 1 12 5869 1 1 14 SER H H 6.781 -2.269 7.381 1.00 . A A . 14 SER H 1 1 12 5870 1 1 14 SER HA H 6.428 -4.506 5.560 1.00 . A A . 14 SER HA 1 1 12 5871 1 1 14 SER HB2 H 7.643 -4.790 8.315 1.00 . A A . 14 SER HB2 1 1 12 5872 1 1 14 SER HB3 H 7.567 -6.016 7.044 1.00 . A A . 14 SER HB3 1 1 12 5873 1 1 14 SER N N 6.917 -2.769 6.548 1.00 . A A . 14 SER N 1 1 12 5874 1 1 14 SER O O 5.017 -3.496 8.282 1.00 . A A . 14 SER O 1 1 12 5875 1 1 14 SER OG O 8.991 -4.530 6.737 1.00 . A A . 14 SER OG 1 1 12 5876 1 1 15 GLY C C 2.152 -5.970 6.691 1.00 . A A . 15 GLY C 1 1 12 5877 1 1 15 GLY CA C 3.166 -5.392 7.640 1.00 . A A . 15 GLY CA 1 1 12 5878 1 1 15 GLY H H 4.652 -5.814 6.228 1.00 . A A . 15 GLY H 1 1 12 5879 1 1 15 GLY HA2 H 3.289 -6.046 8.491 1.00 . A A . 15 GLY HA2 1 1 12 5880 1 1 15 GLY HA3 H 2.820 -4.425 7.973 1.00 . A A . 15 GLY HA3 1 1 12 5881 1 1 15 GLY N N 4.433 -5.218 6.977 1.00 . A A . 15 GLY N 1 1 12 5882 1 1 15 GLY O O 2.496 -6.881 5.922 1.00 . A A . 15 GLY O 1 1 12 5883 1 1 16 PRO C C 0.143 -5.428 4.352 1.00 . A A . 16 PRO C 1 1 12 5884 1 1 16 PRO CA C -0.127 -5.932 5.771 1.00 . A A . 16 PRO CA 1 1 12 5885 1 1 16 PRO CB C -1.433 -5.328 6.324 1.00 . A A . 16 PRO CB 1 1 12 5886 1 1 16 PRO CD C 0.395 -4.423 7.577 1.00 . A A . 16 PRO CD 1 1 12 5887 1 1 16 PRO CG C -1.066 -4.738 7.648 1.00 . A A . 16 PRO CG 1 1 12 5888 1 1 16 PRO HA H -0.185 -7.009 5.764 1.00 . A A . 16 PRO HA 1 1 12 5889 1 1 16 PRO HB2 H -1.787 -4.570 5.642 1.00 . A A . 16 PRO HB2 1 1 12 5890 1 1 16 PRO HB3 H -2.183 -6.097 6.435 1.00 . A A . 16 PRO HB3 1 1 12 5891 1 1 16 PRO HD2 H 0.556 -3.442 7.156 1.00 . A A . 16 PRO HD2 1 1 12 5892 1 1 16 PRO HD3 H 0.841 -4.496 8.558 1.00 . A A . 16 PRO HD3 1 1 12 5893 1 1 16 PRO HG2 H -1.635 -3.837 7.819 1.00 . A A . 16 PRO HG2 1 1 12 5894 1 1 16 PRO HG3 H -1.256 -5.456 8.431 1.00 . A A . 16 PRO HG3 1 1 12 5895 1 1 16 PRO N N 0.905 -5.471 6.691 1.00 . A A . 16 PRO N 1 1 12 5896 1 1 16 PRO O O -0.235 -4.318 3.983 1.00 . A A . 16 PRO O 1 1 12 5897 1 1 17 THR C C 0.268 -6.369 1.215 1.00 . A A . 17 THR C 1 1 12 5898 1 1 17 THR CA C 1.249 -5.865 2.278 1.00 . A A . 17 THR CA 1 1 12 5899 1 1 17 THR CB C 2.648 -6.416 2.037 1.00 . A A . 17 THR CB 1 1 12 5900 1 1 17 THR CG2 C 3.695 -5.556 2.732 1.00 . A A . 17 THR CG2 1 1 12 5901 1 1 17 THR H H 1.151 -7.088 3.936 1.00 . A A . 17 THR H 1 1 12 5902 1 1 17 THR HA H 1.304 -4.789 2.224 1.00 . A A . 17 THR HA 1 1 12 5903 1 1 17 THR HB H 2.839 -6.432 0.974 1.00 . A A . 17 THR HB 1 1 12 5904 1 1 17 THR HG1 H 2.885 -8.348 1.817 1.00 . A A . 17 THR HG1 1 1 12 5905 1 1 17 THR HG21 H 3.632 -4.543 2.360 1.00 . A A . 17 THR HG21 1 1 12 5906 1 1 17 THR HG22 H 4.680 -5.948 2.532 1.00 . A A . 17 THR HG22 1 1 12 5907 1 1 17 THR HG23 H 3.513 -5.558 3.797 1.00 . A A . 17 THR HG23 1 1 12 5908 1 1 17 THR N N 0.843 -6.219 3.599 1.00 . A A . 17 THR N 1 1 12 5909 1 1 17 THR O O 0.420 -6.082 0.017 1.00 . A A . 17 THR O 1 1 12 5910 1 1 17 THR OG1 O 2.705 -7.763 2.562 1.00 . A A . 17 THR OG1 1 1 12 5911 1 1 18 VAL C C -2.939 -6.669 0.822 1.00 . A A . 18 VAL C 1 1 12 5912 1 1 18 VAL CA C -1.749 -7.612 0.749 1.00 . A A . 18 VAL CA 1 1 12 5913 1 1 18 VAL CB C -2.192 -9.067 1.093 1.00 . A A . 18 VAL CB 1 1 12 5914 1 1 18 VAL CG1 C -3.303 -9.541 0.157 1.00 . A A . 18 VAL CG1 1 1 12 5915 1 1 18 VAL CG2 C -1.004 -10.017 1.010 1.00 . A A . 18 VAL CG2 1 1 12 5916 1 1 18 VAL H H -0.753 -7.367 2.596 1.00 . A A . 18 VAL H 1 1 12 5917 1 1 18 VAL HA H -1.348 -7.588 -0.255 1.00 . A A . 18 VAL HA 1 1 12 5918 1 1 18 VAL HB H -2.570 -9.080 2.105 1.00 . A A . 18 VAL HB 1 1 12 5919 1 1 18 VAL HG11 H -2.959 -9.502 -0.866 1.00 . A A . 18 VAL HG11 1 1 12 5920 1 1 18 VAL HG12 H -4.165 -8.901 0.269 1.00 . A A . 18 VAL HG12 1 1 12 5921 1 1 18 VAL HG13 H -3.577 -10.556 0.405 1.00 . A A . 18 VAL HG13 1 1 12 5922 1 1 18 VAL HG21 H -0.618 -10.020 0.001 1.00 . A A . 18 VAL HG21 1 1 12 5923 1 1 18 VAL HG22 H -1.314 -11.014 1.284 1.00 . A A . 18 VAL HG22 1 1 12 5924 1 1 18 VAL HG23 H -0.229 -9.687 1.685 1.00 . A A . 18 VAL HG23 1 1 12 5925 1 1 18 VAL N N -0.718 -7.130 1.644 1.00 . A A . 18 VAL N 1 1 12 5926 1 1 18 VAL O O -3.593 -6.551 1.872 1.00 . A A . 18 VAL O 1 1 12 5927 1 1 19 CYS C C -5.620 -5.721 -0.550 1.00 . A A . 19 CYS C 1 1 12 5928 1 1 19 CYS CA C -4.286 -5.033 -0.326 1.00 . A A . 19 CYS CA 1 1 12 5929 1 1 19 CYS CB C -4.018 -3.998 -1.412 1.00 . A A . 19 CYS CB 1 1 12 5930 1 1 19 CYS H H -2.661 -6.139 -1.069 1.00 . A A . 19 CYS H 1 1 12 5931 1 1 19 CYS HA H -4.330 -4.526 0.627 1.00 . A A . 19 CYS HA 1 1 12 5932 1 1 19 CYS HB2 H -3.923 -4.490 -2.370 1.00 . A A . 19 CYS HB2 1 1 12 5933 1 1 19 CYS HB3 H -4.845 -3.303 -1.447 1.00 . A A . 19 CYS HB3 1 1 12 5934 1 1 19 CYS N N -3.203 -5.990 -0.264 1.00 . A A . 19 CYS N 1 1 12 5935 1 1 19 CYS O O -5.670 -6.897 -0.927 1.00 . A A . 19 CYS O 1 1 12 5936 1 1 19 CYS SG S -2.506 -3.033 -1.125 1.00 . A A . 19 CYS SG 1 1 12 5937 1 1 20 ALA C C -8.371 -5.801 -1.873 1.00 . A A . 20 ALA C 1 1 12 5938 1 1 20 ALA CA C -8.051 -5.494 -0.420 1.00 . A A . 20 ALA CA 1 1 12 5939 1 1 20 ALA CB C -9.017 -4.457 0.124 1.00 . A A . 20 ALA CB 1 1 12 5940 1 1 20 ALA H H -6.577 -4.082 0.045 1.00 . A A . 20 ALA H 1 1 12 5941 1 1 20 ALA HA H -8.154 -6.393 0.167 1.00 . A A . 20 ALA HA 1 1 12 5942 1 1 20 ALA HB1 H -8.759 -4.238 1.150 1.00 . A A . 20 ALA HB1 1 1 12 5943 1 1 20 ALA HB2 H -10.026 -4.833 0.079 1.00 . A A . 20 ALA HB2 1 1 12 5944 1 1 20 ALA HB3 H -8.942 -3.553 -0.463 1.00 . A A . 20 ALA HB3 1 1 12 5945 1 1 20 ALA N N -6.692 -5.000 -0.277 1.00 . A A . 20 ALA N 1 1 12 5946 1 1 20 ALA O O -7.798 -5.178 -2.781 1.00 . A A . 20 ALA O 1 1 12 5947 1 1 21 SER C C -10.269 -5.941 -4.182 1.00 . A A . 21 SER C 1 1 12 5948 1 1 21 SER CA C -9.668 -7.123 -3.424 1.00 . A A . 21 SER CA 1 1 12 5949 1 1 21 SER CB C -10.643 -8.293 -3.357 1.00 . A A . 21 SER CB 1 1 12 5950 1 1 21 SER H H -9.714 -7.183 -1.338 1.00 . A A . 21 SER H 1 1 12 5951 1 1 21 SER HA H -8.779 -7.447 -3.943 1.00 . A A . 21 SER HA 1 1 12 5952 1 1 21 SER HB2 H -11.519 -7.999 -2.798 1.00 . A A . 21 SER HB2 1 1 12 5953 1 1 21 SER HB3 H -10.934 -8.579 -4.357 1.00 . A A . 21 SER HB3 1 1 12 5954 1 1 21 SER HG H -9.360 -9.761 -3.314 1.00 . A A . 21 SER HG 1 1 12 5955 1 1 21 SER N N -9.275 -6.736 -2.095 1.00 . A A . 21 SER N 1 1 12 5956 1 1 21 SER O O -11.291 -5.362 -3.774 1.00 . A A . 21 SER O 1 1 12 5957 1 1 21 SER OG O -10.034 -9.415 -2.714 1.00 . A A . 21 SER OG 1 1 12 5958 1 1 22 GLY C C -9.095 -3.288 -5.908 1.00 . A A . 22 GLY C 1 1 12 5959 1 1 22 GLY CA C -10.036 -4.454 -6.041 1.00 . A A . 22 GLY CA 1 1 12 5960 1 1 22 GLY H H -8.784 -6.044 -5.489 1.00 . A A . 22 GLY H 1 1 12 5961 1 1 22 GLY HA2 H -10.072 -4.761 -7.076 1.00 . A A . 22 GLY HA2 1 1 12 5962 1 1 22 GLY HA3 H -11.021 -4.147 -5.722 1.00 . A A . 22 GLY HA3 1 1 12 5963 1 1 22 GLY N N -9.605 -5.563 -5.242 1.00 . A A . 22 GLY N 1 1 12 5964 1 1 22 GLY O O -9.120 -2.363 -6.726 1.00 . A A . 22 GLY O 1 1 12 5965 1 1 23 THR C C -5.914 -2.811 -5.004 1.00 . A A . 23 THR C 1 1 12 5966 1 1 23 THR CA C -7.291 -2.278 -4.687 1.00 . A A . 23 THR CA 1 1 12 5967 1 1 23 THR CB C -7.336 -1.723 -3.226 1.00 . A A . 23 THR CB 1 1 12 5968 1 1 23 THR CG2 C -8.742 -1.272 -2.881 1.00 . A A . 23 THR CG2 1 1 12 5969 1 1 23 THR H H -8.245 -4.105 -4.291 1.00 . A A . 23 THR H 1 1 12 5970 1 1 23 THR HA H -7.520 -1.480 -5.379 1.00 . A A . 23 THR HA 1 1 12 5971 1 1 23 THR HB H -6.672 -0.875 -3.135 1.00 . A A . 23 THR HB 1 1 12 5972 1 1 23 THR HG1 H -7.170 -3.589 -2.632 1.00 . A A . 23 THR HG1 1 1 12 5973 1 1 23 THR HG21 H -9.050 -0.490 -3.561 1.00 . A A . 23 THR HG21 1 1 12 5974 1 1 23 THR HG22 H -8.760 -0.899 -1.869 1.00 . A A . 23 THR HG22 1 1 12 5975 1 1 23 THR HG23 H -9.419 -2.110 -2.970 1.00 . A A . 23 THR HG23 1 1 12 5976 1 1 23 THR N N -8.248 -3.331 -4.899 1.00 . A A . 23 THR N 1 1 12 5977 1 1 23 THR O O -5.643 -4.009 -4.813 1.00 . A A . 23 THR O 1 1 12 5978 1 1 23 THR OG1 O -6.935 -2.718 -2.279 1.00 . A A . 23 THR OG1 1 1 12 5979 1 1 24 THR C C -2.701 -1.622 -5.103 1.00 . A A . 24 THR C 1 1 12 5980 1 1 24 THR CA C -3.757 -2.371 -5.903 1.00 . A A . 24 THR CA 1 1 12 5981 1 1 24 THR CB C -3.544 -2.147 -7.423 1.00 . A A . 24 THR CB 1 1 12 5982 1 1 24 THR CG2 C -4.372 -3.130 -8.236 1.00 . A A . 24 THR CG2 1 1 12 5983 1 1 24 THR H H -5.339 -1.027 -5.637 1.00 . A A . 24 THR H 1 1 12 5984 1 1 24 THR HA H -3.671 -3.428 -5.701 1.00 . A A . 24 THR HA 1 1 12 5985 1 1 24 THR HB H -2.498 -2.299 -7.645 1.00 . A A . 24 THR HB 1 1 12 5986 1 1 24 THR HG1 H -4.559 -0.457 -7.148 1.00 . A A . 24 THR HG1 1 1 12 5987 1 1 24 THR HG21 H -4.080 -4.137 -7.984 1.00 . A A . 24 THR HG21 1 1 12 5988 1 1 24 THR HG22 H -4.208 -2.958 -9.290 1.00 . A A . 24 THR HG22 1 1 12 5989 1 1 24 THR HG23 H -5.417 -2.992 -8.005 1.00 . A A . 24 THR HG23 1 1 12 5990 1 1 24 THR N N -5.072 -1.970 -5.515 1.00 . A A . 24 THR N 1 1 12 5991 1 1 24 THR O O -2.825 -0.420 -4.889 1.00 . A A . 24 THR O 1 1 12 5992 1 1 24 THR OG1 O -3.915 -0.793 -7.795 1.00 . A A . 24 THR OG1 1 1 12 5993 1 1 25 CYS C C 0.265 -0.998 -4.923 1.00 . A A . 25 CYS C 1 1 12 5994 1 1 25 CYS CA C -0.604 -1.719 -3.913 1.00 . A A . 25 CYS CA 1 1 12 5995 1 1 25 CYS CB C 0.209 -2.797 -3.155 1.00 . A A . 25 CYS CB 1 1 12 5996 1 1 25 CYS H H -1.699 -3.299 -4.784 1.00 . A A . 25 CYS H 1 1 12 5997 1 1 25 CYS HA H -1.003 -1.001 -3.212 1.00 . A A . 25 CYS HA 1 1 12 5998 1 1 25 CYS HB2 H -0.447 -3.294 -2.456 1.00 . A A . 25 CYS HB2 1 1 12 5999 1 1 25 CYS HB3 H 0.573 -3.520 -3.871 1.00 . A A . 25 CYS HB3 1 1 12 6000 1 1 25 CYS N N -1.706 -2.329 -4.632 1.00 . A A . 25 CYS N 1 1 12 6001 1 1 25 CYS O O 1.033 -1.625 -5.652 1.00 . A A . 25 CYS O 1 1 12 6002 1 1 25 CYS SG S 1.653 -2.179 -2.197 1.00 . A A . 25 CYS SG 1 1 12 6003 1 1 26 GLN C C 1.925 1.801 -5.305 1.00 . A A . 26 GLN C 1 1 12 6004 1 1 26 GLN CA C 0.797 1.088 -5.989 1.00 . A A . 26 GLN CA 1 1 12 6005 1 1 26 GLN CB C -0.122 2.092 -6.691 1.00 . A A . 26 GLN CB 1 1 12 6006 1 1 26 GLN CD C -2.126 2.437 -8.208 1.00 . A A . 26 GLN CD 1 1 12 6007 1 1 26 GLN CG C -1.216 1.441 -7.516 1.00 . A A . 26 GLN CG 1 1 12 6008 1 1 26 GLN H H -0.599 0.731 -4.463 1.00 . A A . 26 GLN H 1 1 12 6009 1 1 26 GLN HA H 1.206 0.416 -6.730 1.00 . A A . 26 GLN HA 1 1 12 6010 1 1 26 GLN HB2 H -0.586 2.718 -5.944 1.00 . A A . 26 GLN HB2 1 1 12 6011 1 1 26 GLN HB3 H 0.473 2.714 -7.344 1.00 . A A . 26 GLN HB3 1 1 12 6012 1 1 26 GLN HE21 H -3.601 1.141 -8.115 1.00 . A A . 26 GLN HE21 1 1 12 6013 1 1 26 GLN HE22 H -3.983 2.654 -8.858 1.00 . A A . 26 GLN HE22 1 1 12 6014 1 1 26 GLN HG2 H -0.756 0.826 -8.275 1.00 . A A . 26 GLN HG2 1 1 12 6015 1 1 26 GLN HG3 H -1.814 0.816 -6.868 1.00 . A A . 26 GLN HG3 1 1 12 6016 1 1 26 GLN N N 0.067 0.293 -5.039 1.00 . A A . 26 GLN N 1 1 12 6017 1 1 26 GLN NE2 N -3.354 2.045 -8.416 1.00 . A A . 26 GLN NE2 1 1 12 6018 1 1 26 GLN O O 1.728 2.444 -4.258 1.00 . A A . 26 GLN O 1 1 12 6019 1 1 26 GLN OE1 O -1.718 3.554 -8.567 1.00 . A A . 26 GLN OE1 1 1 12 6020 1 1 27 VAL C C 4.284 3.772 -5.824 1.00 . A A . 27 VAL C 1 1 12 6021 1 1 27 VAL CA C 4.266 2.327 -5.335 1.00 . A A . 27 VAL CA 1 1 12 6022 1 1 27 VAL CB C 5.570 1.581 -5.745 1.00 . A A . 27 VAL CB 1 1 12 6023 1 1 27 VAL CG1 C 6.793 2.203 -5.088 1.00 . A A . 27 VAL CG1 1 1 12 6024 1 1 27 VAL CG2 C 5.479 0.101 -5.393 1.00 . A A . 27 VAL CG2 1 1 12 6025 1 1 27 VAL H H 3.187 1.170 -6.703 1.00 . A A . 27 VAL H 1 1 12 6026 1 1 27 VAL HA H 4.175 2.329 -4.258 1.00 . A A . 27 VAL HA 1 1 12 6027 1 1 27 VAL HB H 5.683 1.666 -6.815 1.00 . A A . 27 VAL HB 1 1 12 6028 1 1 27 VAL HG11 H 6.892 3.229 -5.409 1.00 . A A . 27 VAL HG11 1 1 12 6029 1 1 27 VAL HG12 H 7.677 1.647 -5.363 1.00 . A A . 27 VAL HG12 1 1 12 6030 1 1 27 VAL HG13 H 6.676 2.175 -4.015 1.00 . A A . 27 VAL HG13 1 1 12 6031 1 1 27 VAL HG21 H 5.339 -0.006 -4.329 1.00 . A A . 27 VAL HG21 1 1 12 6032 1 1 27 VAL HG22 H 6.390 -0.396 -5.691 1.00 . A A . 27 VAL HG22 1 1 12 6033 1 1 27 VAL HG23 H 4.644 -0.345 -5.913 1.00 . A A . 27 VAL HG23 1 1 12 6034 1 1 27 VAL N N 3.097 1.686 -5.873 1.00 . A A . 27 VAL N 1 1 12 6035 1 1 27 VAL O O 4.697 4.065 -6.946 1.00 . A A . 27 VAL O 1 1 12 6036 1 1 28 LEU C C 4.955 6.740 -5.187 1.00 . A A . 28 LEU C 1 1 12 6037 1 1 28 LEU CA C 3.622 6.050 -5.345 1.00 . A A . 28 LEU CA 1 1 12 6038 1 1 28 LEU CB C 2.587 6.707 -4.429 1.00 . A A . 28 LEU CB 1 1 12 6039 1 1 28 LEU CD1 C 0.280 6.824 -3.462 1.00 . A A . 28 LEU CD1 1 1 12 6040 1 1 28 LEU CD2 C 0.588 6.254 -5.858 1.00 . A A . 28 LEU CD2 1 1 12 6041 1 1 28 LEU CG C 1.173 6.125 -4.470 1.00 . A A . 28 LEU CG 1 1 12 6042 1 1 28 LEU H H 3.431 4.325 -4.140 1.00 . A A . 28 LEU H 1 1 12 6043 1 1 28 LEU HA H 3.292 6.140 -6.369 1.00 . A A . 28 LEU HA 1 1 12 6044 1 1 28 LEU HB2 H 2.948 6.645 -3.413 1.00 . A A . 28 LEU HB2 1 1 12 6045 1 1 28 LEU HB3 H 2.528 7.747 -4.706 1.00 . A A . 28 LEU HB3 1 1 12 6046 1 1 28 LEU HD11 H -0.722 6.425 -3.531 1.00 . A A . 28 LEU HD11 1 1 12 6047 1 1 28 LEU HD12 H 0.266 7.885 -3.664 1.00 . A A . 28 LEU HD12 1 1 12 6048 1 1 28 LEU HD13 H 0.663 6.654 -2.465 1.00 . A A . 28 LEU HD13 1 1 12 6049 1 1 28 LEU HD21 H 1.193 5.702 -6.563 1.00 . A A . 28 LEU HD21 1 1 12 6050 1 1 28 LEU HD22 H 0.577 7.299 -6.128 1.00 . A A . 28 LEU HD22 1 1 12 6051 1 1 28 LEU HD23 H -0.420 5.866 -5.856 1.00 . A A . 28 LEU HD23 1 1 12 6052 1 1 28 LEU HG H 1.215 5.077 -4.212 1.00 . A A . 28 LEU HG 1 1 12 6053 1 1 28 LEU N N 3.749 4.643 -5.010 1.00 . A A . 28 LEU N 1 1 12 6054 1 1 28 LEU O O 5.404 7.494 -6.063 1.00 . A A . 28 LEU O 1 1 12 6055 1 1 29 ASN C C 7.715 5.794 -3.397 1.00 . A A . 29 ASN C 1 1 12 6056 1 1 29 ASN CA C 6.863 7.003 -3.729 1.00 . A A . 29 ASN CA 1 1 12 6057 1 1 29 ASN CB C 6.751 7.899 -2.473 1.00 . A A . 29 ASN CB 1 1 12 6058 1 1 29 ASN CG C 5.902 9.165 -2.603 1.00 . A A . 29 ASN CG 1 1 12 6059 1 1 29 ASN H H 5.177 5.816 -3.463 1.00 . A A . 29 ASN H 1 1 12 6060 1 1 29 ASN HA H 7.276 7.553 -4.561 1.00 . A A . 29 ASN HA 1 1 12 6061 1 1 29 ASN HB2 H 6.351 7.310 -1.663 1.00 . A A . 29 ASN HB2 1 1 12 6062 1 1 29 ASN HB3 H 7.754 8.191 -2.203 1.00 . A A . 29 ASN HB3 1 1 12 6063 1 1 29 ASN HD21 H 6.999 10.046 -1.222 1.00 . A A . 29 ASN HD21 1 1 12 6064 1 1 29 ASN HD22 H 5.690 10.975 -1.853 1.00 . A A . 29 ASN HD22 1 1 12 6065 1 1 29 ASN N N 5.577 6.465 -4.086 1.00 . A A . 29 ASN N 1 1 12 6066 1 1 29 ASN ND2 N 6.233 10.159 -1.827 1.00 . A A . 29 ASN ND2 1 1 12 6067 1 1 29 ASN O O 7.156 4.714 -3.253 1.00 . A A . 29 ASN O 1 1 12 6068 1 1 29 ASN OD1 O 4.948 9.245 -3.379 1.00 . A A . 29 ASN OD1 1 1 12 6069 1 1 30 PRO C C 9.509 4.084 -1.624 1.00 . A A . 30 PRO C 1 1 12 6070 1 1 30 PRO CA C 9.899 4.755 -2.937 1.00 . A A . 30 PRO CA 1 1 12 6071 1 1 30 PRO CB C 11.314 5.342 -2.833 1.00 . A A . 30 PRO CB 1 1 12 6072 1 1 30 PRO CD C 9.859 7.147 -3.369 1.00 . A A . 30 PRO CD 1 1 12 6073 1 1 30 PRO CG C 11.246 6.619 -3.585 1.00 . A A . 30 PRO CG 1 1 12 6074 1 1 30 PRO HA H 9.863 4.026 -3.731 1.00 . A A . 30 PRO HA 1 1 12 6075 1 1 30 PRO HB2 H 11.564 5.505 -1.795 1.00 . A A . 30 PRO HB2 1 1 12 6076 1 1 30 PRO HB3 H 12.024 4.662 -3.277 1.00 . A A . 30 PRO HB3 1 1 12 6077 1 1 30 PRO HD2 H 9.823 7.733 -2.463 1.00 . A A . 30 PRO HD2 1 1 12 6078 1 1 30 PRO HD3 H 9.534 7.736 -4.213 1.00 . A A . 30 PRO HD3 1 1 12 6079 1 1 30 PRO HG2 H 11.982 7.306 -3.195 1.00 . A A . 30 PRO HG2 1 1 12 6080 1 1 30 PRO HG3 H 11.425 6.441 -4.635 1.00 . A A . 30 PRO HG3 1 1 12 6081 1 1 30 PRO N N 9.054 5.917 -3.239 1.00 . A A . 30 PRO N 1 1 12 6082 1 1 30 PRO O O 9.585 2.861 -1.488 1.00 . A A . 30 PRO O 1 1 12 6083 1 1 31 TYR C C 7.202 4.290 0.772 1.00 . A A . 31 TYR C 1 1 12 6084 1 1 31 TYR CA C 8.719 4.297 0.606 1.00 . A A . 31 TYR CA 1 1 12 6085 1 1 31 TYR CB C 9.347 5.119 1.735 1.00 . A A . 31 TYR CB 1 1 12 6086 1 1 31 TYR CD1 C 11.198 6.667 0.945 1.00 . A A . 31 TYR CD1 1 1 12 6087 1 1 31 TYR CD2 C 11.809 4.593 1.912 1.00 . A A . 31 TYR CD2 1 1 12 6088 1 1 31 TYR CE1 C 12.520 6.976 0.760 1.00 . A A . 31 TYR CE1 1 1 12 6089 1 1 31 TYR CE2 C 13.130 4.893 1.729 1.00 . A A . 31 TYR CE2 1 1 12 6090 1 1 31 TYR CG C 10.815 5.460 1.525 1.00 . A A . 31 TYR CG 1 1 12 6091 1 1 31 TYR CZ C 13.483 6.087 1.159 1.00 . A A . 31 TYR CZ 1 1 12 6092 1 1 31 TYR H H 9.001 5.838 -0.805 1.00 . A A . 31 TYR H 1 1 12 6093 1 1 31 TYR HA H 9.102 3.289 0.658 1.00 . A A . 31 TYR HA 1 1 12 6094 1 1 31 TYR HB2 H 8.798 6.039 1.858 1.00 . A A . 31 TYR HB2 1 1 12 6095 1 1 31 TYR HB3 H 9.267 4.548 2.647 1.00 . A A . 31 TYR HB3 1 1 12 6096 1 1 31 TYR HD1 H 10.444 7.371 0.630 1.00 . A A . 31 TYR HD1 1 1 12 6097 1 1 31 TYR HD2 H 11.534 3.651 2.363 1.00 . A A . 31 TYR HD2 1 1 12 6098 1 1 31 TYR HE1 H 12.796 7.917 0.308 1.00 . A A . 31 TYR HE1 1 1 12 6099 1 1 31 TYR HE2 H 13.883 4.185 2.043 1.00 . A A . 31 TYR HE2 1 1 12 6100 1 1 31 TYR HH H 15.253 5.623 0.622 1.00 . A A . 31 TYR HH 1 1 12 6101 1 1 31 TYR N N 9.075 4.871 -0.661 1.00 . A A . 31 TYR N 1 1 12 6102 1 1 31 TYR O O 6.642 3.428 1.462 1.00 . A A . 31 TYR O 1 1 12 6103 1 1 31 TYR OH O 14.806 6.398 0.985 1.00 . A A . 31 TYR OH 1 1 12 6104 1 1 32 TYR C C 4.435 4.465 -0.893 1.00 . A A . 32 TYR C 1 1 12 6105 1 1 32 TYR CA C 5.089 5.267 0.215 1.00 . A A . 32 TYR CA 1 1 12 6106 1 1 32 TYR CB C 4.587 6.714 0.199 1.00 . A A . 32 TYR CB 1 1 12 6107 1 1 32 TYR CD1 C 2.093 7.110 -0.121 1.00 . A A . 32 TYR CD1 1 1 12 6108 1 1 32 TYR CD2 C 2.935 6.830 2.098 1.00 . A A . 32 TYR CD2 1 1 12 6109 1 1 32 TYR CE1 C 0.814 7.285 0.390 1.00 . A A . 32 TYR CE1 1 1 12 6110 1 1 32 TYR CE2 C 1.666 6.995 2.611 1.00 . A A . 32 TYR CE2 1 1 12 6111 1 1 32 TYR CG C 3.175 6.882 0.730 1.00 . A A . 32 TYR CG 1 1 12 6112 1 1 32 TYR CZ C 0.610 7.227 1.760 1.00 . A A . 32 TYR CZ 1 1 12 6113 1 1 32 TYR H H 7.002 5.861 -0.441 1.00 . A A . 32 TYR H 1 1 12 6114 1 1 32 TYR HA H 4.820 4.821 1.161 1.00 . A A . 32 TYR HA 1 1 12 6115 1 1 32 TYR HB2 H 5.243 7.343 0.781 1.00 . A A . 32 TYR HB2 1 1 12 6116 1 1 32 TYR HB3 H 4.587 7.063 -0.823 1.00 . A A . 32 TYR HB3 1 1 12 6117 1 1 32 TYR HD1 H 2.252 7.154 -1.189 1.00 . A A . 32 TYR HD1 1 1 12 6118 1 1 32 TYR HD2 H 3.765 6.645 2.765 1.00 . A A . 32 TYR HD2 1 1 12 6119 1 1 32 TYR HE1 H -0.017 7.456 -0.278 1.00 . A A . 32 TYR HE1 1 1 12 6120 1 1 32 TYR HE2 H 1.508 6.949 3.677 1.00 . A A . 32 TYR HE2 1 1 12 6121 1 1 32 TYR HH H -1.305 6.912 1.771 1.00 . A A . 32 TYR HH 1 1 12 6122 1 1 32 TYR N N 6.525 5.208 0.109 1.00 . A A . 32 TYR N 1 1 12 6123 1 1 32 TYR O O 4.530 4.803 -2.073 1.00 . A A . 32 TYR O 1 1 12 6124 1 1 32 TYR OH O -0.657 7.421 2.284 1.00 . A A . 32 TYR OH 1 1 12 6125 1 1 33 SER C C 1.654 2.501 -0.855 1.00 . A A . 33 SER C 1 1 12 6126 1 1 33 SER CA C 3.028 2.642 -1.446 1.00 . A A . 33 SER CA 1 1 12 6127 1 1 33 SER CB C 3.709 1.289 -1.623 1.00 . A A . 33 SER CB 1 1 12 6128 1 1 33 SER H H 3.755 3.183 0.419 1.00 . A A . 33 SER H 1 1 12 6129 1 1 33 SER HA H 2.967 3.162 -2.390 1.00 . A A . 33 SER HA 1 1 12 6130 1 1 33 SER HB2 H 3.682 0.747 -0.689 1.00 . A A . 33 SER HB2 1 1 12 6131 1 1 33 SER HB3 H 3.197 0.721 -2.385 1.00 . A A . 33 SER HB3 1 1 12 6132 1 1 33 SER HG H 5.215 2.381 -2.262 1.00 . A A . 33 SER HG 1 1 12 6133 1 1 33 SER N N 3.772 3.440 -0.526 1.00 . A A . 33 SER N 1 1 12 6134 1 1 33 SER O O 1.537 2.268 0.345 1.00 . A A . 33 SER O 1 1 12 6135 1 1 33 SER OG O 5.064 1.463 -2.014 1.00 . A A . 33 SER OG 1 1 12 6136 1 1 34 GLN C C -1.646 1.844 -1.910 1.00 . A A . 34 GLN C 1 1 12 6137 1 1 34 GLN CA C -0.695 2.696 -1.100 1.00 . A A . 34 GLN CA 1 1 12 6138 1 1 34 GLN CB C -1.171 4.155 -1.009 1.00 . A A . 34 GLN CB 1 1 12 6139 1 1 34 GLN CD C -2.879 5.759 -0.115 1.00 . A A . 34 GLN CD 1 1 12 6140 1 1 34 GLN CG C -2.566 4.328 -0.454 1.00 . A A . 34 GLN CG 1 1 12 6141 1 1 34 GLN H H 0.766 2.739 -2.613 1.00 . A A . 34 GLN H 1 1 12 6142 1 1 34 GLN HA H -0.650 2.300 -0.096 1.00 . A A . 34 GLN HA 1 1 12 6143 1 1 34 GLN HB2 H -0.491 4.693 -0.364 1.00 . A A . 34 GLN HB2 1 1 12 6144 1 1 34 GLN HB3 H -1.135 4.597 -1.993 1.00 . A A . 34 GLN HB3 1 1 12 6145 1 1 34 GLN HE21 H -3.710 6.051 -1.867 1.00 . A A . 34 GLN HE21 1 1 12 6146 1 1 34 GLN HE22 H -3.654 7.415 -0.813 1.00 . A A . 34 GLN HE22 1 1 12 6147 1 1 34 GLN HG2 H -3.282 3.980 -1.184 1.00 . A A . 34 GLN HG2 1 1 12 6148 1 1 34 GLN HG3 H -2.657 3.730 0.442 1.00 . A A . 34 GLN HG3 1 1 12 6149 1 1 34 GLN N N 0.634 2.666 -1.639 1.00 . A A . 34 GLN N 1 1 12 6150 1 1 34 GLN NE2 N -3.476 6.469 -1.014 1.00 . A A . 34 GLN NE2 1 1 12 6151 1 1 34 GLN O O -1.525 1.767 -3.132 1.00 . A A . 34 GLN O 1 1 12 6152 1 1 34 GLN OE1 O -2.620 6.200 0.990 1.00 . A A . 34 GLN OE1 1 1 12 6153 1 1 35 CYS C C -4.597 1.262 -2.486 1.00 . A A . 35 CYS C 1 1 12 6154 1 1 35 CYS CA C -3.560 0.361 -1.862 1.00 . A A . 35 CYS CA 1 1 12 6155 1 1 35 CYS CB C -4.239 -0.568 -0.868 1.00 . A A . 35 CYS CB 1 1 12 6156 1 1 35 CYS H H -2.536 1.180 -0.237 1.00 . A A . 35 CYS H 1 1 12 6157 1 1 35 CYS HA H -3.086 -0.229 -2.634 1.00 . A A . 35 CYS HA 1 1 12 6158 1 1 35 CYS HB2 H -4.901 -0.013 -0.223 1.00 . A A . 35 CYS HB2 1 1 12 6159 1 1 35 CYS HB3 H -4.841 -1.252 -1.443 1.00 . A A . 35 CYS HB3 1 1 12 6160 1 1 35 CYS N N -2.553 1.163 -1.218 1.00 . A A . 35 CYS N 1 1 12 6161 1 1 35 CYS O O -5.406 1.898 -1.777 1.00 . A A . 35 CYS O 1 1 12 6162 1 1 35 CYS SG S -3.096 -1.558 0.139 1.00 . A A . 35 CYS SG 1 1 12 6163 1 1 36 LEU C C -6.264 1.182 -5.353 1.00 . A A . 36 LEU C 1 1 12 6164 1 1 36 LEU CA C -5.435 2.128 -4.546 1.00 . A A . 36 LEU CA 1 1 12 6165 1 1 36 LEU CB C -4.674 3.099 -5.452 1.00 . A A . 36 LEU CB 1 1 12 6166 1 1 36 LEU CD1 C -3.096 5.015 -5.745 1.00 . A A . 36 LEU CD1 1 1 12 6167 1 1 36 LEU CD2 C -4.825 5.118 -3.985 1.00 . A A . 36 LEU CD2 1 1 12 6168 1 1 36 LEU CG C -3.888 4.208 -4.746 1.00 . A A . 36 LEU CG 1 1 12 6169 1 1 36 LEU H H -3.836 0.863 -4.253 1.00 . A A . 36 LEU H 1 1 12 6170 1 1 36 LEU HA H -6.077 2.685 -3.880 1.00 . A A . 36 LEU HA 1 1 12 6171 1 1 36 LEU HB2 H -3.983 2.521 -6.046 1.00 . A A . 36 LEU HB2 1 1 12 6172 1 1 36 LEU HB3 H -5.384 3.564 -6.120 1.00 . A A . 36 LEU HB3 1 1 12 6173 1 1 36 LEU HD11 H -2.390 4.374 -6.252 1.00 . A A . 36 LEU HD11 1 1 12 6174 1 1 36 LEU HD12 H -2.568 5.806 -5.232 1.00 . A A . 36 LEU HD12 1 1 12 6175 1 1 36 LEU HD13 H -3.771 5.446 -6.470 1.00 . A A . 36 LEU HD13 1 1 12 6176 1 1 36 LEU HD21 H -5.587 5.487 -4.655 1.00 . A A . 36 LEU HD21 1 1 12 6177 1 1 36 LEU HD22 H -4.265 5.964 -3.616 1.00 . A A . 36 LEU HD22 1 1 12 6178 1 1 36 LEU HD23 H -5.283 4.588 -3.163 1.00 . A A . 36 LEU HD23 1 1 12 6179 1 1 36 LEU HG H -3.198 3.770 -4.041 1.00 . A A . 36 LEU HG 1 1 12 6180 1 1 36 LEU N N -4.535 1.359 -3.767 1.00 . A A . 36 LEU N 1 1 12 6181 1 1 36 LEU O O -5.705 0.521 -6.266 1.00 . A A . 36 LEU O 1 1 12 6182 1 1 36 LEU OXT O -7.463 1.066 -5.084 1.00 . A A . 36 LEU OXT 1 1 12 6183 2 2 1 MAN C1 C 10.080 -5.298 7.169 1.00 . B A . 101 MAN C1 1 1 12 6184 2 2 1 MAN C2 C 10.179 -5.422 8.697 1.00 . B A . 101 MAN C2 1 1 12 6185 2 2 1 MAN C3 C 10.417 -4.059 9.374 1.00 . B A . 101 MAN C3 1 1 12 6186 2 2 1 MAN C4 C 10.892 -2.971 8.386 1.00 . B A . 101 MAN C4 1 1 12 6187 2 2 1 MAN C5 C 11.808 -3.518 7.239 1.00 . B A . 101 MAN C5 1 1 12 6188 2 2 1 MAN C6 C 13.262 -3.698 7.647 1.00 . B A . 101 MAN C6 1 1 12 6189 2 2 1 MAN H1 H 9.940 -6.315 6.776 1.00 . B A . 101 MAN H1 1 1 12 6190 2 2 1 MAN H2 H 9.250 -5.867 9.080 1.00 . B A . 101 MAN H2 1 1 12 6191 2 2 1 MAN H3 H 9.449 -3.756 9.797 1.00 . B A . 101 MAN H3 1 1 12 6192 2 2 1 MAN H4 H 11.491 -2.282 9.000 1.00 . B A . 101 MAN H4 1 1 12 6193 2 2 1 MAN H5 H 11.760 -2.774 6.430 1.00 . B A . 101 MAN H5 1 1 12 6194 2 2 1 MAN H61 H 13.632 -2.728 8.011 1.00 . B A . 101 MAN H61 1 1 12 6195 2 2 1 MAN H62 H 13.848 -3.951 6.751 1.00 . B A . 101 MAN H62 1 1 12 6196 2 2 1 MAN HO2 H 12.040 -5.800 8.635 1.00 . B A . 101 MAN HO2 1 1 12 6197 2 2 1 MAN HO3 H 12.203 -4.439 9.976 1.00 . B A . 101 MAN HO3 1 1 12 6198 2 2 1 MAN HO4 H 10.153 -1.475 7.397 1.00 . B A . 101 MAN HO4 1 1 12 6199 2 2 1 MAN HO6 H 14.291 -5.117 8.501 1.00 . B A . 101 MAN HO6 1 1 12 6200 2 2 1 MAN O2 O 11.279 -6.269 9.012 1.00 . B A . 101 MAN O2 1 1 12 6201 2 2 1 MAN O3 O 11.369 -4.211 10.411 1.00 . B A . 101 MAN O3 1 1 12 6202 2 2 1 MAN O4 O 9.801 -2.229 7.889 1.00 . B A . 101 MAN O4 1 1 12 6203 2 2 1 MAN O5 O 11.334 -4.802 6.674 1.00 . B A . 101 MAN O5 1 1 12 6204 2 2 1 MAN O6 O 13.417 -4.720 8.630 1.00 . B A . 101 MAN O6 1 1 13 6205 1 1 1 THR C C -5.801 -5.424 4.173 1.00 . A A . 1 THR C 1 1 13 6206 1 1 1 THR CA C -5.936 -6.916 3.926 1.00 . A A . 1 THR CA 1 1 13 6207 1 1 1 THR CB C -6.856 -7.206 2.717 1.00 . A A . 1 THR CB 1 1 13 6208 1 1 1 THR CG2 C -6.613 -8.609 2.174 1.00 . A A . 1 THR CG2 1 1 13 6209 1 1 1 THR H1 H -7.352 -7.116 5.342 1.00 . A A . 1 THR H1 1 1 13 6210 1 1 1 THR H2 H -5.780 -7.391 5.905 1.00 . A A . 1 THR H2 1 1 13 6211 1 1 1 THR H3 H -6.577 -8.570 4.964 1.00 . A A . 1 THR H3 1 1 13 6212 1 1 1 THR HA H -4.952 -7.316 3.726 1.00 . A A . 1 THR HA 1 1 13 6213 1 1 1 THR HB H -6.625 -6.486 1.945 1.00 . A A . 1 THR HB 1 1 13 6214 1 1 1 THR HG1 H -8.793 -7.311 2.333 1.00 . A A . 1 THR HG1 1 1 13 6215 1 1 1 THR HG21 H -6.802 -9.340 2.946 1.00 . A A . 1 THR HG21 1 1 13 6216 1 1 1 THR HG22 H -5.587 -8.692 1.848 1.00 . A A . 1 THR HG22 1 1 13 6217 1 1 1 THR HG23 H -7.269 -8.790 1.335 1.00 . A A . 1 THR HG23 1 1 13 6218 1 1 1 THR N N -6.437 -7.554 5.117 1.00 . A A . 1 THR N 1 1 13 6219 1 1 1 THR O O -6.605 -4.842 4.915 1.00 . A A . 1 THR O 1 1 13 6220 1 1 1 THR OG1 O -8.247 -7.055 3.088 1.00 . A A . 1 THR OG1 1 1 13 6221 1 1 2 GLN C C -5.599 -2.594 3.079 1.00 . A A . 2 GLN C 1 1 13 6222 1 1 2 GLN CA C -4.528 -3.417 3.825 1.00 . A A . 2 GLN CA 1 1 13 6223 1 1 2 GLN CB C -3.080 -3.069 3.407 1.00 . A A . 2 GLN CB 1 1 13 6224 1 1 2 GLN CD C -2.992 -0.608 4.138 1.00 . A A . 2 GLN CD 1 1 13 6225 1 1 2 GLN CG C -2.404 -1.991 4.280 1.00 . A A . 2 GLN CG 1 1 13 6226 1 1 2 GLN H H -4.181 -5.323 3.006 1.00 . A A . 2 GLN H 1 1 13 6227 1 1 2 GLN HA H -4.651 -3.243 4.884 1.00 . A A . 2 GLN HA 1 1 13 6228 1 1 2 GLN HB2 H -2.486 -3.968 3.466 1.00 . A A . 2 GLN HB2 1 1 13 6229 1 1 2 GLN HB3 H -3.086 -2.728 2.383 1.00 . A A . 2 GLN HB3 1 1 13 6230 1 1 2 GLN HE21 H -3.315 -0.918 2.231 1.00 . A A . 2 GLN HE21 1 1 13 6231 1 1 2 GLN HE22 H -3.845 0.592 2.856 1.00 . A A . 2 GLN HE22 1 1 13 6232 1 1 2 GLN HG2 H -2.492 -2.284 5.315 1.00 . A A . 2 GLN HG2 1 1 13 6233 1 1 2 GLN HG3 H -1.356 -1.947 4.031 1.00 . A A . 2 GLN HG3 1 1 13 6234 1 1 2 GLN N N -4.778 -4.815 3.604 1.00 . A A . 2 GLN N 1 1 13 6235 1 1 2 GLN NE2 N -3.408 -0.276 2.970 1.00 . A A . 2 GLN NE2 1 1 13 6236 1 1 2 GLN O O -5.907 -2.863 1.902 1.00 . A A . 2 GLN O 1 1 13 6237 1 1 2 GLN OE1 O -3.021 0.176 5.085 1.00 . A A . 2 GLN OE1 1 1 13 6238 1 1 3 SER C C -6.962 0.086 2.145 1.00 . A A . 3 SER C 1 1 13 6239 1 1 3 SER CA C -7.290 -0.839 3.339 1.00 . A A . 3 SER CA 1 1 13 6240 1 1 3 SER CB C -7.783 -0.016 4.526 1.00 . A A . 3 SER CB 1 1 13 6241 1 1 3 SER H H -5.807 -1.453 4.681 1.00 . A A . 3 SER H 1 1 13 6242 1 1 3 SER HA H -8.086 -1.511 3.059 1.00 . A A . 3 SER HA 1 1 13 6243 1 1 3 SER HB2 H -7.008 0.676 4.821 1.00 . A A . 3 SER HB2 1 1 13 6244 1 1 3 SER HB3 H -8.673 0.530 4.255 1.00 . A A . 3 SER HB3 1 1 13 6245 1 1 3 SER HG H -8.934 -1.274 5.461 1.00 . A A . 3 SER HG 1 1 13 6246 1 1 3 SER N N -6.164 -1.642 3.786 1.00 . A A . 3 SER N 1 1 13 6247 1 1 3 SER O O -5.798 0.407 1.864 1.00 . A A . 3 SER O 1 1 13 6248 1 1 3 SER OG O -8.077 -0.863 5.638 1.00 . A A . 3 SER OG 1 1 13 6249 1 1 4 HIS C C -7.399 2.761 0.882 1.00 . A A . 4 HIS C 1 1 13 6250 1 1 4 HIS CA C -7.858 1.416 0.327 1.00 . A A . 4 HIS CA 1 1 13 6251 1 1 4 HIS CB C -9.207 1.565 -0.415 1.00 . A A . 4 HIS CB 1 1 13 6252 1 1 4 HIS CD2 C -8.068 2.230 -2.653 1.00 . A A . 4 HIS CD2 1 1 13 6253 1 1 4 HIS CE1 C -9.792 3.057 -3.690 1.00 . A A . 4 HIS CE1 1 1 13 6254 1 1 4 HIS CG C -9.104 2.180 -1.794 1.00 . A A . 4 HIS CG 1 1 13 6255 1 1 4 HIS H H -8.894 0.205 1.720 1.00 . A A . 4 HIS H 1 1 13 6256 1 1 4 HIS HA H -7.111 1.018 -0.342 1.00 . A A . 4 HIS HA 1 1 13 6257 1 1 4 HIS HB2 H -9.666 0.593 -0.522 1.00 . A A . 4 HIS HB2 1 1 13 6258 1 1 4 HIS HB3 H -9.853 2.188 0.184 1.00 . A A . 4 HIS HB3 1 1 13 6259 1 1 4 HIS HD1 H -11.090 2.837 -2.139 1.00 . A A . 4 HIS HD1 1 1 13 6260 1 1 4 HIS HD2 H -7.059 1.900 -2.448 1.00 . A A . 4 HIS HD2 1 1 13 6261 1 1 4 HIS HE1 H -10.420 3.499 -4.449 1.00 . A A . 4 HIS HE1 1 1 13 6262 1 1 4 HIS HE2 H -8.169 2.368 -4.662 1.00 . A A . 4 HIS HE2 1 1 13 6263 1 1 4 HIS N N -8.001 0.510 1.447 1.00 . A A . 4 HIS N 1 1 13 6264 1 1 4 HIS ND1 N -10.172 2.716 -2.473 1.00 . A A . 4 HIS ND1 1 1 13 6265 1 1 4 HIS NE2 N -8.514 2.769 -3.823 1.00 . A A . 4 HIS NE2 1 1 13 6266 1 1 4 HIS O O -8.064 3.320 1.742 1.00 . A A . 4 HIS O 1 1 13 6267 1 1 5 TYR C C -4.853 4.259 2.182 1.00 . A A . 5 TYR C 1 1 13 6268 1 1 5 TYR CA C -5.615 4.477 0.873 1.00 . A A . 5 TYR CA 1 1 13 6269 1 1 5 TYR CB C -6.532 5.715 0.946 1.00 . A A . 5 TYR CB 1 1 13 6270 1 1 5 TYR CD1 C -6.268 7.254 -1.018 1.00 . A A . 5 TYR CD1 1 1 13 6271 1 1 5 TYR CD2 C -8.139 5.784 -1.005 1.00 . A A . 5 TYR CD2 1 1 13 6272 1 1 5 TYR CE1 C -6.674 7.775 -2.219 1.00 . A A . 5 TYR CE1 1 1 13 6273 1 1 5 TYR CE2 C -8.551 6.299 -2.215 1.00 . A A . 5 TYR CE2 1 1 13 6274 1 1 5 TYR CG C -6.986 6.254 -0.386 1.00 . A A . 5 TYR CG 1 1 13 6275 1 1 5 TYR CZ C -7.815 7.296 -2.815 1.00 . A A . 5 TYR CZ 1 1 13 6276 1 1 5 TYR H H -5.825 2.758 -0.345 1.00 . A A . 5 TYR H 1 1 13 6277 1 1 5 TYR HA H -4.845 4.665 0.138 1.00 . A A . 5 TYR HA 1 1 13 6278 1 1 5 TYR HB2 H -7.413 5.462 1.514 1.00 . A A . 5 TYR HB2 1 1 13 6279 1 1 5 TYR HB3 H -5.998 6.501 1.461 1.00 . A A . 5 TYR HB3 1 1 13 6280 1 1 5 TYR HD1 H -5.368 7.626 -0.551 1.00 . A A . 5 TYR HD1 1 1 13 6281 1 1 5 TYR HD2 H -8.712 5.002 -0.530 1.00 . A A . 5 TYR HD2 1 1 13 6282 1 1 5 TYR HE1 H -6.097 8.556 -2.695 1.00 . A A . 5 TYR HE1 1 1 13 6283 1 1 5 TYR HE2 H -9.447 5.922 -2.686 1.00 . A A . 5 TYR HE2 1 1 13 6284 1 1 5 TYR HH H -7.428 7.923 -4.560 1.00 . A A . 5 TYR HH 1 1 13 6285 1 1 5 TYR N N -6.263 3.249 0.386 1.00 . A A . 5 TYR N 1 1 13 6286 1 1 5 TYR O O -5.162 4.854 3.222 1.00 . A A . 5 TYR O 1 1 13 6287 1 1 5 TYR OH O -8.223 7.820 -4.016 1.00 . A A . 5 TYR OH 1 1 13 6288 1 1 6 GLY C C -1.753 2.481 2.678 1.00 . A A . 6 GLY C 1 1 13 6289 1 1 6 GLY CA C -3.020 3.084 3.225 1.00 . A A . 6 GLY CA 1 1 13 6290 1 1 6 GLY H H -3.769 2.834 1.309 1.00 . A A . 6 GLY H 1 1 13 6291 1 1 6 GLY HA2 H -2.793 4.007 3.737 1.00 . A A . 6 GLY HA2 1 1 13 6292 1 1 6 GLY HA3 H -3.482 2.383 3.905 1.00 . A A . 6 GLY HA3 1 1 13 6293 1 1 6 GLY N N -3.907 3.357 2.125 1.00 . A A . 6 GLY N 1 1 13 6294 1 1 6 GLY O O -1.767 1.985 1.541 1.00 . A A . 6 GLY O 1 1 13 6295 1 1 7 GLN C C 0.603 0.471 3.084 1.00 . A A . 7 GLN C 1 1 13 6296 1 1 7 GLN CA C 0.590 1.988 2.980 1.00 . A A . 7 GLN CA 1 1 13 6297 1 1 7 GLN CB C 1.755 2.609 3.757 1.00 . A A . 7 GLN CB 1 1 13 6298 1 1 7 GLN CD C 4.257 2.901 4.030 1.00 . A A . 7 GLN CD 1 1 13 6299 1 1 7 GLN CG C 3.148 2.174 3.291 1.00 . A A . 7 GLN CG 1 1 13 6300 1 1 7 GLN H H -0.755 2.853 4.354 1.00 . A A . 7 GLN H 1 1 13 6301 1 1 7 GLN HA H 0.683 2.256 1.937 1.00 . A A . 7 GLN HA 1 1 13 6302 1 1 7 GLN HB2 H 1.692 3.684 3.666 1.00 . A A . 7 GLN HB2 1 1 13 6303 1 1 7 GLN HB3 H 1.651 2.343 4.799 1.00 . A A . 7 GLN HB3 1 1 13 6304 1 1 7 GLN HE21 H 5.546 2.775 2.483 1.00 . A A . 7 GLN HE21 1 1 13 6305 1 1 7 GLN HE22 H 6.099 3.525 3.919 1.00 . A A . 7 GLN HE22 1 1 13 6306 1 1 7 GLN HG2 H 3.251 1.115 3.475 1.00 . A A . 7 GLN HG2 1 1 13 6307 1 1 7 GLN HG3 H 3.248 2.358 2.231 1.00 . A A . 7 GLN HG3 1 1 13 6308 1 1 7 GLN N N -0.684 2.511 3.437 1.00 . A A . 7 GLN N 1 1 13 6309 1 1 7 GLN NE2 N 5.394 3.079 3.400 1.00 . A A . 7 GLN NE2 1 1 13 6310 1 1 7 GLN O O 0.498 -0.089 4.164 1.00 . A A . 7 GLN O 1 1 13 6311 1 1 7 GLN OE1 O 4.092 3.300 5.174 1.00 . A A . 7 GLN OE1 1 1 13 6312 1 1 8 CYS C C 2.053 -2.220 2.043 1.00 . A A . 8 CYS C 1 1 13 6313 1 1 8 CYS CA C 0.688 -1.608 1.854 1.00 . A A . 8 CYS CA 1 1 13 6314 1 1 8 CYS CB C 0.120 -1.996 0.509 1.00 . A A . 8 CYS CB 1 1 13 6315 1 1 8 CYS H H 0.802 0.366 1.130 1.00 . A A . 8 CYS H 1 1 13 6316 1 1 8 CYS HA H 0.032 -1.995 2.616 1.00 . A A . 8 CYS HA 1 1 13 6317 1 1 8 CYS HB2 H 0.327 -3.037 0.315 1.00 . A A . 8 CYS HB2 1 1 13 6318 1 1 8 CYS HB3 H -0.947 -1.837 0.511 1.00 . A A . 8 CYS HB3 1 1 13 6319 1 1 8 CYS N N 0.711 -0.161 1.954 1.00 . A A . 8 CYS N 1 1 13 6320 1 1 8 CYS O O 2.205 -3.196 2.742 1.00 . A A . 8 CYS O 1 1 13 6321 1 1 8 CYS SG S 0.820 -1.021 -0.872 1.00 . A A . 8 CYS SG 1 1 13 6322 1 1 9 GLY C C 5.339 -1.501 0.693 1.00 . A A . 9 GLY C 1 1 13 6323 1 1 9 GLY CA C 4.352 -2.215 1.535 1.00 . A A . 9 GLY CA 1 1 13 6324 1 1 9 GLY H H 2.890 -0.858 0.871 1.00 . A A . 9 GLY H 1 1 13 6325 1 1 9 GLY HA2 H 4.669 -2.170 2.566 1.00 . A A . 9 GLY HA2 1 1 13 6326 1 1 9 GLY HA3 H 4.310 -3.247 1.223 1.00 . A A . 9 GLY HA3 1 1 13 6327 1 1 9 GLY N N 3.048 -1.651 1.424 1.00 . A A . 9 GLY N 1 1 13 6328 1 1 9 GLY O O 5.586 -1.883 -0.440 1.00 . A A . 9 GLY O 1 1 13 6329 1 1 10 GLY C C 8.189 0.100 1.248 1.00 . A A . 10 GLY C 1 1 13 6330 1 1 10 GLY CA C 6.886 0.292 0.538 1.00 . A A . 10 GLY CA 1 1 13 6331 1 1 10 GLY H H 5.599 -0.172 2.125 1.00 . A A . 10 GLY H 1 1 13 6332 1 1 10 GLY HA2 H 6.962 -0.064 -0.479 1.00 . A A . 10 GLY HA2 1 1 13 6333 1 1 10 GLY HA3 H 6.636 1.343 0.543 1.00 . A A . 10 GLY HA3 1 1 13 6334 1 1 10 GLY N N 5.867 -0.443 1.224 1.00 . A A . 10 GLY N 1 1 13 6335 1 1 10 GLY O O 8.256 -0.706 2.190 1.00 . A A . 10 GLY O 1 1 13 6336 1 1 11 ILE C C 10.419 1.242 2.911 1.00 . A A . 11 ILE C 1 1 13 6337 1 1 11 ILE CA C 10.503 0.713 1.479 1.00 . A A . 11 ILE CA 1 1 13 6338 1 1 11 ILE CB C 11.601 1.484 0.705 1.00 . A A . 11 ILE CB 1 1 13 6339 1 1 11 ILE CD1 C 12.676 1.762 -1.600 1.00 . A A . 11 ILE CD1 1 1 13 6340 1 1 11 ILE CG1 C 11.677 1.002 -0.750 1.00 . A A . 11 ILE CG1 1 1 13 6341 1 1 11 ILE CG2 C 12.959 1.300 1.391 1.00 . A A . 11 ILE CG2 1 1 13 6342 1 1 11 ILE H H 9.083 1.444 0.100 1.00 . A A . 11 ILE H 1 1 13 6343 1 1 11 ILE HA H 10.765 -0.334 1.511 1.00 . A A . 11 ILE HA 1 1 13 6344 1 1 11 ILE HB H 11.348 2.534 0.716 1.00 . A A . 11 ILE HB 1 1 13 6345 1 1 11 ILE HD11 H 13.665 1.663 -1.174 1.00 . A A . 11 ILE HD11 1 1 13 6346 1 1 11 ILE HD12 H 12.396 2.804 -1.629 1.00 . A A . 11 ILE HD12 1 1 13 6347 1 1 11 ILE HD13 H 12.675 1.360 -2.601 1.00 . A A . 11 ILE HD13 1 1 13 6348 1 1 11 ILE HG12 H 11.970 -0.037 -0.758 1.00 . A A . 11 ILE HG12 1 1 13 6349 1 1 11 ILE HG13 H 10.703 1.098 -1.207 1.00 . A A . 11 ILE HG13 1 1 13 6350 1 1 11 ILE HG21 H 13.214 0.252 1.410 1.00 . A A . 11 ILE HG21 1 1 13 6351 1 1 11 ILE HG22 H 12.899 1.672 2.402 1.00 . A A . 11 ILE HG22 1 1 13 6352 1 1 11 ILE HG23 H 13.712 1.850 0.845 1.00 . A A . 11 ILE HG23 1 1 13 6353 1 1 11 ILE N N 9.206 0.820 0.843 1.00 . A A . 11 ILE N 1 1 13 6354 1 1 11 ILE O O 10.158 2.433 3.135 1.00 . A A . 11 ILE O 1 1 13 6355 1 1 12 GLY C C 9.288 0.158 5.907 1.00 . A A . 12 GLY C 1 1 13 6356 1 1 12 GLY CA C 10.525 0.715 5.246 1.00 . A A . 12 GLY CA 1 1 13 6357 1 1 12 GLY H H 10.769 -0.577 3.606 1.00 . A A . 12 GLY H 1 1 13 6358 1 1 12 GLY HA2 H 11.397 0.327 5.752 1.00 . A A . 12 GLY HA2 1 1 13 6359 1 1 12 GLY HA3 H 10.517 1.790 5.338 1.00 . A A . 12 GLY HA3 1 1 13 6360 1 1 12 GLY N N 10.591 0.356 3.857 1.00 . A A . 12 GLY N 1 1 13 6361 1 1 12 GLY O O 9.150 0.206 7.124 1.00 . A A . 12 GLY O 1 1 13 6362 1 1 13 TYR C C 7.254 -2.449 5.697 1.00 . A A . 13 TYR C 1 1 13 6363 1 1 13 TYR CA C 7.169 -0.934 5.649 1.00 . A A . 13 TYR CA 1 1 13 6364 1 1 13 TYR CB C 5.952 -0.499 4.810 1.00 . A A . 13 TYR CB 1 1 13 6365 1 1 13 TYR CD1 C 4.054 -2.163 5.197 1.00 . A A . 13 TYR CD1 1 1 13 6366 1 1 13 TYR CD2 C 3.864 0.003 6.149 1.00 . A A . 13 TYR CD2 1 1 13 6367 1 1 13 TYR CE1 C 2.827 -2.508 5.728 1.00 . A A . 13 TYR CE1 1 1 13 6368 1 1 13 TYR CE2 C 2.641 -0.336 6.683 1.00 . A A . 13 TYR CE2 1 1 13 6369 1 1 13 TYR CG C 4.596 -0.897 5.400 1.00 . A A . 13 TYR CG 1 1 13 6370 1 1 13 TYR CZ C 2.128 -1.592 6.470 1.00 . A A . 13 TYR CZ 1 1 13 6371 1 1 13 TYR H H 8.561 -0.442 4.150 1.00 . A A . 13 TYR H 1 1 13 6372 1 1 13 TYR HA H 7.055 -0.555 6.652 1.00 . A A . 13 TYR HA 1 1 13 6373 1 1 13 TYR HB2 H 5.964 0.577 4.707 1.00 . A A . 13 TYR HB2 1 1 13 6374 1 1 13 TYR HB3 H 6.035 -0.946 3.830 1.00 . A A . 13 TYR HB3 1 1 13 6375 1 1 13 TYR HD1 H 4.610 -2.886 4.618 1.00 . A A . 13 TYR HD1 1 1 13 6376 1 1 13 TYR HD2 H 4.266 0.989 6.314 1.00 . A A . 13 TYR HD2 1 1 13 6377 1 1 13 TYR HE1 H 2.423 -3.495 5.561 1.00 . A A . 13 TYR HE1 1 1 13 6378 1 1 13 TYR HE2 H 2.094 0.389 7.268 1.00 . A A . 13 TYR HE2 1 1 13 6379 1 1 13 TYR HH H 0.289 -1.228 6.719 1.00 . A A . 13 TYR HH 1 1 13 6380 1 1 13 TYR N N 8.392 -0.385 5.115 1.00 . A A . 13 TYR N 1 1 13 6381 1 1 13 TYR O O 7.717 -3.087 4.749 1.00 . A A . 13 TYR O 1 1 13 6382 1 1 13 TYR OH O 0.896 -1.927 6.993 1.00 . A A . 13 TYR OH 1 1 13 6383 1 1 14 SER C C 5.469 -4.732 7.716 1.00 . A A . 14 SER C 1 1 13 6384 1 1 14 SER CA C 6.762 -4.420 6.980 1.00 . A A . 14 SER CA 1 1 13 6385 1 1 14 SER CB C 7.984 -4.877 7.771 1.00 . A A . 14 SER CB 1 1 13 6386 1 1 14 SER H H 6.572 -2.431 7.550 1.00 . A A . 14 SER H 1 1 13 6387 1 1 14 SER HA H 6.753 -4.896 6.011 1.00 . A A . 14 SER HA 1 1 13 6388 1 1 14 SER HB2 H 8.016 -4.335 8.704 1.00 . A A . 14 SER HB2 1 1 13 6389 1 1 14 SER HB3 H 7.900 -5.938 7.960 1.00 . A A . 14 SER HB3 1 1 13 6390 1 1 14 SER N N 6.836 -2.999 6.792 1.00 . A A . 14 SER N 1 1 13 6391 1 1 14 SER O O 5.270 -4.279 8.839 1.00 . A A . 14 SER O 1 1 13 6392 1 1 14 SER OG O 9.195 -4.626 6.992 1.00 . A A . 14 SER OG 1 1 13 6393 1 1 15 GLY C C 2.389 -6.378 6.617 1.00 . A A . 15 GLY C 1 1 13 6394 1 1 15 GLY CA C 3.305 -5.769 7.650 1.00 . A A . 15 GLY CA 1 1 13 6395 1 1 15 GLY H H 4.782 -5.802 6.174 1.00 . A A . 15 GLY H 1 1 13 6396 1 1 15 GLY HA2 H 3.450 -6.465 8.462 1.00 . A A . 15 GLY HA2 1 1 13 6397 1 1 15 GLY HA3 H 2.859 -4.861 8.024 1.00 . A A . 15 GLY HA3 1 1 13 6398 1 1 15 GLY N N 4.585 -5.451 7.069 1.00 . A A . 15 GLY N 1 1 13 6399 1 1 15 GLY O O 2.872 -7.082 5.720 1.00 . A A . 15 GLY O 1 1 13 6400 1 1 16 PRO C C 0.221 -5.954 4.387 1.00 . A A . 16 PRO C 1 1 13 6401 1 1 16 PRO CA C 0.101 -6.658 5.738 1.00 . A A . 16 PRO CA 1 1 13 6402 1 1 16 PRO CB C -1.270 -6.362 6.379 1.00 . A A . 16 PRO CB 1 1 13 6403 1 1 16 PRO CD C 0.403 -5.360 7.743 1.00 . A A . 16 PRO CD 1 1 13 6404 1 1 16 PRO CG C -0.957 -5.987 7.788 1.00 . A A . 16 PRO CG 1 1 13 6405 1 1 16 PRO HA H 0.224 -7.721 5.598 1.00 . A A . 16 PRO HA 1 1 13 6406 1 1 16 PRO HB2 H -1.736 -5.543 5.850 1.00 . A A . 16 PRO HB2 1 1 13 6407 1 1 16 PRO HB3 H -1.899 -7.237 6.332 1.00 . A A . 16 PRO HB3 1 1 13 6408 1 1 16 PRO HD2 H 0.334 -4.320 7.461 1.00 . A A . 16 PRO HD2 1 1 13 6409 1 1 16 PRO HD3 H 0.900 -5.470 8.694 1.00 . A A . 16 PRO HD3 1 1 13 6410 1 1 16 PRO HG2 H -1.687 -5.287 8.168 1.00 . A A . 16 PRO HG2 1 1 13 6411 1 1 16 PRO HG3 H -0.935 -6.874 8.404 1.00 . A A . 16 PRO HG3 1 1 13 6412 1 1 16 PRO N N 1.070 -6.141 6.703 1.00 . A A . 16 PRO N 1 1 13 6413 1 1 16 PRO O O -0.324 -4.870 4.181 1.00 . A A . 16 PRO O 1 1 13 6414 1 1 17 THR C C 0.073 -6.263 1.229 1.00 . A A . 17 THR C 1 1 13 6415 1 1 17 THR CA C 1.225 -6.023 2.202 1.00 . A A . 17 THR CA 1 1 13 6416 1 1 17 THR CB C 2.538 -6.619 1.644 1.00 . A A . 17 THR CB 1 1 13 6417 1 1 17 THR CG2 C 3.743 -6.111 2.427 1.00 . A A . 17 THR CG2 1 1 13 6418 1 1 17 THR H H 1.377 -7.417 3.737 1.00 . A A . 17 THR H 1 1 13 6419 1 1 17 THR HA H 1.367 -4.959 2.309 1.00 . A A . 17 THR HA 1 1 13 6420 1 1 17 THR HB H 2.637 -6.331 0.608 1.00 . A A . 17 THR HB 1 1 13 6421 1 1 17 THR HG1 H 2.398 -8.393 0.824 1.00 . A A . 17 THR HG1 1 1 13 6422 1 1 17 THR HG21 H 4.651 -6.522 2.011 1.00 . A A . 17 THR HG21 1 1 13 6423 1 1 17 THR HG22 H 3.649 -6.413 3.460 1.00 . A A . 17 THR HG22 1 1 13 6424 1 1 17 THR HG23 H 3.776 -5.032 2.375 1.00 . A A . 17 THR HG23 1 1 13 6425 1 1 17 THR N N 0.958 -6.564 3.504 1.00 . A A . 17 THR N 1 1 13 6426 1 1 17 THR O O -0.120 -5.501 0.277 1.00 . A A . 17 THR O 1 1 13 6427 1 1 17 THR OG1 O 2.493 -8.063 1.729 1.00 . A A . 17 THR OG1 1 1 13 6428 1 1 18 VAL C C -2.960 -6.714 0.829 1.00 . A A . 