NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | item_count |
469093 | 1ac0 | cing | 4-filtered-FRED | STAR | entry | full | 964 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1ac0 # This FRED archive file contains, for PDB entry <1ac0>: # # - 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.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_1ac0 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1ac0 _Assembly.Number_of_components 3 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all disulfide bound" _Assembly.Molecular_mass 12189.94 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 $GLUCOAMYLASE A . 1 1 2 . 2 $SUGAR__7_MER_ B . 1 1 3 . 2 $SUGAR__7_MER_ C . 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 GLC 1 GLC 1 1 3 2 GLC 1 GLC 1 1 stop_ save_ save_GLUCOAMYLASE _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name GLUCOAMYLASE _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code CTTPTAVAVTFDLTATTTYGENIYLVGSISQLGDWETSDGIALSADKYTSSDPLWYVTVTLPAGESFEYKFIRIESDDSVEWESDPNREYTVPQACGTSTATVTDTWR _Entity.Number_of_monomers 108 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 CYS . 1 1 2 THR . 1 1 3 THR . 1 1 4 PRO . 1 1 5 THR . 1 1 6 ALA . 1 1 7 VAL . 1 1 8 ALA . 1 1 9 VAL . 1 1 10 THR . 1 1 11 PHE . 1 1 12 ASP . 1 1 13 LEU . 1 1 14 THR . 1 1 15 ALA . 1 1 16 THR . 1 1 17 THR . 1 1 18 THR . 1 1 19 TYR . 1 1 20 GLY . 1 1 21 GLU . 1 1 22 ASN . 1 1 23 ILE . 1 1 24 TYR . 1 1 25 LEU . 1 1 26 VAL . 1 1 27 GLY . 1 1 28 SER . 1 1 29 ILE . 1 1 30 SER . 1 1 31 GLN . 1 1 32 LEU . 1 1 33 GLY . 1 1 34 ASP . 1 1 35 TRP . 1 1 36 GLU . 1 1 37 THR . 1 1 38 SER . 1 1 39 ASP . 1 1 40 GLY . 1 1 41 ILE . 1 1 42 ALA . 1 1 43 LEU . 1 1 44 SER . 1 1 45 ALA . 1 1 46 ASP . 1 1 47 LYS . 1 1 48 TYR . 1 1 49 THR . 1 1 50 SER . 1 1 51 SER . 1 1 52 ASP . 1 1 53 PRO . 1 1 54 LEU . 1 1 55 TRP . 1 1 56 TYR . 1 1 57 VAL . 1 1 58 THR . 1 1 59 VAL . 1 1 60 THR . 1 1 61 LEU . 1 1 62 PRO . 1 1 63 ALA . 1 1 64 GLY . 1 1 65 GLU . 1 1 66 SER . 1 1 67 PHE . 1 1 68 GLU . 1 1 69 TYR . 1 1 70 LYS . 1 1 71 PHE . 1 1 72 ILE . 1 1 73 ARG . 1 1 74 ILE . 1 1 75 GLU . 1 1 76 SER . 1 1 77 ASP . 1 1 78 ASP . 1 1 79 SER . 1 1 80 VAL . 1 1 81 GLU . 1 1 82 TRP . 1 1 83 GLU . 1 1 84 SER . 1 1 85 ASP . 1 1 86 PRO . 1 1 87 ASN . 1 1 88 ARG . 1 1 89 GLU . 1 1 90 TYR . 1 1 91 THR . 1 1 92 VAL . 1 1 93 PRO . 1 1 94 GLN . 1 1 95 ALA . 1 1 96 CYS . 1 1 97 GLY . 1 1 98 THR . 1 1 99 SER . 1 1 100 THR . 1 1 101 ALA . 1 1 102 THR . 1 1 103 VAL . 1 1 104 THR . 1 1 105 ASP . 1 1 106 THR . 1 1 107 TRP . 1 1 108 ARG . 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 CYS 1 1 1 1 THR 2 2 1 1 THR 3 3 1 1 PRO 4 4 1 1 THR 5 5 1 1 ALA 6 6 1 1 VAL 7 7 1 1 ALA 8 8 1 1 VAL 9 9 1 1 THR 10 10 1 1 PHE 11 11 1 1 ASP 12 12 1 1 LEU 13 13 1 1 THR 14 14 1 1 ALA 15 15 1 1 THR 16 16 1 1 THR 17 17 1 1 THR 18 18 1 1 TYR 19 19 1 1 GLY 20 20 1 1 GLU 21 21 1 1 ASN 22 22 1 1 ILE 23 23 1 1 TYR 24 24 1 1 LEU 25 25 1 1 VAL 26 26 1 1 GLY 27 27 1 1 SER 28 28 1 1 ILE 29 29 1 1 SER 30 30 1 1 GLN 31 31 1 1 LEU 32 32 1 1 GLY 33 33 1 1 ASP 34 34 1 1 TRP 35 35 1 1 GLU 36 36 1 1 THR 37 37 1 1 SER 38 38 1 1 ASP 39 39 1 1 GLY 40 40 1 1 ILE 41 41 1 1 ALA 42 42 1 1 LEU 43 43 1 1 SER 44 44 1 1 ALA 45 45 1 1 ASP 46 46 1 1 LYS 47 47 1 1 TYR 48 48 1 1 THR 49 49 1 1 SER 50 50 1 1 SER 51 51 1 1 ASP 52 52 1 1 PRO 53 53 1 1 LEU 54 54 1 1 TRP 55 55 1 1 TYR 56 56 1 1 VAL 57 57 1 1 THR 58 58 1 1 VAL 59 59 1 1 THR 60 60 1 1 LEU 61 61 1 1 PRO 62 62 1 1 ALA 63 63 1 1 GLY 64 64 1 1 GLU 65 65 1 1 SER 66 66 1 1 PHE 67 67 1 1 GLU 68 68 1 1 TYR 69 69 1 1 LYS 70 70 1 1 PHE 71 71 1 1 ILE 72 72 1 1 ARG 73 73 1 1 ILE 74 74 1 1 GLU 75 75 1 1 SER 76 76 1 1 ASP 77 77 1 1 ASP 78 78 1 1 SER 79 79 1 1 VAL 80 80 1 1 GLU 81 81 1 1 TRP 82 82 1 1 GLU 83 83 1 1 SER 84 84 1 1 ASP 85 85 1 1 PRO 86 86 1 1 ASN 87 87 1 1 ARG 88 88 1 1 GLU 89 89 1 1 TYR 90 90 1 1 THR 91 91 1 1 VAL 92 92 1 1 PRO 93 93 1 1 GLN 94 94 1 1 ALA 95 95 1 1 CYS 96 96 1 1 GLY 97 97 1 1 THR 98 98 1 1 SER 99 99 1 1 THR 100 100 1 1 ALA 101 101 1 1 THR 102 102 1 1 VAL 103 103 1 1 THR 104 104 1 1 ASP 105 105 1 1 THR 106 106 1 1 TRP 107 107 1 1 ARG 108 108 1 1 stop_ save_ save_SUGAR__7_MER_ _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "SUGAR 7 MER " _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 GLC $GLC 1 2 stop_ save_ save_GLC _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID GLC _Chem_comp.Type non-polymer save_ save_CNS/XPLOR_distance_constraints_3_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 1 . . . 1 1 315 1 . . . 1 1 316 1 . . . 1 1 317 1 . . . 1 1 318 1 . . . 1 1 319 1 . . . 1 1 320 1 . . . 1 1 321 1 . . . 1 1 322 1 . . . 1 1 323 1 . . . 1 1 324 1 . . . 1 1 325 1 . . . 1 1 326 1 . . . 1 1 327 1 . . . 1 1 328 1 . . . 1 1 329 1 . . . 1 1 330 1 . . . 1 1 331 1 . . . 1 1 332 1 . . . 1 1 333 1 . . . 1 1 334 1 . . . 1 1 335 1 . . . 1 1 336 1 . . . 1 1 337 1 . . . 1 1 338 1 . . . 1 1 339 1 . . . 1 1 340 1 . . . 1 1 341 1 . . . 1 1 342 1 . . . 1 1 343 1 . . . 1 1 344 1 . . . 1 1 345 1 . . . 1 1 346 1 . . . 1 1 347 1 . . . 1 1 348 1 . . . 1 1 349 1 . . . 1 1 350 1 . . . 1 1 351 1 . . . 1 1 352 1 . . . 1 1 353 1 . . . 1 1 354 1 . . . 1 1 355 1 . . . 1 1 356 1 . . . 1 1 357 1 . . . 1 1 358 1 . . . 1 1 359 1 . . . 1 1 360 1 . . . 1 1 361 1 . . . 1 1 362 1 . . . 1 1 363 1 . . . 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 . . . 1 1 375 1 . . . 1 1 376 1 . . . 1 1 377 1 . . . 1 1 378 1 . . . 1 1 379 1 . . . 1 1 380 1 . . . 1 1 381 1 . . . 1 1 382 1 . . . 1 1 383 1 . . . 1 1 384 1 . . . 1 1 385 1 . . . 1 1 386 1 . . . 1 1 387 1 . . . 1 1 388 1 . . . 1 1 389 1 . . . 1 1 390 1 . . . 1 1 391 1 . . . 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 . . . 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 . . . 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 . . . 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 . . . 1 1 515 1 . . . 1 1 516 1 . . . 1 1 517 1 . . . 1 1 518 1 . . . 1 1 519 1 . . . 1 1 520 1 . . . 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 . . . 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 . . . 1 1 535 1 . . . 1 1 536 1 . . . 1 1 537 1 . . . 1 1 538 1 . . . 1 1 539 1 . . . 1 1 540 1 . . . 1 1 541 1 . . . 1 1 542 1 . . . 1 1 543 1 . . . 1 1 544 1 . . . 1 1 545 1 . . . 1 1 546 1 . . . 1 1 547 1 . . . 1 1 548 1 . . . 1 1 549 1 . . . 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 . . . 1 1 557 1 . . . 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 . . . 1 1 577 1 . . . 1 1 578 1 . . . 1 1 579 1 . . . 1 1 580 1 . . . 1 1 581 1 . . . 1 1 582 1 . . . 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 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 5 THR HA . 513 . HA 1 1 1 1 2 1 1 6 ALA H . 514 . HN 1 1 2 1 1 1 1 5 THR MG . 513 . HG2# 1 1 2 1 2 1 1 6 ALA H . 514 . HN 1 1 3 1 1 1 1 6 ALA HA . 514 . HA 1 1 3 1 2 1 1 7 VAL H . 515 . HN 1 1 4 1 1 1 1 6 ALA MB . 514 . HB# 1 1 4 1 2 1 1 7 VAL H . 515 . HN 1 1 5 1 1 1 1 7 VAL HA . 515 . HA 1 1 5 1 2 1 1 8 ALA H . 516 . HN 1 1 6 1 1 1 1 7 VAL MG1 . 515 . HG1# 1 1 6 1 2 1 1 8 ALA H . 516 . HN 1 1 7 1 1 1 1 8 ALA HA . 516 . HA 1 1 7 1 2 1 1 9 VAL H . 517 . HN 1 1 8 1 1 1 1 8 ALA MB . 516 . HB# 1 1 8 1 2 1 1 9 VAL H . 517 . HN 1 1 9 1 1 1 1 9 VAL HA . 517 . HA 1 1 9 1 2 1 1 10 THR H . 518 . HN 1 1 10 1 1 1 1 9 VAL MG1 . 517 . HG1# 1 1 10 1 2 1 1 10 THR H . 518 . HN 1 1 11 1 1 1 1 9 VAL MG2 . 517 . HG2# 1 1 11 1 2 1 1 10 THR H . 518 . HN 1 1 12 1 1 1 1 10 THR HA . 518 . HA 1 1 12 1 2 1 1 11 PHE H . 519 . HN 1 1 13 1 1 1 1 10 THR MG . 518 . HG2# 1 1 13 1 2 1 1 11 PHE H . 519 . HN 1 1 14 1 1 1 1 11 PHE HA . 519 . HA 1 1 14 1 2 1 1 12 ASP H . 520 . HN 1 1 15 1 1 1 1 11 PHE QB . 519 . HB# 1 1 15 1 2 1 1 12 ASP H . 520 . HN 1 1 16 1 1 1 1 12 ASP HA . 520 . HA 1 1 16 1 2 1 1 13 LEU H . 521 . HN 1 1 17 1 1 1 1 12 ASP HB3 . 520 . HB1 1 1 17 1 2 1 1 13 LEU H . 521 . HN 1 1 18 1 1 1 1 12 ASP HB2 . 520 . HB2 1 1 18 1 2 1 1 13 LEU H . 521 . HN 1 1 19 1 1 1 1 13 LEU HA . 521 . HA 1 1 19 1 2 1 1 14 THR H . 522 . HN 1 1 20 1 1 1 1 13 LEU QD . 521 . HD# 1 1 20 1 2 1 1 14 THR H . 522 . HN 1 1 21 1 1 1 1 14 THR HA . 522 . HA 1 1 21 1 2 1 1 15 ALA H . 523 . HN 1 1 22 1 1 1 1 14 THR MG . 522 . HG2# 1 1 22 1 2 1 1 15 ALA H . 523 . HN 1 1 23 1 1 1 1 15 ALA HA . 523 . HA 1 1 23 1 2 1 1 16 THR H . 524 . HN 1 1 24 1 1 1 1 15 ALA MB . 523 . HB# 1 1 24 1 2 1 1 16 THR H . 524 . HN 1 1 25 1 1 1 1 16 THR HA . 524 . HA 1 1 25 1 2 1 1 17 THR H . 525 . HN 1 1 26 1 1 1 1 16 THR HB . 524 . HB 1 1 26 1 2 1 1 17 THR H . 525 . HN 1 1 27 1 1 1 1 16 THR MG . 524 . HG2# 1 1 27 1 2 1 1 17 THR H . 525 . HN 1 1 28 1 1 1 1 17 THR HA . 525 . HA 1 1 28 1 2 1 1 18 THR H . 526 . HN 1 1 29 1 1 1 1 17 THR HB . 525 . HB 1 1 29 1 2 1 1 18 THR H . 526 . HN 1 1 30 1 1 1 1 17 THR MG . 525 . HG2# 1 1 30 1 2 1 1 18 THR H . 526 . HN 1 1 31 1 1 1 1 18 THR HA . 526 . HA 1 1 31 1 2 1 1 19 TYR H . 527 . HN 1 1 32 1 1 1 1 18 THR HB . 526 . HB 1 1 32 1 2 1 1 19 TYR H . 527 . HN 1 1 33 1 1 1 1 18 THR MG . 526 . HG2# 1 1 33 1 2 1 1 19 TYR H . 527 . HN 1 1 34 1 1 1 1 19 TYR HA . 527 . HA 1 1 34 1 2 1 1 20 GLY H . 528 . HN 1 1 35 1 1 1 1 21 GLU HA . 529 . HA 1 1 35 1 2 1 1 22 ASN H . 530 . HN 1 1 36 1 1 1 1 21 GLU HB3 . 529 . HB1 1 1 36 1 2 1 1 22 ASN H . 530 . HN 1 1 37 1 1 1 1 22 ASN HA . 530 . HA 1 1 37 1 2 1 1 23 ILE H . 531 . HN 1 1 38 1 1 1 1 22 ASN QB . 530 . HB# 1 1 38 1 2 1 1 23 ILE H . 531 . HN 1 1 39 1 1 1 1 23 ILE HA . 531 . HA 1 1 39 1 2 1 1 24 TYR H . 532 . HN 1 1 40 1 1 1 1 23 ILE HB . 531 . HB 1 1 40 1 2 1 1 24 TYR H . 532 . HN 1 1 41 1 1 1 1 23 ILE QG . 531 . HG1# 1 1 41 1 2 1 1 24 TYR H . 532 . HN 1 1 42 1 1 1 1 23 ILE MG . 531 . HG2# 1 1 42 1 2 1 1 24 TYR H . 532 . HN 1 1 43 1 1 1 1 23 ILE MD . 531 . HD# 1 1 43 1 2 1 1 24 TYR H . 532 . HN 1 1 44 1 1 1 1 24 TYR HA . 532 . HA 1 1 44 1 2 1 1 25 LEU H . 533 . HN 1 1 45 1 1 1 1 24 TYR QB . 532 . HB# 1 1 45 1 2 1 1 25 LEU H . 533 . HN 1 1 46 1 1 1 1 25 LEU HA . 533 . HA 1 1 46 1 2 1 1 26 VAL H . 534 . HN 1 1 47 1 1 1 1 25 LEU QD . 533 . HD# 1 1 47 1 2 1 1 26 VAL H . 534 . HN 1 1 48 1 1 1 1 26 VAL HA . 534 . HA 1 1 48 1 2 1 1 27 GLY H . 535 . HN 1 1 49 1 1 1 1 26 VAL HB . 534 . HB 1 1 49 1 2 1 1 27 GLY H . 535 . HN 1 1 50 1 1 1 1 26 VAL QG . 534 . HG1# 1 1 50 1 2 1 1 27 GLY H . 535 . HN 1 1 51 1 1 1 1 27 GLY QA . 535 . HA# 1 1 51 1 2 1 1 28 SER H . 536 . HN 1 1 52 1 1 1 1 28 SER HA . 536 . HA 1 1 52 1 2 1 1 29 ILE H . 537 . HN 1 1 53 1 1 1 1 29 ILE HA . 537 . HA 1 1 53 1 2 1 1 30 SER H . 538 . HN 1 1 54 1 1 1 1 29 ILE HB . 537 . HB 1 1 54 1 2 1 1 30 SER H . 538 . HN 1 1 55 1 1 1 1 29 ILE MG . 537 . HG2# 1 1 55 1 2 1 1 30 SER H . 538 . HN 1 1 56 1 1 1 1 30 SER HA . 538 . HA 1 1 56 1 2 1 1 31 GLN H . 539 . HN 1 1 57 1 1 1 1 30 SER QB . 538 . HB# 1 1 57 1 2 1 1 31 GLN H . 539 . HN 1 1 58 1 1 1 1 31 GLN HA . 539 . HA 1 1 58 1 2 1 1 32 LEU H . 540 . HN 1 1 59 1 1 1 1 32 LEU HA . 540 . HA 1 1 59 1 2 1 1 33 GLY H . 541 . HN 1 1 60 1 1 1 1 32 LEU QB . 540 . HB# 1 1 60 1 2 1 1 33 GLY H . 541 . HN 1 1 61 1 1 1 1 32 LEU HG . 540 . HG 1 1 61 1 2 1 1 33 GLY H . 541 . HN 1 1 62 1 1 1 1 32 LEU QD . 540 . HD# 1 1 62 1 2 1 1 33 GLY H . 541 . HN 1 1 63 1 1 1 1 34 ASP HA . 542 . HA 1 1 63 1 2 1 1 35 TRP H . 543 . HN 1 1 64 1 1 1 1 34 ASP QB . 542 . HB# 1 1 64 1 2 1 1 35 TRP H . 543 . HN 1 1 65 1 1 1 1 35 TRP HA . 543 . HA 1 1 65 1 2 1 1 36 GLU H . 544 . HN 1 1 66 1 1 1 1 36 GLU HA . 544 . HA 1 1 66 1 2 1 1 37 THR H . 545 . HN 1 1 67 1 1 1 1 36 GLU HB3 . 544 . HB1 1 1 67 1 2 1 1 37 THR H . 545 . HN 1 1 68 1 1 1 1 36 GLU QG . 544 . HG# 1 1 68 1 2 1 1 37 THR H . 545 . HN 1 1 69 1 1 1 1 37 THR HA . 545 . HA 1 1 69 1 2 1 1 38 SER H . 546 . HN 1 1 70 1 1 1 1 37 THR MG . 545 . HG2# 1 1 70 1 2 1 1 38 SER H . 546 . HN 1 1 71 1 1 1 1 38 SER HA . 546 . HA 1 1 71 1 2 1 1 39 ASP H . 547 . HN 1 1 72 1 1 1 1 39 ASP HA . 547 . HA 1 1 72 1 2 1 1 40 GLY H . 548 . HN 1 1 73 1 1 1 1 39 ASP QB . 547 . HB# 1 1 73 1 2 1 1 40 GLY H . 548 . HN 1 1 74 1 1 1 1 40 GLY QA . 548 . HA# 1 1 74 1 2 1 1 41 ILE H . 549 . HN 1 1 75 1 1 1 1 41 ILE HA . 549 . HA 1 1 75 1 2 1 1 42 ALA H . 550 . HN 1 1 76 1 1 1 1 42 ALA HA . 550 . HA 1 1 76 1 2 1 1 43 LEU H . 551 . HN 1 1 77 1 1 1 1 42 ALA MB . 550 . HB# 1 1 77 1 2 1 1 43 LEU H . 551 . HN 1 1 78 1 1 1 1 43 LEU HA . 551 . HA 1 1 78 1 2 1 1 44 SER H . 552 . HN 1 1 79 1 1 1 1 44 SER HA . 552 . HA 1 1 79 1 2 1 1 45 ALA H . 553 . HN 1 1 80 1 1 1 1 45 ALA MB . 553 . HB# 1 1 80 1 2 1 1 46 ASP H . 554 . HN 1 1 81 1 1 1 1 46 ASP HA . 554 . HA 1 1 81 1 2 1 1 47 LYS H . 555 . HN 1 1 82 1 1 1 1 46 ASP QB . 554 . HB# 1 1 82 1 2 1 1 47 LYS H . 555 . HN 1 1 83 1 1 1 1 47 LYS HA . 555 . HA 1 1 83 1 2 1 1 48 TYR H . 556 . HN 1 1 84 1 1 1 1 47 LYS QB . 555 . HB# 1 1 84 1 2 1 1 48 TYR H . 556 . HN 1 1 85 1 1 1 1 47 LYS QG . 555 . HG# 1 1 85 1 2 1 1 48 TYR H . 556 . HN 1 1 86 1 1 1 1 47 LYS QD . 555 . HD# 1 1 86 1 2 1 1 48 TYR H . 556 . HN 1 1 87 1 1 1 1 48 TYR HA . 556 . HA 1 1 87 1 2 1 1 49 THR H . 557 . HN 1 1 88 1 1 1 1 49 THR HA . 557 . HA 1 1 88 1 2 1 1 50 SER H . 558 . HN 1 1 89 1 1 1 1 49 THR HB . 557 . HB 1 1 89 1 2 1 1 50 SER H . 558 . HN 1 1 90 1 1 1 1 49 THR MG . 557 . HG2# 1 1 90 1 2 1 1 50 SER H . 558 . HN 1 1 91 1 1 1 1 50 SER HA . 558 . HA 1 1 91 1 2 1 1 51 SER H . 559 . HN 1 1 92 1 1 1 1 50 SER QB . 558 . HB# 1 1 92 1 2 1 1 51 SER H . 559 . HN 1 1 93 1 1 1 1 51 SER HA . 559 . HA 1 1 93 1 2 1 1 52 ASP H . 560 . HN 1 1 94 1 1 1 1 51 SER QB . 559 . HB# 1 1 94 1 2 1 1 52 ASP H . 560 . HN 1 1 95 1 1 1 1 53 PRO QB . 561 . HB# 1 1 95 1 2 1 1 54 LEU H . 562 . HN 1 1 96 1 1 1 1 54 LEU HA . 562 . HA 1 1 96 1 2 1 1 55 TRP H . 563 . HN 1 1 97 1 1 1 1 54 LEU HG . 562 . HG 1 1 97 1 2 1 1 55 TRP H . 563 . HN 1 1 98 1 1 1 1 54 LEU QD . 562 . HD# 1 1 98 1 2 1 1 55 TRP H . 563 . HN 1 1 99 1 1 1 1 55 TRP HA . 563 . HA 1 1 99 1 2 1 1 56 TYR H . 564 . HN 1 1 100 1 1 1 1 55 TRP QB . 563 . HB# 1 1 100 1 2 1 1 56 TYR H . 564 . HN 1 1 101 1 1 1 1 56 TYR HA . 564 . HA 1 1 101 1 2 1 1 57 VAL H . 565 . HN 1 1 102 1 1 1 1 56 TYR HB3 . 564 . HB1 1 1 102 1 2 1 1 57 VAL H . 565 . HN 1 1 103 1 1 1 1 56 TYR HB2 . 564 . HB2 1 1 103 1 2 1 1 57 VAL H . 565 . HN 1 1 104 1 1 1 1 57 VAL HA . 565 . HA 1 1 104 1 2 1 1 58 THR H . 566 . HN 1 1 105 1 1 1 1 57 VAL MG2 . 565 . HG2# 1 1 105 1 2 1 1 58 THR H . 566 . HN 1 1 106 1 1 1 1 58 THR HA . 566 . HA 1 1 106 1 2 1 1 59 VAL H . 567 . HN 1 1 107 1 1 1 1 58 THR MG . 566 . HG2# 1 1 107 1 2 1 1 59 VAL H . 567 . HN 1 1 108 1 1 1 1 59 VAL HA . 567 . HA 1 1 108 1 2 1 1 60 THR H . 568 . HN 1 1 109 1 1 1 1 59 VAL HB . 567 . HB 1 1 109 1 2 1 1 60 THR H . 568 . HN 1 1 110 1 1 1 1 59 VAL QG . 567 . HG# 1 1 110 1 2 1 1 60 THR H . 568 . HN 1 1 111 1 1 1 1 60 THR HA . 568 . HA 1 1 111 1 2 1 1 61 LEU H . 569 . HN 1 1 112 1 1 1 1 60 THR HB . 568 . HB 1 1 112 1 2 1 1 61 LEU H . 569 . HN 1 1 113 1 1 1 1 60 THR MG . 568 . HG2# 1 1 113 1 2 1 1 61 LEU H . 569 . HN 1 1 114 1 1 1 1 62 PRO HA . 570 . HA 1 1 114 1 2 1 1 63 ALA H . 571 . HN 1 1 115 1 1 1 1 62 PRO QB . 570 . HB# 1 1 115 1 2 1 1 63 ALA H . 571 . HN 1 1 116 1 1 1 1 63 ALA HA . 571 . HA 1 1 116 1 2 1 1 64 GLY H . 572 . HN 1 1 117 1 1 1 1 64 GLY QA . 572 . HA# 1 1 117 1 2 1 1 65 GLU H . 573 . HN 1 1 118 1 1 1 1 65 GLU HA . 573 . HA 1 1 118 1 2 1 1 66 SER H . 574 . HN 1 1 119 1 1 1 1 65 GLU QB . 573 . HB# 1 1 119 1 2 1 1 66 SER H . 574 . HN 1 1 120 1 1 1 1 65 GLU QG . 573 . HG# 1 1 120 1 2 1 1 66 SER H . 574 . HN 1 1 121 1 1 1 1 66 SER HA . 574 . HA 1 1 121 1 2 1 1 67 PHE H . 575 . HN 1 1 122 1 1 1 1 66 SER QB . 574 . HB# 1 1 122 1 2 1 1 67 PHE H . 575 . HN 1 1 123 1 1 1 1 67 PHE HA . 575 . HA 1 1 123 1 2 1 1 68 GLU H . 576 . HN 1 1 124 1 1 1 1 67 PHE QB . 575 . HB# 1 1 124 1 2 1 1 68 GLU H . 576 . HN 1 1 125 1 1 1 1 68 GLU HA . 576 . HA 1 1 125 1 2 1 1 69 TYR H . 577 . HN 1 1 126 1 1 1 1 69 TYR HA . 577 . HA 1 1 126 1 2 1 1 70 LYS H . 578 . HN 1 1 127 1 1 1 1 69 TYR QB . 577 . HB# 1 1 127 1 2 1 1 70 LYS H . 578 . HN 1 1 128 1 1 1 1 70 LYS HA . 578 . HA 1 1 128 1 2 1 1 71 PHE H . 579 . HN 1 1 129 1 1 1 1 71 PHE HA . 579 . HA 1 1 129 1 2 1 1 72 ILE H . 580 . HN 1 1 130 1 1 1 1 71 PHE QB . 579 . HB# 1 1 130 1 2 1 1 72 ILE H . 580 . HN 1 1 131 1 1 1 1 72 ILE HA . 580 . HA 1 1 131 1 2 1 1 73 ARG H . 581 . HN 1 1 132 1 1 1 1 72 ILE HB . 580 . HB 1 1 132 1 2 1 1 73 ARG H . 581 . HN 1 1 133 1 1 1 1 73 ARG HA . 581 . HA 1 1 133 1 2 1 1 74 ILE H . 582 . HN 1 1 134 1 1 1 1 74 ILE HA . 582 . HA 1 1 134 1 2 1 1 75 GLU H . 583 . HN 1 1 135 1 1 1 1 74 ILE MG . 582 . HG2# 1 1 135 1 2 1 1 75 GLU H . 583 . HN 1 1 136 1 1 1 1 75 GLU HA . 583 . HA 1 1 136 1 2 1 1 76 SER H . 584 . HN 1 1 137 1 1 1 1 76 SER HA . 584 . HA 1 1 137 1 2 1 1 77 ASP H . 585 . HN 1 1 138 1 1 1 1 77 ASP HA . 585 . HA 1 1 138 1 2 1 1 78 ASP H . 586 . HN 1 1 139 1 1 1 1 78 ASP HA . 586 . HA 1 1 139 1 2 1 1 79 SER H . 587 . HN 1 1 140 1 1 1 1 78 ASP QB . 586 . HB# 1 1 140 1 2 1 1 79 SER H . 587 . HN 1 1 141 1 1 1 1 79 SER HA . 587 . HA 1 1 141 1 2 1 1 80 VAL H . 588 . HN 1 1 142 1 1 1 1 79 SER QB . 587 . HB# 1 1 142 1 2 1 1 80 VAL H . 588 . HN 1 1 143 1 1 1 1 80 VAL HA . 588 . HA 1 1 143 1 2 1 1 81 GLU H . 589 . HN 1 1 144 1 1 1 1 80 VAL MG1 . 588 . HG1# 1 1 144 1 2 1 1 81 GLU H . 589 . HN 1 1 145 1 1 1 1 81 GLU HA . 589 . HA 1 1 145 1 2 1 1 82 TRP H . 590 . HN 1 1 146 1 1 1 1 82 TRP HA . 590 . HA 1 1 146 1 2 1 1 83 GLU H . 591 . HN 1 1 147 1 1 1 1 84 SER HA . 592 . HA 1 1 147 1 2 1 1 85 ASP H . 593 . HN 1 1 148 1 1 1 1 86 PRO HA . 594 . HA 1 1 148 1 2 1 1 87 ASN H . 595 . HN 1 1 149 1 1 1 1 86 PRO QB . 594 . HB# 1 1 149 1 2 1 1 87 ASN H . 595 . HN 1 1 150 1 1 1 1 86 PRO QG . 594 . HG# 1 1 150 1 2 1 1 87 ASN H . 595 . HN 1 1 151 1 1 1 1 86 PRO QD . 594 . HD# 1 1 151 1 2 1 1 87 ASN H . 595 . HN 1 1 152 1 1 1 1 87 ASN HA . 595 . HA 1 1 152 1 2 1 1 88 ARG H . 596 . HN 1 1 153 1 1 1 1 89 GLU HA . 597 . HA 1 1 153 1 2 1 1 90 TYR H . 598 . HN 1 1 154 1 1 1 1 90 TYR HA . 598 . HA 1 1 154 1 2 1 1 91 THR H . 599 . HN 1 1 155 1 1 1 1 91 THR HA . 599 . HA 1 1 155 1 2 1 1 92 VAL H . 600 . HN 1 1 156 1 1 1 1 91 THR MG . 599 . HG2# 1 1 156 1 2 1 1 92 VAL H . 600 . HN 1 1 157 1 1 1 1 93 PRO HA . 601 . HA 1 1 157 1 2 1 1 94 GLN H . 602 . HN 1 1 158 1 1 1 1 93 PRO QB . 601 . HB# 1 1 158 1 2 1 1 94 GLN H . 602 . HN 1 1 159 1 1 1 1 98 THR HA . 606 . HA 1 1 159 1 2 1 1 99 SER H . 607 . HN 1 1 160 1 1 1 1 98 THR MG . 606 . HG2# 1 1 160 1 2 1 1 99 SER H . 607 . HN 1 1 161 1 1 1 1 100 THR HA . 608 . HA 1 1 161 1 2 1 1 101 ALA H . 609 . HN 1 1 162 1 1 1 1 100 THR HB . 608 . HB 1 1 162 1 2 1 1 101 ALA H . 609 . HN 1 1 163 1 1 1 1 100 THR MG . 608 . HG2# 1 1 163 1 2 1 1 101 ALA H . 609 . HN 1 1 164 1 1 1 1 101 ALA HA . 609 . HA 1 1 164 1 2 1 1 102 THR H . 610 . HN 1 1 165 1 1 1 1 101 ALA MB . 609 . HB# 1 1 165 1 2 1 1 102 THR H . 610 . HN 1 1 166 1 1 1 1 102 THR HA . 610 . HA 1 1 166 1 2 1 1 103 VAL H . 611 . HN 1 1 167 1 1 1 1 102 THR MG . 610 . HG2# 1 1 167 1 2 1 1 103 VAL H . 611 . HN 1 1 168 1 1 1 1 103 VAL HA . 611 . HA 1 1 168 1 2 1 1 104 THR H . 612 . HN 1 1 169 1 1 1 1 103 VAL MG1 . 611 . HG1# 1 1 169 1 2 1 1 104 THR H . 612 . HN 1 1 170 1 1 1 1 104 THR HA . 612 . HA 1 1 170 1 2 1 1 105 ASP H . 613 . HN 1 1 171 1 1 1 1 104 THR HB . 612 . HB 1 1 171 1 2 1 1 105 ASP H . 613 . HN 1 1 172 1 1 1 1 104 THR MG . 612 . HG2# 1 1 172 1 2 1 1 105 ASP H . 613 . HN 1 1 173 1 1 1 1 105 ASP HA . 613 . HA 1 1 173 1 2 1 1 106 THR H . 614 . HN 1 1 174 1 1 1 1 106 THR HA . 614 . HA 1 1 174 1 2 1 1 107 TRP H . 615 . HN 1 1 175 1 1 1 1 107 TRP HA . 615 . HA 1 1 175 1 2 1 1 108 ARG H . 616 . HN 1 1 176 1 1 1 1 25 LEU QD . 533 . HD# 1 1 176 1 2 1 1 32 LEU QD . 540 . HD# 1 1 177 1 1 1 1 9 VAL MG1 . 517 . HG1# 1 1 177 1 2 1 1 103 VAL MG2 . 611 . HG2# 1 1 178 1 1 1 1 9 VAL MG2 . 517 . HG2# 1 1 178 1 2 1 1 103 VAL MG2 . 611 . HG2# 1 1 179 1 1 1 1 9 VAL MG1 . 517 . HG1# 1 1 179 1 2 1 1 103 VAL MG1 . 611 . HG1# 1 1 180 1 1 1 1 9 VAL MG2 . 517 . HG2# 1 1 180 1 2 1 1 103 VAL MG1 . 611 . HG1# 1 1 181 1 1 1 1 13 LEU QD . 521 . HD# 1 1 181 1 2 1 1 15 ALA MB . 523 . HB# 1 1 182 1 1 1 1 13 LEU QD . 521 . HD# 1 1 182 1 2 1 1 23 ILE MG . 531 . HG2# 1 1 183 1 1 1 1 13 LEU QD . 521 . HD# 1 1 183 1 2 1 1 23 ILE MD . 531 . HD# 1 1 184 1 1 1 1 32 LEU QD . 540 . HD# 1 1 184 1 2 1 1 61 LEU QD . 569 . HD# 1 1 185 1 1 1 1 32 LEU QD . 540 . HD# 1 1 185 1 2 1 1 61 LEU QB . 569 . HB# 1 1 186 1 1 1 1 72 ILE MG . 580 . HG2# 1 1 186 1 2 1 1 80 VAL MG1 . 588 . HG1# 1 1 187 1 1 1 1 72 ILE MD . 580 . HD# 1 1 187 1 2 1 1 80 VAL MG1 . 588 . HG1# 1 1 188 1 1 1 1 74 ILE MD . 582 . HD# 1 1 188 1 2 1 1 80 VAL MG1 . 588 . HG1# 1 1 189 1 1 1 1 15 ALA MB . 523 . HB# 1 1 189 1 2 1 1 23 ILE MD . 531 . HD# 1 1 190 1 1 1 1 25 LEU QD . 533 . HD# 1 1 190 1 2 1 1 41 ILE HB . 549 . HB 1 1 191 1 1 1 1 25 LEU QD . 533 . HD# 1 1 191 1 2 1 1 43 LEU QD . 551 . HD# 1 1 192 1 1 1 1 26 VAL QG . 534 . HG2# 1 1 192 1 2 1 1 72 ILE MG . 580 . HG2# 1 1 193 1 1 1 1 29 ILE QG . 537 . HG1# 1 1 193 1 2 1 1 61 LEU QD . 569 . HD# 1 1 194 1 1 1 1 43 LEU H . 551 . HN 1 1 194 1 2 1 1 44 SER H . 552 . HN 1 1 195 1 1 1 1 6 ALA H . 514 . HN 1 1 195 1 2 1 1 7 VAL H . 515 . HN 1 1 196 1 1 1 1 15 ALA H . 523 . HN 1 1 196 1 2 1 1 55 TRP HD1 . 563 . HD1 1 1 197 1 1 1 1 5 THR H . 513 . HN 1 1 197 1 2 1 1 6 ALA H . 514 . HN 1 1 198 1 1 1 1 44 SER H . 552 . HN 1 1 198 1 2 1 1 45 ALA H . 553 . HN 1 1 199 1 1 1 1 30 SER H . 538 . HN 1 1 199 1 2 1 1 31 GLN H . 539 . HN 1 1 200 1 1 1 1 10 THR H . 518 . HN 1 1 200 1 2 1 1 11 PHE H . 519 . HN 1 1 201 1 1 1 1 11 PHE H . 519 . HN 1 1 201 1 2 1 1 12 ASP H . 520 . HN 1 1 202 1 1 1 1 12 ASP H . 520 . HN 1 1 202 1 2 1 1 13 LEU H . 521 . HN 1 1 203 1 1 1 1 13 LEU H . 521 . HN 1 1 203 1 2 1 1 14 THR H . 522 . HN 1 1 204 1 1 1 1 105 ASP H . 613 . HN 1 1 204 1 2 1 1 106 THR H . 614 . HN 1 1 205 1 1 1 1 75 GLU H . 583 . HN 1 1 205 1 2 1 1 76 SER H . 584 . HN 1 1 206 1 1 1 1 24 TYR H . 532 . HN 1 1 206 1 2 1 1 25 LEU H . 533 . HN 1 1 207 1 1 1 1 14 THR H . 522 . HN 1 1 207 1 2 1 1 15 ALA H . 523 . HN 1 1 208 1 1 1 1 41 ILE H . 549 . HN 1 1 208 1 2 1 1 42 ALA H . 550 . HN 1 1 209 1 1 1 1 104 THR H . 612 . HN 1 1 209 1 2 1 1 105 ASP H . 613 . HN 1 1 210 1 1 1 1 103 VAL H . 611 . HN 1 1 210 1 2 1 1 104 THR H . 612 . HN 1 1 211 1 1 1 1 102 THR H . 610 . HN 1 1 211 1 2 1 1 103 VAL H . 611 . HN 1 1 212 1 1 1 1 106 THR H . 614 . HN 1 1 212 1 2 1 1 107 TRP H . 615 . HN 1 1 213 1 1 1 1 15 ALA H . 523 . HN 1 1 213 1 2 1 1 16 THR H . 524 . HN 1 1 214 1 1 1 1 84 SER H . 592 . HN 1 1 214 1 2 1 1 85 ASP H . 593 . HN 1 1 215 1 1 1 1 80 VAL H . 588 . HN 1 1 215 1 2 1 1 81 GLU H . 589 . HN 1 1 216 1 1 1 1 46 ASP H . 554 . HN 1 1 216 1 2 1 1 47 LYS H . 555 . HN 1 1 217 1 1 1 1 8 ALA H . 516 . HN 1 1 217 1 2 1 1 9 VAL H . 517 . HN 1 1 218 1 1 1 1 39 ASP H . 547 . HN 1 1 218 1 2 1 1 40 GLY H . 548 . HN 1 1 219 1 1 1 1 45 ALA H . 553 . HN 1 1 219 1 2 1 1 46 ASP H . 554 . HN 1 1 220 1 1 1 1 49 THR H . 557 . HN 1 1 220 1 2 1 1 50 SER H . 558 . HN 1 1 221 1 1 1 1 37 THR H . 545 . HN 1 1 221 1 2 1 1 38 SER H . 546 . HN 1 1 222 1 1 1 1 36 GLU H . 544 . HN 1 1 222 1 2 1 1 37 THR H . 545 . HN 1 1 223 1 1 1 1 99 SER H . 607 . HN 1 1 223 1 2 1 1 100 THR H . 608 . HN 1 1 224 1 1 1 1 79 SER H . 587 . HN 1 1 224 1 2 1 1 80 VAL H . 588 . HN 1 1 225 1 1 1 1 78 ASP H . 586 . HN 1 1 225 1 2 1 1 79 SER H . 587 . HN 1 1 226 1 1 1 1 20 GLY H . 528 . HN 1 1 226 1 2 1 1 21 GLU H . 529 . HN 1 1 227 1 1 1 1 42 ALA H . 550 . HN 1 1 227 1 2 1 1 43 LEU H . 551 . HN 1 1 228 1 1 1 1 38 SER H . 546 . HN 1 1 228 1 2 1 1 39 ASP H . 547 . HN 1 1 229 1 1 1 1 50 SER H . 558 . HN 1 1 229 1 2 1 1 51 SER H . 559 . HN 1 1 230 1 1 1 1 90 TYR QE . 598 . HE# 1 1 230 1 2 1 1 91 THR H . 599 . HN 1 1 231 1 1 1 1 90 TYR QD . 598 . HD# 1 1 231 1 2 1 1 91 THR H . 599 . HN 1 1 232 1 1 1 1 32 LEU H . 540 . HN 1 1 232 1 2 1 1 33 GLY H . 541 . HN 1 1 233 1 1 1 1 48 TYR H . 556 . HN 1 1 233 1 2 1 1 48 TYR QE . 556 . HE# 1 1 234 1 1 1 1 48 TYR H . 556 . HN 1 1 234 1 2 1 1 48 TYR QD . 556 . HD# 1 1 235 1 1 1 1 48 TYR QD . 556 . HD# 1 1 235 1 2 1 1 55 TRP HD1 . 563 . HD1 1 1 236 1 1 1 1 48 TYR QE . 556 . HE# 1 1 236 1 2 1 1 55 TRP HD1 . 563 . HD1 1 1 237 1 1 1 1 24 TYR QD . 532 . HD# 1 1 237 1 2 1 1 43 LEU H . 551 . HN 1 1 238 1 1 1 1 56 TYR HA . 564 . HA 1 1 238 1 2 1 1 56 TYR QD . 564 . HD# 1 1 239 1 1 1 1 56 TYR HA . 564 . HA 1 1 239 1 2 1 1 56 TYR QE . 564 . HE# 1 1 240 1 1 1 1 19 TYR H . 527 . HN 1 1 240 1 2 1 1 20 GLY H . 528 . HN 1 1 241 1 1 1 1 31 GLN H . 539 . HN 1 1 241 1 2 1 1 32 LEU H . 540 . HN 1 1 242 1 1 1 1 34 ASP H . 542 . HN 1 1 242 1 2 1 1 35 TRP H . 543 . HN 1 1 243 1 1 1 1 33 GLY H . 541 . HN 1 1 243 1 2 1 1 34 ASP H . 542 . HN 1 1 244 1 1 1 1 51 SER H . 559 . HN 1 1 244 1 2 1 1 52 ASP H . 560 . HN 1 1 245 1 1 1 1 35 TRP H . 543 . HN 1 1 245 1 2 1 1 36 GLU H . 544 . HN 1 1 246 1 1 1 1 48 TYR H . 556 . HN 1 1 246 1 2 1 1 49 THR H . 557 . HN 1 1 247 1 1 1 1 27 GLY H . 535 . HN 1 1 247 1 2 1 1 28 SER H . 536 . HN 1 1 248 1 1 1 1 77 ASP H . 585 . HN 1 1 248 1 2 1 1 78 ASP H . 586 . HN 1 1 249 1 1 1 1 40 GLY H . 548 . HN 1 1 249 1 2 1 1 41 ILE H . 549 . HN 1 1 250 1 1 1 1 31 GLN H . 539 . HN 1 1 250 1 2 1 1 33 GLY H . 541 . HN 1 1 251 1 1 1 1 82 TRP H . 590 . HN 1 1 251 1 2 1 1 83 GLU H . 591 . HN 1 1 252 1 1 1 1 83 GLU H . 591 . HN 1 1 252 1 2 1 1 84 SER H . 592 . HN 1 1 253 1 1 1 1 76 SER H . 584 . HN 1 1 253 1 2 1 1 77 ASP H . 585 . HN 1 1 254 1 1 1 1 47 LYS H . 555 . HN 1 1 254 1 2 1 1 48 TYR H . 556 . HN 1 1 255 1 1 1 1 48 TYR QD . 556 . HD# 1 1 255 1 2 1 1 49 THR H . 557 . HN 1 1 256 1 1 1 1 46 ASP H . 554 . HN 1 1 256 1 2 1 1 56 TYR QE . 564 . HE# 1 1 257 1 1 1 1 24 TYR QD . 532 . HD# 1 1 257 1 2 1 1 26 VAL H . 534 . HN 1 1 258 1 1 1 1 90 TYR H . 598 . HN 1 1 258 1 2 1 1 91 THR H . 599 . HN 1 1 259 1 1 1 1 56 TYR H . 564 . HN 1 1 259 1 2 1 1 56 TYR QD . 564 . HD# 1 1 260 1 1 1 1 56 TYR H . 564 . HN 1 1 260 1 2 1 1 56 TYR QE . 564 . HE# 1 1 261 1 1 1 1 56 TYR QD . 564 . HD# 1 1 261 1 2 1 1 57 VAL H . 565 . HN 1 1 262 1 1 1 1 56 TYR QE . 564 . HE# 1 1 262 1 2 1 1 57 VAL H . 565 . HN 1 1 263 1 1 1 1 24 TYR QD . 532 . HD# 1 1 263 1 2 1 1 42 ALA H . 550 . HN 1 1 264 1 1 1 1 91 THR H . 599 . HN 1 1 264 1 2 1 1 92 VAL H . 600 . HN 1 1 265 1 1 1 1 24 TYR QD . 532 . HD# 1 1 265 1 2 1 1 74 ILE H . 582 . HN 1 1 266 1 1 1 1 69 TYR H . 577 . HN 1 1 266 1 2 1 1 69 TYR QD . 577 . HD# 1 1 267 1 1 1 1 24 TYR H . 532 . HN 1 1 267 1 2 1 1 24 TYR QD . 532 . HD# 1 1 268 1 1 1 1 29 ILE H . 537 . HN 1 1 268 1 2 1 1 30 SER H . 538 . HN 1 1 269 1 1 1 1 24 TYR QD . 532 . HD# 1 1 269 1 2 1 1 25 LEU H . 533 . HN 1 1 270 1 1 1 1 11 PHE H . 519 . HN 1 1 270 1 2 1 1 11 PHE QD . 519 . HD# 1 1 271 1 1 1 1 11 PHE H . 519 . HN 1 1 271 1 2 1 1 11 PHE QE . 519 . HE# 1 1 272 1 1 1 1 48 TYR QD . 556 . HD# 1 1 272 1 2 1 1 55 TRP H . 563 . HN 1 1 273 1 1 1 1 48 TYR QE . 556 . HE# 1 1 273 1 2 1 1 55 TRP H . 563 . HN 1 1 274 1 1 1 1 47 LYS H . 555 . HN 1 1 274 1 2 1 1 56 TYR QD . 564 . HD# 1 1 275 1 1 1 1 47 LYS H . 555 . HN 1 1 275 1 2 1 1 56 TYR QE . 564 . HE# 1 1 276 1 1 1 1 47 LYS H . 555 . HN 1 1 276 1 2 1 1 48 TYR QD . 556 . HD# 1 1 277 1 1 1 1 69 TYR H . 577 . HN 1 1 277 1 2 1 1 70 LYS H . 578 . HN 1 1 278 1 1 1 1 75 GLU H . 583 . HN 1 1 278 1 2 1 1 79 SER H . 587 . HN 1 1 279 1 1 1 1 102 THR HA . 610 . HA 1 1 279 1 2 1 1 103 VAL HB . 611 . HB 1 1 280 1 1 1 1 25 LEU QB . 533 . HB# 1 1 280 1 2 1 1 69 TYR HA . 577 . HA 1 1 281 1 1 1 1 104 THR MG . 612 . HG2# 1 1 281 1 2 1 1 105 ASP HA . 613 . HA 1 1 282 1 1 1 1 25 LEU QB . 533 . HB# 1 1 282 1 2 1 1 71 PHE HA . 579 . HA 1 1 283 1 1 1 1 57 VAL MG2 . 565 . HG2# 1 1 283 1 2 1 1 58 THR HA . 566 . HA 1 1 284 1 1 1 1 9 VAL MG2 . 517 . HG2# 1 1 284 1 2 1 1 100 THR HA . 608 . HA 1 1 285 1 1 1 1 9 VAL MG1 . 517 . HG1# 1 1 285 1 2 1 1 100 THR HA . 608 . HA 1 1 286 1 1 1 1 10 THR HA . 518 . HA 1 1 286 1 2 1 1 58 THR MG . 566 . HG2# 1 1 287 1 1 1 1 58 THR HA . 566 . HA 1 1 287 1 2 1 1 59 VAL QG . 567 . HG# 1 1 288 1 1 1 1 25 LEU HG . 533 . HG 1 1 288 1 2 1 1 69 TYR HA . 577 . HA 1 1 289 1 1 1 1 25 LEU HG . 533 . HG 1 1 289 1 2 1 1 71 PHE HA . 579 . HA 1 1 290 1 1 1 1 66 SER HA . 574 . HA 1 1 290 1 2 1 1 91 THR MG . 599 . HG2# 1 1 291 1 1 1 1 102 THR HA . 610 . HA 1 1 291 1 2 1 1 103 VAL MG1 . 611 . HG1# 1 1 292 1 1 1 1 102 THR HA . 610 . HA 1 1 292 1 2 1 1 103 VAL MG2 . 611 . HG2# 1 1 293 1 1 1 1 22 ASN HA . 530 . HA 1 1 293 1 2 1 1 23 ILE MG . 531 . HG2# 1 1 294 1 1 1 1 25 LEU QD . 533 . HD# 1 1 294 1 2 1 1 69 TYR HA . 577 . HA 1 1 295 1 1 1 1 22 ASN HA . 530 . HA 1 1 295 1 2 1 1 23 ILE MD . 531 . HD# 1 1 296 1 1 1 1 25 LEU QD . 533 . HD# 1 1 296 1 2 1 1 71 PHE HA . 579 . HA 1 1 297 1 1 1 1 68 GLU HA . 576 . HA 1 1 297 1 2 1 1 69 TYR HA . 577 . HA 1 1 298 1 1 1 1 104 THR HA . 612 . HA 1 1 298 1 2 1 1 105 ASP HA . 613 . HA 1 1 299 1 1 1 1 72 ILE HA . 580 . HA 1 1 299 1 2 1 1 73 ARG HA . 581 . HA 1 1 300 1 1 1 1 58 THR HA . 566 . HA 1 1 300 1 2 1 1 59 VAL HA . 567 . HA 1 1 301 1 1 1 1 57 VAL HA . 565 . HA 1 1 301 1 2 1 1 58 THR HA . 566 . HA 1 1 302 1 1 1 1 9 VAL HA . 517 . HA 1 1 302 1 2 1 1 100 THR HA . 608 . HA 1 1 303 1 1 1 1 13 LEU HA . 521 . HA 1 1 303 1 2 1 1 106 THR HB . 614 . HB 1 1 304 1 1 1 1 66 SER HA . 574 . HA 1 1 304 1 2 1 1 91 THR HB . 599 . HB 1 1 305 1 1 1 1 12 ASP HA . 520 . HA 1 1 305 1 2 1 1 56 TYR HB3 . 564 . HB1 1 1 306 1 1 1 1 12 ASP HA . 