NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
468366 | 1a2i | 4291 | cing | 4-filtered-FRED | STAR | entry | full | 1421 |
data_FRED_restraints_with_modified_coordinates_PDB_code_1a2i # This FRED archive file contains, for PDB entry <1a2i>: # # - 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_1a2i _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 1a2i _Assembly.Number_of_components 5 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all other bound" _Assembly.Molecular_mass 14101.00 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 $CYTOCHROME_C3 A . 1 1 2 . 2 $HEME_C B . 1 1 3 . 2 $HEME_C C . 1 1 4 . 2 $HEME_C D . 1 1 5 . 2 $HEME_C E . 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 HEC 1 HEC 1 1 3 2 HEC 1 HEC 1 1 4 2 HEC 1 HEC 1 1 5 2 HEC 1 HEC 1 1 stop_ save_ save_CYTOCHROME_C3 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "CYTOCHROME C3" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code APKAPADGLKMEATKQPVVFNHSTHKSVKCGDCHHPVNGKEDYRKCGTAGCHDSMDKKDKSAKGYYHVMHDKNTKFKSCVGCHVEVAGADAAKKKDLTGCKKSKCHE _Entity.Number_of_monomers 107 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 ALA . 1 1 2 PRO . 1 1 3 LYS . 1 1 4 ALA . 1 1 5 PRO . 1 1 6 ALA . 1 1 7 ASP . 1 1 8 GLY . 1 1 9 LEU . 1 1 10 LYS . 1 1 11 MET . 1 1 12 GLU . 1 1 13 ALA . 1 1 14 THR . 1 1 15 LYS . 1 1 16 GLN . 1 1 17 PRO . 1 1 18 VAL . 1 1 19 VAL . 1 1 20 PHE . 1 1 21 ASN . 1 1 22 HIS . 1 1 23 SER . 1 1 24 THR . 1 1 25 HIS . 1 1 26 LYS . 1 1 27 SER . 1 1 28 VAL . 1 1 29 LYS . 1 1 30 CYS . 1 1 31 GLY . 1 1 32 ASP . 1 1 33 CYS . 1 1 34 HIS . 1 1 35 HIS . 1 1 36 PRO . 1 1 37 VAL . 1 1 38 ASN . 1 1 39 GLY . 1 1 40 LYS . 1 1 41 GLU . 1 1 42 ASP . 1 1 43 TYR . 1 1 44 ARG . 1 1 45 LYS . 1 1 46 CYS . 1 1 47 GLY . 1 1 48 THR . 1 1 49 ALA . 1 1 50 GLY . 1 1 51 CYS . 1 1 52 HIS . 1 1 53 ASP . 1 1 54 SER . 1 1 55 MET . 1 1 56 ASP . 1 1 57 LYS . 1 1 58 LYS . 1 1 59 ASP . 1 1 60 LYS . 1 1 61 SER . 1 1 62 ALA . 1 1 63 LYS . 1 1 64 GLY . 1 1 65 TYR . 1 1 66 TYR . 1 1 67 HIS . 1 1 68 VAL . 1 1 69 MET . 1 1 70 HIS . 1 1 71 ASP . 1 1 72 LYS . 1 1 73 ASN . 1 1 74 THR . 1 1 75 LYS . 1 1 76 PHE . 1 1 77 LYS . 1 1 78 SER . 1 1 79 CYS . 1 1 80 VAL . 1 1 81 GLY . 1 1 82 CYS . 1 1 83 HIS . 1 1 84 VAL . 1 1 85 GLU . 1 1 86 VAL . 1 1 87 ALA . 1 1 88 GLY . 1 1 89 ALA . 1 1 90 ASP . 1 1 91 ALA . 1 1 92 ALA . 1 1 93 LYS . 1 1 94 LYS . 1 1 95 LYS . 1 1 96 ASP . 1 1 97 LEU . 1 1 98 THR . 1 1 99 GLY . 1 1 100 CYS . 1 1 101 LYS . 1 1 102 LYS . 1 1 103 SER . 1 1 104 LYS . 1 1 105 CYS . 1 1 106 HIS . 1 1 107 GLU . 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 ALA 1 1 1 1 PRO 2 2 1 1 LYS 3 3 1 1 ALA 4 4 1 1 PRO 5 5 1 1 ALA 6 6 1 1 ASP 7 7 1 1 GLY 8 8 1 1 LEU 9 9 1 1 LYS 10 10 1 1 MET 11 11 1 1 GLU 12 12 1 1 ALA 13 13 1 1 THR 14 14 1 1 LYS 15 15 1 1 GLN 16 16 1 1 PRO 17 17 1 1 VAL 18 18 1 1 VAL 19 19 1 1 PHE 20 20 1 1 ASN 21 21 1 1 HIS 22 22 1 1 SER 23 23 1 1 THR 24 24 1 1 HIS 25 25 1 1 LYS 26 26 1 1 SER 27 27 1 1 VAL 28 28 1 1 LYS 29 29 1 1 CYS 30 30 1 1 GLY 31 31 1 1 ASP 32 32 1 1 CYS 33 33 1 1 HIS 34 34 1 1 HIS 35 35 1 1 PRO 36 36 1 1 VAL 37 37 1 1 ASN 38 38 1 1 GLY 39 39 1 1 LYS 40 40 1 1 GLU 41 41 1 1 ASP 42 42 1 1 TYR 43 43 1 1 ARG 44 44 1 1 LYS 45 45 1 1 CYS 46 46 1 1 GLY 47 47 1 1 THR 48 48 1 1 ALA 49 49 1 1 GLY 50 50 1 1 CYS 51 51 1 1 HIS 52 52 1 1 ASP 53 53 1 1 SER 54 54 1 1 MET 55 55 1 1 ASP 56 56 1 1 LYS 57 57 1 1 LYS 58 58 1 1 ASP 59 59 1 1 LYS 60 60 1 1 SER 61 61 1 1 ALA 62 62 1 1 LYS 63 63 1 1 GLY 64 64 1 1 TYR 65 65 1 1 TYR 66 66 1 1 HIS 67 67 1 1 VAL 68 68 1 1 MET 69 69 1 1 HIS 70 70 1 1 ASP 71 71 1 1 LYS 72 72 1 1 ASN 73 73 1 1 THR 74 74 1 1 LYS 75 75 1 1 PHE 76 76 1 1 LYS 77 77 1 1 SER 78 78 1 1 CYS 79 79 1 1 VAL 80 80 1 1 GLY 81 81 1 1 CYS 82 82 1 1 HIS 83 83 1 1 VAL 84 84 1 1 GLU 85 85 1 1 VAL 86 86 1 1 ALA 87 87 1 1 GLY 88 88 1 1 ALA 89 89 1 1 ASP 90 90 1 1 ALA 91 91 1 1 ALA 92 92 1 1 LYS 93 93 1 1 LYS 94 94 1 1 LYS 95 95 1 1 ASP 96 96 1 1 LEU 97 97 1 1 THR 98 98 1 1 GLY 99 99 1 1 CYS 100 100 1 1 LYS 101 101 1 1 LYS 102 102 1 1 SER 103 103 1 1 LYS 104 104 1 1 CYS 105 105 1 1 HIS 106 106 1 1 GLU 107 107 1 1 stop_ save_ save_HEME_C _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "HEME C" _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 HEC $HEC 1 2 stop_ save_ save_HEC _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID HEC _Chem_comp.Type non-polymer save_ save_DYANA/DIANA_distance_constraints_2_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 1 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 1 2 1 . . . 1 1 3 1 . . . 1 1 4 1 . . . 1 1 5 1 . . . 1 1 6 1 . . . 1 1 7 1 . . . 1 1 8 1 . . . 1 1 9 1 . . . 1 1 10 1 . . . 1 1 11 1 . . . 1 1 12 1 . . . 1 1 13 1 . . . 1 1 14 1 . . . 1 1 15 1 . . . 1 1 16 1 . . . 1 1 17 1 . . . 1 1 18 1 . . . 1 1 19 1 . . . 1 1 20 1 . . . 1 1 21 1 . . . 1 1 22 1 . . . 1 1 23 1 . . . 1 1 24 1 . . . 1 1 25 1 . . . 1 1 26 1 . . . 1 1 27 1 . . . 1 1 28 1 . . . 1 1 29 1 . . . 1 1 30 1 . . . 1 1 31 1 . . . 1 1 32 1 . . . 1 1 33 1 . . . 1 1 34 1 . . . 1 1 35 1 . . . 1 1 36 1 . . . 1 1 37 1 . . . 1 1 38 1 . . . 1 1 39 1 . . . 1 1 40 1 . . . 1 1 41 1 . . . 1 1 42 1 . . . 1 1 43 1 . . . 1 1 44 1 . . . 1 1 45 1 . . . 1 1 46 1 . . . 1 1 47 1 . . . 1 1 48 1 . . . 1 1 49 1 . . . 1 1 50 1 . . . 1 1 51 1 . . . 1 1 52 1 . . . 1 1 53 1 . . . 1 1 54 1 . . . 1 1 55 1 . . . 1 1 56 1 . . . 1 1 57 1 . . . 1 1 58 1 . . . 1 1 59 1 . . . 1 1 60 1 . . . 1 1 61 1 . . . 1 1 62 1 . . . 1 1 63 1 . . . 1 1 64 1 . . . 1 1 65 1 . . . 1 1 66 1 . . . 1 1 67 1 . . . 1 1 68 1 . . . 1 1 69 1 . . . 1 1 70 1 . . . 1 1 71 1 . . . 1 1 72 1 . . . 1 1 73 1 . . . 1 1 74 1 . . . 1 1 75 1 . . . 1 1 76 1 . . . 1 1 77 1 . . . 1 1 78 1 . . . 1 1 79 1 . . . 1 1 80 1 . . . 1 1 81 1 . . . 1 1 82 1 . . . 1 1 83 1 . . . 1 1 84 1 . . . 1 1 85 1 . . . 1 1 86 1 . . . 1 1 87 1 . . . 1 1 88 1 . . . 1 1 89 1 . . . 1 1 90 1 . . . 1 1 91 1 . . . 1 1 92 1 . . . 1 1 93 1 . . . 1 1 94 1 . . . 1 1 95 1 . . . 1 1 96 1 . . . 1 1 97 1 . . . 1 1 98 1 . . . 1 1 99 1 . . . 1 1 100 1 . . . 1 1 101 1 . . . 1 1 102 1 . . . 1 1 103 1 . . . 1 1 104 1 . . . 1 1 105 1 . . . 1 1 106 1 . . . 1 1 107 1 . . . 1 1 108 1 . . . 1 1 109 1 . . . 1 1 110 1 . . . 1 1 111 1 . . . 1 1 112 1 . . . 1 1 113 1 . . . 1 1 114 1 . . . 1 1 115 1 . . . 1 1 116 1 . . . 1 1 117 1 . . . 1 1 118 1 . . . 1 1 119 1 . . . 1 1 120 1 . . . 1 1 121 1 . . . 1 1 122 1 . . . 1 1 123 1 . . . 1 1 124 1 . . . 1 1 125 1 . . . 1 1 126 1 . . . 1 1 127 1 . . . 1 1 128 1 . . . 1 1 129 1 . . . 1 1 130 1 . . . 1 1 131 1 . . . 1 1 132 1 . . . 1 1 133 1 . . . 1 1 134 1 . . . 1 1 135 1 . . . 1 1 136 1 . . . 1 1 137 1 . . . 1 1 138 1 . . . 1 1 139 1 . . . 1 1 140 1 . . . 1 1 141 1 . . . 1 1 142 1 . . . 1 1 143 1 . . . 1 1 144 1 . . . 1 1 145 1 . . . 1 1 146 1 . . . 1 1 147 1 . . . 1 1 148 1 . . . 1 1 149 1 . . . 1 1 150 1 . . . 1 1 151 1 . . . 1 1 152 1 . . . 1 1 153 1 . . . 1 1 154 1 . . . 1 1 155 1 . . . 1 1 156 1 . . . 1 1 157 1 . . . 1 1 158 1 . . . 1 1 159 1 . . . 1 1 160 1 . . . 1 1 161 1 . . . 1 1 162 1 . . . 1 1 163 1 . . . 1 1 164 1 . . . 1 1 165 1 . . . 1 1 166 1 . . . 1 1 167 1 . . . 1 1 168 1 . . . 1 1 169 1 . . . 1 1 170 1 . . . 1 1 171 1 . . . 1 1 172 1 . . . 1 1 173 1 . . . 1 1 174 1 . . . 1 1 175 1 . . . 1 1 176 1 . . . 1 1 177 1 . . . 1 1 178 1 . . . 1 1 179 1 . . . 1 1 180 1 . . . 1 1 181 1 . . . 1 1 182 1 . . . 1 1 183 1 . . . 1 1 184 1 . . . 1 1 185 1 . . . 1 1 186 1 . . . 1 1 187 1 . . . 1 1 188 1 . . . 1 1 189 1 . . . 1 1 190 1 . . . 1 1 191 1 . . . 1 1 192 1 . . . 1 1 193 1 . . . 1 1 194 1 . . . 1 1 195 1 . . . 1 1 196 1 . . . 1 1 197 1 . . . 1 1 198 1 . . . 1 1 199 1 . . . 1 1 200 1 . . . 1 1 201 1 . . . 1 1 202 1 . . . 1 1 203 1 . . . 1 1 204 1 . . . 1 1 205 1 . . . 1 1 206 1 . . . 1 1 207 1 . . . 1 1 208 1 . . . 1 1 209 1 . . . 1 1 210 1 . . . 1 1 211 1 . . . 1 1 212 1 . . . 1 1 213 1 . . . 1 1 214 1 . . . 1 1 215 1 . . . 1 1 216 1 . . . 1 1 217 1 . . . 1 1 218 1 . . . 1 1 219 1 . . . 1 1 220 1 . . . 1 1 221 1 . . . 1 1 222 1 . . . 1 1 223 1 . . . 1 1 224 1 . . . 1 1 225 1 . . . 1 1 226 1 . . . 1 1 227 1 . . . 1 1 228 1 . . . 1 1 229 1 . . . 1 1 230 1 . . . 1 1 231 1 . . . 1 1 232 1 . . . 1 1 233 1 . . . 1 1 234 1 . . . 1 1 235 1 . . . 1 1 236 1 . . . 1 1 237 1 . . . 1 1 238 1 . . . 1 1 239 1 . . . 1 1 240 1 . . . 1 1 241 1 . . . 1 1 242 1 . . . 1 1 243 1 . . . 1 1 244 1 . . . 1 1 245 1 . . . 1 1 246 1 . . . 1 1 247 1 . . . 1 1 248 1 . . . 1 1 249 1 . . . 1 1 250 1 . . . 1 1 251 1 . . . 1 1 252 1 . . . 1 1 253 1 . . . 1 1 254 1 . . . 1 1 255 1 . . . 1 1 256 1 . . . 1 1 257 1 . . . 1 1 258 1 . . . 1 1 259 1 . . . 1 1 260 1 . . . 1 1 261 1 . . . 1 1 262 1 . . . 1 1 263 1 . . . 1 1 264 1 . . . 1 1 265 1 . . . 1 1 266 1 . . . 1 1 267 1 . . . 1 1 268 1 . . . 1 1 269 1 . . . 1 1 270 1 . . . 1 1 271 1 . . . 1 1 272 1 . . . 1 1 273 1 . . . 1 1 274 1 . . . 1 1 275 1 . . . 1 1 276 1 . . . 1 1 277 1 . . . 1 1 278 1 . . . 1 1 279 1 . . . 1 1 280 1 . . . 1 1 281 1 . . . 1 1 282 1 . . . 1 1 283 1 . . . 1 1 284 1 . . . 1 1 285 1 . . . 1 1 286 1 . . . 1 1 287 1 . . . 1 1 288 1 . . . 1 1 289 1 . . . 1 1 290 1 . . . 1 1 291 1 . . . 1 1 292 1 . . . 1 1 293 1 . . . 1 1 294 1 . . . 1 1 295 1 . . . 1 1 296 1 . . . 1 1 297 1 . . . 1 1 298 1 . . . 1 1 299 1 . . . 1 1 300 1 . . . 1 1 301 1 . . . 1 1 302 1 . . . 1 1 303 1 . . . 1 1 304 1 . . . 1 1 305 1 . . . 1 1 306 1 . . . 1 1 307 1 . . . 1 1 308 1 . . . 1 1 309 1 . . . 1 1 310 1 . . . 1 1 311 1 . . . 1 1 312 1 . . . 1 1 313 1 . . . 1 1 314 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 1 675 1 . . . 1 1 676 1 . . . 1 1 677 1 . . . 1 1 678 1 . . . 1 1 679 1 . . . 1 1 680 1 . . . 1 1 681 1 . . . 1 1 682 1 . . . 1 1 683 1 . . . 1 1 684 1 . . . 1 1 685 1 . . . 1 1 686 1 . . . 1 1 687 1 . . . 1 1 688 1 . . . 1 1 689 1 . . . 1 1 690 1 . . . 1 1 691 1 . . . 1 1 692 1 . . . 1 1 693 1 . . . 1 1 694 1 . . . 1 1 695 1 . . . 1 1 696 1 . . . 1 1 697 1 . . . 1 1 698 1 . . . 1 1 699 1 . . . 1 1 700 1 . . . 1 1 701 1 . . . 1 1 702 1 . . . 1 1 703 1 . . . 1 1 704 1 . . . 1 1 705 1 . . . 1 1 706 1 . . . 1 1 707 1 . . . 1 1 708 1 . . . 1 1 709 1 . . . 1 1 710 1 . . . 1 1 711 1 . . . 1 1 712 1 . . . 1 1 713 1 . . . 1 1 714 1 . . . 1 1 715 1 . . . 1 1 716 1 . . . 1 1 717 1 . . . 1 1 718 1 . . . 1 1 719 1 . . . 1 1 720 1 . . . 1 1 721 1 . . . 1 1 722 1 . . . 1 1 723 1 . . . 1 1 724 1 . . . 1 1 725 1 . . . 1 1 726 1 . . . 1 1 727 1 . . . 1 1 728 1 . . . 1 1 729 1 . . . 1 1 730 1 . . . 1 1 731 1 . . . 1 1 732 1 . . . 1 1 733 1 . . . 1 1 734 1 . . . 1 1 735 1 . . . 1 1 736 1 . . . 1 1 737 1 . . . 1 1 738 1 . . . 1 1 739 1 . . . 1 1 740 1 . . . 1 1 741 1 . . . 1 1 742 1 . . . 1 1 743 1 . . . 1 1 744 1 . . . 1 1 745 1 . . . 1 1 746 1 . . . 1 1 747 1 . . . 1 1 748 1 . . . 1 1 749 1 . . . 1 1 750 1 . . . 1 1 751 1 . . . 1 1 752 1 . . . 1 1 753 1 . . . 1 1 754 1 . . . 1 1 755 1 . . . 1 1 756 1 . . . 1 1 757 1 . . . 1 1 758 1 . . . 1 1 759 1 . . . 1 1 760 1 . . . 1 1 761 1 . . . 1 1 762 1 . . . 1 1 763 1 . . . 1 1 764 1 . . . 1 1 765 1 . . . 1 1 766 1 . . . 1 1 767 1 . . . 1 1 768 1 . . . 1 1 769 1 . . . 1 1 770 1 . . . 1 1 771 1 . . . 1 1 772 1 . . . 1 1 773 1 . . . 1 1 774 1 . . . 1 1 775 1 . . . 1 1 776 1 . . . 1 1 777 1 . . . 1 1 778 1 . . . 1 1 779 1 . . . 1 1 780 1 . . . 1 1 781 1 . . . 1 1 782 1 . . . 1 1 783 1 . . . 1 1 784 1 . . . 1 1 785 1 . . . 1 1 786 1 . . . 1 1 787 1 . . . 1 1 788 1 . . . 1 1 789 1 . . . 1 1 790 1 . . . 1 1 791 1 . . . 1 1 792 1 . . . 1 1 793 1 . . . 1 1 794 1 . . . 1 1 795 1 . . . 1 1 796 1 . . . 1 1 797 1 . . . 1 1 798 1 . . . 1 1 799 1 . . . 1 1 800 1 . . . 1 1 801 1 . . . 1 1 802 1 . . . 1 1 803 1 . . . 1 1 804 1 . . . 1 1 805 1 . . . 1 1 806 1 . . . 1 1 807 1 . . . 1 1 808 1 . . . 1 1 809 1 . . . 1 1 810 1 . . . 1 1 811 1 . . . 1 1 812 1 . . . 1 1 813 1 . . . 1 1 814 1 . . . 1 1 815 1 . . . 1 1 816 1 . . . 1 1 817 1 . . . 1 1 818 1 . . . 1 1 819 1 . . . 1 1 820 1 . . . 1 1 821 1 . . . 1 1 822 1 . . . 1 1 823 1 . . . 1 1 824 1 . . . 1 1 825 1 . . . 1 1 826 1 . . . 1 1 827 1 . . . 1 1 828 1 . . . 1 1 829 1 . . . 1 1 830 1 . . . 1 1 831 1 . . . 1 1 832 1 . . . 1 1 833 1 . . . 1 1 834 1 . . . 1 1 835 1 . . . 1 1 836 1 . . . 1 1 837 1 . . . 1 1 838 1 . . . 1 1 839 1 . . . 1 1 840 1 . . . 1 1 841 1 . . . 1 1 842 1 . . . 1 1 843 1 . . . 1 1 844 1 . . . 1 1 845 1 . . . 1 1 846 1 . . . 1 1 847 1 . . . 1 1 848 1 . . . 1 1 849 1 . . . 1 1 850 1 . . . 1 1 851 1 . . . 1 1 852 1 . . . 1 1 853 1 . . . 1 1 854 1 . . . 1 1 855 1 . . . 1 1 856 1 . . . 1 1 857 1 . . . 1 1 858 1 . . . 1 1 859 1 . . . 1 1 860 1 . . . 1 1 861 1 . . . 1 1 862 1 . . . 1 1 863 1 . . . 1 1 864 1 . . . 1 1 865 1 . . . 1 1 866 1 . . . 1 1 867 1 . . . 1 1 868 1 . . . 1 1 869 1 . . . 1 1 870 1 . . . 1 1 871 1 . . . 1 1 872 1 . . . 1 1 873 1 . . . 1 1 874 1 . . . 1 1 875 1 . . . 1 1 876 1 . . . 1 1 877 1 . . . 1 1 878 1 . . . 1 1 879 1 . . . 1 1 880 1 . . . 1 1 881 1 . . . 1 1 882 1 . . . 1 1 883 1 . . . 1 1 884 1 . . . 1 1 885 1 . . . 1 1 886 1 . . . 1 1 887 1 . . . 1 1 888 1 . . . 1 1 889 1 . . . 1 1 890 1 . . . 1 1 891 1 . . . 1 1 892 1 . . . 1 1 893 1 . . . 1 1 894 1 . . . 1 1 895 1 . . . 1 1 896 1 . . . 1 1 897 1 . . . 1 1 898 1 . . . 1 1 899 1 . . . 1 1 900 1 . . . 1 1 901 1 . . . 1 1 902 1 . . . 1 1 903 1 . . . 1 1 904 1 . . . 1 1 905 1 . . . 1 1 906 1 . . . 1 1 907 1 . . . 1 1 908 1 . . . 1 1 909 1 . . . 1 1 910 1 . . . 1 1 911 1 . . . 1 1 912 1 . . . 1 1 913 1 . . . 1 1 914 1 . . . 1 1 915 1 . . . 1 1 916 1 . . . 1 1 917 1 . . . 1 1 918 1 . . . 1 1 919 1 . . . 1 1 920 1 . . . 1 1 921 1 . . . 1 1 922 1 . . . 1 1 923 1 . . . 1 1 924 1 . . . 1 1 925 1 . . . 1 1 926 1 . . . 1 1 927 1 . . . 1 1 928 1 . . . 1 1 929 1 . . . 1 1 930 1 . . . 1 1 931 1 . . . 1 1 932 1 . . . 1 1 933 1 . . . 1 1 934 1 . . . 1 1 935 1 . . . 1 1 936 1 . . . 1 1 937 1 . . . 1 1 938 1 . . . 1 1 939 1 . . . 1 1 940 1 . . . 1 1 941 1 . . . 1 1 942 1 . . . 1 1 943 1 . . . 1 1 944 1 . . . 1 1 945 1 . . . 1 1 946 1 . . . 1 1 947 1 . . . 1 1 948 1 . . . 1 1 949 1 . . . 1 1 950 1 . . . 1 1 951 1 . . . 1 1 952 1 . . . 1 1 953 1 . . . 1 1 954 1 . . . 1 1 955 1 . . . 1 1 956 1 . . . 1 1 957 1 . . . 1 1 958 1 . . . 1 1 959 1 . . . 1 1 960 1 . . . 1 1 961 1 . . . 1 1 962 1 . . . 1 1 963 1 . . . 1 1 964 1 . . . 1 1 965 1 . . . 1 1 966 1 . . . 1 1 967 1 . . . 1 1 968 1 . . . 1 1 969 1 . . . 1 1 970 1 . . . 1 1 971 1 . . . 1 1 972 1 . . . 1 1 973 1 . . . 1 1 974 1 . . . 1 1 975 1 . . . 1 1 976 1 . . . 1 1 977 1 . . . 1 1 978 1 . . . 1 1 979 1 . . . 1 1 980 1 . . . 1 1 981 1 . . . 1 1 982 1 . . . 1 1 983 1 . . . 1 1 984 1 . . . 1 1 985 1 . . . 1 1 986 1 . . . 1 1 987 1 . . . 1 1 988 1 . . . 1 1 989 1 . . . 1 1 990 1 . . . 1 1 991 1 . . . 1 1 992 1 . . . 1 1 993 1 . . . 1 1 994 1 . . . 1 1 995 1 . . . 1 1 996 1 . . . 1 1 997 1 . . . 1 1 998 1 . . . 1 1 999 1 . . . 1 1 1000 1 . . . 1 1 1001 1 . . . 1 1 1002 1 . . . 1 1 1003 1 . . . 1 1 1004 1 . . . 1 1 1005 1 . . . 1 1 1006 1 . . . 1 1 1007 1 . . . 1 1 1008 1 . . . 1 1 1009 1 . . . 1 1 1010 1 . . . 1 1 1011 1 . . . 1 1 1012 1 . . . 1 1 1013 1 . . . 1 1 1014 1 . . . 1 1 1015 1 . . . 1 1 1016 1 . . . 1 1 1017 1 . . . 1 1 1018 1 . . . 1 1 1019 1 . . . 1 1 1020 1 . . . 1 1 1021 1 . . . 1 1 1022 1 . . . 1 1 1023 1 . . . 1 1 1024 1 . . . 1 1 1025 1 . . . 1 1 1026 1 . . . 1 1 1027 1 . . . 1 1 1028 1 . . . 1 1 1029 1 . . . 1 1 1030 1 . . . 1 1 1031 1 . . . 1 1 1032 1 . . . 1 1 1033 1 . . . 1 1 1034 1 . . . 1 1 1035 1 . . . 1 1 1036 1 . . . 1 1 1037 1 . . . 1 1 1038 1 . . . 1 1 1039 1 . . . 1 1 1040 1 . . . 1 1 1041 1 . . . 1 1 1042 1 . . . 1 1 1043 1 . . . 1 1 1044 1 . . . 1 1 1045 1 . . . 1 1 1046 1 . . . 1 1 1047 1 . . . 1 1 1048 1 . . . 1 1 1049 1 . . . 1 1 1050 1 . . . 1 1 1051 1 . . . 1 1 1052 1 . . . 1 1 1053 1 . . . 1 1 1054 1 . . . 1 1 1055 1 . . . 1 1 1056 1 . . . 1 1 1057 1 . . . 1 1 1058 1 . . . 1 1 1059 1 . . . 1 1 1060 1 . . . 1 1 1061 1 . . . 1 1 1062 1 . . . 1 1 1063 1 . . . 1 1 1064 1 . . . 1 1 1065 1 . . . 1 1 1066 1 . . . 1 1 1067 1 . . . 1 1 1068 1 . . . 1 1 1069 1 . . . 1 1 1070 1 . . . 1 1 1071 1 . . . 1 1 1072 1 . . . 1 1 1073 1 . . . 1 1 1074 1 . . . 1 1 1075 1 . . . 1 1 1076 1 . . . 1 1 1077 1 . . . 1 1 1078 1 . . . 1 1 1079 1 . . . 1 1 1080 1 . . . 1 1 1081 1 . . . 1 1 1082 1 . . . 1 1 1083 1 . . . 1 1 1084 1 . . . 1 1 1085 1 . . . 1 1 1086 1 . . . 1 1 1087 1 . . . 1 1 1088 1 . . . 1 1 1089 1 . . . 1 1 1090 1 . . . 1 1 1091 1 . . . 1 1 1092 1 . . . 1 1 1093 1 . . . 1 1 1094 1 . . . 1 1 1095 1 . . . 1 1 1096 1 . . . 1 1 1097 1 . . . 1 1 1098 1 . . . 1 1 1099 1 . . . 1 1 1100 1 . . . 1 1 1101 1 . . . 1 1 1102 1 . . . 1 1 1103 1 . . . 1 1 1104 1 . . . 1 1 1105 1 . . . 1 1 1106 1 . . . 1 1 1107 1 . . . 1 1 1108 1 . . . 1 1 1109 1 . . . 1 1 1110 1 . . . 1 1 1111 1 . . . 1 1 1112 1 . . . 1 1 1113 1 . . . 1 1 1114 1 . . . 1 1 1115 1 . . . 1 1 1116 1 . . . 1 1 1117 1 . . . 1 1 1118 1 . . . 1 1 1119 1 . . . 1 1 1120 1 . . . 1 1 1121 1 . . . 1 1 1122 1 . . . 1 1 1123 1 . . . 1 1 1124 1 . . . 1 1 1125 1 . . . 1 1 1126 1 . . . 1 1 1127 1 . . . 1 1 1128 1 . . . 1 1 1129 1 . . . 1 1 1130 1 . . . 1 1 1131 1 . . . 1 1 1132 1 . . . 1 1 1133 1 . . . 1 1 1134 1 . . . 1 1 1135 1 . . . 1 1 1136 1 . . . 1 1 1137 1 . . . 1 1 1138 1 . . . 1 1 1139 1 . . . 1 1 1140 1 . . . 1 1 1141 1 . . . 1 1 1142 1 . . . 1 1 1143 1 . . . 1 1 1144 1 . . . 1 1 1145 1 . . . 1 1 1146 1 . . . 1 1 1147 1 . . . 1 1 1148 1 . . . 1 1 1149 1 . . . 1 1 1150 1 . . . 1 1 1151 1 . . . 1 1 1152 1 . . . 1 1 1153 1 . . . 1 1 1154 1 . . . 1 1 1155 1 . . . 1 1 1156 1 . . . 1 1 1157 1 . . . 1 1 1158 1 . . . 1 1 1159 1 . . . 1 1 1160 1 . . . 1 1 1161 1 . . . 1 1 1162 1 . . . 1 1 1163 1 . . . 1 1 1164 1 . . . 1 1 1165 1 . . . 1 1 1166 1 . . . 1 1 1167 1 . . . 1 1 1168 1 . . . 1 1 1169 1 . . . 1 1 1170 1 . . . 1 1 1171 1 . . . 1 1 1172 1 . . . 1 1 1173 1 . . . 1 1 1174 1 . . . 1 1 1175 1 . . . 1 1 1176 1 . . . 1 1 1177 1 . . . 1 1 1178 1 . . . 1 1 1179 1 . . . 1 1 1180 1 . . . 1 1 1181 1 . . . 1 1 1182 1 . . . 1 1 1183 1 . . . 1 1 1184 1 . . . 1 1 1185 1 . . . 1 1 1186 1 . . . 1 1 1187 1 . . . 1 1 1188 1 . . . 1 1 1189 1 . . . 1 1 1190 1 . . . 1 1 1191 1 . . . 1 1 1192 1 . . . 1 1 1193 1 . . . 1 1 1194 1 . . . 1 1 1195 1 . . . 1 1 1196 1 . . . 1 1 1197 1 . . . 1 1 1198 1 . . . 1 1 1199 1 . . . 1 1 1200 1 . . . 1 1 1201 1 . . . 1 1 1202 1 . . . 1 1 1203 1 . . . 1 1 1204 1 . . . 1 1 1205 1 . . . 1 1 1206 1 . . . 1 1 1207 1 . . . 1 1 1208 1 . . . 1 1 1209 1 . . . 1 1 1210 1 . . . 1 1 1211 1 . . . 1 1 1212 1 . . . 1 1 1213 1 . . . 1 1 1214 1 . . . 1 1 1215 1 . . . 1 1 1216 1 . . . 1 1 1217 1 . . . 1 1 1218 1 . . . 1 1 1219 1 . . . 1 1 1220 1 . . . 1 1 1221 1 . . . 1 1 1222 1 . . . 1 1 1223 1 . . . 1 1 1224 1 . . . 1 1 1225 1 . . . 1 1 1226 1 . . . 1 1 1227 1 . . . 1 1 1228 1 . . . 1 1 1229 1 . . . 1 1 1230 1 . . . 1 1 1231 1 . . . 1 1 1232 1 . . . 1 1 1233 1 . . . 1 1 1234 1 . . . 1 1 1235 1 . . . 1 1 1236 1 . . . 1 1 1237 1 . . . 1 1 1238 1 . . . 1 1 1239 1 . . . 1 1 1240 1 . . . 1 1 1241 1 . . . 1 1 1242 1 . . . 1 1 1243 1 . . . 1 1 1244 1 . . . 1 1 1245 1 . . . 1 1 1246 1 . . . 1 1 1247 1 . . . 1 1 1248 1 . . . 1 1 1249 1 . . . 1 1 1250 1 . . . 1 1 1251 1 . . . 1 1 1252 1 . . . 1 1 1253 1 . . . 1 1 1254 1 . . . 1 1 1255 1 . . . 1 1 1256 1 . . . 1 1 1257 1 . . . 1 1 1258 1 . . . 1 1 1259 1 . . . 1 1 1260 1 . . . 1 1 1261 1 . . . 1 1 1262 1 . . . 1 1 1263 1 . . . 1 1 1264 1 . . . 1 1 1265 1 . . . 1 1 1266 1 . . . 1 1 1267 1 . . . 1 1 1268 1 . . . 1 1 1269 1 . . . 1 1 1270 1 . . . 1 1 1271 1 . . . 1 1 1272 1 . . . 1 1 1273 1 . . . 1 1 1274 1 . . . 1 1 1275 1 . . . 1 1 1276 1 . . . 1 1 1277 1 . . . 1 1 1278 1 . . . 1 1 1279 1 . . . 1 1 1280 1 . . . 1 1 1281 1 . . . 1 1 1282 1 . . . 1 1 1283 1 . . . 1 1 1284 1 . . . 1 1 1285 1 . . . 1 1 1286 1 . . . 1 1 1287 1 . . . 1 1 1288 1 . . . 1 1 1289 1 . . . 1 1 1290 1 . . . 1 1 1291 1 . . . 1 1 1292 1 . . . 1 1 1293 1 . . . 1 1 1294 1 . . . 1 1 1295 1 . . . 1 1 1296 1 . . . 1 1 1297 1 . . . 1 1 1298 1 . . . 1 1 1299 1 . . . 1 1 1300 1 . . . 1 1 1301 1 . . . 1 1 1302 1 . . . 1 1 1303 1 . . . 1 1 1304 1 . . . 1 1 1305 1 . . . 1 1 1306 1 . . . 1 1 1307 1 . . . 1 1 1308 1 . . . 1 1 1309 1 . . . 1 1 1310 1 . . . 1 1 1311 1 . . . 1 1 1312 1 . . . 1 1 1313 1 . . . 1 1 1314 1 . . . 1 1 1315 1 . . . 1 1 1316 1 . . . 1 1 1317 1 . . . 1 1 1318 1 . . . 1 1 1319 1 . . . 1 1 1320 1 . . . 1 1 1321 1 . . . 1 1 1322 1 . . . 1 1 1323 1 . . . 1 1 1324 1 . . . 1 1 1325 1 . . . 1 1 1326 1 . . . 1 1 1327 1 . . . 1 1 1328 1 . . . 1 1 1329 1 . . . 1 1 1330 1 . . . 1 1 1331 1 . . . 1 1 1332 1 . . . 1 1 1333 1 . . . 1 1 1334 1 . . . 1 1 1335 1 . . . 1 1 1336 1 . . . 1 1 1337 1 . . . 1 1 1338 1 . . . 1 1 1339 1 . . . 1 1 1340 1 . . . 1 1 1341 1 . . . 1 1 1342 1 . . . 1 1 1343 1 . . . 1 1 1344 1 . . . 1 1 1345 1 . . . 1 1 1346 1 . . . 1 1 1347 1 . . . 1 1 1348 1 . . . 1 1 1349 1 . . . 1 1 1350 1 . . . 1 1 1351 1 . . . 1 1 1352 1 . . . 1 1 1353 1 . . . 1 1 1354 1 . . . 1 1 1355 1 . . . 1 1 1356 1 . . . 1 1 1357 1 . . . 1 1 1358 1 . . . 1 1 1359 1 . . . 1 1 1360 1 . . . 1 1 1361 1 . . . 1 1 1362 1 . . . 1 1 1363 1 . . . 1 1 1364 1 . . . 1 1 1365 1 . . . 1 1 1366 1 . . . 1 1 1367 1 . . . 1 1 1368 1 . . . 1 1 1369 1 . . . 1 1 1370 1 . . . 1 1 1371 1 . . . 1 1 1372 1 . . . 1 1 1373 1 . . . 1 1 1374 1 . . . 1 1 1375 1 . . . 1 1 1376 1 . . . 1 1 1377 1 . . . 1 1 1378 1 . . . 1 1 1379 1 . . . 1 1 1380 1 . . . 1 1 1381 1 . . . 1 1 1382 1 . . . 1 1 1383 1 . . . 1 1 1384 1 . . . 1 1 1385 1 . . . 1 1 1386 1 . . . 1 1 1387 1 . . . 1 1 1388 1 . . . 1 1 1389 1 . . . 1 1 1390 1 . . . 1 1 1391 1 . . . 1 1 1392 1 . . . 1 1 1393 1 . . . 1 1 1394 1 . . . 1 1 1395 1 . . . 1 1 1396 1 . . . 1 1 1397 1 . . . 1 1 1398 1 . . . 1 1 1399 1 . . . 1 1 1400 1 . . . 1 1 1401 1 . . . 1 1 1402 1 . . . 1 1 1403 1 . . . 1 1 1404 1 . . . 1 1 1405 1 . . . 1 1 1406 1 . . . 1 1 1407 1 . . . 1 1 1408 1 . . . 1 1 1409 1 . . . 1 1 1410 1 . . . 1 1 1411 1 . . . 1 1 1412 1 . . . 1 1 1413 1 . . . 1 1 1414 1 . . . 1 1 1415 1 . . . 1 1 1416 1 . . . 1 1 1417 1 . . . 1 1 1418 1 . . . 1 1 1419 1 . . . 1 1 1420 1 . . . 1 1 1421 1 . . . 1 1 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 1 ALA HA . 1 ALA HA 1 1 1 1 2 1 1 2 PRO HD2 . 2 PRO HD2 1 1 2 1 1 1 1 1 ALA HA . 1 ALA HA 1 1 2 1 2 1 1 2 PRO QD . 2 PRO QD 1 1 3 1 1 1 1 1 ALA HA . 1 ALA HA 1 1 3 1 2 1 1 2 PRO HD3 . 2 PRO HD3 1 1 4 1 1 1 1 1 ALA MB . 1 ALA QB 1 1 4 1 2 1 1 2 PRO QD . 2 PRO QD 1 1 5 1 1 1 1 2 PRO QD . 2 PRO QD 1 1 5 1 2 1 1 43 TYR QD . 43 TYRF QD 1 1 6 1 1 1 1 2 PRO QD . 2 PRO QD 1 1 6 1 2 1 1 43 TYR QE . 43 TYRF QE 1 1 7 1 1 1 1 3 LYS HA . 3 LYS HA 1 1 7 1 2 1 1 4 ALA H . 4 ALA HN 1 1 8 1 1 1 1 3 LYS HA . 3 LYS HA 1 1 8 1 2 1 1 4 ALA MB . 4 ALA QB 1 1 9 1 1 1 1 3 LYS QG . 3 LYS QG 1 1 9 1 2 1 1 4 ALA H . 4 ALA HN 1 1 10 1 1 1 1 4 ALA H . 4 ALA HN 1 1 10 1 2 1 1 4 ALA MB . 4 ALA QB 1 1 11 1 1 1 1 4 ALA HA . 4 ALA HA 1 1 11 1 2 1 1 5 PRO HD2 . 5 PRO HD2 1 1 12 1 1 1 1 4 ALA HA . 4 ALA HA 1 1 12 1 2 1 1 5 PRO HD3 . 5 PRO HD3 1 1 13 1 1 1 1 4 ALA HA . 4 ALA HA 1 1 13 1 2 1 1 5 PRO QG . 5 PRO QG 1 1 14 1 1 1 1 4 ALA HA . 4 ALA HA 1 1 14 1 2 1 1 22 HIS HD2 . 22 HISH HD2 1 1 15 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 15 1 2 1 1 5 PRO HD2 . 5 PRO HD2 1 1 16 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 16 1 2 1 1 5 PRO HD3 . 5 PRO HD3 1 1 17 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 17 1 2 1 1 6 ALA HA . 6 ALA HA 1 1 18 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 18 1 2 1 1 22 HIS HA . 22 HISH HA 1 1 19 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 19 1 2 1 1 22 HIS HB2 . 22 HISH HB2 1 1 20 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 20 1 2 1 1 22 HIS HB3 . 22 HISH HB3 1 1 21 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 21 1 2 1 1 22 HIS HD1 . 22 HISH HD1 1 1 22 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 22 1 2 1 1 22 HIS HD2 . 22 HISH HD2 1 1 23 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 23 1 2 1 1 22 HIS HE1 . 22 HISH HE1 1 1 24 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 24 1 2 1 1 26 LYS HA . 26 LYS HA 1 1 25 1 1 1 1 4 ALA MB . 4 ALA QB 1 1 25 1 2 1 1 30 CYS HA . 30 CYSH HA 1 1 26 1 1 1 1 5 PRO HA . 5 PRO HA 1 1 26 1 2 1 1 6 ALA H . 6 ALA HN 1 1 27 1 1 1 1 5 PRO HA . 5 PRO HA 1 1 27 1 2 1 1 6 ALA MB . 6 ALA QB 1 1 28 1 1 1 1 5 PRO HB2 . 5 PRO HB2 1 1 28 1 2 1 1 6 ALA H . 6 ALA HN 1 1 29 1 1 1 1 5 PRO HB2 . 5 PRO HB2 1 1 29 1 2 1 1 22 HIS HE1 . 22 HISH HE1 1 1 30 1 1 1 1 5 PRO HB3 . 5 PRO HB3 1 1 30 1 2 1 1 6 ALA H . 6 ALA HN 1 1 31 1 1 1 1 5 PRO HD2 . 5 PRO HD2 1 1 31 1 2 1 1 22 HIS HA . 22 HISH HA 1 1 32 1 1 1 1 5 PRO HD2 . 5 PRO HD2 1 1 32 1 2 1 1 22 HIS HB2 . 22 HISH HB2 1 1 33 1 1 1 1 5 PRO HD2 . 5 PRO HD2 1 1 33 1 2 1 1 22 HIS HB3 . 22 HISH HB3 1 1 34 1 1 1 1 5 PRO HD2 . 5 PRO HD2 1 1 34 1 2 1 1 22 HIS HD1 . 22 HISH HD1 1 1 35 1 1 1 1 5 PRO HD2 . 5 PRO HD2 1 1 35 1 2 1 1 22 HIS HD2 . 22 HISH HD2 1 1 36 1 1 1 1 5 PRO HD2 . 5 PRO HD2 1 1 36 1 2 1 1 22 HIS HE1 . 22 HISH HE1 1 1 37 1 1 1 1 5 PRO HD3 . 5 PRO HD3 1 1 37 1 2 1 1 22 HIS HD1 . 22 HISH HD1 1 1 38 1 1 1 1 5 PRO QG . 5 PRO QG 1 1 38 1 2 1 1 9 LEU MD2 . 9 LEU QD2 1 1 39 1 1 1 1 5 PRO QG . 5 PRO QG 1 1 39 1 2 1 1 22 HIS HD1 . 22 HISH HD1 1 1 40 1 1 1 1 5 PRO QG . 5 PRO QG 1 1 40 1 2 1 1 22 HIS HD2 . 22 HISH HD2 1 1 41 1 1 1 1 5 PRO QG . 5 PRO QG 1 1 41 1 2 1 1 22 HIS HE1 . 22 HISH HE1 1 1 42 1 1 1 1 6 ALA H . 6 ALA HN 1 1 42 1 2 1 1 6 ALA MB . 6 ALA QB 1 1 43 1 1 1 1 6 ALA HA . 6 ALA HA 1 1 43 1 2 1 1 7 ASP H . 7 ASP- HN 1 1 44 1 1 1 1 6 ALA MB . 6 ALA QB 1 1 44 1 2 1 1 7 ASP H . 7 ASP- HN 1 1 45 1 1 1 1 6 ALA MB . 6 ALA QB 1 1 45 1 2 1 1 7 ASP HA . 7 ASP- HA 1 1 46 1 1 1 1 7 ASP HA . 7 ASP- HA 1 1 46 1 2 1 1 9 LEU H . 9 LEU HN 1 1 47 1 1 1 1 7 ASP HA . 7 ASP- HA 1 1 47 1 2 1 1 21 ASN HA . 21 ASN HA 1 1 48 1 1 1 1 7 ASP HA . 7 ASP- HA 1 1 48 1 2 1 1 22 HIS H . 22 HISH HN 1 1 49 1 1 1 1 7 ASP QB . 7 ASP- QB 1 1 49 1 2 1 1 9 LEU H . 9 LEU HN 1 1 50 1 1 1 1 7 ASP HB2 . 7 ASP- HB2 1 1 50 1 2 1 1 8 GLY H . 8 GLY HN 1 1 51 1 1 1 1 7 ASP HB3 . 7 ASP- HB3 1 1 51 1 2 1 1 8 GLY H . 8 GLY HN 1 1 52 1 1 1 1 8 GLY H . 8 GLY HN 1 1 52 1 2 1 1 21 ASN HA . 21 ASN HA 1 1 53 1 1 1 1 8 GLY HA2 . 8 GLY HA1 1 1 53 1 2 1 1 9 LEU H . 9 LEU HN 1 1 54 1 1 1 1 8 GLY HA2 . 8 GLY HA1 1 1 54 1 2 1 1 19 VAL MG1 . 19 VAL QG1 1 1 55 1 1 1 1 8 GLY HA3 . 8 GLY HA2 1 1 55 1 2 1 1 19 VAL MG1 . 19 VAL QG1 1 1 56 1 1 1 1 8 GLY HA3 . 8 GLY HA2 1 1 56 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 57 1 1 1 1 9 LEU H . 9 LEU HN 1 1 57 1 2 1 1 9 LEU HB3 . 9 LEU HB3 1 1 58 1 1 1 1 9 LEU H . 9 LEU HN 1 1 58 1 2 1 1 9 LEU MD1 . 9 LEU QD1 1 1 59 1 1 1 1 9 LEU H . 9 LEU HN 1 1 59 1 2 1 1 9 LEU MD2 . 9 LEU QD2 1 1 60 1 1 1 1 9 LEU H . 9 LEU HN 1 1 60 1 2 1 1 10 LYS H . 10 LYS HN 1 1 61 1 1 1 1 9 LEU H . 9 LEU HN 1 1 61 1 2 1 1 19 VAL MG1 . 19 VAL QG1 1 1 62 1 1 1 1 9 LEU H . 9 LEU HN 1 1 62 1 2 1 1 20 PHE H . 20 PHEF HN 1 1 63 1 1 1 1 9 LEU HA . 9 LEU HA 1 1 63 1 2 1 1 9 LEU MD1 . 9 LEU QD1 1 1 64 1 1 1 1 9 LEU HA . 9 LEU HA 1 1 64 1 2 1 1 9 LEU MD2 . 9 LEU QD2 1 1 65 1 1 1 1 9 LEU HA . 9 LEU HA 1 1 65 1 2 1 1 10 LYS H . 10 LYS HN 1 1 66 1 1 1 1 9 LEU HA . 9 LEU HA 1 1 66 1 2 1 1 10 LYS HA . 10 LYS HA 1 1 67 1 1 1 1 9 LEU HA . 9 LEU HA 1 1 67 1 2 1 1 10 LYS QB . 10 LYS QB 1 1 68 1 1 1 1 9 LEU HA . 9 LEU HA 1 1 68 1 2 1 1 11 MET H . 11 MET HN 1 1 69 1 1 1 1 9 LEU HA . 9 LEU HA 1 1 69 1 2 1 1 19 VAL MG1 . 19 VAL QG1 1 1 70 1 1 1 1 9 LEU HA . 9 LEU HA 1 1 70 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 71 1 1 1 1 9 LEU HB3 . 9 LEU HB3 1 1 71 1 2 1 1 10 LYS H . 10 LYS HN 1 1 72 1 1 1 1 9 LEU HB3 . 9 LEU HB3 1 1 72 1 2 1 1 20 PHE H . 20 PHEF HN 1 1 73 1 1 1 1 9 LEU HB3 . 9 LEU HB3 1 1 73 1 2 1 1 20 PHE HB2 . 20 PHEF HB2 1 1 74 1 1 1 1 9 LEU HB3 . 9 LEU HB3 1 1 74 1 2 1 1 20 PHE HB3 . 20 PHEF HB3 1 1 75 1 1 1 1 9 LEU MD1 . 9 LEU QD1 1 1 75 1 2 1 1 10 LYS H . 10 LYS HN 1 1 76 1 1 1 1 9 LEU MD1 . 9 LEU QD1 1 1 76 1 2 1 1 11 MET QG . 11 MET QG 1 1 77 1 1 1 1 9 LEU MD1 . 9 LEU QD1 1 1 77 1 2 1 1 19 VAL HA . 19 VAL HA 1 1 78 1 1 1 1 9 LEU MD1 . 9 LEU QD1 1 1 78 1 2 1 1 20 PHE H . 20 PHEF HN 1 1 79 1 1 1 1 9 LEU MD1 . 9 LEU QD1 1 1 79 1 2 1 1 20 PHE QD . 20 PHEF QD 1 1 80 1 1 1 1 9 LEU MD1 . 9 LEU QD1 1 1 80 1 2 1 1 22 HIS H . 22 HISH HN 1 1 81 1 1 1 1 9 LEU MD2 . 9 LEU QD2 1 1 81 1 2 1 1 10 LYS H . 10 LYS HN 1 1 82 1 1 1 1 9 LEU MD2 . 9 LEU QD2 1 1 82 1 2 1 1 10 LYS HA . 10 LYS HA 1 1 83 1 1 1 1 9 LEU MD2 . 9 LEU QD2 1 1 83 1 2 1 1 10 LYS QB . 10 LYS QB 1 1 84 1 1 1 1 9 LEU MD2 . 9 LEU QD2 1 1 84 1 2 1 1 11 MET H . 11 MET HN 1 1 85 1 1 1 1 9 LEU MD2 . 9 LEU QD2 1 1 85 1 2 1 1 11 MET HA . 11 MET HA 1 1 86 1 1 1 1 9 LEU MD2 . 9 LEU QD2 1 1 86 1 2 1 1 11 MET QG . 11 MET QG 1 1 87 1 1 1 1 9 LEU MD2 . 9 LEU QD2 1 1 87 1 2 1 1 12 GLU H . 12 GLU- HN 1 1 88 1 1 1 1 9 LEU MD2 . 9 LEU QD2 1 1 88 1 2 1 1 20 PHE H . 20 PHEF HN 1 1 89 1 1 1 1 9 LEU MD2 . 9 LEU QD2 1 1 89 1 2 1 1 20 PHE QD . 20 PHEF QD 1 1 90 1 1 1 1 9 LEU MD2 . 9 LEU QD2 1 1 90 1 2 1 1 45 LYS HA . 45 LYS HA 1 1 91 1 1 1 1 9 LEU MD2 . 9 LEU QD2 1 1 91 1 2 1 1 45 LYS HG3 . 45 LYS HG3 1 1 92 1 1 1 1 9 LEU HG . 9 LEU HG 1 1 92 1 2 1 1 22 HIS HD1 . 22 HISH HD1 1 1 93 1 1 1 1 10 LYS H . 10 LYS HN 1 1 93 1 2 1 1 10 LYS QB . 10 LYS QB 1 1 94 1 1 1 1 10 LYS H . 10 LYS HN 1 1 94 1 2 1 1 10 LYS HG2 . 10 LYS HG2 1 1 95 1 1 1 1 10 LYS H . 10 LYS HN 1 1 95 1 2 1 1 10 LYS HG3 . 10 LYS HG3 1 1 96 1 1 1 1 10 LYS H . 10 LYS HN 1 1 96 1 2 1 1 11 MET H . 11 MET HN 1 1 97 1 1 1 1 10 LYS H . 10 LYS HN 1 1 97 1 2 1 1 19 VAL MG1 . 19 VAL QG1 1 1 98 1 1 1 1 10 LYS H . 10 LYS HN 1 1 98 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 99 1 1 1 1 10 LYS H . 10 LYS HN 1 1 99 1 2 1 1 20 PHE H . 20 PHEF HN 1 1 100 1 1 1 1 10 LYS HA . 10 LYS HA 1 1 100 1 2 1 1 11 MET H . 11 MET HN 1 1 101 1 1 1 1 10 LYS HA . 10 LYS HA 1 1 101 1 2 1 1 18 VAL H . 18 VAL HN 1 1 102 1 1 1 1 10 LYS QB . 10 LYS QB 1 1 102 1 2 1 1 11 MET H . 11 MET HN 1 1 103 1 1 1 1 10 LYS QB . 10 LYS QB 1 1 103 1 2 1 1 18 VAL H . 18 VAL HN 1 1 104 1 1 1 1 10 LYS QB . 10 LYS QB 1 1 104 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 105 1 1 1 1 10 LYS QD . 10 LYS QD 1 1 105 1 2 1 1 12 GLU HB3 . 12 GLU- HB3 1 1 106 1 1 1 1 10 LYS QD . 10 LYS QD 1 1 106 1 2 1 1 19 VAL MG1 . 19 VAL QG1 1 1 107 1 1 1 1 10 LYS QD . 10 LYS QD 1 1 107 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 108 1 1 1 1 10 LYS QE . 10 LYS QE 1 1 108 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 109 1 1 1 1 10 LYS HE2 . 10 LYS HE2 1 1 109 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 110 1 1 1 1 10 LYS HE3 . 10 LYS HE3 1 1 110 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 111 1 1 1 1 10 LYS HG2 . 10 LYS HG2 1 1 111 1 2 1 1 11 MET H . 11 MET HN 1 1 112 1 1 1 1 10 LYS HG3 . 10 LYS HG3 1 1 112 1 2 1 1 11 MET H . 11 MET HN 1 1 113 1 1 1 1 10 LYS HG3 . 10 LYS HG3 1 1 113 1 2 1 1 12 GLU H . 12 GLU- HN 1 1 114 1 1 1 1 10 LYS HG3 . 10 LYS HG3 1 1 114 1 2 1 1 19 VAL H . 19 VAL HN 1 1 115 1 1 1 1 11 MET H . 11 MET HN 1 1 115 1 2 1 1 11 MET QB . 11 MET QB 1 1 116 1 1 1 1 11 MET H . 11 MET HN 1 1 116 1 2 1 1 11 MET QG . 11 MET QG 1 1 117 1 1 1 1 11 MET H . 11 MET HN 1 1 117 1 2 1 1 12 GLU H . 12 GLU- HN 1 1 118 1 1 1 1 11 MET H . 11 MET HN 1 1 118 1 2 1 1 12 GLU HA . 12 GLU- HA 1 1 119 1 1 1 1 11 MET H . 11 MET HN 1 1 119 1 2 1 1 18 VAL H . 18 VAL HN 1 1 120 1 1 1 1 11 MET H . 11 MET HN 1 1 120 1 2 1 1 18 VAL HA . 18 VAL HA 1 1 121 1 1 1 1 11 MET H . 11 MET HN 1 1 121 1 2 1 1 18 VAL HB . 18 VAL HB 1 1 122 1 1 1 1 11 MET H . 11 MET HN 1 1 122 1 2 1 1 18 VAL MG1 . 18 VAL QG1 1 1 123 1 1 1 1 11 MET H . 11 MET HN 1 1 123 1 2 1 1 18 VAL MG2 . 18 VAL QG2 1 1 124 1 1 1 1 11 MET H . 11 MET HN 1 1 124 1 2 1 1 19 VAL H . 19 VAL HN 1 1 125 1 1 1 1 11 MET H . 11 MET HN 1 1 125 1 2 1 1 19 VAL MG1 . 19 VAL QG1 1 1 126 1 1 1 1 11 MET H . 11 MET HN 1 1 126 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 127 1 1 1 1 11 MET H . 11 MET HN 1 1 127 1 2 1 1 20 PHE H . 20 PHEF HN 1 1 128 1 1 1 1 11 MET HA . 11 MET HA 1 1 128 1 2 1 1 11 MET QG . 11 MET QG 1 1 129 1 1 1 1 11 MET HA . 11 MET HA 1 1 129 1 2 1 1 12 GLU H . 12 GLU- HN 1 1 130 1 1 1 1 11 MET HA . 11 MET HA 1 1 130 1 2 1 1 12 GLU HA . 12 GLU- HA 1 1 131 1 1 1 1 11 MET HA . 11 MET HA 1 1 131 1 2 1 1 12 GLU HB2 . 12 GLU- HB2 1 1 132 1 1 1 1 11 MET HA . 11 MET HA 1 1 132 1 2 1 1 13 ALA H . 13 ALA HN 1 1 133 1 1 1 1 11 MET HA . 11 MET HA 1 1 133 1 2 1 1 13 ALA MB . 13 ALA QB 1 1 134 1 1 1 1 11 MET QB . 11 MET QB 1 1 134 1 2 1 1 13 ALA H . 13 ALA HN 1 1 135 1 1 1 1 11 MET QB . 11 MET QB 1 1 135 1 2 1 1 18 VAL H . 18 VAL HN 1 1 136 1 1 1 1 11 MET QB . 11 MET QB 1 1 136 1 2 1 1 18 VAL MG2 . 18 VAL QG2 1 1 137 1 1 1 1 11 MET QB . 11 MET QB 1 1 137 1 2 1 1 65 TYR QE . 65 TYRF QE 1 1 138 1 1 1 1 11 MET ME . 11 MET QE 1 1 138 1 2 1 1 12 GLU H . 12 GLU- HN 1 1 139 1 1 1 1 11 MET ME . 11 MET QE 1 1 139 1 2 1 1 13 ALA H . 13 ALA HN 1 1 140 1 1 1 1 11 MET ME . 11 MET QE 1 1 140 1 2 1 1 17 PRO HA . 17 PRO HA 1 1 141 1 1 1 1 11 MET ME . 11 MET QE 1 1 141 1 2 1 1 18 VAL MG2 . 18 VAL QG2 1 1 142 1 1 1 1 11 MET ME . 11 MET QE 1 1 142 1 2 1 1 46 CYS QB . 46 CYSH QB 1 1 143 1 1 1 1 11 MET ME . 11 MET QE 1 1 143 1 2 1 1 69 MET HB2 . 69 MET HB2 1 1 144 1 1 1 1 11 MET ME . 11 MET QE 1 1 144 1 2 1 1 69 MET ME . 69 MET QE 1 1 145 1 1 1 1 11 MET QG . 11 MET QG 1 1 145 1 2 1 1 12 GLU H . 12 GLU- HN 1 1 146 1 1 1 1 11 MET QG . 11 MET QG 1 1 146 1 2 1 1 13 ALA H . 13 ALA HN 1 1 147 1 1 1 1 11 MET QG . 11 MET QG 1 1 147 1 2 1 1 17 PRO HA . 17 PRO HA 1 1 148 1 1 1 1 11 MET QG . 11 MET QG 1 1 148 1 2 1 1 18 VAL H . 18 VAL HN 1 1 149 1 1 1 1 11 MET QG . 11 MET QG 1 1 149 1 2 1 1 18 VAL HB . 18 VAL HB 1 1 150 1 1 1 1 11 MET QG . 11 MET QG 1 1 150 1 2 1 1 18 VAL MG2 . 18 VAL QG2 1 1 151 1 1 1 1 12 GLU H . 12 GLU- HN 1 1 151 1 2 1 1 12 GLU HB2 . 12 GLU- HB2 1 1 152 1 1 1 1 12 GLU H . 12 GLU- HN 1 1 152 1 2 1 1 12 GLU HB3 . 12 GLU- HB3 1 1 153 1 1 1 1 12 GLU H . 12 GLU- HN 1 1 153 1 2 1 1 13 ALA H . 13 ALA HN 1 1 154 1 1 1 1 12 GLU H . 12 GLU- HN 1 1 154 1 2 1 1 14 THR H . 14 THR HN 1 1 155 1 1 1 1 12 GLU HA . 12 GLU- HA 1 1 155 1 2 1 1 12 GLU HG3 . 12 GLU- HG3 1 1 156 1 1 1 1 12 GLU HA . 12 GLU- HA 1 1 156 1 2 1 1 13 ALA H . 13 ALA HN 1 1 157 1 1 1 1 12 GLU HB2 . 12 GLU- HB2 1 1 157 1 2 1 1 12 GLU HG2 . 12 GLU- HG2 1 1 158 1 1 1 1 12 GLU HB2 . 12 GLU- HB2 1 1 158 1 2 1 1 12 GLU HG3 . 12 GLU- HG3 1 1 159 1 1 1 1 12 GLU HB2 . 12 GLU- HB2 1 1 159 1 2 1 1 13 ALA H . 13 ALA HN 1 1 160 1 1 1 1 12 GLU HB2 . 12 GLU- HB2 1 1 160 1 2 1 1 14 THR H . 14 THR HN 1 1 161 1 1 1 1 12 GLU HB3 . 12 GLU- HB3 1 1 161 1 2 1 1 13 ALA H . 13 ALA HN 1 1 162 1 1 1 1 12 GLU HB3 . 12 GLU- HB3 1 1 162 1 2 1 1 14 THR H . 14 THR HN 1 1 163 1 1 1 1 12 GLU HB3 . 12 GLU- HB3 1 1 163 1 2 1 1 18 VAL H . 18 VAL HN 1 1 164 1 1 1 1 12 GLU HG2 . 12 GLU- HG2 1 1 164 1 2 1 1 13 ALA H . 13 ALA HN 1 1 165 1 1 1 1 12 GLU HG2 . 12 GLU- HG2 1 1 165 1 2 1 1 14 THR H . 14 THR HN 1 1 166 1 1 1 1 12 GLU HG3 . 12 GLU- HG3 1 1 166 1 2 1 1 13 ALA H . 13 ALA HN 1 1 167 1 1 1 1 13 ALA H . 13 ALA HN 1 1 167 1 2 1 1 13 ALA MB . 13 ALA QB 1 1 168 1 1 1 1 13 ALA H . 13 ALA HN 1 1 168 1 2 1 1 14 THR H . 14 THR HN 1 1 169 1 1 1 1 13 ALA H . 13 ALA HN 1 1 169 1 2 1 1 14 THR HA . 14 THR HA 1 1 170 1 1 1 1 13 ALA H . 13 ALA HN 1 1 170 1 2 1 1 14 THR HG1 . 14 THR HG1 1 1 171 1 1 1 1 13 ALA H . 13 ALA HN 1 1 171 1 2 1 1 14 THR MG . 14 THR QG2 1 1 172 1 1 1 1 13 ALA H . 13 ALA HN 1 1 172 1 2 1 1 17 PRO HB3 . 17 PRO HB3 1 1 173 1 1 1 1 13 ALA H . 13 ALA HN 1 1 173 1 2 1 1 17 PRO QG . 17 PRO QG 1 1 174 1 1 1 1 13 ALA H . 13 ALA HN 1 1 174 1 2 1 1 55 MET ME . 55 MET QE 1 1 175 1 1 1 1 13 ALA HA . 13 ALA HA 1 1 175 1 2 1 1 14 THR H . 14 THR HN 1 1 176 1 1 1 1 13 ALA HA . 13 ALA HA 1 1 176 1 2 1 1 14 THR MG . 14 THR QG2 1 1 177 1 1 1 1 13 ALA MB . 13 ALA QB 1 1 177 1 2 1 1 14 THR H . 14 THR HN 1 1 178 1 1 1 1 13 ALA MB . 13 ALA QB 1 1 178 1 2 1 1 14 THR HA . 14 THR HA 1 1 179 1 1 1 1 13 ALA MB . 13 ALA QB 1 1 179 1 2 1 1 14 THR HB . 14 THR HB 1 1 180 1 1 1 1 13 ALA MB . 13 ALA QB 1 1 180 1 2 1 1 14 THR MG . 14 THR QG2 1 1 181 1 1 1 1 13 ALA MB . 13 ALA QB 1 1 181 1 2 1 1 55 MET HA . 55 MET HA 1 1 182 1 1 1 1 13 ALA MB . 13 ALA QB 1 1 182 1 2 1 1 65 TYR QD . 65 TYRF QD 1 1 183 1 1 1 1 14 THR H . 14 THR HN 1 1 183 1 2 1 1 14 THR HG1 . 14 THR HG1 1 1 184 1 1 1 1 14 THR H . 14 THR HN 1 1 184 1 2 1 1 14 THR MG . 14 THR QG2 1 1 185 1 1 1 1 14 THR H . 14 THR HN 1 1 185 1 2 1 1 15 LYS H . 15 LYS HN 1 1 186 1 1 1 1 14 THR H . 14 THR HN 1 1 186 1 2 1 1 16 GLN H . 16 GLN HN 1 1 187 1 1 1 1 14 THR H . 14 THR HN 1 1 187 1 2 1 1 16 GLN HG2 . 16 GLN HG2 1 1 188 1 1 1 1 14 THR H . 14 THR HN 1 1 188 1 2 1 1 17 PRO HB3 . 17 PRO HB3 1 1 189 1 1 1 1 14 THR H . 14 THR HN 1 1 189 1 2 1 1 17 PRO QD . 17 PRO QD 1 1 190 1 1 1 1 14 THR H . 14 THR HN 1 1 190 1 2 1 1 17 PRO QG . 17 PRO QG 1 1 191 1 1 1 1 14 THR H . 14 THR HN 1 1 191 1 2 1 1 55 MET ME . 55 MET QE 1 1 192 1 1 1 1 14 THR HA . 14 THR HA 1 1 192 1 2 1 1 14 THR MG . 14 THR QG2 1 1 193 1 1 1 1 14 THR HA . 14 THR HA 1 1 193 1 2 1 1 15 LYS H . 15 LYS HN 1 1 194 1 1 1 1 14 THR HA . 14 THR HA 1 1 194 1 2 1 1 15 LYS HB2 . 15 LYS HB2 1 1 195 1 1 1 1 14 THR HA . 14 THR HA 1 1 195 1 2 1 1 15 LYS HB3 . 15 LYS HB3 1 1 196 1 1 1 1 14 THR HA . 14 THR HA 1 1 196 1 2 1 1 15 LYS QD . 15 LYS QD 1 1 197 1 1 1 1 14 THR HA . 14 THR HA 1 1 197 1 2 1 1 15 LYS QG . 15 LYS QG 1 1 198 1 1 1 1 14 THR HA . 14 THR HA 1 1 198 1 2 1 1 16 GLN H . 16 GLN HN 1 1 199 1 1 1 1 14 THR HA . 14 THR HA 1 1 199 1 2 1 1 16 GLN HB2 . 16 GLN HB2 1 1 200 1 1 1 1 14 THR HA . 14 THR HA 1 1 200 1 2 1 1 55 MET ME . 55 MET QE 1 1 201 1 1 1 1 14 THR HB . 14 THR HB 1 1 201 1 2 1 1 15 LYS H . 15 LYS HN 1 1 202 1 1 1 1 14 THR HB . 14 THR HB 1 1 202 1 2 1 1 15 LYS HA . 15 LYS HA 1 1 203 1 1 1 1 14 THR HB . 14 THR HB 1 1 203 1 2 1 1 15 LYS HB2 . 15 LYS HB2 1 1 204 1 1 1 1 14 THR HB . 14 THR HB 1 1 204 1 2 1 1 15 LYS HB3 . 15 LYS HB3 1 1 205 1 1 1 1 14 THR HB . 14 THR HB 1 1 205 1 2 1 1 15 LYS QG . 15 LYS QG 1 1 206 1 1 1 1 14 THR HB . 14 THR HB 1 1 206 1 2 1 1 16 GLN H . 16 GLN HN 1 1 207 1 1 1 1 14 THR HB . 14 THR HB 1 1 207 1 2 1 1 16 GLN HB2 . 16 GLN HB2 1 1 208 1 1 1 1 14 THR HB . 14 THR HB 1 1 208 1 2 1 1 16 GLN HB3 . 16 GLN HB3 1 1 209 1 1 1 1 14 THR HB . 14 THR HB 1 1 209 1 2 1 1 16 GLN HG3 . 16 GLN HG3 1 1 210 1 1 1 1 14 THR HB . 14 THR HB 1 1 210 1 2 1 1 55 MET ME . 55 MET QE 1 1 211 1 1 1 1 14 THR HG1 . 14 THR HG1 1 1 211 1 2 1 1 16 GLN H . 16 GLN HN 1 1 212 1 1 1 1 14 THR MG . 14 THR QG2 1 1 212 1 2 1 1 15 LYS H . 15 LYS HN 1 1 213 1 1 1 1 14 THR MG . 14 THR QG2 1 1 213 1 2 1 1 16 GLN H . 16 GLN HN 1 1 214 1 1 1 1 14 THR MG . 14 THR QG2 1 1 214 1 2 1 1 18 VAL MG2 . 18 VAL QG2 1 1 215 1 1 1 1 15 LYS H . 15 LYS HN 1 1 215 1 2 1 1 15 LYS HB2 . 15 LYS HB2 1 1 216 1 1 1 1 15 LYS H . 15 LYS HN 1 1 216 1 2 1 1 15 LYS QD . 15 LYS QD 1 1 217 1 1 1 1 15 LYS H . 15 LYS HN 1 1 217 1 2 1 1 15 LYS QG . 15 LYS QG 1 1 218 1 1 1 1 15 LYS H . 15 LYS HN 1 1 218 1 2 1 1 16 GLN H . 16 GLN HN 1 1 219 1 1 1 1 15 LYS H . 15 LYS HN 1 1 219 1 2 1 1 17 PRO QD . 17 PRO QD 1 1 220 1 1 1 1 15 LYS HA . 15 LYS HA 1 1 220 1 2 1 1 15 LYS HB2 . 15 LYS HB2 1 1 221 1 1 1 1 15 LYS HA . 15 LYS HA 1 1 221 1 2 1 1 15 LYS QG . 15 LYS QG 1 1 222 1 1 1 1 15 LYS HB2 . 15 LYS HB2 1 1 222 1 2 1 1 16 GLN H . 16 GLN HN 1 1 223 1 1 1 1 15 LYS HB3 . 15 LYS HB3 1 1 223 1 2 1 1 16 GLN H . 16 GLN HN 1 1 224 1 1 1 1 15 LYS HB3 . 15 LYS HB3 1 1 224 1 2 1 1 16 GLN HB3 . 16 GLN HB3 1 1 225 1 1 1 1 15 LYS QG . 15 LYS QG 1 1 225 1 2 1 1 16 GLN H . 16 GLN HN 1 1 226 1 1 1 1 16 GLN H . 16 GLN HN 1 1 226 1 2 1 1 16 GLN HB2 . 16 GLN HB2 1 1 227 1 1 1 1 16 GLN H . 16 GLN HN 1 1 227 1 2 1 1 16 GLN HG2 . 16 GLN HG2 1 1 228 1 1 1 1 16 GLN H . 16 GLN HN 1 1 228 1 2 1 1 16 GLN HG3 . 16 GLN HG3 1 1 229 1 1 1 1 16 GLN H . 16 GLN HN 1 1 229 1 2 1 1 17 PRO HA . 17 PRO HA 1 1 230 1 1 1 1 16 GLN H . 16 GLN HN 1 1 230 1 2 1 1 17 PRO QD . 17 PRO QD 1 1 231 1 1 1 1 16 GLN H . 16 GLN HN 1 1 231 1 2 1 1 17 PRO QG . 17 PRO QG 1 1 232 1 1 1 1 16 GLN HA . 16 GLN HA 1 1 232 1 2 1 1 16 GLN HB3 . 16 GLN HB3 1 1 233 1 1 1 1 16 GLN HA . 16 GLN HA 1 1 233 1 2 1 1 16 GLN HG2 . 16 GLN HG2 1 1 234 1 1 1 1 16 GLN HB2 . 16 GLN HB2 1 1 234 1 2 1 1 16 GLN HE21 . 16 GLN HE21 1 1 235 1 1 1 1 16 GLN HB2 . 16 GLN HB2 1 1 235 1 2 1 1 16 GLN HE22 . 16 GLN HE22 1 1 236 1 1 1 1 16 GLN HB2 . 16 GLN HB2 1 1 236 1 2 1 1 106 HIS HE1 . 106 HISH HE1 1 1 237 1 1 1 1 16 GLN HB3 . 16 GLN HB3 1 1 237 1 2 1 1 16 GLN HE21 . 16 GLN HE21 1 1 238 1 1 1 1 16 GLN HB3 . 16 GLN HB3 1 1 238 1 2 1 1 16 GLN HE22 . 16 GLN HE22 1 1 239 1 1 1 1 16 GLN HB3 . 16 GLN HB3 1 1 239 1 2 1 1 17 PRO QD . 17 PRO QD 1 1 240 1 1 1 1 16 GLN HB3 . 16 GLN HB3 1 1 240 1 2 1 1 18 VAL MG2 . 18 VAL QG2 1 1 241 1 1 1 1 16 GLN HB3 . 16 GLN HB3 1 1 241 1 2 1 1 106 HIS HA . 106 HISH HA 1 1 242 1 1 1 1 16 GLN HB3 . 16 GLN HB3 1 1 242 1 2 1 1 106 HIS HD1 . 106 HISH HD1 1 1 243 1 1 1 1 16 GLN HB3 . 16 GLN HB3 1 1 243 1 2 1 1 106 HIS HE1 . 106 HISH HE1 1 1 244 1 1 1 1 16 GLN HE21 . 16 GLN HE21 1 1 244 1 2 1 1 106 HIS HD1 . 106 HISH HD1 1 1 245 1 1 1 1 16 GLN HE22 . 16 GLN HE22 1 1 245 1 2 1 1 106 HIS HD1 . 106 HISH HD1 1 1 246 1 1 1 1 16 GLN HE22 . 16 GLN HE22 1 1 246 1 2 1 1 106 HIS HE1 . 106 HISH HE1 1 1 247 1 1 1 1 16 GLN HG3 . 16 GLN HG3 1 1 247 1 2 1 1 17 PRO QD . 17 PRO QD 1 1 248 1 1 1 1 17 PRO HA . 17 PRO HA 1 1 248 1 2 1 1 18 VAL HA . 18 VAL HA 1 1 249 1 1 1 1 17 PRO HA . 17 PRO HA 1 1 249 1 2 1 1 18 VAL MG2 . 18 VAL QG2 1 1 250 1 1 1 1 17 PRO HA . 17 PRO HA 1 1 250 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 251 1 1 1 1 17 PRO HA . 17 PRO HA 1 1 251 1 2 1 1 106 HIS HE1 . 106 HISH HE1 1 1 252 1 1 1 1 17 PRO HB2 . 17 PRO HB2 1 1 252 1 2 1 1 18 VAL H . 18 VAL HN 1 1 253 1 1 1 1 17 PRO HB2 . 17 PRO HB2 1 1 253 1 2 1 1 18 VAL MG2 . 18 VAL QG2 1 1 254 1 1 1 1 17 PRO QD . 17 PRO QD 1 1 254 1 2 1 1 18 VAL MG2 . 18 VAL QG2 1 1 255 1 1 1 1 18 VAL H . 18 VAL HN 1 1 255 1 2 1 1 18 VAL HB . 18 VAL HB 1 1 256 1 1 1 1 18 VAL H . 18 VAL HN 1 1 256 1 2 1 1 18 VAL MG2 . 18 VAL QG2 1 1 257 1 1 1 1 18 VAL H . 18 VAL HN 1 1 257 1 2 1 1 19 VAL H . 19 VAL HN 1 1 258 1 1 1 1 18 VAL H . 18 VAL HN 1 1 258 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 259 1 1 1 1 18 VAL HA . 18 VAL HA 1 1 259 1 2 1 1 18 VAL MG1 . 18 VAL QG1 1 1 260 1 1 1 1 18 VAL HA . 18 VAL HA 1 1 260 1 2 1 1 18 VAL MG2 . 18 VAL QG2 1 1 261 1 1 1 1 18 VAL HA . 18 VAL HA 1 1 261 1 2 1 1 19 VAL H . 19 VAL HN 1 1 262 1 1 1 1 18 VAL HA . 18 VAL HA 1 1 262 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 263 1 1 1 1 18 VAL HA . 18 VAL HA 1 1 263 1 2 1 1 106 HIS HE1 . 106 HISH HE1 1 1 264 1 1 1 1 18 VAL HB . 18 VAL HB 1 1 264 1 2 1 1 19 VAL H . 19 VAL HN 1 1 265 1 1 1 1 18 VAL MG1 . 18 VAL QG1 1 1 265 1 2 1 1 19 VAL H . 19 VAL HN 1 1 266 1 1 1 1 18 VAL MG1 . 18 VAL QG1 1 1 266 1 2 1 1 20 PHE H . 20 PHEF HN 1 1 267 1 1 1 1 18 VAL MG1 . 18 VAL QG1 1 1 267 1 2 1 1 20 PHE QD . 20 PHEF QD 1 1 268 1 1 1 1 18 VAL MG1 . 18 VAL QG1 1 1 268 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 269 1 1 1 1 18 VAL MG1 . 18 VAL QG1 1 1 269 1 2 1 1 105 CYS HA . 105 HEMC HA 1 1 270 1 1 1 1 18 VAL MG1 . 18 VAL QG1 1 1 270 1 2 1 1 106 HIS H . 106 HISH HN 1 1 271 1 1 1 1 18 VAL MG1 . 18 VAL QG1 1 1 271 1 2 1 1 106 HIS HD1 . 106 HISH HD1 1 1 272 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 272 1 2 1 1 19 VAL H . 19 VAL HN 1 1 273 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 273 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 274 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 274 1 2 1 1 70 HIS HE1 . 70 HISH HE1 1 1 275 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 275 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 276 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 276 1 2 1 1 105 CYS HA . 105 HEMC HA 1 1 277 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 277 1 2 1 1 105 CYS HB2 . 105 HEMC HB2 1 1 278 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 278 1 2 1 1 105 CYS HB3 . 105 HEMC HB3 1 1 279 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 279 1 2 1 1 106 HIS H . 106 HISH HN 1 1 280 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 280 1 2 1 1 106 HIS HA . 106 HISH HA 1 1 281 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 281 1 2 1 1 106 HIS HD1 . 106 HISH HD1 1 1 282 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 282 1 2 1 1 106 HIS HD2 . 106 HISH HD2 1 1 283 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 283 1 2 1 1 106 HIS HE1 . 106 HISH HE1 1 1 284 1 1 1 1 18 VAL MG2 . 18 VAL QG2 1 1 284 1 2 1 1 107 GLU H . 107 GLU- HN 1 1 285 1 1 1 1 19 VAL H . 19 VAL HN 1 1 285 1 2 1 1 19 VAL HB . 19 VAL HB 1 1 286 1 1 1 1 19 VAL H . 19 VAL HN 1 1 286 1 2 1 1 19 VAL MG1 . 19 VAL QG1 1 1 287 1 1 1 1 19 VAL H . 19 VAL HN 1 1 287 1 2 1 1 19 VAL MG2 . 19 VAL QG2 1 1 288 1 1 1 1 19 VAL H . 19 VAL HN 1 1 288 1 2 1 1 20 PHE H . 20 PHEF HN 1 1 289 1 1 1 1 19 VAL MG1 . 19 VAL QG1 1 1 289 1 2 1 1 20 PHE H . 20 PHEF HN 1 1 290 1 1 1 1 19 VAL MG1 . 19 VAL QG1 1 1 290 1 2 1 1 21 ASN H . 21 ASN HN 1 1 291 1 1 1 1 19 VAL MG1 . 19 VAL QG1 1 1 291 1 2 1 1 21 ASN HD21 . 21 ASN HD21 1 1 292 1 1 1 1 19 VAL MG1 . 19 VAL QG1 1 1 292 1 2 1 1 21 ASN HD22 . 21 ASN HD22 1 1 293 1 1 1 1 19 VAL MG2 . 19 VAL QG2 1 1 293 1 2 1 1 20 PHE H . 20 PHEF HN 1 1 294 1 1 1 1 19 VAL MG2 . 19 VAL QG2 1 1 294 1 2 1 1 21 ASN HD22 . 21 ASN HD22 1 1 295 1 1 1 1 20 PHE H . 20 PHEF HN 1 1 295 1 2 1 1 20 PHE HB2 . 20 PHEF HB2 1 1 296 1 1 1 1 20 PHE H . 20 PHEF HN 1 1 296 1 2 1 1 20 PHE HB3 . 20 PHEF HB3 1 1 297 1 1 1 1 20 PHE H . 20 PHEF HN 1 1 297 1 2 1 1 21 ASN H . 21 ASN HN 1 1 298 1 1 1 1 20 PHE HA . 20 PHEF HA 1 1 298 1 2 1 1 20 PHE HB2 . 20 PHEF HB2 1 1 299 1 1 1 1 20 PHE HA . 20 PHEF HA 1 1 299 1 2 1 1 21 ASN H . 21 ASN HN 1 1 300 1 1 1 1 20 PHE HB2 . 20 PHEF HB2 1 1 300 1 2 1 1 21 ASN H . 21 ASN HN 1 1 301 1 1 1 1 20 PHE QD . 20 PHEF QD 1 1 301 1 2 1 1 22 HIS HE1 . 22 HISH HE1 1 1 302 1 1 1 1 20 PHE QE . 20 PHEF QE 1 1 302 1 2 1 1 25 HIS HB2 . 25 HISH HB2 1 1 303 1 1 1 1 20 PHE QE . 20 PHEF QE 1 1 303 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 304 1 1 1 1 20 PHE HE1 . 20 PHEF HE1 1 1 304 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 305 1 1 1 1 20 PHE HE2 . 20 PHEF HE2 1 1 305 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 306 1 1 1 1 20 PHE HZ . 20 PHEF HZ 1 1 306 1 2 1 1 22 HIS HA . 22 HISH HA 1 1 307 1 1 1 1 20 PHE HZ . 20 PHEF HZ 1 1 307 1 2 1 1 25 HIS HB2 . 25 HISH HB2 1 1 308 1 1 1 1 20 PHE HZ . 20 PHEF HZ 1 1 308 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 309 1 1 1 1 20 PHE HZ . 20 PHEF HZ 1 1 309 1 2 1 1 25 HIS HD2 . 25 HISH HD2 1 1 310 1 1 1 1 21 ASN H . 21 ASN HN 1 1 310 1 2 1 1 21 ASN HD21 . 21 ASN HD21 1 1 311 1 1 1 1 21 ASN H . 21 ASN HN 1 1 311 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 312 1 1 1 1 21 ASN HB2 . 21 ASN HB2 1 1 312 1 2 1 1 22 HIS H . 22 HISH HN 1 1 313 1 1 1 1 21 ASN HB2 . 21 ASN HB2 1 1 313 1 2 1 1 24 THR H . 24 THR HN 1 1 314 1 1 1 1 21 ASN HB2 . 21 ASN HB2 1 1 314 1 2 1 1 24 THR MG . 24 THR QG2 1 1 315 1 1 1 1 21 ASN HB3 . 21 ASN HB3 1 1 315 1 2 1 1 24 THR H . 24 THR HN 1 1 316 1 1 1 1 21 ASN HB3 . 21 ASN HB3 1 1 316 1 2 1 1 24 THR MG . 24 THR QG2 1 1 317 1 1 1 1 21 ASN HD21 . 21 ASN HD21 1 1 317 1 2 1 1 24 THR HB . 24 THR HB 1 1 318 1 1 1 1 21 ASN HD21 . 21 ASN HD21 1 1 318 1 2 1 1 24 THR MG . 24 THR QG2 1 1 319 1 1 1 1 22 HIS H . 22 HISH HN 1 1 319 1 2 1 1 22 HIS HB2 . 22 HISH HB2 1 1 320 1 1 1 1 22 HIS H . 22 HISH HN 1 1 320 1 2 1 1 22 HIS HB3 . 22 HISH HB3 1 1 321 1 1 1 1 22 HIS H . 22 HISH HN 1 1 321 1 2 1 1 22 HIS HD1 . 22 HISH HD1 1 1 322 1 1 1 1 22 HIS H . 22 HISH HN 1 1 322 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 323 1 1 1 1 22 HIS HA . 22 HISH HA 1 1 323 1 2 1 1 22 HIS HD2 . 22 HISH HD2 1 1 324 1 1 1 1 22 HIS HA . 22 HISH HA 1 1 324 1 2 1 1 25 HIS H . 25 HISH HN 1 1 325 1 1 1 1 22 HIS HA . 22 HISH HA 1 1 325 1 2 1 1 25 HIS HB3 . 25 HISH HB3 1 1 326 1 1 1 1 22 HIS HA . 22 HISH HA 1 1 326 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 327 1 1 1 1 22 HIS HB2 . 22 HISH HB2 1 1 327 1 2 1 1 22 HIS HD2 . 22 HISH HD2 1 1 328 1 1 1 1 22 HIS HB2 . 22 HISH HB2 1 1 328 1 2 1 1 23 SER H . 23 SER HN 1 1 329 1 1 1 1 22 HIS HB2 . 22 HISH HB2 1 1 329 1 2 1 1 25 HIS H . 25 HISH HN 1 1 330 1 1 1 1 22 HIS HB3 . 22 HISH HB3 1 1 330 1 2 1 1 22 HIS HD2 . 22 HISH HD2 1 1 331 1 1 1 1 22 HIS HB3 . 22 HISH HB3 1 1 331 1 2 1 1 23 SER H . 23 SER HN 1 1 332 1 1 1 1 22 HIS HD2 . 22 HISH HD2 1 1 332 1 2 1 1 25 HIS HB3 . 25 HISH HB3 1 1 333 1 1 1 1 22 HIS HD2 . 22 HISH HD2 1 1 333 1 2 1 1 30 CYS HA . 30 CYSH HA 1 1 334 1 1 1 1 23 SER H . 23 SER HN 1 1 334 1 2 1 1 24 THR H . 24 THR HN 1 1 335 1 1 1 1 23 SER HA . 23 SER HA 1 1 335 1 2 1 1 25 HIS H . 25 HISH HN 1 1 336 1 1 1 1 23 SER HA . 23 SER HA 1 1 336 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 337 1 1 1 1 23 SER HA . 23 SER HA 1 1 337 1 2 1 1 26 LYS H . 26 LYS HN 1 1 338 1 1 1 1 23 SER HA . 23 SER HA 1 1 338 1 2 1 1 26 LYS HD2 . 26 LYS HD2 1 1 339 1 1 1 1 23 SER QB . 23 SER QB 1 1 339 1 2 1 1 26 LYS HG3 . 26 LYS HG3 1 1 340 1 1 1 1 24 THR H . 24 THR HN 1 1 340 1 2 1 1 24 THR HB . 24 THR HB 1 1 341 1 1 1 1 24 THR H . 24 THR HN 1 1 341 1 2 1 1 24 THR MG . 24 THR QG2 1 1 342 1 1 1 1 24 THR H . 24 THR HN 1 1 342 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 343 1 1 1 1 24 THR HA . 24 THR HA 1 1 343 1 2 1 1 24 THR MG . 24 THR QG2 1 1 344 1 1 1 1 24 THR HA . 24 THR HA 1 1 344 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 345 1 1 1 1 24 THR HA . 24 THR HA 1 1 345 1 2 1 1 26 LYS H . 26 LYS HN 1 1 346 1 1 1 1 24 THR HB . 24 THR HB 1 1 346 1 2 1 1 25 HIS H . 25 HISH HN 1 1 347 1 1 1 1 24 THR HB . 24 THR HB 1 1 347 1 2 1 1 25 HIS HB2 . 25 HISH HB2 1 1 348 1 1 1 1 24 THR HB . 24 THR HB 1 1 348 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 349 1 1 1 1 24 THR HB . 24 THR HB 1 1 349 1 2 1 1 25 HIS HE1 . 25 HISH HE1 1 1 350 1 1 1 1 24 THR HB . 24 THR HB 1 1 350 1 2 1 1 26 LYS H . 26 LYS HN 1 1 351 1 1 1 1 24 THR MG . 24 THR QG2 1 1 351 1 2 1 1 25 HIS H . 25 HISH HN 1 1 352 1 1 1 1 24 THR MG . 24 THR QG2 1 1 352 1 2 1 1 25 HIS HA . 25 HISH HA 1 1 353 1 1 1 1 24 THR MG . 24 THR QG2 1 1 353 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 354 1 1 1 1 24 THR MG . 24 THR QG2 1 1 354 1 2 1 1 25 HIS HD2 . 25 HISH HD2 1 1 355 1 1 1 1 24 THR MG . 24 THR QG2 1 1 355 1 2 1 1 25 HIS HE1 . 25 HISH HE1 1 1 356 1 1 1 1 24 THR MG . 24 THR QG2 1 1 356 1 2 1 1 26 LYS H . 26 LYS HN 1 1 357 1 1 1 1 25 HIS H . 25 HISH HN 1 1 357 1 2 1 1 25 HIS HB2 . 25 HISH HB2 1 1 358 1 1 1 1 25 HIS H . 25 HISH HN 1 1 358 1 2 1 1 25 HIS HB3 . 25 HISH HB3 1 1 359 1 1 1 1 25 HIS H . 25 HISH HN 1 1 359 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 360 1 1 1 1 25 HIS H . 25 HISH HN 1 1 360 1 2 1 1 25 HIS HE1 . 25 HISH HE1 1 1 361 1 1 1 1 25 HIS H . 25 HISH HN 1 1 361 1 2 1 1 26 LYS H . 26 LYS HN 1 1 362 1 1 1 1 25 HIS H . 25 HISH HN 1 1 362 1 2 1 1 26 LYS HA . 26 LYS HA 1 1 363 1 1 1 1 25 HIS H . 25 HISH HN 1 1 363 1 2 1 1 26 LYS HB2 . 26 LYS HB2 1 1 364 1 1 1 1 25 HIS H . 25 HISH HN 1 1 364 1 2 1 1 26 LYS QB . 26 LYS QB 1 1 365 1 1 1 1 25 HIS H . 25 HISH HN 1 1 365 1 2 1 1 26 LYS HB3 . 26 LYS HB3 1 1 366 1 1 1 1 25 HIS H . 25 HISH HN 1 1 366 1 2 1 1 26 LYS HG2 . 26 LYS HG2 1 1 367 1 1 1 1 25 HIS H . 25 HISH HN 1 1 367 1 2 1 1 26 LYS HG3 . 26 LYS HG3 1 1 368 1 1 1 1 25 HIS HA . 25 HISH HA 1 1 368 1 2 1 1 25 HIS HB2 . 25 HISH HB2 1 1 369 1 1 1 1 25 HIS HA . 25 HISH HA 1 1 369 1 2 1 1 25 HIS HB3 . 25 HISH HB3 1 1 370 1 1 1 1 25 HIS HA . 25 HISH HA 1 1 370 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 371 1 1 1 1 25 HIS HA . 25 HISH HA 1 1 371 1 2 1 1 26 LYS H . 26 LYS HN 1 1 372 1 1 1 1 25 HIS HA . 25 HISH HA 1 1 372 1 2 1 1 28 VAL MG2 . 28 VAL QG2 1 1 373 1 1 1 1 25 HIS HB2 . 25 HISH HB2 1 1 373 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 374 1 1 1 1 25 HIS HB2 . 25 HISH HB2 1 1 374 1 2 1 1 26 LYS H . 26 LYS HN 1 1 375 1 1 1 1 25 HIS HB2 . 25 HISH HB2 1 1 375 1 2 1 1 26 LYS HA . 26 LYS HA 1 1 376 1 1 1 1 25 HIS HB2 . 25 HISH HB2 1 1 376 1 2 1 1 28 VAL H . 28 VAL HN 1 1 377 1 1 1 1 25 HIS HB2 . 25 HISH HB2 1 1 377 1 2 1 1 28 VAL HB . 28 VAL HB 1 1 378 1 1 1 1 25 HIS HB3 . 25 HISH HB3 1 1 378 1 2 1 1 25 HIS HD1 . 25 HISH HD1 1 1 379 1 1 1 1 25 HIS HB3 . 25 HISH HB3 1 1 379 1 2 1 1 25 HIS HD2 . 25 HISH HD2 1 1 380 1 1 1 1 25 HIS HB3 . 25 HISH HB3 1 1 380 1 2 1 1 26 LYS H . 26 LYS HN 1 1 381 1 1 1 1 25 HIS HB3 . 25 HISH HB3 1 1 381 1 2 1 1 28 VAL H . 28 VAL HN 1 1 382 1 1 1 1 25 HIS HB3 . 25 HISH HB3 1 1 382 1 2 1 1 28 VAL MG2 . 28 VAL QG2 1 1 383 1 1 1 1 25 HIS HD1 . 25 HISH HD1 1 1 383 1 2 1 1 26 LYS H . 26 LYS HN 1 1 384 1 1 1 1 25 HIS HD1 . 25 HISH HD1 1 1 384 1 2 1 1 26 LYS HG3 . 26 LYS HG3 1 1 385 1 1 1 1 25 HIS HD2 . 25 HISH HD2 1 1 385 1 2 1 1 28 VAL H . 28 VAL HN 1 1 386 1 1 1 1 25 HIS HD2 . 25 HISH HD2 1 1 386 1 2 1 1 28 VAL HB . 28 VAL HB 1 1 387 1 1 1 1 25 HIS HD2 . 25 HISH HD2 1 1 387 1 2 1 1 28 VAL MG2 . 28 VAL QG2 1 1 388 1 1 1 1 26 LYS H . 26 LYS HN 1 1 388 1 2 1 1 26 LYS HA . 26 LYS HA 1 1 389 1 1 1 1 26 LYS H . 26 LYS HN 1 1 389 1 2 1 1 26 LYS QB . 26 LYS QB 1 1 390 1 1 1 1 26 LYS H . 26 LYS HN 1 1 390 1 2 1 1 26 LYS HD3 . 26 LYS HD3 1 1 391 1 1 1 1 26 LYS H . 26 LYS HN 1 1 391 1 2 1 1 26 LYS HG2 . 26 LYS HG2 1 1 392 1 1 1 1 26 LYS H . 26 LYS HN 1 1 392 1 2 1 1 26 LYS HG3 . 26 LYS HG3 1 1 393 1 1 1 1 26 LYS H . 26 LYS HN 1 1 393 1 2 1 1 28 VAL H . 28 VAL HN 1 1 394 1 1 1 1 26 LYS HA . 26 LYS HA 1 1 394 1 2 1 1 26 LYS QB . 26 LYS QB 1 1 395 1 1 1 1 26 LYS HA . 26 LYS HA 1 1 395 1 2 1 1 26 LYS HG3 . 26 LYS HG3 1 1 396 1 1 1 1 27 SER HA . 27 SER HA 1 1 396 1 2 1 1 27 SER HB2 . 27 SER HB2 1 1 397 1 1 1 1 27 SER HA . 27 SER HA 1 1 397 1 2 1 1 27 SER HB3 . 27 SER HB3 1 1 398 1 1 1 1 28 VAL H . 28 VAL HN 1 1 398 1 2 1 1 28 VAL HB . 28 VAL HB 1 1 399 1 1 1 1 28 VAL H . 28 VAL HN 1 1 399 1 2 1 1 28 VAL MG2 . 28 VAL QG2 1 1 400 1 1 1 1 28 VAL H . 28 VAL HN 1 1 400 1 2 1 1 29 LYS H . 29 LYS HN 1 1 401 1 1 1 1 28 VAL HA . 28 VAL HA 1 1 401 1 2 1 1 28 VAL MG1 . 28 VAL QG1 1 1 402 1 1 1 1 28 VAL HA . 28 VAL HA 1 1 402 1 2 1 1 28 VAL MG2 . 28 VAL QG2 1 1 403 1 1 1 1 28 VAL HA . 28 VAL HA 1 1 403 1 2 1 1 29 LYS H . 29 LYS HN 1 1 404 1 1 1 1 28 VAL HB . 28 VAL HB 1 1 404 1 2 1 1 29 LYS H . 29 LYS HN 1 1 405 1 1 1 1 28 VAL HB . 28 VAL HB 1 1 405 1 2 1 1 30 CYS HA . 30 CYSH HA 1 1 406 1 1 1 1 28 VAL MG1 . 28 VAL QG1 1 1 406 1 2 1 1 29 LYS H . 29 LYS HN 1 1 407 1 1 1 1 28 VAL MG1 . 28 VAL QG1 1 1 407 1 2 1 1 33 CYS H . 33 HEMC HN 1 1 408 1 1 1 1 28 VAL MG1 . 28 VAL QG1 1 1 408 1 2 1 1 34 HIS H . 34 HISH HN 1 1 409 1 1 1 1 28 VAL MG2 . 28 VAL QG2 1 1 409 1 2 1 1 29 LYS H . 29 LYS HN 1 1 410 1 1 1 1 29 LYS H . 29 LYS HN 1 1 410 1 2 1 1 29 LYS HB2 . 29 LYS HB2 1 1 411 1 1 1 1 29 LYS H . 29 LYS HN 1 1 411 1 2 1 1 29 LYS HB3 . 29 LYS HB3 1 1 412 1 1 1 1 29 LYS H . 29 LYS HN 1 1 412 1 2 1 1 29 LYS QG . 29 LYS QG 1 1 413 1 1 1 1 29 LYS H . 29 LYS HN 1 1 413 1 2 1 1 30 CYS H . 30 CYSH HN 1 1 414 1 1 1 1 29 LYS H . 29 LYS HN 1 1 414 1 2 1 1 32 ASP H . 32 ASP- HN 1 1 415 1 1 1 1 29 LYS H . 29 LYS HN 1 1 415 1 2 1 1 32 ASP HB2 . 32 ASP- HB2 1 1 416 1 1 1 1 29 LYS HA . 29 LYS HA 1 1 416 1 2 1 1 29 LYS HB2 . 29 LYS HB2 1 1 417 1 1 1 1 29 LYS HA . 29 LYS HA 1 1 417 1 2 1 1 29 LYS HB3 . 29 LYS HB3 1 1 418 1 1 1 1 29 LYS HA . 29 LYS HA 1 1 418 1 2 1 1 30 CYS H . 30 CYSH HN 1 1 419 1 1 1 1 29 LYS HA . 29 LYS HA 1 1 419 1 2 1 1 30 CYS HA . 30 CYSH HA 1 1 420 1 1 1 1 29 LYS HB2 . 29 LYS HB2 1 1 420 1 2 1 1 30 CYS H . 30 CYSH HN 1 1 421 1 1 1 1 29 LYS HB2 . 29 LYS HB2 1 1 421 1 2 1 1 32 ASP H . 32 ASP- HN 1 1 422 1 1 1 1 29 LYS HB3 . 29 LYS HB3 1 1 422 1 2 1 1 30 CYS H . 30 CYSH HN 1 1 423 1 1 1 1 29 LYS HB3 . 29 LYS HB3 1 1 423 1 2 1 1 30 CYS HA . 30 CYSH HA 1 1 424 1 1 1 1 29 LYS HB3 . 29 LYS HB3 1 1 424 1 2 1 1 32 ASP H . 32 ASP- HN 1 1 425 1 1 1 1 29 LYS QD . 29 LYS QD 1 1 425 1 2 1 1 30 CYS H . 30 CYSH HN 1 1 426 1 1 1 1 29 LYS QG . 29 LYS QG 1 1 426 1 2 1 1 30 CYS H . 30 CYSH HN 1 1 427 1 1 1 1 30 CYS H . 30 CYSH HN 1 1 427 1 2 1 1 31 GLY HA3 . 31 GLY HA2 1 1 428 1 1 1 1 30 CYS H . 30 CYSH HN 1 1 428 1 2 1 1 33 CYS H . 33 HEMC HN 1 1 429 1 1 1 1 30 CYS H . 30 CYSH HN 1 1 429 1 2 1 1 34 HIS HD2 . 34 HISH HD2 1 1 430 1 1 1 1 30 CYS HA . 30 CYSH HA 1 1 430 1 2 1 1 32 ASP H . 32 ASP- HN 1 1 431 1 1 1 1 30 CYS HA . 30 CYSH HA 1 1 431 1 2 1 1 33 CYS HB2 . 33 HEMC HB2 1 1 432 1 1 1 1 30 CYS HA . 30 CYSH HA 1 1 432 1 2 1 1 33 CYS HB3 . 33 HEMC HB3 1 1 433 1 1 1 1 30 CYS HA . 30 CYSH HA 1 1 433 1 2 1 1 34 HIS HD2 . 34 HISH HD2 1 1 434 1 1 1 1 30 CYS QB . 30 CYSH QB 1 1 434 1 2 1 1 34 HIS HD2 . 34 HISH HD2 1 1 435 1 1 1 1 31 GLY H . 31 GLY HN 1 1 435 1 2 1 1 31 GLY HA2 . 31 GLY HA1 1 1 436 1 1 1 1 31 GLY H . 31 GLY HN 1 1 436 1 2 1 1 31 GLY HA3 . 31 GLY HA2 1 1 437 1 1 1 1 31 GLY H . 31 GLY HN 1 1 437 1 2 1 1 32 ASP H . 32 ASP- HN 1 1 438 1 1 1 1 31 GLY H . 31 GLY HN 1 1 438 1 2 1 1 33 CYS H . 33 HEMC HN 1 1 439 1 1 1 1 31 GLY H . 31 GLY HN 1 1 439 1 2 1 1 34 HIS H . 34 HISH HN 1 1 440 1 1 1 1 31 GLY HA3 . 31 GLY HA2 1 1 440 1 2 1 1 34 HIS H . 34 HISH HN 1 1 441 1 1 1 1 32 ASP H . 32 ASP- HN 1 1 441 1 2 1 1 32 ASP HB2 . 32 ASP- HB2 1 1 442 1 1 1 1 32 ASP H . 32 ASP- HN 1 1 442 1 2 1 1 32 ASP HB3 . 32 ASP- HB3 1 1 443 1 1 1 1 32 ASP H . 32 ASP- HN 1 1 443 1 2 1 1 33 CYS H . 33 HEMC HN 1 1 444 1 1 1 1 32 ASP H . 32 ASP- HN 1 1 444 1 2 1 1 33 CYS HA . 33 HEMC HA 1 1 445 1 1 1 1 32 ASP H . 32 ASP- HN 1 1 445 1 2 1 1 34 HIS H . 34 HISH HN 1 1 446 1 1 1 1 32 ASP H . 32 ASP- HN 1 1 446 1 2 1 1 34 HIS HD2 . 34 HISH HD2 1 1 447 1 1 1 1 32 ASP HA . 32 ASP- HA 1 1 447 1 2 1 1 32 ASP HB2 . 32 ASP- HB2 1 1 448 1 1 1 1 32 ASP HA . 32 ASP- HA 1 1 448 1 2 1 1 34 HIS H . 34 HISH HN 1 1 449 1 1 1 1 32 ASP HB2 . 32 ASP- HB2 1 1 449 1 2 1 1 33 CYS H . 33 HEMC HN 1 1 450 1 1 1 1 32 ASP HB2 . 32 ASP- HB2 1 1 450 1 2 1 1 33 CYS HA . 33 HEMC HA 1 1 451 1 1 1 1 32 ASP HB3 . 32 ASP- HB3 1 1 451 1 2 1 1 33 CYS H . 33 HEMC HN 1 1 452 1 1 1 1 33 CYS H . 33 HEMC HN 1 1 452 1 2 1 1 33 CYS HB2 . 33 HEMC HB2 1 1 453 1 1 1 1 33 CYS H . 33 HEMC HN 1 1 453 1 2 1 1 33 CYS HB3 . 33 HEMC HB3 1 1 454 1 1 1 1 33 CYS H . 33 HEMC HN 1 1 454 1 2 1 1 34 HIS HB2 . 34 HISH HB2 1 1 455 1 1 1 1 33 CYS H . 33 HEMC HN 1 1 455 1 2 1 1 34 HIS HD2 . 34 HISH HD2 1 1 456 1 1 1 1 33 CYS H . 33 HEMC HN 1 1 456 1 2 1 1 35 HIS H . 35 HISH HN 1 1 457 1 1 1 1 33 CYS HA . 33 HEMC HA 1 1 457 1 2 1 1 34 HIS HD2 . 34 HISH HD2 1 1 458 1 1 1 1 33 CYS HA . 33 HEMC HA 1 1 458 1 2 1 1 35 HIS HB3 . 35 HISH HB3 1 1 459 1 1 1 1 33 CYS HB2 . 33 HEMC HB2 1 1 459 1 2 1 1 34 HIS H . 34 HISH HN 1 1 460 1 1 1 1 33 CYS HB2 . 33 HEMC HB2 1 1 460 1 2 1 1 34 HIS HD2 . 34 HISH HD2 1 1 461 1 1 1 1 33 CYS HB3 . 33 HEMC HB3 1 1 461 1 2 1 1 34 HIS HD2 . 34 HISH HD2 1 1 462 1 1 1 1 34 HIS H . 34 HISH HN 1 1 462 1 2 1 1 34 HIS HB2 . 34 HISH HB2 1 1 463 1 1 1 1 34 HIS H . 34 HISH HN 1 1 463 1 2 1 1 34 HIS HB3 . 34 HISH HB3 1 1 464 1 1 1 1 34 HIS H . 34 HISH HN 1 1 464 1 2 1 1 34 HIS HD1 . 34 HISH HD1 1 1 465 1 1 1 1 34 HIS H . 34 HISH HN 1 1 465 1 2 1 1 34 HIS HD2 . 34 HISH HD2 1 1 466 1 1 1 1 34 HIS H . 34 HISH HN 1 1 466 1 2 1 1 35 HIS H . 35 HISH HN 1 1 467 1 1 1 1 34 HIS HA . 34 HISH HA 1 1 467 1 2 1 1 34 HIS HD1 . 34 HISH HD1 1 1 468 1 1 1 1 34 HIS HA . 34 HISH HA 1 1 468 1 2 1 1 34 HIS HE1 . 34 HISH HE1 1 1 469 1 1 1 1 34 HIS HA . 34 HISH HA 1 1 469 1 2 1 1 35 HIS HB3 . 35 HISH HB3 1 1 470 1 1 1 1 34 HIS HA . 34 HISH HA 1 1 470 1 2 1 1 35 HIS HD2 . 35 HISH HD2 1 1 471 1 1 1 1 34 HIS HA . 34 HISH HA 1 1 471 1 2 1 1 44 ARG H . 44 ARG HN 1 1 472 1 1 1 1 34 HIS HB2 . 34 HISH HB2 1 1 472 1 2 1 1 43 TYR HA . 43 TYRF HA 1 1 473 1 1 1 1 34 HIS HB3 . 34 HISH HB3 1 1 473 1 2 1 1 43 TYR QE . 43 TYRF QE 1 1 474 1 1 1 1 34 HIS HD1 . 34 HISH HD1 1 1 474 1 2 1 1 43 TYR H . 43 TYRF HN 1 1 475 1 1 1 1 34 HIS HD1 . 34 HISH HD1 1 1 475 1 2 1 1 43 TYR HA . 43 TYRF HA 1 1 476 1 1 1 1 34 HIS HD1 . 34 HISH HD1 1 1 476 1 2 1 1 43 TYR QB . 43 TYRF QB 1 1 477 1 1 1 1 34 HIS HD1 . 34 HISH HD1 1 1 477 1 2 1 1 44 ARG H . 44 ARG HN 1 1 478 1 1 1 1 34 HIS HD2 . 34 HISH HD2 1 1 478 1 2 1 1 43 TYR QE . 43 TYRF QE 1 1 479 1 1 1 1 34 HIS HE1 . 34 HISH HE1 1 1 479 1 2 1 1 43 TYR HA . 43 TYRF HA 1 1 480 1 1 1 1 34 HIS HE1 . 34 HISH HE1 1 1 480 1 2 1 1 44 ARG H . 44 ARG HN 1 1 481 1 1 1 1 34 HIS HE1 . 34 HISH HE1 1 1 481 1 2 1 1 44 ARG HA . 44 ARG HA 1 1 482 1 1 1 1 34 HIS HE1 . 34 HISH HE1 1 1 482 1 2 1 1 45 LYS HA . 45 LYS HA 1 1 483 1 1 1 1 34 HIS HE1 . 34 HISH HE1 1 1 483 1 2 1 1 46 CYS H . 46 CYSH HN 1 1 484 1 1 1 1 35 HIS H . 35 HISH HN 1 1 484 1 2 1 1 35 HIS HB2 . 35 HISH HB2 1 1 485 1 1 1 1 35 HIS H . 35 HISH HN 1 1 485 1 2 1 1 35 HIS HB3 . 35 HISH HB3 1 1 486 1 1 1 1 35 HIS H . 35 HISH HN 1 1 486 1 2 1 1 35 HIS HD2 . 35 HISH HD2 1 1 487 1 1 1 1 35 HIS HA . 35 HISH HA 1 1 487 1 2 1 1 35 HIS HB2 . 35 HISH HB2 1 1 488 1 1 1 1 35 HIS HA . 35 HISH HA 1 1 488 1 2 1 1 35 HIS HD2 . 35 HISH HD2 1 1 489 1 1 1 1 35 HIS HA . 35 HISH HA 1 1 489 1 2 1 1 36 PRO HD2 . 36 PRO HD2 1 1 490 1 1 1 1 35 HIS HA . 35 HISH HA 1 1 490 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 491 1 1 1 1 35 HIS HB2 . 35 HISH HB2 1 1 491 1 2 1 1 35 HIS HD1 . 35 HISH HD1 1 1 492 1 1 1 1 35 HIS HB2 . 35 HISH HB2 1 1 492 1 2 1 1 35 HIS HE1 . 35 HISH HE1 1 1 493 1 1 1 1 35 HIS HB2 . 35 HISH HB2 1 1 493 1 2 1 1 36 PRO HD2 . 36 PRO HD2 1 1 494 1 1 1 1 35 HIS HB2 . 35 HISH HB2 1 1 494 1 2 1 1 36 PRO HD3 . 36 PRO HD3 1 1 495 1 1 1 1 35 HIS HB2 . 35 HISH HB2 1 1 495 1 2 1 1 36 PRO QG . 36 PRO QG 1 1 496 1 1 1 1 35 HIS HB2 . 35 HISH HB2 1 1 496 1 2 1 1 76 PHE QD . 76 PHEF QD 1 1 497 1 1 1 1 35 HIS HB2 . 35 HISH HB2 1 1 497 1 2 1 1 76 PHE QE . 76 PHEF QE 1 1 498 1 1 1 1 35 HIS HB2 . 35 HISH HB2 1 1 498 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 499 1 1 1 1 35 HIS HB3 . 35 HISH HB3 1 1 499 1 2 1 1 35 HIS HD2 . 35 HISH HD2 1 1 500 1 1 1 1 35 HIS HB3 . 35 HISH HB3 1 1 500 1 2 1 1 36 PRO HD2 . 36 PRO HD2 1 1 501 1 1 1 1 35 HIS HB3 . 35 HISH HB3 1 1 501 1 2 1 1 36 PRO HD3 . 36 PRO HD3 1 1 502 1 1 1 1 35 HIS HB3 . 35 HISH HB3 1 1 502 1 2 1 1 76 PHE HB2 . 76 PHEF HB2 1 1 503 1 1 1 1 35 HIS HB3 . 35 HISH HB3 1 1 503 1 2 1 1 76 PHE QD . 76 PHEF QD 1 1 504 1 1 1 1 35 HIS HB3 . 35 HISH HB3 1 1 504 1 2 1 1 76 PHE QE . 76 PHEF QE 1 1 505 1 1 1 1 35 HIS HB3 . 35 HISH HB3 1 1 505 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 506 1 1 1 1 35 HIS HD1 . 35 HISH HD1 1 1 506 1 2 1 1 36 PRO HD2 . 36 PRO HD2 1 1 507 1 1 1 1 35 HIS HD1 . 35 HISH HD1 1 1 507 1 2 1 1 36 PRO HD3 . 36 PRO HD3 1 1 508 1 1 1 1 35 HIS HD1 . 35 HISH HD1 1 1 508 1 2 1 1 37 VAL HA . 37 VAL HA 1 1 509 1 1 1 1 35 HIS HD1 . 35 HISH HD1 1 1 509 1 2 1 1 37 VAL MG1 . 37 VAL QG1 1 1 510 1 1 1 1 35 HIS HD1 . 35 HISH HD1 1 1 510 1 2 1 1 37 VAL MG2 . 37 VAL QG2 1 1 511 1 1 1 1 35 HIS HD1 . 35 HISH HD1 1 1 511 1 2 1 1 76 PHE QD . 76 PHEF QD 1 1 512 1 1 1 1 35 HIS HD1 . 35 HISH HD1 1 1 512 1 2 1 1 76 PHE QE . 76 PHEF QE 1 1 513 1 1 1 1 35 HIS HD1 . 35 HISH HD1 1 1 513 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 514 1 1 1 1 35 HIS HD2 . 35 HISH HD2 1 1 514 1 2 1 1 37 VAL MG2 . 37 VAL QG2 1 1 515 1 1 1 1 35 HIS HD2 . 35 HISH HD2 1 1 515 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 516 1 1 1 1 35 HIS HD2 . 35 HISH HD2 1 1 516 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 517 1 1 1 1 35 HIS HD2 . 35 HISH HD2 1 1 517 1 2 1 1 76 PHE HB2 . 76 PHEF HB2 1 1 518 1 1 1 1 35 HIS HD2 . 35 HISH HD2 1 1 518 1 2 1 1 76 PHE HB3 . 76 PHEF HB3 1 1 519 1 1 1 1 35 HIS HD2 . 35 HISH HD2 1 1 519 1 2 1 1 76 PHE QD . 76 PHEF QD 1 1 520 1 1 1 1 35 HIS HD2 . 35 HISH HD2 1 1 520 1 2 1 1 76 PHE QE . 76 PHEF QE 1 1 521 1 1 1 1 35 HIS HD2 . 35 HISH HD2 1 1 521 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 522 1 1 1 1 35 HIS HE1 . 35 HISH HE1 1 1 522 1 2 1 1 37 VAL H . 37 VAL HN 1 1 523 1 1 1 1 35 HIS HE1 . 35 HISH HE1 1 1 523 1 2 1 1 37 VAL HA . 37 VAL HA 1 1 524 1 1 1 1 35 HIS HE1 . 35 HISH HE1 1 1 524 1 2 1 1 37 VAL MG2 . 37 VAL QG2 1 1 525 1 1 1 1 35 HIS HE1 . 35 HISH HE1 1 1 525 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 526 1 1 1 1 36 PRO HA . 36 PRO HA 1 1 526 1 2 1 1 37 VAL H . 37 VAL HN 1 1 527 1 1 1 1 36 PRO HA . 36 PRO HA 1 1 527 1 2 1 1 42 ASP H . 42 ASP- HN 1 1 528 1 1 1 1 36 PRO QB . 36 PRO QB 1 1 528 1 2 1 1 40 LYS HA . 40 LYS HA 1 1 529 1 1 1 1 36 PRO QB . 36 PRO QB 1 1 529 1 2 1 1 41 GLU HA . 41 GLU- HA 1 1 530 1 1 1 1 36 PRO QB . 36 PRO QB 1 1 530 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 531 1 1 1 1 36 PRO HD2 . 36 PRO HD2 1 1 531 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 532 1 1 1 1 36 PRO HD3 . 36 PRO HD3 1 1 532 1 2 1 1 37 VAL MG2 . 37 VAL QG2 1 1 533 1 1 1 1 36 PRO HD3 . 36 PRO HD3 1 1 533 1 2 1 1 41 GLU QG . 41 GLU- QG 1 1 534 1 1 1 1 36 PRO HD3 . 36 PRO HD3 1 1 534 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 535 1 1 1 1 36 PRO QG . 36 PRO QG 1 1 535 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 536 1 1 1 1 37 VAL H . 37 VAL HN 1 1 536 1 2 1 1 37 VAL MG2 . 37 VAL QG2 1 1 537 1 1 1 1 37 VAL H . 37 VAL HN 1 1 537 1 2 1 1 40 LYS QB . 40 LYS QB 1 1 538 1 1 1 1 37 VAL H . 37 VAL HN 1 1 538 1 2 1 1 41 GLU HA . 41 GLU- HA 1 1 539 1 1 1 1 37 VAL HA . 37 VAL HA 1 1 539 1 2 1 1 37 VAL MG1 . 37 VAL QG1 1 1 540 1 1 1 1 37 VAL HA . 37 VAL HA 1 1 540 1 2 1 1 37 VAL MG2 . 37 VAL QG2 1 1 541 1 1 1 1 37 VAL HA . 37 VAL HA 1 1 541 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 542 1 1 1 1 37 VAL MG1 . 37 VAL QG1 1 1 542 1 2 1 1 38 ASN HA . 38 ASN HA 1 1 543 1 1 1 1 37 VAL MG1 . 37 VAL QG1 1 1 543 1 2 1 1 38 ASN HB2 . 38 ASN HB2 1 1 544 1 1 1 1 37 VAL MG2 . 37 VAL QG2 1 1 544 1 2 1 1 38 ASN HA . 38 ASN HA 1 1 545 1 1 1 1 37 VAL MG2 . 37 VAL QG2 1 1 545 1 2 1 1 38 ASN HB2 . 38 ASN HB2 1 1 546 1 1 1 1 37 VAL MG2 . 37 VAL QG2 1 1 546 1 2 1 1 40 LYS QB . 40 LYS QB 1 1 547 1 1 1 1 37 VAL MG2 . 37 VAL QG2 1 1 547 1 2 1 1 51 CYS HA . 51 HEMC HA 1 1 548 1 1 1 1 37 VAL MG2 . 37 VAL QG2 1 1 548 1 2 1 1 51 CYS HB3 . 51 HEMC HB3 1 1 549 1 1 1 1 37 VAL MG2 . 37 VAL QG2 1 1 549 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 550 1 1 1 1 38 ASN HA . 38 ASN HA 1 1 550 1 2 1 1 38 ASN HB3 . 38 ASN HB3 1 1 551 1 1 1 1 41 GLU HA . 41 GLU- HA 1 1 551 1 2 1 1 42 ASP H . 42 ASP- HN 1 1 552 1 1 1 1 41 GLU QB . 41 GLU- QB 1 1 552 1 2 1 1 43 TYR QE . 43 TYRF QE 1 1 553 1 1 1 1 41 GLU QG . 41 GLU- QG 1 1 553 1 2 1 1 42 ASP H . 42 ASP- HN 1 1 554 1 1 1 1 41 GLU QG . 41 GLU- QG 1 1 554 1 2 1 1 43 TYR H . 43 TYRF HN 1 1 555 1 1 1 1 42 ASP HA . 42 ASP- HA 1 1 555 1 2 1 1 43 TYR H . 43 TYRF HN 1 1 556 1 1 1 1 42 ASP HA . 42 ASP- HA 1 1 556 1 2 1 1 43 TYR QD . 43 TYRF QD 1 1 557 1 1 1 1 42 ASP HA . 42 ASP- HA 1 1 557 1 2 1 1 43 TYR QE . 43 TYRF QE 1 1 558 1 1 1 1 42 ASP HB2 . 42 ASP- HB2 1 1 558 1 2 1 1 43 TYR H . 43 TYRF HN 1 1 559 1 1 1 1 42 ASP HB3 . 42 ASP- HB3 1 1 559 1 2 1 1 43 TYR H . 43 TYRF HN 1 1 560 1 1 1 1 43 TYR HA . 43 TYRF HA 1 1 560 1 2 1 1 44 ARG H . 44 ARG HN 1 1 561 1 1 1 1 44 ARG H . 44 ARG HN 1 1 561 1 2 1 1 44 ARG HG2 . 44 ARG HG2 1 1 562 1 1 1 1 44 ARG H . 44 ARG HN 1 1 562 1 2 1 1 45 LYS H . 45 LYS HN 1 1 563 1 1 1 1 44 ARG HA . 44 ARG HA 1 1 563 1 2 1 1 44 ARG HG2 . 44 ARG HG2 1 1 564 1 1 1 1 44 ARG HA . 44 ARG HA 1 1 564 1 2 1 1 45 LYS H . 45 LYS HN 1 1 565 1 1 1 1 44 ARG HA . 44 ARG HA 1 1 565 1 2 1 1 45 LYS HG2 . 45 LYS HG2 1 1 566 1 1 1 1 44 ARG QB . 44 ARG QB 1 1 566 1 2 1 1 45 LYS HA . 45 LYS HA 1 1 567 1 1 1 1 44 ARG HB2 . 44 ARG HB2 1 1 567 1 2 1 1 45 LYS H . 45 LYS HN 1 1 568 1 1 1 1 44 ARG HB2 . 44 ARG HB2 1 1 568 1 2 1 1 45 LYS HA . 45 LYS HA 1 1 569 1 1 1 1 44 ARG HB3 . 44 ARG HB3 1 1 569 1 2 1 1 45 LYS H . 45 LYS HN 1 1 570 1 1 1 1 44 ARG HB3 . 44 ARG HB3 1 1 570 1 2 1 1 45 LYS HA . 45 LYS HA 1 1 571 1 1 1 1 44 ARG QD . 44 ARG QD 1 1 571 1 2 1 1 45 LYS H . 45 LYS HN 1 1 572 1 1 1 1 44 ARG HG2 . 44 ARG HG2 1 1 572 1 2 1 1 45 LYS H . 45 LYS HN 1 1 573 1 1 1 1 44 ARG HG2 . 44 ARG HG2 1 1 573 1 2 1 1 45 LYS HA . 45 LYS HA 1 1 574 1 1 1 1 44 ARG HG2 . 44 ARG HG2 1 1 574 1 2 1 1 45 LYS HG3 . 45 LYS HG3 1 1 575 1 1 1 1 44 ARG HG2 . 44 ARG HG2 1 1 575 1 2 1 1 46 CYS HA . 46 CYSH HA 1 1 576 1 1 1 1 45 LYS H . 45 LYS HN 1 1 576 1 2 1 1 45 LYS HB2 . 45 LYS HB2 1 1 577 1 1 1 1 45 LYS HA . 45 LYS HA 1 1 577 1 2 1 1 45 LYS HG2 . 45 LYS HG2 1 1 578 1 1 1 1 45 LYS HA . 45 LYS HA 1 1 578 1 2 1 1 47 GLY H . 47 GLY HN 1 1 579 1 1 1 1 45 LYS HB3 . 45 LYS HB3 1 1 579 1 2 1 1 47 GLY H . 47 GLY HN 1 1 580 1 1 1 1 45 LYS HB3 . 45 LYS HB3 1 1 580 1 2 1 1 48 THR H . 48 THR HN 1 1 581 1 1 1 1 45 LYS QD . 45 LYS QD 1 1 581 1 2 1 1 48 THR HA . 48 THR HA 1 1 582 1 1 1 1 45 LYS HG3 . 45 LYS HG3 1 1 582 1 2 1 1 47 GLY H . 47 GLY HN 1 1 583 1 1 1 1 46 CYS H . 46 CYSH HN 1 1 583 1 2 1 1 47 GLY H . 47 GLY HN 1 1 584 1 1 1 1 46 CYS H . 46 CYSH HN 1 1 584 1 2 1 1 48 THR H . 48 THR HN 1 1 585 1 1 1 1 46 CYS H . 46 CYSH HN 1 1 585 1 2 1 1 52 HIS HD2 . 52 HISH HD2 1 1 586 1 1 1 1 46 CYS HA . 46 CYSH HA 1 1 586 1 2 1 1 47 GLY HA2 . 47 GLY HA1 1 1 587 1 1 1 1 46 CYS HA . 46 CYSH HA 1 1 587 1 2 1 1 48 THR H . 48 THR HN 1 1 588 1 1 1 1 46 CYS HA . 46 CYSH HA 1 1 588 1 2 1 1 48 THR HB . 48 THR HB 1 1 589 1 1 1 1 46 CYS HA . 46 CYSH HA 1 1 589 1 2 1 1 51 CYS HB2 . 51 HEMC HB2 1 1 590 1 1 1 1 46 CYS HA . 46 CYSH HA 1 1 590 1 2 1 1 51 CYS HB3 . 51 HEMC HB3 1 1 591 1 1 1 1 46 CYS HA . 46 CYSH HA 1 1 591 1 2 1 1 52 HIS H . 52 HISH HN 1 1 592 1 1 1 1 46 CYS HA . 46 CYSH HA 1 1 592 1 2 1 1 52 HIS HB2 . 52 HISH HB2 1 1 593 1 1 1 1 46 CYS HA . 46 CYSH HA 1 1 593 1 2 1 1 52 HIS HD2 . 52 HISH HD2 1 1 594 1 1 1 1 46 CYS HA . 46 CYSH HA 1 1 594 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 595 1 1 1 1 46 CYS HA . 46 CYSH HA 1 1 595 1 2 1 1 69 MET ME . 69 MET QE 1 1 596 1 1 1 1 46 CYS QB . 46 CYSH QB 1 1 596 1 2 1 1 52 HIS HD2 . 52 HISH HD2 1 1 597 1 1 1 1 46 CYS QB . 46 CYSH QB 1 1 597 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 598 1 1 1 1 46 CYS QB . 46 CYSH QB 1 1 598 1 2 1 1 69 MET ME . 69 MET QE 1 1 599 1 1 1 1 47 GLY H . 47 GLY HN 1 1 599 1 2 1 1 47 GLY HA3 . 47 GLY HA2 1 1 600 1 1 1 1 47 GLY H . 47 GLY HN 1 1 600 1 2 1 1 48 THR H . 48 THR HN 1 1 601 1 1 1 1 47 GLY H . 47 GLY HN 1 1 601 1 2 1 1 48 THR HA . 48 THR HA 1 1 602 1 1 1 1 47 GLY H . 47 GLY HN 1 1 602 1 2 1 1 52 HIS H . 52 HISH HN 1 1 603 1 1 1 1 47 GLY H . 47 GLY HN 1 1 603 1 2 1 1 52 HIS HD2 . 52 HISH HD2 1 1 604 1 1 1 1 47 GLY H . 47 GLY HN 1 1 604 1 2 1 1 69 MET ME . 69 MET QE 1 1 605 1 1 1 1 47 GLY HA2 . 47 GLY HA1 1 1 605 1 2 1 1 52 HIS H . 52 HISH HN 1 1 606 1 1 1 1 47 GLY HA2 . 47 GLY HA1 1 1 606 1 2 1 1 52 HIS HD2 . 52 HISH HD2 1 1 607 1 1 1 1 47 GLY HA3 . 47 GLY HA2 1 1 607 1 2 1 1 52 HIS H . 52 HISH HN 1 1 608 1 1 1 1 48 THR H . 48 THR HN 1 1 608 1 2 1 1 48 THR MG . 48 THR QG2 1 1 609 1 1 1 1 48 THR H . 48 THR HN 1 1 609 1 2 1 1 49 ALA H . 49 ALA HN 1 1 610 1 1 1 1 48 THR H . 48 THR HN 1 1 610 1 2 1 1 51 CYS HB2 . 51 HEMC HB2 1 1 611 1 1 1 1 48 THR H . 48 THR HN 1 1 611 1 2 1 1 52 HIS H . 52 HISH HN 1 1 612 1 1 1 1 48 THR HA . 48 THR HA 1 1 612 1 2 1 1 48 THR MG . 48 THR QG2 1 1 613 1 1 1 1 48 THR HA . 48 THR HA 1 1 613 1 2 1 1 49 ALA H . 49 ALA HN 1 1 614 1 1 1 1 48 THR HB . 48 THR HB 1 1 614 1 2 1 1 51 CYS HB2 . 51 HEMC HB2 1 1 615 1 1 1 1 48 THR MG . 48 THR QG2 1 1 615 1 2 1 1 49 ALA H . 49 ALA HN 1 1 616 1 1 1 1 48 THR MG . 48 THR QG2 1 1 616 1 2 1 1 50 GLY H . 50 GLY HN 1 1 617 1 1 1 1 48 THR MG . 48 THR QG2 1 1 617 1 2 1 1 51 CYS H . 51 HEMC HN 1 1 618 1 1 1 1 49 ALA H . 49 ALA HN 1 1 618 1 2 1 1 49 ALA MB . 49 ALA QB 1 1 619 1 1 1 1 49 ALA H . 49 ALA HN 1 1 619 1 2 1 1 50 GLY H . 50 GLY HN 1 1 620 1 1 1 1 49 ALA HA . 49 ALA HA 1 1 620 1 2 1 1 50 GLY H . 50 GLY HN 1 1 621 1 1 1 1 49 ALA HA . 49 ALA HA 1 1 621 1 2 1 1 50 GLY QA . 50 GLY QA 1 1 622 1 1 1 1 49 ALA HA . 49 ALA HA 1 1 622 1 2 1 1 51 CYS H . 51 HEMC HN 1 1 623 1 1 1 1 49 ALA HA . 49 ALA HA 1 1 623 1 2 1 1 53 ASP HB2 . 53 ASP- HB2 1 1 624 1 1 1 1 49 ALA HA . 49 ALA HA 1 1 624 1 2 1 1 53 ASP HB3 . 53 ASP- HB3 1 1 625 1 1 1 1 49 ALA MB . 49 ALA QB 1 1 625 1 2 1 1 51 CYS H . 51 HEMC HN 1 1 626 1 1 1 1 50 GLY H . 50 GLY HN 1 1 626 1 2 1 1 51 CYS H . 51 HEMC HN 1 1 627 1 1 1 1 50 GLY H . 50 GLY HN 1 1 627 1 2 1 1 51 CYS HB2 . 51 HEMC HB2 1 1 628 1 1 1 1 50 GLY H . 50 GLY HN 1 1 628 1 2 1 1 53 ASP HA . 53 ASP- HA 1 1 629 1 1 1 1 50 GLY H . 50 GLY HN 1 1 629 1 2 1 1 53 ASP HB2 . 53 ASP- HB2 1 1 630 1 1 1 1 50 GLY H . 50 GLY HN 1 1 630 1 2 1 1 53 ASP HB3 . 53 ASP- HB3 1 1 631 1 1 1 1 51 CYS H . 51 HEMC HN 1 1 631 1 2 1 1 51 CYS HB2 . 51 HEMC HB2 1 1 632 1 1 1 1 51 CYS H . 51 HEMC HN 1 1 632 1 2 1 1 51 CYS HB3 . 51 HEMC HB3 1 1 633 1 1 1 1 51 CYS H . 51 HEMC HN 1 1 633 1 2 1 1 52 HIS H . 52 HISH HN 1 1 634 1 1 1 1 51 CYS H . 51 HEMC HN 1 1 634 1 2 1 1 52 HIS HA . 52 HISH HA 1 1 635 1 1 1 1 51 CYS H . 51 HEMC HN 1 1 635 1 2 1 1 53 ASP HB3 . 53 ASP- HB3 1 1 636 1 1 1 1 51 CYS HA . 51 HEMC HA 1 1 636 1 2 1 1 51 CYS HB3 . 51 HEMC HB3 1 1 637 1 1 1 1 51 CYS HA . 51 HEMC HA 1 1 637 1 2 1 1 52 HIS HD2 . 52 HISH HD2 1 1 638 1 1 1 1 51 CYS HB2 . 51 HEMC HB2 1 1 638 1 2 1 1 52 HIS H . 52 HISH HN 1 1 639 1 1 1 1 51 CYS HB2 . 51 HEMC HB2 1 1 639 1 2 1 1 52 HIS HD2 . 52 HISH HD2 1 1 640 1 1 1 1 52 HIS H . 52 HISH HN 1 1 640 1 2 1 1 52 HIS HB3 . 52 HISH HB3 1 1 641 1 1 1 1 52 HIS H . 52 HISH HN 1 1 641 1 2 1 1 52 HIS HD1 . 52 HISH HD1 1 1 642 1 1 1 1 52 HIS H . 52 HISH HN 1 1 642 1 2 1 1 52 HIS HD2 . 52 HISH HD2 1 1 643 1 1 1 1 52 HIS H . 52 HISH HN 1 1 643 1 2 1 1 53 ASP H . 53 ASP- HN 1 1 644 1 1 1 1 52 HIS H . 52 HISH HN 1 1 644 1 2 1 1 53 ASP HA . 53 ASP- HA 1 1 645 1 1 1 1 52 HIS H . 52 HISH HN 1 1 645 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 646 1 1 1 1 52 HIS HA . 52 HISH HA 1 1 646 1 2 1 1 52 HIS HD1 . 52 HISH HD1 1 1 647 1 1 1 1 52 HIS HA . 52 HISH HA 1 1 647 1 2 1 1 53 ASP H . 53 ASP- HN 1 1 648 1 1 1 1 52 HIS HA . 52 HISH HA 1 1 648 1 2 1 1 63 LYS HA . 63 LYS HA 1 1 649 1 1 1 1 52 HIS HA . 52 HISH HA 1 1 649 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 650 1 1 1 1 52 HIS HA . 52 HISH HA 1 1 650 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 651 1 1 1 1 52 HIS HB2 . 52 HISH HB2 1 1 651 1 2 1 1 52 HIS HD2 . 52 HISH HD2 1 1 652 1 1 1 1 52 HIS HB2 . 52 HISH HB2 1 1 652 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 653 1 1 1 1 52 HIS HB3 . 52 HISH HB3 1 1 653 1 2 1 1 65 TYR HA . 65 TYRF HA 1 1 654 1 1 1 1 52 HIS HB3 . 52 HISH HB3 1 1 654 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 655 1 1 1 1 52 HIS HB3 . 52 HISH HB3 1 1 655 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 656 1 1 1 1 52 HIS HD1 . 52 HISH HD1 1 1 656 1 2 1 1 53 ASP H . 53 ASP- HN 1 1 657 1 1 1 1 52 HIS HD1 . 52 HISH HD1 1 1 657 1 2 1 1 62 ALA HA . 62 ALA HA 1 1 658 1 1 1 1 52 HIS HD1 . 52 HISH HD1 1 1 658 1 2 1 1 62 ALA MB . 62 ALA QB 1 1 659 1 1 1 1 52 HIS HD1 . 52 HISH HD1 1 1 659 1 2 1 1 63 LYS H . 63 LYS HN 1 1 660 1 1 1 1 52 HIS HD1 . 52 HISH HD1 1 1 660 1 2 1 1 63 LYS HA . 63 LYS HA 1 1 661 1 1 1 1 52 HIS HD1 . 52 HISH HD1 1 1 661 1 2 1 1 63 LYS QB . 63 LYS QB 1 1 662 1 1 1 1 52 HIS HD1 . 52 HISH HD1 1 1 662 1 2 1 1 64 GLY H . 64 GLY HN 1 1 663 1 1 1 1 52 HIS HD1 . 52 HISH HD1 1 1 663 1 2 1 1 67 HIS HD2 . 67 HIS HD2 1 1 664 1 1 1 1 52 HIS HD1 . 52 HISH HD1 1 1 664 1 2 1 1 68 VAL HB . 68 VAL HB 1 1 665 1 1 1 1 52 HIS HD1 . 52 HISH HD1 1 1 665 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 666 1 1 1 1 52 HIS HD1 . 52 HISH HD1 1 1 666 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 667 1 1 1 1 52 HIS HD2 . 52 HISH HD2 1 1 667 1 2 1 1 68 VAL HB . 68 VAL HB 1 1 668 1 1 1 1 52 HIS HD2 . 52 HISH HD2 1 1 668 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 669 1 1 1 1 52 HIS HD2 . 52 HISH HD2 1 1 669 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 670 1 1 1 1 52 HIS HD2 . 52 HISH HD2 1 1 670 1 2 1 1 69 MET ME . 69 MET QE 1 1 671 1 1 1 1 52 HIS HE1 . 52 HISH HE1 1 1 671 1 2 1 1 67 HIS HD2 . 67 HIS HD2 1 1 672 1 1 1 1 52 HIS HE1 . 52 HISH HE1 1 1 672 1 2 1 1 68 VAL H . 68 VAL HN 1 1 673 1 1 1 1 52 HIS HE1 . 52 HISH HE1 1 1 673 1 2 1 1 68 VAL HB . 68 VAL HB 1 1 674 1 1 1 1 52 HIS HE1 . 52 HISH HE1 1 1 674 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 675 1 1 1 1 52 HIS HE1 . 52 HISH HE1 1 1 675 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 676 1 1 1 1 53 ASP H . 53 ASP- HN 1 1 676 1 2 1 1 54 SER H . 54 SER HN 1 1 677 1 1 1 1 53 ASP H . 53 ASP- HN 1 1 677 1 2 1 1 63 LYS HA . 63 LYS HA 1 1 678 1 1 1 1 53 ASP H . 53 ASP- HN 1 1 678 1 2 1 1 63 LYS QG . 63 LYS QG 1 1 679 1 1 1 1 53 ASP H . 53 ASP- HN 1 1 679 1 2 1 1 65 TYR H . 65 TYRF HN 1 1 680 1 1 1 1 53 ASP HA . 53 ASP- HA 1 1 680 1 2 1 1 53 ASP HB2 . 53 ASP- HB2 1 1 681 1 1 1 1 53 ASP HA . 53 ASP- HA 1 1 681 1 2 1 1 53 ASP HB3 . 53 ASP- HB3 1 1 682 1 1 1 1 53 ASP HA . 53 ASP- HA 1 1 682 1 2 1 1 54 SER QB . 54 SER QB 1 1 683 1 1 1 1 53 ASP HA . 53 ASP- HA 1 1 683 1 2 1 1 55 MET ME . 55 MET QE 1 1 684 1 1 1 1 53 ASP HA . 53 ASP- HA 1 1 684 1 2 1 1 65 TYR QD . 65 TYRF QD 1 1 685 1 1 1 1 54 SER H . 54 SER HN 1 1 685 1 2 1 1 65 TYR HB2 . 65 TYRF HB2 1 1 686 1 1 1 1 54 SER H . 54 SER HN 1 1 686 1 2 1 1 65 TYR HB3 . 65 TYRF HB3 1 1 687 1 1 1 1 55 MET HA . 55 MET HA 1 1 687 1 2 1 1 55 MET HB3 . 55 MET HB3 1 1 688 1 1 1 1 55 MET HA . 55 MET HA 1 1 688 1 2 1 1 55 MET ME . 55 MET QE 1 1 689 1 1 1 1 55 MET HA . 55 MET HA 1 1 689 1 2 1 1 55 MET HG2 . 55 MET HG2 1 1 690 1 1 1 1 55 MET HA . 55 MET HA 1 1 690 1 2 1 1 55 MET HG3 . 55 MET HG3 1 1 691 1 1 1 1 55 MET HA . 55 MET HA 1 1 691 1 2 1 1 65 TYR HB3 . 65 TYRF HB3 1 1 692 1 1 1 1 55 MET HA . 55 MET HA 1 1 692 1 2 1 1 65 TYR QD . 65 TYRF QD 1 1 693 1 1 1 1 55 MET HB3 . 55 MET HB3 1 1 693 1 2 1 1 55 MET HG2 . 55 MET HG2 1 1 694 1 1 1 1 55 MET HB3 . 55 MET HB3 1 1 694 1 2 1 1 55 MET HG3 . 55 MET HG3 1 1 695 1 1 1 1 55 MET ME . 55 MET QE 1 1 695 1 2 1 1 55 MET HG2 . 55 MET HG2 1 1 696 1 1 1 1 55 MET ME . 55 MET QE 1 1 696 1 2 1 1 65 TYR HB2 . 65 TYRF HB2 1 1 697 1 1 1 1 55 MET ME . 55 MET QE 1 1 697 1 2 1 1 65 TYR HB3 . 65 TYRF HB3 1 1 698 1 1 1 1 55 MET ME . 55 MET QE 1 1 698 1 2 1 1 65 TYR QD . 65 TYRF QD 1 1 699 1 1 1 1 55 MET ME . 55 MET QE 1 1 699 1 2 1 1 65 TYR QE . 65 TYRF QE 1 1 700 1 1 1 1 56 ASP HB2 . 56 ASP- HB2 1 1 700 1 2 1 1 59 ASP H . 59 ASP- HN 1 1 701 1 1 1 1 56 ASP HB3 . 56 ASP- HB3 1 1 701 1 2 1 1 59 ASP H . 59 ASP- HN 1 1 702 1 1 1 1 56 ASP HB3 . 56 ASP- HB3 1 1 702 1 2 1 1 59 ASP HA . 59 ASP- HA 1 1 703 1 1 1 1 57 LYS HA . 57 LYS HA 1 1 703 1 2 1 1 57 LYS HG2 . 57 LYS HG2 1 1 704 1 1 1 1 57 LYS HA . 57 LYS HA 1 1 704 1 2 1 1 66 TYR H . 66 TYRF HN 1 1 705 1 1 1 1 57 LYS HA . 57 LYS HA 1 1 705 1 2 1 1 66 TYR HB2 . 66 TYRF HB2 1 1 706 1 1 1 1 57 LYS HA . 57 LYS HA 1 1 706 1 2 1 1 66 TYR HB3 . 66 TYRF HB3 1 1 707 1 1 1 1 57 LYS HA . 57 LYS HA 1 1 707 1 2 1 1 66 TYR QD . 66 TYRF QD 1 1 708 1 1 1 1 57 LYS HA . 57 LYS HA 1 1 708 1 2 1 1 67 HIS H . 67 HIS HN 1 1 709 1 1 1 1 57 LYS QB . 57 LYS QB 1 1 709 1 2 1 1 66 TYR HB3 . 66 TYRF HB3 1 1 710 1 1 1 1 57 LYS QB . 57 LYS QB 1 1 710 1 2 1 1 66 TYR QD . 66 TYRF QD 1 1 711 1 1 1 1 57 LYS HG2 . 57 LYS HG2 1 1 711 1 2 1 1 66 TYR QD . 66 TYRF QD 1 1 712 1 1 1 1 57 LYS HG3 . 57 LYS HG3 1 1 712 1 2 1 1 66 TYR QD . 66 TYRF QD 1 1 713 1 1 1 1 58 LYS QB . 58 LYS QB 1 1 713 1 2 1 1 59 ASP H . 59 ASP- HN 1 1 714 1 1 1 1 60 LYS HA . 60 LYS HA 1 1 714 1 2 1 1 60 LYS QD . 60 LYS QD 1 1 715 1 1 1 1 60 LYS HA . 60 LYS HA 1 1 715 1 2 1 1 61 SER HA . 61 SER HA 1 1 716 1 1 1 1 60 LYS HA . 60 LYS HA 1 1 716 1 2 1 1 64 GLY HA3 . 64 GLY HA2 1 1 717 1 1 1 1 60 LYS HA . 60 LYS HA 1 1 717 1 2 1 1 67 HIS HE1 . 67 HIS HE1 1 1 718 1 1 1 1 60 LYS QB . 60 LYS QB 1 1 718 1 2 1 1 67 HIS HE1 . 67 HIS HE1 1 1 719 1 1 1 1 60 LYS HB2 . 60 LYS HB2 1 1 719 1 2 1 1 67 HIS HE1 . 67 HIS HE1 1 1 720 1 1 1 1 60 LYS HB3 . 60 LYS HB3 1 1 720 1 2 1 1 67 HIS HE1 . 67 HIS HE1 1 1 721 1 1 1 1 60 LYS QD . 60 LYS QD 1 1 721 1 2 1 1 67 HIS HE1 . 67 HIS HE1 1 1 722 1 1 1 1 61 SER HA . 61 SER HA 1 1 722 1 2 1 1 63 LYS H . 63 LYS HN 1 1 723 1 1 1 1 61 SER HA . 61 SER HA 1 1 723 1 2 1 1 67 HIS HD2 . 67 HIS HD2 1 1 724 1 1 1 1 62 ALA HA . 62 ALA HA 1 1 724 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 725 1 1 1 1 62 ALA MB . 62 ALA QB 1 1 725 1 2 1 1 63 LYS H . 63 LYS HN 1 1 726 1 1 1 1 62 ALA MB . 62 ALA QB 1 1 726 1 2 1 1 64 GLY H . 64 GLY HN 1 1 727 1 1 1 1 62 ALA MB . 62 ALA QB 1 1 727 1 2 1 1 67 HIS HD2 . 67 HIS HD2 1 1 728 1 1 1 1 62 ALA MB . 62 ALA QB 1 1 728 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 729 1 1 1 1 62 ALA MB . 62 ALA QB 1 1 729 1 2 1 1 74 THR HB . 74 THR HB 1 1 730 1 1 1 1 63 LYS H . 63 LYS HN 1 1 730 1 2 1 1 63 LYS HG2 . 63 LYS HG2 1 1 731 1 1 1 1 63 LYS H . 63 LYS HN 1 1 731 1 2 1 1 63 LYS HG3 . 63 LYS HG3 1 1 732 1 1 1 1 63 LYS H . 63 LYS HN 1 1 732 1 2 1 1 64 GLY H . 64 GLY HN 1 1 733 1 1 1 1 63 LYS H . 63 LYS HN 1 1 733 1 2 1 1 67 HIS HD2 . 67 HIS HD2 1 1 734 1 1 1 1 63 LYS H . 63 LYS HN 1 1 734 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 735 1 1 1 1 63 LYS HA . 63 LYS HA 1 1 735 1 2 1 1 63 LYS QG . 63 LYS QG 1 1 736 1 1 1 1 63 LYS QB . 63 LYS QB 1 1 736 1 2 1 1 64 GLY H . 64 GLY HN 1 1 737 1 1 1 1 63 LYS QG . 63 LYS QG 1 1 737 1 2 1 1 64 GLY H . 64 GLY HN 1 1 738 1 1 1 1 64 GLY H . 64 GLY HN 1 1 738 1 2 1 1 67 HIS H . 67 HIS HN 1 1 739 1 1 1 1 64 GLY H . 64 GLY HN 1 1 739 1 2 1 1 67 HIS HD2 . 67 HIS HD2 1 1 740 1 1 1 1 64 GLY H . 64 GLY HN 1 1 740 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 741 1 1 1 1 64 GLY HA2 . 64 GLY HA1 1 1 741 1 2 1 1 65 TYR H . 65 TYRF HN 1 1 742 1 1 1 1 64 GLY HA2 . 64 GLY HA1 1 1 742 1 2 1 1 67 HIS HD2 . 67 HIS HD2 1 1 743 1 1 1 1 64 GLY HA3 . 64 GLY HA2 1 1 743 1 2 1 1 67 HIS H . 67 HIS HN 1 1 744 1 1 1 1 65 TYR H . 65 TYRF HN 1 1 744 1 2 1 1 65 TYR HB2 . 65 TYRF HB2 1 1 745 1 1 1 1 65 TYR H . 65 TYRF HN 1 1 745 1 2 1 1 65 TYR HB3 . 65 TYRF HB3 1 1 746 1 1 1 1 65 TYR H . 65 TYRF HN 1 1 746 1 2 1 1 66 TYR H . 66 TYRF HN 1 1 747 1 1 1 1 65 TYR H . 65 TYRF HN 1 1 747 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 748 1 1 1 1 65 TYR HA . 65 TYRF HA 1 1 748 1 2 1 1 65 TYR HB2 . 65 TYRF HB2 1 1 749 1 1 1 1 65 TYR HA . 65 TYRF HA 1 1 749 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 750 1 1 1 1 65 TYR HA . 65 TYRF HA 1 1 750 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 751 1 1 1 1 65 TYR HB2 . 65 TYRF HB2 1 1 751 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 752 1 1 1 1 65 TYR HB3 . 65 TYRF HB3 1 1 752 1 2 1 1 66 TYR H . 66 TYRF HN 1 1 753 1 1 1 1 65 TYR HB3 . 65 TYRF HB3 1 1 753 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 754 1 1 1 1 65 TYR QE . 65 TYRF QE 1 1 754 1 2 1 1 66 TYR QD . 66 TYRF QD 1 1 755 1 1 1 1 66 TYR H . 66 TYRF HN 1 1 755 1 2 1 1 66 TYR HB2 . 66 TYRF HB2 1 1 756 1 1 1 1 66 TYR H . 66 TYRF HN 1 1 756 1 2 1 1 67 HIS H . 67 HIS HN 1 1 757 1 1 1 1 66 TYR H . 66 TYRF HN 1 1 757 1 2 1 1 67 HIS QB . 67 HIS QB 1 1 758 1 1 1 1 66 TYR H . 66 TYRF HN 1 1 758 1 2 1 1 70 HIS HD1 . 70 HISH HD1 1 1 759 1 1 1 1 66 TYR HA . 66 TYRF HA 1 1 759 1 2 1 1 69 MET HB2 . 69 MET HB2 1 1 760 1 1 1 1 66 TYR HA . 66 TYRF HA 1 1 760 1 2 1 1 70 HIS HE1 . 70 HISH HE1 1 1 761 1 1 1 1 66 TYR HB2 . 66 TYRF HB2 1 1 761 1 2 1 1 67 HIS H . 67 HIS HN 1 1 762 1 1 1 1 66 TYR HB2 . 66 TYRF HB2 1 1 762 1 2 1 1 70 HIS HD1 . 70 HISH HD1 1 1 763 1 1 1 1 66 TYR HB2 . 66 TYRF HB2 1 1 763 1 2 1 1 70 HIS HE1 . 70 HISH HE1 1 1 764 1 1 1 1 66 TYR QD . 66 TYRF QD 1 1 764 1 2 1 1 70 HIS HB2 . 70 HISH HB2 1 1 765 1 1 1 1 66 TYR QD . 66 TYRF QD 1 1 765 1 2 1 1 70 HIS HB3 . 70 HISH HB3 1 1 766 1 1 1 1 66 TYR QE . 66 TYRF QE 1 1 766 1 2 1 1 70 HIS HB3 . 70 HISH HB3 1 1 767 1 1 1 1 66 TYR QE . 66 TYRF QE 1 1 767 1 2 1 1 70 HIS HD1 . 70 HISH HD1 1 1 768 1 1 1 1 67 HIS H . 67 HIS HN 1 1 768 1 2 1 1 67 HIS QB . 67 HIS QB 1 1 769 1 1 1 1 67 HIS H . 67 HIS HN 1 1 769 1 2 1 1 67 HIS HD2 . 67 HIS HD2 1 1 770 1 1 1 1 67 HIS H . 67 HIS HN 1 1 770 1 2 1 1 68 VAL H . 68 VAL HN 1 1 771 1 1 1 1 67 HIS H . 67 HIS HN 1 1 771 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 772 1 1 1 1 67 HIS H . 67 HIS HN 1 1 772 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 773 1 1 1 1 67 HIS H . 67 HIS HN 1 1 773 1 2 1 1 70 HIS H . 70 HISH HN 1 1 774 1 1 1 1 67 HIS H . 67 HIS HN 1 1 774 1 2 1 1 70 HIS HD1 . 70 HISH HD1 1 1 775 1 1 1 1 67 HIS HA . 67 HIS HA 1 1 775 1 2 1 1 70 HIS H . 70 HISH HN 1 1 776 1 1 1 1 67 HIS HA . 67 HIS HA 1 1 776 1 2 1 1 70 HIS HB2 . 70 HISH HB2 1 1 777 1 1 1 1 67 HIS HA . 67 HIS HA 1 1 777 1 2 1 1 71 ASP QB . 71 ASP- QB 1 1 778 1 1 1 1 67 HIS HA . 67 HIS HA 1 1 778 1 2 1 1 74 THR MG . 74 THR QG2 1 1 779 1 1 1 1 67 HIS QB . 67 HIS QB 1 1 779 1 2 1 1 68 VAL H . 68 VAL HN 1 1 780 1 1 1 1 67 HIS QB . 67 HIS QB 1 1 780 1 2 1 1 71 ASP H . 71 ASP- HN 1 1 781 1 1 1 1 67 HIS HD2 . 67 HIS HD2 1 1 781 1 2 1 1 68 VAL H . 68 VAL HN 1 1 782 1 1 1 1 67 HIS HD2 . 67 HIS HD2 1 1 782 1 2 1 1 68 VAL HA . 68 VAL HA 1 1 783 1 1 1 1 67 HIS HD2 . 67 HIS HD2 1 1 783 1 2 1 1 68 VAL HB . 68 VAL HB 1 1 784 1 1 1 1 67 HIS HD2 . 67 HIS HD2 1 1 784 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 785 1 1 1 1 67 HIS HD2 . 67 HIS HD2 1 1 785 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 786 1 1 1 1 67 HIS HD2 . 67 HIS HD2 1 1 786 1 2 1 1 74 THR HB . 74 THR HB 1 1 787 1 1 1 1 67 HIS HD2 . 67 HIS HD2 1 1 787 1 2 1 1 74 THR MG . 74 THR QG2 1 1 788 1 1 1 1 67 HIS HE1 . 67 HIS HE1 1 1 788 1 2 1 1 68 VAL HA . 68 VAL HA 1 1 789 1 1 1 1 67 HIS HE1 . 67 HIS HE1 1 1 789 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 790 1 1 1 1 67 HIS HE1 . 67 HIS HE1 1 1 790 1 2 1 1 71 ASP HA . 71 ASP- HA 1 1 791 1 1 1 1 67 HIS HE1 . 67 HIS HE1 1 1 791 1 2 1 1 71 ASP QB . 71 ASP- QB 1 1 792 1 1 1 1 67 HIS HE1 . 67 HIS HE1 1 1 792 1 2 1 1 73 ASN HB2 . 73 ASN HB2 1 1 793 1 1 1 1 67 HIS HE1 . 67 HIS HE1 1 1 793 1 2 1 1 73 ASN QB . 73 ASN QB 1 1 794 1 1 1 1 67 HIS HE1 . 67 HIS HE1 1 1 794 1 2 1 1 73 ASN HB3 . 73 ASN HB3 1 1 795 1 1 1 1 67 HIS HE1 . 67 HIS HE1 1 1 795 1 2 1 1 74 THR HA . 74 THR HA 1 1 796 1 1 1 1 67 HIS HE1 . 67 HIS HE1 1 1 796 1 2 1 1 74 THR HB . 74 THR HB 1 1 797 1 1 1 1 67 HIS HE1 . 67 HIS HE1 1 1 797 1 2 1 1 74 THR MG . 74 THR QG2 1 1 798 1 1 1 1 68 VAL H . 68 VAL HN 1 1 798 1 2 1 1 69 MET H . 69 MET HN 1 1 799 1 1 1 1 68 VAL H . 68 VAL HN 1 1 799 1 2 1 1 69 MET QG . 69 MET QG 1 1 800 1 1 1 1 68 VAL H . 68 VAL HN 1 1 800 1 2 1 1 70 HIS H . 70 HISH HN 1 1 801 1 1 1 1 68 VAL H . 68 VAL HN 1 1 801 1 2 1 1 71 ASP H . 71 ASP- HN 1 1 802 1 1 1 1 68 VAL H . 68 VAL HN 1 1 802 1 2 1 1 74 THR MG . 74 THR QG2 1 1 803 1 1 1 1 68 VAL HA . 68 VAL HA 1 1 803 1 2 1 1 68 VAL HB . 68 VAL HB 1 1 804 1 1 1 1 68 VAL HA . 68 VAL HA 1 1 804 1 2 1 1 68 VAL MG1 . 68 VAL QG1 1 1 805 1 1 1 1 68 VAL HA . 68 VAL HA 1 1 805 1 2 1 1 68 VAL MG2 . 68 VAL QG2 1 1 806 1 1 1 1 68 VAL HA . 68 VAL HA 1 1 806 1 2 1 1 70 HIS H . 70 HISH HN 1 1 807 1 1 1 1 68 VAL HA . 68 VAL HA 1 1 807 1 2 1 1 71 ASP H . 71 ASP- HN 1 1 808 1 1 1 1 68 VAL HA . 68 VAL HA 1 1 808 1 2 1 1 74 THR MG . 74 THR QG2 1 1 809 1 1 1 1 68 VAL HA . 68 VAL HA 1 1 809 1 2 1 1 78 SER HA . 78 SER HA 1 1 810 1 1 1 1 68 VAL HA . 68 VAL HA 1 1 810 1 2 1 1 78 SER HB2 . 78 SER HB2 1 1 811 1 1 1 1 68 VAL HB . 68 VAL HB 1 1 811 1 2 1 1 78 SER HA . 78 SER HA 1 1 812 1 1 1 1 68 VAL MG1 . 68 VAL QG1 1 1 812 1 2 1 1 69 MET H . 69 MET HN 1 1 813 1 1 1 1 68 VAL MG1 . 68 VAL QG1 1 1 813 1 2 1 1 69 MET ME . 69 MET QE 1 1 814 1 1 1 1 68 VAL MG1 . 68 VAL QG1 1 1 814 1 2 1 1 74 THR HA . 74 THR HA 1 1 815 1 1 1 1 68 VAL MG1 . 68 VAL QG1 1 1 815 1 2 1 1 74 THR HB . 74 THR HB 1 1 816 1 1 1 1 68 VAL MG1 . 68 VAL QG1 1 1 816 1 2 1 1 74 THR MG . 74 THR QG2 1 1 817 1 1 1 1 68 VAL MG1 . 68 VAL QG1 1 1 817 1 2 1 1 78 SER H . 78 SER HN 1 1 818 1 1 1 1 68 VAL MG1 . 68 VAL QG1 1 1 818 1 2 1 1 78 SER HA . 78 SER HA 1 1 819 1 1 1 1 68 VAL MG1 . 68 VAL QG1 1 1 819 1 2 1 1 78 SER HB3 . 78 SER HB3 1 1 820 1 1 1 1 68 VAL MG2 . 68 VAL QG2 1 1 820 1 2 1 1 69 MET H . 69 MET HN 1 1 821 1 1 1 1 68 VAL MG2 . 68 VAL QG2 1 1 821 1 2 1 1 69 MET HA . 69 MET HA 1 1 822 1 1 1 1 68 VAL MG2 . 68 VAL QG2 1 1 822 1 2 1 1 69 MET HB2 . 69 MET HB2 1 1 823 1 1 1 1 68 VAL MG2 . 68 VAL QG2 1 1 823 1 2 1 1 69 MET ME . 69 MET QE 1 1 824 1 1 1 1 68 VAL MG2 . 68 VAL QG2 1 1 824 1 2 1 1 69 MET QG . 69 MET QG 1 1 825 1 1 1 1 68 VAL MG2 . 68 VAL QG2 1 1 825 1 2 1 1 70 HIS H . 70 HISH HN 1 1 826 1 1 1 1 68 VAL MG2 . 68 VAL QG2 1 1 826 1 2 1 1 74 THR MG . 74 THR QG2 1 1 827 1 1 1 1 68 VAL MG2 . 68 VAL QG2 1 1 827 1 2 1 1 78 SER HA . 78 SER HA 1 1 828 1 1 1 1 69 MET H . 69 MET HN 1 1 828 1 2 1 1 69 MET HB2 . 69 MET HB2 1 1 829 1 1 1 1 69 MET H . 69 MET HN 1 1 829 1 2 1 1 69 MET ME . 69 MET QE 1 1 830 1 1 1 1 69 MET H . 69 MET HN 1 1 830 1 2 1 1 69 MET QG . 69 MET QG 1 1 831 1 1 1 1 69 MET H . 69 MET HN 1 1 831 1 2 1 1 71 ASP H . 71 ASP- HN 1 1 832 1 1 1 1 69 MET HA . 69 MET HA 1 1 832 1 2 1 1 70 HIS HD2 . 70 HISH HD2 1 1 833 1 1 1 1 69 MET HA . 69 MET HA 1 1 833 1 2 1 1 78 SER HA . 78 SER HA 1 1 834 1 1 1 1 69 MET HA . 69 MET HA 1 1 834 1 2 1 1 78 SER HB2 . 78 SER HB2 1 1 835 1 1 1 1 69 MET HA . 69 MET HA 1 1 835 1 2 1 1 79 CYS H . 79 CYSH HN 1 1 836 1 1 1 1 69 MET HA . 69 MET HA 1 1 836 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 837 1 1 1 1 69 MET HB2 . 69 MET HB2 1 1 837 1 2 1 1 70 HIS H . 70 HISH HN 1 1 838 1 1 1 1 69 MET HB2 . 69 MET HB2 1 1 838 1 2 1 1 70 HIS HD1 . 70 HISH HD1 1 1 839 1 1 1 1 69 MET HB3 . 69 MET HB3 1 1 839 1 2 1 1 70 HIS H . 70 HISH HN 1 1 840 1 1 1 1 69 MET HB3 . 69 MET HB3 1 1 840 1 2 1 1 70 HIS HD1 . 70 HISH HD1 1 1 841 1 1 1 1 69 MET HB3 . 69 MET HB3 1 1 841 1 2 1 1 79 CYS H . 79 CYSH HN 1 1 842 1 1 1 1 69 MET HB3 . 69 MET HB3 1 1 842 1 2 1 1 79 CYS HB2 . 79 CYSH HB2 1 1 843 1 1 1 1 69 MET QG . 69 MET QG 1 1 843 1 2 1 1 70 HIS HD1 . 70 HISH HD1 1 1 844 1 1 1 1 70 HIS H . 70 HISH HN 1 1 844 1 2 1 1 70 HIS HB2 . 70 HISH HB2 1 1 845 1 1 1 1 70 HIS H . 70 HISH HN 1 1 845 1 2 1 1 70 HIS HB3 . 70 HISH HB3 1 1 846 1 1 1 1 70 HIS H . 70 HISH HN 1 1 846 1 2 1 1 70 HIS HD1 . 70 HISH HD1 1 1 847 1 1 1 1 70 HIS H . 70 HISH HN 1 1 847 1 2 1 1 70 HIS HD2 . 70 HISH HD2 1 1 848 1 1 1 1 70 HIS H . 70 HISH HN 1 1 848 1 2 1 1 70 HIS HE1 . 70 HISH HE1 1 1 849 1 1 1 1 70 HIS H . 70 HISH HN 1 1 849 1 2 1 1 71 ASP H . 71 ASP- HN 1 1 850 1 1 1 1 70 HIS H . 70 HISH HN 1 1 850 1 2 1 1 71 ASP HA . 71 ASP- HA 1 1 851 1 1 1 1 70 HIS H . 70 HISH HN 1 1 851 1 2 1 1 71 ASP QB . 71 ASP- QB 1 1 852 1 1 1 1 70 HIS H . 70 HISH HN 1 1 852 1 2 1 1 79 CYS HB3 . 79 CYSH HB3 1 1 853 1 1 1 1 70 HIS H . 70 HISH HN 1 1 853 1 2 1 1 80 VAL HB . 80 VAL HB 1 1 854 1 1 1 1 70 HIS H . 70 HISH HN 1 1 854 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 855 1 1 1 1 70 HIS H . 70 HISH HN 1 1 855 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 856 1 1 1 1 70 HIS HA . 70 HISH HA 1 1 856 1 2 1 1 70 HIS HB3 . 70 HISH HB3 1 1 857 1 1 1 1 70 HIS HA . 70 HISH HA 1 1 857 1 2 1 1 70 HIS HD2 . 70 HISH HD2 1 1 858 1 1 1 1 70 HIS HA . 70 HISH HA 1 1 858 1 2 1 1 80 VAL HB . 80 VAL HB 1 1 859 1 1 1 1 70 HIS HA . 70 HISH HA 1 1 859 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 860 1 1 1 1 70 HIS HA . 70 HISH HA 1 1 860 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 861 1 1 1 1 70 HIS HA . 70 HISH HA 1 1 861 1 2 1 1 81 GLY H . 81 GLY HN 1 1 862 1 1 1 1 70 HIS HB2 . 70 HISH HB2 1 1 862 1 2 1 1 70 HIS HD1 . 70 HISH HD1 1 1 863 1 1 1 1 70 HIS HB2 . 70 HISH HB2 1 1 863 1 2 1 1 71 ASP H . 71 ASP- HN 1 1 864 1 1 1 1 70 HIS HB2 . 70 HISH HB2 1 1 864 1 2 1 1 71 ASP HA . 71 ASP- HA 1 1 865 1 1 1 1 70 HIS HB2 . 70 HISH HB2 1 1 865 1 2 1 1 80 VAL HB . 80 VAL HB 1 1 866 1 1 1 1 70 HIS HB2 . 70 HISH HB2 1 1 866 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 867 1 1 1 1 70 HIS HB3 . 70 HISH HB3 1 1 867 1 2 1 1 70 HIS HD1 . 70 HISH HD1 1 1 868 1 1 1 1 70 HIS HB3 . 70 HISH HB3 1 1 868 1 2 1 1 70 HIS HD2 . 70 HISH HD2 1 1 869 1 1 1 1 70 HIS HB3 . 70 HISH HB3 1 1 869 1 2 1 1 71 ASP H . 71 ASP- HN 1 1 870 1 1 1 1 70 HIS HB3 . 70 HISH HB3 1 1 870 1 2 1 1 71 ASP HA . 71 ASP- HA 1 1 871 1 1 1 1 70 HIS HB3 . 70 HISH HB3 1 1 871 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 872 1 1 1 1 70 HIS HB3 . 70 HISH HB3 1 1 872 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 873 1 1 1 1 70 HIS HD1 . 70 HISH HD1 1 1 873 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 874 1 1 1 1 70 HIS HD2 . 70 HISH HD2 1 1 874 1 2 1 1 80 VAL H . 80 VAL HN 1 1 875 1 1 1 1 70 HIS HD2 . 70 HISH HD2 1 1 875 1 2 1 1 80 VAL HB . 80 VAL HB 1 1 876 1 1 1 1 70 HIS HD2 . 70 HISH HD2 1 1 876 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 877 1 1 1 1 70 HIS HD2 . 70 HISH HD2 1 1 877 1 2 1 1 106 HIS HD2 . 106 HISH HD2 1 1 878 1 1 1 1 71 ASP H . 71 ASP- HN 1 1 878 1 2 1 1 74 THR MG . 74 THR QG2 1 1 879 1 1 1 1 71 ASP H . 71 ASP- HN 1 1 879 1 2 1 1 78 SER HG . 78 SER HG 1 1 880 1 1 1 1 71 ASP H . 71 ASP- HN 1 1 880 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 881 1 1 1 1 71 ASP HA . 71 ASP- HA 1 1 881 1 2 1 1 72 LYS QG . 72 LYS QG 1 1 882 1 1 1 1 71 ASP HA . 71 ASP- HA 1 1 882 1 2 1 1 74 THR MG . 74 THR QG2 1 1 883 1 1 1 1 71 ASP HA . 71 ASP- HA 1 1 883 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 884 1 1 1 1 71 ASP HA . 71 ASP- HA 1 1 884 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 885 1 1 1 1 71 ASP QB . 71 ASP- QB 1 1 885 1 2 1 1 72 LYS QG . 72 LYS QG 1 1 886 1 1 1 1 71 ASP QB . 71 ASP- QB 1 1 886 1 2 1 1 74 THR MG . 74 THR QG2 1 1 887 1 1 1 1 72 LYS HA . 72 LYS HA 1 1 887 1 2 1 1 72 LYS QD . 72 LYS QD 1 1 888 1 1 1 1 72 LYS HA . 72 LYS HA 1 1 888 1 2 1 1 72 LYS HG2 . 72 LYS HG2 1 1 889 1 1 1 1 72 LYS HA . 72 LYS HA 1 1 889 1 2 1 1 72 LYS QG . 72 LYS QG 1 1 890 1 1 1 1 72 LYS HA . 72 LYS HA 1 1 890 1 2 1 1 72 LYS HG3 . 72 LYS HG3 1 1 891 1 1 1 1 72 LYS HA . 72 LYS HA 1 1 891 1 2 1 1 74 THR MG . 74 THR QG2 1 1 892 1 1 1 1 72 LYS HA . 72 LYS HA 1 1 892 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 893 1 1 1 1 72 LYS HA . 72 LYS HA 1 1 893 1 2 1 1 81 GLY H . 81 GLY HN 1 1 894 1 1 1 1 72 LYS HA . 72 LYS HA 1 1 894 1 2 1 1 81 GLY QA . 81 GLY QA 1 1 895 1 1 1 1 72 LYS QD . 72 LYS QD 1 1 895 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 896 1 1 1 1 72 LYS QD . 72 LYS QD 1 1 896 1 2 1 1 84 VAL MG1 . 84 VAL QG1 1 1 897 1 1 1 1 72 LYS QD . 72 LYS QD 1 1 897 1 2 1 1 84 VAL MG2 . 84 VAL QG2 1 1 898 1 1 1 1 72 LYS QE . 72 LYS QE 1 1 898 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 899 1 1 1 1 72 LYS QE . 72 LYS QE 1 1 899 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 900 1 1 1 1 72 LYS QE . 72 LYS QE 1 1 900 1 2 1 1 84 VAL MG1 . 84 VAL QG1 1 1 901 1 1 1 1 72 LYS QE . 72 LYS QE 1 1 901 1 2 1 1 84 VAL MG2 . 84 VAL QG2 1 1 902 1 1 1 1 72 LYS QG . 72 LYS QG 1 1 902 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 903 1 1 1 1 72 LYS QG . 72 LYS QG 1 1 903 1 2 1 1 81 GLY QA . 81 GLY QA 1 1 904 1 1 1 1 72 LYS HG2 . 72 LYS HG2 1 1 904 1 2 1 1 81 GLY HA2 . 81 GLY HA1 1 1 905 1 1 1 1 72 LYS HG2 . 72 LYS HG2 1 1 905 1 2 1 1 81 GLY HA3 . 81 GLY HA2 1 1 906 1 1 1 1 72 LYS HG3 . 72 LYS HG3 1 1 906 1 2 1 1 81 GLY HA2 . 81 GLY HA1 1 1 907 1 1 1 1 72 LYS HG3 . 72 LYS HG3 1 1 907 1 2 1 1 81 GLY HA3 . 81 GLY HA2 1 1 908 1 1 1 1 74 THR HA . 74 THR HA 1 1 908 1 2 1 1 74 THR MG . 74 THR QG2 1 1 909 1 1 1 1 74 THR HA . 74 THR HA 1 1 909 1 2 1 1 75 LYS H . 75 LYS HN 1 1 910 1 1 1 1 74 THR HA . 74 THR HA 1 1 910 1 2 1 1 76 PHE H . 76 PHEF HN 1 1 911 1 1 1 1 74 THR HB . 74 THR HB 1 1 911 1 2 1 1 75 LYS H . 75 LYS HN 1 1 912 1 1 1 1 74 THR HB . 74 THR HB 1 1 912 1 2 1 1 75 LYS HB2 . 75 LYS HB2 1 1 913 1 1 1 1 74 THR HB . 74 THR HB 1 1 913 1 2 1 1 75 LYS HB3 . 75 LYS HB3 1 1 914 1 1 1 1 74 THR HB . 74 THR HB 1 1 914 1 2 1 1 75 LYS HG2 . 75 LYS HG2 1 1 915 1 1 1 1 74 THR HB . 74 THR HB 1 1 915 1 2 1 1 76 PHE H . 76 PHEF HN 1 1 916 1 1 1 1 74 THR MG . 74 THR QG2 1 1 916 1 2 1 1 75 LYS H . 75 LYS HN 1 1 917 1 1 1 1 74 THR MG . 74 THR QG2 1 1 917 1 2 1 1 78 SER HA . 78 SER HA 1 1 918 1 1 1 1 74 THR MG . 74 THR QG2 1 1 918 1 2 1 1 78 SER HB3 . 78 SER HB3 1 1 919 1 1 1 1 75 LYS H . 75 LYS HN 1 1 919 1 2 1 1 75 LYS HB2 . 75 LYS HB2 1 1 920 1 1 1 1 75 LYS H . 75 LYS HN 1 1 920 1 2 1 1 76 PHE H . 76 PHEF HN 1 1 921 1 1 1 1 75 LYS H . 75 LYS HN 1 1 921 1 2 1 1 76 PHE QD . 76 PHEF QD 1 1 922 1 1 1 1 75 LYS HA . 75 LYS HA 1 1 922 1 2 1 1 75 LYS HB2 . 75 LYS HB2 1 1 923 1 1 1 1 75 LYS HA . 75 LYS HA 1 1 923 1 2 1 1 75 LYS HG2 . 75 LYS HG2 1 1 924 1 1 1 1 75 LYS HA . 75 LYS HA 1 1 924 1 2 1 1 75 LYS HG3 . 75 LYS HG3 1 1 925 1 1 1 1 75 LYS HA . 75 LYS HA 1 1 925 1 2 1 1 76 PHE QD . 76 PHEF QD 1 1 926 1 1 1 1 75 LYS HA . 75 LYS HA 1 1 926 1 2 1 1 76 PHE QE . 76 PHEF QE 1 1 927 1 1 1 1 75 LYS HB2 . 75 LYS HB2 1 1 927 1 2 1 1 76 PHE H . 76 PHEF HN 1 1 928 1 1 1 1 75 LYS HB2 . 75 LYS HB2 1 1 928 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 929 1 1 1 1 75 LYS HB3 . 75 LYS HB3 1 1 929 1 2 1 1 76 PHE H . 76 PHEF HN 1 1 930 1 1 1 1 75 LYS HB3 . 75 LYS HB3 1 1 930 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 931 1 1 1 1 75 LYS QD . 75 LYS QD 1 1 931 1 2 1 1 76 PHE QD . 76 PHEF QD 1 1 932 1 1 1 1 75 LYS QD . 75 LYS QD 1 1 932 1 2 1 1 76 PHE QE . 76 PHEF QE 1 1 933 1 1 1 1 75 LYS QD . 75 LYS QD 1 1 933 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 934 1 1 1 1 75 LYS QE . 75 LYS QE 1 1 934 1 2 1 1 76 PHE QE . 76 PHEF QE 1 1 935 1 1 1 1 75 LYS QE . 75 LYS QE 1 1 935 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 936 1 1 1 1 75 LYS HG2 . 75 LYS HG2 1 1 936 1 2 1 1 76 PHE QD . 76 PHEF QD 1 1 937 1 1 1 1 75 LYS HG2 . 75 LYS HG2 1 1 937 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 938 1 1 1 1 75 LYS HG3 . 75 LYS HG3 1 1 938 1 2 1 1 76 PHE HA . 76 PHEF HA 1 1 939 1 1 1 1 75 LYS HG3 . 75 LYS HG3 1 1 939 1 2 1 1 76 PHE QD . 76 PHEF QD 1 1 940 1 1 1 1 75 LYS HG3 . 75 LYS HG3 1 1 940 1 2 1 1 76 PHE QE . 76 PHEF QE 1 1 941 1 1 1 1 75 LYS HG3 . 75 LYS HG3 1 1 941 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 942 1 1 1 1 76 PHE H . 76 PHEF HN 1 1 942 1 2 1 1 77 LYS H . 77 LYS HN 1 1 943 1 1 1 1 76 PHE HA . 76 PHEF HA 1 1 943 1 2 1 1 76 PHE HB3 . 76 PHEF HB3 1 1 944 1 1 1 1 76 PHE HA . 76 PHEF HA 1 1 944 1 2 1 1 76 PHE QE . 76 PHEF QE 1 1 945 1 1 1 1 76 PHE HA . 76 PHEF HA 1 1 945 1 2 1 1 76 PHE HZ . 76 PHEF HZ 1 1 946 1 1 1 1 76 PHE HB2 . 76 PHEF HB2 1 1 946 1 2 1 1 77 LYS H . 77 LYS HN 1 1 947 1 1 1 1 77 LYS H . 77 LYS HN 1 1 947 1 2 1 1 77 LYS HB2 . 77 LYS HB2 1 1 948 1 1 1 1 77 LYS H . 77 LYS HN 1 1 948 1 2 1 1 77 LYS HB3 . 77 LYS HB3 1 1 949 1 1 1 1 77 LYS H . 77 LYS HN 1 1 949 1 2 1 1 77 LYS QG . 77 LYS QG 1 1 950 1 1 1 1 77 LYS H . 77 LYS HN 1 1 950 1 2 1 1 78 SER H . 78 SER HN 1 1 951 1 1 1 1 77 LYS HA . 77 LYS HA 1 1 951 1 2 1 1 77 LYS HG2 . 77 LYS HG2 1 1 952 1 1 1 1 77 LYS HA . 77 LYS HA 1 1 952 1 2 1 1 77 LYS QG . 77 LYS QG 1 1 953 1 1 1 1 77 LYS HA . 77 LYS HA 1 1 953 1 2 1 1 77 LYS HG3 . 77 LYS HG3 1 1 954 1 1 1 1 77 LYS HA . 77 LYS HA 1 1 954 1 2 1 1 78 SER H . 78 SER HN 1 1 955 1 1 1 1 77 LYS HA . 77 LYS HA 1 1 955 1 2 1 1 78 SER HA . 78 SER HA 1 1 956 1 1 1 1 77 LYS HB2 . 77 LYS HB2 1 1 956 1 2 1 1 82 CYS HB2 . 82 HEMC HB2 1 1 957 1 1 1 1 77 LYS HB3 . 77 LYS HB3 1 1 957 1 2 1 1 78 SER H . 78 SER HN 1 1 958 1 1 1 1 77 LYS HB3 . 77 LYS HB3 1 1 958 1 2 1 1 78 SER HA . 78 SER HA 1 1 959 1 1 1 1 77 LYS QD . 77 LYS QD 1 1 959 1 2 1 1 78 SER H . 78 SER HN 1 1 960 1 1 1 1 77 LYS QG . 77 LYS QG 1 1 960 1 2 1 1 78 SER H . 78 SER HN 1 1 961 1 1 1 1 77 LYS QG . 77 LYS QG 1 1 961 1 2 1 1 82 CYS HB2 . 82 HEMC HB2 1 1 962 1 1 1 1 78 SER H . 78 SER HN 1 1 962 1 2 1 1 78 SER HB2 . 78 SER HB2 1 1 963 1 1 1 1 78 SER H . 78 SER HN 1 1 963 1 2 1 1 78 SER HB3 . 78 SER HB3 1 1 964 1 1 1 1 78 SER H . 78 SER HN 1 1 964 1 2 1 1 78 SER HG . 78 SER HG 1 1 965 1 1 1 1 78 SER H . 78 SER HN 1 1 965 1 2 1 1 80 VAL H . 80 VAL HN 1 1 966 1 1 1 1 78 SER H . 78 SER HN 1 1 966 1 2 1 1 81 GLY H . 81 GLY HN 1 1 967 1 1 1 1 78 SER H . 78 SER HN 1 1 967 1 2 1 1 81 GLY HA2 . 81 GLY HA1 1 1 968 1 1 1 1 78 SER H . 78 SER HN 1 1 968 1 2 1 1 81 GLY QA . 81 GLY QA 1 1 969 1 1 1 1 78 SER H . 78 SER HN 1 1 969 1 2 1 1 81 GLY HA3 . 81 GLY HA2 1 1 970 1 1 1 1 78 SER H . 78 SER HN 1 1 970 1 2 1 1 82 CYS H . 82 HEMC HN 1 1 971 1 1 1 1 78 SER HA . 78 SER HA 1 1 971 1 2 1 1 78 SER HB2 . 78 SER HB2 1 1 972 1 1 1 1 78 SER HA . 78 SER HA 1 1 972 1 2 1 1 78 SER HB3 . 78 SER HB3 1 1 973 1 1 1 1 78 SER HA . 78 SER HA 1 1 973 1 2 1 1 79 CYS H . 79 CYSH HN 1 1 974 1 1 1 1 78 SER HA . 78 SER HA 1 1 974 1 2 1 1 79 CYS HA . 79 CYSH HA 1 1 975 1 1 1 1 78 SER HA . 78 SER HA 1 1 975 1 2 1 1 79 CYS HB3 . 79 CYSH HB3 1 1 976 1 1 1 1 78 SER HA . 78 SER HA 1 1 976 1 2 1 1 81 GLY H . 81 GLY HN 1 1 977 1 1 1 1 78 SER HA . 78 SER HA 1 1 977 1 2 1 1 82 CYS H . 82 HEMC HN 1 1 978 1 1 1 1 78 SER HB2 . 78 SER HB2 1 1 978 1 2 1 1 79 CYS H . 79 CYSH HN 1 1 979 1 1 1 1 78 SER HB2 . 78 SER HB2 1 1 979 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 980 1 1 1 1 78 SER HB2 . 78 SER HB2 1 1 980 1 2 1 1 81 GLY H . 81 GLY HN 1 1 981 1 1 1 1 78 SER HB3 . 78 SER HB3 1 1 981 1 2 1 1 79 CYS H . 79 CYSH HN 1 1 982 1 1 1 1 78 SER HB3 . 78 SER HB3 1 1 982 1 2 1 1 80 VAL H . 80 VAL HN 1 1 983 1 1 1 1 78 SER HB3 . 78 SER HB3 1 1 983 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 984 1 1 1 1 78 SER HG . 78 SER HG 1 1 984 1 2 1 1 79 CYS H . 79 CYSH HN 1 1 985 1 1 1 1 78 SER HG . 78 SER HG 1 1 985 1 2 1 1 81 GLY H . 81 GLY HN 1 1 986 1 1 1 1 79 CYS H . 79 CYSH HN 1 1 986 1 2 1 1 79 CYS HB2 . 79 CYSH HB2 1 1 987 1 1 1 1 79 CYS H . 79 CYSH HN 1 1 987 1 2 1 1 79 CYS HB3 . 79 CYSH HB3 1 1 988 1 1 1 1 79 CYS H . 79 CYSH HN 1 1 988 1 2 1 1 80 VAL H . 80 VAL HN 1 1 989 1 1 1 1 79 CYS H . 79 CYSH HN 1 1 989 1 2 1 1 80 VAL HB . 80 VAL HB 1 1 990 1 1 1 1 79 CYS H . 79 CYSH HN 1 1 990 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 991 1 1 1 1 79 CYS H . 79 CYSH HN 1 1 991 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 992 1 1 1 1 79 CYS H . 79 CYSH HN 1 1 992 1 2 1 1 81 GLY H . 81 GLY HN 1 1 993 1 1 1 1 79 CYS H . 79 CYSH HN 1 1 993 1 2 1 1 82 CYS H . 82 HEMC HN 1 1 994 1 1 1 1 79 CYS HA . 79 CYSH HA 1 1 994 1 2 1 1 79 CYS HB3 . 79 CYSH HB3 1 1 995 1 1 1 1 79 CYS HA . 79 CYSH HA 1 1 995 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 996 1 1 1 1 79 CYS HA . 79 CYSH HA 1 1 996 1 2 1 1 83 HIS H . 83 HISH HN 1 1 997 1 1 1 1 79 CYS HB2 . 79 CYSH HB2 1 1 997 1 2 1 1 80 VAL H . 80 VAL HN 1 1 998 1 1 1 1 79 CYS HB2 . 79 CYSH HB2 1 1 998 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 999 1 1 1 1 79 CYS HB2 . 79 CYSH HB2 1 1 999 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 1000 1 1 1 1 79 CYS HB3 . 79 CYSH HB3 1 1 1000 1 2 1 1 80 VAL H . 80 VAL HN 1 1 1001 1 1 1 1 79 CYS HB3 . 79 CYSH HB3 1 1 1001 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1002 1 1 1 1 79 CYS HB3 . 79 CYSH HB3 1 1 1002 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 1003 1 1 1 1 80 VAL H . 80 VAL HN 1 1 1003 1 2 1 1 80 VAL HB . 80 VAL HB 1 1 1004 1 1 1 1 80 VAL H . 80 VAL HN 1 1 1004 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1005 1 1 1 1 80 VAL H . 80 VAL HN 1 1 1005 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 1006 1 1 1 1 80 VAL H . 80 VAL HN 1 1 1006 1 2 1 1 81 GLY H . 81 GLY HN 1 1 1007 1 1 1 1 80 VAL H . 80 VAL HN 1 1 1007 1 2 1 1 81 GLY QA . 81 GLY QA 1 1 1008 1 1 1 1 80 VAL H . 80 VAL HN 1 1 1008 1 2 1 1 82 CYS H . 82 HEMC HN 1 1 1009 1 1 1 1 80 VAL H . 80 VAL HN 1 1 1009 1 2 1 1 83 HIS H . 83 HISH HN 1 1 1010 1 1 1 1 80 VAL HA . 80 VAL HA 1 1 1010 1 2 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1011 1 1 1 1 80 VAL HA . 80 VAL HA 1 1 1011 1 2 1 1 80 VAL MG2 . 80 VAL QG2 1 1 1012 1 1 1 1 80 VAL HA . 80 VAL HA 1 1 1012 1 2 1 1 82 CYS H . 82 HEMC HN 1 1 1013 1 1 1 1 80 VAL HA . 80 VAL HA 1 1 1013 1 2 1 1 83 HIS H . 83 HISH HN 1 1 1014 1 1 1 1 80 VAL HA . 80 VAL HA 1 1 1014 1 2 1 1 83 HIS HB2 . 83 HISH HB2 1 1 1015 1 1 1 1 80 VAL HA . 80 VAL HA 1 1 1015 1 2 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1016 1 1 1 1 80 VAL HA . 80 VAL HA 1 1 1016 1 2 1 1 84 VAL H . 84 VAL HN 1 1 1017 1 1 1 1 80 VAL HA . 80 VAL HA 1 1 1017 1 2 1 1 84 VAL MG2 . 84 VAL QG2 1 1 1018 1 1 1 1 80 VAL HA . 80 VAL HA 1 1 1018 1 2 1 1 98 THR HA . 98 THR HA 1 1 1019 1 1 1 1 80 VAL HA . 80 VAL HA 1 1 1019 1 2 1 1 98 THR HB . 98 THR HB 1 1 1020 1 1 1 1 80 VAL HA . 80 VAL HA 1 1 1020 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1021 1 1 1 1 80 VAL HB . 80 VAL HB 1 1 1021 1 2 1 1 81 GLY H . 81 GLY HN 1 1 1022 1 1 1 1 80 VAL HB . 80 VAL HB 1 1 1022 1 2 1 1 82 CYS H . 82 HEMC HN 1 1 1023 1 1 1 1 80 VAL HB . 80 VAL HB 1 1 1023 1 2 1 1 83 HIS H . 83 HISH HN 1 1 1024 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1024 1 2 1 1 81 GLY H . 81 GLY HN 1 1 1025 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1025 1 2 1 1 81 GLY HA2 . 81 GLY HA1 1 1 1026 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1026 1 2 1 1 81 GLY QA . 81 GLY QA 1 1 1027 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1027 1 2 1 1 81 GLY HA3 . 81 GLY HA2 1 1 1028 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1028 1 2 1 1 82 CYS H . 82 HEMC HN 1 1 1029 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1029 1 2 1 1 83 HIS H . 83 HISH HN 1 1 1030 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1030 1 2 1 1 83 HIS HB2 . 83 HISH HB2 1 1 1031 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1031 1 2 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1032 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1032 1 2 1 1 84 VAL H . 84 VAL HN 1 1 1033 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1033 1 2 1 1 84 VAL HA . 84 VAL HA 1 1 1034 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1034 1 2 1 1 84 VAL HB . 84 VAL HB 1 1 1035 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1035 1 2 1 1 84 VAL MG1 . 84 VAL QG1 1 1 1036 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1036 1 2 1 1 84 VAL MG2 . 84 VAL QG2 1 1 1037 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1037 1 2 1 1 97 LEU HB3 . 97 LEU HB3 1 1 1038 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1038 1 2 1 1 98 THR HA . 98 THR HA 1 1 1039 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1039 1 2 1 1 98 THR HB . 98 THR HB 1 1 1040 1 1 1 1 80 VAL MG1 . 80 VAL QG1 1 1 1040 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1041 1 1 1 1 80 VAL MG2 . 80 VAL QG2 1 1 1041 1 2 1 1 81 GLY H . 81 GLY HN 1 1 1042 1 1 1 1 80 VAL MG2 . 80 VAL QG2 1 1 1042 1 2 1 1 83 HIS H . 83 HISH HN 1 1 1043 1 1 1 1 80 VAL MG2 . 80 VAL QG2 1 1 1043 1 2 1 1 83 HIS HB2 . 83 HISH HB2 1 1 1044 1 1 1 1 80 VAL MG2 . 80 VAL QG2 1 1 1044 1 2 1 1 84 VAL MG2 . 84 VAL QG2 1 1 1045 1 1 1 1 80 VAL MG2 . 80 VAL QG2 1 1 1045 1 2 1 1 98 THR HA . 98 THR HA 1 1 1046 1 1 1 1 80 VAL MG2 . 80 VAL QG2 1 1 1046 1 2 1 1 98 THR HB . 98 THR HB 1 1 1047 1 1 1 1 80 VAL MG2 . 80 VAL QG2 1 1 1047 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1048 1 1 1 1 80 VAL MG2 . 80 VAL QG2 1 1 1048 1 2 1 1 106 HIS HD2 . 106 HISH HD2 1 1 1049 1 1 1 1 81 GLY H . 81 GLY HN 1 1 1049 1 2 1 1 81 GLY HA2 . 81 GLY HA1 1 1 1050 1 1 1 1 81 GLY H . 81 GLY HN 1 1 1050 1 2 1 1 81 GLY QA . 81 GLY QA 1 1 1051 1 1 1 1 81 GLY H . 81 GLY HN 1 1 1051 1 2 1 1 81 GLY HA3 . 81 GLY HA2 1 1 1052 1 1 1 1 81 GLY H . 81 GLY HN 1 1 1052 1 2 1 1 82 CYS H . 82 HEMC HN 1 1 1053 1 1 1 1 81 GLY H . 81 GLY HN 1 1 1053 1 2 1 1 83 HIS H . 83 HISH HN 1 1 1054 1 1 1 1 81 GLY H . 81 GLY HN 1 1 1054 1 2 1 1 84 VAL MG2 . 84 VAL QG2 1 1 1055 1 1 1 1 81 GLY QA . 81 GLY QA 1 1 1055 1 2 1 1 83 HIS H . 83 HISH HN 1 1 1056 1 1 1 1 81 GLY QA . 81 GLY QA 1 1 1056 1 2 1 1 84 VAL H . 84 VAL HN 1 1 1057 1 1 1 1 81 GLY QA . 81 GLY QA 1 1 1057 1 2 1 1 84 VAL MG2 . 84 VAL QG2 1 1 1058 1 1 1 1 81 GLY HA2 . 81 GLY HA1 1 1 1058 1 2 1 1 83 HIS H . 83 HISH HN 1 1 1059 1 1 1 1 81 GLY HA3 . 81 GLY HA2 1 1 1059 1 2 1 1 83 HIS H . 83 HISH HN 1 1 1060 1 1 1 1 82 CYS H . 82 HEMC HN 1 1 1060 1 2 1 1 82 CYS HB2 . 82 HEMC HB2 1 1 1061 1 1 1 1 82 CYS H . 82 HEMC HN 1 1 1061 1 2 1 1 82 CYS HB3 . 82 HEMC HB3 1 1 1062 1 1 1 1 82 CYS H . 82 HEMC HN 1 1 1062 1 2 1 1 83 HIS H . 83 HISH HN 1 1 1063 1 1 1 1 82 CYS H . 82 HEMC HN 1 1 1063 1 2 1 1 83 HIS HA . 83 HISH HA 1 1 1064 1 1 1 1 82 CYS H . 82 HEMC HN 1 1 1064 1 2 1 1 85 GLU H . 85 GLU- HN 1 1 1065 1 1 1 1 82 CYS HA . 82 HEMC HA 1 1 1065 1 2 1 1 82 CYS HB2 . 82 HEMC HB2 1 1 1066 1 1 1 1 82 CYS HA . 82 HEMC HA 1 1 1066 1 2 1 1 83 HIS HD2 . 83 HISH HD2 1 1 1067 1 1 1 1 82 CYS HA . 82 HEMC HA 1 1 1067 1 2 1 1 84 VAL H . 84 VAL HN 1 1 1068 1 1 1 1 82 CYS HA . 82 HEMC HA 1 1 1068 1 2 1 1 85 GLU H . 85 GLU- HN 1 1 1069 1 1 1 1 82 CYS HA . 82 HEMC HA 1 1 1069 1 2 1 1 85 GLU HB2 . 85 GLU- HB2 1 1 1070 1 1 1 1 82 CYS HA . 82 HEMC HA 1 1 1070 1 2 1 1 85 GLU HB3 . 85 GLU- HB3 1 1 1071 1 1 1 1 82 CYS HB2 . 82 HEMC HB2 1 1 1071 1 2 1 1 83 HIS H . 83 HISH HN 1 1 1072 1 1 1 1 82 CYS HB3 . 82 HEMC HB3 1 1 1072 1 2 1 1 83 HIS H . 83 HISH HN 1 1 1073 1 1 1 1 83 HIS H . 83 HISH HN 1 1 1073 1 2 1 1 83 HIS HB2 . 83 HISH HB2 1 1 1074 1 1 1 1 83 HIS H . 83 HISH HN 1 1 1074 1 2 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1075 1 1 1 1 83 HIS H . 83 HISH HN 1 1 1075 1 2 1 1 83 HIS HD2 . 83 HISH HD2 1 1 1076 1 1 1 1 83 HIS H . 83 HISH HN 1 1 1076 1 2 1 1 84 VAL H . 84 VAL HN 1 1 1077 1 1 1 1 83 HIS H . 83 HISH HN 1 1 1077 1 2 1 1 84 VAL HA . 84 VAL HA 1 1 1078 1 1 1 1 83 HIS H . 83 HISH HN 1 1 1078 1 2 1 1 84 VAL HB . 84 VAL HB 1 1 1079 1 1 1 1 83 HIS H . 83 HISH HN 1 1 1079 1 2 1 1 84 VAL MG1 . 84 VAL QG1 1 1 1080 1 1 1 1 83 HIS H . 83 HISH HN 1 1 1080 1 2 1 1 86 VAL H . 86 VAL HN 1 1 1081 1 1 1 1 83 HIS H . 83 HISH HN 1 1 1081 1 2 1 1 86 VAL HB . 86 VAL HB 1 1 1082 1 1 1 1 83 HIS H . 83 HISH HN 1 1 1082 1 2 1 1 98 THR HA . 98 THR HA 1 1 1083 1 1 1 1 83 HIS H . 83 HISH HN 1 1 1083 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1084 1 1 1 1 83 HIS HA . 83 HISH HA 1 1 1084 1 2 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1085 1 1 1 1 83 HIS HA . 83 HISH HA 1 1 1085 1 2 1 1 85 GLU H . 85 GLU- HN 1 1 1086 1 1 1 1 83 HIS HA . 83 HISH HA 1 1 1086 1 2 1 1 86 VAL H . 86 VAL HN 1 1 1087 1 1 1 1 83 HIS HA . 83 HISH HA 1 1 1087 1 2 1 1 86 VAL HB . 86 VAL HB 1 1 1088 1 1 1 1 83 HIS HA . 83 HISH HA 1 1 1088 1 2 1 1 88 GLY H . 88 GLY HN 1 1 1089 1 1 1 1 83 HIS HA . 83 HISH HA 1 1 1089 1 2 1 1 97 LEU MD1 . 97 LEU QD1 1 1 1090 1 1 1 1 83 HIS HA . 83 HISH HA 1 1 1090 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1091 1 1 1 1 83 HIS HB2 . 83 HISH HB2 1 1 1091 1 2 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1092 1 1 1 1 83 HIS HB2 . 83 HISH HB2 1 1 1092 1 2 1 1 84 VAL H . 84 VAL HN 1 1 1093 1 1 1 1 83 HIS HB2 . 83 HISH HB2 1 1 1093 1 2 1 1 98 THR HA . 98 THR HA 1 1 1094 1 1 1 1 83 HIS HB2 . 83 HISH HB2 1 1 1094 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1095 1 1 1 1 83 HIS HB3 . 83 HISH HB3 1 1 1095 1 2 1 1 84 VAL H . 84 VAL HN 1 1 1096 1 1 1 1 83 HIS HB3 . 83 HISH HB3 1 1 1096 1 2 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1097 1 1 1 1 83 HIS HB3 . 83 HISH HB3 1 1 1097 1 2 1 1 98 THR HA . 98 THR HA 1 1 1098 1 1 1 1 83 HIS HB3 . 83 HISH HB3 1 1 1098 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1099 1 1 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1099 1 2 1 1 84 VAL H . 84 VAL HN 1 1 1100 1 1 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1100 1 2 1 1 87 ALA MB . 87 ALA QB 1 1 1101 1 1 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1101 1 2 1 1 97 LEU H . 97 LEU HN 1 1 1102 1 1 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1102 1 2 1 1 97 LEU HA . 97 LEU HA 1 1 1103 1 1 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1103 1 2 1 1 97 LEU HB2 . 97 LEU HB2 1 1 1104 1 1 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1104 1 2 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1105 1 1 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1105 1 2 1 1 98 THR H . 98 THR HN 1 1 1106 1 1 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1106 1 2 1 1 98 THR HA . 98 THR HA 1 1 1107 1 1 1 1 83 HIS HD1 . 83 HISH HD1 1 1 1107 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1108 1 1 1 1 83 HIS HE1 . 83 HISH HE1 1 1 1108 1 2 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1109 1 1 1 1 84 VAL H . 84 VAL HN 1 1 1109 1 2 1 1 84 VAL HA . 84 VAL HA 1 1 1110 1 1 1 1 84 VAL H . 84 VAL HN 1 1 1110 1 2 1 1 84 VAL MG2 . 84 VAL QG2 1 1 1111 1 1 1 1 84 VAL H . 84 VAL HN 1 1 1111 1 2 1 1 86 VAL MG2 . 86 VAL QG2 1 1 1112 1 1 1 1 84 VAL H . 84 VAL HN 1 1 1112 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1113 1 1 1 1 84 VAL HA . 84 VAL HA 1 1 1113 1 2 1 1 84 VAL HB . 84 VAL HB 1 1 1114 1 1 1 1 84 VAL HA . 84 VAL HA 1 1 1114 1 2 1 1 84 VAL MG1 . 84 VAL QG1 1 1 1115 1 1 1 1 84 VAL HA . 84 VAL HA 1 1 1115 1 2 1 1 84 VAL MG2 . 84 VAL QG2 1 1 1116 1 1 1 1 84 VAL HA . 84 VAL HA 1 1 1116 1 2 1 1 86 VAL H . 86 VAL HN 1 1 1117 1 1 1 1 84 VAL HA . 84 VAL HA 1 1 1117 1 2 1 1 87 ALA MB . 87 ALA QB 1 1 1118 1 1 1 1 84 VAL HA . 84 VAL HA 1 1 1118 1 2 1 1 88 GLY H . 88 GLY HN 1 1 1119 1 1 1 1 84 VAL HA . 84 VAL HA 1 1 1119 1 2 1 1 97 LEU HB3 . 97 LEU HB3 1 1 1120 1 1 1 1 84 VAL HA . 84 VAL HA 1 1 1120 1 2 1 1 98 THR HA . 98 THR HA 1 1 1121 1 1 1 1 84 VAL HA . 84 VAL HA 1 1 1121 1 2 1 1 98 THR HB . 98 THR HB 1 1 1122 1 1 1 1 84 VAL HA . 84 VAL HA 1 1 1122 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1123 1 1 1 1 84 VAL HB . 84 VAL HB 1 1 1123 1 2 1 1 85 GLU H . 85 GLU- HN 1 1 1124 1 1 1 1 84 VAL MG1 . 84 VAL QG1 1 1 1124 1 2 1 1 85 GLU H . 85 GLU- HN 1 1 1125 1 1 1 1 84 VAL MG1 . 84 VAL QG1 1 1 1125 1 2 1 1 85 GLU HA . 85 GLU- HA 1 1 1126 1 1 1 1 84 VAL MG1 . 84 VAL QG1 1 1 1126 1 2 1 1 85 GLU HB2 . 85 GLU- HB2 1 1 1127 1 1 1 1 84 VAL MG1 . 84 VAL QG1 1 1 1127 1 2 1 1 86 VAL H . 86 VAL HN 1 1 1128 1 1 1 1 84 VAL MG1 . 84 VAL QG1 1 1 1128 1 2 1 1 88 GLY H . 88 GLY HN 1 1 1129 1 1 1 1 84 VAL MG1 . 84 VAL QG1 1 1 1129 1 2 1 1 98 THR HA . 98 THR HA 1 1 1130 1 1 1 1 84 VAL MG1 . 84 VAL QG1 1 1 1130 1 2 1 1 98 THR HB . 98 THR HB 1 1 1131 1 1 1 1 84 VAL MG2 . 84 VAL QG2 1 1 1131 1 2 1 1 85 GLU HA . 85 GLU- HA 1 1 1132 1 1 1 1 84 VAL MG2 . 84 VAL QG2 1 1 1132 1 2 1 1 98 THR HA . 98 THR HA 1 1 1133 1 1 1 1 84 VAL MG2 . 84 VAL QG2 1 1 1133 1 2 1 1 98 THR HB . 98 THR HB 1 1 1134 1 1 1 1 85 GLU H . 85 GLU- HN 1 1 1134 1 2 1 1 85 GLU HA . 85 GLU- HA 1 1 1135 1 1 1 1 85 GLU H . 85 GLU- HN 1 1 1135 1 2 1 1 85 GLU HB2 . 85 GLU- HB2 1 1 1136 1 1 1 1 85 GLU H . 85 GLU- HN 1 1 1136 1 2 1 1 85 GLU HB3 . 85 GLU- HB3 1 1 1137 1 1 1 1 85 GLU H . 85 GLU- HN 1 1 1137 1 2 1 1 85 GLU HG2 . 85 GLU- HG2 1 1 1138 1 1 1 1 85 GLU H . 85 GLU- HN 1 1 1138 1 2 1 1 85 GLU QG . 85 GLU- QG 1 1 1139 1 1 1 1 85 GLU H . 85 GLU- HN 1 1 1139 1 2 1 1 85 GLU HG3 . 85 GLU- HG3 1 1 1140 1 1 1 1 85 GLU H . 85 GLU- HN 1 1 1140 1 2 1 1 86 VAL H . 86 VAL HN 1 1 1141 1 1 1 1 85 GLU H . 85 GLU- HN 1 1 1141 1 2 1 1 86 VAL HA . 86 VAL HA 1 1 1142 1 1 1 1 85 GLU H . 85 GLU- HN 1 1 1142 1 2 1 1 87 ALA MB . 87 ALA QB 1 1 1143 1 1 1 1 85 GLU HA . 85 GLU- HA 1 1 1143 1 2 1 1 85 GLU HG2 . 85 GLU- HG2 1 1 1144 1 1 1 1 85 GLU HA . 85 GLU- HA 1 1 1144 1 2 1 1 85 GLU QG . 85 GLU- QG 1 1 1145 1 1 1 1 85 GLU HA . 85 GLU- HA 1 1 1145 1 2 1 1 85 GLU HG3 . 85 GLU- HG3 1 1 1146 1 1 1 1 85 GLU HA . 85 GLU- HA 1 1 1146 1 2 1 1 86 VAL H . 86 VAL HN 1 1 1147 1 1 1 1 85 GLU HA . 85 GLU- HA 1 1 1147 1 2 1 1 88 GLY H . 88 GLY HN 1 1 1148 1 1 1 1 85 GLU HB2 . 85 GLU- HB2 1 1 1148 1 2 1 1 86 VAL H . 86 VAL HN 1 1 1149 1 1 1 1 85 GLU HB3 . 85 GLU- HB3 1 1 1149 1 2 1 1 86 VAL H . 86 VAL HN 1 1 1150 1 1 1 1 85 GLU QG . 85 GLU- QG 1 1 1150 1 2 1 1 86 VAL H . 86 VAL HN 1 1 1151 1 1 1 1 86 VAL H . 86 VAL HN 1 1 1151 1 2 1 1 86 VAL HA . 86 VAL HA 1 1 1152 1 1 1 1 86 VAL H . 86 VAL HN 1 1 1152 1 2 1 1 86 VAL HB . 86 VAL HB 1 1 1153 1 1 1 1 86 VAL H . 86 VAL HN 1 1 1153 1 2 1 1 86 VAL MG2 . 86 VAL QG2 1 1 1154 1 1 1 1 86 VAL H . 86 VAL HN 1 1 1154 1 2 1 1 87 ALA H . 87 ALA HN 1 1 1155 1 1 1 1 86 VAL H . 86 VAL HN 1 1 1155 1 2 1 1 88 GLY H . 88 GLY HN 1 1 1156 1 1 1 1 86 VAL H . 86 VAL HN 1 1 1156 1 2 1 1 97 LEU HB2 . 97 LEU HB2 1 1 1157 1 1 1 1 86 VAL H . 86 VAL HN 1 1 1157 1 2 1 1 97 LEU MD1 . 97 LEU QD1 1 1 1158 1 1 1 1 86 VAL HA . 86 VAL HA 1 1 1158 1 2 1 1 86 VAL MG1 . 86 VAL QG1 1 1 1159 1 1 1 1 86 VAL HA . 86 VAL HA 1 1 1159 1 2 1 1 86 VAL MG2 . 86 VAL QG2 1 1 1160 1 1 1 1 86 VAL HA . 86 VAL HA 1 1 1160 1 2 1 1 97 LEU MD1 . 97 LEU QD1 1 1 1161 1 1 1 1 86 VAL HB . 86 VAL HB 1 1 1161 1 2 1 1 87 ALA H . 87 ALA HN 1 1 1162 1 1 1 1 86 VAL HB . 86 VAL HB 1 1 1162 1 2 1 1 87 ALA MB . 87 ALA QB 1 1 1163 1 1 1 1 86 VAL HB . 86 VAL HB 1 1 1163 1 2 1 1 88 GLY H . 88 GLY HN 1 1 1164 1 1 1 1 86 VAL HB . 86 VAL HB 1 1 1164 1 2 1 1 97 LEU MD1 . 97 LEU QD1 1 1 1165 1 1 1 1 86 VAL HB . 86 VAL HB 1 1 1165 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1166 1 1 1 1 86 VAL MG1 . 86 VAL QG1 1 1 1166 1 2 1 1 87 ALA H . 87 ALA HN 1 1 1167 1 1 1 1 86 VAL MG1 . 86 VAL QG1 1 1 1167 1 2 1 1 87 ALA HA . 87 ALA HA 1 1 1168 1 1 1 1 86 VAL MG1 . 86 VAL QG1 1 1 1168 1 2 1 1 93 LYS QE . 93 LYS QE 1 1 1169 1 1 1 1 86 VAL MG1 . 86 VAL QG1 1 1 1169 1 2 1 1 97 LEU MD1 . 97 LEU QD1 1 1 1170 1 1 1 1 87 ALA H . 87 ALA HN 1 1 1170 1 2 1 1 87 ALA MB . 87 ALA QB 1 1 1171 1 1 1 1 87 ALA H . 87 ALA HN 1 1 1171 1 2 1 1 88 GLY H . 88 GLY HN 1 1 1172 1 1 1 1 87 ALA H . 87 ALA HN 1 1 1172 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1173 1 1 1 1 87 ALA HA . 87 ALA HA 1 1 1173 1 2 1 1 93 LYS HB2 . 93 LYS HB2 1 1 1174 1 1 1 1 87 ALA HA . 87 ALA HA 1 1 1174 1 2 1 1 93 LYS HB3 . 93 LYS HB3 1 1 1175 1 1 1 1 87 ALA HA . 87 ALA HA 1 1 1175 1 2 1 1 93 LYS QG . 93 LYS QG 1 1 1176 1 1 1 1 87 ALA HA . 87 ALA HA 1 1 1176 1 2 1 1 94 LYS H . 94 LYS HN 1 1 1177 1 1 1 1 87 ALA HA . 87 ALA HA 1 1 1177 1 2 1 1 97 LEU MD1 . 97 LEU QD1 1 1 1178 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1178 1 2 1 1 88 GLY H . 88 GLY HN 1 1 1179 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1179 1 2 1 1 89 ALA HA . 89 ALA HA 1 1 1180 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1180 1 2 1 1 90 ASP HB2 . 90 ASP- HB2 1 1 1181 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1181 1 2 1 1 91 ALA HA . 91 ALA HA 1 1 1182 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1182 1 2 1 1 93 LYS HA . 93 LYS HA 1 1 1183 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1183 1 2 1 1 93 LYS HB2 . 93 LYS HB2 1 1 1184 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1184 1 2 1 1 93 LYS HB3 . 93 LYS HB3 1 1 1185 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1185 1 2 1 1 93 LYS QD . 93 LYS QD 1 1 1186 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1186 1 2 1 1 93 LYS QE . 93 LYS QE 1 1 1187 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1187 1 2 1 1 94 LYS H . 94 LYS HN 1 1 1188 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1188 1 2 1 1 94 LYS HA . 94 LYS HA 1 1 1189 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1189 1 2 1 1 94 LYS QE . 94 LYS QE 1 1 1190 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1190 1 2 1 1 97 LEU MD1 . 97 LEU QD1 1 1 1191 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1191 1 2 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1192 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1192 1 2 1 1 98 THR H . 98 THR HN 1 1 1193 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1193 1 2 1 1 98 THR HA . 98 THR HA 1 1 1194 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1194 1 2 1 1 98 THR HB . 98 THR HB 1 1 1195 1 1 1 1 87 ALA MB . 87 ALA QB 1 1 1195 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1196 1 1 1 1 88 GLY HA3 . 88 GLY HA2 1 1 1196 1 2 1 1 90 ASP HB2 . 90 ASP- HB2 1 1 1197 1 1 1 1 89 ALA HA . 89 ALA HA 1 1 1197 1 2 1 1 90 ASP HB2 . 90 ASP- HB2 1 1 1198 1 1 1 1 89 ALA HA . 89 ALA HA 1 1 1198 1 2 1 1 94 LYS QE . 94 LYS QE 1 1 1199 1 1 1 1 89 ALA MB . 89 ALA QB 1 1 1199 1 2 1 1 90 ASP HA . 90 ASP- HA 1 1 1200 1 1 1 1 90 ASP H . 90 ASP- HN 1 1 1200 1 2 1 1 90 ASP HB2 . 90 ASP- HB2 1 1 1201 1 1 1 1 90 ASP H . 90 ASP- HN 1 1 1201 1 2 1 1 90 ASP HB3 . 90 ASP- HB3 1 1 1202 1 1 1 1 90 ASP H . 90 ASP- HN 1 1 1202 1 2 1 1 94 LYS H . 94 LYS HN 1 1 1203 1 1 1 1 90 ASP HA . 90 ASP- HA 1 1 1203 1 2 1 1 90 ASP HB2 . 90 ASP- HB2 1 1 1204 1 1 1 1 90 ASP HA . 90 ASP- HA 1 1 1204 1 2 1 1 90 ASP HB3 . 90 ASP- HB3 1 1 1205 1 1 1 1 90 ASP HA . 90 ASP- HA 1 1 1205 1 2 1 1 91 ALA HA . 91 ALA HA 1 1 1206 1 1 1 1 90 ASP HA . 90 ASP- HA 1 1 1206 1 2 1 1 91 ALA MB . 91 ALA QB 1 1 1207 1 1 1 1 90 ASP HB2 . 90 ASP- HB2 1 1 1207 1 2 1 1 93 LYS H . 93 LYS HN 1 1 1208 1 1 1 1 90 ASP HB2 . 90 ASP- HB2 1 1 1208 1 2 1 1 93 LYS HB2 . 93 LYS HB2 1 1 1209 1 1 1 1 90 ASP HB2 . 90 ASP- HB2 1 1 1209 1 2 1 1 94 LYS H . 94 LYS HN 1 1 1210 1 1 1 1 90 ASP HB3 . 90 ASP- HB3 1 1 1210 1 2 1 1 93 LYS H . 93 LYS HN 1 1 1211 1 1 1 1 91 ALA HA . 91 ALA HA 1 1 1211 1 2 1 1 93 LYS H . 93 LYS HN 1 1 1212 1 1 1 1 91 ALA HA . 91 ALA HA 1 1 1212 1 2 1 1 94 LYS H . 94 LYS HN 1 1 1213 1 1 1 1 91 ALA HA . 91 ALA HA 1 1 1213 1 2 1 1 94 LYS QB . 94 LYS QB 1 1 1214 1 1 1 1 91 ALA HA . 91 ALA HA 1 1 1214 1 2 1 1 94 LYS QE . 94 LYS QE 1 1 1215 1 1 1 1 91 ALA HA . 91 ALA HA 1 1 1215 1 2 1 1 95 LYS H . 95 LYS HN 1 1 1216 1 1 1 1 92 ALA HA . 92 ALA HA 1 1 1216 1 2 1 1 95 LYS HB2 . 95 LYS HB2 1 1 1217 1 1 1 1 92 ALA HA . 92 ALA HA 1 1 1217 1 2 1 1 96 ASP H . 96 ASP- HN 1 1 1218 1 1 1 1 92 ALA MB . 92 ALA QB 1 1 1218 1 2 1 1 93 LYS H . 93 LYS HN 1 1 1219 1 1 1 1 92 ALA MB . 92 ALA QB 1 1 1219 1 2 1 1 94 LYS H . 94 LYS HN 1 1 1220 1 1 1 1 93 LYS H . 93 LYS HN 1 1 1220 1 2 1 1 93 LYS HB2 . 93 LYS HB2 1 1 1221 1 1 1 1 93 LYS H . 93 LYS HN 1 1 1221 1 2 1 1 93 LYS HB3 . 93 LYS HB3 1 1 1222 1 1 1 1 93 LYS H . 93 LYS HN 1 1 1222 1 2 1 1 94 LYS H . 94 LYS HN 1 1 1223 1 1 1 1 93 LYS H . 93 LYS HN 1 1 1223 1 2 1 1 94 LYS HA . 94 LYS HA 1 1 1224 1 1 1 1 93 LYS HA . 93 LYS HA 1 1 1224 1 2 1 1 93 LYS HB3 . 93 LYS HB3 1 1 1225 1 1 1 1 93 LYS HA . 93 LYS HA 1 1 1225 1 2 1 1 95 LYS H . 95 LYS HN 1 1 1226 1 1 1 1 93 LYS HA . 93 LYS HA 1 1 1226 1 2 1 1 96 ASP H . 96 ASP- HN 1 1 1227 1 1 1 1 93 LYS HA . 93 LYS HA 1 1 1227 1 2 1 1 96 ASP HB2 . 96 ASP- HB2 1 1 1228 1 1 1 1 93 LYS HA . 93 LYS HA 1 1 1228 1 2 1 1 96 ASP HB3 . 96 ASP- HB3 1 1 1229 1 1 1 1 93 LYS HB2 . 93 LYS HB2 1 1 1229 1 2 1 1 94 LYS H . 94 LYS HN 1 1 1230 1 1 1 1 93 LYS HB2 . 93 LYS HB2 1 1 1230 1 2 1 1 94 LYS HA . 94 LYS HA 1 1 1231 1 1 1 1 93 LYS HB2 . 93 LYS HB2 1 1 1231 1 2 1 1 97 LEU HB2 . 97 LEU HB2 1 1 1232 1 1 1 1 93 LYS HB2 . 93 LYS HB2 1 1 1232 1 2 1 1 97 LEU MD1 . 97 LEU QD1 1 1 1233 1 1 1 1 93 LYS HB3 . 93 LYS HB3 1 1 1233 1 2 1 1 94 LYS H . 94 LYS HN 1 1 1234 1 1 1 1 93 LYS HB3 . 93 LYS HB3 1 1 1234 1 2 1 1 97 LEU MD1 . 97 LEU QD1 1 1 1235 1 1 1 1 93 LYS HB3 . 93 LYS HB3 1 1 1235 1 2 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1236 1 1 1 1 93 LYS QD . 93 LYS QD 1 1 1236 1 2 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1237 1 1 1 1 93 LYS QE . 93 LYS QE 1 1 1237 1 2 1 1 97 LEU MD1 . 97 LEU QD1 1 1 1238 1 1 1 1 94 LYS H . 94 LYS HN 1 1 1238 1 2 1 1 94 LYS QB . 94 LYS QB 1 1 1239 1 1 1 1 94 LYS H . 94 LYS HN 1 1 1239 1 2 1 1 94 LYS QD . 94 LYS QD 1 1 1240 1 1 1 1 94 LYS H . 94 LYS HN 1 1 1240 1 2 1 1 96 ASP H . 96 ASP- HN 1 1 1241 1 1 1 1 94 LYS H . 94 LYS HN 1 1 1241 1 2 1 1 97 LEU H . 97 LEU HN 1 1 1242 1 1 1 1 94 LYS H . 94 LYS HN 1 1 1242 1 2 1 1 97 LEU MD1 . 97 LEU QD1 1 1 1243 1 1 1 1 94 LYS HA . 94 LYS HA 1 1 1243 1 2 1 1 97 LEU H . 97 LEU HN 1 1 1244 1 1 1 1 94 LYS HA . 94 LYS HA 1 1 1244 1 2 1 1 98 THR H . 98 THR HN 1 1 1245 1 1 1 1 94 LYS HA . 94 LYS HA 1 1 1245 1 2 1 1 98 THR HA . 98 THR HA 1 1 1246 1 1 1 1 94 LYS HA . 94 LYS HA 1 1 1246 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1247 1 1 1 1 94 LYS QG . 94 LYS QG 1 1 1247 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1248 1 1 1 1 95 LYS HA . 95 LYS HA 1 1 1248 1 2 1 1 95 LYS HB2 . 95 LYS HB2 1 1 1249 1 1 1 1 95 LYS HA . 95 LYS HA 1 1 1249 1 2 1 1 95 LYS HG2 . 95 LYS HG2 1 1 1250 1 1 1 1 95 LYS HA . 95 LYS HA 1 1 1250 1 2 1 1 95 LYS HG3 . 95 LYS HG3 1 1 1251 1 1 1 1 95 LYS HA . 95 LYS HA 1 1 1251 1 2 1 1 98 THR HA . 98 THR HA 1 1 1252 1 1 1 1 95 LYS HA . 95 LYS HA 1 1 1252 1 2 1 1 99 GLY H . 99 GLY HN 1 1 1253 1 1 1 1 95 LYS HA . 95 LYS HA 1 1 1253 1 2 1 1 99 GLY HA2 . 99 GLY HA1 1 1 1254 1 1 1 1 95 LYS HA . 95 LYS HA 1 1 1254 1 2 1 1 99 GLY HA3 . 99 GLY HA2 1 1 1255 1 1 1 1 95 LYS HA . 95 LYS HA 1 1 1255 1 2 1 1 103 SER HA . 103 SER HA 1 1 1256 1 1 1 1 95 LYS HB2 . 95 LYS HB2 1 1 1256 1 2 1 1 99 GLY H . 99 GLY HN 1 1 1257 1 1 1 1 95 LYS QD . 95 LYS QD 1 1 1257 1 2 1 1 103 SER HA . 103 SER HA 1 1 1258 1 1 1 1 95 LYS HG2 . 95 LYS HG2 1 1 1258 1 2 1 1 103 SER HA . 103 SER HA 1 1 1259 1 1 1 1 95 LYS HG3 . 95 LYS HG3 1 1 1259 1 2 1 1 103 SER HA . 103 SER HA 1 1 1260 1 1 1 1 96 ASP H . 96 ASP- HN 1 1 1260 1 2 1 1 96 ASP HB2 . 96 ASP- HB2 1 1 1261 1 1 1 1 96 ASP H . 96 ASP- HN 1 1 1261 1 2 1 1 96 ASP HB3 . 96 ASP- HB3 1 1 1262 1 1 1 1 96 ASP H . 96 ASP- HN 1 1 1262 1 2 1 1 97 LEU H . 97 LEU HN 1 1 1263 1 1 1 1 96 ASP H . 96 ASP- HN 1 1 1263 1 2 1 1 97 LEU HB2 . 97 LEU HB2 1 1 1264 1 1 1 1 96 ASP H . 96 ASP- HN 1 1 1264 1 2 1 1 97 LEU HB3 . 97 LEU HB3 1 1 1265 1 1 1 1 96 ASP H . 96 ASP- HN 1 1 1265 1 2 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1266 1 1 1 1 96 ASP H . 96 ASP- HN 1 1 1266 1 2 1 1 97 LEU HG . 97 LEU HG 1 1 1267 1 1 1 1 96 ASP H . 96 ASP- HN 1 1 1267 1 2 1 1 99 GLY H . 99 GLY HN 1 1 1268 1 1 1 1 96 ASP H . 96 ASP- HN 1 1 1268 1 2 1 1 103 SER HA . 103 SER HA 1 1 1269 1 1 1 1 96 ASP H . 96 ASP- HN 1 1 1269 1 2 1 1 104 LYS H . 104 LYS HN 1 1 1270 1 1 1 1 96 ASP HA . 96 ASP- HA 1 1 1270 1 2 1 1 96 ASP HB2 . 96 ASP- HB2 1 1 1271 1 1 1 1 96 ASP HA . 96 ASP- HA 1 1 1271 1 2 1 1 96 ASP HB3 . 96 ASP- HB3 1 1 1272 1 1 1 1 96 ASP HA . 96 ASP- HA 1 1 1272 1 2 1 1 97 LEU HA . 97 LEU HA 1 1 1273 1 1 1 1 96 ASP HA . 96 ASP- HA 1 1 1273 1 2 1 1 97 LEU HB3 . 97 LEU HB3 1 1 1274 1 1 1 1 96 ASP HA . 96 ASP- HA 1 1 1274 1 2 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1275 1 1 1 1 96 ASP HA . 96 ASP- HA 1 1 1275 1 2 1 1 98 THR H . 98 THR HN 1 1 1276 1 1 1 1 96 ASP HA . 96 ASP- HA 1 1 1276 1 2 1 1 103 SER HA . 103 SER HA 1 1 1277 1 1 1 1 96 ASP HA . 96 ASP- HA 1 1 1277 1 2 1 1 104 LYS H . 104 LYS HN 1 1 1278 1 1 1 1 96 ASP HA . 96 ASP- HA 1 1 1278 1 2 1 1 104 LYS HG2 . 104 LYS HG2 1 1 1279 1 1 1 1 96 ASP HA . 96 ASP- HA 1 1 1279 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 1280 1 1 1 1 96 ASP HB3 . 96 ASP- HB3 1 1 1280 1 2 1 1 97 LEU MD1 . 97 LEU QD1 1 1 1281 1 1 1 1 96 ASP HB3 . 96 ASP- HB3 1 1 1281 1 2 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1282 1 1 1 1 96 ASP HB3 . 96 ASP- HB3 1 1 1282 1 2 1 1 97 LEU HG . 97 LEU HG 1 1 1283 1 1 1 1 96 ASP HB3 . 96 ASP- HB3 1 1 1283 1 2 1 1 103 SER HA . 103 SER HA 1 1 1284 1 1 1 1 96 ASP HB3 . 96 ASP- HB3 1 1 1284 1 2 1 1 104 LYS H . 104 LYS HN 1 1 1285 1 1 1 1 96 ASP HB3 . 96 ASP- HB3 1 1 1285 1 2 1 1 104 LYS HE2 . 104 LYS HE2 1 1 1286 1 1 1 1 96 ASP HB3 . 96 ASP- HB3 1 1 1286 1 2 1 1 104 LYS HG2 . 104 LYS HG2 1 1 1287 1 1 1 1 97 LEU H . 97 LEU HN 1 1 1287 1 2 1 1 97 LEU HA . 97 LEU HA 1 1 1288 1 1 1 1 97 LEU H . 97 LEU HN 1 1 1288 1 2 1 1 97 LEU HB2 . 97 LEU HB2 1 1 1289 1 1 1 1 97 LEU H . 97 LEU HN 1 1 1289 1 2 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1290 1 1 1 1 97 LEU H . 97 LEU HN 1 1 1290 1 2 1 1 98 THR H . 98 THR HN 1 1 1291 1 1 1 1 97 LEU H . 97 LEU HN 1 1 1291 1 2 1 1 99 GLY H . 99 GLY HN 1 1 1292 1 1 1 1 97 LEU HA . 97 LEU HA 1 1 1292 1 2 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1293 1 1 1 1 97 LEU HA . 97 LEU HA 1 1 1293 1 2 1 1 97 LEU HG . 97 LEU HG 1 1 1294 1 1 1 1 97 LEU HA . 97 LEU HA 1 1 1294 1 2 1 1 98 THR HA . 98 THR HA 1 1 1295 1 1 1 1 97 LEU HA . 97 LEU HA 1 1 1295 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1296 1 1 1 1 97 LEU HA . 97 LEU HA 1 1 1296 1 2 1 1 99 GLY H . 99 GLY HN 1 1 1297 1 1 1 1 97 LEU HB2 . 97 LEU HB2 1 1 1297 1 2 1 1 98 THR H . 98 THR HN 1 1 1298 1 1 1 1 97 LEU HB2 . 97 LEU HB2 1 1 1298 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1299 1 1 1 1 97 LEU HB3 . 97 LEU HB3 1 1 1299 1 2 1 1 98 THR H . 98 THR HN 1 1 1300 1 1 1 1 97 LEU HB3 . 97 LEU HB3 1 1 1300 1 2 1 1 98 THR HA . 98 THR HA 1 1 1301 1 1 1 1 97 LEU HB3 . 97 LEU HB3 1 1 1301 1 2 1 1 99 GLY H . 99 GLY HN 1 1 1302 1 1 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1302 1 2 1 1 98 THR H . 98 THR HN 1 1 1303 1 1 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1303 1 2 1 1 98 THR HA . 98 THR HA 1 1 1304 1 1 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1304 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1305 1 1 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1305 1 2 1 1 103 SER HA . 103 SER HA 1 1 1306 1 1 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1306 1 2 1 1 104 LYS HA . 104 LYS HA 1 1 1307 1 1 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1307 1 2 1 1 104 LYS HB2 . 104 LYS HB2 1 1 1308 1 1 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1308 1 2 1 1 104 LYS HB3 . 104 LYS HB3 1 1 1309 1 1 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1309 1 2 1 1 104 LYS HD2 . 104 LYS HD2 1 1 1310 1 1 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1310 1 2 1 1 104 LYS HE3 . 104 LYS HE3 1 1 1311 1 1 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1311 1 2 1 1 104 LYS HG2 . 104 LYS HG2 1 1 1312 1 1 1 1 97 LEU MD2 . 97 LEU QD2 1 1 1312 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 1313 1 1 1 1 98 THR H . 98 THR HN 1 1 1313 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1314 1 1 1 1 98 THR H . 98 THR HN 1 1 1314 1 2 1 1 99 GLY H . 99 GLY HN 1 1 1315 1 1 1 1 98 THR HA . 98 THR HA 1 1 1315 1 2 1 1 98 THR HB . 98 THR HB 1 1 1316 1 1 1 1 98 THR HA . 98 THR HA 1 1 1316 1 2 1 1 98 THR MG . 98 THR QG2 1 1 1317 1 1 1 1 98 THR HA . 98 THR HA 1 1 1317 1 2 1 1 99 GLY HA3 . 99 GLY HA2 1 1 1318 1 1 1 1 98 THR HA . 98 THR HA 1 1 1318 1 2 1 1 103 SER HG . 103 SER HG 1 1 1319 1 1 1 1 98 THR HA . 98 THR HA 1 1 1319 1 2 1 1 105 CYS HB2 . 105 HEMC HB2 1 1 1320 1 1 1 1 98 THR MG . 98 THR QG2 1 1 1320 1 2 1 1 99 GLY H . 99 GLY HN 1 1 1321 1 1 1 1 99 GLY H . 99 GLY HN 1 1 1321 1 2 1 1 100 CYS H . 100 CYSH HN 1 1 1322 1 1 1 1 99 GLY H . 99 GLY HN 1 1 1322 1 2 1 1 103 SER HA . 103 SER HA 1 1 1323 1 1 1 1 99 GLY H . 99 GLY HN 1 1 1323 1 2 1 1 103 SER HB3 . 103 SER HB3 1 1 1324 1 1 1 1 99 GLY H . 99 GLY HN 1 1 1324 1 2 1 1 103 SER HG . 103 SER HG 1 1 1325 1 1 1 1 99 GLY H . 99 GLY HN 1 1 1325 1 2 1 1 104 LYS H . 104 LYS HN 1 1 1326 1 1 1 1 99 GLY HA3 . 99 GLY HA2 1 1 1326 1 2 1 1 103 SER HA . 103 SER HA 1 1 1327 1 1 1 1 99 GLY HA3 . 99 GLY HA2 1 1 1327 1 2 1 1 103 SER HG . 103 SER HG 1 1 1328 1 1 1 1 100 CYS H . 100 CYSH HN 1 1 1328 1 2 1 1 101 LYS HA . 101 LYS HA 1 1 1329 1 1 1 1 100 CYS HA . 100 CYSH HA 1 1 1329 1 2 1 1 106 HIS QB . 106 HISH QB 1 1 1330 1 1 1 1 100 CYS HA . 100 CYSH HA 1 1 1330 1 2 1 1 106 HIS HD2 . 106 HISH HD2 1 1 1331 1 1 1 1 101 LYS HA . 101 LYS HA 1 1 1331 1 2 1 1 101 LYS HB2 . 101 LYS HB2 1 1 1332 1 1 1 1 101 LYS HA . 101 LYS HA 1 1 1332 1 2 1 1 101 LYS HG2 . 101 LYS HG2 1 1 1333 1 1 1 1 101 LYS HA . 101 LYS HA 1 1 1333 1 2 1 1 101 LYS HG3 . 101 LYS HG3 1 1 1334 1 1 1 1 101 LYS HA . 101 LYS HA 1 1 1334 1 2 1 1 102 LYS H . 102 LYS HN 1 1 1335 1 1 1 1 101 LYS HA . 101 LYS HA 1 1 1335 1 2 1 1 103 SER H . 103 SER HN 1 1 1336 1 1 1 1 101 LYS HA . 101 LYS HA 1 1 1336 1 2 1 1 106 HIS H . 106 HISH HN 1 1 1337 1 1 1 1 101 LYS HA . 101 LYS HA 1 1 1337 1 2 1 1 106 HIS HD1 . 106 HISH HD1 1 1 1338 1 1 1 1 101 LYS HA . 101 LYS HA 1 1 1338 1 2 1 1 106 HIS HD2 . 106 HISH HD2 1 1 1339 1 1 1 1 101 LYS HB2 . 101 LYS HB2 1 1 1339 1 2 1 1 102 LYS H . 102 LYS HN 1 1 1340 1 1 1 1 101 LYS HG2 . 101 LYS HG2 1 1 1340 1 2 1 1 102 LYS H . 102 LYS HN 1 1 1341 1 1 1 1 101 LYS HG2 . 101 LYS HG2 1 1 1341 1 2 1 1 102 LYS HA . 102 LYS HA 1 1 1342 1 1 1 1 101 LYS HG3 . 101 LYS HG3 1 1 1342 1 2 1 1 102 LYS H . 102 LYS HN 1 1 1343 1 1 1 1 102 LYS H . 102 LYS HN 1 1 1343 1 2 1 1 102 LYS HA . 102 LYS HA 1 1 1344 1 1 1 1 102 LYS H . 102 LYS HN 1 1 1344 1 2 1 1 102 LYS QG . 102 LYS QG 1 1 1345 1 1 1 1 102 LYS H . 102 LYS HN 1 1 1345 1 2 1 1 107 GLU HA . 107 GLU- HA 1 1 1346 1 1 1 1 102 LYS HA . 102 LYS HA 1 1 1346 1 2 1 1 102 LYS QD . 102 LYS QD 1 1 1347 1 1 1 1 102 LYS HA . 102 LYS HA 1 1 1347 1 2 1 1 102 LYS QG . 102 LYS QG 1 1 1348 1 1 1 1 102 LYS HA . 102 LYS HA 1 1 1348 1 2 1 1 103 SER H . 103 SER HN 1 1 1349 1 1 1 1 102 LYS HA . 102 LYS HA 1 1 1349 1 2 1 1 103 SER HA . 103 SER HA 1 1 1350 1 1 1 1 102 LYS HA . 102 LYS HA 1 1 1350 1 2 1 1 107 GLU H . 107 GLU- HN 1 1 1351 1 1 1 1 102 LYS HA . 102 LYS HA 1 1 1351 1 2 1 1 107 GLU HA . 107 GLU- HA 1 1 1352 1 1 1 1 102 LYS HA . 102 LYS HA 1 1 1352 1 2 1 1 107 GLU QG . 107 GLU- QG 1 1 1353 1 1 1 1 102 LYS QB . 102 LYS QB 1 1 1353 1 2 1 1 103 SER HA . 103 SER HA 1 1 1354 1 1 1 1 102 LYS QB . 102 LYS QB 1 1 1354 1 2 1 1 107 GLU HA . 107 GLU- HA 1 1 1355 1 1 1 1 102 LYS QG . 102 LYS QG 1 1 1355 1 2 1 1 103 SER HA . 103 SER HA 1 1 1356 1 1 1 1 102 LYS QG . 102 LYS QG 1 1 1356 1 2 1 1 107 GLU HA . 107 GLU- HA 1 1 1357 1 1 1 1 103 SER H . 103 SER HN 1 1 1357 1 2 1 1 103 SER HB3 . 103 SER HB3 1 1 1358 1 1 1 1 103 SER H . 103 SER HN 1 1 1358 1 2 1 1 103 SER HG . 103 SER HG 1 1 1359 1 1 1 1 103 SER H . 103 SER HN 1 1 1359 1 2 1 1 104 LYS H . 104 LYS HN 1 1 1360 1 1 1 1 103 SER H . 103 SER HN 1 1 1360 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 1361 1 1 1 1 103 SER H . 103 SER HN 1 1 1361 1 2 1 1 106 HIS H . 106 HISH HN 1 1 1362 1 1 1 1 103 SER H . 103 SER HN 1 1 1362 1 2 1 1 106 HIS QB . 106 HISH QB 1 1 1363 1 1 1 1 103 SER H . 103 SER HN 1 1 1363 1 2 1 1 107 GLU HA . 107 GLU- HA 1 1 1364 1 1 1 1 103 SER HA . 103 SER HA 1 1 1364 1 2 1 1 103 SER HB2 . 103 SER HB2 1 1 1365 1 1 1 1 103 SER HA . 103 SER HA 1 1 1365 1 2 1 1 103 SER HB3 . 103 SER HB3 1 1 1366 1 1 1 1 103 SER HA . 103 SER HA 1 1 1366 1 2 1 1 103 SER HG . 103 SER HG 1 1 1367 1 1 1 1 103 SER HA . 103 SER HA 1 1 1367 1 2 1 1 104 LYS H . 104 LYS HN 1 1 1368 1 1 1 1 103 SER HA . 103 SER HA 1 1 1368 1 2 1 1 104 LYS HB2 . 104 LYS HB2 1 1 1369 1 1 1 1 103 SER HA . 103 SER HA 1 1 1369 1 2 1 1 104 LYS HB3 . 104 LYS HB3 1 1 1370 1 1 1 1 103 SER HA . 103 SER HA 1 1 1370 1 2 1 1 104 LYS HG2 . 104 LYS HG2 1 1 1371 1 1 1 1 103 SER HA . 103 SER HA 1 1 1371 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 1372 1 1 1 1 103 SER HA . 103 SER HA 1 1 1372 1 2 1 1 106 HIS H . 106 HISH HN 1 1 1373 1 1 1 1 103 SER HA . 103 SER HA 1 1 1373 1 2 1 1 107 GLU HA . 107 GLU- HA 1 1 1374 1 1 1 1 103 SER HB2 . 103 SER HB2 1 1 1374 1 2 1 1 103 SER HG . 103 SER HG 1 1 1375 1 1 1 1 103 SER HB2 . 103 SER HB2 1 1 1375 1 2 1 1 104 LYS H . 104 LYS HN 1 1 1376 1 1 1 1 103 SER HB2 . 103 SER HB2 1 1 1376 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 1377 1 1 1 1 103 SER HB2 . 103 SER HB2 1 1 1377 1 2 1 1 106 HIS H . 106 HISH HN 1 1 1378 1 1 1 1 103 SER HB3 . 103 SER HB3 1 1 1378 1 2 1 1 104 LYS H . 104 LYS HN 1 1 1379 1 1 1 1 103 SER HB3 . 103 SER HB3 1 1 1379 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 1380 1 1 1 1 103 SER HB3 . 103 SER HB3 1 1 1380 1 2 1 1 106 HIS H . 106 HISH HN 1 1 1381 1 1 1 1 103 SER HG . 103 SER HG 1 1 1381 1 2 1 1 104 LYS H . 104 LYS HN 1 1 1382 1 1 1 1 103 SER HG . 103 SER HG 1 1 1382 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 1383 1 1 1 1 103 SER HG . 103 SER HG 1 1 1383 1 2 1 1 106 HIS H . 106 HISH HN 1 1 1384 1 1 1 1 104 LYS H . 104 LYS HN 1 1 1384 1 2 1 1 104 LYS HB2 . 104 LYS HB2 1 1 1385 1 1 1 1 104 LYS H . 104 LYS HN 1 1 1385 1 2 1 1 104 LYS HB3 . 104 LYS HB3 1 1 1386 1 1 1 1 104 LYS H . 104 LYS HN 1 1 1386 1 2 1 1 104 LYS HD2 . 104 LYS HD2 1 1 1387 1 1 1 1 104 LYS H . 104 LYS HN 1 1 1387 1 2 1 1 104 LYS HD3 . 104 LYS HD3 1 1 1388 1 1 1 1 104 LYS H . 104 LYS HN 1 1 1388 1 2 1 1 104 LYS HE2 . 104 LYS HE2 1 1 1389 1 1 1 1 104 LYS H . 104 LYS HN 1 1 1389 1 2 1 1 104 LYS HG2 . 104 LYS HG2 1 1 1390 1 1 1 1 104 LYS H . 104 LYS HN 1 1 1390 1 2 1 1 104 LYS HG3 . 104 LYS HG3 1 1 1391 1 1 1 1 104 LYS H . 104 LYS HN 1 1 1391 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 1392 1 1 1 1 104 LYS H . 104 LYS HN 1 1 1392 1 2 1 1 105 CYS HA . 105 HEMC HA 1 1 1393 1 1 1 1 104 LYS H . 104 LYS HN 1 1 1393 1 2 1 1 106 HIS H . 106 HISH HN 1 1 1394 1 1 1 1 104 LYS HA . 104 LYS HA 1 1 1394 1 2 1 1 104 LYS HB3 . 104 LYS HB3 1 1 1395 1 1 1 1 104 LYS HA . 104 LYS HA 1 1 1395 1 2 1 1 104 LYS HD2 . 104 LYS HD2 1 1 1396 1 1 1 1 104 LYS HA . 104 LYS HA 1 1 1396 1 2 1 1 104 LYS HD3 . 104 LYS HD3 1 1 1397 1 1 1 1 104 LYS HA . 104 LYS HA 1 1 1397 1 2 1 1 104 LYS HE2 . 104 LYS HE2 1 1 1398 1 1 1 1 104 LYS HA . 104 LYS HA 1 1 1398 1 2 1 1 104 LYS HG3 . 104 LYS HG3 1 1 1399 1 1 1 1 104 LYS HA . 104 LYS HA 1 1 1399 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 1400 1 1 1 1 104 LYS HA . 104 LYS HA 1 1 1400 1 2 1 1 106 HIS H . 106 HISH HN 1 1 1401 1 1 1 1 104 LYS HB2 . 104 LYS HB2 1 1 1401 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 1402 1 1 1 1 104 LYS HB3 . 104 LYS HB3 1 1 1402 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 1403 1 1 1 1 104 LYS HG2 . 104 LYS HG2 1 1 1403 1 2 1 1 105 CYS H . 105 HEMC HN 1 1 1404 1 1 1 1 104 LYS HG2 . 104 LYS HG2 1 1 1404 1 2 1 1 106 HIS H . 106 HISH HN 1 1 1405 1 1 1 1 105 CYS H . 105 HEMC HN 1 1 1405 1 2 1 1 105 CYS HB2 . 105 HEMC HB2 1 1 1406 1 1 1 1 105 CYS H . 105 HEMC HN 1 1 1406 1 2 1 1 106 HIS H . 106 HISH HN 1 1 1407 1 1 1 1 105 CYS H . 105 HEMC HN 1 1 1407 1 2 1 1 106 HIS HD2 . 106 HISH HD2 1 1 1408 1 1 1 1 105 CYS HA . 105 HEMC HA 1 1 1408 1 2 1 1 105 CYS HB3 . 105 HEMC HB3 1 1 1409 1 1 1 1 105 CYS HB2 . 105 HEMC HB2 1 1 1409 1 2 1 1 106 HIS H . 106 HISH HN 1 1 1410 1 1 1 1 106 HIS H . 106 HISH HN 1 1 1410 1 2 1 1 106 HIS HD1 . 106 HISH HD1 1 1 1411 1 1 1 1 106 HIS H . 106 HISH HN 1 1 1411 1 2 1 1 106 HIS HD2 . 106 HISH HD2 1 1 1412 1 1 1 1 106 HIS H . 106 HISH HN 1 1 1412 1 2 1 1 107 GLU H . 107 GLU- HN 1 1 1413 1 1 1 1 106 HIS H . 106 HISH HN 1 1 1413 1 2 1 1 107 GLU QG . 107 GLU- QG 1 1 1414 1 1 1 1 106 HIS HA . 106 HISH HA 1 1 1414 1 2 1 1 106 HIS HD1 . 106 HISH HD1 1 1 1415 1 1 1 1 106 HIS HA . 106 HISH HA 1 1 1415 1 2 1 1 106 HIS HD2 . 106 HISH HD2 1 1 1416 1 1 1 1 106 HIS HA . 106 HISH HA 1 1 1416 1 2 1 1 106 HIS HE1 . 106 HISH HE1 1 1 1417 1 1 1 1 106 HIS HA . 106 HISH HA 1 1 1417 1 2 1 1 107 GLU H . 107 GLU- HN 1 1 1418 1 1 1 1 106 HIS HA . 106 HISH HA 1 1 1418 1 2 1 1 107 GLU QG . 107 GLU- QG 1 1 1419 1 1 1 1 106 HIS QB . 106 HISH QB 1 1 1419 1 2 1 1 107 GLU H . 107 GLU- HN 1 1 1420 1 1 1 1 106 HIS HD1 . 106 HISH HD1 1 1 1420 1 2 1 1 107 GLU H . 107 GLU- HN 1 1 1421 1 1 1 1 107 GLU H . 107 GLU- HN 1 1 1421 1 2 1 1 107 GLU QB . 107 GLU- QB 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 . . . . . . . 3.1 1 1 2 1 . . . . . . . 2.87 1 1 3 1 . . . . . . . 3.1 1 1 4 1 . . . . . . . 4.36 1 1 5 1 . . . . . . . 10.02 1 1 6 1 . . . . . . . 8.71 1 1 7 1 . . . . . . . 3.4 1 1 8 1 . . . . . . . 5.4 1 1 9 1 . . . . . . . 7.0 1 1 10 1 . . . . . . . 3.6 1 1 11 1 . . . . . . . 2.7 1 1 12 1 . . . . . . . 2.5 1 1 13 1 . . . . . . . 5.21 1 1 14 1 . . . . . . . 5.3 1 1 15 1 . . . . . . . 3.5 1 1 16 1 . . . . . . . 4.0 1 1 17 1 . . . . . . . 8.0 1 1 18 1 . . . . . . . 6.5 1 1 19 1 . . . . . . . 4.1 1 1 20 1 . . . . . . . 4.1 1 1 21 1 . . . . . . . 7.2 1 1 22 1 . . . . . . . 4.0 1 1 23 1 . . . . . . . 8.0 1 1 24 1 . . . . . . . 8.0 1 1 25 1 . . . . . . . 8.0 1 1 26 1 . . . . . . . 2.9 1 1 27 1 . . . . . . . 5.1 1 1 28 1 . . . . . . . 4.0 1 1 29 1 . . . . . . . 5.0 1 1 30 1 . . . . . . . 4.1 1 1 31 1 . . . . . . . 7.0 1 1 32 1 . . . . . . . 5.2 1 1 33 1 . . . . . . . 6.4 1 1 34 1 . . . . . . . 5.2 1 1 35 1 . . . . . . . 4.4 1 1 36 1 . . . . . . . 4.1 1 1 37 1 . . . . . . . 5.7 1 1 38 1 . . . . . . . 6.48 1 1 39 1 . . . . . . . 5.58 1 1 40 1 . . . . . . . 6.98 1 1 41 1 . . . . . . . 4.18 1 1 42 1 . . . . . . . 3.4 1 1 43 1 . . . . . . . 3.2 1 1 44 1 . . . . . . . 4.0 1 1 45 1 . . . . . . . 6.1 1 1 46 1 . . . . . . . 5.6 1 1 47 1 . . . . . . . 3.5 1 1 48 1 . . . . . . . 5.0 1 1 49 1 . . . . . . . 6.58 1 1 50 1 . . . . . . . 4.2 1 1 51 1 . . . . . . . 4.2 1 1 52 1 . . . . . . . 3.9 1 1 53 1 . . . . . . . 3.6 1 1 54 1 . . . . . . . 3.2 1 1 55 1 . . . . . . . 4.7 1 1 56 1 . . . . . . . 6.3 1 1 57 1 . . . . . . . 3.6 1 1 58 1 . . . . . . . 5.2 1 1 59 1 . . . . . . . 5.5 1 1 60 1 . . . . . . . 4.6 1 1 61 1 . . . . . . . 4.6 1 1 62 1 . . . . . . . 4.8 1 1 63 1 . . . . . . . 4.4 1 1 64 1 . . . . . . . 3.4 1 1 65 1 . . . . . . . 2.2 1 1 66 1 . . . . . . . 5.2 1 1 67 1 . . . . . . . 5.2 1 1 68 1 . . . . . . . 7.0 1 1 69 1 . . . . . . . 6.8 1 1 70 1 . . . . . . . 6.8 1 1 71 1 . . . . . . . 4.6 1 1 72 1 . . . . . . . 4.6 1 1 73 1 . . . . . . . 7.0 1 1 74 1 . . . . . . . 6.0 1 1 75 1 . . . . . . . 5.4 1 1 76 1 . . . . . . . 8.4 1 1 77 1 . . . . . . . 6.2 1 1 78 1 . . . . . . . 6.2 1 1 79 1 . . . . . . . 7.14 1 1 80 1 . . . . . . . 7.1 1 1 81 1 . . . . . . . 4.5 1 1 82 1 . . . . . . . 5.6 1 1 83 1 . . . . . . . 8.8 1 1 84 1 . . . . . . . 8.0 1 1 85 1 . . . . . . . 6.3 1 1 86 1 . . . . . . . 6.5 1 1 87 1 . . . . . . . 8.0 1 1 88 1 . . . . . . . 6.5 1 1 89 1 . . . . . . . 8.84 1 1 90 1 . . . . . . . 7.0 1 1 91 1 . . . . . . . 6.4 1 1 92 1 . . . . . . . 4.4 1 1 93 1 . . . . . . . 3.6 1 1 94 1 . . . . . . . 4.2 1 1 95 1 . . . . . . . 5.4 1 1 96 1 . . . . . . . 5.1 1 1 97 1 . . . . . . . 6.8 1 1 98 1 . . . . . . . 6.9 1 1 99 1 . . . . . . . 7.0 1 1 100 1 . . . . . . . 2.4 1 1 101 1 . . . . . . . 5.8 1 1 102 1 . . . . . . . 5.0 1 1 103 1 . . . . . . . 7.6 1 1 104 1 . . . . . . . 6.0 1 1 105 1 . . . . . . . 7.8 1 1 106 1 . . . . . . . 7.5 1 1 107 1 . . . . . . . 6.1 1 1 108 1 . . . . . . . 5.48 1 1 109 1 . . . . . . . 5.7 1 1 110 1 . . . . . . . 5.7 1 1 111 1 . . . . . . . 4.4 1 1 112 1 . . . . . . . 4.6 1 1 113 1 . . . . . . . 6.4 1 1 114 1 . . . . . . . 6.0 1 1 115 1 . . . . . . . 3.9 1 1 116 1 . . . . . . . 4.7 1 1 117 1 . . . . . . . 5.5 1 1 118 1 . . . . . . . 5.0 1 1 119 1 . . . . . . . 3.9 1 1 120 1 . . . . . . . 6.4 1 1 121 1 . . . . . . . 4.6 1 1 122 1 . . . . . . . 5.3 1 1 123 1 . . . . . . . 7.7 1 1 124 1 . . . . . . . 7.0 1 1 125 1 . . . . . . . 7.7 1 1 126 1 . . . . . . . 5.5 1 1 127 1 . . . . . . . 5.0 1 1 128 1 . . . . . . . 3.8 1 1 129 1 . . . . . . . 2.8 1 1 130 1 . . . . . . . 5.7 1 1 131 1 . . . . . . . 4.7 1 1 132 1 . . . . . . . 5.4 1 1 133 1 . . . . . . . 7.5 1 1 134 1 . . . . . . . 8.0 1 1 135 1 . . . . . . . 5.2 1 1 136 1 . . . . . . . 7.4 1 1 137 1 . . . . . . . 10.13 1 1 138 1 . . . . . . . 7.6 1 1 139 1 . . . . . . . 8.0 1 1 140 1 . . . . . . . 7.6 1 1 141 1 . . . . . . . 7.2 1 1 142 1 . . . . . . . 8.0 1 1 143 1 . . . . . . . 7.6 1 1 144 1 . . . . . . . 4.2 1 1 145 1 . . . . . . . 6.4 1 1 146 1 . . . . . . . 7.4 1 1 147 1 . . . . . . . 6.2 1 1 148 1 . . . . . . . 6.2 1 1 149 1 . . . . . . . 6.5 1 1 150 1 . . . . . . . 8.3 1 1 151 1 . . . . . . . 3.7 1 1 152 1 . . . . . . . 3.6 1 1 153 1 . . . . . . . 3.5 1 1 154 1 . . . . . . . 5.3 1 1 155 1 . . . . . . . 3.5 1 1 156 1 . . . . . . . 2.8 1 1 157 1 . . . . . . . 2.6 1 1 158 1 . . . . . . . 3.0 1 1 159 1 . . . . . . . 5.1 1 1 160 1 . . . . . . . 5.9 1 1 161 1 . . . . . . . 4.5 1 1 162 1 . . . . . . . 5.7 1 1 163 1 . . . . . . . 6.2 1 1 164 1 . . . . . . . 4.4 1 1 165 1 . . . . . . . 4.6 1 1 166 1 . . . . . . . 5.6 1 1 167 1 . . . . . . . 3.1 1 1 168 1 . . . . . . . 2.7 1 1 169 1 . . . . . . . 5.4 1 1 170 1 . . . . . . . 4.3 1 1 171 1 . . . . . . . 4.8 1 1 172 1 . . . . . . . 7.0 1 1 173 1 . . . . . . . 7.8 1 1 174 1 . . . . . . . 7.7 1 1 175 1 . . . . . . . 3.5 1 1 176 1 . . . . . . . 5.4 1 1 177 1 . . . . . . . 3.9 1 1 178 1 . . . . . . . 5.6 1 1 179 1 . . . . . . . 7.1 1 1 180 1 . . . . . . . 4.3 1 1 181 1 . . . . . . . 7.4 1 1 182 1 . . . . . . . 6.94 1 1 183 1 . . . . . . . 3.0 1 1 184 1 . . . . . . . 3.7 1 1 185 1 . . . . . . . 6.4 1 1 186 1 . . . . . . . 5.1 1 1 187 1 . . . . . . . 6.6 1 1 188 1 . . . . . . . 6.6 1 1 189 1 . . . . . . . 8.0 1 1 190 1 . . . . . . . 6.8 1 1 191 1 . . . . . . . 7.4 1 1 192 1 . . . . . . . 3.2 1 1 193 1 . . . . . . . 2.9 1 1 194 1 . . . . . . . 5.8 1 1 195 1 . . . . . . . 5.1 1 1 196 1 . . . . . . . 8.0 1 1 197 1 . . . . . . . 6.6 1 1 198 1 . . . . . . . 4.1 1 1 199 1 . . . . . . . 7.0 1 1 200 1 . . . . . . . 5.9 1 1 201 1 . . . . . . . 3.1 1 1 202 1 . . . . . . . 5.2 1 1 203 1 . . . . . . . 6.0 1 1 204 1 . . . . . . . 6.3 1 1 205 1 . . . . . . . 7.6 1 1 206 1 . . . . . . . 4.3 1 1 207 1 . . . . . . . 5.7 1 1 208 1 . . . . . . . 7.0 1 1 209 1 . . . . . . . 6.5 1 1 210 1 . . . . . . . 7.2 1 1 211 1 . . . . . . . 3.3 1 1 212 1 . . . . . . . 4.7 1 1 213 1 . . . . . . . 5.7 1 1 214 1 . . . . . . . 9.0 1 1 215 1 . . . . . . . 3.1 1 1 216 1 . . . . . . . 6.0 1 1 217 1 . . . . . . . 4.8 1 1 218 1 . . . . . . . 3.7 1 1 219 1 . . . . . . . 8.0 1 1 220 1 . . . . . . . 2.9 1 1 221 1 . . . . . . . 3.8 1 1 222 1 . . . . . . . 4.5 1 1 223 1 . . . . . . . 5.6 1 1 224 1 . . . . . . . 5.6 1 1 225 1 . . . . . . . 7.7 1 1 226 1 . . . . . . . 3.9 1 1 227 1 . . . . . . . 4.4 1 1 228 1 . . . . . . . 4.0 1 1 229 1 . . . . . . . 5.4 1 1 230 1 . . . . . . . 4.8 1 1 231 1 . . . . . . . 7.1 1 1 232 1 . . . . . . . 3.0 1 1 233 1 . . . . . . . 2.8 1 1 234 1 . . . . . . . 3.4 1 1 235 1 . . . . . . . 4.6 1 1 236 1 . . . . . . . 3.1 1 1 237 1 . . . . . . . 3.9 1 1 238 1 . . . . . . . 4.0 1 1 239 1 . . . . . . . 5.9 1 1 240 1 . . . . . . . 5.4 1 1 241 1 . . . . . . . 7.0 1 1 242 1 . . . . . . . 3.4 1 1 243 1 . . . . . . . 3.2 1 1 244 1 . . . . . . . 5.0 1 1 245 1 . . . . . . . 5.7 1 1 246 1 . . . . . . . 5.3 1 1 247 1 . . . . . . . 7.9 1 1 248 1 . . . . . . . 5.0 1 1 249 1 . . . . . . . 4.6 1 1 250 1 . . . . . . . 8.0 1 1 251 1 . . . . . . . 6.0 1 1 252 1 . . . . . . . 3.4 1 1 253 1 . . . . . . . 7.4 1 1 254 1 . . . . . . . 9.0 1 1 255 1 . . . . . . . 3.1 1 1 256 1 . . . . . . . 3.9 1 1 257 1 . . . . . . . 5.1 1 1 258 1 . . . . . . . 8.0 1 1 259 1 . . . . . . . 3.5 1 1 260 1 . . . . . . . 3.1 1 1 261 1 . . . . . . . 2.5 1 1 262 1 . . . . . . . 4.9 1 1 263 1 . . . . . . . 5.3 1 1 264 1 . . . . . . . 4.1 1 1 265 1 . . . . . . . 3.7 1 1 266 1 . . . . . . . 5.1 1 1 267 1 . . . . . . . 8.64 1 1 268 1 . . . . . . . 7.1 1 1 269 1 . . . . . . . 4.0 1 1 270 1 . . . . . . . 7.1 1 1 271 1 . . . . . . . 6.1 1 1 272 1 . . . . . . . 4.6 1 1 273 1 . . . . . . . 9.0 1 1 274 1 . . . . . . . 8.0 1 1 275 1 . . . . . . . 7.9 1 1 276 1 . . . . . . . 4.9 1 1 277 1 . . . . . . . 4.9 1 1 278 1 . . . . . . . 3.9 1 1 279 1 . . . . . . . 6.8 1 1 280 1 . . . . . . . 5.3 1 1 281 1 . . . . . . . 3.8 1 1 282 1 . . . . . . . 6.3 1 1 283 1 . . . . . . . 3.1 1 1 284 1 . . . . . . . 8.0 1 1 285 1 . . . . . . . 2.5 1 1 286 1 . . . . . . . 4.6 1 1 287 1 . . . . . . . 3.7 1 1 288 1 . . . . . . . 4.9 1 1 289 1 . . . . . . . 3.9 1 1 290 1 . . . . . . . 7.4 1 1 291 1 . . . . . . . 5.6 1 1 292 1 . . . . . . . 4.6 1 1 293 1 . . . . . . . 4.9 1 1 294 1 . . . . . . . 8.0 1 1 295 1 . . . . . . . 3.8 1 1 296 1 . . . . . . . 3.8 1 1 297 1 . . . . . . . 6.9 1 1 298 1 . . . . . . . 2.9 1 1 299 1 . . . . . . . 2.9 1 1 300 1 . . . . . . . 5.7 1 1 301 1 . . . . . . . 6.54 1 1 302 1 . . . . . . . 7.83 1 1 303 1 . . . . . . . 6.11 1 1 304 1 . . . . . . . 7.0 1 1 305 1 . . . . . . . 7.0 1 1 306 1 . . . . . . . 4.9 1 1 307 1 . . . . . . . 3.5 1 1 308 1 . . . . . . . 4.5 1 1 309 1 . . . . . . . 4.4 1 1 310 1 . . . . . . . 5.2 1 1 311 1 . . . . . . . 5.9 1 1 312 1 . . . . . . . 5.9 1 1 313 1 . . . . . . . 4.0 1 1 314 1 . . . . . . . 4.5 1 1 315 1 . . . . . . . 5.4 1 1 316 1 . . . . . . . 5.5 1 1 317 1 . . . . . . . 5.7 1 1 318 1 . . . . . . . 8.0 1 1 319 1 . . . . . . . 4.1 1 1 320 1 . . . . . . . 3.8 1 1 321 1 . . . . . . . 4.4 1 1 322 1 . . . . . . . 7.0 1 1 323 1 . . . . . . . 4.5 1 1 324 1 . . . . . . . 4.5 1 1 325 1 . . . . . . . 5.0 1 1 326 1 . . . . . . . 3.9 1 1 327 1 . . . . . . . 4.0 1 1 328 1 . . . . . . . 5.8 1 1 329 1 . . . . . . . 6.0 1 1 330 1 . . . . . . . 3.4 1 1 331 1 . . . . . . . 6.1 1 1 332 1 . . . . . . . 6.1 1 1 333 1 . . . . . . . 5.2 1 1 334 1 . . . . . . . 6.8 1 1 335 1 . . . . . . . 4.6 1 1 336 1 . . . . . . . 7.0 1 1 337 1 . . . . . . . 4.6 1 1 338 1 . . . . . . . 3.4 1 1 339 1 . . . . . . . 5.78 1 1 340 1 . . . . . . . 2.8 1 1 341 1 . . . . . . . 4.6 1 1 342 1 . . . . . . . 4.1 1 1 343 1 . . . . . . . 3.5 1 1 344 1 . . . . . . . 5.6 1 1 345 1 . . . . . . . 4.8 1 1 346 1 . . . . . . . 3.5 1 1 347 1 . . . . . . . 4.9 1 1 348 1 . . . . . . . 3.2 1 1 349 1 . . . . . . . 3.5 1 1 350 1 . . . . . . . 7.0 1 1 351 1 . . . . . . . 5.1 1 1 352 1 . . . . . . . 5.0 1 1 353 1 . . . . . . . 4.8 1 1 354 1 . . . . . . . 