18 VAL C 1 1 13 6429 1 1 18 VAL CA C -1.791 -7.661 0.597 1.00 . A A . 18 VAL CA 1 1 13 6430 1 1 18 VAL CB C -2.242 -9.136 0.794 1.00 . A A . 18 VAL CB 1 1 13 6431 1 1 18 VAL CG1 C -3.381 -9.499 -0.158 1.00 . A A . 18 VAL CG1 1 1 13 6432 1 1 18 VAL CG2 C -1.066 -10.074 0.583 1.00 . A A . 18 VAL CG2 1 1 13 6433 1 1 18 VAL H H -0.508 -7.854 2.266 1.00 . A A . 18 VAL H 1 1 13 6434 1 1 18 VAL HA H -1.447 -7.534 -0.420 1.00 . A A . 18 VAL HA 1 1 13 6435 1 1 18 VAL HB H -2.595 -9.254 1.808 1.00 . A A . 18 VAL HB 1 1 13 6436 1 1 18 VAL HG11 H -3.044 -9.400 -1.179 1.00 . A A . 18 VAL HG11 1 1 13 6437 1 1 18 VAL HG12 H -4.212 -8.829 0.007 1.00 . A A . 18 VAL HG12 1 1 13 6438 1 1 18 VAL HG13 H -3.698 -10.514 0.023 1.00 . A A . 18 VAL HG13 1 1 13 6439 1 1 18 VAL HG21 H -0.695 -9.963 -0.424 1.00 . A A . 18 VAL HG21 1 1 13 6440 1 1 18 VAL HG22 H -1.379 -11.095 0.743 1.00 . A A . 18 VAL HG22 1 1 13 6441 1 1 18 VAL HG23 H -0.278 -9.829 1.281 1.00 . A A . 18 VAL HG23 1 1 13 6442 1 1 18 VAL N N -0.690 -7.313 1.469 1.00 . A A . 18 VAL N 1 1 13 6443 1 1 18 VAL O O -3.509 -6.633 1.941 1.00 . A A . 18 VAL O 1 1 13 6444 1 1 19 CYS C C -5.726 -5.736 -0.308 1.00 . A A . 19 CYS C 1 1 13 6445 1 1 19 CYS CA C -4.392 -5.036 -0.139 1.00 . A A . 19 CYS CA 1 1 13 6446 1 1 19 CYS CB C -4.212 -3.968 -1.208 1.00 . A A . 19 CYS CB 1 1 13 6447 1 1 19 CYS H H -2.823 -6.092 -1.043 1.00 . A A . 19 CYS H 1 1 13 6448 1 1 19 CYS HA H -4.366 -4.561 0.831 1.00 . A A . 19 CYS HA 1 1 13 6449 1 1 19 CYS HB2 H -4.251 -4.407 -2.193 1.00 . A A . 19 CYS HB2 1 1 13 6450 1 1 19 CYS HB3 H -5.008 -3.244 -1.112 1.00 . A A . 19 CYS HB3 1 1 13 6451 1 1 19 CYS N N -3.309 -5.987 -0.197 1.00 . A A . 19 CYS N 1 1 13 6452 1 1 19 CYS O O -5.776 -6.927 -0.651 1.00 . A A . 19 CYS O 1 1 13 6453 1 1 19 CYS SG S -2.650 -3.072 -1.074 1.00 . A A . 19 CYS SG 1 1 13 6454 1 1 20 ALA C C -8.460 -5.861 -1.621 1.00 . A A . 20 ALA C 1 1 13 6455 1 1 20 ALA CA C -8.127 -5.575 -0.156 1.00 . A A . 20 ALA CA 1 1 13 6456 1 1 20 ALA CB C -9.138 -4.622 0.453 1.00 . A A . 20 ALA CB 1 1 13 6457 1 1 20 ALA H H -6.692 -4.103 0.286 1.00 . A A . 20 ALA H 1 1 13 6458 1 1 20 ALA HA H -8.155 -6.503 0.396 1.00 . A A . 20 ALA HA 1 1 13 6459 1 1 20 ALA HB1 H -8.893 -4.447 1.490 1.00 . A A . 20 ALA HB1 1 1 13 6460 1 1 20 ALA HB2 H -10.126 -5.052 0.384 1.00 . A A . 20 ALA HB2 1 1 13 6461 1 1 20 ALA HB3 H -9.117 -3.686 -0.085 1.00 . A A . 20 ALA HB3 1 1 13 6462 1 1 20 ALA N N -6.795 -5.029 -0.024 1.00 . A A . 20 ALA N 1 1 13 6463 1 1 20 ALA O O -7.878 -5.244 -2.537 1.00 . A A . 20 ALA O 1 1 13 6464 1 1 21 SER C C -10.357 -5.946 -3.897 1.00 . A A . 21 SER C 1 1 13 6465 1 1 21 SER CA C -9.790 -7.173 -3.169 1.00 . A A . 21 SER CA 1 1 13 6466 1 1 21 SER CB C -10.869 -8.231 -3.027 1.00 . A A . 21 SER CB 1 1 13 6467 1 1 21 SER H H -9.744 -7.285 -1.082 1.00 . A A . 21 SER H 1 1 13 6468 1 1 21 SER HA H -8.957 -7.585 -3.717 1.00 . A A . 21 SER HA 1 1 13 6469 1 1 21 SER HB2 H -11.782 -7.761 -2.698 1.00 . A A . 21 SER HB2 1 1 13 6470 1 1 21 SER HB3 H -11.032 -8.713 -3.980 1.00 . A A . 21 SER HB3 1 1 13 6471 1 1 21 SER HG H -9.809 -9.774 -2.496 1.00 . A A . 21 SER HG 1 1 13 6472 1 1 21 SER N N -9.355 -6.796 -1.841 1.00 . A A . 21 SER N 1 1 13 6473 1 1 21 SER O O -11.326 -5.325 -3.429 1.00 . A A . 21 SER O 1 1 13 6474 1 1 21 SER OG O -10.472 -9.214 -2.072 1.00 . A A . 21 SER OG 1 1 13 6475 1 1 22 GLY C C -9.260 -3.247 -5.557 1.00 . A A . 22 GLY C 1 1 13 6476 1 1 22 GLY CA C -10.190 -4.420 -5.720 1.00 . A A . 22 GLY CA 1 1 13 6477 1 1 22 GLY H H -8.944 -6.052 -5.311 1.00 . A A . 22 GLY H 1 1 13 6478 1 1 22 GLY HA2 H -10.256 -4.676 -6.769 1.00 . A A . 22 GLY HA2 1 1 13 6479 1 1 22 GLY HA3 H -11.168 -4.139 -5.358 1.00 . A A . 22 GLY HA3 1 1 13 6480 1 1 22 GLY N N -9.732 -5.567 -4.984 1.00 . A A . 22 GLY N 1 1 13 6481 1 1 22 GLY O O -9.505 -2.167 -6.096 1.00 . A A . 22 GLY O 1 1 13 6482 1 1 23 THR C C -5.849 -2.979 -4.877 1.00 . A A . 23 THR C 1 1 13 6483 1 1 23 THR CA C -7.223 -2.396 -4.602 1.00 . A A . 23 THR CA 1 1 13 6484 1 1 23 THR CB C -7.282 -1.778 -3.169 1.00 . A A . 23 THR CB 1 1 13 6485 1 1 23 THR CG2 C -8.647 -1.181 -2.896 1.00 . A A . 23 THR CG2 1 1 13 6486 1 1 23 THR H H -8.068 -4.293 -4.341 1.00 . A A . 23 THR H 1 1 13 6487 1 1 23 THR HA H -7.420 -1.625 -5.333 1.00 . A A . 23 THR HA 1 1 13 6488 1 1 23 THR HB H -6.544 -0.990 -3.102 1.00 . A A . 23 THR HB 1 1 13 6489 1 1 23 THR HG1 H -7.304 -3.634 -2.484 1.00 . A A . 23 THR HG1 1 1 13 6490 1 1 23 THR HG21 H -8.672 -0.789 -1.891 1.00 . A A . 23 THR HG21 1 1 13 6491 1 1 23 THR HG22 H -9.405 -1.941 -3.011 1.00 . A A . 23 THR HG22 1 1 13 6492 1 1 23 THR HG23 H -8.835 -0.380 -3.594 1.00 . A A . 23 THR HG23 1 1 13 6493 1 1 23 THR N N -8.207 -3.431 -4.790 1.00 . A A . 23 THR N 1 1 13 6494 1 1 23 THR O O -5.596 -4.143 -4.561 1.00 . A A . 23 THR O 1 1 13 6495 1 1 23 THR OG1 O -7.014 -2.764 -2.169 1.00 . A A . 23 THR OG1 1 1 13 6496 1 1 24 THR C C -2.593 -1.952 -5.084 1.00 . A A . 24 THR C 1 1 13 6497 1 1 24 THR CA C -3.682 -2.697 -5.840 1.00 . A A . 24 THR CA 1 1 13 6498 1 1 24 THR CB C -3.466 -2.573 -7.369 1.00 . A A . 24 THR CB 1 1 13 6499 1 1 24 THR CG2 C -4.342 -3.562 -8.116 1.00 . A A . 24 THR CG2 1 1 13 6500 1 1 24 THR H H -5.209 -1.268 -5.671 1.00 . A A . 24 THR H 1 1 13 6501 1 1 24 THR HA H -3.637 -3.743 -5.575 1.00 . A A . 24 THR HA 1 1 13 6502 1 1 24 THR HB H -2.430 -2.786 -7.587 1.00 . A A . 24 THR HB 1 1 13 6503 1 1 24 THR HG1 H -4.403 -0.802 -7.212 1.00 . A A . 24 THR HG1 1 1 13 6504 1 1 24 THR HG21 H -4.096 -4.567 -7.804 1.00 . A A . 24 THR HG21 1 1 13 6505 1 1 24 THR HG22 H -4.175 -3.464 -9.180 1.00 . A A . 24 THR HG22 1 1 13 6506 1 1 24 THR HG23 H -5.380 -3.363 -7.895 1.00 . A A . 24 THR HG23 1 1 13 6507 1 1 24 THR N N -4.985 -2.209 -5.475 1.00 . A A . 24 THR N 1 1 13 6508 1 1 24 THR O O -2.666 -0.731 -4.937 1.00 . A A . 24 THR O 1 1 13 6509 1 1 24 THR OG1 O -3.779 -1.233 -7.821 1.00 . A A . 24 THR OG1 1 1 13 6510 1 1 25 CYS C C 0.425 -1.414 -4.872 1.00 . A A . 25 CYS C 1 1 13 6511 1 1 25 CYS CA C -0.510 -2.049 -3.868 1.00 . A A . 25 CYS CA 1 1 13 6512 1 1 25 CYS CB C 0.246 -3.078 -3.010 1.00 . A A . 25 CYS CB 1 1 13 6513 1 1 25 CYS H H -1.586 -3.646 -4.706 1.00 . A A . 25 CYS H 1 1 13 6514 1 1 25 CYS HA H -0.920 -1.280 -3.231 1.00 . A A . 25 CYS HA 1 1 13 6515 1 1 25 CYS HB2 H -0.434 -3.513 -2.292 1.00 . A A . 25 CYS HB2 1 1 13 6516 1 1 25 CYS HB3 H 0.624 -3.858 -3.654 1.00 . A A . 25 CYS HB3 1 1 13 6517 1 1 25 CYS N N -1.607 -2.673 -4.584 1.00 . A A . 25 CYS N 1 1 13 6518 1 1 25 CYS O O 1.166 -2.111 -5.569 1.00 . A A . 25 CYS O 1 1 13 6519 1 1 25 CYS SG S 1.667 -2.395 -2.082 1.00 . A A . 25 CYS SG 1 1 13 6520 1 1 26 GLN C C 2.059 1.579 -5.287 1.00 . A A . 26 GLN C 1 1 13 6521 1 1 26 GLN CA C 1.168 0.585 -5.956 1.00 . A A . 26 GLN CA 1 1 13 6522 1 1 26 GLN CB C 0.314 1.289 -7.002 1.00 . A A . 26 GLN CB 1 1 13 6523 1 1 26 GLN CD C -1.240 1.107 -8.945 1.00 . A A . 26 GLN CD 1 1 13 6524 1 1 26 GLN CG C -0.416 0.357 -7.939 1.00 . A A . 26 GLN CG 1 1 13 6525 1 1 26 GLN H H -0.261 0.399 -4.430 1.00 . A A . 26 GLN H 1 1 13 6526 1 1 26 GLN HA H 1.787 -0.140 -6.460 1.00 . A A . 26 GLN HA 1 1 13 6527 1 1 26 GLN HB2 H -0.417 1.904 -6.499 1.00 . A A . 26 GLN HB2 1 1 13 6528 1 1 26 GLN HB3 H 0.953 1.931 -7.591 1.00 . A A . 26 GLN HB3 1 1 13 6529 1 1 26 GLN HE21 H -2.825 0.976 -7.788 1.00 . A A . 26 GLN HE21 1 1 13 6530 1 1 26 GLN HE22 H -3.047 1.791 -9.294 1.00 . A A . 26 GLN HE22 1 1 13 6531 1 1 26 GLN HG2 H 0.309 -0.243 -8.469 1.00 . A A . 26 GLN HG2 1 1 13 6532 1 1 26 GLN HG3 H -1.068 -0.284 -7.364 1.00 . A A . 26 GLN HG3 1 1 13 6533 1 1 26 GLN N N 0.354 -0.118 -5.001 1.00 . A A . 26 GLN N 1 1 13 6534 1 1 26 GLN NE2 N -2.487 1.316 -8.643 1.00 . A A . 26 GLN NE2 1 1 13 6535 1 1 26 GLN O O 1.675 2.211 -4.302 1.00 . A A . 26 GLN O 1 1 13 6536 1 1 26 GLN OE1 O -0.756 1.467 -10.020 1.00 . A A . 26 GLN OE1 1 1 13 6537 1 1 27 VAL C C 3.647 4.066 -5.636 1.00 . A A . 27 VAL C 1 1 13 6538 1 1 27 VAL CA C 4.206 2.669 -5.356 1.00 . A A . 27 VAL CA 1 1 13 6539 1 1 27 VAL CB C 5.569 2.475 -6.083 1.00 . A A . 27 VAL CB 1 1 13 6540 1 1 27 VAL CG1 C 6.583 3.526 -5.673 1.00 . A A . 27 VAL CG1 1 1 13 6541 1 1 27 VAL CG2 C 6.118 1.086 -5.806 1.00 . A A . 27 VAL CG2 1 1 13 6542 1 1 27 VAL H H 3.497 1.106 -6.554 1.00 . A A . 27 VAL H 1 1 13 6543 1 1 27 VAL HA H 4.342 2.523 -4.293 1.00 . A A . 27 VAL HA 1 1 13 6544 1 1 27 VAL HB H 5.402 2.561 -7.147 1.00 . A A . 27 VAL HB 1 1 13 6545 1 1 27 VAL HG11 H 6.205 4.507 -5.920 1.00 . A A . 27 VAL HG11 1 1 13 6546 1 1 27 VAL HG12 H 7.512 3.355 -6.196 1.00 . A A . 27 VAL HG12 1 1 13 6547 1 1 27 VAL HG13 H 6.751 3.466 -4.608 1.00 . A A . 27 VAL HG13 1 1 13 6548 1 1 27 VAL HG21 H 6.267 0.962 -4.745 1.00 . A A . 27 VAL HG21 1 1 13 6549 1 1 27 VAL HG22 H 7.059 0.957 -6.319 1.00 . A A . 27 VAL HG22 1 1 13 6550 1 1 27 VAL HG23 H 5.406 0.352 -6.156 1.00 . A A . 27 VAL HG23 1 1 13 6551 1 1 27 VAL N N 3.249 1.698 -5.812 1.00 . A A . 27 VAL N 1 1 13 6552 1 1 27 VAL O O 3.434 4.438 -6.789 1.00 . A A . 27 VAL O 1 1 13 6553 1 1 28 LEU C C 3.958 7.106 -4.704 1.00 . A A . 28 LEU C 1 1 13 6554 1 1 28 LEU CA C 2.800 6.125 -4.720 1.00 . A A . 28 LEU CA 1 1 13 6555 1 1 28 LEU CB C 1.823 6.370 -3.536 1.00 . A A . 28 LEU CB 1 1 13 6556 1 1 28 LEU CD1 C -0.192 7.461 -2.516 1.00 . A A . 28 LEU CD1 1 1 13 6557 1 1 28 LEU CD2 C 1.498 8.893 -3.564 1.00 . A A . 28 LEU CD2 1 1 13 6558 1 1 28 LEU CG C 0.815 7.548 -3.635 1.00 . A A . 28 LEU CG 1 1 13 6559 1 1 28 LEU H H 3.572 4.444 -3.700 1.00 . A A . 28 LEU H 1 1 13 6560 1 1 28 LEU HA H 2.270 6.193 -5.659 1.00 . A A . 28 LEU HA 1 1 13 6561 1 1 28 LEU HB2 H 1.263 5.463 -3.368 1.00 . A A . 28 LEU HB2 1 1 13 6562 1 1 28 LEU HB3 H 2.442 6.534 -2.666 1.00 . A A . 28 LEU HB3 1 1 13 6563 1 1 28 LEU HD11 H -0.738 6.532 -2.586 1.00 . A A . 28 LEU HD11 1 1 13 6564 1 1 28 LEU HD12 H -0.876 8.293 -2.586 1.00 . A A . 28 LEU HD12 1 1 13 6565 1 1 28 LEU HD13 H 0.321 7.506 -1.568 1.00 . A A . 28 LEU HD13 1 1 13 6566 1 1 28 LEU HD21 H 0.756 9.675 -3.633 1.00 . A A . 28 LEU HD21 1 1 13 6567 1 1 28 LEU HD22 H 2.198 8.981 -4.381 1.00 . A A . 28 LEU HD22 1 1 13 6568 1 1 28 LEU HD23 H 2.028 8.980 -2.627 1.00 . A A . 28 LEU HD23 1 1 13 6569 1 1 28 LEU HG H 0.281 7.476 -4.570 1.00 . A A . 28 LEU HG 1 1 13 6570 1 1 28 LEU N N 3.367 4.799 -4.593 1.00 . A A . 28 LEU N 1 1 13 6571 1 1 28 LEU O O 4.032 8.031 -5.508 1.00 . A A . 28 LEU O 1 1 13 6572 1 1 29 ASN C C 7.169 6.575 -3.444 1.00 . A A . 29 ASN C 1 1 13 6573 1 1 29 ASN CA C 6.080 7.620 -3.610 1.00 . A A . 29 ASN CA 1 1 13 6574 1 1 29 ASN CB C 6.005 8.490 -2.335 1.00 . A A . 29 ASN CB 1 1 13 6575 1 1 29 ASN CG C 4.941 9.571 -2.337 1.00 . A A . 29 ASN CG 1 1 13 6576 1 1 29 ASN H H 4.754 6.070 -3.214 1.00 . A A . 29 ASN H 1 1 13 6577 1 1 29 ASN HA H 6.268 8.225 -4.485 1.00 . A A . 29 ASN HA 1 1 13 6578 1 1 29 ASN HB2 H 5.814 7.850 -1.489 1.00 . A A . 29 ASN HB2 1 1 13 6579 1 1 29 ASN HB3 H 6.966 8.966 -2.199 1.00 . A A . 29 ASN HB3 1 1 13 6580 1 1 29 ASN HD21 H 4.794 9.452 -0.366 1.00 . A A . 29 ASN HD21 1 1 13 6581 1 1 29 ASN HD22 H 3.760 10.596 -1.113 1.00 . A A . 29 ASN HD22 1 1 13 6582 1 1 29 ASN N N 4.863 6.858 -3.797 1.00 . A A . 29 ASN N 1 1 13 6583 1 1 29 ASN ND2 N 4.452 9.903 -1.167 1.00 . A A . 29 ASN ND2 1 1 13 6584 1 1 29 ASN O O 6.827 5.429 -3.218 1.00 . A A . 29 ASN O 1 1 13 6585 1 1 29 ASN OD1 O 4.575 10.122 -3.375 1.00 . A A . 29 ASN OD1 1 1 13 6586 1 1 30 PRO C C 9.478 4.972 -2.243 1.00 . A A . 30 PRO C 1 1 13 6587 1 1 30 PRO CA C 9.575 5.928 -3.448 1.00 . A A . 30 PRO CA 1 1 13 6588 1 1 30 PRO CB C 10.819 6.800 -3.332 1.00 . A A . 30 PRO CB 1 1 13 6589 1 1 30 PRO CD C 9.012 8.283 -3.758 1.00 . A A . 30 PRO CD 1 1 13 6590 1 1 30 PRO CG C 10.458 8.033 -4.067 1.00 . A A . 30 PRO CG 1 1 13 6591 1 1 30 PRO HA H 9.636 5.341 -4.353 1.00 . A A . 30 PRO HA 1 1 13 6592 1 1 30 PRO HB2 H 11.018 7.000 -2.290 1.00 . A A . 30 PRO HB2 1 1 13 6593 1 1 30 PRO HB3 H 11.666 6.303 -3.782 1.00 . A A . 30 PRO HB3 1 1 13 6594 1 1 30 PRO HD2 H 8.935 8.878 -2.862 1.00 . A A . 30 PRO HD2 1 1 13 6595 1 1 30 PRO HD3 H 8.513 8.767 -4.582 1.00 . A A . 30 PRO HD3 1 1 13 6596 1 1 30 PRO HG2 H 11.070 8.852 -3.723 1.00 . A A . 30 PRO HG2 1 1 13 6597 1 1 30 PRO HG3 H 10.588 7.879 -5.127 1.00 . A A . 30 PRO HG3 1 1 13 6598 1 1 30 PRO N N 8.475 6.920 -3.537 1.00 . A A . 30 PRO N 1 1 13 6599 1 1 30 PRO O O 9.777 3.779 -2.361 1.00 . A A . 30 PRO O 1 1 13 6600 1 1 31 TYR C C 7.521 4.334 0.417 1.00 . A A . 31 TYR C 1 1 13 6601 1 1 31 TYR CA C 8.974 4.648 0.084 1.00 . A A . 31 TYR CA 1 1 13 6602 1 1 31 TYR CB C 9.667 5.353 1.279 1.00 . A A . 31 TYR CB 1 1 13 6603 1 1 31 TYR CD1 C 11.531 6.769 0.300 1.00 . A A . 31 TYR CD1 1 1 13 6604 1 1 31 TYR CD2 C 12.116 4.793 1.478 1.00 . A A . 31 TYR CD2 1 1 13 6605 1 1 31 TYR CE1 C 12.859 7.010 0.029 1.00 . A A . 31 TYR CE1 1 1 13 6606 1 1 31 TYR CE2 C 13.445 5.031 1.222 1.00 . A A . 31 TYR CE2 1 1 13 6607 1 1 31 TYR CG C 11.135 5.649 1.025 1.00 . A A . 31 TYR CG 1 1 13 6608 1 1 31 TYR CZ C 13.813 6.138 0.493 1.00 . A A . 31 TYR CZ 1 1 13 6609 1 1 31 TYR H H 8.813 6.428 -1.048 1.00 . A A . 31 TYR H 1 1 13 6610 1 1 31 TYR HA H 9.495 3.725 -0.118 1.00 . A A . 31 TYR HA 1 1 13 6611 1 1 31 TYR HB2 H 9.168 6.287 1.489 1.00 . A A . 31 TYR HB2 1 1 13 6612 1 1 31 TYR HB3 H 9.600 4.711 2.146 1.00 . A A . 31 TYR HB3 1 1 13 6613 1 1 31 TYR HD1 H 10.777 7.453 -0.063 1.00 . A A . 31 TYR HD1 1 1 13 6614 1 1 31 TYR HD2 H 11.831 3.925 2.053 1.00 . A A . 31 TYR HD2 1 1 13 6615 1 1 31 TYR HE1 H 13.145 7.885 -0.534 1.00 . A A . 31 TYR HE1 1 1 13 6616 1 1 31 TYR HE2 H 14.190 4.343 1.590 1.00 . A A . 31 TYR HE2 1 1 13 6617 1 1 31 TYR HH H 15.341 7.270 0.462 1.00 . A A . 31 TYR HH 1 1 13 6618 1 1 31 TYR N N 9.063 5.480 -1.101 1.00 . A A . 31 TYR N 1 1 13 6619 1 1 31 TYR O O 7.213 3.323 1.053 1.00 . A A . 31 TYR O 1 1 13 6620 1 1 31 TYR OH O 15.145 6.359 0.205 1.00 . A A . 31 TYR OH 1 1 13 6621 1 1 32 TYR C C 4.544 4.227 -0.877 1.00 . A A . 32 TYR C 1 1 13 6622 1 1 32 TYR CA C 5.238 4.984 0.262 1.00 . A A . 32 TYR CA 1 1 13 6623 1 1 32 TYR CB C 4.565 6.337 0.498 1.00 . A A . 32 TYR CB 1 1 13 6624 1 1 32 TYR CD1 C 2.051 6.377 0.398 1.00 . A A . 32 TYR CD1 1 1 13 6625 1 1 32 TYR CD2 C 3.090 6.063 2.506 1.00 . A A . 32 TYR CD2 1 1 13 6626 1 1 32 TYR CE1 C 0.815 6.300 0.995 1.00 . A A . 32 TYR CE1 1 1 13 6627 1 1 32 TYR CE2 C 1.858 5.987 3.111 1.00 . A A . 32 TYR CE2 1 1 13 6628 1 1 32 TYR CG C 3.208 6.258 1.143 1.00 . A A . 32 TYR CG 1 1 13 6629 1 1 32 TYR CZ C 0.724 6.107 2.350 1.00 . A A . 32 TYR CZ 1 1 13 6630 1 1 32 TYR H H 6.930 5.954 -0.537 1.00 . A A . 32 TYR H 1 1 13 6631 1 1 32 TYR HA H 5.157 4.404 1.169 1.00 . A A . 32 TYR HA 1 1 13 6632 1 1 32 TYR HB2 H 5.190 6.952 1.125 1.00 . A A . 32 TYR HB2 1 1 13 6633 1 1 32 TYR HB3 H 4.439 6.820 -0.459 1.00 . A A . 32 TYR HB3 1 1 13 6634 1 1 32 TYR HD1 H 2.128 6.529 -0.668 1.00 . A A . 32 TYR HD1 1 1 13 6635 1 1 32 TYR HD2 H 3.987 5.971 3.100 1.00 . A A . 32 TYR HD2 1 1 13 6636 1 1 32 TYR HE1 H -0.080 6.398 0.398 1.00 . A A . 32 TYR HE1 1 1 13 6637 1 1 32 TYR HE2 H 1.793 5.835 4.179 1.00 . A A . 32 TYR HE2 1 1 13 6638 1 1 32 TYR HH H -1.110 5.620 2.290 1.00 . A A . 32 TYR HH 1 1 13 6639 1 1 32 TYR N N 6.631 5.183 -0.013 1.00 . A A . 32 TYR N 1 1 13 6640 1 1 32 TYR O O 4.385 4.756 -1.976 1.00 . A A . 32 TYR O 1 1 13 6641 1 1 32 TYR OH O -0.514 6.011 2.943 1.00 . A A . 32 TYR OH 1 1 13 6642 1 1 33 SER C C 1.920 2.205 -0.953 1.00 . A A . 33 SER C 1 1 13 6643 1 1 33 SER CA C 3.303 2.308 -1.553 1.00 . A A . 33 SER CA 1 1 13 6644 1 1 33 SER CB C 3.897 0.923 -1.818 1.00 . A A . 33 SER CB 1 1 13 6645 1 1 33 SER H H 4.313 2.618 0.246 1.00 . A A . 33 SER H 1 1 13 6646 1 1 33 SER HA H 3.253 2.882 -2.466 1.00 . A A . 33 SER HA 1 1 13 6647 1 1 33 SER HB2 H 3.819 0.303 -0.938 1.00 . A A . 33 SER HB2 1 1 13 6648 1 1 33 SER HB3 H 3.352 0.472 -2.634 1.00 . A A . 33 SER HB3 1 1 13 6649 1 1 33 SER HG H 5.444 0.335 -2.850 1.00 . A A . 33 SER HG 1 1 13 6650 1 1 33 SER N N 4.099 3.042 -0.606 1.00 . A A . 33 SER N 1 1 13 6651 1 1 33 SER O O 1.793 1.939 0.243 1.00 . A A . 33 SER O 1 1 13 6652 1 1 33 SER OG O 5.260 1.025 -2.204 1.00 . A A . 33 SER OG 1 1 13 6653 1 1 34 GLN C C -1.391 1.660 -2.037 1.00 . A A . 34 GLN C 1 1 13 6654 1 1 34 GLN CA C -0.429 2.497 -1.220 1.00 . A A . 34 GLN CA 1 1 13 6655 1 1 34 GLN CB C -0.876 3.964 -1.156 1.00 . A A . 34 GLN CB 1 1 13 6656 1 1 34 GLN CD C -2.576 5.607 -0.286 1.00 . A A . 34 GLN CD 1 1 13 6657 1 1 34 GLN CG C -2.285 4.175 -0.646 1.00 . A A . 34 GLN CG 1 1 13 6658 1 1 34 GLN H H 1.054 2.511 -2.708 1.00 . A A . 34 GLN H 1 1 13 6659 1 1 34 GLN HA H -0.410 2.112 -0.211 1.00 . A A . 34 GLN HA 1 1 13 6660 1 1 34 GLN HB2 H -0.199 4.496 -0.506 1.00 . A A . 34 GLN HB2 1 1 13 6661 1 1 34 GLN HB3 H -0.804 4.384 -2.148 1.00 . A A . 34 GLN HB3 1 1 13 6662 1 1 34 GLN HE21 H -3.274 5.966 -2.085 1.00 . A A . 34 GLN HE21 1 1 13 6663 1 1 34 GLN HE22 H -3.255 7.299 -0.984 1.00 . A A . 34 GLN HE22 1 1 13 6664 1 1 34 GLN HG2 H -2.981 3.862 -1.410 1.00 . A A . 34 GLN HG2 1 1 13 6665 1 1 34 GLN HG3 H -2.421 3.561 0.231 1.00 . A A . 34 GLN HG3 1 1 13 6666 1 1 34 GLN N N 0.908 2.429 -1.735 1.00 . A A . 34 GLN N 1 1 13 6667 1 1 34 GLN NE2 N -3.090 6.354 -1.208 1.00 . A A . 34 GLN NE2 1 1 13 6668 1 1 34 GLN O O -1.227 1.515 -3.249 1.00 . A A . 34 GLN O 1 1 13 6669 1 1 34 GLN OE1 O -2.361 6.020 0.849 1.00 . A A . 34 GLN OE1 1 1 13 6670 1 1 35 CYS C C -4.343 1.271 -2.694 1.00 . A A . 35 CYS C 1 1 13 6671 1 1 35 CYS CA C -3.400 0.318 -1.993 1.00 . A A . 35 CYS CA 1 1 13 6672 1 1 35 CYS CB C -4.171 -0.487 -0.965 1.00 . A A . 35 CYS CB 1 1 13 6673 1 1 35 CYS H H -2.353 1.123 -0.377 1.00 . A A . 35 CYS H 1 1 13 6674 1 1 35 CYS HA H -2.958 -0.355 -2.713 1.00 . A A . 35 CYS HA 1 1 13 6675 1 1 35 CYS HB2 H -4.764 0.171 -0.351 1.00 . A A . 35 CYS HB2 1 1 13 6676 1 1 35 CYS HB3 H -4.833 -1.150 -1.496 1.00 . A A . 35 CYS HB3 1 1 13 6677 1 1 35 CYS N N -2.355 1.072 -1.357 1.00 . A A . 35 CYS N 1 1 13 6678 1 1 35 CYS O O -5.081 2.038 -2.036 1.00 . A A . 35 CYS O 1 1 13 6679 1 1 35 CYS SG S -3.122 -1.499 0.100 1.00 . A A . 35 CYS SG 1 1 13 6680 1 1 36 LEU C C -5.955 1.149 -5.662 1.00 . A A . 36 LEU C 1 1 13 6681 1 1 36 LEU CA C -5.098 2.069 -4.836 1.00 . A A . 36 LEU CA 1 1 13 6682 1 1 36 LEU CB C -4.231 2.950 -5.746 1.00 . A A . 36 LEU CB 1 1 13 6683 1 1 36 LEU CD1 C -2.483 4.729 -6.053 1.00 . A A . 36 LEU CD1 1 1 13 6684 1 1 36 LEU CD2 C -4.228 4.997 -4.286 1.00 . A A . 36 LEU CD2 1 1 13 6685 1 1 36 LEU CG C -3.356 4.001 -5.045 1.00 . A A . 36 LEU CG 1 1 13 6686 1 1 36 LEU H H -3.644 0.645 -4.424 1.00 . A A . 36 LEU H 1 1 13 6687 1 1 36 LEU HA H -5.727 2.694 -4.219 1.00 . A A . 36 LEU HA 1 1 13 6688 1 1 36 LEU HB2 H -3.585 2.299 -6.319 1.00 . A A . 36 LEU HB2 1 1 13 6689 1 1 36 LEU HB3 H -4.883 3.463 -6.435 1.00 . A A . 36 LEU HB3 1 1 13 6690 1 1 36 LEU HD11 H -1.869 5.456 -5.542 1.00 . A A . 36 LEU HD11 1 1 13 6691 1 1 36 LEU HD12 H -3.110 5.236 -6.774 1.00 . A A . 36 LEU HD12 1 1 13 6692 1 1 36 LEU HD13 H -1.850 4.019 -6.565 1.00 . A A . 36 LEU HD13 1 1 13 6693 1 1 36 LEU HD21 H -4.737 4.504 -3.472 1.00 . A A . 36 LEU HD21 1 1 13 6694 1 1 36 LEU HD22 H -4.961 5.406 -4.965 1.00 . A A . 36 LEU HD22 1 1 13 6695 1 1 36 LEU HD23 H -3.615 5.799 -3.906 1.00 . A A . 36 LEU HD23 1 1 13 6696 1 1 36 LEU HG H -2.713 3.503 -4.335 1.00 . A A . 36 LEU HG 1 1 13 6697 1 1 36 LEU N N -4.280 1.259 -3.989 1.00 . A A . 36 LEU N 1 1 13 6698 1 1 36 LEU O O -7.180 1.140 -5.488 1.00 . A A . 36 LEU O 1 1 13 6699 1 1 36 LEU OXT O -5.387 0.353 -6.433 1.00 . A A . 36 LEU OXT 1 1 13 6700 2 2 1 MAN C1 C 10.369 -4.527 7.760 1.00 . B A . 101 MAN C1 1 1 13 6701 2 2 1 MAN C2 C 10.668 -5.816 8.573 1.00 . B A . 101 MAN C2 1 1 13 6702 2 2 1 MAN C3 C 11.704 -5.526 9.669 1.00 . B A . 101 MAN C3 1 1 13 6703 2 2 1 MAN C4 C 12.539 -4.332 9.256 1.00 . B A . 101 MAN C4 1 1 13 6704 2 2 1 MAN C5 C 11.641 -3.064 9.181 1.00 . B A . 101 MAN C5 1 1 13 6705 2 2 1 MAN C6 C 12.221 -1.966 8.290 1.00 . B A . 101 MAN C6 1 1 13 6706 2 2 1 MAN H1 H 11.211 -4.370 7.071 1.00 . B A . 101 MAN H1 1 1 13 6707 2 2 1 MAN H2 H 9.727 -6.157 9.029 1.00 . B A . 101 MAN H2 1 1 13 6708 2 2 1 MAN H3 H 11.206 -5.297 10.624 1.00 . B A . 101 MAN H3 1 1 13 6709 2 2 1 MAN H4 H 12.950 -4.538 8.258 1.00 . B A . 101 MAN H4 1 1 13 6710 2 2 1 MAN H5 H 11.441 -2.662 10.185 1.00 . B A . 101 MAN H5 1 1 13 6711 2 2 1 MAN H61 H 11.474 -1.164 8.223 1.00 . B A . 101 MAN H61 1 1 13 6712 2 2 1 MAN H62 H 12.387 -2.357 7.276 1.00 . B A . 101 MAN H62 1 1 13 6713 2 2 1 MAN HO2 H 10.574 -6.927 6.984 1.00 . B A . 101 MAN HO2 1 1 13 6714 2 2 1 MAN HO3 H 12.887 -6.811 8.886 1.00 . B A . 101 MAN HO3 1 1 13 6715 2 2 1 MAN HO4 H 14.046 -5.022 10.191 1.00 . B A . 101 MAN HO4 1 1 13 6716 2 2 1 MAN HO6 H 13.913 -2.178 9.258 1.00 . B A . 101 MAN HO6 1 1 13 6717 2 2 1 MAN O2 O 11.198 -6.809 7.710 1.00 . B A . 101 MAN O2 1 1 13 6718 2 2 1 MAN O3 O 12.574 -6.645 9.787 1.00 . B A . 101 MAN O3 1 1 13 6719 2 2 1 MAN O4 O 13.595 -4.169 10.182 1.00 . B A . 101 MAN O4 1 1 13 6720 2 2 1 MAN O5 O 10.342 -3.411 8.631 1.00 . B A . 101 MAN O5 1 1 13 6721 2 2 1 MAN O6 O 13.445 -1.460 8.814 1.00 . B A . 101 MAN O6 1 1 14 6722 1 1 1 THR C C -4.782 -5.912 4.692 1.00 . A A . 1 THR C 1 1 14 6723 1 1 1 THR CA C -5.045 -7.343 4.216 1.00 . A A . 1 THR CA 1 1 14 6724 1 1 1 THR CB C -6.546 -7.601 4.132 1.00 . A A . 1 THR CB 1 1 14 6725 1 1 1 THR CG2 C -7.142 -6.908 2.927 1.00 . A A . 1 THR CG2 1 1 14 6726 1 1 1 THR H1 H -4.854 -8.070 6.096 1.00 . A A . 1 THR H1 1 1 14 6727 1 1 1 THR H2 H -3.434 -8.230 5.165 1.00 . A A . 1 THR H2 1 1 14 6728 1 1 1 THR H3 H -4.797 -9.218 4.882 1.00 . A A . 1 THR H3 1 1 14 6729 1 1 1 THR HA H -4.602 -7.495 3.243 1.00 . A A . 1 THR HA 1 1 14 6730 1 1 1 THR HB H -7.023 -7.239 5.031 1.00 . A A . 1 THR HB 1 1 14 6731 1 1 1 THR HG1 H -7.661 -9.155 3.703 1.00 . A A . 1 THR HG1 1 1 14 6732 1 1 1 THR HG21 H -6.977 -5.844 3.006 1.00 . A A . 1 THR HG21 1 1 14 6733 1 1 1 THR HG22 H -8.204 -7.105 2.882 1.00 . A A . 1 THR HG22 1 1 14 6734 1 1 1 THR HG23 H -6.669 -7.280 2.030 1.00 . A A . 1 THR HG23 1 1 14 6735 1 1 1 THR N N -4.471 -8.269 5.153 1.00 . A A . 1 THR N 1 1 14 6736 1 1 1 THR O O -4.762 -5.657 5.897 1.00 . A A . 1 THR O 1 1 14 6737 1 1 1 THR OG1 O -6.756 -9.014 4.003 1.00 . A A . 1 THR OG1 1 1 14 6738 1 1 2 GLN C C -5.359 -2.777 3.345 1.00 . A A . 2 GLN C 1 1 14 6739 1 1 2 GLN CA C -4.306 -3.628 4.091 1.00 . A A . 2 GLN CA 1 1 14 6740 1 1 2 GLN CB C -2.846 -3.264 3.731 1.00 . A A . 2 GLN CB 1 1 14 6741 1 1 2 GLN CD C -2.784 -0.716 4.017 1.00 . A A . 2 GLN CD 1 1 14 6742 1 1 2 GLN CG C -2.263 -2.053 4.479 1.00 . A A . 2 GLN CG 1 1 14 6743 1 1 2 GLN H H -4.496 -5.280 2.822 1.00 . A A . 2 GLN H 1 1 14 6744 1 1 2 GLN HA H -4.463 -3.515 5.154 1.00 . A A . 2 GLN HA 1 1 14 6745 1 1 2 GLN HB2 H -2.224 -4.119 3.954 1.00 . A A . 2 GLN HB2 1 1 14 6746 1 1 2 GLN HB3 H -2.793 -3.076 2.670 1.00 . A A . 2 GLN HB3 1 1 14 6747 1 1 2 GLN HE21 H -2.850 -1.335 2.145 1.00 . A A . 2 GLN HE21 1 1 14 6748 1 1 2 GLN HE22 H -3.385 0.266 2.438 1.00 . A A . 2 GLN HE22 1 1 14 6749 1 1 2 GLN HG2 H -2.504 -2.154 5.527 1.00 . A A . 2 GLN HG2 1 1 14 6750 1 1 2 GLN HG3 H -1.189 -2.066 4.366 1.00 . A A . 2 GLN HG3 1 1 14 6751 1 1 2 GLN N N -4.539 -5.006 3.766 1.00 . A A . 2 GLN N 1 1 14 6752 1 1 2 GLN NE2 N -3.019 -0.585 2.752 1.00 . A A . 2 GLN NE2 1 1 14 6753 1 1 2 GLN O O -5.701 -3.071 2.184 1.00 . A A . 2 GLN O 1 1 14 6754 1 1 2 GLN OE1 O -2.918 0.218 4.802 1.00 . A A . 2 GLN OE1 1 1 14 6755 1 1 3 SER C C -6.714 -0.120 2.297 1.00 . A A . 3 SER C 1 1 14 6756 1 1 3 SER CA C -6.963 -0.915 3.599 1.00 . A A . 3 SER CA 1 1 14 6757 1 1 3 SER CB C -7.262 0.055 4.727 1.00 . A A . 3 SER CB 1 1 14 6758 1 1 3 SER H H -5.480 -1.555 4.907 1.00 . A A . 3 SER H 1 1 14 6759 1 1 3 SER HA H -7.841 -1.531 3.477 1.00 . A A . 3 SER HA 1 1 14 6760 1 1 3 SER HB2 H -6.429 0.731 4.850 1.00 . A A . 3 SER HB2 1 1 14 6761 1 1 3 SER HB3 H -8.149 0.619 4.486 1.00 . A A . 3 SER HB3 1 1 14 6762 1 1 3 SER HG H -8.062 -0.079 6.468 1.00 . A A . 3 SER HG 1 1 14 6763 1 1 3 SER N N -5.861 -1.768 4.030 1.00 . A A . 3 SER N 1 1 14 6764 1 1 3 SER O O -5.572 0.203 1.924 1.00 . A A . 3 SER O 1 1 14 6765 1 1 3 SER OG O -7.477 -0.641 5.943 1.00 . A A . 3 SER OG 1 1 14 6766 1 1 4 HIS C C -7.275 2.411 0.842 1.00 . A A . 4 HIS C 1 1 14 6767 1 1 4 HIS CA C -7.797 1.031 0.434 1.00 . A A . 4 HIS CA 1 1 14 6768 1 1 4 HIS CB C -9.242 1.136 -0.122 1.00 . A A . 4 HIS CB 1 1 14 6769 1 1 4 HIS CD2 C -8.450 2.115 -2.409 1.00 . A A . 4 HIS CD2 1 1 14 6770 1 1 4 HIS CE1 C -10.390 2.310 -3.374 1.00 . A A . 4 HIS CE1 1 1 14 6771 1 1 4 HIS CG C -9.380 1.723 -1.513 1.00 . A A . 4 HIS CG 1 1 14 6772 1 1 4 HIS H H -8.673 -0.104 1.980 1.00 . A A . 4 HIS H 1 1 14 6773 1 1 4 HIS HA H -7.145 0.583 -0.303 1.00 . A A . 4 HIS HA 1 1 14 6774 1 1 4 HIS HB2 H -9.679 0.149 -0.147 1.00 . A A . 4 HIS HB2 1 1 14 6775 1 1 4 HIS HB3 H -9.821 1.746 0.555 1.00 . A A . 4 HIS HB3 1 1 14 6776 1 1 4 HIS HD1 H -11.479 1.683 -1.772 1.00 . A A . 4 HIS HD1 1 1 14 6777 1 1 4 HIS HD2 H -7.382 2.141 -2.245 1.00 . A A . 4 HIS HD2 1 1 14 6778 1 1 4 HIS HE1 H -11.159 2.504 -4.107 1.00 . A A . 4 HIS HE1 1 1 14 6779 1 1 4 HIS HE2 H -8.659 2.243 -4.416 1.00 . A A . 4 HIS HE2 1 1 14 6780 1 1 4 HIS N N -7.810 0.212 1.630 1.00 . A A . 4 HIS N 1 1 14 6781 1 1 4 HIS ND1 N -10.588 1.866 -2.149 1.00 . A A . 4 HIS ND1 1 1 14 6782 1 1 4 HIS NE2 N -9.095 2.468 -3.555 1.00 . A A . 4 HIS NE2 1 1 14 6783 1 1 4 HIS O O -7.688 2.938 1.865 1.00 . A A . 4 HIS O 1 1 14 6784 1 1 5 TYR C C -4.768 4.242 1.576 1.00 . A A . 5 TYR C 1 1 14 6785 1 1 5 TYR CA C -5.710 4.254 0.363 1.00 . A A . 5 TYR CA 1 1 14 6786 1 1 5 TYR CB C -6.719 5.426 0.431 1.00 . A A . 5 TYR CB 1 1 14 6787 1 1 5 TYR CD1 C -6.502 6.473 -1.845 1.00 . A A . 5 TYR CD1 1 1 14 6788 1 1 5 TYR CD2 C -8.594 5.505 -1.263 1.00 . A A . 5 TYR CD2 1 1 14 6789 1 1 5 TYR CE1 C -6.995 6.823 -3.079 1.00 . A A . 5 TYR CE1 1 1 14 6790 1 1 5 TYR CE2 C -9.097 5.858 -2.505 1.00 . A A . 5 TYR CE2 1 1 14 6791 1 1 5 TYR CG C -7.287 5.807 -0.916 1.00 . A A . 5 TYR CG 1 1 14 6792 1 1 5 TYR CZ C -8.292 6.514 -3.405 1.00 . A A . 5 TYR CZ 1 1 14 6793 1 1 5 TYR H H -6.028 2.472 -0.723 1.00 . A A . 5 TYR H 1 1 14 6794 1 1 5 TYR HA H -5.068 4.422 -0.491 1.00 . A A . 5 TYR HA 1 1 14 6795 1 1 5 TYR HB2 H -7.540 5.147 1.074 1.00 . A A . 5 TYR HB2 1 1 14 6796 1 1 5 TYR HB3 H -6.223 6.294 0.842 1.00 . A A . 5 TYR HB3 1 1 14 6797 1 1 5 TYR HD1 H -5.480 6.714 -1.590 1.00 . A A . 5 TYR HD1 1 1 14 6798 1 1 5 TYR HD2 H -9.222 4.989 -0.551 1.00 . A A . 5 TYR HD2 1 1 14 6799 1 1 5 TYR HE1 H -6.363 7.341 -3.785 1.00 . A A . 5 TYR HE1 1 1 14 6800 1 1 5 TYR HE2 H -10.116 5.618 -2.772 1.00 . A A . 5 TYR HE2 1 1 14 6801 1 1 5 TYR HH H -9.675 7.211 -4.531 1.00 . A A . 5 TYR HH 1 1 14 6802 1 1 5 TYR N N -6.338 2.950 0.080 1.00 . A A . 5 TYR N 1 1 14 6803 1 1 5 TYR O O -4.318 5.292 2.027 1.00 . A A . 5 TYR O 1 1 14 6804 1 1 5 TYR OH O -8.784 6.854 -4.649 1.00 . A A . 5 TYR OH 1 1 14 6805 1 1 6 GLY C C -2.117 2.588 2.593 1.00 . A A . 6 GLY C 1 1 14 6806 1 1 6 GLY CA C -3.473 2.986 3.142 1.00 . A A . 6 GLY CA 1 1 14 6807 1 1 6 GLY H H -4.852 2.258 1.720 1.00 . A A . 6 GLY H 1 1 14 6808 1 1 6 GLY HA2 H -3.398 3.944 3.633 1.00 . A A . 6 GLY HA2 1 1 14 6809 1 1 6 GLY HA3 H -3.794 2.239 3.852 1.00 . A A . 6 GLY HA3 1 1 14 6810 1 1 6 GLY N N -4.439 3.077 2.067 1.00 . A A . 6 GLY N 1 1 14 6811 1 1 6 GLY O O -2.032 2.164 1.419 1.00 . A A . 6 GLY O 1 1 14 6812 1 1 7 GLN C C 0.406 0.817 3.060 1.00 . A A . 7 GLN C 1 1 14 6813 1 1 7 GLN CA C 0.271 2.336 2.996 1.00 . A A . 7 GLN CA 1 1 14 6814 1 1 7 GLN CB C 1.339 3.017 3.872 1.00 . A A . 7 GLN CB 1 1 14 6815 1 1 7 GLN CD C 3.812 3.340 4.394 1.00 . A A . 7 GLN CD 1 1 14 6816 1 1 7 GLN CG C 2.786 2.677 3.485 1.00 . A A . 7 GLN CG 1 1 14 6817 1 1 7 GLN H H -1.213 3.071 4.308 1.00 . A A . 7 GLN H 1 1 14 6818 1 1 7 GLN HA H 0.400 2.645 1.969 1.00 . A A . 7 GLN HA 1 1 14 6819 1 1 7 GLN HB2 H 1.212 4.087 3.802 1.00 . A A . 7 GLN HB2 1 1 14 6820 1 1 7 GLN HB3 H 1.184 2.716 4.898 1.00 . A A . 7 GLN HB3 1 1 14 6821 1 1 7 GLN HE21 H 5.200 3.426 2.939 1.00 . A A . 7 GLN HE21 1 1 14 6822 1 1 7 GLN HE22 H 5.662 4.020 4.460 1.00 . A A . 7 GLN HE22 1 1 14 6823 1 1 7 GLN HG2 H 2.917 1.608 3.544 1.00 . A A . 7 GLN HG2 1 1 14 6824 1 1 7 GLN HG3 H 2.960 3.002 2.469 1.00 . A A . 7 GLN HG3 1 1 14 6825 1 1 7 GLN N N -1.075 2.721 3.400 1.00 . A A . 7 GLN N 1 1 14 6826 1 1 7 GLN NE2 N 4.978 3.619 3.876 1.00 . A A . 7 GLN NE2 1 1 14 6827 1 1 7 GLN O O 0.422 0.235 4.134 1.00 . A A . 7 GLN O 1 1 14 6828 1 1 7 GLN OE1 O 3.548 3.595 5.567 1.00 . A A . 7 GLN OE1 1 1 14 6829 1 1 8 CYS C C 1.922 -1.813 1.988 1.00 . A A . 8 CYS C 1 1 14 6830 1 1 8 CYS CA C 0.532 -1.248 1.807 1.00 . A A . 8 CYS CA 1 1 14 6831 1 1 8 CYS CB C -0.031 -1.681 0.473 1.00 . A A . 8 CYS CB 1 1 14 6832 1 1 8 CYS H H 0.492 0.747 1.093 1.00 . A A . 8 CYS H 1 1 14 6833 1 1 8 CYS HA H -0.108 -1.651 2.578 1.00 . A A . 8 CYS HA 1 1 14 6834 1 1 8 CYS HB2 H 0.164 -2.735 0.331 1.00 . A A . 8 CYS HB2 1 1 14 6835 1 1 8 CYS HB3 H -1.097 -1.513 0.467 1.00 . A A . 8 CYS HB3 1 1 14 6836 1 1 8 CYS N N 0.484 0.202 1.911 1.00 . A A . 8 CYS N 1 1 14 6837 1 1 8 CYS O O 2.085 -2.893 2.507 1.00 . A A . 8 CYS O 1 1 14 6838 1 1 8 CYS SG S 0.683 -0.784 -0.944 1.00 . A A . 8 CYS SG 1 1 14 6839 1 1 9 GLY C C 5.240 -0.985 0.814 1.00 . A A . 9 GLY C 1 1 14 6840 1 1 9 GLY CA C 4.244 -1.636 1.699 1.00 . A A . 9 GLY CA 1 1 14 6841 1 1 9 GLY H H 2.759 -0.230 1.139 1.00 . A A . 9 GLY H 1 1 14 6842 1 1 9 GLY HA2 H 4.559 -1.517 2.724 1.00 . A A . 9 GLY HA2 1 1 14 6843 1 1 9 GLY HA3 H 4.210 -2.690 1.469 1.00 . A A . 9 GLY HA3 1 1 14 6844 1 1 9 GLY N N 2.925 -1.098 1.556 1.00 . A A . 9 GLY N 1 1 14 6845 1 1 9 GLY O O 5.360 -1.325 -0.369 1.00 . A A . 9 GLY O 1 1 14 6846 1 1 10 GLY C C 8.234 0.293 1.363 1.00 . A A . 10 GLY C 1 1 14 6847 1 1 10 GLY CA C 6.967 0.616 0.651 1.00 . A A . 10 GLY CA 1 1 14 6848 1 1 10 GLY H H 5.667 0.303 2.242 1.00 . A A . 10 GLY H 1 1 14 6849 1 1 10 GLY HA2 H 7.004 0.226 -0.355 1.00 . A A . 10 GLY HA2 1 1 14 6850 1 1 10 GLY HA3 H 6.830 1.687 0.634 1.00 . A A . 10 GLY HA3 1 1 14 6851 1 1 10 GLY N N 5.886 -0.002 1.339 1.00 . A A . 10 GLY N 1 1 14 6852 1 1 10 GLY O O 8.224 -0.552 2.272 1.00 . A A . 10 GLY O 1 1 14 6853 1 1 11 ILE C C 10.384 1.199 3.145 1.00 . A A . 11 ILE C 1 1 14 6854 1 1 11 ILE CA C 10.568 0.750 1.695 1.00 . A A . 11 ILE CA 1 1 14 6855 1 1 11 ILE CB C 11.721 1.567 1.035 1.00 . A A . 11 ILE CB 1 1 14 6856 1 1 11 ILE CD1 C 12.953 1.939 -1.188 1.00 . A A . 11 ILE CD1 1 1 14 6857 1 1 11 ILE CG1 C 11.903 1.143 -0.432 1.00 . A A . 11 ILE CG1 1 1 14 6858 1 1 11 ILE CG2 C 13.030 1.385 1.815 1.00 . A A . 11 ILE CG2 1 1 14 6859 1 1 11 ILE H H 9.274 1.566 0.241 1.00 . A A . 11 ILE H 1 1 14 6860 1 1 11 ILE HA H 10.813 -0.303 1.676 1.00 . A A . 11 ILE HA 1 1 14 6861 1 1 11 ILE HB H 11.452 2.613 1.066 1.00 . A A . 11 ILE HB 1 1 14 6862 1 1 11 ILE HD11 H 12.675 2.984 -1.196 1.00 . A A . 11 ILE HD11 1 1 14 6863 1 1 11 ILE HD12 H 13.015 1.574 -2.202 1.00 . A A . 11 ILE HD12 1 1 14 6864 1 1 11 ILE HD13 H 13.909 1.823 -0.701 1.00 . A A . 11 ILE HD13 1 1 14 6865 1 1 11 ILE HG12 H 12.196 0.104 -0.463 1.00 . A A . 11 ILE HG12 1 1 14 6866 1 1 11 ILE HG13 H 10.961 1.258 -0.949 1.00 . A A . 11 ILE HG13 1 1 14 6867 1 1 11 ILE HG21 H 13.303 0.340 1.824 1.00 . A A . 11 ILE HG21 1 1 14 6868 1 1 11 ILE HG22 H 12.896 1.730 2.829 1.00 . A A . 11 ILE HG22 1 1 14 6869 1 1 11 ILE HG23 H 13.813 1.959 1.340 1.00 . A A . 11 ILE HG23 1 1 14 6870 1 1 11 ILE N N 9.313 0.939 0.996 1.00 . A A . 11 ILE N 1 1 14 6871 1 1 11 ILE O O 9.976 2.326 3.400 1.00 . A A . 11 ILE O 1 1 14 6872 1 1 12 GLY C C 9.168 0.126 6.053 1.00 . A A . 12 GLY C 1 1 14 6873 1 1 12 GLY CA C 10.449 0.644 5.456 1.00 . A A . 12 GLY CA 1 1 14 6874 1 1 12 GLY H H 10.749 -0.641 3.824 1.00 . A A . 12 GLY H 1 1 14 6875 1 1 12 GLY HA2 H 11.284 0.228 5.998 1.00 . A A . 12 GLY HA2 1 1 14 6876 1 1 12 GLY HA3 H 10.465 1.720 5.550 1.00 . A A . 12 GLY HA3 1 1 14 6877 1 1 12 GLY N N 10.568 0.294 4.069 1.00 . A A . 12 GLY N 1 1 14 6878 1 1 12 GLY O O 9.029 0.054 7.277 1.00 . A A . 12 GLY O 1 1 14 6879 1 1 13 TYR C C 7.005 -2.263 5.424 1.00 . A A . 13 TYR C 1 1 14 6880 1 1 13 TYR CA C 6.987 -0.780 5.669 1.00 . A A . 13 TYR CA 1 1 14 6881 1 1 13 TYR CB C 5.792 -0.134 4.941 1.00 . A A . 13 TYR CB 1 1 14 6882 1 1 13 TYR CD1 C 3.715 0.327 6.310 1.00 . A A . 13 TYR CD1 1 1 14 6883 1 1 13 TYR CD2 C 3.862 -1.783 5.226 1.00 . A A . 13 TYR CD2 1 1 14 6884 1 1 13 TYR CE1 C 2.489 -0.028 6.836 1.00 . A A . 13 TYR CE1 1 1 14 6885 1 1 13 TYR CE2 C 2.639 -2.143 5.745 1.00 . A A . 13 TYR CE2 1 1 14 6886 1 1 13 TYR CG C 4.426 -0.536 5.499 1.00 . A A . 13 TYR CG 1 1 14 6887 1 1 13 TYR CZ C 1.958 -1.263 6.548 1.00 . A A . 13 TYR CZ 1 1 14 6888 1 1 13 TYR H H 8.405 -0.195 4.242 1.00 . A A . 13 TYR H 1 1 14 6889 1 1 13 TYR HA H 6.909 -0.596 6.728 1.00 . A A . 13 TYR HA 1 1 14 6890 1 1 13 TYR HB2 H 5.876 0.941 5.012 1.00 . A A . 13 TYR HB2 1 1 14 6891 1 1 13 TYR HB3 H 5.830 -0.422 3.902 1.00 . A A . 13 TYR HB3 1 1 14 6892 1 1 13 TYR HD1 H 4.132 1.298 6.535 1.00 . A A . 13 TYR HD1 1 1 14 6893 1 1 13 TYR HD2 H 4.399 -2.476 4.597 1.00 . A A . 13 TYR HD2 1 1 14 6894 1 1 13 TYR HE1 H 1.952 0.663 7.468 1.00 . A A . 13 TYR HE1 1 1 14 6895 1 1 13 TYR HE2 H 2.219 -3.112 5.520 1.00 . A A . 13 TYR HE2 1 1 14 6896 1 1 13 TYR HH H 0.107 -0.932 6.880 1.00 . A A . 13 TYR HH 1 1 14 6897 1 1 13 TYR N N 8.236 -0.245 5.209 1.00 . A A . 13 TYR N 1 1 14 6898 1 1 13 TYR O O 7.165 -2.710 4.285 1.00 . A A . 13 TYR O 1 1 14 6899 1 1 13 TYR OH O 0.748 -1.624 7.082 1.00 . A A . 13 TYR OH 1 1 14 6900 1 1 14 SER C C 5.698 -4.950 7.191 1.00 . A A . 14 SER C 1 1 14 6901 1 1 14 SER CA C 6.853 -4.439 6.361 1.00 . A A . 14 SER CA 1 1 14 6902 1 1 14 SER CB C 8.182 -4.970 6.906 1.00 . A A . 14 SER CB 1 1 14 6903 1 1 14 SER H H 6.703 -2.612 7.345 1.00 . A A . 14 SER H 1 1 14 6904 1 1 14 SER HA H 6.738 -4.730 5.328 1.00 . A A . 14 SER HA 1 1 14 6905 1 1 14 SER HB2 H 8.117 -5.040 7.983 1.00 . A A . 14 SER HB2 1 1 14 6906 1 1 14 SER HB3 H 8.374 -5.947 6.485 1.00 . A A . 14 SER HB3 1 1 14 6907 1 1 14 SER N N 6.845 -3.012 6.461 1.00 . A A . 14 SER N 1 1 14 6908 1 1 14 SER O O 5.603 -4.624 8.376 1.00 . A A . 14 SER O 1 1 14 6909 1 1 14 SER OG O 9.272 -4.071 6.545 1.00 . A A . 14 SER OG 1 1 14 6910 1 1 15 GLY C C 2.538 -6.530 6.369 1.00 . A A . 15 GLY C 1 1 14 6911 1 1 15 GLY CA C 3.657 -6.161 7.311 1.00 . A A . 15 GLY CA 1 1 14 6912 1 1 15 GLY H H 4.931 -5.987 5.661 1.00 . A A . 15 GLY H 1 1 14 6913 1 1 15 GLY HA2 H 3.935 -7.024 7.898 1.00 . A A . 15 GLY HA2 1 1 14 6914 1 1 15 GLY HA3 H 3.329 -5.371 7.968 1.00 . A A . 15 GLY HA3 1 1 14 6915 1 1 15 GLY N N 4.813 -5.704 6.594 1.00 . A A . 15 GLY N 1 1 14 6916 1 1 15 GLY O O 2.754 -7.347 5.467 1.00 . A A . 15 GLY O 1 1 14 6917 1 1 16 PRO C C 0.384 -5.590 4.292 1.00 . A A . 16 PRO C 1 1 14 6918 1 1 16 PRO CA C 0.201 -6.251 5.657 1.00 . A A . 16 PRO CA 1 1 14 6919 1 1 16 PRO CB C -1.021 -5.664 6.389 1.00 . A A . 16 PRO CB 1 1 14 6920 1 1 16 PRO CD C 0.947 -5.021 7.596 1.00 . A A . 16 PRO CD 1 1 14 6921 1 1 16 PRO CG C -0.525 -5.267 7.742 1.00 . A A . 16 PRO CG 1 1 14 6922 1 1 16 PRO HA H 0.084 -7.316 5.532 1.00 . A A . 16 PRO HA 1 1 14 6923 1 1 16 PRO HB2 H -1.387 -4.808 5.841 1.00 . A A . 16 PRO HB2 1 1 14 6924 1 1 16 PRO HB3 H -1.800 -6.409 6.458 1.00 . A A . 16 PRO HB3 1 1 14 6925 1 1 16 PRO HD2 H 1.135 -4.000 7.297 1.00 . A A . 16 PRO HD2 1 1 14 6926 1 1 16 PRO HD3 H 1.448 -5.250 8.524 1.00 . A A . 16 PRO HD3 1 1 14 6927 1 1 16 PRO HG2 H -1.023 -4.366 8.070 1.00 . A A . 16 PRO HG2 1 1 14 6928 1 1 16 PRO HG3 H -0.702 -6.069 8.443 1.00 . A A . 16 PRO HG3 1 1 14 6929 1 1 16 PRO N N 1.327 -5.970 6.540 1.00 . A A . 16 PRO N 1 1 14 6930 1 1 16 PRO O O 0.111 -4.414 4.118 1.00 . A A . 16 PRO O 1 1 14 6931 1 1 17 THR C C 0.109 -6.211 1.010 1.00 . A A . 17 THR C 1 1 14 6932 1 1 17 THR CA C 1.184 -5.848 2.040 1.00 . A A . 17 THR CA 1 1 14 6933 1 1 17 THR CB C 2.559 -6.374 1.588 1.00 . A A . 17 THR CB 1 1 14 6934 1 1 17 THR CG2 C 3.681 -5.691 2.359 1.00 . A A . 17 THR CG2 1 1 14 6935 1 1 17 THR H H 1.099 -7.281 3.553 1.00 . A A . 17 THR H 1 1 14 6936 1 1 17 THR HA H 1.252 -4.773 2.105 1.00 . A A . 17 THR HA 1 1 14 6937 1 1 17 THR HB H 2.675 -6.177 0.532 1.00 . A A . 17 THR HB 1 1 14 6938 1 1 17 THR HG1 H 3.512 -8.084 1.550 1.00 . A A . 17 THR HG1 1 1 14 6939 1 1 17 THR HG21 H 3.622 -4.623 2.206 1.00 . A A . 17 THR HG21 1 1 14 6940 1 1 17 THR HG22 H 4.637 -6.047 2.007 1.00 . A A . 17 THR HG22 1 1 14 6941 1 1 17 THR HG23 H 3.582 -5.907 3.412 1.00 . A A . 17 THR HG23 1 1 14 6942 1 1 17 THR N N 0.884 -6.348 3.355 1.00 . A A . 17 THR N 1 1 14 6943 1 1 17 THR O O 0.104 -5.692 -0.117 1.00 . A A . 17 THR O 1 1 14 6944 1 1 17 THR OG1 O 2.625 -7.806 1.810 1.00 . A A . 17 THR OG1 1 1 14 6945 1 1 18 VAL C C -3.038 -6.595 0.619 1.00 . A A . 18 VAL C 1 1 14 6946 1 1 18 VAL CA C -1.844 -7.513 0.475 1.00 . A A . 18 VAL CA 1 1 14 6947 1 1 18 VAL CB C -2.269 -8.989 0.733 1.00 . A A . 18 VAL CB 1 1 14 6948 1 1 18 VAL CG1 C -3.370 -9.425 -0.230 1.00 . A A . 18 VAL CG1 1 1 14 6949 1 1 18 VAL CG2 C -1.067 -9.917 0.612 1.00 . A A . 18 VAL CG2 1 1 14 6950 1 1 18 VAL H H -0.798 -7.411 2.305 1.00 . A A . 18 VAL H 1 1 14 6951 1 1 18 VAL HA H -1.460 -7.424 -0.530 1.00 . A A . 18 VAL HA 1 1 14 6952 1 1 18 VAL HB H -2.656 -9.063 1.738 1.00 . A A . 18 VAL HB 1 1 14 6953 1 1 18 VAL HG11 H -3.643 -10.449 -0.025 1.00 . A A . 18 VAL HG11 1 1 14 6954 1 1 18 VAL HG12 H -3.010 -9.344 -1.245 1.00 . A A . 18 VAL HG12 1 1 14 6955 1 1 18 VAL HG13 H -4.233 -8.788 -0.106 1.00 . A A . 18 VAL HG13 1 1 14 6956 1 1 18 VAL HG21 H -1.372 -10.934 0.806 1.00 . A A . 18 VAL HG21 1 1 14 6957 1 1 18 VAL HG22 H -0.312 -9.623 1.325 1.00 . A A . 18 VAL HG22 1 1 14 6958 1 1 18 VAL HG23 H -0.661 -9.847 -0.387 1.00 . A A . 18 VAL HG23 1 1 14 6959 1 1 18 VAL N N -0.802 -7.080 1.383 1.00 . A A . 18 VAL N 1 1 14 6960 1 1 18 VAL O O -3.656 -6.532 1.674 1.00 . A A . 18 VAL O 1 1 14 6961 1 1 19 CYS C C -5.768 -5.617 -0.474 1.00 . A A . 19 CYS C 1 1 14 6962 1 1 19 CYS CA C -4.426 -4.925 -0.384 1.00 . A A . 19 CYS CA 1 1 14 6963 1 1 19 CYS CB C -4.268 -3.910 -1.489 1.00 . A A . 19 CYS CB 1 1 14 6964 1 1 19 CYS H H -2.811 -5.961 -1.237 1.00 . A A . 19 CYS H 1 1 14 6965 1 1 19 CYS HA H -4.377 -4.406 0.562 1.00 . A A . 19 CYS HA 1 1 14 6966 1 1 19 CYS HB2 H -4.291 -4.403 -2.449 1.00 . A A . 19 CYS HB2 1 1 14 6967 1 1 19 CYS HB3 H -5.075 -3.194 -1.431 1.00 . A A . 19 CYS HB3 1 1 14 6968 1 1 19 CYS N N -3.334 -5.868 -0.414 1.00 . A A . 19 CYS N 1 1 14 6969 1 1 19 CYS O O -5.860 -6.777 -0.919 1.00 . A A . 19 CYS O 1 1 14 6970 1 1 19 CYS SG S -2.725 -2.984 -1.371 1.00 . A A . 19 CYS SG 1 1 14 6971 1 1 20 ALA C C -8.685 -5.679 -1.436 1.00 . A A . 20 ALA C 1 1 14 6972 1 1 20 ALA CA C -8.154 -5.399 -0.026 1.00 . A A . 20 ALA CA 1 1 14 6973 1 1 20 ALA CB C -9.042 -4.413 0.709 1.00 . A A . 20 ALA CB 1 1 14 6974 1 1 20 ALA H H -6.629 -3.999 0.289 1.00 . A A . 20 ALA H 1 1 14 6975 1 1 20 ALA HA H -8.158 -6.325 0.530 1.00 . A A . 20 ALA HA 1 1 14 6976 1 1 20 ALA HB1 H -8.635 -4.221 1.690 1.00 . A A . 20 ALA HB1 1 1 14 6977 1 1 20 ALA HB2 H -10.033 -4.831 0.809 1.00 . A A . 20 ALA HB2 1 1 14 6978 1 1 20 ALA HB3 H -9.092 -3.490 0.150 1.00 . A A . 20 ALA HB3 1 1 14 6979 1 1 20 ALA N N -6.793 -4.908 -0.042 1.00 . A A . 20 ALA N 1 1 14 6980 1 1 20 ALA O O -8.059 -5.289 -2.451 1.00 . A A . 20 ALA O 1 1 14 6981 1 1 21 SER C C -10.746 -5.525 -3.627 1.00 . A A . 21 SER C 1 1 14 6982 1 1 21 SER CA C -10.438 -6.731 -2.735 1.00 . A A . 21 SER CA 1 1 14 6983 1 1 21 SER CB C -11.710 -7.543 -2.454 1.00 . A A . 21 SER CB 1 1 14 6984 1 1 21 SER H H -10.318 -6.496 -0.658 1.00 . A A . 21 SER H 1 1 14 6985 1 1 21 SER HA H -9.732 -7.368 -3.247 1.00 . A A . 21 SER HA 1 1 14 6986 1 1 21 SER HB2 H -11.488 -8.311 -1.730 1.00 . A A . 21 SER HB2 1 1 14 6987 1 1 21 SER HB3 H -12.467 -6.885 -2.053 1.00 . A A . 21 SER HB3 1 1 14 6988 1 1 21 SER HG H -12.475 -9.053 -3.397 1.00 . A A . 