520 . HA 1 1 306 1 2 1 1 56 TYR HB2 . 564 . HB2 1 1 307 1 1 1 1 68 GLU HA . 576 . HA 1 1 307 1 2 1 1 69 TYR QB . 577 . HB# 1 1 308 1 1 1 1 68 GLU HA . 576 . HA 1 1 308 1 2 1 1 89 GLU QG . 597 . HG# 1 1 309 1 1 1 1 68 GLU HA . 576 . HA 1 1 309 1 2 1 1 89 GLU QB . 597 . HB# 1 1 310 1 1 1 1 58 THR HA . 566 . HA 1 1 310 1 2 1 1 59 VAL HB . 567 . HB 1 1 311 1 1 1 1 68 GLU QB . 576 . HB# 1 1 311 1 2 1 1 89 GLU HA . 597 . HA 1 1 312 1 1 1 1 72 ILE QG . 580 . HG1# 1 1 312 1 2 1 1 82 TRP HE1 . 590 . HE1 1 1 313 1 1 1 1 72 ILE MG . 580 . HG2# 1 1 313 1 2 1 1 82 TRP HE1 . 590 . HE1 1 1 314 1 1 1 1 72 ILE MD . 580 . HD# 1 1 314 1 2 1 1 82 TRP HE1 . 590 . HE1 1 1 315 1 1 1 1 80 VAL HB . 588 . HB 1 1 315 1 2 1 1 82 TRP HE1 . 590 . HE1 1 1 316 1 1 1 1 80 VAL MG1 . 588 . HG1# 1 1 316 1 2 1 1 82 TRP HE1 . 590 . HE1 1 1 317 1 1 1 1 80 VAL MG2 . 588 . HG2# 1 1 317 1 2 1 1 82 TRP HE1 . 590 . HE1 1 1 318 1 1 1 1 28 SER H . 536 . HN 1 1 318 1 2 1 1 35 TRP HE1 . 543 . HE1 1 1 319 1 1 1 1 28 SER HA . 536 . HA 1 1 319 1 2 1 1 35 TRP HE1 . 543 . HE1 1 1 320 1 1 1 1 29 ILE HA . 537 . HA 1 1 320 1 2 1 1 35 TRP HE1 . 543 . HE1 1 1 321 1 1 1 1 83 GLU HA . 591 . HA 1 1 321 1 2 1 1 107 TRP HE1 . 615 . HE1 1 1 322 1 1 1 1 36 GLU HA . 544 . HA 1 1 322 1 2 1 1 38 SER H . 546 . HN 1 1 323 1 1 1 1 21 GLU HA . 529 . HA 1 1 323 1 2 1 1 76 SER H . 584 . HN 1 1 324 1 1 1 1 45 ALA HA . 553 . HA 1 1 324 1 2 1 1 47 LYS H . 555 . HN 1 1 325 1 1 1 1 44 SER HA . 552 . HA 1 1 325 1 2 1 1 46 ASP H . 554 . HN 1 1 326 1 1 1 1 14 THR HB . 522 . HB 1 1 326 1 2 1 1 107 TRP H . 615 . HN 1 1 327 1 1 1 1 44 SER H . 552 . HN 1 1 327 1 2 1 1 57 VAL HB . 565 . HB 1 1 328 1 1 1 1 44 SER H . 552 . HN 1 1 328 1 2 1 1 57 VAL MG1 . 565 . HG1# 1 1 329 1 1 1 1 44 SER H . 552 . HN 1 1 329 1 2 1 1 57 VAL MG2 . 565 . HG2# 1 1 330 1 1 1 1 43 LEU HG . 551 . HG 1 1 330 1 2 1 1 58 THR H . 566 . HN 1 1 331 1 1 1 1 36 GLU HB3 . 544 . HB1 1 1 331 1 2 1 1 38 SER H . 546 . HN 1 1 332 1 1 1 1 36 GLU HB2 . 544 . HB2 1 1 332 1 2 1 1 38 SER H . 546 . HN 1 1 333 1 1 1 1 36 GLU QG . 544 . HG# 1 1 333 1 2 1 1 38 SER H . 546 . HN 1 1 334 1 1 1 1 23 ILE MD . 531 . HD# 1 1 334 1 2 1 1 55 TRP HE1 . 563 . HE1 1 1 335 1 1 1 1 13 LEU QD . 521 . HD# 1 1 335 1 2 1 1 15 ALA H . 523 . HN 1 1 336 1 1 1 1 13 LEU QD . 521 . HD# 1 1 336 1 2 1 1 105 ASP H . 613 . HN 1 1 337 1 1 1 1 23 ILE MD . 531 . HD# 1 1 337 1 2 1 1 74 ILE H . 582 . HN 1 1 338 1 1 1 1 28 SER H . 536 . HN 1 1 338 1 2 1 1 32 LEU QD . 540 . HD# 1 1 339 1 1 1 1 9 VAL MG1 . 517 . HG1# 1 1 339 1 2 1 1 102 THR H . 610 . HN 1 1 340 1 1 1 1 13 LEU QD . 521 . HD# 1 1 340 1 2 1 1 107 TRP H . 615 . HN 1 1 341 1 1 1 1 11 PHE QD . 519 . HD# 1 1 341 1 2 1 1 58 THR HA . 566 . HA 1 1 342 1 1 1 1 22 ASN HA . 530 . HA 1 1 342 1 2 1 1 24 TYR QD . 532 . HD# 1 1 343 1 1 1 1 29 ILE HA . 537 . HA 1 1 343 1 2 1 1 35 TRP HD1 . 543 . HD1 1 1 344 1 1 1 1 23 ILE HA . 531 . HA 1 1 344 1 2 1 1 24 TYR QD . 532 . HD# 1 1 345 1 1 1 1 37 THR HA . 545 . HA 1 1 345 1 2 1 1 39 ASP H . 547 . HN 1 1 346 1 1 1 1 28 SER HA . 536 . HA 1 1 346 1 2 1 1 35 TRP HD1 . 543 . HD1 1 1 347 1 1 1 1 28 SER QB . 536 . HB# 1 1 347 1 2 1 1 35 TRP HD1 . 543 . HD1 1 1 348 1 1 1 1 27 GLY QA . 535 . HA# 1 1 348 1 2 1 1 69 TYR QD . 577 . HD# 1 1 349 1 1 1 1 90 TYR QD . 598 . HD# 1 1 349 1 2 1 1 92 VAL HA . 600 . HA 1 1 350 1 1 1 1 24 TYR QD . 532 . HD# 1 1 350 1 2 1 1 25 LEU HA . 533 . HA 1 1 351 1 1 1 1 24 TYR QD . 532 . HD# 1 1 351 1 2 1 1 41 ILE HA . 549 . HA 1 1 352 1 1 1 1 24 TYR QD . 532 . HD# 1 1 352 1 2 1 1 40 GLY QA . 548 . HA# 1 1 353 1 1 1 1 24 TYR QD . 532 . HD# 1 1 353 1 2 1 1 42 ALA HA . 550 . HA 1 1 354 1 1 1 1 24 TYR QD . 532 . HD# 1 1 354 1 2 1 1 42 ALA MB . 550 . HB# 1 1 355 1 1 1 1 24 TYR QD . 532 . HD# 1 1 355 1 2 1 1 74 ILE HB . 582 . HB 1 1 356 1 1 1 1 90 TYR QE . 598 . HE# 1 1 356 1 2 1 1 92 VAL HA . 600 . HA 1 1 357 1 1 1 1 90 TYR QE . 598 . HE# 1 1 357 1 2 1 1 92 VAL HB . 600 . HB 1 1 358 1 1 1 1 26 VAL HB . 534 . HB 1 1 358 1 2 1 1 36 GLU H . 544 . HN 1 1 359 1 1 1 1 80 VAL HB . 588 . HB 1 1 359 1 2 1 1 82 TRP HD1 . 590 . HD1 1 1 360 1 1 1 1 81 GLU QB . 589 . HB# 1 1 360 1 2 1 1 82 TRP HD1 . 590 . HD1 1 1 361 1 1 1 1 81 GLU QG . 589 . HG# 1 1 361 1 2 1 1 82 TRP HD1 . 590 . HD1 1 1 362 1 1 1 1 90 TYR QD . 598 . HD# 1 1 362 1 2 1 1 92 VAL MG1 . 600 . HG1# 1 1 363 1 1 1 1 90 TYR QD . 598 . HD# 1 1 363 1 2 1 1 92 VAL MG2 . 600 . HG2# 1 1 364 1 1 1 1 90 TYR QE . 598 . HE# 1 1 364 1 2 1 1 92 VAL MG1 . 600 . HG1# 1 1 365 1 1 1 1 90 TYR QE . 598 . HE# 1 1 365 1 2 1 1 92 VAL MG2 . 600 . HG2# 1 1 366 1 1 1 1 43 LEU QB . 551 . HB# 1 1 366 1 2 1 1 56 TYR QD . 564 . HD# 1 1 367 1 1 1 1 43 LEU QB . 551 . HB# 1 1 367 1 2 1 1 56 TYR QE . 564 . HE# 1 1 368 1 1 1 1 12 ASP HB3 . 520 . HB1 1 1 368 1 2 1 1 56 TYR HA . 564 . HA 1 1 369 1 1 1 1 22 ASN QB . 530 . HB# 1 1 369 1 2 1 1 24 TYR QD . 532 . HD# 1 1 370 1 1 1 1 26 VAL QG . 534 . HG1# 1 1 370 1 2 1 1 36 GLU H . 544 . HN 1 1 371 1 1 1 1 23 ILE MD . 531 . HD# 1 1 371 1 2 1 1 55 TRP HD1 . 563 . HD1 1 1 372 1 1 1 1 13 LEU QD . 521 . HD# 1 1 372 1 2 1 1 55 TRP HD1 . 563 . HD1 1 1 373 1 1 1 1 31 GLN QE . 539 . HE2# 1 1 373 1 2 1 1 32 LEU QD . 540 . HD# 1 1 374 1 1 1 1 31 GLN QE . 539 . HE2# 1 1 374 1 2 1 1 61 LEU QD . 569 . HD# 1 1 375 1 1 1 1 26 VAL QG . 534 . HG1# 1 1 375 1 2 1 1 35 TRP H . 543 . HN 1 1 376 1 1 1 1 26 VAL QG . 534 . HG1# 1 1 376 1 2 1 1 35 TRP HZ2 . 543 . HZ2 1 1 377 1 1 1 1 26 VAL QG . 534 . HG1# 1 1 377 1 2 1 1 35 TRP HE3 . 543 . HE3 1 1 378 1 1 1 1 26 VAL QG . 534 . HG1# 1 1 378 1 2 1 1 35 TRP HD1 . 543 . HD1 1 1 379 1 1 1 1 26 VAL QG . 534 . HG1# 1 1 379 1 2 1 1 82 TRP HZ2 . 590 . HZ2 1 1 380 1 1 1 1 26 VAL QG . 534 . HG1# 1 1 380 1 2 1 1 82 TRP HZ3 . 590 . HZ3 1 1 381 1 1 1 1 26 VAL QG . 534 . HG1# 1 1 381 1 2 1 1 82 TRP HH2 . 590 . HH2 1 1 382 1 1 1 1 72 ILE MD . 580 . HD# 1 1 382 1 2 1 1 82 TRP HD1 . 590 . HD1 1 1 383 1 1 1 1 72 ILE MD . 580 . HD# 1 1 383 1 2 1 1 82 TRP HE3 . 590 . HE3 1 1 384 1 1 1 1 72 ILE MD . 580 . HD# 1 1 384 1 2 1 1 82 TRP HZ2 . 590 . HZ2 1 1 385 1 1 1 1 72 ILE MD . 580 . HD# 1 1 385 1 2 1 1 82 TRP HH2 . 590 . HH2 1 1 386 1 1 1 1 23 ILE MD . 531 . HD# 1 1 386 1 2 1 1 107 TRP HZ2 . 615 . HZ2 1 1 387 1 1 1 1 72 ILE MG . 580 . HG2# 1 1 387 1 2 1 1 82 TRP HD1 . 590 . HD1 1 1 388 1 1 1 1 80 VAL MG1 . 588 . HG1# 1 1 388 1 2 1 1 82 TRP HD1 . 590 . HD1 1 1 389 1 1 1 1 80 VAL MG2 . 588 . HG2# 1 1 389 1 2 1 1 82 TRP HD1 . 590 . HD1 1 1 390 1 1 1 1 23 ILE MD . 531 . HD# 1 1 390 1 2 1 1 107 TRP HZ3 . 615 . HZ3 1 1 391 1 1 1 1 11 PHE QD . 519 . HD# 1 1 391 1 2 1 1 103 VAL MG1 . 611 . HG1# 1 1 392 1 1 1 1 11 PHE QD . 519 . HD# 1 1 392 1 2 1 1 103 VAL MG2 . 611 . HG2# 1 1 393 1 1 1 1 90 TYR QD . 598 . HD# 1 1 393 1 2 1 1 103 VAL MG2 . 611 . HG2# 1 1 394 1 1 1 1 9 VAL MG1 . 517 . HG1# 1 1 394 1 2 1 1 11 PHE QD . 519 . HD# 1 1 395 1 1 1 1 11 PHE QD . 519 . HD# 1 1 395 1 2 1 1 32 LEU QD . 540 . HD# 1 1 396 1 1 1 1 9 VAL MG1 . 517 . HG1# 1 1 396 1 2 1 1 90 TYR QD . 598 . HD# 1 1 397 1 1 1 1 32 LEU QD . 540 . HD# 1 1 397 1 2 1 1 69 TYR QD . 577 . HD# 1 1 398 1 1 1 1 32 LEU QD . 540 . HD# 1 1 398 1 2 1 1 69 TYR QE . 577 . HE# 1 1 399 1 1 1 1 11 PHE QD . 519 . HD# 1 1 399 1 2 1 1 13 LEU QD . 521 . HD# 1 1 400 1 1 1 1 72 ILE MD . 580 . HD# 1 1 400 1 2 1 1 82 TRP HZ3 . 590 . HZ3 1 1 401 1 1 1 1 61 LEU QD . 569 . HD# 1 1 401 1 2 1 1 69 TYR QD . 577 . HD# 1 1 402 1 1 1 1 61 LEU QD . 569 . HD# 1 1 402 1 2 1 1 69 TYR QE . 577 . HE# 1 1 403 1 1 1 1 11 PHE QD . 519 . HD# 1 1 403 1 2 1 1 41 ILE MG . 549 . HG2# 1 1 404 1 1 1 1 11 PHE QD . 519 . HD# 1 1 404 1 2 1 1 41 ILE MD . 549 . HD# 1 1 405 1 1 1 1 90 TYR QE . 598 . HE# 1 1 405 1 2 1 1 103 VAL MG1 . 611 . HG1# 1 1 406 1 1 1 1 90 TYR QE . 598 . HE# 1 1 406 1 2 1 1 103 VAL MG2 . 611 . HG2# 1 1 407 1 1 1 1 11 PHE QE . 519 . HE# 1 1 407 1 2 1 1 103 VAL MG1 . 611 . HG1# 1 1 408 1 1 1 1 11 PHE QE . 519 . HE# 1 1 408 1 2 1 1 103 VAL MG2 . 611 . HG2# 1 1 409 1 1 1 1 11 PHE HZ . 519 . HZ 1 1 409 1 2 1 1 103 VAL MG2 . 611 . HG2# 1 1 410 1 1 1 1 11 PHE QE . 519 . HE# 1 1 410 1 2 1 1 25 LEU QD . 533 . HD# 1 1 411 1 1 1 1 22 ASN QD . 530 . HD2# 1 1 411 1 2 1 1 25 LEU QD . 533 . HD# 1 1 412 1 1 1 1 9 VAL MG1 . 517 . HG1# 1 1 412 1 2 1 1 90 TYR QE . 598 . HE# 1 1 413 1 1 1 1 9 VAL MG1 . 517 . HG1# 1 1 413 1 2 1 1 11 PHE HZ . 519 . HZ 1 1 414 1 1 1 1 9 VAL MG1 . 517 . HG1# 1 1 414 1 2 1 1 11 PHE QE . 519 . HE# 1 1 415 1 1 1 1 11 PHE HZ . 519 . HZ 1 1 415 1 2 1 1 32 LEU QD . 540 . HD# 1 1 416 1 1 1 1 11 PHE QE . 519 . HE# 1 1 416 1 2 1 1 32 LEU QD . 540 . HD# 1 1 417 1 1 1 1 29 ILE H . 537 . HN 1 1 417 1 2 1 1 32 LEU QD . 540 . HD# 1 1 418 1 1 1 1 29 ILE H . 537 . HN 1 1 418 1 2 1 1 61 LEU QD . 569 . HD# 1 1 419 1 1 1 1 11 PHE QE . 519 . HE# 1 1 419 1 2 1 1 41 ILE MG . 549 . HG2# 1 1 420 1 1 1 1 11 PHE QE . 519 . HE# 1 1 420 1 2 1 1 41 ILE MD . 549 . HD# 1 1 421 1 1 1 1 11 PHE HZ . 519 . HZ 1 1 421 1 2 1 1 41 ILE MG . 549 . HG2# 1 1 422 1 1 1 1 11 PHE HZ . 519 . HZ 1 1 422 1 2 1 1 41 ILE MD . 549 . HD# 1 1 423 1 1 1 1 11 PHE QD . 519 . HD# 1 1 423 1 2 1 1 43 LEU QB . 551 . HB# 1 1 424 1 1 1 1 9 VAL HB . 517 . HB 1 1 424 1 2 1 1 11 PHE QD . 519 . HD# 1 1 425 1 1 1 1 23 ILE MD . 531 . HD# 1 1 425 1 2 1 1 73 ARG HA . 581 . HA 1 1 426 1 1 1 1 23 ILE MD . 531 . HD# 1 1 426 1 2 1 1 54 LEU QD . 562 . HD# 1 1 427 1 1 1 1 72 ILE MG . 580 . HG2# 1 1 427 1 2 1 1 82 TRP HA . 590 . HA 1 1 428 1 1 1 1 13 LEU QD . 521 . HD# 1 1 428 1 2 1 1 43 LEU QD . 551 . HD# 1 1 429 1 1 1 1 11 PHE QB . 519 . HB# 1 1 429 1 2 1 1 25 LEU QD . 533 . HD# 1 1 430 1 1 1 1 13 LEU QD . 521 . HD# 1 1 430 1 2 1 1 55 TRP QB . 563 . HB# 1 1 431 1 1 1 1 13 LEU QD . 521 . HD# 1 1 431 1 2 1 1 14 THR HA . 522 . HA 1 1 432 1 1 1 1 61 LEU QD . 569 . HD# 1 1 432 1 2 1 1 92 VAL MG1 . 600 . HG1# 1 1 433 1 1 1 1 29 ILE QG . 537 . HG1# 1 1 433 1 2 1 1 32 LEU QD . 540 . HD# 1 1 434 1 1 1 1 26 VAL HA . 534 . HA 1 1 434 1 2 1 1 32 LEU QD . 540 . HD# 1 1 435 1 1 1 1 45 ALA MB . 553 . HB# 1 1 435 1 2 1 1 48 TYR QB . 556 . HB# 1 1 436 1 1 1 1 26 VAL HB . 534 . HB 1 1 436 1 2 1 1 37 THR HA . 545 . HA 1 1 437 1 1 1 1 26 VAL QG . 534 . HG1# 1 1 437 1 2 1 1 37 THR HA . 545 . HA 1 1 438 1 1 1 1 26 VAL HB . 534 . HB 1 1 438 1 2 1 1 40 GLY H . 548 . HN 1 1 439 1 1 1 1 26 VAL QG . 534 . HG1# 1 1 439 1 2 1 1 40 GLY H . 548 . HN 1 1 440 1 1 1 1 37 THR HA . 545 . HA 1 1 440 1 2 1 1 40 GLY H . 548 . HN 1 1 441 1 1 1 1 33 GLY H . 541 . HN 1 1 441 1 2 1 1 37 THR HA . 545 . HA 1 1 442 1 1 1 1 37 THR HA . 545 . HA 1 1 442 1 2 1 1 40 GLY QA . 548 . HA# 1 1 443 1 1 1 1 26 VAL HA . 534 . HA 1 1 443 1 2 1 1 37 THR HA . 545 . HA 1 1 444 1 1 1 1 36 GLU HA . 544 . HA 1 1 444 1 2 1 1 37 THR HA . 545 . HA 1 1 445 1 1 1 1 29 ILE MD . 537 . HD# 1 1 445 1 2 1 1 31 GLN HB3 . 539 . HB1 1 1 446 1 1 1 1 29 ILE MD . 537 . HD# 1 1 446 1 2 1 1 31 GLN HB2 . 539 . HB2 1 1 447 1 1 1 1 24 TYR QB . 532 . HB# 1 1 447 1 2 1 1 72 ILE MD . 580 . HD# 1 1 448 1 1 1 1 61 LEU HA . 569 . HA 1 1 448 1 2 1 1 62 PRO QD . 570 . HD# 1 1 449 1 1 1 1 61 LEU QD . 569 . HD# 1 1 449 1 2 1 1 62 PRO QD . 570 . HD# 1 1 450 1 1 1 1 37 THR HA . 545 . HA 1 1 450 1 2 1 1 72 ILE MD . 580 . HD# 1 1 451 1 1 1 1 74 ILE MD . 582 . HD# 1 1 451 1 2 1 1 79 SER QB . 587 . HB# 1 1 452 1 1 1 1 45 ALA MB . 553 . HB# 1 1 452 1 2 1 1 52 ASP HA . 560 . HA 1 1 453 1 1 1 1 12 ASP HA . 520 . HA 1 1 453 1 2 1 1 57 VAL MG1 . 565 . HG1# 1 1 454 1 1 1 1 24 TYR HA . 532 . HA 1 1 454 1 2 1 1 43 LEU QD . 551 . HD# 1 1 455 1 1 1 1 8 ALA MB . 516 . HB# 1 1 455 1 2 1 1 100 THR HA . 608 . HA 1 1 456 1 1 1 1 7 VAL MG1 . 515 . HG1# 1 1 456 1 2 1 1 100 THR HA . 608 . HA 1 1 457 1 1 1 1 23 ILE MD . 531 . HD# 1 1 457 1 2 1 1 71 PHE QE . 579 . HE# 1 1 458 1 1 1 1 23 ILE MD . 531 . HD# 1 1 458 1 2 1 1 71 PHE HZ . 579 . HZ 1 1 459 1 1 1 1 11 PHE QE . 519 . HE# 1 1 459 1 2 1 1 59 VAL HB . 567 . HB 1 1 460 1 1 1 1 11 PHE QE . 519 . HE# 1 1 460 1 2 1 1 59 VAL QG . 567 . HG# 1 1 461 1 1 1 1 9 VAL HB . 517 . HB 1 1 461 1 2 1 1 11 PHE QE . 519 . HE# 1 1 462 1 1 1 1 9 VAL MG2 . 517 . HG2# 1 1 462 1 2 1 1 11 PHE QE . 519 . HE# 1 1 463 1 1 1 1 12 ASP H . 520 . HN 1 1 463 1 2 1 1 12 ASP HB3 . 520 . HB1 1 1 464 1 1 1 1 12 ASP H . 520 . HN 1 1 464 1 2 1 1 12 ASP HB2 . 520 . HB2 1 1 465 1 1 1 1 19 TYR H . 527 . HN 1 1 465 1 2 1 1 19 TYR HB3 . 527 . HB1 1 1 466 1 1 1 1 19 TYR H . 527 . HN 1 1 466 1 2 1 1 19 TYR HB2 . 527 . HB2 1 1 467 1 1 1 1 21 GLU H . 529 . HN 1 1 467 1 2 1 1 21 GLU HB2 . 529 . HB2 1 1 468 1 1 1 1 31 GLN HA . 539 . HA 1 1 468 1 2 1 1 31 GLN HB3 . 539 . HB1 1 1 469 1 1 1 1 31 GLN HA . 539 . HA 1 1 469 1 2 1 1 31 GLN HB2 . 539 . HB2 1 1 470 1 1 1 1 31 GLN H . 539 . HN 1 1 470 1 2 1 1 31 GLN HB3 . 539 . HB1 1 1 471 1 1 1 1 31 GLN H . 539 . HN 1 1 471 1 2 1 1 31 GLN HB2 . 539 . HB2 1 1 472 1 1 1 1 36 GLU HA . 544 . HA 1 1 472 1 2 1 1 36 GLU HB3 . 544 . HB1 1 1 473 1 1 1 1 36 GLU HA . 544 . HA 1 1 473 1 2 1 1 36 GLU HB2 . 544 . HB2 1 1 474 1 1 1 1 36 GLU H . 544 . HN 1 1 474 1 2 1 1 36 GLU HB3 . 544 . HB1 1 1 475 1 1 1 1 36 GLU H . 544 . HN 1 1 475 1 2 1 1 36 GLU HB2 . 544 . HB2 1 1 476 1 1 1 1 44 SER HA . 552 . HA 1 1 476 1 2 1 1 44 SER HB3 . 552 . HB1 1 1 477 1 1 1 1 44 SER HA . 552 . HA 1 1 477 1 2 1 1 44 SER HB2 . 552 . HB2 1 1 478 1 1 1 1 44 SER H . 552 . HN 1 1 478 1 2 1 1 44 SER HB3 . 552 . HB1 1 1 479 1 1 1 1 44 SER H . 552 . HN 1 1 479 1 2 1 1 44 SER HB2 . 552 . HB2 1 1 480 1 1 1 1 56 TYR HA . 564 . HA 1 1 480 1 2 1 1 56 TYR HB3 . 564 . HB1 1 1 481 1 1 1 1 56 TYR H . 564 . HN 1 1 481 1 2 1 1 56 TYR HB2 . 564 . HB2 1 1 482 1 1 1 1 77 ASP HA . 585 . HA 1 1 482 1 2 1 1 77 ASP HB3 . 585 . HB1 1 1 483 1 1 1 1 77 ASP HA . 585 . HA 1 1 483 1 2 1 1 77 ASP HB2 . 585 . HB2 1 1 484 1 1 1 1 77 ASP H . 585 . HN 1 1 484 1 2 1 1 77 ASP HB3 . 585 . HB1 1 1 485 1 1 1 1 77 ASP H . 585 . HN 1 1 485 1 2 1 1 77 ASP HB2 . 585 . HB2 1 1 486 1 1 1 1 9 VAL MG1 . 517 . HG1# 1 1 486 1 2 1 1 101 ALA H . 609 . HN 1 1 487 1 1 1 1 9 VAL MG2 . 517 . HG2# 1 1 487 1 2 1 1 101 ALA H . 609 . HN 1 1 488 1 1 1 1 54 LEU QD . 562 . HD# 1 1 488 1 2 1 1 55 TRP HD1 . 563 . HD1 1 1 489 1 1 1 1 15 ALA MB . 523 . HB# 1 1 489 1 2 1 1 55 TRP HD1 . 563 . HD1 1 1 490 1 1 1 1 15 ALA MB . 523 . HB# 1 1 490 1 2 1 1 107 TRP HD1 . 615 . HD1 1 1 491 1 1 1 1 54 LEU HA . 562 . HA 1 1 491 1 2 1 1 55 TRP HD1 . 563 . HD1 1 1 492 1 1 1 1 14 THR HA . 522 . HA 1 1 492 1 2 1 1 55 TRP HD1 . 563 . HD1 1 1 493 1 1 1 1 18 THR HA . 526 . HA 1 1 493 1 2 1 1 51 SER H . 559 . HN 1 1 494 1 1 1 1 22 ASN HA . 530 . HA 1 1 494 1 2 1 1 55 TRP HE3 . 563 . HE3 1 1 495 1 1 1 1 22 ASN HA . 530 . HA 1 1 495 1 2 1 1 55 TRP HZ3 . 563 . HZ3 1 1 496 1 1 1 1 22 ASN HA . 530 . HA 1 1 496 1 2 1 1 55 TRP HH2 . 563 . HH2 1 1 497 1 1 1 1 22 ASN HA . 530 . HA 1 1 497 1 2 1 1 55 TRP HZ2 . 563 . HZ2 1 1 498 1 1 1 1 71 PHE QE . 579 . HE# 1 1 498 1 2 1 1 72 ILE HA . 580 . HA 1 1 499 1 1 1 1 71 PHE QD . 579 . HD# 1 1 499 1 2 1 1 72 ILE HA . 580 . HA 1 1 500 1 1 1 1 71 PHE HZ . 579 . HZ 1 1 500 1 2 1 1 72 ILE HA . 580 . HA 1 1 501 1 1 1 1 72 ILE HA . 580 . HA 1 1 501 1 2 1 1 82 TRP HD1 . 590 . HD1 1 1 502 1 1 1 1 23 ILE H . 531 . HN 1 1 502 1 2 1 1 55 TRP HZ3 . 563 . HZ3 1 1 503 1 1 1 1 23 ILE H . 531 . HN 1 1 503 1 2 1 1 55 TRP HH2 . 563 . HH2 1 1 504 1 1 1 1 23 ILE H . 531 . HN 1 1 504 1 2 1 1 55 TRP HZ2 . 563 . HZ2 1 1 505 1 1 1 1 107 TRP HD1 . 615 . HD1 1 1 505 1 2 1 1 108 ARG H . 616 . HN 1 1 506 1 1 1 1 23 ILE MD . 531 . HD# 1 1 506 1 2 1 1 107 TRP HE3 . 615 . HE3 1 1 507 1 1 1 1 23 ILE MD . 531 . HD# 1 1 507 1 2 1 1 71 PHE QD . 579 . HD# 1 1 508 1 1 1 1 23 ILE MD . 531 . HD# 1 1 508 1 2 1 1 107 TRP HH2 . 615 . HH2 1 1 509 1 1 1 1 23 ILE MD . 531 . HD# 1 1 509 1 2 1 1 55 TRP HH2 . 563 . HH2 1 1 510 1 1 1 1 23 ILE MD . 531 . HD# 1 1 510 1 2 1 1 55 TRP HZ2 . 563 . HZ2 1 1 511 1 1 1 1 74 ILE MD . 582 . HD# 1 1 511 1 2 1 1 80 VAL H . 588 . HN 1 1 512 1 1 1 1 7 VAL MG1 . 515 . HG1# 1 1 512 1 2 1 1 100 THR H . 608 . HN 1 1 513 1 1 1 1 36 GLU HB3 . 544 . HB1 1 1 513 1 2 1 1 39 ASP H . 547 . HN 1 1 514 1 1 1 1 36 GLU HB2 . 544 . HB2 1 1 514 1 2 1 1 39 ASP H . 547 . HN 1 1 515 1 1 1 1 36 GLU QG . 544 . HG# 1 1 515 1 2 1 1 39 ASP H . 547 . HN 1 1 516 1 1 1 1 14 THR H . 522 . HN 1 1 516 1 2 1 1 106 THR MG . 614 . HG2# 1 1 517 1 1 1 1 13 LEU QD . 521 . HD# 1 1 517 1 2 1 1 107 TRP HH2 . 615 . HH2 1 1 518 1 1 1 1 13 LEU QD . 521 . HD# 1 1 518 1 2 1 1 107 TRP HE3 . 615 . HE3 1 1 519 1 1 1 1 25 LEU QD . 533 . HD# 1 1 519 1 2 1 1 69 TYR QD . 577 . HD# 1 1 520 1 1 1 1 54 LEU QD . 562 . HD# 1 1 520 1 2 1 1 56 TYR QD . 564 . HD# 1 1 521 1 1 1 1 54 LEU QD . 562 . HD# 1 1 521 1 2 1 1 56 TYR QE . 564 . HE# 1 1 522 1 1 1 1 23 ILE HA . 531 . HA 1 1 522 1 2 1 1 72 ILE QG . 580 . HG1# 1 1 523 1 1 1 1 44 SER HB3 . 552 . HB1 1 1 523 1 2 1 1 52 ASP HA . 560 . HA 1 1 524 1 1 1 1 7 VAL MG2 . 515 . HG2# 1 1 524 1 2 1 1 100 THR HA . 608 . HA 1 1 525 1 1 1 1 26 VAL HA . 534 . HA 1 1 525 1 2 1 1 32 LEU QB . 540 . HB# 1 1 526 1 1 1 1 12 ASP HB3 . 520 . HB1 1 1 526 1 2 1 1 104 THR HA . 612 . HA 1 1 527 1 1 1 1 12 ASP HB2 . 520 . HB2 1 1 527 1 2 1 1 104 THR HA . 612 . HA 1 1 528 1 1 1 1 105 ASP HA . 613 . HA 1 1 528 1 2 1 1 106 THR MG . 614 . HG2# 1 1 529 1 1 1 1 71 PHE HA . 579 . HA 1 1 529 1 2 1 1 72 ILE QG . 580 . HG1# 1 1 530 1 1 1 1 13 LEU QD . 521 . HD# 1 1 530 1 2 1 1 107 TRP HA . 615 . HA 1 1 531 1 1 1 1 26 VAL QG . 534 . HG1# 1 1 531 1 2 1 1 35 TRP HA . 543 . HA 1 1 532 1 1 1 1 10 THR HA . 518 . HA 1 1 532 1 2 1 1 11 PHE QD . 519 . HD# 1 1 533 1 1 1 1 55 TRP HA . 563 . HA 1 1 533 1 2 1 1 56 TYR QD . 564 . HD# 1 1 534 1 1 1 1 35 TRP HH2 . 543 . HH2 1 1 534 1 2 1 1 68 GLU HA . 576 . HA 1 1 535 1 1 1 1 35 TRP HH2 . 543 . HH2 1 1 535 1 2 1 1 69 TYR HA . 577 . HA 1 1 536 1 1 1 1 35 TRP HZ2 . 543 . HZ2 1 1 536 1 2 1 1 68 GLU HA . 576 . HA 1 1 537 1 1 1 1 35 TRP HZ2 . 543 . HZ2 1 1 537 1 2 1 1 69 TYR HA . 577 . HA 1 1 538 1 1 1 1 66 SER HA . 574 . HA 1 1 538 1 2 1 1 69 TYR QD . 577 . HD# 1 1 539 1 1 1 1 29 ILE HA . 537 . HA 1 1 539 1 2 1 1 33 GLY H . 541 . HN 1 1 540 1 1 1 1 47 LYS QE . 555 . HE# 1 1 540 1 2 1 1 56 TYR QD . 564 . HD# 1 1 541 1 1 1 1 47 LYS QE . 555 . HE# 1 1 541 1 2 1 1 56 TYR QE . 564 . HE# 1 1 542 1 1 1 1 47 LYS QG . 555 . HG# 1 1 542 1 2 1 1 56 TYR QD . 564 . HD# 1 1 543 1 1 1 1 47 LYS QG . 555 . HG# 1 1 543 1 2 1 1 56 TYR QE . 564 . HE# 1 1 544 1 1 1 1 47 LYS QB . 555 . HB# 1 1 544 1 2 1 1 56 TYR QD . 564 . HD# 1 1 545 1 1 1 1 47 LYS QB . 555 . HB# 1 1 545 1 2 1 1 56 TYR QE . 564 . HE# 1 1 546 1 1 1 1 8 ALA H . 516 . HN 1 1 546 1 2 1 1 9 VAL MG2 . 517 . HG2# 1 1 547 1 1 1 1 8 ALA H . 516 . HN 1 1 547 1 2 1 1 100 THR MG . 608 . HG2# 1 1 548 1 1 1 1 43 LEU QD . 551 . HD# 1 1 548 1 2 1 1 56 TYR HA . 564 . HA 1 1 549 1 1 1 1 26 VAL HA . 534 . HA 1 1 549 1 2 1 1 35 TRP H . 543 . HN 1 1 550 1 1 1 1 13 LEU QD . 521 . HD# 1 1 550 1 2 1 1 107 TRP HD1 . 615 . HD1 1 1 551 1 1 1 1 44 SER H . 552 . HN 1 1 551 1 2 1 1 58 THR H . 566 . HN 1 1 552 1 1 1 1 41 ILE MG . 549 . HG2# 1 1 552 1 2 1 1 42 ALA H . 550 . HN 1 1 553 1 1 1 1 103 VAL HB . 611 . HB 1 1 553 1 2 1 1 104 THR H . 612 . HN 1 1 554 1 1 1 1 17 THR H . 525 . HN 1 1 554 1 2 1 1 55 TRP HE1 . 563 . HE1 1 1 555 1 1 1 1 16 THR HA . 524 . HA 1 1 555 1 2 1 1 55 TRP HE1 . 563 . HE1 1 1 556 1 1 1 1 16 THR MG . 524 . HG2# 1 1 556 1 2 1 1 55 TRP HE1 . 563 . HE1 1 1 557 1 1 1 1 48 TYR QD . 556 . HD# 1 1 557 1 2 1 1 55 TRP HE1 . 563 . HE1 1 1 558 1 1 1 1 48 TYR QE . 556 . HE# 1 1 558 1 2 1 1 55 TRP HE1 . 563 . HE1 1 1 559 1 1 1 1 55 TRP H . 563 . HN 1 1 559 1 2 1 1 55 TRP HZ2 . 563 . HZ2 1 1 560 1 1 1 1 23 ILE MG . 531 . HG2# 1 1 560 1 2 1 1 71 PHE QD . 579 . HD# 1 1 561 1 1 1 1 24 TYR QD . 532 . HD# 1 1 561 1 2 1 1 41 ILE MD . 549 . HD# 1 1 562 1 1 1 1 24 TYR QD . 532 . HD# 1 1 562 1 2 1 1 41 ILE MG . 549 . HG2# 1 1 563 1 1 1 1 24 TYR QD . 532 . HD# 1 1 563 1 2 1 1 72 ILE QG . 580 . HG1# 1 1 564 1 1 1 1 24 TYR QD . 532 . HD# 1 1 564 1 2 1 1 72 ILE MG . 580 . HG2# 1 1 565 1 1 1 1 24 TYR QD . 532 . HD# 1 1 565 1 2 1 1 74 ILE MG . 582 . HG2# 1 1 566 1 1 1 1 27 GLY QA . 535 . HA# 1 1 566 1 2 1 1 35 TRP HZ3 . 543 . HZ3 1 1 567 1 1 1 1 29 ILE QG . 537 . HG1# 1 1 567 1 2 1 1 67 PHE QD . 575 . HD# 1 1 568 1 1 1 1 29 ILE MG . 537 . HG2# 1 1 568 1 2 1 1 67 PHE QD . 575 . HD# 1 1 569 1 1 1 1 29 ILE MD . 537 . HD# 1 1 569 1 2 1 1 67 PHE QD . 575 . HD# 1 1 570 1 1 1 1 35 TRP HH2 . 543 . HH2 1 1 570 1 2 1 1 68 GLU QB . 576 . HB# 1 1 571 1 1 1 1 47 LYS QD . 555 . HD# 1 1 571 1 2 1 1 56 TYR QD . 564 . HD# 1 1 572 1 1 1 1 47 LYS QD . 555 . HD# 1 1 572 1 2 1 1 56 TYR QE . 564 . HE# 1 1 573 1 1 1 1 35 TRP HA . 543 . HA 1 1 573 1 2 1 1 82 TRP HZ3 . 590 . HZ3 1 1 574 1 1 1 1 35 TRP QB . 543 . HB# 1 1 574 1 2 1 1 82 TRP HZ3 . 590 . HZ3 1 1 575 1 1 1 1 35 TRP HA . 543 . HA 1 1 575 1 2 1 1 82 TRP HH2 . 590 . HH2 1 1 576 1 1 1 1 35 TRP QB . 543 . HB# 1 1 576 1 2 1 1 82 TRP HH2 . 590 . HH2 1 1 577 1 1 1 1 6 ALA MB . 514 . HB# 1 1 577 1 2 1 1 60 THR MG . 568 . HG2# 1 1 578 1 1 1 1 7 VAL HA . 515 . HA 1 1 578 1 2 1 1 92 VAL MG1 . 600 . HG1# 1 1 579 1 1 1 1 7 VAL HA . 515 . HA 1 1 579 1 2 1 1 92 VAL MG2 . 600 . HG2# 1 1 580 1 1 1 1 7 VAL HB . 515 . HB 1 1 580 1 2 1 1 92 VAL MG1 . 600 . HG1# 1 1 581 1 1 1 1 7 VAL MG1 . 515 . HG1# 1 1 581 1 2 1 1 90 TYR QE . 598 . HE# 1 1 582 1 1 1 1 7 VAL MG1 . 515 . HG1# 1 1 582 1 2 1 1 92 VAL MG1 . 600 . HG1# 1 1 583 1 1 1 1 7 VAL MG1 . 515 . HG1# 1 1 583 1 2 1 1 92 VAL MG2 . 600 . HG2# 1 1 584 1 1 1 1 7 VAL MG1 . 515 . HG1# 1 1 584 1 2 1 1 61 LEU QB . 569 . HB# 1 1 585 1 1 1 1 7 VAL MG1 . 515 . HG1# 1 1 585 1 2 1 1 101 ALA H . 609 . HN 1 1 586 1 1 1 1 8 ALA MB . 516 . HB# 1 1 586 1 2 1 1 58 THR MG . 566 . HG2# 1 1 587 1 1 1 1 8 ALA MB . 516 . HB# 1 1 587 1 2 1 1 60 THR MG . 568 . HG2# 1 1 588 1 1 1 1 9 VAL H . 517 . HN 1 1 588 1 2 1 1 61 LEU H . 569 . HN 1 1 589 1 1 1 1 29 ILE MD . 537 . HD# 1 1 589 1 2 1 1 61 LEU QD . 569 . HD# 1 1 590 1 1 1 1 37 THR MG . 545 . HG2# 1 1 590 1 2 1 1 82 TRP HD1 . 590 . HD1 1 1 591 1 1 1 1 37 THR MG . 545 . HG2# 1 1 591 1 2 1 1 82 TRP HZ2 . 590 . HZ2 1 1 592 1 1 1 1 67 PHE HA . 575 . HA 1 1 592 1 2 1 1 67 PHE QD . 575 . HD# 1 1 593 1 1 1 1 67 PHE QB . 575 . HB# 1 1 593 1 2 1 1 67 PHE QD . 575 . HD# 1 1 594 1 1 1 1 90 TYR H . 598 . HN 1 1 594 1 2 1 1 90 TYR QD . 598 . HD# 1 1 595 1 1 1 1 67 PHE HA . 575 . HA 1 1 595 1 2 1 1 69 TYR QD . 577 . HD# 1 1 596 1 1 1 1 67 PHE QB . 575 . HB# 1 1 596 1 2 1 1 69 TYR QD . 577 . HD# 1 1 597 1 1 1 1 40 GLY H . 548 . HN 1 1 597 1 2 1 1 41 ILE HA . 549 . HA 1 1 598 1 1 1 1 40 GLY H . 548 . HN 1 1 598 1 2 1 1 41 ILE QG . 549 . HG1# 1 1 599 1 1 1 1 25 LEU H . 533 . HN 1 1 599 1 2 1 1 41 ILE HA . 549 . HA 1 1 600 1 1 1 1 16 THR H . 524 . HN 1 1 600 1 2 1 1 23 ILE MD . 531 . HD# 1 1 601 1 1 1 1 83 GLU HA . 591 . HA 1 1 601 1 2 1 1 107 TRP HZ2 . 615 . HZ2 1 1 602 1 1 1 1 83 GLU QB . 591 . HB# 1 1 602 1 2 1 1 107 TRP HZ2 . 615 . HZ2 1 1 603 1 1 1 1 81 GLU QB . 589 . HB# 1 1 603 1 2 1 1 107 TRP HZ2 . 615 . HZ2 1 1 604 1 1 1 1 81 GLU QG . 589 . HG# 1 1 604 1 2 1 1 107 TRP HZ2 . 615 . HZ2 1 1 605 1 1 1 1 32 LEU QD . 540 . HD# 1 1 605 1 2 1 1 41 ILE MD . 549 . HD# 1 1 606 1 1 1 1 32 LEU QD . 540 . HD# 1 1 606 1 2 1 1 41 ILE MG . 549 . HG2# 1 1 607 1 1 1 1 55 TRP H . 563 . HN 1 1 607 1 2 1 1 55 TRP HD1 . 563 . HD1 1 1 608 1 1 1 1 27 GLY H . 535 . HN 1 1 608 1 2 1 1 32 LEU QD . 540 . HD# 1 1 609 1 1 1 1 27 GLY H . 535 . HN 1 1 609 1 2 1 1 32 LEU HG . 540 . HG 1 1 610 1 1 1 1 27 GLY H . 535 . HN 1 1 610 1 2 1 1 32 LEU QB . 540 . HB# 1 1 611 1 1 1 1 75 GLU HA . 583 . HA 1 1 611 1 2 1 1 77 ASP H . 585 . HN 1 1 612 1 1 1 1 75 GLU QB . 583 . HB# 1 1 612 1 2 1 1 77 ASP H . 585 . HN 1 1 613 1 1 1 1 75 GLU QG . 583 . HG# 1 1 613 1 2 1 1 77 ASP H . 585 . HN 1 1 614 1 1 1 1 75 GLU H . 583 . HN 1 1 614 1 2 1 1 77 ASP H . 585 . HN 1 1 615 1 1 1 1 76 SER H . 584 . HN 1 1 615 1 2 1 1 79 SER H . 587 . HN 1 1 616 1 1 1 1 76 SER H . 584 . HN 1 1 616 1 2 1 1 78 ASP H . 586 . HN 1 1 617 1 1 1 1 11 PHE H . 519 . HN 1 1 617 1 2 1 1 59 VAL H . 567 . HN 1 1 618 1 1 1 1 36 GLU H . 544 . HN 1 1 618 1 2 1 1 39 ASP QB . 547 . HB# 1 1 619 1 1 1 1 29 ILE HA . 537 . HA 1 1 619 1 2 1 1 30 SER HA . 538 . HA 1 1 620 1 1 1 1 29 ILE HA . 537 . HA 1 1 620 1 2 1 1 32 LEU HA . 540 . HA 1 1 621 1 1 1 1 25 LEU H . 533 . HN 1 1 621 1 2 1 1 41 ILE HB . 549 . HB 1 1 622 1 1 1 1 22 ASN H . 530 . HN 1 1 622 1 2 1 1 74 ILE MD . 582 . HD# 1 1 623 1 1 1 1 13 LEU QD . 521 . HD# 1 1 623 1 2 1 1 108 ARG H . 616 . HN 1 1 624 1 1 1 1 48 TYR QD . 556 . HD# 1 1 624 1 2 1 1 52 ASP HA . 560 . HA 1 1 625 1 1 1 1 47 LYS QB . 555 . HB# 1 1 625 1 2 1 1 54 LEU QD . 562 . HD# 1 1 626 1 1 1 1 47 LYS QG . 555 . HG# 1 1 626 1 2 1 1 54 LEU QD . 562 . HD# 1 1 627 1 1 1 1 47 LYS QD . 555 . HD# 1 1 627 1 2 1 1 54 LEU QD . 562 . HD# 1 1 628 1 1 1 1 48 TYR QD . 556 . HD# 1 1 628 1 2 1 1 53 PRO QD . 561 . HD# 1 1 629 1 1 1 1 48 TYR QD . 556 . HD# 1 1 629 1 2 1 1 53 PRO QG . 561 . HG# 1 1 630 1 1 1 1 53 PRO QD . 561 . HD# 1 1 630 1 2 1 1 55 TRP HD1 . 563 . HD1 1 1 631 1 1 1 1 90 TYR QD . 598 . HD# 1 1 631 1 2 1 1 92 VAL QG . 600 . HG# 1 1 632 1 1 1 1 90 TYR QE . 598 . HE# 1 1 632 1 2 1 1 92 VAL QG . 600 . HG# 1 1 633 1 1 1 1 53 PRO QD . 561 . HD# 1 1 633 1 2 1 1 54 LEU H . 562 . HN 1 1 634 1 1 1 1 53 PRO QG . 561 . HG# 1 1 634 1 2 1 1 54 LEU H . 562 . HN 1 1 635 1 1 1 1 90 TYR QD . 598 . HD# 1 1 635 1 2 1 1 101 ALA MB . 609 . HB# 1 1 636 1 1 1 1 90 TYR QE . 598 . HE# 1 1 636 1 2 1 1 101 ALA MB . 609 . HB# 1 1 637 1 1 1 1 77 ASP H . 585 . HN 1 1 637 1 2 1 1 79 SER H . 587 . HN 1 1 638 1 1 1 1 16 THR MG . 524 . HG2# 1 1 638 1 2 1 1 53 PRO QG . 561 . HG# 1 1 639 1 1 1 1 16 THR MG . 524 . HG2# 1 1 639 1 2 1 1 53 PRO QB . 561 . HB# 1 1 640 1 1 1 1 16 THR HA . 524 . HA 1 1 640 1 2 1 1 53 PRO QG . 561 . HG# 1 1 641 1 1 1 1 16 THR HA . 524 . HA 1 1 641 1 2 1 1 53 PRO QB . 561 . HB# 1 1 642 1 1 1 1 17 THR H . 525 . HN 1 1 642 1 2 1 1 54 LEU QD . 562 . HD# 1 1 643 1 1 1 1 53 PRO QB . 561 . HB# 1 1 643 1 2 1 1 55 TRP HE1 . 563 . HE1 1 1 644 1 1 1 1 53 PRO QG . 561 . HG# 1 1 644 1 2 1 1 55 TRP HE1 . 563 . HE1 1 1 645 1 1 1 1 17 THR H . 525 . HN 1 1 645 1 2 1 1 53 PRO QB . 561 . HB# 1 1 646 1 1 1 1 17 THR H . 525 . HN 1 1 646 1 2 1 1 53 PRO QG . 561 . HG# 1 1 647 1 1 1 1 83 GLU QB . 591 . HB# 1 1 647 1 2 1 1 86 PRO QD . 594 . HD# 1 1 648 1 1 1 1 52 ASP H . 560 . HN 1 1 648 1 2 1 1 53 PRO QD . 561 . HD# 1 1 649 1 1 1 1 45 ALA MB . 553 . HB# 1 1 649 1 2 1 1 48 TYR QD . 556 . HD# 1 1 650 1 1 1 1 48 TYR QD . 556 . HD# 1 1 650 1 2 1 1 54 LEU QD . 562 . HD# 1 1 651 1 1 1 1 29 ILE MG . 537 . HG2# 1 1 651 1 2 1 1 32 LEU H . 540 . HN 1 1 652 1 1 1 1 29 ILE MD . 537 . HD# 1 1 652 1 2 1 1 32 LEU H . 540 . HN 1 1 653 1 1 1 1 33 GLY H . 541 . HN 1 1 653 1 2 1 1 39 ASP QB . 547 . HB# 1 1 654 1 1 1 1 75 GLU H . 583 . HN 1 1 654 1 2 1 1 80 VAL QG . 588 . HG# 1 1 655 1 1 1 1 15 ALA H . 523 . HN 1 1 655 1 2 1 1 53 PRO QB . 561 . HB# 1 1 656 1 1 1 1 17 THR H . 525 . HN 1 1 656 1 2 1 1 48 TYR QD . 556 . HD# 1 1 657 1 1 1 1 30 SER HA . 538 . HA 1 1 657 1 2 1 1 34 ASP H . 542 . HN 1 1 658 1 1 1 1 92 VAL MG2 . 600 . HG2# 1 1 658 1 2 1 1 99 SER HA . 607 . HA 1 1 659 1 1 1 1 83 GLU QB . 591 . HB# 1 1 659 1 2 1 1 107 TRP HH2 . 615 . HH2 1 1 660 1 1 1 1 83 GLU QB . 591 . HB# 1 1 660 1 2 1 1 107 TRP HD1 . 615 . HD1 1 1 661 1 1 1 1 64 GLY QA . 572 . HA# 1 1 661 1 2 1 1 93 PRO HA . 601 . HA# 1 1 662 1 1 1 1 1 CYS QB . 509 . HB# 1 1 662 1 2 1 1 2 THR H . 510 . HN 1 1 663 1 1 1 1 1 CYS QB . 509 . HB# 1 1 663 1 2 1 1 3 THR H . 511 . HN 1 1 664 1 1 1 1 7 VAL H . 515 . HN 1 1 664 1 2 1 1 62 PRO HA . 570 . HA 1 1 665 1 1 1 1 31 GLN QE . 539 . HE2# 1 1 665 1 2 1 1 59 VAL QG . 567 . HG# 1 1 666 1 1 1 1 86 PRO QD . 594 . HD# 1 1 666 1 2 1 1 108 ARG H . 616 . HN 1 1 667 1 1 1 1 86 PRO QG . 594 . HG# 1 1 667 1 2 1 1 108 ARG H . 616 . HN 1 1 668 1 1 1 1 19 TYR QD . 527 . HD# 1 1 668 1 2 1 1 53 PRO QG . 561 . HG# 1 1 669 1 1 1 1 19 TYR QE . 527 . HE# 1 1 669 1 2 1 1 53 PRO QG . 561 . HG# 1 1 670 1 1 1 1 19 TYR H . 527 . HN 1 1 670 1 2 1 1 76 SER QB . 584 . HB# 1 1 671 1 1 1 1 6 ALA H . 514 . HN 1 1 671 1 2 1 1 62 PRO QB . 570 . HB# 1 1 672 1 1 1 1 75 GLU H . 583 . HN 1 1 672 1 2 1 1 79 SER QB . 587 . HB# 1 1 673 1 1 1 1 18 THR MG . 526 . HG2# 1 1 673 1 2 1 1 78 ASP H . 586 . HN 1 1 674 1 1 1 1 21 GLU HA . 529 . HA 1 1 674 1 2 1 1 75 GLU QB . 583 . HB# 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.6 1.9 4.4 1 1 2 1 . . . . . 5.0 1.9 5.8 1 1 3 1 . . . . . 3.6 1.9 4.4 1 1 4 1 . . . . . 3.6 1.9 4.4 1 1 5 1 . . . . . 3.0 1.9 3.5 1 1 6 1 . . . . . 5.0 1.9 5.8 1 1 7 1 . . . . . 2.6 1.9 3.0 1 1 8 1 . . . . . 3.6 1.9 4.4 1 1 9 1 . . . . . 3.0 1.9 3.5 1 1 10 1 . . . . . 3.6 1.9 4.4 1 1 11 1 . . . . . 3.6 1.9 4.4 1 1 12 1 . . . . . 5.0 1.9 5.8 1 1 13 1 . . . . . 5.0 1.9 5.8 1 1 14 1 . . . . . 5.0 1.9 5.8 1 1 15 1 . . . . . 5.0 1.9 5.8 1 1 16 1 . . . . . 3.6 1.9 4.4 1 1 17 1 . . . . . 5.0 1.9 5.8 1 1 18 1 . . . . . 5.0 1.9 5.8 1 1 19 1 . . . . . 3.6 1.9 4.4 1 1 20 1 . . . . . 3.6 1.9 4.4 1 1 21 1 . . . . . 5.0 1.9 5.8 1 1 22 1 . . . . . 3.6 1.9 4.4 1 1 23 1 . . . . . 2.4 1.9 2.7 1 1 24 1 . . . . . 5.0 1.9 5.8 1 1 25 1 . . . . . 5.0 1.9 5.8 1 1 26 1 . . . . . 5.0 1.9 5.8 1 1 27 1 . . . . . 5.0 1.9 5.8 1 1 28 1 . . . . . 3.6 1.9 4.4 1 1 29 1 . . . . . 5.0 1.9 5.8 1 1 30 1 . . . . . 5.0 1.9 5.8 1 1 31 1 . . . . . 2.6 1.9 3.0 1 1 32 1 . . . . . 3.6 1.9 4.4 1 1 33 1 . . . . . 5.0 1.9 5.8 1 1 34 1 . . . . . 