6.8 1 1 355 1 . . . . . . . 4.3 1 1 356 1 . . . . . . . 7.1 1 1 357 1 . . . . . . . 3.0 1 1 358 1 . . . . . . . 3.5 1 1 359 1 . . . . . . . 3.1 1 1 360 1 . . . . . . . 5.0 1 1 361 1 . . . . . . . 2.9 1 1 362 1 . . . . . . . 4.8 1 1 363 1 . . . . . . . 6.7 1 1 364 1 . . . . . . . 6.44 1 1 365 1 . . . . . . . 6.7 1 1 366 1 . . . . . . . 5.4 1 1 367 1 . . . . . . . 5.4 1 1 368 1 . . . . . . . 3.0 1 1 369 1 . . . . . . . 2.7 1 1 370 1 . . . . . . . 5.0 1 1 371 1 . . . . . . . 3.3 1 1 372 1 . . . . . . . 3.7 1 1 373 1 . . . . . . . 3.3 1 1 374 1 . . . . . . . 5.3 1 1 375 1 . . . . . . . 7.0 1 1 376 1 . . . . . . . 7.0 1 1 377 1 . . . . . . . 4.1 1 1 378 1 . . . . . . . 3.8 1 1 379 1 . . . . . . . 3.5 1 1 380 1 . . . . . . . 5.7 1 1 381 1 . . . . . . . 4.7 1 1 382 1 . . . . . . . 4.5 1 1 383 1 . . . . . . . 5.4 1 1 384 1 . . . . . . . 6.6 1 1 385 1 . . . . . . . 6.6 1 1 386 1 . . . . . . . 4.8 1 1 387 1 . . . . . . . 3.7 1 1 388 1 . . . . . . . 2.8 1 1 389 1 . . . . . . . 3.59 1 1 390 1 . . . . . . . 4.3 1 1 391 1 . . . . . . . 3.8 1 1 392 1 . . . . . . . 3.0 1 1 393 1 . . . . . . . 6.5 1 1 394 1 . . . . . . . 2.69 1 1 395 1 . . . . . . . 3.1 1 1 396 1 . . . . . . . 2.8 1 1 397 1 . . . . . . . 2.8 1 1 398 1 . . . . . . . 2.6 1 1 399 1 . . . . . . . 3.1 1 1 400 1 . . . . . . . 4.7 1 1 401 1 . . . . . . . 3.4 1 1 402 1 . . . . . . . 3.1 1 1 403 1 . . . . . . . 2.2 1 1 404 1 . . . . . . . 4.1 1 1 405 1 . . . . . . . 6.9 1 1 406 1 . . . . . . . 3.5 1 1 407 1 . . . . . . . 6.4 1 1 408 1 . . . . . . . 8.0 1 1 409 1 . . . . . . . 4.8 1 1 410 1 . . . . . . . 3.0 1 1 411 1 . . . . . . . 3.2 1 1 412 1 . . . . . . . 4.4 1 1 413 1 . . . . . . . 5.0 1 1 414 1 . . . . . . . 5.0 1 1 415 1 . . . . . . . 4.8 1 1 416 1 . . . . . . . 3.0 1 1 417 1 . . . . . . . 2.9 1 1 418 1 . . . . . . . 2.5 1 1 419 1 . . . . . . . 4.8 1 1 420 1 . . . . . . . 4.8 1 1 421 1 . . . . . . . 4.6 1 1 422 1 . . . . . . . 3.9 1 1 423 1 . . . . . . . 7.0 1 1 424 1 . . . . . . . 4.9 1 1 425 1 . . . . . . . 8.0 1 1 426 1 . . . . . . . 8.0 1 1 427 1 . . . . . . . 5.3 1 1 428 1 . . . . . . . 7.0 1 1 429 1 . . . . . . . 7.0 1 1 430 1 . . . . . . . 6.0 1 1 431 1 . . . . . . . 5.8 1 1 432 1 . . . . . . . 6.0 1 1 433 1 . . . . . . . 3.8 1 1 434 1 . . . . . . . 5.0 1 1 435 1 . . . . . . . 2.9 1 1 436 1 . . . . . . . 2.7 1 1 437 1 . . . . . . . 3.4 1 1 438 1 . . . . . . . 5.1 1 1 439 1 . . . . . . . 5.0 1 1 440 1 . . . . . . . 5.6 1 1 441 1 . . . . . . . 3.0 1 1 442 1 . . . . . . . 2.6 1 1 443 1 . . . . . . . 2.6 1 1 444 1 . . . . . . . 6.2 1 1 445 1 . . . . . . . 3.9 1 1 446 1 . . . . . . . 7.0 1 1 447 1 . . . . . . . 2.5 1 1 448 1 . . . . . . . 5.4 1 1 449 1 . . . . . . . 4.0 1 1 450 1 . . . . . . . 6.4 1 1 451 1 . . . . . . . 3.5 1 1 452 1 . . . . . . . 3.2 1 1 453 1 . . . . . . . 3.5 1 1 454 1 . . . . . . . 4.8 1 1 455 1 . . . . . . . 4.5 1 1 456 1 . . . . . . . 7.0 1 1 457 1 . . . . . . . 7.0 1 1 458 1 . . . . . . . 5.7 1 1 459 1 . . . . . . . 3.1 1 1 460 1 . . . . . . . 5.4 1 1 461 1 . . . . . . . 4.1 1 1 462 1 . . . . . . . 3.1 1 1 463 1 . . . . . . . 3.8 1 1 464 1 . . . . . . . 5.1 1 1 465 1 . . . . . . . 3.3 1 1 466 1 . . . . . . . 4.8 1 1 467 1 . . . . . . . 3.4 1 1 468 1 . . . . . . . 6.2 1 1 469 1 . . . . . . . 5.5 1 1 470 1 . . . . . . . 5.1 1 1 471 1 . . . . . . . 6.3 1 1 472 1 . . . . . . . 4.5 1 1 473 1 . . . . . . . 6.93 1 1 474 1 . . . . . . . 7.0 1 1 475 1 . . . . . . . 3.7 1 1 476 1 . . . . . . . 5.8 1 1 477 1 . . . . . . . 3.5 1 1 478 1 . . . . . . . 6.53 1 1 479 1 . . . . . . . 4.9 1 1 480 1 . . . . . . . 4.8 1 1 481 1 . . . . . . . 6.9 1 1 482 1 . . . . . . . 4.9 1 1 483 1 . . . . . . . 6.8 1 1 484 1 . . . . . . . 4.0 1 1 485 1 . . . . . . . 3.2 1 1 486 1 . . . . . . . 3.4 1 1 487 1 . . . . . . . 3.0 1 1 488 1 . . . . . . . 5.3 1 1 489 1 . . . . . . . 2.6 1 1 490 1 . . . . . . . 6.9 1 1 491 1 . . . . . . . 3.6 1 1 492 1 . . . . . . . 5.1 1 1 493 1 . . . . . . . 3.1 1 1 494 1 . . . . . . . 3.2 1 1 495 1 . . . . . . . 7.6 1 1 496 1 . . . . . . . 6.44 1 1 497 1 . . . . . . . 6.73 1 1 498 1 . . . . . . . 5.1 1 1 499 1 . . . . . . . 3.7 1 1 500 1 . . . . . . . 3.7 1 1 501 1 . . . . . . . 4.0 1 1 502 1 . . . . . . . 4.6 1 1 503 1 . . . . . . . 6.44 1 1 504 1 . . . . . . . 7.03 1 1 505 1 . . . . . . . 6.6 1 1 506 1 . . . . . . . 5.4 1 1 507 1 . . . . . . . 5.8 1 1 508 1 . . . . . . . 4.4 1 1 509 1 . . . . . . . 5.6 1 1 510 1 . . . . . . . 3.6 1 1 511 1 . . . . . . . 7.74 1 1 512 1 . . . . . . . 6.33 1 1 513 1 . . . . . . . 4.8 1 1 514 1 . . . . . . . 6.8 1 1 515 1 . . . . . . . 8.0 1 1 516 1 . . . . . . . 8.0 1 1 517 1 . . . . . . . 5.9 1 1 518 1 . . . . . . . 5.4 1 1 519 1 . . . . . . . 6.54 1 1 520 1 . . . . . . . 8.63 1 1 521 1 . . . . . . . 7.0 1 1 522 1 . . . . . . . 6.5 1 1 523 1 . . . . . . . 4.8 1 1 524 1 . . . . . . . 3.0 1 1 525 1 . . . . . . . 6.2 1 1 526 1 . . . . . . . 2.7 1 1 527 1 . . . . . . . 6.1 1 1 528 1 . . . . . . . 7.38 1 1 529 1 . . . . . . . 5.58 1 1 530 1 . . . . . . . 7.88 1 1 531 1 . . . . . . . 5.4 1 1 532 1 . . . . . . . 8.0 1 1 533 1 . . . . . . . 4.3 1 1 534 1 . . . . . . . 6.2 1 1 535 1 . . . . . . . 6.9 1 1 536 1 . . . . . . . 4.4 1 1 537 1 . . . . . . . 8.0 1 1 538 1 . . . . . . . 6.8 1 1 539 1 . . . . . . . 3.2 1 1 540 1 . . . . . . . 3.2 1 1 541 1 . . . . . . . 7.0 1 1 542 1 . . . . . . . 7.1 1 1 543 1 . . . . . . . 4.0 1 1 544 1 . . . . . . . 8.0 1 1 545 1 . . . . . . . 7.5 1 1 546 1 . . . . . . . 9.0 1 1 547 1 . . . . . . . 7.5 1 1 548 1 . . . . . . . 8.0 1 1 549 1 . . . . . . . 8.0 1 1 550 1 . . . . . . . 2.9 1 1 551 1 . . . . . . . 2.6 1 1 552 1 . . . . . . . 7.73 1 1 553 1 . . . . . . . 7.7 1 1 554 1 . . . . . . . 8.0 1 1 555 1 . . . . . . . 3.1 1 1 556 1 . . . . . . . 7.04 1 1 557 1 . . . . . . . 9.13 1 1 558 1 . . . . . . . 5.0 1 1 559 1 . . . . . . . 5.0 1 1 560 1 . . . . . . . 2.8 1 1 561 1 . . . . . . . 4.7 1 1 562 1 . . . . . . . 6.0 1 1 563 1 . . . . . . . 3.8 1 1 564 1 . . . . . . . 2.8 1 1 565 1 . . . . . . . 6.0 1 1 566 1 . . . . . . . 6.51 1 1 567 1 . . . . . . . 4.1 1 1 568 1 . . . . . . . 7.0 1 1 569 1 . . . . . . . 4.1 1 1 570 1 . . . . . . . 7.0 1 1 571 1 . . . . . . . 7.4 1 1 572 1 . . . . . . . 4.4 1 1 573 1 . . . . . . . 5.7 1 1 574 1 . . . . . . . 6.2 1 1 575 1 . . . . . . . 7.0 1 1 576 1 . . . . . . . 3.6 1 1 577 1 . . . . . . . 3.8 1 1 578 1 . . . . . . . 5.0 1 1 579 1 . . . . . . . 3.8 1 1 580 1 . . . . . . . 5.1 1 1 581 1 . . . . . . . 6.6 1 1 582 1 . . . . . . . 5.5 1 1 583 1 . . . . . . . 5.0 1 1 584 1 . . . . . . . 6.0 1 1 585 1 . . . . . . . 5.7 1 1 586 1 . . . . . . . 5.4 1 1 587 1 . . . . . . . 4.7 1 1 588 1 . . . . . . . 5.5 1 1 589 1 . . . . . . . 4.4 1 1 590 1 . . . . . . . 7.0 1 1 591 1 . . . . . . . 6.9 1 1 592 1 . . . . . . . 5.8 1 1 593 1 . . . . . . . 3.7 1 1 594 1 . . . . . . . 7.5 1 1 595 1 . . . . . . . 6.3 1 1 596 1 . . . . . . . 4.7 1 1 597 1 . . . . . . . 7.7 1 1 598 1 . . . . . . . 5.3 1 1 599 1 . . . . . . . 2.8 1 1 600 1 . . . . . . . 3.5 1 1 601 1 . . . . . . . 6.7 1 1 602 1 . . . . . . . 7.0 1 1 603 1 . . . . . . . 5.6 1 1 604 1 . . . . . . . 8.0 1 1 605 1 . . . . . . . 3.8 1 1 606 1 . . . . . . . 5.0 1 1 607 1 . . . . . . . 5.8 1 1 608 1 . . . . . . . 4.3 1 1 609 1 . . . . . . . 6.1 1 1 610 1 . . . . . . . 4.2 1 1 611 1 . . . . . . . 5.3 1 1 612 1 . . . . . . . 3.2 1 1 613 1 . . . . . . . 2.8 1 1 614 1 . . . . . . . 3.4 1 1 615 1 . . . . . . . 3.8 1 1 616 1 . . . . . . . 8.0 1 1 617 1 . . . . . . . 5.3 1 1 618 1 . . . . . . . 3.2 1 1 619 1 . . . . . . . 5.7 1 1 620 1 . . . . . . . 2.4 1 1 621 1 . . . . . . . 5.68 1 1 622 1 . . . . . . . 3.5 1 1 623 1 . . . . . . . 3.1 1 1 624 1 . . . . . . . 3.2 1 1 625 1 . . . . . . . 6.2 1 1 626 1 . . . . . . . 3.1 1 1 627 1 . . . . . . . 6.1 1 1 628 1 . . . . . . . 5.5 1 1 629 1 . . . . . . . 4.3 1 1 630 1 . . . . . . . 4.3 1 1 631 1 . . . . . . . 3.2 1 1 632 1 . . . . . . . 3.6 1 1 633 1 . . . . . . . 3.9 1 1 634 1 . . . . . . . 7.0 1 1 635 1 . . . . . . . 5.2 1 1 636 1 . . . . . . . 2.7 1 1 637 1 . . . . . . . 7.0 1 1 638 1 . . . . . . . 2.7 1 1 639 1 . . . . . . . 4.2 1 1 640 1 . . . . . . . 4.1 1 1 641 1 . . . . . . . 5.5 1 1 642 1 . . . . . . . 4.1 1 1 643 1 . . . . . . . 4.7 1 1 644 1 . . . . . . . 7.0 1 1 645 1 . . . . . . . 8.0 1 1 646 1 . . . . . . . 3.2 1 1 647 1 . . . . . . . 2.7 1 1 648 1 . . . . . . . 3.2 1 1 649 1 . . . . . . . 7.0 1 1 650 1 . . . . . . . 7.0 1 1 651 1 . . . . . . . 3.5 1 1 652 1 . . . . . . . 4.6 1 1 653 1 . . . . . . . 3.5 1 1 654 1 . . . . . . . 7.2 1 1 655 1 . . . . . . . 4.3 1 1 656 1 . . . . . . . 5.1 1 1 657 1 . . . . . . . 7.0 1 1 658 1 . . . . . . . 8.0 1 1 659 1 . . . . . . . 5.0 1 1 660 1 . . . . . . . 3.1 1 1 661 1 . . . . . . . 7.2 1 1 662 1 . . . . . . . 5.0 1 1 663 1 . . . . . . . 7.0 1 1 664 1 . . . . . . . 7.0 1 1 665 1 . . . . . . . 4.2 1 1 666 1 . . . . . . . 4.4 1 1 667 1 . . . . . . . 5.3 1 1 668 1 . . . . . . . 7.4 1 1 669 1 . . . . . . . 5.1 1 1 670 1 . . . . . . . 6.8 1 1 671 1 . . . . . . . 5.6 1 1 672 1 . . . . . . . 7.0 1 1 673 1 . . . . . . . 5.5 1 1 674 1 . . . . . . . 3.6 1 1 675 1 . . . . . . . 4.4 1 1 676 1 . . . . . . . 3.6 1 1 677 1 . . . . . . . 4.2 1 1 678 1 . . . . . . . 7.08 1 1 679 1 . . . . . . . 5.6 1 1 680 1 . . . . . . . 2.7 1 1 681 1 . . . . . . . 2.9 1 1 682 1 . . . . . . . 6.98 1 1 683 1 . . . . . . . 3.8 1 1 684 1 . . . . . . . 6.44 1 1 685 1 . . . . . . . 6.2 1 1 686 1 . . . . . . . 6.1 1 1 687 1 . . . . . . . 2.9 1 1 688 1 . . . . . . . 4.6 1 1 689 1 . . . . . . . 4.0 1 1 690 1 . . . . . . . 3.0 1 1 691 1 . . . . . . . 5.0 1 1 692 1 . . . . . . . 7.24 1 1 693 1 . . . . . . . 2.3 1 1 694 1 . . . . . . . 3.0 1 1 695 1 . . . . . . . 4.0 1 1 696 1 . . . . . . . 4.3 1 1 697 1 . . . . . . . 5.0 1 1 698 1 . . . . . . . 6.34 1 1 699 1 . . . . . . . 7.73 1 1 700 1 . . . . . . . 7.0 1 1 701 1 . . . . . . . 6.9 1 1 702 1 . . . . . . . 5.6 1 1 703 1 . . . . . . . 3.0 1 1 704 1 . . . . . . . 4.8 1 1 705 1 . . . . . . . 3.8 1 1 706 1 . . . . . . . 3.0 1 1 707 1 . . . . . . . 6.24 1 1 708 1 . . . . . . . 5.2 1 1 709 1 . . . . . . . 7.88 1 1 710 1 . . . . . . . 7.12 1 1 711 1 . . . . . . . 7.44 1 1 712 1 . . . . . . . 7.34 1 1 713 1 . . . . . . . 6.6 1 1 714 1 . . . . . . . 4.6 1 1 715 1 . . . . . . . 5.1 1 1 716 1 . . . . . . . 3.7 1 1 717 1 . . . . . . . 5.1 1 1 718 1 . . . . . . . 5.75 1 1 719 1 . . . . . . . 6.2 1 1 720 1 . . . . . . . 6.2 1 1 721 1 . . . . . . . 7.2 1 1 722 1 . . . . . . . 6.0 1 1 723 1 . . . . . . . 6.4 1 1 724 1 . . . . . . . 4.1 1 1 725 1 . . . . . . . 4.3 1 1 726 1 . . . . . . . 5.9 1 1 727 1 . . . . . . . 5.3 1 1 728 1 . . . . . . . 5.7 1 1 729 1 . . . . . . . 7.4 1 1 730 1 . . . . . . . 3.5 1 1 731 1 . . . . . . . 3.5 1 1 732 1 . . . . . . . 3.6 1 1 733 1 . . . . . . . 7.0 1 1 734 1 . . . . . . . 8.0 1 1 735 1 . . . . . . . 3.66 1 1 736 1 . . . . . . . 5.8 1 1 737 1 . . . . . . . 4.98 1 1 738 1 . . . . . . . 5.8 1 1 739 1 . . . . . . . 5.1 1 1 740 1 . . . . . . . 5.9 1 1 741 1 . . . . . . . 3.3 1 1 742 1 . . . . . . . 5.4 1 1 743 1 . . . . . . . 5.5 1 1 744 1 . . . . . . . 3.2 1 1 745 1 . . . . . . . 3.6 1 1 746 1 . . . . . . . 4.3 1 1 747 1 . . . . . . . 6.6 1 1 748 1 . . . . . . . 2.8 1 1 749 1 . . . . . . . 5.6 1 1 750 1 . . . . . . . 3.5 1 1 751 1 . . . . . . . 6.5 1 1 752 1 . . . . . . . 4.3 1 1 753 1 . . . . . . . 8.0 1 1 754 1 . . . . . . . 11.27 1 1 755 1 . . . . . . . 3.4 1 1 756 1 . . . . . . . 3.8 1 1 757 1 . . . . . . . 8.0 1 1 758 1 . . . . . . . 7.0 1 1 759 1 . . . . . . . 5.3 1 1 760 1 . . . . . . . 4.3 1 1 761 1 . . . . . . . 4.8 1 1 762 1 . . . . . . . 4.7 1 1 763 1 . . . . . . . 5.5 1 1 764 1 . . . . . . . 7.04 1 1 765 1 . . . . . . . 7.34 1 1 766 1 . . . . . . . 7.43 1 1 767 1 . . . . . . . 8.73 1 1 768 1 . . . . . . . 3.5 1 1 769 1 . . . . . . . 5.2 1 1 770 1 . . . . . . . 3.8 1 1 771 1 . . . . . . . 6.3 1 1 772 1 . . . . . . . 5.8 1 1 773 1 . . . . . . . 7.0 1 1 774 1 . . . . . . . 6.8 1 1 775 1 . . . . . . . 4.5 1 1 776 1 . . . . . . . 5.2 1 1 777 1 . . . . . . . 5.3 1 1 778 1 . . . . . . . 6.1 1 1 779 1 . . . . . . . 5.1 1 1 780 1 . . . . . . . 6.7 1 1 781 1 . . . . . . . 5.5 1 1 782 1 . . . . . . . 5.1 1 1 783 1 . . . . . . . 6.1 1 1 784 1 . . . . . . . 3.4 1 1 785 1 . . . . . . . 4.9 1 1 786 1 . . . . . . . 6.3 1 1 787 1 . . . . . . . 5.5 1 1 788 1 . . . . . . . 7.0 1 1 789 1 . . . . . . . 8.0 1 1 790 1 . . . . . . . 6.6 1 1 791 1 . . . . . . . 5.5 1 1 792 1 . . . . . . . 6.9 1 1 793 1 . . . . . . . 6.65 1 1 794 1 . . . . . . . 6.9 1 1 795 1 . . . . . . . 5.9 1 1 796 1 . . . . . . . 7.0 1 1 797 1 . . . . . . . 4.0 1 1 798 1 . . . . . . . 3.1 1 1 799 1 . . . . . . . 6.9 1 1 800 1 . . . . . . . 5.3 1 1 801 1 . . . . . . . 5.9 1 1 802 1 . . . . . . . 8.0 1 1 803 1 . . . . . . . 2.8 1 1 804 1 . . . . . . . 3.3 1 1 805 1 . . . . . . . 3.7 1 1 806 1 . . . . . . . 5.6 1 1 807 1 . . . . . . . 4.8 1 1 808 1 . . . . . . . 4.8 1 1 809 1 . . . . . . . 5.7 1 1 810 1 . . . . . . . 3.9 1 1 811 1 . . . . . . . 6.1 1 1 812 1 . . . . . . . 5.4 1 1 813 1 . . . . . . . 6.2 1 1 814 1 . . . . . . . 8.0 1 1 815 1 . . . . . . . 6.1 1 1 816 1 . . . . . . . 6.6 1 1 817 1 . . . . . . . 8.0 1 1 818 1 . . . . . . . 7.3 1 1 819 1 . . . . . . . 8.0 1 1 820 1 . . . . . . . 4.1 1 1 821 1 . . . . . . . 7.5 1 1 822 1 . . . . . . . 6.8 1 1 823 1 . . . . . . . 4.5 1 1 824 1 . . . . . . . 6.2 1 1 825 1 . . . . . . . 6.0 1 1 826 1 . . . . . . . 7.3 1 1 827 1 . . . . . . . 7.7 1 1 828 1 . . . . . . . 3.6 1 1 829 1 . . . . . . . 6.2 1 1 830 1 . . . . . . . 4.5 1 1 831 1 . . . . . . . 4.5 1 1 832 1 . . . . . . . 7.0 1 1 833 1 . . . . . . . 5.4 1 1 834 1 . . . . . . . 4.3 1 1 835 1 . . . . . . . 3.8 1 1 836 1 . . . . . . . 8.0 1 1 837 1 . . . . . . . 4.1 1 1 838 1 . . . . . . . 3.3 1 1 839 1 . . . . . . . 5.6 1 1 840 1 . . . . . . . 3.8 1 1 841 1 . . . . . . . 6.0 1 1 842 1 . . . . . . . 6.4 1 1 843 1 . . . . . . . 6.4 1 1 844 1 . . . . . . . 3.2 1 1 845 1 . . . . . . . 3.7 1 1 846 1 . . . . . . . 3.0 1 1 847 1 . . . . . . . 5.7 1 1 848 1 . . . . . . . 5.2 1 1 849 1 . . . . . . . 3.0 1 1 850 1 . . . . . . . 5.8 1 1 851 1 . . . . . . . 8.0 1 1 852 1 . . . . . . . 6.8 1 1 853 1 . . . . . . . 7.0 1 1 854 1 . . . . . . . 8.0 1 1 855 1 . . . . . . . 6.8 1 1 856 1 . . . . . . . 2.8 1 1 857 1 . . . . . . . 3.8 1 1 858 1 . . . . . . . 2.5 1 1 859 1 . . . . . . . 4.5 1 1 860 1 . . . . . . . 3.1 1 1 861 1 . . . . . . . 4.4 1 1 862 1 . . . . . . . 3.2 1 1 863 1 . . . . . . . 3.9 1 1 864 1 . . . . . . . 5.7 1 1 865 1 . . . . . . . 4.7 1 1 866 1 . . . . . . . 5.4 1 1 867 1 . . . . . . . 3.8 1 1 868 1 . . . . . . . 3.3 1 1 869 1 . . . . . . . 4.4 1 1 870 1 . . . . . . . 7.0 1 1 871 1 . . . . . . . 6.3 1 1 872 1 . . . . . . . 4.0 1 1 873 1 . . . . . . . 8.0 1 1 874 1 . . . . . . . 6.5 1 1 875 1 . . . . . . . 5.0 1 1 876 1 . . . . . . . 5.8 1 1 877 1 . . . . . . . 7.0 1 1 878 1 . . . . . . . 6.3 1 1 879 1 . . . . . . . 7.0 1 1 880 1 . . . . . . . 8.0 1 1 881 1 . . . . . . . 5.68 1 1 882 1 . . . . . . . 5.9 1 1 883 1 . . . . . . . 8.0 1 1 884 1 . . . . . . . 8.0 1 1 885 1 . . . . . . . 8.88 1 1 886 1 . . . . . . . 5.5 1 1 887 1 . . . . . . . 4.4 1 1 888 1 . . . . . . . 3.3 1 1 889 1 . . . . . . . 3.08 1 1 890 1 . . . . . . . 3.3 1 1 891 1 . . . . . . . 5.8 1 1 892 1 . . . . . . . 6.4 1 1 893 1 . . . . . . . 5.7 1 1 894 1 . . . . . . . 4.48 1 1 895 1 . . . . . . . 6.4 1 1 896 1 . . . . . . . 6.5 1 1 897 1 . . . . . . . 6.8 1 1 898 1 . . . . . . . 6.4 1 1 899 1 . . . . . . . 8.6 1 1 900 1 . . . . . . . 7.4 1 1 901 1 . . . . . . . 6.6 1 1 902 1 . . . . . . . 6.08 1 1 903 1 . . . . . . . 4.21 1 1 904 1 . . . . . . . 5.05 1 1 905 1 . . . . . . . 5.05 1 1 906 1 . . . . . . . 5.05 1 1 907 1 . . . . . . . 5.05 1 1 908 1 . . . . . . . 3.4 1 1 909 1 . . . . . . . 3.5 1 1 910 1 . . . . . . . 6.1 1 1 911 1 . . . . . . . 4.1 1 1 912 1 . . . . . . . 6.9 1 1 913 1 . . . . . . . 5.0 1 1 914 1 . . . . . . . 6.8 1 1 915 1 . . . . . . . 4.0 1 1 916 1 . . . . . . . 4.9 1 1 917 1 . . . . . . . 6.1 1 1 918 1 . . . . . . . 5.7 1 1 919 1 . . . . . . . 3.6 1 1 920 1 . . . . . . . 4.2 1 1 921 1 . . . . . . . 9.14 1 1 922 1 . . . . . . . 2.7 1 1 923 1 . . . . . . . 3.5 1 1 924 1 . . . . . . . 3.5 1 1 925 1 . . . . . . . 9.14 1 1 926 1 . . . . . . . 8.53 1 1 927 1 . . . . . . . 4.3 1 1 928 1 . . . . . . . 7.0 1 1 929 1 . . . . . . . 3.7 1 1 930 1 . . . . . . . 6.3 1 1 931 1 . . . . . . . 10.14 1 1 932 1 . . . . . . . 8.43 1 1 933 1 . . . . . . . 6.6 1 1 934 1 . . . . . . . 8.13 1 1 935 1 . . . . . . . 5.7 1 1 936 1 . . . . . . . 7.34 1 1 937 1 . . . . . . . 5.6 1 1 938 1 . . . . . . . 6.5 1 1 939 1 . . . . . . . 8.14 1 1 940 1 . . . . . . . 7.43 1 1 941 1 . . . . . . . 5.8 1 1 942 1 . . . . . . . 6.4 1 1 943 1 . . . . . . . 2.8 1 1 944 1 . . . . . . . 5.42 1 1 945 1 . . . . . . . 7.0 1 1 946 1 . . . . . . . 3.9 1 1 947 1 . . . . . . . 3.5 1 1 948 1 . . . . . . . 3.9 1 1 949 1 . . . . . . . 4.48 1 1 950 1 . . . . . . . 5.0 1 1 951 1 . . . . . . . 3.8 1 1 952 1 . . . . . . . 3.6 1 1 953 1 . . . . . . . 3.8 1 1 954 1 . . . . . . . 2.4 1 1 955 1 . . . . . . . 5.2 1 1 956 1 . . . . . . . 4.5 1 1 957 1 . . . . . . . 3.6 1 1 958 1 . . . . . . . 7.0 1 1 959 1 . . . . . . . 6.5 1 1 960 1 . . . . . . . 5.88 1 1 961 1 . . . . . . . 6.08 1 1 962 1 . . . . . . . 4.1 1 1 963 1 . . . . . . . 3.8 1 1 964 1 . . . . . . . 5.3 1 1 965 1 . . . . . . . 7.0 1 1 966 1 . . . . . . . 4.7 1 1 967 1 . . . . . . . 5.7 1 1 968 1 . . . . . . . 4.97 1 1 969 1 . . . . . . . 5.7 1 1 970 1 . . . . . . . 5.7 1 1 971 1 . . . . . . . 2.8 1 1 972 1 . . . . . . . 2.9 1 1 973 1 . . . . . . . 2.8 1 1 974 1 . . . . . . . 6.0 1 1 975 1 . . . . . . . 6.7 1 1 976 1 . . . . . . . 6.1 1 1 977 1 . . . . . . . 6.9 1 1 978 1 . . . . . . . 3.6 1 1 979 1 . . . . . . . 8.0 1 1 980 1 . . . . . . . 6.1 1 1 981 1 . . . . . . . 4.1 1 1 982 1 . . . . . . . 6.5 1 1 983 1 . . . . . . . 8.0 1 1 984 1 . . . . . . . 6.6 1 1 985 1 . . . . . . . 3.8 1 1 986 1 . . . . . . . 3.7 1 1 987 1 . . . . . . . 4.0 1 1 988 1 . . . . . . . 3.5 1 1 989 1 . . . . . . . 5.3 1 1 990 1 . . . . . . . 8.0 1 1 991 1 . . . . . . . 6.4 1 1 992 1 . . . . . . . 4.9 1 1 993 1 . . . . . . . 6.3 1 1 994 1 . . . . . . . 3.0 1 1 995 1 . . . . . . . 8.0 1 1 996 1 . . . . . . . 5.6 1 1 997 1 . . . . . . . 2.8 1 1 998 1 . . . . . . . 6.8 1 1 999 1 . . . . . . . 4.4 1 1 1000 1 . . . . . . . 3.2 1 1 1001 1 . . . . . . . 7.0 1 1 1002 1 . . . . . . . 4.9 1 1 1003 1 . . . . . . . 2.7 1 1 1004 1 . . . . . . . 4.3 1 1 1005 1 . . . . . . . 3.0 1 1 1006 1 . . . . . . . 3.2 1 1 1007 1 . . . . . . . 7.28 1 1 1008 1 . . . . . . . 5.8 1 1 1009 1 . . . . . . . 6.4 1 1 1010 1 . . . . . . . 3.3 1 1 1011 1 . . . . . . . 3.2 1 1 1012 1 . . . . . . . 7.0 1 1 1013 1 . . . . . . . 3.5 1 1 1014 1 . . . . . . . 2.5 1 1 1015 1 . . . . . . . 5.3 1 1 1016 1 . . . . . . . 4.5 1 1 1017 1 . . . . . . . 6.2 1 1 1018 1 . . . . . . . 4.6 1 1 1019 1 . . . . . . . 6.1 1 1 1020 1 . . . . . . . 5.2 1 1 1021 1 . . . . . . . 3.5 1 1 1022 1 . . . . . . . 6.3 1 1 1023 1 . . . . . . . 6.1 1 1 1024 1 . . . . . . . 4.8 1 1 1025 1 . . . . . . . 5.8 1 1 1026 1 . . . . . . . 5.53 1 1 1027 1 . . . . . . . 5.8 1 1 1028 1 . . . . . . . 8.0 1 1 1029 1 . . . . . . . 6.7 1 1 1030 1 . . . . . . . 5.2 1 1 1031 1 . . . . . . . 7.0 1 1 1032 1 . . . . . . . 5.8 1 1 1033 1 . . . . . . . 6.6 1 1 1034 1 . . . . . . . 5.7 1 1 1035 1 . . . . . . . 6.4 1 1 1036 1 . . . . . . . 4.5 1 1 1037 1 . . . . . . . 8.0 1 1 1038 1 . . . . . . . 4.4 1 1 1039 1 . . . . . . . 3.9 1 1 1040 1 . . . . . . . 4.6 1 1 1041 1 . . . . . . . 4.6 1 1 1042 1 . . . . . . . 6.4 1 1 1043 1 . . . . . . . 5.0 1 1 1044 1 . . . . . . . 8.2 1 1 1045 1 . . . . . . . 4.8 1 1 1046 1 . . . . . . . 5.7 1 1 1047 1 . . . . . . . 5.7 1 1 1048 1 . . . . . . . 7.3 1 1 1049 1 . . . . . . . 2.9 1 1 1050 1 . . . . . . . 2.66 1 1 1051 1 . . . . . . . 2.9 1 1 1052 1 . . . . . . . 3.3 1 1 1053 1 . . . . . . . 4.8 1 1 1054 1 . . . . . . . 6.3 1 1 1055 1 . . . . . . . 6.32 1 1 1056 1 . . . . . . . 6.28 1 1 1057 1 . . . . . . . 6.18 1 1 1058 1 . . . . . . . 7.0 1 1 1059 1 . . . . . . . 7.0 1 1 1060 1 . . . . . . . 2.9 1 1 1061 1 . . . . . . . 2.7 1 1 1062 1 . . . . . . . 2.9 1 1 1063 1 . . . . . . . 5.8 1 1 1064 1 . . . . . . . 5.6 1 1 1065 1 . . . . . . . 2.7 1 1 1066 1 . . . . . . . 6.3 1 1 1067 1 . . . . . . . 4.3 1 1 1068 1 . . . . . . . 4.0 1 1 1069 1 . . . . . . . 3.8 1 1 1070 1 . . . . . . . 4.1 1 1 1071 1 . . . . . . . 4.1 1 1 1072 1 . . . . . . . 3.1 1 1 1073 1 . . . . . . . 2.6 1 1 1074 1 . . . . . . . 4.7 1 1 1075 1 . . . . . . . 3.0 1 1 1076 1 . . . . . . . 3.0 1 1 1077 1 . . . . . . . 5.9 1 1 1078 1 . . . . . . . 5.5 1 1 1079 1 . . . . . . . 7.0 1 1 1080 1 . . . . . . . 5.0 1 1 1081 1 . . . . . . . 5.3 1 1 1082 1 . . . . . . . 7.0 1 1 1083 1 . . . . . . . 6.0 1 1 1084 1 . . . . . . . 4.5 1 1 1085 1 . . . . . . . 4.8 1 1 1086 1 . . . . . . . 3.1 1 1 1087 1 . . . . . . . 2.3 1 1 1088 1 . . . . . . . 7.0 1 1 1089 1 . . . . . . . 4.1 1 1 1090 1 . . . . . . . 5.4 1 1 1091 1 . . . . . . . 3.4 1 1 1092 1 . . . . . . . 3.9 1 1 1093 1 . . . . . . . 5.8 1 1 1094 1 . . . . . . . 3.2 1 1 1095 1 . . . . . . . 4.2 1 1 1096 1 . . . . . . . 5.0 1 1 1097 1 . . . . . . . 5.0 1 1 1098 1 . . . . . . . 3.6 1 1 1099 1 . . . . . . . 6.0 1 1 1100 1 . . . . . . . 6.5 1 1 1101 1 . . . . . . . 4.9 1 1 1102 1 . . . . . . . 3.2 1 1 1103 1 . . . . . . . 3.8 1 1 1104 1 . . . . . . . 3.9 1 1 1105 1 . . . . . . . 7.0 1 1 1106 1 . . . . . . . 4.9 1 1 1107 1 . . . . . . . 5.1 1 1 1108 1 . . . . . . . 4.0 1 1 1109 1 . . . . . . . 2.7 1 1 1110 1 . . . . . . . 3.0 1 1 1111 1 . . . . . . . 6.1 1 1 1112 1 . . . . . . . 4.0 1 1 1113 1 . . . . . . . 3.0 1 1 1114 1 . . . . . . . 3.5 1 1 1115 1 . . . . . . . 3.0 1 1 1116 1 . . . . . . . 5.7 1 1 1117 1 . . . . . . . 3.9 1 1 1118 1 . . . . . . . 5.5 1 1 1119 1 . . . . . . . 7.0 1 1 1120 1 . . . . . . . 6.2 1 1 1121 1 . . . . . . . 5.9 1 1 1122 1 . . . . . . . 3.1 1 1 1123 1 . . . . . . . 3.2 1 1 1124 1 . . . . . . . 4.6 1 1 1125 1 . . . . . . . 5.0 1 1 1126 1 . . . . . . . 6.3 1 1 1127 1 . . . . . . . 7.0 1 1 1128 1 . . . . . . . 5.8 1 1 1129 1 . . . . . . . 8.0 1 1 1130 1 . . . . . . . 6.5 1 1 1131 1 . . . . . . . 7.7 1 1 1132 1 . . . . . . . 5.7 1 1 1133 1 . . . . . . . 4.6 1 1 1134 1 . . . . . . . 2.9 1 1 1135 1 . . . . . . . 2.8 1 1 1136 1 . . . . . . . 3.3 1 1 1137 1 . . . . . . . 3.7 1 1 1138 1 . . . . . . . 3.39 1 1 1139 1 . . . . . . . 3.7 1 1 1140 1 . . . . . . . 2.6 1 1 1141 1 . . . . . . . 6.9 1 1 1142 1 . . . . . . . 6.9 1 1 1143 1 . . . . . . . 3.6 1 1 1144 1 . . . . . . . 3.29 1 1 1145 1 . . . . . . . 3.6 1 1 1146 1 . . . . . . . 3.5 1 1 1147 1 . . . . . . . 3.9 1 1 1148 1 . . . . . . . 3.2 1 1 1149 1 . . . . . . . 3.4 1 1 1150 1 . . . . . . . 5.08 1 1 1151 1 . . . . . . . 2.9 1 1 1152 1 . . . . . . . 3.1 1 1 1153 1 . . . . . . . 3.0 1 1 1154 1 . . . . . . . 2.9 1 1 1155 1 . . . . . . . 4.0 1 1 1156 1 . . . . . . . 6.8 1 1 1157 1 . . . . . . . 5.6 1 1 1158 1 . . . . . . . 3.2 1 1 1159 1 . . . . . . . 3.0 1 1 1160 1 . . . . . . . 6.4 1 1 1161 1 . . . . . . . 2.8 1 1 1162 1 . . . . . . . 4.9 1 1 1163 1 . . . . . . . 4.7 1 1 1164 1 . . . . . . . 3.5 1 1 1165 1 . . . . . . . 6.0 1 1 1166 1 . . . . . . . 4.1 1 1 1167 1 . . . . . . . 4.8 1 1 1168 1 . . . . . . . 9.0 1 1 1169 1 . . . . . . . 4.2 1 1 1170 1 . . . . . . . 3.0 1 1 1171 1 . . . . . . . 3.1 1 1 1172 1 . . . . . . . 5.2 1 1 1173 1 . . . . . . . 3.1 1 1 1174 1 . . . . . . . 2.9 1 1 1175 1 . . . . . . . 6.5 1 1 1176 1 . . . . . . . 6.3 1 1 1177 1 . . . . . . . 4.6 1 1 1178 1 . . . . . . . 4.1 1 1 1179 1 . . . . . . . 8.0 1 1 1180 1 . . . . . . . 5.8 1 1 1181 1 . . . . . . . 6.3 1 1 1182 1 . . . . . . . 5.3 1 1 1183 1 . . . . . . . 3.9 1 1 1184 1 . . . . . . . 3.4 1 1 1185 1 . . . . . . . 5.6 1 1 1186 1 . . . . . . . 9.0 1 1 1187 1 . . . . . . . 4.1 1 1 1188 1 . . . . . . . 3.0 1 1 1189 1 . . . . . . . 9.0 1 1 1190 1 . . . . . . . 4.3 1 1 1191 1 . . . . . . . 6.6 1 1 1192 1 . . . . . . . 7.5 1 1 1193 1 . . . . . . . 7.8 1 1 1194 1 . . . . . . . 7.9 1 1 1195 1 . . . . . . . 5.0 1 1 1196 1 . . . . . . . 5.4 1 1 1197 1 . . . . . . . 5.5 1 1 1198 1 . . . . . . . 6.0 1 1 1199 1 . . . . . . . 5.1 1 1 1200 1 . . . . . . . 3.2 1 1 1201 1 . . . . . . . 3.2 1 1 1202 1 . . . . . . . 5.1 1 1 1203 1 . . . . . . . 2.6 1 1 1204 1 . . . . . . . 3.0 1 1 1205 1 . . . . . . . 5.3 1 1 1206 1 . . . . . . . 5.6 1 1 1207 1 . . . . . . . 5.1 1 1 1208 1 . . . . . . . 3.9 1 1 1209 1 . . . . . . . 7.0 1 1 1210 1 . . . . . . . 4.7 1 1 1211 1 . . . . . . . 5.6 1 1 1212 1 . . . . . . . 4.1 1 1 1213 1 . . . . . . . 4.4 1 1 1214 1 . . . . . . . 6.2 1 1 1215 1 . . . . . . . 4.8 1 1 1216 1 . . . . . . . 3.8 1 1 1217 1 . . . . . . . 5.3 1 1 1218 1 . . . . . . . 3.7 1 1 1219 1 . . . . . . . 5.8 1 1 1220 1 . . . . . . . 3.1 1 1 1221 1 . . . . . . . 3.7 1 1 1222 1 . . . . . . . 3.1 1 1 1223 1 . . . . . . . 7.0 1 1 1224 1 . . . . . . . 2.5 1 1 1225 1 . . . . . . . 5.7 1 1 1226 1 . . . . . . . 3.6 1 1 1227 1 . . . . . . . 2.9 1 1 1228 1 . . . . . . . 4.0 1 1 1229 1 . . . . . . . 3.5 1 1 1230 1 . . . . . . . 5.4 1 1 1231 1 . . . . . . . 4.5 1 1 1232 1 . . . . . . . 6.0 1 1 1233 1 . . . . . . . 3.6 1 1 1234 1 . . . . . . . 3.7 1 1 1235 1 . . . . . . . 6.7 1 1 1236 1 . . . . . . . 7.7 1 1 1237 1 . . . . . . . 6.6 1 1 1238 1 . . . . . . . 3.8 1 1 1239 1 . . . . . . . 4.9 1 1 1240 1 . . . . . . . 6.6 1 1 1241 1 . . . . . . . 5.3 1 1 1242 1 . . . . . . . 8.0 1 1 1243 1 . . . . . . . 4.6 1 1 1244 1 . . . . . . . 3.8 1 1 1245 1 . . . . . . . 6.8 1 1 1246 1 . . . . . . . 4.1 1 1 1247 1 . . . . . . . 7.4 1 1 1248 1 . . . . . . . 2.8 1 1 1249 1 . . . . . . . 2.9 1 1 1250 1 . . . . . . . 3.4 1 1 1251 1 . . . . . . . 7.0 1 1 1252 1 . . . . . . . 3.6 1 1 1253 1 . . . . . . . 4.0 1 1 1254 1 . . . . . . . 4.9 1 1 1255 1 . . . . . . . 6.0 1 1 1256 1 . . . . . . . 5.7 1 1 1257 1 . . . . . . . 7.4 1 1 1258 1 . . . . . . . 5.7 1 1 1259 1 . . . . . . . 6.3 1 1 1260 1 . . . . . . . 2.8 1 1 1261 1 . . . . . . . 3.3 1 1 1262 1 . . . . . . . 3.2 1 1 1263 1 . . . . . . . 5.5 1 1 1264 1 . . . . . . . 6.0 1 1 1265 1 . . . . . . . 6.4 1 1 1266 1 . . . . . . . 6.4 1 1 1267 1 . . . . . . . 5.3 1 1 1268 1 . . . . . . . 6.6 1 1 1269 1 . . . . . . . 7.0 1 1 1270 1 . . . . . . . 3.0 1 1 1271 1 . . . . . . . 2.9 1 1 1272 1 . . . . . . . 5.2 1 1 1273 1 . . . . . . . 7.0 1 1 1274 1 . . . . . . . 7.3 1 1 1275 1 . . . . . . . 5.3 1 1 1276 1 . . . . . . . 2.8 1 1 1277 1 . . . . . . . 3.2 1 1 1278 1 . . . . . . . 3.6 1 1 1279 1 . . . . . . . 5.1 1 1 1280 1 . . . . . . . 6.7 1 1 1281 1 . . . . . . . 4.9 1 1 1282 1 . . . . . . . 4.2 1 1 1283 1 . . . . . . . 5.5 1 1 1284 1 . . . . . . . 5.5 1 1 1285 1 . . . . . . . 4.2 1 1 1286 1 . . . . . . . 4.2 1 1 1287 1 . . . . . . . 2.9 1 1 1288 1 . . . . . . . 3.1 1 1 1289 1 . . . . . . . 4.5 1 1 1290 1 . . . . . . . 2.9 1 1 1291 1 . . . . . . . 4.0 1 1 1292 1 . . . . . . . 3.0 1 1 1293 1 . . . . . . . 3.4 1 1 1294 1 . . . . . . . 5.6 1 1 1295 1 . . . . . . . 6.0 1 1 1296 1 . . . . . . . 5.0 1 1 1297 1 . . . . . . . 3.7 1 1 1298 1 . . . . . . . 4.7 1 1 1299 1 . . . . . . . 4.0 1 1 1300 1 . . . . . . . 5.4 1 1 1301 1 . . . . . . . 7.0 1 1 1302 1 . . . . . . . 6.5 1 1 1303 1 . . . . . . . 7.8 1 1 1304 1 . . . . . . . 7.7 1 1 1305 1 . . . . . . . 8.0 1 1 1306 1 . . . . . . . 8.0 1 1 1307 1 . . . . . . . 5.3 1 1 1308 1 . . . . . . . 5.4 1 1 1309 1 . . . . . . . 6.3 1 1 1310 1 . . . . . . . 6.7 1 1 1311 1 . . . . . . . 6.3 1 1 1312 1 . . . . . . . 8.0 1 1 1313 1 . . . . . . . 4.2 1 1 1314 1 . . . . . . . 2.7 1 1 1315 1 . . . . . . . 2.4 1 1 1316 1 . . . . . . . 3.2 1 1 1317 1 . . . . . . . 7.0 1 1 1318 1 . . . . . . . 7.0 1 1 1319 1 . . . . . . . 6.6 1 1 1320 1 . . . . . . . 6.2 1 1 1321 1 . . . . . . . 5.6 1 1 1322 1 . . . . . . . 5.8 1 1 1323 1 . . . . . . . 4.1 1 1 1324 1 . . . . . . . 5.3 1 1 1325 1 . . . . . . . 6.8 1 1 1326 1 . . . . . . . 7.0 1 1 1327 1 . . . . . . . 5.1 1 1 1328 1 . . . . . . . 7.0 1 1 1329 1 . . . . . . . 6.5 1 1 1330 1 . . . . . . . 3.6 1 1 1331 1 . . . . . . . 2.8 1 1 1332 1 . . . . . . . 2.7 1 1 1333 1 . . . . . . . 3.6 1 1 1334 1 . . . . . . . 3.0 1 1 1335 1 . . . . . . . 4.0 1 1 1336 1 . . . . . . . 6.7 1 1 1337 1 . . . . . . . 7.0 1 1 1338 1 . . . . . . . 5.9 1 1 1339 1 . . . . . . . 4.2 1 1 1340 1 . . . . . . . 4.2 1 1 1341 1 . . . . . . . 4.0 1 1 1342 1 . . . . . . . 5.0 1 1 1343 1 . . . . . . . 2.9 1 1 1344 1 . . . . . . . 4.9 1 1 1345 1 . . . . . . . 3.4 1 1 1346 1 . . . . . . . 4.9 1 1 1347 1 . . . . . . . 4.0 1 1 1348 1 . . . . . . . 3.2 1 1 1349 1 . . . . . . . 7.0 1 1 1350 1 . . . . . . . 7.0 1 1 1351 1 . . . . . . . 3.6 1 1 1352 1 . . . . . . . 6.7 1 1 1353 1 . . . . . . . 7.9 1 1 1354 1 . . . . . . . 6.5 1 1 1355 1 . . . . . . . 8.0 1 1 1356 1 . . . . . . . 6.6 1 1 1357 1 . . . . . . . 4.0 1 1 1358 1 . . . . . . . 3.8 1 1 1359 1 . . . . . . . 5.0 1 1 1360 1 . . . . . . . 5.0 1 1 1361 1 . . . . . . . 4.0 1 1 1362 1 . . . . . . . 5.7 1 1 1363 1 . . . . . . . 3.6 1 1 1364 1 . . . . . . . 2.7 1 1 1365 1 . . . . . . . 2.7 1 1 1366 1 . . . . . . . 3.8 1 1 1367 1 . . . . . . . 2.9 1 1 1368 1 . . . . . . . 5.4 1 1 1369 1 . . . . . . . 7.0 1 1 1370 1 . . . . . . . 4.3 1 1 1371 1 . . . . . . . 4.4 1 1 1372 1 . . . . . . . 5.9 1 1 1373 1 . . . . . . . 6.4 1 1 1374 1 . . . . . . . 2.6 1 1 1375 1 . . . . . . . 3.0 1 1 1376 1 . . . . . . . 3.7 1 1 1377 1 . . . . . . . 4.7 1 1 1378 1 . . . . . . . 3.4 1 1 1379 1 . . . . . . . 4.5 1 1 1380 1 . . . . . . . 5.6 1 1 1381 1 . . . . . . . 4.3 1 1 1382 1 . . . . . . . 3.8 1 1 1383 1 . . . . . . . 3.4 1 1 1384 1 . . . . . . . 3.0 1 1 1385 1 . . . . . . . 3.6 1 1 1386 1 . . . . . . . 5.3 1 1 1387 1 . . . . . . . 5.5 1 1 1388 1 . . . . . . . 7.0 1 1 1389 1 . . . . . . . 3.1 1 1 1390 1 . . . . . . . 4.1 1 1 1391 1 . . . . . . . 3.0 1 1 1392 1 . . . . . . . 7.0 1 1 1393 1 . . . . . . . 5.0 1 1 1394 1 . . . . . . . 2.8 1 1 1395 1 . . . . . . . 3.7 1 1 1396 1 . . . . . . . 3.2 1 1 1397 1 . . . . . . . 5.3 1 1 1398 1 . . . . . . . 4.0 1 1 1399 1 . . . . . . . 3.6 1 1 1400 1 . . . . . . . 5.5 1 1 1401 1 . . . . . . . 3.9 1 1 1402 1 . . . . . . . 4.3 1 1 1403 1 . . . . . . . 6.6 1 1 1404 1 . . . . . . . 7.0 1 1 1405 1 . . . . . . . 3.2 1 1 1406 1 . . . . . . . 2.6 1 1 1407 1 . . . . . . . 6.7 1 1 1408 1 . . . . . . . 2.9 1 1 1409 1 . . . . . . . 3.2 1 1 1410 1 . . . . . . . 5.6 1 1 1411 1 . . . . . . . 5.1 1 1 1412 1 . . . . . . . 4.8 1 1 1413 1 . . . . . . . 7.5 1 1 1414 1 . . . . . . . 2.6 1 1 1415 1 . . . . . . . 4.9 1 1 1416 1 . . . . . . . 5.0 1 1 1417 1 . . . . . . . 2.3 1 1 1418 1 . . . . . . . 4.8 1 1 1419 1 . . . . . . . 6.3 1 1 1420 1 . . . . . . . 4.1 1 1 1421 1 . . . . . . . 3.3 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 ALA C C -2.671 5.693 20.838 1.00 . A A . 1 ALA C 1 1 1 2 1 1 1 ALA CA C -1.956 4.804 21.858 1.00 . A A . 1 ALA CA 1 1 1 3 1 1 1 ALA CB C -1.790 3.366 21.362 1.00 . A A . 1 ALA CB 1 1 1 4 1 1 1 ALA H1 H -2.059 4.804 23.885 1.00 . A A . 1 ALA H1 1 1 1 5 1 1 1 ALA H2 H -3.289 5.632 23.147 1.00 . A A . 1 ALA H2 1 1 1 6 1 1 1 ALA HA H -0.970 5.220 22.063 1.00 . A A . 1 ALA HA 1 1 1 7 1 1 1 ALA HB1 H -1.847 2.681 22.208 1.00 . A A . 1 ALA HB1 1 1 1 8 1 1 1 ALA HB2 H -2.584 3.132 20.652 1.00 . A A . 1 ALA HB2 1 1 1 9 1 1 1 ALA HB3 H -0.822 3.260 20.873 1.00 . A A . 1 ALA HB3 1 1 1 10 1 1 1 ALA N N -2.705 4.804 23.103 1.00 . A A . 1 ALA N 1 1 1 11 1 1 1 ALA O O -3.810 6.102 21.057 1.00 . A A . 1 ALA O 1 1 1 12 1 1 2 PRO C C -3.547 6.039 17.847 1.00 . A A . 2 PRO C 1 1 1 13 1 1 2 PRO CA C -2.507 6.808 18.664 1.00 . A A . 2 PRO CA 1 1 1 14 1 1 2 PRO CB C -1.308 7.245 17.838 1.00 . A A . 2 PRO CB 1 1 1 15 1 1 2 PRO CD C -0.601 5.507 19.425 1.00 . A A . 2 PRO CD 1 1 1 16 1 1 2 PRO CG C -0.191 6.272 18.178 1.00 . A A . 2 PRO CG 1 1 1 17 1 1 2 PRO HA H -2.991 7.589 19.058 1.00 . A A . 2 PRO HA 1 1 1 18 1 1 2 PRO HB2 H -1.538 7.220 16.773 1.00 . A A . 2 PRO HB2 1 1 1 19 1 1 2 PRO HB3 H -1.021 8.269 18.079 1.00 . A A . 2 PRO HB3 1 1 1 20 1 1 2 PRO HD2 H -0.582 4.431 19.254 1.00 . A A . 2 PRO HD2 1 1 1 21 1 1 2 PRO HD3 H 0.076 5.710 20.255 1.00 . A A . 2 PRO HD3 1 1 1 22 1 1 2 PRO HG2 H -0.017 5.586 17.349 1.00 . A A . 2 PRO HG2 1 1 1 23 1 1 2 PRO HG3 H 0.743 6.808 18.348 1.00 . A A . 2 PRO HG3 1 1 1 24 1 1 2 PRO N N -1.953 5.974 19.718 1.00 . A A . 2 PRO N 1 1 1 25 1 1 2 PRO O O -4.288 6.632 17.063 1.00 . A A . 2 PRO O 1 1 1 26 1 1 3 LYS C C -4.478 4.217 15.859 1.00 . A A . 3 LYS C 1 1 1 27 1 1 3 LYS CA C -4.508 3.876 17.350 1.00 . A A . 3 LYS CA 1 1 1 28 1 1 3 LYS CB C -5.901 3.975 17.975 1.00 . A A . 3 LYS CB 1 1 1 29 1 1 3 LYS CD C -7.872 2.680 18.869 1.00 . A A . 3 LYS CD 1 1 1 30 1 1 3 LYS CE C -7.913 2.376 20.368 1.00 . A A . 3 LYS CE 1 1 1 31 1 1 3 LYS CG C -6.443 2.589 18.330 1.00 . A A . 3 LYS CG 1 1 1 32 1 1 3 LYS H H -2.966 4.257 18.697 1.00 . A A . 3 LYS H 1 1 1 33 1 1 3 LYS HA H -4.171 2.847 17.476 1.00 . A A . 3 LYS HA 1 1 1 34 1 1 3 LYS HB2 H -5.859 4.593 18.872 1.00 . A A . 3 LYS HB2 1 1 1 35 1 1 3 LYS HB3 H -6.581 4.469 17.281 1.00 . A A . 3 LYS HB3 1 1 1 36 1 1 3 LYS HD2 H -8.271 3.678 18.686 1.00 . A A . 3 LYS HD2 1 1 1 37 1 1 3 LYS HD3 H -8.512 1.978 18.335 1.00 . A A . 3 LYS HD3 1 1 1 38 1 1 3 LYS HE2 H -7.767 1.309 20.533 1.00 . A A . 3 LYS HE2 1 1 1 39 1 1 3 LYS HE3 H -7.095 2.891 20.872 1.00 . A A . 3 LYS HE3 1 1 1 40 1 1 3 LYS HG2 H -6.423 1.950 17.447 1.00 . A A . 3 LYS HG2 1 1 1 41 1 1 3 LYS HG3 H -5.798 2.122 19.075 1.00 . A A . 3 LYS HG3 1 1 1 42 1 1 3 LYS HZ1 H -9.084 3.316 21.813 1.00 . A A . 3 LYS HZ1 1 1 1 43 1 1 3 LYS HZ2 H -9.725 3.403 20.318 1.00 . A A . 3 LYS HZ2 1 1 1 44 1 1 3 LYS N N -3.571 4.732 18.058 1.00 . A A . 3 LYS N 1 1 1 45 1 1 3 LYS NZ N -9.207 2.801 20.948 1.00 . A A . 3 LYS NZ 1 1 1 46 1 1 3 LYS O O -3.641 5.001 15.415 1.00 . A A . 3 LYS O 1 1 1 47 1 1 4 ALA C C -6.137 5.205 13.441 1.00 . A A . 4 ALA C 1 1 1 48 1 1 4 ALA CA C -5.491 3.841 13.695 1.00 . A A . 4 ALA CA 1 1 1 49 1 1 4 ALA CB C -6.268 2.697 13.042 1.00 . A A . 4 ALA CB 1 1 1 50 1 1 4 ALA H H -6.079 2.976 15.496 1.00 . A A . 4 ALA H 1 1 1 51 1 1 4 ALA HA H -4.476 3.849 13.296 1.00 . A A . 4 ALA HA 1 1 1 52 1 1 4 ALA HB1 H -6.881 2.199 13.793 1.00 . A A . 4 ALA HB1 1 1 1 53 1 1 4 ALA HB2 H -6.909 3.095 12.255 1.00 . A A . 4 ALA HB2 1 1 1 54 1 1 4 ALA HB3 H -5.568 1.981 12.612 1.00 . A A . 4 ALA HB3 1 1 1 55 1 1 4 ALA N N -5.402 3.612 15.127 1.00 . A A . 4 ALA N 1 1 1 56 1 1 4 ALA O O -6.969 5.658 14.226 1.00 . A A . 4 ALA O 1 1 1 57 1 1 5 PRO C C -7.669 7.018 11.392 1.00 . A A . 5 PRO C 1 1 1 58 1 1 5 PRO CA C -6.248 7.140 11.944 1.00 . A A . 5 PRO CA 1 1 1 59 1 1 5 PRO CB C -5.261 7.693 10.929 1.00 . A A . 5 PRO CB 1 1 1 60 1 1 5 PRO CD C -4.736 5.331 11.358 1.00 . A A . 5 PRO CD 1 1 1 61 1 1 5 PRO CG C -4.473 6.497 10.419 1.00 . A A . 5 PRO CG 1 1 1 62 1 1 5 PRO HA H -6.317 7.726 12.751 1.00 . A A . 5 PRO HA 1 1 1 63 1 1 5 PRO HB2 H -5.781 8.195 10.113 1.00 . A A . 5 PRO HB2 1 1 1 64 1 1 5 PRO HB3 H -4.601 8.429 11.387 1.00 . A A . 5 PRO HB3 1 1 1 65 1 1 5 PRO HD2 H -5.118 4.465 10.818 1.00 . A A . 5 PRO HD2 1 1 1 66 1 1 5 PRO HD3 H -3.822 5.015 11.862 1.00 . A A . 5 PRO HD3 1 1 1 67 1 1 5 PRO HG2 H -4.777 6.244 9.403 1.00 . A A . 5 PRO HG2 1 1 1 68 1 1 5 PRO HG3 H -3.409 6.727 10.385 1.00 . A A . 5 PRO HG3 1 1 1 69 1 1 5 PRO N N -5.719 5.837 12.312 1.00 . A A . 5 PRO N 1 1 1 70 1 1 5 PRO O O -8.166 5.912 11.183 1.00 . A A . 5 PRO O 1 1 1 71 1 1 6 ALA C C -9.671 7.522 9.278 1.00 . A A . 6 ALA C 1 1 1 72 1 1 6 ALA CA C -9.639 8.208 10.646 1.00 . A A . 6 ALA CA 1 1 1 73 1 1 6 ALA CB C -10.123 9.658 10.583 1.00 . A A . 6 ALA CB 1 1 1 74 1 1 6 ALA H H -7.873 9.066 11.342 1.00 . A A . 6 ALA H 1 1 1 75 1 1 6 ALA HA H -10.277 7.654 11.335 1.00 . A A . 6 ALA HA 1 1 1 76 1 1 6 ALA HB1 H -9.405 10.303 11.089 1.00 . A A . 6 ALA HB1 1 1 1 77 1 1 6 ALA HB2 H -10.215 9.965 9.541 1.00 . A A . 6 ALA HB2 1 1 1 78 1 1 6 ALA HB3 H -11.093 9.738 11.073 1.00 . A A . 6 ALA HB3 1 1 1 79 1 1 6 ALA N N -8.284 8.171 11.170 1.00 . A A . 6 ALA N 1 1 1 80 1 1 6 ALA O O -8.642 7.064 8.786 1.00 . A A . 6 ALA O 1 1 1 81 1 1 7 ASP C C -10.950 7.922 6.314 1.00 . A A . 7 ASP C 1 1 1 82 1 1 7 ASP CA C -11.044 6.852 7.404 1.00 . A A . 7 ASP CA 1 1 1 83 1 1 7 ASP CB C -12.418 6.187 7.296 1.00 . A A . 7 ASP CB 1 1 1 84 1 1 7 ASP CG C -13.608 7.147 7.366 1.00 . A A . 7 ASP CG 1 1 1 85 1 1 7 ASP H H -11.696 7.850 9.112 1.00 . A A . 7 ASP H 1 1 1 86 1 1 7 ASP HA H -10.250 6.109 7.329 1.00 . A A . 7 ASP HA 1 1 1 87 1 1 7 ASP HB2 H -12.467 5.640 6.355 1.00 . A A . 7 ASP HB2 1 1 1 88 1 1 7 ASP HB3 H -12.514 5.454 8.097 1.00 . A A . 7 ASP HB3 1 1 1 89 1 1 7 ASP N N -10.864 7.474 8.704 1.00 . A A . 7 ASP N 1 1 1 90 1 1 7 ASP O O -10.954 9.116 6.609 1.00 . A A . 7 ASP O 1 1 1 91 1 1 7 ASP OD1 O -13.419 8.244 7.934 1.00 . A A . 7 ASP OD1 1 1 1 92 1 1 7 ASP OD2 O -14.679 6.761 6.851 1.00 . A A . 7 ASP OD2 1 1 1 93 1 1 8 GLY C C -9.331 8.833 3.739 1.00 . A A . 8 GLY C 1 1 1 94 1 1 8 GLY CA C -10.771 8.357 3.941 1.00 . A A . 8 GLY CA 1 1 1 95 1 1 8 GLY H H -10.864 6.482 4.845 1.00 . A A . 8 GLY H 1 1 1 96 1 1 8 GLY HA2 H -11.121 7.852 3.041 1.00 . A A . 8 GLY HA2 1 1 1 97 1 1 8 GLY HA3 H -11.423 9.216 4.099 1.00 . A A . 8 GLY HA3 1 1 1 98 1 1 8 GLY N N -10.867 7.455 5.076 1.00 . A A . 8 GLY N 1 1 1 99 1 1 8 GLY O O -9.098 9.874 3.128 1.00 . A A . 8 GLY O 1 1 1 100 1 1 9 LEU C C -6.519 8.081 2.722 1.00 . A A . 9 LEU C 1 1 1 101 1 1 9 LEU CA C -6.992 8.374 4.148 1.00 . A A . 9 LEU CA 1 1 1 102 1 1 9 LEU CB C -6.183 7.648 5.225 1.00 . A A . 9 LEU CB 1 1 1 103 1 1 9 LEU CD1 C -4.247 6.270 4.383 1.00 . A A . 9 LEU CD1 1 1 1 104 1 1 9 LEU CD2 C -4.195 8.798 4.184 1.00 . A A . 9 LEU CD2 1 1 1 105 1 1 9 LEU CG C -4.669 7.600 5.009 1.00 . A A . 9 LEU CG 1 1 1 106 1 1 9 LEU H H -8.601 7.200 4.759 1.00 . A A . 9 LEU H 1 1 1 107 1 1 9 LEU HA H -6.889 9.443 4.333 1.00 . A A . 9 LEU HA 1 1 1 108 1 1 9 LEU HB2 H -6.379 8.129 6.184 1.00 . A A . 9 LEU HB2 1 1 1 109 1 1 9 LEU HB3 H -6.552 6.625 5.301 1.00 . A A . 9 LEU HB3 1 1 1 110 1 1 9 LEU HD11 H -4.855 5.465 4.795 1.00 . A A . 9 LEU HD11 1 1 1 111 1 1 9 LEU HD12 H -4.387 6.315 3.303 1.00 . A A . 9 LEU HD12 1 1 1 112 1 1 9 LEU HD13 H -3.196 6.081 4.605 1.00 . A A . 9 LEU HD13 1 1 1 113 1 1 9 LEU HD21 H -4.890 9.628 4.315 1.00 . A A . 9 LEU HD21 1 1 1 114 1 1 9 LEU HD22 H -3.202 9.099 4.518 1.00 . A A . 9 LEU HD22 1 1 1 115 1 1 9 LEU HD23 H -4.155 8.521 3.131 1.00 . A A . 9 LEU HD23 1 1 1 116 1 1 9 LEU HG H -4.183 7.667 5.982 1.00 . A A . 9 LEU HG 1 1 1 117 1 1 9 LEU N N -8.403 8.046 4.263 1.00 . A A . 9 LEU N 1 1 1 118 1 1 9 LEU O O -6.283 6.927 2.368 1.00 . A A . 9 LEU O 1 1 1 119 1 1 10 LYS C C -4.573 9.651 0.413 1.00 . A A . 10 LYS C 1 1 1 120 1 1 10 LYS CA C -5.957 9.017 0.564 1.00 . A A . 10 LYS CA 1 1 1 121 1 1 10 LYS CB C -7.006 9.594 -0.388 1.00 . A A . 10 LYS CB 1 1 1 122 1 1 10 LYS CD C -7.703 11.736 -1.522 1.00 . A A . 10 LYS CD 1 1 1 123 1 1 10 LYS CE C -7.276 12.619 -2.697 1.00 . A A . 10 LYS CE 1 1 1 124 1 1 10 LYS CG C -6.524 10.911 -1.000 1.00 . A A . 10 LYS CG 1 1 1 125 1 1 10 LYS H H -6.591 10.080 2.239 1.00 . A A . 10 LYS H 1 1 1 126 1 1 10 LYS HA H -5.874 7.952 0.346 1.00 . A A . 10 LYS HA 1 1 1 127 1 1 10 LYS HB2 H -7.217 8.877 -1.181 1.00 . A A . 10 LYS HB2 1 1 1 128 1 1 10 LYS HB3 H -7.939 9.758 0.149 1.00 . A A . 10 LYS HB3 1 1 1 129 1 1 10 LYS HD2 H -8.507 11.070 -1.836 1.00 . A A . 10 LYS HD2 1 1 1 130 1 1 10 LYS HD3 H -8.099 12.359 -0.720 1.00 . A A . 10 LYS HD3 1 1 1 131 1 1 10 LYS HE2 H -6.839 12.002 -3.483 1.00 . A A . 10 LYS HE2 1 1 1 132 1 1 10 LYS HE3 H -8.149 13.110 -3.126 1.00 . A A . 10 LYS HE3 1 1 1 133 1 1 10 LYS HG2 H -5.977 11.485 -0.252 1.00 . A A . 10 LYS HG2 1 1 1 134 1 1 10 LYS HG3 H -5.830 10.706 -1.815 1.00 . A A . 10 LYS HG3 1 1 1 135 1 1 10 LYS HZ1 H -6.299 13.751 -1.246 1.00 . A A . 10 LYS HZ1 1 1 1 136 1 1 10 LYS HZ2 H -5.348 13.390 -2.518 1.00 . A A . 10 LYS HZ2 1 1 1 137 1 1 10 LYS N N -6.396 9.145 1.943 1.00 . A A . 10 LYS N 1 1 1 138 1 1 10 LYS NZ N -6.296 13.635 -2.253 1.00 . A A . 10 LYS NZ 1 1 1 139 1 1 10 LYS O O -4.211 10.547 1.174 1.00 . A A . 10 LYS O 1 1 1 140 1 1 11 MET C C -2.332 10.039 -2.309 1.00 . A A . 11 MET C 1 1 1 141 1 1 11 MET CA C -2.501 9.669 -0.834 1.00 . A A . 11 MET CA 1 1 1 142 1 1 11 MET CB C -1.467 8.608 -0.452 1.00 . A A . 11 MET CB 1 1 1 143 1 1 11 MET CE C -0.523 5.073 -0.123 1.00 . A A . 11 MET CE 1 1 1 144 1 1 11 MET CG C -1.755 7.283 -1.162 1.00 . A A . 11 MET CG 1 1 1 145 1 1 11 MET H H -4.139 8.433 -1.188 1.00 . A A . 11 MET H 1 1 1 146 1 1 11 MET HA H -2.401 10.561 -0.215 1.00 . A A . 11 MET HA 1 1 1 147 1 1 11 MET HB2 H -0.469 8.956 -0.715 1.00 . A A . 11 MET HB2 1 1 1 148 1 1 11 MET HB3 H -1.479 8.456 0.627 1.00 . A A . 11 MET HB3 1 1 1 149 1 1 11 MET HE1 H 0.323 5.761 -0.105 1.00 . A A . 11 MET HE1 1 1 1 150 1 1 11 MET HE2 H -0.435 4.368 0.703 1.00 . A A . 11 MET HE2 1 1 1 151 1 1 11 MET HE3 H -0.529 4.528 -1.067 1.00 . A A . 11 MET HE3 1 1 1 152 1 1 11 MET HG2 H -2.625 7.389 -1.809 1.00 . A A . 11 MET HG2 1 1 1 153 1 1 11 MET HG3 H -0.914 7.014 -1.801 1.00 . A A . 11 MET HG3 1 1 1 154 1 1 11 MET N N -3.837 9.162 -0.574 1.00 . A A . 11 MET N 1 1 1 155 1 1 11 MET O O -2.363 9.169 -3.178 1.00 . A A . 11 MET O 1 1 1 156 1 1 11 MET SD S -2.043 5.996 0.040 1.00 . A A . 11 MET SD 1 1 1 157 1 1 12 GLU C C -0.536 12.264 -4.126 1.00 . A A . 12 GLU C 1 1 1 158 1 1 12 GLU CA C -1.985 11.826 -3.901 1.00 . A A . 12 GLU CA 1 1 1 159 1 1 12 GLU CB C -2.956 12.972 -4.194 1.00 . A A . 12 GLU CB 1 1 1 160 1 1 12 GLU CD C -1.937 14.258 -6.110 1.00 . A A . 12 GLU CD 1 1 1 161 1 1 12 GLU CG C -3.023 13.263 -5.695 1.00 . A A . 12 GLU CG 1 1 1 162 1 1 12 GLU H H -2.134 12.032 -1.834 1.00 . A A . 12 GLU H 1 1 1 163 1 1 12 GLU HA H -2.222 10.983 -4.550 1.00 . A A . 12 GLU HA 1 1 1 164 1 1 12 GLU HB2 H -3.949 12.715 -3.825 1.00 . A A . 12 GLU HB2 1 1 1 165 1 1 12 GLU HB3 H -2.639 13.868 -3.660 1.00 . A A . 12 GLU HB3 1 1 1 166 1 1 12 GLU HG2 H -2.905 12.335 -6.255 1.00 . A A . 12 GLU HG2 1 1 1 167 1 1 12 GLU HG3 H -4.005 13.665 -5.947 1.00 . A A . 12 GLU HG3 1 1 1 168 1 1 12 GLU N N -2.158 11.331 -2.546 1.00 . A A . 12 GLU N 1 1 1 169 1 1 12 GLU O O -0.263 13.450 -4.300 1.00 . A A . 12 GLU O 1 1 1 170 1 1 12 GLU OE1 O -2.119 15.457 -5.804 1.00 . A A . 12 GLU OE1 1 1 1 171 1 1 12 GLU OE2 O -0.950 13.798 -6.723 1.00 . A A . 12 GLU OE2 1 1 1 172 1 1 13 ALA C C 2.128 11.302 -5.779 1.00 . A A . 13 ALA C 1 1 1 173 1 1 13 ALA CA C 1.767 11.552 -4.313 1.00 . A A . 13 ALA CA 1 1 1 174 1 1 13 ALA CB C 2.592 10.689 -3.355 1.00 . A A . 13 ALA CB 1 1 1 175 1 1 13 ALA H H 0.123 10.320 -3.972 1.00 . A A . 13 ALA H 1 1 1 176 1 1 13 ALA HA H 1.942 12.601 -4.078 1.00 . A A . 13 ALA HA 1 1 1 177 1 1 13 ALA HB1 H 2.312 9.642 -3.477 1.00 . A A . 13 ALA HB1 1 1 1 178 1 1 13 ALA HB2 H 3.652 10.810 -3.578 1.00 . A A . 13 ALA HB2 1 1 1 179 1 1 13 ALA HB3 H 2.398 11.000 -2.329 1.00 . A A . 13 ALA HB3 1 1 1 180 1 1 13 ALA N N 0.354 11.282 -4.114 1.00 . A A . 13 ALA N 1 1 1 181 1 1 13 ALA O O 3.225 11.642 -6.219 1.00 . A A . 13 ALA O 1 1 1 182 1 1 14 THR C C 0.189 10.883 -8.727 1.00 . A A . 14 THR C 1 1 1 183 1 1 14 THR CA C 1.388 10.410 -7.902 1.00 . A A . 14 THR CA 1 1 1 184 1 1 14 THR CB C 1.661 8.910 -8.031 1.00 . A A . 14 THR CB 1 1 1 185 1 1 14 THR CG2 C 2.466 8.358 -6.853 1.00 . A A . 14 THR CG2 1 1 1 186 1 1 14 THR H H 0.293 10.436 -6.130 1.00 . A A . 14 THR H 1 1 1 187 1 1 14 THR HA H 2.256 10.970 -8.250 1.00 . A A . 14 THR HA 1 1 1 188 1 1 14 THR HB H 2.152 8.684 -8.978 1.00 . A A . 14 THR HB 1 1 1 189 1 1 14 THR HG1 H -0.043 8.603 -7.028 1.00 . A A . 14 THR HG1 1 1 1 190 1 1 14 THR HG21 H 3.411 8.895 -6.775 1.00 . A A . 14 THR HG21 1 1 1 191 1 1 14 THR HG22 H 1.897 8.488 -5.932 1.00 . A A . 14 THR HG22 1 1 1 192 1 1 14 THR HG23 H 2.663 7.298 -7.013 1.00 . A A . 14 THR HG23 1 1 1 193 1 1 14 THR N N 1.183 10.710 -6.495 1.00 . A A . 14 THR N 1 1 1 194 1 1 14 THR O O -0.795 11.372 -8.175 1.00 . A A . 14 THR O 1 1 1 195 1 1 14 THR OG1 O 0.377 8.309 -7.887 1.00 . A A . 14 THR OG1 1 1 1 196 1 1 15 LYS C C -1.990 10.268 -10.683 1.00 . A A . 15 LYS C 1 1 1 197 1 1 15 LYS CA C -0.749 11.124 -10.944 1.00 . A A . 15 LYS CA 1 1 1 198 1 1 15 LYS CB C -0.262 11.075 -12.393 1.00 . A A . 15 LYS CB 1 1 1 199 1 1 15 LYS CD C -0.498 12.535 -14.436 1.00 . A A . 15 LYS CD 1 1 1 200 1 1 15 LYS CE C -1.276 13.775 -14.881 1.00 . A A . 15 LYS CE 1 1 1 201 1 1 15 LYS CG C -1.242 11.791 -13.325 1.00 . A A . 15 LYS CG 1 1 1 202 1 1 15 LYS H H 1.115 10.321 -10.477 1.00 . A A . 15 LYS H 1 1 1 203 1 1 15 LYS HA H -0.992 12.163 -10.720 1.00 . A A . 15 LYS HA 1 1 1 204 1 1 15 LYS HB2 H 0.721 11.540 -12.467 1.00 . A A . 15 LYS HB2 1 1 1 205 1 1 15 LYS HB3 H -0.147 10.038 -12.708 1.00 . A A . 15 LYS HB3 1 1 1 206 1 1 15 LYS HD2 H 0.490 12.830 -14.082 1.00 . A A . 15 LYS HD2 1 1 1 207 1 1 15 LYS HD3 H -0.347 11.871 -15.286 1.00 . A A . 15 LYS HD3 1 1 1 208 1 1 15 LYS HE2 H -1.944 13.517 -15.703 1.00 . A A . 15 LYS HE2 1 1 1 209 1 1 15 LYS HE3 H -1.901 14.133 -14.063 1.00 . A A . 15 LYS HE3 1 1 1 210 1 1 15 LYS HG2 H -1.927 11.066 -13.764 1.00 . A A . 15 LYS HG2 1 1 1 211 1 1 15 LYS HG3 H -1.846 12.494 -12.752 1.00 . A A . 15 LYS HG3 1 1 1 212 1 1 15 LYS HZ1 H -0.160 15.506 -14.561 1.00 . A A . 15 LYS HZ1 1 1 1 213 1 1 15 LYS HZ2 H 0.550 14.474 -15.602 1.00 . A A . 15 LYS HZ2 1 1 1 214 1 1 15 LYS N N 0.312 10.720 -10.037 1.00 . A A . 15 LYS N 1 1 1 215 1 1 15 LYS NZ N -0.347 14.845 -15.307 1.00 . A A . 15 LYS NZ 1 1 1 216 1 1 15 LYS O O -3.074 10.573 -11.179 1.00 . A A . 15 LYS O 1 1 1 217 1 1 16 GLN C C -3.025 8.191 -8.054 1.00 . A A . 16 GLN C 1 1 1 218 1 1 16 GLN CA C -2.881 8.313 -9.573 1.00 . A A . 16 GLN CA 1 1 1 219 1 1 16 GLN CB C -2.672 6.940 -10.216 1.00 . A A . 16 GLN CB 1 1 1 220 1 1 16 GLN CD C -3.514 6.783 -12.588 1.00 . A A . 16 GLN CD 1 1 1 221 1 1 16 GLN CG C -2.307 7.078 -11.695 1.00 . A A . 16 GLN CG 1 1 1 222 1 1 16 GLN H H -0.907 8.974 -9.505 1.00 . A A . 16 GLN H 1 1 1 223 1 1 16 GLN HA H -3.776 8.772 -9.993 1.00 . A A . 16 GLN HA 1 1 1 224 1 1 16 GLN HB2 H -1.882 6.405 -9.690 1.00 . A A . 16 GLN HB2 1 1 1 225 1 1 16 GLN HB3 H -3.581 6.346 -10.116 1.00 . A A . 16 GLN HB3 1 1 1 226 1 1 16 GLN HE21 H -3.582 4.920 -11.800 1.00 . A A . 16 GLN HE21 1 1 1 227 1 1 16 GLN HE22 H -4.794 5.267 -12.988 1.00 . A A . 16 GLN HE22 1 1 1 228 1 1 16 GLN HG2 H -1.942 8.087 -11.891 1.00 . A A . 16 GLN HG2 1 1 1 229 1 1 16 GLN HG3 H -1.494 6.393 -11.938 1.00 . A A . 16 GLN HG3 1 1 1 230 1 1 16 GLN N N -1.791 9.215 -9.905 1.00 . A A . 16 GLN N 1 1 1 231 1 1 16 GLN NE2 N -4.004 5.555 -12.447 1.00 . A A . 16 GLN NE2 1 1 1 232 1 1 16 GLN O O -2.284 7.445 -7.415 1.00 . A A . 16 GLN O 1 1 1 233 1 1 16 GLN OE1 O -3.970 7.616 -13.354 1.00 . A A . 16 GLN OE1 1 1 1 234 1 1 17 PRO C C -4.976 7.653 -5.658 1.00 . A A . 17 PRO C 1 1 1 235 1 1 17 PRO CA C -4.259 8.938 -6.076 1.00 . A A . 17 PRO CA 1 1 1 236 1 1 17 PRO CB C -5.077 10.190 -5.806 1.00 . A A . 17 PRO CB 1 1 1 237 1 1 17 PRO CD C -4.905 9.849 -8.233 1.00 . A A . 17 PRO CD 1 1 1 238 1 1 17 PRO CG C -5.648 10.613 -7.149 1.00 . A A . 17 PRO CG 1 1 1 239 1 1 17 PRO HA H -3.395 8.945 -5.572 1.00 . A A . 17 PRO HA 1 1 1 240 1 1 17 PRO HB2 H -5.873 9.989 -5.089 1.00 . A A . 17 PRO HB2 1 1 1 241 1 1 17 PRO HB3 H -4.457 10.979 -5.380 1.00 . A A . 17 PRO HB3 1 1 1 242 1 1 17 PRO HD2 H -5.593 9.291 -8.868 1.00 . A A . 17 PRO HD2 1 1 1 243 1 1 17 PRO HD3 H -4.348 10.524 -8.883 1.00 . A A . 17 PRO HD3 1 1 1 244 1 1 17 PRO HG2 H -6.716 10.397 -7.195 1.00 . A A . 17 PRO HG2 1 1 1 245 1 1 17 PRO HG3 H -5.534 11.687 -7.292 1.00 . A A . 17 PRO HG3 1 1 1 246 1 1 17 PRO N N -4.008 8.954 -7.507 1.00 . A A . 17 PRO N 1 1 1 247 1 1 17 PRO O O -5.545 6.956 -6.497 1.00 . A A . 17 PRO O 1 1 1 248 1 1 18 VAL C C -6.164 6.514 -2.455 1.00 . A A . 18 VAL C 1 1 1 249 1 1 18 VAL CA C -5.564 6.190 -3.825 1.00 . A A . 18 VAL CA 1 1 1 250 1 1 18 VAL CB C -4.563 5.033 -3.781 1.00 . A A . 18 VAL CB 1 1 1 251 1 1 18 VAL CG1 C -5.166 3.813 -3.082 1.00 . A A . 18 VAL CG1 1 1 1 252 1 1 18 VAL CG2 C -4.077 4.676 -5.187 1.00 . A A . 18 VAL CG2 1 1 1 253 1 1 18 VAL H H -4.462 7.952 -3.688 1.00 . A A . 18 VAL H 1 1 1 254 1 1 18 VAL HA H -6.371 5.913 -4.504 1.00 . A A . 18 VAL HA 1 1 1 255 1 1 18 VAL HB H -3.700 5.359 -3.201 1.00 . A A . 18 VAL HB 1 1 1 256 1 1 18 VAL HG11 H -6.141 3.590 -3.517 1.00 . A A . 18 VAL HG11 1 1 1 257 1 1 18 VAL HG12 H -4.505 2.956 -3.214 1.00 . A A . 18 VAL HG12 1 1 1 258 1 1 18 VAL HG13 H -5.282 4.023 -2.019 1.00 . A A . 18 VAL HG13 1 1 1 259 1 1 18 VAL HG21 H -4.836 4.958 -5.917 1.00 . A A . 18 VAL HG21 1 1 1 260 1 1 18 VAL HG22 H -3.152 5.213 -5.399 1.00 . A A . 18 VAL HG22 1 1 1 261 1 1 18 VAL HG23 H -3.895 3.603 -5.247 1.00 . A A . 18 VAL HG23 1 1 1 262 1 1 18 VAL N N -4.926 7.379 -4.363 1.00 . A A . 18 VAL N 1 1 1 263 1 1 18 VAL O O -5.695 7.419 -1.766 1.00 . A A . 18 VAL O 1 1 1 264 1 1 19 VAL C C -7.778 4.661 -0.008 1.00 . A A . 19 VAL C 1 1 1 265 1 1 19 VAL CA C -7.860 5.952 -0.825 1.00 . A A . 19 VAL CA 1 1 1 266 1 1 19 VAL CB C -9.297 6.423 -1.055 1.00 . A A . 19 VAL CB 1 1 1 267 1 1 19 VAL CG1 C -10.111 6.352 0.239 1.00 . A A . 19 VAL CG1 1 1 1 268 1 1 19 VAL CG2 C -9.324 7.836 -1.641 1.00 . A A . 19 VAL CG2 1 1 1 269 1 1 19 VAL H H -7.566 5.022 -2.666 1.00 . A A . 19 VAL H 1 1 1 270 1 1 19 VAL HA H -7.328 6.739 -0.292 1.00 . A A . 19 VAL HA 1 1 1 271 1 1 19 VAL HB H -9.759 5.752 -1.778 1.00 . A A . 19 VAL HB 1 1 1 272 1 1 19 VAL HG11 H -9.535 6.786 1.056 1.00 . A A . 19 VAL HG11 1 1 1 273 1 1 19 VAL HG12 H -11.041 6.907 0.115 1.00 . A A . 19 VAL HG12 1 1 1 274 1 1 19 VAL HG13 H -10.338 5.310 0.468 1.00 . A A . 19 VAL HG13 1 1 1 275 1 1 19 VAL HG21 H -8.519 7.942 -2.369 1.00 . A A . 19 VAL HG21 1 1 1 276 1 1 19 VAL HG22 H -10.282 8.008 -2.132 1.00 . A A . 19 VAL HG22 1 1 1 277 1 1 19 VAL HG23 H -9.189 8.564 -0.842 1.00 . A A . 19 VAL HG23 1 1 1 278 1 1 19 VAL N N -7.191 5.756 -2.100 1.00 . A A . 19 VAL N 1 1 1 279 1 1 19 VAL O O -8.351 3.642 -0.390 1.00 . A A . 19 VAL O 1 1 1 280 1 1 20 PHE C C -7.833 3.686 3.182 1.00 . A A . 20 PHE C 1 1 1 281 1 1 20 PHE CA C -6.895 3.597 1.977 1.00 . A A . 20 PHE CA 1 1 1 282 1 1 20 PHE CB C -5.447 3.646 2.468 1.00 . A A . 20 PHE CB 1 1 1 283 1 1 20 PHE CD1 C -4.846 1.202 2.621 1.00 . A A . 20 PHE CD1 1 1 1 284 1 1 20 PHE CD2 C -4.802 2.507 4.623 1.00 . A A . 20 PHE CD2 1 1 1 285 1 1 20 PHE CE1 C -4.442 0.040 3.370 1.00 . A A . 20 PHE CE1 1 1 1 286 1 1 20 PHE CE2 C -4.398 1.345 5.372 1.00 . A A . 20 PHE CE2 1 1 1 287 1 1 20 PHE CG C -5.017 2.411 3.264 1.00 . A A . 20 PHE CG 1 1 1 288 1 1 20 PHE CZ C -4.238 0.169 4.708 1.00 . A A . 20 PHE CZ 1 1 1 289 1 1 20 PHE H H -6.597 5.578 1.407 1.00 . A A . 20 PHE H 1 1 1 290 1 1 20 PHE HA H -7.135 2.701 1.404 1.00 . A A . 20 PHE HA 1 1 1 291 1 1 20 PHE HB2 H -4.786 3.760 1.609 1.00 . A A . 20 PHE HB2 1 1 1 292 1 1 20 PHE HB3 H -5.315 4.531 3.091 1.00 . A A . 20 PHE HB3 1 1 1 293 1 1 20 PHE HD1 H -5.017 1.127 1.547 1.00 . A A . 20 PHE HD1 1 1 1 294 1 1 20 PHE HD2 H -4.937 3.462 5.131 1.00 . A A . 20 PHE HD2 1 1 1 295 1 1 20 PHE HE1 H -4.303 -0.921 2.875 1.00 . A A . 20 PHE HE1 1 1 1 296 1 1 20 PHE HE2 H -4.224 1.407 6.446 1.00 . A A . 20 PHE HE2 1 1 1 297 1 1 20 PHE HZ H -3.945 -0.678 5.379 1.00 . A A . 20 PHE HZ 1 1 1 298 1 1 20 PHE N N -7.060 4.746 1.103 1.00 . A A . 20 PHE N 1 1 1 299 1 1 20 PHE O O -8.389 4.747 3.464 1.00 . A A . 20 PHE O 1 1 1 300 1 1 21 ASN C C -8.233 1.539 6.056 1.00 . A A . 21 ASN C 1 1 1 301 1 1 21 ASN CA C -8.843 2.495 5.029 1.00 . A A . 21 ASN CA 1 1 1 302 1 1 21 ASN CB C -10.232 1.969 4.661 1.00 . A A . 21 ASN CB 1 1 1 303 1 1 21 ASN CG C -10.984 2.974 3.785 1.00 . A A . 21 ASN CG 1 1 1 304 1 1 21 ASN H H -7.525 1.699 3.625 1.00 . A A . 21 ASN H 1 1 1 305 1 1 21 ASN HA H -8.903 3.519 5.396 1.00 . A A . 21 ASN HA 1 1 1 306 1 1 21 ASN HB2 H -10.138 1.020 4.133 1.00 . A A . 21 ASN HB2 1 1 1 307 1 1 21 ASN HB3 H -10.803 1.774 5.568 1.00 . A A . 21 ASN HB3 1 1 1 308 1 1 21 ASN HD21 H -9.985 2.249 2.179 1.00 . A A . 21 ASN HD21 1 1 1 309 1 1 21 ASN HD22 H -11.102 3.529 1.842 1.00 . A A . 21 ASN HD22 1 1 1 310 1 1 21 ASN N N -7.981 2.558 3.861 1.00 . A A . 21 ASN N 1 1 1 311 1 1 21 ASN ND2 N -10.664 2.912 2.495 1.00 . A A . 21 ASN ND2 1 1 1 312 1 1 21 ASN O O -7.727 0.477 5.698 1.00 . A A . 21 ASN O 1 1 1 313 1 1 21 ASN OD1 O -11.800 3.753 4.249 1.00 . A A . 21 ASN OD1 1 1 1 314 1 1 22 HIS C C -8.871 0.272 8.987 1.00 . A A . 22 HIS C 1 1 1 315 1 1 22 HIS CA C -7.762 1.145 8.396 1.00 . A A . 22 HIS CA 1 1 1 316 1 1 22 HIS CB C -7.081 2.028 9.443 1.00 . A A . 22 HIS CB 1 1 1 317 1 1 22 HIS CD2 C -4.477 1.829 9.331 1.00 . A A . 22 HIS CD2 1 1 1 318 1 1 22 HIS CE1 C -4.071 3.667 8.217 1.00 . A A . 22 HIS CE1 1 1 1 319 1 1 22 HIS CG C -5.672 2.435 9.080 1.00 . A A . 22 HIS CG 1 1 1 320 1 1 22 HIS H H -8.716 2.816 7.597 1.00 . A A . 22 HIS H 1 1 1 321 1 1 22 HIS HA H -7.000 0.502 7.956 1.00 . A A . 22 HIS HA 1 1 1 322 1 1 22 HIS HB2 H -7.680 2.925 9.593 1.00 . A A . 22 HIS HB2 1 1 1 323 1 1 22 HIS HB3 H -7.060 1.496 10.394 1.00 . A A . 22 HIS HB3 1 1 1 324 1 1 22 HIS HD1 H -6.053 4.257 8.046 1.00 . A A . 22 HIS HD1 1 1 1 325 1 1 22 HIS HD2 H -4.338 0.891 9.870 1.00 . A A . 22 HIS HD2 1 1 1 326 1 1 22 HIS HE1 H -3.533 4.464 7.703 1.00 . A A . 22 HIS HE1 1 1 1 327 1 1 22 HIS N N -8.302 1.951 7.314 1.00 . A A . 22 HIS N 1 1 1 328 1 1 22 HIS ND1 N -5.384 3.592 8.377 1.00 . A A . 22 HIS ND1 1 1 1 329 1 1 22 HIS NE2 N -3.510 2.574 8.808 1.00 . A A . 22 HIS NE2 1 1 1 330 1 1 22 HIS O O -8.593 -0.733 9.640 1.00 . A A . 22 HIS O 1 1 1 331 1 1 23 SER C C -11.496 -1.290 8.382 1.00 . A A . 23 SER C 1 1 1 332 1 1 23 SER CA C -11.255 -0.044 9.238 1.00 . A A . 23 SER CA 1 1 1 333 1 1 23 SER CB C -12.505 0.839 9.252 1.00 . A A . 23 SER CB 1 1 1 334 1 1 23 SER H H -10.321 1.505 8.205 1.00 . A A . 23 SER H 1 1 1 335 1 1 23 SER HA H -10.998 -0.325 10.259 1.00 . A A . 23 SER HA 1 1 1 336 1 1 23 SER HB2 H -12.450 1.530 10.093 1.00 . A A . 23 SER HB2 1 1 1 337 1 1 23 SER HB3 H -12.533 1.442 8.345 1.00 . A A . 23 SER HB3 1 1 1 338 1 1 23 SER HG H -14.255 0.394 10.115 1.00 . A A . 23 SER HG 1 1 1 339 1 1 23 SER N N -10.104 0.687 8.738 1.00 . A A . 23 SER N 1 1 1 340 1 1 23 SER O O -12.392 -2.081 8.670 1.00 . A A . 23 SER O 1 1 1 341 1 1 23 SER OG O -13.701 0.070 9.348 1.00 . A A . 23 SER OG 1 1 1 342 1 1 24 THR C C -9.663 -3.559 6.706 1.00 . A A . 24 THR C 1 1 1 343 1 1 24 THR CA C -10.792 -2.560 6.448 1.00 . A A . 24 THR CA 1 1 1 344 1 1 24 THR CB C -10.817 -2.027 5.014 1.00 . A A . 24 THR CB 1 1 1 345 1 1 24 THR CG2 C -10.913 -3.146 3.975 1.00 . A A . 24 THR CG2 1 1 1 346 1 1 24 THR H H -9.953 -0.777 7.120 1.00 . A A . 24 THR H 1 1 1 347 1 1 24 THR HA H -11.729 -3.075 6.661 1.00 . A A . 24 THR HA 1 1 1 348 1 1 24 THR HB H -9.954 -1.390 4.821 1.00 . A A . 24 THR HB 1 1 1 349 1 1 24 THR HG1 H -12.811 -1.970 5.178 1.00 . A A . 24 THR HG1 1 1 1 350 1 1 24 THR HG21 H -10.766 -4.109 4.463 1.00 . A A . 24 THR HG21 1 1 1 351 1 1 24 THR HG22 H -11.897 -3.123 3.506 1.00 . A A . 24 THR HG22 1 1 1 352 1 1 24 THR HG23 H -10.145 -3.003 3.215 1.00 . A A . 24 THR HG23 1 1 1 353 1 1 24 THR N N -10.679 -1.425 7.347 1.00 . A A . 24 THR N 1 1 1 354 1 1 24 THR O O -9.859 -4.768 6.586 1.00 . A A . 24 THR O 1 1 1 355 1 1 24 THR OG1 O -12.068 -1.353 4.915 1.00 . A A . 24 THR OG1 1 1 1 356 1 1 25 HIS C C -7.185 -4.023 8.841 1.00 . A A . 25 HIS C 1 1 1 357 1 1 25 HIS CA C -7.344 -3.846 7.330 1.00 . A A . 25 HIS CA 1 1 1 358 1 1 25 HIS CB C -6.093 -3.266 6.666 1.00 . A A . 25 HIS CB 1 1 1 359 1 1 25 HIS CD2 C -5.735 -3.845 4.142 1.00 . A A . 25 HIS CD2 1 1 1 360 1 1 25 HIS CE1 C -6.828 -2.158 3.278 1.00 . A A . 25 HIS CE1 1 1 1 361 1 1 25 HIS CG C -6.216 -3.090 5.172 1.00 . A A . 25 HIS CG 1 1 1 362 1 1 25 HIS H H -8.354 -2.034 7.149 1.00 . A A . 25 HIS H 1 1 1 363 1 1 25 HIS HA H -7.539 -4.819 6.877 1.00 . A A . 25 HIS HA 1 1 1 364 1 1 25 HIS HB2 H -5.869 -2.300 7.119 1.00 . A A . 25 HIS HB2 1 1 1 365 1 1 25 HIS HB3 H -5.246 -3.920 6.876 1.00 . A A . 25 HIS HB3 1 1 1 366 1 1 25 HIS HD1 H -7.368 -1.301 5.089 1.00 . A A . 25 HIS HD1 1 1 1 367 1 1 25 HIS HD2 H -5.146 -4.757 4.242 1.00 . A A . 25 HIS HD2 1 1 1 368 1 1 25 HIS HE1 H -7.268 -1.481 2.546 1.00 . A A . 25 HIS HE1 1 1 1 369 1 1 25 HIS N N -8.505 -3.018 7.054 1.00 . A A . 25 HIS N 1 1 1 370 1 1 25 HIS ND1 N -6.900 -2.034 4.595 1.00 . A A . 25 HIS ND1 1 1 1 371 1 1 25 HIS NE2 N -6.107 -3.282 2.999 1.00 . A A . 25 HIS NE2 1 1 1 372 1 1 25 HIS O O -6.067 -4.093 9.348 1.00 . A A . 25 HIS O 1 1 1 373 1 1 26 LYS C C -7.791 -5.646 11.312 1.00 . A A . 26 LYS C 1 1 1 374 1 1 26 LYS CA C -8.324 -4.255 10.962 1.00 . A A . 26 LYS CA 1 1 1 375 1 1 26 LYS CB C -9.714 -3.969 11.533 1.00 . A A . 26 LYS CB 1 1 1 376 1 1 26 LYS CD C -11.628 -2.328 11.618 1.00 . A A . 26 LYS CD 1 1 1 377 1 1 26 LYS CE C -11.562 -1.460 12.875 1.00 . A A . 26 LYS CE 1 1 1 378 1 1 26 LYS CG C -10.227 -2.604 11.068 1.00 . A A . 26 LYS CG 1 1 1 379 1 1 26 LYS H H -9.228 -4.031 9.099 1.00 . A A . 26 LYS H 1 1 1 380 1 1 26 LYS HA H -7.645 -3.511 11.378 1.00 . A A . 26 LYS HA 1 1 1 381 1 1 26 LYS HB2 H -10.408 -4.748 11.219 1.00 . A A . 26 LYS HB2 1 1 1 382 1 1 26 LYS HB3 H -9.677 -3.995 12.622 1.00 . A A . 26 LYS HB3 1 1 1 383 1 1 26 LYS HD2 H -12.229 -1.829 10.858 1.00 . A A . 26 LYS HD2 1 1 1 384 1 1 26 LYS HD3 H -12.124 -3.271 11.848 1.00 . A A . 26 LYS HD3 1 1 1 385 1 1 26 LYS HE2 H -10.542 -1.444 13.260 1.00 . A A . 26 LYS HE2 1 1 1 386 1 1 26 LYS HE3 H -11.826 -0.431 12.629 1.00 . A A . 26 LYS HE3 1 1 1 387 1 1 26 LYS HG2 H -9.542 -1.823 11.398 1.00 . A A . 26 LYS HG2 1 1 1 388 1 1 26 LYS HG3 H -10.247 -2.571 9.979 1.00 . A A . 26 LYS HG3 1 1 1 389 1 1 26 LYS HZ1 H -13.450 -1.753 13.708 1.00 . A A . 26 LYS HZ1 1 1 1 390 1 1 26 LYS HZ2 H -12.427 -2.987 13.998 1.00 . A A . 26 LYS HZ2 1 1 1 391 1 1 26 LYS N N -8.322 -4.089 9.519 1.00 . A A . 26 LYS N 1 1 1 392 1 1 26 LYS NZ N -12.482 -1.979 13.912 1.00 . A A . 26 LYS NZ 1 1 1 393 1 1 26 LYS O O -7.102 -5.817 12.317 1.00 . A A . 26 LYS O 1 1 1 394 1 1 27 SER C C -6.221 -8.122 10.277 1.00 . A A . 27 SER C 1 1 1 395 1 1 27 SER CA C -7.693 -7.976 10.669 1.00 . A A . 27 SER CA 1 1 1 396 1 1 27 SER CB C -8.555 -8.955 9.869 1.00 . A A . 27 SER CB 1 1 1 397 1 1 27 SER H H -8.689 -6.458 9.647 1.00 . A A . 27 SER H 1 1 1 398 1 1 27 SER HA H -7.826 -8.163 11.735 1.00 . A A . 27 SER HA 1 1 1 399 1 1 27 SER HB2 H -8.379 -9.969 10.227 1.00 . A A . 27 SER HB2 1 1 1 400 1 1 27 SER HB3 H -9.609 -8.734 10.041 1.00 . A A . 27 SER HB3 1 1 1 401 1 1 27 SER HG H -9.135 -8.856 7.956 1.00 . A A . 27 SER HG 1 1 1 402 1 1 27 SER N N -8.129 -6.605 10.462 1.00 . A A . 27 SER N 1 1 1 403 1 1 27 SER O O -5.594 -9.138 10.573 1.00 . A A . 27 SER O 1 1 1 404 1 1 27 SER OG O -8.279 -8.890 8.472 1.00 . A A . 27 SER OG 1 1 1 405 1 1 28 VAL C C -3.447 -6.514 10.291 1.00 . A A . 28 VAL C 1 1 1 406 1 1 28 VAL CA C -4.327 -7.093 9.181 1.00 . A A . 28 VAL CA 1 1 1 407 1 1 28 VAL CB C -4.194 -6.337 7.857 1.00 . A A . 28 VAL CB 1 1 1 408 1 1 28 VAL CG1 C -2.781 -6.475 7.286 1.00 . A A . 28 VAL CG1 1 1 1 409 1 1 28 VAL CG2 C -5.242 -6.810 6.848 1.00 . A A . 28 VAL CG2 1 1 1 410 1 1 28 VAL H H -6.230 -6.269 9.380 1.00 . A A . 28 VAL H 1 1 1 411 1 1 28 VAL HA H -4.037 -8.129 9.008 1.00 . A A . 28 VAL HA 1 1 1 412 1 1 28 VAL HB H -4.374 -5.280 8.056 1.00 . A A . 28 VAL HB 1 1 1 413 1 1 28 VAL HG11 H -2.449 -7.508 7.384 1.00 . A A . 28 VAL HG11 1 1 1 414 1 1 28 VAL HG12 H -2.786 -6.193 6.234 1.00 . A A . 28 VAL HG12 1 1 1 415 1 1 28 VAL HG13 H -2.103 -5.821 7.835 1.00 . A A . 28 VAL HG13 1 1 1 416 1 1 28 VAL HG21 H -5.827 -7.620 7.284 1.00 . A A . 28 VAL HG21 1 1 1 417 1 1 28 VAL HG22 H -5.903 -5.981 6.594 1.00 . A A . 28 VAL HG22 1 1 1 418 1 1 28 VAL HG23 H -4.743 -7.167 5.946 1.00 . A A . 28 VAL HG23 1 1 1 419 1 1 28 VAL N N -5.713 -7.092 9.617 1.00 . A A . 28 VAL N 1 1 1 420 1 1 28 VAL O O -3.851 -5.583 10.986 1.00 . A A . 28 VAL O 1 1 1 421 1 1 29 LYS C C -0.711 -5.308 11.007 1.00 . A A . 29 LYS C 1 1 1 422 1 1 29 LYS CA C -1.321 -6.643 11.437 1.00 . A A . 29 LYS CA 1 1 1 423 1 1 29 LYS CB C -0.283 -7.731 11.721 1.00 . A A . 29 LYS CB 1 1 1 424 1 1 29 LYS CD C 0.668 -7.826 14.054 1.00 . A A . 29 LYS CD 1 1 1 425 1 1 29 LYS CE C 0.238 -6.597 14.858 1.00 . A A . 29 LYS CE 1 1 1 426 1 1 29 LYS CG C -0.456 -8.299 13.131 1.00 . A A . 29 LYS CG 1 1 1 427 1 1 29 LYS H H -1.941 -7.847 9.853 1.00 . A A . 29 LYS H 1 1 1 428 1 1 29 LYS HA H -1.884 -6.486 12.357 1.00 . A A . 29 LYS HA 1 1 1 429 1 1 29 LYS HB2 H -0.380 -8.532 10.988 1.00 . A A . 29 LYS HB2 1 1 1 430 1 1 29 LYS HB3 H 0.720 -7.319 11.612 1.00 . A A . 29 LYS HB3 1 1 1 431 1 1 29 LYS HD2 H 0.947 -8.630 14.735 1.00 . A A . 29 LYS HD2 1 1 1 432 1 1 29 LYS HD3 H 1.553 -7.587 13.464 1.00 . A A . 29 LYS HD3 1 1 1 433 1 1 29 LYS HE2 H -0.270 -5.888 14.205 1.00 . A A . 29 LYS HE2 1 1 1 434 1 1 29 LYS HE3 H -0.476 -6.890 15.627 1.00 . A A . 29 LYS HE3 1 1 1 435 1 1 29 LYS HG2 H -1.419 -7.988 13.536 1.00 . A A . 29 LYS HG2 1 1 1 436 1 1 29 LYS HG3 H -0.464 -9.388 13.090 1.00 . A A . 29 LYS HG3 1 1 1 437 1 1 29 LYS HZ1 H 2.221 -6.561 15.497 1.00 . A A . 29 LYS HZ1 1 1 1 438 1 1 29 LYS HZ2 H 1.689 -5.108 14.992 1.00 . A A . 29 LYS HZ2 1 1 1 439 1 1 29 LYS N N -2.261 -7.090 10.423 1.00 . A A . 29 LYS N 1 1 1 440 1 1 29 LYS NZ N 1.413 -5.950 15.484 1.00 . A A . 29 LYS NZ 1 1 1 441 1 1 29 LYS O O -0.363 -5.127 9.841 1.00 . A A . 29 LYS O 1 1 1 442 1 1 30 CYS C C 1.394 -3.276 11.200 1.00 . A A . 30 CYS C 1 1 1 443 1 1 30 CYS CA C -0.038 -3.093 11.708 1.00 . A A . 30 CYS CA 1 1 1 444 1 1 30 CYS CB C -0.094 -2.195 12.946 1.00 . A A . 30 CYS CB 1 1 1 445 1 1 30 CYS H H -0.885 -4.562 12.918 1.00 . A A . 30 CYS H 1 1 1 446 1 1 30 CYS HA H -0.664 -2.632 10.944 1.00 . A A . 30 CYS HA 1 1 1 447 1 1 30 CYS HB2 H 0.753 -2.434 13.589 1.00 . A A . 30 CYS HB2 1 1 1 448 1 1 30 CYS HB3 H 0.027 -1.159 12.631 1.00 . A A . 30 CYS HB3 1 1 1 449 1 1 30 CYS N N -0.600 -4.407 11.972 1.00 . A A . 30 CYS N 1 1 1 450 1 1 30 CYS O O 1.868 -2.495 10.377 1.00 . A A . 30 CYS O 1 1 1 451 1 1 30 CYS SG S -1.632 -2.334 13.927 1.00 . A A . 30 CYS SG 1 1 1 452 1 1 31 GLY C C 3.457 -5.242 9.930 1.00 . A A . 31 GLY C 1 1 1 453 1 1 31 GLY CA C 3.409 -4.607 11.321 1.00 . A A . 31 GLY CA 1 1 1 454 1 1 31 GLY H H 1.648 -4.943 12.381 1.00 . A A . 31 GLY H 1 1 1 455 1 1 31 GLY HA2 H 3.999 -3.691 11.326 1.00 . A A . 31 GLY HA2 1 1 1 456 1 1 31 GLY HA3 H 3.862 -5.282 12.048 1.00 . A A . 31 GLY HA3 1 1 1 457 1 1 31 GLY N N 2.042 -4.312 11.712 1.00 . A A . 31 GLY N 1 1 1 458 1 1 31 GLY O O 4.535 -5.492 9.394 1.00 . A A . 31 GLY O 1 1 1 459 1 1 32 ASP C C 2.386 -5.012 7.000 1.00 . A A . 32 ASP C 1 1 1 460 1 1 32 ASP CA C 2.167 -6.087 8.066 1.00 . A A . 32 ASP CA 1 1 1 461 1 1 32 ASP CB C 0.778 -6.692 7.848 1.00 . A A . 32 ASP CB 1 1 1 462 1 1 32 ASP CG C 0.630 -7.528 6.576 1.00 . A A . 32 ASP CG 1 1 1 463 1 1 32 ASP H H 1.401 -5.279 9.827 1.00 . A A . 32 ASP H 1 1 1 464 1 1 32 ASP HA H 2.933 -6.862 8.042 1.00 . A A . 32 ASP HA 1 1 1 465 1 1 32 ASP HB2 H 0.532 -7.318 8.707 1.00 . A A . 32 ASP HB2 1 1 1 466 1 1 32 ASP HB3 H 0.047 -5.885 7.822 1.00 . A A . 32 ASP HB3 1 1 1 467 1 1 32 ASP N N 2.274 -5.486 9.385 1.00 . A A . 32 ASP N 1 1 1 468 1 1 32 ASP O O 2.936 -5.291 5.936 1.00 . A A . 32 ASP O 1 1 1 469 1 1 32 ASP OD1 O 1.032 -7.015 5.509 1.00 . A A . 32 ASP OD1 1 1 1 470 1 1 32 ASP OD2 O 0.118 -8.662 6.698 1.00 . A A . 32 ASP OD2 1 1 1 471 1 1 33 CYS C C 3.207 -1.781 6.923 1.00 . A A . 33 CYS C 1 1 1 472 1 1 33 CYS CA C 2.087 -2.686 6.407 1.00 . A A . 33 CYS CA 1 1 1 473 1 1 33 CYS CB C 0.771 -1.925 6.236 1.00 . A A . 33 CYS CB 1 1 1 474 1 1 33 CYS H H 1.500 -3.586 8.192 1.00 . A A . 33 CYS H 1 1 1 475 1 1 33 CYS HA H 2.346 -3.108 5.436 1.00 . A A . 33 CYS HA 1 1 1 476 1 1 33 CYS HB2 H 0.194 -1.967 7.161 1.00 . A A . 33 CYS HB2 1 1 1 477 1 1 33 CYS HB3 H 0.973 -0.873 6.034 1.00 . A A . 33 CYS HB3 1 1 1 478 1 1 33 CYS N N 1.946 -3.805 7.324 1.00 . A A . 33 CYS N 1 1 1 479 1 1 33 CYS O O 4.159 -1.492 6.200 1.00 . A A . 33 CYS O 1 1 1 480 1 1 33 CYS SG S -0.199 -2.650 4.864 1.00 . A A . 33 CYS SG 1 1 1 481 1 1 34 HIS C C 5.269 -1.313 9.190 1.00 . A A . 34 HIS C 1 1 1 482 1 1 34 HIS CA C 4.043 -0.491 8.790 1.00 . A A . 34 HIS CA 1 1 1 483 1 1 34 HIS CB C 3.432 0.273 9.966 1.00 . A A . 34 HIS CB 1 1 1 484 1 1 34 HIS CD2 C 0.923 0.939 9.657 1.00 . A A . 34 HIS CD2 1 1 1 485 1 1 34 HIS CE1 C 1.232 2.943 8.836 1.00 . A A . 34 HIS CE1 1 1 1 486 1 1 34 HIS CG C 2.268 1.157 9.586 1.00 . A A . 34 HIS CG 1 1 1 487 1 1 34 HIS H H 2.279 -1.597 8.751 1.00 . A A . 34 HIS H 1 1 1 488 1 1 34 HIS HA H 4.336 0.239 8.036 1.00 . A A . 34 HIS HA 1 1 1 489 1 1 34 HIS HB2 H 3.101 -0.443 10.719 1.00 . A A . 34 HIS HB2 1 1 1 490 1 1 34 HIS HB3 H 4.205 0.887 10.428 1.00 . A A . 34 HIS HB3 1 1 1 491 1 1 34 HIS HD1 H 3.305 2.881 8.890 1.00 . A A . 34 HIS HD1 1 1 1 492 1 1 34 HIS HD2 H 0.443 0.031 10.023 1.00 . A A . 34 HIS HD2 1 1 1 493 1 1 34 HIS HE1 H 1.027 3.932 8.426 1.00 . A A . 34 HIS HE1 1 1 1 494 1 1 34 HIS N N 3.056 -1.358 8.169 1.00 . A A . 34 HIS N 1 1 1 495 1 1 34 HIS ND1 N 2.431 2.428 9.065 1.00 . A A . 34 HIS ND1 1 1 1 496 1 1 34 HIS NE2 N 0.299 2.019 9.204 1.00 . A A . 34 HIS NE2 1 1 1 497 1 1 34 HIS O O 5.660 -1.325 10.356 1.00 . A A . 34 HIS O 1 1 1 498 1 1 35 HIS C C 7.978 -2.074 9.373 1.00 . A A . 35 HIS C 1 1 1 499 1 1 35 HIS CA C 7.016 -2.806 8.434 1.00 . A A . 35 HIS CA 1 1 1 500 1 1 35 HIS CB C 7.670 -3.208 7.111 1.00 . A A . 35 HIS CB 1 1 1 501 1 1 35 HIS CD2 C 7.814 -1.439 5.193 1.00 . A A . 35 HIS CD2 1 1 1 502 1 1 35 HIS CE1 C 9.646 -0.430 5.836 1.00 . A A . 35 HIS CE1 1 1 1 503 1 1 35 HIS CG C 8.246 -2.049 6.333 1.00 . A A . 35 HIS CG 1 1 1 504 1 1 35 HIS H H 5.518 -1.967 7.254 1.00 . A A . 35 HIS H 1 1 1 505 1 1 35 HIS HA H 6.668 -3.716 8.923 1.00 . A A . 35 HIS HA 1 1 1 506 1 1 35 HIS HB2 H 8.465 -3.927 7.314 1.00 . A A . 35 HIS HB2 1 1 1 507 1 1 35 HIS HB3 H 6.931 -3.717 6.492 1.00 . A A . 35 HIS HB3 1 1 1 508 1 1 35 HIS HD1 H 9.961 -1.606 7.516 1.00 . A A . 35 HIS HD1 1 1 1 509 1 1 35 HIS HD2 H 6.924 -1.709 4.623 1.00 . A A . 35 HIS HD2 1 1 1 510 1 1 35 HIS HE1 H 10.486 0.264 5.861 1.00 . A A . 35 HIS HE1 1 1 1 511 1 1 35 HIS N N 5.843 -1.982 8.200 1.00 . A A . 35 HIS N 1 1 1 512 1 1 35 HIS ND1 N 9.403 -1.392 6.714 1.00 . A A . 35 HIS ND1 1 1 1 513 1 1 35 HIS NE2 N 8.660 -0.460 4.894 1.00 . A A . 35 HIS NE2 1 1 1 514 1 1 35 HIS O O 8.045 -0.846 9.364 1.00 . A A . 35 HIS O 1 1 1 515 1 1 36 PRO C C 10.930 -1.831 10.403 1.00 . A A . 36 PRO C 1 1 1 516 1 1 36 PRO CA C 9.672 -2.322 11.123 1.00 . A A . 36 PRO CA 1 1 1 517 1 1 36 PRO CB C 9.952 -3.444 12.110 1.00 . A A . 36 PRO CB 1 1 1 518 1 1 36 PRO CD C 8.664 -4.339 10.218 1.00 . A A . 36 PRO CD 1 1 1 519 1 1 36 PRO CG C 9.508 -4.725 11.422 1.00 . A A . 36 PRO CG 1 1 1 520 1 1 36 PRO HA H 9.285 -1.519 11.575 1.00 . A A . 36 PRO HA 1 1 1 521 1 1 36 PRO HB2 H 11.011 -3.484 12.365 1.00 . A A . 36 PRO HB2 1 1 1 522 1 1 36 PRO HB3 H 9.406 -3.290 13.041 1.00 . A A . 36 PRO HB3 1 1 1 523 1 1 36 PRO HD2 H 9.062 -4.773 9.301 1.00 . A A . 36 PRO HD2 1 1 1 524 1 1 36 PRO HD3 H 7.640 -4.695 10.322 1.00 . A A . 36 PRO HD3 1 1 1 525 1 1 36 PRO HG2 H 10.372 -5.311 11.111 1.00 . A A . 36 PRO HG2 1 1 1 526 1 1 36 PRO HG3 H 8.932 -5.346 12.108 1.00 . A A . 36 PRO HG3 1 1 1 527 1 1 36 PRO N N 8.717 -2.880 10.181 1.00 . A A . 36 PRO N 1 1 1 528 1 1 36 PRO O O 11.465 -2.523 9.538 1.00 . A A . 36 PRO O 1 1 1 529 1 1 37 VAL C C 13.550 0.309 11.292 1.00 . A A . 37 VAL C 1 1 1 530 1 1 37 VAL CA C 12.551 -0.049 10.189 1.00 . A A . 37 VAL CA 1 1 1 531 1 1 37 VAL CB C 12.158 1.151 9.326 1.00 . A A . 37 VAL CB 1 1 1 532 1 1 37 VAL CG1 C 13.397 1.893 8.822 1.00 . A A . 37 VAL CG1 1 1 1 533 1 1 37 VAL CG2 C 11.265 0.720 8.161 1.00 . A A . 37 VAL CG2 1 1 1 534 1 1 37 VAL H H 10.926 -0.084 11.492 1.00 . A A . 37 VAL H 1 1 1 535 1 1 37 VAL HA H 13.001 -0.799 9.539 1.00 . A A . 37 VAL HA 1 1 1 536 1 1 37 VAL HB H 11.586 1.839 9.949 1.00 . A A . 37 VAL HB 1 1 1 537 1 1 37 VAL HG11 H 13.993 2.225 9.672 1.00 . A A . 37 VAL HG11 1 1 1 538 1 1 37 VAL HG12 H 13.992 1.225 8.199 1.00 . A A . 37 VAL HG12 1 1 1 539 1 1 37 VAL HG13 H 13.089 2.759 8.234 1.00 . A A . 37 VAL HG13 1 1 1 540 1 1 37 VAL HG21 H 10.431 0.130 8.542 1.00 . A A . 37 VAL HG21 1 1 1 541 1 1 37 VAL HG22 H 10.882 1.603 7.650 1.00 . A A . 37 VAL HG22 1 1 1 542 1 1 37 VAL HG23 H 11.845 0.119 7.462 1.00 . A A . 37 VAL HG23 1 1 1 543 1 1 37 VAL N N 11.367 -0.641 10.787 1.00 . A A . 37 VAL N 1 1 1 544 1 1 37 VAL O O 13.277 1.173 12.124 1.00 . A A . 37 VAL O 1 1 1 545 1 1 38 ASN C C 15.402 -0.924 13.522 1.00 . A A . 38 ASN C 1 1 1 546 1 1 38 ASN CA C 15.725 -0.138 12.250 1.00 . A A . 38 ASN CA 1 1 1 547 1 1 38 ASN CB C 15.809 1.344 12.618 1.00 . A A . 38 ASN CB 1 1 1 548 1 1 38 ASN CG C 17.263 1.779 12.815 1.00 . A A . 38 ASN CG 1 1 1 549 1 1 38 ASN H H 14.899 -1.074 10.582 1.00 . A A . 38 ASN H 1 1 1 550 1 1 38 ASN HA H 16.649 -0.471 11.777 1.00 . A A . 38 ASN HA 1 1 1 551 1 1 38 ASN HB2 H 15.350 1.945 11.833 1.00 . A A . 38 ASN HB2 1 1 1 552 1 1 38 ASN HB3 H 15.244 1.528 13.532 1.00 . A A . 38 ASN HB3 1 1 1 553 1 1 38 ASN HD21 H 16.896 3.380 11.633 1.00 . A A . 38 ASN HD21 1 1 1 554 1 1 38 ASN HD22 H 18.512 3.267 12.246 1.00 . A A . 38 ASN HD22 1 1 1 555 1 1 38 ASN N N 14.685 -0.373 11.263 1.00 . A A . 38 ASN N 1 1 1 556 1 1 38 ASN ND2 N 17.583 2.902 12.179 1.00 . A A . 38 ASN ND2 1 1 1 557 1 1 38 ASN O O 16.163 -0.889 14.488 1.00 . A A . 38 ASN O 1 1 1 558 1 1 38 ASN OD1 O 18.043 1.137 13.500 1.00 . A A . 38 ASN OD1 1 1 1 559 1 1 39 GLY C C 12.777 -1.664 15.433 1.00 . A A . 39 GLY C 1 1 1 560 1 1 39 GLY CA C 13.838 -2.408 14.619 1.00 . A A . 39 GLY CA 1 1 1 561 1 1 39 GLY H H 13.659 -1.638 12.692 1.00 . A A . 39 GLY H 1 1 1 562 1 1 39 GLY HA2 H 13.435 -3.359 14.272 1.00 . A A . 39 GLY HA2 1 1 1 563 1 1 39 GLY HA3 H 14.694 -2.637 15.254 1.00 . A A . 39 GLY HA3 1 1 1 564 1 1 39 GLY N N 14.272 -1.615 13.481 1.00 . A A . 39 GLY N 1 1 1 565 1 1 39 GLY O O 12.294 -2.175 16.443 1.00 . A A . 39 GLY O 1 1 1 566 1 1 40 LYS C C 10.159 0.347 14.817 1.00 . A A . 40 LYS C 1 1 1 567 1 1 40 LYS CA C 11.451 0.348 15.635 1.00 . A A . 40 LYS CA 1 1 1 568 1 1 40 LYS CB C 12.005 1.748 15.909 1.00 . A A . 40 LYS CB 1 1 1 569 1 1 40 LYS CD C 13.006 3.680 14.633 1.00 . A A . 40 LYS CD 1 1 1 570 1 1 40 LYS CE C 12.480 5.030 14.142 1.00 . A A . 40 LYS CE 1 1 1 571 1 1 40 LYS CG C 11.888 2.636 14.668 1.00 . A A . 40 LYS CG 1 1 1 572 1 1 40 LYS H H 12.844 -0.063 14.142 1.00 . A A . 40 LYS H 1 1 1 573 1 1 40 LYS HA H 11.248 -0.112 16.602 1.00 . A A . 40 LYS HA 1 1 1 574 1 1 40 LYS HB2 H 11.464 2.203 16.738 1.00 . A A . 40 LYS HB2 1 1 1 575 1 1 40 LYS HB3 H 13.050 1.677 16.212 1.00 . A A . 40 LYS HB3 1 1 1 576 1 1 40 LYS HD2 H 13.434 3.793 15.629 1.00 . A A . 40 LYS HD2 1 1 1 577 1 1 40 LYS HD3 H 13.807 3.338 13.979 1.00 . A A . 40 LYS HD3 1 1 1 578 1 1 40 LYS HE2 H 13.204 5.485 13.467 1.00 . A A . 40 LYS HE2 1 1 1 579 1 1 40 LYS HE3 H 11.561 4.884 13.573 1.00 . A A . 40 LYS HE3 1 1 1 580 1 1 40 LYS HG2 H 11.933 2.020 13.770 1.00 . A A . 40 LYS HG2 1 1 1 581 1 1 40 LYS HG3 H 10.919 3.135 14.664 1.00 . A A . 40 LYS HG3 1 1 1 582 1 1 40 LYS HZ1 H 12.906 6.681 15.340 1.00 . A A . 40 LYS HZ1 1 1 1 583 1 1 40 LYS HZ2 H 11.311 6.373 15.226 1.00 . A A . 40 LYS HZ2 1 1 1 584 1 1 40 LYS N N 12.446 -0.471 14.964 1.00 . A A . 40 LYS N 1 1 1 585 1 1 40 LYS NZ N 12.223 5.934 15.286 1.00 . A A . 40 LYS NZ 1 1 1 586 1 1 40 LYS O O 10.198 0.389 13.588 1.00 . A A . 40 LYS O 1 1 1 587 1 1 41 GLU C C 6.980 1.579 15.213 1.00 . A A . 41 GLU C 1 1 1 588 1 1 41 GLU CA C 7.742 0.293 14.886 1.00 . A A . 41 GLU CA 1 1 1 589 1 1 41 GLU CB C 6.935 -0.942 15.293 1.00 . A A . 41 GLU CB 1 1 1 590 1 1 41 GLU CD C 5.290 -2.458 14.129 1.00 . A A . 41 GLU CD 1 1 1 591 1 1 41 GLU CG C 6.699 -1.862 14.094 1.00 . A A . 41 GLU CG 1 1 1 592 1 1 41 GLU H H 9.020 0.267 16.530 1.00 . A A . 41 GLU H 1 1 1 593 1 1 41 GLU HA H 7.948 0.248 13.816 1.00 . A A . 41 GLU HA 1 1 1 594 1 1 41 GLU HB2 H 7.465 -1.485 16.074 1.00 . A A . 41 GLU HB2 1 1 1 595 1 1 41 GLU HB3 H 5.977 -0.633 15.713 1.00 . A A . 41 GLU HB3 1 1 1 596 1 1 41 GLU HG2 H 6.838 -1.303 13.168 1.00 . A A . 41 GLU HG2 1 1 1 597 1 1 41 GLU HG3 H 7.437 -2.664 14.096 1.00 . A A . 41 GLU HG3 1 1 1 598 1 1 41 GLU N N 9.044 0.300 15.531 1.00 . A A . 41 GLU N 1 1 1 599 1 1 41 GLU O O 6.831 1.936 16.381 1.00 . A A . 41 GLU O 1 1 1 600 1 1 41 GLU OE1 O 4.994 -3.157 15.122 1.00 . A A . 41 GLU OE1 1 1 1 601 1 1 41 GLU OE2 O 4.540 -2.201 13.163 1.00 . A A . 41 GLU OE2 1 1 1 602 1 1 42 ASP C C 4.760 3.611 13.186 1.00 . A A . 42 ASP C 1 1 1 603 1 1 42 ASP CA C 5.775 3.477 14.323 1.00 . A A . 42 ASP CA 1 1 1 604 1 1 42 ASP CB C 6.707 4.689 14.269 1.00 . A A . 42 ASP CB 1 1 1 605 1 1 42 ASP CG C 7.080 5.156 12.861 1.00 . A A . 42 ASP CG 1 1 1 606 1 1 42 ASP H H 6.643 1.942 13.215 1.00 . A A . 42 ASP H 1 1 1 607 1 1 42 ASP HA H 5.299 3.401 15.301 1.00 . A A . 42 ASP HA 1 1 1 608 1 1 42 ASP HB2 H 6.233 5.517 14.797 1.00 . A A . 42 ASP HB2 1 1 1 609 1 1 42 ASP HB3 H 7.622 4.450 14.811 1.00 . A A . 42 ASP HB3 1 1 1 610 1 1 42 ASP N N 6.517 2.239 14.162 1.00 . A A . 42 ASP N 1 1 1 611 1 1 42 ASP O O 4.902 2.972 12.145 1.00 . A A . 42 ASP O 1 1 1 612 1 1 42 ASP OD1 O 7.415 4.274 12.041 1.00 . A A . 42 ASP OD1 1 1 1 613 1 1 42 ASP OD2 O 7.022 6.385 12.636 1.00 . A A . 42 ASP OD2 1 1 1 614 1 1 43 TYR C C 2.990 5.948 11.637 1.00 . A A . 43 TYR C 1 1 1 615 1 1 43 TYR CA C 2.720 4.669 12.433 1.00 . A A . 43 TYR CA 1 1 1 616 1 1 43 TYR CB C 1.417 4.837 13.218 1.00 . A A . 43 TYR CB 1 1 1 617 1 1 43 TYR CD1 C 1.545 2.389 13.811 1.00 . A A . 43 TYR CD1 1 1 1 618 1 1 43 TYR CD2 C 0.308 3.841 15.251 1.00 . A A . 43 TYR CD2 1 1 1 619 1 1 43 TYR CE1 C 1.227 1.273 14.662 1.00 . A A . 43 TYR CE1 1 1 1 620 1 1 43 TYR CE2 C -0.010 2.724 16.103 1.00 . A A . 43 TYR CE2 1 1 1 621 1 1 43 TYR CG C 1.079 3.650 14.123 1.00 . A A . 43 TYR CG 1 1 1 622 1 1 43 TYR CZ C 0.465 1.495 15.766 1.00 . A A . 43 TYR CZ 1 1 1 623 1 1 43 TYR H H 3.650 4.960 14.274 1.00 . A A . 43 TYR H 1 1 1 624 1 1 43 TYR HA H 2.716 3.819 11.751 1.00 . A A . 43 TYR HA 1 1 1 625 1 1 43 TYR HB2 H 1.485 5.738 13.828 1.00 . A A . 43 TYR HB2 1 1 1 626 1 1 43 TYR HB3 H 0.599 4.989 12.515 1.00 . A A . 43 TYR HB3 1 1 1 627 1 1 43 TYR HD1 H 2.154 2.239 12.919 1.00 . A A . 43 TYR HD1 1 1 1 628 1 1 43 TYR HD2 H -0.060 4.837 15.498 1.00 . A A . 43 TYR HD2 1 1 1 629 1 1 43 TYR HE1 H 1.589 0.272 14.427 1.00 . A A . 43 TYR HE1 1 1 1 630 1 1 43 TYR HE2 H -0.618 2.861 16.997 1.00 . A A . 43 TYR HE2 1 1 1 631 1 1 43 TYR HH H 0.459 0.630 17.507 1.00 . A A . 43 TYR HH 1 1 1 632 1 1 43 TYR N N 3.758 4.445 13.424 1.00 . A A . 43 TYR N 1 1 1 633 1 1 43 TYR O O 2.599 7.037 12.054 1.00 . A A . 43 TYR O 1 1 1 634 1 1 43 TYR OH O 0.164 0.441 16.571 1.00 . A A . 43 TYR OH 1 1 1 635 1 1 44 ARG C C 3.439 6.665 8.235 1.00 . A A . 44 ARG C 1 1 1 636 1 1 44 ARG CA C 3.982 6.898 9.646 1.00 . A A . 44 ARG CA 1 1 1 637 1 1 44 ARG CB C 5.495 7.115 9.575 1.00 . A A . 44 ARG CB 1 1 1 638 1 1 44 ARG CD C 7.387 8.554 10.415 1.00 . A A . 44 ARG CD 1 1 1 639 1 1 44 ARG CG C 5.881 8.477 10.154 1.00 . A A . 44 ARG CG 1 1 1 640 1 1 44 ARG CZ C 7.724 10.864 11.312 1.00 . A A . 44 ARG CZ 1 1 1 641 1 1 44 ARG H H 3.969 4.883 10.173 1.00 . A A . 44 ARG H 1 1 1 642 1 1 44 ARG HA H 3.499 7.755 10.116 1.00 . A A . 44 ARG HA 1 1 1 643 1 1 44 ARG HB2 H 6.006 6.324 10.123 1.00 . A A . 44 ARG HB2 1 1 1 644 1 1 44 ARG HB3 H 5.826 7.050 8.538 1.00 . A A . 44 ARG HB3 1 1 1 645 1 1 44 ARG HD2 H 7.767 7.572 10.694 1.00 . A A . 44 ARG HD2 1 1 1 646 1 1 44 ARG HD3 H 7.908 8.851 9.505 1.00 . A A . 44 ARG HD3 1 1 1 647 1 1 44 ARG HE H 7.818 9.174 12.417 1.00 . A A . 44 ARG HE 1 1 1 648 1 1 44 ARG HG2 H 5.587 9.267 9.464 1.00 . A A . 44 ARG HG2 1 1 1 649 1 1 44 ARG HG3 H 5.339 8.648 11.084 1.00 . A A . 44 ARG HG3 1 1 1 650 1 1 44 ARG HH11 H 7.333 10.802 9.308 1.00 . A A . 44 ARG HH11 1 1 1 651 1 1 44 ARG HH12 H 7.571 12.389 9.961 1.00 . A A . 44 ARG HH12 1 1 1 652 1 1 44 ARG HH21 H 8.040 12.638 12.298 1.00 . A A . 44 ARG HH21 1 1 1 653 1 1 44 ARG N N 3.655 5.772 10.505 1.00 . A A . 44 ARG N 1 1 1 654 1 1 44 ARG NE N 7.665 9.528 11.495 1.00 . A A . 44 ARG NE 1 1 1 655 1 1 44 ARG NH1 N 7.526 11.398 10.088 1.00 . A A . 44 ARG NH1 1 1 1 656 1 1 44 ARG NH2 N 7.979 11.641 12.348 1.00 . A A . 44 ARG NH2 1 1 1 657 1 1 44 ARG O O 2.885 5.605 7.947 1.00 . A A . 44 ARG O 1 1 1 658 1 1 45 LYS C C 4.238 6.942 5.156 1.00 . A A . 45 LYS C 1 1 1 659 1 1 45 LYS CA C 3.153 7.590 6.019 1.00 . A A . 45 LYS CA 1 1 1 660 1 1 45 LYS CB C 2.710 8.966 5.520 1.00 . A A . 45 LYS CB 1 1 1 661 1 1 45 LYS CD C 2.104 10.548 7.388 1.00 . A A . 45 LYS CD 1 1 1 662 1 1 45 LYS CE C 1.262 11.825 7.363 1.00 . A A . 45 LYS CE 1 1 1 663 1 1 45 LYS CG C 1.576 9.524 6.382 1.00 . A A . 45 LYS CG 1 1 1 664 1 1 45 LYS H H 4.070 8.530 7.635 1.00 . A A . 45 LYS H 1 1 1 665 1 1 45 LYS HA H 2.274 6.945 6.009 1.00 . A A . 45 LYS HA 1 1 1 666 1 1 45 LYS HB2 H 3.556 9.653 5.537 1.00 . A A . 45 LYS HB2 1 1 1 667 1 1 45 LYS HB3 H 2.382 8.893 4.483 1.00 . A A . 45 LYS HB3 1 1 1 668 1 1 45 LYS HD2 H 2.091 10.119 8.390 1.00 . A A . 45 LYS HD2 1 1 1 669 1 1 45 LYS HD3 H 3.142 10.788 7.158 1.00 . A A . 45 LYS HD3 1 1 1 670 1 1 45 LYS HE2 H 0.856 11.981 6.364 1.00 . A A . 45 LYS HE2 1 1 1 671 1 1 45 LYS HE3 H 0.413 11.722 8.039 1.00 . A A . 45 LYS HE3 1 1 1 672 1 1 45 LYS HG2 H 0.824 9.989 5.744 1.00 . A A . 45 LYS HG2 1 1 1 673 1 1 45 LYS HG3 H 1.083 8.708 6.912 1.00 . A A . 45 LYS HG3 1 1 1 674 1 1 45 LYS HZ1 H 3.055 12.878 7.506 1.00 . A A . 45 LYS HZ1 1 1 1 675 1 1 45 LYS HZ2 H 1.760 13.848 7.319 1.00 . A A . 45 LYS HZ2 1 1 1 676 1 1 45 LYS N N 3.618 7.672 7.393 1.00 . A A . 45 LYS N 1 1 1 677 1 1 45 LYS NZ N 2.080 12.993 7.760 1.00 . A A . 45 LYS NZ 1 1 1 678 1 1 45 LYS O O 5.411 7.299 5.255 1.00 . A A . 45 LYS O 1 1 1 679 1 1 46 CYS C C 5.455 6.337 2.590 1.00 . A A . 46 CYS C 1 1 1 680 1 1 46 CYS CA C 4.727 5.301 3.448 1.00 . A A . 46 CYS CA 1 1 1 681 1 1 46 CYS CB C 4.007 4.256 2.593 1.00 . A A . 46 CYS CB 1 1 1 682 1 1 46 CYS H H 2.851 5.717 4.253 1.00 . A A . 46 CYS H 1 1 1 683 1 1 46 CYS HA H 5.429 4.767 4.089 1.00 . A A . 46 CYS HA 1 1 1 684 1 1 46 CYS HB2 H 3.589 4.751 1.716 1.00 . A A . 46 CYS HB2 1 1 1 685 1 1 46 CYS HB3 H 4.740 3.534 2.232 1.00 . A A . 46 CYS HB3 1 1 1 686 1 1 46 CYS N N 3.807 6.002 4.328 1.00 . A A . 46 CYS N 1 1 1 687 1 1 46 CYS O O 6.669 6.257 2.410 1.00 . A A . 46 CYS O 1 1 1 688 1 1 46 CYS SG S 2.667 3.353 3.451 1.00 . A A . 46 CYS SG 1 1 1 689 1 1 47 GLY C C 5.856 9.448 2.102 1.00 . A A . 47 GLY C 1 1 1 690 1 1 47 GLY CA C 5.239 8.338 1.248 1.00 . A A . 47 GLY CA 1 1 1 691 1 1 47 GLY H H 3.696 7.345 2.235 1.00 . A A . 47 GLY H 1 1 1 692 1 1 47 GLY HA2 H 5.997 7.919 0.587 1.00 . A A . 47 GLY HA2 1 1 1 693 1 1 47 GLY HA3 H 4.457 8.755 0.613 1.00 . A A . 47 GLY HA3 1 1 1 694 1 1 47 GLY N N 4.683 7.287 2.083 1.00 . A A . 47 GLY N 1 1 1 695 1 1 47 GLY O O 5.588 10.628 1.881 1.00 . A A . 47 GLY O 1 1 1 696 1 1 48 THR C C 8.667 10.418 3.359 1.00 . A A . 48 THR C 1 1 1 697 1 1 48 THR CA C 7.326 9.975 3.948 1.00 . A A . 48 THR CA 1 1 1 698 1 1 48 THR CB C 7.455 9.318 5.324 1.00 . A A . 48 THR CB 1 1 1 699 1 1 48 THR CG2 C 8.450 10.047 6.230 1.00 . A A . 48 THR CG2 1 1 1 700 1 1 48 THR H H 6.883 8.069 3.234 1.00 . A A . 48 THR H 1 1 1 701 1 1 48 THR HA H 6.702 10.864 4.027 1.00 . A A . 48 THR HA 1 1 1 702 1 1 48 THR HB H 7.715 8.264 5.230 1.00 . A A . 48 THR HB 1 1 1 703 1 1 48 THR HG1 H 5.478 9.040 5.460 1.00 . A A . 48 THR HG1 1 1 1 704 1 1 48 THR HG21 H 9.422 10.095 5.738 1.00 . A A . 48 THR HG21 1 1 1 705 1 1 48 THR HG22 H 8.091 11.057 6.425 1.00 . A A . 48 THR HG22 1 1 1 706 1 1 48 THR HG23 H 8.547 9.507 7.172 1.00 . A A . 48 THR HG23 1 1 1 707 1 1 48 THR N N 6.670 9.031 3.060 1.00 . A A . 48 THR N 1 1 1 708 1 1 48 THR O O 9.471 9.586 2.941 1.00 . A A . 48 THR O 1 1 1 709 1 1 48 THR OG1 O 6.191 9.551 5.940 1.00 . A A . 48 THR OG1 1 1 1 710 1 1 49 ALA C C 11.292 11.661 3.528 1.00 . A A . 49 ALA C 1 1 1 711 1 1 49 ALA CA C 10.095 12.292 2.813 1.00 . A A . 49 ALA CA 1 1 1 712 1 1 49 ALA CB C 10.064 13.814 2.960 1.00 . A A . 49 ALA CB 1 1 1 713 1 1 49 ALA H H 8.208 12.398 3.687 1.00 . A A . 49 ALA H 1 1 1 714 1 1 49 ALA HA H 10.143 12.043 1.753 1.00 . A A . 49 ALA HA 1 1 1 715 1 1 49 ALA HB1 H 9.133 14.114 3.441 1.00 . A A . 49 ALA HB1 1 1 1 716 1 1 49 ALA HB2 H 10.908 14.137 3.569 1.00 . A A . 49 ALA HB2 1 1 1 717 1 1 49 ALA HB3 H 10.129 14.276 1.975 1.00 . A A . 49 ALA HB3 1 1 1 718 1 1 49 ALA N N 8.866 11.728 3.345 1.00 . A A . 49 ALA N 1 1 1 719 1 1 49 ALA O O 11.606 12.025 4.660 1.00 . A A . 49 ALA O 1 1 1 720 1 1 50 GLY C C 12.846 8.531 3.456 1.00 . A A . 50 GLY C 1 1 1 721 1 1 50 GLY CA C 13.083 10.041 3.392 1.00 . A A . 50 GLY CA 1 1 1 722 1 1 50 GLY H H 11.667 10.436 1.916 1.00 . A A . 50 GLY H 1 1 1 723 1 1 50 GLY HA2 H 13.962 10.250 2.781 1.00 . A A . 50 GLY HA2 1 1 1 724 1 1 50 GLY HA3 H 13.291 10.423 4.391 1.00 . A A . 50 GLY HA3 1 1 1 725 1 1 50 GLY N N 11.928 10.726 2.837 1.00 . A A . 50 GLY N 1 1 1 726 1 1 50 GLY O O 13.761 7.768 3.761 1.00 . A A . 50 GLY O 1 1 1 727 1 1 51 CYS C C 11.039 6.275 1.740 1.00 . A A . 51 CYS C 1 1 1 728 1 1 51 CYS CA C 11.245 6.739 3.183 1.00 . A A . 51 CYS CA 1 1 1 729 1 1 51 CYS CB C 10.004 6.492 4.044 1.00 . A A . 51 CYS CB 1 1 1 730 1 1 51 CYS H H 10.875 8.771 2.914 1.00 . A A . 51 CYS H 1 1 1 731 1 1 51 CYS HA H 12.073 6.205 3.647 1.00 . A A . 51 CYS HA 1 1 1 732 1 1 51 CYS HB2 H 9.194 7.150 3.727 1.00 . A A . 51 CYS HB2 1 1 1 733 1 1 51 CYS HB3 H 9.655 5.469 3.908 1.00 . A A . 51 CYS HB3 1 1 1 734 1 1 51 CYS N N 11.613 8.144 3.162 1.00 . A A . 51 CYS N 1 1 1 735 1 1 51 CYS O O 11.987 5.855 1.078 1.00 . A A . 51 CYS O 1 1 1 736 1 1 51 CYS SG S 10.396 6.791 5.806 1.00 . A A . 51 CYS SG 1 1 1 737 1 1 52 HIS C C 9.180 7.201 -0.913 1.00 . A A . 52 HIS C 1 1 1 738 1 1 52 HIS CA C 9.452 5.961 -0.059 1.00 . A A . 52 HIS CA 1 1 1 739 1 1 52 HIS CB C 8.281 4.977 -0.051 1.00 . A A . 52 HIS CB 1 1 1 740 1 1 52 HIS CD2 C 8.201 3.055 1.719 1.00 . A A . 52 HIS CD2 1 1 1 741 1 1 52 HIS CE1 C 9.546 1.651 0.715 1.00 . A A . 52 HIS CE1 1 1 1 742 1 1 52 HIS CG C 8.611 3.633 0.554 1.00 . A A . 52 HIS CG 1 1 1 743 1 1 52 HIS H H 9.029 6.710 1.838 1.00 . A A . 52 HIS H 1 1 1 744 1 1 52 HIS HA H 10.322 5.439 -0.458 1.00 . A A . 52 HIS HA 1 1 1 745 1 1 52 HIS HB2 H 7.452 5.419 0.502 1.00 . A A . 52 HIS HB2 1 1 1 746 1 1 52 HIS HB3 H 7.938 4.828 -1.075 1.00 . A A . 52 HIS HB3 1 1 1 747 1 1 52 HIS HD1 H 9.925 2.856 -0.931 1.00 . A A . 52 HIS HD1 1 1 1 748 1 1 52 HIS HD2 H 7.524 3.501 2.447 1.00 . A A . 52 HIS HD2 1 1 1 749 1 1 52 HIS HE1 H 10.138 0.760 0.508 1.00 . A A . 52 HIS HE1 1 1 1 750 1 1 52 HIS N N 9.795 6.366 1.294 1.00 . A A . 52 HIS N 1 1 1 751 1 1 52 HIS ND1 N 9.458 2.725 -0.056 1.00 . A A . 52 HIS ND1 1 1 1 752 1 1 52 HIS NE2 N 8.765 1.858 1.815 1.00 . A A . 52 HIS NE2 1 1 1 753 1 1 52 HIS O O 8.029 7.505 -1.222 1.00 . A A . 52 HIS O 1 1 1 754 1 1 53 ASP C C 11.217 9.050 -3.177 1.00 . A A . 53 ASP C 1 1 1 755 1 1 53 ASP CA C 10.150 9.083 -2.082 1.00 . A A . 53 ASP CA 1 1 1 756 1 1 53 ASP CB C 10.375 10.340 -1.240 1.00 . A A . 53 ASP CB 1 1 1 757 1 1 53 ASP CG C 10.766 11.588 -2.033 1.00 . A A . 53 ASP CG 1 1 1 758 1 1 53 ASP H H 11.191 7.628 -1.015 1.00 . A A . 53 ASP H 1 1 1 759 1 1 53 ASP HA H 9.137 9.065 -2.486 1.00 . A A . 53 ASP HA 1 1 1 760 1 1 53 ASP HB2 H 9.463 10.553 -0.682 1.00 . A A . 53 ASP HB2 1 1 1 761 1 1 53 ASP HB3 H 11.155 10.134 -0.507 1.00 . A A . 53 ASP HB3 1 1 1 762 1 1 53 ASP N N 10.258 7.883 -1.270 1.00 . A A . 53 ASP N 1 1 1 763 1 1 53 ASP O O 12.236 9.733 -3.077 1.00 . A A . 53 ASP O 1 1 1 764 1 1 53 ASP OD1 O 10.074 11.863 -3.037 1.00 . A A . 53 ASP OD1 1 1 1 765 1 1 53 ASP OD2 O 11.748 12.241 -1.617 1.00 . A A . 53 ASP OD2 1 1 1 766 1 1 54 SER C C 11.304 8.816 -6.549 1.00 . A A . 54 SER C 1 1 1 767 1 1 54 SER CA C 11.873 8.120 -5.311 1.00 . A A . 54 SER CA 1 1 1 768 1 1 54 SER CB C 12.164 6.649 -5.616 1.00 . A A . 54 SER CB 1 1 1 769 1 1 54 SER H H 10.117 7.699 -4.273 1.00 . A A . 54 SER H 1 1 1 770 1 1 54 SER HA H 12.789 8.610 -4.984 1.00 . A A . 54 SER HA 1 1 1 771 1 1 54 SER HB2 H 12.912 6.583 -6.406 1.00 . A A . 54 SER HB2 1 1 1 772 1 1 54 SER HB3 H 12.590 6.173 -4.733 1.00 . A A . 54 SER HB3 1 1 1 773 1 1 54 SER HG H 10.181 6.509 -5.854 1.00 . A A . 54 SER HG 1 1 1 774 1 1 54 SER N N 10.948 8.250 -4.199 1.00 . A A . 54 SER N 1 1 1 775 1 1 54 SER O O 12.055 9.326 -7.379 1.00 . A A . 54 SER O 1 1 1 776 1 1 54 SER OG O 10.991 5.944 -6.015 1.00 . A A . 54 SER OG 1 1 1 777 1 1 55 MET C C 9.933 9.013 -9.085 1.00 . A A . 55 MET C 1 1 1 778 1 1 55 MET CA C 9.304 9.440 -7.757 1.00 . A A . 55 MET CA 1 1 1 779 1 1 55 MET CB C 9.384 10.961 -7.620 1.00 . A A . 55 MET CB 1 1 1 780 1 1 55 MET CE C 7.158 10.215 -5.099 1.00 . A A . 55 MET CE 1 1 1 781 1 1 55 MET CG C 8.007 11.559 -7.325 1.00 . A A . 55 MET CG 1 1 1 782 1 1 55 MET H H 9.378 8.398 -5.955 1.00 . A A . 55 MET H 1 1 1 783 1 1 55 MET HA H 8.272 9.090 -7.707 1.00 . A A . 55 MET HA 1 1 1 784 1 1 55 MET HB2 H 10.076 11.222 -6.819 1.00 . A A . 55 MET HB2 1 1 1 785 1 1 55 MET HB3 H 9.782 11.392 -8.538 1.00 . A A . 55 MET HB3 1 1 1 786 1 1 55 MET HE1 H 7.721 9.428 -5.601 1.00 . A A . 55 MET HE1 1 1 1 787 1 1 55 MET HE2 H 7.243 10.090 -4.020 1.00 . A A . 55 MET HE2 1 1 1 788 1 1 55 MET HE3 H 6.109 10.153 -5.391 1.00 . A A . 55 MET HE3 1 1 1 789 1 1 55 MET HG2 H 7.892 12.507 -7.850 1.00 . A A . 55 MET HG2 1 1 1 790 1 1 55 MET HG3 H 7.226 10.894 -7.694 1.00 . A A . 55 MET HG3 1 1 1 791 1 1 55 MET N N 9.982 8.815 -6.634 1.00 . A A . 55 MET N 1 1 1 792 1 1 55 MET O O 10.000 9.801 -10.026 1.00 . A A . 55 MET O 1 1 1 793 1 1 55 MET SD S 7.813 11.808 -5.568 1.00 . A A . 55 MET SD 1 1 1 794 1 1 56 ASP C C 10.023 6.275 -11.007 1.00 . A A . 56 ASP C 1 1 1 795 1 1 56 ASP CA C 11.001 7.224 -10.314 1.00 . A A . 56 ASP CA 1 1 1 796 1 1 56 ASP CB C 12.264 6.432 -9.967 1.00 . A A . 56 ASP CB 1 1 1 797 1 1 56 ASP CG C 13.407 6.565 -10.975 1.00 . A A . 56 ASP CG 1 1 1 798 1 1 56 ASP H H 10.320 7.130 -8.347 1.00 . A A . 56 ASP H 1 1 1 799 1 1 56 ASP HA H 11.246 8.092 -10.926 1.00 . A A . 56 ASP HA 1 1 1 800 1 1 56 ASP HB2 H 12.621 6.756 -8.990 1.00 . A A . 56 ASP HB2 1 1 1 801 1 1 56 ASP HB3 H 12.000 5.378 -9.877 1.00 . A A . 56 ASP HB3 1 1 1 802 1 1 56 ASP N N 10.379 7.765 -9.117 1.00 . A A . 56 ASP N 1 1 1 803 1 1 56 ASP O O 9.991 6.198 -12.235 1.00 . A A . 56 ASP O 1 1 1 804 1 1 56 ASP OD1 O 13.876 7.710 -11.153 1.00 . A A . 56 ASP OD1 1 1 1 805 1 1 56 ASP OD2 O 13.786 5.519 -11.545 1.00 . A A . 56 ASP OD2 1 1 1 806 1 1 57 LYS C C 9.000 3.435 -11.324 1.00 . A A . 57 LYS C 1 1 1 807 1 1 57 LYS CA C 8.271 4.633 -10.712 1.00 . A A . 57 LYS CA 1 1 1 808 1 1 57 LYS CB C 7.316 5.332 -11.681 1.00 . A A . 57 LYS CB 1 1 1 809 1 1 57 LYS CD C 6.451 3.873 -13.547 1.00 . A A . 57 LYS CD 1 1 1 810 1 1 57 LYS CE C 6.841 2.394 -13.534 1.00 . A A . 57 LYS CE 1 1 1 811 1 1 57 LYS CG C 6.199 4.387 -12.128 1.00 . A A . 57 LYS CG 1 1 1 812 1 1 57 LYS H H 9.280 5.643 -9.194 1.00 . A A . 57 LYS H 1 1 1 813 1 1 57 LYS HA H 7.676 4.281 -9.869 1.00 . A A . 57 LYS HA 1 1 1 814 1 1 57 LYS HB2 H 6.883 6.210 -11.201 1.00 . A A . 57 LYS HB2 1 1 1 815 1 1 57 LYS HB3 H 7.869 5.685 -12.551 1.00 . A A . 57 LYS HB3 1 1 1 816 1 1 57 LYS HD2 H 5.555 4.012 -14.152 1.00 . A A . 57 LYS HD2 1 1 1 817 1 1 57 LYS HD3 H 7.244 4.458 -14.014 1.00 . A A . 57 LYS HD3 1 1 1 818 1 1 57 LYS HE2 H 7.763 2.250 -14.096 1.00 . A A . 57 LYS HE2 1 1 1 819 1 1 57 LYS HE3 H 7.038 2.073 -12.511 1.00 . A A . 57 LYS HE3 1 1 1 820 1 1 57 LYS HG2 H 6.133 3.545 -11.439 1.00 . A A . 57 LYS HG2 1 1 1 821 1 1 57 LYS HG3 H 5.241 4.905 -12.090 1.00 . A A . 57 LYS HG3 1 1 1 822 1 1 57 LYS HZ1 H 5.180 2.100 -14.758 1.00 . A A . 57 LYS HZ1 1 1 1 823 1 1 57 LYS HZ2 H 6.127 0.780 -14.642 1.00 . A A . 57 LYS HZ2 1 1 1 824 1 1 57 LYS N N 9.248 5.575 -10.192 1.00 . A A . 57 LYS N 1 1 1 825 1 1 57 LYS NZ N 5.761 1.568 -14.120 1.00 . A A . 57 LYS NZ 1 1 1 826 1 1 57 LYS O O 8.879 2.314 -10.833 1.00 . A A . 57 LYS O 1 1 1 827 1 1 58 LYS C C 11.806 2.429 -12.335 1.00 . A A . 58 LYS C 1 1 1 828 1 1 58 LYS CA C 10.488 2.673 -13.072 1.00 . A A . 58 LYS CA 1 1 1 829 1 1 58 LYS CB C 10.665 3.024 -14.550 1.00 . A A . 58 LYS CB 1 1 1 830 1 1 58 LYS CD C 11.517 1.662 -16.493 1.00 . A A . 58 LYS CD 1 1 1 831 1 1 58 LYS CE C 11.737 0.193 -16.863 1.00 . A A . 58 LYS CE 1 1 1 832 1 1 58 LYS CG C 10.419 1.803 -15.438 1.00 . A A . 58 LYS CG 1 1 1 833 1 1 58 LYS H H 9.833 4.628 -12.780 1.00 . A A . 58 LYS H 1 1 1 834 1 1 58 LYS HA H 9.893 1.760 -13.027 1.00 . A A . 58 LYS HA 1 1 1 835 1 1 58 LYS HB2 H 9.975 3.822 -14.823 1.00 . A A . 58 LYS HB2 1 1 1 836 1 1 58 LYS HB3 H 11.673 3.404 -14.719 1.00 . A A . 58 LYS HB3 1 1 1 837 1 1 58 LYS HD2 H 11.246 2.228 -17.384 1.00 . A A . 58 LYS HD2 1 1 1 838 1 1 58 LYS HD3 H 12.446 2.088 -16.116 1.00 . A A . 58 LYS HD3 1 1 1 839 1 1 58 LYS HE2 H 10.958 -0.422 -16.412 1.00 . A A . 58 LYS HE2 1 1 1 840 1 1 58 LYS HE3 H 11.656 0.068 -17.943 1.00 . A A . 58 LYS HE3 1 1 1 841 1 1 58 LYS HG2 H 10.382 0.904 -14.823 1.00 . A A . 58 LYS HG2 1 1 1 842 1 1 58 LYS HG3 H 9.449 1.894 -15.927 1.00 . A A . 58 LYS HG3 1 1 1 843 1 1 58 LYS HZ1 H 13.061 -1.242 -16.135 1.00 . A A . 58 LYS HZ1 1 1 1 844 1 1 58 LYS HZ2 H 13.774 -0.161 -17.123 1.00 . A A . 58 LYS HZ2 1 1 1 845 1 1 58 LYS N N 9.740 3.713 -12.387 1.00 . A A . 58 LYS N 1 1 1 846 1 1 58 LYS NZ N 13.067 -0.264 -16.403 1.00 . A A . 58 LYS NZ 1 1 1 847 1 1 58 LYS O O 12.872 2.803 -12.822 1.00 . A A . 58 LYS O 1 1 1 848 1 1 59 ASP C C 12.703 0.121 -9.736 1.00 . A A . 59 ASP C 1 1 1 849 1 1 59 ASP CA C 12.861 1.508 -10.363 1.00 . A A . 59 ASP CA 1 1 1 850 1 1 59 ASP CB C 13.019 2.523 -9.230 1.00 . A A . 59 ASP CB 1 1 1 851 1 1 59 ASP CG C 14.453 2.721 -8.735 1.00 . A A . 59 ASP CG 1 1 1 852 1 1 59 ASP H H 10.821 1.504 -10.783 1.00 . A A . 59 ASP H 1 1 1 853 1 1 59 ASP HA H 13.705 1.561 -11.050 1.00 . A A . 59 ASP HA 1 1 1 854 1 1 59 ASP HB2 H 12.632 3.485 -9.567 1.00 . A A . 59 ASP HB2 1 1 1 855 1 1 59 ASP HB3 H 12.401 2.207 -8.390 1.00 . A A . 59 ASP HB3 1 1 1 856 1 1 59 ASP N N 11.691 1.805 -11.172 1.00 . A A . 59 ASP N 1 1 1 857 1 1 59 ASP O O 13.598 -0.717 -9.840 1.00 . A A . 59 ASP O 1 1 1 858 1 1 59 ASP OD1 O 15.347 2.811 -9.604 1.00 . A A . 59 ASP OD1 1 1 1 859 1 1 59 ASP OD2 O 14.624 2.779 -7.498 1.00 . A A . 59 ASP OD2 1 1 1 860 1 1 60 LYS C C 12.526 -1.842 -7.729 1.00 . A A . 60 LYS C 1 1 1 861 1 1 60 LYS CA C 11.273 -1.349 -8.455 1.00 . A A . 60 LYS CA 1 1 1 862 1 1 60 LYS CB C 10.716 -2.351 -9.469 1.00 . A A . 60 LYS CB 1 1 1 863 1 1 60 LYS CD C 11.110 -3.507 -11.675 1.00 . A A . 60 LYS CD 1 1 1 864 1 1 60 LYS CE C 12.007 -3.592 -12.912 1.00 . A A . 60 LYS CE 1 1 1 865 1 1 60 LYS CG C 11.613 -2.436 -10.705 1.00 . A A . 60 LYS CG 1 1 1 866 1 1 60 LYS H H 10.836 0.608 -9.020 1.00 . A A . 60 LYS H 1 1 1 867 1 1 60 LYS HA H 10.492 -1.172 -7.715 1.00 . A A . 60 LYS HA 1 1 1 868 1 1 60 LYS HB2 H 10.632 -3.334 -9.007 1.00 . A A . 60 LYS HB2 1 1 1 869 1 1 60 LYS HB3 H 9.710 -2.053 -9.766 1.00 . A A . 60 LYS HB3 1 1 1 870 1 1 60 LYS HD2 H 11.085 -4.474 -11.173 1.00 . A A . 60 LYS HD2 1 1 1 871 1 1 60 LYS HD3 H 10.089 -3.278 -11.978 1.00 . A A . 60 LYS HD3 1 1 1 872 1 1 60 LYS HE2 H 12.900 -2.985 -12.763 1.00 . A A . 60 LYS HE2 1 1 1 873 1 1 60 LYS HE3 H 12.341 -4.619 -13.057 1.00 . A A . 60 LYS HE3 1 1 1 874 1 1 60 LYS HG2 H 11.640 -1.469 -11.207 1.00 . A A . 60 LYS HG2 1 1 1 875 1 1 60 LYS HG3 H 12.635 -2.666 -10.402 1.00 . A A . 60 LYS HG3 1 1 1 876 1 1 60 LYS HZ1 H 11.093 -3.883 -14.762 1.00 . A A . 60 LYS HZ1 1 1 1 877 1 1 60 LYS HZ2 H 10.383 -2.714 -13.878 1.00 . A A . 60 LYS HZ2 1 1 1 878 1 1 60 LYS N N 11.559 -0.079 -9.099 1.00 . A A . 60 LYS N 1 1 1 879 1 1 60 LYS NZ N 11.279 -3.126 -14.113 1.00 . A A . 60 LYS NZ 1 1 1 880 1 1 60 LYS O O 13.348 -2.548 -8.312 1.00 . A A . 60 LYS O 1 1 1 881 1 1 61 SER C C 13.415 -1.752 -4.172 1.00 . A A . 61 SER C 1 1 1 882 1 1 61 SER CA C 13.773 -1.843 -5.657 1.00 . A A . 61 SER CA 1 1 1 883 1 1 61 SER CB C 14.993 -0.972 -5.963 1.00 . A A . 61 SER CB 1 1 1 884 1 1 61 SER H H 11.960 -0.876 -6.002 1.00 . A A . 61 SER H 1 1 1 885 1 1 61 SER HA H 13.985 -2.875 -5.937 1.00 . A A . 61 SER HA 1 1 1 886 1 1 61 SER HB2 H 14.667 0.046 -6.177 1.00 . A A . 61 SER HB2 1 1 1 887 1 1 61 SER HB3 H 15.634 -0.923 -5.082 1.00 . A A . 61 SER HB3 1 1 1 888 1 1 61 SER HG H 16.217 -2.313 -6.806 1.00 . A A . 61 SER HG 1 1 1 889 1 1 61 SER N N 12.633 -1.450 -6.468 1.00 . A A . 61 SER N 1 1 1 890 1 1 61 SER O O 13.561 -2.724 -3.434 1.00 . A A . 61 SER O 1 1 1 891 1 1 61 SER OG O 15.742 -1.472 -7.067 1.00 . A A . 61 SER OG 1 1 1 892 1 1 62 ALA C C 12.067 1.093 -2.243 1.00 . A A . 62 ALA C 1 1 1 893 1 1 62 ALA CA C 12.573 -0.343 -2.396 1.00 . A A . 62 ALA CA 1 1 1 894 1 1 62 ALA CB C 13.763 -0.642 -1.482 1.00 . A A . 62 ALA CB 1 1 1 895 1 1 62 ALA H H 12.837 0.212 -4.386 1.00 . A A . 62 ALA H 1 1 1 896 1 1 62 ALA HA H 11.764 -1.032 -2.154 1.00 . A A . 62 ALA HA 1 1 1 897 1 1 62 ALA HB1 H 14.687 -0.578 -2.057 1.00 . A A . 62 ALA HB1 1 1 1 898 1 1 62 ALA HB2 H 13.790 0.085 -0.671 1.00 . A A . 62 ALA HB2 1 1 1 899 1 1 62 ALA HB3 H 13.661 -1.645 -1.069 1.00 . A A . 62 ALA HB3 1 1 1 900 1 1 62 ALA N N 12.953 -0.574 -3.779 1.00 . A A . 62 ALA N 1 1 1 901 1 1 62 ALA O O 10.960 1.317 -1.758 1.00 . A A . 62 ALA O 1 1 1 902 1 1 63 LYS C C 11.369 3.721 -3.507 1.00 . A A . 63 LYS C 1 1 1 903 1 1 63 LYS CA C 12.556 3.438 -2.583 1.00 . A A . 63 LYS CA 1 1 1 904 1 1 63 LYS CB C 13.780 4.310 -2.869 1.00 . A A . 63 LYS CB 1 1 1 905 1 1 63 LYS CD C 15.724 5.467 -1.756 1.00 . A A . 63 LYS CD 1 1 1 906 1 1 63 LYS CE C 15.641 6.307 -0.479 1.00 . A A . 63 LYS CE 1 1 1 907 1 1 63 LYS CG C 14.760 4.280 -1.695 1.00 . A A . 63 LYS CG 1 1 1 908 1 1 63 LYS H H 13.803 1.839 -3.061 1.00 . A A . 63 LYS H 1 1 1 909 1 1 63 LYS HA H 12.250 3.638 -1.556 1.00 . A A . 63 LYS HA 1 1 1 910 1 1 63 LYS HB2 H 14.278 3.960 -3.773 1.00 . A A . 63 LYS HB2 1 1 1 911 1 1 63 LYS HB3 H 13.463 5.336 -3.058 1.00 . A A . 63 LYS HB3 1 1 1 912 1 1 63 LYS HD2 H 16.743 5.106 -1.892 1.00 . A A . 63 LYS HD2 1 1 1 913 1 1 63 LYS HD3 H 15.488 6.089 -2.620 1.00 . A A . 63 LYS HD3 1 1 1 914 1 1 63 LYS HE2 H 15.151 5.734 0.308 1.00 . A A . 63 LYS HE2 1 1 1 915 1 1 63 LYS HE3 H 16.644 6.542 -0.125 1.00 . A A . 63 LYS HE3 1 1 1 916 1 1 63 LYS HG2 H 14.209 4.302 -0.755 1.00 . A A . 63 LYS HG2 1 1 1 917 1 1 63 LYS HG3 H 15.325 3.348 -1.712 1.00 . A A . 63 LYS HG3 1 1 1 918 1 1 63 LYS HZ1 H 15.037 7.907 -1.670 1.00 . A A . 63 LYS HZ1 1 1 1 919 1 1 63 LYS HZ2 H 13.891 7.431 -0.616 1.00 . A A . 63 LYS HZ2 1 1 1 920 1 1 63 LYS N N 12.904 2.029 -2.667 1.00 . A A . 63 LYS N 1 1 1 921 1 1 63 LYS NZ N 14.891 7.558 -0.729 1.00 . A A . 63 LYS NZ 1 1 1 922 1 1 63 LYS O O 10.678 4.725 -3.345 1.00 . A A . 63 LYS O 1 1 1 923 1 1 64 GLY C C 8.724 2.895 -4.698 1.00 . A A . 64 GLY C 1 1 1 924 1 1 64 GLY CA C 10.079 2.958 -5.405 1.00 . A A . 64 GLY CA 1 1 1 925 1 1 64 GLY H H 11.737 2.004 -4.581 1.00 . A A . 64 GLY H 1 1 1 926 1 1 64 GLY HA2 H 10.173 3.907 -5.935 1.00 . A A . 64 GLY HA2 1 1 1 927 1 1 64 GLY HA3 H 10.140 2.168 -6.154 1.00 . A A . 64 GLY HA3 1 1 1 928 1 1 64 GLY N N 11.170 2.818 -4.456 1.00 . A A . 64 GLY N 1 1 1 929 1 1 64 GLY O O 8.180 1.813 -4.486 1.00 . A A . 64 GLY O 1 1 1 930 1 1 65 TYR C C 5.851 3.416 -4.446 1.00 . A A . 65 TYR C 1 1 1 931 1 1 65 TYR CA C 6.938 4.162 -3.671 1.00 . A A . 65 TYR CA 1 1 1 932 1 1 65 TYR CB C 6.588 5.651 -3.630 1.00 . A A . 65 TYR CB 1 1 1 933 1 1 65 TYR CD1 C 4.771 5.724 -1.883 1.00 . A A . 65 TYR CD1 1 1 1 934 1 1 65 TYR CD2 C 4.234 6.419 -4.107 1.00 . A A . 65 TYR CD2 1 1 1 935 1 1 65 TYR CE1 C 3.419 5.996 -1.471 1.00 . A A . 65 TYR CE1 1 1 1 936 1 1 65 TYR CE2 C 2.882 6.692 -3.694 1.00 . A A . 65 TYR CE2 1 1 1 937 1 1 65 TYR CG C 5.151 5.941 -3.192 1.00 . A A . 65 TYR CG 1 1 1 938 1 1 65 TYR CZ C 2.541 6.467 -2.397 1.00 . A A . 65 TYR CZ 1 1 1 939 1 1 65 TYR H H 8.668 4.946 -4.526 1.00 . A A . 65 TYR H 1 1 1 940 1 1 65 TYR HA H 7.047 3.709 -2.685 1.00 . A A . 65 TYR HA 1 1 1 941 1 1 65 TYR HB2 H 7.273 6.156 -2.949 1.00 . A A . 65 TYR HB2 1 1 1 942 1 1 65 TYR HB3 H 6.749 6.078 -4.620 1.00 . A A . 65 TYR HB3 1 1 1 943 1 1 65 TYR HD1 H 5.495 5.346 -1.161 1.00 . A A . 65 TYR HD1 1 1 1 944 1 1 65 TYR HD2 H 4.534 6.590 -5.140 1.00 . A A . 65 TYR HD2 1 1 1 945 1 1 65 TYR HE1 H 3.105 5.830 -0.441 1.00 . A A . 65 TYR HE1 1 1 1 946 1 1 65 TYR HE2 H 2.148 7.069 -4.406 1.00 . A A . 65 TYR HE2 1 1 1 947 1 1 65 TYR HH H 0.711 5.893 -2.076 1.00 . A A . 65 TYR HH 1 1 1 948 1 1 65 TYR N N 8.219 4.070 -4.351 1.00 . A A . 65 TYR N 1 1 1 949 1 1 65 TYR O O 5.016 2.735 -3.852 1.00 . A A . 65 TYR O 1 1 1 950 1 1 65 TYR OH O 1.263 6.724 -2.008 1.00 . A A . 65 TYR OH 1 1 1 951 1 1 66 TYR C C 5.269 1.441 -6.822 1.00 . A A . 66 TYR C 1 1 1 952 1 1 66 TYR CA C 4.924 2.918 -6.624 1.00 . A A . 66 TYR CA 1 1 1 953 1 1 66 TYR CB C 5.012 3.635 -7.973 1.00 . A A . 66 TYR CB 1 1 1 954 1 1 66 TYR CD1 C 5.384 1.828 -9.691 1.00 . A A . 66 TYR CD1 1 1 1 955 1 1 66 TYR CD2 C 3.291 2.984 -9.697 1.00 . A A . 66 TYR CD2 1 1 1 956 1 1 66 TYR CE1 C 4.946 1.030 -10.808 1.00 . A A . 66 TYR CE1 1 1 1 957 1 1 66 TYR CE2 C 2.854 2.186 -10.814 1.00 . A A . 66 TYR CE2 1 1 1 958 1 1 66 TYR CG C 4.547 2.788 -9.159 1.00 . A A . 66 TYR CG 1 1 1 959 1 1 66 TYR CZ C 3.703 1.249 -11.314 1.00 . A A . 66 TYR CZ 1 1 1 960 1 1 66 TYR H H 6.578 4.124 -6.236 1.00 . A A . 66 TYR H 1 1 1 961 1 1 66 TYR HA H 3.947 2.995 -6.148 1.00 . A A . 66 TYR HA 1 1 1 962 1 1 66 TYR HB2 H 4.410 4.543 -7.930 1.00 . A A . 66 TYR HB2 1 1 1 963 1 1 66 TYR HB3 H 6.043 3.944 -8.143 1.00 . A A . 66 TYR HB3 1 1 1 964 1 1 66 TYR HD1 H 6.375 1.673 -9.266 1.00 . A A . 66 TYR HD1 1 1 1 965 1 1 66 TYR HD2 H 2.631 3.742 -9.277 1.00 . A A . 66 TYR HD2 1 1 1 966 1 1 66 TYR HE1 H 5.597 0.269 -11.237 1.00 . A A . 66 TYR HE1 1 1 1 967 1 1 66 TYR HE2 H 1.865 2.331 -11.248 1.00 . A A . 66 TYR HE2 1 1 1 968 1 1 66 TYR HH H 3.058 -0.427 -12.059 1.00 . A A . 66 TYR HH 1 1 1 969 1 1 66 TYR N N 5.896 3.569 -5.761 1.00 . A A . 66 TYR N 1 1 1 970 1 1 66 TYR O O 4.562 0.724 -7.528 1.00 . A A . 66 TYR O 1 1 1 971 1 1 66 TYR OH O 3.290 0.496 -12.368 1.00 . A A . 66 TYR OH 1 1 1 972 1 1 67 HIS C C 6.354 -1.123 -5.043 1.00 . A A . 67 HIS C 1 1 1 973 1 1 67 HIS CA C 6.804 -0.349 -6.283 1.00 . A A . 67 HIS CA 1 1 1 974 1 1 67 HIS CB C 8.316 -0.415 -6.507 1.00 . A A . 67 HIS CB 1 1 1 975 1 1 67 HIS CD2 C 9.428 -1.721 -4.535 1.00 . A A . 67 HIS CD2 1 1 1 976 1 1 67 HIS CE1 C 9.862 -3.582 -5.600 1.00 . A A . 67 HIS CE1 1 1 1 977 1 1 67 HIS CG C 8.989 -1.578 -5.819 1.00 . A A . 67 HIS CG 1 1 1 978 1 1 67 HIS H H 6.926 1.620 -5.613 1.00 . A A . 67 HIS H 1 1 1 979 1 1 67 HIS HA H 6.319 -0.774 -7.162 1.00 . A A . 67 HIS HA 1 1 1 980 1 1 67 HIS HB2 H 8.512 -0.477 -7.578 1.00 . A A . 67 HIS HB2 1 1 1 981 1 1 67 HIS HB3 H 8.766 0.513 -6.154 1.00 . A A . 67 HIS HB3 1 1 1 982 1 1 67 HIS HD1 H 9.078 -2.976 -7.422 1.00 . A A . 67 HIS HD1 1 1 1 983 1 1 67 HIS HD2 H 9.358 -0.968 -3.750 1.00 . A A . 67 HIS HD2 1 1 1 984 1 1 67 HIS HE1 H 10.209 -4.595 -5.807 1.00 . A A . 67 HIS HE1 1 1 1 985 1 1 67 HIS N N 6.357 1.030 -6.186 1.00 . A A . 67 HIS N 1 1 1 986 1 1 67 HIS ND1 N 9.278 -2.767 -6.465 1.00 . A A . 67 HIS ND1 1 1 1 987 1 1 67 HIS NE2 N 9.954 -2.932 -4.404 1.00 . A A . 67 HIS NE2 1 1 1 988 1 1 67 HIS O O 6.102 -2.325 -5.115 1.00 . A A . 67 HIS O 1 1 1 989 1 1 68 VAL C C 4.326 -0.979 -2.584 1.00 . A A . 68 VAL C 1 1 1 990 1 1 68 VAL CA C 5.853 -1.008 -2.680 1.00 . A A . 68 VAL CA 1 1 1 991 1 1 68 VAL CB C 6.539 -0.303 -1.507 1.00 . A A . 68 VAL CB 1 1 1 992 1 1 68 VAL CG1 C 7.995 -0.752 -1.375 1.00 . A A . 68 VAL CG1 1 1 1 993 1 1 68 VAL CG2 C 6.444 1.217 -1.650 1.00 . A A . 68 VAL CG2 1 1 1 994 1 1 68 VAL H H 6.474 0.574 -3.885 1.00 . A A . 68 VAL H 1 1 1 995 1 1 68 VAL HA H 6.184 -2.046 -2.690 1.00 . A A . 68 VAL HA 1 1 1 996 1 1 68 VAL HB H 6.016 -0.587 -0.594 1.00 . A A . 68 VAL HB 1 1 1 997 1 1 68 VAL HG11 H 8.073 -1.811 -1.618 1.00 . A A . 68 VAL HG11 1 1 1 998 1 1 68 VAL HG12 H 8.617 -0.175 -2.059 1.00 . A A . 68 VAL HG12 1 1 1 999 1 1 68 VAL HG13 H 8.334 -0.588 -0.351 1.00 . A A . 68 VAL HG13 1 1 1 1000 1 1 68 VAL HG21 H 5.495 1.480 -2.117 1.00 . A A . 68 VAL HG21 1 1 1 1001 1 1 68 VAL HG22 H 6.504 1.679 -0.664 1.00 . A A . 68 VAL HG22 1 1 1 1002 1 1 68 VAL HG23 H 7.265 1.576 -2.270 1.00 . A A . 68 VAL HG23 1 1 1 1003 1 1 68 VAL N N 6.267 -0.403 -3.934 1.00 . A A . 68 VAL N 1 1 1 1004 1 1 68 VAL O O 3.760 -1.289 -1.538 1.00 . A A . 68 VAL O 1 1 1 1005 1 1 69 MET C C 1.692 -1.506 -4.781 1.00 . A A . 69 MET C 1 1 1 1006 1 1 69 MET CA C 2.253 -0.528 -3.746 1.00 . A A . 69 MET CA 1 1 1 1007 1 1 69 MET CB C 1.828 0.897 -4.106 1.00 . A A . 69 MET CB 1 1 1 1008 1 1 69 MET CE C 2.673 2.030 -0.394 1.00 . A A . 69 MET CE 1 1 1 1009 1 1 69 MET CG C 2.404 1.908 -3.113 1.00 . A A . 69 MET CG 1 1 1 1010 1 1 69 MET H H 4.171 -0.352 -4.539 1.00 . A A . 69 MET H 1 1 1 1011 1 1 69 MET HA H 1.908 -0.806 -2.750 1.00 . A A . 69 MET HA 1 1 1 1012 1 1 69 MET HB2 H 2.167 1.137 -5.114 1.00 . A A . 69 MET HB2 1 1 1 1013 1 1 69 MET HB3 H 0.740 0.965 -4.111 1.00 . A A . 69 MET HB3 1 1 1 1014 1 1 69 MET HE1 H 3.565 1.520 -0.758 1.00 . A A . 69 MET HE1 1 1 1 1015 1 1 69 MET HE2 H 2.913 3.072 -0.179 1.00 . A A . 69 MET HE2 1 1 1 1016 1 1 69 MET HE3 H 2.321 1.543 0.515 1.00 . A A . 69 MET HE3 1 1 1 1017 1 1 69 MET HG2 H 3.427 1.635 -2.855 1.00 . A A . 69 MET HG2 1 1 1 1018 1 1 69 MET HG3 H 2.444 2.897 -3.570 1.00 . A A . 69 MET HG3 1 1 1 1019 1 1 69 MET N N 3.703 -0.603 -3.692 1.00 . A A . 69 MET N 1 1 1 1020 1 1 69 MET O O 0.491 -1.768 -4.805 1.00 . A A . 69 MET O 1 1 1 1021 1 1 69 MET SD S 1.397 1.959 -1.640 1.00 . A A . 69 MET SD 1 1 1 1022 1 1 70 HIS C C 3.156 -4.154 -6.640 1.00 . A A . 70 HIS C 1 1 1 1023 1 1 70 HIS CA C 2.199 -2.960 -6.646 1.00 . A A . 70 HIS CA 1 1 1 1024 1 1 70 HIS CB C 2.122 -2.269 -8.009 1.00 . A A . 70 HIS CB 1 1 1 1025 1 1 70 HIS CD2 C 0.153 -0.586 -8.362 1.00 . A A . 70 HIS CD2 1 1 1 1026 1 1 70 HIS CE1 C 1.148 1.217 -7.624 1.00 . A A . 70 HIS CE1 1 1 1 1027 1 1 70 HIS CG C 1.416 -0.934 -7.981 1.00 . A A . 70 HIS CG 1 1 1 1028 1 1 70 HIS H H 3.565 -1.799 -5.584 1.00 . A A . 70 HIS H 1 1 1 1029 1 1 70 HIS HA H 1.197 -3.307 -6.392 1.00 . A A . 70 HIS HA 1 1 1 1030 1 1 70 HIS HB2 H 3.133 -2.126 -8.390 1.00 . A A . 70 HIS HB2 1 1 1 1031 1 1 70 HIS HB3 H 1.607 -2.927 -8.709 1.00 . A A . 70 HIS HB3 1 1 1 1032 1 1 70 HIS HD1 H 2.952 0.297 -7.170 1.00 . A A . 70 HIS HD1 1 1 1 1033 1 1 70 HIS HD2 H -0.597 -1.261 -8.775 1.00 . A A . 70 HIS HD2 1 1 1 1034 1 1 70 HIS HE1 H 1.325 2.255 -7.342 1.00 . A A . 70 HIS HE1 1 1 1 1035 1 1 70 HIS N N 2.589 -2.018 -5.611 1.00 . A A . 70 HIS N 1 1 1 1036 1 1 70 HIS ND1 N 2.018 0.223 -7.521 1.00 . A A . 70 HIS ND1 1 1 1 1037 1 1 70 HIS NE2 N -0.007 0.713 -8.145 1.00 . A A . 70 HIS NE2 1 1 1 1038 1 1 70 HIS O O 2.734 -5.292 -6.439 1.00 . A A . 70 HIS O 1 1 1 1039 1 1 71 ASP C C 5.150 -5.916 -5.793 1.00 . A A . 71 ASP C 1 1 1 1040 1 1 71 ASP CA C 5.447 -4.888 -6.887 1.00 . A A . 71 ASP CA 1 1 1 1041 1 1 71 ASP CB C 6.834 -4.300 -6.620 1.00 . A A . 71 ASP CB 1 1 1 1042 1 1 71 ASP CG C 7.992 -5.047 -7.284 1.00 . A A . 71 ASP CG 1 1 1 1043 1 1 71 ASP H H 4.762 -2.926 -7.026 1.00 . A A . 71 ASP H 1 1 1 1044 1 1 71 ASP HA H 5.397 -5.318 -7.887 1.00 . A A . 71 ASP HA 1 1 1 1045 1 1 71 ASP HB2 H 6.845 -3.265 -6.961 1.00 . A A . 71 ASP HB2 1 1 1 1046 1 1 71 ASP HB3 H 7.003 -4.282 -5.543 1.00 . A A . 71 ASP HB3 1 1 1 1047 1 1 71 ASP N N 4.427 -3.854 -6.863 1.00 . A A . 71 ASP N 1 1 1 1048 1 1 71 ASP O O 4.886 -5.551 -4.649 1.00 . A A . 71 ASP O 1 1 1 1049 1 1 71 ASP OD1 O 8.451 -6.038 -6.676 1.00 . A A . 71 ASP OD1 1 1 1 1050 1 1 71 ASP OD2 O 8.392 -4.611 -8.385 1.00 . A A . 71 ASP OD2 1 1 1 1051 1 1 72 LYS C C 6.272 -8.897 -4.828 1.00 . A A . 72 LYS C 1 1 1 1052 1 1 72 LYS CA C 4.944 -8.264 -5.251 1.00 . A A . 72 LYS CA 1 1 1 1053 1 1 72 LYS CB C 3.951 -9.261 -5.851 1.00 . A A . 72 LYS CB 1 1 1 1054 1 1 72 LYS CD C 2.752 -8.657 -7.985 1.00 . A A . 72 LYS CD 1 1 1 1055 1 1 72 LYS CE C 2.253 -7.366 -8.637 1.00 . A A . 72 LYS CE 1 1 1 1056 1 1 72 LYS CG C 2.748 -8.538 -6.460 1.00 . A A . 72 LYS CG 1 1 1 1057 1 1 72 LYS H H 5.421 -7.470 -7.116 1.00 . A A . 72 LYS H 1 1 1 1058 1 1 72 LYS HA H 4.473 -7.830 -4.369 1.00 . A A . 72 LYS HA 1 1 1 1059 1 1 72 LYS HB2 H 4.446 -9.859 -6.616 1.00 . A A . 72 LYS HB2 1 1 1 1060 1 1 72 LYS HB3 H 3.612 -9.951 -5.078 1.00 . A A . 72 LYS HB3 1 1 1 1061 1 1 72 LYS HD2 H 3.760 -8.880 -8.334 1.00 . A A . 72 LYS HD2 1 1 1 1062 1 1 72 LYS HD3 H 2.118 -9.491 -8.290 1.00 . A A . 72 LYS HD3 1 1 1 1063 1 1 72 LYS HE2 H 1.263 -7.118 -8.257 1.00 . A A . 72 LYS HE2 1 1 1 1064 1 1 72 LYS HE3 H 2.913 -6.540 -8.371 1.00 . A A . 72 LYS HE3 1 1 1 1065 1 1 72 LYS HG2 H 1.826 -8.959 -6.060 1.00 . A A . 72 LYS HG2 1 1 1 1066 1 1 72 LYS HG3 H 2.769 -7.486 -6.174 1.00 . A A . 72 LYS HG3 1 1 1 1067 1 1 72 LYS HZ1 H 3.022 -7.991 -10.471 1.00 . A A . 72 LYS HZ1 1 1 1 1068 1 1 72 LYS HZ2 H 1.395 -8.049 -10.409 1.00 . A A . 72 LYS HZ2 1 1 1 1069 1 1 72 LYS N N 5.205 -7.181 -6.184 1.00 . A A . 72 LYS N 1 1 1 1070 1 1 72 LYS NZ N 2.203 -7.515 -10.109 1.00 . A A . 72 LYS NZ 1 1 1 1071 1 1 72 LYS O O 6.391 -9.414 -3.718 1.00 . A A . 72 LYS O 1 1 1 1072 1 1 73 ASN C C 9.322 -8.459 -4.540 1.00 . A A . 73 ASN C 1 1 1 1073 1 1 73 ASN CA C 8.549 -9.397 -5.470 1.00 . A A . 73 ASN CA 1 1 1 1074 1 1 73 ASN CB C 9.354 -9.549 -6.763 1.00 . A A . 73 ASN CB 1 1 1 1075 1 1 73 ASN CG C 8.810 -10.697 -7.615 1.00 . A A . 73 ASN CG 1 1 1 1076 1 1 73 ASN H H 7.130 -8.413 -6.635 1.00 . A A . 73 ASN H 1 1 1 1077 1 1 73 ASN HA H 8.359 -10.370 -5.018 1.00 . A A . 73 ASN HA 1 1 1 1078 1 1 73 ASN HB2 H 9.315 -8.619 -7.331 1.00 . A A . 73 ASN HB2 1 1 1 1079 1 1 73 ASN HB3 H 10.401 -9.733 -6.524 1.00 . A A . 73 ASN HB3 1 1 1 1080 1 1 73 ASN HD21 H 10.031 -10.098 -9.116 1.00 . A A . 73 ASN HD21 1 1 1 1081 1 1 73 ASN HD22 H 9.050 -11.482 -9.466 1.00 . A A . 73 ASN HD22 1 1 1 1082 1 1 73 ASN N N 7.235 -8.835 -5.735 1.00 . A A . 73 ASN N 1 1 1 1083 1 1 73 ASN ND2 N 9.341 -10.765 -8.833 1.00 . A A . 73 ASN ND2 1 1 1 1084 1 1 73 ASN O O 10.383 -7.955 -4.903 1.00 . A A . 73 ASN O 1 1 1 1085 1 1 73 ASN OD1 O 7.965 -11.470 -7.195 1.00 . A A . 73 ASN OD1 1 1 1 1086 1 1 74 THR C C 9.639 -8.151 -1.075 1.00 . A A . 74 THR C 1 1 1 1087 1 1 74 THR CA C 9.381 -7.385 -2.374 1.00 . A A . 74 THR CA 1 1 1 1088 1 1 74 THR CB C 8.483 -6.160 -2.189 1.00 . A A . 74 THR CB 1 1 1 1089 1 1 74 THR CG2 C 8.274 -5.386 -3.492 1.00 . A A . 74 THR CG2 1 1 1 1090 1 1 74 THR H H 7.895 -8.668 -3.071 1.00 . A A . 74 THR H 1 1 1 1091 1 1 74 THR HA H 10.351 -7.071 -2.758 1.00 . A A . 74 THR HA 1 1 1 1092 1 1 74 THR HB H 8.870 -5.508 -1.406 1.00 . A A . 74 THR HB 1 1 1 1093 1 1 74 THR HG1 H 6.643 -6.041 -1.410 1.00 . A A . 74 THR HG1 1 1 1 1094 1 1 74 THR HG21 H 9.111 -5.574 -4.165 1.00 . A A . 74 THR HG21 1 1 1 1095 1 1 74 THR HG22 H 7.347 -5.712 -3.964 1.00 . A A . 74 THR HG22 1 1 1 1096 1 1 74 THR HG23 H 8.215 -4.319 -3.275 1.00 . A A . 74 THR HG23 1 1 1 1097 1 1 74 THR N N 8.759 -8.254 -3.359 1.00 . A A . 74 THR N 1 1 1 1098 1 1 74 THR O O 8.990 -9.161 -0.806 1.00 . A A . 74 THR O 1 1 1 1099 1 1 74 THR OG1 O 7.200 -6.710 -1.903 1.00 . A A . 74 THR OG1 1 1 1 1100 1 1 75 LYS C C 9.745 -8.183 1.915 1.00 . A A . 75 LYS C 1 1 1 1101 1 1 75 LYS CA C 10.939 -8.264 0.962 1.00 . A A . 75 LYS CA 1 1 1 1102 1 1 75 LYS CB C 12.219 -7.645 1.526 1.00 . A A . 75 LYS CB 1 1 1 1103 1 1 75 LYS CD C 13.723 -7.468 3.543 1.00 . A A . 75 LYS CD 1 1 1 1104 1 1 75 LYS CE C 14.383 -8.344 4.610 1.00 . A A . 75 LYS CE 1 1 1 1105 1 1 75 LYS CG C 12.506 -8.168 2.935 1.00 . A A . 75 LYS CG 1 1 1 1106 1 1 75 LYS H H 11.109 -6.819 -0.528 1.00 . A A . 75 LYS H 1 1 1 1107 1 1 75 LYS HA H 11.150 -9.314 0.761 1.00 . A A . 75 LYS HA 1 1 1 1108 1 1 75 LYS HB2 H 13.059 -7.877 0.871 1.00 . A A . 75 LYS HB2 1 1 1 1109 1 1 75 LYS HB3 H 12.123 -6.560 1.549 1.00 . A A . 75 LYS HB3 1 1 1 1110 1 1 75 LYS HD2 H 14.445 -7.239 2.758 1.00 . A A . 75 LYS HD2 1 1 1 1111 1 1 75 LYS HD3 H 13.420 -6.519 3.983 1.00 . A A . 75 LYS HD3 1 1 1 1112 1 1 75 LYS HE2 H 13.751 -9.206 4.823 1.00 . A A . 75 LYS HE2 1 1 1 1113 1 1 75 LYS HE3 H 15.333 -8.729 4.237 1.00 . A A . 75 LYS HE3 1 1 1 1114 1 1 75 LYS HG2 H 11.635 -8.007 3.571 1.00 . A A . 75 LYS HG2 1 1 1 1115 1 1 75 LYS HG3 H 12.680 -9.243 2.900 1.00 . A A . 75 LYS HG3 1 1 1 1116 1 1 75 LYS HZ1 H 13.969 -6.785 5.930 1.00 . A A . 75 LYS HZ1 1 1 1 1117 1 1 75 LYS HZ2 H 14.483 -8.135 6.681 1.00 . A A . 75 LYS HZ2 1 1 1 1118 1 1 75 LYS N N 10.587 -7.641 -0.303 1.00 . A A . 75 LYS N 1 1 1 1119 1 1 75 LYS NZ N 14.609 -7.568 5.850 1.00 . A A . 75 LYS NZ 1 1 1 1120 1 1 75 LYS O O 9.622 -8.994 2.832 1.00 . A A . 75 LYS O 1 1 1 1121 1 1 76 PHE C C 6.437 -7.146 1.663 1.00 . A A . 76 PHE C 1 1 1 1122 1 1 76 PHE CA C 7.715 -7.000 2.491 1.00 . A A . 76 PHE CA 1 1 1 1123 1 1 76 PHE CB C 7.806 -5.568 3.020 1.00 . A A . 76 PHE CB 1 1 1 1124 1 1 76 PHE CD1 C 8.954 -5.999 5.222 1.00 . A A . 76 PHE CD1 1 1 1 1125 1 1 76 PHE CD2 C 9.979 -4.478 3.690 1.00 . A A . 76 PHE CD2 1 1 1 1126 1 1 76 PHE CE1 C 10.031 -5.786 6.154 1.00 . A A . 76 PHE CE1 1 1 1 1127 1 1 76 PHE CE2 C 11.056 -4.265 4.621 1.00 . A A . 76 PHE CE2 1 1 1 1128 1 1 76 PHE CG C 8.950 -5.341 4.010 1.00 . A A . 76 PHE CG 1 1 1 1129 1 1 76 PHE CZ C 11.028 -4.929 5.808 1.00 . A A . 76 PHE CZ 1 1 1 1130 1 1 76 PHE H H 9.002 -6.543 0.918 1.00 . A A . 76 PHE H 1 1 1 1131 1 1 76 PHE HA H 7.721 -7.759 3.273 1.00 . A A . 76 PHE HA 1 1 1 1132 1 1 76 PHE HB2 H 7.928 -4.887 2.177 1.00 . A A . 76 PHE HB2 1 1 1 1133 1 1 76 PHE HB3 H 6.864 -5.310 3.504 1.00 . A A . 76 PHE HB3 1 1 1 1134 1 1 76 PHE HD1 H 8.141 -6.680 5.475 1.00 . A A . 76 PHE HD1 1 1 1 1135 1 1 76 PHE HD2 H 9.976 -3.958 2.731 1.00 . A A . 76 PHE HD2 1 1 1 1136 1 1 76 PHE HE1 H 10.046 -6.299 7.116 1.00 . A A . 76 PHE HE1 1 1 1 1137 1 1 76 PHE HE2 H 11.874 -3.586 4.381 1.00 . A A . 76 PHE HE2 1 1 1 1138 1 1 76 PHE HZ H 11.828 -4.848 6.587 1.00 . A A . 76 PHE HZ 1 1 1 1139 1 1 76 PHE N N 8.895 -7.198 1.666 1.00 . A A . 76 PHE N 1 1 1 1140 1 1 76 PHE O O 6.463 -6.995 0.442 1.00 . A A . 76 PHE O 1 1 1 1141 1 1 77 LYS C C 3.628 -6.272 1.095 1.00 . A A . 77 LYS C 1 1 1 1142 1 1 77 LYS CA C 4.063 -7.606 1.705 1.00 . A A . 77 LYS CA 1 1 1 1143 1 1 77 LYS CB C 3.040 -8.200 2.675 1.00 . A A . 77 LYS CB 1 1 1 1144 1 1 77 LYS CD C 1.927 -10.461 2.782 1.00 . A A . 77 LYS CD 1 1 1 1145 1 1 77 LYS CE C 1.615 -11.134 4.121 1.00 . A A . 77 LYS CE 1 1 1 1146 1 1 77 LYS CG C 3.256 -9.706 2.845 1.00 . A A . 77 LYS CG 1 1 1 1147 1 1 77 LYS H H 5.336 -7.559 3.353 1.00 . A A . 77 LYS H 1 1 1 1148 1 1 77 LYS HA H 4.199 -8.326 0.898 1.00 . A A . 77 LYS HA 1 1 1 1149 1 1 77 LYS HB2 H 3.122 -7.707 3.644 1.00 . A A . 77 LYS HB2 1 1 1 1150 1 1 77 LYS HB3 H 2.032 -8.013 2.307 1.00 . A A . 77 LYS HB3 1 1 1 1151 1 1 77 LYS HD2 H 1.124 -9.770 2.523 1.00 . A A . 77 LYS HD2 1 1 1 1152 1 1 77 LYS HD3 H 1.968 -11.212 1.994 1.00 . A A . 77 LYS HD3 1 1 1 1153 1 1 77 LYS HE2 H 1.974 -12.163 4.109 1.00 . A A . 77 LYS HE2 1 1 1 1154 1 1 77 LYS HE3 H 2.144 -10.621 4.924 1.00 . A A . 77 LYS HE3 1 1 1 1155 1 1 77 LYS HG2 H 3.923 -10.071 2.064 1.00 . A A . 77 LYS HG2 1 1 1 1156 1 1 77 LYS HG3 H 3.745 -9.902 3.799 1.00 . A A . 77 LYS HG3 1 1 1 1157 1 1 77 LYS HZ1 H -0.047 -10.941 5.363 1.00 . A A . 77 LYS HZ1 1 1 1 1158 1 1 77 LYS HZ2 H -0.313 -10.389 3.854 1.00 . A A . 77 LYS HZ2 1 1 1 1159 1 1 77 LYS N N 5.349 -7.438 2.360 1.00 . A A . 77 LYS N 1 1 1 1160 1 1 77 LYS NZ N 0.159 -11.112 4.385 1.00 . A A . 77 LYS NZ 1 1 1 1161 1 1 77 LYS O O 3.562 -5.259 1.790 1.00 . A A . 77 LYS O 1 1 1 1162 1 1 78 SER C C 1.389 -5.082 -0.999 1.00 . A A . 78 SER C 1 1 1 1163 1 1 78 SER CA C 2.916 -5.121 -0.910 1.00 . A A . 78 SER CA 1 1 1 1164 1 1 78 SER CB C 3.531 -5.065 -2.310 1.00 . A A . 78 SER CB 1 1 1 1165 1 1 78 SER H H 3.398 -7.142 -0.757 1.00 . A A . 78 SER H 1 1 1 1166 1 1 78 SER HA H 3.286 -4.284 -0.318 1.00 . A A . 78 SER HA 1 1 1 1167 1 1 78 SER HB2 H 4.001 -4.094 -2.461 1.00 . A A . 78 SER HB2 1 1 1 1168 1 1 78 SER HB3 H 4.317 -5.816 -2.391 1.00 . A A . 78 SER HB3 1 1 1 1169 1 1 78 SER HG H 3.009 -5.378 -4.217 1.00 . A A . 78 SER HG 1 1 1 1170 1 1 78 SER N N 3.342 -6.314 -0.198 1.00 . A A . 78 SER N 1 1 1 1171 1 1 78 SER O O 0.727 -6.102 -0.810 1.00 . A A . 78 SER O 1 1 1 1172 1 1 78 SER OG O 2.559 -5.286 -3.329 1.00 . A A . 78 SER OG 1 1 1 1173 1 1 79 CYS C C -1.115 -4.806 -2.315 1.00 . A A . 79 CYS C 1 1 1 1174 1 1 79 CYS CA C -0.562 -3.711 -1.402 1.00 . A A . 79 CYS CA 1 1 1 1175 1 1 79 CYS CB C -0.913 -2.311 -1.911 1.00 . A A . 79 CYS CB 1 1 1 1176 1 1 79 CYS H H 1.420 -3.072 -1.438 1.00 . A A . 79 CYS H 1 1 1 1177 1 1 79 CYS HA H -0.971 -3.802 -0.396 1.00 . A A . 79 CYS HA 1 1 1 1178 1 1 79 CYS HB2 H -0.584 -2.224 -2.947 1.00 . A A . 79 CYS HB2 1 1 1 1179 1 1 79 CYS HB3 H -1.997 -2.201 -1.911 1.00 . A A . 79 CYS HB3 1 1 1 1180 1 1 79 CYS N N 0.875 -3.896 -1.286 1.00 . A A . 79 CYS N 1 1 1 1181 1 1 79 CYS O O -1.869 -5.670 -1.868 1.00 . A A . 79 CYS O 1 1 1 1182 1 1 79 CYS SG S -0.184 -0.938 -0.947 1.00 . A A . 79 CYS SG 1 1 1 1183 1 1 80 VAL C C -0.644 -7.095 -4.169 1.00 . A A . 80 VAL C 1 1 1 1184 1 1 80 VAL CA C -1.167 -5.710 -4.558 1.00 . A A . 80 VAL CA 1 1 1 1185 1 1 80 VAL CB C -0.733 -5.279 -5.960 1.00 . A A . 80 VAL CB 1 1 1 1186 1 1 80 VAL CG1 C -1.062 -6.360 -6.992 1.00 . A A . 80 VAL CG1 1 1 1 1187 1 1 80 VAL CG2 C -1.370 -3.942 -6.344 1.00 . A A . 80 VAL CG2 1 1 1 1188 1 1 80 VAL H H -0.106 -4.030 -3.933 1.00 . A A . 80 VAL H 1 1 1 1189 1 1 80 VAL HA H -2.257 -5.727 -4.532 1.00 . A A . 80 VAL HA 1 1 1 1190 1 1 80 VAL HB H 0.348 -5.144 -5.950 1.00 . A A . 80 VAL HB 1 1 1 1191 1 1 80 VAL HG11 H -2.017 -6.823 -6.742 1.00 . A A . 80 VAL HG11 1 1 1 1192 1 1 80 VAL HG12 H -1.126 -5.909 -7.983 1.00 . A A . 80 VAL HG12 1 1 1 1193 1 1 80 VAL HG13 H -0.278 -7.117 -6.988 1.00 . A A . 80 VAL HG13 1 1 1 1194 1 1 80 VAL HG21 H -2.352 -3.860 -5.878 1.00 . A A . 80 VAL HG21 1 1 1 1195 1 1 80 VAL HG22 H -0.735 -3.125 -6.001 1.00 . A A . 80 VAL HG22 1 1 1 1196 1 1 80 VAL HG23 H -1.477 -3.888 -7.428 1.00 . A A . 80 VAL HG23 1 1 1 1197 1 1 80 VAL N N -0.720 -4.735 -3.578 1.00 . A A . 80 VAL N 1 1 1 1198 1 1 80 VAL O O -1.324 -8.099 -4.372 1.00 . A A . 80 VAL O 1 1 1 1199 1 1 81 GLY C C 0.251 -9.148 -2.288 1.00 . A A . 81 GLY C 1 1 1 1200 1 1 81 GLY CA C 1.184 -8.348 -3.200 1.00 . A A . 81 GLY CA 1 1 1 1201 1 1 81 GLY H H 1.108 -6.282 -3.456 1.00 . A A . 81 GLY H 1 1 1 1202 1 1 81 GLY HA2 H 1.439 -8.943 -4.076 1.00 . A A . 81 GLY HA2 1 1 1 1203 1 1 81 GLY HA3 H 2.115 -8.134 -2.676 1.00 . A A . 81 GLY HA3 1 1 1 1204 1 1 81 GLY N N 0.561 -7.103 -3.618 1.00 . A A . 81 GLY N 1 1 1 1205 1 1 81 GLY O O -0.113 -10.279 -2.605 1.00 . A A . 81 GLY O 1 1 1 1206 1 1 82 CYS C C -2.345 -9.399 -0.884 1.00 . A A . 82 CYS C 1 1 1 1207 1 1 82 CYS CA C -0.990 -9.170 -0.212 1.00 . A A . 82 CYS CA 1 1 1 1208 1 1 82 CYS CB C -1.121 -8.347 1.071 1.00 . A A . 82 CYS CB 1 1 1 1209 1 1 82 CYS H H 0.193 -7.609 -0.922 1.00 . A A . 82 CYS H 1 1 1 1210 1 1 82 CYS HA H -0.525 -10.118 0.056 1.00 . A A . 82 CYS HA 1 1 1 1211 1 1 82 CYS HB2 H -0.134 -8.148 1.488 1.00 . A A . 82 CYS HB2 1 1 1 1212 1 1 82 CYS HB3 H -1.575 -7.381 0.850 1.00 . A A . 82 CYS HB3 1 1 1 1213 1 1 82 CYS N N -0.108 -8.529 -1.173 1.00 . A A . 82 CYS N 1 1 1 1214 1 1 82 CYS O O -2.926 -10.478 -0.767 1.00 . A A . 82 CYS O 1 1 1 1215 1 1 82 CYS SG S -2.143 -9.251 2.292 1.00 . A A . 82 CYS SG 1 1 1 1216 1 1 83 HIS C C -4.109 -9.676 -3.169 1.00 . A A . 83 HIS C 1 1 1 1217 1 1 83 HIS CA C -4.087 -8.443 -2.263 1.00 . A A . 83 HIS CA 1 1 1 1218 1 1 83 HIS CB C -4.373 -7.145 -3.021 1.00 . A A . 83 HIS CB 1 1 1 1219 1 1 83 HIS CD2 C -4.748 -5.776 -0.826 1.00 . A A . 83 HIS CD2 1 1 1 1220 1 1 83 HIS CE1 C -6.052 -4.222 -1.648 1.00 . A A . 83 HIS CE1 1 1 1 1221 1 1 83 HIS CG C -4.919 -6.036 -2.155 1.00 . A A . 83 HIS CG 1 1 1 1222 1 1 83 HIS H H -2.333 -7.494 -1.663 1.00 . A A . 83 HIS H 1 1 1 1223 1 1 83 HIS HA H -4.852 -8.554 -1.494 1.00 . A A . 83 HIS HA 1 1 1 1224 1 1 83 HIS HB2 H -3.453 -6.804 -3.495 1.00 . A A . 83 HIS HB2 1 1 1 1225 1 1 83 HIS HB3 H -5.085 -7.352 -3.820 1.00 . A A . 83 HIS HB3 1 1 1 1226 1 1 83 HIS HD1 H -6.058 -4.952 -3.590 1.00 . A A . 83 HIS HD1 1 1 1 1227 1 1 83 HIS HD2 H -4.151 -6.368 -0.133 1.00 . A A . 83 HIS HD2 1 1 1 1228 1 1 83 HIS HE1 H -6.687 -3.339 -1.715 1.00 . A A . 83 HIS HE1 1 1 1 1229 1 1 83 HIS N N -2.811 -8.368 -1.573 1.00 . A A . 83 HIS N 1 1 1 1230 1 1 83 HIS ND1 N -5.745 -5.040 -2.645 1.00 . A A . 83 HIS ND1 1 1 1 1231 1 1 83 HIS NE2 N -5.432 -4.680 -0.522 1.00 . A A . 83 HIS NE2 1 1 1 1232 1 1 83 HIS O O -5.097 -10.407 -3.205 1.00 . A A . 83 HIS O 1 1 1 1233 1 1 84 VAL C C -3.108 -12.297 -4.001 1.00 . A A . 84 VAL C 1 1 1 1234 1 1 84 VAL CA C -2.886 -11.000 -4.782 1.00 . A A . 84 VAL CA 1 1 1 1235 1 1 84 VAL CB C -1.535 -10.956 -5.498 1.00 . A A . 84 VAL CB 1 1 1 1236 1 1 84 VAL CG1 C -1.296 -12.240 -6.296 1.00 . A A . 84 VAL CG1 1 1 1 1237 1 1 84 VAL CG2 C -1.431 -9.724 -6.398 1.00 . A A . 84 VAL CG2 1 1 1 1238 1 1 84 VAL H H -2.207 -9.269 -3.843 1.00 . A A . 84 VAL H 1 1 1 1239 1 1 84 VAL HA H -3.670 -10.905 -5.534 1.00 . A A . 84 VAL HA 1 1 1 1240 1 1 84 VAL HB H -0.756 -10.884 -4.739 1.00 . A A . 84 VAL HB 1 1 1 1241 1 1 84 VAL HG11 H -2.242 -12.761 -6.439 1.00 . A A . 84 VAL HG11 1 1 1 1242 1 1 84 VAL HG12 H -0.869 -11.989 -7.267 1.00 . A A . 84 VAL HG12 1 1 1 1243 1 1 84 VAL HG13 H -0.605 -12.883 -5.751 1.00 . A A . 84 VAL HG13 1 1 1 1244 1 1 84 VAL HG21 H -2.228 -9.024 -6.149 1.00 . A A . 84 VAL HG21 1 1 1 1245 1 1 84 VAL HG22 H -0.464 -9.243 -6.245 1.00 . A A . 84 VAL HG22 1 1 1 1246 1 1 84 VAL HG23 H -1.525 -10.026 -7.441 1.00 . A A . 84 VAL HG23 1 1 1 1247 1 1 84 VAL N N -3.007 -9.869 -3.878 1.00 . A A . 84 VAL N 1 1 1 1248 1 1 84 VAL O O -3.716 -13.237 -4.511 1.00 . A A . 84 VAL O 1 1 1 1249 1 1 85 GLU C C -4.167 -13.577 -1.387 1.00 . A A . 85 GLU C 1 1 1 1250 1 1 85 GLU CA C -2.737 -13.472 -1.920 1.00 . A A . 85 GLU CA 1 1 1 1251 1 1 85 GLU CB C -1.725 -13.430 -0.773 1.00 . A A . 85 GLU CB 1 1 1 1252 1 1 85 GLU CD C -0.357 -15.420 -0.048 1.00 . A A . 85 GLU CD 1 1 1 1253 1 1 85 GLU CG C -0.508 -14.303 -1.083 1.00 . A A . 85 GLU CG 1 1 1 1254 1 1 85 GLU H H -2.109 -11.537 -2.369 1.00 . A A . 85 GLU H 1 1 1 1255 1 1 85 GLU HA H -2.517 -14.328 -2.559 1.00 . A A . 85 GLU HA 1 1 1 1256 1 1 85 GLU HB2 H -1.406 -12.402 -0.603 1.00 . A A . 85 GLU HB2 1 1 1 1257 1 1 85 GLU HB3 H -2.199 -13.773 0.147 1.00 . A A . 85 GLU HB3 1 1 1 1258 1 1 85 GLU HG2 H -0.610 -14.736 -2.078 1.00 . A A . 85 GLU HG2 1 1 1 1259 1 1 85 GLU HG3 H 0.392 -13.689 -1.093 1.00 . A A . 85 GLU HG3 1 1 1 1260 1 1 85 GLU N N -2.602 -12.306 -2.776 1.00 . A A . 85 GLU N 1 1 1 1261 1 1 85 GLU O O -4.686 -14.677 -1.203 1.00 . A A . 85 GLU O 1 1 1 1262 1 1 85 GLU OE1 O -1.103 -16.416 -0.175 1.00 . A A . 85 GLU OE1 1 1 1 1263 1 1 85 GLU OE2 O 0.500 -15.254 0.846 1.00 . A A . 85 GLU OE2 1 1 1 1264 1 1 86 VAL C C -7.098 -12.733 -1.766 1.00 . A A . 86 VAL C 1 1 1 1265 1 1 86 VAL CA C -6.124 -12.365 -0.645 1.00 . A A . 86 VAL CA 1 1 1 1266 1 1 86 VAL CB C -6.403 -10.988 -0.039 1.00 . A A . 86 VAL CB 1 1 1 1267 1 1 86 VAL CG1 C -7.836 -10.902 0.491 1.00 . A A . 86 VAL CG1 1 1 1 1268 1 1 86 VAL CG2 C -5.391 -10.658 1.060 1.00 . A A . 86 VAL CG2 1 1 1 1269 1 1 86 VAL H H -4.335 -11.527 -1.307 1.00 . A A . 86 VAL H 1 1 1 1270 1 1 86 VAL HA H -6.207 -13.107 0.149 1.00 . A A . 86 VAL HA 1 1 1 1271 1 1 86 VAL HB H -6.293 -10.245 -0.829 1.00 . A A . 86 VAL HB 1 1 1 1272 1 1 86 VAL HG11 H -8.531 -11.214 -0.289 1.00 . A A . 86 VAL HG11 1 1 1 1273 1 1 86 VAL HG12 H -7.943 -11.557 1.356 1.00 . A A . 86 VAL HG12 1 1 1 1274 1 1 86 VAL HG13 H -8.054 -9.875 0.783 1.00 . A A . 86 VAL HG13 1 1 1 1275 1 1 86 VAL HG21 H -4.513 -11.293 0.949 1.00 . A A . 86 VAL HG21 1 1 1 1276 1 1 86 VAL HG22 H -5.096 -9.612 0.979 1.00 . A A . 86 VAL HG22 1 1 1 1277 1 1 86 VAL HG23 H -5.845 -10.833 2.036 1.00 . A A . 86 VAL HG23 1 1 1 1278 1 1 86 VAL N N -4.764 -12.417 -1.154 1.00 . A A . 86 VAL N 1 1 1 1279 1 1 86 VAL O O -7.925 -13.629 -1.605 1.00 . A A . 86 VAL O 1 1 1 1280 1 1 87 ALA C C -7.510 -13.639 -4.613 1.00 . A A . 87 ALA C 1 1 1 1281 1 1 87 ALA CA C -7.827 -12.263 -4.024 1.00 . A A . 87 ALA CA 1 1 1 1282 1 1 87 ALA CB C -7.644 -11.137 -5.043 1.00 . A A . 87 ALA CB 1 1 1 1283 1 1 87 ALA H H -6.293 -11.295 -3.000 1.00 . A A . 87 ALA H 1 1 1 1284 1 1 87 ALA HA H -8.859 -12.256 -3.673 1.00 . A A . 87 ALA HA 1 1 1 1285 1 1 87 ALA HB1 H -7.778 -10.174 -4.549 1.00 . A A . 87 ALA HB1 1 1 1 1286 1 1 87 ALA HB2 H -6.642 -11.190 -5.469 1.00 . A A . 87 ALA HB2 1 1 1 1287 1 1 87 ALA HB3 H -8.383 -11.243 -5.838 1.00 . A A . 87 ALA HB3 1 1 1 1288 1 1 87 ALA N N -6.968 -12.023 -2.877 1.00 . A A . 87 ALA N 1 1 1 1289 1 1 87 ALA O O -8.411 -14.352 -5.053 1.00 . A A . 87 ALA O 1 1 1 1290 1 1 88 GLY C C -6.564 -15.626 -6.390 1.00 . A A . 88 GLY C 1 1 1 1291 1 1 88 GLY CA C -5.781 -15.249 -5.130 1.00 . A A . 88 GLY CA 1 1 1 1292 1 1 88 GLY H H -5.501 -13.386 -4.242 1.00 . A A . 88 GLY H 1 1 1 1293 1 1 88 GLY HA2 H -4.717 -15.200 -5.361 1.00 . A A . 88 GLY HA2 1 1 1 1294 1 1 88 GLY HA3 H -5.907 -16.024 -4.374 1.00 . A A . 88 GLY HA3 1 1 1 1295 1 1 88 GLY N N -6.227 -13.971 -4.602 1.00 . A A . 88 GLY N 1 1 1 1296 1 1 88 GLY O O -6.567 -14.881 -7.369 1.00 . A A . 88 GLY O 1 1 1 1297 1 1 89 ALA C C -9.474 -17.274 -7.063 1.00 . A A . 89 ALA C 1 1 1 1298 1 1 89 ALA CA C -7.992 -17.266 -7.447 1.00 . A A . 89 ALA CA 1 1 1 1299 1 1 89 ALA CB C -7.490 -18.651 -7.861 1.00 . A A . 89 ALA CB 1 1 1 1300 1 1 89 ALA H H -7.201 -17.381 -5.524 1.00 . A A . 89 ALA H 1 1 1 1301 1 1 89 ALA HA H -7.844 -16.576 -8.278 1.00 . A A . 89 ALA HA 1 1 1 1302 1 1 89 ALA HB1 H -7.207 -19.215 -6.972 1.00 . A A . 89 ALA HB1 1 1 1 1303 1 1 89 ALA HB2 H -8.282 -19.181 -8.391 1.00 . A A . 89 ALA HB2 1 1 1 1304 1 1 89 ALA HB3 H -6.625 -18.543 -8.514 1.00 . A A . 89 ALA HB3 1 1 1 1305 1 1 89 ALA N N -7.208 -16.781 -6.324 1.00 . A A . 89 ALA N 1 1 1 1306 1 1 89 ALA O O -10.112 -18.325 -7.060 1.00 . A A . 89 ALA O 1 1 1 1307 1 1 90 ASP C C -12.121 -15.181 -7.458 1.00 . A A . 90 ASP C 1 1 1 1308 1 1 90 ASP CA C -11.371 -15.946 -6.366 1.00 . A A . 90 ASP CA 1 1 1 1309 1 1 90 ASP CB C -11.505 -15.158 -5.061 1.00 . A A . 90 ASP CB 1 1 1 1310 1 1 90 ASP CG C -12.757 -15.473 -4.241 1.00 . A A . 90 ASP CG 1 1 1 1311 1 1 90 ASP H H -9.451 -15.238 -6.756 1.00 . A A . 90 ASP H 1 1 1 1312 1 1 90 ASP HA H -11.740 -16.964 -6.241 1.00 . A A . 90 ASP HA 1 1 1 1313 1 1 90 ASP HB2 H -10.627 -15.353 -4.445 1.00 . A A . 90 ASP HB2 1 1 1 1314 1 1 90 ASP HB3 H -11.500 -14.093 -5.295 1.00 . A A . 90 ASP HB3 1 1 1 1315 1 1 90 ASP N N -9.977 -16.089 -6.750 1.00 . A A . 90 ASP N 1 1 1 1316 1 1 90 ASP O O -13.350 -15.210 -7.509 1.00 . A A . 90 ASP O 1 1 1 1317 1 1 90 ASP OD1 O -13.626 -16.188 -4.784 1.00 . A A . 90 ASP OD1 1 1 1 1318 1 1 90 ASP OD2 O -12.817 -14.991 -3.089 1.00 . A A . 90 ASP OD2 1 1 1 1319 1 1 91 ALA C C -12.816 -12.642 -8.818 1.00 . A A . 91 ALA C 1 1 1 1320 1 1 91 ALA CA C -11.927 -13.745 -9.395 1.00 . A A . 91 ALA CA 1 1 1 1321 1 1 91 ALA CB C -12.692 -14.680 -10.333 1.00 . A A . 91 ALA CB 1 1 1 1322 1 1 91 ALA H H -10.352 -14.498 -8.258 1.00 . A A . 91 ALA H 1 1 1 1323 1 1 91 ALA HA H -11.106 -13.287 -9.948 1.00 . A A . 91 ALA HA 1 1 1 1324 1 1 91 ALA HB1 H -12.015 -15.440 -10.722 1.00 . A A . 91 ALA HB1 1 1 1 1325 1 1 91 ALA HB2 H -13.502 -15.161 -9.785 1.00 . A A . 91 ALA HB2 1 1 1 1326 1 1 91 ALA HB3 H -13.106 -14.104 -11.161 1.00 . A A . 91 ALA HB3 1 1 1 1327 1 1 91 ALA N N -11.350 -14.516 -8.306 1.00 . A A . 91 ALA N 1 1 1 1328 1 1 91 ALA O O -13.451 -12.830 -7.782 1.00 . A A . 91 ALA O 1 1 1 1329 1 1 92 ALA C C -12.849 -9.575 -8.043 1.00 . A A . 92 ALA C 1 1 1 1330 1 1 92 ALA CA C -13.632 -10.380 -9.083 1.00 . A A . 92 ALA CA 1 1 1 1331 1 1 92 ALA CB C -14.975 -10.878 -8.545 1.00 . A A . 92 ALA CB 1 1 1 1332 1 1 92 ALA H H -12.311 -11.369 -10.355 1.00 . A A . 92 ALA H 1 1 1 1333 1 1 92 ALA HA H -13.813 -9.752 -9.955 1.00 . A A . 92 ALA HA 1 1 1 1334 1 1 92 ALA HB1 H -15.163 -11.886 -8.914 1.00 . A A . 92 ALA HB1 1 1 1 1335 1 1 92 ALA HB2 H -14.949 -10.889 -7.455 1.00 . A A . 92 ALA HB2 1 1 1 1336 1 1 92 ALA HB3 H -15.770 -10.214 -8.883 1.00 . A A . 92 ALA HB3 1 1 1 1337 1 1 92 ALA N N -12.831 -11.514 -9.513 1.00 . A A . 92 ALA N 1 1 1 1338 1 1 92 ALA O O -12.722 -8.358 -8.162 1.00 . A A . 92 ALA O 1 1 1 1339 1 1 93 LYS C C -10.271 -9.114 -6.561 1.00 . A A . 93 LYS C 1 1 1 1340 1 1 93 LYS CA C -11.580 -9.655 -5.985 1.00 . A A . 93 LYS CA 1 1 1 1341 1 1 93 LYS CB C -11.385 -10.622 -4.815 1.00 . A A . 93 LYS CB 1 1 1 1342 1 1 93 LYS CD C -12.536 -11.397 -2.710 1.00 . A A . 93 LYS CD 1 1 1 1343 1 1 93 LYS CE C -13.675 -10.867 -1.836 1.00 . A A . 93 LYS CE 1 1 1 1344 1 1 93 LYS CG C -12.725 -10.979 -4.169 1.00 . A A . 93 LYS CG 1 1 1 1345 1 1 93 LYS H H -12.454 -11.278 -6.956 1.00 . A A . 93 LYS H 1 1 1 1346 1 1 93 LYS HA H -12.168 -8.815 -5.614 1.00 . A A . 93 LYS HA 1 1 1 1347 1 1 93 LYS HB2 H -10.893 -11.529 -5.166 1.00 . A A . 93 LYS HB2 1 1 1 1348 1 1 93 LYS HB3 H -10.728 -10.170 -4.072 1.00 . A A . 93 LYS HB3 1 1 1 1349 1 1 93 LYS HD2 H -12.496 -12.484 -2.641 1.00 . A A . 93 LYS HD2 1 1 1 1350 1 1 93 LYS HD3 H -11.583 -11.019 -2.340 1.00 . A A . 93 LYS HD3 1 1 1 1351 1 1 93 LYS HE2 H -14.632 -11.066 -2.316 1.00 . A A . 93 LYS HE2 1 1 1 1352 1 1 93 LYS HE3 H -13.682 -11.392 -0.881 1.00 . A A . 93 LYS HE3 1 1 1 1353 1 1 93 LYS HG2 H -13.398 -10.123 -4.222 1.00 . A A . 93 LYS HG2 1 1 1 1354 1 1 93 LYS HG3 H -13.196 -11.790 -4.726 1.00 . A A . 93 LYS HG3 1 1 1 1355 1 1 93 LYS HZ1 H -13.676 -8.877 -2.455 1.00 . A A . 93 LYS HZ1 1 1 1 1356 1 1 93 LYS HZ2 H -14.173 -9.065 -0.916 1.00 . A A . 93 LYS HZ2 1 1 1 1357 1 1 93 LYS N N -12.346 -10.288 -7.045 1.00 . A A . 93 LYS N 1 1 1 1358 1 1 93 LYS NZ N -13.519 -9.413 -1.609 1.00 . A A . 93 LYS NZ 1 1 1 1359 1 1 93 LYS O O -9.884 -7.982 -6.276 1.00 . A A . 93 LYS O 1 1 1 1360 1 1 94 LYS C C -8.607 -8.405 -8.944 1.00 . A A . 94 LYS C 1 1 1 1361 1 1 94 LYS CA C -8.365 -9.568 -7.980 1.00 . A A . 94 LYS CA 1 1 1 1362 1 1 94 LYS CB C -7.701 -10.781 -8.634 1.00 . A A . 94 LYS CB 1 1 1 1363 1 1 94 LYS CD C -5.549 -12.083 -8.453 1.00 . A A . 94 LYS CD 1 1 1 1364 1 1 94 LYS CE C -4.941 -12.494 -9.795 1.00 . A A . 94 LYS CE 1 1 1 1365 1 1 94 LYS CG C -6.177 -10.690 -8.539 1.00 . A A . 94 LYS CG 1 1 1 1366 1 1 94 LYS H H -9.945 -10.868 -7.589 1.00 . A A . 94 LYS H 1 1 1 1367 1 1 94 LYS HA H -7.701 -9.226 -7.186 1.00 . A A . 94 LYS HA 1 1 1 1368 1 1 94 LYS HB2 H -8.046 -11.695 -8.150 1.00 . A A . 94 LYS HB2 1 1 1 1369 1 1 94 LYS HB3 H -8.001 -10.844 -9.681 1.00 . A A . 94 LYS HB3 1 1 1 1370 1 1 94 LYS HD2 H -4.778 -12.091 -7.683 1.00 . A A . 94 LYS HD2 1 1 1 1371 1 1 94 LYS HD3 H -6.305 -12.809 -8.154 1.00 . A A . 94 LYS HD3 1 1 1 1372 1 1 94 LYS HE2 H -5.023 -13.573 -9.923 1.00 . A A . 94 LYS HE2 1 1 1 1373 1 1 94 LYS HE3 H -5.500 -12.033 -10.610 1.00 . A A . 94 LYS HE3 1 1 1 1374 1 1 94 LYS HG2 H -5.785 -10.164 -9.409 1.00 . A A . 94 LYS HG2 1 1 1 1375 1 1 94 LYS HG3 H -5.898 -10.107 -7.661 1.00 . A A . 94 LYS HG3 1 1 1 1376 1 1 94 LYS HZ1 H -3.170 -11.770 -8.970 1.00 . A A . 94 LYS HZ1 1 1 1 1377 1 1 94 LYS HZ2 H -2.921 -12.849 -10.165 1.00 . A A . 94 LYS HZ2 1 1 1 1378 1 1 94 LYS N N -9.624 -9.948 -7.362 1.00 . A A . 94 LYS N 1 1 1 1379 1 1 94 LYS NZ N -3.520 -12.086 -9.868 1.00 . A A . 94 LYS NZ 1 1 1 1380 1 1 94 LYS O O -7.659 -7.795 -9.436 1.00 . A A . 94 LYS O 1 1 1 1381 1 1 95 LYS C C -10.601 -5.808 -9.258 1.00 . A A . 95 LYS C 1 1 1 1382 1 1 95 LYS CA C -10.259 -7.052 -10.081 1.00 . A A . 95 LYS CA 1 1 1 1383 1 1 95 LYS CB C -11.384 -7.501 -11.015 1.00 . A A . 95 LYS CB 1 1 1 1384 1 1 95 LYS CD C -11.829 -8.053 -13.435 1.00 . A A . 95 LYS CD 1 1 1 1385 1 1 95 LYS CE C -10.881 -9.022 -14.144 1.00 . A A . 95 LYS CE 1 1 1 1386 1 1 95 LYS CG C -11.065 -7.146 -12.468 1.00 . A A . 95 LYS CG 1 1 1 1387 1 1 95 LYS H H -10.646 -8.632 -8.779 1.00 . A A . 95 LYS H 1 1 1 1388 1 1 95 LYS HA H -9.393 -6.827 -10.704 1.00 . A A . 95 LYS HA 1 1 1 1389 1 1 95 LYS HB2 H -11.531 -8.577 -10.923 1.00 . A A . 95 LYS HB2 1 1 1 1390 1 1 95 LYS HB3 H -12.319 -7.027 -10.718 1.00 . A A . 95 LYS HB3 1 1 1 1391 1 1 95 LYS HD2 H -12.588 -8.614 -12.890 1.00 . A A . 95 LYS HD2 1 1 1 1392 1 1 95 LYS HD3 H -12.352 -7.445 -14.173 1.00 . A A . 95 LYS HD3 1 1 1 1393 1 1 95 LYS HE2 H -11.080 -9.017 -15.215 1.00 . A A . 95 LYS HE2 1 1 1 1394 1 1 95 LYS HE3 H -9.850 -8.694 -14.010 1.00 . A A . 95 LYS HE3 1 1 1 1395 1 1 95 LYS HG2 H -11.325 -6.105 -12.658 1.00 . A A . 95 LYS HG2 1 1 1 1396 1 1 95 LYS HG3 H -9.993 -7.244 -12.643 1.00 . A A . 95 LYS HG3 1 1 1 1397 1 1 95 LYS HZ1 H -10.980 -10.415 -12.597 1.00 . A A . 95 LYS HZ1 1 1 1 1398 1 1 95 LYS HZ2 H -11.945 -10.791 -13.854 1.00 . A A . 95 LYS HZ2 1 1 1 1399 1 1 95 LYS N N -9.881 -8.132 -9.184 1.00 . A A . 95 LYS N 1 1 1 1400 1 1 95 LYS NZ N -11.045 -10.392 -13.608 1.00 . A A . 95 LYS NZ 1 1 1 1401 1 1 95 LYS O O -10.684 -4.706 -9.798 1.00 . A A . 95 LYS O 1 1 1 1402 1 1 96 ASP C C -10.082 -4.870 -5.946 1.00 . A A . 96 ASP C 1 1 1 1403 1 1 96 ASP CA C -11.124 -4.937 -7.063 1.00 . A A . 96 ASP CA 1 1 1 1404 1 1 96 ASP CB C -12.495 -5.154 -6.419 1.00 . A A . 96 ASP CB 1 1 1 1405 1 1 96 ASP CG C -13.582 -4.176 -6.868 1.00 . A A . 96 ASP CG 1 1 1 1406 1 1 96 ASP H H -10.723 -6.926 -7.534 1.00 . A A . 96 ASP H 1 1 1 1407 1 1 96 ASP HA H -11.128 -4.042 -7.685 1.00 . A A . 96 ASP HA 1 1 1 1408 1 1 96 ASP HB2 H -12.826 -6.169 -6.639 1.00 . A A . 96 ASP HB2 1 1 1 1409 1 1 96 ASP HB3 H -12.386 -5.082 -5.337 1.00 . A A . 96 ASP HB3 1 1 1 1410 1 1 96 ASP N N -10.792 -6.027 -7.965 1.00 . A A . 96 ASP N 1 1 1 1411 1 1 96 ASP O O -10.215 -4.078 -5.014 1.00 . A A . 96 ASP O 1 1 1 1412 1 1 96 ASP OD1 O -13.701 -3.984 -8.097 1.00 . A A . 96 ASP OD1 1 1 1 1413 1 1 96 ASP OD2 O -14.271 -3.643 -5.971 1.00 . A A . 96 ASP OD2 1 1 1 1414 1 1 97 LEU C C -6.660 -5.510 -5.779 1.00 . A A . 97 LEU C 1 1 1 1415 1 1 97 LEU CA C -8.002 -5.758 -5.088 1.00 . A A . 97 LEU CA 1 1 1 1416 1 1 97 LEU CB C -8.056 -7.071 -4.303 1.00 . A A . 97 LEU CB 1 1 1 1417 1 1 97 LEU CD1 C -8.951 -8.351 -2.324 1.00 . A A . 97 LEU CD1 1 1 1 1418 1 1 97 LEU CD2 C -9.487 -5.887 -2.598 1.00 . A A . 97 LEU CD2 1 1 1 1419 1 1 97 LEU CG C -9.212 -7.212 -3.311 1.00 . A A . 97 LEU CG 1 1 1 1420 1 1 97 LEU H H -8.965 -6.352 -6.837 1.00 . A A . 97 LEU H 1 1 1 1421 1 1 97 LEU HA H -8.179 -4.951 -4.378 1.00 . A A . 97 LEU HA 1 1 1 1422 1 1 97 LEU HB2 H -8.111 -7.894 -5.015 1.00 . A A . 97 LEU HB2 1 1 1 1423 1 1 97 LEU HB3 H -7.119 -7.183 -3.757 1.00 . A A . 97 LEU HB3 1 1 1 1424 1 1 97 LEU HD11 H -7.905 -8.335 -2.018 1.00 . A A . 97 LEU HD11 1 1 1 1425 1 1 97 LEU HD12 H -9.588 -8.226 -1.448 1.00 . A A . 97 LEU HD12 1 1 1 1426 1 1 97 LEU HD13 H -9.175 -9.305 -2.802 1.00 . A A . 97 LEU HD13 1 1 1 1427 1 1 97 LEU HD21 H -8.550 -5.347 -2.460 1.00 . A A . 97 LEU HD21 1 1 1 1428 1 1 97 LEU HD22 H -10.168 -5.285 -3.199 1.00 . A A . 97 LEU HD22 1 1 1 1429 1 1 97 LEU HD23 H -9.939 -6.084 -1.626 1.00 . A A . 97 LEU HD23 1 1 1 1430 1 1 97 LEU HG H -10.112 -7.470 -3.870 1.00 . A A . 97 LEU HG 1 1 1 1431 1 1 97 LEU N N -9.066 -5.712 -6.076 1.00 . A A . 97 LEU N 1 1 1 1432 1 1 97 LEU O O -5.835 -4.744 -5.284 1.00 . A A . 97 LEU O 1 1 1 1433 1 1 98 THR C C -5.554 -5.487 -9.074 1.00 . A A . 98 THR C 1 1 1 1434 1 1 98 THR CA C -5.254 -6.034 -7.677 1.00 . A A . 98 THR CA 1 1 1 1435 1 1 98 THR CB C -4.552 -7.393 -7.694 1.00 . A A . 98 THR CB 1 1 1 1436 1 1 98 THR CG2 C -4.670 -8.130 -6.359 1.00 . A A . 98 THR CG2 1 1 1 1437 1 1 98 THR H H -7.159 -6.794 -7.309 1.00 . A A . 98 THR H 1 1 1 1438 1 1 98 THR HA H -4.620 -5.302 -7.177 1.00 . A A . 98 THR HA 1 1 1 1439 1 1 98 THR HB H -3.508 -7.288 -7.990 1.00 . A A . 98 THR HB 1 1 1 1440 1 1 98 THR HG1 H -4.895 -8.203 -9.491 1.00 . A A . 98 THR HG1 1 1 1 1441 1 1 98 THR HG21 H -5.722 -8.245 -6.099 1.00 . A A . 98 THR HG21 1 1 1 1442 1 1 98 THR HG22 H -4.207 -9.113 -6.444 1.00 . A A . 98 THR HG22 1 1 1 1443 1 1 98 THR HG23 H -4.165 -7.556 -5.581 1.00 . A A . 98 THR HG23 1 1 1 1444 1 1 98 THR N N -6.482 -6.173 -6.913 1.00 . A A . 98 THR N 1 1 1 1445 1 1 98 THR O O -4.661 -5.401 -9.916 1.00 . A A . 98 THR O 1 1 1 1446 1 1 98 THR OG1 O -5.333 -8.176 -8.593 1.00 . A A . 98 THR OG1 1 1 1 1447 1 1 99 GLY C C -6.499 -3.299 -10.887 1.00 . A A . 99 GLY C 1 1 1 1448 1 1 99 GLY CA C -7.243 -4.595 -10.558 1.00 . A A . 99 GLY CA 1 1 1 1449 1 1 99 GLY H H -7.534 -5.204 -8.587 1.00 . A A . 99 GLY H 1 1 1 1450 1 1 99 GLY HA2 H -7.064 -5.331 -11.342 1.00 . A A . 99 GLY HA2 1 1 1 1451 1 1 99 GLY HA3 H -8.317 -4.407 -10.536 1.00 . A A . 99 GLY HA3 1 1 1 1452 1 1 99 GLY N N -6.814 -5.131 -9.277 1.00 . A A . 99 GLY N 1 1 1 1453 1 1 99 GLY O O -6.198 -2.509 -9.994 1.00 . A A . 99 GLY O 1 1 1 1454 1 1 100 CYS C C -6.533 -0.794 -12.748 1.00 . A A . 100 CYS C 1 1 1 1455 1 1 100 CYS CA C -5.522 -1.936 -12.629 1.00 . A A . 100 CYS CA 1 1 1 1456 1 1 100 CYS CB C -4.787 -2.188 -13.947 1.00 . A A . 100 CYS CB 1 1 1 1457 1 1 100 CYS H H -6.474 -3.770 -12.891 1.00 . A A . 100 CYS H 1 1 1 1458 1 1 100 CYS HA H -4.768 -1.708 -11.875 1.00 . A A . 100 CYS HA 1 1 1 1459 1 1 100 CYS HB2 H -5.410 -2.820 -14.580 1.00 . A A . 100 CYS HB2 1 1 1 1460 1 1 100 CYS HB3 H -4.666 -1.237 -14.467 1.00 . A A . 100 CYS HB3 1 1 1 1461 1 1 100 CYS N N -6.225 -3.122 -12.171 1.00 . A A . 100 CYS N 1 1 1 1462 1 1 100 CYS O O -6.319 0.289 -12.205 1.00 . A A . 100 CYS O 1 1 1 1463 1 1 100 CYS SG S -3.143 -2.973 -13.772 1.00 . A A . 100 CYS SG 1 1 1 1464 1 1 101 LYS C C -9.996 -0.663 -13.198 1.00 . A A . 101 LYS C 1 1 1 1465 1 1 101 LYS CA C -8.657 -0.085 -13.661 1.00 . A A . 101 LYS CA 1 1 1 1466 1 1 101 LYS CB C -8.666 0.402 -15.111 1.00 . A A . 101 LYS CB 1 1 1 1467 1 1 101 LYS CD C -10.115 1.666 -16.743 1.00 . A A . 101 LYS CD 1 1 1 1468 1 1 101 LYS CE C -11.492 2.329 -16.826 1.00 . A A . 101 LYS CE 1 1 1 1469 1 1 101 LYS CG C -9.640 1.568 -15.292 1.00 . A A . 101 LYS CG 1 1 1 1470 1 1 101 LYS H H -7.779 -1.958 -13.901 1.00 . A A . 101 LYS H 1 1 1 1471 1 1 101 LYS HA H -8.417 0.774 -13.034 1.00 . A A . 101 LYS HA 1 1 1 1472 1 1 101 LYS HB2 H -7.662 0.714 -15.401 1.00 . A A . 101 LYS HB2 1 1 1 1473 1 1 101 LYS HB3 H -8.948 -0.417 -15.772 1.00 . A A . 101 LYS HB3 1 1 1 1474 1 1 101 LYS HD2 H -9.396 2.240 -17.327 1.00 . A A . 101 LYS HD2 1 1 1 1475 1 1 101 LYS HD3 H -10.160 0.669 -17.183 1.00 . A A . 101 LYS HD3 1 1 1 1476 1 1 101 LYS HE2 H -12.177 1.844 -16.131 1.00 . A A . 101 LYS HE2 1 1 1 1477 1 1 101 LYS HE3 H -11.417 3.374 -16.525 1.00 . A A . 101 LYS HE3 1 1 1 1478 1 1 101 LYS HG2 H -10.498 1.436 -14.633 1.00 . A A . 101 LYS HG2 1 1 1 1479 1 1 101 LYS HG3 H -9.156 2.500 -15.001 1.00 . A A . 101 LYS HG3 1 1 1 1480 1 1 101 LYS HZ1 H -13.007 1.981 -18.213 1.00 . A A . 101 LYS HZ1 1 1 1 1481 1 1 101 LYS HZ2 H -11.952 3.123 -18.697 1.00 . A A . 101 LYS HZ2 1 1 1 1482 1 1 101 LYS N N -7.613 -1.075 -13.463 1.00 . A A . 101 LYS N 1 1 1 1483 1 1 101 LYS NZ N -12.027 2.240 -18.203 1.00 . A A . 101 LYS NZ 1 1 1 1484 1 1 101 LYS O O -10.284 -1.836 -13.432 1.00 . A A . 101 LYS O 1 1 1 1485 1 1 102 LYS C C -11.892 -1.153 -10.850 1.00 . A A . 102 LYS C 1 1 1 1486 1 1 102 LYS CA C -12.081 -0.225 -12.052 1.00 . A A . 102 LYS CA 1 1 1 1487 1 1 102 LYS CB C -12.915 -0.838 -13.178 1.00 . A A . 102 LYS CB 1 1 1 1488 1 1 102 LYS CD C -14.442 -0.188 -15.077 1.00 . A A . 102 LYS CD 1 1 1 1489 1 1 102 LYS CE C -15.935 -0.517 -15.130 1.00 . A A . 102 LYS CE 1 1 1 1490 1 1 102 LYS CG C -14.001 0.132 -13.647 1.00 . A A . 102 LYS CG 1 1 1 1491 1 1 102 LYS H H -10.538 1.140 -12.364 1.00 . A A . 102 LYS H 1 1 1 1492 1 1 102 LYS HA H -12.601 0.673 -11.717 1.00 . A A . 102 LYS HA 1 1 1 1493 1 1 102 LYS HB2 H -12.268 -1.099 -14.015 1.00 . A A . 102 LYS HB2 1 1 1 1494 1 1 102 LYS HB3 H -13.375 -1.764 -12.831 1.00 . A A . 102 LYS HB3 1 1 1 1495 1 1 102 LYS HD2 H -14.229 0.662 -15.726 1.00 . A A . 102 LYS HD2 1 1 1 1496 1 1 102 LYS HD3 H -13.866 -1.031 -15.459 1.00 . A A . 102 LYS HD3 1 1 1 1497 1 1 102 LYS HE2 H -16.142 -1.394 -14.517 1.00 . A A . 102 LYS HE2 1 1 1 1498 1 1 102 LYS HE3 H -16.510 0.309 -14.710 1.00 . A A . 102 LYS HE3 1 1 1 1499 1 1 102 LYS HG2 H -14.859 0.076 -12.977 1.00 . A A . 102 LYS HG2 1 1 1 1500 1 1 102 LYS HG3 H -13.625 1.155 -13.599 1.00 . A A . 102 LYS HG3 1 1 1 1501 1 1 102 LYS HZ1 H -16.016 -1.654 -16.874 1.00 . A A . 102 LYS HZ1 1 1 1 1502 1 1 102 LYS HZ2 H -17.371 -0.789 -16.615 1.00 . A A . 102 LYS HZ2 1 1 1 1503 1 1 102 LYS N N -10.779 0.187 -12.550 1.00 . A A . 102 LYS N 1 1 1 1504 1 1 102 LYS NZ N -16.362 -0.767 -16.525 1.00 . A A . 102 LYS NZ 1 1 1 1505 1 1 102 LYS O O -12.533 -2.199 -10.763 1.00 . A A . 102 LYS O 1 1 1 1506 1 1 103 SER C C -11.041 -0.695 -7.511 1.00 . A A . 103 SER C 1 1 1 1507 1 1 103 SER CA C -10.727 -1.518 -8.762 1.00 . A A . 103 SER CA 1 1 1 1508 1 1 103 SER CB C -9.270 -1.983 -8.740 1.00 . A A . 103 SER CB 1 1 1 1509 1 1 103 SER H H -10.492 0.116 -10.033 1.00 . A A . 103 SER H 1 1 1 1510 1 1 103 SER HA H -11.384 -2.385 -8.824 1.00 . A A . 103 SER HA 1 1 1 1511 1 1 103 SER HB2 H -8.897 -1.956 -7.716 1.00 . A A . 103 SER HB2 1 1 1 1512 1 1 103 SER HB3 H -9.215 -3.019 -9.072 1.00 . A A . 103 SER HB3 1 1 1 1513 1 1 103 SER HG H -8.504 -0.217 -9.288 1.00 . A A . 103 SER HG 1 1 1 1514 1 1 103 SER N N -11.009 -0.736 -9.954 1.00 . A A . 103 SER N 1 1 1 1515 1 1 103 SER O O -11.576 0.409 -7.608 1.00 . A A . 103 SER O 1 1 1 1516 1 1 103 SER OG O -8.439 -1.175 -9.568 1.00 . A A . 103 SER OG 1 1 1 1517 1 1 104 LYS C C -9.910 0.527 -4.916 1.00 . A A . 104 LYS C 1 1 1 1518 1 1 104 LYS CA C -10.933 -0.596 -5.097 1.00 . A A . 104 LYS CA 1 1 1 1519 1 1 104 LYS CB C -10.942 -1.610 -3.951 1.00 . A A . 104 LYS CB 1 1 1 1520 1 1 104 LYS CD C -13.386 -1.991 -3.461 1.00 . A A . 104 LYS CD 1 1 1 1521 1 1 104 LYS CE C -13.983 -2.948 -2.428 1.00 . A A . 104 LYS CE 1 1 1 1522 1 1 104 LYS CG C -12.119 -2.579 -4.085 1.00 . A A . 104 LYS CG 1 1 1 1523 1 1 104 LYS H H -10.260 -2.161 -6.296 1.00 . A A . 104 LYS H 1 1 1 1524 1 1 104 LYS HA H -11.928 -0.153 -5.142 1.00 . A A . 104 LYS HA 1 1 1 1525 1 1 104 LYS HB2 H -10.005 -2.168 -3.947 1.00 . A A . 104 LYS HB2 1 1 1 1526 1 1 104 LYS HB3 H -11.004 -1.086 -2.997 1.00 . A A . 104 LYS HB3 1 1 1 1527 1 1 104 LYS HD2 H -13.154 -1.037 -2.988 1.00 . A A . 104 LYS HD2 1 1 1 1528 1 1 104 LYS HD3 H -14.120 -1.789 -4.242 1.00 . A A . 104 LYS HD3 1 1 1 1529 1 1 104 LYS HE2 H -13.562 -3.945 -2.560 1.00 . A A . 104 LYS HE2 1 1 1 1530 1 1 104 LYS HE3 H -13.716 -2.620 -1.423 1.00 . A A . 104 LYS HE3 1 1 1 1531 1 1 104 LYS HG2 H -12.295 -2.798 -5.138 1.00 . A A . 104 LYS HG2 1 1 1 1532 1 1 104 LYS HG3 H -11.874 -3.523 -3.599 1.00 . A A . 104 LYS HG3 1 1 1 1533 1 1 104 LYS HZ1 H -15.895 -3.433 -1.756 1.00 . A A . 104 LYS HZ1 1 1 1 1534 1 1 104 LYS HZ2 H -15.863 -2.081 -2.663 1.00 . A A . 104 LYS HZ2 1 1 1 1535 1 1 104 LYS N N -10.695 -1.263 -6.365 1.00 . A A . 104 LYS N 1 1 1 1536 1 1 104 LYS NZ N -15.456 -3.004 -2.563 1.00 . A A . 104 LYS NZ 1 1 1 1537 1 1 104 LYS O O -10.193 1.530 -4.262 1.00 . A A . 104 LYS O 1 1 1 1538 1 1 105 CYS C C -7.890 2.346 -6.521 1.00 . A A . 105 CYS C 1 1 1 1539 1 1 105 CYS CA C -7.676 1.304 -5.420 1.00 . A A . 105 CYS CA 1 1 1 1540 1 1 105 CYS CB C -6.296 0.651 -5.514 1.00 . A A . 105 CYS CB 1 1 1 1541 1 1 105 CYS H H -8.521 -0.496 -6.039 1.00 . A A . 105 CYS H 1 1 1 1542 1 1 105 CYS HA H -7.753 1.762 -4.434 1.00 . A A . 105 CYS HA 1 1 1 1543 1 1 105 CYS HB2 H -6.129 0.276 -6.524 1.00 . A A . 105 CYS HB2 1 1 1 1544 1 1 105 CYS HB3 H -5.520 1.391 -5.316 1.00 . A A . 105 CYS HB3 1 1 1 1545 1 1 105 CYS N N -8.743 0.322 -5.508 1.00 . A A . 105 CYS N 1 1 1 1546 1 1 105 CYS O O -8.182 3.506 -6.234 1.00 . A A . 105 CYS O 1 1 1 1547 1 1 105 CYS SG S -6.170 -0.722 -4.310 1.00 . A A . 105 CYS SG 1 1 1 1548 1 1 106 HIS C C -9.340 2.648 -9.432 1.00 . A A . 106 HIS C 1 1 1 1549 1 1 106 HIS CA C -7.910 2.772 -8.901 1.00 . A A . 106 HIS CA 1 1 1 1550 1 1 106 HIS CB C -6.854 2.484 -9.971 1.00 . A A . 106 HIS CB 1 1 1 1551 1 1 106 HIS CD2 C -4.374 1.834 -9.461 1.00 . A A . 106 HIS CD2 1 1 1 1552 1 1 106 HIS CE1 C -3.699 3.765 -8.684 1.00 . A A . 106 HIS CE1 1 1 1 1553 1 1 106 HIS CG C -5.433 2.692 -9.503 1.00 . A A . 106 HIS CG 1 1 1 1554 1 1 106 HIS H H -7.500 0.948 -7.981 1.00 . A A . 106 HIS H 1 1 1 1555 1 1 106 HIS HA H -7.751 3.788 -8.542 1.00 . A A . 106 HIS HA 1 1 1 1556 1 1 106 HIS HB2 H -6.967 1.454 -10.310 1.00 . A A . 106 HIS HB2 1 1 1 1557 1 1 106 HIS HB3 H -7.040 3.125 -10.832 1.00 . A A . 106 HIS HB3 1 1 1 1558 1 1 106 HIS HD1 H -5.520 4.735 -8.908 1.00 . A A . 106 HIS HD1 1 1 1 1559 1 1 106 HIS HD2 H -4.386 0.792 -9.780 1.00 . A A . 106 HIS HD2 1 1 1 1560 1 1 106 HIS HE1 H -3.058 4.541 -8.266 1.00 . A A . 106 HIS HE1 1 1 1 1561 1 1 106 HIS N N -7.737 1.893 -7.757 1.00 . A A . 106 HIS N 1 1 1 1562 1 1 106 HIS ND1 N -4.977 3.901 -9.007 1.00 . A A . 106 HIS ND1 1 1 1 1563 1 1 106 HIS NE2 N -3.327 2.484 -8.967 1.00 . A A . 106 HIS NE2 1 1 1 1564 1 1 106 HIS O O -9.846 1.542 -9.611 1.00 . A A . 106 HIS O 1 1 1 1565 1 1 107 GLU C C -11.337 4.413 -11.591 1.00 . A A . 107 GLU C 1 1 1 1566 1 1 107 GLU CA C -11.312 3.836 -10.174 1.00 . A A . 107 GLU CA 1 1 1 1567 1 1 107 GLU CB C -12.223 4.635 -9.240 1.00 . A A . 107 GLU CB 1 1 1 1568 1 1 107 GLU CD C -13.011 6.999 -8.855 1.00 . A A . 107 GLU CD 1 1 1 1569 1 1 107 GLU CG C -11.818 6.110 -9.209 1.00 . A A . 107 GLU CG 1 1 1 1570 1 1 107 GLU H H -9.531 4.696 -9.520 1.00 . A A . 107 GLU H 1 1 1 1571 1 1 107 GLU HA H -11.641 2.797 -10.191 1.00 . A A . 107 GLU HA 1 1 1 1572 1 1 107 GLU HB2 H -13.257 4.545 -9.571 1.00 . A A . 107 GLU HB2 1 1 1 1573 1 1 107 GLU HB3 H -12.173 4.219 -8.234 1.00 . A A . 107 GLU HB3 1 1 1 1574 1 1 107 GLU HG2 H -11.021 6.257 -8.479 1.00 . A A . 107 GLU HG2 1 1 1 1575 1 1 107 GLU HG3 H -11.417 6.402 -10.180 1.00 . A A . 107 GLU HG3 1 1 1 1576 1 1 107 GLU N N -9.950 3.800 -9.668 1.00 . A A . 107 GLU N 1 1 1 1577 1 1 107 GLU O O -10.366 5.025 -12.033 1.00 . A A . 107 GLU O 1 1 1 1578 1 1 107 GLU OXT O -12.378 4.231 -12.259 1.00 . A A . 107 GLU OXT 1 1 1 1579 1 1 107 GLU OE1 O -13.264 7.155 -7.641 1.00 . A A . 107 GLU OE1 1 1 1 1580 1 1 107 GLU OE2 O -13.645 7.504 -9.807 1.00 . A A . 107 GLU OE2 1 1 1 1581 2 2 1 HEC C1A C -1.166 5.310 9.254 1.00 . B A . 108 HEC C1A 1 1 1 1582 2 2 1 HEC C1B C -2.005 2.118 12.043 1.00 . B A . 108 HEC C1B 1 1 1 1583 2 2 1 HEC C1C C -2.142 -0.709 8.740 1.00 . B A . 108 HEC C1C 1 1 1 1584 2 2 1 HEC C1D C -1.120 2.469 5.996 1.00 . B A . 108 HEC C1D 1 1 1 1585 2 2 1 HEC C2A C -1.094 6.373 10.228 1.00 . B A . 108 HEC C2A 1 1 1 1586 2 2 1 HEC C2B C -2.402 1.197 13.082 1.00 . B A . 108 HEC C2B 1 1 1 1587 2 2 1 HEC C2C C -2.188 -1.771 7.762 1.00 . B A . 108 HEC C2C 1 1 1 1588 2 2 1 HEC C2D C -0.716 3.400 4.969 1.00 . B A . 108 HEC C2D 1 1 1 1589 2 2 1 HEC C3A C -1.301 5.816 11.440 1.00 . B A . 108 HEC C3A 1 1 1 1590 2 2 1 HEC C3B C -2.555 -0.012 12.503 1.00 . B A . 108 HEC C3B 1 1 1 1591 2 2 1 HEC C3C C -1.891 -1.222 6.566 1.00 . B A . 108 HEC C3C 1 1 1 1592 2 2 1 HEC C3D C -0.628 4.616 5.548 1.00 . B A . 108 HEC C3D 1 1 1 1593 2 2 1 HEC C4A C -1.503 4.402 11.228 1.00 . B A . 108 HEC C4A 1 1 1 1594 2 2 1 HEC C4B C -2.255 0.148 11.100 1.00 . B A . 108 HEC C4B 1 1 1 1595 2 2 1 HEC C4C C -1.658 0.185 6.790 1.00 . B A . 108 HEC C4C 1 1 1 1596 2 2 1 HEC C4D C -0.976 4.450 6.939 1.00 . B A . 108 HEC C4D 1 1 1 1597 2 2 1 HEC CAA C -0.836 7.817 9.906 1.00 . B A . 108 HEC CAA 1 1 1 1598 2 2 1 HEC CAB C -2.959 -1.304 13.153 1.00 . B A . 108 HEC CAB 1 1 1 1599 2 2 1 HEC CAC C -1.806 -1.904 5.232 1.00 . B A . 108 HEC CAC 1 1 1 1600 2 2 1 HEC CAD C -0.245 5.918 4.908 1.00 . B A . 108 HEC CAD 1 1 1 1601 2 2 1 HEC CBA C 0.627 8.231 10.045 1.00 . B A . 108 HEC CBA 1 1 1 1602 2 2 1 HEC CBB C -4.200 -1.194 14.034 1.00 . B A . 108 HEC CBB 1 1 1 1603 2 2 1 HEC CBC C -2.799 -3.050 5.056 1.00 . B A . 108 HEC CBC 1 1 1 1604 2 2 1 HEC CBD C -0.839 6.125 3.517 1.00 . B A . 108 HEC CBD 1 1 1 1605 2 2 1 HEC CGA C 0.791 9.317 11.097 1.00 . B A . 108 HEC CGA 1 1 1 1606 2 2 1 HEC CGD C 0.255 6.327 2.478 1.00 . B A . 108 HEC CGD 1 1 1 1607 2 2 1 HEC CHA C -1.003 5.491 7.884 1.00 . B A . 108 HEC CHA 1 1 1 1608 2 2 1 HEC CHB C -1.751 3.470 12.252 1.00 . B A . 108 HEC CHB 1 1 1 1609 2 2 1 HEC CHC C -2.300 -0.890 10.151 1.00 . B A . 108 HEC CHC 1 1 1 1610 2 2 1 HEC CHD C -1.319 1.108 5.784 1.00 . B A . 108 HEC CHD 1 1 1 1611 2 2 1 HEC CMA C -1.326 6.497 12.778 1.00 . B A . 108 HEC CMA 1 1 1 1612 2 2 1 HEC CMB C -2.597 1.562 14.525 1.00 . B A . 108 HEC CMB 1 1 1 1613 2 2 1 HEC CMC C -2.512 -3.204 8.067 1.00 . B A . 108 HEC CMC 1 1 1 1614 2 2 1 HEC CMD C -0.455 3.037 3.536 1.00 . B A . 108 HEC CMD 1 1 1 1615 2 2 1 HEC FE FE -1.607 2.295 9.011 1.00 . B A . 108 HEC FE 1 1 1 1616 2 2 1 HEC HAA1 H -1.131 8.018 8.877 1.00 . B A . 108 HEC HAA1 1 1 1 1617 2 2 1 HEC HAA2 H -1.414 8.448 10.580 1.00 . B A . 108 HEC HAA2 1 1 1 1618 2 2 1 HEC HAB H -3.176 -2.045 12.384 1.00 . B A . 108 HEC HAB 1 1 1 1619 2 2 1 HEC HAC H -2.007 -1.181 4.441 1.00 . B A . 108 HEC HAC 1 1 1 1620 2 2 1 HEC HAD1 H -0.589 6.744 5.530 1.00 . B A . 108 HEC HAD1 1 1 1 1621 2 2 1 HEC HAD2 H 0.839 5.968 4.805 1.00 . B A . 108 HEC HAD2 1 1 1 1622 2 2 1 HEC HBA1 H 1.223 7.367 10.339 1.00 . B A . 108 HEC HBA1 1 1 1 1623 2 2 1 HEC HBA2 H 0.988 8.613 9.090 1.00 . B A . 108 HEC HBA2 1 1 1 1624 2 2 1 HEC HBB1 H -4.160 -0.265 14.604 1.00 . B A . 108 HEC HBB1 1 1 1 1625 2 2 1 HEC HBB2 H -5.092 -1.197 13.407 1.00 . B A . 108 HEC HBB2 1 1 1 1626 2 2 1 HEC HBB3 H -4.235 -2.040 14.720 1.00 . B A . 108 HEC HBB3 1 1 1 1627 2 2 1 HEC HBC1 H -2.785 -3.387 4.020 1.00 . B A . 108 HEC HBC1 1 1 1 1628 2 2 1 HEC HBC2 H -2.520 -3.875 5.711 1.00 . B A . 108 HEC HBC2 1 1 1 1629 2 2 1 HEC HBC3 H -3.800 -2.705 5.313 1.00 . B A . 108 HEC HBC3 1 1 1 1630 2 2 1 HEC HBD1 H -1.427 5.250 3.240 1.00 . B A . 108 HEC HBD1 1 1 1 1631 2 2 1 HEC HBD2 H -1.480 7.007 3.524 1.00 . B A . 108 HEC HBD2 1 1 1 1632 2 2 1 HEC HHA H -0.887 6.510 7.514 1.00 . B A . 108 HEC HHA 1 1 1 1633 2 2 1 HEC HHB H -1.742 3.836 13.278 1.00 . B A . 108 HEC HHB 1 1 1 1634 2 2 1 HEC HHC H -2.473 -1.901 10.519 1.00 . B A . 108 HEC HHC 1 1 1 1635 2 2 1 HEC HHD H -1.205 0.727 4.769 1.00 . B A . 108 HEC HHD 1 1 1 1636 2 2 1 HEC HMA1 H -0.969 5.807 13.542 1.00 . B A . 108 HEC HMA1 1 1 1 1637 2 2 1 HEC HMA2 H -0.682 7.375 12.750 1.00 . B A . 108 HEC HMA2 1 1 1 1638 2 2 1 HEC HMA3 H -2.346 6.801 13.011 1.00 . B A . 108 HEC HMA3 1 1 1 1639 2 2 1 HEC HMB1 H -1.927 2.382 14.786 1.00 . B A . 108 HEC HMB1 1 1 1 1640 2 2 1 HEC HMB2 H -3.629 1.872 14.686 1.00 . B A . 108 HEC HMB2 1 1 1 1641 2 2 1 HEC HMB3 H -2.375 0.698 15.151 1.00 . B A . 108 HEC HMB3 1 1 1 1642 2 2 1 HEC HMC1 H -1.789 -3.853 7.571 1.00 . B A . 108 HEC HMC1 1 1 1 1643 2 2 1 HEC HMC2 H -2.466 -3.366 9.144 1.00 . B A . 108 HEC HMC2 1 1 1 1644 2 2 1 HEC HMC3 H -3.514 -3.435 7.707 1.00 . B A . 108 HEC HMC3 1 1 1 1645 2 2 1 HEC HMD1 H -1.403 2.930 3.009 1.00 . B A . 108 HEC HMD1 1 1 1 1646 2 2 1 HEC HMD2 H 0.136 3.822 3.065 1.00 . B A . 108 HEC HMD2 1 1 1 1647 2 2 1 HEC HMD3 H 0.093 2.095 3.493 1.00 . B A . 108 HEC HMD3 1 1 1 1648 2 2 1 HEC NA N -1.418 4.102 9.880 1.00 . B A . 108 HEC NA 1 1 1 1649 2 2 1 HEC NB N -1.917 1.462 10.828 1.00 . B A . 108 HEC NB 1 1 1 1650 2 2 1 HEC NC N -1.815 0.490 8.131 1.00 . B A . 108 HEC NC 1 1 1 1651 2 2 1 HEC ND N -1.277 3.125 7.204 1.00 . B A . 108 HEC ND 1 1 1 1652 2 2 1 HEC O1A O 0.985 8.943 12.274 1.00 . B A . 108 HEC O1A 1 1 1 1653 2 2 1 HEC O1D O 0.040 7.174 1.585 1.00 . B A . 108 HEC O1D 1 1 1 1654 2 2 1 HEC O2A O 0.720 10.502 10.706 1.00 . B A . 108 HEC O2A 1 1 1 1655 2 2 1 HEC O2D O 1.285 5.629 2.597 1.00 . B A . 108 HEC O2D 1 1 1 1656 3 2 1 HEC C1A C 9.637 -1.699 1.668 1.00 . C A . 109 HEC C1A 1 1 1 1657 3 2 1 HEC C1B C 5.783 -0.038 2.701 1.00 . C A . 109 HEC C1B 1 1 1 1658 3 2 1 HEC C1C C 7.788 2.972 5.173 1.00 . C A . 109 HEC C1C 1 1 1 1659 3 2 1 HEC C1D C 11.614 1.481 3.828 1.00 . C A . 109 HEC C1D 1 1 1 1660 3 2 1 HEC C2A C 9.141 -2.786 0.857 1.00 . C A . 109 HEC C2A 1 1 1 1661 3 2 1 HEC C2B C 4.424 0.307 3.047 1.00 . C A . 109 HEC C2B 1 1 1 1662 3 2 1 HEC C2C C 8.295 4.110 5.903 1.00 . C A . 109 HEC C2C 1 1 1 1663 3 2 1 HEC C2D C 12.965 1.091 3.501 1.00 . C A . 109 HEC C2D 1 1 1 1664 3 2 1 HEC C3A C 7.796 -2.675 0.826 1.00 . C A . 109 HEC C3A 1 1 1 1665 3 2 1 HEC C3B C 4.485 1.345 3.907 1.00 . C A . 109 HEC C3B 1 1 1 1666 3 2 1 HEC C3C C 9.638 4.103 5.766 1.00 . C A . 