21 SER HG 1 1 14 6989 1 1 21 SER N N -9.836 -6.314 -1.493 1.00 . A A . 21 SER N 1 1 14 6990 1 1 21 SER O O -11.462 -4.593 -3.230 1.00 . A A . 21 SER O 1 1 14 6991 1 1 21 SER OG O -12.215 -8.154 -3.634 1.00 . A A . 21 SER OG 1 1 14 6992 1 1 22 GLY C C -9.256 -3.477 -5.749 1.00 . A A . 22 GLY C 1 1 14 6993 1 1 22 GLY CA C -10.374 -4.482 -5.738 1.00 . A A . 22 GLY CA 1 1 14 6994 1 1 22 GLY H H -9.543 -6.256 -5.029 1.00 . A A . 22 GLY H 1 1 14 6995 1 1 22 GLY HA2 H -10.473 -4.915 -6.721 1.00 . A A . 22 GLY HA2 1 1 14 6996 1 1 22 GLY HA3 H -11.295 -3.976 -5.487 1.00 . A A . 22 GLY HA3 1 1 14 6997 1 1 22 GLY N N -10.154 -5.524 -4.794 1.00 . A A . 22 GLY N 1 1 14 6998 1 1 22 GLY O O -9.182 -2.634 -6.644 1.00 . A A . 22 GLY O 1 1 14 6999 1 1 23 THR C C -5.930 -3.174 -4.950 1.00 . A A . 23 THR C 1 1 14 7000 1 1 23 THR CA C -7.313 -2.582 -4.683 1.00 . A A . 23 THR CA 1 1 14 7001 1 1 23 THR CB C -7.363 -1.868 -3.303 1.00 . A A . 23 THR CB 1 1 14 7002 1 1 23 THR CG2 C -8.739 -1.282 -3.080 1.00 . A A . 23 THR CG2 1 1 14 7003 1 1 23 THR H H -8.369 -4.337 -4.177 1.00 . A A . 23 THR H 1 1 14 7004 1 1 23 THR HA H -7.504 -1.842 -5.448 1.00 . A A . 23 THR HA 1 1 14 7005 1 1 23 THR HB H -6.641 -1.066 -3.286 1.00 . A A . 23 THR HB 1 1 14 7006 1 1 23 THR HG1 H -7.437 -3.663 -2.481 1.00 . A A . 23 THR HG1 1 1 14 7007 1 1 23 THR HG21 H -8.769 -0.788 -2.120 1.00 . A A . 23 THR HG21 1 1 14 7008 1 1 23 THR HG22 H -9.471 -2.073 -3.104 1.00 . A A . 23 THR HG22 1 1 14 7009 1 1 23 THR HG23 H -8.956 -0.565 -3.857 1.00 . A A . 23 THR HG23 1 1 14 7010 1 1 23 THR N N -8.354 -3.574 -4.795 1.00 . A A . 23 THR N 1 1 14 7011 1 1 23 THR O O -5.663 -4.347 -4.626 1.00 . A A . 23 THR O 1 1 14 7012 1 1 23 THR OG1 O -7.099 -2.789 -2.236 1.00 . A A . 23 THR OG1 1 1 14 7013 1 1 24 THR C C -2.688 -1.981 -5.123 1.00 . A A . 24 THR C 1 1 14 7014 1 1 24 THR CA C -3.729 -2.809 -5.877 1.00 . A A . 24 THR CA 1 1 14 7015 1 1 24 THR CB C -3.473 -2.718 -7.404 1.00 . A A . 24 THR CB 1 1 14 7016 1 1 24 THR CG2 C -4.242 -3.797 -8.152 1.00 . A A . 24 THR CG2 1 1 14 7017 1 1 24 THR H H -5.344 -1.458 -5.775 1.00 . A A . 24 THR H 1 1 14 7018 1 1 24 THR HA H -3.632 -3.842 -5.578 1.00 . A A . 24 THR HA 1 1 14 7019 1 1 24 THR HB H -2.415 -2.856 -7.573 1.00 . A A . 24 THR HB 1 1 14 7020 1 1 24 THR HG1 H -4.692 -1.150 -7.496 1.00 . A A . 24 THR HG1 1 1 14 7021 1 1 24 THR HG21 H -5.300 -3.674 -7.970 1.00 . A A . 24 THR HG21 1 1 14 7022 1 1 24 THR HG22 H -3.926 -4.770 -7.804 1.00 . A A . 24 THR HG22 1 1 14 7023 1 1 24 THR HG23 H -4.046 -3.714 -9.211 1.00 . A A . 24 THR HG23 1 1 14 7024 1 1 24 THR N N -5.068 -2.381 -5.549 1.00 . A A . 24 THR N 1 1 14 7025 1 1 24 THR O O -2.810 -0.763 -5.030 1.00 . A A . 24 THR O 1 1 14 7026 1 1 24 THR OG1 O -3.852 -1.412 -7.902 1.00 . A A . 24 THR OG1 1 1 14 7027 1 1 25 CYS C C 0.300 -1.324 -4.871 1.00 . A A . 25 CYS C 1 1 14 7028 1 1 25 CYS CA C -0.616 -1.966 -3.856 1.00 . A A . 25 CYS CA 1 1 14 7029 1 1 25 CYS CB C 0.179 -2.963 -2.995 1.00 . A A . 25 CYS CB 1 1 14 7030 1 1 25 CYS H H -1.696 -3.624 -4.593 1.00 . A A . 25 CYS H 1 1 14 7031 1 1 25 CYS HA H -1.039 -1.202 -3.221 1.00 . A A . 25 CYS HA 1 1 14 7032 1 1 25 CYS HB2 H -0.490 -3.418 -2.279 1.00 . A A . 25 CYS HB2 1 1 14 7033 1 1 25 CYS HB3 H 0.585 -3.733 -3.634 1.00 . A A . 25 CYS HB3 1 1 14 7034 1 1 25 CYS N N -1.701 -2.644 -4.556 1.00 . A A . 25 CYS N 1 1 14 7035 1 1 25 CYS O O 1.029 -2.015 -5.572 1.00 . A A . 25 CYS O 1 1 14 7036 1 1 25 CYS SG S 1.565 -2.229 -2.052 1.00 . A A . 25 CYS SG 1 1 14 7037 1 1 26 GLN C C 2.024 1.568 -5.299 1.00 . A A . 26 GLN C 1 1 14 7038 1 1 26 GLN CA C 1.032 0.657 -5.967 1.00 . A A . 26 GLN CA 1 1 14 7039 1 1 26 GLN CB C 0.165 1.443 -6.929 1.00 . A A . 26 GLN CB 1 1 14 7040 1 1 26 GLN CD C -1.593 1.387 -8.713 1.00 . A A . 26 GLN CD 1 1 14 7041 1 1 26 GLN CG C -0.807 0.589 -7.714 1.00 . A A . 26 GLN CG 1 1 14 7042 1 1 26 GLN H H -0.391 0.491 -4.437 1.00 . A A . 26 GLN H 1 1 14 7043 1 1 26 GLN HA H 1.573 -0.087 -6.532 1.00 . A A . 26 GLN HA 1 1 14 7044 1 1 26 GLN HB2 H -0.400 2.168 -6.362 1.00 . A A . 26 GLN HB2 1 1 14 7045 1 1 26 GLN HB3 H 0.807 1.961 -7.625 1.00 . A A . 26 GLN HB3 1 1 14 7046 1 1 26 GLN HE21 H -3.132 0.188 -8.460 1.00 . A A . 26 GLN HE21 1 1 14 7047 1 1 26 GLN HE22 H -3.362 1.477 -9.587 1.00 . A A . 26 GLN HE22 1 1 14 7048 1 1 26 GLN HG2 H -0.252 -0.173 -8.242 1.00 . A A . 26 GLN HG2 1 1 14 7049 1 1 26 GLN HG3 H -1.493 0.121 -7.025 1.00 . A A . 26 GLN HG3 1 1 14 7050 1 1 26 GLN N N 0.226 -0.032 -5.000 1.00 . A A . 26 GLN N 1 1 14 7051 1 1 26 GLN NE2 N -2.809 0.983 -8.946 1.00 . A A . 26 GLN NE2 1 1 14 7052 1 1 26 GLN O O 1.718 2.219 -4.295 1.00 . A A . 26 GLN O 1 1 14 7053 1 1 26 GLN OE1 O -1.108 2.385 -9.260 1.00 . A A . 26 GLN OE1 1 1 14 7054 1 1 27 VAL C C 4.012 3.882 -5.803 1.00 . A A . 27 VAL C 1 1 14 7055 1 1 27 VAL CA C 4.263 2.446 -5.354 1.00 . A A . 27 VAL CA 1 1 14 7056 1 1 27 VAL CB C 5.645 1.951 -5.871 1.00 . A A . 27 VAL CB 1 1 14 7057 1 1 27 VAL CG1 C 6.772 2.871 -5.431 1.00 . A A . 27 VAL CG1 1 1 14 7058 1 1 27 VAL CG2 C 5.910 0.534 -5.389 1.00 . A A . 27 VAL CG2 1 1 14 7059 1 1 27 VAL H H 3.375 1.072 -6.654 1.00 . A A . 27 VAL H 1 1 14 7060 1 1 27 VAL HA H 4.245 2.387 -4.275 1.00 . A A . 27 VAL HA 1 1 14 7061 1 1 27 VAL HB H 5.620 1.940 -6.950 1.00 . A A . 27 VAL HB 1 1 14 7062 1 1 27 VAL HG11 H 7.716 2.484 -5.784 1.00 . A A . 27 VAL HG11 1 1 14 7063 1 1 27 VAL HG12 H 6.784 2.936 -4.354 1.00 . A A . 27 VAL HG12 1 1 14 7064 1 1 27 VAL HG13 H 6.614 3.857 -5.842 1.00 . A A . 27 VAL HG13 1 1 14 7065 1 1 27 VAL HG21 H 5.926 0.521 -4.310 1.00 . A A . 27 VAL HG21 1 1 14 7066 1 1 27 VAL HG22 H 6.860 0.193 -5.770 1.00 . A A . 27 VAL HG22 1 1 14 7067 1 1 27 VAL HG23 H 5.122 -0.117 -5.740 1.00 . A A . 27 VAL HG23 1 1 14 7068 1 1 27 VAL N N 3.204 1.611 -5.853 1.00 . A A . 27 VAL N 1 1 14 7069 1 1 27 VAL O O 4.045 4.186 -7.002 1.00 . A A . 27 VAL O 1 1 14 7070 1 1 28 LEU C C 4.730 6.938 -4.976 1.00 . A A . 28 LEU C 1 1 14 7071 1 1 28 LEU CA C 3.440 6.136 -5.174 1.00 . A A . 28 LEU CA 1 1 14 7072 1 1 28 LEU CB C 2.298 6.636 -4.250 1.00 . A A . 28 LEU CB 1 1 14 7073 1 1 28 LEU CD1 C 0.247 8.022 -3.803 1.00 . A A . 28 LEU CD1 1 1 14 7074 1 1 28 LEU CD2 C 2.224 9.134 -4.799 1.00 . A A . 28 LEU CD2 1 1 14 7075 1 1 28 LEU CG C 1.432 7.835 -4.732 1.00 . A A . 28 LEU CG 1 1 14 7076 1 1 28 LEU H H 3.733 4.448 -3.927 1.00 . A A . 28 LEU H 1 1 14 7077 1 1 28 LEU HA H 3.132 6.200 -6.208 1.00 . A A . 28 LEU HA 1 1 14 7078 1 1 28 LEU HB2 H 1.638 5.806 -4.047 1.00 . A A . 28 LEU HB2 1 1 14 7079 1 1 28 LEU HB3 H 2.762 6.918 -3.318 1.00 . A A . 28 LEU HB3 1 1 14 7080 1 1 28 LEU HD11 H -0.347 8.854 -4.149 1.00 . A A . 28 LEU HD11 1 1 14 7081 1 1 28 LEU HD12 H 0.606 8.231 -2.807 1.00 . A A . 28 LEU HD12 1 1 14 7082 1 1 28 LEU HD13 H -0.352 7.124 -3.794 1.00 . A A . 28 LEU HD13 1 1 14 7083 1 1 28 LEU HD21 H 2.602 9.377 -3.818 1.00 . A A . 28 LEU HD21 1 1 14 7084 1 1 28 LEU HD22 H 1.580 9.930 -5.143 1.00 . A A . 28 LEU HD22 1 1 14 7085 1 1 28 LEU HD23 H 3.050 9.014 -5.485 1.00 . A A . 28 LEU HD23 1 1 14 7086 1 1 28 LEU HG H 1.044 7.610 -5.715 1.00 . A A . 28 LEU HG 1 1 14 7087 1 1 28 LEU N N 3.729 4.749 -4.863 1.00 . A A . 28 LEU N 1 1 14 7088 1 1 28 LEU O O 5.020 7.888 -5.715 1.00 . A A . 28 LEU O 1 1 14 7089 1 1 29 ASN C C 7.657 5.929 -3.245 1.00 . A A . 29 ASN C 1 1 14 7090 1 1 29 ASN CA C 6.787 7.093 -3.662 1.00 . A A . 29 ASN CA 1 1 14 7091 1 1 29 ASN CB C 6.685 8.097 -2.485 1.00 . A A . 29 ASN CB 1 1 14 7092 1 1 29 ASN CG C 5.866 9.332 -2.770 1.00 . A A . 29 ASN CG 1 1 14 7093 1 1 29 ASN H H 5.227 5.741 -3.459 1.00 . A A . 29 ASN H 1 1 14 7094 1 1 29 ASN HA H 7.198 7.572 -4.540 1.00 . A A . 29 ASN HA 1 1 14 7095 1 1 29 ASN HB2 H 6.272 7.605 -1.620 1.00 . A A . 29 ASN HB2 1 1 14 7096 1 1 29 ASN HB3 H 7.688 8.414 -2.242 1.00 . A A . 29 ASN HB3 1 1 14 7097 1 1 29 ASN HD21 H 4.259 8.520 -1.948 1.00 . A A . 29 ASN HD21 1 1 14 7098 1 1 29 ASN HD22 H 4.077 10.126 -2.558 1.00 . A A . 29 ASN HD22 1 1 14 7099 1 1 29 ASN N N 5.497 6.519 -3.998 1.00 . A A . 29 ASN N 1 1 14 7100 1 1 29 ASN ND2 N 4.611 9.318 -2.392 1.00 . A A . 29 ASN ND2 1 1 14 7101 1 1 29 ASN O O 7.113 4.855 -3.011 1.00 . A A . 29 ASN O 1 1 14 7102 1 1 29 ASN OD1 O 6.377 10.313 -3.292 1.00 . A A . 29 ASN OD1 1 1 14 7103 1 1 30 PRO C C 9.452 4.296 -1.435 1.00 . A A . 30 PRO C 1 1 14 7104 1 1 30 PRO CA C 9.885 4.978 -2.743 1.00 . A A . 30 PRO CA 1 1 14 7105 1 1 30 PRO CB C 11.245 5.654 -2.577 1.00 . A A . 30 PRO CB 1 1 14 7106 1 1 30 PRO CD C 9.766 7.319 -3.419 1.00 . A A . 30 PRO CD 1 1 14 7107 1 1 30 PRO CG C 11.180 6.828 -3.484 1.00 . A A . 30 PRO CG 1 1 14 7108 1 1 30 PRO HA H 9.941 4.234 -3.524 1.00 . A A . 30 PRO HA 1 1 14 7109 1 1 30 PRO HB2 H 11.379 5.948 -1.546 1.00 . A A . 30 PRO HB2 1 1 14 7110 1 1 30 PRO HB3 H 12.031 4.973 -2.869 1.00 . A A . 30 PRO HB3 1 1 14 7111 1 1 30 PRO HD2 H 9.663 8.038 -2.621 1.00 . A A . 30 PRO HD2 1 1 14 7112 1 1 30 PRO HD3 H 9.464 7.753 -4.361 1.00 . A A . 30 PRO HD3 1 1 14 7113 1 1 30 PRO HG2 H 11.861 7.594 -3.146 1.00 . A A . 30 PRO HG2 1 1 14 7114 1 1 30 PRO HG3 H 11.425 6.528 -4.492 1.00 . A A . 30 PRO HG3 1 1 14 7115 1 1 30 PRO N N 8.996 6.085 -3.136 1.00 . A A . 30 PRO N 1 1 14 7116 1 1 30 PRO O O 9.431 3.067 -1.341 1.00 . A A . 30 PRO O 1 1 14 7117 1 1 31 TYR C C 7.134 4.396 0.863 1.00 . A A . 31 TYR C 1 1 14 7118 1 1 31 TYR CA C 8.655 4.488 0.809 1.00 . A A . 31 TYR CA 1 1 14 7119 1 1 31 TYR CB C 9.133 5.346 1.995 1.00 . A A . 31 TYR CB 1 1 14 7120 1 1 31 TYR CD1 C 11.388 6.266 1.248 1.00 . A A . 31 TYR CD1 1 1 14 7121 1 1 31 TYR CD2 C 11.302 4.940 3.212 1.00 . A A . 31 TYR CD2 1 1 14 7122 1 1 31 TYR CE1 C 12.743 6.432 1.420 1.00 . A A . 31 TYR CE1 1 1 14 7123 1 1 31 TYR CE2 C 12.652 5.098 3.384 1.00 . A A . 31 TYR CE2 1 1 14 7124 1 1 31 TYR CG C 10.641 5.512 2.146 1.00 . A A . 31 TYR CG 1 1 14 7125 1 1 31 TYR CZ C 13.368 5.843 2.492 1.00 . A A . 31 TYR CZ 1 1 14 7126 1 1 31 TYR H H 9.090 6.050 -0.555 1.00 . A A . 31 TYR H 1 1 14 7127 1 1 31 TYR HA H 9.086 3.502 0.899 1.00 . A A . 31 TYR HA 1 1 14 7128 1 1 31 TYR HB2 H 8.705 6.331 1.911 1.00 . A A . 31 TYR HB2 1 1 14 7129 1 1 31 TYR HB3 H 8.761 4.897 2.903 1.00 . A A . 31 TYR HB3 1 1 14 7130 1 1 31 TYR HD1 H 10.895 6.726 0.406 1.00 . A A . 31 TYR HD1 1 1 14 7131 1 1 31 TYR HD2 H 10.740 4.349 3.920 1.00 . A A . 31 TYR HD2 1 1 14 7132 1 1 31 TYR HE1 H 13.308 7.019 0.713 1.00 . A A . 31 TYR HE1 1 1 14 7133 1 1 31 TYR HE2 H 13.145 4.635 4.226 1.00 . A A . 31 TYR HE2 1 1 14 7134 1 1 31 TYR HH H 15.105 5.145 2.881 1.00 . A A . 31 TYR HH 1 1 14 7135 1 1 31 TYR N N 9.077 5.074 -0.445 1.00 . A A . 31 TYR N 1 1 14 7136 1 1 31 TYR O O 6.573 3.528 1.534 1.00 . A A . 31 TYR O 1 1 14 7137 1 1 31 TYR OH O 14.721 6.011 2.681 1.00 . A A . 31 TYR OH 1 1 14 7138 1 1 32 TYR C C 4.406 4.403 -0.918 1.00 . A A . 32 TYR C 1 1 14 7139 1 1 32 TYR CA C 5.027 5.251 0.189 1.00 . A A . 32 TYR CA 1 1 14 7140 1 1 32 TYR CB C 4.476 6.671 0.155 1.00 . A A . 32 TYR CB 1 1 14 7141 1 1 32 TYR CD1 C 2.572 6.426 1.774 1.00 . A A . 32 TYR CD1 1 1 14 7142 1 1 32 TYR CD2 C 2.082 7.212 -0.416 1.00 . A A . 32 TYR CD2 1 1 14 7143 1 1 32 TYR CE1 C 1.246 6.527 2.114 1.00 . A A . 32 TYR CE1 1 1 14 7144 1 1 32 TYR CE2 C 0.750 7.312 -0.083 1.00 . A A . 32 TYR CE2 1 1 14 7145 1 1 32 TYR CG C 3.014 6.765 0.506 1.00 . A A . 32 TYR CG 1 1 14 7146 1 1 32 TYR CZ C 0.340 6.968 1.182 1.00 . A A . 32 TYR CZ 1 1 14 7147 1 1 32 TYR H H 6.941 5.885 -0.435 1.00 . A A . 32 TYR H 1 1 14 7148 1 1 32 TYR HA H 4.748 4.812 1.135 1.00 . A A . 32 TYR HA 1 1 14 7149 1 1 32 TYR HB2 H 5.028 7.308 0.827 1.00 . A A . 32 TYR HB2 1 1 14 7150 1 1 32 TYR HB3 H 4.580 7.043 -0.854 1.00 . A A . 32 TYR HB3 1 1 14 7151 1 1 32 TYR HD1 H 3.288 6.077 2.504 1.00 . A A . 32 TYR HD1 1 1 14 7152 1 1 32 TYR HD2 H 2.410 7.482 -1.408 1.00 . A A . 32 TYR HD2 1 1 14 7153 1 1 32 TYR HE1 H 0.921 6.257 3.108 1.00 . A A . 32 TYR HE1 1 1 14 7154 1 1 32 TYR HE2 H 0.031 7.654 -0.812 1.00 . A A . 32 TYR HE2 1 1 14 7155 1 1 32 TYR HH H -1.515 6.920 0.739 1.00 . A A . 32 TYR HH 1 1 14 7156 1 1 32 TYR N N 6.461 5.257 0.143 1.00 . A A . 32 TYR N 1 1 14 7157 1 1 32 TYR O O 4.468 4.753 -2.099 1.00 . A A . 32 TYR O 1 1 14 7158 1 1 32 TYR OH O -0.980 7.086 1.526 1.00 . A A . 32 TYR OH 1 1 14 7159 1 1 33 SER C C 1.599 2.533 -0.952 1.00 . A A . 33 SER C 1 1 14 7160 1 1 33 SER CA C 3.017 2.562 -1.472 1.00 . A A . 33 SER CA 1 1 14 7161 1 1 33 SER CB C 3.591 1.151 -1.588 1.00 . A A . 33 SER CB 1 1 14 7162 1 1 33 SER H H 3.782 3.073 0.394 1.00 . A A . 33 SER H 1 1 14 7163 1 1 33 SER HA H 3.033 3.060 -2.430 1.00 . A A . 33 SER HA 1 1 14 7164 1 1 33 SER HB2 H 3.438 0.612 -0.665 1.00 . A A . 33 SER HB2 1 1 14 7165 1 1 33 SER HB3 H 3.085 0.643 -2.397 1.00 . A A . 33 SER HB3 1 1 14 7166 1 1 33 SER HG H 5.347 0.322 -1.632 1.00 . A A . 33 SER HG 1 1 14 7167 1 1 33 SER N N 3.766 3.352 -0.543 1.00 . A A . 33 SER N 1 1 14 7168 1 1 33 SER O O 1.399 2.389 0.249 1.00 . A A . 33 SER O 1 1 14 7169 1 1 33 SER OG O 4.984 1.182 -1.882 1.00 . A A . 33 SER OG 1 1 14 7170 1 1 34 GLN C C -1.622 1.883 -2.222 1.00 . A A . 34 GLN C 1 1 14 7171 1 1 34 GLN CA C -0.729 2.808 -1.413 1.00 . A A . 34 GLN CA 1 1 14 7172 1 1 34 GLN CB C -1.152 4.286 -1.535 1.00 . A A . 34 GLN CB 1 1 14 7173 1 1 34 GLN CD C -2.957 6.028 -1.366 1.00 . A A . 34 GLN CD 1 1 14 7174 1 1 34 GLN CG C -2.637 4.552 -1.408 1.00 . A A . 34 GLN CG 1 1 14 7175 1 1 34 GLN H H 0.859 2.671 -2.777 1.00 . A A . 34 GLN H 1 1 14 7176 1 1 34 GLN HA H -0.793 2.523 -0.373 1.00 . A A . 34 GLN HA 1 1 14 7177 1 1 34 GLN HB2 H -0.657 4.846 -0.756 1.00 . A A . 34 GLN HB2 1 1 14 7178 1 1 34 GLN HB3 H -0.818 4.668 -2.489 1.00 . A A . 34 GLN HB3 1 1 14 7179 1 1 34 GLN HE21 H -3.051 5.991 0.615 1.00 . A A . 34 GLN HE21 1 1 14 7180 1 1 34 GLN HE22 H -3.356 7.507 -0.118 1.00 . A A . 34 GLN HE22 1 1 14 7181 1 1 34 GLN HG2 H -3.145 4.108 -2.251 1.00 . A A . 34 GLN HG2 1 1 14 7182 1 1 34 GLN HG3 H -2.985 4.093 -0.495 1.00 . A A . 34 GLN HG3 1 1 14 7183 1 1 34 GLN N N 0.647 2.682 -1.813 1.00 . A A . 34 GLN N 1 1 14 7184 1 1 34 GLN NE2 N -3.125 6.554 -0.188 1.00 . A A . 34 GLN NE2 1 1 14 7185 1 1 34 GLN O O -1.382 1.661 -3.408 1.00 . A A . 34 GLN O 1 1 14 7186 1 1 34 GLN OE1 O -3.127 6.671 -2.385 1.00 . A A . 34 GLN OE1 1 1 14 7187 1 1 35 CYS C C -4.575 1.288 -2.954 1.00 . A A . 35 CYS C 1 1 14 7188 1 1 35 CYS CA C -3.561 0.448 -2.213 1.00 . A A . 35 CYS CA 1 1 14 7189 1 1 35 CYS CB C -4.286 -0.419 -1.200 1.00 . A A . 35 CYS CB 1 1 14 7190 1 1 35 CYS H H -2.675 1.420 -0.591 1.00 . A A . 35 CYS H 1 1 14 7191 1 1 35 CYS HA H -3.041 -0.193 -2.910 1.00 . A A . 35 CYS HA 1 1 14 7192 1 1 35 CYS HB2 H -4.879 0.197 -0.542 1.00 . A A . 35 CYS HB2 1 1 14 7193 1 1 35 CYS HB3 H -4.941 -1.080 -1.741 1.00 . A A . 35 CYS HB3 1 1 14 7194 1 1 35 CYS N N -2.602 1.297 -1.561 1.00 . A A . 35 CYS N 1 1 14 7195 1 1 35 CYS O O -5.408 1.969 -2.329 1.00 . A A . 35 CYS O 1 1 14 7196 1 1 35 CYS SG S -3.203 -1.435 -0.174 1.00 . A A . 35 CYS SG 1 1 14 7197 1 1 36 LEU C C -6.389 0.975 -5.643 1.00 . A A . 36 LEU C 1 1 14 7198 1 1 36 LEU CA C -5.400 1.971 -5.097 1.00 . A A . 36 LEU CA 1 1 14 7199 1 1 36 LEU CB C -4.659 2.689 -6.234 1.00 . A A . 36 LEU CB 1 1 14 7200 1 1 36 LEU CD1 C -2.981 4.386 -7.015 1.00 . A A . 36 LEU CD1 1 1 14 7201 1 1 36 LEU CD2 C -4.398 4.881 -5.026 1.00 . A A . 36 LEU CD2 1 1 14 7202 1 1 36 LEU CG C -3.676 3.790 -5.805 1.00 . A A . 36 LEU CG 1 1 14 7203 1 1 36 LEU H H -3.772 0.740 -4.664 1.00 . A A . 36 LEU H 1 1 14 7204 1 1 36 LEU HA H -5.931 2.696 -4.497 1.00 . A A . 36 LEU HA 1 1 14 7205 1 1 36 LEU HB2 H -4.112 1.949 -6.799 1.00 . A A . 36 LEU HB2 1 1 14 7206 1 1 36 LEU HB3 H -5.397 3.133 -6.885 1.00 . A A . 36 LEU HB3 1 1 14 7207 1 1 36 LEU HD11 H -3.719 4.815 -7.677 1.00 . A A . 36 LEU HD11 1 1 14 7208 1 1 36 LEU HD12 H -2.435 3.612 -7.532 1.00 . A A . 36 LEU HD12 1 1 14 7209 1 1 36 LEU HD13 H -2.295 5.155 -6.695 1.00 . A A . 36 LEU HD13 1 1 14 7210 1 1 36 LEU HD21 H -4.831 4.462 -4.131 1.00 . A A . 36 LEU HD21 1 1 14 7211 1 1 36 LEU HD22 H -5.184 5.300 -5.637 1.00 . A A . 36 LEU HD22 1 1 14 7212 1 1 36 LEU HD23 H -3.698 5.657 -4.758 1.00 . A A . 36 LEU HD23 1 1 14 7213 1 1 36 LEU HG H -2.922 3.359 -5.162 1.00 . A A . 36 LEU HG 1 1 14 7214 1 1 36 LEU N N -4.487 1.271 -4.244 1.00 . A A . 36 LEU N 1 1 14 7215 1 1 36 LEU O O -7.565 1.024 -5.243 1.00 . A A . 36 LEU O 1 1 14 7216 1 1 36 LEU OXT O -5.969 0.062 -6.398 1.00 . A A . 36 LEU OXT 1 1 14 7217 2 2 1 MAN C1 C 10.524 -4.599 6.832 1.00 . B A . 101 MAN C1 1 1 14 7218 2 2 1 MAN C2 C 11.588 -3.466 6.880 1.00 . B A . 101 MAN C2 1 1 14 7219 2 2 1 MAN C3 C 12.285 -3.265 5.522 1.00 . B A . 101 MAN C3 1 1 14 7220 2 2 1 MAN C4 C 11.379 -3.637 4.353 1.00 . B A . 101 MAN C4 1 1 14 7221 2 2 1 MAN C5 C 10.842 -5.108 4.501 1.00 . B A . 101 MAN C5 1 1 14 7222 2 2 1 MAN C6 C 11.592 -6.117 3.653 1.00 . B A . 101 MAN C6 1 1 14 7223 2 2 1 MAN H1 H 10.503 -5.021 7.846 1.00 . B A . 101 MAN H1 1 1 14 7224 2 2 1 MAN H2 H 11.101 -2.528 7.188 1.00 . B A . 101 MAN H2 1 1 14 7225 2 2 1 MAN H3 H 12.527 -2.193 5.487 1.00 . B A . 101 MAN H3 1 1 14 7226 2 2 1 MAN H4 H 11.982 -3.582 3.436 1.00 . B A . 101 MAN H4 1 1 14 7227 2 2 1 MAN H5 H 9.783 -5.096 4.201 1.00 . B A . 101 MAN H5 1 1 14 7228 2 2 1 MAN H61 H 11.527 -5.789 2.606 1.00 . B A . 101 MAN H61 1 1 14 7229 2 2 1 MAN H62 H 11.076 -7.086 3.725 1.00 . B A . 101 MAN H62 1 1 14 7230 2 2 1 MAN HO2 H 12.151 -3.928 8.668 1.00 . B A . 101 MAN HO2 1 1 14 7231 2 2 1 MAN HO3 H 13.889 -3.789 6.364 1.00 . B A . 101 MAN HO3 1 1 14 7232 2 2 1 MAN HO4 H 9.781 -2.947 3.479 1.00 . B A . 101 MAN HO4 1 1 14 7233 2 2 1 MAN HO6 H 13.089 -5.593 4.785 1.00 . B A . 101 MAN HO6 1 1 14 7234 2 2 1 MAN O2 O 12.597 -3.837 7.817 1.00 . B A . 101 MAN O2 1 1 14 7235 2 2 1 MAN O3 O 13.484 -4.005 5.514 1.00 . B A . 101 MAN O3 1 1 14 7236 2 2 1 MAN O4 O 10.320 -2.703 4.241 1.00 . B A . 101 MAN O4 1 1 14 7237 2 2 1 MAN O5 O 10.927 -5.571 5.893 1.00 . B A . 101 MAN O5 1 1 14 7238 2 2 1 MAN O6 O 12.952 -6.246 4.078 1.00 . B A . 101 MAN O6 1 1 15 7239 1 1 1 THR C C -6.013 -6.376 4.443 1.00 . A A . 1 THR C 1 1 15 7240 1 1 1 THR CA C -5.974 -7.865 4.102 1.00 . A A . 1 THR CA 1 1 15 7241 1 1 1 THR CB C -7.098 -8.195 3.119 1.00 . A A . 1 THR CB 1 1 15 7242 1 1 1 THR CG2 C -6.599 -8.054 1.713 1.00 . A A . 1 THR CG2 1 1 15 7243 1 1 1 THR H1 H -7.115 -8.290 5.728 1.00 . A A . 1 THR H1 1 1 15 7244 1 1 1 THR H2 H -5.463 -8.424 6.027 1.00 . A A . 1 THR H2 1 1 15 7245 1 1 1 THR H3 H -6.286 -9.614 5.106 1.00 . A A . 1 THR H3 1 1 15 7246 1 1 1 THR HA H -5.016 -8.126 3.676 1.00 . A A . 1 THR HA 1 1 15 7247 1 1 1 THR HB H -7.933 -7.529 3.273 1.00 . A A . 1 THR HB 1 1 15 7248 1 1 1 THR HG1 H -7.222 -10.073 2.533 1.00 . A A . 1 THR HG1 1 1 15 7249 1 1 1 THR HG21 H -5.784 -8.745 1.552 1.00 . A A . 1 THR HG21 1 1 15 7250 1 1 1 THR HG22 H -6.245 -7.045 1.557 1.00 . A A . 1 THR HG22 1 1 15 7251 1 1 1 THR HG23 H -7.393 -8.267 1.014 1.00 . A A . 1 THR HG23 1 1 15 7252 1 1 1 THR N N -6.209 -8.601 5.328 1.00 . A A . 1 THR N 1 1 15 7253 1 1 1 THR O O -6.863 -5.968 5.226 1.00 . A A . 1 THR O 1 1 15 7254 1 1 1 THR OG1 O -7.499 -9.567 3.308 1.00 . A A . 1 THR OG1 1 1 15 7255 1 1 2 GLN C C -6.104 -3.322 3.495 1.00 . A A . 2 GLN C 1 1 15 7256 1 1 2 GLN CA C -5.079 -4.150 4.271 1.00 . A A . 2 GLN CA 1 1 15 7257 1 1 2 GLN CB C -3.685 -3.535 4.118 1.00 . A A . 2 GLN CB 1 1 15 7258 1 1 2 GLN CD C -2.280 -1.448 4.531 1.00 . A A . 2 GLN CD 1 1 15 7259 1 1 2 GLN CG C -3.596 -2.131 4.723 1.00 . A A . 2 GLN CG 1 1 15 7260 1 1 2 GLN H H -4.487 -5.886 3.201 1.00 . A A . 2 GLN H 1 1 15 7261 1 1 2 GLN HA H -5.359 -4.113 5.314 1.00 . A A . 2 GLN HA 1 1 15 7262 1 1 2 GLN HB2 H -2.967 -4.172 4.612 1.00 . A A . 2 GLN HB2 1 1 15 7263 1 1 2 GLN HB3 H -3.447 -3.473 3.068 1.00 . A A . 2 GLN HB3 1 1 15 7264 1 1 2 GLN HE21 H -2.028 -2.319 2.787 1.00 . A A . 2 GLN HE21 1 1 15 7265 1 1 2 GLN HE22 H -0.792 -1.239 3.345 1.00 . A A . 2 GLN HE22 1 1 15 7266 1 1 2 GLN HG2 H -4.359 -1.515 4.272 1.00 . A A . 2 GLN HG2 1 1 15 7267 1 1 2 GLN HG3 H -3.794 -2.199 5.780 1.00 . A A . 2 GLN HG3 1 1 15 7268 1 1 2 GLN N N -5.115 -5.561 3.886 1.00 . A A . 2 GLN N 1 1 15 7269 1 1 2 GLN NE2 N -1.649 -1.702 3.444 1.00 . A A . 2 GLN NE2 1 1 15 7270 1 1 2 GLN O O -6.387 -3.592 2.334 1.00 . A A . 2 GLN O 1 1 15 7271 1 1 2 GLN OE1 O -1.854 -0.645 5.373 1.00 . A A . 2 GLN OE1 1 1 15 7272 1 1 3 SER C C -7.139 -0.567 2.461 1.00 . A A . 3 SER C 1 1 15 7273 1 1 3 SER CA C -7.623 -1.416 3.661 1.00 . A A . 3 SER CA 1 1 15 7274 1 1 3 SER CB C -7.952 -0.484 4.799 1.00 . A A . 3 SER CB 1 1 15 7275 1 1 3 SER H H -6.326 -2.170 5.083 1.00 . A A . 3 SER H 1 1 15 7276 1 1 3 SER HA H -8.525 -1.954 3.417 1.00 . A A . 3 SER HA 1 1 15 7277 1 1 3 SER HB2 H -7.031 0.040 5.023 1.00 . A A . 3 SER HB2 1 1 15 7278 1 1 3 SER HB3 H -8.730 0.210 4.517 1.00 . A A . 3 SER HB3 1 1 15 7279 1 1 3 SER HG H -8.853 -1.985 5.647 1.00 . A A . 3 SER HG 1 1 15 7280 1 1 3 SER N N -6.627 -2.325 4.162 1.00 . A A . 3 SER N 1 1 15 7281 1 1 3 SER O O -5.931 -0.454 2.173 1.00 . A A . 3 SER O 1 1 15 7282 1 1 3 SER OG O -8.345 -1.221 5.949 1.00 . A A . 3 SER OG 1 1 15 7283 1 1 4 HIS C C -7.281 2.229 1.329 1.00 . A A . 4 HIS C 1 1 15 7284 1 1 4 HIS CA C -7.877 0.971 0.713 1.00 . A A . 4 HIS CA 1 1 15 7285 1 1 4 HIS CB C -9.235 1.289 0.055 1.00 . A A . 4 HIS CB 1 1 15 7286 1 1 4 HIS CD2 C -8.197 2.277 -2.118 1.00 . A A . 4 HIS CD2 1 1 15 7287 1 1 4 HIS CE1 C -10.008 3.135 -2.966 1.00 . A A . 4 HIS CE1 1 1 15 7288 1 1 4 HIS CG C -9.194 2.061 -1.240 1.00 . A A . 4 HIS CG 1 1 15 7289 1 1 4 HIS H H -9.031 -0.123 2.070 1.00 . A A . 4 HIS H 1 1 15 7290 1 1 4 HIS HA H -7.202 0.541 -0.012 1.00 . A A . 4 HIS HA 1 1 15 7291 1 1 4 HIS HB2 H -9.744 0.360 -0.151 1.00 . A A . 4 HIS HB2 1 1 15 7292 1 1 4 HIS HB3 H -9.828 1.854 0.759 1.00 . A A . 4 HIS HB3 1 1 15 7293 1 1 4 HIS HD1 H -11.201 2.631 -1.392 1.00 . A A . 4 HIS HD1 1 1 15 7294 1 1 4 HIS HD2 H -7.165 1.980 -1.996 1.00 . A A . 4 HIS HD2 1 1 15 7295 1 1 4 HIS HE1 H -10.696 3.639 -3.627 1.00 . A A . 4 HIS HE1 1 1 15 7296 1 1 4 HIS HE2 H -8.413 2.662 -4.087 1.00 . A A . 4 HIS HE2 1 1 15 7297 1 1 4 HIS N N -8.103 0.046 1.799 1.00 . A A . 4 HIS N 1 1 15 7298 1 1 4 HIS ND1 N -10.306 2.619 -1.803 1.00 . A A . 4 HIS ND1 1 1 15 7299 1 1 4 HIS NE2 N -8.723 2.941 -3.187 1.00 . A A . 4 HIS NE2 1 1 15 7300 1 1 4 HIS O O -7.703 2.627 2.415 1.00 . A A . 4 HIS O 1 1 15 7301 1 1 5 TYR C C -4.670 3.686 2.328 1.00 . A A . 5 TYR C 1 1 15 7302 1 1 5 TYR CA C -5.591 4.010 1.158 1.00 . A A . 5 TYR CA 1 1 15 7303 1 1 5 TYR CB C -6.535 5.196 1.457 1.00 . A A . 5 TYR CB 1 1 15 7304 1 1 5 TYR CD1 C -6.380 6.708 -0.543 1.00 . A A . 5 TYR CD1 1 1 15 7305 1 1 5 TYR CD2 C -8.399 5.504 -0.218 1.00 . A A . 5 TYR CD2 1 1 15 7306 1 1 5 TYR CE1 C -6.886 7.274 -1.689 1.00 . A A . 5 TYR CE1 1 1 15 7307 1 1 5 TYR CE2 C -8.918 6.070 -1.367 1.00 . A A . 5 TYR CE2 1 1 15 7308 1 1 5 TYR CG C -7.122 5.814 0.210 1.00 . A A . 5 TYR CG 1 1 15 7309 1 1 5 TYR CZ C -8.155 6.953 -2.098 1.00 . A A . 5 TYR CZ 1 1 15 7310 1 1 5 TYR H H -5.996 2.459 -0.202 1.00 . A A . 5 TYR H 1 1 15 7311 1 1 5 TYR HA H -4.932 4.294 0.349 1.00 . A A . 5 TYR HA 1 1 15 7312 1 1 5 TYR HB2 H -7.351 4.852 2.075 1.00 . A A . 5 TYR HB2 1 1 15 7313 1 1 5 TYR HB3 H -5.989 5.962 1.987 1.00 . A A . 5 TYR HB3 1 1 15 7314 1 1 5 TYR HD1 H -5.381 6.955 -0.218 1.00 . A A . 5 TYR HD1 1 1 15 7315 1 1 5 TYR HD2 H -8.995 4.812 0.360 1.00 . A A . 5 TYR HD2 1 1 15 7316 1 1 5 TYR HE1 H -6.287 7.966 -2.259 1.00 . A A . 5 TYR HE1 1 1 15 7317 1 1 5 TYR HE2 H -9.917 5.817 -1.690 1.00 . A A . 5 TYR HE2 1 1 15 7318 1 1 5 TYR HH H -9.583 7.759 -3.080 1.00 . A A . 5 TYR HH 1 1 15 7319 1 1 5 TYR N N -6.296 2.819 0.662 1.00 . A A . 5 TYR N 1 1 15 7320 1 1 5 TYR O O -4.302 4.552 3.123 1.00 . A A . 5 TYR O 1 1 15 7321 1 1 5 TYR OH O -8.665 7.516 -3.253 1.00 . A A . 5 TYR OH 1 1 15 7322 1 1 6 GLY C C -1.974 1.866 2.650 1.00 . A A . 6 GLY C 1 1 15 7323 1 1 6 GLY CA C -3.286 2.044 3.357 1.00 . A A . 6 GLY CA 1 1 15 7324 1 1 6 GLY H H -4.670 1.767 1.814 1.00 . A A . 6 GLY H 1 1 15 7325 1 1 6 GLY HA2 H -3.190 2.801 4.120 1.00 . A A . 6 GLY HA2 1 1 15 7326 1 1 6 GLY HA3 H -3.571 1.103 3.805 1.00 . A A . 6 GLY HA3 1 1 15 7327 1 1 6 GLY N N -4.279 2.441 2.406 1.00 . A A . 6 GLY N 1 1 15 7328 1 1 6 GLY O O -1.969 1.523 1.449 1.00 . A A . 6 GLY O 1 1 15 7329 1 1 7 GLN C C 0.666 0.453 2.619 1.00 . A A . 7 GLN C 1 1 15 7330 1 1 7 GLN CA C 0.425 1.944 2.746 1.00 . A A . 7 GLN CA 1 1 15 7331 1 1 7 GLN CB C 1.513 2.625 3.584 1.00 . A A . 7 GLN CB 1 1 15 7332 1 1 7 GLN CD C 3.916 3.377 3.710 1.00 . A A . 7 GLN CD 1 1 15 7333 1 1 7 GLN CG C 2.920 2.485 3.014 1.00 . A A . 7 GLN CG 1 1 15 7334 1 1 7 GLN H H -0.928 2.458 4.256 1.00 . A A . 7 GLN H 1 1 15 7335 1 1 7 GLN HA H 0.396 2.393 1.763 1.00 . A A . 7 GLN HA 1 1 15 7336 1 1 7 GLN HB2 H 1.287 3.678 3.661 1.00 . A A . 7 GLN HB2 1 1 15 7337 1 1 7 GLN HB3 H 1.507 2.193 4.574 1.00 . A A . 7 GLN HB3 1 1 15 7338 1 1 7 GLN HE21 H 5.412 2.152 3.275 1.00 . A A . 7 GLN HE21 1 1 15 7339 1 1 7 GLN HE22 H 5.815 3.559 4.164 1.00 . A A . 7 GLN HE22 1 1 15 7340 1 1 7 GLN HG2 H 3.232 1.460 3.160 1.00 . A A . 7 GLN HG2 1 1 15 7341 1 1 7 GLN HG3 H 2.912 2.700 1.955 1.00 . A A . 7 GLN HG3 1 1 15 7342 1 1 7 GLN N N -0.875 2.136 3.329 1.00 . A A . 7 GLN N 1 1 15 7343 1 1 7 GLN NE2 N 5.156 2.986 3.712 1.00 . A A . 7 GLN NE2 1 1 15 7344 1 1 7 GLN O O 0.797 -0.235 3.599 1.00 . A A . 7 GLN O 1 1 15 7345 1 1 7 GLN OE1 O 3.570 4.444 4.208 1.00 . A A . 7 GLN OE1 1 1 15 7346 1 1 8 CYS C C 2.108 -2.019 1.455 1.00 . A A . 8 CYS C 1 1 15 7347 1 1 8 CYS CA C 0.747 -1.452 1.157 1.00 . A A . 8 CYS CA 1 1 15 7348 1 1 8 CYS CB C 0.362 -1.734 -0.282 1.00 . A A . 8 CYS CB 1 1 15 7349 1 1 8 CYS H H 0.621 0.597 0.666 1.00 . A A . 8 CYS H 1 1 15 7350 1 1 8 CYS HA H 0.024 -1.942 1.793 1.00 . A A . 8 CYS HA 1 1 15 7351 1 1 8 CYS HB2 H 0.605 -2.759 -0.518 1.00 . A A . 8 CYS HB2 1 1 15 7352 1 1 8 CYS HB3 H -0.701 -1.581 -0.401 1.00 . A A . 8 CYS HB3 1 1 15 7353 1 1 8 CYS N N 0.664 -0.029 1.419 1.00 . A A . 8 CYS N 1 1 15 7354 1 1 8 CYS O O 2.227 -3.028 2.117 1.00 . A A . 8 CYS O 1 1 15 7355 1 1 8 CYS SG S 1.216 -0.674 -1.492 1.00 . A A . 8 CYS SG 1 1 15 7356 1 1 9 GLY C C 5.460 -1.186 0.424 1.00 . A A . 9 GLY C 1 1 15 7357 1 1 9 GLY CA C 4.424 -1.922 1.177 1.00 . A A . 9 GLY CA 1 1 15 7358 1 1 9 GLY H H 2.999 -0.518 0.527 1.00 . A A . 9 GLY H 1 1 15 7359 1 1 9 GLY HA2 H 4.668 -1.900 2.229 1.00 . A A . 9 GLY HA2 1 1 15 7360 1 1 9 GLY HA3 H 4.414 -2.950 0.842 1.00 . A A . 9 GLY HA3 1 1 15 7361 1 1 9 GLY N N 3.132 -1.370 0.993 1.00 . A A . 9 GLY N 1 1 15 7362 1 1 9 GLY O O 5.715 -1.470 -0.744 1.00 . A A . 9 GLY O 1 1 15 7363 1 1 10 GLY C C 8.276 0.225 1.376 1.00 . A A . 10 GLY C 1 1 15 7364 1 1 10 GLY CA C 7.086 0.523 0.524 1.00 . A A . 10 GLY CA 1 1 15 7365 1 1 10 GLY H H 5.642 0.043 1.938 1.00 . A A . 10 GLY H 1 1 15 7366 1 1 10 GLY HA2 H 7.262 0.197 -0.489 1.00 . A A . 10 GLY HA2 1 1 15 7367 1 1 10 GLY HA3 H 6.889 1.584 0.546 1.00 . A A . 10 GLY HA3 1 1 15 7368 1 1 10 GLY N N 5.982 -0.192 1.053 1.00 . A A . 10 GLY N 1 1 15 7369 1 1 10 GLY O O 8.138 -0.492 2.378 1.00 . A A . 10 GLY O 1 1 15 7370 1 1 11 ILE C C 10.406 1.237 3.176 1.00 . A A . 11 ILE C 1 1 15 7371 1 1 11 ILE CA C 10.606 0.546 1.828 1.00 . A A . 11 ILE CA 1 1 15 7372 1 1 11 ILE CB C 11.873 1.093 1.115 1.00 . A A . 11 ILE CB 1 1 15 7373 1 1 11 ILE CD1 C 13.187 0.933 -1.087 1.00 . A A . 11 ILE CD1 1 1 15 7374 1 1 11 ILE CG1 C 12.020 0.427 -0.268 1.00 . A A . 11 ILE CG1 1 1 15 7375 1 1 11 ILE CG2 C 13.125 0.841 1.969 1.00 . A A . 11 ILE CG2 1 1 15 7376 1 1 11 ILE H H 9.466 1.306 0.223 1.00 . A A . 11 ILE H 1 1 15 7377 1 1 11 ILE HA H 10.713 -0.516 1.994 1.00 . A A . 11 ILE HA 1 1 15 7378 1 1 11 ILE HB H 11.763 2.158 0.981 1.00 . A A . 11 ILE HB 1 1 15 7379 1 1 11 ILE HD11 H 14.105 0.758 -0.547 1.00 . A A . 11 ILE HD11 1 1 15 7380 1 1 11 ILE HD12 H 13.070 1.992 -1.270 1.00 . A A . 11 ILE HD12 1 1 15 7381 1 1 11 ILE HD13 H 13.222 0.409 -2.031 1.00 . A A . 11 ILE HD13 1 1 15 7382 1 1 11 ILE HG12 H 12.149 -0.637 -0.134 1.00 . A A . 11 ILE HG12 1 1 15 7383 1 1 11 ILE HG13 H 11.114 0.596 -0.831 1.00 . A A . 11 ILE HG13 1 1 15 7384 1 1 11 ILE HG21 H 13.015 1.336 2.922 1.00 . A A . 11 ILE HG21 1 1 15 7385 1 1 11 ILE HG22 H 13.995 1.227 1.460 1.00 . A A . 11 ILE HG22 1 1 15 7386 1 1 11 ILE HG23 H 13.245 -0.220 2.130 1.00 . A A . 11 ILE HG23 1 1 15 7387 1 1 11 ILE N N 9.417 0.752 1.028 1.00 . A A . 11 ILE N 1 1 15 7388 1 1 11 ILE O O 10.167 2.436 3.233 1.00 . A A . 11 ILE O 1 1 15 7389 1 1 12 GLY C C 8.873 0.577 6.090 1.00 . A A . 12 GLY C 1 1 15 7390 1 1 12 GLY CA C 10.195 1.030 5.538 1.00 . A A . 12 GLY CA 1 1 15 7391 1 1 12 GLY H H 10.576 -0.498 4.130 1.00 . A A . 12 GLY H 1 1 15 7392 1 1 12 GLY HA2 H 10.984 0.723 6.208 1.00 . A A . 12 GLY HA2 1 1 15 7393 1 1 12 GLY HA3 H 10.192 2.106 5.463 1.00 . A A . 12 GLY HA3 1 1 15 7394 1 1 12 GLY N N 10.424 0.469 4.232 1.00 . A A . 12 GLY N 1 1 15 7395 1 1 12 GLY O O 8.578 0.766 7.275 1.00 . A A . 12 GLY O 1 1 15 7396 1 1 13 TYR C C 6.970 -2.009 5.965 1.00 . A A . 13 TYR C 1 1 15 7397 1 1 13 TYR CA C 6.804 -0.540 5.669 1.00 . A A . 13 TYR CA 1 1 15 7398 1 1 13 TYR CB C 5.692 -0.322 4.633 1.00 . A A . 13 TYR CB 1 1 15 7399 1 1 13 TYR CD1 C 3.561 0.201 5.880 1.00 . A A . 13 TYR CD1 1 1 15 7400 1 1 13 TYR CD2 C 3.797 -1.984 4.959 1.00 . A A . 13 TYR CD2 1 1 15 7401 1 1 13 TYR CE1 C 2.329 -0.142 6.394 1.00 . A A . 13 TYR CE1 1 1 15 7402 1 1 13 TYR CE2 C 2.563 -2.336 5.462 1.00 . A A . 13 TYR CE2 1 1 15 7403 1 1 13 TYR CG C 4.318 -0.710 5.156 1.00 . A A . 13 TYR CG 1 1 15 7404 1 1 13 TYR CZ C 1.830 -1.410 6.182 1.00 . A A . 13 TYR CZ 1 1 15 7405 1 1 13 TYR H H 8.336 -0.135 4.300 1.00 . A A . 13 TYR H 1 1 15 7406 1 1 13 TYR HA H 6.541 -0.027 6.583 1.00 . A A . 13 TYR HA 1 1 15 7407 1 1 13 TYR HB2 H 5.665 0.720 4.351 1.00 . A A . 13 TYR HB2 1 1 15 7408 1 1 13 TYR HB3 H 5.905 -0.924 3.762 1.00 . A A . 13 TYR HB3 1 1 15 7409 1 1 13 TYR HD1 H 3.951 1.194 6.043 1.00 . A A . 13 TYR HD1 1 1 15 7410 1 1 13 TYR HD2 H 4.372 -2.706 4.399 1.00 . A A . 13 TYR HD2 1 1 15 7411 1 1 13 TYR HE1 H 1.759 0.584 6.953 1.00 . A A . 13 TYR HE1 1 1 15 7412 1 1 13 TYR HE2 H 2.185 -3.334 5.287 1.00 . A A . 13 TYR HE2 1 1 15 7413 1 1 13 TYR HH H -0.063 -1.168 6.338 1.00 . A A . 13 TYR HH 1 1 15 7414 1 1 13 TYR N N 8.060 -0.022 5.237 1.00 . A A . 13 TYR N 1 1 15 7415 1 1 13 TYR O O 7.578 -2.753 5.180 1.00 . A A . 13 TYR O 1 1 15 7416 1 1 13 TYR OH O 0.610 -1.756 6.710 1.00 . A A . 13 TYR OH 1 1 15 7417 1 1 14 SER C C 5.191 -4.195 8.052 1.00 . A A . 14 SER C 1 1 15 7418 1 1 14 SER CA C 6.554 -3.767 7.532 1.00 . A A . 14 SER CA 1 1 15 7419 1 1 14 SER CB C 7.619 -3.839 8.619 1.00 . A A . 14 SER CB 1 1 15 7420 1 1 14 SER H H 6.024 -1.769 7.678 1.00 . A A . 14 SER H 1 1 15 7421 1 1 14 SER HA H 6.845 -4.394 6.701 1.00 . A A . 14 SER HA 1 1 15 7422 1 1 14 SER HB2 H 7.309 -3.230 9.456 1.00 . A A . 14 SER HB2 1 1 15 7423 1 1 14 SER HB3 H 7.727 -4.866 8.936 1.00 . A A . 14 SER HB3 1 1 15 7424 1 1 14 SER N N 6.466 -2.412 7.085 1.00 . A A . 14 SER N 1 1 15 7425 1 1 14 SER O O 4.806 -3.874 9.192 1.00 . A A . 14 SER O 1 1 15 7426 1 1 14 SER OG O 8.899 -3.371 8.083 1.00 . A A . 14 SER OG 1 1 15 7427 1 1 15 GLY C C 2.405 -5.922 6.428 1.00 . A A . 15 GLY C 1 1 15 7428 1 1 15 GLY CA C 3.125 -5.261 7.572 1.00 . A A . 15 GLY CA 1 1 15 7429 1 1 15 GLY H H 4.763 -5.027 6.300 1.00 . A A . 15 GLY H 1 1 15 7430 1 1 15 GLY HA2 H 3.213 -5.970 8.381 1.00 . A A . 15 GLY HA2 1 1 15 7431 1 1 15 GLY HA3 H 2.560 -4.402 7.899 1.00 . A A . 15 GLY HA3 1 1 15 7432 1 1 15 GLY N N 4.433 -4.833 7.203 1.00 . A A . 15 GLY N 1 1 15 7433 1 1 15 GLY O O 3.053 -6.550 5.570 1.00 . A A . 15 GLY O 1 1 15 7434 1 1 16 PRO C C 0.420 -5.746 3.985 1.00 . A A . 16 PRO C 1 1 15 7435 1 1 16 PRO CA C 0.265 -6.430 5.340 1.00 . A A . 16 PRO CA 1 1 15 7436 1 1 16 PRO CB C -1.175 -6.266 5.857 1.00 . A A . 16 PRO CB 1 1 15 7437 1 1 16 PRO CD C 0.252 -5.033 7.307 1.00 . A A . 16 PRO CD 1 1 15 7438 1 1 16 PRO CG C -1.048 -5.756 7.255 1.00 . A A . 16 PRO CG 1 1 15 7439 1 1 16 PRO HA H 0.497 -7.481 5.238 1.00 . A A . 16 PRO HA 1 1 15 7440 1 1 16 PRO HB2 H -1.702 -5.571 5.223 1.00 . A A . 16 PRO HB2 1 1 15 7441 1 1 16 PRO HB3 H -1.671 -7.222 5.835 1.00 . A A . 16 PRO HB3 1 1 15 7442 1 1 16 PRO HD2 H 0.133 -4.011 6.977 1.00 . A A . 16 PRO HD2 1 1 15 7443 1 1 16 PRO HD3 H 0.660 -5.071 8.306 1.00 . A A . 16 PRO HD3 1 1 15 7444 1 1 16 PRO HG2 H -1.861 -5.081 7.479 1.00 . A A . 16 PRO HG2 1 1 15 7445 1 1 16 PRO HG3 H -1.048 -6.584 7.949 1.00 . A A . 16 PRO HG3 1 1 15 7446 1 1 16 PRO N N 1.080 -5.804 6.372 1.00 . A A . 16 PRO N 1 1 15 7447 1 1 16 PRO O O -0.060 -4.634 3.777 1.00 . A A . 16 PRO O 1 1 15 7448 1 1 17 THR C C 0.178 -6.215 0.814 1.00 . A A . 17 THR C 1 1 15 7449 1 1 17 THR CA C 1.326 -5.879 1.753 1.00 . A A . 17 THR CA 1 1 15 7450 1 1 17 THR CB C 2.645 -6.425 1.173 1.00 . A A . 17 THR CB 1 1 15 7451 1 1 17 THR CG2 C 3.832 -5.919 1.978 1.00 . A A . 17 THR CG2 1 1 15 7452 1 1 17 THR H H 1.471 -7.288 3.299 1.00 . A A . 17 THR H 1 1 15 7453 1 1 17 THR HA H 1.414 -4.806 1.838 1.00 . A A . 17 THR HA 1 1 15 7454 1 1 17 THR HB H 2.741 -6.095 0.149 1.00 . A A . 17 THR HB 1 1 15 7455 1 1 17 THR HG1 H 2.622 -8.187 0.293 1.00 . A A . 17 THR HG1 1 1 15 7456 1 1 17 THR HG21 H 3.856 -4.840 1.944 1.00 . A A . 17 THR HG21 1 1 15 7457 1 1 17 THR HG22 H 4.752 -6.319 1.578 1.00 . A A . 17 THR HG22 1 1 15 7458 1 1 17 THR HG23 H 3.715 -6.232 3.005 1.00 . A A . 17 THR HG23 1 1 15 7459 1 1 17 THR N N 1.093 -6.412 3.076 1.00 . A A . 17 THR N 1 1 15 7460 1 1 17 THR O O 0.057 -5.650 -0.280 1.00 . A A . 17 THR O 1 1 15 7461 1 1 17 THR OG1 O 2.625 -7.869 1.207 1.00 . A A . 17 THR OG1 1 1 15 7462 1 1 18 VAL C C -2.935 -6.610 0.632 1.00 . A A . 18 VAL C 1 1 15 7463 1 1 18 VAL CA C -1.770 -7.571 0.437 1.00 . A A . 18 VAL CA 1 1 15 7464 1 1 18 VAL CB C -2.200 -9.021 0.791 1.00 . A A . 18 VAL CB 1 1 15 7465 1 1 18 VAL CG1 C -3.318 -9.489 -0.118 1.00 . A A . 18 VAL CG1 1 1 15 7466 1 1 18 VAL CG2 C -1.016 -9.972 0.697 1.00 . A A . 18 VAL CG2 1 1 15 7467 1 1 18 VAL H H -0.524 -7.509 2.133 1.00 . A A . 18 VAL H 1 1 15 7468 1 1 18 VAL HA H -1.461 -7.539 -0.599 1.00 . A A . 18 VAL HA 1 1 15 7469 1 1 18 VAL HB H -2.564 -9.029 1.807 1.00 . A A . 18 VAL HB 1 1 15 7470 1 1 18 VAL HG11 H -2.978 -9.471 -1.142 1.00 . A A . 18 VAL HG11 1 1 15 7471 1 1 18 VAL HG12 H -4.164 -8.828 -0.006 1.00 . A A . 18 VAL HG12 1 1 15 7472 1 1 18 VAL HG13 H -3.608 -10.495 0.147 1.00 . A A . 18 VAL HG13 1 1 15 7473 1 1 18 VAL HG21 H -0.254 -9.666 1.399 1.00 . A A . 18 VAL HG21 1 1 15 7474 1 1 18 VAL HG22 H -0.611 -9.940 -0.303 1.00 . A A . 18 VAL HG22 1 1 15 7475 1 1 18 VAL HG23 H -1.334 -10.979 0.924 1.00 . A A . 18 VAL HG23 1 1 15 7476 1 1 18 VAL N N -0.658 -7.135 1.237 1.00 . A A . 18 VAL N 1 1 15 7477 1 1 18 VAL O O -3.466 -6.469 1.748 1.00 . A A . 18 VAL O 1 1 15 7478 1 1 19 CYS C C -5.724 -5.635 -0.552 1.00 . A A . 19 CYS C 1 1 15 7479 1 1 19 CYS CA C -4.371 -4.975 -0.383 1.00 . A A . 19 CYS CA 1 1 15 7480 1 1 19 CYS CB C -4.160 -3.919 -1.451 1.00 . A A . 19 CYS CB 1 1 15 7481 1 1 19 CYS H H -2.874 -6.122 -1.289 1.00 . A A . 19 CYS H 1 1 15 7482 1 1 19 CYS HA H -4.336 -4.495 0.584 1.00 . A A . 19 CYS HA 1 1 15 7483 1 1 19 CYS HB2 H -4.236 -4.368 -2.431 1.00 . A A . 19 CYS HB2 1 1 15 7484 1 1 19 CYS HB3 H -4.926 -3.168 -1.334 1.00 . A A . 19 CYS HB3 1 1 15 7485 1 1 19 CYS N N -3.312 -5.948 -0.430 1.00 . A A . 19 CYS N 1 1 15 7486 1 1 19 CYS O O -5.827 -6.733 -1.132 1.00 . A A . 19 CYS O 1 1 15 7487 1 1 19 CYS SG S -2.554 -3.075 -1.333 1.00 . A A . 19 CYS SG 1 1 15 7488 1 1 20 ALA C C -8.582 -5.727 -1.440 1.00 . A A . 20 ALA C 1 1 15 7489 1 1 20 ALA CA C -8.126 -5.428 -0.035 1.00 . A A . 20 ALA CA 1 1 15 7490 1 1 20 ALA CB C -9.021 -4.367 0.577 1.00 . A A . 20 ALA CB 1 1 15 7491 1 1 20 ALA H H -6.557 -4.161 0.508 1.00 . A A . 20 ALA H 1 1 15 7492 1 1 20 ALA HA H -8.215 -6.320 0.566 1.00 . A A . 20 ALA HA 1 1 15 7493 1 1 20 ALA HB1 H -8.697 -4.160 1.586 1.00 . A A . 20 ALA HB1 1 1 15 7494 1 1 20 ALA HB2 H -10.038 -4.726 0.599 1.00 . A A . 20 ALA HB2 1 1 15 7495 1 1 20 ALA HB3 H -8.963 -3.464 -0.011 1.00 . A A . 20 ALA HB3 1 1 15 7496 1 1 20 ALA N N -6.742 -4.985 0.004 1.00 . A A . 20 ALA N 1 1 15 7497 1 1 20 ALA O O -8.106 -5.106 -2.406 1.00 . A A . 20 ALA O 1 1 15 7498 1 1 21 SER C C -10.637 -5.873 -3.549 1.00 . A A . 21 SER C 1 1 15 7499 1 1 21 SER CA C -10.051 -7.082 -2.799 1.00 . A A . 21 SER CA 1 1 15 7500 1 1 21 SER CB C -11.122 -8.124 -2.503 1.00 . A A . 21 SER CB 1 1 15 7501 1 1 21 SER H H -9.810 -7.130 -0.743 1.00 . A A . 21 SER H 1 1 15 7502 1 1 21 SER HA H -9.277 -7.543 -3.395 1.00 . A A . 21 SER HA 1 1 15 7503 1 1 21 SER HB2 H -11.931 -7.660 -1.958 1.00 . A A . 21 SER HB2 1 1 15 7504 1 1 21 SER HB3 H -11.502 -8.534 -3.426 1.00 . A A . 21 SER HB3 1 1 15 7505 1 1 21 SER HG H -10.255 -9.850 -2.338 1.00 . A A . 21 SER HG 1 1 15 7506 1 1 21 SER N N -9.487 -6.669 -1.547 1.00 . A A . 21 SER N 1 1 15 7507 1 1 21 SER O O -11.594 -5.228 -3.082 1.00 . A A . 21 SER O 1 1 15 7508 1 1 21 SER OG O -10.574 -9.182 -1.715 1.00 . A A . 21 SER OG 1 1 15 7509 1 1 22 GLY C C -9.498 -3.243 -5.385 1.00 . A A . 22 GLY C 1 1 15 7510 1 1 22 GLY CA C -10.460 -4.419 -5.443 1.00 . A A . 22 GLY CA 1 1 15 7511 1 1 22 GLY H H -9.221 -6.041 -4.932 1.00 . A A . 22 GLY H 1 1 15 7512 1 1 22 GLY HA2 H -10.559 -4.738 -6.471 1.00 . A A . 22 GLY HA2 1 1 15 7513 1 1 22 GLY HA3 H -11.425 -4.097 -5.078 1.00 . A A . 22 GLY HA3 1 1 15 7514 1 1 22 GLY N N -10.013 -5.530 -4.653 1.00 . A A . 22 GLY N 1 1 15 7515 1 1 22 GLY O O -9.729 -2.215 -6.027 1.00 . A A . 22 GLY O 1 1 15 7516 1 1 23 THR C C -6.044 -2.884 -4.755 1.00 . A A . 23 THR C 1 1 15 7517 1 1 23 THR CA C -7.432 -2.311 -4.505 1.00 . A A . 23 THR CA 1 1 15 7518 1 1 23 THR CB C -7.494 -1.625 -3.101 1.00 . A A . 23 THR CB 1 1 15 7519 1 1 23 THR CG2 C -8.866 -1.025 -2.869 1.00 . A A . 23 THR CG2 1 1 15 7520 1 1 23 THR H H -8.268 -4.216 -4.137 1.00 . A A . 23 THR H 1 1 15 7521 1 1 23 THR HA H -7.644 -1.577 -5.268 1.00 . A A . 23 THR HA 1 1 15 7522 1 1 23 THR HB H -6.756 -0.838 -3.022 1.00 . A A . 23 THR HB 1 1 15 7523 1 1 23 THR HG1 H -7.520 -3.450 -2.347 1.00 . A A . 23 THR HG1 1 1 15 7524 1 1 23 THR HG21 H -8.898 -0.558 -1.896 1.00 . A A . 23 THR HG21 1 1 15 7525 1 1 23 THR HG22 H -9.613 -1.803 -2.925 1.00 . A A . 23 THR HG22 1 1 15 7526 1 1 23 THR HG23 H -9.069 -0.284 -3.629 1.00 . A A . 23 THR HG23 1 1 15 7527 1 1 23 THR N N -8.423 -3.375 -4.623 1.00 . A A . 23 THR N 1 1 15 7528 1 1 23 THR O O -5.773 -4.020 -4.375 1.00 . A A . 23 THR O 1 1 15 7529 1 1 23 THR OG1 O -7.236 -2.570 -2.059 1.00 . A A . 23 THR OG1 1 1 15 7530 1 1 24 THR C C -2.773 -1.764 -5.079 1.00 . A A . 24 THR C 1 1 15 7531 1 1 24 THR CA C -3.854 -2.621 -5.705 1.00 . A A . 24 THR CA 1 1 15 7532 1 1 24 THR CB C -3.637 -2.729 -7.230 1.00 . A A . 24 THR CB 1 1 15 7533 1 1 24 THR CG2 C -4.364 -3.933 -7.804 1.00 . A A . 24 THR CG2 1 1 15 7534 1 1 24 THR H H -5.401 -1.200 -5.633 1.00 . A A . 24 THR H 1 1 15 7535 1 1 24 THR HA H -3.775 -3.612 -5.286 1.00 . A A . 24 THR HA 1 1 15 7536 1 1 24 THR HB H -2.577 -2.840 -7.407 1.00 . A A . 24 THR HB 1 1 15 7537 1 1 24 THR HG1 H -5.040 -1.473 -7.772 1.00 . A A . 24 THR HG1 1 1 15 7538 1 1 24 THR HG21 H -4.221 -3.965 -8.874 1.00 . A A . 24 THR HG21 1 1 15 7539 1 1 24 THR HG22 H -5.417 -3.859 -7.578 1.00 . A A . 24 THR HG22 1 1 15 7540 1 1 24 THR HG23 H -3.967 -4.836 -7.364 1.00 . A A . 24 THR HG23 1 1 15 7541 1 1 24 THR N N -5.178 -2.130 -5.387 1.00 . A A . 24 THR N 1 1 15 7542 1 1 24 THR O O -2.956 -0.560 -4.886 1.00 . A A . 24 THR O 1 1 15 7543 1 1 24 THR OG1 O -4.083 -1.523 -7.891 1.00 . A A . 24 THR OG1 1 1 15 7544 1 1 25 CYS C C 0.151 -0.926 -5.278 1.00 . A A . 25 CYS C 1 1 15 7545 1 1 25 CYS CA C -0.536 -1.703 -4.182 1.00 . A A . 25 CYS CA 1 1 15 7546 1 1 25 CYS CB C 0.440 -2.718 -3.571 1.00 . A A . 25 CYS CB 1 1 15 7547 1 1 25 CYS H H -1.598 -3.352 -4.910 1.00 . A A . 