3.6 1.9 4.4 1 1 35 1 . . . . . 3.0 1.9 3.5 1 1 36 1 . . . . . 5.0 1.9 5.8 1 1 37 1 . . . . . 3.0 1.9 3.5 1 1 38 1 . . . . . 5.0 1.9 5.8 1 1 39 1 . . . . . 5.0 1.9 5.8 1 1 40 1 . . . . . 5.0 1.9 5.8 1 1 41 1 . . . . . 5.0 1.9 5.8 1 1 42 1 . . . . . 5.0 1.9 5.8 1 1 43 1 . . . . . 5.0 1.9 5.8 1 1 44 1 . . . . . 3.0 1.9 3.5 1 1 45 1 . . . . . 5.0 1.9 5.8 1 1 46 1 . . . . . 5.0 1.9 5.8 1 1 47 1 . . . . . 3.6 1.9 4.4 1 1 48 1 . . . . . 3.0 1.9 3.5 1 1 49 1 . . . . . 3.6 1.9 4.4 1 1 50 1 . . . . . 5.0 1.9 5.8 1 1 51 1 . . . . . 3.6 1.9 4.4 1 1 52 1 . . . . . 5.0 1.9 5.8 1 1 53 1 . . . . . 3.0 1.9 3.5 1 1 54 1 . . . . . 3.6 1.9 4.4 1 1 55 1 . . . . . 5.0 1.9 5.8 1 1 56 1 . . . . . 5.0 1.9 5.8 1 1 57 1 . . . . . 5.0 1.9 5.8 1 1 58 1 . . . . . 5.0 1.9 5.8 1 1 59 1 . . . . . 5.0 1.9 5.8 1 1 60 1 . . . . . 5.0 1.9 5.8 1 1 61 1 . . . . . 5.0 1.9 5.8 1 1 62 1 . . . . . 5.0 1.9 5.8 1 1 63 1 . . . . . 5.0 1.9 5.8 1 1 64 1 . . . . . 5.0 1.9 5.8 1 1 65 1 . . . . . 5.0 1.9 5.8 1 1 66 1 . . . . . 5.0 1.9 5.8 1 1 67 1 . . . . . 5.0 1.9 5.8 1 1 68 1 . . . . . 5.0 1.9 5.8 1 1 69 1 . . . . . 5.0 1.9 5.8 1 1 70 1 . . . . . 5.0 1.9 5.8 1 1 71 1 . . . . . 5.0 1.9 5.8 1 1 72 1 . . . . . 5.0 1.9 5.8 1 1 73 1 . . . . . 5.0 1.9 5.8 1 1 74 1 . . . . . 5.0 1.9 5.8 1 1 75 1 . . . . . 5.0 1.9 5.8 1 1 76 1 . . . . . 2.6 1.9 3.0 1 1 77 1 . . . . . 5.0 1.9 5.8 1 1 78 1 . . . . . 5.0 1.9 5.8 1 1 79 1 . . . . . 5.0 1.9 5.8 1 1 80 1 . . . . . 5.0 1.9 5.8 1 1 81 1 . . . . . 5.0 1.9 5.8 1 1 82 1 . . . . . 5.0 1.9 5.8 1 1 83 1 . . . . . 5.0 1.9 5.8 1 1 84 1 . . . . . 5.0 1.9 5.8 1 1 85 1 . . . . . 5.0 1.9 5.8 1 1 86 1 . . . . . 5.0 1.9 5.8 1 1 87 1 . . . . . 5.0 1.9 5.8 1 1 88 1 . . . . . 2.6 1.9 3.0 1 1 89 1 . . . . . 5.0 1.9 5.8 1 1 90 1 . . . . . 2.6 1.9 3.0 1 1 91 1 . . . . . 5.0 1.9 5.8 1 1 92 1 . . . . . 5.0 1.9 5.8 1 1 93 1 . . . . . 5.0 1.9 5.8 1 1 94 1 . . . . . 5.0 1.9 5.8 1 1 95 1 . . . . . 5.0 1.9 5.8 1 1 96 1 . . . . . 5.0 1.9 5.8 1 1 97 1 . . . . . 5.0 1.9 5.8 1 1 98 1 . . . . . 3.6 1.9 4.4 1 1 99 1 . . . . . 3.6 1.9 4.4 1 1 100 1 . . . . . 5.0 1.9 5.8 1 1 101 1 . . . . . 3.0 1.9 3.5 1 1 102 1 . . . . . 5.0 1.9 5.8 1 1 103 1 . . . . . 5.0 1.9 5.8 1 1 104 1 . . . . . 2.6 1.9 3.0 1 1 105 1 . . . . . 3.0 1.9 3.5 1 1 106 1 . . . . . 3.0 1.9 3.5 1 1 107 1 . . . . . 3.6 1.9 4.4 1 1 108 1 . . . . . 3.6 1.9 4.4 1 1 109 1 . . . . . 5.0 1.9 5.8 1 1 110 1 . . . . . 3.6 1.9 4.4 1 1 111 1 . . . . . 5.0 1.9 5.8 1 1 112 1 . . . . . 3.0 1.9 3.5 1 1 113 1 . . . . . 3.6 1.9 4.4 1 1 114 1 . . . . . 5.0 1.9 5.8 1 1 115 1 . . . . . 5.0 1.9 5.8 1 1 116 1 . . . . . 3.6 1.9 4.4 1 1 117 1 . . . . . 5.0 1.9 5.8 1 1 118 1 . . . . . 2.6 1.9 3.0 1 1 119 1 . . . . . 5.0 1.9 5.8 1 1 120 1 . . . . . 5.0 1.9 5.8 1 1 121 1 . . . . . 3.0 1.9 3.5 1 1 122 1 . . . . . 5.0 1.9 5.8 1 1 123 1 . . . . . 5.0 1.9 5.8 1 1 124 1 . . . . . 5.0 1.9 5.8 1 1 125 1 . . . . . 3.0 1.9 3.5 1 1 126 1 . . . . . 3.0 1.9 3.5 1 1 127 1 . . . . . 5.0 1.9 5.8 1 1 128 1 . . . . . 3.6 1.9 4.4 1 1 129 1 . . . . . 3.0 1.9 3.5 1 1 130 1 . . . . . 5.0 1.9 5.8 1 1 131 1 . . . . . 5.0 1.9 5.8 1 1 132 1 . . . . . 5.0 1.9 5.8 1 1 133 1 . . . . . 5.0 1.9 5.8 1 1 134 1 . . . . . 5.0 1.9 5.8 1 1 135 1 . . . . . 3.6 1.9 4.4 1 1 136 1 . . . . . 3.0 1.9 3.5 1 1 137 1 . . . . . 5.0 1.9 5.8 1 1 138 1 . . . . . 5.0 1.9 5.8 1 1 139 1 . . . . . 5.0 1.9 5.8 1 1 140 1 . . . . . 5.0 1.9 5.8 1 1 141 1 . . . . . 5.0 1.9 5.8 1 1 142 1 . . . . . 5.0 1.9 5.8 1 1 143 1 . . . . . 3.6 1.9 4.4 1 1 144 1 . . . . . 3.6 1.9 4.4 1 1 145 1 . . . . . 3.6 1.9 4.4 1 1 146 1 . . . . . 3.0 1.9 3.5 1 1 147 1 . . . . . 5.0 1.9 5.8 1 1 148 1 . . . . . 3.6 1.9 4.4 1 1 149 1 . . . . . 5.0 1.9 5.8 1 1 150 1 . . . . . 5.0 1.9 5.8 1 1 151 1 . . . . . 5.0 1.9 5.8 1 1 152 1 . . . . . 5.0 1.9 5.8 1 1 153 1 . . . . . 3.0 1.9 3.5 1 1 154 1 . . . . . 5.0 1.9 5.8 1 1 155 1 . . . . . 3.0 1.9 3.5 1 1 156 1 . . . . . 3.6 1.9 4.4 1 1 157 1 . . . . . 2.4 1.9 2.7 1 1 158 1 . . . . . 3.6 1.9 4.4 1 1 159 1 . . . . . 5.0 1.9 5.8 1 1 160 1 . . . . . 5.0 1.9 5.8 1 1 161 1 . . . . . 3.6 1.9 4.4 1 1 162 1 . . . . . 3.6 1.9 4.4 1 1 163 1 . . . . . 5.0 1.9 5.8 1 1 164 1 . . . . . 5.0 1.9 5.8 1 1 165 1 . . . . . 3.6 1.9 4.4 1 1 166 1 . . . . . 3.0 1.9 3.5 1 1 167 1 . . . . . 3.6 1.9 4.4 1 1 168 1 . . . . . 3.0 1.9 3.5 1 1 169 1 . . . . . 3.6 1.9 4.4 1 1 170 1 . . . . . 5.0 1.9 5.8 1 1 171 1 . . . . . 5.0 1.9 5.8 1 1 172 1 . . . . . 5.0 1.9 5.8 1 1 173 1 . . . . . 5.0 1.9 5.8 1 1 174 1 . . . . . 5.0 1.9 5.8 1 1 175 1 . . . . . 5.0 1.9 5.8 1 1 176 1 . . . . . . 1.9 2.7 1 1 177 1 . . . . . 2.4 1.9 2.7 1 1 178 1 . . . . . 3.0 1.9 3.5 1 1 179 1 . . . . . 2.4 1.9 2.7 1 1 180 1 . . . . . 3.0 1.9 3.5 1 1 181 1 . . . . . 2.4 1.9 2.7 1 1 182 1 . . . . . 2.4 1.9 2.7 1 1 183 1 . . . . . 2.6 1.9 3.0 1 1 184 1 . . . . . . 1.9 2.7 1 1 185 1 . . . . . 2.6 1.9 3.0 1 1 186 1 . . . . . 2.6 1.9 3.0 1 1 187 1 . . . . . 2.6 1.9 3.0 1 1 188 1 . . . . . 2.4 1.9 2.7 1 1 189 1 . . . . . 3.0 1.9 3.5 1 1 190 1 . . . . . 3.6 1.9 4.4 1 1 191 1 . . . . . . 1.9 3.5 1 1 192 1 . . . . . 2.6 1.9 2.7 1 1 193 1 . . . . . 2.4 1.9 2.7 1 1 194 1 . . . . . 5.0 1.9 5.8 1 1 195 1 . . . . . 5.0 1.9 5.8 1 1 196 1 . . . . . 3.0 1.9 3.5 1 1 197 1 . . . . . 3.0 1.9 3.5 1 1 198 1 . . . . . 5.0 1.9 5.8 1 1 199 1 . . . . . 5.0 1.9 5.8 1 1 200 1 . . . . . 5.0 1.9 5.8 1 1 201 1 . . . . . 5.0 1.9 5.8 1 1 202 1 . . . . . 5.0 1.9 5.8 1 1 203 1 . . . . . 5.0 1.9 5.8 1 1 204 1 . . . . . 5.0 1.9 5.8 1 1 205 1 . . . . . 5.0 1.9 5.8 1 1 206 1 . . . . . 5.0 1.9 5.8 1 1 207 1 . . . . . 5.0 1.9 5.8 1 1 208 1 . . . . . 5.0 1.9 5.8 1 1 209 1 . . . . . 5.0 1.9 5.8 1 1 210 1 . . . . . 5.0 1.9 5.8 1 1 211 1 . . . . . 5.0 1.9 5.8 1 1 212 1 . . . . . 5.0 1.9 5.8 1 1 213 1 . . . . . 5.0 1.9 5.8 1 1 214 1 . . . . . 5.0 1.9 5.8 1 1 215 1 . . . . . 5.0 1.9 5.8 1 1 216 1 . . . . . 5.0 1.9 5.8 1 1 217 1 . . . . . 5.0 1.9 5.8 1 1 218 1 . . . . . 2.4 1.9 2.7 1 1 219 1 . . . . . 3.6 1.9 4.4 1 1 220 1 . . . . . 3.6 1.9 4.4 1 1 221 1 . . . . . 3.6 1.9 4.4 1 1 222 1 . . . . . 3.6 1.9 4.4 1 1 223 1 . . . . . 3.6 1.9 4.4 1 1 224 1 . . . . . 5.0 1.9 5.8 1 1 225 1 . . . . . 3.0 1.9 3.5 1 1 226 1 . . . . . 5.0 1.9 5.8 1 1 227 1 . . . . . 5.0 1.9 5.8 1 1 228 1 . . . . . 2.6 1.9 3.0 1 1 229 1 . . . . . 3.0 1.9 3.5 1 1 230 1 . . . . . 5.0 1.9 5.8 1 1 231 1 . . . . . 3.0 1.9 3.5 1 1 232 1 . . . . . 3.6 1.9 4.4 1 1 233 1 . . . . . 3.6 1.9 4.4 1 1 234 1 . . . . . 2.6 1.9 3.0 1 1 235 1 . . . . . 3.6 1.9 4.4 1 1 236 1 . . . . . 5.0 1.9 5.8 1 1 237 1 . . . . . 3.0 1.9 3.5 1 1 238 1 . . . . . 2.6 1.9 3.0 1 1 239 1 . . . . . 5.0 1.9 5.8 1 1 240 1 . . . . . 5.0 1.9 5.8 1 1 241 1 . . . . . 5.0 1.9 5.8 1 1 242 1 . . . . . 3.0 1.9 3.5 1 1 243 1 . . . . . 2.6 1.9 3.0 1 1 244 1 . . . . . 2.4 1.9 2.7 1 1 245 1 . . . . . 5.0 1.9 5.8 1 1 246 1 . . . . . 5.0 1.9 5.8 1 1 247 1 . . . . . 5.0 1.9 5.8 1 1 248 1 . . . . . 2.4 1.9 2.7 1 1 249 1 . . . . . 3.0 1.9 3.5 1 1 250 1 . . . . . 3.6 1.9 4.4 1 1 251 1 . . . . . 3.6 1.9 4.4 1 1 252 1 . . . . . 5.0 1.9 5.8 1 1 253 1 . . . . . 3.0 1.9 3.5 1 1 254 1 . . . . . 3.6 1.9 4.4 1 1 255 1 . . . . . 3.0 1.9 3.5 1 1 256 1 . . . . . 5.0 1.9 5.8 1 1 257 1 . . . . . 3.6 1.9 4.4 1 1 258 1 . . . . . 5.0 1.9 5.8 1 1 259 1 . . . . . 2.6 1.9 3.0 1 1 260 1 . . . . . 2.6 1.9 3.0 1 1 261 1 . . . . . 3.6 1.9 4.4 1 1 262 1 . . . . . 5.0 1.9 5.8 1 1 263 1 . . . . . 2.4 1.9 2.7 1 1 264 1 . . . . . 5.0 1.9 5.8 1 1 265 1 . . . . . 2.6 1.9 3.0 1 1 266 1 . . . . . 5.0 1.9 5.8 1 1 267 1 . . . . . 2.4 1.9 2.7 1 1 268 1 . . . . . 5.0 1.9 5.8 1 1 269 1 . . . . . 2.4 1.9 2.7 1 1 270 1 . . . . . 2.4 1.9 2.7 1 1 271 1 . . . . . 5.0 1.9 5.8 1 1 272 1 . . . . . 3.0 1.9 3.5 1 1 273 1 . . . . . 5.0 1.9 5.8 1 1 274 1 . . . . . 5.0 1.9 5.8 1 1 275 1 . . . . . 3.6 1.9 4.4 1 1 276 1 . . . . . 5.0 1.9 5.8 1 1 277 1 . . . . . 5.0 1.9 5.8 1 1 278 1 . . . . . 5.0 1.9 5.8 1 1 279 1 . . . . . 3.6 1.9 4.4 1 1 280 1 . . . . . 5.0 1.9 5.8 1 1 281 1 . . . . . 3.6 1.9 4.4 1 1 282 1 . . . . . 5.0 1.9 5.8 1 1 283 1 . . . . . 3.6 1.9 4.4 1 1 284 1 . . . . . 3.6 1.9 4.4 1 1 285 1 . . . . . 3.0 1.9 3.5 1 1 286 1 . . . . . . 1.9 3.5 1 1 287 1 . . . . . 3.6 1.9 4.4 1 1 288 1 . . . . . 5.0 1.9 5.8 1 1 289 1 . . . . . 5.0 1.9 5.8 1 1 290 1 . . . . . 2.6 1.9 3.0 1 1 291 1 . . . . . 5.0 1.9 5.8 1 1 292 1 . . . . . 3.6 1.9 4.4 1 1 293 1 . . . . . 3.6 1.9 4.4 1 1 294 1 . . . . . 3.0 1.9 3.5 1 1 295 1 . . . . . 5.0 1.9 5.8 1 1 296 1 . . . . . 5.0 1.9 5.8 1 1 297 1 . . . . . 3.6 1.9 4.4 1 1 298 1 . . . . . 5.0 1.9 5.8 1 1 299 1 . . . . . 5.0 1.9 5.8 1 1 300 1 . . . . . 5.0 1.9 5.8 1 1 301 1 . . . . . 5.0 1.9 5.8 1 1 302 1 . . . . . 5.0 1.9 5.8 1 1 303 1 . . . . . 3.0 1.9 3.5 1 1 304 1 . . . . . 5.0 1.9 5.8 1 1 305 1 . . . . . 5.0 1.9 5.8 1 1 306 1 . . . . . 5.0 1.9 5.8 1 1 307 1 . . . . . 5.0 1.9 5.8 1 1 308 1 . . . . . 5.0 1.9 5.8 1 1 309 1 . . . . . 5.0 1.9 5.8 1 1 310 1 . . . . . 5.0 1.9 5.8 1 1 311 1 . . . . . 5.0 1.9 5.8 1 1 312 1 . . . . . 2.6 1.9 3.0 1 1 313 1 . . . . . 3.6 1.9 4.4 1 1 314 1 . . . . . 3.6 1.9 4.4 1 1 315 1 . . . . . 3.0 1.9 3.5 1 1 316 1 . . . . . 2.4 1.9 2.7 1 1 317 1 . . . . . 2.6 1.9 3.0 1 1 318 1 . . . . . 5.0 1.9 5.8 1 1 319 1 . . . . . 3.0 1.9 3.5 1 1 320 1 . . . . . 5.0 1.9 5.8 1 1 321 1 . . . . . 5.0 1.9 5.8 1 1 322 1 . . . . . 5.0 1.9 5.8 1 1 323 1 . . . . . 5.0 1.9 5.8 1 1 324 1 . . . . . 5.0 1.9 5.8 1 1 325 1 . . . . . 5.0 1.9 5.8 1 1 326 1 . . . . . 3.6 1.9 4.4 1 1 327 1 . . . . . 5.0 1.9 5.8 1 1 328 1 . . . . . 5.0 1.9 5.8 1 1 329 1 . . . . . 5.0 1.9 5.8 1 1 330 1 . . . . . 5.0 1.9 5.8 1 1 331 1 . . . . . 3.0 1.9 3.5 1 1 332 1 . . . . . 3.6 1.9 4.4 1 1 333 1 . . . . . 2.4 1.9 2.7 1 1 334 1 . . . . . 3.0 1.9 3.5 1 1 335 1 . . . . . 5.0 1.9 5.8 1 1 336 1 . . . . . 3.6 1.9 4.4 1 1 337 1 . . . . . 3.6 1.9 4.4 1 1 338 1 . . . . . 3.0 1.9 3.5 1 1 339 1 . . . . . 3.6 1.9 4.4 1 1 340 1 . . . . . 3.6 1.9 4.4 1 1 341 1 . . . . . 3.6 1.9 4.4 1 1 342 1 . . . . . 3.6 1.9 4.4 1 1 343 1 . . . . . 5.0 1.9 5.8 1 1 344 1 . . . . . 3.0 1.9 3.5 1 1 345 1 . . . . . 3.6 1.9 4.4 1 1 346 1 . . . . . 2.4 1.9 2.7 1 1 347 1 . . . . . 3.6 1.9 4.4 1 1 348 1 . . . . . 3.6 1.9 4.4 1 1 349 1 . . . . . 2.6 1.9 3.0 1 1 350 1 . . . . . 3.6 1.9 4.4 1 1 351 1 . . . . . 2.6 1.9 3.0 1 1 352 1 . . . . . 2.6 1.9 3.0 1 1 353 1 . . . . . 2.4 1.9 2.7 1 1 354 1 . . . . . 2.4 1.9 2.7 1 1 355 1 . . . . . 2.4 1.9 2.7 1 1 356 1 . . . . . 2.4 1.9 2.7 1 1 357 1 . . . . . 3.6 1.9 4.4 1 1 358 1 . . . . . 5.0 1.9 5.8 1 1 359 1 . . . . . 5.0 1.9 5.8 1 1 360 1 . . . . . 5.0 1.9 5.8 1 1 361 1 . . . . . 3.6 1.9 4.4 1 1 362 1 . . . . . 2.6 1.9 3.0 1 1 363 1 . . . . . 2.4 1.9 2.7 1 1 364 1 . . . . . 2.4 1.9 2.7 1 1 365 1 . . . . . 2.4 1.9 2.7 1 1 366 1 . . . . . 5.0 1.9 5.8 1 1 367 1 . . . . . 5.0 1.9 5.8 1 1 368 1 . . . . . 5.0 1.9 5.8 1 1 369 1 . . . . . 2.6 1.9 3.0 1 1 370 1 . . . . . . 1.9 3.5 1 1 371 1 . . . . . 2.6 1.9 3.0 1 1 372 1 . . . . . 3.0 1.9 3.5 1 1 373 1 . . . . . 5.0 1.9 5.8 1 1 374 1 . . . . . 3.0 1.9 3.5 1 1 375 1 . . . . . 3.0 1.9 3.5 1 1 376 1 . . . . . 5.0 1.9 5.8 1 1 377 1 . . . . . 2.6 1.9 3.0 1 1 378 1 . . . . . 5.0 1.9 5.8 1 1 379 1 . . . . . 5.0 1.9 5.8 1 1 380 1 . . . . . 2.4 1.9 2.7 1 1 381 1 . . . . . 2.4 1.9 2.7 1 1 382 1 . . . . . 5.0 1.9 5.8 1 1 383 1 . . . . . 5.0 1.9 5.8 1 1 384 1 . . . . . 3.0 1.9 3.5 1 1 385 1 . . . . . 5.0 1.9 5.8 1 1 386 1 . . . . . 5.0 1.9 5.8 1 1 387 1 . . . . . 3.0 1.9 3.5 1 1 388 1 . . . . . 2.4 1.9 2.7 1 1 389 1 . . . . . 2.6 1.9 3.0 1 1 390 1 . . . . . 3.6 1.9 4.4 1 1 391 1 . . . . . 2.4 1.9 2.7 1 1 392 1 . . . . . 2.4 1.9 2.7 1 1 393 1 . . . . . 2.4 1.9 2.7 1 1 394 1 . . . . . 5.0 1.9 5.8 1 1 395 1 . . . . . 5.0 1.9 5.8 1 1 396 1 . . . . . 2.4 1.9 2.7 1 1 397 1 . . . . . 5.0 1.9 5.8 1 1 398 1 . . . . . 3.6 1.9 4.4 1 1 399 1 . . . . . 5.0 1.9 5.8 1 1 400 1 . . . . . 5.0 1.9 5.8 1 1 401 1 . . . . . 5.0 1.9 5.8 1 1 402 1 . . . . . 5.0 1.9 5.8 1 1 403 1 . . . . . 5.0 1.9 5.8 1 1 404 1 . . . . . 5.0 1.9 5.8 1 1 405 1 . . . . . 3.0 1.9 3.5 1 1 406 1 . . . . . 2.4 1.9 2.7 1 1 407 1 . . . . . 3.0 1.9 3.5 1 1 408 1 . . . . . 5.0 1.9 5.8 1 1 409 1 . . . . . 2.6 1.9 3.0 1 1 410 1 . . . . . 5.0 1.9 5.8 1 1 411 1 . . . . . 5.0 1.9 5.8 1 1 412 1 . . . . . 2.4 1.9 2.7 1 1 413 1 . . . . . 5.0 1.9 5.8 1 1 414 1 . . . . . 5.0 1.9 5.8 1 1 415 1 . . . . . 5.0 1.9 5.8 1 1 416 1 . . . . . 5.0 1.9 5.8 1 1 417 1 . . . . . 5.0 1.9 5.8 1 1 418 1 . . . . . 3.0 1.9 3.5 1 1 419 1 . . . . . 5.0 1.9 5.8 1 1 420 1 . . . . . 2.4 1.9 2.7 1 1 421 1 . . . . . 2.4 1.9 2.7 1 1 422 1 . . . . . 2.4 1.9 2.7 1 1 423 1 . . . . . 5.0 1.9 5.8 1 1 424 1 . . . . . 5.0 1.9 5.8 1 1 425 1 . . . . . 3.0 1.9 3.5 1 1 426 1 . . . . . 5.0 1.9 5.8 1 1 427 1 . . . . . 2.4 1.9 2.7 1 1 428 1 . . . . . 3.0 1.9 3.5 1 1 429 1 . . . . . 2.6 1.9 3.0 1 1 430 1 . . . . . 5.0 1.9 5.8 1 1 431 1 . . . . . 2.6 1.9 3.0 1 1 432 1 . . . . . 3.0 1.9 3.5 1 1 433 1 . . . . . 3.6 1.9 4.4 1 1 434 1 . . . . . 3.6 1.9 4.4 1 1 435 1 . . . . . 3.6 1.9 4.4 1 1 436 1 . . . . . 3.6 1.9 4.4 1 1 437 1 . . . . . 2.6 1.9 3.0 1 1 438 1 . . . . . 5.0 1.9 5.8 1 1 439 1 . . . . . 5.0 1.9 5.8 1 1 440 1 . . . . . 3.6 1.9 4.4 1 1 441 1 . . . . . 5.0 1.9 5.8 1 1 442 1 . . . . . 3.0 1.9 3.5 1 1 443 1 . . . . . 5.0 1.9 5.8 1 1 444 1 . . . . . 3.6 1.9 4.4 1 1 445 1 . . . . . 5.0 1.9 5.8 1 1 446 1 . . . . . 5.0 1.9 5.8 1 1 447 1 . . . . . 3.0 1.9 3.5 1 1 448 1 . . . . . 5.0 1.9 5.8 1 1 449 1 . . . . . 2.6 1.9 3.0 1 1 450 1 . . . . . 3.6 1.9 4.4 1 1 451 1 . . . . . 2.6 1.9 3.0 1 1 452 1 . . . . . 2.6 1.9 3.0 1 1 453 1 . . . . . 2.6 1.9 3.0 1 1 454 1 . . . . . 2.6 1.9 3.0 1 1 455 1 . . . . . 3.0 1.9 3.5 1 1 456 1 . . . . . . 1.9 2.7 1 1 457 1 . . . . . 5.0 1.9 5.8 1 1 458 1 . . . . . 5.0 1.9 5.8 1 1 459 1 . . . . . 2.6 1.9 3.0 1 1 460 1 . . . . . 2.6 1.9 3.0 1 1 461 1 . . . . . 2.6 1.9 3.0 1 1 462 1 . . . . . 2.6 1.9 3.0 1 1 463 1 . . . . . 3.0 1.9 3.5 1 1 464 1 . . . . . 3.6 1.9 4.4 1 1 465 1 . . . . . 3.0 1.9 3.5 1 1 466 1 . . . . . 3.0 1.9 3.5 1 1 467 1 . . . . . 3.6 1.9 4.4 1 1 468 1 . . . . . 2.6 1.9 3.0 1 1 469 1 . . . . . 3.0 1.9 3.5 1 1 470 1 . . . . . 3.0 1.9 3.5 1 1 471 1 . . . . . 3.0 1.9 3.5 1 1 472 1 . . . . . 2.6 1.9 3.0 1 1 473 1 . . . . . 3.0 1.9 3.5 1 1 474 1 . . . . . 3.0 1.9 3.5 1 1 475 1 . . . . . 3.0 1.9 3.5 1 1 476 1 . . . . . 3.0 1.9 3.5 1 1 477 1 . . . . . 3.0 1.9 3.5 1 1 478 1 . . . . . 3.0 1.9 3.5 1 1 479 1 . . . . . 3.0 1.9 3.5 1 1 480 1 . . . . . 3.0 1.9 3.5 1 1 481 1 . . . . . 3.6 1.9 4.4 1 1 482 1 . . . . . 2.4 1.9 2.7 1 1 483 1 . . . . . 2.4 1.9 2.7 1 1 484 1 . . . . . 3.6 1.9 4.4 1 1 485 1 . . . . . 2.6 1.9 3.0 1 1 486 1 . . . . . 3.6 1.9 4.4 1 1 487 1 . . . . . 3.0 1.9 3.5 1 1 488 1 . . . . . 3.0 1.9 3.5 1 1 489 1 . . . . . 2.4 1.9 2.7 1 1 490 1 . . . . . 2.4 1.9 2.7 1 1 491 1 . . . . . 5.0 1.9 5.8 1 1 492 1 . . . . . 3.0 1.9 3.5 1 1 493 1 . . . . . 5.0 1.9 5.8 1 1 494 1 . . . . . 3.0 1.9 3.5 1 1 495 1 . . . . . 5.0 1.9 5.8 1 1 496 1 . . . . . 5.0 1.9 5.8 1 1 497 1 . . . . . 5.0 1.9 5.8 1 1 498 1 . . . . . 5.0 1.9 5.8 1 1 499 1 . . . . . 5.0 1.9 5.8 1 1 500 1 . . . . . 5.0 1.9 5.8 1 1 501 1 . . . . . 5.0 1.9 5.8 1 1 502 1 . . . . . 2.6 1.9 3.0 1 1 503 1 . . . . . 3.6 1.9 4.4 1 1 504 1 . . . . . 5.0 1.9 5.8 1 1 505 1 . . . . . 3.6 1.9 4.4 1 1 506 1 . . . . . 3.0 1.9 3.5 1 1 507 1 . . . . . 5.0 1.9 5.8 1 1 508 1 . . . . . 5.0 1.9 5.8 1 1 509 1 . . . . . 5.0 1.9 5.8 1 1 510 1 . . . . . 5.0 1.9 5.8 1 1 511 1 . . . . . 5.0 1.9 5.8 1 1 512 1 . . . . . 3.6 1.9 4.4 1 1 513 1 . . . . . 3.6 1.9 4.4 1 1 514 1 . . . . . 5.0 1.9 5.8 1 1 515 1 . . . . . 3.0 1.9 3.5 1 1 516 1 . . . . . 3.0 1.9 3.5 1 1 517 1 . . . . . 2.4 1.9 2.7 1 1 518 1 . . . . . 3.0 1.9 3.5 1 1 519 1 . . . . . 3.0 1.9 3.5 1 1 520 1 . . . . . 2.6 1.9 3.0 1 1 521 1 . . . . . 5.0 1.9 5.8 1 1 522 1 . . . . . 3.6 1.9 4.4 1 1 523 1 . . . . . 3.6 1.9 4.4 1 1 524 1 . . . . . 5.0 1.9 5.8 1 1 525 1 . . . . . 5.0 1.9 5.8 1 1 526 1 . . . . . 5.0 1.9 5.8 1 1 527 1 . . . . . 5.0 1.9 5.8 1 1 528 1 . . . . . 3.0 1.9 3.5 1 1 529 1 . . . . . 3.0 1.9 3.5 1 1 530 1 . . . . . 3.0 1.9 3.5 1 1 531 1 . . . . . 3.0 1.9 3.5 1 1 532 1 . . . . . 2.6 1.9 3.0 1 1 533 1 . . . . . 3.6 1.9 4.4 1 1 534 1 . . . . . 5.0 1.9 5.8 1 1 535 1 . . . . . 5.0 1.9 5.8 1 1 536 1 . . . . . 3.6 1.9 4.4 1 1 537 1 . . . . . 5.0 1.9 5.8 1 1 538 1 . . . . . 5.0 1.9 5.8 1 1 539 1 . . . . . 5.0 1.9 5.8 1 1 540 1 . . . . . 2.6 1.9 3.0 1 1 541 1 . . . . . 2.4 1.9 2.7 1 1 542 1 . . . . . 3.6 1.9 4.4 1 1 543 1 . . . . . 3.0 1.9 3.5 1 1 544 1 . . . . . 5.0 1.9 5.8 1 1 545 1 . . . . . 5.0 1.9 5.8 1 1 546 1 . . . . . 3.6 1.9 4.4 1 1 547 1 . . . . . 3.6 1.9 4.4 1 1 548 1 . . . . . 5.0 1.9 5.8 1 1 549 1 . . . . . 5.0 1.9 5.8 1 1 550 1 . . . . . 5.0 1.9 5.8 1 1 551 1 . . . . . 5.0 1.9 5.8 1 1 552 1 . . . . . 5.0 1.9 5.8 1 1 553 1 . . . . . 5.0 1.9 5.8 1 1 554 1 . . . . . 5.0 1.9 5.8 1 1 555 1 . . . . . 3.0 1.9 3.5 1 1 556 1 . . . . . 2.4 1.9 2.7 1 1 557 1 . . . . . 5.0 1.9 5.8 1 1 558 1 . . . . . 5.0 1.9 5.8 1 1 559 1 . . . . . 5.0 1.9 5.8 1 1 560 1 . . . . . 5.0 1.9 5.8 1 1 561 1 . . . . . 5.0 1.9 5.8 1 1 562 1 . . . . . 5.0 1.9 5.8 1 1 563 1 . . . . . 5.0 1.9 5.8 1 1 564 1 . . . . . 5.0 1.9 5.8 1 1 565 1 . . . . . 5.0 1.9 5.8 1 1 566 1 . . . . . 5.0 1.9 5.8 1 1 567 1 . . . . . 2.4 1.9 2.7 1 1 568 1 . . . . . 2.4 1.9 2.7 1 1 569 1 . . . . . 2.4 1.9 2.7 1 1 570 1 . . . . . 5.0 1.9 5.8 1 1 571 1 . . . . . 5.0 1.9 5.8 1 1 572 1 . . . . . 5.0 1.9 5.8 1 1 573 1 . . . . . 5.0 1.9 5.8 1 1 574 1 . . . . . 5.0 1.9 5.8 1 1 575 1 . . . . . 3.6 1.9 4.4 1 1 576 1 . . . . . 3.0 1.9 3.5 1 1 577 1 . . . . . 2.4 1.9 2.7 1 1 578 1 . . . . . 3.6 1.9 4.4 1 1 579 1 . . . . . 3.6 1.9 4.4 1 1 580 1 . . . . . 2.6 1.9 3.0 1 1 581 1 . . . . . 3.0 1.9 3.5 1 1 582 1 . . . . . 2.6 1.9 3.0 1 1 583 1 . . . . . 2.4 1.9 2.7 1 1 584 1 . . . . . 2.6 1.9 3.0 1 1 585 1 . . . . . 2.6 1.9 3.0 1 1 586 1 . . . . . 2.6 1.9 3.0 1 1 587 1 . . . . . 3.6 1.9 4.4 1 1 588 1 . . . . . 5.0 1.9 5.8 1 1 589 1 . . . . . 5.0 1.9 5.8 1 1 590 1 . . . . . 3.0 1.9 3.5 1 1 591 1 . . . . . 2.6 1.9 3.0 1 1 592 1 . . . . . 5.0 1.9 5.8 1 1 593 1 . . . . . 5.0 1.9 5.8 1 1 594 1 . . . . . 3.0 1.9 3.5 1 1 595 1 . . . . . 5.0 1.9 5.8 1 1 596 1 . . . . . 5.0 1.9 5.8 1 1 597 1 . . . . . 5.0 1.9 5.8 1 1 598 1 . . . . . 5.0 1.9 5.8 1 1 599 1 . . . . . 5.0 1.9 5.8 1 1 600 1 . . . . . 5.0 1.9 5.8 1 1 601 1 . . . . . 3.6 1.9 4.4 1 1 602 1 . . . . . 3.6 1.9 4.4 1 1 603 1 . . . . . 3.6 1.9 4.4 1 1 604 1 . . . . . 3.0 1.9 3.5 1 1 605 1 . . . . . 2.6 1.9 3.0 1 1 606 1 . . . . . 2.6 1.9 3.0 1 1 607 1 . . . . . 5.0 1.9 5.8 1 1 608 1 . . . . . 5.0 1.9 5.8 1 1 609 1 . . . . . 5.0 1.9 5.8 1 1 610 1 . . . . . 5.0 1.9 5.8 1 1 611 1 . . . . . 5.0 1.9 5.8 1 1 612 1 . . . . . 5.0 1.9 5.8 1 1 613 1 . . . . . 3.6 1.9 4.4 1 1 614 1 . . . . . 5.0 1.9 5.8 1 1 615 1 . . . . . 5.0 1.9 5.8 1 1 616 1 . . . . . 5.0 1.9 5.8 1 1 617 1 . . . . . 5.0 1.9 5.8 1 1 618 1 . . . . . 5.0 1.9 5.8 1 1 619 1 . . . . . 5.0 1.9 5.8 1 1 620 1 . . . . . 5.0 1.9 5.8 1 1 621 1 . . . . . 3.6 1.9 4.4 1 1 622 1 . . . . . 3.0 1.9 3.5 1 1 623 1 . . . . . 5.0 1.9 5.8 1 1 624 1 . . . . . 5.0 1.9 5.8 1 1 625 1 . . . . . 5.0 1.9 5.8 1 1 626 1 . . . . . 5.0 1.9 5.8 1 1 627 1 . . . . . 5.0 1.9 5.8 1 1 628 1 . . . . . 2.6 1.9 3.0 1 1 629 1 . . . . . 5.0 1.9 5.8 1 1 630 1 . . . . . 5.0 1.9 5.8 1 1 631 1 . . . . . 5.0 1.9 5.8 1 1 632 1 . . . . . 5.0 1.9 5.8 1 1 633 1 . . . . . 5.0 1.9 5.8 1 1 634 1 . . . . . 5.0 1.9 5.8 1 1 635 1 . . . . . 5.0 1.9 5.8 1 1 636 1 . . . . . 5.0 1.9 5.8 1 1 637 1 . . . . . 5.0 1.9 5.8 1 1 638 1 . . . . . 5.0 1.9 5.8 1 1 639 1 . . . . . 5.0 1.9 5.8 1 1 640 1 . . . . . 5.0 1.9 5.8 1 1 641 1 . . . . . 5.0 1.9 5.8 1 1 642 1 . . . . . 5.0 1.9 5.8 1 1 643 1 . . . . . 3.6 1.9 4.4 1 1 644 1 . . . . . 5.0 1.9 5.8 1 1 645 1 . . . . . 5.0 1.9 5.8 1 1 646 1 . . . . . 5.0 1.9 5.8 1 1 647 1 . . . . . 5.0 1.9 5.8 1 1 648 1 . . . . . 5.0 1.9 5.8 1 1 649 1 . . . . . 3.0 1.9 3.5 1 1 650 1 . . . . . 3.0 1.9 3.5 1 1 651 1 . . . . . 5.0 1.9 5.8 1 1 652 1 . . . . . 5.0 1.9 5.8 1 1 653 1 . . . . . 5.0 1.9 5.8 1 1 654 1 . . . . . 5.0 1.9 5.8 1 1 655 1 . . . . . 5.0 1.9 5.8 1 1 656 1 . . . . . 5.0 1.9 5.8 1 1 657 1 . . . . . 5.0 1.9 5.8 1 1 658 1 . . . . . 5.0 1.9 5.8 1 1 659 1 . . . . . 5.0 1.9 5.8 1 1 660 1 . . . . . 5.0 1.9 5.8 1 1 661 1 . . . . . 5.0 1.9 5.8 1 1 662 1 . . . . . 5.0 1.9 5.8 1 1 663 1 . . . . . 5.0 1.9 5.8 1 1 664 1 . . . . . 5.0 1.9 5.8 1 1 665 1 . . . . . 5.0 1.9 5.8 1 1 666 1 . . . . . 5.0 1.9 5.8 1 1 667 1 . . . . . 5.0 1.9 5.8 1 1 668 1 . . . . . 5.0 1.9 5.8 1 1 669 1 . . . . . 5.0 1.9 5.8 1 1 670 1 . . . . . 5.0 1.9 5.8 1 1 671 1 . . . . . 5.0 1.9 5.8 1 1 672 1 . . . . . 5.0 1.9 5.8 1 1 673 1 . . . . . 5.0 1.9 5.8 1 1 674 1 . . . . . 5.0 1.9 5.8 1 1 stop_ save_ save_CNS/XPLOR_distance_constraints_5_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _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 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 . . . 1 2 50 1 . . . 1 2 51 1 . . . 1 2 52 1 . . . 1 2 53 1 . . . 1 2 54 1 . . . 1 2 55 1 . . . 1 2 56 1 . . . 1 2 57 1 . . . 1 2 58 1 . . . 1 2 59 1 . . . 1 2 60 1 . . . 1 2 61 1 . . . 1 2 62 1 . . . 1 2 63 1 . . . 1 2 64 1 . . . 1 2 65 1 . . . 1 2 66 1 . . . 1 2 67 1 . . . 1 2 68 1 . . . 1 2 69 1 . . . 1 2 70 1 . . . 1 2 71 1 . . . 1 2 72 1 . . . 1 2 73 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 6 ALA HA . 514 . HA 1 2 1 1 2 1 1 63 ALA H . 571 . HN 1 2 2 1 1 1 1 8 ALA HA . 516 . HA 1 2 2 1 2 1 1 61 LEU H . 569 . HN 1 2 3 1 1 1 1 8 ALA HA . 516 . HA 1 2 3 1 2 1 1 60 THR HA . 568 . HA 1 2 4 1 1 1 1 9 VAL H . 517 . HN 1 2 4 1 2 1 1 60 THR HA . 568 . HA 1 2 5 1 1 1 1 9 VAL H . 517 . HN 1 2 5 1 2 1 1 59 VAL H . 567 . HN 1 2 6 1 1 1 1 10 THR HA . 518 . HA 1 2 6 1 2 1 1 59 VAL H . 567 . HN 1 2 7 1 1 1 1 10 THR HA . 518 . HA 1 2 7 1 2 1 1 58 THR HA . 566 . HA 1 2 8 1 1 1 1 11 PHE H . 519 . HN 1 2 8 1 2 1 1 58 THR HA . 566 . HA 1 2 9 1 1 1 1 11 PHE H . 519 . HN 1 2 9 1 2 1 1 57 VAL H . 565 . HN 1 2 10 1 1 1 1 12 ASP HA . 520 . HA 1 2 10 1 2 1 1 57 VAL H . 565 . HN 1 2 11 1 1 1 1 12 ASP HA . 520 . HA 1 2 11 1 2 1 1 56 TYR HA . 564 . HA 1 2 12 1 1 1 1 13 LEU H . 521 . HN 1 2 12 1 2 1 1 56 TYR HA . 564 . HA 1 2 13 1 1 1 1 13 LEU H . 521 . HN 1 2 13 1 2 1 1 55 TRP H . 563 . HN 1 2 14 1 1 1 1 14 THR HA . 522 . HA 1 2 14 1 2 1 1 55 TRP H . 563 . HN 1 2 15 1 1 1 1 15 ALA H . 523 . HN 1 2 15 1 2 1 1 55 TRP H . 563 . HN 1 2 16 1 1 1 1 8 ALA H . 516 . HN 1 2 16 1 2 1 1 100 THR HA . 608 . HA 1 2 17 1 1 1 1 9 VAL HA . 517 . HA 1 2 17 1 2 1 1 101 ALA H . 609 . HN 1 2 18 1 1 1 1 9 VAL HA . 517 . HA 1 2 18 1 2 1 1 102 THR HA . 610 . HA 1 2 19 1 1 1 1 10 THR H . 518 . HN 1 2 19 1 2 1 1 101 ALA H . 609 . HN 1 2 20 1 1 1 1 10 THR H . 518 . HN 1 2 20 1 2 1 1 102 THR HA . 610 . HA 1 2 21 1 1 1 1 10 THR H . 518 . HN 1 2 21 1 2 1 1 103 VAL H . 611 . HN 1 2 22 1 1 1 1 11 PHE HA . 519 . HA 1 2 22 1 2 1 1 103 VAL H . 611 . HN 1 2 23 1 1 1 1 12 ASP H . 520 . HN 1 2 23 1 2 1 1 103 VAL H . 611 . HN 1 2 24 1 1 1 1 12 ASP H . 520 . HN 1 2 24 1 2 1 1 104 THR HA . 612 . HA 1 2 25 1 1 1 1 12 ASP H . 520 . HN 1 2 25 1 2 1 1 105 ASP H . 613 . HN 1 2 26 1 1 1 1 13 LEU HA . 521 . HA 1 2 26 1 2 1 1 105 ASP H . 613 . HN 1 2 27 1 1 1 1 13 LEU HA . 521 . HA 1 2 27 1 2 1 1 106 THR HA . 614 . HA 1 2 28 1 1 1 1 14 THR H . 522 . HN 1 2 28 1 2 1 1 106 THR HA . 614 . HA 1 2 29 1 1 1 1 14 THR H . 522 . HN 1 2 29 1 2 1 1 107 TRP H . 615 . HN 1 2 30 1 1 1 1 15 ALA HA . 523 . HA 1 2 30 1 2 1 1 107 TRP H . 615 . HN 1 2 31 1 1 1 1 23 ILE H . 531 . HN 1 2 31 1 2 1 1 43 LEU H . 551 . HN 1 2 32 1 1 1 1 24 TYR HA . 532 . HA 1 2 32 1 2 1 1 43 LEU H . 551 . HN 1 2 33 1 1 1 1 24 TYR HA . 532 . HA 1 2 33 1 2 1 1 42 ALA HA . 550 . HA 1 2 34 1 1 1 1 25 LEU H . 533 . HN 1 2 34 1 2 1 1 43 LEU H . 551 . HN 1 2 35 1 1 1 1 25 LEU H . 533 . HN 1 2 35 1 2 1 1 42 ALA HA . 550 . HA 1 2 36 1 1 1 1 25 LEU H . 533 . HN 1 2 36 1 2 1 1 41 ILE H . 549 . HN 1 2 37 1 1 1 1 26 VAL HA . 534 . HA 1 2 37 1 2 1 1 41 ILE H . 549 . HN 1 2 38 1 1 1 1 26 VAL HA . 534 . HA 1 2 38 1 2 1 1 40 GLY QA . 548 . HA# 1 2 39 1 1 1 1 22 ASN H . 530 . HN 1 2 39 1 2 1 1 75 GLU HA . 583 . HA 1 2 40 1 1 1 1 22 ASN H . 530 . HN 1 2 40 1 2 1 1 74 ILE H . 582 . HN 1 2 41 1 1 1 1 23 ILE HA . 531 . HA 1 2 41 1 2 1 1 74 ILE H . 582 . HN 1 2 42 1 1 1 1 23 ILE HA . 531 . HA 1 2 42 1 2 1 1 73 ARG HA . 581 . HA 1 2 43 1 1 1 1 24 TYR H . 532 . HN 1 2 43 1 2 1 1 73 ARG HA . 581 . HA 1 2 44 1 1 1 1 24 TYR H . 532 . HN 1 2 44 1 2 1 1 72 ILE H . 580 . HN 1 2 45 1 1 1 1 25 LEU HA . 533 . HA 1 2 45 1 2 1 1 72 ILE H . 580 . HN 1 2 46 1 1 1 1 25 LEU HA . 533 . HA 1 2 46 1 2 1 1 71 PHE HA . 579 . HA 1 2 47 1 1 1 1 26 VAL H . 534 . HN 1 2 47 1 2 1 1 71 PHE HA . 579 . HA 1 2 48 1 1 1 1 26 VAL H . 534 . HN 1 2 48 1 2 1 1 70 LYS H . 578 . HN 1 2 49 1 1 1 1 27 GLY QA . 535 . HA# 1 2 49 1 2 1 1 70 LYS H . 578 . HN 1 2 50 1 1 1 1 27 GLY QA . 535 . HA# 1 2 50 1 2 1 1 69 TYR HA . 577 . HA 1 2 51 1 1 1 1 28 SER H . 536 . HN 1 2 51 1 2 1 1 69 TYR HA . 577 . HA 1 2 52 1 1 1 1 28 SER H . 536 . HN 1 2 52 1 2 1 1 68 GLU H . 576 . HN 1 2 53 1 1 1 1 29 ILE HA . 537 . HA 1 2 53 1 2 1 1 68 GLU H . 576 . HN 1 2 54 1 1 1 1 29 ILE HA . 537 . HA 1 2 54 1 2 1 1 67 PHE HA . 575 . HA 1 2 55 1 1 1 1 30 SER H . 538 . HN 1 2 55 1 2 1 1 67 PHE HA . 575 . HA 1 2 56 1 1 1 1 44 SER H . 552 . HN 1 2 56 1 2 1 1 56 TYR H . 564 . HN 1 2 57 1 1 1 1 44 SER H . 552 . HN 1 2 57 1 2 1 1 57 VAL HA . 565 . HA 1 2 58 1 1 1 1 74 ILE HA . 582 . HA 1 2 58 1 2 1 1 81 GLU H . 589 . HN 1 2 59 1 1 1 1 73 ARG H . 581 . HN 1 2 59 1 2 1 1 81 GLU H . 589 . HN 1 2 60 1 1 1 1 73 ARG H . 581 . HN 1 2 60 1 2 1 1 82 TRP HA . 590 . HA 1 2 61 1 1 1 1 72 ILE HA . 580 . HA 1 2 61 1 2 1 1 82 TRP HA . 590 . HA 1 2 62 1 1 1 1 72 ILE HA . 580 . HA 1 2 62 1 2 1 1 83 GLU H . 591 . HN 1 2 63 1 1 1 1 71 PHE H . 579 . HN 1 2 63 1 2 1 1 83 GLU H . 591 . HN 1 2 64 1 1 1 1 69 TYR H . 577 . HN 1 2 64 1 2 1 1 88 ARG H . 596 . HN 1 2 65 1 1 1 1 69 TYR H . 577 . HN 1 2 65 1 2 1 1 89 GLU HA . 597 . HA 1 2 66 1 1 1 1 68 GLU HA . 576 . HA 1 2 66 1 2 1 1 89 GLU HA . 597 . HA 1 2 67 1 1 1 1 68 GLU HA . 576 . HA 1 2 67 1 2 1 1 90 TYR H . 598 . HN 1 2 68 1 1 1 1 67 PHE H . 575 . HN 1 2 68 1 2 1 1 89 GLU HA . 597 . HA 1 2 69 1 1 1 1 67 PHE H . 575 . HN 1 2 69 1 2 1 1 90 TYR H . 598 . HN 1 2 70 1 1 1 1 67 PHE H . 575 . HN 1 2 70 1 2 1 1 91 THR HA . 599 . HA 1 2 71 1 1 1 1 66 SER HA . 574 . HA 1 2 71 1 2 1 1 91 THR HA . 599 . HA 1 2 72 1 1 1 1 66 SER HA . 574 . HA 1 2 72 1 2 1 1 92 VAL H . 600 . HN 1 2 73 1 1 1 1 65 GLU H . 573 . HN 1 2 73 1 2 1 1 92 VAL H . 600 . HN 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.6 1.9 4.4 1 2 2 1 . . . . . 5.0 1.9 5.8 1 2 3 1 . . . . . 5.0 1.9 5.8 1 2 4 1 . . . . . 3.6 1.9 4.4 1 2 5 1 . . . . . 5.0 1.9 5.8 1 2 6 1 . . . . . 5.0 1.9 5.8 1 2 7 1 . . . . . 5.0 1.9 5.8 1 2 8 1 . . . . . 3.6 1.9 4.4 1 2 9 1 . . . . . 3.6 1.9 4.4 1 2 10 1 . . . . . 5.0 1.9 5.8 1 2 11 1 . . . . . 3.6 1.9 4.4 1 2 12 1 . . . . . 3.6 1.9 4.4 1 2 13 1 . . . . . 5.0 1.9 5.8 1 2 14 1 . . . . . 5.0 1.9 5.8 1 2 15 1 . . . . . 5.0 1.9 5.8 1 2 16 1 . . . . . 5.0 1.9 5.8 1 2 17 1 . . . . . 5.0 1.9 5.8 1 2 18 1 . . . . . 5.0 1.9 5.8 1 2 19 1 . . . . . 5.0 1.9 5.8 1 2 20 1 . . . . . 3.6 1.9 4.4 1 2 21 1 . . . . . 5.0 1.9 5.8 1 2 22 1 . . . . . 5.0 1.9 5.8 1 2 23 1 . . . . . 5.0 1.9 5.8 1 2 24 1 . . . . . 5.0 1.9 5.8 1 2 25 1 . . . . . 5.0 1.9 5.8 1 2 26 1 . . . . . 5.0 1.9 5.8 1 2 27 1 . . . . . 5.0 1.9 5.8 1 2 28 1 . . . . . 5.0 1.9 5.8 1 2 29 1 . . . . . 5.0 1.9 5.8 1 2 30 1 . . . . . 5.0 1.9 5.8 1 2 31 1 . . . . . 5.0 1.9 5.8 1 2 32 1 . . . . . 5.0 1.9 5.8 1 2 33 1 . . . . . 5.0 1.9 5.8 1 2 34 1 . . . . . 5.0 1.9 5.8 1 2 35 1 . . . . . 3.6 1.9 4.4 1 2 36 1 . . . . . 5.0 1.9 5.8 1 2 37 1 . . . . . 5.0 1.9 5.8 1 2 38 1 . . . . . 3.6 1.9 4.4 1 2 39 1 . . . . . 5.0 1.9 5.8 1 2 40 1 . . . . . 3.6 1.9 4.4 1 2 41 1 . . . . . 5.0 1.9 5.8 1 2 42 1 . . . . . 5.0 1.9 5.8 1 2 43 1 . . . . . 5.0 1.9 5.8 1 2 44 1 . . . . . 5.0 1.9 5.8 1 2 45 1 . . . . . 5.0 1.9 5.8 1 2 46 1 . . . . . 5.0 1.9 5.8 1 2 47 1 . . . . . 5.0 1.9 5.8 1 2 48 1 . . . . . 5.0 1.9 5.8 1 2 49 1 . . . . . 5.0 1.9 5.8 1 2 50 1 . . . . . 5.0 1.9 5.8 1 2 51 1 . . . . . 5.0 1.9 5.8 1 2 52 1 . . . . . 5.0 1.9 5.8 1 2 53 1 . . . . . 5.0 1.9 5.8 1 2 54 1 . . . . . 5.0 1.9 5.8 1 2 55 1 . . . . . 5.0 1.9 5.8 1 2 56 1 . . . . . 5.0 1.9 5.8 1 2 57 1 . . . . . 3.6 1.9 4.4 1 2 58 1 . . . . . 3.6 1.9 4.4 1 2 59 1 . . . . . 5.0 1.9 5.8 1 2 60 1 . . . . . 5.0 1.9 5.8 1 2 61 1 . . . . . 5.0 1.9 5.8 1 2 62 1 . . . . . 5.0 1.9 5.8 1 2 63 1 . . . . . 5.0 1.9 5.8 1 2 64 1 . . . . . 5.0 1.9 5.8 1 2 65 1 . . . . . 5.0 1.9 5.8 1 2 66 1 . . . . . 3.6 1.9 4.4 1 2 67 1 . . . . . 3.6 1.9 4.4 1 2 68 1 . . . . . 3.6 1.9 4.4 1 2 69 1 . . . . . 5.0 1.9 5.8 1 2 70 1 . . . . . 5.0 1.9 5.8 1 2 71 1 . . . . . 3.0 1.9 3.5 1 2 72 1 . . . . . 5.0 1.9 5.8 1 2 73 1 . . . . . 5.0 1.9 5.8 1 2 stop_ save_ save_CNS/XPLOR_distance_constraints_7_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 3 _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 3 2 1 . . . 1 3 3 1 . . . 1 3 4 1 . . . 1 3 5 1 . . . 1 3 6 1 . . . 1 3 7 1 . . . 1 3 8 1 . . . 1 3 9 1 . . . 1 3 10 1 . . . 1 3 11 1 . . . 1 3 12 1 . . . 1 3 13 1 . . . 1 3 14 1 . . . 1 3 15 1 . . . 1 3 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 11 PHE QD . 519 . HD# 1 3 1 1 2 1 1 29 ILE MD . 