109 HEC C3C 1 1 1 1667 3 2 1 HEC C3D C 12.885 -0.040 2.769 1.00 . C A . 109 HEC C3D 1 1 1 1668 3 2 1 HEC C4A C 7.446 -1.519 1.618 1.00 . C A . 109 HEC C4A 1 1 1 1669 3 2 1 HEC C4B C 5.882 1.654 4.102 1.00 . C A . 109 HEC C4B 1 1 1 1670 3 2 1 HEC C4C C 9.976 2.961 4.950 1.00 . C A . 109 HEC C4C 1 1 1 1671 3 2 1 HEC C4D C 11.484 -0.361 2.635 1.00 . C A . 109 HEC C4D 1 1 1 1672 3 2 1 HEC CAA C 9.999 -3.822 0.192 1.00 . C A . 109 HEC CAA 1 1 1 1673 3 2 1 HEC CAB C 3.345 2.072 4.560 1.00 . C A . 109 HEC CAB 1 1 1 1674 3 2 1 HEC CAC C 10.630 5.076 6.335 1.00 . C A . 109 HEC CAC 1 1 1 1675 3 2 1 HEC CAD C 14.010 -0.845 2.185 1.00 . C A . 109 HEC CAD 1 1 1 1676 3 2 1 HEC CBA C 10.264 -3.552 -1.286 1.00 . C A . 109 HEC CBA 1 1 1 1677 3 2 1 HEC CBB C 2.313 1.154 5.208 1.00 . C A . 109 HEC CBB 1 1 1 1678 3 2 1 HEC CBC C 10.622 5.150 7.859 1.00 . C A . 109 HEC CBC 1 1 1 1679 3 2 1 HEC CBD C 15.240 -0.935 3.083 1.00 . C A . 109 HEC CBD 1 1 1 1680 3 2 1 HEC CGA C 11.050 -4.691 -1.919 1.00 . C A . 109 HEC CGA 1 1 1 1681 3 2 1 HEC CGD C 16.404 -0.148 2.500 1.00 . C A . 109 HEC CGD 1 1 1 1682 3 2 1 HEC CHA C 10.984 -1.475 1.936 1.00 . C A . 109 HEC CHA 1 1 1 1683 3 2 1 HEC CHB C 6.132 -1.067 1.832 1.00 . C A . 109 HEC CHB 1 1 1 1684 3 2 1 HEC CHC C 6.363 2.681 4.934 1.00 . C A . 109 HEC CHC 1 1 1 1685 3 2 1 HEC CHD C 11.285 2.606 4.578 1.00 . C A . 109 HEC CHD 1 1 1 1686 3 2 1 HEC CMA C 6.812 -3.561 0.118 1.00 . C A . 109 HEC CMA 1 1 1 1687 3 2 1 HEC CMB C 3.202 -0.389 2.522 1.00 . C A . 109 HEC CMB 1 1 1 1688 3 2 1 HEC CMC C 7.448 5.092 6.660 1.00 . C A . 109 HEC CMC 1 1 1 1689 3 2 1 HEC CMD C 14.200 1.835 3.920 1.00 . C A . 109 HEC CMD 1 1 1 1690 3 2 1 HEC FE FE 8.700 0.681 3.342 1.00 . C A . 109 HEC FE 1 1 1 1691 3 2 1 HEC HAA1 H 10.967 -3.867 0.690 1.00 . C A . 109 HEC HAA1 1 1 1 1692 3 2 1 HEC HAA2 H 9.511 -4.794 0.258 1.00 . C A . 109 HEC HAA2 1 1 1 1693 3 2 1 HEC HAB H 3.732 2.725 5.342 1.00 . C A . 109 HEC HAB 1 1 1 1694 3 2 1 HEC HAC H 11.636 4.787 6.032 1.00 . C A . 109 HEC HAC 1 1 1 1695 3 2 1 HEC HAD1 H 13.671 -1.864 2.001 1.00 . C A . 109 HEC HAD1 1 1 1 1696 3 2 1 HEC HAD2 H 14.330 -0.393 1.246 1.00 . C A . 109 HEC HAD2 1 1 1 1697 3 2 1 HEC HBA1 H 9.316 -3.448 -1.813 1.00 . C A . 109 HEC HBA1 1 1 1 1698 3 2 1 HEC HBA2 H 10.840 -2.632 -1.390 1.00 . C A . 109 HEC HBA2 1 1 1 1699 3 2 1 HEC HBB1 H 1.761 0.623 4.432 1.00 . C A . 109 HEC HBB1 1 1 1 1700 3 2 1 HEC HBB2 H 2.820 0.434 5.850 1.00 . C A . 109 HEC HBB2 1 1 1 1701 3 2 1 HEC HBB3 H 1.621 1.748 5.804 1.00 . C A . 109 HEC HBB3 1 1 1 1702 3 2 1 HEC HBC1 H 11.573 5.551 8.208 1.00 . C A . 109 HEC HBC1 1 1 1 1703 3 2 1 HEC HBC2 H 9.811 5.800 8.187 1.00 . C A . 109 HEC HBC2 1 1 1 1704 3 2 1 HEC HBC3 H 10.476 4.151 8.271 1.00 . C A . 109 HEC HBC3 1 1 1 1705 3 2 1 HEC HBD1 H 15.003 -0.529 4.067 1.00 . C A . 109 HEC HBD1 1 1 1 1706 3 2 1 HEC HBD2 H 15.541 -1.978 3.184 1.00 . C A . 109 HEC HBD2 1 1 1 1707 3 2 1 HEC HHA H 11.705 -2.212 1.582 1.00 . C A . 109 HEC HHA 1 1 1 1708 3 2 1 HEC HHB H 5.334 -1.560 1.276 1.00 . C A . 109 HEC HHB 1 1 1 1709 3 2 1 HEC HHC H 5.627 3.292 5.456 1.00 . C A . 109 HEC HHC 1 1 1 1710 3 2 1 HEC HHD H 12.094 3.260 4.902 1.00 . C A . 109 HEC HHD 1 1 1 1711 3 2 1 HEC HMA1 H 6.648 -4.464 0.706 1.00 . C A . 109 HEC HMA1 1 1 1 1712 3 2 1 HEC HMA2 H 5.868 -3.030 -0.004 1.00 . C A . 109 HEC HMA2 1 1 1 1713 3 2 1 HEC HMA3 H 7.207 -3.832 -0.861 1.00 . C A . 109 HEC HMA3 1 1 1 1714 3 2 1 HEC HMB1 H 2.905 -1.175 3.216 1.00 . C A . 109 HEC HMB1 1 1 1 1715 3 2 1 HEC HMB2 H 2.390 0.331 2.421 1.00 . C A . 109 HEC HMB2 1 1 1 1716 3 2 1 HEC HMB3 H 3.422 -0.827 1.549 1.00 . C A . 109 HEC HMB3 1 1 1 1717 3 2 1 HEC HMC1 H 7.129 4.646 7.602 1.00 . C A . 109 HEC HMC1 1 1 1 1718 3 2 1 HEC HMC2 H 8.029 5.992 6.862 1.00 . C A . 109 HEC HMC2 1 1 1 1719 3 2 1 HEC HMC3 H 6.573 5.350 6.064 1.00 . C A . 109 HEC HMC3 1 1 1 1720 3 2 1 HEC HMD1 H 13.972 2.898 4.004 1.00 . C A . 109 HEC HMD1 1 1 1 1721 3 2 1 HEC HMD2 H 14.541 1.459 4.885 1.00 . C A . 109 HEC HMD2 1 1 1 1722 3 2 1 HEC HMD3 H 14.982 1.689 3.176 1.00 . C A . 109 HEC HMD3 1 1 1 1723 3 2 1 HEC NA N 8.587 -0.926 2.131 1.00 . C A . 109 HEC NA 1 1 1 1724 3 2 1 HEC NB N 6.672 0.796 3.356 1.00 . C A . 109 HEC NB 1 1 1 1725 3 2 1 HEC NC N 8.830 2.272 4.591 1.00 . C A . 109 HEC NC 1 1 1 1726 3 2 1 HEC ND N 10.711 0.581 3.290 1.00 . C A . 109 HEC ND 1 1 1 1727 3 2 1 HEC O1A O 10.943 -4.837 -3.156 1.00 . C A . 109 HEC O1A 1 1 1 1728 3 2 1 HEC O1D O 17.115 0.494 3.303 1.00 . C A . 109 HEC O1D 1 1 1 1729 3 2 1 HEC O2A O 11.744 -5.396 -1.154 1.00 . C A . 109 HEC O2A 1 1 1 1730 3 2 1 HEC O2D O 16.562 -0.202 1.261 1.00 . C A . 109 HEC O2D 1 1 1 1731 4 2 1 HEC C1A C -8.650 -3.391 0.451 1.00 . D A . 110 HEC C1A 1 1 1 1732 4 2 1 HEC C1B C -4.926 -1.224 0.121 1.00 . D A . 110 HEC C1B 1 1 1 1733 4 2 1 HEC C1C C -2.840 -4.531 1.986 1.00 . D A . 110 HEC C1C 1 1 1 1734 4 2 1 HEC C1D C -6.577 -6.667 2.361 1.00 . D A . 110 HEC C1D 1 1 1 1735 4 2 1 HEC C2A C -9.477 -2.413 -0.215 1.00 . D A . 110 HEC C2A 1 1 1 1736 4 2 1 HEC C2B C -3.765 -0.395 -0.103 1.00 . D A . 110 HEC C2B 1 1 1 1737 4 2 1 HEC C2C C -1.997 -5.563 2.543 1.00 . D A . 110 HEC C2C 1 1 1 1738 4 2 1 HEC C2D C -7.747 -7.460 2.658 1.00 . D A . 110 HEC C2D 1 1 1 1739 4 2 1 HEC C3A C -8.673 -1.389 -0.570 1.00 . D A . 110 HEC C3A 1 1 1 1740 4 2 1 HEC C3B C -2.712 -1.028 0.456 1.00 . D A . 110 HEC C3B 1 1 1 1741 4 2 1 HEC C3C C -2.799 -6.598 2.868 1.00 . D A . 110 HEC C3C 1 1 1 1742 4 2 1 HEC C3D C -8.814 -6.786 2.178 1.00 . D A . 110 HEC C3D 1 1 1 1743 4 2 1 HEC C4A C -7.339 -1.723 -0.127 1.00 . D A . 110 HEC C4A 1 1 1 1744 4 2 1 HEC C4B C -3.211 -2.254 1.032 1.00 . D A . 110 HEC C4B 1 1 1 1745 4 2 1 HEC C4C C -4.147 -6.218 2.516 1.00 . D A . 110 HEC C4C 1 1 1 1746 4 2 1 HEC C4D C -8.316 -5.571 1.579 1.00 . D A . 110 HEC C4D 1 1 1 1747 4 2 1 HEC CAA C -10.953 -2.552 -0.446 1.00 . D A . 110 HEC CAA 1 1 1 1748 4 2 1 HEC CAB C -1.280 -0.580 0.496 1.00 . D A . 110 HEC CAB 1 1 1 1749 4 2 1 HEC CAC C -2.409 -7.912 3.480 1.00 . D A . 110 HEC CAC 1 1 1 1750 4 2 1 HEC CAD C -10.260 -7.186 2.233 1.00 . D A . 110 HEC CAD 1 1 1 1751 4 2 1 HEC CBA C -11.794 -2.445 0.823 1.00 . D A . 110 HEC CBA 1 1 1 1752 4 2 1 HEC CBB C -1.092 0.859 0.968 1.00 . D A . 110 HEC CBB 1 1 1 1753 4 2 1 HEC CBC C -1.112 -7.862 4.284 1.00 . D A . 110 HEC CBC 1 1 1 1754 4 2 1 HEC CBD C -10.934 -7.269 0.866 1.00 . D A . 110 HEC CBD 1 1 1 1755 4 2 1 HEC CGA C -11.732 -1.039 1.404 1.00 . D A . 110 HEC CGA 1 1 1 1756 4 2 1 HEC CGD C -12.074 -6.266 0.755 1.00 . D A . 110 HEC CGD 1 1 1 1757 4 2 1 HEC CHA C -9.122 -4.595 0.966 1.00 . D A . 110 HEC CHA 1 1 1 1758 4 2 1 HEC CHB C -6.210 -0.905 -0.311 1.00 . D A . 110 HEC CHB 1 1 1 1759 4 2 1 HEC CHC C -2.417 -3.197 1.711 1.00 . D A . 110 HEC CHC 1 1 1 1760 4 2 1 HEC CHD C -5.279 -7.033 2.701 1.00 . D A . 110 HEC CHD 1 1 1 1761 4 2 1 HEC CMA C -9.048 -0.126 -1.288 1.00 . D A . 110 HEC CMA 1 1 1 1762 4 2 1 HEC CMB C -3.775 0.919 -0.829 1.00 . D A . 110 HEC CMB 1 1 1 1763 4 2 1 HEC CMC C -0.509 -5.458 2.709 1.00 . D A . 110 HEC CMC 1 1 1 1764 4 2 1 HEC CMD C -7.732 -8.781 3.369 1.00 . D A . 110 HEC CMD 1 1 1 1765 4 2 1 HEC FE FE -5.752 -3.944 1.248 1.00 . D A . 110 HEC FE 1 1 1 1766 4 2 1 HEC HAA1 H -11.290 -1.766 -1.123 1.00 . D A . 110 HEC HAA1 1 1 1 1767 4 2 1 HEC HAA2 H -11.162 -3.526 -0.889 1.00 . D A . 110 HEC HAA2 1 1 1 1768 4 2 1 HEC HAB H -0.719 -1.218 1.179 1.00 . D A . 110 HEC HAB 1 1 1 1769 4 2 1 HEC HAC H -3.195 -8.245 4.158 1.00 . D A . 110 HEC HAC 1 1 1 1770 4 2 1 HEC HAD1 H -10.348 -8.170 2.694 1.00 . D A . 110 HEC HAD1 1 1 1 1771 4 2 1 HEC HAD2 H -10.817 -6.457 2.822 1.00 . D A . 110 HEC HAD2 1 1 1 1772 4 2 1 HEC HBA1 H -12.832 -2.682 0.592 1.00 . D A . 110 HEC HBA1 1 1 1 1773 4 2 1 HEC HBA2 H -11.418 -3.147 1.568 1.00 . D A . 110 HEC HBA2 1 1 1 1774 4 2 1 HEC HBB1 H -0.575 1.430 0.197 1.00 . D A . 110 HEC HBB1 1 1 1 1775 4 2 1 HEC HBB2 H -2.067 1.308 1.161 1.00 . D A . 110 HEC HBB2 1 1 1 1776 4 2 1 HEC HBB3 H -0.501 0.867 1.884 1.00 . D A . 110 HEC HBB3 1 1 1 1777 4 2 1 HEC HBC1 H -1.170 -7.058 5.017 1.00 . D A . 110 HEC HBC1 1 1 1 1778 4 2 1 HEC HBC2 H -0.966 -8.812 4.797 1.00 . D A . 110 HEC HBC2 1 1 1 1779 4 2 1 HEC HBC3 H -0.275 -7.680 3.611 1.00 . D A . 110 HEC HBC3 1 1 1 1780 4 2 1 HEC HBD1 H -10.203 -7.052 0.087 1.00 . D A . 110 HEC HBD1 1 1 1 1781 4 2 1 HEC HBD2 H -11.335 -8.271 0.719 1.00 . D A . 110 HEC HBD2 1 1 1 1782 4 2 1 HEC HHA H -10.189 -4.799 0.890 1.00 . D A . 110 HEC HHA 1 1 1 1783 4 2 1 HEC HHB H -6.354 0.043 -0.829 1.00 . D A . 110 HEC HHB 1 1 1 1784 4 2 1 HEC HHC H -1.419 -2.886 2.018 1.00 . D A . 110 HEC HHC 1 1 1 1785 4 2 1 HEC HHD H -5.123 -8.017 3.142 1.00 . D A . 110 HEC HHD 1 1 1 1786 4 2 1 HEC HMA1 H -8.542 -0.092 -2.253 1.00 . D A . 110 HEC HMA1 1 1 1 1787 4 2 1 HEC HMA2 H -10.127 -0.102 -1.443 1.00 . D A . 110 HEC HMA2 1 1 1 1788 4 2 1 HEC HMA3 H -8.748 0.735 -0.691 1.00 . D A . 110 HEC HMA3 1 1 1 1789 4 2 1 HEC HMB1 H -4.391 0.835 -1.725 1.00 . D A . 110 HEC HMB1 1 1 1 1790 4 2 1 HEC HMB2 H -4.185 1.691 -0.178 1.00 . D A . 110 HEC HMB2 1 1 1 1791 4 2 1 HEC HMB3 H -2.757 1.185 -1.112 1.00 . D A . 110 HEC HMB3 1 1 1 1792 4 2 1 HEC HMC1 H -0.165 -4.502 2.315 1.00 . D A . 110 HEC HMC1 1 1 1 1793 4 2 1 HEC HMC2 H -0.256 -5.528 3.767 1.00 . D A . 110 HEC HMC2 1 1 1 1794 4 2 1 HEC HMC3 H -0.024 -6.270 2.166 1.00 . D A . 110 HEC HMC3 1 1 1 1795 4 2 1 HEC HMD1 H -8.738 -9.020 3.714 1.00 . D A . 110 HEC HMD1 1 1 1 1796 4 2 1 HEC HMD2 H -7.388 -9.557 2.686 1.00 . D A . 110 HEC HMD2 1 1 1 1797 4 2 1 HEC HMD3 H -7.059 -8.725 4.225 1.00 . D A . 110 HEC HMD3 1 1 1 1798 4 2 1 HEC NA N -7.336 -2.957 0.500 1.00 . D A . 110 HEC NA 1 1 1 1799 4 2 1 HEC NB N -4.574 -2.365 0.821 1.00 . D A . 110 HEC NB 1 1 1 1800 4 2 1 HEC NC N -4.161 -4.945 1.974 1.00 . D A . 110 HEC NC 1 1 1 1801 4 2 1 HEC ND N -6.938 -5.507 1.698 1.00 . D A . 110 HEC ND 1 1 1 1802 4 2 1 HEC O1A O -11.180 -0.909 2.517 1.00 . D A . 110 HEC O1A 1 1 1 1803 4 2 1 HEC O1D O -12.922 -6.269 1.673 1.00 . D A . 110 HEC O1D 1 1 1 1804 4 2 1 HEC O2A O -12.239 -0.121 0.723 1.00 . D A . 110 HEC O2A 1 1 1 1805 4 2 1 HEC O2D O -12.075 -5.516 -0.245 1.00 . D A . 110 HEC O2D 1 1 1 1806 5 2 1 HEC C1A C -0.105 4.187 -9.213 1.00 . E A . 111 HEC C1A 1 1 1 1807 5 2 1 HEC C1B C -1.339 0.731 -11.497 1.00 . E A . 111 HEC C1B 1 1 1 1808 5 2 1 HEC C1C C -3.157 -0.962 -7.926 1.00 . E A . 111 HEC C1C 1 1 1 1809 5 2 1 HEC C1D C -1.875 2.485 -5.657 1.00 . E A . 111 HEC C1D 1 1 1 1810 5 2 1 HEC C2A C 0.502 4.905 -10.309 1.00 . E A . 111 HEC C2A 1 1 1 1811 5 2 1 HEC C2B C -1.485 -0.424 -12.351 1.00 . E A . 111 HEC C2B 1 1 1 1812 5 2 1 HEC C2C C -3.902 -1.598 -6.865 1.00 . E A . 111 HEC C2C 1 1 1 1813 5 2 1 HEC C2D C -1.393 3.484 -4.732 1.00 . E A . 111 HEC C2D 1 1 1 1814 5 2 1 HEC C3A C 0.328 4.157 -11.418 1.00 . E A . 111 HEC C3A 1 1 1 1815 5 2 1 HEC C3B C -2.084 -1.386 -11.619 1.00 . E A . 111 HEC C3B 1 1 1 1816 5 2 1 HEC C3C C -3.795 -0.807 -5.776 1.00 . E A . 111 HEC C3C 1 1 1 1817 5 2 1 HEC C3D C -0.697 4.389 -5.453 1.00 . E A . 111 HEC C3D 1 1 1 1818 5 2 1 HEC C4A C -0.388 2.967 -11.021 1.00 . E A . 111 HEC C4A 1 1 1 1819 5 2 1 HEC C4B C -2.315 -0.837 -10.303 1.00 . E A . 111 HEC C4B 1 1 1 1820 5 2 1 HEC C4C C -2.983 0.326 -6.152 1.00 . E A . 111 HEC C4C 1 1 1 1821 5 2 1 HEC C4D C -0.742 3.959 -6.831 1.00 . E A . 111 HEC C4D 1 1 1 1822 5 2 1 HEC CAA C 1.187 6.235 -10.189 1.00 . E A . 111 HEC CAA 1 1 1 1823 5 2 1 HEC CAB C -2.458 -2.776 -12.047 1.00 . E A . 111 HEC CAB 1 1 1 1824 5 2 1 HEC CAC C -4.389 -1.024 -4.415 1.00 . E A . 111 HEC CAC 1 1 1 1825 5 2 1 HEC CAD C 0.005 5.620 -4.959 1.00 . E A . 111 HEC CAD 1 1 1 1826 5 2 1 HEC CBA C 2.595 6.263 -10.776 1.00 . E A . 111 HEC CBA 1 1 1 1827 5 2 1 HEC CBB C -1.394 -3.826 -11.742 1.00 . E A . 111 HEC CBB 1 1 1 1828 5 2 1 HEC CBC C -4.219 -2.444 -3.882 1.00 . E A . 111 HEC CBC 1 1 1 1829 5 2 1 HEC CBD C -0.931 6.784 -4.645 1.00 . E A . 111 HEC CBD 1 1 1 1830 5 2 1 HEC CGA C 2.698 7.278 -11.905 1.00 . E A . 111 HEC CGA 1 1 1 1831 5 2 1 HEC CGD C -0.172 8.104 -4.613 1.00 . E A . 111 HEC CGD 1 1 1 1832 5 2 1 HEC CHA C -0.131 4.641 -7.899 1.00 . E A . 111 HEC CHA 1 1 1 1833 5 2 1 HEC CHB C -0.762 1.932 -11.897 1.00 . E A . 111 HEC CHB 1 1 1 1834 5 2 1 HEC CHC C -2.923 -1.534 -9.244 1.00 . E A . 111 HEC CHC 1 1 1 1835 5 2 1 HEC CHD C -2.638 1.382 -5.288 1.00 . E A . 111 HEC CHD 1 1 1 1836 5 2 1 HEC CMA C 0.776 4.462 -12.818 1.00 . E A . 111 HEC CMA 1 1 1 1837 5 2 1 HEC CMB C -1.039 -0.495 -13.783 1.00 . E A . 111 HEC CMB 1 1 1 1838 5 2 1 HEC CMC C -4.642 -2.897 -6.995 1.00 . E A . 111 HEC CMC 1 1 1 1839 5 2 1 HEC CMD C -1.643 3.476 -3.252 1.00 . E A . 111 HEC CMD 1 1 1 1840 5 2 1 HEC FE FE -1.642 1.618 -8.581 1.00 . E A . 111 HEC FE 1 1 1 1841 5 2 1 HEC HAA1 H 0.605 6.992 -10.713 1.00 . E A . 111 HEC HAA1 1 1 1 1842 5 2 1 HEC HAA2 H 1.273 6.506 -9.136 1.00 . E A . 111 HEC HAA2 1 1 1 1843 5 2 1 HEC HAB H -3.369 -3.082 -11.533 1.00 . E A . 111 HEC HAB 1 1 1 1844 5 2 1 HEC HAC H -3.913 -0.353 -3.699 1.00 . E A . 111 HEC HAC 1 1 1 1845 5 2 1 HEC HAD1 H 0.547 5.387 -4.043 1.00 . E A . 111 HEC HAD1 1 1 1 1846 5 2 1 HEC HAD2 H 0.706 5.967 -5.718 1.00 . E A . 111 HEC HAD2 1 1 1 1847 5 2 1 HEC HBA1 H 3.309 6.533 -9.998 1.00 . E A . 111 HEC HBA1 1 1 1 1848 5 2 1 HEC HBA2 H 2.844 5.277 -11.170 1.00 . E A . 111 HEC HBA2 1 1 1 1849 5 2 1 HEC HBB1 H -0.476 -3.332 -11.424 1.00 . E A . 111 HEC HBB1 1 1 1 1850 5 2 1 HEC HBB2 H -1.748 -4.482 -10.946 1.00 . E A . 111 HEC HBB2 1 1 1 1851 5 2 1 HEC HBB3 H -1.198 -4.416 -12.638 1.00 . E A . 111 HEC HBB3 1 1 1 1852 5 2 1 HEC HBC1 H -3.320 -2.887 -4.310 1.00 . E A . 111 HEC HBC1 1 1 1 1853 5 2 1 HEC HBC2 H -4.129 -2.417 -2.796 1.00 . E A . 111 HEC HBC2 1 1 1 1854 5 2 1 HEC HBC3 H -5.087 -3.043 -4.160 1.00 . E A . 111 HEC HBC3 1 1 1 1855 5 2 1 HEC HBD1 H -1.704 6.845 -5.411 1.00 . E A . 111 HEC HBD1 1 1 1 1856 5 2 1 HEC HBD2 H -1.395 6.625 -3.672 1.00 . E A . 111 HEC HBD2 1 1 1 1857 5 2 1 HEC HHA H 0.355 5.591 -7.676 1.00 . E A . 111 HEC HHA 1 1 1 1858 5 2 1 HEC HHB H -0.586 2.085 -12.961 1.00 . E A . 111 HEC HHB 1 1 1 1859 5 2 1 HEC HHC H -3.238 -2.561 -9.432 1.00 . E A . 111 HEC HHC 1 1 1 1860 5 2 1 HEC HHD H -2.997 1.328 -4.260 1.00 . E A . 111 HEC HHD 1 1 1 1861 5 2 1 HEC HMA1 H 0.169 5.270 -13.226 1.00 . E A . 111 HEC HMA1 1 1 1 1862 5 2 1 HEC HMA2 H 1.824 4.764 -12.806 1.00 . E A . 111 HEC HMA2 1 1 1 1863 5 2 1 HEC HMA3 H 0.662 3.573 -13.438 1.00 . E A . 111 HEC HMA3 1 1 1 1864 5 2 1 HEC HMB1 H -0.956 -1.538 -14.086 1.00 . E A . 111 HEC HMB1 1 1 1 1865 5 2 1 HEC HMB2 H -1.768 0.011 -14.416 1.00 . E A . 111 HEC HMB2 1 1 1 1866 5 2 1 HEC HMB3 H -0.069 -0.009 -13.885 1.00 . E A . 111 HEC HMB3 1 1 1 1867 5 2 1 HEC HMC1 H -4.479 -3.310 -7.990 1.00 . E A . 111 HEC HMC1 1 1 1 1868 5 2 1 HEC HMC2 H -4.277 -3.599 -6.245 1.00 . E A . 111 HEC HMC2 1 1 1 1869 5 2 1 HEC HMC3 H -5.707 -2.725 -6.843 1.00 . E A . 111 HEC HMC3 1 1 1 1870 5 2 1 HEC HMD1 H -1.830 4.494 -2.910 1.00 . E A . 111 HEC HMD1 1 1 1 1871 5 2 1 HEC HMD2 H -2.512 2.855 -3.034 1.00 . E A . 111 HEC HMD2 1 1 1 1872 5 2 1 HEC HMD3 H -0.770 3.074 -2.738 1.00 . E A . 111 HEC HMD3 1 1 1 1873 5 2 1 HEC NA N -0.650 2.996 -9.662 1.00 . E A . 111 HEC NA 1 1 1 1874 5 2 1 HEC NB N -1.853 0.466 -10.239 1.00 . E A . 111 HEC NB 1 1 1 1875 5 2 1 HEC NC N -2.595 0.221 -7.476 1.00 . E A . 111 HEC NC 1 1 1 1876 5 2 1 HEC ND N -1.469 2.787 -6.945 1.00 . E A . 111 HEC ND 1 1 1 1877 5 2 1 HEC O1A O 3.082 8.428 -11.601 1.00 . E A . 111 HEC O1A 1 1 1 1878 5 2 1 HEC O1D O -0.257 8.832 -5.626 1.00 . E A . 111 HEC O1D 1 1 1 1879 5 2 1 HEC O2A O 2.390 6.886 -13.052 1.00 . E A . 111 HEC O2A 1 1 1 1880 5 2 1 HEC O2D O 0.478 8.359 -3.577 1.00 . E A . 111 HEC O2D 1 1 2 1881 1 1 1 ALA C C 0.411 4.059 19.909 1.00 . A A . 1 ALA C 1 1 2 1882 1 1 1 ALA CA C 1.551 3.061 19.699 1.00 . A A . 1 ALA CA 1 1 2 1883 1 1 1 ALA CB C 1.202 1.661 20.208 1.00 . A A . 1 ALA CB 1 1 2 1884 1 1 1 ALA H1 H 2.564 3.591 21.377 1.00 . A A . 1 ALA H1 1 1 2 1885 1 1 1 ALA H2 H 3.511 2.904 20.205 1.00 . A A . 1 ALA H2 1 1 2 1886 1 1 1 ALA HA H 1.780 3.001 18.635 1.00 . A A . 1 ALA HA 1 1 2 1887 1 1 1 ALA HB1 H 1.021 1.699 21.282 1.00 . A A . 1 ALA HB1 1 1 2 1888 1 1 1 ALA HB2 H 0.305 1.304 19.701 1.00 . A A . 1 ALA HB2 1 1 2 1889 1 1 1 ALA HB3 H 2.030 0.982 20.002 1.00 . A A . 1 ALA HB3 1 1 2 1890 1 1 1 ALA N N 2.742 3.541 20.380 1.00 . A A . 1 ALA N 1 1 2 1891 1 1 1 ALA O O -0.265 4.028 20.936 1.00 . A A . 1 ALA O 1 1 2 1892 1 1 2 PRO C C -2.194 5.327 18.708 1.00 . A A . 2 PRO C 1 1 2 1893 1 1 2 PRO CA C -0.819 5.950 18.956 1.00 . A A . 2 PRO CA 1 1 2 1894 1 1 2 PRO CB C -0.436 6.983 17.908 1.00 . A A . 2 PRO CB 1 1 2 1895 1 1 2 PRO CD C 1.009 5.011 17.661 1.00 . A A . 2 PRO CD 1 1 2 1896 1 1 2 PRO CG C 0.549 6.290 16.981 1.00 . A A . 2 PRO CG 1 1 2 1897 1 1 2 PRO HA H -0.861 6.350 19.872 1.00 . A A . 2 PRO HA 1 1 2 1898 1 1 2 PRO HB2 H -1.314 7.326 17.360 1.00 . A A . 2 PRO HB2 1 1 2 1899 1 1 2 PRO HB3 H 0.014 7.861 18.371 1.00 . A A . 2 PRO HB3 1 1 2 1900 1 1 2 PRO HD2 H 0.829 4.140 17.031 1.00 . A A . 2 PRO HD2 1 1 2 1901 1 1 2 PRO HD3 H 2.078 5.037 17.872 1.00 . A A . 2 PRO HD3 1 1 2 1902 1 1 2 PRO HG2 H 0.079 6.065 16.024 1.00 . A A . 2 PRO HG2 1 1 2 1903 1 1 2 PRO HG3 H 1.400 6.940 16.774 1.00 . A A . 2 PRO HG3 1 1 2 1904 1 1 2 PRO N N 0.228 4.944 18.893 1.00 . A A . 2 PRO N 1 1 2 1905 1 1 2 PRO O O -2.865 4.901 19.646 1.00 . A A . 2 PRO O 1 1 2 1906 1 1 3 LYS C C -4.057 4.910 15.549 1.00 . A A . 3 LYS C 1 1 2 1907 1 1 3 LYS CA C -3.855 4.730 17.055 1.00 . A A . 3 LYS CA 1 1 2 1908 1 1 3 LYS CB C -4.979 5.330 17.902 1.00 . A A . 3 LYS CB 1 1 2 1909 1 1 3 LYS CD C -7.299 4.547 18.506 1.00 . A A . 3 LYS CD 1 1 2 1910 1 1 3 LYS CE C -8.125 3.265 18.384 1.00 . A A . 3 LYS CE 1 1 2 1911 1 1 3 LYS CG C -5.804 4.232 18.576 1.00 . A A . 3 LYS CG 1 1 2 1912 1 1 3 LYS H H -2.020 5.641 16.681 1.00 . A A . 3 LYS H 1 1 2 1913 1 1 3 LYS HA H -3.822 3.662 17.273 1.00 . A A . 3 LYS HA 1 1 2 1914 1 1 3 LYS HB2 H -4.556 5.990 18.660 1.00 . A A . 3 LYS HB2 1 1 2 1915 1 1 3 LYS HB3 H -5.626 5.942 17.273 1.00 . A A . 3 LYS HB3 1 1 2 1916 1 1 3 LYS HD2 H -7.601 5.095 19.398 1.00 . A A . 3 LYS HD2 1 1 2 1917 1 1 3 LYS HD3 H -7.498 5.195 17.652 1.00 . A A . 3 LYS HD3 1 1 2 1918 1 1 3 LYS HE2 H -8.621 3.236 17.414 1.00 . A A . 3 LYS HE2 1 1 2 1919 1 1 3 LYS HE3 H -7.468 2.397 18.433 1.00 . A A . 3 LYS HE3 1 1 2 1920 1 1 3 LYS HG2 H -5.607 3.275 18.092 1.00 . A A . 3 LYS HG2 1 1 2 1921 1 1 3 LYS HG3 H -5.498 4.131 19.618 1.00 . A A . 3 LYS HG3 1 1 2 1922 1 1 3 LYS HZ1 H -9.446 2.243 19.630 1.00 . A A . 3 LYS HZ1 1 1 2 1923 1 1 3 LYS HZ2 H -8.769 3.538 20.347 1.00 . A A . 3 LYS HZ2 1 1 2 1924 1 1 3 LYS N N -2.572 5.293 17.438 1.00 . A A . 3 LYS N 1 1 2 1925 1 1 3 LYS NZ N -9.133 3.193 19.466 1.00 . A A . 3 LYS NZ 1 1 2 1926 1 1 3 LYS O O -3.441 5.781 14.936 1.00 . A A . 3 LYS O 1 1 2 1927 1 1 4 ALA C C -5.894 5.459 13.248 1.00 . A A . 4 ALA C 1 1 2 1928 1 1 4 ALA CA C -5.212 4.129 13.573 1.00 . A A . 4 ALA CA 1 1 2 1929 1 1 4 ALA CB C -6.067 2.924 13.178 1.00 . A A . 4 ALA CB 1 1 2 1930 1 1 4 ALA H H -5.419 3.368 15.500 1.00 . A A . 4 ALA H 1 1 2 1931 1 1 4 ALA HA H -4.263 4.076 13.038 1.00 . A A . 4 ALA HA 1 1 2 1932 1 1 4 ALA HB1 H -6.921 2.847 13.852 1.00 . A A . 4 ALA HB1 1 1 2 1933 1 1 4 ALA HB2 H -6.422 3.049 12.155 1.00 . A A . 4 ALA HB2 1 1 2 1934 1 1 4 ALA HB3 H -5.469 2.015 13.246 1.00 . A A . 4 ALA HB3 1 1 2 1935 1 1 4 ALA N N -4.922 4.073 14.995 1.00 . A A . 4 ALA N 1 1 2 1936 1 1 4 ALA O O -6.708 5.950 14.027 1.00 . A A . 4 ALA O 1 1 2 1937 1 1 5 PRO C C -7.529 7.098 11.132 1.00 . A A . 5 PRO C 1 1 2 1938 1 1 5 PRO CA C -6.093 7.284 11.626 1.00 . A A . 5 PRO CA 1 1 2 1939 1 1 5 PRO CB C -5.152 7.783 10.542 1.00 . A A . 5 PRO CB 1 1 2 1940 1 1 5 PRO CD C -4.564 5.467 11.115 1.00 . A A . 5 PRO CD 1 1 2 1941 1 1 5 PRO CG C -4.357 6.569 10.090 1.00 . A A . 5 PRO CG 1 1 2 1942 1 1 5 PRO HA H -6.148 7.924 12.393 1.00 . A A . 5 PRO HA 1 1 2 1943 1 1 5 PRO HB2 H -5.708 8.218 9.712 1.00 . A A . 5 PRO HB2 1 1 2 1944 1 1 5 PRO HB3 H -4.492 8.561 10.926 1.00 . A A . 5 PRO HB3 1 1 2 1945 1 1 5 PRO HD2 H -4.946 4.558 10.649 1.00 . A A . 5 PRO HD2 1 1 2 1946 1 1 5 PRO HD3 H -3.628 5.203 11.608 1.00 . A A . 5 PRO HD3 1 1 2 1947 1 1 5 PRO HG2 H -4.688 6.242 9.104 1.00 . A A . 5 PRO HG2 1 1 2 1948 1 1 5 PRO HG3 H -3.299 6.817 10.004 1.00 . A A . 5 PRO HG3 1 1 2 1949 1 1 5 PRO N N -5.526 6.020 12.064 1.00 . A A . 5 PRO N 1 1 2 1950 1 1 5 PRO O O -7.970 5.973 10.901 1.00 . A A . 5 PRO O 1 1 2 1951 1 1 6 ALA C C -9.666 7.471 9.176 1.00 . A A . 6 ALA C 1 1 2 1952 1 1 6 ALA CA C -9.597 8.195 10.522 1.00 . A A . 6 ALA CA 1 1 2 1953 1 1 6 ALA CB C -10.135 9.625 10.443 1.00 . A A . 6 ALA CB 1 1 2 1954 1 1 6 ALA H H -7.854 9.131 11.174 1.00 . A A . 6 ALA H 1 1 2 1955 1 1 6 ALA HA H -10.183 7.639 11.254 1.00 . A A . 6 ALA HA 1 1 2 1956 1 1 6 ALA HB1 H -9.436 10.246 9.882 1.00 . A A . 6 ALA HB1 1 1 2 1957 1 1 6 ALA HB2 H -11.102 9.622 9.940 1.00 . A A . 6 ALA HB2 1 1 2 1958 1 1 6 ALA HB3 H -10.250 10.026 11.450 1.00 . A A . 6 ALA HB3 1 1 2 1959 1 1 6 ALA N N -8.220 8.219 10.984 1.00 . A A . 6 ALA N 1 1 2 1960 1 1 6 ALA O O -8.685 6.870 8.740 1.00 . A A . 6 ALA O 1 1 2 1961 1 1 7 ASP C C -10.961 7.964 6.160 1.00 . A A . 7 ASP C 1 1 2 1962 1 1 7 ASP CA C -11.043 6.912 7.268 1.00 . A A . 7 ASP CA 1 1 2 1963 1 1 7 ASP CB C -12.424 6.258 7.196 1.00 . A A . 7 ASP CB 1 1 2 1964 1 1 7 ASP CG C -13.604 7.227 7.286 1.00 . A A . 7 ASP CG 1 1 2 1965 1 1 7 ASP H H -11.626 8.044 8.917 1.00 . A A . 7 ASP H 1 1 2 1966 1 1 7 ASP HA H -10.256 6.162 7.190 1.00 . A A . 7 ASP HA 1 1 2 1967 1 1 7 ASP HB2 H -12.499 5.703 6.261 1.00 . A A . 7 ASP HB2 1 1 2 1968 1 1 7 ASP HB3 H -12.508 5.531 8.005 1.00 . A A . 7 ASP HB3 1 1 2 1969 1 1 7 ASP N N -10.833 7.552 8.555 1.00 . A A . 7 ASP N 1 1 2 1970 1 1 7 ASP O O -10.943 9.163 6.438 1.00 . A A . 7 ASP O 1 1 2 1971 1 1 7 ASP OD1 O -13.762 7.831 8.368 1.00 . A A . 7 ASP OD1 1 1 2 1972 1 1 7 ASP OD2 O -14.322 7.342 6.269 1.00 . A A . 7 ASP OD2 1 1 2 1973 1 1 8 GLY C C -9.401 8.860 3.568 1.00 . A A . 8 GLY C 1 1 2 1974 1 1 8 GLY CA C -10.833 8.362 3.778 1.00 . A A . 8 GLY CA 1 1 2 1975 1 1 8 GLY H H -10.928 6.502 4.712 1.00 . A A . 8 GLY H 1 1 2 1976 1 1 8 GLY HA2 H -11.173 7.836 2.886 1.00 . A A . 8 GLY HA2 1 1 2 1977 1 1 8 GLY HA3 H -11.500 9.212 3.921 1.00 . A A . 8 GLY HA3 1 1 2 1978 1 1 8 GLY N N -10.913 7.478 4.929 1.00 . A A . 8 GLY N 1 1 2 1979 1 1 8 GLY O O -9.186 9.890 2.931 1.00 . A A . 8 GLY O 1 1 2 1980 1 1 9 LEU C C -6.573 8.140 2.579 1.00 . A A . 9 LEU C 1 1 2 1981 1 1 9 LEU CA C -7.055 8.457 3.996 1.00 . A A . 9 LEU CA 1 1 2 1982 1 1 9 LEU CB C -6.236 7.771 5.092 1.00 . A A . 9 LEU CB 1 1 2 1983 1 1 9 LEU CD1 C -4.310 6.368 4.266 1.00 . A A . 9 LEU CD1 1 1 2 1984 1 1 9 LEU CD2 C -4.255 8.891 4.005 1.00 . A A . 9 LEU CD2 1 1 2 1985 1 1 9 LEU CG C -4.725 7.715 4.863 1.00 . A A . 9 LEU CG 1 1 2 1986 1 1 9 LEU H H -8.644 7.268 4.631 1.00 . A A . 9 LEU H 1 1 2 1987 1 1 9 LEU HA H -6.973 9.532 4.157 1.00 . A A . 9 LEU HA 1 1 2 1988 1 1 9 LEU HB2 H -6.422 8.288 6.034 1.00 . A A . 9 LEU HB2 1 1 2 1989 1 1 9 LEU HB3 H -6.604 6.752 5.209 1.00 . A A . 9 LEU HB3 1 1 2 1990 1 1 9 LEU HD11 H -4.996 5.593 4.609 1.00 . A A . 9 LEU HD11 1 1 2 1991 1 1 9 LEU HD12 H -4.343 6.428 3.179 1.00 . A A . 9 LEU HD12 1 1 2 1992 1 1 9 LEU HD13 H -3.297 6.125 4.587 1.00 . A A . 9 LEU HD13 1 1 2 1993 1 1 9 LEU HD21 H -4.984 9.700 4.067 1.00 . A A . 9 LEU HD21 1 1 2 1994 1 1 9 LEU HD22 H -3.290 9.243 4.367 1.00 . A A . 9 LEU HD22 1 1 2 1995 1 1 9 LEU HD23 H -4.159 8.568 2.968 1.00 . A A . 9 LEU HD23 1 1 2 1996 1 1 9 LEU HG H -4.229 7.804 5.830 1.00 . A A . 9 LEU HG 1 1 2 1997 1 1 9 LEU N N -8.460 8.105 4.115 1.00 . A A . 9 LEU N 1 1 2 1998 1 1 9 LEU O O -6.375 6.977 2.232 1.00 . A A . 9 LEU O 1 1 2 1999 1 1 10 LYS C C -4.562 9.687 0.278 1.00 . A A . 10 LYS C 1 1 2 2000 1 1 10 LYS CA C -5.943 9.045 0.426 1.00 . A A . 10 LYS CA 1 1 2 2001 1 1 10 LYS CB C -6.986 9.597 -0.548 1.00 . A A . 10 LYS CB 1 1 2 2002 1 1 10 LYS CD C -7.761 11.773 -1.560 1.00 . A A . 10 LYS CD 1 1 2 2003 1 1 10 LYS CE C -8.261 12.681 -0.435 1.00 . A A . 10 LYS CE 1 1 2 2004 1 1 10 LYS CG C -6.551 10.953 -1.106 1.00 . A A . 10 LYS CG 1 1 2 2005 1 1 10 LYS H H -6.561 10.139 2.088 1.00 . A A . 10 LYS H 1 1 2 2006 1 1 10 LYS HA H -5.851 7.977 0.228 1.00 . A A . 10 LYS HA 1 1 2 2007 1 1 10 LYS HB2 H -7.133 8.893 -1.367 1.00 . A A . 10 LYS HB2 1 1 2 2008 1 1 10 LYS HB3 H -7.945 9.699 -0.040 1.00 . A A . 10 LYS HB3 1 1 2 2009 1 1 10 LYS HD2 H -7.492 12.376 -2.427 1.00 . A A . 10 LYS HD2 1 1 2 2010 1 1 10 LYS HD3 H -8.561 11.103 -1.874 1.00 . A A . 10 LYS HD3 1 1 2 2011 1 1 10 LYS HE2 H -9.187 12.283 -0.022 1.00 . A A . 10 LYS HE2 1 1 2 2012 1 1 10 LYS HE3 H -7.532 12.700 0.376 1.00 . A A . 10 LYS HE3 1 1 2 2013 1 1 10 LYS HG2 H -5.999 11.504 -0.344 1.00 . A A . 10 LYS HG2 1 1 2 2014 1 1 10 LYS HG3 H -5.873 10.804 -1.946 1.00 . A A . 10 LYS HG3 1 1 2 2015 1 1 10 LYS HZ1 H -9.178 14.078 -1.679 1.00 . A A . 10 LYS HZ1 1 1 2 2016 1 1 10 LYS HZ2 H -8.814 14.678 -0.210 1.00 . A A . 10 LYS HZ2 1 1 2 2017 1 1 10 LYS N N -6.398 9.196 1.798 1.00 . A A . 10 LYS N 1 1 2 2018 1 1 10 LYS NZ N -8.486 14.054 -0.939 1.00 . A A . 10 LYS NZ 1 1 2 2019 1 1 10 LYS O O -4.236 10.636 0.988 1.00 . A A . 10 LYS O 1 1 2 2020 1 1 11 MET C C -2.283 10.054 -2.368 1.00 . A A . 11 MET C 1 1 2 2021 1 1 11 MET CA C -2.451 9.651 -0.901 1.00 . A A . 11 MET CA 1 1 2 2022 1 1 11 MET CB C -1.422 8.576 -0.546 1.00 . A A . 11 MET CB 1 1 2 2023 1 1 11 MET CE C -0.694 5.001 -0.125 1.00 . A A . 11 MET CE 1 1 2 2024 1 1 11 MET CG C -1.734 7.260 -1.263 1.00 . A A . 11 MET CG 1 1 2 2025 1 1 11 MET H H -4.063 8.372 -1.225 1.00 . A A . 11 MET H 1 1 2 2026 1 1 11 MET HA H -2.346 10.528 -0.262 1.00 . A A . 11 MET HA 1 1 2 2027 1 1 11 MET HB2 H -0.424 8.917 -0.822 1.00 . A A . 11 MET HB2 1 1 2 2028 1 1 11 MET HB3 H -1.417 8.414 0.532 1.00 . A A . 11 MET HB3 1 1 2 2029 1 1 11 MET HE1 H 0.132 5.591 -0.522 1.00 . A A . 11 MET HE1 1 1 2 2030 1 1 11 MET HE2 H -0.448 4.662 0.881 1.00 . A A . 11 MET HE2 1 1 2 2031 1 1 11 MET HE3 H -0.866 4.137 -0.767 1.00 . A A . 11 MET HE3 1 1 2 2032 1 1 11 MET HG2 H -2.553 7.405 -1.967 1.00 . A A . 11 MET HG2 1 1 2 2033 1 1 11 MET HG3 H -0.868 6.939 -1.842 1.00 . A A . 11 MET HG3 1 1 2 2034 1 1 11 MET N N -3.789 9.143 -0.651 1.00 . A A . 11 MET N 1 1 2 2035 1 1 11 MET O O -2.325 9.205 -3.257 1.00 . A A . 11 MET O 1 1 2 2036 1 1 11 MET SD S -2.169 6.004 -0.072 1.00 . A A . 11 MET SD 1 1 2 2037 1 1 12 GLU C C -0.472 12.313 -4.133 1.00 . A A . 12 GLU C 1 1 2 2038 1 1 12 GLU CA C -1.922 11.875 -3.918 1.00 . A A . 12 GLU CA 1 1 2 2039 1 1 12 GLU CB C -2.889 13.030 -4.184 1.00 . A A . 12 GLU CB 1 1 2 2040 1 1 12 GLU CD C -1.871 14.357 -6.072 1.00 . A A . 12 GLU CD 1 1 2 2041 1 1 12 GLU CG C -2.958 13.354 -5.678 1.00 . A A . 12 GLU CG 1 1 2 2042 1 1 12 GLU H H -2.063 12.033 -1.846 1.00 . A A . 12 GLU H 1 1 2 2043 1 1 12 GLU HA H -2.161 11.047 -4.586 1.00 . A A . 12 GLU HA 1 1 2 2044 1 1 12 GLU HB2 H -3.883 12.769 -3.819 1.00 . A A . 12 GLU HB2 1 1 2 2045 1 1 12 GLU HB3 H -2.569 13.913 -3.631 1.00 . A A . 12 GLU HB3 1 1 2 2046 1 1 12 GLU HG2 H -2.841 12.439 -6.258 1.00 . A A . 12 GLU HG2 1 1 2 2047 1 1 12 GLU HG3 H -3.939 13.762 -5.920 1.00 . A A . 12 GLU HG3 1 1 2 2048 1 1 12 GLU N N -2.096 11.349 -2.575 1.00 . A A . 12 GLU N 1 1 2 2049 1 1 12 GLU O O -0.195 13.502 -4.281 1.00 . A A . 12 GLU O 1 1 2 2050 1 1 12 GLU OE1 O -2.093 15.561 -5.822 1.00 . A A . 12 GLU OE1 1 1 2 2051 1 1 12 GLU OE2 O -0.844 13.896 -6.614 1.00 . A A . 12 GLU OE2 1 1 2 2052 1 1 13 ALA C C 2.193 11.363 -5.803 1.00 . A A . 13 ALA C 1 1 2 2053 1 1 13 ALA CA C 1.830 11.599 -4.335 1.00 . A A . 13 ALA CA 1 1 2 2054 1 1 13 ALA CB C 2.651 10.726 -3.384 1.00 . A A . 13 ALA CB 1 1 2 2055 1 1 13 ALA H H 0.181 10.365 -4.020 1.00 . A A . 13 ALA H 1 1 2 2056 1 1 13 ALA HA H 2.004 12.646 -4.090 1.00 . A A . 13 ALA HA 1 1 2 2057 1 1 13 ALA HB1 H 1.994 10.011 -2.889 1.00 . A A . 13 ALA HB1 1 1 2 2058 1 1 13 ALA HB2 H 3.412 10.189 -3.949 1.00 . A A . 13 ALA HB2 1 1 2 2059 1 1 13 ALA HB3 H 3.131 11.356 -2.635 1.00 . A A . 13 ALA HB3 1 1 2 2060 1 1 13 ALA N N 0.415 11.329 -4.142 1.00 . A A . 13 ALA N 1 1 2 2061 1 1 13 ALA O O 3.281 11.732 -6.243 1.00 . A A . 13 ALA O 1 1 2 2062 1 1 14 THR C C 0.283 10.953 -8.755 1.00 . A A . 14 THR C 1 1 2 2063 1 1 14 THR CA C 1.471 10.460 -7.927 1.00 . A A . 14 THR CA 1 1 2 2064 1 1 14 THR CB C 1.729 8.959 -8.068 1.00 . A A . 14 THR CB 1 1 2 2065 1 1 14 THR CG2 C 2.500 8.383 -6.878 1.00 . A A . 14 THR CG2 1 1 2 2066 1 1 14 THR H H 0.380 10.453 -6.153 1.00 . A A . 14 THR H 1 1 2 2067 1 1 14 THR HA H 2.348 11.013 -8.265 1.00 . A A . 14 THR HA 1 1 2 2068 1 1 14 THR HB H 2.239 8.738 -9.005 1.00 . A A . 14 THR HB 1 1 2 2069 1 1 14 THR HG1 H -0.030 8.718 -7.145 1.00 . A A . 14 THR HG1 1 1 2 2070 1 1 14 THR HG21 H 3.017 9.188 -6.356 1.00 . A A . 14 THR HG21 1 1 2 2071 1 1 14 THR HG22 H 1.803 7.897 -6.195 1.00 . A A . 14 THR HG22 1 1 2 2072 1 1 14 THR HG23 H 3.227 7.654 -7.235 1.00 . A A . 14 THR HG23 1 1 2 2073 1 1 14 THR N N 1.262 10.750 -6.519 1.00 . A A . 14 THR N 1 1 2 2074 1 1 14 THR O O -0.701 11.444 -8.204 1.00 . A A . 14 THR O 1 1 2 2075 1 1 14 THR OG1 O 0.435 8.372 -7.960 1.00 . A A . 14 THR OG1 1 1 2 2076 1 1 15 LYS C C -1.888 10.380 -10.733 1.00 . A A . 15 LYS C 1 1 2 2077 1 1 15 LYS CA C -0.638 11.229 -10.974 1.00 . A A . 15 LYS CA 1 1 2 2078 1 1 15 LYS CB C -0.141 11.194 -12.421 1.00 . A A . 15 LYS CB 1 1 2 2079 1 1 15 LYS CD C -1.187 11.233 -14.715 1.00 . A A . 15 LYS CD 1 1 2 2080 1 1 15 LYS CE C -0.355 11.984 -15.757 1.00 . A A . 15 LYS CE 1 1 2 2081 1 1 15 LYS CG C -1.112 11.923 -13.352 1.00 . A A . 15 LYS CG 1 1 2 2082 1 1 15 LYS H H 1.217 10.404 -10.505 1.00 . A A . 15 LYS H 1 1 2 2083 1 1 15 LYS HA H -0.874 12.266 -10.740 1.00 . A A . 15 LYS HA 1 1 2 2084 1 1 15 LYS HB2 H 0.845 11.656 -12.483 1.00 . A A . 15 LYS HB2 1 1 2 2085 1 1 15 LYS HB3 H -0.027 10.160 -12.746 1.00 . A A . 15 LYS HB3 1 1 2 2086 1 1 15 LYS HD2 H -0.828 10.208 -14.628 1.00 . A A . 15 LYS HD2 1 1 2 2087 1 1 15 LYS HD3 H -2.225 11.180 -15.043 1.00 . A A . 15 LYS HD3 1 1 2 2088 1 1 15 LYS HE2 H 0.065 12.887 -15.313 1.00 . A A . 15 LYS HE2 1 1 2 2089 1 1 15 LYS HE3 H 0.484 11.365 -16.076 1.00 . A A . 15 LYS HE3 1 1 2 2090 1 1 15 LYS HG2 H -2.103 11.952 -12.899 1.00 . A A . 15 LYS HG2 1 1 2 2091 1 1 15 LYS HG3 H -0.790 12.957 -13.481 1.00 . A A . 15 LYS HG3 1 1 2 2092 1 1 15 LYS HZ1 H -0.955 11.786 -17.743 1.00 . A A . 15 LYS HZ1 1 1 2 2093 1 1 15 LYS HZ2 H -2.176 12.198 -16.747 1.00 . A A . 15 LYS HZ2 1 1 2 2094 1 1 15 LYS N N 0.413 10.804 -10.065 1.00 . A A . 15 LYS N 1 1 2 2095 1 1 15 LYS NZ N -1.188 12.341 -16.927 1.00 . A A . 15 LYS NZ 1 1 2 2096 1 1 15 LYS O O -2.965 10.699 -11.234 1.00 . A A . 15 LYS O 1 1 2 2097 1 1 16 GLN C C -2.961 8.283 -8.137 1.00 . A A . 16 GLN C 1 1 2 2098 1 1 16 GLN CA C -2.802 8.419 -9.653 1.00 . A A . 16 GLN CA 1 1 2 2099 1 1 16 GLN CB C -2.598 7.051 -10.307 1.00 . A A . 16 GLN CB 1 1 2 2100 1 1 16 GLN CD C -3.442 6.972 -12.682 1.00 . A A . 16 GLN CD 1 1 2 2101 1 1 16 GLN CG C -2.225 7.200 -11.784 1.00 . A A . 16 GLN CG 1 1 2 2102 1 1 16 GLN H H -0.823 9.063 -9.563 1.00 . A A . 16 GLN H 1 1 2 2103 1 1 16 GLN HA H -3.690 8.889 -10.078 1.00 . A A . 16 GLN HA 1 1 2 2104 1 1 16 GLN HB2 H -1.812 6.507 -9.783 1.00 . A A . 16 GLN HB2 1 1 2 2105 1 1 16 GLN HB3 H -3.509 6.460 -10.217 1.00 . A A . 16 GLN HB3 1 1 2 2106 1 1 16 GLN HE21 H -3.523 5.064 -12.009 1.00 . A A . 16 GLN HE21 1 1 2 2107 1 1 16 GLN HE22 H -4.741 5.495 -13.163 1.00 . A A . 16 GLN HE22 1 1 2 2108 1 1 16 GLN HG2 H -1.819 8.196 -11.962 1.00 . A A . 16 GLN HG2 1 1 2 2109 1 1 16 GLN HG3 H -1.442 6.486 -12.039 1.00 . A A . 16 GLN HG3 1 1 2 2110 1 1 16 GLN N N -1.703 9.316 -9.966 1.00 . A A . 16 GLN N 1 1 2 2111 1 1 16 GLN NE2 N -3.944 5.742 -12.612 1.00 . A A . 16 GLN NE2 1 1 2 2112 1 1 16 GLN O O -2.235 7.523 -7.499 1.00 . A A . 16 GLN O 1 1 2 2113 1 1 16 GLN OE1 O -3.896 7.854 -13.392 1.00 . A A . 16 GLN OE1 1 1 2 2114 1 1 17 PRO C C -4.940 7.744 -5.765 1.00 . A A . 17 PRO C 1 1 2 2115 1 1 17 PRO CA C -4.205 9.025 -6.162 1.00 . A A . 17 PRO CA 1 1 2 2116 1 1 17 PRO CB C -5.012 10.283 -5.887 1.00 . A A . 17 PRO CB 1 1 2 2117 1 1 17 PRO CD C -4.821 9.964 -8.316 1.00 . A A . 17 PRO CD 1 1 2 2118 1 1 17 PRO CG C -5.566 10.725 -7.232 1.00 . A A . 17 PRO CG 1 1 2 2119 1 1 17 PRO HA H -3.345 9.017 -5.651 1.00 . A A . 17 PRO HA 1 1 2 2120 1 1 17 PRO HB2 H -5.817 10.084 -5.180 1.00 . A A . 17 PRO HB2 1 1 2 2121 1 1 17 PRO HB3 H -4.386 11.060 -5.448 1.00 . A A . 17 PRO HB3 1 1 2 2122 1 1 17 PRO HD2 H -5.509 9.420 -8.963 1.00 . A A . 17 PRO HD2 1 1 2 2123 1 1 17 PRO HD3 H -4.252 10.640 -8.954 1.00 . A A . 17 PRO HD3 1 1 2 2124 1 1 17 PRO HG2 H -6.636 10.522 -7.290 1.00 . A A . 17 PRO HG2 1 1 2 2125 1 1 17 PRO HG3 H -5.438 11.800 -7.363 1.00 . A A . 17 PRO HG3 1 1 2 2126 1 1 17 PRO N N -3.941 9.052 -7.591 1.00 . A A . 17 PRO N 1 1 2 2127 1 1 17 PRO O O -5.551 7.087 -6.607 1.00 . A A . 17 PRO O 1 1 2 2128 1 1 18 VAL C C -6.105 6.543 -2.587 1.00 . A A . 18 VAL C 1 1 2 2129 1 1 18 VAL CA C -5.508 6.235 -3.962 1.00 . A A . 18 VAL CA 1 1 2 2130 1 1 18 VAL CB C -4.519 5.068 -3.936 1.00 . A A . 18 VAL CB 1 1 2 2131 1 1 18 VAL CG1 C -5.134 3.843 -3.256 1.00 . A A . 18 VAL CG1 1 1 2 2132 1 1 18 VAL CG2 C -4.037 4.727 -5.348 1.00 . A A . 18 VAL CG2 1 1 2 2133 1 1 18 VAL H H -4.360 7.966 -3.803 1.00 . A A . 18 VAL H 1 1 2 2134 1 1 18 VAL HA H -6.317 5.977 -4.645 1.00 . A A . 18 VAL HA 1 1 2 2135 1 1 18 VAL HB H -3.652 5.376 -3.352 1.00 . A A . 18 VAL HB 1 1 2 2136 1 1 18 VAL HG11 H -6.173 3.738 -3.567 1.00 . A A . 18 VAL HG11 1 1 2 2137 1 1 18 VAL HG12 H -4.576 2.951 -3.541 1.00 . A A . 18 VAL HG12 1 1 2 2138 1 1 18 VAL HG13 H -5.090 3.969 -2.174 1.00 . A A . 18 VAL HG13 1 1 2 2139 1 1 18 VAL HG21 H -4.751 5.110 -6.078 1.00 . A A . 18 VAL HG21 1 1 2 2140 1 1 18 VAL HG22 H -3.062 5.183 -5.519 1.00 . A A . 18 VAL HG22 1 1 2 2141 1 1 18 VAL HG23 H -3.956 3.645 -5.452 1.00 . A A . 18 VAL HG23 1 1 2 2142 1 1 18 VAL N N -4.858 7.426 -4.481 1.00 . A A . 18 VAL N 1 1 2 2143 1 1 18 VAL O O -5.610 7.415 -1.873 1.00 . A A . 18 VAL O 1 1 2 2144 1 1 19 VAL C C -7.718 4.709 -0.161 1.00 . A A . 19 VAL C 1 1 2 2145 1 1 19 VAL CA C -7.828 5.996 -0.980 1.00 . A A . 19 VAL CA 1 1 2 2146 1 1 19 VAL CB C -9.275 6.438 -1.207 1.00 . A A . 19 VAL CB 1 1 2 2147 1 1 19 VAL CG1 C -10.080 6.368 0.092 1.00 . A A . 19 VAL CG1 1 1 2 2148 1 1 19 VAL CG2 C -9.330 7.843 -1.811 1.00 . A A . 19 VAL CG2 1 1 2 2149 1 1 19 VAL H H -7.554 5.104 -2.843 1.00 . A A . 19 VAL H 1 1 2 2150 1 1 19 VAL HA H -7.310 6.795 -0.450 1.00 . A A . 19 VAL HA 1 1 2 2151 1 1 19 VAL HB H -9.728 5.749 -1.920 1.00 . A A . 19 VAL HB 1 1 2 2152 1 1 19 VAL HG11 H -9.901 5.409 0.579 1.00 . A A . 19 VAL HG11 1 1 2 2153 1 1 19 VAL HG12 H -9.770 7.175 0.756 1.00 . A A . 19 VAL HG12 1 1 2 2154 1 1 19 VAL HG13 H -11.142 6.469 -0.132 1.00 . A A . 19 VAL HG13 1 1 2 2155 1 1 19 VAL HG21 H -8.494 7.977 -2.497 1.00 . A A . 19 VAL HG21 1 1 2 2156 1 1 19 VAL HG22 H -10.268 7.968 -2.353 1.00 . A A . 19 VAL HG22 1 1 2 2157 1 1 19 VAL HG23 H -9.269 8.584 -1.014 1.00 . A A . 19 VAL HG23 1 1 2 2158 1 1 19 VAL N N -7.159 5.811 -2.257 1.00 . A A . 19 VAL N 1 1 2 2159 1 1 19 VAL O O -8.211 3.661 -0.575 1.00 . A A . 19 VAL O 1 1 2 2160 1 1 20 PHE C C -7.773 3.808 3.110 1.00 . A A . 20 PHE C 1 1 2 2161 1 1 20 PHE CA C -6.886 3.689 1.869 1.00 . A A . 20 PHE CA 1 1 2 2162 1 1 20 PHE CB C -5.419 3.718 2.300 1.00 . A A . 20 PHE CB 1 1 2 2163 1 1 20 PHE CD1 C -4.966 1.250 2.549 1.00 . A A . 20 PHE CD1 1 1 2 2164 1 1 20 PHE CD2 C -4.622 2.662 4.446 1.00 . A A . 20 PHE CD2 1 1 2 2165 1 1 20 PHE CE1 C -4.561 0.108 3.326 1.00 . A A . 20 PHE CE1 1 1 2 2166 1 1 20 PHE CE2 C -4.217 1.520 5.223 1.00 . A A . 20 PHE CE2 1 1 2 2167 1 1 20 PHE CG C -4.988 2.504 3.125 1.00 . A A . 20 PHE CG 1 1 2 2168 1 1 20 PHE CZ C -4.206 0.299 4.625 1.00 . A A . 20 PHE CZ 1 1 2 2169 1 1 20 PHE H H -6.670 5.686 1.317 1.00 . A A . 20 PHE H 1 1 2 2170 1 1 20 PHE HA H -7.165 2.790 1.317 1.00 . A A . 20 PHE HA 1 1 2 2171 1 1 20 PHE HB2 H -4.791 3.781 1.411 1.00 . A A . 20 PHE HB2 1 1 2 2172 1 1 20 PHE HB3 H -5.239 4.622 2.881 1.00 . A A . 20 PHE HB3 1 1 2 2173 1 1 20 PHE HD1 H -5.255 1.125 1.505 1.00 . A A . 20 PHE HD1 1 1 2 2174 1 1 20 PHE HD2 H -4.640 3.653 4.902 1.00 . A A . 20 PHE HD2 1 1 2 2175 1 1 20 PHE HE1 H -4.539 -0.888 2.883 1.00 . A A . 20 PHE HE1 1 1 2 2176 1 1 20 PHE HE2 H -3.925 1.631 6.268 1.00 . A A . 20 PHE HE2 1 1 2 2177 1 1 20 PHE HZ H -3.887 -0.645 5.136 1.00 . A A . 20 PHE HZ 1 1 2 2178 1 1 20 PHE N N -7.068 4.830 0.988 1.00 . A A . 20 PHE N 1 1 2 2179 1 1 20 PHE O O -8.272 4.889 3.419 1.00 . A A . 20 PHE O 1 1 2 2180 1 1 21 ASN C C -8.107 1.721 6.017 1.00 . A A . 21 ASN C 1 1 2 2181 1 1 21 ASN CA C -8.759 2.647 4.989 1.00 . A A . 21 ASN CA 1 1 2 2182 1 1 21 ASN CB C -10.158 2.108 4.686 1.00 . A A . 21 ASN CB 1 1 2 2183 1 1 21 ASN CG C -10.953 3.096 3.829 1.00 . A A . 21 ASN CG 1 1 2 2184 1 1 21 ASN H H -7.531 1.808 3.530 1.00 . A A . 21 ASN H 1 1 2 2185 1 1 21 ASN HA H -8.809 3.681 5.331 1.00 . A A . 21 ASN HA 1 1 2 2186 1 1 21 ASN HB2 H -10.080 1.153 4.168 1.00 . A A . 21 ASN HB2 1 1 2 2187 1 1 21 ASN HB3 H -10.690 1.922 5.620 1.00 . A A . 21 ASN HB3 1 1 2 2188 1 1 21 ASN HD21 H -10.045 2.330 2.190 1.00 . A A . 21 ASN HD21 1 1 2 2189 1 1 21 ASN HD22 H -11.174 3.607 1.883 1.00 . A A . 21 ASN HD22 1 1 2 2190 1 1 21 ASN N N -7.941 2.682 3.788 1.00 . A A . 21 ASN N 1 1 2 2191 1 1 21 ASN ND2 N -10.704 3.003 2.526 1.00 . A A . 21 ASN ND2 1 1 2 2192 1 1 21 ASN O O -7.470 0.733 5.653 1.00 . A A . 21 ASN O 1 1 2 2193 1 1 21 ASN OD1 O -11.740 3.889 4.319 1.00 . A A . 21 ASN OD1 1 1 2 2194 1 1 22 HIS C C -8.817 0.401 8.977 1.00 . A A . 22 HIS C 1 1 2 2195 1 1 22 HIS CA C -7.727 1.284 8.366 1.00 . A A . 22 HIS CA 1 1 2 2196 1 1 22 HIS CB C -7.047 2.186 9.397 1.00 . A A . 22 HIS CB 1 1 2 2197 1 1 22 HIS CD2 C -4.446 1.925 9.378 1.00 . A A . 22 HIS CD2 1 1 2 2198 1 1 22 HIS CE1 C -3.964 3.687 8.173 1.00 . A A . 22 HIS CE1 1 1 2 2199 1 1 22 HIS CG C -5.619 2.541 9.056 1.00 . A A . 22 HIS CG 1 1 2 2200 1 1 22 HIS H H -8.809 2.876 7.569 1.00 . A A . 22 HIS H 1 1 2 2201 1 1 22 HIS HA H -6.961 0.647 7.924 1.00 . A A . 22 HIS HA 1 1 2 2202 1 1 22 HIS HB2 H -7.625 3.105 9.498 1.00 . A A . 22 HIS HB2 1 1 2 2203 1 1 22 HIS HB3 H -7.065 1.690 10.367 1.00 . A A . 22 HIS HB3 1 1 2 2204 1 1 22 HIS HD1 H -5.926 4.308 7.907 1.00 . A A . 22 HIS HD1 1 1 2 2205 1 1 22 HIS HD2 H -4.346 1.018 9.974 1.00 . A A . 22 HIS HD2 1 1 2 2206 1 1 22 HIS HE1 H -3.393 4.440 7.631 1.00 . A A . 22 HIS HE1 1 1 2 2207 1 1 22 HIS N N -8.290 2.071 7.282 1.00 . A A . 22 HIS N 1 1 2 2208 1 1 22 HIS ND1 N -5.283 3.648 8.296 1.00 . A A . 22 HIS ND1 1 1 2 2209 1 1 22 HIS NE2 N -3.448 2.617 8.844 1.00 . A A . 22 HIS NE2 1 1 2 2210 1 1 22 HIS O O -8.518 -0.609 9.612 1.00 . A A . 22 HIS O 1 1 2 2211 1 1 23 SER C C -11.446 -1.169 8.432 1.00 . A A . 23 SER C 1 1 2 2212 1 1 23 SER CA C -11.193 0.074 9.288 1.00 . A A . 23 SER CA 1 1 2 2213 1 1 23 SER CB C -12.447 0.949 9.335 1.00 . A A . 23 SER CB 1 1 2 2214 1 1 23 SER H H -10.292 1.637 8.247 1.00 . A A . 23 SER H 1 1 2 2215 1 1 23 SER HA H -10.910 -0.210 10.301 1.00 . A A . 23 SER HA 1 1 2 2216 1 1 23 SER HB2 H -12.165 1.994 9.200 1.00 . A A . 23 SER HB2 1 1 2 2217 1 1 23 SER HB3 H -13.104 0.687 8.507 1.00 . A A . 23 SER HB3 1 1 2 2218 1 1 23 SER HG H -13.628 -0.075 10.584 1.00 . A A . 23 SER HG 1 1 2 2219 1 1 23 SER N N -10.057 0.814 8.765 1.00 . A A . 23 SER N 1 1 2 2220 1 1 23 SER O O -12.309 -1.984 8.755 1.00 . A A . 23 SER O 1 1 2 2221 1 1 23 SER OG O -13.153 0.805 10.565 1.00 . A A . 23 SER OG 1 1 2 2222 1 1 24 THR C C -9.683 -3.414 6.694 1.00 . A A . 24 THR C 1 1 2 2223 1 1 24 THR CA C -10.808 -2.405 6.453 1.00 . A A . 24 THR CA 1 1 2 2224 1 1 24 THR CB C -10.843 -1.864 5.023 1.00 . A A . 24 THR CB 1 1 2 2225 1 1 24 THR CG2 C -10.981 -2.975 3.980 1.00 . A A . 24 THR CG2 1 1 2 2226 1 1 24 THR H H -9.978 -0.608 7.102 1.00 . A A . 24 THR H 1 1 2 2227 1 1 24 THR HA H -11.746 -2.915 6.673 1.00 . A A . 24 THR HA 1 1 2 2228 1 1 24 THR HB H -9.970 -1.245 4.819 1.00 . A A . 24 THR HB 1 1 2 2229 1 1 24 THR HG1 H -12.838 -1.780 5.159 1.00 . A A . 24 THR HG1 1 1 2 2230 1 1 24 THR HG21 H -10.381 -3.833 4.282 1.00 . A A . 24 THR HG21 1 1 2 2231 1 1 24 THR HG22 H -12.026 -3.272 3.901 1.00 . A A . 24 THR HG22 1 1 2 2232 1 1 24 THR HG23 H -10.632 -2.611 3.013 1.00 . A A . 24 THR HG23 1 1 2 2233 1 1 24 THR N N -10.678 -1.276 7.358 1.00 . A A . 24 THR N 1 1 2 2234 1 1 24 THR O O -9.874 -4.616 6.519 1.00 . A A . 24 THR O 1 1 2 2235 1 1 24 THR OG1 O -12.081 -1.162 4.948 1.00 . A A . 24 THR OG1 1 1 2 2236 1 1 25 HIS C C -7.217 -3.914 8.867 1.00 . A A . 25 HIS C 1 1 2 2237 1 1 25 HIS CA C -7.378 -3.725 7.357 1.00 . A A . 25 HIS CA 1 1 2 2238 1 1 25 HIS CB C -6.125 -3.149 6.695 1.00 . A A . 25 HIS CB 1 1 2 2239 1 1 25 HIS CD2 C -5.743 -3.751 4.180 1.00 . A A . 25 HIS CD2 1 1 2 2240 1 1 25 HIS CE1 C -6.847 -2.084 3.290 1.00 . A A . 25 HIS CE1 1 1 2 2241 1 1 25 HIS CG C -6.239 -2.990 5.198 1.00 . A A . 25 HIS CG 1 1 2 2242 1 1 25 HIS H H -8.387 -1.907 7.231 1.00 . A A . 25 HIS H 1 1 2 2243 1 1 25 HIS HA H -7.581 -4.693 6.898 1.00 . A A . 25 HIS HA 1 1 2 2244 1 1 25 HIS HB2 H -5.906 -2.177 7.138 1.00 . A A . 25 HIS HB2 1 1 2 2245 1 1 25 HIS HB3 H -5.278 -3.798 6.918 1.00 . A A . 25 HIS HB3 1 1 2 2246 1 1 25 HIS HD1 H -7.408 -1.214 5.088 1.00 . A A . 25 HIS HD1 1 1 2 2247 1 1 25 HIS HD2 H -5.146 -4.655 4.294 1.00 . A A . 25 HIS HD2 1 1 2 2248 1 1 25 HIS HE1 H -7.288 -1.420 2.548 1.00 . A A . 25 HIS HE1 1 1 2 2249 1 1 25 HIS N N -8.534 -2.886 7.091 1.00 . A A . 25 HIS N 1 1 2 2250 1 1 25 HIS ND1 N -6.929 -1.946 4.606 1.00 . A A . 25 HIS ND1 1 1 2 2251 1 1 25 HIS NE2 N -6.112 -3.203 3.029 1.00 . A A . 25 HIS NE2 1 1 2 2252 1 1 25 HIS O O -6.098 -3.975 9.373 1.00 . A A . 25 HIS O 1 1 2 2253 1 1 26 LYS C C -7.802 -5.571 11.321 1.00 . A A . 26 LYS C 1 1 2 2254 1 1 26 LYS CA C -8.352 -4.183 10.986 1.00 . A A . 26 LYS CA 1 1 2 2255 1 1 26 LYS CB C -9.746 -3.920 11.559 1.00 . A A . 26 LYS CB 1 1 2 2256 1 1 26 LYS CD C -11.709 -2.337 11.594 1.00 . A A . 26 LYS CD 1 1 2 2257 1 1 26 LYS CE C -11.740 -1.884 13.054 1.00 . A A . 26 LYS CE 1 1 2 2258 1 1 26 LYS CG C -10.271 -2.552 11.116 1.00 . A A . 26 LYS CG 1 1 2 2259 1 1 26 LYS H H -9.259 -3.953 9.125 1.00 . A A . 26 LYS H 1 1 2 2260 1 1 26 LYS HA H -7.683 -3.434 11.408 1.00 . A A . 26 LYS HA 1 1 2 2261 1 1 26 LYS HB2 H -10.432 -4.700 11.231 1.00 . A A . 26 LYS HB2 1 1 2 2262 1 1 26 LYS HB3 H -9.710 -3.964 12.648 1.00 . A A . 26 LYS HB3 1 1 2 2263 1 1 26 LYS HD2 H -12.196 -1.589 10.967 1.00 . A A . 26 LYS HD2 1 1 2 2264 1 1 26 LYS HD3 H -12.275 -3.261 11.484 1.00 . A A . 26 LYS HD3 1 1 2 2265 1 1 26 LYS HE2 H -10.848 -1.299 13.279 1.00 . A A . 26 LYS HE2 1 1 2 2266 1 1 26 LYS HE3 H -12.598 -1.233 13.222 1.00 . A A . 26 LYS HE3 1 1 2 2267 1 1 26 LYS HG2 H -9.630 -1.766 11.515 1.00 . A A . 26 LYS HG2 1 1 2 2268 1 1 26 LYS HG3 H -10.230 -2.477 10.030 1.00 . A A . 26 LYS HG3 1 1 2 2269 1 1 26 LYS HZ1 H -11.763 -2.783 14.934 1.00 . A A . 26 LYS HZ1 1 1 2 2270 1 1 26 LYS HZ2 H -12.678 -3.570 13.841 1.00 . A A . 26 LYS HZ2 1 1 2 2271 1 1 26 LYS N N -8.353 -4.003 9.544 1.00 . A A . 26 LYS N 1 1 2 2272 1 1 26 LYS NZ N -11.813 -3.053 13.958 1.00 . A A . 26 LYS NZ 1 1 2 2273 1 1 26 LYS O O -7.038 -5.726 12.273 1.00 . A A . 26 LYS O 1 1 2 2274 1 1 27 SER C C -6.294 -8.049 10.337 1.00 . A A . 27 SER C 1 1 2 2275 1 1 27 SER CA C -7.768 -7.914 10.722 1.00 . A A . 27 SER CA 1 1 2 2276 1 1 27 SER CB C -8.621 -8.892 9.911 1.00 . A A . 27 SER CB 1 1 2 2277 1 1 27 SER H H -8.832 -6.410 9.749 1.00 . A A . 27 SER H 1 1 2 2278 1 1 27 SER HA H -7.906 -8.108 11.785 1.00 . A A . 27 SER HA 1 1 2 2279 1 1 27 SER HB2 H -8.162 -9.880 9.937 1.00 . A A . 27 SER HB2 1 1 2 2280 1 1 27 SER HB3 H -9.604 -8.985 10.372 1.00 . A A . 27 SER HB3 1 1 2 2281 1 1 27 SER HG H -7.888 -8.177 8.191 1.00 . A A . 27 SER HG 1 1 2 2282 1 1 27 SER N N -8.211 -6.544 10.521 1.00 . A A . 27 SER N 1 1 2 2283 1 1 27 SER O O -5.655 -9.050 10.657 1.00 . A A . 27 SER O 1 1 2 2284 1 1 27 SER OG O -8.770 -8.475 8.557 1.00 . A A . 27 SER OG 1 1 2 2285 1 1 28 VAL C C -3.537 -6.436 10.335 1.00 . A A . 28 VAL C 1 1 2 2286 1 1 28 VAL CA C -4.410 -7.019 9.223 1.00 . A A . 28 VAL CA 1 1 2 2287 1 1 28 VAL CB C -4.278 -6.262 7.900 1.00 . A A . 28 VAL CB 1 1 2 2288 1 1 28 VAL CG1 C -2.855 -6.366 7.348 1.00 . A A . 28 VAL CG1 1 1 2 2289 1 1 28 VAL CG2 C -5.301 -6.761 6.878 1.00 . A A . 28 VAL CG2 1 1 2 2290 1 1 28 VAL H H -6.324 -6.216 9.399 1.00 . A A . 28 VAL H 1 1 2 2291 1 1 28 VAL HA H -4.114 -8.054 9.050 1.00 . A A . 28 VAL HA 1 1 2 2292 1 1 28 VAL HB H -4.486 -5.209 8.095 1.00 . A A . 28 VAL HB 1 1 2 2293 1 1 28 VAL HG11 H -2.142 -6.101 8.128 1.00 . A A . 28 VAL HG11 1 1 2 2294 1 1 28 VAL HG12 H -2.668 -7.388 7.017 1.00 . A A . 28 VAL HG12 1 1 2 2295 1 1 28 VAL HG13 H -2.742 -5.685 6.505 1.00 . A A . 28 VAL HG13 1 1 2 2296 1 1 28 VAL HG21 H -6.010 -7.428 7.369 1.00 . A A . 28 VAL HG21 1 1 2 2297 1 1 28 VAL HG22 H -5.836 -5.911 6.455 1.00 . A A . 28 VAL HG22 1 1 2 2298 1 1 28 VAL HG23 H -4.787 -7.299 6.082 1.00 . A A . 28 VAL HG23 1 1 2 2299 1 1 28 VAL N N -5.797 -7.027 9.655 1.00 . A A . 28 VAL N 1 1 2 2300 1 1 28 VAL O O -3.928 -5.477 10.999 1.00 . A A . 28 VAL O 1 1 2 2301 1 1 29 LYS C C -0.836 -5.250 11.109 1.00 . A A . 29 LYS C 1 1 2 2302 1 1 29 LYS CA C -1.438 -6.593 11.527 1.00 . A A . 29 LYS CA 1 1 2 2303 1 1 29 LYS CB C -0.393 -7.674 11.809 1.00 . A A . 29 LYS CB 1 1 2 2304 1 1 29 LYS CD C -1.451 -9.278 13.442 1.00 . A A . 29 LYS CD 1 1 2 2305 1 1 29 LYS CE C -2.794 -8.766 13.965 1.00 . A A . 29 LYS CE 1 1 2 2306 1 1 29 LYS CG C -0.455 -8.130 13.269 1.00 . A A . 29 LYS CG 1 1 2 2307 1 1 29 LYS H H -2.059 -7.819 9.962 1.00 . A A . 29 LYS H 1 1 2 2308 1 1 29 LYS HA H -2.006 -6.446 12.446 1.00 . A A . 29 LYS HA 1 1 2 2309 1 1 29 LYS HB2 H -0.559 -8.527 11.151 1.00 . A A . 29 LYS HB2 1 1 2 2310 1 1 29 LYS HB3 H 0.603 -7.290 11.587 1.00 . A A . 29 LYS HB3 1 1 2 2311 1 1 29 LYS HD2 H -1.597 -9.785 12.488 1.00 . A A . 29 LYS HD2 1 1 2 2312 1 1 29 LYS HD3 H -1.044 -10.015 14.134 1.00 . A A . 29 LYS HD3 1 1 2 2313 1 1 29 LYS HE2 H -2.904 -9.024 15.018 1.00 . A A . 29 LYS HE2 1 1 2 2314 1 1 29 LYS HE3 H -2.826 -7.678 13.898 1.00 . A A . 29 LYS HE3 1 1 2 2315 1 1 29 LYS HG2 H 0.534 -8.449 13.596 1.00 . A A . 29 LYS HG2 1 1 2 2316 1 1 29 LYS HG3 H -0.747 -7.292 13.902 1.00 . A A . 29 LYS HG3 1 1 2 2317 1 1 29 LYS HZ1 H -3.662 -10.243 12.779 1.00 . A A . 29 LYS HZ1 1 1 2 2318 1 1 29 LYS HZ2 H -4.732 -9.505 13.760 1.00 . A A . 29 LYS HZ2 1 1 2 2319 1 1 29 LYS N N -2.370 -7.040 10.506 1.00 . A A . 29 LYS N 1 1 2 2320 1 1 29 LYS NZ N -3.910 -9.349 13.187 1.00 . A A . 29 LYS NZ 1 1 2 2321 1 1 29 LYS O O -0.520 -5.045 9.938 1.00 . A A . 29 LYS O 1 1 2 2322 1 1 30 CYS C C 1.304 -3.225 11.354 1.00 . A A . 30 CYS C 1 1 2 2323 1 1 30 CYS CA C -0.137 -3.052 11.838 1.00 . A A . 30 CYS CA 1 1 2 2324 1 1 30 CYS CB C -0.220 -2.157 13.076 1.00 . A A . 30 CYS CB 1 1 2 2325 1 1 30 CYS H H -0.955 -4.545 13.039 1.00 . A A . 30 CYS H 1 1 2 2326 1 1 30 CYS HA H -0.753 -2.594 11.064 1.00 . A A . 30 CYS HA 1 1 2 2327 1 1 30 CYS HB2 H 0.598 -2.415 13.749 1.00 . A A . 30 CYS HB2 1 1 2 2328 1 1 30 CYS HB3 H -0.067 -1.122 12.770 1.00 . A A . 30 CYS HB3 1 1 2 2329 1 1 30 CYS N N -0.695 -4.370 12.090 1.00 . A A . 30 CYS N 1 1 2 2330 1 1 30 CYS O O 1.819 -2.388 10.614 1.00 . A A . 30 CYS O 1 1 2 2331 1 1 30 CYS SG S -1.796 -2.268 13.999 1.00 . A A . 30 CYS SG 1 1 2 2332 1 1 31 GLY C C 3.345 -5.265 10.032 1.00 . A A . 31 GLY C 1 1 2 2333 1 1 31 GLY CA C 3.286 -4.610 11.413 1.00 . A A . 31 GLY CA 1 1 2 2334 1 1 31 GLY H H 1.488 -4.992 12.394 1.00 . A A . 31 GLY H 1 1 2 2335 1 1 31 GLY HA2 H 3.871 -3.690 11.408 1.00 . A A . 31 GLY HA2 1 1 2 2336 1 1 31 GLY HA3 H 3.738 -5.270 12.153 1.00 . A A . 31 GLY HA3 1 1 2 2337 1 1 31 GLY N N 1.914 -4.317 11.792 1.00 . A A . 31 GLY N 1 1 2 2338 1 1 31 GLY O O 4.427 -5.570 9.531 1.00 . A A . 31 GLY O 1 1 2 2339 1 1 32 ASP C C 2.311 -5.015 7.068 1.00 . A A . 32 ASP C 1 1 2 2340 1 1 32 ASP CA C 2.074 -6.078 8.142 1.00 . A A . 32 ASP CA 1 1 2 2341 1 1 32 ASP CB C 0.685 -6.678 7.915 1.00 . A A . 32 ASP CB 1 1 2 2342 1 1 32 ASP CG C 0.566 -7.587 6.690 1.00 . A A . 32 ASP CG 1 1 2 2343 1 1 32 ASP H H 1.294 -5.213 9.870 1.00 . A A . 32 ASP H 1 1 2 2344 1 1 32 ASP HA H 2.836 -6.857 8.134 1.00 . A A . 32 ASP HA 1 1 2 2345 1 1 32 ASP HB2 H 0.402 -7.247 8.800 1.00 . A A . 32 ASP HB2 1 1 2 2346 1 1 32 ASP HB3 H -0.034 -5.865 7.816 1.00 . A A . 32 ASP HB3 1 1 2 2347 1 1 32 ASP N N 2.169 -5.464 9.456 1.00 . A A . 32 ASP N 1 1 2 2348 1 1 32 ASP O O 2.846 -5.314 6.002 1.00 . A A . 32 ASP O 1 1 2 2349 1 1 32 ASP OD1 O 1.067 -7.171 5.623 1.00 . A A . 32 ASP OD1 1 1 2 2350 1 1 32 ASP OD2 O -0.024 -8.678 6.848 1.00 . A A . 32 ASP OD2 1 1 2 2351 1 1 33 CYS C C 3.201 -1.799 6.971 1.00 . A A . 33 CYS C 1 1 2 2352 1 1 33 CYS CA C 2.063 -2.687 6.462 1.00 . A A . 33 CYS CA 1 1 2 2353 1 1 33 CYS CB C 0.762 -1.902 6.288 1.00 . A A . 33 CYS CB 1 1 2 2354 1 1 33 CYS H H 1.468 -3.561 8.257 1.00 . A A . 33 CYS H 1 1 2 2355 1 1 33 CYS HA H 2.314 -3.120 5.494 1.00 . A A . 33 CYS HA 1 1 2 2356 1 1 33 CYS HB2 H 0.177 -1.942 7.207 1.00 . A A . 33 CYS HB2 1 1 2 2357 1 1 33 CYS HB3 H 0.983 -0.852 6.097 1.00 . A A . 33 CYS HB3 1 1 2 2358 1 1 33 CYS N N 1.902 -3.796 7.387 1.00 . A A . 33 CYS N 1 1 2 2359 1 1 33 CYS O O 4.160 -1.537 6.246 1.00 . A A . 33 CYS O 1 1 2 2360 1 1 33 CYS SG S -0.207 -2.598 4.900 1.00 . A A . 33 CYS SG 1 1 2 2361 1 1 34 HIS C C 5.279 -1.345 9.214 1.00 . A A . 34 HIS C 1 1 2 2362 1 1 34 HIS CA C 4.060 -0.507 8.826 1.00 . A A . 34 HIS CA 1 1 2 2363 1 1 34 HIS CB C 3.469 0.263 10.009 1.00 . A A . 34 HIS CB 1 1 2 2364 1 1 34 HIS CD2 C 0.964 0.951 9.722 1.00 . A A . 34 HIS CD2 1 1 2 2365 1 1 34 HIS CE1 C 1.282 2.956 8.906 1.00 . A A . 34 HIS CE1 1 1 2 2366 1 1 34 HIS CG C 2.309 1.158 9.641 1.00 . A A . 34 HIS CG 1 1 2 2367 1 1 34 HIS H H 2.273 -1.577 8.795 1.00 . A A . 34 HIS H 1 1 2 2368 1 1 34 HIS HA H 4.356 0.221 8.070 1.00 . A A . 34 HIS HA 1 1 2 2369 1 1 34 HIS HB2 H 3.139 -0.449 10.765 1.00 . A A . 34 HIS HB2 1 1 2 2370 1 1 34 HIS HB3 H 4.253 0.870 10.462 1.00 . A A . 34 HIS HB3 1 1 2 2371 1 1 34 HIS HD1 H 3.356 2.876 8.942 1.00 . A A . 34 HIS HD1 1 1 2 2372 1 1 34 HIS HD2 H 0.479 0.047 10.090 1.00 . A A . 34 HIS HD2 1 1 2 2373 1 1 34 HIS HE1 H 1.083 3.948 8.500 1.00 . A A . 34 HIS HE1 1 1 2 2374 1 1 34 HIS N N 3.057 -1.360 8.212 1.00 . A A . 34 HIS N 1 1 2 2375 1 1 34 HIS ND1 N 2.479 2.430 9.122 1.00 . A A . 34 HIS ND1 1 1 2 2376 1 1 34 HIS NE2 N 0.345 2.038 9.278 1.00 . A A . 34 HIS NE2 1 1 2 2377 1 1 34 HIS O O 5.674 -1.371 10.379 1.00 . A A . 34 HIS O 1 1 2 2378 1 1 35 HIS C C 7.971 -2.144 9.394 1.00 . A A . 35 HIS C 1 1 2 2379 1 1 35 HIS CA C 7.007 -2.849 8.439 1.00 . A A . 35 HIS CA 1 1 2 2380 1 1 35 HIS CB C 7.663 -3.232 7.110 1.00 . A A . 35 HIS CB 1 1 2 2381 1 1 35 HIS CD2 C 7.817 -1.408 5.244 1.00 . A A . 35 HIS CD2 1 1 2 2382 1 1 35 HIS CE1 C 9.682 -0.461 5.886 1.00 . A A . 35 HIS CE1 1 1 2 2383 1 1 35 HIS CG C 8.253 -2.063 6.358 1.00 . A A . 35 HIS CG 1 1 2 2384 1 1 35 HIS H H 5.514 -1.985 7.272 1.00 . A A . 35 HIS H 1 1 2 2385 1 1 35 HIS HA H 6.649 -3.766 8.908 1.00 . A A . 35 HIS HA 1 1 2 2386 1 1 35 HIS HB2 H 8.450 -3.962 7.302 1.00 . A A . 35 HIS HB2 1 1 2 2387 1 1 35 HIS HB3 H 6.922 -3.720 6.478 1.00 . A A . 35 HIS HB3 1 1 2 2388 1 1 35 HIS HD1 H 9.997 -1.695 7.524 1.00 . A A . 35 HIS HD1 1 1 2 2389 1 1 35 HIS HD2 H 6.912 -1.640 4.682 1.00 . A A . 35 HIS HD2 1 1 2 2390 1 1 35 HIS HE1 H 10.539 0.212 5.918 1.00 . A A . 35 HIS HE1 1 1 2 2391 1 1 35 HIS N N 5.841 -2.011 8.216 1.00 . A A . 35 HIS N 1 1 2 2392 1 1 35 HIS ND1 N 9.431 -1.444 6.739 1.00 . A A . 35 HIS ND1 1 1 2 2393 1 1 35 HIS NE2 N 8.680 -0.440 4.961 1.00 . A A . 35 HIS NE2 1 1 2 2394 1 1 35 HIS O O 8.049 -0.917 9.410 1.00 . A A . 35 HIS O 1 1 2 2395 1 1 36 PRO C C 10.922 -1.947 10.440 1.00 . A A . 36 PRO C 1 1 2 2396 1 1 36 PRO CA C 9.657 -2.441 11.146 1.00 . A A . 36 PRO CA 1 1 2 2397 1 1 36 PRO CB C 9.924 -3.584 12.111 1.00 . A A . 36 PRO CB 1 1 2 2398 1 1 36 PRO CD C 8.636 -4.431 10.197 1.00 . A A . 36 PRO CD 1 1 2 2399 1 1 36 PRO CG C 9.472 -4.848 11.397 1.00 . A A . 36 PRO CG 1 1 2 2400 1 1 36 PRO HA H 9.275 -1.644 11.612 1.00 . A A . 36 PRO HA 1 1 2 2401 1 1 36 PRO HB2 H 10.982 -3.639 12.369 1.00 . A A . 36 PRO HB2 1 1 2 2402 1 1 36 PRO HB3 H 9.376 -3.445 13.043 1.00 . A A . 36 PRO HB3 1 1 2 2403 1 1 36 PRO HD2 H 9.033 -4.850 9.273 1.00 . A A . 36 PRO HD2 1 1 2 2404 1 1 36 PRO HD3 H 7.608 -4.781 10.290 1.00 . A A . 36 PRO HD3 1 1 2 2405 1 1 36 PRO HG2 H 10.333 -5.435 11.077 1.00 . A A . 36 PRO HG2 1 1 2 2406 1 1 36 PRO HG3 H 8.888 -5.478 12.068 1.00 . A A . 36 PRO HG3 1 1 2 2407 1 1 36 PRO N N 8.701 -2.972 10.189 1.00 . A A . 36 PRO N 1 1 2 2408 1 1 36 PRO O O 11.668 -2.740 9.868 1.00 . A A . 36 PRO O 1 1 2 2409 1 1 37 VAL C C 13.463 -0.068 10.854 1.00 . A A . 37 VAL C 1 1 2 2410 1 1 37 VAL CA C 12.285 -0.029 9.878 1.00 . A A . 37 VAL CA 1 1 2 2411 1 1 37 VAL CB C 11.943 1.386 9.409 1.00 . A A . 37 VAL CB 1 1 2 2412 1 1 37 VAL CG1 C 13.213 2.193 9.132 1.00 . A A . 37 VAL CG1 1 1 2 2413 1 1 37 VAL CG2 C 11.036 1.351 8.177 1.00 . A A . 37 VAL CG2 1 1 2 2414 1 1 37 VAL H H 10.512 -0.001 10.972 1.00 . A A . 37 VAL H 1 1 2 2415 1 1 37 VAL HA H 12.536 -0.625 9.001 1.00 . A A . 37 VAL HA 1 1 2 2416 1 1 37 VAL HB H 11.398 1.883 10.212 1.00 . A A . 37 VAL HB 1 1 2 2417 1 1 37 VAL HG11 H 13.850 1.642 8.440 1.00 . A A . 37 VAL HG11 1 1 2 2418 1 1 37 VAL HG12 H 12.944 3.154 8.692 1.00 . A A . 37 VAL HG12 1 1 2 2419 1 1 37 VAL HG13 H 13.749 2.359 10.066 1.00 . A A . 37 VAL HG13 1 1 2 2420 1 1 37 VAL HG21 H 10.306 0.550 8.286 1.00 . A A . 37 VAL HG21 1 1 2 2421 1 1 37 VAL HG22 H 10.517 2.305 8.081 1.00 . A A . 37 VAL HG22 1 1 2 2422 1 1 37 VAL HG23 H 11.639 1.174 7.287 1.00 . A A . 37 VAL HG23 1 1 2 2423 1 1 37 VAL N N 11.123 -0.639 10.504 1.00 . A A . 37 VAL N 1 1 2 2424 1 1 37 VAL O O 14.471 -0.721 10.589 1.00 . A A . 37 VAL O 1 1 2 2425 1 1 38 ASN C C 13.998 -0.289 14.097 1.00 . A A . 38 ASN C 1 1 2 2426 1 1 38 ASN CA C 14.334 0.696 12.976 1.00 . A A . 38 ASN CA 1 1 2 2427 1 1 38 ASN CB C 14.431 2.095 13.590 1.00 . A A . 38 ASN CB 1 1 2 2428 1 1 38 ASN CG C 15.868 2.618 13.539 1.00 . A A . 38 ASN CG 1 1 2 2429 1 1 38 ASN H H 12.473 1.169 12.168 1.00 . A A . 38 ASN H 1 1 2 2430 1 1 38 ASN HA H 15.257 0.438 12.457 1.00 . A A . 38 ASN HA 1 1 2 2431 1 1 38 ASN HB2 H 13.772 2.777 13.052 1.00 . A A . 38 ASN HB2 1 1 2 2432 1 1 38 ASN HB3 H 14.086 2.067 14.623 1.00 . A A . 38 ASN HB3 1 1 2 2433 1 1 38 ASN HD21 H 15.207 4.190 12.448 1.00 . A A . 38 ASN HD21 1 1 2 2434 1 1 38 ASN HD22 H 16.908 4.178 12.776 1.00 . A A . 38 ASN HD22 1 1 2 2435 1 1 38 ASN N N 13.297 0.641 11.961 1.00 . A A . 38 ASN N 1 1 2 2436 1 1 38 ASN ND2 N 16.005 3.756 12.866 1.00 . A A . 38 ASN ND2 1 1 2 2437 1 1 38 ASN O O 14.276 -0.024 15.266 1.00 . A A . 38 ASN O 1 1 2 2438 1 1 38 ASN OD1 O 16.790 2.027 14.077 1.00 . A A . 38 ASN OD1 1 1 2 2439 1 1 39 GLY C C 11.741 -2.049 15.395 1.00 . A A . 39 GLY C 1 1 2 2440 1 1 39 GLY CA C 13.027 -2.432 14.659 1.00 . A A . 39 GLY CA 1 1 2 2441 1 1 39 GLY H H 13.182 -1.614 12.749 1.00 . A A . 39 GLY H 1 1 2 2442 1 1 39 GLY HA2 H 12.886 -3.381 14.142 1.00 . A A . 39 GLY HA2 1 1 2 2443 1 1 39 GLY HA3 H 13.833 -2.578 15.378 1.00 . A A . 39 GLY HA3 1 1 2 2444 1 1 39 GLY N N 13.404 -1.406 13.702 1.00 . A A . 39 GLY N 1 1 2 2445 1 1 39 GLY O O 11.265 -2.796 16.248 1.00 . A A . 39 GLY O 1 1 2 2446 1 1 40 LYS C C 8.939 -0.169 14.571 1.00 . A A . 40 LYS C 1 1 2 2447 1 1 40 LYS CA C 9.996 -0.395 15.653 1.00 . A A . 40 LYS CA 1 1 2 2448 1 1 40 LYS CB C 10.285 0.846 16.500 1.00 . A A . 40 LYS CB 1 1 2 2449 1 1 40 LYS CD C 9.307 2.927 17.536 1.00 . A A . 40 LYS CD 1 1 2 2450 1 1 40 LYS CE C 8.361 4.082 17.202 1.00 . A A . 40 LYS CE 1 1 2 2451 1 1 40 LYS CG C 9.036 1.719 16.636 1.00 . A A . 40 LYS CG 1 1 2 2452 1 1 40 LYS H H 11.611 -0.285 14.342 1.00 . A A . 40 LYS H 1 1 2 2453 1 1 40 LYS HA H 9.637 -1.171 16.330 1.00 . A A . 40 LYS HA 1 1 2 2454 1 1 40 LYS HB2 H 10.631 0.544 17.488 1.00 . A A . 40 LYS HB2 1 1 2 2455 1 1 40 LYS HB3 H 11.089 1.423 16.043 1.00 . A A . 40 LYS HB3 1 1 2 2456 1 1 40 LYS HD2 H 9.184 2.642 18.580 1.00 . A A . 40 LYS HD2 1 1 2 2457 1 1 40 LYS HD3 H 10.340 3.252 17.413 1.00 . A A . 40 LYS HD3 1 1 2 2458 1 1 40 LYS HE2 H 8.514 4.900 17.906 1.00 . A A . 40 LYS HE2 1 1 2 2459 1 1 40 LYS HE3 H 8.587 4.470 16.209 1.00 . A A . 40 LYS HE3 1 1 2 2460 1 1 40 LYS HG2 H 8.717 2.060 15.651 1.00 . A A . 40 LYS HG2 1 1 2 2461 1 1 40 LYS HG3 H 8.218 1.130 17.050 1.00 . A A . 40 LYS HG3 1 1 2 2462 1 1 40 LYS HZ1 H 6.825 2.861 17.903 1.00 . A A . 40 LYS HZ1 1 1 2 2463 1 1 40 LYS HZ2 H 6.327 4.371 17.555 1.00 . A A . 40 LYS HZ2 1 1 2 2464 1 1 40 LYS N N 11.217 -0.887 15.037 1.00 . A A . 40 LYS N 1 1 2 2465 1 1 40 LYS NZ N 6.952 3.631 17.256 1.00 . A A . 40 LYS NZ 1 1 2 2466 1 1 40 LYS O O 9.259 0.272 13.468 1.00 . A A . 40 LYS O 1 1 2 2467 1 1 41 GLU C C 5.944 1.056 14.181 1.00 . A A . 41 GLU C 1 1 2 2468 1 1 41 GLU CA C 6.594 -0.317 13.996 1.00 . A A . 41 GLU CA 1 1 2 2469 1 1 41 GLU CB C 5.566 -1.438 14.165 1.00 . A A . 41 GLU CB 1 1 2 2470 1 1 41 GLU CD C 6.606 -3.732 14.285 1.00 . A A . 41 GLU CD 1 1 2 2471 1 1 41 GLU CG C 5.974 -2.680 13.371 1.00 . A A . 41 GLU CG 1 1 2 2472 1 1 41 GLU H H 7.448 -0.838 15.823 1.00 . A A . 41 GLU H 1 1 2 2473 1 1 41 GLU HA H 7.037 -0.386 13.002 1.00 . A A . 41 GLU HA 1 1 2 2474 1 1 41 GLU HB2 H 5.470 -1.692 15.221 1.00 . A A . 41 GLU HB2 1 1 2 2475 1 1 41 GLU HB3 H 4.588 -1.093 13.830 1.00 . A A . 41 GLU HB3 1 1 2 2476 1 1 41 GLU HG2 H 5.100 -3.102 12.875 1.00 . A A . 41 GLU HG2 1 1 2 2477 1 1 41 GLU HG3 H 6.681 -2.401 12.589 1.00 . A A . 41 GLU HG3 1 1 2 2478 1 1 41 GLU N N 7.700 -0.481 14.924 1.00 . A A . 41 GLU N 1 1 2 2479 1 1 41 GLU O O 4.915 1.175 14.845 1.00 . A A . 41 GLU O 1 1 2 2480 1 1 41 GLU OE1 O 7.241 -3.315 15.277 1.00 . A A . 41 GLU OE1 1 1 2 2481 1 1 41 GLU OE2 O 6.438 -4.931 13.971 1.00 . A A . 41 GLU OE2 1 1 2 2482 1 1 42 ASP C C 4.942 3.609 12.656 1.00 . A A . 42 ASP C 1 1 2 2483 1 1 42 ASP CA C 6.067 3.417 13.674 1.00 . A A . 42 ASP CA 1 1 2 2484 1 1 42 ASP CB C 7.166 4.434 13.361 1.00 . A A . 42 ASP CB 1 1 2 2485 1 1 42 ASP CG C 6.737 5.900 13.455 1.00 . A A . 42 ASP CG 1 1 2 2486 1 1 42 ASP H H 7.407 1.952 13.045 1.00 . A A . 42 ASP H 1 1 2 2487 1 1 42 ASP HA H 5.722 3.526 14.703 1.00 . A A . 42 ASP HA 1 1 2 2488 1 1 42 ASP HB2 H 7.998 4.271 14.047 1.00 . A A . 42 ASP HB2 1 1 2 2489 1 1 42 ASP HB3 H 7.541 4.245 12.355 1.00 . A A . 42 ASP HB3 1 1 2 2490 1 1 42 ASP N N 6.571 2.058 13.583 1.00 . A A . 42 ASP N 1 1 2 2491 1 1 42 ASP O O 5.036 3.134 11.525 1.00 . A A . 42 ASP O 1 1 2 2492 1 1 42 ASP OD1 O 6.455 6.337 14.591 1.00 . A A . 42 ASP OD1 1 1 2 2493 1 1 42 ASP OD2 O 6.700 6.550 12.387 1.00 . A A . 42 ASP OD2 1 1 2 2494 1 1 43 TYR C C 2.932 5.885 11.479 1.00 . A A . 43 TYR C 1 1 2 2495 1 1 43 TYR CA C 2.761 4.565 12.234 1.00 . A A . 43 TYR CA 1 1 2 2496 1 1 43 TYR CB C 1.551 4.676 13.163 1.00 . A A . 43 TYR CB 1 1 2 2497 1 1 43 TYR CD1 C 1.917 2.226 13.633 1.00 . A A . 43 TYR CD1 1 1 2 2498 1 1 43 TYR CD2 C 0.245 3.384 14.890 1.00 . A A . 43 TYR CD2 1 1 2 2499 1 1 43 TYR CE1 C 1.612 1.013 14.345 1.00 . A A . 43 TYR CE1 1 1 2 2500 1 1 43 TYR CE2 C -0.059 2.170 15.603 1.00 . A A . 43 TYR CE2 1 1 2 2501 1 1 43 TYR CG C 1.227 3.387 13.920 1.00 . A A . 43 TYR CG 1 1 2 2502 1 1 43 TYR CZ C 0.639 1.044 15.295 1.00 . A A . 43 TYR CZ 1 1 2 2503 1 1 43 TYR H H 3.835 4.689 14.014 1.00 . A A . 43 TYR H 1 1 2 2504 1 1 43 TYR HA H 2.689 3.750 11.514 1.00 . A A . 43 TYR HA 1 1 2 2505 1 1 43 TYR HB2 H 1.731 5.473 13.884 1.00 . A A . 43 TYR HB2 1 1 2 2506 1 1 43 TYR HB3 H 0.680 4.969 12.576 1.00 . A A . 43 TYR HB3 1 1 2 2507 1 1 43 TYR HD1 H 2.692 2.229 12.866 1.00 . A A . 43 TYR HD1 1 1 2 2508 1 1 43 TYR HD2 H -0.299 4.300 15.117 1.00 . A A . 43 TYR HD2 1 1 2 2509 1 1 43 TYR HE1 H 2.149 0.089 14.128 1.00 . A A . 43 TYR HE1 1 1 2 2510 1 1 43 TYR HE2 H -0.832 2.154 16.371 1.00 . A A . 43 TYR HE2 1 1 2 2511 1 1 43 TYR HH H 0.980 -0.213 16.738 1.00 . A A . 43 TYR HH 1 1 2 2512 1 1 43 TYR N N 3.903 4.306 13.093 1.00 . A A . 43 TYR N 1 1 2 2513 1 1 43 TYR O O 2.395 6.913 11.889 1.00 . A A . 43 TYR O 1 1 2 2514 1 1 43 TYR OH O 0.352 -0.102 15.968 1.00 . A A . 43 TYR OH 1 1 2 2515 1 1 44 ARG C C 3.451 6.752 8.138 1.00 . A A . 44 ARG C 1 1 2 2516 1 1 44 ARG CA C 3.929 6.990 9.572 1.00 . A A . 44 ARG CA 1 1 2 2517 1 1 44 ARG CB C 5.418 7.343 9.554 1.00 . A A . 44 ARG CB 1 1 2 2518 1 1 44 ARG CD C 7.134 8.926 10.506 1.00 . A A . 44 ARG CD 1 1 2 2519 1 1 44 ARG CG C 5.659 8.731 10.150 1.00 . A A . 44 ARG CG 1 1 2 2520 1 1 44 ARG CZ C 8.648 10.862 10.969 1.00 . A A . 44 ARG CZ 1 1 2 2521 1 1 44 ARG H H 4.113 4.973 10.061 1.00 . A A . 44 ARG H 1 1 2 2522 1 1 44 ARG HA H 3.358 7.786 10.049 1.00 . A A . 44 ARG HA 1 1 2 2523 1 1 44 ARG HB2 H 5.979 6.598 10.119 1.00 . A A . 44 ARG HB2 1 1 2 2524 1 1 44 ARG HB3 H 5.790 7.313 8.530 1.00 . A A . 44 ARG HB3 1 1 2 2525 1 1 44 ARG HD2 H 7.356 8.433 11.452 1.00 . A A . 44 ARG HD2 1 1 2 2526 1 1 44 ARG HD3 H 7.764 8.461 9.748 1.00 . A A . 44 ARG HD3 1 1 2 2527 1 1 44 ARG HE H 6.718 11.021 10.386 1.00 . A A . 44 ARG HE 1 1 2 2528 1 1 44 ARG HG2 H 5.349 9.496 9.437 1.00 . A A . 44 ARG HG2 1 1 2 2529 1 1 44 ARG HG3 H 5.046 8.860 11.042 1.00 . A A . 44 ARG HG3 1 1 2 2530 1 1 44 ARG HH11 H 9.531 9.039 11.232 1.00 . A A . 44 ARG HH11 1 1 2 2531 1 1 44 ARG HH12 H 10.553 10.402 11.545 1.00 . A A . 44 ARG HH12 1 1 2 2532 1 1 44 ARG HH21 H 9.671 12.615 11.284 1.00 . A A . 44 ARG HH21 1 1 2 2533 1 1 44 ARG N N 3.681 5.813 10.388 1.00 . A A . 44 ARG N 1 1 2 2534 1 1 44 ARG NE N 7.445 10.370 10.604 1.00 . A A . 44 ARG NE 1 1 2 2535 1 1 44 ARG NH1 N 9.665 10.029 11.275 1.00 . A A . 44 ARG NH1 1 1 2 2536 1 1 44 ARG NH2 N 8.814 12.171 11.023 1.00 . A A . 44 ARG NH2 1 1 2 2537 1 1 44 ARG O O 3.052 5.642 7.789 1.00 . A A . 44 ARG O 1 1 2 2538 1 1 45 LYS C C 4.187 7.070 5.131 1.00 . A A . 45 LYS C 1 1 2 2539 1 1 45 LYS CA C 3.084 7.733 5.958 1.00 . A A . 45 LYS CA 1 1 2 2540 1 1 45 LYS CB C 2.675 9.114 5.443 1.00 . A A . 45 LYS CB 1 1 2 2541 1 1 45 LYS CD C 1.956 10.480 7.437 1.00 . A A . 45 LYS CD 1 1 2 2542 1 1 45 LYS CE C 1.353 11.886 7.415 1.00 . A A . 45 LYS CE 1 1 2 2543 1 1 45 LYS CG C 1.485 9.663 6.232 1.00 . A A . 45 LYS CG 1 1 2 2544 1 1 45 LYS H H 3.833 8.711 7.638 1.00 . A A . 45 LYS H 1 1 2 2545 1 1 45 LYS HA H 2.198 7.100 5.923 1.00 . A A . 45 LYS HA 1 1 2 2546 1 1 45 LYS HB2 H 3.517 9.801 5.523 1.00 . A A . 45 LYS HB2 1 1 2 2547 1 1 45 LYS HB3 H 2.416 9.050 4.386 1.00 . A A . 45 LYS HB3 1 1 2 2548 1 1 45 LYS HD2 H 1.671 9.973 8.359 1.00 . A A . 45 LYS HD2 1 1 2 2549 1 1 45 LYS HD3 H 3.043 10.547 7.433 1.00 . A A . 45 LYS HD3 1 1 2 2550 1 1 45 LYS HE2 H 1.339 12.266 6.394 1.00 . A A . 45 LYS HE2 1 1 2 2551 1 1 45 LYS HE3 H 0.318 11.850 7.756 1.00 . A A . 45 LYS HE3 1 1 2 2552 1 1 45 LYS HG2 H 0.870 10.286 5.583 1.00 . A A . 45 LYS HG2 1 1 2 2553 1 1 45 LYS HG3 H 0.857 8.839 6.570 1.00 . A A . 45 LYS HG3 1 1 2 2554 1 1 45 LYS HZ1 H 1.716 12.904 9.197 1.00 . A A . 45 LYS HZ1 1 1 2 2555 1 1 45 LYS HZ2 H 3.081 12.466 8.425 1.00 . A A . 45 LYS HZ2 1 1 2 2556 1 1 45 LYS N N 3.507 7.812 7.346 1.00 . A A . 45 LYS N 1 1 2 2557 1 1 45 LYS NZ N 2.135 12.799 8.280 1.00 . A A . 45 LYS NZ 1 1 2 2558 1 1 45 LYS O O 5.356 7.436 5.242 1.00 . A A . 45 LYS O 1 1 2 2559 1 1 46 CYS C C 5.436 6.405 2.586 1.00 . A A . 46 CYS C 1 1 2 2560 1 1 46 CYS CA C 4.715 5.389 3.474 1.00 . A A . 46 CYS CA 1 1 2 2561 1 1 46 CYS CB C 4.019 4.303 2.651 1.00 . A A . 46 CYS CB 1 1 2 2562 1 1 46 CYS H H 2.823 5.815 4.235 1.00 . A A . 46 CYS H 1 1 2 2563 1 1 46 CYS HA H 5.419 4.890 4.141 1.00 . A A . 46 CYS HA 1 1 2 2564 1 1 46 CYS HB2 H 3.604 4.759 1.752 1.00 . A A . 46 CYS HB2 1 1 2 2565 1 1 46 CYS HB3 H 4.766 3.579 2.325 1.00 . A A . 46 CYS HB3 1 1 2 2566 1 1 46 CYS N N 3.776 6.106 4.320 1.00 . A A . 46 CYS N 1 1 2 2567 1 1 46 CYS O O 6.660 6.374 2.467 1.00 . A A . 46 CYS O 1 1 2 2568 1 1 46 CYS SG S 2.683 3.412 3.528 1.00 . A A . 46 CYS SG 1 1 2 2569 1 1 47 GLY C C 5.804 9.450 1.921 1.00 . A A . 47 GLY C 1 1 2 2570 1 1 47 GLY CA C 5.193 8.306 1.110 1.00 . A A . 47 GLY CA 1 1 2 2571 1 1 47 GLY H H 3.651 7.301 2.086 1.00 . A A . 47 GLY H 1 1 2 2572 1 1 47 GLY HA2 H 5.952 7.868 0.463 1.00 . A A . 47 GLY HA2 1 1 2 2573 1 1 47 GLY HA3 H 4.407 8.694 0.463 1.00 . A A . 47 GLY HA3 1 1 2 2574 1 1 47 GLY N N 4.646 7.282 1.985 1.00 . A A . 47 GLY N 1 1 2 2575 1 1 47 GLY O O 5.487 10.616 1.693 1.00 . A A . 47 GLY O 1 1 2 2576 1 1 48 THR C C 8.705 10.411 3.132 1.00 . A A . 48 THR C 1 1 2 2577 1 1 48 THR CA C 7.329 10.056 3.698 1.00 . A A . 48 THR CA 1 1 2 2578 1 1 48 THR CB C 7.383 9.493 5.120 1.00 . A A . 48 THR CB 1 1 2 2579 1 1 48 THR CG2 C 8.457 10.168 5.976 1.00 . A A . 48 THR CG2 1 1 2 2580 1 1 48 THR H H 6.923 8.125 3.031 1.00 . A A . 48 THR H 1 1 2 2581 1 1 48 THR HA H 6.735 10.970 3.691 1.00 . A A . 48 THR HA 1 1 2 2582 1 1 48 THR HB H 7.519 8.412 5.105 1.00 . A A . 48 THR HB 1 1 2 2583 1 1 48 THR HG1 H 6.195 9.804 6.700 1.00 . A A . 48 THR HG1 1 1 2 2584 1 1 48 THR HG21 H 9.403 10.172 5.436 1.00 . A A . 48 THR HG21 1 1 2 2585 1 1 48 THR HG22 H 8.158 11.193 6.193 1.00 . A A . 48 THR HG22 1 1 2 2586 1 1 48 THR HG23 H 8.574 9.619 6.911 1.00 . A A . 48 THR HG23 1 1 2 2587 1 1 48 THR N N 6.670 9.076 2.852 1.00 . A A . 48 THR N 1 1 2 2588 1 1 48 THR O O 9.487 9.525 2.792 1.00 . A A . 48 THR O 1 1 2 2589 1 1 48 THR OG1 O 6.155 9.914 5.707 1.00 . A A . 48 THR OG1 1 1 2 2590 1 1 49 ALA C C 11.373 11.553 3.319 1.00 . A A . 49 ALA C 1 1 2 2591 1 1 49 ALA CA C 10.228 12.191 2.530 1.00 . A A . 49 ALA CA 1 1 2 2592 1 1 49 ALA CB C 10.257 13.720 2.593 1.00 . A A . 49 ALA CB 1 1 2 2593 1 1 49 ALA H H 8.318 12.423 3.329 1.00 . A A . 49 ALA H 1 1 2 2594 1 1 49 ALA HA H 10.299 11.882 1.487 1.00 . A A . 49 ALA HA 1 1 2 2595 1 1 49 ALA HB1 H 9.396 14.077 3.158 1.00 . A A . 49 ALA HB1 1 1 2 2596 1 1 49 ALA HB2 H 11.174 14.046 3.084 1.00 . A A . 49 ALA HB2 1 1 2 2597 1 1 49 ALA HB3 H 10.222 14.126 1.582 1.00 . A A . 49 ALA HB3 1 1 2 2598 1 1 49 ALA N N 8.959 11.709 3.049 1.00 . A A . 49 ALA N 1 1 2 2599 1 1 49 ALA O O 11.591 11.887 4.483 1.00 . A A . 49 ALA O 1 1 2 2600 1 1 50 GLY C C 12.933 8.453 3.357 1.00 . A A . 50 GLY C 1 1 2 2601 1 1 50 GLY CA C 13.191 9.959 3.278 1.00 . A A . 50 GLY CA 1 1 2 2602 1 1 50 GLY H H 11.890 10.382 1.707 1.00 . A A . 50 GLY H 1 1 2 2603 1 1 50 GLY HA2 H 14.102 10.146 2.710 1.00 . A A . 50 GLY HA2 1 1 2 2604 1 1 50 GLY HA3 H 13.353 10.356 4.280 1.00 . A A . 50 GLY HA3 1 1 2 2605 1 1 50 GLY N N 12.074 10.647 2.654 1.00 . A A . 50 GLY N 1 1 2 2606 1 1 50 GLY O O 13.849 7.675 3.620 1.00 . A A . 50 GLY O 1 1 2 2607 1 1 51 CYS C C 11.084 6.204 1.729 1.00 . A A . 51 CYS C 1 1 2 2608 1 1 51 CYS CA C 11.290 6.688 3.165 1.00 . A A . 51 CYS CA 1 1 2 2609 1 1 51 CYS CB C 10.042 6.474 4.024 1.00 . A A . 51 CYS CB 1 1 2 2610 1 1 51 CYS H H 10.942 8.726 2.910 1.00 . A A . 51 CYS H 1 1 2 2611 1 1 51 CYS HA H 12.109 6.148 3.642 1.00 . A A . 51 CYS HA 1 1 2 2612 1 1 51 CYS HB2 H 9.239 7.126 3.681 1.00 . A A . 51 CYS HB2 1 1 2 2613 1 1 51 CYS HB3 H 9.688 5.449 3.917 1.00 . A A . 51 CYS HB3 1 1 2 2614 1 1 51 CYS N N 11.681 8.087 3.124 1.00 . A A . 51 CYS N 1 1 2 2615 1 1 51 CYS O O 12.021 5.729 1.089 1.00 . A A . 51 CYS O 1 1 2 2616 1 1 51 CYS SG S 10.424 6.823 5.780 1.00 . A A . 51 CYS SG 1 1 2 2617 1 1 52 HIS C C 9.246 7.156 -0.954 1.00 . A A . 52 HIS C 1 1 2 2618 1 1 52 HIS CA C 9.510 5.924 -0.086 1.00 . A A . 52 HIS CA 1 1 2 2619 1 1 52 HIS CB C 8.333 4.946 -0.071 1.00 . A A . 52 HIS CB 1 1 2 2620 1 1 52 HIS CD2 C 8.240 3.081 1.758 1.00 . A A . 52 HIS CD2 1 1 2 2621 1 1 52 HIS CE1 C 9.549 1.624 0.782 1.00 . A A . 52 HIS CE1 1 1 2 2622 1 1 52 HIS CG C 8.647 3.616 0.571 1.00 . A A . 52 HIS CG 1 1 2 2623 1 1 52 HIS H H 9.095 6.729 1.789 1.00 . A A . 52 HIS H 1 1 2 2624 1 1 52 HIS HA H 10.377 5.393 -0.478 1.00 . A A . 52 HIS HA 1 1 2 2625 1 1 52 HIS HB2 H 7.499 5.406 0.460 1.00 . A A . 52 HIS HB2 1 1 2 2626 1 1 52 HIS HB3 H 8.003 4.775 -1.095 1.00 . A A . 52 HIS HB3 1 1 2 2627 1 1 52 HIS HD1 H 9.930 2.771 -0.904 1.00 . A A . 52 HIS HD1 1 1 2 2628 1 1 52 HIS HD2 H 7.580 3.560 2.480 1.00 . A A . 52 HIS HD2 1 1 2 2629 1 1 52 HIS HE1 H 10.123 0.716 0.596 1.00 . A A . 52 HIS HE1 1 1 2 2630 1 1 52 HIS N N 9.851 6.341 1.263 1.00 . A A . 52 HIS N 1 1 2 2631 1 1 52 HIS ND1 N 9.471 2.675 -0.021 1.00 . A A . 52 HIS ND1 1 1 2 2632 1 1 52 HIS NE2 N 8.785 1.877 1.884 1.00 . A A . 52 HIS NE2 1 1 2 2633 1 1 52 HIS O O 8.106 7.424 -1.328 1.00 . A A . 52 HIS O 1 1 2 2634 1 1 53 ASP C C 11.306 9.041 -3.142 1.00 . A A . 53 ASP C 1 1 2 2635 1 1 53 ASP CA C 10.220 9.071 -2.065 1.00 . A A . 53 ASP CA 1 1 2 2636 1 1 53 ASP CB C 10.425 10.331 -1.221 1.00 . A A . 53 ASP CB 1 1 2 2637 1 1 53 ASP CG C 9.690 11.574 -1.727 1.00 . A A . 53 ASP CG 1 1 2 2638 1 1 53 ASP H H 11.245 7.648 -0.941 1.00 . A A . 53 ASP H 1 1 2 2639 1 1 53 ASP HA H 9.214 9.047 -2.485 1.00 . A A . 53 ASP HA 1 1 2 2640 1 1 53 ASP HB2 H 10.100 10.124 -0.202 1.00 . A A . 53 ASP HB2 1 1 2 2641 1 1 53 ASP HB3 H 11.492 10.551 -1.178 1.00 . A A . 53 ASP HB3 1 1 2 2642 1 1 53 ASP N N 10.321 7.873 -1.249 1.00 . A A . 53 ASP N 1 1 2 2643 1 1 53 ASP O O 12.302 9.756 -3.044 1.00 . A A . 53 ASP O 1 1 2 2644 1 1 53 ASP OD1 O 8.470 11.451 -1.971 1.00 . A A . 53 ASP OD1 1 1 2 2645 1 1 53 ASP OD2 O 10.364 12.618 -1.857 1.00 . A A . 53 ASP OD2 1 1 2 2646 1 1 54 SER C C 11.451 8.719 -6.506 1.00 . A A . 54 SER C 1 1 2 2647 1 1 54 SER CA C 12.022 8.076 -5.241 1.00 . A A . 54 SER CA 1 1 2 2648 1 1 54 SER CB C 12.363 6.607 -5.500 1.00 . A A . 54 SER CB 1 1 2 2649 1 1 54 SER H H 10.262 7.631 -4.219 1.00 . A A . 54 SER H 1 1 2 2650 1 1 54 SER HA H 12.917 8.604 -4.914 1.00 . A A . 54 SER HA 1 1 2 2651 1 1 54 SER HB2 H 12.484 6.090 -4.548 1.00 . A A . 54 SER HB2 1 1 2 2652 1 1 54 SER HB3 H 11.533 6.128 -6.019 1.00 . A A . 54 SER HB3 1 1 2 2653 1 1 54 SER HG H 14.321 6.892 -5.800 1.00 . A A . 54 SER HG 1 1 2 2654 1 1 54 SER N N 11.075 8.208 -4.146 1.00 . A A . 54 SER N 1 1 2 2655 1 1 54 SER O O 12.202 9.146 -7.382 1.00 . A A . 54 SER O 1 1 2 2656 1 1 54 SER OG O 13.551 6.463 -6.273 1.00 . A A . 54 SER OG 1 1 2 2657 1 1 55 MET C C 9.977 8.765 -9.016 1.00 . A A . 55 MET C 1 1 2 2658 1 1 55 MET CA C 9.449 9.352 -7.706 1.00 . A A . 55 MET CA 1 1 2 2659 1 1 55 MET CB C 9.657 10.868 -7.705 1.00 . A A . 55 MET CB 1 1 2 2660 1 1 55 MET CE C 7.372 10.248 -5.121 1.00 . A A . 55 MET CE 1 1 2 2661 1 1 55 MET CG C 8.381 11.595 -7.276 1.00 . A A . 55 MET CG 1 1 2 2662 1 1 55 MET H H 9.525 8.418 -5.845 1.00 . A A . 55 MET H 1 1 2 2663 1 1 55 MET HA H 8.396 9.095 -7.583 1.00 . A A . 55 MET HA 1 1 2 2664 1 1 55 MET HB2 H 10.472 11.126 -7.029 1.00 . A A . 55 MET HB2 1 1 2 2665 1 1 55 MET HB3 H 9.951 11.198 -8.701 1.00 . A A . 55 MET HB3 1 1 2 2666 1 1 55 MET HE1 H 6.906 9.873 -6.031 1.00 . A A . 55 MET HE1 1 1 2 2667 1 1 55 MET HE2 H 8.035 9.485 -4.711 1.00 . A A . 55 MET HE2 1 1 2 2668 1 1 55 MET HE3 H 6.601 10.489 -4.390 1.00 . A A . 55 MET HE3 1 1 2 2669 1 1 55 MET HG2 H 8.356 12.592 -7.717 1.00 . A A . 55 MET HG2 1 1 2 2670 1 1 55 MET HG3 H 7.506 11.061 -7.645 1.00 . A A . 55 MET HG3 1 1 2 2671 1 1 55 MET N N 10.128 8.768 -6.562 1.00 . A A . 55 MET N 1 1 2 2672 1 1 55 MET O O 10.052 9.461 -10.027 1.00 . A A . 55 MET O 1 1 2 2673 1 1 55 MET SD S 8.316 11.716 -5.496 1.00 . A A . 55 MET SD 1 1 2 2674 1 1 56 ASP C C 10.071 5.500 -10.335 1.00 . A A . 56 ASP C 1 1 2 2675 1 1 56 ASP CA C 10.850 6.800 -10.125 1.00 . A A . 56 ASP CA 1 1 2 2676 1 1 56 ASP CB C 12.326 6.443 -9.943 1.00 . A A . 56 ASP CB 1 1 2 2677 1 1 56 ASP CG C 13.314 7.492 -10.455 1.00 . A A . 56 ASP CG 1 1 2 2678 1 1 56 ASP H H 10.266 6.929 -8.130 1.00 . A A . 56 ASP H 1 1 2 2679 1 1 56 ASP HA H 10.722 7.501 -10.951 1.00 . A A . 56 ASP HA 1 1 2 2680 1 1 56 ASP HB2 H 12.516 6.275 -8.882 1.00 . A A . 56 ASP HB2 1 1 2 2681 1 1 56 ASP HB3 H 12.523 5.500 -10.455 1.00 . A A . 56 ASP HB3 1 1 2 2682 1 1 56 ASP N N 10.330 7.489 -8.956 1.00 . A A . 56 ASP N 1 1 2 2683 1 1 56 ASP O O 10.609 4.412 -10.140 1.00 . A A . 56 ASP O 1 1 2 2684 1 1 56 ASP OD1 O 13.193 7.853 -11.646 1.00 . A A . 56 ASP OD1 1 1 2 2685 1 1 56 ASP OD2 O 14.169 7.911 -9.645 1.00 . A A . 56 ASP OD2 1 1 2 2686 1 1 57 LYS C C 8.760 3.414 -11.670 1.00 . A A . 57 LYS C 1 1 2 2687 1 1 57 LYS CA C 7.957 4.509 -10.966 1.00 . A A . 57 LYS CA 1 1 2 2688 1 1 57 LYS CB C 6.697 4.931 -11.724 1.00 . A A . 57 LYS CB 1 1 2 2689 1 1 57 LYS CD C 6.246 3.683 -13.869 1.00 . A A . 57 LYS CD 1 1 2 2690 1 1 57 LYS CE C 4.936 3.455 -14.625 1.00 . A A . 57 LYS CE 1 1 2 2691 1 1 57 LYS CG C 6.008 3.720 -12.358 1.00 . A A . 57 LYS CG 1 1 2 2692 1 1 57 LYS H H 8.386 6.546 -10.885 1.00 . A A . 57 LYS H 1 1 2 2693 1 1 57 LYS HA H 7.638 4.133 -9.994 1.00 . A A . 57 LYS HA 1 1 2 2694 1 1 57 LYS HB2 H 6.008 5.430 -11.043 1.00 . A A . 57 LYS HB2 1 1 2 2695 1 1 57 LYS HB3 H 6.957 5.652 -12.498 1.00 . A A . 57 LYS HB3 1 1 2 2696 1 1 57 LYS HD2 H 6.699 4.621 -14.193 1.00 . A A . 57 LYS HD2 1 1 2 2697 1 1 57 LYS HD3 H 6.952 2.889 -14.110 1.00 . A A . 57 LYS HD3 1 1 2 2698 1 1 57 LYS HE2 H 4.444 2.558 -14.250 1.00 . A A . 57 LYS HE2 1 1 2 2699 1 1 57 LYS HE3 H 4.257 4.289 -14.448 1.00 . A A . 57 LYS HE3 1 1 2 2700 1 1 57 LYS HG2 H 6.385 2.804 -11.904 1.00 . A A . 57 LYS HG2 1 1 2 2701 1 1 57 LYS HG3 H 4.937 3.760 -12.156 1.00 . A A . 57 LYS HG3 1 1 2 2702 1 1 57 LYS HZ1 H 4.912 2.407 -16.426 1.00 . A A . 57 LYS HZ1 1 1 2 2703 1 1 57 LYS HZ2 H 4.688 4.009 -16.619 1.00 . A A . 57 LYS HZ2 1 1 2 2704 1 1 57 LYS N N 8.816 5.657 -10.729 1.00 . A A . 57 LYS N 1 1 2 2705 1 1 57 LYS NZ N 5.192 3.317 -16.076 1.00 . A A . 57 LYS NZ 1 1 2 2706 1 1 57 LYS O O 8.784 2.269 -11.219 1.00 . A A . 57 LYS O 1 1 2 2707 1 1 58 LYS C C 11.543 2.653 -12.831 1.00 . A A . 58 LYS C 1 1 2 2708 1 1 58 LYS CA C 10.202 2.868 -13.534 1.00 . A A . 58 LYS CA 1 1 2 2709 1 1 58 LYS CB C 10.336 3.344 -14.982 1.00 . A A . 58 LYS CB 1 1 2 2710 1 1 58 LYS CD C 10.573 5.582 -16.121 1.00 . A A . 58 LYS CD 1 1 2 2711 1 1 58 LYS CE C 11.666 6.481 -16.703 1.00 . A A . 58 LYS CE 1 1 2 2712 1 1 58 LYS CG C 11.146 4.639 -15.061 1.00 . A A . 58 LYS CG 1 1 2 2713 1 1 58 LYS H H 9.376 4.736 -13.123 1.00 . A A . 58 LYS H 1 1 2 2714 1 1 58 LYS HA H 9.667 1.919 -13.555 1.00 . A A . 58 LYS HA 1 1 2 2715 1 1 58 LYS HB2 H 10.819 2.572 -15.580 1.00 . A A . 58 LYS HB2 1 1 2 2716 1 1 58 LYS HB3 H 9.346 3.504 -15.409 1.00 . A A . 58 LYS HB3 1 1 2 2717 1 1 58 LYS HD2 H 10.113 4.999 -16.919 1.00 . A A . 58 LYS HD2 1 1 2 2718 1 1 58 LYS HD3 H 9.788 6.196 -15.681 1.00 . A A . 58 LYS HD3 1 1 2 2719 1 1 58 LYS HE2 H 11.244 7.451 -16.966 1.00 . A A . 58 LYS HE2 1 1 2 2720 1 1 58 LYS HE3 H 12.435 6.661 -15.953 1.00 . A A . 58 LYS HE3 1 1 2 2721 1 1 58 LYS HG2 H 11.143 5.134 -14.089 1.00 . A A . 58 LYS HG2 1 1 2 2722 1 1 58 LYS HG3 H 12.185 4.409 -15.297 1.00 . A A . 58 LYS HG3 1 1 2 2723 1 1 58 LYS HZ1 H 12.916 5.113 -17.656 1.00 . A A . 58 LYS HZ1 1 1 2 2724 1 1 58 LYS HZ2 H 11.568 5.444 -18.509 1.00 . A A . 58 LYS HZ2 1 1 2 2725 1 1 58 LYS N N 9.399 3.803 -12.763 1.00 . A A . 58 LYS N 1 1 2 2726 1 1 58 LYS NZ N 12.269 5.854 -17.901 1.00 . A A . 58 LYS NZ 1 1 2 2727 1 1 58 LYS O O 12.596 2.968 -13.384 1.00 . A A . 58 LYS O 1 1 2 2728 1 1 59 ASP C C 12.277 1.061 -9.587 1.00 . A A . 59 ASP C 1 1 2 2729 1 1 59 ASP CA C 12.657 1.857 -10.837 1.00 . A A . 59 ASP CA 1 1 2 2730 1 1 59 ASP CB C 13.314 3.163 -10.384 1.00 . A A . 59 ASP CB 1 1 2 2731 1 1 59 ASP CG C 14.695 3.004 -9.745 1.00 . A A . 59 ASP CG 1 1 2 2732 1 1 59 ASP H H 10.602 1.864 -11.179 1.00 . A A . 59 ASP H 1 1 2 2733 1 1 59 ASP HA H 13.319 1.301 -11.500 1.00 . A A . 59 ASP HA 1 1 2 2734 1 1 59 ASP HB2 H 13.403 3.825 -11.246 1.00 . A A . 59 ASP HB2 1 1 2 2735 1 1 59 ASP HB3 H 12.654 3.656 -9.670 1.00 . A A . 59 ASP HB3 1 1 2 2736 1 1 59 ASP N N 11.462 2.118 -11.622 1.00 . A A . 59 ASP N 1 1 2 2737 1 1 59 ASP O O 11.961 1.641 -8.549 1.00 . A A . 59 ASP O 1 1 2 2738 1 1 59 ASP OD1 O 15.155 1.844 -9.670 1.00 . A A . 59 ASP OD1 1 1 2 2739 1 1 59 ASP OD2 O 15.259 4.046 -9.346 1.00 . A A . 59 ASP OD2 1 1 2 2740 1 1 60 LYS C C 13.235 -1.388 -7.777 1.00 . A A . 60 LYS C 1 1 2 2741 1 1 60 LYS CA C 11.984 -1.137 -8.622 1.00 . A A . 60 LYS CA 1 1 2 2742 1 1 60 LYS CB C 11.325 -2.417 -9.139 1.00 . A A . 60 LYS CB 1 1 2 2743 1 1 60 LYS CD C 12.096 -3.409 -11.325 1.00 . A A . 60 LYS CD 1 1 2 2744 1 1 60 LYS CE C 12.623 -4.726 -11.899 1.00 . A A . 60 LYS CE 1 1 2 2745 1 1 60 LYS CG C 12.351 -3.326 -9.819 1.00 . A A . 60 LYS CG 1 1 2 2746 1 1 60 LYS H H 12.579 -0.720 -10.574 1.00 . A A . 60 LYS H 1 1 2 2747 1 1 60 LYS HA H 11.248 -0.622 -8.005 1.00 . A A . 60 LYS HA 1 1 2 2748 1 1 60 LYS HB2 H 10.854 -2.949 -8.312 1.00 . A A . 60 LYS HB2 1 1 2 2749 1 1 60 LYS HB3 H 10.534 -2.164 -9.845 1.00 . A A . 60 LYS HB3 1 1 2 2750 1 1 60 LYS HD2 H 11.027 -3.324 -11.523 1.00 . A A . 60 LYS HD2 1 1 2 2751 1 1 60 LYS HD3 H 12.580 -2.571 -11.826 1.00 . A A . 60 LYS HD3 1 1 2 2752 1 1 60 LYS HE2 H 13.595 -4.957 -11.463 1.00 . A A . 60 LYS HE2 1 1 2 2753 1 1 60 LYS HE3 H 11.951 -5.542 -11.629 1.00 . A A . 60 LYS HE3 1 1 2 2754 1 1 60 LYS HG2 H 13.356 -2.946 -9.637 1.00 . A A . 60 LYS HG2 1 1 2 2755 1 1 60 LYS HG3 H 12.303 -4.324 -9.383 1.00 . A A . 60 LYS HG3 1 1 2 2756 1 1 60 LYS HZ1 H 11.882 -4.317 -13.803 1.00 . A A . 60 LYS HZ1 1 1 2 2757 1 1 60 LYS HZ2 H 13.472 -3.999 -13.657 1.00 . A A . 60 LYS HZ2 1 1 2 2758 1 1 60 LYS N N 12.320 -0.256 -9.727 1.00 . A A . 60 LYS N 1 1 2 2759 1 1 60 LYS NZ N 12.740 -4.640 -13.372 1.00 . A A . 60 LYS NZ 1 1 2 2760 1 1 60 LYS O O 14.342 -1.458 -8.306 1.00 . A A . 60 LYS O 1 1 2 2761 1 1 61 SER C C 13.598 -1.717 -4.111 1.00 . A A . 61 SER C 1 1 2 2762 1 1 61 SER CA C 14.111 -1.757 -5.552 1.00 . A A . 61 SER CA 1 1 2 2763 1 1 61 SER CB C 15.230 -0.733 -5.747 1.00 . A A . 61 SER CB 1 1 2 2764 1 1 61 SER H H 12.111 -1.458 -6.053 1.00 . A A . 61 SER H 1 1 2 2765 1 1 61 SER HA H 14.482 -2.752 -5.799 1.00 . A A . 61 SER HA 1 1 2 2766 1 1 61 SER HB2 H 14.942 -0.023 -6.522 1.00 . A A . 61 SER HB2 1 1 2 2767 1 1 61 SER HB3 H 15.363 -0.163 -4.827 1.00 . A A . 61 SER HB3 1 1 2 2768 1 1 61 SER HG H 16.541 -2.243 -5.659 1.00 . A A . 61 SER HG 1 1 2 2769 1 1 61 SER N N 13.015 -1.516 -6.476 1.00 . A A . 61 SER N 1 1 2 2770 1 1 61 SER O O 13.594 -2.736 -3.422 1.00 . A A . 61 SER O 1 1 2 2771 1 1 61 SER OG O 16.463 -1.351 -6.104 1.00 . A A . 61 SER OG 1 1 2 2772 1 1 62 ALA C C 12.175 1.096 -2.193 1.00 . A A . 62 ALA C 1 1 2 2773 1 1 62 ALA CA C 12.667 -0.344 -2.352 1.00 . A A . 62 ALA CA 1 1 2 2774 1 1 62 ALA CB C 13.753 -0.705 -1.337 1.00 . A A . 62 ALA CB 1 1 2 2775 1 1 62 ALA H H 13.186 0.293 -4.266 1.00 . A A . 62 ALA H 1 1 2 2776 1 1 62 ALA HA H 11.824 -1.023 -2.221 1.00 . A A . 62 ALA HA 1 1 2 2777 1 1 62 ALA HB1 H 14.363 -1.518 -1.732 1.00 . A A . 62 ALA HB1 1 1 2 2778 1 1 62 ALA HB2 H 14.383 0.166 -1.154 1.00 . A A . 62 ALA HB2 1 1 2 2779 1 1 62 ALA HB3 H 13.288 -1.020 -0.403 1.00 . A A . 62 ALA HB3 1 1 2 2780 1 1 62 ALA N N 13.179 -0.530 -3.699 1.00 . A A . 62 ALA N 1 1 2 2781 1 1 62 ALA O O 11.093 1.331 -1.657 1.00 . A A . 62 ALA O 1 1 2 2782 1 1 63 LYS C C 11.513 3.738 -3.553 1.00 . A A . 63 LYS C 1 1 2 2783 1 1 63 LYS CA C 12.657 3.434 -2.584 1.00 . A A . 63 LYS CA 1 1 2 2784 1 1 63 LYS CB C 13.900 4.296 -2.809 1.00 . A A . 63 LYS CB 1 1 2 2785 1 1 63 LYS CD C 16.003 4.117 -4.190 1.00 . A A . 63 LYS CD 1 1 2 2786 1 1 63 LYS CE C 16.577 2.855 -3.544 1.00 . A A . 63 LYS CE 1 1 2 2787 1 1 63 LYS CG C 14.474 4.076 -4.210 1.00 . A A . 63 LYS CG 1 1 2 2788 1 1 63 LYS H H 13.872 1.824 -3.102 1.00 . A A . 63 LYS H 1 1 2 2789 1 1 63 LYS HA H 12.310 3.627 -1.569 1.00 . A A . 63 LYS HA 1 1 2 2790 1 1 63 LYS HB2 H 13.646 5.348 -2.678 1.00 . A A . 63 LYS HB2 1 1 2 2791 1 1 63 LYS HB3 H 14.655 4.055 -2.061 1.00 . A A . 63 LYS HB3 1 1 2 2792 1 1 63 LYS HD2 H 16.382 4.214 -5.207 1.00 . A A . 63 LYS HD2 1 1 2 2793 1 1 63 LYS HD3 H 16.339 4.996 -3.640 1.00 . A A . 63 LYS HD3 1 1 2 2794 1 1 63 LYS HE2 H 15.997 2.597 -2.657 1.00 . A A . 63 LYS HE2 1 1 2 2795 1 1 63 LYS HE3 H 16.493 2.015 -4.234 1.00 . A A . 63 LYS HE3 1 1 2 2796 1 1 63 LYS HG2 H 14.138 3.114 -4.597 1.00 . A A . 63 LYS HG2 1 1 2 2797 1 1 63 LYS HG3 H 14.095 4.841 -4.887 1.00 . A A . 63 LYS HG3 1 1 2 2798 1 1 63 LYS HZ1 H 18.329 3.979 -3.444 1.00 . A A . 63 LYS HZ1 1 1 2 2799 1 1 63 LYS HZ2 H 18.143 2.976 -2.174 1.00 . A A . 63 LYS HZ2 1 1 2 2800 1 1 63 LYS N N 12.994 2.023 -2.667 1.00 . A A . 63 LYS N 1 1 2 2801 1 1 63 LYS NZ N 17.995 3.060 -3.174 1.00 . A A . 63 LYS NZ 1 1 2 2802 1 1 63 LYS O O 10.972 4.843 -3.553 1.00 . A A . 63 LYS O 1 1 2 2803 1 1 64 GLY C C 8.739 2.859 -4.645 1.00 . A A . 64 GLY C 1 1 2 2804 1 1 64 GLY CA C 10.108 2.886 -5.328 1.00 . A A . 64 GLY CA 1 1 2 2805 1 1 64 GLY H H 11.622 1.843 -4.348 1.00 . A A . 64 GLY H 1 1 2 2806 1 1 64 GLY HA2 H 10.230 3.825 -5.869 1.00 . A A . 64 GLY HA2 1 1 2 2807 1 1 64 GLY HA3 H 10.167 2.084 -6.064 1.00 . A A . 64 GLY HA3 1 1 2 2808 1 1 64 GLY N N 11.177 2.739 -4.355 1.00 . A A . 64 GLY N 1 1 2 2809 1 1 64 GLY O O 8.157 1.791 -4.456 1.00 . A A . 64 GLY O 1 1 2 2810 1 1 65 TYR C C 5.888 3.423 -4.412 1.00 . A A . 65 TYR C 1 1 2 2811 1 1 65 TYR CA C 6.975 4.170 -3.636 1.00 . A A . 65 TYR CA 1 1 2 2812 1 1 65 TYR CB C 6.646 5.664 -3.633 1.00 . A A . 65 TYR CB 1 1 2 2813 1 1 65 TYR CD1 C 4.850 5.829 -1.871 1.00 . A A . 65 TYR CD1 1 1 2 2814 1 1 65 TYR CD2 C 4.295 6.435 -4.116 1.00 . A A . 65 TYR CD2 1 1 2 2815 1 1 65 TYR CE1 C 3.505 6.132 -1.456 1.00 . A A . 65 TYR CE1 1 1 2 2816 1 1 65 TYR CE2 C 2.950 6.738 -3.701 1.00 . A A . 65 TYR CE2 1 1 2 2817 1 1 65 TYR CG C 5.217 5.987 -3.192 1.00 . A A . 65 TYR CG 1 1 2 2818 1 1 65 TYR CZ C 2.621 6.572 -2.392 1.00 . A A . 65 TYR CZ 1 1 2 2819 1 1 65 TYR H H 8.744 4.908 -4.452 1.00 . A A . 65 TYR H 1 1 2 2820 1 1 65 TYR HA H 7.062 3.737 -2.640 1.00 . A A . 65 TYR HA 1 1 2 2821 1 1 65 TYR HB2 H 7.344 6.178 -2.972 1.00 . A A . 65 TYR HB2 1 1 2 2822 1 1 65 TYR HB3 H 6.805 6.063 -4.635 1.00 . A A . 65 TYR HB3 1 1 2 2823 1 1 65 TYR HD1 H 5.579 5.475 -1.142 1.00 . A A . 65 TYR HD1 1 1 2 2824 1 1 65 TYR HD2 H 4.584 6.559 -5.159 1.00 . A A . 65 TYR HD2 1 1 2 2825 1 1 65 TYR HE1 H 3.202 6.012 -0.416 1.00 . A A . 65 TYR HE1 1 1 2 2826 1 1 65 TYR HE2 H 2.211 7.093 -4.420 1.00 . A A . 65 TYR HE2 1 1 2 2827 1 1 65 TYR HH H 0.874 7.358 -2.724 1.00 . A A . 65 TYR HH 1 1 2 2828 1 1 65 TYR N N 8.264 4.045 -4.294 1.00 . A A . 65 TYR N 1 1 2 2829 1 1 65 TYR O O 5.047 2.750 -3.818 1.00 . A A . 65 TYR O 1 1 2 2830 1 1 65 TYR OH O 1.351 6.858 -2.000 1.00 . A A . 65 TYR OH 1 1 2 2831 1 1 66 TYR C C 5.313 1.434 -6.780 1.00 . A A . 66 TYR C 1 1 2 2832 1 1 66 TYR CA C 4.972 2.914 -6.592 1.00 . A A . 66 TYR CA 1 1 2 2833 1 1 66 TYR CB C 5.068 3.623 -7.945 1.00 . A A . 66 TYR CB 1 1 2 2834 1 1 66 TYR CD1 C 5.397 1.788 -9.642 1.00 . A A . 66 TYR CD1 1 1 2 2835 1 1 66 TYR CD2 C 3.340 3.005 -9.674 1.00 . A A . 66 TYR CD2 1 1 2 2836 1 1 66 TYR CE1 C 4.944 0.992 -10.753 1.00 . A A . 66 TYR CE1 1 1 2 2837 1 1 66 TYR CE2 C 2.887 2.209 -10.785 1.00 . A A . 66 TYR CE2 1 1 2 2838 1 1 66 TYR CG C 4.586 2.777 -9.125 1.00 . A A . 66 TYR CG 1 1 2 2839 1 1 66 TYR CZ C 3.711 1.242 -11.270 1.00 . A A . 66 TYR CZ 1 1 2 2840 1 1 66 TYR H H 6.629 4.116 -6.204 1.00 . A A . 66 TYR H 1 1 2 2841 1 1 66 TYR HA H 3.992 2.997 -6.121 1.00 . A A . 66 TYR HA 1 1 2 2842 1 1 66 TYR HB2 H 4.481 4.541 -7.905 1.00 . A A . 66 TYR HB2 1 1 2 2843 1 1 66 TYR HB3 H 6.104 3.914 -8.118 1.00 . A A . 66 TYR HB3 1 1 2 2844 1 1 66 TYR HD1 H 6.381 1.608 -9.209 1.00 . A A . 66 TYR HD1 1 1 2 2845 1 1 66 TYR HD2 H 2.700 3.787 -9.266 1.00 . A A . 66 TYR HD2 1 1 2 2846 1 1 66 TYR HE1 H 5.575 0.207 -11.171 1.00 . A A . 66 TYR HE1 1 1 2 2847 1 1 66 TYR HE2 H 1.905 2.378 -11.228 1.00 . A A . 66 TYR HE2 1 1 2 2848 1 1 66 TYR HH H 3.956 0.521 -13.059 1.00 . A A . 66 TYR HH 1 1 2 2849 1 1 66 TYR N N 5.941 3.567 -5.728 1.00 . A A . 66 TYR N 1 1 2 2850 1 1 66 TYR O O 4.597 0.712 -7.471 1.00 . A A . 66 TYR O 1 1 2 2851 1 1 66 TYR OH O 3.283 0.491 -12.320 1.00 . A A . 66 TYR OH 1 1 2 2852 1 1 67 HIS C C 6.410 -1.116 -4.990 1.00 . A A . 67 HIS C 1 1 2 2853 1 1 67 HIS CA C 6.851 -0.352 -6.240 1.00 . A A . 67 HIS CA 1 1 2 2854 1 1 67 HIS CB C 8.361 -0.422 -6.476 1.00 . A A . 67 HIS CB 1 1 2 2855 1 1 67 HIS CD2 C 9.481 -1.795 -4.554 1.00 . A A . 67 HIS CD2 1 1 2 2856 1 1 67 HIS CE1 C 9.884 -3.630 -5.675 1.00 . A A . 67 HIS CE1 1 1 2 2857 1 1 67 HIS CG C 9.030 -1.611 -5.827 1.00 . A A . 67 HIS CG 1 1 2 2858 1 1 67 HIS H H 6.983 1.622 -5.590 1.00 . A A . 67 HIS H 1 1 2 2859 1 1 67 HIS HA H 6.359 -0.784 -7.112 1.00 . A A . 67 HIS HA 1 1 2 2860 1 1 67 HIS HB2 H 8.551 -0.452 -7.549 1.00 . A A . 67 HIS HB2 1 1 2 2861 1 1 67 HIS HB3 H 8.821 0.491 -6.097 1.00 . A A . 67 HIS HB3 1 1 2 2862 1 1 67 HIS HD1 H 9.086 -2.964 -7.471 1.00 . A A . 67 HIS HD1 1 1 2 2863 1 1 67 HIS HD2 H 9.428 -1.063 -3.747 1.00 . A A . 67 HIS HD2 1 1 2 2864 1 1 67 HIS HE1 H 10.218 -4.640 -5.914 1.00 . A A . 67 HIS HE1 1 1 2 2865 1 1 67 HIS N N 6.406 1.028 -6.151 1.00 . A A . 67 HIS N 1 1 2 2866 1 1 67 HIS ND1 N 9.298 -2.785 -6.510 1.00 . A A . 67 HIS ND1 1 1 2 2867 1 1 67 HIS NE2 N 9.996 -3.015 -4.463 1.00 . A A . 67 HIS NE2 1 1 2 2868 1 1 67 HIS O O 6.226 -2.331 -5.033 1.00 . A A . 67 HIS O 1 1 2 2869 1 1 68 VAL C C 4.311 -0.930 -2.551 1.00 . A A . 68 VAL C 1 1 2 2870 1 1 68 VAL CA C 5.837 -0.962 -2.645 1.00 . A A . 68 VAL CA 1 1 2 2871 1 1 68 VAL CB C 6.523 -0.246 -1.480 1.00 . A A . 68 VAL CB 1 1 2 2872 1 1 68 VAL CG1 C 7.966 -0.728 -1.313 1.00 . A A . 68 VAL CG1 1 1 2 2873 1 1 68 VAL CG2 C 6.470 1.272 -1.661 1.00 . A A . 68 VAL CG2 1 1 2 2874 1 1 68 VAL H H 6.404 0.618 -3.879 1.00 . A A . 68 VAL H 1 1 2 2875 1 1 68 VAL HA H 6.167 -2.001 -2.645 1.00 . A A . 68 VAL HA 1 1 2 2876 1 1 68 VAL HB H 5.980 -0.494 -0.568 1.00 . A A . 68 VAL HB 1 1 2 2877 1 1 68 VAL HG11 H 8.015 -1.800 -1.505 1.00 . A A . 68 VAL HG11 1 1 2 2878 1 1 68 VAL HG12 H 8.608 -0.203 -2.020 1.00 . A A . 68 VAL HG12 1 1 2 2879 1 1 68 VAL HG13 H 8.302 -0.525 -0.297 1.00 . A A . 68 VAL HG13 1 1 2 2880 1 1 68 VAL HG21 H 5.478 1.562 -2.008 1.00 . A A . 68 VAL HG21 1 1 2 2881 1 1 68 VAL HG22 H 6.678 1.759 -0.709 1.00 . A A . 68 VAL HG22 1 1 2 2882 1 1 68 VAL HG23 H 7.215 1.577 -2.395 1.00 . A A . 68 VAL HG23 1 1 2 2883 1 1 68 VAL N N 6.253 -0.370 -3.906 1.00 . A A . 68 VAL N 1 1 2 2884 1 1 68 VAL O O 3.743 -1.238 -1.504 1.00 . A A . 68 VAL O 1 1 2 2885 1 1 69 MET C C 1.678 -1.448 -4.755 1.00 . A A . 69 MET C 1 1 2 2886 1 1 69 MET CA C 2.239 -0.477 -3.714 1.00 . A A . 69 MET CA 1 1 2 2887 1 1 69 MET CB C 1.816 0.950 -4.066 1.00 . A A . 69 MET CB 1 1 2 2888 1 1 69 MET CE C 2.705 2.181 -0.373 1.00 . A A . 69 MET CE 1 1 2 2889 1 1 69 MET CG C 2.414 1.958 -3.083 1.00 . A A . 69 MET CG 1 1 2 2890 1 1 69 MET H H 4.158 -0.305 -4.506 1.00 . A A . 69 MET H 1 1 2 2891 1 1 69 MET HA H 1.893 -0.760 -2.720 1.00 . A A . 69 MET HA 1 1 2 2892 1 1 69 MET HB2 H 2.140 1.189 -5.079 1.00 . A A . 69 MET HB2 1 1 2 2893 1 1 69 MET HB3 H 0.729 1.025 -4.053 1.00 . A A . 69 MET HB3 1 1 2 2894 1 1 69 MET HE1 H 3.561 2.698 -0.804 1.00 . A A . 69 MET HE1 1 1 2 2895 1 1 69 MET HE2 H 2.328 2.748 0.479 1.00 . A A . 69 MET HE2 1 1 2 2896 1 1 69 MET HE3 H 3.009 1.188 -0.042 1.00 . A A . 69 MET HE3 1 1 2 2897 1 1 69 MET HG2 H 3.435 1.671 -2.831 1.00 . A A . 69 MET HG2 1 1 2 2898 1 1 69 MET HG3 H 2.465 2.944 -3.545 1.00 . A A . 69 MET HG3 1 1 2 2899 1 1 69 MET N N 3.689 -0.554 -3.659 1.00 . A A . 69 MET N 1 1 2 2900 1 1 69 MET O O 0.475 -1.704 -4.785 1.00 . A A . 69 MET O 1 1 2 2901 1 1 69 MET SD S 1.420 2.030 -1.602 1.00 . A A . 69 MET SD 1 1 2 2902 1 1 70 HIS C C 3.129 -4.102 -6.610 1.00 . A A . 70 HIS C 1 1 2 2903 1 1 70 HIS CA C 2.185 -2.898 -6.623 1.00 . A A . 70 HIS CA 1 1 2 2904 1 1 70 HIS CB C 2.128 -2.204 -7.985 1.00 . A A . 70 HIS CB 1 1 2 2905 1 1 70 HIS CD2 C 0.164 -0.522 -8.367 1.00 . A A . 70 HIS CD2 1 1 2 2906 1 1 70 HIS CE1 C 1.146 1.280 -7.606 1.00 . A A . 70 HIS CE1 1 1 2 2907 1 1 70 HIS CG C 1.420 -0.871 -7.965 1.00 . A A . 70 HIS CG 1 1 2 2908 1 1 70 HIS H H 3.552 -1.748 -5.551 1.00 . A A . 70 HIS H 1 1 2 2909 1 1 70 HIS HA H 1.178 -3.235 -6.378 1.00 . A A . 70 HIS HA 1 1 2 2910 1 1 70 HIS HB2 H 3.144 -2.060 -8.351 1.00 . A A . 70 HIS HB2 1 1 2 2911 1 1 70 HIS HB3 H 1.624 -2.861 -8.695 1.00 . A A . 70 HIS HB3 1 1 2 2912 1 1 70 HIS HD1 H 2.942 0.359 -7.124 1.00 . A A . 70 HIS HD1 1 1 2 2913 1 1 70 HIS HD2 H -0.578 -1.196 -8.795 1.00 . A A . 70 HIS HD2 1 1 2 2914 1 1 70 HIS HE1 H 1.317 2.317 -7.318 1.00 . A A . 70 HIS HE1 1 1 2 2915 1 1 70 HIS N N 2.576 -1.962 -5.583 1.00 . A A . 70 HIS N 1 1 2 2916 1 1 70 HIS ND1 N 2.014 0.286 -7.491 1.00 . A A . 70 HIS ND1 1 1 2 2917 1 1 70 HIS NE2 N -0.001 0.777 -8.149 1.00 . A A . 70 HIS NE2 1 1 2 2918 1 1 70 HIS O O 2.698 -5.231 -6.380 1.00 . A A . 70 HIS O 1 1 2 2919 1 1 71 ASP C C 5.116 -5.872 -5.764 1.00 . A A . 71 ASP C 1 1 2 2920 1 1 71 ASP CA C 5.408 -4.866 -6.880 1.00 . A A . 71 ASP CA 1 1 2 2921 1 1 71 ASP CB C 6.805 -4.289 -6.643 1.00 . A A . 71 ASP CB 1 1 2 2922 1 1 71 ASP CG C 7.936 -5.012 -7.376 1.00 . A A . 71 ASP CG 1 1 2 2923 1 1 71 ASP H H 4.742 -2.899 -7.045 1.00 . A A . 71 ASP H 1 1 2 2924 1 1 71 ASP HA H 5.338 -5.312 -7.872 1.00 . A A . 71 ASP HA 1 1 2 2925 1 1 71 ASP HB2 H 6.806 -3.242 -6.948 1.00 . A A . 71 ASP HB2 1 1 2 2926 1 1 71 ASP HB3 H 7.014 -4.309 -5.573 1.00 . A A . 71 ASP HB3 1 1 2 2927 1 1 71 ASP N N 4.399 -3.820 -6.859 1.00 . A A . 71 ASP N 1 1 2 2928 1 1 71 ASP O O 4.875 -5.484 -4.622 1.00 . A A . 71 ASP O 1 1 2 2929 1 1 71 ASP OD1 O 8.245 -6.150 -6.960 1.00 . A A . 71 ASP OD1 1 1 2 2930 1 1 71 ASP OD2 O 8.467 -4.411 -8.335 1.00 . A A . 71 ASP OD2 1 1 2 2931 1 1 72 LYS C C 6.217 -8.847 -4.764 1.00 . A A . 72 LYS C 1 1 2 2932 1 1 72 LYS CA C 4.891 -8.208 -5.179 1.00 . A A . 72 LYS CA 1 1 2 2933 1 1 72 LYS CB C 3.879 -9.204 -5.747 1.00 . A A . 72 LYS CB 1 1 2 2934 1 1 72 LYS CD C 2.663 -8.682 -7.894 1.00 . A A . 72 LYS CD 1 1 2 2935 1 1 72 LYS CE C 2.276 -10.120 -8.247 1.00 . A A . 72 LYS CE 1 1 2 2936 1 1 72 LYS CG C 2.689 -8.478 -6.378 1.00 . A A . 72 LYS CG 1 1 2 2937 1 1 72 LYS H H 5.346 -7.450 -7.065 1.00 . A A . 72 LYS H 1 1 2 2938 1 1 72 LYS HA H 4.436 -7.753 -4.299 1.00 . A A . 72 LYS HA 1 1 2 2939 1 1 72 LYS HB2 H 4.362 -9.834 -6.494 1.00 . A A . 72 LYS HB2 1 1 2 2940 1 1 72 LYS HB3 H 3.528 -9.864 -4.954 1.00 . A A . 72 LYS HB3 1 1 2 2941 1 1 72 LYS HD2 H 1.953 -7.990 -8.346 1.00 . A A . 72 LYS HD2 1 1 2 2942 1 1 72 LYS HD3 H 3.643 -8.453 -8.312 1.00 . A A . 72 LYS HD3 1 1 2 2943 1 1 72 LYS HE2 H 2.245 -10.727 -7.342 1.00 . A A . 72 LYS HE2 1 1 2 2944 1 1 72 LYS HE3 H 1.275 -10.138 -8.677 1.00 . A A . 72 LYS HE3 1 1 2 2945 1 1 72 LYS HG2 H 1.760 -8.847 -5.942 1.00 . A A . 72 LYS HG2 1 1 2 2946 1 1 72 LYS HG3 H 2.747 -7.413 -6.152 1.00 . A A . 72 LYS HG3 1 1 2 2947 1 1 72 LYS HZ1 H 3.439 -10.066 -9.975 1.00 . A A . 72 LYS HZ1 1 1 2 2948 1 1 72 LYS HZ2 H 4.134 -10.907 -8.766 1.00 . A A . 72 LYS HZ2 1 1 2 2949 1 1 72 LYS N N 5.149 -7.143 -6.134 1.00 . A A . 72 LYS N 1 1 2 2950 1 1 72 LYS NZ N 3.245 -10.697 -9.205 1.00 . A A . 72 LYS NZ 1 1 2 2951 1 1 72 LYS O O 6.338 -9.372 -3.658 1.00 . A A . 72 LYS O 1 1 2 2952 1 1 73 ASN C C 9.272 -8.415 -4.487 1.00 . A A . 73 ASN C 1 1 2 2953 1 1 73 ASN CA C 8.492 -9.349 -5.415 1.00 . A A . 73 ASN CA 1 1 2 2954 1 1 73 ASN CB C 9.290 -9.502 -6.711 1.00 . A A . 73 ASN CB 1 1 2 2955 1 1 73 ASN CG C 8.560 -10.413 -7.700 1.00 . A A . 73 ASN CG 1 1 2 2956 1 1 73 ASN H H 7.072 -8.353 -6.569 1.00 . A A . 73 ASN H 1 1 2 2957 1 1 73 ASN HA H 8.300 -10.322 -4.963 1.00 . A A . 73 ASN HA 1 1 2 2958 1 1 73 ASN HB2 H 9.448 -8.522 -7.163 1.00 . A A . 73 ASN HB2 1 1 2 2959 1 1 73 ASN HB3 H 10.274 -9.914 -6.490 1.00 . A A . 73 ASN HB3 1 1 2 2960 1 1 73 ASN HD21 H 9.691 -9.629 -9.185 1.00 . A A . 73 ASN HD21 1 1 2 2961 1 1 73 ASN HD22 H 8.551 -10.835 -9.680 1.00 . A A . 73 ASN HD22 1 1 2 2962 1 1 73 ASN N N 7.179 -8.782 -5.672 1.00 . A A . 73 ASN N 1 1 2 2963 1 1 73 ASN ND2 N 8.968 -10.282 -8.959 1.00 . A A . 73 ASN ND2 1 1 2 2964 1 1 73 ASN O O 10.327 -7.905 -4.858 1.00 . A A . 73 ASN O 1 1 2 2965 1 1 73 ASN OD1 O 7.685 -11.184 -7.343 1.00 . A A . 73 ASN OD1 1 1 2 2966 1 1 74 THR C C 9.605 -8.126 -1.013 1.00 . A A . 74 THR C 1 1 2 2967 1 1 74 THR CA C 9.353 -7.358 -2.313 1.00 . A A . 74 THR CA 1 1 2 2968 1 1 74 THR CB C 8.467 -6.125 -2.128 1.00 . A A . 74 THR CB 1 1 2 2969 1 1 74 THR CG2 C 8.230 -5.372 -3.439 1.00 . A A . 74 THR CG2 1 1 2 2970 1 1 74 THR H H 7.864 -8.641 -3.002 1.00 . A A . 74 THR H 1 1 2 2971 1 1 74 THR HA H 10.326 -7.053 -2.697 1.00 . A A . 74 THR HA 1 1 2 2972 1 1 74 THR HB H 8.877 -5.462 -1.366 1.00 . A A . 74 THR HB 1 1 2 2973 1 1 74 THR HG1 H 6.793 -6.160 -1.032 1.00 . A A . 74 THR HG1 1 1 2 2974 1 1 74 THR HG21 H 8.910 -5.750 -4.203 1.00 . A A . 74 THR HG21 1 1 2 2975 1 1 74 THR HG22 H 7.200 -5.521 -3.762 1.00 . A A . 74 THR HG22 1 1 2 2976 1 1 74 THR HG23 H 8.413 -4.308 -3.285 1.00 . A A . 74 THR HG23 1 1 2 2977 1 1 74 THR N N 8.722 -8.221 -3.297 1.00 . A A . 74 THR N 1 1 2 2978 1 1 74 THR O O 8.947 -9.129 -0.744 1.00 . A A . 74 THR O 1 1 2 2979 1 1 74 THR OG1 O 7.188 -6.662 -1.801 1.00 . A A . 74 THR OG1 1 1 2 2980 1 1 75 LYS C C 9.715 -8.157 1.976 1.00 . A A . 75 LYS C 1 1 2 2981 1 1 75 LYS CA C 10.907 -8.250 1.021 1.00 . A A . 75 LYS CA 1 1 2 2982 1 1 75 LYS CB C 12.194 -7.644 1.584 1.00 . A A . 75 LYS CB 1 1 2 2983 1 1 75 LYS CD C 14.001 -7.996 3.307 1.00 . A A . 75 LYS CD 1 1 2 2984 1 1 75 LYS CE C 14.211 -8.061 4.821 1.00 . A A . 75 LYS CE 1 1 2 2985 1 1 75 LYS CG C 12.537 -8.252 2.945 1.00 . A A . 75 LYS CG 1 1 2 2986 1 1 75 LYS H H 11.090 -6.807 -0.470 1.00 . A A . 75 LYS H 1 1 2 2987 1 1 75 LYS HA H 11.107 -9.303 0.821 1.00 . A A . 75 LYS HA 1 1 2 2988 1 1 75 LYS HB2 H 13.015 -7.816 0.888 1.00 . A A . 75 LYS HB2 1 1 2 2989 1 1 75 LYS HB3 H 12.080 -6.565 1.681 1.00 . A A . 75 LYS HB3 1 1 2 2990 1 1 75 LYS HD2 H 14.636 -8.734 2.816 1.00 . A A . 75 LYS HD2 1 1 2 2991 1 1 75 LYS HD3 H 14.305 -7.017 2.936 1.00 . A A . 75 LYS HD3 1 1 2 2992 1 1 75 LYS HE2 H 14.465 -7.071 5.202 1.00 . A A . 75 LYS HE2 1 1 2 2993 1 1 75 LYS HE3 H 13.285 -8.363 5.310 1.00 . A A . 75 LYS HE3 1 1 2 2994 1 1 75 LYS HG2 H 11.889 -7.826 3.711 1.00 . A A . 75 LYS HG2 1 1 2 2995 1 1 75 LYS HG3 H 12.346 -9.325 2.927 1.00 . A A . 75 LYS HG3 1 1 2 2996 1 1 75 LYS HZ1 H 15.697 -9.435 4.324 1.00 . A A . 75 LYS HZ1 1 1 2 2997 1 1 75 LYS HZ2 H 16.048 -8.575 5.662 1.00 . A A . 75 LYS HZ2 1 1 2 2998 1 1 75 LYS N N 10.559 -7.624 -0.243 1.00 . A A . 75 LYS N 1 1 2 2999 1 1 75 LYS NZ N 15.290 -9.018 5.154 1.00 . A A . 75 LYS NZ 1 1 2 3000 1 1 75 LYS O O 9.578 -8.974 2.886 1.00 . A A . 75 LYS O 1 1 2 3001 1 1 76 PHE C C 6.425 -7.073 1.739 1.00 . A A . 76 PHE C 1 1 2 3002 1 1 76 PHE CA C 7.707 -6.943 2.564 1.00 . A A . 76 PHE CA 1 1 2 3003 1 1 76 PHE CB C 7.816 -5.512 3.094 1.00 . A A . 76 PHE CB 1 1 2 3004 1 1 76 PHE CD1 C 9.002 -5.900 5.285 1.00 . A A . 76 PHE CD1 1 1 2 3005 1 1 76 PHE CD2 C 10.042 -4.478 3.670 1.00 . A A . 76 PHE CD2 1 1 2 3006 1 1 76 PHE CE1 C 10.108 -5.691 6.182 1.00 . A A . 76 PHE CE1 1 1 2 3007 1 1 76 PHE CE2 C 11.149 -4.268 4.567 1.00 . A A . 76 PHE CE2 1 1 2 3008 1 1 76 PHE CG C 8.992 -5.289 4.048 1.00 . A A . 76 PHE CG 1 1 2 3009 1 1 76 PHE CZ C 11.127 -4.885 5.779 1.00 . A A . 76 PHE CZ 1 1 2 3010 1 1 76 PHE H H 9.001 -6.495 0.994 1.00 . A A . 76 PHE H 1 1 2 3011 1 1 76 PHE HA H 7.705 -7.703 3.346 1.00 . A A . 76 PHE HA 1 1 2 3012 1 1 76 PHE HB2 H 7.912 -4.829 2.250 1.00 . A A . 76 PHE HB2 1 1 2 3013 1 1 76 PHE HB3 H 6.890 -5.255 3.609 1.00 . A A . 76 PHE HB3 1 1 2 3014 1 1 76 PHE HD1 H 8.172 -6.541 5.583 1.00 . A A . 76 PHE HD1 1 1 2 3015 1 1 76 PHE HD2 H 10.034 -3.995 2.693 1.00 . A A . 76 PHE HD2 1 1 2 3016 1 1 76 PHE HE1 H 10.129 -6.167 7.162 1.00 . A A . 76 PHE HE1 1 1 2 3017 1 1 76 PHE HE2 H 11.984 -3.629 4.282 1.00 . A A . 76 PHE HE2 1 1 2 3018 1 1 76 PHE HZ H 11.948 -4.803 6.536 1.00 . A A . 76 PHE HZ 1 1 2 3019 1 1 76 PHE N N 8.883 -7.154 1.736 1.00 . A A . 76 PHE N 1 1 2 3020 1 1 76 PHE O O 6.447 -6.904 0.521 1.00 . A A . 76 PHE O 1 1 2 3021 1 1 77 LYS C C 3.635 -6.190 1.161 1.00 . A A . 77 LYS C 1 1 2 3022 1 1 77 LYS CA C 4.050 -7.525 1.783 1.00 . A A . 77 LYS CA 1 1 2 3023 1 1 77 LYS CB C 3.019 -8.095 2.759 1.00 . A A . 77 LYS CB 1 1 2 3024 1 1 77 LYS CD C 1.656 -10.215 2.858 1.00 . A A . 77 LYS CD 1 1 2 3025 1 1 77 LYS CE C 1.419 -11.231 1.739 1.00 . A A . 77 LYS CE 1 1 2 3026 1 1 77 LYS CG C 3.065 -9.625 2.773 1.00 . A A . 77 LYS CG 1 1 2 3027 1 1 77 LYS H H 5.329 -7.506 3.426 1.00 . A A . 77 LYS H 1 1 2 3028 1 1 77 LYS HA H 4.174 -8.255 0.983 1.00 . A A . 77 LYS HA 1 1 2 3029 1 1 77 LYS HB2 H 3.211 -7.713 3.762 1.00 . A A . 77 LYS HB2 1 1 2 3030 1 1 77 LYS HB3 H 2.021 -7.761 2.477 1.00 . A A . 77 LYS HB3 1 1 2 3031 1 1 77 LYS HD2 H 1.518 -10.696 3.826 1.00 . A A . 77 LYS HD2 1 1 2 3032 1 1 77 LYS HD3 H 0.919 -9.416 2.791 1.00 . A A . 77 LYS HD3 1 1 2 3033 1 1 77 LYS HE2 H 1.468 -10.732 0.771 1.00 . A A . 77 LYS HE2 1 1 2 3034 1 1 77 LYS HE3 H 2.207 -11.984 1.750 1.00 . A A . 77 LYS HE3 1 1 2 3035 1 1 77 LYS HG2 H 3.561 -9.986 1.872 1.00 . A A . 77 LYS HG2 1 1 2 3036 1 1 77 LYS HG3 H 3.658 -9.966 3.622 1.00 . A A . 77 LYS HG3 1 1 2 3037 1 1 77 LYS HZ1 H 0.068 -12.792 1.453 1.00 . A A . 77 LYS HZ1 1 1 2 3038 1 1 77 LYS HZ2 H -0.134 -12.028 2.877 1.00 . A A . 77 LYS HZ2 1 1 2 3039 1 1 77 LYS N N 5.338 -7.371 2.436 1.00 . A A . 77 LYS N 1 1 2 3040 1 1 77 LYS NZ N 0.100 -11.883 1.901 1.00 . A A . 77 LYS NZ 1 1 2 3041 1 1 77 LYS O O 3.591 -5.169 1.846 1.00 . A A . 77 LYS O 1 1 2 3042 1 1 78 SER C C 1.407 -5.016 -0.986 1.00 . A A . 78 SER C 1 1 2 3043 1 1 78 SER CA C 2.930 -5.048 -0.851 1.00 . A A . 78 SER CA 1 1 2 3044 1 1 78 SER CB C 3.587 -4.987 -2.232 1.00 . A A . 78 SER CB 1 1 2 3045 1 1 78 SER H H 3.378 -7.075 -0.679 1.00 . A A . 78 SER H 1 1 2 3046 1 1 78 SER HA H 3.279 -4.211 -0.246 1.00 . A A . 78 SER HA 1 1 2 3047 1 1 78 SER HB2 H 3.608 -3.953 -2.578 1.00 . A A . 78 SER HB2 1 1 2 3048 1 1 78 SER HB3 H 4.622 -5.318 -2.156 1.00 . A A . 78 SER HB3 1 1 2 3049 1 1 78 SER HG H 3.495 -5.978 -3.968 1.00 . A A . 78 SER HG 1 1 2 3050 1 1 78 SER N N 3.340 -6.241 -0.130 1.00 . A A . 78 SER N 1 1 2 3051 1 1 78 SER O O 0.750 -6.053 -0.905 1.00 . A A . 78 SER O 1 1 2 3052 1 1 78 SER OG O 2.900 -5.792 -3.186 1.00 . A A . 78 SER OG 1 1 2 3053 1 1 79 CYS C C -1.078 -4.734 -2.256 1.00 . A A . 79 CYS C 1 1 2 3054 1 1 79 CYS CA C -0.546 -3.632 -1.338 1.00 . A A . 79 CYS CA 1 1 2 3055 1 1 79 CYS CB C -0.889 -2.237 -1.863 1.00 . A A . 79 CYS CB 1 1 2 3056 1 1 79 CYS H H 1.429 -2.975 -1.256 1.00 . A A . 79 CYS H 1 1 2 3057 1 1 79 CYS HA H -0.976 -3.719 -0.340 1.00 . A A . 79 CYS HA 1 1 2 3058 1 1 79 CYS HB2 H -0.547 -2.158 -2.895 1.00 . A A . 79 CYS HB2 1 1 2 3059 1 1 79 CYS HB3 H -1.974 -2.126 -1.877 1.00 . A A . 79 CYS HB3 1 1 2 3060 1 1 79 CYS N N 0.888 -3.814 -1.191 1.00 . A A . 79 CYS N 1 1 2 3061 1 1 79 CYS O O -1.831 -5.603 -1.818 1.00 . A A . 79 CYS O 1 1 2 3062 1 1 79 CYS SG S -0.171 -0.857 -0.899 1.00 . A A . 79 CYS SG 1 1 2 3063 1 1 80 VAL C C -0.568 -7.024 -4.096 1.00 . A A . 80 VAL C 1 1 2 3064 1 1 80 VAL CA C -1.092 -5.644 -4.498 1.00 . A A . 80 VAL CA 1 1 2 3065 1 1 80 VAL CB C -0.637 -5.215 -5.894 1.00 . A A . 80 VAL CB 1 1 2 3066 1 1 80 VAL CG1 C -0.970 -6.288 -6.933 1.00 . A A . 80 VAL CG1 1 1 2 3067 1 1 80 VAL CG2 C -1.250 -3.868 -6.281 1.00 . A A . 80 VAL CG2 1 1 2 3068 1 1 80 VAL H H -0.053 -3.953 -3.862 1.00 . A A . 80 VAL H 1 1 2 3069 1 1 80 VAL HA H -2.181 -5.666 -4.490 1.00 . A A . 80 VAL HA 1 1 2 3070 1 1 80 VAL HB H 0.447 -5.095 -5.872 1.00 . A A . 80 VAL HB 1 1 2 3071 1 1 80 VAL HG11 H -1.678 -6.998 -6.506 1.00 . A A . 80 VAL HG11 1 1 2 3072 1 1 80 VAL HG12 H -1.411 -5.818 -7.812 1.00 . A A . 80 VAL HG12 1 1 2 3073 1 1 80 VAL HG13 H -0.058 -6.812 -7.219 1.00 . A A . 80 VAL HG13 1 1 2 3074 1 1 80 VAL HG21 H -1.242 -3.203 -5.417 1.00 . A A . 80 VAL HG21 1 1 2 3075 1 1 80 VAL HG22 H -0.669 -3.422 -7.088 1.00 . A A . 80 VAL HG22 1 1 2 3076 1 1 80 VAL HG23 H -2.277 -4.019 -6.614 1.00 . A A . 80 VAL HG23 1 1 2 3077 1 1 80 VAL N N -0.666 -4.663 -3.513 1.00 . A A . 80 VAL N 1 1 2 3078 1 1 80 VAL O O -1.240 -8.032 -4.305 1.00 . A A . 80 VAL O 1 1 2 3079 1 1 81 GLY C C 0.308 -9.064 -2.190 1.00 . A A . 81 GLY C 1 1 2 3080 1 1 81 GLY CA C 1.250 -8.265 -3.093 1.00 . A A . 81 GLY CA 1 1 2 3081 1 1 81 GLY H H 1.168 -6.200 -3.358 1.00 . A A . 81 GLY H 1 1 2 3082 1 1 81 GLY HA2 H 1.521 -8.863 -3.963 1.00 . A A . 81 GLY HA2 1 1 2 3083 1 1 81 GLY HA3 H 2.173 -8.045 -2.557 1.00 . A A . 81 GLY HA3 1 1 2 3084 1 1 81 GLY N N 0.628 -7.025 -3.525 1.00 . A A . 81 GLY N 1 1 2 3085 1 1 81 GLY O O -0.049 -10.197 -2.509 1.00 . A A . 81 GLY O 1 1 2 3086 1 1 82 CYS C C -2.306 -9.317 -0.818 1.00 . A A . 82 CYS C 1 1 2 3087 1 1 82 CYS CA C -0.959 -9.083 -0.131 1.00 . A A . 82 CYS CA 1 1 2 3088 1 1 82 CYS CB C -1.107 -8.259 1.150 1.00 . A A . 82 CYS CB 1 1 2 3089 1 1 82 CYS H H 0.229 -7.522 -0.830 1.00 . A A . 82 CYS H 1 1 2 3090 1 1 82 CYS HA H -0.496 -10.031 0.145 1.00 . A A . 82 CYS HA 1 1 2 3091 1 1 82 CYS HB2 H -0.125 -8.049 1.573 1.00 . A A . 82 CYS HB2 1 1 2 3092 1 1 82 CYS HB3 H -1.568 -7.298 0.922 1.00 . A A . 82 CYS HB3 1 1 2 3093 1 1 82 CYS N N -0.067 -8.443 -1.082 1.00 . A A . 82 CYS N 1 1 2 3094 1 1 82 CYS O O -2.883 -10.398 -0.711 1.00 . A A . 82 CYS O 1 1 2 3095 1 1 82 CYS SG S -2.129 -9.168 2.365 1.00 . A A . 82 CYS SG 1 1 2 3096 1 1 83 HIS C C -4.045 -9.598 -3.118 1.00 . A A . 83 HIS C 1 1 2 3097 1 1 83 HIS CA C -4.036 -8.364 -2.214 1.00 . A A . 83 HIS CA 1 1 2 3098 1 1 83 HIS CB C -4.316 -7.068 -2.977 1.00 . A A . 83 HIS CB 1 1 2 3099 1 1 83 HIS CD2 C -4.721 -5.709 -0.781 1.00 . A A . 83 HIS CD2 1 1 2 3100 1 1 83 HIS CE1 C -5.970 -4.121 -1.623 1.00 . A A . 83 HIS CE1 1 1 2 3101 1 1 83 HIS CG C -4.861 -5.954 -2.116 1.00 . A A . 83 HIS CG 1 1 2 3102 1 1 83 HIS H H -2.293 -7.409 -1.592 1.00 . A A . 83 HIS H 1 1 2 3103 1 1 83 HIS HA H -4.810 -8.476 -1.454 1.00 . A A . 83 HIS HA 1 1 2 3104 1 1 83 HIS HB2 H -3.393 -6.730 -3.448 1.00 . A A . 83 HIS HB2 1 1 2 3105 1 1 83 HIS HB3 H -5.026 -7.275 -3.777 1.00 . A A . 83 HIS HB3 1 1 2 3106 1 1 83 HIS HD1 H -5.939 -4.835 -3.572 1.00 . A A . 83 HIS HD1 1 1 2 3107 1 1 83 HIS HD2 H -4.156 -6.319 -0.077 1.00 . A A . 83 HIS HD2 1 1 2 3108 1 1 83 HIS HE1 H -6.585 -3.225 -1.700 1.00 . A A . 83 HIS HE1 1 1 2 3109 1 1 83 HIS N N -2.768 -8.285 -1.509 1.00 . A A . 83 HIS N 1 1 2 3110 1 1 83 HIS ND1 N -5.654 -4.937 -2.619 1.00 . A A . 83 HIS ND1 1 1 2 3111 1 1 83 HIS NE2 N -5.391 -4.601 -0.486 1.00 . A A . 83 HIS NE2 1 1 2 3112 1 1 83 HIS O O -5.034 -10.328 -3.169 1.00 . A A . 83 HIS O 1 1 2 3113 1 1 84 VAL C C -3.041 -12.221 -3.933 1.00 . A A . 84 VAL C 1 1 2 3114 1 1 84 VAL CA C -2.799 -10.926 -4.710 1.00 . A A . 84 VAL CA 1 1 2 3115 1 1 84 VAL CB C -1.434 -10.888 -5.400 1.00 . A A . 84 VAL CB 1 1 2 3116 1 1 84 VAL CG1 C -1.162 -12.195 -6.149 1.00 . A A . 84 VAL CG1 1 1 2 3117 1 1 84 VAL CG2 C -1.326 -9.685 -6.339 1.00 . A A . 84 VAL CG2 1 1 2 3118 1 1 84 VAL H H -2.132 -9.195 -3.763 1.00 . A A . 84 VAL H 1 1 2 3119 1 1 84 VAL HA H -3.567 -10.828 -5.477 1.00 . A A . 84 VAL HA 1 1 2 3120 1 1 84 VAL HB H -0.671 -10.780 -4.628 1.00 . A A . 84 VAL HB 1 1 2 3121 1 1 84 VAL HG11 H -2.041 -12.836 -6.090 1.00 . A A . 84 VAL HG11 1 1 2 3122 1 1 84 VAL HG12 H -0.941 -11.975 -7.193 1.00 . A A . 84 VAL HG12 1 1 2 3123 1 1 84 VAL HG13 H -0.310 -12.703 -5.696 1.00 . A A . 84 VAL HG13 1 1 2 3124 1 1 84 VAL HG21 H -2.140 -8.990 -6.132 1.00 . A A . 84 VAL HG21 1 1 2 3125 1 1 84 VAL HG22 H -0.371 -9.185 -6.181 1.00 . A A . 84 VAL HG22 1 1 2 3126 1 1 84 VAL HG23 H -1.392 -10.024 -7.373 1.00 . A A . 84 VAL HG23 1 1 2 3127 1 1 84 VAL N N -2.932 -9.793 -3.810 1.00 . A A . 84 VAL N 1 1 2 3128 1 1 84 VAL O O -3.645 -13.158 -4.452 1.00 . A A . 84 VAL O 1 1 2 3129 1 1 85 GLU C C -4.154 -13.499 -1.343 1.00 . A A . 85 GLU C 1 1 2 3130 1 1 85 GLU CA C -2.712 -13.397 -1.845 1.00 . A A . 85 GLU CA 1 1 2 3131 1 1 85 GLU CB C -1.726 -13.355 -0.676 1.00 . A A . 85 GLU CB 1 1 2 3132 1 1 85 GLU CD C -0.378 -15.341 0.100 1.00 . A A . 85 GLU CD 1 1 2 3133 1 1 85 GLU CG C -0.508 -14.238 -0.953 1.00 . A A . 85 GLU CG 1 1 2 3134 1 1 85 GLU H H -2.066 -11.466 -2.284 1.00 . A A . 85 GLU H 1 1 2 3135 1 1 85 GLU HA H -2.479 -14.254 -2.478 1.00 . A A . 85 GLU HA 1 1 2 3136 1 1 85 GLU HB2 H -1.404 -12.328 -0.504 1.00 . A A . 85 GLU HB2 1 1 2 3137 1 1 85 GLU HB3 H -2.222 -13.690 0.235 1.00 . A A . 85 GLU HB3 1 1 2 3138 1 1 85 GLU HG2 H -0.596 -14.685 -1.944 1.00 . A A . 85 GLU HG2 1 1 2 3139 1 1 85 GLU HG3 H 0.395 -13.627 -0.958 1.00 . A A . 85 GLU HG3 1 1 2 3140 1 1 85 GLU N N -2.556 -12.232 -2.699 1.00 . A A . 85 GLU N 1 1 2 3141 1 1 85 GLU O O -4.675 -14.598 -1.160 1.00 . A A . 85 GLU O 1 1 2 3142 1 1 85 GLU OE1 O -1.399 -16.024 0.334 1.00 . A A . 85 GLU OE1 1 1 2 3143 1 1 85 GLU OE2 O 0.738 -15.476 0.646 1.00 . A A . 85 GLU OE2 1 1 2 3144 1 1 86 VAL C C -7.077 -12.659 -1.798 1.00 . A A . 86 VAL C 1 1 2 3145 1 1 86 VAL CA C -6.128 -12.283 -0.658 1.00 . A A . 86 VAL CA 1 1 2 3146 1 1 86 VAL CB C -6.422 -10.902 -0.068 1.00 . A A . 86 VAL CB 1 1 2 3147 1 1 86 VAL CG1 C -7.877 -10.800 0.394 1.00 . A A . 86 VAL CG1 1 1 2 3148 1 1 86 VAL CG2 C -5.459 -10.579 1.077 1.00 . A A . 86 VAL CG2 1 1 2 3149 1 1 86 VAL H H -4.326 -11.448 -1.287 1.00 . A A . 86 VAL H 1 1 2 3150 1 1 86 VAL HA H -6.229 -13.019 0.139 1.00 . A A . 86 VAL HA 1 1 2 3151 1 1 86 VAL HB H -6.267 -10.162 -0.853 1.00 . A A . 86 VAL HB 1 1 2 3152 1 1 86 VAL HG11 H -8.210 -11.771 0.761 1.00 . A A . 86 VAL HG11 1 1 2 3153 1 1 86 VAL HG12 H -7.954 -10.064 1.193 1.00 . A A . 86 VAL HG12 1 1 2 3154 1 1 86 VAL HG13 H -8.503 -10.495 -0.444 1.00 . A A . 86 VAL HG13 1 1 2 3155 1 1 86 VAL HG21 H -4.808 -11.435 1.256 1.00 . A A . 86 VAL HG21 1 1 2 3156 1 1 86 VAL HG22 H -4.855 -9.712 0.811 1.00 . A A . 86 VAL HG22 1 1 2 3157 1 1 86 VAL HG23 H -6.029 -10.361 1.980 1.00 . A A . 86 VAL HG23 1 1 2 3158 1 1 86 VAL N N -4.757 -12.338 -1.135 1.00 . A A . 86 VAL N 1 1 2 3159 1 1 86 VAL O O -7.937 -13.523 -1.636 1.00 . A A . 86 VAL O 1 1 2 3160 1 1 87 ALA C C -7.340 -13.600 -4.696 1.00 . A A . 87 ALA C 1 1 2 3161 1 1 87 ALA CA C -7.715 -12.244 -4.094 1.00 . A A . 87 ALA CA 1 1 2 3162 1 1 87 ALA CB C -7.553 -11.097 -5.094 1.00 . A A . 87 ALA CB 1 1 2 3163 1 1 87 ALA H H -6.185 -11.290 -3.051 1.00 . A A . 87 ALA H 1 1 2 3164 1 1 87 ALA HA H -8.753 -12.278 -3.764 1.00 . A A . 87 ALA HA 1 1 2 3165 1 1 87 ALA HB1 H -6.494 -10.942 -5.300 1.00 . A A . 87 ALA HB1 1 1 2 3166 1 1 87 ALA HB2 H -8.071 -11.347 -6.020 1.00 . A A . 87 ALA HB2 1 1 2 3167 1 1 87 ALA HB3 H -7.979 -10.186 -4.674 1.00 . A A . 87 ALA HB3 1 1 2 3168 1 1 87 ALA N N -6.887 -11.991 -2.927 1.00 . A A . 87 ALA N 1 1 2 3169 1 1 87 ALA O O -8.052 -14.121 -5.553 1.00 . A A . 87 ALA O 1 1 2 3170 1 1 88 GLY C C -6.909 -16.371 -4.974 1.00 . A A . 88 GLY C 1 1 2 3171 1 1 88 GLY CA C -5.743 -15.417 -4.705 1.00 . A A . 88 GLY CA 1 1 2 3172 1 1 88 GLY H H -5.649 -13.701 -3.527 1.00 . A A . 88 GLY H 1 1 2 3173 1 1 88 GLY HA2 H -5.167 -15.274 -5.619 1.00 . A A . 88 GLY HA2 1 1 2 3174 1 1 88 GLY HA3 H -5.070 -15.857 -3.970 1.00 . A A . 88 GLY HA3 1 1 2 3175 1 1 88 GLY N N -6.222 -14.132 -4.224 1.00 . A A . 88 GLY N 1 1 2 3176 1 1 88 GLY O O -7.666 -16.703 -4.063 1.00 . A A . 88 GLY O 1 1 2 3177 1 1 89 ALA C C -9.376 -17.294 -5.925 1.00 . A A . 89 ALA C 1 1 2 3178 1 1 89 ALA CA C -8.077 -17.693 -6.628 1.00 . A A . 89 ALA CA 1 1 2 3179 1 1 89 ALA CB C -7.662 -19.132 -6.314 1.00 . A A . 89 ALA CB 1 1 2 3180 1 1 89 ALA H H -6.396 -16.509 -6.963 1.00 . A A . 89 ALA H 1 1 2 3181 1 1 89 ALA HA H -8.211 -17.593 -7.705 1.00 . A A . 89 ALA HA 1 1 2 3182 1 1 89 ALA HB1 H -7.341 -19.199 -5.274 1.00 . A A . 89 ALA HB1 1 1 2 3183 1 1 89 ALA HB2 H -8.509 -19.798 -6.477 1.00 . A A . 89 ALA HB2 1 1 2 3184 1 1 89 ALA HB3 H -6.840 -19.424 -6.968 1.00 . A A . 89 ALA HB3 1 1 2 3185 1 1 89 ALA N N -7.016 -16.784 -6.228 1.00 . A A . 89 ALA N 1 1 2 3186 1 1 89 ALA O O -9.665 -17.772 -4.829 1.00 . A A . 89 ALA O 1 1 2 3187 1 1 90 ASP C C -12.196 -15.272 -7.141 1.00 . A A . 90 ASP C 1 1 2 3188 1 1 90 ASP CA C -11.387 -15.955 -6.036 1.00 . A A . 90 ASP CA 1 1 2 3189 1 1 90 ASP CB C -11.157 -14.935 -4.919 1.00 . A A . 90 ASP CB 1 1 2 3190 1 1 90 ASP CG C -12.279 -14.847 -3.883 1.00 . A A . 90 ASP CG 1 1 2 3191 1 1 90 ASP H H -9.884 -16.040 -7.476 1.00 . A A . 90 ASP H 1 1 2 3192 1 1 90 ASP HA H -11.880 -16.846 -5.649 1.00 . A A . 90 ASP HA 1 1 2 3193 1 1 90 ASP HB2 H -10.228 -15.183 -4.406 1.00 . A A . 90 ASP HB2 1 1 2 3194 1 1 90 ASP HB3 H -11.020 -13.951 -5.369 1.00 . A A . 90 ASP HB3 1 1 2 3195 1 1 90 ASP N N -10.125 -16.423 -6.584 1.00 . A A . 90 ASP N 1 1 2 3196 1 1 90 ASP O O -13.401 -15.487 -7.256 1.00 . A A . 90 ASP O 1 1 2 3197 1 1 90 ASP OD1 O -13.216 -15.667 -3.990 1.00 . A A . 90 ASP OD1 1 1 2 3198 1 1 90 ASP OD2 O -12.175 -13.960 -3.008 1.00 . A A . 90 ASP OD2 1 1 2 3199 1 1 91 ALA C C -12.956 -12.585 -8.450 1.00 . A A . 91 ALA C 1 1 2 3200 1 1 91 ALA CA C -12.139 -13.747 -9.017 1.00 . A A . 91 ALA CA 1 1 2 3201 1 1 91 ALA CB C -12.994 -14.718 -9.834 1.00 . A A . 91 ALA CB 1 1 2 3202 1 1 91 ALA H H -10.519 -14.293 -7.826 1.00 . A A . 91 ALA H 1 1 2 3203 1 1 91 ALA HA H -11.352 -13.348 -9.658 1.00 . A A . 91 ALA HA 1 1 2 3204 1 1 91 ALA HB1 H -12.930 -15.714 -9.396 1.00 . A A . 91 ALA HB1 1 1 2 3205 1 1 91 ALA HB2 H -14.031 -14.383 -9.825 1.00 . A A . 91 ALA HB2 1 1 2 3206 1 1 91 ALA HB3 H -12.630 -14.747 -10.861 1.00 . A A . 91 ALA HB3 1 1 2 3207 1 1 91 ALA N N -11.500 -14.463 -7.926 1.00 . A A . 91 ALA N 1 1 2 3208 1 1 91 ALA O O -13.547 -12.702 -7.377 1.00 . A A . 91 ALA O 1 1 2 3209 1 1 92 ALA C C -12.834 -9.481 -7.827 1.00 . A A . 92 ALA C 1 1 2 3210 1 1 92 ALA CA C -13.701 -10.307 -8.779 1.00 . A A . 92 ALA CA 1 1 2 3211 1 1 92 ALA CB C -15.027 -10.728 -8.143 1.00 . A A . 92 ALA CB 1 1 2 3212 1 1 92 ALA H H -12.483 -11.402 -10.066 1.00 . A A . 92 ALA H 1 1 2 3213 1 1 92 ALA HA H -13.911 -9.717 -9.671 1.00 . A A . 92 ALA HA 1 1 2 3214 1 1 92 ALA HB1 H -15.286 -11.734 -8.475 1.00 . A A . 92 ALA HB1 1 1 2 3215 1 1 92 ALA HB2 H -14.929 -10.718 -7.057 1.00 . A A . 92 ALA HB2 1 1 2 3216 1 1 92 ALA HB3 H -15.811 -10.033 -8.443 1.00 . A A . 92 ALA HB3 1 1 2 3217 1 1 92 ALA N N -12.965 -11.490 -9.195 1.00 . A A . 92 ALA N 1 1 2 3218 1 1 92 ALA O O -12.704 -8.269 -7.993 1.00 . A A . 92 ALA O 1 1 2 3219 1 1 93 LYS C C -10.078 -9.147 -6.526 1.00 . A A . 93 LYS C 1 1 2 3220 1 1 93 LYS CA C -11.411 -9.515 -5.871 1.00 . A A . 93 LYS CA 1 1 2 3221 1 1 93 LYS CB C -11.263 -10.386 -4.622 1.00 . A A . 93 LYS CB 1 1 2 3222 1 1 93 LYS CD C -12.508 -9.847 -2.496 1.00 . A A . 93 LYS CD 1 1 2 3223 1 1 93 LYS CE C -13.903 -9.590 -1.923 1.00 . A A . 93 LYS CE 1 1 2 3224 1 1 93 LYS CG C -12.593 -10.504 -3.875 1.00 . A A . 93 LYS CG 1 1 2 3225 1 1 93 LYS H H -12.372 -11.156 -6.722 1.00 . A A . 93 LYS H 1 1 2 3226 1 1 93 LYS HA H -11.912 -8.596 -5.566 1.00 . A A . 93 LYS HA 1 1 2 3227 1 1 93 LYS HB2 H -10.911 -11.378 -4.905 1.00 . A A . 93 LYS HB2 1 1 2 3228 1 1 93 LYS HB3 H -10.508 -9.957 -3.963 1.00 . A A . 93 LYS HB3 1 1 2 3229 1 1 93 LYS HD2 H -11.945 -10.490 -1.818 1.00 . A A . 93 LYS HD2 1 1 2 3230 1 1 93 LYS HD3 H -11.962 -8.907 -2.570 1.00 . A A . 93 LYS HD3 1 1 2 3231 1 1 93 LYS HE2 H -14.657 -10.035 -2.573 1.00 . A A . 93 LYS HE2 1 1 2 3232 1 1 93 LYS HE3 H -13.998 -10.072 -0.950 1.00 . A A . 93 LYS HE3 1 1 2 3233 1 1 93 LYS HG2 H -13.385 -10.033 -4.458 1.00 . A A . 93 LYS HG2 1 1 2 3234 1 1 93 LYS HG3 H -12.861 -11.555 -3.766 1.00 . A A . 93 LYS HG3 1 1 2 3235 1 1 93 LYS HZ1 H -14.289 -7.692 -2.691 1.00 . A A . 93 LYS HZ1 1 1 2 3236 1 1 93 LYS HZ2 H -14.974 -7.940 -1.235 1.00 . A A . 93 LYS HZ2 1 1 2 3237 1 1 93 LYS N N -12.262 -10.170 -6.850 1.00 . A A . 93 LYS N 1 1 2 3238 1 1 93 LYS NZ N -14.149 -8.137 -1.791 1.00 . A A . 93 LYS NZ 1 1 2 3239 1 1 93 LYS O O -9.545 -8.064 -6.289 1.00 . A A . 93 LYS O 1 1 2 3240 1 1 94 LYS C C -8.464 -8.676 -8.992 1.00 . A A . 94 LYS C 1 1 2 3241 1 1 94 LYS CA C -8.318 -9.854 -8.026 1.00 . A A . 94 LYS CA 1 1 2 3242 1 1 94 LYS CB C -7.848 -11.146 -8.698 1.00 . A A . 94 LYS CB 1 1 2 3243 1 1 94 LYS CD C -5.953 -12.792 -8.938 1.00 . A A . 94 LYS CD 1 1 2 3244 1 1 94 LYS CE C -5.252 -13.740 -7.963 1.00 . A A . 94 LYS CE 1 1 2 3245 1 1 94 LYS CG C -6.447 -11.534 -8.221 1.00 . A A . 94 LYS CG 1 1 2 3246 1 1 94 LYS H H -10.019 -10.946 -7.523 1.00 . A A . 94 LYS H 1 1 2 3247 1 1 94 LYS HA H -7.574 -9.593 -7.273 1.00 . A A . 94 LYS HA 1 1 2 3248 1 1 94 LYS HB2 H -8.548 -11.951 -8.475 1.00 . A A . 94 LYS HB2 1 1 2 3249 1 1 94 LYS HB3 H -7.845 -11.017 -9.780 1.00 . A A . 94 LYS HB3 1 1 2 3250 1 1 94 LYS HD2 H -6.795 -13.303 -9.406 1.00 . A A . 94 LYS HD2 1 1 2 3251 1 1 94 LYS HD3 H -5.266 -12.513 -9.737 1.00 . A A . 94 LYS HD3 1 1 2 3252 1 1 94 LYS HE2 H -5.674 -13.622 -6.965 1.00 . A A . 94 LYS HE2 1 1 2 3253 1 1 94 LYS HE3 H -5.426 -14.773 -8.262 1.00 . A A . 94 LYS HE3 1 1 2 3254 1 1 94 LYS HG2 H -5.756 -10.712 -8.404 1.00 . A A . 94 LYS HG2 1 1 2 3255 1 1 94 LYS HG3 H -6.460 -11.706 -7.145 1.00 . A A . 94 LYS HG3 1 1 2 3256 1 1 94 LYS HZ1 H -3.258 -14.304 -7.744 1.00 . A A . 94 LYS HZ1 1 1 2 3257 1 1 94 LYS HZ2 H -3.462 -13.087 -8.807 1.00 . A A . 94 LYS HZ2 1 1 2 3258 1 1 94 LYS N N -9.578 -10.068 -7.336 1.00 . A A . 94 LYS N 1 1 2 3259 1 1 94 LYS NZ N -3.798 -13.466 -7.928 1.00 . A A . 94 LYS NZ 1 1 2 3260 1 1 94 LYS O O -7.473 -8.186 -9.532 1.00 . A A . 94 LYS O 1 1 2 3261 1 1 95 LYS C C -10.445 -5.939 -9.246 1.00 . A A . 95 LYS C 1 1 2 3262 1 1 95 LYS CA C -9.994 -7.146 -10.071 1.00 . A A . 95 LYS CA 1 1 2 3263 1 1 95 LYS CB C -11.000 -7.568 -11.144 1.00 . A A . 95 LYS CB 1 1 2 3264 1 1 95 LYS CD C -11.216 -7.909 -13.634 1.00 . A A . 95 LYS CD 1 1 2 3265 1 1 95 LYS CE C -10.181 -8.786 -14.341 1.00 . A A . 95 LYS CE 1 1 2 3266 1 1 95 LYS CG C -10.564 -7.078 -12.527 1.00 . A A . 95 LYS CG 1 1 2 3267 1 1 95 LYS H H -10.506 -8.661 -8.736 1.00 . A A . 95 LYS H 1 1 2 3268 1 1 95 LYS HA H -9.067 -6.888 -10.582 1.00 . A A . 95 LYS HA 1 1 2 3269 1 1 95 LYS HB2 H -11.095 -8.654 -11.153 1.00 . A A . 95 LYS HB2 1 1 2 3270 1 1 95 LYS HB3 H -11.984 -7.164 -10.905 1.00 . A A . 95 LYS HB3 1 1 2 3271 1 1 95 LYS HD2 H -12.000 -8.536 -13.209 1.00 . A A . 95 LYS HD2 1 1 2 3272 1 1 95 LYS HD3 H -11.693 -7.248 -14.357 1.00 . A A . 95 LYS HD3 1 1 2 3273 1 1 95 LYS HE2 H -9.534 -9.262 -13.604 1.00 . A A . 95 LYS HE2 1 1 2 3274 1 1 95 LYS HE3 H -10.685 -9.585 -14.886 1.00 . A A . 95 LYS HE3 1 1 2 3275 1 1 95 LYS HG2 H -10.836 -6.029 -12.647 1.00 . A A . 95 LYS HG2 1 1 2 3276 1 1 95 LYS HG3 H -9.479 -7.138 -12.613 1.00 . A A . 95 LYS HG3 1 1 2 3277 1 1 95 LYS HZ1 H -8.396 -7.929 -14.989 1.00 . A A . 95 LYS HZ1 1 1 2 3278 1 1 95 LYS HZ2 H -9.378 -8.357 -16.216 1.00 . A A . 95 LYS HZ2 1 1 2 3279 1 1 95 LYS N N -9.706 -8.257 -9.179 1.00 . A A . 95 LYS N 1 1 2 3280 1 1 95 LYS NZ N -9.367 -7.977 -15.276 1.00 . A A . 95 LYS NZ 1 1 2 3281 1 1 95 LYS O O -10.593 -4.840 -9.777 1.00 . A A . 95 LYS O 1 1 2 3282 1 1 96 ASP C C -10.054 -4.974 -5.936 1.00 . A A . 96 ASP C 1 1 2 3283 1 1 96 ASP CA C -11.083 -5.132 -7.057 1.00 . A A . 96 ASP CA 1 1 2 3284 1 1 96 ASP CB C -12.430 -5.473 -6.417 1.00 . A A . 96 ASP CB 1 1 2 3285 1 1 96 ASP CG C -13.603 -4.606 -6.877 1.00 . A A . 96 ASP CG 1 1 2 3286 1 1 96 ASP H H -10.529 -7.082 -7.536 1.00 . A A . 96 ASP H 1 1 2 3287 1 1 96 ASP HA H -11.166 -4.239 -7.676 1.00 . A A . 96 ASP HA 1 1 2 3288 1 1 96 ASP HB2 H -12.663 -6.517 -6.631 1.00 . A A . 96 ASP HB2 1 1 2 3289 1 1 96 ASP HB3 H -12.334 -5.384 -5.335 1.00 . A A . 96 ASP HB3 1 1 2 3290 1 1 96 ASP N N -10.652 -6.185 -7.961 1.00 . A A . 96 ASP N 1 1 2 3291 1 1 96 ASP O O -10.243 -4.171 -5.024 1.00 . A A . 96 ASP O 1 1 2 3292 1 1 96 ASP OD1 O -14.037 -4.805 -8.033 1.00 . A A . 96 ASP OD1 1 1 2 3293 1 1 96 ASP OD2 O -14.040 -3.763 -6.063 1.00 . A A . 96 ASP OD2 1 1 2 3294 1 1 97 LEU C C -6.592 -5.442 -5.744 1.00 . A A . 97 LEU C 1 1 2 3295 1 1 97 LEU CA C -7.928 -5.710 -5.048 1.00 . A A . 97 LEU CA 1 1 2 3296 1 1 97 LEU CB C -7.935 -6.984 -4.201 1.00 . A A . 97 LEU CB 1 1 2 3297 1 1 97 LEU CD1 C -8.828 -8.243 -2.206 1.00 . A A . 97 LEU CD1 1 1 2 3298 1 1 97 LEU CD2 C -9.421 -5.800 -2.544 1.00 . A A . 97 LEU CD2 1 1 2 3299 1 1 97 LEU CG C -9.102 -7.133 -3.223 1.00 . A A . 97 LEU CG 1 1 2 3300 1 1 97 LEU H H -8.841 -6.404 -6.787 1.00 . A A . 97 LEU H 1 1 2 3301 1 1 97 LEU HA H -8.142 -4.877 -4.378 1.00 . A A . 97 LEU HA 1 1 2 3302 1 1 97 LEU HB2 H -7.939 -7.843 -4.873 1.00 . A A . 97 LEU HB2 1 1 2 3303 1 1 97 LEU HB3 H -7.005 -7.026 -3.635 1.00 . A A . 97 LEU HB3 1 1 2 3304 1 1 97 LEU HD11 H -8.120 -8.956 -2.629 1.00 . A A . 97 LEU HD11 1 1 2 3305 1 1 97 LEU HD12 H -8.407 -7.808 -1.299 1.00 . A A . 97 LEU HD12 1 1 2 3306 1 1 97 LEU HD13 H -9.760 -8.754 -1.966 1.00 . A A . 97 LEU HD13 1 1 2 3307 1 1 97 LEU HD21 H -8.510 -5.208 -2.457 1.00 . A A . 97 LEU HD21 1 1 2 3308 1 1 97 LEU HD22 H -10.153 -5.254 -3.140 1.00 . A A . 97 LEU HD22 1 1 2 3309 1 1 97 LEU HD23 H -9.829 -5.986 -1.550 1.00 . A A . 97 LEU HD23 1 1 2 3310 1 1 97 LEU HG H -9.987 -7.426 -3.788 1.00 . A A . 97 LEU HG 1 1 2 3311 1 1 97 LEU N N -8.987 -5.753 -6.042 1.00 . A A . 97 LEU N 1 1 2 3312 1 1 97 LEU O O -5.816 -4.597 -5.302 1.00 . A A . 97 LEU O 1 1 2 3313 1 1 98 THR C C -5.438 -5.496 -8.985 1.00 . A A . 98 THR C 1 1 2 3314 1 1 98 THR CA C -5.136 -6.031 -7.584 1.00 . A A . 98 THR CA 1 1 2 3315 1 1 98 THR CB C -4.419 -7.382 -7.590 1.00 . A A . 98 THR CB 1 1 2 3316 1 1 98 THR CG2 C -4.533 -8.112 -6.250 1.00 . A A . 98 THR CG2 1 1 2 3317 1 1 98 THR H H -7.002 -6.864 -7.176 1.00 . A A . 98 THR H 1 1 2 3318 1 1 98 THR HA H -4.511 -5.289 -7.087 1.00 . A A . 98 THR HA 1 1 2 3319 1 1 98 THR HB H -3.376 -7.268 -7.885 1.00 . A A . 98 THR HB 1 1 2 3320 1 1 98 THR HG1 H -5.069 -7.854 -9.424 1.00 . A A . 98 THR HG1 1 1 2 3321 1 1 98 THR HG21 H -5.579 -8.156 -5.948 1.00 . A A . 98 THR HG21 1 1 2 3322 1 1 98 THR HG22 H -4.142 -9.124 -6.353 1.00 . A A . 98 THR HG22 1 1 2 3323 1 1 98 THR HG23 H -3.958 -7.576 -5.495 1.00 . A A . 98 THR HG23 1 1 2 3324 1 1 98 THR N N -6.365 -6.178 -6.822 1.00 . A A . 98 THR N 1 1 2 3325 1 1 98 THR O O -4.551 -5.436 -9.835 1.00 . A A . 98 THR O 1 1 2 3326 1 1 98 THR OG1 O -5.189 -8.180 -8.486 1.00 . A A . 98 THR OG1 1 1 2 3327 1 1 99 GLY C C -6.369 -3.311 -10.814 1.00 . A A . 99 GLY C 1 1 2 3328 1 1 99 GLY CA C -7.124 -4.595 -10.467 1.00 . A A . 99 GLY CA 1 1 2 3329 1 1 99 GLY H H -7.410 -5.174 -8.487 1.00 . A A . 99 GLY H 1 1 2 3330 1 1 99 GLY HA2 H -6.957 -5.341 -11.245 1.00 . A A . 99 GLY HA2 1 1 2 3331 1 1 99 GLY HA3 H -8.195 -4.396 -10.442 1.00 . A A . 99 GLY HA3 1 1 2 3332 1 1 99 GLY N N -6.694 -5.122 -9.183 1.00 . A A . 99 GLY N 1 1 2 3333 1 1 99 GLY O O -5.988 -2.551 -9.924 1.00 . A A . 99 GLY O 1 1 2 3334 1 1 100 CYS C C -6.475 -0.780 -12.690 1.00 . A A . 100 CYS C 1 1 2 3335 1 1 100 CYS CA C -5.470 -1.928 -12.583 1.00 . A A . 100 CYS CA 1 1 2 3336 1 1 100 CYS CB C -4.760 -2.191 -13.913 1.00 . A A . 100 CYS CB 1 1 2 3337 1 1 100 CYS H H -6.487 -3.730 -12.825 1.00 . A A . 100 CYS H 1 1 2 3338 1 1 100 CYS HA H -4.702 -1.703 -11.844 1.00 . A A . 100 CYS HA 1 1 2 3339 1 1 100 CYS HB2 H -5.391 -2.834 -14.525 1.00 . A A . 100 CYS HB2 1 1 2 3340 1 1 100 CYS HB3 H -4.656 -1.245 -14.446 1.00 . A A . 100 CYS HB3 1 1 2 3341 1 1 100 CYS N N -6.174 -3.107 -12.108 1.00 . A A . 100 CYS N 1 1 2 3342 1 1 100 CYS O O -6.293 0.269 -12.074 1.00 . A A . 100 CYS O 1 1 2 3343 1 1 100 CYS SG S -3.108 -2.963 -13.761 1.00 . A A . 100 CYS SG 1 1 2 3344 1 1 101 LYS C C -9.898 -0.588 -13.235 1.00 . A A . 101 LYS C 1 1 2 3345 1 1 101 LYS CA C -8.548 -0.014 -13.673 1.00 . A A . 101 LYS CA 1 1 2 3346 1 1 101 LYS CB C -8.535 0.494 -15.116 1.00 . A A . 101 LYS CB 1 1 2 3347 1 1 101 LYS CD C -10.898 0.975 -15.856 1.00 . A A . 101 LYS CD 1 1 2 3348 1 1 101 LYS CE C -11.553 1.902 -16.882 1.00 . A A . 101 LYS CE 1 1 2 3349 1 1 101 LYS CG C -9.596 1.577 -15.325 1.00 . A A . 101 LYS CG 1 1 2 3350 1 1 101 LYS H H -7.656 -1.872 -13.975 1.00 . A A . 101 LYS H 1 1 2 3351 1 1 101 LYS HA H -8.308 0.833 -13.031 1.00 . A A . 101 LYS HA 1 1 2 3352 1 1 101 LYS HB2 H -7.550 0.893 -15.356 1.00 . A A . 101 LYS HB2 1 1 2 3353 1 1 101 LYS HB3 H -8.718 -0.336 -15.799 1.00 . A A . 101 LYS HB3 1 1 2 3354 1 1 101 LYS HD2 H -10.694 0.006 -16.314 1.00 . A A . 101 LYS HD2 1 1 2 3355 1 1 101 LYS HD3 H -11.585 0.798 -15.029 1.00 . A A . 101 LYS HD3 1 1 2 3356 1 1 101 LYS HE2 H -12.599 1.625 -17.016 1.00 . A A . 101 LYS HE2 1 1 2 3357 1 1 101 LYS HE3 H -11.540 2.928 -16.513 1.00 . A A . 101 LYS HE3 1 1 2 3358 1 1 101 LYS HG2 H -9.786 2.091 -14.383 1.00 . A A . 101 LYS HG2 1 1 2 3359 1 1 101 LYS HG3 H -9.224 2.324 -16.026 1.00 . A A . 101 LYS HG3 1 1 2 3360 1 1 101 LYS HZ1 H -11.474 1.936 -18.964 1.00 . A A . 101 LYS HZ1 1 1 2 3361 1 1 101 LYS HZ2 H -10.136 2.547 -18.267 1.00 . A A . 101 LYS HZ2 1 1 2 3362 1 1 101 LYS N N -7.514 -1.016 -13.477 1.00 . A A . 101 LYS N 1 1 2 3363 1 1 101 LYS NZ N -10.843 1.826 -18.178 1.00 . A A . 101 LYS NZ 1 1 2 3364 1 1 101 LYS O O -10.196 -1.752 -13.498 1.00 . A A . 101 LYS O 1 1 2 3365 1 1 102 LYS C C -11.820 -1.071 -10.885 1.00 . A A . 102 LYS C 1 1 2 3366 1 1 102 LYS CA C -11.987 -0.152 -12.097 1.00 . A A . 102 LYS CA 1 1 2 3367 1 1 102 LYS CB C -12.801 -0.775 -13.233 1.00 . A A . 102 LYS CB 1 1 2 3368 1 1 102 LYS CD C -15.225 -0.692 -13.924 1.00 . A A . 102 LYS CD 1 1 2 3369 1 1 102 LYS CE C -16.245 0.130 -14.715 1.00 . A A . 102 LYS CE 1 1 2 3370 1 1 102 LYS CG C -13.969 0.131 -13.630 1.00 . A A . 102 LYS CG 1 1 2 3371 1 1 102 LYS H H -10.426 1.201 -12.365 1.00 . A A . 102 LYS H 1 1 2 3372 1 1 102 LYS HA H -12.513 0.747 -11.778 1.00 . A A . 102 LYS HA 1 1 2 3373 1 1 102 LYS HB2 H -12.158 -0.945 -14.096 1.00 . A A . 102 LYS HB2 1 1 2 3374 1 1 102 LYS HB3 H -13.180 -1.748 -12.922 1.00 . A A . 102 LYS HB3 1 1 2 3375 1 1 102 LYS HD2 H -14.955 -1.585 -14.488 1.00 . A A . 102 LYS HD2 1 1 2 3376 1 1 102 LYS HD3 H -15.671 -1.028 -12.988 1.00 . A A . 102 LYS HD3 1 1 2 3377 1 1 102 LYS HE2 H -17.255 -0.192 -14.461 1.00 . A A . 102 LYS HE2 1 1 2 3378 1 1 102 LYS HE3 H -16.166 1.181 -14.440 1.00 . A A . 102 LYS HE3 1 1 2 3379 1 1 102 LYS HG2 H -14.173 0.840 -12.828 1.00 . A A . 102 LYS HG2 1 1 2 3380 1 1 102 LYS HG3 H -13.698 0.715 -14.510 1.00 . A A . 102 LYS HG3 1 1 2 3381 1 1 102 LYS HZ1 H -15.837 -0.991 -16.425 1.00 . A A . 102 LYS HZ1 1 1 2 3382 1 1 102 LYS HZ2 H -16.822 0.274 -16.713 1.00 . A A . 102 LYS HZ2 1 1 2 3383 1 1 102 LYS N N -10.677 0.256 -12.574 1.00 . A A . 102 LYS N 1 1 2 3384 1 1 102 LYS NZ N -16.020 -0.027 -16.170 1.00 . A A . 102 LYS NZ 1 1 2 3385 1 1 102 LYS O O -12.508 -2.084 -10.770 1.00 . A A . 102 LYS O 1 1 2 3386 1 1 103 SER C C -10.967 -0.636 -7.569 1.00 . A A . 103 SER C 1 1 2 3387 1 1 103 SER CA C -10.634 -1.462 -8.813 1.00 . A A . 103 SER CA 1 1 2 3388 1 1 103 SER CB C -9.177 -1.924 -8.769 1.00 . A A . 103 SER CB 1 1 2 3389 1 1 103 SER H H -10.345 0.140 -10.113 1.00 . A A . 103 SER H 1 1 2 3390 1 1 103 SER HA H -11.288 -2.331 -8.881 1.00 . A A . 103 SER HA 1 1 2 3391 1 1 103 SER HB2 H -8.830 -1.931 -7.736 1.00 . A A . 103 SER HB2 1 1 2 3392 1 1 103 SER HB3 H -9.110 -2.948 -9.135 1.00 . A A . 103 SER HB3 1 1 2 3393 1 1 103 SER HG H -8.448 -0.131 -9.278 1.00 . A A . 103 SER HG 1 1 2 3394 1 1 103 SER N N -10.901 -0.685 -10.012 1.00 . A A . 103 SER N 1 1 2 3395 1 1 103 SER O O -11.494 0.470 -7.677 1.00 . A A . 103 SER O 1 1 2 3396 1 1 103 SER OG O -8.327 -1.086 -9.548 1.00 . A A . 103 SER OG 1 1 2 3397 1 1 104 LYS C C -9.881 0.586 -4.957 1.00 . A A . 104 LYS C 1 1 2 3398 1 1 104 LYS CA C -10.904 -0.534 -5.154 1.00 . A A . 104 LYS CA 1 1 2 3399 1 1 104 LYS CB C -10.935 -1.547 -4.007 1.00 . A A . 104 LYS CB 1 1 2 3400 1 1 104 LYS CD C -13.306 -1.757 -3.173 1.00 . A A . 104 LYS CD 1 1 2 3401 1 1 104 LYS CE C -14.317 -2.812 -2.720 1.00 . A A . 104 LYS CE 1 1 2 3402 1 1 104 LYS CG C -12.216 -2.382 -4.047 1.00 . A A . 104 LYS CG 1 1 2 3403 1 1 104 LYS H H -10.216 -2.104 -6.338 1.00 . A A . 104 LYS H 1 1 2 3404 1 1 104 LYS HA H -11.896 -0.089 -5.217 1.00 . A A . 104 LYS HA 1 1 2 3405 1 1 104 LYS HB2 H -10.067 -2.203 -4.071 1.00 . A A . 104 LYS HB2 1 1 2 3406 1 1 104 LYS HB3 H -10.868 -1.023 -3.053 1.00 . A A . 104 LYS HB3 1 1 2 3407 1 1 104 LYS HD2 H -12.852 -1.286 -2.301 1.00 . A A . 104 LYS HD2 1 1 2 3408 1 1 104 LYS HD3 H -13.818 -0.972 -3.729 1.00 . A A . 104 LYS HD3 1 1 2 3409 1 1 104 LYS HE2 H -13.792 -3.675 -2.310 1.00 . A A . 104 LYS HE2 1 1 2 3410 1 1 104 LYS HE3 H -14.940 -2.409 -1.922 1.00 . A A . 104 LYS HE3 1 1 2 3411 1 1 104 LYS HG2 H -12.571 -2.461 -5.075 1.00 . A A . 104 LYS HG2 1 1 2 3412 1 1 104 LYS HG3 H -12.006 -3.395 -3.704 1.00 . A A . 104 LYS HG3 1 1 2 3413 1 1 104 LYS HZ1 H -15.779 -4.005 -3.605 1.00 . A A . 104 LYS HZ1 1 1 2 3414 1 1 104 LYS HZ2 H -15.763 -2.483 -4.184 1.00 . A A . 104 LYS HZ2 1 1 2 3415 1 1 104 LYS N N -10.645 -1.204 -6.417 1.00 . A A . 104 LYS N 1 1 2 3416 1 1 104 LYS NZ N -15.168 -3.235 -3.855 1.00 . A A . 104 LYS NZ 1 1 2 3417 1 1 104 LYS O O -10.175 1.595 -4.318 1.00 . A A . 104 LYS O 1 1 2 3418 1 1 105 CYS C C -7.841 2.409 -6.497 1.00 . A A . 105 CYS C 1 1 2 3419 1 1 105 CYS CA C -7.632 1.350 -5.412 1.00 . A A . 105 CYS CA 1 1 2 3420 1 1 105 CYS CB C -6.252 0.696 -5.512 1.00 . A A . 105 CYS CB 1 1 2 3421 1 1 105 CYS H H -8.469 -0.452 -6.037 1.00 . A A . 105 CYS H 1 1 2 3422 1 1 105 CYS HA H -7.710 1.793 -4.419 1.00 . A A . 105 CYS HA 1 1 2 3423 1 1 105 CYS HB2 H -6.097 0.308 -6.519 1.00 . A A . 105 CYS HB2 1 1 2 3424 1 1 105 CYS HB3 H -5.475 1.438 -5.334 1.00 . A A . 105 CYS HB3 1 1 2 3425 1 1 105 CYS N N -8.700 0.371 -5.518 1.00 . A A . 105 CYS N 1 1 2 3426 1 1 105 CYS O O -8.115 3.569 -6.193 1.00 . A A . 105 CYS O 1 1 2 3427 1 1 105 CYS SG S -6.113 -0.661 -4.292 1.00 . A A . 105 CYS SG 1 1 2 3428 1 1 106 HIS C C -9.314 2.785 -9.379 1.00 . A A . 106 HIS C 1 1 2 3429 1 1 106 HIS CA C -7.873 2.868 -8.872 1.00 . A A . 106 HIS CA 1 1 2 3430 1 1 106 HIS CB C -6.843 2.568 -9.962 1.00 . A A . 106 HIS CB 1 1 2 3431 1 1 106 HIS CD2 C -4.367 1.903 -9.450 1.00 . A A . 106 HIS CD2 1 1 2 3432 1 1 106 HIS CE1 C -3.646 3.864 -8.800 1.00 . A A . 106 HIS CE1 1 1 2 3433 1 1 106 HIS CG C -5.411 2.777 -9.528 1.00 . A A . 106 HIS CG 1 1 2 3434 1 1 106 HIS H H -7.480 1.027 -7.979 1.00 . A A . 106 HIS H 1 1 2 3435 1 1 106 HIS HA H -7.684 3.876 -8.504 1.00 . A A . 106 HIS HA 1 1 2 3436 1 1 106 HIS HB2 H -6.965 1.535 -10.289 1.00 . A A . 106 HIS HB2 1 1 2 3437 1 1 106 HIS HB3 H -7.047 3.202 -10.825 1.00 . A A . 106 HIS HB3 1 1 2 3438 1 1 106 HIS HD1 H -5.452 4.852 -9.055 1.00 . A A . 106 HIS HD1 1 1 2 3439 1 1 106 HIS HD2 H -4.402 0.844 -9.705 1.00 . A A . 106 HIS HD2 1 1 2 3440 1 1 106 HIS HE1 H -2.984 4.651 -8.439 1.00 . A A . 106 HIS HE1 1 1 2 3441 1 1 106 HIS N N -7.703 1.972 -7.740 1.00 . A A . 106 HIS N 1 1 2 3442 1 1 106 HIS ND1 N -4.926 4.004 -9.112 1.00 . A A . 106 HIS ND1 1 1 2 3443 1 1 106 HIS NE2 N -3.301 2.561 -9.011 1.00 . A A . 106 HIS NE2 1 1 2 3444 1 1 106 HIS O O -9.914 1.711 -9.385 1.00 . A A . 106 HIS O 1 1 2 3445 1 1 107 GLU C C -11.238 4.865 -11.566 1.00 . A A . 107 GLU C 1 1 2 3446 1 1 107 GLU CA C -11.188 4.006 -10.300 1.00 . A A . 107 GLU CA 1 1 2 3447 1 1 107 GLU CB C -12.144 4.544 -9.234 1.00 . A A . 107 GLU CB 1 1 2 3448 1 1 107 GLU CD C -13.730 3.600 -7.515 1.00 . A A . 107 GLU CD 1 1 2 3449 1 1 107 GLU CG C -12.314 3.540 -8.092 1.00 . A A . 107 GLU CG 1 1 2 3450 1 1 107 GLU H H -9.334 4.803 -9.785 1.00 . A A . 107 GLU H 1 1 2 3451 1 1 107 GLU HA H -11.462 2.978 -10.540 1.00 . A A . 107 GLU HA 1 1 2 3452 1 1 107 GLU HB2 H -11.762 5.486 -8.841 1.00 . A A . 107 GLU HB2 1 1 2 3453 1 1 107 GLU HB3 H -13.114 4.756 -9.684 1.00 . A A . 107 GLU HB3 1 1 2 3454 1 1 107 GLU HG2 H -12.108 2.533 -8.455 1.00 . A A . 107 GLU HG2 1 1 2 3455 1 1 107 GLU HG3 H -11.588 3.750 -7.307 1.00 . A A . 107 GLU HG3 1 1 2 3456 1 1 107 GLU N N -9.829 3.934 -9.793 1.00 . A A . 107 GLU N 1 1 2 3457 1 1 107 GLU O O -10.289 4.879 -12.348 1.00 . A A . 107 GLU O 1 1 2 3458 1 1 107 GLU OXT O -12.275 5.537 -11.755 1.00 . A A . 107 GLU OXT 1 1 2 3459 1 1 107 GLU OE1 O -14.117 4.705 -7.077 1.00 . A A . 107 GLU OE1 1 1 2 3460 1 1 107 GLU OE2 O -14.392 2.540 -7.524 1.00 . A A . 107 GLU OE2 1 1 2 3461 2 2 1 HEC C1A C -1.103 5.359 9.316 1.00 . B A . 108 HEC C1A 1 1 2 3462 2 2 1 HEC C1B C -1.982 2.172 12.098 1.00 . B A . 108 HEC C1B 1 1 2 3463 2 2 1 HEC C1C C -2.157 -0.647 8.773 1.00 . B A . 108 HEC C1C 1 1 2 3464 2 2 1 HEC C1D C -1.053 2.525 6.053 1.00 . B A . 108 HEC C1D 1 1 2 3465 2 2 1 HEC C2A C -0.996 6.415 10.295 1.00 . B A . 108 HEC C2A 1 1 2 3466 2 2 1 HEC C2B C -2.442 1.268 13.126 1.00 . B A . 108 HEC C2B 1 1 2 3467 2 2 1 HEC C2C C -2.221 -1.700 7.788 1.00 . B A . 108 HEC C2C 1 1 2 3468 2 2 1 HEC C2D C -0.685 3.465 5.021 1.00 . B A . 108 HEC C2D 1 1 2 3469 2 2 1 HEC C3A C -1.199 5.856 11.507 1.00 . B A . 108 HEC C3A 1 1 2 3470 2 2 1 HEC C3B C -2.618 0.062 12.545 1.00 . B A . 108 HEC C3B 1 1 2 3471 2 2 1 HEC C3C C -1.889 -1.154 6.599 1.00 . B A . 108 HEC C3C 1 1 2 3472 2 2 1 HEC C3D C -0.607 4.681 5.601 1.00 . B A . 108 HEC C3D 1 1 2 3473 2 2 1 HEC C4A C -1.435 4.448 11.289 1.00 . B A . 108 HEC C4A 1 1 2 3474 2 2 1 HEC C4B C -2.268 0.207 11.151 1.00 . B A . 108 HEC C4B 1 1 2 3475 2 2 1 HEC C4C C -1.614 0.244 6.837 1.00 . B A . 108 HEC C4C 1 1 2 3476 2 2 1 HEC C4D C -0.926 4.506 6.998 1.00 . B A . 108 HEC C4D 1 1 2 3477 2 2 1 HEC CAA C -0.709 7.854 9.979 1.00 . B A . 108 HEC CAA 1 1 2 3478 2 2 1 HEC CAB C -3.084 -1.213 13.185 1.00 . B A . 108 HEC CAB 1 1 2 3479 2 2 1 HEC CAC C -1.806 -1.830 5.262 1.00 . B A . 108 HEC CAC 1 1 2 3480 2 2 1 HEC CAD C -0.259 5.992 4.956 1.00 . B A . 108 HEC CAD 1 1 2 3481 2 2 1 HEC CBA C 0.408 8.465 10.821 1.00 . B A . 108 HEC CBA 1 1 2 3482 2 2 1 HEC CBB C -4.356 -1.061 14.014 1.00 . B A . 108 HEC CBB 1 1 2 3483 2 2 1 HEC CBC C -2.814 -2.960 5.074 1.00 . B A . 108 HEC CBC 1 1 2 3484 2 2 1 HEC CBD C -0.863 6.180 3.568 1.00 . B A . 108 HEC CBD 1 1 2 3485 2 2 1 HEC CGA C 0.163 9.947 11.063 1.00 . B A . 108 HEC CGA 1 1 2 3486 2 2 1 HEC CGD C 0.224 6.295 2.509 1.00 . B A . 108 HEC CGD 1 1 2 3487 2 2 1 HEC CHA C -0.954 5.546 7.946 1.00 . B A . 108 HEC CHA 1 1 2 3488 2 2 1 HEC CHB C -1.690 3.515 12.311 1.00 . B A . 108 HEC CHB 1 1 2 3489 2 2 1 HEC CHC C -2.319 -0.831 10.204 1.00 . B A . 108 HEC CHC 1 1 2 3490 2 2 1 HEC CHD C -1.231 1.162 5.842 1.00 . B A . 108 HEC CHD 1 1 2 3491 2 2 1 HEC CMA C -1.191 6.528 12.849 1.00 . B A . 108 HEC CMA 1 1 2 3492 2 2 1 HEC CMB C -2.669 1.644 14.561 1.00 . B A . 108 HEC CMB 1 1 2 3493 2 2 1 HEC CMC C -2.595 -3.125 8.078 1.00 . B A . 108 HEC CMC 1 1 2 3494 2 2 1 HEC CMD C -0.444 3.110 3.582 1.00 . B A . 108 HEC CMD 1 1 2 3495 2 2 1 HEC FE FE -1.558 2.346 9.067 1.00 . B A . 108 HEC FE 1 1 2 3496 2 2 1 HEC HAA1 H -0.410 7.944 8.934 1.00 . B A . 108 HEC HAA1 1 1 2 3497 2 2 1 HEC HAA2 H -1.605 8.450 10.153 1.00 . B A . 108 HEC HAA2 1 1 2 3498 2 2 1 HEC HAB H -3.291 -1.953 12.412 1.00 . B A . 108 HEC HAB 1 1 2 3499 2 2 1 HEC HAC H -1.991 -1.100 4.474 1.00 . B A . 108 HEC HAC 1 1 2 3500 2 2 1 HEC HAD1 H -0.623 6.810 5.578 1.00 . B A . 108 HEC HAD1 1 1 2 3501 2 2 1 HEC HAD2 H 0.823 6.069 4.850 1.00 . B A . 108 HEC HAD2 1 1 2 3502 2 2 1 HEC HBA1 H 0.456 7.957 11.784 1.00 . B A . 108 HEC HBA1 1 1 2 3503 2 2 1 HEC HBA2 H 1.359 8.348 10.301 1.00 . B A . 108 HEC HBA2 1 1 2 3504 2 2 1 HEC HBB1 H -4.097 -0.730 15.020 1.00 . B A . 108 HEC HBB1 1 1 2 3505 2 2 1 HEC HBB2 H -5.010 -0.326 13.546 1.00 . B A . 108 HEC HBB2 1 1 2 3506 2 2 1 HEC HBB3 H -4.870 -2.021 14.070 1.00 . B A . 108 HEC HBB3 1 1 2 3507 2 2 1 HEC HBC1 H -3.712 -2.746 5.654 1.00 . B A . 108 HEC HBC1 1 1 2 3508 2 2 1 HEC HBC2 H -3.074 -3.044 4.019 1.00 . B A . 108 HEC HBC2 1 1 2 3509 2 2 1 HEC HBC3 H -2.376 -3.898 5.416 1.00 . B A . 108 HEC HBC3 1 1 2 3510 2 2 1 HEC HBD1 H -1.495 5.325 3.327 1.00 . B A . 108 HEC HBD1 1 1 2 3511 2 2 1 HEC HBD2 H -1.462 7.090 3.552 1.00 . B A . 108 HEC HBD2 1 1 2 3512 2 2 1 HEC HHA H -0.850 6.566 7.576 1.00 . B A . 108 HEC HHA 1 1 2 3513 2 2 1 HEC HHB H -1.655 3.874 13.340 1.00 . B A . 108 HEC HHB 1 1 2 3514 2 2 1 HEC HHC H -2.532 -1.836 10.570 1.00 . B A . 108 HEC HHC 1 1 2 3515 2 2 1 HEC HHD H -1.064 0.773 4.837 1.00 . B A . 108 HEC HHD 1 1 2 3516 2 2 1 HEC HMA1 H -1.684 7.497 12.772 1.00 . B A . 108 HEC HMA1 1 1 2 3517 2 2 1 HEC HMA2 H -1.722 5.906 13.570 1.00 . B A . 108 HEC HMA2 1 1 2 3518 2 2 1 HEC HMA3 H -0.162 6.669 13.178 1.00 . B A . 108 HEC HMA3 1 1 2 3519 2 2 1 HEC HMB1 H -2.205 2.609 14.762 1.00 . B A . 108 HEC HMB1 1 1 2 3520 2 2 1 HEC HMB2 H -3.740 1.708 14.755 1.00 . B A . 108 HEC HMB2 1 1 2 3521 2 2 1 HEC HMB3 H -2.227 0.887 15.209 1.00 . B A . 108 HEC HMB3 1 1 2 3522 2 2 1 HEC HMC1 H -3.671 -3.250 7.957 1.00 . B A . 108 HEC HMC1 1 1 2 3523 2 2 1 HEC HMC2 H -2.072 -3.786 7.385 1.00 . B A . 108 HEC HMC2 1 1 2 3524 2 2 1 HEC HMC3 H -2.312 -3.374 9.100 1.00 . B A . 108 HEC HMC3 1 1 2 3525 2 2 1 HEC HMD1 H 0.104 2.169 3.527 1.00 . B A . 108 HEC HMD1 1 1 2 3526 2 2 1 HEC HMD2 H -1.400 3.005 3.069 1.00 . B A . 108 HEC HMD2 1 1 2 3527 2 2 1 HEC HMD3 H 0.140 3.898 3.106 1.00 . B A . 108 HEC HMD3 1 1 2 3528 2 2 1 HEC NA N -1.374 4.153 9.938 1.00 . B A . 108 HEC NA 1 1 2 3529 2 2 1 HEC NB N -1.879 1.509 10.887 1.00 . B A . 108 HEC NB 1 1 2 3530 2 2 1 HEC NC N -1.782 0.545 8.177 1.00 . B A . 108 HEC NC 1 1 2 3531 2 2 1 HEC ND N -1.199 3.176 7.266 1.00 . B A . 108 HEC ND 1 1 2 3532 2 2 1 HEC O1A O 0.452 10.392 12.195 1.00 . B A . 108 HEC O1A 1 1 2 3533 2 2 1 HEC O1D O 1.309 5.719 2.744 1.00 . B A . 108 HEC O1D 1 1 2 3534 2 2 1 HEC O2A O -0.307 10.608 10.112 1.00 . B A . 108 HEC O2A 1 1 2 3535 2 2 1 HEC O2D O -0.049 6.957 1.484 1.00 . B A . 108 HEC O2D 1 1 2 3536 3 2 1 HEC C1A C 9.655 -1.676 1.731 1.00 . C A . 109 HEC C1A 1 1 2 3537 3 2 1 HEC C1B C 5.800 -0.013 2.758 1.00 . C A . 109 HEC C1B 1 1 2 3538 3 2 1 HEC C1C C 7.800 2.997 5.232 1.00 . C A . 109 HEC C1C 1 1 2 3539 3 2 1 HEC C1D C 11.628 1.495 3.907 1.00 . C A . 109 HEC C1D 1 1 2 3540 3 2 1 HEC C2A C 9.160 -2.750 0.904 1.00 . C A . 109 HEC C2A 1 1 2 3541 3 2 1 HEC C2B C 4.441 0.339 3.095 1.00 . C A . 109 HEC C2B 1 1 2 3542 3 2 1 HEC C2C C 8.305 4.147 5.945 1.00 . C A . 109 HEC C2C 1 1 2 3543 3 2 1 HEC C2D C 12.981 1.082 3.616 1.00 . C A . 109 HEC C2D 1 1 2 3544 3 2 1 HEC C3A C 7.816 -2.638 0.869 1.00 . C A . 109 HEC C3A 1 1 2 3545 3 2 1 HEC C3B C 4.501 1.375 3.958 1.00 . C A . 109 HEC C3B 1 1 2 3546 3 2 1 HEC C3C C 9.648 4.140 5.809 1.00 . C A . 109 HEC C3C 1 1 2 3547 3 2 1 HEC C3D C 12.902 -0.050 2.885 1.00 . C A . 109 HEC C3D 1 1 2 3548 3 2 1 HEC C4A C 7.464 -1.492 1.674 1.00 . C A . 109 HEC C4A 1 1 2 3549 3 2 1 HEC C4B C 5.898 1.675 4.164 1.00 . C A . 109 HEC C4B 1 1 2 3550 3 2 1 HEC C4C C 9.988 2.986 5.011 1.00 . C A . 109 HEC C4C 1 1 2 3551 3 2 1 HEC C4D C 11.500 -0.349 2.716 1.00 . C A . 109 HEC C4D 1 1 2 3552 3 2 1 HEC CAA C 10.019 -3.779 0.228 1.00 . C A . 109 HEC CAA 1 1 2 3553 3 2 1 HEC CAB C 3.361 2.107 4.604 1.00 . C A . 109 HEC CAB 1 1 2 3554 3 2 1 HEC CAC C 10.638 5.123 6.363 1.00 . C A . 109 HEC CAC 1 1 2 3555 3 2 1 HEC CAD C 14.029 -0.873 2.332 1.00 . C A . 109 HEC CAD 1 1 2 3556 3 2 1 HEC CBA C 10.269 -3.504 -1.252 1.00 . C A . 109 HEC CBA 1 1 2 3557 3 2 1 HEC CBB C 2.319 1.193 5.242 1.00 . C A . 109 HEC CBB 1 1 2 3558 3 2 1 HEC CBC C 10.608 5.243 7.884 1.00 . C A . 109 HEC CBC 1 1 2 3559 3 2 1 HEC CBD C 15.233 -0.981 3.263 1.00 . C A . 109 HEC CBD 1 1 2 3560 3 2 1 HEC CGA C 11.053 -4.639 -1.896 1.00 . C A . 109 HEC CGA 1 1 2 3561 3 2 1 HEC CGD C 16.269 0.088 2.945 1.00 . C A . 109 HEC CGD 1 1 2 3562 3 2 1 HEC CHA C 11.000 -1.457 2.008 1.00 . C A . 109 HEC CHA 1 1 2 3563 3 2 1 HEC CHB C 6.149 -1.041 1.889 1.00 . C A . 109 HEC CHB 1 1 2 3564 3 2 1 HEC CHC C 6.379 2.697 5.003 1.00 . C A . 109 HEC CHC 1 1 2 3565 3 2 1 HEC CHD C 11.298 2.627 4.645 1.00 . C A . 109 HEC CHD 1 1 2 3566 3 2 1 HEC CMA C 6.834 -3.513 0.145 1.00 . C A . 109 HEC CMA 1 1 2 3567 3 2 1 HEC CMB C 3.218 -0.347 2.559 1.00 . C A . 109 HEC CMB 1 1 2 3568 3 2 1 HEC CMC C 7.456 5.140 6.685 1.00 . C A . 109 HEC CMC 1 1 2 3569 3 2 1 HEC CMD C 14.216 1.809 4.065 1.00 . C A . 109 HEC CMD 1 1 2 3570 3 2 1 HEC FE FE 8.715 0.701 3.408 1.00 . C A . 109 HEC FE 1 1 2 3571 3 2 1 HEC HAA1 H 10.993 -3.817 0.716 1.00 . C A . 109 HEC HAA1 1 1 2 3572 3 2 1 HEC HAA2 H 9.540 -4.755 0.297 1.00 . C A . 109 HEC HAA2 1 1 2 3573 3 2 1 HEC HAB H 3.745 2.755 5.391 1.00 . C A . 109 HEC HAB 1 1 2 3574 3 2 1 HEC HAC H 11.646 4.819 6.084 1.00 . C A . 109 HEC HAC 1 1 2 3575 3 2 1 HEC HAD1 H 13.678 -1.887 2.142 1.00 . C A . 109 HEC HAD1 1 1 2 3576 3 2 1 HEC HAD2 H 14.381 -0.429 1.401 1.00 . C A . 109 HEC HAD2 1 1 2 3577 3 2 1 HEC HBA1 H 9.314 -3.403 -1.769 1.00 . C A . 109 HEC HBA1 1 1 2 3578 3 2 1 HEC HBA2 H 10.839 -2.582 -1.360 1.00 . C A . 109 HEC HBA2 1 1 2 3579 3 2 1 HEC HBB1 H 2.815 0.480 5.900 1.00 . C A . 109 HEC HBB1 1 1 2 3580 3 2 1 HEC HBB2 H 1.615 1.792 5.821 1.00 . C A . 109 HEC HBB2 1 1 2 3581 3 2 1 HEC HBB3 H 1.781 0.654 4.462 1.00 . C A . 109 HEC HBB3 1 1 2 3582 3 2 1 HEC HBC1 H 10.335 4.282 8.319 1.00 . C A . 109 HEC HBC1 1 1 2 3583 3 2 1 HEC HBC2 H 11.594 5.538 8.244 1.00 . C A . 109 HEC HBC2 1 1 2 3584 3 2 1 HEC HBC3 H 9.875 5.995 8.175 1.00 . C A . 109 HEC HBC3 1 1 2 3585 3 2 1 HEC HBD1 H 14.908 -0.854 4.295 1.00 . C A . 109 HEC HBD1 1 1 2 3586 3 2 1 HEC HBD2 H 15.696 -1.961 3.146 1.00 . C A . 109 HEC HBD2 1 1 2 3587 3 2 1 HEC HHA H 11.722 -2.193 1.653 1.00 . C A . 109 HEC HHA 1 1 2 3588 3 2 1 HEC HHB H 5.352 -1.534 1.333 1.00 . C A . 109 HEC HHB 1 1 2 3589 3 2 1 HEC HHC H 5.643 3.305 5.528 1.00 . C A . 109 HEC HHC 1 1 2 3590 3 2 1 HEC HHD H 12.106 3.284 4.964 1.00 . C A . 109 HEC HHD 1 1 2 3591 3 2 1 HEC HMA1 H 6.129 -3.937 0.860 1.00 . C A . 109 HEC HMA1 1 1 2 3592 3 2 1 HEC HMA2 H 6.292 -2.919 -0.591 1.00 . C A . 109 HEC HMA2 1 1 2 3593 3 2 1 HEC HMA3 H 7.368 -4.318 -0.360 1.00 . C A . 109 HEC HMA3 1 1 2 3594 3 2 1 HEC HMB1 H 3.467 -0.862 1.631 1.00 . C A . 109 HEC HMB1 1 1 2 3595 3 2 1 HEC HMB2 H 2.858 -1.071 3.290 1.00 . C A . 109 HEC HMB2 1 1 2 3596 3 2 1 HEC HMB3 H 2.441 0.392 2.367 1.00 . C A . 109 HEC HMB3 1 1 2 3597 3 2 1 HEC HMC1 H 8.093 5.778 7.297 1.00 . C A . 109 HEC HMC1 1 1 2 3598 3 2 1 HEC HMC2 H 6.907 5.752 5.970 1.00 . C A . 109 HEC HMC2 1 1 2 3599 3 2 1 HEC HMC3 H 6.752 4.609 7.326 1.00 . C A . 109 HEC HMC3 1 1 2 3600 3 2 1 HEC HMD1 H 13.935 2.626 4.729 1.00 . C A . 109 HEC HMD1 1 1 2 3601 3 2 1 HEC HMD2 H 14.871 1.118 4.595 1.00 . C A . 109 HEC HMD2 1 1 2 3602 3 2 1 HEC HMD3 H 14.737 2.210 3.195 1.00 . C A . 109 HEC HMD3 1 1 2 3603 3 2 1 HEC NA N 8.603 -0.908 2.200 1.00 . C A . 109 HEC NA 1 1 2 3604 3 2 1 HEC NB N 6.689 0.815 3.422 1.00 . C A . 109 HEC NB 1 1 2 3605 3 2 1 HEC NC N 8.843 2.290 4.662 1.00 . C A . 109 HEC NC 1 1 2 3606 3 2 1 HEC ND N 10.725 0.608 3.349 1.00 . C A . 109 HEC ND 1 1 2 3607 3 2 1 HEC O1A O 10.762 -4.932 -3.076 1.00 . C A . 109 HEC O1A 1 1 2 3608 3 2 1 HEC O1D O 16.380 0.432 1.748 1.00 . C A . 109 HEC O1D 1 1 2 3609 3 2 1 HEC O2A O 11.929 -5.192 -1.196 1.00 . C A . 109 HEC O2A 1 1 2 3610 3 2 1 HEC O2D O 16.930 0.541 3.904 1.00 . C A . 109 HEC O2D 1 1 2 3611 4 2 1 HEC C1A C -8.633 -3.326 0.459 1.00 . D A . 110 HEC C1A 1 1 2 3612 4 2 1 HEC C1B C -4.913 -1.150 0.153 1.00 . D A . 110 HEC C1B 1 1 2 3613 4 2 1 HEC C1C C -2.832 -4.449 2.057 1.00 . D A . 110 HEC C1C 1 1 2 3614 4 2 1 HEC C1D C -6.570 -6.589 2.402 1.00 . D A . 110 HEC C1D 1 1 2 3615 4 2 1 HEC C2A C -9.457 -2.354 -0.219 1.00 . D A . 110 HEC C2A 1 1 2 3616 4 2 1 HEC C2B C -3.750 -0.323 -0.072 1.00 . D A . 110 HEC C2B 1 1 2 3617 4 2 1 HEC C2C C -1.993 -5.479 2.622 1.00 . D A . 110 HEC C2C 1 1 2 3618 4 2 1 HEC C2D C -7.745 -7.364 2.726 1.00 . D A . 110 HEC C2D 1 1 2 3619 4 2 1 HEC C3A C -8.652 -1.329 -0.571 1.00 . D A . 110 HEC C3A 1 1 2 3620 4 2 1 HEC C3B C -2.701 -0.950 0.500 1.00 . D A . 110 HEC C3B 1 1 2 3621 4 2 1 HEC C3C C -2.796 -6.517 2.937 1.00 . D A . 110 HEC C3C 1 1 2 3622 4 2 1 HEC C3D C -8.810 -6.693 2.237 1.00 . D A . 110 HEC C3D 1 1 2 3623 4 2 1 HEC C4A C -7.322 -1.656 -0.114 1.00 . D A . 110 HEC C4A 1 1 2 3624 4 2 1 HEC C4B C -3.203 -2.172 1.084 1.00 . D A . 110 HEC C4B 1 1 2 3625 4 2 1 HEC C4C C -4.141 -6.141 2.570 1.00 . D A . 110 HEC C4C 1 1 2 3626 4 2 1 HEC C4D C -8.304 -5.497 1.606 1.00 . D A . 110 HEC C4D 1 1 2 3627 4 2 1 HEC CAA C -10.930 -2.498 -0.465 1.00 . D A . 110 HEC CAA 1 1 2 3628 4 2 1 HEC CAB C -1.269 -0.502 0.545 1.00 . D A . 110 HEC CAB 1 1 2 3629 4 2 1 HEC CAC C -2.409 -7.831 3.552 1.00 . D A . 110 HEC CAC 1 1 2 3630 4 2 1 HEC CAD C -10.258 -7.079 2.311 1.00 . D A . 110 HEC CAD 1 1 2 3631 4 2 1 HEC CBA C -11.798 -1.620 0.432 1.00 . D A . 110 HEC CBA 1 1 2 3632 4 2 1 HEC CBB C -1.084 0.938 1.015 1.00 . D A . 110 HEC CBB 1 1 2 3633 4 2 1 HEC CBC C -1.121 -7.779 4.368 1.00 . D A . 110 HEC CBC 1 1 2 3634 4 2 1 HEC CBD C -10.956 -7.137 0.955 1.00 . D A . 110 HEC CBD 1 1 2 3635 4 2 1 HEC CGA C -13.006 -2.389 0.948 1.00 . D A . 110 HEC CGA 1 1 2 3636 4 2 1 HEC CGD C -12.108 -6.146 0.889 1.00 . D A . 110 HEC CGD 1 1 2 3637 4 2 1 HEC CHA C -9.106 -4.529 0.974 1.00 . D A . 110 HEC CHA 1 1 2 3638 4 2 1 HEC CHB C -6.193 -0.836 -0.290 1.00 . D A . 110 HEC CHB 1 1 2 3639 4 2 1 HEC CHC C -2.413 -3.109 1.775 1.00 . D A . 110 HEC CHC 1 1 2 3640 4 2 1 HEC CHD C -5.273 -6.958 2.742 1.00 . D A . 110 HEC CHD 1 1 2 3641 4 2 1 HEC CMA C -9.024 -0.069 -1.299 1.00 . D A . 110 HEC CMA 1 1 2 3642 4 2 1 HEC CMB C -3.756 0.984 -0.809 1.00 . D A . 110 HEC CMB 1 1 2 3643 4 2 1 HEC CMC C -0.507 -5.371 2.805 1.00 . D A . 110 HEC CMC 1 1 2 3644 4 2 1 HEC CMD C -7.736 -8.668 3.469 1.00 . D A . 110 HEC CMD 1 1 2 3645 4 2 1 HEC FE FE -5.741 -3.871 1.281 1.00 . D A . 110 HEC FE 1 1 2 3646 4 2 1 HEC HAA1 H -11.155 -2.226 -1.496 1.00 . D A . 110 HEC HAA1 1 1 2 3647 4 2 1 HEC HAA2 H -11.229 -3.532 -0.289 1.00 . D A . 110 HEC HAA2 1 1 2 3648 4 2 1 HEC HAB H -0.710 -1.138 1.231 1.00 . D A . 110 HEC HAB 1 1 2 3649 4 2 1 HEC HAC H -3.201 -8.165 4.222 1.00 . D A . 110 HEC HAC 1 1 2 3650 4 2 1 HEC HAD1 H -10.349 -8.067 2.763 1.00 . D A . 110 HEC HAD1 1 1 2 3651 4 2 1 HEC HAD2 H -10.797 -6.351 2.919 1.00 . D A . 110 HEC HAD2 1 1 2 3652 4 2 1 HEC HBA1 H -11.211 -1.279 1.284 1.00 . D A . 110 HEC HBA1 1 1 2 3653 4 2 1 HEC HBA2 H -12.150 -0.758 -0.135 1.00 . D A . 110 HEC HBA2 1 1 2 3654 4 2 1 HEC HBB1 H -1.107 1.607 0.154 1.00 . D A . 110 HEC HBB1 1 1 2 3655 4 2 1 HEC HBB2 H -1.888 1.202 1.702 1.00 . D A . 110 HEC HBB2 1 1 2 3656 4 2 1 HEC HBB3 H -0.125 1.034 1.523 1.00 . D A . 110 HEC HBB3 1 1 2 3657 4 2 1 HEC HBC1 H -1.194 -6.986 5.113 1.00 . D A . 110 HEC HBC1 1 1 2 3658 4 2 1 HEC HBC2 H -0.970 -8.735 4.870 1.00 . D A . 110 HEC HBC2 1 1 2 3659 4 2 1 HEC HBC3 H -0.279 -7.579 3.706 1.00 . D A . 110 HEC HBC3 1 1 2 3660 4 2 1 HEC HBD1 H -10.241 -6.895 0.169 1.00 . D A . 110 HEC HBD1 1 1 2 3661 4 2 1 HEC HBD2 H -11.349 -8.141 0.792 1.00 . D A . 110 HEC HBD2 1 1 2 3662 4 2 1 HEC HHA H -10.172 -4.740 0.884 1.00 . D A . 110 HEC HHA 1 1 2 3663 4 2 1 HEC HHB H -6.337 0.111 -0.811 1.00 . D A . 110 HEC HHB 1 1 2 3664 4 2 1 HEC HHC H -1.419 -2.793 2.090 1.00 . D A . 110 HEC HHC 1 1 2 3665 4 2 1 HEC HHD H -5.118 -7.948 3.171 1.00 . D A . 110 HEC HHD 1 1 2 3666 4 2 1 HEC HMA1 H -8.364 0.739 -0.986 1.00 . D A . 110 HEC HMA1 1 1 2 3667 4 2 1 HEC HMA2 H -8.923 -0.227 -2.373 1.00 . D A . 110 HEC HMA2 1 1 2 3668 4 2 1 HEC HMA3 H -10.056 0.193 -1.066 1.00 . D A . 110 HEC HMA3 1 1 2 3669 4 2 1 HEC HMB1 H -2.782 1.145 -1.271 1.00 . D A . 110 HEC HMB1 1 1 2 3670 4 2 1 HEC HMB2 H -4.526 0.963 -1.581 1.00 . D A . 110 HEC HMB2 1 1 2 3671 4 2 1 HEC HMB3 H -3.965 1.795 -0.110 1.00 . D A . 110 HEC HMB3 1 1 2 3672 4 2 1 HEC HMC1 H -0.177 -4.372 2.522 1.00 . D A . 110 HEC HMC1 1 1 2 3673 4 2 1 HEC HMC2 H -0.256 -5.554 3.850 1.00 . D A . 110 HEC HMC2 1 1 2 3674 4 2 1 HEC HMC3 H -0.009 -6.110 2.177 1.00 . D A . 110 HEC HMC3 1 1 2 3675 4 2 1 HEC HMD1 H -8.011 -8.494 4.509 1.00 . D A . 110 HEC HMD1 1 1 2 3676 4 2 1 HEC HMD2 H -8.452 -9.351 3.013 1.00 . D A . 110 HEC HMD2 1 1 2 3677 4 2 1 HEC HMD3 H -6.738 -9.104 3.425 1.00 . D A . 110 HEC HMD3 1 1 2 3678 4 2 1 HEC NA N -7.322 -2.888 0.518 1.00 . D A . 110 HEC NA 1 1 2 3679 4 2 1 HEC NB N -4.564 -2.285 0.864 1.00 . D A . 110 HEC NB 1 1 2 3680 4 2 1 HEC NC N -4.152 -4.866 2.030 1.00 . D A . 110 HEC NC 1 1 2 3681 4 2 1 HEC ND N -6.926 -5.443 1.713 1.00 . D A . 110 HEC ND 1 1 2 3682 4 2 1 HEC O1A O -14.111 -1.806 0.904 1.00 . D A . 110 HEC O1A 1 1 2 3683 4 2 1 HEC O1D O -12.816 -6.029 1.912 1.00 . D A . 110 HEC O1D 1 1 2 3684 4 2 1 HEC O2A O -12.802 -3.545 1.378 1.00 . D A . 110 HEC O2A 1 1 2 3685 4 2 1 HEC O2D O -12.260 -5.524 -0.185 1.00 . D A . 110 HEC O2D 1 1 2 3686 5 2 1 HEC C1A C -0.065 4.246 -9.232 1.00 . E A . 111 HEC C1A 1 1 2 3687 5 2 1 HEC C1B C -1.299 0.788 -11.512 1.00 . E A . 111 HEC C1B 1 1 2 3688 5 2 1 HEC C1C C -3.122 -0.899 -7.935 1.00 . E A . 111 HEC C1C 1 1 2 3689 5 2 1 HEC C1D C -1.880 2.574 -5.685 1.00 . E A . 111 HEC C1D 1 1 2 3690 5 2 1 HEC C2A C 0.550 4.959 -10.326 1.00 . E A . 111 HEC C2A 1 1 2 3691 5 2 1 HEC C2B C -1.431 -0.373 -12.360 1.00 . E A . 111 HEC C2B 1 1 2 3692 5 2 1 HEC C2C C -3.844 -1.547 -6.865 1.00 . E A . 111 HEC C2C 1 1 2 3693 5 2 1 HEC C2D C -1.404 3.577 -4.761 1.00 . E A . 111 HEC C2D 1 1 2 3694 5 2 1 HEC C3A C 0.379 4.208 -11.435 1.00 . E A . 111 HEC C3A 1 1 2 3695 5 2 1 HEC C3B C -2.035 -1.333 -11.629 1.00 . E A . 111 HEC C3B 1 1 2 3696 5 2 1 HEC C3C C -3.753 -0.746 -5.783 1.00 . E A . 111 HEC C3C 1 1 2 3697 5 2 1 HEC C3D C -0.694 4.473 -5.479 1.00 . E A . 111 HEC C3D 1 1 2 3698 5 2 1 HEC C4A C -0.346 3.024 -11.038 1.00 . E A . 111 HEC C4A 1 1 2 3699 5 2 1 HEC C4B C -2.284 -0.776 -10.320 1.00 . E A . 111 HEC C4B 1 1 2 3700 5 2 1 HEC C4C C -2.974 0.407 -6.172 1.00 . E A . 111 HEC C4C 1 1 2 3701 5 2 1 HEC C4D C -0.724 4.034 -6.854 1.00 . E A . 111 HEC C4D 1 1 2 3702 5 2 1 HEC CAA C 1.242 6.285 -10.207 1.00 . E A . 111 HEC CAA 1 1 2 3703 5 2 1 HEC CAB C -2.399 -2.726 -12.052 1.00 . E A . 111 HEC CAB 1 1 2 3704 5 2 1 HEC CAC C -4.334 -0.968 -4.417 1.00 . E A . 111 HEC CAC 1 1 2 3705 5 2 1 HEC CAD C 0.009 5.703 -4.985 1.00 . E A . 111 HEC CAD 1 1 2 3706 5 2 1 HEC CBA C 2.654 6.303 -10.785 1.00 . E A . 111 HEC CBA 1 1 2 3707 5 2 1 HEC CBB C -1.304 -3.759 -11.795 1.00 . E A . 111 HEC CBB 1 1 2 3708 5 2 1 HEC CBC C -4.163 -2.391 -3.894 1.00 . E A . 111 HEC CBC 1 1 2 3709 5 2 1 HEC CBD C -0.920 6.886 -4.723 1.00 . E A . 111 HEC CBD 1 1 2 3710 5 2 1 HEC CGA C 2.795 7.380 -11.852 1.00 . E A . 111 HEC CGA 1 1 2 3711 5 2 1 HEC CGD C -0.157 8.202 -4.768 1.00 . E A . 111 HEC CGD 1 1 2 3712 5 2 1 HEC CHA C -0.095 4.704 -7.919 1.00 . E A . 111 HEC CHA 1 1 2 3713 5 2 1 HEC CHB C -0.721 1.988 -11.913 1.00 . E A . 111 HEC CHB 1 1 2 3714 5 2 1 HEC CHC C -2.903 -1.468 -9.263 1.00 . E A . 111 HEC CHC 1 1 2 3715 5 2 1 HEC CHD C -2.655 1.479 -5.318 1.00 . E A . 111 HEC CHD 1 1 2 3716 5 2 1 HEC CMA C 0.835 4.508 -12.834 1.00 . E A . 111 HEC CMA 1 1 2 3717 5 2 1 HEC CMB C -0.967 -0.452 -13.786 1.00 . E A . 111 HEC CMB 1 1 2 3718 5 2 1 HEC CMC C -4.549 -2.867 -6.981 1.00 . E A . 111 HEC CMC 1 1 2 3719 5 2 1 HEC CMD C -1.674 3.581 -3.284 1.00 . E A . 111 HEC CMD 1 1 2 3720 5 2 1 HEC FE FE -1.622 1.688 -8.602 1.00 . E A . 111 HEC FE 1 1 2 3721 5 2 1 HEC HAA1 H 0.667 7.044 -10.737 1.00 . E A . 111 HEC HAA1 1 1 2 3722 5 2 1 HEC HAA2 H 1.322 6.559 -9.155 1.00 . E A . 111 HEC HAA2 1 1 2 3723 5 2 1 HEC HAB H -3.284 -3.053 -11.506 1.00 . E A . 111 HEC HAB 1 1 2 3724 5 2 1 HEC HAC H -3.849 -0.303 -3.703 1.00 . E A . 111 HEC HAC 1 1 2 3725 5 2 1 HEC HAD1 H 0.517 5.480 -4.047 1.00 . E A . 111 HEC HAD1 1 1 2 3726 5 2 1 HEC HAD2 H 0.739 6.027 -5.726 1.00 . E A . 111 HEC HAD2 1 1 2 3727 5 2 1 HEC HBA1 H 3.371 6.505 -9.990 1.00 . E A . 111 HEC HBA1 1 1 2 3728 5 2 1 HEC HBA2 H 2.875 5.335 -11.236 1.00 . E A . 111 HEC HBA2 1 1 2 3729 5 2 1 HEC HBB1 H -1.118 -4.325 -12.708 1.00 . E A . 111 HEC HBB1 1 1 2 3730 5 2 1 HEC HBB2 H -0.390 -3.250 -11.490 1.00 . E A . 111 HEC HBB2 1 1 2 3731 5 2 1 HEC HBB3 H -1.624 -4.438 -11.005 1.00 . E A . 111 HEC HBB3 1 1 2 3732 5 2 1 HEC HBC1 H -3.980 -2.365 -2.820 1.00 . E A . 111 HEC HBC1 1 1 2 3733 5 2 1 HEC HBC2 H -5.069 -2.963 -4.093 1.00 . E A . 111 HEC HBC2 1 1 2 3734 5 2 1 HEC HBC3 H -3.318 -2.864 -4.395 1.00 . E A . 111 HEC HBC3 1 1 2 3735 5 2 1 HEC HBD1 H -1.701 6.909 -5.483 1.00 . E A . 