25 CYS H 1 1 15 7548 1 1 25 CYS HA H -0.880 -1.029 -3.413 1.00 . A A . 25 CYS HA 1 1 15 7549 1 1 25 CYS HB2 H -0.064 -3.264 -2.788 1.00 . A A . 25 CYS HB2 1 1 15 7550 1 1 25 CYS HB3 H 0.750 -3.408 -4.342 1.00 . A A . 25 CYS HB3 1 1 15 7551 1 1 25 CYS N N -1.671 -2.387 -4.747 1.00 . A A . 25 CYS N 1 1 15 7552 1 1 25 CYS O O 0.565 -1.503 -6.284 1.00 . A A . 25 CYS O 1 1 15 7553 1 1 25 CYS SG S 1.946 -1.978 -2.845 1.00 . A A . 25 CYS SG 1 1 15 7554 1 1 26 GLN C C 1.977 1.987 -5.519 1.00 . A A . 26 GLN C 1 1 15 7555 1 1 26 GLN CA C 0.853 1.183 -6.133 1.00 . A A . 26 GLN CA 1 1 15 7556 1 1 26 GLN CB C -0.171 2.076 -6.829 1.00 . A A . 26 GLN CB 1 1 15 7557 1 1 26 GLN CD C -2.292 2.128 -8.217 1.00 . A A . 26 GLN CD 1 1 15 7558 1 1 26 GLN CG C -1.266 1.275 -7.528 1.00 . A A . 26 GLN CG 1 1 15 7559 1 1 26 GLN H H -0.191 0.812 -4.359 1.00 . A A . 26 GLN H 1 1 15 7560 1 1 26 GLN HA H 1.278 0.513 -6.864 1.00 . A A . 26 GLN HA 1 1 15 7561 1 1 26 GLN HB2 H -0.630 2.719 -6.092 1.00 . A A . 26 GLN HB2 1 1 15 7562 1 1 26 GLN HB3 H 0.333 2.685 -7.565 1.00 . A A . 26 GLN HB3 1 1 15 7563 1 1 26 GLN HE21 H -3.683 0.759 -7.886 1.00 . A A . 26 GLN HE21 1 1 15 7564 1 1 26 GLN HE22 H -4.194 2.190 -8.709 1.00 . A A . 26 GLN HE22 1 1 15 7565 1 1 26 GLN HG2 H -0.808 0.633 -8.266 1.00 . A A . 26 GLN HG2 1 1 15 7566 1 1 26 GLN HG3 H -1.761 0.663 -6.790 1.00 . A A . 26 GLN HG3 1 1 15 7567 1 1 26 GLN N N 0.215 0.370 -5.140 1.00 . A A . 26 GLN N 1 1 15 7568 1 1 26 GLN NE2 N -3.505 1.641 -8.281 1.00 . A A . 26 GLN NE2 1 1 15 7569 1 1 26 GLN O O 1.796 2.677 -4.494 1.00 . A A . 26 GLN O 1 1 15 7570 1 1 26 GLN OE1 O -2.002 3.218 -8.684 1.00 . A A . 26 GLN OE1 1 1 15 7571 1 1 27 VAL C C 4.271 3.998 -6.136 1.00 . A A . 27 VAL C 1 1 15 7572 1 1 27 VAL CA C 4.319 2.558 -5.658 1.00 . A A . 27 VAL CA 1 1 15 7573 1 1 27 VAL CB C 5.616 1.866 -6.170 1.00 . A A . 27 VAL CB 1 1 15 7574 1 1 27 VAL CG1 C 6.867 2.595 -5.685 1.00 . A A . 27 VAL CG1 1 1 15 7575 1 1 27 VAL CG2 C 5.651 0.408 -5.732 1.00 . A A . 27 VAL CG2 1 1 15 7576 1 1 27 VAL H H 3.213 1.306 -6.915 1.00 . A A . 27 VAL H 1 1 15 7577 1 1 27 VAL HA H 4.315 2.543 -4.578 1.00 . A A . 27 VAL HA 1 1 15 7578 1 1 27 VAL HB H 5.605 1.894 -7.250 1.00 . A A . 27 VAL HB 1 1 15 7579 1 1 27 VAL HG11 H 6.876 2.617 -4.606 1.00 . A A . 27 VAL HG11 1 1 15 7580 1 1 27 VAL HG12 H 6.859 3.608 -6.058 1.00 . A A . 27 VAL HG12 1 1 15 7581 1 1 27 VAL HG13 H 7.747 2.082 -6.042 1.00 . A A . 27 VAL HG13 1 1 15 7582 1 1 27 VAL HG21 H 6.552 -0.052 -6.109 1.00 . A A . 27 VAL HG21 1 1 15 7583 1 1 27 VAL HG22 H 4.787 -0.111 -6.121 1.00 . A A . 27 VAL HG22 1 1 15 7584 1 1 27 VAL HG23 H 5.649 0.356 -4.653 1.00 . A A . 27 VAL HG23 1 1 15 7585 1 1 27 VAL N N 3.141 1.871 -6.115 1.00 . A A . 27 VAL N 1 1 15 7586 1 1 27 VAL O O 4.474 4.285 -7.318 1.00 . A A . 27 VAL O 1 1 15 7587 1 1 28 LEU C C 5.216 6.928 -5.408 1.00 . A A . 28 LEU C 1 1 15 7588 1 1 28 LEU CA C 3.849 6.288 -5.552 1.00 . A A . 28 LEU CA 1 1 15 7589 1 1 28 LEU CB C 2.836 6.970 -4.618 1.00 . A A . 28 LEU CB 1 1 15 7590 1 1 28 LEU CD1 C 0.523 7.124 -3.642 1.00 . A A . 28 LEU CD1 1 1 15 7591 1 1 28 LEU CD2 C 0.811 6.434 -6.011 1.00 . A A . 28 LEU CD2 1 1 15 7592 1 1 28 LEU CG C 1.413 6.386 -4.622 1.00 . A A . 28 LEU CG 1 1 15 7593 1 1 28 LEU H H 3.762 4.580 -4.323 1.00 . A A . 28 LEU H 1 1 15 7594 1 1 28 LEU HA H 3.512 6.388 -6.574 1.00 . A A . 28 LEU HA 1 1 15 7595 1 1 28 LEU HB2 H 3.219 6.916 -3.611 1.00 . A A . 28 LEU HB2 1 1 15 7596 1 1 28 LEU HB3 H 2.769 8.011 -4.901 1.00 . A A . 28 LEU HB3 1 1 15 7597 1 1 28 LEU HD11 H -0.472 6.707 -3.682 1.00 . A A . 28 LEU HD11 1 1 15 7598 1 1 28 LEU HD12 H 0.483 8.172 -3.903 1.00 . A A . 28 LEU HD12 1 1 15 7599 1 1 28 LEU HD13 H 0.919 7.011 -2.642 1.00 . A A . 28 LEU HD13 1 1 15 7600 1 1 28 LEU HD21 H 0.786 7.460 -6.346 1.00 . A A . 28 LEU HD21 1 1 15 7601 1 1 28 LEU HD22 H -0.195 6.044 -5.973 1.00 . A A . 28 LEU HD22 1 1 15 7602 1 1 28 LEU HD23 H 1.411 5.844 -6.687 1.00 . A A . 28 LEU HD23 1 1 15 7603 1 1 28 LEU HG H 1.459 5.353 -4.308 1.00 . A A . 28 LEU HG 1 1 15 7604 1 1 28 LEU N N 3.946 4.884 -5.235 1.00 . A A . 28 LEU N 1 1 15 7605 1 1 28 LEU O O 5.702 7.608 -6.314 1.00 . A A . 28 LEU O 1 1 15 7606 1 1 29 ASN C C 8.011 6.008 -3.549 1.00 . A A . 29 ASN C 1 1 15 7607 1 1 29 ASN CA C 7.144 7.195 -3.945 1.00 . A A . 29 ASN CA 1 1 15 7608 1 1 29 ASN CB C 7.005 8.171 -2.752 1.00 . A A . 29 ASN CB 1 1 15 7609 1 1 29 ASN CG C 6.052 9.337 -3.004 1.00 . A A . 29 ASN CG 1 1 15 7610 1 1 29 ASN H H 5.452 6.000 -3.667 1.00 . A A . 29 ASN H 1 1 15 7611 1 1 29 ASN HA H 7.561 7.700 -4.803 1.00 . A A . 29 ASN HA 1 1 15 7612 1 1 29 ASN HB2 H 6.663 7.626 -1.886 1.00 . A A . 29 ASN HB2 1 1 15 7613 1 1 29 ASN HB3 H 7.980 8.576 -2.528 1.00 . A A . 29 ASN HB3 1 1 15 7614 1 1 29 ASN HD21 H 5.590 9.399 -1.090 1.00 . A A . 29 ASN HD21 1 1 15 7615 1 1 29 ASN HD22 H 4.789 10.541 -2.099 1.00 . A A . 29 ASN HD22 1 1 15 7616 1 1 29 ASN N N 5.845 6.650 -4.293 1.00 . A A . 29 ASN N 1 1 15 7617 1 1 29 ASN ND2 N 5.420 9.804 -1.967 1.00 . A A . 29 ASN ND2 1 1 15 7618 1 1 29 ASN O O 7.470 4.907 -3.417 1.00 . A A . 29 ASN O 1 1 15 7619 1 1 29 ASN OD1 O 5.896 9.815 -4.129 1.00 . A A . 29 ASN OD1 1 1 15 7620 1 1 30 PRO C C 9.768 4.310 -1.721 1.00 . A A . 30 PRO C 1 1 15 7621 1 1 30 PRO CA C 10.223 5.031 -2.993 1.00 . A A . 30 PRO CA 1 1 15 7622 1 1 30 PRO CB C 11.599 5.677 -2.767 1.00 . A A . 30 PRO CB 1 1 15 7623 1 1 30 PRO CD C 10.127 7.429 -3.433 1.00 . A A . 30 PRO CD 1 1 15 7624 1 1 30 PRO CG C 11.548 6.952 -3.523 1.00 . A A . 30 PRO CG 1 1 15 7625 1 1 30 PRO HA H 10.277 4.325 -3.808 1.00 . A A . 30 PRO HA 1 1 15 7626 1 1 30 PRO HB2 H 11.741 5.851 -1.711 1.00 . A A . 30 PRO HB2 1 1 15 7627 1 1 30 PRO HB3 H 12.377 5.027 -3.137 1.00 . A A . 30 PRO HB3 1 1 15 7628 1 1 30 PRO HD2 H 9.999 8.032 -2.547 1.00 . A A . 30 PRO HD2 1 1 15 7629 1 1 30 PRO HD3 H 9.847 7.984 -4.313 1.00 . A A . 30 PRO HD3 1 1 15 7630 1 1 30 PRO HG2 H 12.218 7.669 -3.071 1.00 . A A . 30 PRO HG2 1 1 15 7631 1 1 30 PRO HG3 H 11.824 6.778 -4.552 1.00 . A A . 30 PRO HG3 1 1 15 7632 1 1 30 PRO N N 9.350 6.170 -3.334 1.00 . A A . 30 PRO N 1 1 15 7633 1 1 30 PRO O O 9.688 3.070 -1.674 1.00 . A A . 30 PRO O 1 1 15 7634 1 1 31 TYR C C 7.484 4.434 0.625 1.00 . A A . 31 TYR C 1 1 15 7635 1 1 31 TYR CA C 9.011 4.471 0.531 1.00 . A A . 31 TYR CA 1 1 15 7636 1 1 31 TYR CB C 9.585 5.282 1.713 1.00 . A A . 31 TYR CB 1 1 15 7637 1 1 31 TYR CD1 C 11.632 6.639 1.037 1.00 . A A . 31 TYR CD1 1 1 15 7638 1 1 31 TYR CD2 C 11.984 4.625 2.252 1.00 . A A . 31 TYR CD2 1 1 15 7639 1 1 31 TYR CE1 C 12.991 6.859 0.999 1.00 . A A . 31 TYR CE1 1 1 15 7640 1 1 31 TYR CE2 C 13.347 4.838 2.217 1.00 . A A . 31 TYR CE2 1 1 15 7641 1 1 31 TYR CG C 11.098 5.516 1.664 1.00 . A A . 31 TYR CG 1 1 15 7642 1 1 31 TYR CZ C 13.845 5.955 1.591 1.00 . A A . 31 TYR CZ 1 1 15 7643 1 1 31 TYR H H 9.454 6.044 -0.804 1.00 . A A . 31 TYR H 1 1 15 7644 1 1 31 TYR HA H 9.403 3.467 0.577 1.00 . A A . 31 TYR HA 1 1 15 7645 1 1 31 TYR HB2 H 9.100 6.246 1.741 1.00 . A A . 31 TYR HB2 1 1 15 7646 1 1 31 TYR HB3 H 9.360 4.755 2.629 1.00 . A A . 31 TYR HB3 1 1 15 7647 1 1 31 TYR HD1 H 10.969 7.350 0.568 1.00 . A A . 31 TYR HD1 1 1 15 7648 1 1 31 TYR HD2 H 11.590 3.747 2.742 1.00 . A A . 31 TYR HD2 1 1 15 7649 1 1 31 TYR HE1 H 13.383 7.739 0.509 1.00 . A A . 31 TYR HE1 1 1 15 7650 1 1 31 TYR HE2 H 14.014 4.127 2.684 1.00 . A A . 31 TYR HE2 1 1 15 7651 1 1 31 TYR HH H 15.380 7.106 1.742 1.00 . A A . 31 TYR HH 1 1 15 7652 1 1 31 TYR N N 9.419 5.070 -0.712 1.00 . A A . 31 TYR N 1 1 15 7653 1 1 31 TYR O O 6.910 3.562 1.278 1.00 . A A . 31 TYR O 1 1 15 7654 1 1 31 TYR OH O 15.212 6.172 1.548 1.00 . A A . 31 TYR OH 1 1 15 7655 1 1 32 TYR C C 4.738 4.600 -1.126 1.00 . A A . 32 TYR C 1 1 15 7656 1 1 32 TYR CA C 5.384 5.404 -0.008 1.00 . A A . 32 TYR CA 1 1 15 7657 1 1 32 TYR CB C 4.889 6.842 -0.029 1.00 . A A . 32 TYR CB 1 1 15 7658 1 1 32 TYR CD1 C 3.110 6.729 1.719 1.00 . A A . 32 TYR CD1 1 1 15 7659 1 1 32 TYR CD2 C 2.457 7.425 -0.459 1.00 . A A . 32 TYR CD2 1 1 15 7660 1 1 32 TYR CE1 C 1.833 6.891 2.170 1.00 . A A . 32 TYR CE1 1 1 15 7661 1 1 32 TYR CE2 C 1.157 7.581 -0.009 1.00 . A A . 32 TYR CE2 1 1 15 7662 1 1 32 TYR CG C 3.456 6.992 0.409 1.00 . A A . 32 TYR CG 1 1 15 7663 1 1 32 TYR CZ C 0.860 7.315 1.312 1.00 . A A . 32 TYR CZ 1 1 15 7664 1 1 32 TYR H H 7.323 5.963 -0.638 1.00 . A A . 32 TYR H 1 1 15 7665 1 1 32 TYR HA H 5.091 4.959 0.931 1.00 . A A . 32 TYR HA 1 1 15 7666 1 1 32 TYR HB2 H 5.497 7.440 0.631 1.00 . A A . 32 TYR HB2 1 1 15 7667 1 1 32 TYR HB3 H 4.960 7.224 -1.036 1.00 . A A . 32 TYR HB3 1 1 15 7668 1 1 32 TYR HD1 H 3.877 6.392 2.397 1.00 . A A . 32 TYR HD1 1 1 15 7669 1 1 32 TYR HD2 H 2.694 7.629 -1.494 1.00 . A A . 32 TYR HD2 1 1 15 7670 1 1 32 TYR HE1 H 1.594 6.667 3.199 1.00 . A A . 32 TYR HE1 1 1 15 7671 1 1 32 TYR HE2 H 0.379 7.910 -0.682 1.00 . A A . 32 TYR HE2 1 1 15 7672 1 1 32 TYR HH H -1.041 7.115 1.165 1.00 . A A . 32 TYR HH 1 1 15 7673 1 1 32 TYR N N 6.825 5.344 -0.069 1.00 . A A . 32 TYR N 1 1 15 7674 1 1 32 TYR O O 4.856 4.930 -2.307 1.00 . A A . 32 TYR O 1 1 15 7675 1 1 32 TYR OH O -0.408 7.502 1.783 1.00 . A A . 32 TYR OH 1 1 15 7676 1 1 33 SER C C 1.975 2.524 -1.061 1.00 . A A . 33 SER C 1 1 15 7677 1 1 33 SER CA C 3.326 2.783 -1.699 1.00 . A A . 33 SER CA 1 1 15 7678 1 1 33 SER CB C 4.105 1.488 -1.964 1.00 . A A . 33 SER CB 1 1 15 7679 1 1 33 SER H H 4.018 3.328 0.180 1.00 . A A . 33 SER H 1 1 15 7680 1 1 33 SER HA H 3.198 3.342 -2.615 1.00 . A A . 33 SER HA 1 1 15 7681 1 1 33 SER HB2 H 4.115 0.882 -1.070 1.00 . A A . 33 SER HB2 1 1 15 7682 1 1 33 SER HB3 H 3.636 0.942 -2.769 1.00 . A A . 33 SER HB3 1 1 15 7683 1 1 33 SER HG H 5.505 2.755 -2.458 1.00 . A A . 33 SER HG 1 1 15 7684 1 1 33 SER N N 4.057 3.582 -0.766 1.00 . A A . 33 SER N 1 1 15 7685 1 1 33 SER O O 1.925 2.101 0.080 1.00 . A A . 33 SER O 1 1 15 7686 1 1 33 SER OG O 5.454 1.799 -2.343 1.00 . A A . 33 SER OG 1 1 15 7687 1 1 34 GLN C C -1.396 1.914 -2.002 1.00 . A A . 34 GLN C 1 1 15 7688 1 1 34 GLN CA C -0.420 2.739 -1.156 1.00 . A A . 34 GLN CA 1 1 15 7689 1 1 34 GLN CB C -0.930 4.178 -0.910 1.00 . A A . 34 GLN CB 1 1 15 7690 1 1 34 GLN CD C -2.796 5.694 -0.151 1.00 . A A . 34 GLN CD 1 1 15 7691 1 1 34 GLN CG C -2.365 4.279 -0.435 1.00 . A A . 34 GLN CG 1 1 15 7692 1 1 34 GLN H H 0.981 3.014 -2.713 1.00 . A A . 34 GLN H 1 1 15 7693 1 1 34 GLN HA H -0.317 2.251 -0.198 1.00 . A A . 34 GLN HA 1 1 15 7694 1 1 34 GLN HB2 H -0.313 4.619 -0.144 1.00 . A A . 34 GLN HB2 1 1 15 7695 1 1 34 GLN HB3 H -0.821 4.771 -1.807 1.00 . A A . 34 GLN HB3 1 1 15 7696 1 1 34 GLN HE21 H -2.339 5.504 1.774 1.00 . A A . 34 GLN HE21 1 1 15 7697 1 1 34 GLN HE22 H -3.004 7.015 1.307 1.00 . A A . 34 GLN HE22 1 1 15 7698 1 1 34 GLN HG2 H -3.012 3.875 -1.201 1.00 . A A . 34 GLN HG2 1 1 15 7699 1 1 34 GLN HG3 H -2.480 3.691 0.467 1.00 . A A . 34 GLN HG3 1 1 15 7700 1 1 34 GLN N N 0.904 2.800 -1.756 1.00 . A A . 34 GLN N 1 1 15 7701 1 1 34 GLN NE2 N -2.692 6.109 1.083 1.00 . A A . 34 GLN NE2 1 1 15 7702 1 1 34 GLN O O -1.249 1.839 -3.220 1.00 . A A . 34 GLN O 1 1 15 7703 1 1 34 GLN OE1 O -3.263 6.393 -1.029 1.00 . A A . 34 GLN OE1 1 1 15 7704 1 1 35 CYS C C -4.418 1.413 -2.571 1.00 . A A . 35 CYS C 1 1 15 7705 1 1 35 CYS CA C -3.369 0.484 -1.996 1.00 . A A . 35 CYS CA 1 1 15 7706 1 1 35 CYS CB C -4.050 -0.463 -1.013 1.00 . A A . 35 CYS CB 1 1 15 7707 1 1 35 CYS H H -2.351 1.277 -0.352 1.00 . A A . 35 CYS H 1 1 15 7708 1 1 35 CYS HA H -2.915 -0.095 -2.785 1.00 . A A . 35 CYS HA 1 1 15 7709 1 1 35 CYS HB2 H -4.674 0.090 -0.329 1.00 . A A . 35 CYS HB2 1 1 15 7710 1 1 35 CYS HB3 H -4.691 -1.102 -1.594 1.00 . A A . 35 CYS HB3 1 1 15 7711 1 1 35 CYS N N -2.342 1.256 -1.336 1.00 . A A . 35 CYS N 1 1 15 7712 1 1 35 CYS O O -5.152 2.086 -1.819 1.00 . A A . 35 CYS O 1 1 15 7713 1 1 35 CYS SG S -2.919 -1.530 -0.069 1.00 . A A . 35 CYS SG 1 1 15 7714 1 1 36 LEU C C -6.374 1.345 -5.310 1.00 . A A . 36 LEU C 1 1 15 7715 1 1 36 LEU CA C -5.421 2.261 -4.579 1.00 . A A . 36 LEU CA 1 1 15 7716 1 1 36 LEU CB C -4.712 3.217 -5.548 1.00 . A A . 36 LEU CB 1 1 15 7717 1 1 36 LEU CD1 C -3.095 5.096 -5.977 1.00 . A A . 36 LEU CD1 1 1 15 7718 1 1 36 LEU CD2 C -4.539 5.157 -3.941 1.00 . A A . 36 LEU CD2 1 1 15 7719 1 1 36 LEU CG C -3.774 4.257 -4.908 1.00 . A A . 36 LEU CG 1 1 15 7720 1 1 36 LEU H H -3.872 0.896 -4.394 1.00 . A A . 36 LEU H 1 1 15 7721 1 1 36 LEU HA H -5.986 2.833 -3.858 1.00 . A A . 36 LEU HA 1 1 15 7722 1 1 36 LEU HB2 H -4.131 2.622 -6.239 1.00 . A A . 36 LEU HB2 1 1 15 7723 1 1 36 LEU HB3 H -5.470 3.745 -6.109 1.00 . A A . 36 LEU HB3 1 1 15 7724 1 1 36 LEU HD11 H -2.457 5.829 -5.505 1.00 . A A . 36 LEU HD11 1 1 15 7725 1 1 36 LEU HD12 H -3.842 5.593 -6.577 1.00 . A A . 36 LEU HD12 1 1 15 7726 1 1 36 LEU HD13 H -2.495 4.454 -6.607 1.00 . A A . 36 LEU HD13 1 1 15 7727 1 1 36 LEU HD21 H -3.862 5.883 -3.518 1.00 . A A . 36 LEU HD21 1 1 15 7728 1 1 36 LEU HD22 H -4.955 4.561 -3.143 1.00 . A A . 36 LEU HD22 1 1 15 7729 1 1 36 LEU HD23 H -5.333 5.667 -4.467 1.00 . A A . 36 LEU HD23 1 1 15 7730 1 1 36 LEU HG H -3.002 3.743 -4.355 1.00 . A A . 36 LEU HG 1 1 15 7731 1 1 36 LEU N N -4.483 1.458 -3.863 1.00 . A A . 36 LEU N 1 1 15 7732 1 1 36 LEU O O -7.590 1.437 -5.072 1.00 . A A . 36 LEU O 1 1 15 7733 1 1 36 LEU OXT O -5.903 0.447 -6.040 1.00 . A A . 36 LEU OXT 1 1 15 7734 2 2 1 MAN C1 C 9.736 -2.771 9.048 1.00 . B A . 101 MAN C1 1 1 15 7735 2 2 1 MAN C2 C 10.021 -3.734 10.238 1.00 . B A . 101 MAN C2 1 1 15 7736 2 2 1 MAN C3 C 10.435 -2.953 11.477 1.00 . B A . 101 MAN C3 1 1 15 7737 2 2 1 MAN C4 C 11.119 -1.669 11.072 1.00 . B A . 101 MAN C4 1 1 15 7738 2 2 1 MAN C5 C 10.089 -0.753 10.357 1.00 . B A . 101 MAN C5 1 1 15 7739 2 2 1 MAN C6 C 10.727 0.277 9.434 1.00 . B A . 101 MAN C6 1 1 15 7740 2 2 1 MAN H1 H 10.689 -2.497 8.573 1.00 . B A . 101 MAN H1 1 1 15 7741 2 2 1 MAN H2 H 9.122 -4.307 10.513 1.00 . B A . 101 MAN H2 1 1 15 7742 2 2 1 MAN H3 H 9.541 -2.720 12.076 1.00 . B A . 101 MAN H3 1 1 15 7743 2 2 1 MAN H4 H 11.937 -1.896 10.372 1.00 . B A . 101 MAN H4 1 1 15 7744 2 2 1 MAN H5 H 9.468 -0.239 11.106 1.00 . B A . 101 MAN H5 1 1 15 7745 2 2 1 MAN H61 H 11.259 1.013 10.053 1.00 . B A . 101 MAN H61 1 1 15 7746 2 2 1 MAN H62 H 9.926 0.816 8.904 1.00 . B A . 101 MAN H62 1 1 15 7747 2 2 1 MAN HO2 H 11.264 -4.986 10.822 1.00 . B A . 101 MAN HO2 1 1 15 7748 2 2 1 MAN HO3 H 11.612 -3.214 12.973 1.00 . B A . 101 MAN HO3 1 1 15 7749 2 2 1 MAN HO4 H 12.085 -0.230 11.968 1.00 . B A . 101 MAN HO4 1 1 15 7750 2 2 1 MAN HO6 H 12.335 0.278 8.327 1.00 . B A . 101 MAN HO6 1 1 15 7751 2 2 1 MAN O2 O 11.077 -4.618 9.945 1.00 . B A . 101 MAN O2 1 1 15 7752 2 2 1 MAN O3 O 11.353 -3.747 12.215 1.00 . B A . 101 MAN O3 1 1 15 7753 2 2 1 MAN O4 O 11.642 -1.043 12.235 1.00 . B A . 101 MAN O4 1 1 15 7754 2 2 1 MAN O5 O 9.172 -1.559 9.547 1.00 . B A . 101 MAN O5 1 1 15 7755 2 2 1 MAN O6 O 11.603 -0.330 8.474 1.00 . B A . 101 MAN O6 1 1 16 7756 1 1 1 THR C C -5.802 -6.355 4.013 1.00 . A A . 1 THR C 1 1 16 7757 1 1 1 THR CA C -5.812 -7.735 3.364 1.00 . A A . 1 THR CA 1 1 16 7758 1 1 1 THR CB C -6.903 -7.818 2.283 1.00 . A A . 1 THR CB 1 1 16 7759 1 1 1 THR CG2 C -6.751 -9.074 1.438 1.00 . A A . 1 THR CG2 1 1 16 7760 1 1 1 THR H1 H -5.289 -8.710 5.088 1.00 . A A . 1 THR H1 1 1 16 7761 1 1 1 THR H2 H -6.117 -9.683 3.964 1.00 . A A . 1 THR H2 1 1 16 7762 1 1 1 THR H3 H -6.942 -8.492 4.844 1.00 . A A . 1 THR H3 1 1 16 7763 1 1 1 THR HA H -4.849 -7.915 2.910 1.00 . A A . 1 THR HA 1 1 16 7764 1 1 1 THR HB H -6.807 -6.950 1.646 1.00 . A A . 1 THR HB 1 1 16 7765 1 1 1 THR HG1 H -8.879 -7.959 2.235 1.00 . A A . 1 THR HG1 1 1 16 7766 1 1 1 THR HG21 H -5.788 -9.067 0.950 1.00 . A A . 1 THR HG21 1 1 16 7767 1 1 1 THR HG22 H -7.530 -9.099 0.690 1.00 . A A . 1 THR HG22 1 1 16 7768 1 1 1 THR HG23 H -6.827 -9.947 2.069 1.00 . A A . 1 THR HG23 1 1 16 7769 1 1 1 THR N N -6.045 -8.732 4.377 1.00 . A A . 1 THR N 1 1 16 7770 1 1 1 THR O O -6.358 -6.179 5.107 1.00 . A A . 1 THR O 1 1 16 7771 1 1 1 THR OG1 O -8.193 -7.814 2.898 1.00 . A A . 1 THR OG1 1 1 16 7772 1 1 2 GLN C C -6.157 -3.165 3.319 1.00 . A A . 2 GLN C 1 1 16 7773 1 1 2 GLN CA C -5.086 -4.066 3.956 1.00 . A A . 2 GLN CA 1 1 16 7774 1 1 2 GLN CB C -3.707 -3.438 3.771 1.00 . A A . 2 GLN CB 1 1 16 7775 1 1 2 GLN CD C -2.294 -1.414 4.330 1.00 . A A . 2 GLN CD 1 1 16 7776 1 1 2 GLN CG C -3.510 -2.215 4.647 1.00 . A A . 2 GLN CG 1 1 16 7777 1 1 2 GLN H H -4.628 -5.602 2.587 1.00 . A A . 2 GLN H 1 1 16 7778 1 1 2 GLN HA H -5.292 -4.146 5.013 1.00 . A A . 2 GLN HA 1 1 16 7779 1 1 2 GLN HB2 H -2.947 -4.166 4.008 1.00 . A A . 2 GLN HB2 1 1 16 7780 1 1 2 GLN HB3 H -3.599 -3.135 2.740 1.00 . A A . 2 GLN HB3 1 1 16 7781 1 1 2 GLN HE21 H -1.250 -3.014 3.756 1.00 . A A . 2 GLN HE21 1 1 16 7782 1 1 2 GLN HE22 H -0.500 -1.453 3.682 1.00 . A A . 2 GLN HE22 1 1 16 7783 1 1 2 GLN HG2 H -4.367 -1.568 4.537 1.00 . A A . 2 GLN HG2 1 1 16 7784 1 1 2 GLN HG3 H -3.452 -2.546 5.674 1.00 . A A . 2 GLN HG3 1 1 16 7785 1 1 2 GLN N N -5.133 -5.399 3.405 1.00 . A A . 2 GLN N 1 1 16 7786 1 1 2 GLN NE2 N -1.264 -2.037 3.884 1.00 . A A . 2 GLN NE2 1 1 16 7787 1 1 2 GLN O O -6.635 -3.430 2.204 1.00 . A A . 2 GLN O 1 1 16 7788 1 1 2 GLN OE1 O -2.288 -0.206 4.528 1.00 . A A . 2 GLN OE1 1 1 16 7789 1 1 3 SER C C -7.072 -0.304 2.437 1.00 . A A . 3 SER C 1 1 16 7790 1 1 3 SER CA C -7.475 -1.126 3.682 1.00 . A A . 3 SER CA 1 1 16 7791 1 1 3 SER CB C -7.566 -0.193 4.872 1.00 . A A . 3 SER CB 1 1 16 7792 1 1 3 SER H H -6.077 -1.976 4.911 1.00 . A A . 3 SER H 1 1 16 7793 1 1 3 SER HA H -8.444 -1.578 3.548 1.00 . A A . 3 SER HA 1 1 16 7794 1 1 3 SER HB2 H -6.644 0.368 4.929 1.00 . A A . 3 SER HB2 1 1 16 7795 1 1 3 SER HB3 H -8.405 0.478 4.765 1.00 . A A . 3 SER HB3 1 1 16 7796 1 1 3 SER HG H -7.961 -0.319 6.769 1.00 . A A . 3 SER HG 1 1 16 7797 1 1 3 SER N N -6.498 -2.121 4.039 1.00 . A A . 3 SER N 1 1 16 7798 1 1 3 SER O O -5.908 -0.297 2.005 1.00 . A A . 3 SER O 1 1 16 7799 1 1 3 SER OG O -7.709 -0.944 6.075 1.00 . A A . 3 SER OG 1 1 16 7800 1 1 4 HIS C C -7.276 2.588 1.365 1.00 . A A . 4 HIS C 1 1 16 7801 1 1 4 HIS CA C -7.830 1.297 0.779 1.00 . A A . 4 HIS CA 1 1 16 7802 1 1 4 HIS CB C -9.174 1.545 0.062 1.00 . A A . 4 HIS CB 1 1 16 7803 1 1 4 HIS CD2 C -8.224 2.278 -2.254 1.00 . A A . 4 HIS CD2 1 1 16 7804 1 1 4 HIS CE1 C -9.811 3.655 -2.823 1.00 . A A . 4 HIS CE1 1 1 16 7805 1 1 4 HIS CG C -9.105 2.323 -1.231 1.00 . A A . 4 HIS CG 1 1 16 7806 1 1 4 HIS H H -8.945 0.336 2.278 1.00 . A A . 4 HIS H 1 1 16 7807 1 1 4 HIS HA H -7.115 0.860 0.099 1.00 . A A . 4 HIS HA 1 1 16 7808 1 1 4 HIS HB2 H -9.636 0.595 -0.158 1.00 . A A . 4 HIS HB2 1 1 16 7809 1 1 4 HIS HB3 H -9.821 2.086 0.736 1.00 . A A . 4 HIS HB3 1 1 16 7810 1 1 4 HIS HD1 H -10.860 3.453 -1.080 1.00 . A A . 4 HIS HD1 1 1 16 7811 1 1 4 HIS HD2 H -7.319 1.687 -2.282 1.00 . A A . 4 HIS HD2 1 1 16 7812 1 1 4 HIS HE1 H -10.416 4.356 -3.378 1.00 . A A . 4 HIS HE1 1 1 16 7813 1 1 4 HIS HE2 H -8.506 2.954 -4.191 1.00 . A A . 4 HIS HE2 1 1 16 7814 1 1 4 HIS N N -8.045 0.402 1.891 1.00 . A A . 4 HIS N 1 1 16 7815 1 1 4 HIS ND1 N -10.077 3.197 -1.618 1.00 . A A . 4 HIS ND1 1 1 16 7816 1 1 4 HIS NE2 N -8.685 3.113 -3.234 1.00 . A A . 4 HIS NE2 1 1 16 7817 1 1 4 HIS O O -7.786 3.059 2.382 1.00 . A A . 4 HIS O 1 1 16 7818 1 1 5 TYR C C -4.717 4.035 2.491 1.00 . A A . 5 TYR C 1 1 16 7819 1 1 5 TYR CA C -5.542 4.329 1.251 1.00 . A A . 5 TYR CA 1 1 16 7820 1 1 5 TYR CB C -6.432 5.579 1.414 1.00 . A A . 5 TYR CB 1 1 16 7821 1 1 5 TYR CD1 C -7.953 5.937 -0.570 1.00 . A A . 5 TYR CD1 1 1 16 7822 1 1 5 TYR CD2 C -5.941 7.181 -0.444 1.00 . A A . 5 TYR CD2 1 1 16 7823 1 1 5 TYR CE1 C -8.255 6.554 -1.768 1.00 . A A . 5 TYR CE1 1 1 16 7824 1 1 5 TYR CE2 C -6.234 7.798 -1.633 1.00 . A A . 5 TYR CE2 1 1 16 7825 1 1 5 TYR CG C -6.788 6.244 0.110 1.00 . A A . 5 TYR CG 1 1 16 7826 1 1 5 TYR CZ C -7.387 7.485 -2.293 1.00 . A A . 5 TYR CZ 1 1 16 7827 1 1 5 TYR H H -5.895 2.715 -0.079 1.00 . A A . 5 TYR H 1 1 16 7828 1 1 5 TYR HA H -4.806 4.533 0.484 1.00 . A A . 5 TYR HA 1 1 16 7829 1 1 5 TYR HB2 H -7.352 5.281 1.893 1.00 . A A . 5 TYR HB2 1 1 16 7830 1 1 5 TYR HB3 H -5.924 6.301 2.037 1.00 . A A . 5 TYR HB3 1 1 16 7831 1 1 5 TYR HD1 H -8.631 5.204 -0.157 1.00 . A A . 5 TYR HD1 1 1 16 7832 1 1 5 TYR HD2 H -5.027 7.432 0.075 1.00 . A A . 5 TYR HD2 1 1 16 7833 1 1 5 TYR HE1 H -9.167 6.303 -2.288 1.00 . A A . 5 TYR HE1 1 1 16 7834 1 1 5 TYR HE2 H -5.551 8.526 -2.040 1.00 . A A . 5 TYR HE2 1 1 16 7835 1 1 5 TYR HH H -8.596 8.402 -3.439 1.00 . A A . 5 TYR HH 1 1 16 7836 1 1 5 TYR N N -6.234 3.134 0.744 1.00 . A A . 5 TYR N 1 1 16 7837 1 1 5 TYR O O -4.980 4.537 3.592 1.00 . A A . 5 TYR O 1 1 16 7838 1 1 5 TYR OH O -7.679 8.103 -3.491 1.00 . A A . 5 TYR OH 1 1 16 7839 1 1 6 GLY C C -1.627 2.280 2.661 1.00 . A A . 6 GLY C 1 1 16 7840 1 1 6 GLY CA C -2.866 2.775 3.328 1.00 . A A . 6 GLY CA 1 1 16 7841 1 1 6 GLY H H -3.715 2.681 1.455 1.00 . A A . 6 GLY H 1 1 16 7842 1 1 6 GLY HA2 H -2.636 3.644 3.927 1.00 . A A . 6 GLY HA2 1 1 16 7843 1 1 6 GLY HA3 H -3.273 1.990 3.948 1.00 . A A . 6 GLY HA3 1 1 16 7844 1 1 6 GLY N N -3.797 3.140 2.315 1.00 . A A . 6 GLY N 1 1 16 7845 1 1 6 GLY O O -1.697 1.856 1.494 1.00 . A A . 6 GLY O 1 1 16 7846 1 1 7 GLN C C 0.809 0.405 2.781 1.00 . A A . 7 GLN C 1 1 16 7847 1 1 7 GLN CA C 0.740 1.917 2.787 1.00 . A A . 7 GLN CA 1 1 16 7848 1 1 7 GLN CB C 1.910 2.539 3.560 1.00 . A A . 7 GLN CB 1 1 16 7849 1 1 7 GLN CD C 4.395 2.915 3.798 1.00 . A A . 7 GLN CD 1 1 16 7850 1 1 7 GLN CG C 3.303 2.164 3.056 1.00 . A A . 7 GLN CG 1 1 16 7851 1 1 7 GLN H H -0.540 2.640 4.275 1.00 . A A . 7 GLN H 1 1 16 7852 1 1 7 GLN HA H 0.772 2.263 1.764 1.00 . A A . 7 GLN HA 1 1 16 7853 1 1 7 GLN HB2 H 1.826 3.613 3.506 1.00 . A A . 7 GLN HB2 1 1 16 7854 1 1 7 GLN HB3 H 1.836 2.237 4.594 1.00 . A A . 7 GLN HB3 1 1 16 7855 1 1 7 GLN HE21 H 5.666 2.842 2.236 1.00 . A A . 7 GLN HE21 1 1 16 7856 1 1 7 GLN HE22 H 6.230 3.591 3.667 1.00 . A A . 7 GLN HE22 1 1 16 7857 1 1 7 GLN HG2 H 3.447 1.105 3.220 1.00 . A A . 7 GLN HG2 1 1 16 7858 1 1 7 GLN HG3 H 3.378 2.371 2.000 1.00 . A A . 7 GLN HG3 1 1 16 7859 1 1 7 GLN N N -0.516 2.341 3.341 1.00 . A A . 7 GLN N 1 1 16 7860 1 1 7 GLN NE2 N 5.520 3.136 3.158 1.00 . A A . 7 GLN NE2 1 1 16 7861 1 1 7 GLN O O 0.871 -0.222 3.820 1.00 . A A . 7 GLN O 1 1 16 7862 1 1 7 GLN OE1 O 4.228 3.286 4.953 1.00 . A A . 7 GLN OE1 1 1 16 7863 1 1 8 CYS C C 2.089 -2.214 1.763 1.00 . A A . 8 CYS C 1 1 16 7864 1 1 8 CYS CA C 0.757 -1.602 1.421 1.00 . A A . 8 CYS CA 1 1 16 7865 1 1 8 CYS CB C 0.377 -1.928 -0.015 1.00 . A A . 8 CYS CB 1 1 16 7866 1 1 8 CYS H H 0.732 0.421 0.816 1.00 . A A . 8 CYS H 1 1 16 7867 1 1 8 CYS HA H 0.001 -2.018 2.071 1.00 . A A . 8 CYS HA 1 1 16 7868 1 1 8 CYS HB2 H 0.557 -2.979 -0.196 1.00 . A A . 8 CYS HB2 1 1 16 7869 1 1 8 CYS HB3 H -0.672 -1.716 -0.162 1.00 . A A . 8 CYS HB3 1 1 16 7870 1 1 8 CYS N N 0.763 -0.160 1.606 1.00 . A A . 8 CYS N 1 1 16 7871 1 1 8 CYS O O 2.173 -3.165 2.521 1.00 . A A . 8 CYS O 1 1 16 7872 1 1 8 CYS SG S 1.319 -0.974 -1.260 1.00 . A A . 8 CYS SG 1 1 16 7873 1 1 9 GLY C C 5.405 -1.337 0.742 1.00 . A A . 9 GLY C 1 1 16 7874 1 1 9 GLY CA C 4.407 -2.172 1.427 1.00 . A A . 9 GLY CA 1 1 16 7875 1 1 9 GLY H H 2.997 -0.855 0.667 1.00 . A A . 9 GLY H 1 1 16 7876 1 1 9 GLY HA2 H 4.627 -2.199 2.483 1.00 . A A . 9 GLY HA2 1 1 16 7877 1 1 9 GLY HA3 H 4.453 -3.172 1.023 1.00 . A A . 9 GLY HA3 1 1 16 7878 1 1 9 GLY N N 3.118 -1.650 1.228 1.00 . A A . 9 GLY N 1 1 16 7879 1 1 9 GLY O O 5.703 -1.548 -0.427 1.00 . A A . 9 GLY O 1 1 16 7880 1 1 10 GLY C C 8.136 0.248 1.637 1.00 . A A . 10 GLY C 1 1 16 7881 1 1 10 GLY CA C 6.867 0.486 0.901 1.00 . A A . 10 GLY CA 1 1 16 7882 1 1 10 GLY H H 5.543 -0.216 2.343 1.00 . A A . 10 GLY H 1 1 16 7883 1 1 10 GLY HA2 H 6.998 0.257 -0.145 1.00 . A A . 10 GLY HA2 1 1 16 7884 1 1 10 GLY HA3 H 6.579 1.520 1.017 1.00 . A A . 10 GLY HA3 1 1 16 7885 1 1 10 GLY N N 5.860 -0.353 1.428 1.00 . A A . 10 GLY N 1 1 16 7886 1 1 10 GLY O O 8.130 -0.478 2.642 1.00 . A A . 10 GLY O 1 1 16 7887 1 1 11 ILE C C 10.413 1.305 3.229 1.00 . A A . 11 ILE C 1 1 16 7888 1 1 11 ILE CA C 10.496 0.698 1.825 1.00 . A A . 11 ILE CA 1 1 16 7889 1 1 11 ILE CB C 11.620 1.404 1.018 1.00 . A A . 11 ILE CB 1 1 16 7890 1 1 11 ILE CD1 C 12.679 1.555 -1.321 1.00 . A A . 11 ILE CD1 1 1 16 7891 1 1 11 ILE CG1 C 11.654 0.876 -0.427 1.00 . A A . 11 ILE CG1 1 1 16 7892 1 1 11 ILE CG2 C 12.974 1.190 1.696 1.00 . A A . 11 ILE CG2 1 1 16 7893 1 1 11 ILE H H 9.130 1.383 0.367 1.00 . A A . 11 ILE H 1 1 16 7894 1 1 11 ILE HA H 10.722 -0.355 1.908 1.00 . A A . 11 ILE HA 1 1 16 7895 1 1 11 ILE HB H 11.409 2.464 0.999 1.00 . A A . 11 ILE HB 1 1 16 7896 1 1 11 ILE HD11 H 12.474 2.614 -1.366 1.00 . A A . 11 ILE HD11 1 1 16 7897 1 1 11 ILE HD12 H 12.622 1.135 -2.314 1.00 . A A . 11 ILE HD12 1 1 16 7898 1 1 11 ILE HD13 H 13.669 1.395 -0.918 1.00 . A A . 11 ILE HD13 1 1 16 7899 1 1 11 ILE HG12 H 11.889 -0.176 -0.402 1.00 . A A . 11 ILE HG12 1 1 16 7900 1 1 11 ILE HG13 H 10.679 1.009 -0.872 1.00 . A A . 11 ILE HG13 1 1 16 7901 1 1 11 ILE HG21 H 12.944 1.584 2.701 1.00 . A A . 11 ILE HG21 1 1 16 7902 1 1 11 ILE HG22 H 13.744 1.699 1.134 1.00 . A A . 11 ILE HG22 1 1 16 7903 1 1 11 ILE HG23 H 13.192 0.132 1.728 1.00 . A A . 11 ILE HG23 1 1 16 7904 1 1 11 ILE N N 9.209 0.834 1.174 1.00 . A A . 11 ILE N 1 1 16 7905 1 1 11 ILE O O 10.173 2.501 3.380 1.00 . A A . 11 ILE O 1 1 16 7906 1 1 12 GLY C C 9.173 0.482 6.256 1.00 . A A . 12 GLY C 1 1 16 7907 1 1 12 GLY CA C 10.464 0.909 5.591 1.00 . A A . 12 GLY CA 1 1 16 7908 1 1 12 GLY H H 10.662 -0.488 4.028 1.00 . A A . 12 GLY H 1 1 16 7909 1 1 12 GLY HA2 H 11.297 0.481 6.131 1.00 . A A . 12 GLY HA2 1 1 16 7910 1 1 12 GLY HA3 H 10.541 1.985 5.622 1.00 . A A . 12 GLY HA3 1 1 16 7911 1 1 12 GLY N N 10.532 0.464 4.223 1.00 . A A . 12 GLY N 1 1 16 7912 1 1 12 GLY O O 9.024 0.584 7.480 1.00 . A A . 12 GLY O 1 1 16 7913 1 1 13 TYR C C 6.959 -1.974 6.006 1.00 . A A . 13 TYR C 1 1 16 7914 1 1 13 TYR CA C 6.983 -0.469 5.990 1.00 . A A . 13 TYR CA 1 1 16 7915 1 1 13 TYR CB C 5.786 0.056 5.165 1.00 . A A . 13 TYR CB 1 1 16 7916 1 1 13 TYR CD1 C 3.694 0.279 6.601 1.00 . A A . 13 TYR CD1 1 1 16 7917 1 1 13 TYR CD2 C 3.877 -1.638 5.194 1.00 . A A . 13 TYR CD2 1 1 16 7918 1 1 13 TYR CE1 C 2.474 -0.181 7.063 1.00 . A A . 13 TYR CE1 1 1 16 7919 1 1 13 TYR CE2 C 2.662 -2.099 5.647 1.00 . A A . 13 TYR CE2 1 1 16 7920 1 1 13 TYR CG C 4.421 -0.440 5.659 1.00 . A A . 13 TYR CG 1 1 16 7921 1 1 13 TYR CZ C 1.963 -1.372 6.582 1.00 . A A . 13 TYR CZ 1 1 16 7922 1 1 13 TYR H H 8.402 -0.080 4.498 1.00 . A A . 13 TYR H 1 1 16 7923 1 1 13 TYR HA H 6.894 -0.098 7.000 1.00 . A A . 13 TYR HA 1 1 16 7924 1 1 13 TYR HB2 H 5.775 1.134 5.200 1.00 . A A . 13 TYR HB2 1 1 16 7925 1 1 13 TYR HB3 H 5.905 -0.263 4.140 1.00 . A A . 13 TYR HB3 1 1 16 7926 1 1 13 TYR HD1 H 4.093 1.210 6.976 1.00 . A A . 13 TYR HD1 1 1 16 7927 1 1 13 TYR HD2 H 4.426 -2.213 4.464 1.00 . A A . 13 TYR HD2 1 1 16 7928 1 1 13 TYR HE1 H 1.922 0.391 7.795 1.00 . A A . 13 TYR HE1 1 1 16 7929 1 1 13 TYR HE2 H 2.272 -3.031 5.262 1.00 . A A . 13 TYR HE2 1 1 16 7930 1 1 13 TYR HH H 0.109 -1.129 6.963 1.00 . A A . 13 TYR HH 1 1 16 7931 1 1 13 TYR N N 8.239 -0.005 5.466 1.00 . A A . 13 TYR N 1 1 16 7932 1 1 13 TYR O O 7.324 -2.623 5.020 1.00 . A A . 13 TYR O 1 1 16 7933 1 1 13 TYR OH O 0.751 -1.843 7.053 1.00 . A A . 13 TYR OH 1 1 16 7934 1 1 14 SER C C 4.961 -4.181 7.731 1.00 . A A . 14 SER C 1 1 16 7935 1 1 14 SER CA C 6.366 -3.934 7.212 1.00 . A A . 14 SER CA 1 1 16 7936 1 1 14 SER CB C 7.422 -4.540 8.147 1.00 . A A . 14 SER CB 1 1 16 7937 1 1 14 SER H H 6.352 -1.972 7.887 1.00 . A A . 14 SER H 1 1 16 7938 1 1 14 SER HA H 6.457 -4.363 6.226 1.00 . A A . 14 SER HA 1 1 16 7939 1 1 14 SER HB2 H 7.231 -4.177 9.145 1.00 . A A . 14 SER HB2 1 1 16 7940 1 1 14 SER HB3 H 7.348 -5.617 8.143 1.00 . A A . 14 SER HB3 1 1 16 7941 1 1 14 SER N N 6.547 -2.522 7.099 1.00 . A A . 14 SER N 1 1 16 7942 1 1 14 SER O O 4.538 -3.536 8.697 1.00 . A A . 14 SER O 1 1 16 7943 1 1 14 SER OG O 8.785 -4.141 7.762 1.00 . A A . 14 SER OG 1 1 16 7944 1 1 15 GLY C C 2.082 -5.999 6.397 1.00 . A A . 15 GLY C 1 1 16 7945 1 1 15 GLY CA C 2.871 -5.313 7.485 1.00 . A A . 15 GLY CA 1 1 16 7946 1 1 15 GLY H H 4.558 -5.496 6.267 1.00 . A A . 15 GLY H 1 1 16 7947 1 1 15 GLY HA2 H 2.903 -5.952 8.353 1.00 . A A . 15 GLY HA2 1 1 16 7948 1 1 15 GLY HA3 H 2.386 -4.384 7.739 1.00 . A A . 15 GLY HA3 1 1 16 7949 1 1 15 GLY N N 4.217 -5.037 7.067 1.00 . A A . 15 GLY N 1 1 16 7950 1 1 15 GLY O O 2.680 -6.671 5.544 1.00 . A A . 15 GLY O 1 1 16 7951 1 1 16 PRO C C 0.074 -5.847 4.000 1.00 . A A . 16 PRO C 1 1 16 7952 1 1 16 PRO CA C -0.121 -6.469 5.385 1.00 . A A . 16 PRO CA 1 1 16 7953 1 1 16 PRO CB C -1.550 -6.210 5.899 1.00 . A A . 16 PRO CB 1 1 16 7954 1 1 16 PRO CD C -0.030 -5.033 7.330 1.00 . A A . 16 PRO CD 1 1 16 7955 1 1 16 PRO CG C -1.393 -5.652 7.274 1.00 . A A . 16 PRO CG 1 1 16 7956 1 1 16 PRO HA H 0.063 -7.532 5.323 1.00 . A A . 16 PRO HA 1 1 16 7957 1 1 16 PRO HB2 H -2.042 -5.508 5.244 1.00 . A A . 16 PRO HB2 1 1 16 7958 1 1 16 PRO HB3 H -2.102 -7.138 5.915 1.00 . A A . 16 PRO HB3 1 1 16 7959 1 1 16 PRO HD2 H -0.070 -4.002 7.011 1.00 . A A . 16 PRO HD2 1 1 16 7960 1 1 16 PRO HD3 H 0.380 -5.109 8.326 1.00 . A A . 16 PRO HD3 1 1 16 7961 1 1 16 PRO HG2 H -2.152 -4.905 7.455 1.00 . A A . 16 PRO HG2 1 1 16 7962 1 1 16 PRO HG3 H -1.473 -6.448 8.000 1.00 . A A . 16 PRO HG3 1 1 16 7963 1 1 16 PRO N N 0.744 -5.846 6.383 1.00 . A A . 16 PRO N 1 1 16 7964 1 1 16 PRO O O -0.457 -4.773 3.700 1.00 . A A . 16 PRO O 1 1 16 7965 1 1 17 THR C C 0.117 -6.303 0.836 1.00 . A A . 17 THR C 1 1 16 7966 1 1 17 THR CA C 1.199 -6.031 1.874 1.00 . A A . 17 THR CA 1 1 16 7967 1 1 17 THR CB C 2.530 -6.650 1.436 1.00 . A A . 17 THR CB 1 1 16 7968 1 1 17 THR CG2 C 3.686 -6.030 2.196 1.00 . A A . 17 THR CG2 1 1 16 7969 1 1 17 THR H H 1.229 -7.373 3.468 1.00 . A A . 17 THR H 1 1 16 7970 1 1 17 THR HA H 1.345 -4.964 1.950 1.00 . A A . 17 THR HA 1 1 16 7971 1 1 17 THR HB H 2.656 -6.471 0.380 1.00 . A A . 17 THR HB 1 1 16 7972 1 1 17 THR HG1 H 3.129 -8.302 2.372 1.00 . A A . 17 THR HG1 1 1 16 7973 1 1 17 THR HG21 H 4.614 -6.483 1.880 1.00 . A A . 17 THR HG21 1 1 16 7974 1 1 17 THR HG22 H 3.539 -6.190 3.255 1.00 . A A . 17 THR HG22 1 1 16 7975 1 1 17 THR HG23 H 3.716 -4.968 2.003 1.00 . A A . 17 THR HG23 1 1 16 7976 1 1 17 THR N N 0.847 -6.518 3.181 1.00 . A A . 17 THR N 1 1 16 7977 1 1 17 THR O O 0.058 -5.642 -0.208 1.00 . A A . 17 THR O 1 1 16 7978 1 1 17 THR OG1 O 2.499 -8.081 1.675 1.00 . A A . 17 THR OG1 1 1 16 7979 1 1 18 VAL C C -2.987 -6.756 0.555 1.00 . A A . 18 VAL C 1 1 16 7980 1 1 18 VAL CA C -1.793 -7.627 0.223 1.00 . A A . 18 VAL CA 1 1 16 7981 1 1 18 VAL CB C -2.176 -9.125 0.359 1.00 . A A . 18 VAL CB 1 1 16 7982 1 1 18 VAL CG1 C -3.254 -9.510 -0.650 1.00 . A A . 18 VAL CG1 1 1 16 7983 1 1 18 VAL CG2 C -0.945 -10.005 0.186 1.00 . A A . 18 VAL CG2 1 1 16 7984 1 1 18 VAL H H -0.615 -7.747 1.965 1.00 . A A . 18 VAL H 1 1 16 7985 1 1 18 VAL HA H -1.473 -7.427 -0.788 1.00 . A A . 18 VAL HA 1 1 16 7986 1 1 18 VAL HB H -2.573 -9.285 1.352 1.00 . A A . 18 VAL HB 1 1 16 7987 1 1 18 VAL HG11 H -4.131 -8.898 -0.494 1.00 . A A . 18 VAL HG11 1 1 16 7988 1 1 18 VAL HG12 H -3.512 -10.550 -0.522 1.00 . A A . 18 VAL HG12 1 1 16 7989 1 1 18 VAL HG13 H -2.881 -9.356 -1.652 1.00 . A A . 18 VAL HG13 1 1 16 7990 1 1 18 VAL HG21 H -1.220 -11.045 0.272 1.00 . A A . 18 VAL HG21 1 1 16 7991 1 1 18 VAL HG22 H -0.218 -9.762 0.948 1.00 . A A . 18 VAL HG22 1 1 16 7992 1 1 18 VAL HG23 H -0.512 -9.827 -0.786 1.00 . A A . 18 VAL HG23 1 1 16 7993 1 1 18 VAL N N -0.719 -7.273 1.117 1.00 . A A . 18 VAL N 1 1 16 7994 1 1 18 VAL O O -3.454 -6.739 1.693 1.00 . A A . 18 VAL O 1 1 16 7995 1 1 19 CYS C C -5.881 -5.808 -0.411 1.00 . A A . 19 CYS C 1 1 16 7996 1 1 19 CYS CA C -4.535 -5.113 -0.171 1.00 . A A . 19 CYS CA 1 1 16 7997 1 1 19 CYS CB C -4.361 -3.908 -1.078 1.00 . A A . 19 CYS CB 1 1 16 7998 1 1 19 CYS H H -3.086 -6.101 -1.304 1.00 . A A . 19 CYS H 1 1 16 7999 1 1 19 CYS HA H -4.489 -4.786 0.857 1.00 . A A . 19 CYS HA 1 1 16 8000 1 1 19 CYS HB2 H -4.608 -4.157 -2.100 1.00 . A A . 19 CYS HB2 1 1 16 8001 1 1 19 CYS HB3 H -5.030 -3.138 -0.723 1.00 . A A . 19 CYS HB3 1 1 16 8002 1 1 19 CYS N N -3.457 -6.028 -0.400 1.00 . A A . 19 CYS N 1 1 16 8003 1 1 19 CYS O O -5.928 -6.917 -0.977 1.00 . A A . 19 CYS O 1 1 16 8004 1 1 19 CYS SG S -2.681 -3.206 -1.044 1.00 . A A . 19 CYS SG 1 1 16 8005 1 1 20 ALA C C -8.672 -5.894 -1.583 1.00 . A A . 20 ALA C 1 1 16 8006 1 1 20 ALA CA C -8.321 -5.705 -0.111 1.00 . A A . 20 ALA CA 1 1 16 8007 1 1 20 ALA CB C -9.320 -4.768 0.555 1.00 . A A . 20 ALA CB 1 1 16 8008 1 1 20 ALA H H -6.850 -4.333 0.533 1.00 . A A . 20 ALA H 1 1 16 8009 1 1 20 ALA HA H -8.376 -6.665 0.379 1.00 . A A . 20 ALA HA 1 1 16 8010 1 1 20 ALA HB1 H -9.064 -4.649 1.597 1.00 . A A . 20 ALA HB1 1 1 16 8011 1 1 20 ALA HB2 H -10.313 -5.185 0.473 1.00 . A A . 20 ALA HB2 1 1 16 8012 1 1 20 ALA HB3 H -9.294 -3.806 0.065 1.00 . A A . 20 ALA HB3 1 1 16 8013 1 1 20 ALA N N -6.961 -5.185 0.050 1.00 . A A . 20 ALA N 1 1 16 8014 1 1 20 ALA O O -8.046 -5.275 -2.467 1.00 . A A . 20 ALA O 1 1 16 8015 1 1 21 SER C C -10.553 -5.726 -3.873 1.00 . A A . 21 SER C 1 1 16 8016 1 1 21 SER CA C -10.077 -7.021 -3.193 1.00 . A A . 21 SER CA 1 1 16 8017 1 1 21 SER CB C -11.205 -8.042 -3.127 1.00 . A A . 21 SER CB 1 1 16 8018 1 1 21 SER H H -10.115 -7.186 -1.117 1.00 . A A . 21 SER H 1 1 16 8019 1 1 21 SER HA H -9.250 -7.440 -3.744 1.00 . A A . 21 SER HA 1 1 16 8020 1 1 21 SER HB2 H -12.093 -7.578 -2.723 1.00 . A A . 21 SER HB2 1 1 16 8021 1 1 21 SER HB3 H -11.408 -8.409 -4.122 1.00 . A A . 21 SER HB3 1 1 16 8022 1 1 21 SER HG H -11.622 -9.385 -1.790 1.00 . A A . 21 SER HG 1 1 16 8023 1 1 21 SER N N -9.642 -6.732 -1.846 1.00 . A A . 21 SER N 1 1 16 8024 1 1 21 SER O O -11.474 -5.064 -3.395 1.00 . A A . 21 SER O 1 1 16 8025 1 1 21 SER OG O -10.833 -9.150 -2.298 1.00 . A A . 21 SER OG 1 1 16 8026 1 1 22 GLY C C -9.144 -3.093 -5.455 1.00 . A A . 22 GLY C 1 1 16 8027 1 1 22 GLY CA C -10.222 -4.132 -5.630 1.00 . A A . 22 GLY CA 1 1 16 8028 1 1 22 GLY H H -9.160 -5.913 -5.282 1.00 . A A . 22 GLY H 1 1 16 8029 1 1 22 GLY HA2 H -10.354 -4.340 -6.680 1.00 . A A . 22 GLY HA2 1 1 16 8030 1 1 22 GLY HA3 H -11.149 -3.746 -5.233 1.00 . A A . 22 GLY HA3 1 1 16 8031 1 1 22 GLY N N -9.890 -5.351 -4.940 1.00 . A A . 22 GLY N 1 1 16 8032 1 1 22 GLY O O -9.021 -2.173 -6.254 1.00 . A A . 22 GLY O 1 1 16 8033 1 1 23 THR C C -5.932 -2.995 -4.456 1.00 . A A . 23 THR C 1 1 16 8034 1 1 23 THR CA C -7.266 -2.325 -4.158 1.00 . A A . 23 THR CA 1 1 16 8035 1 1 23 THR CB C -7.318 -1.797 -2.687 1.00 . A A . 23 THR CB 1 1 16 8036 1 1 23 THR CG2 C -8.660 -1.154 -2.410 1.00 . A A . 23 THR CG2 1 1 16 8037 1 1 23 THR H H -8.448 -4.045 -3.849 1.00 . A A . 23 THR H 1 1 16 8038 1 1 23 THR HA H -7.387 -1.495 -4.839 1.00 . A A . 23 THR HA 1 1 16 8039 1 1 23 THR HB H -6.541 -1.066 -2.503 1.00 . A A . 23 THR HB 1 1 16 8040 1 1 23 THR HG1 H -7.461 -3.686 -2.165 1.00 . A A . 23 THR HG1 1 1 16 8041 1 1 23 THR HG21 H -8.683 -0.798 -1.391 1.00 . A A . 23 THR HG21 1 1 16 8042 1 1 23 THR HG22 H -9.443 -1.886 -2.551 1.00 . A A . 23 THR HG22 1 1 16 8043 1 1 23 THR HG23 H -8.812 -0.325 -3.085 1.00 . A A . 23 THR HG23 1 1 16 8044 1 1 23 THR N N -8.331 -3.262 -4.429 1.00 . A A . 23 THR N 1 1 16 8045 1 1 23 THR O O -5.765 -4.208 -4.216 1.00 . A A . 23 THR O 1 1 16 8046 1 1 23 THR OG1 O -7.148 -2.863 -1.767 1.00 . A A . 23 THR OG1 1 1 16 8047 1 1 24 THR C C -2.613 -2.001 -4.759 1.00 . A A . 24 THR C 1 1 16 8048 1 1 24 THR CA C -3.742 -2.786 -5.397 1.00 . A A . 24 THR CA 1 1 16 8049 1 1 24 THR CB C -3.593 -2.752 -6.934 1.00 . A A . 24 THR CB 1 1 16 8050 1 1 24 THR CG2 C -4.493 -3.786 -7.593 1.00 . A A . 24 THR CG2 1 1 16 8051 1 1 24 THR H H -5.203 -1.301 -5.172 1.00 . A A . 24 THR H 1 1 16 8052 1 1 24 THR HA H -3.692 -3.817 -5.078 1.00 . A A . 24 THR HA 1 1 16 8053 1 1 24 THR HB H -2.564 -2.966 -7.180 1.00 . A A . 24 THR HB 1 1 16 8054 1 1 24 THR HG1 H -4.613 -1.032 -6.896 1.00 . A A . 24 THR HG1 1 1 16 8055 1 1 24 THR HG21 H -4.363 -3.746 -8.664 1.00 . A A . 24 THR HG21 1 1 16 8056 1 1 24 THR HG22 H -5.523 -3.575 -7.348 1.00 . A A . 24 THR HG22 1 1 16 8057 1 1 24 THR HG23 H -4.235 -4.772 -7.238 1.00 . A A . 24 THR HG23 1 1 16 8058 1 1 24 THR N N -5.019 -2.258 -5.009 1.00 . A A . 24 THR N 1 1 16 8059 1 1 24 THR O O -2.745 -0.803 -4.533 1.00 . A A . 24 THR O 1 1 16 8060 1 1 24 THR OG1 O -3.910 -1.427 -7.441 1.00 . A A . 24 THR OG1 1 1 16 8061 1 1 25 CYS C C 0.344 -1.286 -5.024 1.00 . A A . 25 CYS C 1 1 16 8062 1 1 25 CYS CA C -0.368 -2.032 -3.908 1.00 . A A . 25 CYS CA 1 1 16 8063 1 1 25 CYS CB C 0.568 -3.082 -3.282 1.00 . A A . 25 CYS CB 1 1 16 8064 1 1 25 CYS H H -1.504 -3.637 -4.616 1.00 . A A . 25 CYS H 1 1 16 8065 1 1 25 CYS HA H -0.683 -1.331 -3.149 1.00 . A A . 25 CYS HA 1 1 16 8066 1 1 25 CYS HB2 H 0.028 -3.627 -2.521 1.00 . A A . 25 CYS HB2 1 1 16 8067 1 1 25 CYS HB3 H 0.887 -3.772 -4.048 1.00 . A A . 25 CYS HB3 1 1 16 8068 1 1 25 CYS N N -1.534 -2.669 -4.459 1.00 . A A . 25 CYS N 1 1 16 8069 1 1 25 CYS O O 0.868 -1.905 -5.956 1.00 . A A . 25 CYS O 1 1 16 8070 1 1 25 CYS SG S 2.062 -2.388 -2.500 1.00 . A A . 25 CYS SG 1 1 16 8071 1 1 26 GLN C C 2.004 1.697 -5.399 1.00 . A A . 26 GLN C 1 1 16 8072 1 1 26 GLN CA C 0.930 0.830 -6.002 1.00 . A A . 26 GLN CA 1 1 16 8073 1 1 26 GLN CB C -0.093 1.703 -6.727 1.00 . A A . 26 GLN CB 1 1 16 8074 1 1 26 GLN CD C -2.176 1.802 -8.154 1.00 . A A . 26 GLN CD 1 1 16 8075 1 1 26 GLN CG C -1.183 0.918 -7.435 1.00 . A A . 26 GLN CG 1 1 16 8076 1 1 26 GLN H H -0.195 0.480 -4.266 1.00 . A A . 26 GLN H 1 1 16 8077 1 1 26 GLN HA H 1.385 0.164 -6.719 1.00 . A A . 26 GLN HA 1 1 16 8078 1 1 26 GLN HB2 H -0.560 2.352 -6.001 1.00 . A A . 26 GLN HB2 1 1 16 8079 1 1 26 GLN HB3 H 0.422 2.308 -7.459 1.00 . A A . 26 GLN HB3 1 1 16 8080 1 1 26 GLN HE21 H -3.593 0.474 -7.840 1.00 . A A . 26 GLN HE21 1 1 16 8081 1 1 26 GLN HE22 H -4.086 1.879 -8.694 1.00 . A A . 26 GLN HE22 1 1 16 8082 1 1 26 GLN HG2 H -0.720 0.268 -8.162 1.00 . A A . 26 GLN HG2 1 1 16 8083 1 1 26 GLN HG3 H -1.712 0.319 -6.708 1.00 . A A . 26 GLN HG3 1 1 16 8084 1 1 26 GLN N N 0.295 0.022 -4.987 1.00 . A A . 26 GLN N 1 1 16 8085 1 1 26 GLN NE2 N -3.394 1.350 -8.243 1.00 . A A . 26 GLN NE2 1 1 16 8086 1 1 26 GLN O O 1.789 2.349 -4.375 1.00 . A A . 26 GLN O 1 1 16 8087 1 1 26 GLN OE1 O -1.842 2.892 -8.629 1.00 . A A . 26 GLN OE1 1 1 16 8088 1 1 27 VAL C C 3.990 3.954 -6.029 1.00 . A A . 27 VAL C 1 1 16 8089 1 1 27 VAL CA C 4.256 2.522 -5.578 1.00 . A A . 27 VAL CA 1 1 16 8090 1 1 27 VAL CB C 5.603 2.013 -6.164 1.00 . A A . 27 VAL CB 1 1 16 8091 1 1 27 VAL CG1 C 6.770 2.864 -5.683 1.00 . A A . 27 VAL CG1 1 1 16 8092 1 1 27 VAL CG2 C 5.825 0.552 -5.794 1.00 . A A . 27 VAL CG2 1 1 16 8093 1 1 27 VAL H H 3.271 1.125 -6.806 1.00 . A A . 27 VAL H 1 1 16 8094 1 1 27 VAL HA H 4.299 2.495 -4.500 1.00 . A A . 27 VAL HA 1 1 16 8095 1 1 27 VAL HB H 5.554 2.086 -7.240 1.00 . A A . 27 VAL HB 1 1 16 8096 1 1 27 VAL HG11 H 7.691 2.494 -6.109 1.00 . A A . 27 VAL HG11 1 1 16 8097 1 1 27 VAL HG12 H 6.829 2.816 -4.604 1.00 . A A . 27 VAL HG12 1 1 16 8098 1 1 27 VAL HG13 H 6.620 3.890 -5.986 1.00 . A A . 27 VAL HG13 1 1 16 8099 1 1 27 VAL HG21 H 5.005 -0.043 -6.170 1.00 . A A . 27 VAL HG21 1 1 16 8100 1 1 27 VAL HG22 H 5.868 0.459 -4.718 1.00 . A A . 27 VAL HG22 1 1 16 8101 1 1 27 VAL HG23 H 6.751 0.206 -6.227 1.00 . A A . 27 VAL HG23 1 1 16 8102 1 1 27 VAL N N 3.153 1.697 -6.014 1.00 . A A . 27 VAL N 1 1 16 8103 1 1 27 VAL O O 4.000 4.249 -7.224 1.00 . A A . 27 VAL O 1 1 16 8104 1 1 28 LEU C C 4.626 7.046 -5.316 1.00 . A A . 28 LEU C 1 1 16 8105 1 1 28 LEU CA C 3.376 6.198 -5.394 1.00 . A A . 28 LEU CA 1 1 16 8106 1 1 28 LEU CB C 2.340 6.747 -4.407 1.00 . A A . 