537 . HD# 1 3 1 1 2 1 1 32 LEU QD . 540 . HD# 1 3 2 1 1 1 1 11 PHE QE . 519 . HE# 1 3 2 1 2 1 1 29 ILE MD . 537 . HD# 1 3 2 1 2 1 1 32 LEU QD . 540 . HD# 1 3 3 1 1 1 1 11 PHE HZ . 519 . HZ 1 3 3 1 2 1 1 29 ILE MD . 537 . HD# 1 3 3 1 2 1 1 32 LEU QD . 540 . HD# 1 3 4 1 1 1 1 16 THR HA . 524 . HA 1 3 4 1 1 1 1 23 ILE HA . 531 . HA 1 3 4 1 2 1 1 23 ILE MD . 531 . HD# 1 3 5 1 1 1 1 23 ILE MD . 531 . HD# 1 3 5 1 2 1 1 73 ARG HA . 581 . HA 1 3 5 1 2 1 1 74 ILE HA . 582 . HA 1 3 6 1 1 1 1 24 TYR QD . 532 . HD# 1 3 6 1 2 1 1 72 ILE MD . 580 . HD# 1 3 6 1 2 1 1 74 ILE MD . 582 . HD# 1 3 7 1 1 1 1 28 SER H . 536 . HN 1 3 7 1 2 1 1 29 ILE MD . 537 . HD# 1 3 7 1 2 1 1 32 LEU QD . 540 . HD# 1 3 8 1 1 1 1 43 LEU HA . 551 . HA 1 3 8 1 1 1 1 47 LYS HA . 555 . HA 1 3 8 1 2 1 1 56 TYR QD . 564 . HD# 1 3 9 1 1 1 1 43 LEU HA . 551 . HA 1 3 9 1 1 1 1 47 LYS HA . 555 . HA 1 3 9 1 2 1 1 56 TYR QE . 564 . HE# 1 3 10 1 1 1 1 26 VAL HA . 534 . HA 1 3 10 1 1 1 1 39 ASP HA . 547 . HA 1 3 10 1 2 1 1 36 GLU H . 544 . HN 1 3 11 1 1 1 1 35 TRP QB . 543 . HB# 1 3 11 1 1 1 1 84 SER QB . 592 . HB# 1 3 11 1 2 1 1 82 TRP HD1 . 590 . HD1 1 3 12 1 1 1 1 23 ILE HA . 531 . HA 1 3 12 1 1 1 1 106 THR HA . 614 . HA 1 3 12 1 2 1 1 107 TRP HD1 . 615 . HD1 1 3 13 1 1 1 1 7 VAL HA . 515 . HA 1 3 13 1 1 1 1 104 THR HB . 612 . HB 1 3 13 1 2 1 1 90 TYR QE . 598 . HE# 1 3 14 1 1 1 1 82 TRP HE1 . 590 . HE1 1 3 14 1 2 2 2 1 GLC H3 BCD1 1 . H3 1 3 15 1 1 1 1 45 ALA MB . 553 . HB# 1 3 15 1 2 3 2 1 GLC H3 BCD2 1 . H3 1 3 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 5.0 1.9 5.8 1 3 2 1 . . . . . 5.0 1.9 5.8 1 3 3 1 . . . . . 5.0 1.9 5.8 1 3 4 1 . . . . . 5.0 1.9 5.8 1 3 5 1 . . . . . 3.0 1.9 3.5 1 3 6 1 . . . . . 2.6 1.9 3.0 1 3 7 1 . . . . . 3.6 1.9 4.4 1 3 8 1 . . . . . 3.0 1.9 3.5 1 3 9 1 . . . . . 3.0 1.9 3.5 1 3 10 1 . . . . . 5.0 1.9 5.8 1 3 11 1 . . . . . 5.0 1.9 5.8 1 3 12 1 . . . . . 5.0 1.9 5.8 1 3 13 1 . . . . . 5.0 1.9 5.8 1 3 14 1 . . . . . 3.6 1.9 4.4 1 3 15 1 . . . . . 2.6 1.9 3.0 1 3 stop_ save_ save_CNS/XPLOR_distance_constraints_6_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 4 _Distance_constraint_list.Constraint_type "hydrogen bond" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 4 2 1 . . . 1 4 3 1 . . . 1 4 4 1 . . . 1 4 5 1 . . . 1 4 6 1 . . . 1 4 7 1 . . . 1 4 8 1 . . . 1 4 9 1 . . . 1 4 10 1 . . . 1 4 11 1 . . . 1 4 12 1 . . . 1 4 13 1 . . . 1 4 14 1 . . . 1 4 15 1 . . . 1 4 16 1 . . . 1 4 17 1 . . . 1 4 18 1 . . . 1 4 19 1 . . . 1 4 20 1 . . . 1 4 21 1 . . . 1 4 22 1 . . . 1 4 23 1 . . . 1 4 24 1 . . . 1 4 25 1 . . . 1 4 26 1 . . . 1 4 27 1 . . . 1 4 28 1 . . . 1 4 29 1 . . . 1 4 30 1 . . . 1 4 31 1 . . . 1 4 32 1 . . . 1 4 33 1 . . . 1 4 34 1 . . . 1 4 35 1 . . . 1 4 36 1 . . . 1 4 37 1 . . . 1 4 38 1 . . . 1 4 39 1 . . . 1 4 40 1 . . . 1 4 41 1 . . . 1 4 42 1 . . . 1 4 43 1 . . . 1 4 44 1 . . . 1 4 45 1 . . . 1 4 46 1 . . . 1 4 47 1 . . . 1 4 48 1 . . . 1 4 49 1 . . . 1 4 50 1 . . . 1 4 51 1 . . . 1 4 52 1 . . . 1 4 53 1 . . . 1 4 54 1 . . . 1 4 55 1 . . . 1 4 56 1 . . . 1 4 57 1 . . . 1 4 58 1 . . . 1 4 59 1 . . . 1 4 60 1 . . . 1 4 61 1 . . . 1 4 62 1 . . . 1 4 63 1 . . . 1 4 64 1 . . . 1 4 65 1 . . . 1 4 66 1 . . . 1 4 67 1 . . . 1 4 68 1 . . . 1 4 69 1 . . . 1 4 70 1 . . . 1 4 71 1 . . . 1 4 72 1 . . . 1 4 73 1 . . . 1 4 74 1 . . . 1 4 75 1 . . . 1 4 76 1 . . . 1 4 77 1 . . . 1 4 78 1 . . . 1 4 79 1 . . . 1 4 80 1 . . . 1 4 81 1 . . . 1 4 82 1 . . . 1 4 83 1 . . . 1 4 84 1 . . . 1 4 85 1 . . . 1 4 86 1 . . . 1 4 87 1 . . . 1 4 88 1 . . . 1 4 89 1 . . . 1 4 90 1 . . . 1 4 91 1 . . . 1 4 92 1 . . . 1 4 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 5 THR O . 513 . O 1 4 1 1 2 1 1 63 ALA N . 571 . N 1 4 2 1 1 1 1 5 THR O . 513 . O 1 4 2 1 2 1 1 63 ALA H . 571 . HN 1 4 3 1 1 1 1 7 VAL N . 515 . N 1 4 3 1 2 1 1 61 LEU O . 569 . O 1 4 4 1 1 1 1 7 VAL H . 515 . HN 1 4 4 1 2 1 1 61 LEU O . 569 . O 1 4 5 1 1 1 1 7 VAL O . 515 . O 1 4 5 1 2 1 1 61 LEU N . 569 . N 1 4 6 1 1 1 1 7 VAL O . 515 . O 1 4 6 1 2 1 1 61 LEU H . 569 . HN 1 4 7 1 1 1 1 9 VAL N . 517 . N 1 4 7 1 2 1 1 59 VAL O . 567 . O 1 4 8 1 1 1 1 9 VAL H . 517 . HN 1 4 8 1 2 1 1 59 VAL O . 567 . O 1 4 9 1 1 1 1 9 VAL O . 517 . O 1 4 9 1 2 1 1 59 VAL N . 567 . N 1 4 10 1 1 1 1 9 VAL O . 517 . O 1 4 10 1 2 1 1 59 VAL H . 567 . HN 1 4 11 1 1 1 1 11 PHE N . 519 . N 1 4 11 1 2 1 1 57 VAL O . 565 . O 1 4 12 1 1 1 1 11 PHE H . 519 . HN 1 4 12 1 2 1 1 57 VAL O . 565 . O 1 4 13 1 1 1 1 11 PHE O . 519 . O 1 4 13 1 2 1 1 57 VAL N . 565 . N 1 4 14 1 1 1 1 11 PHE O . 519 . O 1 4 14 1 2 1 1 57 VAL H . 565 . HN 1 4 15 1 1 1 1 13 LEU N . 521 . N 1 4 15 1 2 1 1 55 TRP O . 563 . O 1 4 16 1 1 1 1 13 LEU H . 521 . HN 1 4 16 1 2 1 1 55 TRP O . 563 . O 1 4 17 1 1 1 1 52 ASP O . 560 . O 1 4 17 1 2 1 1 55 TRP N . 563 . N 1 4 18 1 1 1 1 52 ASP O . 560 . O 1 4 18 1 2 1 1 55 TRP H . 563 . HN 1 4 19 1 1 1 1 15 ALA N . 523 . N 1 4 19 1 2 1 1 53 PRO O . 561 . O 1 4 20 1 1 1 1 15 ALA H . 523 . HN 1 4 20 1 2 1 1 53 PRO O . 561 . O 1 4 21 1 1 1 1 8 ALA N . 516 . N 1 4 21 1 2 1 1 99 SER O . 607 . O 1 4 22 1 1 1 1 8 ALA H . 516 . HN 1 4 22 1 2 1 1 99 SER O . 607 . O 1 4 23 1 1 1 1 8 ALA O . 516 . O 1 4 23 1 2 1 1 101 ALA N . 609 . N 1 4 24 1 1 1 1 8 ALA O . 516 . O 1 4 24 1 2 1 1 101 ALA H . 609 . HN 1 4 25 1 1 1 1 10 THR N . 518 . N 1 4 25 1 2 1 1 101 ALA O . 609 . O 1 4 26 1 1 1 1 10 THR H . 518 . HN 1 4 26 1 2 1 1 101 ALA O . 609 . O 1 4 27 1 1 1 1 10 THR O . 518 . O 1 4 27 1 2 1 1 103 VAL N . 611 . N 1 4 28 1 1 1 1 10 THR O . 518 . O 1 4 28 1 2 1 1 103 VAL H . 611 . HN 1 4 29 1 1 1 1 12 ASP N . 520 . N 1 4 29 1 2 1 1 103 VAL O . 611 . O 1 4 30 1 1 1 1 12 ASP H . 520 . HN 1 4 30 1 2 1 1 103 VAL O . 611 . O 1 4 31 1 1 1 1 12 ASP O . 520 . O 1 4 31 1 2 1 1 105 ASP N . 613 . N 1 4 32 1 1 1 1 12 ASP O . 520 . O 1 4 32 1 2 1 1 105 ASP H . 613 . HN 1 4 33 1 1 1 1 14 THR N . 522 . N 1 4 33 1 2 1 1 105 ASP O . 613 . O 1 4 34 1 1 1 1 14 THR H . 522 . HN 1 4 34 1 2 1 1 105 ASP O . 613 . O 1 4 35 1 1 1 1 14 THR O . 522 . O 1 4 35 1 2 1 1 107 TRP N . 615 . N 1 4 36 1 1 1 1 14 THR O . 522 . O 1 4 36 1 2 1 1 107 TRP H . 615 . HN 1 4 37 1 1 1 1 23 ILE O . 531 . O 1 4 37 1 2 1 1 43 LEU N . 551 . N 1 4 38 1 1 1 1 23 ILE O . 531 . O 1 4 38 1 2 1 1 43 LEU H . 551 . HN 1 4 39 1 1 1 1 25 LEU N . 533 . N 1 4 39 1 2 1 1 41 ILE O . 549 . O 1 4 40 1 1 1 1 25 LEU H . 533 . HN 1 4 40 1 2 1 1 41 ILE O . 549 . O 1 4 41 1 1 1 1 25 LEU O . 533 . O 1 4 41 1 2 1 1 41 ILE N . 549 . N 1 4 42 1 1 1 1 25 LEU O . 533 . O 1 4 42 1 2 1 1 41 ILE H . 549 . HN 1 4 43 1 1 1 1 22 ASN N . 530 . N 1 4 43 1 2 1 1 74 ILE O . 582 . O 1 4 44 1 1 1 1 22 ASN H . 530 . HN 1 4 44 1 2 1 1 74 ILE O . 582 . O 1 4 45 1 1 1 1 22 ASN O . 530 . O 1 4 45 1 2 1 1 74 ILE N . 582 . N 1 4 46 1 1 1 1 22 ASN O . 530 . O 1 4 46 1 2 1 1 74 ILE H . 582 . HN 1 4 47 1 1 1 1 24 TYR N . 532 . N 1 4 47 1 2 1 1 72 ILE O . 580 . O 1 4 48 1 1 1 1 24 TYR H . 532 . HN 1 4 48 1 2 1 1 72 ILE O . 580 . O 1 4 49 1 1 1 1 24 TYR O . 532 . O 1 4 49 1 2 1 1 72 ILE N . 580 . N 1 4 50 1 1 1 1 24 TYR O . 532 . O 1 4 50 1 2 1 1 72 ILE H . 580 . HN 1 4 51 1 1 1 1 26 VAL N . 534 . N 1 4 51 1 2 1 1 70 LYS O . 578 . O 1 4 52 1 1 1 1 26 VAL H . 534 . HN 1 4 52 1 2 1 1 70 LYS O . 578 . O 1 4 53 1 1 1 1 26 VAL O . 534 . O 1 4 53 1 2 1 1 70 LYS N . 578 . N 1 4 54 1 1 1 1 26 VAL O . 534 . O 1 4 54 1 2 1 1 70 LYS H . 578 . HN 1 4 55 1 1 1 1 28 SER N . 536 . N 1 4 55 1 2 1 1 68 GLU O . 576 . O 1 4 56 1 1 1 1 28 SER H . 536 . HN 1 4 56 1 2 1 1 68 GLU O . 576 . O 1 4 57 1 1 1 1 28 SER O . 536 . O 1 4 57 1 2 1 1 68 GLU N . 576 . N 1 4 58 1 1 1 1 28 SER O . 536 . O 1 4 58 1 2 1 1 68 GLU H . 576 . HN 1 4 59 1 1 1 1 44 SER N . 552 . N 1 4 59 1 2 1 1 56 TYR O . 564 . O 1 4 60 1 1 1 1 44 SER H . 552 . HN 1 4 60 1 2 1 1 56 TYR O . 564 . O 1 4 61 1 1 1 1 44 SER O . 552 . O 1 4 61 1 2 1 1 56 TYR N . 564 . N 1 4 62 1 1 1 1 44 SER O . 552 . O 1 4 62 1 2 1 1 56 TYR H . 564 . HN 1 4 63 1 1 1 1 71 PHE N . 579 . N 1 4 63 1 2 1 1 83 GLU O . 591 . O 1 4 64 1 1 1 1 71 PHE H . 579 . HN 1 4 64 1 2 1 1 83 GLU O . 591 . O 1 4 65 1 1 1 1 71 PHE O . 579 . O 1 4 65 1 2 1 1 83 GLU N . 591 . N 1 4 66 1 1 1 1 71 PHE O . 579 . O 1 4 66 1 2 1 1 83 GLU H . 591 . HN 1 4 67 1 1 1 1 73 ARG N . 581 . N 1 4 67 1 2 1 1 81 GLU O . 589 . O 1 4 68 1 1 1 1 73 ARG H . 581 . HN 1 4 68 1 2 1 1 81 GLU O . 589 . O 1 4 69 1 1 1 1 73 ARG O . 581 . O 1 4 69 1 2 1 1 81 GLU N . 589 . N 1 4 70 1 1 1 1 73 ARG O . 581 . O 1 4 70 1 2 1 1 81 GLU H . 589 . HN 1 4 71 1 1 1 1 65 GLU N . 573 . N 1 4 71 1 2 1 1 92 VAL O . 600 . O 1 4 72 1 1 1 1 65 GLU H . 573 . HN 1 4 72 1 2 1 1 92 VAL O . 600 . O 1 4 73 1 1 1 1 65 GLU O . 573 . O 1 4 73 1 2 1 1 92 VAL N . 600 . N 1 4 74 1 1 1 1 65 GLU O . 573 . O 1 4 74 1 2 1 1 92 VAL H . 600 . HN 1 4 75 1 1 1 1 67 PHE N . 575 . N 1 4 75 1 2 1 1 90 TYR O . 598 . O 1 4 76 1 1 1 1 67 PHE H . 575 . HN 1 4 76 1 2 1 1 90 TYR O . 598 . O 1 4 77 1 1 1 1 67 PHE O . 575 . O 1 4 77 1 2 1 1 90 TYR N . 598 . N 1 4 78 1 1 1 1 67 PHE O . 575 . O 1 4 78 1 2 1 1 90 TYR H . 598 . HN 1 4 79 1 1 1 1 69 TYR N . 577 . N 1 4 79 1 2 1 1 88 ARG O . 596 . O 1 4 80 1 1 1 1 69 TYR H . 577 . HN 1 4 80 1 2 1 1 88 ARG O . 596 . O 1 4 81 1 1 1 1 69 TYR O . 577 . O 1 4 81 1 2 1 1 88 ARG N . 596 . N 1 4 82 1 1 1 1 69 TYR O . 577 . O 1 4 82 1 2 1 1 88 ARG H . 596 . HN 1 4 83 1 1 1 1 23 ILE N . 531 . N 1 4 83 1 2 1 1 43 LEU O . 551 . O 1 4 84 1 1 1 1 23 ILE H . 531 . HN 1 4 84 1 2 1 1 43 LEU O . 551 . O 1 4 85 1 1 1 1 29 ILE N . 537 . N 1 4 85 1 2 1 1 32 LEU O . 540 . O 1 4 86 1 1 1 1 29 ILE H . 537 . HN 1 4 86 1 2 1 1 32 LEU O . 540 . O 1 4 87 1 1 1 1 29 ILE O . 537 . O 1 4 87 1 2 1 1 32 LEU N . 540 . N 1 4 88 1 1 1 1 29 ILE O . 537 . O 1 4 88 1 2 1 1 32 LEU H . 540 . HN 1 4 89 1 1 1 1 33 GLY N . 541 . N 1 4 89 1 2 1 1 39 ASP O . 547 . O 1 4 90 1 1 1 1 33 GLY H . 541 . HN 1 4 90 1 2 1 1 39 ASP O . 547 . O 1 4 91 1 1 1 1 75 GLU N . 583 . N 1 4 91 1 2 1 1 79 SER O . 587 . O 1 4 92 1 1 1 1 75 GLU H . 583 . HN 1 4 92 1 2 1 1 79 SER O . 587 . O 1 4 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . 3.3 2.5 3.5 1 4 2 1 . . . . . 2.3 1.8 2.5 1 4 3 1 . . . . . 3.3 2.5 3.5 1 4 4 1 . . . . . 2.3 1.8 2.5 1 4 5 1 . . . . . 3.3 2.5 3.5 1 4 6 1 . . . . . 2.3 1.8 2.5 1 4 7 1 . . . . . 3.3 2.5 3.5 1 4 8 1 . . . . . 2.3 1.8 2.5 1 4 9 1 . . . . . 3.3 2.5 3.5 1 4 10 1 . . . . . 2.3 1.8 2.5 1 4 11 1 . . . . . 3.3 2.5 3.5 1 4 12 1 . . . . . 2.3 1.8 2.5 1 4 13 1 . . . . . 3.3 2.5 3.5 1 4 14 1 . . . . . 2.3 1.8 2.5 1 4 15 1 . . . . . 3.3 2.5 3.5 1 4 16 1 . . . . . 2.3 1.8 2.5 1 4 17 1 . . . . . 3.3 2.5 3.5 1 4 18 1 . . . . . 2.3 1.8 2.5 1 4 19 1 . . . . . 3.3 2.5 3.5 1 4 20 1 . . . . . 2.3 1.8 2.5 1 4 21 1 . . . . . 3.3 2.5 3.5 1 4 22 1 . . . . . 2.3 1.8 2.5 1 4 23 1 . . . . . 3.3 2.5 3.5 1 4 24 1 . . . . . 2.3 1.8 2.5 1 4 25 1 . . . . . 3.3 2.5 3.5 1 4 26 1 . . . . . 2.3 1.8 2.5 1 4 27 1 . . . . . 3.3 2.5 3.5 1 4 28 1 . . . . . 2.3 1.8 2.5 1 4 29 1 . . . . . 3.3 2.5 3.5 1 4 30 1 . . . . . 2.3 1.8 2.5 1 4 31 1 . . . . . 3.3 2.5 3.5 1 4 32 1 . . . . . 2.3 1.8 2.5 1 4 33 1 . . . . . 3.3 2.5 3.5 1 4 34 1 . . . . . 2.3 1.8 2.5 1 4 35 1 . . . . . 3.3 2.5 3.5 1 4 36 1 . . . . . 2.3 1.8 2.5 1 4 37 1 . . . . . 3.3 2.5 3.5 1 4 38 1 . . . . . 2.3 1.8 2.5 1 4 39 1 . . . . . 3.3 2.5 3.5 1 4 40 1 . . . . . 2.3 1.8 2.5 1 4 41 1 . . . . . 3.3 2.5 3.5 1 4 42 1 . . . . . 2.3 1.8 2.5 1 4 43 1 . . . . . 3.3 2.5 3.5 1 4 44 1 . . . . . 2.3 1.8 2.5 1 4 45 1 . . . . . 3.3 2.5 3.5 1 4 46 1 . . . . . 2.3 1.8 2.5 1 4 47 1 . . . . . 3.3 2.5 3.5 1 4 48 1 . . . . . 2.3 1.8 2.5 1 4 49 1 . . . . . 3.3 2.5 3.5 1 4 50 1 . . . . . 2.3 1.8 2.5 1 4 51 1 . . . . . 3.3 2.5 3.5 1 4 52 1 . . . . . 2.3 1.8 2.5 1 4 53 1 . . . . . 3.3 2.5 3.5 1 4 54 1 . . . . . 2.3 1.8 2.5 1 4 55 1 . . . . . 3.3 2.5 3.5 1 4 56 1 . . . . . 2.3 1.8 2.5 1 4 57 1 . . . . . 3.3 2.5 3.5 1 4 58 1 . . . . . 2.3 1.8 2.5 1 4 59 1 . . . . . 3.3 2.5 3.5 1 4 60 1 . . . . . 2.3 1.8 2.5 1 4 61 1 . . . . . 3.3 2.5 3.5 1 4 62 1 . . . . . 2.3 1.8 2.5 1 4 63 1 . . . . . 3.3 2.5 3.5 1 4 64 1 . . . . . 2.3 1.8 2.5 1 4 65 1 . . . . . 3.3 2.5 3.5 1 4 66 1 . . . . . 2.3 1.8 2.5 1 4 67 1 . . . . . 3.3 2.5 3.5 1 4 68 1 . . . . . 2.3 1.8 2.5 1 4 69 1 . . . . . 3.3 2.5 3.5 1 4 70 1 . . . . . 2.3 1.8 2.5 1 4 71 1 . . . . . 3.3 2.5 3.5 1 4 72 1 . . . . . 2.3 1.8 2.5 1 4 73 1 . . . . . 3.3 2.5 3.5 1 4 74 1 . . . . . 2.3 1.8 2.5 1 4 75 1 . . . . . 3.3 2.5 3.5 1 4 76 1 . . . . . 2.3 1.8 2.5 1 4 77 1 . . . . . 3.3 2.5 3.5 1 4 78 1 . . . . . 2.3 1.8 2.5 1 4 79 1 . . . . . 3.3 2.5 3.5 1 4 80 1 . . . . . 2.3 1.8 2.5 1 4 81 1 . . . . . 3.3 2.5 3.5 1 4 82 1 . . . . . 2.3 1.8 2.5 1 4 83 1 . . . . . 3.3 2.5 3.5 1 4 84 1 . . . . . 2.3 1.8 2.5 1 4 85 1 . . . . . 3.3 2.5 3.5 1 4 86 1 . . . . . 2.3 1.8 2.5 1 4 87 1 . . . . . 3.3 2.5 3.5 1 4 88 1 . . . . . 2.3 1.8 2.5 1 4 89 1 . . . . . 3.3 2.5 3.5 1 4 90 1 . . . . . 2.3 1.8 2.5 1 4 91 1 . . . . . 3.3 2.5 3.5 1 4 92 1 . . . . . 2.3 1.8 2.5 1 4 stop_ save_ save_CNS/XPLOR_dihedral_8 _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 5 THR C 1 1 6 ALA N 1 1 6 ALA CA 1 1 6 ALA C -160.0 -80.0 . 513 . C . 514 . N . 514 . CA . 514 . C 1 1 2 . 1 1 6 ALA C 1 1 7 VAL N 1 1 7 VAL CA 1 1 7 VAL C -160.0 -80.0 . 514 . C . 515 . N . 515 . CA . 515 . C 1 1 3 . 1 1 7 VAL C 1 1 8 ALA N 1 1 8 ALA CA 1 1 8 ALA C -160.0 -80.0 . 515 . C . 516 . N . 516 . CA . 516 . C 1 1 4 . 1 1 8 ALA C 1 1 9 VAL N 1 1 9 VAL CA 1 1 9 VAL C -160.0 -80.0 . 516 . C . 517 . N . 517 . CA . 517 . C 1 1 5 . 1 1 9 VAL C 1 1 10 THR N 1 1 10 THR CA 1 1 10 THR C -160.0 -80.0 . 517 . C . 518 . N . 518 . CA . 518 . C 1 1 6 . 1 1 10 THR C 1 1 11 PHE N 1 1 11 PHE CA 1 1 11 PHE C -160.0 -80.0 . 518 . C . 519 . N . 519 . CA . 519 . C 1 1 7 . 1 1 11 PHE C 1 1 12 ASP N 1 1 12 ASP CA 1 1 12 ASP C -160.0 -80.0 . 519 . C . 520 . N . 520 . CA . 520 . C 1 1 8 . 1 1 12 ASP C 1 1 13 LEU N 1 1 13 LEU CA 1 1 13 LEU C -160.0 -80.0 . 520 . C . 521 . N . 521 . CA . 521 . C 1 1 9 . 1 1 14 THR C 1 1 15 ALA N 1 1 15 ALA CA 1 1 15 ALA C -160.0 -80.0 . 522 . C . 523 . N . 523 . CA . 523 . C 1 1 10 . 1 1 22 ASN C 1 1 23 ILE N 1 1 23 ILE CA 1 1 23 ILE C -160.0 -80.0 . 530 . C . 531 . N . 531 . CA . 531 . C 1 1 11 . 1 1 23 ILE C 1 1 24 TYR N 1 1 24 TYR CA 1 1 24 TYR C -160.0 -80.0 . 531 . C . 532 . N . 532 . CA . 532 . C 1 1 12 . 1 1 24 TYR C 1 1 25 LEU N 1 1 25 LEU CA 1 1 25 LEU C -160.0 -80.0 . 532 . C . 533 . N . 533 . CA . 533 . C 1 1 13 . 1 1 25 LEU C 1 1 26 VAL N 1 1 26 VAL CA 1 1 26 VAL C -160.0 -80.0 . 533 . C . 534 . N . 534 . CA . 534 . C 1 1 14 . 1 1 27 GLY C 1 1 28 SER N 1 1 28 SER CA 1 1 28 SER C -160.0 -80.0 . 535 . C . 536 . N . 536 . CA . 536 . C 1 1 15 . 1 1 28 SER C 1 1 29 ILE N 1 1 29 ILE CA 1 1 29 ILE C -160.0 -80.0 . 536 . C . 537 . N . 537 . CA . 537 . C 1 1 16 . 1 1 29 ILE C 1 1 30 SER N 1 1 30 SER CA 1 1 30 SER C -89.99999 -40.0 . 537 . C . 538 . N . 538 . CA . 538 . C 1 1 17 . 1 1 30 SER C 1 1 31 GLN N 1 1 31 GLN CA 1 1 31 GLN C -89.99999 -40.0 . 538 . C . 539 . N . 539 . CA . 539 . C 1 1 18 . 1 1 34 ASP C 1 1 35 TRP N 1 1 35 TRP CA 1 1 35 TRP C -170.0 -70.0 . 542 . C . 543 . N . 543 . CA . 543 . C 1 1 19 . 1 1 36 GLU C 1 1 37 THR N 1 1 37 THR CA 1 1 37 THR C -89.99999 -40.0 . 544 . C . 545 . N . 545 . CA . 545 . C 1 1 20 . 1 1 37 THR C 1 1 38 SER N 1 1 38 SER CA 1 1 38 SER C -89.99999 -40.0 . 545 . C . 546 . N . 546 . CA . 546 . C 1 1 21 . 1 1 38 SER C 1 1 39 ASP N 1 1 39 ASP CA 1 1 39 ASP C -160.0 -80.0 . 546 . C . 547 . N . 547 . CA . 547 . C 1 1 22 . 1 1 39 ASP C 1 1 40 GLY N 1 1 40 GLY CA 1 1 40 GLY C -89.99999 -40.0 . 547 . C . 548 . N . 548 . CA . 548 . C 1 1 23 . 1 1 40 GLY C 1 1 41 ILE N 1 1 41 ILE CA 1 1 41 ILE C -160.0 -80.0 . 548 . C . 549 . N . 549 . CA . 549 . C 1 1 24 . 1 1 41 ILE C 1 1 42 ALA N 1 1 42 ALA CA 1 1 42 ALA C -89.99999 -40.0 . 549 . C . 550 . N . 550 . CA . 550 . C 1 1 25 . 1 1 43 LEU C 1 1 44 SER N 1 1 44 SER CA 1 1 44 SER C -160.0 -80.0 . 551 . C . 552 . N . 552 . CA . 552 . C 1 1 26 . 1 1 44 SER C 1 1 45 ALA N 1 1 45 ALA CA 1 1 45 ALA C -160.0 -80.0 . 552 . C . 553 . N . 553 . CA . 553 . C 1 1 27 . 1 1 45 ALA C 1 1 46 ASP N 1 1 46 ASP CA 1 1 46 ASP C -89.99999 -40.0 . 553 . C . 554 . N . 554 . CA . 554 . C 1 1 28 . 1 1 48 TYR C 1 1 49 THR N 1 1 49 THR CA 1 1 49 THR C -160.0 -80.0 . 556 . C . 557 . N . 557 . CA . 557 . C 1 1 29 . 1 1 49 THR C 1 1 50 SER N 1 1 50 SER CA 1 1 50 SER C -89.99999 -40.0 . 557 . C . 558 . N . 558 . CA . 558 . C 1 1 30 . 1 1 50 SER C 1 1 51 SER N 1 1 51 SER CA 1 1 51 SER C -160.0 -80.0 . 558 . C . 559 . N . 559 . CA . 559 . C 1 1 31 . 1 1 55 TRP C 1 1 56 TYR N 1 1 56 TYR CA 1 1 56 TYR C -160.0 -80.0 . 563 . C . 564 . N . 564 . CA . 564 . C 1 1 32 . 1 1 57 VAL C 1 1 58 THR N 1 1 58 THR CA 1 1 58 THR C -160.0 -80.0 . 565 . C . 566 . N . 566 . CA . 566 . C 1 1 33 . 1 1 58 THR C 1 1 59 VAL N 1 1 59 VAL CA 1 1 59 VAL C -160.0 -80.0 . 566 . C . 567 . N . 567 . CA . 567 . C 1 1 34 . 1 1 60 THR C 1 1 61 LEU N 1 1 61 LEU CA 1 1 61 LEU C -160.0 -80.0 . 568 . C . 569 . N . 569 . CA . 569 . C 1 1 35 . 1 1 62 PRO C 1 1 63 ALA N 1 1 63 ALA CA 1 1 63 ALA C -160.0 -80.0 . 570 . C . 571 . N . 571 . CA . 571 . C 1 1 36 . 1 1 64 GLY C 1 1 65 GLU N 1 1 65 GLU CA 1 1 65 GLU C -160.0 -80.0 . 572 . C . 573 . N . 573 . CA . 573 . C 1 1 37 . 1 1 65 GLU C 1 1 66 SER N 1 1 66 SER CA 1 1 66 SER C -160.0 -80.0 . 573 . C . 574 . N . 574 . CA . 574 . C 1 1 38 . 1 1 66 SER C 1 1 67 PHE N 1 1 67 PHE CA 1 1 67 PHE C -160.0 -80.0 . 574 . C . 575 . N . 575 . CA . 575 . C 1 1 39 . 1 1 67 PHE C 1 1 68 GLU N 1 1 68 GLU CA 1 1 68 GLU C -160.0 -80.0 . 575 . C . 576 . N . 576 . CA . 576 . C 1 1 40 . 1 1 68 GLU C 1 1 69 TYR N 1 1 69 TYR CA 1 1 69 TYR C -160.0 -80.0 . 576 . C . 577 . N . 577 . CA . 577 . C 1 1 41 . 1 1 72 ILE C 1 1 73 ARG N 1 1 73 ARG CA 1 1 73 ARG C -160.0 -80.0 . 580 . C . 581 . N . 581 . CA . 581 . C 1 1 42 . 1 1 73 ARG C 1 1 74 ILE N 1 1 74 ILE CA 1 1 74 ILE C -160.0 -80.0 . 581 . C . 582 . N . 582 . CA . 582 . C 1 1 43 . 1 1 75 GLU C 1 1 76 SER N 1 1 76 SER CA 1 1 76 SER C -89.99999 -40.0 . 583 . C . 584 . N . 584 . CA . 584 . C 1 1 44 . 1 1 76 SER C 1 1 77 ASP N 1 1 77 ASP CA 1 1 77 ASP C -160.0 -80.0 . 584 . C . 585 . N . 585 . CA . 585 . C 1 1 45 . 1 1 78 ASP C 1 1 79 SER N 1 1 79 SER CA 1 1 79 SER C -170.0 -70.0 . 586 . C . 587 . N . 587 . CA . 587 . C 1 1 46 . 1 1 79 SER C 1 1 80 VAL N 1 1 80 VAL CA 1 1 80 VAL C -160.0 -80.0 . 587 . C . 588 . N . 588 . CA . 588 . C 1 1 47 . 1 1 80 VAL C 1 1 81 GLU N 1 1 81 GLU CA 1 1 81 GLU C -160.0 -80.0 . 588 . C . 589 . N . 589 . CA . 589 . C 1 1 48 . 1 1 84 SER C 1 1 85 ASP N 1 1 85 ASP CA 1 1 85 ASP C -89.99999 -40.0 . 592 . C . 593 . N . 593 . CA . 593 . C 1 1 49 . 1 1 87 ASN C 1 1 88 ARG N 1 1 88 ARG CA 1 1 88 ARG C -160.0 -80.0 . 595 . C . 596 . N . 596 . CA . 596 . C 1 1 50 . 1 1 88 ARG C 1 1 89 GLU N 1 1 89 GLU CA 1 1 89 GLU C -160.0 -80.0 . 596 . C . 597 . N . 597 . CA . 597 . C 1 1 51 . 1 1 90 TYR C 1 1 91 THR N 1 1 91 THR CA 1 1 91 THR C -160.0 -80.0 . 598 . C . 599 . N . 599 . CA . 599 . C 1 1 52 . 1 1 100 THR C 1 1 101 ALA N 1 1 101 ALA CA 1 1 101 ALA C -160.0 -80.0 . 608 . C . 609 . N . 609 . CA . 609 . C 1 1 53 . 1 1 101 ALA C 1 1 102 THR N 1 1 102 THR CA 1 1 102 THR C -160.0 -80.0 . 609 . C . 610 . N . 610 . CA . 610 . C 1 1 54 . 1 1 102 THR C 1 1 103 VAL N 1 1 103 VAL CA 1 1 103 VAL C -160.0 -80.0 . 610 . C . 611 . N . 611 . CA . 611 . C 1 1 55 . 1 1 103 VAL C 1 1 104 THR N 1 1 104 THR CA 1 1 104 THR C -160.0 -80.0 . 611 . C . 612 . N . 612 . CA . 612 . C 1 1 56 . 1 1 104 THR C 1 1 105 ASP N 1 1 105 ASP CA 1 1 105 ASP C -160.0 -80.0 . 612 . C . 613 . N . 613 . CA . 613 . C 1 1 57 . 1 1 105 ASP C 1 1 106 THR N 1 1 106 THR CA 1 1 106 THR C -160.0 -80.0 . 613 . C . 614 . N . 614 . CA . 614 . C 1 1 58 . 1 1 107 TRP C 1 1 108 ARG N 1 1 108 ARG CA 1 1 108 ARG C -160.0 -80.0 . 615 . C . 616 . N . 616 . CA . 616 . C 1 1 59 . 1 1 12 ASP N 1 1 12 ASP CA 1 1 12 ASP CB 1 1 12 ASP CG -89.99999 -30.0 . 520 . N . 520 . CA . 520 . CB . 520 . CG 1 1 60 . 1 1 19 TYR N 1 1 19 TYR CA 1 1 19 TYR CB 1 1 19 TYR CG 150.0 210.0 . 527 . N . 527 . CA . 527 . CB . 527 . CG 1 1 61 . 1 1 21 GLU N 1 1 21 GLU CA 1 1 21 GLU CB 1 1 21 GLU CG 30.0 89.99999 . 529 . N . 529 . CA . 529 . CB . 529 . CG 1 1 62 . 1 1 31 GLN N 1 1 31 GLN CA 1 1 31 GLN CB 1 1 31 GLN CG 150.0 210.0 . 539 . N . 539 . CA . 539 . CB . 539 . CG 1 1 63 . 1 1 36 GLU N 1 1 36 GLU CA 1 1 36 GLU CB 1 1 36 GLU CG 150.0 210.0 . 544 . N . 544 . CA . 544 . CB . 544 . CG 1 1 64 . 1 1 44 SER N 1 1 44 SER CA 1 1 44 SER CB 1 1 44 SER OG 150.0 210.0 . 552 . N . 552 . CA . 552 . CB . 552 . OG 1 1 65 . 1 1 46 ASP N 1 1 46 ASP CA 1 1 46 ASP CB 1 1 46 ASP CG 30.0 89.99999 . 554 . N . 554 . CA . 554 . CB . 554 . CG 1 1 66 . 1 1 56 TYR N 1 1 56 TYR CA 1 1 56 TYR CB 1 1 56 TYR CG 30.0 89.99999 . 564 . N . 564 . CA . 564 . CB . 564 . CG 1 1 67 . 1 1 77 ASP N 1 1 77 ASP CA 1 1 77 ASP CB 1 1 77 ASP CG 20.0 100.0 . 585 . N . 585 . CA . 585 . CB . 585 . CG 1 1 68 . 1 1 87 ASN N 1 1 87 ASN CA 1 1 87 ASN CB 1 1 87 ASN CG 30.0 89.99999 . 595 . N . 595 . CA . 595 . CB . 595 . CG 1 1 69 . 1 1 48 TYR N 1 1 48 TYR CA 1 1 48 TYR CB 1 1 48 TYR CG -100.0 -20.0 . 556 . N . 556 . CA . 556 . CB . 556 . CG 1 1 70 . 1 1 7 VAL N 1 1 7 VAL CA 1 1 7 VAL CB 1 1 7 VAL CG1 150.0 210.0 . 515 . N . 515 . CA . 515 . CB . 515 . CG1 1 1 71 . 1 1 9 VAL N 1 1 9 VAL CA 1 1 9 VAL CB 1 1 9 VAL CG1 150.0 210.0 . 517 . N . 517 . CA . 517 . CB . 517 . CG1 1 1 72 . 1 1 26 VAL N 1 1 26 VAL CA 1 1 26 VAL CB 1 1 26 VAL CG1 30.0 89.99999 . 534 . N . 534 . CA . 534 . CB . 534 . CG1 1 1 73 . 1 1 57 VAL N 1 1 57 VAL CA 1 1 57 VAL CB 1 1 57 VAL CG1 30.0 89.99999 . 565 . N . 565 . CA . 565 . CB . 565 . CG1 1 1 74 . 1 1 59 VAL N 1 1 59 VAL CA 1 1 59 VAL CB 1 1 59 VAL CG1 150.0 210.0 . 567 . N . 567 . CA . 567 . CB . 567 . CG1 1 1 75 . 1 1 80 VAL N 1 1 80 VAL CA 1 1 80 VAL CB 1 1 80 VAL CG1 150.0 210.0 . 588 . N . 588 . CA . 588 . CB . 588 . CG1 1 1 76 . 1 1 92 VAL N 1 1 92 VAL CA 1 1 92 VAL CB 1 1 92 VAL CG1 150.0 210.0 . 600 . N . 600 . CA . 600 . CB . 600 . CG1 1 1 77 . 1 1 103 VAL N 1 1 103 VAL CA 1 1 103 VAL CB 1 1 103 VAL CG1 150.0 210.0 . 611 . N . 611 . CA . 611 . CB . 611 . CG1 1 1 78 . 1 1 5 THR N 1 1 5 THR CA 1 1 5 THR CB 1 1 5 THR OG1 30.0 89.99999 . 513 . N . 513 . CA . 513 . CB . 513 . OG1 1 1 79 . 1 1 17 THR N 1 1 17 THR CA 1 1 17 THR CB 1 1 17 THR OG1 150.0 210.0 . 525 . N . 525 . CA . 525 . CB . 525 . OG1 1 1 80 . 1 1 18 THR N 1 1 18 THR CA 1 1 18 THR CB 1 1 18 THR OG1 150.0 210.0 . 526 . N . 526 . CA . 526 . CB . 526 . OG1 1 1 81 . 1 1 37 THR N 1 1 37 THR CA 1 1 37 THR CB 1 1 37 THR OG1 30.0 89.99999 . 545 . N . 545 . CA . 545 . CB . 545 . OG1 1 1 82 . 1 1 37 THR N 1 1 37 THR CA 1 1 37 THR CB 1 1 37 THR OG1 20.0 100.0 . 545 . N . 545 . CA . 545 . CB . 545 . OG1 1 1 83 . 1 1 58 THR N 1 1 58 THR CA 1 1 58 THR CB 1 1 58 THR OG1 -89.99999 89.99999 . 566 . N . 566 . CA . 566 . CB . 566 . OG1 1 1 84 . 1 1 60 THR N 1 1 60 THR CA 1 1 60 THR CB 1 1 60 THR OG1 30.0 89.99999 . 568 . N . 568 . CA . 568 . CB . 568 . OG1 1 1 85 . 1 1 100 THR N 1 1 100 THR CA 1 1 100 THR CB 1 1 100 THR OG1 30.0 89.99999 . 608 . N . 608 . CA . 608 . CB . 608 . OG1 1 1 86 . 1 1 102 THR N 1 1 102 THR CA 1 1 102 THR CB 1 1 102 THR OG1 30.0 89.99999 . 610 . N . 610 . CA . 610 . CB . 610 . OG1 1 1 87 . 1 1 104 THR N 1 1 104 THR CA 1 1 104 THR CB 1 1 104 THR OG1 30.0 89.99999 . 612 . N . 612 . CA . 612 . CB . 612 . OG1 1 1 88 . 1 1 11 PHE N 1 1 11 PHE CA 1 1 11 PHE CB 1 1 11 PHE CG -89.99999 -30.0 . 519 . N . 519 . CA . 519 . CB . 519 . CG 1 1 89 . 1 1 13 LEU N 1 1 13 LEU CA 1 1 13 LEU CB 1 1 13 LEU CG 150.0 210.0 . 521 . N . 521 . CA . 521 . CB . 521 . CG 1 1 90 . 1 1 14 THR N 1 1 14 THR CA 1 1 14 THR CB 1 1 14 THR OG1 -100.0 -20.0 . 522 . N . 522 . CA . 522 . CB . 522 . OG1 1 1 91 . 1 1 16 THR N 1 1 16 THR CA 1 1 16 THR CB 1 1 16 THR OG1 150.0 210.0 . 524 . N . 524 . CA . 524 . CB . 524 . OG1 1 1 92 . 1 1 22 ASN N 1 1 22 ASN CA 1 1 22 ASN CB 1 1 22 ASN CG 150.0 210.0 . 530 . N . 530 . CA . 530 . CB . 530 . CG 1 1 93 . 1 1 34 ASP N 1 1 34 ASP CA 1 1 34 ASP CB 1 1 34 ASP CG 150.0 210.0 . 542 . N . 542 . CA . 542 . CB . 542 . CG 1 1 94 . 1 1 39 ASP N 1 1 39 ASP CA 1 1 39 ASP CB 1 1 39 ASP CG -89.99999 -30.0 . 547 . N . 547 . CA . 547 . CB . 547 . CG 1 1 95 . 1 1 43 LEU N 1 1 43 LEU CA 1 1 43 LEU CB 1 1 43 LEU CG -89.99999 -30.0 . 551 . N . 551 . CA . 551 . CB . 551 . CG 1 1 96 . 1 1 49 THR N 1 1 49 THR CA 1 1 49 THR CB 1 1 49 THR OG1 -89.99999 -30.0 . 557 . N . 557 . CA . 557 . CB . 557 . OG1 1 1 97 . 1 1 55 TRP N 1 1 55 TRP CA 1 1 55 TRP CB 1 1 55 TRP CG -89.99999 -30.0 . 563 . N . 563 . CA . 563 . CB . 563 . CG 1 1 98 . 1 1 61 LEU N 1 1 61 LEU CA 1 1 61 LEU CB 1 1 61 LEU CG 140.0 220.0 . 569 . N . 569 . CA . 569 . CB . 569 . CG 1 1 99 . 1 1 67 PHE N 1 1 67 PHE CA 1 1 67 PHE CB 1 1 67 PHE CG -89.99999 -30.0 . 575 . N . 575 . CA . 575 . CB . 575 . CG 1 1 100 . 1 1 68 GLU N 1 1 68 GLU CA 1 1 68 GLU CB 1 1 68 GLU CG -100.0 -20.0 . 576 . N . 576 . CA . 576 . CB . 576 . CG 1 1 101 . 1 1 69 TYR N 1 1 69 TYR CA 1 1 69 TYR CB 1 1 69 TYR CG -89.99999 -30.0 . 577 . N . 577 . CA . 577 . CB . 577 . CG 1 1 102 . 1 1 71 PHE N 1 1 71 PHE CA 1 1 71 PHE CB 1 1 71 PHE CG 150.0 210.0 . 579 . N . 579 . CA . 579 . CB . 579 . CG 1 1 103 . 1 1 73 ARG N 1 1 73 ARG CA 1 1 73 ARG CB 1 1 73 ARG CG 150.0 210.0 . 581 . N . 581 . CA . 581 . CB . 581 . CG 1 1 104 . 1 1 75 GLU N 1 1 75 GLU CA 1 1 75 GLU CB 1 1 75 GLU CG 150.0 210.0 . 583 . N . 583 . CA . 583 . CB . 583 . CG 1 1 105 . 1 1 82 TRP N 1 1 82 TRP CA 1 1 82 TRP CB 1 1 82 TRP CG -89.99999 -30.0 . 590 . N . 590 . CA . 590 . CB . 590 . CG 1 1 106 . 1 1 83 GLU N 1 1 83 GLU CA 1 1 83 GLU CB 1 1 83 GLU CG 140.0 220.0 . 591 . N . 591 . CA . 591 . CB . 591 . CG 1 1 107 . 1 1 84 SER N 1 1 84 SER CA 1 1 84 SER CB 1 1 84 SER OG 150.0 210.0 . 592 . N . 592 . CA . 592 . CB . 592 . OG 1 1 108 . 1 1 89 GLU N 1 1 89 GLU CA 1 1 89 GLU CB 1 1 89 GLU CG 30.0 89.99999 . 597 . N . 597 . CA . 597 . CB . 597 . CG 1 1 109 . 1 1 90 TYR N 1 1 90 TYR CA 1 1 90 TYR CB 1 1 90 TYR CG 150.0 210.0 . 598 . N . 598 . CA . 598 . CB . 598 . CG 1 1 110 . 1 1 105 ASP N 1 1 105 ASP CA 1 1 105 ASP CB 1 1 105 ASP CG -100.0 -20.0 . 613 . N . 613 . CA . 613 . CB . 613 . CG 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 CYS C C -0.515 19.549 7.485 1.00 . A A . 509 CYS C 1 1 1 2 1 1 1 CYS CA C -0.717 20.353 6.199 1.00 . A A . 509 CYS CA 1 1 1 3 1 1 1 CYS CB C 0.644 20.715 5.602 1.00 . A A . 509 CYS CB 1 1 1 4 1 1 1 CYS H1 H -1.538 21.719 7.539 1.00 . A A . 509 CYS H1 1 1 1 5 1 1 1 CYS H2 H -0.976 22.417 6.100 1.00 . A A . 509 CYS H2 1 1 1 6 1 1 1 CYS H3 H -2.428 21.536 6.104 1.00 . A A . 509 CYS H3 1 1 1 7 1 1 1 CYS HA H -1.276 19.761 5.489 1.00 . A A . 509 CYS HA 1 1 1 8 1 1 1 CYS HB2 H 1.223 21.261 6.332 1.00 . A A . 509 CYS HB2 1 1 1 9 1 1 1 CYS HB3 H 1.170 19.812 5.330 1.00 . A A . 509 CYS HB3 1 1 1 10 1 1 1 CYS N N -1.472 21.600 6.509 1.00 . A A . 509 CYS N 1 1 1 11 1 1 1 CYS O O -1.181 19.770 8.477 1.00 . A A . 509 CYS O 1 1 1 12 1 1 1 CYS SG S 0.407 21.743 4.129 1.00 . A A . 509 CYS SG 1 1 1 13 1 1 2 THR C C 2.133 17.529 8.860 1.00 . A A . 510 THR C 1 1 1 14 1 1 2 THR CA C 0.635 17.800 8.703 1.00 . A A . 510 THR CA 1 1 1 15 1 1 2 THR CB C -0.116 16.472 8.589 1.00 . A A . 510 THR CB 1 1 1 16 1 1 2 THR CG2 C -0.494 15.975 9.985 1.00 . A A . 510 THR CG2 1 1 1 17 1 1 2 THR H H 0.925 18.449 6.669 1.00 . A A . 510 THR H 1 1 1 18 1 1 2 THR HA H 0.277 18.341 9.567 1.00 . A A . 510 THR HA 1 1 1 19 1 1 2 THR HB H 0.515 15.739 8.110 1.00 . A A . 510 THR HB 1 1 1 20 1 1 2 THR HG1 H -1.809 15.852 7.859 1.00 . A A . 510 THR HG1 1 1 1 21 1 1 2 THR HG21 H -0.922 16.788 10.553 1.00 . A A . 510 THR HG21 1 1 1 22 1 1 2 THR HG22 H -1.214 15.175 9.901 1.00 . A A . 510 THR HG22 1 1 1 23 1 1 2 THR HG23 H 0.391 15.612 10.488 1.00 . A A . 510 THR HG23 1 1 1 24 1 1 2 THR N N 0.398 18.615 7.478 1.00 . A A . 510 THR N 1 1 1 25 1 1 2 THR O O 2.748 17.947 9.821 1.00 . A A . 510 THR O 1 1 1 26 1 1 2 THR OG1 O -1.294 16.662 7.817 1.00 . A A . 510 THR OG1 1 1 1 27 1 1 3 THR C C 4.641 15.641 6.886 1.00 . A A . 511 THR C 1 1 1 28 1 1 3 THR CA C 4.188 16.547 8.039 1.00 . A A . 511 THR CA 1 1 1 29 1 1 3 THR CB C 4.474 15.853 9.374 1.00 . A A . 511 THR CB 1 1 1 30 1 1 3 THR CG2 C 5.344 16.759 10.246 1.00 . A A . 511 THR CG2 1 1 1 31 1 1 3 THR H H 2.220 16.508 7.156 1.00 . A A . 511 THR H 1 1 1 32 1 1 3 THR HA H 4.738 17.476 7.997 1.00 . A A . 511 THR HA 1 1 1 33 1 1 3 THR HB H 4.997 14.926 9.194 1.00 . A A . 511 THR HB 1 1 1 34 1 1 3 THR HG1 H 3.452 15.117 10.856 1.00 . A A . 511 THR HG1 1 1 1 35 1 1 3 THR HG21 H 5.369 17.751 9.822 1.00 . A A . 511 THR HG21 1 1 1 36 1 1 3 THR HG22 H 4.930 16.805 11.244 1.00 . A A . 511 THR HG22 1 1 1 37 1 1 3 THR HG23 H 6.347 16.360 10.291 1.00 . A A . 511 THR HG23 1 1 1 38 1 1 3 THR N N 2.729 16.835 7.927 1.00 . A A . 511 THR N 1 1 1 39 1 1 3 THR O O 5.562 15.975 6.168 1.00 . A A . 511 THR O 1 1 1 40 1 1 3 THR OG1 O 3.250 15.584 10.042 1.00 . A A . 511 THR OG1 1 1 1 41 1 1 4 PRO C C 3.784 13.991 4.335 1.00 . A A . 512 PRO C 1 1 1 42 1 1 4 PRO CA C 4.311 13.531 5.699 1.00 . A A . 512 PRO CA 1 1 1 43 1 1 4 PRO CB C 3.595 12.260 6.164 1.00 . A A . 512 PRO CB 1 1 1 44 1 1 4 PRO CD C 2.865 14.118 7.627 1.00 . A A . 