111 HEC HBD1 1 1 2 3736 5 2 1 HEC HBD2 H -1.374 6.780 -3.738 1.00 . E A . 111 HEC HBD2 1 1 2 3737 5 2 1 HEC HHA H 0.403 5.648 -7.695 1.00 . E A . 111 HEC HHA 1 1 2 3738 5 2 1 HEC HHB H -0.545 2.140 -12.978 1.00 . E A . 111 HEC HHB 1 1 2 3739 5 2 1 HEC HHC H -3.232 -2.489 -9.455 1.00 . E A . 111 HEC HHC 1 1 2 3740 5 2 1 HEC HHD H -3.043 1.444 -4.301 1.00 . E A . 111 HEC HHD 1 1 2 3741 5 2 1 HEC HMA1 H 0.003 4.915 -13.408 1.00 . E A . 111 HEC HMA1 1 1 2 3742 5 2 1 HEC HMA2 H 1.646 5.235 -12.803 1.00 . E A . 111 HEC HMA2 1 1 2 3743 5 2 1 HEC HMA3 H 1.187 3.590 -13.305 1.00 . E A . 111 HEC HMA3 1 1 2 3744 5 2 1 HEC HMB1 H -1.774 -0.836 -14.410 1.00 . E A . 111 HEC HMB1 1 1 2 3745 5 2 1 HEC HMB2 H -0.682 0.542 -14.131 1.00 . E A . 111 HEC HMB2 1 1 2 3746 5 2 1 HEC HMB3 H -0.108 -1.120 -13.851 1.00 . E A . 111 HEC HMB3 1 1 2 3747 5 2 1 HEC HMC1 H -5.619 -2.722 -6.831 1.00 . E A . 111 HEC HMC1 1 1 2 3748 5 2 1 HEC HMC2 H -4.374 -3.286 -7.972 1.00 . E A . 111 HEC HMC2 1 1 2 3749 5 2 1 HEC HMC3 H -4.165 -3.552 -6.224 1.00 . E A . 111 HEC HMC3 1 1 2 3750 5 2 1 HEC HMD1 H -1.850 4.604 -2.950 1.00 . E A . 111 HEC HMD1 1 1 2 3751 5 2 1 HEC HMD2 H -2.554 2.973 -3.074 1.00 . E A . 111 HEC HMD2 1 1 2 3752 5 2 1 HEC HMD3 H -0.813 3.170 -2.757 1.00 . E A . 111 HEC HMD3 1 1 2 3753 5 2 1 HEC NA N -0.613 3.057 -9.681 1.00 . E A . 111 HEC NA 1 1 2 3754 5 2 1 HEC NB N -1.827 0.529 -10.259 1.00 . E A . 111 HEC NB 1 1 2 3755 5 2 1 HEC NC N -2.591 0.302 -7.497 1.00 . E A . 111 HEC NC 1 1 2 3756 5 2 1 HEC ND N -1.456 2.865 -6.970 1.00 . E A . 111 HEC ND 1 1 2 3757 5 2 1 HEC O1A O 2.943 6.994 -13.032 1.00 . E A . 111 HEC O1A 1 1 2 3758 5 2 1 HEC O1D O 0.600 8.452 -3.806 1.00 . E A . 111 HEC O1D 1 1 2 3759 5 2 1 HEC O2A O 2.753 8.568 -11.468 1.00 . E A . 111 HEC O2A 1 1 2 3760 5 2 1 HEC O2D O -0.346 8.934 -5.764 1.00 . E A . 111 HEC O2D 1 1 3 3761 1 1 1 ALA C C 0.402 4.254 19.863 1.00 . A A . 1 ALA C 1 1 3 3762 1 1 1 ALA CA C 1.505 3.211 19.677 1.00 . A A . 1 ALA CA 1 1 3 3763 1 1 1 ALA CB C 1.122 1.847 20.257 1.00 . A A . 1 ALA CB 1 1 3 3764 1 1 1 ALA H1 H 2.595 4.638 20.625 1.00 . A A . 1 ALA H1 1 1 3 3765 1 1 1 ALA H2 H 2.940 3.093 21.110 1.00 . A A . 1 ALA H2 1 1 3 3766 1 1 1 ALA HA H 1.709 3.095 18.613 1.00 . A A . 1 ALA HA 1 1 3 3767 1 1 1 ALA HB1 H 1.854 1.553 21.009 1.00 . A A . 1 ALA HB1 1 1 3 3768 1 1 1 ALA HB2 H 0.136 1.912 20.716 1.00 . A A . 1 ALA HB2 1 1 3 3769 1 1 1 ALA HB3 H 1.103 1.106 19.458 1.00 . A A . 1 ALA HB3 1 1 3 3770 1 1 1 ALA N N 2.724 3.682 20.313 1.00 . A A . 1 ALA N 1 1 3 3771 1 1 1 ALA O O -0.269 4.277 20.894 1.00 . A A . 1 ALA O 1 1 3 3772 1 1 2 PRO C C -2.163 5.578 18.636 1.00 . A A . 2 PRO C 1 1 3 3773 1 1 2 PRO CA C -0.766 6.159 18.861 1.00 . A A . 2 PRO CA 1 1 3 3774 1 1 2 PRO CB C -0.353 7.147 17.782 1.00 . A A . 2 PRO CB 1 1 3 3775 1 1 2 PRO CD C 1.021 5.119 17.587 1.00 . A A . 2 PRO CD 1 1 3 3776 1 1 2 PRO CG C 0.603 6.393 16.871 1.00 . A A . 2 PRO CG 1 1 3 3777 1 1 2 PRO HA H -0.789 6.586 19.765 1.00 . A A . 2 PRO HA 1 1 3 3778 1 1 2 PRO HB2 H -1.220 7.505 17.228 1.00 . A A . 2 PRO HB2 1 1 3 3779 1 1 2 PRO HB3 H 0.131 8.021 18.218 1.00 . A A . 2 PRO HB3 1 1 3 3780 1 1 2 PRO HD2 H 0.808 4.237 16.982 1.00 . A A . 2 PRO HD2 1 1 3 3781 1 1 2 PRO HD3 H 2.092 5.113 17.791 1.00 . A A . 2 PRO HD3 1 1 3 3782 1 1 2 PRO HG2 H 0.121 6.158 15.923 1.00 . A A . 2 PRO HG2 1 1 3 3783 1 1 2 PRO HG3 H 1.475 7.006 16.642 1.00 . A A . 2 PRO HG3 1 1 3 3784 1 1 2 PRO N N 0.245 5.116 18.823 1.00 . A A . 2 PRO N 1 1 3 3785 1 1 2 PRO O O -2.863 5.248 19.593 1.00 . A A . 2 PRO O 1 1 3 3786 1 1 3 LYS C C -4.041 5.098 15.498 1.00 . A A . 3 LYS C 1 1 3 3787 1 1 3 LYS CA C -3.828 4.935 17.005 1.00 . A A . 3 LYS CA 1 1 3 3788 1 1 3 LYS CB C -4.927 5.577 17.854 1.00 . A A . 3 LYS CB 1 1 3 3789 1 1 3 LYS CD C -7.185 4.857 18.716 1.00 . A A . 3 LYS CD 1 1 3 3790 1 1 3 LYS CE C -7.894 4.003 19.769 1.00 . A A . 3 LYS CE 1 1 3 3791 1 1 3 LYS CG C -5.695 4.519 18.649 1.00 . A A . 3 LYS CG 1 1 3 3792 1 1 3 LYS H H -1.952 5.740 16.595 1.00 . A A . 3 LYS H 1 1 3 3793 1 1 3 LYS HA H -3.821 3.870 17.239 1.00 . A A . 3 LYS HA 1 1 3 3794 1 1 3 LYS HB2 H -4.487 6.302 18.538 1.00 . A A . 3 LYS HB2 1 1 3 3795 1 1 3 LYS HB3 H -5.616 6.124 17.210 1.00 . A A . 3 LYS HB3 1 1 3 3796 1 1 3 LYS HD2 H -7.311 5.913 18.955 1.00 . A A . 3 LYS HD2 1 1 3 3797 1 1 3 LYS HD3 H -7.643 4.694 17.741 1.00 . A A . 3 LYS HD3 1 1 3 3798 1 1 3 LYS HE2 H -8.879 3.710 19.405 1.00 . A A . 3 LYS HE2 1 1 3 3799 1 1 3 LYS HE3 H -7.332 3.085 19.940 1.00 . A A . 3 LYS HE3 1 1 3 3800 1 1 3 LYS HG2 H -5.561 3.542 18.185 1.00 . A A . 3 LYS HG2 1 1 3 3801 1 1 3 LYS HG3 H -5.287 4.451 19.658 1.00 . A A . 3 LYS HG3 1 1 3 3802 1 1 3 LYS HZ1 H -7.399 5.543 21.082 1.00 . A A . 3 LYS HZ1 1 1 3 3803 1 1 3 LYS HZ2 H -8.968 5.116 21.165 1.00 . A A . 3 LYS HZ2 1 1 3 3804 1 1 3 LYS N N -2.527 5.470 17.367 1.00 . A A . 3 LYS N 1 1 3 3805 1 1 3 LYS NZ N -8.031 4.751 21.038 1.00 . A A . 3 LYS NZ 1 1 3 3806 1 1 3 LYS O O -3.436 5.968 14.873 1.00 . A A . 3 LYS O 1 1 3 3807 1 1 4 ALA C C -5.887 5.612 13.201 1.00 . A A . 4 ALA C 1 1 3 3808 1 1 4 ALA CA C -5.201 4.287 13.538 1.00 . A A . 4 ALA CA 1 1 3 3809 1 1 4 ALA CB C -6.057 3.076 13.163 1.00 . A A . 4 ALA CB 1 1 3 3810 1 1 4 ALA H H -5.390 3.544 15.474 1.00 . A A . 4 ALA H 1 1 3 3811 1 1 4 ALA HA H -4.256 4.229 12.998 1.00 . A A . 4 ALA HA 1 1 3 3812 1 1 4 ALA HB1 H -5.874 2.268 13.871 1.00 . A A . 4 ALA HB1 1 1 3 3813 1 1 4 ALA HB2 H -7.111 3.353 13.192 1.00 . A A . 4 ALA HB2 1 1 3 3814 1 1 4 ALA HB3 H -5.797 2.743 12.158 1.00 . A A . 4 ALA HB3 1 1 3 3815 1 1 4 ALA N N -4.902 4.248 14.959 1.00 . A A . 4 ALA N 1 1 3 3816 1 1 4 ALA O O -6.694 6.114 13.983 1.00 . A A . 4 ALA O 1 1 3 3817 1 1 5 PRO C C -7.547 7.221 11.081 1.00 . A A . 5 PRO C 1 1 3 3818 1 1 5 PRO CA C -6.106 7.414 11.557 1.00 . A A . 5 PRO CA 1 1 3 3819 1 1 5 PRO CB C -5.177 7.898 10.456 1.00 . A A . 5 PRO CB 1 1 3 3820 1 1 5 PRO CD C -4.582 5.590 11.054 1.00 . A A . 5 PRO CD 1 1 3 3821 1 1 5 PRO CG C -4.386 6.678 10.011 1.00 . A A . 5 PRO CG 1 1 3 3822 1 1 5 PRO HA H -6.153 8.064 12.315 1.00 . A A . 5 PRO HA 1 1 3 3823 1 1 5 PRO HB2 H -5.742 8.321 9.625 1.00 . A A . 5 PRO HB2 1 1 3 3824 1 1 5 PRO HB3 H -4.513 8.682 10.821 1.00 . A A . 5 PRO HB3 1 1 3 3825 1 1 5 PRO HD2 H -4.968 4.675 10.605 1.00 . A A . 5 PRO HD2 1 1 3 3826 1 1 5 PRO HD3 H -3.640 5.334 11.540 1.00 . A A . 5 PRO HD3 1 1 3 3827 1 1 5 PRO HG2 H -4.728 6.337 9.034 1.00 . A A . 5 PRO HG2 1 1 3 3828 1 1 5 PRO HG3 H -3.329 6.925 9.910 1.00 . A A . 5 PRO HG3 1 1 3 3829 1 1 5 PRO N N -5.533 6.156 12.006 1.00 . A A . 5 PRO N 1 1 3 3830 1 1 5 PRO O O -7.977 6.096 10.832 1.00 . A A . 5 PRO O 1 1 3 3831 1 1 6 ALA C C -9.723 7.580 9.183 1.00 . A A . 6 ALA C 1 1 3 3832 1 1 6 ALA CA C -9.638 8.304 10.528 1.00 . A A . 6 ALA CA 1 1 3 3833 1 1 6 ALA CB C -10.184 9.731 10.458 1.00 . A A . 6 ALA CB 1 1 3 3834 1 1 6 ALA H H -7.896 9.248 11.174 1.00 . A A . 6 ALA H 1 1 3 3835 1 1 6 ALA HA H -10.209 7.745 11.269 1.00 . A A . 6 ALA HA 1 1 3 3836 1 1 6 ALA HB1 H -9.429 10.389 10.028 1.00 . A A . 6 ALA HB1 1 1 3 3837 1 1 6 ALA HB2 H -11.078 9.748 9.835 1.00 . A A . 6 ALA HB2 1 1 3 3838 1 1 6 ALA HB3 H -10.436 10.074 11.462 1.00 . A A . 6 ALA HB3 1 1 3 3839 1 1 6 ALA N N -8.254 8.336 10.969 1.00 . A A . 6 ALA N 1 1 3 3840 1 1 6 ALA O O -8.738 7.010 8.717 1.00 . A A . 6 ALA O 1 1 3 3841 1 1 7 ASP C C -11.079 8.032 6.203 1.00 . A A . 7 ASP C 1 1 3 3842 1 1 7 ASP CA C -11.137 6.982 7.314 1.00 . A A . 7 ASP CA 1 1 3 3843 1 1 7 ASP CB C -12.516 6.320 7.267 1.00 . A A . 7 ASP CB 1 1 3 3844 1 1 7 ASP CG C -13.681 7.224 7.674 1.00 . A A . 7 ASP CG 1 1 3 3845 1 1 7 ASP H H -11.707 8.093 8.982 1.00 . A A . 7 ASP H 1 1 3 3846 1 1 7 ASP HA H -10.348 6.236 7.225 1.00 . A A . 7 ASP HA 1 1 3 3847 1 1 7 ASP HB2 H -12.693 5.957 6.255 1.00 . A A . 7 ASP HB2 1 1 3 3848 1 1 7 ASP HB3 H -12.506 5.448 7.921 1.00 . A A . 7 ASP HB3 1 1 3 3849 1 1 7 ASP N N -10.910 7.627 8.597 1.00 . A A . 7 ASP N 1 1 3 3850 1 1 7 ASP O O -11.238 9.224 6.462 1.00 . A A . 7 ASP O 1 1 3 3851 1 1 7 ASP OD1 O -13.842 8.274 7.016 1.00 . A A . 7 ASP OD1 1 1 3 3852 1 1 7 ASP OD2 O -14.386 6.844 8.634 1.00 . A A . 7 ASP OD2 1 1 3 3853 1 1 8 GLY C C -9.342 8.952 3.645 1.00 . A A . 8 GLY C 1 1 3 3854 1 1 8 GLY CA C -10.769 8.434 3.838 1.00 . A A . 8 GLY CA 1 1 3 3855 1 1 8 GLY H H -10.723 6.580 4.788 1.00 . A A . 8 GLY H 1 1 3 3856 1 1 8 GLY HA2 H -11.090 7.901 2.944 1.00 . A A . 8 GLY HA2 1 1 3 3857 1 1 8 GLY HA3 H -11.450 9.274 3.970 1.00 . A A . 8 GLY HA3 1 1 3 3858 1 1 8 GLY N N -10.851 7.551 4.990 1.00 . A A . 8 GLY N 1 1 3 3859 1 1 8 GLY O O -9.139 10.026 3.081 1.00 . A A . 8 GLY O 1 1 3 3860 1 1 9 LEU C C -6.526 8.318 2.568 1.00 . A A . 9 LEU C 1 1 3 3861 1 1 9 LEU CA C -6.989 8.530 4.010 1.00 . A A . 9 LEU CA 1 1 3 3862 1 1 9 LEU CB C -6.153 7.771 5.043 1.00 . A A . 9 LEU CB 1 1 3 3863 1 1 9 LEU CD1 C -4.151 6.536 4.132 1.00 . A A . 9 LEU CD1 1 1 3 3864 1 1 9 LEU CD2 C -4.215 9.071 4.085 1.00 . A A . 9 LEU CD2 1 1 3 3865 1 1 9 LEU CG C -4.637 7.806 4.834 1.00 . A A . 9 LEU CG 1 1 3 3866 1 1 9 LEU H H -8.564 7.292 4.580 1.00 . A A . 9 LEU H 1 1 3 3867 1 1 9 LEU HA H -6.908 9.591 4.247 1.00 . A A . 9 LEU HA 1 1 3 3868 1 1 9 LEU HB2 H -6.373 8.178 6.030 1.00 . A A . 9 LEU HB2 1 1 3 3869 1 1 9 LEU HB3 H -6.475 6.730 5.048 1.00 . A A . 9 LEU HB3 1 1 3 3870 1 1 9 LEU HD11 H -4.776 5.694 4.431 1.00 . A A . 9 LEU HD11 1 1 3 3871 1 1 9 LEU HD12 H -4.215 6.670 3.052 1.00 . A A . 9 LEU HD12 1 1 3 3872 1 1 9 LEU HD13 H -3.117 6.338 4.414 1.00 . A A . 9 LEU HD13 1 1 3 3873 1 1 9 LEU HD21 H -4.911 9.878 4.314 1.00 . A A . 9 LEU HD21 1 1 3 3874 1 1 9 LEU HD22 H -3.211 9.359 4.394 1.00 . A A . 9 LEU HD22 1 1 3 3875 1 1 9 LEU HD23 H -4.224 8.878 3.012 1.00 . A A . 9 LEU HD23 1 1 3 3876 1 1 9 LEU HG H -4.158 7.836 5.812 1.00 . A A . 9 LEU HG 1 1 3 3877 1 1 9 LEU N N -8.391 8.164 4.123 1.00 . A A . 9 LEU N 1 1 3 3878 1 1 9 LEU O O -6.175 7.204 2.182 1.00 . A A . 9 LEU O 1 1 3 3879 1 1 10 LYS C C -4.706 9.906 0.291 1.00 . A A . 10 LYS C 1 1 3 3880 1 1 10 LYS CA C -6.126 9.352 0.418 1.00 . A A . 10 LYS CA 1 1 3 3881 1 1 10 LYS CB C -7.146 10.065 -0.472 1.00 . A A . 10 LYS CB 1 1 3 3882 1 1 10 LYS CD C -7.438 11.248 -2.680 1.00 . A A . 10 LYS CD 1 1 3 3883 1 1 10 LYS CE C -6.546 12.363 -3.231 1.00 . A A . 10 LYS CE 1 1 3 3884 1 1 10 LYS CG C -6.614 10.223 -1.898 1.00 . A A . 10 LYS CG 1 1 3 3885 1 1 10 LYS H H -6.827 10.307 2.131 1.00 . A A . 10 LYS H 1 1 3 3886 1 1 10 LYS HA H -6.115 8.304 0.120 1.00 . A A . 10 LYS HA 1 1 3 3887 1 1 10 LYS HB2 H -8.078 9.501 -0.488 1.00 . A A . 10 LYS HB2 1 1 3 3888 1 1 10 LYS HB3 H -7.375 11.046 -0.055 1.00 . A A . 10 LYS HB3 1 1 3 3889 1 1 10 LYS HD2 H -7.957 10.753 -3.501 1.00 . A A . 10 LYS HD2 1 1 3 3890 1 1 10 LYS HD3 H -8.203 11.676 -2.032 1.00 . A A . 10 LYS HD3 1 1 3 3891 1 1 10 LYS HE2 H -5.680 12.497 -2.583 1.00 . A A . 10 LYS HE2 1 1 3 3892 1 1 10 LYS HE3 H -6.169 12.081 -4.214 1.00 . A A . 10 LYS HE3 1 1 3 3893 1 1 10 LYS HG2 H -5.571 10.536 -1.868 1.00 . A A . 10 LYS HG2 1 1 3 3894 1 1 10 LYS HG3 H -6.644 9.261 -2.409 1.00 . A A . 10 LYS HG3 1 1 3 3895 1 1 10 LYS HZ1 H -7.846 13.814 -2.492 1.00 . A A . 10 LYS HZ1 1 1 3 3896 1 1 10 LYS HZ2 H -6.690 14.429 -3.461 1.00 . A A . 10 LYS HZ2 1 1 3 3897 1 1 10 LYS N N -6.540 9.405 1.810 1.00 . A A . 10 LYS N 1 1 3 3898 1 1 10 LYS NZ N -7.302 13.631 -3.328 1.00 . A A . 10 LYS NZ 1 1 3 3899 1 1 10 LYS O O -4.348 10.869 0.969 1.00 . A A . 10 LYS O 1 1 3 3900 1 1 11 MET C C -2.324 10.034 -2.277 1.00 . A A . 11 MET C 1 1 3 3901 1 1 11 MET CA C -2.560 9.693 -0.805 1.00 . A A . 11 MET CA 1 1 3 3902 1 1 11 MET CB C -1.610 8.572 -0.381 1.00 . A A . 11 MET CB 1 1 3 3903 1 1 11 MET CE C -0.710 5.006 -0.233 1.00 . A A . 11 MET CE 1 1 3 3904 1 1 11 MET CG C -1.887 7.291 -1.170 1.00 . A A . 11 MET CG 1 1 3 3905 1 1 11 MET H H -4.232 8.493 -1.128 1.00 . A A . 11 MET H 1 1 3 3906 1 1 11 MET HA H -2.422 10.584 -0.192 1.00 . A A . 11 MET HA 1 1 3 3907 1 1 11 MET HB2 H -0.578 8.885 -0.540 1.00 . A A . 11 MET HB2 1 1 3 3908 1 1 11 MET HB3 H -1.723 8.378 0.686 1.00 . A A . 11 MET HB3 1 1 3 3909 1 1 11 MET HE1 H 0.145 5.679 -0.169 1.00 . A A . 11 MET HE1 1 1 3 3910 1 1 11 MET HE2 H -0.646 4.261 0.559 1.00 . A A . 11 MET HE2 1 1 3 3911 1 1 11 MET HE3 H -0.709 4.508 -1.202 1.00 . A A . 11 MET HE3 1 1 3 3912 1 1 11 MET HG2 H -2.738 7.440 -1.834 1.00 . A A . 11 MET HG2 1 1 3 3913 1 1 11 MET HG3 H -1.030 7.049 -1.799 1.00 . A A . 11 MET HG3 1 1 3 3914 1 1 11 MET N N -3.934 9.275 -0.581 1.00 . A A . 11 MET N 1 1 3 3915 1 1 11 MET O O -2.354 9.152 -3.135 1.00 . A A . 11 MET O 1 1 3 3916 1 1 11 MET SD S -2.219 5.943 -0.048 1.00 . A A . 11 MET SD 1 1 3 3917 1 1 12 GLU C C -0.385 12.179 -4.052 1.00 . A A . 12 GLU C 1 1 3 3918 1 1 12 GLU CA C -1.852 11.782 -3.881 1.00 . A A . 12 GLU CA 1 1 3 3919 1 1 12 GLU CB C -2.780 12.948 -4.231 1.00 . A A . 12 GLU CB 1 1 3 3920 1 1 12 GLU CD C -1.634 14.141 -6.135 1.00 . A A . 12 GLU CD 1 1 3 3921 1 1 12 GLU CG C -2.783 13.212 -5.738 1.00 . A A . 12 GLU CG 1 1 3 3922 1 1 12 GLU H H -2.070 12.025 -1.823 1.00 . A A . 12 GLU H 1 1 3 3923 1 1 12 GLU HA H -2.084 10.935 -4.525 1.00 . A A . 12 GLU HA 1 1 3 3924 1 1 12 GLU HB2 H -3.792 12.725 -3.895 1.00 . A A . 12 GLU HB2 1 1 3 3925 1 1 12 GLU HB3 H -2.458 13.845 -3.702 1.00 . A A . 12 GLU HB3 1 1 3 3926 1 1 12 GLU HG2 H -2.694 12.268 -6.277 1.00 . A A . 12 GLU HG2 1 1 3 3927 1 1 12 GLU HG3 H -3.733 13.657 -6.031 1.00 . A A . 12 GLU HG3 1 1 3 3928 1 1 12 GLU N N -2.094 11.315 -2.526 1.00 . A A . 12 GLU N 1 1 3 3929 1 1 12 GLU O O -0.071 13.357 -4.212 1.00 . A A . 12 GLU O 1 1 3 3930 1 1 12 GLU OE1 O -1.457 15.158 -5.430 1.00 . A A . 12 GLU OE1 1 1 3 3931 1 1 12 GLU OE2 O -0.957 13.813 -7.134 1.00 . A A . 12 GLU OE2 1 1 3 3932 1 1 13 ALA C C 2.312 11.122 -5.607 1.00 . A A . 13 ALA C 1 1 3 3933 1 1 13 ALA CA C 1.903 11.401 -4.160 1.00 . A A . 13 ALA CA 1 1 3 3934 1 1 13 ALA CB C 2.666 10.531 -3.159 1.00 . A A . 13 ALA CB 1 1 3 3935 1 1 13 ALA H H 0.212 10.216 -3.881 1.00 . A A . 13 ALA H 1 1 3 3936 1 1 13 ALA HA H 2.096 12.449 -3.932 1.00 . A A . 13 ALA HA 1 1 3 3937 1 1 13 ALA HB1 H 1.978 9.828 -2.690 1.00 . A A . 13 ALA HB1 1 1 3 3938 1 1 13 ALA HB2 H 3.449 9.980 -3.680 1.00 . A A . 13 ALA HB2 1 1 3 3939 1 1 13 ALA HB3 H 3.115 11.164 -2.395 1.00 . A A . 13 ALA HB3 1 1 3 3940 1 1 13 ALA N N 0.476 11.172 -4.011 1.00 . A A . 13 ALA N 1 1 3 3941 1 1 13 ALA O O 3.441 11.408 -6.003 1.00 . A A . 13 ALA O 1 1 3 3942 1 1 14 THR C C 0.476 10.753 -8.630 1.00 . A A . 14 THR C 1 1 3 3943 1 1 14 THR CA C 1.621 10.244 -7.752 1.00 . A A . 14 THR CA 1 1 3 3944 1 1 14 THR CB C 1.842 8.734 -7.857 1.00 . A A . 14 THR CB 1 1 3 3945 1 1 14 THR CG2 C 2.613 8.170 -6.662 1.00 . A A . 14 THR CG2 1 1 3 3946 1 1 14 THR H H 0.457 10.336 -6.028 1.00 . A A . 14 THR H 1 1 3 3947 1 1 14 THR HA H 2.524 10.767 -8.069 1.00 . A A . 14 THR HA 1 1 3 3948 1 1 14 THR HB H 2.334 8.476 -8.795 1.00 . A A . 14 THR HB 1 1 3 3949 1 1 14 THR HG1 H 0.067 8.603 -6.942 1.00 . A A . 14 THR HG1 1 1 3 3950 1 1 14 THR HG21 H 2.071 8.392 -5.742 1.00 . A A . 14 THR HG21 1 1 3 3951 1 1 14 THR HG22 H 2.716 7.091 -6.772 1.00 . A A . 14 THR HG22 1 1 3 3952 1 1 14 THR HG23 H 3.602 8.627 -6.620 1.00 . A A . 14 THR HG23 1 1 3 3953 1 1 14 THR N N 1.372 10.566 -6.357 1.00 . A A . 14 THR N 1 1 3 3954 1 1 14 THR O O -0.507 11.292 -8.123 1.00 . A A . 14 THR O 1 1 3 3955 1 1 14 THR OG1 O 0.535 8.182 -7.719 1.00 . A A . 14 THR OG1 1 1 3 3956 1 1 15 LYS C C -1.653 10.202 -10.657 1.00 . A A . 15 LYS C 1 1 3 3957 1 1 15 LYS CA C -0.367 10.998 -10.883 1.00 . A A . 15 LYS CA 1 1 3 3958 1 1 15 LYS CB C 0.171 10.904 -12.313 1.00 . A A . 15 LYS CB 1 1 3 3959 1 1 15 LYS CD C 0.057 12.564 -14.208 1.00 . A A . 15 LYS CD 1 1 3 3960 1 1 15 LYS CE C -0.790 13.038 -15.390 1.00 . A A . 15 LYS CE 1 1 3 3961 1 1 15 LYS CG C -0.746 11.637 -13.293 1.00 . A A . 15 LYS CG 1 1 3 3962 1 1 15 LYS H H 1.443 10.125 -10.335 1.00 . A A . 15 LYS H 1 1 3 3963 1 1 15 LYS HA H -0.572 12.050 -10.685 1.00 . A A . 15 LYS HA 1 1 3 3964 1 1 15 LYS HB2 H 1.173 11.331 -12.357 1.00 . A A . 15 LYS HB2 1 1 3 3965 1 1 15 LYS HB3 H 0.259 9.857 -12.604 1.00 . A A . 15 LYS HB3 1 1 3 3966 1 1 15 LYS HD2 H 0.410 13.425 -13.640 1.00 . A A . 15 LYS HD2 1 1 3 3967 1 1 15 LYS HD3 H 0.941 12.042 -14.575 1.00 . A A . 15 LYS HD3 1 1 3 3968 1 1 15 LYS HE2 H -0.152 13.215 -16.255 1.00 . A A . 15 LYS HE2 1 1 3 3969 1 1 15 LYS HE3 H -1.500 12.260 -15.671 1.00 . A A . 15 LYS HE3 1 1 3 3970 1 1 15 LYS HG2 H -1.294 10.912 -13.895 1.00 . A A . 15 LYS HG2 1 1 3 3971 1 1 15 LYS HG3 H -1.486 12.217 -12.741 1.00 . A A . 15 LYS HG3 1 1 3 3972 1 1 15 LYS HZ1 H -1.383 15.006 -15.734 1.00 . A A . 15 LYS HZ1 1 1 3 3973 1 1 15 LYS HZ2 H -2.518 14.125 -14.969 1.00 . A A . 15 LYS HZ2 1 1 3 3974 1 1 15 LYS N N 0.641 10.565 -9.931 1.00 . A A . 15 LYS N 1 1 3 3975 1 1 15 LYS NZ N -1.518 14.279 -15.041 1.00 . A A . 15 LYS NZ 1 1 3 3976 1 1 15 LYS O O -2.703 10.543 -11.201 1.00 . A A . 15 LYS O 1 1 3 3977 1 1 16 GLN C C -2.846 8.180 -8.033 1.00 . A A . 16 GLN C 1 1 3 3978 1 1 16 GLN CA C -2.670 8.308 -9.548 1.00 . A A . 16 GLN CA 1 1 3 3979 1 1 16 GLN CB C -2.520 6.933 -10.201 1.00 . A A . 16 GLN CB 1 1 3 3980 1 1 16 GLN CD C -3.374 6.953 -12.573 1.00 . A A . 16 GLN CD 1 1 3 3981 1 1 16 GLN CG C -2.139 7.065 -11.677 1.00 . A A . 16 GLN CG 1 1 3 3982 1 1 16 GLN H H -0.673 8.886 -9.414 1.00 . A A . 16 GLN H 1 1 3 3983 1 1 16 GLN HA H -3.532 8.816 -9.979 1.00 . A A . 16 GLN HA 1 1 3 3984 1 1 16 GLN HB2 H -1.758 6.358 -9.675 1.00 . A A . 16 GLN HB2 1 1 3 3985 1 1 16 GLN HB3 H -3.455 6.380 -10.111 1.00 . A A . 16 GLN HB3 1 1 3 3986 1 1 16 GLN HE21 H -3.645 5.068 -11.886 1.00 . A A . 16 GLN HE21 1 1 3 3987 1 1 16 GLN HE22 H -4.814 5.611 -13.043 1.00 . A A . 16 GLN HE22 1 1 3 3988 1 1 16 GLN HG2 H -1.648 8.023 -11.845 1.00 . A A . 16 GLN HG2 1 1 3 3989 1 1 16 GLN HG3 H -1.422 6.288 -11.941 1.00 . A A . 16 GLN HG3 1 1 3 3990 1 1 16 GLN N N -1.530 9.156 -9.853 1.00 . A A . 16 GLN N 1 1 3 3991 1 1 16 GLN NE2 N -3.996 5.780 -12.494 1.00 . A A . 16 GLN NE2 1 1 3 3992 1 1 16 GLN O O -2.134 7.416 -7.384 1.00 . A A . 16 GLN O 1 1 3 3993 1 1 16 GLN OE1 O -3.738 7.872 -13.290 1.00 . A A . 16 GLN OE1 1 1 3 3994 1 1 17 PRO C C -4.855 7.669 -5.680 1.00 . A A . 17 PRO C 1 1 3 3995 1 1 17 PRO CA C -4.103 8.942 -6.075 1.00 . A A . 17 PRO CA 1 1 3 3996 1 1 17 PRO CB C -4.901 10.209 -5.813 1.00 . A A . 17 PRO CB 1 1 3 3997 1 1 17 PRO CD C -4.687 9.878 -8.238 1.00 . A A . 17 PRO CD 1 1 3 3998 1 1 17 PRO CG C -5.437 10.650 -7.165 1.00 . A A . 17 PRO CG 1 1 3 3999 1 1 17 PRO HA H -3.249 8.927 -5.554 1.00 . A A . 17 PRO HA 1 1 3 4000 1 1 17 PRO HB2 H -5.715 10.020 -5.113 1.00 . A A . 17 PRO HB2 1 1 3 4001 1 1 17 PRO HB3 H -4.273 10.982 -5.370 1.00 . A A . 17 PRO HB3 1 1 3 4002 1 1 17 PRO HD2 H -5.374 9.338 -8.890 1.00 . A A . 17 PRO HD2 1 1 3 4003 1 1 17 PRO HD3 H -4.105 10.546 -8.873 1.00 . A A . 17 PRO HD3 1 1 3 4004 1 1 17 PRO HG2 H -6.507 10.458 -7.233 1.00 . A A . 17 PRO HG2 1 1 3 4005 1 1 17 PRO HG3 H -5.297 11.723 -7.299 1.00 . A A . 17 PRO HG3 1 1 3 4006 1 1 17 PRO N N -3.824 8.960 -7.500 1.00 . A A . 17 PRO N 1 1 3 4007 1 1 17 PRO O O -5.421 6.988 -6.534 1.00 . A A . 17 PRO O 1 1 3 4008 1 1 18 VAL C C -6.130 6.537 -2.507 1.00 . A A . 18 VAL C 1 1 3 4009 1 1 18 VAL CA C -5.511 6.208 -3.867 1.00 . A A . 18 VAL CA 1 1 3 4010 1 1 18 VAL CB C -4.535 5.031 -3.810 1.00 . A A . 18 VAL CB 1 1 3 4011 1 1 18 VAL CG1 C -5.155 3.840 -3.078 1.00 . A A . 18 VAL CG1 1 1 3 4012 1 1 18 VAL CG2 C -4.075 4.633 -5.214 1.00 . A A . 18 VAL CG2 1 1 3 4013 1 1 18 VAL H H -4.376 7.947 -3.697 1.00 . A A . 18 VAL H 1 1 3 4014 1 1 18 VAL HA H -6.309 5.952 -4.564 1.00 . A A . 18 VAL HA 1 1 3 4015 1 1 18 VAL HB H -3.657 5.350 -3.249 1.00 . A A . 18 VAL HB 1 1 3 4016 1 1 18 VAL HG11 H -5.466 4.149 -2.080 1.00 . A A . 18 VAL HG11 1 1 3 4017 1 1 18 VAL HG12 H -6.022 3.483 -3.634 1.00 . A A . 18 VAL HG12 1 1 3 4018 1 1 18 VAL HG13 H -4.420 3.039 -2.998 1.00 . A A . 18 VAL HG13 1 1 3 4019 1 1 18 VAL HG21 H -4.818 4.953 -5.945 1.00 . A A . 18 VAL HG21 1 1 3 4020 1 1 18 VAL HG22 H -3.120 5.111 -5.433 1.00 . A A . 18 VAL HG22 1 1 3 4021 1 1 18 VAL HG23 H -3.959 3.550 -5.265 1.00 . A A . 18 VAL HG23 1 1 3 4022 1 1 18 VAL N N -4.838 7.387 -4.385 1.00 . A A . 18 VAL N 1 1 3 4023 1 1 18 VAL O O -5.645 7.415 -1.796 1.00 . A A . 18 VAL O 1 1 3 4024 1 1 19 VAL C C -7.824 4.729 -0.101 1.00 . A A . 19 VAL C 1 1 3 4025 1 1 19 VAL CA C -7.885 6.017 -0.925 1.00 . A A . 19 VAL CA 1 1 3 4026 1 1 19 VAL CB C -9.315 6.495 -1.184 1.00 . A A . 19 VAL CB 1 1 3 4027 1 1 19 VAL CG1 C -10.155 6.425 0.093 1.00 . A A . 19 VAL CG1 1 1 3 4028 1 1 19 VAL CG2 C -9.324 7.908 -1.770 1.00 . A A . 19 VAL CG2 1 1 3 4029 1 1 19 VAL H H -7.581 5.101 -2.771 1.00 . A A . 19 VAL H 1 1 3 4030 1 1 19 VAL HA H -7.359 6.805 -0.385 1.00 . A A . 19 VAL HA 1 1 3 4031 1 1 19 VAL HB H -9.764 5.825 -1.917 1.00 . A A . 19 VAL HB 1 1 3 4032 1 1 19 VAL HG11 H -9.499 6.296 0.954 1.00 . A A . 19 VAL HG11 1 1 3 4033 1 1 19 VAL HG12 H -10.724 7.348 0.205 1.00 . A A . 19 VAL HG12 1 1 3 4034 1 1 19 VAL HG13 H -10.842 5.581 0.030 1.00 . A A . 19 VAL HG13 1 1 3 4035 1 1 19 VAL HG21 H -8.302 8.216 -1.991 1.00 . A A . 19 VAL HG21 1 1 3 4036 1 1 19 VAL HG22 H -9.913 7.917 -2.687 1.00 . A A . 19 VAL HG22 1 1 3 4037 1 1 19 VAL HG23 H -9.763 8.597 -1.048 1.00 . A A . 19 VAL HG23 1 1 3 4038 1 1 19 VAL N N -7.193 5.813 -2.187 1.00 . A A . 19 VAL N 1 1 3 4039 1 1 19 VAL O O -8.405 3.715 -0.484 1.00 . A A . 19 VAL O 1 1 3 4040 1 1 20 PHE C C -7.865 3.805 3.129 1.00 . A A . 20 PHE C 1 1 3 4041 1 1 20 PHE CA C -6.970 3.665 1.895 1.00 . A A . 20 PHE CA 1 1 3 4042 1 1 20 PHE CB C -5.506 3.658 2.341 1.00 . A A . 20 PHE CB 1 1 3 4043 1 1 20 PHE CD1 C -4.947 1.233 2.749 1.00 . A A . 20 PHE CD1 1 1 3 4044 1 1 20 PHE CD2 C -5.013 2.712 4.626 1.00 . A A . 20 PHE CD2 1 1 3 4045 1 1 20 PHE CE1 C -4.606 0.140 3.622 1.00 . A A . 20 PHE CE1 1 1 3 4046 1 1 20 PHE CE2 C -4.673 1.619 5.499 1.00 . A A . 20 PHE CE2 1 1 3 4047 1 1 20 PHE CG C -5.144 2.496 3.269 1.00 . A A . 20 PHE CG 1 1 3 4048 1 1 20 PHE CZ C -4.486 0.387 4.954 1.00 . A A . 20 PHE CZ 1 1 3 4049 1 1 20 PHE H H -6.645 5.640 1.319 1.00 . A A . 20 PHE H 1 1 3 4050 1 1 20 PHE HA H -7.265 2.775 1.340 1.00 . A A . 20 PHE HA 1 1 3 4051 1 1 20 PHE HB2 H -4.868 3.616 1.457 1.00 . A A . 20 PHE HB2 1 1 3 4052 1 1 20 PHE HB3 H -5.286 4.597 2.848 1.00 . A A . 20 PHE HB3 1 1 3 4053 1 1 20 PHE HD1 H -5.050 1.063 1.677 1.00 . A A . 20 PHE HD1 1 1 3 4054 1 1 20 PHE HD2 H -5.169 3.710 5.036 1.00 . A A . 20 PHE HD2 1 1 3 4055 1 1 20 PHE HE1 H -4.448 -0.862 3.225 1.00 . A A . 20 PHE HE1 1 1 3 4056 1 1 20 PHE HE2 H -4.567 1.776 6.573 1.00 . A A . 20 PHE HE2 1 1 3 4057 1 1 20 PHE HZ H -4.198 -0.520 5.544 1.00 . A A . 20 PHE HZ 1 1 3 4058 1 1 20 PHE N N -7.114 4.812 1.015 1.00 . A A . 20 PHE N 1 1 3 4059 1 1 20 PHE O O -8.349 4.895 3.428 1.00 . A A . 20 PHE O 1 1 3 4060 1 1 21 ASN C C -8.254 1.742 6.045 1.00 . A A . 21 ASN C 1 1 3 4061 1 1 21 ASN CA C -8.885 2.669 5.004 1.00 . A A . 21 ASN CA 1 1 3 4062 1 1 21 ASN CB C -10.288 2.144 4.694 1.00 . A A . 21 ASN CB 1 1 3 4063 1 1 21 ASN CG C -11.069 3.142 3.836 1.00 . A A . 21 ASN CG 1 1 3 4064 1 1 21 ASN H H -7.658 1.803 3.561 1.00 . A A . 21 ASN H 1 1 3 4065 1 1 21 ASN HA H -8.926 3.705 5.339 1.00 . A A . 21 ASN HA 1 1 3 4066 1 1 21 ASN HB2 H -10.216 1.190 4.173 1.00 . A A . 21 ASN HB2 1 1 3 4067 1 1 21 ASN HB3 H -10.826 1.960 5.624 1.00 . A A . 21 ASN HB3 1 1 3 4068 1 1 21 ASN HD21 H -10.149 2.384 2.200 1.00 . A A . 21 ASN HD21 1 1 3 4069 1 1 21 ASN HD22 H -11.269 3.670 1.892 1.00 . A A . 21 ASN HD22 1 1 3 4070 1 1 21 ASN N N -8.056 2.685 3.811 1.00 . A A . 21 ASN N 1 1 3 4071 1 1 21 ASN ND2 N -10.807 3.059 2.535 1.00 . A A . 21 ASN ND2 1 1 3 4072 1 1 21 ASN O O -7.714 0.692 5.701 1.00 . A A . 21 ASN O 1 1 3 4073 1 1 21 ASN OD1 O -11.857 3.936 4.324 1.00 . A A . 21 ASN OD1 1 1 3 4074 1 1 22 HIS C C -8.884 0.525 9.019 1.00 . A A . 22 HIS C 1 1 3 4075 1 1 22 HIS CA C -7.786 1.386 8.392 1.00 . A A . 22 HIS CA 1 1 3 4076 1 1 22 HIS CB C -7.092 2.295 9.408 1.00 . A A . 22 HIS CB 1 1 3 4077 1 1 22 HIS CD2 C -4.493 2.024 9.361 1.00 . A A . 22 HIS CD2 1 1 3 4078 1 1 22 HIS CE1 C -4.019 3.778 8.142 1.00 . A A . 22 HIS CE1 1 1 3 4079 1 1 22 HIS CG C -5.668 2.643 9.048 1.00 . A A . 22 HIS CG 1 1 3 4080 1 1 22 HIS H H -8.783 3.020 7.570 1.00 . A A . 22 HIS H 1 1 3 4081 1 1 22 HIS HA H -7.028 0.734 7.957 1.00 . A A . 22 HIS HA 1 1 3 4082 1 1 22 HIS HB2 H -7.667 3.216 9.508 1.00 . A A . 22 HIS HB2 1 1 3 4083 1 1 22 HIS HB3 H -7.101 1.807 10.382 1.00 . A A . 22 HIS HB3 1 1 3 4084 1 1 22 HIS HD1 H -5.982 4.405 7.895 1.00 . A A . 22 HIS HD1 1 1 3 4085 1 1 22 HIS HD2 H -4.389 1.119 9.959 1.00 . A A . 22 HIS HD2 1 1 3 4086 1 1 22 HIS HE1 H -3.451 4.527 7.589 1.00 . A A . 22 HIS HE1 1 1 3 4087 1 1 22 HIS N N -8.342 2.165 7.298 1.00 . A A . 22 HIS N 1 1 3 4088 1 1 22 HIS ND1 N -5.336 3.746 8.280 1.00 . A A . 22 HIS ND1 1 1 3 4089 1 1 22 HIS NE2 N -3.498 2.710 8.811 1.00 . A A . 22 HIS NE2 1 1 3 4090 1 1 22 HIS O O -8.595 -0.459 9.698 1.00 . A A . 22 HIS O 1 1 3 4091 1 1 23 SER C C -11.529 -1.049 8.462 1.00 . A A . 23 SER C 1 1 3 4092 1 1 23 SER CA C -11.265 0.204 9.300 1.00 . A A . 23 SER CA 1 1 3 4093 1 1 23 SER CB C -12.510 1.092 9.335 1.00 . A A . 23 SER CB 1 1 3 4094 1 1 23 SER H H -10.349 1.727 8.214 1.00 . A A . 23 SER H 1 1 3 4095 1 1 23 SER HA H -10.986 -0.069 10.318 1.00 . A A . 23 SER HA 1 1 3 4096 1 1 23 SER HB2 H -12.216 2.134 9.208 1.00 . A A . 23 SER HB2 1 1 3 4097 1 1 23 SER HB3 H -13.159 0.839 8.496 1.00 . A A . 23 SER HB3 1 1 3 4098 1 1 23 SER HG H -12.599 0.884 11.323 1.00 . A A . 23 SER HG 1 1 3 4099 1 1 23 SER N N -10.122 0.926 8.768 1.00 . A A . 23 SER N 1 1 3 4100 1 1 23 SER O O -12.438 -1.821 8.762 1.00 . A A . 23 SER O 1 1 3 4101 1 1 23 SER OG O -13.234 0.949 10.554 1.00 . A A . 23 SER OG 1 1 3 4102 1 1 24 THR C C -9.732 -3.366 6.804 1.00 . A A . 24 THR C 1 1 3 4103 1 1 24 THR CA C -10.852 -2.357 6.543 1.00 . A A . 24 THR CA 1 1 3 4104 1 1 24 THR CB C -10.882 -1.841 5.103 1.00 . A A . 24 THR CB 1 1 3 4105 1 1 24 THR CG2 C -11.014 -2.971 4.080 1.00 . A A . 24 THR CG2 1 1 3 4106 1 1 24 THR H H -9.980 -0.579 7.190 1.00 . A A . 24 THR H 1 1 3 4107 1 1 24 THR HA H -11.793 -2.857 6.771 1.00 . A A . 24 THR HA 1 1 3 4108 1 1 24 THR HB H -10.009 -1.224 4.892 1.00 . A A . 24 THR HB 1 1 3 4109 1 1 24 THR HG1 H -12.118 -0.359 5.632 1.00 . A A . 24 THR HG1 1 1 3 4110 1 1 24 THR HG21 H -10.401 -3.816 4.391 1.00 . A A . 24 THR HG21 1 1 3 4111 1 1 24 THR HG22 H -12.057 -3.282 4.015 1.00 . A A . 24 THR HG22 1 1 3 4112 1 1 24 THR HG23 H -10.679 -2.618 3.104 1.00 . A A . 24 THR HG23 1 1 3 4113 1 1 24 THR N N -10.717 -1.211 7.427 1.00 . A A . 24 THR N 1 1 3 4114 1 1 24 THR O O -9.951 -4.574 6.729 1.00 . A A . 24 THR O 1 1 3 4115 1 1 24 THR OG1 O -12.120 -1.142 5.010 1.00 . A A . 24 THR OG1 1 1 3 4116 1 1 25 HIS C C -7.234 -3.839 8.889 1.00 . A A . 25 HIS C 1 1 3 4117 1 1 25 HIS CA C -7.403 -3.673 7.377 1.00 . A A . 25 HIS CA 1 1 3 4118 1 1 25 HIS CB C -6.151 -3.112 6.699 1.00 . A A . 25 HIS CB 1 1 3 4119 1 1 25 HIS CD2 C -5.778 -3.735 4.188 1.00 . A A . 25 HIS CD2 1 1 3 4120 1 1 25 HIS CE1 C -6.907 -2.091 3.288 1.00 . A A . 25 HIS CE1 1 1 3 4121 1 1 25 HIS CG C -6.277 -2.970 5.201 1.00 . A A . 25 HIS CG 1 1 3 4122 1 1 25 HIS H H -8.388 -1.850 7.165 1.00 . A A . 25 HIS H 1 1 3 4123 1 1 25 HIS HA H -7.613 -4.647 6.934 1.00 . A A . 25 HIS HA 1 1 3 4124 1 1 25 HIS HB2 H -5.924 -2.137 7.128 1.00 . A A . 25 HIS HB2 1 1 3 4125 1 1 25 HIS HB3 H -5.307 -3.764 6.922 1.00 . A A . 25 HIS HB3 1 1 3 4126 1 1 25 HIS HD1 H -7.468 -1.209 5.080 1.00 . A A . 25 HIS HD1 1 1 3 4127 1 1 25 HIS HD2 H -5.169 -4.631 4.307 1.00 . A A . 25 HIS HD2 1 1 3 4128 1 1 25 HIS HE1 H -7.361 -1.440 2.541 1.00 . A A . 25 HIS HE1 1 1 3 4129 1 1 25 HIS N N -8.557 -2.834 7.105 1.00 . A A . 25 HIS N 1 1 3 4130 1 1 25 HIS ND1 N -6.983 -1.941 4.602 1.00 . A A . 25 HIS ND1 1 1 3 4131 1 1 25 HIS NE2 N -6.160 -3.204 3.033 1.00 . A A . 25 HIS NE2 1 1 3 4132 1 1 25 HIS O O -6.112 -3.942 9.384 1.00 . A A . 25 HIS O 1 1 3 4133 1 1 26 LYS C C -7.814 -5.398 11.384 1.00 . A A . 26 LYS C 1 1 3 4134 1 1 26 LYS CA C -8.355 -4.013 11.024 1.00 . A A . 26 LYS CA 1 1 3 4135 1 1 26 LYS CB C -9.743 -3.726 11.602 1.00 . A A . 26 LYS CB 1 1 3 4136 1 1 26 LYS CD C -11.649 -2.078 11.709 1.00 . A A . 26 LYS CD 1 1 3 4137 1 1 26 LYS CE C -11.563 -1.283 13.014 1.00 . A A . 26 LYS CE 1 1 3 4138 1 1 26 LYS CG C -10.254 -2.358 11.145 1.00 . A A . 26 LYS CG 1 1 3 4139 1 1 26 LYS H H -9.272 -3.777 9.169 1.00 . A A . 26 LYS H 1 1 3 4140 1 1 26 LYS HA H -7.677 -3.261 11.428 1.00 . A A . 26 LYS HA 1 1 3 4141 1 1 26 LYS HB2 H -10.440 -4.502 11.287 1.00 . A A . 26 LYS HB2 1 1 3 4142 1 1 26 LYS HB3 H -9.701 -3.758 12.691 1.00 . A A . 26 LYS HB3 1 1 3 4143 1 1 26 LYS HD2 H -12.236 -1.522 10.978 1.00 . A A . 26 LYS HD2 1 1 3 4144 1 1 26 LYS HD3 H -12.169 -3.019 11.887 1.00 . A A . 26 LYS HD3 1 1 3 4145 1 1 26 LYS HE2 H -10.519 -1.135 13.288 1.00 . A A . 26 LYS HE2 1 1 3 4146 1 1 26 LYS HE3 H -11.999 -0.294 12.873 1.00 . A A . 26 LYS HE3 1 1 3 4147 1 1 26 LYS HG2 H -9.564 -1.580 11.471 1.00 . A A . 26 LYS HG2 1 1 3 4148 1 1 26 LYS HG3 H -10.285 -2.322 10.056 1.00 . A A . 26 LYS HG3 1 1 3 4149 1 1 26 LYS HZ1 H -13.112 -1.503 14.391 1.00 . A A . 26 LYS HZ1 1 1 3 4150 1 1 26 LYS HZ2 H -12.559 -2.925 13.823 1.00 . A A . 26 LYS HZ2 1 1 3 4151 1 1 26 LYS N N -8.364 -3.861 9.579 1.00 . A A . 26 LYS N 1 1 3 4152 1 1 26 LYS NZ N -12.273 -1.993 14.101 1.00 . A A . 26 LYS NZ 1 1 3 4153 1 1 26 LYS O O -7.034 -5.538 12.325 1.00 . A A . 26 LYS O 1 1 3 4154 1 1 27 SER C C -6.343 -7.908 10.467 1.00 . A A . 27 SER C 1 1 3 4155 1 1 27 SER CA C -7.818 -7.755 10.843 1.00 . A A . 27 SER CA 1 1 3 4156 1 1 27 SER CB C -8.675 -8.741 10.046 1.00 . A A . 27 SER CB 1 1 3 4157 1 1 27 SER H H -8.883 -6.263 9.853 1.00 . A A . 27 SER H 1 1 3 4158 1 1 27 SER HA H -7.961 -7.930 11.909 1.00 . A A . 27 SER HA 1 1 3 4159 1 1 27 SER HB2 H -8.498 -9.752 10.411 1.00 . A A . 27 SER HB2 1 1 3 4160 1 1 27 SER HB3 H -9.729 -8.522 10.212 1.00 . A A . 27 SER HB3 1 1 3 4161 1 1 27 SER HG H -7.787 -9.437 8.393 1.00 . A A . 27 SER HG 1 1 3 4162 1 1 27 SER N N -8.249 -6.386 10.616 1.00 . A A . 27 SER N 1 1 3 4163 1 1 27 SER O O -5.702 -8.888 10.842 1.00 . A A . 27 SER O 1 1 3 4164 1 1 27 SER OG O -8.394 -8.685 8.650 1.00 . A A . 27 SER OG 1 1 3 4165 1 1 28 VAL C C -3.583 -6.342 10.399 1.00 . A A . 28 VAL C 1 1 3 4166 1 1 28 VAL CA C -4.461 -6.939 9.297 1.00 . A A . 28 VAL CA 1 1 3 4167 1 1 28 VAL CB C -4.322 -6.208 7.960 1.00 . A A . 28 VAL CB 1 1 3 4168 1 1 28 VAL CG1 C -2.897 -6.328 7.416 1.00 . A A . 28 VAL CG1 1 1 3 4169 1 1 28 VAL CG2 C -5.343 -6.725 6.944 1.00 . A A . 28 VAL CG2 1 1 3 4170 1 1 28 VAL H H -6.377 -6.131 9.428 1.00 . A A . 28 VAL H 1 1 3 4171 1 1 28 VAL HA H -4.174 -7.979 9.145 1.00 . A A . 28 VAL HA 1 1 3 4172 1 1 28 VAL HB H -4.527 -5.151 8.133 1.00 . A A . 28 VAL HB 1 1 3 4173 1 1 28 VAL HG11 H -2.533 -7.344 7.571 1.00 . A A . 28 VAL HG11 1 1 3 4174 1 1 28 VAL HG12 H -2.895 -6.101 6.350 1.00 . A A . 28 VAL HG12 1 1 3 4175 1 1 28 VAL HG13 H -2.248 -5.625 7.938 1.00 . A A . 28 VAL HG13 1 1 3 4176 1 1 28 VAL HG21 H -5.384 -7.813 6.992 1.00 . A A . 28 VAL HG21 1 1 3 4177 1 1 28 VAL HG22 H -6.325 -6.313 7.175 1.00 . A A . 28 VAL HG22 1 1 3 4178 1 1 28 VAL HG23 H -5.046 -6.416 5.942 1.00 . A A . 28 VAL HG23 1 1 3 4179 1 1 28 VAL N N -5.848 -6.925 9.729 1.00 . A A . 28 VAL N 1 1 3 4180 1 1 28 VAL O O -3.970 -5.372 11.049 1.00 . A A . 28 VAL O 1 1 3 4181 1 1 29 LYS C C -0.872 -5.155 11.145 1.00 . A A . 29 LYS C 1 1 3 4182 1 1 29 LYS CA C -1.481 -6.487 11.587 1.00 . A A . 29 LYS CA 1 1 3 4183 1 1 29 LYS CB C -0.441 -7.570 11.885 1.00 . A A . 29 LYS CB 1 1 3 4184 1 1 29 LYS CD C 0.302 -9.269 13.594 1.00 . A A . 29 LYS CD 1 1 3 4185 1 1 29 LYS CE C -0.470 -10.221 14.509 1.00 . A A . 29 LYS CE 1 1 3 4186 1 1 29 LYS CG C -0.482 -7.977 13.360 1.00 . A A . 29 LYS CG 1 1 3 4187 1 1 29 LYS H H -2.110 -7.735 10.041 1.00 . A A . 29 LYS H 1 1 3 4188 1 1 29 LYS HA H -2.046 -6.322 12.504 1.00 . A A . 29 LYS HA 1 1 3 4189 1 1 29 LYS HB2 H -0.628 -8.441 11.259 1.00 . A A . 29 LYS HB2 1 1 3 4190 1 1 29 LYS HB3 H 0.553 -7.203 11.633 1.00 . A A . 29 LYS HB3 1 1 3 4191 1 1 29 LYS HD2 H 0.500 -9.757 12.639 1.00 . A A . 29 LYS HD2 1 1 3 4192 1 1 29 LYS HD3 H 1.270 -9.036 14.038 1.00 . A A . 29 LYS HD3 1 1 3 4193 1 1 29 LYS HE2 H -1.493 -9.867 14.632 1.00 . A A . 29 LYS HE2 1 1 3 4194 1 1 29 LYS HE3 H -0.527 -11.209 14.051 1.00 . A A . 29 LYS HE3 1 1 3 4195 1 1 29 LYS HG2 H -0.065 -7.178 13.973 1.00 . A A . 29 LYS HG2 1 1 3 4196 1 1 29 LYS HG3 H -1.517 -8.113 13.675 1.00 . A A . 29 LYS HG3 1 1 3 4197 1 1 29 LYS HZ1 H 0.538 -11.253 16.013 1.00 . A A . 29 LYS HZ1 1 1 3 4198 1 1 29 LYS HZ2 H 0.981 -9.690 15.907 1.00 . A A . 29 LYS HZ2 1 1 3 4199 1 1 29 LYS N N -2.417 -6.946 10.575 1.00 . A A . 29 LYS N 1 1 3 4200 1 1 29 LYS NZ N 0.189 -10.319 15.830 1.00 . A A . 29 LYS NZ 1 1 3 4201 1 1 29 LYS O O -0.546 -4.976 9.972 1.00 . A A . 29 LYS O 1 1 3 4202 1 1 30 CYS C C 1.267 -3.132 11.351 1.00 . A A . 30 CYS C 1 1 3 4203 1 1 30 CYS CA C -0.174 -2.944 11.832 1.00 . A A . 30 CYS CA 1 1 3 4204 1 1 30 CYS CB C -0.252 -2.026 13.054 1.00 . A A . 30 CYS CB 1 1 3 4205 1 1 30 CYS H H -1.005 -4.408 13.058 1.00 . A A . 30 CYS H 1 1 3 4206 1 1 30 CYS HA H -0.787 -2.497 11.050 1.00 . A A . 30 CYS HA 1 1 3 4207 1 1 30 CYS HB2 H 0.570 -2.270 13.727 1.00 . A A . 30 CYS HB2 1 1 3 4208 1 1 30 CYS HB3 H -0.103 -0.997 12.728 1.00 . A A . 30 CYS HB3 1 1 3 4209 1 1 30 CYS N N -0.737 -4.254 12.107 1.00 . A A . 30 CYS N 1 1 3 4210 1 1 30 CYS O O 1.789 -2.305 10.605 1.00 . A A . 30 CYS O 1 1 3 4211 1 1 30 CYS SG S -1.823 -2.124 13.987 1.00 . A A . 30 CYS SG 1 1 3 4212 1 1 31 GLY C C 3.294 -5.201 10.049 1.00 . A A . 31 GLY C 1 1 3 4213 1 1 31 GLY CA C 3.238 -4.530 11.424 1.00 . A A . 31 GLY CA 1 1 3 4214 1 1 31 GLY H H 1.437 -4.891 12.405 1.00 . A A . 31 GLY H 1 1 3 4215 1 1 31 GLY HA2 H 3.829 -3.615 11.409 1.00 . A A . 31 GLY HA2 1 1 3 4216 1 1 31 GLY HA3 H 3.685 -5.187 12.170 1.00 . A A . 31 GLY HA3 1 1 3 4217 1 1 31 GLY N N 1.869 -4.224 11.799 1.00 . A A . 31 GLY N 1 1 3 4218 1 1 31 GLY O O 4.374 -5.513 9.550 1.00 . A A . 31 GLY O 1 1 3 4219 1 1 32 ASP C C 2.246 -4.978 7.084 1.00 . A A . 32 ASP C 1 1 3 4220 1 1 32 ASP CA C 2.017 -6.031 8.170 1.00 . A A . 32 ASP CA 1 1 3 4221 1 1 32 ASP CB C 0.629 -6.638 7.955 1.00 . A A . 32 ASP CB 1 1 3 4222 1 1 32 ASP CG C 0.519 -7.594 6.766 1.00 . A A . 32 ASP CG 1 1 3 4223 1 1 32 ASP H H 1.242 -5.146 9.890 1.00 . A A . 32 ASP H 1 1 3 4224 1 1 32 ASP HA H 2.782 -6.807 8.167 1.00 . A A . 32 ASP HA 1 1 3 4225 1 1 32 ASP HB2 H 0.338 -7.172 8.860 1.00 . A A . 32 ASP HB2 1 1 3 4226 1 1 32 ASP HB3 H -0.088 -5.828 7.819 1.00 . A A . 32 ASP HB3 1 1 3 4227 1 1 32 ASP N N 2.116 -5.403 9.477 1.00 . A A . 32 ASP N 1 1 3 4228 1 1 32 ASP O O 2.784 -5.284 6.022 1.00 . A A . 32 ASP O 1 1 3 4229 1 1 32 ASP OD1 O 1.068 -7.239 5.700 1.00 . A A . 32 ASP OD1 1 1 3 4230 1 1 32 ASP OD2 O -0.112 -8.657 6.949 1.00 . A A . 32 ASP OD2 1 1 3 4231 1 1 33 CYS C C 3.122 -1.767 6.940 1.00 . A A . 33 CYS C 1 1 3 4232 1 1 33 CYS CA C 1.979 -2.659 6.452 1.00 . A A . 33 CYS CA 1 1 3 4233 1 1 33 CYS CB C 0.676 -1.875 6.283 1.00 . A A . 33 CYS CB 1 1 3 4234 1 1 33 CYS H H 1.390 -3.518 8.256 1.00 . A A . 33 CYS H 1 1 3 4235 1 1 33 CYS HA H 2.219 -3.102 5.486 1.00 . A A . 33 CYS HA 1 1 3 4236 1 1 33 CYS HB2 H 0.094 -1.918 7.203 1.00 . A A . 33 CYS HB2 1 1 3 4237 1 1 33 CYS HB3 H 0.896 -0.824 6.093 1.00 . A A . 33 CYS HB3 1 1 3 4238 1 1 33 CYS N N 1.826 -3.759 7.389 1.00 . A A . 33 CYS N 1 1 3 4239 1 1 33 CYS O O 4.077 -1.517 6.206 1.00 . A A . 33 CYS O 1 1 3 4240 1 1 33 CYS SG S -0.297 -2.569 4.897 1.00 . A A . 33 CYS SG 1 1 3 4241 1 1 34 HIS C C 5.216 -1.288 9.165 1.00 . A A . 34 HIS C 1 1 3 4242 1 1 34 HIS CA C 3.997 -0.451 8.771 1.00 . A A . 34 HIS CA 1 1 3 4243 1 1 34 HIS CB C 3.416 0.338 9.946 1.00 . A A . 34 HIS CB 1 1 3 4244 1 1 34 HIS CD2 C 0.911 1.035 9.675 1.00 . A A . 34 HIS CD2 1 1 3 4245 1 1 34 HIS CE1 C 1.231 3.017 8.806 1.00 . A A . 34 HIS CE1 1 1 3 4246 1 1 34 HIS CG C 2.257 1.231 9.572 1.00 . A A . 34 HIS CG 1 1 3 4247 1 1 34 HIS H H 2.208 -1.518 8.768 1.00 . A A . 34 HIS H 1 1 3 4248 1 1 34 HIS HA H 4.291 0.264 8.003 1.00 . A A . 34 HIS HA 1 1 3 4249 1 1 34 HIS HB2 H 3.088 -0.362 10.714 1.00 . A A . 34 HIS HB2 1 1 3 4250 1 1 34 HIS HB3 H 4.204 0.949 10.386 1.00 . A A . 34 HIS HB3 1 1 3 4251 1 1 34 HIS HD1 H 3.303 2.926 8.819 1.00 . A A . 34 HIS HD1 1 1 3 4252 1 1 34 HIS HD2 H 0.426 0.142 10.069 1.00 . A A . 34 HIS HD2 1 1 3 4253 1 1 34 HIS HE1 H 1.031 4.000 8.380 1.00 . A A . 34 HIS HE1 1 1 3 4254 1 1 34 HIS N N 2.987 -1.310 8.177 1.00 . A A . 34 HIS N 1 1 3 4255 1 1 34 HIS ND1 N 2.427 2.489 9.021 1.00 . A A . 34 HIS ND1 1 1 3 4256 1 1 34 HIS NE2 N 0.292 2.114 9.213 1.00 . A A . 34 HIS NE2 1 1 3 4257 1 1 34 HIS O O 5.618 -1.297 10.327 1.00 . A A . 34 HIS O 1 1 3 4258 1 1 35 HIS C C 7.898 -2.101 9.356 1.00 . A A . 35 HIS C 1 1 3 4259 1 1 35 HIS CA C 6.934 -2.809 8.402 1.00 . A A . 35 HIS CA 1 1 3 4260 1 1 35 HIS CB C 7.592 -3.198 7.077 1.00 . A A . 35 HIS CB 1 1 3 4261 1 1 35 HIS CD2 C 7.762 -1.406 5.182 1.00 . A A . 35 HIS CD2 1 1 3 4262 1 1 35 HIS CE1 C 9.594 -0.415 5.853 1.00 . A A . 35 HIS CE1 1 1 3 4263 1 1 35 HIS CG C 8.181 -2.033 6.318 1.00 . A A . 35 HIS CG 1 1 3 4264 1 1 35 HIS H H 5.437 -1.958 7.231 1.00 . A A . 35 HIS H 1 1 3 4265 1 1 35 HIS HA H 6.574 -3.723 8.875 1.00 . A A . 35 HIS HA 1 1 3 4266 1 1 35 HIS HB2 H 8.379 -3.926 7.273 1.00 . A A . 35 HIS HB2 1 1 3 4267 1 1 35 HIS HB3 H 6.852 -3.692 6.447 1.00 . A A . 35 HIS HB3 1 1 3 4268 1 1 35 HIS HD1 H 9.887 -1.614 7.521 1.00 . A A . 35 HIS HD1 1 1 3 4269 1 1 35 HIS HD2 H 6.877 -1.664 4.601 1.00 . A A . 35 HIS HD2 1 1 3 4270 1 1 35 HIS HE1 H 10.438 0.273 5.895 1.00 . A A . 35 HIS HE1 1 1 3 4271 1 1 35 HIS N N 5.770 -1.971 8.174 1.00 . A A . 35 HIS N 1 1 3 4272 1 1 35 HIS ND1 N 9.338 -1.387 6.717 1.00 . A A . 35 HIS ND1 1 1 3 4273 1 1 35 HIS NE2 N 8.616 -0.428 4.903 1.00 . A A . 35 HIS NE2 1 1 3 4274 1 1 35 HIS O O 7.976 -0.873 9.367 1.00 . A A . 35 HIS O 1 1 3 4275 1 1 36 PRO C C 10.847 -1.902 10.406 1.00 . A A . 36 PRO C 1 1 3 4276 1 1 36 PRO CA C 9.580 -2.392 11.112 1.00 . A A . 36 PRO CA 1 1 3 4277 1 1 36 PRO CB C 9.845 -3.531 12.082 1.00 . A A . 36 PRO CB 1 1 3 4278 1 1 36 PRO CD C 8.559 -4.385 10.170 1.00 . A A . 36 PRO CD 1 1 3 4279 1 1 36 PRO CG C 9.392 -4.797 11.373 1.00 . A A . 36 PRO CG 1 1 3 4280 1 1 36 PRO HA H 9.198 -1.592 11.574 1.00 . A A . 36 PRO HA 1 1 3 4281 1 1 36 PRO HB2 H 10.902 -3.586 12.342 1.00 . A A . 36 PRO HB2 1 1 3 4282 1 1 36 PRO HB3 H 9.295 -3.387 13.013 1.00 . A A . 36 PRO HB3 1 1 3 4283 1 1 36 PRO HD2 H 8.957 -4.808 9.248 1.00 . A A . 36 PRO HD2 1 1 3 4284 1 1 36 PRO HD3 H 7.530 -4.733 10.263 1.00 . A A . 36 PRO HD3 1 1 3 4285 1 1 36 PRO HG2 H 10.253 -5.386 11.057 1.00 . A A . 36 PRO HG2 1 1 3 4286 1 1 36 PRO HG3 H 8.807 -5.423 12.046 1.00 . A A . 36 PRO HG3 1 1 3 4287 1 1 36 PRO N N 8.625 -2.926 10.156 1.00 . A A . 36 PRO N 1 1 3 4288 1 1 36 PRO O O 11.584 -2.695 9.824 1.00 . A A . 36 PRO O 1 1 3 4289 1 1 37 VAL C C 13.417 -0.088 10.809 1.00 . A A . 37 VAL C 1 1 3 4290 1 1 37 VAL CA C 12.223 0.010 9.856 1.00 . A A . 37 VAL CA 1 1 3 4291 1 1 37 VAL CB C 11.906 1.448 9.441 1.00 . A A . 37 VAL CB 1 1 3 4292 1 1 37 VAL CG1 C 13.186 2.220 9.116 1.00 . A A . 37 VAL CG1 1 1 3 4293 1 1 37 VAL CG2 C 10.933 1.476 8.261 1.00 . A A . 37 VAL CG2 1 1 3 4294 1 1 37 VAL H H 10.454 0.043 10.956 1.00 . A A . 37 VAL H 1 1 3 4295 1 1 37 VAL HA H 12.446 -0.560 8.954 1.00 . A A . 37 VAL HA 1 1 3 4296 1 1 37 VAL HB H 11.422 1.941 10.285 1.00 . A A . 37 VAL HB 1 1 3 4297 1 1 37 VAL HG11 H 13.857 2.189 9.975 1.00 . A A . 37 VAL HG11 1 1 3 4298 1 1 37 VAL HG12 H 13.676 1.765 8.255 1.00 . A A . 37 VAL HG12 1 1 3 4299 1 1 37 VAL HG13 H 12.937 3.256 8.887 1.00 . A A . 37 VAL HG13 1 1 3 4300 1 1 37 VAL HG21 H 10.139 0.748 8.426 1.00 . A A . 37 VAL HG21 1 1 3 4301 1 1 37 VAL HG22 H 10.500 2.472 8.171 1.00 . A A . 37 VAL HG22 1 1 3 4302 1 1 37 VAL HG23 H 11.468 1.229 7.344 1.00 . A A . 37 VAL HG23 1 1 3 4303 1 1 37 VAL N N 11.059 -0.596 10.481 1.00 . A A . 37 VAL N 1 1 3 4304 1 1 37 VAL O O 14.361 -0.834 10.552 1.00 . A A . 37 VAL O 1 1 3 4305 1 1 38 ASN C C 14.053 -0.302 13.998 1.00 . A A . 38 ASN C 1 1 3 4306 1 1 38 ASN CA C 14.397 0.684 12.880 1.00 . A A . 38 ASN CA 1 1 3 4307 1 1 38 ASN CB C 14.555 2.071 13.506 1.00 . A A . 38 ASN CB 1 1 3 4308 1 1 38 ASN CG C 15.994 2.573 13.372 1.00 . A A . 38 ASN CG 1 1 3 4309 1 1 38 ASN H H 12.564 1.279 12.090 1.00 . A A . 38 ASN H 1 1 3 4310 1 1 38 ASN HA H 15.299 0.401 12.337 1.00 . A A . 38 ASN HA 1 1 3 4311 1 1 38 ASN HB2 H 13.875 2.772 13.021 1.00 . A A . 38 ASN HB2 1 1 3 4312 1 1 38 ASN HB3 H 14.276 2.033 14.559 1.00 . A A . 38 ASN HB3 1 1 3 4313 1 1 38 ASN HD21 H 15.615 2.999 11.429 1.00 . A A . 38 ASN HD21 1 1 3 4314 1 1 38 ASN HD22 H 17.220 3.364 11.968 1.00 . A A . 38 ASN HD22 1 1 3 4315 1 1 38 ASN N N 13.335 0.675 11.888 1.00 . A A . 38 ASN N 1 1 3 4316 1 1 38 ASN ND2 N 16.302 3.015 12.156 1.00 . A A . 38 ASN ND2 1 1 3 4317 1 1 38 ASN O O 14.412 -0.085 15.154 1.00 . A A . 38 ASN O 1 1 3 4318 1 1 38 ASN OD1 O 16.774 2.559 14.310 1.00 . A A . 38 ASN OD1 1 1 3 4319 1 1 39 GLY C C 11.689 -1.978 15.308 1.00 . A A . 39 GLY C 1 1 3 4320 1 1 39 GLY CA C 12.965 -2.385 14.569 1.00 . A A . 39 GLY CA 1 1 3 4321 1 1 39 GLY H H 13.074 -1.535 12.671 1.00 . A A . 39 GLY H 1 1 3 4322 1 1 39 GLY HA2 H 12.804 -3.331 14.051 1.00 . A A . 39 GLY HA2 1 1 3 4323 1 1 39 GLY HA3 H 13.769 -2.549 15.287 1.00 . A A . 39 GLY HA3 1 1 3 4324 1 1 39 GLY N N 13.362 -1.365 13.614 1.00 . A A . 39 GLY N 1 1 3 4325 1 1 39 GLY O O 11.201 -2.715 16.163 1.00 . A A . 39 GLY O 1 1 3 4326 1 1 40 LYS C C 8.885 -0.148 14.506 1.00 . A A . 40 LYS C 1 1 3 4327 1 1 40 LYS CA C 9.975 -0.292 15.570 1.00 . A A . 40 LYS CA 1 1 3 4328 1 1 40 LYS CB C 10.270 1.005 16.327 1.00 . A A . 40 LYS CB 1 1 3 4329 1 1 40 LYS CD C 11.549 3.128 15.858 1.00 . A A . 40 LYS CD 1 1 3 4330 1 1 40 LYS CE C 11.318 4.546 15.331 1.00 . A A . 40 LYS CE 1 1 3 4331 1 1 40 LYS CG C 10.462 2.174 15.358 1.00 . A A . 40 LYS CG 1 1 3 4332 1 1 40 LYS H H 11.589 -0.213 14.254 1.00 . A A . 40 LYS H 1 1 3 4333 1 1 40 LYS HA H 9.647 -1.026 16.305 1.00 . A A . 40 LYS HA 1 1 3 4334 1 1 40 LYS HB2 H 9.451 1.226 17.011 1.00 . A A . 40 LYS HB2 1 1 3 4335 1 1 40 LYS HB3 H 11.167 0.880 16.934 1.00 . A A . 40 LYS HB3 1 1 3 4336 1 1 40 LYS HD2 H 11.556 3.137 16.948 1.00 . A A . 40 LYS HD2 1 1 3 4337 1 1 40 LYS HD3 H 12.527 2.771 15.535 1.00 . A A . 40 LYS HD3 1 1 3 4338 1 1 40 LYS HE2 H 11.204 4.523 14.248 1.00 . A A . 40 LYS HE2 1 1 3 4339 1 1 40 LYS HE3 H 10.391 4.946 15.741 1.00 . A A . 40 LYS HE3 1 1 3 4340 1 1 40 LYS HG2 H 10.732 1.793 14.373 1.00 . A A . 40 LYS HG2 1 1 3 4341 1 1 40 LYS HG3 H 9.522 2.715 15.244 1.00 . A A . 40 LYS HG3 1 1 3 4342 1 1 40 LYS HZ1 H 13.008 5.683 14.892 1.00 . A A . 40 LYS HZ1 1 1 3 4343 1 1 40 LYS HZ2 H 12.137 6.289 16.127 1.00 . A A . 40 LYS HZ2 1 1 3 4344 1 1 40 LYS N N 11.185 -0.806 14.951 1.00 . A A . 40 LYS N 1 1 3 4345 1 1 40 LYS NZ N 12.450 5.425 15.699 1.00 . A A . 40 LYS NZ 1 1 3 4346 1 1 40 LYS O O 9.171 0.203 13.363 1.00 . A A . 40 LYS O 1 1 3 4347 1 1 41 GLU C C 5.823 1.015 14.182 1.00 . A A . 41 GLU C 1 1 3 4348 1 1 41 GLU CA C 6.523 -0.336 14.018 1.00 . A A . 41 GLU CA 1 1 3 4349 1 1 41 GLU CB C 5.546 -1.491 14.245 1.00 . A A . 41 GLU CB 1 1 3 4350 1 1 41 GLU CD C 5.879 -3.991 14.223 1.00 . A A . 41 GLU CD 1 1 3 4351 1 1 41 GLU CG C 5.926 -2.705 13.395 1.00 . A A . 41 GLU CG 1 1 3 4352 1 1 41 GLU H H 7.434 -0.713 15.853 1.00 . A A . 41 GLU H 1 1 3 4353 1 1 41 GLU HA H 6.944 -0.415 13.015 1.00 . A A . 41 GLU HA 1 1 3 4354 1 1 41 GLU HB2 H 5.543 -1.767 15.299 1.00 . A A . 41 GLU HB2 1 1 3 4355 1 1 41 GLU HB3 H 4.535 -1.171 13.996 1.00 . A A . 41 GLU HB3 1 1 3 4356 1 1 41 GLU HG2 H 5.245 -2.788 12.548 1.00 . A A . 41 GLU HG2 1 1 3 4357 1 1 41 GLU HG3 H 6.927 -2.568 12.986 1.00 . A A . 41 GLU HG3 1 1 3 4358 1 1 41 GLU N N 7.658 -0.428 14.921 1.00 . A A . 41 GLU N 1 1 3 4359 1 1 41 GLU O O 4.710 1.082 14.701 1.00 . A A . 41 GLU O 1 1 3 4360 1 1 41 GLU OE1 O 6.641 -4.058 15.211 1.00 . A A . 41 GLU OE1 1 1 3 4361 1 1 41 GLU OE2 O 5.081 -4.877 13.849 1.00 . A A . 41 GLU OE2 1 1 3 4362 1 1 42 ASP C C 4.872 3.580 12.761 1.00 . A A . 42 ASP C 1 1 3 4363 1 1 42 ASP CA C 5.962 3.402 13.820 1.00 . A A . 42 ASP CA 1 1 3 4364 1 1 42 ASP CB C 7.045 4.452 13.564 1.00 . A A . 42 ASP CB 1 1 3 4365 1 1 42 ASP CG C 7.967 4.155 12.380 1.00 . A A . 42 ASP CG 1 1 3 4366 1 1 42 ASP H H 7.409 1.994 13.308 1.00 . A A . 42 ASP H 1 1 3 4367 1 1 42 ASP HA H 5.575 3.487 14.835 1.00 . A A . 42 ASP HA 1 1 3 4368 1 1 42 ASP HB2 H 6.564 5.416 13.398 1.00 . A A . 42 ASP HB2 1 1 3 4369 1 1 42 ASP HB3 H 7.654 4.550 14.463 1.00 . A A . 42 ASP HB3 1 1 3 4370 1 1 42 ASP N N 6.504 2.057 13.729 1.00 . A A . 42 ASP N 1 1 3 4371 1 1 42 ASP O O 4.965 3.022 11.669 1.00 . A A . 42 ASP O 1 1 3 4372 1 1 42 ASP OD1 O 8.843 3.279 12.548 1.00 . A A . 42 ASP OD1 1 1 3 4373 1 1 42 ASP OD2 O 7.774 4.809 11.332 1.00 . A A . 42 ASP OD2 1 1 3 4374 1 1 43 TYR C C 2.967 5.928 11.452 1.00 . A A . 43 TYR C 1 1 3 4375 1 1 43 TYR CA C 2.757 4.619 12.216 1.00 . A A . 43 TYR CA 1 1 3 4376 1 1 43 TYR CB C 1.513 4.750 13.097 1.00 . A A . 43 TYR CB 1 1 3 4377 1 1 43 TYR CD1 C 1.870 2.317 13.654 1.00 . A A . 43 TYR CD1 1 1 3 4378 1 1 43 TYR CD2 C 0.179 3.516 14.845 1.00 . A A . 43 TYR CD2 1 1 3 4379 1 1 43 TYR CE1 C 1.553 1.128 14.402 1.00 . A A . 43 TYR CE1 1 1 3 4380 1 1 43 TYR CE2 C -0.138 2.327 15.592 1.00 . A A . 43 TYR CE2 1 1 3 4381 1 1 43 TYR CG C 1.176 3.487 13.891 1.00 . A A . 43 TYR CG 1 1 3 4382 1 1 43 TYR CZ C 0.565 1.191 15.334 1.00 . A A . 43 TYR CZ 1 1 3 4383 1 1 43 TYR H H 3.795 4.811 14.011 1.00 . A A . 43 TYR H 1 1 3 4384 1 1 43 TYR HA H 2.706 3.795 11.504 1.00 . A A . 43 TYR HA 1 1 3 4385 1 1 43 TYR HB2 H 1.659 5.576 13.793 1.00 . A A . 43 TYR HB2 1 1 3 4386 1 1 43 TYR HB3 H 0.661 5.010 12.469 1.00 . A A . 43 TYR HB3 1 1 3 4387 1 1 43 TYR HD1 H 2.658 2.294 12.901 1.00 . A A . 43 TYR HD1 1 1 3 4388 1 1 43 TYR HD2 H -0.369 4.440 15.032 1.00 . A A . 43 TYR HD2 1 1 3 4389 1 1 43 TYR HE1 H 2.093 0.198 14.225 1.00 . A A . 43 TYR HE1 1 1 3 4390 1 1 43 TYR HE2 H -0.923 2.336 16.348 1.00 . A A . 43 TYR HE2 1 1 3 4391 1 1 43 TYR HH H -0.364 -0.507 15.517 1.00 . A A . 43 TYR HH 1 1 3 4392 1 1 43 TYR N N 3.863 4.360 13.121 1.00 . A A . 43 TYR N 1 1 3 4393 1 1 43 TYR O O 2.502 6.982 11.881 1.00 . A A . 43 TYR O 1 1 3 4394 1 1 43 TYR OH O 0.266 0.068 16.040 1.00 . A A . 43 TYR OH 1 1 3 4395 1 1 44 ARG C C 3.435 6.750 8.082 1.00 . A A . 44 ARG C 1 1 3 4396 1 1 44 ARG CA C 3.946 6.978 9.506 1.00 . A A . 44 ARG CA 1 1 3 4397 1 1 44 ARG CB C 5.446 7.276 9.461 1.00 . A A . 44 ARG CB 1 1 3 4398 1 1 44 ARG CD C 7.241 8.796 10.372 1.00 . A A . 44 ARG CD 1 1 3 4399 1 1 44 ARG CG C 5.750 8.652 10.058 1.00 . A A . 44 ARG CG 1 1 3 4400 1 1 44 ARG CZ C 8.524 9.124 12.493 1.00 . A A . 44 ARG CZ 1 1 3 4401 1 1 44 ARG H H 4.043 4.955 9.991 1.00 . A A . 44 ARG H 1 1 3 4402 1 1 44 ARG HA H 3.412 7.798 9.988 1.00 . A A . 44 ARG HA 1 1 3 4403 1 1 44 ARG HB2 H 5.990 6.508 10.012 1.00 . A A . 44 ARG HB2 1 1 3 4404 1 1 44 ARG HB3 H 5.797 7.237 8.430 1.00 . A A . 44 ARG HB3 1 1 3 4405 1 1 44 ARG HD2 H 7.813 8.062 9.804 1.00 . A A . 44 ARG HD2 1 1 3 4406 1 1 44 ARG HD3 H 7.592 9.781 10.065 1.00 . A A . 44 ARG HD3 1 1 3 4407 1 1 44 ARG HE H 6.812 8.059 12.334 1.00 . A A . 44 ARG HE 1 1 3 4408 1 1 44 ARG HG2 H 5.445 9.431 9.359 1.00 . A A . 44 ARG HG2 1 1 3 4409 1 1 44 ARG HG3 H 5.168 8.794 10.968 1.00 . A A . 44 ARG HG3 1 1 3 4410 1 1 44 ARG HH11 H 9.358 10.042 10.870 1.00 . A A . 44 ARG HH11 1 1 3 4411 1 1 44 ARG HH12 H 10.222 10.250 12.356 1.00 . A A . 44 ARG HH12 1 1 3 4412 1 1 44 ARG HH21 H 9.378 9.237 14.357 1.00 . A A . 44 ARG HH21 1 1 3 4413 1 1 44 ARG N N 3.668 5.817 10.334 1.00 . A A . 44 ARG N 1 1 3 4414 1 1 44 ARG NE N 7.474 8.606 11.821 1.00 . A A . 44 ARG NE 1 1 3 4415 1 1 44 ARG NH1 N 9.448 9.870 11.851 1.00 . A A . 44 ARG NH1 1 1 3 4416 1 1 44 ARG NH2 N 8.633 8.891 13.788 1.00 . A A . 44 ARG NH2 1 1 3 4417 1 1 44 ARG O O 2.967 5.661 7.754 1.00 . A A . 44 ARG O 1 1 3 4418 1 1 45 LYS C C 4.178 7.048 5.048 1.00 . A A . 45 LYS C 1 1 3 4419 1 1 45 LYS CA C 3.097 7.723 5.894 1.00 . A A . 45 LYS CA 1 1 3 4420 1 1 45 LYS CB C 2.696 9.110 5.387 1.00 . A A . 45 LYS CB 1 1 3 4421 1 1 45 LYS CD C 1.992 10.372 7.454 1.00 . A A . 45 LYS CD 1 1 3 4422 1 1 45 LYS CE C 1.224 11.675 7.678 1.00 . A A . 45 LYS CE 1 1 3 4423 1 1 45 LYS CG C 1.514 9.665 6.184 1.00 . A A . 45 LYS CG 1 1 3 4424 1 1 45 LYS H H 3.925 8.678 7.550 1.00 . A A . 45 LYS H 1 1 3 4425 1 1 45 LYS HA H 2.202 7.101 5.872 1.00 . A A . 45 LYS HA 1 1 3 4426 1 1 45 LYS HB2 H 3.544 9.790 5.466 1.00 . A A . 45 LYS HB2 1 1 3 4427 1 1 45 LYS HB3 H 2.432 9.053 4.331 1.00 . A A . 45 LYS HB3 1 1 3 4428 1 1 45 LYS HD2 H 1.858 9.714 8.313 1.00 . A A . 45 LYS HD2 1 1 3 4429 1 1 45 LYS HD3 H 3.059 10.582 7.377 1.00 . A A . 45 LYS HD3 1 1 3 4430 1 1 45 LYS HE2 H 0.154 11.473 7.711 1.00 . A A . 45 LYS HE2 1 1 3 4431 1 1 45 LYS HE3 H 1.497 12.104 8.642 1.00 . A A . 45 LYS HE3 1 1 3 4432 1 1 45 LYS HG2 H 0.949 10.363 5.566 1.00 . A A . 45 LYS HG2 1 1 3 4433 1 1 45 LYS HG3 H 0.836 8.853 6.449 1.00 . A A . 45 LYS HG3 1 1 3 4434 1 1 45 LYS HZ1 H 1.426 13.603 6.911 1.00 . A A . 45 LYS HZ1 1 1 3 4435 1 1 45 LYS HZ2 H 2.464 12.540 6.243 1.00 . A A . 45 LYS HZ2 1 1 3 4436 1 1 45 LYS N N 3.542 7.795 7.275 1.00 . A A . 45 LYS N 1 1 3 4437 1 1 45 LYS NZ N 1.519 12.643 6.597 1.00 . A A . 45 LYS NZ 1 1 3 4438 1 1 45 LYS O O 5.355 7.390 5.151 1.00 . A A . 45 LYS O 1 1 3 4439 1 1 46 CYS C C 5.376 6.385 2.472 1.00 . A A . 46 CYS C 1 1 3 4440 1 1 46 CYS CA C 4.656 5.375 3.368 1.00 . A A . 46 CYS CA 1 1 3 4441 1 1 46 CYS CB C 3.934 4.301 2.552 1.00 . A A . 46 CYS CB 1 1 3 4442 1 1 46 CYS H H 2.781 5.830 4.153 1.00 . A A . 46 CYS H 1 1 3 4443 1 1 46 CYS HA H 5.364 4.865 4.022 1.00 . A A . 46 CYS HA 1 1 3 4444 1 1 46 CYS HB2 H 3.504 4.767 1.665 1.00 . A A . 46 CYS HB2 1 1 3 4445 1 1 46 CYS HB3 H 4.667 3.573 2.206 1.00 . A A . 46 CYS HB3 1 1 3 4446 1 1 46 CYS N N 3.740 6.102 4.231 1.00 . A A . 46 CYS N 1 1 3 4447 1 1 46 CYS O O 6.600 6.358 2.358 1.00 . A A . 46 CYS O 1 1 3 4448 1 1 46 CYS SG S 2.608 3.417 3.451 1.00 . A A . 46 CYS SG 1 1 3 4449 1 1 47 GLY C C 5.735 9.424 1.778 1.00 . A A . 47 GLY C 1 1 3 4450 1 1 47 GLY CA C 5.129 8.270 0.976 1.00 . A A . 47 GLY CA 1 1 3 4451 1 1 47 GLY H H 3.589 7.269 1.958 1.00 . A A . 47 GLY H 1 1 3 4452 1 1 47 GLY HA2 H 5.892 7.828 0.335 1.00 . A A . 47 GLY HA2 1 1 3 4453 1 1 47 GLY HA3 H 4.344 8.649 0.323 1.00 . A A . 47 GLY HA3 1 1 3 4454 1 1 47 GLY N N 4.584 7.253 1.859 1.00 . A A . 47 GLY N 1 1 3 4455 1 1 47 GLY O O 5.414 10.587 1.537 1.00 . A A . 47 GLY O 1 1 3 4456 1 1 48 THR C C 8.627 10.412 2.983 1.00 . A A . 48 THR C 1 1 3 4457 1 1 48 THR CA C 7.253 10.054 3.552 1.00 . A A . 48 THR CA 1 1 3 4458 1 1 48 THR CB C 7.311 9.502 4.978 1.00 . A A . 48 THR CB 1 1 3 4459 1 1 48 THR CG2 C 8.385 10.186 5.827 1.00 . A A . 48 THR CG2 1 1 3 4460 1 1 48 THR H H 6.856 8.115 2.902 1.00 . A A . 48 THR H 1 1 3 4461 1 1 48 THR HA H 6.654 10.964 3.538 1.00 . A A . 48 THR HA 1 1 3 4462 1 1 48 THR HB H 7.449 8.421 4.972 1.00 . A A . 48 THR HB 1 1 3 4463 1 1 48 THR HG1 H 5.448 9.156 5.621 1.00 . A A . 48 THR HG1 1 1 3 4464 1 1 48 THR HG21 H 8.726 11.090 5.322 1.00 . A A . 48 THR HG21 1 1 3 4465 1 1 48 THR HG22 H 7.967 10.448 6.799 1.00 . A A . 48 THR HG22 1 1 3 4466 1 1 48 THR HG23 H 9.226 9.507 5.964 1.00 . A A . 48 THR HG23 1 1 3 4467 1 1 48 THR N N 6.600 9.063 2.714 1.00 . A A . 48 THR N 1 1 3 4468 1 1 48 THR O O 9.413 9.528 2.645 1.00 . A A . 48 THR O 1 1 3 4469 1 1 48 THR OG1 O 6.083 9.926 5.564 1.00 . A A . 48 THR OG1 1 1 3 4470 1 1 49 ALA C C 11.290 11.570 3.164 1.00 . A A . 49 ALA C 1 1 3 4471 1 1 49 ALA CA C 10.141 12.197 2.371 1.00 . A A . 49 ALA CA 1 1 3 4472 1 1 49 ALA CB C 10.162 13.726 2.425 1.00 . A A . 49 ALA CB 1 1 3 4473 1 1 49 ALA H H 8.231 12.423 3.172 1.00 . A A . 49 ALA H 1 1 3 4474 1 1 49 ALA HA H 10.213 11.881 1.331 1.00 . A A . 49 ALA HA 1 1 3 4475 1 1 49 ALA HB1 H 9.141 14.101 2.500 1.00 . A A . 49 ALA HB1 1 1 3 4476 1 1 49 ALA HB2 H 10.734 14.051 3.294 1.00 . A A . 49 ALA HB2 1 1 3 4477 1 1 49 ALA HB3 H 10.626 14.115 1.518 1.00 . A A . 49 ALA HB3 1 1 3 4478 1 1 49 ALA N N 8.875 11.711 2.894 1.00 . A A . 49 ALA N 1 1 3 4479 1 1 49 ALA O O 11.509 11.914 4.324 1.00 . A A . 49 ALA O 1 1 3 4480 1 1 50 GLY C C 12.863 8.474 3.220 1.00 . A A . 50 GLY C 1 1 3 4481 1 1 50 GLY CA C 13.113 9.981 3.134 1.00 . A A . 50 GLY CA 1 1 3 4482 1 1 50 GLY H H 11.808 10.386 1.561 1.00 . A A . 50 GLY H 1 1 3 4483 1 1 50 GLY HA2 H 14.023 10.170 2.564 1.00 . A A . 50 GLY HA2 1 1 3 4484 1 1 50 GLY HA3 H 13.273 10.385 4.133 1.00 . A A . 50 GLY HA3 1 1 3 4485 1 1 50 GLY N N 11.993 10.660 2.505 1.00 . A A . 50 GLY N 1 1 3 4486 1 1 50 GLY O O 13.784 7.703 3.485 1.00 . A A . 50 GLY O 1 1 3 4487 1 1 51 CYS C C 11.024 6.207 1.608 1.00 . A A . 51 CYS C 1 1 3 4488 1 1 51 CYS CA C 11.230 6.700 3.042 1.00 . A A . 51 CYS CA 1 1 3 4489 1 1 51 CYS CB C 9.984 6.484 3.904 1.00 . A A . 51 CYS CB 1 1 3 4490 1 1 51 CYS H H 10.870 8.734 2.777 1.00 . A A . 51 CYS H 1 1 3 4491 1 1 51 CYS HA H 12.052 6.167 3.520 1.00 . A A . 51 CYS HA 1 1 3 4492 1 1 51 CYS HB2 H 9.176 7.128 3.557 1.00 . A A . 51 CYS HB2 1 1 3 4493 1 1 51 CYS HB3 H 9.637 5.456 3.805 1.00 . A A . 51 CYS HB3 1 1 3 4494 1 1 51 CYS N N 11.613 8.101 2.992 1.00 . A A . 51 CYS N 1 1 3 4495 1 1 51 CYS O O 11.965 5.744 0.965 1.00 . A A . 51 CYS O 1 1 3 4496 1 1 51 CYS SG S 10.365 6.849 5.656 1.00 . A A . 51 CYS SG 1 1 3 4497 1 1 52 HIS C C 9.172 7.121 -1.073 1.00 . A A . 52 HIS C 1 1 3 4498 1 1 52 HIS CA C 9.445 5.896 -0.198 1.00 . A A . 52 HIS CA 1 1 3 4499 1 1 52 HIS CB C 8.274 4.912 -0.174 1.00 . A A . 52 HIS CB 1 1 3 4500 1 1 52 HIS CD2 C 8.185 3.053 1.662 1.00 . A A . 52 HIS CD2 1 1 3 4501 1 1 52 HIS CE1 C 9.519 1.607 0.705 1.00 . A A . 52 HIS CE1 1 1 3 4502 1 1 52 HIS CG C 8.597 3.588 0.476 1.00 . A A . 52 HIS CG 1 1 3 4503 1 1 52 HIS H H 9.027 6.702 1.677 1.00 . A A . 52 HIS H 1 1 3 4504 1 1 52 HIS HA H 10.315 5.368 -0.588 1.00 . A A . 52 HIS HA 1 1 3 4505 1 1 52 HIS HB2 H 7.438 5.371 0.354 1.00 . A A . 52 HIS HB2 1 1 3 4506 1 1 52 HIS HB3 H 7.943 4.732 -1.197 1.00 . A A . 52 HIS HB3 1 1 3 4507 1 1 52 HIS HD1 H 9.902 2.751 -0.983 1.00 . A A . 52 HIS HD1 1 1 3 4508 1 1 52 HIS HD2 H 7.512 3.529 2.376 1.00 . A A . 52 HIS HD2 1 1 3 4509 1 1 52 HIS HE1 H 10.104 0.705 0.528 1.00 . A A . 52 HIS HE1 1 1 3 4510 1 1 52 HIS N N 9.786 6.324 1.148 1.00 . A A . 52 HIS N 1 1 3 4511 1 1 52 HIS ND1 N 9.436 2.653 -0.104 1.00 . A A . 52 HIS ND1 1 1 3 4512 1 1 52 HIS NE2 N 8.742 1.856 1.798 1.00 . A A . 52 HIS NE2 1 1 3 4513 1 1 52 HIS O O 8.032 7.369 -1.462 1.00 . A A . 52 HIS O 1 1 3 4514 1 1 53 ASP C C 11.191 9.006 -3.277 1.00 . A A . 53 ASP C 1 1 3 4515 1 1 53 ASP CA C 10.128 9.049 -2.177 1.00 . A A . 53 ASP CA 1 1 3 4516 1 1 53 ASP CB C 10.359 10.313 -1.345 1.00 . A A . 53 ASP CB 1 1 3 4517 1 1 53 ASP CG C 9.627 11.559 -1.846 1.00 . A A . 53 ASP CG 1 1 3 4518 1 1 53 ASP H H 11.162 7.647 -1.035 1.00 . A A . 53 ASP H 1 1 3 4519 1 1 53 ASP HA H 9.114 9.030 -2.575 1.00 . A A . 53 ASP HA 1 1 3 4520 1 1 53 ASP HB2 H 10.050 10.116 -0.319 1.00 . A A . 53 ASP HB2 1 1 3 4521 1 1 53 ASP HB3 H 11.429 10.523 -1.321 1.00 . A A . 53 ASP HB3 1 1 3 4522 1 1 53 ASP N N 10.238 7.856 -1.355 1.00 . A A . 53 ASP N 1 1 3 4523 1 1 53 ASP O O 12.205 9.697 -3.193 1.00 . A A . 53 ASP O 1 1 3 4524 1 1 53 ASP OD1 O 8.586 11.376 -2.513 1.00 . A A . 53 ASP OD1 1 1 3 4525 1 1 53 ASP OD2 O 10.125 12.667 -1.551 1.00 . A A . 53 ASP OD2 1 1 3 4526 1 1 54 SER C C 11.291 8.770 -6.627 1.00 . A A . 54 SER C 1 1 3 4527 1 1 54 SER CA C 11.842 8.045 -5.398 1.00 . A A . 54 SER CA 1 1 3 4528 1 1 54 SER CB C 12.093 6.570 -5.720 1.00 . A A . 54 SER CB 1 1 3 4529 1 1 54 SER H H 10.094 7.629 -4.344 1.00 . A A . 54 SER H 1 1 3 4530 1 1 54 SER HA H 12.772 8.507 -5.066 1.00 . A A . 54 SER HA 1 1 3 4531 1 1 54 SER HB2 H 12.555 6.085 -4.860 1.00 . A A . 54 SER HB2 1 1 3 4532 1 1 54 SER HB3 H 11.140 6.070 -5.894 1.00 . A A . 54 SER HB3 1 1 3 4533 1 1 54 SER HG H 12.597 5.650 -7.424 1.00 . A A . 54 SER HG 1 1 3 4534 1 1 54 SER N N 10.922 8.187 -4.283 1.00 . A A . 54 SER N 1 1 3 4535 1 1 54 SER O O 12.052 9.335 -7.412 1.00 . A A . 54 SER O 1 1 3 4536 1 1 54 SER OG O 12.929 6.408 -6.863 1.00 . A A . 54 SER OG 1 1 3 4537 1 1 55 MET C C 9.776 8.778 -9.208 1.00 . A A . 55 MET C 1 1 3 4538 1 1 55 MET CA C 9.312 9.377 -7.878 1.00 . A A . 55 MET CA 1 1 3 4539 1 1 55 MET CB C 9.620 10.875 -7.858 1.00 . A A . 55 MET CB 1 1 3 4540 1 1 55 MET CE C 7.670 10.244 -5.037 1.00 . A A . 55 MET CE 1 1 3 4541 1 1 55 MET CG C 8.466 11.664 -7.235 1.00 . A A . 55 MET CG 1 1 3 4542 1 1 55 MET H H 9.362 8.269 -6.115 1.00 . A A . 55 MET H 1 1 3 4543 1 1 55 MET HA H 8.248 9.188 -7.738 1.00 . A A . 55 MET HA 1 1 3 4544 1 1 55 MET HB2 H 10.535 11.055 -7.292 1.00 . A A . 55 MET HB2 1 1 3 4545 1 1 55 MET HB3 H 9.799 11.227 -8.873 1.00 . A A . 55 MET HB3 1 1 3 4546 1 1 55 MET HE1 H 7.040 9.968 -5.883 1.00 . A A . 55 MET HE1 1 1 3 4547 1 1 55 MET HE2 H 8.340 9.417 -4.799 1.00 . A A . 55 MET HE2 1 1 3 4548 1 1 55 MET HE3 H 7.043 10.464 -4.173 1.00 . A A . 55 MET HE3 1 1 3 4549 1 1 55 MET HG2 H 8.460 12.683 -7.621 1.00 . A A . 55 MET HG2 1 1 3 4550 1 1 55 MET HG3 H 7.514 11.212 -7.513 1.00 . A A . 55 MET HG3 1 1 3 4551 1 1 55 MET N N 9.973 8.731 -6.757 1.00 . A A . 55 MET N 1 1 3 4552 1 1 55 MET O O 9.902 9.491 -10.202 1.00 . A A . 55 MET O 1 1 3 4553 1 1 55 MET SD S 8.632 11.687 -5.458 1.00 . A A . 55 MET SD 1 1 3 4554 1 1 56 ASP C C 9.805 5.393 -10.422 1.00 . A A . 56 ASP C 1 1 3 4555 1 1 56 ASP CA C 10.463 6.773 -10.372 1.00 . A A . 56 ASP CA 1 1 3 4556 1 1 56 ASP CB C 11.980 6.573 -10.357 1.00 . A A . 56 ASP CB 1 1 3 4557 1 1 56 ASP CG C 12.795 7.775 -10.838 1.00 . A A . 56 ASP CG 1 1 3 4558 1 1 56 ASP H H 9.910 6.904 -8.368 1.00 . A A . 56 ASP H 1 1 3 4559 1 1 56 ASP HA H 10.166 7.408 -11.207 1.00 . A A . 56 ASP HA 1 1 3 4560 1 1 56 ASP HB2 H 12.289 6.327 -9.341 1.00 . A A . 56 ASP HB2 1 1 3 4561 1 1 56 ASP HB3 H 12.225 5.714 -10.981 1.00 . A A . 56 ASP HB3 1 1 3 4562 1 1 56 ASP N N 10.016 7.476 -9.181 1.00 . A A . 56 ASP N 1 1 3 4563 1 1 56 ASP O O 10.380 4.410 -9.957 1.00 . A A . 56 ASP O 1 1 3 4564 1 1 56 ASP OD1 O 12.526 8.226 -11.972 1.00 . A A . 56 ASP OD1 1 1 3 4565 1 1 56 ASP OD2 O 13.670 8.216 -10.061 1.00 . A A . 56 ASP OD2 1 1 3 4566 1 1 57 LYS C C 8.822 2.996 -11.514 1.00 . A A . 57 LYS C 1 1 3 4567 1 1 57 LYS CA C 7.866 4.120 -11.108 1.00 . A A . 57 LYS CA 1 1 3 4568 1 1 57 LYS CB C 6.680 4.292 -12.058 1.00 . A A . 57 LYS CB 1 1 3 4569 1 1 57 LYS CD C 6.653 2.735 -14.042 1.00 . A A . 57 LYS CD 1 1 3 4570 1 1 57 LYS CE C 5.664 3.375 -15.017 1.00 . A A . 57 LYS CE 1 1 3 4571 1 1 57 LYS CG C 6.205 2.939 -12.593 1.00 . A A . 57 LYS CG 1 1 3 4572 1 1 57 LYS H H 8.149 6.167 -11.368 1.00 . A A . 57 LYS H 1 1 3 4573 1 1 57 LYS HA H 7.460 3.889 -10.123 1.00 . A A . 57 LYS HA 1 1 3 4574 1 1 57 LYS HB2 H 5.861 4.788 -11.538 1.00 . A A . 57 LYS HB2 1 1 3 4575 1 1 57 LYS HB3 H 6.965 4.936 -12.890 1.00 . A A . 57 LYS HB3 1 1 3 4576 1 1 57 LYS HD2 H 7.643 3.169 -14.185 1.00 . A A . 57 LYS HD2 1 1 3 4577 1 1 57 LYS HD3 H 6.740 1.669 -14.252 1.00 . A A . 57 LYS HD3 1 1 3 4578 1 1 57 LYS HE2 H 5.054 2.602 -15.485 1.00 . A A . 57 LYS HE2 1 1 3 4579 1 1 57 LYS HE3 H 4.984 4.033 -14.476 1.00 . A A . 57 LYS HE3 1 1 3 4580 1 1 57 LYS HG2 H 6.602 2.138 -11.969 1.00 . A A . 57 LYS HG2 1 1 3 4581 1 1 57 LYS HG3 H 5.118 2.881 -12.533 1.00 . A A . 57 LYS HG3 1 1 3 4582 1 1 57 LYS HZ1 H 5.876 4.165 -16.934 1.00 . A A . 57 LYS HZ1 1 1 3 4583 1 1 57 LYS HZ2 H 6.535 5.107 -15.781 1.00 . A A . 57 LYS HZ2 1 1 3 4584 1 1 57 LYS N N 8.609 5.363 -10.991 1.00 . A A . 57 LYS N 1 1 3 4585 1 1 57 LYS NZ N 6.384 4.143 -16.057 1.00 . A A . 57 LYS NZ 1 1 3 4586 1 1 57 LYS O O 8.873 1.954 -10.864 1.00 . A A . 57 LYS O 1 1 3 4587 1 1 58 LYS C C 11.790 2.340 -12.260 1.00 . A A . 58 LYS C 1 1 3 4588 1 1 58 LYS CA C 10.507 2.269 -13.090 1.00 . A A . 58 LYS CA 1 1 3 4589 1 1 58 LYS CB C 10.734 2.463 -14.591 1.00 . A A . 58 LYS CB 1 1 3 4590 1 1 58 LYS CD C 10.362 4.787 -15.496 1.00 . A A . 58 LYS CD 1 1 3 4591 1 1 58 LYS CE C 10.218 6.051 -14.645 1.00 . A A . 58 LYS CE 1 1 3 4592 1 1 58 LYS CG C 11.375 3.822 -14.877 1.00 . A A . 58 LYS CG 1 1 3 4593 1 1 58 LYS H H 9.509 4.098 -13.112 1.00 . A A . 58 LYS H 1 1 3 4594 1 1 58 LYS HA H 10.062 1.283 -12.956 1.00 . A A . 58 LYS HA 1 1 3 4595 1 1 58 LYS HB2 H 11.374 1.668 -14.972 1.00 . A A . 58 LYS HB2 1 1 3 4596 1 1 58 LYS HB3 H 9.783 2.387 -15.119 1.00 . A A . 58 LYS HB3 1 1 3 4597 1 1 58 LYS HD2 H 10.679 5.057 -16.503 1.00 . A A . 58 LYS HD2 1 1 3 4598 1 1 58 LYS HD3 H 9.394 4.294 -15.588 1.00 . A A . 58 LYS HD3 1 1 3 4599 1 1 58 LYS HE2 H 10.661 5.887 -13.663 1.00 . A A . 58 LYS HE2 1 1 3 4600 1 1 58 LYS HE3 H 10.763 6.873 -15.108 1.00 . A A . 58 LYS HE3 1 1 3 4601 1 1 58 LYS HG2 H 11.768 4.245 -13.952 1.00 . A A . 58 LYS HG2 1 1 3 4602 1 1 58 LYS HG3 H 12.220 3.694 -15.553 1.00 . A A . 58 LYS HG3 1 1 3 4603 1 1 58 LYS HZ1 H 8.392 6.049 -13.640 1.00 . A A . 58 LYS HZ1 1 1 3 4604 1 1 58 LYS HZ2 H 8.656 7.421 -14.476 1.00 . A A . 58 LYS HZ2 1 1 3 4605 1 1 58 LYS N N 9.556 3.247 -12.589 1.00 . A A . 58 LYS N 1 1 3 4606 1 1 58 LYS NZ N 8.791 6.416 -14.497 1.00 . A A . 58 LYS NZ 1 1 3 4607 1 1 58 LYS O O 12.875 2.538 -12.804 1.00 . A A . 58 LYS O 1 1 3 4608 1 1 59 ASP C C 12.816 0.910 -9.254 1.00 . A A . 59 ASP C 1 1 3 4609 1 1 59 ASP CA C 12.754 2.218 -10.045 1.00 . A A . 59 ASP CA 1 1 3 4610 1 1 59 ASP CB C 12.614 3.368 -9.047 1.00 . A A . 59 ASP CB 1 1 3 4611 1 1 59 ASP CG C 13.733 3.462 -8.007 1.00 . A A . 59 ASP CG 1 1 3 4612 1 1 59 ASP H H 10.737 2.014 -10.521 1.00 . A A . 59 ASP H 1 1 3 4613 1 1 59 ASP HA H 13.628 2.362 -10.681 1.00 . A A . 59 ASP HA 1 1 3 4614 1 1 59 ASP HB2 H 12.573 4.307 -9.600 1.00 . A A . 59 ASP HB2 1 1 3 4615 1 1 59 ASP HB3 H 11.663 3.263 -8.526 1.00 . A A . 59 ASP HB3 1 1 3 4616 1 1 59 ASP N N 11.623 2.175 -10.956 1.00 . A A . 59 ASP N 1 1 3 4617 1 1 59 ASP O O 13.822 0.202 -9.295 1.00 . A A . 59 ASP O 1 1 3 4618 1 1 59 ASP OD1 O 13.605 2.774 -6.972 1.00 . A A . 59 ASP OD1 1 1 3 4619 1 1 59 ASP OD2 O 14.691 4.221 -8.271 1.00 . A A . 59 ASP OD2 1 1 3 4620 1 1 60 LYS C C 12.708 -0.533 -6.650 1.00 . A A . 60 LYS C 1 1 3 4621 1 1 60 LYS CA C 11.647 -0.582 -7.751 1.00 . A A . 60 LYS CA 1 1 3 4622 1 1 60 LYS CB C 11.744 -1.821 -8.643 1.00 . A A . 60 LYS CB 1 1 3 4623 1 1 60 LYS CD C 11.394 -1.284 -11.082 1.00 . A A . 60 LYS CD 1 1 3 4624 1 1 60 LYS CE C 11.608 -2.454 -12.044 1.00 . A A . 60 LYS CE 1 1 3 4625 1 1 60 LYS CG C 10.729 -1.754 -9.786 1.00 . A A . 60 LYS CG 1 1 3 4626 1 1 60 LYS H H 10.915 1.209 -8.523 1.00 . A A . 60 LYS H 1 1 3 4627 1 1 60 LYS HA H 10.663 -0.598 -7.282 1.00 . A A . 60 LYS HA 1 1 3 4628 1 1 60 LYS HB2 H 12.751 -1.904 -9.050 1.00 . A A . 60 LYS HB2 1 1 3 4629 1 1 60 LYS HB3 H 11.567 -2.717 -8.047 1.00 . A A . 60 LYS HB3 1 1 3 4630 1 1 60 LYS HD2 H 10.773 -0.525 -11.558 1.00 . A A . 60 LYS HD2 1 1 3 4631 1 1 60 LYS HD3 H 12.351 -0.815 -10.854 1.00 . A A . 60 LYS HD3 1 1 3 4632 1 1 60 LYS HE2 H 12.252 -2.142 -12.867 1.00 . A A . 60 LYS HE2 1 1 3 4633 1 1 60 LYS HE3 H 12.120 -3.267 -11.529 1.00 . A A . 60 LYS HE3 1 1 3 4634 1 1 60 LYS HG2 H 10.282 -2.737 -9.939 1.00 . A A . 60 LYS HG2 1 1 3 4635 1 1 60 LYS HG3 H 9.920 -1.074 -9.520 1.00 . A A . 60 LYS HG3 1 1 3 4636 1 1 60 LYS HZ1 H 9.562 -2.821 -11.902 1.00 . A A . 60 LYS HZ1 1 1 3 4637 1 1 60 LYS HZ2 H 10.035 -2.429 -13.410 1.00 . A A . 60 LYS HZ2 1 1 3 4638 1 1 60 LYS N N 11.729 0.628 -8.551 1.00 . A A . 60 LYS N 1 1 3 4639 1 1 60 LYS NZ N 10.312 -2.932 -12.575 1.00 . A A . 60 LYS NZ 1 1 3 4640 1 1 60 LYS O O 12.937 0.516 -6.049 1.00 . A A . 60 LYS O 1 1 3 4641 1 1 61 SER C C 13.729 -1.717 -4.008 1.00 . A A . 61 SER C 1 1 3 4642 1 1 61 SER CA C 14.360 -1.781 -5.400 1.00 . A A . 61 SER CA 1 1 3 4643 1 1 61 SER CB C 15.404 -0.674 -5.561 1.00 . A A . 61 SER CB 1 1 3 4644 1 1 61 SER H H 13.137 -2.529 -6.911 1.00 . A A . 61 SER H 1 1 3 4645 1 1 61 SER HA H 14.832 -2.751 -5.562 1.00 . A A . 61 SER HA 1 1 3 4646 1 1 61 SER HB2 H 14.971 0.279 -5.256 1.00 . A A . 61 SER HB2 1 1 3 4647 1 1 61 SER HB3 H 16.245 -0.869 -4.896 1.00 . A A . 61 SER HB3 1 1 3 4648 1 1 61 SER HG H 16.340 0.300 -7.037 1.00 . A A . 61 SER HG 1 1 3 4649 1 1 61 SER N N 13.329 -1.680 -6.418 1.00 . A A . 61 SER N 1 1 3 4650 1 1 61 SER O O 13.675 -2.721 -3.299 1.00 . A A . 61 SER O 1 1 3 4651 1 1 61 SER OG O 15.873 -0.574 -6.902 1.00 . A A . 61 SER OG 1 1 3 4652 1 1 62 ALA C C 12.179 1.137 -2.252 1.00 . A A . 62 ALA C 1 1 3 4653 1 1 62 ALA CA C 12.641 -0.317 -2.362 1.00 . A A . 62 ALA CA 1 1 3 4654 1 1 62 ALA CB C 13.622 -0.703 -1.253 1.00 . A A . 62 ALA CB 1 1 3 4655 1 1 62 ALA H H 13.313 0.286 -4.239 1.00 . A A . 62 ALA H 1 1 3 4656 1 1 62 ALA HA H 11.771 -0.972 -2.304 1.00 . A A . 62 ALA HA 1 1 3 4657 1 1 62 ALA HB1 H 14.331 -1.438 -1.635 1.00 . A A . 62 ALA HB1 1 1 3 4658 1 1 62 ALA HB2 H 14.161 0.184 -0.921 1.00 . A A . 62 ALA HB2 1 1 3 4659 1 1 62 ALA HB3 H 13.072 -1.130 -0.414 1.00 . A A . 62 ALA HB3 1 1 3 4660 1 1 62 ALA N N 13.266 -0.526 -3.657 1.00 . A A . 62 ALA N 1 1 3 4661 1 1 62 ALA O O 11.082 1.408 -1.766 1.00 . A A . 62 ALA O 1 1 3 4662 1 1 63 LYS C C 11.563 3.747 -3.611 1.00 . A A . 63 LYS C 1 1 3 4663 1 1 63 LYS CA C 12.733 3.454 -2.669 1.00 . A A . 63 LYS CA 1 1 3 4664 1 1 63 LYS CB C 13.985 4.281 -2.969 1.00 . A A . 63 LYS CB 1 1 3 4665 1 1 63 LYS CD C 15.121 5.007 -5.100 1.00 . A A . 63 LYS CD 1 1 3 4666 1 1 63 LYS CE C 16.619 5.255 -4.911 1.00 . A A . 63 LYS CE 1 1 3 4667 1 1 63 LYS CG C 14.654 3.814 -4.263 1.00 . A A . 63 LYS CG 1 1 3 4668 1 1 63 LYS H H 13.929 1.805 -3.104 1.00 . A A . 63 LYS H 1 1 3 4669 1 1 63 LYS HA H 12.425 3.692 -1.651 1.00 . A A . 63 LYS HA 1 1 3 4670 1 1 63 LYS HB2 H 13.719 5.334 -3.052 1.00 . A A . 63 LYS HB2 1 1 3 4671 1 1 63 LYS HB3 H 14.689 4.195 -2.140 1.00 . A A . 63 LYS HB3 1 1 3 4672 1 1 63 LYS HD2 H 14.909 4.822 -6.153 1.00 . A A . 63 LYS HD2 1 1 3 4673 1 1 63 LYS HD3 H 14.562 5.898 -4.814 1.00 . A A . 63 LYS HD3 1 1 3 4674 1 1 63 LYS HE2 H 16.933 4.894 -3.932 1.00 . A A . 63 LYS HE2 1 1 3 4675 1 1 63 LYS HE3 H 17.184 4.693 -5.655 1.00 . A A . 63 LYS HE3 1 1 3 4676 1 1 63 LYS HG2 H 15.505 3.175 -4.027 1.00 . A A . 63 LYS HG2 1 1 3 4677 1 1 63 LYS HG3 H 13.954 3.211 -4.842 1.00 . A A . 63 LYS HG3 1 1 3 4678 1 1 63 LYS HZ1 H 16.330 7.155 -5.717 1.00 . A A . 63 LYS HZ1 1 1 3 4679 1 1 63 LYS HZ2 H 16.796 7.190 -4.157 1.00 . A A . 63 LYS HZ2 1 1 3 4680 1 1 63 LYS N N 13.039 2.034 -2.711 1.00 . A A . 63 LYS N 1 1 3 4681 1 1 63 LYS NZ N 16.924 6.698 -5.035 1.00 . A A . 63 LYS NZ 1 1 3 4682 1 1 63 LYS O O 11.002 4.841 -3.588 1.00 . A A . 63 LYS O 1 1 3 4683 1 1 64 GLY C C 8.783 2.807 -4.656 1.00 . A A . 64 GLY C 1 1 3 4684 1 1 64 GLY CA C 10.137 2.886 -5.365 1.00 . A A . 64 GLY CA 1 1 3 4685 1 1 64 GLY H H 11.691 1.862 -4.429 1.00 . A A . 64 GLY H 1 1 3 4686 1 1 64 GLY HA2 H 10.222 3.839 -5.888 1.00 . A A . 64 GLY HA2 1 1 3 4687 1 1 64 GLY HA3 H 10.204 2.102 -6.118 1.00 . A A . 64 GLY HA3 1 1 3 4688 1 1 64 GLY N N 11.230 2.749 -4.417 1.00 . A A . 64 GLY N 1 1 3 4689 1 1 64 GLY O O 8.280 1.716 -4.392 1.00 . A A . 64 GLY O 1 1 3 4690 1 1 65 TYR C C 5.883 3.259 -4.454 1.00 . A A . 65 TYR C 1 1 3 4691 1 1 65 TYR CA C 6.947 4.053 -3.695 1.00 . A A . 65 TYR CA 1 1 3 4692 1 1 65 TYR CB C 6.559 5.533 -3.695 1.00 . A A . 65 TYR CB 1 1 3 4693 1 1 65 TYR CD1 C 4.782 5.537 -1.906 1.00 . A A . 65 TYR CD1 1 1 3 4694 1 1 65 TYR CD2 C 4.193 6.309 -4.090 1.00 . A A . 65 TYR CD2 1 1 3 4695 1 1 65 TYR CE1 C 3.438 5.789 -1.454 1.00 . A A . 65 TYR CE1 1 1 3 4696 1 1 65 TYR CE2 C 2.849 6.561 -3.638 1.00 . A A . 65 TYR CE2 1 1 3 4697 1 1 65 TYR CG C 5.131 5.802 -3.215 1.00 . A A . 65 TYR CG 1 1 3 4698 1 1 65 TYR CZ C 2.538 6.289 -2.343 1.00 . A A . 65 TYR CZ 1 1 3 4699 1 1 65 TYR H H 8.649 4.860 -4.586 1.00 . A A . 65 TYR H 1 1 3 4700 1 1 65 TYR HA H 7.064 3.630 -2.697 1.00 . A A . 65 TYR HA 1 1 3 4701 1 1 65 TYR HB2 H 7.254 6.081 -3.059 1.00 . A A . 65 TYR HB2 1 1 3 4702 1 1 65 TYR HB3 H 6.672 5.928 -4.705 1.00 . A A . 65 TYR HB3 1 1 3 4703 1 1 65 TYR HD1 H 5.523 5.136 -1.215 1.00 . A A . 65 TYR HD1 1 1 3 4704 1 1 65 TYR HD2 H 4.468 6.518 -5.124 1.00 . A A . 65 TYR HD2 1 1 3 4705 1 1 65 TYR HE1 H 3.149 5.585 -0.424 1.00 . A A . 65 TYR HE1 1 1 3 4706 1 1 65 TYR HE2 H 2.098 6.962 -4.320 1.00 . A A . 65 TYR HE2 1 1 3 4707 1 1 65 TYR HH H 0.695 5.727 -2.086 1.00 . A A . 65 TYR HH 1 1 3 4708 1 1 65 TYR N N 8.233 3.977 -4.368 1.00 . A A . 65 TYR N 1 1 3 4709 1 1 65 TYR O O 5.101 2.526 -3.849 1.00 . A A . 65 TYR O 1 1 3 4710 1 1 65 TYR OH O 1.269 6.528 -1.916 1.00 . A A . 65 TYR OH 1 1 3 4711 1 1 66 TYR C C 5.314 1.268 -6.788 1.00 . A A . 66 TYR C 1 1 3 4712 1 1 66 TYR CA C 4.930 2.739 -6.615 1.00 . A A . 66 TYR CA 1 1 3 4713 1 1 66 TYR CB C 4.994 3.434 -7.977 1.00 . A A . 66 TYR CB 1 1 3 4714 1 1 66 TYR CD1 C 5.354 1.593 -9.662 1.00 . A A . 66 TYR CD1 1 1 3 4715 1 1 66 TYR CD2 C 3.261 2.747 -9.675 1.00 . A A . 66 TYR CD2 1 1 3 4716 1 1 66 TYR CE1 C 4.910 0.774 -10.759 1.00 . A A . 66 TYR CE1 1 1 3 4717 1 1 66 TYR CE2 C 2.816 1.928 -10.772 1.00 . A A . 66 TYR CE2 1 1 3 4718 1 1 66 TYR CG C 4.521 2.563 -9.143 1.00 . A A . 66 TYR CG 1 1 3 4719 1 1 66 TYR CZ C 3.662 0.981 -11.260 1.00 . A A . 66 TYR CZ 1 1 3 4720 1 1 66 TYR H H 6.525 4.029 -6.252 1.00 . A A . 66 TYR H 1 1 3 4721 1 1 66 TYR HA H 3.952 2.798 -6.137 1.00 . A A . 66 TYR HA 1 1 3 4722 1 1 66 TYR HB2 H 4.385 4.337 -7.941 1.00 . A A . 66 TYR HB2 1 1 3 4723 1 1 66 TYR HB3 H 6.020 3.749 -8.165 1.00 . A A . 66 TYR HB3 1 1 3 4724 1 1 66 TYR HD1 H 6.350 1.448 -9.241 1.00 . A A . 66 TYR HD1 1 1 3 4725 1 1 66 TYR HD2 H 2.603 3.513 -9.265 1.00 . A A . 66 TYR HD2 1 1 3 4726 1 1 66 TYR HE1 H 5.558 0.004 -11.179 1.00 . A A . 66 TYR HE1 1 1 3 4727 1 1 66 TYR HE2 H 1.824 2.063 -11.202 1.00 . A A . 66 TYR HE2 1 1 3 4728 1 1 66 TYR HH H 2.341 -0.176 -12.093 1.00 . A A . 66 TYR HH 1 1 3 4729 1 1 66 TYR N N 5.886 3.431 -5.767 1.00 . A A . 66 TYR N 1 1 3 4730 1 1 66 TYR O O 4.623 0.520 -7.478 1.00 . A A . 66 TYR O 1 1 3 4731 1 1 66 TYR OH O 3.242 0.207 -12.296 1.00 . A A . 66 TYR OH 1 1 3 4732 1 1 67 HIS C C 6.472 -1.235 -4.970 1.00 . A A . 67 HIS C 1 1 3 4733 1 1 67 HIS CA C 6.899 -0.470 -6.225 1.00 . A A . 67 HIS CA 1 1 3 4734 1 1 67 HIS CB C 8.412 -0.499 -6.451 1.00 . A A . 67 HIS CB 1 1 3 4735 1 1 67 HIS CD2 C 9.567 -1.762 -4.476 1.00 . A A . 67 HIS CD2 1 1 3 4736 1 1 67 HIS CE1 C 10.031 -3.625 -5.526 1.00 . A A . 67 HIS CE1 1 1 3 4737 1 1 67 HIS CG C 9.115 -1.641 -5.756 1.00 . A A . 67 HIS CG 1 1 3 4738 1 1 67 HIS H H 6.970 1.513 -5.591 1.00 . A A . 67 HIS H 1 1 3 4739 1 1 67 HIS HA H 6.424 -0.923 -7.095 1.00 . A A . 67 HIS HA 1 1 3 4740 1 1 67 HIS HB2 H 8.608 -0.562 -7.521 1.00 . A A . 67 HIS HB2 1 1 3 4741 1 1 67 HIS HB3 H 8.839 0.442 -6.103 1.00 . A A . 67 HIS HB3 1 1 3 4742 1 1 67 HIS HD1 H 9.219 -3.052 -7.348 1.00 . A A . 67 HIS HD1 1 1 3 4743 1 1 67 HIS HD2 H 9.488 -1.003 -3.697 1.00 . A A . 67 HIS HD2 1 1 3 4744 1 1 67 HIS HE1 H 10.398 -4.631 -5.727 1.00 . A A . 67 HIS HE1 1 1 3 4745 1 1 67 HIS N N 6.415 0.898 -6.150 1.00 . A A . 67 HIS N 1 1 3 4746 1 1 67 HIS ND1 N 9.422 -2.830 -6.394 1.00 . A A . 67 HIS ND1 1 1 3 4747 1 1 67 HIS NE2 N 10.120 -2.961 -4.338 1.00 . A A . 67 HIS NE2 1 1 3 4748 1 1 67 HIS O O 6.409 -2.463 -4.979 1.00 . A A . 67 HIS O 1 1 3 4749 1 1 68 VAL C C 4.244 -1.042 -2.574 1.00 . A A . 68 VAL C 1 1 3 4750 1 1 68 VAL CA C 5.771 -1.067 -2.661 1.00 . A A . 68 VAL CA 1 1 3 4751 1 1 68 VAL CB C 6.448 -0.346 -1.494 1.00 . A A . 68 VAL CB 1 1 3 4752 1 1 68 VAL CG1 C 7.893 -0.820 -1.322 1.00 . A A . 68 VAL CG1 1 1 3 4753 1 1 68 VAL CG2 C 6.387 1.171 -1.677 1.00 . A A . 68 VAL CG2 1 1 3 4754 1 1 68 VAL H H 6.243 0.522 -3.922 1.00 . A A . 68 VAL H 1 1 3 4755 1 1 68 VAL HA H 6.106 -2.105 -2.658 1.00 . A A . 68 VAL HA 1 1 3 4756 1 1 68 VAL HB H 5.903 -0.596 -0.584 1.00 . A A . 68 VAL HB 1 1 3 4757 1 1 68 VAL HG11 H 7.936 -1.903 -1.433 1.00 . A A . 68 VAL HG11 1 1 3 4758 1 1 68 VAL HG12 H 8.522 -0.352 -2.079 1.00 . A A . 68 VAL HG12 1 1 3 4759 1 1 68 VAL HG13 H 8.250 -0.542 -0.330 1.00 . A A . 68 VAL HG13 1 1 3 4760 1 1 68 VAL HG21 H 5.375 1.463 -1.960 1.00 . A A . 68 VAL HG21 1 1 3 4761 1 1 68 VAL HG22 H 6.659 1.661 -0.742 1.00 . A A . 68 VAL HG22 1 1 3 4762 1 1 68 VAL HG23 H 7.084 1.471 -2.460 1.00 . A A . 68 VAL HG23 1 1 3 4763 1 1 68 VAL N N 6.190 -0.476 -3.921 1.00 . A A . 68 VAL N 1 1 3 4764 1 1 68 VAL O O 3.673 -1.341 -1.526 1.00 . A A . 68 VAL O 1 1 3 4765 1 1 69 MET C C 1.622 -1.611 -4.772 1.00 . A A . 69 MET C 1 1 3 4766 1 1 69 MET CA C 2.175 -0.614 -3.751 1.00 . A A . 69 MET CA 1 1 3 4767 1 1 69 MET CB C 1.747 0.803 -4.138 1.00 . A A . 69 MET CB 1 1 3 4768 1 1 69 MET CE C 2.629 2.072 -0.441 1.00 . A A . 69 MET CE 1 1 3 4769 1 1 69 MET CG C 2.291 1.831 -3.144 1.00 . A A . 69 MET CG 1 1 3 4770 1 1 69 MET H H 4.096 -0.441 -4.537 1.00 . A A . 69 MET H 1 1 3 4771 1 1 69 MET HA H 1.826 -0.875 -2.752 1.00 . A A . 69 MET HA 1 1 3 4772 1 1 69 MET HB2 H 2.107 1.035 -5.140 1.00 . A A . 69 MET HB2 1 1 3 4773 1 1 69 MET HB3 H 0.659 0.863 -4.169 1.00 . A A . 69 MET HB3 1 1 3 4774 1 1 69 MET HE1 H 3.454 1.384 -0.628 1.00 . A A . 69 MET HE1 1 1 3 4775 1 1 69 MET HE2 H 2.986 3.099 -0.528 1.00 . A A . 69 MET HE2 1 1 3 4776 1 1 69 MET HE3 H 2.239 1.907 0.563 1.00 . A A . 69 MET HE3 1 1 3 4777 1 1 69 MET HG2 H 3.338 1.620 -2.926 1.00 . A A . 69 MET HG2 1 1 3 4778 1 1 69 MET HG3 H 2.251 2.829 -3.581 1.00 . A A . 69 MET HG3 1 1 3 4779 1 1 69 MET N N 3.625 -0.682 -3.689 1.00 . A A . 69 MET N 1 1 3 4780 1 1 69 MET O O 0.425 -1.895 -4.782 1.00 . A A . 69 MET O 1 1 3 4781 1 1 69 MET SD S 1.335 1.788 -1.637 1.00 . A A . 69 MET SD 1 1 3 4782 1 1 70 HIS C C 3.111 -4.254 -6.614 1.00 . A A . 70 HIS C 1 1 3 4783 1 1 70 HIS CA C 2.138 -3.074 -6.627 1.00 . A A . 70 HIS CA 1 1 3 4784 1 1 70 HIS CB C 2.043 -2.399 -7.997 1.00 . A A . 70 HIS CB 1 1 3 4785 1 1 70 HIS CD2 C 0.104 -0.681 -8.344 1.00 . A A . 70 HIS CD2 1 1 3 4786 1 1 70 HIS CE1 C 1.141 1.107 -7.626 1.00 . A A . 70 HIS CE1 1 1 3 4787 1 1 70 HIS CG C 1.363 -1.051 -7.972 1.00 . A A . 70 HIS CG 1 1 3 4788 1 1 70 HIS H H 3.492 -1.879 -5.589 1.00 . A A . 70 HIS H 1 1 3 4789 1 1 70 HIS HA H 1.142 -3.432 -6.364 1.00 . A A . 70 HIS HA 1 1 3 4790 1 1 70 HIS HB2 H 3.048 -2.280 -8.403 1.00 . A A . 70 HIS HB2 1 1 3 4791 1 1 70 HIS HB3 H 1.500 -3.056 -8.677 1.00 . A A . 70 HIS HB3 1 1 3 4792 1 1 70 HIS HD1 H 2.930 0.155 -7.182 1.00 . A A . 70 HIS HD1 1 1 3 4793 1 1 70 HIS HD2 H -0.662 -1.343 -8.746 1.00 . A A . 70 HIS HD2 1 1 3 4794 1 1 70 HIS HE1 H 1.340 2.144 -7.352 1.00 . A A . 70 HIS HE1 1 1 3 4795 1 1 70 HIS N N 2.520 -2.115 -5.605 1.00 . A A . 70 HIS N 1 1 3 4796 1 1 70 HIS ND1 N 1.992 0.097 -7.524 1.00 . A A . 70 HIS ND1 1 1 3 4797 1 1 70 HIS NE2 N -0.029 0.623 -8.134 1.00 . A A . 70 HIS NE2 1 1 3 4798 1 1 70 HIS O O 2.716 -5.386 -6.339 1.00 . A A . 70 HIS O 1 1 3 4799 1 1 71 ASP C C 5.155 -5.965 -5.803 1.00 . A A . 71 ASP C 1 1 3 4800 1 1 71 ASP CA C 5.398 -4.971 -6.941 1.00 . A A . 71 ASP CA 1 1 3 4801 1 1 71 ASP CB C 6.785 -4.357 -6.746 1.00 . A A . 71 ASP CB 1 1 3 4802 1 1 71 ASP CG C 7.897 -4.990 -7.585 1.00 . A A . 71 ASP CG 1 1 3 4803 1 1 71 ASP H H 4.678 -3.026 -7.137 1.00 . A A . 71 ASP H 1 1 3 4804 1 1 71 ASP HA H 5.316 -5.435 -7.924 1.00 . A A . 71 ASP HA 1 1 3 4805 1 1 71 ASP HB2 H 6.732 -3.294 -6.982 1.00 . A A . 71 ASP HB2 1 1 3 4806 1 1 71 ASP HB3 H 7.056 -4.436 -5.693 1.00 . A A . 71 ASP HB3 1 1 3 4807 1 1 71 ASP N N 4.365 -3.950 -6.915 1.00 . A A . 71 ASP N 1 1 3 4808 1 1 71 ASP O O 4.929 -5.564 -4.662 1.00 . A A . 71 ASP O 1 1 3 4809 1 1 71 ASP OD1 O 8.487 -5.976 -7.094 1.00 . A A . 71 ASP OD1 1 1 3 4810 1 1 71 ASP OD2 O 8.131 -4.473 -8.699 1.00 . A A . 71 ASP OD2 1 1 3 4811 1 1 72 LYS C C 6.355 -8.842 -4.721 1.00 . A A . 72 LYS C 1 1 3 4812 1 1 72 LYS CA C 5.000 -8.295 -5.175 1.00 . A A . 72 LYS CA 1 1 3 4813 1 1 72 LYS CB C 4.061 -9.366 -5.735 1.00 . A A . 72 LYS CB 1 1 3 4814 1 1 72 LYS CD C 1.966 -9.798 -7.069 1.00 . A A . 72 LYS CD 1 1 3 4815 1 1 72 LYS CE C 1.244 -9.262 -8.307 1.00 . A A . 72 LYS CE 1 1 3 4816 1 1 72 LYS CG C 2.873 -8.729 -6.457 1.00 . A A . 72 LYS CG 1 1 3 4817 1 1 72 LYS H H 5.396 -7.559 -7.083 1.00 . A A . 72 LYS H 1 1 3 4818 1 1 72 LYS HA H 4.503 -7.848 -4.315 1.00 . A A . 72 LYS HA 1 1 3 4819 1 1 72 LYS HB2 H 4.607 -10.010 -6.424 1.00 . A A . 72 LYS HB2 1 1 3 4820 1 1 72 LYS HB3 H 3.702 -9.999 -4.924 1.00 . A A . 72 LYS HB3 1 1 3 4821 1 1 72 LYS HD2 H 2.559 -10.672 -7.340 1.00 . A A . 72 LYS HD2 1 1 3 4822 1 1 72 LYS HD3 H 1.234 -10.126 -6.331 1.00 . A A . 72 LYS HD3 1 1 3 4823 1 1 72 LYS HE2 H 0.311 -9.806 -8.455 1.00 . A A . 72 LYS HE2 1 1 3 4824 1 1 72 LYS HE3 H 0.981 -8.215 -8.157 1.00 . A A . 72 LYS HE3 1 1 3 4825 1 1 72 LYS HG2 H 2.301 -8.119 -5.757 1.00 . A A . 72 LYS HG2 1 1 3 4826 1 1 72 LYS HG3 H 3.233 -8.061 -7.240 1.00 . A A . 72 LYS HG3 1 1 3 4827 1 1 72 LYS HZ1 H 1.634 -9.903 -10.251 1.00 . A A . 72 LYS HZ1 1 1 3 4828 1 1 72 LYS HZ2 H 2.368 -8.497 -9.886 1.00 . A A . 72 LYS HZ2 1 1 3 4829 1 1 72 LYS N N 5.211 -7.241 -6.153 1.00 . A A . 72 LYS N 1 1 3 4830 1 1 72 LYS NZ N 2.100 -9.398 -9.506 1.00 . A A . 72 LYS NZ 1 1 3 4831 1 1 72 LYS O O 6.510 -9.251 -3.571 1.00 . A A . 72 LYS O 1 1 3 4832 1 1 73 ASN C C 9.331 -8.360 -4.390 1.00 . A A . 73 ASN C 1 1 3 4833 1 1 73 ASN CA C 8.639 -9.323 -5.357 1.00 . A A . 73 ASN CA 1 1 3 4834 1 1 73 ASN CB C 9.484 -9.404 -6.630 1.00 . A A . 73 ASN CB 1 1 3 4835 1 1 73 ASN CG C 9.377 -10.789 -7.272 1.00 . A A . 73 ASN CG 1 1 3 4836 1 1 73 ASN H H 7.168 -8.498 -6.580 1.00 . A A . 73 ASN H 1 1 3 4837 1 1 73 ASN HA H 8.493 -10.313 -4.927 1.00 . A A . 73 ASN HA 1 1 3 4838 1 1 73 ASN HB2 H 9.155 -8.644 -7.339 1.00 . A A . 73 ASN HB2 1 1 3 4839 1 1 73 ASN HB3 H 10.526 -9.189 -6.393 1.00 . A A . 73 ASN HB3 1 1 3 4840 1 1 73 ASN HD21 H 11.252 -11.185 -6.618 1.00 . A A . 73 ASN HD21 1 1 3 4841 1 1 73 ASN HD22 H 10.489 -12.464 -7.503 1.00 . A A . 73 ASN HD22 1 1 3 4842 1 1 73 ASN N N 7.302 -8.832 -5.648 1.00 . A A . 73 ASN N 1 1 3 4843 1 1 73 ASN ND2 N 10.462 -11.542 -7.118 1.00 . A A . 73 ASN ND2 1 1 3 4844 1 1 73 ASN O O 10.315 -7.715 -4.749 1.00 . A A . 73 ASN O 1 1 3 4845 1 1 73 ASN OD1 O 8.375 -11.149 -7.867 1.00 . A A . 73 ASN OD1 1 1 3 4846 1 1 74 THR C C 9.557 -8.193 -0.858 1.00 . A A . 74 THR C 1 1 3 4847 1 1 74 THR CA C 9.344 -7.421 -2.161 1.00 . A A . 74 THR CA 1 1 3 4848 1 1 74 THR CB C 8.409 -6.219 -2.010 1.00 . A A . 74 THR CB 1 1 3 4849 1 1 74 THR CG2 C 8.179 -5.485 -3.332 1.00 . A A . 74 THR CG2 1 1 3 4850 1 1 74 THR H H 7.990 -8.822 -2.899 1.00 . A A . 74 THR H 1 1 3 4851 1 1 74 THR HA H 10.324 -7.080 -2.495 1.00 . A A . 74 THR HA 1 1 3 4852 1 1 74 THR HB H 8.776 -5.536 -1.244 1.00 . A A . 74 THR HB 1 1 3 4853 1 1 74 THR HG1 H 7.195 -7.311 -0.852 1.00 . A A . 74 THR HG1 1 1 3 4854 1 1 74 THR HG21 H 9.079 -5.549 -3.945 1.00 . A A . 74 THR HG21 1 1 3 4855 1 1 74 THR HG22 H 7.346 -5.946 -3.863 1.00 . A A . 74 THR HG22 1 1 3 4856 1 1 74 THR HG23 H 7.949 -4.439 -3.132 1.00 . A A . 74 THR HG23 1 1 3 4857 1 1 74 THR N N 8.790 -8.294 -3.182 1.00 . A A . 74 THR N 1 1 3 4858 1 1 74 THR O O 8.868 -9.178 -0.596 1.00 . A A . 74 THR O 1 1 3 4859 1 1 74 THR OG1 O 7.143 -6.800 -1.710 1.00 . A A . 74 THR OG1 1 1 3 4860 1 1 75 LYS C C 9.625 -8.225 2.132 1.00 . A A . 75 LYS C 1 1 3 4861 1 1 75 LYS CA C 10.827 -8.351 1.194 1.00 . A A . 75 LYS CA 1 1 3 4862 1 1 75 LYS CB C 12.122 -7.779 1.774 1.00 . A A . 75 LYS CB 1 1 3 4863 1 1 75 LYS CD C 13.337 -7.390 3.949 1.00 . A A . 75 LYS CD 1 1 3 4864 1 1 75 LYS CE C 14.745 -7.484 3.358 1.00 . A A . 75 LYS CE 1 1 3 4865 1 1 75 LYS CG C 12.363 -8.296 3.193 1.00 . A A . 75 LYS CG 1 1 3 4866 1 1 75 LYS H H 11.070 -6.916 -0.296 1.00 . A A . 75 LYS H 1 1 3 4867 1 1 75 LYS HA H 11.002 -9.409 0.997 1.00 . A A . 75 LYS HA 1 1 3 4868 1 1 75 LYS HB2 H 12.963 -8.052 1.136 1.00 . A A . 75 LYS HB2 1 1 3 4869 1 1 75 LYS HB3 H 12.071 -6.690 1.783 1.00 . A A . 75 LYS HB3 1 1 3 4870 1 1 75 LYS HD2 H 12.988 -6.358 3.905 1.00 . A A . 75 LYS HD2 1 1 3 4871 1 1 75 LYS HD3 H 13.362 -7.674 5.001 1.00 . A A . 75 LYS HD3 1 1 3 4872 1 1 75 LYS HE2 H 14.934 -8.501 3.014 1.00 . A A . 75 LYS HE2 1 1 3 4873 1 1 75 LYS HE3 H 14.824 -6.833 2.487 1.00 . A A . 75 LYS HE3 1 1 3 4874 1 1 75 LYS HG2 H 11.417 -8.347 3.731 1.00 . A A . 75 LYS HG2 1 1 3 4875 1 1 75 LYS HG3 H 12.762 -9.310 3.152 1.00 . A A . 75 LYS HG3 1 1 3 4876 1 1 75 LYS HZ1 H 16.595 -7.667 4.300 1.00 . A A . 75 LYS HZ1 1 1 3 4877 1 1 75 LYS HZ2 H 16.050 -6.133 4.260 1.00 . A A . 75 LYS HZ2 1 1 3 4878 1 1 75 LYS N N 10.514 -7.717 -0.075 1.00 . A A . 75 LYS N 1 1 3 4879 1 1 75 LYS NZ N 15.758 -7.098 4.366 1.00 . A A . 75 LYS NZ 1 1 3 4880 1 1 75 LYS O O 9.453 -9.038 3.039 1.00 . A A . 75 LYS O 1 1 3 4881 1 1 76 PHE C C 6.368 -7.098 1.861 1.00 . A A . 76 PHE C 1 1 3 4882 1 1 76 PHE CA C 7.644 -6.956 2.693 1.00 . A A . 76 PHE CA 1 1 3 4883 1 1 76 PHE CB C 7.760 -5.511 3.184 1.00 . A A . 76 PHE CB 1 1 3 4884 1 1 76 PHE CD1 C 8.942 -5.853 5.384 1.00 . A A . 76 PHE CD1 1 1 3 4885 1 1 76 PHE CD2 C 9.986 -4.466 3.741 1.00 . A A . 76 PHE CD2 1 1 3 4886 1 1 76 PHE CE1 C 10.048 -5.625 6.279 1.00 . A A . 76 PHE CE1 1 1 3 4887 1 1 76 PHE CE2 C 11.092 -4.239 4.635 1.00 . A A . 76 PHE CE2 1 1 3 4888 1 1 76 PHE CG C 8.935 -5.269 4.134 1.00 . A A . 76 PHE CG 1 1 3 4889 1 1 76 PHE CZ C 11.068 -4.829 5.860 1.00 . A A . 76 PHE CZ 1 1 3 4890 1 1 76 PHE H H 8.972 -6.543 1.142 1.00 . A A . 76 PHE H 1 1 3 4891 1 1 76 PHE HA H 7.630 -7.693 3.496 1.00 . A A . 76 PHE HA 1 1 3 4892 1 1 76 PHE HB2 H 7.862 -4.852 2.321 1.00 . A A . 76 PHE HB2 1 1 3 4893 1 1 76 PHE HB3 H 6.835 -5.234 3.688 1.00 . A A . 76 PHE HB3 1 1 3 4894 1 1 76 PHE HD1 H 8.112 -6.487 5.695 1.00 . A A . 76 PHE HD1 1 1 3 4895 1 1 76 PHE HD2 H 9.980 -4.005 2.753 1.00 . A A . 76 PHE HD2 1 1 3 4896 1 1 76 PHE HE1 H 10.066 -6.081 7.269 1.00 . A A . 76 PHE HE1 1 1 3 4897 1 1 76 PHE HE2 H 11.929 -3.607 4.337 1.00 . A A . 76 PHE HE2 1 1 3 4898 1 1 76 PHE HZ H 11.888 -4.732 6.616 1.00 . A A . 76 PHE HZ 1 1 3 4899 1 1 76 PHE N N 8.825 -7.199 1.882 1.00 . A A . 76 PHE N 1 1 3 4900 1 1 76 PHE O O 6.397 -6.940 0.641 1.00 . A A . 76 PHE O 1 1 3 4901 1 1 77 LYS C C 3.574 -6.232 1.264 1.00 . A A . 77 LYS C 1 1 3 4902 1 1 77 LYS CA C 3.994 -7.561 1.893 1.00 . A A . 77 LYS CA 1 1 3 4903 1 1 77 LYS CB C 2.962 -8.135 2.866 1.00 . A A . 77 LYS CB 1 1 3 4904 1 1 77 LYS CD C 2.514 -10.022 4.478 1.00 . A A . 77 LYS CD 1 1 3 4905 1 1 77 LYS CE C 2.743 -11.507 4.768 1.00 . A A . 77 LYS CE 1 1 3 4906 1 1 77 LYS CG C 3.315 -9.573 3.254 1.00 . A A . 77 LYS CG 1 1 3 4907 1 1 77 LYS H H 5.263 -7.522 3.545 1.00 . A A . 77 LYS H 1 1 3 4908 1 1 77 LYS HA H 4.129 -8.293 1.097 1.00 . A A . 77 LYS HA 1 1 3 4909 1 1 77 LYS HB2 H 2.915 -7.514 3.760 1.00 . A A . 77 LYS HB2 1 1 3 4910 1 1 77 LYS HB3 H 1.973 -8.110 2.409 1.00 . A A . 77 LYS HB3 1 1 3 4911 1 1 77 LYS HD2 H 2.805 -9.429 5.345 1.00 . A A . 77 LYS HD2 1 1 3 4912 1 1 77 LYS HD3 H 1.452 -9.840 4.309 1.00 . A A . 77 LYS HD3 1 1 3 4913 1 1 77 LYS HE2 H 3.727 -11.806 4.407 1.00 . A A . 77 LYS HE2 1 1 3 4914 1 1 77 LYS HE3 H 2.732 -11.679 5.844 1.00 . A A . 77 LYS HE3 1 1 3 4915 1 1 77 LYS HG2 H 3.110 -10.240 2.416 1.00 . A A . 77 LYS HG2 1 1 3 4916 1 1 77 LYS HG3 H 4.381 -9.645 3.466 1.00 . A A . 77 LYS HG3 1 1 3 4917 1 1 77 LYS HZ1 H 0.870 -12.419 4.697 1.00 . A A . 77 LYS HZ1 1 1 3 4918 1 1 77 LYS HZ2 H 1.396 -11.932 3.235 1.00 . A A . 77 LYS HZ2 1 1 3 4919 1 1 77 LYS N N 5.278 -7.395 2.553 1.00 . A A . 77 LYS N 1 1 3 4920 1 1 77 LYS NZ N 1.698 -12.329 4.118 1.00 . A A . 77 LYS NZ 1 1 3 4921 1 1 77 LYS O O 3.529 -5.206 1.942 1.00 . A A . 77 LYS O 1 1 3 4922 1 1 78 SER C C 1.336 -5.069 -0.870 1.00 . A A . 78 SER C 1 1 3 4923 1 1 78 SER CA C 2.861 -5.105 -0.754 1.00 . A A . 78 SER CA 1 1 3 4924 1 1 78 SER CB C 3.500 -5.060 -2.144 1.00 . A A . 78 SER CB 1 1 3 4925 1 1 78 SER H H 3.315 -7.130 -0.570 1.00 . A A . 78 SER H 1 1 3 4926 1 1 78 SER HA H 3.220 -4.263 -0.162 1.00 . A A . 78 SER HA 1 1 3 4927 1 1 78 SER HB2 H 4.012 -4.107 -2.276 1.00 . A A . 78 SER HB2 1 1 3 4928 1 1 78 SER HB3 H 4.256 -5.841 -2.220 1.00 . A A . 78 SER HB3 1 1 3 4929 1 1 78 SER HG H 2.993 -5.258 -4.069 1.00 . A A . 78 SER HG 1 1 3 4930 1 1 78 SER N N 3.276 -6.292 -0.026 1.00 . A A . 78 SER N 1 1 3 4931 1 1 78 SER O O 0.672 -6.090 -0.695 1.00 . A A . 78 SER O 1 1 3 4932 1 1 78 SER OG O 2.537 -5.229 -3.180 1.00 . A A . 78 SER OG 1 1 3 4933 1 1 79 CYS C C -1.150 -4.813 -2.206 1.00 . A A . 79 CYS C 1 1 3 4934 1 1 79 CYS CA C -0.610 -3.700 -1.306 1.00 . A A . 79 CYS CA 1 1 3 4935 1 1 79 CYS CB C -0.953 -2.311 -1.847 1.00 . A A . 79 CYS CB 1 1 3 4936 1 1 79 CYS H H 1.371 -3.058 -1.306 1.00 . A A . 79 CYS H 1 1 3 4937 1 1 79 CYS HA H -1.035 -3.773 -0.305 1.00 . A A . 79 CYS HA 1 1 3 4938 1 1 79 CYS HB2 H -0.617 -2.247 -2.882 1.00 . A A . 79 CYS HB2 1 1 3 4939 1 1 79 CYS HB3 H -2.037 -2.198 -1.857 1.00 . A A . 79 CYS HB3 1 1 3 4940 1 1 79 CYS N N 0.825 -3.883 -1.165 1.00 . A A . 79 CYS N 1 1 3 4941 1 1 79 CYS O O -1.908 -5.670 -1.755 1.00 . A A . 79 CYS O 1 1 3 4942 1 1 79 CYS SG S -0.226 -0.920 -0.907 1.00 . A A . 79 CYS SG 1 1 3 4943 1 1 80 VAL C C -0.654 -7.135 -4.010 1.00 . A A . 80 VAL C 1 1 3 4944 1 1 80 VAL CA C -1.170 -5.758 -4.433 1.00 . A A . 80 VAL CA 1 1 3 4945 1 1 80 VAL CB C -0.714 -5.354 -5.836 1.00 . A A . 80 VAL CB 1 1 3 4946 1 1 80 VAL CG1 C -1.078 -6.429 -6.862 1.00 . A A . 80 VAL CG1 1 1 3 4947 1 1 80 VAL CG2 C -1.299 -3.997 -6.233 1.00 . A A . 80 VAL CG2 1 1 3 4948 1 1 80 VAL H H -0.120 -4.065 -3.824 1.00 . A A . 80 VAL H 1 1 3 4949 1 1 80 VAL HA H -2.260 -5.774 -4.423 1.00 . A A . 80 VAL HA 1 1 3 4950 1 1 80 VAL HB H 0.372 -5.259 -5.822 1.00 . A A . 80 VAL HB 1 1 3 4951 1 1 80 VAL HG11 H -2.048 -6.858 -6.610 1.00 . A A . 80 VAL HG11 1 1 3 4952 1 1 80 VAL HG12 H -1.126 -5.983 -7.855 1.00 . A A . 80 VAL HG12 1 1 3 4953 1 1 80 VAL HG13 H -0.320 -7.213 -6.852 1.00 . A A . 80 VAL HG13 1 1 3 4954 1 1 80 VAL HG21 H -1.241 -3.314 -5.385 1.00 . A A . 80 VAL HG21 1 1 3 4955 1 1 80 VAL HG22 H -0.732 -3.587 -7.069 1.00 . A A . 80 VAL HG22 1 1 3 4956 1 1 80 VAL HG23 H -2.341 -4.123 -6.528 1.00 . A A . 80 VAL HG23 1 1 3 4957 1 1 80 VAL N N -0.737 -4.765 -3.465 1.00 . A A . 80 VAL N 1 1 3 4958 1 1 80 VAL O O -1.349 -8.137 -4.166 1.00 . A A . 80 VAL O 1 1 3 4959 1 1 81 GLY C C 0.242 -9.155 -2.112 1.00 . A A . 81 GLY C 1 1 3 4960 1 1 81 GLY CA C 1.179 -8.377 -3.037 1.00 . A A . 81 GLY CA 1 1 3 4961 1 1 81 GLY H H 1.121 -6.320 -3.360 1.00 . A A . 81 GLY H 1 1 3 4962 1 1 81 GLY HA2 H 1.437 -8.991 -3.900 1.00 . A A . 81 GLY HA2 1 1 3 4963 1 1 81 GLY HA3 H 2.110 -8.156 -2.515 1.00 . A A . 81 GLY HA3 1 1 3 4964 1 1 81 GLY N N 0.562 -7.140 -3.483 1.00 . A A . 81 GLY N 1 1 3 4965 1 1 81 GLY O O -0.116 -10.296 -2.402 1.00 . A A . 81 GLY O 1 1 3 4966 1 1 82 CYS C C -2.367 -9.375 -0.724 1.00 . A A . 82 CYS C 1 1 3 4967 1 1 82 CYS CA C -1.018 -9.125 -0.047 1.00 . A A . 82 CYS CA 1 1 3 4968 1 1 82 CYS CB C -1.160 -8.271 1.213 1.00 . A A . 82 CYS CB 1 1 3 4969 1 1 82 CYS H H 0.167 -7.580 -0.789 1.00 . A A . 82 CYS H 1 1 3 4970 1 1 82 CYS HA H -0.553 -10.066 0.249 1.00 . A A . 82 CYS HA 1 1 3 4971 1 1 82 CYS HB2 H -0.176 -8.046 1.624 1.00 . A A . 82 CYS HB2 1 1 3 4972 1 1 82 CYS HB3 H -1.628 -7.318 0.966 1.00 . A A . 82 CYS HB3 1 1 3 4973 1 1 82 CYS N N -0.129 -8.508 -1.017 1.00 . A A . 82 CYS N 1 1 3 4974 1 1 82 CYS O O -2.941 -10.455 -0.592 1.00 . A A . 82 CYS O 1 1 3 4975 1 1 82 CYS SG S -2.169 -9.155 2.458 1.00 . A A . 82 CYS SG 1 1 3 4976 1 1 83 HIS C C -4.116 -9.705 -3.011 1.00 . A A . 83 HIS C 1 1 3 4977 1 1 83 HIS CA C -4.106 -8.454 -2.130 1.00 . A A . 83 HIS CA 1 1 3 4978 1 1 83 HIS CB C -4.393 -7.173 -2.916 1.00 . A A . 83 HIS CB 1 1 3 4979 1 1 83 HIS CD2 C -4.782 -5.771 -0.744 1.00 . A A . 83 HIS CD2 1 1 3 4980 1 1 83 HIS CE1 C -6.039 -4.202 -1.607 1.00 . A A . 83 HIS CE1 1 1 3 4981 1 1 83 HIS CG C -4.933 -6.043 -2.072 1.00 . A A . 83 HIS CG 1 1 3 4982 1 1 83 HIS H H -2.361 -7.483 -1.535 1.00 . A A . 83 HIS H 1 1 3 4983 1 1 83 HIS HA H -4.876 -8.553 -1.364 1.00 . A A . 83 HIS HA 1 1 3 4984 1 1 83 HIS HB2 H -3.474 -6.844 -3.401 1.00 . A A . 83 HIS HB2 1 1 3 4985 1 1 83 HIS HB3 H -5.109 -7.397 -3.707 1.00 . A A . 83 HIS HB3 1 1 3 4986 1 1 83 HIS HD1 H -6.023 -4.953 -3.541 1.00 . A A . 83 HIS HD1 1 1 3 4987 1 1 83 HIS HD2 H -4.210 -6.367 -0.033 1.00 . A A . 83 HIS HD2 1 1 3 4988 1 1 83 HIS HE1 H -6.656 -3.308 -1.697 1.00 . A A . 83 HIS HE1 1 1 3 4989 1 1 83 HIS N N -2.835 -8.358 -1.433 1.00 . A A . 83 HIS N 1 1 3 4990 1 1 83 HIS ND1 N -5.730 -5.037 -2.589 1.00 . A A . 83 HIS ND1 1 1 3 4991 1 1 83 HIS NE2 N -5.450 -4.659 -0.465 1.00 . A A . 83 HIS NE2 1 1 3 4992 1 1 83 HIS O O -5.102 -10.439 -3.042 1.00 . A A . 83 HIS O 1 1 3 4993 1 1 84 VAL C C -3.117 -12.339 -3.783 1.00 . A A . 84 VAL C 1 1 3 4994 1 1 84 VAL CA C -2.874 -11.058 -4.584 1.00 . A A . 84 VAL CA 1 1 3 4995 1 1 84 VAL CB C -1.509 -11.035 -5.275 1.00 . A A . 84 VAL CB 1 1 3 4996 1 1 84 VAL CG1 C -1.281 -12.315 -6.082 1.00 . A A . 84 VAL CG1 1 1 3 4997 1 1 84 VAL CG2 C -1.364 -9.795 -6.161 1.00 . A A . 84 VAL CG2 1 1 3 4998 1 1 84 VAL H H -2.208 -9.308 -3.673 1.00 . A A . 84 VAL H 1 1 3 4999 1 1 84 VAL HA H -3.643 -10.974 -5.352 1.00 . A A . 84 VAL HA 1 1 3 5000 1 1 84 VAL HB H -0.743 -10.985 -4.502 1.00 . A A . 84 VAL HB 1 1 3 5001 1 1 84 VAL HG11 H -1.969 -13.088 -5.739 1.00 . A A . 84 VAL HG11 1 1 3 5002 1 1 84 VAL HG12 H -1.457 -12.114 -7.139 1.00 . A A . 84 VAL HG12 1 1 3 5003 1 1 84 VAL HG13 H -0.255 -12.654 -5.942 1.00 . A A . 84 VAL HG13 1 1 3 5004 1 1 84 VAL HG21 H -2.250 -9.169 -6.057 1.00 . A A . 84 VAL HG21 1 1 3 5005 1 1 84 VAL HG22 H -0.482 -9.232 -5.855 1.00 . A A . 84 VAL HG22 1 1 3 5006 1 1 84 VAL HG23 H -1.257 -10.103 -7.201 1.00 . A A . 84 VAL HG23 1 1 3 5007 1 1 84 VAL N N -3.006 -9.909 -3.705 1.00 . A A . 84 VAL N 1 1 3 5008 1 1 84 VAL O O -3.733 -13.280 -4.281 1.00 . A A . 84 VAL O 1 1 3 5009 1 1 85 GLU C C -4.207 -13.559 -1.150 1.00 . A A . 85 GLU C 1 1 3 5010 1 1 85 GLU CA C -2.773 -13.483 -1.680 1.00 . A A . 85 GLU CA 1 1 3 5011 1 1 85 GLU CB C -1.766 -13.436 -0.530 1.00 . A A . 85 GLU CB 1 1 3 5012 1 1 85 GLU CD C -0.428 -15.435 0.229 1.00 . A A . 85 GLU CD 1 1 3 5013 1 1 85 GLU CG C -0.559 -14.330 -0.821 1.00 . A A . 85 GLU CG 1 1 3 5014 1 1 85 GLU H H -2.119 -11.564 -2.157 1.00 . A A . 85 GLU H 1 1 3 5015 1 1 85 GLU HA H -2.563 -14.352 -2.304 1.00 . A A . 85 GLU HA 1 1 3 5016 1 1 85 GLU HB2 H -1.434 -12.410 -0.374 1.00 . A A . 85 GLU HB2 1 1 3 5017 1 1 85 GLU HB3 H -2.247 -13.759 0.394 1.00 . A A . 85 GLU HB3 1 1 3 5018 1 1 85 GLU HG2 H -0.662 -14.775 -1.811 1.00 . A A . 85 GLU HG2 1 1 3 5019 1 1 85 GLU HG3 H 0.349 -13.728 -0.835 1.00 . A A . 85 GLU HG3 1 1 3 5020 1 1 85 GLU N N -2.619 -12.334 -2.555 1.00 . A A . 85 GLU N 1 1 3 5021 1 1 85 GLU O O -4.740 -14.648 -0.945 1.00 . A A . 85 GLU O 1 1 3 5022 1 1 85 GLU OE1 O -1.433 -16.151 0.427 1.00 . A A . 85 GLU OE1 1 1 3 5023 1 1 85 GLU OE2 O 0.674 -15.539 0.809 1.00 . A A . 85 GLU OE2 1 1 3 5024 1 1 86 VAL C C -7.124 -12.706 -1.553 1.00 . A A . 86 VAL C 1 1 3 5025 1 1 86 VAL CA C -6.151 -12.306 -0.442 1.00 . A A . 86 VAL CA 1 1 3 5026 1 1 86 VAL CB C -6.422 -10.907 0.114 1.00 . A A . 86 VAL CB 1 1 3 5027 1 1 86 VAL CG1 C -7.869 -10.777 0.592 1.00 . A A . 86 VAL CG1 1 1 3 5028 1 1 86 VAL CG2 C -5.440 -10.564 1.237 1.00 . A A . 86 VAL CG2 1 1 3 5029 1 1 86 VAL H H -4.349 -11.505 -1.114 1.00 . A A . 86 VAL H 1 1 3 5030 1 1 86 VAL HA H -6.242 -13.019 0.377 1.00 . A A . 86 VAL HA 1 1 3 5031 1 1 86 VAL HB H -6.270 -10.190 -0.693 1.00 . A A . 86 VAL HB 1 1 3 5032 1 1 86 VAL HG11 H -8.535 -11.243 -0.134 1.00 . A A . 86 VAL HG11 1 1 3 5033 1 1 86 VAL HG12 H -7.979 -11.274 1.556 1.00 . A A . 86 VAL HG12 1 1 3 5034 1 1 86 VAL HG13 H -8.125 -9.723 0.695 1.00 . A A . 86 VAL HG13 1 1 3 5035 1 1 86 VAL HG21 H -4.457 -10.969 0.996 1.00 . A A . 86 VAL HG21 1 1 3 5036 1 1 86 VAL HG22 H -5.372 -9.481 1.342 1.00 . A A . 86 VAL HG22 1 1 3 5037 1 1 86 VAL HG23 H -5.793 -10.998 2.172 1.00 . A A . 86 VAL HG23 1 1 3 5038 1 1 86 VAL N N -4.790 -12.387 -0.945 1.00 . A A . 86 VAL N 1 1 3 5039 1 1 86 VAL O O -7.975 -13.573 -1.356 1.00 . A A . 86 VAL O 1 1 3 5040 1 1 87 ALA C C -7.583 -13.767 -4.314 1.00 . A A . 87 ALA C 1 1 3 5041 1 1 87 ALA CA C -7.822 -12.332 -3.838 1.00 . A A . 87 ALA CA 1 1 3 5042 1 1 87 ALA CB C -7.556 -11.302 -4.937 1.00 . A A . 87 ALA CB 1 1 3 5043 1 1 87 ALA H H -6.274 -11.352 -2.849 1.00 . A A . 87 ALA H 1 1 3 5044 1 1 87 ALA HA H -8.857 -12.235 -3.510 1.00 . A A . 87 ALA HA 1 1 3 5045 1 1 87 ALA HB1 H -7.694 -10.298 -4.536 1.00 . A A . 87 ALA HB1 1 1 3 5046 1 1 87 ALA HB2 H -6.533 -11.411 -5.298 1.00 . A A . 87 ALA HB2 1 1 3 5047 1 1 87 ALA HB3 H -8.250 -11.462 -5.762 1.00 . A A . 87 ALA HB3 1 1 3 5048 1 1 87 ALA N N -6.968 -12.055 -2.696 1.00 . A A . 87 ALA N 1 1 3 5049 1 1 87 ALA O O -8.496 -14.418 -4.817 1.00 . A A . 87 ALA O 1 1 3 5050 1 1 88 GLY C C -6.507 -15.879 -5.942 1.00 . A A . 88 GLY C 1 1 3 5051 1 1 88 GLY CA C -5.977 -15.561 -4.542 1.00 . A A . 88 GLY CA 1 1 3 5052 1 1 88 GLY H H -5.611 -13.680 -3.726 1.00 . A A . 88 GLY H 1 1 3 5053 1 1 88 GLY HA2 H -4.892 -15.662 -4.528 1.00 . A A . 88 GLY HA2 1 1 3 5054 1 1 88 GLY HA3 H -6.373 -16.282 -3.827 1.00 . A A . 88 GLY HA3 1 1 3 5055 1 1 88 GLY N N -6.349 -14.216 -4.137 1.00 . A A . 88 GLY N 1 1 3 5056 1 1 88 GLY O O -5.944 -15.430 -6.939 1.00 . A A . 88 GLY O 1 1 3 5057 1 1 89 ALA C C -9.705 -16.784 -7.158 1.00 . A A . 89 ALA C 1 1 3 5058 1 1 89 ALA CA C -8.197 -17.032 -7.232 1.00 . A A . 89 ALA CA 1 1 3 5059 1 1 89 ALA CB C -7.860 -18.492 -7.541 1.00 . A A . 89 ALA CB 1 1 3 5060 1 1 89 ALA H H -8.037 -17.009 -5.155 1.00 . A A . 89 ALA H 1 1 3 5061 1 1 89 ALA HA H -7.771 -16.401 -8.012 1.00 . A A . 89 ALA HA 1 1 3 5062 1 1 89 ALA HB1 H -8.234 -19.128 -6.738 1.00 . A A . 89 ALA HB1 1 1 3 5063 1 1 89 ALA HB2 H -8.327 -18.782 -8.482 1.00 . A A . 89 ALA HB2 1 1 3 5064 1 1 89 ALA HB3 H -6.779 -18.607 -7.621 1.00 . A A . 89 ALA HB3 1 1 3 5065 1 1 89 ALA N N -7.585 -16.649 -5.971 1.00 . A A . 89 ALA N 1 1 3 5066 1 1 89 ALA O O -10.495 -17.726 -7.201 1.00 . A A . 89 ALA O 1 1 3 5067 1 1 90 ASP C C -11.846 -14.364 -8.234 1.00 . A A . 90 ASP C 1 1 3 5068 1 1 90 ASP CA C -11.458 -15.128 -6.967 1.00 . A A . 90 ASP CA 1 1 3 5069 1 1 90 ASP CB C -11.710 -14.214 -5.766 1.00 . A A . 90 ASP CB 1 1 3 5070 1 1 90 ASP CG C -13.142 -13.693 -5.640 1.00 . A A . 90 ASP CG 1 1 3 5071 1 1 90 ASP H H -9.409 -14.752 -7.013 1.00 . A A . 90 ASP H 1 1 3 5072 1 1 90 ASP HA H -12.005 -16.065 -6.860 1.00 . A A . 90 ASP HA 1 1 3 5073 1 1 90 ASP HB2 H -11.455 -14.757 -4.856 1.00 . A A . 90 ASP HB2 1 1 3 5074 1 1 90 ASP HB3 H -11.033 -13.362 -5.829 1.00 . A A . 90 ASP HB3 1 1 3 5075 1 1 90 ASP N N -10.058 -15.512 -7.048 1.00 . A A . 90 ASP N 1 1 3 5076 1 1 90 ASP O O -12.984 -14.452 -8.691 1.00 . A A . 90 ASP O 1 1 3 5077 1 1 90 ASP OD1 O -13.686 -13.268 -6.683 1.00 . A A . 90 ASP OD1 1 1 3 5078 1 1 90 ASP OD2 O -13.662 -13.730 -4.504 1.00 . A A . 90 ASP OD2 1 1 3 5079 1 1 91 ALA C C -11.762 -11.520 -9.594 1.00 . A A . 91 ALA C 1 1 3 5080 1 1 91 ALA CA C -11.106 -12.851 -9.969 1.00 . A A . 91 ALA CA 1 1 3 5081 1 1 91 ALA CB C -11.953 -13.662 -10.951 1.00 . A A . 91 ALA CB 1 1 3 5082 1 1 91 ALA H H -9.955 -13.565 -8.386 1.00 . A A . 91 ALA H 1 1 3 5083 1 1 91 ALA HA H -10.135 -12.652 -10.424 1.00 . A A . 91 ALA HA 1 1 3 5084 1 1 91 ALA HB1 H -11.975 -14.705 -10.636 1.00 . A A . 91 ALA HB1 1 1 3 5085 1 1 91 ALA HB2 H -12.968 -13.266 -10.967 1.00 . A A . 91 ALA HB2 1 1 3 5086 1 1 91 ALA HB3 H -11.519 -13.593 -11.948 1.00 . A A . 91 ALA HB3 1 1 3 5087 1 1 91 ALA N N -10.879 -13.630 -8.764 1.00 . A A . 91 ALA N 1 1 3 5088 1 1 91 ALA O O -11.103 -10.481 -9.578 1.00 . A A . 91 ALA O 1 1 3 5089 1 1 92 ALA C C -12.972 -9.566 -7.959 1.00 . A A . 92 ALA C 1 1 3 5090 1 1 92 ALA CA C -13.804 -10.409 -8.927 1.00 . A A . 92 ALA CA 1 1 3 5091 1 1 92 ALA CB C -15.149 -10.826 -8.329 1.00 . A A . 92 ALA CB 1 1 3 5092 1 1 92 ALA H H -13.580 -12.444 -9.315 1.00 . A A . 92 ALA H 1 1 3 5093 1 1 92 ALA HA H -13.986 -9.833 -9.834 1.00 . A A . 92 ALA HA 1 1 3 5094 1 1 92 ALA HB1 H -14.993 -11.625 -7.604 1.00 . A A . 92 ALA HB1 1 1 3 5095 1 1 92 ALA HB2 H -15.608 -9.970 -7.834 1.00 . A A . 92 ALA HB2 1 1 3 5096 1 1 92 ALA HB3 H -15.806 -11.180 -9.124 1.00 . A A . 92 ALA HB3 1 1 3 5097 1 1 92 ALA N N -13.052 -11.595 -9.300 1.00 . A A . 92 ALA N 1 1 3 5098 1 1 92 ALA O O -12.968 -8.339 -8.043 1.00 . A A . 92 ALA O 1 1 3 5099 1 1 93 LYS C C -10.106 -9.234 -6.713 1.00 . A A . 93 LYS C 1 1 3 5100 1 1 93 LYS CA C -11.452 -9.589 -6.077 1.00 . A A . 93 LYS CA 1 1 3 5101 1 1 93 LYS CB C -11.330 -10.439 -4.811 1.00 . A A . 93 LYS CB 1 1 3 5102 1 1 93 LYS CD C -12.548 -11.366 -2.807 1.00 . A A . 93 LYS CD 1 1 3 5103 1 1 93 LYS CE C -13.933 -11.655 -2.226 1.00 . A A . 93 LYS CE 1 1 3 5104 1 1 93 LYS CG C -12.646 -10.454 -4.031 1.00 . A A . 93 LYS CG 1 1 3 5105 1 1 93 LYS H H -12.294 -11.257 -6.999 1.00 . A A . 93 LYS H 1 1 3 5106 1 1 93 LYS HA H -11.956 -8.664 -5.797 1.00 . A A . 93 LYS HA 1 1 3 5107 1 1 93 LYS HB2 H -11.049 -11.458 -5.077 1.00 . A A . 93 LYS HB2 1 1 3 5108 1 1 93 LYS HB3 H -10.533 -10.045 -4.180 1.00 . A A . 93 LYS HB3 1 1 3 5109 1 1 93 LYS HD2 H -12.064 -12.303 -3.085 1.00 . A A . 93 LYS HD2 1 1 3 5110 1 1 93 LYS HD3 H -11.922 -10.897 -2.048 1.00 . A A . 93 LYS HD3 1 1 3 5111 1 1 93 LYS HE2 H -14.404 -10.723 -1.912 1.00 . A A . 93 LYS HE2 1 1 3 5112 1 1 93 LYS HE3 H -14.573 -12.092 -2.993 1.00 . A A . 93 LYS HE3 1 1 3 5113 1 1 93 LYS HG2 H -12.897 -9.441 -3.715 1.00 . A A . 93 LYS HG2 1 1 3 5114 1 1 93 LYS HG3 H -13.453 -10.795 -4.680 1.00 . A A . 93 LYS HG3 1 1 3 5115 1 1 93 LYS HZ1 H -14.342 -13.439 -1.228 1.00 . A A . 93 LYS HZ1 1 1 3 5116 1 1 93 LYS HZ2 H -12.869 -12.838 -0.880 1.00 . A A . 93 LYS HZ2 1 1 3 5117 1 1 93 LYS N N -12.286 -10.259 -7.061 1.00 . A A . 93 LYS N 1 1 3 5118 1 1 93 LYS NZ N -13.830 -12.577 -1.073 1.00 . A A . 93 LYS NZ 1 1 3 5119 1 1 93 LYS O O -9.529 -8.191 -6.411 1.00 . A A . 93 LYS O 1 1 3 5120 1 1 94 LYS C C -8.481 -8.686 -9.161 1.00 . A A . 94 LYS C 1 1 3 5121 1 1 94 LYS CA C -8.378 -9.918 -8.260 1.00 . A A . 94 LYS CA 1 1 3 5122 1 1 94 LYS CB C -7.955 -11.189 -9.000 1.00 . A A . 94 LYS CB 1 1 3 5123 1 1 94 LYS CD C -5.860 -12.575 -8.782 1.00 . A A . 94 LYS CD 1 1 3 5124 1 1 94 LYS CE C -4.781 -13.041 -9.763 1.00 . A A . 94 LYS CE 1 1 3 5125 1 1 94 LYS CG C -6.439 -11.224 -9.206 1.00 . A A . 94 LYS CG 1 1 3 5126 1 1 94 LYS H H -10.121 -10.970 -7.819 1.00 . A A . 94 LYS H 1 1 3 5127 1 1 94 LYS HA H -7.625 -9.724 -7.496 1.00 . A A . 94 LYS HA 1 1 3 5128 1 1 94 LYS HB2 H -8.269 -12.066 -8.435 1.00 . A A . 94 LYS HB2 1 1 3 5129 1 1 94 LYS HB3 H -8.458 -11.235 -9.966 1.00 . A A . 94 LYS HB3 1 1 3 5130 1 1 94 LYS HD2 H -5.436 -12.495 -7.781 1.00 . A A . 94 LYS HD2 1 1 3 5131 1 1 94 LYS HD3 H -6.656 -13.317 -8.733 1.00 . A A . 94 LYS HD3 1 1 3 5132 1 1 94 LYS HE2 H -5.092 -13.971 -10.239 1.00 . A A . 94 LYS HE2 1 1 3 5133 1 1 94 LYS HE3 H -4.658 -12.303 -10.555 1.00 . A A . 94 LYS HE3 1 1 3 5134 1 1 94 LYS HG2 H -6.206 -11.038 -10.255 1.00 . A A . 94 LYS HG2 1 1 3 5135 1 1 94 LYS HG3 H -5.971 -10.427 -8.629 1.00 . A A . 94 LYS HG3 1 1 3 5136 1 1 94 LYS HZ1 H -3.043 -14.108 -9.336 1.00 . A A . 94 LYS HZ1 1 1 3 5137 1 1 94 LYS HZ2 H -2.837 -12.495 -9.250 1.00 . A A . 94 LYS HZ2 1 1 3 5138 1 1 94 LYS N N -9.645 -10.124 -7.580 1.00 . A A . 94 LYS N 1 1 3 5139 1 1 94 LYS NZ N -3.494 -13.243 -9.060 1.00 . A A . 94 LYS NZ 1 1 3 5140 1 1 94 LYS O O -7.479 -8.223 -9.703 1.00 . A A . 94 LYS O 1 1 3 5141 1 1 95 LYS C C -10.423 -5.868 -9.237 1.00 . A A . 95 LYS C 1 1 3 5142 1 1 95 LYS CA C -9.951 -7.023 -10.122 1.00 . A A . 95 LYS CA 1 1 3 5143 1 1 95 LYS CB C -10.920 -7.365 -11.256 1.00 . A A . 95 LYS CB 1 1 3 5144 1 1 95 LYS CD C -10.971 -7.639 -13.762 1.00 . A A . 95 LYS CD 1 1 3 5145 1 1 95 LYS CE C -9.916 -8.597 -14.319 1.00 . A A . 95 LYS CE 1 1 3 5146 1 1 95 LYS CG C -10.410 -6.826 -12.594 1.00 . A A . 95 LYS CG 1 1 3 5147 1 1 95 LYS H H -10.513 -8.575 -8.851 1.00 . A A . 95 LYS H 1 1 3 5148 1 1 95 LYS HA H -9.004 -6.741 -10.582 1.00 . A A . 95 LYS HA 1 1 3 5149 1 1 95 LYS HB2 H -11.045 -8.446 -11.319 1.00 . A A . 95 LYS HB2 1 1 3 5150 1 1 95 LYS HB3 H -11.902 -6.943 -11.040 1.00 . A A . 95 LYS HB3 1 1 3 5151 1 1 95 LYS HD2 H -11.842 -8.205 -13.431 1.00 . A A . 95 LYS HD2 1 1 3 5152 1 1 95 LYS HD3 H -11.309 -6.966 -14.550 1.00 . A A . 95 LYS HD3 1 1 3 5153 1 1 95 LYS HE2 H -10.126 -8.809 -15.368 1.00 . A A . 95 LYS HE2 1 1 3 5154 1 1 95 LYS HE3 H -8.933 -8.128 -14.280 1.00 . A A . 95 LYS HE3 1 1 3 5155 1 1 95 LYS HG2 H -10.699 -5.780 -12.703 1.00 . A A . 95 LYS HG2 1 1 3 5156 1 1 95 LYS HG3 H -9.321 -6.859 -12.613 1.00 . A A . 95 LYS HG3 1 1 3 5157 1 1 95 LYS HZ1 H -9.128 -10.459 -13.813 1.00 . A A . 95 LYS HZ1 1 1 3 5158 1 1 95 LYS HZ2 H -9.813 -9.692 -12.550 1.00 . A A . 95 LYS HZ2 1 1 3 5159 1 1 95 LYS N N -9.703 -8.192 -9.295 1.00 . A A . 95 LYS N 1 1 3 5160 1 1 95 LYS NZ N -9.901 -9.859 -13.546 1.00 . A A . 95 LYS NZ 1 1 3 5161 1 1 95 LYS O O -10.508 -4.728 -9.691 1.00 . A A . 95 LYS O 1 1 3 5162 1 1 96 ASP C C -10.139 -5.049 -5.927 1.00 . A A . 96 ASP C 1 1 3 5163 1 1 96 ASP CA C -11.180 -5.208 -7.037 1.00 . A A . 96 ASP CA 1 1 3 5164 1 1 96 ASP CB C -12.499 -5.635 -6.390 1.00 . A A . 96 ASP CB 1 1 3 5165 1 1 96 ASP CG C -13.721 -4.815 -6.812 1.00 . A A . 96 ASP CG 1 1 3 5166 1 1 96 ASP H H -10.646 -7.132 -7.628 1.00 . A A . 96 ASP H 1 1 3 5167 1 1 96 ASP HA H -11.313 -4.295 -7.618 1.00 . A A . 96 ASP HA 1 1 3 5168 1 1 96 ASP HB2 H -12.682 -6.682 -6.631 1.00 . A A . 96 ASP HB2 1 1 3 5169 1 1 96 ASP HB3 H -12.393 -5.570 -5.307 1.00 . A A . 96 ASP HB3 1 1 3 5170 1 1 96 ASP N N -10.718 -6.203 -7.990 1.00 . A A . 96 ASP N 1 1 3 5171 1 1 96 ASP O O -10.293 -4.209 -5.042 1.00 . A A . 96 ASP O 1 1 3 5172 1 1 96 ASP OD1 O -14.155 -4.999 -7.969 1.00 . A A . 96 ASP OD1 1 1 3 5173 1 1 96 ASP OD2 O -14.193 -4.024 -5.967 1.00 . A A . 96 ASP OD2 1 1 3 5174 1 1 97 LEU C C -6.706 -5.555 -5.727 1.00 . A A . 97 LEU C 1 1 3 5175 1 1 97 LEU CA C -8.036 -5.831 -5.024 1.00 . A A . 97 LEU CA 1 1 3 5176 1 1 97 LEU CB C -8.035 -7.111 -4.186 1.00 . A A . 97 LEU CB 1 1 3 5177 1 1 97 LEU CD1 C -8.940 -8.418 -2.229 1.00 . A A . 97 LEU CD1 1 1 3 5178 1 1 97 LEU CD2 C -9.512 -5.961 -2.496 1.00 . A A . 97 LEU CD2 1 1 3 5179 1 1 97 LEU CG C -9.204 -7.278 -3.213 1.00 . A A . 97 LEU CG 1 1 3 5180 1 1 97 LEU H H -8.984 -6.549 -6.734 1.00 . A A . 97 LEU H 1 1 3 5181 1 1 97 LEU HA H -8.247 -5.003 -4.347 1.00 . A A . 97 LEU HA 1 1 3 5182 1 1 97 LEU HB2 H -8.027 -7.965 -4.864 1.00 . A A . 97 LEU HB2 1 1 3 5183 1 1 97 LEU HB3 H -7.106 -7.148 -3.617 1.00 . A A . 97 LEU HB3 1 1 3 5184 1 1 97 LEU HD11 H -8.645 -9.312 -2.779 1.00 . A A . 97 LEU HD11 1 1 3 5185 1 1 97 LEU HD12 H -8.140 -8.132 -1.546 1.00 . A A . 97 LEU HD12 1 1 3 5186 1 1 97 LEU HD13 H -9.847 -8.624 -1.660 1.00 . A A . 97 LEU HD13 1 1 3 5187 1 1 97 LEU HD21 H -8.579 -5.479 -2.205 1.00 . A A . 97 LEU HD21 1 1 3 5188 1 1 97 LEU HD22 H -10.068 -5.304 -3.166 1.00 . A A . 97 LEU HD22 1 1 3 5189 1 1 97 LEU HD23 H -10.109 -6.163 -1.607 1.00 . A A . 97 LEU HD23 1 1 3 5190 1 1 97 LEU HG H -10.090 -7.547 -3.787 1.00 . A A . 97 LEU HG 1 1 3 5191 1 1 97 LEU N N -9.102 -5.869 -6.010 1.00 . A A . 97 LEU N 1 1 3 5192 1 1 97 LEU O O -5.929 -4.710 -5.284 1.00 . A A . 97 LEU O 1 1 3 5193 1 1 98 THR C C -5.574 -5.588 -8.977 1.00 . A A . 98 THR C 1 1 3 5194 1 1 98 THR CA C -5.260 -6.127 -7.580 1.00 . A A . 98 THR CA 1 1 3 5195 1 1 98 THR CB C -4.538 -7.476 -7.597 1.00 . A A . 98 THR CB 1 1 3 5196 1 1 98 THR CG2 C -4.638 -8.211 -6.259 1.00 . A A . 98 THR CG2 1 1 3 5197 1 1 98 THR H H -7.121 -6.968 -7.165 1.00 . A A . 98 THR H 1 1 3 5198 1 1 98 THR HA H -4.635 -5.385 -7.084 1.00 . A A . 98 THR HA 1 1 3 5199 1 1 98 THR HB H -3.497 -7.356 -7.898 1.00 . A A . 98 THR HB 1 1 3 5200 1 1 98 THR HG1 H -6.221 -8.432 -8.105 1.00 . A A . 98 THR HG1 1 1 3 5201 1 1 98 THR HG21 H -5.683 -8.271 -5.954 1.00 . A A . 98 THR HG21 1 1 3 5202 1 1 98 THR HG22 H -4.233 -9.217 -6.365 1.00 . A A . 98 THR HG22 1 1 3 5203 1 1 98 THR HG23 H -4.070 -7.668 -5.503 1.00 . A A . 98 THR HG23 1 1 3 5204 1 1 98 THR N N -6.484 -6.283 -6.811 1.00 . A A . 98 THR N 1 1 3 5205 1 1 98 THR O O -4.731 -5.644 -9.871 1.00 . A A . 98 THR O 1 1 3 5206 1 1 98 THR OG1 O -5.311 -8.273 -8.489 1.00 . A A . 98 THR OG1 1 1 3 5207 1 1 99 GLY C C -6.374 -3.321 -10.790 1.00 . A A . 99 GLY C 1 1 3 5208 1 1 99 GLY CA C -7.223 -4.531 -10.395 1.00 . A A . 99 GLY CA 1 1 3 5209 1 1 99 GLY H H -7.468 -5.037 -8.389 1.00 . A A . 99 GLY H 1 1 3 5210 1 1 99 GLY HA2 H -7.153 -5.296 -11.167 1.00 . A A . 99 GLY HA2 1 1 3 5211 1 1 99 GLY HA3 H -8.271 -4.238 -10.330 1.00 . A A . 99 GLY HA3 1 1 3 5212 1 1 99 GLY N N -6.788 -5.079 -9.122 1.00 . A A . 99 GLY N 1 1 3 5213 1 1 99 GLY O O -5.837 -2.627 -9.928 1.00 . A A . 99 GLY O 1 1 3 5214 1 1 100 CYS C C -6.434 -0.786 -12.762 1.00 . A A . 100 CYS C 1 1 3 5215 1 1 100 CYS CA C -5.503 -1.992 -12.613 1.00 . A A . 100 CYS CA 1 1 3 5216 1 1 100 CYS CB C -4.816 -2.348 -13.933 1.00 . A A . 100 CYS CB 1 1 3 5217 1 1 100 CYS H H -6.719 -3.674 -12.788 1.00 . A A . 100 CYS H 1 1 3 5218 1 1 100 CYS HA H -4.720 -1.788 -11.884 1.00 . A A . 100 CYS HA 1 1 3 5219 1 1 100 CYS HB2 H -5.438 -3.065 -14.468 1.00 . A A . 100 CYS HB2 1 1 3 5220 1 1 100 CYS HB3 H -4.759 -1.452 -14.550 1.00 . A A . 100 CYS HB3 1 1 3 5221 1 1 100 CYS N N -6.279 -3.105 -12.094 1.00 . A A . 100 CYS N 1 1 3 5222 1 1 100 CYS O O -6.120 0.306 -12.293 1.00 . A A . 100 CYS O 1 1 3 5223 1 1 100 CYS SG S -3.134 -3.047 -13.758 1.00 . A A . 100 CYS SG 1 1 3 5224 1 1 101 LYS C C -9.917 -0.465 -13.189 1.00 . A A . 101 LYS C 1 1 3 5225 1 1 101 LYS CA C -8.539 0.026 -13.634 1.00 . A A . 101 LYS CA 1 1 3 5226 1 1 101 LYS CB C -8.496 0.506 -15.086 1.00 . A A . 101 LYS CB 1 1 3 5227 1 1 101 LYS CD C -10.882 0.882 -15.811 1.00 . A A . 101 LYS CD 1 1 3 5228 1 1 101 LYS CE C -11.002 0.907 -17.336 1.00 . A A . 101 LYS CE 1 1 3 5229 1 1 101 LYS CG C -9.584 1.549 -15.351 1.00 . A A . 101 LYS CG 1 1 3 5230 1 1 101 LYS H H -7.808 -1.918 -13.796 1.00 . A A . 101 LYS H 1 1 3 5231 1 1 101 LYS HA H -8.254 0.871 -13.007 1.00 . A A . 101 LYS HA 1 1 3 5232 1 1 101 LYS HB2 H -7.517 0.934 -15.304 1.00 . A A . 101 LYS HB2 1 1 3 5233 1 1 101 LYS HB3 H -8.629 -0.342 -15.758 1.00 . A A . 101 LYS HB3 1 1 3 5234 1 1 101 LYS HD2 H -10.910 -0.149 -15.457 1.00 . A A . 101 LYS HD2 1 1 3 5235 1 1 101 LYS HD3 H -11.736 1.394 -15.366 1.00 . A A . 101 LYS HD3 1 1 3 5236 1 1 101 LYS HE2 H -12.035 1.107 -17.622 1.00 . A A . 101 LYS HE2 1 1 3 5237 1 1 101 LYS HE3 H -10.397 1.719 -17.740 1.00 . A A . 101 LYS HE3 1 1 3 5238 1 1 101 LYS HG2 H -9.769 2.126 -14.445 1.00 . A A . 101 LYS HG2 1 1 3 5239 1 1 101 LYS HG3 H -9.243 2.251 -16.112 1.00 . A A . 101 LYS HG3 1 1 3 5240 1 1 101 LYS HZ1 H -11.090 -0.629 -18.741 1.00 . A A . 101 LYS HZ1 1 1 3 5241 1 1 101 LYS HZ2 H -9.584 -0.364 -18.182 1.00 . A A . 101 LYS HZ2 1 1 3 5242 1 1 101 LYS N N -7.561 -1.026 -13.417 1.00 . A A . 101 LYS N 1 1 3 5243 1 1 101 LYS NZ N -10.561 -0.383 -17.912 1.00 . A A . 101 LYS NZ 1 1 3 5244 1 1 101 LYS O O -10.277 -1.617 -13.428 1.00 . A A . 101 LYS O 1 1 3 5245 1 1 102 LYS C C -11.871 -0.858 -10.884 1.00 . A A . 102 LYS C 1 1 3 5246 1 1 102 LYS CA C -11.984 0.104 -12.068 1.00 . A A . 102 LYS CA 1 1 3 5247 1 1 102 LYS CB C -12.851 -0.428 -13.212 1.00 . A A . 102 LYS CB 1 1 3 5248 1 1 102 LYS CD C -15.236 -0.768 -13.954 1.00 . A A . 102 LYS CD 1 1 3 5249 1 1 102 LYS CE C -15.059 -2.125 -14.637 1.00 . A A . 102 LYS CE 1 1 3 5250 1 1 102 LYS CG C -14.297 -0.630 -12.755 1.00 . A A . 102 LYS CG 1 1 3 5251 1 1 102 LYS H H -10.353 1.367 -12.359 1.00 . A A . 102 LYS H 1 1 3 5252 1 1 102 LYS HA H -12.442 1.029 -11.720 1.00 . A A . 102 LYS HA 1 1 3 5253 1 1 102 LYS HB2 H -12.824 0.270 -14.049 1.00 . A A . 102 LYS HB2 1 1 3 5254 1 1 102 LYS HB3 H -12.443 -1.372 -13.572 1.00 . A A . 102 LYS HB3 1 1 3 5255 1 1 102 LYS HD2 H -16.270 -0.654 -13.626 1.00 . A A . 102 LYS HD2 1 1 3 5256 1 1 102 LYS HD3 H -15.039 0.031 -14.669 1.00 . A A . 102 LYS HD3 1 1 3 5257 1 1 102 LYS HE2 H -15.322 -2.046 -15.692 1.00 . A A . 102 LYS HE2 1 1 3 5258 1 1 102 LYS HE3 H -14.012 -2.428 -14.591 1.00 . A A . 102 LYS HE3 1 1 3 5259 1 1 102 LYS HG2 H -14.363 -1.522 -12.132 1.00 . A A . 102 LYS HG2 1 1 3 5260 1 1 102 LYS HG3 H -14.609 0.213 -12.139 1.00 . A A . 102 LYS HG3 1 1 3 5261 1 1 102 LYS HZ1 H -15.681 -4.086 -14.300 1.00 . A A . 102 LYS HZ1 1 1 3 5262 1 1 102 LYS HZ2 H -15.797 -3.145 -12.976 1.00 . A A . 102 LYS HZ2 1 1 3 5263 1 1 102 LYS N N -10.653 0.432 -12.550 1.00 . A A . 102 LYS N 1 1 3 5264 1 1 102 LYS NZ N -15.906 -3.149 -13.984 1.00 . A A . 102 LYS NZ 1 1 3 5265 1 1 102 LYS O O -12.594 -1.850 -10.814 1.00 . A A . 102 LYS O 1 1 3 5266 1 1 103 SER C C -11.032 -0.543 -7.539 1.00 . A A . 103 SER C 1 1 3 5267 1 1 103 SER CA C -10.739 -1.353 -8.804 1.00 . A A . 103 SER CA 1 1 3 5268 1 1 103 SER CB C -9.309 -1.896 -8.768 1.00 . A A . 103 SER CB 1 1 3 5269 1 1 103 SER H H -10.372 0.279 -10.046 1.00 . A A . 103 SER H 1 1 3 5270 1 1 103 SER HA H -11.440 -2.182 -8.898 1.00 . A A . 103 SER HA 1 1 3 5271 1 1 103 SER HB2 H -8.948 -1.898 -7.740 1.00 . A A . 103 SER HB2 1 1 3 5272 1 1 103 SER HB3 H -9.306 -2.931 -9.109 1.00 . A A . 103 SER HB3 1 1 3 5273 1 1 103 SER HG H -8.467 -0.164 -9.312 1.00 . A A . 103 SER HG 1 1 3 5274 1 1 103 SER N N -10.957 -0.530 -9.982 1.00 . A A . 103 SER N 1 1 3 5275 1 1 103 SER O O -11.521 0.582 -7.618 1.00 . A A . 103 SER O 1 1 3 5276 1 1 103 SER OG O -8.426 -1.127 -9.579 1.00 . A A . 103 SER OG 1 1 3 5277 1 1 104 LYS C C -9.887 0.591 -4.918 1.00 . A A . 104 LYS C 1 1 3 5278 1 1 104 LYS CA C -10.942 -0.498 -5.123 1.00 . A A . 104 LYS CA 1 1 3 5279 1 1 104 LYS CB C -10.985 -1.532 -3.996 1.00 . A A . 104 LYS CB 1 1 3 5280 1 1 104 LYS CD C -13.407 -1.863 -3.376 1.00 . A A . 104 LYS CD 1 1 3 5281 1 1 104 LYS CE C -14.085 -2.936 -2.521 1.00 . A A . 104 LYS CE 1 1 3 5282 1 1 104 LYS CG C -12.209 -2.440 -4.132 1.00 . A A . 104 LYS CG 1 1 3 5283 1 1 104 LYS H H -10.321 -2.064 -6.348 1.00 . A A . 104 LYS H 1 1 3 5284 1 1 104 LYS HA H -11.924 -0.025 -5.164 1.00 . A A . 104 LYS HA 1 1 3 5285 1 1 104 LYS HB2 H -10.077 -2.135 -4.015 1.00 . A A . 104 LYS HB2 1 1 3 5286 1 1 104 LYS HB3 H -11.010 -1.024 -3.032 1.00 . A A . 104 LYS HB3 1 1 3 5287 1 1 104 LYS HD2 H -13.079 -1.040 -2.741 1.00 . A A . 104 LYS HD2 1 1 3 5288 1 1 104 LYS HD3 H -14.125 -1.451 -4.085 1.00 . A A . 104 LYS HD3 1 1 3 5289 1 1 104 LYS HE2 H -13.333 -3.488 -1.957 1.00 . A A . 104 LYS HE2 1 1 3 5290 1 1 104 LYS HE3 H -14.747 -2.465 -1.794 1.00 . A A . 104 LYS HE3 1 1 3 5291 1 1 104 LYS HG2 H -12.463 -2.559 -5.186 1.00 . A A . 104 LYS HG2 1 1 3 5292 1 1 104 LYS HG3 H -11.975 -3.432 -3.747 1.00 . A A . 104 LYS HG3 1 1 3 5293 1 1 104 LYS HZ1 H -15.703 -4.188 -2.916 1.00 . A A . 104 LYS HZ1 1 1 3 5294 1 1 104 LYS HZ2 H -15.139 -3.437 -4.247 1.00 . A A . 104 LYS HZ2 1 1 3 5295 1 1 104 LYS N N -10.719 -1.148 -6.403 1.00 . A A . 104 LYS N 1 1 3 5296 1 1 104 LYS NZ N -14.856 -3.867 -3.373 1.00 . A A . 104 LYS NZ 1 1 3 5297 1 1 104 LYS O O -10.150 1.601 -4.266 1.00 . A A . 104 LYS O 1 1 3 5298 1 1 105 CYS C C -7.799 2.370 -6.449 1.00 . A A . 105 CYS C 1 1 3 5299 1 1 105 CYS CA C -7.619 1.296 -5.374 1.00 . A A . 105 CYS CA 1 1 3 5300 1 1 105 CYS CB C -6.259 0.603 -5.482 1.00 . A A . 105 CYS CB 1 1 3 5301 1 1 105 CYS H H -8.510 -0.474 -6.015 1.00 . A A . 105 CYS H 1 1 3 5302 1 1 105 CYS HA H -7.683 1.732 -4.377 1.00 . A A . 105 CYS HA 1 1 3 5303 1 1 105 CYS HB2 H -6.129 0.194 -6.484 1.00 . A A . 105 CYS HB2 1 1 3 5304 1 1 105 CYS HB3 H -5.459 1.328 -5.327 1.00 . A A . 105 CYS HB3 1 1 3 5305 1 1 105 CYS N N -8.715 0.349 -5.486 1.00 . A A . 105 CYS N 1 1 3 5306 1 1 105 CYS O O -7.990 3.543 -6.134 1.00 . A A . 105 CYS O 1 1 3 5307 1 1 105 CYS SG S -6.139 -0.735 -4.240 1.00 . A A . 105 CYS SG 1 1 3 5308 1 1 106 HIS C C -9.325 2.777 -9.337 1.00 . A A . 106 HIS C 1 1 3 5309 1 1 106 HIS CA C -7.886 2.838 -8.820 1.00 . A A . 106 HIS CA 1 1 3 5310 1 1 106 HIS CB C -6.853 2.537 -9.908 1.00 . A A . 106 HIS CB 1 1 3 5311 1 1 106 HIS CD2 C -4.384 1.828 -9.422 1.00 . A A . 106 HIS CD2 1 1 3 5312 1 1 106 HIS CE1 C -3.649 3.748 -8.674 1.00 . A A . 106 HIS CE1 1 1 3 5313 1 1 106 HIS CG C -5.421 2.713 -9.460 1.00 . A A . 106 HIS CG 1 1 3 5314 1 1 106 HIS H H -7.578 0.973 -7.945 1.00 . A A . 106 HIS H 1 1 3 5315 1 1 106 HIS HA H -7.687 3.841 -8.441 1.00 . A A . 106 HIS HA 1 1 3 5316 1 1 106 HIS HB2 H -6.991 1.513 -10.252 1.00 . A A . 106 HIS HB2 1 1 3 5317 1 1 106 HIS HB3 H -7.038 3.189 -10.761 1.00 . A A . 106 HIS HB3 1 1 3 5318 1 1 106 HIS HD1 H -5.447 4.763 -8.885 1.00 . A A . 106 HIS HD1 1 1 3 5319 1 1 106 HIS HD2 H -4.427 0.783 -9.729 1.00 . A A . 106 HIS HD2 1 1 3 5320 1 1 106 HIS HE1 H -2.983 4.511 -8.272 1.00 . A A . 106 HIS HE1 1 1 3 5321 1 1 106 HIS N N -7.733 1.930 -7.697 1.00 . A A . 106 HIS N 1 1 3 5322 1 1 106 HIS ND1 N -4.927 3.914 -8.982 1.00 . A A . 106 HIS ND1 1 1 3 5323 1 1 106 HIS NE2 N -3.315 2.454 -8.947 1.00 . A A . 106 HIS NE2 1 1 3 5324 1 1 106 HIS O O -9.925 1.705 -9.388 1.00 . A A . 106 HIS O 1 1 3 5325 1 1 107 GLU C C -11.178 4.390 -11.706 1.00 . A A . 107 GLU C 1 1 3 5326 1 1 107 GLU CA C -11.194 4.035 -10.217 1.00 . A A . 107 GLU CA 1 1 3 5327 1 1 107 GLU CB C -12.011 5.053 -9.420 1.00 . A A . 107 GLU CB 1 1 3 5328 1 1 107 GLU CD C -12.432 7.514 -9.060 1.00 . A A . 107 GLU CD 1 1 3 5329 1 1 107 GLU CG C -11.458 6.468 -9.607 1.00 . A A . 107 GLU CG 1 1 3 5330 1 1 107 GLU H H -9.341 4.810 -9.663 1.00 . A A . 107 GLU H 1 1 3 5331 1 1 107 GLU HA H -11.624 3.044 -10.078 1.00 . A A . 107 GLU HA 1 1 3 5332 1 1 107 GLU HB2 H -13.052 5.021 -9.741 1.00 . A A . 107 GLU HB2 1 1 3 5333 1 1 107 GLU HB3 H -11.995 4.790 -8.362 1.00 . A A . 107 GLU HB3 1 1 3 5334 1 1 107 GLU HG2 H -10.498 6.557 -9.097 1.00 . A A . 107 GLU HG2 1 1 3 5335 1 1 107 GLU HG3 H -11.275 6.654 -10.665 1.00 . A A . 107 GLU HG3 1 1 3 5336 1 1 107 GLU N N -9.837 3.942 -9.707 1.00 . A A . 107 GLU N 1 1 3 5337 1 1 107 GLU O O -12.210 4.741 -12.275 1.00 . A A . 107 GLU O 1 1 3 5338 1 1 107 GLU OXT O -10.080 4.305 -12.298 1.00 . A A . 107 GLU OXT 1 1 3 5339 1 1 107 GLU OE1 O -13.608 7.469 -9.481 1.00 . A A . 107 GLU OE1 1 1 3 5340 1 1 107 GLU OE2 O -11.977 8.334 -8.233 1.00 . A A . 107 GLU OE2 1 1 3 5341 2 2 1 HEC C1A C -1.130 5.444 9.238 1.00 . B A . 108 HEC C1A 1 1 3 5342 2 2 1 HEC C1B C -2.004 2.281 12.049 1.00 . B A . 108 HEC C1B 1 1 3 5343 2 2 1 HEC C1C C -2.224 -0.558 8.745 1.00 . B A . 108 HEC C1C 1 1 3 5344 2 2 1 HEC C1D C -1.128 2.588 5.993 1.00 . B A . 108 HEC C1D 1 1 3 5345 2 2 1 HEC C2A C -1.003 6.505 10.208 1.00 . B A . 108 HEC C2A 1 1 3 5346 2 2 1 HEC C2B C -2.464 1.388 13.086 1.00 . B A . 108 HEC C2B 1 1 3 5347 2 2 1 HEC C2C C -2.289 -1.622 7.771 1.00 . B A . 108 HEC C2C 1 1 3 5348 2 2 1 HEC C2D C -0.753 3.517 4.953 1.00 . B A . 108 HEC C2D 1 1 3 5349 2 2 1 HEC C3A C -1.200 5.956 11.425 1.00 . B A . 108 HEC C3A 1 1 3 5350 2 2 1 HEC C3B C -2.648 0.179 12.516 1.00 . B A . 108 HEC C3B 1 1 3 5351 2 2 1 HEC C3C C -1.965 -1.086 6.575 1.00 . B A . 108 HEC C3C 1 1 3 5352 2 2 1 HEC C3D C -0.661 4.736 5.525 1.00 . B A . 108 HEC C3D 1 1 3 5353 2 2 1 HEC C4A C -1.451 4.549 11.220 1.00 . B A . 108 HEC C4A 1 1 3 5354 2 2 1 HEC C4B C -2.304 0.311 11.120 1.00 . B A . 108 HEC C4B 1 1 3 5355 2 2 1 HEC C4C C -1.696 0.315 6.798 1.00 . B A . 108 HEC C4C 1 1 3 5356 2 2 1 HEC C4D C -0.978 4.574 6.924 1.00 . B A . 108 HEC C4D 1 1 3 5357 2 2 1 HEC CAA C -0.707 7.940 9.880 1.00 . B A . 108 HEC CAA 1 1 3 5358 2 2 1 HEC CAB C -3.118 -1.089 13.168 1.00 . B A . 108 HEC CAB 1 1 3 5359 2 2 1 HEC CAC C -1.886 -1.775 5.244 1.00 . B A . 108 HEC CAC 1 1 3 5360 2 2 1 HEC CAD C -0.301 6.038 4.871 1.00 . B A . 108 HEC CAD 1 1 3 5361 2 2 1 HEC CBA C 0.237 8.620 10.867 1.00 . B A . 108 HEC CBA 1 1 3 5362 2 2 1 HEC CBB C -4.394 -0.928 13.989 1.00 . B A . 108 HEC CBB 1 1 3 5363 2 2 1 HEC CBC C -2.910 -2.891 5.062 1.00 . B A . 108 HEC CBC 1 1 3 5364 2 2 1 HEC CBD C -0.913 6.228 3.486 1.00 . B A . 108 HEC CBD 1 1 3 5365 2 2 1 HEC CGA C -0.432 9.816 11.529 1.00 . B A . 108 HEC CGA 1 1 3 5366 2 2 1 HEC CGD C 0.167 6.378 2.425 1.00 . B A . 108 HEC CGD 1 1 3 5367 2 2 1 HEC CHA C -0.993 5.620 7.865 1.00 . B A . 108 HEC CHA 1 1 3 5368 2 2 1 HEC CHB C -1.704 3.625 12.250 1.00 . B A . 108 HEC CHB 1 1 3 5369 2 2 1 HEC CHC C -2.364 -0.735 10.181 1.00 . B A . 108 HEC CHC 1 1 3 5370 2 2 1 HEC CHD C -1.322 1.225 5.792 1.00 . B A . 108 HEC CHD 1 1 3 5371 2 2 1 HEC CMA C -1.173 6.637 12.763 1.00 . B A . 108 HEC CMA 1 1 3 5372 2 2 1 HEC CMB C -2.682 1.777 14.519 1.00 . B A . 108 HEC CMB 1 1 3 5373 2 2 1 HEC CMC C -2.655 -3.046 8.076 1.00 . B A . 108 HEC CMC 1 1 3 5374 2 2 1 HEC CMD C -0.519 3.149 3.517 1.00 . B A . 108 HEC CMD 1 1 3 5375 2 2 1 HEC FE FE -1.610 2.433 9.013 1.00 . B A . 108 HEC FE 1 1 3 5376 2 2 1 HEC HAA1 H -0.241 7.998 8.896 1.00 . B A . 108 HEC HAA1 1 1 3 5377 2 2 1 HEC HAA2 H -1.635 8.511 9.876 1.00 . B A . 108 HEC HAA2 1 1 3 5378 2 2 1 HEC HAB H -3.321 -1.838 12.402 1.00 . B A . 108 HEC HAB 1 1 3 5379 2 2 1 HEC HAC H -2.056 -1.049 4.449 1.00 . B A . 108 HEC HAC 1 1 3 5380 2 2 1 HEC HAD1 H -0.647 6.865 5.491 1.00 . B A . 108 HEC HAD1 1 1 3 5381 2 2 1 HEC HAD2 H 0.781 6.100 4.755 1.00 . B A . 108 HEC HAD2 1 1 3 5382 2 2 1 HEC HBA1 H 0.527 7.910 11.641 1.00 . B A . 108 HEC HBA1 1 1 3 5383 2 2 1 HEC HBA2 H 1.126 8.967 10.339 1.00 . B A . 108 HEC HBA2 1 1 3 5384 2 2 1 HEC HBB1 H -4.185 -1.157 15.034 1.00 . B A . 108 HEC HBB1 1 1 3 5385 2 2 1 HEC HBB2 H -4.752 0.099 13.907 1.00 . B A . 108 HEC HBB2 1 1 3 5386 2 2 1 HEC HBB3 H -5.157 -1.609 13.613 1.00 . B A . 108 HEC HBB3 1 1 3 5387 2 2 1 HEC HBC1 H -3.095 -3.044 3.998 1.00 . B A . 108 HEC HBC1 1 1 3 5388 2 2 1 HEC HBC2 H -2.524 -3.813 5.498 1.00 . B A . 108 HEC HBC2 1 1 3 5389 2 2 1 HEC HBC3 H -3.840 -2.616 5.557 1.00 . B A . 108 HEC HBC3 1 1 3 5390 2 2 1 HEC HBD1 H -1.527 5.361 3.238 1.00 . B A . 108 HEC HBD1 1 1 3 5391 2 2 1 HEC HBD2 H -1.533 7.124 3.482 1.00 . B A . 108 HEC HBD2 1 1 3 5392 2 2 1 HEC HHA H -0.888 6.637 7.487 1.00 . B A . 108 HEC HHA 1 1 3 5393 2 2 1 HEC HHB H -1.661 3.991 13.276 1.00 . B A . 108 HEC HHB 1 1 3 5394 2 2 1 HEC HHC H -2.567 -1.737 10.557 1.00 . B A . 108 HEC HHC 1 1 3 5395 2 2 1 HEC HHD H -1.175 0.831 4.786 1.00 . B A . 108 HEC HHD 1 1 3 5396 2 2 1 HEC HMA1 H -1.741 6.048 13.482 1.00 . B A . 108 HEC HMA1 1 1 3 5397 2 2 1 HEC HMA2 H -0.141 6.729 13.102 1.00 . B A . 108 HEC HMA2 1 1 3 5398 2 2 1 HEC HMA3 H -1.616 7.628 12.674 1.00 . B A . 108 HEC HMA3 1 1 3 5399 2 2 1 HEC HMB1 H -3.751 1.797 14.732 1.00 . B A . 108 HEC HMB1 1 1 3 5400 2 2 1 HEC HMB2 H -2.197 1.050 15.171 1.00 . B A . 108 HEC HMB2 1 1 3 5401 2 2 1 HEC HMB3 H -2.258 2.765 14.697 1.00 . B A . 108 HEC HMB3 1 1 3 5402 2 2 1 HEC HMC1 H -3.392 -3.395 7.353 1.00 . B A . 108 HEC HMC1 1 1 3 5403 2 2 1 HEC HMC2 H -1.763 -3.670 8.017 1.00 . B A . 108 HEC HMC2 1 1 3 5404 2 2 1 HEC HMC3 H -3.074 -3.105 9.081 1.00 . B A . 108 HEC HMC3 1 1 3 5405 2 2 1 HEC HMD1 H -1.476 3.075 3.000 1.00 . B A . 108 HEC HMD1 1 1 3 5406 2 2 1 HEC HMD2 H 0.093 3.916 3.041 1.00 . B A . 108 HEC HMD2 1 1 3 5407 2 2 1 HEC HMD3 H -0.004 2.190 3.467 1.00 . B A . 108 HEC HMD3 1 1 3 5408 2 2 1 HEC NA N -1.406 4.245 9.870 1.00 . B A . 108 HEC NA 1 1 3 5409 2 2 1 HEC NB N -1.909 1.609 10.843 1.00 . B A . 108 HEC NB 1 1 3 5410 2 2 1 HEC NC N -1.858 0.629 8.136 1.00 . B A . 108 HEC NC 1 1 3 5411 2 2 1 HEC ND N -1.265 3.249 7.201 1.00 . B A . 108 HEC ND 1 1 3 5412 2 2 1 HEC O1A O -0.910 10.690 10.773 1.00 . B A . 108 HEC O1A 1 1 3 5413 2 2 1 HEC O1D O -0.087 7.129 1.458 1.00 . B A . 108 HEC O1D 1 1 3 5414 2 2 1 HEC O2A O -0.454 9.835 12.778 1.00 . B A . 108 HEC O2A 1 1 3 5415 2 2 1 HEC O2D O 1.228 5.740 2.600 1.00 . B A . 108 HEC O2D 1 1 3 5416 3 2 1 HEC C1A C 9.620 -1.711 1.717 1.00 . C A . 109 HEC C1A 1 1 3 5417 3 2 1 HEC C1B C 5.758 -0.026 2.685 1.00 . C A . 109 HEC C1B 1 1 3 5418 3 2 1 HEC C1C C 7.741 3.023 5.122 1.00 . C A . 109 HEC C1C 1 1 3 5419 3 2 1 HEC C1D C 11.580 1.493 3.857 1.00 . C A . 109 HEC C1D 1 1 3 5420 3 2 1 HEC C2A C 9.128 -2.811 0.922 1.00 . C A . 109 HEC C2A 1 1 3 5421 3 2 1 HEC C2B C 4.396 0.321 3.017 1.00 . C A . 109 HEC C2B 1 1 3 5422 3 2 1 HEC C2C C 8.242 4.180 5.825 1.00 . C A . 109 HEC C2C 1 1 3 5423 3 2 1 HEC C2D C 12.934 1.075 3.582 1.00 . C A . 109 HEC C2D 1 1 3 5424 3 2 1 HEC C3A C 7.784 -2.696 0.873 1.00 . C A . 109 HEC C3A 1 1 3 5425 3 2 1 HEC C3B C 4.450 1.368 3.867 1.00 . C A . 109 HEC C3B 1 1 3 5426 3 2 1 HEC C3C C 9.586 4.167 5.704 1.00 . C A . 109 HEC C3C 1 1 3 5427 3 2 1 HEC C3D C 12.860 -0.067 2.867 1.00 . C A . 109 HEC C3D 1 1 3 5428 3 2 1 HEC C4A C 7.430 -1.524 1.639 1.00 . C A . 109 HEC C4A 1 1 3 5429 3 2 1 HEC C4B C 5.845 1.679 4.070 1.00 . C A . 109 HEC C4B 1 1 3 5430 3 2 1 HEC C4C C 9.931 3.002 4.924 1.00 . C A . 109 HEC C4C 1 1 3 5431 3 2 1 HEC C4D C 11.459 -0.368 2.692 1.00 . C A . 109 HEC C4D 1 1 3 5432 3 2 1 HEC CAA C 9.989 -3.863 0.286 1.00 . C A . 109 HEC CAA 1 1 3 5433 3 2 1 HEC CAB C 3.305 2.100 4.504 1.00 . C A . 109 HEC CAB 1 1 3 5434 3 2 1 HEC CAC C 10.573 5.154 6.256 1.00 . C A . 109 HEC CAC 1 1 3 5435 3 2 1 HEC CAD C 13.990 -0.899 2.334 1.00 . C A . 109 HEC CAD 1 1 3 5436 3 2 1 HEC CBA C 10.246 -3.639 -1.202 1.00 . C A . 109 HEC CBA 1 1 3 5437 3 2 1 HEC CBB C 2.275 1.188 5.165 1.00 . C A . 109 HEC CBB 1 1 3 5438 3 2 1 HEC CBC C 10.533 5.288 7.776 1.00 . C A . 109 HEC CBC 1 1 3 5439 3 2 1 HEC CBD C 15.205 -0.958 3.256 1.00 . C A . 109 HEC CBD 1 1 3 5440 3 2 1 HEC CGA C 10.979 -4.824 -1.815 1.00 . C A . 109 HEC CGA 1 1 3 5441 3 2 1 HEC CGD C 16.326 -0.066 2.742 1.00 . C A . 109 HEC CGD 1 1 3 5442 3 2 1 HEC CHA C 10.964 -1.486 1.996 1.00 . C A . 109 HEC CHA 1 1 3 5443 3 2 1 HEC CHB C 6.115 -1.063 1.829 1.00 . C A . 109 HEC CHB 1 1 3 5444 3 2 1 HEC CHC C 6.319 2.715 4.896 1.00 . C A . 109 HEC CHC 1 1 3 5445 3 2 1 HEC CHD C 11.244 2.635 4.576 1.00 . C A . 109 HEC CHD 1 1 3 5446 3 2 1 HEC CMA C 6.805 -3.592 0.171 1.00 . C A . 109 HEC CMA 1 1 3 5447 3 2 1 HEC CMB C 3.179 -0.381 2.490 1.00 . C A . 109 HEC CMB 1 1 3 5448 3 2 1 HEC CMC C 7.388 5.184 6.544 1.00 . C A . 109 HEC CMC 1 1 3 5449 3 2 1 HEC CMD C 14.166 1.807 4.029 1.00 . C A . 109 HEC CMD 1 1 3 5450 3 2 1 HEC FE FE 8.669 0.699 3.342 1.00 . C A . 109 HEC FE 1 1 3 5451 3 2 1 HEC HAA1 H 10.961 -3.885 0.780 1.00 . C A . 109 HEC HAA1 1 1 3 5452 3 2 1 HEC HAA2 H 9.508 -4.836 0.387 1.00 . C A . 109 HEC HAA2 1 1 3 5453 3 2 1 HEC HAB H 3.685 2.768 5.277 1.00 . C A . 109 HEC HAB 1 1 3 5454 3 2 1 HEC HAC H 11.584 4.847 5.987 1.00 . C A . 109 HEC HAC 1 1 3 5455 3 2 1 HEC HAD1 H 13.649 -1.924 2.186 1.00 . C A . 109 HEC HAD1 1 1 3 5456 3 2 1 HEC HAD2 H 14.328 -0.488 1.383 1.00 . C A . 109 HEC HAD2 1 1 3 5457 3 2 1 HEC HBA1 H 9.295 -3.513 -1.719 1.00 . C A . 109 HEC HBA1 1 1 3 5458 3 2 1 HEC HBA2 H 10.854 -2.745 -1.336 1.00 . C A . 109 HEC HBA2 1 1 3 5459 3 2 1 HEC HBB1 H 1.279 1.445 4.807 1.00 . C A . 109 HEC HBB1 1 1 3 5460 3 2 1 HEC HBB2 H 2.495 0.150 4.915 1.00 . C A . 109 HEC HBB2 1 1 3 5461 3 2 1 HEC HBB3 H 2.317 1.316 6.247 1.00 . C A . 109 HEC HBB3 1 1 3 5462 3 2 1 HEC HBC1 H 9.496 5.341 8.108 1.00 . C A . 109 HEC HBC1 1 1 3 5463 3 2 1 HEC HBC2 H 11.016 4.423 8.229 1.00 . C A . 109 HEC HBC2 1 1 3 5464 3 2 1 HEC HBC3 H 11.058 6.195 8.075 1.00 . C A . 109 HEC HBC3 1 1 3 5465 3 2 1 HEC HBD1 H 14.922 -0.622 4.253 1.00 . C A . 109 HEC HBD1 1 1 3 5466 3 2 1 HEC HBD2 H 15.572 -1.983 3.308 1.00 . C A . 109 HEC HBD2 1 1 3 5467 3 2 1 HEC HHA H 11.688 -2.226 1.653 1.00 . C A . 109 HEC HHA 1 1 3 5468 3 2 1 HEC HHB H 5.323 -1.555 1.264 1.00 . C A . 109 HEC HHB 1 1 3 5469 3 2 1 HEC HHC H 5.578 3.326 5.411 1.00 . C A . 109 HEC HHC 1 1 3 5470 3 2 1 HEC HHD H 12.051 3.295 4.895 1.00 . C A . 109 HEC HHD 1 1 3 5471 3 2 1 HEC HMA1 H 7.329 -4.190 -0.573 1.00 . C A . 109 HEC HMA1 1 1 3 5472 3 2 1 HEC HMA2 H 6.329 -4.250 0.898 1.00 . C A . 109 HEC HMA2 1 1 3 5473 3 2 1 HEC HMA3 H 6.045 -2.984 -0.321 1.00 . C A . 109 HEC HMA3 1 1 3 5474 3 2 1 HEC HMB1 H 3.429 -0.896 1.562 1.00 . C A . 109 HEC HMB1 1 1 3 5475 3 2 1 HEC HMB2 H 2.830 -1.106 3.226 1.00 . C A . 109 HEC HMB2 1 1 3 5476 3 2 1 HEC HMB3 H 2.392 0.350 2.300 1.00 . C A . 109 HEC HMB3 1 1 3 5477 3 2 1 HEC HMC1 H 6.579 5.507 5.890 1.00 . C A . 109 HEC HMC1 1 1 3 5478 3 2 1 HEC HMC2 H 6.970 4.728 7.442 1.00 . C A . 109 HEC HMC2 1 1 3 5479 3 2 1 HEC HMC3 H 7.996 6.044 6.823 1.00 . C A . 109 HEC HMC3 1 1 3 5480 3 2 1 HEC HMD1 H 14.593 1.304 4.896 1.00 . C A . 109 HEC HMD1 1 1 3 5481 3 2 1 HEC HMD2 H 14.896 1.818 3.219 1.00 . C A . 109 HEC HMD2 1 1 3 5482 3 2 1 HEC HMD3 H 13.903 2.831 4.295 1.00 . C A . 109 HEC HMD3 1 1 3 5483 3 2 1 HEC NA N 8.567 -0.925 2.153 1.00 . C A . 109 HEC NA 1 1 3 5484 3 2 1 HEC NB N 6.641 0.816 3.339 1.00 . C A . 109 HEC NB 1 1 3 5485 3 2 1 HEC NC N 8.789 2.305 4.571 1.00 . C A . 109 HEC NC 1 1 3 5486 3 2 1 HEC ND N 10.680 0.598 3.305 1.00 . C A . 109 HEC ND 1 1 3 5487 3 2 1 HEC O1A O 10.984 -4.904 -3.063 1.00 . C A . 109 HEC O1A 1 1 3 5488 3 2 1 HEC O1D O 16.638 -0.183 1.537 1.00 . C A . 109 HEC O1D 1 1 3 5489 3 2 1 HEC O2A O 11.522 -5.626 -1.025 1.00 . C A . 109 HEC O2A 1 1 3 5490 3 2 1 HEC O2D O 16.850 0.717 3.564 1.00 . C A . 109 HEC O2D 1 1 3 5491 4 2 1 HEC C1A C -8.687 -3.383 0.467 1.00 . D A . 110 HEC C1A 1 1 3 5492 4 2 1 HEC C1B C -4.980 -1.186 0.140 1.00 . D A . 110 HEC C1B 1 1 3 5493 4 2 1 HEC C1C C -2.885 -4.439 2.081 1.00 . D A . 110 HEC C1C 1 1 3 5494 4 2 1 HEC C1D C -6.598 -6.622 2.421 1.00 . D A . 110 HEC C1D 1 1 3 5495 4 2 1 HEC C2A C -9.521 -2.412 -0.201 1.00 . D A . 110 HEC C2A 1 1 3 5496 4 2 1 HEC C2B C -3.824 -0.353 -0.090 1.00 . D A . 110 HEC C2B 1 1 3 5497 4 2 1 HEC C2C C -2.037 -5.452 2.664 1.00 . D A . 110 HEC C2C 1 1 3 5498 4 2 1 HEC C2D C -7.760 -7.437 2.689 1.00 . D A . 110 HEC C2D 1 1 3 5499 4 2 1 HEC C3A C -8.724 -1.382 -0.556 1.00 . D A . 110 HEC C3A 1 1 3 5500 4 2 1 HEC C3B C -2.768 -0.975 0.475 1.00 . D A . 110 HEC C3B 1 1 3 5501 4 2 1 HEC C3C C -2.830 -6.494 2.989 1.00 . D A . 110 HEC C3C 1 1 3 5502 4 2 1 HEC C3D C -8.828 -6.781 2.189 1.00 . D A . 110 HEC C3D 1 1 3 5503 4 2 1 HEC C4A C -7.389 -1.705 -0.112 1.00 . D A . 110 HEC C4A 1 1 3 5504 4 2 1 HEC C4B C -3.259 -2.201 1.060 1.00 . D A . 110 HEC C4B 1 1 3 5505 4 2 1 HEC C4C C -4.177 -6.137 2.610 1.00 . D A . 110 HEC C4C 1 1 3 5506 4 2 1 HEC C4D C -8.340 -5.554 1.607 1.00 . D A . 110 HEC C4D 1 1 3 5507 4 2 1 HEC CAA C -10.996 -2.562 -0.435 1.00 . D A . 110 HEC CAA 1 1 3 5508 4 2 1 HEC CAB C -1.338 -0.519 0.512 1.00 . D A . 110 HEC CAB 1 1 3 5509 4 2 1 HEC CAC C -2.432 -7.795 3.623 1.00 . D A . 110 HEC CAC 1 1 3 5510 4 2 1 HEC CAD C -10.267 -7.208 2.211 1.00 . D A . 110 HEC CAD 1 1 3 5511 4 2 1 HEC CBA C -11.864 -1.885 0.622 1.00 . D A . 110 HEC CBA 1 1 3 5512 4 2 1 HEC CBB C -1.161 0.932 0.949 1.00 . D A . 110 HEC CBB 1 1 3 5513 4 2 1 HEC CBC C -1.131 -7.726 4.418 1.00 . D A . 110 HEC CBC 1 1 3 5514 4 2 1 HEC CBD C -10.874 -7.417 0.827 1.00 . D A . 110 HEC CBD 1 1 3 5515 4 2 1 HEC CGA C -12.841 -2.873 1.243 1.00 . D A . 110 HEC CGA 1 1 3 5516 4 2 1 HEC CGD C -11.616 -8.743 0.748 1.00 . D A . 110 HEC CGD 1 1 3 5517 4 2 1 HEC CHA C -9.150 -4.589 0.981 1.00 . D A . 110 HEC CHA 1 1 3 5518 4 2 1 HEC CHB C -6.265 -0.878 -0.294 1.00 . D A . 110 HEC CHB 1 1 3 5519 4 2 1 HEC CHC C -2.460 -3.134 1.745 1.00 . D A . 110 HEC CHC 1 1 3 5520 4 2 1 HEC CHD C -5.301 -6.965 2.787 1.00 . D A . 110 HEC CHD 1 1 3 5521 4 2 1 HEC CMA C -9.108 -0.122 -1.276 1.00 . D A . 110 HEC CMA 1 1 3 5522 4 2 1 HEC CMB C -3.841 0.955 -0.825 1.00 . D A . 110 HEC CMB 1 1 3 5523 4 2 1 HEC CMC C -0.553 -5.325 2.853 1.00 . D A . 110 HEC CMC 1 1 3 5524 4 2 1 HEC CMD C -7.735 -8.761 3.395 1.00 . D A . 110 HEC CMD 1 1 3 5525 4 2 1 HEC FE FE -5.791 -3.899 1.293 1.00 . D A . 110 HEC FE 1 1 3 5526 4 2 1 HEC HAA1 H -11.258 -2.122 -1.397 1.00 . D A . 110 HEC HAA1 1 1 3 5527 4 2 1 HEC HAA2 H -11.258 -3.620 -0.437 1.00 . D A . 110 HEC HAA2 1 1 3 5528 4 2 1 HEC HAB H -0.777 -1.137 1.213 1.00 . D A . 110 HEC HAB 1 1 3 5529 4 2 1 HEC HAC H -3.213 -8.117 4.312 1.00 . D A . 110 HEC HAC 1 1 3 5530 4 2 1 HEC HAD1 H -10.358 -8.152 2.748 1.00 . D A . 110 HEC HAD1 1 1 3 5531 4 2 1 HEC HAD2 H -10.865 -6.446 2.713 1.00 . D A . 110 HEC HAD2 1 1 3 5532 4 2 1 HEC HBA1 H -11.229 -1.481 1.410 1.00 . D A . 110 HEC HBA1 1 1 3 5533 4 2 1 HEC HBA2 H -12.432 -1.076 0.162 1.00 . D A . 110 HEC HBA2 1 1 3 5534 4 2 1 HEC HBB1 H -0.643 1.487 0.166 1.00 . D A . 110 HEC HBB1 1 1 3 5535 4 2 1 HEC HBB2 H -2.138 1.380 1.126 1.00 . D A . 110 HEC HBB2 1 1 3 5536 4 2 1 HEC HBB3 H -0.573 0.966 1.867 1.00 . D A . 110 HEC HBB3 1 1 3 5537 4 2 1 HEC HBC1 H -0.300 -7.536 3.739 1.00 . D A . 110 HEC HBC1 1 1 3 5538 4 2 1 HEC HBC2 H -1.194 -6.920 5.149 1.00 . D A . 110 HEC HBC2 1 1 3 5539 4 2 1 HEC HBC3 H -0.970 -8.672 4.934 1.00 . D A . 110 HEC HBC3 1 1 3 5540 4 2 1 HEC HBD1 H -11.577 -6.611 0.613 1.00 . D A . 110 HEC HBD1 1 1 3 5541 4 2 1 HEC HBD2 H -10.082 -7.415 0.079 1.00 . D A . 110 HEC HBD2 1 1 3 5542 4 2 1 HEC HHA H -10.215 -4.807 0.895 1.00 . D A . 110 HEC HHA 1 1 3 5543 4 2 1 HEC HHB H -6.417 0.068 -0.814 1.00 . D A . 110 HEC HHB 1 1 3 5544 4 2 1 HEC HHC H -1.457 -2.821 2.034 1.00 . D A . 110 HEC HHC 1 1 3 5545 4 2 1 HEC HHD H -5.139 -7.942 3.242 1.00 . D A . 110 HEC HHD 1 1 3 5546 4 2 1 HEC HMA1 H -8.816 0.742 -0.678 1.00 . D A . 110 HEC HMA1 1 1 3 5547 4 2 1 HEC HMA2 H -8.601 -0.085 -2.240 1.00 . D A . 110 HEC HMA2 1 1 3 5548 4 2 1 HEC HMA3 H -10.187 -0.107 -1.432 1.00 . D A . 110 HEC HMA3 1 1 3 5549 4 2 1 HEC HMB1 H -4.588 1.613 -0.380 1.00 . D A . 110 HEC HMB1 1 1 3 5550 4 2 1 HEC HMB2 H -2.859 1.423 -0.758 1.00 . D A . 110 HEC HMB2 1 1 3 5551 4 2 1 HEC HMB3 H -4.089 0.780 -1.872 1.00 . D A . 110 HEC HMB3 1 1 3 5552 4 2 1 HEC HMC1 H -0.048 -6.118 2.303 1.00 . D A . 110 HEC HMC1 1 1 3 5553 4 2 1 HEC HMC2 H -0.221 -4.356 2.480 1.00 . D A . 110 HEC HMC2 1 1 3 5554 4 2 1 HEC HMC3 H -0.314 -5.407 3.913 1.00 . D A . 110 HEC HMC3 1 1 3 5555 4 2 1 HEC HMD1 H -8.595 -8.835 4.060 1.00 . D A . 110 HEC HMD1 1 1 3 5556 4 2 1 HEC HMD2 H -7.774 -9.566 2.660 1.00 . D A . 110 HEC HMD2 1 1 3 5557 4 2 1 HEC HMD3 H -6.817 -8.846 3.977 1.00 . D A . 110 HEC HMD3 1 1 3 5558 4 2 1 HEC NA N -7.377 -2.938 0.516 1.00 . D A . 110 HEC NA 1 1 3 5559 4 2 1 HEC NB N -4.622 -2.321 0.848 1.00 . D A . 110 HEC NB 1 1 3 5560 4 2 1 HEC NC N -4.200 -4.871 2.053 1.00 . D A . 110 HEC NC 1 1 3 5561 4 2 1 HEC ND N -6.966 -5.465 1.755 1.00 . D A . 110 HEC ND 1 1 3 5562 4 2 1 HEC O1A O -12.377 -3.972 1.616 1.00 . D A . 110 HEC O1A 1 1 3 5563 4 2 1 HEC O1D O -11.126 -9.624 0.009 1.00 . D A . 110 HEC O1D 1 1 3 5564 4 2 1 HEC O2A O -14.034 -2.511 1.334 1.00 . D A . 110 HEC O2A 1 1 3 5565 4 2 1 HEC O2D O -12.659 -8.852 1.429 1.00 . D A . 110 HEC O2D 1 1 3 5566 5 2 1 HEC C1A C -0.059 4.100 -9.184 1.00 . E A . 111 HEC C1A 1 1 3 5567 5 2 1 HEC C1B C -1.345 0.668 -11.476 1.00 . E A . 111 HEC C1B 1 1 3 5568 5 2 1 HEC C1C C -3.173 -1.012 -7.902 1.00 . E A . 111 HEC C1C 1 1 3 5569 5 2 1 HEC C1D C -1.866 2.426 -5.634 1.00 . E A . 111 HEC C1D 1 1 3 5570 5 2 1 HEC C2A C 0.577 4.800 -10.275 1.00 . E A . 111 HEC C2A 1 1 3 5571 5 2 1 HEC C2B C -1.489 -0.489 -12.328 1.00 . E A . 111 HEC C2B 1 1 3 5572 5 2 1 HEC C2C C -3.902 -1.654 -6.834 1.00 . E A . 111 HEC C2C 1 1 3 5573 5 2 1 HEC C2D C -1.379 3.422 -4.709 1.00 . E A . 111 HEC C2D 1 1 3 5574 5 2 1 HEC C3A C 0.392 4.057 -11.386 1.00 . E A . 111 HEC C3A 1 1 3 5575 5 2 1 HEC C3B C -2.100 -1.446 -11.599 1.00 . E A . 111 HEC C3B 1 1 3 5576 5 2 1 HEC C3C C -3.790 -0.864 -5.746 1.00 . E A . 111 HEC C3C 1 1 3 5577 5 2 1 HEC C3D C -0.669 4.317 -5.427 1.00 . E A . 111 HEC C3D 1 1 3 5578 5 2 1 HEC C4A C -0.361 2.889 -10.995 1.00 . E A . 111 HEC C4A 1 1 3 5579 5 2 1 HEC C4B C -2.340 -0.892 -10.287 1.00 . E A . 111 HEC C4B 1 1 3 5580 5 2 1 HEC C4C C -2.990 0.275 -6.128 1.00 . E A . 111 HEC C4C 1 1 3 5581 5 2 1 HEC C4D C -0.708 3.884 -6.804 1.00 . E A . 111 HEC C4D 1 1 3 5582 5 2 1 HEC CAA C 1.300 6.110 -10.149 1.00 . E A . 111 HEC CAA 1 1 3 5583 5 2 1 HEC CAB C -2.477 -2.834 -12.027 1.00 . E A . 111 HEC CAB 1 1 3 5584 5 2 1 HEC CAC C -4.369 -1.087 -4.379 1.00 . E A . 111 HEC CAC 1 1 3 5585 5 2 1 HEC CAD C 0.044 5.542 -4.933 1.00 . E A . 111 HEC CAD 1 1 3 5586 5 2 1 HEC CBA C 2.705 6.104 -10.745 1.00 . E A . 111 HEC CBA 1 1 3 5587 5 2 1 HEC CBB C -1.377 -3.871 -11.813 1.00 . E A . 111 HEC CBB 1 1 3 5588 5 2 1 HEC CBC C -4.231 -2.520 -3.872 1.00 . E A . 111 HEC CBC 1 1 3 5589 5 2 1 HEC CBD C -0.884 6.705 -4.592 1.00 . E A . 111 HEC CBD 1 1 3 5590 5 2 1 HEC CGA C 3.039 7.448 -11.375 1.00 . E A . 111 HEC CGA 1 1 3 5591 5 2 1 HEC CGD C -0.109 8.009 -4.478 1.00 . E A . 111 HEC CGD 1 1 3 5592 5 2 1 HEC CHA C -0.082 4.555 -7.870 1.00 . E A . 111 HEC CHA 1 1 3 5593 5 2 1 HEC CHB C -0.758 1.864 -11.873 1.00 . E A . 111 HEC CHB 1 1 3 5594 5 2 1 HEC CHC C -2.961 -1.583 -9.231 1.00 . E A . 111 HEC CHC 1 1 3 5595 5 2 1 HEC CHD C -2.644 1.332 -5.267 1.00 . E A . 111 HEC CHD 1 1 3 5596 5 2 1 HEC CMA C 0.860 4.349 -12.782 1.00 . E A . 111 HEC CMA 1 1 3 5597 5 2 1 HEC CMB C -1.031 -0.566 -13.756 1.00 . E A . 111 HEC CMB 1 1 3 5598 5 2 1 HEC CMC C -4.635 -2.958 -6.958 1.00 . E A . 111 HEC CMC 1 1 3 5599 5 2 1 HEC CMD C -1.640 3.422 -3.231 1.00 . E A . 111 HEC CMD 1 1 3 5600 5 2 1 HEC FE FE -1.642 1.556 -8.559 1.00 . E A . 111 HEC FE 1 1 3 5601 5 2 1 HEC HAA1 H 0.736 6.887 -10.665 1.00 . E A . 111 HEC HAA1 1 1 3 5602 5 2 1 HEC HAA2 H 1.398 6.371 -9.095 1.00 . E A . 111 HEC HAA2 1 1 3 5603 5 2 1 HEC HAB H -3.347 -3.166 -11.459 1.00 . E A . 111 HEC HAB 1 1 3 5604 5 2 1 HEC HAC H -3.862 -0.442 -3.660 1.00 . E A . 111 HEC HAC 1 1 3 5605 5 2 1 HEC HAD1 H 0.600 5.299 -4.028 1.00 . E A . 111 HEC HAD1 1 1 3 5606 5 2 1 HEC HAD2 H 0.734 5.896 -5.699 1.00 . E A . 111 HEC HAD2 1 1 3 5607 5 2 1 HEC HBA1 H 3.431 5.897 -9.959 1.00 . E A . 111 HEC HBA1 1 1 3 5608 5 2 1 HEC HBA2 H 2.771 5.333 -11.512 1.00 . E A . 111 HEC HBA2 1 1 3 5609 5 2 1 HEC HBB1 H -0.953 -4.154 -12.776 1.00 . E A . 111 HEC HBB1 1 1 3 5610 5 2 1 HEC HBB2 H -0.596 -3.446 -11.182 1.00 . E A . 111 HEC HBB2 1 1 3 5611 5 2 1 HEC HBB3 H -1.798 -4.751 -11.327 1.00 . E A . 111 HEC HBB3 1 1 3 5612 5 2 1 HEC HBC1 H -5.135 -3.079 -4.115 1.00 . E A . 111 HEC HBC1 1 1 3 5613 5 2 1 HEC HBC2 H -3.373 -2.993 -4.349 1.00 . E A . 111 HEC HBC2 1 1 3 5614 5 2 1 HEC HBC3 H -4.088 -2.512 -2.792 1.00 . E A . 111 HEC HBC3 1 1 3 5615 5 2 1 HEC HBD1 H -1.635 6.812 -5.376 1.00 . E A . 111 HEC HBD1 1 1 3 5616 5 2 1 HEC HBD2 H -1.378 6.508 -3.641 1.00 . E A . 111 HEC HBD2 1 1 3 5617 5 2 1 HEC HHA H 0.418 5.497 -7.646 1.00 . E A . 111 HEC HHA 1 1 3 5618 5 2 1 HEC HHB H -0.591 2.023 -12.939 1.00 . E A . 111 HEC HHB 1 1 3 5619 5 2 1 HEC HHC H -3.301 -2.601 -9.427 1.00 . E A . 111 HEC HHC 1 1 3 5620 5 2 1 HEC HHD H -3.013 1.288 -4.243 1.00 . E A . 111 HEC HHD 1 1 3 5621 5 2 1 HEC HMA1 H 0.074 4.091 -13.491 1.00 . E A . 111 HEC HMA1 1 1 3 5622 5 2 1 HEC HMA2 H 1.097 5.409 -12.872 1.00 . E A . 111 HEC HMA2 1 1 3 5623 5 2 1 HEC HMA3 H 1.751 3.759 -12.997 1.00 . E A . 111 HEC HMA3 1 1 3 5624 5 2 1 HEC HMB1 H -1.865 -0.865 -14.390 1.00 . E A . 111 HEC HMB1 1 1 3 5625 5 2 1 HEC HMB2 H -0.665 0.411 -14.073 1.00 . E A . 111 HEC HMB2 1 1 3 5626 5 2 1 HEC HMB3 H -0.229 -1.299 -13.840 1.00 . E A . 111 HEC HMB3 1 1 3 5627 5 2 1 HEC HMC1 H -4.260 -3.658 -6.211 1.00 . E A . 111 HEC HMC1 1 1 3 5628 5 2 1 HEC HMC2 H -5.701 -2.793 -6.799 1.00 . E A . 111 HEC HMC2 1 1 3 5629 5 2 1 HEC HMC3 H -4.477 -3.371 -7.955 1.00 . E A . 111 HEC HMC3 1 1 3 5630 5 2 1 HEC HMD1 H -0.740 3.105 -2.703 1.00 . E A . 111 HEC HMD1 1 1 3 5631 5 2 1 HEC HMD2 H -1.914 4.427 -2.910 1.00 . E A . 111 HEC HMD2 1 1 3 5632 5 2 1 HEC HMD3 H -2.455 2.734 -3.006 1.00 . E A . 111 HEC HMD3 1 1 3 5633 5 2 1 HEC NA N -0.633 2.925 -9.638 1.00 . E A . 111 HEC NA 1 1 3 5634 5 2 1 HEC NB N -1.871 0.408 -10.222 1.00 . E A . 111 HEC NB 1 1 3 5635 5 2 1 HEC NC N -2.615 0.174 -7.457 1.00 . E A . 111 HEC NC 1 1 3 5636 5 2 1 HEC ND N -1.447 2.719 -6.920 1.00 . E A . 111 HEC ND 1 1 3 5637 5 2 1 HEC O1A O 2.591 7.663 -12.522 1.00 . E A . 111 HEC O1A 1 1 3 5638 5 2 1 HEC O1D O -0.103 8.755 -5.482 1.00 . E A . 111 HEC O1D 1 1 3 5639 5 2 1 HEC O2A O 3.736 8.235 -10.699 1.00 . E A . 111 HEC O2A 1 1 3 5640 5 2 1 HEC O2D O 0.463 8.237 -3.390 1.00 . E A . 111 HEC O2D 1 1 4 5641 1 1 1 ALA C C -0.316 3.664 20.267 1.00 . A A . 1 ALA C 1 1 4 5642 1 1 1 ALA CA C 1.069 3.027 20.389 1.00 . A A . 1 ALA CA 1 1 4 5643 1 1 1 ALA CB C 1.233 1.809 19.477 1.00 . A A . 1 ALA CB 1 1 4 5644 1 1 1 ALA H1 H 2.252 2.854 22.030 1.00 . A A . 1 ALA H1 1 1 4 5645 1 1 1 ALA H2 H 0.656 3.135 22.374 1.00 . A A . 1 ALA H2 1 1 4 5646 1 1 1 ALA HA H 1.825 3.767 20.125 1.00 . A A . 1 ALA HA 1 1 4 5647 1 1 1 ALA HB1 H 1.831 1.053 19.985 1.00 . A A . 1 ALA HB1 1 1 4 5648 1 1 1 ALA HB2 H 0.252 1.398 19.240 1.00 . A A . 1 ALA HB2 1 1 4 5649 1 1 1 ALA HB3 H 1.733 2.109 18.556 1.00 . A A . 1 ALA HB3 1 1 4 5650 1 1 1 ALA N N 1.297 2.633 21.769 1.00 . A A . 1 ALA N 1 1 4 5651 1 1 1 ALA O O -1.252 3.262 20.958 1.00 . A A . 1 ALA O 1 1 4 5652 1 1 2 PRO C C -2.633 4.509 18.328 1.00 . A A . 2 PRO C 1 1 4 5653 1 1 2 PRO CA C -1.663 5.371 19.139 1.00 . A A . 2 PRO CA 1 1 4 5654 1 1 2 PRO CB C -1.278 6.659 18.430 1.00 . A A . 2 PRO CB 1 1 4 5655 1 1 2 PRO CD C 0.679 5.176 18.524 1.00 . A A . 2 PRO CD 1 1 4 5656 1 1 2 PRO CG C 0.115 6.425 17.867 1.00 . A A . 2 PRO CG 1 1 4 5657 1 1 2 PRO HA H -2.119 5.549 20.011 1.00 . A A . 2 PRO HA 1 1 4 5658 1 1 2 PRO HB2 H -1.986 6.894 17.635 1.00 . A A . 2 PRO HB2 1 1 4 5659 1 1 2 PRO HB3 H -1.283 7.502 19.121 1.00 . A A . 2 PRO HB3 1 1 4 5660 1 1 2 PRO HD2 H 0.980 4.439 17.780 1.00 . A A . 2 PRO HD2 1 1 4 5661 1 1 2 PRO HD3 H 1.563 5.407 19.120 1.00 . A A . 2 PRO HD3 1 1 4 5662 1 1 2 PRO HG2 H 0.073 6.301 16.785 1.00 . A A . 2 PRO HG2 1 1 4 5663 1 1 2 PRO HG3 H 0.756 7.284 18.065 1.00 . A A . 2 PRO HG3 1 1 4 5664 1 1 2 PRO N N -0.407 4.674 19.360 1.00 . A A . 2 PRO N 1 1 4 5665 1 1 2 PRO O O -2.285 3.407 17.905 1.00 . A A . 2 PRO O 1 1 4 5666 1 1 3 LYS C C -4.740 4.707 15.905 1.00 . A A . 3 LYS C 1 1 4 5667 1 1 3 LYS CA C -4.853 4.336 17.385 1.00 . A A . 3 LYS CA 1 1 4 5668 1 1 3 LYS CB C -6.236 4.602 17.981 1.00 . A A . 3 LYS CB 1 1 4 5669 1 1 3 LYS CD C -7.795 4.113 19.902 1.00 . A A . 3 LYS CD 1 1 4 5670 1 1 3 LYS CE C -8.194 2.914 20.766 1.00 . A A . 3 LYS CE 1 1 4 5671 1 1 3 LYS CG C -6.375 3.947 19.357 1.00 . A A . 3 LYS CG 1 1 4 5672 1 1 3 LYS H H -4.105 5.939 18.484 1.00 . A A . 3 LYS H 1 1 4 5673 1 1 3 LYS HA H -4.657 3.269 17.489 1.00 . A A . 3 LYS HA 1 1 4 5674 1 1 3 LYS HB2 H -6.399 5.676 18.068 1.00 . A A . 3 LYS HB2 1 1 4 5675 1 1 3 LYS HB3 H -7.005 4.217 17.312 1.00 . A A . 3 LYS HB3 1 1 4 5676 1 1 3 LYS HD2 H -7.858 5.027 20.493 1.00 . A A . 3 LYS HD2 1 1 4 5677 1 1 3 LYS HD3 H -8.496 4.219 19.075 1.00 . A A . 3 LYS HD3 1 1 4 5678 1 1 3 LYS HE2 H -8.042 1.990 20.208 1.00 . A A . 3 LYS HE2 1 1 4 5679 1 1 3 LYS HE3 H -7.554 2.863 21.646 1.00 . A A . 3 LYS HE3 1 1 4 5680 1 1 3 LYS HG2 H -6.131 2.887 19.286 1.00 . A A . 3 LYS HG2 1 1 4 5681 1 1 3 LYS HG3 H -5.661 4.393 20.050 1.00 . A A . 3 LYS HG3 1 1 4 5682 1 1 3 LYS HZ1 H -10.238 2.600 20.505 1.00 . A A . 3 LYS HZ1 1 1 4 5683 1 1 3 LYS HZ2 H -9.783 2.564 22.068 1.00 . A A . 3 LYS HZ2 1 1 4 5684 1 1 3 LYS N N -3.830 5.043 18.136 1.00 . A A . 3 LYS N 1 1 4 5685 1 1 3 LYS NZ N -9.611 3.023 21.181 1.00 . A A . 3 LYS NZ 1 1 4 5686 1 1 3 LYS O O -4.012 5.633 15.547 1.00 . A A . 3 LYS O 1 1 4 5687 1 1 4 ALA C C -6.060 5.585 13.365 1.00 . A A . 4 ALA C 1 1 4 5688 1 1 4 ALA CA C -5.461 4.206 13.651 1.00 . A A . 4 ALA CA 1 1 4 5689 1 1 4 ALA CB C -6.217 3.082 12.940 1.00 . A A . 4 ALA CB 1 1 4 5690 1 1 4 ALA H H -6.059 3.216 15.383 1.00 . A A . 4 ALA H 1 1 4 5691 1 1 4 ALA HA H -4.422 4.195 13.319 1.00 . A A . 4 ALA HA 1 1 4 5692 1 1 4 ALA HB1 H -7.196 2.955 13.402 1.00 . A A . 4 ALA HB1 1 1 4 5693 1 1 4 ALA HB2 H -6.342 3.337 11.888 1.00 . A A . 4 ALA HB2 1 1 4 5694 1 1 4 ALA HB3 H -5.652 2.154 13.025 1.00 . A A . 4 ALA HB3 1 1 4 5695 1 1 4 ALA N N -5.470 3.967 15.084 1.00 . A A . 4 ALA N 1 1 4 5696 1 1 4 ALA O O -6.873 6.085 14.140 1.00 . A A . 4 ALA O 1 1 4 5697 1 1 5 PRO C C -7.536 7.399 11.275 1.00 . A A . 5 PRO C 1 1 4 5698 1 1 5 PRO CA C -6.109 7.485 11.821 1.00 . A A . 5 PRO CA 1 1 4 5699 1 1 5 PRO CB C -5.108 7.978 10.789 1.00 . A A . 5 PRO CB 1 1 4 5700 1 1 5 PRO CD C -4.663 5.611 11.276 1.00 . A A . 5 PRO CD 1 1 4 5701 1 1 5 PRO CG C -4.364 6.743 10.307 1.00 . A A . 5 PRO CG 1 1 4 5702 1 1 5 PRO HA H -6.156 8.093 12.613 1.00 . A A . 5 PRO HA 1 1 4 5703 1 1 5 PRO HB2 H -5.613 8.477 9.962 1.00 . A A . 5 PRO HB2 1 1 4 5704 1 1 5 PRO HB3 H -4.421 8.702 11.227 1.00 . A A . 5 PRO HB3 1 1 4 5705 1 1 5 PRO HD2 H -5.077 4.745 10.758 1.00 . A A . 5 PRO HD2 1 1 4 5706 1 1 5 PRO HD3 H -3.759 5.276 11.785 1.00 . A A . 5 PRO HD3 1 1 4 5707 1 1 5 PRO HG2 H -4.680 6.476 9.299 1.00 . A A . 5 PRO HG2 1 1 4 5708 1 1 5 PRO HG3 H -3.292 6.936 10.265 1.00 . A A . 5 PRO HG3 1 1 4 5709 1 1 5 PRO N N -5.625 6.174 12.219 1.00 . A A . 5 PRO N 1 1 4 5710 1 1 5 PRO O O -8.075 6.306 11.104 1.00 . A A . 5 PRO O 1 1 4 5711 1 1 6 ALA C C -9.513 7.952 9.128 1.00 . A A . 6 ALA C 1 1 4 5712 1 1 6 ALA CA C -9.462 8.637 10.495 1.00 . A A . 6 ALA CA 1 1 4 5713 1 1 6 ALA CB C -9.910 10.099 10.432 1.00 . A A . 6 ALA CB 1 1 4 5714 1 1 6 ALA H H -7.663 9.450 11.159 1.00 . A A . 6 ALA H 1 1 4 5715 1 1 6 ALA HA H -10.113 8.100 11.186 1.00 . A A . 6 ALA HA 1 1 4 5716 1 1 6 ALA HB1 H -9.105 10.741 10.791 1.00 . A A . 6 ALA HB1 1 1 4 5717 1 1 6 ALA HB2 H -10.151 10.360 9.402 1.00 . A A . 6 ALA HB2 1 1 4 5718 1 1 6 ALA HB3 H -10.791 10.236 11.058 1.00 . A A . 6 ALA HB3 1 1 4 5719 1 1 6 ALA N N -8.108 8.566 11.017 1.00 . A A . 6 ALA N 1 1 4 5720 1 1 6 ALA O O -8.487 7.796 8.469 1.00 . A A . 6 ALA O 1 1 4 5721 1 1 7 ASP C C -10.885 7.936 6.344 1.00 . A A . 7 ASP C 1 1 4 5722 1 1 7 ASP CA C -10.918 6.897 7.466 1.00 . A A . 7 ASP CA 1 1 4 5723 1 1 7 ASP CB C -12.274 6.191 7.417 1.00 . A A . 7 ASP CB 1 1 4 5724 1 1 7 ASP CG C -12.538 5.383 6.145 1.00 . A A . 7 ASP CG 1 1 4 5725 1 1 7 ASP H H -11.550 7.693 9.284 1.00 . A A . 7 ASP H 1 1 4 5726 1 1 7 ASP HA H -10.105 6.175 7.389 1.00 . A A . 7 ASP HA 1 1 4 5727 1 1 7 ASP HB2 H -12.351 5.524 8.276 1.00 . A A . 7 ASP HB2 1 1 4 5728 1 1 7 ASP HB3 H -13.060 6.939 7.524 1.00 . A A . 7 ASP HB3 1 1 4 5729 1 1 7 ASP N N -10.719 7.562 8.742 1.00 . A A . 7 ASP N 1 1 4 5730 1 1 7 ASP O O -11.022 9.132 6.596 1.00 . A A . 7 ASP O 1 1 4 5731 1 1 7 ASP OD1 O -11.936 4.293 6.030 1.00 . A A . 7 ASP OD1 1 1 4 5732 1 1 7 ASP OD2 O -13.335 5.873 5.316 1.00 . A A . 7 ASP OD2 1 1 4 5733 1 1 8 GLY C C -9.229 8.825 3.728 1.00 . A A . 8 GLY C 1 1 4 5734 1 1 8 GLY CA C -10.651 8.313 3.966 1.00 . A A . 8 GLY CA 1 1 4 5735 1 1 8 GLY H H -10.594 6.468 4.931 1.00 . A A . 8 GLY H 1 1 4 5736 1 1 8 GLY HA2 H -10.999 7.773 3.086 1.00 . A A . 8 GLY HA2 1 1 4 5737 1 1 8 GLY HA3 H -11.325 9.157 4.109 1.00 . A A . 8 GLY HA3 1 1 4 5738 1 1 8 GLY N N -10.703 7.442 5.128 1.00 . A A . 8 GLY N 1 1 4 5739 1 1 8 GLY O O -9.037 9.883 3.131 1.00 . A A . 8 GLY O 1 1 4 5740 1 1 9 LEU C C -6.435 8.158 2.610 1.00 . A A . 9 LEU C 1 1 4 5741 1 1 9 LEU CA C -6.868 8.411 4.056 1.00 . A A . 9 LEU CA 1 1 4 5742 1 1 9 LEU CB C -6.010 7.681 5.091 1.00 . A A . 9 LEU CB 1 1 4 5743 1 1 9 LEU CD1 C -4.022 6.393 4.227 1.00 . A A . 9 LEU CD1 1 1 4 5744 1 1 9 LEU CD2 C -4.100 8.919 4.005 1.00 . A A . 9 LEU CD2 1 1 4 5745 1 1 9 LEU CG C -4.500 7.707 4.849 1.00 . A A . 9 LEU CG 1 1 4 5746 1 1 9 LEU H H -8.431 7.190 4.693 1.00 . A A . 9 LEU H 1 1 4 5747 1 1 9 LEU HA H -6.782 9.478 4.260 1.00 . A A . 9 LEU HA 1 1 4 5748 1 1 9 LEU HB2 H -6.209 8.117 6.070 1.00 . A A . 9 LEU HB2 1 1 4 5749 1 1 9 LEU HB3 H -6.334 6.641 5.134 1.00 . A A . 9 LEU HB3 1 1 4 5750 1 1 9 LEU HD11 H -4.701 5.589 4.510 1.00 . A A . 9 LEU HD11 1 1 4 5751 1 1 9 LEU HD12 H -4.005 6.490 3.142 1.00 . A A . 9 LEU HD12 1 1 4 5752 1 1 9 LEU HD13 H -3.019 6.165 4.587 1.00 . A A . 9 LEU HD13 1 1 4 5753 1 1 9 LEU HD21 H -4.805 9.732 4.181 1.00 . A A . 9 LEU HD21 1 1 4 5754 1 1 9 LEU HD22 H -3.097 9.241 4.284 1.00 . A A . 9 LEU HD22 1 1 4 5755 1 1 9 LEU HD23 H -4.115 8.648 2.950 1.00 . A A . 9 LEU HD23 1 1 4 5756 1 1 9 LEU HG H -4.001 7.807 5.813 1.00 . A A . 9 LEU HG 1 1 4 5757 1 1 9 LEU N N -8.267 8.049 4.208 1.00 . A A . 9 LEU N 1 1 4 5758 1 1 9 LEU O O -6.118 7.028 2.242 1.00 . A A . 9 LEU O 1 1 4 5759 1 1 10 LYS C C -4.634 9.697 0.263 1.00 . A A . 10 LYS C 1 1 4 5760 1 1 10 LYS CA C -6.047 9.137 0.433 1.00 . A A . 10 LYS CA 1 1 4 5761 1 1 10 LYS CB C -7.089 9.816 -0.459 1.00 . A A . 10 LYS CB 1 1 4 5762 1 1 10 LYS CD C -7.447 10.898 -2.708 1.00 . A A . 10 LYS CD 1 1 4 5763 1 1 10 LYS CE C -6.944 12.332 -2.537 1.00 . A A . 10 LYS CE 1 1 4 5764 1 1 10 LYS CG C -6.593 9.917 -1.903 1.00 . A A . 10 LYS CG 1 1 4 5765 1 1 10 LYS H H -6.695 10.144 2.137 1.00 . A A . 10 LYS H 1 1 4 5766 1 1 10 LYS HA H -6.035 8.080 0.166 1.00 . A A . 10 LYS HA 1 1 4 5767 1 1 10 LYS HB2 H -8.021 9.252 -0.430 1.00 . A A . 10 LYS HB2 1 1 4 5768 1 1 10 LYS HB3 H -7.308 10.812 -0.075 1.00 . A A . 10 LYS HB3 1 1 4 5769 1 1 10 LYS HD2 H -7.424 10.624 -3.763 1.00 . A A . 10 LYS HD2 1 1 4 5770 1 1 10 LYS HD3 H -8.486 10.832 -2.385 1.00 . A A . 10 LYS HD3 1 1 4 5771 1 1 10 LYS HE2 H -6.015 12.332 -1.966 1.00 . A A . 10 LYS HE2 1 1 4 5772 1 1 10 LYS HE3 H -6.719 12.764 -3.512 1.00 . A A . 10 LYS HE3 1 1 4 5773 1 1 10 LYS HG2 H -5.553 10.243 -1.911 1.00 . A A . 10 LYS HG2 1 1 4 5774 1 1 10 LYS HG3 H -6.622 8.933 -2.371 1.00 . A A . 10 LYS HG3 1 1 4 5775 1 1 10 LYS HZ1 H -8.796 12.629 -1.629 1.00 . A A . 10 LYS HZ1 1 1 4 5776 1 1 10 LYS HZ2 H -7.611 13.530 -0.967 1.00 . A A . 10 LYS HZ2 1 1 4 5777 1 1 10 LYS N N -6.436 9.229 1.830 1.00 . A A . 10 LYS N 1 1 4 5778 1 1 10 LYS NZ N -7.958 13.158 -1.845 1.00 . A A . 10 LYS NZ 1 1 4 5779 1 1 10 LYS O O -4.261 10.662 0.927 1.00 . A A . 10 LYS O 1 1 4 5780 1 1 11 MET C C -2.346 9.888 -2.362 1.00 . A A . 11 MET C 1 1 4 5781 1 1 11 MET CA C -2.521 9.490 -0.896 1.00 . A A . 11 MET CA 1 1 4 5782 1 1 11 MET CB C -1.558 8.350 -0.558 1.00 . A A . 11 MET CB 1 1 4 5783 1 1 11 MET CE C -0.765 4.902 -0.137 1.00 . A A . 11 MET CE 1 1 4 5784 1 1 11 MET CG C -1.927 7.076 -1.321 1.00 . A A . 11 MET CG 1 1 4 5785 1 1 11 MET H H -4.196 8.282 -1.167 1.00 . A A . 11 MET H 1 1 4 5786 1 1 11 MET HA H -2.353 10.354 -0.254 1.00 . A A . 11 MET HA 1 1 4 5787 1 1 11 MET HB2 H -0.538 8.644 -0.806 1.00 . A A . 11 MET HB2 1 1 4 5788 1 1 11 MET HB3 H -1.581 8.155 0.514 1.00 . A A . 11 MET HB3 1 1 4 5789 1 1 11 MET HE1 H 0.043 5.598 -0.359 1.00 . A A . 11 MET HE1 1 1 4 5790 1 1 11 MET HE2 H -0.612 4.471 0.852 1.00 . A A . 11 MET HE2 1 1 4 5791 1 1 11 MET HE3 H -0.775 4.106 -0.882 1.00 . A A . 11 MET HE3 1 1 4 5792 1 1 11 MET HG2 H -2.777 7.268 -1.976 1.00 . A A . 11 MET HG2 1 1 4 5793 1 1 11 MET HG3 H -1.097 6.771 -1.959 1.00 . A A . 11 MET HG3 1 1 4 5794 1 1 11 MET N N -3.885 9.066 -0.631 1.00 . A A . 11 MET N 1 1 4 5795 1 1 11 MET O O -2.263 9.028 -3.238 1.00 . A A . 11 MET O 1 1 4 5796 1 1 11 MET SD S -2.325 5.769 -0.173 1.00 . A A . 11 MET SD 1 1 4 5797 1 1 12 GLU C C -0.685 12.163 -4.155 1.00 . A A . 12 GLU C 1 1 4 5798 1 1 12 GLU CA C -2.131 11.717 -3.931 1.00 . A A . 12 GLU CA 1 1 4 5799 1 1 12 GLU CB C -3.106 12.865 -4.195 1.00 . A A . 12 GLU CB 1 1 4 5800 1 1 12 GLU CD C -2.128 14.253 -6.059 1.00 . A A . 12 GLU CD 1 1 4 5801 1 1 12 GLU CG C -3.171 13.198 -5.687 1.00 . A A . 12 GLU CG 1 1 4 5802 1 1 12 GLU H H -2.362 11.887 -1.868 1.00 . A A . 12 GLU H 1 1 4 5803 1 1 12 GLU HA H -2.369 10.886 -4.596 1.00 . A A . 12 GLU HA 1 1 4 5804 1 1 12 GLU HB2 H -4.099 12.594 -3.836 1.00 . A A . 12 GLU HB2 1 1 4 5805 1 1 12 GLU HB3 H -2.796 13.747 -3.635 1.00 . A A . 12 GLU HB3 1 1 4 5806 1 1 12 GLU HG2 H -3.004 12.294 -6.272 1.00 . A A . 12 GLU HG2 1 1 4 5807 1 1 12 GLU HG3 H -4.167 13.562 -5.939 1.00 . A A . 12 GLU HG3 1 1 4 5808 1 1 12 GLU N N -2.294 11.193 -2.586 1.00 . A A . 12 GLU N 1 1 4 5809 1 1 12 GLU O O -0.419 13.351 -4.335 1.00 . A A . 12 GLU O 1 1 4 5810 1 1 12 GLU OE1 O -2.405 15.443 -5.796 1.00 . A A . 12 GLU OE1 1 1 4 5811 1 1 12 GLU OE2 O -1.076 13.846 -6.599 1.00 . A A . 12 GLU OE2 1 1 4 5812 1 1 13 ALA C C 1.984 11.232 -5.803 1.00 . A A . 13 ALA C 1 1 4 5813 1 1 13 ALA CA C 1.624 11.466 -4.335 1.00 . A A . 