28 LEU CB 1 1 16 8107 1 1 28 LEU CD1 C 0.086 6.703 -3.337 1.00 . A A . 28 LEU CD1 1 1 16 8108 1 1 28 LEU CD2 C 0.363 5.805 -5.626 1.00 . A A . 28 LEU CD2 1 1 16 8109 1 1 28 LEU CG C 1.022 5.980 -4.280 1.00 . A A . 28 LEU CG 1 1 16 8110 1 1 28 LEU H H 3.710 4.519 -4.150 1.00 . A A . 28 LEU H 1 1 16 8111 1 1 28 LEU HA H 2.970 6.242 -6.393 1.00 . A A . 28 LEU HA 1 1 16 8112 1 1 28 LEU HB2 H 2.796 6.793 -3.430 1.00 . A A . 28 LEU HB2 1 1 16 8113 1 1 28 LEU HB3 H 2.109 7.755 -4.721 1.00 . A A . 28 LEU HB3 1 1 16 8114 1 1 28 LEU HD11 H -0.101 7.702 -3.707 1.00 . A A . 28 LEU HD11 1 1 16 8115 1 1 28 LEU HD12 H 0.527 6.760 -2.353 1.00 . A A . 28 LEU HD12 1 1 16 8116 1 1 28 LEU HD13 H -0.850 6.169 -3.279 1.00 . A A . 28 LEU HD13 1 1 16 8117 1 1 28 LEU HD21 H 1.023 5.252 -6.276 1.00 . A A . 28 LEU HD21 1 1 16 8118 1 1 28 LEU HD22 H 0.157 6.783 -6.038 1.00 . A A . 28 LEU HD22 1 1 16 8119 1 1 28 LEU HD23 H -0.559 5.262 -5.490 1.00 . A A . 28 LEU HD23 1 1 16 8120 1 1 28 LEU HG H 1.223 5.003 -3.866 1.00 . A A . 28 LEU HG 1 1 16 8121 1 1 28 LEU N N 3.697 4.814 -5.085 1.00 . A A . 28 LEU N 1 1 16 8122 1 1 28 LEU O O 4.886 7.897 -6.176 1.00 . A A . 28 LEU O 1 1 16 8123 1 1 29 ASN C C 7.670 6.460 -3.750 1.00 . A A . 29 ASN C 1 1 16 8124 1 1 29 ASN CA C 6.609 7.515 -4.005 1.00 . A A . 29 ASN CA 1 1 16 8125 1 1 29 ASN CB C 6.436 8.408 -2.749 1.00 . A A . 29 ASN CB 1 1 16 8126 1 1 29 ASN CG C 5.374 9.489 -2.884 1.00 . A A . 29 ASN CG 1 1 16 8127 1 1 29 ASN H H 5.159 6.063 -3.675 1.00 . A A . 29 ASN H 1 1 16 8128 1 1 29 ASN HA H 6.875 8.118 -4.860 1.00 . A A . 29 ASN HA 1 1 16 8129 1 1 29 ASN HB2 H 6.190 7.787 -1.903 1.00 . A A . 29 ASN HB2 1 1 16 8130 1 1 29 ASN HB3 H 7.384 8.887 -2.559 1.00 . A A . 29 ASN HB3 1 1 16 8131 1 1 29 ASN HD21 H 4.984 9.427 -0.937 1.00 . A A . 29 ASN HD21 1 1 16 8132 1 1 29 ASN HD22 H 4.077 10.550 -1.863 1.00 . A A . 29 ASN HD22 1 1 16 8133 1 1 29 ASN N N 5.388 6.800 -4.286 1.00 . A A . 29 ASN N 1 1 16 8134 1 1 29 ASN ND2 N 4.758 9.848 -1.792 1.00 . A A . 29 ASN ND2 1 1 16 8135 1 1 29 ASN O O 7.304 5.303 -3.556 1.00 . A A . 29 ASN O 1 1 16 8136 1 1 29 ASN OD1 O 5.118 10.000 -3.966 1.00 . A A . 29 ASN OD1 1 1 16 8137 1 1 30 PRO C C 9.857 4.927 -2.299 1.00 . A A . 30 PRO C 1 1 16 8138 1 1 30 PRO CA C 10.071 5.828 -3.528 1.00 . A A . 30 PRO CA 1 1 16 8139 1 1 30 PRO CB C 11.309 6.708 -3.347 1.00 . A A . 30 PRO CB 1 1 16 8140 1 1 30 PRO CD C 9.532 8.173 -3.955 1.00 . A A . 30 PRO CD 1 1 16 8141 1 1 30 PRO CG C 11.003 7.924 -4.148 1.00 . A A . 30 PRO CG 1 1 16 8142 1 1 30 PRO HA H 10.197 5.203 -4.400 1.00 . A A . 30 PRO HA 1 1 16 8143 1 1 30 PRO HB2 H 11.440 6.937 -2.300 1.00 . A A . 30 PRO HB2 1 1 16 8144 1 1 30 PRO HB3 H 12.183 6.197 -3.723 1.00 . A A . 30 PRO HB3 1 1 16 8145 1 1 30 PRO HD2 H 9.381 8.792 -3.083 1.00 . A A . 30 PRO HD2 1 1 16 8146 1 1 30 PRO HD3 H 9.092 8.637 -4.826 1.00 . A A . 30 PRO HD3 1 1 16 8147 1 1 30 PRO HG2 H 11.582 8.761 -3.786 1.00 . A A . 30 PRO HG2 1 1 16 8148 1 1 30 PRO HG3 H 11.218 7.739 -5.190 1.00 . A A . 30 PRO HG3 1 1 16 8149 1 1 30 PRO N N 8.983 6.810 -3.738 1.00 . A A . 30 PRO N 1 1 16 8150 1 1 30 PRO O O 10.091 3.721 -2.357 1.00 . A A . 30 PRO O 1 1 16 8151 1 1 31 TYR C C 7.680 4.478 0.207 1.00 . A A . 31 TYR C 1 1 16 8152 1 1 31 TYR CA C 9.171 4.714 -0.005 1.00 . A A . 31 TYR CA 1 1 16 8153 1 1 31 TYR CB C 9.758 5.409 1.238 1.00 . A A . 31 TYR CB 1 1 16 8154 1 1 31 TYR CD1 C 12.088 4.735 1.937 1.00 . A A . 31 TYR CD1 1 1 16 8155 1 1 31 TYR CD2 C 11.868 6.609 0.495 1.00 . A A . 31 TYR CD2 1 1 16 8156 1 1 31 TYR CE1 C 13.457 4.884 1.932 1.00 . A A . 31 TYR CE1 1 1 16 8157 1 1 31 TYR CE2 C 13.238 6.764 0.484 1.00 . A A . 31 TYR CE2 1 1 16 8158 1 1 31 TYR CG C 11.268 5.590 1.224 1.00 . A A . 31 TYR CG 1 1 16 8159 1 1 31 TYR CZ C 14.026 5.896 1.204 1.00 . A A . 31 TYR CZ 1 1 16 8160 1 1 31 TYR H H 9.243 6.469 -1.191 1.00 . A A . 31 TYR H 1 1 16 8161 1 1 31 TYR HA H 9.664 3.761 -0.128 1.00 . A A . 31 TYR HA 1 1 16 8162 1 1 31 TYR HB2 H 9.310 6.385 1.335 1.00 . A A . 31 TYR HB2 1 1 16 8163 1 1 31 TYR HB3 H 9.500 4.826 2.110 1.00 . A A . 31 TYR HB3 1 1 16 8164 1 1 31 TYR HD1 H 11.640 3.938 2.512 1.00 . A A . 31 TYR HD1 1 1 16 8165 1 1 31 TYR HD2 H 11.246 7.289 -0.069 1.00 . A A . 31 TYR HD2 1 1 16 8166 1 1 31 TYR HE1 H 14.078 4.204 2.497 1.00 . A A . 31 TYR HE1 1 1 16 8167 1 1 31 TYR HE2 H 13.685 7.562 -0.088 1.00 . A A . 31 TYR HE2 1 1 16 8168 1 1 31 TYR HH H 15.800 5.166 1.169 1.00 . A A . 31 TYR HH 1 1 16 8169 1 1 31 TYR N N 9.409 5.501 -1.200 1.00 . A A . 31 TYR N 1 1 16 8170 1 1 31 TYR O O 7.279 3.498 0.835 1.00 . A A . 31 TYR O 1 1 16 8171 1 1 31 TYR OH O 15.392 6.042 1.193 1.00 . A A . 31 TYR OH 1 1 16 8172 1 1 32 TYR C C 4.746 4.414 -1.204 1.00 . A A . 32 TYR C 1 1 16 8173 1 1 32 TYR CA C 5.434 5.210 -0.101 1.00 . A A . 32 TYR CA 1 1 16 8174 1 1 32 TYR CB C 4.745 6.555 0.115 1.00 . A A . 32 TYR CB 1 1 16 8175 1 1 32 TYR CD1 C 2.207 6.562 -0.034 1.00 . A A . 32 TYR CD1 1 1 16 8176 1 1 32 TYR CD2 C 3.235 6.097 2.064 1.00 . A A . 32 TYR CD2 1 1 16 8177 1 1 32 TYR CE1 C 0.967 6.403 0.550 1.00 . A A . 32 TYR CE1 1 1 16 8178 1 1 32 TYR CE2 C 2.002 5.941 2.648 1.00 . A A . 32 TYR CE2 1 1 16 8179 1 1 32 TYR CG C 3.367 6.408 0.721 1.00 . A A . 32 TYR CG 1 1 16 8180 1 1 32 TYR CZ C 0.873 6.091 1.895 1.00 . A A . 32 TYR CZ 1 1 16 8181 1 1 32 TYR H H 7.204 6.086 -0.863 1.00 . A A . 32 TYR H 1 1 16 8182 1 1 32 TYR HA H 5.333 4.635 0.807 1.00 . A A . 32 TYR HA 1 1 16 8183 1 1 32 TYR HB2 H 5.343 7.165 0.775 1.00 . A A . 32 TYR HB2 1 1 16 8184 1 1 32 TYR HB3 H 4.631 7.053 -0.836 1.00 . A A . 32 TYR HB3 1 1 16 8185 1 1 32 TYR HD1 H 2.271 6.800 -1.089 1.00 . A A . 32 TYR HD1 1 1 16 8186 1 1 32 TYR HD2 H 4.128 5.978 2.662 1.00 . A A . 32 TYR HD2 1 1 16 8187 1 1 32 TYR HE1 H 0.071 6.530 -0.039 1.00 . A A . 32 TYR HE1 1 1 16 8188 1 1 32 TYR HE2 H 1.929 5.699 3.698 1.00 . A A . 32 TYR HE2 1 1 16 8189 1 1 32 TYR HH H -0.364 6.421 3.303 1.00 . A A . 32 TYR HH 1 1 16 8190 1 1 32 TYR N N 6.850 5.353 -0.319 1.00 . A A . 32 TYR N 1 1 16 8191 1 1 32 TYR O O 4.687 4.834 -2.360 1.00 . A A . 32 TYR O 1 1 16 8192 1 1 32 TYR OH O -0.365 5.915 2.481 1.00 . A A . 32 TYR OH 1 1 16 8193 1 1 33 SER C C 2.084 2.314 -1.059 1.00 . A A . 33 SER C 1 1 16 8194 1 1 33 SER CA C 3.446 2.483 -1.732 1.00 . A A . 33 SER CA 1 1 16 8195 1 1 33 SER CB C 4.157 1.147 -1.946 1.00 . A A . 33 SER CB 1 1 16 8196 1 1 33 SER H H 4.358 2.959 0.067 1.00 . A A . 33 SER H 1 1 16 8197 1 1 33 SER HA H 3.327 3.008 -2.668 1.00 . A A . 33 SER HA 1 1 16 8198 1 1 33 SER HB2 H 4.136 0.574 -1.030 1.00 . A A . 33 SER HB2 1 1 16 8199 1 1 33 SER HB3 H 3.661 0.596 -2.731 1.00 . A A . 33 SER HB3 1 1 16 8200 1 1 33 SER HG H 5.608 2.303 -2.574 1.00 . A A . 33 SER HG 1 1 16 8201 1 1 33 SER N N 4.229 3.289 -0.845 1.00 . A A . 33 SER N 1 1 16 8202 1 1 33 SER O O 2.036 2.002 0.118 1.00 . A A . 33 SER O 1 1 16 8203 1 1 33 SER OG O 5.519 1.374 -2.333 1.00 . A A . 33 SER OG 1 1 16 8204 1 1 34 GLN C C -1.301 1.683 -1.899 1.00 . A A . 34 GLN C 1 1 16 8205 1 1 34 GLN CA C -0.314 2.582 -1.168 1.00 . A A . 34 GLN CA 1 1 16 8206 1 1 34 GLN CB C -0.805 4.036 -1.152 1.00 . A A . 34 GLN CB 1 1 16 8207 1 1 34 GLN CD C -2.578 5.728 -0.532 1.00 . A A . 34 GLN CD 1 1 16 8208 1 1 34 GLN CG C -2.206 4.262 -0.608 1.00 . A A . 34 GLN CG 1 1 16 8209 1 1 34 GLN H H 1.087 2.655 -2.749 1.00 . A A . 34 GLN H 1 1 16 8210 1 1 34 GLN HA H -0.226 2.248 -0.144 1.00 . A A . 34 GLN HA 1 1 16 8211 1 1 34 GLN HB2 H -0.119 4.604 -0.542 1.00 . A A . 34 GLN HB2 1 1 16 8212 1 1 34 GLN HB3 H -0.764 4.412 -2.164 1.00 . A A . 34 GLN HB3 1 1 16 8213 1 1 34 GLN HE21 H -1.905 5.852 1.329 1.00 . A A . 34 GLN HE21 1 1 16 8214 1 1 34 GLN HE22 H -2.544 7.294 0.672 1.00 . A A . 34 GLN HE22 1 1 16 8215 1 1 34 GLN HG2 H -2.912 3.762 -1.256 1.00 . A A . 34 GLN HG2 1 1 16 8216 1 1 34 GLN HG3 H -2.271 3.836 0.383 1.00 . A A . 34 GLN HG3 1 1 16 8217 1 1 34 GLN N N 1.010 2.543 -1.773 1.00 . A A . 34 GLN N 1 1 16 8218 1 1 34 GLN NE2 N -2.325 6.342 0.586 1.00 . A A . 34 GLN NE2 1 1 16 8219 1 1 34 GLN O O -1.174 1.463 -3.100 1.00 . A A . 34 GLN O 1 1 16 8220 1 1 34 GLN OE1 O -3.096 6.302 -1.477 1.00 . A A . 34 GLN OE1 1 1 16 8221 1 1 35 CYS C C -4.359 1.230 -2.338 1.00 . A A . 35 CYS C 1 1 16 8222 1 1 35 CYS CA C -3.305 0.339 -1.701 1.00 . A A . 35 CYS CA 1 1 16 8223 1 1 35 CYS CB C -3.963 -0.516 -0.627 1.00 . A A . 35 CYS CB 1 1 16 8224 1 1 35 CYS H H -2.227 1.255 -0.176 1.00 . A A . 35 CYS H 1 1 16 8225 1 1 35 CYS HA H -2.887 -0.311 -2.455 1.00 . A A . 35 CYS HA 1 1 16 8226 1 1 35 CYS HB2 H -4.454 0.105 0.104 1.00 . A A . 35 CYS HB2 1 1 16 8227 1 1 35 CYS HB3 H -4.714 -1.110 -1.119 1.00 . A A . 35 CYS HB3 1 1 16 8228 1 1 35 CYS N N -2.247 1.135 -1.150 1.00 . A A . 35 CYS N 1 1 16 8229 1 1 35 CYS O O -5.122 1.935 -1.636 1.00 . A A . 35 CYS O 1 1 16 8230 1 1 35 CYS SG S -2.847 -1.650 0.239 1.00 . A A . 35 CYS SG 1 1 16 8231 1 1 36 LEU C C -6.159 0.940 -5.162 1.00 . A A . 36 LEU C 1 1 16 8232 1 1 36 LEU CA C -5.333 1.948 -4.417 1.00 . A A . 36 LEU CA 1 1 16 8233 1 1 36 LEU CB C -4.666 2.926 -5.391 1.00 . A A . 36 LEU CB 1 1 16 8234 1 1 36 LEU CD1 C -3.296 4.970 -5.849 1.00 . A A . 36 LEU CD1 1 1 16 8235 1 1 36 LEU CD2 C -4.852 4.940 -3.904 1.00 . A A . 36 LEU CD2 1 1 16 8236 1 1 36 LEU CG C -3.915 4.107 -4.766 1.00 . A A . 36 LEU CG 1 1 16 8237 1 1 36 LEU H H -3.696 0.699 -4.113 1.00 . A A . 36 LEU H 1 1 16 8238 1 1 36 LEU HA H -5.977 2.490 -3.740 1.00 . A A . 36 LEU HA 1 1 16 8239 1 1 36 LEU HB2 H -3.965 2.366 -5.993 1.00 . A A . 36 LEU HB2 1 1 16 8240 1 1 36 LEU HB3 H -5.431 3.322 -6.043 1.00 . A A . 36 LEU HB3 1 1 16 8241 1 1 36 LEU HD11 H -2.604 4.380 -6.431 1.00 . A A . 36 LEU HD11 1 1 16 8242 1 1 36 LEU HD12 H -2.771 5.797 -5.395 1.00 . A A . 36 LEU HD12 1 1 16 8243 1 1 36 LEU HD13 H -4.073 5.351 -6.492 1.00 . A A . 36 LEU HD13 1 1 16 8244 1 1 36 LEU HD21 H -4.310 5.781 -3.498 1.00 . A A . 36 LEU HD21 1 1 16 8245 1 1 36 LEU HD22 H -5.230 4.339 -3.091 1.00 . A A . 36 LEU HD22 1 1 16 8246 1 1 36 LEU HD23 H -5.676 5.300 -4.502 1.00 . A A . 36 LEU HD23 1 1 16 8247 1 1 36 LEU HG H -3.119 3.732 -4.141 1.00 . A A . 36 LEU HG 1 1 16 8248 1 1 36 LEU N N -4.370 1.233 -3.634 1.00 . A A . 36 LEU N 1 1 16 8249 1 1 36 LEU O O -7.350 0.811 -4.868 1.00 . A A . 36 LEU O 1 1 16 8250 1 1 36 LEU OXT O -5.577 0.173 -5.965 1.00 . A A . 36 LEU OXT 1 1 16 8251 2 2 1 MAN C1 C 9.108 -4.403 6.405 1.00 . B A . 101 MAN C1 1 1 16 8252 2 2 1 MAN C2 C 9.060 -5.927 6.042 1.00 . B A . 101 MAN C2 1 1 16 8253 2 2 1 MAN C3 C 10.467 -6.553 6.074 1.00 . B A . 101 MAN C3 1 1 16 8254 2 2 1 MAN C4 C 11.305 -5.885 7.149 1.00 . B A . 101 MAN C4 1 1 16 8255 2 2 1 MAN C5 C 11.493 -4.385 6.812 1.00 . B A . 101 MAN C5 1 1 16 8256 2 2 1 MAN C6 C 12.755 -4.145 6.005 1.00 . B A . 101 MAN C6 1 1 16 8257 2 2 1 MAN H1 H 8.380 -3.880 5.767 1.00 . B A . 101 MAN H1 1 1 16 8258 2 2 1 MAN H2 H 8.404 -6.461 6.742 1.00 . B A . 101 MAN H2 1 1 16 8259 2 2 1 MAN H3 H 10.372 -7.623 6.307 1.00 . B A . 101 MAN H3 1 1 16 8260 2 2 1 MAN H4 H 12.301 -6.351 7.163 1.00 . B A . 101 MAN H4 1 1 16 8261 2 2 1 MAN H5 H 11.541 -3.818 7.751 1.00 . B A . 101 MAN H5 1 1 16 8262 2 2 1 MAN H61 H 12.854 -3.061 5.852 1.00 . B A . 101 MAN H61 1 1 16 8263 2 2 1 MAN H62 H 12.650 -4.627 5.021 1.00 . B A . 101 MAN H62 1 1 16 8264 2 2 1 MAN HO2 H 9.234 -5.564 4.205 1.00 . B A . 101 MAN HO2 1 1 16 8265 2 2 1 MAN HO3 H 11.969 -6.818 4.863 1.00 . B A . 101 MAN HO3 1 1 16 8266 2 2 1 MAN HO4 H 11.265 -5.574 9.049 1.00 . B A . 101 MAN HO4 1 1 16 8267 2 2 1 MAN HO6 H 14.603 -4.779 6.028 1.00 . B A . 101 MAN HO6 1 1 16 8268 2 2 1 MAN O2 O 8.580 -6.046 4.726 1.00 . B A . 101 MAN O2 1 1 16 8269 2 2 1 MAN O3 O 11.087 -6.425 4.790 1.00 . B A . 101 MAN O3 1 1 16 8270 2 2 1 MAN O4 O 10.698 -6.040 8.422 1.00 . B A . 101 MAN O4 1 1 16 8271 2 2 1 MAN O5 O 10.365 -3.868 6.034 1.00 . B A . 101 MAN O5 1 1 16 8272 2 2 1 MAN O6 O 13.902 -4.660 6.683 1.00 . B A . 101 MAN O6 1 1 17 8273 1 1 1 THR C C -5.498 -6.082 4.714 1.00 . A A . 1 THR C 1 1 17 8274 1 1 1 THR CA C -5.213 -7.551 4.394 1.00 . A A . 1 THR CA 1 1 17 8275 1 1 1 THR CB C -6.452 -8.239 3.821 1.00 . A A . 1 THR CB 1 1 17 8276 1 1 1 THR CG2 C -6.630 -7.903 2.357 1.00 . A A . 1 THR CG2 1 1 17 8277 1 1 1 THR H1 H -5.663 -8.050 6.290 1.00 . A A . 1 THR H1 1 1 17 8278 1 1 1 THR H2 H -4.006 -7.861 6.075 1.00 . A A . 1 THR H2 1 1 17 8279 1 1 1 THR H3 H -4.820 -9.232 5.467 1.00 . A A . 1 THR H3 1 1 17 8280 1 1 1 THR HA H -4.390 -7.631 3.702 1.00 . A A . 1 THR HA 1 1 17 8281 1 1 1 THR HB H -7.321 -7.921 4.378 1.00 . A A . 1 THR HB 1 1 17 8282 1 1 1 THR HG1 H -6.659 -10.094 3.174 1.00 . A A . 1 THR HG1 1 1 17 8283 1 1 1 THR HG21 H -5.773 -8.251 1.801 1.00 . A A . 1 THR HG21 1 1 17 8284 1 1 1 THR HG22 H -6.718 -6.833 2.243 1.00 . A A . 1 THR HG22 1 1 17 8285 1 1 1 THR HG23 H -7.521 -8.380 1.981 1.00 . A A . 1 THR HG23 1 1 17 8286 1 1 1 THR N N -4.877 -8.209 5.630 1.00 . A A . 1 THR N 1 1 17 8287 1 1 1 THR O O -6.246 -5.792 5.636 1.00 . A A . 1 THR O 1 1 17 8288 1 1 1 THR OG1 O -6.270 -9.666 3.949 1.00 . A A . 1 THR OG1 1 1 17 8289 1 1 2 GLN C C -6.073 -3.041 3.499 1.00 . A A . 2 GLN C 1 1 17 8290 1 1 2 GLN CA C -5.016 -3.765 4.347 1.00 . A A . 2 GLN CA 1 1 17 8291 1 1 2 GLN CB C -3.676 -3.075 4.218 1.00 . A A . 2 GLN CB 1 1 17 8292 1 1 2 GLN CD C -2.272 -1.067 4.815 1.00 . A A . 2 GLN CD 1 1 17 8293 1 1 2 GLN CG C -3.565 -1.791 5.034 1.00 . A A . 2 GLN CG 1 1 17 8294 1 1 2 GLN H H -4.368 -5.429 3.199 1.00 . A A . 2 GLN H 1 1 17 8295 1 1 2 GLN HA H -5.322 -3.721 5.382 1.00 . A A . 2 GLN HA 1 1 17 8296 1 1 2 GLN HB2 H -2.896 -3.755 4.525 1.00 . A A . 2 GLN HB2 1 1 17 8297 1 1 2 GLN HB3 H -3.544 -2.834 3.175 1.00 . A A . 2 GLN HB3 1 1 17 8298 1 1 2 GLN HE21 H -2.236 -1.596 2.903 1.00 . A A . 2 GLN HE21 1 1 17 8299 1 1 2 GLN HE22 H -0.925 -0.650 3.488 1.00 . A A . 2 GLN HE22 1 1 17 8300 1 1 2 GLN HG2 H -4.376 -1.133 4.761 1.00 . A A . 2 GLN HG2 1 1 17 8301 1 1 2 GLN HG3 H -3.650 -2.042 6.081 1.00 . A A . 2 GLN HG3 1 1 17 8302 1 1 2 GLN N N -4.894 -5.163 3.990 1.00 . A A . 2 GLN N 1 1 17 8303 1 1 2 GLN NE2 N -1.778 -1.112 3.620 1.00 . A A . 2 GLN NE2 1 1 17 8304 1 1 2 GLN O O -6.414 -3.476 2.387 1.00 . A A . 2 GLN O 1 1 17 8305 1 1 2 GLN OE1 O -1.739 -0.418 5.725 1.00 . A A . 2 GLN OE1 1 1 17 8306 1 1 3 SER C C -7.075 -0.253 2.286 1.00 . A A . 3 SER C 1 1 17 8307 1 1 3 SER CA C -7.585 -1.117 3.463 1.00 . A A . 3 SER CA 1 1 17 8308 1 1 3 SER CB C -8.060 -0.185 4.560 1.00 . A A . 3 SER CB 1 1 17 8309 1 1 3 SER H H -6.228 -1.660 4.919 1.00 . A A . 3 SER H 1 1 17 8310 1 1 3 SER HA H -8.427 -1.725 3.169 1.00 . A A . 3 SER HA 1 1 17 8311 1 1 3 SER HB2 H -7.246 0.494 4.775 1.00 . A A . 3 SER HB2 1 1 17 8312 1 1 3 SER HB3 H -8.934 0.362 4.238 1.00 . A A . 3 SER HB3 1 1 17 8313 1 1 3 SER HG H -9.162 -1.427 5.597 1.00 . A A . 3 SER HG 1 1 17 8314 1 1 3 SER N N -6.559 -1.946 4.042 1.00 . A A . 3 SER N 1 1 17 8315 1 1 3 SER O O -5.858 -0.068 2.080 1.00 . A A . 3 SER O 1 1 17 8316 1 1 3 SER OG O -8.358 -0.910 5.744 1.00 . A A . 3 SER OG 1 1 17 8317 1 1 4 HIS C C -7.209 2.501 1.065 1.00 . A A . 4 HIS C 1 1 17 8318 1 1 4 HIS CA C -7.822 1.225 0.465 1.00 . A A . 4 HIS CA 1 1 17 8319 1 1 4 HIS CB C -9.206 1.523 -0.168 1.00 . A A . 4 HIS CB 1 1 17 8320 1 1 4 HIS CD2 C -8.410 2.404 -2.495 1.00 . A A . 4 HIS CD2 1 1 17 8321 1 1 4 HIS CE1 C -10.065 3.768 -2.899 1.00 . A A . 4 HIS CE1 1 1 17 8322 1 1 4 HIS CG C -9.229 2.369 -1.422 1.00 . A A . 4 HIS CG 1 1 17 8323 1 1 4 HIS H H -8.958 0.027 1.761 1.00 . A A . 4 HIS H 1 1 17 8324 1 1 4 HIS HA H -7.165 0.793 -0.273 1.00 . A A . 4 HIS HA 1 1 17 8325 1 1 4 HIS HB2 H -9.696 0.591 -0.404 1.00 . A A . 4 HIS HB2 1 1 17 8326 1 1 4 HIS HB3 H -9.802 2.027 0.579 1.00 . A A . 4 HIS HB3 1 1 17 8327 1 1 4 HIS HD1 H -11.010 3.453 -1.117 1.00 . A A . 4 HIS HD1 1 1 17 8328 1 1 4 HIS HD2 H -7.489 1.850 -2.602 1.00 . A A . 4 HIS HD2 1 1 17 8329 1 1 4 HIS HE1 H -10.713 4.481 -3.384 1.00 . A A . 4 HIS HE1 1 1 17 8330 1 1 4 HIS HE2 H -8.699 3.398 -4.338 1.00 . A A . 4 HIS HE2 1 1 17 8331 1 1 4 HIS N N -8.033 0.286 1.552 1.00 . A A . 4 HIS N 1 1 17 8332 1 1 4 HIS ND1 N -10.251 3.241 -1.709 1.00 . A A . 4 HIS ND1 1 1 17 8333 1 1 4 HIS NE2 N -8.955 3.280 -3.393 1.00 . A A . 4 HIS NE2 1 1 17 8334 1 1 4 HIS O O -7.585 2.899 2.163 1.00 . A A . 4 HIS O 1 1 17 8335 1 1 5 TYR C C -4.495 4.071 1.899 1.00 . A A . 5 TYR C 1 1 17 8336 1 1 5 TYR CA C -5.525 4.317 0.795 1.00 . A A . 5 TYR CA 1 1 17 8337 1 1 5 TYR CB C -6.458 5.483 1.176 1.00 . A A . 5 TYR CB 1 1 17 8338 1 1 5 TYR CD1 C -8.540 5.908 -0.166 1.00 . A A . 5 TYR CD1 1 1 17 8339 1 1 5 TYR CD2 C -6.529 6.950 -0.868 1.00 . A A . 5 TYR CD2 1 1 17 8340 1 1 5 TYR CE1 C -9.212 6.495 -1.213 1.00 . A A . 5 TYR CE1 1 1 17 8341 1 1 5 TYR CE2 C -7.191 7.540 -1.919 1.00 . A A . 5 TYR CE2 1 1 17 8342 1 1 5 TYR CG C -7.192 6.122 0.025 1.00 . A A . 5 TYR CG 1 1 17 8343 1 1 5 TYR CZ C -8.533 7.309 -2.088 1.00 . A A . 5 TYR CZ 1 1 17 8344 1 1 5 TYR H H -5.965 2.691 -0.493 1.00 . A A . 5 TYR H 1 1 17 8345 1 1 5 TYR HA H -4.955 4.616 -0.073 1.00 . A A . 5 TYR HA 1 1 17 8346 1 1 5 TYR HB2 H -7.207 5.100 1.851 1.00 . A A . 5 TYR HB2 1 1 17 8347 1 1 5 TYR HB3 H -5.875 6.241 1.678 1.00 . A A . 5 TYR HB3 1 1 17 8348 1 1 5 TYR HD1 H -9.071 5.264 0.520 1.00 . A A . 5 TYR HD1 1 1 17 8349 1 1 5 TYR HD2 H -5.472 7.127 -0.732 1.00 . A A . 5 TYR HD2 1 1 17 8350 1 1 5 TYR HE1 H -10.268 6.313 -1.345 1.00 . A A . 5 TYR HE1 1 1 17 8351 1 1 5 TYR HE2 H -6.658 8.180 -2.607 1.00 . A A . 5 TYR HE2 1 1 17 8352 1 1 5 TYR HH H -8.650 7.797 -3.924 1.00 . A A . 5 TYR HH 1 1 17 8353 1 1 5 TYR N N -6.241 3.091 0.364 1.00 . A A . 5 TYR N 1 1 17 8354 1 1 5 TYR O O -3.921 5.014 2.436 1.00 . A A . 5 TYR O 1 1 17 8355 1 1 5 TYR OH O -9.202 7.887 -3.136 1.00 . A A . 5 TYR OH 1 1 17 8356 1 1 6 GLY C C -1.921 2.241 2.532 1.00 . A A . 6 GLY C 1 1 17 8357 1 1 6 GLY CA C -3.231 2.548 3.199 1.00 . A A . 6 GLY CA 1 1 17 8358 1 1 6 GLY H H -4.744 2.097 1.809 1.00 . A A . 6 GLY H 1 1 17 8359 1 1 6 GLY HA2 H -3.098 3.432 3.804 1.00 . A A . 6 GLY HA2 1 1 17 8360 1 1 6 GLY HA3 H -3.526 1.712 3.815 1.00 . A A . 6 GLY HA3 1 1 17 8361 1 1 6 GLY N N -4.247 2.831 2.223 1.00 . A A . 6 GLY N 1 1 17 8362 1 1 6 GLY O O -1.911 1.821 1.360 1.00 . A A . 6 GLY O 1 1 17 8363 1 1 7 GLN C C 0.661 0.670 2.663 1.00 . A A . 7 GLN C 1 1 17 8364 1 1 7 GLN CA C 0.498 2.168 2.730 1.00 . A A . 7 GLN CA 1 1 17 8365 1 1 7 GLN CB C 1.596 2.785 3.609 1.00 . A A . 7 GLN CB 1 1 17 8366 1 1 7 GLN CD C 4.080 3.036 4.069 1.00 . A A . 7 GLN CD 1 1 17 8367 1 1 7 GLN CG C 3.022 2.468 3.142 1.00 . A A . 7 GLN CG 1 1 17 8368 1 1 7 GLN H H -0.915 2.820 4.152 1.00 . A A . 7 GLN H 1 1 17 8369 1 1 7 GLN HA H 0.565 2.572 1.731 1.00 . A A . 7 GLN HA 1 1 17 8370 1 1 7 GLN HB2 H 1.473 3.857 3.614 1.00 . A A . 7 GLN HB2 1 1 17 8371 1 1 7 GLN HB3 H 1.480 2.415 4.616 1.00 . A A . 7 GLN HB3 1 1 17 8372 1 1 7 GLN HE21 H 5.441 3.185 2.601 1.00 . A A . 7 GLN HE21 1 1 17 8373 1 1 7 GLN HE22 H 5.935 3.645 4.166 1.00 . A A . 7 GLN HE22 1 1 17 8374 1 1 7 GLN HG2 H 3.138 1.394 3.108 1.00 . A A . 7 GLN HG2 1 1 17 8375 1 1 7 GLN HG3 H 3.166 2.871 2.151 1.00 . A A . 7 GLN HG3 1 1 17 8376 1 1 7 GLN N N -0.824 2.465 3.242 1.00 . A A . 7 GLN N 1 1 17 8377 1 1 7 GLN NE2 N 5.240 3.317 3.555 1.00 . A A . 7 GLN NE2 1 1 17 8378 1 1 7 GLN O O 0.747 0.015 3.680 1.00 . A A . 7 GLN O 1 1 17 8379 1 1 7 GLN OE1 O 3.854 3.199 5.256 1.00 . A A . 7 GLN OE1 1 1 17 8380 1 1 8 CYS C C 2.065 -1.875 1.493 1.00 . A A . 8 CYS C 1 1 17 8381 1 1 8 CYS CA C 0.694 -1.297 1.273 1.00 . A A . 8 CYS CA 1 1 17 8382 1 1 8 CYS CB C 0.200 -1.644 -0.113 1.00 . A A . 8 CYS CB 1 1 17 8383 1 1 8 CYS H H 0.609 0.738 0.697 1.00 . A A . 8 CYS H 1 1 17 8384 1 1 8 CYS HA H 0.016 -1.743 1.985 1.00 . A A . 8 CYS HA 1 1 17 8385 1 1 8 CYS HB2 H 0.382 -2.693 -0.298 1.00 . A A . 8 CYS HB2 1 1 17 8386 1 1 8 CYS HB3 H -0.861 -1.454 -0.170 1.00 . A A . 8 CYS HB3 1 1 17 8387 1 1 8 CYS N N 0.651 0.139 1.476 1.00 . A A . 8 CYS N 1 1 17 8388 1 1 8 CYS O O 2.202 -2.951 2.035 1.00 . A A . 8 CYS O 1 1 17 8389 1 1 8 CYS SG S 1.012 -0.701 -1.442 1.00 . A A . 8 CYS SG 1 1 17 8390 1 1 9 GLY C C 5.403 -1.009 0.427 1.00 . A A . 9 GLY C 1 1 17 8391 1 1 9 GLY CA C 4.386 -1.706 1.248 1.00 . A A . 9 GLY CA 1 1 17 8392 1 1 9 GLY H H 2.933 -0.297 0.665 1.00 . A A . 9 GLY H 1 1 17 8393 1 1 9 GLY HA2 H 4.666 -1.635 2.288 1.00 . A A . 9 GLY HA2 1 1 17 8394 1 1 9 GLY HA3 H 4.362 -2.747 0.963 1.00 . A A . 9 GLY HA3 1 1 17 8395 1 1 9 GLY N N 3.080 -1.169 1.085 1.00 . A A . 9 GLY N 1 1 17 8396 1 1 9 GLY O O 5.543 -1.270 -0.770 1.00 . A A . 9 GLY O 1 1 17 8397 1 1 10 GLY C C 8.411 0.142 1.121 1.00 . A A . 10 GLY C 1 1 17 8398 1 1 10 GLY CA C 7.162 0.565 0.417 1.00 . A A . 10 GLY CA 1 1 17 8399 1 1 10 GLY H H 5.837 0.150 1.961 1.00 . A A . 10 GLY H 1 1 17 8400 1 1 10 GLY HA2 H 7.203 0.282 -0.623 1.00 . A A . 10 GLY HA2 1 1 17 8401 1 1 10 GLY HA3 H 7.048 1.635 0.506 1.00 . A A . 10 GLY HA3 1 1 17 8402 1 1 10 GLY N N 6.061 -0.087 1.039 1.00 . A A . 10 GLY N 1 1 17 8403 1 1 10 GLY O O 8.360 -0.781 1.955 1.00 . A A . 10 GLY O 1 1 17 8404 1 1 11 ILE C C 10.660 0.826 2.977 1.00 . A A . 11 ILE C 1 1 17 8405 1 1 11 ILE CA C 10.761 0.466 1.485 1.00 . A A . 11 ILE CA 1 1 17 8406 1 1 11 ILE CB C 11.944 1.239 0.833 1.00 . A A . 11 ILE CB 1 1 17 8407 1 1 11 ILE CD1 C 13.062 1.735 -1.429 1.00 . A A . 11 ILE CD1 1 1 17 8408 1 1 11 ILE CG1 C 11.999 0.952 -0.680 1.00 . A A . 11 ILE CG1 1 1 17 8409 1 1 11 ILE CG2 C 13.269 0.858 1.497 1.00 . A A . 11 ILE CG2 1 1 17 8410 1 1 11 ILE H H 9.488 1.499 0.159 1.00 . A A . 11 ILE H 1 1 17 8411 1 1 11 ILE HA H 10.931 -0.597 1.388 1.00 . A A . 11 ILE HA 1 1 17 8412 1 1 11 ILE HB H 11.784 2.296 0.981 1.00 . A A . 11 ILE HB 1 1 17 8413 1 1 11 ILE HD11 H 13.035 1.468 -2.476 1.00 . A A . 11 ILE HD11 1 1 17 8414 1 1 11 ILE HD12 H 14.033 1.497 -1.021 1.00 . A A . 11 ILE HD12 1 1 17 8415 1 1 11 ILE HD13 H 12.871 2.792 -1.320 1.00 . A A . 11 ILE HD13 1 1 17 8416 1 1 11 ILE HG12 H 12.196 -0.097 -0.831 1.00 . A A . 11 ILE HG12 1 1 17 8417 1 1 11 ILE HG13 H 11.039 1.190 -1.115 1.00 . A A . 11 ILE HG13 1 1 17 8418 1 1 11 ILE HG21 H 13.437 -0.201 1.375 1.00 . A A . 11 ILE HG21 1 1 17 8419 1 1 11 ILE HG22 H 13.227 1.096 2.550 1.00 . A A . 11 ILE HG22 1 1 17 8420 1 1 11 ILE HG23 H 14.074 1.407 1.033 1.00 . A A . 11 ILE HG23 1 1 17 8421 1 1 11 ILE N N 9.507 0.785 0.832 1.00 . A A . 11 ILE N 1 1 17 8422 1 1 11 ILE O O 10.369 1.966 3.327 1.00 . A A . 11 ILE O 1 1 17 8423 1 1 12 GLY C C 9.431 -0.214 5.876 1.00 . A A . 12 GLY C 1 1 17 8424 1 1 12 GLY CA C 10.780 0.089 5.260 1.00 . A A . 12 GLY CA 1 1 17 8425 1 1 12 GLY H H 10.930 -1.074 3.496 1.00 . A A . 12 GLY H 1 1 17 8426 1 1 12 GLY HA2 H 11.527 -0.525 5.739 1.00 . A A . 12 GLY HA2 1 1 17 8427 1 1 12 GLY HA3 H 11.017 1.128 5.436 1.00 . A A . 12 GLY HA3 1 1 17 8428 1 1 12 GLY N N 10.811 -0.159 3.832 1.00 . A A . 12 GLY N 1 1 17 8429 1 1 12 GLY O O 9.232 -0.070 7.096 1.00 . A A . 12 GLY O 1 1 17 8430 1 1 13 TYR C C 7.112 -2.449 5.727 1.00 . A A . 13 TYR C 1 1 17 8431 1 1 13 TYR CA C 7.194 -0.959 5.572 1.00 . A A . 13 TYR CA 1 1 17 8432 1 1 13 TYR CB C 6.058 -0.444 4.663 1.00 . A A . 13 TYR CB 1 1 17 8433 1 1 13 TYR CD1 C 4.024 -1.989 4.827 1.00 . A A . 13 TYR CD1 1 1 17 8434 1 1 13 TYR CD2 C 3.937 0.108 5.948 1.00 . A A . 13 TYR CD2 1 1 17 8435 1 1 13 TYR CE1 C 2.749 -2.286 5.272 1.00 . A A . 13 TYR CE1 1 1 17 8436 1 1 13 TYR CE2 C 2.663 -0.182 6.397 1.00 . A A . 13 TYR CE2 1 1 17 8437 1 1 13 TYR CG C 4.644 -0.783 5.158 1.00 . A A . 13 TYR CG 1 1 17 8438 1 1 13 TYR CZ C 2.076 -1.380 6.058 1.00 . A A . 13 TYR CZ 1 1 17 8439 1 1 13 TYR H H 8.679 -0.692 4.102 1.00 . A A . 13 TYR H 1 1 17 8440 1 1 13 TYR HA H 7.096 -0.504 6.548 1.00 . A A . 13 TYR HA 1 1 17 8441 1 1 13 TYR HB2 H 6.130 0.632 4.608 1.00 . A A . 13 TYR HB2 1 1 17 8442 1 1 13 TYR HB3 H 6.174 -0.847 3.669 1.00 . A A . 13 TYR HB3 1 1 17 8443 1 1 13 TYR HD1 H 4.554 -2.702 4.214 1.00 . A A . 13 TYR HD1 1 1 17 8444 1 1 13 TYR HD2 H 4.397 1.049 6.211 1.00 . A A . 13 TYR HD2 1 1 17 8445 1 1 13 TYR HE1 H 2.288 -3.226 5.007 1.00 . A A . 13 TYR HE1 1 1 17 8446 1 1 13 TYR HE2 H 2.134 0.529 7.014 1.00 . A A . 13 TYR HE2 1 1 17 8447 1 1 13 TYR HH H 0.203 -1.002 6.100 1.00 . A A . 13 TYR HH 1 1 17 8448 1 1 13 TYR N N 8.490 -0.610 5.064 1.00 . A A . 13 TYR N 1 1 17 8449 1 1 13 TYR O O 7.466 -3.191 4.822 1.00 . A A . 13 TYR O 1 1 17 8450 1 1 13 TYR OH O 0.794 -1.661 6.489 1.00 . A A . 13 TYR OH 1 1 17 8451 1 1 14 SER C C 5.157 -4.406 7.840 1.00 . A A . 14 SER C 1 1 17 8452 1 1 14 SER CA C 6.484 -4.264 7.133 1.00 . A A . 14 SER CA 1 1 17 8453 1 1 14 SER CB C 7.652 -4.799 7.970 1.00 . A A . 14 SER CB 1 1 17 8454 1 1 14 SER H H 6.468 -2.253 7.586 1.00 . A A . 14 SER H 1 1 17 8455 1 1 14 SER HA H 6.442 -4.786 6.189 1.00 . A A . 14 SER HA 1 1 17 8456 1 1 14 SER HB2 H 7.435 -5.815 8.269 1.00 . A A . 14 SER HB2 1 1 17 8457 1 1 14 SER HB3 H 8.550 -4.781 7.372 1.00 . A A . 14 SER HB3 1 1 17 8458 1 1 14 SER N N 6.682 -2.877 6.861 1.00 . A A . 14 SER N 1 1 17 8459 1 1 14 SER O O 4.846 -3.610 8.747 1.00 . A A . 14 SER O 1 1 17 8460 1 1 14 SER OG O 7.853 -3.984 9.154 1.00 . A A . 14 SER OG 1 1 17 8461 1 1 15 GLY C C 2.150 -6.146 6.900 1.00 . A A . 15 GLY C 1 1 17 8462 1 1 15 GLY CA C 3.048 -5.540 7.945 1.00 . A A . 15 GLY CA 1 1 17 8463 1 1 15 GLY H H 4.642 -5.950 6.680 1.00 . A A . 15 GLY H 1 1 17 8464 1 1 15 GLY HA2 H 3.103 -6.186 8.810 1.00 . A A . 15 GLY HA2 1 1 17 8465 1 1 15 GLY HA3 H 2.647 -4.581 8.235 1.00 . A A . 15 GLY HA3 1 1 17 8466 1 1 15 GLY N N 4.361 -5.346 7.401 1.00 . A A . 15 GLY N 1 1 17 8467 1 1 15 GLY O O 2.611 -6.995 6.128 1.00 . A A . 15 GLY O 1 1 17 8468 1 1 16 PRO C C 0.220 -5.617 4.449 1.00 . A A . 16 PRO C 1 1 17 8469 1 1 16 PRO CA C -0.039 -6.247 5.816 1.00 . A A . 16 PRO CA 1 1 17 8470 1 1 16 PRO CB C -1.433 -5.859 6.337 1.00 . A A . 16 PRO CB 1 1 17 8471 1 1 16 PRO CD C 0.234 -4.734 7.671 1.00 . A A . 16 PRO CD 1 1 17 8472 1 1 16 PRO CG C -1.208 -5.151 7.640 1.00 . A A . 16 PRO CG 1 1 17 8473 1 1 16 PRO HA H 0.043 -7.320 5.737 1.00 . A A . 16 PRO HA 1 1 17 8474 1 1 16 PRO HB2 H -1.911 -5.215 5.616 1.00 . A A . 16 PRO HB2 1 1 17 8475 1 1 16 PRO HB3 H -2.028 -6.751 6.468 1.00 . A A . 16 PRO HB3 1 1 17 8476 1 1 16 PRO HD2 H 0.349 -3.742 7.261 1.00 . A A . 16 PRO HD2 1 1 17 8477 1 1 16 PRO HD3 H 0.614 -4.782 8.681 1.00 . A A . 16 PRO HD3 1 1 17 8478 1 1 16 PRO HG2 H -1.845 -4.281 7.692 1.00 . A A . 16 PRO HG2 1 1 17 8479 1 1 16 PRO HG3 H -1.426 -5.818 8.461 1.00 . A A . 16 PRO HG3 1 1 17 8480 1 1 16 PRO N N 0.881 -5.735 6.817 1.00 . A A . 16 PRO N 1 1 17 8481 1 1 16 PRO O O -0.197 -4.489 4.175 1.00 . A A . 16 PRO O 1 1 17 8482 1 1 17 THR C C 0.272 -6.203 1.250 1.00 . A A . 17 THR C 1 1 17 8483 1 1 17 THR CA C 1.308 -5.865 2.318 1.00 . A A . 17 THR CA 1 1 17 8484 1 1 17 THR CB C 2.681 -6.443 1.951 1.00 . A A . 17 THR CB 1 1 17 8485 1 1 17 THR CG2 C 3.795 -5.680 2.646 1.00 . A A . 17 THR CG2 1 1 17 8486 1 1 17 THR H H 1.234 -7.233 3.872 1.00 . A A . 17 THR H 1 1 17 8487 1 1 17 THR HA H 1.404 -4.789 2.355 1.00 . A A . 17 THR HA 1 1 17 8488 1 1 17 THR HB H 2.812 -6.379 0.880 1.00 . A A . 17 THR HB 1 1 17 8489 1 1 17 THR HG1 H 2.877 -8.366 1.563 1.00 . A A . 17 THR HG1 1 1 17 8490 1 1 17 THR HG21 H 3.768 -4.644 2.340 1.00 . A A . 17 THR HG21 1 1 17 8491 1 1 17 THR HG22 H 4.748 -6.110 2.377 1.00 . A A . 17 THR HG22 1 1 17 8492 1 1 17 THR HG23 H 3.656 -5.741 3.716 1.00 . A A . 17 THR HG23 1 1 17 8493 1 1 17 THR N N 0.928 -6.335 3.619 1.00 . A A . 17 THR N 1 1 17 8494 1 1 17 THR O O 0.333 -5.695 0.124 1.00 . A A . 17 THR O 1 1 17 8495 1 1 17 THR OG1 O 2.728 -7.830 2.350 1.00 . A A . 17 THR OG1 1 1 17 8496 1 1 18 VAL C C -2.913 -6.541 0.894 1.00 . A A . 18 VAL C 1 1 17 8497 1 1 18 VAL CA C -1.710 -7.428 0.662 1.00 . A A . 18 VAL CA 1 1 17 8498 1 1 18 VAL CB C -2.107 -8.928 0.788 1.00 . A A . 18 VAL CB 1 1 17 8499 1 1 18 VAL CG1 C -3.216 -9.295 -0.199 1.00 . A A . 18 VAL CG1 1 1 17 8500 1 1 18 VAL CG2 C -0.891 -9.817 0.562 1.00 . A A . 18 VAL CG2 1 1 17 8501 1 1 18 VAL H H -0.676 -7.438 2.493 1.00 . A A . 18 VAL H 1 1 17 8502 1 1 18 VAL HA H -1.336 -7.246 -0.336 1.00 . A A . 18 VAL HA 1 1 17 8503 1 1 18 VAL HB H -2.473 -9.101 1.789 1.00 . A A . 18 VAL HB 1 1 17 8504 1 1 18 VAL HG11 H -3.471 -10.338 -0.084 1.00 . A A . 18 VAL HG11 1 1 17 8505 1 1 18 VAL HG12 H -2.877 -9.117 -1.208 1.00 . A A . 18 VAL HG12 1 1 17 8506 1 1 18 VAL HG13 H -4.086 -8.687 0.000 1.00 . A A . 18 VAL HG13 1 1 17 8507 1 1 18 VAL HG21 H -1.184 -10.852 0.653 1.00 . A A . 18 VAL HG21 1 1 17 8508 1 1 18 VAL HG22 H -0.133 -9.590 1.297 1.00 . A A . 18 VAL HG22 1 1 17 8509 1 1 18 VAL HG23 H -0.496 -9.644 -0.428 1.00 . A A . 18 VAL HG23 1 1 17 8510 1 1 18 VAL N N -0.669 -7.058 1.588 1.00 . A A . 18 VAL N 1 1 17 8511 1 1 18 VAL O O -3.444 -6.466 2.015 1.00 . A A . 18 VAL O 1 1 17 8512 1 1 19 CYS C C -5.709 -5.767 -0.326 1.00 . A A . 19 CYS C 1 1 17 8513 1 1 19 CYS CA C -4.451 -4.967 -0.047 1.00 . A A . 19 CYS CA 1 1 17 8514 1 1 19 CYS CB C -4.305 -3.844 -1.066 1.00 . A A . 19 CYS CB 1 1 17 8515 1 1 19 CYS H H -2.845 -5.920 -0.985 1.00 . A A . 19 CYS H 1 1 17 8516 1 1 19 CYS HA H -4.495 -4.545 0.946 1.00 . A A . 19 CYS HA 1 1 17 8517 1 1 19 CYS HB2 H -4.406 -4.238 -2.066 1.00 . A A . 19 CYS HB2 1 1 17 8518 1 1 19 CYS HB3 H -5.083 -3.116 -0.887 1.00 . A A . 19 CYS HB3 1 1 17 8519 1 1 19 CYS N N -3.314 -5.845 -0.128 1.00 . A A . 19 CYS N 1 1 17 8520 1 1 19 CYS O O -5.629 -6.892 -0.841 1.00 . A A . 19 CYS O 1 1 17 8521 1 1 19 CYS SG S -2.708 -2.971 -0.966 1.00 . A A . 19 CYS SG 1 1 17 8522 1 1 20 ALA C C -8.336 -6.028 -1.707 1.00 . A A . 20 ALA C 1 1 17 8523 1 1 20 ALA CA C -8.119 -5.878 -0.207 1.00 . A A . 20 ALA CA 1 1 17 8524 1 1 20 ALA CB C -9.248 -5.072 0.419 1.00 . A A . 20 ALA CB 1 1 17 8525 1 1 20 ALA H H -6.844 -4.362 0.509 1.00 . A A . 20 ALA H 1 1 17 8526 1 1 20 ALA HA H -8.095 -6.857 0.247 1.00 . A A . 20 ALA HA 1 1 17 8527 1 1 20 ALA HB1 H -10.188 -5.579 0.252 1.00 . A A . 20 ALA HB1 1 1 17 8528 1 1 20 ALA HB2 H -9.283 -4.095 -0.038 1.00 . A A . 20 ALA HB2 1 1 17 8529 1 1 20 ALA HB3 H -9.075 -4.971 1.480 1.00 . A A . 20 ALA HB3 1 1 17 8530 1 1 20 ALA N N -6.850 -5.226 0.043 1.00 . A A . 20 ALA N 1 1 17 8531 1 1 20 ALA O O -7.912 -5.167 -2.490 1.00 . A A . 20 ALA O 1 1 17 8532 1 1 21 SER C C -10.127 -6.232 -4.022 1.00 . A A . 21 SER C 1 1 17 8533 1 1 21 SER CA C -9.222 -7.335 -3.504 1.00 . A A . 21 SER CA 1 1 17 8534 1 1 21 SER CB C -9.832 -8.705 -3.705 1.00 . A A . 21 SER CB 1 1 17 8535 1 1 21 SER H H -9.209 -7.794 -1.458 1.00 . A A . 21 SER H 1 1 17 8536 1 1 21 SER HA H -8.283 -7.281 -4.034 1.00 . A A . 21 SER HA 1 1 17 8537 1 1 21 SER HB2 H -10.756 -8.775 -3.151 1.00 . A A . 21 SER HB2 1 1 17 8538 1 1 21 SER HB3 H -10.023 -8.864 -4.756 1.00 . A A . 21 SER HB3 1 1 17 8539 1 1 21 SER HG H -8.039 -9.343 -3.346 1.00 . A A . 21 SER HG 1 1 17 8540 1 1 21 SER N N -8.938 -7.115 -2.113 1.00 . A A . 21 SER N 1 1 17 8541 1 1 21 SER O O -11.167 -5.920 -3.414 1.00 . A A . 21 SER O 1 1 17 8542 1 1 21 SER OG O -8.930 -9.711 -3.246 1.00 . A A . 21 SER OG 1 1 17 8543 1 1 22 GLY C C -9.526 -3.253 -5.475 1.00 . A A . 22 GLY C 1 1 17 8544 1 1 22 GLY CA C -10.385 -4.489 -5.630 1.00 . A A . 22 GLY CA 1 1 17 8545 1 1 22 GLY H H -8.922 -5.982 -5.576 1.00 . A A . 22 GLY H 1 1 17 8546 1 1 22 GLY HA2 H -10.595 -4.656 -6.676 1.00 . A A . 22 GLY HA2 1 1 17 8547 1 1 22 GLY HA3 H -11.311 -4.343 -5.094 1.00 . A A . 22 GLY HA3 1 1 17 8548 1 1 22 GLY N N -9.712 -5.634 -5.104 1.00 . A A . 22 GLY N 1 1 17 8549 1 1 22 GLY O O -9.802 -2.210 -6.077 1.00 . A A . 22 GLY O 1 1 17 8550 1 1 23 THR C C -6.154 -2.866 -4.810 1.00 . A A . 23 THR C 1 1 17 8551 1 1 23 THR CA C -7.527 -2.304 -4.492 1.00 . A A . 23 THR CA 1 1 17 8552 1 1 23 THR CB C -7.553 -1.687 -3.051 1.00 . A A . 23 THR CB 1 1 17 8553 1 1 23 THR CG2 C -8.920 -1.106 -2.746 1.00 . A A . 23 THR CG2 1 1 17 8554 1 1 23 THR H H -8.359 -4.195 -4.152 1.00 . A A . 23 THR H 1 1 17 8555 1 1 23 THR HA H -7.755 -1.538 -5.219 1.00 . A A . 23 THR HA 1 1 17 8556 1 1 23 THR HB H -6.817 -0.898 -2.974 1.00 . A A . 23 THR HB 1 1 17 8557 1 1 23 THR HG1 H -7.453 -3.552 -2.409 1.00 . A A . 23 THR HG1 1 1 17 8558 1 1 23 THR HG21 H -8.915 -0.709 -1.743 1.00 . A A . 23 THR HG21 1 1 17 8559 1 1 23 THR HG22 H -9.671 -1.878 -2.827 1.00 . A A . 23 THR HG22 1 1 17 8560 1 1 23 THR HG23 H -9.140 -0.313 -3.445 1.00 . A A . 23 THR HG23 1 1 17 8561 1 1 23 THR N N -8.492 -3.365 -4.660 1.00 . A A . 23 THR N 1 1 17 8562 1 1 23 THR O O -5.889 -4.045 -4.534 1.00 . A A . 23 THR O 1 1 17 8563 1 1 23 THR OG1 O -7.243 -2.672 -2.062 1.00 . A A . 23 THR OG1 1 1 17 8564 1 1 24 THR C C -2.890 -1.747 -5.159 1.00 . A A . 24 THR C 1 1 17 8565 1 1 24 THR CA C -4.005 -2.570 -5.791 1.00 . A A . 24 THR CA 1 1 17 8566 1 1 24 THR CB C -3.847 -2.577 -7.329 1.00 . A A . 24 THR CB 1 1 17 8567 1 1 24 THR CG2 C -4.790 -3.584 -7.975 1.00 . A A . 24 THR CG2 1 1 17 8568 1 1 24 THR H H -5.545 -1.146 -5.594 1.00 . A A . 24 THR H 1 1 17 8569 1 1 24 THR HA H -3.924 -3.588 -5.441 1.00 . A A . 24 THR HA 1 1 17 8570 1 1 24 THR HB H -2.828 -2.846 -7.566 1.00 . A A . 24 THR HB 1 1 17 8571 1 1 24 THR HG1 H -4.676 -0.755 -7.253 1.00 . A A . 24 THR HG1 1 1 17 8572 1 1 24 THR HG21 H -5.812 -3.308 -7.761 1.00 . A A . 24 THR HG21 1 1 17 8573 1 1 24 THR HG22 H -4.599 -4.567 -7.571 1.00 . A A . 24 THR HG22 1 1 17 8574 1 1 24 THR HG23 H -4.634 -3.592 -9.043 1.00 . A A . 24 THR HG23 1 1 17 8575 1 1 24 THR N N -5.304 -2.084 -5.405 1.00 . A A . 24 THR N 1 1 17 8576 1 1 24 THR O O -2.985 -0.528 -5.073 1.00 . A A . 24 THR O 1 1 17 8577 1 1 24 THR OG1 O -4.117 -1.265 -7.865 1.00 . A A . 24 THR OG1 1 1 17 8578 1 1 25 CYS C C 0.069 -1.059 -5.229 1.00 . A A . 25 CYS C 1 1 17 8579 1 1 25 CYS CA C -0.708 -1.772 -4.131 1.00 . A A . 25 CYS CA 1 1 17 8580 1 1 25 CYS CB C 0.186 -2.812 -3.436 1.00 . A A . 25 CYS CB 1 1 17 8581 1 1 25 CYS H H -1.875 -3.394 -4.772 1.00 . A A . 25 CYS H 1 1 17 8582 1 1 25 CYS HA H -1.042 -1.049 -3.402 1.00 . A A . 25 CYS HA 1 1 17 8583 1 1 25 CYS HB2 H -0.373 -3.291 -2.646 1.00 . A A . 25 CYS HB2 1 1 17 8584 1 1 25 CYS HB3 H 0.479 -3.556 -4.163 1.00 . A A . 25 CYS HB3 1 1 17 8585 1 1 25 CYS N N -1.865 -2.416 -4.706 1.00 . A A . 25 CYS N 1 1 17 8586 1 1 25 CYS O O 0.658 -1.701 -6.102 1.00 . A A . 25 CYS O 1 1 17 8587 1 1 25 CYS SG S 1.707 -2.132 -2.689 1.00 . A A . 25 CYS SG 1 1 17 8588 1 1 26 GLN C C 1.717 1.932 -5.548 1.00 . A A . 26 GLN C 1 1 17 8589 1 1 26 GLN CA C 0.697 1.040 -6.212 1.00 . A A . 26 GLN CA 1 1 17 8590 1 1 26 GLN CB C -0.296 1.843 -7.045 1.00 . A A . 26 GLN CB 1 1 17 8591 1 1 26 GLN CD C -2.192 1.759 -8.700 1.00 . A A . 26 GLN CD 1 1 17 8592 1 1 26 GLN CG C -1.111 0.983 -8.000 1.00 . A A . 26 GLN CG 1 1 17 8593 1 1 26 GLN H H -0.520 0.717 -4.550 1.00 . A A . 26 GLN H 1 1 17 8594 1 1 26 GLN HA H 1.219 0.355 -6.863 1.00 . A A . 26 GLN HA 1 1 17 8595 1 1 26 GLN HB2 H -0.978 2.349 -6.377 1.00 . A A . 26 GLN HB2 1 1 17 8596 1 1 26 GLN HB3 H 0.242 2.579 -7.622 1.00 . A A . 26 GLN HB3 1 1 17 8597 1 1 26 GLN HE21 H -3.499 1.209 -7.328 1.00 . A A . 26 GLN HE21 1 1 17 8598 1 1 26 GLN HE22 H -4.110 2.226 -8.561 1.00 . A A . 26 GLN HE22 1 1 17 8599 1 1 26 GLN HG2 H -0.448 0.569 -8.747 1.00 . A A . 26 GLN HG2 1 1 17 8600 1 1 26 GLN HG3 H -1.566 0.180 -7.441 1.00 . A A . 26 GLN HG3 1 1 17 8601 1 1 26 GLN N N 0.010 0.244 -5.233 1.00 . A A . 26 GLN N 1 1 17 8602 1 1 26 GLN NE2 N -3.371 1.728 -8.151 1.00 . A A . 26 GLN NE2 1 1 17 8603 1 1 26 GLN O O 1.414 2.631 -4.575 1.00 . A A . 26 GLN O 1 1 17 8604 1 1 26 GLN OE1 O -1.973 2.353 -9.764 1.00 . A A . 26 GLN OE1 1 1 17 8605 1 1 27 VAL C C 3.908 4.098 -5.953 1.00 . A A . 27 VAL C 1 1 17 8606 1 1 27 VAL CA C 4.021 2.644 -5.514 1.00 . A A . 27 VAL CA 1 1 17 8607 1 1 27 VAL CB C 5.385 2.057 -5.974 1.00 . A A . 27 VAL CB 1 1 17 8608 1 1 27 VAL CG1 C 6.547 2.807 -5.339 1.00 . A A . 27 VAL CG1 1 1 17 8609 1 1 27 VAL CG2 C 5.471 0.571 -5.644 1.00 . A A . 27 VAL CG2 1 1 17 8610 1 1 27 VAL H H 3.073 1.326 -6.844 1.00 . A A . 27 VAL H 1 1 17 8611 1 1 27 VAL HA H 3.967 2.593 -4.437 1.00 . A A . 27 VAL HA 1 1 17 8612 1 1 27 VAL HB H 5.456 2.172 -7.046 1.00 . A A . 27 VAL HB 1 1 17 8613 1 1 27 VAL HG11 H 7.479 2.380 -5.678 1.00 . A A . 27 VAL HG11 1 1 17 8614 1 1 27 VAL HG12 H 6.484 2.724 -4.264 1.00 . A A . 27 VAL HG12 1 1 17 8615 1 1 27 VAL HG13 H 6.505 3.847 -5.622 1.00 . A A . 27 VAL HG13 1 1 17 8616 1 1 27 VAL HG21 H 6.424 0.182 -5.970 1.00 . A A . 27 VAL HG21 1 1 17 8617 1 1 27 VAL HG22 H 4.677 0.042 -6.150 1.00 . A A . 27 VAL HG22 1 1 17 8618 1 1 27 VAL HG23 H 5.372 0.434 -4.577 1.00 . A A . 27 VAL HG23 1 1 17 8619 1 1 27 VAL N N 2.918 1.886 -6.053 1.00 . A A . 27 VAL N 1 1 17 8620 1 1 27 VAL O O 3.897 4.405 -7.161 1.00 . A A . 27 VAL O 1 1 17 8621 1 1 28 LEU C C 5.025 7.047 -5.062 1.00 . A A . 28 LEU C 1 1 17 8622 1 1 28 LEU CA C 3.677 6.386 -5.272 1.00 . A A . 28 LEU CA 1 1 17 8623 1 1 28 LEU CB C 2.617 7.018 -4.352 1.00 . A A . 28 LEU CB 1 1 17 8624 1 1 28 LEU CD1 C 0.269 7.119 -3.471 1.00 . A A . 28 LEU CD1 1 1 17 8625 1 1 28 LEU CD2 C 0.654 6.552 -5.858 1.00 . A A . 28 LEU CD2 1 1 17 8626 1 1 28 LEU CG C 1.199 6.430 -4.447 1.00 . A A . 28 LEU CG 1 1 17 8627 1 1 28 LEU H H 3.823 4.664 -4.063 1.00 . A A . 28 LEU H 1 1 17 8628 1 1 28 LEU HA H 3.376 6.509 -6.301 1.00 . A A . 28 LEU HA 1 1 17 8629 1 1 28 LEU HB2 H 2.954 6.914 -3.331 1.00 . A A . 28 LEU HB2 1 1 17 8630 1 1 28 LEU HB3 H 2.559 8.072 -4.581 1.00 . A A . 28 LEU HB3 1 1 17 8631 1 1 28 LEU HD11 H 0.251 8.177 -3.680 1.00 . A A . 28 LEU HD11 1 1 17 8632 1 1 28 LEU HD12 H 0.613 6.948 -2.462 1.00 . A A . 28 LEU HD12 1 1 17 8633 1 1 28 LEU HD13 H -0.727 6.718 -3.579 1.00 . A A . 28 LEU HD13 1 1 17 8634 1 1 28 LEU HD21 H 1.285 6.001 -6.538 1.00 . A A . 28 LEU HD21 1 1 17 8635 1 1 28 LEU HD22 H 0.636 7.596 -6.135 1.00 . A A . 28 LEU HD22 1 1 17 8636 1 1 28 LEU HD23 H -0.350 6.155 -5.887 1.00 . A A . 28 LEU HD23 1 1 17 8637 1 1 28 LEU HG H 1.232 5.382 -4.184 1.00 . A A . 28 LEU HG 1 1 17 8638 1 1 28 LEU N N 3.799 4.976 -4.996 1.00 . A A . 28 LEU N 1 1 17 8639 1 1 28 LEU O O 5.544 7.743 -5.924 1.00 . A A . 28 LEU O 1 1 17 8640 1 1 29 ASN C C 7.772 6.157 -3.223 1.00 . A A . 29 ASN C 1 1 17 8641 1 1 29 ASN CA C 6.879 7.333 -3.568 1.00 . A A . 29 ASN CA 1 1 17 8642 1 1 29 ASN CB C 6.709 8.277 -2.353 1.00 . A A . 29 ASN CB 1 1 17 8643 1 1 29 ASN CG C 5.776 9.458 -2.613 1.00 . A A . 29 ASN CG 1 1 17 8644 1 1 29 ASN H H 5.205 6.126 -3.322 1.00 . A A . 29 ASN H 1 1 17 8645 1 1 29 ASN HA H 7.287 7.874 -4.410 1.00 . A A . 29 ASN HA 1 1 17 8646 1 1 29 ASN HB2 H 6.331 7.718 -1.511 1.00 . A A . 29 ASN HB2 1 1 17 8647 1 1 29 ASN HB3 H 7.683 8.669 -2.105 1.00 . A A . 29 ASN HB3 1 1 17 8648 1 1 29 ASN HD21 H 5.167 9.460 -0.724 1.00 . A A . 29 ASN HD21 1 1 17 8649 1 1 29 ASN HD22 H 4.463 10.648 -1.736 1.00 . A A . 29 ASN HD22 1 1 17 8650 1 1 29 ASN N N 5.607 6.776 -3.943 1.00 . A A . 29 ASN N 1 1 17 8651 1 1 29 ASN ND2 N 5.074 9.894 -1.598 1.00 . A A . 29 ASN ND2 1 1 17 8652 1 1 29 ASN O O 7.252 5.063 -3.071 1.00 . A A . 29 ASN O 1 1 17 8653 1 1 29 ASN OD1 O 5.684 9.966 -3.731 1.00 . A A . 29 ASN OD1 1 1 17 8654 1 1 30 PRO C C 9.605 4.411 -1.582 1.00 . A A . 30 PRO C 1 1 17 8655 1 1 30 PRO CA C 10.035 5.219 -2.802 1.00 . A A . 30 PRO CA 1 1 17 8656 1 1 30 PRO CB C 11.362 5.920 -2.522 1.00 . A A . 30 PRO CB 1 1 17 8657 1 1 30 PRO CD C 9.851 7.600 -3.268 1.00 . A A . 30 PRO CD 1 1 17 8658 1 1 30 PRO CG C 11.289 7.164 -3.320 1.00 . A A . 30 PRO CG 1 1 17 8659 1 1 30 PRO HA H 10.143 4.558 -3.647 1.00 . A A . 30 PRO HA 1 1 17 8660 1 1 30 PRO HB2 H 11.447 6.130 -1.466 1.00 . A A . 30 PRO HB2 1 1 17 8661 1 1 30 PRO HB3 H 12.182 5.295 -2.843 1.00 . A A . 30 PRO HB3 1 1 17 8662 1 1 30 PRO HD2 H 9.695 8.243 -2.415 1.00 . A A . 30 PRO HD2 1 1 17 8663 1 1 30 PRO HD3 H 9.556 8.106 -4.176 1.00 . A A . 30 PRO HD3 1 1 17 8664 1 1 30 PRO HG2 H 11.931 7.919 -2.889 1.00 . A A . 30 PRO HG2 1 1 17 8665 1 1 30 PRO HG3 H 11.581 6.960 -4.339 1.00 . A A . 30 PRO HG3 1 1 17 8666 1 1 30 PRO N N 9.112 6.332 -3.103 1.00 . A A . 