512 PRO CD 1 1 1 45 1 1 4 PRO CG C 2.468 12.719 7.120 1.00 . A A . 512 PRO CG 1 1 1 46 1 1 4 PRO HA H 5.373 13.357 5.657 1.00 . A A . 512 PRO HA 1 1 1 47 1 1 4 PRO HB2 H 3.177 11.739 5.313 1.00 . A A . 512 PRO HB2 1 1 1 48 1 1 4 PRO HB3 H 4.282 11.619 6.693 1.00 . A A . 512 PRO HB3 1 1 1 49 1 1 4 PRO HD2 H 2.036 14.804 7.523 1.00 . A A . 512 PRO HD2 1 1 1 50 1 1 4 PRO HD3 H 3.192 14.069 8.653 1.00 . A A . 512 PRO HD3 1 1 1 51 1 1 4 PRO HG2 H 1.529 12.768 6.587 1.00 . A A . 512 PRO HG2 1 1 1 52 1 1 4 PRO HG3 H 2.389 12.038 7.953 1.00 . A A . 512 PRO HG3 1 1 1 53 1 1 4 PRO N N 3.987 14.514 6.750 1.00 . A A . 512 PRO N 1 1 1 54 1 1 4 PRO O O 2.854 14.768 4.244 1.00 . A A . 512 PRO O 1 1 1 55 1 1 5 THR C C 3.723 12.671 1.045 1.00 . A A . 513 THR C 1 1 1 56 1 1 5 THR CA C 3.920 13.918 1.913 1.00 . A A . 513 THR CA 1 1 1 57 1 1 5 THR CB C 4.973 14.825 1.270 1.00 . A A . 513 THR CB 1 1 1 58 1 1 5 THR CG2 C 5.351 15.941 2.245 1.00 . A A . 513 THR CG2 1 1 1 59 1 1 5 THR H H 5.126 12.890 3.372 1.00 . A A . 513 THR H 1 1 1 60 1 1 5 THR HA H 2.985 14.454 1.991 1.00 . A A . 513 THR HA 1 1 1 61 1 1 5 THR HB H 4.571 15.261 0.369 1.00 . A A . 513 THR HB 1 1 1 62 1 1 5 THR HG1 H 6.871 14.423 1.434 1.00 . A A . 513 THR HG1 1 1 1 63 1 1 5 THR HG21 H 5.030 15.674 3.241 1.00 . A A . 513 THR HG21 1 1 1 64 1 1 5 THR HG22 H 6.422 16.078 2.237 1.00 . A A . 513 THR HG22 1 1 1 65 1 1 5 THR HG23 H 4.868 16.860 1.945 1.00 . A A . 513 THR HG23 1 1 1 66 1 1 5 THR N N 4.377 13.514 3.273 1.00 . A A . 513 THR N 1 1 1 67 1 1 5 THR O O 4.118 12.633 -0.106 1.00 . A A . 513 THR O 1 1 1 68 1 1 5 THR OG1 O 6.126 14.056 0.952 1.00 . A A . 513 THR OG1 1 1 1 69 1 1 6 ALA C C 1.639 10.581 -0.072 1.00 . A A . 514 ALA C 1 1 1 70 1 1 6 ALA CA C 2.884 10.407 0.798 1.00 . A A . 514 ALA CA 1 1 1 71 1 1 6 ALA CB C 2.677 9.227 1.750 1.00 . A A . 514 ALA CB 1 1 1 72 1 1 6 ALA H H 2.801 11.705 2.516 1.00 . A A . 514 ALA H 1 1 1 73 1 1 6 ALA HA H 3.739 10.216 0.170 1.00 . A A . 514 ALA HA 1 1 1 74 1 1 6 ALA HB1 H 2.643 9.587 2.768 1.00 . A A . 514 ALA HB1 1 1 1 75 1 1 6 ALA HB2 H 1.747 8.731 1.512 1.00 . A A . 514 ALA HB2 1 1 1 76 1 1 6 ALA HB3 H 3.494 8.529 1.642 1.00 . A A . 514 ALA HB3 1 1 1 77 1 1 6 ALA N N 3.112 11.651 1.588 1.00 . A A . 514 ALA N 1 1 1 78 1 1 6 ALA O O 0.631 11.093 0.371 1.00 . A A . 514 ALA O 1 1 1 79 1 1 7 VAL C C -0.223 8.974 -2.308 1.00 . A A . 515 VAL C 1 1 1 80 1 1 7 VAL CA C 0.505 10.304 -2.187 1.00 . A A . 515 VAL CA 1 1 1 81 1 1 7 VAL CB C 0.920 10.753 -3.574 1.00 . A A . 515 VAL CB 1 1 1 82 1 1 7 VAL CG1 C -0.348 10.960 -4.419 1.00 . A A . 515 VAL CG1 1 1 1 83 1 1 7 VAL CG2 C 1.709 12.056 -3.448 1.00 . A A . 515 VAL CG2 1 1 1 84 1 1 7 VAL H H 2.514 9.744 -1.648 1.00 . A A . 515 VAL H 1 1 1 85 1 1 7 VAL HA H -0.156 11.043 -1.775 1.00 . A A . 515 VAL HA 1 1 1 86 1 1 7 VAL HB H 1.536 10.000 -4.033 1.00 . A A . 515 VAL HB 1 1 1 87 1 1 7 VAL HG11 H -1.035 10.135 -4.255 1.00 . A A . 515 VAL HG11 1 1 1 88 1 1 7 VAL HG12 H -0.832 11.880 -4.131 1.00 . A A . 515 VAL HG12 1 1 1 89 1 1 7 VAL HG13 H -0.082 11.000 -5.465 1.00 . A A . 515 VAL HG13 1 1 1 90 1 1 7 VAL HG21 H 2.497 11.930 -2.720 1.00 . A A . 515 VAL HG21 1 1 1 91 1 1 7 VAL HG22 H 2.140 12.312 -4.404 1.00 . A A . 515 VAL HG22 1 1 1 92 1 1 7 VAL HG23 H 1.047 12.846 -3.125 1.00 . A A . 515 VAL HG23 1 1 1 93 1 1 7 VAL N N 1.695 10.158 -1.306 1.00 . A A . 515 VAL N 1 1 1 94 1 1 7 VAL O O 0.084 8.170 -3.164 1.00 . A A . 515 VAL O 1 1 1 95 1 1 8 ALA C C -2.893 7.587 -2.787 1.00 . A A . 516 ALA C 1 1 1 96 1 1 8 ALA CA C -1.946 7.460 -1.603 1.00 . A A . 516 ALA CA 1 1 1 97 1 1 8 ALA CB C -2.749 7.199 -0.326 1.00 . A A . 516 ALA CB 1 1 1 98 1 1 8 ALA H H -1.459 9.403 -0.814 1.00 . A A . 516 ALA H 1 1 1 99 1 1 8 ALA HA H -1.255 6.653 -1.773 1.00 . A A . 516 ALA HA 1 1 1 100 1 1 8 ALA HB1 H -2.101 7.295 0.533 1.00 . A A . 516 ALA HB1 1 1 1 101 1 1 8 ALA HB2 H -3.553 7.915 -0.253 1.00 . A A . 516 ALA HB2 1 1 1 102 1 1 8 ALA HB3 H -3.159 6.198 -0.358 1.00 . A A . 516 ALA HB3 1 1 1 103 1 1 8 ALA N N -1.204 8.738 -1.487 1.00 . A A . 516 ALA N 1 1 1 104 1 1 8 ALA O O -3.843 8.346 -2.757 1.00 . A A . 516 ALA O 1 1 1 105 1 1 9 VAL C C -4.249 5.687 -5.212 1.00 . A A . 517 VAL C 1 1 1 106 1 1 9 VAL CA C -3.551 7.031 -5.005 1.00 . A A . 517 VAL CA 1 1 1 107 1 1 9 VAL CB C -2.772 7.372 -6.276 1.00 . A A . 517 VAL CB 1 1 1 108 1 1 9 VAL CG1 C -3.525 8.455 -7.035 1.00 . A A . 517 VAL CG1 1 1 1 109 1 1 9 VAL CG2 C -1.357 7.846 -5.977 1.00 . A A . 517 VAL CG2 1 1 1 110 1 1 9 VAL H H -1.865 6.288 -3.894 1.00 . A A . 517 VAL H 1 1 1 111 1 1 9 VAL HA H -4.284 7.798 -4.803 1.00 . A A . 517 VAL HA 1 1 1 112 1 1 9 VAL HB H -2.724 6.487 -6.896 1.00 . A A . 517 VAL HB 1 1 1 113 1 1 9 VAL HG11 H -4.523 8.116 -7.260 1.00 . A A . 517 VAL HG11 1 1 1 114 1 1 9 VAL HG12 H -3.577 9.345 -6.415 1.00 . A A . 517 VAL HG12 1 1 1 115 1 1 9 VAL HG13 H -2.993 8.682 -7.952 1.00 . A A . 517 VAL HG13 1 1 1 116 1 1 9 VAL HG21 H -0.894 7.177 -5.267 1.00 . A A . 517 VAL HG21 1 1 1 117 1 1 9 VAL HG22 H -0.790 7.842 -6.904 1.00 . A A . 517 VAL HG22 1 1 1 118 1 1 9 VAL HG23 H -1.386 8.846 -5.574 1.00 . A A . 517 VAL HG23 1 1 1 119 1 1 9 VAL N N -2.642 6.883 -3.852 1.00 . A A . 517 VAL N 1 1 1 120 1 1 9 VAL O O -3.629 4.641 -5.142 1.00 . A A . 517 VAL O 1 1 1 121 1 1 10 THR C C -6.344 4.169 -7.185 1.00 . A A . 518 THR C 1 1 1 122 1 1 10 THR CA C -6.236 4.413 -5.685 1.00 . A A . 518 THR CA 1 1 1 123 1 1 10 THR CB C -7.637 4.489 -5.072 1.00 . A A . 518 THR CB 1 1 1 124 1 1 10 THR CG2 C -7.655 3.736 -3.741 1.00 . A A . 518 THR CG2 1 1 1 125 1 1 10 THR H H -6.006 6.542 -5.523 1.00 . A A . 518 THR H 1 1 1 126 1 1 10 THR HA H -5.680 3.606 -5.230 1.00 . A A . 518 THR HA 1 1 1 127 1 1 10 THR HB H -8.350 4.039 -5.745 1.00 . A A . 518 THR HB 1 1 1 128 1 1 10 THR HG1 H -8.784 5.871 -4.324 1.00 . A A . 518 THR HG1 1 1 1 129 1 1 10 THR HG21 H -6.708 3.871 -3.240 1.00 . A A . 518 THR HG21 1 1 1 130 1 1 10 THR HG22 H -8.450 4.121 -3.120 1.00 . A A . 518 THR HG22 1 1 1 131 1 1 10 THR HG23 H -7.819 2.684 -3.925 1.00 . A A . 518 THR HG23 1 1 1 132 1 1 10 THR N N -5.522 5.696 -5.468 1.00 . A A . 518 THR N 1 1 1 133 1 1 10 THR O O -6.892 4.968 -7.915 1.00 . A A . 518 THR O 1 1 1 134 1 1 10 THR OG1 O -7.983 5.850 -4.853 1.00 . A A . 518 THR OG1 1 1 1 135 1 1 11 PHE C C -6.847 1.587 -9.311 1.00 . A A . 519 PHE C 1 1 1 136 1 1 11 PHE CA C -5.919 2.777 -9.102 1.00 . A A . 519 PHE CA 1 1 1 137 1 1 11 PHE CB C -4.538 2.437 -9.695 1.00 . A A . 519 PHE CB 1 1 1 138 1 1 11 PHE CD1 C -3.141 2.873 -7.618 1.00 . A A . 519 PHE CD1 1 1 1 139 1 1 11 PHE CD2 C -2.666 4.113 -9.644 1.00 . A A . 519 PHE CD2 1 1 1 140 1 1 11 PHE CE1 C -2.106 3.554 -6.965 1.00 . A A . 519 PHE CE1 1 1 1 141 1 1 11 PHE CE2 C -1.635 4.790 -8.990 1.00 . A A . 519 PHE CE2 1 1 1 142 1 1 11 PHE CG C -3.424 3.156 -8.963 1.00 . A A . 519 PHE CG 1 1 1 143 1 1 11 PHE CZ C -1.358 4.512 -7.653 1.00 . A A . 519 PHE CZ 1 1 1 144 1 1 11 PHE H H -5.415 2.433 -7.044 1.00 . A A . 519 PHE H 1 1 1 145 1 1 11 PHE HA H -6.325 3.637 -9.612 1.00 . A A . 519 PHE HA 1 1 1 146 1 1 11 PHE HB2 H -4.377 1.379 -9.639 1.00 . A A . 519 PHE HB2 1 1 1 147 1 1 11 PHE HB3 H -4.523 2.736 -10.733 1.00 . A A . 519 PHE HB3 1 1 1 148 1 1 11 PHE HD1 H -3.712 2.134 -7.086 1.00 . A A . 519 PHE HD1 1 1 1 149 1 1 11 PHE HD2 H -2.877 4.322 -10.681 1.00 . A A . 519 PHE HD2 1 1 1 150 1 1 11 PHE HE1 H -1.885 3.340 -5.930 1.00 . A A . 519 PHE HE1 1 1 1 151 1 1 11 PHE HE2 H -1.056 5.535 -9.516 1.00 . A A . 519 PHE HE2 1 1 1 152 1 1 11 PHE HZ H -0.567 5.036 -7.151 1.00 . A A . 519 PHE HZ 1 1 1 153 1 1 11 PHE N N -5.834 3.068 -7.650 1.00 . A A . 519 PHE N 1 1 1 154 1 1 11 PHE O O -6.947 0.700 -8.481 1.00 . A A . 519 PHE O 1 1 1 155 1 1 12 ASP C C -8.255 0.036 -12.165 1.00 . A A . 520 ASP C 1 1 1 156 1 1 12 ASP CA C -8.438 0.436 -10.704 1.00 . A A . 520 ASP CA 1 1 1 157 1 1 12 ASP CB C -9.876 0.886 -10.463 1.00 . A A . 520 ASP CB 1 1 1 158 1 1 12 ASP CG C -10.272 0.587 -9.016 1.00 . A A . 520 ASP CG 1 1 1 159 1 1 12 ASP H H -7.426 2.285 -11.070 1.00 . A A . 520 ASP H 1 1 1 160 1 1 12 ASP HA H -8.197 -0.399 -10.059 1.00 . A A . 520 ASP HA 1 1 1 161 1 1 12 ASP HB2 H -9.953 1.948 -10.646 1.00 . A A . 520 ASP HB2 1 1 1 162 1 1 12 ASP HB3 H -10.529 0.360 -11.133 1.00 . A A . 520 ASP HB3 1 1 1 163 1 1 12 ASP N N -7.523 1.561 -10.418 1.00 . A A . 520 ASP N 1 1 1 164 1 1 12 ASP O O -8.672 0.736 -13.065 1.00 . A A . 520 ASP O 1 1 1 165 1 1 12 ASP OD1 O -9.504 0.924 -8.130 1.00 . A A . 520 ASP OD1 1 1 1 166 1 1 12 ASP OD2 O -11.338 0.027 -8.818 1.00 . A A . 520 ASP OD2 1 1 1 167 1 1 13 LEU C C -8.133 -2.773 -14.118 1.00 . A A . 521 LEU C 1 1 1 168 1 1 13 LEU CA C -7.382 -1.484 -13.820 1.00 . A A . 521 LEU CA 1 1 1 169 1 1 13 LEU CB C -5.889 -1.697 -14.030 1.00 . A A . 521 LEU CB 1 1 1 170 1 1 13 LEU CD1 C -4.101 -1.624 -15.750 1.00 . A A . 521 LEU CD1 1 1 1 171 1 1 13 LEU CD2 C -6.038 -3.221 -15.986 1.00 . A A . 521 LEU CD2 1 1 1 172 1 1 13 LEU CG C -5.603 -1.826 -15.518 1.00 . A A . 521 LEU CG 1 1 1 173 1 1 13 LEU H H -7.267 -1.616 -11.675 1.00 . A A . 521 LEU H 1 1 1 174 1 1 13 LEU HA H -7.729 -0.712 -14.485 1.00 . A A . 521 LEU HA 1 1 1 175 1 1 13 LEU HB2 H -5.345 -0.855 -13.628 1.00 . A A . 521 LEU HB2 1 1 1 176 1 1 13 LEU HB3 H -5.580 -2.600 -13.526 1.00 . A A . 521 LEU HB3 1 1 1 177 1 1 13 LEU HD11 H -3.600 -1.556 -14.797 1.00 . A A . 521 LEU HD11 1 1 1 178 1 1 13 LEU HD12 H -3.700 -2.456 -16.308 1.00 . A A . 521 LEU HD12 1 1 1 179 1 1 13 LEU HD13 H -3.940 -0.709 -16.303 1.00 . A A . 521 LEU HD13 1 1 1 180 1 1 13 LEU HD21 H -5.678 -3.962 -15.288 1.00 . A A . 521 LEU HD21 1 1 1 181 1 1 13 LEU HD22 H -7.121 -3.269 -16.030 1.00 . A A . 521 LEU HD22 1 1 1 182 1 1 13 LEU HD23 H -5.629 -3.416 -16.966 1.00 . A A . 521 LEU HD23 1 1 1 183 1 1 13 LEU HG H -6.155 -1.071 -16.058 1.00 . A A . 521 LEU HG 1 1 1 184 1 1 13 LEU N N -7.613 -1.069 -12.413 1.00 . A A . 521 LEU N 1 1 1 185 1 1 13 LEU O O -7.961 -3.771 -13.453 1.00 . A A . 521 LEU O 1 1 1 186 1 1 14 THR C C -8.948 -4.902 -16.377 1.00 . A A . 522 THR C 1 1 1 187 1 1 14 THR CA C -9.741 -3.992 -15.439 1.00 . A A . 522 THR CA 1 1 1 188 1 1 14 THR CB C -11.072 -3.611 -16.089 1.00 . A A . 522 THR CB 1 1 1 189 1 1 14 THR CG2 C -11.938 -4.861 -16.257 1.00 . A A . 522 THR CG2 1 1 1 190 1 1 14 THR H H -9.102 -1.936 -15.640 1.00 . A A . 522 THR H 1 1 1 191 1 1 14 THR HA H -9.927 -4.526 -14.526 1.00 . A A . 522 THR HA 1 1 1 192 1 1 14 THR HB H -10.888 -3.173 -17.058 1.00 . A A . 522 THR HB 1 1 1 193 1 1 14 THR HG1 H -12.005 -3.120 -14.455 1.00 . A A . 522 THR HG1 1 1 1 194 1 1 14 THR HG21 H -11.303 -5.732 -16.326 1.00 . A A . 522 THR HG21 1 1 1 195 1 1 14 THR HG22 H -12.595 -4.960 -15.406 1.00 . A A . 522 THR HG22 1 1 1 196 1 1 14 THR HG23 H -12.527 -4.772 -17.158 1.00 . A A . 522 THR HG23 1 1 1 197 1 1 14 THR N N -8.972 -2.759 -15.115 1.00 . A A . 522 THR N 1 1 1 198 1 1 14 THR O O -8.773 -4.620 -17.543 1.00 . A A . 522 THR O 1 1 1 199 1 1 14 THR OG1 O -11.747 -2.672 -15.264 1.00 . A A . 522 THR OG1 1 1 1 200 1 1 15 ALA C C -8.114 -8.385 -16.303 1.00 . A A . 523 ALA C 1 1 1 201 1 1 15 ALA CA C -7.714 -6.970 -16.694 1.00 . A A . 523 ALA CA 1 1 1 202 1 1 15 ALA CB C -6.217 -6.742 -16.469 1.00 . A A . 523 ALA CB 1 1 1 203 1 1 15 ALA H H -8.662 -6.213 -14.921 1.00 . A A . 523 ALA H 1 1 1 204 1 1 15 ALA HA H -7.935 -6.831 -17.729 1.00 . A A . 523 ALA HA 1 1 1 205 1 1 15 ALA HB1 H -6.012 -5.684 -16.504 1.00 . A A . 523 ALA HB1 1 1 1 206 1 1 15 ALA HB2 H -5.935 -7.129 -15.504 1.00 . A A . 523 ALA HB2 1 1 1 207 1 1 15 ALA HB3 H -5.649 -7.243 -17.247 1.00 . A A . 523 ALA HB3 1 1 1 208 1 1 15 ALA N N -8.487 -6.007 -15.864 1.00 . A A . 523 ALA N 1 1 1 209 1 1 15 ALA O O -9.282 -8.710 -16.213 1.00 . A A . 523 ALA O 1 1 1 210 1 1 16 THR C C -6.221 -11.485 -15.608 1.00 . A A . 524 THR C 1 1 1 211 1 1 16 THR CA C -7.496 -10.649 -15.744 1.00 . A A . 524 THR CA 1 1 1 212 1 1 16 THR CB C -8.337 -11.209 -16.872 1.00 . A A . 524 THR CB 1 1 1 213 1 1 16 THR CG2 C -7.932 -10.461 -18.129 1.00 . A A . 524 THR CG2 1 1 1 214 1 1 16 THR H H -6.238 -8.958 -16.216 1.00 . A A . 524 THR H 1 1 1 215 1 1 16 THR HA H -8.059 -10.677 -14.829 1.00 . A A . 524 THR HA 1 1 1 216 1 1 16 THR HB H -9.382 -11.035 -16.673 1.00 . A A . 524 THR HB 1 1 1 217 1 1 16 THR HG1 H -8.252 -12.839 -17.930 1.00 . A A . 524 THR HG1 1 1 1 218 1 1 16 THR HG21 H -7.275 -9.643 -17.839 1.00 . A A . 524 THR HG21 1 1 1 219 1 1 16 THR HG22 H -7.412 -11.128 -18.797 1.00 . A A . 524 THR HG22 1 1 1 220 1 1 16 THR HG23 H -8.809 -10.064 -18.612 1.00 . A A . 524 THR HG23 1 1 1 221 1 1 16 THR N N -7.162 -9.238 -16.101 1.00 . A A . 524 THR N 1 1 1 222 1 1 16 THR O O -5.628 -11.885 -16.590 1.00 . A A . 524 THR O 1 1 1 223 1 1 16 THR OG1 O -8.095 -12.602 -17.013 1.00 . A A . 524 THR OG1 1 1 1 224 1 1 17 THR C C -4.920 -14.062 -14.323 1.00 . A A . 525 THR C 1 1 1 225 1 1 17 THR CA C -4.562 -12.587 -14.233 1.00 . A A . 525 THR CA 1 1 1 226 1 1 17 THR CB C -3.974 -12.342 -12.851 1.00 . A A . 525 THR CB 1 1 1 227 1 1 17 THR CG2 C -5.092 -12.422 -11.828 1.00 . A A . 525 THR CG2 1 1 1 228 1 1 17 THR H H -6.292 -11.436 -13.617 1.00 . A A . 525 THR H 1 1 1 229 1 1 17 THR HA H -3.837 -12.334 -14.992 1.00 . A A . 525 THR HA 1 1 1 230 1 1 17 THR HB H -3.523 -11.370 -12.813 1.00 . A A . 525 THR HB 1 1 1 231 1 1 17 THR HG1 H -2.459 -13.457 -13.340 1.00 . A A . 525 THR HG1 1 1 1 232 1 1 17 THR HG21 H -6.009 -12.719 -12.319 1.00 . A A . 525 THR HG21 1 1 1 233 1 1 17 THR HG22 H -4.837 -13.148 -11.070 1.00 . A A . 525 THR HG22 1 1 1 234 1 1 17 THR HG23 H -5.224 -11.458 -11.374 1.00 . A A . 525 THR HG23 1 1 1 235 1 1 17 THR N N -5.797 -11.763 -14.406 1.00 . A A . 525 THR N 1 1 1 236 1 1 17 THR O O -6.077 -14.430 -14.366 1.00 . A A . 525 THR O 1 1 1 237 1 1 17 THR OG1 O -3.003 -13.338 -12.562 1.00 . A A . 525 THR OG1 1 1 1 238 1 1 18 THR C C -3.919 -16.966 -13.002 1.00 . A A . 526 THR C 1 1 1 239 1 1 18 THR CA C -4.234 -16.363 -14.361 1.00 . A A . 526 THR CA 1 1 1 240 1 1 18 THR CB C -3.413 -17.040 -15.455 1.00 . A A . 526 THR CB 1 1 1 241 1 1 18 THR CG2 C -2.070 -16.323 -15.608 1.00 . A A . 526 THR CG2 1 1 1 242 1 1 18 THR H H -3.012 -14.605 -14.256 1.00 . A A . 526 THR H 1 1 1 243 1 1 18 THR HA H -5.291 -16.493 -14.552 1.00 . A A . 526 THR HA 1 1 1 244 1 1 18 THR HB H -3.954 -16.985 -16.383 1.00 . A A . 526 THR HB 1 1 1 245 1 1 18 THR HG1 H -3.153 -18.910 -15.926 1.00 . A A . 526 THR HG1 1 1 1 246 1 1 18 THR HG21 H -1.617 -16.196 -14.636 1.00 . A A . 526 THR HG21 1 1 1 247 1 1 18 THR HG22 H -1.416 -16.912 -16.235 1.00 . A A . 526 THR HG22 1 1 1 248 1 1 18 THR HG23 H -2.227 -15.356 -16.061 1.00 . A A . 526 THR HG23 1 1 1 249 1 1 18 THR N N -3.938 -14.916 -14.315 1.00 . A A . 526 THR N 1 1 1 250 1 1 18 THR O O -3.051 -17.800 -12.838 1.00 . A A . 526 THR O 1 1 1 251 1 1 18 THR OG1 O -3.194 -18.402 -15.113 1.00 . A A . 526 THR OG1 1 1 1 252 1 1 19 TYR C C -3.046 -17.098 -10.249 1.00 . A A . 527 TYR C 1 1 1 253 1 1 19 TYR CA C -4.527 -17.057 -10.664 1.00 . A A . 527 TYR CA 1 1 1 254 1 1 19 TYR CB C -5.109 -18.461 -10.641 1.00 . A A . 527 TYR CB 1 1 1 255 1 1 19 TYR CD1 C -7.136 -18.263 -9.209 1.00 . A A . 527 TYR CD1 1 1 1 256 1 1 19 TYR CD2 C -5.182 -19.332 -8.261 1.00 . A A . 527 TYR CD2 1 1 1 257 1 1 19 TYR CE1 C -7.836 -18.459 -8.022 1.00 . A A . 527 TYR CE1 1 1 1 258 1 1 19 TYR CE2 C -5.882 -19.532 -7.061 1.00 . A A . 527 TYR CE2 1 1 1 259 1 1 19 TYR CG C -5.816 -18.695 -9.333 1.00 . A A . 527 TYR CG 1 1 1 260 1 1 19 TYR CZ C -7.211 -19.095 -6.942 1.00 . A A . 527 TYR CZ 1 1 1 261 1 1 19 TYR H H -5.366 -15.906 -12.238 1.00 . A A . 527 TYR H 1 1 1 262 1 1 19 TYR HA H -5.081 -16.432 -9.984 1.00 . A A . 527 TYR HA 1 1 1 263 1 1 19 TYR HB2 H -5.813 -18.570 -11.454 1.00 . A A . 527 TYR HB2 1 1 1 264 1 1 19 TYR HB3 H -4.316 -19.171 -10.760 1.00 . A A . 527 TYR HB3 1 1 1 265 1 1 19 TYR HD1 H -7.614 -17.774 -10.039 1.00 . A A . 527 TYR HD1 1 1 1 266 1 1 19 TYR HD2 H -4.160 -19.668 -8.356 1.00 . A A . 527 TYR HD2 1 1 1 267 1 1 19 TYR HE1 H -8.861 -18.118 -7.942 1.00 . A A . 527 TYR HE1 1 1 1 268 1 1 19 TYR HE2 H -5.398 -20.022 -6.230 1.00 . A A . 527 TYR HE2 1 1 1 269 1 1 19 TYR HH H -8.691 -18.747 -5.787 1.00 . A A . 527 TYR HH 1 1 1 270 1 1 19 TYR N N -4.668 -16.549 -12.041 1.00 . A A . 527 TYR N 1 1 1 271 1 1 19 TYR O O -2.575 -18.099 -9.746 1.00 . A A . 527 TYR O 1 1 1 272 1 1 19 TYR OH O -7.901 -19.292 -5.764 1.00 . A A . 527 TYR OH 1 1 1 273 1 1 20 GLY C C -0.004 -14.986 -10.669 1.00 . A A . 528 GLY C 1 1 1 274 1 1 20 GLY CA C -0.871 -16.065 -9.988 1.00 . A A . 528 GLY CA 1 1 1 275 1 1 20 GLY H H -2.684 -15.208 -10.810 1.00 . A A . 528 GLY H 1 1 1 276 1 1 20 GLY HA2 H -0.828 -15.920 -8.919 1.00 . A A . 528 GLY HA2 1 1 1 277 1 1 20 GLY HA3 H -0.465 -17.038 -10.223 1.00 . A A . 528 GLY HA3 1 1 1 278 1 1 20 GLY N N -2.303 -16.023 -10.423 1.00 . A A . 528 GLY N 1 1 1 279 1 1 20 GLY O O 1.096 -15.266 -11.098 1.00 . A A . 528 GLY O 1 1 1 280 1 1 21 GLU C C -0.019 -11.306 -10.905 1.00 . A A . 529 GLU C 1 1 1 281 1 1 21 GLU CA C 0.424 -12.702 -11.375 1.00 . A A . 529 GLU CA 1 1 1 282 1 1 21 GLU CB C 0.361 -12.810 -12.903 1.00 . A A . 529 GLU CB 1 1 1 283 1 1 21 GLU CD C -1.136 -12.424 -14.858 1.00 . A A . 529 GLU CD 1 1 1 284 1 1 21 GLU CG C -0.752 -11.928 -13.460 1.00 . A A . 529 GLU CG 1 1 1 285 1 1 21 GLU H H -1.322 -13.517 -10.374 1.00 . A A . 529 GLU H 1 1 1 286 1 1 21 GLU HA H 1.444 -12.864 -11.056 1.00 . A A . 529 GLU HA 1 1 1 287 1 1 21 GLU HB2 H 1.304 -12.493 -13.319 1.00 . A A . 529 GLU HB2 1 1 1 288 1 1 21 GLU HB3 H 0.175 -13.837 -13.182 1.00 . A A . 529 GLU HB3 1 1 1 289 1 1 21 GLU HG2 H -1.610 -11.971 -12.807 1.00 . A A . 529 GLU HG2 1 1 1 290 1 1 21 GLU HG3 H -0.404 -10.909 -13.527 1.00 . A A . 529 GLU HG3 1 1 1 291 1 1 21 GLU N N -0.446 -13.754 -10.746 1.00 . A A . 529 GLU N 1 1 1 292 1 1 21 GLU O O -0.922 -11.181 -10.101 1.00 . A A . 529 GLU O 1 1 1 293 1 1 21 GLU OE1 O -1.245 -13.627 -15.029 1.00 . A A . 529 GLU OE1 1 1 1 294 1 1 21 GLU OE2 O -1.313 -11.593 -15.733 1.00 . A A . 529 GLU OE2 1 1 1 295 1 1 22 ASN C C 0.275 -7.864 -12.024 1.00 . A A . 530 ASN C 1 1 1 296 1 1 22 ASN CA C 0.212 -8.885 -10.890 1.00 . A A . 530 ASN CA 1 1 1 297 1 1 22 ASN CB C 1.141 -8.453 -9.755 1.00 . A A . 530 ASN CB 1 1 1 298 1 1 22 ASN CG C 0.367 -7.570 -8.777 1.00 . A A . 530 ASN CG 1 1 1 299 1 1 22 ASN H H 1.366 -10.357 -12.009 1.00 . A A . 530 ASN H 1 1 1 300 1 1 22 ASN HA H -0.796 -8.915 -10.526 1.00 . A A . 530 ASN HA 1 1 1 301 1 1 22 ASN HB2 H 1.509 -9.329 -9.238 1.00 . A A . 530 ASN HB2 1 1 1 302 1 1 22 ASN HB3 H 1.972 -7.897 -10.160 1.00 . A A . 530 ASN HB3 1 1 1 303 1 1 22 ASN HD21 H -0.214 -6.281 -10.169 1.00 . A A . 530 ASN HD21 1 1 1 304 1 1 22 ASN HD22 H -0.754 -5.948 -8.597 1.00 . A A . 530 ASN HD22 1 1 1 305 1 1 22 ASN N N 0.618 -10.251 -11.370 1.00 . A A . 530 ASN N 1 1 1 306 1 1 22 ASN ND2 N -0.250 -6.510 -9.218 1.00 . A A . 530 ASN ND2 1 1 1 307 1 1 22 ASN O O 1.189 -7.839 -12.791 1.00 . A A . 530 ASN O 1 1 1 308 1 1 22 ASN OD1 O 0.322 -7.849 -7.595 1.00 . A A . 530 ASN OD1 1 1 1 309 1 1 23 ILE C C -0.111 -4.729 -12.611 1.00 . A A . 531 ILE C 1 1 1 310 1 1 23 ILE CA C -0.752 -5.974 -13.179 1.00 . A A . 531 ILE CA 1 1 1 311 1 1 23 ILE CB C -2.214 -5.744 -13.593 1.00 . A A . 531 ILE CB 1 1 1 312 1 1 23 ILE CD1 C -3.529 -5.655 -15.681 1.00 . A A . 531 ILE CD1 1 1 1 313 1 1 23 ILE CG1 C -2.314 -5.086 -14.963 1.00 . A A . 531 ILE CG1 1 1 1 314 1 1 23 ILE CG2 C -2.923 -4.873 -12.566 1.00 . A A . 531 ILE CG2 1 1 1 315 1 1 23 ILE H H -1.439 -7.068 -11.461 1.00 . A A . 531 ILE H 1 1 1 316 1 1 23 ILE HA H -0.163 -6.294 -14.021 1.00 . A A . 531 ILE HA 1 1 1 317 1 1 23 ILE HB H -2.708 -6.699 -13.637 1.00 . A A . 531 ILE HB 1 1 1 318 1 1 23 ILE HD11 H -4.335 -5.831 -14.959 1.00 . A A . 531 ILE HD11 1 1 1 319 1 1 23 ILE HD12 H -3.859 -4.948 -16.436 1.00 . A A . 531 ILE HD12 1 1 1 320 1 1 23 ILE HD13 H -3.247 -6.586 -16.148 1.00 . A A . 531 ILE HD13 1 1 1 321 1 1 23 ILE HG12 H -2.438 -4.024 -14.849 1.00 . A A . 531 ILE HG12 1 1 1 322 1 1 23 ILE HG13 H -1.425 -5.295 -15.537 1.00 . A A . 531 ILE HG13 1 1 1 323 1 1 23 ILE HG21 H -2.856 -5.338 -11.594 1.00 . A A . 531 ILE HG21 1 1 1 324 1 1 23 ILE HG22 H -2.461 -3.902 -12.533 1.00 . A A . 531 ILE HG22 1 1 1 325 1 1 23 ILE HG23 H -3.960 -4.766 -12.845 1.00 . A A . 531 ILE HG23 1 1 1 326 1 1 23 ILE N N -0.715 -7.019 -12.111 1.00 . A A . 531 ILE N 1 1 1 327 1 1 23 ILE O O -0.554 -4.156 -11.642 1.00 . A A . 531 ILE O 1 1 1 328 1 1 24 TYR C C 1.474 -1.887 -13.005 1.00 . A A . 532 TYR C 1 1 1 329 1 1 24 TYR CA C 1.797 -3.292 -12.582 1.00 . A A . 532 TYR CA 1 1 1 330 1 1 24 TYR CB C 3.259 -3.526 -12.861 1.00 . A A . 532 TYR CB 1 1 1 331 1 1 24 TYR CD1 C 3.945 -5.034 -10.987 1.00 . A A . 532 TYR CD1 1 1 1 332 1 1 24 TYR CD2 C 4.393 -2.666 -10.755 1.00 . A A . 532 TYR CD2 1 1 1 333 1 1 24 TYR CE1 C 4.538 -5.281 -9.752 1.00 . A A . 532 TYR CE1 1 1 1 334 1 1 24 TYR CE2 C 4.992 -2.908 -9.509 1.00 . A A . 532 TYR CE2 1 1 1 335 1 1 24 TYR CG C 3.871 -3.735 -11.490 1.00 . A A . 532 TYR CG 1 1 1 336 1 1 24 TYR CZ C 5.064 -4.218 -9.007 1.00 . A A . 532 TYR CZ 1 1 1 337 1 1 24 TYR H H 0.591 -4.832 -13.541 1.00 . A A . 532 TYR H 1 1 1 338 1 1 24 TYR HA H 1.425 -3.674 -11.695 1.00 . A A . 532 TYR HA 1 1 1 339 1 1 24 TYR HB2 H 3.367 -4.401 -13.444 1.00 . A A . 532 TYR HB2 1 1 1 340 1 1 24 TYR HB3 H 3.661 -2.674 -13.319 1.00 . A A . 532 TYR HB3 1 1 1 341 1 1 24 TYR HD1 H 3.538 -5.848 -11.560 1.00 . A A . 532 TYR HD1 1 1 1 342 1 1 24 TYR HD2 H 4.337 -1.660 -11.144 1.00 . A A . 532 TYR HD2 1 1 1 343 1 1 24 TYR HE1 H 4.588 -6.295 -9.376 1.00 . A A . 532 TYR HE1 1 1 1 344 1 1 24 TYR HE2 H 5.397 -2.088 -8.937 1.00 . A A . 532 TYR HE2 1 1 1 345 1 1 24 TYR HH H 5.418 -5.348 -7.510 1.00 . A A . 532 TYR HH 1 1 1 346 1 1 24 TYR N N 1.011 -4.396 -13.144 1.00 . A A . 532 TYR N 1 1 1 347 1 1 24 TYR O O 1.010 -1.604 -14.075 1.00 . A A . 532 TYR O 1 1 1 348 1 1 24 TYR OH O 5.654 -4.458 -7.783 1.00 . A A . 532 TYR OH 1 1 1 349 1 1 25 LEU C C 2.978 1.153 -12.113 1.00 . A A . 533 LEU C 1 1 1 350 1 1 25 LEU CA C 1.652 0.441 -12.397 1.00 . A A . 533 LEU CA 1 1 1 351 1 1 25 LEU CB C 0.541 1.019 -11.522 1.00 . A A . 533 LEU CB 1 1 1 352 1 1 25 LEU CD1 C -1.822 1.619 -12.065 1.00 . A A . 533 LEU CD1 1 1 1 353 1 1 25 LEU CD2 C -0.057 3.387 -12.039 1.00 . A A . 533 LEU CD2 1 1 1 354 1 1 25 LEU CG C -0.355 1.923 -12.370 1.00 . A A . 533 LEU CG 1 1 1 355 1 1 25 LEU H H 2.256 -1.272 -11.292 1.00 . A A . 533 LEU H 1 1 1 356 1 1 25 LEU HA H 1.404 0.549 -13.421 1.00 . A A . 533 LEU HA 1 1 1 357 1 1 25 LEU HB2 H -0.047 0.214 -11.106 1.00 . A A . 533 LEU HB2 1 1 1 358 1 1 25 LEU HB3 H 0.978 1.597 -10.726 1.00 . A A . 533 LEU HB3 1 1 1 359 1 1 25 LEU HD11 H -1.934 1.397 -11.014 1.00 . A A . 533 LEU HD11 1 1 1 360 1 1 25 LEU HD12 H -2.428 2.478 -12.319 1.00 . A A . 533 LEU HD12 1 1 1 361 1 1 25 LEU HD13 H -2.142 0.768 -12.649 1.00 . A A . 533 LEU HD13 1 1 1 362 1 1 25 LEU HD21 H 1.006 3.514 -11.894 1.00 . A A . 533 LEU HD21 1 1 1 363 1 1 25 LEU HD22 H -0.388 4.014 -12.854 1.00 . A A . 533 LEU HD22 1 1 1 364 1 1 25 LEU HD23 H -0.580 3.665 -11.135 1.00 . A A . 533 LEU HD23 1 1 1 365 1 1 25 LEU HG H -0.159 1.742 -13.416 1.00 . A A . 533 LEU HG 1 1 1 366 1 1 25 LEU N N 1.826 -0.988 -12.125 1.00 . A A . 533 LEU N 1 1 1 367 1 1 25 LEU O O 3.134 1.844 -11.133 1.00 . A A . 533 LEU O 1 1 1 368 1 1 26 VAL C C 5.237 3.056 -13.227 1.00 . A A . 534 VAL C 1 1 1 369 1 1 26 VAL CA C 5.284 1.579 -12.784 1.00 . A A . 534 VAL CA 1 1 1 370 1 1 26 VAL CB C 6.294 0.746 -13.612 1.00 . A A . 534 VAL CB 1 1 1 371 1 1 26 VAL CG1 C 6.282 1.130 -15.066 1.00 . A A . 534 VAL CG1 1 1 1 372 1 1 26 VAL CG2 C 7.724 0.935 -13.177 1.00 . A A . 534 VAL CG2 1 1 1 373 1 1 26 VAL H H 3.774 0.372 -13.733 1.00 . A A . 534 VAL H 1 1 1 374 1 1 26 VAL HA H 5.556 1.534 -11.741 1.00 . A A . 534 VAL HA 1 1 1 375 1 1 26 VAL HB H 6.039 -0.288 -13.514 1.00 . A A . 534 VAL HB 1 1 1 376 1 1 26 VAL HG11 H 5.283 1.078 -15.455 1.00 . A A . 534 VAL HG11 1 1 1 377 1 1 26 VAL HG12 H 6.677 2.132 -15.173 1.00 . A A . 534 VAL HG12 1 1 1 378 1 1 26 VAL HG13 H 6.928 0.441 -15.590 1.00 . A A . 534 VAL HG13 1 1 1 379 1 1 26 VAL HG21 H 7.780 1.701 -12.434 1.00 . A A . 534 VAL HG21 1 1 1 380 1 1 26 VAL HG22 H 8.106 0.010 -12.786 1.00 . A A . 534 VAL HG22 1 1 1 381 1 1 26 VAL HG23 H 8.304 1.225 -14.062 1.00 . A A . 534 VAL HG23 1 1 1 382 1 1 26 VAL N N 3.936 0.955 -12.968 1.00 . A A . 534 VAL N 1 1 1 383 1 1 26 VAL O O 5.044 3.367 -14.382 1.00 . A A . 534 VAL O 1 1 1 384 1 1 27 GLY C C 6.819 5.975 -12.585 1.00 . A A . 535 GLY C 1 1 1 385 1 1 27 GLY CA C 5.388 5.438 -12.617 1.00 . A A . 535 GLY CA 1 1 1 386 1 1 27 GLY H H 5.569 3.673 -11.373 1.00 . A A . 535 GLY H 1 1 1 387 1 1 27 GLY HA2 H 4.974 5.579 -13.605 1.00 . A A . 535 GLY HA2 1 1 1 388 1 1 27 GLY HA3 H 4.792 5.964 -11.898 1.00 . A A . 535 GLY HA3 1 1 1 389 1 1 27 GLY N N 5.415 3.964 -12.292 1.00 . A A . 535 GLY N 1 1 1 390 1 1 27 GLY O O 7.680 5.359 -12.017 1.00 . A A . 535 GLY O 1 1 1 391 1 1 28 SER C C 8.970 8.241 -11.993 1.00 . A A . 536 SER C 1 1 1 392 1 1 28 SER CA C 8.534 7.570 -13.283 1.00 . A A . 536 SER CA 1 1 1 393 1 1 28 SER CB C 8.720 8.579 -14.415 1.00 . A A . 536 SER CB 1 1 1 394 1 1 28 SER H H 6.408 7.546 -13.716 1.00 . A A . 536 SER H 1 1 1 395 1 1 28 SER HA H 9.212 6.723 -13.480 1.00 . A A . 536 SER HA 1 1 1 396 1 1 28 SER HB2 H 8.560 8.097 -15.364 1.00 . A A . 536 SER HB2 1 1 1 397 1 1 28 SER HB3 H 8.015 9.385 -14.299 1.00 . A A . 536 SER HB3 1 1 1 398 1 1 28 SER HG H 10.006 10.035 -14.524 1.00 . A A . 536 SER HG 1 1 1 399 1 1 28 SER N N 7.106 7.078 -13.231 1.00 . A A . 536 SER N 1 1 1 400 1 1 28 SER O O 9.477 9.340 -12.023 1.00 . A A . 536 SER O 1 1 1 401 1 1 28 SER OG O 10.046 9.088 -14.371 1.00 . A A . 536 SER OG 1 1 1 402 1 1 29 ILE C C 9.984 7.051 -8.823 1.00 . A A . 537 ILE C 1 1 1 403 1 1 29 ILE CA C 9.339 8.168 -9.629 1.00 . A A . 537 ILE CA 1 1 1 404 1 1 29 ILE CB C 8.244 8.890 -8.859 1.00 . A A . 537 ILE CB 1 1 1 405 1 1 29 ILE CD1 C 9.802 10.267 -7.470 1.00 . A A . 537 ILE CD1 1 1 1 406 1 1 29 ILE CG1 C 8.714 9.191 -7.433 1.00 . A A . 537 ILE CG1 1 1 1 407 1 1 29 ILE CG2 C 6.999 8.032 -8.813 1.00 . A A . 537 ILE CG2 1 1 1 408 1 1 29 ILE H H 8.441 6.707 -10.857 1.00 . A A . 537 ILE H 1 1 1 409 1 1 29 ILE HA H 10.101 8.847 -9.892 1.00 . A A . 537 ILE HA 1 1 1 410 1 1 29 ILE HB H 8.016 9.813 -9.364 1.00 . A A . 537 ILE HB 1 1 1 411 1 1 29 ILE HD11 H 10.283 10.260 -8.437 1.00 . A A . 537 ILE HD11 1 1 1 412 1 1 29 ILE HD12 H 9.356 11.235 -7.297 1.00 . A A . 537 ILE HD12 1 1 1 413 1 1 29 ILE HD13 H 10.534 10.065 -6.703 1.00 . A A . 537 ILE HD13 1 1 1 414 1 1 29 ILE HG12 H 7.879 9.546 -6.848 1.00 . A A . 537 ILE HG12 1 1 1 415 1 1 29 ILE HG13 H 9.112 8.294 -6.986 1.00 . A A . 537 ILE HG13 1 1 1 416 1 1 29 ILE HG21 H 6.842 7.573 -9.777 1.00 . A A . 537 ILE HG21 1 1 1 417 1 1 29 ILE HG22 H 7.121 7.268 -8.062 1.00 . A A . 537 ILE HG22 1 1 1 418 1 1 29 ILE HG23 H 6.151 8.653 -8.567 1.00 . A A . 537 ILE HG23 1 1 1 419 1 1 29 ILE N N 8.833 7.586 -10.874 1.00 . A A . 537 ILE N 1 1 1 420 1 1 29 ILE O O 9.806 5.896 -9.108 1.00 . A A . 537 ILE O 1 1 1 421 1 1 30 SER C C 10.480 5.355 -6.446 1.00 . A A . 538 SER C 1 1 1 422 1 1 30 SER CA C 11.490 6.290 -7.114 1.00 . A A . 538 SER CA 1 1 1 423 1 1 30 SER CB C 12.409 6.903 -6.057 1.00 . A A . 538 SER CB 1 1 1 424 1 1 30 SER H H 10.970 8.323 -7.688 1.00 . A A . 538 SER H 1 1 1 425 1 1 30 SER HA H 12.076 5.708 -7.815 1.00 . A A . 538 SER HA 1 1 1 426 1 1 30 SER HB2 H 11.914 7.734 -5.584 1.00 . A A . 538 SER HB2 1 1 1 427 1 1 30 SER HB3 H 12.646 6.156 -5.311 1.00 . A A . 538 SER HB3 1 1 1 428 1 1 30 SER HG H 13.766 8.259 -6.383 1.00 . A A . 538 SER HG 1 1 1 429 1 1 30 SER N N 10.790 7.375 -7.872 1.00 . A A . 538 SER N 1 1 1 430 1 1 30 SER O O 10.604 4.149 -6.518 1.00 . A A . 538 SER O 1 1 1 431 1 1 30 SER OG O 13.601 7.362 -6.681 1.00 . A A . 538 SER OG 1 1 1 432 1 1 31 GLN C C 7.687 4.385 -6.366 1.00 . A A . 539 GLN C 1 1 1 433 1 1 31 GLN CA C 8.447 5.006 -5.210 1.00 . A A . 539 GLN CA 1 1 1 434 1 1 31 GLN CB C 7.500 5.831 -4.334 1.00 . A A . 539 GLN CB 1 1 1 435 1 1 31 GLN CD C 6.336 3.705 -3.712 1.00 . A A . 539 GLN CD 1 1 1 436 1 1 31 GLN CG C 6.997 4.973 -3.170 1.00 . A A . 539 GLN CG 1 1 1 437 1 1 31 GLN H H 9.361 6.847 -5.818 1.00 . A A . 539 GLN H 1 1 1 438 1 1 31 GLN HA H 8.928 4.235 -4.624 1.00 . A A . 539 GLN HA 1 1 1 439 1 1 31 GLN HB2 H 8.026 6.692 -3.947 1.00 . A A . 539 GLN HB2 1 1 1 440 1 1 31 GLN HB3 H 6.659 6.160 -4.925 1.00 . A A . 539 GLN HB3 1 1 1 441 1 1 31 GLN HE21 H 4.896 4.689 -4.661 1.00 . A A . 539 GLN HE21 1 1 1 442 1 1 31 GLN HE22 H 4.837 2.999 -4.806 1.00 . A A . 539 GLN HE22 1 1 1 443 1 1 31 GLN HG2 H 7.830 4.703 -2.537 1.00 . A A . 539 GLN HG2 1 1 1 444 1 1 31 GLN HG3 H 6.275 5.534 -2.595 1.00 . A A . 539 GLN HG3 1 1 1 445 1 1 31 GLN N N 9.468 5.886 -5.833 1.00 . A A . 539 GLN N 1 1 1 446 1 1 31 GLN NE2 N 5.268 3.806 -4.455 1.00 . A A . 539 GLN NE2 1 1 1 447 1 1 31 GLN O O 6.995 3.395 -6.239 1.00 . A A . 539 GLN O 1 1 1 448 1 1 31 GLN OE1 O 6.797 2.610 -3.457 1.00 . A A . 539 GLN OE1 1 1 1 449 1 1 32 LEU C C 8.272 4.429 -9.826 1.00 . A A . 540 LEU C 1 1 1 450 1 1 32 LEU CA C 7.209 4.487 -8.741 1.00 . A A . 540 LEU CA 1 1 1 451 1 1 32 LEU CB C 6.092 5.451 -9.144 1.00 . A A . 