13 ALA CA 1 1 4 5814 1 1 13 ALA CB C 2.454 10.599 -3.386 1.00 . A A . 13 ALA CB 1 1 4 5815 1 1 13 ALA H H -0.013 10.225 -3.990 1.00 . A A . 13 ALA H 1 1 4 5816 1 1 13 ALA HA H 1.794 12.515 -4.090 1.00 . A A . 13 ALA HA 1 1 4 5817 1 1 13 ALA HB1 H 1.845 10.316 -2.527 1.00 . A A . 13 ALA HB1 1 1 4 5818 1 1 13 ALA HB2 H 2.783 9.701 -3.909 1.00 . A A . 13 ALA HB2 1 1 4 5819 1 1 13 ALA HB3 H 3.323 11.161 -3.046 1.00 . A A . 13 ALA HB3 1 1 4 5820 1 1 13 ALA N N 0.212 11.188 -4.136 1.00 . A A . 13 ALA N 1 1 4 5821 1 1 13 ALA O O 3.078 11.587 -6.242 1.00 . A A . 13 ALA O 1 1 4 5822 1 1 14 THR C C 0.032 10.793 -8.748 1.00 . A A . 14 THR C 1 1 4 5823 1 1 14 THR CA C 1.249 10.351 -7.932 1.00 . A A . 14 THR CA 1 1 4 5824 1 1 14 THR CB C 1.566 8.861 -8.072 1.00 . A A . 14 THR CB 1 1 4 5825 1 1 14 THR CG2 C 2.742 8.428 -7.194 1.00 . A A . 14 THR CG2 1 1 4 5826 1 1 14 THR H H 0.158 10.352 -6.158 1.00 . A A . 14 THR H 1 1 4 5827 1 1 14 THR HA H 2.098 10.938 -8.282 1.00 . A A . 14 THR HA 1 1 4 5828 1 1 14 THR HB H 1.740 8.596 -9.114 1.00 . A A . 14 THR HB 1 1 4 5829 1 1 14 THR HG1 H -0.400 8.696 -7.733 1.00 . A A . 14 THR HG1 1 1 4 5830 1 1 14 THR HG21 H 2.736 9.003 -6.268 1.00 . A A . 14 THR HG21 1 1 4 5831 1 1 14 THR HG22 H 2.651 7.367 -6.963 1.00 . A A . 14 THR HG22 1 1 4 5832 1 1 14 THR HG23 H 3.677 8.605 -7.726 1.00 . A A . 14 THR HG23 1 1 4 5833 1 1 14 THR N N 1.044 10.637 -6.522 1.00 . A A . 14 THR N 1 1 4 5834 1 1 14 THR O O -0.962 11.251 -8.188 1.00 . A A . 14 THR O 1 1 4 5835 1 1 14 THR OG1 O 0.440 8.211 -7.488 1.00 . A A . 14 THR OG1 1 1 4 5836 1 1 15 LYS C C -2.145 10.133 -10.684 1.00 . A A . 15 LYS C 1 1 4 5837 1 1 15 LYS CA C -0.927 11.017 -10.957 1.00 . A A . 15 LYS CA 1 1 4 5838 1 1 15 LYS CB C -0.451 10.976 -12.411 1.00 . A A . 15 LYS CB 1 1 4 5839 1 1 15 LYS CD C -2.250 10.610 -14.140 1.00 . A A . 15 LYS CD 1 1 4 5840 1 1 15 LYS CE C -2.905 11.245 -15.368 1.00 . A A . 15 LYS CE 1 1 4 5841 1 1 15 LYS CG C -1.465 11.650 -13.338 1.00 . A A . 15 LYS CG 1 1 4 5842 1 1 15 LYS H H 0.963 10.266 -10.506 1.00 . A A . 15 LYS H 1 1 4 5843 1 1 15 LYS HA H -1.192 12.050 -10.733 1.00 . A A . 15 LYS HA 1 1 4 5844 1 1 15 LYS HB2 H 0.514 11.477 -12.496 1.00 . A A . 15 LYS HB2 1 1 4 5845 1 1 15 LYS HB3 H -0.301 9.942 -12.720 1.00 . A A . 15 LYS HB3 1 1 4 5846 1 1 15 LYS HD2 H -1.582 9.807 -14.453 1.00 . A A . 15 LYS HD2 1 1 4 5847 1 1 15 LYS HD3 H -3.014 10.159 -13.507 1.00 . A A . 15 LYS HD3 1 1 4 5848 1 1 15 LYS HE2 H -2.356 12.140 -15.659 1.00 . A A . 15 LYS HE2 1 1 4 5849 1 1 15 LYS HE3 H -2.858 10.554 -16.210 1.00 . A A . 15 LYS HE3 1 1 4 5850 1 1 15 LYS HG2 H -2.153 12.257 -12.750 1.00 . A A . 15 LYS HG2 1 1 4 5851 1 1 15 LYS HG3 H -0.947 12.325 -14.020 1.00 . A A . 15 LYS HG3 1 1 4 5852 1 1 15 LYS HZ1 H -4.897 11.530 -15.910 1.00 . A A . 15 LYS HZ1 1 1 4 5853 1 1 15 LYS HZ2 H -4.725 10.975 -14.389 1.00 . A A . 15 LYS HZ2 1 1 4 5854 1 1 15 LYS N N 0.151 10.639 -10.059 1.00 . A A . 15 LYS N 1 1 4 5855 1 1 15 LYS NZ N -4.315 11.592 -15.082 1.00 . A A . 15 LYS NZ 1 1 4 5856 1 1 15 LYS O O -3.250 10.438 -11.132 1.00 . A A . 15 LYS O 1 1 4 5857 1 1 16 GLN C C -3.136 8.041 -8.095 1.00 . A A . 16 GLN C 1 1 4 5858 1 1 16 GLN CA C -2.968 8.127 -9.613 1.00 . A A . 16 GLN CA 1 1 4 5859 1 1 16 GLN CB C -2.700 6.745 -10.214 1.00 . A A . 16 GLN CB 1 1 4 5860 1 1 16 GLN CD C -3.540 6.574 -12.585 1.00 . A A . 16 GLN CD 1 1 4 5861 1 1 16 GLN CG C -2.328 6.853 -11.694 1.00 . A A . 16 GLN CG 1 1 4 5862 1 1 16 GLN H H -1.002 8.817 -9.590 1.00 . A A . 16 GLN H 1 1 4 5863 1 1 16 GLN HA H -3.869 8.543 -10.063 1.00 . A A . 16 GLN HA 1 1 4 5864 1 1 16 GLN HB2 H -1.893 6.258 -9.667 1.00 . A A . 16 GLN HB2 1 1 4 5865 1 1 16 GLN HB3 H -3.584 6.118 -10.102 1.00 . A A . 16 GLN HB3 1 1 4 5866 1 1 16 GLN HE21 H -3.638 4.716 -11.788 1.00 . A A . 16 GLN HE21 1 1 4 5867 1 1 16 GLN HE22 H -4.844 5.077 -12.978 1.00 . A A . 16 GLN HE22 1 1 4 5868 1 1 16 GLN HG2 H -1.940 7.850 -11.903 1.00 . A A . 16 GLN HG2 1 1 4 5869 1 1 16 GLN HG3 H -1.531 6.146 -11.925 1.00 . A A . 16 GLN HG3 1 1 4 5870 1 1 16 GLN N N -1.904 9.057 -9.951 1.00 . A A . 16 GLN N 1 1 4 5871 1 1 16 GLN NE2 N -4.050 5.355 -12.439 1.00 . A A . 16 GLN NE2 1 1 4 5872 1 1 16 GLN O O -2.393 7.328 -7.423 1.00 . A A . 16 GLN O 1 1 4 5873 1 1 16 GLN OE1 O -3.982 7.411 -13.355 1.00 . A A . 16 GLN OE1 1 1 4 5874 1 1 17 PRO C C -5.120 7.528 -5.720 1.00 . A A . 17 PRO C 1 1 4 5875 1 1 17 PRO CA C -4.420 8.816 -6.158 1.00 . A A . 17 PRO CA 1 1 4 5876 1 1 17 PRO CB C -5.267 10.058 -5.936 1.00 . A A . 17 PRO CB 1 1 4 5877 1 1 17 PRO CD C -5.044 9.657 -8.350 1.00 . A A . 17 PRO CD 1 1 4 5878 1 1 17 PRO CG C -5.823 10.433 -7.300 1.00 . A A . 17 PRO CG 1 1 4 5879 1 1 17 PRO HA H -3.565 8.852 -5.640 1.00 . A A . 17 PRO HA 1 1 4 5880 1 1 17 PRO HB2 H -6.072 9.860 -5.228 1.00 . A A . 17 PRO HB2 1 1 4 5881 1 1 17 PRO HB3 H -4.670 10.869 -5.521 1.00 . A A . 17 PRO HB3 1 1 4 5882 1 1 17 PRO HD2 H -5.710 9.068 -8.981 1.00 . A A . 17 PRO HD2 1 1 4 5883 1 1 17 PRO HD3 H -4.490 10.326 -9.008 1.00 . A A . 17 PRO HD3 1 1 4 5884 1 1 17 PRO HG2 H -6.885 10.196 -7.359 1.00 . A A . 17 PRO HG2 1 1 4 5885 1 1 17 PRO HG3 H -5.726 11.506 -7.470 1.00 . A A . 17 PRO HG3 1 1 4 5886 1 1 17 PRO N N -4.144 8.799 -7.585 1.00 . A A . 17 PRO N 1 1 4 5887 1 1 17 PRO O O -5.764 6.861 -6.528 1.00 . A A . 17 PRO O 1 1 4 5888 1 1 18 VAL C C -6.129 6.333 -2.493 1.00 . A A . 18 VAL C 1 1 4 5889 1 1 18 VAL CA C -5.578 6.020 -3.885 1.00 . A A . 18 VAL CA 1 1 4 5890 1 1 18 VAL CB C -4.568 4.871 -3.884 1.00 . A A . 18 VAL CB 1 1 4 5891 1 1 18 VAL CG1 C -5.112 3.664 -3.116 1.00 . A A . 18 VAL CG1 1 1 4 5892 1 1 18 VAL CG2 C -4.179 4.482 -5.312 1.00 . A A . 18 VAL CG2 1 1 4 5893 1 1 18 VAL H H -4.443 7.764 -3.790 1.00 . A A . 18 VAL H 1 1 4 5894 1 1 18 VAL HA H -6.407 5.740 -4.536 1.00 . A A . 18 VAL HA 1 1 4 5895 1 1 18 VAL HB H -3.669 5.215 -3.374 1.00 . A A . 18 VAL HB 1 1 4 5896 1 1 18 VAL HG11 H -6.188 3.774 -2.982 1.00 . A A . 18 VAL HG11 1 1 4 5897 1 1 18 VAL HG12 H -4.907 2.753 -3.679 1.00 . A A . 18 VAL HG12 1 1 4 5898 1 1 18 VAL HG13 H -4.627 3.605 -2.142 1.00 . A A . 18 VAL HG13 1 1 4 5899 1 1 18 VAL HG21 H -4.960 4.802 -6.002 1.00 . A A . 18 VAL HG21 1 1 4 5900 1 1 18 VAL HG22 H -3.239 4.967 -5.577 1.00 . A A . 18 VAL HG22 1 1 4 5901 1 1 18 VAL HG23 H -4.059 3.400 -5.374 1.00 . A A . 18 VAL HG23 1 1 4 5902 1 1 18 VAL N N -4.969 7.216 -4.441 1.00 . A A . 18 VAL N 1 1 4 5903 1 1 18 VAL O O -5.550 7.131 -1.757 1.00 . A A . 18 VAL O 1 1 4 5904 1 1 19 VAL C C -7.755 4.607 -0.054 1.00 . A A . 19 VAL C 1 1 4 5905 1 1 19 VAL CA C -7.877 5.888 -0.882 1.00 . A A . 19 VAL CA 1 1 4 5906 1 1 19 VAL CB C -9.326 6.338 -1.076 1.00 . A A . 19 VAL CB 1 1 4 5907 1 1 19 VAL CG1 C -10.101 6.275 0.242 1.00 . A A . 19 VAL CG1 1 1 4 5908 1 1 19 VAL CG2 C -9.388 7.742 -1.682 1.00 . A A . 19 VAL CG2 1 1 4 5909 1 1 19 VAL H H -7.706 5.040 -2.777 1.00 . A A . 19 VAL H 1 1 4 5910 1 1 19 VAL HA H -7.341 6.688 -0.371 1.00 . A A . 19 VAL HA 1 1 4 5911 1 1 19 VAL HB H -9.800 5.650 -1.776 1.00 . A A . 19 VAL HB 1 1 4 5912 1 1 19 VAL HG11 H -9.413 6.058 1.058 1.00 . A A . 19 VAL HG11 1 1 4 5913 1 1 19 VAL HG12 H -10.589 7.233 0.423 1.00 . A A . 19 VAL HG12 1 1 4 5914 1 1 19 VAL HG13 H -10.854 5.489 0.183 1.00 . A A . 19 VAL HG13 1 1 4 5915 1 1 19 VAL HG21 H -8.387 8.051 -1.984 1.00 . A A . 19 VAL HG21 1 1 4 5916 1 1 19 VAL HG22 H -10.044 7.733 -2.552 1.00 . A A . 19 VAL HG22 1 1 4 5917 1 1 19 VAL HG23 H -9.776 8.441 -0.941 1.00 . A A . 19 VAL HG23 1 1 4 5918 1 1 19 VAL N N -7.241 5.688 -2.173 1.00 . A A . 19 VAL N 1 1 4 5919 1 1 19 VAL O O -8.278 3.562 -0.440 1.00 . A A . 19 VAL O 1 1 4 5920 1 1 20 PHE C C -7.725 3.724 3.212 1.00 . A A . 20 PHE C 1 1 4 5921 1 1 20 PHE CA C -6.864 3.594 1.954 1.00 . A A . 20 PHE CA 1 1 4 5922 1 1 20 PHE CB C -5.388 3.624 2.354 1.00 . A A . 20 PHE CB 1 1 4 5923 1 1 20 PHE CD1 C -4.768 1.204 2.701 1.00 . A A . 20 PHE CD1 1 1 4 5924 1 1 20 PHE CD2 C -4.772 2.657 4.600 1.00 . A A . 20 PHE CD2 1 1 4 5925 1 1 20 PHE CE1 C -4.367 0.106 3.542 1.00 . A A . 20 PHE CE1 1 1 4 5926 1 1 20 PHE CE2 C -4.371 1.559 5.441 1.00 . A A . 20 PHE CE2 1 1 4 5927 1 1 20 PHE CG C -4.962 2.457 3.247 1.00 . A A . 20 PHE CG 1 1 4 5928 1 1 20 PHE CZ C -4.189 0.338 4.870 1.00 . A A . 20 PHE CZ 1 1 4 5929 1 1 20 PHE H H -6.641 5.583 1.375 1.00 . A A . 20 PHE H 1 1 4 5930 1 1 20 PHE HA H -7.156 2.693 1.415 1.00 . A A . 20 PHE HA 1 1 4 5931 1 1 20 PHE HB2 H -4.777 3.618 1.452 1.00 . A A . 20 PHE HB2 1 1 4 5932 1 1 20 PHE HB3 H -5.181 4.559 2.873 1.00 . A A . 20 PHE HB3 1 1 4 5933 1 1 20 PHE HD1 H -4.918 1.047 1.633 1.00 . A A . 20 PHE HD1 1 1 4 5934 1 1 20 PHE HD2 H -4.925 3.646 5.031 1.00 . A A . 20 PHE HD2 1 1 4 5935 1 1 20 PHE HE1 H -4.211 -0.888 3.123 1.00 . A A . 20 PHE HE1 1 1 4 5936 1 1 20 PHE HE2 H -4.218 1.703 6.510 1.00 . A A . 20 PHE HE2 1 1 4 5937 1 1 20 PHE HZ H -3.857 -0.572 5.433 1.00 . A A . 20 PHE HZ 1 1 4 5938 1 1 20 PHE N N -7.062 4.729 1.069 1.00 . A A . 20 PHE N 1 1 4 5939 1 1 20 PHE O O -8.006 4.832 3.665 1.00 . A A . 20 PHE O 1 1 4 5940 1 1 21 ASN C C -8.285 1.639 5.982 1.00 . A A . 21 ASN C 1 1 4 5941 1 1 21 ASN CA C -8.942 2.546 4.939 1.00 . A A . 21 ASN CA 1 1 4 5942 1 1 21 ASN CB C -10.334 1.988 4.637 1.00 . A A . 21 ASN CB 1 1 4 5943 1 1 21 ASN CG C -10.933 2.652 3.395 1.00 . A A . 21 ASN CG 1 1 4 5944 1 1 21 ASN H H -7.885 1.677 3.368 1.00 . A A . 21 ASN H 1 1 4 5945 1 1 21 ASN HA H -9.005 3.583 5.268 1.00 . A A . 21 ASN HA 1 1 4 5946 1 1 21 ASN HB2 H -10.273 0.911 4.484 1.00 . A A . 21 ASN HB2 1 1 4 5947 1 1 21 ASN HB3 H -10.989 2.152 5.493 1.00 . A A . 21 ASN HB3 1 1 4 5948 1 1 21 ASN HD21 H -11.253 4.319 4.499 1.00 . A A . 21 ASN HD21 1 1 4 5949 1 1 21 ASN HD22 H -11.755 4.418 2.844 1.00 . A A . 21 ASN HD22 1 1 4 5950 1 1 21 ASN N N -8.119 2.575 3.742 1.00 . A A . 21 ASN N 1 1 4 5951 1 1 21 ASN ND2 N -11.348 3.900 3.596 1.00 . A A . 21 ASN ND2 1 1 4 5952 1 1 21 ASN O O -7.786 0.565 5.650 1.00 . A A . 21 ASN O 1 1 4 5953 1 1 21 ASN OD1 O -11.013 2.070 2.326 1.00 . A A . 21 ASN OD1 1 1 4 5954 1 1 22 HIS C C -8.785 0.452 8.950 1.00 . A A . 22 HIS C 1 1 4 5955 1 1 22 HIS CA C -7.720 1.350 8.316 1.00 . A A . 22 HIS CA 1 1 4 5956 1 1 22 HIS CB C -7.055 2.286 9.327 1.00 . A A . 22 HIS CB 1 1 4 5957 1 1 22 HIS CD2 C -4.454 2.042 9.249 1.00 . A A . 22 HIS CD2 1 1 4 5958 1 1 22 HIS CE1 C -4.005 3.853 8.107 1.00 . A A . 22 HIS CE1 1 1 4 5959 1 1 22 HIS CG C -5.636 2.663 8.973 1.00 . A A . 22 HIS CG 1 1 4 5960 1 1 22 HIS H H -8.716 2.979 7.484 1.00 . A A . 22 HIS H 1 1 4 5961 1 1 22 HIS HA H -6.942 0.723 7.881 1.00 . A A . 22 HIS HA 1 1 4 5962 1 1 22 HIS HB2 H -7.652 3.194 9.413 1.00 . A A . 22 HIS HB2 1 1 4 5963 1 1 22 HIS HB3 H -7.060 1.808 10.307 1.00 . A A . 22 HIS HB3 1 1 4 5964 1 1 22 HIS HD1 H -5.975 4.473 7.903 1.00 . A A . 22 HIS HD1 1 1 4 5965 1 1 22 HIS HD2 H -4.337 1.112 9.805 1.00 . A A . 22 HIS HD2 1 1 4 5966 1 1 22 HIS HE1 H -3.448 4.632 7.586 1.00 . A A . 22 HIS HE1 1 1 4 5967 1 1 22 HIS N N -8.308 2.105 7.222 1.00 . A A . 22 HIS N 1 1 4 5968 1 1 22 HIS ND1 N -5.321 3.802 8.253 1.00 . A A . 22 HIS ND1 1 1 4 5969 1 1 22 HIS NE2 N -3.470 2.761 8.724 1.00 . A A . 22 HIS NE2 1 1 4 5970 1 1 22 HIS O O -8.466 -0.591 9.518 1.00 . A A . 22 HIS O 1 1 4 5971 1 1 23 SER C C -11.427 -1.090 8.523 1.00 . A A . 23 SER C 1 1 4 5972 1 1 23 SER CA C -11.144 0.141 9.386 1.00 . A A . 23 SER CA 1 1 4 5973 1 1 23 SER CB C -12.396 1.014 9.494 1.00 . A A . 23 SER CB 1 1 4 5974 1 1 23 SER H H -10.282 1.741 8.368 1.00 . A A . 23 SER H 1 1 4 5975 1 1 23 SER HA H -10.823 -0.157 10.384 1.00 . A A . 23 SER HA 1 1 4 5976 1 1 23 SER HB2 H -12.663 1.388 8.505 1.00 . A A . 23 SER HB2 1 1 4 5977 1 1 23 SER HB3 H -13.232 0.407 9.842 1.00 . A A . 23 SER HB3 1 1 4 5978 1 1 23 SER HG H -11.502 1.891 11.054 1.00 . A A . 23 SER HG 1 1 4 5979 1 1 23 SER N N -10.030 0.891 8.832 1.00 . A A . 23 SER N 1 1 4 5980 1 1 23 SER O O -12.299 -1.894 8.850 1.00 . A A . 23 SER O 1 1 4 5981 1 1 23 SER OG O -12.207 2.113 10.381 1.00 . A A . 23 SER OG 1 1 4 5982 1 1 24 THR C C -9.715 -3.342 6.737 1.00 . A A . 24 THR C 1 1 4 5983 1 1 24 THR CA C -10.833 -2.319 6.527 1.00 . A A . 24 THR CA 1 1 4 5984 1 1 24 THR CB C -10.889 -1.763 5.102 1.00 . A A . 24 THR CB 1 1 4 5985 1 1 24 THR CG2 C -11.069 -2.862 4.052 1.00 . A A . 24 THR CG2 1 1 4 5986 1 1 24 THR H H -9.967 -0.541 7.181 1.00 . A A . 24 THR H 1 1 4 5987 1 1 24 THR HA H -11.773 -2.820 6.759 1.00 . A A . 24 THR HA 1 1 4 5988 1 1 24 THR HB H -10.009 -1.158 4.885 1.00 . A A . 24 THR HB 1 1 4 5989 1 1 24 THR HG1 H -12.097 -0.298 5.732 1.00 . A A . 24 THR HG1 1 1 4 5990 1 1 24 THR HG21 H -11.170 -3.826 4.549 1.00 . A A . 24 THR HG21 1 1 4 5991 1 1 24 THR HG22 H -11.966 -2.660 3.465 1.00 . A A . 24 THR HG22 1 1 4 5992 1 1 24 THR HG23 H -10.201 -2.881 3.394 1.00 . A A . 24 THR HG23 1 1 4 5993 1 1 24 THR N N -10.674 -1.199 7.439 1.00 . A A . 24 THR N 1 1 4 5994 1 1 24 THR O O -9.918 -4.538 6.536 1.00 . A A . 24 THR O 1 1 4 5995 1 1 24 THR OG1 O -12.115 -1.038 5.060 1.00 . A A . 24 THR OG1 1 1 4 5996 1 1 25 HIS C C -7.230 -3.898 8.883 1.00 . A A . 25 HIS C 1 1 4 5997 1 1 25 HIS CA C -7.409 -3.687 7.378 1.00 . A A . 25 HIS CA 1 1 4 5998 1 1 25 HIS CB C -6.159 -3.115 6.707 1.00 . A A . 25 HIS CB 1 1 4 5999 1 1 25 HIS CD2 C -5.780 -3.722 4.193 1.00 . A A . 25 HIS CD2 1 1 4 6000 1 1 25 HIS CE1 C -6.905 -2.072 3.301 1.00 . A A . 25 HIS CE1 1 1 4 6001 1 1 25 HIS CG C -6.280 -2.963 5.210 1.00 . A A . 25 HIS CG 1 1 4 6002 1 1 25 HIS H H -8.403 -1.859 7.300 1.00 . A A . 25 HIS H 1 1 4 6003 1 1 25 HIS HA H -7.628 -4.646 6.909 1.00 . A A . 25 HIS HA 1 1 4 6004 1 1 25 HIS HB2 H -5.938 -2.141 7.144 1.00 . A A . 25 HIS HB2 1 1 4 6005 1 1 25 HIS HB3 H -5.311 -3.763 6.929 1.00 . A A . 25 HIS HB3 1 1 4 6006 1 1 25 HIS HD1 H -7.470 -1.201 5.097 1.00 . A A . 25 HIS HD1 1 1 4 6007 1 1 25 HIS HD2 H -5.171 -4.620 4.308 1.00 . A A . 25 HIS HD2 1 1 4 6008 1 1 25 HIS HE1 H -7.357 -1.416 2.557 1.00 . A A . 25 HIS HE1 1 1 4 6009 1 1 25 HIS N N -8.559 -2.833 7.139 1.00 . A A . 25 HIS N 1 1 4 6010 1 1 25 HIS ND1 N -6.984 -1.930 4.616 1.00 . A A . 25 HIS ND1 1 1 4 6011 1 1 25 HIS NE2 N -6.159 -3.184 3.041 1.00 . A A . 25 HIS NE2 1 1 4 6012 1 1 25 HIS O O -6.105 -3.995 9.370 1.00 . A A . 25 HIS O 1 1 4 6013 1 1 26 LYS C C -7.761 -5.542 11.330 1.00 . A A . 26 LYS C 1 1 4 6014 1 1 26 LYS CA C -8.340 -4.161 11.016 1.00 . A A . 26 LYS CA 1 1 4 6015 1 1 26 LYS CB C -9.732 -3.929 11.606 1.00 . A A . 26 LYS CB 1 1 4 6016 1 1 26 LYS CD C -11.653 -2.309 11.825 1.00 . A A . 26 LYS CD 1 1 4 6017 1 1 26 LYS CE C -11.615 -1.141 12.813 1.00 . A A . 26 LYS CE 1 1 4 6018 1 1 26 LYS CG C -10.273 -2.553 11.211 1.00 . A A . 26 LYS CG 1 1 4 6019 1 1 26 LYS H H -9.268 -3.884 9.172 1.00 . A A . 26 LYS H 1 1 4 6020 1 1 26 LYS HA H -7.680 -3.405 11.441 1.00 . A A . 26 LYS HA 1 1 4 6021 1 1 26 LYS HB2 H -10.414 -4.705 11.256 1.00 . A A . 26 LYS HB2 1 1 4 6022 1 1 26 LYS HB3 H -9.689 -4.009 12.692 1.00 . A A . 26 LYS HB3 1 1 4 6023 1 1 26 LYS HD2 H -12.374 -2.099 11.035 1.00 . A A . 26 LYS HD2 1 1 4 6024 1 1 26 LYS HD3 H -11.992 -3.211 12.335 1.00 . A A . 26 LYS HD3 1 1 4 6025 1 1 26 LYS HE2 H -10.967 -0.353 12.429 1.00 . A A . 26 LYS HE2 1 1 4 6026 1 1 26 LYS HE3 H -12.612 -0.712 12.915 1.00 . A A . 26 LYS HE3 1 1 4 6027 1 1 26 LYS HG2 H -9.581 -1.778 11.543 1.00 . A A . 26 LYS HG2 1 1 4 6028 1 1 26 LYS HG3 H -10.335 -2.480 10.126 1.00 . A A . 26 LYS HG3 1 1 4 6029 1 1 26 LYS HZ1 H -10.996 -2.600 14.166 1.00 . A A . 26 LYS HZ1 1 1 4 6030 1 1 26 LYS HZ2 H -10.233 -1.176 14.372 1.00 . A A . 26 LYS HZ2 1 1 4 6031 1 1 26 LYS N N -8.357 -3.963 9.576 1.00 . A A . 26 LYS N 1 1 4 6032 1 1 26 LYS NZ N -11.126 -1.595 14.134 1.00 . A A . 26 LYS NZ 1 1 4 6033 1 1 26 LYS O O -6.950 -5.686 12.243 1.00 . A A . 26 LYS O 1 1 4 6034 1 1 27 SER C C -6.265 -7.998 10.336 1.00 . A A . 27 SER C 1 1 4 6035 1 1 27 SER CA C -7.736 -7.887 10.739 1.00 . A A . 27 SER CA 1 1 4 6036 1 1 27 SER CB C -8.584 -8.871 9.930 1.00 . A A . 27 SER CB 1 1 4 6037 1 1 27 SER H H -8.860 -6.397 9.813 1.00 . A A . 27 SER H 1 1 4 6038 1 1 27 SER HA H -7.859 -8.092 11.802 1.00 . A A . 27 SER HA 1 1 4 6039 1 1 27 SER HB2 H -8.355 -9.890 10.243 1.00 . A A . 27 SER HB2 1 1 4 6040 1 1 27 SER HB3 H -9.639 -8.702 10.144 1.00 . A A . 27 SER HB3 1 1 4 6041 1 1 27 SER HG H -9.200 -8.942 8.027 1.00 . A A . 27 SER HG 1 1 4 6042 1 1 27 SER N N -8.200 -6.523 10.554 1.00 . A A . 27 SER N 1 1 4 6043 1 1 27 SER O O -5.635 -9.032 10.553 1.00 . A A . 27 SER O 1 1 4 6044 1 1 27 SER OG O -8.358 -8.744 8.529 1.00 . A A . 27 SER OG 1 1 4 6045 1 1 28 VAL C C -3.513 -6.262 10.423 1.00 . A A . 28 VAL C 1 1 4 6046 1 1 28 VAL CA C -4.374 -6.883 9.321 1.00 . A A . 28 VAL CA 1 1 4 6047 1 1 28 VAL CB C -4.264 -6.141 7.987 1.00 . A A . 28 VAL CB 1 1 4 6048 1 1 28 VAL CG1 C -2.844 -6.232 7.425 1.00 . A A . 28 VAL CG1 1 1 4 6049 1 1 28 VAL CG2 C -5.288 -6.668 6.980 1.00 . A A . 28 VAL CG2 1 1 4 6050 1 1 28 VAL H H -6.279 -6.082 9.584 1.00 . A A . 28 VAL H 1 1 4 6051 1 1 28 VAL HA H -4.052 -7.912 9.162 1.00 . A A . 28 VAL HA 1 1 4 6052 1 1 28 VAL HB H -4.485 -5.089 8.170 1.00 . A A . 28 VAL HB 1 1 4 6053 1 1 28 VAL HG11 H -2.543 -7.278 7.365 1.00 . A A . 28 VAL HG11 1 1 4 6054 1 1 28 VAL HG12 H -2.818 -5.789 6.429 1.00 . A A . 28 VAL HG12 1 1 4 6055 1 1 28 VAL HG13 H -2.158 -5.694 8.080 1.00 . A A . 28 VAL HG13 1 1 4 6056 1 1 28 VAL HG21 H -5.586 -7.678 7.261 1.00 . A A . 28 VAL HG21 1 1 4 6057 1 1 28 VAL HG22 H -6.163 -6.018 6.978 1.00 . A A . 28 VAL HG22 1 1 4 6058 1 1 28 VAL HG23 H -4.844 -6.684 5.985 1.00 . A A . 28 VAL HG23 1 1 4 6059 1 1 28 VAL N N -5.760 -6.919 9.756 1.00 . A A . 28 VAL N 1 1 4 6060 1 1 28 VAL O O -3.927 -5.303 11.072 1.00 . A A . 28 VAL O 1 1 4 6061 1 1 29 LYS C C -0.789 -5.034 11.144 1.00 . A A . 29 LYS C 1 1 4 6062 1 1 29 LYS CA C -1.410 -6.351 11.614 1.00 . A A . 29 LYS CA 1 1 4 6063 1 1 29 LYS CB C -0.380 -7.428 11.960 1.00 . A A . 29 LYS CB 1 1 4 6064 1 1 29 LYS CD C -0.246 -9.374 13.558 1.00 . A A . 29 LYS CD 1 1 4 6065 1 1 29 LYS CE C -1.462 -10.200 13.133 1.00 . A A . 29 LYS CE 1 1 4 6066 1 1 29 LYS CG C -0.523 -7.876 13.416 1.00 . A A . 29 LYS CG 1 1 4 6067 1 1 29 LYS H H -2.003 -7.616 10.069 1.00 . A A . 29 LYS H 1 1 4 6068 1 1 29 LYS HA H -1.989 -6.157 12.517 1.00 . A A . 29 LYS HA 1 1 4 6069 1 1 29 LYS HB2 H -0.507 -8.285 11.298 1.00 . A A . 29 LYS HB2 1 1 4 6070 1 1 29 LYS HB3 H 0.626 -7.042 11.792 1.00 . A A . 29 LYS HB3 1 1 4 6071 1 1 29 LYS HD2 H 0.615 -9.648 12.949 1.00 . A A . 29 LYS HD2 1 1 4 6072 1 1 29 LYS HD3 H 0.010 -9.604 14.593 1.00 . A A . 29 LYS HD3 1 1 4 6073 1 1 29 LYS HE2 H -1.812 -10.801 13.972 1.00 . A A . 29 LYS HE2 1 1 4 6074 1 1 29 LYS HE3 H -2.280 -9.536 12.854 1.00 . A A . 29 LYS HE3 1 1 4 6075 1 1 29 LYS HG2 H 0.168 -7.313 14.043 1.00 . A A . 29 LYS HG2 1 1 4 6076 1 1 29 LYS HG3 H -1.529 -7.654 13.771 1.00 . A A . 29 LYS HG3 1 1 4 6077 1 1 29 LYS HZ1 H -1.278 -10.626 11.101 1.00 . A A . 29 LYS HZ1 1 1 4 6078 1 1 29 LYS HZ2 H -0.143 -11.359 12.010 1.00 . A A . 29 LYS HZ2 1 1 4 6079 1 1 29 LYS N N -2.332 -6.836 10.601 1.00 . A A . 29 LYS N 1 1 4 6080 1 1 29 LYS NZ N -1.118 -11.080 11.993 1.00 . A A . 29 LYS NZ 1 1 4 6081 1 1 29 LYS O O -0.492 -4.871 9.961 1.00 . A A . 29 LYS O 1 1 4 6082 1 1 30 CYS C C 1.398 -3.049 11.289 1.00 . A A . 30 CYS C 1 1 4 6083 1 1 30 CYS CA C -0.030 -2.831 11.792 1.00 . A A . 30 CYS CA 1 1 4 6084 1 1 30 CYS CB C -0.072 -1.897 13.003 1.00 . A A . 30 CYS CB 1 1 4 6085 1 1 30 CYS H H -0.854 -4.269 13.054 1.00 . A A . 30 CYS H 1 1 4 6086 1 1 30 CYS HA H -0.650 -2.384 11.015 1.00 . A A . 30 CYS HA 1 1 4 6087 1 1 30 CYS HB2 H 0.776 -2.123 13.649 1.00 . A A . 30 CYS HB2 1 1 4 6088 1 1 30 CYS HB3 H 0.055 -0.871 12.657 1.00 . A A . 30 CYS HB3 1 1 4 6089 1 1 30 CYS N N -0.610 -4.129 12.094 1.00 . A A . 30 CYS N 1 1 4 6090 1 1 30 CYS O O 1.897 -2.276 10.472 1.00 . A A . 30 CYS O 1 1 4 6091 1 1 30 CYS SG S -1.607 -1.995 13.995 1.00 . A A . 30 CYS SG 1 1 4 6092 1 1 31 GLY C C 3.409 -5.105 10.035 1.00 . A A . 31 GLY C 1 1 4 6093 1 1 31 GLY CA C 3.377 -4.434 11.410 1.00 . A A . 31 GLY CA 1 1 4 6094 1 1 31 GLY H H 1.603 -4.729 12.461 1.00 . A A . 31 GLY H 1 1 4 6095 1 1 31 GLY HA2 H 3.983 -3.528 11.391 1.00 . A A . 31 GLY HA2 1 1 4 6096 1 1 31 GLY HA3 H 3.820 -5.098 12.153 1.00 . A A . 31 GLY HA3 1 1 4 6097 1 1 31 GLY N N 2.016 -4.105 11.797 1.00 . A A . 31 GLY N 1 1 4 6098 1 1 31 GLY O O 4.481 -5.393 9.506 1.00 . A A . 31 GLY O 1 1 4 6099 1 1 32 ASP C C 2.322 -4.917 7.100 1.00 . A A . 32 ASP C 1 1 4 6100 1 1 32 ASP CA C 2.099 -5.965 8.193 1.00 . A A . 32 ASP CA 1 1 4 6101 1 1 32 ASP CB C 0.704 -6.561 7.998 1.00 . A A . 32 ASP CB 1 1 4 6102 1 1 32 ASP CG C 0.543 -7.438 6.754 1.00 . A A . 32 ASP CG 1 1 4 6103 1 1 32 ASP H H 1.353 -5.095 9.932 1.00 . A A . 32 ASP H 1 1 4 6104 1 1 32 ASP HA H 2.858 -6.747 8.182 1.00 . A A . 32 ASP HA 1 1 4 6105 1 1 32 ASP HB2 H 0.452 -7.155 8.877 1.00 . A A . 32 ASP HB2 1 1 4 6106 1 1 32 ASP HB3 H -0.019 -5.747 7.946 1.00 . A A . 32 ASP HB3 1 1 4 6107 1 1 32 ASP N N 2.221 -5.333 9.496 1.00 . A A . 32 ASP N 1 1 4 6108 1 1 32 ASP O O 2.831 -5.234 6.026 1.00 . A A . 32 ASP O 1 1 4 6109 1 1 32 ASP OD1 O 0.996 -6.987 5.680 1.00 . A A . 32 ASP OD1 1 1 4 6110 1 1 32 ASP OD2 O -0.029 -8.539 6.906 1.00 . A A . 32 ASP OD2 1 1 4 6111 1 1 33 CYS C C 3.207 -1.686 6.966 1.00 . A A . 33 CYS C 1 1 4 6112 1 1 33 CYS CA C 2.081 -2.595 6.470 1.00 . A A . 33 CYS CA 1 1 4 6113 1 1 33 CYS CB C 0.770 -1.828 6.281 1.00 . A A . 33 CYS CB 1 1 4 6114 1 1 33 CYS H H 1.518 -3.441 8.288 1.00 . A A . 33 CYS H 1 1 4 6115 1 1 33 CYS HA H 2.338 -3.040 5.510 1.00 . A A . 33 CYS HA 1 1 4 6116 1 1 33 CYS HB2 H 0.190 -1.849 7.203 1.00 . A A . 33 CYS HB2 1 1 4 6117 1 1 33 CYS HB3 H 0.981 -0.781 6.061 1.00 . A A . 33 CYS HB3 1 1 4 6118 1 1 33 CYS N N 1.930 -3.691 7.412 1.00 . A A . 33 CYS N 1 1 4 6119 1 1 33 CYS O O 4.162 -1.421 6.238 1.00 . A A . 33 CYS O 1 1 4 6120 1 1 33 CYS SG S -0.198 -2.570 4.917 1.00 . A A . 33 CYS SG 1 1 4 6121 1 1 34 HIS C C 5.273 -1.182 9.222 1.00 . A A . 34 HIS C 1 1 4 6122 1 1 34 HIS CA C 4.051 -0.360 8.805 1.00 . A A . 34 HIS CA 1 1 4 6123 1 1 34 HIS CB C 3.446 0.433 9.964 1.00 . A A . 34 HIS CB 1 1 4 6124 1 1 34 HIS CD2 C 0.944 1.114 9.637 1.00 . A A . 34 HIS CD2 1 1 4 6125 1 1 34 HIS CE1 C 1.271 3.100 8.779 1.00 . A A . 34 HIS CE1 1 1 4 6126 1 1 34 HIS CG C 2.290 1.319 9.565 1.00 . A A . 34 HIS CG 1 1 4 6127 1 1 34 HIS H H 2.279 -1.455 8.789 1.00 . A A . 34 HIS H 1 1 4 6128 1 1 34 HIS HA H 4.349 0.352 8.035 1.00 . A A . 34 HIS HA 1 1 4 6129 1 1 34 HIS HB2 H 3.108 -0.265 10.731 1.00 . A A . 34 HIS HB2 1 1 4 6130 1 1 34 HIS HB3 H 4.224 1.049 10.415 1.00 . A A . 34 HIS HB3 1 1 4 6131 1 1 34 HIS HD1 H 3.343 3.021 8.839 1.00 . A A . 34 HIS HD1 1 1 4 6132 1 1 34 HIS HD2 H 0.455 0.217 10.019 1.00 . A A . 34 HIS HD2 1 1 4 6133 1 1 34 HIS HE1 H 1.075 4.082 8.349 1.00 . A A . 34 HIS HE1 1 1 4 6134 1 1 34 HIS N N 3.059 -1.234 8.203 1.00 . A A . 34 HIS N 1 1 4 6135 1 1 34 HIS ND1 N 2.465 2.579 9.020 1.00 . A A . 34 HIS ND1 1 1 4 6136 1 1 34 HIS NE2 N 0.329 2.190 9.162 1.00 . A A . 34 HIS NE2 1 1 4 6137 1 1 34 HIS O O 5.661 -1.174 10.389 1.00 . A A . 34 HIS O 1 1 4 6138 1 1 35 HIS C C 7.973 -1.957 9.429 1.00 . A A . 35 HIS C 1 1 4 6139 1 1 35 HIS CA C 7.012 -2.698 8.497 1.00 . A A . 35 HIS CA 1 1 4 6140 1 1 35 HIS CB C 7.670 -3.123 7.183 1.00 . A A . 35 HIS CB 1 1 4 6141 1 1 35 HIS CD2 C 7.820 -1.406 5.218 1.00 . A A . 35 HIS CD2 1 1 4 6142 1 1 35 HIS CE1 C 9.623 -0.348 5.865 1.00 . A A . 35 HIS CE1 1 1 4 6143 1 1 35 HIS CG C 8.241 -1.977 6.383 1.00 . A A . 35 HIS CG 1 1 4 6144 1 1 35 HIS H H 5.521 -1.873 7.299 1.00 . A A . 35 HIS H 1 1 4 6145 1 1 35 HIS HA H 6.657 -3.598 8.998 1.00 . A A . 35 HIS HA 1 1 4 6146 1 1 35 HIS HB2 H 8.468 -3.833 7.401 1.00 . A A . 35 HIS HB2 1 1 4 6147 1 1 35 HIS HB3 H 6.934 -3.647 6.573 1.00 . A A . 35 HIS HB3 1 1 4 6148 1 1 35 HIS HD1 H 9.925 -1.471 7.584 1.00 . A A . 35 HIS HD1 1 1 4 6149 1 1 35 HIS HD2 H 6.947 -1.708 4.640 1.00 . A A . 35 HIS HD2 1 1 4 6150 1 1 35 HIS HE1 H 10.451 0.360 5.886 1.00 . A A . 35 HIS HE1 1 1 4 6151 1 1 35 HIS N N 5.844 -1.872 8.246 1.00 . A A . 35 HIS N 1 1 4 6152 1 1 35 HIS ND1 N 9.379 -1.289 6.766 1.00 . A A . 35 HIS ND1 1 1 4 6153 1 1 35 HIS NE2 N 8.655 -0.423 4.907 1.00 . A A . 35 HIS NE2 1 1 4 6154 1 1 35 HIS O O 8.049 -0.729 9.400 1.00 . A A . 35 HIS O 1 1 4 6155 1 1 36 PRO C C 10.922 -1.717 10.472 1.00 . A A . 36 PRO C 1 1 4 6156 1 1 36 PRO CA C 9.656 -2.187 11.193 1.00 . A A . 36 PRO CA 1 1 4 6157 1 1 36 PRO CB C 9.923 -3.293 12.200 1.00 . A A . 36 PRO CB 1 1 4 6158 1 1 36 PRO CD C 8.640 -4.211 10.316 1.00 . A A . 36 PRO CD 1 1 4 6159 1 1 36 PRO CG C 9.474 -4.582 11.532 1.00 . A A . 36 PRO CG 1 1 4 6160 1 1 36 PRO HA H 9.272 -1.373 11.629 1.00 . A A . 36 PRO HA 1 1 4 6161 1 1 36 PRO HB2 H 10.980 -3.337 12.462 1.00 . A A . 36 PRO HB2 1 1 4 6162 1 1 36 PRO HB3 H 9.373 -3.120 13.125 1.00 . A A . 36 PRO HB3 1 1 4 6163 1 1 36 PRO HD2 H 9.039 -4.664 9.409 1.00 . A A . 36 PRO HD2 1 1 4 6164 1 1 36 PRO HD3 H 7.612 -4.559 10.420 1.00 . A A . 36 PRO HD3 1 1 4 6165 1 1 36 PRO HG2 H 10.336 -5.179 11.236 1.00 . A A . 36 PRO HG2 1 1 4 6166 1 1 36 PRO HG3 H 8.889 -5.188 12.225 1.00 . A A . 36 PRO HG3 1 1 4 6167 1 1 36 PRO N N 8.703 -2.754 10.254 1.00 . A A . 36 PRO N 1 1 4 6168 1 1 36 PRO O O 11.636 -2.521 9.876 1.00 . A A . 36 PRO O 1 1 4 6169 1 1 37 VAL C C 13.520 0.087 10.867 1.00 . A A . 37 VAL C 1 1 4 6170 1 1 37 VAL CA C 12.326 0.171 9.913 1.00 . A A . 37 VAL CA 1 1 4 6171 1 1 37 VAL CB C 12.016 1.602 9.470 1.00 . A A . 37 VAL CB 1 1 4 6172 1 1 37 VAL CG1 C 13.297 2.352 9.100 1.00 . A A . 37 VAL CG1 1 1 4 6173 1 1 37 VAL CG2 C 11.020 1.613 8.309 1.00 . A A . 37 VAL CG2 1 1 4 6174 1 1 37 VAL H H 10.574 0.232 11.038 1.00 . A A . 37 VAL H 1 1 4 6175 1 1 37 VAL HA H 12.546 -0.418 9.023 1.00 . A A . 37 VAL HA 1 1 4 6176 1 1 37 VAL HB H 11.555 2.121 10.311 1.00 . A A . 37 VAL HB 1 1 4 6177 1 1 37 VAL HG11 H 14.017 2.264 9.913 1.00 . A A . 37 VAL HG11 1 1 4 6178 1 1 37 VAL HG12 H 13.721 1.921 8.192 1.00 . A A . 37 VAL HG12 1 1 4 6179 1 1 37 VAL HG13 H 13.067 3.404 8.929 1.00 . A A . 37 VAL HG13 1 1 4 6180 1 1 37 VAL HG21 H 11.147 0.709 7.713 1.00 . A A . 37 VAL HG21 1 1 4 6181 1 1 37 VAL HG22 H 10.004 1.648 8.702 1.00 . A A . 37 VAL HG22 1 1 4 6182 1 1 37 VAL HG23 H 11.199 2.488 7.684 1.00 . A A . 37 VAL HG23 1 1 4 6183 1 1 37 VAL N N 11.160 -0.415 10.551 1.00 . A A . 37 VAL N 1 1 4 6184 1 1 37 VAL O O 14.469 -0.654 10.614 1.00 . A A . 37 VAL O 1 1 4 6185 1 1 38 ASN C C 14.125 -0.053 14.091 1.00 . A A . 38 ASN C 1 1 4 6186 1 1 38 ASN CA C 14.495 0.877 12.934 1.00 . A A . 38 ASN CA 1 1 4 6187 1 1 38 ASN CB C 14.689 2.284 13.502 1.00 . A A . 38 ASN CB 1 1 4 6188 1 1 38 ASN CG C 16.145 2.735 13.366 1.00 . A A . 38 ASN CG 1 1 4 6189 1 1 38 ASN H H 12.658 1.455 12.140 1.00 . A A . 38 ASN H 1 1 4 6190 1 1 38 ASN HA H 15.389 0.549 12.404 1.00 . A A . 38 ASN HA 1 1 4 6191 1 1 38 ASN HB2 H 14.037 2.985 12.980 1.00 . A A . 38 ASN HB2 1 1 4 6192 1 1 38 ASN HB3 H 14.397 2.300 14.553 1.00 . A A . 38 ASN HB3 1 1 4 6193 1 1 38 ASN HD21 H 15.974 3.668 15.155 1.00 . A A . 38 ASN HD21 1 1 4 6194 1 1 38 ASN HD22 H 17.524 3.804 14.392 1.00 . A A . 38 ASN HD22 1 1 4 6195 1 1 38 ASN N N 13.434 0.856 11.942 1.00 . A A . 38 ASN N 1 1 4 6196 1 1 38 ASN ND2 N 16.584 3.463 14.389 1.00 . A A . 38 ASN ND2 1 1 4 6197 1 1 38 ASN O O 14.451 0.224 15.244 1.00 . A A . 38 ASN O 1 1 4 6198 1 1 38 ASN OD1 O 16.824 2.441 12.396 1.00 . A A . 38 ASN OD1 1 1 4 6199 1 1 39 GLY C C 11.744 -1.664 15.434 1.00 . A A . 39 GLY C 1 1 4 6200 1 1 39 GLY CA C 13.031 -2.111 14.737 1.00 . A A . 39 GLY CA 1 1 4 6201 1 1 39 GLY H H 13.188 -1.357 12.802 1.00 . A A . 39 GLY H 1 1 4 6202 1 1 39 GLY HA2 H 12.873 -3.079 14.261 1.00 . A A . 39 GLY HA2 1 1 4 6203 1 1 39 GLY HA3 H 13.821 -2.244 15.476 1.00 . A A . 39 GLY HA3 1 1 4 6204 1 1 39 GLY N N 13.449 -1.138 13.742 1.00 . A A . 39 GLY N 1 1 4 6205 1 1 39 GLY O O 11.231 -2.363 16.307 1.00 . A A . 39 GLY O 1 1 4 6206 1 1 40 LYS C C 8.963 0.124 14.516 1.00 . A A . 40 LYS C 1 1 4 6207 1 1 40 LYS CA C 10.043 0.047 15.597 1.00 . A A . 40 LYS CA 1 1 4 6208 1 1 40 LYS CB C 10.328 1.388 16.277 1.00 . A A . 40 LYS CB 1 1 4 6209 1 1 40 LYS CD C 11.077 3.772 15.933 1.00 . A A . 40 LYS CD 1 1 4 6210 1 1 40 LYS CE C 10.848 4.961 14.998 1.00 . A A . 40 LYS CE 1 1 4 6211 1 1 40 LYS CG C 10.705 2.455 15.247 1.00 . A A . 40 LYS CG 1 1 4 6212 1 1 40 LYS H H 11.682 0.061 14.312 1.00 . A A . 40 LYS H 1 1 4 6213 1 1 40 LYS HA H 9.708 -0.642 16.372 1.00 . A A . 40 LYS HA 1 1 4 6214 1 1 40 LYS HB2 H 9.450 1.711 16.836 1.00 . A A . 40 LYS HB2 1 1 4 6215 1 1 40 LYS HB3 H 11.138 1.270 16.997 1.00 . A A . 40 LYS HB3 1 1 4 6216 1 1 40 LYS HD2 H 10.481 3.895 16.837 1.00 . A A . 40 LYS HD2 1 1 4 6217 1 1 40 LYS HD3 H 12.122 3.743 16.242 1.00 . A A . 40 LYS HD3 1 1 4 6218 1 1 40 LYS HE2 H 10.316 4.632 14.106 1.00 . A A . 40 LYS HE2 1 1 4 6219 1 1 40 LYS HE3 H 10.218 5.702 15.490 1.00 . A A . 40 LYS HE3 1 1 4 6220 1 1 40 LYS HG2 H 11.544 2.105 14.646 1.00 . A A . 40 LYS HG2 1 1 4 6221 1 1 40 LYS HG3 H 9.870 2.619 14.566 1.00 . A A . 40 LYS HG3 1 1 4 6222 1 1 40 LYS HZ1 H 12.014 6.368 13.996 1.00 . A A . 40 LYS HZ1 1 1 4 6223 1 1 40 LYS HZ2 H 12.654 5.910 15.421 1.00 . A A . 40 LYS HZ2 1 1 4 6224 1 1 40 LYS N N 11.259 -0.502 15.023 1.00 . A A . 40 LYS N 1 1 4 6225 1 1 40 LYS NZ N 12.139 5.574 14.615 1.00 . A A . 40 LYS NZ 1 1 4 6226 1 1 40 LYS O O 9.273 0.259 13.333 1.00 . A A . 40 LYS O 1 1 4 6227 1 1 41 GLU C C 5.859 1.426 14.187 1.00 . A A . 41 GLU C 1 1 4 6228 1 1 41 GLU CA C 6.591 0.090 14.045 1.00 . A A . 41 GLU CA 1 1 4 6229 1 1 41 GLU CB C 5.638 -1.085 14.275 1.00 . A A . 41 GLU CB 1 1 4 6230 1 1 41 GLU CD C 6.157 -3.538 14.540 1.00 . A A . 41 GLU CD 1 1 4 6231 1 1 41 GLU CG C 6.147 -2.348 13.579 1.00 . A A . 41 GLU CG 1 1 4 6232 1 1 41 GLU H H 7.475 -0.077 15.924 1.00 . A A . 41 GLU H 1 1 4 6233 1 1 41 GLU HA H 7.023 0.009 13.048 1.00 . A A . 41 GLU HA 1 1 4 6234 1 1 41 GLU HB2 H 5.536 -1.271 15.344 1.00 . A A . 41 GLU HB2 1 1 4 6235 1 1 41 GLU HB3 H 4.647 -0.832 13.900 1.00 . A A . 41 GLU HB3 1 1 4 6236 1 1 41 GLU HG2 H 5.515 -2.575 12.721 1.00 . A A . 41 GLU HG2 1 1 4 6237 1 1 41 GLU HG3 H 7.153 -2.177 13.196 1.00 . A A . 41 GLU HG3 1 1 4 6238 1 1 41 GLU N N 7.718 0.033 14.960 1.00 . A A . 41 GLU N 1 1 4 6239 1 1 41 GLU O O 4.709 1.464 14.625 1.00 . A A . 41 GLU O 1 1 4 6240 1 1 41 GLU OE1 O 6.796 -3.402 15.606 1.00 . A A . 41 GLU OE1 1 1 4 6241 1 1 41 GLU OE2 O 5.525 -4.558 14.188 1.00 . A A . 41 GLU OE2 1 1 4 6242 1 1 42 ASP C C 4.970 4.009 12.760 1.00 . A A . 42 ASP C 1 1 4 6243 1 1 42 ASP CA C 5.984 3.823 13.890 1.00 . A A . 42 ASP CA 1 1 4 6244 1 1 42 ASP CB C 7.066 4.894 13.735 1.00 . A A . 42 ASP CB 1 1 4 6245 1 1 42 ASP CG C 7.865 4.822 12.432 1.00 . A A . 42 ASP CG 1 1 4 6246 1 1 42 ASP H H 7.488 2.448 13.455 1.00 . A A . 42 ASP H 1 1 4 6247 1 1 42 ASP HA H 5.525 3.879 14.877 1.00 . A A . 42 ASP HA 1 1 4 6248 1 1 42 ASP HB2 H 6.597 5.875 13.802 1.00 . A A . 42 ASP HB2 1 1 4 6249 1 1 42 ASP HB3 H 7.758 4.814 14.573 1.00 . A A . 42 ASP HB3 1 1 4 6250 1 1 42 ASP N N 6.554 2.489 13.810 1.00 . A A . 42 ASP N 1 1 4 6251 1 1 42 ASP O O 5.264 3.714 11.603 1.00 . A A . 42 ASP O 1 1 4 6252 1 1 42 ASP OD1 O 7.761 3.774 11.760 1.00 . A A . 42 ASP OD1 1 1 4 6253 1 1 42 ASP OD2 O 8.561 5.818 12.138 1.00 . A A . 42 ASP OD2 1 1 4 6254 1 1 43 TYR C C 2.978 6.016 11.384 1.00 . A A . 43 TYR C 1 1 4 6255 1 1 43 TYR CA C 2.737 4.724 12.168 1.00 . A A . 43 TYR CA 1 1 4 6256 1 1 43 TYR CB C 1.448 4.868 12.980 1.00 . A A . 43 TYR CB 1 1 4 6257 1 1 43 TYR CD1 C 1.723 2.473 13.719 1.00 . A A . 43 TYR CD1 1 1 4 6258 1 1 43 TYR CD2 C 0.475 3.955 15.120 1.00 . A A . 43 TYR CD2 1 1 4 6259 1 1 43 TYR CE1 C 1.497 1.400 14.653 1.00 . A A . 43 TYR CE1 1 1 4 6260 1 1 43 TYR CE2 C 0.249 2.883 16.053 1.00 . A A . 43 TYR CE2 1 1 4 6261 1 1 43 TYR CG C 1.208 3.728 13.972 1.00 . A A . 43 TYR CG 1 1 4 6262 1 1 43 TYR CZ C 0.771 1.658 15.774 1.00 . A A . 43 TYR CZ 1 1 4 6263 1 1 43 TYR H H 3.566 4.734 14.079 1.00 . A A . 43 TYR H 1 1 4 6264 1 1 43 TYR HA H 2.728 3.884 11.474 1.00 . A A . 43 TYR HA 1 1 4 6265 1 1 43 TYR HB2 H 1.478 5.811 13.526 1.00 . A A . 43 TYR HB2 1 1 4 6266 1 1 43 TYR HB3 H 0.603 4.923 12.294 1.00 . A A . 43 TYR HB3 1 1 4 6267 1 1 43 TYR HD1 H 2.301 2.294 12.813 1.00 . A A . 43 TYR HD1 1 1 4 6268 1 1 43 TYR HD2 H 0.068 4.947 15.319 1.00 . A A . 43 TYR HD2 1 1 4 6269 1 1 43 TYR HE1 H 1.898 0.405 14.466 1.00 . A A . 43 TYR HE1 1 1 4 6270 1 1 43 TYR HE2 H -0.327 3.048 16.963 1.00 . A A . 43 TYR HE2 1 1 4 6271 1 1 43 TYR HH H -0.137 0.914 17.324 1.00 . A A . 43 TYR HH 1 1 4 6272 1 1 43 TYR N N 3.797 4.496 13.135 1.00 . A A . 43 TYR N 1 1 4 6273 1 1 43 TYR O O 2.560 7.092 11.810 1.00 . A A . 43 TYR O 1 1 4 6274 1 1 43 TYR OH O 0.557 0.645 16.656 1.00 . A A . 43 TYR OH 1 1 4 6275 1 1 44 ARG C C 3.442 6.766 7.985 1.00 . A A . 44 ARG C 1 1 4 6276 1 1 44 ARG CA C 3.954 7.009 9.407 1.00 . A A . 44 ARG CA 1 1 4 6277 1 1 44 ARG CB C 5.460 7.276 9.360 1.00 . A A . 44 ARG CB 1 1 4 6278 1 1 44 ARG CD C 7.291 8.783 10.220 1.00 . A A . 44 ARG CD 1 1 4 6279 1 1 44 ARG CG C 5.791 8.650 9.945 1.00 . A A . 44 ARG CG 1 1 4 6280 1 1 44 ARG CZ C 8.666 10.487 11.426 1.00 . A A . 44 ARG CZ 1 1 4 6281 1 1 44 ARG H H 3.988 4.989 9.914 1.00 . A A . 44 ARG H 1 1 4 6282 1 1 44 ARG HA H 3.436 7.846 9.873 1.00 . A A . 44 ARG HA 1 1 4 6283 1 1 44 ARG HB2 H 5.988 6.503 9.918 1.00 . A A . 44 ARG HB2 1 1 4 6284 1 1 44 ARG HB3 H 5.811 7.222 8.330 1.00 . A A . 44 ARG HB3 1 1 4 6285 1 1 44 ARG HD2 H 7.701 7.818 10.518 1.00 . A A . 44 ARG HD2 1 1 4 6286 1 1 44 ARG HD3 H 7.811 9.082 9.310 1.00 . A A . 44 ARG HD3 1 1 4 6287 1 1 44 ARG HE H 6.789 9.944 11.946 1.00 . A A . 44 ARG HE 1 1 4 6288 1 1 44 ARG HG2 H 5.475 9.431 9.253 1.00 . A A . 44 ARG HG2 1 1 4 6289 1 1 44 ARG HG3 H 5.234 8.800 10.870 1.00 . A A . 44 ARG HG3 1 1 4 6290 1 1 44 ARG HH11 H 9.607 9.650 9.818 1.00 . A A . 44 ARG HH11 1 1 4 6291 1 1 44 ARG HH12 H 10.534 10.836 10.676 1.00 . A A . 44 ARG HH12 1 1 4 6292 1 1 44 ARG HH21 H 9.575 11.915 12.590 1.00 . A A . 44 ARG HH21 1 1 4 6293 1 1 44 ARG N N 3.652 5.867 10.253 1.00 . A A . 44 ARG N 1 1 4 6294 1 1 44 ARG NE N 7.524 9.781 11.287 1.00 . A A . 44 ARG NE 1 1 4 6295 1 1 44 ARG NH1 N 9.691 10.309 10.566 1.00 . A A . 44 ARG NH1 1 1 4 6296 1 1 44 ARG NH2 N 8.766 11.354 12.417 1.00 . A A . 44 ARG NH2 1 1 4 6297 1 1 44 ARG O O 2.956 5.680 7.674 1.00 . A A . 44 ARG O 1 1 4 6298 1 1 45 LYS C C 4.209 7.026 4.943 1.00 . A A . 45 LYS C 1 1 4 6299 1 1 45 LYS CA C 3.125 7.708 5.780 1.00 . A A . 45 LYS CA 1 1 4 6300 1 1 45 LYS CB C 2.722 9.088 5.259 1.00 . A A . 45 LYS CB 1 1 4 6301 1 1 45 LYS CD C 1.890 10.719 6.993 1.00 . A A . 45 LYS CD 1 1 4 6302 1 1 45 LYS CE C 1.238 12.052 6.620 1.00 . A A . 45 LYS CE 1 1 4 6303 1 1 45 LYS CG C 1.496 9.620 6.004 1.00 . A A . 45 LYS CG 1 1 4 6304 1 1 45 LYS H H 3.967 8.675 7.422 1.00 . A A . 45 LYS H 1 1 4 6305 1 1 45 LYS HA H 2.232 7.083 5.764 1.00 . A A . 45 LYS HA 1 1 4 6306 1 1 45 LYS HB2 H 3.553 9.783 5.376 1.00 . A A . 45 LYS HB2 1 1 4 6307 1 1 45 LYS HB3 H 2.506 9.029 4.192 1.00 . A A . 45 LYS HB3 1 1 4 6308 1 1 45 LYS HD2 H 1.588 10.432 8.001 1.00 . A A . 45 LYS HD2 1 1 4 6309 1 1 45 LYS HD3 H 2.974 10.831 7.005 1.00 . A A . 45 LYS HD3 1 1 4 6310 1 1 45 LYS HE2 H 0.350 11.872 6.014 1.00 . A A . 45 LYS HE2 1 1 4 6311 1 1 45 LYS HE3 H 0.910 12.568 7.522 1.00 . A A . 45 LYS HE3 1 1 4 6312 1 1 45 LYS HG2 H 0.772 10.011 5.290 1.00 . A A . 45 LYS HG2 1 1 4 6313 1 1 45 LYS HG3 H 1.008 8.804 6.538 1.00 . A A . 45 LYS HG3 1 1 4 6314 1 1 45 LYS HZ1 H 1.717 13.616 5.329 1.00 . A A . 45 LYS HZ1 1 1 4 6315 1 1 45 LYS HZ2 H 2.835 13.385 6.490 1.00 . A A . 45 LYS HZ2 1 1 4 6316 1 1 45 LYS N N 3.569 7.795 7.161 1.00 . A A . 45 LYS N 1 1 4 6317 1 1 45 LYS NZ N 2.191 12.903 5.873 1.00 . A A . 45 LYS NZ 1 1 4 6318 1 1 45 LYS O O 5.381 7.391 5.022 1.00 . A A . 45 LYS O 1 1 4 6319 1 1 46 CYS C C 5.415 6.312 2.397 1.00 . A A . 46 CYS C 1 1 4 6320 1 1 46 CYS CA C 4.698 5.312 3.307 1.00 . A A . 46 CYS CA 1 1 4 6321 1 1 46 CYS CB C 3.979 4.225 2.506 1.00 . A A . 46 CYS CB 1 1 4 6322 1 1 46 CYS H H 2.824 5.758 4.100 1.00 . A A . 46 CYS H 1 1 4 6323 1 1 46 CYS HA H 5.406 4.814 3.969 1.00 . A A . 46 CYS HA 1 1 4 6324 1 1 46 CYS HB2 H 3.553 4.675 1.610 1.00 . A A . 46 CYS HB2 1 1 4 6325 1 1 46 CYS HB3 H 4.714 3.491 2.175 1.00 . A A . 46 CYS HB3 1 1 4 6326 1 1 46 CYS N N 3.779 6.049 4.159 1.00 . A A . 46 CYS N 1 1 4 6327 1 1 46 CYS O O 6.634 6.254 2.245 1.00 . A A . 46 CYS O 1 1 4 6328 1 1 46 CYS SG S 2.650 3.355 3.414 1.00 . A A . 46 CYS SG 1 1 4 6329 1 1 47 GLY C C 5.777 9.376 1.717 1.00 . A A . 47 GLY C 1 1 4 6330 1 1 47 GLY CA C 5.171 8.215 0.925 1.00 . A A . 47 GLY CA 1 1 4 6331 1 1 47 GLY H H 3.636 7.245 1.946 1.00 . A A . 47 GLY H 1 1 4 6332 1 1 47 GLY HA2 H 5.934 7.769 0.286 1.00 . A A . 47 GLY HA2 1 1 4 6333 1 1 47 GLY HA3 H 4.385 8.589 0.270 1.00 . A A . 47 GLY HA3 1 1 4 6334 1 1 47 GLY N N 4.627 7.205 1.816 1.00 . A A . 47 GLY N 1 1 4 6335 1 1 47 GLY O O 5.490 10.539 1.438 1.00 . A A . 47 GLY O 1 1 4 6336 1 1 48 THR C C 8.632 10.366 2.963 1.00 . A A . 48 THR C 1 1 4 6337 1 1 48 THR CA C 7.252 10.017 3.523 1.00 . A A . 48 THR CA 1 1 4 6338 1 1 48 THR CB C 7.296 9.480 4.955 1.00 . A A . 48 THR CB 1 1 4 6339 1 1 48 THR CG2 C 8.377 10.155 5.801 1.00 . A A . 48 THR CG2 1 1 4 6340 1 1 48 THR H H 6.832 8.071 2.909 1.00 . A A . 48 THR H 1 1 4 6341 1 1 48 THR HA H 6.656 10.929 3.495 1.00 . A A . 48 THR HA 1 1 4 6342 1 1 48 THR HB H 7.417 8.396 4.961 1.00 . A A . 48 THR HB 1 1 4 6343 1 1 48 THR HG1 H 5.588 9.159 5.948 1.00 . A A . 48 THR HG1 1 1 4 6344 1 1 48 THR HG21 H 8.197 11.230 5.830 1.00 . A A . 48 THR HG21 1 1 4 6345 1 1 48 THR HG22 H 8.348 9.755 6.815 1.00 . A A . 48 THR HG22 1 1 4 6346 1 1 48 THR HG23 H 9.356 9.962 5.362 1.00 . A A . 48 THR HG23 1 1 4 6347 1 1 48 THR N N 6.604 9.020 2.689 1.00 . A A . 48 THR N 1 1 4 6348 1 1 48 THR O O 9.411 9.477 2.623 1.00 . A A . 48 THR O 1 1 4 6349 1 1 48 THR OG1 O 6.073 9.928 5.532 1.00 . A A . 48 THR OG1 1 1 4 6350 1 1 49 ALA C C 11.305 11.495 3.161 1.00 . A A . 49 ALA C 1 1 4 6351 1 1 49 ALA CA C 10.165 12.140 2.369 1.00 . A A . 49 ALA CA 1 1 4 6352 1 1 49 ALA CB C 10.202 13.668 2.436 1.00 . A A . 49 ALA CB 1 1 4 6353 1 1 49 ALA H H 8.254 12.380 3.162 1.00 . A A . 49 ALA H 1 1 4 6354 1 1 49 ALA HA H 10.239 11.832 1.326 1.00 . A A . 49 ALA HA 1 1 4 6355 1 1 49 ALA HB1 H 9.309 14.031 2.943 1.00 . A A . 49 ALA HB1 1 1 4 6356 1 1 49 ALA HB2 H 11.087 13.987 2.986 1.00 . A A . 49 ALA HB2 1 1 4 6357 1 1 49 ALA HB3 H 10.236 14.075 1.425 1.00 . A A . 49 ALA HB3 1 1 4 6358 1 1 49 ALA N N 8.893 11.663 2.883 1.00 . A A . 49 ALA N 1 1 4 6359 1 1 49 ALA O O 11.486 11.783 4.343 1.00 . A A . 49 ALA O 1 1 4 6360 1 1 50 GLY C C 12.902 8.438 3.178 1.00 . A A . 50 GLY C 1 1 4 6361 1 1 50 GLY CA C 13.160 9.944 3.102 1.00 . A A . 50 GLY CA 1 1 4 6362 1 1 50 GLY H H 11.890 10.404 1.516 1.00 . A A . 50 GLY H 1 1 4 6363 1 1 50 GLY HA2 H 14.071 10.132 2.534 1.00 . A A . 50 GLY HA2 1 1 4 6364 1 1 50 GLY HA3 H 13.321 10.340 4.104 1.00 . A A . 50 GLY HA3 1 1 4 6365 1 1 50 GLY N N 12.043 10.633 2.477 1.00 . A A . 50 GLY N 1 1 4 6366 1 1 50 GLY O O 13.826 7.656 3.394 1.00 . A A . 50 GLY O 1 1 4 6367 1 1 51 CYS C C 11.022 6.195 1.606 1.00 . A A . 51 CYS C 1 1 4 6368 1 1 51 CYS CA C 11.248 6.678 3.040 1.00 . A A . 51 CYS CA 1 1 4 6369 1 1 51 CYS CB C 10.012 6.465 3.915 1.00 . A A . 51 CYS CB 1 1 4 6370 1 1 51 CYS H H 10.894 8.719 2.819 1.00 . A A . 51 CYS H 1 1 4 6371 1 1 51 CYS HA H 12.073 6.137 3.505 1.00 . A A . 51 CYS HA 1 1 4 6372 1 1 51 CYS HB2 H 9.203 7.114 3.580 1.00 . A A . 51 CYS HB2 1 1 4 6373 1 1 51 CYS HB3 H 9.658 5.438 3.816 1.00 . A A . 51 CYS HB3 1 1 4 6374 1 1 51 CYS N N 11.640 8.076 2.995 1.00 . A A . 51 CYS N 1 1 4 6375 1 1 51 CYS O O 11.955 5.739 0.947 1.00 . A A . 51 CYS O 1 1 4 6376 1 1 51 CYS SG S 10.414 6.821 5.665 1.00 . A A . 51 CYS SG 1 1 4 6377 1 1 52 HIS C C 9.128 7.126 -1.040 1.00 . A A . 52 HIS C 1 1 4 6378 1 1 52 HIS CA C 9.418 5.895 -0.179 1.00 . A A . 52 HIS CA 1 1 4 6379 1 1 52 HIS CB C 8.251 4.906 -0.145 1.00 . A A . 52 HIS CB 1 1 4 6380 1 1 52 HIS CD2 C 8.180 3.018 1.661 1.00 . A A . 52 HIS CD2 1 1 4 6381 1 1 52 HIS CE1 C 9.538 1.605 0.688 1.00 . A A . 52 HIS CE1 1 1 4 6382 1 1 52 HIS CG C 8.589 3.577 0.486 1.00 . A A . 52 HIS CG 1 1 4 6383 1 1 52 HIS H H 9.026 6.686 1.707 1.00 . A A . 52 HIS H 1 1 4 6384 1 1 52 HIS HA H 10.284 5.373 -0.587 1.00 . A A . 52 HIS HA 1 1 4 6385 1 1 52 HIS HB2 H 7.423 5.356 0.402 1.00 . A A . 52 HIS HB2 1 1 4 6386 1 1 52 HIS HB3 H 7.904 4.735 -1.164 1.00 . A A . 52 HIS HB3 1 1 4 6387 1 1 52 HIS HD1 H 9.913 2.781 -0.980 1.00 . A A . 52 HIS HD1 1 1 4 6388 1 1 52 HIS HD2 H 7.497 3.473 2.379 1.00 . A A . 52 HIS HD2 1 1 4 6389 1 1 52 HIS HE1 H 10.137 0.714 0.500 1.00 . A A . 52 HIS HE1 1 1 4 6390 1 1 52 HIS N N 9.779 6.313 1.165 1.00 . A A . 52 HIS N 1 1 4 6391 1 1 52 HIS ND1 N 9.445 2.663 -0.104 1.00 . A A . 52 HIS ND1 1 1 4 6392 1 1 52 HIS NE2 N 8.753 1.827 1.781 1.00 . A A . 52 HIS NE2 1 1 4 6393 1 1 52 HIS O O 7.972 7.418 -1.342 1.00 . A A . 52 HIS O 1 1 4 6394 1 1 53 ASP C C 11.132 8.977 -3.333 1.00 . A A . 53 ASP C 1 1 4 6395 1 1 53 ASP CA C 10.073 9.008 -2.230 1.00 . A A . 53 ASP CA 1 1 4 6396 1 1 53 ASP CB C 10.293 10.273 -1.398 1.00 . A A . 53 ASP CB 1 1 4 6397 1 1 53 ASP CG C 9.547 11.512 -1.896 1.00 . A A . 53 ASP CG 1 1 4 6398 1 1 53 ASP H H 11.134 7.570 -1.160 1.00 . A A . 53 ASP H 1 1 4 6399 1 1 53 ASP HA H 9.057 8.978 -2.625 1.00 . A A . 53 ASP HA 1 1 4 6400 1 1 53 ASP HB2 H 9.988 10.072 -0.371 1.00 . A A . 53 ASP HB2 1 1 4 6401 1 1 53 ASP HB3 H 11.360 10.494 -1.376 1.00 . A A . 53 ASP HB3 1 1 4 6402 1 1 53 ASP N N 10.198 7.815 -1.410 1.00 . A A . 53 ASP N 1 1 4 6403 1 1 53 ASP O O 12.134 9.686 -3.256 1.00 . A A . 53 ASP O 1 1 4 6404 1 1 53 ASP OD1 O 8.299 11.451 -1.922 1.00 . A A . 53 ASP OD1 1 1 4 6405 1 1 53 ASP OD2 O 10.242 12.493 -2.240 1.00 . A A . 53 ASP OD2 1 1 4 6406 1 1 54 SER C C 11.207 8.688 -6.694 1.00 . A A . 54 SER C 1 1 4 6407 1 1 54 SER CA C 11.793 8.015 -5.451 1.00 . A A . 54 SER CA 1 1 4 6408 1 1 54 SER CB C 12.102 6.544 -5.739 1.00 . A A . 54 SER CB 1 1 4 6409 1 1 54 SER H H 10.057 7.575 -4.389 1.00 . A A . 54 SER H 1 1 4 6410 1 1 54 SER HA H 12.706 8.522 -5.136 1.00 . A A . 54 SER HA 1 1 4 6411 1 1 54 SER HB2 H 12.364 6.040 -4.809 1.00 . A A . 54 SER HB2 1 1 4 6412 1 1 54 SER HB3 H 11.207 6.055 -6.125 1.00 . A A . 54 SER HB3 1 1 4 6413 1 1 54 SER HG H 13.706 5.584 -6.452 1.00 . A A . 54 SER HG 1 1 4 6414 1 1 54 SER N N 10.874 8.148 -4.334 1.00 . A A . 54 SER N 1 1 4 6415 1 1 54 SER O O 11.945 9.219 -7.523 1.00 . A A . 54 SER O 1 1 4 6416 1 1 54 SER OG O 13.165 6.395 -6.675 1.00 . A A . 54 SER OG 1 1 4 6417 1 1 55 MET C C 9.824 8.807 -9.237 1.00 . A A . 55 MET C 1 1 4 6418 1 1 55 MET CA C 9.193 9.240 -7.913 1.00 . A A . 55 MET CA 1 1 4 6419 1 1 55 MET CB C 9.247 10.765 -7.796 1.00 . A A . 55 MET CB 1 1 4 6420 1 1 55 MET CE C 7.043 9.947 -5.166 1.00 . A A . 55 MET CE 1 1 4 6421 1 1 55 MET CG C 7.892 11.330 -7.367 1.00 . A A . 55 MET CG 1 1 4 6422 1 1 55 MET H H 9.294 8.208 -6.106 1.00 . A A . 55 MET H 1 1 4 6423 1 1 55 MET HA H 8.168 8.874 -7.854 1.00 . A A . 55 MET HA 1 1 4 6424 1 1 55 MET HB2 H 10.010 11.050 -7.072 1.00 . A A . 55 MET HB2 1 1 4 6425 1 1 55 MET HB3 H 9.539 11.196 -8.753 1.00 . A A . 55 MET HB3 1 1 4 6426 1 1 55 MET HE1 H 6.302 9.697 -5.925 1.00 . A A . 55 MET HE1 1 1 4 6427 1 1 55 MET HE2 H 7.793 9.157 -5.117 1.00 . A A . 55 MET HE2 1 1 4 6428 1 1 55 MET HE3 H 6.553 10.043 -4.198 1.00 . A A . 55 MET HE3 1 1 4 6429 1 1 55 MET HG2 H 7.730 12.302 -7.834 1.00 . A A . 55 MET HG2 1 1 4 6430 1 1 55 MET HG3 H 7.090 10.675 -7.709 1.00 . A A . 55 MET HG3 1 1 4 6431 1 1 55 MET N N 9.886 8.642 -6.785 1.00 . A A . 55 MET N 1 1 4 6432 1 1 55 MET O O 9.874 9.584 -10.189 1.00 . A A . 55 MET O 1 1 4 6433 1 1 55 MET SD S 7.832 11.491 -5.590 1.00 . A A . 55 MET SD 1 1 4 6434 1 1 56 ASP C C 9.962 6.026 -11.110 1.00 . A A . 56 ASP C 1 1 4 6435 1 1 56 ASP CA C 10.917 7.020 -10.447 1.00 . A A . 56 ASP CA 1 1 4 6436 1 1 56 ASP CB C 12.208 6.276 -10.099 1.00 . A A . 56 ASP CB 1 1 4 6437 1 1 56 ASP CG C 13.214 6.156 -11.245 1.00 . A A . 56 ASP CG 1 1 4 6438 1 1 56 ASP H H 10.246 6.941 -8.477 1.00 . A A . 56 ASP H 1 1 4 6439 1 1 56 ASP HA H 11.128 7.882 -11.081 1.00 . A A . 56 ASP HA 1 1 4 6440 1 1 56 ASP HB2 H 12.690 6.786 -9.265 1.00 . A A . 56 ASP HB2 1 1 4 6441 1 1 56 ASP HB3 H 11.950 5.274 -9.755 1.00 . A A . 56 ASP HB3 1 1 4 6442 1 1 56 ASP N N 10.291 7.567 -9.255 1.00 . A A . 56 ASP N 1 1 4 6443 1 1 56 ASP O O 9.953 5.890 -12.333 1.00 . A A . 56 ASP O 1 1 4 6444 1 1 56 ASP OD1 O 12.825 5.582 -12.285 1.00 . A A . 56 ASP OD1 1 1 4 6445 1 1 56 ASP OD2 O 14.351 6.641 -11.056 1.00 . A A . 56 ASP OD2 1 1 4 6446 1 1 57 LYS C C 8.979 3.159 -11.300 1.00 . A A . 57 LYS C 1 1 4 6447 1 1 57 LYS CA C 8.226 4.378 -10.764 1.00 . A A . 57 LYS CA 1 1 4 6448 1 1 57 LYS CB C 7.282 5.016 -11.785 1.00 . A A . 57 LYS CB 1 1 4 6449 1 1 57 LYS CD C 6.498 3.344 -13.503 1.00 . A A . 57 LYS CD 1 1 4 6450 1 1 57 LYS CE C 5.438 3.645 -14.564 1.00 . A A . 57 LYS CE 1 1 4 6451 1 1 57 LYS CG C 6.168 4.046 -12.184 1.00 . A A . 57 LYS CG 1 1 4 6452 1 1 57 LYS H H 9.196 5.474 -9.281 1.00 . A A . 57 LYS H 1 1 4 6453 1 1 57 LYS HA H 7.617 4.063 -9.916 1.00 . A A . 57 LYS HA 1 1 4 6454 1 1 57 LYS HB2 H 6.846 5.924 -11.367 1.00 . A A . 57 LYS HB2 1 1 4 6455 1 1 57 LYS HB3 H 7.845 5.313 -12.670 1.00 . A A . 57 LYS HB3 1 1 4 6456 1 1 57 LYS HD2 H 7.476 3.670 -13.858 1.00 . A A . 57 LYS HD2 1 1 4 6457 1 1 57 LYS HD3 H 6.561 2.268 -13.340 1.00 . A A . 57 LYS HD3 1 1 4 6458 1 1 57 LYS HE2 H 4.456 3.336 -14.203 1.00 . A A . 57 LYS HE2 1 1 4 6459 1 1 57 LYS HE3 H 5.388 4.719 -14.743 1.00 . A A . 57 LYS HE3 1 1 4 6460 1 1 57 LYS HG2 H 6.029 3.304 -11.398 1.00 . A A . 57 LYS HG2 1 1 4 6461 1 1 57 LYS HG3 H 5.227 4.587 -12.281 1.00 . A A . 57 LYS HG3 1 1 4 6462 1 1 57 LYS HZ1 H 4.920 2.744 -16.371 1.00 . A A . 57 LYS HZ1 1 1 4 6463 1 1 57 LYS HZ2 H 6.372 3.481 -16.420 1.00 . A A . 57 LYS HZ2 1 1 4 6464 1 1 57 LYS N N 9.182 5.357 -10.274 1.00 . A A . 57 LYS N 1 1 4 6465 1 1 57 LYS NZ N 5.753 2.939 -15.826 1.00 . A A . 57 LYS NZ 1 1 4 6466 1 1 57 LYS O O 8.841 2.058 -10.771 1.00 . A A . 57 LYS O 1 1 4 6467 1 1 58 LYS C C 11.912 2.264 -12.295 1.00 . A A . 58 LYS C 1 1 4 6468 1 1 58 LYS CA C 10.534 2.333 -12.958 1.00 . A A . 58 LYS CA 1 1 4 6469 1 1 58 LYS CB C 10.591 2.518 -14.476 1.00 . A A . 58 LYS CB 1 1 4 6470 1 1 58 LYS CD C 11.267 1.439 -16.652 1.00 . A A . 58 LYS CD 1 1 4 6471 1 1 58 LYS CE C 12.111 0.294 -17.216 1.00 . A A . 58 LYS CE 1 1 4 6472 1 1 58 LYS CG C 10.942 1.204 -15.176 1.00 . A A . 58 LYS CG 1 1 4 6473 1 1 58 LYS H H 9.866 4.297 -12.768 1.00 . A A . 58 LYS H 1 1 4 6474 1 1 58 LYS HA H 10.011 1.396 -12.767 1.00 . A A . 58 LYS HA 1 1 4 6475 1 1 58 LYS HB2 H 9.629 2.881 -14.838 1.00 . A A . 58 LYS HB2 1 1 4 6476 1 1 58 LYS HB3 H 11.332 3.277 -14.726 1.00 . A A . 58 LYS HB3 1 1 4 6477 1 1 58 LYS HD2 H 10.342 1.528 -17.222 1.00 . A A . 58 LYS HD2 1 1 4 6478 1 1 58 LYS HD3 H 11.803 2.381 -16.765 1.00 . A A . 58 LYS HD3 1 1 4 6479 1 1 58 LYS HE2 H 13.092 0.668 -17.508 1.00 . A A . 58 LYS HE2 1 1 4 6480 1 1 58 LYS HE3 H 12.273 -0.460 -16.447 1.00 . A A . 58 LYS HE3 1 1 4 6481 1 1 58 LYS HG2 H 11.796 0.741 -14.681 1.00 . A A . 58 LYS HG2 1 1 4 6482 1 1 58 LYS HG3 H 10.108 0.507 -15.089 1.00 . A A . 58 LYS HG3 1 1 4 6483 1 1 58 LYS HZ1 H 11.090 -1.247 -18.178 1.00 . A A . 58 LYS HZ1 1 1 4 6484 1 1 58 LYS HZ2 H 10.647 0.231 -18.698 1.00 . A A . 58 LYS HZ2 1 1 4 6485 1 1 58 LYS N N 9.759 3.398 -12.344 1.00 . A A . 58 LYS N 1 1 4 6486 1 1 58 LYS NZ N 11.439 -0.318 -18.385 1.00 . A A . 58 LYS NZ 1 1 4 6487 1 1 58 LYS O O 12.922 2.579 -12.922 1.00 . A A . 58 LYS O 1 1 4 6488 1 1 59 ASP C C 13.066 0.510 -9.367 1.00 . A A . 59 ASP C 1 1 4 6489 1 1 59 ASP CA C 13.144 1.734 -10.283 1.00 . A A . 59 ASP CA 1 1 4 6490 1 1 59 ASP CB C 13.371 2.967 -9.406 1.00 . A A . 59 ASP CB 1 1 4 6491 1 1 59 ASP CG C 14.372 2.774 -8.265 1.00 . A A . 59 ASP CG 1 1 4 6492 1 1 59 ASP H H 11.081 1.594 -10.535 1.00 . A A . 59 ASP H 1 1 4 6493 1 1 59 ASP HA H 13.930 1.644 -11.033 1.00 . A A . 59 ASP HA 1 1 4 6494 1 1 59 ASP HB2 H 13.716 3.785 -10.038 1.00 . A A . 59 ASP HB2 1 1 4 6495 1 1 59 ASP HB3 H 12.414 3.273 -8.982 1.00 . A A . 59 ASP HB3 1 1 4 6496 1 1 59 ASP N N 11.907 1.849 -11.037 1.00 . A A . 59 ASP N 1 1 4 6497 1 1 59 ASP O O 13.998 -0.291 -9.316 1.00 . A A . 59 ASP O 1 1 4 6498 1 1 59 ASP OD1 O 15.247 1.895 -8.421 1.00 . A A . 59 ASP OD1 1 1 4 6499 1 1 59 ASP OD2 O 14.239 3.509 -7.263 1.00 . A A . 59 ASP OD2 1 1 4 6500 1 1 60 LYS C C 12.736 -0.612 -6.602 1.00 . A A . 60 LYS C 1 1 4 6501 1 1 60 LYS CA C 11.735 -0.707 -7.756 1.00 . A A . 60 LYS CA 1 1 4 6502 1 1 60 LYS CB C 11.791 -2.036 -8.511 1.00 . A A . 60 LYS CB 1 1 4 6503 1 1 60 LYS CD C 11.086 -1.857 -10.925 1.00 . A A . 60 LYS CD 1 1 4 6504 1 1 60 LYS CE C 10.054 -2.342 -11.946 1.00 . A A . 60 LYS CE 1 1 4 6505 1 1 60 LYS CG C 10.627 -2.156 -9.497 1.00 . A A . 60 LYS CG 1 1 4 6506 1 1 60 LYS H H 11.194 1.062 -8.715 1.00 . A A . 60 LYS H 1 1 4 6507 1 1 60 LYS HA H 10.729 -0.609 -7.349 1.00 . A A . 60 LYS HA 1 1 4 6508 1 1 60 LYS HB2 H 12.737 -2.115 -9.048 1.00 . A A . 60 LYS HB2 1 1 4 6509 1 1 60 LYS HB3 H 11.758 -2.863 -7.802 1.00 . A A . 60 LYS HB3 1 1 4 6510 1 1 60 LYS HD2 H 11.242 -0.784 -11.044 1.00 . A A . 60 LYS HD2 1 1 4 6511 1 1 60 LYS HD3 H 12.044 -2.341 -11.113 1.00 . A A . 60 LYS HD3 1 1 4 6512 1 1 60 LYS HE2 H 10.492 -3.120 -12.572 1.00 . A A . 60 LYS HE2 1 1 4 6513 1 1 60 LYS HE3 H 9.205 -2.790 -11.428 1.00 . A A . 60 LYS HE3 1 1 4 6514 1 1 60 LYS HG2 H 10.208 -3.161 -9.449 1.00 . A A . 60 LYS HG2 1 1 4 6515 1 1 60 LYS HG3 H 9.833 -1.465 -9.213 1.00 . A A . 60 LYS HG3 1 1 4 6516 1 1 60 LYS HZ1 H 9.323 -0.413 -12.236 1.00 . A A . 60 LYS HZ1 1 1 4 6517 1 1 60 LYS HZ2 H 10.310 -0.906 -13.434 1.00 . A A . 60 LYS HZ2 1 1 4 6518 1 1 60 LYS N N 11.947 0.405 -8.667 1.00 . A A . 60 LYS N 1 1 4 6519 1 1 60 LYS NZ N 9.591 -1.219 -12.790 1.00 . A A . 60 LYS NZ 1 1 4 6520 1 1 60 LYS O O 12.746 0.371 -5.863 1.00 . A A . 60 LYS O 1 1 4 6521 1 1 61 SER C C 13.875 -1.715 -4.062 1.00 . A A . 61 SER C 1 1 4 6522 1 1 61 SER CA C 14.555 -1.694 -5.433 1.00 . A A . 61 SER CA 1 1 4 6523 1 1 61 SER CB C 15.513 -0.506 -5.532 1.00 . A A . 61 SER CB 1 1 4 6524 1 1 61 SER H H 13.539 -2.444 -7.089 1.00 . A A . 61 SER H 1 1 4 6525 1 1 61 SER HA H 15.107 -2.619 -5.600 1.00 . A A . 61 SER HA 1 1 4 6526 1 1 61 SER HB2 H 14.993 0.343 -5.976 1.00 . A A . 61 SER HB2 1 1 4 6527 1 1 61 SER HB3 H 15.820 -0.202 -4.531 1.00 . A A . 61 SER HB3 1 1 4 6528 1 1 61 SER HG H 17.194 0.019 -6.483 1.00 . A A . 61 SER HG 1 1 4 6529 1 1 61 SER N N 13.554 -1.648 -6.484 1.00 . A A . 61 SER N 1 1 4 6530 1 1 61 SER O O 13.772 -2.767 -3.432 1.00 . A A . 61 SER O 1 1 4 6531 1 1 61 SER OG O 16.668 -0.813 -6.308 1.00 . A A . 61 SER OG 1 1 4 6532 1 1 62 ALA C C 12.228 1.015 -2.206 1.00 . A A . 62 ALA C 1 1 4 6533 1 1 62 ALA CA C 12.762 -0.411 -2.356 1.00 . A A . 62 ALA CA 1 1 4 6534 1 1 62 ALA CB C 13.733 -0.791 -1.236 1.00 . A A . 62 ALA CB 1 1 4 6535 1 1 62 ALA H H 13.517 0.310 -4.159 1.00 . A A . 62 ALA H 1 1 4 6536 1 1 62 ALA HA H 11.924 -1.108 -2.346 1.00 . A A . 62 ALA HA 1 1 4 6537 1 1 62 ALA HB1 H 14.740 -0.882 -1.643 1.00 . A A . 62 ALA HB1 1 1 4 6538 1 1 62 ALA HB2 H 13.720 -0.019 -0.467 1.00 . A A . 62 ALA HB2 1 1 4 6539 1 1 62 ALA HB3 H 13.429 -1.743 -0.800 1.00 . A A . 62 ALA HB3 1 1 4 6540 1 1 62 ALA N N 13.429 -0.541 -3.641 1.00 . A A . 62 ALA N 1 1 4 6541 1 1 62 ALA O O 11.120 1.217 -1.712 1.00 . A A . 62 ALA O 1 1 4 6542 1 1 63 LYS C C 11.456 3.618 -3.467 1.00 . A A . 63 LYS C 1 1 4 6543 1 1 63 LYS CA C 12.663 3.367 -2.561 1.00 . A A . 63 LYS CA 1 1 4 6544 1 1 63 LYS CB C 13.863 4.264 -2.873 1.00 . A A . 63 LYS CB 1 1 4 6545 1 1 63 LYS CD C 14.432 5.430 -0.711 1.00 . A A . 63 LYS CD 1 1 4 6546 1 1 63 LYS CE C 15.662 6.210 -0.239 1.00 . A A . 63 LYS CE 1 1 4 6547 1 1 63 LYS CG C 14.828 4.320 -1.686 1.00 . A A . 63 LYS CG 1 1 4 6548 1 1 63 LYS H H 13.940 1.793 -3.043 1.00 . A A . 63 LYS H 1 1 4 6549 1 1 63 LYS HA H 12.370 3.568 -1.531 1.00 . A A . 63 LYS HA 1 1 4 6550 1 1 63 LYS HB2 H 14.385 3.887 -3.753 1.00 . A A . 63 LYS HB2 1 1 4 6551 1 1 63 LYS HB3 H 13.517 5.269 -3.114 1.00 . A A . 63 LYS HB3 1 1 4 6552 1 1 63 LYS HD2 H 13.729 6.110 -1.193 1.00 . A A . 63 LYS HD2 1 1 4 6553 1 1 63 LYS HD3 H 13.919 4.998 0.149 1.00 . A A . 63 LYS HD3 1 1 4 6554 1 1 63 LYS HE2 H 15.848 6.003 0.814 1.00 . A A . 63 LYS HE2 1 1 4 6555 1 1 63 LYS HE3 H 16.542 5.879 -0.790 1.00 . A A . 63 LYS HE3 1 1 4 6556 1 1 63 LYS HG2 H 14.830 3.361 -1.169 1.00 . A A . 63 LYS HG2 1 1 4 6557 1 1 63 LYS HG3 H 15.842 4.492 -2.046 1.00 . A A . 63 LYS HG3 1 1 4 6558 1 1 63 LYS HZ1 H 15.390 7.905 -1.420 1.00 . A A . 63 LYS HZ1 1 1 4 6559 1 1 63 LYS HZ2 H 14.615 7.994 0.009 1.00 . A A . 63 LYS HZ2 1 1 4 6560 1 1 63 LYS N N 13.040 1.966 -2.642 1.00 . A A . 63 LYS N 1 1 4 6561 1 1 63 LYS NZ N 15.462 7.663 -0.438 1.00 . A A . 63 LYS NZ 1 1 4 6562 1 1 63 LYS O O 10.711 4.576 -3.263 1.00 . A A . 63 LYS O 1 1 4 6563 1 1 64 GLY C C 8.851 2.771 -4.663 1.00 . A A . 64 GLY C 1 1 4 6564 1 1 64 GLY CA C 10.196 2.857 -5.386 1.00 . A A . 64 GLY CA 1 1 4 6565 1 1 64 GLY H H 11.910 1.965 -4.607 1.00 . A A . 64 GLY H 1 1 4 6566 1 1 64 GLY HA2 H 10.266 3.804 -5.921 1.00 . A A . 64 GLY HA2 1 1 4 6567 1 1 64 GLY HA3 H 10.263 2.064 -6.131 1.00 . A A . 64 GLY HA3 1 1 4 6568 1 1 64 GLY N N 11.300 2.742 -4.448 1.00 . A A . 64 GLY N 1 1 4 6569 1 1 64 GLY O O 8.337 1.679 -4.426 1.00 . A A . 64 GLY O 1 1 4 6570 1 1 65 TYR C C 5.958 3.249 -4.408 1.00 . A A . 65 TYR C 1 1 4 6571 1 1 65 TYR CA C 7.042 4.009 -3.640 1.00 . A A . 65 TYR CA 1 1 4 6572 1 1 65 TYR CB C 6.670 5.492 -3.591 1.00 . A A . 65 TYR CB 1 1 4 6573 1 1 65 TYR CD1 C 4.778 5.462 -1.925 1.00 . A A . 65 TYR CD1 1 1 4 6574 1 1 65 TYR CD2 C 4.338 6.289 -4.124 1.00 . A A . 65 TYR CD2 1 1 4 6575 1 1 65 TYR CE1 C 3.408 5.711 -1.558 1.00 . A A . 65 TYR CE1 1 1 4 6576 1 1 65 TYR CE2 C 2.968 6.538 -3.757 1.00 . A A . 65 TYR CE2 1 1 4 6577 1 1 65 TYR CG C 5.214 5.757 -3.201 1.00 . A A . 65 TYR CG 1 1 4 6578 1 1 65 TYR CZ C 2.571 6.237 -2.492 1.00 . A A . 65 TYR CZ 1 1 4 6579 1 1 65 TYR H H 8.741 4.822 -4.529 1.00 . A A . 65 TYR H 1 1 4 6580 1 1 65 TYR HA H 7.166 3.554 -2.657 1.00 . A A . 65 TYR HA 1 1 4 6581 1 1 65 TYR HB2 H 7.324 5.997 -2.880 1.00 . A A . 65 TYR HB2 1 1 4 6582 1 1 65 TYR HB3 H 6.860 5.936 -4.569 1.00 . A A . 65 TYR HB3 1 1 4 6583 1 1 65 TYR HD1 H 5.470 5.042 -1.196 1.00 . A A . 65 TYR HD1 1 1 4 6584 1 1 65 TYR HD2 H 4.683 6.522 -5.132 1.00 . A A . 65 TYR HD2 1 1 4 6585 1 1 65 TYR HE1 H 3.050 5.484 -0.554 1.00 . A A . 65 TYR HE1 1 1 4 6586 1 1 65 TYR HE2 H 2.266 6.958 -4.477 1.00 . A A . 65 TYR HE2 1 1 4 6587 1 1 65 TYR HH H 1.240 6.957 -1.271 1.00 . A A . 65 TYR HH 1 1 4 6588 1 1 65 TYR N N 8.317 3.938 -4.332 1.00 . A A . 65 TYR N 1 1 4 6589 1 1 65 TYR O O 5.149 2.541 -3.810 1.00 . A A . 65 TYR O 1 1 4 6590 1 1 65 TYR OH O 1.277 6.472 -2.145 1.00 . A A . 65 TYR OH 1 1 4 6591 1 1 66 TYR C C 5.362 1.286 -6.773 1.00 . A A . 66 TYR C 1 1 4 6592 1 1 66 TYR CA C 5.007 2.761 -6.578 1.00 . A A . 66 TYR CA 1 1 4 6593 1 1 66 TYR CB C 5.082 3.475 -7.929 1.00 . A A . 66 TYR CB 1 1 4 6594 1 1 66 TYR CD1 C 5.366 1.675 -9.672 1.00 . A A . 66 TYR CD1 1 1 4 6595 1 1 66 TYR CD2 C 3.290 2.857 -9.592 1.00 . A A . 66 TYR CD2 1 1 4 6596 1 1 66 TYR CE1 C 4.877 0.891 -10.776 1.00 . A A . 66 TYR CE1 1 1 4 6597 1 1 66 TYR CE2 C 2.801 2.073 -10.696 1.00 . A A . 66 TYR CE2 1 1 4 6598 1 1 66 TYR CG C 4.562 2.642 -9.102 1.00 . A A . 66 TYR CG 1 1 4 6599 1 1 66 TYR CZ C 3.619 1.128 -11.233 1.00 . A A . 66 TYR CZ 1 1 4 6600 1 1 66 TYR H H 6.640 3.999 -6.200 1.00 . A A . 66 TYR H 1 1 4 6601 1 1 66 TYR HA H 4.032 2.832 -6.097 1.00 . A A . 66 TYR HA 1 1 4 6602 1 1 66 TYR HB2 H 4.509 4.400 -7.872 1.00 . A A . 66 TYR HB2 1 1 4 6603 1 1 66 TYR HB3 H 6.118 3.753 -8.125 1.00 . A A . 66 TYR HB3 1 1 4 6604 1 1 66 TYR HD1 H 6.371 1.505 -9.285 1.00 . A A . 66 TYR HD1 1 1 4 6605 1 1 66 TYR HD2 H 2.655 3.621 -9.142 1.00 . A A . 66 TYR HD2 1 1 4 6606 1 1 66 TYR HE1 H 5.501 0.124 -11.235 1.00 . A A . 66 TYR HE1 1 1 4 6607 1 1 66 TYR HE2 H 1.798 2.233 -11.092 1.00 . A A . 66 TYR HE2 1 1 4 6608 1 1 66 TYR HH H 2.226 0.075 -12.088 1.00 . A A . 66 TYR HH 1 1 4 6609 1 1 66 TYR N N 5.978 3.422 -5.722 1.00 . A A . 66 TYR N 1 1 4 6610 1 1 66 TYR O O 4.655 0.560 -7.470 1.00 . A A . 66 TYR O 1 1 4 6611 1 1 66 TYR OH O 3.157 0.388 -12.276 1.00 . A A . 66 TYR OH 1 1 4 6612 1 1 67 HIS C C 6.503 -1.257 -4.985 1.00 . A A . 67 HIS C 1 1 4 6613 1 1 67 HIS CA C 6.917 -0.489 -6.242 1.00 . A A . 67 HIS CA 1 1 4 6614 1 1 67 HIS CB C 8.423 -0.544 -6.501 1.00 . A A . 67 HIS CB 1 1 4 6615 1 1 67 HIS CD2 C 9.617 -1.867 -4.588 1.00 . A A . 67 HIS CD2 1 1 4 6616 1 1 67 HIS CE1 C 9.978 -3.730 -5.676 1.00 . A A . 67 HIS CE1 1 1 4 6617 1 1 67 HIS CG C 9.117 -1.716 -5.848 1.00 . A A . 67 HIS CG 1 1 4 6618 1 1 67 HIS H H 7.029 1.482 -5.580 1.00 . A A . 67 HIS H 1 1 4 6619 1 1 67 HIS HA H 6.415 -0.926 -7.106 1.00 . A A . 67 HIS HA 1 1 4 6620 1 1 67 HIS HB2 H 8.596 -0.586 -7.576 1.00 . A A . 67 HIS HB2 1 1 4 6621 1 1 67 HIS HB3 H 8.877 0.380 -6.141 1.00 . A A . 67 HIS HB3 1 1 4 6622 1 1 67 HIS HD1 H 9.112 -3.110 -7.457 1.00 . A A . 67 HIS HD1 1 1 4 6623 1 1 67 HIS HD2 H 9.593 -1.115 -3.799 1.00 . A A . 67 HIS HD2 1 1 4 6624 1 1 67 HIS HE1 H 10.304 -4.745 -5.902 1.00 . A A . 67 HIS HE1 1 1 4 6625 1 1 67 HIS N N 6.458 0.886 -6.146 1.00 . A A . 67 HIS N 1 1 4 6626 1 1 67 HIS ND1 N 9.360 -2.906 -6.510 1.00 . A A . 67 HIS ND1 1 1 4 6627 1 1 67 HIS NE2 N 10.136 -3.084 -4.485 1.00 . A A . 67 HIS NE2 1 1 4 6628 1 1 67 HIS O O 6.474 -2.487 -4.986 1.00 . A A . 67 HIS O 1 1 4 6629 1 1 68 VAL C C 4.256 -1.055 -2.577 1.00 . A A . 68 VAL C 1 1 4 6630 1 1 68 VAL CA C 5.782 -1.094 -2.682 1.00 . A A . 68 VAL CA 1 1 4 6631 1 1 68 VAL CB C 6.479 -0.386 -1.518 1.00 . A A . 68 VAL CB 1 1 4 6632 1 1 68 VAL CG1 C 7.924 -0.869 -1.369 1.00 . A A . 68 VAL CG1 1 1 4 6633 1 1 68 VAL CG2 C 6.424 1.133 -1.689 1.00 . A A . 68 VAL CG2 1 1 4 6634 1 1 68 VAL H H 6.219 0.500 -3.951 1.00 . A A . 68 VAL H 1 1 4 6635 1 1 68 VAL HA H 6.107 -2.135 -2.687 1.00 . A A . 68 VAL HA 1 1 4 6636 1 1 68 VAL HB H 5.945 -0.640 -0.603 1.00 . A A . 68 VAL HB 1 1 4 6637 1 1 68 VAL HG11 H 7.958 -1.952 -1.480 1.00 . A A . 68 VAL HG11 1 1 4 6638 1 1 68 VAL HG12 H 8.543 -0.405 -2.137 1.00 . A A . 68 VAL HG12 1 1 4 6639 1 1 68 VAL HG13 H 8.299 -0.592 -0.384 1.00 . A A . 68 VAL HG13 1 1 4 6640 1 1 68 VAL HG21 H 5.408 1.434 -1.944 1.00 . A A . 68 VAL HG21 1 1 4 6641 1 1 68 VAL HG22 H 6.722 1.615 -0.757 1.00 . A A . 68 VAL HG22 1 1 4 6642 1 1 68 VAL HG23 H 7.103 1.435 -2.487 1.00 . A A . 68 VAL HG23 1 1 4 6643 1 1 68 VAL N N 6.193 -0.500 -3.943 1.00 . A A . 68 VAL N 1 1 4 6644 1 1 68 VAL O O 3.695 -1.356 -1.525 1.00 . A A . 68 VAL O 1 1 4 6645 1 1 69 MET C C 1.606 -1.582 -4.751 1.00 . A A . 69 MET C 1 1 4 6646 1 1 69 MET CA C 2.179 -0.599 -3.729 1.00 . A A . 69 MET CA 1 1 4 6647 1 1 69 MET CB C 1.760 0.826 -4.099 1.00 . A A . 69 MET CB 1 1 4 6648 1 1 69 MET CE C 2.726 2.170 -0.451 1.00 . A A . 69 MET CE 1 1 4 6649 1 1 69 MET CG C 2.384 1.846 -3.145 1.00 . A A . 69 MET CG 1 1 4 6650 1 1 69 MET H H 4.093 -0.438 -4.535 1.00 . A A . 69 MET H 1 1 4 6651 1 1 69 MET HA H 1.839 -0.865 -2.728 1.00 . A A . 69 MET HA 1 1 4 6652 1 1 69 MET HB2 H 2.067 1.044 -5.122 1.00 . A A . 69 MET HB2 1 1 4 6653 1 1 69 MET HB3 H 0.674 0.909 -4.067 1.00 . A A . 69 MET HB3 1 1 4 6654 1 1 69 MET HE1 H 3.476 1.392 -0.586 1.00 . A A . 69 MET HE1 1 1 4 6655 1 1 69 MET HE2 H 3.187 3.148 -0.592 1.00 . A A . 69 MET HE2 1 1 4 6656 1 1 69 MET HE3 H 2.312 2.106 0.555 1.00 . A A . 69 MET HE3 1 1 4 6657 1 1 69 MET HG2 H 3.408 1.557 -2.908 1.00 . A A . 69 MET HG2 1 1 4 6658 1 1 69 MET HG3 H 2.431 2.824 -3.625 1.00 . A A . 69 MET HG3 1 1 4 6659 1 1 69 MET N N 3.629 -0.681 -3.683 1.00 . A A . 69 MET N 1 1 4 6660 1 1 69 MET O O 0.402 -1.834 -4.768 1.00 . A A . 69 MET O 1 1 4 6661 1 1 69 MET SD S 1.419 1.950 -1.647 1.00 . A A . 69 MET SD 1 1 4 6662 1 1 70 HIS C C 3.048 -4.254 -6.599 1.00 . A A . 70 HIS C 1 1 4 6663 1 1 70 HIS CA C 2.092 -3.060 -6.603 1.00 . A A . 70 HIS CA 1 1 4 6664 1 1 70 HIS CB C 2.000 -2.379 -7.970 1.00 . A A . 70 HIS CB 1 1 4 6665 1 1 70 HIS CD2 C 0.048 -0.677 -8.328 1.00 . A A . 70 HIS CD2 1 1 4 6666 1 1 70 HIS CE1 C 1.057 1.115 -7.582 1.00 . A A . 70 HIS CE1 1 1 4 6667 1 1 70 HIS CG C 1.306 -1.038 -7.942 1.00 . A A . 70 HIS CG 1 1 4 6668 1 1 70 HIS H H 3.472 -1.900 -5.559 1.00 . A A . 70 HIS H 1 1 4 6669 1 1 70 HIS HA H 1.093 -3.404 -6.335 1.00 . A A . 70 HIS HA 1 1 4 6670 1 1 70 HIS HB2 H 3.006 -2.247 -8.368 1.00 . A A . 70 HIS HB2 1 1 4 6671 1 1 70 HIS HB3 H 1.469 -3.037 -8.657 1.00 . A A . 70 HIS HB3 1 1 4 6672 1 1 70 HIS HD1 H 2.850 0.178 -7.122 1.00 . A A . 70 HIS HD1 1 1 4 6673 1 1 70 HIS HD2 H -0.706 -1.344 -8.745 1.00 . A A . 70 HIS HD2 1 1 4 6674 1 1 70 HIS HE1 H 1.241 2.151 -7.297 1.00 . A A . 70 HIS HE1 1 1 4 6675 1 1 70 HIS N N 2.495 -2.110 -5.580 1.00 . A A . 70 HIS N 1 1 4 6676 1 1 70 HIS ND1 N 1.917 0.113 -7.477 1.00 . A A . 70 HIS ND1 1 1 4 6677 1 1 70 HIS NE2 N -0.101 0.623 -8.109 1.00 . A A . 70 HIS NE2 1 1 4 6678 1 1 70 HIS O O 2.637 -5.382 -6.328 1.00 . A A . 70 HIS O 1 1 4 6679 1 1 71 ASP C C 5.080 -5.990 -5.794 1.00 . A A . 71 ASP C 1 1 4 6680 1 1 71 ASP CA C 5.323 -5.003 -6.938 1.00 . A A . 71 ASP CA 1 1 4 6681 1 1 71 ASP CB C 6.721 -4.409 -6.760 1.00 . A A . 71 ASP CB 1 1 4 6682 1 1 71 ASP CG C 7.813 -5.057 -7.613 1.00 . A A . 71 ASP CG 1 1 4 6683 1 1 71 ASP H H 4.631 -3.047 -7.122 1.00 . A A . 71 ASP H 1 1 4 6684 1 1 71 ASP HA H 5.223 -5.469 -7.919 1.00 . A A . 71 ASP HA 1 1 4 6685 1 1 71 ASP HB2 H 6.680 -3.345 -6.997 1.00 . A A . 71 ASP HB2 1 1 4 6686 1 1 71 ASP HB3 H 7.004 -4.491 -5.711 1.00 . A A . 71 ASP HB3 1 1 4 6687 1 1 71 ASP N N 4.305 -3.966 -6.903 1.00 . A A . 71 ASP N 1 1 4 6688 1 1 71 ASP O O 4.865 -5.582 -4.654 1.00 . A A . 71 ASP O 1 1 4 6689 1 1 71 ASP OD1 O 8.305 -6.125 -7.189 1.00 . A A . 71 ASP OD1 1 1 4 6690 1 1 71 ASP OD2 O 8.131 -4.471 -8.670 1.00 . A A . 71 ASP OD2 1 1 4 6691 1 1 72 LYS C C 6.260 -8.887 -4.723 1.00 . A A . 72 LYS C 1 1 4 6692 1 1 72 LYS CA C 4.907 -8.316 -5.155 1.00 . A A . 72 LYS CA 1 1 4 6693 1 1 72 LYS CB C 3.939 -9.370 -5.697 1.00 . A A . 72 LYS CB 1 1 4 6694 1 1 72 LYS CD C 2.657 -8.854 -7.806 1.00 . A A . 72 LYS CD 1 1 4 6695 1 1 72 LYS CE C 1.965 -7.653 -8.453 1.00 . A A . 72 LYS CE 1 1 4 6696 1 1 72 LYS CG C 2.687 -8.715 -6.283 1.00 . A A . 72 LYS CG 1 1 4 6697 1 1 72 LYS H H 5.297 -7.591 -7.069 1.00 . A A . 72 LYS H 1 1 4 6698 1 1 72 LYS HA H 4.433 -7.858 -4.288 1.00 . A A . 72 LYS HA 1 1 4 6699 1 1 72 LYS HB2 H 4.435 -9.965 -6.464 1.00 . A A . 72 LYS HB2 1 1 4 6700 1 1 72 LYS HB3 H 3.656 -10.054 -4.897 1.00 . A A . 72 LYS HB3 1 1 4 6701 1 1 72 LYS HD2 H 3.674 -8.941 -8.187 1.00 . A A . 72 LYS HD2 1 1 4 6702 1 1 72 LYS HD3 H 2.135 -9.770 -8.081 1.00 . A A . 72 LYS HD3 1 1 4 6703 1 1 72 LYS HE2 H 1.041 -7.428 -7.921 1.00 . A A . 72 LYS HE2 1 1 4 6704 1 1 72 LYS HE3 H 2.602 -6.772 -8.372 1.00 . A A . 72 LYS HE3 1 1 4 6705 1 1 72 LYS HG2 H 1.797 -9.175 -5.854 1.00 . A A . 72 LYS HG2 1 1 4 6706 1 1 72 LYS HG3 H 2.663 -7.660 -6.010 1.00 . A A . 72 LYS HG3 1 1 4 6707 1 1 72 LYS HZ1 H 2.456 -8.360 -10.351 1.00 . A A . 72 LYS HZ1 1 1 4 6708 1 1 72 LYS HZ2 H 0.881 -8.557 -9.986 1.00 . A A . 72 LYS HZ2 1 1 4 6709 1 1 72 LYS N N 5.121 -7.268 -6.139 1.00 . A A . 72 LYS N 1 1 4 6710 1 1 72 LYS NZ N 1.670 -7.929 -9.877 1.00 . A A . 72 LYS NZ 1 1 4 6711 1 1 72 LYS O O 6.424 -9.304 -3.578 1.00 . A A . 72 LYS O 1 1 4 6712 1 1 73 ASN C C 9.265 -8.431 -4.471 1.00 . A A . 73 ASN C 1 1 4 6713 1 1 73 ASN CA C 8.525 -9.402 -5.394 1.00 . A A . 73 ASN CA 1 1 4 6714 1 1 73 ASN CB C 9.335 -9.536 -6.686 1.00 . A A . 73 ASN CB 1 1 4 6715 1 1 73 ASN CG C 9.205 -10.943 -7.272 1.00 . A A . 73 ASN CG 1 1 4 6716 1 1 73 ASN H H 7.051 -8.547 -6.593 1.00 . A A . 73 ASN H 1 1 4 6717 1 1 73 ASN HA H 8.369 -10.378 -4.935 1.00 . A A . 73 ASN HA 1 1 4 6718 1 1 73 ASN HB2 H 8.990 -8.801 -7.413 1.00 . A A . 73 ASN HB2 1 1 4 6719 1 1 73 ASN HB3 H 10.384 -9.317 -6.485 1.00 . A A . 73 ASN HB3 1 1 4 6720 1 1 73 ASN HD21 H 7.885 -10.208 -8.619 1.00 . A A . 73 ASN HD21 1 1 4 6721 1 1 73 ASN HD22 H 8.210 -11.904 -8.750 1.00 . A A . 73 ASN HD22 1 1 4 6722 1 1 73 ASN N N 7.193 -8.888 -5.663 1.00 . A A . 73 ASN N 1 1 4 6723 1 1 73 ASN ND2 N 8.364 -11.025 -8.299 1.00 . A A . 73 ASN ND2 1 1 4 6724 1 1 73 ASN O O 10.239 -7.802 -4.879 1.00 . A A . 73 ASN O 1 1 4 6725 1 1 73 ASN OD1 O 9.826 -11.891 -6.821 1.00 . A A . 73 ASN OD1 1 1 4 6726 1 1 74 THR C C 9.618 -8.207 -0.949 1.00 . A A . 74 THR C 1 1 4 6727 1 1 74 THR CA C 9.374 -7.457 -2.260 1.00 . A A . 74 THR CA 1 1 4 6728 1 1 74 THR CB C 8.464 -6.237 -2.102 1.00 . A A . 74 THR CB 1 1 4 6729 1 1 74 THR CG2 C 8.225 -5.509 -3.426 1.00 . A A . 74 THR CG2 1 1 4 6730 1 1 74 THR H H 7.979 -8.857 -2.921 1.00 . A A . 74 THR H 1 1 4 6731 1 1 74 THR HA H 10.347 -7.139 -2.633 1.00 . A A . 74 THR HA 1 1 4 6732 1 1 74 THR HB H 8.856 -5.555 -1.347 1.00 . A A . 74 THR HB 1 1 4 6733 1 1 74 THR HG1 H 6.802 -7.246 -2.577 1.00 . A A . 74 THR HG1 1 1 4 6734 1 1 74 THR HG21 H 8.929 -5.874 -4.174 1.00 . A A . 74 THR HG21 1 1 4 6735 1 1 74 THR HG22 H 7.206 -5.697 -3.765 1.00 . A A . 74 THR HG22 1 1 4 6736 1 1 74 THR HG23 H 8.369 -4.438 -3.283 1.00 . A A . 74 THR HG23 1 1 4 6737 1 1 74 THR N N 8.772 -8.341 -3.244 1.00 . A A . 74 THR N 1 1 4 6738 1 1 74 THR O O 8.959 -9.207 -0.669 1.00 . A A . 74 THR O 1 1 4 6739 1 1 74 THR OG1 O 7.193 -6.792 -1.776 1.00 . A A . 74 THR OG1 1 1 4 6740 1 1 75 LYS C C 9.713 -8.193 2.043 1.00 . A A . 75 LYS C 1 1 4 6741 1 1 75 LYS CA C 10.908 -8.304 1.094 1.00 . A A . 75 LYS CA 1 1 4 6742 1 1 75 LYS CB C 12.196 -7.695 1.653 1.00 . A A . 75 LYS CB 1 1 4 6743 1 1 75 LYS CD C 13.795 -7.647 3.602 1.00 . A A . 75 LYS CD 1 1 4 6744 1 1 75 LYS CE C 14.363 -8.551 4.698 1.00 . A A . 75 LYS CE 1 1 4 6745 1 1 75 LYS CG C 12.468 -8.196 3.073 1.00 . A A . 75 LYS CG 1 1 4 6746 1 1 75 LYS H H 11.100 -6.882 -0.415 1.00 . A A . 75 LYS H 1 1 4 6747 1 1 75 LYS HA H 11.106 -9.360 0.910 1.00 . A A . 75 LYS HA 1 1 4 6748 1 1 75 LYS HB2 H 13.035 -7.951 1.006 1.00 . A A . 75 LYS HB2 1 1 4 6749 1 1 75 LYS HB3 H 12.116 -6.608 1.656 1.00 . A A . 75 LYS HB3 1 1 4 6750 1 1 75 LYS HD2 H 14.511 -7.566 2.785 1.00 . A A . 75 LYS HD2 1 1 4 6751 1 1 75 LYS HD3 H 13.646 -6.642 3.996 1.00 . A A . 75 LYS HD3 1 1 4 6752 1 1 75 LYS HE2 H 14.199 -9.596 4.437 1.00 . A A . 75 LYS HE2 1 1 4 6753 1 1 75 LYS HE3 H 15.441 -8.407 4.774 1.00 . A A . 75 LYS HE3 1 1 4 6754 1 1 75 LYS HG2 H 11.656 -7.891 3.732 1.00 . A A . 75 LYS HG2 1 1 4 6755 1 1 75 LYS HG3 H 12.493 -9.285 3.080 1.00 . A A . 75 LYS HG3 1 1 4 6756 1 1 75 LYS HZ1 H 14.396 -7.926 6.686 1.00 . A A . 75 LYS HZ1 1 1 4 6757 1 1 75 LYS HZ2 H 13.015 -7.533 5.918 1.00 . A A . 75 LYS HZ2 1 1 4 6758 1 1 75 LYS N N 10.568 -7.695 -0.180 1.00 . A A . 75 LYS N 1 1 4 6759 1 1 75 LYS NZ N 13.725 -8.252 5.999 1.00 . A A . 75 LYS NZ 1 1 4 6760 1 1 75 LYS O O 9.580 -8.985 2.975 1.00 . A A . 75 LYS O 1 1 4 6761 1 1 76 PHE C C 6.417 -7.116 1.761 1.00 . A A . 76 PHE C 1 1 4 6762 1 1 76 PHE CA C 7.694 -6.978 2.591 1.00 . A A . 76 PHE CA 1 1 4 6763 1 1 76 PHE CB C 7.804 -5.541 3.102 1.00 . A A . 76 PHE CB 1 1 4 6764 1 1 76 PHE CD1 C 8.971 -5.974 5.294 1.00 . A A . 76 PHE CD1 1 1 4 6765 1 1 76 PHE CD2 C 9.982 -4.450 3.755 1.00 . A A . 76 PHE CD2 1 1 4 6766 1 1 76 PHE CE1 C 10.055 -5.761 6.217 1.00 . A A . 76 PHE CE1 1 1 4 6767 1 1 76 PHE CE2 C 11.066 -4.237 4.678 1.00 . A A . 76 PHE CE2 1 1 4 6768 1 1 76 PHE CG C 8.956 -5.314 4.082 1.00 . A A . 76 PHE CG 1 1 4 6769 1 1 76 PHE CZ C 11.049 -4.903 5.863 1.00 . A A . 76 PHE CZ 1 1 4 6770 1 1 76 PHE H H 8.989 -6.565 1.013 1.00 . A A . 76 PHE H 1 1 4 6771 1 1 76 PHE HA H 7.687 -7.727 3.383 1.00 . A A . 76 PHE HA 1 1 4 6772 1 1 76 PHE HB2 H 7.929 -4.872 2.250 1.00 . A A . 76 PHE HB2 1 1 4 6773 1 1 76 PHE HB3 H 6.868 -5.266 3.588 1.00 . A A . 76 PHE HB3 1 1 4 6774 1 1 76 PHE HD1 H 8.161 -6.657 5.553 1.00 . A A . 76 PHE HD1 1 1 4 6775 1 1 76 PHE HD2 H 9.970 -3.929 2.797 1.00 . A A . 76 PHE HD2 1 1 4 6776 1 1 76 PHE HE1 H 10.079 -6.276 7.177 1.00 . A A . 76 PHE HE1 1 1 4 6777 1 1 76 PHE HE2 H 11.882 -3.558 4.432 1.00 . A A . 76 PHE HE2 1 1 4 6778 1 1 76 PHE HZ H 11.855 -4.823 6.636 1.00 . A A . 76 PHE HZ 1 1 4 6779 1 1 76 PHE N N 8.874 -7.204 1.773 1.00 . A A . 76 PHE N 1 1 4 6780 1 1 76 PHE O O 6.445 -6.960 0.541 1.00 . A A . 76 PHE O 1 1 4 6781 1 1 77 LYS C C 3.626 -6.238 1.166 1.00 . A A . 77 LYS C 1 1 4 6782 1 1 77 LYS CA C 4.041 -7.569 1.797 1.00 . A A . 77 LYS CA 1 1 4 6783 1 1 77 LYS CB C 3.008 -8.136 2.772 1.00 . A A . 77 LYS CB 1 1 4 6784 1 1 77 LYS CD C 1.671 -10.239 3.164 1.00 . A A . 77 LYS CD 1 1 4 6785 1 1 77 LYS CE C 1.831 -11.454 4.079 1.00 . A A . 77 LYS CE 1 1 4 6786 1 1 77 LYS CG C 3.034 -9.666 2.771 1.00 . A A . 77 LYS CG 1 1 4 6787 1 1 77 LYS H H 5.312 -7.533 3.447 1.00 . A A . 77 LYS H 1 1 4 6788 1 1 77 LYS HA H 4.171 -8.303 1.002 1.00 . A A . 77 LYS HA 1 1 4 6789 1 1 77 LYS HB2 H 3.209 -7.767 3.778 1.00 . A A . 77 LYS HB2 1 1 4 6790 1 1 77 LYS HB3 H 2.013 -7.786 2.498 1.00 . A A . 77 LYS HB3 1 1 4 6791 1 1 77 LYS HD2 H 1.083 -9.473 3.670 1.00 . A A . 77 LYS HD2 1 1 4 6792 1 1 77 LYS HD3 H 1.120 -10.524 2.268 1.00 . A A . 77 LYS HD3 1 1 4 6793 1 1 77 LYS HE2 H 1.929 -12.359 3.479 1.00 . A A . 77 LYS HE2 1 1 4 6794 1 1 77 LYS HE3 H 2.745 -11.359 4.664 1.00 . A A . 77 LYS HE3 1 1 4 6795 1 1 77 LYS HG2 H 3.313 -10.027 1.781 1.00 . A A . 77 LYS HG2 1 1 4 6796 1 1 77 LYS HG3 H 3.796 -10.021 3.465 1.00 . A A . 77 LYS HG3 1 1 4 6797 1 1 77 LYS HZ1 H 0.020 -10.803 4.880 1.00 . A A . 77 LYS HZ1 1 1 4 6798 1 1 77 LYS HZ2 H 0.139 -12.426 4.813 1.00 . A A . 77 LYS HZ2 1 1 4 6799 1 1 77 LYS N N 5.326 -7.408 2.455 1.00 . A A . 77 LYS N 1 1 4 6800 1 1 77 LYS NZ N 0.666 -11.577 4.985 1.00 . A A . 77 LYS NZ 1 1 4 6801 1 1 77 LYS O O 3.599 -5.209 1.840 1.00 . A A . 77 LYS O 1 1 4 6802 1 1 78 SER C C 1.374 -5.074 -0.962 1.00 . A A . 78 SER C 1 1 4 6803 1 1 78 SER CA C 2.899 -5.115 -0.849 1.00 . A A . 78 SER CA 1 1 4 6804 1 1 78 SER CB C 3.536 -5.074 -2.239 1.00 . A A . 78 SER CB 1 1 4 6805 1 1 78 SER H H 3.336 -7.143 -0.660 1.00 . A A . 78 SER H 1 1 4 6806 1 1 78 SER HA H 3.262 -4.273 -0.259 1.00 . A A . 78 SER HA 1 1 4 6807 1 1 78 SER HB2 H 3.582 -4.042 -2.586 1.00 . A A . 78 SER HB2 1 1 4 6808 1 1 78 SER HB3 H 4.563 -5.436 -2.179 1.00 . A A . 78 SER HB3 1 1 4 6809 1 1 78 SER HG H 3.217 -5.762 -4.091 1.00 . A A . 78 SER HG 1 1 4 6810 1 1 78 SER N N 3.312 -6.302 -0.119 1.00 . A A . 78 SER N 1 1 4 6811 1 1 78 SER O O 0.714 -6.108 -0.871 1.00 . A A . 78 SER O 1 1 4 6812 1 1 78 SER OG O 2.811 -5.859 -3.182 1.00 . A A . 78 SER OG 1 1 4 6813 1 1 79 CYS C C -1.129 -4.788 -2.185 1.00 . A A . 79 CYS C 1 1 4 6814 1 1 79 CYS CA C -0.576 -3.680 -1.286 1.00 . A A . 79 CYS CA 1 1 4 6815 1 1 79 CYS CB C -0.918 -2.288 -1.820 1.00 . A A . 79 CYS CB 1 1 4 6816 1 1 79 CYS H H 1.404 -3.034 -1.233 1.00 . A A . 79 CYS H 1 1 4 6817 1 1 79 CYS HA H -0.991 -3.754 -0.281 1.00 . A A . 79 CYS HA 1 1 4 6818 1 1 79 CYS HB2 H -0.583 -2.218 -2.855 1.00 . A A . 79 CYS HB2 1 1 4 6819 1 1 79 CYS HB3 H -2.002 -2.173 -1.827 1.00 . A A . 79 CYS HB3 1 1 4 6820 1 1 79 CYS N N 0.859 -3.869 -1.160 1.00 . A A . 79 CYS N 1 1 4 6821 1 1 79 CYS O O -1.886 -5.643 -1.729 1.00 . A A . 79 CYS O 1 1 4 6822 1 1 79 CYS SG S -0.187 -0.902 -0.873 1.00 . A A . 79 CYS SG 1 1 4 6823 1 1 80 VAL C C -0.665 -7.105 -4.000 1.00 . A A . 80 VAL C 1 1 4 6824 1 1 80 VAL CA C -1.176 -5.724 -4.415 1.00 . A A . 80 VAL CA 1 1 4 6825 1 1 80 VAL CB C -0.729 -5.319 -5.821 1.00 . A A . 80 VAL CB 1 1 4 6826 1 1 80 VAL CG1 C -1.106 -6.390 -6.846 1.00 . A A . 80 VAL CG1 1 1 4 6827 1 1 80 VAL CG2 C -1.310 -3.958 -6.211 1.00 . A A . 80 VAL CG2 1 1 4 6828 1 1 80 VAL H H -0.113 -4.037 -3.811 1.00 . A A . 80 VAL H 1 1 4 6829 1 1 80 VAL HA H -2.266 -5.733 -4.397 1.00 . A A . 80 VAL HA 1 1 4 6830 1 1 80 VAL HB H 0.358 -5.229 -5.814 1.00 . A A . 80 VAL HB 1 1 4 6831 1 1 80 VAL HG11 H -0.678 -7.347 -6.546 1.00 . A A . 80 VAL HG11 1 1 4 6832 1 1 80 VAL HG12 H -2.191 -6.477 -6.898 1.00 . A A . 80 VAL HG12 1 1 4 6833 1 1 80 VAL HG13 H -0.717 -6.109 -7.825 1.00 . A A . 80 VAL HG13 1 1 4 6834 1 1 80 VAL HG21 H -1.229 -3.273 -5.366 1.00 . A A . 80 VAL HG21 1 1 4 6835 1 1 80 VAL HG22 H -0.756 -3.556 -7.059 1.00 . A A . 80 VAL HG22 1 1 4 6836 1 1 80 VAL HG23 H -2.358 -4.076 -6.484 1.00 . A A . 80 VAL HG23 1 1 4 6837 1 1 80 VAL N N -0.729 -4.736 -3.448 1.00 . A A . 80 VAL N 1 1 4 6838 1 1 80 VAL O O -1.367 -8.103 -4.157 1.00 . A A . 80 VAL O 1 1 4 6839 1 1 81 GLY C C 0.226 -9.140 -2.118 1.00 . A A . 81 GLY C 1 1 4 6840 1 1 81 GLY CA C 1.166 -8.361 -3.040 1.00 . A A . 81 GLY CA 1 1 4 6841 1 1 81 GLY H H 1.117 -6.302 -3.354 1.00 . A A . 81 GLY H 1 1 4 6842 1 1 81 GLY HA2 H 1.420 -8.971 -3.907 1.00 . A A . 81 GLY HA2 1 1 4 6843 1 1 81 GLY HA3 H 2.098 -8.146 -2.518 1.00 . A A . 81 GLY HA3 1 1 4 6844 1 1 81 GLY N N 0.553 -7.118 -3.479 1.00 . A A . 81 GLY N 1 1 4 6845 1 1 81 GLY O O -0.147 -10.272 -2.421 1.00 . A A . 81 GLY O 1 1 4 6846 1 1 82 CYS C C -2.373 -9.354 -0.715 1.00 . A A . 82 CYS C 1 1 4 6847 1 1 82 CYS CA C -1.018 -9.123 -0.044 1.00 . A A . 82 CYS CA 1 1 4 6848 1 1 82 CYS CB C -1.147 -8.280 1.226 1.00 . A A . 82 CYS CB 1 1 4 6849 1 1 82 CYS H H 0.179 -7.582 -0.774 1.00 . A A . 82 CYS H 1 1 4 6850 1 1 82 CYS HA H -0.559 -10.070 0.240 1.00 . A A . 82 CYS HA 1 1 4 6851 1 1 82 CYS HB2 H -0.160 -8.087 1.647 1.00 . A A . 82 CYS HB2 1 1 4 6852 1 1 82 CYS HB3 H -1.585 -7.311 0.987 1.00 . A A . 82 CYS HB3 1 1 4 6853 1 1 82 CYS N N -0.129 -8.503 -1.012 1.00 . A A . 82 CYS N 1 1 4 6854 1 1 82 CYS O O -2.962 -10.425 -0.579 1.00 . A A . 82 CYS O 1 1 4 6855 1 1 82 CYS SG S -2.188 -9.151 2.453 1.00 . A A . 82 CYS SG 1 1 4 6856 1 1 83 HIS C C -4.132 -9.663 -2.999 1.00 . A A . 83 HIS C 1 1 4 6857 1 1 83 HIS CA C -4.102 -8.412 -2.119 1.00 . A A . 83 HIS CA 1 1 4 6858 1 1 83 HIS CB C -4.374 -7.128 -2.904 1.00 . A A . 83 HIS CB 1 1 4 6859 1 1 83 HIS CD2 C -4.774 -5.735 -0.729 1.00 . A A . 83 HIS CD2 1 1 4 6860 1 1 83 HIS CE1 C -5.981 -4.133 -1.602 1.00 . A A . 83 HIS CE1 1 1 4 6861 1 1 83 HIS CG C -4.906 -5.993 -2.062 1.00 . A A . 83 HIS CG 1 1 4 6862 1 1 83 HIS H H -2.342 -7.465 -1.533 1.00 . A A . 83 HIS H 1 1 4 6863 1 1 83 HIS HA H -4.871 -8.501 -1.350 1.00 . A A . 83 HIS HA 1 1 4 6864 1 1 83 HIS HB2 H -3.451 -6.807 -3.387 1.00 . A A . 83 HIS HB2 1 1 4 6865 1 1 83 HIS HB3 H -5.090 -7.344 -3.697 1.00 . A A . 83 HIS HB3 1 1 4 6866 1 1 83 HIS HD1 H -5.945 -4.869 -3.541 1.00 . A A . 83 HIS HD1 1 1 4 6867 1 1 83 HIS HD2 H -4.229 -6.349 -0.012 1.00 . A A . 83 HIS HD2 1 1 4 6868 1 1 83 HIS HE1 H -6.577 -3.224 -1.695 1.00 . A A . 83 HIS HE1 1 1 4 6869 1 1 83 HIS N N -2.828 -8.333 -1.426 1.00 . A A . 83 HIS N 1 1 4 6870 1 1 83 HIS ND1 N -5.672 -4.966 -2.584 1.00 . A A . 83 HIS ND1 1 1 4 6871 1 1 83 HIS NE2 N -5.424 -4.611 -0.452 1.00 . A A . 83 HIS NE2 1 1 4 6872 1 1 83 HIS O O -5.129 -10.383 -3.028 1.00 . A A . 83 HIS O 1 1 4 6873 1 1 84 VAL C C -3.181 -12.311 -3.774 1.00 . A A . 84 VAL C 1 1 4 6874 1 1 84 VAL CA C -2.913 -11.035 -4.575 1.00 . A A . 84 VAL CA 1 1 4 6875 1 1 84 VAL CB C -1.546 -11.036 -5.262 1.00 . A A . 84 VAL CB 1 1 4 6876 1 1 84 VAL CG1 C -1.351 -12.306 -6.093 1.00 . A A . 84 VAL CG1 1 1 4 6877 1 1 84 VAL CG2 C -1.364 -9.784 -6.123 1.00 . A A . 84 VAL CG2 1 1 4 6878 1 1 84 VAL H H -2.220 -9.293 -3.667 1.00 . A A . 84 VAL H 1 1 4 6879 1 1 84 VAL HA H -3.678 -10.937 -5.345 1.00 . A A . 84 VAL HA 1 1 4 6880 1 1 84 VAL HB H -0.781 -11.022 -4.486 1.00 . A A . 84 VAL HB 1 1 4 6881 1 1 84 VAL HG11 H -2.322 -12.677 -6.422 1.00 . A A . 84 VAL HG11 1 1 4 6882 1 1 84 VAL HG12 H -0.735 -12.079 -6.963 1.00 . A A . 84 VAL HG12 1 1 4 6883 1 1 84 VAL HG13 H -0.858 -13.065 -5.486 1.00 . A A . 84 VAL HG13 1 1 4 6884 1 1 84 VAL HG21 H -2.209 -9.112 -5.970 1.00 . A A . 84 VAL HG21 1 1 4 6885 1 1 84 VAL HG22 H -0.442 -9.278 -5.837 1.00 . A A . 84 VAL HG22 1 1 4 6886 1 1 84 VAL HG23 H -1.312 -10.070 -7.173 1.00 . A A . 84 VAL HG23 1 1 4 6887 1 1 84 VAL N N -3.027 -9.883 -3.696 1.00 . A A . 84 VAL N 1 1 4 6888 1 1 84 VAL O O -3.867 -13.214 -4.250 1.00 . A A . 84 VAL O 1 1 4 6889 1 1 85 GLU C C -4.205 -13.506 -1.105 1.00 . A A . 85 GLU C 1 1 4 6890 1 1 85 GLU CA C -2.796 -13.494 -1.701 1.00 . A A . 85 GLU CA 1 1 4 6891 1 1 85 GLU CB C -1.735 -13.509 -0.599 1.00 . A A . 85 GLU CB 1 1 4 6892 1 1 85 GLU CD C -0.475 -15.592 0.061 1.00 . A A . 85 GLU CD 1 1 4 6893 1 1 85 GLU CG C -0.586 -14.454 -0.956 1.00 . A A . 85 GLU CG 1 1 4 6894 1 1 85 GLU H H -2.069 -11.605 -2.192 1.00 . A A . 85 GLU H 1 1 4 6895 1 1 85 GLU HA H -2.657 -14.366 -2.341 1.00 . A A . 85 GLU HA 1 1 4 6896 1 1 85 GLU HB2 H -1.348 -12.501 -0.448 1.00 . A A . 85 GLU HB2 1 1 4 6897 1 1 85 GLU HB3 H -2.187 -13.821 0.343 1.00 . A A . 85 GLU HB3 1 1 4 6898 1 1 85 GLU HG2 H -0.745 -14.866 -1.952 1.00 . A A . 85 GLU HG2 1 1 4 6899 1 1 85 GLU HG3 H 0.351 -13.898 -0.987 1.00 . A A . 85 GLU HG3 1 1 4 6900 1 1 85 GLU N N -2.626 -12.344 -2.572 1.00 . A A . 85 GLU N 1 1 4 6901 1 1 85 GLU O O -4.785 -14.570 -0.896 1.00 . A A . 85 GLU O 1 1 4 6902 1 1 85 GLU OE1 O 0.070 -15.326 1.153 1.00 . A A . 85 GLU OE1 1 1 4 6903 1 1 85 GLU OE2 O -0.939 -16.702 -0.278 1.00 . A A . 85 GLU OE2 1 1 4 6904 1 1 86 VAL C C -7.086 -12.562 -1.332 1.00 . A A . 86 VAL C 1 1 4 6905 1 1 86 VAL CA C -6.045 -12.169 -0.282 1.00 . A A . 86 VAL CA 1 1 4 6906 1 1 86 VAL CB C -6.239 -10.748 0.250 1.00 . A A . 86 VAL CB 1 1 4 6907 1 1 86 VAL CG1 C -7.673 -10.537 0.740 1.00 . A A . 86 VAL CG1 1 1 4 6908 1 1 86 VAL CG2 C -5.229 -10.433 1.355 1.00 . A A . 86 VAL CG2 1 1 4 6909 1 1 86 VAL H H -4.236 -11.449 -1.023 1.00 . A A . 86 VAL H 1 1 4 6910 1 1 86 VAL HA H -6.118 -12.857 0.560 1.00 . A A . 86 VAL HA 1 1 4 6911 1 1 86 VAL HB H -6.061 -10.055 -0.573 1.00 . A A . 86 VAL HB 1 1 4 6912 1 1 86 VAL HG11 H -7.924 -11.307 1.469 1.00 . A A . 86 VAL HG11 1 1 4 6913 1 1 86 VAL HG12 H -7.757 -9.555 1.206 1.00 . A A . 86 VAL HG12 1 1 4 6914 1 1 86 VAL HG13 H -8.358 -10.598 -0.105 1.00 . A A . 86 VAL HG13 1 1 4 6915 1 1 86 VAL HG21 H -4.566 -11.287 1.495 1.00 . A A . 86 VAL HG21 1 1 4 6916 1 1 86 VAL HG22 H -4.642 -9.559 1.074 1.00 . A A . 86 VAL HG22 1 1 4 6917 1 1 86 VAL HG23 H -5.760 -10.231 2.285 1.00 . A A . 86 VAL HG23 1 1 4 6918 1 1 86 VAL N N -4.714 -12.310 -0.850 1.00 . A A . 86 VAL N 1 1 4 6919 1 1 86 VAL O O -7.959 -13.388 -1.067 1.00 . A A . 86 VAL O 1 1 4 6920 1 1 87 ALA C C -7.720 -13.683 -4.033 1.00 . A A . 87 ALA C 1 1 4 6921 1 1 87 ALA CA C -7.881 -12.227 -3.591 1.00 . A A . 87 ALA CA 1 1 4 6922 1 1 87 ALA CB C -7.630 -11.240 -4.733 1.00 . A A . 87 ALA CB 1 1 4 6923 1 1 87 ALA H H -6.249 -11.281 -2.708 1.00 . A A . 87 ALA H 1 1 4 6924 1 1 87 ALA HA H -8.894 -12.080 -3.216 1.00 . A A . 87 ALA HA 1 1 4 6925 1 1 87 ALA HB1 H -6.566 -11.015 -4.791 1.00 . A A . 87 ALA HB1 1 1 4 6926 1 1 87 ALA HB2 H -7.960 -11.682 -5.674 1.00 . A A . 87 ALA HB2 1 1 4 6927 1 1 87 ALA HB3 H -8.187 -10.322 -4.548 1.00 . A A . 87 ALA HB3 1 1 4 6928 1 1 87 ALA N N -6.961 -11.952 -2.501 1.00 . A A . 87 ALA N 1 1 4 6929 1 1 87 ALA O O -8.603 -14.240 -4.683 1.00 . A A . 87 ALA O 1 1 4 6930 1 1 88 GLY C C -6.726 -15.941 -5.451 1.00 . A A . 88 GLY C 1 1 4 6931 1 1 88 GLY CA C -6.297 -15.639 -4.013 1.00 . A A . 88 GLY CA 1 1 4 6932 1 1 88 GLY H H -5.872 -13.799 -3.134 1.00 . A A . 88 GLY H 1 1 4 6933 1 1 88 GLY HA2 H -5.230 -15.831 -3.900 1.00 . A A . 88 GLY HA2 1 1 4 6934 1 1 88 GLY HA3 H -6.816 -16.308 -3.327 1.00 . A A . 88 GLY HA3 1 1 4 6935 1 1 88 GLY N N -6.585 -14.259 -3.663 1.00 . A A . 88 GLY N 1 1 4 6936 1 1 88 GLY O O -6.187 -15.368 -6.396 1.00 . A A . 88 GLY O 1 1 4 6937 1 1 89 ALA C C -9.610 -16.663 -7.056 1.00 . A A . 89 ALA C 1 1 4 6938 1 1 89 ALA CA C -8.198 -17.225 -6.876 1.00 . A A . 89 ALA CA 1 1 4 6939 1 1 89 ALA CB C -8.156 -18.749 -7.011 1.00 . A A . 89 ALA CB 1 1 4 6940 1 1 89 ALA H H -8.125 -17.301 -4.795 1.00 . A A . 89 ALA H 1 1 4 6941 1 1 89 ALA HA H -7.543 -16.787 -7.629 1.00 . A A . 89 ALA HA 1 1 4 6942 1 1 89 ALA HB1 H -7.513 -19.164 -6.235 1.00 . A A . 89 ALA HB1 1 1 4 6943 1 1 89 ALA HB2 H -9.163 -19.151 -6.903 1.00 . A A . 89 ALA HB2 1 1 4 6944 1 1 89 ALA HB3 H -7.762 -19.015 -7.992 1.00 . A A . 89 ALA HB3 1 1 4 6945 1 1 89 ALA N N -7.692 -16.840 -5.570 1.00 . A A . 89 ALA N 1 1 4 6946 1 1 89 ALA O O -10.593 -17.393 -6.937 1.00 . A A . 89 ALA O 1 1 4 6947 1 1 90 ASP C C -10.729 -13.455 -8.401 1.00 . A A . 90 ASP C 1 1 4 6948 1 1 90 ASP CA C -10.940 -14.701 -7.538 1.00 . A A . 90 ASP CA 1 1 4 6949 1 1 90 ASP CB C -11.541 -14.256 -6.204 1.00 . A A . 90 ASP CB 1 1 4 6950 1 1 90 ASP CG C -13.042 -13.960 -6.237 1.00 . A A . 90 ASP CG 1 1 4 6951 1 1 90 ASP H H -8.861 -14.783 -7.436 1.00 . A A . 90 ASP H 1 1 4 6952 1 1 90 ASP HA H -11.579 -15.440 -8.022 1.00 . A A . 90 ASP HA 1 1 4 6953 1 1 90 ASP HB2 H -11.356 -15.033 -5.462 1.00 . A A . 90 ASP HB2 1 1 4 6954 1 1 90 ASP HB3 H -11.017 -13.362 -5.867 1.00 . A A . 90 ASP HB3 1 1 4 6955 1 1 90 ASP N N -9.665 -15.370 -7.341 1.00 . A A . 90 ASP N 1 1 4 6956 1 1 90 ASP O O -10.361 -12.398 -7.892 1.00 . A A . 90 ASP O 1 1 4 6957 1 1 90 ASP OD1 O -13.698 -14.456 -7.179 1.00 . A A . 90 ASP OD1 1 1 4 6958 1 1 90 ASP OD2 O -13.500 -13.244 -5.321 1.00 . A A . 90 ASP OD2 1 1 4 6959 1 1 91 ALA C C -11.482 -11.271 -10.062 1.00 . A A . 91 ALA C 1 1 4 6960 1 1 91 ALA CA C -10.813 -12.523 -10.631 1.00 . A A . 91 ALA CA 1 1 4 6961 1 1 91 ALA CB C -11.390 -12.925 -11.990 1.00 . A A . 91 ALA CB 1 1 4 6962 1 1 91 ALA H H -11.272 -14.484 -10.099 1.00 . A A . 91 ALA H 1 1 4 6963 1 1 91 ALA HA H -9.746 -12.335 -10.745 1.00 . A A . 91 ALA HA 1 1 4 6964 1 1 91 ALA HB1 H -12.112 -13.730 -11.855 1.00 . A A . 91 ALA HB1 1 1 4 6965 1 1 91 ALA HB2 H -11.884 -12.066 -12.444 1.00 . A A . 91 ALA HB2 1 1 4 6966 1 1 91 ALA HB3 H -10.584 -13.266 -12.640 1.00 . A A . 91 ALA HB3 1 1 4 6967 1 1 91 ALA N N -10.972 -13.621 -9.693 1.00 . A A . 91 ALA N 1 1 4 6968 1 1 91 ALA O O -10.889 -10.193 -10.057 1.00 . A A . 91 ALA O 1 1 4 6969 1 1 92 ALA C C -12.558 -9.543 -8.096 1.00 . A A . 92 ALA C 1 1 4 6970 1 1 92 ALA CA C -13.465 -10.351 -9.026 1.00 . A A . 92 ALA CA 1 1 4 6971 1 1 92 ALA CB C -14.700 -10.897 -8.306 1.00 . A A . 92 ALA CB 1 1 4 6972 1 1 92 ALA H H -13.184 -12.333 -9.603 1.00 . A A . 92 ALA H 1 1 4 6973 1 1 92 ALA HA H -13.791 -9.713 -9.847 1.00 . A A . 92 ALA HA 1 1 4 6974 1 1 92 ALA HB1 H -14.688 -11.987 -8.340 1.00 . A A . 92 ALA HB1 1 1 4 6975 1 1 92 ALA HB2 H -14.691 -10.567 -7.267 1.00 . A A . 92 ALA HB2 1 1 4 6976 1 1 92 ALA HB3 H -15.600 -10.528 -8.797 1.00 . A A . 92 ALA HB3 1 1 4 6977 1 1 92 ALA N N -12.709 -11.453 -9.595 1.00 . A A . 92 ALA N 1 1 4 6978 1 1 92 ALA O O -12.292 -8.369 -8.348 1.00 . A A . 92 ALA O 1 1 4 6979 1 1 93 LYS C C -9.907 -9.208 -6.742 1.00 . A A . 93 LYS C 1 1 4 6980 1 1 93 LYS CA C -11.235 -9.562 -6.070 1.00 . A A . 93 LYS CA 1 1 4 6981 1 1 93 LYS CB C -11.082 -10.437 -4.825 1.00 . A A . 93 LYS CB 1 1 4 6982 1 1 93 LYS CD C -12.035 -10.823 -2.523 1.00 . A A . 93 LYS CD 1 1 4 6983 1 1 93 LYS CE C -13.324 -11.144 -1.764 1.00 . A A . 93 LYS CE 1 1 4 6984 1 1 93 LYS CG C -12.339 -10.379 -3.955 1.00 . A A . 93 LYS CG 1 1 4 6985 1 1 93 LYS H H -12.327 -11.160 -6.842 1.00 . A A . 93 LYS H 1 1 4 6986 1 1 93 LYS HA H -11.721 -8.638 -5.757 1.00 . A A . 93 LYS HA 1 1 4 6987 1 1 93 LYS HB2 H -10.888 -11.468 -5.122 1.00 . A A . 93 LYS HB2 1 1 4 6988 1 1 93 LYS HB3 H -10.219 -10.106 -4.247 1.00 . A A . 93 LYS HB3 1 1 4 6989 1 1 93 LYS HD2 H -11.390 -11.701 -2.539 1.00 . A A . 93 LYS HD2 1 1 4 6990 1 1 93 LYS HD3 H -11.489 -10.036 -2.002 1.00 . A A . 93 LYS HD3 1 1 4 6991 1 1 93 LYS HE2 H -13.545 -10.346 -1.056 1.00 . A A . 93 LYS HE2 1 1 4 6992 1 1 93 LYS HE3 H -14.161 -11.193 -2.461 1.00 . A A . 93 LYS HE3 1 1 4 6993 1 1 93 LYS HG2 H -12.734 -9.363 -3.949 1.00 . A A . 93 LYS HG2 1 1 4 6994 1 1 93 LYS HG3 H -13.111 -11.019 -4.382 1.00 . A A . 93 LYS HG3 1 1 4 6995 1 1 93 LYS HZ1 H -12.231 -12.638 -0.806 1.00 . A A . 93 LYS HZ1 1 1 4 6996 1 1 93 LYS HZ2 H -13.720 -12.436 -0.177 1.00 . A A . 93 LYS HZ2 1 1 4 6997 1 1 93 LYS N N -12.107 -10.204 -7.040 1.00 . A A . 93 LYS N 1 1 4 6998 1 1 93 LYS NZ N -13.195 -12.432 -1.044 1.00 . A A . 93 LYS NZ 1 1 4 6999 1 1 93 LYS O O -9.294 -8.193 -6.416 1.00 . A A . 93 LYS O 1 1 4 7000 1 1 94 LYS C C -8.385 -8.617 -9.272 1.00 . A A . 94 LYS C 1 1 4 7001 1 1 94 LYS CA C -8.255 -9.858 -8.385 1.00 . A A . 94 LYS CA 1 1 4 7002 1 1 94 LYS CB C -7.860 -11.122 -9.151 1.00 . A A . 94 LYS CB 1 1 4 7003 1 1 94 LYS CD C -5.921 -12.241 -10.310 1.00 . A A . 94 LYS CD 1 1 4 7004 1 1 94 LYS CE C -4.409 -12.478 -10.292 1.00 . A A . 94 LYS CE 1 1 4 7005 1 1 94 LYS CG C -6.340 -11.287 -9.190 1.00 . A A . 94 LYS CG 1 1 4 7006 1 1 94 LYS H H -10.005 -10.890 -7.925 1.00 . A A . 94 LYS H 1 1 4 7007 1 1 94 LYS HA H -7.477 -9.673 -7.645 1.00 . A A . 94 LYS HA 1 1 4 7008 1 1 94 LYS HB2 H -8.312 -11.994 -8.679 1.00 . A A . 94 LYS HB2 1 1 4 7009 1 1 94 LYS HB3 H -8.251 -11.073 -10.167 1.00 . A A . 94 LYS HB3 1 1 4 7010 1 1 94 LYS HD2 H -6.442 -13.192 -10.197 1.00 . A A . 94 LYS HD2 1 1 4 7011 1 1 94 LYS HD3 H -6.216 -11.828 -11.275 1.00 . A A . 94 LYS HD3 1 1 4 7012 1 1 94 LYS HE2 H -4.102 -12.827 -9.306 1.00 . A A . 94 LYS HE2 1 1 4 7013 1 1 94 LYS HE3 H -4.149 -13.262 -11.003 1.00 . A A . 94 LYS HE3 1 1 4 7014 1 1 94 LYS HG2 H -5.869 -10.315 -9.341 1.00 . A A . 94 LYS HG2 1 1 4 7015 1 1 94 LYS HG3 H -5.987 -11.667 -8.232 1.00 . A A . 94 LYS HG3 1 1 4 7016 1 1 94 LYS HZ1 H -2.810 -11.152 -10.127 1.00 . A A . 94 LYS HZ1 1 1 4 7017 1 1 94 LYS HZ2 H -3.461 -11.181 -11.619 1.00 . A A . 94 LYS HZ2 1 1 4 7018 1 1 94 LYS N N -9.500 -10.066 -7.666 1.00 . A A . 94 LYS N 1 1 4 7019 1 1 94 LYS NZ N -3.685 -11.233 -10.632 1.00 . A A . 94 LYS NZ 1 1 4 7020 1 1 94 LYS O O -7.402 -8.159 -9.852 1.00 . A A . 94 LYS O 1 1 4 7021 1 1 95 LYS C C -10.414 -5.816 -9.255 1.00 . A A . 95 LYS C 1 1 4 7022 1 1 95 LYS CA C -9.878 -6.931 -10.155 1.00 . A A . 95 LYS CA 1 1 4 7023 1 1 95 LYS CB C -10.806 -7.281 -11.319 1.00 . A A . 95 LYS CB 1 1 4 7024 1 1 95 LYS CD C -10.905 -7.274 -13.839 1.00 . A A . 95 LYS CD 1 1 4 7025 1 1 95 LYS CE C -10.021 -8.473 -14.189 1.00 . A A . 95 LYS CE 1 1 4 7026 1 1 95 LYS CG C -10.382 -6.552 -12.596 1.00 . A A . 95 LYS CG 1 1 4 7027 1 1 95 LYS H H -10.401 -8.488 -8.873 1.00 . A A . 95 LYS H 1 1 4 7028 1 1 95 LYS HA H -8.931 -6.604 -10.584 1.00 . A A . 95 LYS HA 1 1 4 7029 1 1 95 LYS HB2 H -10.792 -8.358 -11.490 1.00 . A A . 95 LYS HB2 1 1 4 7030 1 1 95 LYS HB3 H -11.831 -7.013 -11.066 1.00 . A A . 95 LYS HB3 1 1 4 7031 1 1 95 LYS HD2 H -11.927 -7.610 -13.667 1.00 . A A . 95 LYS HD2 1 1 4 7032 1 1 95 LYS HD3 H -10.934 -6.582 -14.681 1.00 . A A . 95 LYS HD3 1 1 4 7033 1 1 95 LYS HE2 H -8.971 -8.205 -14.071 1.00 . A A . 95 LYS HE2 1 1 4 7034 1 1 95 LYS HE3 H -10.220 -9.293 -13.498 1.00 . A A . 95 LYS HE3 1 1 4 7035 1 1 95 LYS HG2 H -10.762 -5.530 -12.578 1.00 . A A . 95 LYS HG2 1 1 4 7036 1 1 95 LYS HG3 H -9.295 -6.487 -12.638 1.00 . A A . 95 LYS HG3 1 1 4 7037 1 1 95 LYS HZ1 H -9.704 -9.717 -15.831 1.00 . A A . 95 LYS HZ1 1 1 4 7038 1 1 95 LYS HZ2 H -11.240 -9.185 -15.722 1.00 . A A . 95 LYS HZ2 1 1 4 7039 1 1 95 LYS N N -9.607 -8.109 -9.348 1.00 . A A . 95 LYS N 1 1 4 7040 1 1 95 LYS NZ N -10.273 -8.916 -15.578 1.00 . A A . 95 LYS NZ 1 1 4 7041 1 1 95 LYS O O -10.566 -4.677 -9.696 1.00 . A A . 95 LYS O 1 1 4 7042 1 1 96 ASP C C -10.128 -4.937 -5.996 1.00 . A A . 96 ASP C 1 1 4 7043 1 1 96 ASP CA C -11.203 -5.226 -7.046 1.00 . A A . 96 ASP CA 1 1 4 7044 1 1 96 ASP CB C -12.432 -5.781 -6.325 1.00 . A A . 96 ASP CB 1 1 4 7045 1 1 96 ASP CG C -13.742 -5.048 -6.621 1.00 . A A . 96 ASP CG 1 1 4 7046 1 1 96 ASP H H -10.560 -7.109 -7.661 1.00 . A A . 96 ASP H 1 1 4 7047 1 1 96 ASP HA H -11.464 -4.343 -7.629 1.00 . A A . 96 ASP HA 1 1 4 7048 1 1 96 ASP HB2 H -12.551 -6.830 -6.596 1.00 . A A . 96 ASP HB2 1 1 4 7049 1 1 96 ASP HB3 H -12.250 -5.748 -5.250 1.00 . A A . 96 ASP HB3 1 1 4 7050 1 1 96 ASP N N -10.686 -6.181 -8.011 1.00 . A A . 96 ASP N 1 1 4 7051 1 1 96 ASP O O -10.164 -3.900 -5.335 1.00 . A A . 96 ASP O 1 1 4 7052 1 1 96 ASP OD1 O -14.095 -4.978 -7.818 1.00 . A A . 96 ASP OD1 1 1 4 7053 1 1 96 ASP OD2 O -14.361 -4.574 -5.644 1.00 . A A . 96 ASP OD2 1 1 4 7054 1 1 97 LEU C C -6.812 -5.443 -5.663 1.00 . A A . 97 LEU C 1 1 4 7055 1 1 97 LEU CA C -8.116 -5.732 -4.916 1.00 . A A . 97 LEU CA 1 1 4 7056 1 1 97 LEU CB C -8.044 -6.959 -4.005 1.00 . A A . 97 LEU CB 1 1 4 7057 1 1 97 LEU CD1 C -8.831 -8.203 -1.957 1.00 . A A . 97 LEU CD1 1 1 4 7058 1 1 97 LEU CD2 C -9.317 -5.726 -2.211 1.00 . A A . 97 LEU CD2 1 1 4 7059 1 1 97 LEU CG C -9.130 -7.062 -2.932 1.00 . A A . 97 LEU CG 1 1 4 7060 1 1 97 LEU H H -9.176 -6.713 -6.417 1.00 . A A . 97 LEU H 1 1 4 7061 1 1 97 LEU HA H -8.348 -4.874 -4.284 1.00 . A A . 97 LEU HA 1 1 4 7062 1 1 97 LEU HB2 H -8.090 -7.852 -4.628 1.00 . A A . 97 LEU HB2 1 1 4 7063 1 1 97 LEU HB3 H -7.072 -6.964 -3.511 1.00 . A A . 97 LEU HB3 1 1 4 7064 1 1 97 LEU HD11 H -8.361 -9.026 -2.495 1.00 . A A . 97 LEU HD11 1 1 4 7065 1 1 97 LEU HD12 H -8.157 -7.847 -1.177 1.00 . A A . 97 LEU HD12 1 1 4 7066 1 1 97 LEU HD13 H -9.761 -8.547 -1.505 1.00 . A A . 97 LEU HD13 1 1 4 7067 1 1 97 LEU HD21 H -8.362 -5.203 -2.160 1.00 . A A . 97 LEU HD21 1 1 4 7068 1 1 97 LEU HD22 H -10.037 -5.116 -2.757 1.00 . A A . 97 LEU HD22 1 1 4 7069 1 1 97 LEU HD23 H -9.687 -5.907 -1.201 1.00 . A A . 97 LEU HD23 1 1 4 7070 1 1 97 LEU HG H -10.074 -7.298 -3.423 1.00 . A A . 97 LEU HG 1 1 4 7071 1 1 97 LEU N N -9.198 -5.872 -5.875 1.00 . A A . 97 LEU N 1 1 4 7072 1 1 97 LEU O O -6.071 -4.533 -5.297 1.00 . A A . 97 LEU O 1 1 4 7073 1 1 98 THR C C -5.718 -5.502 -8.872 1.00 . A A . 98 THR C 1 1 4 7074 1 1 98 THR CA C -5.371 -6.078 -7.499 1.00 . A A . 98 THR CA 1 1 4 7075 1 1 98 THR CB C -4.668 -7.435 -7.569 1.00 . A A . 98 THR CB 1 1 4 7076 1 1 98 THR CG2 C -4.670 -8.167 -6.226 1.00 . A A . 98 THR CG2 1 1 4 7077 1 1 98 THR H H -7.180 -6.975 -6.988 1.00 . A A . 98 THR H 1 1 4 7078 1 1 98 THR HA H -4.720 -5.357 -7.004 1.00 . A A . 98 THR HA 1 1 4 7079 1 1 98 THR HB H -3.653 -7.328 -7.953 1.00 . A A . 98 THR HB 1 1 4 7080 1 1 98 THR HG1 H -5.523 -7.862 -9.328 1.00 . A A . 98 THR HG1 1 1 4 7081 1 1 98 THR HG21 H -5.696 -8.294 -5.883 1.00 . A A . 98 THR HG21 1 1 4 7082 1 1 98 THR HG22 H -4.202 -9.145 -6.344 1.00 . A A . 98 THR HG22 1 1 4 7083 1 1 98 THR HG23 H -4.112 -7.583 -5.493 1.00 . A A . 98 THR HG23 1 1 4 7084 1 1 98 THR N N -6.572 -6.237 -6.697 1.00 . A A . 98 THR N 1 1 4 7085 1 1 98 THR O O -4.915 -5.574 -9.801 1.00 . A A . 98 THR O 1 1 4 7086 1 1 98 THR OG1 O -5.519 -8.225 -8.396 1.00 . A A . 98 THR OG1 1 1 4 7087 1 1 99 GLY C C -6.543 -3.130 -10.576 1.00 . A A . 99 GLY C 1 1 4 7088 1 1 99 GLY CA C -7.381 -4.354 -10.203 1.00 . A A . 99 GLY CA 1 1 4 7089 1 1 99 GLY H H -7.564 -4.888 -8.198 1.00 . A A . 99 GLY H 1 1 4 7090 1 1 99 GLY HA2 H -7.326 -5.094 -11.001 1.00 . A A . 99 GLY HA2 1 1 4 7091 1 1 99 GLY HA3 H -8.428 -4.067 -10.105 1.00 . A A . 99 GLY HA3 1 1 4 7092 1 1 99 GLY N N -6.917 -4.943 -8.958 1.00 . A A . 99 GLY N 1 1 4 7093 1 1 99 GLY O O -6.063 -2.411 -9.701 1.00 . A A . 99 GLY O 1 1 4 7094 1 1 100 CYS C C -6.544 -0.586 -12.457 1.00 . A A . 100 CYS C 1 1 4 7095 1 1 100 CYS CA C -5.621 -1.804 -12.377 1.00 . A A . 100 CYS CA 1 1 4 7096 1 1 100 CYS CB C -4.973 -2.118 -13.727 1.00 . A A . 100 CYS CB 1 1 4 7097 1 1 100 CYS H H -6.787 -3.519 -12.583 1.00 . A A . 100 CYS H 1 1 4 7098 1 1 100 CYS HA H -4.816 -1.635 -11.663 1.00 . A A . 100 CYS HA 1 1 4 7099 1 1 100 CYS HB2 H -5.671 -2.710 -14.321 1.00 . A A . 100 CYS HB2 1 1 4 7100 1 1 100 CYS HB3 H -4.812 -1.183 -14.264 1.00 . A A . 100 CYS HB3 1 1 4 7101 1 1 100 CYS N N -6.393 -2.929 -11.877 1.00 . A A . 100 CYS N 1 1 4 7102 1 1 100 CYS O O -6.314 0.415 -11.781 1.00 . A A . 100 CYS O 1 1 4 7103 1 1 100 CYS SG S -3.383 -3.017 -13.625 1.00 . A A . 100 CYS SG 1 1 4 7104 1 1 101 LYS C C -9.919 -0.126 -13.068 1.00 . A A . 101 LYS C 1 1 4 7105 1 1 101 LYS CA C -8.526 0.366 -13.464 1.00 . A A . 101 LYS CA 1 1 4 7106 1 1 101 LYS CB C -8.451 0.921 -14.888 1.00 . A A . 101 LYS CB 1 1 4 7107 1 1 101 LYS CD C -9.824 2.291 -16.500 1.00 . A A . 101 LYS CD 1 1 4 7108 1 1 101 LYS CE C -8.932 3.273 -17.261 1.00 . A A . 101 LYS CE 1 1 4 7109 1 1 101 LYS CG C -9.361 2.140 -15.049 1.00 . A A . 101 LYS CG 1 1 4 7110 1 1 101 LYS H H -7.747 -1.531 -13.834 1.00 . A A . 101 LYS H 1 1 4 7111 1 1 101 LYS HA H -8.239 1.171 -12.789 1.00 . A A . 101 LYS HA 1 1 4 7112 1 1 101 LYS HB2 H -7.423 1.196 -15.122 1.00 . A A . 101 LYS HB2 1 1 4 7113 1 1 101 LYS HB3 H -8.743 0.148 -15.599 1.00 . A A . 101 LYS HB3 1 1 4 7114 1 1 101 LYS HD2 H -9.806 1.319 -16.994 1.00 . A A . 101 LYS HD2 1 1 4 7115 1 1 101 LYS HD3 H -10.856 2.640 -16.521 1.00 . A A . 101 LYS HD3 1 1 4 7116 1 1 101 LYS HE2 H -9.139 4.292 -16.934 1.00 . A A . 101 LYS HE2 1 1 4 7117 1 1 101 LYS HE3 H -7.885 3.073 -17.034 1.00 . A A . 101 LYS HE3 1 1 4 7118 1 1 101 LYS HG2 H -10.227 2.041 -14.396 1.00 . A A . 101 LYS HG2 1 1 4 7119 1 1 101 LYS HG3 H -8.829 3.039 -14.739 1.00 . A A . 101 LYS HG3 1 1 4 7120 1 1 101 LYS HZ1 H -9.805 3.863 -19.059 1.00 . A A . 101 LYS HZ1 1 1 4 7121 1 1 101 LYS HZ2 H -8.302 3.265 -19.248 1.00 . A A . 101 LYS HZ2 1 1 4 7122 1 1 101 LYS N N -7.568 -0.712 -13.288 1.00 . A A . 101 LYS N 1 1 4 7123 1 1 101 LYS NZ N -9.160 3.158 -18.719 1.00 . A A . 101 LYS NZ 1 1 4 7124 1 1 101 LYS O O -10.297 -1.253 -13.385 1.00 . A A . 101 LYS O 1 1 4 7125 1 1 102 LYS C C -11.909 -0.614 -10.806 1.00 . A A . 102 LYS C 1 1 4 7126 1 1 102 LYS CA C -11.989 0.412 -11.938 1.00 . A A . 102 LYS CA 1 1 4 7127 1 1 102 LYS CB C -12.846 -0.044 -13.121 1.00 . A A . 102 LYS CB 1 1 4 7128 1 1 102 LYS CD C -14.688 0.596 -14.720 1.00 . A A . 102 LYS CD 1 1 4 7129 1 1 102 LYS CE C -15.296 1.801 -15.441 1.00 . A A . 102 LYS CE 1 1 4 7130 1 1 102 LYS CG C -13.850 1.040 -13.520 1.00 . A A . 102 LYS CG 1 1 4 7131 1 1 102 LYS H H -10.331 1.658 -12.128 1.00 . A A . 102 LYS H 1 1 4 7132 1 1 102 LYS HA H -12.439 1.324 -11.547 1.00 . A A . 102 LYS HA 1 1 4 7133 1 1 102 LYS HB2 H -12.205 -0.281 -13.970 1.00 . A A . 102 LYS HB2 1 1 4 7134 1 1 102 LYS HB3 H -13.378 -0.958 -12.858 1.00 . A A . 102 LYS HB3 1 1 4 7135 1 1 102 LYS HD2 H -14.066 0.030 -15.413 1.00 . A A . 102 LYS HD2 1 1 4 7136 1 1 102 LYS HD3 H -15.482 -0.072 -14.387 1.00 . A A . 102 LYS HD3 1 1 4 7137 1 1 102 LYS HE2 H -15.988 2.318 -14.776 1.00 . A A . 102 LYS HE2 1 1 4 7138 1 1 102 LYS HE3 H -14.511 2.512 -15.699 1.00 . A A . 102 LYS HE3 1 1 4 7139 1 1 102 LYS HG2 H -14.504 1.263 -12.677 1.00 . A A . 102 LYS HG2 1 1 4 7140 1 1 102 LYS HG3 H -13.319 1.961 -13.763 1.00 . A A . 102 LYS HG3 1 1 4 7141 1 1 102 LYS HZ1 H -15.588 0.539 -17.073 1.00 . A A . 102 LYS HZ1 1 1 4 7142 1 1 102 LYS HZ2 H -16.978 1.149 -16.484 1.00 . A A . 102 LYS HZ2 1 1 4 7143 1 1 102 LYS N N -10.646 0.743 -12.381 1.00 . A A . 102 LYS N 1 1 4 7144 1 1 102 LYS NZ N -16.005 1.369 -16.666 1.00 . A A . 102 LYS NZ 1 1 4 7145 1 1 102 LYS O O -12.592 -1.637 -10.840 1.00 . A A . 102 LYS O 1 1 4 7146 1 1 103 SER C C -11.141 -0.420 -7.388 1.00 . A A . 103 SER C 1 1 4 7147 1 1 103 SER CA C -10.891 -1.187 -8.688 1.00 . A A . 103 SER CA 1 1 4 7148 1 1 103 SER CB C -9.490 -1.802 -8.681 1.00 . A A . 103 SER CB 1 1 4 7149 1 1 103 SER H H -10.518 0.529 -9.808 1.00 . A A . 103 SER H 1 1 4 7150 1 1 103 SER HA H -11.632 -1.976 -8.815 1.00 . A A . 103 SER HA 1 1 4 7151 1 1 103 SER HB2 H -9.097 -1.796 -7.664 1.00 . A A . 103 SER HB2 1 1 4 7152 1 1 103 SER HB3 H -9.550 -2.844 -8.993 1.00 . A A . 103 SER HB3 1 1 4 7153 1 1 103 SER HG H -8.570 -0.132 -9.289 1.00 . A A . 103 SER HG 1 1 4 7154 1 1 103 SER N N -11.069 -0.305 -9.828 1.00 . A A . 103 SER N 1 1 4 7155 1 1 103 SER O O -11.598 0.722 -7.416 1.00 . A A . 103 SER O 1 1 4 7156 1 1 103 SER OG O -8.595 -1.100 -9.539 1.00 . A A . 103 SER OG 1 1 4 7157 1 1 104 LYS C C -9.921 0.573 -4.740 1.00 . A A . 104 LYS C 1 1 4 7158 1 1 104 LYS CA C -11.015 -0.471 -4.973 1.00 . A A . 104 LYS CA 1 1 4 7159 1 1 104 LYS CB C -11.079 -1.548 -3.888 1.00 . A A . 104 LYS CB 1 1 4 7160 1 1 104 LYS CD C -13.464 -1.870 -3.133 1.00 . A A . 104 LYS CD 1 1 4 7161 1 1 104 LYS CE C -14.092 -3.003 -2.319 1.00 . A A . 104 LYS CE 1 1 4 7162 1 1 104 LYS CG C -12.344 -2.397 -4.032 1.00 . A A . 104 LYS CG 1 1 4 7163 1 1 104 LYS H H -10.458 -2.006 -6.267 1.00 . A A . 104 LYS H 1 1 4 7164 1 1 104 LYS HA H -11.980 0.036 -4.982 1.00 . A A . 104 LYS HA 1 1 4 7165 1 1 104 LYS HB2 H -10.199 -2.186 -3.951 1.00 . A A . 104 LYS HB2 1 1 4 7166 1 1 104 LYS HB3 H -11.062 -1.079 -2.904 1.00 . A A . 104 LYS HB3 1 1 4 7167 1 1 104 LYS HD2 H -13.067 -1.110 -2.460 1.00 . A A . 104 LYS HD2 1 1 4 7168 1 1 104 LYS HD3 H -14.229 -1.389 -3.742 1.00 . A A . 104 LYS HD3 1 1 4 7169 1 1 104 LYS HE2 H -13.341 -3.764 -2.104 1.00 . A A . 104 LYS HE2 1 1 4 7170 1 1 104 LYS HE3 H -14.440 -2.620 -1.360 1.00 . A A . 104 LYS HE3 1 1 4 7171 1 1 104 LYS HG2 H -12.674 -2.391 -5.071 1.00 . A A . 104 LYS HG2 1 1 4 7172 1 1 104 LYS HG3 H -12.122 -3.432 -3.775 1.00 . A A . 104 LYS HG3 1 1 4 7173 1 1 104 LYS HZ1 H -14.922 -4.376 -3.649 1.00 . A A . 104 LYS HZ1 1 1 4 7174 1 1 104 LYS HZ2 H -15.930 -3.978 -2.433 1.00 . A A . 104 LYS HZ2 1 1 4 7175 1 1 104 LYS N N -10.830 -1.077 -6.281 1.00 . A A . 104 LYS N 1 1 4 7176 1 1 104 LYS NZ N -15.222 -3.608 -3.058 1.00 . A A . 104 LYS NZ 1 1 4 7177 1 1 104 LYS O O -10.125 1.538 -4.006 1.00 . A A . 104 LYS O 1 1 4 7178 1 1 105 CYS C C -7.821 2.371 -6.280 1.00 . A A . 105 CYS C 1 1 4 7179 1 1 105 CYS CA C -7.656 1.252 -5.251 1.00 . A A . 105 CYS CA 1 1 4 7180 1 1 105 CYS CB C -6.321 0.522 -5.410 1.00 . A A . 105 CYS CB 1 1 4 7181 1 1 105 CYS H H -8.625 -0.444 -5.976 1.00 . A A . 105 CYS H 1 1 4 7182 1 1 105 CYS HA H -7.690 1.651 -4.237 1.00 . A A . 105 CYS HA 1 1 4 7183 1 1 105 CYS HB2 H -6.276 0.036 -6.384 1.00 . A A . 105 CYS HB2 1 1 4 7184 1 1 105 CYS HB3 H -5.499 1.238 -5.373 1.00 . A A . 105 CYS HB3 1 1 4 7185 1 1 105 CYS N N -8.783 0.344 -5.380 1.00 . A A . 105 CYS N 1 1 4 7186 1 1 105 CYS O O -7.973 3.536 -5.917 1.00 . A A . 105 CYS O 1 1 4 7187 1 1 105 CYS SG S -6.125 -0.721 -4.082 1.00 . A A . 105 CYS SG 1 1 4 7188 1 1 106 HIS C C -9.384 2.957 -9.105 1.00 . A A . 106 HIS C 1 1 4 7189 1 1 106 HIS CA C -7.929 2.934 -8.630 1.00 . A A . 106 HIS CA 1 1 4 7190 1 1 106 HIS CB C -6.943 2.627 -9.758 1.00 . A A . 106 HIS CB 1 1 4 7191 1 1 106 HIS CD2 C -4.479 1.867 -9.325 1.00 . A A . 106 HIS CD2 1 1 4 7192 1 1 106 HIS CE1 C -3.668 3.793 -8.677 1.00 . A A . 106 HIS CE1 1 1 4 7193 1 1 106 HIS CG C -5.493 2.779 -9.364 1.00 . A A . 106 HIS CG 1 1 4 7194 1 1 106 HIS H H -7.662 1.028 -7.832 1.00 . A A . 106 HIS H 1 1 4 7195 1 1 106 HIS HA H -7.674 3.912 -8.222 1.00 . A A . 106 HIS HA 1 1 4 7196 1 1 106 HIS HB2 H -7.109 1.608 -10.106 1.00 . A A . 106 HIS HB2 1 1 4 7197 1 1 106 HIS HB3 H -7.151 3.289 -10.599 1.00 . A A . 106 HIS HB3 1 1 4 7198 1 1 106 HIS HD1 H -5.443 4.850 -8.870 1.00 . A A . 106 HIS HD1 1 1 4 7199 1 1 106 HIS HD2 H -4.561 0.812 -9.589 1.00 . A A . 106 HIS HD2 1 1 4 7200 1 1 106 HIS HE1 H -2.968 4.551 -8.327 1.00 . A A . 106 HIS HE1 1 1 4 7201 1 1 106 HIS N N -7.786 1.978 -7.545 1.00 . A A . 106 HIS N 1 1 4 7202 1 1 106 HIS ND1 N -4.951 3.983 -8.950 1.00 . A A . 106 HIS ND1 1 1 4 7203 1 1 106 HIS NE2 N -3.378 2.480 -8.911 1.00 . A A . 106 HIS NE2 1 1 4 7204 1 1 106 HIS O O -9.971 1.910 -9.369 1.00 . A A . 106 HIS O 1 1 4 7205 1 1 107 GLU C C -11.346 5.192 -10.905 1.00 . A A . 107 GLU C 1 1 4 7206 1 1 107 GLU CA C -11.297 4.338 -9.636 1.00 . A A . 107 GLU CA 1 1 4 7207 1 1 107 GLU CB C -12.152 4.955 -8.527 1.00 . A A . 107 GLU CB 1 1 4 7208 1 1 107 GLU CD C -13.780 3.777 -7.003 1.00 . A A . 107 GLU CD 1 1 4 7209 1 1 107 GLU CG C -12.305 3.988 -7.351 1.00 . A A . 107 GLU CG 1 1 4 7210 1 1 107 GLU H H -9.438 5.012 -8.982 1.00 . A A . 107 GLU H 1 1 4 7211 1 1 107 GLU HA H -11.662 3.334 -9.851 1.00 . A A . 107 GLU HA 1 1 4 7212 1 1 107 GLU HB2 H -11.694 5.882 -8.183 1.00 . A A . 107 GLU HB2 1 1 4 7213 1 1 107 GLU HB3 H -13.135 5.212 -8.921 1.00 . A A . 107 GLU HB3 1 1 4 7214 1 1 107 GLU HG2 H -11.847 3.031 -7.601 1.00 . A A . 107 GLU HG2 1 1 4 7215 1 1 107 GLU HG3 H -11.775 4.378 -6.483 1.00 . A A . 107 GLU HG3 1 1 4 7216 1 1 107 GLU N N -9.923 4.164 -9.198 1.00 . A A . 107 GLU N 1 1 4 7217 1 1 107 GLU O O -11.724 4.706 -11.970 1.00 . A A . 107 GLU O 1 1 4 7218 1 1 107 GLU OXT O -10.988 6.385 -10.801 1.00 . A A . 107 GLU OXT 1 1 4 7219 1 1 107 GLU OE1 O -14.408 4.767 -6.569 1.00 . A A . 107 GLU OE1 1 1 4 7220 1 1 107 GLU OE2 O -14.247 2.631 -7.180 1.00 . A A . 107 GLU OE2 1 1 4 7221 2 2 1 HEC C1A C -1.111 5.499 9.117 1.00 . B A . 108 HEC C1A 1 1 4 7222 2 2 1 HEC C1B C -1.959 2.385 11.990 1.00 . B A . 108 HEC C1B 1 1 4 7223 2 2 1 HEC C1C C -2.150 -0.524 8.738 1.00 . B A . 108 HEC C1C 1 1 4 7224 2 2 1 HEC C1D C -1.067 2.577 5.931 1.00 . B A . 108 HEC C1D 1 1 4 7225 2 2 1 HEC C2A C -0.981 6.578 10.068 1.00 . B A . 108 HEC C2A 1 1 4 7226 2 2 1 HEC C2B C -2.352 1.492 13.055 1.00 . B A . 108 HEC C2B 1 1 4 7227 2 2 1 HEC C2C C -2.210 -1.605 7.783 1.00 . B A . 108 HEC C2C 1 1 4 7228 2 2 1 HEC C2D C -0.687 3.488 4.876 1.00 . B A . 108 HEC C2D 1 1 4 7229 2 2 1 HEC C3A C -1.178 6.051 11.295 1.00 . B A . 108 HEC C3A 1 1 4 7230 2 2 1 HEC C3B C -2.529 0.272 12.506 1.00 . B A . 108 HEC C3B 1 1 4 7231 2 2 1 HEC C3C C -1.884 -1.089 6.579 1.00 . B A . 108 HEC C3C 1 1 4 7232 2 2 1 HEC C3D C -0.610 4.719 5.423 1.00 . B A . 108 HEC C3D 1 1 4 7233 2 2 1 HEC C4A C -1.431 4.641 11.116 1.00 . B A . 108 HEC C4A 1 1 4 7234 2 2 1 HEC C4B C -2.247 0.397 11.095 1.00 . B A . 108 HEC C4B 1 1 4 7235 2 2 1 HEC C4C C -1.620 0.317 6.777 1.00 . B A . 108 HEC C4C 1 1 4 7236 2 2 1 HEC C4D C -0.942 4.584 6.822 1.00 . B A . 108 HEC C4D 1 1 4 7237 2 2 1 HEC CAA C -0.683 8.005 9.712 1.00 . B A . 108 HEC CAA 1 1 4 7238 2 2 1 HEC CAB C -2.939 -0.999 13.191 1.00 . B A . 108 HEC CAB 1 1 4 7239 2 2 1 HEC CAC C -1.800 -1.802 5.261 1.00 . B A . 108 HEC CAC 1 1 4 7240 2 2 1 HEC CAD C -0.253 6.010 4.747 1.00 . B A . 108 HEC CAD 1 1 4 7241 2 2 1 HEC CBA C 0.806 8.338 9.680 1.00 . B A . 108 HEC CBA 1 1 4 7242 2 2 1 HEC CBB C -4.184 -0.861 14.063 1.00 . B A . 108 HEC CBB 1 1 4 7243 2 2 1 HEC CBC C -2.803 -2.942 5.107 1.00 . B A . 108 HEC CBC 1 1 4 7244 2 2 1 HEC CBD C -0.891 6.188 3.372 1.00 . B A . 108 HEC CBD 1 1 4 7245 2 2 1 HEC CGA C 1.128 9.498 10.613 1.00 . B A . 108 HEC CGA 1 1 4 7246 2 2 1 HEC CGD C 0.154 6.550 2.326 1.00 . B A . 108 HEC CGD 1 1 4 7247 2 2 1 HEC CHA C -0.975 5.648 7.741 1.00 . B A . 108 HEC CHA 1 1 4 7248 2 2 1 HEC CHB C -1.685 3.737 12.164 1.00 . B A . 108 HEC CHB 1 1 4 7249 2 2 1 HEC CHC C -2.320 -0.661 10.171 1.00 . B A . 108 HEC CHC 1 1 4 7250 2 2 1 HEC CHD C -1.247 1.209 5.755 1.00 . B A . 108 HEC CHD 1 1 4 7251 2 2 1 HEC CMA C -1.148 6.758 12.619 1.00 . B A . 108 HEC CMA 1 1 4 7252 2 2 1 HEC CMB C -2.520 1.892 14.492 1.00 . B A . 108 HEC CMB 1 1 4 7253 2 2 1 HEC CMC C -2.571 -3.024 8.114 1.00 . B A . 108 HEC CMC 1 1 4 7254 2 2 1 HEC CMD C -0.434 3.093 3.450 1.00 . B A . 108 HEC CMD 1 1 4 7255 2 2 1 HEC FE FE -1.573 2.482 8.949 1.00 . B A . 108 HEC FE 1 1 4 7256 2 2 1 HEC HAA1 H -1.082 8.224 8.721 1.00 . B A . 108 HEC HAA1 1 1 4 7257 2 2 1 HEC HAA2 H -1.145 8.667 10.444 1.00 . B A . 108 HEC HAA2 1 1 4 7258 2 2 1 HEC HAB H -3.153 -1.762 12.443 1.00 . B A . 108 HEC HAB 1 1 4 7259 2 2 1 HEC HAC H -1.990 -1.095 4.453 1.00 . B A . 108 HEC HAC 1 1 4 7260 2 2 1 HEC HAD1 H -0.580 6.847 5.364 1.00 . B A . 108 HEC HAD1 1 1 4 7261 2 2 1 HEC HAD2 H 0.827 6.062 4.609 1.00 . B A . 108 HEC HAD2 1 1 4 7262 2 2 1 HEC HBA1 H 1.380 7.467 9.996 1.00 . B A . 108 HEC HBA1 1 1 4 7263 2 2 1 HEC HBA2 H 1.095 8.616 8.667 1.00 . B A . 108 HEC HBA2 1 1 4 7264 2 2 1 HEC HBB1 H -4.827 -1.728 13.917 1.00 . B A . 108 HEC HBB1 1 1 4 7265 2 2 1 HEC HBB2 H -3.889 -0.798 15.110 1.00 . B A . 108 HEC HBB2 1 1 4 7266 2 2 1 HEC HBB3 H -4.725 0.044 13.783 1.00 . B A . 108 HEC HBB3 1 1 4 7267 2 2 1 HEC HBC1 H -3.711 -2.705 5.661 1.00 . B A . 108 HEC HBC1 1 1 4 7268 2 2 1 HEC HBC2 H -3.045 -3.073 4.052 1.00 . B A . 108 HEC HBC2 1 1 4 7269 2 2 1 HEC HBC3 H -2.369 -3.863 5.497 1.00 . B A . 108 HEC HBC3 1 1 4 7270 2 2 1 HEC HBD1 H -1.376 5.259 3.074 1.00 . B A . 108 HEC HBD1 1 1 4 7271 2 2 1 HEC HBD2 H -1.631 6.987 3.416 1.00 . B A . 108 HEC HBD2 1 1 4 7272 2 2 1 HEC HHA H -0.886 6.659 7.343 1.00 . B A . 108 HEC HHA 1 1 4 7273 2 2 1 HEC HHB H -1.665 4.129 13.181 1.00 . B A . 108 HEC HHB 1 1 4 7274 2 2 1 HEC HHC H -2.516 -1.659 10.564 1.00 . B A . 108 HEC HHC 1 1 4 7275 2 2 1 HEC HHD H -1.091 0.796 4.759 1.00 . B A . 108 HEC HHD 1 1 4 7276 2 2 1 HEC HMA1 H -0.701 7.744 12.495 1.00 . B A . 108 HEC HMA1 1 1 4 7277 2 2 1 HEC HMA2 H -2.165 6.864 12.997 1.00 . B A . 108 HEC HMA2 1 1 4 7278 2 2 1 HEC HMA3 H -0.556 6.177 13.327 1.00 . B A . 108 HEC HMA3 1 1 4 7279 2 2 1 HEC HMB1 H -3.241 1.229 14.972 1.00 . B A . 108 HEC HMB1 1 1 4 7280 2 2 1 HEC HMB2 H -1.561 1.818 15.005 1.00 . B A . 108 HEC HMB2 1 1 4 7281 2 2 1 HEC HMB3 H -2.882 2.919 14.544 1.00 . B A . 108 HEC HMB3 1 1 4 7282 2 2 1 HEC HMC1 H -3.591 -3.224 7.787 1.00 . B A . 108 HEC HMC1 1 1 4 7283 2 2 1 HEC HMC2 H -1.886 -3.701 7.604 1.00 . B A . 108 HEC HMC2 1 1 4 7284 2 2 1 HEC HMC3 H -2.497 -3.176 9.191 1.00 . B A . 108 HEC HMC3 1 1 4 7285 2 2 1 HEC HMD1 H 0.117 2.153 3.426 1.00 . B A . 108 HEC HMD1 1 1 4 7286 2 2 1 HEC HMD2 H -1.386 2.969 2.934 1.00 . B A . 108 HEC HMD2 1 1 4 7287 2 2 1 HEC HMD3 H 0.150 3.869 2.956 1.00 . B A . 108 HEC HMD3 1 1 4 7288 2 2 1 HEC NA N -1.388 4.312 9.773 1.00 . B A . 108 HEC NA 1 1 4 7289 2 2 1 HEC NB N -1.898 1.700 10.789 1.00 . B A . 108 HEC NB 1 1 4 7290 2 2 1 HEC NC N -1.787 0.654 8.109 1.00 . B A . 108 HEC NC 1 1 4 7291 2 2 1 HEC ND N -1.221 3.262 7.124 1.00 . B A . 108 HEC ND 1 1 4 7292 2 2 1 HEC O1A O 1.428 9.211 11.792 1.00 . B A . 108 HEC O1A 1 1 4 7293 2 2 1 HEC O1D O 0.978 5.662 2.016 1.00 . B A . 108 HEC O1D 1 1 4 7294 2 2 1 HEC O2A O 1.068 10.648 10.128 1.00 . B A . 108 HEC O2A 1 1 4 7295 2 2 1 HEC O2D O 0.109 7.707 1.855 1.00 . B A . 108 HEC O2D 1 1 4 7296 3 2 1 HEC C1A C 9.629 -1.725 1.697 1.00 . C A . 109 HEC C1A 1 1 4 7297 3 2 1 HEC C1B C 5.775 -0.052 2.708 1.00 . C A . 109 HEC C1B 1 1 4 7298 3 2 1 HEC C1C C 7.773 3.005 5.121 1.00 . C A . 109 HEC C1C 1 1 4 7299 3 2 1 HEC C1D C 11.602 1.479 3.824 1.00 . C A . 109 HEC C1D 1 1 4 7300 3 2 1 HEC C2A C 9.134 -2.812 0.886 1.00 . C A . 109 HEC C2A 1 1 4 7301 3 2 1 HEC C2B C 4.416 0.296 3.053 1.00 . C A . 109 HEC C2B 1 1 4 7302 3 2 1 HEC C2C C 8.280 4.153 5.834 1.00 . C A . 109 HEC C2C 1 1 4 7303 3 2 1 HEC C2D C 12.955 1.053 3.553 1.00 . C A . 109 HEC C2D 1 1 4 7304 3 2 1 HEC C3A C 7.789 -2.703 0.854 1.00 . C A . 109 HEC C3A 1 1 4 7305 3 2 1 HEC C3B C 4.478 1.349 3.894 1.00 . C A . 109 HEC C3B 1 1 4 7306 3 2 1 HEC C3C C 9.623 4.142 5.701 1.00 . C A . 109 HEC C3C 1 1 4 7307 3 2 1 HEC C3D C 12.877 -0.090 2.840 1.00 . C A . 109 HEC C3D 1 1 4 7308 3 2 1 HEC C4A C 7.438 -1.546 1.644 1.00 . C A . 109 HEC C4A 1 1 4 7309 3 2 1 HEC C4B C 5.875 1.664 4.079 1.00 . C A . 109 HEC C4B 1 1 4 7310 3 2 1 HEC C4C C 9.961 2.987 4.903 1.00 . C A . 109 HEC C4C 1 1 4 7311 3 2 1 HEC C4D C 11.474 -0.384 2.662 1.00 . C A . 109 HEC C4D 1 1 4 7312 3 2 1 HEC CAA C 9.993 -3.849 0.223 1.00 . C A . 109 HEC CAA 1 1 4 7313 3 2 1 HEC CAB C 3.339 2.085 4.539 1.00 . C A . 109 HEC CAB 1 1 4 7314 3 2 1 HEC CAC C 10.615 5.122 6.257 1.00 . C A . 109 HEC CAC 1 1 4 7315 3 2 1 HEC CAD C 14.004 -0.929 2.313 1.00 . C A . 109 HEC CAD 1 1 4 7316 3 2 1 HEC CBA C 10.239 -3.594 -1.262 1.00 . C A . 109 HEC CBA 1 1 4 7317 3 2 1 HEC CBB C 2.320 1.176 5.221 1.00 . C A . 109 HEC CBB 1 1 4 7318 3 2 1 HEC CBC C 10.577 5.249 7.777 1.00 . C A . 109 HEC CBC 1 1 4 7319 3 2 1 HEC CBD C 15.212 -1.001 3.242 1.00 . C A . 109 HEC CBD 1 1 4 7320 3 2 1 HEC CGA C 11.031 -4.732 -1.889 1.00 . C A . 109 HEC CGA 1 1 4 7321 3 2 1 HEC CGD C 16.437 -0.367 2.598 1.00 . C A . 109 HEC CGD 1 1 4 7322 3 2 1 HEC CHA C 10.975 -1.501 1.967 1.00 . C A . 109 HEC CHA 1 1 4 7323 3 2 1 HEC CHB C 6.123 -1.094 1.856 1.00 . C A . 109 HEC CHB 1 1 4 7324 3 2 1 HEC CHC C 6.356 2.707 4.892 1.00 . C A . 109 HEC CHC 1 1 4 7325 3 2 1 HEC CHD C 11.271 2.624 4.540 1.00 . C A . 109 HEC CHD 1 1 4 7326 3 2 1 HEC CMA C 6.807 -3.589 0.145 1.00 . C A . 109 HEC CMA 1 1 4 7327 3 2 1 HEC CMB C 3.194 -0.411 2.545 1.00 . C A . 109 HEC CMB 1 1 4 7328 3 2 1 HEC CMC C 7.433 5.148 6.573 1.00 . C A . 109 HEC CMC 1 1 4 7329 3 2 1 HEC CMD C 14.190 1.780 4.002 1.00 . C A . 109 HEC CMD 1 1 4 7330 3 2 1 HEC FE FE 8.689 0.681 3.332 1.00 . C A . 109 HEC FE 1 1 4 7331 3 2 1 HEC HAA1 H 10.968 -3.879 0.710 1.00 . C A . 109 HEC HAA1 1 1 4 7332 3 2 1 HEC HAA2 H 9.515 -4.825 0.307 1.00 . C A . 109 HEC HAA2 1 1 4 7333 3 2 1 HEC HAB H 3.727 2.761 5.300 1.00 . C A . 109 HEC HAB 1 1 4 7334 3 2 1 HEC HAC H 11.624 4.811 5.986 1.00 . C A . 109 HEC HAC 1 1 4 7335 3 2 1 HEC HAD1 H 13.655 -1.951 2.159 1.00 . C A . 109 HEC HAD1 1 1 4 7336 3 2 1 HEC HAD2 H 14.351 -0.517 1.365 1.00 . C A . 109 HEC HAD2 1 1 4 7337 3 2 1 HEC HBA1 H 9.283 -3.508 -1.778 1.00 . C A . 109 HEC HBA1 1 1 4 7338 3 2 1 HEC HBA2 H 10.802 -2.669 -1.383 1.00 . C A . 109 HEC HBA2 1 1 4 7339 3 2 1 HEC HBB1 H 2.603 0.134 5.070 1.00 . C A . 109 HEC HBB1 1 1 4 7340 3 2 1 HEC HBB2 H 2.297 1.394 6.289 1.00 . C A . 109 HEC HBB2 1 1 4 7341 3 2 1 HEC HBB3 H 1.333 1.350 4.793 1.00 . C A . 109 HEC HBB3 1 1 4 7342 3 2 1 HEC HBC1 H 9.740 5.884 8.068 1.00 . C A . 109 HEC HBC1 1 1 4 7343 3 2 1 HEC HBC2 H 10.455 4.261 8.221 1.00 . C A . 109 HEC HBC2 1 1 4 7344 3 2 1 HEC HBC3 H 11.508 5.693 8.128 1.00 . C A . 109 HEC HBC3 1 1 4 7345 3 2 1 HEC HBD1 H 14.991 -0.470 4.168 1.00 . C A . 109 HEC HBD1 1 1 4 7346 3 2 1 HEC HBD2 H 15.436 -2.044 3.466 1.00 . C A . 109 HEC HBD2 1 1 4 7347 3 2 1 HEC HHA H 11.697 -2.239 1.618 1.00 . C A . 109 HEC HHA 1 1 4 7348 3 2 1 HEC HHB H 5.325 -1.599 1.312 1.00 . C A . 109 HEC HHB 1 1 4 7349 3 2 1 HEC HHC H 5.620 3.329 5.400 1.00 . C A . 109 HEC HHC 1 1 4 7350 3 2 1 HEC HHD H 12.079 3.290 4.842 1.00 . C A . 109 HEC HHD 1 1 4 7351 3 2 1 HEC HMA1 H 5.854 -3.069 0.046 1.00 . C A . 109 HEC HMA1 1 1 4 7352 3 2 1 HEC HMA2 H 7.190 -3.837 -0.845 1.00 . C A . 109 HEC HMA2 1 1 4 7353 3 2 1 HEC HMA3 H 6.663 -4.504 0.719 1.00 . C A . 109 HEC HMA3 1 1 4 7354 3 2 1 HEC HMB1 H 3.203 -1.445 2.890 1.00 . C A . 109 HEC HMB1 1 1 4 7355 3 2 1 HEC HMB2 H 2.302 0.090 2.921 1.00 . C A . 109 HEC HMB2 1 1 4 7356 3 2 1 HEC HMB3 H 3.189 -0.392 1.455 1.00 . C A . 109 HEC HMB3 1 1 4 7357 3 2 1 HEC HMC1 H 7.761 5.204 7.611 1.00 . C A . 109 HEC HMC1 1 1 4 7358 3 2 1 HEC HMC2 H 7.533 6.128 6.107 1.00 . C A . 109 HEC HMC2 1 1 4 7359 3 2 1 HEC HMC3 H 6.390 4.834 6.538 1.00 . C A . 109 HEC HMC3 1 1 4 7360 3 2 1 HEC HMD1 H 14.360 1.586 5.061 1.00 . C A . 109 HEC HMD1 1 1 4 7361 3 2 1 HEC HMD2 H 15.047 1.430 3.426 1.00 . C A . 109 HEC HMD2 1 1 4 7362 3 2 1 HEC HMD3 H 14.059 2.850 3.845 1.00 . C A . 109 HEC HMD3 1 1 4 7363 3 2 1 HEC NA N 8.578 -0.952 2.158 1.00 . C A . 109 HEC NA 1 1 4 7364 3 2 1 HEC NB N 6.664 0.796 3.345 1.00 . C A . 109 HEC NB 1 1 4 7365 3 2 1 HEC NC N 8.816 2.294 4.552 1.00 . C A . 109 HEC NC 1 1 4 7366 3 2 1 HEC ND N 10.699 0.587 3.271 1.00 . C A . 109 HEC ND 1 1 4 7367 3 2 1 HEC O1A O 11.897 -5.282 -1.175 1.00 . C A . 109 HEC O1A 1 1 4 7368 3 2 1 HEC O1D O 17.553 -0.812 2.942 1.00 . C A . 109 HEC O1D 1 1 4 7369 3 2 1 HEC O2A O 10.756 -5.031 -3.071 1.00 . C A . 109 HEC O2A 1 1 4 7370 3 2 1 HEC O2D O 16.234 0.550 1.774 1.00 . C A . 109 HEC O2D 1 1 4 7371 4 2 1 HEC C1A C -8.665 -3.333 0.460 1.00 . D A . 110 HEC C1A 1 1 4 7372 4 2 1 HEC C1B C -4.948 -1.150 0.152 1.00 . D A . 110 HEC C1B 1 1 4 7373 4 2 1 HEC C1C C -2.867 -4.433 2.072 1.00 . D A . 110 HEC C1C 1 1 4 7374 4 2 1 HEC C1D C -6.607 -6.560 2.467 1.00 . D A . 110 HEC C1D 1 1 4 7375 4 2 1 HEC C2A C -9.491 -2.358 -0.212 1.00 . D A . 110 HEC C2A 1 1 4 7376 4 2 1 HEC C2B C -3.786 -0.326 -0.080 1.00 . D A . 110 HEC C2B 1 1 4 7377 4 2 1 HEC C2C C -2.026 -5.458 2.643 1.00 . D A . 110 HEC C2C 1 1 4 7378 4 2 1 HEC C2D C -7.781 -7.340 2.781 1.00 . D A . 110 HEC C2D 1 1 4 7379 4 2 1 HEC C3A C -8.688 -1.332 -0.565 1.00 . D A . 110 HEC C3A 1 1 4 7380 4 2 1 HEC C3B C -2.736 -0.947 0.498 1.00 . D A . 110 HEC C3B 1 1 4 7381 4 2 1 HEC C3C C -2.831 -6.486 2.987 1.00 . D A . 110 HEC C3C 1 1 4 7382 4 2 1 HEC C3D C -8.843 -6.683 2.267 1.00 . D A . 110 HEC C3D 1 1 4 7383 4 2 1 HEC C4A C -7.356 -1.661 -0.115 1.00 . D A . 110 HEC C4A 1 1 4 7384 4 2 1 HEC C4B C -3.238 -2.164 1.093 1.00 . D A . 110 HEC C4B 1 1 4 7385 4 2 1 HEC C4C C -4.178 -6.107 2.632 1.00 . D A . 110 HEC C4C 1 1 4 7386 4 2 1 HEC C4D C -8.337 -5.491 1.630 1.00 . D A . 110 HEC C4D 1 1 4 7387 4 2 1 HEC CAA C -10.966 -2.502 -0.451 1.00 . D A . 110 HEC CAA 1 1 4 7388 4 2 1 HEC CAB C -1.304 -0.499 0.539 1.00 . D A . 110 HEC CAB 1 1 4 7389 4 2 1 HEC CAC C -2.444 -7.791 3.620 1.00 . D A . 110 HEC CAC 1 1 4 7390 4 2 1 HEC CAD C -10.290 -7.079 2.323 1.00 . D A . 110 HEC CAD 1 1 4 7391 4 2 1 HEC CBA C -11.796 -2.595 0.826 1.00 . D A . 110 HEC CBA 1 1 4 7392 4 2 1 HEC CBB C -1.121 0.952 0.975 1.00 . D A . 110 HEC CBB 1 1 4 7393 4 2 1 HEC CBC C -1.144 -7.734 4.417 1.00 . D A . 110 HEC CBC 1 1 4 7394 4 2 1 HEC CBD C -10.918 -7.327 0.955 1.00 . D A . 110 HEC CBD 1 1 4 7395 4 2 1 HEC CGA C -12.187 -1.211 1.326 1.00 . D A . 110 HEC CGA 1 1 4 7396 4 2 1 HEC CGD C -11.702 -8.632 0.940 1.00 . D A . 110 HEC CGD 1 1 4 7397 4 2 1 HEC CHA C -9.135 -4.536 0.974 1.00 . D A . 110 HEC CHA 1 1 4 7398 4 2 1 HEC CHB C -6.228 -0.840 -0.294 1.00 . D A . 110 HEC CHB 1 1 4 7399 4 2 1 HEC CHC C -2.449 -3.094 1.794 1.00 . D A . 110 HEC CHC 1 1 4 7400 4 2 1 HEC CHD C -5.312 -6.915 2.832 1.00 . D A . 110 HEC CHD 1 1 4 7401 4 2 1 HEC CMA C -9.064 -0.071 -1.288 1.00 . D A . 110 HEC CMA 1 1 4 7402 4 2 1 HEC CMB C -3.791 0.975 -0.829 1.00 . D A . 110 HEC CMB 1 1 4 7403 4 2 1 HEC CMC C -0.537 -5.357 2.805 1.00 . D A . 110 HEC CMC 1 1 4 7404 4 2 1 HEC CMD C -7.774 -8.635 3.540 1.00 . D A . 110 HEC CMD 1 1 4 7405 4 2 1 HEC FE FE -5.776 -3.860 1.305 1.00 . D A . 110 HEC FE 1 1 4 7406 4 2 1 HEC HAA1 H -11.329 -1.640 -1.010 1.00 . D A . 110 HEC HAA1 1 1 4 7407 4 2 1 HEC HAA2 H -11.154 -3.411 -1.024 1.00 . D A . 110 HEC HAA2 1 1 4 7408 4 2 1 HEC HAB H -0.749 -1.119 1.243 1.00 . D A . 110 HEC HAB 1 1 4 7409 4 2 1 HEC HAC H -3.228 -8.109 4.306 1.00 . D A . 110 HEC HAC 1 1 4 7410 4 2 1 HEC HAD1 H -10.392 -8.001 2.896 1.00 . D A . 110 HEC HAD1 1 1 4 7411 4 2 1 HEC HAD2 H -10.865 -6.287 2.803 1.00 . D A . 110 HEC HAD2 1 1 4 7412 4 2 1 HEC HBA1 H -12.705 -3.164 0.628 1.00 . D A . 110 HEC HBA1 1 1 4 7413 4 2 1 HEC HBA2 H -11.215 -3.094 1.601 1.00 . D A . 110 HEC HBA2 1 1 4 7414 4 2 1 HEC HBB1 H -0.256 1.026 1.636 1.00 . D A . 110 HEC HBB1 1 1 4 7415 4 2 1 HEC HBB2 H -0.962 1.578 0.098 1.00 . D A . 110 HEC HBB2 1 1 4 7416 4 2 1 HEC HBB3 H -2.012 1.288 1.505 1.00 . D A . 110 HEC HBB3 1 1 4 7417 4 2 1 HEC HBC1 H -0.310 -7.551 3.739 1.00 . D A . 110 HEC HBC1 1 1 4 7418 4 2 1 HEC HBC2 H -1.201 -6.927 5.147 1.00 . D A . 110 HEC HBC2 1 1 4 7419 4 2 1 HEC HBC3 H -0.992 -8.681 4.933 1.00 . D A . 110 HEC HBC3 1 1 4 7420 4 2 1 HEC HBD1 H -11.598 -6.509 0.714 1.00 . D A . 110 HEC HBD1 1 1 4 7421 4 2 1 HEC HBD2 H -10.135 -7.382 0.199 1.00 . D A . 110 HEC HBD2 1 1 4 7422 4 2 1 HEC HHA H -10.196 -4.760 0.863 1.00 . D A . 110 HEC HHA 1 1 4 7423 4 2 1 HEC HHB H -6.372 0.104 -0.820 1.00 . D A . 110 HEC HHB 1 1 4 7424 4 2 1 HEC HHC H -1.456 -2.773 2.110 1.00 . D A . 110 HEC HHC 1 1 4 7425 4 2 1 HEC HHD H -5.162 -7.884 3.307 1.00 . D A . 110 HEC HHD 1 1 4 7426 4 2 1 HEC HMA1 H -10.029 0.282 -0.924 1.00 . D A . 110 HEC HMA1 1 1 4 7427 4 2 1 HEC HMA2 H -8.306 0.691 -1.106 1.00 . D A . 110 HEC HMA2 1 1 4 7428 4 2 1 HEC HMA3 H -9.130 -0.271 -2.357 1.00 . D A . 110 HEC HMA3 1 1 4 7429 4 2 1 HEC HMB1 H -3.816 0.776 -1.901 1.00 . D A . 110 HEC HMB1 1 1 4 7430 4 2 1 HEC HMB2 H -4.670 1.554 -0.546 1.00 . D A . 110 HEC HMB2 1 1 4 7431 4 2 1 HEC HMB3 H -2.891 1.538 -0.585 1.00 . D A . 110 HEC HMB3 1 1 4 7432 4 2 1 HEC HMC1 H -0.276 -5.478 3.856 1.00 . D A . 110 HEC HMC1 1 1 4 7433 4 2 1 HEC HMC2 H -0.053 -6.137 2.218 1.00 . D A . 110 HEC HMC2 1 1 4 7434 4 2 1 HEC HMC3 H -0.200 -4.380 2.458 1.00 . D A . 110 HEC HMC3 1 1 4 7435 4 2 1 HEC HMD1 H -6.767 -9.050 3.541 1.00 . D A . 110 HEC HMD1 1 1 4 7436 4 2 1 HEC HMD2 H -8.094 -8.456 4.567 1.00 . D A . 110 HEC HMD2 1 1 4 7437 4 2 1 HEC HMD3 H -8.457 -9.339 3.064 1.00 . D A . 110 HEC HMD3 1 1 4 7438 4 2 1 HEC NA N -7.353 -2.894 0.515 1.00 . D A . 110 HEC NA 1 1 4 7439 4 2 1 HEC NB N -4.600 -2.278 0.875 1.00 . D A . 110 HEC NB 1 1 4 7440 4 2 1 HEC NC N -4.189 -4.843 2.070 1.00 . D A . 110 HEC NC 1 1 4 7441 4 2 1 HEC ND N -6.960 -5.425 1.759 1.00 . D A . 110 HEC ND 1 1 4 7442 4 2 1 HEC O1A O -13.395 -0.900 1.246 1.00 . D A . 110 HEC O1A 1 1 4 7443 4 2 1 HEC O1D O -12.915 -8.562 0.646 1.00 . D A . 110 HEC O1D 1 1 4 7444 4 2 1 HEC O2A O -11.271 -0.492 1.779 1.00 . D A . 110 HEC O2A 1 1 4 7445 4 2 1 HEC O2D O -11.074 -9.674 1.224 1.00 . D A . 110 HEC O2D 1 1 4 7446 5 2 1 HEC C1A C -0.120 4.096 -9.182 1.00 . E A . 111 HEC C1A 1 1 4 7447 5 2 1 HEC C1B C -1.453 0.659 -11.438 1.00 . E A . 111 HEC C1B 1 1 4 7448 5 2 1 HEC C1C C -3.268 -0.982 -7.830 1.00 . E A . 111 HEC C1C 1 1 4 7449 5 2 1 HEC C1D C -1.883 2.448 -5.597 1.00 . E A . 111 HEC C1D 1 1 4 7450 5 2 1 HEC C2A C 0.479 4.803 -10.290 1.00 . E A . 111 HEC C2A 1 1 4 7451 5 2 1 HEC C2B C -1.614 -0.501 -12.283 1.00 . E A . 111 HEC C2B 1 1 4 7452 5 2 1 HEC C2C C -3.961 -1.627 -6.740 1.00 . E A . 111 HEC C2C 1 1 4 7453 5 2 1 HEC C2D C -1.343 3.423 -4.679 1.00 . E A . 111 HEC C2D 1 1 4 7454 5 2 1 HEC C3A C 0.273 4.057 -11.395 1.00 . E A . 111 HEC C3A 1 1 4 7455 5 2 1 HEC C3B C -2.220 -1.451 -11.540 1.00 . E A . 111 HEC C3B 1 1 4 7456 5 2 1 HEC C3C C -3.821 -0.835 -5.656 1.00 . E A . 111 HEC C3C 1 1 4 7457 5 2 1 HEC C3D C -0.632 4.306 -5.411 1.00 . E A . 111 HEC C3D 1 1 4 7458 5 2 1 HEC C4A C -0.456 2.881 -10.983 1.00 . E A . 111 HEC C4A 1 1 4 7459 5 2 1 HEC C4B C -2.440 -0.889 -10.228 1.00 . E A . 111 HEC C4B 1 1 4 7460 5 2 1 HEC C4C C -3.041 0.309 -6.065 1.00 . E A . 111 HEC C4C 1 1 4 7461 5 2 1 HEC C4D C -0.724 3.887 -6.790 1.00 . E A . 111 HEC C4D 1 1 4 7462 5 2 1 HEC CAA C 1.190 6.121 -10.184 1.00 . E A . 111 HEC CAA 1 1 4 7463 5 2 1 HEC CAB C -2.610 -2.840 -11.955 1.00 . E A . 111 HEC CAB 1 1 4 7464 5 2 1 HEC CAC C -4.357 -1.059 -4.272 1.00 . E A . 111 HEC CAC 1 1 4 7465 5 2 1 HEC CAD C 0.126 5.508 -4.928 1.00 . E A . 111 HEC CAD 1 1 4 7466 5 2 1 HEC CBA C 2.601 6.114 -10.766 1.00 . E A . 111 HEC CBA 1 1 4 7467 5 2 1 HEC CBB C -1.533 -3.890 -11.696 1.00 . E A . 111 HEC CBB 1 1 4 7468 5 2 1 HEC CBC C -4.192 -2.489 -3.767 1.00 . E A . 111 HEC CBC 1 1 4 7469 5 2 1 HEC CBD C -0.749 6.733 -4.675 1.00 . E A . 111 HEC CBD 1 1 4 7470 5 2 1 HEC CGA C 2.905 7.423 -11.481 1.00 . E A . 111 HEC CGA 1 1 4 7471 5 2 1 HEC CGD C 0.092 7.930 -4.255 1.00 . E A . 111 HEC CGD 1 1 4 7472 5 2 1 HEC CHA C -0.113 4.552 -7.868 1.00 . E A . 111 HEC CHA 1 1 4 7473 5 2 1 HEC CHB C -0.865 1.851 -11.850 1.00 . E A . 111 HEC CHB 1 1 4 7474 5 2 1 HEC CHC C -3.051 -1.571 -9.160 1.00 . E A . 111 HEC CHC 1 1 4 7475 5 2 1 HEC CHD C -2.677 1.371 -5.217 1.00 . E A . 111 HEC CHD 1 1 4 7476 5 2 1 HEC CMA C 0.700 4.353 -12.803 1.00 . E A . 111 HEC CMA 1 1 4 7477 5 2 1 HEC CMB C -1.174 -0.588 -13.715 1.00 . E A . 111 HEC CMB 1 1 4 7478 5 2 1 HEC CMC C -4.688 -2.937 -6.839 1.00 . E A . 111 HEC CMC 1 1 4 7479 5 2 1 HEC CMD C -1.559 3.415 -3.194 1.00 . E A . 111 HEC CMD 1 1 4 7480 5 2 1 HEC FE FE -1.714 1.569 -8.524 1.00 . E A . 111 HEC FE 1 1 4 7481 5 2 1 HEC HAA1 H 0.625 6.883 -10.720 1.00 . E A . 111 HEC HAA1 1 1 4 7482 5 2 1 HEC HAA2 H 1.277 6.404 -9.135 1.00 . E A . 111 HEC HAA2 1 1 4 7483 5 2 1 HEC HAB H -3.498 -3.148 -11.405 1.00 . E A . 111 HEC HAB 1 1 4 7484 5 2 1 HEC HAC H -3.835 -0.408 -3.571 1.00 . E A . 111 HEC HAC 1 1 4 7485 5 2 1 HEC HAD1 H 0.624 5.270 -3.988 1.00 . E A . 111 HEC HAD1 1 1 4 7486 5 2 1 HEC HAD2 H 0.870 5.792 -5.672 1.00 . E A . 111 HEC HAD2 1 1 4 7487 5 2 1 HEC HBA1 H 3.325 5.978 -9.963 1.00 . E A . 111 HEC HBA1 1 1 4 7488 5 2 1 HEC HBA2 H 2.694 5.297 -11.481 1.00 . E A . 111 HEC HBA2 1 1 4 7489 5 2 1 HEC HBB1 H -1.013 -4.115 -12.627 1.00 . E A . 111 HEC HBB1 1 1 4 7490 5 2 1 HEC HBB2 H -0.821 -3.508 -10.965 1.00 . E A . 111 HEC HBB2 1 1 4 7491 5 2 1 HEC HBB3 H -1.997 -4.798 -11.311 1.00 . E A . 111 HEC HBB3 1 1 4 7492 5 2 1 HEC HBC1 H -3.315 -2.939 -4.231 1.00 . E A . 111 HEC HBC1 1 1 4 7493 5 2 1 HEC HBC2 H -4.067 -2.480 -2.684 1.00 . E A . 111 HEC HBC2 1 1 4 7494 5 2 1 HEC HBC3 H -5.078 -3.070 -4.025 1.00 . E A . 111 HEC HBC3 1 1 4 7495 5 2 1 HEC HBD1 H -1.287 6.989 -5.588 1.00 . E A . 111 HEC HBD1 1 1 4 7496 5 2 1 HEC HBD2 H -1.463 6.513 -3.882 1.00 . E A . 111 HEC HBD2 1 1 4 7497 5 2 1 HEC HHA H 0.400 5.490 -7.655 1.00 . E A . 111 HEC HHA 1 1 4 7498 5 2 1 HEC HHB H -0.708 2.001 -12.918 1.00 . E A . 111 HEC HHB 1 1 4 7499 5 2 1 HEC HHC H -3.392 -2.589 -9.344 1.00 . E A . 111 HEC HHC 1 1 4 7500 5 2 1 HEC HHD H -3.045 1.344 -4.192 1.00 . E A . 111 HEC HHD 1 1 4 7501 5 2 1 HEC HMA1 H 1.595 3.777 -13.040 1.00 . E A . 111 HEC HMA1 1 1 4 7502 5 2 1 HEC HMA2 H -0.100 4.080 -13.491 1.00 . E A . 111 HEC HMA2 1 1 4 7503 5 2 1 HEC HMA3 H 0.917 5.417 -12.901 1.00 . E A . 111 HEC HMA3 1 1 4 7504 5 2 1 HEC HMB1 H -0.841 0.393 -14.053 1.00 . E A . 111 HEC HMB1 1 1 4 7505 5 2 1 HEC HMB2 H -0.353 -1.300 -13.800 1.00 . E A . 111 HEC HMB2 1 1 4 7506 5 2 1 HEC HMB3 H -2.009 -0.921 -14.332 1.00 . E A . 111 HEC HMB3 1 1 4 7507 5 2 1 HEC HMC1 H -4.580 -3.337 -7.847 1.00 . E A . 111 HEC HMC1 1 1 4 7508 5 2 1 HEC HMC2 H -4.267 -3.641 -6.122 1.00 . E A . 111 HEC HMC2 1 1 4 7509 5 2 1 HEC HMC3 H -5.745 -2.783 -6.621 1.00 . E A . 111 HEC HMC3 1 1 4 7510 5 2 1 HEC HMD1 H -2.594 3.148 -2.979 1.00 . E A . 111 HEC HMD1 1 1 4 7511 5 2 1 HEC HMD2 H -0.893 2.686 -2.733 1.00 . E A . 111 HEC HMD2 1 1 4 7512 5 2 1 HEC HMD3 H -1.349 4.406 -2.791 1.00 . E A . 111 HEC HMD3 1 1 4 7513 5 2 1 HEC NA N -0.693 2.915 -9.620 1.00 . E A . 111 HEC NA 1 1 4 7514 5 2 1 HEC NB N -1.964 0.410 -10.177 1.00 . E A . 111 HEC NB 1 1 4 7515 5 2 1 HEC NC N -2.706 0.208 -7.405 1.00 . E A . 111 HEC NC 1 1 4 7516 5 2 1 HEC ND N -1.495 2.743 -6.893 1.00 . E A . 111 HEC ND 1 1 4 7517 5 2 1 HEC O1A O 2.509 7.530 -12.661 1.00 . E A . 111 HEC O1A 1 1 4 7518 5 2 1 HEC O1D O 0.010 8.289 -3.060 1.00 . E A . 111 HEC O1D 1 1 4 7519 5 2 1 HEC O2A O 3.528 8.292 -10.833 1.00 . E A . 111 HEC O2A 1 1 4 7520 5 2 1 HEC O2D O 0.801 8.463 -5.135 1.00 . E A . 111 HEC O2D 1 1 5 7521 1 1 1 ALA C C -1.322 4.172 20.991 1.00 . A A . 1 ALA C 1 1 5 7522 1 1 1 ALA CA C -0.295 3.314 21.732 1.00 . A A . 1 ALA CA 1 1 5 7523 1 1 1 ALA CB C 0.088 2.057 20.948 1.00 . A A . 1 ALA CB 1 1 5 7524 1 1 1 ALA H1 H -0.243 3.308 23.762 1.00 . A A . 1 ALA H1 1 1 5 7525 1 1 1 ALA H2 H -1.772 3.302 23.126 1.00 . A A . 1 ALA H2 1 1 5 7526 1 1 1 ALA HA H 0.603 3.906 21.907 1.00 . A A . 1 ALA HA 1 1 5 7527 1 1 1 ALA HB1 H -0.439 1.197 21.360 1.00 . A A . 1 ALA HB1 1 1 5 7528 1 1 1 ALA HB2 H -0.186 2.184 19.901 1.00 . A A . 1 ALA HB2 1 1 5 7529 1 1 1 ALA HB3 H 1.163 1.895 21.025 1.00 . A A . 1 ALA HB3 1 1 5 7530 1 1 1 ALA N N -0.833 2.932 23.027 1.00 . A A . 1 ALA N 1 1 5 7531 1 1 1 ALA O O -2.475 4.266 21.409 1.00 . A A . 1 ALA O 1 1 5 7532 1 1 2 PRO C C -2.689 4.803 18.240 1.00 . A A . 2 PRO C 1 1 5 7533 1 1 2 PRO CA C -1.718 5.642 19.073 1.00 . A A . 2 PRO CA 1 1 5 7534 1 1 2 PRO CB C -0.773 6.475 18.223 1.00 . A A . 2 PRO CB 1 1 5 7535 1 1 2 PRO CD C 0.506 4.706 19.352 1.00 . A A . 2 PRO CD 1 1 5 7536 1 1 2 PRO CG C 0.559 5.743 18.241 1.00 . A A . 2 PRO CG 1 1 5 7537 1 1 2 PRO HA H -2.288 6.214 19.663 1.00 . A A . 2 PRO HA 1 1 5 7538 1 1 2 PRO HB2 H -1.149 6.576 17.205 1.00 . A A . 2 PRO HB2 1 1 5 7539 1 1 2 PRO HB3 H -0.670 7.483 18.626 1.00 . A A . 2 PRO HB3 1 1 5 7540 1 1 2 PRO HD2 H 0.720 3.707 18.972 1.00 . A A . 2 PRO HD2 1 1 5 7541 1 1 2 PRO HD3 H 1.243 4.918 20.126 1.00 . A A . 2 PRO HD3 1 1 5 7542 1 1 2 PRO HG2 H 0.744 5.263 17.280 1.00 . A A . 2 PRO HG2 1 1 5 7543 1 1 2 PRO HG3 H 1.377 6.443 18.410 1.00 . A A . 2 PRO HG3 1 1 5 7544 1 1 2 PRO N N -0.854 4.794 19.876 1.00 . A A . 2 PRO N 1 1 5 7545 1 1 2 PRO O O -2.286 3.828 17.606 1.00 . A A . 2 PRO O 1 1 5 7546 1 1 3 LYS C C -4.842 4.837 16.035 1.00 . A A . 3 LYS C 1 1 5 7547 1 1 3 LYS CA C -4.980 4.509 17.523 1.00 . A A . 3 LYS CA 1 1 5 7548 1 1 3 LYS CB C -6.363 4.824 18.096 1.00 . A A . 3 LYS CB 1 1 5 7549 1 1 3 LYS CD C -7.759 2.775 17.636 1.00 . A A . 3 LYS CD 1 1 5 7550 1 1 3 LYS CE C -8.615 1.680 18.277 1.00 . A A . 3 LYS CE 1 1 5 7551 1 1 3 LYS CG C -7.004 3.573 18.701 1.00 . A A . 3 LYS CG 1 1 5 7552 1 1 3 LYS H H -4.268 6.005 18.785 1.00 . A A . 3 LYS H 1 1 5 7553 1 1 3 LYS HA H -4.811 3.441 17.658 1.00 . A A . 3 LYS HA 1 1 5 7554 1 1 3 LYS HB2 H -6.278 5.598 18.859 1.00 . A A . 3 LYS HB2 1 1 5 7555 1 1 3 LYS HB3 H -7.005 5.222 17.310 1.00 . A A . 3 LYS HB3 1 1 5 7556 1 1 3 LYS HD2 H -8.394 3.445 17.056 1.00 . A A . 3 LYS HD2 1 1 5 7557 1 1 3 LYS HD3 H -7.050 2.326 16.941 1.00 . A A . 3 LYS HD3 1 1 5 7558 1 1 3 LYS HE2 H -8.182 0.702 18.066 1.00 . A A . 3 LYS HE2 1 1 5 7559 1 1 3 LYS HE3 H -8.619 1.800 19.360 1.00 . A A . 3 LYS HE3 1 1 5 7560 1 1 3 LYS HG2 H -6.234 2.947 19.152 1.00 . A A . 3 LYS HG2 1 1 5 7561 1 1 3 LYS HG3 H -7.688 3.860 19.499 1.00 . A A . 3 LYS HG3 1 1 5 7562 1 1 3 LYS HZ1 H -10.610 2.277 18.366 1.00 . A A . 3 LYS HZ1 1 1 5 7563 1 1 3 LYS HZ2 H -10.047 2.164 16.842 1.00 . A A . 3 LYS HZ2 1 1 5 7564 1 1 3 LYS N N -3.949 5.211 18.267 1.00 . A A . 3 LYS N 1 1 5 7565 1 1 3 LYS NZ N -10.001 1.737 17.760 1.00 . A A . 3 LYS NZ 1 1 5 7566 1 1 3 LYS O O -4.134 5.773 15.665 1.00 . A A . 3 LYS O 1 1 5 7567 1 1 4 ALA C C -6.123 5.595 13.438 1.00 . A A . 4 ALA C 1 1 5 7568 1 1 4 ALA CA C -5.492 4.244 13.782 1.00 . A A . 4 ALA CA 1 1 5 7569 1 1 4 ALA CB C -6.200 3.078 13.090 1.00 . A A . 4 ALA CB 1 1 5 7570 1 1 4 ALA H H -6.103 3.291 15.531 1.00 . A A . 4 ALA H 1 1 5 7571 1 1 4 ALA HA H -4.446 4.252 13.475 1.00 . A A . 4 ALA HA 1 1 5 7572 1 1 4 ALA HB1 H -5.702 2.144 13.352 1.00 . A A . 4 ALA HB1 1 1 5 7573 1 1 4 ALA HB2 H -7.240 3.039 13.416 1.00 . A A . 4 ALA HB2 1 1 5 7574 1 1 4 ALA HB3 H -6.163 3.219 12.010 1.00 . A A . 4 ALA HB3 1 1 5 7575 1 1 4 ALA N N -5.530 4.049 15.222 1.00 . A A . 4 ALA N 1 1 5 7576 1 1 4 ALA O O -6.957 6.103 14.186 1.00 . A A . 4 ALA O 1 1 5 7577 1 1 5 PRO C C -7.618 7.293 11.266 1.00 . A A . 5 PRO C 1 1 5 7578 1 1 5 PRO CA C -6.200 7.436 11.825 1.00 . A A . 5 PRO CA 1 1 5 7579 1 1 5 PRO CB C -5.199 7.916 10.787 1.00 . A A . 5 PRO CB 1 1 5 7580 1 1 5 PRO CD C -4.701 5.580 11.366 1.00 . A A . 5 PRO CD 1 1 5 7581 1 1 5 PRO CG C -4.418 6.684 10.360 1.00 . A A . 5 PRO CG 1 1 5 7582 1 1 5 PRO HA H -6.272 8.071 12.593 1.00 . A A . 5 PRO HA 1 1 5 7583 1 1 5 PRO HB2 H -5.706 8.372 9.936 1.00 . A A . 5 PRO HB2 1 1 5 7584 1 1 5 PRO HB3 H -4.535 8.673 11.206 1.00 . A A . 5 PRO HB3 1 1 5 7585 1 1 5 PRO HD2 H -5.086 4.686 10.876 1.00 . A A . 5 PRO HD2 1 1 5 7586 1 1 5 PRO HD3 H -3.795 5.287 11.898 1.00 . A A . 5 PRO HD3 1 1 5 7587 1 1 5 PRO HG2 H -4.714 6.372 9.358 1.00 . A A . 5 PRO HG2 1 1 5 7588 1 1 5 PRO HG3 H -3.351 6.902 10.322 1.00 . A A . 5 PRO HG3 1 1 5 7589 1 1 5 PRO N N -5.688 6.153 12.277 1.00 . A A . 5 PRO N 1 1 5 7590 1 1 5 PRO O O -8.071 6.184 10.988 1.00 . A A . 5 PRO O 1 1 5 7591 1 1 6 ALA C C -9.669 7.726 9.251 1.00 . A A . 6 ALA C 1 1 5 7592 1 1 6 ALA CA C -9.635 8.449 10.599 1.00 . A A . 6 ALA CA 1 1 5 7593 1 1 6 ALA CB C -10.126 9.895 10.497 1.00 . A A . 6 ALA CB 1 1 5 7594 1 1 6 ALA H H -7.902 9.330 11.347 1.00 . A A . 6 ALA H 1 1 5 7595 1 1 6 ALA HA H -10.268 7.912 11.306 1.00 . A A . 6 ALA HA 1 1 5 7596 1 1 6 ALA HB1 H -9.715 10.476 11.323 1.00 . A A . 6 ALA HB1 1 1 5 7597 1 1 6 ALA HB2 H -9.797 10.324 9.551 1.00 . A A . 6 ALA HB2 1 1 5 7598 1 1 6 ALA HB3 H -11.214 9.913 10.546 1.00 . A A . 6 ALA HB3 1 1 5 7599 1 1 6 ALA N N -8.278 8.432 11.119 1.00 . A A . 6 ALA N 1 1 5 7600 1 1 6 ALA O O -8.652 7.205 8.796 1.00 . A A . 6 ALA O 1 1 5 7601 1 1 7 ASP C C -10.934 8.109 6.251 1.00 . A A . 7 ASP C 1 1 5 7602 1 1 7 ASP CA C -11.030 7.064 7.365 1.00 . A A . 7 ASP CA 1 1 5 7603 1 1 7 ASP CB C -12.405 6.399 7.271 1.00 . A A . 7 ASP CB 1 1 5 7604 1 1 7 ASP CG C -13.548 7.185 7.917 1.00 . A A . 7 ASP CG 1 1 5 7605 1 1 7 ASP H H -11.673 8.141 9.028 1.00 . A A . 7 ASP H 1 1 5 7606 1 1 7 ASP HA H -10.237 6.319 7.307 1.00 . A A . 7 ASP HA 1 1 5 7607 1 1 7 ASP HB2 H -12.644 6.238 6.220 1.00 . A A . 7 ASP HB2 1 1 5 7608 1 1 7 ASP HB3 H -12.349 5.417 7.740 1.00 . A A . 7 ASP HB3 1 1 5 7609 1 1 7 ASP N N -10.850 7.715 8.651 1.00 . A A . 7 ASP N 1 1 5 7610 1 1 7 ASP O O -10.923 9.309 6.520 1.00 . A A . 7 ASP O 1 1 5 7611 1 1 7 ASP OD1 O -13.922 8.226 7.334 1.00 . A A . 7 ASP OD1 1 1 5 7612 1 1 7 ASP OD2 O -14.023 6.727 8.979 1.00 . A A . 7 ASP OD2 1 1 5 7613 1 1 8 GLY C C -9.330 8.963 3.657 1.00 . A A . 8 GLY C 1 1 5 7614 1 1 8 GLY CA C -10.769 8.490 3.868 1.00 . A A . 8 GLY CA 1 1 5 7615 1 1 8 GLY H H -10.874 6.636 4.813 1.00 . A A . 8 GLY H 1 1 5 7616 1 1 8 GLY HA2 H -11.117 7.964 2.979 1.00 . A A . 8 GLY HA2 1 1 5 7617 1 1 8 GLY HA3 H -11.423 9.351 4.005 1.00 . A A . 8 GLY HA3 1 1 5 7618 1 1 8 GLY N N -10.865 7.614 5.024 1.00 . A A . 8 GLY N 1 1 5 7619 1 1 8 GLY O O -9.096 9.985 3.013 1.00 . A A . 8 GLY O 1 1 5 7620 1 1 9 LEU C C -6.511 8.190 2.678 1.00 . A A . 9 LEU C 1 1 5 7621 1 1 9 LEU CA C -6.991 8.525 4.091 1.00 . A A . 9 LEU CA 1 1 5 7622 1 1 9 LEU CB C -6.185 7.835 5.194 1.00 . A A . 9 LEU CB 1 1 5 7623 1 1 9 LEU CD1 C -4.253 6.419 4.407 1.00 . A A . 9 LEU CD1 1 1 5 7624 1 1 9 LEU CD2 C -4.193 8.937 4.109 1.00 . A A . 9 LEU CD2 1 1 5 7625 1 1 9 LEU CG C -4.671 7.774 4.980 1.00 . A A . 9 LEU CG 1 1 5 7626 1 1 9 LEU H H -8.599 7.367 4.732 1.00 . A A . 9 LEU H 1 1 5 7627 1 1 9 LEU HA H -6.892 9.600 4.244 1.00 . A A . 9 LEU HA 1 1 5 7628 1 1 9 LEU HB2 H -6.378 8.351 6.135 1.00 . A A . 9 LEU HB2 1 1 5 7629 1 1 9 LEU HB3 H -6.558 6.817 5.306 1.00 . A A . 9 LEU HB3 1 1 5 7630 1 1 9 LEU HD11 H -4.880 5.635 4.832 1.00 . A A . 9 LEU HD11 1 1 5 7631 1 1 9 LEU HD12 H -4.371 6.430 3.323 1.00 . A A . 9 LEU HD12 1 1 5 7632 1 1 9 LEU HD13 H -3.210 6.225 4.656 1.00 . A A . 9 LEU HD13 1 1 5 7633 1 1 9 LEU HD21 H -4.876 9.780 4.221 1.00 . A A . 9 LEU HD21 1 1 5 7634 1 1 9 LEU HD22 H -3.192 9.236 4.419 1.00 . A A . 9 LEU HD22 1 1 5 7635 1 1 9 LEU HD23 H -4.171 8.624 3.065 1.00 . A A . 9 LEU HD23 1 1 5 7636 1 1 9 LEU HG H -4.185 7.877 5.950 1.00 . A A . 9 LEU HG 1 1 5 7637 1 1 9 LEU N N -8.401 8.197 4.211 1.00 . A A . 9 LEU N 1 1 5 7638 1 1 9 LEU O O -6.269 7.026 2.360 1.00 . A A . 9 LEU O 1 1 5 7639 1 1 10 LYS C C -4.560 9.692 0.330 1.00 . A A . 10 LYS C 1 1 5 7640 1 1 10 LYS CA C -5.944 9.060 0.494 1.00 . A A . 10 LYS CA 1 1 5 7641 1 1 10 LYS CB C -6.989 9.608 -0.480 1.00 . A A . 10 LYS CB 1 1 5 7642 1 1 10 LYS CD C -7.750 11.777 -1.516 1.00 . A A . 10 LYS CD 1 1 5 7643 1 1 10 LYS CE C -8.096 11.487 -2.978 1.00 . A A . 10 LYS CE 1 1 5 7644 1 1 10 LYS CG C -6.545 10.951 -1.062 1.00 . A A . 10 LYS CG 1 1 5 7645 1 1 10 LYS H H -6.588 10.173 2.133 1.00 . A A . 10 LYS H 1 1 5 7646 1 1 10 LYS HA H -5.859 7.990 0.308 1.00 . A A . 10 LYS HA 1 1 5 7647 1 1 10 LYS HB2 H -7.149 8.893 -1.287 1.00 . A A . 10 LYS HB2 1 1 5 7648 1 1 10 LYS HB3 H -7.943 9.727 0.033 1.00 . A A . 10 LYS HB3 1 1 5 7649 1 1 10 LYS HD2 H -8.609 11.551 -0.883 1.00 . A A . 10 LYS HD2 1 1 5 7650 1 1 10 LYS HD3 H -7.535 12.839 -1.393 1.00 . A A . 10 LYS HD3 1 1 5 7651 1 1 10 LYS HE2 H -8.537 12.372 -3.436 1.00 . A A . 10 LYS HE2 1 1 5 7652 1 1 10 LYS HE3 H -7.187 11.259 -3.534 1.00 . A A . 10 LYS HE3 1 1 5 7653 1 1 10 LYS HG2 H -5.979 11.507 -0.314 1.00 . A A . 10 LYS HG2 1 1 5 7654 1 1 10 LYS HG3 H -5.877 10.783 -1.907 1.00 . A A . 10 LYS HG3 1 1 5 7655 1 1 10 LYS HZ1 H -9.858 10.487 -2.489 1.00 . A A . 10 LYS HZ1 1 1 5 7656 1 1 10 LYS HZ2 H -9.372 10.210 -4.018 1.00 . A A . 10 LYS HZ2 1 1 5 7657 1 1 10 LYS N N -6.389 9.230 1.866 1.00 . A A . 10 LYS N 1 1 5 7658 1 1 10 LYS NZ N -9.039 10.350 -3.071 1.00 . A A . 10 LYS NZ 1 1 5 7659 1 1 10 LYS O O -4.240 10.677 0.993 1.00 . A A . 10 LYS O 1 1 5 7660 1 1 11 MET C C -2.264 9.973 -2.289 1.00 . A A . 11 MET C 1 1 5 7661 1 1 11 MET CA C -2.433 9.590 -0.817 1.00 . A A . 11 MET CA 1 1 5 7662 1 1 11 MET CB C -1.413 8.510 -0.450 1.00 . A A . 11 MET CB 1 1 5 7663 1 1 11 MET CE C -0.738 4.943 0.047 1.00 . A A . 11 MET CE 1 1 5 7664 1 1 11 MET CG C -1.738 7.189 -1.151 1.00 . A A . 11 MET CG 1 1 5 7665 1 1 11 MET H H -4.043 8.298 -1.094 1.00 . A A . 11 MET H 1 1 5 7666 1 1 11 MET HA H -2.318 10.474 -0.189 1.00 . A A . 11 MET HA 1 1 5 7667 1 1 11 MET HB2 H -0.413 8.839 -0.731 1.00 . A A . 11 MET HB2 1 1 5 7668 1 1 11 MET HB3 H -1.408 8.362 0.630 1.00 . A A . 11 MET HB3 1 1 5 7669 1 1 11 MET HE1 H 0.119 5.546 -0.252 1.00 . A A . 11 MET HE1 1 1 5 7670 1 1 11 MET HE2 H -0.569 4.542 1.046 1.00 . A A . 11 MET HE2 1 1 5 7671 1 1 11 MET HE3 H -0.868 4.122 -0.658 1.00 . A A . 11 MET HE3 1 1 5 7672 1 1 11 MET HG2 H -2.547 7.337 -1.866 1.00 . A A . 11 MET HG2 1 1 5 7673 1 1 11 MET HG3 H -0.872 6.845 -1.716 1.00 . A A . 11 MET HG3 1 1 5 7674 1 1 11 MET N N -3.775 9.099 -0.558 1.00 . A A . 11 MET N 1 1 5 7675 1 1 11 MET O O -2.323 9.115 -3.168 1.00 . A A . 11 MET O 1 1 5 7676 1 1 11 MET SD S -2.206 5.958 0.054 1.00 . A A . 11 MET SD 1 1 5 7677 1 1 12 GLU C C -0.431 12.214 -4.076 1.00 . A A . 12 GLU C 1 1 5 7678 1 1 12 GLU CA C -1.880 11.770 -3.862 1.00 . A A . 12 GLU CA 1 1 5 7679 1 1 12 GLU CB C -2.852 12.915 -4.149 1.00 . A A . 12 GLU CB 1 1 5 7680 1 1 12 GLU CD C -1.816 14.197 -6.058 1.00 . A A . 12 GLU CD 1 1 5 7681 1 1 12 GLU CG C -2.917 13.216 -5.648 1.00 . A A . 12 GLU CG 1 1 5 7682 1 1 12 GLU H H -2.010 11.955 -1.791 1.00 . A A . 12 GLU H 1 1 5 7683 1 1 12 GLU HA H -2.111 10.932 -4.519 1.00 . A A . 12 GLU HA 1 1 5 7684 1 1 12 GLU HB2 H -3.846 12.654 -3.784 1.00 . A A . 12 GLU HB2 1 1 5 7685 1 1 12 GLU HB3 H -2.539 13.808 -3.609 1.00 . A A . 12 GLU HB3 1 1 5 7686 1 1 12 GLU HG2 H -2.813 12.290 -6.214 1.00 . A A . 12 GLU HG2 1 1 5 7687 1 1 12 GLU HG3 H -3.892 13.634 -5.897 1.00 . A A . 12 GLU HG3 1 1 5 7688 1 1 12 GLU N N -2.057 11.263 -2.512 1.00 . A A . 12 GLU N 1 1 5 7689 1 1 12 GLU O O -0.158 13.404 -4.224 1.00 . A A . 12 GLU O 1 1 5 7690 1 1 12 GLU OE1 O -1.778 15.291 -5.455 1.00 . A A . 12 GLU OE1 1 1 5 7691 1 1 12 GLU OE2 O -1.038 13.830 -6.965 1.00 . A A . 12 GLU OE2 1 1 5 7692 1 1 13 ALA C C 2.239 11.269 -5.745 1.00 . A A . 13 ALA C 1 1 5 7693 1 1 13 ALA CA C 1.873 11.508 -4.279 1.00 . A A . 13 ALA CA 1 1 5 7694 1 1 13 ALA CB C 2.697 10.642 -3.324 1.00 . A A . 13 ALA CB 1 1 5 7695 1 1 13 ALA H H 0.229 10.267 -3.965 1.00 . A A . 13 ALA H 1 1 5 7696 1 1 13 ALA HA H 2.043 12.557 -4.037 1.00 . A A . 13 ALA HA 1 1 5 7697 1 1 13 ALA HB1 H 2.063 10.299 -2.506 1.00 . A A . 13 ALA HB1 1 1 5 7698 1 1 13 ALA HB2 H 3.092 9.781 -3.863 1.00 . A A . 13 ALA HB2 1 1 5 7699 1 1 13 ALA HB3 H 3.523 11.229 -2.922 1.00 . A A . 13 ALA HB3 1 1 5 7700 1 1 13 ALA N N 0.460 11.233 -4.086 1.00 . A A . 13 ALA N 1 1 5 7701 1 1 13 ALA O O 3.322 11.649 -6.188 1.00 . A A . 13 ALA O 1 1 5 7702 1 1 14 THR C C 0.321 10.794 -8.691 1.00 . A A . 14 THR C 1 1 5 7703 1 1 14 THR CA C 1.528 10.346 -7.864 1.00 . A A . 14 THR CA 1 1 5 7704 1 1 14 THR CB C 1.832 8.852 -7.994 1.00 . A A . 14 THR CB 1 1 5 7705 1 1 14 THR CG2 C 2.615 8.308 -6.798 1.00 . A A . 14 THR CG2 1 1 5 7706 1 1 14 THR H H 0.438 10.335 -6.089 1.00 . A A . 14 THR H 1 1 5 7707 1 1 14 THR HA H 2.385 10.923 -8.211 1.00 . A A . 14 THR HA 1 1 5 7708 1 1 14 THR HB H 2.352 8.641 -8.929 1.00 . A A . 14 THR HB 1 1 5 7709 1 1 14 THR HG1 H 0.099 8.525 -7.049 1.00 . A A . 14 THR HG1 1 1 5 7710 1 1 14 THR HG21 H 2.088 8.555 -5.876 1.00 . A A . 14 THR HG21 1 1 5 7711 1 1 14 THR HG22 H 2.706 7.225 -6.885 1.00 . A A . 14 THR HG22 1 1 5 7712 1 1 14 THR HG23 H 3.609 8.756 -6.779 1.00 . A A . 14 THR HG23 1 1 5 7713 1 1 14 THR N N 1.316 10.640 -6.457 1.00 . A A . 14 THR N 1 1 5 7714 1 1 14 THR O O -0.677 11.256 -8.139 1.00 . A A . 14 THR O 1 1 5 7715 1 1 14 THR OG1 O 0.556 8.227 -7.887 1.00 . A A . 14 THR OG1 1 1 5 7716 1 1 15 LYS C C -1.834 10.133 -10.663 1.00 . A A . 15 LYS C 1 1 5 7717 1 1 15 LYS CA C -0.616 11.025 -10.909 1.00 . A A . 15 LYS CA 1 1 5 7718 1 1 15 LYS CB C -0.121 11.005 -12.356 1.00 . A A . 15 LYS CB 1 1 5 7719 1 1 15 LYS CD C -0.421 12.218 -14.547 1.00 . A A . 15 LYS CD 1 1 5 7720 1 1 15 LYS CE C -1.427 12.433 -15.679 1.00 . A A . 15 LYS CE 1 1 5 7721 1 1 15 LYS CG C -1.117 11.703 -13.286 1.00 . A A . 15 LYS CG 1 1 5 7722 1 1 15 LYS H H 1.266 10.265 -10.441 1.00 . A A . 15 LYS H 1 1 5 7723 1 1 15 LYS HA H -0.889 12.054 -10.676 1.00 . A A . 15 LYS HA 1 1 5 7724 1 1 15 LYS HB2 H 0.848 11.499 -12.420 1.00 . A A . 15 LYS HB2 1 1 5 7725 1 1 15 LYS HB3 H 0.024 9.975 -12.680 1.00 . A A . 15 LYS HB3 1 1 5 7726 1 1 15 LYS HD2 H 0.090 13.156 -14.327 1.00 . A A . 15 LYS HD2 1 1 5 7727 1 1 15 LYS HD3 H 0.342 11.507 -14.863 1.00 . A A . 15 LYS HD3 1 1 5 7728 1 1 15 LYS HE2 H -2.207 11.674 -15.629 1.00 . A A . 15 LYS HE2 1 1 5 7729 1 1 15 LYS HE3 H -1.915 13.400 -15.561 1.00 . A A . 15 LYS HE3 1 1 5 7730 1 1 15 LYS HG2 H -1.910 11.008 -13.562 1.00 . A A . 15 LYS HG2 1 1 5 7731 1 1 15 LYS HG3 H -1.589 12.533 -12.761 1.00 . A A . 15 LYS HG3 1 1 5 7732 1 1 15 LYS HZ1 H 0.129 12.878 -16.993 1.00 . A A . 15 LYS HZ1 1 1 5 7733 1 1 15 LYS HZ2 H -0.535 11.417 -17.266 1.00 . A A . 15 LYS HZ2 1 1 5 7734 1 1 15 LYS N N 0.451 10.642 -10.001 1.00 . A A . 15 LYS N 1 1 5 7735 1 1 15 LYS NZ N -0.749 12.370 -16.993 1.00 . A A . 15 LYS NZ 1 1 5 7736 1 1 15 LYS O O -2.920 10.404 -11.174 1.00 . A A . 15 LYS O 1 1 5 7737 1 1 16 GLN C C -2.856 8.047 -8.044 1.00 . A A . 16 GLN C 1 1 5 7738 1 1 16 GLN CA C -2.680 8.153 -9.560 1.00 . A A . 16 GLN CA 1 1 5 7739 1 1 16 GLN CB C -2.409 6.780 -10.178 1.00 . A A . 16 GLN CB 1 1 5 7740 1 1 16 GLN CD C -3.053 6.380 -12.583 1.00 . A A . 16 GLN CD 1 1 5 7741 1 1 16 GLN CG C -1.973 6.912 -11.639 1.00 . A A . 16 GLN CG 1 1 5 7742 1 1 16 GLN H H -0.728 8.874 -9.468 1.00 . A A . 16 GLN H 1 1 5 7743 1 1 16 GLN HA H -3.579 8.575 -10.009 1.00 . A A . 16 GLN HA 1 1 5 7744 1 1 16 GLN HB2 H -1.634 6.267 -9.609 1.00 . A A . 16 GLN HB2 1 1 5 7745 1 1 16 GLN HB3 H -3.308 6.166 -10.117 1.00 . A A . 16 GLN HB3 1 1 5 7746 1 1 16 GLN HE21 H -4.443 7.308 -11.440 1.00 . A A . 16 GLN HE21 1 1 5 7747 1 1 16 GLN HE22 H -5.064 6.441 -12.805 1.00 . A A . 16 GLN HE22 1 1 5 7748 1 1 16 GLN HG2 H -1.767 7.957 -11.868 1.00 . A A . 16 GLN HG2 1 1 5 7749 1 1 16 GLN HG3 H -1.045 6.363 -11.796 1.00 . A A . 16 GLN HG3 1 1 5 7750 1 1 16 GLN N N -1.614 9.087 -9.880 1.00 . A A . 16 GLN N 1 1 5 7751 1 1 16 GLN NE2 N -4.289 6.739 -12.249 1.00 . A A . 16 GLN NE2 1 1 5 7752 1 1 16 GLN O O -2.149 7.286 -7.385 1.00 . A A . 16 GLN O 1 1 5 7753 1 1 16 GLN OE1 O -2.782 5.690 -13.552 1.00 . A A . 16 GLN OE1 1 1 5 7754 1 1 17 PRO C C -4.867 7.583 -5.683 1.00 . A A . 17 PRO C 1 1 5 7755 1 1 17 PRO CA C -4.106 8.845 -6.096 1.00 . A A . 17 PRO CA 1 1 5 7756 1 1 17 PRO CB C -4.894 10.121 -5.851 1.00 . A A . 17 PRO CB 1 1 5 7757 1 1 17 PRO CD C -4.685 9.755 -8.272 1.00 . A A . 17 PRO CD 1 1 5 7758 1 1 17 PRO CG C -5.428 10.548 -7.209 1.00 . A A . 17 PRO CG 1 1 5 7759 1 1 17 PRO HA H -3.252 8.831 -5.575 1.00 . A A . 17 PRO HA 1 1 5 7760 1 1 17 PRO HB2 H -5.709 9.948 -5.148 1.00 . A A . 17 PRO HB2 1 1 5 7761 1 1 17 PRO HB3 H -4.260 10.895 -5.419 1.00 . A A . 17 PRO HB3 1 1 5 7762 1 1 17 PRO HD2 H -5.376 9.211 -8.915 1.00 . A A . 17 PRO HD2 1 1 5 7763 1 1 17 PRO HD3 H -4.098 10.410 -8.916 1.00 . A A . 17 PRO HD3 1 1 5 7764 1 1 17 PRO HG2 H -6.500 10.362 -7.273 1.00 . A A . 17 PRO HG2 1 1 5 7765 1 1 17 PRO HG3 H -5.280 11.618 -7.358 1.00 . A A . 17 PRO HG3 1 1 5 7766 1 1 17 PRO N N -3.828 8.842 -7.522 1.00 . A A . 17 PRO N 1 1 5 7767 1 1 17 PRO O O -5.418 6.881 -6.530 1.00 . A A . 17 PRO O 1 1 5 7768 1 1 18 VAL C C -6.148 6.514 -2.477 1.00 . A A . 18 VAL C 1 1 5 7769 1 1 18 VAL CA C -5.558 6.169 -3.846 1.00 . A A . 18 VAL CA 1 1 5 7770 1 1 18 VAL CB C -4.602 4.975 -3.802 1.00 . A A . 18 VAL CB 1 1 5 7771 1 1 18 VAL CG1 C -5.263 3.768 -3.133 1.00 . A A . 18 VAL CG1 1 1 5 7772 1 1 18 VAL CG2 C -4.104 4.619 -5.205 1.00 . A A . 18 VAL CG2 1 1 5 7773 1 1 18 VAL H H -4.423 7.910 -3.700 1.00 . A A . 18 VAL H 1 1 5 7774 1 1 18 VAL HA H -6.373 5.924 -4.528 1.00 . A A . 18 VAL HA 1 1 5 7775 1 1 18 VAL HB H -3.738 5.259 -3.202 1.00 . A A . 18 VAL HB 1 1 5 7776 1 1 18 VAL HG11 H -5.639 4.058 -2.152 1.00 . A A . 18 VAL HG11 1 1 5 7777 1 1 18 VAL HG12 H -6.090 3.418 -3.750 1.00 . A A . 18 VAL HG12 1 1 5 7778 1 1 18 VAL HG13 H -4.530 2.969 -3.020 1.00 . A A . 18 VAL HG13 1 1 5 7779 1 1 18 VAL HG21 H -4.890 4.824 -5.932 1.00 . A A . 18 VAL HG21 1 1 5 7780 1 1 18 VAL HG22 H -3.225 5.220 -5.441 1.00 . A A . 18 VAL HG22 1 1 5 7781 1 1 18 VAL HG23 H -3.842 3.562 -5.240 1.00 . A A . 18 VAL HG23 1 1 5 7782 1 1 18 VAL N N -4.874 7.334 -4.382 1.00 . A A . 18 VAL N 1 1 5 7783 1 1 18 VAL O O -5.642 7.395 -1.784 1.00 . A A . 18 VAL O 1 1 5 7784 1 1 19 VAL C C -7.780 4.747 -0.011 1.00 . A A . 19 VAL C 1 1 5 7785 1 1 19 VAL CA C -7.872 6.020 -0.855 1.00 . A A . 19 VAL CA 1 1 5 7786 1 1 19 VAL CB C -9.313 6.479 -1.088 1.00 . A A . 19 VAL CB 1 1 5 7787 1 1 19 VAL CG1 C -10.116 6.449 0.214 1.00 . A A . 19 VAL CG1 1 1 5 7788 1 1 19 VAL CG2 C -9.349 7.871 -1.722 1.00 . A A . 19 VAL CG2 1 1 5 7789 1 1 19 VAL H H -7.613 5.085 -2.698 1.00 . A A . 19 VAL H 1 1 5 7790 1 1 19 VAL HA H -7.341 6.821 -0.341 1.00 . A A . 19 VAL HA 1 1 5 7791 1 1 19 VAL HB H -9.778 5.782 -1.785 1.00 . A A . 19 VAL HB 1 1 5 7792 1 1 19 VAL HG11 H -9.986 5.481 0.698 1.00 . A A . 19 VAL HG11 1 1 5 7793 1 1 19 VAL HG12 H -9.761 7.238 0.877 1.00 . A A . 19 VAL HG12 1 1 5 7794 1 1 19 VAL HG13 H -11.171 6.606 -0.007 1.00 . A A . 19 VAL HG13 1 1 5 7795 1 1 19 VAL HG21 H -8.512 7.977 -2.413 1.00 . A A . 19 VAL HG21 1 1 5 7796 1 1 19 VAL HG22 H -10.286 7.999 -2.264 1.00 . A A . 19 VAL HG22 1 1 5 7797 1 1 19 VAL HG23 H -9.274 8.628 -0.942 1.00 . A A . 19 VAL HG23 1 1 5 7798 1 1 19 VAL N N -7.208 5.800 -2.129 1.00 . A A . 19 VAL N 1 1 5 7799 1 1 19 VAL O O -8.350 3.718 -0.368 1.00 . A A . 19 VAL O 1 1 5 7800 1 1 20 PHE C C -7.829 3.831 3.190 1.00 . A A . 20 PHE C 1 1 5 7801 1 1 20 PHE CA C -6.882 3.731 1.992 1.00 . A A . 20 PHE CA 1 1 5 7802 1 1 20 PHE CB C -5.438 3.809 2.492 1.00 . A A . 20 PHE CB 1 1 5 7803 1 1 20 PHE CD1 C -4.772 1.380 2.599 1.00 . A A . 20 PHE CD1 1 1 5 7804 1 1 20 PHE CD2 C -4.772 2.646 4.627 1.00 . A A . 20 PHE CD2 1 1 5 7805 1 1 20 PHE CE1 C -4.340 0.215 3.327 1.00 . A A . 20 PHE CE1 1 1 5 7806 1 1 20 PHE CE2 C -4.340 1.481 5.355 1.00 . A A . 20 PHE CE2 1 1 5 7807 1 1 20 PHE CG C -4.979 2.571 3.265 1.00 . A A . 20 PHE CG 1 1 5 7808 1 1 20 PHE CZ C -4.145 0.323 4.669 1.00 . A A . 20 PHE CZ 1 1 5 7809 1 1 20 PHE H H -6.597 5.701 1.378 1.00 . A A . 20 PHE H 1 1 5 7810 1 1 20 PHE HA H -7.106 2.821 1.436 1.00 . A A . 20 PHE HA 1 1 5 7811 1 1 20 PHE HB2 H -4.777 3.958 1.638 1.00 . A A . 20 PHE HB2 1 1 5 7812 1 1 20 PHE HB3 H -5.333 4.685 3.132 1.00 . A A . 20 PHE HB3 1 1 5 7813 1 1 20 PHE HD1 H -4.936 1.321 1.523 1.00 . A A . 20 PHE HD1 1 1 5 7814 1 1 20 PHE HD2 H -4.935 3.587 5.152 1.00 . A A . 20 PHE HD2 1 1 5 7815 1 1 20 PHE HE1 H -4.173 -0.732 2.814 1.00 . A A . 20 PHE HE1 1 1 5 7816 1 1 20 PHE HE2 H -4.173 1.526 6.431 1.00 . A A . 20 PHE HE2 1 1 5 7817 1 1 20 PHE HZ H -3.832 -0.529 5.325 1.00 . A A . 20 PHE HZ 1 1 5 7818 1 1 20 PHE N N -7.057 4.860 1.094 1.00 . A A . 20 PHE N 1 1 5 7819 1 1 20 PHE O O -8.385 4.895 3.459 1.00 . A A . 20 PHE O 1 1 5 7820 1 1 21 ASN C C -8.254 1.710 6.079 1.00 . A A . 21 ASN C 1 1 5 7821 1 1 21 ASN CA C -8.856 2.657 5.038 1.00 . A A . 21 ASN CA 1 1 5 7822 1 1 21 ASN CB C -10.242 2.128 4.664 1.00 . A A . 21 ASN CB 1 1 5 7823 1 1 21 ASN CG C -10.985 3.122 3.769 1.00 . A A . 21 ASN CG 1 1 5 7824 1 1 21 ASN H H -7.529 1.848 3.650 1.00 . A A . 21 ASN H 1 1 5 7825 1 1 21 ASN HA H -8.918 3.684 5.396 1.00 . A A . 21 ASN HA 1 1 5 7826 1 1 21 ASN HB2 H -10.144 1.172 4.149 1.00 . A A . 21 ASN HB2 1 1 5 7827 1 1 21 ASN HB3 H -10.821 1.945 5.569 1.00 . A A . 21 ASN HB3 1 1 5 7828 1 1 21 ASN HD21 H -9.971 2.378 2.182 1.00 . A A . 21 ASN HD21 1 1 5 7829 1 1 21 ASN HD22 H -11.084 3.654 1.818 1.00 . A A . 21 ASN HD22 1 1 5 7830 1 1 21 ASN N N -7.985 2.709 3.876 1.00 . A A . 21 ASN N 1 1 5 7831 1 1 21 ASN ND2 N -10.652 3.045 2.484 1.00 . A A . 21 ASN ND2 1 1 5 7832 1 1 21 ASN O O -7.775 0.630 5.738 1.00 . A A . 21 ASN O 1 1 5 7833 1 1 21 ASN OD1 O -11.805 3.907 4.216 1.00 . A A . 21 ASN OD1 1 1 5 7834 1 1 22 HIS C C -8.876 0.499 9.025 1.00 . A A . 22 HIS C 1 1 5 7835 1 1 22 HIS CA C -7.762 1.357 8.420 1.00 . A A . 22 HIS CA 1 1 5 7836 1 1 22 HIS CB C -7.074 2.250 9.455 1.00 . A A . 22 HIS CB 1 1 5 7837 1 1 22 HIS CD2 C -4.474 1.996 9.372 1.00 . A A . 22 HIS CD2 1 1 5 7838 1 1 22 HIS CE1 C -4.021 3.804 8.226 1.00 . A A . 22 HIS CE1 1 1 5 7839 1 1 22 HIS CG C -5.655 2.622 9.098 1.00 . A A . 22 HIS CG 1 1 5 7840 1 1 22 HIS H H -8.689 3.031 7.597 1.00 . A A . 22 HIS H 1 1 5 7841 1 1 22 HIS HA H -7.004 0.702 7.990 1.00 . A A . 22 HIS HA 1 1 5 7842 1 1 22 HIS HB2 H -7.658 3.162 9.578 1.00 . A A . 22 HIS HB2 1 1 5 7843 1 1 22 HIS HB3 H -7.074 1.740 10.418 1.00 . A A . 22 HIS HB3 1 1 5 7844 1 1 22 HIS HD1 H -5.989 4.430 8.024 1.00 . A A . 22 HIS HD1 1 1 5 7845 1 1 22 HIS HD2 H -4.360 1.067 9.930 1.00 . A A . 22 HIS HD2 1 1 5 7846 1 1 22 HIS HE1 H -3.462 4.580 7.702 1.00 . A A . 22 HIS HE1 1 1 5 7847 1 1 22 HIS N N -8.298 2.151 7.328 1.00 . A A . 22 HIS N 1 1 5 7848 1 1 22 HIS ND1 N -5.337 3.758 8.375 1.00 . A A . 22 HIS ND1 1 1 5 7849 1 1 22 HIS NE2 N -3.488 2.711 8.844 1.00 . A A . 22 HIS NE2 1 1 5 7850 1 1 22 HIS O O -8.603 -0.477 9.723 1.00 . A A . 22 HIS O 1 1 5 7851 1 1 23 SER C C -11.510 -1.078 8.398 1.00 . A A . 23 SER C 1 1 5 7852 1 1 23 SER CA C -11.262 0.174 9.242 1.00 . A A . 23 SER CA 1 1 5 7853 1 1 23 SER CB C -12.507 1.064 9.249 1.00 . A A . 23 SER CB 1 1 5 7854 1 1 23 SER H H -10.320 1.689 8.167 1.00 . A A . 23 SER H 1 1 5 7855 1 1 23 SER HA H -11.006 -0.099 10.266 1.00 . A A . 23 SER HA 1 1 5 7856 1 1 23 SER HB2 H -12.222 2.083 9.512 1.00 . A A . 23 SER HB2 1 1 5 7857 1 1 23 SER HB3 H -12.931 1.101 8.246 1.00 . A A . 23 SER HB3 1 1 5 7858 1 1 23 SER HG H -13.752 -0.343 9.938 1.00 . A A . 23 SER HG 1 1 5 7859 1 1 23 SER N N -10.107 0.894 8.735 1.00 . A A . 23 SER N 1 1 5 7860 1 1 23 SER O O -12.421 -1.854 8.685 1.00 . A A . 23 SER O 1 1 5 7861 1 1 23 SER OG O -13.493 0.596 10.164 1.00 . A A . 23 SER OG 1 1 5 7862 1 1 24 THR C C -9.675 -3.380 6.752 1.00 . A A . 24 THR C 1 1 5 7863 1 1 24 THR CA C -10.802 -2.380 6.487 1.00 . A A . 24 THR CA 1 1 5 7864 1 1 24 THR CB C -10.828 -1.861 5.048 1.00 . A A . 24 THR CB 1 1 5 7865 1 1 24 THR CG2 C -10.937 -2.990 4.020 1.00 . A A . 24 THR CG2 1 1 5 7866 1 1 24 THR H H -9.946 -0.600 7.148 1.00 . A A . 24 THR H 1 1 5 7867 1 1 24 THR HA H -11.740 -2.890 6.707 1.00 . A A . 24 THR HA 1 1 5 7868 1 1 24 THR HB H -9.961 -1.233 4.845 1.00 . A A . 24 THR HB 1 1 5 7869 1 1 24 THR HG1 H -12.043 -0.330 5.475 1.00 . A A . 24 THR HG1 1 1 5 7870 1 1 24 THR HG21 H -10.292 -3.816 4.318 1.00 . A A . 24 THR HG21 1 1 5 7871 1 1 24 THR HG22 H -11.970 -3.336 3.969 1.00 . A A . 24 THR HG22 1 1 5 7872 1 1 24 THR HG23 H -10.628 -2.622 3.042 1.00 . A A . 24 THR HG23 1 1 5 7873 1 1 24 THR N N -10.684 -1.236 7.374 1.00 . A A . 24 THR N 1 1 5 7874 1 1 24 THR O O -9.878 -4.589 6.655 1.00 . A A . 24 THR O 1 1 5 7875 1 1 24 THR OG1 O -12.075 -1.178 4.947 1.00 . A A . 24 THR OG1 1 1 5 7876 1 1 25 HIS C C -7.191 -3.830 8.875 1.00 . A A . 25 HIS C 1 1 5 7877 1 1 25 HIS CA C -7.352 -3.667 7.362 1.00 . A A . 25 HIS CA 1 1 5 7878 1 1 25 HIS CB C -6.102 -3.097 6.691 1.00 . A A . 25 HIS CB 1 1 5 7879 1 1 25 HIS CD2 C -5.735 -3.708 4.176 1.00 . A A . 25 HIS CD2 1 1 5 7880 1 1 25 HIS CE1 C -6.843 -2.045 3.286 1.00 . A A . 25 HIS CE1 1 1 5 7881 1 1 25 HIS CG C -6.225 -2.943 5.193 1.00 . A A . 25 HIS CG 1 1 5 7882 1 1 25 HIS H H -8.356 -1.853 7.160 1.00 . A A . 25 HIS H 1 1 5 7883 1 1 25 HIS HA H -7.552 -4.643 6.919 1.00 . A A . 25 HIS HA 1 1 5 7884 1 1 25 HIS HB2 H -5.879 -2.124 7.128 1.00 . A A . 25 HIS HB2 1 1 5 7885 1 1 25 HIS HB3 H -5.255 -3.747 6.911 1.00 . A A . 25 HIS HB3 1 1 5 7886 1 1 25 HIS HD1 H -7.394 -1.167 5.084 1.00 . A A . 25 HIS HD1 1 1 5 7887 1 1 25 HIS HD2 H -5.137 -4.612 4.290 1.00 . A A . 25 HIS HD2 1 1 5 7888 1 1 25 HIS HE1 H -7.289 -1.383 2.543 1.00 . A A . 