30 PRO N 1 1 17 8667 1 1 30 PRO O O 9.641 3.166 -1.594 1.00 . A A . 30 PRO O 1 1 17 8668 1 1 31 TYR C C 7.254 4.345 0.709 1.00 . A A . 31 TYR C 1 1 17 8669 1 1 31 TYR CA C 8.774 4.411 0.640 1.00 . A A . 31 TYR CA 1 1 17 8670 1 1 31 TYR CB C 9.282 5.145 1.885 1.00 . A A . 31 TYR CB 1 1 17 8671 1 1 31 TYR CD1 C 11.696 4.486 2.281 1.00 . A A . 31 TYR CD1 1 1 17 8672 1 1 31 TYR CD2 C 11.253 6.694 1.550 1.00 . A A . 31 TYR CD2 1 1 17 8673 1 1 31 TYR CE1 C 13.043 4.762 2.303 1.00 . A A . 31 TYR CE1 1 1 17 8674 1 1 31 TYR CE2 C 12.588 6.978 1.571 1.00 . A A . 31 TYR CE2 1 1 17 8675 1 1 31 TYR CG C 10.774 5.444 1.904 1.00 . A A . 31 TYR CG 1 1 17 8676 1 1 31 TYR CZ C 13.481 6.013 1.944 1.00 . A A . 31 TYR CZ 1 1 17 8677 1 1 31 TYR H H 9.156 6.081 -0.575 1.00 . A A . 31 TYR H 1 1 17 8678 1 1 31 TYR HA H 9.191 3.417 0.634 1.00 . A A . 31 TYR HA 1 1 17 8679 1 1 31 TYR HB2 H 8.759 6.086 1.970 1.00 . A A . 31 TYR HB2 1 1 17 8680 1 1 31 TYR HB3 H 9.048 4.540 2.746 1.00 . A A . 31 TYR HB3 1 1 17 8681 1 1 31 TYR HD1 H 11.340 3.506 2.563 1.00 . A A . 31 TYR HD1 1 1 17 8682 1 1 31 TYR HD2 H 10.563 7.468 1.254 1.00 . A A . 31 TYR HD2 1 1 17 8683 1 1 31 TYR HE1 H 13.746 3.999 2.601 1.00 . A A . 31 TYR HE1 1 1 17 8684 1 1 31 TYR HE2 H 12.934 7.962 1.293 1.00 . A A . 31 TYR HE2 1 1 17 8685 1 1 31 TYR HH H 15.258 5.515 1.571 1.00 . A A . 31 TYR HH 1 1 17 8686 1 1 31 TYR N N 9.185 5.102 -0.541 1.00 . A A . 31 TYR N 1 1 17 8687 1 1 31 TYR O O 6.698 3.419 1.289 1.00 . A A . 31 TYR O 1 1 17 8688 1 1 31 TYR OH O 14.830 6.299 1.943 1.00 . A A . 31 TYR OH 1 1 17 8689 1 1 32 TYR C C 4.475 4.558 -1.013 1.00 . A A . 32 TYR C 1 1 17 8690 1 1 32 TYR CA C 5.131 5.279 0.170 1.00 . A A . 32 TYR CA 1 1 17 8691 1 1 32 TYR CB C 4.536 6.679 0.362 1.00 . A A . 32 TYR CB 1 1 17 8692 1 1 32 TYR CD1 C 2.746 6.293 2.084 1.00 . A A . 32 TYR CD1 1 1 17 8693 1 1 32 TYR CD2 C 2.055 6.853 -0.127 1.00 . A A . 32 TYR CD2 1 1 17 8694 1 1 32 TYR CE1 C 1.434 6.194 2.478 1.00 . A A . 32 TYR CE1 1 1 17 8695 1 1 32 TYR CE2 C 0.737 6.765 0.269 1.00 . A A . 32 TYR CE2 1 1 17 8696 1 1 32 TYR CG C 3.083 6.620 0.778 1.00 . A A . 32 TYR CG 1 1 17 8697 1 1 32 TYR CZ C 0.434 6.430 1.572 1.00 . A A . 32 TYR CZ 1 1 17 8698 1 1 32 TYR H H 7.041 5.982 -0.413 1.00 . A A . 32 TYR H 1 1 17 8699 1 1 32 TYR HA H 4.896 4.697 1.049 1.00 . A A . 32 TYR HA 1 1 17 8700 1 1 32 TYR HB2 H 5.091 7.218 1.117 1.00 . A A . 32 TYR HB2 1 1 17 8701 1 1 32 TYR HB3 H 4.587 7.217 -0.573 1.00 . A A . 32 TYR HB3 1 1 17 8702 1 1 32 TYR HD1 H 3.535 6.110 2.798 1.00 . A A . 32 TYR HD1 1 1 17 8703 1 1 32 TYR HD2 H 2.294 7.111 -1.149 1.00 . A A . 32 TYR HD2 1 1 17 8704 1 1 32 TYR HE1 H 1.191 5.943 3.501 1.00 . A A . 32 TYR HE1 1 1 17 8705 1 1 32 TYR HE2 H -0.055 6.953 -0.441 1.00 . A A . 32 TYR HE2 1 1 17 8706 1 1 32 TYR HH H -0.980 6.767 2.810 1.00 . A A . 32 TYR HH 1 1 17 8707 1 1 32 TYR N N 6.571 5.291 0.098 1.00 . A A . 32 TYR N 1 1 17 8708 1 1 32 TYR O O 4.514 5.031 -2.147 1.00 . A A . 32 TYR O 1 1 17 8709 1 1 32 TYR OH O -0.877 6.316 1.961 1.00 . A A . 32 TYR OH 1 1 17 8710 1 1 33 SER C C 1.674 2.646 -1.139 1.00 . A A . 33 SER C 1 1 17 8711 1 1 33 SER CA C 3.073 2.749 -1.703 1.00 . A A . 33 SER CA 1 1 17 8712 1 1 33 SER CB C 3.699 1.372 -1.900 1.00 . A A . 33 SER CB 1 1 17 8713 1 1 33 SER H H 3.843 3.143 0.188 1.00 . A A . 33 SER H 1 1 17 8714 1 1 33 SER HA H 3.059 3.304 -2.630 1.00 . A A . 33 SER HA 1 1 17 8715 1 1 33 SER HB2 H 3.616 0.804 -0.984 1.00 . A A . 33 SER HB2 1 1 17 8716 1 1 33 SER HB3 H 3.197 0.850 -2.703 1.00 . A A . 33 SER HB3 1 1 17 8717 1 1 33 SER HG H 5.469 0.615 -2.261 1.00 . A A . 33 SER HG 1 1 17 8718 1 1 33 SER N N 3.829 3.482 -0.727 1.00 . A A . 33 SER N 1 1 17 8719 1 1 33 SER O O 1.537 2.421 0.048 1.00 . A A . 33 SER O 1 1 17 8720 1 1 33 SER OG O 5.075 1.491 -2.221 1.00 . A A . 33 SER OG 1 1 17 8721 1 1 34 GLN C C -1.635 1.930 -2.151 1.00 . A A . 34 GLN C 1 1 17 8722 1 1 34 GLN CA C -0.694 2.883 -1.417 1.00 . A A . 34 GLN CA 1 1 17 8723 1 1 34 GLN CB C -1.181 4.338 -1.503 1.00 . A A . 34 GLN CB 1 1 17 8724 1 1 34 GLN CD C -2.974 6.063 -1.098 1.00 . A A . 34 GLN CD 1 1 17 8725 1 1 34 GLN CG C -2.587 4.595 -1.017 1.00 . A A . 34 GLN CG 1 1 17 8726 1 1 34 GLN H H 0.797 2.868 -2.914 1.00 . A A . 34 GLN H 1 1 17 8727 1 1 34 GLN HA H -0.660 2.602 -0.374 1.00 . A A . 34 GLN HA 1 1 17 8728 1 1 34 GLN HB2 H -0.532 4.927 -0.871 1.00 . A A . 34 GLN HB2 1 1 17 8729 1 1 34 GLN HB3 H -1.096 4.681 -2.523 1.00 . A A . 34 GLN HB3 1 1 17 8730 1 1 34 GLN HE21 H -2.276 6.391 0.725 1.00 . A A . 34 GLN HE21 1 1 17 8731 1 1 34 GLN HE22 H -2.957 7.749 -0.069 1.00 . A A . 34 GLN HE22 1 1 17 8732 1 1 34 GLN HG2 H -3.275 4.020 -1.621 1.00 . A A . 34 GLN HG2 1 1 17 8733 1 1 34 GLN HG3 H -2.662 4.273 0.010 1.00 . A A . 34 GLN HG3 1 1 17 8734 1 1 34 GLN N N 0.658 2.815 -1.940 1.00 . A A . 34 GLN N 1 1 17 8735 1 1 34 GLN NE2 N -2.713 6.800 -0.061 1.00 . A A . 34 GLN NE2 1 1 17 8736 1 1 34 GLN O O -1.486 1.699 -3.352 1.00 . A A . 34 GLN O 1 1 17 8737 1 1 34 GLN OE1 O -3.500 6.529 -2.102 1.00 . A A . 34 GLN OE1 1 1 17 8738 1 1 35 CYS C C -4.617 1.316 -2.670 1.00 . A A . 35 CYS C 1 1 17 8739 1 1 35 CYS CA C -3.557 0.478 -1.981 1.00 . A A . 35 CYS CA 1 1 17 8740 1 1 35 CYS CB C -4.231 -0.368 -0.907 1.00 . A A . 35 CYS CB 1 1 17 8741 1 1 35 CYS H H -2.555 1.463 -0.437 1.00 . A A . 35 CYS H 1 1 17 8742 1 1 35 CYS HA H -3.088 -0.176 -2.702 1.00 . A A . 35 CYS HA 1 1 17 8743 1 1 35 CYS HB2 H -4.855 0.253 -0.286 1.00 . A A . 35 CYS HB2 1 1 17 8744 1 1 35 CYS HB3 H -4.872 -1.067 -1.415 1.00 . A A . 35 CYS HB3 1 1 17 8745 1 1 35 CYS N N -2.558 1.338 -1.411 1.00 . A A . 35 CYS N 1 1 17 8746 1 1 35 CYS O O -5.424 1.986 -2.006 1.00 . A A . 35 CYS O 1 1 17 8747 1 1 35 CYS SG S -3.102 -1.323 0.148 1.00 . A A . 35 CYS SG 1 1 17 8748 1 1 36 LEU C C -6.238 0.976 -5.612 1.00 . A A . 36 LEU C 1 1 17 8749 1 1 36 LEU CA C -5.542 1.991 -4.770 1.00 . A A . 36 LEU CA 1 1 17 8750 1 1 36 LEU CB C -4.875 3.063 -5.630 1.00 . A A . 36 LEU CB 1 1 17 8751 1 1 36 LEU CD1 C -3.550 5.175 -5.829 1.00 . A A . 36 LEU CD1 1 1 17 8752 1 1 36 LEU CD2 C -5.335 4.971 -4.094 1.00 . A A . 36 LEU CD2 1 1 17 8753 1 1 36 LEU CG C -4.258 4.231 -4.870 1.00 . A A . 36 LEU CG 1 1 17 8754 1 1 36 LEU H H -3.896 0.786 -4.424 1.00 . A A . 36 LEU H 1 1 17 8755 1 1 36 LEU HA H -6.269 2.452 -4.119 1.00 . A A . 36 LEU HA 1 1 17 8756 1 1 36 LEU HB2 H -4.099 2.588 -6.210 1.00 . A A . 36 LEU HB2 1 1 17 8757 1 1 36 LEU HB3 H -5.615 3.460 -6.309 1.00 . A A . 36 LEU HB3 1 1 17 8758 1 1 36 LEU HD11 H -4.260 5.565 -6.543 1.00 . A A . 36 LEU HD11 1 1 17 8759 1 1 36 LEU HD12 H -2.772 4.641 -6.355 1.00 . A A . 36 LEU HD12 1 1 17 8760 1 1 36 LEU HD13 H -3.114 5.992 -5.274 1.00 . A A . 36 LEU HD13 1 1 17 8761 1 1 36 LEU HD21 H -6.085 5.340 -4.776 1.00 . A A . 36 LEU HD21 1 1 17 8762 1 1 36 LEU HD22 H -4.885 5.801 -3.568 1.00 . A A . 36 LEU HD22 1 1 17 8763 1 1 36 LEU HD23 H -5.791 4.309 -3.373 1.00 . A A . 36 LEU HD23 1 1 17 8764 1 1 36 LEU HG H -3.529 3.856 -4.167 1.00 . A A . 36 LEU HG 1 1 17 8765 1 1 36 LEU N N -4.592 1.307 -3.959 1.00 . A A . 36 LEU N 1 1 17 8766 1 1 36 LEU O O -5.624 0.451 -6.563 1.00 . A A . 36 LEU O 1 1 17 8767 1 1 36 LEU OXT O -7.365 0.636 -5.290 1.00 . A A . 36 LEU OXT 1 1 17 8768 2 2 1 MAN C1 C 8.992 -4.358 9.873 1.00 . B A . 101 MAN C1 1 1 17 8769 2 2 1 MAN C2 C 9.011 -3.655 11.259 1.00 . B A . 101 MAN C2 1 1 17 8770 2 2 1 MAN C3 C 9.801 -2.341 11.219 1.00 . B A . 101 MAN C3 1 1 17 8771 2 2 1 MAN C4 C 9.776 -1.713 9.819 1.00 . B A . 101 MAN C4 1 1 17 8772 2 2 1 MAN C5 C 10.416 -2.685 8.786 1.00 . B A . 101 MAN C5 1 1 17 8773 2 2 1 MAN C6 C 11.920 -2.477 8.629 1.00 . B A . 101 MAN C6 1 1 17 8774 2 2 1 MAN H1 H 8.932 -5.437 10.081 1.00 . B A . 101 MAN H1 1 1 17 8775 2 2 1 MAN H2 H 7.975 -3.464 11.579 1.00 . B A . 101 MAN H2 1 1 17 8776 2 2 1 MAN H3 H 9.300 -1.694 11.955 1.00 . B A . 101 MAN H3 1 1 17 8777 2 2 1 MAN H4 H 10.370 -0.789 9.845 1.00 . B A . 101 MAN H4 1 1 17 8778 2 2 1 MAN H5 H 9.930 -2.564 7.806 1.00 . B A . 101 MAN H5 1 1 17 8779 2 2 1 MAN H61 H 12.308 -3.264 7.965 1.00 . B A . 101 MAN H61 1 1 17 8780 2 2 1 MAN H62 H 12.399 -2.595 9.612 1.00 . B A . 101 MAN H62 1 1 17 8781 2 2 1 MAN HO2 H 9.175 -5.339 12.213 1.00 . B A . 101 MAN HO2 1 1 17 8782 2 2 1 MAN HO3 H 10.975 -3.226 12.392 1.00 . B A . 101 MAN HO3 1 1 17 8783 2 2 1 MAN HO4 H 8.548 -0.923 8.582 1.00 . B A . 101 MAN HO4 1 1 17 8784 2 2 1 MAN HO6 H 12.334 -0.553 8.824 1.00 . B A . 101 MAN HO6 1 1 17 8785 2 2 1 MAN O2 O 9.664 -4.505 12.201 1.00 . B A . 101 MAN O2 1 1 17 8786 2 2 1 MAN O3 O 11.131 -2.635 11.642 1.00 . B A . 101 MAN O3 1 1 17 8787 2 2 1 MAN O4 O 8.446 -1.365 9.437 1.00 . B A . 101 MAN O4 1 1 17 8788 2 2 1 MAN O5 O 10.220 -4.088 9.190 1.00 . B A . 101 MAN O5 1 1 17 8789 2 2 1 MAN O6 O 12.228 -1.183 8.099 1.00 . B A . 101 MAN O6 1 1 18 8790 1 1 1 THR C C -5.445 -5.836 4.574 1.00 . A A . 1 THR C 1 1 18 8791 1 1 1 THR CA C -5.425 -7.341 4.335 1.00 . A A . 1 THR CA 1 1 18 8792 1 1 1 THR CB C -6.827 -7.887 4.042 1.00 . A A . 1 THR CB 1 1 18 8793 1 1 1 THR CG2 C -7.324 -7.408 2.692 1.00 . A A . 1 THR CG2 1 1 18 8794 1 1 1 THR H1 H -4.865 -9.012 5.388 1.00 . A A . 1 THR H1 1 1 18 8795 1 1 1 THR H2 H -5.569 -7.775 6.294 1.00 . A A . 1 THR H2 1 1 18 8796 1 1 1 THR H3 H -3.980 -7.601 5.782 1.00 . A A . 1 THR H3 1 1 18 8797 1 1 1 THR HA H -4.765 -7.560 3.508 1.00 . A A . 1 THR HA 1 1 18 8798 1 1 1 THR HB H -7.506 -7.563 4.817 1.00 . A A . 1 THR HB 1 1 18 8799 1 1 1 THR HG1 H -7.612 -9.671 3.742 1.00 . A A . 1 THR HG1 1 1 18 8800 1 1 1 THR HG21 H -7.363 -6.328 2.685 1.00 . A A . 1 THR HG21 1 1 18 8801 1 1 1 THR HG22 H -8.313 -7.803 2.509 1.00 . A A . 1 THR HG22 1 1 18 8802 1 1 1 THR HG23 H -6.652 -7.748 1.918 1.00 . A A . 1 THR HG23 1 1 18 8803 1 1 1 THR N N -4.909 -7.982 5.518 1.00 . A A . 1 THR N 1 1 18 8804 1 1 1 THR O O -6.194 -5.333 5.416 1.00 . A A . 1 THR O 1 1 18 8805 1 1 1 THR OG1 O -6.751 -9.329 4.021 1.00 . A A . 1 THR OG1 1 1 18 8806 1 1 2 GLN C C -5.436 -2.928 3.310 1.00 . A A . 2 GLN C 1 1 18 8807 1 1 2 GLN CA C -4.375 -3.741 4.080 1.00 . A A . 2 GLN CA 1 1 18 8808 1 1 2 GLN CB C -2.918 -3.423 3.683 1.00 . A A . 2 GLN CB 1 1 18 8809 1 1 2 GLN CD C -2.809 -0.903 4.066 1.00 . A A . 2 GLN CD 1 1 18 8810 1 1 2 GLN CG C -2.282 -2.260 4.443 1.00 . A A . 2 GLN CG 1 1 18 8811 1 1 2 GLN H H -4.103 -5.584 3.133 1.00 . A A . 2 GLN H 1 1 18 8812 1 1 2 GLN HA H -4.506 -3.554 5.135 1.00 . A A . 2 GLN HA 1 1 18 8813 1 1 2 GLN HB2 H -2.322 -4.303 3.872 1.00 . A A . 2 GLN HB2 1 1 18 8814 1 1 2 GLN HB3 H -2.880 -3.212 2.625 1.00 . A A . 2 GLN HB3 1 1 18 8815 1 1 2 GLN HE21 H -3.021 -1.451 2.184 1.00 . A A . 2 GLN HE21 1 1 18 8816 1 1 2 GLN HE22 H -3.517 0.140 2.573 1.00 . A A . 2 GLN HE22 1 1 18 8817 1 1 2 GLN HG2 H -2.487 -2.404 5.494 1.00 . A A . 2 GLN HG2 1 1 18 8818 1 1 2 GLN HG3 H -1.213 -2.290 4.295 1.00 . A A . 2 GLN HG3 1 1 18 8819 1 1 2 GLN N N -4.597 -5.140 3.861 1.00 . A A . 2 GLN N 1 1 18 8820 1 1 2 GLN NE2 N -3.134 -0.722 2.829 1.00 . A A . 2 GLN NE2 1 1 18 8821 1 1 2 GLN O O -5.707 -3.189 2.128 1.00 . A A . 2 GLN O 1 1 18 8822 1 1 2 GLN OE1 O -2.877 0.000 4.891 1.00 . A A . 2 GLN OE1 1 1 18 8823 1 1 3 SER C C -6.855 -0.208 2.370 1.00 . A A . 3 SER C 1 1 18 8824 1 1 3 SER CA C -7.157 -1.205 3.527 1.00 . A A . 3 SER CA 1 1 18 8825 1 1 3 SER CB C -7.751 -0.493 4.729 1.00 . A A . 3 SER CB 1 1 18 8826 1 1 3 SER H H -5.658 -1.731 4.878 1.00 . A A . 3 SER H 1 1 18 8827 1 1 3 SER HA H -7.896 -1.912 3.181 1.00 . A A . 3 SER HA 1 1 18 8828 1 1 3 SER HB2 H -7.044 0.239 5.090 1.00 . A A . 3 SER HB2 1 1 18 8829 1 1 3 SER HB3 H -8.671 -0.002 4.457 1.00 . A A . 3 SER HB3 1 1 18 8830 1 1 3 SER HG H -8.979 -1.526 5.820 1.00 . A A . 3 SER HG 1 1 18 8831 1 1 3 SER N N -6.011 -1.967 3.993 1.00 . A A . 3 SER N 1 1 18 8832 1 1 3 SER O O -5.689 0.112 2.059 1.00 . A A . 3 SER O 1 1 18 8833 1 1 3 SER OG O -8.017 -1.438 5.764 1.00 . A A . 3 SER OG 1 1 18 8834 1 1 4 HIS C C -7.260 2.517 1.085 1.00 . A A . 4 HIS C 1 1 18 8835 1 1 4 HIS CA C -7.856 1.194 0.622 1.00 . A A . 4 HIS CA 1 1 18 8836 1 1 4 HIS CB C -9.272 1.421 0.049 1.00 . A A . 4 HIS CB 1 1 18 8837 1 1 4 HIS CD2 C -8.348 2.398 -2.194 1.00 . A A . 4 HIS CD2 1 1 18 8838 1 1 4 HIS CE1 C -10.225 2.494 -3.288 1.00 . A A . 4 HIS CE1 1 1 18 8839 1 1 4 HIS CG C -9.324 1.979 -1.357 1.00 . A A . 4 HIS CG 1 1 18 8840 1 1 4 HIS H H -8.815 0.055 2.110 1.00 . A A . 4 HIS H 1 1 18 8841 1 1 4 HIS HA H -7.226 0.756 -0.138 1.00 . A A . 4 HIS HA 1 1 18 8842 1 1 4 HIS HB2 H -9.804 0.482 0.042 1.00 . A A . 4 HIS HB2 1 1 18 8843 1 1 4 HIS HB3 H -9.796 2.109 0.696 1.00 . A A . 4 HIS HB3 1 1 18 8844 1 1 4 HIS HD1 H -11.376 1.814 -1.744 1.00 . A A . 4 HIS HD1 1 1 18 8845 1 1 4 HIS HD2 H -7.297 2.476 -1.957 1.00 . A A . 4 HIS HD2 1 1 18 8846 1 1 4 HIS HE1 H -10.953 2.654 -4.068 1.00 . A A . 4 HIS HE1 1 1 18 8847 1 1 4 HIS HE2 H -8.473 2.380 -4.206 1.00 . A A . 4 HIS HE2 1 1 18 8848 1 1 4 HIS N N -7.927 0.289 1.758 1.00 . A A . 4 HIS N 1 1 18 8849 1 1 4 HIS ND1 N -10.482 2.058 -2.077 1.00 . A A . 4 HIS ND1 1 1 18 8850 1 1 4 HIS NE2 N -8.929 2.704 -3.391 1.00 . A A . 4 HIS NE2 1 1 18 8851 1 1 4 HIS O O -7.687 3.059 2.099 1.00 . A A . 4 HIS O 1 1 18 8852 1 1 5 TYR C C -4.563 4.136 1.804 1.00 . A A . 5 TYR C 1 1 18 8853 1 1 5 TYR CA C -5.538 4.241 0.626 1.00 . A A . 5 TYR CA 1 1 18 8854 1 1 5 TYR CB C -6.458 5.481 0.726 1.00 . A A . 5 TYR CB 1 1 18 8855 1 1 5 TYR CD1 C -8.495 5.766 -0.753 1.00 . A A . 5 TYR CD1 1 1 18 8856 1 1 5 TYR CD2 C -6.370 6.304 -1.668 1.00 . A A . 5 TYR CD2 1 1 18 8857 1 1 5 TYR CE1 C -9.097 6.104 -1.954 1.00 . A A . 5 TYR CE1 1 1 18 8858 1 1 5 TYR CE2 C -6.965 6.645 -2.870 1.00 . A A . 5 TYR CE2 1 1 18 8859 1 1 5 TYR CG C -7.125 5.861 -0.589 1.00 . A A . 5 TYR CG 1 1 18 8860 1 1 5 TYR CZ C -8.328 6.542 -3.006 1.00 . A A . 5 TYR CZ 1 1 18 8861 1 1 5 TYR H H -5.949 2.477 -0.433 1.00 . A A . 5 TYR H 1 1 18 8862 1 1 5 TYR HA H -4.905 4.365 -0.242 1.00 . A A . 5 TYR HA 1 1 18 8863 1 1 5 TYR HB2 H -7.240 5.274 1.440 1.00 . A A . 5 TYR HB2 1 1 18 8864 1 1 5 TYR HB3 H -5.879 6.326 1.067 1.00 . A A . 5 TYR HB3 1 1 18 8865 1 1 5 TYR HD1 H -9.102 5.424 0.072 1.00 . A A . 5 TYR HD1 1 1 18 8866 1 1 5 TYR HD2 H -5.299 6.384 -1.558 1.00 . A A . 5 TYR HD2 1 1 18 8867 1 1 5 TYR HE1 H -10.166 6.026 -2.067 1.00 . A A . 5 TYR HE1 1 1 18 8868 1 1 5 TYR HE2 H -6.359 6.988 -3.696 1.00 . A A . 5 TYR HE2 1 1 18 8869 1 1 5 TYR HH H -8.528 6.340 -4.911 1.00 . A A . 5 TYR HH 1 1 18 8870 1 1 5 TYR N N -6.254 2.990 0.350 1.00 . A A . 5 TYR N 1 1 18 8871 1 1 5 TYR O O -4.044 5.142 2.286 1.00 . A A . 5 TYR O 1 1 18 8872 1 1 5 TYR OH O -8.928 6.867 -4.207 1.00 . A A . 5 TYR OH 1 1 18 8873 1 1 6 GLY C C -1.964 2.294 2.584 1.00 . A A . 6 GLY C 1 1 18 8874 1 1 6 GLY CA C -3.270 2.716 3.233 1.00 . A A . 6 GLY CA 1 1 18 8875 1 1 6 GLY H H -4.765 2.162 1.846 1.00 . A A . 6 GLY H 1 1 18 8876 1 1 6 GLY HA2 H -3.122 3.631 3.786 1.00 . A A . 6 GLY HA2 1 1 18 8877 1 1 6 GLY HA3 H -3.593 1.935 3.907 1.00 . A A . 6 GLY HA3 1 1 18 8878 1 1 6 GLY N N -4.281 2.928 2.219 1.00 . A A . 6 GLY N 1 1 18 8879 1 1 6 GLY O O -1.965 1.933 1.390 1.00 . A A . 6 GLY O 1 1 18 8880 1 1 7 GLN C C 0.523 0.414 2.732 1.00 . A A . 7 GLN C 1 1 18 8881 1 1 7 GLN CA C 0.436 1.937 2.816 1.00 . A A . 7 GLN CA 1 1 18 8882 1 1 7 GLN CB C 1.573 2.504 3.694 1.00 . A A . 7 GLN CB 1 1 18 8883 1 1 7 GLN CD C 4.086 2.795 4.048 1.00 . A A . 7 GLN CD 1 1 18 8884 1 1 7 GLN CG C 2.985 2.237 3.153 1.00 . A A . 7 GLN CG 1 1 18 8885 1 1 7 GLN H H -0.941 2.600 4.273 1.00 . A A . 7 GLN H 1 1 18 8886 1 1 7 GLN HA H 0.522 2.340 1.818 1.00 . A A . 7 GLN HA 1 1 18 8887 1 1 7 GLN HB2 H 1.448 3.573 3.779 1.00 . A A . 7 GLN HB2 1 1 18 8888 1 1 7 GLN HB3 H 1.501 2.063 4.677 1.00 . A A . 7 GLN HB3 1 1 18 8889 1 1 7 GLN HE21 H 5.314 3.143 2.490 1.00 . A A . 7 GLN HE21 1 1 18 8890 1 1 7 GLN HE22 H 5.902 3.549 4.038 1.00 . A A . 7 GLN HE22 1 1 18 8891 1 1 7 GLN HG2 H 3.122 1.167 3.080 1.00 . A A . 7 GLN HG2 1 1 18 8892 1 1 7 GLN HG3 H 3.076 2.669 2.168 1.00 . A A . 7 GLN HG3 1 1 18 8893 1 1 7 GLN N N -0.869 2.327 3.333 1.00 . A A . 7 GLN N 1 1 18 8894 1 1 7 GLN NE2 N 5.193 3.193 3.461 1.00 . A A . 7 GLN NE2 1 1 18 8895 1 1 7 GLN O O 0.413 -0.271 3.735 1.00 . A A . 7 GLN O 1 1 18 8896 1 1 7 GLN OE1 O 3.938 2.875 5.260 1.00 . A A . 7 GLN OE1 1 1 18 8897 1 1 8 CYS C C 2.091 -2.153 1.557 1.00 . A A . 8 CYS C 1 1 18 8898 1 1 8 CYS CA C 0.736 -1.533 1.308 1.00 . A A . 8 CYS CA 1 1 18 8899 1 1 8 CYS CB C 0.259 -1.854 -0.100 1.00 . A A . 8 CYS CB 1 1 18 8900 1 1 8 CYS H H 0.843 0.524 0.784 1.00 . A A . 8 CYS H 1 1 18 8901 1 1 8 CYS HA H 0.051 -2.000 2.002 1.00 . A A . 8 CYS HA 1 1 18 8902 1 1 8 CYS HB2 H 0.383 -2.911 -0.280 1.00 . A A . 8 CYS HB2 1 1 18 8903 1 1 8 CYS HB3 H -0.789 -1.606 -0.182 1.00 . A A . 8 CYS HB3 1 1 18 8904 1 1 8 CYS N N 0.716 -0.093 1.539 1.00 . A A . 8 CYS N 1 1 18 8905 1 1 8 CYS O O 2.176 -3.252 2.068 1.00 . A A . 8 CYS O 1 1 18 8906 1 1 8 CYS SG S 1.143 -0.964 -1.423 1.00 . A A . 8 CYS SG 1 1 18 8907 1 1 9 GLY C C 5.534 -1.231 0.768 1.00 . A A . 9 GLY C 1 1 18 8908 1 1 9 GLY CA C 4.452 -2.041 1.389 1.00 . A A . 9 GLY CA 1 1 18 8909 1 1 9 GLY H H 3.041 -0.568 0.822 1.00 . A A . 9 GLY H 1 1 18 8910 1 1 9 GLY HA2 H 4.652 -2.132 2.446 1.00 . A A . 9 GLY HA2 1 1 18 8911 1 1 9 GLY HA3 H 4.457 -3.026 0.946 1.00 . A A . 9 GLY HA3 1 1 18 8912 1 1 9 GLY N N 3.150 -1.459 1.209 1.00 . A A . 9 GLY N 1 1 18 8913 1 1 9 GLY O O 6.141 -1.641 -0.225 1.00 . A A . 9 GLY O 1 1 18 8914 1 1 10 GLY C C 7.993 0.610 1.802 1.00 . A A . 10 GLY C 1 1 18 8915 1 1 10 GLY CA C 6.828 0.753 0.873 1.00 . A A . 10 GLY CA 1 1 18 8916 1 1 10 GLY H H 5.253 0.170 2.122 1.00 . A A . 10 GLY H 1 1 18 8917 1 1 10 GLY HA2 H 7.117 0.456 -0.126 1.00 . A A . 10 GLY HA2 1 1 18 8918 1 1 10 GLY HA3 H 6.504 1.782 0.869 1.00 . A A . 10 GLY HA3 1 1 18 8919 1 1 10 GLY N N 5.769 -0.089 1.333 1.00 . A A . 10 GLY N 1 1 18 8920 1 1 10 GLY O O 7.869 -0.084 2.823 1.00 . A A . 10 GLY O 1 1 18 8921 1 1 11 ILE C C 10.007 1.663 3.734 1.00 . A A . 11 ILE C 1 1 18 8922 1 1 11 ILE CA C 10.295 1.159 2.314 1.00 . A A . 11 ILE CA 1 1 18 8923 1 1 11 ILE CB C 11.479 1.956 1.710 1.00 . A A . 11 ILE CB 1 1 18 8924 1 1 11 ILE CD1 C 12.788 2.348 -0.453 1.00 . A A . 11 ILE CD1 1 1 18 8925 1 1 11 ILE CG1 C 11.736 1.521 0.259 1.00 . A A . 11 ILE CG1 1 1 18 8926 1 1 11 ILE CG2 C 12.742 1.746 2.554 1.00 . A A . 11 ILE CG2 1 1 18 8927 1 1 11 ILE H H 9.109 1.824 0.694 1.00 . A A . 11 ILE H 1 1 18 8928 1 1 11 ILE HA H 10.564 0.114 2.367 1.00 . A A . 11 ILE HA 1 1 18 8929 1 1 11 ILE HB H 11.228 3.006 1.724 1.00 . A A . 11 ILE HB 1 1 18 8930 1 1 11 ILE HD11 H 12.472 3.380 -0.483 1.00 . A A . 11 ILE HD11 1 1 18 8931 1 1 11 ILE HD12 H 12.921 1.981 -1.460 1.00 . A A . 11 ILE HD12 1 1 18 8932 1 1 11 ILE HD13 H 13.720 2.273 0.089 1.00 . A A . 11 ILE HD13 1 1 18 8933 1 1 11 ILE HG12 H 12.069 0.494 0.257 1.00 . A A . 11 ILE HG12 1 1 18 8934 1 1 11 ILE HG13 H 10.818 1.595 -0.303 1.00 . A A . 11 ILE HG13 1 1 18 8935 1 1 11 ILE HG21 H 13.557 2.319 2.136 1.00 . A A . 11 ILE HG21 1 1 18 8936 1 1 11 ILE HG22 H 13.002 0.698 2.552 1.00 . A A . 11 ILE HG22 1 1 18 8937 1 1 11 ILE HG23 H 12.550 2.069 3.567 1.00 . A A . 11 ILE HG23 1 1 18 8938 1 1 11 ILE N N 9.096 1.257 1.493 1.00 . A A . 11 ILE N 1 1 18 8939 1 1 11 ILE O O 9.627 2.830 3.940 1.00 . A A . 11 ILE O 1 1 18 8940 1 1 12 GLY C C 8.667 0.373 6.568 1.00 . A A . 12 GLY C 1 1 18 8941 1 1 12 GLY CA C 9.893 1.091 6.054 1.00 . A A . 12 GLY CA 1 1 18 8942 1 1 12 GLY H H 10.434 -0.129 4.434 1.00 . A A . 12 GLY H 1 1 18 8943 1 1 12 GLY HA2 H 10.748 0.803 6.646 1.00 . A A . 12 GLY HA2 1 1 18 8944 1 1 12 GLY HA3 H 9.737 2.155 6.146 1.00 . A A . 12 GLY HA3 1 1 18 8945 1 1 12 GLY N N 10.148 0.778 4.681 1.00 . A A . 12 GLY N 1 1 18 8946 1 1 12 GLY O O 8.556 0.104 7.765 1.00 . A A . 12 GLY O 1 1 18 8947 1 1 13 TYR C C 6.858 -2.128 6.187 1.00 . A A . 13 TYR C 1 1 18 8948 1 1 13 TYR CA C 6.551 -0.657 6.060 1.00 . A A . 13 TYR CA 1 1 18 8949 1 1 13 TYR CB C 5.438 -0.432 5.027 1.00 . A A . 13 TYR CB 1 1 18 8950 1 1 13 TYR CD1 C 3.734 -2.321 4.998 1.00 . A A . 13 TYR CD1 1 1 18 8951 1 1 13 TYR CD2 C 3.178 -0.318 6.160 1.00 . A A . 13 TYR CD2 1 1 18 8952 1 1 13 TYR CE1 C 2.508 -2.863 5.331 1.00 . A A . 13 TYR CE1 1 1 18 8953 1 1 13 TYR CE2 C 1.954 -0.853 6.500 1.00 . A A . 13 TYR CE2 1 1 18 8954 1 1 13 TYR CG C 4.091 -1.038 5.405 1.00 . A A . 13 TYR CG 1 1 18 8955 1 1 13 TYR CZ C 1.624 -2.125 6.083 1.00 . A A . 13 TYR CZ 1 1 18 8956 1 1 13 TYR H H 7.935 0.209 4.724 1.00 . A A . 13 TYR H 1 1 18 8957 1 1 13 TYR HA H 6.235 -0.276 7.020 1.00 . A A . 13 TYR HA 1 1 18 8958 1 1 13 TYR HB2 H 5.293 0.629 4.891 1.00 . A A . 13 TYR HB2 1 1 18 8959 1 1 13 TYR HB3 H 5.745 -0.864 4.087 1.00 . A A . 13 TYR HB3 1 1 18 8960 1 1 13 TYR HD1 H 4.435 -2.898 4.412 1.00 . A A . 13 TYR HD1 1 1 18 8961 1 1 13 TYR HD2 H 3.438 0.678 6.485 1.00 . A A . 13 TYR HD2 1 1 18 8962 1 1 13 TYR HE1 H 2.251 -3.860 5.007 1.00 . A A . 13 TYR HE1 1 1 18 8963 1 1 13 TYR HE2 H 1.257 -0.277 7.091 1.00 . A A . 13 TYR HE2 1 1 18 8964 1 1 13 TYR HH H -0.243 -1.978 6.127 1.00 . A A . 13 TYR HH 1 1 18 8965 1 1 13 TYR N N 7.763 0.033 5.676 1.00 . A A . 13 TYR N 1 1 18 8966 1 1 13 TYR O O 7.536 -2.698 5.333 1.00 . A A . 13 TYR O 1 1 18 8967 1 1 13 TYR OH O 0.396 -2.646 6.401 1.00 . A A . 13 TYR OH 1 1 18 8968 1 1 14 SER C C 5.374 -4.768 7.918 1.00 . A A . 14 SER C 1 1 18 8969 1 1 14 SER CA C 6.656 -4.107 7.480 1.00 . A A . 14 SER CA 1 1 18 8970 1 1 14 SER CB C 7.720 -4.206 8.564 1.00 . A A . 14 SER CB 1 1 18 8971 1 1 14 SER H H 5.862 -2.242 7.898 1.00 . A A . 14 SER H 1 1 18 8972 1 1 14 SER HA H 7.026 -4.563 6.575 1.00 . A A . 14 SER HA 1 1 18 8973 1 1 14 SER HB2 H 7.279 -3.950 9.515 1.00 . A A . 14 SER HB2 1 1 18 8974 1 1 14 SER HB3 H 8.111 -5.212 8.597 1.00 . A A . 14 SER HB3 1 1 18 8975 1 1 14 SER N N 6.395 -2.726 7.234 1.00 . A A . 14 SER N 1 1 18 8976 1 1 14 SER O O 4.919 -4.570 9.046 1.00 . A A . 14 SER O 1 1 18 8977 1 1 14 SER OG O 8.799 -3.291 8.239 1.00 . A A . 14 SER OG 1 1 18 8978 1 1 15 GLY C C 2.889 -6.775 6.134 1.00 . A A . 15 GLY C 1 1 18 8979 1 1 15 GLY CA C 3.516 -6.135 7.344 1.00 . A A . 15 GLY CA 1 1 18 8980 1 1 15 GLY H H 5.137 -5.624 6.129 1.00 . A A . 15 GLY H 1 1 18 8981 1 1 15 GLY HA2 H 3.692 -6.893 8.093 1.00 . A A . 15 GLY HA2 1 1 18 8982 1 1 15 GLY HA3 H 2.837 -5.394 7.740 1.00 . A A . 15 GLY HA3 1 1 18 8983 1 1 15 GLY N N 4.758 -5.495 7.026 1.00 . A A . 15 GLY N 1 1 18 8984 1 1 15 GLY O O 3.602 -7.085 5.164 1.00 . A A . 15 GLY O 1 1 18 8985 1 1 16 PRO C C 0.719 -6.693 3.853 1.00 . A A . 16 PRO C 1 1 18 8986 1 1 16 PRO CA C 0.854 -7.617 5.053 1.00 . A A . 16 PRO CA 1 1 18 8987 1 1 16 PRO CB C -0.532 -7.931 5.652 1.00 . A A . 16 PRO CB 1 1 18 8988 1 1 16 PRO CD C 0.652 -6.582 7.202 1.00 . A A . 16 PRO CD 1 1 18 8989 1 1 16 PRO CG C -0.395 -7.640 7.108 1.00 . A A . 16 PRO CG 1 1 18 8990 1 1 16 PRO HA H 1.342 -8.533 4.759 1.00 . A A . 16 PRO HA 1 1 18 8991 1 1 16 PRO HB2 H -1.276 -7.300 5.189 1.00 . A A . 16 PRO HB2 1 1 18 8992 1 1 16 PRO HB3 H -0.777 -8.969 5.480 1.00 . A A . 16 PRO HB3 1 1 18 8993 1 1 16 PRO HD2 H 0.236 -5.605 6.996 1.00 . A A . 16 PRO HD2 1 1 18 8994 1 1 16 PRO HD3 H 1.142 -6.612 8.163 1.00 . A A . 16 PRO HD3 1 1 18 8995 1 1 16 PRO HG2 H -1.330 -7.287 7.515 1.00 . A A . 16 PRO HG2 1 1 18 8996 1 1 16 PRO HG3 H -0.073 -8.529 7.628 1.00 . A A . 16 PRO HG3 1 1 18 8997 1 1 16 PRO N N 1.568 -6.977 6.142 1.00 . A A . 16 PRO N 1 1 18 8998 1 1 16 PRO O O 0.165 -5.599 3.947 1.00 . A A . 16 PRO O 1 1 18 8999 1 1 17 THR C C -0.029 -6.657 0.665 1.00 . A A . 17 THR C 1 1 18 9000 1 1 17 THR CA C 1.213 -6.387 1.521 1.00 . A A . 17 THR CA 1 1 18 9001 1 1 17 THR CB C 2.504 -6.693 0.742 1.00 . A A . 17 THR CB 1 1 18 9002 1 1 17 THR CG2 C 3.676 -5.897 1.293 1.00 . A A . 17 THR CG2 1 1 18 9003 1 1 17 THR H H 1.567 -8.063 2.705 1.00 . A A . 17 THR H 1 1 18 9004 1 1 17 THR HA H 1.222 -5.336 1.783 1.00 . A A . 17 THR HA 1 1 18 9005 1 1 17 THR HB H 2.343 -6.435 -0.294 1.00 . A A . 17 THR HB 1 1 18 9006 1 1 17 THR HG1 H 2.161 -8.612 0.313 1.00 . A A . 17 THR HG1 1 1 18 9007 1 1 17 THR HG21 H 4.562 -6.100 0.711 1.00 . A A . 17 THR HG21 1 1 18 9008 1 1 17 THR HG22 H 3.849 -6.175 2.322 1.00 . A A . 17 THR HG22 1 1 18 9009 1 1 17 THR HG23 H 3.446 -4.843 1.240 1.00 . A A . 17 THR HG23 1 1 18 9010 1 1 17 THR N N 1.202 -7.153 2.736 1.00 . A A . 17 THR N 1 1 18 9011 1 1 17 THR O O -0.234 -6.024 -0.381 1.00 . A A . 17 THR O 1 1 18 9012 1 1 17 THR OG1 O 2.801 -8.114 0.840 1.00 . A A . 17 THR OG1 1 1 18 9013 1 1 18 VAL C C -3.107 -6.823 0.695 1.00 . A A . 18 VAL C 1 1 18 9014 1 1 18 VAL CA C -2.084 -7.917 0.418 1.00 . A A . 18 VAL CA 1 1 18 9015 1 1 18 VAL CB C -2.664 -9.292 0.851 1.00 . A A . 18 VAL CB 1 1 18 9016 1 1 18 VAL CG1 C -3.975 -9.584 0.123 1.00 . A A . 18 VAL CG1 1 1 18 9017 1 1 18 VAL CG2 C -1.661 -10.399 0.583 1.00 . A A . 18 VAL CG2 1 1 18 9018 1 1 18 VAL H H -0.598 -8.090 1.919 1.00 . A A . 18 VAL H 1 1 18 9019 1 1 18 VAL HA H -1.874 -7.938 -0.641 1.00 . A A . 18 VAL HA 1 1 18 9020 1 1 18 VAL HB H -2.861 -9.257 1.912 1.00 . A A . 18 VAL HB 1 1 18 9021 1 1 18 VAL HG11 H -4.370 -10.535 0.450 1.00 . A A . 18 VAL HG11 1 1 18 9022 1 1 18 VAL HG12 H -3.789 -9.623 -0.939 1.00 . A A . 18 VAL HG12 1 1 18 9023 1 1 18 VAL HG13 H -4.688 -8.800 0.338 1.00 . A A . 18 VAL HG13 1 1 18 9024 1 1 18 VAL HG21 H -2.049 -11.342 0.937 1.00 . A A . 18 VAL HG21 1 1 18 9025 1 1 18 VAL HG22 H -0.727 -10.178 1.075 1.00 . A A . 18 VAL HG22 1 1 18 9026 1 1 18 VAL HG23 H -1.487 -10.464 -0.480 1.00 . A A . 18 VAL HG23 1 1 18 9027 1 1 18 VAL N N -0.847 -7.603 1.105 1.00 . A A . 18 VAL N 1 1 18 9028 1 1 18 VAL O O -3.486 -6.593 1.852 1.00 . A A . 18 VAL O 1 1 18 9029 1 1 19 CYS C C -5.899 -5.645 -0.264 1.00 . A A . 19 CYS C 1 1 18 9030 1 1 19 CYS CA C -4.488 -5.081 -0.229 1.00 . A A . 19 CYS CA 1 1 18 9031 1 1 19 CYS CB C -4.299 -4.063 -1.354 1.00 . A A . 19 CYS CB 1 1 18 9032 1 1 19 CYS H H -3.151 -6.358 -1.225 1.00 . A A . 19 CYS H 1 1 18 9033 1 1 19 CYS HA H -4.333 -4.585 0.717 1.00 . A A . 19 CYS HA 1 1 18 9034 1 1 19 CYS HB2 H -4.402 -4.564 -2.305 1.00 . A A . 19 CYS HB2 1 1 18 9035 1 1 19 CYS HB3 H -5.058 -3.299 -1.268 1.00 . A A . 19 CYS HB3 1 1 18 9036 1 1 19 CYS N N -3.515 -6.141 -0.341 1.00 . A A . 19 CYS N 1 1 18 9037 1 1 19 CYS O O -6.102 -6.813 -0.618 1.00 . A A . 19 CYS O 1 1 18 9038 1 1 19 CYS SG S -2.683 -3.232 -1.343 1.00 . A A . 19 CYS SG 1 1 18 9039 1 1 20 ALA C C -8.776 -5.468 -1.290 1.00 . A A . 20 ALA C 1 1 18 9040 1 1 20 ALA CA C -8.262 -5.195 0.125 1.00 . A A . 20 ALA CA 1 1 18 9041 1 1 20 ALA CB C -9.088 -4.106 0.802 1.00 . A A . 20 ALA CB 1 1 18 9042 1 1 20 ALA H H -6.605 -3.932 0.441 1.00 . A A . 20 ALA H 1 1 18 9043 1 1 20 ALA HA H -8.360 -6.100 0.705 1.00 . A A . 20 ALA HA 1 1 18 9044 1 1 20 ALA HB1 H -10.123 -4.412 0.847 1.00 . A A . 20 ALA HB1 1 1 18 9045 1 1 20 ALA HB2 H -9.009 -3.187 0.238 1.00 . A A . 20 ALA HB2 1 1 18 9046 1 1 20 ALA HB3 H -8.716 -3.948 1.803 1.00 . A A . 20 ALA HB3 1 1 18 9047 1 1 20 ALA N N -6.857 -4.826 0.121 1.00 . A A . 20 ALA N 1 1 18 9048 1 1 20 ALA O O -8.149 -5.061 -2.290 1.00 . A A . 20 ALA O 1 1 18 9049 1 1 21 SER C C -10.819 -5.294 -3.464 1.00 . A A . 21 SER C 1 1 18 9050 1 1 21 SER CA C -10.537 -6.524 -2.584 1.00 . A A . 21 SER CA 1 1 18 9051 1 1 21 SER CB C -11.839 -7.277 -2.246 1.00 . A A . 21 SER CB 1 1 18 9052 1 1 21 SER H H -10.339 -6.387 -0.516 1.00 . A A . 21 SER H 1 1 18 9053 1 1 21 SER HA H -9.879 -7.199 -3.110 1.00 . A A . 21 SER HA 1 1 18 9054 1 1 21 SER HB2 H -11.615 -8.096 -1.580 1.00 . A A . 21 SER HB2 1 1 18 9055 1 1 21 SER HB3 H -12.517 -6.596 -1.751 1.00 . A A . 21 SER HB3 1 1 18 9056 1 1 21 SER HG H -11.824 -8.331 -3.875 1.00 . A A . 21 SER HG 1 1 18 9057 1 1 21 SER N N -9.898 -6.135 -1.356 1.00 . A A . 21 SER N 1 1 18 9058 1 1 21 SER O O -11.513 -4.341 -3.045 1.00 . A A . 21 SER O 1 1 18 9059 1 1 21 SER OG O -12.474 -7.797 -3.401 1.00 . A A . 21 SER OG 1 1 18 9060 1 1 22 GLY C C -9.336 -3.190 -5.553 1.00 . A A . 22 GLY C 1 1 18 9061 1 1 22 GLY CA C -10.440 -4.224 -5.590 1.00 . A A . 22 GLY CA 1 1 18 9062 1 1 22 GLY H H -9.658 -6.052 -4.894 1.00 . A A . 22 GLY H 1 1 18 9063 1 1 22 GLY HA2 H -10.495 -4.639 -6.586 1.00 . A A . 22 GLY HA2 1 1 18 9064 1 1 22 GLY HA3 H -11.378 -3.739 -5.366 1.00 . A A . 22 GLY HA3 1 1 18 9065 1 1 22 GLY N N -10.235 -5.296 -4.648 1.00 . A A . 22 GLY N 1 1 18 9066 1 1 22 GLY O O -9.268 -2.313 -6.412 1.00 . A A . 22 GLY O 1 1 18 9067 1 1 23 THR C C -6.064 -2.942 -4.797 1.00 . A A . 23 THR C 1 1 18 9068 1 1 23 THR CA C -7.404 -2.316 -4.451 1.00 . A A . 23 THR CA 1 1 18 9069 1 1 23 THR CB C -7.377 -1.683 -3.031 1.00 . A A . 23 THR CB 1 1 18 9070 1 1 23 THR CG2 C -8.737 -1.120 -2.691 1.00 . A A . 23 THR CG2 1 1 18 9071 1 1 23 THR H H -8.503 -4.044 -3.954 1.00 . A A . 23 THR H 1 1 18 9072 1 1 23 THR HA H -7.603 -1.537 -5.173 1.00 . A A . 23 THR HA 1 1 18 9073 1 1 23 THR HB H -6.659 -0.876 -3.011 1.00 . A A . 23 THR HB 1 1 18 9074 1 1 23 THR HG1 H -7.432 -3.505 -2.279 1.00 . A A . 23 THR HG1 1 1 18 9075 1 1 23 THR HG21 H -8.710 -0.691 -1.700 1.00 . A A . 23 THR HG21 1 1 18 9076 1 1 23 THR HG22 H -9.475 -1.908 -2.726 1.00 . A A . 23 THR HG22 1 1 18 9077 1 1 23 THR HG23 H -8.993 -0.352 -3.406 1.00 . A A . 23 THR HG23 1 1 18 9078 1 1 23 THR N N -8.456 -3.291 -4.582 1.00 . A A . 23 THR N 1 1 18 9079 1 1 23 THR O O -5.832 -4.119 -4.509 1.00 . A A . 23 THR O 1 1 18 9080 1 1 23 THR OG1 O -7.040 -2.653 -2.039 1.00 . A A . 23 THR OG1 1 1 18 9081 1 1 24 THR C C -2.796 -1.936 -5.158 1.00 . A A . 24 THR C 1 1 18 9082 1 1 24 THR CA C -3.929 -2.671 -5.861 1.00 . A A . 24 THR CA 1 1 18 9083 1 1 24 THR CB C -3.780 -2.532 -7.394 1.00 . A A . 24 THR CB 1 1 18 9084 1 1 24 THR CG2 C -4.685 -3.516 -8.115 1.00 . A A . 24 THR CG2 1 1 18 9085 1 1 24 THR H H -5.449 -1.245 -5.615 1.00 . A A . 24 THR H 1 1 18 9086 1 1 24 THR HA H -3.875 -3.719 -5.611 1.00 . A A . 24 THR HA 1 1 18 9087 1 1 24 THR HB H -2.754 -2.741 -7.655 1.00 . A A . 24 THR HB 1 1 18 9088 1 1 24 THR HG1 H -4.780 -0.793 -7.250 1.00 . A A . 24 THR HG1 1 1 18 9089 1 1 24 THR HG21 H -4.568 -3.402 -9.182 1.00 . A A . 24 THR HG21 1 1 18 9090 1 1 24 THR HG22 H -5.712 -3.318 -7.843 1.00 . A A . 24 THR HG22 1 1 18 9091 1 1 24 THR HG23 H -4.426 -4.523 -7.827 1.00 . A A . 24 THR HG23 1 1 18 9092 1 1 24 THR N N -5.212 -2.187 -5.429 1.00 . A A . 24 THR N 1 1 18 9093 1 1 24 THR O O -2.882 -0.738 -4.930 1.00 . A A . 24 THR O 1 1 18 9094 1 1 24 THR OG1 O -4.096 -1.180 -7.823 1.00 . A A . 24 THR OG1 1 1 18 9095 1 1 25 CYS C C 0.211 -1.301 -5.202 1.00 . A A . 25 CYS C 1 1 18 9096 1 1 25 CYS CA C -0.615 -2.030 -4.156 1.00 . A A . 25 CYS CA 1 1 18 9097 1 1 25 CYS CB C 0.236 -3.088 -3.435 1.00 . A A . 25 CYS CB 1 1 18 9098 1 1 25 CYS H H -1.739 -3.609 -4.996 1.00 . A A . 25 CYS H 1 1 18 9099 1 1 25 CYS HA H -0.982 -1.312 -3.436 1.00 . A A . 25 CYS HA 1 1 18 9100 1 1 25 CYS HB2 H -0.357 -3.540 -2.653 1.00 . A A . 25 CYS HB2 1 1 18 9101 1 1 25 CYS HB3 H 0.518 -3.849 -4.148 1.00 . A A . 25 CYS HB3 1 1 18 9102 1 1 25 CYS N N -1.757 -2.646 -4.802 1.00 . A A . 25 CYS N 1 1 18 9103 1 1 25 CYS O O 0.831 -1.933 -6.061 1.00 . A A . 25 CYS O 1 1 18 9104 1 1 25 CYS SG S 1.772 -2.450 -2.655 1.00 . A A . 25 CYS SG 1 1 18 9105 1 1 26 GLN C C 1.959 1.632 -5.469 1.00 . A A . 26 GLN C 1 1 18 9106 1 1 26 GLN CA C 0.907 0.786 -6.145 1.00 . A A . 26 GLN CA 1 1 18 9107 1 1 26 GLN CB C -0.033 1.653 -6.984 1.00 . A A . 26 GLN CB 1 1 18 9108 1 1 26 GLN CD C -1.899 1.699 -8.690 1.00 . A A . 26 GLN CD 1 1 18 9109 1 1 26 GLN CG C -1.041 0.848 -7.786 1.00 . A A . 26 GLN CG 1 1 18 9110 1 1 26 GLN H H -0.348 0.485 -4.497 1.00 . A A . 26 GLN H 1 1 18 9111 1 1 26 GLN HA H 1.403 0.085 -6.798 1.00 . A A . 26 GLN HA 1 1 18 9112 1 1 26 GLN HB2 H -0.574 2.316 -6.326 1.00 . A A . 26 GLN HB2 1 1 18 9113 1 1 26 GLN HB3 H 0.553 2.244 -7.672 1.00 . A A . 26 GLN HB3 1 1 18 9114 1 1 26 GLN HE21 H -3.400 0.429 -8.495 1.00 . A A . 26 GLN HE21 1 1 18 9115 1 1 26 GLN HE22 H -3.668 1.776 -9.541 1.00 . A A . 26 GLN HE22 1 1 18 9116 1 1 26 GLN HG2 H -0.507 0.134 -8.397 1.00 . A A . 26 GLN HG2 1 1 18 9117 1 1 26 GLN HG3 H -1.681 0.315 -7.098 1.00 . A A . 26 GLN HG3 1 1 18 9118 1 1 26 GLN N N 0.177 0.008 -5.181 1.00 . A A . 26 GLN N 1 1 18 9119 1 1 26 GLN NE2 N -3.106 1.268 -8.919 1.00 . A A . 26 GLN NE2 1 1 18 9120 1 1 26 GLN O O 1.733 2.179 -4.385 1.00 . A A . 26 GLN O 1 1 18 9121 1 1 26 GLN OE1 O -1.472 2.758 -9.174 1.00 . A A . 26 GLN OE1 1 1 18 9122 1 1 27 VAL C C 4.069 3.915 -6.080 1.00 . A A . 27 VAL C 1 1 18 9123 1 1 27 VAL CA C 4.206 2.490 -5.575 1.00 . A A . 27 VAL CA 1 1 18 9124 1 1 27 VAL CB C 5.569 1.900 -6.039 1.00 . A A . 27 VAL CB 1 1 18 9125 1 1 27 VAL CG1 C 6.736 2.646 -5.411 1.00 . A A . 27 VAL CG1 1 1 18 9126 1 1 27 VAL CG2 C 5.654 0.414 -5.722 1.00 . A A . 27 VAL CG2 1 1 18 9127 1 1 27 VAL H H 3.197 1.292 -6.972 1.00 . A A . 27 VAL H 1 1 18 9128 1 1 27 VAL HA H 4.152 2.473 -4.496 1.00 . A A . 27 VAL HA 1 1 18 9129 1 1 27 VAL HB H 5.636 2.022 -7.110 1.00 . A A . 27 VAL HB 1 1 18 9130 1 1 27 VAL HG11 H 6.683 2.558 -4.336 1.00 . A A . 27 VAL HG11 1 1 18 9131 1 1 27 VAL HG12 H 6.683 3.690 -5.686 1.00 . A A . 27 VAL HG12 1 1 18 9132 1 1 27 VAL HG13 H 7.668 2.229 -5.762 1.00 . A A . 27 VAL HG13 1 1 18 9133 1 1 27 VAL HG21 H 6.607 0.028 -6.052 1.00 . A A . 27 VAL HG21 1 1 18 9134 1 1 27 VAL HG22 H 4.856 -0.108 -6.229 1.00 . A A . 27 VAL HG22 1 1 18 9135 1 1 27 VAL HG23 H 5.560 0.268 -4.654 1.00 . A A . 27 VAL HG23 1 1 18 9136 1 1 27 VAL N N 3.099 1.726 -6.098 1.00 . A A . 27 VAL N 1 1 18 9137 1 1 27 VAL O O 4.152 4.164 -7.284 1.00 . A A . 27 VAL O 1 1 18 9138 1 1 28 LEU C C 4.881 7.016 -5.416 1.00 . A A . 28 LEU C 1 1 18 9139 1 1 28 LEU CA C 3.607 6.215 -5.555 1.00 . A A . 28 LEU CA 1 1 18 9140 1 1 28 LEU CB C 2.501 6.832 -4.692 1.00 . A A . 28 LEU CB 1 1 18 9141 1 1 28 LEU CD1 C 0.140 6.851 -3.855 1.00 . A A . 28 LEU CD1 1 1 18 9142 1 1 28 LEU CD2 C 0.607 6.210 -6.212 1.00 . A A . 28 LEU CD2 1 1 18 9143 1 1 28 LEU CG C 1.122 6.170 -4.786 1.00 . A A . 28 LEU CG 1 1 18 9144 1 1 28 LEU H H 3.812 4.574 -4.233 1.00 . A A . 28 LEU H 1 1 18 9145 1 1 28 LEU HA H 3.294 6.243 -6.587 1.00 . A A . 28 LEU HA 1 1 18 9146 1 1 28 LEU HB2 H 2.825 6.790 -3.663 1.00 . A A . 28 LEU HB2 1 1 18 9147 1 1 28 LEU HB3 H 2.396 7.869 -4.969 1.00 . A A . 28 LEU HB3 1 1 18 9148 1 1 28 LEU HD11 H 0.050 7.892 -4.125 1.00 . A A . 28 LEU HD11 1 1 18 9149 1 1 28 LEU HD12 H 0.496 6.770 -2.839 1.00 . A A . 28 LEU HD12 1 1 18 9150 1 1 28 LEU HD13 H -0.825 6.373 -3.938 1.00 . A A . 28 LEU HD13 1 1 18 9151 1 1 28 LEU HD21 H 0.536 7.240 -6.531 1.00 . A A . 28 LEU HD21 1 1 18 9152 1 1 28 LEU HD22 H -0.368 5.746 -6.247 1.00 . A A . 28 LEU HD22 1 1 18 9153 1 1 28 LEU HD23 H 1.283 5.673 -6.860 1.00 . A A . 28 LEU HD23 1 1 18 9154 1 1 28 LEU HG H 1.206 5.135 -4.484 1.00 . A A . 28 LEU HG 1 1 18 9155 1 1 28 LEU N N 3.826 4.831 -5.181 1.00 . A A . 28 LEU N 1 1 18 9156 1 1 28 LEU O O 5.105 7.983 -6.146 1.00 . A A . 28 LEU O 1 1 18 9157 1 1 29 ASN C C 7.898 6.185 -3.706 1.00 . A A . 29 ASN C 1 1 18 9158 1 1 29 ASN CA C 6.969 7.273 -4.186 1.00 . A A . 29 ASN CA 1 1 18 9159 1 1 29 ASN CB C 6.815 8.333 -3.068 1.00 . A A . 29 ASN CB 1 1 18 9160 1 1 29 ASN CG C 5.889 9.481 -3.394 1.00 . A A . 29 ASN CG 1 1 18 9161 1 1 29 ASN H H 5.497 5.812 -3.953 1.00 . A A . 29 ASN H 1 1 18 9162 1 1 29 ASN HA H 7.353 7.723 -5.089 1.00 . A A . 29 ASN HA 1 1 18 9163 1 1 29 ASN HB2 H 6.457 7.856 -2.169 1.00 . A A . 29 ASN HB2 1 1 18 9164 1 1 29 ASN HB3 H 7.795 8.741 -2.870 1.00 . A A . 29 ASN HB3 1 1 18 9165 1 1 29 ASN HD21 H 4.377 8.556 -2.524 1.00 . A A . 29 ASN HD21 1 1 18 9166 1 1 29 ASN HD22 H 4.040 10.104 -3.209 1.00 . A A . 29 ASN HD22 1 1 18 9167 1 1 29 ASN N N 5.701 6.619 -4.478 1.00 . A A . 29 ASN N 1 1 18 9168 1 1 29 ASN ND2 N 4.650 9.364 -3.001 1.00 . A A . 29 ASN ND2 1 1 18 9169 1 1 29 ASN O O 7.409 5.103 -3.417 1.00 . A A . 29 ASN O 1 1 18 9170 1 1 29 ASN OD1 O 6.299 10.483 -3.968 1.00 . A A . 29 ASN OD1 1 1 18 9171 1 1 30 PRO C C 9.773 4.714 -1.825 1.00 . A A . 30 PRO C 1 1 18 9172 1 1 30 PRO CA C 10.192 5.400 -3.134 1.00 . A A . 30 PRO CA 1 1 18 9173 1 1 30 PRO CB C 11.490 6.189 -2.932 1.00 . A A . 30 PRO CB 1 1 18 9174 1 1 30 PRO CD C 9.933 7.697 -3.932 1.00 . A A . 30 PRO CD 1 1 18 9175 1 1 30 PRO CG C 11.388 7.323 -3.889 1.00 . A A . 30 PRO CG 1 1 18 9176 1 1 30 PRO HA H 10.343 4.646 -3.892 1.00 . A A . 30 PRO HA 1 1 18 9177 1 1 30 PRO HB2 H 11.546 6.534 -1.910 1.00 . A A . 30 PRO HB2 1 1 18 9178 1 1 30 PRO HB3 H 12.339 5.559 -3.156 1.00 . A A . 30 PRO HB3 1 1 18 9179 1 1 30 PRO HD2 H 9.739 8.457 -3.191 1.00 . A A . 30 PRO HD2 1 1 18 9180 1 1 30 PRO HD3 H 9.649 8.046 -4.913 1.00 . A A . 30 PRO HD3 1 1 18 9181 1 1 30 PRO HG2 H 11.984 8.154 -3.538 1.00 . A A . 30 PRO HG2 1 1 18 9182 1 1 30 PRO HG3 H 11.723 7.012 -4.868 1.00 . A A . 30 PRO HG3 1 1 18 9183 1 1 30 PRO N N 9.235 6.430 -3.589 1.00 . A A . 30 PRO N 1 1 18 9184 1 1 30 PRO O O 9.863 3.497 -1.699 1.00 . A A . 30 PRO O 1 1 18 9185 1 1 31 TYR C C 7.391 4.719 0.461 1.00 . A A . 31 TYR C 1 1 18 9186 1 1 31 TYR CA C 8.905 4.891 0.403 1.00 . A A . 31 TYR CA 1 1 18 9187 1 1 31 TYR CB C 9.366 5.770 1.589 1.00 . A A . 31 TYR CB 1 1 18 9188 1 1 31 TYR CD1 C 11.511 6.915 0.866 1.00 . A A . 31 TYR CD1 1 1 18 9189 1 1 31 TYR CD2 C 11.646 5.266 2.570 1.00 . A A . 31 TYR CD2 1 1 18 9190 1 1 31 TYR CE1 C 12.866 7.113 0.938 1.00 . A A . 31 TYR CE1 1 1 18 9191 1 1 31 TYR CE2 C 13.011 5.462 2.651 1.00 . A A . 31 TYR CE2 1 1 18 9192 1 1 31 TYR CG C 10.871 5.988 1.677 1.00 . A A . 31 TYR CG 1 1 18 9193 1 1 31 TYR CZ C 13.615 6.386 1.831 1.00 . A A . 31 TYR CZ 1 1 18 9194 1 1 31 TYR H H 9.244 6.454 -0.992 1.00 . A A . 31 TYR H 1 1 18 9195 1 1 31 TYR HA H 9.378 3.924 0.488 1.00 . A A . 31 TYR HA 1 1 18 9196 1 1 31 TYR HB2 H 8.899 6.740 1.514 1.00 . A A . 31 TYR HB2 1 1 18 9197 1 1 31 TYR HB3 H 9.046 5.300 2.508 1.00 . A A . 31 TYR HB3 1 1 18 9198 1 1 31 TYR HD1 H 10.926 7.488 0.163 1.00 . A A . 31 TYR HD1 1 1 18 9199 1 1 31 TYR HD2 H 11.170 4.540 3.213 1.00 . A A . 31 TYR HD2 1 1 18 9200 1 1 31 TYR HE1 H 13.333 7.841 0.293 1.00 . A A . 31 TYR HE1 1 1 18 9201 1 1 31 TYR HE2 H 13.598 4.890 3.353 1.00 . A A . 31 TYR HE2 1 1 18 9202 1 1 31 TYR HH H 15.391 5.703 1.825 1.00 . A A . 31 TYR HH 1 1 18 9203 1 1 31 TYR N N 9.307 5.484 -0.858 1.00 . A A . 31 TYR N 1 1 18 9204 1 1 31 TYR O O 6.871 3.854 1.178 1.00 . A A . 31 TYR O 1 1 18 9205 1 1 31 TYR OH O 14.982 6.577 1.896 1.00 . A A . 31 TYR OH 1 1 18 9206 1 1 32 TYR C C 4.617 4.557 -1.264 1.00 . A A . 32 TYR C 1 1 18 9207 1 1 32 TYR CA C 5.248 5.480 -0.214 1.00 . A A . 32 TYR CA 1 1 18 9208 1 1 32 TYR CB C 4.665 6.884 -0.298 1.00 . A A . 32 TYR CB 1 1 18 9209 1 1 32 TYR CD1 C 2.939 6.674 1.490 1.00 . A A . 32 TYR CD1 1 1 18 9210 1 1 32 TYR CD2 C 2.212 7.344 -0.676 1.00 . A A . 32 TYR CD2 1 1 18 9211 1 1 32 TYR CE1 C 1.661 6.759 1.958 1.00 . A A . 32 TYR CE1 1 1 18 9212 1 1 32 TYR CE2 C 0.917 7.427 -0.212 1.00 . A A . 32 TYR CE2 1 1 18 9213 1 1 32 TYR CG C 3.244 6.965 0.173 1.00 . A A . 32 TYR CG 1 1 18 9214 1 1 32 TYR CZ C 0.650 7.130 1.107 1.00 . A A . 32 TYR CZ 1 1 18 9215 1 1 32 TYR H H 7.133 6.115 -0.920 1.00 . A A . 32 TYR H 1 1 18 9216 1 1 32 TYR HA H 5.001 5.082 0.759 1.00 . A A . 32 TYR HA 1 1 18 9217 1 1 32 TYR HB2 H 5.255 7.562 0.301 1.00 . A A . 32 TYR HB2 1 1 18 9218 1 1 32 TYR HB3 H 4.688 7.207 -1.328 1.00 . A A . 32 TYR HB3 1 1 18 9219 1 1 32 TYR HD1 H 3.736 6.376 2.158 1.00 . A A . 32 TYR HD1 1 1 18 9220 1 1 32 TYR HD2 H 2.426 7.572 -1.710 1.00 . A A . 32 TYR HD2 1 1 18 9221 1 1 32 TYR HE1 H 1.458 6.524 2.992 1.00 . A A . 32 TYR HE1 1 1 18 9222 1 1 32 TYR HE2 H 0.120 7.716 -0.881 1.00 . A A . 32 TYR HE2 1 1 18 9223 1 1 32 TYR HH H -1.238 7.034 0.862 1.00 . A A . 32 TYR HH 1 1 18 9224 1 1 32 TYR N N 6.679 5.522 -0.287 1.00 . A A . 32 TYR N 1 1 18 9225 1 1 32 TYR O O 4.636 4.855 -2.463 1.00 . A A . 32 TYR O 1 1 18 9226 1 1 32 TYR OH O -0.635 7.242 1.590 1.00 . A A . 32 TYR OH 1 1 18 9227 1 1 33 SER C C 1.879 2.470 -1.033 1.00 . A A . 