540 LEU CB 1 1 1 452 1 1 32 LEU CD1 C 4.166 4.592 -7.817 1.00 . A A . 540 LEU CD1 1 1 1 453 1 1 32 LEU CD2 C 3.812 5.532 -10.111 1.00 . A A . 540 LEU CD2 1 1 1 454 1 1 32 LEU CG C 4.758 4.719 -9.223 1.00 . A A . 540 LEU CG 1 1 1 455 1 1 32 LEU H H 8.435 5.766 -7.560 1.00 . A A . 540 LEU H 1 1 1 456 1 1 32 LEU HA H 6.820 3.525 -8.579 1.00 . A A . 540 LEU HA 1 1 1 457 1 1 32 LEU HB2 H 6.014 6.229 -8.404 1.00 . A A . 540 LEU HB2 1 1 1 458 1 1 32 LEU HB3 H 6.319 5.886 -10.104 1.00 . A A . 540 LEU HB3 1 1 1 459 1 1 32 LEU HD11 H 4.747 5.188 -7.128 1.00 . A A . 540 LEU HD11 1 1 1 460 1 1 32 LEU HD12 H 3.145 4.943 -7.821 1.00 . A A . 540 LEU HD12 1 1 1 461 1 1 32 LEU HD13 H 4.191 3.557 -7.508 1.00 . A A . 540 LEU HD13 1 1 1 462 1 1 32 LEU HD21 H 4.314 6.437 -10.436 1.00 . A A . 540 LEU HD21 1 1 1 463 1 1 32 LEU HD22 H 3.539 4.946 -10.977 1.00 . A A . 540 LEU HD22 1 1 1 464 1 1 32 LEU HD23 H 2.925 5.792 -9.553 1.00 . A A . 540 LEU HD23 1 1 1 465 1 1 32 LEU HG H 4.904 3.737 -9.644 1.00 . A A . 540 LEU HG 1 1 1 466 1 1 32 LEU N N 7.854 4.981 -7.510 1.00 . A A . 540 LEU N 1 1 1 467 1 1 32 LEU O O 8.170 5.079 -10.817 1.00 . A A . 540 LEU O 1 1 1 468 1 1 33 GLY C C 9.870 3.856 -12.054 1.00 . A A . 541 GLY C 1 1 1 469 1 1 33 GLY CA C 10.418 3.623 -10.639 1.00 . A A . 541 GLY CA 1 1 1 470 1 1 33 GLY H H 9.387 3.172 -8.788 1.00 . A A . 541 GLY H 1 1 1 471 1 1 33 GLY HA2 H 11.151 4.383 -10.411 1.00 . A A . 541 GLY HA2 1 1 1 472 1 1 33 GLY HA3 H 10.890 2.652 -10.598 1.00 . A A . 541 GLY HA3 1 1 1 473 1 1 33 GLY N N 9.315 3.680 -9.621 1.00 . A A . 541 GLY N 1 1 1 474 1 1 33 GLY O O 10.482 4.509 -12.877 1.00 . A A . 541 GLY O 1 1 1 475 1 1 34 ASP C C 8.873 2.750 -14.728 1.00 . A A . 542 ASP C 1 1 1 476 1 1 34 ASP CA C 8.066 3.452 -13.681 1.00 . A A . 542 ASP CA 1 1 1 477 1 1 34 ASP CB C 8.019 4.885 -14.149 1.00 . A A . 542 ASP CB 1 1 1 478 1 1 34 ASP CG C 6.875 5.045 -15.155 1.00 . A A . 542 ASP CG 1 1 1 479 1 1 34 ASP H H 8.275 2.810 -11.609 1.00 . A A . 542 ASP H 1 1 1 480 1 1 34 ASP HA H 7.074 3.047 -13.654 1.00 . A A . 542 ASP HA 1 1 1 481 1 1 34 ASP HB2 H 7.869 5.525 -13.315 1.00 . A A . 542 ASP HB2 1 1 1 482 1 1 34 ASP HB3 H 8.949 5.132 -14.623 1.00 . A A . 542 ASP HB3 1 1 1 483 1 1 34 ASP N N 8.720 3.316 -12.320 1.00 . A A . 542 ASP N 1 1 1 484 1 1 34 ASP O O 8.409 2.489 -15.803 1.00 . A A . 542 ASP O 1 1 1 485 1 1 34 ASP OD1 O 6.633 4.108 -15.896 1.00 . A A . 542 ASP OD1 1 1 1 486 1 1 34 ASP OD2 O 6.262 6.099 -15.171 1.00 . A A . 542 ASP OD2 1 1 1 487 1 1 35 TRP C C 11.686 0.739 -14.728 1.00 . A A . 543 TRP C 1 1 1 488 1 1 35 TRP CA C 10.980 1.900 -15.413 1.00 . A A . 543 TRP CA 1 1 1 489 1 1 35 TRP CB C 11.893 3.025 -15.844 1.00 . A A . 543 TRP CB 1 1 1 490 1 1 35 TRP CD1 C 11.250 5.456 -15.305 1.00 . A A . 543 TRP CD1 1 1 1 491 1 1 35 TRP CD2 C 9.782 4.464 -16.684 1.00 . A A . 543 TRP CD2 1 1 1 492 1 1 35 TRP CE2 C 9.332 5.792 -16.494 1.00 . A A . 543 TRP CE2 1 1 1 493 1 1 35 TRP CE3 C 9.016 3.624 -17.507 1.00 . A A . 543 TRP CE3 1 1 1 494 1 1 35 TRP CG C 11.031 4.276 -15.942 1.00 . A A . 543 TRP CG 1 1 1 495 1 1 35 TRP CH2 C 7.419 5.418 -17.911 1.00 . A A . 543 TRP CH2 1 1 1 496 1 1 35 TRP CZ2 C 8.168 6.268 -17.097 1.00 . A A . 543 TRP CZ2 1 1 1 497 1 1 35 TRP CZ3 C 7.841 4.096 -18.114 1.00 . A A . 543 TRP CZ3 1 1 1 498 1 1 35 TRP H H 10.422 2.764 -13.572 1.00 . A A . 543 TRP H 1 1 1 499 1 1 35 TRP HA H 10.415 1.542 -16.260 1.00 . A A . 543 TRP HA 1 1 1 500 1 1 35 TRP HB2 H 12.676 3.162 -15.114 1.00 . A A . 543 TRP HB2 1 1 1 501 1 1 35 TRP HB3 H 12.316 2.796 -16.807 1.00 . A A . 543 TRP HB3 1 1 1 502 1 1 35 TRP HD1 H 12.059 5.676 -14.651 1.00 . A A . 543 TRP HD1 1 1 1 503 1 1 35 TRP HE1 H 10.214 7.279 -15.349 1.00 . A A . 543 TRP HE1 1 1 1 504 1 1 35 TRP HE3 H 9.314 2.595 -17.645 1.00 . A A . 543 TRP HE3 1 1 1 505 1 1 35 TRP HH2 H 6.515 5.777 -18.378 1.00 . A A . 543 TRP HH2 1 1 1 506 1 1 35 TRP HZ2 H 7.839 7.282 -16.921 1.00 . A A . 543 TRP HZ2 1 1 1 507 1 1 35 TRP HZ3 H 7.261 3.437 -18.742 1.00 . A A . 543 TRP HZ3 1 1 1 508 1 1 35 TRP N N 10.083 2.507 -14.435 1.00 . A A . 543 TRP N 1 1 1 509 1 1 35 TRP NE1 N 10.264 6.353 -15.656 1.00 . A A . 543 TRP NE1 1 1 1 510 1 1 35 TRP O O 12.783 0.332 -15.053 1.00 . A A . 543 TRP O 1 1 1 511 1 1 36 GLU C C 10.135 -1.338 -12.226 1.00 . A A . 544 GLU C 1 1 1 512 1 1 36 GLU CA C 11.385 -0.958 -12.984 1.00 . A A . 544 GLU CA 1 1 1 513 1 1 36 GLU CB C 12.495 -0.588 -12.003 1.00 . A A . 544 GLU CB 1 1 1 514 1 1 36 GLU CD C 14.400 -1.479 -10.655 1.00 . A A . 544 GLU CD 1 1 1 515 1 1 36 GLU CG C 13.194 -1.858 -11.517 1.00 . A A . 544 GLU CG 1 1 1 516 1 1 36 GLU H H 10.087 0.585 -13.615 1.00 . A A . 544 GLU H 1 1 1 517 1 1 36 GLU HA H 11.685 -1.769 -13.624 1.00 . A A . 544 GLU HA 1 1 1 518 1 1 36 GLU HB2 H 13.207 0.048 -12.494 1.00 . A A . 544 GLU HB2 1 1 1 519 1 1 36 GLU HB3 H 12.069 -0.070 -11.159 1.00 . A A . 544 GLU HB3 1 1 1 520 1 1 36 GLU HG2 H 12.503 -2.448 -10.932 1.00 . A A . 544 GLU HG2 1 1 1 521 1 1 36 GLU HG3 H 13.528 -2.431 -12.366 1.00 . A A . 544 GLU HG3 1 1 1 522 1 1 36 GLU N N 10.970 0.206 -13.787 1.00 . A A . 544 GLU N 1 1 1 523 1 1 36 GLU O O 9.922 -0.907 -11.113 1.00 . A A . 544 GLU O 1 1 1 524 1 1 36 GLU OE1 O 14.556 -0.302 -10.373 1.00 . A A . 544 GLU OE1 1 1 1 525 1 1 36 GLU OE2 O 15.147 -2.373 -10.290 1.00 . A A . 544 GLU OE2 1 1 1 526 1 1 37 THR C C 8.266 -2.886 -10.748 1.00 . A A . 545 THR C 1 1 1 527 1 1 37 THR CA C 7.991 -2.424 -12.187 1.00 . A A . 545 THR CA 1 1 1 528 1 1 37 THR CB C 7.275 -3.565 -12.934 1.00 . A A . 545 THR CB 1 1 1 529 1 1 37 THR CG2 C 7.574 -3.501 -14.432 1.00 . A A . 545 THR CG2 1 1 1 530 1 1 37 THR H H 9.440 -2.368 -13.769 1.00 . A A . 545 THR H 1 1 1 531 1 1 37 THR HA H 7.364 -1.528 -12.188 1.00 . A A . 545 THR HA 1 1 1 532 1 1 37 THR HB H 6.211 -3.480 -12.781 1.00 . A A . 545 THR HB 1 1 1 533 1 1 37 THR HG1 H 8.680 -4.770 -12.338 1.00 . A A . 545 THR HG1 1 1 1 534 1 1 37 THR HG21 H 7.565 -2.474 -14.751 1.00 . A A . 545 THR HG21 1 1 1 535 1 1 37 THR HG22 H 8.543 -3.935 -14.623 1.00 . A A . 545 THR HG22 1 1 1 536 1 1 37 THR HG23 H 6.821 -4.054 -14.980 1.00 . A A . 545 THR HG23 1 1 1 537 1 1 37 THR N N 9.268 -2.080 -12.851 1.00 . A A . 545 THR N 1 1 1 538 1 1 37 THR O O 7.364 -3.006 -9.945 1.00 . A A . 545 THR O 1 1 1 539 1 1 37 THR OG1 O 7.724 -4.811 -12.421 1.00 . A A . 545 THR OG1 1 1 1 540 1 1 38 SER C C 9.270 -2.634 -8.018 1.00 . A A . 546 SER C 1 1 1 541 1 1 38 SER CA C 9.821 -3.632 -9.039 1.00 . A A . 546 SER CA 1 1 1 542 1 1 38 SER CB C 11.337 -3.744 -8.873 1.00 . A A . 546 SER CB 1 1 1 543 1 1 38 SER H H 10.226 -3.072 -11.082 1.00 . A A . 546 SER H 1 1 1 544 1 1 38 SER HA H 9.370 -4.599 -8.875 1.00 . A A . 546 SER HA 1 1 1 545 1 1 38 SER HB2 H 11.786 -4.010 -9.816 1.00 . A A . 546 SER HB2 1 1 1 546 1 1 38 SER HB3 H 11.734 -2.793 -8.543 1.00 . A A . 546 SER HB3 1 1 1 547 1 1 38 SER HG H 12.534 -4.624 -7.615 1.00 . A A . 546 SER HG 1 1 1 548 1 1 38 SER N N 9.505 -3.164 -10.419 1.00 . A A . 546 SER N 1 1 1 549 1 1 38 SER O O 8.775 -3.009 -6.974 1.00 . A A . 546 SER O 1 1 1 550 1 1 38 SER OG O 11.631 -4.753 -7.915 1.00 . A A . 546 SER OG 1 1 1 551 1 1 39 ASP C C 7.715 0.448 -8.045 1.00 . A A . 547 ASP C 1 1 1 552 1 1 39 ASP CA C 8.833 -0.346 -7.368 1.00 . A A . 547 ASP CA 1 1 1 553 1 1 39 ASP CB C 9.968 0.602 -6.972 1.00 . A A . 547 ASP CB 1 1 1 554 1 1 39 ASP CG C 10.835 -0.059 -5.899 1.00 . A A . 547 ASP CG 1 1 1 555 1 1 39 ASP H H 9.750 -1.090 -9.159 1.00 . A A . 547 ASP H 1 1 1 556 1 1 39 ASP HA H 8.446 -0.833 -6.485 1.00 . A A . 547 ASP HA 1 1 1 557 1 1 39 ASP HB2 H 10.572 0.822 -7.840 1.00 . A A . 547 ASP HB2 1 1 1 558 1 1 39 ASP HB3 H 9.552 1.519 -6.581 1.00 . A A . 547 ASP HB3 1 1 1 559 1 1 39 ASP N N 9.351 -1.368 -8.314 1.00 . A A . 547 ASP N 1 1 1 560 1 1 39 ASP O O 7.590 1.641 -7.860 1.00 . A A . 547 ASP O 1 1 1 561 1 1 39 ASP OD1 O 11.455 -1.065 -6.203 1.00 . A A . 547 ASP OD1 1 1 1 562 1 1 39 ASP OD2 O 10.865 0.452 -4.791 1.00 . A A . 547 ASP OD2 1 1 1 563 1 1 40 GLY C C 4.559 0.439 -8.607 1.00 . A A . 548 GLY C 1 1 1 564 1 1 40 GLY CA C 5.784 0.498 -9.502 1.00 . A A . 548 GLY CA 1 1 1 565 1 1 40 GLY H H 7.008 -1.169 -8.957 1.00 . A A . 548 GLY H 1 1 1 566 1 1 40 GLY HA2 H 6.058 1.525 -9.688 1.00 . A A . 548 GLY HA2 1 1 1 567 1 1 40 GLY HA3 H 5.559 -0.003 -10.434 1.00 . A A . 548 GLY HA3 1 1 1 568 1 1 40 GLY N N 6.897 -0.208 -8.824 1.00 . A A . 548 GLY N 1 1 1 569 1 1 40 GLY O O 4.579 0.856 -7.466 1.00 . A A . 548 GLY O 1 1 1 570 1 1 41 ILE C C 1.467 -1.439 -8.799 1.00 . A A . 549 ILE C 1 1 1 571 1 1 41 ILE CA C 2.264 -0.240 -8.300 1.00 . A A . 549 ILE CA 1 1 1 572 1 1 41 ILE CB C 1.405 1.035 -8.381 1.00 . A A . 549 ILE CB 1 1 1 573 1 1 41 ILE CD1 C 1.432 3.327 -9.354 1.00 . A A . 549 ILE CD1 1 1 1 574 1 1 41 ILE CG1 C 2.279 2.257 -8.661 1.00 . A A . 549 ILE CG1 1 1 1 575 1 1 41 ILE CG2 C 0.681 1.265 -7.056 1.00 . A A . 549 ILE CG2 1 1 1 576 1 1 41 ILE H H 3.531 -0.455 -10.030 1.00 . A A . 549 ILE H 1 1 1 577 1 1 41 ILE HA H 2.551 -0.426 -7.285 1.00 . A A . 549 ILE HA 1 1 1 578 1 1 41 ILE HB H 0.675 0.924 -9.169 1.00 . A A . 549 ILE HB 1 1 1 579 1 1 41 ILE HD11 H 0.456 2.922 -9.579 1.00 . A A . 549 ILE HD11 1 1 1 580 1 1 41 ILE HD12 H 1.323 4.180 -8.702 1.00 . A A . 549 ILE HD12 1 1 1 581 1 1 41 ILE HD13 H 1.914 3.631 -10.270 1.00 . A A . 549 ILE HD13 1 1 1 582 1 1 41 ILE HG12 H 2.657 2.646 -7.727 1.00 . A A . 549 ILE HG12 1 1 1 583 1 1 41 ILE HG13 H 3.101 1.982 -9.295 1.00 . A A . 549 ILE HG13 1 1 1 584 1 1 41 ILE HG21 H 1.377 1.138 -6.241 1.00 . A A . 549 ILE HG21 1 1 1 585 1 1 41 ILE HG22 H 0.283 2.275 -7.034 1.00 . A A . 549 ILE HG22 1 1 1 586 1 1 41 ILE HG23 H -0.126 0.555 -6.956 1.00 . A A . 549 ILE HG23 1 1 1 587 1 1 41 ILE N N 3.500 -0.108 -9.115 1.00 . A A . 549 ILE N 1 1 1 588 1 1 41 ILE O O 0.753 -1.367 -9.778 1.00 . A A . 549 ILE O 1 1 1 589 1 1 42 ALA C C -0.573 -3.745 -8.102 1.00 . A A . 550 ALA C 1 1 1 590 1 1 42 ALA CA C 0.890 -3.777 -8.558 1.00 . A A . 550 ALA CA 1 1 1 591 1 1 42 ALA CB C 1.586 -4.997 -7.951 1.00 . A A . 550 ALA CB 1 1 1 592 1 1 42 ALA H H 2.205 -2.577 -7.358 1.00 . A A . 550 ALA H 1 1 1 593 1 1 42 ALA HA H 0.925 -3.853 -9.634 1.00 . A A . 550 ALA HA 1 1 1 594 1 1 42 ALA HB1 H 2.530 -4.695 -7.521 1.00 . A A . 550 ALA HB1 1 1 1 595 1 1 42 ALA HB2 H 0.959 -5.423 -7.181 1.00 . A A . 550 ALA HB2 1 1 1 596 1 1 42 ALA HB3 H 1.761 -5.732 -8.722 1.00 . A A . 550 ALA HB3 1 1 1 597 1 1 42 ALA N N 1.608 -2.549 -8.133 1.00 . A A . 550 ALA N 1 1 1 598 1 1 42 ALA O O -0.884 -3.501 -6.954 1.00 . A A . 550 ALA O 1 1 1 599 1 1 43 LEU C C -3.304 -5.556 -8.652 1.00 . A A . 551 LEU C 1 1 1 600 1 1 43 LEU CA C -2.916 -4.080 -8.699 1.00 . A A . 551 LEU CA 1 1 1 601 1 1 43 LEU CB C -3.692 -3.378 -9.823 1.00 . A A . 551 LEU CB 1 1 1 602 1 1 43 LEU CD1 C -1.861 -1.977 -10.817 1.00 . A A . 551 LEU CD1 1 1 1 603 1 1 43 LEU CD2 C -4.205 -1.131 -10.789 1.00 . A A . 551 LEU CD2 1 1 1 604 1 1 43 LEU CG C -3.165 -1.952 -10.019 1.00 . A A . 551 LEU CG 1 1 1 605 1 1 43 LEU H H -1.159 -4.251 -9.914 1.00 . A A . 551 LEU H 1 1 1 606 1 1 43 LEU HA H -3.122 -3.614 -7.742 1.00 . A A . 551 LEU HA 1 1 1 607 1 1 43 LEU HB2 H -3.568 -3.931 -10.738 1.00 . A A . 551 LEU HB2 1 1 1 608 1 1 43 LEU HB3 H -4.740 -3.341 -9.572 1.00 . A A . 551 LEU HB3 1 1 1 609 1 1 43 LEU HD11 H -1.999 -2.557 -11.714 1.00 . A A . 551 LEU HD11 1 1 1 610 1 1 43 LEU HD12 H -1.582 -0.968 -11.082 1.00 . A A . 551 LEU HD12 1 1 1 611 1 1 43 LEU HD13 H -1.080 -2.418 -10.220 1.00 . A A . 551 LEU HD13 1 1 1 612 1 1 43 LEU HD21 H -5.183 -1.301 -10.366 1.00 . A A . 551 LEU HD21 1 1 1 613 1 1 43 LEU HD22 H -3.959 -0.082 -10.720 1.00 . A A . 551 LEU HD22 1 1 1 614 1 1 43 LEU HD23 H -4.204 -1.433 -11.826 1.00 . A A . 551 LEU HD23 1 1 1 615 1 1 43 LEU HG H -2.985 -1.500 -9.059 1.00 . A A . 551 LEU HG 1 1 1 616 1 1 43 LEU N N -1.460 -4.033 -9.011 1.00 . A A . 551 LEU N 1 1 1 617 1 1 43 LEU O O -2.815 -6.343 -9.442 1.00 . A A . 551 LEU O 1 1 1 618 1 1 44 SER C C -5.914 -7.694 -7.266 1.00 . A A . 552 SER C 1 1 1 619 1 1 44 SER CA C -4.463 -7.427 -7.693 1.00 . A A . 552 SER CA 1 1 1 620 1 1 44 SER CB C -3.525 -8.113 -6.702 1.00 . A A . 552 SER CB 1 1 1 621 1 1 44 SER H H -4.515 -5.338 -7.074 1.00 . A A . 552 SER H 1 1 1 622 1 1 44 SER HA H -4.300 -7.840 -8.672 1.00 . A A . 552 SER HA 1 1 1 623 1 1 44 SER HB2 H -2.593 -7.576 -6.650 1.00 . A A . 552 SER HB2 1 1 1 624 1 1 44 SER HB3 H -3.991 -8.119 -5.728 1.00 . A A . 552 SER HB3 1 1 1 625 1 1 44 SER HG H -3.030 -9.961 -6.349 1.00 . A A . 552 SER HG 1 1 1 626 1 1 44 SER N N -4.138 -5.968 -7.734 1.00 . A A . 552 SER N 1 1 1 627 1 1 44 SER O O -6.687 -6.787 -7.027 1.00 . A A . 552 SER O 1 1 1 628 1 1 44 SER OG O -3.274 -9.447 -7.122 1.00 . A A . 552 SER OG 1 1 1 629 1 1 45 ALA C C -7.693 -9.378 -5.201 1.00 . A A . 553 ALA C 1 1 1 630 1 1 45 ALA CA C -7.655 -9.334 -6.735 1.00 . A A . 553 ALA CA 1 1 1 631 1 1 45 ALA CB C -8.041 -10.735 -7.296 1.00 . A A . 553 ALA CB 1 1 1 632 1 1 45 ALA H H -5.622 -9.659 -7.347 1.00 . A A . 553 ALA H 1 1 1 633 1 1 45 ALA HA H -8.355 -8.592 -7.093 1.00 . A A . 553 ALA HA 1 1 1 634 1 1 45 ALA HB1 H -7.163 -11.241 -7.650 1.00 . A A . 553 ALA HB1 1 1 1 635 1 1 45 ALA HB2 H -8.494 -11.325 -6.509 1.00 . A A . 553 ALA HB2 1 1 1 636 1 1 45 ALA HB3 H -8.760 -10.636 -8.116 1.00 . A A . 553 ALA HB3 1 1 1 637 1 1 45 ALA N N -6.273 -8.958 -7.159 1.00 . A A . 553 ALA N 1 1 1 638 1 1 45 ALA O O -7.996 -10.395 -4.611 1.00 . A A . 553 ALA O 1 1 1 639 1 1 46 ASP C C -8.802 -8.633 -2.567 1.00 . A A . 554 ASP C 1 1 1 640 1 1 46 ASP CA C -7.391 -8.287 -3.052 1.00 . A A . 554 ASP CA 1 1 1 641 1 1 46 ASP CB C -6.949 -6.916 -2.527 1.00 . A A . 554 ASP CB 1 1 1 642 1 1 46 ASP CG C -8.141 -5.962 -2.456 1.00 . A A . 554 ASP CG 1 1 1 643 1 1 46 ASP H H -7.128 -7.476 -5.035 1.00 . A A . 554 ASP H 1 1 1 644 1 1 46 ASP HA H -6.704 -9.043 -2.697 1.00 . A A . 554 ASP HA 1 1 1 645 1 1 46 ASP HB2 H -6.523 -7.032 -1.541 1.00 . A A . 554 ASP HB2 1 1 1 646 1 1 46 ASP HB3 H -6.204 -6.508 -3.193 1.00 . A A . 554 ASP HB3 1 1 1 647 1 1 46 ASP N N -7.377 -8.287 -4.546 1.00 . A A . 554 ASP N 1 1 1 648 1 1 46 ASP O O -9.011 -9.650 -1.934 1.00 . A A . 554 ASP O 1 1 1 649 1 1 46 ASP OD1 O -8.591 -5.533 -3.507 1.00 . A A . 554 ASP OD1 1 1 1 650 1 1 46 ASP OD2 O -8.583 -5.676 -1.355 1.00 . A A . 554 ASP OD2 1 1 1 651 1 1 47 LYS C C -11.498 -9.418 -3.323 1.00 . A A . 555 LYS C 1 1 1 652 1 1 47 LYS CA C -11.169 -8.192 -2.502 1.00 . A A . 555 LYS CA 1 1 1 653 1 1 47 LYS CB C -12.129 -7.051 -2.846 1.00 . A A . 555 LYS CB 1 1 1 654 1 1 47 LYS CD C -12.304 -4.567 -3.054 1.00 . A A . 555 LYS CD 1 1 1 655 1 1 47 LYS CE C -11.420 -3.321 -3.141 1.00 . A A . 555 LYS CE 1 1 1 656 1 1 47 LYS CG C -11.505 -5.715 -2.436 1.00 . A A . 555 LYS CG 1 1 1 657 1 1 47 LYS H H -9.622 -7.054 -3.457 1.00 . A A . 555 LYS H 1 1 1 658 1 1 47 LYS HA H -11.209 -8.423 -1.446 1.00 . A A . 555 LYS HA 1 1 1 659 1 1 47 LYS HB2 H -12.318 -7.050 -3.911 1.00 . A A . 555 LYS HB2 1 1 1 660 1 1 47 LYS HB3 H -13.059 -7.190 -2.316 1.00 . A A . 555 LYS HB3 1 1 1 661 1 1 47 LYS HD2 H -12.630 -4.849 -4.045 1.00 . A A . 555 LYS HD2 1 1 1 662 1 1 47 LYS HD3 H -13.164 -4.354 -2.438 1.00 . A A . 555 LYS HD3 1 1 1 663 1 1 47 LYS HE2 H -10.554 -3.450 -2.509 1.00 . A A . 555 LYS HE2 1 1 1 664 1 1 47 LYS HE3 H -11.102 -3.174 -4.163 1.00 . A A . 555 LYS HE3 1 1 1 665 1 1 47 LYS HG2 H -11.520 -5.626 -1.359 1.00 . A A . 555 LYS HG2 1 1 1 666 1 1 47 LYS HG3 H -10.486 -5.669 -2.786 1.00 . A A . 555 LYS HG3 1 1 1 667 1 1 47 LYS HZ1 H -12.668 -2.350 -1.786 1.00 . A A . 555 LYS HZ1 1 1 1 668 1 1 47 LYS HZ2 H -11.548 -1.330 -2.547 1.00 . A A . 555 LYS HZ2 1 1 1 669 1 1 47 LYS HZ3 H -12.906 -1.886 -3.403 1.00 . A A . 555 LYS HZ3 1 1 1 670 1 1 47 LYS N N -9.786 -7.839 -2.903 1.00 . A A . 555 LYS N 1 1 1 671 1 1 47 LYS NZ N -12.194 -2.132 -2.685 1.00 . A A . 555 LYS NZ 1 1 1 672 1 1 47 LYS O O -12.045 -10.394 -2.851 1.00 . A A . 555 LYS O 1 1 1 673 1 1 48 TYR C C -10.763 -11.763 -4.761 1.00 . A A . 556 TYR C 1 1 1 674 1 1 48 TYR CA C -11.281 -10.515 -5.465 1.00 . A A . 556 TYR CA 1 1 1 675 1 1 48 TYR CB C -10.466 -10.245 -6.731 1.00 . A A . 556 TYR CB 1 1 1 676 1 1 48 TYR CD1 C -12.531 -8.990 -7.263 1.00 . A A . 556 TYR CD1 1 1 1 677 1 1 48 TYR CD2 C -10.748 -8.960 -8.939 1.00 . A A . 556 TYR CD2 1 1 1 678 1 1 48 TYR CE1 C -13.329 -8.216 -8.093 1.00 . A A . 556 TYR CE1 1 1 1 679 1 1 48 TYR CE2 C -11.563 -8.186 -9.755 1.00 . A A . 556 TYR CE2 1 1 1 680 1 1 48 TYR CG C -11.252 -9.373 -7.666 1.00 . A A . 556 TYR CG 1 1 1 681 1 1 48 TYR CZ C -12.853 -7.816 -9.340 1.00 . A A . 556 TYR CZ 1 1 1 682 1 1 48 TYR H H -10.624 -8.574 -4.885 1.00 . A A . 556 TYR H 1 1 1 683 1 1 48 TYR HA H -12.323 -10.636 -5.708 1.00 . A A . 556 TYR HA 1 1 1 684 1 1 48 TYR HB2 H -9.566 -9.735 -6.455 1.00 . A A . 556 TYR HB2 1 1 1 685 1 1 48 TYR HB3 H -10.238 -11.180 -7.213 1.00 . A A . 556 TYR HB3 1 1 1 686 1 1 48 TYR HD1 H -12.906 -9.312 -6.301 1.00 . A A . 556 TYR HD1 1 1 1 687 1 1 48 TYR HD2 H -9.733 -9.217 -9.300 1.00 . A A . 556 TYR HD2 1 1 1 688 1 1 48 TYR HE1 H -14.313 -7.924 -7.768 1.00 . A A . 556 TYR HE1 1 1 1 689 1 1 48 TYR HE2 H -11.202 -7.893 -10.724 1.00 . A A . 556 TYR HE2 1 1 1 690 1 1 48 TYR HH H -14.356 -6.676 -9.630 1.00 . A A . 556 TYR HH 1 1 1 691 1 1 48 TYR N N -11.093 -9.371 -4.559 1.00 . A A . 556 TYR N 1 1 1 692 1 1 48 TYR O O -9.987 -11.681 -3.828 1.00 . A A . 556 TYR O 1 1 1 693 1 1 48 TYR OH O -13.651 -7.049 -10.165 1.00 . A A . 556 TYR OH 1 1 1 694 1 1 49 THR C C -9.756 -14.950 -5.348 1.00 . A A . 557 THR C 1 1 1 695 1 1 49 THR CA C -10.724 -14.151 -4.481 1.00 . A A . 557 THR CA 1 1 1 696 1 1 49 THR CB C -11.925 -15.020 -4.108 1.00 . A A . 557 THR CB 1 1 1 697 1 1 49 THR CG2 C -11.520 -16.492 -4.162 1.00 . A A . 557 THR CG2 1 1 1 698 1 1 49 THR H H -11.838 -12.959 -5.915 1.00 . A A . 557 THR H 1 1 1 699 1 1 49 THR HA H -10.211 -13.863 -3.593 1.00 . A A . 557 THR HA 1 1 1 700 1 1 49 THR HB H -12.726 -14.845 -4.809 1.00 . A A . 557 THR HB 1 1 1 701 1 1 49 THR HG1 H -13.137 -14.117 -2.881 1.00 . A A . 557 THR HG1 1 1 1 702 1 1 49 THR HG21 H -11.104 -16.705 -5.139 1.00 . A A . 557 THR HG21 1 1 1 703 1 1 49 THR HG22 H -10.779 -16.690 -3.402 1.00 . A A . 557 THR HG22 1 1 1 704 1 1 49 THR HG23 H -12.387 -17.113 -3.995 1.00 . A A . 557 THR HG23 1 1 1 705 1 1 49 THR N N -11.195 -12.913 -5.173 1.00 . A A . 557 THR N 1 1 1 706 1 1 49 THR O O -9.035 -15.801 -4.865 1.00 . A A . 557 THR O 1 1 1 707 1 1 49 THR OG1 O -12.365 -14.682 -2.799 1.00 . A A . 557 THR OG1 1 1 1 708 1 1 50 SER C C -7.400 -14.885 -7.298 1.00 . A A . 558 SER C 1 1 1 709 1 1 50 SER CA C -8.811 -15.424 -7.503 1.00 . A A . 558 SER CA 1 1 1 710 1 1 50 SER CB C -9.251 -15.209 -8.951 1.00 . A A . 558 SER CB 1 1 1 711 1 1 50 SER H H -10.309 -14.001 -6.954 1.00 . A A . 558 SER H 1 1 1 712 1 1 50 SER HA H -8.836 -16.476 -7.266 1.00 . A A . 558 SER HA 1 1 1 713 1 1 50 SER HB2 H -10.264 -15.552 -9.076 1.00 . A A . 558 SER HB2 1 1 1 714 1 1 50 SER HB3 H -9.201 -14.153 -9.186 1.00 . A A . 558 SER HB3 1 1 1 715 1 1 50 SER HG H -8.542 -15.623 -10.713 1.00 . A A . 558 SER HG 1 1 1 716 1 1 50 SER N N -9.730 -14.686 -6.603 1.00 . A A . 558 SER N 1 1 1 717 1 1 50 SER O O -6.861 -14.930 -6.209 1.00 . A A . 558 SER O 1 1 1 718 1 1 50 SER OG O -8.399 -15.942 -9.818 1.00 . A A . 558 SER OG 1 1 1 719 1 1 51 SER C C -5.467 -12.296 -8.313 1.00 . A A . 559 SER C 1 1 1 720 1 1 51 SER CA C -5.421 -13.813 -8.152 1.00 . A A . 559 SER CA 1 1 1 721 1 1 51 SER CB C -4.478 -14.418 -9.186 1.00 . A A . 559 SER CB 1 1 1 722 1 1 51 SER H H -7.245 -14.326 -9.200 1.00 . A A . 559 SER H 1 1 1 723 1 1 51 SER HA H -5.065 -14.053 -7.160 1.00 . A A . 559 SER HA 1 1 1 724 1 1 51 SER HB2 H -5.042 -14.765 -10.034 1.00 . A A . 559 SER HB2 1 1 1 725 1 1 51 SER HB3 H -3.770 -13.669 -9.511 1.00 . A A . 559 SER HB3 1 1 1 726 1 1 51 SER HG H -3.057 -15.163 -8.089 1.00 . A A . 559 SER HG 1 1 1 727 1 1 51 SER N N -6.795 -14.364 -8.324 1.00 . A A . 559 SER N 1 1 1 728 1 1 51 SER O O -5.028 -11.562 -7.452 1.00 . A A . 559 SER O 1 1 1 729 1 1 51 SER OG O -3.793 -15.512 -8.596 1.00 . A A . 559 SER OG 1 1 1 730 1 1 52 ASP C C -6.628 -10.013 -11.008 1.00 . A A . 560 ASP C 1 1 1 731 1 1 52 ASP CA C -6.065 -10.342 -9.621 1.00 . A A . 560 ASP CA 1 1 1 732 1 1 52 ASP CB C -4.658 -9.752 -9.508 1.00 . A A . 560 ASP CB 1 1 1 733 1 1 52 ASP CG C -3.610 -10.759 -9.984 1.00 . A A . 560 ASP CG 1 1 1 734 1 1 52 ASP H H -6.326 -12.430 -10.091 1.00 . A A . 560 ASP H 1 1 1 735 1 1 52 ASP HA H -6.688 -9.892 -8.871 1.00 . A A . 560 ASP HA 1 1 1 736 1 1 52 ASP HB2 H -4.596 -8.859 -10.113 1.00 . A A . 560 ASP HB2 1 1 1 737 1 1 52 ASP HB3 H -4.464 -9.503 -8.481 1.00 . A A . 560 ASP HB3 1 1 1 738 1 1 52 ASP N N -5.991 -11.819 -9.409 1.00 . A A . 560 ASP N 1 1 1 739 1 1 52 ASP O O -6.002 -9.303 -11.742 1.00 . A A . 560 ASP O 1 1 1 740 1 1 52 ASP OD1 O -3.285 -11.657 -9.221 1.00 . A A . 560 ASP OD1 1 1 1 741 1 1 52 ASP OD2 O -3.137 -10.605 -11.098 1.00 . A A . 560 ASP OD2 1 1 1 742 1 1 53 PRO C C -8.861 -8.796 -12.855 1.00 . A A . 561 PRO C 1 1 1 743 1 1 53 PRO CA C -8.388 -10.262 -12.662 1.00 . A A . 561 PRO CA 1 1 1 744 1 1 53 PRO CB C -9.488 -11.322 -12.787 1.00 . A A . 561 PRO CB 1 1 1 745 1 1 53 PRO CD C -8.600 -11.398 -10.471 1.00 . A A . 561 PRO CD 1 1 1 746 1 1 53 PRO CG C -9.784 -11.827 -11.357 1.00 . A A . 561 PRO CG 1 1 1 747 1 1 53 PRO HA H -7.644 -10.468 -13.411 1.00 . A A . 561 PRO HA 1 1 1 748 1 1 53 PRO HB2 H -10.377 -10.881 -13.219 1.00 . A A . 561 PRO HB2 1 1 1 749 1 1 53 PRO HB3 H -9.146 -12.142 -13.399 1.00 . A A . 561 PRO HB3 1 1 1 750 1 1 53 PRO HD2 H -8.955 -10.854 -9.611 1.00 . A A . 561 PRO HD2 1 1 1 751 1 1 53 PRO HD3 H -8.039 -12.259 -10.167 1.00 . A A . 561 PRO HD3 1 1 1 752 1 1 53 PRO HG2 H -10.695 -11.401 -10.994 1.00 . A A . 561 PRO HG2 1 1 1 753 1 1 53 PRO HG3 H -9.855 -12.907 -11.357 1.00 . A A . 561 PRO HG3 1 1 1 754 1 1 53 PRO N N -7.786 -10.526 -11.344 1.00 . A A . 561 PRO N 1 1 1 755 1 1 53 PRO O O -8.671 -8.248 -13.916 1.00 . A A . 561 PRO O 1 1 1 756 1 1 54 LEU C C -8.687 -5.806 -11.481 1.00 . A A . 562 LEU C 1 1 1 757 1 1 54 LEU CA C -9.755 -6.663 -12.145 1.00 . A A . 562 LEU CA 1 1 1 758 1 1 54 LEU CB C -11.157 -6.274 -11.640 1.00 . A A . 562 LEU CB 1 1 1 759 1 1 54 LEU CD1 C -9.931 -6.242 -9.391 1.00 . A A . 562 LEU CD1 1 1 1 760 1 1 54 LEU CD2 C -11.068 -4.182 -10.251 1.00 . A A . 562 LEU CD2 1 1 1 761 1 1 54 LEU CG C -11.134 -5.711 -10.199 1.00 . A A . 562 LEU CG 1 1 1 762 1 1 54 LEU H H -9.531 -8.509 -10.992 1.00 . A A . 562 LEU H 1 1 1 763 1 1 54 LEU HA H -9.708 -6.495 -13.214 1.00 . A A . 562 LEU HA 1 1 1 764 1 1 54 LEU HB2 H -11.560 -5.517 -12.298 1.00 . A A . 562 LEU HB2 1 1 1 765 1 1 54 LEU HB3 H -11.802 -7.138 -11.678 1.00 . A A . 562 LEU HB3 1 1 1 766 1 1 54 LEU HD11 H -9.493 -7.086 -9.902 1.00 . A A . 562 LEU HD11 1 1 1 767 1 1 54 LEU HD12 H -9.188 -5.459 -9.279 1.00 . A A . 562 LEU HD12 1 1 1 768 1 1 54 LEU HD13 H -10.268 -6.552 -8.413 1.00 . A A . 562 LEU HD13 1 1 1 769 1 1 54 LEU HD21 H -10.998 -3.860 -11.280 1.00 . A A . 562 LEU HD21 1 1 1 770 1 1 54 LEU HD22 H -11.959 -3.767 -9.804 1.00 . A A . 562 LEU HD22 1 1 1 771 1 1 54 LEU HD23 H -10.198 -3.841 -9.707 1.00 . A A . 562 LEU HD23 1 1 1 772 1 1 54 LEU HG H -12.052 -6.011 -9.705 1.00 . A A . 562 LEU HG 1 1 1 773 1 1 54 LEU N N -9.407 -8.111 -11.878 1.00 . A A . 562 LEU N 1 1 1 774 1 1 54 LEU O O -8.768 -4.597 -11.426 1.00 . A A . 562 LEU O 1 1 1 775 1 1 55 TRP C C -6.860 -4.377 -9.873 1.00 . A A . 563 TRP C 1 1 1 776 1 1 55 TRP CA C -6.526 -5.799 -10.336 1.00 . A A . 563 TRP CA 1 1 1 777 1 1 55 TRP CB C -5.375 -5.711 -11.330 1.00 . A A . 563 TRP CB 1 1 1 778 1 1 55 TRP CD1 C -6.498 -7.139 -13.112 1.00 . A A . 563 TRP CD1 1 1 1 779 1 1 55 TRP CD2 C -4.395 -7.767 -12.687 1.00 . A A . 563 TRP CD2 1 1 1 780 1 1 55 TRP CE2 C -4.871 -8.623 -13.707 1.00 . A A . 563 TRP CE2 1 1 1 781 1 1 55 TRP CE3 C -3.094 -7.951 -12.227 1.00 . A A . 563 TRP CE3 1 1 1 782 1 1 55 TRP CG C -5.437 -6.829 -12.331 1.00 . A A . 563 TRP CG 1 1 1 783 1 1 55 TRP CH2 C -2.768 -9.776 -13.778 1.00 . A A . 563 TRP CH2 1 1 1 784 1 1 55 TRP CZ2 C -4.066 -9.618 -14.248 1.00 . A A . 563 TRP CZ2 1 1 1 785 1 1 55 TRP CZ3 C -2.285 -8.952 -12.771 1.00 . A A . 563 TRP CZ3 1 1 1 786 1 1 55 TRP H H -7.656 -7.441 -11.086 1.00 . A A . 563 TRP H 1 1 1 787 1 1 55 TRP HA H -6.211 -6.386 -9.487 1.00 . A A . 563 TRP HA 1 1 1 788 1 1 55 TRP HB2 H -5.431 -4.767 -11.850 1.00 . A A . 563 TRP HB2 1 1 1 789 1 1 55 TRP HB3 H -4.439 -5.765 -10.793 1.00 . A A . 563 TRP HB3 1 1 1 790 1 1 55 TRP HD1 H -7.446 -6.647 -13.092 1.00 . A A . 563 TRP HD1 1 1 1 791 1 1 55 TRP HE1 H -6.769 -8.632 -14.591 1.00 . A A . 563 TRP HE1 1 1 1 792 1 1 55 TRP HE3 H -2.715 -7.318 -11.441 1.00 . A A . 563 TRP HE3 1 1 1 793 1 1 55 TRP HH2 H -2.139 -10.535 -14.190 1.00 . A A . 563 TRP HH2 1 1 1 794 1 1 55 TRP HZ2 H -4.436 -10.253 -15.026 1.00 . A A . 563 TRP HZ2 1 1 1 795 1 1 55 TRP HZ3 H -1.283 -9.088 -12.414 1.00 . A A . 563 TRP HZ3 1 1 1 796 1 1 55 TRP N N -7.673 -6.467 -10.996 1.00 . A A . 563 TRP N 1 1 1 797 1 1 55 TRP NE1 N -6.168 -8.209 -13.927 1.00 . A A . 563 TRP NE1 1 1 1 798 1 1 55 TRP O O -6.684 -3.424 -10.605 1.00 . A A . 563 TRP O 1 1 1 799 1 1 56 TYR C C -6.211 -2.364 -7.500 1.00 . A A . 564 TYR C 1 1 1 800 1 1 56 TYR CA C -7.530 -2.830 -8.132 1.00 . A A . 564 TYR CA 1 1 1 801 1 1 56 TYR CB C -8.591 -2.872 -7.027 1.00 . A A . 564 TYR CB 1 1 1 802 1 1 56 TYR CD1 C -6.774 -4.162 -5.977 1.00 . A A . 564 TYR CD1 1 1 1 803 1 1 56 TYR CD2 C -8.264 -2.958 -4.514 1.00 . A A . 564 TYR CD2 1 1 1 804 1 1 56 TYR CE1 C -6.042 -4.607 -4.917 1.00 . A A . 564 TYR CE1 1 1 1 805 1 1 56 TYR CE2 C -7.524 -3.412 -3.410 1.00 . A A . 564 TYR CE2 1 1 1 806 1 1 56 TYR CG C -7.876 -3.343 -5.797 1.00 . A A . 564 TYR CG 1 1 1 807 1 1 56 TYR CZ C -6.404 -4.241 -3.613 1.00 . A A . 564 TYR CZ 1 1 1 808 1 1 56 TYR H H -7.354 -4.996 -8.044 1.00 . A A . 564 TYR H 1 1 1 809 1 1 56 TYR HA H -7.824 -2.176 -8.926 1.00 . A A . 564 TYR HA 1 1 1 810 1 1 56 TYR HB2 H -9.002 -1.885 -6.869 1.00 . A A . 564 TYR HB2 1 1 1 811 1 1 56 TYR HB3 H -9.374 -3.567 -7.287 1.00 . A A . 564 TYR HB3 1 1 1 812 1 1 56 TYR HD1 H -6.478 -4.440 -6.965 1.00 . A A . 564 TYR HD1 1 1 1 813 1 1 56 TYR HD2 H -9.125 -2.323 -4.373 1.00 . A A . 564 TYR HD2 1 1 1 814 1 1 56 TYR HE1 H -5.200 -5.241 -5.116 1.00 . A A . 564 TYR HE1 1 1 1 815 1 1 56 TYR HE2 H -7.812 -3.126 -2.411 1.00 . A A . 564 TYR HE2 1 1 1 816 1 1 56 TYR HH H -4.740 -4.491 -2.710 1.00 . A A . 564 TYR HH 1 1 1 817 1 1 56 TYR N N -7.271 -4.213 -8.648 1.00 . A A . 564 TYR N 1 1 1 818 1 1 56 TYR O O -5.182 -2.966 -7.722 1.00 . A A . 564 TYR O 1 1 1 819 1 1 56 TYR OH O -5.665 -4.685 -2.536 1.00 . A A . 564 TYR OH 1 1 1 820 1 1 57 VAL C C -5.068 0.282 -5.167 1.00 . A A . 565 VAL C 1 1 1 821 1 1 57 VAL CA C -4.933 -0.987 -6.004 1.00 . A A . 565 VAL CA 1 1 1 822 1 1 57 VAL CB C -3.855 -0.787 -7.063 1.00 . A A . 565 VAL CB 1 1 1 823 1 1 57 VAL CG1 C -4.444 -0.016 -8.236 1.00 . A A . 565 VAL CG1 1 1 1 824 1 1 57 VAL CG2 C -2.679 -0.003 -6.469 1.00 . A A . 565 VAL CG2 1 1 1 825 1 1 57 VAL H H -7.055 -0.903 -6.435 1.00 . A A . 565 VAL H 1 1 1 826 1 1 57 VAL HA H -4.630 -1.796 -5.356 1.00 . A A . 565 VAL HA 1 1 1 827 1 1 57 VAL HB H -3.508 -1.750 -7.405 1.00 . A A . 565 VAL HB 1 1 1 828 1 1 57 VAL HG11 H -4.845 0.923 -7.885 1.00 . A A . 565 VAL HG11 1 1 1 829 1 1 57 VAL HG12 H -3.668 0.173 -8.960 1.00 . A A . 565 VAL HG12 1 1 1 830 1 1 57 VAL HG13 H -5.234 -0.596 -8.693 1.00 . A A . 565 VAL HG13 1 1 1 831 1 1 57 VAL HG21 H -3.045 0.895 -5.995 1.00 . A A . 565 VAL HG21 1 1 1 832 1 1 57 VAL HG22 H -2.173 -0.615 -5.736 1.00 . A A . 565 VAL HG22 1 1 1 833 1 1 57 VAL HG23 H -1.988 0.261 -7.256 1.00 . A A . 565 VAL HG23 1 1 1 834 1 1 57 VAL N N -6.219 -1.363 -6.662 1.00 . A A . 565 VAL N 1 1 1 835 1 1 57 VAL O O -5.903 1.132 -5.406 1.00 . A A . 565 VAL O 1 1 1 836 1 1 58 THR C C -2.818 1.715 -2.673 1.00 . A A . 566 THR C 1 1 1 837 1 1 58 THR CA C -4.207 1.598 -3.303 1.00 . A A . 566 THR CA 1 1 1 838 1 1 58 THR CB C -5.256 1.445 -2.199 1.00 . A A . 566 THR CB 1 1 1 839 1 1 58 THR CG2 C -5.210 2.668 -1.277 1.00 . A A . 566 THR CG2 1 1 1 840 1 1 58 THR H H -3.550 -0.312 -4.051 1.00 . A A . 566 THR H 1 1 1 841 1 1 58 THR HA H -4.416 2.484 -3.886 1.00 . A A . 566 THR HA 1 1 1 842 1 1 58 THR HB H -5.045 0.557 -1.622 1.00 . A A . 566 THR HB 1 1 1 843 1 1 58 THR HG1 H -7.006 0.611 -2.356 1.00 . A A . 566 THR HG1 1 1 1 844 1 1 58 THR HG21 H -4.192 3.027 -1.201 1.00 . A A . 566 THR HG21 1 1 1 845 1 1 58 THR HG22 H -5.835 3.449 -1.684 1.00 . A A . 566 THR HG22 1 1 1 846 1 1 58 THR HG23 H -5.569 2.394 -0.296 1.00 . A A . 566 THR HG23 1 1 1 847 1 1 58 THR N N -4.213 0.400 -4.192 1.00 . A A . 566 THR N 1 1 1 848 1 1 58 THR O O -2.570 1.207 -1.597 1.00 . A A . 566 THR O 1 1 1 849 1 1 58 THR OG1 O -6.546 1.336 -2.784 1.00 . A A . 566 THR OG1 1 1 1 850 1 1 59 VAL C C -0.221 3.967 -2.521 1.00 . A A . 567 VAL C 1 1 1 851 1 1 59 VAL CA C -0.526 2.493 -2.787 1.00 . A A . 567 VAL CA 1 1 1 852 1 1 59 VAL CB C 0.472 1.920 -3.795 1.00 . A A . 567 VAL CB 1 1 1 853 1 1 59 VAL CG1 C 1.739 1.464 -3.067 1.00 . A A . 567 VAL CG1 1 1 1 854 1 1 59 VAL CG2 C -0.163 0.718 -4.497 1.00 . A A . 567 VAL CG2 1 1 1 855 1 1 59 VAL H H -2.125 2.758 -4.215 1.00 . A A . 