25 HIS HE1 1 1 5 7889 1 1 25 HIS N N -8.512 -2.838 7.082 1.00 . A A . 25 HIS N 1 1 5 7890 1 1 25 HIS ND1 N -6.918 -1.902 4.601 1.00 . A A . 25 HIS ND1 1 1 5 7891 1 1 25 HIS NE2 N -6.110 -3.165 3.024 1.00 . A A . 25 HIS NE2 1 1 5 7892 1 1 25 HIS O O -6.072 -3.910 9.378 1.00 . A A . 25 HIS O 1 1 5 7893 1 1 26 LYS C C -7.814 -5.422 11.364 1.00 . A A . 26 LYS C 1 1 5 7894 1 1 26 LYS CA C -8.325 -4.026 11.002 1.00 . A A . 26 LYS CA 1 1 5 7895 1 1 26 LYS CB C -9.707 -3.710 11.576 1.00 . A A . 26 LYS CB 1 1 5 7896 1 1 26 LYS CD C -11.588 -2.032 11.659 1.00 . A A . 26 LYS CD 1 1 5 7897 1 1 26 LYS CE C -11.505 -1.004 12.789 1.00 . A A . 26 LYS CE 1 1 5 7898 1 1 26 LYS CG C -10.199 -2.342 11.097 1.00 . A A . 26 LYS CG 1 1 5 7899 1 1 26 LYS H H -9.232 -3.809 9.140 1.00 . A A . 26 LYS H 1 1 5 7900 1 1 26 LYS HA H -7.631 -3.289 11.408 1.00 . A A . 26 LYS HA 1 1 5 7901 1 1 26 LYS HB2 H -10.416 -4.481 11.274 1.00 . A A . 26 LYS HB2 1 1 5 7902 1 1 26 LYS HB3 H -9.666 -3.725 12.665 1.00 . A A . 26 LYS HB3 1 1 5 7903 1 1 26 LYS HD2 H -12.230 -1.653 10.864 1.00 . A A . 26 LYS HD2 1 1 5 7904 1 1 26 LYS HD3 H -12.048 -2.948 12.030 1.00 . A A . 26 LYS HD3 1 1 5 7905 1 1 26 LYS HE2 H -10.569 -1.127 13.333 1.00 . A A . 26 LYS HE2 1 1 5 7906 1 1 26 LYS HE3 H -11.501 0.004 12.373 1.00 . A A . 26 LYS HE3 1 1 5 7907 1 1 26 LYS HG2 H -9.496 -1.570 11.408 1.00 . A A . 26 LYS HG2 1 1 5 7908 1 1 26 LYS HG3 H -10.232 -2.324 10.008 1.00 . A A . 26 LYS HG3 1 1 5 7909 1 1 26 LYS HZ1 H -13.224 -1.959 13.479 1.00 . A A . 26 LYS HZ1 1 1 5 7910 1 1 26 LYS HZ2 H -12.345 -1.288 14.675 1.00 . A A . 26 LYS HZ2 1 1 5 7911 1 1 26 LYS N N -8.326 -3.875 9.557 1.00 . A A . 26 LYS N 1 1 5 7912 1 1 26 LYS NZ N -12.649 -1.158 13.716 1.00 . A A . 26 LYS NZ 1 1 5 7913 1 1 26 LYS O O -7.122 -5.594 12.366 1.00 . A A . 26 LYS O 1 1 5 7914 1 1 27 SER C C -6.286 -7.928 10.383 1.00 . A A . 27 SER C 1 1 5 7915 1 1 27 SER CA C -7.762 -7.760 10.747 1.00 . A A . 27 SER CA 1 1 5 7916 1 1 27 SER CB C -8.623 -8.730 9.935 1.00 . A A . 27 SER CB 1 1 5 7917 1 1 27 SER H H -8.738 -6.237 9.715 1.00 . A A . 27 SER H 1 1 5 7918 1 1 27 SER HA H -7.917 -7.942 11.811 1.00 . A A . 27 SER HA 1 1 5 7919 1 1 27 SER HB2 H -8.307 -9.753 10.138 1.00 . A A . 27 SER HB2 1 1 5 7920 1 1 27 SER HB3 H -9.662 -8.648 10.254 1.00 . A A . 27 SER HB3 1 1 5 7921 1 1 27 SER HG H -9.452 -8.454 8.134 1.00 . A A . 27 SER HG 1 1 5 7922 1 1 27 SER N N -8.175 -6.385 10.528 1.00 . A A . 27 SER N 1 1 5 7923 1 1 27 SER O O -5.669 -8.935 10.726 1.00 . A A . 27 SER O 1 1 5 7924 1 1 27 SER OG O -8.536 -8.476 8.535 1.00 . A A . 27 SER OG 1 1 5 7925 1 1 28 VAL C C -3.501 -6.356 10.387 1.00 . A A . 28 VAL C 1 1 5 7926 1 1 28 VAL CA C -4.370 -6.951 9.277 1.00 . A A . 28 VAL CA 1 1 5 7927 1 1 28 VAL CB C -4.210 -6.226 7.939 1.00 . A A . 28 VAL CB 1 1 5 7928 1 1 28 VAL CG1 C -2.800 -6.417 7.377 1.00 . A A . 28 VAL CG1 1 1 5 7929 1 1 28 VAL CG2 C -5.268 -6.687 6.935 1.00 . A A . 28 VAL CG2 1 1 5 7930 1 1 28 VAL H H -6.271 -6.110 9.417 1.00 . A A . 28 VAL H 1 1 5 7931 1 1 28 VAL HA H -4.088 -7.993 9.131 1.00 . A A . 28 VAL HA 1 1 5 7932 1 1 28 VAL HB H -4.358 -5.160 8.115 1.00 . A A . 28 VAL HB 1 1 5 7933 1 1 28 VAL HG11 H -2.452 -7.424 7.606 1.00 . A A . 28 VAL HG11 1 1 5 7934 1 1 28 VAL HG12 H -2.818 -6.276 6.296 1.00 . A A . 28 VAL HG12 1 1 5 7935 1 1 28 VAL HG13 H -2.127 -5.689 7.828 1.00 . A A . 28 VAL HG13 1 1 5 7936 1 1 28 VAL HG21 H -6.257 -6.612 7.389 1.00 . A A . 28 VAL HG21 1 1 5 7937 1 1 28 VAL HG22 H -5.227 -6.056 6.048 1.00 . A A . 28 VAL HG22 1 1 5 7938 1 1 28 VAL HG23 H -5.075 -7.722 6.654 1.00 . A A . 28 VAL HG23 1 1 5 7939 1 1 28 VAL N N -5.762 -6.926 9.692 1.00 . A A . 28 VAL N 1 1 5 7940 1 1 28 VAL O O -3.904 -5.402 11.051 1.00 . A A . 28 VAL O 1 1 5 7941 1 1 29 LYS C C -0.788 -5.149 11.136 1.00 . A A . 29 LYS C 1 1 5 7942 1 1 29 LYS CA C -1.396 -6.484 11.571 1.00 . A A . 29 LYS CA 1 1 5 7943 1 1 29 LYS CB C -0.356 -7.564 11.874 1.00 . A A . 29 LYS CB 1 1 5 7944 1 1 29 LYS CD C -1.170 -9.217 13.596 1.00 . A A . 29 LYS CD 1 1 5 7945 1 1 29 LYS CE C -0.546 -10.055 14.713 1.00 . A A . 29 LYS CE 1 1 5 7946 1 1 29 LYS CG C -0.367 -7.936 13.358 1.00 . A A . 29 LYS CG 1 1 5 7947 1 1 29 LYS H H -2.005 -7.718 10.008 1.00 . A A . 29 LYS H 1 1 5 7948 1 1 29 LYS HA H -1.967 -6.321 12.485 1.00 . A A . 29 LYS HA 1 1 5 7949 1 1 29 LYS HB2 H -0.559 -8.449 11.271 1.00 . A A . 29 LYS HB2 1 1 5 7950 1 1 29 LYS HB3 H 0.636 -7.208 11.592 1.00 . A A . 29 LYS HB3 1 1 5 7951 1 1 29 LYS HD2 H -2.197 -8.963 13.857 1.00 . A A . 29 LYS HD2 1 1 5 7952 1 1 29 LYS HD3 H -1.210 -9.801 12.677 1.00 . A A . 29 LYS HD3 1 1 5 7953 1 1 29 LYS HE2 H 0.526 -9.865 14.763 1.00 . A A . 29 LYS HE2 1 1 5 7954 1 1 29 LYS HE3 H -0.967 -9.762 15.675 1.00 . A A . 29 LYS HE3 1 1 5 7955 1 1 29 LYS HG2 H 0.655 -8.072 13.710 1.00 . A A . 29 LYS HG2 1 1 5 7956 1 1 29 LYS HG3 H -0.798 -7.120 13.938 1.00 . A A . 29 LYS HG3 1 1 5 7957 1 1 29 LYS HZ1 H -1.234 -11.664 13.582 1.00 . A A . 29 LYS HZ1 1 1 5 7958 1 1 29 LYS HZ2 H 0.072 -12.032 14.483 1.00 . A A . 29 LYS HZ2 1 1 5 7959 1 1 29 LYS N N -2.325 -6.943 10.553 1.00 . A A . 29 LYS N 1 1 5 7960 1 1 29 LYS NZ N -0.789 -11.496 14.477 1.00 . A A . 29 LYS NZ 1 1 5 7961 1 1 29 LYS O O -0.468 -4.962 9.963 1.00 . A A . 29 LYS O 1 1 5 7962 1 1 30 CYS C C 1.353 -3.129 11.344 1.00 . A A . 30 CYS C 1 1 5 7963 1 1 30 CYS CA C -0.084 -2.943 11.835 1.00 . A A . 30 CYS CA 1 1 5 7964 1 1 30 CYS CB C -0.155 -2.034 13.064 1.00 . A A . 30 CYS CB 1 1 5 7965 1 1 30 CYS H H -0.910 -4.416 13.055 1.00 . A A . 30 CYS H 1 1 5 7966 1 1 30 CYS HA H -0.702 -2.490 11.059 1.00 . A A . 30 CYS HA 1 1 5 7967 1 1 30 CYS HB2 H 0.679 -2.273 13.723 1.00 . A A . 30 CYS HB2 1 1 5 7968 1 1 30 CYS HB3 H -0.021 -1.002 12.742 1.00 . A A . 30 CYS HB3 1 1 5 7969 1 1 30 CYS N N -0.647 -4.255 12.104 1.00 . A A . 30 CYS N 1 1 5 7970 1 1 30 CYS O O 1.870 -2.300 10.597 1.00 . A A . 30 CYS O 1 1 5 7971 1 1 30 CYS SG S -1.712 -2.155 14.018 1.00 . A A . 30 CYS SG 1 1 5 7972 1 1 31 GLY C C 3.374 -5.190 10.023 1.00 . A A . 31 GLY C 1 1 5 7973 1 1 31 GLY CA C 3.326 -4.527 11.401 1.00 . A A . 31 GLY CA 1 1 5 7974 1 1 31 GLY H H 1.531 -4.891 12.393 1.00 . A A . 31 GLY H 1 1 5 7975 1 1 31 GLY HA2 H 3.917 -3.611 11.389 1.00 . A A . 31 GLY HA2 1 1 5 7976 1 1 31 GLY HA3 H 3.777 -5.187 12.142 1.00 . A A . 31 GLY HA3 1 1 5 7977 1 1 31 GLY N N 1.959 -4.222 11.785 1.00 . A A . 31 GLY N 1 1 5 7978 1 1 31 GLY O O 4.451 -5.503 9.518 1.00 . A A . 31 GLY O 1 1 5 7979 1 1 32 ASP C C 2.276 -4.939 7.063 1.00 . A A . 32 ASP C 1 1 5 7980 1 1 32 ASP CA C 2.087 -6.005 8.145 1.00 . A A . 32 ASP CA 1 1 5 7981 1 1 32 ASP CB C 0.709 -6.640 7.947 1.00 . A A . 32 ASP CB 1 1 5 7982 1 1 32 ASP CG C 0.578 -7.529 6.708 1.00 . A A . 32 ASP CG 1 1 5 7983 1 1 32 ASP H H 1.322 -5.127 9.872 1.00 . A A . 32 ASP H 1 1 5 7984 1 1 32 ASP HA H 2.868 -6.764 8.123 1.00 . A A . 32 ASP HA 1 1 5 7985 1 1 32 ASP HB2 H 0.469 -7.234 8.829 1.00 . A A . 32 ASP HB2 1 1 5 7986 1 1 32 ASP HB3 H -0.035 -5.846 7.886 1.00 . A A . 32 ASP HB3 1 1 5 7987 1 1 32 ASP N N 2.193 -5.385 9.454 1.00 . A A . 32 ASP N 1 1 5 7988 1 1 32 ASP O O 2.678 -5.251 5.944 1.00 . A A . 32 ASP O 1 1 5 7989 1 1 32 ASP OD1 O 1.066 -7.093 5.643 1.00 . A A . 32 ASP OD1 1 1 5 7990 1 1 32 ASP OD2 O -0.006 -8.624 6.854 1.00 . A A . 32 ASP OD2 1 1 5 7991 1 1 33 CYS C C 3.225 -1.676 7.017 1.00 . A A . 33 CYS C 1 1 5 7992 1 1 33 CYS CA C 2.108 -2.591 6.512 1.00 . A A . 33 CYS CA 1 1 5 7993 1 1 33 CYS CB C 0.787 -1.837 6.341 1.00 . A A . 33 CYS CB 1 1 5 7994 1 1 33 CYS H H 1.650 -3.459 8.349 1.00 . A A . 33 CYS H 1 1 5 7995 1 1 33 CYS HA H 2.366 -3.017 5.543 1.00 . A A . 33 CYS HA 1 1 5 7996 1 1 33 CYS HB2 H 0.202 -1.900 7.259 1.00 . A A . 33 CYS HB2 1 1 5 7997 1 1 33 CYS HB3 H 0.982 -0.781 6.159 1.00 . A A . 33 CYS HB3 1 1 5 7998 1 1 33 CYS N N 1.976 -3.704 7.436 1.00 . A A . 33 CYS N 1 1 5 7999 1 1 33 CYS O O 4.175 -1.390 6.290 1.00 . A A . 33 CYS O 1 1 5 8000 1 1 33 CYS SG S -0.162 -2.546 4.946 1.00 . A A . 33 CYS SG 1 1 5 8001 1 1 34 HIS C C 5.286 -1.180 9.283 1.00 . A A . 34 HIS C 1 1 5 8002 1 1 34 HIS CA C 4.059 -0.365 8.872 1.00 . A A . 34 HIS CA 1 1 5 8003 1 1 34 HIS CB C 3.444 0.412 10.038 1.00 . A A . 34 HIS CB 1 1 5 8004 1 1 34 HIS CD2 C 0.934 1.073 9.728 1.00 . A A . 34 HIS CD2 1 1 5 8005 1 1 34 HIS CE1 C 1.240 3.060 8.864 1.00 . A A . 34 HIS CE1 1 1 5 8006 1 1 34 HIS CG C 2.279 1.288 9.646 1.00 . A A . 34 HIS CG 1 1 5 8007 1 1 34 HIS H H 2.299 -1.480 8.845 1.00 . A A . 34 HIS H 1 1 5 8008 1 1 34 HIS HA H 4.351 0.356 8.109 1.00 . A A . 34 HIS HA 1 1 5 8009 1 1 34 HIS HB2 H 3.114 -0.296 10.798 1.00 . A A . 34 HIS HB2 1 1 5 8010 1 1 34 HIS HB3 H 4.215 1.032 10.494 1.00 . A A . 34 HIS HB3 1 1 5 8011 1 1 34 HIS HD1 H 3.314 2.997 8.908 1.00 . A A . 34 HIS HD1 1 1 5 8012 1 1 34 HIS HD2 H 0.456 0.173 10.115 1.00 . A A . 34 HIS HD2 1 1 5 8013 1 1 34 HIS HE1 H 1.034 4.040 8.434 1.00 . A A . 34 HIS HE1 1 1 5 8014 1 1 34 HIS N N 3.074 -1.242 8.260 1.00 . A A . 34 HIS N 1 1 5 8015 1 1 34 HIS ND1 N 2.440 2.548 9.097 1.00 . A A . 34 HIS ND1 1 1 5 8016 1 1 34 HIS NE2 N 0.308 2.144 9.256 1.00 . A A . 34 HIS NE2 1 1 5 8017 1 1 34 HIS O O 5.690 -1.158 10.445 1.00 . A A . 34 HIS O 1 1 5 8018 1 1 35 HIS C C 7.976 -1.961 9.491 1.00 . A A . 35 HIS C 1 1 5 8019 1 1 35 HIS CA C 7.020 -2.701 8.554 1.00 . A A . 35 HIS CA 1 1 5 8020 1 1 35 HIS CB C 7.681 -3.114 7.238 1.00 . A A . 35 HIS CB 1 1 5 8021 1 1 35 HIS CD2 C 7.814 -1.368 5.297 1.00 . A A . 35 HIS CD2 1 1 5 8022 1 1 35 HIS CE1 C 9.632 -0.331 5.934 1.00 . A A . 35 HIS CE1 1 1 5 8023 1 1 35 HIS CG C 8.248 -1.959 6.447 1.00 . A A . 35 HIS CG 1 1 5 8024 1 1 35 HIS H H 5.512 -1.893 7.366 1.00 . A A . 35 HIS H 1 1 5 8025 1 1 35 HIS HA H 6.669 -3.607 9.049 1.00 . A A . 35 HIS HA 1 1 5 8026 1 1 35 HIS HB2 H 8.481 -3.822 7.451 1.00 . A A . 35 HIS HB2 1 1 5 8027 1 1 35 HIS HB3 H 6.948 -3.636 6.623 1.00 . A A . 35 HIS HB3 1 1 5 8028 1 1 35 HIS HD1 H 9.952 -1.482 7.631 1.00 . A A . 35 HIS HD1 1 1 5 8029 1 1 35 HIS HD2 H 6.930 -1.655 4.727 1.00 . A A . 35 HIS HD2 1 1 5 8030 1 1 35 HIS HE1 H 10.465 0.371 5.954 1.00 . A A . 35 HIS HE1 1 1 5 8031 1 1 35 HIS N N 5.846 -1.880 8.308 1.00 . A A . 35 HIS N 1 1 5 8032 1 1 35 HIS ND1 N 9.396 -1.284 6.824 1.00 . A A . 35 HIS ND1 1 1 5 8033 1 1 35 HIS NE2 N 8.650 -0.385 4.989 1.00 . A A . 35 HIS NE2 1 1 5 8034 1 1 35 HIS O O 8.043 -0.733 9.473 1.00 . A A . 35 HIS O 1 1 5 8035 1 1 36 PRO C C 10.923 -1.709 10.535 1.00 . A A . 36 PRO C 1 1 5 8036 1 1 36 PRO CA C 9.662 -2.194 11.253 1.00 . A A . 36 PRO CA 1 1 5 8037 1 1 36 PRO CB C 9.937 -3.306 12.251 1.00 . A A . 36 PRO CB 1 1 5 8038 1 1 36 PRO CD C 8.659 -4.218 10.360 1.00 . A A . 36 PRO CD 1 1 5 8039 1 1 36 PRO CG C 9.496 -4.593 11.572 1.00 . A A . 36 PRO CG 1 1 5 8040 1 1 36 PRO HA H 9.272 -1.386 11.696 1.00 . A A . 36 PRO HA 1 1 5 8041 1 1 36 PRO HB2 H 10.994 -3.345 12.511 1.00 . A A . 36 PRO HB2 1 1 5 8042 1 1 36 PRO HB3 H 9.386 -3.145 13.177 1.00 . A A . 36 PRO HB3 1 1 5 8043 1 1 36 PRO HD2 H 9.061 -4.660 9.448 1.00 . A A . 36 PRO HD2 1 1 5 8044 1 1 36 PRO HD3 H 7.634 -4.574 10.461 1.00 . A A . 36 PRO HD3 1 1 5 8045 1 1 36 PRO HG2 H 10.363 -5.182 11.270 1.00 . A A . 36 PRO HG2 1 1 5 8046 1 1 36 PRO HG3 H 8.917 -5.209 12.260 1.00 . A A . 36 PRO HG3 1 1 5 8047 1 1 36 PRO N N 8.712 -2.760 10.310 1.00 . A A . 36 PRO N 1 1 5 8048 1 1 36 PRO O O 11.579 -2.479 9.836 1.00 . A A . 36 PRO O 1 1 5 8049 1 1 37 VAL C C 13.438 0.468 11.191 1.00 . A A . 37 VAL C 1 1 5 8050 1 1 37 VAL CA C 12.396 0.163 10.114 1.00 . A A . 37 VAL CA 1 1 5 8051 1 1 37 VAL CB C 11.989 1.400 9.309 1.00 . A A . 37 VAL CB 1 1 5 8052 1 1 37 VAL CG1 C 13.212 2.073 8.684 1.00 . A A . 37 VAL CG1 1 1 5 8053 1 1 37 VAL CG2 C 10.953 1.043 8.242 1.00 . A A . 37 VAL CG2 1 1 5 8054 1 1 37 VAL H H 10.686 0.186 11.304 1.00 . A A . 37 VAL H 1 1 5 8055 1 1 37 VAL HA H 12.810 -0.569 9.421 1.00 . A A . 37 VAL HA 1 1 5 8056 1 1 37 VAL HB H 11.530 2.111 9.997 1.00 . A A . 37 VAL HB 1 1 5 8057 1 1 37 VAL HG11 H 14.087 1.439 8.823 1.00 . A A . 37 VAL HG11 1 1 5 8058 1 1 37 VAL HG12 H 13.038 2.223 7.618 1.00 . A A . 37 VAL HG12 1 1 5 8059 1 1 37 VAL HG13 H 13.381 3.037 9.163 1.00 . A A . 37 VAL HG13 1 1 5 8060 1 1 37 VAL HG21 H 11.144 0.036 7.872 1.00 . A A . 37 VAL HG21 1 1 5 8061 1 1 37 VAL HG22 H 9.954 1.086 8.676 1.00 . A A . 37 VAL HG22 1 1 5 8062 1 1 37 VAL HG23 H 11.021 1.752 7.417 1.00 . A A . 37 VAL HG23 1 1 5 8063 1 1 37 VAL N N 11.225 -0.434 10.733 1.00 . A A . 37 VAL N 1 1 5 8064 1 1 37 VAL O O 13.208 1.301 12.066 1.00 . A A . 37 VAL O 1 1 5 8065 1 1 38 ASN C C 15.392 -0.926 13.272 1.00 . A A . 38 ASN C 1 1 5 8066 1 1 38 ASN CA C 15.642 -0.040 12.049 1.00 . A A . 38 ASN CA 1 1 5 8067 1 1 38 ASN CB C 15.714 1.412 12.524 1.00 . A A . 38 ASN CB 1 1 5 8068 1 1 38 ASN CG C 17.158 1.823 12.816 1.00 . A A . 38 ASN CG 1 1 5 8069 1 1 38 ASN H H 14.743 -0.902 10.379 1.00 . A A . 38 ASN H 1 1 5 8070 1 1 38 ASN HA H 16.550 -0.316 11.514 1.00 . A A . 38 ASN HA 1 1 5 8071 1 1 38 ASN HB2 H 15.292 2.069 11.763 1.00 . A A . 38 ASN HB2 1 1 5 8072 1 1 38 ASN HB3 H 15.108 1.535 13.422 1.00 . A A . 38 ASN HB3 1 1 5 8073 1 1 38 ASN HD21 H 16.615 3.754 12.540 1.00 . A A . 38 ASN HD21 1 1 5 8074 1 1 38 ASN HD22 H 18.283 3.502 12.935 1.00 . A A . 38 ASN HD22 1 1 5 8075 1 1 38 ASN N N 14.563 -0.226 11.094 1.00 . A A . 38 ASN N 1 1 5 8076 1 1 38 ASN ND2 N 17.370 3.135 12.759 1.00 . A A . 38 ASN ND2 1 1 5 8077 1 1 38 ASN O O 16.254 -1.048 14.141 1.00 . A A . 38 ASN O 1 1 5 8078 1 1 38 ASN OD1 O 18.023 1.003 13.076 1.00 . A A . 38 ASN OD1 1 1 5 8079 1 1 39 GLY C C 12.777 -1.727 15.289 1.00 . A A . 39 GLY C 1 1 5 8080 1 1 39 GLY CA C 13.833 -2.389 14.402 1.00 . A A . 39 GLY CA 1 1 5 8081 1 1 39 GLY H H 13.512 -1.415 12.590 1.00 . A A . 39 GLY H 1 1 5 8082 1 1 39 GLY HA2 H 13.447 -3.331 14.012 1.00 . A A . 39 GLY HA2 1 1 5 8083 1 1 39 GLY HA3 H 14.715 -2.629 14.997 1.00 . A A . 39 GLY HA3 1 1 5 8084 1 1 39 GLY N N 14.208 -1.520 13.300 1.00 . A A . 39 GLY N 1 1 5 8085 1 1 39 GLY O O 12.343 -2.307 16.283 1.00 . A A . 39 GLY O 1 1 5 8086 1 1 40 LYS C C 10.098 0.285 14.838 1.00 . A A . 40 LYS C 1 1 5 8087 1 1 40 LYS CA C 11.397 0.227 15.645 1.00 . A A . 40 LYS CA 1 1 5 8088 1 1 40 LYS CB C 11.941 1.603 16.035 1.00 . A A . 40 LYS CB 1 1 5 8089 1 1 40 LYS CD C 13.163 3.534 14.969 1.00 . A A . 40 LYS CD 1 1 5 8090 1 1 40 LYS CE C 12.795 4.877 14.336 1.00 . A A . 40 LYS CE 1 1 5 8091 1 1 40 LYS CG C 12.021 2.526 14.818 1.00 . A A . 40 LYS CG 1 1 5 8092 1 1 40 LYS H H 12.751 -0.056 14.088 1.00 . A A . 40 LYS H 1 1 5 8093 1 1 40 LYS HA H 11.205 -0.318 16.569 1.00 . A A . 40 LYS HA 1 1 5 8094 1 1 40 LYS HB2 H 11.298 2.050 16.794 1.00 . A A . 40 LYS HB2 1 1 5 8095 1 1 40 LYS HB3 H 12.929 1.494 16.480 1.00 . A A . 40 LYS HB3 1 1 5 8096 1 1 40 LYS HD2 H 13.389 3.676 16.026 1.00 . A A . 40 LYS HD2 1 1 5 8097 1 1 40 LYS HD3 H 14.064 3.141 14.500 1.00 . A A . 40 LYS HD3 1 1 5 8098 1 1 40 LYS HE2 H 13.644 5.265 13.773 1.00 . A A . 40 LYS HE2 1 1 5 8099 1 1 40 LYS HE3 H 11.978 4.740 13.627 1.00 . A A . 40 LYS HE3 1 1 5 8100 1 1 40 LYS HG2 H 12.173 1.932 13.916 1.00 . A A . 40 LYS HG2 1 1 5 8101 1 1 40 LYS HG3 H 11.077 3.056 14.696 1.00 . A A . 40 LYS HG3 1 1 5 8102 1 1 40 LYS HZ1 H 11.599 5.528 15.913 1.00 . A A . 40 LYS HZ1 1 1 5 8103 1 1 40 LYS HZ2 H 13.145 6.023 16.041 1.00 . A A . 40 LYS HZ2 1 1 5 8104 1 1 40 LYS N N 12.394 -0.521 14.898 1.00 . A A . 40 LYS N 1 1 5 8105 1 1 40 LYS NZ N 12.397 5.850 15.378 1.00 . A A . 40 LYS NZ 1 1 5 8106 1 1 40 LYS O O 10.129 0.412 13.615 1.00 . A A . 40 LYS O 1 1 5 8107 1 1 41 GLU C C 6.999 1.572 15.195 1.00 . A A . 41 GLU C 1 1 5 8108 1 1 41 GLU CA C 7.682 0.231 14.921 1.00 . A A . 41 GLU CA 1 1 5 8109 1 1 41 GLU CB C 6.808 -0.934 15.390 1.00 . A A . 41 GLU CB 1 1 5 8110 1 1 41 GLU CD C 6.318 -3.366 14.935 1.00 . A A . 41 GLU CD 1 1 5 8111 1 1 41 GLU CG C 6.731 -2.027 14.321 1.00 . A A . 41 GLU CG 1 1 5 8112 1 1 41 GLU H H 8.972 0.089 16.550 1.00 . A A . 41 GLU H 1 1 5 8113 1 1 41 GLU HA H 7.875 0.125 13.853 1.00 . A A . 41 GLU HA 1 1 5 8114 1 1 41 GLU HB2 H 7.215 -1.351 16.312 1.00 . A A . 41 GLU HB2 1 1 5 8115 1 1 41 GLU HB3 H 5.806 -0.573 15.620 1.00 . A A . 41 GLU HB3 1 1 5 8116 1 1 41 GLU HG2 H 6.013 -1.738 13.553 1.00 . A A . 41 GLU HG2 1 1 5 8117 1 1 41 GLU HG3 H 7.698 -2.130 13.831 1.00 . A A . 41 GLU HG3 1 1 5 8118 1 1 41 GLU N N 8.988 0.191 15.555 1.00 . A A . 41 GLU N 1 1 5 8119 1 1 41 GLU O O 6.979 2.042 16.332 1.00 . A A . 41 GLU O 1 1 5 8120 1 1 41 GLU OE1 O 5.411 -3.341 15.796 1.00 . A A . 41 GLU OE1 1 1 5 8121 1 1 41 GLU OE2 O 6.918 -4.385 14.530 1.00 . A A . 41 GLU OE2 1 1 5 8122 1 1 42 ASP C C 4.680 3.515 13.182 1.00 . A A . 42 ASP C 1 1 5 8123 1 1 42 ASP CA C 5.777 3.431 14.246 1.00 . A A . 42 ASP CA 1 1 5 8124 1 1 42 ASP CB C 6.746 4.593 14.018 1.00 . A A . 42 ASP CB 1 1 5 8125 1 1 42 ASP CG C 6.647 5.727 15.041 1.00 . A A . 42 ASP CG 1 1 5 8126 1 1 42 ASP H H 6.478 1.764 13.213 1.00 . A A . 42 ASP H 1 1 5 8127 1 1 42 ASP HA H 5.377 3.455 15.260 1.00 . A A . 42 ASP HA 1 1 5 8128 1 1 42 ASP HB2 H 7.764 4.204 14.027 1.00 . A A . 42 ASP HB2 1 1 5 8129 1 1 42 ASP HB3 H 6.570 5.004 13.024 1.00 . A A . 42 ASP HB3 1 1 5 8130 1 1 42 ASP N N 6.458 2.152 14.134 1.00 . A A . 42 ASP N 1 1 5 8131 1 1 42 ASP O O 4.600 2.662 12.299 1.00 . A A . 42 ASP O 1 1 5 8132 1 1 42 ASP OD1 O 5.674 5.701 15.825 1.00 . A A . 42 ASP OD1 1 1 5 8133 1 1 42 ASP OD2 O 7.547 6.594 15.015 1.00 . A A . 42 ASP OD2 1 1 5 8134 1 1 43 TYR C C 2.979 6.042 11.559 1.00 . A A . 43 TYR C 1 1 5 8135 1 1 43 TYR CA C 2.773 4.756 12.362 1.00 . A A . 43 TYR CA 1 1 5 8136 1 1 43 TYR CB C 1.506 4.894 13.208 1.00 . A A . 43 TYR CB 1 1 5 8137 1 1 43 TYR CD1 C 1.742 2.448 13.770 1.00 . A A . 43 TYR CD1 1 1 5 8138 1 1 43 TYR CD2 C 0.423 3.821 15.216 1.00 . A A . 43 TYR CD2 1 1 5 8139 1 1 43 TYR CE1 C 1.467 1.306 14.603 1.00 . A A . 43 TYR CE1 1 1 5 8140 1 1 43 TYR CE2 C 0.148 2.679 16.049 1.00 . A A . 43 TYR CE2 1 1 5 8141 1 1 43 TYR CG C 1.214 3.681 14.093 1.00 . A A . 43 TYR CG 1 1 5 8142 1 1 43 TYR CZ C 0.684 1.478 15.702 1.00 . A A . 43 TYR CZ 1 1 5 8143 1 1 43 TYR H H 3.934 5.240 14.023 1.00 . A A . 43 TYR H 1 1 5 8144 1 1 43 TYR HA H 2.755 3.908 11.677 1.00 . A A . 43 TYR HA 1 1 5 8145 1 1 43 TYR HB2 H 1.597 5.779 13.839 1.00 . A A . 43 TYR HB2 1 1 5 8146 1 1 43 TYR HB3 H 0.656 5.061 12.546 1.00 . A A . 43 TYR HB3 1 1 5 8147 1 1 43 TYR HD1 H 2.366 2.338 12.883 1.00 . A A . 43 TYR HD1 1 1 5 8148 1 1 43 TYR HD2 H 0.007 4.795 15.471 1.00 . A A . 43 TYR HD2 1 1 5 8149 1 1 43 TYR HE1 H 1.877 0.326 14.359 1.00 . A A . 43 TYR HE1 1 1 5 8150 1 1 43 TYR HE2 H -0.475 2.775 16.938 1.00 . A A . 43 TYR HE2 1 1 5 8151 1 1 43 TYR HH H 0.834 0.529 17.392 1.00 . A A . 43 TYR HH 1 1 5 8152 1 1 43 TYR N N 3.862 4.550 13.302 1.00 . A A . 43 TYR N 1 1 5 8153 1 1 43 TYR O O 2.495 7.105 11.947 1.00 . A A . 43 TYR O 1 1 5 8154 1 1 43 TYR OH O 0.424 0.400 16.489 1.00 . A A . 43 TYR OH 1 1 5 8155 1 1 44 ARG C C 3.452 6.775 8.178 1.00 . A A . 44 ARG C 1 1 5 8156 1 1 44 ARG CA C 3.971 7.041 9.592 1.00 . A A . 44 ARG CA 1 1 5 8157 1 1 44 ARG CB C 5.471 7.335 9.530 1.00 . A A . 44 ARG CB 1 1 5 8158 1 1 44 ARG CD C 7.268 8.862 10.424 1.00 . A A . 44 ARG CD 1 1 5 8159 1 1 44 ARG CG C 5.782 8.725 10.088 1.00 . A A . 44 ARG CG 1 1 5 8160 1 1 44 ARG CZ C 7.893 11.245 10.000 1.00 . A A . 44 ARG CZ 1 1 5 8161 1 1 44 ARG H H 4.085 5.036 10.144 1.00 . A A . 44 ARG H 1 1 5 8162 1 1 44 ARG HA H 3.442 7.875 10.054 1.00 . A A . 44 ARG HA 1 1 5 8163 1 1 44 ARG HB2 H 6.017 6.581 10.098 1.00 . A A . 44 ARG HB2 1 1 5 8164 1 1 44 ARG HB3 H 5.816 7.268 8.498 1.00 . A A . 44 ARG HB3 1 1 5 8165 1 1 44 ARG HD2 H 7.391 9.071 11.487 1.00 . A A . 44 ARG HD2 1 1 5 8166 1 1 44 ARG HD3 H 7.783 7.922 10.223 1.00 . A A . 44 ARG HD3 1 1 5 8167 1 1 44 ARG HE H 8.287 9.710 8.745 1.00 . A A . 44 ARG HE 1 1 5 8168 1 1 44 ARG HG2 H 5.499 9.485 9.359 1.00 . A A . 44 ARG HG2 1 1 5 8169 1 1 44 ARG HG3 H 5.185 8.904 10.983 1.00 . A A . 44 ARG HG3 1 1 5 8170 1 1 44 ARG HH11 H 6.920 10.947 11.771 1.00 . A A . 44 ARG HH11 1 1 5 8171 1 1 44 ARG HH12 H 7.367 12.588 11.446 1.00 . A A . 44 ARG HH12 1 1 5 8172 1 1 44 ARG HH21 H 8.517 13.111 9.410 1.00 . A A . 44 ARG HH21 1 1 5 8173 1 1 44 ARG N N 3.696 5.904 10.453 1.00 . A A . 44 ARG N 1 1 5 8174 1 1 44 ARG NE N 7.871 9.950 9.622 1.00 . A A . 44 ARG NE 1 1 5 8175 1 1 44 ARG NH1 N 7.346 11.627 11.174 1.00 . A A . 44 ARG NH1 1 1 5 8176 1 1 44 ARG NH2 N 8.458 12.134 9.204 1.00 . A A . 44 ARG NH2 1 1 5 8177 1 1 44 ARG O O 2.984 5.676 7.881 1.00 . A A . 44 ARG O 1 1 5 8178 1 1 45 LYS C C 4.190 7.029 5.124 1.00 . A A . 45 LYS C 1 1 5 8179 1 1 45 LYS CA C 3.096 7.688 5.967 1.00 . A A . 45 LYS CA 1 1 5 8180 1 1 45 LYS CB C 2.653 9.054 5.439 1.00 . A A . 45 LYS CB 1 1 5 8181 1 1 45 LYS CD C 1.767 10.254 7.472 1.00 . A A . 45 LYS CD 1 1 5 8182 1 1 45 LYS CE C 0.554 10.973 8.066 1.00 . A A . 45 LYS CE 1 1 5 8183 1 1 45 LYS CG C 1.400 9.544 6.168 1.00 . A A . 45 LYS CG 1 1 5 8184 1 1 45 LYS H H 3.932 8.689 7.592 1.00 . A A . 45 LYS H 1 1 5 8185 1 1 45 LYS HA H 2.219 7.041 5.964 1.00 . A A . 45 LYS HA 1 1 5 8186 1 1 45 LYS HB2 H 3.458 9.777 5.566 1.00 . A A . 45 LYS HB2 1 1 5 8187 1 1 45 LYS HB3 H 2.452 8.987 4.369 1.00 . A A . 45 LYS HB3 1 1 5 8188 1 1 45 LYS HD2 H 2.151 9.529 8.190 1.00 . A A . 45 LYS HD2 1 1 5 8189 1 1 45 LYS HD3 H 2.565 10.973 7.287 1.00 . A A . 45 LYS HD3 1 1 5 8190 1 1 45 LYS HE2 H -0.205 11.113 7.296 1.00 . A A . 45 LYS HE2 1 1 5 8191 1 1 45 LYS HE3 H 0.106 10.359 8.847 1.00 . A A . 45 LYS HE3 1 1 5 8192 1 1 45 LYS HG2 H 0.842 10.224 5.524 1.00 . A A . 45 LYS HG2 1 1 5 8193 1 1 45 LYS HG3 H 0.746 8.699 6.381 1.00 . A A . 45 LYS HG3 1 1 5 8194 1 1 45 LYS HZ1 H 1.729 12.203 9.269 1.00 . A A . 45 LYS HZ1 1 1 5 8195 1 1 45 LYS HZ2 H 1.235 12.935 7.900 1.00 . A A . 45 LYS HZ2 1 1 5 8196 1 1 45 LYS N N 3.551 7.798 7.343 1.00 . A A . 45 LYS N 1 1 5 8197 1 1 45 LYS NZ N 0.951 12.285 8.624 1.00 . A A . 45 LYS NZ 1 1 5 8198 1 1 45 LYS O O 5.363 7.380 5.239 1.00 . A A . 45 LYS O 1 1 5 8199 1 1 46 CYS C C 5.408 6.394 2.549 1.00 . A A . 46 CYS C 1 1 5 8200 1 1 46 CYS CA C 4.694 5.372 3.436 1.00 . A A . 46 CYS CA 1 1 5 8201 1 1 46 CYS CB C 3.987 4.295 2.610 1.00 . A A . 46 CYS CB 1 1 5 8202 1 1 46 CYS H H 2.809 5.805 4.210 1.00 . A A . 46 CYS H 1 1 5 8203 1 1 46 CYS HA H 5.403 4.866 4.091 1.00 . A A . 46 CYS HA 1 1 5 8204 1 1 46 CYS HB2 H 3.569 4.758 1.717 1.00 . A A . 46 CYS HB2 1 1 5 8205 1 1 46 CYS HB3 H 4.728 3.569 2.276 1.00 . A A . 46 CYS HB3 1 1 5 8206 1 1 46 CYS N N 3.766 6.084 4.297 1.00 . A A . 46 CYS N 1 1 5 8207 1 1 46 CYS O O 6.634 6.385 2.449 1.00 . A A . 46 CYS O 1 1 5 8208 1 1 46 CYS SG S 2.651 3.407 3.490 1.00 . A A . 46 CYS SG 1 1 5 8209 1 1 47 GLY C C 5.734 9.437 1.863 1.00 . A A . 47 GLY C 1 1 5 8210 1 1 47 GLY CA C 5.151 8.277 1.054 1.00 . A A . 47 GLY CA 1 1 5 8211 1 1 47 GLY H H 3.614 7.251 2.016 1.00 . A A . 47 GLY H 1 1 5 8212 1 1 47 GLY HA2 H 5.925 7.847 0.418 1.00 . A A . 47 GLY HA2 1 1 5 8213 1 1 47 GLY HA3 H 4.366 8.647 0.394 1.00 . A A . 47 GLY HA3 1 1 5 8214 1 1 47 GLY N N 4.610 7.251 1.929 1.00 . A A . 47 GLY N 1 1 5 8215 1 1 47 GLY O O 5.398 10.596 1.625 1.00 . A A . 47 GLY O 1 1 5 8216 1 1 48 THR C C 8.603 10.461 3.093 1.00 . A A . 48 THR C 1 1 5 8217 1 1 48 THR CA C 7.230 10.082 3.651 1.00 . A A . 48 THR CA 1 1 5 8218 1 1 48 THR CB C 7.285 9.526 5.075 1.00 . A A . 48 THR CB 1 1 5 8219 1 1 48 THR CG2 C 8.377 10.186 5.919 1.00 . A A . 48 THR CG2 1 1 5 8220 1 1 48 THR H H 6.865 8.139 2.992 1.00 . A A . 48 THR H 1 1 5 8221 1 1 48 THR HA H 6.618 10.983 3.636 1.00 . A A . 48 THR HA 1 1 5 8222 1 1 48 THR HB H 7.402 8.442 5.066 1.00 . A A . 48 THR HB 1 1 5 8223 1 1 48 THR HG1 H 6.080 9.786 6.652 1.00 . A A . 48 THR HG1 1 1 5 8224 1 1 48 THR HG21 H 8.713 11.100 5.429 1.00 . A A . 48 THR HG21 1 1 5 8225 1 1 48 THR HG22 H 7.979 10.428 6.905 1.00 . A A . 48 THR HG22 1 1 5 8226 1 1 48 THR HG23 H 9.218 9.500 6.026 1.00 . A A . 48 THR HG23 1 1 5 8227 1 1 48 THR N N 6.597 9.084 2.804 1.00 . A A . 48 THR N 1 1 5 8228 1 1 48 THR O O 9.403 9.589 2.758 1.00 . A A . 48 THR O 1 1 5 8229 1 1 48 THR OG1 O 6.070 9.973 5.670 1.00 . A A . 48 THR OG1 1 1 5 8230 1 1 49 ALA C C 11.247 11.657 3.299 1.00 . A A . 49 ALA C 1 1 5 8231 1 1 49 ALA CA C 10.096 12.269 2.499 1.00 . A A . 49 ALA CA 1 1 5 8232 1 1 49 ALA CB C 10.094 13.798 2.555 1.00 . A A . 49 ALA CB 1 1 5 8233 1 1 49 ALA H H 8.177 12.466 3.286 1.00 . A A . 49 ALA H 1 1 5 8234 1 1 49 ALA HA H 10.181 11.956 1.458 1.00 . A A . 49 ALA HA 1 1 5 8235 1 1 49 ALA HB1 H 9.632 14.127 3.487 1.00 . A A . 49 ALA HB1 1 1 5 8236 1 1 49 ALA HB2 H 11.119 14.164 2.508 1.00 . A A . 49 ALA HB2 1 1 5 8237 1 1 49 ALA HB3 H 9.528 14.192 1.711 1.00 . A A . 49 ALA HB3 1 1 5 8238 1 1 49 ALA N N 8.833 11.763 3.011 1.00 . A A . 49 ALA N 1 1 5 8239 1 1 49 ALA O O 11.458 12.010 4.458 1.00 . A A . 49 ALA O 1 1 5 8240 1 1 50 GLY C C 12.863 8.575 3.355 1.00 . A A . 50 GLY C 1 1 5 8241 1 1 50 GLY CA C 13.087 10.087 3.285 1.00 . A A . 50 GLY CA 1 1 5 8242 1 1 50 GLY H H 11.784 10.470 1.705 1.00 . A A . 50 GLY H 1 1 5 8243 1 1 50 GLY HA2 H 14.000 10.298 2.729 1.00 . A A . 50 GLY HA2 1 1 5 8244 1 1 50 GLY HA3 H 13.227 10.484 4.291 1.00 . A A . 50 GLY HA3 1 1 5 8245 1 1 50 GLY N N 11.962 10.751 2.648 1.00 . A A . 50 GLY N 1 1 5 8246 1 1 50 GLY O O 13.795 7.818 3.618 1.00 . A A . 50 GLY O 1 1 5 8247 1 1 51 CYS C C 11.061 6.296 1.706 1.00 . A A . 51 CYS C 1 1 5 8248 1 1 51 CYS CA C 11.263 6.774 3.145 1.00 . A A . 51 CYS CA 1 1 5 8249 1 1 51 CYS CB C 10.024 6.525 4.009 1.00 . A A . 51 CYS CB 1 1 5 8250 1 1 51 CYS H H 10.869 8.804 2.899 1.00 . A A . 51 CYS H 1 1 5 8251 1 1 51 CYS HA H 12.096 6.249 3.614 1.00 . A A . 51 CYS HA 1 1 5 8252 1 1 51 CYS HB2 H 9.204 7.161 3.675 1.00 . A A . 51 CYS HB2 1 1 5 8253 1 1 51 CYS HB3 H 9.693 5.493 3.895 1.00 . A A . 51 CYS HB3 1 1 5 8254 1 1 51 CYS N N 11.621 8.182 3.113 1.00 . A A . 51 CYS N 1 1 5 8255 1 1 51 CYS O O 12.014 5.891 1.043 1.00 . A A . 51 CYS O 1 1 5 8256 1 1 51 CYS SG S 10.406 6.868 5.765 1.00 . A A . 51 CYS SG 1 1 5 8257 1 1 52 HIS C C 9.203 7.169 -0.953 1.00 . A A . 52 HIS C 1 1 5 8258 1 1 52 HIS CA C 9.474 5.939 -0.084 1.00 . A A . 52 HIS CA 1 1 5 8259 1 1 52 HIS CB C 8.302 4.956 -0.067 1.00 . A A . 52 HIS CB 1 1 5 8260 1 1 52 HIS CD2 C 8.208 3.075 1.745 1.00 . A A . 52 HIS CD2 1 1 5 8261 1 1 52 HIS CE1 C 9.554 1.645 0.780 1.00 . A A . 52 HIS CE1 1 1 5 8262 1 1 52 HIS CG C 8.626 3.625 0.569 1.00 . A A . 52 HIS CG 1 1 5 8263 1 1 52 HIS H H 9.043 6.692 1.810 1.00 . A A . 52 HIS H 1 1 5 8264 1 1 52 HIS HA H 10.344 5.413 -0.475 1.00 . A A . 52 HIS HA 1 1 5 8265 1 1 52 HIS HB2 H 7.468 5.410 0.468 1.00 . A A . 52 HIS HB2 1 1 5 8266 1 1 52 HIS HB3 H 7.969 4.786 -1.091 1.00 . A A . 52 HIS HB3 1 1 5 8267 1 1 52 HIS HD1 H 9.945 2.811 -0.891 1.00 . A A . 52 HIS HD1 1 1 5 8268 1 1 52 HIS HD2 H 7.529 3.539 2.460 1.00 . A A . 52 HIS HD2 1 1 5 8269 1 1 52 HIS HE1 H 10.144 0.747 0.596 1.00 . A A . 52 HIS HE1 1 1 5 8270 1 1 52 HIS N N 9.813 6.360 1.265 1.00 . A A . 52 HIS N 1 1 5 8271 1 1 52 HIS ND1 N 9.473 2.701 -0.016 1.00 . A A . 52 HIS ND1 1 1 5 8272 1 1 52 HIS NE2 N 8.769 1.878 1.871 1.00 . A A . 52 HIS NE2 1 1 5 8273 1 1 52 HIS O O 8.066 7.412 -1.355 1.00 . A A . 52 HIS O 1 1 5 8274 1 1 53 ASP C C 11.230 9.081 -3.122 1.00 . A A . 53 ASP C 1 1 5 8275 1 1 53 ASP CA C 10.159 9.112 -2.030 1.00 . A A . 53 ASP CA 1 1 5 8276 1 1 53 ASP CB C 10.378 10.371 -1.188 1.00 . A A . 53 ASP CB 1 1 5 8277 1 1 53 ASP CG C 9.643 11.617 -1.684 1.00 . A A . 53 ASP CG 1 1 5 8278 1 1 53 ASP H H 11.189 7.709 -0.886 1.00 . A A . 53 ASP H 1 1 5 8279 1 1 53 ASP HA H 9.148 9.092 -2.437 1.00 . A A . 53 ASP HA 1 1 5 8280 1 1 53 ASP HB2 H 10.064 10.165 -0.165 1.00 . A A . 53 ASP HB2 1 1 5 8281 1 1 53 ASP HB3 H 11.446 10.586 -1.156 1.00 . A A . 53 ASP HB3 1 1 5 8282 1 1 53 ASP N N 10.267 7.913 -1.217 1.00 . A A . 53 ASP N 1 1 5 8283 1 1 53 ASP O O 12.237 9.782 -3.030 1.00 . A A . 53 ASP O 1 1 5 8284 1 1 53 ASP OD1 O 8.400 11.536 -1.796 1.00 . A A . 53 ASP OD1 1 1 5 8285 1 1 53 ASP OD2 O 10.339 12.623 -1.941 1.00 . A A . 53 ASP OD2 1 1 5 8286 1 1 54 SER C C 11.301 8.733 -6.507 1.00 . A A . 54 SER C 1 1 5 8287 1 1 54 SER CA C 11.908 8.129 -5.240 1.00 . A A . 54 SER CA 1 1 5 8288 1 1 54 SER CB C 12.279 6.663 -5.475 1.00 . A A . 54 SER CB 1 1 5 8289 1 1 54 SER H H 10.156 7.694 -4.199 1.00 . A A . 54 SER H 1 1 5 8290 1 1 54 SER HA H 12.796 8.684 -4.938 1.00 . A A . 54 SER HA 1 1 5 8291 1 1 54 SER HB2 H 12.540 6.198 -4.525 1.00 . A A . 54 SER HB2 1 1 5 8292 1 1 54 SER HB3 H 11.413 6.128 -5.865 1.00 . A A . 54 SER HB3 1 1 5 8293 1 1 54 SER HG H 13.290 7.205 -7.116 1.00 . A A . 54 SER HG 1 1 5 8294 1 1 54 SER N N 10.978 8.261 -4.131 1.00 . A A . 54 SER N 1 1 5 8295 1 1 54 SER O O 12.026 9.132 -7.417 1.00 . A A . 54 SER O 1 1 5 8296 1 1 54 SER OG O 13.369 6.528 -6.384 1.00 . A A . 54 SER OG 1 1 5 8297 1 1 55 MET C C 9.758 8.706 -8.974 1.00 . A A . 55 MET C 1 1 5 8298 1 1 55 MET CA C 9.265 9.331 -7.668 1.00 . A A . 55 MET CA 1 1 5 8299 1 1 55 MET CB C 9.470 10.846 -7.717 1.00 . A A . 55 MET CB 1 1 5 8300 1 1 55 MET CE C 7.351 10.262 -4.943 1.00 . A A . 55 MET CE 1 1 5 8301 1 1 55 MET CG C 8.248 11.583 -7.163 1.00 . A A . 55 MET CG 1 1 5 8302 1 1 55 MET H H 9.395 8.455 -5.782 1.00 . A A . 55 MET H 1 1 5 8303 1 1 55 MET HA H 8.217 9.077 -7.508 1.00 . A A . 55 MET HA 1 1 5 8304 1 1 55 MET HB2 H 10.354 11.116 -7.140 1.00 . A A . 55 MET HB2 1 1 5 8305 1 1 55 MET HB3 H 9.652 11.159 -8.745 1.00 . A A . 55 MET HB3 1 1 5 8306 1 1 55 MET HE1 H 7.696 9.388 -5.495 1.00 . A A . 55 MET HE1 1 1 5 8307 1 1 55 MET HE2 H 7.440 10.074 -3.873 1.00 . A A . 55 MET HE2 1 1 5 8308 1 1 55 MET HE3 H 6.308 10.460 -5.191 1.00 . A A . 55 MET HE3 1 1 5 8309 1 1 55 MET HG2 H 8.196 12.586 -7.586 1.00 . A A . 55 MET HG2 1 1 5 8310 1 1 55 MET HG3 H 7.336 11.064 -7.458 1.00 . A A . 55 MET HG3 1 1 5 8311 1 1 55 MET N N 9.977 8.782 -6.526 1.00 . A A . 55 MET N 1 1 5 8312 1 1 55 MET O O 9.832 9.380 -10.000 1.00 . A A . 55 MET O 1 1 5 8313 1 1 55 MET SD S 8.347 11.677 -5.384 1.00 . A A . 55 MET SD 1 1 5 8314 1 1 56 ASP C C 9.853 5.351 -10.148 1.00 . A A . 56 ASP C 1 1 5 8315 1 1 56 ASP CA C 10.568 6.700 -10.057 1.00 . A A . 56 ASP CA 1 1 5 8316 1 1 56 ASP CB C 12.071 6.433 -9.952 1.00 . A A . 56 ASP CB 1 1 5 8317 1 1 56 ASP CG C 12.903 6.945 -11.130 1.00 . A A . 56 ASP CG 1 1 5 8318 1 1 56 ASP H H 10.020 6.882 -8.056 1.00 . A A . 56 ASP H 1 1 5 8319 1 1 56 ASP HA H 10.350 7.346 -10.908 1.00 . A A . 56 ASP HA 1 1 5 8320 1 1 56 ASP HB2 H 12.443 6.892 -9.037 1.00 . A A . 56 ASP HB2 1 1 5 8321 1 1 56 ASP HB3 H 12.227 5.358 -9.857 1.00 . A A . 56 ASP HB3 1 1 5 8322 1 1 56 ASP N N 10.083 7.424 -8.894 1.00 . A A . 56 ASP N 1 1 5 8323 1 1 56 ASP O O 10.259 4.384 -9.505 1.00 . A A . 56 ASP O 1 1 5 8324 1 1 56 ASP OD1 O 12.770 6.349 -12.220 1.00 . A A . 56 ASP OD1 1 1 5 8325 1 1 56 ASP OD2 O 13.652 7.922 -10.913 1.00 . A A . 56 ASP OD2 1 1 5 8326 1 1 57 LYS C C 8.910 3.037 -11.762 1.00 . A A . 57 LYS C 1 1 5 8327 1 1 57 LYS CA C 8.023 4.114 -11.134 1.00 . A A . 57 LYS CA 1 1 5 8328 1 1 57 LYS CB C 6.751 4.406 -11.932 1.00 . A A . 57 LYS CB 1 1 5 8329 1 1 57 LYS CD C 6.261 2.936 -13.922 1.00 . A A . 57 LYS CD 1 1 5 8330 1 1 57 LYS CE C 7.011 1.643 -14.246 1.00 . A A . 57 LYS CE 1 1 5 8331 1 1 57 LYS CG C 6.095 3.109 -12.411 1.00 . A A . 57 LYS CG 1 1 5 8332 1 1 57 LYS H H 8.475 6.119 -11.470 1.00 . A A . 57 LYS H 1 1 5 8333 1 1 57 LYS HA H 7.713 3.773 -10.146 1.00 . A A . 57 LYS HA 1 1 5 8334 1 1 57 LYS HB2 H 6.049 4.966 -11.314 1.00 . A A . 57 LYS HB2 1 1 5 8335 1 1 57 LYS HB3 H 6.992 5.034 -12.790 1.00 . A A . 57 LYS HB3 1 1 5 8336 1 1 57 LYS HD2 H 5.281 2.922 -14.400 1.00 . A A . 57 LYS HD2 1 1 5 8337 1 1 57 LYS HD3 H 6.803 3.788 -14.332 1.00 . A A . 57 LYS HD3 1 1 5 8338 1 1 57 LYS HE2 H 8.035 1.874 -14.540 1.00 . A A . 57 LYS HE2 1 1 5 8339 1 1 57 LYS HE3 H 7.069 1.016 -13.357 1.00 . A A . 57 LYS HE3 1 1 5 8340 1 1 57 LYS HG2 H 6.539 2.260 -11.893 1.00 . A A . 57 LYS HG2 1 1 5 8341 1 1 57 LYS HG3 H 5.035 3.119 -12.157 1.00 . A A . 57 LYS HG3 1 1 5 8342 1 1 57 LYS HZ1 H 5.811 0.109 -14.988 1.00 . A A . 57 LYS HZ1 1 1 5 8343 1 1 57 LYS HZ2 H 5.669 1.493 -15.834 1.00 . A A . 57 LYS HZ2 1 1 5 8344 1 1 57 LYS N N 8.799 5.329 -10.951 1.00 . A A . 57 LYS N 1 1 5 8345 1 1 57 LYS NZ N 6.330 0.908 -15.335 1.00 . A A . 57 LYS NZ 1 1 5 8346 1 1 57 LYS O O 8.891 1.884 -11.333 1.00 . A A . 57 LYS O 1 1 5 8347 1 1 58 LYS C C 11.846 2.375 -12.650 1.00 . A A . 58 LYS C 1 1 5 8348 1 1 58 LYS CA C 10.558 2.536 -13.460 1.00 . A A . 58 LYS CA 1 1 5 8349 1 1 58 LYS CB C 10.790 3.000 -14.899 1.00 . A A . 58 LYS CB 1 1 5 8350 1 1 58 LYS CD C 9.377 1.954 -16.707 1.00 . A A . 58 LYS CD 1 1 5 8351 1 1 58 LYS CE C 9.693 2.358 -18.149 1.00 . A A . 58 LYS CE 1 1 5 8352 1 1 58 LYS CG C 10.658 1.832 -15.880 1.00 . A A . 58 LYS CG 1 1 5 8353 1 1 58 LYS H H 9.675 4.390 -13.111 1.00 . A A . 58 LYS H 1 1 5 8354 1 1 58 LYS HA H 10.058 1.568 -13.510 1.00 . A A . 58 LYS HA 1 1 5 8355 1 1 58 LYS HB2 H 10.071 3.778 -15.156 1.00 . A A . 58 LYS HB2 1 1 5 8356 1 1 58 LYS HB3 H 11.782 3.443 -14.986 1.00 . A A . 58 LYS HB3 1 1 5 8357 1 1 58 LYS HD2 H 8.845 1.003 -16.701 1.00 . A A . 58 LYS HD2 1 1 5 8358 1 1 58 LYS HD3 H 8.716 2.693 -16.255 1.00 . A A . 58 LYS HD3 1 1 5 8359 1 1 58 LYS HE2 H 8.959 3.085 -18.498 1.00 . A A . 58 LYS HE2 1 1 5 8360 1 1 58 LYS HE3 H 10.668 2.844 -18.192 1.00 . A A . 58 LYS HE3 1 1 5 8361 1 1 58 LYS HG2 H 11.523 1.810 -16.542 1.00 . A A . 58 LYS HG2 1 1 5 8362 1 1 58 LYS HG3 H 10.653 0.891 -15.331 1.00 . A A . 58 LYS HG3 1 1 5 8363 1 1 58 LYS HZ1 H 9.948 0.327 -18.539 1.00 . A A . 58 LYS HZ1 1 1 5 8364 1 1 58 LYS HZ2 H 8.767 1.003 -19.434 1.00 . A A . 58 LYS HZ2 1 1 5 8365 1 1 58 LYS N N 9.666 3.451 -12.768 1.00 . A A . 58 LYS N 1 1 5 8366 1 1 58 LYS NZ N 9.684 1.172 -19.034 1.00 . A A . 58 LYS NZ 1 1 5 8367 1 1 58 LYS O O 12.941 2.575 -13.172 1.00 . A A . 58 LYS O 1 1 5 8368 1 1 59 ASP C C 12.387 0.942 -9.323 1.00 . A A . 59 ASP C 1 1 5 8369 1 1 59 ASP CA C 12.806 1.828 -10.499 1.00 . A A . 59 ASP CA 1 1 5 8370 1 1 59 ASP CB C 13.292 3.164 -9.934 1.00 . A A . 59 ASP CB 1 1 5 8371 1 1 59 ASP CG C 14.676 3.126 -9.283 1.00 . A A . 59 ASP CG 1 1 5 8372 1 1 59 ASP H H 10.777 1.856 -10.969 1.00 . A A . 59 ASP H 1 1 5 8373 1 1 59 ASP HA H 13.578 1.366 -11.114 1.00 . A A . 59 ASP HA 1 1 5 8374 1 1 59 ASP HB2 H 13.306 3.898 -10.740 1.00 . A A . 59 ASP HB2 1 1 5 8375 1 1 59 ASP HB3 H 12.570 3.514 -9.196 1.00 . A A . 59 ASP HB3 1 1 5 8376 1 1 59 ASP N N 11.671 2.017 -11.386 1.00 . A A . 59 ASP N 1 1 5 8377 1 1 59 ASP O O 11.875 1.437 -8.320 1.00 . A A . 59 ASP O 1 1 5 8378 1 1 59 ASP OD1 O 14.725 2.834 -8.069 1.00 . A A . 59 ASP OD1 1 1 5 8379 1 1 59 ASP OD2 O 15.655 3.390 -10.015 1.00 . A A . 59 ASP OD2 1 1 5 8380 1 1 60 LYS C C 13.484 -1.539 -7.546 1.00 . A A . 60 LYS C 1 1 5 8381 1 1 60 LYS CA C 12.272 -1.311 -8.452 1.00 . A A . 60 LYS CA 1 1 5 8382 1 1 60 LYS CB C 11.719 -2.595 -9.074 1.00 . A A . 60 LYS CB 1 1 5 8383 1 1 60 LYS CD C 10.642 -2.006 -11.277 1.00 . A A . 60 LYS CD 1 1 5 8384 1 1 60 LYS CE C 10.832 -3.287 -12.093 1.00 . A A . 60 LYS CE 1 1 5 8385 1 1 60 LYS CG C 10.400 -2.327 -9.801 1.00 . A A . 60 LYS CG 1 1 5 8386 1 1 60 LYS H H 13.036 -0.746 -10.305 1.00 . A A . 60 LYS H 1 1 5 8387 1 1 60 LYS HA H 11.472 -0.872 -7.855 1.00 . A A . 60 LYS HA 1 1 5 8388 1 1 60 LYS HB2 H 12.447 -3.007 -9.774 1.00 . A A . 60 LYS HB2 1 1 5 8389 1 1 60 LYS HB3 H 11.566 -3.343 -8.297 1.00 . A A . 60 LYS HB3 1 1 5 8390 1 1 60 LYS HD2 H 9.800 -1.440 -11.673 1.00 . A A . 60 LYS HD2 1 1 5 8391 1 1 60 LYS HD3 H 11.525 -1.375 -11.376 1.00 . A A . 60 LYS HD3 1 1 5 8392 1 1 60 LYS HE2 H 11.272 -4.062 -11.467 1.00 . A A . 60 LYS HE2 1 1 5 8393 1 1 60 LYS HE3 H 9.863 -3.658 -12.427 1.00 . A A . 60 LYS HE3 1 1 5 8394 1 1 60 LYS HG2 H 9.751 -3.199 -9.717 1.00 . A A . 60 LYS HG2 1 1 5 8395 1 1 60 LYS HG3 H 9.880 -1.496 -9.325 1.00 . A A . 60 LYS HG3 1 1 5 8396 1 1 60 LYS HZ1 H 12.393 -2.315 -13.073 1.00 . A A . 60 LYS HZ1 1 1 5 8397 1 1 60 LYS HZ2 H 12.211 -3.862 -13.545 1.00 . A A . 60 LYS HZ2 1 1 5 8398 1 1 60 LYS N N 12.620 -0.352 -9.486 1.00 . A A . 60 LYS N 1 1 5 8399 1 1 60 LYS NZ N 11.702 -3.032 -13.263 1.00 . A A . 60 LYS NZ 1 1 5 8400 1 1 60 LYS O O 14.604 -1.693 -8.030 1.00 . A A . 60 LYS O 1 1 5 8401 1 1 61 SER C C 13.696 -1.689 -3.855 1.00 . A A . 61 SER C 1 1 5 8402 1 1 61 SER CA C 14.273 -1.760 -5.270 1.00 . A A . 61 SER CA 1 1 5 8403 1 1 61 SER CB C 15.391 -0.729 -5.440 1.00 . A A . 61 SER CB 1 1 5 8404 1 1 61 SER H H 12.304 -1.428 -5.863 1.00 . A A . 61 SER H 1 1 5 8405 1 1 61 SER HA H 14.665 -2.756 -5.475 1.00 . A A . 61 SER HA 1 1 5 8406 1 1 61 SER HB2 H 16.136 -0.870 -4.658 1.00 . A A . 61 SER HB2 1 1 5 8407 1 1 61 SER HB3 H 15.894 -0.893 -6.393 1.00 . A A . 61 SER HB3 1 1 5 8408 1 1 61 SER HG H 15.369 1.119 -4.671 1.00 . A A . 61 SER HG 1 1 5 8409 1 1 61 SER N N 13.218 -1.554 -6.248 1.00 . A A . 61 SER N 1 1 5 8410 1 1 61 SER O O 13.660 -2.693 -3.145 1.00 . A A . 61 SER O 1 1 5 8411 1 1 61 SER OG O 14.897 0.607 -5.389 1.00 . A A . 61 SER OG 1 1 5 8412 1 1 62 ALA C C 12.212 1.171 -2.055 1.00 . A A . 62 ALA C 1 1 5 8413 1 1 62 ALA CA C 12.687 -0.278 -2.170 1.00 . A A . 62 ALA CA 1 1 5 8414 1 1 62 ALA CB C 13.719 -0.640 -1.099 1.00 . A A . 62 ALA CB 1 1 5 8415 1 1 62 ALA H H 13.293 0.318 -4.071 1.00 . A A . 62 ALA H 1 1 5 8416 1 1 62 ALA HA H 11.829 -0.943 -2.069 1.00 . A A . 62 ALA HA 1 1 5 8417 1 1 62 ALA HB1 H 14.326 -1.476 -1.447 1.00 . A A . 62 ALA HB1 1 1 5 8418 1 1 62 ALA HB2 H 14.360 0.220 -0.908 1.00 . A A . 62 ALA HB2 1 1 5 8419 1 1 62 ALA HB3 H 13.205 -0.922 -0.180 1.00 . A A . 62 ALA HB3 1 1 5 8420 1 1 62 ALA N N 13.260 -0.493 -3.487 1.00 . A A . 62 ALA N 1 1 5 8421 1 1 62 ALA O O 11.124 1.433 -1.544 1.00 . A A . 62 ALA O 1 1 5 8422 1 1 63 LYS C C 11.603 3.785 -3.490 1.00 . A A . 63 LYS C 1 1 5 8423 1 1 63 LYS CA C 12.729 3.492 -2.497 1.00 . A A . 63 LYS CA 1 1 5 8424 1 1 63 LYS CB C 13.986 4.333 -2.728 1.00 . A A . 63 LYS CB 1 1 5 8425 1 1 63 LYS CD C 16.101 4.127 -4.087 1.00 . A A . 63 LYS CD 1 1 5 8426 1 1 63 LYS CE C 16.603 5.564 -4.234 1.00 . A A . 63 LYS CE 1 1 5 8427 1 1 63 LYS CG C 14.572 4.075 -4.118 1.00 . A A . 63 LYS CG 1 1 5 8428 1 1 63 LYS H H 13.933 1.854 -2.954 1.00 . A A . 63 LYS H 1 1 5 8429 1 1 63 LYS HA H 12.371 3.716 -1.493 1.00 . A A . 63 LYS HA 1 1 5 8430 1 1 63 LYS HB2 H 13.745 5.391 -2.622 1.00 . A A . 63 LYS HB2 1 1 5 8431 1 1 63 LYS HB3 H 14.730 4.098 -1.967 1.00 . A A . 63 LYS HB3 1 1 5 8432 1 1 63 LYS HD2 H 16.464 3.704 -3.150 1.00 . A A . 63 LYS HD2 1 1 5 8433 1 1 63 LYS HD3 H 16.505 3.513 -4.892 1.00 . A A . 63 LYS HD3 1 1 5 8434 1 1 63 LYS HE2 H 15.939 6.123 -4.893 1.00 . A A . 63 LYS HE2 1 1 5 8435 1 1 63 LYS HE3 H 16.584 6.063 -3.265 1.00 . A A . 63 LYS HE3 1 1 5 8436 1 1 63 LYS HG2 H 14.245 3.099 -4.478 1.00 . A A . 63 LYS HG2 1 1 5 8437 1 1 63 LYS HG3 H 14.193 4.817 -4.820 1.00 . A A . 63 LYS HG3 1 1 5 8438 1 1 63 LYS HZ1 H 18.306 6.522 -4.961 1.00 . A A . 63 LYS HZ1 1 1 5 8439 1 1 63 LYS HZ2 H 18.645 5.156 -4.141 1.00 . A A . 63 LYS HZ2 1 1 5 8440 1 1 63 LYS N N 13.050 2.076 -2.539 1.00 . A A . 63 LYS N 1 1 5 8441 1 1 63 LYS NZ N 17.979 5.579 -4.779 1.00 . A A . 63 LYS NZ 1 1 5 8442 1 1 63 LYS O O 11.076 4.896 -3.527 1.00 . A A . 63 LYS O 1 1 5 8443 1 1 64 GLY C C 8.831 2.832 -4.607 1.00 . A A . 64 GLY C 1 1 5 8444 1 1 64 GLY CA C 10.212 2.904 -5.262 1.00 . A A . 64 GLY CA 1 1 5 8445 1 1 64 GLY H H 11.699 1.868 -4.235 1.00 . A A . 64 GLY H 1 1 5 8446 1 1 64 GLY HA2 H 10.321 3.852 -5.787 1.00 . A A . 64 GLY HA2 1 1 5 8447 1 1 64 GLY HA3 H 10.306 2.114 -6.008 1.00 . A A . 64 GLY HA3 1 1 5 8448 1 1 64 GLY N N 11.266 2.769 -4.271 1.00 . A A . 64 GLY N 1 1 5 8449 1 1 64 GLY O O 8.274 1.748 -4.440 1.00 . A A . 64 GLY O 1 1 5 8450 1 1 65 TYR C C 5.967 3.302 -4.413 1.00 . A A . 65 TYR C 1 1 5 8451 1 1 65 TYR CA C 7.014 4.086 -3.618 1.00 . A A . 65 TYR CA 1 1 5 8452 1 1 65 TYR CB C 6.637 5.568 -3.624 1.00 . A A . 65 TYR CB 1 1 5 8453 1 1 65 TYR CD1 C 4.789 5.574 -1.909 1.00 . A A . 65 TYR CD1 1 1 5 8454 1 1 65 TYR CD2 C 4.295 6.365 -4.110 1.00 . A A . 65 TYR CD2 1 1 5 8455 1 1 65 TYR CE1 C 3.430 5.834 -1.510 1.00 . A A . 65 TYR CE1 1 1 5 8456 1 1 65 TYR CE2 C 2.936 6.626 -3.711 1.00 . A A . 65 TYR CE2 1 1 5 8457 1 1 65 TYR CG C 5.193 5.845 -3.200 1.00 . A A . 65 TYR CG 1 1 5 8458 1 1 65 TYR CZ C 2.571 6.347 -2.430 1.00 . A A . 65 TYR CZ 1 1 5 8459 1 1 65 TYR H H 8.778 4.879 -4.391 1.00 . A A . 65 TYR H 1 1 5 8460 1 1 65 TYR HA H 7.097 3.657 -2.620 1.00 . A A . 65 TYR HA 1 1 5 8461 1 1 65 TYR HB2 H 7.310 6.107 -2.957 1.00 . A A . 65 TYR HB2 1 1 5 8462 1 1 65 TYR HB3 H 6.794 5.969 -4.626 1.00 . A A . 65 TYR HB3 1 1 5 8463 1 1 65 TYR HD1 H 5.499 5.163 -1.191 1.00 . A A . 65 TYR HD1 1 1 5 8464 1 1 65 TYR HD2 H 4.614 6.579 -5.130 1.00 . A A . 65 TYR HD2 1 1 5 8465 1 1 65 TYR HE1 H 3.098 5.625 -0.493 1.00 . A A . 65 TYR HE1 1 1 5 8466 1 1 65 TYR HE2 H 2.216 7.037 -4.419 1.00 . A A . 65 TYR HE2 1 1 5 8467 1 1 65 TYR HH H 1.080 7.566 -2.159 1.00 . A A . 65 TYR HH 1 1 5 8468 1 1 65 TYR N N 8.319 4.002 -4.252 1.00 . A A . 65 TYR N 1 1 5 8469 1 1 65 TYR O O 5.125 2.619 -3.832 1.00 . A A . 65 TYR O 1 1 5 8470 1 1 65 TYR OH O 1.287 6.593 -2.054 1.00 . A A . 65 TYR OH 1 1 5 8471 1 1 66 TYR C C 5.515 1.271 -6.781 1.00 . A A . 66 TYR C 1 1 5 8472 1 1 66 TYR CA C 5.124 2.740 -6.609 1.00 . A A . 66 TYR CA 1 1 5 8473 1 1 66 TYR CB C 5.226 3.445 -7.964 1.00 . A A . 66 TYR CB 1 1 5 8474 1 1 66 TYR CD1 C 5.494 1.628 -9.691 1.00 . A A . 66 TYR CD1 1 1 5 8475 1 1 66 TYR CD2 C 3.441 2.852 -9.643 1.00 . A A . 66 TYR CD2 1 1 5 8476 1 1 66 TYR CE1 C 5.002 0.847 -10.797 1.00 . A A . 66 TYR CE1 1 1 5 8477 1 1 66 TYR CE2 C 2.949 2.071 -10.748 1.00 . A A . 66 TYR CE2 1 1 5 8478 1 1 66 TYR CG C 4.703 2.615 -9.138 1.00 . A A . 66 TYR CG 1 1 5 8479 1 1 66 TYR CZ C 3.753 1.107 -11.270 1.00 . A A . 66 TYR CZ 1 1 5 8480 1 1 66 TYR H H 6.741 3.986 -6.194 1.00 . A A . 66 TYR H 1 1 5 8481 1 1 66 TYR HA H 4.132 2.795 -6.160 1.00 . A A . 66 TYR HA 1 1 5 8482 1 1 66 TYR HB2 H 4.670 4.381 -7.918 1.00 . A A . 66 TYR HB2 1 1 5 8483 1 1 66 TYR HB3 H 6.269 3.702 -8.150 1.00 . A A . 66 TYR HB3 1 1 5 8484 1 1 66 TYR HD1 H 6.491 1.441 -9.292 1.00 . A A . 66 TYR HD1 1 1 5 8485 1 1 66 TYR HD2 H 2.817 3.631 -9.205 1.00 . A A . 66 TYR HD2 1 1 5 8486 1 1 66 TYR HE1 H 5.615 0.065 -11.243 1.00 . A A . 66 TYR HE1 1 1 5 8487 1 1 66 TYR HE2 H 1.954 2.248 -11.156 1.00 . A A . 66 TYR HE2 1 1 5 8488 1 1 66 TYR HH H 2.842 0.964 -12.981 1.00 . A A . 66 TYR HH 1 1 5 8489 1 1 66 TYR N N 6.054 3.428 -5.729 1.00 . A A . 66 TYR N 1 1 5 8490 1 1 66 TYR O O 4.846 0.526 -7.494 1.00 . A A . 66 TYR O 1 1 5 8491 1 1 66 TYR OH O 3.289 0.369 -12.314 1.00 . A A . 66 TYR OH 1 1 5 8492 1 1 67 HIS C C 6.671 -1.227 -4.923 1.00 . A A . 67 HIS C 1 1 5 8493 1 1 67 HIS CA C 7.088 -0.467 -6.185 1.00 . A A . 67 HIS CA 1 1 5 8494 1 1 67 HIS CB C 8.599 -0.492 -6.420 1.00 . A A . 67 HIS CB 1 1 5 8495 1 1 67 HIS CD2 C 9.710 -1.774 -4.431 1.00 . A A . 67 HIS CD2 1 1 5 8496 1 1 67 HIS CE1 C 10.284 -3.588 -5.511 1.00 . A A . 67 HIS CE1 1 1 5 8497 1 1 67 HIS CG C 9.310 -1.630 -5.727 1.00 . A A . 67 HIS CG 1 1 5 8498 1 1 67 HIS H H 7.137 1.512 -5.536 1.00 . A A . 67 HIS H 1 1 5 8499 1 1 67 HIS HA H 6.609 -0.927 -7.050 1.00 . A A . 67 HIS HA 1 1 5 8500 1 1 67 HIS HB2 H 8.789 -0.557 -7.491 1.00 . A A . 67 HIS HB2 1 1 5 8501 1 1 67 HIS HB3 H 9.025 0.451 -6.078 1.00 . A A . 67 HIS HB3 1 1 5 8502 1 1 67 HIS HD1 H 9.533 -2.990 -7.351 1.00 . A A . 67 HIS HD1 1 1 5 8503 1 1 67 HIS HD2 H 9.570 -1.041 -3.636 1.00 . A A . 67 HIS HD2 1 1 5 8504 1 1 67 HIS HE1 H 10.693 -4.576 -5.723 1.00 . A A . 67 HIS HE1 1 1 5 8505 1 1 67 HIS N N 6.599 0.899 -6.115 1.00 . A A . 67 HIS N 1 1 5 8506 1 1 67 HIS ND1 N 9.686 -2.789 -6.383 1.00 . A A . 67 HIS ND1 1 1 5 8507 1 1 67 HIS NE2 N 10.297 -2.957 -4.302 1.00 . A A . 67 HIS NE2 1 1 5 8508 1 1 67 HIS O O 6.733 -2.454 -4.885 1.00 . A A . 67 HIS O 1 1 5 8509 1 1 68 VAL C C 4.303 -1.029 -2.586 1.00 . A A . 68 VAL C 1 1 5 8510 1 1 68 VAL CA C 5.831 -1.050 -2.662 1.00 . A A . 68 VAL CA 1 1 5 8511 1 1 68 VAL CB C 6.497 -0.320 -1.494 1.00 . A A . 68 VAL CB 1 1 5 8512 1 1 68 VAL CG1 C 7.913 -0.849 -1.254 1.00 . A A . 68 VAL CG1 1 1 5 8513 1 1 68 VAL CG2 C 6.509 1.192 -1.727 1.00 . A A . 68 VAL CG2 1 1 5 8514 1 1 68 VAL H H 6.209 0.534 -3.962 1.00 . A A . 68 VAL H 1 1 5 8515 1 1 68 VAL HA H 6.169 -2.086 -2.650 1.00 . A A . 68 VAL HA 1 1 5 8516 1 1 68 VAL HB H 5.910 -0.517 -0.598 1.00 . A A . 68 VAL HB 1 1 5 8517 1 1 68 VAL HG11 H 7.910 -1.937 -1.319 1.00 . A A . 68 VAL HG11 1 1 5 8518 1 1 68 VAL HG12 H 8.586 -0.442 -2.009 1.00 . A A . 68 VAL HG12 1 1 5 8519 1 1 68 VAL HG13 H 8.251 -0.545 -0.264 1.00 . A A . 68 VAL HG13 1 1 5 8520 1 1 68 VAL HG21 H 5.503 1.529 -1.977 1.00 . A A . 68 VAL HG21 1 1 5 8521 1 1 68 VAL HG22 H 6.846 1.696 -0.822 1.00 . A A . 68 VAL HG22 1 1 5 8522 1 1 68 VAL HG23 H 7.185 1.428 -2.548 1.00 . A A . 68 VAL HG23 1 1 5 8523 1 1 68 VAL N N 6.256 -0.464 -3.922 1.00 . A A . 68 VAL N 1 1 5 8524 1 1 68 VAL O O 3.725 -1.343 -1.546 1.00 . A A . 68 VAL O 1 1 5 8525 1 1 69 MET C C 1.696 -1.605 -4.782 1.00 . A A . 69 MET C 1 1 5 8526 1 1 69 MET CA C 2.242 -0.591 -3.774 1.00 . A A . 69 MET CA 1 1 5 8527 1 1 69 MET CB C 1.815 0.819 -4.186 1.00 . A A . 69 MET CB 1 1 5 8528 1 1 69 MET CE C 2.626 2.085 -0.506 1.00 . A A . 69 MET CE 1 1 5 8529 1 1 69 MET CG C 2.375 1.866 -3.220 1.00 . A A . 69 MET CG 1 1 5 8530 1 1 69 MET H H 4.168 -0.404 -4.543 1.00 . A A . 69 MET H 1 1 5 8531 1 1 69 MET HA H 1.887 -0.837 -2.773 1.00 . A A . 69 MET HA 1 1 5 8532 1 1 69 MET HB2 H 2.164 1.028 -5.197 1.00 . A A . 69 MET HB2 1 1 5 8533 1 1 69 MET HB3 H 0.726 0.882 -4.205 1.00 . A A . 69 MET HB3 1 1 5 8534 1 1 69 MET HE1 H 3.388 1.324 -0.678 1.00 . A A . 69 MET HE1 1 1 5 8535 1 1 69 MET HE2 H 3.082 3.074 -0.555 1.00 . A A . 69 MET HE2 1 1 5 8536 1 1 69 MET HE3 H 2.183 1.938 0.479 1.00 . A A . 69 MET HE3 1 1 5 8537 1 1 69 MET HG2 H 3.399 1.610 -2.948 1.00 . A A . 69 MET HG2 1 1 5 8538 1 1 69 MET HG3 H 2.408 2.841 -3.707 1.00 . A A . 69 MET HG3 1 1 5 8539 1 1 69 MET N N 3.691 -0.657 -3.701 1.00 . A A . 69 MET N 1 1 5 8540 1 1 69 MET O O 0.507 -1.917 -4.772 1.00 . A A . 69 MET O 1 1 5 8541 1 1 69 MET SD S 1.358 1.950 -1.755 1.00 . A A . 69 MET SD 1 1 5 8542 1 1 70 HIS C C 3.217 -4.219 -6.639 1.00 . A A . 70 HIS C 1 1 5 8543 1 1 70 HIS CA C 2.216 -3.062 -6.641 1.00 . A A . 70 HIS CA 1 1 5 8544 1 1 70 HIS CB C 2.083 -2.395 -8.011 1.00 . A A . 70 HIS CB 1 1 5 8545 1 1 70 HIS CD2 C 0.151 -0.662 -8.320 1.00 . A A . 70 HIS CD2 1 1 5 8546 1 1 70 HIS CE1 C 1.215 1.119 -7.623 1.00 . A A . 70 HIS CE1 1 1 5 8547 1 1 70 HIS CG C 1.414 -1.042 -7.973 1.00 . A A . 70 HIS CG 1 1 5 8548 1 1 70 HIS H H 3.559 -1.832 -5.629 1.00 . A A . 70 HIS H 1 1 5 8549 1 1 70 HIS HA H 1.234 -3.443 -6.359 1.00 . A A . 70 HIS HA 1 1 5 8550 1 1 70 HIS HB2 H 3.076 -2.286 -8.448 1.00 . A A . 70 HIS HB2 1 1 5 8551 1 1 70 HIS HB3 H 1.515 -3.051 -8.670 1.00 . A A . 70 HIS HB3 1 1 5 8552 1 1 70 HIS HD1 H 3.006 0.153 -7.214 1.00 . A A . 70 HIS HD1 1 1 5 8553 1 1 70 HIS HD2 H -0.628 -1.318 -8.707 1.00 . A A . 70 HIS HD2 1 1 5 8554 1 1 70 HIS HE1 H 1.428 2.153 -7.353 1.00 . A A . 70 HIS HE1 1 1 5 8555 1 1 70 HIS N N 2.593 -2.091 -5.628 1.00 . A A . 70 HIS N 1 1 5 8556 1 1 70 HIS ND1 N 2.061 0.102 -7.538 1.00 . A A . 70 HIS ND1 1 1 5 8557 1 1 70 HIS NE2 N 0.032 0.643 -8.108 1.00 . A A . 70 HIS NE2 1 1 5 8558 1 1 70 HIS O O 2.851 -5.361 -6.367 1.00 . A A . 70 HIS O 1 1 5 8559 1 1 71 ASP C C 5.321 -5.870 -5.834 1.00 . A A . 71 ASP C 1 1 5 8560 1 1 71 ASP CA C 5.518 -4.880 -6.984 1.00 . A A . 71 ASP CA 1 1 5 8561 1 1 71 ASP CB C 6.894 -4.231 -6.817 1.00 . A A . 71 ASP CB 1 1 5 8562 1 1 71 ASP CG C 7.973 -4.749 -7.770 1.00 . A A . 71 ASP CG 1 1 5 8563 1 1 71 ASP H H 4.751 -2.951 -7.165 1.00 . A A . 71 ASP H 1 1 5 8564 1 1 71 ASP HA H 5.431 -5.353 -7.962 1.00 . A A . 71 ASP HA 1 1 5 8565 1 1 71 ASP HB2 H 6.791 -3.155 -6.960 1.00 . A A . 71 ASP HB2 1 1 5 8566 1 1 71 ASP HB3 H 7.230 -4.385 -5.792 1.00 . A A . 71 ASP HB3 1 1 5 8567 1 1 71 ASP N N 4.462 -3.883 -6.946 1.00 . A A . 71 ASP N 1 1 5 8568 1 1 71 ASP O O 5.328 -5.482 -4.667 1.00 . A A . 71 ASP O 1 1 5 8569 1 1 71 ASP OD1 O 7.937 -4.334 -8.948 1.00 . A A . 71 ASP OD1 1 1 5 8570 1 1 71 ASP OD2 O 8.810 -5.549 -7.298 1.00 . A A . 71 ASP OD2 1 1 5 8571 1 1 72 LYS C C 6.310 -8.682 -4.733 1.00 . A A . 72 LYS C 1 1 5 8572 1 1 72 LYS CA C 4.949 -8.180 -5.220 1.00 . A A . 72 LYS CA 1 1 5 8573 1 1 72 LYS CB C 4.052 -9.283 -5.786 1.00 . A A . 72 LYS CB 1 1 5 8574 1 1 72 LYS CD C 2.001 -9.783 -7.164 1.00 . A A . 72 LYS CD 1 1 5 8575 1 1 72 LYS CE C 1.517 -9.331 -8.543 1.00 . A A . 72 LYS CE 1 1 5 8576 1 1 72 LYS CG C 2.829 -8.689 -6.488 1.00 . A A . 72 LYS CG 1 1 5 8577 1 1 72 LYS H H 5.144 -7.438 -7.156 1.00 . A A . 72 LYS H 1 1 5 8578 1 1 72 LYS HA H 4.422 -7.738 -4.374 1.00 . A A . 72 LYS HA 1 1 5 8579 1 1 72 LYS HB2 H 4.619 -9.893 -6.489 1.00 . A A . 72 LYS HB2 1 1 5 8580 1 1 72 LYS HB3 H 3.730 -9.943 -4.981 1.00 . A A . 72 LYS HB3 1 1 5 8581 1 1 72 LYS HD2 H 2.599 -10.689 -7.264 1.00 . A A . 72 LYS HD2 1 1 5 8582 1 1 72 LYS HD3 H 1.144 -10.034 -6.539 1.00 . A A . 72 LYS HD3 1 1 5 8583 1 1 72 LYS HE2 H 0.447 -9.516 -8.639 1.00 . A A . 72 LYS HE2 1 1 5 8584 1 1 72 LYS HE3 H 1.665 -8.257 -8.653 1.00 . A A . 72 LYS HE3 1 1 5 8585 1 1 72 LYS HG2 H 2.213 -8.156 -5.764 1.00 . A A . 72 LYS HG2 1 1 5 8586 1 1 72 LYS HG3 H 3.151 -7.959 -7.231 1.00 . A A . 72 LYS HG3 1 1 5 8587 1 1 72 LYS HZ1 H 1.635 -10.333 -10.367 1.00 . A A . 72 LYS HZ1 1 1 5 8588 1 1 72 LYS HZ2 H 2.978 -9.479 -10.022 1.00 . A A . 72 LYS HZ2 1 1 5 8589 1 1 72 LYS N N 5.149 -7.131 -6.205 1.00 . A A . 72 LYS N 1 1 5 8590 1 1 72 LYS NZ N 2.248 -10.050 -9.610 1.00 . A A . 72 LYS NZ 1 1 5 8591 1 1 72 LYS O O 6.483 -8.967 -3.549 1.00 . A A . 72 LYS O 1 1 5 8592 1 1 73 ASN C C 9.255 -8.233 -4.420 1.00 . A A . 73 ASN C 1 1 5 8593 1 1 73 ASN CA C 8.580 -9.240 -5.354 1.00 . A A . 73 ASN CA 1 1 5 8594 1 1 73 ASN CB C 9.435 -9.361 -6.617 1.00 . A A . 73 ASN CB 1 1 5 8595 1 1 73 ASN CG C 9.605 -10.825 -7.026 1.00 . A A . 73 ASN CG 1 1 5 8596 1 1 73 ASN H H 7.091 -8.542 -6.633 1.00 . A A . 73 ASN H 1 1 5 8597 1 1 73 ASN HA H 8.442 -10.215 -4.887 1.00 . A A . 73 ASN HA 1 1 5 8598 1 1 73 ASN HB2 H 8.970 -8.803 -7.430 1.00 . A A . 73 ASN HB2 1 1 5 8599 1 1 73 ASN HB3 H 10.413 -8.912 -6.442 1.00 . A A . 73 ASN HB3 1 1 5 8600 1 1 73 ASN HD21 H 9.136 -10.300 -8.924 1.00 . A A . 73 ASN HD21 1 1 5 8601 1 1 73 ASN HD22 H 9.473 -11.981 -8.682 1.00 . A A . 73 ASN HD22 1 1 5 8602 1 1 73 ASN N N 7.240 -8.776 -5.672 1.00 . A A . 73 ASN N 1 1 5 8603 1 1 73 ASN ND2 N 9.387 -11.054 -8.318 1.00 . A A . 73 ASN ND2 1 1 5 8604 1 1 73 ASN O O 10.057 -7.412 -4.862 1.00 . A A . 73 ASN O 1 1 5 8605 1 1 73 ASN OD1 O 9.914 -11.689 -6.222 1.00 . A A . 73 ASN OD1 1 1 5 8606 1 1 74 THR C C 9.689 -8.185 -0.829 1.00 . A A . 74 THR C 1 1 5 8607 1 1 74 THR CA C 9.467 -7.438 -2.146 1.00 . A A . 74 THR CA 1 1 5 8608 1 1 74 THR CB C 8.535 -6.232 -2.011 1.00 . A A . 74 THR CB 1 1 5 8609 1 1 74 THR CG2 C 8.346 -5.488 -3.334 1.00 . A A . 74 THR CG2 1 1 5 8610 1 1 74 THR H H 8.253 -9.001 -2.794 1.00 . A A . 74 THR H 1 1 5 8611 1 1 74 THR HA H 10.446 -7.105 -2.493 1.00 . A A . 74 THR HA 1 1 5 8612 1 1 74 THR HB H 8.884 -5.556 -1.230 1.00 . A A . 74 THR HB 1 1 5 8613 1 1 74 THR HG1 H 7.029 -7.470 -2.464 1.00 . A A . 74 THR HG1 1 1 5 8614 1 1 74 THR HG21 H 9.316 -5.171 -3.715 1.00 . A A . 74 THR HG21 1 1 5 8615 1 1 74 THR HG22 H 7.869 -6.149 -4.058 1.00 . A A . 74 THR HG22 1 1 5 8616 1 1 74 THR HG23 H 7.716 -4.613 -3.172 1.00 . A A . 74 THR HG23 1 1 5 8617 1 1 74 THR N N 8.906 -8.330 -3.146 1.00 . A A . 74 THR N 1 1 5 8618 1 1 74 THR O O 9.031 -9.189 -0.562 1.00 . A A . 74 THR O 1 1 5 8619 1 1 74 THR OG1 O 7.258 -6.808 -1.750 1.00 . A A . 74 THR OG1 1 1 5 8620 1 1 75 LYS C C 9.720 -8.169 2.164 1.00 . A A . 75 LYS C 1 1 5 8621 1 1 75 LYS CA C 10.936 -8.271 1.242 1.00 . A A . 75 LYS CA 1 1 5 8622 1 1 75 LYS CB C 12.206 -7.650 1.828 1.00 . A A . 75 LYS CB 1 1 5 8623 1 1 75 LYS CD C 12.734 -7.189 4.250 1.00 . A A . 75 LYS CD 1 1 5 8624 1 1 75 LYS CE C 14.217 -6.977 4.557 1.00 . A A . 75 LYS CE 1 1 5 8625 1 1 75 LYS CG C 12.543 -8.271 3.185 1.00 . A A . 75 LYS CG 1 1 5 8626 1 1 75 LYS H H 11.150 -6.849 -0.265 1.00 . A A . 75 LYS H 1 1 5 8627 1 1 75 LYS HA H 11.146 -9.326 1.062 1.00 . A A . 75 LYS HA 1 1 5 8628 1 1 75 LYS HB2 H 13.039 -7.797 1.140 1.00 . A A . 75 LYS HB2 1 1 5 8629 1 1 75 LYS HB3 H 12.071 -6.575 1.939 1.00 . A A . 75 LYS HB3 1 1 5 8630 1 1 75 LYS HD2 H 12.292 -6.253 3.907 1.00 . A A . 75 LYS HD2 1 1 5 8631 1 1 75 LYS HD3 H 12.207 -7.474 5.161 1.00 . A A . 75 LYS HD3 1 1 5 8632 1 1 75 LYS HE2 H 14.365 -6.901 5.634 1.00 . A A . 75 LYS HE2 1 1 5 8633 1 1 75 LYS HE3 H 14.792 -7.838 4.216 1.00 . A A . 75 LYS HE3 1 1 5 8634 1 1 75 LYS HG2 H 11.745 -8.948 3.488 1.00 . A A . 75 LYS HG2 1 1 5 8635 1 1 75 LYS HG3 H 13.452 -8.867 3.101 1.00 . A A . 75 LYS HG3 1 1 5 8636 1 1 75 LYS HZ1 H 14.260 -4.915 4.253 1.00 . A A . 75 LYS HZ1 1 1 5 8637 1 1 75 LYS HZ2 H 15.710 -5.622 4.028 1.00 . A A . 75 LYS HZ2 1 1 5 8638 1 1 75 LYS N N 10.619 -7.666 -0.041 1.00 . A A . 75 LYS N 1 1 5 8639 1 1 75 LYS NZ N 14.713 -5.749 3.895 1.00 . A A . 75 LYS NZ 1 1 5 8640 1 1 75 LYS O O 9.574 -8.960 3.094 1.00 . A A . 75 LYS O 1 1 5 8641 1 1 76 PHE C C 6.420 -7.129 1.809 1.00 . A A . 76 PHE C 1 1 5 8642 1 1 76 PHE CA C 7.678 -6.973 2.665 1.00 . A A . 76 PHE CA 1 1 5 8643 1 1 76 PHE CB C 7.761 -5.531 3.170 1.00 . A A . 76 PHE CB 1 1 5 8644 1 1 76 PHE CD1 C 8.863 -5.899 5.408 1.00 . A A . 76 PHE CD1 1 1 5 8645 1 1 76 PHE CD2 C 9.940 -4.453 3.838 1.00 . A A . 76 PHE CD2 1 1 5 8646 1 1 76 PHE CE1 C 9.927 -5.668 6.350 1.00 . A A . 76 PHE CE1 1 1 5 8647 1 1 76 PHE CE2 C 11.004 -4.222 4.780 1.00 . A A . 76 PHE CE2 1 1 5 8648 1 1 76 PHE CG C 8.892 -5.286 4.172 1.00 . A A . 76 PHE CG 1 1 5 8649 1 1 76 PHE CZ C 10.945 -4.842 5.990 1.00 . A A . 76 PHE CZ 1 1 5 8650 1 1 76 PHE H H 9.003 -6.550 1.114 1.00 . A A . 76 PHE H 1 1 5 8651 1 1 76 PHE HA H 7.662 -7.717 3.461 1.00 . A A . 76 PHE HA 1 1 5 8652 1 1 76 PHE HB2 H 7.894 -4.865 2.318 1.00 . A A . 76 PHE HB2 1 1 5 8653 1 1 76 PHE HB3 H 6.812 -5.266 3.637 1.00 . A A . 76 PHE HB3 1 1 5 8654 1 1 76 PHE HD1 H 8.035 -6.557 5.671 1.00 . A A . 76 PHE HD1 1 1 5 8655 1 1 76 PHE HD2 H 9.962 -3.969 2.862 1.00 . A A . 76 PHE HD2 1 1 5 8656 1 1 76 PHE HE1 H 9.917 -6.146 7.330 1.00 . A A . 76 PHE HE1 1 1 5 8657 1 1 76 PHE HE2 H 11.838 -3.567 4.530 1.00 . A A . 76 PHE HE2 1 1 5 8658 1 1 76 PHE HZ H 11.733 -4.744 6.780 1.00 . A A . 76 PHE HZ 1 1 5 8659 1 1 76 PHE N N 8.877 -7.189 1.873 1.00 . A A . 76 PHE N 1 1 5 8660 1 1 76 PHE O O 6.479 -7.013 0.586 1.00 . A A . 76 PHE O 1 1 5 8661 1 1 77 LYS C C 3.623 -6.238 1.166 1.00 . A A . 77 LYS C 1 1 5 8662 1 1 77 LYS CA C 4.041 -7.565 1.801 1.00 . A A . 77 LYS CA 1 1 5 8663 1 1 77 LYS CB C 2.995 -8.147 2.754 1.00 . A A . 77 LYS CB 1 1 5 8664 1 1 77 LYS CD C 2.023 -10.270 3.707 1.00 . A A . 77 LYS CD 1 1 5 8665 1 1 77 LYS CE C 2.492 -11.483 4.513 1.00 . A A . 77 LYS CE 1 1 5 8666 1 1 77 LYS CG C 3.181 -9.657 2.916 1.00 . A A . 77 LYS CG 1 1 5 8667 1 1 77 LYS H H 5.272 -7.484 3.480 1.00 . A A . 77 LYS H 1 1 5 8668 1 1 77 LYS HA H 4.195 -8.296 1.007 1.00 . A A . 77 LYS HA 1 1 5 8669 1 1 77 LYS HB2 H 3.073 -7.661 3.727 1.00 . A A . 77 LYS HB2 1 1 5 8670 1 1 77 LYS HB3 H 1.995 -7.939 2.374 1.00 . A A . 77 LYS HB3 1 1 5 8671 1 1 77 LYS HD2 H 1.602 -9.523 4.380 1.00 . A A . 77 LYS HD2 1 1 5 8672 1 1 77 LYS HD3 H 1.228 -10.568 3.024 1.00 . A A . 77 LYS HD3 1 1 5 8673 1 1 77 LYS HE2 H 3.354 -11.212 5.123 1.00 . A A . 77 LYS HE2 1 1 5 8674 1 1 77 LYS HE3 H 1.704 -11.800 5.197 1.00 . A A . 77 LYS HE3 1 1 5 8675 1 1 77 LYS HG2 H 3.243 -10.127 1.934 1.00 . A A . 77 LYS HG2 1 1 5 8676 1 1 77 LYS HG3 H 4.122 -9.859 3.427 1.00 . A A . 77 LYS HG3 1 1 5 8677 1 1 77 LYS HZ1 H 3.734 -12.440 3.139 1.00 . A A . 77 LYS HZ1 1 1 5 8678 1 1 77 LYS HZ2 H 2.936 -13.479 4.106 1.00 . A A . 77 LYS HZ2 1 1 5 8679 1 1 77 LYS N N 5.312 -7.391 2.485 1.00 . A A . 77 LYS N 1 1 5 8680 1 1 77 LYS NZ N 2.849 -12.599 3.609 1.00 . A A . 77 LYS NZ 1 1 5 8681 1 1 77 LYS O O 3.591 -5.207 1.836 1.00 . A A . 77 LYS O 1 1 5 8682 1 1 78 SER C C 1.371 -5.060 -0.927 1.00 . A A . 78 SER C 1 1 5 8683 1 1 78 SER CA C 2.898 -5.123 -0.855 1.00 . A A . 78 SER CA 1 1 5 8684 1 1 78 SER CB C 3.497 -5.110 -2.262 1.00 . A A . 78 SER CB 1 1 5 8685 1 1 78 SER H H 3.341 -7.149 -0.659 1.00 . A A . 78 SER H 1 1 5 8686 1 1 78 SER HA H 3.289 -4.279 -0.286 1.00 . A A . 78 SER HA 1 1 5 8687 1 1 78 SER HB2 H 3.611 -4.079 -2.598 1.00 . A A . 78 SER HB2 1 1 5 8688 1 1 78 SER HB3 H 4.495 -5.548 -2.236 1.00 . A A . 78 SER HB3 1 1 5 8689 1 1 78 SER HG H 3.254 -6.167 -3.944 1.00 . A A . 78 SER HG 1 1 5 8690 1 1 78 SER N N 3.313 -6.306 -0.121 1.00 . A A . 78 SER N 1 1 5 8691 1 1 78 SER O O 0.695 -6.067 -0.725 1.00 . A A . 78 SER O 1 1 5 8692 1 1 78 SER OG O 2.689 -5.825 -3.193 1.00 . A A . 78 SER OG 1 1 5 8693 1 1 79 CYS C C -1.144 -4.756 -2.211 1.00 . A A . 79 CYS C 1 1 5 8694 1 1 79 CYS CA C -0.562 -3.659 -1.317 1.00 . A A . 79 CYS CA 1 1 5 8695 1 1 79 CYS CB C -0.896 -2.260 -1.838 1.00 . A A . 79 CYS CB 1 1 5 8696 1 1 79 CYS H H 1.430 -3.053 -1.378 1.00 . A A . 79 CYS H 1 1 5 8697 1 1 79 CYS HA H -0.961 -3.733 -0.305 1.00 . A A . 79 CYS HA 1 1 5 8698 1 1 79 CYS HB2 H -0.561 -2.184 -2.872 1.00 . A A . 79 CYS HB2 1 1 5 8699 1 1 79 CYS HB3 H -1.979 -2.139 -1.844 1.00 . A A . 79 CYS HB3 1 1 5 8700 1 1 79 CYS N N 0.873 -3.867 -1.215 1.00 . A A . 79 CYS N 1 1 5 8701 1 1 79 CYS O O -1.902 -5.604 -1.745 1.00 . A A . 79 CYS O 1 1 5 8702 1 1 79 CYS SG S -0.157 -0.887 -0.879 1.00 . A A . 79 CYS SG 1 1 5 8703 1 1 80 VAL C C -0.729 -7.067 -4.053 1.00 . A A . 80 VAL C 1 1 5 8704 1 1 80 VAL CA C -1.242 -5.680 -4.444 1.00 . A A . 80 VAL CA 1 1 5 8705 1 1 80 VAL CB C -0.827 -5.265 -5.858 1.00 . A A . 80 VAL CB 1 1 5 8706 1 1 80 VAL CG1 C -1.191 -6.348 -6.875 1.00 . A A . 80 VAL CG1 1 1 5 8707 1 1 80 VAL CG2 C -1.451 -3.922 -6.240 1.00 . A A . 80 VAL CG2 1 1 5 8708 1 1 80 VAL H H -0.149 -4.008 -3.851 1.00 . A A . 80 VAL H 1 1 5 8709 1 1 80 VAL HA H -2.331 -5.683 -4.399 1.00 . A A . 80 VAL HA 1 1 5 8710 1 1 80 VAL HB H 0.256 -5.146 -5.868 1.00 . A A . 80 VAL HB 1 1 5 8711 1 1 80 VAL HG11 H -2.108 -6.848 -6.562 1.00 . A A . 80 VAL HG11 1 1 5 8712 1 1 80 VAL HG12 H -1.343 -5.892 -7.853 1.00 . A A . 80 VAL HG12 1 1 5 8713 1 1 80 VAL HG13 H -0.382 -7.076 -6.935 1.00 . A A . 80 VAL HG13 1 1 5 8714 1 1 80 VAL HG21 H -2.296 -3.713 -5.583 1.00 . A A . 80 VAL HG21 1 1 5 8715 1 1 80 VAL HG22 H -0.707 -3.132 -6.136 1.00 . A A . 80 VAL HG22 1 1 5 8716 1 1 80 VAL HG23 H -1.796 -3.962 -7.273 1.00 . A A . 80 VAL HG23 1 1 5 8717 1 1 80 VAL N N -0.767 -4.702 -3.480 1.00 . A A . 80 VAL N 1 1 5 8718 1 1 80 VAL O O -1.434 -8.062 -4.214 1.00 . A A . 80 VAL O 1 1 5 8719 1 1 81 GLY C C 0.188 -9.120 -2.197 1.00 . A A . 81 GLY C 1 1 5 8720 1 1 81 GLY CA C 1.112 -8.337 -3.132 1.00 . A A . 81 GLY CA 1 1 5 8721 1 1 81 GLY H H 1.063 -6.274 -3.419 1.00 . A A . 81 GLY H 1 1 5 8722 1 1 81 GLY HA2 H 1.345 -8.941 -4.009 1.00 . A A . 81 GLY HA2 1 1 5 8723 1 1 81 GLY HA3 H 2.056 -8.131 -2.627 1.00 . A A . 81 GLY HA3 1 1 5 8724 1 1 81 GLY N N 0.496 -7.088 -3.547 1.00 . A A . 81 GLY N 1 1 5 8725 1 1 81 GLY O O -0.179 -10.257 -2.491 1.00 . A A . 81 GLY O 1 1 5 8726 1 1 82 CYS C C -2.395 -9.349 -0.766 1.00 . A A . 82 CYS C 1 1 5 8727 1 1 82 CYS CA C -1.034 -9.104 -0.110 1.00 . A A . 82 CYS CA 1 1 5 8728 1 1 82 CYS CB C -1.156 -8.258 1.158 1.00 . A A . 82 CYS CB 1 1 5 8729 1 1 82 CYS H H 0.143 -7.557 -0.859 1.00 . A A . 82 CYS H 1 1 5 8730 1 1 82 CYS HA H -0.566 -10.047 0.172 1.00 . A A . 82 CYS HA 1 1 5 8731 1 1 82 CYS HB2 H -0.165 -8.045 1.560 1.00 . A A . 82 CYS HB2 1 1 5 8732 1 1 82 CYS HB3 H -1.617 -7.299 0.923 1.00 . A A . 82 CYS HB3 1 1 5 8733 1 1 82 CYS N N -0.161 -8.482 -1.090 1.00 . A A . 82 CYS N 1 1 5 8734 1 1 82 CYS O O -2.973 -10.425 -0.622 1.00 . A A . 82 CYS O 1 1 5 8735 1 1 82 CYS SG S -2.158 -9.143 2.408 1.00 . A A . 82 CYS SG 1 1 5 8736 1 1 83 HIS C C -4.179 -9.677 -3.025 1.00 . A A . 83 HIS C 1 1 5 8737 1 1 83 HIS CA C -4.148 -8.422 -2.150 1.00 . A A . 83 HIS CA 1 1 5 8738 1 1 83 HIS CB C -4.437 -7.143 -2.938 1.00 . A A . 83 HIS CB 1 1 5 8739 1 1 83 HIS CD2 C -4.792 -5.741 -0.761 1.00 . A A . 83 HIS CD2 1 1 5 8740 1 1 83 HIS CE1 C -5.999 -4.131 -1.620 1.00 . A A . 83 HIS CE1 1 1 5 8741 1 1 83 HIS CG C -4.946 -6.001 -2.091 1.00 . A A . 83 HIS CG 1 1 5 8742 1 1 83 HIS H H -2.389 -7.460 -1.585 1.00 . A A . 83 HIS H 1 1 5 8743 1 1 83 HIS HA H -4.907 -8.512 -1.373 1.00 . A A . 83 HIS HA 1 1 5 8744 1 1 83 HIS HB2 H -3.526 -6.827 -3.446 1.00 . A A . 83 HIS HB2 1 1 5 8745 1 1 83 HIS HB3 H -5.173 -7.363 -3.712 1.00 . A A . 83 HIS HB3 1 1 5 8746 1 1 83 HIS HD1 H -5.999 -4.873 -3.558 1.00 . A A . 83 HIS HD1 1 1 5 8747 1 1 83 HIS HD2 H -4.240 -6.357 -0.051 1.00 . A A . 83 HIS HD2 1 1 5 8748 1 1 83 HIS HE1 H -6.589 -3.218 -1.707 1.00 . A A . 83 HIS HE1 1 1 5 8749 1 1 83 HIS N N -2.866 -8.332 -1.472 1.00 . A A . 83 HIS N 1 1 5 8750 1 1 83 HIS ND1 N -5.712 -4.969 -2.605 1.00 . A A . 83 HIS ND1 1 1 5 8751 1 1 83 HIS NE2 N -5.428 -4.610 -0.478 1.00 . A A . 83 HIS NE2 1 1 5 8752 1 1 83 HIS O O -5.170 -10.405 -3.037 1.00 . A A . 83 HIS O 1 1 5 8753 1 1 84 VAL C C -3.219 -12.319 -3.803 1.00 . A A . 84 VAL C 1 1 5 8754 1 1 84 VAL CA C -2.970 -11.045 -4.611 1.00 . A A . 84 VAL CA 1 1 5 8755 1 1 84 VAL CB C -1.611 -11.039 -5.314 1.00 . A A . 84 VAL CB 1 1 5 8756 1 1 84 VAL CG1 C -1.426 -12.300 -6.161 1.00 . A A . 84 VAL CG1 1 1 5 8757 1 1 84 VAL CG2 C -1.437 -9.778 -6.162 1.00 . A A . 84 VAL CG2 1 1 5 8758 1 1 84 VAL H H -2.279 -9.294 -3.719 1.00 . A A . 84 VAL H 1 1 5 8759 1 1 84 VAL HA H -3.744 -10.955 -5.373 1.00 . A A . 84 VAL HA 1 1 5 8760 1 1 84 VAL HB H -0.837 -11.036 -4.546 1.00 . A A . 84 VAL HB 1 1 5 8761 1 1 84 VAL HG11 H -2.384 -12.811 -6.266 1.00 . A A . 84 VAL HG11 1 1 5 8762 1 1 84 VAL HG12 H -1.053 -12.024 -7.147 1.00 . A A . 84 VAL HG12 1 1 5 8763 1 1 84 VAL HG13 H -0.712 -12.964 -5.675 1.00 . A A . 84 VAL HG13 1 1 5 8764 1 1 84 VAL HG21 H -2.310 -9.136 -6.041 1.00 . A A . 84 VAL HG21 1 1 5 8765 1 1 84 VAL HG22 H -0.544 -9.243 -5.839 1.00 . A A . 84 VAL HG22 1 1 5 8766 1 1 84 VAL HG23 H -1.334 -10.057 -7.211 1.00 . A A . 84 VAL HG23 1 1 5 8767 1 1 84 VAL N N -3.081 -9.891 -3.735 1.00 . A A . 84 VAL N 1 1 5 8768 1 1 84 VAL O O -3.838 -13.261 -4.296 1.00 . A A . 84 VAL O 1 1 5 8769 1 1 85 GLU C C -4.323 -13.521 -1.169 1.00 . A A . 85 GLU C 1 1 5 8770 1 1 85 GLU CA C -2.886 -13.452 -1.692 1.00 . A A . 85 GLU CA 1 1 5 8771 1 1 85 GLU CB C -1.885 -13.399 -0.536 1.00 . A A . 85 GLU CB 1 1 5 8772 1 1 85 GLU CD C -0.575 -15.410 0.239 1.00 . A A . 85 GLU CD 1 1 5 8773 1 1 85 GLU CG C -0.682 -14.303 -0.812 1.00 . A A . 85 GLU CG 1 1 5 8774 1 1 85 GLU H H -2.223 -11.539 -2.179 1.00 . A A . 85 GLU H 1 1 5 8775 1 1 85 GLU HA H -2.674 -14.326 -2.308 1.00 . A A . 85 GLU HA 1 1 5 8776 1 1 85 GLU HB2 H -1.548 -12.373 -0.389 1.00 . A A . 85 GLU HB2 1 1 5 8777 1 1 85 GLU HB3 H -2.373 -13.710 0.388 1.00 . A A . 85 GLU HB3 1 1 5 8778 1 1 85 GLU HG2 H -0.774 -14.746 -1.803 1.00 . A A . 85 GLU HG2 1 1 5 8779 1 1 85 GLU HG3 H 0.232 -13.708 -0.812 1.00 . A A . 85 GLU HG3 1 1 5 8780 1 1 85 GLU N N -2.725 -12.309 -2.573 1.00 . A A . 85 GLU N 1 1 5 8781 1 1 85 GLU O O -4.863 -14.608 -0.969 1.00 . A A . 85 GLU O 1 1 5 8782 1 1 85 GLU OE1 O -0.891 -15.112 1.411 1.00 . A A . 85 GLU OE1 1 1 5 8783 1 1 85 GLU OE2 O -0.180 -16.529 -0.153 1.00 . A A . 85 GLU OE2 1 1 5 8784 1 1 86 VAL C C -7.234 -12.651 -1.587 1.00 . A A . 86 VAL C 1 1 5 8785 1 1 86 VAL CA C -6.265 -12.261 -0.469 1.00 . A A . 86 VAL CA 1 1 5 8786 1 1 86 VAL CB C -6.530 -10.862 0.092 1.00 . A A . 86 VAL CB 1 1 5 8787 1 1 86 VAL CG1 C -7.970 -10.737 0.593 1.00 . A A . 86 VAL CG1 1 1 5 8788 1 1 86 VAL CG2 C -5.532 -10.517 1.199 1.00 . A A . 86 VAL CG2 1 1 5 8789 1 1 86 VAL H H -4.456 -11.468 -1.130 1.00 . A A . 86 VAL H 1 1 5 8790 1 1 86 VAL HA H -6.364 -12.976 0.347 1.00 . A A . 86 VAL HA 1 1 5 8791 1 1 86 VAL HB H -6.393 -10.145 -0.717 1.00 . A A . 86 VAL HB 1 1 5 8792 1 1 86 VAL HG11 H -8.645 -11.210 -0.120 1.00 . A A . 86 VAL HG11 1 1 5 8793 1 1 86 VAL HG12 H -8.062 -11.227 1.561 1.00 . A A . 86 VAL HG12 1 1 5 8794 1 1 86 VAL HG13 H -8.229 -9.683 0.693 1.00 . A A . 86 VAL HG13 1 1 5 8795 1 1 86 VAL HG21 H -5.260 -11.425 1.739 1.00 . A A . 86 VAL HG21 1 1 5 8796 1 1 86 VAL HG22 H -4.639 -10.075 0.759 1.00 . A A . 86 VAL HG22 1 1 5 8797 1 1 86 VAL HG23 H -5.987 -9.807 1.890 1.00 . A A . 86 VAL HG23 1 1 5 8798 1 1 86 VAL N N -4.901 -12.347 -0.964 1.00 . A A . 86 VAL N 1 1 5 8799 1 1 86 VAL O O -8.076 -13.529 -1.405 1.00 . A A . 86 VAL O 1 1 5 8800 1 1 87 ALA C C -7.677 -13.665 -4.370 1.00 . A A . 87 ALA C 1 1 5 8801 1 1 87 ALA CA C -7.936 -12.243 -3.865 1.00 . A A . 87 ALA CA 1 1 5 8802 1 1 87 ALA CB C -7.684 -11.187 -4.943 1.00 . A A . 87 ALA CB 1 1 5 8803 1 1 87 ALA H H -6.396 -11.266 -2.858 1.00 . A A . 87 ALA H 1 1 5 8804 1 1 87 ALA HA H -8.971 -12.167 -3.534 1.00 . A A . 87 ALA HA 1 1 5 8805 1 1 87 ALA HB1 H -6.742 -10.677 -4.740 1.00 . A A . 87 ALA HB1 1 1 5 8806 1 1 87 ALA HB2 H -7.632 -11.670 -5.919 1.00 . A A . 87 ALA HB2 1 1 5 8807 1 1 87 ALA HB3 H -8.498 -10.463 -4.939 1.00 . A A . 87 ALA HB3 1 1 5 8808 1 1 87 ALA N N -7.084 -11.979 -2.718 1.00 . A A . 87 ALA N 1 1 5 8809 1 1 87 ALA O O -8.593 -14.334 -4.846 1.00 . A A . 87 ALA O 1 1 5 8810 1 1 88 GLY C C -6.430 -15.647 -6.146 1.00 . A A . 88 GLY C 1 1 5 8811 1 1 88 GLY CA C -6.036 -15.413 -4.686 1.00 . A A . 88 GLY CA 1 1 5 8812 1 1 88 GLY H H -5.688 -13.533 -3.859 1.00 . A A . 88 GLY H 1 1 5 8813 1 1 88 GLY HA2 H -4.959 -15.535 -4.572 1.00 . A A . 88 GLY HA2 1 1 5 8814 1 1 88 GLY HA3 H -6.511 -16.162 -4.053 1.00 . A A . 88 GLY HA3 1 1 5 8815 1 1 88 GLY N N -6.426 -14.083 -4.248 1.00 . A A . 88 GLY N 1 1 5 8816 1 1 88 GLY O O -5.714 -15.238 -7.059 1.00 . A A . 88 GLY O 1 1 5 8817 1 1 89 ALA C C -9.592 -16.496 -7.656 1.00 . A A . 89 ALA C 1 1 5 8818 1 1 89 ALA CA C -8.066 -16.597 -7.653 1.00 . A A . 89 ALA CA 1 1 5 8819 1 1 89 ALA CB C -7.572 -17.977 -8.090 1.00 . A A . 89 ALA CB 1 1 5 8820 1 1 89 ALA H H -8.144 -16.631 -5.572 1.00 . A A . 89 ALA H 1 1 5 8821 1 1 89 ALA HA H -7.659 -15.847 -8.332 1.00 . A A . 89 ALA HA 1 1 5 8822 1 1 89 ALA HB1 H -6.543 -18.116 -7.759 1.00 . A A . 89 ALA HB1 1 1 5 8823 1 1 89 ALA HB2 H -8.204 -18.746 -7.646 1.00 . A A . 89 ALA HB2 1 1 5 8824 1 1 89 ALA HB3 H -7.617 -18.052 -9.177 1.00 . A A . 89 ALA HB3 1 1 5 8825 1 1 89 ALA N N -7.568 -16.303 -6.320 1.00 . A A . 89 ALA N 1 1 5 8826 1 1 89 ALA O O -10.281 -17.460 -7.987 1.00 . A A . 89 ALA O 1 1 5 8827 1 1 90 ASP C C -11.920 -14.243 -8.453 1.00 . A A . 90 ASP C 1 1 5 8828 1 1 90 ASP CA C -11.509 -15.080 -7.240 1.00 . A A . 90 ASP CA 1 1 5 8829 1 1 90 ASP CB C -11.900 -14.308 -5.979 1.00 . A A . 90 ASP CB 1 1 5 8830 1 1 90 ASP CG C -13.367 -13.880 -5.911 1.00 . A A . 90 ASP CG 1 1 5 8831 1 1 90 ASP H H -9.510 -14.540 -7.018 1.00 . A A . 90 ASP H 1 1 5 8832 1 1 90 ASP HA H -11.965 -16.070 -7.243 1.00 . A A . 90 ASP HA 1 1 5 8833 1 1 90 ASP HB2 H -11.677 -14.926 -5.109 1.00 . A A . 90 ASP HB2 1 1 5 8834 1 1 90 ASP HB3 H -11.273 -13.419 -5.907 1.00 . A A . 90 ASP HB3 1 1 5 8835 1 1 90 ASP N N -10.077 -15.320 -7.285 1.00 . A A . 90 ASP N 1 1 5 8836 1 1 90 ASP O O -13.092 -14.217 -8.825 1.00 . A A . 90 ASP O 1 1 5 8837 1 1 90 ASP OD1 O -14.176 -14.510 -6.626 1.00 . A A . 90 ASP OD1 1 1 5 8838 1 1 90 ASP OD2 O -13.647 -12.932 -5.146 1.00 . A A . 90 ASP OD2 1 1 5 8839 1 1 91 ALA C C -11.775 -11.410 -9.747 1.00 . A A . 91 ALA C 1 1 5 8840 1 1 91 ALA CA C -11.176 -12.744 -10.199 1.00 . A A . 91 ALA CA 1 1 5 8841 1 1 91 ALA CB C -12.084 -13.487 -11.181 1.00 . A A . 91 ALA CB 1 1 5 8842 1 1 91 ALA H H -9.981 -13.607 -8.727 1.00 . A A . 91 ALA H 1 1 5 8843 1 1 91 ALA HA H -10.216 -12.557 -10.681 1.00 . A A . 91 ALA HA 1 1 5 8844 1 1 91 ALA HB1 H -12.233 -14.510 -10.835 1.00 . A A . 91 ALA HB1 1 1 5 8845 1 1 91 ALA HB2 H -13.047 -12.980 -11.241 1.00 . A A . 91 ALA HB2 1 1 5 8846 1 1 91 ALA HB3 H -11.619 -13.500 -12.167 1.00 . A A . 91 ALA HB3 1 1 5 8847 1 1 91 ALA N N -10.932 -13.580 -9.036 1.00 . A A . 91 ALA N 1 1 5 8848 1 1 91 ALA O O -11.083 -10.393 -9.718 1.00 . A A . 91 ALA O 1 1 5 8849 1 1 92 ALA C C -12.834 -9.455 -8.039 1.00 . A A . 92 ALA C 1 1 5 8850 1 1 92 ALA CA C -13.753 -10.266 -8.955 1.00 . A A . 92 ALA CA 1 1 5 8851 1 1 92 ALA CB C -15.057 -10.669 -8.263 1.00 . A A . 92 ALA CB 1 1 5 8852 1 1 92 ALA H H -13.609 -12.289 -9.430 1.00 . A A . 92 ALA H 1 1 5 8853 1 1 92 ALA HA H -13.993 -9.670 -9.835 1.00 . A A . 92 ALA HA 1 1 5 8854 1 1 92 ALA HB1 H -15.257 -11.724 -8.452 1.00 . A A . 92 ALA HB1 1 1 5 8855 1 1 92 ALA HB2 H -14.965 -10.504 -7.190 1.00 . A A . 92 ALA HB2 1 1 5 8856 1 1 92 ALA HB3 H -15.877 -10.068 -8.655 1.00 . A A . 92 ALA HB3 1 1 5 8857 1 1 92 ALA N N -13.054 -11.458 -9.404 1.00 . A A . 92 ALA N 1 1 5 8858 1 1 92 ALA O O -12.553 -8.289 -8.310 1.00 . A A . 92 ALA O 1 1 5 8859 1 1 93 LYS C C -10.176 -9.135 -6.694 1.00 . A A . 93 LYS C 1 1 5 8860 1 1 93 LYS CA C -11.509 -9.460 -6.016 1.00 . A A . 93 LYS CA 1 1 5 8861 1 1 93 LYS CB C -11.364 -10.317 -4.757 1.00 . A A . 93 LYS CB 1 1 5 8862 1 1 93 LYS CD C -12.505 -11.137 -2.662 1.00 . A A . 93 LYS CD 1 1 5 8863 1 1 93 LYS CE C -13.629 -12.160 -2.486 1.00 . A A . 93 LYS CE 1 1 5 8864 1 1 93 LYS CG C -12.674 -10.356 -3.967 1.00 . A A . 93 LYS CG 1 1 5 8865 1 1 93 LYS H H -12.623 -11.055 -6.760 1.00 . A A . 93 LYS H 1 1 5 8866 1 1 93 LYS HA H -11.981 -8.524 -5.716 1.00 . A A . 93 LYS HA 1 1 5 8867 1 1 93 LYS HB2 H -11.073 -11.330 -5.033 1.00 . A A . 93 LYS HB2 1 1 5 8868 1 1 93 LYS HB3 H -10.568 -9.917 -4.129 1.00 . A A . 93 LYS HB3 1 1 5 8869 1 1 93 LYS HD2 H -11.541 -11.646 -2.661 1.00 . A A . 93 LYS HD2 1 1 5 8870 1 1 93 LYS HD3 H -12.501 -10.447 -1.819 1.00 . A A . 93 LYS HD3 1 1 5 8871 1 1 93 LYS HE2 H -14.060 -12.067 -1.489 1.00 . A A . 93 LYS HE2 1 1 5 8872 1 1 93 LYS HE3 H -14.428 -11.958 -3.199 1.00 . A A . 93 LYS HE3 1 1 5 8873 1 1 93 LYS HG2 H -13.000 -9.339 -3.746 1.00 . A A . 93 LYS HG2 1 1 5 8874 1 1 93 LYS HG3 H -13.455 -10.816 -4.572 1.00 . A A . 93 LYS HG3 1 1 5 8875 1 1 93 LYS HZ1 H -12.313 -13.553 -3.305 1.00 . A A . 93 LYS HZ1 1 1 5 8876 1 1 93 LYS HZ2 H -12.822 -13.960 -1.812 1.00 . A A . 93 LYS HZ2 1 1 5 8877 1 1 93 LYS N N -12.390 -10.106 -6.973 1.00 . A A . 93 LYS N 1 1 5 8878 1 1 93 LYS NZ N -13.115 -13.534 -2.685 1.00 . A A . 93 LYS NZ 1 1 5 8879 1 1 93 LYS O O -9.584 -8.088 -6.437 1.00 . A A . 93 LYS O 1 1 5 8880 1 1 94 LYS C C -8.607 -8.664 -9.192 1.00 . A A . 94 LYS C 1 1 5 8881 1 1 94 LYS CA C -8.492 -9.876 -8.264 1.00 . A A . 94 LYS CA 1 1 5 8882 1 1 94 LYS CB C -8.102 -11.167 -8.985 1.00 . A A . 94 LYS CB 1 1 5 8883 1 1 94 LYS CD C -6.337 -12.161 -10.488 1.00 . A A . 94 LYS CD 1 1 5 8884 1 1 94 LYS CE C -4.832 -12.375 -10.662 1.00 . A A . 94 LYS CE 1 1 5 8885 1 1 94 LYS CG C -6.621 -11.154 -9.371 1.00 . A A . 94 LYS CG 1 1 5 8886 1 1 94 LYS H H -10.232 -10.900 -7.751 1.00 . A A . 94 LYS H 1 1 5 8887 1 1 94 LYS HA H -7.718 -9.672 -7.524 1.00 . A A . 94 LYS HA 1 1 5 8888 1 1 94 LYS HB2 H -8.305 -12.024 -8.342 1.00 . A A . 94 LYS HB2 1 1 5 8889 1 1 94 LYS HB3 H -8.714 -11.289 -9.879 1.00 . A A . 94 LYS HB3 1 1 5 8890 1 1 94 LYS HD2 H -6.818 -13.111 -10.257 1.00 . A A . 94 LYS HD2 1 1 5 8891 1 1 94 LYS HD3 H -6.768 -11.804 -11.423 1.00 . A A . 94 LYS HD3 1 1 5 8892 1 1 94 LYS HE2 H -4.303 -12.019 -9.778 1.00 . A A . 94 LYS HE2 1 1 5 8893 1 1 94 LYS HE3 H -4.618 -13.439 -10.754 1.00 . A A . 94 LYS HE3 1 1 5 8894 1 1 94 LYS HG2 H -6.336 -10.153 -9.698 1.00 . A A . 94 LYS HG2 1 1 5 8895 1 1 94 LYS HG3 H -6.012 -11.390 -8.499 1.00 . A A . 94 LYS HG3 1 1 5 8896 1 1 94 LYS HZ1 H -3.819 -10.825 -11.619 1.00 . A A . 94 LYS HZ1 1 1 5 8897 1 1 94 LYS HZ2 H -3.728 -12.237 -12.425 1.00 . A A . 94 LYS HZ2 1 1 5 8898 1 1 94 LYS N N -9.744 -10.052 -7.547 1.00 . A A . 94 LYS N 1 1 5 8899 1 1 94 LYS NZ N -4.342 -11.659 -11.861 1.00 . A A . 94 LYS NZ 1 1 5 8900 1 1 94 LYS O O -7.611 -8.214 -9.757 1.00 . A A . 94 LYS O 1 1 5 8901 1 1 95 LYS C C -10.575 -5.854 -9.308 1.00 . A A . 95 LYS C 1 1 5 8902 1 1 95 LYS CA C -10.087 -7.021 -10.170 1.00 . A A . 95 LYS CA 1 1 5 8903 1 1 95 LYS CB C -11.048 -7.394 -11.300 1.00 . A A . 95 LYS CB 1 1 5 8904 1 1 95 LYS CD C -11.167 -7.626 -13.808 1.00 . A A . 95 LYS CD 1 1 5 8905 1 1 95 LYS CE C -10.092 -8.043 -14.813 1.00 . A A . 95 LYS CE 1 1 5 8906 1 1 95 LYS CG C -10.556 -6.848 -12.642 1.00 . A A . 95 LYS CG 1 1 5 8907 1 1 95 LYS H H -10.634 -8.542 -8.856 1.00 . A A . 95 LYS H 1 1 5 8908 1 1 95 LYS HA H -9.141 -6.737 -10.631 1.00 . A A . 95 LYS HA 1 1 5 8909 1 1 95 LYS HB2 H -11.145 -8.478 -11.357 1.00 . A A . 95 LYS HB2 1 1 5 8910 1 1 95 LYS HB3 H -12.041 -6.997 -11.084 1.00 . A A . 95 LYS HB3 1 1 5 8911 1 1 95 LYS HD2 H -11.680 -8.511 -13.431 1.00 . A A . 95 LYS HD2 1 1 5 8912 1 1 95 LYS HD3 H -11.917 -7.012 -14.306 1.00 . A A . 95 LYS HD3 1 1 5 8913 1 1 95 LYS HE2 H -9.822 -7.193 -15.439 1.00 . A A . 95 LYS HE2 1 1 5 8914 1 1 95 LYS HE3 H -9.189 -8.348 -14.284 1.00 . A A . 95 LYS HE3 1 1 5 8915 1 1 95 LYS HG2 H -10.816 -5.793 -12.727 1.00 . A A . 95 LYS HG2 1 1 5 8916 1 1 95 LYS HG3 H -9.468 -6.913 -12.687 1.00 . A A . 95 LYS HG3 1 1 5 8917 1 1 95 LYS HZ1 H -11.167 -8.828 -16.417 1.00 . A A . 95 LYS HZ1 1 1 5 8918 1 1 95 LYS HZ2 H -9.814 -9.671 -16.085 1.00 . A A . 95 LYS HZ2 1 1 5 8919 1 1 95 LYS N N -9.830 -8.171 -9.320 1.00 . A A . 95 LYS N 1 1 5 8920 1 1 95 LYS NZ N -10.578 -9.156 -15.660 1.00 . A A . 95 LYS NZ 1 1 5 8921 1 1 95 LYS O O -10.729 -4.737 -9.799 1.00 . A A . 95 LYS O 1 1 5 8922 1 1 96 ASP C C -10.235 -4.967 -5.991 1.00 . A A . 96 ASP C 1 1 5 8923 1 1 96 ASP CA C -11.271 -5.144 -7.103 1.00 . A A . 96 ASP CA 1 1 5 8924 1 1 96 ASP CB C -12.593 -5.562 -6.456 1.00 . A A . 96 ASP CB 1 1 5 8925 1 1 96 ASP CG C -13.811 -4.744 -6.888 1.00 . A A . 96 ASP CG 1 1 5 8926 1 1 96 ASP H H -10.675 -7.065 -7.646 1.00 . A A . 96 ASP H 1 1 5 8927 1 1 96 ASP HA H -11.402 -4.241 -7.699 1.00 . A A . 96 ASP HA 1 1 5 8928 1 1 96 ASP HB2 H -12.778 -6.611 -6.687 1.00 . A A . 96 ASP HB2 1 1 5 8929 1 1 96 ASP HB3 H -12.489 -5.489 -5.373 1.00 . A A . 96 ASP HB3 1 1 5 8930 1 1 96 ASP N N -10.804 -6.154 -8.038 1.00 . A A . 96 ASP N 1 1 5 8931 1 1 96 ASP O O -10.425 -4.157 -5.085 1.00 . A A . 96 ASP O 1 1 5 8932 1 1 96 ASP OD1 O -13.943 -3.610 -6.379 1.00 . A A . 96 ASP OD1 1 1 5 8933 1 1 96 ASP OD2 O -14.584 -5.272 -7.717 1.00 . A A . 96 ASP OD2 1 1 5 8934 1 1 97 LEU C C -6.768 -5.408 -5.818 1.00 . A A . 97 LEU C 1 1 5 8935 1 1 97 LEU CA C -8.097 -5.676 -5.110 1.00 . A A . 97 LEU CA 1 1 5 8936 1 1 97 LEU CB C -8.091 -6.940 -4.248 1.00 . A A . 97 LEU CB 1 1 5 8937 1 1 97 LEU CD1 C -8.963 -8.186 -2.237 1.00 . A A . 97 LEU CD1 1 1 5 8938 1 1 97 LEU CD2 C -9.557 -5.744 -2.581 1.00 . A A . 97 LEU CD2 1 1 5 8939 1 1 97 LEU CG C -9.247 -7.082 -3.256 1.00 . A A . 97 LEU CG 1 1 5 8940 1 1 97 LEU H H -9.016 -6.394 -6.836 1.00 . A A . 97 LEU H 1 1 5 8941 1 1 97 LEU HA H -8.312 -4.837 -4.449 1.00 . A A . 97 LEU HA 1 1 5 8942 1 1 97 LEU HB2 H -8.098 -7.807 -4.910 1.00 . A A . 97 LEU HB2 1 1 5 8943 1 1 97 LEU HB3 H -7.155 -6.972 -3.691 1.00 . A A . 97 LEU HB3 1 1 5 8944 1 1 97 LEU HD11 H -7.894 -8.402 -2.223 1.00 . A A . 97 LEU HD11 1 1 5 8945 1 1 97 LEU HD12 H -9.280 -7.858 -1.247 1.00 . A A . 97 LEU HD12 1 1 5 8946 1 1 97 LEU HD13 H -9.512 -9.086 -2.514 1.00 . A A . 97 LEU HD13 1 1 5 8947 1 1 97 LEU HD21 H -8.641 -5.159 -2.496 1.00 . A A . 97 LEU HD21 1 1 5 8948 1 1 97 LEU HD22 H -10.285 -5.195 -3.178 1.00 . A A . 97 LEU HD22 1 1 5 8949 1 1 97 LEU HD23 H -9.965 -5.925 -1.587 1.00 . A A . 97 LEU HD23 1 1 5 8950 1 1 97 LEU HG H -10.139 -7.376 -3.810 1.00 . A A . 97 LEU HG 1 1 5 8951 1 1 97 LEU N N -9.163 -5.738 -6.096 1.00 . A A . 97 LEU N 1 1 5 8952 1 1 97 LEU O O -6.016 -4.520 -5.419 1.00 . A A . 97 LEU O 1 1 5 8953 1 1 98 THR C C -5.598 -5.502 -9.020 1.00 . A A . 98 THR C 1 1 5 8954 1 1 98 THR CA C -5.293 -6.050 -7.625 1.00 . A A . 98 THR CA 1 1 5 8955 1 1 98 THR CB C -4.589 -7.408 -7.646 1.00 . A A . 98 THR CB 1 1 5 8956 1 1 98 THR CG2 C -4.717 -8.155 -6.316 1.00 . A A . 98 THR CG2 1 1 5 8957 1 1 98 THR H H -7.136 -6.911 -7.176 1.00 . A A . 98 THR H 1 1 5 8958 1 1 98 THR HA H -4.658 -5.319 -7.126 1.00 . A A . 98 THR HA 1 1 5 8959 1 1 98 THR HB H -3.543 -7.300 -7.932 1.00 . A A . 98 THR HB 1 1 5 8960 1 1 98 THR HG1 H -6.263 -8.374 -8.166 1.00 . A A . 98 THR HG1 1 1 5 8961 1 1 98 THR HG21 H -5.769 -8.222 -6.037 1.00 . A A . 98 THR HG21 1 1 5 8962 1 1 98 THR HG22 H -4.304 -9.158 -6.422 1.00 . A A . 98 THR HG22 1 1 5 8963 1 1 98 THR HG23 H -4.170 -7.616 -5.543 1.00 . A A . 98 THR HG23 1 1 5 8964 1 1 98 THR N N -6.519 -6.192 -6.857 1.00 . A A . 98 THR N 1 1 5 8965 1 1 98 THR O O -4.729 -5.494 -9.891 1.00 . A A . 98 THR O 1 1 5 8966 1 1 98 THR OG1 O -5.362 -8.186 -8.556 1.00 . A A . 98 THR OG1 1 1 5 8967 1 1 99 GLY C C -6.455 -3.263 -10.827 1.00 . A A . 99 GLY C 1 1 5 8968 1 1 99 GLY CA C -7.265 -4.509 -10.465 1.00 . A A . 99 GLY CA 1 1 5 8969 1 1 99 GLY H H -7.535 -5.068 -8.476 1.00 . A A . 99 GLY H 1 1 5 8970 1 1 99 GLY HA2 H -7.150 -5.261 -11.245 1.00 . A A . 99 GLY HA2 1 1 5 8971 1 1 99 GLY HA3 H -8.324 -4.258 -10.417 1.00 . A A . 99 GLY HA3 1 1 5 8972 1 1 99 GLY N N -6.834 -5.057 -9.189 1.00 . A A . 99 GLY N 1 1 5 8973 1 1 99 GLY O O -5.999 -2.536 -9.945 1.00 . A A . 99 GLY O 1 1 5 8974 1 1 100 CYS C C -6.519 -0.733 -12.769 1.00 . A A . 100 CYS C 1 1 5 8975 1 1 100 CYS CA C -5.552 -1.909 -12.616 1.00 . A A . 100 CYS CA 1 1 5 8976 1 1 100 CYS CB C -4.826 -2.225 -13.925 1.00 . A A . 100 CYS CB 1 1 5 8977 1 1 100 CYS H H -6.673 -3.650 -12.837 1.00 . A A . 100 CYS H 1 1 5 8978 1 1 100 CYS HA H -4.790 -1.689 -11.868 1.00 . A A . 100 CYS HA 1 1 5 8979 1 1 100 CYS HB2 H -5.452 -2.890 -14.520 1.00 . A A . 100 CYS HB2 1 1 5 8980 1 1 100 CYS HB3 H -4.713 -1.301 -14.494 1.00 . A A . 100 CYS HB3 1 1 5 8981 1 1 100 CYS N N -6.299 -3.054 -12.126 1.00 . A A . 100 CYS N 1 1 5 8982 1 1 100 CYS O O -6.243 0.368 -12.295 1.00 . A A . 100 CYS O 1 1 5 8983 1 1 100 CYS SG S -3.178 -2.994 -13.724 1.00 . A A . 100 CYS SG 1 1 5 8984 1 1 101 LYS C C -10.006 -0.517 -13.204 1.00 . A A . 101 LYS C 1 1 5 8985 1 1 101 LYS CA C -8.643 0.014 -13.653 1.00 . A A . 101 LYS CA 1 1 5 8986 1 1 101 LYS CB C -8.616 0.487 -15.108 1.00 . A A . 101 LYS CB 1 1 5 8987 1 1 101 LYS CD C -10.139 1.625 -16.765 1.00 . A A . 101 LYS CD 1 1 5 8988 1 1 101 LYS CE C -9.535 2.771 -17.579 1.00 . A A . 101 LYS CE 1 1 5 8989 1 1 101 LYS CG C -9.608 1.631 -15.330 1.00 . A A . 101 LYS CG 1 1 5 8990 1 1 101 LYS H H -7.850 -1.906 -13.813 1.00 . A A . 101 LYS H 1 1 5 8991 1 1 101 LYS HA H -8.383 0.870 -13.031 1.00 . A A . 101 LYS HA 1 1 5 8992 1 1 101 LYS HB2 H -7.611 0.816 -15.369 1.00 . A A . 101 LYS HB2 1 1 5 8993 1 1 101 LYS HB3 H -8.860 -0.345 -15.769 1.00 . A A . 101 LYS HB3 1 1 5 8994 1 1 101 LYS HD2 H -9.903 0.672 -17.240 1.00 . A A . 101 LYS HD2 1 1 5 8995 1 1 101 LYS HD3 H -11.225 1.714 -16.755 1.00 . A A . 101 LYS HD3 1 1 5 8996 1 1 101 LYS HE2 H -8.656 3.163 -17.067 1.00 . A A . 101 LYS HE2 1 1 5 8997 1 1 101 LYS HE3 H -9.200 2.400 -18.548 1.00 . A A . 101 LYS HE3 1 1 5 8998 1 1 101 LYS HG2 H -10.438 1.538 -14.631 1.00 . A A . 101 LYS HG2 1 1 5 8999 1 1 101 LYS HG3 H -9.121 2.584 -15.123 1.00 . A A . 101 LYS HG3 1 1 5 9000 1 1 101 LYS HZ1 H -10.514 4.519 -17.008 1.00 . A A . 101 LYS HZ1 1 1 5 9001 1 1 101 LYS HZ2 H -10.361 4.374 -18.623 1.00 . A A . 101 LYS HZ2 1 1 5 9002 1 1 101 LYS N N -7.633 -1.007 -13.432 1.00 . A A . 101 LYS N 1 1 5 9003 1 1 101 LYS NZ N -10.528 3.851 -17.770 1.00 . A A . 101 LYS NZ 1 1 5 9004 1 1 101 LYS O O -10.344 -1.670 -13.465 1.00 . A A . 101 LYS O 1 1 5 9005 1 1 102 LYS C C -11.922 -0.973 -10.862 1.00 . A A . 102 LYS C 1 1 5 9006 1 1 102 LYS CA C -12.070 -0.016 -12.047 1.00 . A A . 102 LYS CA 1 1 5 9007 1 1 102 LYS CB C -12.927 -0.575 -13.184 1.00 . A A . 102 LYS CB 1 1 5 9008 1 1 102 LYS CD C -15.164 -1.656 -13.616 1.00 . A A . 102 LYS CD 1 1 5 9009 1 1 102 LYS CE C -16.361 -1.023 -14.326 1.00 . A A . 102 LYS CE 1 1 5 9010 1 1 102 LYS CG C -14.404 -0.617 -12.788 1.00 . A A . 102 LYS CG 1 1 5 9011 1 1 102 LYS H H -10.469 1.287 -12.327 1.00 . A A . 102 LYS H 1 1 5 9012 1 1 102 LYS HA H -12.554 0.895 -11.696 1.00 . A A . 102 LYS HA 1 1 5 9013 1 1 102 LYS HB2 H -12.803 0.042 -14.075 1.00 . A A . 102 LYS HB2 1 1 5 9014 1 1 102 LYS HB3 H -12.587 -1.577 -13.443 1.00 . A A . 102 LYS HB3 1 1 5 9015 1 1 102 LYS HD2 H -14.494 -2.101 -14.351 1.00 . A A . 102 LYS HD2 1 1 5 9016 1 1 102 LYS HD3 H -15.506 -2.463 -12.967 1.00 . A A . 102 LYS HD3 1 1 5 9017 1 1 102 LYS HE2 H -16.540 -0.023 -13.929 1.00 . A A . 102 LYS HE2 1 1 5 9018 1 1 102 LYS HE3 H -16.144 -0.910 -15.388 1.00 . A A . 102 LYS HE3 1 1 5 9019 1 1 102 LYS HG2 H -14.493 -0.855 -11.728 1.00 . A A . 102 LYS HG2 1 1 5 9020 1 1 102 LYS HG3 H -14.851 0.366 -12.933 1.00 . A A . 102 LYS HG3 1 1 5 9021 1 1 102 LYS HZ1 H -17.903 -1.844 -13.188 1.00 . A A . 102 LYS HZ1 1 1 5 9022 1 1 102 LYS HZ2 H -18.340 -1.541 -14.728 1.00 . A A . 102 LYS HZ2 1 1 5 9023 1 1 102 LYS N N -10.752 0.350 -12.535 1.00 . A A . 102 LYS N 1 1 5 9024 1 1 102 LYS NZ N -17.571 -1.857 -14.146 1.00 . A A . 102 LYS NZ 1 1 5 9025 1 1 102 LYS O O -12.607 -1.992 -10.793 1.00 . A A . 102 LYS O 1 1 5 9026 1 1 103 SER C C -11.060 -0.614 -7.515 1.00 . A A . 103 SER C 1 1 5 9027 1 1 103 SER CA C -10.776 -1.425 -8.781 1.00 . A A . 103 SER CA 1 1 5 9028 1 1 103 SER CB C -9.338 -1.948 -8.764 1.00 . A A . 103 SER CB 1 1 5 9029 1 1 103 SER H H -10.469 0.219 -10.022 1.00 . A A . 103 SER H 1 1 5 9030 1 1 103 SER HA H -11.466 -2.265 -8.860 1.00 . A A . 103 SER HA 1 1 5 9031 1 1 103 SER HB2 H -8.969 -1.962 -7.738 1.00 . A A . 103 SER HB2 1 1 5 9032 1 1 103 SER HB3 H -9.322 -2.977 -9.122 1.00 . A A . 103 SER HB3 1 1 5 9033 1 1 103 SER HG H -8.527 -0.194 -9.288 1.00 . A A . 103 SER HG 1 1 5 9034 1 1 103 SER N N -11.023 -0.611 -9.959 1.00 . A A . 103 SER N 1 1 5 9035 1 1 103 SER O O -11.570 0.503 -7.591 1.00 . A A . 103 SER O 1 1 5 9036 1 1 103 SER OG O -8.471 -1.153 -9.568 1.00 . A A . 103 SER OG 1 1 5 9037 1 1 104 LYS C C -9.891 0.552 -4.918 1.00 . A A . 104 LYS C 1 1 5 9038 1 1 104 LYS CA C -10.932 -0.555 -5.101 1.00 . A A . 104 LYS CA 1 1 5 9039 1 1 104 LYS CB C -10.941 -1.584 -3.969 1.00 . A A . 104 LYS CB 1 1 5 9040 1 1 104 LYS CD C -13.330 -1.719 -3.175 1.00 . A A . 104 LYS CD 1 1 5 9041 1 1 104 LYS CE C -14.130 -2.738 -2.360 1.00 . A A . 104 LYS CE 1 1 5 9042 1 1 104 LYS CG C -12.230 -2.407 -3.986 1.00 . A A . 104 LYS CG 1 1 5 9043 1 1 104 LYS H H -10.305 -2.117 -6.328 1.00 . A A . 104 LYS H 1 1 5 9044 1 1 104 LYS HA H -11.921 -0.097 -5.128 1.00 . A A . 104 LYS HA 1 1 5 9045 1 1 104 LYS HB2 H -10.081 -2.247 -4.068 1.00 . A A . 104 LYS HB2 1 1 5 9046 1 1 104 LYS HB3 H -10.842 -1.076 -3.009 1.00 . A A . 104 LYS HB3 1 1 5 9047 1 1 104 LYS HD2 H -12.887 -0.981 -2.507 1.00 . A A . 104 LYS HD2 1 1 5 9048 1 1 104 LYS HD3 H -13.999 -1.180 -3.847 1.00 . A A . 104 LYS HD3 1 1 5 9049 1 1 104 LYS HE2 H -13.477 -3.550 -2.042 1.00 . A A . 104 LYS HE2 1 1 5 9050 1 1 104 LYS HE3 H -14.516 -2.267 -1.456 1.00 . A A . 104 LYS HE3 1 1 5 9051 1 1 104 LYS HG2 H -12.564 -2.546 -5.014 1.00 . A A . 104 LYS HG2 1 1 5 9052 1 1 104 LYS HG3 H -12.038 -3.399 -3.576 1.00 . A A . 104 LYS HG3 1 1 5 9053 1 1 104 LYS HZ1 H -15.263 -2.898 -4.102 1.00 . A A . 104 LYS HZ1 1 1 5 9054 1 1 104 LYS HZ2 H -15.199 -4.287 -3.254 1.00 . A A . 104 LYS HZ2 1 1 5 9055 1 1 104 LYS N N -10.719 -1.208 -6.381 1.00 . A A . 104 LYS N 1 1 5 9056 1 1 104 LYS NZ N -15.250 -3.278 -3.162 1.00 . A A . 104 LYS NZ 1 1 5 9057 1 1 104 LYS O O -10.154 1.552 -4.253 1.00 . A A . 104 LYS O 1 1 5 9058 1 1 105 CYS C C -7.845 2.343 -6.536 1.00 . A A . 105 CYS C 1 1 5 9059 1 1 105 CYS CA C -7.650 1.300 -5.433 1.00 . A A . 105 CYS CA 1 1 5 9060 1 1 105 CYS CB C -6.280 0.625 -5.522 1.00 . A A . 105 CYS CB 1 1 5 9061 1 1 105 CYS H H -8.526 -0.482 -6.060 1.00 . A A . 105 CYS H 1 1 5 9062 1 1 105 CYS HA H -7.721 1.761 -4.448 1.00 . A A . 105 CYS HA 1 1 5 9063 1 1 105 CYS HB2 H -6.136 0.205 -6.517 1.00 . A A . 105 CYS HB2 1 1 5 9064 1 1 105 CYS HB3 H -5.491 1.363 -5.371 1.00 . A A . 105 CYS HB3 1 1 5 9065 1 1 105 CYS N N -8.731 0.334 -5.521 1.00 . A A . 105 CYS N 1 1 5 9066 1 1 105 CYS O O -8.131 3.505 -6.252 1.00 . A A . 105 CYS O 1 1 5 9067 1 1 105 CYS SG S -6.149 -0.695 -4.261 1.00 . A A . 105 CYS SG 1 1 5 9068 1 1 106 HIS C C -9.266 2.659 -9.457 1.00 . A A . 106 HIS C 1 1 5 9069 1 1 106 HIS CA C -7.839 2.768 -8.917 1.00 . A A . 106 HIS CA 1 1 5 9070 1 1 106 HIS CB C -6.778 2.467 -9.978 1.00 . A A . 106 HIS CB 1 1 5 9071 1 1 106 HIS CD2 C -4.310 1.804 -9.430 1.00 . A A . 106 HIS CD2 1 1 5 9072 1 1 106 HIS CE1 C -3.620 3.747 -8.698 1.00 . A A . 106 HIS CE1 1 1 5 9073 1 1 106 HIS CG C -5.359 2.672 -9.504 1.00 . A A . 106 HIS CG 1 1 5 9074 1 1 106 HIS H H -7.452 0.942 -7.991 1.00 . A A . 106 HIS H 1 1 5 9075 1 1 106 HIS HA H -7.671 3.783 -8.557 1.00 . A A . 106 HIS HA 1 1 5 9076 1 1 106 HIS HB2 H -6.894 1.436 -10.311 1.00 . A A . 106 HIS HB2 1 1 5 9077 1 1 106 HIS HB3 H -6.956 3.104 -10.845 1.00 . A A . 106 HIS HB3 1 1 5 9078 1 1 106 HIS HD1 H -5.428 4.731 -8.963 1.00 . A A . 106 HIS HD1 1 1 5 9079 1 1 106 HIS HD2 H -4.331 0.753 -9.721 1.00 . A A . 106 HIS HD2 1 1 5 9080 1 1 106 HIS HE1 H -2.974 4.526 -8.295 1.00 . A A . 106 HIS HE1 1 1 5 9081 1 1 106 HIS N N -7.684 1.889 -7.770 1.00 . A A . 106 HIS N 1 1 5 9082 1 1 106 HIS ND1 N -4.894 3.888 -9.035 1.00 . A A . 106 HIS ND1 1 1 5 9083 1 1 106 HIS NE2 N -3.260 2.454 -8.944 1.00 . A A . 106 HIS NE2 1 1 5 9084 1 1 106 HIS O O -9.755 1.560 -9.712 1.00 . A A . 106 HIS O 1 1 5 9085 1 1 107 GLU C C -11.309 4.665 -11.423 1.00 . A A . 107 GLU C 1 1 5 9086 1 1 107 GLU CA C -11.255 3.865 -10.120 1.00 . A A . 107 GLU CA 1 1 5 9087 1 1 107 GLU CB C -12.206 4.452 -9.076 1.00 . A A . 107 GLU CB 1 1 5 9088 1 1 107 GLU CD C -13.960 3.570 -7.492 1.00 . A A . 107 GLU CD 1 1 5 9089 1 1 107 GLU CG C -12.516 3.430 -7.980 1.00 . A A . 107 GLU CG 1 1 5 9090 1 1 107 GLU H H -9.488 4.705 -9.405 1.00 . A A . 107 GLU H 1 1 5 9091 1 1 107 GLU HA H -11.531 2.828 -10.311 1.00 . A A . 107 GLU HA 1 1 5 9092 1 1 107 GLU HB2 H -11.760 5.342 -8.632 1.00 . A A . 107 GLU HB2 1 1 5 9093 1 1 107 GLU HB3 H -13.132 4.766 -9.557 1.00 . A A . 107 GLU HB3 1 1 5 9094 1 1 107 GLU HG2 H -12.354 2.422 -8.361 1.00 . A A . 107 GLU HG2 1 1 5 9095 1 1 107 GLU HG3 H -11.831 3.569 -7.144 1.00 . A A . 107 GLU HG3 1 1 5 9096 1 1 107 GLU N N -9.894 3.815 -9.615 1.00 . A A . 107 GLU N 1 1 5 9097 1 1 107 GLU O O -12.357 5.198 -11.785 1.00 . A A . 107 GLU O 1 1 5 9098 1 1 107 GLU OXT O -10.252 4.745 -12.084 1.00 . A A . 107 GLU OXT 1 1 5 9099 1 1 107 GLU OE1 O -14.411 4.730 -7.382 1.00 . A A . 107 GLU OE1 1 1 5 9100 1 1 107 GLU OE2 O -14.578 2.514 -7.240 1.00 . A A . 107 GLU OE2 1 1 5 9101 2 2 1 HEC C1A C -1.133 5.436 9.283 1.00 . B A . 108 HEC C1A 1 1 5 9102 2 2 1 HEC C1B C -1.987 2.263 12.089 1.00 . B A . 108 HEC C1B 1 1 5 9103 2 2 1 HEC C1C C -2.143 -0.580 8.791 1.00 . B A . 108 HEC C1C 1 1 5 9104 2 2 1 HEC C1D C -1.095 2.581 6.037 1.00 . B A . 108 HEC C1D 1 1 5 9105 2 2 1 HEC C2A C -1.034 6.501 10.254 1.00 . B A . 108 HEC C2A 1 1 5 9106 2 2 1 HEC C2B C -2.406 1.356 13.131 1.00 . B A . 108 HEC C2B 1 1 5 9107 2 2 1 HEC C2C C -2.181 -1.647 7.820 1.00 . B A . 108 HEC C2C 1 1 5 9108 2 2 1 HEC C2D C -0.710 3.511 5.002 1.00 . B A . 108 HEC C2D 1 1 5 9109 2 2 1 HEC C3A C -1.233 5.948 11.469 1.00 . B A . 108 HEC C3A 1 1 5 9110 2 2 1 HEC C3B C -2.584 0.147 12.557 1.00 . B A . 108 HEC C3B 1 1 5 9111 2 2 1 HEC C3C C -1.869 -1.106 6.623 1.00 . B A . 108 HEC C3C 1 1 5 9112 2 2 1 HEC C3D C -0.626 4.730 5.575 1.00 . B A . 108 HEC C3D 1 1 5 9113 2 2 1 HEC C4A C -1.457 4.537 11.263 1.00 . B A . 108 HEC C4A 1 1 5 9114 2 2 1 HEC C4B C -2.277 0.294 11.154 1.00 . B A . 108 HEC C4B 1 1 5 9115 2 2 1 HEC C4C C -1.635 0.302 6.842 1.00 . B A . 108 HEC C4C 1 1 5 9116 2 2 1 HEC C4D C -0.959 4.568 6.970 1.00 . B A . 108 HEC C4D 1 1 5 9117 2 2 1 HEC CAA C -0.760 7.939 9.926 1.00 . B A . 108 HEC CAA 1 1 5 9118 2 2 1 HEC CAB C -3.018 -1.132 13.212 1.00 . B A . 108 HEC CAB 1 1 5 9119 2 2 1 HEC CAC C -1.772 -1.797 5.294 1.00 . B A . 108 HEC CAC 1 1 5 9120 2 2 1 HEC CAD C -0.262 6.033 4.925 1.00 . B A . 108 HEC CAD 1 1 5 9121 2 2 1 HEC CBA C 0.198 8.625 10.896 1.00 . B A . 108 HEC CBA 1 1 5 9122 2 2 1 HEC CBB C -4.276 -0.998 14.064 1.00 . B A . 108 HEC CBB 1 1 5 9123 2 2 1 HEC CBC C -2.765 -2.942 5.116 1.00 . B A . 108 HEC CBC 1 1 5 9124 2 2 1 HEC CBD C -0.900 6.244 3.555 1.00 . B A . 108 HEC CBD 1 1 5 9125 2 2 1 HEC CGA C -0.448 9.849 11.530 1.00 . B A . 108 HEC CGA 1 1 5 9126 2 2 1 HEC CGD C 0.145 6.625 2.516 1.00 . B A . 108 HEC CGD 1 1 5 9127 2 2 1 HEC CHA C -0.985 5.613 7.911 1.00 . B A . 108 HEC CHA 1 1 5 9128 2 2 1 HEC CHB C -1.704 3.610 12.292 1.00 . B A . 108 HEC CHB 1 1 5 9129 2 2 1 HEC CHC C -2.343 -0.747 10.210 1.00 . B A . 108 HEC CHC 1 1 5 9130 2 2 1 HEC CHD C -1.284 1.218 5.833 1.00 . B A . 108 HEC CHD 1 1 5 9131 2 2 1 HEC CMA C -1.230 6.631 12.806 1.00 . B A . 108 HEC CMA 1 1 5 9132 2 2 1 HEC CMB C -2.595 1.732 14.572 1.00 . B A . 108 HEC CMB 1 1 5 9133 2 2 1 HEC CMC C -2.510 -3.079 8.129 1.00 . B A . 108 HEC CMC 1 1 5 9134 2 2 1 HEC CMD C -0.460 3.144 3.568 1.00 . B A . 108 HEC CMD 1 1 5 9135 2 2 1 HEC FE FE -1.589 2.423 9.054 1.00 . B A . 108 HEC FE 1 1 5 9136 2 2 1 HEC HAA1 H -0.315 8.007 8.933 1.00 . B A . 108 HEC HAA1 1 1 5 9137 2 2 1 HEC HAA2 H -1.694 8.501 9.945 1.00 . B A . 108 HEC HAA2 1 1 5 9138 2 2 1 HEC HAB H -3.226 -1.880 12.447 1.00 . B A . 108 HEC HAB 1 1 5 9139 2 2 1 HEC HAC H -1.964 -1.078 4.497 1.00 . B A . 108 HEC HAC 1 1 5 9140 2 2 1 HEC HAD1 H -0.583 6.859 5.560 1.00 . B A . 108 HEC HAD1 1 1 5 9141 2 2 1 HEC HAD2 H 0.819 6.080 4.787 1.00 . B A . 108 HEC HAD2 1 1 5 9142 2 2 1 HEC HBA1 H 0.476 7.928 11.686 1.00 . B A . 108 HEC HBA1 1 1 5 9143 2 2 1 HEC HBA2 H 1.093 8.942 10.360 1.00 . B A . 108 HEC HBA2 1 1 5 9144 2 2 1 HEC HBB1 H -4.952 -0.277 13.603 1.00 . B A . 108 HEC HBB1 1 1 5 9145 2 2 1 HEC HBB2 H -4.771 -1.966 14.136 1.00 . B A . 108 HEC HBB2 1 1 5 9146 2 2 1 HEC HBB3 H -4.004 -0.654 15.062 1.00 . B A . 108 HEC HBB3 1 1 5 9147 2 2 1 HEC HBC1 H -3.739 -2.643 5.502 1.00 . B A . 108 HEC HBC1 1 1 5 9148 2 2 1 HEC HBC2 H -2.853 -3.185 4.057 1.00 . B A . 108 HEC HBC2 1 1 5 9149 2 2 1 HEC HBC3 H -2.411 -3.817 5.661 1.00 . B A . 108 HEC HBC3 1 1 5 9150 2 2 1 HEC HBD1 H -1.389 5.324 3.237 1.00 . B A . 108 HEC HBD1 1 1 5 9151 2 2 1 HEC HBD2 H -1.637 7.045 3.617 1.00 . B A . 108 HEC HBD2 1 1 5 9152 2 2 1 HEC HHA H -0.882 6.631 7.535 1.00 . B A . 108 HEC HHA 1 1 5 9153 2 2 1 HEC HHB H -1.670 3.977 13.318 1.00 . B A . 108 HEC HHB 1 1 5 9154 2 2 1 HEC HHC H -2.539 -1.752 10.583 1.00 . B A . 108 HEC HHC 1 1 5 9155 2 2 1 HEC HHD H -1.152 0.828 4.824 1.00 . B A . 108 HEC HHD 1 1 5 9156 2 2 1 HEC HMA1 H -1.699 7.611 12.714 1.00 . B A . 108 HEC HMA1 1 1 5 9157 2 2 1 HEC HMA2 H -1.786 6.028 13.523 1.00 . B A . 108 HEC HMA2 1 1 5 9158 2 2 1 HEC HMA3 H -0.203 6.751 13.151 1.00 . B A . 108 HEC HMA3 1 1 5 9159 2 2 1 HEC HMB1 H -3.529 1.305 14.939 1.00 . B A . 108 HEC HMB1 1 1 5 9160 2 2 1 HEC HMB2 H -1.764 1.345 15.161 1.00 . B A . 108 HEC HMB2 1 1 5 9161 2 2 1 HEC HMB3 H -2.631 2.817 14.663 1.00 . B A . 108 HEC HMB3 1 1 5 9162 2 2 1 HEC HMC1 H -1.766 -3.730 7.672 1.00 . B A . 108 HEC HMC1 1 1 5 9163 2 2 1 HEC HMC2 H -2.509 -3.226 9.209 1.00 . B A . 108 HEC HMC2 1 1 5 9164 2 2 1 HEC HMC3 H -3.496 -3.319 7.731 1.00 . B A . 108 HEC HMC3 1 1 5 9165 2 2 1 HEC HMD1 H -1.412 3.047 3.046 1.00 . B A . 108 HEC HMD1 1 1 5 9166 2 2 1 HEC HMD2 H 0.137 3.922 3.093 1.00 . B A . 108 HEC HMD2 1 1 5 9167 2 2 1 HEC HMD3 H 0.077 2.196 3.523 1.00 . B A . 108 HEC HMD3 1 1 5 9168 2 2 1 HEC NA N -1.393 4.233 9.915 1.00 . B A . 108 HEC NA 1 1 5 9169 2 2 1 HEC NB N -1.911 1.600 10.877 1.00 . B A . 108 HEC NB 1 1 5 9170 2 2 1 HEC NC N -1.807 0.615 8.179 1.00 . B A . 108 HEC NC 1 1 5 9171 2 2 1 HEC ND N -1.246 3.242 7.244 1.00 . B A . 108 HEC ND 1 1 5 9172 2 2 1 HEC O1A O 0.261 10.873 11.638 1.00 . B A . 108 HEC O1A 1 1 5 9173 2 2 1 HEC O1D O 0.127 7.802 2.098 1.00 . B A . 108 HEC O1D 1 1 5 9174 2 2 1 HEC O2A O -1.638 9.737 11.896 1.00 . B A . 108 HEC O2A 1 1 5 9175 2 2 1 HEC O2D O 0.942 5.731 2.159 1.00 . B A . 108 HEC O2D 1 1 5 9176 3 2 1 HEC C1A C 9.635 -1.691 1.798 1.00 . C A . 109 HEC C1A 1 1 5 9177 3 2 1 HEC C1B C 5.780 0.004 2.772 1.00 . C A . 109 HEC C1B 1 1 5 9178 3 2 1 HEC C1C C 7.777 3.050 5.207 1.00 . C A . 109 HEC C1C 1 1 5 9179 3 2 1 HEC C1D C 11.607 1.510 3.930 1.00 . C A . 109 HEC C1D 1 1 5 9180 3 2 1 HEC C2A C 9.140 -2.790 1.004 1.00 . C A . 109 HEC C2A 1 1 5 9181 3 2 1 HEC C2B C 4.420 0.350 3.110 1.00 . C A . 109 HEC C2B 1 1 5 9182 3 2 1 HEC C2C C 8.284 4.200 5.917 1.00 . C A . 109 HEC C2C 1 1 5 9183 3 2 1 HEC C2D C 12.960 1.075 3.675 1.00 . C A . 109 HEC C2D 1 1 5 9184 3 2 1 HEC C3A C 7.796 -2.672 0.957 1.00 . C A . 109 HEC C3A 1 1 5 9185 3 2 1 HEC C3B C 4.477 1.398 3.960 1.00 . C A . 109 HEC C3B 1 1 5 9186 3 2 1 HEC C3C C 9.627 4.186 5.788 1.00 . C A . 109 HEC C3C 1 1 5 9187 3 2 1 HEC C3D C 12.882 -0.070 2.965 1.00 . C A . 109 HEC C3D 1 1 5 9188 3 2 1 HEC C4A C 7.446 -1.497 1.722 1.00 . C A . 109 HEC C4A 1 1 5 9189 3 2 1 HEC C4B C 5.873 1.710 4.156 1.00 . C A . 109 HEC C4B 1 1 5 9190 3 2 1 HEC C4C C 9.966 3.027 4.996 1.00 . C A . 109 HEC C4C 1 1 5 9191 3 2 1 HEC C4D C 11.480 -0.355 2.772 1.00 . C A . 109 HEC C4D 1 1 5 9192 3 2 1 HEC CAA C 9.997 -3.846 0.368 1.00 . C A . 109 HEC CAA 1 1 5 9193 3 2 1 HEC CAB C 3.335 2.129 4.603 1.00 . C A . 109 HEC CAB 1 1 5 9194 3 2 1 HEC CAC C 10.620 5.166 6.343 1.00 . C A . 109 HEC CAC 1 1 5 9195 3 2 1 HEC CAD C 14.009 -0.919 2.452 1.00 . C A . 109 HEC CAD 1 1 5 9196 3 2 1 HEC CBA C 10.316 -3.584 -1.101 1.00 . C A . 109 HEC CBA 1 1 5 9197 3 2 1 HEC CBB C 2.313 1.216 5.275 1.00 . C A . 109 HEC CBB 1 1 5 9198 3 2 1 HEC CBC C 10.593 5.282 7.864 1.00 . C A . 109 HEC CBC 1 1 5 9199 3 2 1 HEC CBD C 15.193 -1.022 3.409 1.00 . C A . 109 HEC CBD 1 1 5 9200 3 2 1 HEC CGA C 11.203 -4.681 -1.672 1.00 . C A . 109 HEC CGA 1 1 5 9201 3 2 1 HEC CGD C 16.445 -0.406 2.801 1.00 . C A . 109 HEC CGD 1 1 5 9202 3 2 1 HEC CHA C 10.981 -1.470 2.075 1.00 . C A . 109 HEC CHA 1 1 5 9203 3 2 1 HEC CHB C 6.133 -1.032 1.913 1.00 . C A . 109 HEC CHB 1 1 5 9204 3 2 1 HEC CHC C 6.351 2.746 4.979 1.00 . C A . 109 HEC CHC 1 1 5 9205 3 2 1 HEC CHD C 11.276 2.660 4.638 1.00 . C A . 109 HEC CHD 1 1 5 9206 3 2 1 HEC CMA C 6.813 -3.565 0.258 1.00 . C A . 109 HEC CMA 1 1 5 9207 3 2 1 HEC CMB C 3.200 -0.352 2.590 1.00 . C A . 109 HEC CMB 1 1 5 9208 3 2 1 HEC CMC C 7.437 5.200 6.649 1.00 . C A . 109 HEC CMC 1 1 5 9209 3 2 1 HEC CMD C 14.194 1.794 4.136 1.00 . C A . 109 HEC CMD 1 1 5 9210 3 2 1 HEC FE FE 8.694 0.726 3.417 1.00 . C A . 109 HEC FE 1 1 5 9211 3 2 1 HEC HAA1 H 10.947 -3.909 0.898 1.00 . C A . 109 HEC HAA1 1 1 5 9212 3 2 1 HEC HAA2 H 9.487 -4.808 0.420 1.00 . C A . 109 HEC HAA2 1 1 5 9213 3 2 1 HEC HAB H 3.719 2.801 5.371 1.00 . C A . 109 HEC HAB 1 1 5 9214 3 2 1 HEC HAC H 11.627 4.862 6.061 1.00 . C A . 109 HEC HAC 1 1 5 9215 3 2 1 HEC HAD1 H 13.649 -1.932 2.275 1.00 . C A . 109 HEC HAD1 1 1 5 9216 3 2 1 HEC HAD2 H 14.385 -0.498 1.520 1.00 . C A . 109 HEC HAD2 1 1 5 9217 3 2 1 HEC HBA1 H 9.390 -3.551 -1.674 1.00 . C A . 109 HEC HBA1 1 1 5 9218 3 2 1 HEC HBA2 H 10.836 -2.631 -1.195 1.00 . C A . 109 HEC HBA2 1 1 5 9219 3 2 1 HEC HBB1 H 2.297 1.416 6.347 1.00 . C A . 109 HEC HBB1 1 1 5 9220 3 2 1 HEC HBB2 H 1.325 1.406 4.855 1.00 . C A . 109 HEC HBB2 1 1 5 9221 3 2 1 HEC HBB3 H 2.587 0.175 5.104 1.00 . C A . 109 HEC HBB3 1 1 5 9222 3 2 1 HEC HBC1 H 9.852 6.025 8.160 1.00 . C A . 109 HEC HBC1 1 1 5 9223 3 2 1 HEC HBC2 H 10.332 4.317 8.298 1.00 . C A . 109 HEC HBC2 1 1 5 9224 3 2 1 HEC HBC3 H 11.576 5.587 8.223 1.00 . C A . 109 HEC HBC3 1 1 5 9225 3 2 1 HEC HBD1 H 14.960 -0.495 4.334 1.00 . C A . 109 HEC HBD1 1 1 5 9226 3 2 1 HEC HBD2 H 15.392 -2.071 3.629 1.00 . C A . 109 HEC HBD2 1 1 5 9227 3 2 1 HEC HHA H 11.702 -2.211 1.729 1.00 . C A . 109 HEC HHA 1 1 5 9228 3 2 1 HEC HHB H 5.339 -1.521 1.348 1.00 . C A . 109 HEC HHB 1 1 5 9229 3 2 1 HEC HHC H 5.612 3.359 5.496 1.00 . C A . 109 HEC HHC 1 1 5 9230 3 2 1 HEC HHD H 12.084 3.326 4.939 1.00 . C A . 109 HEC HHD 1 1 5 9231 3 2 1 HEC HMA1 H 7.276 -3.986 -0.635 1.00 . C A . 109 HEC HMA1 1 1 5 9232 3 2 1 HEC HMA2 H 6.515 -4.372 0.927 1.00 . C A . 109 HEC HMA2 1 1 5 9233 3 2 1 HEC HMA3 H 5.935 -2.986 -0.027 1.00 . C A . 109 HEC HMA3 1 1 5 9234 3 2 1 HEC HMB1 H 2.947 -1.180 3.252 1.00 . C A . 109 HEC HMB1 1 1 5 9235 3 2 1 HEC HMB2 H 2.366 0.349 2.549 1.00 . C A . 109 HEC HMB2 1 1 5 9236 3 2 1 HEC HMB3 H 3.401 -0.735 1.589 1.00 . C A . 109 HEC HMB3 1 1 5 9237 3 2 1 HEC HMC1 H 7.325 6.097 6.041 1.00 . C A . 109 HEC HMC1 1 1 5 9238 3 2 1 HEC HMC2 H 6.454 4.769 6.845 1.00 . C A . 109 HEC HMC2 1 1 5 9239 3 2 1 HEC HMC3 H 7.914 5.458 7.594 1.00 . C A . 109 HEC HMC3 1 1 5 9240 3 2 1 HEC HMD1 H 15.066 1.384 3.625 1.00 . C A . 109 HEC HMD1 1 1 5 9241 3 2 1 HEC HMD2 H 14.104 2.855 3.905 1.00 . C A . 109 HEC HMD2 1 1 5 9242 3 2 1 HEC HMD3 H 14.310 1.665 5.212 1.00 . C A . 109 HEC HMD3 1 1 5 9243 3 2 1 HEC NA N 8.586 -0.901 2.234 1.00 . C A . 109 HEC NA 1 1 5 9244 3 2 1 HEC NB N 6.666 0.847 3.420 1.00 . C A . 109 HEC NB 1 1 5 9245 3 2 1 HEC NC N 8.820 2.335 4.644 1.00 . C A . 109 HEC NC 1 1 5 9246 3 2 1 HEC ND N 10.704 0.623 3.369 1.00 . C A . 109 HEC ND 1 1 5 9247 3 2 1 HEC O1A O 11.756 -5.448 -0.854 1.00 . C A . 109 HEC O1A 1 1 5 9248 3 2 1 HEC O1D O 16.279 0.526 1.984 1.00 . C A . 109 HEC O1D 1 1 5 9249 3 2 1 HEC O2A O 11.311 -4.733 -2.916 1.00 . C A . 109 HEC O2A 1 1 5 9250 3 2 1 HEC O2D O 17.544 -0.878 3.164 1.00 . C A . 109 HEC O2D 1 1 5 9251 4 2 1 HEC C1A C -8.651 -3.309 0.484 1.00 . D A . 110 HEC C1A 1 1 5 9252 4 2 1 HEC C1B C -4.929 -1.146 0.119 1.00 . D A . 110 HEC C1B 1 1 5 9253 4 2 1 HEC C1C C -2.841 -4.421 2.048 1.00 . D A . 110 HEC C1C 1 1 5 9254 4 2 1 HEC C1D C -6.575 -6.562 2.429 1.00 . D A . 110 HEC C1D 1 1 5 9255 4 2 1 HEC C2A C -9.480 -2.339 -0.191 1.00 . D A . 110 HEC C2A 1 1 5 9256 4 2 1 HEC C2B C -3.770 -0.313 -0.105 1.00 . D A . 110 HEC C2B 1 1 5 9257 4 2 1 HEC C2C C -1.999 -5.443 2.622 1.00 . D A . 110 HEC C2C 1 1 5 9258 4 2 1 HEC C2D C -7.746 -7.346 2.747 1.00 . D A . 110 HEC C2D 1 1 5 9259 4 2 1 HEC C3A C -8.675 -1.321 -0.565 1.00 . D A . 110 HEC C3A 1 1 5 9260 4 2 1 HEC C3B C -2.718 -0.933 0.470 1.00 . D A . 110 HEC C3B 1 1 5 9261 4 2 1 HEC C3C C -2.799 -6.479 2.951 1.00 . D A . 110 HEC C3C 1 1 5 9262 4 2 1 HEC C3D C -8.814 -6.677 2.263 1.00 . D A . 110 HEC C3D 1 1 5 9263 4 2 1 HEC C4A C -7.340 -1.652 -0.126 1.00 . D A . 110 HEC C4A 1 1 5 9264 4 2 1 HEC C4B C -3.215 -2.155 1.057 1.00 . D A . 110 HEC C4B 1 1 5 9265 4 2 1 HEC C4C C -4.145 -6.109 2.583 1.00 . D A . 110 HEC C4C 1 1 5 9266 4 2 1 HEC C4D C -8.315 -5.472 1.642 1.00 . D A . 110 HEC C4D 1 1 5 9267 4 2 1 HEC CAA C -10.958 -2.477 -0.412 1.00 . D A . 110 HEC CAA 1 1 5 9268 4 2 1 HEC CAB C -1.289 -0.476 0.517 1.00 . D A . 110 HEC CAB 1 1 5 9269 4 2 1 HEC CAC C -2.409 -7.786 3.579 1.00 . D A . 110 HEC CAC 1 1 5 9270 4 2 1 HEC CAD C -10.261 -7.071 2.335 1.00 . D A . 110 HEC CAD 1 1 5 9271 4 2 1 HEC CBA C -11.803 -2.134 0.811 1.00 . D A . 110 HEC CBA 1 1 5 9272 4 2 1 HEC CBB C -1.116 0.980 0.937 1.00 . D A . 110 HEC CBB 1 1 5 9273 4 2 1 HEC CBC C -1.105 -7.729 4.370 1.00 . D A . 110 HEC CBC 1 1 5 9274 4 2 1 HEC CBD C -10.970 -7.074 0.984 1.00 . D A . 110 HEC CBD 1 1 5 9275 4 2 1 HEC CGA C -13.143 -1.538 0.402 1.00 . D A . 110 HEC CGA 1 1 5 9276 4 2 1 HEC CGD C -12.216 -6.200 1.018 1.00 . D A . 110 HEC CGD 1 1 5 9277 4 2 1 HEC CHA C -9.123 -4.504 1.018 1.00 . D A . 110 HEC CHA 1 1 5 9278 4 2 1 HEC CHB C -6.210 -0.840 -0.328 1.00 . D A . 110 HEC CHB 1 1 5 9279 4 2 1 HEC CHC C -2.422 -3.085 1.753 1.00 . D A . 110 HEC CHC 1 1 5 9280 4 2 1 HEC CHD C -5.276 -6.926 2.766 1.00 . D A . 110 HEC CHD 1 1 5 9281 4 2 1 HEC CMA C -9.052 -0.067 -1.299 1.00 . D A . 110 HEC CMA 1 1 5 9282 4 2 1 HEC CMB C -3.781 0.992 -0.847 1.00 . D A . 110 HEC CMB 1 1 5 9283 4 2 1 HEC CMC C -0.512 -5.331 2.801 1.00 . D A . 110 HEC CMC 1 1 5 9284 4 2 1 HEC CMD C -7.730 -8.655 3.480 1.00 . D A . 110 HEC CMD 1 1 5 9285 4 2 1 HEC FE FE -5.752 -3.852 1.283 1.00 . D A . 110 HEC FE 1 1 5 9286 4 2 1 HEC HAA1 H -11.269 -1.810 -1.216 1.00 . D A . 110 HEC HAA1 1 1 5 9287 4 2 1 HEC HAA2 H -11.190 -3.507 -0.684 1.00 . D A . 110 HEC HAA2 1 1 5 9288 4 2 1 HEC HAB H -0.737 -1.085 1.233 1.00 . D A . 110 HEC HAB 1 1 5 9289 4 2 1 HEC HAC H -3.190 -8.105 4.268 1.00 . D A . 110 HEC HAC 1 1 5 9290 4 2 1 HEC HAD1 H -10.343 -8.078 2.744 1.00 . D A . 110 HEC HAD1 1 1 5 9291 4 2 1 HEC HAD2 H -10.796 -6.372 2.978 1.00 . D A . 110 HEC HAD2 1 1 5 9292 4 2 1 HEC HBA1 H -11.987 -3.038 1.392 1.00 . D A . 110 HEC HBA1 1 1 5 9293 4 2 1 HEC HBA2 H -11.273 -1.408 1.427 1.00 . D A . 110 HEC HBA2 1 1 5 9294 4 2 1 HEC HBB1 H -0.763 1.564 0.087 1.00 . D A . 110 HEC HBB1 1 1 5 9295 4 2 1 HEC HBB2 H -2.073 1.377 1.278 1.00 . D A . 110 HEC HBB2 1 1 5 9296 4 2 1 HEC HBB3 H -0.389 1.041 1.747 1.00 . D A . 110 HEC HBB3 1 1 5 9297 4 2 1 HEC HBC1 H -0.275 -7.540 3.689 1.00 . D A . 110 HEC HBC1 1 1 5 9298 4 2 1 HEC HBC2 H -1.161 -6.927 5.106 1.00 . D A . 110 HEC HBC2 1 1 5 9299 4 2 1 HEC HBC3 H -0.948 -8.680 4.879 1.00 . D A . 110 HEC HBC3 1 1 5 9300 4 2 1 HEC HBD1 H -10.296 -6.690 0.218 1.00 . D A . 110 HEC HBD1 1 1 5 9301 4 2 1 HEC HBD2 H -11.266 -8.092 0.731 1.00 . D A . 110 HEC HBD2 1 1 5 9302 4 2 1 HEC HHA H -10.191 -4.708 0.950 1.00 . D A . 110 HEC HHA 1 1 5 9303 4 2 1 HEC HHB H -6.352 0.093 -0.873 1.00 . D A . 110 HEC HHB 1 1 5 9304 4 2 1 HEC HHC H -1.426 -2.766 2.061 1.00 . D A . 110 HEC HHC 1 1 5 9305 4 2 1 HEC HHD H -5.117 -7.913 3.202 1.00 . D A . 110 HEC HHD 1 1 5 9306 4 2 1 HEC HMA1 H -9.067 -0.264 -2.371 1.00 . D A . 110 HEC HMA1 1 1 5 9307 4 2 1 HEC HMA2 H -10.040 0.260 -0.976 1.00 . D A . 110 HEC HMA2 1 1 5 9308 4 2 1 HEC HMA3 H -8.322 0.713 -1.083 1.00 . D A . 110 HEC HMA3 1 1 5 9309 4 2 1 HEC HMB1 H -2.852 1.100 -1.406 1.00 . D A . 110 HEC HMB1 1 1 5 9310 4 2 1 HEC HMB2 H -4.625 1.011 -1.537 1.00 . D A . 110 HEC HMB2 1 1 5 9311 4 2 1 HEC HMB3 H -3.875 1.813 -0.136 1.00 . D A . 110 HEC HMB3 1 1 5 9312 4 2 1 HEC HMC1 H -0.188 -4.327 2.526 1.00 . D A . 110 HEC HMC1 1 1 5 9313 4 2 1 HEC HMC2 H -0.256 -5.523 3.843 1.00 . D A . 110 HEC HMC2 1 1 5 9314 4 2 1 HEC HMC3 H -0.014 -6.061 2.163 1.00 . D A . 110 HEC HMC3 1 1 5 9315 4 2 1 HEC HMD1 H -8.585 -8.705 4.153 1.00 . D A . 110 HEC HMD1 1 1 5 9316 4 2 1 HEC HMD2 H -7.783 -9.474 2.762 1.00 . D A . 110 HEC HMD2 1 1 5 9317 4 2 1 HEC HMD3 H -6.808 -8.738 4.056 1.00 . D A . 110 HEC HMD3 1 1 5 9318 4 2 1 HEC NA N -7.336 -2.877 0.518 1.00 . D A . 110 HEC NA 1 1 5 9319 4 2 1 HEC NB N -4.576 -2.276 0.835 1.00 . D A . 110 HEC NB 1 1 5 9320 4 2 1 HEC NC N -4.160 -4.841 2.029 1.00 . D A . 110 HEC NC 1 1 5 9321 4 2 1 HEC ND N -6.937 -5.412 1.750 1.00 . D A . 110 HEC ND 1 1 5 9322 4 2 1 HEC O1A O -14.170 -2.164 0.742 1.00 . D A . 110 HEC O1A 1 1 5 9323 4 2 1 HEC O1D O -13.178 -6.554 0.302 1.00 . D A . 110 HEC O1D 1 1 5 9324 4 2 1 HEC O2A O -13.115 -0.468 -0.244 1.00 . D A . 110 HEC O2A 1 1 5 9325 4 2 1 HEC O2D O -12.184 -5.194 1.759 1.00 . D A . 110 HEC O2D 1 1 5 9326 5 2 1 HEC C1A C 0.009 4.098 -9.199 1.00 . E A . 111 HEC C1A 1 1 5 9327 5 2 1 HEC C1B C -1.317 0.661 -11.458 1.00 . E A . 111 HEC C1B 1 1 5 9328 5 2 1 HEC C1C C -3.116 -0.993 -7.854 1.00 . E A . 111 HEC C1C 1 1 5 9329 5 2 1 HEC C1D C -1.807 2.472 -5.631 1.00 . E A . 111 HEC C1D 1 1 5 9330 5 2 1 HEC C2A C 0.641 4.789 -10.299 1.00 . E A . 111 HEC C2A 1 1 5 9331 5 2 1 HEC C2B C -1.505 -0.490 -12.311 1.00 . E A . 111 HEC C2B 1 1 5 9332 5 2 1 HEC C2C C -3.870 -1.607 -6.786 1.00 . E A . 111 HEC C2C 1 1 5 9333 5 2 1 HEC C2D C -1.306 3.470 -4.715 1.00 . E A . 111 HEC C2D 1 1 5 9334 5 2 1 HEC C3A C 0.444 4.039 -11.403 1.00 . E A . 111 HEC C3A 1 1 5 9335 5 2 1 HEC C3B C -2.114 -1.438 -11.568 1.00 . E A . 111 HEC C3B 1 1 5 9336 5 2 1 HEC C3C C -3.764 -0.799 -5.710 1.00 . E A . 111 HEC C3C 1 1 5 9337 5 2 1 HEC C3D C -0.586 4.351 -5.442 1.00 . E A . 111 HEC C3D 1 1 5 9338 5 2 1 HEC C4A C -0.311 2.877 -10.999 1.00 . E A . 111 HEC C4A 1 1 5 9339 5 2 1 HEC C4B C -2.309 -0.885 -10.249 1.00 . E A . 111 HEC C4B 1 1 5 9340 5 2 1 HEC C4C C -2.943 0.323 -6.101 1.00 . E A . 111 HEC C4C 1 1 5 9341 5 2 1 HEC C4D C -0.635 3.907 -6.815 1.00 . E A . 111 HEC C4D 1 1 5 9342 5 2 1 HEC CAA C 1.369 6.096 -10.187 1.00 . E A . 111 HEC CAA 1 1 5 9343 5 2 1 HEC CAB C -2.528 -2.818 -11.991 1.00 . E A . 111 HEC CAB 1 1 5 9344 5 2 1 HEC CAC C -4.365 -0.990 -4.348 1.00 . E A . 111 HEC CAC 1 1 5 9345 5 2 1 HEC CAD C 0.142 5.571 -4.959 1.00 . E A . 111 HEC CAD 1 1 5 9346 5 2 1 HEC CBA C 2.738 6.104 -10.862 1.00 . E A . 111 HEC CBA 1 1 5 9347 5 2 1 HEC CBB C -1.493 -3.897 -11.686 1.00 . E A . 111 HEC CBB 1 1 5 9348 5 2 1 HEC CBC C -4.191 -2.397 -3.783 1.00 . E A . 111 HEC CBC 1 1 5 9349 5 2 1 HEC CBD C -0.773 6.744 -4.615 1.00 . E A . 111 HEC CBD 1 1 5 9350 5 2 1 HEC CGA C 2.819 7.192 -11.924 1.00 . E A . 111 HEC CGA 1 1 5 9351 5 2 1 HEC CGD C -0.002 8.056 -4.610 1.00 . E A . 111 HEC CGD 1 1 5 9352 5 2 1 HEC CHA C -0.003 4.563 -7.888 1.00 . E A . 111 HEC CHA 1 1 5 9353 5 2 1 HEC CHB C -0.718 1.848 -11.868 1.00 . E A . 111 HEC CHB 1 1 5 9354 5 2 1 HEC CHC C -2.916 -1.568 -9.180 1.00 . E A . 111 HEC CHC 1 1 5 9355 5 2 1 HEC CHD C -2.596 1.391 -5.254 1.00 . E A . 111 HEC CHD 1 1 5 9356 5 2 1 HEC CMA C 0.904 4.319 -12.804 1.00 . E A . 111 HEC CMA 1 1 5 9357 5 2 1 HEC CMB C -1.085 -0.570 -13.750 1.00 . E A . 111 HEC CMB 1 1 5 9358 5 2 1 HEC CMC C -4.618 -2.904 -6.897 1.00 . E A . 111 HEC CMC 1 1 5 9359 5 2 1 HEC CMD C -1.563 3.484 -3.236 1.00 . E A . 111 HEC CMD 1 1 5 9360 5 2 1 HEC FE FE -1.582 1.569 -8.544 1.00 . E A . 111 HEC FE 1 1 5 9361 5 2 1 HEC HAA1 H 0.776 6.884 -10.652 1.00 . E A . 111 HEC HAA1 1 1 5 9362 5 2 1 HEC HAA2 H 1.528 6.335 -9.135 1.00 . E A . 111 HEC HAA2 1 1 5 9363 5 2 1 HEC HAB H -3.445 -3.097 -11.473 1.00 . E A . 111 HEC HAB 1 1 5 9364 5 2 1 HEC HAC H -3.898 -0.301 -3.644 1.00 . E A . 111 HEC HAC 1 1 5 9365 5 2 1 HEC HAD1 H 0.703 5.326 -4.057 1.00 . E A . 111 HEC HAD1 1 1 5 9366 5 2 1 HEC HAD2 H 0.828 5.915 -5.732 1.00 . E A . 111 HEC HAD2 1 1 5 9367 5 2 1 HEC HBA1 H 3.510 6.287 -10.116 1.00 . E A . 111 HEC HBA1 1 1 5 9368 5 2 1 HEC HBA2 H 2.913 5.139 -11.338 1.00 . E A . 111 HEC HBA2 1 1 5 9369 5 2 1 HEC HBB1 H -1.988 -4.865 -11.611 1.00 . E A . 111 HEC HBB1 1 1 5 9370 5 2 1 HEC HBB2 H -0.754 -3.928 -12.487 1.00 . E A . 111 HEC HBB2 1 1 5 9371 5 2 1 HEC HBB3 H -0.997 -3.669 -10.743 1.00 . E A . 111 HEC HBB3 1 1 5 9372 5 2 1 HEC HBC1 H -4.475 -2.404 -2.731 1.00 . E A . 111 HEC HBC1 1 1 5 9373 5 2 1 HEC HBC2 H -4.825 -3.091 -4.335 1.00 . E A . 111 HEC HBC2 1 1 5 9374 5 2 1 HEC HBC3 H -3.149 -2.701 -3.881 1.00 . E A . 111 HEC HBC3 1 1 5 9375 5 2 1 HEC HBD1 H -1.571 6.811 -5.354 1.00 . E A . 111 HEC HBD1 1 1 5 9376 5 2 1 HEC HBD2 H -1.205 6.590 -3.626 1.00 . E A . 111 HEC HBD2 1 1 5 9377 5 2 1 HEC HHA H 0.511 5.499 -7.672 1.00 . E A . 111 HEC HHA 1 1 5 9378 5 2 1 HEC HHB H -0.550 1.995 -12.934 1.00 . E A . 111 HEC HHB 1 1 5 9379 5 2 1 HEC HHC H -3.248 -2.591 -9.359 1.00 . E A . 111 HEC HHC 1 1 5 9380 5 2 1 HEC HHD H -2.976 1.366 -4.232 1.00 . E A . 111 HEC HHD 1 1 5 9381 5 2 1 HEC HMA1 H 1.521 3.493 -13.156 1.00 . E A . 111 HEC HMA1 1 1 5 9382 5 2 1 HEC HMA2 H 0.037 4.429 -13.456 1.00 . E A . 111 HEC HMA2 1 1 5 9383 5 2 1 HEC HMA3 H 1.487 5.240 -12.818 1.00 . E A . 111 HEC HMA3 1 1 5 9384 5 2 1 HEC HMB1 H -1.969 -0.572 -14.387 1.00 . E A . 111 HEC HMB1 1 1 5 9385 5 2 1 HEC HMB2 H -0.462 0.290 -13.995 1.00 . E A . 111 HEC HMB2 1 1 5 9386 5 2 1 HEC HMB3 H -0.518 -1.487 -13.912 1.00 . E A . 111 HEC HMB3 1 1 5 9387 5 2 1 HEC HMC1 H -5.667 -2.741 -6.650 1.00 . E A . 111 HEC HMC1 1 1 5 9388 5 2 1 HEC HMC2 H -4.539 -3.282 -7.917 1.00 . E A . 111 HEC HMC2 1 1 5 9389 5 2 1 HEC HMC3 H -4.190 -3.631 -6.206 1.00 . E A . 111 HEC HMC3 1 1 5 9390 5 2 1 HEC HMD1 H -1.037 4.326 -2.784 1.00 . E A . 111 HEC HMD1 1 1 5 9391 5 2 1 HEC HMD2 H -2.633 3.585 -3.054 1.00 . E A . 111 HEC HMD2 1 1 5 9392 5 2 1 HEC HMD3 H -1.205 2.554 -2.796 1.00 . E A . 111 HEC HMD3 1 1 5 9393 5 2 1 HEC NA N -0.573 2.923 -9.641 1.00 . E A . 111 HEC NA 1 1 5 9394 5 2 1 HEC NB N -1.816 0.407 -10.192 1.00 . E A . 111 HEC NB 1 1 5 9395 5 2 1 HEC NC N -2.550 0.193 -7.422 1.00 . E A . 111 HEC NC 1 1 5 9396 5 2 1 HEC ND N -1.388 2.751 -6.920 1.00 . E A . 111 HEC ND 1 1 5 9397 5 2 1 HEC O1A O 2.638 8.369 -11.544 1.00 . E A . 111 HEC O1A 1 1 5 9398 5 2 1 HEC O1D O -0.084 8.766 -5.636 1.00 . E A . 111 HEC O1D 1 1 5 9399 5 2 1 HEC O2A O 3.060 6.826 -13.094 1.00 . E A . 111 HEC O2A 1 1 5 9400 5 2 1 HEC O2D O 0.654 8.325 -3.581 1.00 . E A . 111 HEC O2D 1 1 6 9401 1 1 1 ALA C C -1.271 3.663 20.943 1.00 . A A . 1 ALA C 1 1 6 9402 1 1 1 ALA CA C -0.127 2.816 21.503 1.00 . A A . 1 ALA CA 1 1 6 9403 1 1 1 ALA CB C 0.150 1.575 20.652 1.00 . A A . 1 ALA CB 1 1 6 9404 1 1 1 ALA H1 H 0.241 2.793 23.499 1.00 . A A . 1 ALA H1 1 1 6 9405 1 1 1 ALA H2 H -1.368 2.761 23.108 1.00 . A A . 1 ALA H2 1 1 6 9406 1 1 1 ALA HA H 0.778 3.423 21.542 1.00 . A A . 1 ALA HA 1 1 6 9407 1 1 1 ALA HB1 H -0.664 0.861 20.775 1.00 . A A . 1 ALA HB1 1 1 6 9408 1 1 1 ALA HB2 H 0.225 1.862 19.603 1.00 . A A . 1 ALA HB2 1 1 6 9409 1 1 1 ALA HB3 H 1.086 1.117 20.971 1.00 . A A . 1 ALA HB3 1 1 6 9410 1 1 1 ALA N N -0.449 2.412 22.861 1.00 . A A . 1 ALA N 1 1 6 9411 1 1 1 ALA O O -2.396 3.596 21.435 1.00 . A A . 1 ALA O 1 1 6 9412 1 1 2 PRO C C -2.875 4.507 18.383 1.00 . A A . 2 PRO C 1 1 6 9413 1 1 2 PRO CA C -1.923 5.320 19.261 1.00 . A A . 2 PRO CA 1 1 6 9414 1 1 2 PRO CB C -1.112 6.338 18.475 1.00 . A A . 2 PRO CB 1 1 6 9415 1 1 2 PRO CD C 0.387 4.566 19.284 1.00 . A A . 2 PRO CD 1 1 6 9416 1 1 2 PRO CG C 0.275 5.735 18.319 1.00 . A A . 2 PRO CG 1 1 6 9417 1 1 2 PRO HA H -2.496 5.759 19.954 1.00 . A A . 2 PRO HA 1 1 6 9418 1 1 2 PRO HB2 H -1.566 6.532 17.503 1.00 . A A . 2 PRO HB2 1 1 6 9419 1 1 2 PRO HB3 H -1.066 7.292 19.001 1.00 . A A . 2 PRO HB3 1 1 6 9420 1 1 2 PRO HD2 H 0.657 3.648 18.764 1.00 . A A . 2 PRO HD2 1 1 6 9421 1 1 2 PRO HD3 H 1.156 4.746 20.035 1.00 . A A . 2 PRO HD3 1 1 6 9422 1 1 2 PRO HG2 H 0.431 5.400 17.293 1.00 . A A . 2 PRO HG2 1 1 6 9423 1 1 2 PRO HG3 H 1.041 6.480 18.531 1.00 . A A . 2 PRO HG3 1 1 6 9424 1 1 2 PRO N N -0.936 4.461 19.894 1.00 . A A . 2 PRO N 1 1 6 9425 1 1 2 PRO O O -2.507 3.448 17.876 1.00 . A A . 2 PRO O 1 1 6 9426 1 1 3 LYS C C -4.902 4.763 15.954 1.00 . A A . 3 LYS C 1 1 6 9427 1 1 3 LYS CA C -5.090 4.369 17.420 1.00 . A A . 3 LYS CA 1 1 6 9428 1 1 3 LYS CB C -6.490 4.664 17.962 1.00 . A A . 3 LYS CB 1 1 6 9429 1 1 3 LYS CD C -8.713 3.518 18.286 1.00 . A A . 3 LYS CD 1 1 6 9430 1 1 3 LYS CE C -9.202 3.123 16.891 1.00 . A A . 3 LYS CE 1 1 6 9431 1 1 3 LYS CG C -7.193 3.376 18.395 1.00 . A A . 3 LYS CG 1 1 6 9432 1 1 3 LYS H H -4.373 5.895 18.643 1.00 . A A . 3 LYS H 1 1 6 9433 1 1 3 LYS HA H -4.928 3.296 17.513 1.00 . A A . 3 LYS HA 1 1 6 9434 1 1 3 LYS HB2 H -6.420 5.347 18.808 1.00 . A A . 3 LYS HB2 1 1 6 9435 1 1 3 LYS HB3 H -7.082 5.166 17.196 1.00 . A A . 3 LYS HB3 1 1 6 9436 1 1 3 LYS HD2 H -9.194 2.890 19.036 1.00 . A A . 3 LYS HD2 1 1 6 9437 1 1 3 LYS HD3 H -9.002 4.547 18.499 1.00 . A A . 3 LYS HD3 1 1 6 9438 1 1 3 LYS HE2 H -8.681 3.713 16.137 1.00 . A A . 3 LYS HE2 1 1 6 9439 1 1 3 LYS HE3 H -8.965 2.077 16.699 1.00 . A A . 3 LYS HE3 1 1 6 9440 1 1 3 LYS HG2 H -6.856 2.547 17.772 1.00 . A A . 3 LYS HG2 1 1 6 9441 1 1 3 LYS HG3 H -6.919 3.135 19.421 1.00 . A A . 3 LYS HG3 1 1 6 9442 1 1 3 LYS HZ1 H -10.886 4.087 16.131 1.00 . A A . 3 LYS HZ1 1 1 6 9443 1 1 3 LYS HZ2 H -11.141 2.508 16.439 1.00 . A A . 3 LYS HZ2 1 1 6 9444 1 1 3 LYS N N -4.081 5.033 18.229 1.00 . A A . 3 LYS N 1 1 6 9445 1 1 3 LYS NZ N -10.662 3.336 16.775 1.00 . A A . 3 LYS NZ 1 1 6 9446 1 1 3 LYS O O -4.175 5.707 15.649 1.00 . A A . 3 LYS O 1 1 6 9447 1 1 4 ALA C C -6.098 5.647 13.355 1.00 . A A . 4 ALA C 1 1 6 9448 1 1 4 ALA CA C -5.486 4.278 13.657 1.00 . A A . 4 ALA CA 1 1 6 9449 1 1 4 ALA CB C -6.177 3.148 12.891 1.00 . A A . 4 ALA CB 1 1 6 9450 1 1 4 ALA H H -6.159 3.253 15.341 1.00 . A A . 4 ALA H 1 1 6 9451 1 1 4 ALA HA H -4.430 4.293 13.384 1.00 . A A . 4 ALA HA 1 1 6 9452 1 1 4 ALA HB1 H -6.121 2.228 13.472 1.00 . A A . 4 ALA HB1 1 1 6 9453 1 1 4 ALA HB2 H -7.222 3.409 12.724 1.00 . A A . 4 ALA HB2 1 1 6 9454 1 1 4 ALA HB3 H -5.680 3.003 11.932 1.00 . A A . 4 ALA HB3 1 1 6 9455 1 1 4 ALA N N -5.570 4.019 15.084 1.00 . A A . 4 ALA N 1 1 6 9456 1 1 4 ALA O O -6.932 6.140 14.113 1.00 . A A . 4 ALA O 1 1 6 9457 1 1 5 PRO C C -7.558 7.435 11.231 1.00 . A A . 5 PRO C 1 1 6 9458 1 1 5 PRO CA C -6.143 7.541 11.803 1.00 . A A . 5 PRO CA 1 1 6 9459 1 1 5 PRO CB C -5.129 8.045 10.789 1.00 . A A . 5 PRO CB 1 1 6 9460 1 1 5 PRO CD C -4.662 5.685 11.293 1.00 . A A . 5 PRO CD 1 1 6 9461 1 1 5 PRO CG C -4.359 6.818 10.326 1.00 . A A . 5 PRO CG 1 1 6 9462 1 1 5 PRO HA H -6.213 8.152 12.592 1.00 . A A . 5 PRO HA 1 1 6 9463 1 1 5 PRO HB2 H -5.625 8.535 9.951 1.00 . A A . 5 PRO HB2 1 1 6 9464 1 1 5 PRO HB3 H -4.460 8.779 11.237 1.00 . A A . 5 PRO HB3 1 1 6 9465 1 1 5 PRO HD2 H -5.054 4.813 10.770 1.00 . A A . 5 PRO HD2 1 1 6 9466 1 1 5 PRO HD3 H -3.763 5.364 11.820 1.00 . A A . 5 PRO HD3 1 1 6 9467 1 1 5 PRO HG2 H -4.653 6.544 9.312 1.00 . A A . 5 PRO HG2 1 1 6 9468 1 1 5 PRO HG3 H -3.290 7.025 10.303 1.00 . A A . 5 PRO HG3 1 1 6 9469 1 1 5 PRO N N -5.649 6.239 12.215 1.00 . A A . 5 PRO N 1 1 6 9470 1 1 5 PRO O O -8.051 6.335 10.986 1.00 . A A . 5 PRO O 1 1 6 9471 1 1 6 ALA C C -9.560 7.899 9.161 1.00 . A A . 6 ALA C 1 1 6 9472 1 1 6 ALA CA C -9.521 8.644 10.497 1.00 . A A . 6 ALA CA 1 1 6 9473 1 1 6 ALA CB C -9.963 10.102 10.365 1.00 . A A . 6 ALA CB 1 1 6 9474 1 1 6 ALA H H -7.764 9.483 11.238 1.00 . A A . 6 ALA H 1 1 6 9475 1 1 6 ALA HA H -10.179 8.140 11.205 1.00 . A A . 6 ALA HA 1 1 6 9476 1 1 6 ALA HB1 H -9.096 10.727 10.148 1.00 . A A . 6 ALA HB1 1 1 6 9477 1 1 6 ALA HB2 H -10.686 10.190 9.554 1.00 . A A . 6 ALA HB2 1 1 6 9478 1 1 6 ALA HB3 H -10.422 10.429 11.298 1.00 . A A . 6 ALA HB3 1 1 6 9479 1 1 6 ALA N N -8.172 8.593 11.035 1.00 . A A . 6 ALA N 1 1 6 9480 1 1 6 ALA O O -8.528 7.451 8.665 1.00 . A A . 6 ALA O 1 1 6 9481 1 1 7 ASP C C -10.864 8.122 6.209 1.00 . A A . 7 ASP C 1 1 6 9482 1 1 7 ASP CA C -10.951 7.106 7.349 1.00 . A A . 7 ASP CA 1 1 6 9483 1 1 7 ASP CB C -12.326 6.437 7.282 1.00 . A A . 7 ASP CB 1 1 6 9484 1 1 7 ASP CG C -13.454 7.206 7.971 1.00 . A A . 7 ASP CG 1 1 6 9485 1 1 7 ASP H H -11.598 8.156 9.027 1.00 . A A . 7 ASP H 1 1 6 9486 1 1 7 ASP HA H -10.157 6.360 7.304 1.00 . A A . 7 ASP HA 1 1 6 9487 1 1 7 ASP HB2 H -12.592 6.292 6.235 1.00 . A A . 7 ASP HB2 1 1 6 9488 1 1 7 ASP HB3 H -12.253 5.447 7.732 1.00 . A A . 7 ASP HB3 1 1 6 9489 1 1 7 ASP N N -10.763 7.789 8.617 1.00 . A A . 7 ASP N 1 1 6 9490 1 1 7 ASP O O -10.850 9.329 6.448 1.00 . A A . 7 ASP O 1 1 6 9491 1 1 7 ASP OD1 O -13.572 8.417 7.685 1.00 . A A . 7 ASP OD1 1 1 6 9492 1 1 7 ASP OD2 O -14.172 6.567 8.770 1.00 . A A . 7 ASP OD2 1 1 6 9493 1 1 8 GLY C C -9.296 8.953 3.609 1.00 . A A . 8 GLY C 1 1 6 9494 1 1 8 GLY CA C -10.724 8.445 3.816 1.00 . A A . 8 GLY CA 1 1 6 9495 1 1 8 GLY H H -10.822 6.615 4.807 1.00 . A A . 8 GLY H 1 1 6 9496 1 1 8 GLY HA2 H -11.046 7.886 2.937 1.00 . A A . 8 GLY HA2 1 1 6 9497 1 1 8 GLY HA3 H -11.403 9.291 3.922 1.00 . A A . 8 GLY HA3 1 1 6 9498 1 1 8 GLY N N -10.809 7.598 4.993 1.00 . A A . 8 GLY N 1 1 6 9499 1 1 8 GLY O O -9.089 10.010 3.014 1.00 . A A . 8 GLY O 1 1 6 9500 1 1 9 LEU C C -6.483 8.291 2.549 1.00 . A A . 9 LEU C 1 1 6 9501 1 1 9 LEU CA C -6.944 8.535 3.987 1.00 . A A . 9 LEU CA 1 1 6 9502 1 1 9 LEU CB C -6.109 7.796 5.035 1.00 . A A . 9 LEU CB 1 1 6 9503 1 1 9 LEU CD1 C -4.122 6.526 4.139 1.00 . A A . 9 LEU CD1 1 1 6 9504 1 1 9 LEU CD2 C -4.165 9.061 4.044 1.00 . A A . 9 LEU CD2 1 1 6 9505 1 1 9 LEU CG C -4.594 7.813 4.819 1.00 . A A . 9 LEU CG 1 1 6 9506 1 1 9 LEU H H -8.523 7.318 4.591 1.00 . A A . 9 LEU H 1 1 6 9507 1 1 9 LEU HA H -6.859 9.601 4.201 1.00 . A A . 9 LEU HA 1 1 6 9508 1 1 9 LEU HB2 H -6.321 8.229 6.012 1.00 . A A . 9 LEU HB2 1 1 6 9509 1 1 9 LEU HB3 H -6.439 6.758 5.067 1.00 . A A . 9 LEU HB3 1 1 6 9510 1 1 9 LEU HD11 H -4.704 5.683 4.514 1.00 . A A . 9 LEU HD11 1 1 6 9511 1 1 9 LEU HD12 H -4.260 6.612 3.062 1.00 . A A . 9 LEU HD12 1 1 6 9512 1 1 9 LEU HD13 H -3.067 6.365 4.359 1.00 . A A . 9 LEU HD13 1 1 6 9513 1 1 9 LEU HD21 H -4.868 9.870 4.240 1.00 . A A . 9 LEU HD21 1 1 6 9514 1 1 9 LEU HD22 H -3.167 9.361 4.363 1.00 . A A . 9 LEU HD22 1 1 6 9515 1 1 9 LEU HD23 H -4.154 8.840 2.977 1.00 . A A . 9 LEU HD23 1 1 6 9516 1 1 9 LEU HG H -4.110 7.858 5.794 1.00 . A A . 9 LEU HG 1 1 6 9517 1 1 9 LEU N N -8.347 8.176 4.110 1.00 . A A . 9 LEU N 1 1 6 9518 1 1 9 LEU O O -6.190 7.157 2.171 1.00 . A A . 9 LEU O 1 1 6 9519 1 1 10 LYS C C -4.600 9.857 0.262 1.00 . A A . 10 LYS C 1 1 6 9520 1 1 10 LYS CA C -6.014 9.290 0.397 1.00 . A A . 10 LYS CA 1 1 6 9521 1 1 10 LYS CB C -7.039 9.969 -0.514 1.00 . A A . 10 LYS CB 1 1 6 9522 1 1 10 LYS CD C -7.342 11.073 -2.761 1.00 . A A . 10 LYS CD 1 1 6 9523 1 1 10 LYS CE C -8.027 10.378 -3.940 1.00 . A A . 10 LYS CE 1 1 6 9524 1 1 10 LYS CG C -6.512 10.080 -1.946 1.00 . A A . 10 LYS CG 1 1 6 9525 1 1 10 LYS H H -6.674 10.291 2.101 1.00 . A A . 10 LYS H 1 1 6 9526 1 1 10 LYS HA H -5.991 8.235 0.125 1.00 . A A . 10 LYS HA 1 1 6 9527 1 1 10 LYS HB2 H -7.970 9.402 -0.508 1.00 . A A . 10 LYS HB2 1 1 6 9528 1 1 10 LYS HB3 H -7.270 10.963 -0.130 1.00 . A A . 10 LYS HB3 1 1 6 9529 1 1 10 LYS HD2 H -8.093 11.536 -2.121 1.00 . A A . 10 LYS HD2 1 1 6 9530 1 1 10 LYS HD3 H -6.700 11.874 -3.129 1.00 . A A . 10 LYS HD3 1 1 6 9531 1 1 10 LYS HE2 H -8.041 11.043 -4.803 1.00 . A A . 10 LYS HE2 1 1 6 9532 1 1 10 LYS HE3 H -7.459 9.494 -4.228 1.00 . A A . 10 LYS HE3 1 1 6 9533 1 1 10 LYS HG2 H -5.469 10.399 -1.930 1.00 . A A . 10 LYS HG2 1 1 6 9534 1 1 10 LYS HG3 H -6.538 9.100 -2.423 1.00 . A A . 10 LYS HG3 1 1 6 9535 1 1 10 LYS HZ1 H -9.697 10.389 -2.693 1.00 . A A . 10 LYS HZ1 1 1 6 9536 1 1 10 LYS HZ2 H -10.083 10.303 -4.273 1.00 . A A . 10 LYS HZ2 1 1 6 9537 1 1 10 LYS N N -6.434 9.373 1.786 1.00 . A A . 10 LYS N 1 1 6 9538 1 1 10 LYS NZ N -9.410 9.992 -3.581 1.00 . A A . 10 LYS NZ 1 1 6 9539 1 1 10 LYS O O -4.247 10.822 0.937 1.00 . A A . 10 LYS O 1 1 6 9540 1 1 11 MET C C -2.235 10.005 -2.322 1.00 . A A . 11 MET C 1 1 6 9541 1 1 11 MET CA C -2.459 9.662 -0.848 1.00 . A A . 11 MET CA 1 1 6 9542 1 1 11 MET CB C -1.497 8.548 -0.430 1.00 . A A . 11 MET CB 1 1 6 9543 1 1 11 MET CE C -0.708 4.943 -0.211 1.00 . A A . 11 MET CE 1 1 6 9544 1 1 11 MET CG C -1.791 7.254 -1.192 1.00 . A A . 11 MET CG 1 1 6 9545 1 1 11 MET H H -4.122 8.447 -1.161 1.00 . A A . 11 MET H 1 1 6 9546 1 1 11 MET HA H -2.325 10.553 -0.235 1.00 . A A . 11 MET HA 1 1 6 9547 1 1 11 MET HB2 H -0.470 8.861 -0.620 1.00 . A A . 11 MET HB2 1 1 6 9548 1 1 11 MET HB3 H -1.583 8.371 0.642 1.00 . A A . 11 MET HB3 1 1 6 9549 1 1 11 MET HE1 H 0.144 5.583 -0.442 1.00 . A A . 11 MET HE1 1 1 6 9550 1 1 11 MET HE2 H -0.521 4.413 0.723 1.00 . A A . 11 MET HE2 1 1 6 9551 1 1 11 MET HE3 H -0.850 4.222 -1.016 1.00 . A A . 11 MET HE3 1 1 6 9552 1 1 11 MET HG2 H -2.626 7.407 -1.875 1.00 . A A . 11 MET HG2 1 1 6 9553 1 1 11 MET HG3 H -0.929 6.976 -1.798 1.00 . A A . 11 MET HG3 1 1 6 9554 1 1 11 MET N N -3.828 9.232 -0.615 1.00 . A A . 11 MET N 1 1 6 9555 1 1 11 MET O O -2.257 9.122 -3.178 1.00 . A A . 11 MET O 1 1 6 9556 1 1 11 MET SD S -2.176 5.944 -0.043 1.00 . A A . 11 MET SD 1 1 6 9557 1 1 12 GLU C C -0.328 12.148 -4.115 1.00 . A A . 12 GLU C 1 1 6 9558 1 1 12 GLU CA C -1.796 11.759 -3.928 1.00 . A A . 12 GLU CA 1 1 6 9559 1 1 12 GLU CB C -2.721 12.931 -4.264 1.00 . A A . 12 GLU CB 1 1 6 9560 1 1 12 GLU CD C -1.607 14.177 -6.152 1.00 . A A . 12 GLU CD 1 1 6 9561 1 1 12 GLU CG C -2.728 13.209 -5.768 1.00 . A A . 12 GLU CG 1 1 6 9562 1 1 12 GLU H H -2.007 12.000 -1.869 1.00 . A A . 12 GLU H 1 1 6 9563 1 1 12 GLU HA H -2.041 10.915 -4.572 1.00 . A A . 12 GLU HA 1 1 6 9564 1 1 12 GLU HB2 H -3.733 12.708 -3.927 1.00 . A A . 12 GLU HB2 1 1 6 9565 1 1 12 GLU HB3 H -2.395 13.822 -3.727 1.00 . A A . 12 GLU HB3 1 1 6 9566 1 1 12 GLU HG2 H -2.609 12.274 -6.315 1.00 . A A . 12 GLU HG2 1 1 6 9567 1 1 12 GLU HG3 H -3.691 13.629 -6.060 1.00 . A A . 12 GLU HG3 1 1 6 9568 1 1 12 GLU N N -2.024 11.288 -2.572 1.00 . A A . 12 GLU N 1 1 6 9569 1 1 12 GLU O O -0.011 13.323 -4.292 1.00 . A A . 12 GLU O 1 1 6 9570 1 1 12 GLU OE1 O -1.734 15.366 -5.788 1.00 . A A . 12 GLU OE1 1 1 6 9571 1 1 12 GLU OE2 O -0.648 13.706 -6.801 1.00 . A A . 12 GLU OE2 1 1 6 9572 1 1 13 ALA C C 2.346 11.094 -5.688 1.00 . A A . 13 ALA C 1 1 6 9573 1 1 13 ALA CA C 1.955 11.359 -4.232 1.00 . A A . 13 ALA CA 1 1 6 9574 1 1 13 ALA CB C 2.724 10.471 -3.252 1.00 . A A . 13 ALA CB 1 1 6 9575 1 1 13 ALA H H 0.262 10.185 -3.926 1.00 . A A . 13 ALA H 1 1 6 9576 1 1 13 ALA HA H 2.158 12.403 -3.994 1.00 . A A . 13 ALA HA 1 1 6 9577 1 1 13 ALA HB1 H 2.272 10.545 -2.263 1.00 . A A . 13 ALA HB1 1 1 6 9578 1 1 13 ALA HB2 H 2.687 9.437 -3.592 1.00 . A A . 13 ALA HB2 1 1 6 9579 1 1 13 ALA HB3 H 3.763 10.800 -3.201 1.00 . A A . 13 ALA HB3 1 1 6 9580 1 1 13 ALA N N 0.528 11.138 -4.070 1.00 . A A . 13 ALA N 1 1 6 9581 1 1 13 ALA O O 3.456 11.421 -6.106 1.00 . A A . 13 ALA O 1 1 6 9582 1 1 14 THR C C 0.491 10.709 -8.680 1.00 . A A . 14 THR C 1 1 6 9583 1 1 14 THR CA C 1.645 10.193 -7.819 1.00 . A A . 14 THR CA 1 1 6 9584 1 1 14 THR CB C 1.862 8.683 -7.937 1.00 . A A . 14 THR CB 1 1 6 9585 1 1 14 THR CG2 C 2.621 8.105 -6.741 1.00 . A A . 14 THR CG2 1 1 6 9586 1 1 14 THR H H 0.512 10.243 -6.072 1.00 . A A . 14 THR H 1 1 6 9587 1 1 14 THR HA H 2.545 10.716 -8.143 1.00 . A A . 14 THR HA 1 1 6 9588 1 1 14 THR HB H 2.362 8.433 -8.873 1.00 . A A . 14 THR HB 1 1 6 9589 1 1 14 THR HG1 H 0.081 8.542 -7.034 1.00 . A A . 14 THR HG1 1 1 6 9590 1 1 14 THR HG21 H 2.087 8.345 -5.821 1.00 . A A . 14 THR HG21 1 1 6 9591 1 1 14 THR HG22 H 2.695 7.023 -6.846 1.00 . A A . 14 THR HG22 1 1 6 9592 1 1 14 THR HG23 H 3.621 8.536 -6.703 1.00 . A A . 14 THR HG23 1 1 6 9593 1 1 14 THR N N 1.412 10.505 -6.420 1.00 . A A . 14 THR N 1 1 6 9594 1 1 14 THR O O -0.485 11.248 -8.159 1.00 . A A . 14 THR O 1 1 6 9595 1 1 14 THR OG1 O 0.553 8.133 -7.815 1.00 . A A . 14 THR OG1 1 1 6 9596 1 1 15 LYS C C -1.665 10.177 -10.683 1.00 . A A . 15 LYS C 1 1 6 9597 1 1 15 LYS CA C -0.378 10.969 -10.923 1.00 . A A . 15 LYS CA 1 1 6 9598 1 1 15 LYS CB C 0.141 10.878 -12.359 1.00 . A A . 15 LYS CB 1 1 6 9599 1 1 15 LYS CD C -0.020 12.206 -14.497 1.00 . A A . 15 LYS CD 1 1 6 9600 1 1 15 LYS CE C -0.969 12.801 -15.538 1.00 . A A . 15 LYS CE 1 1 6 9601 1 1 15 LYS CG C -0.798 11.597 -13.329 1.00 . A A . 15 LYS CG 1 1 6 9602 1 1 15 LYS H H 1.436 10.089 -10.400 1.00 . A A . 15 LYS H 1 1 6 9603 1 1 15 LYS HA H -0.576 12.021 -10.718 1.00 . A A . 15 LYS HA 1 1 6 9604 1 1 15 LYS HB2 H 1.137 11.317 -12.418 1.00 . A A . 15 LYS HB2 1 1 6 9605 1 1 15 LYS HB3 H 0.238 9.832 -12.649 1.00 . A A . 15 LYS HB3 1 1 6 9606 1 1 15 LYS HD2 H 0.652 12.980 -14.127 1.00 . A A . 15 LYS HD2 1 1 6 9607 1 1 15 LYS HD3 H 0.602 11.440 -14.962 1.00 . A A . 15 LYS HD3 1 1 6 9608 1 1 15 LYS HE2 H -1.833 12.149 -15.666 1.00 . A A . 15 LYS HE2 1 1 6 9609 1 1 15 LYS HE3 H -1.345 13.763 -15.188 1.00 . A A . 15 LYS HE3 1 1 6 9610 1 1 15 LYS HG2 H -1.541 10.896 -13.708 1.00 . A A . 15 LYS HG2 1 1 6 9611 1 1 15 LYS HG3 H -1.340 12.382 -12.801 1.00 . A A . 15 LYS HG3 1 1 6 9612 1 1 15 LYS HZ1 H 0.722 12.807 -16.756 1.00 . A A . 15 LYS HZ1 1 1 6 9613 1 1 15 LYS HZ2 H -0.626 12.339 -17.541 1.00 . A A . 15 LYS HZ2 1 1 6 9614 1 1 15 LYS N N 0.640 10.528 -9.984 1.00 . A A . 15 LYS N 1 1 6 9615 1 1 15 LYS NZ N -0.275 12.975 -16.833 1.00 . A A . 15 LYS NZ 1 1 6 9616 1 1 15 LYS O O -2.720 10.525 -11.212 1.00 . A A . 15 LYS O 1 1 6 9617 1 1 16 GLN C C -2.842 8.163 -8.051 1.00 . A A . 16 GLN C 1 1 6 9618 1 1 16 GLN CA C -2.676 8.284 -9.567 1.00 . A A . 16 GLN CA 1 1 6 9619 1 1 16 GLN CB C -2.533 6.905 -10.215 1.00 . A A . 16 GLN CB 1 1 6 9620 1 1 16 GLN CD C -3.404 6.885 -12.582 1.00 . A A . 16 GLN CD 1 1 6 9621 1 1 16 GLN CG C -2.166 7.030 -11.695 1.00 . A A . 16 GLN CG 1 1 6 9622 1 1 16 GLN H H -0.675 8.853 -9.457 1.00 . A A . 16 GLN H 1 1 6 9623 1 1 16 GLN HA H -3.540 8.792 -9.995 1.00 . A A . 16 GLN HA 1 1 6 9624 1 1 16 GLN HB2 H -1.767 6.332 -9.693 1.00 . A A . 16 GLN HB2 1 1 6 9625 1 1 16 GLN HB3 H -3.468 6.354 -10.114 1.00 . A A . 16 GLN HB3 1 1 6 9626 1 1 16 GLN HE21 H -3.623 4.996 -11.885 1.00 . A A . 16 GLN HE21 1 1 6 9627 1 1 16 GLN HE22 H -4.815 5.505 -13.035 1.00 . A A . 16 GLN HE22 1 1 6 9628 1 1 16 GLN HG2 H -1.696 7.997 -11.876 1.00 . A A . 16 GLN HG2 1 1 6 9629 1 1 16 GLN HG3 H -1.434 6.266 -11.957 1.00 . A A . 16 GLN HG3 1 1 6 9630 1 1 16 GLN N N -1.536 9.128 -9.884 1.00 . A A . 16 GLN N 1 1 6 9631 1 1 16 GLN NE2 N -3.996 5.697 -12.493 1.00 . A A . 16 GLN NE2 1 1 6 9632 1 1 16 GLN O O -2.115 7.414 -7.401 1.00 . A A . 16 GLN O 1 1 6 9633 1 1 16 GLN OE1 O -3.796 7.791 -13.298 1.00 . A A . 16 GLN OE1 1 1 6 9634 1 1 17 PRO C C -4.831 7.638 -5.684 1.00 . A A . 17 PRO C 1 1 6 9635 1 1 17 PRO CA C -4.101 8.919 -6.091 1.00 . A A . 17 PRO CA 1 1 6 9636 1 1 17 PRO CB C -4.917 10.175 -5.834 1.00 . A A . 17 PRO CB 1 1 6 9637 1 1 17 PRO CD C -4.710 9.832 -8.258 1.00 . A A . 17 PRO CD 1 1 6 9638 1 1 17 PRO CG C -5.466 10.600 -7.186 1.00 . A A . 17 PRO CG 1 1 6 9639 1 1 17 PRO HA H -3.244 8.921 -5.575 1.00 . A A . 17 PRO HA 1 1 6 9640 1 1 17 PRO HB2 H -5.724 9.979 -5.128 1.00 . A A . 17 PRO HB2 1 1 6 9641 1 1 17 PRO HB3 H -4.298 10.960 -5.399 1.00 . A A . 17 PRO HB3 1 1 6 9642 1 1 17 PRO HD2 H -5.392 9.277 -8.903 1.00 . A A . 17 PRO HD2 1 1 6 9643 1 1 17 PRO HD3 H -4.141 10.504 -8.900 1.00 . A A . 17 PRO HD3 1 1 6 9644 1 1 17 PRO HG2 H -6.534 10.390 -7.247 1.00 . A A . 17 PRO HG2 1 1 6 9645 1 1 17 PRO HG3 H -5.343 11.674 -7.327 1.00 . A A . 17 PRO HG3 1 1 6 9646 1 1 17 PRO N N -3.829 8.932 -7.518 1.00 . A A . 17 PRO N 1 1 6 9647 1 1 17 PRO O O -5.432 6.968 -6.523 1.00 . A A . 17 PRO O 1 1 6 9648 1 1 18 VAL C C -6.009 6.465 -2.500 1.00 . A A . 18 VAL C 1 1 6 9649 1 1 18 VAL CA C -5.402 6.146 -3.868 1.00 . A A . 18 VAL CA 1 1 6 9650 1 1 18 VAL CB C -4.407 4.985 -3.824 1.00 . A A . 18 VAL CB 1 1 6 9651 1 1 18 VAL CG1 C -4.989 3.792 -3.063 1.00 . A A . 18 VAL CG1 1 1 6 9652 1 1 18 VAL CG2 C -3.976 4.578 -5.234 1.00 . A A . 18 VAL CG2 1 1 6 9653 1 1 18 VAL H H -4.265 7.885 -3.720 1.00 . A A . 18 VAL H 1 1 6 9654 1 1 18 VAL HA H -6.206 5.876 -4.554 1.00 . A A . 18 VAL HA 1 1 6 9655 1 1 18 VAL HB H -3.520 5.324 -3.287 1.00 . A A . 18 VAL HB 1 1 6 9656 1 1 18 VAL HG11 H -6.075 3.798 -3.155 1.00 . A A . 18 VAL HG11 1 1 6 9657 1 1 18 VAL HG12 H -4.594 2.866 -3.482 1.00 . A A . 18 VAL HG12 1 1 6 9658 1 1 18 VAL HG13 H -4.713 3.862 -2.011 1.00 . A A . 18 VAL HG13 1 1 6 9659 1 1 18 VAL HG21 H -4.682 4.981 -5.960 1.00 . A A . 18 VAL HG21 1 1 6 9660 1 1 18 VAL HG22 H -2.980 4.974 -5.438 1.00 . A A . 18 VAL HG22 1 1 6 9661 1 1 18 VAL HG23 H -3.957 3.491 -5.310 1.00 . A A . 18 VAL HG23 1 1 6 9662 1 1 18 VAL N N -4.756 7.335 -4.396 1.00 . A A . 18 VAL N 1 1 6 9663 1 1 18 VAL O O -5.483 7.298 -1.763 1.00 . A A . 18 VAL O 1 1 6 9664 1 1 19 VAL C C -7.708 4.705 -0.107 1.00 . A A . 19 VAL C 1 1 6 9665 1 1 19 VAL CA C -7.791 5.988 -0.936 1.00 . A A . 19 VAL CA 1 1 6 9666 1 1 19 VAL CB C -9.229 6.447 -1.186 1.00 . A A . 19 VAL CB 1 1 6 9667 1 1 19 VAL CG1 C -10.054 6.390 0.101 1.00 . A A . 19 VAL CG1 1 1 6 9668 1 1 19 VAL CG2 C -9.259 7.850 -1.794 1.00 . A A . 19 VAL CG2 1 1 6 9669 1 1 19 VAL H H -7.528 5.111 -2.807 1.00 . A A . 19 VAL H 1 1 6 9670 1 1 19 VAL HA H -7.271 6.784 -0.404 1.00 . A A . 19 VAL HA 1 1 6 9671 1 1 19 VAL HB H -9.680 5.761 -1.903 1.00 . A A . 19 VAL HB 1 1 6 9672 1 1 19 VAL HG11 H -9.405 6.131 0.938 1.00 . A A . 19 VAL HG11 1 1 6 9673 1 1 19 VAL HG12 H -10.512 7.362 0.284 1.00 . A A . 19 VAL HG12 1 1 6 9674 1 1 19 VAL HG13 H -10.834 5.635 0.000 1.00 . A A . 19 VAL HG13 1 1 6 9675 1 1 19 VAL HG21 H -8.245 8.158 -2.047 1.00 . A A . 19 VAL HG21 1 1 6 9676 1 1 19 VAL HG22 H -9.872 7.843 -2.696 1.00 . A A . 19 VAL HG22 1 1 6 9677 1 1 19 VAL HG23 H -9.683 8.550 -1.074 1.00 . A A . 19 VAL HG23 1 1 6 9678 1 1 19 VAL N N -7.107 5.787 -2.202 1.00 . A A . 19 VAL N 1 1 6 9679 1 1 19 VAL O O -8.225 3.665 -0.512 1.00 . A A . 19 VAL O 1 1 6 9680 1 1 20 PHE C C -7.788 3.826 3.164 1.00 . A A . 20 PHE C 1 1 6 9681 1 1 20 PHE CA C -6.897 3.683 1.929 1.00 . A A . 20 PHE CA 1 1 6 9682 1 1 20 PHE CB C -5.431 3.691 2.369 1.00 . A A . 20 PHE CB 1 1 6 9683 1 1 20 PHE CD1 C -4.924 1.251 2.745 1.00 . A A . 20 PHE CD1 1 1 6 9684 1 1 20 PHE CD2 C -4.822 2.731 4.619 1.00 . A A . 20 PHE CD2 1 1 6 9685 1 1 20 PHE CE1 C -4.562 0.147 3.597 1.00 . A A . 20 PHE CE1 1 1 6 9686 1 1 20 PHE CE2 C -4.460 1.628 5.471 1.00 . A A . 20 PHE CE2 1 1 6 9687 1 1 20 PHE CG C -5.047 2.520 3.274 1.00 . A A . 20 PHE CG 1 1 6 9688 1 1 20 PHE CZ C -4.348 0.391 4.918 1.00 . A A . 20 PHE CZ 1 1 6 9689 1 1 20 PHE H H -6.637 5.671 1.362 1.00 . A A . 20 PHE H 1 1 6 9690 1 1 20 PHE HA H -7.187 2.786 1.383 1.00 . A A . 20 PHE HA 1 1 6 9691 1 1 20 PHE HB2 H -4.797 3.677 1.483 1.00 . A A . 20 PHE HB2 1 1 6 9692 1 1 20 PHE HB3 H -5.225 4.625 2.893 1.00 . A A . 20 PHE HB3 1 1 6 9693 1 1 20 PHE HD1 H -5.101 1.084 1.683 1.00 . A A . 20 PHE HD1 1 1 6 9694 1 1 20 PHE HD2 H -4.919 3.733 5.037 1.00 . A A . 20 PHE HD2 1 1 6 9695 1 1 20 PHE HE1 H -4.462 -0.860 3.193 1.00 . A A . 20 PHE HE1 1 1 6 9696 1 1 20 PHE HE2 H -4.280 1.781 6.535 1.00 . A A . 20 PHE HE2 1 1 6 9697 1 1 20 PHE HZ H -4.051 -0.525 5.490 1.00 . A A . 20 PHE HZ 1 1 6 9698 1 1 20 PHE N N -7.054 4.821 1.040 1.00 . A A . 20 PHE N 1 1 6 9699 1 1 20 PHE O O -8.243 4.923 3.483 1.00 . A A . 20 PHE O 1 1 6 9700 1 1 21 ASN C C -8.208 1.763 6.064 1.00 . A A . 21 ASN C 1 1 6 9701 1 1 21 ASN CA C -8.840 2.685 5.020 1.00 . A A . 21 ASN CA 1 1 6 9702 1 1 21 ASN CB C -10.242 2.157 4.710 1.00 . A A . 21 ASN CB 1 1 6 9703 1 1 21 ASN CG C -11.019 3.142 3.834 1.00 . A A . 21 ASN CG 1 1 6 9704 1 1 21 ASN H H -7.637 1.811 3.562 1.00 . A A . 21 ASN H 1 1 6 9705 1 1 21 ASN HA H -8.884 3.723 5.351 1.00 . A A . 21 ASN HA 1 1 6 9706 1 1 21 ASN HB2 H -10.168 1.195 4.203 1.00 . A A . 21 ASN HB2 1 1 6 9707 1 1 21 ASN HB3 H -10.785 1.986 5.640 1.00 . A A . 21 ASN HB3 1 1 6 9708 1 1 21 ASN HD21 H -11.318 4.291 5.474 1.00 . A A . 21 ASN HD21 1 1 6 9709 1 1 21 ASN HD22 H -12.008 4.900 4.007 1.00 . A A . 21 ASN HD22 1 1 6 9710 1 1 21 ASN N N -8.011 2.700 3.827 1.00 . A A . 21 ASN N 1 1 6 9711 1 1 21 ASN ND2 N -11.487 4.198 4.493 1.00 . A A . 21 ASN ND2 1 1 6 9712 1 1 21 ASN O O -7.670 0.711 5.724 1.00 . A A . 21 ASN O 1 1 6 9713 1 1 21 ASN OD1 O -11.181 2.956 2.639 1.00 . A A . 21 ASN OD1 1 1 6 9714 1 1 22 HIS C C -8.834 0.563 9.047 1.00 . A A . 22 HIS C 1 1 6 9715 1 1 22 HIS CA C -7.735 1.418 8.411 1.00 . A A . 22 HIS CA 1 1 6 9716 1 1 22 HIS CB C -7.036 2.332 9.420 1.00 . A A . 22 HIS CB 1 1 6 9717 1 1 22 HIS CD2 C -4.438 2.096 9.267 1.00 . A A . 22 HIS CD2 1 1 6 9718 1 1 22 HIS CE1 C -4.027 3.916 8.125 1.00 . A A . 22 HIS CE1 1 1 6 9719 1 1 22 HIS CG C -5.629 2.715 9.029 1.00 . A A . 22 HIS CG 1 1 6 9720 1 1 22 HIS H H -8.733 3.049 7.583 1.00 . A A . 22 HIS H 1 1 6 9721 1 1 22 HIS HA H -6.981 0.762 7.978 1.00 . A A . 22 HIS HA 1 1 6 9722 1 1 22 HIS HB2 H -7.628 3.238 9.545 1.00 . A A . 22 HIS HB2 1 1 6 9723 1 1 22 HIS HB3 H -7.010 1.832 10.389 1.00 . A A . 22 HIS HB3 1 1 6 9724 1 1 22 HIS HD1 H -6.003 4.531 7.981 1.00 . A A . 22 HIS HD1 1 1 6 9725 1 1 22 HIS HD2 H -4.303 1.162 9.813 1.00 . A A . 22 HIS HD2 1 1 6 9726 1 1 22 HIS HE1 H -3.487 4.700 7.593 1.00 . A A . 22 HIS HE1 1 1 6 9727 1 1 22 HIS N N -8.293 2.192 7.315 1.00 . A A . 22 HIS N 1 1 6 9728 1 1 22 HIS ND1 N -5.338 3.860 8.308 1.00 . A A . 22 HIS ND1 1 1 6 9729 1 1 22 HIS NE2 N -3.471 2.822 8.719 1.00 . A A . 22 HIS NE2 1 1 6 9730 1 1 22 HIS O O -8.544 -0.407 9.745 1.00 . A A . 22 HIS O 1 1 6 9731 1 1 23 SER C C -11.486 -1.015 8.483 1.00 . A A . 23 SER C 1 1 6 9732 1 1 23 SER CA C -11.215 0.236 9.320 1.00 . A A . 23 SER CA 1 1 6 9733 1 1 23 SER CB C -12.457 1.129 9.359 1.00 . A A . 23 SER CB 1 1 6 9734 1 1 23 SER H H -10.299 1.745 8.213 1.00 . A A . 23 SER H 1 1 6 9735 1 1 23 SER HA H -10.932 -0.036 10.336 1.00 . A A . 23 SER HA 1 1 6 9736 1 1 23 SER HB2 H -12.411 1.850 8.543 1.00 . A A . 23 SER HB2 1 1 6 9737 1 1 23 SER HB3 H -13.346 0.520 9.195 1.00 . A A . 23 SER HB3 1 1 6 9738 1 1 23 SER HG H -13.403 2.385 10.596 1.00 . A A . 23 SER HG 1 1 6 9739 1 1 23 SER N N -10.071 0.955 8.782 1.00 . A A . 23 SER N 1 1 6 9740 1 1 23 SER O O -12.400 -1.782 8.785 1.00 . A A . 23 SER O 1 1 6 9741 1 1 23 SER OG O -12.578 1.821 10.598 1.00 . A A . 23 SER OG 1 1 6 9742 1 1 24 THR C C -9.699 -3.342 6.821 1.00 . A A . 24 THR C 1 1 6 9743 1 1 24 THR CA C -10.818 -2.330 6.566 1.00 . A A . 24 THR CA 1 1 6 9744 1 1 24 THR CB C -10.856 -1.816 5.126 1.00 . A A . 24 THR CB 1 1 6 9745 1 1 24 THR CG2 C -10.997 -2.946 4.104 1.00 . A A . 24 THR CG2 1 1 6 9746 1 1 24 THR H H -9.936 -0.557 7.210 1.00 . A A . 24 THR H 1 1 6 9747 1 1 24 THR HA H -11.759 -2.829 6.800 1.00 . A A . 24 THR HA 1 1 6 9748 1 1 24 THR HB H -9.983 -1.201 4.909 1.00 . A A . 24 THR HB 1 1 6 9749 1 1 24 THR HG1 H -12.043 -0.265 5.564 1.00 . A A . 24 THR HG1 1 1 6 9750 1 1 24 THR HG21 H -10.178 -3.655 4.231 1.00 . A A . 24 THR HG21 1 1 6 9751 1 1 24 THR HG22 H -11.947 -3.458 4.257 1.00 . A A . 24 THR HG22 1 1 6 9752 1 1 24 THR HG23 H -10.965 -2.531 3.097 1.00 . A A . 24 THR HG23 1 1 6 9753 1 1 24 THR N N -10.676 -1.185 7.449 1.00 . A A . 24 THR N 1 1 6 9754 1 1 24 THR O O -9.925 -4.550 6.766 1.00 . A A . 24 THR O 1 1 6 9755 1 1 24 THR OG1 O -12.094 -1.115 5.040 1.00 . A A . 24 THR OG1 1 1 6 9756 1 1 25 HIS C C -7.180 -3.817 8.868 1.00 . A A . 25 HIS C 1 1 6 9757 1 1 25 HIS CA C -7.361 -3.652 7.358 1.00 . A A . 25 HIS CA 1 1 6 9758 1 1 25 HIS CB C -6.115 -3.094 6.669 1.00 . A A . 25 HIS CB 1 1 6 9759 1 1 25 HIS CD2 C -5.767 -3.710 4.153 1.00 . A A . 25 HIS CD2 1 1 6 9760 1 1 25 HIS CE1 C -6.901 -2.061 3.268 1.00 . A A . 25 HIS CE1 1 1 6 9761 1 1 25 HIS CG C -6.254 -2.947 5.173 1.00 . A A . 25 HIS CG 1 1 6 9762 1 1 25 HIS H H -8.342 -1.827 7.138 1.00 . A A . 25 HIS H 1 1 6 9763 1 1 25 HIS HA H -7.577 -4.626 6.918 1.00 . A A . 25 HIS HA 1 1 6 9764 1 1 25 HIS HB2 H -5.879 -2.121 7.099 1.00 . A A . 25 HIS HB2 1 1 6 9765 1 1 25 HIS HB3 H -5.270 -3.749 6.882 1.00 . A A . 25 HIS HB3 1 1 6 9766 1 1 25 HIS HD1 H -7.444 -1.183 5.069 1.00 . A A . 25 HIS HD1 1 1 6 9767 1 1 25 HIS HD2 H -5.158 -4.608 4.263 1.00 . A A . 25 HIS HD2 1 1 6 9768 1 1 25 HIS HE1 H -7.362 -1.407 2.528 1.00 . A A . 25 HIS HE1 1 1 6 9769 1 1 25 HIS N N -8.517 -2.811 7.095 1.00 . A A . 25 HIS N 1 1 6 9770 1 1 25 HIS ND1 N -6.964 -1.915 4.584 1.00 . A A . 25 HIS ND1 1 1 6 9771 1 1 25 HIS NE2 N -6.159 -3.174 3.003 1.00 . A A . 25 HIS NE2 1 1 6 9772 1 1 25 HIS O O -6.055 -3.927 9.354 1.00 . A A . 25 HIS O 1 1 6 9773 1 1 26 LYS C C -7.744 -5.365 11.372 1.00 . A A . 26 LYS C 1 1 6 9774 1 1 26 LYS CA C -8.284 -3.979 11.014 1.00 . A A . 26 LYS CA 1 1 6 9775 1 1 26 LYS CB C -9.666 -3.687 11.603 1.00 . A A . 26 LYS CB 1 1 6 9776 1 1 26 LYS CD C -11.569 -2.036 11.719 1.00 . A A . 26 LYS CD 1 1 6 9777 1 1 26 LYS CE C -11.470 -1.245 13.025 1.00 . A A . 26 LYS CE 1 1 6 9778 1 1 26 LYS CG C -10.180 -2.321 11.144 1.00 . A A . 26 LYS CG 1 1 6 9779 1 1 26 LYS H H -9.215 -3.740 9.166 1.00 . A A . 26 LYS H 1 1 6 9780 1 1 26 LYS HA H -7.600 -3.229 11.411 1.00 . A A . 26 LYS HA 1 1 6 9781 1 1 26 LYS HB2 H -10.367 -4.464 11.298 1.00 . A A . 26 LYS HB2 1 1 6 9782 1 1 26 LYS HB3 H -9.615 -3.714 12.691 1.00 . A A . 26 LYS HB3 1 1 6 9783 1 1 26 LYS HD2 H -12.159 -1.476 10.994 1.00 . A A . 26 LYS HD2 1 1 6 9784 1 1 26 LYS HD3 H -12.092 -2.976 11.898 1.00 . A A . 26 LYS HD3 1 1 6 9785 1 1 26 LYS HE2 H -10.443 -1.260 13.389 1.00 . A A . 26 LYS HE2 1 1 6 9786 1 1 26 LYS HE3 H -11.730 -0.202 12.845 1.00 . A A . 26 LYS HE3 1 1 6 9787 1 1 26 LYS HG2 H -9.485 -1.543 11.460 1.00 . A A . 26 LYS HG2 1 1 6 9788 1 1 26 LYS HG3 H -10.219 -2.290 10.056 1.00 . A A . 26 LYS HG3 1 1 6 9789 1 1 26 LYS HZ1 H -13.334 -1.860 13.725 1.00 . A A . 26 LYS HZ1 1 1 6 9790 1 1 26 LYS HZ2 H -12.108 -2.762 14.303 1.00 . A A . 26 LYS HZ2 1 1 6 9791 1 1 26 LYS N N -8.304 -3.829 9.569 1.00 . A A . 26 LYS N 1 1 6 9792 1 1 26 LYS NZ N -12.373 -1.818 14.048 1.00 . A A . 26 LYS NZ 1 1 6 9793 1 1 26 LYS O O -6.999 -5.515 12.339 1.00 . A A . 26 LYS O 1 1 6 9794 1 1 27 SER C C -6.234 -7.864 10.398 1.00 . A A . 27 SER C 1 1 6 9795 1 1 27 SER CA C -7.705 -7.713 10.791 1.00 . A A . 27 SER CA 1 1 6 9796 1 1 27 SER CB C -8.569 -8.699 10.002 1.00 . A A . 27 SER CB 1 1 6 9797 1 1 27 SER H H -8.745 -6.214 9.786 1.00 . A A . 27 SER H 1 1 6 9798 1 1 27 SER HA H -7.836 -7.889 11.859 1.00 . A A . 27 SER HA 1 1 6 9799 1 1 27 SER HB2 H -9.258 -8.146 9.363 1.00 . A A . 27 SER HB2 1 1 6 9800 1 1 27 SER HB3 H -7.933 -9.294 9.347 1.00 . A A . 27 SER HB3 1 1 6 9801 1 1 27 SER HG H -8.880 -9.600 11.762 1.00 . A A . 27 SER HG 1 1 6 9802 1 1 27 SER N N -8.139 -6.344 10.571 1.00 . A A . 27 SER N 1 1 6 9803 1 1 27 SER O O -5.606 -8.876 10.707 1.00 . A A . 27 SER O 1 1 6 9804 1 1 27 SER OG O -9.309 -9.564 10.859 1.00 . A A . 27 SER OG 1 1 6 9805 1 1 28 VAL C C -3.462 -6.240 10.378 1.00 . A A . 28 VAL C 1 1 6 9806 1 1 28 VAL CA C -4.341 -6.850 9.285 1.00 . A A . 28 VAL CA 1 1 6 9807 1 1 28 VAL CB C -4.214 -6.127 7.942 1.00 . A A . 28 VAL CB 1 1 6 9808 1 1 28 VAL CG1 C -2.804 -6.280 7.369 1.00 . A A . 28 VAL CG1 1 1 6 9809 1 1 28 VAL CG2 C -5.266 -6.626 6.949 1.00 . A A . 28 VAL CG2 1 1 6 9810 1 1 28 VAL H H -6.244 -6.023 9.476 1.00 . A A . 28 VAL H 1 1 6 9811 1 1 28 VAL HA H -4.048 -7.889 9.138 1.00 . A A . 28 VAL HA 1 1 6 9812 1 1 28 VAL HB H -4.392 -5.066 8.114 1.00 . A A . 28 VAL HB 1 1 6 9813 1 1 28 VAL HG11 H -2.474 -7.313 7.484 1.00 . A A . 28 VAL HG11 1 1 6 9814 1 1 28 VAL HG12 H -2.811 -6.016 6.311 1.00 . A A . 28 VAL HG12 1 1 6 9815 1 1 28 VAL HG13 H -2.121 -5.619 7.904 1.00 . A A . 28 VAL HG13 1 1 6 9816 1 1 28 VAL HG21 H -5.888 -7.382 7.428 1.00 . A A . 28 VAL HG21 1 1 6 9817 1 1 28 VAL HG22 H -5.890 -5.790 6.631 1.00 . A A . 28 VAL HG22 1 1 6 9818 1 1 28 VAL HG23 H -4.770 -7.060 6.081 1.00 . A A . 28 VAL HG23 1 1 6 9819 1 1 28 VAL N N -5.727 -6.843 9.723 1.00 . A A . 28 VAL N 1 1 6 9820 1 1 28 VAL O O -3.845 -5.258 11.012 1.00 . A A . 28 VAL O 1 1 6 9821 1 1 29 LYS C C -0.753 -5.049 11.112 1.00 . A A . 29 LYS C 1 1 6 9822 1 1 29 LYS CA C -1.362 -6.376 11.570 1.00 . A A . 29 LYS CA 1 1 6 9823 1 1 29 LYS CB C -0.322 -7.454 11.881 1.00 . A A . 29 LYS CB 1 1 6 9824 1 1 29 LYS CD C 0.770 -8.749 13.749 1.00 . A A . 29 LYS CD 1 1 6 9825 1 1 29 LYS CE C 1.014 -8.610 15.253 1.00 . A A . 29 LYS CE 1 1 6 9826 1 1 29 LYS CG C -0.466 -7.957 13.318 1.00 . A A . 29 LYS CG 1 1 6 9827 1 1 29 LYS H H -1.995 -7.645 10.044 1.00 . A A . 29 LYS H 1 1 6 9828 1 1 29 LYS HA H -1.926 -6.200 12.486 1.00 . A A . 29 LYS HA 1 1 6 9829 1 1 29 LYS HB2 H -0.438 -8.287 11.187 1.00 . A A . 29 LYS HB2 1 1 6 9830 1 1 29 LYS HB3 H 0.680 -7.052 11.731 1.00 . A A . 29 LYS HB3 1 1 6 9831 1 1 29 LYS HD2 H 0.640 -9.801 13.494 1.00 . A A . 29 LYS HD2 1 1 6 9832 1 1 29 LYS HD3 H 1.643 -8.394 13.201 1.00 . A A . 29 LYS HD3 1 1 6 9833 1 1 29 LYS HE2 H 2.084 -8.533 15.448 1.00 . A A . 29 LYS HE2 1 1 6 9834 1 1 29 LYS HE3 H 0.557 -7.690 15.618 1.00 . A A . 29 LYS HE3 1 1 6 9835 1 1 29 LYS HG2 H -0.613 -7.112 13.990 1.00 . A A . 29 LYS HG2 1 1 6 9836 1 1 29 LYS HG3 H -1.352 -8.587 13.400 1.00 . A A . 29 LYS HG3 1 1 6 9837 1 1 29 LYS HZ1 H 0.259 -9.555 16.950 1.00 . A A . 29 LYS HZ1 1 1 6 9838 1 1 29 LYS HZ2 H -0.418 -10.090 15.569 1.00 . A A . 29 LYS HZ2 1 1 6 9839 1 1 29 LYS N N -2.299 -6.847 10.564 1.00 . A A . 29 LYS N 1 1 6 9840 1 1 29 LYS NZ N 0.453 -9.771 15.979 1.00 . A A . 29 LYS NZ 1 1 6 9841 1 1 29 LYS O O -0.432 -4.882 9.937 1.00 . A A . 29 LYS O 1 1 6 9842 1 1 30 CYS C C 1.383 -3.026 11.275 1.00 . A A . 30 CYS C 1 1 6 9843 1 1 30 CYS CA C -0.050 -2.831 11.774 1.00 . A A . 30 CYS CA 1 1 6 9844 1 1 30 CYS CB C -0.109 -1.906 12.992 1.00 . A A . 30 CYS CB 1 1 6 9845 1 1 30 CYS H H -0.878 -4.282 13.019 1.00 . A A . 30 CYS H 1 1 6 9846 1 1 30 CYS HA H -0.673 -2.387 10.998 1.00 . A A . 30 CYS HA 1 1 6 9847 1 1 30 CYS HB2 H 0.727 -2.140 13.649 1.00 . A A . 30 CYS HB2 1 1 6 9848 1 1 30 CYS HB3 H 0.027 -0.878 12.656 1.00 . A A . 30 CYS HB3 1 1 6 9849 1 1 30 CYS N N -0.614 -4.139 12.065 1.00 . A A . 30 CYS N 1 1 6 9850 1 1 30 CYS O O 1.870 -2.248 10.456 1.00 . A A . 30 CYS O 1 1 6 9851 1 1 30 CYS SG S -1.661 -2.007 13.957 1.00 . A A . 30 CYS SG 1 1 6 9852 1 1 31 GLY C C 3.434 -5.026 10.022 1.00 . A A . 31 GLY C 1 1 6 9853 1 1 31 GLY CA C 3.385 -4.376 11.406 1.00 . A A . 31 GLY CA 1 1 6 9854 1 1 31 GLY H H 1.614 -4.697 12.455 1.00 . A A . 31 GLY H 1 1 6 9855 1 1 31 GLY HA2 H 3.980 -3.463 11.404 1.00 . A A . 31 GLY HA2 1 1 6 9856 1 1 31 GLY HA3 H 3.832 -5.045 12.142 1.00 . A A . 31 GLY HA3 1 1 6 9857 1 1 31 GLY N N 2.018 -4.069 11.789 1.00 . A A . 31 GLY N 1 1 6 9858 1 1 31 GLY O O 4.514 -5.287 9.493 1.00 . A A . 31 GLY O 1 1 6 9859 1 1 32 ASP C C 2.397 -4.825 7.087 1.00 . A A . 32 ASP C 1 1 6 9860 1 1 32 ASP CA C 2.146 -5.884 8.163 1.00 . A A . 32 ASP CA 1 1 6 9861 1 1 32 ASP CB C 0.749 -6.465 7.938 1.00 . A A . 32 ASP CB 1 1 6 9862 1 1 32 ASP CG C 0.623 -7.398 6.732 1.00 . A A . 32 ASP CG 1 1 6 9863 1 1 32 ASP H H 1.379 -5.053 9.912 1.00 . A A . 32 ASP H 1 1 6 9864 1 1 32 ASP HA H 2.898 -6.673 8.155 1.00 . A A . 32 ASP HA 1 1 6 9865 1 1 32 ASP HB2 H 0.451 -7.010 8.833 1.00 . A A . 32 ASP HB2 1 1 6 9866 1 1 32 ASP HB3 H 0.045 -5.642 7.817 1.00 . A A . 32 ASP HB3 1 1 6 9867 1 1 32 ASP N N 2.252 -5.269 9.475 1.00 . A A . 32 ASP N 1 1 6 9868 1 1 32 ASP O O 2.975 -5.122 6.042 1.00 . A A . 32 ASP O 1 1 6 9869 1 1 32 ASP OD1 O 1.050 -6.971 5.637 1.00 . A A . 32 ASP OD1 1 1 6 9870 1 1 32 ASP OD2 O 0.103 -8.517 6.932 1.00 . A A . 32 ASP OD2 1 1 6 9871 1 1 33 CYS C C 3.234 -1.604 6.975 1.00 . A A . 33 CYS C 1 1 6 9872 1 1 33 CYS CA C 2.118 -2.509 6.449 1.00 . A A . 33 CYS CA 1 1 6 9873 1 1 33 CYS CB C 0.811 -1.741 6.240 1.00 . A A . 33 CYS CB 1 1 6 9874 1 1 33 CYS H H 1.481 -3.380 8.231 1.00 . A A . 33 CYS H 1 1 6 9875 1 1 33 CYS HA H 2.394 -2.947 5.490 1.00 . A A . 33 CYS HA 1 1 6 9876 1 1 33 CYS HB2 H 0.224 -1.750 7.158 1.00 . A A . 33 CYS HB2 1 1 6 9877 1 1 33 CYS HB3 H 1.026 -0.697 6.010 1.00 . A A . 33 CYS HB3 1 1 6 9878 1 1 33 CYS N N 1.950 -3.613 7.379 1.00 . A A . 33 CYS N 1 1 6 9879 1 1 33 CYS O O 4.200 -1.328 6.265 1.00 . A A . 33 CYS O 1 1 6 9880 1 1 33 CYS SG S -0.148 -2.497 4.877 1.00 . A A . 33 CYS SG 1 1 6 9881 1 1 34 HIS C C 5.257 -1.124 9.278 1.00 . A A . 34 HIS C 1 1 6 9882 1 1 34 HIS CA C 4.044 -0.299 8.843 1.00 . A A . 34 HIS CA 1 1 6 9883 1 1 34 HIS CB C 3.416 0.485 9.997 1.00 . A A . 34 HIS CB 1 1 6 9884 1 1 34 HIS CD2 C 0.923 1.171 9.611 1.00 . A A . 34 HIS CD2 1 1 6 9885 1 1 34 HIS CE1 C 1.272 3.171 8.798 1.00 . A A . 34 HIS CE1 1 1 6 9886 1 1 34 HIS CG C 2.271 1.378 9.581 1.00 . A A . 34 HIS CG 1 1 6 9887 1 1 34 HIS H H 2.275 -1.396 8.784 1.00 . A A . 34 HIS H 1 1 6 9888 1 1 34 HIS HA H 4.358 0.420 8.085 1.00 . A A . 34 HIS HA 1 1 6 9889 1 1 34 HIS HB2 H 3.059 -0.219 10.749 1.00 . A A . 34 HIS HB2 1 1 6 9890 1 1 34 HIS HB3 H 4.185 1.095 10.470 1.00 . A A . 34 HIS HB3 1 1 6 9891 1 1 34 HIS HD1 H 3.342 3.093 8.914 1.00 . A A . 34 HIS HD1 1 1 6 9892 1 1 34 HIS HD2 H 0.425 0.267 9.964 1.00 . A A . 34 HIS HD2 1 1 6 9893 1 1 34 HIS HE1 H 1.088 4.161 8.381 1.00 . A A . 34 HIS HE1 1 1 6 9894 1 1 34 HIS N N 3.064 -1.167 8.214 1.00 . A A . 34 HIS N 1 1 6 9895 1 1 34 HIS ND1 N 2.460 2.647 9.063 1.00 . A A . 34 HIS ND1 1 1 6 9896 1 1 34 HIS NE2 N 0.321 2.255 9.139 1.00 . A A . 34 HIS NE2 1 1 6 9897 1 1 34 HIS O O 5.624 -1.123 10.452 1.00 . A A . 34 HIS O 1 1 6 9898 1 1 35 HIS C C 7.972 -1.886 9.496 1.00 . A A . 35 HIS C 1 1 6 9899 1 1 35 HIS CA C 7.008 -2.638 8.576 1.00 . A A . 35 HIS CA 1 1 6 9900 1 1 35 HIS CB C 7.666 -3.090 7.271 1.00 . A A . 35 HIS CB 1 1 6 9901 1 1 35 HIS CD2 C 7.802 -1.396 5.285 1.00 . A A . 35 HIS CD2 1 1 6 9902 1 1 35 HIS CE1 C 9.633 -0.358 5.886 1.00 . A A . 35 HIS CE1 1 1 6 9903 1 1 35 HIS CG C 8.238 -1.961 6.448 1.00 . A A . 35 HIS CG 1 1 6 9904 1 1 35 HIS H H 5.540 -1.804 7.356 1.00 . A A . 35 HIS H 1 1 6 9905 1 1 35 HIS HA H 6.646 -3.527 9.092 1.00 . A A . 35 HIS HA 1 1 6 9906 1 1 35 HIS HB2 H 8.462 -3.796 7.503 1.00 . A A . 35 HIS HB2 1 1 6 9907 1 1 35 HIS HB3 H 6.929 -3.626 6.672 1.00 . A A . 35 HIS HB3 1 1 6 9908 1 1 35 HIS HD1 H 9.953 -1.468 7.610 1.00 . A A . 35 HIS HD1 1 1 6 9909 1 1 35 HIS HD2 H 6.913 -1.689 4.728 1.00 . A A . 35 HIS HD2 1 1 6 9910 1 1 35 HIS HE1 H 10.472 0.338 5.883 1.00 . A A . 35 HIS HE1 1 1 6 9911 1 1 35 HIS N N 5.845 -1.809 8.308 1.00 . A A . 35 HIS N 1 1 6 9912 1 1 35 HIS ND1 N 9.393 -1.286 6.801 1.00 . A A . 35 HIS ND1 1 1 6 9913 1 1 35 HIS NE2 N 8.645 -0.428 4.948 1.00 . A A . 35 HIS NE2 1 1 6 9914 1 1 35 HIS O O 8.045 -0.659 9.457 1.00 . A A . 35 HIS O 1 1 6 9915 1 1 36 PRO C C 10.925 -1.630 10.522 1.00 . A A . 36 PRO C 1 1 6 9916 1 1 36 PRO CA C 9.665 -2.097 11.253 1.00 . A A . 36 PRO CA 1 1 6 9917 1 1 36 PRO CB C 9.939 -3.194 12.269 1.00 . A A . 36 PRO CB 1 1 6 9918 1 1 36 PRO CD C 8.649 -4.131 10.399 1.00 . A A . 36 PRO CD 1 1 6 9919 1 1 36 PRO CG C 9.490 -4.490 11.613 1.00 . A A . 36 PRO CG 1 1 6 9920 1 1 36 PRO HA H 9.280 -1.281 11.685 1.00 . A A . 36 PRO HA 1 1 6 9921 1 1 36 PRO HB2 H 10.998 -3.233 12.525 1.00 . A A . 36 PRO HB2 1 1 6 9922 1 1 36 PRO HB3 H 9.394 -3.015 13.195 1.00 . A A . 36 PRO HB3 1 1 6 9923 1 1 36 PRO HD2 H 9.045 -4.591 9.493 1.00 . A A . 36 PRO HD2 1 1 6 9924 1 1 36 PRO HD3 H 7.623 -4.481 10.511 1.00 . A A . 36 PRO HD3 1 1 6 9925 1 1 36 PRO HG2 H 10.352 -5.088 11.317 1.00 . A A . 36 PRO HG2 1 1 6 9926 1 1 36 PRO HG3 H 8.911 -5.092 12.314 1.00 . A A . 36 PRO HG3 1 1 6 9927 1 1 36 PRO N N 8.708 -2.675 10.325 1.00 . A A . 36 PRO N 1 1 6 9928 1 1 36 PRO O O 11.458 -2.346 9.676 1.00 . A A . 36 PRO O 1 1 6 9929 1 1 37 VAL C C 13.498 0.636 11.359 1.00 . A A . 37 VAL C 1 1 6 9930 1 1 37 VAL CA C 12.552 0.141 10.263 1.00 . A A . 37 VAL CA 1 1 6 9931 1 1 37 VAL CB C 12.154 1.239 9.275 1.00 . A A . 37 VAL CB 1 1 6 9932 1 1 37 VAL CG1 C 13.391 1.883 8.645 1.00 . A A . 37 VAL CG1 1 1 6 9933 1 1 37 VAL CG2 C 11.212 0.694 8.200 1.00 . A A . 37 VAL CG2 1 1 6 9934 1 1 37 VAL H H 10.926 0.145 11.564 1.00 . A A . 37 VAL H 1 1 6 9935 1 1 37 VAL HA H 13.049 -0.653 9.704 1.00 . A A . 37 VAL HA 1 1 6 9936 1 1 37 VAL HB H 11.620 2.011 9.829 1.00 . A A . 37 VAL HB 1 1 6 9937 1 1 37 VAL HG11 H 14.289 1.421 9.052 1.00 . A A . 37 VAL HG11 1 1 6 9938 1 1 37 VAL HG12 H 13.366 1.738 7.565 1.00 . A A . 37 VAL HG12 1 1 6 9939 1 1 37 VAL HG13 H 13.398 2.950 8.868 1.00 . A A . 37 VAL HG13 1 1 6 9940 1 1 37 VAL HG21 H 10.406 0.133 8.674 1.00 . A A . 37 VAL HG21 1 1 6 9941 1 1 37 VAL HG22 H 10.791 1.524 7.631 1.00 . A A . 37 VAL HG22 1 1 6 9942 1 1 37 VAL HG23 H 11.766 0.038 7.529 1.00 . A A . 37 VAL HG23 1 1 6 9943 1 1 37 VAL N N 11.365 -0.431 10.875 1.00 . A A . 37 VAL N 1 1 6 9944 1 1 37 VAL O O 13.208 1.623 12.034 1.00 . A A . 37 VAL O 1 1 6 9945 1 1 38 ASN C C 15.238 -0.388 13.832 1.00 . A A . 38 ASN C 1 1 6 9946 1 1 38 ASN CA C 15.598 0.284 12.505 1.00 . A A . 38 ASN CA 1 1 6 9947 1 1 38 ASN CB C 15.631 1.796 12.735 1.00 . A A . 38 ASN CB 1 1 6 9948 1 1 38 ASN CG C 17.039 2.264 13.108 1.00 . A A . 38 ASN CG 1 1 6 9949 1 1 38 ASN H H 14.837 -0.873 10.949 1.00 . A A . 38 ASN H 1 1 6 9950 1 1 38 ASN HA H 16.550 -0.066 12.105 1.00 . A A . 38 ASN HA 1 1 6 9951 1 1 38 ASN HB2 H 15.300 2.312 11.834 1.00 . A A . 38 ASN HB2 1 1 6 9952 1 1 38 ASN HB3 H 14.933 2.062 13.529 1.00 . A A . 38 ASN HB3 1 1 6 9953 1 1 38 ASN HD21 H 16.286 4.114 13.439 1.00 . A A . 38 ASN HD21 1 1 6 9954 1 1 38 ASN HD22 H 17.989 3.949 13.706 1.00 . A A . 38 ASN HD22 1 1 6 9955 1 1 38 ASN N N 14.609 -0.071 11.502 1.00 . A A . 38 ASN N 1 1 6 9956 1 1 38 ASN ND2 N 17.111 3.549 13.446 1.00 . A A . 38 ASN ND2 1 1 6 9957 1 1 38 ASN O O 16.060 -0.448 14.744 1.00 . A A . 38 ASN O 1 1 6 9958 1 1 38 ASN OD1 O 17.997 1.509 13.091 1.00 . A A . 38 ASN OD1 1 1 6 9959 1 1 39 GLY C C 12.470 -0.695 15.806 1.00 . A A . 39 GLY C 1 1 6 9960 1 1 39 GLY CA C 13.529 -1.541 15.095 1.00 . A A . 39 GLY CA 1 1 6 9961 1 1 39 GLY H H 13.345 -0.823 13.149 1.00 . A A . 39 GLY H 1 1 6 9962 1 1 39 GLY HA2 H 13.108 -2.512 14.834 1.00 . A A . 39 GLY HA2 1 1 6 9963 1 1 39 GLY HA3 H 14.364 -1.727 15.771 1.00 . A A . 