33 SER C 1 1 18 9228 1 1 33 SER CA C 3.261 2.600 -1.652 1.00 . A A . 33 SER CA 1 1 18 9229 1 1 33 SER CB C 3.957 1.239 -1.714 1.00 . A A . 33 SER CB 1 1 18 9230 1 1 33 SER H H 4.043 3.293 0.149 1.00 . A A . 33 SER H 1 1 18 9231 1 1 33 SER HA H 3.179 3.034 -2.638 1.00 . A A . 33 SER HA 1 1 18 9232 1 1 33 SER HB2 H 3.879 0.744 -0.757 1.00 . A A . 33 SER HB2 1 1 18 9233 1 1 33 SER HB3 H 3.483 0.640 -2.477 1.00 . A A . 33 SER HB3 1 1 18 9234 1 1 33 SER HG H 5.588 0.722 -2.685 1.00 . A A . 33 SER HG 1 1 18 9235 1 1 33 SER N N 4.002 3.505 -0.804 1.00 . A A . 33 SER N 1 1 18 9236 1 1 33 SER O O 1.771 2.222 0.159 1.00 . A A . 33 SER O 1 1 18 9237 1 1 33 SER OG O 5.329 1.389 -2.042 1.00 . A A . 33 SER OG 1 1 18 9238 1 1 34 GLN C C -1.437 1.783 -2.088 1.00 . A A . 34 GLN C 1 1 18 9239 1 1 34 GLN CA C -0.503 2.700 -1.300 1.00 . A A . 34 GLN CA 1 1 18 9240 1 1 34 GLN CB C -0.975 4.166 -1.338 1.00 . A A . 34 GLN CB 1 1 18 9241 1 1 34 GLN CD C -2.807 5.862 -1.101 1.00 . A A . 34 GLN CD 1 1 18 9242 1 1 34 GLN CG C -2.450 4.394 -1.081 1.00 . A A . 34 GLN CG 1 1 18 9243 1 1 34 GLN H H 0.988 2.693 -2.788 1.00 . A A . 34 GLN H 1 1 18 9244 1 1 34 GLN HA H -0.487 2.378 -0.270 1.00 . A A . 34 GLN HA 1 1 18 9245 1 1 34 GLN HB2 H -0.429 4.711 -0.582 1.00 . A A . 34 GLN HB2 1 1 18 9246 1 1 34 GLN HB3 H -0.726 4.595 -2.299 1.00 . A A . 34 GLN HB3 1 1 18 9247 1 1 34 GLN HE21 H -2.749 5.966 0.879 1.00 . A A . 34 GLN HE21 1 1 18 9248 1 1 34 GLN HE22 H -3.118 7.426 0.027 1.00 . A A . 34 GLN HE22 1 1 18 9249 1 1 34 GLN HG2 H -3.022 3.885 -1.843 1.00 . A A . 34 GLN HG2 1 1 18 9250 1 1 34 GLN HG3 H -2.698 3.991 -0.110 1.00 . A A . 34 GLN HG3 1 1 18 9251 1 1 34 GLN N N 0.852 2.642 -1.813 1.00 . A A . 34 GLN N 1 1 18 9252 1 1 34 GLN NE2 N -2.894 6.467 0.047 1.00 . A A . 34 GLN NE2 1 1 18 9253 1 1 34 GLN O O -1.245 1.575 -3.286 1.00 . A A . 34 GLN O 1 1 18 9254 1 1 34 GLN OE1 O -3.084 6.420 -2.136 1.00 . A A . 34 GLN OE1 1 1 18 9255 1 1 35 CYS C C -4.441 1.242 -2.707 1.00 . A A . 35 CYS C 1 1 18 9256 1 1 35 CYS CA C -3.397 0.372 -2.034 1.00 . A A . 35 CYS CA 1 1 18 9257 1 1 35 CYS CB C -4.081 -0.544 -1.028 1.00 . A A . 35 CYS CB 1 1 18 9258 1 1 35 CYS H H -2.453 1.307 -0.426 1.00 . A A . 35 CYS H 1 1 18 9259 1 1 35 CYS HA H -2.905 -0.234 -2.780 1.00 . A A . 35 CYS HA 1 1 18 9260 1 1 35 CYS HB2 H -4.635 0.047 -0.315 1.00 . A A . 35 CYS HB2 1 1 18 9261 1 1 35 CYS HB3 H -4.778 -1.159 -1.572 1.00 . A A . 35 CYS HB3 1 1 18 9262 1 1 35 CYS N N -2.406 1.195 -1.399 1.00 . A A . 35 CYS N 1 1 18 9263 1 1 35 CYS O O -5.276 1.877 -2.031 1.00 . A A . 35 CYS O 1 1 18 9264 1 1 35 CYS SG S -2.967 -1.644 -0.108 1.00 . A A . 35 CYS SG 1 1 18 9265 1 1 36 LEU C C -6.269 1.055 -5.371 1.00 . A A . 36 LEU C 1 1 18 9266 1 1 36 LEU CA C -5.285 2.027 -4.810 1.00 . A A . 36 LEU CA 1 1 18 9267 1 1 36 LEU CB C -4.565 2.775 -5.936 1.00 . A A . 36 LEU CB 1 1 18 9268 1 1 36 LEU CD1 C -2.960 4.523 -6.703 1.00 . A A . 36 LEU CD1 1 1 18 9269 1 1 36 LEU CD2 C -4.345 4.926 -4.692 1.00 . A A . 36 LEU CD2 1 1 18 9270 1 1 36 LEU CG C -3.609 3.882 -5.499 1.00 . A A . 36 LEU CG 1 1 18 9271 1 1 36 LEU H H -3.654 0.795 -4.453 1.00 . A A . 36 LEU H 1 1 18 9272 1 1 36 LEU HA H -5.810 2.734 -4.185 1.00 . A A . 36 LEU HA 1 1 18 9273 1 1 36 LEU HB2 H -4.004 2.053 -6.512 1.00 . A A . 36 LEU HB2 1 1 18 9274 1 1 36 LEU HB3 H -5.314 3.211 -6.580 1.00 . A A . 36 LEU HB3 1 1 18 9275 1 1 36 LEU HD11 H -2.373 3.791 -7.237 1.00 . A A . 36 LEU HD11 1 1 18 9276 1 1 36 LEU HD12 H -2.330 5.336 -6.378 1.00 . A A . 36 LEU HD12 1 1 18 9277 1 1 36 LEU HD13 H -3.730 4.909 -7.354 1.00 . A A . 36 LEU HD13 1 1 18 9278 1 1 36 LEU HD21 H -3.651 5.704 -4.411 1.00 . A A . 36 LEU HD21 1 1 18 9279 1 1 36 LEU HD22 H -4.750 4.473 -3.799 1.00 . A A . 36 LEU HD22 1 1 18 9280 1 1 36 LEU HD23 H -5.143 5.351 -5.284 1.00 . A A . 36 LEU HD23 1 1 18 9281 1 1 36 LEU HG H -2.830 3.462 -4.880 1.00 . A A . 36 LEU HG 1 1 18 9282 1 1 36 LEU N N -4.365 1.302 -3.999 1.00 . A A . 36 LEU N 1 1 18 9283 1 1 36 LEU O O -5.897 0.256 -6.256 1.00 . A A . 36 LEU O 1 1 18 9284 1 1 36 LEU OXT O -7.411 1.047 -4.911 1.00 . A A . 36 LEU OXT 1 1 18 9285 2 2 1 MAN C1 C 9.800 -3.245 9.191 1.00 . B A . 101 MAN C1 1 1 18 9286 2 2 1 MAN C2 C 10.753 -2.052 8.892 1.00 . B A . 101 MAN C2 1 1 18 9287 2 2 1 MAN C3 C 11.905 -2.462 7.966 1.00 . B A . 101 MAN C3 1 1 18 9288 2 2 1 MAN C4 C 11.541 -3.683 7.107 1.00 . B A . 101 MAN C4 1 1 18 9289 2 2 1 MAN C5 C 11.127 -4.886 8.000 1.00 . B A . 101 MAN C5 1 1 18 9290 2 2 1 MAN C6 C 12.297 -5.793 8.337 1.00 . B A . 101 MAN C6 1 1 18 9291 2 2 1 MAN H1 H 9.354 -3.032 10.173 1.00 . B A . 101 MAN H1 1 1 18 9292 2 2 1 MAN H2 H 10.149 -1.243 8.454 1.00 . B A . 101 MAN H2 1 1 18 9293 2 2 1 MAN H3 H 12.137 -1.616 7.300 1.00 . B A . 101 MAN H3 1 1 18 9294 2 2 1 MAN H4 H 12.444 -3.970 6.548 1.00 . B A . 101 MAN H4 1 1 18 9295 2 2 1 MAN H5 H 10.345 -5.457 7.478 1.00 . B A . 101 MAN H5 1 1 18 9296 2 2 1 MAN H61 H 11.912 -6.602 8.973 1.00 . B A . 101 MAN H61 1 1 18 9297 2 2 1 MAN H62 H 13.041 -5.224 8.913 1.00 . B A . 101 MAN H62 1 1 18 9298 2 2 1 MAN HO2 H 11.938 -2.418 10.291 1.00 . B A . 101 MAN HO2 1 1 18 9299 2 2 1 MAN HO3 H 13.773 -2.999 8.219 1.00 . B A . 101 MAN HO3 1 1 18 9300 2 2 1 MAN HO4 H 9.713 -3.134 6.609 1.00 . B A . 101 MAN HO4 1 1 18 9301 2 2 1 MAN HO6 H 12.214 -6.901 6.739 1.00 . B A . 101 MAN HO6 1 1 18 9302 2 2 1 MAN O2 O 11.355 -1.667 10.113 1.00 . B A . 101 MAN O2 1 1 18 9303 2 2 1 MAN O3 O 13.034 -2.749 8.787 1.00 . B A . 101 MAN O3 1 1 18 9304 2 2 1 MAN O4 O 10.530 -3.370 6.160 1.00 . B A . 101 MAN O4 1 1 18 9305 2 2 1 MAN O5 O 10.556 -4.437 9.273 1.00 . B A . 101 MAN O5 1 1 18 9306 2 2 1 MAN O6 O 12.883 -6.343 7.160 1.00 . B A . 101 MAN O6 1 1 19 9307 1 1 1 THR C C -5.264 -6.024 4.377 1.00 . A A . 1 THR C 1 1 19 9308 1 1 1 THR CA C -5.275 -7.538 4.075 1.00 . A A . 1 THR CA 1 1 19 9309 1 1 1 THR CB C -6.715 -8.039 3.882 1.00 . A A . 1 THR CB 1 1 19 9310 1 1 1 THR CG2 C -7.209 -7.703 2.492 1.00 . A A . 1 THR CG2 1 1 19 9311 1 1 1 THR H1 H -5.234 -7.975 6.054 1.00 . A A . 1 THR H1 1 1 19 9312 1 1 1 THR H2 H -3.703 -7.947 5.364 1.00 . A A . 1 THR H2 1 1 19 9313 1 1 1 THR H3 H -4.764 -9.251 5.076 1.00 . A A . 1 THR H3 1 1 19 9314 1 1 1 THR HA H -4.690 -7.744 3.189 1.00 . A A . 1 THR HA 1 1 19 9315 1 1 1 THR HB H -7.354 -7.573 4.614 1.00 . A A . 1 THR HB 1 1 19 9316 1 1 1 THR HG1 H -7.191 -9.662 4.893 1.00 . A A . 1 THR HG1 1 1 19 9317 1 1 1 THR HG21 H -7.144 -6.633 2.366 1.00 . A A . 1 THR HG21 1 1 19 9318 1 1 1 THR HG22 H -8.235 -8.024 2.384 1.00 . A A . 1 THR HG22 1 1 19 9319 1 1 1 THR HG23 H -6.593 -8.193 1.754 1.00 . A A . 1 THR HG23 1 1 19 9320 1 1 1 THR N N -4.689 -8.224 5.204 1.00 . A A . 1 THR N 1 1 19 9321 1 1 1 THR O O -6.004 -5.555 5.244 1.00 . A A . 1 THR O 1 1 19 9322 1 1 1 THR OG1 O -6.744 -9.478 4.055 1.00 . A A . 1 THR OG1 1 1 19 9323 1 1 2 GLN C C -5.261 -2.970 3.320 1.00 . A A . 2 GLN C 1 1 19 9324 1 1 2 GLN CA C -4.195 -3.882 3.988 1.00 . A A . 2 GLN CA 1 1 19 9325 1 1 2 GLN CB C -2.740 -3.521 3.607 1.00 . A A . 2 GLN CB 1 1 19 9326 1 1 2 GLN CD C -2.670 -0.992 3.934 1.00 . A A . 2 GLN CD 1 1 19 9327 1 1 2 GLN CG C -2.139 -2.331 4.364 1.00 . A A . 2 GLN CG 1 1 19 9328 1 1 2 GLN H H -3.956 -5.674 2.904 1.00 . A A . 2 GLN H 1 1 19 9329 1 1 2 GLN HA H -4.308 -3.782 5.058 1.00 . A A . 2 GLN HA 1 1 19 9330 1 1 2 GLN HB2 H -2.121 -4.384 3.803 1.00 . A A . 2 GLN HB2 1 1 19 9331 1 1 2 GLN HB3 H -2.700 -3.317 2.548 1.00 . A A . 2 GLN HB3 1 1 19 9332 1 1 2 GLN HE21 H -2.722 -1.567 2.041 1.00 . A A . 2 GLN HE21 1 1 19 9333 1 1 2 GLN HE22 H -3.286 0.013 2.376 1.00 . A A . 2 GLN HE22 1 1 19 9334 1 1 2 GLN HG2 H -2.347 -2.451 5.417 1.00 . A A . 2 GLN HG2 1 1 19 9335 1 1 2 GLN HG3 H -1.068 -2.339 4.217 1.00 . A A . 2 GLN HG3 1 1 19 9336 1 1 2 GLN N N -4.427 -5.282 3.677 1.00 . A A . 2 GLN N 1 1 19 9337 1 1 2 GLN NE2 N -2.902 -0.838 2.671 1.00 . A A . 2 GLN NE2 1 1 19 9338 1 1 2 GLN O O -5.675 -3.207 2.178 1.00 . A A . 2 GLN O 1 1 19 9339 1 1 2 GLN OE1 O -2.802 -0.075 4.740 1.00 . A A . 2 GLN OE1 1 1 19 9340 1 1 3 SER C C -6.539 -0.168 2.457 1.00 . A A . 3 SER C 1 1 19 9341 1 1 3 SER CA C -6.751 -1.024 3.743 1.00 . A A . 3 SER CA 1 1 19 9342 1 1 3 SER CB C -6.873 -0.088 4.931 1.00 . A A . 3 SER CB 1 1 19 9343 1 1 3 SER H H -5.244 -1.787 4.928 1.00 . A A . 3 SER H 1 1 19 9344 1 1 3 SER HA H -7.679 -1.569 3.682 1.00 . A A . 3 SER HA 1 1 19 9345 1 1 3 SER HB2 H -6.058 0.621 4.905 1.00 . A A . 3 SER HB2 1 1 19 9346 1 1 3 SER HB3 H -7.813 0.438 4.885 1.00 . A A . 3 SER HB3 1 1 19 9347 1 1 3 SER HG H -6.297 -0.294 6.770 1.00 . A A . 3 SER HG 1 1 19 9348 1 1 3 SER N N -5.672 -1.956 4.063 1.00 . A A . 3 SER N 1 1 19 9349 1 1 3 SER O O -5.409 0.128 2.034 1.00 . A A . 3 SER O 1 1 19 9350 1 1 3 SER OG O -6.809 -0.823 6.148 1.00 . A A . 3 SER OG 1 1 19 9351 1 1 4 HIS C C -7.093 2.505 1.178 1.00 . A A . 4 HIS C 1 1 19 9352 1 1 4 HIS CA C -7.680 1.151 0.731 1.00 . A A . 4 HIS CA 1 1 19 9353 1 1 4 HIS CB C -9.146 1.304 0.264 1.00 . A A . 4 HIS CB 1 1 19 9354 1 1 4 HIS CD2 C -8.729 2.177 -2.167 1.00 . A A . 4 HIS CD2 1 1 19 9355 1 1 4 HIS CE1 C -10.492 3.453 -2.333 1.00 . A A . 4 HIS CE1 1 1 19 9356 1 1 4 HIS CG C -9.383 2.129 -0.979 1.00 . A A . 4 HIS CG 1 1 19 9357 1 1 4 HIS H H -8.509 -0.091 2.218 1.00 . A A . 4 HIS H 1 1 19 9358 1 1 4 HIS HA H -7.082 0.734 -0.066 1.00 . A A . 4 HIS HA 1 1 19 9359 1 1 4 HIS HB2 H -9.552 0.322 0.072 1.00 . A A . 4 HIS HB2 1 1 19 9360 1 1 4 HIS HB3 H -9.706 1.751 1.072 1.00 . A A . 4 HIS HB3 1 1 19 9361 1 1 4 HIS HD1 H -11.124 3.158 -0.412 1.00 . A A . 4 HIS HD1 1 1 19 9362 1 1 4 HIS HD2 H -7.815 1.658 -2.419 1.00 . A A . 4 HIS HD2 1 1 19 9363 1 1 4 HIS HE1 H -11.241 4.123 -2.725 1.00 . A A . 4 HIS HE1 1 1 19 9364 1 1 4 HIS HE2 H -9.197 3.268 -3.899 1.00 . A A . 4 HIS HE2 1 1 19 9365 1 1 4 HIS N N -7.652 0.243 1.869 1.00 . A A . 4 HIS N 1 1 19 9366 1 1 4 HIS ND1 N -10.472 2.948 -1.123 1.00 . A A . 4 HIS ND1 1 1 19 9367 1 1 4 HIS NE2 N -9.442 3.004 -2.982 1.00 . A A . 4 HIS NE2 1 1 19 9368 1 1 4 HIS O O -7.437 3.005 2.250 1.00 . A A . 4 HIS O 1 1 19 9369 1 1 5 TYR C C -4.419 4.153 1.790 1.00 . A A . 5 TYR C 1 1 19 9370 1 1 5 TYR CA C -5.455 4.307 0.681 1.00 . A A . 5 TYR CA 1 1 19 9371 1 1 5 TYR CB C -6.378 5.520 0.934 1.00 . A A . 5 TYR CB 1 1 19 9372 1 1 5 TYR CD1 C -6.257 7.201 -0.937 1.00 . A A . 5 TYR CD1 1 1 19 9373 1 1 5 TYR CD2 C -8.098 5.707 -0.894 1.00 . A A . 5 TYR CD2 1 1 19 9374 1 1 5 TYR CE1 C -6.745 7.785 -2.084 1.00 . A A . 5 TYR CE1 1 1 19 9375 1 1 5 TYR CE2 C -8.592 6.287 -2.041 1.00 . A A . 5 TYR CE2 1 1 19 9376 1 1 5 TYR CG C -6.926 6.151 -0.323 1.00 . A A . 5 TYR CG 1 1 19 9377 1 1 5 TYR CZ C -7.914 7.324 -2.631 1.00 . A A . 5 TYR CZ 1 1 19 9378 1 1 5 TYR H H -5.944 2.608 -0.474 1.00 . A A . 5 TYR H 1 1 19 9379 1 1 5 TYR HA H -4.882 4.507 -0.214 1.00 . A A . 5 TYR HA 1 1 19 9380 1 1 5 TYR HB2 H -7.219 5.199 1.532 1.00 . A A . 5 TYR HB2 1 1 19 9381 1 1 5 TYR HB3 H -5.827 6.274 1.476 1.00 . A A . 5 TYR HB3 1 1 19 9382 1 1 5 TYR HD1 H -5.336 7.563 -0.503 1.00 . A A . 5 TYR HD1 1 1 19 9383 1 1 5 TYR HD2 H -8.632 4.890 -0.432 1.00 . A A . 5 TYR HD2 1 1 19 9384 1 1 5 TYR HE1 H -6.212 8.602 -2.548 1.00 . A A . 5 TYR HE1 1 1 19 9385 1 1 5 TYR HE2 H -9.514 5.924 -2.473 1.00 . A A . 5 TYR HE2 1 1 19 9386 1 1 5 TYR HH H -7.672 8.041 -4.388 1.00 . A A . 5 TYR HH 1 1 19 9387 1 1 5 TYR N N -6.174 3.052 0.373 1.00 . A A . 5 TYR N 1 1 19 9388 1 1 5 TYR O O -3.845 5.134 2.246 1.00 . A A . 5 TYR O 1 1 19 9389 1 1 5 TYR OH O -8.410 7.895 -3.780 1.00 . A A . 5 TYR OH 1 1 19 9390 1 1 6 GLY C C -1.867 2.230 2.518 1.00 . A A . 6 GLY C 1 1 19 9391 1 1 6 GLY CA C -3.133 2.715 3.179 1.00 . A A . 6 GLY CA 1 1 19 9392 1 1 6 GLY H H -4.666 2.178 1.840 1.00 . A A . 6 GLY H 1 1 19 9393 1 1 6 GLY HA2 H -2.932 3.640 3.698 1.00 . A A . 6 GLY HA2 1 1 19 9394 1 1 6 GLY HA3 H -3.468 1.969 3.884 1.00 . A A . 6 GLY HA3 1 1 19 9395 1 1 6 GLY N N -4.161 2.939 2.196 1.00 . A A . 6 GLY N 1 1 19 9396 1 1 6 GLY O O -1.900 1.839 1.332 1.00 . A A . 6 GLY O 1 1 19 9397 1 1 7 GLN C C 0.570 0.261 2.775 1.00 . A A . 7 GLN C 1 1 19 9398 1 1 7 GLN CA C 0.507 1.777 2.742 1.00 . A A . 7 GLN CA 1 1 19 9399 1 1 7 GLN CB C 1.661 2.381 3.537 1.00 . A A . 7 GLN CB 1 1 19 9400 1 1 7 GLN CD C 4.140 2.625 3.916 1.00 . A A . 7 GLN CD 1 1 19 9401 1 1 7 GLN CG C 3.059 1.951 3.089 1.00 . A A . 7 GLN CG 1 1 19 9402 1 1 7 GLN H H -0.821 2.550 4.182 1.00 . A A . 7 GLN H 1 1 19 9403 1 1 7 GLN HA H 0.582 2.100 1.715 1.00 . A A . 7 GLN HA 1 1 19 9404 1 1 7 GLN HB2 H 1.605 3.457 3.467 1.00 . A A . 7 GLN HB2 1 1 19 9405 1 1 7 GLN HB3 H 1.543 2.095 4.572 1.00 . A A . 7 GLN HB3 1 1 19 9406 1 1 7 GLN HE21 H 5.445 2.664 2.390 1.00 . A A . 7 GLN HE21 1 1 19 9407 1 1 7 GLN HE22 H 5.971 3.317 3.876 1.00 . A A . 7 GLN HE22 1 1 19 9408 1 1 7 GLN HG2 H 3.126 0.885 3.257 1.00 . A A . 7 GLN HG2 1 1 19 9409 1 1 7 GLN HG3 H 3.214 2.138 2.036 1.00 . A A . 7 GLN HG3 1 1 19 9410 1 1 7 GLN N N -0.770 2.239 3.253 1.00 . A A . 7 GLN N 1 1 19 9411 1 1 7 GLN NE2 N 5.278 2.884 3.331 1.00 . A A . 7 GLN NE2 1 1 19 9412 1 1 7 GLN O O 0.559 -0.344 3.838 1.00 . A A . 7 GLN O 1 1 19 9413 1 1 7 GLN OE1 O 3.934 2.926 5.088 1.00 . A A . 7 GLN OE1 1 1 19 9414 1 1 8 CYS C C 2.010 -2.371 1.708 1.00 . A A . 8 CYS C 1 1 19 9415 1 1 8 CYS CA C 0.655 -1.765 1.438 1.00 . A A . 8 CYS CA 1 1 19 9416 1 1 8 CYS CB C 0.205 -2.092 0.025 1.00 . A A . 8 CYS CB 1 1 19 9417 1 1 8 CYS H H 0.659 0.246 0.810 1.00 . A A . 8 CYS H 1 1 19 9418 1 1 8 CYS HA H -0.049 -2.218 2.119 1.00 . A A . 8 CYS HA 1 1 19 9419 1 1 8 CYS HB2 H 0.549 -3.082 -0.238 1.00 . A A . 8 CYS HB2 1 1 19 9420 1 1 8 CYS HB3 H -0.874 -2.063 -0.025 1.00 . A A . 8 CYS HB3 1 1 19 9421 1 1 8 CYS N N 0.633 -0.320 1.612 1.00 . A A . 8 CYS N 1 1 19 9422 1 1 8 CYS O O 2.143 -3.276 2.499 1.00 . A A . 8 CYS O 1 1 19 9423 1 1 8 CYS SG S 0.856 -0.914 -1.224 1.00 . A A . 8 CYS SG 1 1 19 9424 1 1 9 GLY C C 5.335 -1.658 0.549 1.00 . A A . 9 GLY C 1 1 19 9425 1 1 9 GLY CA C 4.294 -2.475 1.189 1.00 . A A . 9 GLY CA 1 1 19 9426 1 1 9 GLY H H 2.902 -1.049 0.536 1.00 . A A . 9 GLY H 1 1 19 9427 1 1 9 GLY HA2 H 4.536 -2.599 2.234 1.00 . A A . 9 GLY HA2 1 1 19 9428 1 1 9 GLY HA3 H 4.265 -3.443 0.711 1.00 . A A . 9 GLY HA3 1 1 19 9429 1 1 9 GLY N N 3.016 -1.860 1.076 1.00 . A A . 9 GLY N 1 1 19 9430 1 1 9 GLY O O 5.735 -1.911 -0.585 1.00 . A A . 9 GLY O 1 1 19 9431 1 1 10 GLY C C 7.985 0.014 1.581 1.00 . A A . 10 GLY C 1 1 19 9432 1 1 10 GLY CA C 6.758 0.192 0.756 1.00 . A A . 10 GLY CA 1 1 19 9433 1 1 10 GLY H H 5.349 -0.493 2.124 1.00 . A A . 10 GLY H 1 1 19 9434 1 1 10 GLY HA2 H 6.969 -0.073 -0.270 1.00 . A A . 10 GLY HA2 1 1 19 9435 1 1 10 GLY HA3 H 6.442 1.221 0.809 1.00 . A A . 10 GLY HA3 1 1 19 9436 1 1 10 GLY N N 5.730 -0.649 1.235 1.00 . A A . 10 GLY N 1 1 19 9437 1 1 10 GLY O O 7.947 -0.697 2.606 1.00 . A A . 10 GLY O 1 1 19 9438 1 1 11 ILE C C 10.110 1.232 3.274 1.00 . A A . 11 ILE C 1 1 19 9439 1 1 11 ILE CA C 10.297 0.581 1.904 1.00 . A A . 11 ILE CA 1 1 19 9440 1 1 11 ILE CB C 11.439 1.288 1.130 1.00 . A A . 11 ILE CB 1 1 19 9441 1 1 11 ILE CD1 C 12.660 1.313 -1.117 1.00 . A A . 11 ILE CD1 1 1 19 9442 1 1 11 ILE CG1 C 11.620 0.638 -0.248 1.00 . A A . 11 ILE CG1 1 1 19 9443 1 1 11 ILE CG2 C 12.745 1.233 1.930 1.00 . A A . 11 ILE CG2 1 1 19 9444 1 1 11 ILE H H 8.992 1.160 0.343 1.00 . A A . 11 ILE H 1 1 19 9445 1 1 11 ILE HA H 10.552 -0.459 2.044 1.00 . A A . 11 ILE HA 1 1 19 9446 1 1 11 ILE HB H 11.169 2.324 0.994 1.00 . A A . 11 ILE HB 1 1 19 9447 1 1 11 ILE HD11 H 12.372 2.338 -1.293 1.00 . A A . 11 ILE HD11 1 1 19 9448 1 1 11 ILE HD12 H 12.738 0.792 -2.059 1.00 . A A . 11 ILE HD12 1 1 19 9449 1 1 11 ILE HD13 H 13.615 1.290 -0.614 1.00 . A A . 11 ILE HD13 1 1 19 9450 1 1 11 ILE HG12 H 11.922 -0.390 -0.115 1.00 . A A . 11 ILE HG12 1 1 19 9451 1 1 11 ILE HG13 H 10.679 0.661 -0.777 1.00 . A A . 11 ILE HG13 1 1 19 9452 1 1 11 ILE HG21 H 13.526 1.734 1.377 1.00 . A A . 11 ILE HG21 1 1 19 9453 1 1 11 ILE HG22 H 13.020 0.202 2.088 1.00 . A A . 11 ILE HG22 1 1 19 9454 1 1 11 ILE HG23 H 12.606 1.718 2.885 1.00 . A A . 11 ILE HG23 1 1 19 9455 1 1 11 ILE N N 9.052 0.637 1.174 1.00 . A A . 11 ILE N 1 1 19 9456 1 1 11 ILE O O 9.810 2.425 3.374 1.00 . A A . 11 ILE O 1 1 19 9457 1 1 12 GLY C C 8.756 0.450 6.254 1.00 . A A . 12 GLY C 1 1 19 9458 1 1 12 GLY CA C 10.050 0.940 5.641 1.00 . A A . 12 GLY CA 1 1 19 9459 1 1 12 GLY H H 10.468 -0.502 4.170 1.00 . A A . 12 GLY H 1 1 19 9460 1 1 12 GLY HA2 H 10.877 0.613 6.256 1.00 . A A . 12 GLY HA2 1 1 19 9461 1 1 12 GLY HA3 H 10.035 2.019 5.614 1.00 . A A . 12 GLY HA3 1 1 19 9462 1 1 12 GLY N N 10.234 0.442 4.308 1.00 . A A . 12 GLY N 1 1 19 9463 1 1 12 GLY O O 8.511 0.644 7.446 1.00 . A A . 12 GLY O 1 1 19 9464 1 1 13 TYR C C 6.835 -2.173 6.256 1.00 . A A . 13 TYR C 1 1 19 9465 1 1 13 TYR CA C 6.674 -0.703 5.950 1.00 . A A . 13 TYR CA 1 1 19 9466 1 1 13 TYR CB C 5.526 -0.499 4.953 1.00 . A A . 13 TYR CB 1 1 19 9467 1 1 13 TYR CD1 C 3.638 -2.191 5.122 1.00 . A A . 13 TYR CD1 1 1 19 9468 1 1 13 TYR CD2 C 3.459 -0.169 6.363 1.00 . A A . 13 TYR CD2 1 1 19 9469 1 1 13 TYR CE1 C 2.417 -2.610 5.622 1.00 . A A . 13 TYR CE1 1 1 19 9470 1 1 13 TYR CE2 C 2.244 -0.581 6.863 1.00 . A A . 13 TYR CE2 1 1 19 9471 1 1 13 TYR CG C 4.178 -0.961 5.483 1.00 . A A . 13 TYR CG 1 1 19 9472 1 1 13 TYR CZ C 1.728 -1.799 6.493 1.00 . A A . 13 TYR CZ 1 1 19 9473 1 1 13 TYR H H 8.152 -0.302 4.505 1.00 . A A . 13 TYR H 1 1 19 9474 1 1 13 TYR HA H 6.441 -0.182 6.866 1.00 . A A . 13 TYR HA 1 1 19 9475 1 1 13 TYR HB2 H 5.447 0.552 4.712 1.00 . A A . 13 TYR HB2 1 1 19 9476 1 1 13 TYR HB3 H 5.739 -1.056 4.053 1.00 . A A . 13 TYR HB3 1 1 19 9477 1 1 13 TYR HD1 H 4.184 -2.823 4.437 1.00 . A A . 13 TYR HD1 1 1 19 9478 1 1 13 TYR HD2 H 3.862 0.789 6.653 1.00 . A A . 13 TYR HD2 1 1 19 9479 1 1 13 TYR HE1 H 2.013 -3.568 5.331 1.00 . A A . 13 TYR HE1 1 1 19 9480 1 1 13 TYR HE2 H 1.703 0.052 7.549 1.00 . A A . 13 TYR HE2 1 1 19 9481 1 1 13 TYR HH H -0.093 -1.466 6.792 1.00 . A A . 13 TYR HH 1 1 19 9482 1 1 13 TYR N N 7.921 -0.175 5.452 1.00 . A A . 13 TYR N 1 1 19 9483 1 1 13 TYR O O 7.439 -2.921 5.470 1.00 . A A . 13 TYR O 1 1 19 9484 1 1 13 TYR OH O 0.510 -2.195 6.988 1.00 . A A . 13 TYR OH 1 1 19 9485 1 1 14 SER C C 4.990 -4.395 8.186 1.00 . A A . 14 SER C 1 1 19 9486 1 1 14 SER CA C 6.393 -3.954 7.801 1.00 . A A . 14 SER CA 1 1 19 9487 1 1 14 SER CB C 7.300 -4.029 9.032 1.00 . A A . 14 SER CB 1 1 19 9488 1 1 14 SER H H 5.830 -1.950 7.957 1.00 . A A . 14 SER H 1 1 19 9489 1 1 14 SER HA H 6.792 -4.569 7.011 1.00 . A A . 14 SER HA 1 1 19 9490 1 1 14 SER HB2 H 6.674 -3.894 9.901 1.00 . A A . 14 SER HB2 1 1 19 9491 1 1 14 SER HB3 H 7.775 -4.996 9.067 1.00 . A A . 14 SER HB3 1 1 19 9492 1 1 14 SER N N 6.307 -2.583 7.374 1.00 . A A . 14 SER N 1 1 19 9493 1 1 14 SER O O 4.435 -3.890 9.166 1.00 . A A . 14 SER O 1 1 19 9494 1 1 14 SER OG O 8.326 -2.980 8.967 1.00 . A A . 14 SER OG 1 1 19 9495 1 1 15 GLY C C 2.348 -6.318 6.574 1.00 . A A . 15 GLY C 1 1 19 9496 1 1 15 GLY CA C 3.064 -5.708 7.748 1.00 . A A . 15 GLY CA 1 1 19 9497 1 1 15 GLY H H 4.808 -5.596 6.586 1.00 . A A . 15 GLY H 1 1 19 9498 1 1 15 GLY HA2 H 3.141 -6.444 8.534 1.00 . A A . 15 GLY HA2 1 1 19 9499 1 1 15 GLY HA3 H 2.498 -4.860 8.105 1.00 . A A . 15 GLY HA3 1 1 19 9500 1 1 15 GLY N N 4.388 -5.259 7.409 1.00 . A A . 15 GLY N 1 1 19 9501 1 1 15 GLY O O 2.996 -6.916 5.712 1.00 . A A . 15 GLY O 1 1 19 9502 1 1 16 PRO C C 0.426 -6.027 4.124 1.00 . A A . 16 PRO C 1 1 19 9503 1 1 16 PRO CA C 0.201 -6.756 5.440 1.00 . A A . 16 PRO CA 1 1 19 9504 1 1 16 PRO CB C -1.249 -6.558 5.921 1.00 . A A . 16 PRO CB 1 1 19 9505 1 1 16 PRO CD C 0.184 -5.468 7.484 1.00 . A A . 16 PRO CD 1 1 19 9506 1 1 16 PRO CG C -1.138 -6.144 7.349 1.00 . A A . 16 PRO CG 1 1 19 9507 1 1 16 PRO HA H 0.403 -7.809 5.306 1.00 . A A . 16 PRO HA 1 1 19 9508 1 1 16 PRO HB2 H -1.728 -5.797 5.323 1.00 . A A . 16 PRO HB2 1 1 19 9509 1 1 16 PRO HB3 H -1.792 -7.485 5.822 1.00 . A A . 16 PRO HB3 1 1 19 9510 1 1 16 PRO HD2 H 0.106 -4.422 7.227 1.00 . A A . 16 PRO HD2 1 1 19 9511 1 1 16 PRO HD3 H 0.565 -5.592 8.488 1.00 . A A . 16 PRO HD3 1 1 19 9512 1 1 16 PRO HG2 H -1.933 -5.458 7.596 1.00 . A A . 16 PRO HG2 1 1 19 9513 1 1 16 PRO HG3 H -1.182 -7.014 7.988 1.00 . A A . 16 PRO HG3 1 1 19 9514 1 1 16 PRO N N 1.014 -6.192 6.514 1.00 . A A . 16 PRO N 1 1 19 9515 1 1 16 PRO O O 0.042 -4.883 3.968 1.00 . A A . 16 PRO O 1 1 19 9516 1 1 17 THR C C 0.309 -6.318 0.885 1.00 . A A . 17 THR C 1 1 19 9517 1 1 17 THR CA C 1.400 -6.133 1.934 1.00 . A A . 17 THR CA 1 1 19 9518 1 1 17 THR CB C 2.719 -6.741 1.451 1.00 . A A . 17 THR CB 1 1 19 9519 1 1 17 THR CG2 C 3.883 -6.178 2.252 1.00 . A A . 17 THR CG2 1 1 19 9520 1 1 17 THR H H 1.350 -7.615 3.385 1.00 . A A . 17 THR H 1 1 19 9521 1 1 17 THR HA H 1.564 -5.076 2.070 1.00 . A A . 17 THR HA 1 1 19 9522 1 1 17 THR HB H 2.852 -6.501 0.406 1.00 . A A . 17 THR HB 1 1 19 9523 1 1 17 THR HG1 H 3.331 -8.541 1.004 1.00 . A A . 17 THR HG1 1 1 19 9524 1 1 17 THR HG21 H 3.762 -6.449 3.290 1.00 . A A . 17 THR HG21 1 1 19 9525 1 1 17 THR HG22 H 3.877 -5.100 2.167 1.00 . A A . 17 THR HG22 1 1 19 9526 1 1 17 THR HG23 H 4.815 -6.572 1.877 1.00 . A A . 17 THR HG23 1 1 19 9527 1 1 17 THR N N 1.058 -6.698 3.207 1.00 . A A . 17 THR N 1 1 19 9528 1 1 17 THR O O 0.282 -5.609 -0.133 1.00 . A A . 17 THR O 1 1 19 9529 1 1 17 THR OG1 O 2.669 -8.184 1.613 1.00 . A A . 17 THR OG1 1 1 19 9530 1 1 18 VAL C C -2.832 -6.629 0.419 1.00 . A A . 18 VAL C 1 1 19 9531 1 1 18 VAL CA C -1.640 -7.531 0.166 1.00 . A A . 18 VAL CA 1 1 19 9532 1 1 18 VAL CB C -2.078 -9.022 0.207 1.00 . A A . 18 VAL CB 1 1 19 9533 1 1 18 VAL CG1 C -3.085 -9.319 -0.894 1.00 . A A . 18 VAL CG1 1 1 19 9534 1 1 18 VAL CG2 C -0.872 -9.944 0.091 1.00 . A A . 18 VAL CG2 1 1 19 9535 1 1 18 VAL H H -0.586 -7.708 1.986 1.00 . A A . 18 VAL H 1 1 19 9536 1 1 18 VAL HA H -1.242 -7.308 -0.812 1.00 . A A . 18 VAL HA 1 1 19 9537 1 1 18 VAL HB H -2.562 -9.208 1.154 1.00 . A A . 18 VAL HB 1 1 19 9538 1 1 18 VAL HG11 H -3.362 -10.361 -0.859 1.00 . A A . 18 VAL HG11 1 1 19 9539 1 1 18 VAL HG12 H -2.641 -9.099 -1.852 1.00 . A A . 18 VAL HG12 1 1 19 9540 1 1 18 VAL HG13 H -3.963 -8.705 -0.756 1.00 . A A . 18 VAL HG13 1 1 19 9541 1 1 18 VAL HG21 H -0.193 -9.748 0.906 1.00 . A A . 18 VAL HG21 1 1 19 9542 1 1 18 VAL HG22 H -0.371 -9.766 -0.850 1.00 . A A . 18 VAL HG22 1 1 19 9543 1 1 18 VAL HG23 H -1.200 -10.972 0.134 1.00 . A A . 18 VAL HG23 1 1 19 9544 1 1 18 VAL N N -0.598 -7.237 1.127 1.00 . A A . 18 VAL N 1 1 19 9545 1 1 18 VAL O O -3.366 -6.580 1.538 1.00 . A A . 18 VAL O 1 1 19 9546 1 1 19 CYS C C -5.684 -5.614 -0.462 1.00 . A A . 19 CYS C 1 1 19 9547 1 1 19 CYS CA C -4.307 -4.959 -0.502 1.00 . A A . 19 CYS CA 1 1 19 9548 1 1 19 CYS CB C -4.216 -3.977 -1.650 1.00 . A A . 19 CYS CB 1 1 19 9549 1 1 19 CYS H H -2.784 -6.043 -1.464 1.00 . A A . 19 CYS H 1 1 19 9550 1 1 19 CYS HA H -4.167 -4.409 0.416 1.00 . A A . 19 CYS HA 1 1 19 9551 1 1 19 CYS HB2 H -4.310 -4.505 -2.587 1.00 . A A . 19 CYS HB2 1 1 19 9552 1 1 19 CYS HB3 H -5.018 -3.256 -1.562 1.00 . A A . 19 CYS HB3 1 1 19 9553 1 1 19 CYS N N -3.232 -5.921 -0.598 1.00 . A A . 19 CYS N 1 1 19 9554 1 1 19 CYS O O -5.850 -6.789 -0.838 1.00 . A A . 19 CYS O 1 1 19 9555 1 1 19 CYS SG S -2.662 -3.052 -1.677 1.00 . A A . 19 CYS SG 1 1 19 9556 1 1 20 ALA C C -8.684 -5.565 -1.222 1.00 . A A . 20 ALA C 1 1 19 9557 1 1 20 ALA CA C -8.042 -5.270 0.130 1.00 . A A . 20 ALA CA 1 1 19 9558 1 1 20 ALA CB C -8.845 -4.224 0.887 1.00 . A A . 20 ALA CB 1 1 19 9559 1 1 20 ALA H H -6.432 -3.936 0.310 1.00 . A A . 20 ALA H 1 1 19 9560 1 1 20 ALA HA H -8.068 -6.184 0.702 1.00 . A A . 20 ALA HA 1 1 19 9561 1 1 20 ALA HB1 H -9.851 -4.585 1.043 1.00 . A A . 20 ALA HB1 1 1 19 9562 1 1 20 ALA HB2 H -8.878 -3.309 0.314 1.00 . A A . 20 ALA HB2 1 1 19 9563 1 1 20 ALA HB3 H -8.377 -4.032 1.841 1.00 . A A . 20 ALA HB3 1 1 19 9564 1 1 20 ALA N N -6.659 -4.845 0.008 1.00 . A A . 20 ALA N 1 1 19 9565 1 1 20 ALA O O -8.104 -5.282 -2.291 1.00 . A A . 20 ALA O 1 1 19 9566 1 1 21 SER C C -10.848 -5.404 -3.314 1.00 . A A . 21 SER C 1 1 19 9567 1 1 21 SER CA C -10.634 -6.529 -2.300 1.00 . A A . 21 SER CA 1 1 19 9568 1 1 21 SER CB C -11.963 -7.057 -1.790 1.00 . A A . 21 SER CB 1 1 19 9569 1 1 21 SER H H -10.316 -6.201 -0.288 1.00 . A A . 21 SER H 1 1 19 9570 1 1 21 SER HA H -10.111 -7.347 -2.770 1.00 . A A . 21 SER HA 1 1 19 9571 1 1 21 SER HB2 H -12.639 -7.179 -2.622 1.00 . A A . 21 SER HB2 1 1 19 9572 1 1 21 SER HB3 H -11.820 -8.000 -1.282 1.00 . A A . 21 SER HB3 1 1 19 9573 1 1 21 SER HG H -12.558 -5.291 -1.368 1.00 . A A . 21 SER HG 1 1 19 9574 1 1 21 SER N N -9.879 -6.097 -1.158 1.00 . A A . 21 SER N 1 1 19 9575 1 1 21 SER O O -11.530 -4.411 -3.024 1.00 . A A . 21 SER O 1 1 19 9576 1 1 21 SER OG O -12.529 -6.125 -0.880 1.00 . A A . 21 SER OG 1 1 19 9577 1 1 22 GLY C C -9.343 -3.533 -5.554 1.00 . A A . 22 GLY C 1 1 19 9578 1 1 22 GLY CA C -10.404 -4.603 -5.522 1.00 . A A . 22 GLY CA 1 1 19 9579 1 1 22 GLY H H -9.640 -6.314 -4.604 1.00 . A A . 22 GLY H 1 1 19 9580 1 1 22 GLY HA2 H -10.391 -5.133 -6.462 1.00 . A A . 22 GLY HA2 1 1 19 9581 1 1 22 GLY HA3 H -11.368 -4.130 -5.400 1.00 . A A . 22 GLY HA3 1 1 19 9582 1 1 22 GLY N N -10.232 -5.545 -4.462 1.00 . A A . 22 GLY N 1 1 19 9583 1 1 22 GLY O O -9.335 -2.718 -6.455 1.00 . A A . 22 GLY O 1 1 19 9584 1 1 23 THR C C -6.040 -3.049 -4.888 1.00 . A A . 23 THR C 1 1 19 9585 1 1 23 THR CA C -7.422 -2.495 -4.534 1.00 . A A . 23 THR CA 1 1 19 9586 1 1 23 THR CB C -7.406 -1.811 -3.134 1.00 . A A . 23 THR CB 1 1 19 9587 1 1 23 THR CG2 C -8.758 -1.191 -2.835 1.00 . A A . 23 THR CG2 1 1 19 9588 1 1 23 THR H H -8.427 -4.265 -3.935 1.00 . A A . 23 THR H 1 1 19 9589 1 1 23 THR HA H -7.684 -1.755 -5.276 1.00 . A A . 23 THR HA 1 1 19 9590 1 1 23 THR HB H -6.658 -1.032 -3.120 1.00 . A A . 23 THR HB 1 1 19 9591 1 1 23 THR HG1 H -7.393 -3.645 -2.396 1.00 . A A . 23 THR HG1 1 1 19 9592 1 1 23 THR HG21 H -9.516 -1.960 -2.848 1.00 . A A . 23 THR HG21 1 1 19 9593 1 1 23 THR HG22 H -8.987 -0.449 -3.586 1.00 . A A . 23 THR HG22 1 1 19 9594 1 1 23 THR HG23 H -8.736 -0.723 -1.862 1.00 . A A . 23 THR HG23 1 1 19 9595 1 1 23 THR N N -8.433 -3.540 -4.598 1.00 . A A . 23 THR N 1 1 19 9596 1 1 23 THR O O -5.745 -4.215 -4.606 1.00 . A A . 23 THR O 1 1 19 9597 1 1 23 THR OG1 O -7.111 -2.765 -2.108 1.00 . A A . 23 THR OG1 1 1 19 9598 1 1 24 THR C C -2.793 -1.850 -5.264 1.00 . A A . 24 THR C 1 1 19 9599 1 1 24 THR CA C -3.888 -2.671 -5.941 1.00 . A A . 24 THR CA 1 1 19 9600 1 1 24 THR CB C -3.737 -2.581 -7.485 1.00 . A A . 24 THR CB 1 1 19 9601 1 1 24 THR CG2 C -4.578 -3.642 -8.180 1.00 . A A . 24 THR CG2 1 1 19 9602 1 1 24 THR H H -5.477 -1.308 -5.704 1.00 . A A . 24 THR H 1 1 19 9603 1 1 24 THR HA H -3.772 -3.705 -5.650 1.00 . A A . 24 THR HA 1 1 19 9604 1 1 24 THR HB H -2.697 -2.741 -7.728 1.00 . A A . 24 THR HB 1 1 19 9605 1 1 24 THR HG1 H -4.667 -0.815 -7.298 1.00 . A A . 24 THR HG1 1 1 19 9606 1 1 24 THR HG21 H -4.455 -3.557 -9.250 1.00 . A A . 24 THR HG21 1 1 19 9607 1 1 24 THR HG22 H -5.618 -3.504 -7.923 1.00 . A A . 24 THR HG22 1 1 19 9608 1 1 24 THR HG23 H -4.257 -4.623 -7.859 1.00 . A A . 24 THR HG23 1 1 19 9609 1 1 24 THR N N -5.211 -2.241 -5.519 1.00 . A A . 24 THR N 1 1 19 9610 1 1 24 THR O O -2.965 -0.660 -5.042 1.00 . A A . 24 THR O 1 1 19 9611 1 1 24 THR OG1 O -4.122 -1.268 -7.967 1.00 . A A . 24 THR OG1 1 1 19 9612 1 1 25 CYS C C 0.219 -1.037 -5.339 1.00 . A A . 25 CYS C 1 1 19 9613 1 1 25 CYS CA C -0.582 -1.796 -4.289 1.00 . A A . 25 CYS CA 1 1 19 9614 1 1 25 CYS CB C 0.316 -2.804 -3.545 1.00 . A A . 25 CYS CB 1 1 19 9615 1 1 25 CYS H H -1.594 -3.437 -5.130 1.00 . A A . 25 CYS H 1 1 19 9616 1 1 25 CYS HA H -0.990 -1.090 -3.581 1.00 . A A . 25 CYS HA 1 1 19 9617 1 1 25 CYS HB2 H -0.279 -3.340 -2.819 1.00 . A A . 25 CYS HB2 1 1 19 9618 1 1 25 CYS HB3 H 0.717 -3.505 -4.261 1.00 . A A . 25 CYS HB3 1 1 19 9619 1 1 25 CYS N N -1.692 -2.481 -4.931 1.00 . A A . 25 CYS N 1 1 19 9620 1 1 25 CYS O O 0.902 -1.640 -6.170 1.00 . A A . 25 CYS O 1 1 19 9621 1 1 25 CYS SG S 1.727 -2.065 -2.643 1.00 . A A . 25 CYS SG 1 1 19 9622 1 1 26 GLN C C 1.806 1.962 -5.611 1.00 . A A . 26 GLN C 1 1 19 9623 1 1 26 GLN CA C 0.771 1.096 -6.301 1.00 . A A . 26 GLN CA 1 1 19 9624 1 1 26 GLN CB C -0.218 1.956 -7.092 1.00 . A A . 26 GLN CB 1 1 19 9625 1 1 26 GLN CD C -2.180 1.991 -8.702 1.00 . A A . 26 GLN CD 1 1 19 9626 1 1 26 GLN CG C -1.212 1.139 -7.909 1.00 . A A . 26 GLN CG 1 1 19 9627 1 1 26 GLN H H -0.490 0.700 -4.673 1.00 . A A . 26 GLN H 1 1 19 9628 1 1 26 GLN HA H 1.281 0.438 -6.988 1.00 . A A . 26 GLN HA 1 1 19 9629 1 1 26 GLN HB2 H -0.769 2.574 -6.399 1.00 . A A . 26 GLN HB2 1 1 19 9630 1 1 26 GLN HB3 H 0.335 2.591 -7.768 1.00 . A A . 26 GLN HB3 1 1 19 9631 1 1 26 GLN HE21 H -3.541 0.593 -8.540 1.00 . A A . 26 GLN HE21 1 1 19 9632 1 1 26 GLN HE22 H -4.008 1.995 -9.435 1.00 . A A . 26 GLN HE22 1 1 19 9633 1 1 26 GLN HG2 H -0.664 0.519 -8.602 1.00 . A A . 26 GLN HG2 1 1 19 9634 1 1 26 GLN HG3 H -1.776 0.509 -7.237 1.00 . A A . 26 GLN HG3 1 1 19 9635 1 1 26 GLN N N 0.086 0.265 -5.344 1.00 . A A . 26 GLN N 1 1 19 9636 1 1 26 GLN NE2 N -3.357 1.485 -8.912 1.00 . A A . 26 GLN NE2 1 1 19 9637 1 1 26 GLN O O 1.520 2.621 -4.606 1.00 . A A . 26 GLN O 1 1 19 9638 1 1 26 GLN OE1 O -1.861 3.105 -9.124 1.00 . A A . 26 GLN OE1 1 1 19 9639 1 1 27 VAL C C 3.967 4.160 -6.009 1.00 . A A . 27 VAL C 1 1 19 9640 1 1 27 VAL CA C 4.105 2.698 -5.598 1.00 . A A . 27 VAL CA 1 1 19 9641 1 1 27 VAL CB C 5.458 2.145 -6.117 1.00 . A A . 27 VAL CB 1 1 19 9642 1 1 27 VAL CG1 C 6.625 2.845 -5.445 1.00 . A A . 27 VAL CG1 1 1 19 9643 1 1 27 VAL CG2 C 5.546 0.649 -5.901 1.00 . A A . 27 VAL CG2 1 1 19 9644 1 1 27 VAL H H 3.140 1.405 -6.946 1.00 . A A . 27 VAL H 1 1 19 9645 1 1 27 VAL HA H 4.077 2.608 -4.522 1.00 . A A . 27 VAL HA 1 1 19 9646 1 1 27 VAL HB H 5.516 2.339 -7.177 1.00 . A A . 27 VAL HB 1 1 19 9647 1 1 27 VAL HG11 H 6.571 3.905 -5.646 1.00 . A A . 27 VAL HG11 1 1 19 9648 1 1 27 VAL HG12 H 7.551 2.449 -5.835 1.00 . A A . 27 VAL HG12 1 1 19 9649 1 1 27 VAL HG13 H 6.585 2.677 -4.379 1.00 . A A . 27 VAL HG13 1 1 19 9650 1 1 27 VAL HG21 H 4.725 0.165 -6.409 1.00 . A A . 27 VAL HG21 1 1 19 9651 1 1 27 VAL HG22 H 5.495 0.436 -4.843 1.00 . A A . 27 VAL HG22 1 1 19 9652 1 1 27 VAL HG23 H 6.480 0.283 -6.300 1.00 . A A . 27 VAL HG23 1 1 19 9653 1 1 27 VAL N N 2.999 1.943 -6.139 1.00 . A A . 27 VAL N 1 1 19 9654 1 1 27 VAL O O 4.052 4.499 -7.201 1.00 . A A . 27 VAL O 1 1 19 9655 1 1 28 LEU C C 4.836 7.169 -5.143 1.00 . A A . 28 LEU C 1 1 19 9656 1 1 28 LEU CA C 3.537 6.421 -5.330 1.00 . A A . 28 LEU CA 1 1 19 9657 1 1 28 LEU CB C 2.470 7.019 -4.403 1.00 . A A . 28 LEU CB 1 1 19 9658 1 1 28 LEU CD1 C 0.134 7.104 -3.506 1.00 . A A . 28 LEU CD1 1 1 19 9659 1 1 28 LEU CD2 C 0.522 6.391 -5.858 1.00 . A A . 28 LEU CD2 1 1 19 9660 1 1 28 LEU CG C 1.077 6.380 -4.448 1.00 . A A . 28 LEU CG 1 1 19 9661 1 1 28 LEU H H 3.686 4.685 -4.126 1.00 . A A . 28 LEU H 1 1 19 9662 1 1 28 LEU HA H 3.207 6.527 -6.353 1.00 . A A . 28 LEU HA 1 1 19 9663 1 1 28 LEU HB2 H 2.838 6.949 -3.389 1.00 . A A . 28 LEU HB2 1 1 19 9664 1 1 28 LEU HB3 H 2.370 8.065 -4.649 1.00 . A A . 28 LEU HB3 1 1 19 9665 1 1 28 LEU HD11 H 0.518 7.044 -2.499 1.00 . A A . 28 LEU HD11 1 1 19 9666 1 1 28 LEU HD12 H -0.841 6.640 -3.550 1.00 . A A . 28 LEU HD12 1 1 19 9667 1 1 28 LEU HD13 H 0.055 8.139 -3.800 1.00 . A A . 28 LEU HD13 1 1 19 9668 1 1 28 LEU HD21 H 0.477 7.409 -6.214 1.00 . A A . 28 LEU HD21 1 1 19 9669 1 1 28 LEU HD22 H -0.469 5.965 -5.844 1.00 . A A . 28 LEU HD22 1 1 19 9670 1 1 28 LEU HD23 H 1.161 5.805 -6.502 1.00 . A A . 28 LEU HD23 1 1 19 9671 1 1 28 LEU HG H 1.154 5.354 -4.118 1.00 . A A . 28 LEU HG 1 1 19 9672 1 1 28 LEU N N 3.727 5.012 -5.051 1.00 . A A . 28 LEU N 1 1 19 9673 1 1 28 LEU O O 5.253 7.963 -5.994 1.00 . A A . 28 LEU O 1 1 19 9674 1 1 29 ASN C C 7.792 6.531 -3.447 1.00 . A A . 29 ASN C 1 1 19 9675 1 1 29 ASN CA C 6.696 7.574 -3.664 1.00 . A A . 29 ASN CA 1 1 19 9676 1 1 29 ASN CB C 6.420 8.362 -2.364 1.00 . A A . 29 ASN CB 1 1 19 9677 1 1 29 ASN CG C 5.320 9.403 -2.487 1.00 . A A . 29 ASN CG 1 1 19 9678 1 1 29 ASN H H 5.193 6.122 -3.502 1.00 . A A . 29 ASN H 1 1 19 9679 1 1 29 ASN HA H 6.981 8.254 -4.454 1.00 . A A . 29 ASN HA 1 1 19 9680 1 1 29 ASN HB2 H 6.170 7.676 -1.572 1.00 . A A . 29 ASN HB2 1 1 19 9681 1 1 29 ASN HB3 H 7.329 8.877 -2.092 1.00 . A A . 29 ASN HB3 1 1 19 9682 1 1 29 ASN HD21 H 4.778 9.120 -0.600 1.00 . A A . 29 ASN HD21 1 1 19 9683 1 1 29 ASN HD22 H 3.890 10.300 -1.459 1.00 . A A . 29 ASN HD22 1 1 19 9684 1 1 29 ASN N N 5.492 6.875 -4.060 1.00 . A A . 29 ASN N 1 1 19 9685 1 1 29 ASN ND2 N 4.596 9.621 -1.423 1.00 . A A . 29 ASN ND2 1 1 19 9686 1 1 29 ASN O O 7.496 5.342 -3.529 1.00 . A A . 29 ASN O 1 1 19 9687 1 1 29 ASN OD1 O 5.121 10.002 -3.543 1.00 . A A . 29 ASN OD1 1 1 19 9688 1 1 30 PRO C C 9.862 4.942 -1.871 1.00 . A A . 30 PRO C 1 1 19 9689 1 1 30 PRO CA C 10.172 5.966 -2.973 1.00 . A A . 30 PRO CA 1 1 19 9690 1 1 30 PRO CB C 11.343 6.859 -2.554 1.00 . A A . 30 PRO CB 1 1 19 9691 1 1 30 PRO CD C 9.578 8.324 -3.164 1.00 . A A . 30 PRO CD 1 1 19 9692 1 1 30 PRO CG C 11.064 8.157 -3.215 1.00 . A A . 30 PRO CG 1 1 19 9693 1 1 30 PRO HA H 10.425 5.438 -3.880 1.00 . A A . 30 PRO HA 1 1 19 9694 1 1 30 PRO HB2 H 11.354 6.955 -1.478 1.00 . A A . 30 PRO HB2 1 1 19 9695 1 1 30 PRO HB3 H 12.275 6.432 -2.894 1.00 . A A . 30 PRO HB3 1 1 19 9696 1 1 30 PRO HD2 H 9.304 8.820 -2.245 1.00 . A A . 30 PRO HD2 1 1 19 9697 1 1 30 PRO HD3 H 9.223 8.882 -4.016 1.00 . A A . 30 PRO HD3 1 1 19 9698 1 1 30 PRO HG2 H 11.553 8.959 -2.682 1.00 . A A . 30 PRO HG2 1 1 19 9699 1 1 30 PRO HG3 H 11.397 8.130 -4.241 1.00 . A A . 30 PRO HG3 1 1 19 9700 1 1 30 PRO N N 9.074 6.929 -3.197 1.00 . A A . 30 PRO N 1 1 19 9701 1 1 30 PRO O O 10.107 3.744 -2.044 1.00 . A A . 30 PRO O 1 1 19 9702 1 1 31 TYR C C 7.479 4.257 0.426 1.00 . A A . 31 TYR C 1 1 19 9703 1 1 31 TYR CA C 8.986 4.525 0.351 1.00 . A A . 31 TYR CA 1 1 19 9704 1 1 31 TYR CB C 9.412 5.176 1.683 1.00 . A A . 31 TYR CB 1 1 19 9705 1 1 31 TYR CD1 C 11.855 4.783 2.255 1.00 . A A . 31 TYR CD1 1 1 19 9706 1 1 31 TYR CD2 C 11.225 6.926 1.444 1.00 . A A . 31 TYR CD2 1 1 19 9707 1 1 31 TYR CE1 C 13.164 5.216 2.381 1.00 . A A . 31 TYR CE1 1 1 19 9708 1 1 31 TYR CE2 C 12.522 7.361 1.558 1.00 . A A . 31 TYR CE2 1 1 19 9709 1 1 31 TYR CG C 10.862 5.631 1.785 1.00 . A A . 31 TYR CG 1 1 19 9710 1 1 31 TYR CZ C 13.488 6.509 2.026 1.00 . A A . 31 TYR CZ 1 1 19 9711 1 1 31 TYR H H 9.108 6.364 -0.698 1.00 . A A . 31 TYR H 1 1 19 9712 1 1 31 TYR HA H 9.525 3.596 0.234 1.00 . A A . 31 TYR HA 1 1 19 9713 1 1 31 TYR HB2 H 8.795 6.045 1.857 1.00 . A A . 31 TYR HB2 1 1 19 9714 1 1 31 TYR HB3 H 9.235 4.462 2.475 1.00 . A A . 31 TYR HB3 1 1 19 9715 1 1 31 TYR HD1 H 11.596 3.771 2.528 1.00 . A A . 31 TYR HD1 1 1 19 9716 1 1 31 TYR HD2 H 10.473 7.606 1.075 1.00 . A A . 31 TYR HD2 1 1 19 9717 1 1 31 TYR HE1 H 13.926 4.544 2.747 1.00 . A A . 31 TYR HE1 1 1 19 9718 1 1 31 TYR HE2 H 12.772 8.374 1.280 1.00 . A A . 31 TYR HE2 1 1 19 9719 1 1 31 TYR HH H 15.387 6.295 1.794 1.00 . A A . 31 TYR HH 1 1 19 9720 1 1 31 TYR N N 9.300 5.404 -0.766 1.00 . A A . 31 TYR N 1 1 19 9721 1 1 31 TYR O O 7.034 3.255 0.990 1.00 . A A . 31 TYR O 1 1 19 9722 1 1 31 TYR OH O 14.790 6.962 2.156 1.00 . A A . 31 TYR OH 1 1 19 9723 1 1 32 TYR C C 4.604 4.305 -1.161 1.00 . A A . 32 TYR C 1 1 19 9724 1 1 32 TYR CA C 5.258 5.041 0.009 1.00 . A A . 32 TYR CA 1 1 19 9725 1 1 32 TYR CB C 4.616 6.408 0.219 1.00 . A A . 32 TYR CB 1 1 19 9726 1 1 32 TYR CD1 C 2.891 6.069 2.017 1.00 . A A . 32 TYR CD1 1 1 19 9727 1 1 32 TYR CD2 C 2.130 6.622 -0.171 1.00 . A A . 32 TYR CD2 1 1 19 9728 1 1 32 TYR CE1 C 1.592 6.038 2.470 1.00 . A A . 32 TYR CE1 1 1 19 9729 1 1 32 TYR CE2 C 0.829 6.591 0.278 1.00 . A A . 32 TYR CE2 1 1 19 9730 1 1 32 TYR CG C 3.185 6.360 0.691 1.00 . A A . 32 TYR CG 1 1 19 9731 1 1 32 TYR CZ C 0.565 6.299 1.596 1.00 . A A . 32 TYR CZ 1 1 19 9732 1 1 32 TYR H H 7.091 5.905 -0.601 1.00 . A A . 32 TYR H 1 1 19 9733 1 1 32 TYR HA H 5.073 4.454 0.898 1.00 . A A . 32 TYR HA 1 1 19 9734 1 1 32 TYR HB2 H 5.183 6.964 0.949 1.00 . A A . 32 TYR HB2 1 1 19 9735 1 1 32 TYR HB3 H 4.625 6.942 -0.718 1.00 . A A . 32 TYR HB3 1 1 19 9736 1 1 32 TYR HD1 H 3.704 5.862 2.697 1.00 . A A . 32 TYR HD1 1 1 19 9737 1 1 32 TYR HD2 H 2.328 6.848 -1.210 1.00 . A A . 32 TYR HD2 1 1 19 9738 1 1 32 TYR HE1 H 1.385 5.810 3.507 1.00 . A A . 32 TYR HE1 1 1 19 9739 1 1 32 TYR HE2 H 0.018 6.797 -0.403 1.00 . A A . 32 TYR HE2 1 1 19 9740 1 1 32 TYR HH H -0.791 6.783 2.854 1.00 . A A . 32 TYR HH 1 1 19 9741 1 1 32 TYR N N 6.694 5.158 -0.112 1.00 . A A . 32 TYR N 1 1 19 9742 1 1 32 TYR O O 4.616 4.783 -2.310 1.00 . A A . 32 TYR O 1 1 19 9743 1 1 32 TYR OH O -0.740 6.267 2.040 1.00 . A A . 32 TYR OH 1 1 19 9744 1 1 33 SER C C 1.827 2.355 -1.182 1.00 . A A . 33 SER C 1 1 19 9745 1 1 33 SER CA C 3.224 2.434 -1.796 1.00 . A A . 33 SER CA 1 1 19 9746 1 1 33 SER CB C 3.818 1.035 -2.007 1.00 . A A . 33 SER CB 1 1 19 9747 1 1 33 SER H H 4.135 2.804 0.036 1.00 . A A . 33 SER H 1 1 19 9748 1 1 33 SER HA H 3.181 2.978 -2.727 1.00 . A A . 33 SER HA 1 1 19 9749 1 1 33 SER HB2 H 3.736 0.462 -1.095 1.00 . A A . 33 SER HB2 1 1 19 9750 1 1 33 SER HB3 H 3.270 0.542 -2.798 1.00 . A A . 33 SER HB3 1 1 19 9751 1 1 33 SER HG H 5.424 0.297 -2.844 1.00 . A A . 33 SER HG 1 1 19 9752 1 1 33 SER N N 4.028 3.178 -0.861 1.00 . A A . 33 SER N 1 1 19 9753 1 1 33 SER O O 1.707 2.072 0.011 1.00 . A A . 33 SER O 1 1 19 9754 1 1 33 SER OG O 5.191 1.115 -2.387 1.00 . A A . 33 SER OG 1 1 19 9755 1 1 34 GLN C C -1.519 1.808 -2.196 1.00 . A A . 34 GLN C 1 1 19 9756 1 1 34 GLN CA C -0.554 2.720 -1.431 1.00 . A A . 34 GLN CA 1 1 19 9757 1 1 34 GLN CB C -0.998 4.180 -1.534 1.00 . A A . 34 GLN CB 1 1 19 9758 1 1 34 GLN CD C -2.754 5.933 -1.118 1.00 . A A . 34 GLN CD 1 1 19 9759 1 1 34 GLN CG C -2.375 4.473 -0.989 1.00 . A A . 34 GLN CG 1 1 19 9760 1 1 34 GLN H H 0.935 2.726 -2.929 1.00 . A A . 34 GLN H 1 1 19 9761 1 1 34 GLN HA H -0.541 2.436 -0.389 1.00 . A A . 34 GLN HA 1 1 19 9762 1 1 34 GLN HB2 H -0.290 4.789 -0.992 1.00 . A A . 34 GLN HB2 1 1 19 9763 1 1 34 GLN HB3 H -0.976 4.467 -2.575 1.00 . A A . 34 GLN HB3 1 1 19 9764 1 1 34 GLN HE21 H -2.004 6.331 0.671 1.00 . A A . 34 GLN HE21 1 1 19 9765 1 1 34 GLN HE22 H -2.683 7.662 -0.187 1.00 . A A . 34 GLN HE22 1 1 19 9766 1 1 34 GLN HG2 H -3.096 3.879 -1.530 1.00 . A A . 34 GLN HG2 1 1 19 9767 1 1 34 GLN HG3 H -2.399 4.200 0.056 1.00 . A A . 34 GLN HG3 1 1 19 9768 1 1 34 GLN N N 0.802 2.618 -1.958 1.00 . A A . 34 GLN N 1 1 19 9769 1 1 34 GLN NE2 N -2.456 6.711 -0.121 1.00 . A A . 34 GLN NE2 1 1 19 9770 1 1 34 GLN O O -1.342 1.577 -3.392 1.00 . A A . 34 GLN O 1 1 19 9771 1 1 34 GLN OE1 O -3.321 6.353 -2.117 1.00 . A A . 34 GLN OE1 1 1 19 9772 1 1 35 CYS C C -4.591 1.288 -2.788 1.00 . A A . 35 CYS C 1 1 19 9773 1 1 35 CYS CA C -3.515 0.449 -2.131 1.00 . A A . 35 CYS CA 1 1 19 9774 1 1 35 CYS CB C -4.152 -0.496 -1.139 1.00 . A A . 35 CYS CB 1 1 19 9775 1 1 35 CYS H H -2.569 1.413 -0.532 1.00 . A A . 35 CYS H 1 1 19 9776 1 1 35 CYS HA H -3.024 -0.138 -2.893 1.00 . A A . 35 CYS HA 1 1 19 9777 1 1 35 CYS HB2 H -4.721 0.042 -0.398 1.00 . A A . 35 CYS HB2 1 1 19 9778 1 1 35 CYS HB3 H -4.834 -1.114 -1.693 1.00 . A A . 35 CYS HB3 1 1 19 9779 1 1 35 CYS N N -2.514 1.273 -1.502 1.00 . A A . 35 CYS N 1 1 19 9780 1 1 35 CYS O O -5.418 1.932 -2.105 1.00 . A A . 35 CYS O 1 1 19 9781 1 1 35 CYS SG S -2.984 -1.595 -0.309 1.00 . A A . 35 CYS SG 1 1 19 9782 1 1 36 LEU C C -6.290 0.922 -5.662 1.00 . A A . 36 LEU C 1 1 19 9783 1 1 36 LEU CA C -5.506 1.966 -4.910 1.00 . A A . 36 LEU CA 1 1 19 9784 1 1 36 LEU CB C -4.780 2.896 -5.885 1.00 . A A . 36 LEU CB 1 1 19 9785 1 1 36 LEU CD1 C -3.199 4.783 -6.309 1.00 . A A . 36 LEU CD1 1 1 19 9786 1 1 36 LEU CD2 C -4.893 4.978 -4.503 1.00 . A A . 36 LEU CD2 1 1 19 9787 1 1 36 LEU CG C -3.972 4.029 -5.250 1.00 . A A . 