567 VAL H 1 1 1 856 1 1 59 VAL HA H -0.460 1.941 -1.861 1.00 . A A . 567 VAL HA 1 1 1 857 1 1 59 VAL HB H 0.723 2.675 -4.525 1.00 . A A . 567 VAL HB 1 1 1 858 1 1 59 VAL HG11 H 1.610 1.593 -2.002 1.00 . A A . 567 VAL HG11 1 1 1 859 1 1 59 VAL HG12 H 1.923 0.422 -3.283 1.00 . A A . 567 VAL HG12 1 1 1 860 1 1 59 VAL HG13 H 2.580 2.054 -3.402 1.00 . A A . 567 VAL HG13 1 1 1 861 1 1 59 VAL HG21 H -0.732 0.142 -3.782 1.00 . A A . 567 VAL HG21 1 1 1 862 1 1 59 VAL HG22 H -0.818 1.064 -5.283 1.00 . A A . 567 VAL HG22 1 1 1 863 1 1 59 VAL HG23 H 0.613 0.098 -4.922 1.00 . A A . 567 VAL HG23 1 1 1 864 1 1 59 VAL N N -1.905 2.364 -3.342 1.00 . A A . 567 VAL N 1 1 1 865 1 1 59 VAL O O -1.109 4.793 -2.517 1.00 . A A . 567 VAL O 1 1 1 866 1 1 60 THR C C 2.571 6.181 -2.809 1.00 . A A . 568 THR C 1 1 1 867 1 1 60 THR CA C 1.346 5.735 -2.005 1.00 . A A . 568 THR CA 1 1 1 868 1 1 60 THR CB C 1.633 5.908 -0.512 1.00 . A A . 568 THR CB 1 1 1 869 1 1 60 THR CG2 C 0.336 5.745 0.283 1.00 . A A . 568 THR CG2 1 1 1 870 1 1 60 THR H H 1.726 3.634 -2.280 1.00 . A A . 568 THR H 1 1 1 871 1 1 60 THR HA H 0.504 6.349 -2.275 1.00 . A A . 568 THR HA 1 1 1 872 1 1 60 THR HB H 2.038 6.892 -0.334 1.00 . A A . 568 THR HB 1 1 1 873 1 1 60 THR HG1 H 2.954 5.215 0.737 1.00 . A A . 568 THR HG1 1 1 1 874 1 1 60 THR HG21 H -0.418 6.404 -0.121 1.00 . A A . 568 THR HG21 1 1 1 875 1 1 60 THR HG22 H -0.003 4.723 0.212 1.00 . A A . 568 THR HG22 1 1 1 876 1 1 60 THR HG23 H 0.515 5.995 1.318 1.00 . A A . 568 THR HG23 1 1 1 877 1 1 60 THR N N 1.019 4.309 -2.285 1.00 . A A . 568 THR N 1 1 1 878 1 1 60 THR O O 3.352 5.380 -3.282 1.00 . A A . 568 THR O 1 1 1 879 1 1 60 THR OG1 O 2.572 4.926 -0.096 1.00 . A A . 568 THR OG1 1 1 1 880 1 1 61 LEU C C 4.369 9.282 -2.959 1.00 . A A . 569 LEU C 1 1 1 881 1 1 61 LEU CA C 3.904 8.020 -3.693 1.00 . A A . 569 LEU CA 1 1 1 882 1 1 61 LEU CB C 3.478 8.366 -5.123 1.00 . A A . 569 LEU CB 1 1 1 883 1 1 61 LEU CD1 C 5.485 7.833 -6.534 1.00 . A A . 569 LEU CD1 1 1 1 884 1 1 61 LEU CD2 C 4.134 9.903 -6.970 1.00 . A A . 569 LEU CD2 1 1 1 885 1 1 61 LEU CG C 4.664 8.960 -5.886 1.00 . A A . 569 LEU CG 1 1 1 886 1 1 61 LEU H H 2.095 8.084 -2.539 1.00 . A A . 569 LEU H 1 1 1 887 1 1 61 LEU HA H 4.703 7.292 -3.713 1.00 . A A . 569 LEU HA 1 1 1 888 1 1 61 LEU HB2 H 3.141 7.470 -5.623 1.00 . A A . 569 LEU HB2 1 1 1 889 1 1 61 LEU HB3 H 2.673 9.087 -5.095 1.00 . A A . 569 LEU HB3 1 1 1 890 1 1 61 LEU HD11 H 5.398 6.939 -5.937 1.00 . A A . 569 LEU HD11 1 1 1 891 1 1 61 LEU HD12 H 5.119 7.637 -7.534 1.00 . A A . 569 LEU HD12 1 1 1 892 1 1 61 LEU HD13 H 6.524 8.127 -6.589 1.00 . A A . 569 LEU HD13 1 1 1 893 1 1 61 LEU HD21 H 3.138 9.599 -7.254 1.00 . A A . 569 LEU HD21 1 1 1 894 1 1 61 LEU HD22 H 4.103 10.915 -6.585 1.00 . A A . 569 LEU HD22 1 1 1 895 1 1 61 LEU HD23 H 4.784 9.861 -7.832 1.00 . A A . 569 LEU HD23 1 1 1 896 1 1 61 LEU HG H 5.291 9.513 -5.202 1.00 . A A . 569 LEU HG 1 1 1 897 1 1 61 LEU N N 2.739 7.468 -2.945 1.00 . A A . 569 LEU N 1 1 1 898 1 1 61 LEU O O 3.893 10.367 -3.225 1.00 . A A . 569 LEU O 1 1 1 899 1 1 62 PRO C C 6.811 11.028 -1.927 1.00 . A A . 570 PRO C 1 1 1 900 1 1 62 PRO CA C 5.798 10.165 -1.176 1.00 . A A . 570 PRO CA 1 1 1 901 1 1 62 PRO CB C 6.471 9.412 -0.025 1.00 . A A . 570 PRO CB 1 1 1 902 1 1 62 PRO CD C 5.829 7.751 -1.743 1.00 . A A . 570 PRO CD 1 1 1 903 1 1 62 PRO CG C 6.776 7.990 -0.552 1.00 . A A . 570 PRO CG 1 1 1 904 1 1 62 PRO HA H 4.999 10.774 -0.792 1.00 . A A . 570 PRO HA 1 1 1 905 1 1 62 PRO HB2 H 7.387 9.912 0.259 1.00 . A A . 570 PRO HB2 1 1 1 906 1 1 62 PRO HB3 H 5.803 9.351 0.820 1.00 . A A . 570 PRO HB3 1 1 1 907 1 1 62 PRO HD2 H 6.381 7.384 -2.601 1.00 . A A . 570 PRO HD2 1 1 1 908 1 1 62 PRO HD3 H 5.045 7.062 -1.472 1.00 . A A . 570 PRO HD3 1 1 1 909 1 1 62 PRO HG2 H 7.806 7.929 -0.876 1.00 . A A . 570 PRO HG2 1 1 1 910 1 1 62 PRO HG3 H 6.585 7.259 0.218 1.00 . A A . 570 PRO HG3 1 1 1 911 1 1 62 PRO N N 5.262 9.082 -2.026 1.00 . A A . 570 PRO N 1 1 1 912 1 1 62 PRO O O 7.969 10.683 -2.050 1.00 . A A . 570 PRO O 1 1 1 913 1 1 63 ALA C C 6.745 14.467 -3.240 1.00 . A A . 571 ALA C 1 1 1 914 1 1 63 ALA CA C 7.328 13.052 -3.145 1.00 . A A . 571 ALA CA 1 1 1 915 1 1 63 ALA CB C 7.576 12.499 -4.546 1.00 . A A . 571 ALA CB 1 1 1 916 1 1 63 ALA H H 5.447 12.427 -2.294 1.00 . A A . 571 ALA H 1 1 1 917 1 1 63 ALA HA H 8.265 13.091 -2.607 1.00 . A A . 571 ALA HA 1 1 1 918 1 1 63 ALA HB1 H 6.673 12.039 -4.916 1.00 . A A . 571 ALA HB1 1 1 1 919 1 1 63 ALA HB2 H 7.867 13.305 -5.203 1.00 . A A . 571 ALA HB2 1 1 1 920 1 1 63 ALA HB3 H 8.366 11.763 -4.508 1.00 . A A . 571 ALA HB3 1 1 1 921 1 1 63 ALA N N 6.384 12.160 -2.418 1.00 . A A . 571 ALA N 1 1 1 922 1 1 63 ALA O O 7.263 15.402 -2.663 1.00 . A A . 571 ALA O 1 1 1 923 1 1 64 GLY C C 5.670 16.679 -5.341 1.00 . A A . 572 GLY C 1 1 1 924 1 1 64 GLY CA C 5.065 15.986 -4.118 1.00 . A A . 572 GLY CA 1 1 1 925 1 1 64 GLY H H 5.278 13.864 -4.437 1.00 . A A . 572 GLY H 1 1 1 926 1 1 64 GLY HA2 H 3.996 15.889 -4.247 1.00 . A A . 572 GLY HA2 1 1 1 927 1 1 64 GLY HA3 H 5.272 16.573 -3.236 1.00 . A A . 572 GLY HA3 1 1 1 928 1 1 64 GLY N N 5.675 14.631 -3.974 1.00 . A A . 572 GLY N 1 1 1 929 1 1 64 GLY O O 6.179 17.779 -5.259 1.00 . A A . 572 GLY O 1 1 1 930 1 1 65 GLU C C 5.639 15.918 -8.942 1.00 . A A . 573 GLU C 1 1 1 931 1 1 65 GLU CA C 6.199 16.638 -7.710 1.00 . A A . 573 GLU CA 1 1 1 932 1 1 65 GLU CB C 7.723 16.496 -7.677 1.00 . A A . 573 GLU CB 1 1 1 933 1 1 65 GLU CD C 9.875 17.478 -8.483 1.00 . A A . 573 GLU CD 1 1 1 934 1 1 65 GLU CG C 8.364 17.696 -8.378 1.00 . A A . 573 GLU CG 1 1 1 935 1 1 65 GLU H H 5.206 15.152 -6.515 1.00 . A A . 573 GLU H 1 1 1 936 1 1 65 GLU HA H 5.937 17.684 -7.757 1.00 . A A . 573 GLU HA 1 1 1 937 1 1 65 GLU HB2 H 8.057 16.457 -6.650 1.00 . A A . 573 GLU HB2 1 1 1 938 1 1 65 GLU HB3 H 8.012 15.588 -8.184 1.00 . A A . 573 GLU HB3 1 1 1 939 1 1 65 GLU HG2 H 7.945 17.802 -9.368 1.00 . A A . 573 GLU HG2 1 1 1 940 1 1 65 GLU HG3 H 8.171 18.592 -7.807 1.00 . A A . 573 GLU HG3 1 1 1 941 1 1 65 GLU N N 5.623 16.034 -6.475 1.00 . A A . 573 GLU N 1 1 1 942 1 1 65 GLU O O 4.489 15.524 -8.976 1.00 . A A . 573 GLU O 1 1 1 943 1 1 65 GLU OE1 O 10.278 16.630 -9.262 1.00 . A A . 573 GLU OE1 1 1 1 944 1 1 65 GLU OE2 O 10.602 18.163 -7.782 1.00 . A A . 573 GLU OE2 1 1 1 945 1 1 66 SER C C 6.590 13.656 -11.262 1.00 . A A . 574 SER C 1 1 1 946 1 1 66 SER CA C 5.978 15.048 -11.186 1.00 . A A . 574 SER CA 1 1 1 947 1 1 66 SER CB C 6.389 15.857 -12.417 1.00 . A A . 574 SER CB 1 1 1 948 1 1 66 SER H H 7.370 16.070 -9.899 1.00 . A A . 574 SER H 1 1 1 949 1 1 66 SER HA H 4.901 14.944 -11.166 1.00 . A A . 574 SER HA 1 1 1 950 1 1 66 SER HB2 H 6.213 15.276 -13.307 1.00 . A A . 574 SER HB2 1 1 1 951 1 1 66 SER HB3 H 5.802 16.765 -12.461 1.00 . A A . 574 SER HB3 1 1 1 952 1 1 66 SER HG H 7.959 16.861 -12.975 1.00 . A A . 574 SER HG 1 1 1 953 1 1 66 SER N N 6.449 15.743 -9.952 1.00 . A A . 574 SER N 1 1 1 954 1 1 66 SER O O 7.791 13.476 -11.266 1.00 . A A . 574 SER O 1 1 1 955 1 1 66 SER OG O 7.772 16.174 -12.331 1.00 . A A . 574 SER OG 1 1 1 956 1 1 67 PHE C C 5.479 10.679 -12.643 1.00 . A A . 575 PHE C 1 1 1 957 1 1 67 PHE CA C 6.194 11.271 -11.435 1.00 . A A . 575 PHE CA 1 1 1 958 1 1 67 PHE CB C 5.768 10.534 -10.170 1.00 . A A . 575 PHE CB 1 1 1 959 1 1 67 PHE CD1 C 7.175 11.661 -8.411 1.00 . A A . 575 PHE CD1 1 1 1 960 1 1 67 PHE CD2 C 4.803 12.141 -8.487 1.00 . A A . 575 PHE CD2 1 1 1 961 1 1 67 PHE CE1 C 7.319 12.529 -7.327 1.00 . A A . 575 PHE CE1 1 1 1 962 1 1 67 PHE CE2 C 4.947 13.013 -7.402 1.00 . A A . 575 PHE CE2 1 1 1 963 1 1 67 PHE CG C 5.919 11.464 -8.991 1.00 . A A . 575 PHE CG 1 1 1 964 1 1 67 PHE CZ C 6.205 13.206 -6.823 1.00 . A A . 575 PHE CZ 1 1 1 965 1 1 67 PHE H H 4.783 12.873 -11.347 1.00 . A A . 575 PHE H 1 1 1 966 1 1 67 PHE HA H 7.275 11.212 -11.552 1.00 . A A . 575 PHE HA 1 1 1 967 1 1 67 PHE HB2 H 4.737 10.226 -10.261 1.00 . A A . 575 PHE HB2 1 1 1 968 1 1 67 PHE HB3 H 6.393 9.671 -10.033 1.00 . A A . 575 PHE HB3 1 1 1 969 1 1 67 PHE HD1 H 8.033 11.138 -8.798 1.00 . A A . 575 PHE HD1 1 1 1 970 1 1 67 PHE HD2 H 3.833 11.988 -8.933 1.00 . A A . 575 PHE HD2 1 1 1 971 1 1 67 PHE HE1 H 8.290 12.679 -6.880 1.00 . A A . 575 PHE HE1 1 1 1 972 1 1 67 PHE HE2 H 4.089 13.537 -7.012 1.00 . A A . 575 PHE HE2 1 1 1 973 1 1 67 PHE HZ H 6.316 13.878 -5.986 1.00 . A A . 575 PHE HZ 1 1 1 974 1 1 67 PHE N N 5.745 12.678 -11.338 1.00 . A A . 575 PHE N 1 1 1 975 1 1 67 PHE O O 4.302 10.945 -12.856 1.00 . A A . 575 PHE O 1 1 1 976 1 1 68 GLU C C 4.476 8.245 -14.113 1.00 . A A . 576 GLU C 1 1 1 977 1 1 68 GLU CA C 5.389 9.339 -14.618 1.00 . A A . 576 GLU CA 1 1 1 978 1 1 68 GLU CB C 6.328 8.770 -15.684 1.00 . A A . 576 GLU CB 1 1 1 979 1 1 68 GLU CD C 6.469 10.482 -17.501 1.00 . A A . 576 GLU CD 1 1 1 980 1 1 68 GLU CG C 7.178 9.898 -16.277 1.00 . A A . 576 GLU CG 1 1 1 981 1 1 68 GLU H H 7.080 9.664 -13.276 1.00 . A A . 576 GLU H 1 1 1 982 1 1 68 GLU HA H 4.791 10.117 -15.056 1.00 . A A . 576 GLU HA 1 1 1 983 1 1 68 GLU HB2 H 6.964 8.024 -15.244 1.00 . A A . 576 GLU HB2 1 1 1 984 1 1 68 GLU HB3 H 5.742 8.319 -16.470 1.00 . A A . 576 GLU HB3 1 1 1 985 1 1 68 GLU HG2 H 7.316 10.672 -15.536 1.00 . A A . 576 GLU HG2 1 1 1 986 1 1 68 GLU HG3 H 8.140 9.507 -16.574 1.00 . A A . 576 GLU HG3 1 1 1 987 1 1 68 GLU N N 6.133 9.887 -13.443 1.00 . A A . 576 GLU N 1 1 1 988 1 1 68 GLU O O 4.550 7.846 -12.968 1.00 . A A . 576 GLU O 1 1 1 989 1 1 68 GLU OE1 O 5.525 9.865 -17.965 1.00 . A A . 576 GLU OE1 1 1 1 990 1 1 68 GLU OE2 O 6.882 11.538 -17.952 1.00 . A A . 576 GLU OE2 1 1 1 991 1 1 69 TYR C C 2.428 5.714 -15.576 1.00 . A A . 577 TYR C 1 1 1 992 1 1 69 TYR CA C 2.689 6.713 -14.454 1.00 . A A . 577 TYR CA 1 1 1 993 1 1 69 TYR CB C 1.392 7.356 -13.963 1.00 . A A . 577 TYR CB 1 1 1 994 1 1 69 TYR CD1 C 2.286 8.748 -12.026 1.00 . A A . 577 TYR CD1 1 1 1 995 1 1 69 TYR CD2 C 0.884 6.818 -11.556 1.00 . A A . 577 TYR CD2 1 1 1 996 1 1 69 TYR CE1 C 2.400 8.992 -10.652 1.00 . A A . 577 TYR CE1 1 1 1 997 1 1 69 TYR CE2 C 1.001 7.070 -10.184 1.00 . A A . 577 TYR CE2 1 1 1 998 1 1 69 TYR CG C 1.522 7.653 -12.482 1.00 . A A . 577 TYR CG 1 1 1 999 1 1 69 TYR CZ C 1.758 8.156 -9.733 1.00 . A A . 577 TYR CZ 1 1 1 1000 1 1 69 TYR H H 3.536 8.107 -15.848 1.00 . A A . 577 TYR H 1 1 1 1001 1 1 69 TYR HA H 3.159 6.200 -13.633 1.00 . A A . 577 TYR HA 1 1 1 1002 1 1 69 TYR HB2 H 1.216 8.274 -14.504 1.00 . A A . 577 TYR HB2 1 1 1 1003 1 1 69 TYR HB3 H 0.567 6.677 -14.123 1.00 . A A . 577 TYR HB3 1 1 1 1004 1 1 69 TYR HD1 H 2.786 9.407 -12.730 1.00 . A A . 577 TYR HD1 1 1 1 1005 1 1 69 TYR HD2 H 0.298 5.979 -11.901 1.00 . A A . 577 TYR HD2 1 1 1 1006 1 1 69 TYR HE1 H 2.983 9.831 -10.301 1.00 . A A . 577 TYR HE1 1 1 1 1007 1 1 69 TYR HE2 H 0.507 6.426 -9.473 1.00 . A A . 577 TYR HE2 1 1 1 1008 1 1 69 TYR HH H 1.224 7.859 -7.925 1.00 . A A . 577 TYR HH 1 1 1 1009 1 1 69 TYR N N 3.601 7.767 -14.931 1.00 . A A . 577 TYR N 1 1 1 1010 1 1 69 TYR O O 1.311 5.524 -16.016 1.00 . A A . 577 TYR O 1 1 1 1011 1 1 69 TYR OH O 1.873 8.400 -8.380 1.00 . A A . 577 TYR OH 1 1 1 1012 1 1 70 LYS C C 2.797 2.760 -16.481 1.00 . A A . 578 LYS C 1 1 1 1013 1 1 70 LYS CA C 3.307 4.053 -17.108 1.00 . A A . 578 LYS CA 1 1 1 1014 1 1 70 LYS CB C 4.657 3.802 -17.781 1.00 . A A . 578 LYS CB 1 1 1 1015 1 1 70 LYS CD C 5.338 4.000 -20.178 1.00 . A A . 578 LYS CD 1 1 1 1016 1 1 70 LYS CE C 4.522 5.051 -20.931 1.00 . A A . 578 LYS CE 1 1 1 1017 1 1 70 LYS CG C 4.432 3.258 -19.193 1.00 . A A . 578 LYS CG 1 1 1 1018 1 1 70 LYS H H 4.353 5.230 -15.646 1.00 . A A . 578 LYS H 1 1 1 1019 1 1 70 LYS HA H 2.595 4.410 -17.838 1.00 . A A . 578 LYS HA 1 1 1 1020 1 1 70 LYS HB2 H 5.208 4.728 -17.834 1.00 . A A . 578 LYS HB2 1 1 1 1021 1 1 70 LYS HB3 H 5.218 3.081 -17.205 1.00 . A A . 578 LYS HB3 1 1 1 1022 1 1 70 LYS HD2 H 6.135 4.487 -19.636 1.00 . A A . 578 LYS HD2 1 1 1 1023 1 1 70 LYS HD3 H 5.757 3.298 -20.884 1.00 . A A . 578 LYS HD3 1 1 1 1024 1 1 70 LYS HE2 H 4.060 4.597 -21.795 1.00 . A A . 578 LYS HE2 1 1 1 1025 1 1 70 LYS HE3 H 3.758 5.445 -20.279 1.00 . A A . 578 LYS HE3 1 1 1 1026 1 1 70 LYS HG2 H 4.664 2.203 -19.213 1.00 . A A . 578 LYS HG2 1 1 1 1027 1 1 70 LYS HG3 H 3.400 3.404 -19.476 1.00 . A A . 578 LYS HG3 1 1 1 1028 1 1 70 LYS HZ1 H 6.411 5.851 -21.286 1.00 . A A . 578 LYS HZ1 1 1 1 1029 1 1 70 LYS HZ2 H 5.213 6.397 -22.360 1.00 . A A . 578 LYS HZ2 1 1 1 1030 1 1 70 LYS HZ3 H 5.265 6.990 -20.768 1.00 . A A . 578 LYS HZ3 1 1 1 1031 1 1 70 LYS N N 3.466 5.062 -16.029 1.00 . A A . 578 LYS N 1 1 1 1032 1 1 70 LYS NZ N 5.420 6.156 -21.369 1.00 . A A . 578 LYS NZ 1 1 1 1033 1 1 70 LYS O O 3.087 2.448 -15.335 1.00 . A A . 578 LYS O 1 1 1 1034 1 1 71 PHE C C 2.118 -0.443 -17.281 1.00 . A A . 579 PHE C 1 1 1 1035 1 1 71 PHE CA C 1.523 0.751 -16.597 1.00 . A A . 579 PHE CA 1 1 1 1036 1 1 71 PHE CB C 0.005 0.706 -16.699 1.00 . A A . 579 PHE CB 1 1 1 1037 1 1 71 PHE CD1 C -0.151 -1.755 -16.309 1.00 . A A . 579 PHE CD1 1 1 1 1038 1 1 71 PHE CD2 C -1.145 -0.253 -14.687 1.00 . A A . 579 PHE CD2 1 1 1 1039 1 1 71 PHE CE1 C -0.535 -2.845 -15.544 1.00 . A A . 579 PHE CE1 1 1 1 1040 1 1 71 PHE CE2 C -1.521 -1.349 -13.911 1.00 . A A . 579 PHE CE2 1 1 1 1041 1 1 71 PHE CG C -0.458 -0.460 -15.885 1.00 . A A . 579 PHE CG 1 1 1 1042 1 1 71 PHE CZ C -1.213 -2.643 -14.346 1.00 . A A . 579 PHE CZ 1 1 1 1043 1 1 71 PHE H H 1.796 2.243 -18.125 1.00 . A A . 579 PHE H 1 1 1 1044 1 1 71 PHE HA H 1.815 0.692 -15.551 1.00 . A A . 579 PHE HA 1 1 1 1045 1 1 71 PHE HB2 H -0.416 1.621 -16.307 1.00 . A A . 579 PHE HB2 1 1 1 1046 1 1 71 PHE HB3 H -0.291 0.575 -17.728 1.00 . A A . 579 PHE HB3 1 1 1 1047 1 1 71 PHE HD1 H 0.373 -1.909 -17.241 1.00 . A A . 579 PHE HD1 1 1 1 1048 1 1 71 PHE HD2 H -1.381 0.749 -14.362 1.00 . A A . 579 PHE HD2 1 1 1 1049 1 1 71 PHE HE1 H -0.303 -3.845 -15.873 1.00 . A A . 579 PHE HE1 1 1 1 1050 1 1 71 PHE HE2 H -2.053 -1.200 -12.984 1.00 . A A . 579 PHE HE2 1 1 1 1051 1 1 71 PHE HZ H -1.484 -3.484 -13.755 1.00 . A A . 579 PHE HZ 1 1 1 1052 1 1 71 PHE N N 2.035 1.998 -17.199 1.00 . A A . 579 PHE N 1 1 1 1053 1 1 71 PHE O O 2.374 -0.460 -18.466 1.00 . A A . 579 PHE O 1 1 1 1054 1 1 72 ILE C C 2.230 -3.846 -16.344 1.00 . A A . 580 ILE C 1 1 1 1055 1 1 72 ILE CA C 2.940 -2.673 -17.009 1.00 . A A . 580 ILE CA 1 1 1 1056 1 1 72 ILE CB C 4.431 -2.649 -16.645 1.00 . A A . 580 ILE CB 1 1 1 1057 1 1 72 ILE CD1 C 5.262 -1.840 -14.399 1.00 . A A . 580 ILE CD1 1 1 1 1058 1 1 72 ILE CG1 C 4.538 -2.957 -15.159 1.00 . A A . 580 ILE CG1 1 1 1 1059 1 1 72 ILE CG2 C 5.022 -1.258 -16.909 1.00 . A A . 580 ILE CG2 1 1 1 1060 1 1 72 ILE H H 2.137 -1.364 -15.552 1.00 . A A . 580 ILE H 1 1 1 1061 1 1 72 ILE HA H 2.797 -2.736 -18.056 1.00 . A A . 580 ILE HA 1 1 1 1062 1 1 72 ILE HB H 4.963 -3.391 -17.217 1.00 . A A . 580 ILE HB 1 1 1 1063 1 1 72 ILE HD11 H 6.230 -1.672 -14.838 1.00 . A A . 580 ILE HD11 1 1 1 1064 1 1 72 ILE HD12 H 4.679 -0.934 -14.461 1.00 . A A . 580 ILE HD12 1 1 1 1065 1 1 72 ILE HD13 H 5.377 -2.120 -13.351 1.00 . A A . 580 ILE HD13 1 1 1 1066 1 1 72 ILE HG12 H 3.529 -3.030 -14.769 1.00 . A A . 580 ILE HG12 1 1 1 1067 1 1 72 ILE HG13 H 5.066 -3.890 -15.024 1.00 . A A . 580 ILE HG13 1 1 1 1068 1 1 72 ILE HG21 H 4.342 -0.506 -16.541 1.00 . A A . 580 ILE HG21 1 1 1 1069 1 1 72 ILE HG22 H 5.973 -1.167 -16.391 1.00 . A A . 580 ILE HG22 1 1 1 1070 1 1 72 ILE HG23 H 5.173 -1.121 -17.966 1.00 . A A . 580 ILE HG23 1 1 1 1071 1 1 72 ILE N N 2.349 -1.439 -16.501 1.00 . A A . 580 ILE N 1 1 1 1072 1 1 72 ILE O O 2.279 -4.008 -15.156 1.00 . A A . 580 ILE O 1 1 1 1073 1 1 73 ARG C C 1.829 -6.902 -16.132 1.00 . A A . 581 ARG C 1 1 1 1074 1 1 73 ARG CA C 0.838 -5.788 -16.443 1.00 . A A . 581 ARG CA 1 1 1 1075 1 1 73 ARG CB C -0.250 -6.315 -17.380 1.00 . A A . 581 ARG CB 1 1 1 1076 1 1 73 ARG CD C -1.698 -8.279 -17.925 1.00 . A A . 581 ARG CD 1 1 1 1077 1 1 73 ARG CG C -0.705 -7.700 -16.914 1.00 . A A . 581 ARG CG 1 1 1 1078 1 1 73 ARG CZ C -1.713 -10.242 -19.344 1.00 . A A . 581 ARG CZ 1 1 1 1079 1 1 73 ARG H H 1.492 -4.519 -18.054 1.00 . A A . 581 ARG H 1 1 1 1080 1 1 73 ARG HA H 0.386 -5.444 -15.529 1.00 . A A . 581 ARG HA 1 1 1 1081 1 1 73 ARG HB2 H -1.090 -5.637 -17.367 1.00 . A A . 581 ARG HB2 1 1 1 1082 1 1 73 ARG HB3 H 0.142 -6.385 -18.383 1.00 . A A . 581 ARG HB3 1 1 1 1083 1 1 73 ARG HD2 H -2.695 -8.244 -17.510 1.00 . A A . 581 ARG HD2 1 1 1 1084 1 1 73 ARG HD3 H -1.665 -7.699 -18.835 1.00 . A A . 581 ARG HD3 1 1 1 1085 1 1 73 ARG HE H -0.808 -10.210 -17.577 1.00 . A A . 581 ARG HE 1 1 1 1086 1 1 73 ARG HG2 H 0.152 -8.353 -16.836 1.00 . A A . 581 ARG HG2 1 1 1 1087 1 1 73 ARG HG3 H -1.184 -7.617 -15.950 1.00 . A A . 581 ARG HG3 1 1 1 1088 1 1 73 ARG HH11 H -3.659 -9.883 -19.039 1.00 . A A . 581 ARG HH11 1 1 1 1089 1 1 73 ARG HH12 H -3.271 -10.698 -20.516 1.00 . A A . 581 ARG HH12 1 1 1 1090 1 1 73 ARG HH21 H 0.143 -10.730 -19.911 1.00 . A A . 581 ARG HH21 1 1 1 1091 1 1 73 ARG HH22 H -1.117 -11.178 -21.010 1.00 . A A . 581 ARG HH22 1 1 1 1092 1 1 73 ARG N N 1.550 -4.658 -17.088 1.00 . A A . 581 ARG N 1 1 1 1093 1 1 73 ARG NE N -1.333 -9.693 -18.223 1.00 . A A . 581 ARG NE 1 1 1 1094 1 1 73 ARG NH1 N -2.980 -10.277 -19.658 1.00 . A A . 581 ARG NH1 1 1 1 1095 1 1 73 ARG NH2 N -0.827 -10.757 -20.152 1.00 . A A . 581 ARG NH2 1 1 1 1096 1 1 73 ARG O O 2.346 -7.547 -17.023 1.00 . A A . 581 ARG O 1 1 1 1097 1 1 74 ILE C C 2.305 -9.593 -14.717 1.00 . A A . 582 ILE C 1 1 1 1098 1 1 74 ILE CA C 3.049 -8.258 -14.554 1.00 . A A . 582 ILE CA 1 1 1 1099 1 1 74 ILE CB C 3.622 -8.080 -13.129 1.00 . A A . 582 ILE CB 1 1 1 1100 1 1 74 ILE CD1 C 5.612 -9.299 -13.920 1.00 . A A . 582 ILE CD1 1 1 1 1101 1 1 74 ILE CG1 C 5.140 -8.022 -13.233 1.00 . A A . 582 ILE CG1 1 1 1 1102 1 1 74 ILE CG2 C 3.252 -9.264 -12.225 1.00 . A A . 582 ILE CG2 1 1 1 1103 1 1 74 ILE H H 1.656 -6.627 -14.150 1.00 . A A . 582 ILE H 1 1 1 1104 1 1 74 ILE HA H 3.861 -8.228 -15.265 1.00 . A A . 582 ILE HA 1 1 1 1105 1 1 74 ILE HB H 3.253 -7.158 -12.694 1.00 . A A . 582 ILE HB 1 1 1 1106 1 1 74 ILE HD11 H 4.816 -10.037 -13.872 1.00 . A A . 582 ILE HD11 1 1 1 1107 1 1 74 ILE HD12 H 5.850 -9.086 -14.955 1.00 . A A . 582 ILE HD12 1 1 1 1108 1 1 74 ILE HD13 H 6.488 -9.679 -13.418 1.00 . A A . 582 ILE HD13 1 1 1 1109 1 1 74 ILE HG12 H 5.433 -7.161 -13.816 1.00 . A A . 582 ILE HG12 1 1 1 1110 1 1 74 ILE HG13 H 5.573 -7.961 -12.247 1.00 . A A . 582 ILE HG13 1 1 1 1111 1 1 74 ILE HG21 H 2.977 -10.114 -12.829 1.00 . A A . 582 ILE HG21 1 1 1 1112 1 1 74 ILE HG22 H 4.102 -9.522 -11.610 1.00 . A A . 582 ILE HG22 1 1 1 1113 1 1 74 ILE HG23 H 2.425 -8.988 -11.591 1.00 . A A . 582 ILE HG23 1 1 1 1114 1 1 74 ILE N N 2.093 -7.154 -14.876 1.00 . A A . 582 ILE N 1 1 1 1115 1 1 74 ILE O O 1.128 -9.693 -14.435 1.00 . A A . 582 ILE O 1 1 1 1116 1 1 75 GLU C C 2.933 -13.053 -14.679 1.00 . A A . 583 GLU C 1 1 1 1117 1 1 75 GLU CA C 2.270 -11.910 -15.454 1.00 . A A . 583 GLU CA 1 1 1 1118 1 1 75 GLU CB C 2.295 -12.234 -16.949 1.00 . A A . 583 GLU CB 1 1 1 1119 1 1 75 GLU CD C 0.755 -12.917 -18.798 1.00 . A A . 583 GLU CD 1 1 1 1120 1 1 75 GLU CG C 1.070 -13.077 -17.309 1.00 . A A . 583 GLU CG 1 1 1 1121 1 1 75 GLU H H 3.904 -10.500 -15.471 1.00 . A A . 583 GLU H 1 1 1 1122 1 1 75 GLU HA H 1.242 -11.819 -15.134 1.00 . A A . 583 GLU HA 1 1 1 1123 1 1 75 GLU HB2 H 2.281 -11.314 -17.517 1.00 . A A . 583 GLU HB2 1 1 1 1124 1 1 75 GLU HB3 H 3.192 -12.787 -17.183 1.00 . A A . 583 GLU HB3 1 1 1 1125 1 1 75 GLU HG2 H 1.271 -14.116 -17.093 1.00 . A A . 583 GLU HG2 1 1 1 1126 1 1 75 GLU HG3 H 0.222 -12.746 -16.728 1.00 . A A . 583 GLU HG3 1 1 1 1127 1 1 75 GLU N N 2.967 -10.606 -15.220 1.00 . A A . 583 GLU N 1 1 1 1128 1 1 75 GLU O O 3.964 -12.893 -14.056 1.00 . A A . 583 GLU O 1 1 1 1129 1 1 75 GLU OE1 O 1.575 -12.347 -19.500 1.00 . A A . 583 GLU OE1 1 1 1 1130 1 1 75 GLU OE2 O -0.301 -13.367 -19.212 1.00 . A A . 583 GLU OE2 1 1 1 1131 1 1 76 SER C C 3.752 -16.255 -14.848 1.00 . A A . 584 SER C 1 1 1 1132 1 1 76 SER CA C 2.844 -15.388 -13.963 1.00 . A A . 584 SER CA 1 1 1 1133 1 1 76 SER CB C 1.666 -16.241 -13.484 1.00 . A A . 584 SER CB 1 1 1 1134 1 1 76 SER H H 1.474 -14.289 -15.205 1.00 . A A . 584 SER H 1 1 1 1135 1 1 76 SER HA H 3.403 -15.047 -13.105 1.00 . A A . 584 SER HA 1 1 1 1136 1 1 76 SER HB2 H 0.849 -15.603 -13.186 1.00 . A A . 584 SER HB2 1 1 1 1137 1 1 76 SER HB3 H 1.337 -16.884 -14.291 1.00 . A A . 584 SER HB3 1 1 1 1138 1 1 76 SER HG H 1.818 -17.937 -12.542 1.00 . A A . 584 SER HG 1 1 1 1139 1 1 76 SER N N 2.311 -14.206 -14.704 1.00 . A A . 584 SER N 1 1 1 1140 1 1 76 SER O O 4.587 -16.985 -14.350 1.00 . A A . 584 SER O 1 1 1 1141 1 1 76 SER OG O 2.077 -17.028 -12.374 1.00 . A A . 584 SER OG 1 1 1 1142 1 1 77 ASP C C 5.580 -16.288 -17.608 1.00 . A A . 585 ASP C 1 1 1 1143 1 1 77 ASP CA C 4.418 -17.080 -17.015 1.00 . A A . 585 ASP CA 1 1 1 1144 1 1 77 ASP CB C 3.541 -17.619 -18.141 1.00 . A A . 585 ASP CB 1 1 1 1145 1 1 77 ASP CG C 2.261 -16.789 -18.265 1.00 . A A . 585 ASP CG 1 1 1 1146 1 1 77 ASP H H 2.903 -15.659 -16.550 1.00 . A A . 585 ASP H 1 1 1 1147 1 1 77 ASP HA H 4.805 -17.908 -16.442 1.00 . A A . 585 ASP HA 1 1 1 1148 1 1 77 ASP HB2 H 4.086 -17.547 -19.054 1.00 . A A . 585 ASP HB2 1 1 1 1149 1 1 77 ASP HB3 H 3.287 -18.650 -17.946 1.00 . A A . 585 ASP HB3 1 1 1 1150 1 1 77 ASP N N 3.586 -16.223 -16.144 1.00 . A A . 585 ASP N 1 1 1 1151 1 1 77 ASP O O 6.711 -16.412 -17.184 1.00 . A A . 585 ASP O 1 1 1 1152 1 1 77 ASP OD1 O 2.355 -15.649 -18.691 1.00 . A A . 585 ASP OD1 1 1 1 1153 1 1 77 ASP OD2 O 1.208 -17.307 -17.931 1.00 . A A . 585 ASP OD2 1 1 1 1154 1 1 78 ASP C C 6.960 -13.700 -18.201 1.00 . A A . 586 ASP C 1 1 1 1155 1 1 78 ASP CA C 6.410 -14.694 -19.222 1.00 . A A . 586 ASP CA 1 1 1 1156 1 1 78 ASP CB C 5.870 -13.938 -20.439 1.00 . A A . 586 ASP CB 1 1 1 1157 1 1 78 ASP CG C 6.935 -12.966 -20.951 1.00 . A A . 586 ASP CG 1 1 1 1158 1 1 78 ASP H H 4.391 -15.401 -18.922 1.00 . A A . 586 ASP H 1 1 1 1159 1 1 78 ASP HA H 7.200 -15.362 -19.534 1.00 . A A . 586 ASP HA 1 1 1 1160 1 1 78 ASP HB2 H 5.623 -14.645 -21.219 1.00 . A A . 586 ASP HB2 1 1 1 1161 1 1 78 ASP HB3 H 4.986 -13.387 -20.160 1.00 . A A . 586 ASP HB3 1 1 1 1162 1 1 78 ASP N N 5.313 -15.483 -18.594 1.00 . A A . 586 ASP N 1 1 1 1163 1 1 78 ASP O O 7.867 -14.000 -17.450 1.00 . A A . 586 ASP O 1 1 1 1164 1 1 78 ASP OD1 O 8.030 -12.979 -20.412 1.00 . A A . 586 ASP OD1 1 1 1 1165 1 1 78 ASP OD2 O 6.638 -12.226 -21.875 1.00 . A A . 586 ASP OD2 1 1 1 1166 1 1 79 SER C C 5.898 -10.341 -17.195 1.00 . A A . 587 SER C 1 1 1 1167 1 1 79 SER CA C 6.873 -11.509 -17.182 1.00 . A A . 587 SER CA 1 1 1 1168 1 1 79 SER CB C 8.270 -11.014 -17.545 1.00 . A A . 587 SER CB 1 1 1 1169 1 1 79 SER H H 5.667 -12.313 -18.766 1.00 . A A . 587 SER H 1 1 1 1170 1 1 79 SER HA H 6.892 -11.947 -16.195 1.00 . A A . 587 SER HA 1 1 1 1171 1 1 79 SER HB2 H 8.586 -10.284 -16.816 1.00 . A A . 587 SER HB2 1 1 1 1172 1 1 79 SER HB3 H 8.959 -11.847 -17.542 1.00 . A A . 587 SER HB3 1 1 1 1173 1 1 79 SER HG H 8.065 -11.096 -19.479 1.00 . A A . 587 SER HG 1 1 1 1174 1 1 79 SER N N 6.406 -12.525 -18.160 1.00 . A A . 587 SER N 1 1 1 1175 1 1 79 SER O O 4.705 -10.528 -17.088 1.00 . A A . 587 SER O 1 1 1 1176 1 1 79 SER OG O 8.237 -10.409 -18.831 1.00 . A A . 587 SER OG 1 1 1 1177 1 1 80 VAL C C 4.919 -7.762 -18.735 1.00 . A A . 588 VAL C 1 1 1 1178 1 1 80 VAL CA C 5.434 -7.992 -17.325 1.00 . A A . 588 VAL CA 1 1 1 1179 1 1 80 VAL CB C 6.129 -6.693 -16.906 1.00 . A A . 588 VAL CB 1 1 1 1180 1 1 80 VAL CG1 C 5.163 -5.833 -16.097 1.00 . A A . 588 VAL CG1 1 1 1 1181 1 1 80 VAL CG2 C 7.386 -6.960 -16.092 1.00 . A A . 588 VAL CG2 1 1 1 1182 1 1 80 VAL H H 7.340 -8.987 -17.414 1.00 . A A . 588 VAL H 1 1 1 1183 1 1 80 VAL HA H 4.610 -8.194 -16.664 1.00 . A A . 588 VAL HA 1 1 1 1184 1 1 80 VAL HB H 6.401 -6.148 -17.800 1.00 . A A . 588 VAL HB 1 1 1 1185 1 1 80 VAL HG11 H 4.161 -6.226 -16.192 1.00 . A A . 588 VAL HG11 1 1 1 1186 1 1 80 VAL HG12 H 5.456 -5.850 -15.057 1.00 . A A . 588 VAL HG12 1 1 1 1187 1 1 80 VAL HG13 H 5.192 -4.816 -16.463 1.00 . A A . 588 VAL HG13 1 1 1 1188 1 1 80 VAL HG21 H 7.566 -8.020 -16.029 1.00 . A A . 588 VAL HG21 1 1 1 1189 1 1 80 VAL HG22 H 8.218 -6.475 -16.583 1.00 . A A . 588 VAL HG22 1 1 1 1190 1 1 80 VAL HG23 H 7.264 -6.550 -15.101 1.00 . A A . 588 VAL HG23 1 1 1 1191 1 1 80 VAL N N 6.377 -9.136 -17.324 1.00 . A A . 588 VAL N 1 1 1 1192 1 1 80 VAL O O 5.212 -8.486 -19.665 1.00 . A A . 588 VAL O 1 1 1 1193 1 1 81 GLU C C 3.478 -4.791 -20.090 1.00 . A A . 589 GLU C 1 1 1 1194 1 1 81 GLU CA C 3.666 -6.293 -20.193 1.00 . A A . 589 GLU CA 1 1 1 1195 1 1 81 GLU CB C 2.328 -6.952 -20.483 1.00 . A A . 589 GLU CB 1 1 1 1196 1 1 81 GLU CD C 1.128 -7.032 -22.671 1.00 . A A . 589 GLU CD 1 1 1 1197 1 1 81 GLU CG C 1.643 -6.121 -21.556 1.00 . A A . 589 GLU CG 1 1 1 1198 1 1 81 GLU H H 4.027 -6.133 -18.105 1.00 . A A . 589 GLU H 1 1 1 1199 1 1 81 GLU HA H 4.380 -6.526 -20.972 1.00 . A A . 589 GLU HA 1 1 1 1200 1 1 81 GLU HB2 H 2.484 -7.962 -20.838 1.00 . A A . 589 GLU HB2 1 1 1 1201 1 1 81 GLU HB3 H 1.721 -6.964 -19.591 1.00 . A A . 589 GLU HB3 1 1 1 1202 1 1 81 GLU HG2 H 0.823 -5.574 -21.115 1.00 . A A . 589 GLU HG2 1 1 1 1203 1 1 81 GLU HG3 H 2.368 -5.422 -21.960 1.00 . A A . 589 GLU HG3 1 1 1 1204 1 1 81 GLU N N 4.196 -6.704 -18.881 1.00 . A A . 589 GLU N 1 1 1 1205 1 1 81 GLU O O 2.386 -4.295 -19.917 1.00 . A A . 589 GLU O 1 1 1 1206 1 1 81 GLU OE1 O 1.093 -8.233 -22.459 1.00 . A A . 589 GLU OE1 1 1 1 1207 1 1 81 GLU OE2 O 0.777 -6.514 -23.718 1.00 . A A . 589 GLU OE2 1 1 1 1208 1 1 82 TRP C C 3.465 -1.966 -20.879 1.00 . A A . 590 TRP C 1 1 1 1209 1 1 82 TRP CA C 4.482 -2.610 -19.954 1.00 . A A . 590 TRP CA 1 1 1 1210 1 1 82 TRP CB C 5.860 -2.020 -20.183 1.00 . A A . 590 TRP CB 1 1 1 1211 1 1 82 TRP CD1 C 6.807 -3.638 -18.514 1.00 . A A . 590 TRP CD1 1 1 1 1212 1 1 82 TRP CD2 C 7.476 -1.531 -18.136 1.00 . A A . 590 TRP CD2 1 1 1 1213 1 1 82 TRP CE2 C 8.089 -2.335 -17.149 1.00 . A A . 590 TRP CE2 1 1 1 1214 1 1 82 TRP CE3 C 7.729 -0.152 -18.114 1.00 . A A . 590 TRP CE3 1 1 1 1215 1 1 82 TRP CG C 6.690 -2.387 -19.005 1.00 . A A . 590 TRP CG 1 1 1 1216 1 1 82 TRP CH2 C 9.160 -0.422 -16.172 1.00 . A A . 590 TRP CH2 1 1 1 1217 1 1 82 TRP CZ2 C 8.925 -1.789 -16.179 1.00 . A A . 590 TRP CZ2 1 1 1 1218 1 1 82 TRP CZ3 C 8.563 0.392 -17.129 1.00 . A A . 590 TRP CZ3 1 1 1 1219 1 1 82 TRP H H 5.423 -4.514 -20.217 1.00 . A A . 590 TRP H 1 1 1 1220 1 1 82 TRP HA H 4.202 -2.400 -18.942 1.00 . A A . 590 TRP HA 1 1 1 1221 1 1 82 TRP HB2 H 6.291 -2.432 -21.084 1.00 . A A . 590 TRP HB2 1 1 1 1222 1 1 82 TRP HB3 H 5.793 -0.946 -20.262 1.00 . A A . 590 TRP HB3 1 1 1 1223 1 1 82 TRP HD1 H 6.321 -4.515 -18.915 1.00 . A A . 590 TRP HD1 1 1 1 1224 1 1 82 TRP HE1 H 7.897 -4.385 -16.879 1.00 . A A . 590 TRP HE1 1 1 1 1225 1 1 82 TRP HE3 H 7.272 0.492 -18.851 1.00 . A A . 590 TRP HE3 1 1 1 1226 1 1 82 TRP HH2 H 9.793 0.013 -15.422 1.00 . A A . 590 TRP HH2 1 1 1 1227 1 1 82 TRP HZ2 H 9.396 -2.421 -15.446 1.00 . A A . 590 TRP HZ2 1 1 1 1228 1 1 82 TRP HZ3 H 8.742 1.445 -17.103 1.00 . A A . 590 TRP HZ3 1 1 1 1229 1 1 82 TRP N N 4.553 -4.076 -20.124 1.00 . A A . 590 TRP N 1 1 1 1230 1 1 82 TRP NE1 N 7.644 -3.610 -17.416 1.00 . A A . 590 TRP NE1 1 1 1 1231 1 1 82 TRP O O 3.807 -1.468 -21.929 1.00 . A A . 590 TRP O 1 1 1 1232 1 1 83 GLU C C 1.665 0.224 -21.335 1.00 . A A . 591 GLU C 1 1 1 1233 1 1 83 GLU CA C 1.208 -1.225 -21.286 1.00 . A A . 591 GLU CA 1 1 1 1234 1 1 83 GLU CB C -0.167 -1.324 -20.625 1.00 . A A . 591 GLU CB 1 1 1 1235 1 1 83 GLU CD C -2.281 -1.711 -21.901 1.00 . A A . 591 GLU CD 1 1 1 1236 1 1 83 GLU CG C -1.217 -0.676 -21.530 1.00 . A A . 591 GLU CG 1 1 1 1237 1 1 83 GLU H H 1.977 -2.277 -19.592 1.00 . A A . 591 GLU H 1 1 1 1238 1 1 83 GLU HA H 1.183 -1.650 -22.279 1.00 . A A . 591 GLU HA 1 1 1 1239 1 1 83 GLU HB2 H -0.416 -2.363 -20.471 1.00 . A A . 591 GLU HB2 1 1 1 1240 1 1 83 GLU HB3 H -0.147 -0.813 -19.676 1.00 . A A . 591 GLU HB3 1 1 1 1241 1 1 83 GLU HG2 H -1.681 0.148 -21.008 1.00 . A A . 591 GLU HG2 1 1 1 1242 1 1 83 GLU HG3 H -0.743 -0.312 -22.429 1.00 . A A . 591 GLU HG3 1 1 1 1243 1 1 83 GLU N N 2.222 -1.913 -20.463 1.00 . A A . 591 GLU N 1 1 1 1244 1 1 83 GLU O O 1.327 1.038 -20.487 1.00 . A A . 591 GLU O 1 1 1 1245 1 1 83 GLU OE1 O -1.909 -2.835 -22.196 1.00 . A A . 591 GLU OE1 1 1 1 1246 1 1 83 GLU OE2 O -3.450 -1.362 -21.883 1.00 . A A . 591 GLU OE2 1 1 1 1247 1 1 84 SER C C 2.182 2.723 -23.322 1.00 . A A . 592 SER C 1 1 1 1248 1 1 84 SER CA C 3.046 1.889 -22.380 1.00 . A A . 592 SER CA 1 1 1 1249 1 1 84 SER CB C 4.486 1.774 -22.886 1.00 . A A . 592 SER CB 1 1 1 1250 1 1 84 SER H H 2.779 -0.158 -22.919 1.00 . A A . 592 SER H 1 1 1 1251 1 1 84 SER HA H 3.048 2.344 -21.400 1.00 . A A . 592 SER HA 1 1 1 1252 1 1 84 SER HB2 H 5.039 1.091 -22.244 1.00 . A A . 592 SER HB2 1 1 1 1253 1 1 84 SER HB3 H 4.481 1.383 -23.894 1.00 . A A . 592 SER HB3 1 1 1 1254 1 1 84 SER HG H 5.523 3.201 -23.707 1.00 . A A . 592 SER HG 1 1 1 1255 1 1 84 SER N N 2.491 0.528 -22.284 1.00 . A A . 592 SER N 1 1 1 1256 1 1 84 SER O O 2.599 3.745 -23.831 1.00 . A A . 592 SER O 1 1 1 1257 1 1 84 SER OG O 5.103 3.055 -22.856 1.00 . A A . 592 SER OG 1 1 1 1258 1 1 85 ASP C C -0.713 4.085 -23.549 1.00 . A A . 