39 GLY HA3 1 1 6 9964 1 1 39 GLY N N 14.008 -0.876 13.896 1.00 . A A . 39 GLY N 1 1 6 9965 1 1 39 GLY O O 11.956 -1.087 16.852 1.00 . A A . 39 GLY O 1 1 6 9966 1 1 40 LYS C C 9.884 1.237 14.978 1.00 . A A . 40 LYS C 1 1 6 9967 1 1 40 LYS CA C 11.187 1.355 15.771 1.00 . A A . 40 LYS CA 1 1 6 9968 1 1 40 LYS CB C 11.741 2.780 15.835 1.00 . A A . 40 LYS CB 1 1 6 9969 1 1 40 LYS CD C 13.006 4.425 14.402 1.00 . A A . 40 LYS CD 1 1 6 9970 1 1 40 LYS CE C 12.590 5.635 13.562 1.00 . A A . 40 LYS CE 1 1 6 9971 1 1 40 LYS CG C 11.897 3.372 14.433 1.00 . A A . 40 LYS CG 1 1 6 9972 1 1 40 LYS H H 12.598 0.762 14.357 1.00 . A A . 40 LYS H 1 1 6 9973 1 1 40 LYS HA H 10.998 1.036 16.796 1.00 . A A . 40 LYS HA 1 1 6 9974 1 1 40 LYS HB2 H 11.075 3.407 16.427 1.00 . A A . 40 LYS HB2 1 1 6 9975 1 1 40 LYS HB3 H 12.707 2.776 16.341 1.00 . A A . 40 LYS HB3 1 1 6 9976 1 1 40 LYS HD2 H 13.236 4.746 15.418 1.00 . A A . 40 LYS HD2 1 1 6 9977 1 1 40 LYS HD3 H 13.916 3.988 13.992 1.00 . A A . 40 LYS HD3 1 1 6 9978 1 1 40 LYS HE2 H 11.504 5.716 13.544 1.00 . A A . 40 LYS HE2 1 1 6 9979 1 1 40 LYS HE3 H 12.971 6.549 14.017 1.00 . A A . 40 LYS HE3 1 1 6 9980 1 1 40 LYS HG2 H 12.125 2.577 13.722 1.00 . A A . 40 LYS HG2 1 1 6 9981 1 1 40 LYS HG3 H 10.955 3.821 14.117 1.00 . A A . 40 LYS HG3 1 1 6 9982 1 1 40 LYS HZ1 H 12.921 6.338 11.628 1.00 . A A . 40 LYS HZ1 1 1 6 9983 1 1 40 LYS HZ2 H 14.111 5.363 12.163 1.00 . A A . 40 LYS HZ2 1 1 6 9984 1 1 40 LYS N N 12.175 0.450 15.208 1.00 . A A . 40 LYS N 1 1 6 9985 1 1 40 LYS NZ N 13.108 5.509 12.181 1.00 . A A . 40 LYS NZ 1 1 6 9986 1 1 40 LYS O O 9.760 1.804 13.893 1.00 . A A . 40 LYS O 1 1 6 9987 1 1 41 GLU C C 6.695 1.427 15.288 1.00 . A A . 41 GLU C 1 1 6 9988 1 1 41 GLU CA C 7.656 0.298 14.910 1.00 . A A . 41 GLU CA 1 1 6 9989 1 1 41 GLU CB C 7.069 -1.067 15.274 1.00 . A A . 41 GLU CB 1 1 6 9990 1 1 41 GLU CD C 6.048 -3.191 14.377 1.00 . A A . 41 GLU CD 1 1 6 9991 1 1 41 GLU CG C 6.740 -1.875 14.017 1.00 . A A . 41 GLU CG 1 1 6 9992 1 1 41 GLU H H 9.054 0.041 16.433 1.00 . A A . 41 GLU H 1 1 6 9993 1 1 41 GLU HA H 7.857 0.327 13.839 1.00 . A A . 41 GLU HA 1 1 6 9994 1 1 41 GLU HB2 H 7.778 -1.619 15.890 1.00 . A A . 41 GLU HB2 1 1 6 9995 1 1 41 GLU HB3 H 6.167 -0.931 15.870 1.00 . A A . 41 GLU HB3 1 1 6 9996 1 1 41 GLU HG2 H 6.096 -1.289 13.361 1.00 . A A . 41 GLU HG2 1 1 6 9997 1 1 41 GLU HG3 H 7.656 -2.081 13.463 1.00 . A A . 41 GLU HG3 1 1 6 9998 1 1 41 GLU N N 8.946 0.498 15.550 1.00 . A A . 41 GLU N 1 1 6 9999 1 1 41 GLU O O 6.199 1.474 16.413 1.00 . A A . 41 GLU O 1 1 6 10000 1 1 41 GLU OE1 O 4.875 -3.118 14.801 1.00 . A A . 41 GLU OE1 1 1 6 10001 1 1 41 GLU OE2 O 6.708 -4.241 14.219 1.00 . A A . 41 GLU OE2 1 1 6 10002 1 1 42 ASP C C 4.644 3.589 13.337 1.00 . A A . 42 ASP C 1 1 6 10003 1 1 42 ASP CA C 5.569 3.435 14.546 1.00 . A A . 42 ASP CA 1 1 6 10004 1 1 42 ASP CB C 6.355 4.737 14.710 1.00 . A A . 42 ASP CB 1 1 6 10005 1 1 42 ASP CG C 5.804 5.697 15.766 1.00 . A A . 42 ASP CG 1 1 6 10006 1 1 42 ASP H H 6.869 2.263 13.415 1.00 . A A . 42 ASP H 1 1 6 10007 1 1 42 ASP HA H 5.025 3.195 15.460 1.00 . A A . 42 ASP HA 1 1 6 10008 1 1 42 ASP HB2 H 7.386 4.492 14.965 1.00 . A A . 42 ASP HB2 1 1 6 10009 1 1 42 ASP HB3 H 6.379 5.252 13.749 1.00 . A A . 42 ASP HB3 1 1 6 10010 1 1 42 ASP N N 6.461 2.309 14.328 1.00 . A A . 42 ASP N 1 1 6 10011 1 1 42 ASP O O 4.749 2.835 12.371 1.00 . A A . 42 ASP O 1 1 6 10012 1 1 42 ASP OD1 O 5.434 5.196 16.850 1.00 . A A . 42 ASP OD1 1 1 6 10013 1 1 42 ASP OD2 O 5.764 6.910 15.465 1.00 . A A . 42 ASP OD2 1 1 6 10014 1 1 43 TYR C C 3.165 6.132 11.626 1.00 . A A . 43 TYR C 1 1 6 10015 1 1 43 TYR CA C 2.817 4.833 12.356 1.00 . A A . 43 TYR CA 1 1 6 10016 1 1 43 TYR CB C 1.449 4.989 13.024 1.00 . A A . 43 TYR CB 1 1 6 10017 1 1 43 TYR CD1 C 1.531 2.585 13.779 1.00 . A A . 43 TYR CD1 1 1 6 10018 1 1 43 TYR CD2 C 0.392 4.168 15.161 1.00 . A A . 43 TYR CD2 1 1 6 10019 1 1 43 TYR CE1 C 1.215 1.539 14.717 1.00 . A A . 43 TYR CE1 1 1 6 10020 1 1 43 TYR CE2 C 0.076 3.122 16.099 1.00 . A A . 43 TYR CE2 1 1 6 10021 1 1 43 TYR CG C 1.113 3.878 14.021 1.00 . A A . 43 TYR CG 1 1 6 10022 1 1 43 TYR CZ C 0.503 1.859 15.830 1.00 . A A . 43 TYR CZ 1 1 6 10023 1 1 43 TYR H H 3.681 5.180 14.220 1.00 . A A . 43 TYR H 1 1 6 10024 1 1 43 TYR HA H 2.870 4.004 11.652 1.00 . A A . 43 TYR HA 1 1 6 10025 1 1 43 TYR HB2 H 1.416 5.949 13.541 1.00 . A A . 43 TYR HB2 1 1 6 10026 1 1 43 TYR HB3 H 0.680 5.016 12.252 1.00 . A A . 43 TYR HB3 1 1 6 10027 1 1 43 TYR HD1 H 2.101 2.355 12.878 1.00 . A A . 43 TYR HD1 1 1 6 10028 1 1 43 TYR HD2 H 0.062 5.189 15.352 1.00 . A A . 43 TYR HD2 1 1 6 10029 1 1 43 TYR HE1 H 1.539 0.513 14.538 1.00 . A A . 43 TYR HE1 1 1 6 10030 1 1 43 TYR HE2 H -0.493 3.338 17.003 1.00 . A A . 43 TYR HE2 1 1 6 10031 1 1 43 TYR HH H 0.410 -0.022 16.315 1.00 . A A . 43 TYR HH 1 1 6 10032 1 1 43 TYR N N 3.760 4.571 13.430 1.00 . A A . 43 TYR N 1 1 6 10033 1 1 43 TYR O O 3.294 7.184 12.250 1.00 . A A . 43 TYR O 1 1 6 10034 1 1 43 TYR OH O 0.204 0.871 16.716 1.00 . A A . 43 TYR OH 1 1 6 10035 1 1 44 ARG C C 3.209 6.927 8.044 1.00 . A A . 44 ARG C 1 1 6 10036 1 1 44 ARG CA C 3.640 7.167 9.492 1.00 . A A . 44 ARG CA 1 1 6 10037 1 1 44 ARG CB C 5.142 7.456 9.529 1.00 . A A . 44 ARG CB 1 1 6 10038 1 1 44 ARG CD C 6.725 5.529 9.908 1.00 . A A . 44 ARG CD 1 1 6 10039 1 1 44 ARG CG C 5.934 6.326 8.868 1.00 . A A . 44 ARG CG 1 1 6 10040 1 1 44 ARG CZ C 7.877 7.025 11.548 1.00 . A A . 44 ARG CZ 1 1 6 10041 1 1 44 ARG H H 3.203 5.156 9.814 1.00 . A A . 44 ARG H 1 1 6 10042 1 1 44 ARG HA H 3.086 7.994 9.935 1.00 . A A . 44 ARG HA 1 1 6 10043 1 1 44 ARG HB2 H 5.348 8.396 9.018 1.00 . A A . 44 ARG HB2 1 1 6 10044 1 1 44 ARG HB3 H 5.468 7.577 10.562 1.00 . A A . 44 ARG HB3 1 1 6 10045 1 1 44 ARG HD2 H 6.078 5.264 10.745 1.00 . A A . 44 ARG HD2 1 1 6 10046 1 1 44 ARG HD3 H 7.079 4.596 9.471 1.00 . A A . 44 ARG HD3 1 1 6 10047 1 1 44 ARG HE H 8.698 6.354 9.826 1.00 . A A . 44 ARG HE 1 1 6 10048 1 1 44 ARG HG2 H 5.252 5.661 8.338 1.00 . A A . 44 ARG HG2 1 1 6 10049 1 1 44 ARG HG3 H 6.617 6.740 8.127 1.00 . A A . 44 ARG HG3 1 1 6 10050 1 1 44 ARG HH11 H 5.977 6.509 12.090 1.00 . A A . 44 ARG HH11 1 1 6 10051 1 1 44 ARG HH12 H 6.803 7.545 13.205 1.00 . A A . 44 ARG HH12 1 1 6 10052 1 1 44 ARG HH21 H 9.043 8.245 12.719 1.00 . A A . 44 ARG HH21 1 1 6 10053 1 1 44 ARG N N 3.309 6.016 10.314 1.00 . A A . 44 ARG N 1 1 6 10054 1 1 44 ARG NE N 7.873 6.328 10.392 1.00 . A A . 44 ARG NE 1 1 6 10055 1 1 44 ARG NH1 N 6.792 7.027 12.351 1.00 . A A . 44 ARG NH1 1 1 6 10056 1 1 44 ARG NH2 N 8.958 7.705 11.882 1.00 . A A . 44 ARG NH2 1 1 6 10057 1 1 44 ARG O O 2.707 5.855 7.712 1.00 . A A . 44 ARG O 1 1 6 10058 1 1 45 LYS C C 4.190 7.172 5.045 1.00 . A A . 45 LYS C 1 1 6 10059 1 1 45 LYS CA C 3.060 7.858 5.816 1.00 . A A . 45 LYS CA 1 1 6 10060 1 1 45 LYS CB C 2.694 9.239 5.271 1.00 . A A . 45 LYS CB 1 1 6 10061 1 1 45 LYS CD C 2.057 10.605 7.293 1.00 . A A . 45 LYS CD 1 1 6 10062 1 1 45 LYS CE C 1.227 11.863 7.556 1.00 . A A . 45 LYS CE 1 1 6 10063 1 1 45 LYS CG C 1.539 9.853 6.065 1.00 . A A . 45 LYS CG 1 1 6 10064 1 1 45 LYS H H 3.831 8.813 7.500 1.00 . A A . 45 LYS H 1 1 6 10065 1 1 45 LYS HA H 2.168 7.236 5.746 1.00 . A A . 45 LYS HA 1 1 6 10066 1 1 45 LYS HB2 H 3.563 9.896 5.319 1.00 . A A . 45 LYS HB2 1 1 6 10067 1 1 45 LYS HB3 H 2.415 9.157 4.221 1.00 . A A . 45 LYS HB3 1 1 6 10068 1 1 45 LYS HD2 H 2.020 9.952 8.166 1.00 . A A . 45 LYS HD2 1 1 6 10069 1 1 45 LYS HD3 H 3.101 10.878 7.144 1.00 . A A . 45 LYS HD3 1 1 6 10070 1 1 45 LYS HE2 H 0.691 12.148 6.651 1.00 . A A . 45 LYS HE2 1 1 6 10071 1 1 45 LYS HE3 H 0.477 11.658 8.320 1.00 . A A . 45 LYS HE3 1 1 6 10072 1 1 45 LYS HG2 H 0.977 10.535 5.427 1.00 . A A . 45 LYS HG2 1 1 6 10073 1 1 45 LYS HG3 H 0.850 9.068 6.378 1.00 . A A . 45 LYS HG3 1 1 6 10074 1 1 45 LYS HZ1 H 1.566 13.809 8.222 1.00 . A A . 45 LYS HZ1 1 1 6 10075 1 1 45 LYS HZ2 H 2.634 12.736 8.821 1.00 . A A . 45 LYS HZ2 1 1 6 10076 1 1 45 LYS N N 3.421 7.944 7.221 1.00 . A A . 45 LYS N 1 1 6 10077 1 1 45 LYS NZ N 2.098 12.976 7.995 1.00 . A A . 45 LYS NZ 1 1 6 10078 1 1 45 LYS O O 5.356 7.540 5.187 1.00 . A A . 45 LYS O 1 1 6 10079 1 1 46 CYS C C 5.522 6.438 2.561 1.00 . A A . 46 CYS C 1 1 6 10080 1 1 46 CYS CA C 4.773 5.447 3.453 1.00 . A A . 46 CYS CA 1 1 6 10081 1 1 46 CYS CB C 4.105 4.337 2.639 1.00 . A A . 46 CYS CB 1 1 6 10082 1 1 46 CYS H H 2.856 5.894 4.137 1.00 . A A . 46 CYS H 1 1 6 10083 1 1 46 CYS HA H 5.454 4.968 4.157 1.00 . A A . 46 CYS HA 1 1 6 10084 1 1 46 CYS HB2 H 3.724 4.766 1.712 1.00 . A A . 46 CYS HB2 1 1 6 10085 1 1 46 CYS HB3 H 4.861 3.602 2.363 1.00 . A A . 46 CYS HB3 1 1 6 10086 1 1 46 CYS N N 3.806 6.187 4.247 1.00 . A A . 46 CYS N 1 1 6 10087 1 1 46 CYS O O 6.747 6.388 2.463 1.00 . A A . 46 CYS O 1 1 6 10088 1 1 46 CYS SG S 2.734 3.477 3.493 1.00 . A A . 46 CYS SG 1 1 6 10089 1 1 47 GLY C C 5.951 9.463 1.853 1.00 . A A . 47 GLY C 1 1 6 10090 1 1 47 GLY CA C 5.330 8.318 1.051 1.00 . A A . 47 GLY CA 1 1 6 10091 1 1 47 GLY H H 3.759 7.351 2.018 1.00 . A A . 47 GLY H 1 1 6 10092 1 1 47 GLY HA2 H 6.090 7.858 0.419 1.00 . A A . 47 GLY HA2 1 1 6 10093 1 1 47 GLY HA3 H 4.559 8.710 0.388 1.00 . A A . 47 GLY HA3 1 1 6 10094 1 1 47 GLY N N 4.754 7.317 1.933 1.00 . A A . 47 GLY N 1 1 6 10095 1 1 47 GLY O O 5.653 10.631 1.609 1.00 . A A . 47 GLY O 1 1 6 10096 1 1 48 THR C C 8.842 10.422 3.058 1.00 . A A . 48 THR C 1 1 6 10097 1 1 48 THR CA C 7.470 10.069 3.635 1.00 . A A . 48 THR CA 1 1 6 10098 1 1 48 THR CB C 7.536 9.507 5.057 1.00 . A A . 48 THR CB 1 1 6 10099 1 1 48 THR CG2 C 8.636 10.162 5.895 1.00 . A A . 48 THR CG2 1 1 6 10100 1 1 48 THR H H 7.042 8.136 2.987 1.00 . A A . 48 THR H 1 1 6 10101 1 1 48 THR HA H 6.877 10.983 3.633 1.00 . A A . 48 THR HA 1 1 6 10102 1 1 48 THR HB H 7.651 8.423 5.042 1.00 . A A . 48 THR HB 1 1 6 10103 1 1 48 THR HG1 H 6.358 10.942 5.802 1.00 . A A . 48 THR HG1 1 1 6 10104 1 1 48 THR HG21 H 8.993 11.059 5.390 1.00 . A A . 48 THR HG21 1 1 6 10105 1 1 48 THR HG22 H 8.236 10.430 6.873 1.00 . A A . 48 THR HG22 1 1 6 10106 1 1 48 THR HG23 H 9.463 9.462 6.020 1.00 . A A . 48 THR HG23 1 1 6 10107 1 1 48 THR N N 6.805 9.088 2.795 1.00 . A A . 48 THR N 1 1 6 10108 1 1 48 THR O O 9.620 9.536 2.708 1.00 . A A . 48 THR O 1 1 6 10109 1 1 48 THR OG1 O 6.326 9.952 5.663 1.00 . A A . 48 THR OG1 1 1 6 10110 1 1 49 ALA C C 11.513 11.563 3.225 1.00 . A A . 49 ALA C 1 1 6 10111 1 1 49 ALA CA C 10.362 12.202 2.445 1.00 . A A . 49 ALA CA 1 1 6 10112 1 1 49 ALA CB C 10.392 13.730 2.508 1.00 . A A . 49 ALA CB 1 1 6 10113 1 1 49 ALA H H 8.460 12.435 3.262 1.00 . A A . 49 ALA H 1 1 6 10114 1 1 49 ALA HA H 10.424 11.892 1.402 1.00 . A A . 49 ALA HA 1 1 6 10115 1 1 49 ALA HB1 H 9.566 14.085 3.124 1.00 . A A . 49 ALA HB1 1 1 6 10116 1 1 49 ALA HB2 H 11.337 14.057 2.944 1.00 . A A . 49 ALA HB2 1 1 6 10117 1 1 49 ALA HB3 H 10.297 14.137 1.502 1.00 . A A . 49 ALA HB3 1 1 6 10118 1 1 49 ALA N N 9.097 11.720 2.975 1.00 . A A . 49 ALA N 1 1 6 10119 1 1 49 ALA O O 11.775 11.934 4.368 1.00 . A A . 49 ALA O 1 1 6 10120 1 1 50 GLY C C 13.016 8.415 3.282 1.00 . A A . 50 GLY C 1 1 6 10121 1 1 50 GLY CA C 13.286 9.918 3.194 1.00 . A A . 50 GLY CA 1 1 6 10122 1 1 50 GLY H H 11.950 10.317 1.646 1.00 . A A . 50 GLY H 1 1 6 10123 1 1 50 GLY HA2 H 14.194 10.095 2.616 1.00 . A A . 50 GLY HA2 1 1 6 10124 1 1 50 GLY HA3 H 13.460 10.319 4.192 1.00 . A A . 50 GLY HA3 1 1 6 10125 1 1 50 GLY N N 12.170 10.613 2.576 1.00 . A A . 50 GLY N 1 1 6 10126 1 1 50 GLY O O 13.918 7.636 3.586 1.00 . A A . 50 GLY O 1 1 6 10127 1 1 51 CYS C C 11.147 6.175 1.620 1.00 . A A . 51 CYS C 1 1 6 10128 1 1 51 CYS CA C 11.371 6.657 3.055 1.00 . A A . 51 CYS CA 1 1 6 10129 1 1 51 CYS CB C 10.130 6.452 3.926 1.00 . A A . 51 CYS CB 1 1 6 10130 1 1 51 CYS H H 11.044 8.693 2.763 1.00 . A A . 51 CYS H 1 1 6 10131 1 1 51 CYS HA H 12.190 6.111 3.523 1.00 . A A . 51 CYS HA 1 1 6 10132 1 1 51 CYS HB2 H 9.330 7.115 3.596 1.00 . A A . 51 CYS HB2 1 1 6 10133 1 1 51 CYS HB3 H 9.763 5.431 3.816 1.00 . A A . 51 CYS HB3 1 1 6 10134 1 1 51 CYS N N 11.771 8.053 3.010 1.00 . A A . 51 CYS N 1 1 6 10135 1 1 51 CYS O O 12.086 5.744 0.952 1.00 . A A . 51 CYS O 1 1 6 10136 1 1 51 CYS SG S 10.534 6.785 5.679 1.00 . A A . 51 CYS SG 1 1 6 10137 1 1 52 HIS C C 9.290 7.072 -1.030 1.00 . A A . 52 HIS C 1 1 6 10138 1 1 52 HIS CA C 9.538 5.842 -0.155 1.00 . A A . 52 HIS CA 1 1 6 10139 1 1 52 HIS CB C 8.345 4.885 -0.123 1.00 . A A . 52 HIS CB 1 1 6 10140 1 1 52 HIS CD2 C 8.231 3.003 1.687 1.00 . A A . 52 HIS CD2 1 1 6 10141 1 1 52 HIS CE1 C 9.533 1.546 0.704 1.00 . A A . 52 HIS CE1 1 1 6 10142 1 1 52 HIS CG C 8.647 3.547 0.507 1.00 . A A . 52 HIS CG 1 1 6 10143 1 1 52 HIS H H 9.140 6.616 1.737 1.00 . A A . 52 HIS H 1 1 6 10144 1 1 52 HIS HA H 10.394 5.293 -0.550 1.00 . A A . 52 HIS HA 1 1 6 10145 1 1 52 HIS HB2 H 7.529 5.357 0.424 1.00 . A A . 52 HIS HB2 1 1 6 10146 1 1 52 HIS HB3 H 7.994 4.724 -1.143 1.00 . A A . 52 HIS HB3 1 1 6 10147 1 1 52 HIS HD1 H 9.929 2.706 -0.970 1.00 . A A . 52 HIS HD1 1 1 6 10148 1 1 52 HIS HD2 H 7.572 3.481 2.411 1.00 . A A . 52 HIS HD2 1 1 6 10149 1 1 52 HIS HE1 H 10.101 0.636 0.511 1.00 . A A . 52 HIS HE1 1 1 6 10150 1 1 52 HIS N N 9.898 6.264 1.188 1.00 . A A . 52 HIS N 1 1 6 10151 1 1 52 HIS ND1 N 9.466 2.605 -0.090 1.00 . A A . 52 HIS ND1 1 1 6 10152 1 1 52 HIS NE2 N 8.767 1.795 1.804 1.00 . A A . 52 HIS NE2 1 1 6 10153 1 1 52 HIS O O 8.164 7.312 -1.464 1.00 . A A . 52 HIS O 1 1 6 10154 1 1 53 ASP C C 11.330 8.960 -3.181 1.00 . A A . 53 ASP C 1 1 6 10155 1 1 53 ASP CA C 10.270 9.018 -2.079 1.00 . A A . 53 ASP CA 1 1 6 10156 1 1 53 ASP CB C 10.527 10.273 -1.242 1.00 . A A . 53 ASP CB 1 1 6 10157 1 1 53 ASP CG C 9.819 11.536 -1.737 1.00 . A A . 53 ASP CG 1 1 6 10158 1 1 53 ASP H H 11.271 7.616 -0.908 1.00 . A A . 53 ASP H 1 1 6 10159 1 1 53 ASP HA H 9.255 9.020 -2.476 1.00 . A A . 53 ASP HA 1 1 6 10160 1 1 53 ASP HB2 H 10.215 10.077 -0.216 1.00 . A A . 53 ASP HB2 1 1 6 10161 1 1 53 ASP HB3 H 11.600 10.462 -1.218 1.00 . A A . 53 ASP HB3 1 1 6 10162 1 1 53 ASP N N 10.359 7.819 -1.264 1.00 . A A . 53 ASP N 1 1 6 10163 1 1 53 ASP O O 12.345 9.650 -3.108 1.00 . A A . 53 ASP O 1 1 6 10164 1 1 53 ASP OD1 O 8.576 11.577 -1.608 1.00 . A A . 53 ASP OD1 1 1 6 10165 1 1 53 ASP OD2 O 10.537 12.432 -2.232 1.00 . A A . 53 ASP OD2 1 1 6 10166 1 1 54 SER C C 11.464 8.751 -6.505 1.00 . A A . 54 SER C 1 1 6 10167 1 1 54 SER CA C 11.975 7.971 -5.292 1.00 . A A . 54 SER CA 1 1 6 10168 1 1 54 SER CB C 12.159 6.495 -5.649 1.00 . A A . 54 SER CB 1 1 6 10169 1 1 54 SER H H 10.230 7.571 -4.228 1.00 . A A . 54 SER H 1 1 6 10170 1 1 54 SER HA H 12.924 8.381 -4.946 1.00 . A A . 54 SER HA 1 1 6 10171 1 1 54 SER HB2 H 12.788 6.412 -6.536 1.00 . A A . 54 SER HB2 1 1 6 10172 1 1 54 SER HB3 H 12.683 5.988 -4.839 1.00 . A A . 54 SER HB3 1 1 6 10173 1 1 54 SER HG H 10.341 6.411 -6.481 1.00 . A A . 54 SER HG 1 1 6 10174 1 1 54 SER N N 11.058 8.129 -4.176 1.00 . A A . 54 SER N 1 1 6 10175 1 1 54 SER O O 12.253 9.282 -7.284 1.00 . A A . 54 SER O 1 1 6 10176 1 1 54 SER OG O 10.914 5.844 -5.889 1.00 . A A . 54 SER OG 1 1 6 10177 1 1 55 MET C C 10.099 9.046 -9.072 1.00 . A A . 55 MET C 1 1 6 10178 1 1 55 MET CA C 9.519 9.501 -7.731 1.00 . A A . 55 MET CA 1 1 6 10179 1 1 55 MET CB C 9.736 11.006 -7.565 1.00 . A A . 55 MET CB 1 1 6 10180 1 1 55 MET CE C 7.560 10.276 -4.895 1.00 . A A . 55 MET CE 1 1 6 10181 1 1 55 MET CG C 8.467 11.690 -7.053 1.00 . A A . 55 MET CG 1 1 6 10182 1 1 55 MET H H 9.510 8.361 -5.988 1.00 . A A . 55 MET H 1 1 6 10183 1 1 55 MET HA H 8.460 9.245 -7.680 1.00 . A A . 55 MET HA 1 1 6 10184 1 1 55 MET HB2 H 10.556 11.184 -6.869 1.00 . A A . 55 MET HB2 1 1 6 10185 1 1 55 MET HB3 H 10.029 11.443 -8.520 1.00 . A A . 55 MET HB3 1 1 6 10186 1 1 55 MET HE1 H 7.795 9.505 -5.628 1.00 . A A . 55 MET HE1 1 1 6 10187 1 1 55 MET HE2 H 7.826 9.923 -3.899 1.00 . A A . 55 MET HE2 1 1 6 10188 1 1 55 MET HE3 H 6.493 10.497 -4.929 1.00 . A A . 55 MET HE3 1 1 6 10189 1 1 55 MET HG2 H 8.397 12.698 -7.461 1.00 . A A . 55 MET HG2 1 1 6 10190 1 1 55 MET HG3 H 7.587 11.146 -7.396 1.00 . A A . 55 MET HG3 1 1 6 10191 1 1 55 MET N N 10.145 8.795 -6.626 1.00 . A A . 55 MET N 1 1 6 10192 1 1 55 MET O O 10.216 9.841 -10.003 1.00 . A A . 55 MET O 1 1 6 10193 1 1 55 MET SD S 8.486 11.755 -5.269 1.00 . A A . 55 MET SD 1 1 6 10194 1 1 56 ASP C C 9.945 6.369 -11.053 1.00 . A A . 56 ASP C 1 1 6 10195 1 1 56 ASP CA C 11.013 7.199 -10.338 1.00 . A A . 56 ASP CA 1 1 6 10196 1 1 56 ASP CB C 12.191 6.277 -10.014 1.00 . A A . 56 ASP CB 1 1 6 10197 1 1 56 ASP CG C 13.345 6.326 -11.017 1.00 . A A . 56 ASP CG 1 1 6 10198 1 1 56 ASP H H 10.349 7.129 -8.365 1.00 . A A . 56 ASP H 1 1 6 10199 1 1 56 ASP HA H 11.344 8.053 -10.929 1.00 . A A . 56 ASP HA 1 1 6 10200 1 1 56 ASP HB2 H 12.574 6.535 -9.027 1.00 . A A . 56 ASP HB2 1 1 6 10201 1 1 56 ASP HB3 H 11.824 5.252 -9.956 1.00 . A A . 56 ASP HB3 1 1 6 10202 1 1 56 ASP N N 10.447 7.769 -9.127 1.00 . A A . 56 ASP N 1 1 6 10203 1 1 56 ASP O O 9.795 6.461 -12.271 1.00 . A A . 56 ASP O 1 1 6 10204 1 1 56 ASP OD1 O 13.077 6.720 -12.172 1.00 . A A . 56 ASP OD1 1 1 6 10205 1 1 56 ASP OD2 O 14.470 5.970 -10.604 1.00 . A A . 56 ASP OD2 1 1 6 10206 1 1 57 LYS C C 8.811 3.638 -11.673 1.00 . A A . 57 LYS C 1 1 6 10207 1 1 57 LYS CA C 8.181 4.733 -10.809 1.00 . A A . 57 LYS CA 1 1 6 10208 1 1 57 LYS CB C 7.141 5.577 -11.549 1.00 . A A . 57 LYS CB 1 1 6 10209 1 1 57 LYS CD C 5.845 5.046 -13.645 1.00 . A A . 57 LYS CD 1 1 6 10210 1 1 57 LYS CE C 5.052 6.347 -13.786 1.00 . A A . 57 LYS CE 1 1 6 10211 1 1 57 LYS CG C 6.060 4.693 -12.172 1.00 . A A . 57 LYS CG 1 1 6 10212 1 1 57 LYS H H 9.359 5.510 -9.277 1.00 . A A . 57 LYS H 1 1 6 10213 1 1 57 LYS HA H 7.674 4.260 -9.968 1.00 . A A . 57 LYS HA 1 1 6 10214 1 1 57 LYS HB2 H 6.684 6.285 -10.857 1.00 . A A . 57 LYS HB2 1 1 6 10215 1 1 57 LYS HB3 H 7.630 6.163 -12.326 1.00 . A A . 57 LYS HB3 1 1 6 10216 1 1 57 LYS HD2 H 6.809 5.148 -14.143 1.00 . A A . 57 LYS HD2 1 1 6 10217 1 1 57 LYS HD3 H 5.312 4.236 -14.144 1.00 . A A . 57 LYS HD3 1 1 6 10218 1 1 57 LYS HE2 H 4.344 6.261 -14.611 1.00 . A A . 57 LYS HE2 1 1 6 10219 1 1 57 LYS HE3 H 4.468 6.524 -12.883 1.00 . A A . 57 LYS HE3 1 1 6 10220 1 1 57 LYS HG2 H 6.347 3.645 -12.084 1.00 . A A . 57 LYS HG2 1 1 6 10221 1 1 57 LYS HG3 H 5.125 4.814 -11.625 1.00 . A A . 57 LYS HG3 1 1 6 10222 1 1 57 LYS HZ1 H 6.397 7.814 -13.168 1.00 . A A . 57 LYS HZ1 1 1 6 10223 1 1 57 LYS HZ2 H 6.718 7.245 -14.660 1.00 . A A . 57 LYS HZ2 1 1 6 10224 1 1 57 LYS N N 9.231 5.578 -10.266 1.00 . A A . 57 LYS N 1 1 6 10225 1 1 57 LYS NZ N 5.965 7.487 -14.025 1.00 . A A . 57 LYS NZ 1 1 6 10226 1 1 57 LYS O O 8.769 2.461 -11.318 1.00 . A A . 57 LYS O 1 1 6 10227 1 1 58 LYS C C 11.291 2.583 -13.066 1.00 . A A . 58 LYS C 1 1 6 10228 1 1 58 LYS CA C 10.016 3.134 -13.709 1.00 . A A . 58 LYS CA 1 1 6 10229 1 1 58 LYS CB C 10.249 3.797 -15.068 1.00 . A A . 58 LYS CB 1 1 6 10230 1 1 58 LYS CD C 11.641 3.088 -17.047 1.00 . A A . 58 LYS CD 1 1 6 10231 1 1 58 LYS CE C 11.191 3.686 -18.381 1.00 . A A . 58 LYS CE 1 1 6 10232 1 1 58 LYS CG C 10.438 2.748 -16.165 1.00 . A A . 58 LYS CG 1 1 6 10233 1 1 58 LYS H H 9.409 5.023 -13.073 1.00 . A A . 58 LYS H 1 1 6 10234 1 1 58 LYS HA H 9.324 2.307 -13.868 1.00 . A A . 58 LYS HA 1 1 6 10235 1 1 58 LYS HB2 H 9.403 4.438 -15.314 1.00 . A A . 58 LYS HB2 1 1 6 10236 1 1 58 LYS HB3 H 11.129 4.439 -15.017 1.00 . A A . 58 LYS HB3 1 1 6 10237 1 1 58 LYS HD2 H 12.290 3.794 -16.528 1.00 . A A . 58 LYS HD2 1 1 6 10238 1 1 58 LYS HD3 H 12.230 2.188 -17.228 1.00 . A A . 58 LYS HD3 1 1 6 10239 1 1 58 LYS HE2 H 10.296 4.290 -18.232 1.00 . A A . 58 LYS HE2 1 1 6 10240 1 1 58 LYS HE3 H 11.964 4.351 -18.767 1.00 . A A . 58 LYS HE3 1 1 6 10241 1 1 58 LYS HG2 H 10.580 1.766 -15.713 1.00 . A A . 58 LYS HG2 1 1 6 10242 1 1 58 LYS HG3 H 9.538 2.691 -16.777 1.00 . A A . 58 LYS HG3 1 1 6 10243 1 1 58 LYS HZ1 H 10.907 2.964 -20.315 1.00 . A A . 58 LYS HZ1 1 1 6 10244 1 1 58 LYS HZ2 H 11.611 1.878 -19.327 1.00 . A A . 58 LYS HZ2 1 1 6 10245 1 1 58 LYS N N 9.379 4.064 -12.791 1.00 . A A . 58 LYS N 1 1 6 10246 1 1 58 LYS NZ N 10.915 2.614 -19.363 1.00 . A A . 58 LYS NZ 1 1 6 10247 1 1 58 LYS O O 12.391 2.816 -13.564 1.00 . A A . 58 LYS O 1 1 6 10248 1 1 59 ASP C C 11.691 0.336 -10.170 1.00 . A A . 59 ASP C 1 1 6 10249 1 1 59 ASP CA C 12.220 1.277 -11.255 1.00 . A A . 59 ASP CA 1 1 6 10250 1 1 59 ASP CB C 13.064 2.356 -10.575 1.00 . A A . 59 ASP CB 1 1 6 10251 1 1 59 ASP CG C 14.340 2.747 -11.323 1.00 . A A . 59 ASP CG 1 1 6 10252 1 1 59 ASP H H 10.201 1.678 -11.573 1.00 . A A . 59 ASP H 1 1 6 10253 1 1 59 ASP HA H 12.802 0.753 -12.014 1.00 . A A . 59 ASP HA 1 1 6 10254 1 1 59 ASP HB2 H 12.450 3.248 -10.444 1.00 . A A . 59 ASP HB2 1 1 6 10255 1 1 59 ASP HB3 H 13.337 2.009 -9.579 1.00 . A A . 59 ASP HB3 1 1 6 10256 1 1 59 ASP N N 11.099 1.863 -11.971 1.00 . A A . 59 ASP N 1 1 6 10257 1 1 59 ASP O O 10.502 0.352 -9.856 1.00 . A A . 59 ASP O 1 1 6 10258 1 1 59 ASP OD1 O 14.503 2.257 -12.462 1.00 . A A . 59 ASP OD1 1 1 6 10259 1 1 59 ASP OD2 O 15.124 3.526 -10.740 1.00 . A A . 59 ASP OD2 1 1 6 10260 1 1 60 LYS C C 13.448 -1.641 -7.677 1.00 . A A . 60 LYS C 1 1 6 10261 1 1 60 LYS CA C 12.240 -1.406 -8.586 1.00 . A A . 60 LYS CA 1 1 6 10262 1 1 60 LYS CB C 11.673 -2.688 -9.198 1.00 . A A . 60 LYS CB 1 1 6 10263 1 1 60 LYS CD C 10.190 -2.168 -11.170 1.00 . A A . 60 LYS CD 1 1 6 10264 1 1 60 LYS CE C 8.932 -1.375 -11.529 1.00 . A A . 60 LYS CE 1 1 6 10265 1 1 60 LYS CG C 10.233 -2.479 -9.673 1.00 . A A . 60 LYS CG 1 1 6 10266 1 1 60 LYS H H 13.565 -0.467 -9.890 1.00 . A A . 60 LYS H 1 1 6 10267 1 1 60 LYS HA H 11.446 -0.953 -7.994 1.00 . A A . 60 LYS HA 1 1 6 10268 1 1 60 LYS HB2 H 12.294 -3.002 -10.037 1.00 . A A . 60 LYS HB2 1 1 6 10269 1 1 60 LYS HB3 H 11.703 -3.492 -8.462 1.00 . A A . 60 LYS HB3 1 1 6 10270 1 1 60 LYS HD2 H 11.076 -1.599 -11.453 1.00 . A A . 60 LYS HD2 1 1 6 10271 1 1 60 LYS HD3 H 10.213 -3.097 -11.739 1.00 . A A . 60 LYS HD3 1 1 6 10272 1 1 60 LYS HE2 H 8.075 -2.046 -11.587 1.00 . A A . 60 LYS HE2 1 1 6 10273 1 1 60 LYS HE3 H 8.716 -0.649 -10.745 1.00 . A A . 60 LYS HE3 1 1 6 10274 1 1 60 LYS HG2 H 9.645 -3.373 -9.466 1.00 . A A . 60 LYS HG2 1 1 6 10275 1 1 60 LYS HG3 H 9.778 -1.661 -9.115 1.00 . A A . 60 LYS HG3 1 1 6 10276 1 1 60 LYS HZ1 H 10.087 -0.497 -13.025 1.00 . A A . 60 LYS HZ1 1 1 6 10277 1 1 60 LYS HZ2 H 8.744 -1.217 -13.599 1.00 . A A . 60 LYS HZ2 1 1 6 10278 1 1 60 LYS N N 12.600 -0.461 -9.628 1.00 . A A . 60 LYS N 1 1 6 10279 1 1 60 LYS NZ N 9.110 -0.677 -12.822 1.00 . A A . 60 LYS NZ 1 1 6 10280 1 1 60 LYS O O 14.571 -1.793 -8.157 1.00 . A A . 60 LYS O 1 1 6 10281 1 1 61 SER C C 13.649 -1.804 -3.986 1.00 . A A . 61 SER C 1 1 6 10282 1 1 61 SER CA C 14.229 -1.878 -5.400 1.00 . A A . 61 SER CA 1 1 6 10283 1 1 61 SER CB C 15.353 -0.853 -5.566 1.00 . A A . 61 SER CB 1 1 6 10284 1 1 61 SER H H 12.262 -1.540 -5.998 1.00 . A A . 61 SER H 1 1 6 10285 1 1 61 SER HA H 14.615 -2.876 -5.604 1.00 . A A . 61 SER HA 1 1 6 10286 1 1 61 SER HB2 H 15.117 -0.187 -6.396 1.00 . A A . 61 SER HB2 1 1 6 10287 1 1 61 SER HB3 H 15.416 -0.235 -4.670 1.00 . A A . 61 SER HB3 1 1 6 10288 1 1 61 SER HG H 17.346 -0.800 -5.739 1.00 . A A . 61 SER HG 1 1 6 10289 1 1 61 SER N N 13.178 -1.664 -6.380 1.00 . A A . 61 SER N 1 1 6 10290 1 1 61 SER O O 13.656 -2.794 -3.256 1.00 . A A . 61 SER O 1 1 6 10291 1 1 61 SER OG O 16.613 -1.477 -5.801 1.00 . A A . 61 SER OG 1 1 6 10292 1 1 62 ALA C C 12.089 1.040 -2.223 1.00 . A A . 62 ALA C 1 1 6 10293 1 1 62 ALA CA C 12.576 -0.407 -2.329 1.00 . A A . 62 ALA CA 1 1 6 10294 1 1 62 ALA CB C 13.604 -0.756 -1.250 1.00 . A A . 62 ALA CB 1 1 6 10295 1 1 62 ALA H H 13.157 0.178 -4.242 1.00 . A A . 62 ALA H 1 1 6 10296 1 1 62 ALA HA H 11.723 -1.077 -2.230 1.00 . A A . 62 ALA HA 1 1 6 10297 1 1 62 ALA HB1 H 14.340 -1.447 -1.661 1.00 . A A . 62 ALA HB1 1 1 6 10298 1 1 62 ALA HB2 H 14.106 0.153 -0.918 1.00 . A A . 62 ALA HB2 1 1 6 10299 1 1 62 ALA HB3 H 13.099 -1.222 -0.405 1.00 . A A . 62 ALA HB3 1 1 6 10300 1 1 62 ALA N N 13.159 -0.622 -3.642 1.00 . A A . 62 ALA N 1 1 6 10301 1 1 62 ALA O O 10.972 1.291 -1.773 1.00 . A A . 62 ALA O 1 1 6 10302 1 1 63 LYS C C 11.459 3.646 -3.557 1.00 . A A . 63 LYS C 1 1 6 10303 1 1 63 LYS CA C 12.622 3.368 -2.603 1.00 . A A . 63 LYS CA 1 1 6 10304 1 1 63 LYS CB C 13.865 4.215 -2.885 1.00 . A A . 63 LYS CB 1 1 6 10305 1 1 63 LYS CD C 15.189 5.781 -1.418 1.00 . A A . 63 LYS CD 1 1 6 10306 1 1 63 LYS CE C 16.655 5.969 -1.815 1.00 . A A . 63 LYS CE 1 1 6 10307 1 1 63 LYS CG C 14.742 4.335 -1.638 1.00 . A A . 63 LYS CG 1 1 6 10308 1 1 63 LYS H H 13.857 1.741 -3.010 1.00 . A A . 63 LYS H 1 1 6 10309 1 1 63 LYS HA H 12.299 3.599 -1.588 1.00 . A A . 63 LYS HA 1 1 6 10310 1 1 63 LYS HB2 H 14.439 3.768 -3.696 1.00 . A A . 63 LYS HB2 1 1 6 10311 1 1 63 LYS HB3 H 13.564 5.208 -3.219 1.00 . A A . 63 LYS HB3 1 1 6 10312 1 1 63 LYS HD2 H 14.562 6.453 -2.004 1.00 . A A . 63 LYS HD2 1 1 6 10313 1 1 63 LYS HD3 H 15.055 6.052 -0.371 1.00 . A A . 63 LYS HD3 1 1 6 10314 1 1 63 LYS HE2 H 17.300 5.728 -0.970 1.00 . A A . 63 LYS HE2 1 1 6 10315 1 1 63 LYS HE3 H 16.911 5.278 -2.618 1.00 . A A . 63 LYS HE3 1 1 6 10316 1 1 63 LYS HG2 H 14.190 3.985 -0.765 1.00 . A A . 63 LYS HG2 1 1 6 10317 1 1 63 LYS HG3 H 15.616 3.692 -1.741 1.00 . A A . 63 LYS HG3 1 1 6 10318 1 1 63 LYS HZ1 H 16.066 7.934 -2.181 1.00 . A A . 63 LYS HZ1 1 1 6 10319 1 1 63 LYS HZ2 H 17.616 7.814 -1.696 1.00 . A A . 63 LYS HZ2 1 1 6 10320 1 1 63 LYS N N 12.951 1.954 -2.645 1.00 . A A . 63 LYS N 1 1 6 10321 1 1 63 LYS NZ N 16.900 7.361 -2.253 1.00 . A A . 63 LYS NZ 1 1 6 10322 1 1 63 LYS O O 10.827 4.699 -3.481 1.00 . A A . 63 LYS O 1 1 6 10323 1 1 64 GLY C C 8.769 2.756 -4.713 1.00 . A A . 64 GLY C 1 1 6 10324 1 1 64 GLY CA C 10.135 2.811 -5.401 1.00 . A A . 64 GLY CA 1 1 6 10325 1 1 64 GLY H H 11.729 1.830 -4.487 1.00 . A A . 64 GLY H 1 1 6 10326 1 1 64 GLY HA2 H 10.236 3.752 -5.941 1.00 . A A . 64 GLY HA2 1 1 6 10327 1 1 64 GLY HA3 H 10.207 2.011 -6.138 1.00 . A A . 64 GLY HA3 1 1 6 10328 1 1 64 GLY N N 11.211 2.683 -4.433 1.00 . A A . 64 GLY N 1 1 6 10329 1 1 64 GLY O O 8.211 1.677 -4.518 1.00 . A A . 64 GLY O 1 1 6 10330 1 1 65 TYR C C 5.909 3.258 -4.470 1.00 . A A . 65 TYR C 1 1 6 10331 1 1 65 TYR CA C 6.981 4.032 -3.701 1.00 . A A . 65 TYR CA 1 1 6 10332 1 1 65 TYR CB C 6.620 5.519 -3.702 1.00 . A A . 65 TYR CB 1 1 6 10333 1 1 65 TYR CD1 C 4.841 5.618 -1.918 1.00 . A A . 65 TYR CD1 1 1 6 10334 1 1 65 TYR CD2 C 4.254 6.272 -4.142 1.00 . A A . 65 TYR CD2 1 1 6 10335 1 1 65 TYR CE1 C 3.496 5.895 -1.483 1.00 . A A . 65 TYR CE1 1 1 6 10336 1 1 65 TYR CE2 C 2.910 6.548 -3.706 1.00 . A A . 65 TYR CE2 1 1 6 10337 1 1 65 TYR CG C 5.192 5.812 -3.239 1.00 . A A . 65 TYR CG 1 1 6 10338 1 1 65 TYR CZ C 2.597 6.346 -2.398 1.00 . A A . 65 TYR CZ 1 1 6 10339 1 1 65 TYR H H 8.731 4.805 -4.525 1.00 . A A . 65 TYR H 1 1 6 10340 1 1 65 TYR HA H 7.082 3.605 -2.703 1.00 . A A . 65 TYR HA 1 1 6 10341 1 1 65 TYR HB2 H 7.317 6.052 -3.056 1.00 . A A . 65 TYR HB2 1 1 6 10342 1 1 65 TYR HB3 H 6.753 5.914 -4.709 1.00 . A A . 65 TYR HB3 1 1 6 10343 1 1 65 TYR HD1 H 5.581 5.256 -1.205 1.00 . A A . 65 TYR HD1 1 1 6 10344 1 1 65 TYR HD2 H 4.532 6.425 -5.185 1.00 . A A . 65 TYR HD2 1 1 6 10345 1 1 65 TYR HE1 H 3.206 5.746 -0.443 1.00 . A A . 65 TYR HE1 1 1 6 10346 1 1 65 TYR HE2 H 2.160 6.911 -4.409 1.00 . A A . 65 TYR HE2 1 1 6 10347 1 1 65 TYR HH H 1.285 7.511 -1.561 1.00 . A A . 65 TYR HH 1 1 6 10348 1 1 65 TYR N N 8.271 3.932 -4.363 1.00 . A A . 65 TYR N 1 1 6 10349 1 1 65 TYR O O 5.054 2.610 -3.868 1.00 . A A . 65 TYR O 1 1 6 10350 1 1 65 TYR OH O 1.328 6.607 -1.987 1.00 . A A . 65 TYR OH 1 1 6 10351 1 1 66 TYR C C 5.402 1.193 -6.809 1.00 . A A . 66 TYR C 1 1 6 10352 1 1 66 TYR CA C 5.035 2.669 -6.647 1.00 . A A . 66 TYR CA 1 1 6 10353 1 1 66 TYR CB C 5.126 3.357 -8.010 1.00 . A A . 66 TYR CB 1 1 6 10354 1 1 66 TYR CD1 C 5.408 1.498 -9.689 1.00 . A A . 66 TYR CD1 1 1 6 10355 1 1 66 TYR CD2 C 3.366 2.740 -9.707 1.00 . A A . 66 TYR CD2 1 1 6 10356 1 1 66 TYR CE1 C 4.928 0.694 -10.784 1.00 . A A . 66 TYR CE1 1 1 6 10357 1 1 66 TYR CE2 C 2.886 1.937 -10.801 1.00 . A A . 66 TYR CE2 1 1 6 10358 1 1 66 TYR CG C 4.616 2.504 -9.174 1.00 . A A . 66 TYR CG 1 1 6 10359 1 1 66 TYR CZ C 3.691 0.953 -11.286 1.00 . A A . 66 TYR CZ 1 1 6 10360 1 1 66 TYR H H 6.687 3.881 -6.271 1.00 . A A . 66 TYR H 1 1 6 10361 1 1 66 TYR HA H 4.051 2.743 -6.182 1.00 . A A . 66 TYR HA 1 1 6 10362 1 1 66 TYR HB2 H 4.555 4.285 -7.977 1.00 . A A . 66 TYR HB2 1 1 6 10363 1 1 66 TYR HB3 H 6.164 3.629 -8.200 1.00 . A A . 66 TYR HB3 1 1 6 10364 1 1 66 TYR HD1 H 6.396 1.311 -9.268 1.00 . A A . 66 TYR HD1 1 1 6 10365 1 1 66 TYR HD2 H 2.741 3.535 -9.299 1.00 . A A . 66 TYR HD2 1 1 6 10366 1 1 66 TYR HE1 H 5.543 -0.104 -11.201 1.00 . A A . 66 TYR HE1 1 1 6 10367 1 1 66 TYR HE2 H 1.901 2.113 -11.232 1.00 . A A . 66 TYR HE2 1 1 6 10368 1 1 66 TYR HH H 2.329 -0.164 -12.108 1.00 . A A . 66 TYR HH 1 1 6 10369 1 1 66 TYR N N 5.988 3.352 -5.789 1.00 . A A . 66 TYR N 1 1 6 10370 1 1 66 TYR O O 4.698 0.445 -7.486 1.00 . A A . 66 TYR O 1 1 6 10371 1 1 66 TYR OH O 3.239 0.195 -12.320 1.00 . A A . 66 TYR OH 1 1 6 10372 1 1 67 HIS C C 6.571 -1.297 -4.963 1.00 . A A . 67 HIS C 1 1 6 10373 1 1 67 HIS CA C 6.972 -0.557 -6.240 1.00 . A A . 67 HIS CA 1 1 6 10374 1 1 67 HIS CB C 8.478 -0.604 -6.505 1.00 . A A . 67 HIS CB 1 1 6 10375 1 1 67 HIS CD2 C 9.591 -1.852 -4.495 1.00 . A A . 67 HIS CD2 1 1 6 10376 1 1 67 HIS CE1 C 10.170 -3.681 -5.546 1.00 . A A . 67 HIS CE1 1 1 6 10377 1 1 67 HIS CG C 9.191 -1.729 -5.794 1.00 . A A . 67 HIS CG 1 1 6 10378 1 1 67 HIS H H 7.069 1.431 -5.626 1.00 . A A . 67 HIS H 1 1 6 10379 1 1 67 HIS HA H 6.470 -1.018 -7.091 1.00 . A A . 67 HIS HA 1 1 6 10380 1 1 67 HIS HB2 H 8.645 -0.703 -7.578 1.00 . A A . 67 HIS HB2 1 1 6 10381 1 1 67 HIS HB3 H 8.921 0.344 -6.200 1.00 . A A . 67 HIS HB3 1 1 6 10382 1 1 67 HIS HD1 H 9.420 -3.114 -7.396 1.00 . A A . 67 HIS HD1 1 1 6 10383 1 1 67 HIS HD2 H 9.448 -1.107 -3.713 1.00 . A A . 67 HIS HD2 1 1 6 10384 1 1 67 HIS HE1 H 10.583 -4.671 -5.742 1.00 . A A . 67 HIS HE1 1 1 6 10385 1 1 67 HIS N N 6.503 0.817 -6.175 1.00 . A A . 67 HIS N 1 1 6 10386 1 1 67 HIS ND1 N 9.571 -2.898 -6.431 1.00 . A A . 67 HIS ND1 1 1 6 10387 1 1 67 HIS NE2 N 10.181 -3.031 -4.347 1.00 . A A . 67 HIS NE2 1 1 6 10388 1 1 67 HIS O O 6.630 -2.525 -4.908 1.00 . A A . 67 HIS O 1 1 6 10389 1 1 68 VAL C C 4.236 -1.045 -2.590 1.00 . A A . 68 VAL C 1 1 6 10390 1 1 68 VAL CA C 5.762 -1.087 -2.694 1.00 . A A . 68 VAL CA 1 1 6 10391 1 1 68 VAL CB C 6.459 -0.354 -1.546 1.00 . A A . 68 VAL CB 1 1 6 10392 1 1 68 VAL CG1 C 7.876 -0.892 -1.332 1.00 . A A . 68 VAL CG1 1 1 6 10393 1 1 68 VAL CG2 C 6.477 1.156 -1.790 1.00 . A A . 68 VAL CG2 1 1 6 10394 1 1 68 VAL H H 6.127 0.478 -4.020 1.00 . A A . 68 VAL H 1 1 6 10395 1 1 68 VAL HA H 6.087 -2.127 -2.677 1.00 . A A . 68 VAL HA 1 1 6 10396 1 1 68 VAL HB H 5.890 -0.539 -0.635 1.00 . A A . 68 VAL HB 1 1 6 10397 1 1 68 VAL HG11 H 7.878 -1.973 -1.469 1.00 . A A . 68 VAL HG11 1 1 6 10398 1 1 68 VAL HG12 H 8.551 -0.433 -2.055 1.00 . A A . 68 VAL HG12 1 1 6 10399 1 1 68 VAL HG13 H 8.207 -0.652 -0.322 1.00 . A A . 68 VAL HG13 1 1 6 10400 1 1 68 VAL HG21 H 5.469 1.499 -2.020 1.00 . A A . 68 VAL HG21 1 1 6 10401 1 1 68 VAL HG22 H 6.838 1.664 -0.896 1.00 . A A . 68 VAL HG22 1 1 6 10402 1 1 68 VAL HG23 H 7.138 1.381 -2.627 1.00 . A A . 68 VAL HG23 1 1 6 10403 1 1 68 VAL N N 6.172 -0.520 -3.967 1.00 . A A . 68 VAL N 1 1 6 10404 1 1 68 VAL O O 3.674 -1.327 -1.532 1.00 . A A . 68 VAL O 1 1 6 10405 1 1 69 MET C C 1.586 -1.595 -4.770 1.00 . A A . 69 MET C 1 1 6 10406 1 1 69 MET CA C 2.158 -0.609 -3.749 1.00 . A A . 69 MET CA 1 1 6 10407 1 1 69 MET CB C 1.740 0.814 -4.123 1.00 . A A . 69 MET CB 1 1 6 10408 1 1 69 MET CE C 2.657 2.067 -0.435 1.00 . A A . 69 MET CE 1 1 6 10409 1 1 69 MET CG C 2.318 1.832 -3.139 1.00 . A A . 69 MET CG 1 1 6 10410 1 1 69 MET H H 4.073 -0.464 -4.558 1.00 . A A . 69 MET H 1 1 6 10411 1 1 69 MET HA H 1.818 -0.873 -2.748 1.00 . A A . 69 MET HA 1 1 6 10412 1 1 69 MET HB2 H 2.082 1.044 -5.133 1.00 . A A . 69 MET HB2 1 1 6 10413 1 1 69 MET HB3 H 0.652 0.887 -4.131 1.00 . A A . 69 MET HB3 1 1 6 10414 1 1 69 MET HE1 H 3.466 1.367 -0.642 1.00 . A A . 69 MET HE1 1 1 6 10415 1 1 69 MET HE2 H 3.035 3.088 -0.494 1.00 . A A . 69 MET HE2 1 1 6 10416 1 1 69 MET HE3 H 2.264 1.882 0.565 1.00 . A A . 69 MET HE3 1 1 6 10417 1 1 69 MET HG2 H 3.355 1.585 -2.914 1.00 . A A . 69 MET HG2 1 1 6 10418 1 1 69 MET HG3 H 2.318 2.826 -3.588 1.00 . A A . 69 MET HG3 1 1 6 10419 1 1 69 MET N N 3.608 -0.692 -3.702 1.00 . A A . 69 MET N 1 1 6 10420 1 1 69 MET O O 0.374 -1.791 -4.836 1.00 . A A . 69 MET O 1 1 6 10421 1 1 69 MET SD S 1.355 1.844 -1.636 1.00 . A A . 69 MET SD 1 1 6 10422 1 1 70 HIS C C 3.041 -4.344 -6.535 1.00 . A A . 70 HIS C 1 1 6 10423 1 1 70 HIS CA C 2.086 -3.149 -6.554 1.00 . A A . 70 HIS CA 1 1 6 10424 1 1 70 HIS CB C 1.998 -2.483 -7.929 1.00 . A A . 70 HIS CB 1 1 6 10425 1 1 70 HIS CD2 C 0.076 -0.748 -8.288 1.00 . A A . 70 HIS CD2 1 1 6 10426 1 1 70 HIS CE1 C 1.129 1.035 -7.580 1.00 . A A . 70 HIS CE1 1 1 6 10427 1 1 70 HIS CG C 1.331 -1.128 -7.912 1.00 . A A . 70 HIS CG 1 1 6 10428 1 1 70 HIS H H 3.470 -2.024 -5.479 1.00 . A A . 70 HIS H 1 1 6 10429 1 1 70 HIS HA H 1.086 -3.490 -6.285 1.00 . A A . 70 HIS HA 1 1 6 10430 1 1 70 HIS HB2 H 3.003 -2.376 -8.335 1.00 . A A . 70 HIS HB2 1 1 6 10431 1 1 70 HIS HB3 H 1.449 -3.138 -8.604 1.00 . A A . 70 HIS HB3 1 1 6 10432 1 1 70 HIS HD1 H 2.909 0.068 -7.128 1.00 . A A . 70 HIS HD1 1 1 6 10433 1 1 70 HIS HD2 H -0.696 -1.405 -8.687 1.00 . A A . 70 HIS HD2 1 1 6 10434 1 1 70 HIS HE1 H 1.338 2.071 -7.312 1.00 . A A . 70 HIS HE1 1 1 6 10435 1 1 70 HIS N N 2.486 -2.189 -5.540 1.00 . A A . 70 HIS N 1 1 6 10436 1 1 70 HIS ND1 N 1.971 0.017 -7.471 1.00 . A A . 70 HIS ND1 1 1 6 10437 1 1 70 HIS NE2 N -0.045 0.559 -8.086 1.00 . A A . 70 HIS NE2 1 1 6 10438 1 1 70 HIS O O 2.628 -5.469 -6.257 1.00 . A A . 70 HIS O 1 1 6 10439 1 1 71 ASP C C 5.053 -6.088 -5.720 1.00 . A A . 71 ASP C 1 1 6 10440 1 1 71 ASP CA C 5.317 -5.097 -6.855 1.00 . A A . 71 ASP CA 1 1 6 10441 1 1 71 ASP CB C 6.713 -4.504 -6.650 1.00 . A A . 71 ASP CB 1 1 6 10442 1 1 71 ASP CG C 7.823 -5.164 -7.470 1.00 . A A . 71 ASP CG 1 1 6 10443 1 1 71 ASP H H 4.628 -3.142 -7.059 1.00 . A A . 71 ASP H 1 1 6 10444 1 1 71 ASP HA H 5.235 -5.558 -7.839 1.00 . A A . 71 ASP HA 1 1 6 10445 1 1 71 ASP HB2 H 6.680 -3.443 -6.897 1.00 . A A . 71 ASP HB2 1 1 6 10446 1 1 71 ASP HB3 H 6.970 -4.577 -5.593 1.00 . A A . 71 ASP HB3 1 1 6 10447 1 1 71 ASP N N 4.300 -4.059 -6.834 1.00 . A A . 71 ASP N 1 1 6 10448 1 1 71 ASP O O 4.920 -5.691 -4.563 1.00 . A A . 71 ASP O 1 1 6 10449 1 1 71 ASP OD1 O 8.381 -6.163 -6.969 1.00 . A A . 71 ASP OD1 1 1 6 10450 1 1 71 ASP OD2 O 8.088 -4.653 -8.580 1.00 . A A . 71 ASP OD2 1 1 6 10451 1 1 72 LYS C C 6.071 -9.020 -4.684 1.00 . A A . 72 LYS C 1 1 6 10452 1 1 72 LYS CA C 4.737 -8.408 -5.117 1.00 . A A . 72 LYS CA 1 1 6 10453 1 1 72 LYS CB C 3.744 -9.431 -5.673 1.00 . A A . 72 LYS CB 1 1 6 10454 1 1 72 LYS CD C 2.599 -9.025 -7.883 1.00 . A A . 72 LYS CD 1 1 6 10455 1 1 72 LYS CE C 2.316 -10.503 -8.160 1.00 . A A . 72 LYS CE 1 1 6 10456 1 1 72 LYS CG C 2.579 -8.736 -6.381 1.00 . A A . 72 LYS CG 1 1 6 10457 1 1 72 LYS H H 5.094 -7.672 -7.033 1.00 . A A . 72 LYS H 1 1 6 10458 1 1 72 LYS HA H 4.271 -7.946 -4.248 1.00 . A A . 72 LYS HA 1 1 6 10459 1 1 72 LYS HB2 H 4.253 -10.096 -6.371 1.00 . A A . 72 LYS HB2 1 1 6 10460 1 1 72 LYS HB3 H 3.363 -10.052 -4.862 1.00 . A A . 72 LYS HB3 1 1 6 10461 1 1 72 LYS HD2 H 1.854 -8.408 -8.386 1.00 . A A . 72 LYS HD2 1 1 6 10462 1 1 72 LYS HD3 H 3.570 -8.753 -8.297 1.00 . A A . 72 LYS HD3 1 1 6 10463 1 1 72 LYS HE2 H 2.457 -11.083 -7.248 1.00 . A A . 72 LYS HE2 1 1 6 10464 1 1 72 LYS HE3 H 1.277 -10.630 -8.462 1.00 . A A . 72 LYS HE3 1 1 6 10465 1 1 72 LYS HG2 H 1.635 -9.074 -5.954 1.00 . A A . 72 LYS HG2 1 1 6 10466 1 1 72 LYS HG3 H 2.638 -7.660 -6.214 1.00 . A A . 72 LYS HG3 1 1 6 10467 1 1 72 LYS HZ1 H 3.118 -12.014 -9.351 1.00 . A A . 72 LYS HZ1 1 1 6 10468 1 1 72 LYS HZ2 H 3.022 -10.581 -10.119 1.00 . A A . 72 LYS HZ2 1 1 6 10469 1 1 72 LYS N N 4.984 -7.358 -6.090 1.00 . A A . 72 LYS N 1 1 6 10470 1 1 72 LYS NZ N 3.213 -11.012 -9.222 1.00 . A A . 72 LYS NZ 1 1 6 10471 1 1 72 LYS O O 6.201 -9.503 -3.560 1.00 . A A . 72 LYS O 1 1 6 10472 1 1 73 ASN C C 9.119 -8.554 -4.425 1.00 . A A . 73 ASN C 1 1 6 10473 1 1 73 ASN CA C 8.349 -9.523 -5.324 1.00 . A A . 73 ASN CA 1 1 6 10474 1 1 73 ASN CB C 9.147 -9.706 -6.616 1.00 . A A . 73 ASN CB 1 1 6 10475 1 1 73 ASN CG C 8.988 -11.127 -7.163 1.00 . A A . 73 ASN CG 1 1 6 10476 1 1 73 ASN H H 6.916 -8.584 -6.510 1.00 . A A . 73 ASN H 1 1 6 10477 1 1 73 ASN HA H 8.168 -10.484 -4.843 1.00 . A A . 73 ASN HA 1 1 6 10478 1 1 73 ASN HB2 H 8.811 -8.986 -7.362 1.00 . A A . 73 ASN HB2 1 1 6 10479 1 1 73 ASN HB3 H 10.201 -9.501 -6.428 1.00 . A A . 73 ASN HB3 1 1 6 10480 1 1 73 ASN HD21 H 10.511 -10.754 -8.444 1.00 . A A . 73 ASN HD21 1 1 6 10481 1 1 73 ASN HD22 H 9.818 -12.337 -8.557 1.00 . A A . 73 ASN HD22 1 1 6 10482 1 1 73 ASN N N 7.029 -8.979 -5.598 1.00 . A A . 73 ASN N 1 1 6 10483 1 1 73 ASN ND2 N 9.843 -11.431 -8.135 1.00 . A A . 73 ASN ND2 1 1 6 10484 1 1 73 ASN O O 10.120 -7.975 -4.845 1.00 . A A . 73 ASN O 1 1 6 10485 1 1 73 ASN OD1 O 8.145 -11.895 -6.730 1.00 . A A . 73 ASN OD1 1 1 6 10486 1 1 74 THR C C 9.516 -8.254 -0.929 1.00 . A A . 74 THR C 1 1 6 10487 1 1 74 THR CA C 9.252 -7.518 -2.244 1.00 . A A . 74 THR CA 1 1 6 10488 1 1 74 THR CB C 8.357 -6.287 -2.082 1.00 . A A . 74 THR CB 1 1 6 10489 1 1 74 THR CG2 C 8.122 -5.556 -3.406 1.00 . A A . 74 THR CG2 1 1 6 10490 1 1 74 THR H H 7.809 -8.882 -2.872 1.00 . A A . 74 THR H 1 1 6 10491 1 1 74 THR HA H 10.221 -7.214 -2.640 1.00 . A A . 74 THR HA 1 1 6 10492 1 1 74 THR HB H 8.759 -5.610 -1.329 1.00 . A A . 74 THR HB 1 1 6 10493 1 1 74 THR HG1 H 7.081 -7.155 -0.808 1.00 . A A . 74 THR HG1 1 1 6 10494 1 1 74 THR HG21 H 8.609 -6.102 -4.214 1.00 . A A . 74 THR HG21 1 1 6 10495 1 1 74 THR HG22 H 7.051 -5.495 -3.602 1.00 . A A . 74 THR HG22 1 1 6 10496 1 1 74 THR HG23 H 8.538 -4.551 -3.344 1.00 . A A . 74 THR HG23 1 1 6 10497 1 1 74 THR N N 8.623 -8.407 -3.206 1.00 . A A . 74 THR N 1 1 6 10498 1 1 74 THR O O 8.875 -9.264 -0.640 1.00 . A A . 74 THR O 1 1 6 10499 1 1 74 THR OG1 O 7.080 -6.827 -1.752 1.00 . A A . 74 THR OG1 1 1 6 10500 1 1 75 LYS C C 9.621 -8.225 2.060 1.00 . A A . 75 LYS C 1 1 6 10501 1 1 75 LYS CA C 10.816 -8.315 1.109 1.00 . A A . 75 LYS CA 1 1 6 10502 1 1 75 LYS CB C 12.091 -7.674 1.661 1.00 . A A . 75 LYS CB 1 1 6 10503 1 1 75 LYS CD C 13.914 -8.168 3.331 1.00 . A A . 75 LYS CD 1 1 6 10504 1 1 75 LYS CE C 14.295 -6.937 4.156 1.00 . A A . 75 LYS CE 1 1 6 10505 1 1 75 LYS CG C 12.409 -8.203 3.061 1.00 . A A . 75 LYS CG 1 1 6 10506 1 1 75 LYS H H 10.976 -6.899 -0.411 1.00 . A A . 75 LYS H 1 1 6 10507 1 1 75 LYS HA H 11.037 -9.367 0.929 1.00 . A A . 75 LYS HA 1 1 6 10508 1 1 75 LYS HB2 H 12.926 -7.880 0.992 1.00 . A A . 75 LYS HB2 1 1 6 10509 1 1 75 LYS HB3 H 11.971 -6.591 1.697 1.00 . A A . 75 LYS HB3 1 1 6 10510 1 1 75 LYS HD2 H 14.213 -9.072 3.862 1.00 . A A . 75 LYS HD2 1 1 6 10511 1 1 75 LYS HD3 H 14.457 -8.160 2.386 1.00 . A A . 75 LYS HD3 1 1 6 10512 1 1 75 LYS HE2 H 14.618 -6.134 3.493 1.00 . A A . 75 LYS HE2 1 1 6 10513 1 1 75 LYS HE3 H 13.423 -6.571 4.698 1.00 . A A . 75 LYS HE3 1 1 6 10514 1 1 75 LYS HG2 H 11.888 -7.604 3.808 1.00 . A A . 75 LYS HG2 1 1 6 10515 1 1 75 LYS HG3 H 12.042 -9.225 3.159 1.00 . A A . 75 LYS HG3 1 1 6 10516 1 1 75 LYS HZ1 H 15.074 -7.930 5.813 1.00 . A A . 75 LYS HZ1 1 1 6 10517 1 1 75 LYS HZ2 H 16.181 -7.675 4.646 1.00 . A A . 75 LYS HZ2 1 1 6 10518 1 1 75 LYS N N 10.460 -7.721 -0.168 1.00 . A A . 75 LYS N 1 1 6 10519 1 1 75 LYS NZ N 15.377 -7.266 5.110 1.00 . A A . 75 LYS NZ 1 1 6 10520 1 1 75 LYS O O 9.503 -9.020 2.992 1.00 . A A . 75 LYS O 1 1 6 10521 1 1 76 PHE C C 6.307 -7.155 1.773 1.00 . A A . 76 PHE C 1 1 6 10522 1 1 76 PHE CA C 7.582 -7.047 2.612 1.00 . A A . 76 PHE CA 1 1 6 10523 1 1 76 PHE CB C 7.694 -5.626 3.167 1.00 . A A . 76 PHE CB 1 1 6 10524 1 1 76 PHE CD1 C 8.947 -6.048 5.314 1.00 . A A . 76 PHE CD1 1 1 6 10525 1 1 76 PHE CD2 C 9.927 -4.583 3.699 1.00 . A A . 76 PHE CD2 1 1 6 10526 1 1 76 PHE CE1 C 10.078 -5.846 6.183 1.00 . A A . 76 PHE CE1 1 1 6 10527 1 1 76 PHE CE2 C 11.058 -4.381 4.568 1.00 . A A . 76 PHE CE2 1 1 6 10528 1 1 76 PHE CG C 8.895 -5.412 4.090 1.00 . A A . 76 PHE CG 1 1 6 10529 1 1 76 PHE CZ C 11.077 -5.023 5.767 1.00 . A A . 76 PHE CZ 1 1 6 10530 1 1 76 PHE H H 8.866 -6.610 1.031 1.00 . A A . 76 PHE H 1 1 6 10531 1 1 76 PHE HA H 7.569 -7.820 3.381 1.00 . A A . 76 PHE HA 1 1 6 10532 1 1 76 PHE HB2 H 7.759 -4.926 2.335 1.00 . A A . 76 PHE HB2 1 1 6 10533 1 1 76 PHE HB3 H 6.782 -5.387 3.714 1.00 . A A . 76 PHE HB3 1 1 6 10534 1 1 76 PHE HD1 H 8.132 -6.702 5.623 1.00 . A A . 76 PHE HD1 1 1 6 10535 1 1 76 PHE HD2 H 9.886 -4.081 2.732 1.00 . A A . 76 PHE HD2 1 1 6 10536 1 1 76 PHE HE1 H 10.131 -6.342 7.152 1.00 . A A . 76 PHE HE1 1 1 6 10537 1 1 76 PHE HE2 H 11.879 -3.729 4.271 1.00 . A A . 76 PHE HE2 1 1 6 10538 1 1 76 PHE HZ H 11.919 -4.948 6.501 1.00 . A A . 76 PHE HZ 1 1 6 10539 1 1 76 PHE N N 8.764 -7.251 1.791 1.00 . A A . 76 PHE N 1 1 6 10540 1 1 76 PHE O O 6.333 -6.923 0.565 1.00 . A A . 76 PHE O 1 1 6 10541 1 1 77 LYS C C 3.523 -6.299 1.191 1.00 . A A . 77 LYS C 1 1 6 10542 1 1 77 LYS CA C 3.939 -7.649 1.778 1.00 . A A . 77 LYS CA 1 1 6 10543 1 1 77 LYS CB C 2.903 -8.251 2.729 1.00 . A A . 77 LYS CB 1 1 6 10544 1 1 77 LYS CD C 1.849 -10.382 3.572 1.00 . A A . 77 LYS CD 1 1 6 10545 1 1 77 LYS CE C 2.523 -11.468 4.412 1.00 . A A . 77 LYS CE 1 1 6 10546 1 1 77 LYS CG C 2.835 -9.772 2.573 1.00 . A A . 77 LYS CG 1 1 6 10547 1 1 77 LYS H H 5.209 -7.694 3.429 1.00 . A A . 77 LYS H 1 1 6 10548 1 1 77 LYS HA H 4.074 -8.355 0.959 1.00 . A A . 77 LYS HA 1 1 6 10549 1 1 77 LYS HB2 H 3.158 -7.999 3.758 1.00 . A A . 77 LYS HB2 1 1 6 10550 1 1 77 LYS HB3 H 1.924 -7.817 2.528 1.00 . A A . 77 LYS HB3 1 1 6 10551 1 1 77 LYS HD2 H 1.458 -9.602 4.225 1.00 . A A . 77 LYS HD2 1 1 6 10552 1 1 77 LYS HD3 H 0.999 -10.806 3.037 1.00 . A A . 77 LYS HD3 1 1 6 10553 1 1 77 LYS HE2 H 2.946 -12.232 3.760 1.00 . A A . 77 LYS HE2 1 1 6 10554 1 1 77 LYS HE3 H 3.349 -11.039 4.978 1.00 . A A . 77 LYS HE3 1 1 6 10555 1 1 77 LYS HG2 H 2.531 -10.024 1.557 1.00 . A A . 77 LYS HG2 1 1 6 10556 1 1 77 LYS HG3 H 3.825 -10.202 2.725 1.00 . A A . 77 LYS HG3 1 1 6 10557 1 1 77 LYS HZ1 H 0.798 -11.448 5.582 1.00 . A A . 77 LYS HZ1 1 1 6 10558 1 1 77 LYS HZ2 H 1.114 -12.910 4.940 1.00 . A A . 77 LYS HZ2 1 1 6 10559 1 1 77 LYS N N 5.221 -7.507 2.447 1.00 . A A . 77 LYS N 1 1 6 10560 1 1 77 LYS NZ N 1.548 -12.085 5.339 1.00 . A A . 77 LYS NZ 1 1 6 10561 1 1 77 LYS O O 3.478 -5.296 1.902 1.00 . A A . 77 LYS O 1 1 6 10562 1 1 78 SER C C 1.293 -5.047 -0.883 1.00 . A A . 78 SER C 1 1 6 10563 1 1 78 SER CA C 2.819 -5.106 -0.792 1.00 . A A . 78 SER CA 1 1 6 10564 1 1 78 SER CB C 3.437 -5.032 -2.189 1.00 . A A . 78 SER CB 1 1 6 10565 1 1 78 SER H H 3.268 -7.136 -0.672 1.00 . A A . 78 SER H 1 1 6 10566 1 1 78 SER HA H 3.197 -4.284 -0.184 1.00 . A A . 78 SER HA 1 1 6 10567 1 1 78 SER HB2 H 3.887 -4.050 -2.335 1.00 . A A . 78 SER HB2 1 1 6 10568 1 1 78 SER HB3 H 4.240 -5.765 -2.269 1.00 . A A . 78 SER HB3 1 1 6 10569 1 1 78 SER HG H 2.936 -5.488 -4.072 1.00 . A A . 78 SER HG 1 1 6 10570 1 1 78 SER N N 3.229 -6.316 -0.101 1.00 . A A . 78 SER N 1 1 6 10571 1 1 78 SER O O 0.619 -6.065 -0.730 1.00 . A A . 78 SER O 1 1 6 10572 1 1 78 SER OG O 2.474 -5.270 -3.212 1.00 . A A . 78 SER OG 1 1 6 10573 1 1 79 CYS C C -1.219 -4.757 -2.119 1.00 . A A . 79 CYS C 1 1 6 10574 1 1 79 CYS CA C -0.642 -3.641 -1.245 1.00 . A A . 79 CYS CA 1 1 6 10575 1 1 79 CYS CB C -0.974 -2.254 -1.797 1.00 . A A . 79 CYS CB 1 1 6 10576 1 1 79 CYS H H 1.347 -3.023 -1.255 1.00 . A A . 79 CYS H 1 1 6 10577 1 1 79 CYS HA H -1.046 -3.694 -0.234 1.00 . A A . 79 CYS HA 1 1 6 10578 1 1 79 CYS HB2 H -0.627 -2.197 -2.829 1.00 . A A . 79 CYS HB2 1 1 6 10579 1 1 79 CYS HB3 H -2.057 -2.136 -1.818 1.00 . A A . 79 CYS HB3 1 1 6 10580 1 1 79 CYS N N 0.792 -3.846 -1.132 1.00 . A A . 79 CYS N 1 1 6 10581 1 1 79 CYS O O -2.001 -5.579 -1.646 1.00 . A A . 79 CYS O 1 1 6 10582 1 1 79 CYS SG S -0.250 -0.860 -0.858 1.00 . A A . 79 CYS SG 1 1 6 10583 1 1 80 VAL C C -0.802 -7.131 -3.873 1.00 . A A . 80 VAL C 1 1 6 10584 1 1 80 VAL CA C -1.276 -5.748 -4.325 1.00 . A A . 80 VAL CA 1 1 6 10585 1 1 80 VAL CB C -0.813 -5.390 -5.738 1.00 . A A . 80 VAL CB 1 1 6 10586 1 1 80 VAL CG1 C -1.134 -6.516 -6.723 1.00 . A A . 80 VAL CG1 1 1 6 10587 1 1 80 VAL CG2 C -1.430 -4.067 -6.198 1.00 . A A . 80 VAL CG2 1 1 6 10588 1 1 80 VAL H H -0.173 -4.076 -3.756 1.00 . A A . 80 VAL H 1 1 6 10589 1 1 80 VAL HA H -2.366 -5.730 -4.312 1.00 . A A . 80 VAL HA 1 1 6 10590 1 1 80 VAL HB H 0.269 -5.264 -5.714 1.00 . A A . 80 VAL HB 1 1 6 10591 1 1 80 VAL HG11 H -2.046 -7.024 -6.409 1.00 . A A . 80 VAL HG11 1 1 6 10592 1 1 80 VAL HG12 H -1.275 -6.098 -7.719 1.00 . A A . 80 VAL HG12 1 1 6 10593 1 1 80 VAL HG13 H -0.309 -7.229 -6.740 1.00 . A A . 80 VAL HG13 1 1 6 10594 1 1 80 VAL HG21 H -1.519 -3.392 -5.346 1.00 . A A . 80 VAL HG21 1 1 6 10595 1 1 80 VAL HG22 H -0.792 -3.613 -6.956 1.00 . A A . 80 VAL HG22 1 1 6 10596 1 1 80 VAL HG23 H -2.418 -4.254 -6.619 1.00 . A A . 80 VAL HG23 1 1 6 10597 1 1 80 VAL N N -0.810 -4.748 -3.380 1.00 . A A . 80 VAL N 1 1 6 10598 1 1 80 VAL O O -1.592 -8.071 -3.807 1.00 . A A . 80 VAL O 1 1 6 10599 1 1 81 GLY C C 0.132 -9.208 -2.184 1.00 . A A . 81 GLY C 1 1 6 10600 1 1 81 GLY CA C 1.076 -8.463 -3.131 1.00 . A A . 81 GLY CA 1 1 6 10601 1 1 81 GLY H H 1.122 -6.441 -3.630 1.00 . A A . 81 GLY H 1 1 6 10602 1 1 81 GLY HA2 H 1.299 -9.089 -3.994 1.00 . A A . 81 GLY HA2 1 1 6 10603 1 1 81 GLY HA3 H 2.021 -8.266 -2.626 1.00 . A A . 81 GLY HA3 1 1 6 10604 1 1 81 GLY N N 0.486 -7.211 -3.574 1.00 . A A . 81 GLY N 1 1 6 10605 1 1 81 GLY O O -0.249 -10.347 -2.451 1.00 . A A . 81 GLY O 1 1 6 10606 1 1 82 CYS C C -2.463 -9.372 -0.775 1.00 . A A . 82 CYS C 1 1 6 10607 1 1 82 CYS CA C -1.108 -9.120 -0.110 1.00 . A A . 82 CYS CA 1 1 6 10608 1 1 82 CYS CB C -1.237 -8.233 1.130 1.00 . A A . 82 CYS CB 1 1 6 10609 1 1 82 CYS H H 0.097 -7.610 -0.888 1.00 . A A . 82 CYS H 1 1 6 10610 1 1 82 CYS HA H -0.652 -10.058 0.207 1.00 . A A . 82 CYS HA 1 1 6 10611 1 1 82 CYS HB2 H -0.248 -7.967 1.502 1.00 . A A . 82 CYS HB2 1 1 6 10612 1 1 82 CYS HB3 H -1.742 -7.302 0.871 1.00 . A A . 82 CYS HB3 1 1 6 10613 1 1 82 CYS N N -0.217 -8.535 -1.098 1.00 . A A . 82 CYS N 1 1 6 10614 1 1 82 CYS O O -3.030 -10.456 -0.645 1.00 . A A . 82 CYS O 1 1 6 10615 1 1 82 CYS SG S -2.177 -9.111 2.432 1.00 . A A . 82 CYS SG 1 1 6 10616 1 1 83 HIS C C -4.241 -9.708 -3.029 1.00 . A A . 83 HIS C 1 1 6 10617 1 1 83 HIS CA C -4.220 -8.451 -2.157 1.00 . A A . 83 HIS CA 1 1 6 10618 1 1 83 HIS CB C -4.510 -7.175 -2.950 1.00 . A A . 83 HIS CB 1 1 6 10619 1 1 83 HIS CD2 C -4.857 -5.761 -0.779 1.00 . A A . 83 HIS CD2 1 1 6 10620 1 1 83 HIS CE1 C -6.071 -4.158 -1.640 1.00 . A A . 83 HIS CE1 1 1 6 10621 1 1 83 HIS CG C -5.017 -6.029 -2.106 1.00 . A A . 83 HIS CG 1 1 6 10622 1 1 83 HIS H H -2.475 -7.475 -1.573 1.00 . A A . 83 HIS H 1 1 6 10623 1 1 83 HIS HA H -4.983 -8.542 -1.384 1.00 . A A . 83 HIS HA 1 1 6 10624 1 1 83 HIS HB2 H -3.600 -6.861 -3.461 1.00 . A A . 83 HIS HB2 1 1 6 10625 1 1 83 HIS HB3 H -5.248 -7.398 -3.721 1.00 . A A . 83 HIS HB3 1 1 6 10626 1 1 83 HIS HD1 H -6.080 -4.911 -3.574 1.00 . A A . 83 HIS HD1 1 1 6 10627 1 1 83 HIS HD2 H -4.300 -6.372 -0.068 1.00 . A A . 83 HIS HD2 1 1 6 10628 1 1 83 HIS HE1 H -6.662 -3.247 -1.729 1.00 . A A . 83 HIS HE1 1 1 6 10629 1 1 83 HIS N N -2.943 -8.353 -1.472 1.00 . A A . 83 HIS N 1 1 6 10630 1 1 83 HIS ND1 N -5.787 -5.001 -2.622 1.00 . A A . 83 HIS ND1 1 1 6 10631 1 1 83 HIS NE2 N -5.493 -4.630 -0.499 1.00 . A A . 83 HIS NE2 1 1 6 10632 1 1 83 HIS O O -5.229 -10.439 -3.047 1.00 . A A . 83 HIS O 1 1 6 10633 1 1 84 VAL C C -3.279 -12.348 -3.796 1.00 . A A . 84 VAL C 1 1 6 10634 1 1 84 VAL CA C -3.016 -11.076 -4.603 1.00 . A A . 84 VAL CA 1 1 6 10635 1 1 84 VAL CB C -1.648 -11.073 -5.288 1.00 . A A . 84 VAL CB 1 1 6 10636 1 1 84 VAL CG1 C -1.392 -12.399 -6.007 1.00 . A A . 84 VAL CG1 1 1 6 10637 1 1 84 VAL CG2 C -1.519 -9.893 -6.253 1.00 . A A . 84 VAL CG2 1 1 6 10638 1 1 84 VAL H H -2.338 -9.320 -3.711 1.00 . A A . 84 VAL H 1 1 6 10639 1 1 84 VAL HA H -3.780 -10.986 -5.376 1.00 . A A . 84 VAL HA 1 1 6 10640 1 1 84 VAL HB H -0.887 -10.959 -4.516 1.00 . A A . 84 VAL HB 1 1 6 10641 1 1 84 VAL HG11 H -2.251 -13.057 -5.873 1.00 . A A . 84 VAL HG11 1 1 6 10642 1 1 84 VAL HG12 H -1.241 -12.213 -7.070 1.00 . A A . 84 VAL HG12 1 1 6 10643 1 1 84 VAL HG13 H -0.503 -12.873 -5.591 1.00 . A A . 84 VAL HG13 1 1 6 10644 1 1 84 VAL HG21 H -1.895 -8.989 -5.773 1.00 . A A . 84 VAL HG21 1 1 6 10645 1 1 84 VAL HG22 H -0.471 -9.754 -6.519 1.00 . A A . 84 VAL HG22 1 1 6 10646 1 1 84 VAL HG23 H -2.099 -10.094 -7.153 1.00 . A A . 84 VAL HG23 1 1 6 10647 1 1 84 VAL N N -3.137 -9.920 -3.731 1.00 . A A . 84 VAL N 1 1 6 10648 1 1 84 VAL O O -3.919 -13.278 -4.286 1.00 . A A . 84 VAL O 1 1 6 10649 1 1 85 GLU C C -4.370 -13.534 -1.146 1.00 . A A . 85 GLU C 1 1 6 10650 1 1 85 GLU CA C -2.941 -13.493 -1.692 1.00 . A A . 85 GLU CA 1 1 6 10651 1 1 85 GLU CB C -1.919 -13.467 -0.554 1.00 . A A . 85 GLU CB 1 1 6 10652 1 1 85 GLU CD C -0.630 -15.500 0.197 1.00 . A A . 85 GLU CD 1 1 6 10653 1 1 85 GLU CG C -0.740 -14.394 -0.854 1.00 . A A . 85 GLU CG 1 1 6 10654 1 1 85 GLU H H -2.251 -11.590 -2.182 1.00 . A A . 85 GLU H 1 1 6 10655 1 1 85 GLU HA H -2.759 -14.369 -2.316 1.00 . A A . 85 GLU HA 1 1 6 10656 1 1 85 GLU HB2 H -1.559 -12.449 -0.408 1.00 . A A . 85 GLU HB2 1 1 6 10657 1 1 85 GLU HB3 H -2.398 -13.772 0.377 1.00 . A A . 85 GLU HB3 1 1 6 10658 1 1 85 GLU HG2 H -0.863 -14.837 -1.842 1.00 . A A . 85 GLU HG2 1 1 6 10659 1 1 85 GLU HG3 H 0.184 -13.816 -0.877 1.00 . A A . 85 GLU HG3 1 1 6 10660 1 1 85 GLU N N -2.770 -12.350 -2.572 1.00 . A A . 85 GLU N 1 1 6 10661 1 1 85 GLU O O -4.929 -14.610 -0.939 1.00 . A A . 85 GLU O 1 1 6 10662 1 1 85 GLU OE1 O -0.741 -15.159 1.394 1.00 . A A . 85 GLU OE1 1 1 6 10663 1 1 85 GLU OE2 O -0.439 -16.663 -0.221 1.00 . A A . 85 GLU OE2 1 1 6 10664 1 1 86 VAL C C -7.268 -12.628 -1.502 1.00 . A A . 86 VAL C 1 1 6 10665 1 1 86 VAL CA C -6.272 -12.235 -0.409 1.00 . A A . 86 VAL CA 1 1 6 10666 1 1 86 VAL CB C -6.507 -10.823 0.134 1.00 . A A . 86 VAL CB 1 1 6 10667 1 1 86 VAL CG1 C -7.952 -10.653 0.609 1.00 . A A . 86 VAL CG1 1 1 6 10668 1 1 86 VAL CG2 C -5.519 -10.495 1.255 1.00 . A A . 86 VAL CG2 1 1 6 10669 1 1 86 VAL H H -4.458 -11.478 -1.099 1.00 . A A . 86 VAL H 1 1 6 10670 1 1 86 VAL HA H -6.366 -12.935 0.421 1.00 . A A . 86 VAL HA 1 1 6 10671 1 1 86 VAL HB H -6.337 -10.119 -0.680 1.00 . A A . 86 VAL HB 1 1 6 10672 1 1 86 VAL HG11 H -8.631 -11.066 -0.137 1.00 . A A . 86 VAL HG11 1 1 6 10673 1 1 86 VAL HG12 H -8.088 -11.178 1.555 1.00 . A A . 86 VAL HG12 1 1 6 10674 1 1 86 VAL HG13 H -8.165 -9.593 0.748 1.00 . A A . 86 VAL HG13 1 1 6 10675 1 1 86 VAL HG21 H -4.629 -11.116 1.147 1.00 . A A . 86 VAL HG21 1 1 6 10676 1 1 86 VAL HG22 H -5.238 -9.444 1.196 1.00 . A A . 86 VAL HG22 1 1 6 10677 1 1 86 VAL HG23 H -5.985 -10.693 2.220 1.00 . A A . 86 VAL HG23 1 1 6 10678 1 1 86 VAL N N -4.919 -12.348 -0.928 1.00 . A A . 86 VAL N 1 1 6 10679 1 1 86 VAL O O -8.140 -13.466 -1.279 1.00 . A A . 86 VAL O 1 1 6 10680 1 1 87 ALA C C -7.787 -13.731 -4.233 1.00 . A A . 87 ALA C 1 1 6 10681 1 1 87 ALA CA C -7.977 -12.280 -3.788 1.00 . A A . 87 ALA CA 1 1 6 10682 1 1 87 ALA CB C -7.689 -11.282 -4.911 1.00 . A A . 87 ALA CB 1 1 6 10683 1 1 87 ALA H H -6.391 -11.325 -2.833 1.00 . A A . 87 ALA H 1 1 6 10684 1 1 87 ALA HA H -9.005 -12.143 -3.452 1.00 . A A . 87 ALA HA 1 1 6 10685 1 1 87 ALA HB1 H -6.776 -10.732 -4.683 1.00 . A A . 87 ALA HB1 1 1 6 10686 1 1 87 ALA HB2 H -7.564 -11.820 -5.851 1.00 . A A . 87 ALA HB2 1 1 6 10687 1 1 87 ALA HB3 H -8.522 -10.585 -5.000 1.00 . A A . 87 ALA HB3 1 1 6 10688 1 1 87 ALA N N -7.103 -12.005 -2.660 1.00 . A A . 87 ALA N 1 1 6 10689 1 1 87 ALA O O -8.695 -14.333 -4.804 1.00 . A A . 87 ALA O 1 1 6 10690 1 1 88 GLY C C -6.897 -15.986 -5.672 1.00 . A A . 88 GLY C 1 1 6 10691 1 1 88 GLY CA C -6.280 -15.620 -4.320 1.00 . A A . 88 GLY CA 1 1 6 10692 1 1 88 GLY H H -5.868 -13.755 -3.490 1.00 . A A . 88 GLY H 1 1 6 10693 1 1 88 GLY HA2 H -5.198 -15.744 -4.365 1.00 . A A . 88 GLY HA2 1 1 6 10694 1 1 88 GLY HA3 H -6.647 -16.301 -3.552 1.00 . A A . 88 GLY HA3 1 1 6 10695 1 1 88 GLY N N -6.601 -14.251 -3.955 1.00 . A A . 88 GLY N 1 1 6 10696 1 1 88 GLY O O -6.609 -15.348 -6.683 1.00 . A A . 88 GLY O 1 1 6 10697 1 1 89 ALA C C -9.774 -16.816 -6.958 1.00 . A A . 89 ALA C 1 1 6 10698 1 1 89 ALA CA C -8.395 -17.472 -6.855 1.00 . A A . 89 ALA CA 1 1 6 10699 1 1 89 ALA CB C -8.476 -19.000 -6.845 1.00 . A A . 89 ALA CB 1 1 6 10700 1 1 89 ALA H H -7.964 -17.526 -4.818 1.00 . A A . 89 ALA H 1 1 6 10701 1 1 89 ALA HA H -7.788 -17.158 -7.704 1.00 . A A . 89 ALA HA 1 1 6 10702 1 1 89 ALA HB1 H -8.448 -19.358 -5.816 1.00 . A A . 89 ALA HB1 1 1 6 10703 1 1 89 ALA HB2 H -9.406 -19.318 -7.316 1.00 . A A . 89 ALA HB2 1 1 6 10704 1 1 89 ALA HB3 H -7.630 -19.412 -7.395 1.00 . A A . 89 ALA HB3 1 1 6 10705 1 1 89 ALA N N -7.735 -17.013 -5.645 1.00 . A A . 89 ALA N 1 1 6 10706 1 1 89 ALA O O -10.795 -17.485 -6.812 1.00 . A A . 89 ALA O 1 1 6 10707 1 1 90 ASP C C -10.761 -13.556 -8.248 1.00 . A A . 90 ASP C 1 1 6 10708 1 1 90 ASP CA C -10.993 -14.762 -7.334 1.00 . A A . 90 ASP CA 1 1 6 10709 1 1 90 ASP CB C -11.460 -14.241 -5.974 1.00 . A A . 90 ASP CB 1 1 6 10710 1 1 90 ASP CG C -12.897 -13.717 -5.940 1.00 . A A . 90 ASP CG 1 1 6 10711 1 1 90 ASP H H -8.921 -14.979 -7.327 1.00 . A A . 90 ASP H 1 1 6 10712 1 1 90 ASP HA H -11.717 -15.464 -7.747 1.00 . A A . 90 ASP HA 1 1 6 10713 1 1 90 ASP HB2 H -11.365 -15.043 -5.242 1.00 . A A . 90 ASP HB2 1 1 6 10714 1 1 90 ASP HB3 H -10.790 -13.441 -5.658 1.00 . A A . 90 ASP HB3 1 1 6 10715 1 1 90 ASP N N -9.757 -15.515 -7.210 1.00 . A A . 90 ASP N 1 1 6 10716 1 1 90 ASP O O -10.290 -12.513 -7.797 1.00 . A A . 90 ASP O 1 1 6 10717 1 1 90 ASP OD1 O -13.113 -12.615 -6.489 1.00 . A A . 90 ASP OD1 1 1 6 10718 1 1 90 ASP OD2 O -13.748 -14.431 -5.366 1.00 . A A . 90 ASP OD2 1 1 6 10719 1 1 91 ALA C C -11.561 -11.392 -9.958 1.00 . A A . 91 ALA C 1 1 6 10720 1 1 91 ALA CA C -10.935 -12.680 -10.495 1.00 . A A . 91 ALA CA 1 1 6 10721 1 1 91 ALA CB C -11.550 -13.116 -11.827 1.00 . A A . 91 ALA CB 1 1 6 10722 1 1 91 ALA H H -11.484 -14.591 -9.873 1.00 . A A . 91 ALA H 1 1 6 10723 1 1 91 ALA HA H -9.866 -12.524 -10.637 1.00 . A A . 91 ALA HA 1 1 6 10724 1 1 91 ALA HB1 H -12.122 -14.032 -11.680 1.00 . A A . 91 ALA HB1 1 1 6 10725 1 1 91 ALA HB2 H -12.209 -12.331 -12.197 1.00 . A A . 91 ALA HB2 1 1 6 10726 1 1 91 ALA HB3 H -10.756 -13.296 -12.552 1.00 . A A . 91 ALA HB3 1 1 6 10727 1 1 91 ALA N N -11.101 -13.740 -9.515 1.00 . A A . 91 ALA N 1 1 6 10728 1 1 91 ALA O O -10.892 -10.363 -9.868 1.00 . A A . 91 ALA O 1 1 6 10729 1 1 92 ALA C C -12.645 -9.554 -8.153 1.00 . A A . 92 ALA C 1 1 6 10730 1 1 92 ALA CA C -13.560 -10.343 -9.091 1.00 . A A . 92 ALA CA 1 1 6 10731 1 1 92 ALA CB C -14.837 -10.821 -8.395 1.00 . A A . 92 ALA CB 1 1 6 10732 1 1 92 ALA H H -13.374 -12.329 -9.692 1.00 . A A . 92 ALA H 1 1 6 10733 1 1 92 ALA HA H -13.836 -9.710 -9.934 1.00 . A A . 92 ALA HA 1 1 6 10734 1 1 92 ALA HB1 H -14.740 -11.877 -8.143 1.00 . A A . 92 ALA HB1 1 1 6 10735 1 1 92 ALA HB2 H -14.992 -10.243 -7.484 1.00 . A A . 92 ALA HB2 1 1 6 10736 1 1 92 ALA HB3 H -15.688 -10.683 -9.062 1.00 . A A . 92 ALA HB3 1 1 6 10737 1 1 92 ALA N N -12.837 -11.489 -9.616 1.00 . A A . 92 ALA N 1 1 6 10738 1 1 92 ALA O O -12.355 -8.385 -8.401 1.00 . A A . 92 ALA O 1 1 6 10739 1 1 93 LYS C C -10.004 -9.258 -6.781 1.00 . A A . 93 LYS C 1 1 6 10740 1 1 93 LYS CA C -11.340 -9.601 -6.117 1.00 . A A . 93 LYS CA 1 1 6 10741 1 1 93 LYS CB C -11.200 -10.488 -4.878 1.00 . A A . 93 LYS CB 1 1 6 10742 1 1 93 LYS CD C -12.365 -11.406 -2.838 1.00 . A A . 93 LYS CD 1 1 6 10743 1 1 93 LYS CE C -12.896 -12.807 -3.147 1.00 . A A . 93 LYS CE 1 1 6 10744 1 1 93 LYS CG C -12.492 -10.491 -4.058 1.00 . A A . 93 LYS CG 1 1 6 10745 1 1 93 LYS H H -12.456 -11.176 -6.899 1.00 . A A . 93 LYS H 1 1 6 10746 1 1 93 LYS HA H -11.815 -8.673 -5.798 1.00 . A A . 93 LYS HA 1 1 6 10747 1 1 93 LYS HB2 H -10.955 -11.506 -5.180 1.00 . A A . 93 LYS HB2 1 1 6 10748 1 1 93 LYS HB3 H -10.375 -10.131 -4.262 1.00 . A A . 93 LYS HB3 1 1 6 10749 1 1 93 LYS HD2 H -11.320 -11.468 -2.533 1.00 . A A . 93 LYS HD2 1 1 6 10750 1 1 93 LYS HD3 H -12.917 -10.981 -2.001 1.00 . A A . 93 LYS HD3 1 1 6 10751 1 1 93 LYS HE2 H -13.710 -12.743 -3.869 1.00 . A A . 93 LYS HE2 1 1 6 10752 1 1 93 LYS HE3 H -12.110 -13.407 -3.606 1.00 . A A . 93 LYS HE3 1 1 6 10753 1 1 93 LYS HG2 H -12.723 -9.476 -3.733 1.00 . A A . 93 LYS HG2 1 1 6 10754 1 1 93 LYS HG3 H -13.322 -10.822 -4.681 1.00 . A A . 93 LYS HG3 1 1 6 10755 1 1 93 LYS HZ1 H -14.252 -13.078 -1.588 1.00 . A A . 93 LYS HZ1 1 1 6 10756 1 1 93 LYS HZ2 H -13.520 -14.460 -2.042 1.00 . A A . 93 LYS HZ2 1 1 6 10757 1 1 93 LYS N N -12.216 -10.225 -7.094 1.00 . A A . 93 LYS N 1 1 6 10758 1 1 93 LYS NZ N -13.372 -13.465 -1.910 1.00 . A A . 93 LYS NZ 1 1 6 10759 1 1 93 LYS O O -9.406 -8.225 -6.484 1.00 . A A . 93 LYS O 1 1 6 10760 1 1 94 LYS C C -8.432 -8.707 -9.263 1.00 . A A . 94 LYS C 1 1 6 10761 1 1 94 LYS CA C -8.323 -9.949 -8.377 1.00 . A A . 94 LYS CA 1 1 6 10762 1 1 94 LYS CB C -7.936 -11.217 -9.140 1.00 . A A . 94 LYS CB 1 1 6 10763 1 1 94 LYS CD C -5.794 -12.313 -8.385 1.00 . A A . 94 LYS CD 1 1 6 10764 1 1 94 LYS CE C -5.199 -13.494 -9.156 1.00 . A A . 94 LYS CE 1 1 6 10765 1 1 94 LYS CG C -6.421 -11.295 -9.340 1.00 . A A . 94 LYS CG 1 1 6 10766 1 1 94 LYS H H -10.070 -10.982 -7.905 1.00 . A A . 94 LYS H 1 1 6 10767 1 1 94 LYS HA H -7.549 -9.773 -7.629 1.00 . A A . 94 LYS HA 1 1 6 10768 1 1 94 LYS HB2 H -8.280 -12.095 -8.593 1.00 . A A . 94 LYS HB2 1 1 6 10769 1 1 94 LYS HB3 H -8.435 -11.230 -10.109 1.00 . A A . 94 LYS HB3 1 1 6 10770 1 1 94 LYS HD2 H -5.015 -11.831 -7.794 1.00 . A A . 94 LYS HD2 1 1 6 10771 1 1 94 LYS HD3 H -6.548 -12.674 -7.686 1.00 . A A . 94 LYS HD3 1 1 6 10772 1 1 94 LYS HE2 H -4.640 -13.129 -10.017 1.00 . A A . 94 LYS HE2 1 1 6 10773 1 1 94 LYS HE3 H -4.494 -14.031 -8.522 1.00 . A A . 94 LYS HE3 1 1 6 10774 1 1 94 LYS HG2 H -6.200 -11.574 -10.370 1.00 . A A . 94 LYS HG2 1 1 6 10775 1 1 94 LYS HG3 H -5.977 -10.314 -9.173 1.00 . A A . 94 LYS HG3 1 1 6 10776 1 1 94 LYS HZ1 H -5.906 -15.323 -9.860 1.00 . A A . 94 LYS HZ1 1 1 6 10777 1 1 94 LYS HZ2 H -6.966 -14.564 -8.884 1.00 . A A . 94 LYS HZ2 1 1 6 10778 1 1 94 LYS N N -9.577 -10.144 -7.668 1.00 . A A . 94 LYS N 1 1 6 10779 1 1 94 LYS NZ N -6.270 -14.411 -9.605 1.00 . A A . 94 LYS NZ 1 1 6 10780 1 1 94 LYS O O -7.433 -8.240 -9.809 1.00 . A A . 94 LYS O 1 1 6 10781 1 1 95 LYS C C -10.445 -5.907 -9.300 1.00 . A A . 95 LYS C 1 1 6 10782 1 1 95 LYS CA C -9.906 -7.028 -10.191 1.00 . A A . 95 LYS CA 1 1 6 10783 1 1 95 LYS CB C -10.821 -7.373 -11.367 1.00 . A A . 95 LYS CB 1 1 6 10784 1 1 95 LYS CD C -10.818 -7.537 -13.884 1.00 . A A . 95 LYS CD 1 1 6 10785 1 1 95 LYS CE C -9.668 -8.116 -14.710 1.00 . A A . 95 LYS CE 1 1 6 10786 1 1 95 LYS CG C -10.290 -6.771 -12.670 1.00 . A A . 95 LYS CG 1 1 6 10787 1 1 95 LYS H H -10.460 -8.592 -8.932 1.00 . A A . 95 LYS H 1 1 6 10788 1 1 95 LYS HA H -8.951 -6.708 -10.608 1.00 . A A . 95 LYS HA 1 1 6 10789 1 1 95 LYS HB2 H -10.898 -8.455 -11.468 1.00 . A A . 95 LYS HB2 1 1 6 10790 1 1 95 LYS HB3 H -11.826 -6.999 -11.173 1.00 . A A . 95 LYS HB3 1 1 6 10791 1 1 95 LYS HD2 H -11.474 -8.343 -13.553 1.00 . A A . 95 LYS HD2 1 1 6 10792 1 1 95 LYS HD3 H -11.419 -6.873 -14.505 1.00 . A A . 95 LYS HD3 1 1 6 10793 1 1 95 LYS HE2 H -8.740 -8.061 -14.141 1.00 . A A . 95 LYS HE2 1 1 6 10794 1 1 95 LYS HE3 H -9.854 -9.170 -14.916 1.00 . A A . 95 LYS HE3 1 1 6 10795 1 1 95 LYS HG2 H -10.587 -5.724 -12.738 1.00 . A A . 95 LYS HG2 1 1 6 10796 1 1 95 LYS HG3 H -9.200 -6.793 -12.667 1.00 . A A . 95 LYS HG3 1 1 6 10797 1 1 95 LYS HZ1 H -8.659 -7.612 -16.463 1.00 . A A . 95 LYS HZ1 1 1 6 10798 1 1 95 LYS HZ2 H -10.279 -7.571 -16.627 1.00 . A A . 95 LYS HZ2 1 1 6 10799 1 1 95 LYS N N -9.653 -8.207 -9.380 1.00 . A A . 95 LYS N 1 1 6 10800 1 1 95 LYS NZ N -9.520 -7.375 -15.983 1.00 . A A . 95 LYS NZ 1 1 6 10801 1 1 95 LYS O O -10.593 -4.771 -9.747 1.00 . A A . 95 LYS O 1 1 6 10802 1 1 96 ASP C C -10.228 -5.111 -5.972 1.00 . A A . 96 ASP C 1 1 6 10803 1 1 96 ASP CA C -11.245 -5.305 -7.099 1.00 . A A . 96 ASP CA 1 1 6 10804 1 1 96 ASP CB C -12.552 -5.799 -6.476 1.00 . A A . 96 ASP CB 1 1 6 10805 1 1 96 ASP CG C -13.806 -5.039 -6.913 1.00 . A A . 96 ASP CG 1 1 6 10806 1 1 96 ASP H H -10.601 -7.192 -7.700 1.00 . A A . 96 ASP H 1 1 6 10807 1 1 96 ASP HA H -11.412 -4.392 -7.671 1.00 . A A . 96 ASP HA 1 1 6 10808 1 1 96 ASP HB2 H -12.680 -6.853 -6.725 1.00 . A A . 96 ASP HB2 1 1 6 10809 1 1 96 ASP HB3 H -12.467 -5.736 -5.391 1.00 . A A . 96 ASP HB3 1 1 6 10810 1 1 96 ASP N N -10.725 -6.266 -8.056 1.00 . A A . 96 ASP N 1 1 6 10811 1 1 96 ASP O O -10.430 -4.284 -5.084 1.00 . A A . 96 ASP O 1 1 6 10812 1 1 96 ASP OD1 O -13.662 -4.173 -7.803 1.00 . A A . 96 ASP OD1 1 1 6 10813 1 1 96 ASP OD2 O -14.879 -5.341 -6.348 1.00 . A A . 96 ASP OD2 1 1 6 10814 1 1 97 LEU C C -6.771 -5.539 -5.729 1.00 . A A . 97 LEU C 1 1 6 10815 1 1 97 LEU CA C -8.109 -5.814 -5.041 1.00 . A A . 97 LEU CA 1 1 6 10816 1 1 97 LEU CB C -8.108 -7.074 -4.173 1.00 . A A . 97 LEU CB 1 1 6 10817 1 1 97 LEU CD1 C -9.085 -8.404 -2.267 1.00 . A A . 97 LEU CD1 1 1 6 10818 1 1 97 LEU CD2 C -9.650 -5.945 -2.528 1.00 . A A . 97 LEU CD2 1 1 6 10819 1 1 97 LEU CG C -9.313 -7.253 -3.248 1.00 . A A . 97 LEU CG 1 1 6 10820 1 1 97 LEU H H -9.002 -6.559 -6.770 1.00 . A A . 97 LEU H 1 1 6 10821 1 1 97 LEU HA H -8.342 -4.973 -4.388 1.00 . A A . 97 LEU HA 1 1 6 10822 1 1 97 LEU HB2 H -8.046 -7.943 -4.829 1.00 . A A . 97 LEU HB2 1 1 6 10823 1 1 97 LEU HB3 H -7.204 -7.070 -3.564 1.00 . A A . 97 LEU HB3 1 1 6 10824 1 1 97 LEU HD11 H -8.637 -9.247 -2.793 1.00 . A A . 97 LEU HD11 1 1 6 10825 1 1 97 LEU HD12 H -8.417 -8.076 -1.470 1.00 . A A . 97 LEU HD12 1 1 6 10826 1 1 97 LEU HD13 H -10.039 -8.710 -1.838 1.00 . A A . 97 LEU HD13 1 1 6 10827 1 1 97 LEU HD21 H -8.730 -5.405 -2.305 1.00 . A A . 97 LEU HD21 1 1 6 10828 1 1 97 LEU HD22 H -10.285 -5.332 -3.168 1.00 . A A . 97 LEU HD22 1 1 6 10829 1 1 97 LEU HD23 H -10.176 -6.167 -1.599 1.00 . A A . 97 LEU HD23 1 1 6 10830 1 1 97 LEU HG H -10.177 -7.516 -3.859 1.00 . A A . 97 LEU HG 1 1 6 10831 1 1 97 LEU N N -9.158 -5.889 -6.044 1.00 . A A . 97 LEU N 1 1 6 10832 1 1 97 LEU O O -6.021 -4.659 -5.307 1.00 . A A . 97 LEU O 1 1 6 10833 1 1 98 THR C C -5.564 -5.624 -8.929 1.00 . A A . 98 THR C 1 1 6 10834 1 1 98 THR CA C -5.275 -6.159 -7.526 1.00 . A A . 98 THR CA 1 1 6 10835 1 1 98 THR CB C -4.556 -7.510 -7.527 1.00 . A A . 98 THR CB 1 1 6 10836 1 1 98 THR CG2 C -4.740 -8.271 -6.212 1.00 . A A . 98 THR CG2 1 1 6 10837 1 1 98 THR H H -7.125 -7.022 -7.112 1.00 . A A . 98 THR H 1 1 6 10838 1 1 98 THR HA H -4.655 -5.417 -7.022 1.00 . A A . 98 THR HA 1 1 6 10839 1 1 98 THR HB H -3.499 -7.388 -7.762 1.00 . A A . 98 THR HB 1 1 6 10840 1 1 98 THR HG1 H -6.234 -8.361 -8.207 1.00 . A A . 98 THR HG1 1 1 6 10841 1 1 98 THR HG21 H -5.802 -8.338 -5.976 1.00 . A A . 98 THR HG21 1 1 6 10842 1 1 98 THR HG22 H -4.326 -9.275 -6.313 1.00 . A A . 98 THR HG22 1 1 6 10843 1 1 98 THR HG23 H -4.221 -7.744 -5.411 1.00 . A A . 98 THR HG23 1 1 6 10844 1 1 98 THR N N -6.510 -6.308 -6.776 1.00 . A A . 98 THR N 1 1 6 10845 1 1 98 THR O O -4.707 -5.684 -9.809 1.00 . A A . 98 THR O 1 1 6 10846 1 1 98 THR OG1 O -5.276 -8.285 -8.481 1.00 . A A . 98 THR OG1 1 1 6 10847 1 1 99 GLY C C -6.266 -3.426 -10.810 1.00 . A A . 99 GLY C 1 1 6 10848 1 1 99 GLY CA C -7.188 -4.567 -10.377 1.00 . A A . 99 GLY CA 1 1 6 10849 1 1 99 GLY H H -7.466 -5.067 -8.374 1.00 . A A . 99 GLY H 1 1 6 10850 1 1 99 GLY HA2 H -7.178 -5.354 -11.131 1.00 . A A . 99 GLY HA2 1 1 6 10851 1 1 99 GLY HA3 H -8.214 -4.205 -10.308 1.00 . A A . 99 GLY HA3 1 1 6 10852 1 1 99 GLY N N -6.775 -5.112 -9.095 1.00 . A A . 99 GLY N 1 1 6 10853 1 1 99 GLY O O -5.518 -2.885 -9.998 1.00 . A A . 99 GLY O 1 1 6 10854 1 1 100 CYS C C -6.420 -0.801 -12.854 1.00 . A A . 100 CYS C 1 1 6 10855 1 1 100 CYS CA C -5.531 -2.028 -12.642 1.00 . A A . 100 CYS CA 1 1 6 10856 1 1 100 CYS CB C -4.836 -2.459 -13.935 1.00 . A A . 100 CYS CB 1 1 6 10857 1 1 100 CYS H H -6.960 -3.540 -12.745 1.00 . A A . 100 CYS H 1 1 6 10858 1 1 100 CYS HA H -4.752 -1.819 -11.908 1.00 . A A . 100 CYS HA 1 1 6 10859 1 1 100 CYS HB2 H -5.437 -3.232 -14.414 1.00 . A A . 100 CYS HB2 1 1 6 10860 1 1 100 CYS HB3 H -4.808 -1.609 -14.617 1.00 . A A . 100 CYS HB3 1 1 6 10861 1 1 100 CYS N N -6.349 -3.094 -12.090 1.00 . A A . 100 CYS N 1 1 6 10862 1 1 100 CYS O O -6.007 0.324 -12.576 1.00 . A A . 100 CYS O 1 1 6 10863 1 1 100 CYS SG S -3.132 -3.092 -13.717 1.00 . A A . 100 CYS SG 1 1 6 10864 1 1 101 LYS C C -9.966 -0.432 -13.139 1.00 . A A . 101 LYS C 1 1 6 10865 1 1 101 LYS CA C -8.574 0.010 -13.595 1.00 . A A . 101 LYS CA 1 1 6 10866 1 1 101 LYS CB C -8.517 0.443 -15.062 1.00 . A A . 101 LYS CB 1 1 6 10867 1 1 101 LYS CD C -9.864 1.719 -16.770 1.00 . A A . 101 LYS CD 1 1 6 10868 1 1 101 LYS CE C -9.758 3.142 -17.320 1.00 . A A . 101 LYS CE 1 1 6 10869 1 1 101 LYS CG C -9.411 1.660 -15.310 1.00 . A A . 101 LYS CG 1 1 6 10870 1 1 101 LYS H H -7.951 -1.977 -13.565 1.00 . A A . 101 LYS H 1 1 6 10871 1 1 101 LYS HA H -8.270 0.867 -12.994 1.00 . A A . 101 LYS HA 1 1 6 10872 1 1 101 LYS HB2 H -7.489 0.682 -15.335 1.00 . A A . 101 LYS HB2 1 1 6 10873 1 1 101 LYS HB3 H -8.832 -0.381 -15.701 1.00 . A A . 101 LYS HB3 1 1 6 10874 1 1 101 LYS HD2 H -9.253 1.046 -17.371 1.00 . A A . 101 LYS HD2 1 1 6 10875 1 1 101 LYS HD3 H -10.894 1.370 -16.849 1.00 . A A . 101 LYS HD3 1 1 6 10876 1 1 101 LYS HE2 H -10.577 3.333 -18.013 1.00 . A A . 101 LYS HE2 1 1 6 10877 1 1 101 LYS HE3 H -9.854 3.861 -16.506 1.00 . A A . 101 LYS HE3 1 1 6 10878 1 1 101 LYS HG2 H -10.282 1.614 -14.656 1.00 . A A . 101 LYS HG2 1 1 6 10879 1 1 101 LYS HG3 H -8.870 2.571 -15.056 1.00 . A A . 101 LYS HG3 1 1 6 10880 1 1 101 LYS HZ1 H -8.585 3.611 -18.978 1.00 . A A . 101 LYS HZ1 1 1 6 10881 1 1 101 LYS HZ2 H -7.902 4.056 -17.568 1.00 . A A . 101 LYS HZ2 1 1 6 10882 1 1 101 LYS N N -7.624 -1.059 -13.343 1.00 . A A . 101 LYS N 1 1 6 10883 1 1 101 LYS NZ N -8.463 3.336 -18.009 1.00 . A A . 101 LYS NZ 1 1 6 10884 1 1 101 LYS O O -10.352 -1.583 -13.339 1.00 . A A . 101 LYS O 1 1 6 10885 1 1 102 LYS C C -11.939 -0.740 -10.865 1.00 . A A . 102 LYS C 1 1 6 10886 1 1 102 LYS CA C -12.022 0.226 -12.048 1.00 . A A . 102 LYS CA 1 1 6 10887 1 1 102 LYS CB C -12.913 -0.272 -13.188 1.00 . A A . 102 LYS CB 1 1 6 10888 1 1 102 LYS CD C -15.078 0.479 -14.242 1.00 . A A . 102 LYS CD 1 1 6 10889 1 1 102 LYS CE C -16.108 1.456 -13.673 1.00 . A A . 102 LYS CE 1 1 6 10890 1 1 102 LYS CG C -13.657 0.890 -13.850 1.00 . A A . 102 LYS CG 1 1 6 10891 1 1 102 LYS H H -10.360 1.439 -12.377 1.00 . A A . 102 LYS H 1 1 6 10892 1 1 102 LYS HA H -12.444 1.168 -11.697 1.00 . A A . 102 LYS HA 1 1 6 10893 1 1 102 LYS HB2 H -12.306 -0.789 -13.931 1.00 . A A . 102 LYS HB2 1 1 6 10894 1 1 102 LYS HB3 H -13.631 -0.996 -12.803 1.00 . A A . 102 LYS HB3 1 1 6 10895 1 1 102 LYS HD2 H -15.164 0.445 -15.328 1.00 . A A . 102 LYS HD2 1 1 6 10896 1 1 102 LYS HD3 H -15.283 -0.527 -13.874 1.00 . A A . 102 LYS HD3 1 1 6 10897 1 1 102 LYS HE2 H -15.968 1.556 -12.597 1.00 . A A . 102 LYS HE2 1 1 6 10898 1 1 102 LYS HE3 H -15.959 2.445 -14.107 1.00 . A A . 102 LYS HE3 1 1 6 10899 1 1 102 LYS HG2 H -13.696 1.738 -13.166 1.00 . A A . 102 LYS HG2 1 1 6 10900 1 1 102 LYS HG3 H -13.113 1.218 -14.735 1.00 . A A . 102 LYS HG3 1 1 6 10901 1 1 102 LYS HZ1 H -17.924 1.527 -14.693 1.00 . A A . 102 LYS HZ1 1 1 6 10902 1 1 102 LYS HZ2 H -17.497 0.017 -14.259 1.00 . A A . 102 LYS HZ2 1 1 6 10903 1 1 102 LYS N N -10.682 0.505 -12.535 1.00 . A A . 102 LYS N 1 1 6 10904 1 1 102 LYS NZ N -17.482 0.985 -13.959 1.00 . A A . 102 LYS NZ 1 1 6 10905 1 1 102 LYS O O -12.757 -1.651 -10.745 1.00 . A A . 102 LYS O 1 1 6 10906 1 1 103 SER C C -11.053 -0.554 -7.580 1.00 . A A . 103 SER C 1 1 6 10907 1 1 103 SER CA C -10.745 -1.347 -8.852 1.00 . A A . 103 SER CA 1 1 6 10908 1 1 103 SER CB C -9.316 -1.893 -8.804 1.00 . A A . 103 SER CB 1 1 6 10909 1 1 103 SER H H -10.285 0.235 -10.125 1.00 . A A . 103 SER H 1 1 6 10910 1 1 103 SER HA H -11.446 -2.174 -8.966 1.00 . A A . 103 SER HA 1 1 6 10911 1 1 103 SER HB2 H -8.953 -1.869 -7.776 1.00 . A A . 103 SER HB2 1 1 6 10912 1 1 103 SER HB3 H -9.317 -2.938 -9.117 1.00 . A A . 103 SER HB3 1 1 6 10913 1 1 103 SER HG H -8.382 -0.201 -9.322 1.00 . A A . 103 SER HG 1 1 6 10914 1 1 103 SER N N -10.945 -0.508 -10.021 1.00 . A A . 103 SER N 1 1 6 10915 1 1 103 SER O O -11.549 0.569 -7.649 1.00 . A A . 103 SER O 1 1 6 10916 1 1 103 SER OG O -8.432 -1.149 -9.637 1.00 . A A . 103 SER OG 1 1 6 10917 1 1 104 LYS C C -9.937 0.554 -4.935 1.00 . A A . 104 LYS C 1 1 6 10918 1 1 104 LYS CA C -10.985 -0.537 -5.162 1.00 . A A . 104 LYS CA 1 1 6 10919 1 1 104 LYS CB C -11.033 -1.585 -4.049 1.00 . A A . 104 LYS CB 1 1 6 10920 1 1 104 LYS CD C -13.525 -1.921 -3.863 1.00 . A A . 104 LYS CD 1 1 6 10921 1 1 104 LYS CE C -14.414 -2.923 -3.125 1.00 . A A . 104 LYS CE 1 1 6 10922 1 1 104 LYS CG C -12.193 -2.559 -4.262 1.00 . A A . 104 LYS CG 1 1 6 10923 1 1 104 LYS H H -10.343 -2.085 -6.400 1.00 . A A . 104 LYS H 1 1 6 10924 1 1 104 LYS HA H -11.968 -0.068 -5.206 1.00 . A A . 104 LYS HA 1 1 6 10925 1 1 104 LYS HB2 H -10.092 -2.135 -4.021 1.00 . A A . 104 LYS HB2 1 1 6 10926 1 1 104 LYS HB3 H -11.141 -1.091 -3.083 1.00 . A A . 104 LYS HB3 1 1 6 10927 1 1 104 LYS HD2 H -13.342 -1.055 -3.227 1.00 . A A . 104 LYS HD2 1 1 6 10928 1 1 104 LYS HD3 H -14.040 -1.559 -4.753 1.00 . A A . 104 LYS HD3 1 1 6 10929 1 1 104 LYS HE2 H -13.799 -3.703 -2.677 1.00 . A A . 104 LYS HE2 1 1 6 10930 1 1 104 LYS HE3 H -14.937 -2.423 -2.310 1.00 . A A . 104 LYS HE3 1 1 6 10931 1 1 104 LYS HG2 H -12.230 -2.862 -5.308 1.00 . A A . 104 LYS HG2 1 1 6 10932 1 1 104 LYS HG3 H -12.028 -3.462 -3.674 1.00 . A A . 104 LYS HG3 1 1 6 10933 1 1 104 LYS HZ1 H -14.948 -4.117 -4.748 1.00 . A A . 104 LYS HZ1 1 1 6 10934 1 1 104 LYS HZ2 H -16.070 -4.109 -3.568 1.00 . A A . 104 LYS HZ2 1 1 6 10935 1 1 104 LYS N N -10.746 -1.171 -6.448 1.00 . A A . 104 LYS N 1 1 6 10936 1 1 104 LYS NZ N -15.395 -3.529 -4.053 1.00 . A A . 104 LYS NZ 1 1 6 10937 1 1 104 LYS O O -10.205 1.546 -4.259 1.00 . A A . 104 LYS O 1 1 6 10938 1 1 105 CYS C C -7.846 2.364 -6.452 1.00 . A A . 105 CYS C 1 1 6 10939 1 1 105 CYS CA C -7.675 1.286 -5.379 1.00 . A A . 105 CYS CA 1 1 6 10940 1 1 105 CYS CB C -6.310 0.601 -5.472 1.00 . A A . 105 CYS CB 1 1 6 10941 1 1 105 CYS H H -8.554 -0.475 -6.059 1.00 . A A . 105 CYS H 1 1 6 10942 1 1 105 CYS HA H -7.755 1.717 -4.381 1.00 . A A . 105 CYS HA 1 1 6 10943 1 1 105 CYS HB2 H -6.166 0.193 -6.472 1.00 . A A . 105 CYS HB2 1 1 6 10944 1 1 105 CYS HB3 H -5.516 1.329 -5.308 1.00 . A A . 105 CYS HB3 1 1 6 10945 1 1 105 CYS N N -8.764 0.334 -5.511 1.00 . A A . 105 CYS N 1 1 6 10946 1 1 105 CYS O O -8.073 3.530 -6.134 1.00 . A A . 105 CYS O 1 1 6 10947 1 1 105 CYS SG S -6.196 -0.738 -4.229 1.00 . A A . 105 CYS SG 1 1 6 10948 1 1 106 HIS C C -9.306 2.801 -9.347 1.00 . A A . 106 HIS C 1 1 6 10949 1 1 106 HIS CA C -7.870 2.849 -8.821 1.00 . A A . 106 HIS CA 1 1 6 10950 1 1 106 HIS CB C -6.832 2.543 -9.903 1.00 . A A . 106 HIS CB 1 1 6 10951 1 1 106 HIS CD2 C -4.374 1.806 -9.403 1.00 . A A . 106 HIS CD2 1 1 6 10952 1 1 106 HIS CE1 C -3.625 3.716 -8.642 1.00 . A A . 106 HIS CE1 1 1 6 10953 1 1 106 HIS CG C -5.402 2.702 -9.445 1.00 . A A . 106 HIS CG 1 1 6 10954 1 1 106 HIS H H -7.547 0.984 -7.950 1.00 . A A . 106 HIS H 1 1 6 10955 1 1 106 HIS HA H -7.665 3.848 -8.437 1.00 . A A . 106 HIS HA 1 1 6 10956 1 1 106 HIS HB2 H -6.979 1.522 -10.254 1.00 . A A . 106 HIS HB2 1 1 6 10957 1 1 106 HIS HB3 H -7.005 3.201 -10.755 1.00 . A A . 106 HIS HB3 1 1 6 10958 1 1 106 HIS HD1 H -5.410 4.751 -8.862 1.00 . A A . 106 HIS HD1 1 1 6 10959 1 1 106 HIS HD2 H -4.426 0.763 -9.714 1.00 . A A . 106 HIS HD2 1 1 6 10960 1 1 106 HIS HE1 H -2.954 4.470 -8.233 1.00 . A A . 106 HIS HE1 1 1 6 10961 1 1 106 HIS N N -7.731 1.935 -7.700 1.00 . A A . 106 HIS N 1 1 6 10962 1 1 106 HIS ND1 N -4.899 3.896 -8.958 1.00 . A A . 106 HIS ND1 1 1 6 10963 1 1 106 HIS NE2 N -3.302 2.420 -8.919 1.00 . A A . 106 HIS NE2 1 1 6 10964 1 1 106 HIS O O -9.810 1.733 -9.691 1.00 . A A . 106 HIS O 1 1 6 10965 1 1 107 GLU C C -11.342 4.902 -11.159 1.00 . A A . 107 GLU C 1 1 6 10966 1 1 107 GLU CA C -11.292 4.078 -9.871 1.00 . A A . 107 GLU CA 1 1 6 10967 1 1 107 GLU CB C -12.202 4.681 -8.799 1.00 . A A . 107 GLU CB 1 1 6 10968 1 1 107 GLU CD C -14.138 3.304 -7.951 1.00 . A A . 107 GLU CD 1 1 6 10969 1 1 107 GLU CG C -12.648 3.615 -7.796 1.00 . A A . 107 GLU CG 1 1 6 10970 1 1 107 GLU H H -9.507 4.837 -9.112 1.00 . A A . 107 GLU H 1 1 6 10971 1 1 107 GLU HA H -11.608 3.055 -10.073 1.00 . A A . 107 GLU HA 1 1 6 10972 1 1 107 GLU HB2 H -11.676 5.479 -8.276 1.00 . A A . 107 GLU HB2 1 1 6 10973 1 1 107 GLU HB3 H -13.077 5.130 -9.269 1.00 . A A . 107 GLU HB3 1 1 6 10974 1 1 107 GLU HG2 H -12.066 2.705 -7.943 1.00 . A A . 107 GLU HG2 1 1 6 10975 1 1 107 GLU HG3 H -12.449 3.959 -6.781 1.00 . A A . 107 GLU HG3 1 1 6 10976 1 1 107 GLU N N -9.924 3.972 -9.393 1.00 . A A . 107 GLU N 1 1 6 10977 1 1 107 GLU O O -12.348 4.891 -11.868 1.00 . A A . 107 GLU O 1 1 6 10978 1 1 107 GLU OXT O -10.326 5.572 -11.444 1.00 . A A . 107 GLU OXT 1 1 6 10979 1 1 107 GLU OE1 O -14.469 2.579 -8.914 1.00 . A A . 107 GLU OE1 1 1 6 10980 1 1 107 GLU OE2 O -14.913 3.799 -7.104 1.00 . A A . 107 GLU OE2 1 1 6 10981 2 2 1 HEC C1A C -1.112 5.542 9.130 1.00 . B A . 108 HEC C1A 1 1 6 10982 2 2 1 HEC C1B C -1.947 2.399 11.976 1.00 . B A . 108 HEC C1B 1 1 6 10983 2 2 1 HEC C1C C -2.140 -0.479 8.690 1.00 . B A . 108 HEC C1C 1 1 6 10984 2 2 1 HEC C1D C -1.063 2.652 5.914 1.00 . B A . 108 HEC C1D 1 1 6 10985 2 2 1 HEC C2A C -0.989 6.613 10.090 1.00 . B A . 108 HEC C2A 1 1 6 10986 2 2 1 HEC C2B C -2.349 1.501 13.033 1.00 . B A . 108 HEC C2B 1 1 6 10987 2 2 1 HEC C2C C -2.180 -1.555 7.727 1.00 . B A . 108 HEC C2C 1 1 6 10988 2 2 1 HEC C2D C -0.676 3.573 4.871 1.00 . B A . 108 HEC C2D 1 1 6 10989 2 2 1 HEC C3A C -1.175 6.073 11.313 1.00 . B A . 108 HEC C3A 1 1 6 10990 2 2 1 HEC C3B C -2.543 0.289 12.472 1.00 . B A . 108 HEC C3B 1 1 6 10991 2 2 1 HEC C3C C -1.855 -1.026 6.528 1.00 . B A . 108 HEC C3C 1 1 6 10992 2 2 1 HEC C3D C -0.602 4.799 5.431 1.00 . B A . 108 HEC C3D 1 1 6 10993 2 2 1 HEC C4A C -1.415 4.662 11.122 1.00 . B A . 108 HEC C4A 1 1 6 10994 2 2 1 HEC C4B C -2.263 0.424 11.062 1.00 . B A . 108 HEC C4B 1 1 6 10995 2 2 1 HEC C4C C -1.610 0.382 6.737 1.00 . B A . 108 HEC C4C 1 1 6 10996 2 2 1 HEC C4D C -0.944 4.650 6.826 1.00 . B A . 108 HEC C4D 1 1 6 10997 2 2 1 HEC CAA C -0.707 8.047 9.746 1.00 . B A . 108 HEC CAA 1 1 6 10998 2 2 1 HEC CAB C -2.968 -0.983 13.145 1.00 . B A . 108 HEC CAB 1 1 6 10999 2 2 1 HEC CAC C -1.754 -1.729 5.205 1.00 . B A . 108 HEC CAC 1 1 6 11000 2 2 1 HEC CAD C -0.239 6.096 4.769 1.00 . B A . 108 HEC CAD 1 1 6 11001 2 2 1 HEC CBA C 0.363 8.695 10.618 1.00 . B A . 108 HEC CBA 1 1 6 11002 2 2 1 HEC CBB C -4.214 -0.839 14.014 1.00 . B A . 108 HEC CBB 1 1 6 11003 2 2 1 HEC CBC C -2.756 -2.866 5.029 1.00 . B A . 108 HEC CBC 1 1 6 11004 2 2 1 HEC CBD C -0.805 6.254 3.361 1.00 . B A . 108 HEC CBD 1 1 6 11005 2 2 1 HEC CGA C -0.261 9.606 11.665 1.00 . B A . 108 HEC CGA 1 1 6 11006 2 2 1 HEC CGD C 0.311 6.331 2.328 1.00 . B A . 108 HEC CGD 1 1 6 11007 2 2 1 HEC CHA C -0.982 5.705 7.755 1.00 . B A . 108 HEC CHA 1 1 6 11008 2 2 1 HEC CHB C -1.655 3.746 12.163 1.00 . B A . 108 HEC CHB 1 1 6 11009 2 2 1 HEC CHC C -2.352 -0.623 10.127 1.00 . B A . 108 HEC CHC 1 1 6 11010 2 2 1 HEC CHD C -1.244 1.286 5.724 1.00 . B A . 108 HEC CHD 1 1 6 11011 2 2 1 HEC CMA C -1.148 6.768 12.644 1.00 . B A . 108 HEC CMA 1 1 6 11012 2 2 1 HEC CMB C -2.508 1.889 14.474 1.00 . B A . 108 HEC CMB 1 1 6 11013 2 2 1 HEC CMC C -2.524 -2.980 8.045 1.00 . B A . 108 HEC CMC 1 1 6 11014 2 2 1 HEC CMD C -0.413 3.191 3.443 1.00 . B A . 108 HEC CMD 1 1 6 11015 2 2 1 HEC FE FE -1.571 2.526 8.931 1.00 . B A . 108 HEC FE 1 1 6 11016 2 2 1 HEC HAA1 H -0.364 8.112 8.714 1.00 . B A . 108 HEC HAA1 1 1 6 11017 2 2 1 HEC HAA2 H -1.618 8.634 9.864 1.00 . B A . 108 HEC HAA2 1 1 6 11018 2 2 1 HEC HAB H -3.188 -1.738 12.390 1.00 . B A . 108 HEC HAB 1 1 6 11019 2 2 1 HEC HAC H -1.932 -1.015 4.401 1.00 . B A . 108 HEC HAC 1 1 6 11020 2 2 1 HEC HAD1 H -0.621 6.926 5.364 1.00 . B A . 108 HEC HAD1 1 1 6 11021 2 2 1 HEC HAD2 H 0.845 6.174 4.691 1.00 . B A . 108 HEC HAD2 1 1 6 11022 2 2 1 HEC HBA1 H 0.936 7.920 11.128 1.00 . B A . 108 HEC HBA1 1 1 6 11023 2 2 1 HEC HBA2 H 1.031 9.289 9.993 1.00 . B A . 108 HEC HBA2 1 1 6 11024 2 2 1 HEC HBB1 H -3.977 -1.124 15.039 1.00 . B A . 108 HEC HBB1 1 1 6 11025 2 2 1 HEC HBB2 H -4.553 0.196 13.994 1.00 . B A . 108 HEC HBB2 1 1 6 11026 2 2 1 HEC HBB3 H -5.002 -1.487 13.630 1.00 . B A . 108 HEC HBB3 1 1 6 11027 2 2 1 HEC HBC1 H -2.313 -3.798 5.382 1.00 . B A . 108 HEC HBC1 1 1 6 11028 2 2 1 HEC HBC2 H -3.656 -2.650 5.604 1.00 . B A . 108 HEC HBC2 1 1 6 11029 2 2 1 HEC HBC3 H -3.013 -2.963 3.974 1.00 . B A . 108 HEC HBC3 1 1 6 11030 2 2 1 HEC HBD1 H -1.439 5.400 3.126 1.00 . B A . 108 HEC HBD1 1 1 6 11031 2 2 1 HEC HBD2 H -1.393 7.170 3.306 1.00 . B A . 108 HEC HBD2 1 1 6 11032 2 2 1 HEC HHA H -0.905 6.721 7.365 1.00 . B A . 108 HEC HHA 1 1 6 11033 2 2 1 HEC HHB H -1.607 4.122 13.185 1.00 . B A . 108 HEC HHB 1 1 6 11034 2 2 1 HEC HHC H -2.584 -1.618 10.507 1.00 . B A . 108 HEC HHC 1 1 6 11035 2 2 1 HEC HHD H -1.091 0.884 4.722 1.00 . B A . 108 HEC HHD 1 1 6 11036 2 2 1 HEC HMA1 H -1.761 7.668 12.596 1.00 . B A . 108 HEC HMA1 1 1 6 11037 2 2 1 HEC HMA2 H -1.541 6.100 13.410 1.00 . B A . 108 HEC HMA2 1 1 6 11038 2 2 1 HEC HMA3 H -0.121 7.039 12.890 1.00 . B A . 108 HEC HMA3 1 1 6 11039 2 2 1 HEC HMB1 H -2.360 1.012 15.105 1.00 . B A . 108 HEC HMB1 1 1 6 11040 2 2 1 HEC HMB2 H -1.771 2.649 14.730 1.00 . B A . 108 HEC HMB2 1 1 6 11041 2 2 1 HEC HMB3 H -3.510 2.286 14.635 1.00 . B A . 108 HEC HMB3 1 1 6 11042 2 2 1 HEC HMC1 H -3.498 -3.223 7.622 1.00 . B A . 108 HEC HMC1 1 1 6 11043 2 2 1 HEC HMC2 H -1.768 -3.641 7.620 1.00 . B A . 108 HEC HMC2 1 1 6 11044 2 2 1 HEC HMC3 H -2.555 -3.114 9.127 1.00 . B A . 108 HEC HMC3 1 1 6 11045 2 2 1 HEC HMD1 H 0.196 3.961 2.968 1.00 . B A . 108 HEC HMD1 1 1 6 11046 2 2 1 HEC HMD2 H 0.116 2.239 3.413 1.00 . B A . 108 HEC HMD2 1 1 6 11047 2 2 1 HEC HMD3 H -1.361 3.098 2.912 1.00 . B A . 108 HEC HMD3 1 1 6 11048 2 2 1 HEC NA N -1.373 4.346 9.776 1.00 . B A . 108 HEC NA 1 1 6 11049 2 2 1 HEC NB N -1.897 1.726 10.767 1.00 . B A . 108 HEC NB 1 1 6 11050 2 2 1 HEC NC N -1.789 0.707 8.070 1.00 . B A . 108 HEC NC 1 1 6 11051 2 2 1 HEC ND N -1.226 3.325 7.112 1.00 . B A . 108 HEC ND 1 1 6 11052 2 2 1 HEC O1A O 0.294 9.649 12.785 1.00 . B A . 108 HEC O1A 1 1 6 11053 2 2 1 HEC O1D O 0.067 6.957 1.274 1.00 . B A . 108 HEC O1D 1 1 6 11054 2 2 1 HEC O2A O -1.282 10.244 11.327 1.00 . B A . 108 HEC O2A 1 1 6 11055 2 2 1 HEC O2D O 1.387 5.761 2.612 1.00 . B A . 108 HEC O2D 1 1 6 11056 3 2 1 HEC C1A C 9.570 -1.770 1.733 1.00 . C A . 109 HEC C1A 1 1 6 11057 3 2 1 HEC C1B C 5.754 -0.018 2.758 1.00 . C A . 109 HEC C1B 1 1 6 11058 3 2 1 HEC C1C C 7.832 3.015 5.143 1.00 . C A . 109 HEC C1C 1 1 6 11059 3 2 1 HEC C1D C 11.620 1.411 3.822 1.00 . C A . 109 HEC C1D 1 1 6 11060 3 2 1 HEC C2A C 9.050 -2.845 0.922 1.00 . C A . 109 HEC C2A 1 1 6 11061 3 2 1 HEC C2B C 4.405 0.357 3.109 1.00 . C A . 109 HEC C2B 1 1 6 11062 3 2 1 HEC C2C C 8.367 4.155 5.851 1.00 . C A . 109 HEC C2C 1 1 6 11063 3 2 1 HEC C2D C 12.962 0.965 3.532 1.00 . C A . 109 HEC C2D 1 1 6 11064 3 2 1 HEC C3A C 7.707 -2.709 0.895 1.00 . C A . 109 HEC C3A 1 1 6 11065 3 2 1 HEC C3B C 4.491 1.411 3.947 1.00 . C A . 109 HEC C3B 1 1 6 11066 3 2 1 HEC C3C C 9.708 4.117 5.706 1.00 . C A . 109 HEC C3C 1 1 6 11067 3 2 1 HEC C3D C 12.856 -0.182 2.828 1.00 . C A . 109 HEC C3D 1 1 6 11068 3 2 1 HEC C4A C 7.382 -1.547 1.689 1.00 . C A . 109 HEC C4A 1 1 6 11069 3 2 1 HEC C4B C 5.895 1.699 4.125 1.00 . C A . 109 HEC C4B 1 1 6 11070 3 2 1 HEC C4C C 10.017 2.954 4.908 1.00 . C A . 109 HEC C4C 1 1 6 11071 3 2 1 HEC C4D C 11.447 -0.458 2.676 1.00 . C A . 109 HEC C4D 1 1 6 11072 3 2 1 HEC CAA C 9.885 -3.898 0.252 1.00 . C A . 109 HEC CAA 1 1 6 11073 3 2 1 HEC CAB C 3.370 2.171 4.596 1.00 . C A . 109 HEC CAB 1 1 6 11074 3 2 1 HEC CAC C 10.723 5.079 6.252 1.00 . C A . 109 HEC CAC 1 1 6 11075 3 2 1 HEC CAD C 13.962 -1.041 2.288 1.00 . C A . 109 HEC CAD 1 1 6 11076 3 2 1 HEC CBA C 10.134 -3.642 -1.231 1.00 . C A . 109 HEC CBA 1 1 6 11077 3 2 1 HEC CBB C 2.309 1.282 5.239 1.00 . C A . 109 HEC CBB 1 1 6 11078 3 2 1 HEC CBC C 10.715 5.192 7.774 1.00 . C A . 109 HEC CBC 1 1 6 11079 3 2 1 HEC CBD C 15.175 -1.143 3.208 1.00 . C A . 109 HEC CBD 1 1 6 11080 3 2 1 HEC CGA C 10.930 -4.778 -1.857 1.00 . C A . 109 HEC CGA 1 1 6 11081 3 2 1 HEC CGD C 16.327 -0.293 2.692 1.00 . C A . 109 HEC CGD 1 1 6 11082 3 2 1 HEC CHA C 10.921 -1.573 1.997 1.00 . C A . 109 HEC CHA 1 1 6 11083 3 2 1 HEC CHB C 6.077 -1.070 1.907 1.00 . C A . 109 HEC CHB 1 1 6 11084 3 2 1 HEC CHC C 6.401 2.734 4.932 1.00 . C A . 109 HEC CHC 1 1 6 11085 3 2 1 HEC CHD C 11.316 2.566 4.535 1.00 . C A . 109 HEC CHD 1 1 6 11086 3 2 1 HEC CMA C 6.704 -3.574 0.188 1.00 . C A . 109 HEC CMA 1 1 6 11087 3 2 1 HEC CMB C 3.166 -0.327 2.609 1.00 . C A . 109 HEC CMB 1 1 6 11088 3 2 1 HEC CMC C 7.545 5.167 6.595 1.00 . C A . 109 HEC CMC 1 1 6 11089 3 2 1 HEC CMD C 14.214 1.677 3.954 1.00 . C A . 109 HEC CMD 1 1 6 11090 3 2 1 HEC FE FE 8.687 0.662 3.362 1.00 . C A . 109 HEC FE 1 1 6 11091 3 2 1 HEC HAA1 H 10.860 -3.951 0.738 1.00 . C A . 109 HEC HAA1 1 1 6 11092 3 2 1 HEC HAA2 H 9.386 -4.863 0.333 1.00 . C A . 109 HEC HAA2 1 1 6 11093 3 2 1 HEC HAB H 3.772 2.812 5.380 1.00 . C A . 109 HEC HAB 1 1 6 11094 3 2 1 HEC HAC H 11.723 4.757 5.959 1.00 . C A . 109 HEC HAC 1 1 6 11095 3 2 1 HEC HAD1 H 13.592 -2.054 2.130 1.00 . C A . 109 HEC HAD1 1 1 6 11096 3 2 1 HEC HAD2 H 14.311 -0.630 1.340 1.00 . C A . 109 HEC HAD2 1 1 6 11097 3 2 1 HEC HBA1 H 9.180 -3.557 -1.751 1.00 . C A . 109 HEC HBA1 1 1 6 11098 3 2 1 HEC HBA2 H 10.697 -2.716 -1.350 1.00 . C A . 109 HEC HBA2 1 1 6 11099 3 2 1 HEC HBB1 H 1.592 0.965 4.482 1.00 . C A . 109 HEC HBB1 1 1 6 11100 3 2 1 HEC HBB2 H 2.786 0.405 5.677 1.00 . C A . 109 HEC HBB2 1 1 6 11101 3 2 1 HEC HBB3 H 1.791 1.841 6.018 1.00 . C A . 109 HEC HBB3 1 1 6 11102 3 2 1 HEC HBC1 H 11.134 4.285 8.209 1.00 . C A . 109 HEC HBC1 1 1 6 11103 3 2 1 HEC HBC2 H 11.314 6.051 8.078 1.00 . C A . 109 HEC HBC2 1 1 6 11104 3 2 1 HEC HBC3 H 9.691 5.323 8.123 1.00 . C A . 109 HEC HBC3 1 1 6 11105 3 2 1 HEC HBD1 H 14.905 -0.795 4.205 1.00 . C A . 109 HEC HBD1 1 1 6 11106 3 2 1 HEC HBD2 H 15.504 -2.180 3.262 1.00 . C A . 109 HEC HBD2 1 1 6 11107 3 2 1 HEC HHA H 11.625 -2.332 1.657 1.00 . C A . 109 HEC HHA 1 1 6 11108 3 2 1 HEC HHB H 5.266 -1.560 1.369 1.00 . C A . 109 HEC HHB 1 1 6 11109 3 2 1 HEC HHC H 5.680 3.366 5.449 1.00 . C A . 109 HEC HHC 1 1 6 11110 3 2 1 HEC HHD H 12.139 3.218 4.826 1.00 . C A . 109 HEC HHD 1 1 6 11111 3 2 1 HEC HMA1 H 7.221 -4.236 -0.507 1.00 . C A . 109 HEC HMA1 1 1 6 11112 3 2 1 HEC HMA2 H 6.159 -4.170 0.920 1.00 . C A . 109 HEC HMA2 1 1 6 11113 3 2 1 HEC HMA3 H 6.004 -2.944 -0.361 1.00 . C A . 109 HEC HMA3 1 1 6 11114 3 2 1 HEC HMB1 H 3.345 -0.717 1.607 1.00 . C A . 109 HEC HMB1 1 1 6 11115 3 2 1 HEC HMB2 H 2.909 -1.148 3.277 1.00 . C A . 109 HEC HMB2 1 1 6 11116 3 2 1 HEC HMB3 H 2.343 0.388 2.579 1.00 . C A . 109 HEC HMB3 1 1 6 11117 3 2 1 HEC HMC1 H 7.759 5.096 7.661 1.00 . C A . 109 HEC HMC1 1 1 6 11118 3 2 1 HEC HMC2 H 7.792 6.168 6.240 1.00 . C A . 109 HEC HMC2 1 1 6 11119 3 2 1 HEC HMC3 H 6.486 4.972 6.423 1.00 . C A . 109 HEC HMC3 1 1 6 11120 3 2 1 HEC HMD1 H 14.947 1.632 3.149 1.00 . C A . 109 HEC HMD1 1 1 6 11121 3 2 1 HEC HMD2 H 13.981 2.718 4.177 1.00 . C A . 109 HEC HMD2 1 1 6 11122 3 2 1 HEC HMD3 H 14.622 1.197 4.844 1.00 . C A . 109 HEC HMD3 1 1 6 11123 3 2 1 HEC NA N 8.535 -0.977 2.199 1.00 . C A . 109 HEC NA 1 1 6 11124 3 2 1 HEC NB N 6.663 0.814 3.389 1.00 . C A . 109 HEC NB 1 1 6 11125 3 2 1 HEC NC N 8.855 2.284 4.568 1.00 . C A . 109 HEC NC 1 1 6 11126 3 2 1 HEC ND N 10.695 0.528 3.290 1.00 . C A . 109 HEC ND 1 1 6 11127 3 2 1 HEC O1A O 11.809 -5.313 -1.147 1.00 . C A . 109 HEC O1A 1 1 6 11128 3 2 1 HEC O1D O 16.979 0.355 3.540 1.00 . C A . 109 HEC O1D 1 1 6 11129 3 2 1 HEC O2A O 10.645 -5.090 -3.033 1.00 . C A . 109 HEC O2A 1 1 6 11130 3 2 1 HEC O2D O 16.535 -0.306 1.460 1.00 . C A . 109 HEC O2D 1 1 6 11131 4 2 1 HEC C1A C -8.714 -3.364 0.461 1.00 . D A . 110 HEC C1A 1 1 6 11132 4 2 1 HEC C1B C -5.024 -1.144 0.112 1.00 . D A . 110 HEC C1B 1 1 6 11133 4 2 1 HEC C1C C -2.891 -4.396 2.011 1.00 . D A . 110 HEC C1C 1 1 6 11134 4 2 1 HEC C1D C -6.595 -6.584 2.414 1.00 . D A . 110 HEC C1D 1 1 6 11135 4 2 1 HEC C2A C -9.556 -2.405 -0.213 1.00 . D A . 110 HEC C2A 1 1 6 11136 4 2 1 HEC C2B C -3.881 -0.285 -0.093 1.00 . D A . 110 HEC C2B 1 1 6 11137 4 2 1 HEC C2C C -2.034 -5.401 2.595 1.00 . D A . 110 HEC C2C 1 1 6 11138 4 2 1 HEC C2D C -7.750 -7.403 2.696 1.00 . D A . 110 HEC C2D 1 1 6 11139 4 2 1 HEC C3A C -8.767 -1.372 -0.578 1.00 . D A . 110 HEC C3A 1 1 6 11140 4 2 1 HEC C3B C -2.817 -0.900 0.465 1.00 . D A . 110 HEC C3B 1 1 6 11141 4 2 1 HEC C3C C -2.821 -6.442 2.940 1.00 . D A . 110 HEC C3C 1 1 6 11142 4 2 1 HEC C3D C -8.826 -6.754 2.203 1.00 . D A . 110 HEC C3D 1 1 6 11143 4 2 1 HEC C4A C -7.429 -1.682 -0.133 1.00 . D A . 110 HEC C4A 1 1 6 11144 4 2 1 HEC C4B C -3.291 -2.146 1.021 1.00 . D A . 110 HEC C4B 1 1 6 11145 4 2 1 HEC C4C C -4.173 -6.092 2.573 1.00 . D A . 110 HEC C4C 1 1 6 11146 4 2 1 HEC C4D C -8.348 -5.527 1.611 1.00 . D A . 110 HEC C4D 1 1 6 11147 4 2 1 HEC CAA C -11.030 -2.568 -0.443 1.00 . D A . 110 HEC CAA 1 1 6 11148 4 2 1 HEC CAB C -1.396 -0.420 0.522 1.00 . D A . 110 HEC CAB 1 1 6 11149 4 2 1 HEC CAC C -2.413 -7.735 3.584 1.00 . D A . 110 HEC CAC 1 1 6 11150 4 2 1 HEC CAD C -10.263 -7.187 2.240 1.00 . D A . 110 HEC CAD 1 1 6 11151 4 2 1 HEC CBA C -11.901 -1.910 0.624 1.00 . D A . 110 HEC CBA 1 1 6 11152 4 2 1 HEC CBB C -1.252 1.043 0.932 1.00 . D A . 110 HEC CBB 1 1 6 11153 4 2 1 HEC CBC C -1.096 -7.658 4.351 1.00 . D A . 110 HEC CBC 1 1 6 11154 4 2 1 HEC CBD C -10.893 -7.366 0.862 1.00 . D A . 110 HEC CBD 1 1 6 11155 4 2 1 HEC CGA C -12.788 -2.936 1.316 1.00 . D A . 110 HEC CGA 1 1 6 11156 4 2 1 HEC CGD C -11.648 -8.684 0.772 1.00 . D A . 110 HEC CGD 1 1 6 11157 4 2 1 HEC CHA C -9.168 -4.569 0.987 1.00 . D A . 110 HEC CHA 1 1 6 11158 4 2 1 HEC CHB C -6.311 -0.850 -0.326 1.00 . D A . 110 HEC CHB 1 1 6 11159 4 2 1 HEC CHC C -2.480 -3.079 1.693 1.00 . D A . 110 HEC CHC 1 1 6 11160 4 2 1 HEC CHD C -5.293 -6.920 2.770 1.00 . D A . 110 HEC CHD 1 1 6 11161 4 2 1 HEC CMA C -9.161 -0.121 -1.309 1.00 . D A . 110 HEC CMA 1 1 6 11162 4 2 1 HEC CMB C -3.917 1.038 -0.801 1.00 . D A . 110 HEC CMB 1 1 6 11163 4 2 1 HEC CMC C -0.549 -5.268 2.767 1.00 . D A . 110 HEC CMC 1 1 6 11164 4 2 1 HEC CMD C -7.714 -8.724 3.408 1.00 . D A . 110 HEC CMD 1 1 6 11165 4 2 1 HEC FE FE -5.808 -3.865 1.263 1.00 . D A . 110 HEC FE 1 1 6 11166 4 2 1 HEC HAA1 H -11.300 -2.120 -1.400 1.00 . D A . 110 HEC HAA1 1 1 6 11167 4 2 1 HEC HAA2 H -11.281 -3.628 -0.454 1.00 . D A . 110 HEC HAA2 1 1 6 11168 4 2 1 HEC HAB H -0.840 -1.014 1.247 1.00 . D A . 110 HEC HAB 1 1 6 11169 4 2 1 HEC HAC H -3.180 -8.046 4.293 1.00 . D A . 110 HEC HAC 1 1 6 11170 4 2 1 HEC HAD1 H -10.341 -8.143 2.757 1.00 . D A . 110 HEC HAD1 1 1 6 11171 4 2 1 HEC HAD2 H -10.854 -6.439 2.769 1.00 . D A . 110 HEC HAD2 1 1 6 11172 4 2 1 HEC HBA1 H -11.264 -1.438 1.372 1.00 . D A . 110 HEC HBA1 1 1 6 11173 4 2 1 HEC HBA2 H -12.537 -1.156 0.160 1.00 . D A . 110 HEC HBA2 1 1 6 11174 4 2 1 HEC HBB1 H -1.047 1.649 0.050 1.00 . D A . 110 HEC HBB1 1 1 6 11175 4 2 1 HEC HBB2 H -2.176 1.382 1.400 1.00 . D A . 110 HEC HBB2 1 1 6 11176 4 2 1 HEC HBB3 H -0.428 1.142 1.640 1.00 . D A . 110 HEC HBB3 1 1 6 11177 4 2 1 HEC HBC1 H -0.263 -7.726 3.651 1.00 . D A . 110 HEC HBC1 1 1 6 11178 4 2 1 HEC HBC2 H -1.043 -6.711 4.888 1.00 . D A . 110 HEC HBC2 1 1 6 11179 4 2 1 HEC HBC3 H -1.041 -8.483 5.062 1.00 . D A . 110 HEC HBC3 1 1 6 11180 4 2 1 HEC HBD1 H -11.591 -6.551 0.673 1.00 . D A . 110 HEC HBD1 1 1 6 11181 4 2 1 HEC HBD2 H -10.112 -7.359 0.101 1.00 . D A . 110 HEC HBD2 1 1 6 11182 4 2 1 HEC HHA H -10.232 -4.791 0.913 1.00 . D A . 110 HEC HHA 1 1 6 11183 4 2 1 HEC HHB H -6.470 0.090 -0.854 1.00 . D A . 110 HEC HHB 1 1 6 11184 4 2 1 HEC HHC H -1.465 -2.772 1.947 1.00 . D A . 110 HEC HHC 1 1 6 11185 4 2 1 HEC HHD H -5.124 -7.891 3.235 1.00 . D A . 110 HEC HHD 1 1 6 11186 4 2 1 HEC HMA1 H -8.372 0.624 -1.204 1.00 . D A . 110 HEC HMA1 1 1 6 11187 4 2 1 HEC HMA2 H -9.309 -0.348 -2.364 1.00 . D A . 110 HEC HMA2 1 1 6 11188 4 2 1 HEC HMA3 H -10.087 0.269 -0.887 1.00 . D A . 110 HEC HMA3 1 1 6 11189 4 2 1 HEC HMB1 H -3.042 1.129 -1.445 1.00 . D A . 110 HEC HMB1 1 1 6 11190 4 2 1 HEC HMB2 H -4.821 1.102 -1.406 1.00 . D A . 110 HEC HMB2 1 1 6 11191 4 2 1 HEC HMB3 H -3.913 1.843 -0.067 1.00 . D A . 110 HEC HMB3 1 1 6 11192 4 2 1 HEC HMC1 H -0.316 -5.126 3.822 1.00 . D A . 110 HEC HMC1 1 1 6 11193 4 2 1 HEC HMC2 H -0.059 -6.173 2.406 1.00 . D A . 110 HEC HMC2 1 1 6 11194 4 2 1 HEC HMC3 H -0.192 -4.411 2.197 1.00 . D A . 110 HEC HMC3 1 1 6 11195 4 2 1 HEC HMD1 H -7.562 -9.523 2.683 1.00 . D A . 110 HEC HMD1 1 1 6 11196 4 2 1 HEC HMD2 H -6.895 -8.726 4.128 1.00 . D A . 110 HEC HMD2 1 1 6 11197 4 2 1 HEC HMD3 H -8.657 -8.881 3.930 1.00 . D A . 110 HEC HMD3 1 1 6 11198 4 2 1 HEC NA N -7.407 -2.910 0.505 1.00 . D A . 110 HEC NA 1 1 6 11199 4 2 1 HEC NB N -4.649 -2.286 0.798 1.00 . D A . 110 HEC NB 1 1 6 11200 4 2 1 HEC NC N -4.204 -4.831 2.002 1.00 . D A . 110 HEC NC 1 1 6 11201 4 2 1 HEC ND N -6.973 -5.433 1.746 1.00 . D A . 110 HEC ND 1 1 6 11202 4 2 1 HEC O1A O -14.023 -2.752 1.253 1.00 . D A . 110 HEC O1A 1 1 6 11203 4 2 1 HEC O1D O -11.151 -9.664 1.369 1.00 . D A . 110 HEC O1D 1 1 6 11204 4 2 1 HEC O2A O -12.214 -3.884 1.893 1.00 . D A . 110 HEC O2A 1 1 6 11205 4 2 1 HEC O2D O -12.707 -8.688 0.108 1.00 . D A . 110 HEC O2D 1 1 6 11206 5 2 1 HEC C1A C -0.042 4.033 -9.172 1.00 . E A . 111 HEC C1A 1 1 6 11207 5 2 1 HEC C1B C -1.355 0.595 -11.438 1.00 . E A . 111 HEC C1B 1 1 6 11208 5 2 1 HEC C1C C -3.183 -1.054 -7.845 1.00 . E A . 111 HEC C1C 1 1 6 11209 5 2 1 HEC C1D C -1.883 2.411 -5.615 1.00 . E A . 111 HEC C1D 1 1 6 11210 5 2 1 HEC C2A C 0.575 4.735 -10.272 1.00 . E A . 111 HEC C2A 1 1 6 11211 5 2 1 HEC C2B C -1.512 -0.565 -12.283 1.00 . E A . 111 HEC C2B 1 1 6 11212 5 2 1 HEC C2C C -3.927 -1.676 -6.775 1.00 . E A . 111 HEC C2C 1 1 6 11213 5 2 1 HEC C2D C -1.393 3.413 -4.697 1.00 . E A . 111 HEC C2D 1 1 6 11214 5 2 1 HEC C3A C 0.382 3.986 -11.379 1.00 . E A . 111 HEC C3A 1 1 6 11215 5 2 1 HEC C3B C -2.131 -1.512 -11.547 1.00 . E A . 111 HEC C3B 1 1 6 11216 5 2 1 HEC C3C C -3.825 -0.869 -5.698 1.00 . E A . 111 HEC C3C 1 1 6 11217 5 2 1 HEC C3D C -0.665 4.290 -5.419 1.00 . E A . 111 HEC C3D 1 1 6 11218 5 2 1 HEC C4A C -0.357 2.813 -10.975 1.00 . E A . 111 HEC C4A 1 1 6 11219 5 2 1 HEC C4B C -2.363 -0.947 -10.238 1.00 . E A . 111 HEC C4B 1 1 6 11220 5 2 1 HEC C4C C -3.017 0.262 -6.090 1.00 . E A . 111 HEC C4C 1 1 6 11221 5 2 1 HEC C4D C -0.697 3.841 -6.791 1.00 . E A . 111 HEC C4D 1 1 6 11222 5 2 1 HEC CAA C 1.289 6.051 -10.160 1.00 . E A . 111 HEC CAA 1 1 6 11223 5 2 1 HEC CAB C -2.523 -2.899 -11.965 1.00 . E A . 111 HEC CAB 1 1 6 11224 5 2 1 HEC CAC C -4.420 -1.067 -4.334 1.00 . E A . 111 HEC CAC 1 1 6 11225 5 2 1 HEC CAD C 0.058 5.513 -4.933 1.00 . E A . 111 HEC CAD 1 1 6 11226 5 2 1 HEC CBA C 2.692 6.049 -10.759 1.00 . E A . 111 HEC CBA 1 1 6 11227 5 2 1 HEC CBB C -1.455 -3.954 -11.693 1.00 . E A . 111 HEC CBB 1 1 6 11228 5 2 1 HEC CBC C -4.270 -2.486 -3.793 1.00 . E A . 111 HEC CBC 1 1 6 11229 5 2 1 HEC CBD C -0.857 6.696 -4.633 1.00 . E A . 111 HEC CBD 1 1 6 11230 5 2 1 HEC CGA C 3.135 7.460 -11.121 1.00 . E A . 111 HEC CGA 1 1 6 11231 5 2 1 HEC CGD C -0.075 8.002 -4.610 1.00 . E A . 111 HEC CGD 1 1 6 11232 5 2 1 HEC CHA C -0.053 4.492 -7.859 1.00 . E A . 111 HEC CHA 1 1 6 11233 5 2 1 HEC CHB C -0.756 1.783 -11.845 1.00 . E A . 111 HEC CHB 1 1 6 11234 5 2 1 HEC CHC C -2.990 -1.625 -9.176 1.00 . E A . 111 HEC CHC 1 1 6 11235 5 2 1 HEC CHD C -2.678 1.332 -5.243 1.00 . E A . 111 HEC CHD 1 1 6 11236 5 2 1 HEC CMA C 0.831 4.277 -12.781 1.00 . E A . 111 HEC CMA 1 1 6 11237 5 2 1 HEC CMB C -1.057 -0.656 -13.711 1.00 . E A . 111 HEC CMB 1 1 6 11238 5 2 1 HEC CMC C -4.662 -2.980 -6.886 1.00 . E A . 111 HEC CMC 1 1 6 11239 5 2 1 HEC CMD C -1.667 3.433 -3.222 1.00 . E A . 111 HEC CMD 1 1 6 11240 5 2 1 HEC FE FE -1.643 1.506 -8.528 1.00 . E A . 111 HEC FE 1 1 6 11241 5 2 1 HEC HAA1 H 0.717 6.819 -10.680 1.00 . E A . 111 HEC HAA1 1 1 6 11242 5 2 1 HEC HAA2 H 1.388 6.321 -9.109 1.00 . E A . 111 HEC HAA2 1 1 6 11243 5 2 1 HEC HAB H -3.420 -3.202 -11.424 1.00 . E A . 111 HEC HAB 1 1 6 11244 5 2 1 HEC HAC H -3.933 -0.399 -3.625 1.00 . E A . 111 HEC HAC 1 1 6 11245 5 2 1 HEC HAD1 H 0.591 5.277 -4.011 1.00 . E A . 111 HEC HAD1 1 1 6 11246 5 2 1 HEC HAD2 H 0.769 5.840 -5.691 1.00 . E A . 111 HEC HAD2 1 1 6 11247 5 2 1 HEC HBA1 H 3.396 5.638 -10.036 1.00 . E A . 111 HEC HBA1 1 1 6 11248 5 2 1 HEC HBA2 H 2.701 5.439 -11.662 1.00 . E A . 111 HEC HBA2 1 1 6 11249 5 2 1 HEC HBB1 H -1.682 -4.856 -12.263 1.00 . E A . 111 HEC HBB1 1 1 6 11250 5 2 1 HEC HBB2 H -0.481 -3.570 -11.993 1.00 . E A . 111 HEC HBB2 1 1 6 11251 5 2 1 HEC HBB3 H -1.441 -4.191 -10.629 1.00 . E A . 111 HEC HBB3 1 1 6 11252 5 2 1 HEC HBC1 H -4.214 -2.455 -2.705 1.00 . E A . 111 HEC HBC1 1 1 6 11253 5 2 1 HEC HBC2 H -5.130 -3.083 -4.095 1.00 . E A . 111 HEC HBC2 1 1 6 11254 5 2 1 HEC HBC3 H -3.359 -2.933 -4.191 1.00 . E A . 111 HEC HBC3 1 1 6 11255 5 2 1 HEC HBD1 H -1.627 6.765 -5.402 1.00 . E A . 111 HEC HBD1 1 1 6 11256 5 2 1 HEC HBD2 H -1.327 6.555 -3.660 1.00 . E A . 111 HEC HBD2 1 1 6 11257 5 2 1 HEC HHA H 0.473 5.421 -7.638 1.00 . E A . 111 HEC HHA 1 1 6 11258 5 2 1 HEC HHB H -0.582 1.929 -12.911 1.00 . E A . 111 HEC HHB 1 1 6 11259 5 2 1 HEC HHC H -3.339 -2.640 -9.364 1.00 . E A . 111 HEC HHC 1 1 6 11260 5 2 1 HEC HHD H -3.068 1.310 -4.225 1.00 . E A . 111 HEC HHD 1 1 6 11261 5 2 1 HEC HMA1 H 0.675 5.333 -13.001 1.00 . E A . 111 HEC HMA1 1 1 6 11262 5 2 1 HEC HMA2 H 1.890 4.038 -12.881 1.00 . E A . 111 HEC HMA2 1 1 6 11263 5 2 1 HEC HMA3 H 0.255 3.672 -13.481 1.00 . E A . 111 HEC HMA3 1 1 6 11264 5 2 1 HEC HMB1 H -0.705 -1.668 -13.916 1.00 . E A . 111 HEC HMB1 1 1 6 11265 5 2 1 HEC HMB2 H -1.889 -0.420 -14.373 1.00 . E A . 111 HEC HMB2 1 1 6 11266 5 2 1 HEC HMB3 H -0.245 0.052 -13.879 1.00 . E A . 111 HEC HMB3 1 1 6 11267 5 2 1 HEC HMC1 H -4.527 -3.389 -7.887 1.00 . E A . 111 HEC HMC1 1 1 6 11268 5 2 1 HEC HMC2 H -4.269 -3.683 -6.151 1.00 . E A . 111 HEC HMC2 1 1 6 11269 5 2 1 HEC HMC3 H -5.723 -2.816 -6.700 1.00 . E A . 111 HEC HMC3 1 1 6 11270 5 2 1 HEC HMD1 H -2.612 2.928 -3.021 1.00 . E A . 111 HEC HMD1 1 1 6 11271 5 2 1 HEC HMD2 H -0.862 2.921 -2.695 1.00 . E A . 111 HEC HMD2 1 1 6 11272 5 2 1 HEC HMD3 H -1.727 4.466 -2.878 1.00 . E A . 111 HEC HMD3 1 1 6 11273 5 2 1 HEC NA N -0.613 2.852 -9.615 1.00 . E A . 111 HEC NA 1 1 6 11274 5 2 1 HEC NB N -1.881 0.349 -10.182 1.00 . E A . 111 HEC NB 1 1 6 11275 5 2 1 HEC NC N -2.628 0.138 -7.413 1.00 . E A . 111 HEC NC 1 1 6 11276 5 2 1 HEC ND N -1.450 2.685 -6.900 1.00 . E A . 111 HEC ND 1 1 6 11277 5 2 1 HEC O1A O 2.516 8.028 -12.047 1.00 . E A . 111 HEC O1A 1 1 6 11278 5 2 1 HEC O1D O -0.175 8.741 -5.613 1.00 . E A . 111 HEC O1D 1 1 6 11279 5 2 1 HEC O2A O 4.082 7.943 -10.465 1.00 . E A . 111 HEC O2A 1 1 6 11280 5 2 1 HEC O2D O 0.609 8.236 -3.590 1.00 . E A . 111 HEC O2D 1 1 7 11281 1 1 1 ALA C C -1.444 3.558 21.037 1.00 . A A . 1 ALA C 1 1 7 11282 1 1 1 ALA CA C -0.250 2.834 21.662 1.00 . A A . 1 ALA CA 1 1 7 11283 1 1 1 ALA CB C 0.411 1.853 20.691 1.00 . A A . 1 ALA CB 1 1 7 11284 1 1 1 ALA H1 H -1.068 1.219 22.580 1.00 . A A . 1 ALA H1 1 1 7 11285 1 1 1 ALA H2 H 0.100 1.983 23.472 1.00 . A A . 1 ALA H2 1 1 7 11286 1 1 1 ALA HA H 0.490 3.572 21.973 1.00 . A A . 1 ALA HA 1 1 7 11287 1 1 1 ALA HB1 H 0.227 0.832 21.025 1.00 . A A . 1 ALA HB1 1 1 7 11288 1 1 1 ALA HB2 H -0.008 1.990 19.694 1.00 . A A . 1 ALA HB2 1 1 7 11289 1 1 1 ALA HB3 H 1.485 2.038 20.663 1.00 . A A . 1 ALA HB3 1 1 7 11290 1 1 1 ALA N N -0.689 2.120 22.849 1.00 . A A . 1 ALA N 1 1 7 11291 1 1 1 ALA O O -2.585 3.348 21.445 1.00 . A A . 1 ALA O 1 1 7 11292 1 1 2 PRO C C -2.953 4.280 18.384 1.00 . A A . 2 PRO C 1 1 7 11293 1 1 2 PRO CA C -2.166 5.174 19.344 1.00 . A A . 2 PRO CA 1 1 7 11294 1 1 2 PRO CB C -1.427 6.299 18.638 1.00 . A A . 2 PRO CB 1 1 7 11295 1 1 2 PRO CD C 0.208 4.691 19.520 1.00 . A A . 2 PRO CD 1 1 7 11296 1 1 2 PRO CG C 0.028 5.865 18.571 1.00 . A A . 2 PRO CG 1 1 7 11297 1 1 2 PRO HA H -2.833 5.524 20.001 1.00 . A A . 2 PRO HA 1 1 7 11298 1 1 2 PRO HB2 H -1.832 6.465 17.640 1.00 . A A . 2 PRO HB2 1 1 7 11299 1 1 2 PRO HB3 H -1.530 7.237 19.184 1.00 . A A . 2 PRO HB3 1 1 7 11300 1 1 2 PRO HD2 H 0.620 3.824 19.003 1.00 . A A . 2 PRO HD2 1 1 7 11301 1 1 2 PRO HD3 H 0.897 4.937 20.328 1.00 . A A . 2 PRO HD3 1 1 7 11302 1 1 2 PRO HG2 H 0.294 5.578 17.553 1.00 . A A . 2 PRO HG2 1 1 7 11303 1 1 2 PRO HG3 H 0.685 6.688 18.852 1.00 . A A . 2 PRO HG3 1 1 7 11304 1 1 2 PRO N N -1.132 4.418 20.030 1.00 . A A . 2 PRO N 1 1 7 11305 1 1 2 PRO O O -2.388 3.384 17.760 1.00 . A A . 2 PRO O 1 1 7 11306 1 1 3 LYS C C -4.943 4.271 15.982 1.00 . A A . 3 LYS C 1 1 7 11307 1 1 3 LYS CA C -5.117 3.787 17.423 1.00 . A A . 3 LYS CA 1 1 7 11308 1 1 3 LYS CB C -6.562 3.847 17.920 1.00 . A A . 3 LYS CB 1 1 7 11309 1 1 3 LYS CD C -8.202 3.005 19.642 1.00 . A A . 3 LYS CD 1 1 7 11310 1 1 3 LYS CE C -8.879 1.672 19.314 1.00 . A A . 3 LYS CE 1 1 7 11311 1 1 3 LYS CG C -6.742 3.005 19.185 1.00 . A A . 3 LYS CG 1 1 7 11312 1 1 3 LYS H H -4.698 5.286 18.807 1.00 . A A . 3 LYS H 1 1 7 11313 1 1 3 LYS HA H -4.799 2.746 17.478 1.00 . A A . 3 LYS HA 1 1 7 11314 1 1 3 LYS HB2 H -6.839 4.881 18.125 1.00 . A A . 3 LYS HB2 1 1 7 11315 1 1 3 LYS HB3 H -7.234 3.487 17.141 1.00 . A A . 3 LYS HB3 1 1 7 11316 1 1 3 LYS HD2 H -8.252 3.188 20.715 1.00 . A A . 3 LYS HD2 1 1 7 11317 1 1 3 LYS HD3 H -8.739 3.819 19.154 1.00 . A A . 3 LYS HD3 1 1 7 11318 1 1 3 LYS HE2 H -8.287 1.128 18.578 1.00 . A A . 3 LYS HE2 1 1 7 11319 1 1 3 LYS HE3 H -8.924 1.051 20.209 1.00 . A A . 3 LYS HE3 1 1 7 11320 1 1 3 LYS HG2 H -6.416 1.982 18.995 1.00 . A A . 3 LYS HG2 1 1 7 11321 1 1 3 LYS HG3 H -6.109 3.398 19.981 1.00 . A A . 3 LYS HG3 1 1 7 11322 1 1 3 LYS HZ1 H -10.896 2.148 19.527 1.00 . A A . 3 LYS HZ1 1 1 7 11323 1 1 3 LYS HZ2 H -10.270 2.649 18.109 1.00 . A A . 3 LYS HZ2 1 1 7 11324 1 1 3 LYS N N -4.246 4.556 18.296 1.00 . A A . 3 LYS N 1 1 7 11325 1 1 3 LYS NZ N -10.244 1.899 18.791 1.00 . A A . 3 LYS NZ 1 1 7 11326 1 1 3 LYS O O -4.175 5.196 15.722 1.00 . A A . 3 LYS O 1 1 7 11327 1 1 4 ALA C C -6.147 5.393 13.481 1.00 . A A . 4 ALA C 1 1 7 11328 1 1 4 ALA CA C -5.603 3.976 13.674 1.00 . A A . 4 ALA CA 1 1 7 11329 1 1 4 ALA CB C -6.371 2.940 12.852 1.00 . A A . 4 ALA CB 1 1 7 11330 1 1 4 ALA H H -6.290 2.872 15.301 1.00 . A A . 4 ALA H 1 1 7 11331 1 1 4 ALA HA H -4.555 3.954 13.374 1.00 . A A . 4 ALA HA 1 1 7 11332 1 1 4 ALA HB1 H -6.961 2.311 13.519 1.00 . A A . 4 ALA HB1 1 1 7 11333 1 1 4 ALA HB2 H -7.034 3.449 12.153 1.00 . A A . 4 ALA HB2 1 1 7 11334 1 1 4 ALA HB3 H -5.666 2.320 12.297 1.00 . A A . 4 ALA HB3 1 1 7 11335 1 1 4 ALA N N -5.668 3.624 15.082 1.00 . A A . 4 ALA N 1 1 7 11336 1 1 4 ALA O O -6.972 5.857 14.267 1.00 . A A . 4 ALA O 1 1 7 11337 1 1 5 PRO C C -7.485 7.421 11.498 1.00 . A A . 5 PRO C 1 1 7 11338 1 1 5 PRO CA C -6.077 7.413 12.099 1.00 . A A . 5 PRO CA 1 1 7 11339 1 1 5 PRO CB C -5.023 7.953 11.147 1.00 . A A . 5 PRO CB 1 1 7 11340 1 1 5 PRO CD C -4.672 5.540 11.452 1.00 . A A . 5 PRO CD 1 1 7 11341 1 1 5 PRO CG C -4.300 6.737 10.591 1.00 . A A . 5 PRO CG 1 1 7 11342 1 1 5 PRO HA H -6.135 7.956 12.936 1.00 . A A . 5 PRO HA 1 1 7 11343 1 1 5 PRO HB2 H -5.479 8.535 10.347 1.00 . A A . 5 PRO HB2 1 1 7 11344 1 1 5 PRO HB3 H -4.330 8.615 11.667 1.00 . A A . 5 PRO HB3 1 1 7 11345 1 1 5 PRO HD2 H -5.092 4.735 10.851 1.00 . A A . 5 PRO HD2 1 1 7 11346 1 1 5 PRO HD3 H -3.799 5.134 11.963 1.00 . A A . 5 PRO HD3 1 1 7 11347 1 1 5 PRO HG2 H -4.586 6.564 9.554 1.00 . A A . 5 PRO HG2 1 1 7 11348 1 1 5 PRO HG3 H -3.222 6.895 10.603 1.00 . A A . 5 PRO HG3 1 1 7 11349 1 1 5 PRO N N -5.650 6.058 12.404 1.00 . A A . 5 PRO N 1 1 7 11350 1 1 5 PRO O O -8.060 6.365 11.241 1.00 . A A . 5 PRO O 1 1 7 11351 1 1 6 ALA C C -9.402 8.041 9.391 1.00 . A A . 6 ALA C 1 1 7 11352 1 1 6 ALA CA C -9.327 8.785 10.726 1.00 . A A . 6 ALA CA 1 1 7 11353 1 1 6 ALA CB C -9.645 10.275 10.582 1.00 . A A . 6 ALA CB 1 1 7 11354 1 1 6 ALA H H -7.523 9.479 11.503 1.00 . A A . 6 ALA H 1 1 7 11355 1 1 6 ALA HA H -10.039 8.340 11.421 1.00 . A A . 6 ALA HA 1 1 7 11356 1 1 6 ALA HB1 H -8.990 10.851 11.236 1.00 . A A . 6 ALA HB1 1 1 7 11357 1 1 6 ALA HB2 H -9.487 10.582 9.548 1.00 . A A . 6 ALA HB2 1 1 7 11358 1 1 6 ALA HB3 H -10.684 10.453 10.859 1.00 . A A . 6 ALA HB3 1 1 7 11359 1 1 6 ALA N N -7.998 8.625 11.292 1.00 . A A . 6 ALA N 1 1 7 11360 1 1 6 ALA O O -8.375 7.752 8.780 1.00 . A A . 6 ALA O 1 1 7 11361 1 1 7 ASP C C -10.762 8.040 6.566 1.00 . A A . 7 ASP C 1 1 7 11362 1 1 7 ASP CA C -10.849 7.048 7.728 1.00 . A A . 7 ASP CA 1 1 7 11363 1 1 7 ASP CB C -12.237 6.404 7.697 1.00 . A A . 7 ASP CB 1 1 7 11364 1 1 7 ASP CG C -13.406 7.390 7.641 1.00 . A A . 7 ASP CG 1 1 7 11365 1 1 7 ASP H H -11.458 7.992 9.483 1.00 . A A . 7 ASP H 1 1 7 11366 1 1 7 ASP HA H -10.070 6.287 7.686 1.00 . A A . 7 ASP HA 1 1 7 11367 1 1 7 ASP HB2 H -12.296 5.745 6.832 1.00 . A A . 7 ASP HB2 1 1 7 11368 1 1 7 ASP HB3 H -12.351 5.779 8.583 1.00 . A A . 7 ASP HB3 1 1 7 11369 1 1 7 ASP N N -10.627 7.753 8.979 1.00 . A A . 7 ASP N 1 1 7 11370 1 1 7 ASP O O -10.660 9.246 6.782 1.00 . A A . 7 ASP O 1 1 7 11371 1 1 7 ASP OD1 O -13.121 8.602 7.531 1.00 . A A . 7 ASP OD1 1 1 7 11372 1 1 7 ASP OD2 O -14.558 6.909 7.710 1.00 . A A . 7 ASP OD2 1 1 7 11373 1 1 8 GLY C C -9.310 8.830 3.938 1.00 . A A . 8 GLY C 1 1 7 11374 1 1 8 GLY CA C -10.733 8.316 4.164 1.00 . A A . 8 GLY CA 1 1 7 11375 1 1 8 GLY H H -10.890 6.512 5.193 1.00 . A A . 8 GLY H 1 1 7 11376 1 1 8 GLY HA2 H -11.055 7.735 3.299 1.00 . A A . 8 GLY HA2 1 1 7 11377 1 1 8 GLY HA3 H -11.418 9.159 4.255 1.00 . A A . 8 GLY HA3 1 1 7 11378 1 1 8 GLY N N -10.806 7.494 5.360 1.00 . A A . 8 GLY N 1 1 7 11379 1 1 8 GLY O O -9.117 9.902 3.366 1.00 . A A . 8 GLY O 1 1 7 11380 1 1 9 LEU C C -6.518 8.188 2.804 1.00 . A A . 9 LEU C 1 1 7 11381 1 1 9 LEU CA C -6.950 8.405 4.256 1.00 . A A . 9 LEU CA 1 1 7 11382 1 1 9 LEU CB C -6.093 7.648 5.272 1.00 . A A . 9 LEU CB 1 1 7 11383 1 1 9 LEU CD1 C -4.108 6.414 4.327 1.00 . A A . 9 LEU CD1 1 1 7 11384 1 1 9 LEU CD2 C -4.177 8.949 4.276 1.00 . A A . 9 LEU CD2 1 1 7 11385 1 1 9 LEU CG C -4.582 7.684 5.035 1.00 . A A . 9 LEU CG 1 1 7 11386 1 1 9 LEU H H -8.515 7.172 4.864 1.00 . A A . 9 LEU H 1 1 7 11387 1 1 9 LEU HA H -6.862 9.467 4.487 1.00 . A A . 9 LEU HA 1 1 7 11388 1 1 9 LEU HB2 H -6.295 8.055 6.263 1.00 . A A . 9 LEU HB2 1 1 7 11389 1 1 9 LEU HB3 H -6.414 6.606 5.284 1.00 . A A . 9 LEU HB3 1 1 7 11390 1 1 9 LEU HD11 H -4.684 5.561 4.685 1.00 . A A . 9 LEU HD11 1 1 7 11391 1 1 9 LEU HD12 H -4.251 6.523 3.251 1.00 . A A . 9 LEU HD12 1 1 7 11392 1 1 9 LEU HD13 H -3.051 6.253 4.538 1.00 . A A . 9 LEU HD13 1 1 7 11393 1 1 9 LEU HD21 H -4.879 9.751 4.505 1.00 . A A . 9 LEU HD21 1 1 7 11394 1 1 9 LEU HD22 H -3.173 9.248 4.578 1.00 . A A . 9 LEU HD22 1 1 7 11395 1 1 9 LEU HD23 H -4.189 8.750 3.205 1.00 . A A . 9 LEU HD23 1 1 7 11396 1 1 9 LEU HG H -4.085 7.717 6.004 1.00 . A A . 9 LEU HG 1 1 7 11397 1 1 9 LEU N N -8.350 8.042 4.400 1.00 . A A . 9 LEU N 1 1 7 11398 1 1 9 LEU O O -6.203 7.067 2.408 1.00 . A A . 9 LEU O 1 1 7 11399 1 1 10 LYS C C -4.699 9.744 0.502 1.00 . A A . 10 LYS C 1 1 7 11400 1 1 10 LYS CA C -6.129 9.221 0.652 1.00 . A A . 10 LYS CA 1 1 7 11401 1 1 10 LYS CB C -7.149 9.960 -0.217 1.00 . A A . 10 LYS CB 1 1 7 11402 1 1 10 LYS CD C -7.528 11.058 -2.456 1.00 . A A . 10 LYS CD 1 1 7 11403 1 1 10 LYS CE C -6.780 12.355 -2.771 1.00 . A A . 10 LYS CE 1 1 7 11404 1 1 10 LYS CG C -6.646 10.097 -1.656 1.00 . A A . 10 LYS CG 1 1 7 11405 1 1 10 LYS H H -6.775 10.186 2.382 1.00 . A A . 10 LYS H 1 1 7 11406 1 1 10 LYS HA H -6.148 8.174 0.350 1.00 . A A . 10 LYS HA 1 1 7 11407 1 1 10 LYS HB2 H -8.097 9.422 -0.210 1.00 . A A . 10 LYS HB2 1 1 7 11408 1 1 10 LYS HB3 H -7.340 10.948 0.201 1.00 . A A . 10 LYS HB3 1 1 7 11409 1 1 10 LYS HD2 H -7.843 10.581 -3.384 1.00 . A A . 10 LYS HD2 1 1 7 11410 1 1 10 LYS HD3 H -8.432 11.283 -1.890 1.00 . A A . 10 LYS HD3 1 1 7 11411 1 1 10 LYS HE2 H -5.902 12.441 -2.131 1.00 . A A . 10 LYS HE2 1 1 7 11412 1 1 10 LYS HE3 H -6.424 12.335 -3.801 1.00 . A A . 10 LYS HE3 1 1 7 11413 1 1 10 LYS HG2 H -5.618 10.460 -1.652 1.00 . A A . 10 LYS HG2 1 1 7 11414 1 1 10 LYS HG3 H -6.637 9.120 -2.137 1.00 . A A . 10 LYS HG3 1 1 7 11415 1 1 10 LYS HZ1 H -8.297 13.662 -3.350 1.00 . A A . 10 LYS HZ1 1 1 7 11416 1 1 10 LYS HZ2 H -8.239 13.428 -1.740 1.00 . A A . 10 LYS HZ2 1 1 7 11417 1 1 10 LYS N N -6.517 9.278 2.051 1.00 . A A . 10 LYS N 1 1 7 11418 1 1 10 LYS NZ N -7.665 13.525 -2.569 1.00 . A A . 10 LYS NZ 1 1 7 11419 1 1 10 LYS O O -4.307 10.692 1.180 1.00 . A A . 10 LYS O 1 1 7 11420 1 1 11 MET C C -2.364 9.830 -2.115 1.00 . A A . 11 MET C 1 1 7 11421 1 1 11 MET CA C -2.582 9.491 -0.639 1.00 . A A . 11 MET CA 1 1 7 11422 1 1 11 MET CB C -1.648 8.348 -0.235 1.00 . A A . 11 MET CB 1 1 7 11423 1 1 11 MET CE C -0.578 5.003 0.098 1.00 . A A . 11 MET CE 1 1 7 11424 1 1 11 MET CG C -1.971 7.074 -1.019 1.00 . A A . 11 MET CG 1 1 7 11425 1 1 11 MET H H -4.287 8.333 -0.939 1.00 . A A . 11 MET H 1 1 7 11426 1 1 11 MET HA H -2.412 10.377 -0.026 1.00 . A A . 11 MET HA 1 1 7 11427 1 1 11 MET HB2 H -0.613 8.637 -0.415 1.00 . A A . 11 MET HB2 1 1 7 11428 1 1 11 MET HB3 H -1.744 8.155 0.834 1.00 . A A . 11 MET HB3 1 1 7 11429 1 1 11 MET HE1 H 0.158 5.792 -0.052 1.00 . A A . 11 MET HE1 1 1 7 11430 1 1 11 MET HE2 H -0.391 4.509 1.052 1.00 . A A . 11 MET HE2 1 1 7 11431 1 1 11 MET HE3 H -0.500 4.275 -0.709 1.00 . A A . 11 MET HE3 1 1 7 11432 1 1 11 MET HG2 H -2.867 7.225 -1.621 1.00 . A A . 11 MET HG2 1 1 7 11433 1 1 11 MET HG3 H -1.158 6.845 -1.708 1.00 . A A . 11 MET HG3 1 1 7 11434 1 1 11 MET N N -3.960 9.103 -0.391 1.00 . A A . 11 MET N 1 1 7 11435 1 1 11 MET O O -2.340 8.940 -2.963 1.00 . A A . 11 MET O 1 1 7 11436 1 1 11 MET SD S -2.217 5.710 0.106 1.00 . A A . 11 MET SD 1 1 7 11437 1 1 12 GLU C C -0.535 11.995 -3.932 1.00 . A A . 12 GLU C 1 1 7 11438 1 1 12 GLU CA C -1.997 11.589 -3.734 1.00 . A A . 12 GLU CA 1 1 7 11439 1 1 12 GLU CB C -2.938 12.748 -4.069 1.00 . A A . 12 GLU CB 1 1 7 11440 1 1 12 GLU CD C -1.862 14.007 -5.971 1.00 . A A . 12 GLU CD 1 1 7 11441 1 1 12 GLU CG C -2.961 13.018 -5.575 1.00 . A A . 12 GLU CG 1 1 7 11442 1 1 12 GLU H H -2.232 11.838 -1.679 1.00 . A A . 12 GLU H 1 1 7 11443 1 1 12 GLU HA H -2.235 10.739 -4.374 1.00 . A A . 12 GLU HA 1 1 7 11444 1 1 12 GLU HB2 H -3.945 12.515 -3.723 1.00 . A A . 12 GLU HB2 1 1 7 11445 1 1 12 GLU HB3 H -2.618 13.645 -3.540 1.00 . A A . 12 GLU HB3 1 1 7 11446 1 1 12 GLU HG2 H -2.825 12.082 -6.118 1.00 . A A . 12 GLU HG2 1 1 7 11447 1 1 12 GLU HG3 H -3.934 13.415 -5.863 1.00 . A A . 12 GLU HG3 1 1 7 11448 1 1 12 GLU N N -2.211 11.120 -2.376 1.00 . A A . 12 GLU N 1 1 7 11449 1 1 12 GLU O O -0.235 13.170 -4.132 1.00 . A A . 12 GLU O 1 1 7 11450 1 1 12 GLU OE1 O -1.727 15.022 -5.254 1.00 . A A . 12 GLU OE1 1 1 7 11451 1 1 12 GLU OE2 O -1.183 13.726 -6.982 1.00 . A A . 12 GLU OE2 1 1 7 11452 1 1 13 ALA C C 2.137 11.026 -5.504 1.00 . A A . 13 ALA C 1 1 7 11453 1 1 13 ALA CA C 1.759 11.237 -4.036 1.00 . A A . 13 ALA CA 1 1 7 11454 1 1 13 ALA CB C 2.546 10.322 -3.095 1.00 . A A . 13 ALA CB 1 1 7 11455 1 1 13 ALA H H 0.084 10.045 -3.704 1.00 . A A . 13 ALA H 1 1 7 11456 1 1 13 ALA HA H 1.957 12.274 -3.764 1.00 . A A . 13 ALA HA 1 1 7 11457 1 1 13 ALA HB1 H 1.851 9.709 -2.520 1.00 . A A . 13 ALA HB1 1 1 7 11458 1 1 13 ALA HB2 H 3.202 9.677 -3.680 1.00 . A A . 13 ALA HB2 1 1 7 11459 1 1 13 ALA HB3 H 3.144 10.929 -2.415 1.00 . A A . 13 ALA HB3 1 1 7 11460 1 1 13 ALA N N 0.336 10.998 -3.868 1.00 . A A . 13 ALA N 1 1 7 11461 1 1 13 ALA O O 3.229 11.402 -5.928 1.00 . A A . 13 ALA O 1 1 7 11462 1 1 14 THR C C 0.226 10.611 -8.475 1.00 . A A . 14 THR C 1 1 7 11463 1 1 14 THR CA C 1.434 10.161 -7.651 1.00 . A A . 14 THR CA 1 1 7 11464 1 1 14 THR CB C 1.758 8.674 -7.807 1.00 . A A . 14 THR CB 1 1 7 11465 1 1 14 THR CG2 C 2.921 8.231 -6.918 1.00 . A A . 14 THR CG2 1 1 7 11466 1 1 14 THR H H 0.326 10.125 -5.887 1.00 . A A . 14 THR H 1 1 7 11467 1 1 14 THR HA H 2.286 10.756 -7.982 1.00 . A A . 14 THR HA 1 1 7 11468 1 1 14 THR HB H 1.948 8.425 -8.851 1.00 . A A . 14 THR HB 1 1 7 11469 1 1 14 THR HG1 H -0.212 8.505 -7.492 1.00 . A A . 14 THR HG1 1 1 7 11470 1 1 14 THR HG21 H 3.273 9.079 -6.330 1.00 . A A . 14 THR HG21 1 1 7 11471 1 1 14 THR HG22 H 2.586 7.439 -6.249 1.00 . A A . 14 THR HG22 1 1 7 11472 1 1 14 THR HG23 H 3.734 7.860 -7.542 1.00 . A A . 14 THR HG23 1 1 7 11473 1 1 14 THR N N 1.212 10.427 -6.240 1.00 . A A . 14 THR N 1 1 7 11474 1 1 14 THR O O -0.766 11.084 -7.922 1.00 . A A . 14 THR O 1 1 7 11475 1 1 14 THR OG1 O 0.625 8.012 -7.251 1.00 . A A . 14 THR OG1 1 1 7 11476 1 1 15 LYS C C -1.952 9.964 -10.414 1.00 . A A . 15 LYS C 1 1 7 11477 1 1 15 LYS CA C -0.721 10.830 -10.689 1.00 . A A . 15 LYS CA 1 1 7 11478 1 1 15 LYS CB C -0.241 10.772 -12.141 1.00 . A A . 15 LYS CB 1 1 7 11479 1 1 15 LYS CD C -2.116 10.362 -13.777 1.00 . A A . 15 LYS CD 1 1 7 11480 1 1 15 LYS CE C -2.484 10.799 -15.196 1.00 . A A . 15 LYS CE 1 1 7 11481 1 1 15 LYS CG C -1.258 11.421 -13.082 1.00 . A A . 15 LYS CG 1 1 7 11482 1 1 15 LYS H H 1.159 10.061 -10.226 1.00 . A A . 15 LYS H 1 1 7 11483 1 1 15 LYS HA H -0.974 11.868 -10.475 1.00 . A A . 15 LYS HA 1 1 7 11484 1 1 15 LYS HB2 H 0.720 11.280 -12.231 1.00 . A A . 15 LYS HB2 1 1 7 11485 1 1 15 LYS HB3 H -0.080 9.734 -12.433 1.00 . A A . 15 LYS HB3 1 1 7 11486 1 1 15 LYS HD2 H -1.575 9.416 -13.813 1.00 . A A . 15 LYS HD2 1 1 7 11487 1 1 15 LYS HD3 H -3.024 10.188 -13.199 1.00 . A A . 15 LYS HD3 1 1 7 11488 1 1 15 LYS HE2 H -3.563 10.922 -15.277 1.00 . A A . 15 LYS HE2 1 1 7 11489 1 1 15 LYS HE3 H -2.036 11.769 -15.411 1.00 . A A . 15 LYS HE3 1 1 7 11490 1 1 15 LYS HG2 H -1.898 12.100 -12.518 1.00 . A A . 15 LYS HG2 1 1 7 11491 1 1 15 LYS HG3 H -0.737 12.020 -13.829 1.00 . A A . 15 LYS HG3 1 1 7 11492 1 1 15 LYS HZ1 H -2.381 8.875 -15.988 1.00 . A A . 15 LYS HZ1 1 1 7 11493 1 1 15 LYS HZ2 H -2.304 10.036 -17.127 1.00 . A A . 15 LYS HZ2 1 1 7 11494 1 1 15 LYS N N 0.349 10.447 -9.784 1.00 . A A . 15 LYS N 1 1 7 11495 1 1 15 LYS NZ N -2.016 9.801 -16.183 1.00 . A A . 15 LYS NZ 1 1 7 11496 1 1 15 LYS O O -3.054 10.289 -10.851 1.00 . A A . 15 LYS O 1 1 7 11497 1 1 16 GLN C C -2.958 7.870 -7.833 1.00 . A A . 16 GLN C 1 1 7 11498 1 1 16 GLN CA C -2.797 7.962 -9.352 1.00 . A A . 16 GLN CA 1 1 7 11499 1 1 16 GLN CB C -2.554 6.580 -9.962 1.00 . A A . 16 GLN CB 1 1 7 11500 1 1 16 GLN CD C -3.416 6.444 -12.328 1.00 . A A . 16 GLN CD 1 1 7 11501 1 1 16 GLN CG C -2.192 6.692 -11.445 1.00 . A A . 16 GLN CG 1 1 7 11502 1 1 16 GLN H H -0.821 8.620 -9.339 1.00 . A A . 16 GLN H 1 1 7 11503 1 1 16 GLN HA H -3.695 8.394 -9.793 1.00 . A A . 16 GLN HA 1 1 7 11504 1 1 16 GLN HB2 H -1.750 6.077 -9.425 1.00 . A A . 16 GLN HB2 1 1 7 11505 1 1 16 GLN HB3 H -3.447 5.966 -9.848 1.00 . A A . 16 GLN HB3 1 1 7 11506 1 1 16 GLN HE21 H -3.517 4.565 -11.581 1.00 . A A . 16 GLN HE21 1 1 7 11507 1 1 16 GLN HE22 H -4.735 4.966 -12.746 1.00 . A A . 16 GLN HE22 1 1 7 11508 1 1 16 GLN HG2 H -1.785 7.682 -11.650 1.00 . A A . 16 GLN HG2 1 1 7 11509 1 1 16 GLN HG3 H -1.412 5.970 -11.687 1.00 . A A . 16 GLN HG3 1 1 7 11510 1 1 16 GLN N N -1.721 8.878 -9.691 1.00 . A A . 16 GLN N 1 1 7 11511 1 1 16 GLN NE2 N -3.932 5.224 -12.208 1.00 . A A . 16 GLN NE2 1 1 7 11512 1 1 16 GLN O O -2.247 7.111 -7.175 1.00 . A A . 16 GLN O 1 1 7 11513 1 1 16 GLN OE1 O -3.862 7.304 -13.070 1.00 . A A . 16 GLN OE1 1 1 7 11514 1 1 17 PRO C C -4.945 7.436 -5.446 1.00 . A A . 17 PRO C 1 1 7 11515 1 1 17 PRO CA C -4.182 8.690 -5.878 1.00 . A A . 17 PRO CA 1 1 7 11516 1 1 17 PRO CB C -4.962 9.973 -5.636 1.00 . A A . 17 PRO CB 1 1 7 11517 1 1 17 PRO CD C -4.780 9.585 -8.056 1.00 . A A . 17 PRO CD 1 1 7 11518 1 1 17 PRO CG C -5.508 10.391 -6.991 1.00 . A A . 17 PRO CG 1 1 7 11519 1 1 17 PRO HA H -3.323 8.677 -5.367 1.00 . A A . 17 PRO HA 1 1 7 11520 1 1 17 PRO HB2 H -5.770 9.810 -4.923 1.00 . A A . 17 PRO HB2 1 1 7 11521 1 1 17 PRO HB3 H -4.319 10.747 -5.218 1.00 . A A . 17 PRO HB3 1 1 7 11522 1 1 17 PRO HD2 H -5.481 9.039 -8.687 1.00 . A A . 17 PRO HD2 1 1 7 11523 1 1 17 PRO HD3 H -4.197 10.231 -8.712 1.00 . A A . 17 PRO HD3 1 1 7 11524 1 1 17 PRO HG2 H -6.582 10.210 -7.043 1.00 . A A . 17 PRO HG2 1 1 7 11525 1 1 17 PRO HG3 H -5.357 11.458 -7.151 1.00 . A A . 17 PRO HG3 1 1 7 11526 1 1 17 PRO N N -3.920 8.674 -7.307 1.00 . A A . 17 PRO N 1 1 7 11527 1 1 17 PRO O O -5.580 6.777 -6.268 1.00 . A A . 17 PRO O 1 1 7 11528 1 1 18 VAL C C -6.137 6.342 -2.247 1.00 . A A . 18 VAL C 1 1 7 11529 1 1 18 VAL CA C -5.532 5.981 -3.606 1.00 . A A . 18 VAL CA 1 1 7 11530 1 1 18 VAL CB C -4.562 4.800 -3.533 1.00 . A A . 18 VAL CB 1 1 7 11531 1 1 18 VAL CG1 C -5.182 3.628 -2.770 1.00 . A A . 18 VAL CG1 1 1 7 11532 1 1 18 VAL CG2 C -4.118 4.369 -4.932 1.00 . A A . 18 VAL CG2 1 1 7 11533 1 1 18 VAL H H -4.341 7.686 -3.494 1.00 . A A . 18 VAL H 1 1 7 11534 1 1 18 VAL HA H -6.339 5.714 -4.289 1.00 . A A . 18 VAL HA 1 1 7 11535 1 1 18 VAL HB H -3.678 5.126 -2.987 1.00 . A A . 18 VAL HB 1 1 7 11536 1 1 18 VAL HG11 H -5.568 3.981 -1.813 1.00 . A A . 18 VAL HG11 1 1 7 11537 1 1 18 VAL HG12 H -5.997 3.202 -3.355 1.00 . A A . 18 VAL HG12 1 1 7 11538 1 1 18 VAL HG13 H -4.422 2.865 -2.596 1.00 . A A . 18 VAL HG13 1 1 7 11539 1 1 18 VAL HG21 H -4.937 4.518 -5.636 1.00 . A A . 18 VAL HG21 1 1 7 11540 1 1 18 VAL HG22 H -3.260 4.967 -5.241 1.00 . A A . 18 VAL HG22 1 1 7 11541 1 1 18 VAL HG23 H -3.839 3.315 -4.917 1.00 . A A . 18 VAL HG23 1 1 7 11542 1 1 18 VAL N N -4.859 7.144 -4.157 1.00 . A A . 18 VAL N 1 1 7 11543 1 1 18 VAL O O -5.648 7.242 -1.566 1.00 . A A . 18 VAL O 1 1 7 11544 1 1 19 VAL C C -7.812 4.583 0.217 1.00 . A A . 19 VAL C 1 1 7 11545 1 1 19 VAL CA C -7.867 5.856 -0.629 1.00 . A A . 19 VAL CA 1 1 7 11546 1 1 19 VAL CB C -9.295 6.344 -0.882 1.00 . A A . 19 VAL CB 1 1 7 11547 1 1 19 VAL CG1 C -10.130 6.282 0.398 1.00 . A A . 19 VAL CG1 1 1 7 11548 1 1 19 VAL CG2 C -9.295 7.757 -1.469 1.00 . A A . 19 VAL CG2 1 1 7 11549 1 1 19 VAL H H -7.582 4.892 -2.454 1.00 . A A . 19 VAL H 1 1 7 11550 1 1 19 VAL HA H -7.327 6.647 -0.109 1.00 . A A . 19 VAL HA 1 1 7 11551 1 1 19 VAL HB H -9.753 5.678 -1.613 1.00 . A A . 19 VAL HB 1 1 7 11552 1 1 19 VAL HG11 H -10.150 5.258 0.770 1.00 . A A . 19 VAL HG11 1 1 7 11553 1 1 19 VAL HG12 H -9.689 6.934 1.152 1.00 . A A . 19 VAL HG12 1 1 7 11554 1 1 19 VAL HG13 H -11.147 6.611 0.185 1.00 . A A . 19 VAL HG13 1 1 7 11555 1 1 19 VAL HG21 H -8.270 8.068 -1.668 1.00 . A A . 19 VAL HG21 1 1 7 11556 1 1 19 VAL HG22 H -9.865 7.764 -2.399 1.00 . A A . 19 VAL HG22 1 1 7 11557 1 1 19 VAL HG23 H -9.752 8.446 -0.758 1.00 . A A . 19 VAL HG23 1 1 7 11558 1 1 19 VAL N N -7.191 5.622 -1.894 1.00 . A A . 19 VAL N 1 1 7 11559 1 1 19 VAL O O -8.382 3.559 -0.158 1.00 . A A . 19 VAL O 1 1 7 11560 1 1 20 PHE C C -7.823 3.758 3.507 1.00 . A A . 20 PHE C 1 1 7 11561 1 1 20 PHE CA C -6.983 3.557 2.244 1.00 . A A . 20 PHE CA 1 1 7 11562 1 1 20 PHE CB C -5.504 3.505 2.633 1.00 . A A . 20 PHE CB 1 1 7 11563 1 1 20 PHE CD1 C -4.845 1.100 3.003 1.00 . A A . 20 PHE CD1 1 1 7 11564 1 1 20 PHE CD2 C -5.112 2.508 4.916 1.00 . A A . 20 PHE CD2 1 1 7 11565 1 1 20 PHE CE1 C -4.503 -0.004 3.863 1.00 . A A . 20 PHE CE1 1 1 7 11566 1 1 20 PHE CE2 C -4.771 1.405 5.776 1.00 . A A . 20 PHE CE2 1 1 7 11567 1 1 20 PHE CG C -5.142 2.333 3.547 1.00 . A A . 20 PHE CG 1 1 7 11568 1 1 20 PHE CZ C -4.484 0.203 5.207 1.00 . A A . 20 PHE CZ 1 1 7 11569 1 1 20 PHE H H -6.660 5.524 1.640 1.00 . A A . 20 PHE H 1 1 7 11570 1 1 20 PHE HA H -7.332 2.666 1.722 1.00 . A A . 20 PHE HA 1 1 7 11571 1 1 20 PHE HB2 H -4.903 3.445 1.726 1.00 . A A . 20 PHE HB2 1 1 7 11572 1 1 20 PHE HB3 H -5.237 4.437 3.131 1.00 . A A . 20 PHE HB3 1 1 7 11573 1 1 20 PHE HD1 H -4.868 0.961 1.922 1.00 . A A . 20 PHE HD1 1 1 7 11574 1 1 20 PHE HD2 H -5.347 3.482 5.345 1.00 . A A . 20 PHE HD2 1 1 7 11575 1 1 20 PHE HE1 H -4.266 -0.983 3.446 1.00 . A A . 20 PHE HE1 1 1 7 11576 1 1 20 PHE HE2 H -4.744 1.530 6.858 1.00 . A A . 20 PHE HE2 1 1 7 11577 1 1 20 PHE HZ H -4.253 -0.594 5.958 1.00 . A A . 20 PHE HZ 1 1 7 11578 1 1 20 PHE N N -7.121 4.688 1.342 1.00 . A A . 20 PHE N 1 1 7 11579 1 1 20 PHE O O -7.863 4.854 4.063 1.00 . A A . 20 PHE O 1 1 7 11580 1 1 21 ASN C C -8.799 1.708 6.129 1.00 . A A . 21 ASN C 1 1 7 11581 1 1 21 ASN CA C -9.313 2.726 5.109 1.00 . A A . 21 ASN CA 1 1 7 11582 1 1 21 ASN CB C -10.762 2.369 4.774 1.00 . A A . 21 ASN CB 1 1 7 11583 1 1 21 ASN CG C -11.464 3.531 4.069 1.00 . A A . 21 ASN CG 1 1 7 11584 1 1 21 ASN H H -8.438 1.793 3.465 1.00 . A A . 21 ASN H 1 1 7 11585 1 1 21 ASN HA H -9.242 3.751 5.472 1.00 . A A . 21 ASN HA 1 1 7 11586 1 1 21 ASN HB2 H -10.785 1.485 4.136 1.00 . A A . 21 ASN HB2 1 1 7 11587 1 1 21 ASN HB3 H -11.299 2.115 5.688 1.00 . A A . 21 ASN HB3 1 1 7 11588 1 1 21 ASN HD21 H -12.986 2.275 3.615 1.00 . A A . 21 ASN HD21 1 1 7 11589 1 1 21 ASN HD22 H -13.175 3.902 3.052 1.00 . A A . 21 ASN HD22 1 1 7 11590 1 1 21 ASN N N -8.475 2.682 3.923 1.00 . A A . 21 ASN N 1 1 7 11591 1 1 21 ASN ND2 N -12.639 3.210 3.535 1.00 . A A . 21 ASN ND2 1 1 7 11592 1 1 21 ASN O O -8.796 0.507 5.865 1.00 . A A . 21 ASN O 1 1 7 11593 1 1 21 ASN OD1 O -10.972 4.646 4.015 1.00 . A A . 21 ASN OD1 1 1 7 11594 1 1 22 HIS C C -8.991 0.509 8.892 1.00 . A A . 22 HIS C 1 1 7 11595 1 1 22 HIS CA C -7.861 1.377 8.334 1.00 . A A . 22 HIS CA 1 1 7 11596 1 1 22 HIS CB C -7.169 2.214 9.412 1.00 . A A . 22 HIS CB 1 1 7 11597 1 1 22 HIS CD2 C -4.568 2.009 9.259 1.00 . A A . 22 HIS CD2 1 1 7 11598 1 1 22 HIS CE1 C -4.166 3.904 8.240 1.00 . A A . 22 HIS CE1 1 1 7 11599 1 1 22 HIS CG C -5.763 2.634 9.055 1.00 . A A . 22 HIS CG 1 1 7 11600 1 1 22 HIS H H -8.383 3.204 7.481 1.00 . A A . 22 HIS H 1 1 7 11601 1 1 22 HIS HA H -7.109 0.731 7.881 1.00 . A A . 22 HIS HA 1 1 7 11602 1 1 22 HIS HB2 H -7.766 3.106 9.604 1.00 . A A . 22 HIS HB2 1 1 7 11603 1 1 22 HIS HB3 H -7.142 1.642 10.340 1.00 . A A . 22 HIS HB3 1 1 7 11604 1 1 22 HIS HD1 H -6.147 4.510 8.125 1.00 . A A . 22 HIS HD1 1 1 7 11605 1 1 22 HIS HD2 H -4.428 1.043 9.744 1.00 . A A . 22 HIS HD2 1 1 7 11606 1 1 22 HIS HE1 H -3.630 4.724 7.763 1.00 . A A . 22 HIS HE1 1 1 7 11607 1 1 22 HIS N N -8.377 2.226 7.273 1.00 . A A . 22 HIS N 1 1 7 11608 1 1 22 HIS ND1 N -5.477 3.825 8.412 1.00 . A A . 22 HIS ND1 1 1 7 11609 1 1 22 HIS NE2 N -3.604 2.777 8.765 1.00 . A A . 22 HIS NE2 1 1 7 11610 1 1 22 HIS O O -8.742 -0.558 9.450 1.00 . A A . 22 HIS O 1 1 7 11611 1 1 23 SER C C -11.630 -0.950 8.332 1.00 . A A . 23 SER C 1 1 7 11612 1 1 23 SER CA C -11.379 0.283 9.202 1.00 . A A . 23 SER CA 1 1 7 11613 1 1 23 SER CB C -12.614 1.187 9.210 1.00 . A A . 23 SER CB 1 1 7 11614 1 1 23 SER H H -10.405 1.869 8.267 1.00 . A A . 23 SER H 1 1 7 11615 1 1 23 SER HA H -11.139 -0.011 10.223 1.00 . A A . 23 SER HA 1 1 7 11616 1 1 23 SER HB2 H -12.317 2.209 8.975 1.00 . A A . 23 SER HB2 1 1 7 11617 1 1 23 SER HB3 H -13.302 0.867 8.427 1.00 . A A . 23 SER HB3 1 1 7 11618 1 1 23 SER HG H -12.909 0.436 11.042 1.00 . A A . 23 SER HG 1 1 7 11619 1 1 23 SER N N -10.210 1.000 8.722 1.00 . A A . 23 SER N 1 1 7 11620 1 1 23 SER O O -12.519 -1.749 8.623 1.00 . A A . 23 SER O 1 1 7 11621 1 1 23 SER OG O -13.283 1.164 10.468 1.00 . A A . 23 SER OG 1 1 7 11622 1 1 24 THR C C -9.840 -3.207 6.617 1.00 . A A . 24 THR C 1 1 7 11623 1 1 24 THR CA C -10.955 -2.190 6.368 1.00 . A A . 24 THR CA 1 1 7 11624 1 1 24 THR CB C -10.967 -1.638 4.941 1.00 . A A . 24 THR CB 1 1 7 11625 1 1 24 THR CG2 C -11.109 -2.740 3.889 1.00 . A A . 24 THR CG2 1 1 7 11626 1 1 24 THR H H -10.110 -0.413 7.052 1.00 . A A . 24 THR H 1 1 7 11627 1 1 24 THR HA H -11.899 -2.695 6.571 1.00 . A A . 24 THR HA 1 1 7 11628 1 1 24 THR HB H -10.083 -1.030 4.751 1.00 . A A . 24 THR HB 1 1 7 11629 1 1 24 THR HG1 H -12.070 0.011 5.204 1.00 . A A . 24 THR HG1 1 1 7 11630 1 1 24 THR HG21 H -10.916 -3.709 4.349 1.00 . A A . 24 THR HG21 1 1 7 11631 1 1 24 THR HG22 H -12.120 -2.726 3.482 1.00 . A A . 24 THR HG22 1 1 7 11632 1 1 24 THR HG23 H -10.392 -2.570 3.086 1.00 . A A . 24 THR HG23 1 1 7 11633 1 1 24 THR N N -10.831 -1.067 7.282 1.00 . A A . 24 THR N 1 1 7 11634 1 1 24 THR O O -10.041 -4.408 6.449 1.00 . A A . 24 THR O 1 1 7 11635 1 1 24 THR OG1 O -12.194 -0.919 4.857 1.00 . A A . 24 THR OG1 1 1 7 11636 1 1 25 HIS C C -7.378 -3.709 8.799 1.00 . A A . 25 HIS C 1 1 7 11637 1 1 25 HIS CA C -7.539 -3.534 7.287 1.00 . A A . 25 HIS CA 1 1 7 11638 1 1 25 HIS CB C -6.281 -2.978 6.618 1.00 . A A . 25 HIS CB 1 1 7 11639 1 1 25 HIS CD2 C -5.874 -3.632 4.120 1.00 . A A . 25 HIS CD2 1 1 7 11640 1 1 25 HIS CE1 C -6.996 -2.002 3.185 1.00 . A A . 25 HIS CE1 1 1 7 11641 1 1 25 HIS CG C -6.387 -2.855 5.116 1.00 . A A . 25 HIS CG 1 1 7 11642 1 1 25 HIS H H -8.531 -1.708 7.148 1.00 . A A . 25 HIS H 1 1 7 11643 1 1 25 HIS HA H -7.752 -4.505 6.839 1.00 . A A . 25 HIS HA 1 1 7 11644 1 1 25 HIS HB2 H -6.062 -1.996 7.038 1.00 . A A . 25 HIS HB2 1 1 7 11645 1 1 25 HIS HB3 H -5.437 -3.623 6.860 1.00 . A A . 25 HIS HB3 1 1 7 11646 1 1 25 HIS HD1 H -7.581 -1.099 4.958 1.00 . A A . 25 HIS HD1 1 1 7 11647 1 1 25 HIS HD2 H -5.265 -4.525 4.258 1.00 . A A . 25 HIS HD2 1 1 7 11648 1 1 25 HIS HE1 H -7.442 -1.362 2.424 1.00 . A A . 25 HIS HE1 1 1 7 11649 1 1 25 HIS N N -8.687 -2.687 7.014 1.00 . A A . 25 HIS N 1 1 7 11650 1 1 25 HIS ND1 N -7.088 -1.836 4.496 1.00 . A A . 25 HIS ND1 1 1 7 11651 1 1 25 HIS NE2 N -6.243 -3.116 2.954 1.00 . A A . 25 HIS NE2 1 1 7 11652 1 1 25 HIS O O -6.259 -3.771 9.305 1.00 . A A . 25 HIS O 1 1 7 11653 1 1 26 LYS C C -7.996 -5.345 11.270 1.00 . A A . 26 LYS C 1 1 7 11654 1 1 26 LYS CA C -8.513 -3.948 10.921 1.00 . A A . 26 LYS CA 1 1 7 11655 1 1 26 LYS CB C -9.898 -3.645 11.496 1.00 . A A . 26 LYS CB 1 1 7 11656 1 1 26 LYS CD C -11.799 -1.989 11.571 1.00 . A A . 26 LYS CD 1 1 7 11657 1 1 26 LYS CE C -11.721 -1.088 12.806 1.00 . A A . 26 LYS CE 1 1 7 11658 1 1 26 LYS CG C -10.403 -2.282 11.018 1.00 . A A . 26 LYS CG 1 1 7 11659 1 1 26 LYS H H -9.420 -3.732 9.058 1.00 . A A . 26 LYS H 1 1 7 11660 1 1 26 LYS HA H -7.824 -3.212 11.334 1.00 . A A . 26 LYS HA 1 1 7 11661 1 1 26 LYS HB2 H -10.600 -4.422 11.195 1.00 . A A . 26 LYS HB2 1 1 7 11662 1 1 26 LYS HB3 H -9.855 -3.659 12.585 1.00 . A A . 26 LYS HB3 1 1 7 11663 1 1 26 LYS HD2 H -12.405 -1.509 10.804 1.00 . A A . 26 LYS HD2 1 1 7 11664 1 1 26 LYS HD3 H -12.295 -2.925 11.830 1.00 . A A . 26 LYS HD3 1 1 7 11665 1 1 26 LYS HE2 H -10.889 -1.398 13.438 1.00 . A A . 26 LYS HE2 1 1 7 11666 1 1 26 LYS HE3 H -11.525 -0.060 12.501 1.00 . A A . 26 LYS HE3 1 1 7 11667 1 1 26 LYS HG2 H -9.711 -1.502 11.335 1.00 . A A . 26 LYS HG2 1 1 7 11668 1 1 26 LYS HG3 H -10.429 -2.261 9.928 1.00 . A A . 26 LYS HG3 1 1 7 11669 1 1 26 LYS HZ1 H -13.660 -0.467 13.252 1.00 . A A . 26 LYS HZ1 1 1 7 11670 1 1 26 LYS HZ2 H -13.429 -2.060 13.500 1.00 . A A . 26 LYS HZ2 1 1 7 11671 1 1 26 LYS N N -8.514 -3.783 9.477 1.00 . A A . 26 LYS N 1 1 7 11672 1 1 26 LYS NZ N -12.985 -1.152 13.574 1.00 . A A . 26 LYS NZ 1 1 7 11673 1 1 26 LYS O O -7.255 -5.513 12.237 1.00 . A A . 26 LYS O 1 1 7 11674 1 1 27 SER C C -6.511 -7.850 10.333 1.00 . A A . 27 SER C 1 1 7 11675 1 1 27 SER CA C -7.994 -7.689 10.673 1.00 . A A . 27 SER CA 1 1 7 11676 1 1 27 SER CB C -8.838 -8.652 9.835 1.00 . A A . 27 SER CB 1 1 7 11677 1 1 27 SER H H -9.008 -6.167 9.677 1.00 . A A . 27 SER H 1 1 7 11678 1 1 27 SER HA H -8.166 -7.883 11.732 1.00 . A A . 27 SER HA 1 1 7 11679 1 1 27 SER HB2 H -8.788 -9.650 10.270 1.00 . A A . 27 SER HB2 1 1 7 11680 1 1 27 SER HB3 H -9.882 -8.342 9.869 1.00 . A A . 27 SER HB3 1 1 7 11681 1 1 27 SER HG H -7.757 -9.457 8.356 1.00 . A A . 27 SER HG 1 1 7 11682 1 1 27 SER N N -8.406 -6.312 10.462 1.00 . A A . 27 SER N 1 1 7 11683 1 1 27 SER O O -5.893 -8.853 10.687 1.00 . A A . 27 SER O 1 1 7 11684 1 1 27 SER OG O -8.402 -8.703 8.480 1.00 . A A . 27 SER OG 1 1 7 11685 1 1 28 VAL C C -3.736 -6.255 10.375 1.00 . A A . 28 VAL C 1 1 7 11686 1 1 28 VAL CA C -4.583 -6.863 9.255 1.00 . A A . 28 VAL CA 1 1 7 11687 1 1 28 VAL CB C -4.407 -6.146 7.915 1.00 . A A . 28 VAL CB 1 1 7 11688 1 1 28 VAL CG1 C -2.995 -6.353 7.364 1.00 . A A . 28 VAL CG1 1 1 7 11689 1 1 28 VAL CG2 C -5.462 -6.603 6.906 1.00 . A A . 28 VAL CG2 1 1 7 11690 1 1 28 VAL H H -6.491 -6.033 9.364 1.00 . A A . 28 VAL H 1 1 7 11691 1 1 28 VAL HA H -4.292 -7.905 9.122 1.00 . A A . 28 VAL HA 1 1 7 11692 1 1 28 VAL HB H -4.547 -5.078 8.086 1.00 . A A . 28 VAL HB 1 1 7 11693 1 1 28 VAL HG11 H -2.300 -6.502 8.191 1.00 . A A . 28 VAL HG11 1 1 7 11694 1 1 28 VAL HG12 H -2.982 -7.229 6.716 1.00 . A A . 28 VAL HG12 1 1 7 11695 1 1 28 VAL HG13 H -2.696 -5.474 6.793 1.00 . A A . 28 VAL HG13 1 1 7 11696 1 1 28 VAL HG21 H -6.159 -7.285 7.393 1.00 . A A . 28 VAL HG21 1 1 7 11697 1 1 28 VAL HG22 H -6.005 -5.736 6.530 1.00 . A A . 28 VAL HG22 1 1 7 11698 1 1 28 VAL HG23 H -4.973 -7.114 6.076 1.00 . A A . 28 VAL HG23 1 1 7 11699 1 1 28 VAL N N -5.982 -6.846 9.648 1.00 . A A . 28 VAL N 1 1 7 11700 1 1 28 VAL O O -4.156 -5.301 11.028 1.00 . A A . 28 VAL O 1 1 7 11701 1 1 29 LYS C C -0.998 -5.052 11.131 1.00 . A A . 29 LYS C 1 1 7 11702 1 1 29 LYS CA C -1.648 -6.359 11.592 1.00 . A A . 29 LYS CA 1 1 7 11703 1 1 29 LYS CB C -0.641 -7.450 11.960 1.00 . A A . 29 LYS CB 1 1 7 11704 1 1 29 LYS CD C -1.769 -9.057 13.542 1.00 . A A . 29 LYS CD 1 1 7 11705 1 1 29 LYS CE C -1.020 -10.344 13.896 1.00 . A A . 29 LYS CE 1 1 7 11706 1 1 29 LYS CG C -0.804 -7.877 13.420 1.00 . A A . 29 LYS CG 1 1 7 11707 1 1 29 LYS H H -2.224 -7.608 10.027 1.00 . A A . 29 LYS H 1 1 7 11708 1 1 29 LYS HA H -2.241 -6.154 12.483 1.00 . A A . 29 LYS HA 1 1 7 11709 1 1 29 LYS HB2 H -0.779 -8.313 11.308 1.00 . A A . 29 LYS HB2 1 1 7 11710 1 1 29 LYS HB3 H 0.373 -7.085 11.794 1.00 . A A . 29 LYS HB3 1 1 7 11711 1 1 29 LYS HD2 H -2.515 -8.844 14.308 1.00 . A A . 29 LYS HD2 1 1 7 11712 1 1 29 LYS HD3 H -2.306 -9.191 12.603 1.00 . A A . 29 LYS HD3 1 1 7 11713 1 1 29 LYS HE2 H -0.302 -10.146 14.692 1.00 . A A . 29 LYS HE2 1 1 7 11714 1 1 29 LYS HE3 H -1.721 -11.087 14.276 1.00 . A A . 29 LYS HE3 1 1 7 11715 1 1 29 LYS HG2 H 0.167 -8.152 13.832 1.00 . A A . 29 LYS HG2 1 1 7 11716 1 1 29 LYS HG3 H -1.173 -7.037 14.009 1.00 . A A . 29 LYS HG3 1 1 7 11717 1 1 29 LYS HZ1 H -0.614 -11.821 12.484 1.00 . A A . 29 LYS HZ1 1 1 7 11718 1 1 29 LYS HZ2 H -0.485 -10.314 11.882 1.00 . A A . 29 LYS HZ2 1 1 7 11719 1 1 29 LYS N N -2.558 -6.832 10.562 1.00 . A A . 29 LYS N 1 1 7 11720 1 1 29 LYS NZ N -0.318 -10.878 12.708 1.00 . A A . 29 LYS NZ 1 1 7 11721 1 1 29 LYS O O -0.732 -4.872 9.944 1.00 . A A . 29 LYS O 1 1 7 11722 1 1 30 CYS C C 1.278 -3.140 11.309 1.00 . A A . 30 CYS C 1 1 7 11723 1 1 30 CYS CA C -0.149 -2.890 11.802 1.00 . A A . 30 CYS CA 1 1 7 11724 1 1 30 CYS CB C -0.178 -1.960 13.017 1.00 . A A . 30 CYS CB 1 1 7 11725 1 1 30 CYS H H -0.981 -4.329 13.058 1.00 . A A . 30 CYS H 1 1 7 11726 1 1 30 CYS HA H -0.752 -2.425 11.023 1.00 . A A . 30 CYS HA 1 1 7 11727 1 1 30 CYS HB2 H 0.670 -2.196 13.659 1.00 . A A . 30 CYS HB2 1 1 7 11728 1 1 30 CYS HB3 H -0.043 -0.934 12.675 1.00 . A A . 30 CYS HB3 1 1 7 11729 1 1 30 CYS N N -0.762 -4.174 12.095 1.00 . A A . 30 CYS N 1 1 7 11730 1 1 30 CYS O O 1.794 -2.388 10.484 1.00 . A A . 30 CYS O 1 1 7 11731 1 1 30 CYS SG S -1.710 -2.048 14.014 1.00 . A A . 30 CYS SG 1 1 7 11732 1 1 31 GLY C C 3.265 -5.203 10.074 1.00 . A A . 31 GLY C 1 1 7 11733 1 1 31 GLY CA C 3.233 -4.556 11.461 1.00 . A A . 31 GLY CA 1 1 7 11734 1 1 31 GLY H H 1.449 -4.805 12.508 1.00 . A A . 31 GLY H 1 1 7 11735 1 1 31 GLY HA2 H 3.862 -3.666 11.466 1.00 . A A . 31 GLY HA2 1 1 7 11736 1 1 31 GLY HA3 H 3.648 -5.244 12.197 1.00 . A A . 31 GLY HA3 1 1 7 11737 1 1 31 GLY N N 1.875 -4.198 11.837 1.00 . A A . 31 GLY N 1 1 7 11738 1 1 31 GLY O O 4.337 -5.496 9.547 1.00 . A A . 31 GLY O 1 1 7 11739 1 1 32 ASP C C 2.205 -4.951 7.136 1.00 . A A . 32 ASP C 1 1 7 11740 1 1 32 ASP CA C 1.956 -6.013 8.209 1.00 . A A . 32 ASP CA 1 1 7 11741 1 1 32 ASP CB C 0.553 -6.584 7.993 1.00 . A A . 32 ASP CB 1 1 7 11742 1 1 32 ASP CG C 0.406 -7.494 6.772 1.00 . A A . 32 ASP CG 1 1 7 11743 1 1 32 ASP H H 1.210 -5.165 9.959 1.00 . A A . 32 ASP H 1 1 7 11744 1 1 32 ASP HA H 2.703 -6.807 8.190 1.00 . A A . 32 ASP HA 1 1 7 11745 1 1 32 ASP HB2 H 0.265 -7.144 8.882 1.00 . A A . 32 ASP HB2 1 1 7 11746 1 1 32 ASP HB3 H -0.149 -5.755 7.897 1.00 . A A . 32 ASP HB3 1 1 7 11747 1 1 32 ASP N N 2.077 -5.406 9.524 1.00 . A A . 32 ASP N 1 1 7 11748 1 1 32 ASP O O 2.777 -5.244 6.088 1.00 . A A . 32 ASP O 1 1 7 11749 1 1 32 ASP OD1 O 0.827 -7.052 5.681 1.00 . A A . 32 ASP OD1 1 1 7 11750 1 1 32 ASP OD2 O -0.123 -8.611 6.957 1.00 . A A . 32 ASP OD2 1 1 7 11751 1 1 33 CYS C C 3.052 -1.732 7.035 1.00 . A A . 33 CYS C 1 1 7 11752 1 1 33 CYS CA C 1.930 -2.630 6.511 1.00 . A A . 33 CYS CA 1 1 7 11753 1 1 33 CYS CB C 0.625 -1.857 6.313 1.00 . A A . 33 CYS CB 1 1 7 11754 1 1 33 CYS H H 1.299 -3.508 8.292 1.00 . A A . 33 CYS H 1 1 7 11755 1 1 33 CYS HA H 2.199 -3.065 5.548 1.00 . A A . 33 CYS HA 1 1 7 11756 1 1 33 CYS HB2 H 0.041 -1.872 7.234 1.00 . A A . 33 CYS HB2 1 1 7 11757 1 1 33 CYS HB3 H 0.842 -0.812 6.091 1.00 . A A . 33 CYS HB3 1 1 7 11758 1 1 33 CYS N N 1.763 -3.738 7.437 1.00 . A A . 33 CYS N 1 1 7 11759 1 1 33 CYS O O 4.020 -1.464 6.325 1.00 . A A . 33 CYS O 1 1 7 11760 1 1 33 CYS SG S -0.342 -2.599 4.948 1.00 . A A . 33 CYS SG 1 1 7 11761 1 1 34 HIS C C 5.073 -1.262 9.347 1.00 . A A . 34 HIS C 1 1 7 11762 1 1 34 HIS CA C 3.871 -0.428 8.900 1.00 . A A . 34 HIS CA 1 1 7 11763 1 1 34 HIS CB C 3.245 0.372 10.044 1.00 . A A . 34 HIS CB 1 1 7 11764 1 1 34 HIS CD2 C 0.763 1.093 9.658 1.00 . A A . 34 HIS CD2 1 1 7 11765 1 1 34 HIS CE1 C 1.143 3.069 8.799 1.00 . A A . 34 HIS CE1 1 1 7 11766 1 1 34 HIS CG C 2.114 1.275 9.615 1.00 . A A . 34 HIS CG 1 1 7 11767 1 1 34 HIS H H 2.094 -1.513 8.844 1.00 . A A . 34 HIS H 1 1 7 11768 1 1 34 HIS HA H 4.196 0.281 8.138 1.00 . A A . 34 HIS HA 1 1 7 11769 1 1 34 HIS HB2 H 2.876 -0.323 10.799 1.00 . A A . 34 HIS HB2 1 1 7 11770 1 1 34 HIS HB3 H 4.019 0.975 10.518 1.00 . A A . 34 HIS HB3 1 1 7 11771 1 1 34 HIS HD1 H 3.212 2.956 8.905 1.00 . A A . 34 HIS HD1 1 1 7 11772 1 1 34 HIS HD2 H 0.251 0.207 10.033 1.00 . A A . 34 HIS HD2 1 1 7 11773 1 1 34 HIS HE1 H 0.973 4.053 8.361 1.00 . A A . 34 HIS HE1 1 1 7 11774 1 1 34 HIS N N 2.885 -1.291 8.273 1.00 . A A . 34 HIS N 1 1 7 11775 1 1 34 HIS ND1 N 2.322 2.529 9.068 1.00 . A A . 34 HIS ND1 1 1 7 11776 1 1 34 HIS NE2 N 0.177 2.178 9.165 1.00 . A A . 34 HIS NE2 1 1 7 11777 1 1 34 HIS O O 5.325 -1.402 10.543 1.00 . A A . 34 HIS O 1 1 7 11778 1 1 35 HIS C C 7.939 -1.821 9.500 1.00 . A A . 35 HIS C 1 1 7 11779 1 1 35 HIS CA C 6.951 -2.612 8.641 1.00 . A A . 35 HIS CA 1 1 7 11780 1 1 35 HIS CB C 7.575 -3.127 7.342 1.00 . A A . 35 HIS CB 1 1 7 11781 1 1 35 HIS CD2 C 7.739 -1.389 5.397 1.00 . A A . 35 HIS CD2 1 1 7 11782 1 1 35 HIS CE1 C 9.739 -0.617 5.837 1.00 . A A . 35 HIS CE1 1 1 7 11783 1 1 35 HIS CG C 8.207 -2.049 6.495 1.00 . A A . 35 HIS CG 1 1 7 11784 1 1 35 HIS H H 5.570 -1.676 7.393 1.00 . A A . 35 HIS H 1 1 7 11785 1 1 35 HIS HA H 6.602 -3.476 9.207 1.00 . A A . 35 HIS HA 1 1 7 11786 1 1 35 HIS HB2 H 8.331 -3.874 7.585 1.00 . A A . 35 HIS HB2 1 1 7 11787 1 1 35 HIS HB3 H 6.806 -3.631 6.756 1.00 . A A . 35 HIS HB3 1 1 7 11788 1 1 35 HIS HD1 H 10.076 -1.824 7.490 1.00 . A A . 35 HIS HD1 1 1 7 11789 1 1 35 HIS HD2 H 6.769 -1.545 4.925 1.00 . A A . 35 HIS HD2 1 1 7 11790 1 1 35 HIS HE1 H 10.657 -0.034 5.767 1.00 . A A . 35 HIS HE1 1 1 7 11791 1 1 35 HIS N N 5.782 -1.795 8.363 1.00 . A A . 35 HIS N 1 1 7 11792 1 1 35 HIS ND1 N 9.470 -1.541 6.747 1.00 . A A . 35 HIS ND1 1 1 7 11793 1 1 35 HIS NE2 N 8.665 -0.524 5.001 1.00 . A A . 35 HIS NE2 1 1 7 11794 1 1 35 HIS O O 8.025 -0.599 9.387 1.00 . A A . 35 HIS O 1 1 7 11795 1 1 36 PRO C C 10.911 -1.542 10.462 1.00 . A A . 36 PRO C 1 1 7 11796 1 1 36 PRO CA C 9.658 -1.950 11.239 1.00 . A A . 36 PRO CA 1 1 7 11797 1 1 36 PRO CB C 9.936 -2.989 12.313 1.00 . A A . 36 PRO CB 1 1 7 11798 1 1 36 PRO CD C 8.604 -4.018 10.522 1.00 . A A . 36 PRO CD 1 1 7 11799 1 1 36 PRO CG C 9.461 -4.315 11.742 1.00 . A A . 36 PRO CG 1 1 7 11800 1 1 36 PRO HA H 9.290 -1.105 11.628 1.00 . A A . 36 PRO HA 1 1 7 11801 1 1 36 PRO HB2 H 10.998 -3.026 12.554 1.00 . A A . 36 PRO HB2 1 1 7 11802 1 1 36 PRO HB3 H 9.408 -2.749 13.235 1.00 . A A . 36 PRO HB3 1 1 7 11803 1 1 36 PRO HD2 H 8.980 -4.534 9.639 1.00 . A A . 36 PRO HD2 1 1 7 11804 1 1 36 PRO HD3 H 7.576 -4.347 10.671 1.00 . A A . 36 PRO HD3 1 1 7 11805 1 1 36 PRO HG2 H 10.311 -4.940 11.468 1.00 . A A . 36 PRO HG2 1 1 7 11806 1 1 36 PRO HG3 H 8.887 -4.867 12.486 1.00 . A A . 36 PRO HG3 1 1 7 11807 1 1 36 PRO N N 8.679 -2.569 10.361 1.00 . A A . 36 PRO N 1 1 7 11808 1 1 36 PRO O O 11.716 -2.392 10.085 1.00 . A A . 36 PRO O 1 1 7 11809 1 1 37 VAL C C 13.346 0.488 10.490 1.00 . A A . 37 VAL C 1 1 7 11810 1 1 37 VAL CA C 12.179 0.290 9.521 1.00 . A A . 37 VAL CA 1 1 7 11811 1 1 37 VAL CB C 11.783 1.575 8.791 1.00 . A A . 37 VAL CB 1 1 7 11812 1 1 37 VAL CG1 C 12.958 2.131 7.984 1.00 . A A . 37 VAL CG1 1 1 7 11813 1 1 37 VAL CG2 C 10.564 1.345 7.897 1.00 . A A . 37 VAL CG2 1 1 7 11814 1 1 37 VAL H H 10.378 0.444 10.557 1.00 . A A . 37 VAL H 1 1 7 11815 1 1 37 VAL HA H 12.465 -0.449 8.772 1.00 . A A . 37 VAL HA 1 1 7 11816 1 1 37 VAL HB H 11.512 2.317 9.542 1.00 . A A . 37 VAL HB 1 1 7 11817 1 1 37 VAL HG11 H 13.892 1.726 8.375 1.00 . A A . 37 VAL HG11 1 1 7 11818 1 1 37 VAL HG12 H 12.848 1.844 6.938 1.00 . A A . 37 VAL HG12 1 1 7 11819 1 1 37 VAL HG13 H 12.972 3.218 8.063 1.00 . A A . 37 VAL HG13 1 1 7 11820 1 1 37 VAL HG21 H 10.284 0.292 7.928 1.00 . A A . 37 VAL HG21 1 1 7 11821 1 1 37 VAL HG22 H 9.731 1.952 8.253 1.00 . A A . 37 VAL HG22 1 1 7 11822 1 1 37 VAL HG23 H 10.806 1.627 6.872 1.00 . A A . 37 VAL HG23 1 1 7 11823 1 1 37 VAL N N 11.037 -0.241 10.247 1.00 . A A . 37 VAL N 1 1 7 11824 1 1 37 VAL O O 13.475 1.545 11.105 1.00 . A A . 37 VAL O 1 1 7 11825 1 1 38 ASN C C 14.842 -0.394 12.928 1.00 . A A . 38 ASN C 1 1 7 11826 1 1 38 ASN CA C 15.320 -0.499 11.479 1.00 . A A . 38 ASN CA 1 1 7 11827 1 1 38 ASN CB C 16.195 0.720 11.180 1.00 . A A . 38 ASN CB 1 1 7 11828 1 1 38 ASN CG C 17.461 0.314 10.424 1.00 . A A . 38 ASN CG 1 1 7 11829 1 1 38 ASN H H 14.057 -1.402 10.091 1.00 . A A . 38 ASN H 1 1 7 11830 1 1 38 ASN HA H 15.867 -1.423 11.286 1.00 . A A . 38 ASN HA 1 1 7 11831 1 1 38 ASN HB2 H 15.630 1.441 10.589 1.00 . A A . 38 ASN HB2 1 1 7 11832 1 1 38 ASN HB3 H 16.466 1.215 12.112 1.00 . A A . 38 ASN HB3 1 1 7 11833 1 1 38 ASN HD21 H 17.592 2.209 9.721 1.00 . A A . 38 ASN HD21 1 1 7 11834 1 1 38 ASN HD22 H 18.843 1.134 9.191 1.00 . A A . 38 ASN HD22 1 1 7 11835 1 1 38 ASN N N 14.168 -0.546 10.595 1.00 . A A . 38 ASN N 1 1 7 11836 1 1 38 ASN ND2 N 18.011 1.301 9.721 1.00 . A A . 38 ASN ND2 1 1 7 11837 1 1 38 ASN O O 14.758 -1.399 13.632 1.00 . A A . 38 ASN O 1 1 7 11838 1 1 38 ASN OD1 O 17.910 -0.819 10.475 1.00 . A A . 38 ASN OD1 1 1 7 11839 1 1 39 GLY C C 12.798 1.925 14.676 1.00 . A A . 39 GLY C 1 1 7 11840 1 1 39 GLY CA C 14.074 1.081 14.684 1.00 . A A . 39 GLY CA 1 1 7 11841 1 1 39 GLY H H 14.612 1.644 12.752 1.00 . A A . 39 GLY H 1 1 7 11842 1 1 39 GLY HA2 H 13.885 0.133 15.188 1.00 . A A . 39 GLY HA2 1 1 7 11843 1 1 39 GLY HA3 H 14.850 1.595 15.252 1.00 . A A . 39 GLY HA3 1 1 7 11844 1 1 39 GLY N N 14.541 0.832 13.331 1.00 . A A . 39 GLY N 1 1 7 11845 1 1 39 GLY O O 12.281 2.285 15.733 1.00 . A A . 39 GLY O 1 1 7 11846 1 1 40 LYS C C 9.908 2.080 13.237 1.00 . A A . 40 LYS C 1 1 7 11847 1 1 40 LYS CA C 11.120 3.010 13.314 1.00 . A A . 40 LYS CA 1 1 7 11848 1 1 40 LYS CB C 11.252 3.949 12.113 1.00 . A A . 40 LYS CB 1 1 7 11849 1 1 40 LYS CD C 13.273 4.600 10.753 1.00 . A A . 40 LYS CD 1 1 7 11850 1 1 40 LYS CE C 14.222 5.782 10.546 1.00 . A A . 40 LYS CE 1 1 7 11851 1 1 40 LYS CG C 12.601 4.670 12.126 1.00 . A A . 40 LYS CG 1 1 7 11852 1 1 40 LYS H H 12.752 1.919 12.618 1.00 . A A . 40 LYS H 1 1 7 11853 1 1 40 LYS HA H 11.020 3.634 14.202 1.00 . A A . 40 LYS HA 1 1 7 11854 1 1 40 LYS HB2 H 11.147 3.381 11.189 1.00 . A A . 40 LYS HB2 1 1 7 11855 1 1 40 LYS HB3 H 10.444 4.682 12.129 1.00 . A A . 40 LYS HB3 1 1 7 11856 1 1 40 LYS HD2 H 13.826 3.665 10.662 1.00 . A A . 40 LYS HD2 1 1 7 11857 1 1 40 LYS HD3 H 12.513 4.597 9.972 1.00 . A A . 40 LYS HD3 1 1 7 11858 1 1 40 LYS HE2 H 14.930 5.553 9.750 1.00 . A A . 40 LYS HE2 1 1 7 11859 1 1 40 LYS HE3 H 13.657 6.658 10.227 1.00 . A A . 40 LYS HE3 1 1 7 11860 1 1 40 LYS HG2 H 12.459 5.712 12.412 1.00 . A A . 40 LYS HG2 1 1 7 11861 1 1 40 LYS HG3 H 13.251 4.219 12.876 1.00 . A A . 40 LYS HG3 1 1 7 11862 1 1 40 LYS HZ1 H 14.325 6.228 12.579 1.00 . A A . 40 LYS HZ1 1 1 7 11863 1 1 40 LYS HZ2 H 15.583 5.335 12.059 1.00 . A A . 40 LYS HZ2 1 1 7 11864 1 1 40 LYS N N 12.326 2.216 13.473 1.00 . A A . 40 LYS N 1 1 7 11865 1 1 40 LYS NZ N 14.953 6.085 11.797 1.00 . A A . 40 LYS NZ 1 1 7 11866 1 1 40 LYS O O 9.970 1.024 12.608 1.00 . A A . 40 LYS O 1 1 7 11867 1 1 41 GLU C C 6.553 2.404 14.772 1.00 . A A . 41 GLU C 1 1 7 11868 1 1 41 GLU CA C 7.609 1.723 13.898 1.00 . A A . 41 GLU CA 1 1 7 11869 1 1 41 GLU CB C 7.876 0.294 14.374 1.00 . A A . 41 GLU CB 1 1 7 11870 1 1 41 GLU CD C 6.312 -1.684 14.443 1.00 . A A . 41 GLU CD 1 1 7 11871 1 1 41 GLU CG C 7.085 -0.718 13.542 1.00 . A A . 41 GLU CG 1 1 7 11872 1 1 41 GLU H H 8.791 3.365 14.394 1.00 . A A . 41 GLU H 1 1 7 11873 1 1 41 GLU HA H 7.270 1.697 12.862 1.00 . A A . 41 GLU HA 1 1 7 11874 1 1 41 GLU HB2 H 8.941 0.076 14.302 1.00 . A A . 41 GLU HB2 1 1 7 11875 1 1 41 GLU HB3 H 7.602 0.200 15.425 1.00 . A A . 41 GLU HB3 1 1 7 11876 1 1 41 GLU HG2 H 6.391 -0.192 12.887 1.00 . A A . 41 GLU HG2 1 1 7 11877 1 1 41 GLU HG3 H 7.766 -1.278 12.902 1.00 . A A . 41 GLU HG3 1 1 7 11878 1 1 41 GLU N N 8.833 2.505 13.885 1.00 . A A . 41 GLU N 1 1 7 11879 1 1 41 GLU O O 6.110 1.839 15.770 1.00 . A A . 41 GLU O 1 1 7 11880 1 1 41 GLU OE1 O 5.347 -1.213 15.083 1.00 . A A . 41 GLU OE1 1 1 7 11881 1 1 41 GLU OE2 O 6.705 -2.870 14.472 1.00 . A A . 41 GLU OE2 1 1 7 11882 1 1 42 ASP C C 4.119 4.878 14.126 1.00 . A A . 42 ASP C 1 1 7 11883 1 1 42 ASP CA C 5.187 4.373 15.098 1.00 . A A . 42 ASP CA 1 1 7 11884 1 1 42 ASP CB C 5.818 5.588 15.780 1.00 . A A . 42 ASP CB 1 1 7 11885 1 1 42 ASP CG C 6.788 6.388 14.907 1.00 . A A . 42 ASP CG 1 1 7 11886 1 1 42 ASP H H 6.547 4.062 13.551 1.00 . A A . 42 ASP H 1 1 7 11887 1 1 42 ASP HA H 4.784 3.682 15.839 1.00 . A A . 42 ASP HA 1 1 7 11888 1 1 42 ASP HB2 H 5.022 6.253 16.114 1.00 . A A . 42 ASP HB2 1 1 7 11889 1 1 42 ASP HB3 H 6.348 5.252 16.671 1.00 . A A . 42 ASP HB3 1 1 7 11890 1 1 42 ASP N N 6.181 3.609 14.365 1.00 . A A . 42 ASP N 1 1 7 11891 1 1 42 ASP O O 3.761 6.054 14.148 1.00 . A A . 42 ASP O 1 1 7 11892 1 1 42 ASP OD1 O 6.446 6.596 13.723 1.00 . A A . 42 ASP OD1 1 1 7 11893 1 1 42 ASP OD2 O 7.850 6.772 15.443 1.00 . A A . 42 ASP OD2 1 1 7 11894 1 1 43 TYR C C 2.956 5.614 11.606 1.00 . A A . 43 TYR C 1 1 7 11895 1 1 43 TYR CA C 2.620 4.301 12.317 1.00 . A A . 43 TYR CA 1 1 7 11896 1 1 43 TYR CB C 1.322 4.480 13.106 1.00 . A A . 43 TYR CB 1 1 7 11897 1 1 43 TYR CD1 C 1.614 2.170 14.075 1.00 . A A . 43 TYR CD1 1 1 7 11898 1 1 43 TYR CD2 C 0.461 3.808 15.379 1.00 . A A . 43 TYR CD2 1 1 7 11899 1 1 43 TYR CE1 C 1.429 1.204 15.126 1.00 . A A . 43 TYR CE1 1 1 7 11900 1 1 43 TYR CE2 C 0.276 2.842 16.430 1.00 . A A . 43 TYR CE2 1 1 7 11901 1 1 43 TYR CG C 1.125 3.453 14.223 1.00 . A A . 43 TYR CG 1 1 7 11902 1 1 43 TYR CZ C 0.770 1.587 16.252 1.00 . A A . 43 TYR CZ 1 1 7 11903 1 1 43 TYR H H 3.936 3.008 13.285 1.00 . A A . 43 TYR H 1 1 7 11904 1 1 43 TYR HA H 2.581 3.498 11.581 1.00 . A A . 43 TYR HA 1 1 7 11905 1 1 43 TYR HB2 H 1.306 5.480 13.539 1.00 . A A . 43 TYR HB2 1 1 7 11906 1 1 43 TYR HB3 H 0.479 4.418 12.417 1.00 . A A . 43 TYR HB3 1 1 7 11907 1 1 43 TYR HD1 H 2.139 1.889 13.162 1.00 . A A . 43 TYR HD1 1 1 7 11908 1 1 43 TYR HD2 H 0.075 4.821 15.496 1.00 . A A . 43 TYR HD2 1 1 7 11909 1 1 43 TYR HE1 H 1.810 0.187 15.022 1.00 . A A . 43 TYR HE1 1 1 7 11910 1 1 43 TYR HE2 H -0.247 3.110 17.348 1.00 . A A . 43 TYR HE2 1 1 7 11911 1 1 43 TYR HH H -0.321 0.278 17.188 1.00 . A A . 43 TYR HH 1 1 7 11912 1 1 43 TYR N N 3.640 3.963 13.296 1.00 . A A . 43 TYR N 1 1 7 11913 1 1 43 TYR O O 2.661 6.693 12.117 1.00 . A A . 43 TYR O 1 1 7 11914 1 1 43 TYR OH O 0.595 0.674 17.244 1.00 . A A . 43 TYR OH 1 1 7 11915 1 1 44 ARG C C 3.488 6.473 8.205 1.00 . A A . 44 ARG C 1 1 7 11916 1 1 44 ARG CA C 3.949 6.639 9.654 1.00 . A A . 44 ARG CA 1 1 7 11917 1 1 44 ARG CB C 5.464 6.851 9.679 1.00 . A A . 44 ARG CB 1 1 7 11918 1 1 44 ARG CD C 7.336 8.385 10.387 1.00 . A A . 44 ARG CD 1 1 7 11919 1 1 44 ARG CG C 5.819 8.198 10.310 1.00 . A A . 44 ARG CG 1 1 7 11920 1 1 44 ARG CZ C 8.836 9.576 11.994 1.00 . A A . 44 ARG CZ 1 1 7 11921 1 1 44 ARG H H 3.806 4.596 10.032 1.00 . A A . 44 ARG H 1 1 7 11922 1 1 44 ARG HA H 3.442 7.477 10.133 1.00 . A A . 44 ARG HA 1 1 7 11923 1 1 44 ARG HB2 H 5.938 6.046 10.242 1.00 . A A . 44 ARG HB2 1 1 7 11924 1 1 44 ARG HB3 H 5.858 6.805 8.664 1.00 . A A . 44 ARG HB3 1 1 7 11925 1 1 44 ARG HD2 H 7.838 7.442 10.172 1.00 . A A . 44 ARG HD2 1 1 7 11926 1 1 44 ARG HD3 H 7.662 9.099 9.632 1.00 . A A . 44 ARG HD3 1 1 7 11927 1 1 44 ARG HE H 7.113 8.648 12.499 1.00 . A A . 44 ARG HE 1 1 7 11928 1 1 44 ARG HG2 H 5.380 9.005 9.724 1.00 . A A . 44 ARG HG2 1 1 7 11929 1 1 44 ARG HG3 H 5.390 8.260 11.310 1.00 . A A . 44 ARG HG3 1 1 7 11930 1 1 44 ARG HH11 H 9.499 9.608 10.063 1.00 . A A . 44 ARG HH11 1 1 7 11931 1 1 44 ARG HH12 H 10.517 10.425 11.202 1.00 . A A . 44 ARG HH12 1 1 7 11932 1 1 44 ARG HH21 H 9.883 10.482 13.512 1.00 . A A . 44 ARG HH21 1 1 7 11933 1 1 44 ARG N N 3.569 5.478 10.440 1.00 . A A . 44 ARG N 1 1 7 11934 1 1 44 ARG NE N 7.719 8.865 11.734 1.00 . A A . 44 ARG NE 1 1 7 11935 1 1 44 ARG NH1 N 9.691 9.898 11.000 1.00 . A A . 44 ARG NH1 1 1 7 11936 1 1 44 ARG NH2 N 9.080 9.954 13.236 1.00 . A A . 44 ARG NH2 1 1 7 11937 1 1 44 ARG O O 3.081 5.386 7.800 1.00 . A A . 44 ARG O 1 1 7 11938 1 1 45 LYS C C 4.261 6.900 5.228 1.00 . A A . 45 LYS C 1 1 7 11939 1 1 45 LYS CA C 3.164 7.558 6.067 1.00 . A A . 45 LYS CA 1 1 7 11940 1 1 45 LYS CB C 2.799 8.970 5.604 1.00 . A A . 45 LYS CB 1 1 7 11941 1 1 45 LYS CD C 1.672 10.251 7.462 1.00 . A A . 45 LYS CD 1 1 7 11942 1 1 45 LYS CE C 1.059 11.643 7.304 1.00 . A A . 45 LYS CE 1 1 7 11943 1 1 45 LYS CG C 1.460 9.413 6.199 1.00 . A A . 45 LYS CG 1 1 7 11944 1 1 45 LYS H H 3.901 8.449 7.800 1.00 . A A . 45 LYS H 1 1 7 11945 1 1 45 LYS HA H 2.262 6.951 5.993 1.00 . A A . 45 LYS HA 1 1 7 11946 1 1 45 LYS HB2 H 3.581 9.668 5.901 1.00 . A A . 45 LYS HB2 1 1 7 11947 1 1 45 LYS HB3 H 2.744 8.997 4.516 1.00 . A A . 45 LYS HB3 1 1 7 11948 1 1 45 LYS HD2 H 1.223 9.746 8.317 1.00 . A A . 45 LYS HD2 1 1 7 11949 1 1 45 LYS HD3 H 2.739 10.340 7.668 1.00 . A A . 45 LYS HD3 1 1 7 11950 1 1 45 LYS HE2 H 0.400 11.661 6.436 1.00 . A A . 45 LYS HE2 1 1 7 11951 1 1 45 LYS HE3 H 0.445 11.877 8.174 1.00 . A A . 45 LYS HE3 1 1 7 11952 1 1 45 LYS HG2 H 0.905 9.993 5.462 1.00 . A A . 45 LYS HG2 1 1 7 11953 1 1 45 LYS HG3 H 0.856 8.537 6.437 1.00 . A A . 45 LYS HG3 1 1 7 11954 1 1 45 LYS HZ1 H 2.252 13.205 7.997 1.00 . A A . 45 LYS HZ1 1 1 7 11955 1 1 45 LYS HZ2 H 3.017 12.247 6.926 1.00 . A A . 45 LYS HZ2 1 1 7 11956 1 1 45 LYS N N 3.568 7.568 7.463 1.00 . A A . 45 LYS N 1 1 7 11957 1 1 45 LYS NZ N 2.120 12.663 7.150 1.00 . A A . 45 LYS NZ 1 1 7 11958 1 1 45 LYS O O 5.441 7.210 5.389 1.00 . A A . 45 LYS O 1 1 7 11959 1 1 46 CYS C C 5.493 6.332 2.622 1.00 . A A . 46 CYS C 1 1 7 11960 1 1 46 CYS CA C 4.766 5.300 3.486 1.00 . A A . 46 CYS CA 1 1 7 11961 1 1 46 CYS CB C 4.060 4.241 2.636 1.00 . A A . 46 CYS CB 1 1 7 11962 1 1 46 CYS H H 2.873 5.759 4.225 1.00 . A A . 46 CYS H 1 1 7 11963 1 1 46 CYS HA H 5.466 4.780 4.138 1.00 . A A . 46 CYS HA 1 1 7 11964 1 1 46 CYS HB2 H 3.663 4.719 1.741 1.00 . A A . 46 CYS HB2 1 1 7 11965 1 1 46 CYS HB3 H 4.797 3.510 2.307 1.00 . A A . 46 CYS HB3 1 1 7 11966 1 1 46 CYS N N 3.834 6.005 4.350 1.00 . A A . 46 CYS N 1 1 7 11967 1 1 46 CYS O O 6.722 6.345 2.566 1.00 . A A . 46 CYS O 1 1 7 11968 1 1 46 CYS SG S 2.698 3.361 3.484 1.00 . A A . 46 CYS SG 1 1 7 11969 1 1 47 GLY C C 5.857 9.344 1.938 1.00 . A A . 47 GLY C 1 1 7 11970 1 1 47 GLY CA C 5.257 8.206 1.110 1.00 . A A . 47 GLY CA 1 1 7 11971 1 1 47 GLY H H 3.705 7.156 2.020 1.00 . A A . 47 GLY H 1 1 7 11972 1 1 47 GLY HA2 H 6.025 7.776 0.467 1.00 . A A . 47 GLY HA2 1 1 7 11973 1 1 47 GLY HA3 H 4.477 8.598 0.458 1.00 . A A . 47 GLY HA3 1 1 7 11974 1 1 47 GLY N N 4.704 7.173 1.969 1.00 . A A . 47 GLY N 1 1 7 11975 1 1 47 GLY O O 5.517 10.509 1.736 1.00 . A A . 47 GLY O 1 1 7 11976 1 1 48 THR C C 8.773 10.294 3.169 1.00 . A A . 48 THR C 1 1 7 11977 1 1 48 THR CA C 7.387 9.942 3.713 1.00 . A A . 48 THR CA 1 1 7 11978 1 1 48 THR CB C 7.418 9.374 5.133 1.00 . A A . 48 THR CB 1 1 7 11979 1 1 48 THR CG2 C 8.464 10.059 6.016 1.00 . A A . 48 THR CG2 1 1 7 11980 1 1 48 THR H H 7.008 8.018 3.011 1.00 . A A . 48 THR H 1 1 7 11981 1 1 48 THR HA H 6.797 10.858 3.701 1.00 . A A . 48 THR HA 1 1 7 11982 1 1 48 THR HB H 7.569 8.294 5.117 1.00 . A A . 48 THR HB 1 1 7 11983 1 1 48 THR HG1 H 5.432 9.216 5.323 1.00 . A A . 48 THR HG1 1 1 7 11984 1 1 48 THR HG21 H 8.825 10.960 5.519 1.00 . A A . 48 THR HG21 1 1 7 11985 1 1 48 THR HG22 H 8.014 10.327 6.971 1.00 . A A . 48 THR HG22 1 1 7 11986 1 1 48 THR HG23 H 9.298 9.378 6.185 1.00 . A A . 48 THR HG23 1 1 7 11987 1 1 48 THR N N 6.738 8.967 2.853 1.00 . A A . 48 THR N 1 1 7 11988 1 1 48 THR O O 9.549 9.407 2.818 1.00 . A A . 48 THR O 1 1 7 11989 1 1 48 THR OG1 O 6.172 9.776 5.696 1.00 . A A . 48 THR OG1 1 1 7 11990 1 1 49 ALA C C 11.450 11.402 3.406 1.00 . A A . 49 ALA C 1 1 7 11991 1 1 49 ALA CA C 10.320 12.070 2.620 1.00 . A A . 49 ALA CA 1 1 7 11992 1 1 49 ALA CB C 10.366 13.596 2.717 1.00 . A A . 49 ALA CB 1 1 7 11993 1 1 49 ALA H H 8.405 12.305 3.404 1.00 . A A . 49 ALA H 1 1 7 11994 1 1 49 ALA HA H 10.399 11.783 1.572 1.00 . A A . 49 ALA HA 1 1 7 11995 1 1 49 ALA HB1 H 9.551 13.944 3.353 1.00 . A A . 49 ALA HB1 1 1 7 11996 1 1 49 ALA HB2 H 11.319 13.905 3.147 1.00 . A A . 49 ALA HB2 1 1 7 11997 1 1 49 ALA HB3 H 10.259 14.027 1.722 1.00 . A A . 49 ALA HB3 1 1 7 11998 1 1 49 ALA N N 9.042 11.590 3.116 1.00 . A A . 49 ALA N 1 1 7 11999 1 1 49 ALA O O 11.629 11.670 4.593 1.00 . A A . 49 ALA O 1 1 7 12000 1 1 50 GLY C C 13.025 8.330 3.370 1.00 . A A . 50 GLY C 1 1 7 12001 1 1 50 GLY CA C 13.292 9.836 3.330 1.00 . A A . 50 GLY CA 1 1 7 12002 1 1 50 GLY H H 12.033 10.332 1.747 1.00 . A A . 50 GLY H 1 1 7 12003 1 1 50 GLY HA2 H 14.209 10.031 2.774 1.00 . A A . 50 GLY HA2 1 1 7 12004 1 1 50 GLY HA3 H 13.447 10.208 4.343 1.00 . A A . 50 GLY HA3 1 1 7 12005 1 1 50 GLY N N 12.184 10.545 2.712 1.00 . A A . 50 GLY N 1 1 7 12006 1 1 50 GLY O O 13.946 7.537 3.561 1.00 . A A . 50 GLY O 1 1 7 12007 1 1 51 CYS C C 11.153 6.129 1.754 1.00 . A A . 51 CYS C 1 1 7 12008 1 1 51 CYS CA C 11.360 6.583 3.201 1.00 . A A . 51 CYS CA 1 1 7 12009 1 1 51 CYS CB C 10.109 6.361 4.053 1.00 . A A . 51 CYS CB 1 1 7 12010 1 1 51 CYS H H 11.017 8.631 3.032 1.00 . A A . 51 CYS H 1 1 7 12011 1 1 51 CYS HA H 12.174 6.029 3.668 1.00 . A A . 51 CYS HA 1 1 7 12012 1 1 51 CYS HB2 H 9.305 7.012 3.710 1.00 . A A . 51 CYS HB2 1 1 7 12013 1 1 51 CYS HB3 H 9.759 5.335 3.940 1.00 . A A . 