36 LEU CG 1 1 19 9788 1 1 36 LEU H H -3.869 0.755 -4.539 1.00 . A A . 36 LEU H 1 1 19 9789 1 1 36 LEU HA H -6.174 2.540 -4.285 1.00 . A A . 36 LEU HA 1 1 19 9790 1 1 36 LEU HB2 H -4.112 2.300 -6.490 1.00 . A A . 36 LEU HB2 1 1 19 9791 1 1 36 LEU HB3 H -5.519 3.339 -6.536 1.00 . A A . 36 LEU HB3 1 1 19 9792 1 1 36 LEU HD11 H -3.890 5.158 -7.049 1.00 . A A . 36 LEU HD11 1 1 19 9793 1 1 36 LEU HD12 H -2.486 4.123 -6.780 1.00 . A A . 36 LEU HD12 1 1 19 9794 1 1 36 LEU HD13 H -2.680 5.613 -5.853 1.00 . A A . 36 LEU HD13 1 1 19 9795 1 1 36 LEU HD21 H -4.307 5.773 -4.066 1.00 . A A . 36 LEU HD21 1 1 19 9796 1 1 36 LEU HD22 H -5.411 4.442 -3.722 1.00 . A A . 36 LEU HD22 1 1 19 9797 1 1 36 LEU HD23 H -5.610 5.398 -5.191 1.00 . A A . 36 LEU HD23 1 1 19 9798 1 1 36 LEU HG H -3.268 3.614 -4.542 1.00 . A A . 36 LEU HG 1 1 19 9799 1 1 36 LEU N N -4.567 1.283 -4.084 1.00 . A A . 36 LEU N 1 1 19 9800 1 1 36 LEU O O -7.437 0.675 -5.314 1.00 . A A . 36 LEU O 1 1 19 9801 1 1 36 LEU OXT O -5.716 0.263 -6.558 1.00 . A A . 36 LEU OXT 1 1 19 9802 2 2 1 MAN C1 C 9.236 -2.940 10.054 1.00 . B A . 101 MAN C1 1 1 19 9803 2 2 1 MAN C2 C 8.485 -2.997 11.411 1.00 . B A . 101 MAN C2 1 1 19 9804 2 2 1 MAN C3 C 7.563 -1.789 11.540 1.00 . B A . 101 MAN C3 1 1 19 9805 2 2 1 MAN C4 C 8.375 -0.508 11.405 1.00 . B A . 101 MAN C4 1 1 19 9806 2 2 1 MAN C5 C 9.135 -0.525 10.070 1.00 . B A . 101 MAN C5 1 1 19 9807 2 2 1 MAN C6 C 10.032 0.679 9.877 1.00 . B A . 101 MAN C6 1 1 19 9808 2 2 1 MAN H1 H 9.908 -3.811 10.017 1.00 . B A . 101 MAN H1 1 1 19 9809 2 2 1 MAN H2 H 7.889 -3.919 11.456 1.00 . B A . 101 MAN H2 1 1 19 9810 2 2 1 MAN H3 H 6.821 -1.841 10.730 1.00 . B A . 101 MAN H3 1 1 19 9811 2 2 1 MAN H4 H 9.103 -0.442 12.225 1.00 . B A . 101 MAN H4 1 1 19 9812 2 2 1 MAN H5 H 8.369 -0.538 9.279 1.00 . B A . 101 MAN H5 1 1 19 9813 2 2 1 MAN H61 H 9.430 1.565 10.128 1.00 . B A . 101 MAN H61 1 1 19 9814 2 2 1 MAN H62 H 10.310 0.741 8.814 1.00 . B A . 101 MAN H62 1 1 19 9815 2 2 1 MAN HO2 H 9.972 -2.213 12.426 1.00 . B A . 101 MAN HO2 1 1 19 9816 2 2 1 MAN HO3 H 7.627 -1.724 13.468 1.00 . B A . 101 MAN HO3 1 1 19 9817 2 2 1 MAN HO4 H 6.863 0.511 10.739 1.00 . B A . 101 MAN HO4 1 1 19 9818 2 2 1 MAN HO6 H 11.413 -0.326 10.788 1.00 . B A . 101 MAN HO6 1 1 19 9819 2 2 1 MAN O2 O 9.410 -2.994 12.491 1.00 . B A . 101 MAN O2 1 1 19 9820 2 2 1 MAN O3 O 6.927 -1.806 12.808 1.00 . B A . 101 MAN O3 1 1 19 9821 2 2 1 MAN O4 O 7.497 0.599 11.459 1.00 . B A . 101 MAN O4 1 1 19 9822 2 2 1 MAN O5 O 9.978 -1.718 9.998 1.00 . B A . 101 MAN O5 1 1 19 9823 2 2 1 MAN O6 O 11.178 0.610 10.720 1.00 . B A . 101 MAN O6 1 1 20 9824 1 1 1 THR C C -4.988 -6.004 4.449 1.00 . A A . 1 THR C 1 1 20 9825 1 1 1 THR CA C -5.237 -7.447 4.044 1.00 . A A . 1 THR CA 1 1 20 9826 1 1 1 THR CB C -6.556 -7.541 3.283 1.00 . A A . 1 THR CB 1 1 20 9827 1 1 1 THR CG2 C -6.681 -8.880 2.568 1.00 . A A . 1 THR CG2 1 1 20 9828 1 1 1 THR H1 H -6.148 -7.958 5.765 1.00 . A A . 1 THR H1 1 1 20 9829 1 1 1 THR H2 H -4.480 -8.107 5.824 1.00 . A A . 1 THR H2 1 1 20 9830 1 1 1 THR H3 H -5.405 -9.280 5.008 1.00 . A A . 1 THR H3 1 1 20 9831 1 1 1 THR HA H -4.435 -7.796 3.410 1.00 . A A . 1 THR HA 1 1 20 9832 1 1 1 THR HB H -6.600 -6.739 2.561 1.00 . A A . 1 THR HB 1 1 20 9833 1 1 1 THR HG1 H -8.458 -7.555 3.767 1.00 . A A . 1 THR HG1 1 1 20 9834 1 1 1 THR HG21 H -5.874 -8.988 1.857 1.00 . A A . 1 THR HG21 1 1 20 9835 1 1 1 THR HG22 H -7.627 -8.928 2.049 1.00 . A A . 1 THR HG22 1 1 20 9836 1 1 1 THR HG23 H -6.629 -9.679 3.292 1.00 . A A . 1 THR HG23 1 1 20 9837 1 1 1 THR N N -5.313 -8.270 5.229 1.00 . A A . 1 THR N 1 1 20 9838 1 1 1 THR O O -5.037 -5.680 5.635 1.00 . A A . 1 THR O 1 1 20 9839 1 1 1 THR OG1 O -7.624 -7.383 4.224 1.00 . A A . 1 THR OG1 1 1 20 9840 1 1 2 GLN C C -5.633 -2.955 3.186 1.00 . A A . 2 GLN C 1 1 20 9841 1 1 2 GLN CA C -4.459 -3.770 3.777 1.00 . A A . 2 GLN CA 1 1 20 9842 1 1 2 GLN CB C -3.116 -3.350 3.161 1.00 . A A . 2 GLN CB 1 1 20 9843 1 1 2 GLN CD C -3.118 -1.128 4.343 1.00 . A A . 2 GLN CD 1 1 20 9844 1 1 2 GLN CG C -2.322 -2.339 3.989 1.00 . A A . 2 GLN CG 1 1 20 9845 1 1 2 GLN H H -4.596 -5.475 2.575 1.00 . A A . 2 GLN H 1 1 20 9846 1 1 2 GLN HA H -4.430 -3.633 4.847 1.00 . A A . 2 GLN HA 1 1 20 9847 1 1 2 GLN HB2 H -2.507 -4.232 3.032 1.00 . A A . 2 GLN HB2 1 1 20 9848 1 1 2 GLN HB3 H -3.307 -2.915 2.192 1.00 . A A . 2 GLN HB3 1 1 20 9849 1 1 2 GLN HE21 H -2.660 -0.333 2.634 1.00 . A A . 2 GLN HE21 1 1 20 9850 1 1 2 GLN HE22 H -3.692 0.596 3.664 1.00 . A A . 2 GLN HE22 1 1 20 9851 1 1 2 GLN HG2 H -2.007 -2.801 4.912 1.00 . A A . 2 GLN HG2 1 1 20 9852 1 1 2 GLN HG3 H -1.454 -2.030 3.428 1.00 . A A . 2 GLN HG3 1 1 20 9853 1 1 2 GLN N N -4.690 -5.157 3.500 1.00 . A A . 2 GLN N 1 1 20 9854 1 1 2 GLN NE2 N -3.154 -0.197 3.470 1.00 . A A . 2 GLN NE2 1 1 20 9855 1 1 2 GLN O O -6.135 -3.278 2.097 1.00 . A A . 2 GLN O 1 1 20 9856 1 1 2 GLN OE1 O -3.757 -1.071 5.390 1.00 . A A . 2 GLN OE1 1 1 20 9857 1 1 3 SER C C -6.869 -0.126 2.374 1.00 . A A . 3 SER C 1 1 20 9858 1 1 3 SER CA C -7.192 -1.112 3.523 1.00 . A A . 3 SER CA 1 1 20 9859 1 1 3 SER CB C -7.675 -0.343 4.748 1.00 . A A . 3 SER CB 1 1 20 9860 1 1 3 SER H H -5.569 -1.688 4.715 1.00 . A A . 3 SER H 1 1 20 9861 1 1 3 SER HA H -7.986 -1.770 3.208 1.00 . A A . 3 SER HA 1 1 20 9862 1 1 3 SER HB2 H -6.892 0.327 5.073 1.00 . A A . 3 SER HB2 1 1 20 9863 1 1 3 SER HB3 H -8.558 0.224 4.493 1.00 . A A . 3 SER HB3 1 1 20 9864 1 1 3 SER HG H -8.388 -0.674 6.509 1.00 . A A . 3 SER HG 1 1 20 9865 1 1 3 SER N N -6.054 -1.932 3.897 1.00 . A A . 3 SER N 1 1 20 9866 1 1 3 SER O O -5.701 0.227 2.121 1.00 . A A . 3 SER O 1 1 20 9867 1 1 3 SER OG O -7.981 -1.218 5.823 1.00 . A A . 3 SER OG 1 1 20 9868 1 1 4 HIS C C -7.267 2.593 1.085 1.00 . A A . 4 HIS C 1 1 20 9869 1 1 4 HIS CA C -7.819 1.243 0.582 1.00 . A A . 4 HIS CA 1 1 20 9870 1 1 4 HIS CB C -9.228 1.423 -0.025 1.00 . A A . 4 HIS CB 1 1 20 9871 1 1 4 HIS CD2 C -8.340 2.076 -2.367 1.00 . A A . 4 HIS CD2 1 1 20 9872 1 1 4 HIS CE1 C -10.193 2.824 -3.223 1.00 . A A . 4 HIS CE1 1 1 20 9873 1 1 4 HIS CG C -9.277 2.004 -1.408 1.00 . A A . 4 HIS CG 1 1 20 9874 1 1 4 HIS H H -8.808 -0.018 1.945 1.00 . A A . 4 HIS H 1 1 20 9875 1 1 4 HIS HA H -7.159 0.830 -0.166 1.00 . A A . 4 HIS HA 1 1 20 9876 1 1 4 HIS HB2 H -9.709 0.458 -0.077 1.00 . A A . 4 HIS HB2 1 1 20 9877 1 1 4 HIS HB3 H -9.805 2.063 0.627 1.00 . A A . 4 HIS HB3 1 1 20 9878 1 1 4 HIS HD1 H -11.295 2.589 -1.521 1.00 . A A . 4 HIS HD1 1 1 20 9879 1 1 4 HIS HD2 H -7.304 1.783 -2.269 1.00 . A A . 4 HIS HD2 1 1 20 9880 1 1 4 HIS HE1 H -10.914 3.230 -3.916 1.00 . A A . 4 HIS HE1 1 1 20 9881 1 1 4 HIS HE2 H -8.657 2.207 -4.363 1.00 . A A . 4 HIS HE2 1 1 20 9882 1 1 4 HIS N N -7.915 0.310 1.694 1.00 . A A . 4 HIS N 1 1 20 9883 1 1 4 HIS ND1 N -10.426 2.489 -1.973 1.00 . A A . 4 HIS ND1 1 1 20 9884 1 1 4 HIS NE2 N -8.926 2.581 -3.486 1.00 . A A . 4 HIS NE2 1 1 20 9885 1 1 4 HIS O O -7.673 3.069 2.136 1.00 . A A . 4 HIS O 1 1 20 9886 1 1 5 TYR C C -4.707 4.403 1.847 1.00 . A A . 5 TYR C 1 1 20 9887 1 1 5 TYR CA C -5.662 4.460 0.655 1.00 . A A . 5 TYR CA 1 1 20 9888 1 1 5 TYR CB C -6.658 5.627 0.773 1.00 . A A . 5 TYR CB 1 1 20 9889 1 1 5 TYR CD1 C -6.646 7.016 -1.326 1.00 . A A . 5 TYR CD1 1 1 20 9890 1 1 5 TYR CD2 C -8.435 5.488 -1.008 1.00 . A A . 5 TYR CD2 1 1 20 9891 1 1 5 TYR CE1 C -7.184 7.405 -2.534 1.00 . A A . 5 TYR CE1 1 1 20 9892 1 1 5 TYR CE2 C -8.981 5.874 -2.214 1.00 . A A . 5 TYR CE2 1 1 20 9893 1 1 5 TYR CG C -7.262 6.051 -0.543 1.00 . A A . 5 TYR CG 1 1 20 9894 1 1 5 TYR CZ C -8.352 6.829 -2.972 1.00 . A A . 5 TYR CZ 1 1 20 9895 1 1 5 TYR H H -5.989 2.698 -0.467 1.00 . A A . 5 TYR H 1 1 20 9896 1 1 5 TYR HA H -5.030 4.651 -0.202 1.00 . A A . 5 TYR HA 1 1 20 9897 1 1 5 TYR HB2 H -7.465 5.323 1.418 1.00 . A A . 5 TYR HB2 1 1 20 9898 1 1 5 TYR HB3 H -6.156 6.479 1.206 1.00 . A A . 5 TYR HB3 1 1 20 9899 1 1 5 TYR HD1 H -5.728 7.465 -0.976 1.00 . A A . 5 TYR HD1 1 1 20 9900 1 1 5 TYR HD2 H -8.928 4.735 -0.411 1.00 . A A . 5 TYR HD2 1 1 20 9901 1 1 5 TYR HE1 H -6.691 8.158 -3.130 1.00 . A A . 5 TYR HE1 1 1 20 9902 1 1 5 TYR HE2 H -9.898 5.423 -2.561 1.00 . A A . 5 TYR HE2 1 1 20 9903 1 1 5 TYR HH H -9.846 7.144 -4.153 1.00 . A A . 5 TYR HH 1 1 20 9904 1 1 5 TYR N N -6.308 3.161 0.339 1.00 . A A . 5 TYR N 1 1 20 9905 1 1 5 TYR O O -4.335 5.437 2.403 1.00 . A A . 5 TYR O 1 1 20 9906 1 1 5 TYR OH O -8.880 7.192 -4.181 1.00 . A A . 5 TYR OH 1 1 20 9907 1 1 6 GLY C C -1.988 2.561 2.614 1.00 . A A . 6 GLY C 1 1 20 9908 1 1 6 GLY CA C -3.273 3.074 3.222 1.00 . A A . 6 GLY CA 1 1 20 9909 1 1 6 GLY H H -4.650 2.417 1.769 1.00 . A A . 6 GLY H 1 1 20 9910 1 1 6 GLY HA2 H -3.094 4.037 3.679 1.00 . A A . 6 GLY HA2 1 1 20 9911 1 1 6 GLY HA3 H -3.609 2.375 3.974 1.00 . A A . 6 GLY HA3 1 1 20 9912 1 1 6 GLY N N -4.280 3.218 2.197 1.00 . A A . 6 GLY N 1 1 20 9913 1 1 6 GLY O O -1.998 2.117 1.447 1.00 . A A . 6 GLY O 1 1 20 9914 1 1 7 GLN C C 0.440 0.610 2.838 1.00 . A A . 7 GLN C 1 1 20 9915 1 1 7 GLN CA C 0.382 2.142 2.869 1.00 . A A . 7 GLN CA 1 1 20 9916 1 1 7 GLN CB C 1.525 2.742 3.706 1.00 . A A . 7 GLN CB 1 1 20 9917 1 1 7 GLN CD C 4.020 3.108 4.024 1.00 . A A . 7 GLN CD 1 1 20 9918 1 1 7 GLN CG C 2.936 2.445 3.183 1.00 . A A . 7 GLN CG 1 1 20 9919 1 1 7 GLN H H -0.991 2.857 4.311 1.00 . A A . 7 GLN H 1 1 20 9920 1 1 7 GLN HA H 0.459 2.497 1.852 1.00 . A A . 7 GLN HA 1 1 20 9921 1 1 7 GLN HB2 H 1.401 3.814 3.742 1.00 . A A . 7 GLN HB2 1 1 20 9922 1 1 7 GLN HB3 H 1.454 2.355 4.712 1.00 . A A . 7 GLN HB3 1 1 20 9923 1 1 7 GLN HE21 H 5.322 3.223 2.481 1.00 . A A . 7 GLN HE21 1 1 20 9924 1 1 7 GLN HE22 H 5.838 3.825 3.991 1.00 . A A . 7 GLN HE22 1 1 20 9925 1 1 7 GLN HG2 H 3.095 1.377 3.199 1.00 . A A . 7 GLN HG2 1 1 20 9926 1 1 7 GLN HG3 H 3.014 2.806 2.168 1.00 . A A . 7 GLN HG3 1 1 20 9927 1 1 7 GLN N N -0.910 2.578 3.371 1.00 . A A . 7 GLN N 1 1 20 9928 1 1 7 GLN NE2 N 5.151 3.406 3.430 1.00 . A A . 7 GLN NE2 1 1 20 9929 1 1 7 GLN O O 0.256 -0.045 3.854 1.00 . A A . 7 GLN O 1 1 20 9930 1 1 7 GLN OE1 O 3.846 3.323 5.211 1.00 . A A . 7 GLN OE1 1 1 20 9931 1 1 8 CYS C C 2.041 -2.004 1.426 1.00 . A A . 8 CYS C 1 1 20 9932 1 1 8 CYS CA C 0.661 -1.383 1.438 1.00 . A A . 8 CYS CA 1 1 20 9933 1 1 8 CYS CB C -0.011 -1.660 0.124 1.00 . A A . 8 CYS CB 1 1 20 9934 1 1 8 CYS H H 0.871 0.660 0.902 1.00 . A A . 8 CYS H 1 1 20 9935 1 1 8 CYS HA H 0.078 -1.854 2.214 1.00 . A A . 8 CYS HA 1 1 20 9936 1 1 8 CYS HB2 H 0.036 -2.719 -0.084 1.00 . A A . 8 CYS HB2 1 1 20 9937 1 1 8 CYS HB3 H -1.043 -1.349 0.179 1.00 . A A . 8 CYS HB3 1 1 20 9938 1 1 8 CYS N N 0.685 0.067 1.664 1.00 . A A . 8 CYS N 1 1 20 9939 1 1 8 CYS O O 2.207 -3.168 1.068 1.00 . A A . 8 CYS O 1 1 20 9940 1 1 8 CYS SG S 0.759 -0.780 -1.265 1.00 . A A . 8 CYS SG 1 1 20 9941 1 1 9 GLY C C 5.296 -1.214 0.892 1.00 . A A . 9 GLY C 1 1 20 9942 1 1 9 GLY CA C 4.328 -1.825 1.835 1.00 . A A . 9 GLY CA 1 1 20 9943 1 1 9 GLY H H 2.865 -0.297 1.928 1.00 . A A . 9 GLY H 1 1 20 9944 1 1 9 GLY HA2 H 4.699 -1.700 2.839 1.00 . A A . 9 GLY HA2 1 1 20 9945 1 1 9 GLY HA3 H 4.247 -2.880 1.622 1.00 . A A . 9 GLY HA3 1 1 20 9946 1 1 9 GLY N N 3.031 -1.245 1.759 1.00 . A A . 9 GLY N 1 1 20 9947 1 1 9 GLY O O 5.379 -1.600 -0.277 1.00 . A A . 9 GLY O 1 1 20 9948 1 1 10 GLY C C 8.302 0.037 1.390 1.00 . A A . 10 GLY C 1 1 20 9949 1 1 10 GLY CA C 7.043 0.371 0.661 1.00 . A A . 10 GLY CA 1 1 20 9950 1 1 10 GLY H H 5.766 0.106 2.273 1.00 . A A . 10 GLY H 1 1 20 9951 1 1 10 GLY HA2 H 7.072 -0.027 -0.343 1.00 . A A . 10 GLY HA2 1 1 20 9952 1 1 10 GLY HA3 H 6.924 1.443 0.635 1.00 . A A . 10 GLY HA3 1 1 20 9953 1 1 10 GLY N N 5.965 -0.222 1.374 1.00 . A A . 10 GLY N 1 1 20 9954 1 1 10 GLY O O 8.260 -0.773 2.333 1.00 . A A . 10 GLY O 1 1 20 9955 1 1 11 ILE C C 10.546 0.850 3.145 1.00 . A A . 11 ILE C 1 1 20 9956 1 1 11 ILE CA C 10.660 0.401 1.677 1.00 . A A . 11 ILE CA 1 1 20 9957 1 1 11 ILE CB C 11.814 1.181 0.990 1.00 . A A . 11 ILE CB 1 1 20 9958 1 1 11 ILE CD1 C 12.847 1.719 -1.292 1.00 . A A . 11 ILE CD1 1 1 20 9959 1 1 11 ILE CG1 C 11.821 0.909 -0.523 1.00 . A A . 11 ILE CG1 1 1 20 9960 1 1 11 ILE CG2 C 13.161 0.788 1.608 1.00 . A A . 11 ILE CG2 1 1 20 9961 1 1 11 ILE H H 9.350 1.260 0.255 1.00 . A A . 11 ILE H 1 1 20 9962 1 1 11 ILE HA H 10.869 -0.658 1.639 1.00 . A A . 11 ILE HA 1 1 20 9963 1 1 11 ILE HB H 11.664 2.237 1.156 1.00 . A A . 11 ILE HB 1 1 20 9964 1 1 11 ILE HD11 H 13.834 1.484 -0.923 1.00 . A A . 11 ILE HD11 1 1 20 9965 1 1 11 ILE HD12 H 12.652 2.773 -1.154 1.00 . A A . 11 ILE HD12 1 1 20 9966 1 1 11 ILE HD13 H 12.786 1.475 -2.342 1.00 . A A . 11 ILE HD13 1 1 20 9967 1 1 11 ILE HG12 H 12.021 -0.137 -0.698 1.00 . A A . 11 ILE HG12 1 1 20 9968 1 1 11 ILE HG13 H 10.845 1.146 -0.920 1.00 . A A . 11 ILE HG13 1 1 20 9969 1 1 11 ILE HG21 H 13.324 -0.272 1.472 1.00 . A A . 11 ILE HG21 1 1 20 9970 1 1 11 ILE HG22 H 13.153 1.018 2.663 1.00 . A A . 11 ILE HG22 1 1 20 9971 1 1 11 ILE HG23 H 13.955 1.339 1.125 1.00 . A A . 11 ILE HG23 1 1 20 9972 1 1 11 ILE N N 9.393 0.638 1.010 1.00 . A A . 11 ILE N 1 1 20 9973 1 1 11 ILE O O 10.131 1.970 3.422 1.00 . A A . 11 ILE O 1 1 20 9974 1 1 12 GLY C C 9.508 -0.188 6.132 1.00 . A A . 12 GLY C 1 1 20 9975 1 1 12 GLY CA C 10.780 0.280 5.466 1.00 . A A . 12 GLY CA 1 1 20 9976 1 1 12 GLY H H 11.045 -0.962 3.775 1.00 . A A . 12 GLY H 1 1 20 9977 1 1 12 GLY HA2 H 11.620 -0.181 5.961 1.00 . A A . 12 GLY HA2 1 1 20 9978 1 1 12 GLY HA3 H 10.855 1.354 5.575 1.00 . A A . 12 GLY HA3 1 1 20 9979 1 1 12 GLY N N 10.820 -0.049 4.057 1.00 . A A . 12 GLY N 1 1 20 9980 1 1 12 GLY O O 9.495 -0.455 7.340 1.00 . A A . 12 GLY O 1 1 20 9981 1 1 13 TYR C C 7.176 -2.243 6.022 1.00 . A A . 13 TYR C 1 1 20 9982 1 1 13 TYR CA C 7.165 -0.739 5.865 1.00 . A A . 13 TYR CA 1 1 20 9983 1 1 13 TYR CB C 6.030 -0.292 4.925 1.00 . A A . 13 TYR CB 1 1 20 9984 1 1 13 TYR CD1 C 3.828 0.304 6.013 1.00 . A A . 13 TYR CD1 1 1 20 9985 1 1 13 TYR CD2 C 4.058 -1.907 5.176 1.00 . A A . 13 TYR CD2 1 1 20 9986 1 1 13 TYR CE1 C 2.546 0.024 6.415 1.00 . A A . 13 TYR CE1 1 1 20 9987 1 1 13 TYR CE2 C 2.773 -2.200 5.581 1.00 . A A . 13 TYR CE2 1 1 20 9988 1 1 13 TYR CG C 4.612 -0.643 5.387 1.00 . A A . 13 TYR CG 1 1 20 9989 1 1 13 TYR CZ C 2.020 -1.224 6.197 1.00 . A A . 13 TYR CZ 1 1 20 9990 1 1 13 TYR H H 8.559 -0.130 4.397 1.00 . A A . 13 TYR H 1 1 20 9991 1 1 13 TYR HA H 7.025 -0.282 6.832 1.00 . A A . 13 TYR HA 1 1 20 9992 1 1 13 TYR HB2 H 6.076 0.784 4.847 1.00 . A A . 13 TYR HB2 1 1 20 9993 1 1 13 TYR HB3 H 6.185 -0.701 3.940 1.00 . A A . 13 TYR HB3 1 1 20 9994 1 1 13 TYR HD1 H 4.239 1.287 6.184 1.00 . A A . 13 TYR HD1 1 1 20 9995 1 1 13 TYR HD2 H 4.653 -2.670 4.696 1.00 . A A . 13 TYR HD2 1 1 20 9996 1 1 13 TYR HE1 H 1.958 0.788 6.902 1.00 . A A . 13 TYR HE1 1 1 20 9997 1 1 13 TYR HE2 H 2.370 -3.186 5.403 1.00 . A A . 13 TYR HE2 1 1 20 9998 1 1 13 TYR HH H 0.153 -0.880 6.123 1.00 . A A . 13 TYR HH 1 1 20 9999 1 1 13 TYR N N 8.450 -0.310 5.353 1.00 . A A . 13 TYR N 1 1 20 10000 1 1 13 TYR O O 7.556 -2.965 5.099 1.00 . A A . 13 TYR O 1 1 20 10001 1 1 13 TYR OH O 0.729 -1.493 6.600 1.00 . A A . 13 TYR OH 1 1 20 10002 1 1 14 SER C C 5.418 -4.501 8.016 1.00 . A A . 14 SER C 1 1 20 10003 1 1 14 SER CA C 6.791 -4.104 7.478 1.00 . A A . 14 SER CA 1 1 20 10004 1 1 14 SER CB C 7.854 -4.350 8.541 1.00 . A A . 14 SER CB 1 1 20 10005 1 1 14 SER H H 6.502 -2.078 7.879 1.00 . A A . 14 SER H 1 1 20 10006 1 1 14 SER HA H 7.038 -4.668 6.590 1.00 . A A . 14 SER HA 1 1 20 10007 1 1 14 SER HB2 H 7.457 -4.055 9.501 1.00 . A A . 14 SER HB2 1 1 20 10008 1 1 14 SER HB3 H 8.123 -5.396 8.556 1.00 . A A . 14 SER HB3 1 1 20 10009 1 1 14 SER N N 6.783 -2.700 7.175 1.00 . A A . 14 SER N 1 1 20 10010 1 1 14 SER O O 5.106 -4.242 9.192 1.00 . A A . 14 SER O 1 1 20 10011 1 1 14 SER OG O 9.033 -3.561 8.247 1.00 . A A . 14 SER OG 1 1 20 10012 1 1 15 GLY C C 2.420 -5.980 6.451 1.00 . A A . 15 GLY C 1 1 20 10013 1 1 15 GLY CA C 3.263 -5.443 7.593 1.00 . A A . 15 GLY CA 1 1 20 10014 1 1 15 GLY H H 4.854 -5.223 6.238 1.00 . A A . 15 GLY H 1 1 20 10015 1 1 15 GLY HA2 H 3.351 -6.201 8.357 1.00 . A A . 15 GLY HA2 1 1 20 10016 1 1 15 GLY HA3 H 2.777 -4.574 8.011 1.00 . A A . 15 GLY HA3 1 1 20 10017 1 1 15 GLY N N 4.583 -5.060 7.169 1.00 . A A . 15 GLY N 1 1 20 10018 1 1 15 GLY O O 2.918 -6.763 5.637 1.00 . A A . 15 GLY O 1 1 20 10019 1 1 16 PRO C C 0.612 -5.490 3.947 1.00 . A A . 16 PRO C 1 1 20 10020 1 1 16 PRO CA C 0.236 -6.041 5.310 1.00 . A A . 16 PRO CA 1 1 20 10021 1 1 16 PRO CB C -1.138 -5.502 5.721 1.00 . A A . 16 PRO CB 1 1 20 10022 1 1 16 PRO CD C 0.472 -4.635 7.262 1.00 . A A . 16 PRO CD 1 1 20 10023 1 1 16 PRO CG C -0.973 -4.984 7.107 1.00 . A A . 16 PRO CG 1 1 20 10024 1 1 16 PRO HA H 0.208 -7.119 5.268 1.00 . A A . 16 PRO HA 1 1 20 10025 1 1 16 PRO HB2 H -1.420 -4.720 5.034 1.00 . A A . 16 PRO HB2 1 1 20 10026 1 1 16 PRO HB3 H -1.867 -6.296 5.674 1.00 . A A . 16 PRO HB3 1 1 20 10027 1 1 16 PRO HD2 H 0.653 -3.614 6.964 1.00 . A A . 16 PRO HD2 1 1 20 10028 1 1 16 PRO HD3 H 0.780 -4.801 8.283 1.00 . A A . 16 PRO HD3 1 1 20 10029 1 1 16 PRO HG2 H -1.585 -4.104 7.246 1.00 . A A . 16 PRO HG2 1 1 20 10030 1 1 16 PRO HG3 H -1.253 -5.749 7.814 1.00 . A A . 16 PRO HG3 1 1 20 10031 1 1 16 PRO N N 1.139 -5.578 6.360 1.00 . A A . 16 PRO N 1 1 20 10032 1 1 16 PRO O O 0.653 -4.275 3.743 1.00 . A A . 16 PRO O 1 1 20 10033 1 1 17 THR C C 0.207 -6.305 0.673 1.00 . A A . 17 THR C 1 1 20 10034 1 1 17 THR CA C 1.282 -5.982 1.714 1.00 . A A . 17 THR CA 1 1 20 10035 1 1 17 THR CB C 2.612 -6.648 1.355 1.00 . A A . 17 THR CB 1 1 20 10036 1 1 17 THR CG2 C 3.748 -6.031 2.147 1.00 . A A . 17 THR CG2 1 1 20 10037 1 1 17 THR H H 0.846 -7.329 3.239 1.00 . A A . 17 THR H 1 1 20 10038 1 1 17 THR HA H 1.437 -4.913 1.726 1.00 . A A . 17 THR HA 1 1 20 10039 1 1 17 THR HB H 2.789 -6.495 0.300 1.00 . A A . 17 THR HB 1 1 20 10040 1 1 17 THR HG1 H 2.693 -8.506 0.792 1.00 . A A . 17 THR HG1 1 1 20 10041 1 1 17 THR HG21 H 3.819 -4.979 1.910 1.00 . A A . 17 THR HG21 1 1 20 10042 1 1 17 THR HG22 H 4.678 -6.524 1.902 1.00 . A A . 17 THR HG22 1 1 20 10043 1 1 17 THR HG23 H 3.546 -6.142 3.202 1.00 . A A . 17 THR HG23 1 1 20 10044 1 1 17 THR N N 0.885 -6.373 3.031 1.00 . A A . 17 THR N 1 1 20 10045 1 1 17 THR O O 0.209 -5.764 -0.443 1.00 . A A . 17 THR O 1 1 20 10046 1 1 17 THR OG1 O 2.541 -8.069 1.641 1.00 . A A . 17 THR OG1 1 1 20 10047 1 1 18 VAL C C -3.008 -6.724 0.493 1.00 . A A . 18 VAL C 1 1 20 10048 1 1 18 VAL CA C -1.790 -7.560 0.158 1.00 . A A . 18 VAL CA 1 1 20 10049 1 1 18 VAL CB C -2.137 -9.074 0.295 1.00 . A A . 18 VAL CB 1 1 20 10050 1 1 18 VAL CG1 C -3.242 -9.476 -0.679 1.00 . A A . 18 VAL CG1 1 1 20 10051 1 1 18 VAL CG2 C -0.900 -9.936 0.078 1.00 . A A . 18 VAL CG2 1 1 20 10052 1 1 18 VAL H H -0.700 -7.540 1.948 1.00 . A A . 18 VAL H 1 1 20 10053 1 1 18 VAL HA H -1.484 -7.353 -0.857 1.00 . A A . 18 VAL HA 1 1 20 10054 1 1 18 VAL HB H -2.501 -9.244 1.299 1.00 . A A . 18 VAL HB 1 1 20 10055 1 1 18 VAL HG11 H -4.133 -8.900 -0.475 1.00 . A A . 18 VAL HG11 1 1 20 10056 1 1 18 VAL HG12 H -3.456 -10.529 -0.568 1.00 . A A . 18 VAL HG12 1 1 20 10057 1 1 18 VAL HG13 H -2.914 -9.283 -1.690 1.00 . A A . 18 VAL HG13 1 1 20 10058 1 1 18 VAL HG21 H -1.166 -10.978 0.177 1.00 . A A . 18 VAL HG21 1 1 20 10059 1 1 18 VAL HG22 H -0.151 -9.684 0.813 1.00 . A A . 18 VAL HG22 1 1 20 10060 1 1 18 VAL HG23 H -0.504 -9.759 -0.912 1.00 . A A . 18 VAL HG23 1 1 20 10061 1 1 18 VAL N N -0.717 -7.171 1.040 1.00 . A A . 18 VAL N 1 1 20 10062 1 1 18 VAL O O -3.560 -6.828 1.590 1.00 . A A . 18 VAL O 1 1 20 10063 1 1 19 CYS C C -5.844 -5.748 -0.359 1.00 . A A . 19 CYS C 1 1 20 10064 1 1 19 CYS CA C -4.521 -5.001 -0.208 1.00 . A A . 19 CYS CA 1 1 20 10065 1 1 19 CYS CB C -4.433 -3.839 -1.181 1.00 . A A . 19 CYS CB 1 1 20 10066 1 1 19 CYS H H -2.929 -5.837 -1.274 1.00 . A A . 19 CYS H 1 1 20 10067 1 1 19 CYS HA H -4.453 -4.613 0.798 1.00 . A A . 19 CYS HA 1 1 20 10068 1 1 19 CYS HB2 H -4.550 -4.204 -2.191 1.00 . A A . 19 CYS HB2 1 1 20 10069 1 1 19 CYS HB3 H -5.225 -3.137 -0.965 1.00 . A A . 19 CYS HB3 1 1 20 10070 1 1 19 CYS N N -3.400 -5.884 -0.413 1.00 . A A . 19 CYS N 1 1 20 10071 1 1 19 CYS O O -5.870 -6.904 -0.813 1.00 . A A . 19 CYS O 1 1 20 10072 1 1 19 CYS SG S -2.858 -2.937 -1.078 1.00 . A A . 19 CYS SG 1 1 20 10073 1 1 20 ALA C C -8.652 -5.936 -1.495 1.00 . A A . 20 ALA C 1 1 20 10074 1 1 20 ALA CA C -8.263 -5.673 -0.035 1.00 . A A . 20 ALA CA 1 1 20 10075 1 1 20 ALA CB C -9.265 -4.735 0.624 1.00 . A A . 20 ALA CB 1 1 20 10076 1 1 20 ALA H H -6.818 -4.220 0.461 1.00 . A A . 20 ALA H 1 1 20 10077 1 1 20 ALA HA H -8.267 -6.609 0.503 1.00 . A A . 20 ALA HA 1 1 20 10078 1 1 20 ALA HB1 H -8.974 -4.559 1.649 1.00 . A A . 20 ALA HB1 1 1 20 10079 1 1 20 ALA HB2 H -10.247 -5.182 0.603 1.00 . A A . 20 ALA HB2 1 1 20 10080 1 1 20 ALA HB3 H -9.285 -3.796 0.091 1.00 . A A . 20 ALA HB3 1 1 20 10081 1 1 20 ALA N N -6.923 -5.111 0.058 1.00 . A A . 20 ALA N 1 1 20 10082 1 1 20 ALA O O -8.031 -5.392 -2.432 1.00 . A A . 20 ALA O 1 1 20 10083 1 1 21 SER C C -10.600 -5.873 -3.769 1.00 . A A . 21 SER C 1 1 20 10084 1 1 21 SER CA C -10.139 -7.116 -2.992 1.00 . A A . 21 SER CA 1 1 20 10085 1 1 21 SER CB C -11.281 -8.108 -2.822 1.00 . A A . 21 SER CB 1 1 20 10086 1 1 21 SER H H -10.132 -7.136 -0.916 1.00 . A A . 21 SER H 1 1 20 10087 1 1 21 SER HA H -9.336 -7.600 -3.527 1.00 . A A . 21 SER HA 1 1 20 10088 1 1 21 SER HB2 H -12.127 -7.607 -2.375 1.00 . A A . 21 SER HB2 1 1 20 10089 1 1 21 SER HB3 H -11.562 -8.510 -3.782 1.00 . A A . 21 SER HB3 1 1 20 10090 1 1 21 SER HG H -10.442 -9.833 -2.545 1.00 . A A . 21 SER HG 1 1 20 10091 1 1 21 SER N N -9.662 -6.748 -1.683 1.00 . A A . 21 SER N 1 1 20 10092 1 1 21 SER O O -11.440 -5.100 -3.293 1.00 . A A . 21 SER O 1 1 20 10093 1 1 21 SER OG O -10.871 -9.182 -1.977 1.00 . A A . 21 SER OG 1 1 20 10094 1 1 22 GLY C C -9.410 -3.382 -5.582 1.00 . A A . 22 GLY C 1 1 20 10095 1 1 22 GLY CA C -10.365 -4.537 -5.736 1.00 . A A . 22 GLY CA 1 1 20 10096 1 1 22 GLY H H -9.267 -6.247 -5.194 1.00 . A A . 22 GLY H 1 1 20 10097 1 1 22 GLY HA2 H -10.374 -4.850 -6.770 1.00 . A A . 22 GLY HA2 1 1 20 10098 1 1 22 GLY HA3 H -11.356 -4.214 -5.456 1.00 . A A . 22 GLY HA3 1 1 20 10099 1 1 22 GLY N N -9.996 -5.652 -4.910 1.00 . A A . 22 GLY N 1 1 20 10100 1 1 22 GLY O O -9.539 -2.364 -6.263 1.00 . A A . 22 GLY O 1 1 20 10101 1 1 23 THR C C -6.092 -3.042 -4.786 1.00 . A A . 23 THR C 1 1 20 10102 1 1 23 THR CA C -7.473 -2.480 -4.484 1.00 . A A . 23 THR CA 1 1 20 10103 1 1 23 THR CB C -7.545 -1.877 -3.043 1.00 . A A . 23 THR CB 1 1 20 10104 1 1 23 THR CG2 C -8.928 -1.315 -2.774 1.00 . A A . 23 THR CG2 1 1 20 10105 1 1 23 THR H H -8.394 -4.346 -4.161 1.00 . A A . 23 THR H 1 1 20 10106 1 1 23 THR HA H -7.684 -1.705 -5.206 1.00 . A A . 23 THR HA 1 1 20 10107 1 1 23 THR HB H -6.826 -1.075 -2.950 1.00 . A A . 23 THR HB 1 1 20 10108 1 1 23 THR HG1 H -7.509 -3.744 -2.383 1.00 . A A . 23 THR HG1 1 1 20 10109 1 1 23 THR HG21 H -9.145 -0.535 -3.489 1.00 . A A . 23 THR HG21 1 1 20 10110 1 1 23 THR HG22 H -8.962 -0.905 -1.776 1.00 . A A . 23 THR HG22 1 1 20 10111 1 1 23 THR HG23 H -9.663 -2.101 -2.871 1.00 . A A . 23 THR HG23 1 1 20 10112 1 1 23 THR N N -8.455 -3.518 -4.686 1.00 . A A . 23 THR N 1 1 20 10113 1 1 23 THR O O -5.828 -4.218 -4.507 1.00 . A A . 23 THR O 1 1 20 10114 1 1 23 THR OG1 O -7.265 -2.867 -2.053 1.00 . A A . 23 THR OG1 1 1 20 10115 1 1 24 THR C C -2.839 -1.911 -5.058 1.00 . A A . 24 THR C 1 1 20 10116 1 1 24 THR CA C -3.928 -2.695 -5.772 1.00 . A A . 24 THR CA 1 1 20 10117 1 1 24 THR CB C -3.744 -2.596 -7.307 1.00 . A A . 24 THR CB 1 1 20 10118 1 1 24 THR CG2 C -4.546 -3.676 -8.015 1.00 . A A . 24 THR CG2 1 1 20 10119 1 1 24 THR H H -5.495 -1.312 -5.574 1.00 . A A . 24 THR H 1 1 20 10120 1 1 24 THR HA H -3.844 -3.735 -5.493 1.00 . A A . 24 THR HA 1 1 20 10121 1 1 24 THR HB H -2.697 -2.736 -7.525 1.00 . A A . 24 THR HB 1 1 20 10122 1 1 24 THR HG1 H -4.807 -0.890 -7.210 1.00 . A A . 24 THR HG1 1 1 20 10123 1 1 24 THR HG21 H -4.413 -3.586 -9.083 1.00 . A A . 24 THR HG21 1 1 20 10124 1 1 24 THR HG22 H -5.593 -3.563 -7.773 1.00 . A A . 24 THR HG22 1 1 20 10125 1 1 24 THR HG23 H -4.204 -4.647 -7.693 1.00 . A A . 24 THR HG23 1 1 20 10126 1 1 24 THR N N -5.243 -2.247 -5.383 1.00 . A A . 24 THR N 1 1 20 10127 1 1 24 THR O O -2.980 -0.714 -4.829 1.00 . A A . 24 THR O 1 1 20 10128 1 1 24 THR OG1 O -4.139 -1.281 -7.798 1.00 . A A . 24 THR OG1 1 1 20 10129 1 1 25 CYS C C 0.235 -1.250 -5.037 1.00 . A A . 25 CYS C 1 1 20 10130 1 1 25 CYS CA C -0.665 -1.945 -4.021 1.00 . A A . 25 CYS CA 1 1 20 10131 1 1 25 CYS CB C 0.138 -2.971 -3.213 1.00 . A A . 25 CYS CB 1 1 20 10132 1 1 25 CYS H H -1.720 -3.540 -4.900 1.00 . A A . 25 CYS H 1 1 20 10133 1 1 25 CYS HA H -1.068 -1.203 -3.348 1.00 . A A . 25 CYS HA 1 1 20 10134 1 1 25 CYS HB2 H -0.506 -3.420 -2.471 1.00 . A A . 25 CYS HB2 1 1 20 10135 1 1 25 CYS HB3 H 0.497 -3.738 -3.882 1.00 . A A . 25 CYS HB3 1 1 20 10136 1 1 25 CYS N N -1.774 -2.582 -4.698 1.00 . A A . 25 CYS N 1 1 20 10137 1 1 25 CYS O O 1.056 -1.899 -5.712 1.00 . A A . 25 CYS O 1 1 20 10138 1 1 25 CYS SG S 1.577 -2.263 -2.351 1.00 . A A . 25 CYS SG 1 1 20 10139 1 1 26 GLN C C 1.855 1.641 -5.445 1.00 . A A . 26 GLN C 1 1 20 10140 1 1 26 GLN CA C 0.818 0.795 -6.154 1.00 . A A . 26 GLN CA 1 1 20 10141 1 1 26 GLN CB C -0.100 1.679 -7.000 1.00 . A A . 26 GLN CB 1 1 20 10142 1 1 26 GLN CD C -2.057 1.813 -8.595 1.00 . A A . 26 GLN CD 1 1 20 10143 1 1 26 GLN CG C -1.190 0.914 -7.740 1.00 . A A . 26 GLN CG 1 1 20 10144 1 1 26 GLN H H -0.603 0.511 -4.632 1.00 . A A . 26 GLN H 1 1 20 10145 1 1 26 GLN HA H 1.328 0.097 -6.801 1.00 . A A . 26 GLN HA 1 1 20 10146 1 1 26 GLN HB2 H -0.577 2.402 -6.355 1.00 . A A . 26 GLN HB2 1 1 20 10147 1 1 26 GLN HB3 H 0.499 2.204 -7.729 1.00 . A A . 26 GLN HB3 1 1 20 10148 1 1 26 GLN HE21 H -3.605 0.624 -8.312 1.00 . A A . 26 GLN HE21 1 1 20 10149 1 1 26 GLN HE22 H -3.903 2.010 -9.288 1.00 . A A . 26 GLN HE22 1 1 20 10150 1 1 26 GLN HG2 H -0.730 0.175 -8.378 1.00 . A A . 26 GLN HG2 1 1 20 10151 1 1 26 GLN HG3 H -1.817 0.416 -7.015 1.00 . A A . 26 GLN HG3 1 1 20 10152 1 1 26 GLN N N 0.054 0.038 -5.193 1.00 . A A . 26 GLN N 1 1 20 10153 1 1 26 GLN NE2 N -3.303 1.451 -8.749 1.00 . A A . 26 GLN NE2 1 1 20 10154 1 1 26 GLN O O 1.554 2.302 -4.446 1.00 . A A . 26 GLN O 1 1 20 10155 1 1 26 GLN OE1 O -1.601 2.842 -9.111 1.00 . A A . 26 GLN OE1 1 1 20 10156 1 1 27 VAL C C 4.000 3.820 -5.850 1.00 . A A . 27 VAL C 1 1 20 10157 1 1 27 VAL CA C 4.145 2.374 -5.385 1.00 . A A . 27 VAL CA 1 1 20 10158 1 1 27 VAL CB C 5.522 1.799 -5.819 1.00 . A A . 27 VAL CB 1 1 20 10159 1 1 27 VAL CG1 C 6.672 2.610 -5.236 1.00 . A A . 27 VAL CG1 1 1 20 10160 1 1 27 VAL CG2 C 5.639 0.339 -5.402 1.00 . A A . 27 VAL CG2 1 1 20 10161 1 1 27 VAL H H 3.244 1.034 -6.719 1.00 . A A . 27 VAL H 1 1 20 10162 1 1 27 VAL HA H 4.069 2.339 -4.307 1.00 . A A . 27 VAL HA 1 1 20 10163 1 1 27 VAL HB H 5.585 1.847 -6.896 1.00 . A A . 27 VAL HB 1 1 20 10164 1 1 27 VAL HG11 H 6.600 3.632 -5.580 1.00 . A A . 27 VAL HG11 1 1 20 10165 1 1 27 VAL HG12 H 7.613 2.186 -5.554 1.00 . A A . 27 VAL HG12 1 1 20 10166 1 1 27 VAL HG13 H 6.616 2.591 -4.158 1.00 . A A . 27 VAL HG13 1 1 20 10167 1 1 27 VAL HG21 H 4.853 -0.233 -5.874 1.00 . A A . 27 VAL HG21 1 1 20 10168 1 1 27 VAL HG22 H 5.542 0.265 -4.329 1.00 . A A . 27 VAL HG22 1 1 20 10169 1 1 27 VAL HG23 H 6.599 -0.049 -5.705 1.00 . A A . 27 VAL HG23 1 1 20 10170 1 1 27 VAL N N 3.062 1.599 -5.937 1.00 . A A . 27 VAL N 1 1 20 10171 1 1 27 VAL O O 4.055 4.103 -7.056 1.00 . A A . 27 VAL O 1 1 20 10172 1 1 28 LEU C C 4.863 6.871 -5.056 1.00 . A A . 28 LEU C 1 1 20 10173 1 1 28 LEU CA C 3.568 6.106 -5.238 1.00 . A A . 28 LEU CA 1 1 20 10174 1 1 28 LEU CB C 2.488 6.716 -4.327 1.00 . A A . 28 LEU CB 1 1 20 10175 1 1 28 LEU CD1 C 0.171 6.794 -3.413 1.00 . A A . 28 LEU CD1 1 1 20 10176 1 1 28 LEU CD2 C 0.539 6.007 -5.727 1.00 . A A . 28 LEU CD2 1 1 20 10177 1 1 28 LEU CG C 1.111 6.051 -4.334 1.00 . A A . 28 LEU CG 1 1 20 10178 1 1 28 LEU H H 3.771 4.418 -3.982 1.00 . A A . 28 LEU H 1 1 20 10179 1 1 28 LEU HA H 3.246 6.182 -6.265 1.00 . A A . 28 LEU HA 1 1 20 10180 1 1 28 LEU HB2 H 2.860 6.690 -3.314 1.00 . A A . 28 LEU HB2 1 1 20 10181 1 1 28 LEU HB3 H 2.360 7.750 -4.611 1.00 . A A . 28 LEU HB3 1 1 20 10182 1 1 28 LEU HD11 H 0.116 7.827 -3.720 1.00 . A A . 28 LEU HD11 1 1 20 10183 1 1 28 LEU HD12 H 0.528 6.734 -2.396 1.00 . A A . 28 LEU HD12 1 1 20 10184 1 1 28 LEU HD13 H -0.813 6.353 -3.475 1.00 . A A . 28 LEU HD13 1 1 20 10185 1 1 28 LEU HD21 H 0.464 7.014 -6.109 1.00 . A A . 28 LEU HD21 1 1 20 10186 1 1 28 LEU HD22 H -0.440 5.553 -5.686 1.00 . A A . 28 LEU HD22 1 1 20 10187 1 1 28 LEU HD23 H 1.186 5.418 -6.360 1.00 . A A . 28 LEU HD23 1 1 20 10188 1 1 28 LEU HG H 1.204 5.039 -3.968 1.00 . A A . 28 LEU HG 1 1 20 10189 1 1 28 LEU N N 3.776 4.710 -4.920 1.00 . A A . 28 LEU N 1 1 20 10190 1 1 28 LEU O O 5.368 7.511 -5.977 1.00 . A A . 28 LEU O 1 1 20 10191 1 1 29 ASN C C 7.678 6.385 -3.333 1.00 . A A . 29 ASN C 1 1 20 10192 1 1 29 ASN CA C 6.621 7.470 -3.496 1.00 . A A . 29 ASN CA 1 1 20 10193 1 1 29 ASN CB C 6.457 8.221 -2.135 1.00 . A A . 29 ASN CB 1 1 20 10194 1 1 29 ASN CG C 5.335 9.266 -2.019 1.00 . A A . 29 ASN CG 1 1 20 10195 1 1 29 ASN H H 5.022 6.138 -3.223 1.00 . A A . 29 ASN H 1 1 20 10196 1 1 29 ASN HA H 6.899 8.157 -4.281 1.00 . A A . 29 ASN HA 1 1 20 10197 1 1 29 ASN HB2 H 6.297 7.491 -1.358 1.00 . A A . 29 ASN HB2 1 1 20 10198 1 1 29 ASN HB3 H 7.393 8.718 -1.925 1.00 . A A . 29 ASN HB3 1 1 20 10199 1 1 29 ASN HD21 H 4.151 8.238 -3.194 1.00 . A A . 29 ASN HD21 1 1 20 10200 1 1 29 ASN HD22 H 3.467 9.671 -2.544 1.00 . A A . 29 ASN HD22 1 1 20 10201 1 1 29 ASN N N 5.403 6.773 -3.873 1.00 . A A . 29 ASN N 1 1 20 10202 1 1 29 ASN ND2 N 4.222 9.050 -2.654 1.00 . A A . 29 ASN ND2 1 1 20 10203 1 1 29 ASN O O 7.316 5.213 -3.381 1.00 . A A . 29 ASN O 1 1 20 10204 1 1 29 ASN OD1 O 5.482 10.258 -1.309 1.00 . A A . 29 ASN OD1 1 1 20 10205 1 1 30 PRO C C 9.704 4.729 -1.783 1.00 . A A . 30 PRO C 1 1 20 10206 1 1 30 PRO CA C 10.026 5.692 -2.941 1.00 . A A . 30 PRO CA 1 1 20 10207 1 1 30 PRO CB C 11.272 6.512 -2.608 1.00 . A A . 30 PRO CB 1 1 20 10208 1 1 30 PRO CD C 9.566 8.081 -3.146 1.00 . A A . 30 PRO CD 1 1 20 10209 1 1 30 PRO CG C 11.040 7.827 -3.256 1.00 . A A . 30 PRO CG 1 1 20 10210 1 1 30 PRO HA H 10.192 5.122 -3.845 1.00 . A A . 30 PRO HA 1 1 20 10211 1 1 30 PRO HB2 H 11.371 6.602 -1.537 1.00 . A A . 30 PRO HB2 1 1 20 10212 1 1 30 PRO HB3 H 12.143 6.020 -3.017 1.00 . A A . 30 PRO HB3 1 1 20 10213 1 1 30 PRO HD2 H 9.356 8.603 -2.224 1.00 . A A . 30 PRO HD2 1 1 20 10214 1 1 30 PRO HD3 H 9.213 8.647 -3.995 1.00 . A A . 30 PRO HD3 1 1 20 10215 1 1 30 PRO HG2 H 11.596 8.594 -2.737 1.00 . A A . 30 PRO HG2 1 1 20 10216 1 1 30 PRO HG3 H 11.335 7.783 -4.293 1.00 . A A . 30 PRO HG3 1 1 20 10217 1 1 30 PRO N N 8.982 6.715 -3.139 1.00 . A A . 30 PRO N 1 1 20 10218 1 1 30 PRO O O 9.921 3.523 -1.884 1.00 . A A . 30 PRO O 1 1 20 10219 1 1 31 TYR C C 7.317 4.292 0.565 1.00 . A A . 31 TYR C 1 1 20 10220 1 1 31 TYR CA C 8.834 4.449 0.446 1.00 . A A . 31 TYR CA 1 1 20 10221 1 1 31 TYR CB C 9.397 5.060 1.747 1.00 . A A . 31 TYR CB 1 1 20 10222 1 1 31 TYR CD1 C 11.522 6.344 1.230 1.00 . A A . 31 TYR CD1 1 1 20 10223 1 1 31 TYR CD2 C 11.704 4.279 2.372 1.00 . A A . 31 TYR CD2 1 1 20 10224 1 1 31 TYR CE1 C 12.892 6.490 1.276 1.00 . A A . 31 TYR CE1 1 1 20 10225 1 1 31 TYR CE2 C 13.069 4.411 2.421 1.00 . A A . 31 TYR CE2 1 1 20 10226 1 1 31 TYR CG C 10.906 5.228 1.778 1.00 . A A . 31 TYR CG 1 1 20 10227 1 1 31 TYR CZ C 13.660 5.513 1.875 1.00 . A A . 31 TYR CZ 1 1 20 10228 1 1 31 TYR H H 9.024 6.232 -0.662 1.00 . A A . 31 TYR H 1 1 20 10229 1 1 31 TYR HA H 9.275 3.474 0.304 1.00 . A A . 31 TYR HA 1 1 20 10230 1 1 31 TYR HB2 H 8.964 6.033 1.911 1.00 . A A . 31 TYR HB2 1 1 20 10231 1 1 31 TYR HB3 H 9.124 4.418 2.571 1.00 . A A . 31 TYR HB3 1 1 20 10232 1 1 31 TYR HD1 H 10.915 7.103 0.759 1.00 . A A . 31 TYR HD1 1 1 20 10233 1 1 31 TYR HD2 H 11.239 3.406 2.806 1.00 . A A . 31 TYR HD2 1 1 20 10234 1 1 31 TYR HE1 H 13.351 7.365 0.844 1.00 . A A . 31 TYR HE1 1 1 20 10235 1 1 31 TYR HE2 H 13.669 3.646 2.890 1.00 . A A . 31 TYR HE2 1 1 20 10236 1 1 31 TYR HH H 15.446 4.817 1.670 1.00 . A A . 31 TYR HH 1 1 20 10237 1 1 31 TYR N N 9.178 5.262 -0.703 1.00 . A A . 31 TYR N 1 1 20 10238 1 1 31 TYR O O 6.823 3.332 1.164 1.00 . A A . 31 TYR O 1 1 20 10239 1 1 31 TYR OH O 15.034 5.649 1.941 1.00 . A A . 31 TYR OH 1 1 20 10240 1 1 32 TYR C C 4.481 4.384 -1.010 1.00 . A A . 32 TYR C 1 1 20 10241 1 1 32 TYR CA C 5.131 5.154 0.138 1.00 . A A . 32 TYR CA 1 1 20 10242 1 1 32 TYR CB C 4.527 6.552 0.237 1.00 . A A . 32 TYR CB 1 1 20 10243 1 1 32 TYR CD1 C 2.898 6.349 2.129 1.00 . A A . 32 TYR CD1 1 1 20 10244 1 1 32 TYR CD2 C 2.033 6.850 -0.035 1.00 . A A . 32 TYR CD2 1 1 20 10245 1 1 32 TYR CE1 C 1.633 6.390 2.657 1.00 . A A . 32 TYR CE1 1 1 20 10246 1 1 32 TYR CE2 C 0.757 6.888 0.491 1.00 . A A . 32 TYR CE2 1 1 20 10247 1 1 32 TYR CG C 3.124 6.577 0.780 1.00 . A A . 32 TYR CG 1 1 20 10248 1 1 32 TYR CZ C 0.565 6.657 1.840 1.00 . A A . 32 TYR CZ 1 1 20 10249 1 1 32 TYR H H 6.999 5.946 -0.486 1.00 . A A . 32 TYR H 1 1 20 10250 1 1 32 TYR HA H 4.918 4.631 1.058 1.00 . A A . 32 TYR HA 1 1 20 10251 1 1 32 TYR HB2 H 5.141 7.199 0.845 1.00 . A A . 32 TYR HB2 1 1 20 10252 1 1 32 TYR HB3 H 4.482 6.964 -0.760 1.00 . A A . 32 TYR HB3 1 1 20 10253 1 1 32 TYR HD1 H 3.743 6.138 2.767 1.00 . A A . 32 TYR HD1 1 1 20 10254 1 1 32 TYR HD2 H 2.183 7.026 -1.091 1.00 . A A . 32 TYR HD2 1 1 20 10255 1 1 32 TYR HE1 H 1.481 6.207 3.711 1.00 . A A . 32 TYR HE1 1 1 20 10256 1 1 32 TYR HE2 H -0.087 7.097 -0.150 1.00 . A A . 32 TYR HE2 1 1 20 10257 1 1 32 TYR HH H -1.322 6.380 1.710 1.00 . A A . 32 TYR HH 1 1 20 10258 1 1 32 TYR N N 6.569 5.217 0.005 1.00 . A A . 32 TYR N 1 1 20 10259 1 1 32 TYR O O 4.495 4.818 -2.163 1.00 . A A . 32 TYR O 1 1 20 10260 1 1 32 TYR OH O -0.708 6.723 2.377 1.00 . A A . 32 TYR OH 1 1 20 10261 1 1 33 SER C C 1.716 2.471 -1.030 1.00 . A A . 33 SER C 1 1 20 10262 1 1 33 SER CA C 3.123 2.484 -1.592 1.00 . A A . 33 SER CA 1 1 20 10263 1 1 33 SER CB C 3.692 1.064 -1.637 1.00 . A A . 33 SER CB 1 1 20 10264 1 1 33 SER H H 3.975 2.955 0.241 1.00 . A A . 33 SER H 1 1 20 10265 1 1 33 SER HA H 3.136 2.937 -2.572 1.00 . A A . 33 SER HA 1 1 20 10266 1 1 33 SER HB2 H 3.532 0.589 -0.678 1.00 . A A . 33 SER HB2 1 1 20 10267 1 1 33 SER HB3 H 3.188 0.501 -2.408 1.00 . A A . 33 SER HB3 1 1 20 10268 1 1 33 SER HG H 5.417 0.185 -1.800 1.00 . A A . 33 SER HG 1 1 20 10269 1 1 33 SER N N 3.894 3.281 -0.676 1.00 . A A . 33 SER N 1 1 20 10270 1 1 33 SER O O 1.567 2.358 0.184 1.00 . A A . 33 SER O 1 1 20 10271 1 1 33 SER OG O 5.088 1.084 -1.915 1.00 . A A . 33 SER OG 1 1 20 10272 1 1 34 GLN C C -1.623 1.834 -2.111 1.00 . A A . 34 GLN C 1 1 20 10273 1 1 34 GLN CA C -0.641 2.707 -1.337 1.00 . A A . 34 GLN CA 1 1 20 10274 1 1 34 GLN CB C -1.066 4.179 -1.350 1.00 . A A . 34 GLN CB 1 1 20 10275 1 1 34 GLN CD C -2.728 5.924 -0.659 1.00 . A A . 34 GLN CD 1 1 20 10276 1 1 34 GLN CG C -2.450 4.451 -0.805 1.00 . A A . 34 GLN CG 1 1 20 10277 1 1 34 GLN H H 0.849 2.589 -2.826 1.00 . A A . 34 GLN H 1 1 20 10278 1 1 34 GLN HA H -0.624 2.374 -0.308 1.00 . A A . 34 GLN HA 1 1 20 10279 1 1 34 GLN HB2 H -0.362 4.745 -0.758 1.00 . A A . 34 GLN HB2 1 1 20 10280 1 1 34 GLN HB3 H -1.027 4.538 -2.367 1.00 . A A . 34 GLN HB3 1 1 20 10281 1 1 34 GLN HE21 H -3.559 5.993 -2.437 1.00 . A A . 34 GLN HE21 1 1 20 10282 1 1 34 GLN HE22 H -3.463 7.490 -1.587 1.00 . A A . 34 GLN HE22 1 1 20 10283 1 1 34 GLN HG2 H -3.180 4.025 -1.478 1.00 . A A . 34 GLN HG2 1 1 20 10284 1 1 34 GLN HG3 H -2.545 3.980 0.163 1.00 . A A . 34 GLN HG3 1 1 20 10285 1 1 34 GLN N N 0.707 2.597 -1.850 1.00 . A A . 34 GLN N 1 1 20 10286 1 1 34 GLN NE2 N -3.315 6.521 -1.651 1.00 . A A . 34 GLN NE2 1 1 20 10287 1 1 34 GLN O O -1.483 1.650 -3.325 1.00 . A A . 34 GLN O 1 1 20 10288 1 1 34 GLN OE1 O -2.450 6.504 0.373 1.00 . A A . 34 GLN OE1 1 1 20 10289 1 1 35 CYS C C -4.615 1.352 -2.696 1.00 . A A . 35 CYS C 1 1 20 10290 1 1 35 CYS CA C -3.619 0.466 -1.988 1.00 . A A . 35 CYS CA 1 1 20 10291 1 1 35 CYS CB C -4.354 -0.344 -0.935 1.00 . A A . 35 CYS CB 1 1 20 10292 1 1 35 CYS H H -2.597 1.386 -0.417 1.00 . A A . 35 CYS H 1 1 20 10293 1 1 35 CYS HA H -3.165 -0.210 -2.697 1.00 . A A . 35 CYS HA 1 1 20 10294 1 1 35 CYS HB2 H -4.955 0.300 -0.314 1.00 . A A . 35 CYS HB2 1 1 20 10295 1 1 35 CYS HB3 H -5.016 -1.012 -1.458 1.00 . A A . 35 CYS HB3 1 1 20 10296 1 1 35 CYS N N -2.587 1.271 -1.391 1.00 . A A . 35 CYS N 1 1 20 10297 1 1 35 CYS O O -5.337 2.137 -2.055 1.00 . A A . 35 CYS O 1 1 20 10298 1 1 35 CYS SG S -3.286 -1.356 0.113 1.00 . A A . 35 CYS SG 1 1 20 10299 1 1 36 LEU C C -6.410 0.973 -5.527 1.00 . A A . 36 LEU C 1 1 20 10300 1 1 36 LEU CA C -5.528 1.967 -4.827 1.00 . A A . 36 LEU CA 1 1 20 10301 1 1 36 LEU CB C -4.756 2.809 -5.835 1.00 . A A . 36 LEU CB 1 1 20 10302 1 1 36 LEU CD1 C -3.127 4.621 -6.352 1.00 . A A . 36 LEU CD1 1 1 20 10303 1 1 36 LEU CD2 C -4.774 4.948 -4.522 1.00 . A A . 36 LEU CD2 1 1 20 10304 1 1 36 LEU CG C -3.903 3.937 -5.255 1.00 . A A . 36 LEU CG 1 1 20 10305 1 1 36 LEU H H -3.999 0.631 -4.415 1.00 . A A . 36 LEU H 1 1 20 10306 1 1 36 LEU HA H -6.136 2.610 -4.210 1.00 . A A . 36 LEU HA 1 1 20 10307 1 1 36 LEU HB2 H -4.110 2.149 -6.395 1.00 . A A . 36 LEU HB2 1 1 20 10308 1 1 36 LEU HB3 H -5.471 3.243 -6.516 1.00 . A A . 36 LEU HB3 1 1 20 10309 1 1 36 LEU HD11 H -2.474 3.907 -6.833 1.00 . A A . 36 LEU HD11 1 1 20 10310 1 1 36 LEU HD12 H -2.539 5.422 -5.927 1.00 . A A . 36 LEU HD12 1 1 20 10311 1 1 36 LEU HD13 H -3.814 5.026 -7.081 1.00 . A A . 36 LEU HD13 1 1 20 10312 1 1 36 LEU HD21 H -4.161 5.769 -4.183 1.00 . A A . 36 LEU HD21 1 1 20 10313 1 1 36 LEU HD22 H -5.240 4.476 -3.669 1.00 . A A . 36 LEU HD22 1 1 20 10314 1 1 36 LEU HD23 H -5.537 5.321 -5.190 1.00 . A A . 36 LEU HD23 1 1 20 10315 1 1 36 LEU HG H -3.197 3.525 -4.550 1.00 . A A . 36 LEU HG 1 1 20 10316 1 1 36 LEU N N -4.635 1.248 -3.981 1.00 . A A . 36 LEU N 1 1 20 10317 1 1 36 LEU O O -5.893 0.166 -6.322 1.00 . A A . 36 LEU O 1 1 20 10318 1 1 36 LEU OXT O -7.618 0.960 -5.258 1.00 . A A . 36 LEU OXT 1 1 20 10319 2 2 1 MAN C1 C 9.993 -3.641 9.247 1.00 . B A . 101 MAN C1 1 1 20 10320 2 2 1 MAN C2 C 10.990 -2.464 9.103 1.00 . B A . 101 MAN C2 1 1 20 10321 2 2 1 MAN C3 C 12.245 -2.864 8.298 1.00 . B A . 101 MAN C3 1 1 20 10322 2 2 1 MAN C4 C 11.938 -3.981 7.287 1.00 . B A . 101 MAN C4 1 1 20 10323 2 2 1 MAN C5 C 11.290 -5.218 7.980 1.00 . B A . 101 MAN C5 1 1 20 10324 2 2 1 MAN C6 C 12.268 -6.335 8.247 1.00 . B A . 101 MAN C6 1 1 20 10325 2 2 1 MAN H1 H 9.505 -3.486 10.220 1.00 . B A . 101 MAN H1 1 1 20 10326 2 2 1 MAN H2 H 10.479 -1.630 8.596 1.00 . B A . 101 MAN H2 1 1 20 10327 2 2 1 MAN H3 H 12.548 -1.959 7.750 1.00 . B A . 101 MAN H3 1 1 20 10328 2 2 1 MAN H4 H 12.889 -4.305 6.843 1.00 . B A . 101 MAN H4 1 1 20 10329 2 2 1 MAN H5 H 10.514 -5.578 7.290 1.00 . B A . 101 MAN H5 1 1 20 10330 2 2 1 MAN H61 H 12.820 -6.527 7.316 1.00 . B A . 101 MAN H61 1 1 20 10331 2 2 1 MAN H62 H 11.713 -7.246 8.519 1.00 . B A . 101 MAN H62 1 1 20 10332 2 2 1 MAN HO2 H 11.856 -2.866 10.761 1.00 . B A . 101 MAN HO2 1 1 20 10333 2 2 1 MAN HO3 H 13.029 -4.051 9.612 1.00 . B A . 101 MAN HO3 1 1 20 10334 2 2 1 MAN HO4 H 11.575 -2.772 5.822 1.00 . B A . 101 MAN HO4 1 1 20 10335 2 2 1 MAN HO6 H 12.594 -5.884 10.074 1.00 . B A . 101 MAN HO6 1 1 20 10336 2 2 1 MAN O2 O 11.416 -2.082 10.405 1.00 . B A . 101 MAN O2 1 1 20 10337 2 2 1 MAN O3 O 13.298 -3.226 9.181 1.00 . B A . 101 MAN O3 1 1 20 10338 2 2 1 MAN O4 O 11.109 -3.497 6.253 1.00 . B A . 101 MAN O4 1 1 20 10339 2 2 1 MAN O5 O 10.698 -4.862 9.262 1.00 . B A . 101 MAN O5 1 1 20 10340 2 2 1 MAN O6 O 13.151 -5.981 9.291 1.00 . B A . 101 MAN O6 1 1 stop_ save_
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