593 ASP C 1 1 1 1259 1 1 85 ASP CA C 0.048 3.075 -24.415 1.00 . A A . 593 ASP CA 1 1 1 1260 1 1 85 ASP CB C -0.930 2.131 -25.119 1.00 . A A . 593 ASP CB 1 1 1 1261 1 1 85 ASP CG C -0.518 1.970 -26.583 1.00 . A A . 593 ASP CG 1 1 1 1262 1 1 85 ASP H H 0.643 1.485 -23.096 1.00 . A A . 593 ASP H 1 1 1 1263 1 1 85 ASP HA H 0.631 3.607 -25.154 1.00 . A A . 593 ASP HA 1 1 1 1264 1 1 85 ASP HB2 H -0.914 1.167 -24.630 1.00 . A A . 593 ASP HB2 1 1 1 1265 1 1 85 ASP HB3 H -1.927 2.543 -25.071 1.00 . A A . 593 ASP HB3 1 1 1 1266 1 1 85 ASP N N 0.962 2.301 -23.535 1.00 . A A . 593 ASP N 1 1 1 1267 1 1 85 ASP O O -0.499 5.275 -23.671 1.00 . A A . 593 ASP O 1 1 1 1268 1 1 85 ASP OD1 O 0.643 2.201 -26.880 1.00 . A A . 593 ASP OD1 1 1 1 1269 1 1 85 ASP OD2 O -1.369 1.617 -27.382 1.00 . A A . 593 ASP OD2 1 1 1 1270 1 1 86 PRO C C -1.427 4.898 -20.593 1.00 . A A . 594 PRO C 1 1 1 1271 1 1 86 PRO CA C -2.326 4.454 -21.755 1.00 . A A . 594 PRO CA 1 1 1 1272 1 1 86 PRO CB C -3.447 3.543 -21.250 1.00 . A A . 594 PRO CB 1 1 1 1273 1 1 86 PRO CD C -1.843 2.140 -22.511 1.00 . A A . 594 PRO CD 1 1 1 1274 1 1 86 PRO CG C -2.944 2.092 -21.435 1.00 . A A . 594 PRO CG 1 1 1 1275 1 1 86 PRO HA H -2.738 5.303 -22.276 1.00 . A A . 594 PRO HA 1 1 1 1276 1 1 86 PRO HB2 H -3.642 3.742 -20.204 1.00 . A A . 594 PRO HB2 1 1 1 1277 1 1 86 PRO HB3 H -4.342 3.695 -21.832 1.00 . A A . 594 PRO HB3 1 1 1 1278 1 1 86 PRO HD2 H -0.965 1.607 -22.174 1.00 . A A . 594 PRO HD2 1 1 1 1279 1 1 86 PRO HD3 H -2.212 1.720 -23.434 1.00 . A A . 594 PRO HD3 1 1 1 1280 1 1 86 PRO HG2 H -2.540 1.719 -20.504 1.00 . A A . 594 PRO HG2 1 1 1 1281 1 1 86 PRO HG3 H -3.752 1.459 -21.769 1.00 . A A . 594 PRO HG3 1 1 1 1282 1 1 86 PRO N N -1.560 3.589 -22.672 1.00 . A A . 594 PRO N 1 1 1 1283 1 1 86 PRO O O -1.508 4.372 -19.501 1.00 . A A . 594 PRO O 1 1 1 1284 1 1 87 ASN C C -0.172 7.604 -19.113 1.00 . A A . 595 ASN C 1 1 1 1285 1 1 87 ASN CA C 0.351 6.305 -19.732 1.00 . A A . 595 ASN CA 1 1 1 1286 1 1 87 ASN CB C 1.746 6.547 -20.310 1.00 . A A . 595 ASN CB 1 1 1 1287 1 1 87 ASN CG C 1.729 7.808 -21.175 1.00 . A A . 595 ASN CG 1 1 1 1288 1 1 87 ASN H H -0.501 6.253 -21.713 1.00 . A A . 595 ASN H 1 1 1 1289 1 1 87 ASN HA H 0.408 5.542 -18.970 1.00 . A A . 595 ASN HA 1 1 1 1290 1 1 87 ASN HB2 H 2.453 6.672 -19.502 1.00 . A A . 595 ASN HB2 1 1 1 1291 1 1 87 ASN HB3 H 2.036 5.701 -20.915 1.00 . A A . 595 ASN HB3 1 1 1 1292 1 1 87 ASN HD21 H 3.706 7.993 -21.193 1.00 . A A . 595 ASN HD21 1 1 1 1293 1 1 87 ASN HD22 H 2.858 9.184 -22.056 1.00 . A A . 595 ASN HD22 1 1 1 1294 1 1 87 ASN N N -0.561 5.848 -20.822 1.00 . A A . 595 ASN N 1 1 1 1295 1 1 87 ASN ND2 N 2.858 8.376 -21.502 1.00 . A A . 595 ASN ND2 1 1 1 1296 1 1 87 ASN O O -1.071 8.235 -19.632 1.00 . A A . 595 ASN O 1 1 1 1297 1 1 87 ASN OD1 O 0.678 8.282 -21.558 1.00 . A A . 595 ASN OD1 1 1 1 1298 1 1 88 ARG C C 1.111 9.940 -16.639 1.00 . A A . 596 ARG C 1 1 1 1299 1 1 88 ARG CA C -0.070 9.264 -17.345 1.00 . A A . 596 ARG CA 1 1 1 1300 1 1 88 ARG CB C -1.154 8.933 -16.317 1.00 . A A . 596 ARG CB 1 1 1 1301 1 1 88 ARG CD C -3.462 9.522 -15.565 1.00 . A A . 596 ARG CD 1 1 1 1302 1 1 88 ARG CG C -2.465 9.609 -16.722 1.00 . A A . 596 ARG CG 1 1 1 1303 1 1 88 ARG CZ C -5.551 10.666 -16.007 1.00 . A A . 596 ARG CZ 1 1 1 1304 1 1 88 ARG H H 1.113 7.480 -17.600 1.00 . A A . 596 ARG H 1 1 1 1305 1 1 88 ARG HA H -0.473 9.932 -18.091 1.00 . A A . 596 ARG HA 1 1 1 1306 1 1 88 ARG HB2 H -1.298 7.862 -16.278 1.00 . A A . 596 ARG HB2 1 1 1 1307 1 1 88 ARG HB3 H -0.851 9.292 -15.346 1.00 . A A . 596 ARG HB3 1 1 1 1308 1 1 88 ARG HD2 H -3.313 8.596 -15.030 1.00 . A A . 596 ARG HD2 1 1 1 1309 1 1 88 ARG HD3 H -3.308 10.355 -14.894 1.00 . A A . 596 ARG HD3 1 1 1 1310 1 1 88 ARG HE H -5.240 8.775 -16.525 1.00 . A A . 596 ARG HE 1 1 1 1311 1 1 88 ARG HG2 H -2.277 10.646 -16.960 1.00 . A A . 596 ARG HG2 1 1 1 1312 1 1 88 ARG HG3 H -2.876 9.111 -17.587 1.00 . A A . 596 ARG HG3 1 1 1 1313 1 1 88 ARG HH11 H -4.672 11.543 -17.577 1.00 . A A . 596 ARG HH11 1 1 1 1314 1 1 88 ARG HH12 H -5.893 12.479 -16.783 1.00 . A A . 596 ARG HH12 1 1 1 1315 1 1 88 ARG HH21 H -6.594 10.045 -14.414 1.00 . A A . 596 ARG HH21 1 1 1 1316 1 1 88 ARG HH22 H -6.981 11.632 -14.992 1.00 . A A . 596 ARG HH22 1 1 1 1317 1 1 88 ARG N N 0.389 8.006 -18.002 1.00 . A A . 596 ARG N 1 1 1 1318 1 1 88 ARG NE N -4.852 9.568 -16.101 1.00 . A A . 596 ARG NE 1 1 1 1319 1 1 88 ARG NH1 N -5.357 11.638 -16.855 1.00 . A A . 596 ARG NH1 1 1 1 1320 1 1 88 ARG NH2 N -6.445 10.791 -15.064 1.00 . A A . 596 ARG NH2 1 1 1 1321 1 1 88 ARG O O 2.257 9.597 -16.853 1.00 . A A . 596 ARG O 1 1 1 1322 1 1 89 GLU C C 1.343 12.295 -13.837 1.00 . A A . 597 GLU C 1 1 1 1323 1 1 89 GLU CA C 1.930 11.609 -15.070 1.00 . A A . 597 GLU CA 1 1 1 1324 1 1 89 GLU CB C 2.558 12.659 -15.990 1.00 . A A . 597 GLU CB 1 1 1 1325 1 1 89 GLU CD C 2.017 14.716 -17.301 1.00 . A A . 597 GLU CD 1 1 1 1326 1 1 89 GLU CG C 1.454 13.412 -16.734 1.00 . A A . 597 GLU CG 1 1 1 1327 1 1 89 GLU H H -0.098 11.158 -15.643 1.00 . A A . 597 GLU H 1 1 1 1328 1 1 89 GLU HA H 2.685 10.899 -14.761 1.00 . A A . 597 GLU HA 1 1 1 1329 1 1 89 GLU HB2 H 3.135 13.356 -15.399 1.00 . A A . 597 GLU HB2 1 1 1 1330 1 1 89 GLU HB3 H 3.204 12.171 -16.705 1.00 . A A . 597 GLU HB3 1 1 1 1331 1 1 89 GLU HG2 H 1.082 12.798 -17.542 1.00 . A A . 597 GLU HG2 1 1 1 1332 1 1 89 GLU HG3 H 0.648 13.636 -16.052 1.00 . A A . 597 GLU HG3 1 1 1 1333 1 1 89 GLU N N 0.835 10.901 -15.798 1.00 . A A . 597 GLU N 1 1 1 1334 1 1 89 GLU O O 0.940 13.440 -13.882 1.00 . A A . 597 GLU O 1 1 1 1335 1 1 89 GLU OE1 O 3.227 14.868 -17.295 1.00 . A A . 597 GLU OE1 1 1 1 1336 1 1 89 GLU OE2 O 1.228 15.542 -17.730 1.00 . A A . 597 GLU OE2 1 1 1 1337 1 1 90 TYR C C 1.624 13.296 -10.987 1.00 . A A . 598 TYR C 1 1 1 1338 1 1 90 TYR CA C 0.717 12.186 -11.507 1.00 . A A . 598 TYR CA 1 1 1 1339 1 1 90 TYR CB C 0.615 11.089 -10.457 1.00 . A A . 598 TYR CB 1 1 1 1340 1 1 90 TYR CD1 C -0.427 12.469 -8.646 1.00 . A A . 598 TYR CD1 1 1 1 1341 1 1 90 TYR CD2 C -1.670 10.604 -9.567 1.00 . A A . 598 TYR CD2 1 1 1 1342 1 1 90 TYR CE1 C -1.482 12.757 -7.784 1.00 . A A . 598 TYR CE1 1 1 1 1343 1 1 90 TYR CE2 C -2.734 10.890 -8.704 1.00 . A A . 598 TYR CE2 1 1 1 1344 1 1 90 TYR CG C -0.522 11.394 -9.533 1.00 . A A . 598 TYR CG 1 1 1 1345 1 1 90 TYR CZ C -2.637 11.968 -7.810 1.00 . A A . 598 TYR CZ 1 1 1 1346 1 1 90 TYR H H 1.601 10.679 -12.715 1.00 . A A . 598 TYR H 1 1 1 1347 1 1 90 TYR HA H -0.266 12.582 -11.710 1.00 . A A . 598 TYR HA 1 1 1 1348 1 1 90 TYR HB2 H 0.438 10.141 -10.944 1.00 . A A . 598 TYR HB2 1 1 1 1349 1 1 90 TYR HB3 H 1.535 11.040 -9.894 1.00 . A A . 598 TYR HB3 1 1 1 1350 1 1 90 TYR HD1 H 0.461 13.078 -8.632 1.00 . A A . 598 TYR HD1 1 1 1 1351 1 1 90 TYR HD2 H -1.731 9.769 -10.257 1.00 . A A . 598 TYR HD2 1 1 1 1352 1 1 90 TYR HE1 H -1.403 13.587 -7.094 1.00 . A A . 598 TYR HE1 1 1 1 1353 1 1 90 TYR HE2 H -3.627 10.284 -8.731 1.00 . A A . 598 TYR HE2 1 1 1 1354 1 1 90 TYR HH H -3.349 12.188 -6.057 1.00 . A A . 598 TYR HH 1 1 1 1355 1 1 90 TYR N N 1.283 11.598 -12.736 1.00 . A A . 598 TYR N 1 1 1 1356 1 1 90 TYR O O 2.613 13.044 -10.331 1.00 . A A . 598 TYR O 1 1 1 1357 1 1 90 TYR OH O -3.677 12.255 -6.956 1.00 . A A . 598 TYR OH 1 1 1 1358 1 1 91 THR C C 1.643 15.955 -9.321 1.00 . A A . 599 THR C 1 1 1 1359 1 1 91 THR CA C 2.115 15.641 -10.737 1.00 . A A . 599 THR CA 1 1 1 1360 1 1 91 THR CB C 1.940 16.872 -11.631 1.00 . A A . 599 THR CB 1 1 1 1361 1 1 91 THR CG2 C 3.282 17.235 -12.270 1.00 . A A . 599 THR CG2 1 1 1 1362 1 1 91 THR H H 0.471 14.710 -11.765 1.00 . A A . 599 THR H 1 1 1 1363 1 1 91 THR HA H 3.151 15.345 -10.716 1.00 . A A . 599 THR HA 1 1 1 1364 1 1 91 THR HB H 1.592 17.703 -11.039 1.00 . A A . 599 THR HB 1 1 1 1365 1 1 91 THR HG1 H 0.254 17.189 -12.547 1.00 . A A . 599 THR HG1 1 1 1 1366 1 1 91 THR HG21 H 4.025 17.364 -11.497 1.00 . A A . 599 THR HG21 1 1 1 1367 1 1 91 THR HG22 H 3.589 16.443 -12.937 1.00 . A A . 599 THR HG22 1 1 1 1368 1 1 91 THR HG23 H 3.178 18.155 -12.826 1.00 . A A . 599 THR HG23 1 1 1 1369 1 1 91 THR N N 1.283 14.524 -11.250 1.00 . A A . 599 THR N 1 1 1 1370 1 1 91 THR O O 1.038 16.978 -9.069 1.00 . A A . 599 THR O 1 1 1 1371 1 1 91 THR OG1 O 0.991 16.584 -12.649 1.00 . A A . 599 THR OG1 1 1 1 1372 1 1 92 VAL C C 2.043 16.615 -6.496 1.00 . A A . 600 VAL C 1 1 1 1373 1 1 92 VAL CA C 1.418 15.315 -7.007 1.00 . A A . 600 VAL CA 1 1 1 1374 1 1 92 VAL CB C 1.823 14.176 -6.062 1.00 . A A . 600 VAL CB 1 1 1 1375 1 1 92 VAL CG1 C 0.746 14.024 -5.014 1.00 . A A . 600 VAL CG1 1 1 1 1376 1 1 92 VAL CG2 C 1.960 12.832 -6.779 1.00 . A A . 600 VAL CG2 1 1 1 1377 1 1 92 VAL H H 2.360 14.241 -8.617 1.00 . A A . 600 VAL H 1 1 1 1378 1 1 92 VAL HA H 0.343 15.411 -7.011 1.00 . A A . 600 VAL HA 1 1 1 1379 1 1 92 VAL HB H 2.754 14.426 -5.581 1.00 . A A . 600 VAL HB 1 1 1 1380 1 1 92 VAL HG11 H -0.140 14.550 -5.336 1.00 . A A . 600 VAL HG11 1 1 1 1381 1 1 92 VAL HG12 H 0.523 12.976 -4.907 1.00 . A A . 600 VAL HG12 1 1 1 1382 1 1 92 VAL HG13 H 1.091 14.423 -4.074 1.00 . A A . 600 VAL HG13 1 1 1 1383 1 1 92 VAL HG21 H 2.327 12.980 -7.780 1.00 . A A . 600 VAL HG21 1 1 1 1384 1 1 92 VAL HG22 H 2.653 12.209 -6.229 1.00 . A A . 600 VAL HG22 1 1 1 1385 1 1 92 VAL HG23 H 0.996 12.343 -6.805 1.00 . A A . 600 VAL HG23 1 1 1 1386 1 1 92 VAL N N 1.888 15.067 -8.394 1.00 . A A . 600 VAL N 1 1 1 1387 1 1 92 VAL O O 3.246 16.786 -6.557 1.00 . A A . 600 VAL O 1 1 1 1388 1 1 93 PRO C C 2.229 18.617 -4.060 1.00 . A A . 601 PRO C 1 1 1 1389 1 1 93 PRO CA C 1.644 18.791 -5.465 1.00 . A A . 601 PRO CA 1 1 1 1390 1 1 93 PRO CB C 0.352 19.613 -5.421 1.00 . A A . 601 PRO CB 1 1 1 1391 1 1 93 PRO CD C -0.251 17.267 -5.934 1.00 . A A . 601 PRO CD 1 1 1 1392 1 1 93 PRO CG C -0.812 18.594 -5.388 1.00 . A A . 601 PRO CG 1 1 1 1393 1 1 93 PRO HA H 2.358 19.258 -6.123 1.00 . A A . 601 PRO HA 1 1 1 1394 1 1 93 PRO HB2 H 0.337 20.229 -4.532 1.00 . A A . 601 PRO HB2 1 1 1 1395 1 1 93 PRO HB3 H 0.273 20.228 -6.302 1.00 . A A . 601 PRO HB3 1 1 1 1396 1 1 93 PRO HD2 H -0.481 16.454 -5.259 1.00 . A A . 601 PRO HD2 1 1 1 1397 1 1 93 PRO HD3 H -0.643 17.066 -6.919 1.00 . A A . 601 PRO HD3 1 1 1 1398 1 1 93 PRO HG2 H -1.159 18.463 -4.372 1.00 . A A . 601 PRO HG2 1 1 1 1399 1 1 93 PRO HG3 H -1.620 18.934 -6.017 1.00 . A A . 601 PRO HG3 1 1 1 1400 1 1 93 PRO N N 1.207 17.491 -6.002 1.00 . A A . 601 PRO N 1 1 1 1401 1 1 93 PRO O O 2.030 17.606 -3.416 1.00 . A A . 601 PRO O 1 1 1 1402 1 1 94 GLN C C 2.557 20.032 -1.185 1.00 . A A . 602 GLN C 1 1 1 1403 1 1 94 GLN CA C 3.542 19.482 -2.218 1.00 . A A . 602 GLN CA 1 1 1 1404 1 1 94 GLN CB C 4.842 20.286 -2.160 1.00 . A A . 602 GLN CB 1 1 1 1405 1 1 94 GLN CD C 6.402 21.108 -0.389 1.00 . A A . 602 GLN CD 1 1 1 1406 1 1 94 GLN CG C 5.629 19.894 -0.907 1.00 . A A . 602 GLN CG 1 1 1 1407 1 1 94 GLN H H 3.096 20.402 -4.114 1.00 . A A . 602 GLN H 1 1 1 1408 1 1 94 GLN HA H 3.750 18.445 -2.001 1.00 . A A . 602 GLN HA 1 1 1 1409 1 1 94 GLN HB2 H 5.435 20.076 -3.039 1.00 . A A . 602 GLN HB2 1 1 1 1410 1 1 94 GLN HB3 H 4.613 21.341 -2.124 1.00 . A A . 602 GLN HB3 1 1 1 1411 1 1 94 GLN HE21 H 6.980 21.691 -2.196 1.00 . A A . 602 GLN HE21 1 1 1 1412 1 1 94 GLN HE22 H 7.514 22.666 -0.914 1.00 . A A . 602 GLN HE22 1 1 1 1413 1 1 94 GLN HG2 H 4.944 19.551 -0.146 1.00 . A A . 602 GLN HG2 1 1 1 1414 1 1 94 GLN HG3 H 6.323 19.105 -1.150 1.00 . A A . 602 GLN HG3 1 1 1 1415 1 1 94 GLN N N 2.947 19.595 -3.580 1.00 . A A . 602 GLN N 1 1 1 1416 1 1 94 GLN NE2 N 7.016 21.887 -1.237 1.00 . A A . 602 GLN NE2 1 1 1 1417 1 1 94 GLN O O 2.702 19.816 0.001 1.00 . A A . 602 GLN O 1 1 1 1418 1 1 94 GLN OE1 O 6.447 21.351 0.801 1.00 . A A . 602 GLN OE1 1 1 1 1419 1 1 95 ALA C C -0.098 20.165 0.109 1.00 . A A . 603 ALA C 1 1 1 1420 1 1 95 ALA CA C 0.562 21.305 -0.670 1.00 . A A . 603 ALA CA 1 1 1 1421 1 1 95 ALA CB C -0.508 22.081 -1.441 1.00 . A A . 603 ALA CB 1 1 1 1422 1 1 95 ALA H H 1.455 20.905 -2.588 1.00 . A A . 603 ALA H 1 1 1 1423 1 1 95 ALA HA H 1.062 21.969 0.019 1.00 . A A . 603 ALA HA 1 1 1 1424 1 1 95 ALA HB1 H -0.085 22.459 -2.360 1.00 . A A . 603 ALA HB1 1 1 1 1425 1 1 95 ALA HB2 H -1.335 21.425 -1.668 1.00 . A A . 603 ALA HB2 1 1 1 1426 1 1 95 ALA HB3 H -0.858 22.907 -0.839 1.00 . A A . 603 ALA HB3 1 1 1 1427 1 1 95 ALA N N 1.555 20.742 -1.627 1.00 . A A . 603 ALA N 1 1 1 1428 1 1 95 ALA O O 0.304 19.022 0.014 1.00 . A A . 603 ALA O 1 1 1 1429 1 1 96 CYS C C -3.299 19.487 1.443 1.00 . A A . 604 CYS C 1 1 1 1430 1 1 96 CYS CA C -1.788 19.400 1.667 1.00 . A A . 604 CYS CA 1 1 1 1431 1 1 96 CYS CB C -1.482 19.590 3.154 1.00 . A A . 604 CYS CB 1 1 1 1432 1 1 96 CYS H H -1.413 21.394 0.945 1.00 . A A . 604 CYS H 1 1 1 1433 1 1 96 CYS HA H -1.431 18.432 1.347 1.00 . A A . 604 CYS HA 1 1 1 1434 1 1 96 CYS HB2 H -2.234 19.087 3.744 1.00 . A A . 604 CYS HB2 1 1 1 1435 1 1 96 CYS HB3 H -0.510 19.175 3.378 1.00 . A A . 604 CYS HB3 1 1 1 1436 1 1 96 CYS N N -1.105 20.466 0.881 1.00 . A A . 604 CYS N 1 1 1 1437 1 1 96 CYS O O -3.777 20.305 0.682 1.00 . A A . 604 CYS O 1 1 1 1438 1 1 96 CYS SG S -1.489 21.358 3.547 1.00 . A A . 604 CYS SG 1 1 1 1439 1 1 97 GLY C C -5.957 17.636 0.899 1.00 . A A . 605 GLY C 1 1 1 1440 1 1 97 GLY CA C -5.534 18.688 1.926 1.00 . A A . 605 GLY CA 1 1 1 1441 1 1 97 GLY H H -3.649 18.000 2.710 1.00 . A A . 605 GLY H 1 1 1 1442 1 1 97 GLY HA2 H -6.012 18.482 2.873 1.00 . A A . 605 GLY HA2 1 1 1 1443 1 1 97 GLY HA3 H -5.831 19.665 1.578 1.00 . A A . 605 GLY HA3 1 1 1 1444 1 1 97 GLY N N -4.054 18.651 2.101 1.00 . A A . 605 GLY N 1 1 1 1445 1 1 97 GLY O O -7.108 17.255 0.827 1.00 . A A . 605 GLY O 1 1 1 1446 1 1 98 THR C C -4.135 15.369 -1.331 1.00 . A A . 606 THR C 1 1 1 1447 1 1 98 THR CA C -5.392 16.137 -0.917 1.00 . A A . 606 THR CA 1 1 1 1448 1 1 98 THR CB C -5.998 16.826 -2.143 1.00 . A A . 606 THR CB 1 1 1 1449 1 1 98 THR CG2 C -7.512 16.613 -2.154 1.00 . A A . 606 THR CG2 1 1 1 1450 1 1 98 THR H H -4.114 17.484 0.176 1.00 . A A . 606 THR H 1 1 1 1451 1 1 98 THR HA H -6.112 15.449 -0.499 1.00 . A A . 606 THR HA 1 1 1 1452 1 1 98 THR HB H -5.573 16.404 -3.040 1.00 . A A . 606 THR HB 1 1 1 1453 1 1 98 THR HG1 H -6.461 18.657 -1.680 1.00 . A A . 606 THR HG1 1 1 1 1454 1 1 98 THR HG21 H -7.766 15.795 -1.495 1.00 . A A . 606 THR HG21 1 1 1 1455 1 1 98 THR HG22 H -8.005 17.513 -1.817 1.00 . A A . 606 THR HG22 1 1 1 1456 1 1 98 THR HG23 H -7.835 16.380 -3.158 1.00 . A A . 606 THR HG23 1 1 1 1457 1 1 98 THR N N -5.037 17.163 0.104 1.00 . A A . 606 THR N 1 1 1 1458 1 1 98 THR O O -3.712 15.418 -2.469 1.00 . A A . 606 THR O 1 1 1 1459 1 1 98 THR OG1 O -5.713 18.217 -2.090 1.00 . A A . 606 THR OG1 1 1 1 1460 1 1 99 SER C C -2.702 12.479 -1.216 1.00 . A A . 607 SER C 1 1 1 1461 1 1 99 SER CA C -2.307 13.885 -0.759 1.00 . A A . 607 SER CA 1 1 1 1462 1 1 99 SER CB C -1.407 13.786 0.473 1.00 . A A . 607 SER CB 1 1 1 1463 1 1 99 SER H H -3.892 14.629 0.496 1.00 . A A . 607 SER H 1 1 1 1464 1 1 99 SER HA H -1.776 14.387 -1.555 1.00 . A A . 607 SER HA 1 1 1 1465 1 1 99 SER HB2 H -1.700 12.938 1.069 1.00 . A A . 607 SER HB2 1 1 1 1466 1 1 99 SER HB3 H -0.379 13.663 0.157 1.00 . A A . 607 SER HB3 1 1 1 1467 1 1 99 SER HG H -0.803 15.549 1.036 1.00 . A A . 607 SER HG 1 1 1 1468 1 1 99 SER N N -3.535 14.657 -0.416 1.00 . A A . 607 SER N 1 1 1 1469 1 1 99 SER O O -1.951 11.538 -1.076 1.00 . A A . 607 SER O 1 1 1 1470 1 1 99 SER OG O -1.540 14.971 1.247 1.00 . A A . 607 SER OG 1 1 1 1471 1 1 100 THR C C -5.470 11.171 -3.219 1.00 . A A . 608 THR C 1 1 1 1472 1 1 100 THR CA C -4.334 10.988 -2.219 1.00 . A A . 608 THR CA 1 1 1 1473 1 1 100 THR CB C -4.851 10.175 -1.022 1.00 . A A . 608 THR CB 1 1 1 1474 1 1 100 THR CG2 C -4.010 10.472 0.222 1.00 . A A . 608 THR CG2 1 1 1 1475 1 1 100 THR H H -4.472 13.107 -1.853 1.00 . A A . 608 THR H 1 1 1 1476 1 1 100 THR HA H -3.515 10.463 -2.701 1.00 . A A . 608 THR HA 1 1 1 1477 1 1 100 THR HB H -4.793 9.123 -1.245 1.00 . A A . 608 THR HB 1 1 1 1478 1 1 100 THR HG1 H -6.525 9.973 -0.052 1.00 . A A . 608 THR HG1 1 1 1 1479 1 1 100 THR HG21 H -3.986 11.537 0.395 1.00 . A A . 608 THR HG21 1 1 1 1480 1 1 100 THR HG22 H -4.449 9.979 1.077 1.00 . A A . 608 THR HG22 1 1 1 1481 1 1 100 THR HG23 H -3.005 10.106 0.074 1.00 . A A . 608 THR HG23 1 1 1 1482 1 1 100 THR N N -3.880 12.331 -1.755 1.00 . A A . 608 THR N 1 1 1 1483 1 1 100 THR O O -6.466 11.805 -2.930 1.00 . A A . 608 THR O 1 1 1 1484 1 1 100 THR OG1 O -6.204 10.526 -0.768 1.00 . A A . 608 THR OG1 1 1 1 1485 1 1 101 ALA C C -6.720 9.452 -6.087 1.00 . A A . 609 ALA C 1 1 1 1486 1 1 101 ALA CA C -6.431 10.786 -5.398 1.00 . A A . 609 ALA CA 1 1 1 1487 1 1 101 ALA CB C -6.027 11.825 -6.442 1.00 . A A . 609 ALA CB 1 1 1 1488 1 1 101 ALA H H -4.515 10.112 -4.608 1.00 . A A . 609 ALA H 1 1 1 1489 1 1 101 ALA HA H -7.325 11.122 -4.893 1.00 . A A . 609 ALA HA 1 1 1 1490 1 1 101 ALA HB1 H -5.422 12.587 -5.975 1.00 . A A . 609 ALA HB1 1 1 1 1491 1 1 101 ALA HB2 H -5.463 11.345 -7.228 1.00 . A A . 609 ALA HB2 1 1 1 1492 1 1 101 ALA HB3 H -6.914 12.277 -6.861 1.00 . A A . 609 ALA HB3 1 1 1 1493 1 1 101 ALA N N -5.335 10.625 -4.392 1.00 . A A . 609 ALA N 1 1 1 1494 1 1 101 ALA O O -6.608 8.402 -5.492 1.00 . A A . 609 ALA O 1 1 1 1495 1 1 102 THR C C -6.500 8.069 -9.257 1.00 . A A . 610 THR C 1 1 1 1496 1 1 102 THR CA C -7.418 8.223 -8.061 1.00 . A A . 610 THR CA 1 1 1 1497 1 1 102 THR CB C -8.876 8.240 -8.528 1.00 . A A . 610 THR CB 1 1 1 1498 1 1 102 THR CG2 C -9.804 8.161 -7.315 1.00 . A A . 610 THR CG2 1 1 1 1499 1 1 102 THR H H -7.203 10.349 -7.794 1.00 . A A . 610 THR H 1 1 1 1500 1 1 102 THR HA H -7.258 7.376 -7.409 1.00 . A A . 610 THR HA 1 1 1 1501 1 1 102 THR HB H -9.058 7.392 -9.171 1.00 . A A . 610 THR HB 1 1 1 1502 1 1 102 THR HG1 H -9.856 9.280 -9.848 1.00 . A A . 610 THR HG1 1 1 1 1503 1 1 102 THR HG21 H -9.215 8.030 -6.419 1.00 . A A . 610 THR HG21 1 1 1 1504 1 1 102 THR HG22 H -10.376 9.073 -7.240 1.00 . A A . 610 THR HG22 1 1 1 1505 1 1 102 THR HG23 H -10.476 7.323 -7.430 1.00 . A A . 610 THR HG23 1 1 1 1506 1 1 102 THR N N -7.108 9.488 -7.336 1.00 . A A . 610 THR N 1 1 1 1507 1 1 102 THR O O -5.741 8.951 -9.606 1.00 . A A . 610 THR O 1 1 1 1508 1 1 102 THR OG1 O -9.128 9.441 -9.243 1.00 . A A . 610 THR OG1 1 1 1 1509 1 1 103 VAL C C -6.308 5.463 -11.776 1.00 . A A . 611 VAL C 1 1 1 1510 1 1 103 VAL CA C -5.668 6.635 -11.013 1.00 . A A . 611 VAL CA 1 1 1 1511 1 1 103 VAL CB C -4.305 6.214 -10.454 1.00 . A A . 611 VAL CB 1 1 1 1512 1 1 103 VAL CG1 C -3.170 6.673 -11.359 1.00 . A A . 611 VAL CG1 1 1 1 1513 1 1 103 VAL CG2 C -4.066 6.844 -9.098 1.00 . A A . 611 VAL CG2 1 1 1 1514 1 1 103 VAL H H -7.156 6.230 -9.533 1.00 . A A . 611 VAL H 1 1 1 1515 1 1 103 VAL HA H -5.571 7.502 -11.649 1.00 . A A . 611 VAL HA 1 1 1 1516 1 1 103 VAL HB H -4.299 5.149 -10.347 1.00 . A A . 611 VAL HB 1 1 1 1517 1 1 103 VAL HG11 H -3.564 7.297 -12.146 1.00 . A A . 611 VAL HG11 1 1 1 1518 1 1 103 VAL HG12 H -2.464 7.248 -10.754 1.00 . A A . 611 VAL HG12 1 1 1 1519 1 1 103 VAL HG13 H -2.668 5.820 -11.785 1.00 . A A . 611 VAL HG13 1 1 1 1520 1 1 103 VAL HG21 H -4.921 6.675 -8.464 1.00 . A A . 611 VAL HG21 1 1 1 1521 1 1 103 VAL HG22 H -3.182 6.400 -8.646 1.00 . A A . 611 VAL HG22 1 1 1 1522 1 1 103 VAL HG23 H -3.909 7.905 -9.235 1.00 . A A . 611 VAL HG23 1 1 1 1523 1 1 103 VAL N N -6.548 6.923 -9.861 1.00 . A A . 611 VAL N 1 1 1 1524 1 1 103 VAL O O -5.926 4.319 -11.614 1.00 . A A . 611 VAL O 1 1 1 1525 1 1 104 THR C C -7.389 4.234 -14.597 1.00 . A A . 612 THR C 1 1 1 1526 1 1 104 THR CA C -8.024 4.625 -13.279 1.00 . A A . 612 THR CA 1 1 1 1527 1 1 104 THR CB C -9.464 5.025 -13.566 1.00 . A A . 612 THR CB 1 1 1 1528 1 1 104 THR CG2 C -10.375 4.403 -12.528 1.00 . A A . 612 THR CG2 1 1 1 1529 1 1 104 THR H H -7.641 6.652 -12.644 1.00 . A A . 612 THR H 1 1 1 1530 1 1 104 THR HA H -8.040 3.758 -12.637 1.00 . A A . 612 THR HA 1 1 1 1531 1 1 104 THR HB H -9.739 4.643 -14.538 1.00 . A A . 612 THR HB 1 1 1 1532 1 1 104 THR HG1 H -10.498 6.663 -13.400 1.00 . A A . 612 THR HG1 1 1 1 1533 1 1 104 THR HG21 H -9.959 4.555 -11.545 1.00 . A A . 612 THR HG21 1 1 1 1534 1 1 104 THR HG22 H -11.352 4.854 -12.588 1.00 . A A . 612 THR HG22 1 1 1 1535 1 1 104 THR HG23 H -10.450 3.343 -12.731 1.00 . A A . 612 THR HG23 1 1 1 1536 1 1 104 THR N N -7.319 5.731 -12.560 1.00 . A A . 612 THR N 1 1 1 1537 1 1 104 THR O O -6.904 5.050 -15.356 1.00 . A A . 612 THR O 1 1 1 1538 1 1 104 THR OG1 O -9.583 6.440 -13.588 1.00 . A A . 612 THR OG1 1 1 1 1539 1 1 105 ASP C C -7.570 1.070 -16.415 1.00 . A A . 613 ASP C 1 1 1 1540 1 1 105 ASP CA C -6.951 2.451 -16.169 1.00 . A A . 613 ASP CA 1 1 1 1541 1 1 105 ASP CB C -5.425 2.352 -16.131 1.00 . A A . 613 ASP CB 1 1 1 1542 1 1 105 ASP CG C -4.816 3.692 -16.544 1.00 . A A . 613 ASP CG 1 1 1 1543 1 1 105 ASP H H -7.903 2.350 -14.266 1.00 . A A . 613 ASP H 1 1 1 1544 1 1 105 ASP HA H -7.262 3.126 -16.945 1.00 . A A . 613 ASP HA 1 1 1 1545 1 1 105 ASP HB2 H -5.106 2.103 -15.130 1.00 . A A . 613 ASP HB2 1 1 1 1546 1 1 105 ASP HB3 H -5.097 1.584 -16.816 1.00 . A A . 613 ASP HB3 1 1 1 1547 1 1 105 ASP N N -7.463 2.965 -14.888 1.00 . A A . 613 ASP N 1 1 1 1548 1 1 105 ASP O O -8.271 0.541 -15.575 1.00 . A A . 613 ASP O 1 1 1 1549 1 1 105 ASP OD1 O -5.112 4.143 -17.639 1.00 . A A . 613 ASP OD1 1 1 1 1550 1 1 105 ASP OD2 O -4.064 4.246 -15.759 1.00 . A A . 613 ASP OD2 1 1 1 1551 1 1 106 THR C C -7.177 -1.562 -18.932 1.00 . A A . 614 THR C 1 1 1 1552 1 1 106 THR CA C -7.919 -0.872 -17.797 1.00 . A A . 614 THR CA 1 1 1 1553 1 1 106 THR CB C -9.406 -0.744 -18.129 1.00 . A A . 614 THR CB 1 1 1 1554 1 1 106 THR CG2 C -9.727 0.698 -18.518 1.00 . A A . 614 THR CG2 1 1 1 1555 1 1 106 THR H H -6.767 0.903 -18.224 1.00 . A A . 614 THR H 1 1 1 1556 1 1 106 THR HA H -7.806 -1.474 -16.906 1.00 . A A . 614 THR HA 1 1 1 1557 1 1 106 THR HB H -9.985 -1.014 -17.258 1.00 . A A . 614 THR HB 1 1 1 1558 1 1 106 THR HG1 H -10.681 -1.737 -19.211 1.00 . A A . 614 THR HG1 1 1 1 1559 1 1 106 THR HG21 H -9.050 1.021 -19.294 1.00 . A A . 614 THR HG21 1 1 1 1560 1 1 106 THR HG22 H -10.743 0.756 -18.878 1.00 . A A . 614 THR HG22 1 1 1 1561 1 1 106 THR HG23 H -9.615 1.336 -17.653 1.00 . A A . 614 THR HG23 1 1 1 1562 1 1 106 THR N N -7.331 0.474 -17.547 1.00 . A A . 614 THR N 1 1 1 1563 1 1 106 THR O O -6.653 -0.930 -19.828 1.00 . A A . 614 THR O 1 1 1 1564 1 1 106 THR OG1 O -9.729 -1.614 -19.205 1.00 . A A . 614 THR OG1 1 1 1 1565 1 1 107 TRP C C -7.210 -3.811 -21.168 1.00 . A A . 615 TRP C 1 1 1 1566 1 1 107 TRP CA C -6.363 -3.610 -19.920 1.00 . A A . 615 TRP CA 1 1 1 1567 1 1 107 TRP CB C -5.916 -4.958 -19.357 1.00 . A A . 615 TRP CB 1 1 1 1568 1 1 107 TRP CD1 C -3.567 -5.867 -19.308 1.00 . A A . 615 TRP CD1 1 1 1 1569 1 1 107 TRP CD2 C -3.692 -3.690 -18.840 1.00 . A A . 615 TRP CD2 1 1 1 1570 1 1 107 TRP CE2 C -2.325 -4.017 -18.808 1.00 . A A . 615 TRP CE2 1 1 1 1571 1 1 107 TRP CE3 C -4.072 -2.376 -18.571 1.00 . A A . 615 TRP CE3 1 1 1 1572 1 1 107 TRP CG C -4.449 -4.867 -19.174 1.00 . A A . 615 TRP CG 1 1 1 1573 1 1 107 TRP CH2 C -1.768 -1.743 -18.251 1.00 . A A . 615 TRP CH2 1 1 1 1574 1 1 107 TRP CZ2 C -1.360 -3.055 -18.519 1.00 . A A . 615 TRP CZ2 1 1 1 1575 1 1 107 TRP CZ3 C -3.119 -1.412 -18.276 1.00 . A A . 615 TRP CZ3 1 1 1 1576 1 1 107 TRP H H -7.508 -3.338 -18.129 1.00 . A A . 615 TRP H 1 1 1 1577 1 1 107 TRP HA H -5.486 -3.044 -20.194 1.00 . A A . 615 TRP HA 1 1 1 1578 1 1 107 TRP HB2 H -6.400 -5.142 -18.408 1.00 . A A . 615 TRP HB2 1 1 1 1579 1 1 107 TRP HB3 H -6.150 -5.747 -20.054 1.00 . A A . 615 TRP HB3 1 1 1 1580 1 1 107 TRP HD1 H -3.814 -6.880 -19.543 1.00 . A A . 615 TRP HD1 1 1 1 1581 1 1 107 TRP HE1 H -1.460 -5.876 -19.174 1.00 . A A . 615 TRP HE1 1 1 1 1582 1 1 107 TRP HE3 H -5.112 -2.114 -18.580 1.00 . A A . 615 TRP HE3 1 1 1 1583 1 1 107 TRP HH2 H -1.046 -0.987 -18.018 1.00 . A A . 615 TRP HH2 1 1 1 1584 1 1 107 TRP HZ2 H -0.312 -3.319 -18.504 1.00 . A A . 615 TRP HZ2 1 1 1 1585 1 1 107 TRP HZ3 H -3.428 -0.406 -18.063 1.00 . A A . 615 TRP HZ3 1 1 1 1586 1 1 107 TRP N N -7.101 -2.860 -18.876 1.00 . A A . 615 TRP N 1 1 1 1587 1 1 107 TRP NE1 N -2.291 -5.362 -19.113 1.00 . A A . 615 TRP NE1 1 1 1 1588 1 1 107 TRP O O -8.416 -3.949 -21.110 1.00 . A A . 615 TRP O 1 1 1 1589 1 1 108 ARG C C -6.381 -4.637 -24.622 1.00 . A A . 616 ARG C 1 1 1 1590 1 1 108 ARG CA C -7.309 -4.005 -23.582 1.00 . A A . 616 ARG CA 1 1 1 1591 1 1 108 ARG CB C -7.793 -2.645 -24.089 1.00 . A A . 616 ARG CB 1 1 1 1592 1 1 108 ARG CD C -9.700 -1.412 -25.129 1.00 . A A . 616 ARG CD 1 1 1 1593 1 1 108 ARG CG C -9.229 -2.768 -24.600 1.00 . A A . 616 ARG CG 1 1 1 1594 1 1 108 ARG CZ C -10.535 -0.628 -27.264 1.00 . A A . 616 ARG CZ 1 1 1 1595 1 1 108 ARG H H -5.587 -3.702 -22.311 1.00 . A A . 616 ARG H 1 1 1 1596 1 1 108 ARG HA H -8.158 -4.652 -23.417 1.00 . A A . 616 ARG HA 1 1 1 1597 1 1 108 ARG HB2 H -7.757 -1.928 -23.281 1.00 . A A . 616 ARG HB2 1 1 1 1598 1 1 108 ARG HB3 H -7.154 -2.312 -24.893 1.00 . A A . 616 ARG HB3 1 1 1 1599 1 1 108 ARG HD2 H -10.682 -1.194 -24.736 1.00 . A A . 616 ARG HD2 1 1 1 1600 1 1 108 ARG HD3 H -9.008 -0.644 -24.817 1.00 . A A . 616 ARG HD3 1 1 1 1601 1 1 108 ARG HE H -9.213 -2.102 -27.111 1.00 . A A . 616 ARG HE 1 1 1 1602 1 1 108 ARG HG2 H -9.266 -3.499 -25.395 1.00 . A A . 616 ARG HG2 1 1 1 1603 1 1 108 ARG HG3 H -9.873 -3.081 -23.792 1.00 . A A . 616 ARG HG3 1 1 1 1604 1 1 108 ARG HH11 H -10.502 0.768 -25.829 1.00 . A A . 616 ARG HH11 1 1 1 1605 1 1 108 ARG HH12 H -11.447 1.154 -27.227 1.00 . A A . 616 ARG HH12 1 1 1 1606 1 1 108 ARG HH21 H -10.748 -1.830 -28.850 1.00 . A A . 616 ARG HH21 1 1 1 1607 1 1 108 ARG HH22 H -11.587 -0.318 -28.938 1.00 . A A . 616 ARG HH22 1 1 1 1608 1 1 108 ARG N N -6.568 -3.820 -22.304 1.00 . A A . 616 ARG N 1 1 1 1609 1 1 108 ARG NE N -9.758 -1.454 -26.617 1.00 . A A . 616 ARG NE 1 1 1 1610 1 1 108 ARG NH1 N -10.853 0.521 -26.732 1.00 . A A . 616 ARG NH1 1 1 1 1611 1 1 108 ARG NH2 N -10.992 -0.950 -28.442 1.00 . A A . 616 ARG NH2 1 1 1 1612 1 1 108 ARG O O -5.879 -5.717 -24.360 1.00 . A A . 616 ARG O 1 1 1 1613 1 1 108 ARG OXT O -6.189 -4.029 -25.662 1.00 . A A . 616 ARG OXT 1 1 1 1614 2 2 1 GLC C1 C 12.186 -1.320 -20.917 1.00 . B A . 1 GLC C1 1 1 1 1615 2 2 1 GLC C2 C 12.106 -0.816 -19.471 1.00 . B A . 1 GLC C2 1 1 1 1616 2 2 1 GLC C3 C 10.956 -1.441 -18.665 1.00 . B A . 1 GLC C3 1 1 1 1617 2 2 1 GLC C4 C 10.939 -2.965 -18.763 1.00 . B A . 1 GLC C4 1 1 1 1618 2 2 1 GLC C5 C 11.711 -3.496 -19.963 1.00 . B A . 1 GLC C5 1 1 1 1619 2 2 1 GLC C6 C 11.182 -4.848 -20.400 1.00 . B A . 1 GLC C6 1 1 1 1620 2 2 1 GLC H1 H 11.596 -0.692 -21.595 1.00 . B A . 1 GLC H1 1 1 1 1621 2 2 1 GLC H2 H 11.965 0.274 -19.514 1.00 . B A . 1 GLC H2 1 1 1 1622 2 2 1 GLC H3 H 11.016 -1.222 -17.590 1.00 . B A . 1 GLC H3 1 1 1 1623 2 2 1 GLC H4 H 9.889 -3.274 -18.868 1.00 . B A . 1 GLC H4 1 1 1 1624 2 2 1 GLC H5 H 12.788 -3.606 -19.755 1.00 . B A . 1 GLC H5 1 1 1 1625 2 2 1 GLC H61 H 10.264 -5.038 -19.807 1.00 . B A . 1 GLC H61 1 1 1 1626 2 2 1 GLC H62 H 11.918 -5.621 -20.141 1.00 . B A . 1 GLC H62 1 1 1 1627 2 2 1 GLC HO2 H 13.460 -0.185 -18.204 1.00 . B A . 1 GLC HO2 1 1 1 1628 2 2 1 GLC HO3 H 9.409 -1.505 -19.860 1.00 . B A . 1 GLC HO3 1 1 1 1629 2 2 1 GLC HO6 H 10.944 -5.772 -22.108 1.00 . B A . 1 GLC HO6 1 1 1 1630 2 2 1 GLC O2 O 13.339 -0.944 -18.781 1.00 . B A . 1 GLC O2 1 1 1 1631 2 2 1 GLC O3 O 9.726 -0.936 -19.155 1.00 . B A . 1 GLC O3 1 1 1 1632 2 2 1 GLC O4 O 11.366 -3.600 -17.539 1.00 . B A . 1 GLC O4 1 1 1 1633 2 2 1 GLC O5 O 11.555 -2.592 -21.075 1.00 . B A . 1 GLC O5 1 1 1 1634 2 2 1 GLC O6 O 10.904 -4.867 -21.792 1.00 . B A . 1 GLC O6 1 1 1 1635 3 2 1 GLC C1 C -14.011 -10.375 -10.322 1.00 . C A . 617 GLC C1 1 1 1 1636 3 2 1 GLC C2 C -12.563 -10.649 -9.934 1.00 . C A . 617 GLC C2 1 1 1 1637 3 2 1 GLC C3 C -12.296 -12.081 -9.470 1.00 . C A . 617 GLC C3 1 1 1 1638 3 2 1 GLC C4 C -13.610 -12.809 -9.250 1.00 . C A . 617 GLC C4 1 1 1 1639 3 2 1 GLC C5 C -14.548 -11.884 -8.488 1.00 . C A . 617 GLC C5 1 1 1 1640 3 2 1 GLC C6 C -13.917 -11.333 -7.224 1.00 . C A . 617 GLC C6 1 1 1 1641 3 2 1 GLC H1 H -14.094 -9.242 -10.470 1.00 . C A . 617 GLC H1 1 1 1 1642 3 2 1 GLC H2 H -12.439 -10.080 -9.053 1.00 . C A . 617 GLC H2 1 1 1 1643 3 2 1 GLC H3 H -11.416 -12.502 -9.981 1.00 . C A . 617 GLC H3 1 1 1 1644 3 2 1 GLC H4 H -13.428 -13.705 -8.655 1.00 . C A . 617 GLC H4 1 1 1 1645 3 2 1 GLC H5 H -15.479 -12.391 -8.230 1.00 . C A . 617 GLC H5 1 1 1 1646 3 2 1 GLC H61 H -14.298 -10.312 -7.188 1.00 . C A . 617 GLC H61 1 1 1 1647 3 2 1 GLC H62 H -12.787 -11.311 -7.249 1.00 . C A . 617 GLC H62 1 1 1 1648 3 2 1 GLC HO2 H -10.916 -9.889 -10.808 1.00 . C A . 617 GLC HO2 1 1 1 1649 3 2 1 GLC HO3 H -10.893 -12.729 -8.262 1.00 . C A . 617 GLC HO3 1 1 1 1650 3 2 1 GLC HO6 H -15.299 -12.280 -6.138 1.00 . C A . 617 GLC HO6 1 1 1 1651 3 2 1 GLC O2 O -11.727 -10.345 -11.038 1.00 . C A . 617 GLC O2 1 1 1 1652 3 2 1 GLC O3 O -11.576 -12.051 -8.247 1.00 . C A . 617 GLC O3 1 1 1 1653 3 2 1 GLC O4 O -14.198 -13.190 -10.509 1.00 . C A . 617 GLC O4 1 1 1 1654 3 2 1 GLC O5 O -14.933 -10.753 -9.301 1.00 . C A . 617 GLC O5 1 1 1 1655 3 2 1 GLC O6 O -14.366 -12.034 -6.070 1.00 . C A . 617 GLC O6 1 1 stop_ save_
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