51 CYS HB3 1 1 7 12014 1 1 51 CYS N N 11.760 7.980 3.187 1.00 . A A . 51 CYS N 1 1 7 12015 1 1 51 CYS O O 12.104 5.729 1.084 1.00 . A A . 51 CYS O 1 1 7 12016 1 1 51 CYS SG S 10.481 6.703 5.812 1.00 . A A . 51 CYS SG 1 1 7 12017 1 1 52 HIS C C 9.313 7.051 -0.892 1.00 . A A . 52 HIS C 1 1 7 12018 1 1 52 HIS CA C 9.561 5.807 -0.038 1.00 . A A . 52 HIS CA 1 1 7 12019 1 1 52 HIS CB C 8.374 4.842 -0.035 1.00 . A A . 52 HIS CB 1 1 7 12020 1 1 52 HIS CD2 C 8.250 2.965 1.780 1.00 . A A . 52 HIS CD2 1 1 7 12021 1 1 52 HIS CE1 C 9.550 1.501 0.802 1.00 . A A . 52 HIS CE1 1 1 7 12022 1 1 52 HIS CG C 8.670 3.504 0.599 1.00 . A A . 52 HIS CG 1 1 7 12023 1 1 52 HIS H H 9.138 6.532 1.868 1.00 . A A . 52 HIS H 1 1 7 12024 1 1 52 HIS HA H 10.424 5.271 -0.434 1.00 . A A . 52 HIS HA 1 1 7 12025 1 1 52 HIS HB2 H 7.542 5.308 0.494 1.00 . A A . 52 HIS HB2 1 1 7 12026 1 1 52 HIS HB3 H 8.047 4.681 -1.063 1.00 . A A . 52 HIS HB3 1 1 7 12027 1 1 52 HIS HD1 H 9.953 2.656 -0.873 1.00 . A A . 52 HIS HD1 1 1 7 12028 1 1 52 HIS HD2 H 7.590 3.447 2.501 1.00 . A A . 52 HIS HD2 1 1 7 12029 1 1 52 HIS HE1 H 10.116 0.589 0.613 1.00 . A A . 52 HIS HE1 1 1 7 12030 1 1 52 HIS N N 9.905 6.206 1.317 1.00 . A A . 52 HIS N 1 1 7 12031 1 1 52 HIS ND1 N 9.488 2.558 0.006 1.00 . A A . 52 HIS ND1 1 1 7 12032 1 1 52 HIS NE2 N 8.782 1.755 1.901 1.00 . A A . 52 HIS NE2 1 1 7 12033 1 1 52 HIS O O 8.179 7.324 -1.283 1.00 . A A . 52 HIS O 1 1 7 12034 1 1 53 ASP C C 11.353 8.930 -3.069 1.00 . A A . 53 ASP C 1 1 7 12035 1 1 53 ASP CA C 10.304 8.984 -1.956 1.00 . A A . 53 ASP CA 1 1 7 12036 1 1 53 ASP CB C 10.580 10.227 -1.107 1.00 . A A . 53 ASP CB 1 1 7 12037 1 1 53 ASP CG C 9.900 11.507 -1.596 1.00 . A A . 53 ASP CG 1 1 7 12038 1 1 53 ASP H H 11.310 7.546 -0.833 1.00 . A A . 53 ASP H 1 1 7 12039 1 1 53 ASP HA H 9.286 8.999 -2.342 1.00 . A A . 53 ASP HA 1 1 7 12040 1 1 53 ASP HB2 H 10.256 10.029 -0.085 1.00 . A A . 53 ASP HB2 1 1 7 12041 1 1 53 ASP HB3 H 11.656 10.394 -1.073 1.00 . A A . 53 ASP HB3 1 1 7 12042 1 1 53 ASP N N 10.391 7.774 -1.156 1.00 . A A . 53 ASP N 1 1 7 12043 1 1 53 ASP O O 12.384 9.595 -2.988 1.00 . A A . 53 ASP O 1 1 7 12044 1 1 53 ASP OD1 O 10.488 12.156 -2.488 1.00 . A A . 53 ASP OD1 1 1 7 12045 1 1 53 ASP OD2 O 8.809 11.809 -1.067 1.00 . A A . 53 ASP OD2 1 1 7 12046 1 1 54 SER C C 11.343 8.619 -6.460 1.00 . A A . 54 SER C 1 1 7 12047 1 1 54 SER CA C 11.956 7.983 -5.211 1.00 . A A . 54 SER CA 1 1 7 12048 1 1 54 SER CB C 12.276 6.509 -5.469 1.00 . A A . 54 SER CB 1 1 7 12049 1 1 54 SER H H 10.211 7.595 -4.142 1.00 . A A . 54 SER H 1 1 7 12050 1 1 54 SER HA H 12.867 8.507 -4.923 1.00 . A A . 54 SER HA 1 1 7 12051 1 1 54 SER HB2 H 12.406 5.995 -4.516 1.00 . A A . 54 SER HB2 1 1 7 12052 1 1 54 SER HB3 H 11.433 6.038 -5.974 1.00 . A A . 54 SER HB3 1 1 7 12053 1 1 54 SER HG H 13.218 5.946 -7.142 1.00 . A A . 54 SER HG 1 1 7 12054 1 1 54 SER N N 11.052 8.132 -4.083 1.00 . A A . 54 SER N 1 1 7 12055 1 1 54 SER O O 12.058 8.970 -7.397 1.00 . A A . 54 SER O 1 1 7 12056 1 1 54 SER OG O 13.452 6.349 -6.258 1.00 . A A . 54 SER OG 1 1 7 12057 1 1 55 MET C C 9.826 8.789 -8.884 1.00 . A A . 55 MET C 1 1 7 12058 1 1 55 MET CA C 9.307 9.335 -7.553 1.00 . A A . 55 MET CA 1 1 7 12059 1 1 55 MET CB C 9.474 10.856 -7.525 1.00 . A A . 55 MET CB 1 1 7 12060 1 1 55 MET CE C 7.341 9.965 -4.819 1.00 . A A . 55 MET CE 1 1 7 12061 1 1 55 MET CG C 8.269 11.528 -6.862 1.00 . A A . 55 MET CG 1 1 7 12062 1 1 55 MET H H 9.450 8.460 -5.668 1.00 . A A . 55 MET H 1 1 7 12063 1 1 55 MET HA H 8.265 9.048 -7.415 1.00 . A A . 55 MET HA 1 1 7 12064 1 1 55 MET HB2 H 10.383 11.116 -6.983 1.00 . A A . 55 MET HB2 1 1 7 12065 1 1 55 MET HB3 H 9.591 11.231 -8.541 1.00 . A A . 55 MET HB3 1 1 7 12066 1 1 55 MET HE1 H 7.595 9.185 -5.536 1.00 . A A . 55 MET HE1 1 1 7 12067 1 1 55 MET HE2 H 7.490 9.590 -3.806 1.00 . A A . 55 MET HE2 1 1 7 12068 1 1 55 MET HE3 H 6.299 10.254 -4.950 1.00 . A A . 55 MET HE3 1 1 7 12069 1 1 55 MET HG2 H 8.226 12.578 -7.148 1.00 . A A . 55 MET HG2 1 1 7 12070 1 1 55 MET HG3 H 7.347 11.064 -7.211 1.00 . A A . 55 MET HG3 1 1 7 12071 1 1 55 MET N N 10.024 8.748 -6.434 1.00 . A A . 55 MET N 1 1 7 12072 1 1 55 MET O O 9.901 9.518 -9.872 1.00 . A A . 55 MET O 1 1 7 12073 1 1 55 MET SD S 8.390 11.384 -5.087 1.00 . A A . 55 MET SD 1 1 7 12074 1 1 56 ASP C C 10.065 5.462 -10.178 1.00 . A A . 56 ASP C 1 1 7 12075 1 1 56 ASP CA C 10.682 6.857 -10.062 1.00 . A A . 56 ASP CA 1 1 7 12076 1 1 56 ASP CB C 12.202 6.698 -9.995 1.00 . A A . 56 ASP CB 1 1 7 12077 1 1 56 ASP CG C 12.929 6.873 -11.330 1.00 . A A . 56 ASP CG 1 1 7 12078 1 1 56 ASP H H 10.107 6.924 -8.061 1.00 . A A . 56 ASP H 1 1 7 12079 1 1 56 ASP HA H 10.398 7.509 -10.888 1.00 . A A . 56 ASP HA 1 1 7 12080 1 1 56 ASP HB2 H 12.598 7.424 -9.285 1.00 . A A . 56 ASP HB2 1 1 7 12081 1 1 56 ASP HB3 H 12.432 5.708 -9.601 1.00 . A A . 56 ASP HB3 1 1 7 12082 1 1 56 ASP N N 10.172 7.510 -8.868 1.00 . A A . 56 ASP N 1 1 7 12083 1 1 56 ASP O O 10.644 4.483 -9.711 1.00 . A A . 56 ASP O 1 1 7 12084 1 1 56 ASP OD1 O 12.631 7.878 -12.011 1.00 . A A . 56 ASP OD1 1 1 7 12085 1 1 56 ASP OD2 O 13.768 5.999 -11.638 1.00 . A A . 56 ASP OD2 1 1 7 12086 1 1 57 LYS C C 9.098 3.182 -11.747 1.00 . A A . 57 LYS C 1 1 7 12087 1 1 57 LYS CA C 8.196 4.157 -10.988 1.00 . A A . 57 LYS CA 1 1 7 12088 1 1 57 LYS CB C 6.841 4.392 -11.658 1.00 . A A . 57 LYS CB 1 1 7 12089 1 1 57 LYS CD C 6.335 2.931 -13.651 1.00 . A A . 57 LYS CD 1 1 7 12090 1 1 57 LYS CE C 4.953 2.771 -14.286 1.00 . A A . 57 LYS CE 1 1 7 12091 1 1 57 LYS CG C 6.228 3.072 -12.131 1.00 . A A . 57 LYS CG 1 1 7 12092 1 1 57 LYS H H 8.434 6.218 -11.182 1.00 . A A . 57 LYS H 1 1 7 12093 1 1 57 LYS HA H 7.999 3.746 -9.998 1.00 . A A . 57 LYS HA 1 1 7 12094 1 1 57 LYS HB2 H 6.164 4.882 -10.959 1.00 . A A . 57 LYS HB2 1 1 7 12095 1 1 57 LYS HB3 H 6.963 5.065 -12.507 1.00 . A A . 57 LYS HB3 1 1 7 12096 1 1 57 LYS HD2 H 6.832 3.807 -14.067 1.00 . A A . 57 LYS HD2 1 1 7 12097 1 1 57 LYS HD3 H 6.954 2.068 -13.896 1.00 . A A . 57 LYS HD3 1 1 7 12098 1 1 57 LYS HE2 H 4.971 1.960 -15.014 1.00 . A A . 57 LYS HE2 1 1 7 12099 1 1 57 LYS HE3 H 4.225 2.497 -13.522 1.00 . A A . 57 LYS HE3 1 1 7 12100 1 1 57 LYS HG2 H 6.735 2.238 -11.648 1.00 . A A . 57 LYS HG2 1 1 7 12101 1 1 57 LYS HG3 H 5.181 3.026 -11.831 1.00 . A A . 57 LYS HG3 1 1 7 12102 1 1 57 LYS HZ1 H 3.686 4.406 -14.545 1.00 . A A . 57 LYS HZ1 1 1 7 12103 1 1 57 LYS HZ2 H 5.245 4.751 -14.867 1.00 . A A . 57 LYS HZ2 1 1 7 12104 1 1 57 LYS N N 8.898 5.416 -10.804 1.00 . A A . 57 LYS N 1 1 7 12105 1 1 57 LYS NZ N 4.537 4.029 -14.946 1.00 . A A . 57 LYS NZ 1 1 7 12106 1 1 57 LYS O O 9.452 2.125 -11.227 1.00 . A A . 57 LYS O 1 1 7 12107 1 1 58 LYS C C 11.720 2.760 -13.243 1.00 . A A . 58 LYS C 1 1 7 12108 1 1 58 LYS CA C 10.296 2.744 -13.802 1.00 . A A . 58 LYS CA 1 1 7 12109 1 1 58 LYS CB C 10.204 3.187 -15.264 1.00 . A A . 58 LYS CB 1 1 7 12110 1 1 58 LYS CD C 9.011 2.682 -17.428 1.00 . A A . 58 LYS CD 1 1 7 12111 1 1 58 LYS CE C 7.714 3.166 -18.079 1.00 . A A . 58 LYS CE 1 1 7 12112 1 1 58 LYS CG C 8.900 2.704 -15.902 1.00 . A A . 58 LYS CG 1 1 7 12113 1 1 58 LYS H H 9.151 4.433 -13.381 1.00 . A A . 58 LYS H 1 1 7 12114 1 1 58 LYS HA H 9.915 1.724 -13.749 1.00 . A A . 58 LYS HA 1 1 7 12115 1 1 58 LYS HB2 H 10.262 4.273 -15.323 1.00 . A A . 58 LYS HB2 1 1 7 12116 1 1 58 LYS HB3 H 11.054 2.792 -15.821 1.00 . A A . 58 LYS HB3 1 1 7 12117 1 1 58 LYS HD2 H 9.840 3.316 -17.744 1.00 . A A . 58 LYS HD2 1 1 7 12118 1 1 58 LYS HD3 H 9.237 1.670 -17.765 1.00 . A A . 58 LYS HD3 1 1 7 12119 1 1 58 LYS HE2 H 6.917 2.445 -17.896 1.00 . A A . 58 LYS HE2 1 1 7 12120 1 1 58 LYS HE3 H 7.402 4.107 -17.626 1.00 . A A . 58 LYS HE3 1 1 7 12121 1 1 58 LYS HG2 H 8.661 1.705 -15.537 1.00 . A A . 58 LYS HG2 1 1 7 12122 1 1 58 LYS HG3 H 8.081 3.357 -15.602 1.00 . A A . 58 LYS HG3 1 1 7 12123 1 1 58 LYS HZ1 H 8.871 3.527 -19.774 1.00 . A A . 58 LYS HZ1 1 1 7 12124 1 1 58 LYS HZ2 H 7.617 2.527 -20.060 1.00 . A A . 58 LYS HZ2 1 1 7 12125 1 1 58 LYS N N 9.443 3.571 -12.966 1.00 . A A . 58 LYS N 1 1 7 12126 1 1 58 LYS NZ N 7.902 3.347 -19.535 1.00 . A A . 58 LYS NZ 1 1 7 12127 1 1 58 LYS O O 12.640 3.258 -13.891 1.00 . A A . 58 LYS O 1 1 7 12128 1 1 59 ASP C C 13.225 0.902 -10.514 1.00 . A A . 59 ASP C 1 1 7 12129 1 1 59 ASP CA C 13.155 2.152 -11.394 1.00 . A A . 59 ASP CA 1 1 7 12130 1 1 59 ASP CB C 13.374 3.373 -10.498 1.00 . A A . 59 ASP CB 1 1 7 12131 1 1 59 ASP CG C 14.825 3.848 -10.395 1.00 . A A . 59 ASP CG 1 1 7 12132 1 1 59 ASP H H 11.106 1.804 -11.527 1.00 . A A . 59 ASP H 1 1 7 12133 1 1 59 ASP HA H 13.884 2.132 -12.204 1.00 . A A . 59 ASP HA 1 1 7 12134 1 1 59 ASP HB2 H 12.765 4.194 -10.875 1.00 . A A . 59 ASP HB2 1 1 7 12135 1 1 59 ASP HB3 H 13.011 3.141 -9.497 1.00 . A A . 59 ASP HB3 1 1 7 12136 1 1 59 ASP N N 11.859 2.207 -12.047 1.00 . A A . 59 ASP N 1 1 7 12137 1 1 59 ASP O O 14.202 0.157 -10.564 1.00 . A A . 59 ASP O 1 1 7 12138 1 1 59 ASP OD1 O 15.589 3.547 -11.337 1.00 . A A . 59 ASP OD1 1 1 7 12139 1 1 59 ASP OD2 O 15.137 4.500 -9.375 1.00 . A A . 59 ASP OD2 1 1 7 12140 1 1 60 LYS C C 12.784 -0.088 -7.511 1.00 . A A . 60 LYS C 1 1 7 12141 1 1 60 LYS CA C 12.105 -0.435 -8.838 1.00 . A A . 60 LYS CA 1 1 7 12142 1 1 60 LYS CB C 12.684 -1.678 -9.518 1.00 . A A . 60 LYS CB 1 1 7 12143 1 1 60 LYS CD C 11.477 -3.641 -10.542 1.00 . A A . 60 LYS CD 1 1 7 12144 1 1 60 LYS CE C 10.122 -3.189 -11.090 1.00 . A A . 60 LYS CE 1 1 7 12145 1 1 60 LYS CG C 11.816 -2.907 -9.243 1.00 . A A . 60 LYS CG 1 1 7 12146 1 1 60 LYS H H 11.384 1.322 -9.693 1.00 . A A . 60 LYS H 1 1 7 12147 1 1 60 LYS HA H 11.051 -0.635 -8.644 1.00 . A A . 60 LYS HA 1 1 7 12148 1 1 60 LYS HB2 H 12.752 -1.510 -10.593 1.00 . A A . 60 LYS HB2 1 1 7 12149 1 1 60 LYS HB3 H 13.697 -1.855 -9.158 1.00 . A A . 60 LYS HB3 1 1 7 12150 1 1 60 LYS HD2 H 12.254 -3.454 -11.283 1.00 . A A . 60 LYS HD2 1 1 7 12151 1 1 60 LYS HD3 H 11.460 -4.716 -10.362 1.00 . A A . 60 LYS HD3 1 1 7 12152 1 1 60 LYS HE2 H 9.362 -3.935 -10.859 1.00 . A A . 60 LYS HE2 1 1 7 12153 1 1 60 LYS HE3 H 9.817 -2.263 -10.603 1.00 . A A . 60 LYS HE3 1 1 7 12154 1 1 60 LYS HG2 H 12.340 -3.582 -8.565 1.00 . A A . 60 LYS HG2 1 1 7 12155 1 1 60 LYS HG3 H 10.897 -2.604 -8.742 1.00 . A A . 60 LYS HG3 1 1 7 12156 1 1 60 LYS HZ1 H 10.980 -3.481 -12.967 1.00 . A A . 60 LYS HZ1 1 1 7 12157 1 1 60 LYS HZ2 H 9.361 -3.311 -13.026 1.00 . A A . 60 LYS HZ2 1 1 7 12158 1 1 60 LYS N N 12.175 0.711 -9.728 1.00 . A A . 60 LYS N 1 1 7 12159 1 1 60 LYS NZ N 10.198 -2.985 -12.554 1.00 . A A . 60 LYS NZ 1 1 7 12160 1 1 60 LYS O O 12.791 1.071 -7.098 1.00 . A A . 60 LYS O 1 1 7 12161 1 1 61 SER C C 12.995 -0.679 -4.501 1.00 . A A . 61 SER C 1 1 7 12162 1 1 61 SER CA C 14.019 -0.930 -5.610 1.00 . A A . 61 SER CA 1 1 7 12163 1 1 61 SER CB C 15.019 0.225 -5.681 1.00 . A A . 61 SER CB 1 1 7 12164 1 1 61 SER H H 13.329 -2.052 -7.224 1.00 . A A . 61 SER H 1 1 7 12165 1 1 61 SER HA H 14.554 -1.863 -5.433 1.00 . A A . 61 SER HA 1 1 7 12166 1 1 61 SER HB2 H 14.921 0.731 -6.642 1.00 . A A . 61 SER HB2 1 1 7 12167 1 1 61 SER HB3 H 14.781 0.958 -4.910 1.00 . A A . 61 SER HB3 1 1 7 12168 1 1 61 SER HG H 16.631 -0.794 -6.287 1.00 . A A . 61 SER HG 1 1 7 12169 1 1 61 SER N N 13.339 -1.113 -6.881 1.00 . A A . 61 SER N 1 1 7 12170 1 1 61 SER O O 11.814 -0.476 -4.776 1.00 . A A . 61 SER O 1 1 7 12171 1 1 61 SER OG O 16.362 -0.220 -5.514 1.00 . A A . 61 SER OG 1 1 7 12172 1 1 62 ALA C C 12.217 0.993 -2.072 1.00 . A A . 62 ALA C 1 1 7 12173 1 1 62 ALA CA C 12.629 -0.479 -2.118 1.00 . A A . 62 ALA CA 1 1 7 12174 1 1 62 ALA CB C 13.357 -0.921 -0.847 1.00 . A A . 62 ALA CB 1 1 7 12175 1 1 62 ALA H H 14.449 -0.867 -3.055 1.00 . A A . 62 ALA H 1 1 7 12176 1 1 62 ALA HA H 11.738 -1.094 -2.244 1.00 . A A . 62 ALA HA 1 1 7 12177 1 1 62 ALA HB1 H 13.899 -1.847 -1.042 1.00 . A A . 62 ALA HB1 1 1 7 12178 1 1 62 ALA HB2 H 14.061 -0.146 -0.543 1.00 . A A . 62 ALA HB2 1 1 7 12179 1 1 62 ALA HB3 H 12.631 -1.086 -0.051 1.00 . A A . 62 ALA HB3 1 1 7 12180 1 1 62 ALA N N 13.486 -0.702 -3.270 1.00 . A A . 62 ALA N 1 1 7 12181 1 1 62 ALA O O 11.118 1.320 -1.624 1.00 . A A . 62 ALA O 1 1 7 12182 1 1 63 LYS C C 11.697 3.566 -3.503 1.00 . A A . 63 LYS C 1 1 7 12183 1 1 63 LYS CA C 12.863 3.273 -2.557 1.00 . A A . 63 LYS CA 1 1 7 12184 1 1 63 LYS CB C 14.140 4.042 -2.898 1.00 . A A . 63 LYS CB 1 1 7 12185 1 1 63 LYS CD C 16.039 5.308 -1.824 1.00 . A A . 63 LYS CD 1 1 7 12186 1 1 63 LYS CE C 17.012 5.357 -0.644 1.00 . A A . 63 LYS CE 1 1 7 12187 1 1 63 LYS CG C 15.065 4.136 -1.683 1.00 . A A . 63 LYS CG 1 1 7 12188 1 1 63 LYS H H 14.010 1.569 -2.903 1.00 . A A . 63 LYS H 1 1 7 12189 1 1 63 LYS HA H 12.571 3.564 -1.548 1.00 . A A . 63 LYS HA 1 1 7 12190 1 1 63 LYS HB2 H 14.660 3.546 -3.718 1.00 . A A . 63 LYS HB2 1 1 7 12191 1 1 63 LYS HB3 H 13.885 5.044 -3.244 1.00 . A A . 63 LYS HB3 1 1 7 12192 1 1 63 LYS HD2 H 16.596 5.212 -2.756 1.00 . A A . 63 LYS HD2 1 1 7 12193 1 1 63 LYS HD3 H 15.482 6.243 -1.881 1.00 . A A . 63 LYS HD3 1 1 7 12194 1 1 63 LYS HE2 H 16.475 5.171 0.286 1.00 . A A . 63 LYS HE2 1 1 7 12195 1 1 63 LYS HE3 H 17.756 4.568 -0.746 1.00 . A A . 63 LYS HE3 1 1 7 12196 1 1 63 LYS HG2 H 14.470 4.260 -0.778 1.00 . A A . 63 LYS HG2 1 1 7 12197 1 1 63 LYS HG3 H 15.622 3.206 -1.572 1.00 . A A . 63 LYS HG3 1 1 7 12198 1 1 63 LYS HZ1 H 17.108 7.372 -0.121 1.00 . A A . 63 LYS HZ1 1 1 7 12199 1 1 63 LYS HZ2 H 18.557 6.631 -0.069 1.00 . A A . 63 LYS HZ2 1 1 7 12200 1 1 63 LYS N N 13.119 1.843 -2.540 1.00 . A A . 63 LYS N 1 1 7 12201 1 1 63 LYS NZ N 17.683 6.675 -0.581 1.00 . A A . 63 LYS NZ 1 1 7 12202 1 1 63 LYS O O 11.074 4.624 -3.418 1.00 . A A . 63 LYS O 1 1 7 12203 1 1 64 GLY C C 8.993 2.664 -4.657 1.00 . A A . 64 GLY C 1 1 7 12204 1 1 64 GLY CA C 10.356 2.754 -5.346 1.00 . A A . 64 GLY CA 1 1 7 12205 1 1 64 GLY H H 11.947 1.754 -4.447 1.00 . A A . 64 GLY H 1 1 7 12206 1 1 64 GLY HA2 H 10.446 3.712 -5.858 1.00 . A A . 64 GLY HA2 1 1 7 12207 1 1 64 GLY HA3 H 10.436 1.977 -6.106 1.00 . A A . 64 GLY HA3 1 1 7 12208 1 1 64 GLY N N 11.436 2.611 -4.384 1.00 . A A . 64 GLY N 1 1 7 12209 1 1 64 GLY O O 8.431 1.578 -4.525 1.00 . A A . 64 GLY O 1 1 7 12210 1 1 65 TYR C C 6.139 3.148 -4.365 1.00 . A A . 65 TYR C 1 1 7 12211 1 1 65 TYR CA C 7.214 3.885 -3.563 1.00 . A A . 65 TYR CA 1 1 7 12212 1 1 65 TYR CB C 6.852 5.369 -3.490 1.00 . A A . 65 TYR CB 1 1 7 12213 1 1 65 TYR CD1 C 5.021 5.429 -1.757 1.00 . A A . 65 TYR CD1 1 1 7 12214 1 1 65 TYR CD2 C 4.487 6.084 -3.993 1.00 . A A . 65 TYR CD2 1 1 7 12215 1 1 65 TYR CE1 C 3.661 5.681 -1.358 1.00 . A A . 65 TYR CE1 1 1 7 12216 1 1 65 TYR CE2 C 3.126 6.335 -3.594 1.00 . A A . 65 TYR CE2 1 1 7 12217 1 1 65 TYR CG C 5.406 5.636 -3.066 1.00 . A A . 65 TYR CG 1 1 7 12218 1 1 65 TYR CZ C 2.780 6.121 -2.296 1.00 . A A . 65 TYR CZ 1 1 7 12219 1 1 65 TYR H H 8.964 4.699 -4.347 1.00 . A A . 65 TYR H 1 1 7 12220 1 1 65 TYR HA H 7.320 3.409 -2.588 1.00 . A A . 65 TYR HA 1 1 7 12221 1 1 65 TYR HB2 H 7.522 5.863 -2.787 1.00 . A A . 65 TYR HB2 1 1 7 12222 1 1 65 TYR HB3 H 7.023 5.824 -4.466 1.00 . A A . 65 TYR HB3 1 1 7 12223 1 1 65 TYR HD1 H 5.747 5.076 -1.025 1.00 . A A . 65 TYR HD1 1 1 7 12224 1 1 65 TYR HD2 H 4.790 6.248 -5.027 1.00 . A A . 65 TYR HD2 1 1 7 12225 1 1 65 TYR HE1 H 3.343 5.521 -0.327 1.00 . A A . 65 TYR HE1 1 1 7 12226 1 1 65 TYR HE2 H 2.390 6.689 -4.316 1.00 . A A . 65 TYR HE2 1 1 7 12227 1 1 65 TYR HH H 1.377 7.327 -1.697 1.00 . A A . 65 TYR HH 1 1 7 12228 1 1 65 TYR N N 8.501 3.820 -4.236 1.00 . A A . 65 TYR N 1 1 7 12229 1 1 65 TYR O O 5.267 2.499 -3.790 1.00 . A A . 65 TYR O 1 1 7 12230 1 1 65 TYR OH O 1.495 6.359 -1.919 1.00 . A A . 65 TYR OH 1 1 7 12231 1 1 66 TYR C C 5.624 1.150 -6.756 1.00 . A A . 66 TYR C 1 1 7 12232 1 1 66 TYR CA C 5.282 2.629 -6.566 1.00 . A A . 66 TYR CA 1 1 7 12233 1 1 66 TYR CB C 5.406 3.346 -7.913 1.00 . A A . 66 TYR CB 1 1 7 12234 1 1 66 TYR CD1 C 5.600 1.565 -9.687 1.00 . A A . 66 TYR CD1 1 1 7 12235 1 1 66 TYR CD2 C 3.574 2.827 -9.565 1.00 . A A . 66 TYR CD2 1 1 7 12236 1 1 66 TYR CE1 C 5.069 0.819 -10.798 1.00 . A A . 66 TYR CE1 1 1 7 12237 1 1 66 TYR CE2 C 3.042 2.081 -10.676 1.00 . A A . 66 TYR CE2 1 1 7 12238 1 1 66 TYR CG C 4.841 2.553 -9.093 1.00 . A A . 66 TYR CG 1 1 7 12239 1 1 66 TYR CZ C 3.816 1.114 -11.238 1.00 . A A . 66 TYR CZ 1 1 7 12240 1 1 66 TYR H H 6.949 3.805 -6.140 1.00 . A A . 66 TYR H 1 1 7 12241 1 1 66 TYR HA H 4.294 2.711 -6.114 1.00 . A A . 66 TYR HA 1 1 7 12242 1 1 66 TYR HB2 H 4.890 4.304 -7.852 1.00 . A A . 66 TYR HB2 1 1 7 12243 1 1 66 TYR HB3 H 6.458 3.561 -8.102 1.00 . A A . 66 TYR HB3 1 1 7 12244 1 1 66 TYR HD1 H 6.601 1.349 -9.314 1.00 . A A . 66 TYR HD1 1 1 7 12245 1 1 66 TYR HD2 H 2.975 3.608 -9.096 1.00 . A A . 66 TYR HD2 1 1 7 12246 1 1 66 TYR HE1 H 5.657 0.036 -11.276 1.00 . A A . 66 TYR HE1 1 1 7 12247 1 1 66 TYR HE2 H 2.042 2.287 -11.058 1.00 . A A . 66 TYR HE2 1 1 7 12248 1 1 66 TYR HH H 4.043 -0.114 -12.728 1.00 . A A . 66 TYR HH 1 1 7 12249 1 1 66 TYR N N 6.236 3.275 -5.680 1.00 . A A . 66 TYR N 1 1 7 12250 1 1 66 TYR O O 4.946 0.443 -7.501 1.00 . A A . 66 TYR O 1 1 7 12251 1 1 66 TYR OH O 3.314 0.410 -12.287 1.00 . A A . 66 TYR OH 1 1 7 12252 1 1 67 HIS C C 6.778 -1.382 -4.849 1.00 . A A . 67 HIS C 1 1 7 12253 1 1 67 HIS CA C 7.115 -0.657 -6.153 1.00 . A A . 67 HIS CA 1 1 7 12254 1 1 67 HIS CB C 8.601 -0.733 -6.508 1.00 . A A . 67 HIS CB 1 1 7 12255 1 1 67 HIS CD2 C 9.736 -1.914 -4.470 1.00 . A A . 67 HIS CD2 1 1 7 12256 1 1 67 HIS CE1 C 10.411 -3.725 -5.496 1.00 . A A . 67 HIS CE1 1 1 7 12257 1 1 67 HIS CG C 9.352 -1.820 -5.776 1.00 . A A . 67 HIS CG 1 1 7 12258 1 1 67 HIS H H 7.220 1.307 -5.466 1.00 . A A . 67 HIS H 1 1 7 12259 1 1 67 HIS HA H 6.554 -1.114 -6.969 1.00 . A A . 67 HIS HA 1 1 7 12260 1 1 67 HIS HB2 H 8.700 -0.897 -7.581 1.00 . A A . 67 HIS HB2 1 1 7 12261 1 1 67 HIS HB3 H 9.066 0.228 -6.287 1.00 . A A . 67 HIS HB3 1 1 7 12262 1 1 67 HIS HD1 H 9.664 -3.207 -7.361 1.00 . A A . 67 HIS HD1 1 1 7 12263 1 1 67 HIS HD2 H 9.549 -1.169 -3.696 1.00 . A A . 67 HIS HD2 1 1 7 12264 1 1 67 HIS HE1 H 10.869 -4.697 -5.677 1.00 . A A . 67 HIS HE1 1 1 7 12265 1 1 67 HIS N N 6.674 0.726 -6.069 1.00 . A A . 67 HIS N 1 1 7 12266 1 1 67 HIS ND1 N 9.792 -2.976 -6.397 1.00 . A A . 67 HIS ND1 1 1 7 12267 1 1 67 HIS NE2 N 10.374 -3.065 -4.302 1.00 . A A . 67 HIS NE2 1 1 7 12268 1 1 67 HIS O O 7.018 -2.582 -4.722 1.00 . A A . 67 HIS O 1 1 7 12269 1 1 68 VAL C C 4.331 -1.181 -2.492 1.00 . A A . 68 VAL C 1 1 7 12270 1 1 68 VAL CA C 5.855 -1.180 -2.622 1.00 . A A . 68 VAL CA 1 1 7 12271 1 1 68 VAL CB C 6.550 -0.407 -1.500 1.00 . A A . 68 VAL CB 1 1 7 12272 1 1 68 VAL CG1 C 7.982 -0.907 -1.294 1.00 . A A . 68 VAL CG1 1 1 7 12273 1 1 68 VAL CG2 C 6.530 1.098 -1.776 1.00 . A A . 68 VAL CG2 1 1 7 12274 1 1 68 VAL H H 6.035 0.351 -4.024 1.00 . A A . 68 VAL H 1 1 7 12275 1 1 68 VAL HA H 6.210 -2.210 -2.593 1.00 . A A . 68 VAL HA 1 1 7 12276 1 1 68 VAL HB H 5.997 -0.585 -0.578 1.00 . A A . 68 VAL HB 1 1 7 12277 1 1 68 VAL HG11 H 8.023 -1.979 -1.488 1.00 . A A . 68 VAL HG11 1 1 7 12278 1 1 68 VAL HG12 H 8.650 -0.387 -1.980 1.00 . A A . 68 VAL HG12 1 1 7 12279 1 1 68 VAL HG13 H 8.291 -0.711 -0.268 1.00 . A A . 68 VAL HG13 1 1 7 12280 1 1 68 VAL HG21 H 5.499 1.433 -1.889 1.00 . A A . 68 VAL HG21 1 1 7 12281 1 1 68 VAL HG22 H 6.995 1.627 -0.944 1.00 . A A . 68 VAL HG22 1 1 7 12282 1 1 68 VAL HG23 H 7.082 1.307 -2.693 1.00 . A A . 68 VAL HG23 1 1 7 12283 1 1 68 VAL N N 6.227 -0.624 -3.912 1.00 . A A . 68 VAL N 1 1 7 12284 1 1 68 VAL O O 3.794 -1.513 -1.436 1.00 . A A . 68 VAL O 1 1 7 12285 1 1 69 MET C C 1.660 -1.690 -4.678 1.00 . A A . 69 MET C 1 1 7 12286 1 1 69 MET CA C 2.224 -0.758 -3.602 1.00 . A A . 69 MET CA 1 1 7 12287 1 1 69 MET CB C 1.763 0.675 -3.875 1.00 . A A . 69 MET CB 1 1 7 12288 1 1 69 MET CE C 3.234 2.630 -0.727 1.00 . A A . 69 MET CE 1 1 7 12289 1 1 69 MET CG C 1.590 1.453 -2.569 1.00 . A A . 69 MET CG 1 1 7 12290 1 1 69 MET H H 4.120 -0.537 -4.436 1.00 . A A . 69 MET H 1 1 7 12291 1 1 69 MET HA H 1.906 -1.097 -2.616 1.00 . A A . 69 MET HA 1 1 7 12292 1 1 69 MET HB2 H 2.491 1.180 -4.510 1.00 . A A . 69 MET HB2 1 1 7 12293 1 1 69 MET HB3 H 0.820 0.660 -4.421 1.00 . A A . 69 MET HB3 1 1 7 12294 1 1 69 MET HE1 H 3.582 1.622 -0.501 1.00 . A A . 69 MET HE1 1 1 7 12295 1 1 69 MET HE2 H 4.021 3.347 -0.494 1.00 . A A . 69 MET HE2 1 1 7 12296 1 1 69 MET HE3 H 2.351 2.852 -0.128 1.00 . A A . 69 MET HE3 1 1 7 12297 1 1 69 MET HG2 H 0.592 1.888 -2.525 1.00 . A A . 69 MET HG2 1 1 7 12298 1 1 69 MET HG3 H 1.683 0.778 -1.719 1.00 . A A . 69 MET HG3 1 1 7 12299 1 1 69 MET N N 3.676 -0.805 -3.581 1.00 . A A . 69 MET N 1 1 7 12300 1 1 69 MET O O 0.450 -1.894 -4.755 1.00 . A A . 69 MET O 1 1 7 12301 1 1 69 MET SD S 2.820 2.742 -2.460 1.00 . A A . 69 MET SD 1 1 7 12302 1 1 70 HIS C C 3.066 -4.376 -6.522 1.00 . A A . 70 HIS C 1 1 7 12303 1 1 70 HIS CA C 2.174 -3.134 -6.549 1.00 . A A . 70 HIS CA 1 1 7 12304 1 1 70 HIS CB C 2.194 -2.418 -7.901 1.00 . A A . 70 HIS CB 1 1 7 12305 1 1 70 HIS CD2 C 0.223 -0.732 -8.222 1.00 . A A . 70 HIS CD2 1 1 7 12306 1 1 70 HIS CE1 C 1.273 1.092 -7.625 1.00 . A A . 70 HIS CE1 1 1 7 12307 1 1 70 HIS CG C 1.502 -1.076 -7.896 1.00 . A A . 70 HIS CG 1 1 7 12308 1 1 70 HIS H H 3.548 -2.058 -5.411 1.00 . A A . 70 HIS H 1 1 7 12309 1 1 70 HIS HA H 1.145 -3.431 -6.345 1.00 . A A . 70 HIS HA 1 1 7 12310 1 1 70 HIS HB2 H 3.229 -2.280 -8.212 1.00 . A A . 70 HIS HB2 1 1 7 12311 1 1 70 HIS HB3 H 1.720 -3.058 -8.646 1.00 . A A . 70 HIS HB3 1 1 7 12312 1 1 70 HIS HD1 H 3.091 0.174 -7.230 1.00 . A A . 70 HIS HD1 1 1 7 12313 1 1 70 HIS HD2 H -0.555 -1.417 -8.561 1.00 . A A . 70 HIS HD2 1 1 7 12314 1 1 70 HIS HE1 H 1.474 2.140 -7.402 1.00 . A A . 70 HIS HE1 1 1 7 12315 1 1 70 HIS N N 2.565 -2.229 -5.481 1.00 . A A . 70 HIS N 1 1 7 12316 1 1 70 HIS ND1 N 2.139 0.095 -7.525 1.00 . A A . 70 HIS ND1 1 1 7 12317 1 1 70 HIS NE2 N 0.086 0.578 -8.057 1.00 . A A . 70 HIS NE2 1 1 7 12318 1 1 70 HIS O O 2.584 -5.486 -6.301 1.00 . A A . 70 HIS O 1 1 7 12319 1 1 71 ASP C C 4.961 -6.230 -5.649 1.00 . A A . 71 ASP C 1 1 7 12320 1 1 71 ASP CA C 5.315 -5.235 -6.756 1.00 . A A . 71 ASP CA 1 1 7 12321 1 1 71 ASP CB C 6.730 -4.717 -6.491 1.00 . A A . 71 ASP CB 1 1 7 12322 1 1 71 ASP CG C 7.840 -5.457 -7.240 1.00 . A A . 71 ASP CG 1 1 7 12323 1 1 71 ASP H H 4.735 -3.242 -6.929 1.00 . A A . 71 ASP H 1 1 7 12324 1 1 71 ASP HA H 5.245 -5.675 -7.751 1.00 . A A . 71 ASP HA 1 1 7 12325 1 1 71 ASP HB2 H 6.771 -3.662 -6.761 1.00 . A A . 71 ASP HB2 1 1 7 12326 1 1 71 ASP HB3 H 6.930 -4.781 -5.421 1.00 . A A . 71 ASP HB3 1 1 7 12327 1 1 71 ASP N N 4.351 -4.148 -6.751 1.00 . A A . 71 ASP N 1 1 7 12328 1 1 71 ASP O O 4.528 -5.834 -4.568 1.00 . A A . 71 ASP O 1 1 7 12329 1 1 71 ASP OD1 O 7.782 -5.453 -8.489 1.00 . A A . 71 ASP OD1 1 1 7 12330 1 1 71 ASP OD2 O 8.721 -6.010 -6.547 1.00 . A A . 71 ASP OD2 1 1 7 12331 1 1 72 LYS C C 6.174 -9.187 -4.524 1.00 . A A . 72 LYS C 1 1 7 12332 1 1 72 LYS CA C 4.864 -8.559 -5.003 1.00 . A A . 72 LYS CA 1 1 7 12333 1 1 72 LYS CB C 3.882 -9.567 -5.603 1.00 . A A . 72 LYS CB 1 1 7 12334 1 1 72 LYS CD C 1.828 -9.867 -7.036 1.00 . A A . 72 LYS CD 1 1 7 12335 1 1 72 LYS CE C 1.031 -9.228 -8.175 1.00 . A A . 72 LYS CE 1 1 7 12336 1 1 72 LYS CG C 2.791 -8.857 -6.408 1.00 . A A . 72 LYS CG 1 1 7 12337 1 1 72 LYS H H 5.510 -7.818 -6.839 1.00 . A A . 72 LYS H 1 1 7 12338 1 1 72 LYS HA H 4.369 -8.097 -4.148 1.00 . A A . 72 LYS HA 1 1 7 12339 1 1 72 LYS HB2 H 4.418 -10.264 -6.247 1.00 . A A . 72 LYS HB2 1 1 7 12340 1 1 72 LYS HB3 H 3.426 -10.155 -4.807 1.00 . A A . 72 LYS HB3 1 1 7 12341 1 1 72 LYS HD2 H 2.389 -10.722 -7.415 1.00 . A A . 72 LYS HD2 1 1 7 12342 1 1 72 LYS HD3 H 1.145 -10.245 -6.276 1.00 . A A . 72 LYS HD3 1 1 7 12343 1 1 72 LYS HE2 H 0.088 -8.838 -7.793 1.00 . A A . 72 LYS HE2 1 1 7 12344 1 1 72 LYS HE3 H 1.583 -8.382 -8.584 1.00 . A A . 72 LYS HE3 1 1 7 12345 1 1 72 LYS HG2 H 2.238 -8.178 -5.758 1.00 . A A . 72 LYS HG2 1 1 7 12346 1 1 72 LYS HG3 H 3.247 -8.249 -7.189 1.00 . A A . 72 LYS HG3 1 1 7 12347 1 1 72 LYS HZ1 H 0.061 -9.897 -9.894 1.00 . A A . 72 LYS HZ1 1 1 7 12348 1 1 72 LYS HZ2 H 1.600 -10.419 -9.788 1.00 . A A . 72 LYS HZ2 1 1 7 12349 1 1 72 LYS N N 5.157 -7.504 -5.957 1.00 . A A . 72 LYS N 1 1 7 12350 1 1 72 LYS NZ N 0.768 -10.219 -9.243 1.00 . A A . 72 LYS NZ 1 1 7 12351 1 1 72 LYS O O 6.249 -9.702 -3.410 1.00 . A A . 72 LYS O 1 1 7 12352 1 1 73 ASN C C 9.225 -8.720 -4.144 1.00 . A A . 73 ASN C 1 1 7 12353 1 1 73 ASN CA C 8.478 -9.681 -5.071 1.00 . A A . 73 ASN CA 1 1 7 12354 1 1 73 ASN CB C 9.320 -9.871 -6.334 1.00 . A A . 73 ASN CB 1 1 7 12355 1 1 73 ASN CG C 10.351 -10.986 -6.143 1.00 . A A . 73 ASN CG 1 1 7 12356 1 1 73 ASN H H 7.105 -8.704 -6.296 1.00 . A A . 73 ASN H 1 1 7 12357 1 1 73 ASN HA H 8.271 -10.641 -4.598 1.00 . A A . 73 ASN HA 1 1 7 12358 1 1 73 ASN HB2 H 8.671 -10.112 -7.176 1.00 . A A . 73 ASN HB2 1 1 7 12359 1 1 73 ASN HB3 H 9.829 -8.939 -6.580 1.00 . A A . 73 ASN HB3 1 1 7 12360 1 1 73 ASN HD21 H 10.668 -10.971 -8.142 1.00 . A A . 73 ASN HD21 1 1 7 12361 1 1 73 ASN HD22 H 11.613 -12.117 -7.251 1.00 . A A . 73 ASN HD22 1 1 7 12362 1 1 73 ASN N N 7.174 -9.125 -5.391 1.00 . A A . 73 ASN N 1 1 7 12363 1 1 73 ASN ND2 N 10.925 -11.391 -7.272 1.00 . A A . 73 ASN ND2 1 1 7 12364 1 1 73 ASN O O 10.293 -8.220 -4.493 1.00 . A A . 73 ASN O 1 1 7 12365 1 1 73 ASN OD1 O 10.608 -11.447 -5.043 1.00 . A A . 73 ASN OD1 1 1 7 12366 1 1 74 THR C C 9.435 -8.326 -0.673 1.00 . A A . 74 THR C 1 1 7 12367 1 1 74 THR CA C 9.229 -7.598 -2.002 1.00 . A A . 74 THR CA 1 1 7 12368 1 1 74 THR CB C 8.336 -6.361 -1.885 1.00 . A A . 74 THR CB 1 1 7 12369 1 1 74 THR CG2 C 8.113 -5.670 -3.232 1.00 . A A . 74 THR CG2 1 1 7 12370 1 1 74 THR H H 7.764 -8.901 -2.705 1.00 . A A . 74 THR H 1 1 7 12371 1 1 74 THR HA H 10.214 -7.302 -2.361 1.00 . A A . 74 THR HA 1 1 7 12372 1 1 74 THR HB H 8.734 -5.661 -1.150 1.00 . A A . 74 THR HB 1 1 7 12373 1 1 74 THR HG1 H 6.906 -6.821 -0.562 1.00 . A A . 74 THR HG1 1 1 7 12374 1 1 74 THR HG21 H 8.819 -6.063 -3.963 1.00 . A A . 74 THR HG21 1 1 7 12375 1 1 74 THR HG22 H 7.095 -5.858 -3.572 1.00 . A A . 74 THR HG22 1 1 7 12376 1 1 74 THR HG23 H 8.266 -4.596 -3.119 1.00 . A A . 74 THR HG23 1 1 7 12377 1 1 74 THR N N 8.633 -8.490 -2.981 1.00 . A A . 74 THR N 1 1 7 12378 1 1 74 THR O O 8.735 -9.293 -0.375 1.00 . A A . 74 THR O 1 1 7 12379 1 1 74 THR OG1 O 7.055 -6.887 -1.549 1.00 . A A . 74 THR OG1 1 1 7 12380 1 1 75 LYS C C 9.503 -8.264 2.313 1.00 . A A . 75 LYS C 1 1 7 12381 1 1 75 LYS CA C 10.707 -8.426 1.382 1.00 . A A . 75 LYS CA 1 1 7 12382 1 1 75 LYS CB C 12.003 -7.839 1.946 1.00 . A A . 75 LYS CB 1 1 7 12383 1 1 75 LYS CD C 12.425 -7.348 4.383 1.00 . A A . 75 LYS CD 1 1 7 12384 1 1 75 LYS CE C 13.361 -7.772 5.516 1.00 . A A . 75 LYS CE 1 1 7 12385 1 1 75 LYS CG C 12.327 -8.440 3.315 1.00 . A A . 75 LYS CG 1 1 7 12386 1 1 75 LYS H H 10.964 -7.047 -0.158 1.00 . A A . 75 LYS H 1 1 7 12387 1 1 75 LYS HA H 10.878 -9.490 1.221 1.00 . A A . 75 LYS HA 1 1 7 12388 1 1 75 LYS HB2 H 12.825 -8.034 1.256 1.00 . A A . 75 LYS HB2 1 1 7 12389 1 1 75 LYS HB3 H 11.909 -6.757 2.032 1.00 . A A . 75 LYS HB3 1 1 7 12390 1 1 75 LYS HD2 H 12.789 -6.425 3.932 1.00 . A A . 75 LYS HD2 1 1 7 12391 1 1 75 LYS HD3 H 11.434 -7.137 4.785 1.00 . A A . 75 LYS HD3 1 1 7 12392 1 1 75 LYS HE2 H 13.896 -8.679 5.234 1.00 . A A . 75 LYS HE2 1 1 7 12393 1 1 75 LYS HE3 H 14.111 -7.000 5.685 1.00 . A A . 75 LYS HE3 1 1 7 12394 1 1 75 LYS HG2 H 11.555 -9.157 3.593 1.00 . A A . 75 LYS HG2 1 1 7 12395 1 1 75 LYS HG3 H 13.267 -8.988 3.263 1.00 . A A . 75 LYS HG3 1 1 7 12396 1 1 75 LYS HZ1 H 11.674 -7.584 6.726 1.00 . A A . 75 LYS HZ1 1 1 7 12397 1 1 75 LYS HZ2 H 12.456 -8.996 6.940 1.00 . A A . 75 LYS HZ2 1 1 7 12398 1 1 75 LYS N N 10.399 -7.834 0.092 1.00 . A A . 75 LYS N 1 1 7 12399 1 1 75 LYS NZ N 12.595 -8.008 6.760 1.00 . A A . 75 LYS NZ 1 1 7 12400 1 1 75 LYS O O 9.319 -9.054 3.238 1.00 . A A . 75 LYS O 1 1 7 12401 1 1 76 PHE C C 6.260 -7.119 2.006 1.00 . A A . 76 PHE C 1 1 7 12402 1 1 76 PHE CA C 7.535 -6.960 2.837 1.00 . A A . 76 PHE CA 1 1 7 12403 1 1 76 PHE CB C 7.660 -5.502 3.284 1.00 . A A . 76 PHE CB 1 1 7 12404 1 1 76 PHE CD1 C 8.793 -5.699 5.528 1.00 . A A . 76 PHE CD1 1 1 7 12405 1 1 76 PHE CD2 C 9.939 -4.543 3.778 1.00 . A A . 76 PHE CD2 1 1 7 12406 1 1 76 PHE CE1 C 9.899 -5.452 6.415 1.00 . A A . 76 PHE CE1 1 1 7 12407 1 1 76 PHE CE2 C 11.045 -4.295 4.665 1.00 . A A . 76 PHE CE2 1 1 7 12408 1 1 76 PHE CG C 8.836 -5.240 4.227 1.00 . A A . 76 PHE CG 1 1 7 12409 1 1 76 PHE CZ C 10.971 -4.762 5.940 1.00 . A A . 76 PHE CZ 1 1 7 12410 1 1 76 PHE H H 8.873 -6.598 1.281 1.00 . A A . 76 PHE H 1 1 7 12411 1 1 76 PHE HA H 7.514 -7.673 3.661 1.00 . A A . 76 PHE HA 1 1 7 12412 1 1 76 PHE HB2 H 7.767 -4.870 2.402 1.00 . A A . 76 PHE HB2 1 1 7 12413 1 1 76 PHE HB3 H 6.736 -5.205 3.780 1.00 . A A . 76 PHE HB3 1 1 7 12414 1 1 76 PHE HD1 H 7.922 -6.250 5.883 1.00 . A A . 76 PHE HD1 1 1 7 12415 1 1 76 PHE HD2 H 9.972 -4.179 2.750 1.00 . A A . 76 PHE HD2 1 1 7 12416 1 1 76 PHE HE1 H 9.879 -5.810 7.445 1.00 . A A . 76 PHE HE1 1 1 7 12417 1 1 76 PHE HE2 H 11.922 -3.746 4.323 1.00 . A A . 76 PHE HE2 1 1 7 12418 1 1 76 PHE HZ H 11.786 -4.641 6.699 1.00 . A A . 76 PHE HZ 1 1 7 12419 1 1 76 PHE N N 8.716 -7.236 2.036 1.00 . A A . 76 PHE N 1 1 7 12420 1 1 76 PHE O O 6.293 -7.000 0.782 1.00 . A A . 76 PHE O 1 1 7 12421 1 1 77 LYS C C 3.480 -6.253 1.364 1.00 . A A . 77 LYS C 1 1 7 12422 1 1 77 LYS CA C 3.882 -7.562 2.048 1.00 . A A . 77 LYS CA 1 1 7 12423 1 1 77 LYS CB C 2.840 -8.083 3.039 1.00 . A A . 77 LYS CB 1 1 7 12424 1 1 77 LYS CD C 2.006 -10.369 2.377 1.00 . A A . 77 LYS CD 1 1 7 12425 1 1 77 LYS CE C 1.986 -11.851 2.757 1.00 . A A . 77 LYS CE 1 1 7 12426 1 1 77 LYS CG C 2.991 -9.591 3.251 1.00 . A A . 77 LYS CG 1 1 7 12427 1 1 77 LYS H H 5.148 -7.480 3.701 1.00 . A A . 77 LYS H 1 1 7 12428 1 1 77 LYS HA H 4.010 -8.327 1.282 1.00 . A A . 77 LYS HA 1 1 7 12429 1 1 77 LYS HB2 H 2.948 -7.566 3.992 1.00 . A A . 77 LYS HB2 1 1 7 12430 1 1 77 LYS HB3 H 1.839 -7.863 2.669 1.00 . A A . 77 LYS HB3 1 1 7 12431 1 1 77 LYS HD2 H 1.006 -9.948 2.486 1.00 . A A . 77 LYS HD2 1 1 7 12432 1 1 77 LYS HD3 H 2.283 -10.263 1.328 1.00 . A A . 77 LYS HD3 1 1 7 12433 1 1 77 LYS HE2 H 2.164 -11.960 3.828 1.00 . A A . 77 LYS HE2 1 1 7 12434 1 1 77 LYS HE3 H 1.002 -12.272 2.554 1.00 . A A . 77 LYS HE3 1 1 7 12435 1 1 77 LYS HG2 H 4.011 -9.895 3.015 1.00 . A A . 77 LYS HG2 1 1 7 12436 1 1 77 LYS HG3 H 2.822 -9.833 4.300 1.00 . A A . 77 LYS HG3 1 1 7 12437 1 1 77 LYS HZ1 H 2.645 -12.994 1.145 1.00 . A A . 77 LYS HZ1 1 1 7 12438 1 1 77 LYS HZ2 H 3.795 -12.001 1.732 1.00 . A A . 77 LYS HZ2 1 1 7 12439 1 1 77 LYS N N 5.166 -7.385 2.705 1.00 . A A . 77 LYS N 1 1 7 12440 1 1 77 LYS NZ N 3.017 -12.595 1.999 1.00 . A A . 77 LYS NZ 1 1 7 12441 1 1 77 LYS O O 3.396 -5.211 2.011 1.00 . A A . 77 LYS O 1 1 7 12442 1 1 78 SER C C 1.327 -5.122 -0.826 1.00 . A A . 78 SER C 1 1 7 12443 1 1 78 SER CA C 2.851 -5.188 -0.714 1.00 . A A . 78 SER CA 1 1 7 12444 1 1 78 SER CB C 3.484 -5.220 -2.107 1.00 . A A . 78 SER CB 1 1 7 12445 1 1 78 SER H H 3.312 -7.203 -0.454 1.00 . A A . 78 SER H 1 1 7 12446 1 1 78 SER HA H 3.232 -4.330 -0.162 1.00 . A A . 78 SER HA 1 1 7 12447 1 1 78 SER HB2 H 4.275 -4.471 -2.162 1.00 . A A . 78 SER HB2 1 1 7 12448 1 1 78 SER HB3 H 3.952 -6.190 -2.270 1.00 . A A . 78 SER HB3 1 1 7 12449 1 1 78 SER HG H 2.842 -5.373 -3.996 1.00 . A A . 78 SER HG 1 1 7 12450 1 1 78 SER N N 3.242 -6.351 0.064 1.00 . A A . 78 SER N 1 1 7 12451 1 1 78 SER O O 0.642 -6.125 -0.630 1.00 . A A . 78 SER O 1 1 7 12452 1 1 78 SER OG O 2.527 -4.975 -3.134 1.00 . A A . 78 SER OG 1 1 7 12453 1 1 79 CYS C C -1.151 -4.814 -2.192 1.00 . A A . 79 CYS C 1 1 7 12454 1 1 79 CYS CA C -0.591 -3.720 -1.280 1.00 . A A . 79 CYS CA 1 1 7 12455 1 1 79 CYS CB C -0.908 -2.319 -1.808 1.00 . A A . 79 CYS CB 1 1 7 12456 1 1 79 CYS H H 1.403 -3.120 -1.298 1.00 . A A . 79 CYS H 1 1 7 12457 1 1 79 CYS HA H -1.018 -3.794 -0.280 1.00 . A A . 79 CYS HA 1 1 7 12458 1 1 79 CYS HB2 H -0.561 -2.247 -2.838 1.00 . A A . 79 CYS HB2 1 1 7 12459 1 1 79 CYS HB3 H -1.990 -2.189 -1.826 1.00 . A A . 79 CYS HB3 1 1 7 12460 1 1 79 CYS N N 0.840 -3.930 -1.140 1.00 . A A . 79 CYS N 1 1 7 12461 1 1 79 CYS O O -1.933 -5.655 -1.751 1.00 . A A . 79 CYS O 1 1 7 12462 1 1 79 CYS SG S -0.170 -0.951 -0.843 1.00 . A A . 79 CYS SG 1 1 7 12463 1 1 80 VAL C C -0.698 -7.134 -4.008 1.00 . A A . 80 VAL C 1 1 7 12464 1 1 80 VAL CA C -1.178 -5.743 -4.424 1.00 . A A . 80 VAL CA 1 1 7 12465 1 1 80 VAL CB C -0.703 -5.340 -5.822 1.00 . A A . 80 VAL CB 1 1 7 12466 1 1 80 VAL CG1 C -1.065 -6.411 -6.853 1.00 . A A . 80 VAL CG1 1 1 7 12467 1 1 80 VAL CG2 C -1.273 -3.978 -6.224 1.00 . A A . 80 VAL CG2 1 1 7 12468 1 1 80 VAL H H -0.092 -4.080 -3.797 1.00 . A A . 80 VAL H 1 1 7 12469 1 1 80 VAL HA H -2.268 -5.732 -4.423 1.00 . A A . 80 VAL HA 1 1 7 12470 1 1 80 VAL HB H 0.383 -5.254 -5.795 1.00 . A A . 80 VAL HB 1 1 7 12471 1 1 80 VAL HG11 H -0.652 -7.371 -6.541 1.00 . A A . 80 VAL HG11 1 1 7 12472 1 1 80 VAL HG12 H -2.149 -6.490 -6.931 1.00 . A A . 80 VAL HG12 1 1 7 12473 1 1 80 VAL HG13 H -0.650 -6.136 -7.823 1.00 . A A . 80 VAL HG13 1 1 7 12474 1 1 80 VAL HG21 H -1.196 -3.290 -5.382 1.00 . A A . 80 VAL HG21 1 1 7 12475 1 1 80 VAL HG22 H -0.708 -3.583 -7.068 1.00 . A A . 80 VAL HG22 1 1 7 12476 1 1 80 VAL HG23 H -2.319 -4.091 -6.507 1.00 . A A . 80 VAL HG23 1 1 7 12477 1 1 80 VAL N N -0.729 -4.767 -3.447 1.00 . A A . 80 VAL N 1 1 7 12478 1 1 80 VAL O O -1.410 -8.121 -4.189 1.00 . A A . 80 VAL O 1 1 7 12479 1 1 81 GLY C C 0.123 -9.188 -2.106 1.00 . A A . 81 GLY C 1 1 7 12480 1 1 81 GLY CA C 1.090 -8.424 -3.013 1.00 . A A . 81 GLY CA 1 1 7 12481 1 1 81 GLY H H 1.079 -6.362 -3.312 1.00 . A A . 81 GLY H 1 1 7 12482 1 1 81 GLY HA2 H 1.344 -9.037 -3.878 1.00 . A A . 81 GLY HA2 1 1 7 12483 1 1 81 GLY HA3 H 2.019 -8.227 -2.477 1.00 . A A . 81 GLY HA3 1 1 7 12484 1 1 81 GLY N N 0.506 -7.169 -3.457 1.00 . A A . 81 GLY N 1 1 7 12485 1 1 81 GLY O O -0.264 -10.314 -2.413 1.00 . A A . 81 GLY O 1 1 7 12486 1 1 82 CYS C C -2.500 -9.363 -0.745 1.00 . A A . 82 CYS C 1 1 7 12487 1 1 82 CYS CA C -1.153 -9.149 -0.051 1.00 . A A . 82 CYS CA 1 1 7 12488 1 1 82 CYS CB C -1.291 -8.302 1.215 1.00 . A A . 82 CYS CB 1 1 7 12489 1 1 82 CYS H H 0.080 -7.628 -0.763 1.00 . A A . 82 CYS H 1 1 7 12490 1 1 82 CYS HA H -0.713 -10.102 0.242 1.00 . A A . 82 CYS HA 1 1 7 12491 1 1 82 CYS HB2 H -0.308 -8.110 1.644 1.00 . A A . 82 CYS HB2 1 1 7 12492 1 1 82 CYS HB3 H -1.725 -7.333 0.968 1.00 . A A . 82 CYS HB3 1 1 7 12493 1 1 82 CYS N N -0.239 -8.544 -1.005 1.00 . A A . 82 CYS N 1 1 7 12494 1 1 82 CYS O O -3.106 -10.426 -0.617 1.00 . A A . 82 CYS O 1 1 7 12495 1 1 82 CYS SG S -2.346 -9.166 2.435 1.00 . A A . 82 CYS SG 1 1 7 12496 1 1 83 HIS C C -4.222 -9.649 -3.061 1.00 . A A . 83 HIS C 1 1 7 12497 1 1 83 HIS CA C -4.192 -8.399 -2.179 1.00 . A A . 83 HIS CA 1 1 7 12498 1 1 83 HIS CB C -4.435 -7.111 -2.967 1.00 . A A . 83 HIS CB 1 1 7 12499 1 1 83 HIS CD2 C -4.842 -5.712 -0.797 1.00 . A A . 83 HIS CD2 1 1 7 12500 1 1 83 HIS CE1 C -6.017 -4.094 -1.684 1.00 . A A . 83 HIS CE1 1 1 7 12501 1 1 83 HIS CG C -4.961 -5.969 -2.131 1.00 . A A . 83 HIS CG 1 1 7 12502 1 1 83 HIS H H -2.428 -7.476 -1.564 1.00 . A A . 83 HIS H 1 1 7 12503 1 1 83 HIS HA H -4.974 -8.479 -1.424 1.00 . A A . 83 HIS HA 1 1 7 12504 1 1 83 HIS HB2 H -3.500 -6.803 -3.437 1.00 . A A . 83 HIS HB2 1 1 7 12505 1 1 83 HIS HB3 H -5.142 -7.316 -3.770 1.00 . A A . 83 HIS HB3 1 1 7 12506 1 1 83 HIS HD1 H -5.969 -4.832 -3.623 1.00 . A A . 83 HIS HD1 1 1 7 12507 1 1 83 HIS HD2 H -4.312 -6.332 -0.074 1.00 . A A . 83 HIS HD2 1 1 7 12508 1 1 83 HIS HE1 H -6.600 -3.179 -1.785 1.00 . A A . 83 HIS HE1 1 1 7 12509 1 1 83 HIS N N -2.928 -8.337 -1.465 1.00 . A A . 83 HIS N 1 1 7 12510 1 1 83 HIS ND1 N -5.707 -4.932 -2.663 1.00 . A A . 83 HIS ND1 1 1 7 12511 1 1 83 HIS NE2 N -5.480 -4.580 -0.529 1.00 . A A . 83 HIS NE2 1 1 7 12512 1 1 83 HIS O O -5.224 -10.361 -3.100 1.00 . A A . 83 HIS O 1 1 7 12513 1 1 84 VAL C C -3.263 -12.304 -3.826 1.00 . A A . 84 VAL C 1 1 7 12514 1 1 84 VAL CA C -2.999 -11.027 -4.627 1.00 . A A . 84 VAL CA 1 1 7 12515 1 1 84 VAL CB C -1.633 -11.026 -5.317 1.00 . A A . 84 VAL CB 1 1 7 12516 1 1 84 VAL CG1 C -1.437 -12.297 -6.146 1.00 . A A . 84 VAL CG1 1 1 7 12517 1 1 84 VAL CG2 C -1.457 -9.776 -6.181 1.00 . A A . 84 VAL CG2 1 1 7 12518 1 1 84 VAL H H -2.301 -9.292 -3.709 1.00 . A A . 84 VAL H 1 1 7 12519 1 1 84 VAL HA H -3.766 -10.931 -5.395 1.00 . A A . 84 VAL HA 1 1 7 12520 1 1 84 VAL HB H -0.866 -11.009 -4.543 1.00 . A A . 84 VAL HB 1 1 7 12521 1 1 84 VAL HG11 H -2.237 -12.379 -6.881 1.00 . A A . 84 VAL HG11 1 1 7 12522 1 1 84 VAL HG12 H -0.476 -12.252 -6.658 1.00 . A A . 84 VAL HG12 1 1 7 12523 1 1 84 VAL HG13 H -1.457 -13.167 -5.488 1.00 . A A . 84 VAL HG13 1 1 7 12524 1 1 84 VAL HG21 H -2.309 -9.112 -6.038 1.00 . A A . 84 VAL HG21 1 1 7 12525 1 1 84 VAL HG22 H -0.542 -9.260 -5.890 1.00 . A A . 84 VAL HG22 1 1 7 12526 1 1 84 VAL HG23 H -1.393 -10.065 -7.230 1.00 . A A . 84 VAL HG23 1 1 7 12527 1 1 84 VAL N N -3.112 -9.877 -3.747 1.00 . A A . 84 VAL N 1 1 7 12528 1 1 84 VAL O O -3.875 -13.243 -4.332 1.00 . A A . 84 VAL O 1 1 7 12529 1 1 85 GLU C C -4.407 -13.508 -1.209 1.00 . A A . 85 GLU C 1 1 7 12530 1 1 85 GLU CA C -2.964 -13.443 -1.713 1.00 . A A . 85 GLU CA 1 1 7 12531 1 1 85 GLU CB C -1.977 -13.398 -0.545 1.00 . A A . 85 GLU CB 1 1 7 12532 1 1 85 GLU CD C -0.658 -15.390 0.262 1.00 . A A . 85 GLU CD 1 1 7 12533 1 1 85 GLU CG C -0.773 -14.304 -0.810 1.00 . A A . 85 GLU CG 1 1 7 12534 1 1 85 GLU H H -2.291 -11.529 -2.185 1.00 . A A . 85 GLU H 1 1 7 12535 1 1 85 GLU HA H -2.748 -14.315 -2.330 1.00 . A A . 85 GLU HA 1 1 7 12536 1 1 85 GLU HB2 H -1.639 -12.373 -0.390 1.00 . A A . 85 GLU HB2 1 1 7 12537 1 1 85 GLU HB3 H -2.477 -13.710 0.371 1.00 . A A . 85 GLU HB3 1 1 7 12538 1 1 85 GLU HG2 H -0.869 -14.765 -1.792 1.00 . A A . 85 GLU HG2 1 1 7 12539 1 1 85 GLU HG3 H 0.139 -13.707 -0.826 1.00 . A A . 85 GLU HG3 1 1 7 12540 1 1 85 GLU N N -2.788 -12.297 -2.589 1.00 . A A . 85 GLU N 1 1 7 12541 1 1 85 GLU O O -4.952 -14.594 -1.013 1.00 . A A . 85 GLU O 1 1 7 12542 1 1 85 GLU OE1 O -1.630 -16.167 0.388 1.00 . A A . 85 GLU OE1 1 1 7 12543 1 1 85 GLU OE2 O 0.398 -15.420 0.930 1.00 . A A . 85 GLU OE2 1 1 7 12544 1 1 86 VAL C C -7.312 -12.628 -1.665 1.00 . A A . 86 VAL C 1 1 7 12545 1 1 86 VAL CA C -6.355 -12.243 -0.535 1.00 . A A . 86 VAL CA 1 1 7 12546 1 1 86 VAL CB C -6.623 -10.844 0.024 1.00 . A A . 86 VAL CB 1 1 7 12547 1 1 86 VAL CG1 C -8.071 -10.712 0.500 1.00 . A A . 86 VAL CG1 1 1 7 12548 1 1 86 VAL CG2 C -5.643 -10.506 1.150 1.00 . A A . 86 VAL CG2 1 1 7 12549 1 1 86 VAL H H -4.536 -11.454 -1.174 1.00 . A A . 86 VAL H 1 1 7 12550 1 1 86 VAL HA H -6.467 -12.958 0.280 1.00 . A A . 86 VAL HA 1 1 7 12551 1 1 86 VAL HB H -6.468 -10.126 -0.781 1.00 . A A . 86 VAL HB 1 1 7 12552 1 1 86 VAL HG11 H -8.747 -10.893 -0.336 1.00 . A A . 86 VAL HG11 1 1 7 12553 1 1 86 VAL HG12 H -8.264 -11.442 1.286 1.00 . A A . 86 VAL HG12 1 1 7 12554 1 1 86 VAL HG13 H -8.236 -9.707 0.889 1.00 . A A . 86 VAL HG13 1 1 7 12555 1 1 86 VAL HG21 H -4.683 -10.981 0.950 1.00 . A A . 86 VAL HG21 1 1 7 12556 1 1 86 VAL HG22 H -5.511 -9.425 1.204 1.00 . A A . 86 VAL HG22 1 1 7 12557 1 1 86 VAL HG23 H -6.039 -10.871 2.098 1.00 . A A . 86 VAL HG23 1 1 7 12558 1 1 86 VAL N N -4.986 -12.333 -1.013 1.00 . A A . 86 VAL N 1 1 7 12559 1 1 86 VAL O O -8.156 -13.506 -1.495 1.00 . A A . 86 VAL O 1 1 7 12560 1 1 87 ALA C C -7.718 -13.632 -4.459 1.00 . A A . 87 ALA C 1 1 7 12561 1 1 87 ALA CA C -7.985 -12.214 -3.951 1.00 . A A . 87 ALA CA 1 1 7 12562 1 1 87 ALA CB C -7.724 -11.152 -5.020 1.00 . A A . 87 ALA CB 1 1 7 12563 1 1 87 ALA H H -6.457 -11.241 -2.923 1.00 . A A . 87 ALA H 1 1 7 12564 1 1 87 ALA HA H -9.025 -12.141 -3.630 1.00 . A A . 87 ALA HA 1 1 7 12565 1 1 87 ALA HB1 H -7.406 -10.225 -4.542 1.00 . A A . 87 ALA HB1 1 1 7 12566 1 1 87 ALA HB2 H -6.941 -11.500 -5.694 1.00 . A A . 87 ALA HB2 1 1 7 12567 1 1 87 ALA HB3 H -8.638 -10.974 -5.587 1.00 . A A . 87 ALA HB3 1 1 7 12568 1 1 87 ALA N N -7.147 -11.953 -2.793 1.00 . A A . 87 ALA N 1 1 7 12569 1 1 87 ALA O O -8.620 -14.290 -4.976 1.00 . A A . 87 ALA O 1 1 7 12570 1 1 88 GLY C C -6.546 -15.658 -6.163 1.00 . A A . 88 GLY C 1 1 7 12571 1 1 88 GLY CA C -6.078 -15.389 -4.732 1.00 . A A . 88 GLY CA 1 1 7 12572 1 1 88 GLY H H -5.748 -13.519 -3.874 1.00 . A A . 88 GLY H 1 1 7 12573 1 1 88 GLY HA2 H -4.994 -15.485 -4.675 1.00 . A A . 88 GLY HA2 1 1 7 12574 1 1 88 GLY HA3 H -6.500 -16.137 -4.061 1.00 . A A . 88 GLY HA3 1 1 7 12575 1 1 88 GLY N N -6.476 -14.061 -4.295 1.00 . A A . 88 GLY N 1 1 7 12576 1 1 88 GLY O O -5.932 -15.186 -7.120 1.00 . A A . 88 GLY O 1 1 7 12577 1 1 89 ALA C C -9.702 -16.559 -7.531 1.00 . A A . 89 ALA C 1 1 7 12578 1 1 89 ALA CA C -8.185 -16.753 -7.565 1.00 . A A . 89 ALA CA 1 1 7 12579 1 1 89 ALA CB C -7.788 -18.183 -7.935 1.00 . A A . 89 ALA CB 1 1 7 12580 1 1 89 ALA H H -8.122 -16.794 -5.484 1.00 . A A . 89 ALA H 1 1 7 12581 1 1 89 ALA HA H -7.756 -16.069 -8.298 1.00 . A A . 89 ALA HA 1 1 7 12582 1 1 89 ALA HB1 H -8.027 -18.852 -7.107 1.00 . A A . 89 ALA HB1 1 1 7 12583 1 1 89 ALA HB2 H -8.337 -18.495 -8.823 1.00 . A A . 89 ALA HB2 1 1 7 12584 1 1 89 ALA HB3 H -6.718 -18.223 -8.136 1.00 . A A . 89 ALA HB3 1 1 7 12585 1 1 89 ALA N N -7.628 -16.415 -6.266 1.00 . A A . 89 ALA N 1 1 7 12586 1 1 89 ALA O O -10.458 -17.515 -7.700 1.00 . A A . 89 ALA O 1 1 7 12587 1 1 90 ASP C C -11.878 -14.098 -8.448 1.00 . A A . 90 ASP C 1 1 7 12588 1 1 90 ASP CA C -11.516 -14.984 -7.253 1.00 . A A . 90 ASP CA 1 1 7 12589 1 1 90 ASP CB C -11.849 -14.212 -5.975 1.00 . A A . 90 ASP CB 1 1 7 12590 1 1 90 ASP CG C -13.294 -13.721 -5.873 1.00 . A A . 90 ASP CG 1 1 7 12591 1 1 90 ASP H H -9.482 -14.543 -7.176 1.00 . A A . 90 ASP H 1 1 7 12592 1 1 90 ASP HA H -12.036 -15.942 -7.272 1.00 . A A . 90 ASP HA 1 1 7 12593 1 1 90 ASP HB2 H -11.636 -14.851 -5.117 1.00 . A A . 90 ASP HB2 1 1 7 12594 1 1 90 ASP HB3 H -11.183 -13.352 -5.904 1.00 . A A . 90 ASP HB3 1 1 7 12595 1 1 90 ASP N N -10.103 -15.315 -7.312 1.00 . A A . 90 ASP N 1 1 7 12596 1 1 90 ASP O O -13.053 -13.820 -8.685 1.00 . A A . 90 ASP O 1 1 7 12597 1 1 90 ASP OD1 O -14.170 -14.581 -5.637 1.00 . A A . 90 ASP OD1 1 1 7 12598 1 1 90 ASP OD2 O -13.491 -12.497 -6.033 1.00 . A A . 90 ASP OD2 1 1 7 12599 1 1 91 ALA C C -11.536 -11.456 -9.876 1.00 . A A . 91 ALA C 1 1 7 12600 1 1 91 ALA CA C -11.042 -12.831 -10.330 1.00 . A A . 91 ALA CA 1 1 7 12601 1 1 91 ALA CB C -12.013 -13.509 -11.300 1.00 . A A . 91 ALA CB 1 1 7 12602 1 1 91 ALA H H -9.895 -13.911 -8.967 1.00 . A A . 91 ALA H 1 1 7 12603 1 1 91 ALA HA H -10.076 -12.717 -10.823 1.00 . A A . 91 ALA HA 1 1 7 12604 1 1 91 ALA HB1 H -12.563 -14.290 -10.776 1.00 . A A . 91 ALA HB1 1 1 7 12605 1 1 91 ALA HB2 H -12.713 -12.769 -11.689 1.00 . A A . 91 ALA HB2 1 1 7 12606 1 1 91 ALA HB3 H -11.453 -13.949 -12.125 1.00 . A A . 91 ALA HB3 1 1 7 12607 1 1 91 ALA N N -10.847 -13.680 -9.167 1.00 . A A . 91 ALA N 1 1 7 12608 1 1 91 ALA O O -10.779 -10.487 -9.884 1.00 . A A . 91 ALA O 1 1 7 12609 1 1 92 ALA C C -12.412 -9.424 -8.150 1.00 . A A . 92 ALA C 1 1 7 12610 1 1 92 ALA CA C -13.408 -10.175 -9.036 1.00 . A A . 92 ALA CA 1 1 7 12611 1 1 92 ALA CB C -14.718 -10.483 -8.309 1.00 . A A . 92 ALA CB 1 1 7 12612 1 1 92 ALA H H -13.412 -12.208 -9.488 1.00 . A A . 92 ALA H 1 1 7 12613 1 1 92 ALA HA H -13.628 -9.570 -9.915 1.00 . A A . 92 ALA HA 1 1 7 12614 1 1 92 ALA HB1 H -14.734 -11.533 -8.018 1.00 . A A . 92 ALA HB1 1 1 7 12615 1 1 92 ALA HB2 H -14.795 -9.858 -7.418 1.00 . A A . 92 ALA HB2 1 1 7 12616 1 1 92 ALA HB3 H -15.558 -10.276 -8.971 1.00 . A A . 92 ALA HB3 1 1 7 12617 1 1 92 ALA N N -12.803 -11.416 -9.492 1.00 . A A . 92 ALA N 1 1 7 12618 1 1 92 ALA O O -12.051 -8.285 -8.444 1.00 . A A . 92 ALA O 1 1 7 12619 1 1 93 LYS C C -9.715 -9.269 -6.868 1.00 . A A . 93 LYS C 1 1 7 12620 1 1 93 LYS CA C -11.049 -9.500 -6.154 1.00 . A A . 93 LYS CA 1 1 7 12621 1 1 93 LYS CB C -10.930 -10.358 -4.892 1.00 . A A . 93 LYS CB 1 1 7 12622 1 1 93 LYS CD C -12.044 -11.039 -2.735 1.00 . A A . 93 LYS CD 1 1 7 12623 1 1 93 LYS CE C -13.296 -11.915 -2.654 1.00 . A A . 93 LYS CE 1 1 7 12624 1 1 93 LYS CG C -12.105 -10.106 -3.945 1.00 . A A . 93 LYS CG 1 1 7 12625 1 1 93 LYS H H -12.293 -11.017 -6.853 1.00 . A A . 93 LYS H 1 1 7 12626 1 1 93 LYS HA H -11.450 -8.533 -5.850 1.00 . A A . 93 LYS HA 1 1 7 12627 1 1 93 LYS HB2 H -10.899 -11.412 -5.167 1.00 . A A . 93 LYS HB2 1 1 7 12628 1 1 93 LYS HB3 H -9.993 -10.134 -4.383 1.00 . A A . 93 LYS HB3 1 1 7 12629 1 1 93 LYS HD2 H -11.158 -11.670 -2.802 1.00 . A A . 93 LYS HD2 1 1 7 12630 1 1 93 LYS HD3 H -11.948 -10.451 -1.822 1.00 . A A . 93 LYS HD3 1 1 7 12631 1 1 93 LYS HE2 H -13.711 -11.874 -1.647 1.00 . A A . 93 LYS HE2 1 1 7 12632 1 1 93 LYS HE3 H -14.060 -11.531 -3.330 1.00 . A A . 93 LYS HE3 1 1 7 12633 1 1 93 LYS HG2 H -12.091 -9.068 -3.611 1.00 . A A . 93 LYS HG2 1 1 7 12634 1 1 93 LYS HG3 H -13.045 -10.255 -4.478 1.00 . A A . 93 LYS HG3 1 1 7 12635 1 1 93 LYS HZ1 H -12.815 -13.888 -2.184 1.00 . A A . 93 LYS HZ1 1 1 7 12636 1 1 93 LYS HZ2 H -13.717 -13.757 -3.534 1.00 . A A . 93 LYS HZ2 1 1 7 12637 1 1 93 LYS N N -11.995 -10.091 -7.084 1.00 . A A . 93 LYS N 1 1 7 12638 1 1 93 LYS NZ N -12.971 -13.316 -3.007 1.00 . A A . 93 LYS NZ 1 1 7 12639 1 1 93 LYS O O -8.997 -8.320 -6.557 1.00 . A A . 93 LYS O 1 1 7 12640 1 1 94 LYS C C -8.241 -8.815 -9.464 1.00 . A A . 94 LYS C 1 1 7 12641 1 1 94 LYS CA C -8.190 -10.057 -8.571 1.00 . A A . 94 LYS CA 1 1 7 12642 1 1 94 LYS CB C -7.931 -11.355 -9.338 1.00 . A A . 94 LYS CB 1 1 7 12643 1 1 94 LYS CD C -6.428 -11.225 -11.359 1.00 . A A . 94 LYS CD 1 1 7 12644 1 1 94 LYS CE C -5.512 -12.265 -12.007 1.00 . A A . 94 LYS CE 1 1 7 12645 1 1 94 LYS CG C -6.488 -11.416 -9.842 1.00 . A A . 94 LYS CG 1 1 7 12646 1 1 94 LYS H H -10.014 -10.921 -8.058 1.00 . A A . 94 LYS H 1 1 7 12647 1 1 94 LYS HA H -7.375 -9.936 -7.857 1.00 . A A . 94 LYS HA 1 1 7 12648 1 1 94 LYS HB2 H -8.131 -12.210 -8.692 1.00 . A A . 94 LYS HB2 1 1 7 12649 1 1 94 LYS HB3 H -8.618 -11.427 -10.182 1.00 . A A . 94 LYS HB3 1 1 7 12650 1 1 94 LYS HD2 H -7.430 -11.306 -11.779 1.00 . A A . 94 LYS HD2 1 1 7 12651 1 1 94 LYS HD3 H -6.065 -10.223 -11.588 1.00 . A A . 94 LYS HD3 1 1 7 12652 1 1 94 LYS HE2 H -5.484 -13.166 -11.394 1.00 . A A . 94 LYS HE2 1 1 7 12653 1 1 94 LYS HE3 H -5.910 -12.553 -12.979 1.00 . A A . 94 LYS HE3 1 1 7 12654 1 1 94 LYS HG2 H -5.895 -10.645 -9.351 1.00 . A A . 94 LYS HG2 1 1 7 12655 1 1 94 LYS HG3 H -6.046 -12.376 -9.575 1.00 . A A . 94 LYS HG3 1 1 7 12656 1 1 94 LYS HZ1 H -3.694 -12.068 -13.006 1.00 . A A . 94 LYS HZ1 1 1 7 12657 1 1 94 LYS HZ2 H -4.139 -10.712 -12.222 1.00 . A A . 94 LYS HZ2 1 1 7 12658 1 1 94 LYS N N -9.425 -10.153 -7.811 1.00 . A A . 94 LYS N 1 1 7 12659 1 1 94 LYS NZ N -4.143 -11.724 -12.165 1.00 . A A . 94 LYS NZ 1 1 7 12660 1 1 94 LYS O O -7.238 -8.441 -10.070 1.00 . A A . 94 LYS O 1 1 7 12661 1 1 95 LYS C C -10.167 -5.896 -9.445 1.00 . A A . 95 LYS C 1 1 7 12662 1 1 95 LYS CA C -9.613 -7.019 -10.324 1.00 . A A . 95 LYS CA 1 1 7 12663 1 1 95 LYS CB C -10.484 -7.334 -11.541 1.00 . A A . 95 LYS CB 1 1 7 12664 1 1 95 LYS CD C -10.437 -7.297 -14.063 1.00 . A A . 95 LYS CD 1 1 7 12665 1 1 95 LYS CE C -9.265 -8.002 -14.749 1.00 . A A . 95 LYS CE 1 1 7 12666 1 1 95 LYS CG C -9.980 -6.594 -12.783 1.00 . A A . 95 LYS CG 1 1 7 12667 1 1 95 LYS H H -10.229 -8.521 -9.019 1.00 . A A . 95 LYS H 1 1 7 12668 1 1 95 LYS HA H -8.635 -6.715 -10.698 1.00 . A A . 95 LYS HA 1 1 7 12669 1 1 95 LYS HB2 H -10.482 -8.408 -11.728 1.00 . A A . 95 LYS HB2 1 1 7 12670 1 1 95 LYS HB3 H -11.517 -7.048 -11.338 1.00 . A A . 95 LYS HB3 1 1 7 12671 1 1 95 LYS HD2 H -11.214 -8.024 -13.825 1.00 . A A . 95 LYS HD2 1 1 7 12672 1 1 95 LYS HD3 H -10.878 -6.570 -14.744 1.00 . A A . 95 LYS HD3 1 1 7 12673 1 1 95 LYS HE2 H -8.355 -7.414 -14.623 1.00 . A A . 95 LYS HE2 1 1 7 12674 1 1 95 LYS HE3 H -9.087 -8.969 -14.278 1.00 . A A . 95 LYS HE3 1 1 7 12675 1 1 95 LYS HG2 H -10.351 -5.569 -12.775 1.00 . A A . 95 LYS HG2 1 1 7 12676 1 1 95 LYS HG3 H -8.892 -6.540 -12.761 1.00 . A A . 95 LYS HG3 1 1 7 12677 1 1 95 LYS HZ1 H -10.503 -7.953 -16.425 1.00 . A A . 95 LYS HZ1 1 1 7 12678 1 1 95 LYS HZ2 H -8.949 -7.609 -16.771 1.00 . A A . 95 LYS HZ2 1 1 7 12679 1 1 95 LYS N N -9.418 -8.210 -9.516 1.00 . A A . 95 LYS N 1 1 7 12680 1 1 95 LYS NZ N -9.545 -8.189 -16.190 1.00 . A A . 95 LYS NZ 1 1 7 12681 1 1 95 LYS O O -10.322 -4.765 -9.901 1.00 . A A . 95 LYS O 1 1 7 12682 1 1 96 ASP C C -9.939 -5.008 -6.169 1.00 . A A . 96 ASP C 1 1 7 12683 1 1 96 ASP CA C -10.983 -5.284 -7.252 1.00 . A A . 96 ASP CA 1 1 7 12684 1 1 96 ASP CB C -12.242 -5.822 -6.569 1.00 . A A . 96 ASP CB 1 1 7 12685 1 1 96 ASP CG C -13.548 -5.147 -6.995 1.00 . A A . 96 ASP CG 1 1 7 12686 1 1 96 ASP H H -10.320 -7.171 -7.836 1.00 . A A . 96 ASP H 1 1 7 12687 1 1 96 ASP HA H -11.214 -4.399 -7.844 1.00 . A A . 96 ASP HA 1 1 7 12688 1 1 96 ASP HB2 H -12.320 -6.890 -6.773 1.00 . A A . 96 ASP HB2 1 1 7 12689 1 1 96 ASP HB3 H -12.128 -5.711 -5.491 1.00 . A A . 96 ASP HB3 1 1 7 12690 1 1 96 ASP N N -10.450 -6.248 -8.199 1.00 . A A . 96 ASP N 1 1 7 12691 1 1 96 ASP O O -9.971 -3.962 -5.522 1.00 . A A . 96 ASP O 1 1 7 12692 1 1 96 ASP OD1 O -13.489 -4.358 -7.962 1.00 . A A . 96 ASP OD1 1 1 7 12693 1 1 96 ASP OD2 O -14.574 -5.435 -6.342 1.00 . A A . 96 ASP OD2 1 1 7 12694 1 1 97 LEU C C -6.645 -5.624 -5.715 1.00 . A A . 97 LEU C 1 1 7 12695 1 1 97 LEU CA C -7.985 -5.838 -5.009 1.00 . A A . 97 LEU CA 1 1 7 12696 1 1 97 LEU CB C -7.996 -7.039 -4.062 1.00 . A A . 97 LEU CB 1 1 7 12697 1 1 97 LEU CD1 C -9.026 -8.298 -2.134 1.00 . A A . 97 LEU CD1 1 1 7 12698 1 1 97 LEU CD2 C -9.434 -5.808 -2.395 1.00 . A A . 97 LEU CD2 1 1 7 12699 1 1 97 LEU CG C -9.195 -7.137 -3.115 1.00 . A A . 97 LEU CG 1 1 7 12700 1 1 97 LEU H H -9.018 -6.813 -6.533 1.00 . A A . 97 LEU H 1 1 7 12701 1 1 97 LEU HA H -8.206 -4.954 -4.411 1.00 . A A . 97 LEU HA 1 1 7 12702 1 1 97 LEU HB2 H -7.956 -7.950 -4.660 1.00 . A A . 97 LEU HB2 1 1 7 12703 1 1 97 LEU HB3 H -7.086 -7.012 -3.462 1.00 . A A . 97 LEU HB3 1 1 7 12704 1 1 97 LEU HD11 H -8.303 -9.009 -2.534 1.00 . A A . 97 LEU HD11 1 1 7 12705 1 1 97 LEU HD12 H -8.668 -7.916 -1.177 1.00 . A A . 97 LEU HD12 1 1 7 12706 1 1 97 LEU HD13 H -9.984 -8.796 -1.991 1.00 . A A . 97 LEU HD13 1 1 7 12707 1 1 97 LEU HD21 H -8.537 -5.192 -2.461 1.00 . A A . 97 LEU HD21 1 1 7 12708 1 1 97 LEU HD22 H -10.268 -5.286 -2.864 1.00 . A A . 97 LEU HD22 1 1 7 12709 1 1 97 LEU HD23 H -9.667 -5.999 -1.348 1.00 . A A . 97 LEU HD23 1 1 7 12710 1 1 97 LEU HG H -10.084 -7.345 -3.710 1.00 . A A . 97 LEU HG 1 1 7 12711 1 1 97 LEU N N -9.037 -5.965 -6.003 1.00 . A A . 97 LEU N 1 1 7 12712 1 1 97 LEU O O -5.754 -4.967 -5.178 1.00 . A A . 97 LEU O 1 1 7 12713 1 1 98 THR C C -5.648 -5.558 -9.100 1.00 . A A . 98 THR C 1 1 7 12714 1 1 98 THR CA C -5.328 -6.069 -7.694 1.00 . A A . 98 THR CA 1 1 7 12715 1 1 98 THR CB C -4.624 -7.428 -7.687 1.00 . A A . 98 THR CB 1 1 7 12716 1 1 98 THR CG2 C -4.707 -8.124 -6.327 1.00 . A A . 98 THR CG2 1 1 7 12717 1 1 98 THR H H -7.274 -6.722 -7.339 1.00 . A A . 98 THR H 1 1 7 12718 1 1 98 THR HA H -4.686 -5.325 -7.222 1.00 . A A . 98 THR HA 1 1 7 12719 1 1 98 THR HB H -3.589 -7.332 -8.013 1.00 . A A . 98 THR HB 1 1 7 12720 1 1 98 THR HG1 H -5.166 -8.094 -9.495 1.00 . A A . 98 THR HG1 1 1 7 12721 1 1 98 THR HG21 H -5.745 -8.154 -5.997 1.00 . A A . 98 THR HG21 1 1 7 12722 1 1 98 THR HG22 H -4.324 -9.141 -6.415 1.00 . A A . 98 THR HG22 1 1 7 12723 1 1 98 THR HG23 H -4.110 -7.573 -5.600 1.00 . A A . 98 THR HG23 1 1 7 12724 1 1 98 THR N N -6.544 -6.190 -6.909 1.00 . A A . 98 THR N 1 1 7 12725 1 1 98 THR O O -4.864 -5.748 -10.028 1.00 . A A . 98 THR O 1 1 7 12726 1 1 98 THR OG1 O -5.427 -8.239 -8.541 1.00 . A A . 98 THR OG1 1 1 7 12727 1 1 99 GLY C C -6.431 -3.134 -10.862 1.00 . A A . 99 GLY C 1 1 7 12728 1 1 99 GLY CA C -7.238 -4.379 -10.490 1.00 . A A . 99 GLY CA 1 1 7 12729 1 1 99 GLY H H -7.436 -4.768 -8.453 1.00 . A A . 99 GLY H 1 1 7 12730 1 1 99 GLY HA2 H -7.124 -5.136 -11.266 1.00 . A A . 99 GLY HA2 1 1 7 12731 1 1 99 GLY HA3 H -8.298 -4.129 -10.441 1.00 . A A . 99 GLY HA3 1 1 7 12732 1 1 99 GLY N N -6.804 -4.919 -9.213 1.00 . A A . 99 GLY N 1 1 7 12733 1 1 99 GLY O O -6.064 -2.345 -9.992 1.00 . A A . 99 GLY O 1 1 7 12734 1 1 100 CYS C C -6.381 -0.679 -12.821 1.00 . A A . 100 CYS C 1 1 7 12735 1 1 100 CYS CA C -5.422 -1.859 -12.653 1.00 . A A . 100 CYS CA 1 1 7 12736 1 1 100 CYS CB C -4.693 -2.193 -13.956 1.00 . A A . 100 CYS CB 1 1 7 12737 1 1 100 CYS H H -6.481 -3.641 -12.856 1.00 . A A . 100 CYS H 1 1 7 12738 1 1 100 CYS HA H -4.662 -1.637 -11.903 1.00 . A A . 100 CYS HA 1 1 7 12739 1 1 100 CYS HB2 H -5.334 -2.833 -14.561 1.00 . A A . 100 CYS HB2 1 1 7 12740 1 1 100 CYS HB3 H -4.543 -1.270 -14.518 1.00 . A A . 100 CYS HB3 1 1 7 12741 1 1 100 CYS N N -6.179 -2.995 -12.155 1.00 . A A . 100 CYS N 1 1 7 12742 1 1 100 CYS O O -6.127 0.410 -12.310 1.00 . A A . 100 CYS O 1 1 7 12743 1 1 100 CYS SG S -3.074 -3.018 -13.740 1.00 . A A . 100 CYS SG 1 1 7 12744 1 1 101 LYS C C -9.840 -0.435 -13.373 1.00 . A A . 101 LYS C 1 1 7 12745 1 1 101 LYS CA C -8.463 0.091 -13.783 1.00 . A A . 101 LYS CA 1 1 7 12746 1 1 101 LYS CB C -8.395 0.572 -15.233 1.00 . A A . 101 LYS CB 1 1 7 12747 1 1 101 LYS CD C -10.284 1.125 -16.810 1.00 . A A . 101 LYS CD 1 1 7 12748 1 1 101 LYS CE C -10.581 2.335 -17.697 1.00 . A A . 101 LYS CE 1 1 7 12749 1 1 101 LYS CG C -9.536 1.543 -15.543 1.00 . A A . 101 LYS CG 1 1 7 12750 1 1 101 LYS H H -7.664 -1.825 -13.953 1.00 . A A . 101 LYS H 1 1 7 12751 1 1 101 LYS HA H -8.216 0.943 -13.149 1.00 . A A . 101 LYS HA 1 1 7 12752 1 1 101 LYS HB2 H -7.437 1.061 -15.414 1.00 . A A . 101 LYS HB2 1 1 7 12753 1 1 101 LYS HB3 H -8.447 -0.283 -15.907 1.00 . A A . 101 LYS HB3 1 1 7 12754 1 1 101 LYS HD2 H -9.688 0.400 -17.365 1.00 . A A . 101 LYS HD2 1 1 7 12755 1 1 101 LYS HD3 H -11.217 0.630 -16.539 1.00 . A A . 101 LYS HD3 1 1 7 12756 1 1 101 LYS HE2 H -11.322 2.973 -17.215 1.00 . A A . 101 LYS HE2 1 1 7 12757 1 1 101 LYS HE3 H -9.678 2.933 -17.821 1.00 . A A . 101 LYS HE3 1 1 7 12758 1 1 101 LYS HG2 H -10.228 1.576 -14.702 1.00 . A A . 101 LYS HG2 1 1 7 12759 1 1 101 LYS HG3 H -9.137 2.550 -15.667 1.00 . A A . 101 LYS HG3 1 1 7 12760 1 1 101 LYS HZ1 H -10.626 1.048 -19.335 1.00 . A A . 101 LYS HZ1 1 1 7 12761 1 1 101 LYS HZ2 H -12.076 1.714 -19.009 1.00 . A A . 101 LYS HZ2 1 1 7 12762 1 1 101 LYS N N -7.464 -0.936 -13.540 1.00 . A A . 101 LYS N 1 1 7 12763 1 1 101 LYS NZ N -11.078 1.899 -19.021 1.00 . A A . 101 LYS NZ 1 1 7 12764 1 1 101 LYS O O -10.212 -1.552 -13.729 1.00 . A A . 101 LYS O 1 1 7 12765 1 1 102 LYS C C -11.761 -0.945 -10.993 1.00 . A A . 102 LYS C 1 1 7 12766 1 1 102 LYS CA C -11.886 0.026 -12.169 1.00 . A A . 102 LYS CA 1 1 7 12767 1 1 102 LYS CB C -12.725 -0.516 -13.328 1.00 . A A . 102 LYS CB 1 1 7 12768 1 1 102 LYS CD C -14.925 0.489 -14.043 1.00 . A A . 102 LYS CD 1 1 7 12769 1 1 102 LYS CE C -15.129 1.900 -13.488 1.00 . A A . 102 LYS CE 1 1 7 12770 1 1 102 LYS CG C -14.220 -0.405 -13.021 1.00 . A A . 102 LYS CG 1 1 7 12771 1 1 102 LYS H H -10.248 1.301 -12.346 1.00 . A A . 102 LYS H 1 1 7 12772 1 1 102 LYS HA H -12.373 0.935 -11.816 1.00 . A A . 102 LYS HA 1 1 7 12773 1 1 102 LYS HB2 H -12.495 0.037 -14.238 1.00 . A A . 102 LYS HB2 1 1 7 12774 1 1 102 LYS HB3 H -12.465 -1.558 -13.514 1.00 . A A . 102 LYS HB3 1 1 7 12775 1 1 102 LYS HD2 H -14.334 0.537 -14.958 1.00 . A A . 102 LYS HD2 1 1 7 12776 1 1 102 LYS HD3 H -15.889 0.055 -14.307 1.00 . A A . 102 LYS HD3 1 1 7 12777 1 1 102 LYS HE2 H -16.134 2.249 -13.726 1.00 . A A . 102 LYS HE2 1 1 7 12778 1 1 102 LYS HE3 H -15.047 1.885 -12.401 1.00 . A A . 102 LYS HE3 1 1 7 12779 1 1 102 LYS HG2 H -14.671 -1.398 -13.028 1.00 . A A . 102 LYS HG2 1 1 7 12780 1 1 102 LYS HG3 H -14.360 0.001 -12.019 1.00 . A A . 102 LYS HG3 1 1 7 12781 1 1 102 LYS HZ1 H -14.316 3.793 -13.799 1.00 . A A . 102 LYS HZ1 1 1 7 12782 1 1 102 LYS HZ2 H -13.189 2.620 -13.731 1.00 . A A . 102 LYS HZ2 1 1 7 12783 1 1 102 LYS N N -10.558 0.394 -12.631 1.00 . A A . 102 LYS N 1 1 7 12784 1 1 102 LYS NZ N -14.127 2.830 -14.054 1.00 . A A . 102 LYS NZ 1 1 7 12785 1 1 102 LYS O O -12.370 -2.014 -10.999 1.00 . A A . 102 LYS O 1 1 7 12786 1 1 103 SER C C -11.028 -0.540 -7.570 1.00 . A A . 103 SER C 1 1 7 12787 1 1 103 SER CA C -10.755 -1.359 -8.833 1.00 . A A . 103 SER CA 1 1 7 12788 1 1 103 SER CB C -9.333 -1.922 -8.803 1.00 . A A . 103 SER CB 1 1 7 12789 1 1 103 SER H H -10.477 0.333 -10.016 1.00 . A A . 103 SER H 1 1 7 12790 1 1 103 SER HA H -11.468 -2.178 -8.919 1.00 . A A . 103 SER HA 1 1 7 12791 1 1 103 SER HB2 H -8.984 -1.972 -7.771 1.00 . A A . 103 SER HB2 1 1 7 12792 1 1 103 SER HB3 H -9.339 -2.942 -9.187 1.00 . A A . 103 SER HB3 1 1 7 12793 1 1 103 SER HG H -8.551 -0.163 -9.352 1.00 . A A . 103 SER HG 1 1 7 12794 1 1 103 SER N N -10.968 -0.538 -10.013 1.00 . A A . 103 SER N 1 1 7 12795 1 1 103 SER O O -11.487 0.599 -7.651 1.00 . A A . 103 SER O 1 1 7 12796 1 1 103 SER OG O -8.429 -1.131 -9.571 1.00 . A A . 103 SER OG 1 1 7 12797 1 1 104 LYS C C -9.857 0.562 -4.943 1.00 . A A . 104 LYS C 1 1 7 12798 1 1 104 LYS CA C -10.945 -0.494 -5.153 1.00 . A A . 104 LYS CA 1 1 7 12799 1 1 104 LYS CB C -11.026 -1.526 -4.026 1.00 . A A . 104 LYS CB 1 1 7 12800 1 1 104 LYS CD C -13.415 -2.023 -3.391 1.00 . A A . 104 LYS CD 1 1 7 12801 1 1 104 LYS CE C -13.976 -3.190 -2.575 1.00 . A A . 104 LYS CE 1 1 7 12802 1 1 104 LYS CG C -12.215 -2.467 -4.229 1.00 . A A . 104 LYS CG 1 1 7 12803 1 1 104 LYS H H -10.363 -2.078 -6.374 1.00 . A A . 104 LYS H 1 1 7 12804 1 1 104 LYS HA H -11.910 0.010 -5.199 1.00 . A A . 104 LYS HA 1 1 7 12805 1 1 104 LYS HB2 H -10.102 -2.103 -3.990 1.00 . A A . 104 LYS HB2 1 1 7 12806 1 1 104 LYS HB3 H -11.120 -1.016 -3.067 1.00 . A A . 104 LYS HB3 1 1 7 12807 1 1 104 LYS HD2 H -13.117 -1.216 -2.721 1.00 . A A . 104 LYS HD2 1 1 7 12808 1 1 104 LYS HD3 H -14.191 -1.624 -4.044 1.00 . A A . 104 LYS HD3 1 1 7 12809 1 1 104 LYS HE2 H -13.169 -3.684 -2.035 1.00 . A A . 104 LYS HE2 1 1 7 12810 1 1 104 LYS HE3 H -14.677 -2.816 -1.829 1.00 . A A . 104 LYS HE3 1 1 7 12811 1 1 104 LYS HG2 H -12.491 -2.488 -5.284 1.00 . A A . 104 LYS HG2 1 1 7 12812 1 1 104 LYS HG3 H -11.930 -3.483 -3.954 1.00 . A A . 104 LYS HG3 1 1 7 12813 1 1 104 LYS HZ1 H -14.478 -5.119 -3.181 1.00 . A A . 104 LYS HZ1 1 1 7 12814 1 1 104 LYS HZ2 H -15.663 -4.037 -3.458 1.00 . A A . 104 LYS HZ2 1 1 7 12815 1 1 104 LYS N N -10.736 -1.152 -6.431 1.00 . A A . 104 LYS N 1 1 7 12816 1 1 104 LYS NZ N -14.656 -4.161 -3.461 1.00 . A A . 104 LYS NZ 1 1 7 12817 1 1 104 LYS O O -10.088 1.574 -4.284 1.00 . A A . 104 LYS O 1 1 7 12818 1 1 105 CYS C C -7.719 2.285 -6.471 1.00 . A A . 105 CYS C 1 1 7 12819 1 1 105 CYS CA C -7.570 1.202 -5.401 1.00 . A A . 105 CYS CA 1 1 7 12820 1 1 105 CYS CB C -6.232 0.468 -5.513 1.00 . A A . 105 CYS CB 1 1 7 12821 1 1 105 CYS H H -8.515 -0.537 -6.052 1.00 . A A . 105 CYS H 1 1 7 12822 1 1 105 CYS HA H -7.620 1.635 -4.402 1.00 . A A . 105 CYS HA 1 1 7 12823 1 1 105 CYS HB2 H -6.149 -0.007 -6.491 1.00 . A A . 105 CYS HB2 1 1 7 12824 1 1 105 CYS HB3 H -5.410 1.180 -5.434 1.00 . A A . 105 CYS HB3 1 1 7 12825 1 1 105 CYS N N -8.694 0.289 -5.517 1.00 . A A . 105 CYS N 1 1 7 12826 1 1 105 CYS O O -7.864 3.464 -6.151 1.00 . A A . 105 CYS O 1 1 7 12827 1 1 105 CYS SG S -6.096 -0.791 -4.193 1.00 . A A . 105 CYS SG 1 1 7 12828 1 1 106 HIS C C -9.220 2.680 -9.414 1.00 . A A . 106 HIS C 1 1 7 12829 1 1 106 HIS CA C -7.804 2.765 -8.840 1.00 . A A . 106 HIS CA 1 1 7 12830 1 1 106 HIS CB C -6.722 2.497 -9.889 1.00 . A A . 106 HIS CB 1 1 7 12831 1 1 106 HIS CD2 C -4.255 1.791 -9.394 1.00 . A A . 106 HIS CD2 1 1 7 12832 1 1 106 HIS CE1 C -3.598 3.629 -8.404 1.00 . A A . 106 HIS CE1 1 1 7 12833 1 1 106 HIS CG C -5.313 2.652 -9.370 1.00 . A A . 106 HIS CG 1 1 7 12834 1 1 106 HIS H H -7.558 0.887 -7.973 1.00 . A A . 106 HIS H 1 1 7 12835 1 1 106 HIS HA H -7.641 3.767 -8.443 1.00 . A A . 106 HIS HA 1 1 7 12836 1 1 106 HIS HB2 H -6.847 1.485 -10.274 1.00 . A A . 106 HIS HB2 1 1 7 12837 1 1 106 HIS HB3 H -6.867 3.178 -10.727 1.00 . A A . 106 HIS HB3 1 1 7 12838 1 1 106 HIS HD1 H -5.413 4.621 -8.566 1.00 . A A . 106 HIS HD1 1 1 7 12839 1 1 106 HIS HD2 H -4.259 0.788 -9.819 1.00 . A A . 106 HIS HD2 1 1 7 12840 1 1 106 HIS HE1 H -2.966 4.355 -7.893 1.00 . A A . 106 HIS HE1 1 1 7 12841 1 1 106 HIS N N -7.676 1.847 -7.721 1.00 . A A . 106 HIS N 1 1 7 12842 1 1 106 HIS ND1 N -4.868 3.801 -8.739 1.00 . A A . 106 HIS ND1 1 1 7 12843 1 1 106 HIS NE2 N -3.219 2.383 -8.811 1.00 . A A . 106 HIS NE2 1 1 7 12844 1 1 106 HIS O O -9.824 1.609 -9.430 1.00 . A A . 106 HIS O 1 1 7 12845 1 1 107 GLU C C -10.990 4.534 -11.833 1.00 . A A . 107 GLU C 1 1 7 12846 1 1 107 GLU CA C -11.041 3.893 -10.445 1.00 . A A . 107 GLU CA 1 1 7 12847 1 1 107 GLU CB C -11.995 4.655 -9.524 1.00 . A A . 107 GLU CB 1 1 7 12848 1 1 107 GLU CD C -13.975 4.090 -8.067 1.00 . A A . 107 GLU CD 1 1 7 12849 1 1 107 GLU CG C -12.523 3.749 -8.410 1.00 . A A . 107 GLU CG 1 1 7 12850 1 1 107 GLU H H -9.209 4.690 -9.856 1.00 . A A . 107 GLU H 1 1 7 12851 1 1 107 GLU HA H -11.375 2.858 -10.528 1.00 . A A . 107 GLU HA 1 1 7 12852 1 1 107 GLU HB2 H -11.479 5.510 -9.088 1.00 . A A . 107 GLU HB2 1 1 7 12853 1 1 107 GLU HB3 H -12.830 5.048 -10.104 1.00 . A A . 107 GLU HB3 1 1 7 12854 1 1 107 GLU HG2 H -12.454 2.706 -8.721 1.00 . A A . 107 GLU HG2 1 1 7 12855 1 1 107 GLU HG3 H -11.901 3.858 -7.522 1.00 . A A . 107 GLU HG3 1 1 7 12856 1 1 107 GLU N N -9.707 3.824 -9.872 1.00 . A A . 107 GLU N 1 1 7 12857 1 1 107 GLU O O -11.411 3.928 -12.817 1.00 . A A . 107 GLU O 1 1 7 12858 1 1 107 GLU OXT O -10.506 5.684 -11.910 1.00 . A A . 107 GLU OXT 1 1 7 12859 1 1 107 GLU OE1 O -14.284 5.300 -8.050 1.00 . A A . 107 GLU OE1 1 1 7 12860 1 1 107 GLU OE2 O -14.742 3.132 -7.831 1.00 . A A . 107 GLU OE2 1 1 7 12861 2 2 1 HEC C1A C -1.150 5.460 9.181 1.00 . B A . 108 HEC C1A 1 1 7 12862 2 2 1 HEC C1B C -2.076 2.341 12.025 1.00 . B A . 108 HEC C1B 1 1 7 12863 2 2 1 HEC C1C C -2.299 -0.538 8.750 1.00 . B A . 108 HEC C1C 1 1 7 12864 2 2 1 HEC C1D C -1.201 2.574 5.961 1.00 . B A . 108 HEC C1D 1 1 7 12865 2 2 1 HEC C2A C -0.954 6.517 10.144 1.00 . B A . 108 HEC C2A 1 1 7 12866 2 2 1 HEC C2B C -2.453 1.438 13.086 1.00 . B A . 108 HEC C2B 1 1 7 12867 2 2 1 HEC C2C C -2.343 -1.618 7.793 1.00 . B A . 108 HEC C2C 1 1 7 12868 2 2 1 HEC C2D C -0.773 3.480 4.922 1.00 . B A . 108 HEC C2D 1 1 7 12869 2 2 1 HEC C3A C -1.170 5.986 11.366 1.00 . B A . 108 HEC C3A 1 1 7 12870 2 2 1 HEC C3B C -2.641 0.224 12.526 1.00 . B A . 108 HEC C3B 1 1 7 12871 2 2 1 HEC C3C C -2.029 -1.095 6.589 1.00 . B A . 108 HEC C3C 1 1 7 12872 2 2 1 HEC C3D C -0.656 4.702 5.483 1.00 . B A . 108 HEC C3D 1 1 7 12873 2 2 1 HEC C4A C -1.501 4.594 11.171 1.00 . B A . 108 HEC C4A 1 1 7 12874 2 2 1 HEC C4B C -2.381 0.364 11.113 1.00 . B A . 108 HEC C4B 1 1 7 12875 2 2 1 HEC C4C C -1.788 0.315 6.789 1.00 . B A . 108 HEC C4C 1 1 7 12876 2 2 1 HEC C4D C -1.012 4.565 6.876 1.00 . B A . 108 HEC C4D 1 1 7 12877 2 2 1 HEC CAA C -0.580 7.931 9.804 1.00 . B A . 108 HEC CAA 1 1 7 12878 2 2 1 HEC CAB C -3.042 -1.054 13.204 1.00 . B A . 108 HEC CAB 1 1 7 12879 2 2 1 HEC CAC C -1.936 -1.803 5.269 1.00 . B A . 108 HEC CAC 1 1 7 12880 2 2 1 HEC CAD C -0.241 5.985 4.825 1.00 . B A . 108 HEC CAD 1 1 7 12881 2 2 1 HEC CBA C 0.554 8.494 10.655 1.00 . B A . 108 HEC CBA 1 1 7 12882 2 2 1 HEC CBB C -4.286 -0.928 14.080 1.00 . B A . 108 HEC CBB 1 1 7 12883 2 2 1 HEC CBC C -2.955 -2.925 5.093 1.00 . B A . 108 HEC CBC 1 1 7 12884 2 2 1 HEC CBD C -0.816 6.179 3.425 1.00 . B A . 108 HEC CBD 1 1 7 12885 2 2 1 HEC CGA C 0.136 9.789 11.337 1.00 . B A . 108 HEC CGA 1 1 7 12886 2 2 1 HEC CGD C 0.292 6.373 2.399 1.00 . B A . 108 HEC CGD 1 1 7 12887 2 2 1 HEC CHA C -1.015 5.621 7.806 1.00 . B A . 108 HEC CHA 1 1 7 12888 2 2 1 HEC CHB C -1.797 3.691 12.209 1.00 . B A . 108 HEC CHB 1 1 7 12889 2 2 1 HEC CHC C -2.471 -0.684 10.178 1.00 . B A . 108 HEC CHC 1 1 7 12890 2 2 1 HEC CHD C -1.432 1.216 5.769 1.00 . B A . 108 HEC CHD 1 1 7 12891 2 2 1 HEC CMA C -1.091 6.672 12.699 1.00 . B A . 108 HEC CMA 1 1 7 12892 2 2 1 HEC CMB C -2.598 1.822 14.530 1.00 . B A . 108 HEC CMB 1 1 7 12893 2 2 1 HEC CMC C -2.679 -3.044 8.121 1.00 . B A . 108 HEC CMC 1 1 7 12894 2 2 1 HEC CMD C -0.517 3.090 3.495 1.00 . B A . 108 HEC CMD 1 1 7 12895 2 2 1 HEC FE FE -1.706 2.462 8.980 1.00 . B A . 108 HEC FE 1 1 7 12896 2 2 1 HEC HAA1 H -0.258 7.981 8.764 1.00 . B A . 108 HEC HAA1 1 1 7 12897 2 2 1 HEC HAA2 H -1.444 8.580 9.949 1.00 . B A . 108 HEC HAA2 1 1 7 12898 2 2 1 HEC HAB H -3.255 -1.813 12.451 1.00 . B A . 108 HEC HAB 1 1 7 12899 2 2 1 HEC HAC H -2.100 -1.090 4.461 1.00 . B A . 108 HEC HAC 1 1 7 12900 2 2 1 HEC HAD1 H -0.575 6.828 5.430 1.00 . B A . 108 HEC HAD1 1 1 7 12901 2 2 1 HEC HAD2 H 0.845 6.011 4.733 1.00 . B A . 108 HEC HAD2 1 1 7 12902 2 2 1 HEC HBA1 H 0.829 7.769 11.421 1.00 . B A . 108 HEC HBA1 1 1 7 12903 2 2 1 HEC HBA2 H 1.417 8.698 10.021 1.00 . B A . 108 HEC HBA2 1 1 7 12904 2 2 1 HEC HBB1 H -4.794 0.010 13.856 1.00 . B A . 108 HEC HBB1 1 1 7 12905 2 2 1 HEC HBB2 H -4.957 -1.763 13.879 1.00 . B A . 108 HEC HBB2 1 1 7 12906 2 2 1 HEC HBB3 H -3.993 -0.941 15.130 1.00 . B A . 108 HEC HBB3 1 1 7 12907 2 2 1 HEC HBC1 H -2.745 -3.722 5.806 1.00 . B A . 108 HEC HBC1 1 1 7 12908 2 2 1 HEC HBC2 H -3.958 -2.535 5.270 1.00 . B A . 108 HEC HBC2 1 1 7 12909 2 2 1 HEC HBC3 H -2.892 -3.318 4.078 1.00 . B A . 108 HEC HBC3 1 1 7 12910 2 2 1 HEC HBD1 H -1.398 5.301 3.146 1.00 . B A . 108 HEC HBD1 1 1 7 12911 2 2 1 HEC HBD2 H -1.457 7.060 3.414 1.00 . B A . 108 HEC HBD2 1 1 7 12912 2 2 1 HEC HHA H -0.905 6.633 7.417 1.00 . B A . 108 HEC HHA 1 1 7 12913 2 2 1 HEC HHB H -1.806 4.082 13.227 1.00 . B A . 108 HEC HHB 1 1 7 12914 2 2 1 HEC HHC H -2.672 -1.684 10.562 1.00 . B A . 108 HEC HHC 1 1 7 12915 2 2 1 HEC HHD H -1.332 0.818 4.759 1.00 . B A . 108 HEC HHD 1 1 7 12916 2 2 1 HEC HMA1 H -0.047 6.838 12.961 1.00 . B A . 108 HEC HMA1 1 1 7 12917 2 2 1 HEC HMA2 H -1.610 7.629 12.646 1.00 . B A . 108 HEC HMA2 1 1 7 12918 2 2 1 HEC HMA3 H -1.561 6.045 13.458 1.00 . B A . 108 HEC HMA3 1 1 7 12919 2 2 1 HEC HMB1 H -3.179 1.062 15.052 1.00 . B A . 108 HEC HMB1 1 1 7 12920 2 2 1 HEC HMB2 H -1.611 1.901 14.985 1.00 . B A . 108 HEC HMB2 1 1 7 12921 2 2 1 HEC HMB3 H -3.109 2.783 14.601 1.00 . B A . 108 HEC HMB3 1 1 7 12922 2 2 1 HEC HMC1 H -1.949 -3.706 7.657 1.00 . B A . 108 HEC HMC1 1 1 7 12923 2 2 1 HEC HMC2 H -2.660 -3.182 9.202 1.00 . B A . 108 HEC HMC2 1 1 7 12924 2 2 1 HEC HMC3 H -3.674 -3.279 7.742 1.00 . B A . 108 HEC HMC3 1 1 7 12925 2 2 1 HEC HMD1 H -1.456 3.098 2.942 1.00 . B A . 108 HEC HMD1 1 1 7 12926 2 2 1 HEC HMD2 H 0.177 3.799 3.043 1.00 . B A . 108 HEC HMD2 1 1 7 12927 2 2 1 HEC HMD3 H -0.085 2.089 3.463 1.00 . B A . 108 HEC HMD3 1 1 7 12928 2 2 1 HEC NA N -1.486 4.281 9.823 1.00 . B A . 108 HEC NA 1 1 7 12929 2 2 1 HEC NB N -2.035 1.670 10.815 1.00 . B A . 108 HEC NB 1 1 7 12930 2 2 1 HEC NC N -1.957 0.646 8.122 1.00 . B A . 108 HEC NC 1 1 7 12931 2 2 1 HEC ND N -1.345 3.252 7.159 1.00 . B A . 108 HEC ND 1 1 7 12932 2 2 1 HEC O1A O -1.044 9.861 11.743 1.00 . B A . 108 HEC O1A 1 1 7 12933 2 2 1 HEC O1D O 1.278 5.607 2.477 1.00 . B A . 108 HEC O1D 1 1 7 12934 2 2 1 HEC O2A O 1.005 10.682 11.441 1.00 . B A . 108 HEC O2A 1 1 7 12935 2 2 1 HEC O2D O 0.134 7.283 1.557 1.00 . B A . 108 HEC O2D 1 1 7 12936 3 2 1 HEC C1A C 9.618 -1.812 1.795 1.00 . C A . 109 HEC C1A 1 1 7 12937 3 2 1 HEC C1B C 5.778 -0.093 2.784 1.00 . C A . 109 HEC C1B 1 1 7 12938 3 2 1 HEC C1C C 7.801 2.916 5.253 1.00 . C A . 109 HEC C1C 1 1 7 12939 3 2 1 HEC C1D C 11.615 1.356 3.951 1.00 . C A . 109 HEC C1D 1 1 7 12940 3 2 1 HEC C2A C 9.113 -2.895 0.983 1.00 . C A . 109 HEC C2A 1 1 7 12941 3 2 1 HEC C2B C 4.421 0.283 3.105 1.00 . C A . 109 HEC C2B 1 1 7 12942 3 2 1 HEC C2C C 8.321 4.054 5.975 1.00 . C A . 109 HEC C2C 1 1 7 12943 3 2 1 HEC C2D C 12.963 0.889 3.729 1.00 . C A . 109 HEC C2D 1 1 7 12944 3 2 1 HEC C3A C 7.771 -2.766 0.940 1.00 . C A . 109 HEC C3A 1 1 7 12945 3 2 1 HEC C3B C 4.489 1.324 3.961 1.00 . C A . 109 HEC C3B 1 1 7 12946 3 2 1 HEC C3C C 9.663 4.033 5.835 1.00 . C A . 109 HEC C3C 1 1 7 12947 3 2 1 HEC C3D C 12.875 -0.252 3.014 1.00 . C A . 109 HEC C3D 1 1 7 12948 3 2 1 HEC C4A C 7.430 -1.603 1.725 1.00 . C A . 109 HEC C4A 1 1 7 12949 3 2 1 HEC C4B C 5.889 1.604 4.179 1.00 . C A . 109 HEC C4B 1 1 7 12950 3 2 1 HEC C4C C 9.988 2.882 5.026 1.00 . C A . 109 HEC C4C 1 1 7 12951 3 2 1 HEC C4D C 11.472 -0.504 2.786 1.00 . C A . 109 HEC C4D 1 1 7 12952 3 2 1 HEC CAA C 9.963 -3.945 0.329 1.00 . C A . 109 HEC CAA 1 1 7 12953 3 2 1 HEC CAB C 3.354 2.078 4.591 1.00 . C A . 109 HEC CAB 1 1 7 12954 3 2 1 HEC CAC C 10.665 5.000 6.396 1.00 . C A . 109 HEC CAC 1 1 7 12955 3 2 1 HEC CAD C 13.995 -1.126 2.527 1.00 . C A . 109 HEC CAD 1 1 7 12956 3 2 1 HEC CBA C 10.175 -3.728 -1.167 1.00 . C A . 109 HEC CBA 1 1 7 12957 3 2 1 HEC CBB C 2.292 1.185 5.225 1.00 . C A . 109 HEC CBB 1 1 7 12958 3 2 1 HEC CBC C 10.628 5.120 7.917 1.00 . C A . 109 HEC CBC 1 1 7 12959 3 2 1 HEC CBD C 15.123 -1.310 3.538 1.00 . C A . 109 HEC CBD 1 1 7 12960 3 2 1 HEC CGA C 10.902 -4.909 -1.794 1.00 . C A . 109 HEC CGA 1 1 7 12961 3 2 1 HEC CGD C 16.433 -0.745 3.006 1.00 . C A . 109 HEC CGD 1 1 7 12962 3 2 1 HEC CHA C 10.965 -1.606 2.075 1.00 . C A . 109 HEC CHA 1 1 7 12963 3 2 1 HEC CHB C 6.119 -1.132 1.926 1.00 . C A . 109 HEC CHB 1 1 7 12964 3 2 1 HEC CHC C 6.377 2.624 5.015 1.00 . C A . 109 HEC CHC 1 1 7 12965 3 2 1 HEC CHD C 11.293 2.512 4.654 1.00 . C A . 109 HEC CHD 1 1 7 12966 3 2 1 HEC CMA C 6.781 -3.641 0.226 1.00 . C A . 109 HEC CMA 1 1 7 12967 3 2 1 HEC CMB C 3.193 -0.389 2.562 1.00 . C A . 109 HEC CMB 1 1 7 12968 3 2 1 HEC CMC C 7.484 5.049 6.726 1.00 . C A . 109 HEC CMC 1 1 7 12969 3 2 1 HEC CMD C 14.202 1.579 4.221 1.00 . C A . 109 HEC CMD 1 1 7 12970 3 2 1 HEC FE FE 8.697 0.599 3.434 1.00 . C A . 109 HEC FE 1 1 7 12971 3 2 1 HEC HAA1 H 10.948 -3.958 0.795 1.00 . C A . 109 HEC HAA1 1 1 7 12972 3 2 1 HEC HAA2 H 9.491 -4.920 0.448 1.00 . C A . 109 HEC HAA2 1 1 7 12973 3 2 1 HEC HAB H 3.741 2.727 5.377 1.00 . C A . 109 HEC HAB 1 1 7 12974 3 2 1 HEC HAC H 11.671 4.680 6.122 1.00 . C A . 109 HEC HAC 1 1 7 12975 3 2 1 HEC HAD1 H 13.607 -2.118 2.295 1.00 . C A . 109 HEC HAD1 1 1 7 12976 3 2 1 HEC HAD2 H 14.434 -0.688 1.631 1.00 . C A . 109 HEC HAD2 1 1 7 12977 3 2 1 HEC HBA1 H 9.209 -3.613 -1.658 1.00 . C A . 109 HEC HBA1 1 1 7 12978 3 2 1 HEC HBA2 H 10.772 -2.829 -1.323 1.00 . C A . 109 HEC HBA2 1 1 7 12979 3 2 1 HEC HBB1 H 1.735 1.755 5.969 1.00 . C A . 109 HEC HBB1 1 1 7 12980 3 2 1 HEC HBB2 H 1.609 0.829 4.454 1.00 . C A . 109 HEC HBB2 1 1 7 12981 3 2 1 HEC HBB3 H 2.773 0.333 5.706 1.00 . C A . 109 HEC HBB3 1 1 7 12982 3 2 1 HEC HBC1 H 9.686 5.574 8.223 1.00 . C A . 109 HEC HBC1 1 1 7 12983 3 2 1 HEC HBC2 H 10.715 4.129 8.361 1.00 . C A . 109 HEC HBC2 1 1 7 12984 3 2 1 HEC HBC3 H 11.458 5.743 8.252 1.00 . C A . 109 HEC HBC3 1 1 7 12985 3 2 1 HEC HBD1 H 14.871 -0.791 4.463 1.00 . C A . 109 HEC HBD1 1 1 7 12986 3 2 1 HEC HBD2 H 15.259 -2.372 3.742 1.00 . C A . 109 HEC HBD2 1 1 7 12987 3 2 1 HEC HHA H 11.680 -2.348 1.719 1.00 . C A . 109 HEC HHA 1 1 7 12988 3 2 1 HEC HHB H 5.319 -1.619 1.368 1.00 . C A . 109 HEC HHB 1 1 7 12989 3 2 1 HEC HHC H 5.645 3.239 5.538 1.00 . C A . 109 HEC HHC 1 1 7 12990 3 2 1 HEC HHD H 12.106 3.181 4.938 1.00 . C A . 109 HEC HHD 1 1 7 12991 3 2 1 HEC HMA1 H 6.999 -4.687 0.442 1.00 . C A . 109 HEC HMA1 1 1 7 12992 3 2 1 HEC HMA2 H 5.773 -3.401 0.566 1.00 . C A . 109 HEC HMA2 1 1 7 12993 3 2 1 HEC HMA3 H 6.853 -3.469 -0.848 1.00 . C A . 109 HEC HMA3 1 1 7 12994 3 2 1 HEC HMB1 H 2.351 0.303 2.606 1.00 . C A . 109 HEC HMB1 1 1 7 12995 3 2 1 HEC HMB2 H 3.368 -0.684 1.527 1.00 . C A . 109 HEC HMB2 1 1 7 12996 3 2 1 HEC HMB3 H 2.969 -1.272 3.159 1.00 . C A . 109 HEC HMB3 1 1 7 12997 3 2 1 HEC HMC1 H 7.756 6.058 6.418 1.00 . C A . 109 HEC HMC1 1 1 7 12998 3 2 1 HEC HMC2 H 6.430 4.874 6.510 1.00 . C A . 109 HEC HMC2 1 1 7 12999 3 2 1 HEC HMC3 H 7.660 4.936 7.796 1.00 . C A . 109 HEC HMC3 1 1 7 13000 3 2 1 HEC HMD1 H 14.296 1.434 5.297 1.00 . C A . 109 HEC HMD1 1 1 7 13001 3 2 1 HEC HMD2 H 15.075 1.159 3.720 1.00 . C A . 109 HEC HMD2 1 1 7 13002 3 2 1 HEC HMD3 H 14.136 2.645 4.002 1.00 . C A . 109 HEC HMD3 1 1 7 13003 3 2 1 HEC NA N 8.573 -1.024 2.246 1.00 . C A . 109 HEC NA 1 1 7 13004 3 2 1 HEC NB N 6.673 0.726 3.451 1.00 . C A . 109 HEC NB 1 1 7 13005 3 2 1 HEC NC N 8.835 2.202 4.674 1.00 . C A . 109 HEC NC 1 1 7 13006 3 2 1 HEC ND N 10.705 0.491 3.366 1.00 . C A . 109 HEC ND 1 1 7 13007 3 2 1 HEC O1A O 10.644 -5.164 -2.990 1.00 . C A . 109 HEC O1A 1 1 7 13008 3 2 1 HEC O1D O 17.165 -0.145 3.822 1.00 . C A . 109 HEC O1D 1 1 7 13009 3 2 1 HEC O2A O 11.702 -5.535 -1.066 1.00 . C A . 109 HEC O2A 1 1 7 13010 3 2 1 HEC O2D O 16.677 -0.924 1.793 1.00 . C A . 109 HEC O2D 1 1 7 13011 4 2 1 HEC C1A C -8.711 -3.247 0.344 1.00 . D A . 110 HEC C1A 1 1 7 13012 4 2 1 HEC C1B C -4.953 -1.130 0.079 1.00 . D A . 110 HEC C1B 1 1 7 13013 4 2 1 HEC C1C C -2.956 -4.439 2.042 1.00 . D A . 110 HEC C1C 1 1 7 13014 4 2 1 HEC C1D C -6.730 -6.520 2.354 1.00 . D A . 110 HEC C1D 1 1 7 13015 4 2 1 HEC C2A C -9.513 -2.255 -0.332 1.00 . D A . 110 HEC C2A 1 1 7 13016 4 2 1 HEC C2B C -3.775 -0.320 -0.128 1.00 . D A . 110 HEC C2B 1 1 7 13017 4 2 1 HEC C2C C -2.141 -5.473 2.634 1.00 . D A . 110 HEC C2C 1 1 7 13018 4 2 1 HEC C2D C -7.919 -7.287 2.641 1.00 . D A . 110 HEC C2D 1 1 7 13019 4 2 1 HEC C3A C -8.687 -1.246 -0.679 1.00 . D A . 110 HEC C3A 1 1 7 13020 4 2 1 HEC C3B C -2.746 -0.955 0.472 1.00 . D A . 110 HEC C3B 1 1 7 13021 4 2 1 HEC C3C C -2.965 -6.493 2.955 1.00 . D A . 110 HEC C3C 1 1 7 13022 4 2 1 HEC C3D C -8.964 -6.609 2.123 1.00 . D A . 110 HEC C3D 1 1 7 13023 4 2 1 HEC C4A C -7.365 -1.602 -0.222 1.00 . D A . 110 HEC C4A 1 1 7 13024 4 2 1 HEC C4B C -3.276 -2.164 1.057 1.00 . D A . 110 HEC C4B 1 1 7 13025 4 2 1 HEC C4C C -4.298 -6.101 2.563 1.00 . D A . 110 HEC C4C 1 1 7 13026 4 2 1 HEC C4D C -8.433 -5.415 1.509 1.00 . D A . 110 HEC C4D 1 1 7 13027 4 2 1 HEC CAA C -10.989 -2.368 -0.580 1.00 . D A . 110 HEC CAA 1 1 7 13028 4 2 1 HEC CAB C -1.310 -0.524 0.544 1.00 . D A . 110 HEC CAB 1 1 7 13029 4 2 1 HEC CAC C -2.608 -7.802 3.596 1.00 . D A . 110 HEC CAC 1 1 7 13030 4 2 1 HEC CAD C -10.417 -6.985 2.154 1.00 . D A . 110 HEC CAD 1 1 7 13031 4 2 1 HEC CBA C -11.830 -2.428 0.693 1.00 . D A . 110 HEC CBA 1 1 7 13032 4 2 1 HEC CBB C -1.118 0.924 0.987 1.00 . D A . 110 HEC CBB 1 1 7 13033 4 2 1 HEC CBC C -1.324 -7.761 4.419 1.00 . D A . 110 HEC CBC 1 1 7 13034 4 2 1 HEC CBD C -11.009 -7.287 0.780 1.00 . D A . 110 HEC CBD 1 1 7 13035 4 2 1 HEC CGA C -11.962 -1.051 1.327 1.00 . D A . 110 HEC CGA 1 1 7 13036 4 2 1 HEC CGD C -11.734 -8.625 0.779 1.00 . D A . 110 HEC CGD 1 1 7 13037 4 2 1 HEC CHA C -9.209 -4.441 0.855 1.00 . D A . 110 HEC CHA 1 1 7 13038 4 2 1 HEC CHB C -6.219 -0.804 -0.394 1.00 . D A . 110 HEC CHB 1 1 7 13039 4 2 1 HEC CHC C -2.514 -3.103 1.775 1.00 . D A . 110 HEC CHC 1 1 7 13040 4 2 1 HEC CHD C -5.445 -6.897 2.731 1.00 . D A . 110 HEC CHD 1 1 7 13041 4 2 1 HEC CMA C -9.033 0.023 -1.403 1.00 . D A . 110 HEC CMA 1 1 7 13042 4 2 1 HEC CMB C -3.748 0.979 -0.878 1.00 . D A . 110 HEC CMB 1 1 7 13043 4 2 1 HEC CMC C -0.656 -5.385 2.837 1.00 . D A . 110 HEC CMC 1 1 7 13044 4 2 1 HEC CMD C -7.940 -8.592 3.383 1.00 . D A . 110 HEC CMD 1 1 7 13045 4 2 1 HEC FE FE -5.841 -3.826 1.219 1.00 . D A . 110 HEC FE 1 1 7 13046 4 2 1 HEC HAA1 H -11.330 -1.503 -1.149 1.00 . D A . 110 HEC HAA1 1 1 7 13047 4 2 1 HEC HAA2 H -11.194 -3.278 -1.144 1.00 . D A . 110 HEC HAA2 1 1 7 13048 4 2 1 HEC HAB H -0.778 -1.152 1.258 1.00 . D A . 110 HEC HAB 1 1 7 13049 4 2 1 HEC HAC H -3.411 -8.109 4.266 1.00 . D A . 110 HEC HAC 1 1 7 13050 4 2 1 HEC HAD1 H -10.548 -7.878 2.764 1.00 . D A . 110 HEC HAD1 1 1 7 13051 4 2 1 HEC HAD2 H -10.995 -6.165 2.580 1.00 . D A . 110 HEC HAD2 1 1 7 13052 4 2 1 HEC HBA1 H -12.826 -2.799 0.453 1.00 . D A . 110 HEC HBA1 1 1 7 13053 4 2 1 HEC HBA2 H -11.355 -3.098 1.410 1.00 . D A . 110 HEC HBA2 1 1 7 13054 4 2 1 HEC HBB1 H -0.314 0.975 1.721 1.00 . D A . 110 HEC HBB1 1 1 7 13055 4 2 1 HEC HBB2 H -0.861 1.536 0.123 1.00 . D A . 110 HEC HBB2 1 1 7 13056 4 2 1 HEC HBB3 H -2.042 1.293 1.432 1.00 . D A . 110 HEC HBB3 1 1 7 13057 4 2 1 HEC HBC1 H -1.304 -8.608 5.105 1.00 . D A . 110 HEC HBC1 1 1 7 13058 4 2 1 HEC HBC2 H -0.463 -7.814 3.753 1.00 . D A . 110 HEC HBC2 1 1 7 13059 4 2 1 HEC HBC3 H -1.287 -6.832 4.988 1.00 . D A . 110 HEC HBC3 1 1 7 13060 4 2 1 HEC HBD1 H -11.720 -6.506 0.511 1.00 . D A . 110 HEC HBD1 1 1 7 13061 4 2 1 HEC HBD2 H -10.210 -7.323 0.040 1.00 . D A . 110 HEC HBD2 1 1 7 13062 4 2 1 HEC HHA H -10.275 -4.640 0.743 1.00 . D A . 110 HEC HHA 1 1 7 13063 4 2 1 HEC HHB H -6.337 0.133 -0.938 1.00 . D A . 110 HEC HHB 1 1 7 13064 4 2 1 HEC HHC H -1.528 -2.793 2.119 1.00 . D A . 110 HEC HHC 1 1 7 13065 4 2 1 HEC HHD H -5.314 -7.877 3.190 1.00 . D A . 110 HEC HHD 1 1 7 13066 4 2 1 HEC HMA1 H -8.825 0.877 -0.759 1.00 . D A . 110 HEC HMA1 1 1 7 13067 4 2 1 HEC HMA2 H -8.433 0.099 -2.310 1.00 . D A . 110 HEC HMA2 1 1 7 13068 4 2 1 HEC HMA3 H -10.090 0.015 -1.667 1.00 . D A . 110 HEC HMA3 1 1 7 13069 4 2 1 HEC HMB1 H -4.567 1.001 -1.597 1.00 . D A . 110 HEC HMB1 1 1 7 13070 4 2 1 HEC HMB2 H -3.859 1.806 -0.177 1.00 . D A . 110 HEC HMB2 1 1 7 13071 4 2 1 HEC HMB3 H -2.799 1.075 -1.406 1.00 . D A . 110 HEC HMB3 1 1 7 13072 4 2 1 HEC HMC1 H -0.186 -6.300 2.476 1.00 . D A . 110 HEC HMC1 1 1 7 13073 4 2 1 HEC HMC2 H -0.264 -4.533 2.283 1.00 . D A . 110 HEC HMC2 1 1 7 13074 4 2 1 HEC HMC3 H -0.441 -5.260 3.898 1.00 . D A . 110 HEC HMC3 1 1 7 13075 4 2 1 HEC HMD1 H -7.844 -8.404 4.452 1.00 . D A . 110 HEC HMD1 1 1 7 13076 4 2 1 HEC HMD2 H -8.882 -9.105 3.188 1.00 . D A . 110 HEC HMD2 1 1 7 13077 4 2 1 HEC HMD3 H -7.111 -9.214 3.047 1.00 . D A . 110 HEC HMD3 1 1 7 13078 4 2 1 HEC NA N -7.391 -2.835 0.407 1.00 . D A . 110 HEC NA 1 1 7 13079 4 2 1 HEC NB N -4.634 -2.262 0.810 1.00 . D A . 110 HEC NB 1 1 7 13080 4 2 1 HEC NC N -4.281 -4.835 2.003 1.00 . D A . 110 HEC NC 1 1 7 13081 4 2 1 HEC ND N -7.057 -5.370 1.657 1.00 . D A . 110 HEC ND 1 1 7 13082 4 2 1 HEC O1A O -10.938 -0.569 1.856 1.00 . D A . 110 HEC O1A 1 1 7 13083 4 2 1 HEC O1D O -12.896 -8.641 0.319 1.00 . D A . 110 HEC O1D 1 1 7 13084 4 2 1 HEC O2A O -13.086 -0.506 1.270 1.00 . D A . 110 HEC O2A 1 1 7 13085 4 2 1 HEC O2D O -11.112 -9.608 1.237 1.00 . D A . 110 HEC O2D 1 1 7 13086 5 2 1 HEC C1A C 0.029 4.047 -9.092 1.00 . E A . 111 HEC C1A 1 1 7 13087 5 2 1 HEC C1B C -1.269 0.624 -11.392 1.00 . E A . 111 HEC C1B 1 1 7 13088 5 2 1 HEC C1C C -3.092 -1.070 -7.807 1.00 . E A . 111 HEC C1C 1 1 7 13089 5 2 1 HEC C1D C -1.702 2.326 -5.525 1.00 . E A . 111 HEC C1D 1 1 7 13090 5 2 1 HEC C2A C 0.664 4.750 -10.182 1.00 . E A . 111 HEC C2A 1 1 7 13091 5 2 1 HEC C2B C -1.426 -0.526 -12.250 1.00 . E A . 111 HEC C2B 1 1 7 13092 5 2 1 HEC C2C C -3.856 -1.686 -6.748 1.00 . E A . 111 HEC C2C 1 1 7 13093 5 2 1 HEC C2D C -1.143 3.277 -4.593 1.00 . E A . 111 HEC C2D 1 1 7 13094 5 2 1 HEC C3A C 0.476 4.010 -11.295 1.00 . E A . 111 HEC C3A 1 1 7 13095 5 2 1 HEC C3B C -2.039 -1.483 -11.521 1.00 . E A . 111 HEC C3B 1 1 7 13096 5 2 1 HEC C3C C -3.719 -0.907 -5.655 1.00 . E A . 111 HEC C3C 1 1 7 13097 5 2 1 HEC C3D C -0.452 4.182 -5.316 1.00 . E A . 111 HEC C3D 1 1 7 13098 5 2 1 HEC C4A C -0.277 2.841 -10.906 1.00 . E A . 111 HEC C4A 1 1 7 13099 5 2 1 HEC C4B C -2.267 -0.935 -10.205 1.00 . E A . 111 HEC C4B 1 1 7 13100 5 2 1 HEC C4C C -2.868 0.199 -6.025 1.00 . E A . 111 HEC C4C 1 1 7 13101 5 2 1 HEC C4D C -0.575 3.801 -6.703 1.00 . E A . 111 HEC C4D 1 1 7 13102 5 2 1 HEC CAA C 1.388 6.059 -10.054 1.00 . E A . 111 HEC CAA 1 1 7 13103 5 2 1 HEC CAB C -2.428 -2.867 -11.955 1.00 . E A . 111 HEC CAB 1 1 7 13104 5 2 1 HEC CAC C -4.317 -1.112 -4.293 1.00 . E A . 111 HEC CAC 1 1 7 13105 5 2 1 HEC CAD C 0.315 5.373 -4.817 1.00 . E A . 111 HEC CAD 1 1 7 13106 5 2 1 HEC CBA C 2.817 6.033 -10.588 1.00 . E A . 111 HEC CBA 1 1 7 13107 5 2 1 HEC CBB C -1.381 -3.932 -11.644 1.00 . E A . 111 HEC CBB 1 1 7 13108 5 2 1 HEC CBC C -4.162 -2.531 -3.754 1.00 . E A . 111 HEC CBC 1 1 7 13109 5 2 1 HEC CBD C -0.562 6.567 -4.452 1.00 . E A . 111 HEC CBD 1 1 7 13110 5 2 1 HEC CGA C 3.016 7.083 -11.671 1.00 . E A . 111 HEC CGA 1 1 7 13111 5 2 1 HEC CGD C 0.284 7.761 -4.034 1.00 . E A . 111 HEC CGD 1 1 7 13112 5 2 1 HEC CHA C 0.008 4.498 -7.777 1.00 . E A . 111 HEC CHA 1 1 7 13113 5 2 1 HEC CHB C -0.676 1.819 -11.786 1.00 . E A . 111 HEC CHB 1 1 7 13114 5 2 1 HEC CHC C -2.887 -1.627 -9.149 1.00 . E A . 111 HEC CHC 1 1 7 13115 5 2 1 HEC CHD C -2.485 1.237 -5.156 1.00 . E A . 111 HEC CHD 1 1 7 13116 5 2 1 HEC CMA C 0.942 4.305 -12.691 1.00 . E A . 111 HEC CMA 1 1 7 13117 5 2 1 HEC CMB C -0.977 -0.599 -13.680 1.00 . E A . 111 HEC CMB 1 1 7 13118 5 2 1 HEC CMC C -4.642 -2.957 -6.885 1.00 . E A . 111 HEC CMC 1 1 7 13119 5 2 1 HEC CMD C -1.324 3.227 -3.103 1.00 . E A . 111 HEC CMD 1 1 7 13120 5 2 1 HEC FE FE -1.543 1.496 -8.464 1.00 . E A . 111 HEC FE 1 1 7 13121 5 2 1 HEC HAA1 H 0.850 6.827 -10.610 1.00 . E A . 111 HEC HAA1 1 1 7 13122 5 2 1 HEC HAA2 H 1.442 6.342 -9.003 1.00 . E A . 111 HEC HAA2 1 1 7 13123 5 2 1 HEC HAB H -3.347 -3.161 -11.448 1.00 . E A . 111 HEC HAB 1 1 7 13124 5 2 1 HEC HAC H -3.836 -0.442 -3.580 1.00 . E A . 111 HEC HAC 1 1 7 13125 5 2 1 HEC HAD1 H 0.872 5.097 -3.922 1.00 . E A . 111 HEC HAD1 1 1 7 13126 5 2 1 HEC HAD2 H 1.008 5.707 -5.589 1.00 . E A . 111 HEC HAD2 1 1 7 13127 5 2 1 HEC HBA1 H 3.513 6.236 -9.774 1.00 . E A . 111 HEC HBA1 1 1 7 13128 5 2 1 HEC HBA2 H 3.029 5.051 -11.011 1.00 . E A . 111 HEC HBA2 1 1 7 13129 5 2 1 HEC HBB1 H -1.680 -4.878 -12.096 1.00 . E A . 111 HEC HBB1 1 1 7 13130 5 2 1 HEC HBB2 H -0.418 -3.624 -12.050 1.00 . E A . 111 HEC HBB2 1 1 7 13131 5 2 1 HEC HBB3 H -1.298 -4.056 -10.564 1.00 . E A . 111 HEC HBB3 1 1 7 13132 5 2 1 HEC HBC1 H -4.424 -2.548 -2.696 1.00 . E A . 111 HEC HBC1 1 1 7 13133 5 2 1 HEC HBC2 H -4.822 -3.202 -4.303 1.00 . E A . 111 HEC HBC2 1 1 7 13134 5 2 1 HEC HBC3 H -3.129 -2.855 -3.878 1.00 . E A . 111 HEC HBC3 1 1 7 13135 5 2 1 HEC HBD1 H -1.166 6.852 -5.314 1.00 . E A . 111 HEC HBD1 1 1 7 13136 5 2 1 HEC HBD2 H -1.217 6.297 -3.623 1.00 . E A . 111 HEC HBD2 1 1 7 13137 5 2 1 HEC HHA H 0.475 5.459 -7.558 1.00 . E A . 111 HEC HHA 1 1 7 13138 5 2 1 HEC HHB H -0.506 1.979 -12.851 1.00 . E A . 111 HEC HHB 1 1 7 13139 5 2 1 HEC HHC H -3.279 -2.622 -9.362 1.00 . E A . 111 HEC HHC 1 1 7 13140 5 2 1 HEC HHD H -2.828 1.179 -4.123 1.00 . E A . 111 HEC HHD 1 1 7 13141 5 2 1 HEC HMA1 H 0.151 4.057 -13.398 1.00 . E A . 111 HEC HMA1 1 1 7 13142 5 2 1 HEC HMA2 H 1.187 5.364 -12.776 1.00 . E A . 111 HEC HMA2 1 1 7 13143 5 2 1 HEC HMA3 H 1.828 3.709 -12.912 1.00 . E A . 111 HEC HMA3 1 1 7 13144 5 2 1 HEC HMB1 H -0.410 -1.516 -13.836 1.00 . E A . 111 HEC HMB1 1 1 7 13145 5 2 1 HEC HMB2 H -1.848 -0.594 -14.335 1.00 . E A . 111 HEC HMB2 1 1 7 13146 5 2 1 HEC HMB3 H -0.346 0.261 -13.906 1.00 . E A . 111 HEC HMB3 1 1 7 13147 5 2 1 HEC HMC1 H -4.525 -3.351 -7.894 1.00 . E A . 111 HEC HMC1 1 1 7 13148 5 2 1 HEC HMC2 H -4.277 -3.689 -6.165 1.00 . E A . 111 HEC HMC2 1 1 7 13149 5 2 1 HEC HMC3 H -5.696 -2.755 -6.694 1.00 . E A . 111 HEC HMC3 1 1 7 13150 5 2 1 HEC HMD1 H -0.480 3.717 -2.618 1.00 . E A . 111 HEC HMD1 1 1 7 13151 5 2 1 HEC HMD2 H -2.247 3.741 -2.832 1.00 . E A . 111 HEC HMD2 1 1 7 13152 5 2 1 HEC HMD3 H -1.378 2.188 -2.778 1.00 . E A . 111 HEC HMD3 1 1 7 13153 5 2 1 HEC NA N -0.547 2.874 -9.549 1.00 . E A . 111 HEC NA 1 1 7 13154 5 2 1 HEC NB N -1.790 0.362 -10.136 1.00 . E A . 111 HEC NB 1 1 7 13155 5 2 1 HEC NC N -2.488 0.090 -7.352 1.00 . E A . 111 HEC NC 1 1 7 13156 5 2 1 HEC ND N -1.347 2.658 -6.820 1.00 . E A . 111 HEC ND 1 1 7 13157 5 2 1 HEC O1A O 2.574 8.229 -11.439 1.00 . E A . 111 HEC O1A 1 1 7 13158 5 2 1 HEC O1D O 0.189 8.136 -2.845 1.00 . E A . 111 HEC O1D 1 1 7 13159 5 2 1 HEC O2A O 3.607 6.720 -12.712 1.00 . E A . 111 HEC O2A 1 1 7 13160 5 2 1 HEC O2D O 1.011 8.276 -4.910 1.00 . E A . 111 HEC O2D 1 1 8 13161 1 1 1 ALA C C -0.257 3.392 19.989 1.00 . A A . 1 ALA C 1 1 8 13162 1 1 1 ALA CA C 1.155 2.808 19.927 1.00 . A A . 1 ALA CA 1 1 8 13163 1 1 1 ALA CB C 1.163 1.285 20.068 1.00 . A A . 1 ALA CB 1 1 8 13164 1 1 1 ALA H1 H 1.596 4.310 21.220 1.00 . A A . 1 ALA H1 1 1 8 13165 1 1 1 ALA H2 H 1.944 2.798 21.797 1.00 . A A . 1 ALA H2 1 1 8 13166 1 1 1 ALA HA H 1.607 3.075 18.972 1.00 . A A . 1 ALA HA 1 1 8 13167 1 1 1 ALA HB1 H 1.368 1.017 21.104 1.00 . A A . 1 ALA HB1 1 1 8 13168 1 1 1 ALA HB2 H 0.191 0.888 19.776 1.00 . A A . 1 ALA HB2 1 1 8 13169 1 1 1 ALA HB3 H 1.935 0.864 19.424 1.00 . A A . 1 ALA HB3 1 1 8 13170 1 1 1 ALA N N 1.965 3.397 20.979 1.00 . A A . 1 ALA N 1 1 8 13171 1 1 1 ALA O O -1.103 2.903 20.736 1.00 . A A . 1 ALA O 1 1 8 13172 1 1 2 PRO C C -2.786 4.272 18.356 1.00 . A A . 2 PRO C 1 1 8 13173 1 1 2 PRO CA C -1.771 5.115 19.130 1.00 . A A . 2 PRO CA 1 1 8 13174 1 1 2 PRO CB C -1.506 6.466 18.485 1.00 . A A . 2 PRO CB 1 1 8 13175 1 1 2 PRO CD C 0.503 5.066 18.276 1.00 . A A . 2 PRO CD 1 1 8 13176 1 1 2 PRO CG C -0.170 6.333 17.772 1.00 . A A . 2 PRO CG 1 1 8 13177 1 1 2 PRO HA H -2.143 5.212 20.053 1.00 . A A . 2 PRO HA 1 1 8 13178 1 1 2 PRO HB2 H -2.299 6.726 17.783 1.00 . A A . 2 PRO HB2 1 1 8 13179 1 1 2 PRO HB3 H -1.472 7.257 19.234 1.00 . A A . 2 PRO HB3 1 1 8 13180 1 1 2 PRO HD2 H 0.753 4.397 17.453 1.00 . A A . 2 PRO HD2 1 1 8 13181 1 1 2 PRO HD3 H 1.433 5.292 18.797 1.00 . A A . 2 PRO HD3 1 1 8 13182 1 1 2 PRO HG2 H -0.316 6.285 16.693 1.00 . A A . 2 PRO HG2 1 1 8 13183 1 1 2 PRO HG3 H 0.457 7.202 17.971 1.00 . A A . 2 PRO HG3 1 1 8 13184 1 1 2 PRO N N -0.475 4.459 19.174 1.00 . A A . 2 PRO N 1 1 8 13185 1 1 2 PRO O O -2.524 3.112 18.041 1.00 . A A . 2 PRO O 1 1 8 13186 1 1 3 LYS C C -4.886 4.575 15.857 1.00 . A A . 3 LYS C 1 1 8 13187 1 1 3 LYS CA C -4.980 4.209 17.340 1.00 . A A . 3 LYS CA 1 1 8 13188 1 1 3 LYS CB C -6.344 4.514 17.963 1.00 . A A . 3 LYS CB 1 1 8 13189 1 1 3 LYS CD C -8.510 3.428 18.663 1.00 . A A . 3 LYS CD 1 1 8 13190 1 1 3 LYS CE C -8.887 3.546 20.141 1.00 . A A . 3 LYS CE 1 1 8 13191 1 1 3 LYS CG C -7.001 3.238 18.496 1.00 . A A . 3 LYS CG 1 1 8 13192 1 1 3 LYS H H -4.129 5.832 18.330 1.00 . A A . 3 LYS H 1 1 8 13193 1 1 3 LYS HA H -4.812 3.137 17.443 1.00 . A A . 3 LYS HA 1 1 8 13194 1 1 3 LYS HB2 H -6.226 5.232 18.774 1.00 . A A . 3 LYS HB2 1 1 8 13195 1 1 3 LYS HB3 H -6.992 4.977 17.219 1.00 . A A . 3 LYS HB3 1 1 8 13196 1 1 3 LYS HD2 H -8.829 4.323 18.130 1.00 . A A . 3 LYS HD2 1 1 8 13197 1 1 3 LYS HD3 H -9.038 2.585 18.216 1.00 . A A . 3 LYS HD3 1 1 8 13198 1 1 3 LYS HE2 H -8.884 2.559 20.604 1.00 . A A . 3 LYS HE2 1 1 8 13199 1 1 3 LYS HE3 H -8.143 4.146 20.666 1.00 . A A . 3 LYS HE3 1 1 8 13200 1 1 3 LYS HG2 H -6.808 2.412 17.811 1.00 . A A . 3 LYS HG2 1 1 8 13201 1 1 3 LYS HG3 H -6.556 2.969 19.454 1.00 . A A . 3 LYS HG3 1 1 8 13202 1 1 3 LYS HZ1 H -10.442 4.373 21.256 1.00 . A A . 3 LYS HZ1 1 1 8 13203 1 1 3 LYS HZ2 H -10.296 5.037 19.776 1.00 . A A . 3 LYS HZ2 1 1 8 13204 1 1 3 LYS N N -3.924 4.888 18.071 1.00 . A A . 3 LYS N 1 1 8 13205 1 1 3 LYS NZ N -10.224 4.165 20.288 1.00 . A A . 3 LYS NZ 1 1 8 13206 1 1 3 LYS O O -4.175 5.509 15.489 1.00 . A A . 3 LYS O 1 1 8 13207 1 1 4 ALA C C -6.239 5.421 13.325 1.00 . A A . 4 ALA C 1 1 8 13208 1 1 4 ALA CA C -5.618 4.052 13.613 1.00 . A A . 4 ALA CA 1 1 8 13209 1 1 4 ALA CB C -6.366 2.914 12.914 1.00 . A A . 4 ALA CB 1 1 8 13210 1 1 4 ALA H H -6.187 3.061 15.354 1.00 . A A . 4 ALA H 1 1 8 13211 1 1 4 ALA HA H -4.583 4.053 13.272 1.00 . A A . 4 ALA HA 1 1 8 13212 1 1 4 ALA HB1 H -5.964 1.957 13.246 1.00 . A A . 4 ALA HB1 1 1 8 13213 1 1 4 ALA HB2 H -7.426 2.970 13.163 1.00 . A A . 4 ALA HB2 1 1 8 13214 1 1 4 ALA HB3 H -6.241 3.006 11.835 1.00 . A A . 4 ALA HB3 1 1 8 13215 1 1 4 ALA N N -5.612 3.819 15.047 1.00 . A A . 4 ALA N 1 1 8 13216 1 1 4 ALA O O -7.104 5.882 14.068 1.00 . A A . 4 ALA O 1 1 8 13217 1 1 5 PRO C C -7.652 7.245 11.201 1.00 . A A . 5 PRO C 1 1 8 13218 1 1 5 PRO CA C -6.259 7.354 11.823 1.00 . A A . 5 PRO CA 1 1 8 13219 1 1 5 PRO CB C -5.218 7.896 10.856 1.00 . A A . 5 PRO CB 1 1 8 13220 1 1 5 PRO CD C -4.736 5.531 11.314 1.00 . A A . 5 PRO CD 1 1 8 13221 1 1 5 PRO CG C -4.417 6.693 10.387 1.00 . A A . 5 PRO CG 1 1 8 13222 1 1 5 PRO HA H -6.362 7.943 12.624 1.00 . A A . 5 PRO HA 1 1 8 13223 1 1 5 PRO HB2 H -5.692 8.402 10.015 1.00 . A A . 5 PRO HB2 1 1 8 13224 1 1 5 PRO HB3 H -4.574 8.627 11.345 1.00 . A A . 5 PRO HB3 1 1 8 13225 1 1 5 PRO HD2 H -5.099 4.668 10.756 1.00 . A A . 5 PRO HD2 1 1 8 13226 1 1 5 PRO HD3 H -3.851 5.207 11.863 1.00 . A A . 5 PRO HD3 1 1 8 13227 1 1 5 PRO HG2 H -4.673 6.441 9.358 1.00 . A A . 5 PRO HG2 1 1 8 13228 1 1 5 PRO HG3 H -3.350 6.914 10.406 1.00 . A A . 5 PRO HG3 1 1 8 13229 1 1 5 PRO N N -5.760 6.047 12.217 1.00 . A A . 5 PRO N 1 1 8 13230 1 1 5 PRO O O -8.090 6.154 10.838 1.00 . A A . 5 PRO O 1 1 8 13231 1 1 6 ALA C C -9.625 7.792 9.137 1.00 . A A . 6 ALA C 1 1 8 13232 1 1 6 ALA CA C -9.646 8.436 10.525 1.00 . A A . 6 ALA CA 1 1 8 13233 1 1 6 ALA CB C -10.135 9.885 10.488 1.00 . A A . 6 ALA CB 1 1 8 13234 1 1 6 ALA H H -7.947 9.273 11.393 1.00 . A A . 6 ALA H 1 1 8 13235 1 1 6 ALA HA H -10.304 7.860 11.174 1.00 . A A . 6 ALA HA 1 1 8 13236 1 1 6 ALA HB1 H -10.139 10.294 11.498 1.00 . A A . 6 ALA HB1 1 1 8 13237 1 1 6 ALA HB2 H -9.470 10.477 9.859 1.00 . A A . 6 ALA HB2 1 1 8 13238 1 1 6 ALA HB3 H -11.145 9.917 10.079 1.00 . A A . 6 ALA HB3 1 1 8 13239 1 1 6 ALA N N -8.310 8.390 11.096 1.00 . A A . 6 ALA N 1 1 8 13240 1 1 6 ALA O O -8.561 7.621 8.545 1.00 . A A . 6 ALA O 1 1 8 13241 1 1 7 ASP C C -10.918 7.913 6.273 1.00 . A A . 7 ASP C 1 1 8 13242 1 1 7 ASP CA C -10.944 6.830 7.353 1.00 . A A . 7 ASP CA 1 1 8 13243 1 1 7 ASP CB C -12.269 6.075 7.233 1.00 . A A . 7 ASP CB 1 1 8 13244 1 1 7 ASP CG C -13.521 6.955 7.273 1.00 . A A . 7 ASP CG 1 1 8 13245 1 1 7 ASP H H -11.674 7.595 9.148 1.00 . A A . 7 ASP H 1 1 8 13246 1 1 7 ASP HA H -10.101 6.144 7.277 1.00 . A A . 7 ASP HA 1 1 8 13247 1 1 7 ASP HB2 H -12.267 5.514 6.299 1.00 . A A . 7 ASP HB2 1 1 8 13248 1 1 7 ASP HB3 H -12.330 5.347 8.042 1.00 . A A . 7 ASP HB3 1 1 8 13249 1 1 7 ASP N N -10.813 7.452 8.660 1.00 . A A . 7 ASP N 1 1 8 13250 1 1 7 ASP O O -11.090 9.095 6.568 1.00 . A A . 7 ASP O 1 1 8 13251 1 1 7 ASP OD1 O -13.344 8.190 7.341 1.00 . A A . 7 ASP OD1 1 1 8 13252 1 1 7 ASP OD2 O -14.626 6.371 7.234 1.00 . A A . 7 ASP OD2 1 1 8 13253 1 1 8 GLY C C -9.236 8.943 3.726 1.00 . A A . 8 GLY C 1 1 8 13254 1 1 8 GLY CA C -10.649 8.388 3.916 1.00 . A A . 8 GLY CA 1 1 8 13255 1 1 8 GLY H H -10.561 6.509 4.810 1.00 . A A . 8 GLY H 1 1 8 13256 1 1 8 GLY HA2 H -10.967 7.874 3.009 1.00 . A A . 8 GLY HA2 1 1 8 13257 1 1 8 GLY HA3 H -11.347 9.209 4.079 1.00 . A A . 8 GLY HA3 1 1 8 13258 1 1 8 GLY N N -10.701 7.472 5.042 1.00 . A A . 8 GLY N 1 1 8 13259 1 1 8 GLY O O -9.061 10.029 3.174 1.00 . A A . 8 GLY O 1 1 8 13260 1 1 9 LEU C C -6.405 8.384 2.636 1.00 . A A . 9 LEU C 1 1 8 13261 1 1 9 LEU CA C -6.872 8.575 4.081 1.00 . A A . 9 LEU CA 1 1 8 13262 1 1 9 LEU CB C -6.016 7.831 5.107 1.00 . A A . 9 LEU CB 1 1 8 13263 1 1 9 LEU CD1 C -4.046 6.689 4.022 1.00 . A A . 9 LEU CD1 1 1 8 13264 1 1 9 LEU CD2 C -4.079 9.214 4.273 1.00 . A A . 9 LEU CD2 1 1 8 13265 1 1 9 LEU CG C -4.504 7.873 4.876 1.00 . A A . 9 LEU CG 1 1 8 13266 1 1 9 LEU H H -8.415 7.292 4.640 1.00 . A A . 9 LEU H 1 1 8 13267 1 1 9 LEU HA H -6.818 9.636 4.324 1.00 . A A . 9 LEU HA 1 1 8 13268 1 1 9 LEU HB2 H -6.225 8.244 6.094 1.00 . A A . 9 LEU HB2 1 1 8 13269 1 1 9 LEU HB3 H -6.331 6.787 5.126 1.00 . A A . 9 LEU HB3 1 1 8 13270 1 1 9 LEU HD11 H -4.904 6.061 3.782 1.00 . A A . 9 LEU HD11 1 1 8 13271 1 1 9 LEU HD12 H -3.597 7.059 3.099 1.00 . A A . 9 LEU HD12 1 1 8 13272 1 1 9 LEU HD13 H -3.311 6.105 4.574 1.00 . A A . 9 LEU HD13 1 1 8 13273 1 1 9 LEU HD21 H -4.851 9.959 4.465 1.00 . A A . 9 LEU HD21 1 1 8 13274 1 1 9 LEU HD22 H -3.142 9.535 4.728 1.00 . A A . 9 LEU HD22 1 1 8 13275 1 1 9 LEU HD23 H -3.941 9.101 3.198 1.00 . A A . 9 LEU HD23 1 1 8 13276 1 1 9 LEU HG H -4.008 7.783 5.843 1.00 . A A . 9 LEU HG 1 1 8 13277 1 1 9 LEU N N -8.264 8.174 4.193 1.00 . A A . 9 LEU N 1 1 8 13278 1 1 9 LEU O O -5.947 7.305 2.266 1.00 . A A . 9 LEU O 1 1 8 13279 1 1 10 LYS C C -4.689 9.893 0.342 1.00 . A A . 10 LYS C 1 1 8 13280 1 1 10 LYS CA C -6.136 9.413 0.464 1.00 . A A . 10 LYS CA 1 1 8 13281 1 1 10 LYS CB C -7.122 10.204 -0.399 1.00 . A A . 10 LYS CB 1 1 8 13282 1 1 10 LYS CD C -7.489 11.299 -2.640 1.00 . A A . 10 LYS CD 1 1 8 13283 1 1 10 LYS CE C -6.646 12.317 -3.411 1.00 . A A . 10 LYS CE 1 1 8 13284 1 1 10 LYS CG C -6.601 10.354 -1.829 1.00 . A A . 10 LYS CG 1 1 8 13285 1 1 10 LYS H H -6.912 10.324 2.169 1.00 . A A . 10 LYS H 1 1 8 13286 1 1 10 LYS HA H -6.185 8.374 0.137 1.00 . A A . 10 LYS HA 1 1 8 13287 1 1 10 LYS HB2 H -8.088 9.699 -0.410 1.00 . A A . 10 LYS HB2 1 1 8 13288 1 1 10 LYS HB3 H -7.283 11.189 0.038 1.00 . A A . 10 LYS HB3 1 1 8 13289 1 1 10 LYS HD2 H -8.098 10.724 -3.338 1.00 . A A . 10 LYS HD2 1 1 8 13290 1 1 10 LYS HD3 H -8.175 11.821 -1.973 1.00 . A A . 10 LYS HD3 1 1 8 13291 1 1 10 LYS HE2 H -5.820 11.811 -3.910 1.00 . A A . 10 LYS HE2 1 1 8 13292 1 1 10 LYS HE3 H -7.250 12.784 -4.189 1.00 . A A . 10 LYS HE3 1 1 8 13293 1 1 10 LYS HG2 H -5.580 10.735 -1.810 1.00 . A A . 10 LYS HG2 1 1 8 13294 1 1 10 LYS HG3 H -6.567 9.377 -2.312 1.00 . A A . 10 LYS HG3 1 1 8 13295 1 1 10 LYS HZ1 H -6.261 13.108 -1.522 1.00 . A A . 10 LYS HZ1 1 1 8 13296 1 1 10 LYS HZ2 H -5.123 13.499 -2.619 1.00 . A A . 10 LYS HZ2 1 1 8 13297 1 1 10 LYS N N -6.538 9.449 1.860 1.00 . A A . 10 LYS N 1 1 8 13298 1 1 10 LYS NZ N -6.119 13.354 -2.496 1.00 . A A . 10 LYS NZ 1 1 8 13299 1 1 10 LYS O O -4.254 10.764 1.093 1.00 . A A . 10 LYS O 1 1 8 13300 1 1 11 MET C C -2.327 9.902 -2.329 1.00 . A A . 11 MET C 1 1 8 13301 1 1 11 MET CA C -2.592 9.660 -0.841 1.00 . A A . 11 MET CA 1 1 8 13302 1 1 11 MET CB C -1.686 8.534 -0.338 1.00 . A A . 11 MET CB 1 1 8 13303 1 1 11 MET CE C -0.690 5.030 -0.047 1.00 . A A . 11 MET CE 1 1 8 13304 1 1 11 MET CG C -2.034 7.207 -1.014 1.00 . A A . 11 MET CG 1 1 8 13305 1 1 11 MET H H -4.343 8.596 -1.219 1.00 . A A . 11 MET H 1 1 8 13306 1 1 11 MET HA H -2.430 10.581 -0.282 1.00 . A A . 11 MET HA 1 1 8 13307 1 1 11 MET HB2 H -0.644 8.785 -0.536 1.00 . A A . 11 MET HB2 1 1 8 13308 1 1 11 MET HB3 H -1.790 8.435 0.742 1.00 . A A . 11 MET HB3 1 1 8 13309 1 1 11 MET HE1 H 0.066 5.708 -0.443 1.00 . A A . 11 MET HE1 1 1 8 13310 1 1 11 MET HE2 H -0.346 4.615 0.900 1.00 . A A . 11 MET HE2 1 1 8 13311 1 1 11 MET HE3 H -0.861 4.222 -0.757 1.00 . A A . 11 MET HE3 1 1 8 13312 1 1 11 MET HG2 H -2.959 7.309 -1.582 1.00 . A A . 11 MET HG2 1 1 8 13313 1 1 11 MET HG3 H -1.253 6.935 -1.724 1.00 . A A . 11 MET HG3 1 1 8 13314 1 1 11 MET N N -3.982 9.303 -0.612 1.00 . A A . 11 MET N 1 1 8 13315 1 1 11 MET O O -2.230 8.955 -3.108 1.00 . A A . 11 MET O 1 1 8 13316 1 1 11 MET SD S -2.213 5.924 0.214 1.00 . A A . 11 MET SD 1 1 8 13317 1 1 12 GLU C C -0.506 11.973 -4.236 1.00 . A A . 12 GLU C 1 1 8 13318 1 1 12 GLU CA C -1.967 11.554 -4.058 1.00 . A A . 12 GLU CA 1 1 8 13319 1 1 12 GLU CB C -2.915 12.671 -4.502 1.00 . A A . 12 GLU CB 1 1 8 13320 1 1 12 GLU CD C -1.816 13.834 -6.451 1.00 . A A . 12 GLU CD 1 1 8 13321 1 1 12 GLU CG C -2.893 12.836 -6.022 1.00 . A A . 12 GLU CG 1 1 8 13322 1 1 12 GLU H H -2.299 11.940 -2.038 1.00 . A A . 12 GLU H 1 1 8 13323 1 1 12 GLU HA H -2.170 10.659 -4.646 1.00 . A A . 12 GLU HA 1 1 8 13324 1 1 12 GLU HB2 H -3.928 12.445 -4.171 1.00 . A A . 12 GLU HB2 1 1 8 13325 1 1 12 GLU HB3 H -2.626 13.608 -4.026 1.00 . A A . 12 GLU HB3 1 1 8 13326 1 1 12 GLU HG2 H -2.708 11.871 -6.494 1.00 . A A . 12 GLU HG2 1 1 8 13327 1 1 12 GLU HG3 H -3.869 13.178 -6.368 1.00 . A A . 12 GLU HG3 1 1 8 13328 1 1 12 GLU N N -2.218 11.176 -2.678 1.00 . A A . 12 GLU N 1 1 8 13329 1 1 12 GLU O O -0.220 13.131 -4.536 1.00 . A A . 12 GLU O 1 1 8 13330 1 1 12 GLU OE1 O -2.082 15.048 -6.320 1.00 . A A . 12 GLU OE1 1 1 8 13331 1 1 12 GLU OE2 O -0.749 13.360 -6.898 1.00 . A A . 12 GLU OE2 1 1 8 13332 1 1 13 ALA C C 2.208 11.109 -5.647 1.00 . A A . 13 ALA C 1 1 8 13333 1 1 13 ALA CA C 1.805 11.260 -4.179 1.00 . A A . 13 ALA CA 1 1 8 13334 1 1 13 ALA CB C 2.581 10.315 -3.260 1.00 . A A . 13 ALA CB 1 1 8 13335 1 1 13 ALA H H 0.140 10.067 -3.800 1.00 . A A . 13 ALA H 1 1 8 13336 1 1 13 ALA HA H 1.990 12.287 -3.864 1.00 . A A . 13 ALA HA 1 1 8 13337 1 1 13 ALA HB1 H 1.884 9.782 -2.614 1.00 . A A . 13 ALA HB1 1 1 8 13338 1 1 13 ALA HB2 H 3.138 9.598 -3.863 1.00 . A A . 13 ALA HB2 1 1 8 13339 1 1 13 ALA HB3 H 3.275 10.891 -2.649 1.00 . A A . 13 ALA HB3 1 1 8 13340 1 1 13 ALA N N 0.380 11.007 -4.044 1.00 . A A . 13 ALA N 1 1 8 13341 1 1 13 ALA O O 3.287 11.545 -6.046 1.00 . A A . 13 ALA O 1 1 8 13342 1 1 14 THR C C 0.393 10.784 -8.659 1.00 . A A . 14 THR C 1 1 8 13343 1 1 14 THR CA C 1.571 10.274 -7.826 1.00 . A A . 14 THR CA 1 1 8 13344 1 1 14 THR CB C 1.864 8.787 -8.033 1.00 . A A . 14 THR CB 1 1 8 13345 1 1 14 THR CG2 C 2.522 8.144 -6.811 1.00 . A A . 14 THR CG2 1 1 8 13346 1 1 14 THR H H 0.445 10.138 -6.078 1.00 . A A . 14 THR H 1 1 8 13347 1 1 14 THR HA H 2.443 10.861 -8.113 1.00 . A A . 14 THR HA 1 1 8 13348 1 1 14 THR HB H 2.466 8.630 -8.928 1.00 . A A . 14 THR HB 1 1 8 13349 1 1 14 THR HG1 H -0.011 8.559 -7.372 1.00 . A A . 14 THR HG1 1 1 8 13350 1 1 14 THR HG21 H 2.966 8.919 -6.187 1.00 . A A . 14 THR HG21 1 1 8 13351 1 1 14 THR HG22 H 1.771 7.601 -6.237 1.00 . A A . 14 THR HG22 1 1 8 13352 1 1 14 THR HG23 H 3.298 7.452 -7.139 1.00 . A A . 14 THR HG23 1 1 8 13353 1 1 14 THR N N 1.321 10.489 -6.411 1.00 . A A . 14 THR N 1 1 8 13354 1 1 14 THR O O -0.586 11.288 -8.112 1.00 . A A . 14 THR O 1 1 8 13355 1 1 14 THR OG1 O 0.574 8.184 -8.091 1.00 . A A . 14 THR OG1 1 1 8 13356 1 1 15 LYS C C -1.778 10.247 -10.644 1.00 . A A . 15 LYS C 1 1 8 13357 1 1 15 LYS CA C -0.513 11.073 -10.883 1.00 . A A . 15 LYS CA 1 1 8 13358 1 1 15 LYS CB C -0.011 11.026 -12.328 1.00 . A A . 15 LYS CB 1 1 8 13359 1 1 15 LYS CD C -0.251 12.626 -14.262 1.00 . A A . 15 LYS CD 1 1 8 13360 1 1 15 LYS CE C -0.910 12.582 -15.642 1.00 . A A . 15 LYS CE 1 1 8 13361 1 1 15 LYS CG C -0.991 11.726 -13.271 1.00 . A A . 15 LYS CG 1 1 8 13362 1 1 15 LYS H H 1.328 10.222 -10.405 1.00 . A A . 15 LYS H 1 1 8 13363 1 1 15 LYS HA H -0.732 12.115 -10.652 1.00 . A A . 15 LYS HA 1 1 8 13364 1 1 15 LYS HB2 H 0.966 11.504 -12.393 1.00 . A A . 15 LYS HB2 1 1 8 13365 1 1 15 LYS HB3 H 0.120 9.989 -12.637 1.00 . A A . 15 LYS HB3 1 1 8 13366 1 1 15 LYS HD2 H -0.243 13.651 -13.891 1.00 . A A . 15 LYS HD2 1 1 8 13367 1 1 15 LYS HD3 H 0.789 12.308 -14.341 1.00 . A A . 15 LYS HD3 1 1 8 13368 1 1 15 LYS HE2 H -0.208 12.933 -16.398 1.00 . A A . 15 LYS HE2 1 1 8 13369 1 1 15 LYS HE3 H -1.164 11.553 -15.897 1.00 . A A . 15 LYS HE3 1 1 8 13370 1 1 15 LYS HG2 H -1.572 10.981 -13.815 1.00 . A A . 15 LYS HG2 1 1 8 13371 1 1 15 LYS HG3 H -1.698 12.320 -12.692 1.00 . A A . 15 LYS HG3 1 1 8 13372 1 1 15 LYS HZ1 H -2.235 13.917 -16.539 1.00 . A A . 15 LYS HZ1 1 1 8 13373 1 1 15 LYS HZ2 H -2.971 12.869 -15.532 1.00 . A A . 15 LYS HZ2 1 1 8 13374 1 1 15 LYS N N 0.528 10.634 -9.969 1.00 . A A . 15 LYS N 1 1 8 13375 1 1 15 LYS NZ N -2.129 13.420 -15.661 1.00 . A A . 15 LYS NZ 1 1 8 13376 1 1 15 LYS O O -2.846 10.579 -11.154 1.00 . A A . 15 LYS O 1 1 8 13377 1 1 16 GLN C C -2.922 8.213 -8.040 1.00 . A A . 16 GLN C 1 1 8 13378 1 1 16 GLN CA C -2.730 8.308 -9.555 1.00 . A A . 16 GLN CA 1 1 8 13379 1 1 16 GLN CB C -2.527 6.922 -10.170 1.00 . A A . 16 GLN CB 1 1 8 13380 1 1 16 GLN CD C -3.284 6.703 -12.566 1.00 . A A . 16 GLN CD 1 1 8 13381 1 1 16 GLN CG C -2.112 7.030 -11.639 1.00 . A A . 16 GLN CG 1 1 8 13382 1 1 16 GLN H H -0.742 8.922 -9.456 1.00 . A A . 16 GLN H 1 1 8 13383 1 1 16 GLN HA H -3.603 8.776 -10.010 1.00 . A A . 16 GLN HA 1 1 8 13384 1 1 16 GLN HB2 H -1.764 6.380 -9.611 1.00 . A A . 16 GLN HB2 1 1 8 13385 1 1 16 GLN HB3 H -3.449 6.346 -10.091 1.00 . A A . 16 GLN HB3 1 1 8 13386 1 1 16 GLN HE21 H -3.339 4.845 -11.764 1.00 . A A . 16 GLN HE21 1 1 8 13387 1 1 16 GLN HE22 H -4.520 5.157 -12.992 1.00 . A A . 16 GLN HE22 1 1 8 13388 1 1 16 GLN HG2 H -1.750 8.037 -11.845 1.00 . A A . 16 GLN HG2 1 1 8 13389 1 1 16 GLN HG3 H -1.285 6.347 -11.837 1.00 . A A . 16 GLN HG3 1 1 8 13390 1 1 16 GLN N N -1.615 9.185 -9.868 1.00 . A A . 16 GLN N 1 1 8 13391 1 1 16 GLN NE2 N -3.753 5.466 -12.429 1.00 . A A . 16 GLN NE2 1 1 8 13392 1 1 16 GLN O O -2.188 7.497 -7.361 1.00 . A A . 16 GLN O 1 1 8 13393 1 1 16 GLN OE1 O -3.733 7.520 -13.353 1.00 . A A . 16 GLN OE1 1 1 8 13394 1 1 17 PRO C C -4.941 7.679 -5.700 1.00 . A A . 17 PRO C 1 1 8 13395 1 1 17 PRO CA C -4.239 8.972 -6.119 1.00 . A A . 17 PRO CA 1 1 8 13396 1 1 17 PRO CB C -5.094 10.210 -5.903 1.00 . A A . 17 PRO CB 1 1 8 13397 1 1 17 PRO CD C -4.832 9.824 -8.316 1.00 . A A . 17 PRO CD 1 1 8 13398 1 1 17 PRO CG C -5.628 10.592 -7.273 1.00 . A A . 17 PRO CG 1 1 8 13399 1 1 17 PRO HA H -3.392 9.008 -5.588 1.00 . A A . 17 PRO HA 1 1 8 13400 1 1 17 PRO HB2 H -5.909 10.005 -5.209 1.00 . A A . 17 PRO HB2 1 1 8 13401 1 1 17 PRO HB3 H -4.505 11.020 -5.473 1.00 . A A . 17 PRO HB3 1 1 8 13402 1 1 17 PRO HD2 H -5.485 9.238 -8.961 1.00 . A A . 17 PRO HD2 1 1 8 13403 1 1 17 PRO HD3 H -4.269 10.499 -8.960 1.00 . A A . 17 PRO HD3 1 1 8 13404 1 1 17 PRO HG2 H -6.689 10.351 -7.350 1.00 . A A . 17 PRO HG2 1 1 8 13405 1 1 17 PRO HG3 H -5.533 11.665 -7.435 1.00 . A A . 17 PRO HG3 1 1 8 13406 1 1 17 PRO N N -3.941 8.965 -7.542 1.00 . A A . 17 PRO N 1 1 8 13407 1 1 17 PRO O O -5.477 6.959 -6.541 1.00 . A A . 17 PRO O 1 1 8 13408 1 1 18 VAL C C -6.146 6.553 -2.490 1.00 . A A . 18 VAL C 1 1 8 13409 1 1 18 VAL CA C -5.543 6.231 -3.859 1.00 . A A . 18 VAL CA 1 1 8 13410 1 1 18 VAL CB C -4.532 5.083 -3.812 1.00 . A A . 18 VAL CB 1 1 8 13411 1 1 18 VAL CG1 C -5.097 3.886 -3.045 1.00 . A A . 18 VAL CG1 1 1 8 13412 1 1 18 VAL CG2 C -4.099 4.676 -5.222 1.00 . A A . 18 VAL CG2 1 1 8 13413 1 1 18 VAL H H -4.478 8.015 -3.723 1.00 . A A . 18 VAL H 1 1 8 13414 1 1 18 VAL HA H -6.347 5.945 -4.537 1.00 . A A . 18 VAL HA 1 1 8 13415 1 1 18 VAL HB H -3.649 5.436 -3.279 1.00 . A A . 18 VAL HB 1 1 8 13416 1 1 18 VAL HG11 H -6.169 3.811 -3.226 1.00 . A A . 18 VAL HG11 1 1 8 13417 1 1 18 VAL HG12 H -4.607 2.973 -3.384 1.00 . A A . 18 VAL HG12 1 1 8 13418 1 1 18 VAL HG13 H -4.917 4.020 -1.979 1.00 . A A . 18 VAL HG13 1 1 8 13419 1 1 18 VAL HG21 H -4.890 4.923 -5.930 1.00 . A A . 18 VAL HG21 1 1 8 13420 1 1 18 VAL HG22 H -3.190 5.213 -5.492 1.00 . A A . 18 VAL HG22 1 1 8 13421 1 1 18 VAL HG23 H -3.909 3.603 -5.248 1.00 . A A . 18 VAL HG23 1 1 8 13422 1 1 18 VAL N N -4.916 7.424 -4.400 1.00 . A A . 18 VAL N 1 1 8 13423 1 1 18 VAL O O -5.669 7.446 -1.792 1.00 . A A . 18 VAL O 1 1 8 13424 1 1 19 VAL C C -7.855 4.686 -0.093 1.00 . A A . 19 VAL C 1 1 8 13425 1 1 19 VAL CA C -7.859 6.002 -0.873 1.00 . A A . 19 VAL CA 1 1 8 13426 1 1 19 VAL CB C -9.266 6.556 -1.105 1.00 . A A . 19 VAL CB 1 1 8 13427 1 1 19 VAL CG1 C -10.091 6.511 0.183 1.00 . A A . 19 VAL CG1 1 1 8 13428 1 1 19 VAL CG2 C -9.210 7.976 -1.671 1.00 . A A . 19 VAL CG2 1 1 8 13429 1 1 19 VAL H H -7.567 5.081 -2.719 1.00 . A A . 19 VAL H 1 1 8 13430 1 1 19 VAL HA H -7.292 6.744 -0.312 1.00 . A A . 19 VAL HA 1 1 8 13431 1 1 19 VAL HB H -9.759 5.921 -1.841 1.00 . A A . 19 VAL HB 1 1 8 13432 1 1 19 VAL HG11 H -10.046 5.508 0.608 1.00 . A A . 19 VAL HG11 1 1 8 13433 1 1 19 VAL HG12 H -9.688 7.228 0.898 1.00 . A A . 19 VAL HG12 1 1 8 13434 1 1 19 VAL HG13 H -11.127 6.765 -0.041 1.00 . A A . 19 VAL HG13 1 1 8 13435 1 1 19 VAL HG21 H -8.170 8.272 -1.806 1.00 . A A . 19 VAL HG21 1 1 8 13436 1 1 19 VAL HG22 H -9.722 8.004 -2.633 1.00 . A A . 19 VAL HG22 1 1 8 13437 1 1 19 VAL HG23 H -9.697 8.662 -0.979 1.00 . A A . 19 VAL HG23 1 1 8 13438 1 1 19 VAL N N -7.186 5.806 -2.146 1.00 . A A . 19 VAL N 1 1 8 13439 1 1 19 VAL O O -8.488 3.714 -0.503 1.00 . A A . 19 VAL O 1 1 8 13440 1 1 20 PHE C C -7.983 3.621 3.062 1.00 . A A . 20 PHE C 1 1 8 13441 1 1 20 PHE CA C -7.040 3.516 1.861 1.00 . A A . 20 PHE CA 1 1 8 13442 1 1 20 PHE CB C -5.596 3.472 2.365 1.00 . A A . 20 PHE CB 1 1 8 13443 1 1 20 PHE CD1 C -5.218 0.983 2.510 1.00 . A A . 20 PHE CD1 1 1 8 13444 1 1 20 PHE CD2 C -4.968 2.285 4.499 1.00 . A A . 20 PHE CD2 1 1 8 13445 1 1 20 PHE CE1 C -4.892 -0.208 3.250 1.00 . A A . 20 PHE CE1 1 1 8 13446 1 1 20 PHE CE2 C -4.642 1.094 5.239 1.00 . A A . 20 PHE CE2 1 1 8 13447 1 1 20 PHE CG C -5.249 2.205 3.150 1.00 . A A . 20 PHE CG 1 1 8 13448 1 1 20 PHE CZ C -4.620 -0.095 4.577 1.00 . A A . 20 PHE CZ 1 1 8 13449 1 1 20 PHE H H -6.623 5.491 1.347 1.00 . A A . 20 PHE H 1 1 8 13450 1 1 20 PHE HA H -7.323 2.651 1.261 1.00 . A A . 20 PHE HA 1 1 8 13451 1 1 20 PHE HB2 H -4.922 3.554 1.512 1.00 . A A . 20 PHE HB2 1 1 8 13452 1 1 20 PHE HB3 H -5.416 4.340 2.998 1.00 . A A . 20 PHE HB3 1 1 8 13453 1 1 20 PHE HD1 H -5.440 0.920 1.445 1.00 . A A . 20 PHE HD1 1 1 8 13454 1 1 20 PHE HD2 H -4.993 3.251 5.005 1.00 . A A . 20 PHE HD2 1 1 8 13455 1 1 20 PHE HE1 H -4.863 -1.180 2.757 1.00 . A A . 20 PHE HE1 1 1 8 13456 1 1 20 PHE HE2 H -4.418 1.143 6.304 1.00 . A A . 20 PHE HE2 1 1 8 13457 1 1 20 PHE HZ H -4.357 -1.072 5.057 1.00 . A A . 20 PHE HZ 1 1 8 13458 1 1 20 PHE N N -7.135 4.697 1.020 1.00 . A A . 20 PHE N 1 1 8 13459 1 1 20 PHE O O -8.608 4.659 3.275 1.00 . A A . 20 PHE O 1 1 8 13460 1 1 21 ASN C C -8.267 1.600 6.051 1.00 . A A . 21 ASN C 1 1 8 13461 1 1 21 ASN CA C -8.912 2.490 4.987 1.00 . A A . 21 ASN CA 1 1 8 13462 1 1 21 ASN CB C -10.283 1.901 4.647 1.00 . A A . 21 ASN CB 1 1 8 13463 1 1 21 ASN CG C -11.035 2.797 3.660 1.00 . A A . 21 ASN CG 1 1 8 13464 1 1 21 ASN H H -7.543 1.693 3.633 1.00 . A A . 21 ASN H 1 1 8 13465 1 1 21 ASN HA H -9.007 3.526 5.311 1.00 . A A . 21 ASN HA 1 1 8 13466 1 1 21 ASN HB2 H -10.160 0.906 4.219 1.00 . A A . 21 ASN HB2 1 1 8 13467 1 1 21 ASN HB3 H -10.869 1.786 5.558 1.00 . A A . 21 ASN HB3 1 1 8 13468 1 1 21 ASN HD21 H -10.032 1.895 2.150 1.00 . A A . 21 ASN HD21 1 1 8 13469 1 1 21 ASN HD22 H -11.150 3.126 1.666 1.00 . A A . 21 ASN HD22 1 1 8 13470 1 1 21 ASN N N -8.056 2.533 3.814 1.00 . A A . 21 ASN N 1 1 8 13471 1 1 21 ASN ND2 N -10.712 2.589 2.386 1.00 . A A . 21 ASN ND2 1 1 8 13472 1 1 21 ASN O O -7.704 0.554 5.733 1.00 . A A . 21 ASN O 1 1 8 13473 1 1 21 ASN OD1 O -11.853 3.623 4.030 1.00 . A A . 21 ASN OD1 1 1 8 13474 1 1 22 HIS C C -8.889 0.444 9.054 1.00 . A A . 22 HIS C 1 1 8 13475 1 1 22 HIS CA C -7.804 1.307 8.407 1.00 . A A . 22 HIS CA 1 1 8 13476 1 1 22 HIS CB C -7.127 2.253 9.402 1.00 . A A . 22 HIS CB 1 1 8 13477 1 1 22 HIS CD2 C -4.529 1.985 9.298 1.00 . A A . 22 HIS CD2 1 1 8 13478 1 1 22 HIS CE1 C -4.075 3.792 8.152 1.00 . A A . 22 HIS CE1 1 1 8 13479 1 1 22 HIS CG C -5.708 2.617 9.034 1.00 . A A . 22 HIS CG 1 1 8 13480 1 1 22 HIS H H -8.831 2.901 7.544 1.00 . A A . 22 HIS H 1 1 8 13481 1 1 22 HIS HA H -7.035 0.657 7.991 1.00 . A A . 22 HIS HA 1 1 8 13482 1 1 22 HIS HB2 H -7.717 3.166 9.479 1.00 . A A . 22 HIS HB2 1 1 8 13483 1 1 22 HIS HB3 H -7.128 1.788 10.388 1.00 . A A . 22 HIS HB3 1 1 8 13484 1 1 22 HIS HD1 H -6.041 4.429 7.967 1.00 . A A . 22 HIS HD1 1 1 8 13485 1 1 22 HIS HD2 H -4.416 1.053 9.854 1.00 . A A . 22 HIS HD2 1 1 8 13486 1 1 22 HIS HE1 H -3.516 4.565 7.625 1.00 . A A . 22 HIS HE1 1 1 8 13487 1 1 22 HIS N N -8.371 2.049 7.294 1.00 . A A . 22 HIS N 1 1 8 13488 1 1 22 HIS ND1 N -5.389 3.753 8.311 1.00 . A A . 22 HIS ND1 1 1 8 13489 1 1 22 HIS NE2 N -3.543 2.695 8.764 1.00 . A A . 22 HIS NE2 1 1 8 13490 1 1 22 HIS O O -8.588 -0.452 9.841 1.00 . A A . 22 HIS O 1 1 8 13491 1 1 23 SER C C -11.507 -1.252 8.404 1.00 . A A . 23 SER C 1 1 8 13492 1 1 23 SER CA C -11.261 0.008 9.236 1.00 . A A . 23 SER CA 1 1 8 13493 1 1 23 SER CB C -12.520 0.878 9.266 1.00 . A A . 23 SER CB 1 1 8 13494 1 1 23 SER H H -10.366 1.476 8.059 1.00 . A A . 23 SER H 1 1 8 13495 1 1 23 SER HA H -10.977 -0.255 10.255 1.00 . A A . 23 SER HA 1 1 8 13496 1 1 23 SER HB2 H -13.355 0.293 9.652 1.00 . A A . 23 SER HB2 1 1 8 13497 1 1 23 SER HB3 H -12.369 1.710 9.953 1.00 . A A . 23 SER HB3 1 1 8 13498 1 1 23 SER HG H -13.076 0.627 7.360 1.00 . A A . 23 SER HG 1 1 8 13499 1 1 23 SER N N -10.130 0.745 8.699 1.00 . A A . 23 SER N 1 1 8 13500 1 1 23 SER O O -12.369 -2.063 8.739 1.00 . A A . 23 SER O 1 1 8 13501 1 1 23 SER OG O -12.852 1.383 7.975 1.00 . A A . 23 SER OG 1 1 8 13502 1 1 24 THR C C -9.710 -3.509 6.694 1.00 . A A . 24 THR C 1 1 8 13503 1 1 24 THR CA C -10.857 -2.525 6.453 1.00 . A A . 24 THR CA 1 1 8 13504 1 1 24 THR CB C -10.924 -2.010 5.014 1.00 . A A . 24 THR CB 1 1 8 13505 1 1 24 THR CG2 C -11.059 -3.142 3.993 1.00 . A A . 24 THR CG2 1 1 8 13506 1 1 24 THR H H -10.035 -0.713 7.070 1.00 . A A . 24 THR H 1 1 8 13507 1 1 24 THR HA H -11.782 -3.048 6.696 1.00 . A A . 24 THR HA 1 1 8 13508 1 1 24 THR HB H -10.064 -1.381 4.786 1.00 . A A . 24 THR HB 1 1 8 13509 1 1 24 THR HG1 H -12.925 -1.989 4.996 1.00 . A A . 24 THR HG1 1 1 8 13510 1 1 24 THR HG21 H -11.089 -4.099 4.513 1.00 . A A . 24 THR HG21 1 1 8 13511 1 1 24 THR HG22 H -11.979 -3.009 3.423 1.00 . A A . 24 THR HG22 1 1 8 13512 1 1 24 THR HG23 H -10.206 -3.123 3.315 1.00 . A A . 24 THR HG23 1 1 8 13513 1 1 24 THR N N -10.734 -1.378 7.335 1.00 . A A . 24 THR N 1 1 8 13514 1 1 24 THR O O -9.886 -4.719 6.562 1.00 . A A . 24 THR O 1 1 8 13515 1 1 24 THR OG1 O -12.174 -1.330 4.946 1.00 . A A . 24 THR OG1 1 1 8 13516 1 1 25 HIS C C -7.202 -3.937 8.812 1.00 . A A . 25 HIS C 1 1 8 13517 1 1 25 HIS CA C -7.383 -3.764 7.303 1.00 . A A . 25 HIS CA 1 1 8 13518 1 1 25 HIS CB C -6.149 -3.168 6.622 1.00 . A A . 25 HIS CB 1 1 8 13519 1 1 25 HIS CD2 C -5.745 -3.776 4.112 1.00 . A A . 25 HIS CD2 1 1 8 13520 1 1 25 HIS CE1 C -6.949 -2.188 3.209 1.00 . A A . 25 HIS CE1 1 1 8 13521 1 1 25 HIS CG C -6.280 -3.034 5.123 1.00 . A A . 25 HIS CG 1 1 8 13522 1 1 25 HIS H H -8.424 -1.967 7.148 1.00 . A A . 25 HIS H 1 1 8 13523 1 1 25 HIS HA H -7.571 -4.740 6.855 1.00 . A A . 25 HIS HA 1 1 8 13524 1 1 25 HIS HB2 H -5.951 -2.185 7.049 1.00 . A A . 25 HIS HB2 1 1 8 13525 1 1 25 HIS HB3 H -5.285 -3.794 6.846 1.00 . A A . 25 HIS HB3 1 1 8 13526 1 1 25 HIS HD1 H -7.552 -1.331 5.000 1.00 . A A . 25 HIS HD1 1 1 8 13527 1 1 25 HIS HD2 H -5.095 -4.643 4.233 1.00 . A A . 25 HIS HD2 1 1 8 13528 1 1 25 HIS HE1 H -7.433 -1.560 2.461 1.00 . A A . 25 HIS HE1 1 1 8 13529 1 1 25 HIS N N -8.559 -2.952 7.043 1.00 . A A . 25 HIS N 1 1 8 13530 1 1 25 HIS ND1 N -7.033 -2.040 4.523 1.00 . A A . 25 HIS ND1 1 1 8 13531 1 1 25 HIS NE2 N -6.151 -3.265 2.956 1.00 . A A . 25 HIS NE2 1 1 8 13532 1 1 25 HIS O O -6.075 -3.987 9.304 1.00 . A A . 25 HIS O 1 1 8 13533 1 1 26 LYS C C -7.754 -5.571 11.292 1.00 . A A . 26 LYS C 1 1 8 13534 1 1 26 LYS CA C -8.307 -4.187 10.949 1.00 . A A . 26 LYS CA 1 1 8 13535 1 1 26 LYS CB C -9.693 -3.915 11.539 1.00 . A A . 26 LYS CB 1 1 8 13536 1 1 26 LYS CD C -11.635 -2.309 11.625 1.00 . A A . 26 LYS CD 1 1 8 13537 1 1 26 LYS CE C -11.588 -1.567 12.963 1.00 . A A . 26 LYS CE 1 1 8 13538 1 1 26 LYS CG C -10.225 -2.554 11.085 1.00 . A A . 26 LYS CG 1 1 8 13539 1 1 26 LYS H H -9.240 -3.980 9.098 1.00 . A A . 26 LYS H 1 1 8 13540 1 1 26 LYS HA H -7.631 -3.434 11.354 1.00 . A A . 26 LYS HA 1 1 8 13541 1 1 26 LYS HB2 H -10.384 -4.700 11.232 1.00 . A A . 26 LYS HB2 1 1 8 13542 1 1 26 LYS HB3 H -9.641 -3.945 12.627 1.00 . A A . 26 LYS HB3 1 1 8 13543 1 1 26 LYS HD2 H -12.209 -1.728 10.903 1.00 . A A . 26 LYS HD2 1 1 8 13544 1 1 26 LYS HD3 H -12.151 -3.260 11.751 1.00 . A A . 26 LYS HD3 1 1 8 13545 1 1 26 LYS HE2 H -10.954 -2.110 13.664 1.00 . A A . 26 LYS HE2 1 1 8 13546 1 1 26 LYS HE3 H -11.141 -0.583 12.825 1.00 . A A . 26 LYS HE3 1 1 8 13547 1 1 26 LYS HG2 H -9.557 -1.765 11.431 1.00 . A A . 26 LYS HG2 1 1 8 13548 1 1 26 LYS HG3 H -10.235 -2.508 9.996 1.00 . A A . 26 LYS HG3 1 1 8 13549 1 1 26 LYS HZ1 H -13.593 -1.008 12.861 1.00 . A A . 26 LYS HZ1 1 1 8 13550 1 1 26 LYS HZ2 H -13.345 -2.320 13.794 1.00 . A A . 26 LYS HZ2 1 1 8 13551 1 1 26 LYS N N -8.328 -4.022 9.505 1.00 . A A . 26 LYS N 1 1 8 13552 1 1 26 LYS NZ N -12.950 -1.426 13.525 1.00 . A A . 26 LYS NZ 1 1 8 13553 1 1 26 LYS O O -7.036 -5.730 12.278 1.00 . A A . 26 LYS O 1 1 8 13554 1 1 27 SER C C -6.185 -8.034 10.259 1.00 . A A . 27 SER C 1 1 8 13555 1 1 27 SER CA C -7.655 -7.904 10.661 1.00 . A A . 27 SER CA 1 1 8 13556 1 1 27 SER CB C -8.512 -8.892 9.866 1.00 . A A . 27 SER CB 1 1 8 13557 1 1 27 SER H H -8.691 -6.401 9.658 1.00 . A A . 27 SER H 1 1 8 13558 1 1 27 SER HA H -7.779 -8.093 11.727 1.00 . A A . 27 SER HA 1 1 8 13559 1 1 27 SER HB2 H -9.214 -8.341 9.240 1.00 . A A . 27 SER HB2 1 1 8 13560 1 1 27 SER HB3 H -7.874 -9.469 9.198 1.00 . A A . 27 SER HB3 1 1 8 13561 1 1 27 SER HG H -9.802 -9.256 11.353 1.00 . A A . 27 SER HG 1 1 8 13562 1 1 27 SER N N -8.108 -6.538 10.458 1.00 . A A . 27 SER N 1 1 8 13563 1 1 27 SER O O -5.541 -9.036 10.563 1.00 . A A . 27 SER O 1 1 8 13564 1 1 27 SER OG O -9.233 -9.778 10.718 1.00 . A A . 27 SER OG 1 1 8 13565 1 1 28 VAL C C -3.430 -6.418 10.242 1.00 . A A . 28 VAL C 1 1 8 13566 1 1 28 VAL CA C -4.315 -6.991 9.133 1.00 . A A . 28 VAL CA 1 1 8 13567 1 1 28 VAL CB C -4.199 -6.220 7.817 1.00 . A A . 28 VAL CB 1 1 8 13568 1 1 28 VAL CG1 C -2.790 -6.344 7.232 1.00 . A A . 28 VAL CG1 1 1 8 13569 1 1 28 VAL CG2 C -5.253 -6.689 6.812 1.00 . A A . 28 VAL CG2 1 1 8 13570 1 1 28 VAL H H -6.228 -6.193 9.338 1.00 . A A . 28 VAL H 1 1 8 13571 1 1 28 VAL HA H -4.019 -8.024 8.947 1.00 . A A . 28 VAL HA 1 1 8 13572 1 1 28 VAL HB H -4.382 -5.167 8.028 1.00 . A A . 28 VAL HB 1 1 8 13573 1 1 28 VAL HG11 H -2.088 -6.597 8.026 1.00 . A A . 28 VAL HG11 1 1 8 13574 1 1 28 VAL HG12 H -2.779 -7.126 6.474 1.00 . A A . 28 VAL HG12 1 1 8 13575 1 1 28 VAL HG13 H -2.500 -5.395 6.780 1.00 . A A . 28 VAL HG13 1 1 8 13576 1 1 28 VAL HG21 H -5.249 -7.778 6.763 1.00 . A A . 28 VAL HG21 1 1 8 13577 1 1 28 VAL HG22 H -6.236 -6.343 7.130 1.00 . A A . 28 VAL HG22 1 1 8 13578 1 1 28 VAL HG23 H -5.024 -6.280 5.828 1.00 . A A . 28 VAL HG23 1 1 8 13579 1 1 28 VAL N N -5.697 -7.005 9.581 1.00 . A A . 28 VAL N 1 1 8 13580 1 1 28 VAL O O -3.822 -5.477 10.929 1.00 . A A . 28 VAL O 1 1 8 13581 1 1 29 LYS C C -0.719 -5.222 10.985 1.00 . A A . 29 LYS C 1 1 8 13582 1 1 29 LYS CA C -1.310 -6.572 11.396 1.00 . A A . 29 LYS CA 1 1 8 13583 1 1 29 LYS CB C -0.257 -7.652 11.652 1.00 . A A . 29 LYS CB 1 1 8 13584 1 1 29 LYS CD C 0.699 -7.802 13.981 1.00 . A A . 29 LYS CD 1 1 8 13585 1 1 29 LYS CE C 0.496 -6.347 14.409 1.00 . A A . 29 LYS CE 1 1 8 13586 1 1 29 LYS CG C -0.423 -8.260 13.046 1.00 . A A . 29 LYS CG 1 1 8 13587 1 1 29 LYS H H -1.942 -7.777 9.819 1.00 . A A . 29 LYS H 1 1 8 13588 1 1 29 LYS HA H -1.866 -6.438 12.324 1.00 . A A . 29 LYS HA 1 1 8 13589 1 1 29 LYS HB2 H -0.342 -8.434 10.898 1.00 . A A . 29 LYS HB2 1 1 8 13590 1 1 29 LYS HB3 H 0.740 -7.223 11.554 1.00 . A A . 29 LYS HB3 1 1 8 13591 1 1 29 LYS HD2 H 0.727 -8.443 14.862 1.00 . A A . 29 LYS HD2 1 1 8 13592 1 1 29 LYS HD3 H 1.661 -7.906 13.479 1.00 . A A . 29 LYS HD3 1 1 8 13593 1 1 29 LYS HE2 H 0.319 -5.725 13.532 1.00 . A A . 29 LYS HE2 1 1 8 13594 1 1 29 LYS HE3 H -0.390 -6.267 15.040 1.00 . A A . 29 LYS HE3 1 1 8 13595 1 1 29 LYS HG2 H -1.388 -7.970 13.461 1.00 . A A . 29 LYS HG2 1 1 8 13596 1 1 29 LYS HG3 H -0.420 -9.347 12.975 1.00 . A A . 29 LYS HG3 1 1 8 13597 1 1 29 LYS HZ1 H 1.827 -4.859 15.005 1.00 . A A . 29 LYS HZ1 1 1 8 13598 1 1 29 LYS HZ2 H 1.597 -6.000 16.144 1.00 . A A . 29 LYS HZ2 1 1 8 13599 1 1 29 LYS N N -2.253 -7.011 10.382 1.00 . A A . 29 LYS N 1 1 8 13600 1 1 29 LYS NZ N 1.681 -5.853 15.144 1.00 . A A . 29 LYS NZ 1 1 8 13601 1 1 29 LYS O O -0.317 -5.039 9.837 1.00 . A A . 29 LYS O 1 1 8 13602 1 1 30 CYS C C 1.289 -3.129 11.196 1.00 . A A . 30 CYS C 1 1 8 13603 1 1 30 CYS CA C -0.149 -2.982 11.699 1.00 . A A . 30 CYS CA 1 1 8 13604 1 1 30 CYS CB C -0.230 -2.099 12.946 1.00 . A A . 30 CYS CB 1 1 8 13605 1 1 30 CYS H H -1.012 -4.467 12.878 1.00 . A A . 30 CYS H 1 1 8 13606 1 1 30 CYS HA H -0.781 -2.527 10.937 1.00 . A A . 30 CYS HA 1 1 8 13607 1 1 30 CYS HB2 H 0.599 -2.351 13.607 1.00 . A A . 30 CYS HB2 1 1 8 13608 1 1 30 CYS HB3 H -0.094 -1.059 12.647 1.00 . A A . 30 CYS HB3 1 1 8 13609 1 1 30 CYS N N -0.684 -4.310 11.946 1.00 . A A . 30 CYS N 1 1 8 13610 1 1 30 CYS O O 1.764 -2.307 10.415 1.00 . A A . 30 CYS O 1 1 8 13611 1 1 30 CYS SG S -1.794 -2.238 13.885 1.00 . A A . 30 CYS SG 1 1 8 13612 1 1 31 GLY C C 3.375 -5.081 9.881 1.00 . A A . 31 GLY C 1 1 8 13613 1 1 31 GLY CA C 3.315 -4.448 11.273 1.00 . A A . 31 GLY CA 1 1 8 13614 1 1 31 GLY H H 1.547 -4.847 12.300 1.00 . A A . 31 GLY H 1 1 8 13615 1 1 31 GLY HA2 H 3.884 -3.519 11.279 1.00 . A A . 31 GLY HA2 1 1 8 13616 1 1 31 GLY HA3 H 3.782 -5.113 11.999 1.00 . A A . 31 GLY HA3 1 1 8 13617 1 1 31 GLY N N 1.941 -4.183 11.665 1.00 . A A . 31 GLY N 1 1 8 13618 1 1 31 GLY O O 4.459 -5.308 9.345 1.00 . A A . 31 GLY O 1 1 8 13619 1 1 32 ASP C C 2.321 -4.871 6.951 1.00 . A A . 32 ASP C 1 1 8 13620 1 1 32 ASP CA C 2.103 -5.948 8.016 1.00 . A A . 32 ASP CA 1 1 8 13621 1 1 32 ASP CB C 0.721 -6.564 7.789 1.00 . A A . 32 ASP CB 1 1 8 13622 1 1 32 ASP CG C 0.628 -7.525 6.602 1.00 . A A . 32 ASP CG 1 1 8 13623 1 1 32 ASP H H 1.321 -5.158 9.777 1.00 . A A . 32 ASP H 1 1 8 13624 1 1 32 ASP HA H 2.875 -6.717 7.996 1.00 . A A . 32 ASP HA 1 1 8 13625 1 1 32 ASP HB2 H 0.424 -7.096 8.693 1.00 . A A . 32 ASP HB2 1 1 8 13626 1 1 32 ASP HB3 H 0.001 -5.759 7.643 1.00 . A A . 32 ASP HB3 1 1 8 13627 1 1 32 ASP N N 2.197 -5.346 9.335 1.00 . A A . 32 ASP N 1 1 8 13628 1 1 32 ASP O O 2.826 -5.158 5.867 1.00 . A A . 32 ASP O 1 1 8 13629 1 1 32 ASP OD1 O 1.048 -7.109 5.501 1.00 . A A . 32 ASP OD1 1 1 8 13630 1 1 32 ASP OD2 O 0.138 -8.654 6.823 1.00 . A A . 32 ASP OD2 1 1 8 13631 1 1 33 CYS C C 3.188 -1.625 6.914 1.00 . A A . 33 CYS C 1 1 8 13632 1 1 33 CYS CA C 2.075 -2.532 6.386 1.00 . A A . 33 CYS CA 1 1 8 13633 1 1 33 CYS CB C 0.758 -1.775 6.206 1.00 . A A . 33 CYS CB 1 1 8 13634 1 1 33 CYS H H 1.519 -3.429 8.182 1.00 . A A . 33 CYS H 1 1 8 13635 1 1 33 CYS HA H 2.344 -2.950 5.416 1.00 . A A . 33 CYS HA 1 1 8 13636 1 1 33 CYS HB2 H 0.162 -1.843 7.116 1.00 . A A . 33 CYS HB2 1 1 8 13637 1 1 33 CYS HB3 H 0.958 -0.717 6.035 1.00 . A A . 33 CYS HB3 1 1 8 13638 1 1 33 CYS N N 1.929 -3.654 7.298 1.00 . A A . 33 CYS N 1 1 8 13639 1 1 33 CYS O O 4.134 -1.312 6.193 1.00 . A A . 33 CYS O 1 1 8 13640 1 1 33 CYS SG S -0.176 -2.470 4.794 1.00 . A A . 33 CYS SG 1 1 8 13641 1 1 34 HIS C C 5.235 -1.186 9.223 1.00 . A A . 34 HIS C 1 1 8 13642 1 1 34 HIS CA C 4.017 -0.361 8.802 1.00 . A A . 34 HIS CA 1 1 8 13643 1 1 34 HIS CB C 3.391 0.408 9.967 1.00 . A A . 34 HIS CB 1 1 8 13644 1 1 34 HIS CD2 C 0.880 1.058 9.641 1.00 . A A . 34 HIS CD2 1 1 8 13645 1 1 34 HIS CE1 C 1.183 3.050 8.790 1.00 . A A . 34 HIS CE1 1 1 8 13646 1 1 34 HIS CG C 2.224 1.280 9.571 1.00 . A A . 34 HIS CG 1 1 8 13647 1 1 34 HIS H H 2.265 -1.486 8.749 1.00 . A A . 34 HIS H 1 1 8 13648 1 1 34 HIS HA H 4.324 0.366 8.051 1.00 . A A . 34 HIS HA 1 1 8 13649 1 1 34 HIS HB2 H 3.059 -0.305 10.723 1.00 . A A . 34 HIS HB2 1 1 8 13650 1 1 34 HIS HB3 H 4.156 1.030 10.432 1.00 . A A . 34 HIS HB3 1 1 8 13651 1 1 34 HIS HD1 H 3.256 2.998 8.850 1.00 . A A . 34 HIS HD1 1 1 8 13652 1 1 34 HIS HD2 H 0.403 0.154 10.020 1.00 . A A . 34 HIS HD2 1 1 8 13653 1 1 34 HIS HE1 H 0.974 4.032 8.363 1.00 . A A . 34 HIS HE1 1 1 8 13654 1 1 34 HIS N N 3.037 -1.227 8.169 1.00 . A A . 34 HIS N 1 1 8 13655 1 1 34 HIS ND1 N 2.383 2.544 9.030 1.00 . A A . 34 HIS ND1 1 1 8 13656 1 1 34 HIS NE2 N 0.252 2.128 9.170 1.00 . A A . 34 HIS NE2 1 1 8 13657 1 1 34 HIS O O 5.629 -1.169 10.389 1.00 . A A . 34 HIS O 1 1 8 13658 1 1 35 HIS C C 7.937 -1.972 9.418 1.00 . A A . 35 HIS C 1 1 8 13659 1 1 35 HIS CA C 6.962 -2.720 8.507 1.00 . A A . 35 HIS CA 1 1 8 13660 1 1 35 HIS CB C 7.606 -3.171 7.194 1.00 . A A . 35 HIS CB 1 1 8 13661 1 1 35 HIS CD2 C 7.744 -1.378 5.297 1.00 . A A . 35 HIS CD2 1 1 8 13662 1 1 35 HIS CE1 C 9.699 -0.537 5.805 1.00 . A A . 35 HIS CE1 1 1 8 13663 1 1 35 HIS CG C 8.213 -2.046 6.389 1.00 . A A . 35 HIS CG 1 1 8 13664 1 1 35 HIS H H 5.471 -1.898 7.306 1.00 . A A . 35 HIS H 1 1 8 13665 1 1 35 HIS HA H 6.605 -3.610 9.024 1.00 . A A . 35 HIS HA 1 1 8 13666 1 1 35 HIS HB2 H 8.381 -3.905 7.414 1.00 . A A . 35 HIS HB2 1 1 8 13667 1 1 35 HIS HB3 H 6.854 -3.674 6.586 1.00 . A A . 35 HIS HB3 1 1 8 13668 1 1 35 HIS HD1 H 10.047 -1.771 7.436 1.00 . A A . 35 HIS HD1 1 1 8 13669 1 1 35 HIS HD2 H 6.792 -1.561 4.798 1.00 . A A . 35 HIS HD2 1 1 8 13670 1 1 35 HIS HE1 H 10.593 0.085 5.772 1.00 . A A . 35 HIS HE1 1 1 8 13671 1 1 35 HIS N N 5.798 -1.890 8.252 1.00 . A A . 35 HIS N 1 1 8 13672 1 1 35 HIS ND1 N 9.447 -1.495 6.685 1.00 . A A . 35 HIS ND1 1 1 8 13673 1 1 35 HIS NE2 N 8.641 -0.466 4.946 1.00 . A A . 35 HIS NE2 1 1 8 13674 1 1 35 HIS O O 8.008 -0.744 9.382 1.00 . A A . 35 HIS O 1 1 8 13675 1 1 36 PRO C C 10.901 -1.719 10.412 1.00 . A A . 36 PRO C 1 1 8 13676 1 1 36 PRO CA C 9.649 -2.188 11.156 1.00 . A A . 36 PRO CA 1 1 8 13677 1 1 36 PRO CB C 9.935 -3.289 12.164 1.00 . A A . 36 PRO CB 1 1 8 13678 1 1 36 PRO CD C 8.624 -4.220 10.306 1.00 . A A . 36 PRO CD 1 1 8 13679 1 1 36 PRO CG C 9.479 -4.583 11.509 1.00 . A A . 36 PRO CG 1 1 8 13680 1 1 36 PRO HA H 9.269 -1.374 11.594 1.00 . A A . 36 PRO HA 1 1 8 13681 1 1 36 PRO HB2 H 10.997 -3.329 12.408 1.00 . A A . 36 PRO HB2 1 1 8 13682 1 1 36 PRO HB3 H 9.400 -3.114 13.097 1.00 . A A . 36 PRO HB3 1 1 8 13683 1 1 36 PRO HD2 H 9.010 -4.676 9.394 1.00 . A A . 36 PRO HD2 1 1 8 13684 1 1 36 PRO HD3 H 7.599 -4.570 10.428 1.00 . A A . 36 PRO HD3 1 1 8 13685 1 1 36 PRO HG2 H 10.338 -5.179 11.202 1.00 . A A . 36 PRO HG2 1 1 8 13686 1 1 36 PRO HG3 H 8.908 -5.187 12.215 1.00 . A A . 36 PRO HG3 1 1 8 13687 1 1 36 PRO N N 8.682 -2.763 10.236 1.00 . A A . 36 PRO N 1 1 8 13688 1 1 36 PRO O O 11.536 -2.498 9.703 1.00 . A A . 36 PRO O 1 1 8 13689 1 1 37 VAL C C 13.394 0.559 11.022 1.00 . A A . 37 VAL C 1 1 8 13690 1 1 37 VAL CA C 12.382 0.138 9.954 1.00 . A A . 37 VAL CA 1 1 8 13691 1 1 37 VAL CB C 11.954 1.293 9.047 1.00 . A A . 37 VAL CB 1 1 8 13692 1 1 37 VAL CG1 C 13.164 1.923 8.354 1.00 . A A . 37 VAL CG1 1 1 8 13693 1 1 37 VAL CG2 C 10.915 0.831 8.024 1.00 . A A . 37 VAL CG2 1 1 8 13694 1 1 37 VAL H H 10.696 0.182 11.177 1.00 . A A . 37 VAL H 1 1 8 13695 1 1 37 VAL HA H 12.833 -0.633 9.329 1.00 . A A . 37 VAL HA 1 1 8 13696 1 1 37 VAL HB H 11.492 2.057 9.673 1.00 . A A . 37 VAL HB 1 1 8 13697 1 1 37 VAL HG11 H 13.870 2.277 9.105 1.00 . A A . 37 VAL HG11 1 1 8 13698 1 1 37 VAL HG12 H 13.649 1.178 7.722 1.00 . A A . 37 VAL HG12 1 1 8 13699 1 1 37 VAL HG13 H 12.835 2.761 7.740 1.00 . A A . 37 VAL HG13 1 1 8 13700 1 1 37 VAL HG21 H 11.154 -0.180 7.695 1.00 . A A . 37 VAL HG21 1 1 8 13701 1 1 37 VAL HG22 H 9.926 0.840 8.482 1.00 . A A . 37 VAL HG22 1 1 8 13702 1 1 37 VAL HG23 H 10.925 1.504 7.167 1.00 . A A . 37 VAL HG23 1 1 8 13703 1 1 37 VAL N N 11.218 -0.446 10.599 1.00 . A A . 37 VAL N 1 1 8 13704 1 1 37 VAL O O 13.096 1.403 11.866 1.00 . A A . 37 VAL O 1 1 8 13705 1 1 38 ASN C C 15.413 -0.573 13.173 1.00 . A A . 38 ASN C 1 1 8 13706 1 1 38 ASN CA C 15.626 0.252 11.902 1.00 . A A . 38 ASN CA 1 1 8 13707 1 1 38 ASN CB C 15.611 1.732 12.291 1.00 . A A . 38 ASN CB 1 1 8 13708 1 1 38 ASN CG C 17.018 2.219 12.646 1.00 . A A . 38 ASN CG 1 1 8 13709 1 1 38 ASN H H 14.803 -0.734 10.262 1.00 . A A . 38 ASN H 1 1 8 13710 1 1 38 ASN HA H 16.553 -0.003 11.389 1.00 . A A . 38 ASN HA 1 1 8 13711 1 1 38 ASN HB2 H 15.215 2.325 11.467 1.00 . A A . 38 ASN HB2 1 1 8 13712 1 1 38 ASN HB3 H 14.945 1.882 13.141 1.00 . A A . 38 ASN HB3 1 1 8 13713 1 1 38 ASN HD21 H 16.236 3.145 14.268 1.00 . A A . 38 ASN HD21 1 1 8 13714 1 1 38 ASN HD22 H 17.948 3.321 14.067 1.00 . A A . 38 ASN HD22 1 1 8 13715 1 1 38 ASN N N 14.569 -0.049 10.951 1.00 . A A . 38 ASN N 1 1 8 13716 1 1 38 ASN ND2 N 17.072 2.956 13.752 1.00 . A A . 38 ASN ND2 1 1 8 13717 1 1 38 ASN O O 16.227 -0.522 14.093 1.00 . A A . 38 ASN O 1 1 8 13718 1 1 38 ASN OD1 O 17.989 1.945 11.961 1.00 . A A . 38 ASN OD1 1 1 8 13719 1 1 39 GLY C C 12.907 -1.491 15.190 1.00 . A A . 39 GLY C 1 1 8 13720 1 1 39 GLY CA C 13.984 -2.147 14.325 1.00 . A A . 39 GLY CA 1 1 8 13721 1 1 39 GLY H H 13.658 -1.349 12.429 1.00 . A A . 39 GLY H 1 1 8 13722 1 1 39 GLY HA2 H 13.636 -3.121 13.981 1.00 . A A . 39 GLY HA2 1 1 8 13723 1 1 39 GLY HA3 H 14.879 -2.322 14.923 1.00 . A A . 39 GLY HA3 1 1 8 13724 1 1 39 GLY N N 14.314 -1.313 13.182 1.00 . A A . 39 GLY N 1 1 8 13725 1 1 39 GLY O O 12.455 -2.074 16.175 1.00 . A A . 39 GLY O 1 1 8 13726 1 1 40 LYS C C 10.195 0.414 14.734 1.00 . A A . 40 LYS C 1 1 8 13727 1 1 40 LYS CA C 11.509 0.456 15.518 1.00 . A A . 40 LYS CA 1 1 8 13728 1 1 40 LYS CB C 11.997 1.873 15.825 1.00 . A A . 40 LYS CB 1 1 8 13729 1 1 40 LYS CD C 12.452 4.162 14.869 1.00 . A A . 40 LYS CD 1 1 8 13730 1 1 40 LYS CE C 13.162 4.819 13.684 1.00 . A A . 40 LYS CE 1 1 8 13731 1 1 40 LYS CG C 12.075 2.714 14.549 1.00 . A A . 40 LYS CG 1 1 8 13732 1 1 40 LYS H H 12.897 0.181 13.989 1.00 . A A . 40 LYS H 1 1 8 13733 1 1 40 LYS HA H 11.358 -0.047 16.473 1.00 . A A . 40 LYS HA 1 1 8 13734 1 1 40 LYS HB2 H 11.323 2.348 16.537 1.00 . A A . 40 LYS HB2 1 1 8 13735 1 1 40 LYS HB3 H 12.979 1.829 16.296 1.00 . A A . 40 LYS HB3 1 1 8 13736 1 1 40 LYS HD2 H 11.555 4.728 15.120 1.00 . A A . 40 LYS HD2 1 1 8 13737 1 1 40 LYS HD3 H 13.100 4.188 15.745 1.00 . A A . 40 LYS HD3 1 1 8 13738 1 1 40 LYS HE2 H 13.547 4.051 13.012 1.00 . A A . 40 LYS HE2 1 1 8 13739 1 1 40 LYS HE3 H 12.452 5.415 13.112 1.00 . A A . 40 LYS HE3 1 1 8 13740 1 1 40 LYS HG2 H 12.812 2.284 13.870 1.00 . A A . 40 LYS HG2 1 1 8 13741 1 1 40 LYS HG3 H 11.115 2.690 14.034 1.00 . A A . 40 LYS HG3 1 1 8 13742 1 1 40 LYS HZ1 H 14.685 6.213 13.400 1.00 . A A . 40 LYS HZ1 1 1 8 13743 1 1 40 LYS HZ2 H 13.967 6.343 14.856 1.00 . A A . 40 LYS HZ2 1 1 8 13744 1 1 40 LYS N N 12.525 -0.287 14.791 1.00 . A A . 40 LYS N 1 1 8 13745 1 1 40 LYS NZ N 14.273 5.676 14.155 1.00 . A A . 40 LYS NZ 1 1 8 13746 1 1 40 LYS O O 10.201 0.421 13.505 1.00 . A A . 40 LYS O 1 1 8 13747 1 1 41 GLU C C 7.005 1.606 15.196 1.00 . A A . 41 GLU C 1 1 8 13748 1 1 41 GLU CA C 7.782 0.329 14.870 1.00 . A A . 41 GLU CA 1 1 8 13749 1 1 41 GLU CB C 7.010 -0.913 15.321 1.00 . A A . 41 GLU CB 1 1 8 13750 1 1 41 GLU CD C 5.241 -2.368 14.266 1.00 . A A . 41 GLU CD 1 1 8 13751 1 1 41 GLU CG C 6.656 -1.802 14.128 1.00 . A A . 41 GLU CG 1 1 8 13752 1 1 41 GLU H H 9.104 0.367 16.479 1.00 . A A . 41 GLU H 1 1 8 13753 1 1 41 GLU HA H 7.961 0.268 13.797 1.00 . A A . 41 GLU HA 1 1 8 13754 1 1 41 GLU HB2 H 7.608 -1.478 16.036 1.00 . A A . 41 GLU HB2 1 1 8 13755 1 1 41 GLU HB3 H 6.098 -0.611 15.837 1.00 . A A . 41 GLU HB3 1 1 8 13756 1 1 41 GLU HG2 H 6.734 -1.227 13.205 1.00 . A A . 41 GLU HG2 1 1 8 13757 1 1 41 GLU HG3 H 7.373 -2.620 14.054 1.00 . A A . 41 GLU HG3 1 1 8 13758 1 1 41 GLU N N 9.100 0.372 15.479 1.00 . A A . 41 GLU N 1 1 8 13759 1 1 41 GLU O O 6.866 1.973 16.361 1.00 . A A . 41 GLU O 1 1 8 13760 1 1 41 GLU OE1 O 4.944 -2.891 15.361 1.00 . A A . 41 GLU OE1 1 1 8 13761 1 1 41 GLU OE2 O 4.490 -2.264 13.272 1.00 . A A . 41 GLU OE2 1 1 8 13762 1 1 42 ASP C C 4.717 3.576 13.187 1.00 . A A . 42 ASP C 1 1 8 13763 1 1 42 ASP CA C 5.759 3.477 14.303 1.00 . A A . 42 ASP CA 1 1 8 13764 1 1 42 ASP CB C 6.669 4.703 14.209 1.00 . A A . 42 ASP CB 1 1 8 13765 1 1 42 ASP CG C 6.498 5.723 15.337 1.00 . A A . 42 ASP CG 1 1 8 13766 1 1 42 ASP H H 6.635 1.943 13.199 1.00 . A A . 42 ASP H 1 1 8 13767 1 1 42 ASP HA H 5.306 3.408 15.292 1.00 . A A . 42 ASP HA 1 1 8 13768 1 1 42 ASP HB2 H 7.706 4.367 14.198 1.00 . A A . 42 ASP HB2 1 1 8 13769 1 1 42 ASP HB3 H 6.485 5.201 13.257 1.00 . A A . 42 ASP HB3 1 1 8 13770 1 1 42 ASP N N 6.518 2.248 14.144 1.00 . A A . 42 ASP N 1 1 8 13771 1 1 42 ASP O O 4.772 2.826 12.214 1.00 . A A . 42 ASP O 1 1 8 13772 1 1 42 ASP OD1 O 7.126 5.508 16.396 1.00 . A A . 42 ASP OD1 1 1 8 13773 1 1 42 ASP OD2 O 5.745 6.695 15.113 1.00 . A A . 42 ASP OD2 1 1 8 13774 1 1 43 TYR C C 2.978 5.992 11.584 1.00 . A A . 43 TYR C 1 1 8 13775 1 1 43 TYR CA C 2.737 4.712 12.387 1.00 . A A . 43 TYR CA 1 1 8 13776 1 1 43 TYR CB C 1.442 4.862 13.187 1.00 . A A . 43 TYR CB 1 1 8 13777 1 1 43 TYR CD1 C 1.675 2.430 13.809 1.00 . A A . 43 TYR CD1 1 1 8 13778 1 1 43 TYR CD2 C 0.278 3.817 15.165 1.00 . A A . 43 TYR CD2 1 1 8 13779 1 1 43 TYR CE1 C 1.373 1.302 14.652 1.00 . A A . 43 TYR CE1 1 1 8 13780 1 1 43 TYR CE2 C -0.024 2.690 16.008 1.00 . A A . 43 TYR CE2 1 1 8 13781 1 1 43 TYR CG C 1.121 3.664 14.083 1.00 . A A . 43 TYR CG 1 1 8 13782 1 1 43 TYR CZ C 0.539 1.488 15.710 1.00 . A A . 43 TYR CZ 1 1 8 13783 1 1 43 TYR H H 3.753 5.112 14.161 1.00 . A A . 43 TYR H 1 1 8 13784 1 1 43 TYR HA H 2.738 3.860 11.708 1.00 . A A . 43 TYR HA 1 1 8 13785 1 1 43 TYR HB2 H 1.510 5.757 13.806 1.00 . A A . 43 TYR HB2 1 1 8 13786 1 1 43 TYR HB3 H 0.615 5.016 12.494 1.00 . A A . 43 TYR HB3 1 1 8 13787 1 1 43 TYR HD1 H 2.341 2.309 12.955 1.00 . A A . 43 TYR HD1 1 1 8 13788 1 1 43 TYR HD2 H -0.160 4.792 15.381 1.00 . A A . 43 TYR HD2 1 1 8 13789 1 1 43 TYR HE1 H 1.804 0.322 14.447 1.00 . A A . 43 TYR HE1 1 1 8 13790 1 1 43 TYR HE2 H -0.688 2.797 16.865 1.00 . A A . 43 TYR HE2 1 1 8 13791 1 1 43 TYR HH H -0.091 0.739 17.390 1.00 . A A . 43 TYR HH 1 1 8 13792 1 1 43 TYR N N 3.791 4.506 13.367 1.00 . A A . 43 TYR N 1 1 8 13793 1 1 43 TYR O O 2.519 7.066 11.969 1.00 . A A . 43 TYR O 1 1 8 13794 1 1 43 TYR OH O 0.254 0.423 16.506 1.00 . A A . 43 TYR OH 1 1 8 13795 1 1 44 ARG C C 3.486 6.709 8.205 1.00 . A A . 44 ARG C 1 1 8 13796 1 1 44 ARG CA C 4.005 6.964 9.622 1.00 . A A . 44 ARG CA 1 1 8 13797 1 1 44 ARG CB C 5.512 7.221 9.568 1.00 . A A . 44 ARG CB 1 1 8 13798 1 1 44 ARG CD C 7.357 8.741 10.371 1.00 . A A . 44 ARG CD 1 1 8 13799 1 1 44 ARG CG C 5.853 8.606 10.123 1.00 . A A . 44 ARG CG 1 1 8 13800 1 1 44 ARG CZ C 7.341 10.556 12.092 1.00 . A A . 44 ARG CZ 1 1 8 13801 1 1 44 ARG H H 4.067 4.957 10.177 1.00 . A A . 44 ARG H 1 1 8 13802 1 1 44 ARG HA H 3.493 7.811 10.080 1.00 . A A . 44 ARG HA 1 1 8 13803 1 1 44 ARG HB2 H 6.036 6.456 10.141 1.00 . A A . 44 ARG HB2 1 1 8 13804 1 1 44 ARG HB3 H 5.861 7.142 8.538 1.00 . A A . 44 ARG HB3 1 1 8 13805 1 1 44 ARG HD2 H 7.840 7.771 10.266 1.00 . A A . 44 ARG HD2 1 1 8 13806 1 1 44 ARG HD3 H 7.799 9.401 9.624 1.00 . A A . 44 ARG HD3 1 1 8 13807 1 1 44 ARG HE H 7.976 8.664 12.417 1.00 . A A . 44 ARG HE 1 1 8 13808 1 1 44 ARG HG2 H 5.526 9.373 9.421 1.00 . A A . 44 ARG HG2 1 1 8 13809 1 1 44 ARG HG3 H 5.310 8.772 11.053 1.00 . A A . 44 ARG HG3 1 1 8 13810 1 1 44 ARG HH11 H 6.640 11.141 10.265 1.00 . A A . 44 ARG HH11 1 1 8 13811 1 1 44 ARG HH12 H 6.643 12.375 11.480 1.00 . A A . 44 ARG HH12 1 1 8 13812 1 1 44 ARG HH21 H 7.434 11.854 13.681 1.00 . A A . 44 ARG HH21 1 1 8 13813 1 1 44 ARG N N 3.697 5.835 10.483 1.00 . A A . 44 ARG N 1 1 8 13814 1 1 44 ARG NE N 7.598 9.281 11.728 1.00 . A A . 44 ARG NE 1 1 8 13815 1 1 44 ARG NH1 N 6.831 11.433 11.202 1.00 . A A . 44 ARG NH1 1 1 8 13816 1 1 44 ARG NH2 N 7.596 10.931 13.332 1.00 . A A . 44 ARG NH2 1 1 8 13817 1 1 44 ARG O O 3.032 5.609 7.896 1.00 . A A . 44 ARG O 1 1 8 13818 1 1 45 LYS C C 4.207 6.987 5.159 1.00 . A A . 45 LYS C 1 1 8 13819 1 1 45 LYS CA C 3.117 7.646 6.006 1.00 . A A . 45 LYS CA 1 1 8 13820 1 1 45 LYS CB C 2.679 9.017 5.487 1.00 . A A . 45 LYS CB 1 1 8 13821 1 1 45 LYS CD C 1.805 10.235 7.515 1.00 . A A . 45 LYS CD 1 1 8 13822 1 1 45 LYS CE C 0.861 11.411 7.776 1.00 . A A . 45 LYS CE 1 1 8 13823 1 1 45 LYS CG C 1.430 9.508 6.222 1.00 . A A . 45 LYS CG 1 1 8 13824 1 1 45 LYS H H 3.944 8.635 7.642 1.00 . A A . 45 LYS H 1 1 8 13825 1 1 45 LYS HA H 2.237 7.002 5.998 1.00 . A A . 45 LYS HA 1 1 8 13826 1 1 45 LYS HB2 H 3.489 9.735 5.618 1.00 . A A . 45 LYS HB2 1 1 8 13827 1 1 45 LYS HB3 H 2.477 8.957 4.418 1.00 . A A . 45 LYS HB3 1 1 8 13828 1 1 45 LYS HD2 H 1.765 9.539 8.353 1.00 . A A . 45 LYS HD2 1 1 8 13829 1 1 45 LYS HD3 H 2.831 10.596 7.449 1.00 . A A . 45 LYS HD3 1 1 8 13830 1 1 45 LYS HE2 H 0.488 11.802 6.829 1.00 . A A . 45 LYS HE2 1 1 8 13831 1 1 45 LYS HE3 H -0.005 11.071 8.343 1.00 . A A . 45 LYS HE3 1 1 8 13832 1 1 45 LYS HG2 H 0.863 10.177 5.575 1.00 . A A . 45 LYS HG2 1 1 8 13833 1 1 45 LYS HG3 H 0.783 8.662 6.451 1.00 . A A . 45 LYS HG3 1 1 8 13834 1 1 45 LYS HZ1 H 1.352 13.401 8.150 1.00 . A A . 45 LYS HZ1 1 1 8 13835 1 1 45 LYS HZ2 H 1.299 12.494 9.501 1.00 . A A . 45 LYS HZ2 1 1 8 13836 1 1 45 LYS N N 3.572 7.744 7.383 1.00 . A A . 45 LYS N 1 1 8 13837 1 1 45 LYS NZ N 1.561 12.481 8.521 1.00 . A A . 45 LYS NZ 1 1 8 13838 1 1 45 LYS O O 5.385 7.315 5.292 1.00 . A A . 45 LYS O 1 1 8 13839 1 1 46 CYS C C 5.437 6.391 2.578 1.00 . A A . 46 CYS C 1 1 8 13840 1 1 46 CYS CA C 4.701 5.361 3.437 1.00 . A A . 46 CYS CA 1 1 8 13841 1 1 46 CYS CB C 3.985 4.313 2.583 1.00 . A A . 46 CYS CB 1 1 8 13842 1 1 46 CYS H H 2.816 5.809 4.203 1.00 . A A . 46 CYS H 1 1 8 13843 1 1 46 CYS HA H 5.397 4.831 4.087 1.00 . A A . 46 CYS HA 1 1 8 13844 1 1 46 CYS HB2 H 3.570 4.803 1.703 1.00 . A A . 46 CYS HB2 1 1 8 13845 1 1 46 CYS HB3 H 4.720 3.590 2.229 1.00 . A A . 46 CYS HB3 1 1 8 13846 1 1 46 CYS N N 3.776 6.069 4.306 1.00 . A A . 46 CYS N 1 1 8 13847 1 1 46 CYS O O 6.664 6.375 2.498 1.00 . A A . 46 CYS O 1 1 8 13848 1 1 46 CYS SG S 2.642 3.412 3.440 1.00 . A A . 46 CYS SG 1 1 8 13849 1 1 47 GLY C C 5.799 9.440 1.942 1.00 . A A . 47 GLY C 1 1 8 13850 1 1 47 GLY CA C 5.218 8.298 1.106 1.00 . A A . 47 GLY CA 1 1 8 13851 1 1 47 GLY H H 3.658 7.270 2.027 1.00 . A A . 47 GLY H 1 1 8 13852 1 1 47 GLY HA2 H 5.998 7.871 0.475 1.00 . A A . 47 GLY HA2 1 1 8 13853 1 1 47 GLY HA3 H 4.447 8.686 0.441 1.00 . A A . 47 GLY HA3 1 1 8 13854 1 1 47 GLY N N 4.656 7.263 1.957 1.00 . A A . 47 GLY N 1 1 8 13855 1 1 47 GLY O O 5.477 10.605 1.717 1.00 . A A . 47 GLY O 1 1 8 13856 1 1 48 THR C C 8.646 10.440 3.216 1.00 . A A . 48 THR C 1 1 8 13857 1 1 48 THR CA C 7.274 10.043 3.762 1.00 . A A . 48 THR CA 1 1 8 13858 1 1 48 THR CB C 7.328 9.453 5.173 1.00 . A A . 48 THR CB 1 1 8 13859 1 1 48 THR CG2 C 8.379 10.134 6.052 1.00 . A A . 48 THR CG2 1 1 8 13860 1 1 48 THR H H 6.902 8.115 3.067 1.00 . A A . 48 THR H 1 1 8 13861 1 1 48 THR HA H 6.659 10.943 3.768 1.00 . A A . 48 THR HA 1 1 8 13862 1 1 48 THR HB H 7.489 8.375 5.138 1.00 . A A . 48 THR HB 1 1 8 13863 1 1 48 THR HG1 H 5.490 9.037 5.845 1.00 . A A . 48 THR HG1 1 1 8 13864 1 1 48 THR HG21 H 8.219 11.212 6.040 1.00 . A A . 48 THR HG21 1 1 8 13865 1 1 48 THR HG22 H 8.293 9.764 7.074 1.00 . A A . 48 THR HG22 1 1 8 13866 1 1 48 THR HG23 H 9.375 9.910 5.668 1.00 . A A . 48 THR HG23 1 1 8 13867 1 1 48 THR N N 6.645 9.065 2.891 1.00 . A A . 48 THR N 1 1 8 13868 1 1 48 THR O O 9.450 9.579 2.862 1.00 . A A . 48 THR O 1 1 8 13869 1 1 48 THR OG1 O 6.086 9.835 5.757 1.00 . A A . 48 THR OG1 1 1 8 13870 1 1 49 ALA C C 11.287 11.635 3.451 1.00 . A A . 49 ALA C 1 1 8 13871 1 1 49 ALA CA C 10.134 12.266 2.666 1.00 . A A . 49 ALA CA 1 1 8 13872 1 1 49 ALA CB C 10.130 13.793 2.763 1.00 . A A . 49 ALA CB 1 1 8 13873 1 1 49 ALA H H 8.214 12.438 3.454 1.00 . A A . 49 ALA H 1 1 8 13874 1 1 49 ALA HA H 10.221 11.981 1.618 1.00 . A A . 49 ALA HA 1 1 8 13875 1 1 49 ALA HB1 H 9.144 14.171 2.494 1.00 . A A . 49 ALA HB1 1 1 8 13876 1 1 49 ALA HB2 H 10.367 14.092 3.784 1.00 . A A . 49 ALA HB2 1 1 8 13877 1 1 49 ALA HB3 H 10.875 14.202 2.082 1.00 . A A . 49 ALA HB3 1 1 8 13878 1 1 49 ALA N N 8.873 11.744 3.164 1.00 . A A . 49 ALA N 1 1 8 13879 1 1 49 ALA O O 11.523 11.988 4.605 1.00 . A A . 49 ALA O 1 1 8 13880 1 1 50 GLY C C 12.853 8.520 3.473 1.00 . A A . 50 GLY C 1 1 8 13881 1 1 50 GLY CA C 13.095 10.030 3.413 1.00 . A A . 50 GLY CA 1 1 8 13882 1 1 50 GLY H H 11.775 10.432 1.853 1.00 . A A . 50 GLY H 1 1 8 13883 1 1 50 GLY HA2 H 14.007 10.234 2.851 1.00 . A A . 50 GLY HA2 1 1 8 13884 1 1 50 GLY HA3 H 13.249 10.417 4.421 1.00 . A A . 50 GLY HA3 1 1 8 13885 1 1 50 GLY N N 11.974 10.713 2.792 1.00 . A A . 50 GLY N 1 1 8 13886 1 1 50 GLY O O 13.763 7.754 3.786 1.00 . A A . 50 GLY O 1 1 8 13887 1 1 51 CYS C C 11.052 6.273 1.738 1.00 . A A . 51 CYS C 1 1 8 13888 1 1 51 CYS CA C 11.248 6.734 3.184 1.00 . A A . 51 CYS CA 1 1 8 13889 1 1 51 CYS CB C 10.000 6.490 4.034 1.00 . A A . 51 CYS CB 1 1 8 13890 1 1 51 CYS H H 10.887 8.768 2.915 1.00 . A A . 51 CYS H 1 1 8 13891 1 1 51 CYS HA H 12.072 6.196 3.653 1.00 . A A . 51 CYS HA 1 1 8 13892 1 1 51 CYS HB2 H 9.189 7.137 3.700 1.00 . A A . 51 CYS HB2 1 1 8 13893 1 1 51 CYS HB3 H 9.660 5.462 3.908 1.00 . A A . 51 CYS HB3 1 1 8 13894 1 1 51 CYS N N 11.622 8.138 3.168 1.00 . A A . 51 CYS N 1 1 8 13895 1 1 51 CYS O O 12.011 5.888 1.070 1.00 . A A . 51 CYS O 1 1 8 13896 1 1 51 CYS SG S 10.371 6.814 5.797 1.00 . A A . 51 CYS SG 1 1 8 13897 1 1 52 HIS C C 9.208 7.159 -0.916 1.00 . A A . 52 HIS C 1 1 8 13898 1 1 52 HIS CA C 9.470 5.920 -0.058 1.00 . A A . 52 HIS CA 1 1 8 13899 1 1 52 HIS CB C 8.296 4.940 -0.056 1.00 . A A . 52 HIS CB 1 1 8 13900 1 1 52 HIS CD2 C 8.194 3.049 1.746 1.00 . A A . 52 HIS CD2 1 1 8 13901 1 1 52 HIS CE1 C 9.527 1.615 0.769 1.00 . A A . 52 HIS CE1 1 1 8 13902 1 1 52 HIS CG C 8.612 3.604 0.572 1.00 . A A . 52 HIS CG 1 1 8 13903 1 1 52 HIS H H 9.030 6.642 1.846 1.00 . A A . 52 HIS H 1 1 8 13904 1 1 52 HIS HA H 10.341 5.395 -0.450 1.00 . A A . 52 HIS HA 1 1 8 13905 1 1 52 HIS HB2 H 7.459 5.392 0.477 1.00 . A A . 52 HIS HB2 1 1 8 13906 1 1 52 HIS HB3 H 7.969 4.779 -1.083 1.00 . A A . 52 HIS HB3 1 1 8 13907 1 1 52 HIS HD1 H 9.921 2.788 -0.896 1.00 . A A . 52 HIS HD1 1 1 8 13908 1 1 52 HIS HD2 H 7.521 3.514 2.466 1.00 . A A . 52 HIS HD2 1 1 8 13909 1 1 52 HIS HE1 H 10.110 0.715 0.578 1.00 . A A . 52 HIS HE1 1 1 8 13910 1 1 52 HIS N N 9.804 6.328 1.297 1.00 . A A . 52 HIS N 1 1 8 13911 1 1 52 HIS ND1 N 9.451 2.676 -0.021 1.00 . A A . 52 HIS ND1 1 1 8 13912 1 1 52 HIS NE2 N 8.747 1.848 1.864 1.00 . A A . 52 HIS NE2 1 1 8 13913 1 1 52 HIS O O 8.076 7.401 -1.334 1.00 . A A . 52 HIS O 1 1 8 13914 1 1 53 ASP C C 11.275 9.118 -3.014 1.00 . A A . 53 ASP C 1 1 8 13915 1 1 53 ASP CA C 10.170 9.120 -1.955 1.00 . A A . 53 ASP CA 1 1 8 13916 1 1 53 ASP CB C 10.346 10.370 -1.091 1.00 . A A . 53 ASP CB 1 1 8 13917 1 1 53 ASP CG C 9.605 11.611 -1.591 1.00 . A A . 53 ASP CG 1 1 8 13918 1 1 53 ASP H H 11.189 7.708 -0.811 1.00 . A A . 53 ASP H 1 1 8 13919 1 1 53 ASP HA H 9.173 9.090 -2.393 1.00 . A A . 53 ASP HA 1 1 8 13920 1 1 53 ASP HB2 H 10.006 10.145 -0.080 1.00 . A A . 53 ASP HB2 1 1 8 13921 1 1 53 ASP HB3 H 11.409 10.602 -1.025 1.00 . A A . 53 ASP HB3 1 1 8 13922 1 1 53 ASP N N 10.272 7.911 -1.154 1.00 . A A . 53 ASP N 1 1 8 13923 1 1 53 ASP O O 12.257 9.848 -2.892 1.00 . A A . 53 ASP O 1 1 8 13924 1 1 53 ASP OD1 O 9.120 11.557 -2.742 1.00 . A A . 53 ASP OD1 1 1 8 13925 1 1 53 ASP OD2 O 9.540 12.586 -0.812 1.00 . A A . 53 ASP OD2 1 1 8 13926 1 1 54 SER C C 11.435 8.712 -6.410 1.00 . A A . 54 SER C 1 1 8 13927 1 1 54 SER CA C 12.043 8.184 -5.109 1.00 . A A . 54 SER CA 1 1 8 13928 1 1 54 SER CB C 12.510 6.739 -5.290 1.00 . A A . 54 SER CB 1 1 8 13929 1 1 54 SER H H 10.274 7.700 -4.121 1.00 . A A . 54 SER H 1 1 8 13930 1 1 54 SER HA H 12.887 8.802 -4.802 1.00 . A A . 54 SER HA 1 1 8 13931 1 1 54 SER HB2 H 13.361 6.715 -5.971 1.00 . A A . 54 SER HB2 1 1 8 13932 1 1 54 SER HB3 H 12.856 6.347 -4.333 1.00 . A A . 54 SER HB3 1 1 8 13933 1 1 54 SER HG H 10.769 5.770 -5.101 1.00 . A A . 54 SER HG 1 1 8 13934 1 1 54 SER N N 11.076 8.290 -4.029 1.00 . A A . 54 SER N 1 1 8 13935 1 1 54 SER O O 12.134 9.303 -7.231 1.00 . A A . 54 SER O 1 1 8 13936 1 1 54 SER OG O 11.474 5.903 -5.798 1.00 . A A . 54 SER OG 1 1 8 13937 1 1 55 MET C C 9.976 8.242 -8.998 1.00 . A A . 55 MET C 1 1 8 13938 1 1 55 MET CA C 9.429 8.925 -7.744 1.00 . A A . 55 MET CA 1 1 8 13939 1 1 55 MET CB C 9.570 10.442 -7.885 1.00 . A A . 55 MET CB 1 1 8 13940 1 1 55 MET CE C 7.496 10.325 -5.104 1.00 . A A . 55 MET CE 1 1 8 13941 1 1 55 MET CG C 8.241 11.146 -7.604 1.00 . A A . 55 MET CG 1 1 8 13942 1 1 55 MET H H 9.577 8.000 -5.884 1.00 . A A . 55 MET H 1 1 8 13943 1 1 55 MET HA H 8.389 8.637 -7.589 1.00 . A A . 55 MET HA 1 1 8 13944 1 1 55 MET HB2 H 10.331 10.806 -7.195 1.00 . A A . 55 MET HB2 1 1 8 13945 1 1 55 MET HB3 H 9.909 10.687 -8.891 1.00 . A A . 55 MET HB3 1 1 8 13946 1 1 55 MET HE1 H 7.569 9.454 -5.755 1.00 . A A . 55 MET HE1 1 1 8 13947 1 1 55 MET HE2 H 8.035 10.131 -4.176 1.00 . A A . 55 MET HE2 1 1 8 13948 1 1 55 MET HE3 H 6.448 10.523 -4.880 1.00 . A A . 55 MET HE3 1 1 8 13949 1 1 55 MET HG2 H 8.106 11.977 -8.295 1.00 . A A . 55 MET HG2 1 1 8 13950 1 1 55 MET HG3 H 7.413 10.456 -7.769 1.00 . A A . 55 MET HG3 1 1 8 13951 1 1 55 MET N N 10.139 8.481 -6.556 1.00 . A A . 55 MET N 1 1 8 13952 1 1 55 MET O O 9.994 8.836 -10.075 1.00 . A A . 55 MET O 1 1 8 13953 1 1 55 MET SD S 8.209 11.742 -5.922 1.00 . A A . 55 MET SD 1 1 8 13954 1 1 56 ASP C C 10.062 5.021 -10.185 1.00 . A A . 56 ASP C 1 1 8 13955 1 1 56 ASP CA C 10.957 6.233 -9.921 1.00 . A A . 56 ASP CA 1 1 8 13956 1 1 56 ASP CB C 12.361 5.721 -9.593 1.00 . A A . 56 ASP CB 1 1 8 13957 1 1 56 ASP CG C 13.315 6.772 -9.021 1.00 . A A . 56 ASP CG 1 1 8 13958 1 1 56 ASP H H 10.392 6.528 -7.938 1.00 . A A . 56 ASP H 1 1 8 13959 1 1 56 ASP HA H 10.986 6.923 -10.765 1.00 . A A . 56 ASP HA 1 1 8 13960 1 1 56 ASP HB2 H 12.275 4.903 -8.878 1.00 . A A . 56 ASP HB2 1 1 8 13961 1 1 56 ASP HB3 H 12.802 5.307 -10.500 1.00 . A A . 56 ASP HB3 1 1 8 13962 1 1 56 ASP N N 10.410 7.004 -8.817 1.00 . A A . 56 ASP N 1 1 8 13963 1 1 56 ASP O O 10.461 3.884 -9.937 1.00 . A A . 56 ASP O 1 1 8 13964 1 1 56 ASP OD1 O 13.033 7.971 -9.234 1.00 . A A . 56 ASP OD1 1 1 8 13965 1 1 56 ASP OD2 O 14.305 6.352 -8.383 1.00 . A A . 56 ASP OD2 1 1 8 13966 1 1 57 LYS C C 8.644 3.075 -11.631 1.00 . A A . 57 LYS C 1 1 8 13967 1 1 57 LYS CA C 7.912 4.253 -10.984 1.00 . A A . 57 LYS CA 1 1 8 13968 1 1 57 LYS CB C 6.760 4.800 -11.829 1.00 . A A . 57 LYS CB 1 1 8 13969 1 1 57 LYS CD C 6.408 3.575 -14.006 1.00 . A A . 57 LYS CD 1 1 8 13970 1 1 57 LYS CE C 5.224 3.134 -14.868 1.00 . A A . 57 LYS CE 1 1 8 13971 1 1 57 LYS CG C 6.009 3.667 -12.532 1.00 . A A . 57 LYS CG 1 1 8 13972 1 1 57 LYS H H 8.551 6.233 -10.883 1.00 . A A . 57 LYS H 1 1 8 13973 1 1 57 LYS HA H 7.487 3.918 -10.038 1.00 . A A . 57 LYS HA 1 1 8 13974 1 1 57 LYS HB2 H 6.072 5.359 -11.195 1.00 . A A . 57 LYS HB2 1 1 8 13975 1 1 57 LYS HB3 H 7.148 5.498 -12.571 1.00 . A A . 57 LYS HB3 1 1 8 13976 1 1 57 LYS HD2 H 6.772 4.544 -14.349 1.00 . A A . 57 LYS HD2 1 1 8 13977 1 1 57 LYS HD3 H 7.230 2.868 -14.121 1.00 . A A . 57 LYS HD3 1 1 8 13978 1 1 57 LYS HE2 H 5.545 2.367 -15.573 1.00 . A A . 57 LYS HE2 1 1 8 13979 1 1 57 LYS HE3 H 4.455 2.687 -14.239 1.00 . A A . 57 LYS HE3 1 1 8 13980 1 1 57 LYS HG2 H 6.223 2.721 -12.034 1.00 . A A . 57 LYS HG2 1 1 8 13981 1 1 57 LYS HG3 H 4.935 3.833 -12.452 1.00 . A A . 57 LYS HG3 1 1 8 13982 1 1 57 LYS HZ1 H 3.650 4.323 -15.541 1.00 . A A . 57 LYS HZ1 1 1 8 13983 1 1 57 LYS HZ2 H 5.009 5.172 -15.250 1.00 . A A . 57 LYS HZ2 1 1 8 13984 1 1 57 LYS N N 8.868 5.306 -10.684 1.00 . A A . 57 LYS N 1 1 8 13985 1 1 57 LYS NZ N 4.662 4.288 -15.605 1.00 . A A . 57 LYS NZ 1 1 8 13986 1 1 57 LYS O O 8.505 1.935 -11.189 1.00 . A A . 57 LYS O 1 1 8 13987 1 1 58 LYS C C 11.571 2.284 -12.792 1.00 . A A . 58 LYS C 1 1 8 13988 1 1 58 LYS CA C 10.160 2.372 -13.379 1.00 . A A . 58 LYS CA 1 1 8 13989 1 1 58 LYS CB C 10.137 2.643 -14.885 1.00 . A A . 58 LYS CB 1 1 8 13990 1 1 58 LYS CD C 11.264 2.028 -17.055 1.00 . A A . 58 LYS CD 1 1 8 13991 1 1 58 LYS CE C 10.301 1.461 -18.100 1.00 . A A . 58 LYS CE 1 1 8 13992 1 1 58 LYS CG C 10.890 1.553 -15.650 1.00 . A A . 58 LYS CG 1 1 8 13993 1 1 58 LYS H H 9.515 4.320 -13.020 1.00 . A A . 58 LYS H 1 1 8 13994 1 1 58 LYS HA H 9.658 1.419 -13.215 1.00 . A A . 58 LYS HA 1 1 8 13995 1 1 58 LYS HB2 H 9.105 2.690 -15.233 1.00 . A A . 58 LYS HB2 1 1 8 13996 1 1 58 LYS HB3 H 10.587 3.614 -15.090 1.00 . A A . 58 LYS HB3 1 1 8 13997 1 1 58 LYS HD2 H 11.245 3.117 -17.092 1.00 . A A . 58 LYS HD2 1 1 8 13998 1 1 58 LYS HD3 H 12.283 1.719 -17.288 1.00 . A A . 58 LYS HD3 1 1 8 13999 1 1 58 LYS HE2 H 9.733 0.635 -17.670 1.00 . A A . 58 LYS HE2 1 1 8 14000 1 1 58 LYS HE3 H 9.581 2.225 -18.392 1.00 . A A . 58 LYS HE3 1 1 8 14001 1 1 58 LYS HG2 H 11.792 1.277 -15.103 1.00 . A A . 58 LYS HG2 1 1 8 14002 1 1 58 LYS HG3 H 10.272 0.658 -15.717 1.00 . A A . 58 LYS HG3 1 1 8 14003 1 1 58 LYS HZ1 H 11.205 1.738 -19.957 1.00 . A A . 58 LYS HZ1 1 1 8 14004 1 1 58 LYS HZ2 H 11.955 0.617 -19.045 1.00 . A A . 58 LYS HZ2 1 1 8 14005 1 1 58 LYS N N 9.407 3.390 -12.667 1.00 . A A . 58 LYS N 1 1 8 14006 1 1 58 LYS NZ N 11.045 0.991 -19.290 1.00 . A A . 58 LYS NZ 1 1 8 14007 1 1 58 LYS O O 12.495 2.926 -13.289 1.00 . A A . 58 LYS O 1 1 8 14008 1 1 59 ASP C C 12.942 0.013 -10.262 1.00 . A A . 59 ASP C 1 1 8 14009 1 1 59 ASP CA C 12.974 1.303 -11.084 1.00 . A A . 59 ASP CA 1 1 8 14010 1 1 59 ASP CB C 13.271 2.463 -10.132 1.00 . A A . 59 ASP CB 1 1 8 14011 1 1 59 ASP CG C 14.458 2.240 -9.193 1.00 . A A . 59 ASP CG 1 1 8 14012 1 1 59 ASP H H 10.935 0.964 -11.346 1.00 . A A . 59 ASP H 1 1 8 14013 1 1 59 ASP HA H 13.708 1.266 -11.889 1.00 . A A . 59 ASP HA 1 1 8 14014 1 1 59 ASP HB2 H 13.459 3.359 -10.724 1.00 . A A . 59 ASP HB2 1 1 8 14015 1 1 59 ASP HB3 H 12.383 2.657 -9.531 1.00 . A A . 59 ASP HB3 1 1 8 14016 1 1 59 ASP N N 11.692 1.483 -11.744 1.00 . A A . 59 ASP N 1 1 8 14017 1 1 59 ASP O O 13.742 -0.893 -10.491 1.00 . A A . 59 ASP O 1 1 8 14018 1 1 59 ASP OD1 O 15.483 1.721 -9.686 1.00 . A A . 59 ASP OD1 1 1 8 14019 1 1 59 ASP OD2 O 14.314 2.594 -8.003 1.00 . A A . 59 ASP OD2 1 1 8 14020 1 1 60 LYS C C 13.138 -1.375 -7.636 1.00 . A A . 60 LYS C 1 1 8 14021 1 1 60 LYS CA C 11.864 -1.193 -8.464 1.00 . A A . 60 LYS CA 1 1 8 14022 1 1 60 LYS CB C 11.487 -2.424 -9.291 1.00 . A A . 60 LYS CB 1 1 8 14023 1 1 60 LYS CD C 10.030 -3.136 -11.222 1.00 . A A . 60 LYS CD 1 1 8 14024 1 1 60 LYS CE C 10.521 -2.432 -12.489 1.00 . A A . 60 LYS CE 1 1 8 14025 1 1 60 LYS CG C 10.149 -2.218 -10.004 1.00 . A A . 60 LYS CG 1 1 8 14026 1 1 60 LYS H H 11.363 0.711 -9.142 1.00 . A A . 60 LYS H 1 1 8 14027 1 1 60 LYS HA H 11.035 -0.996 -7.784 1.00 . A A . 60 LYS HA 1 1 8 14028 1 1 60 LYS HB2 H 12.267 -2.627 -10.025 1.00 . A A . 60 LYS HB2 1 1 8 14029 1 1 60 LYS HB3 H 11.426 -3.298 -8.642 1.00 . A A . 60 LYS HB3 1 1 8 14030 1 1 60 LYS HD2 H 10.612 -4.042 -11.057 1.00 . A A . 60 LYS HD2 1 1 8 14031 1 1 60 LYS HD3 H 8.992 -3.442 -11.351 1.00 . A A . 60 LYS HD3 1 1 8 14032 1 1 60 LYS HE2 H 9.714 -1.837 -12.918 1.00 . A A . 60 LYS HE2 1 1 8 14033 1 1 60 LYS HE3 H 11.327 -1.742 -12.240 1.00 . A A . 60 LYS HE3 1 1 8 14034 1 1 60 LYS HG2 H 9.330 -2.416 -9.313 1.00 . A A . 60 LYS HG2 1 1 8 14035 1 1 60 LYS HG3 H 10.057 -1.178 -10.317 1.00 . A A . 60 LYS HG3 1 1 8 14036 1 1 60 LYS HZ1 H 12.005 -3.516 -13.471 1.00 . A A . 60 LYS HZ1 1 1 8 14037 1 1 60 LYS HZ2 H 10.614 -4.345 -13.309 1.00 . A A . 60 LYS HZ2 1 1 8 14038 1 1 60 LYS N N 12.010 -0.030 -9.322 1.00 . A A . 60 LYS N 1 1 8 14039 1 1 60 LYS NZ N 10.996 -3.422 -13.481 1.00 . A A . 60 LYS NZ 1 1 8 14040 1 1 60 LYS O O 14.243 -1.346 -8.177 1.00 . A A . 60 LYS O 1 1 8 14041 1 1 61 SER C C 13.575 -1.686 -3.982 1.00 . A A . 61 SER C 1 1 8 14042 1 1 61 SER CA C 14.061 -1.742 -5.431 1.00 . A A . 61 SER CA 1 1 8 14043 1 1 61 SER CB C 15.143 -0.687 -5.669 1.00 . A A . 61 SER CB 1 1 8 14044 1 1 61 SER H H 12.040 -1.578 -5.907 1.00 . A A . 61 SER H 1 1 8 14045 1 1 61 SER HA H 14.460 -2.730 -5.663 1.00 . A A . 61 SER HA 1 1 8 14046 1 1 61 SER HB2 H 14.847 -0.044 -6.498 1.00 . A A . 61 SER HB2 1 1 8 14047 1 1 61 SER HB3 H 15.230 -0.052 -4.788 1.00 . A A . 61 SER HB3 1 1 8 14048 1 1 61 SER HG H 17.143 -0.639 -5.721 1.00 . A A . 61 SER HG 1 1 8 14049 1 1 61 SER N N 12.941 -1.556 -6.339 1.00 . A A . 61 SER N 1 1 8 14050 1 1 61 SER O O 13.620 -2.687 -3.269 1.00 . A A . 61 SER O 1 1 8 14051 1 1 61 SER OG O 16.409 -1.276 -5.956 1.00 . A A . 61 SER OG 1 1 8 14052 1 1 62 ALA C C 12.095 1.123 -2.099 1.00 . A A . 62 ALA C 1 1 8 14053 1 1 62 ALA CA C 12.626 -0.305 -2.237 1.00 . A A . 62 ALA CA 1 1 8 14054 1 1 62 ALA CB C 13.741 -0.612 -1.235 1.00 . A A . 62 ALA CB 1 1 8 14055 1 1 62 ALA H H 13.087 0.305 -4.175 1.00 . A A . 62 ALA H 1 1 8 14056 1 1 62 ALA HA H 11.807 -1.006 -2.076 1.00 . A A . 62 ALA HA 1 1 8 14057 1 1 62 ALA HB1 H 14.358 -1.426 -1.616 1.00 . A A . 62 ALA HB1 1 1 8 14058 1 1 62 ALA HB2 H 14.358 0.276 -1.094 1.00 . A A . 62 ALA HB2 1 1 8 14059 1 1 62 ALA HB3 H 13.302 -0.905 -0.282 1.00 . A A . 62 ALA HB3 1 1 8 14060 1 1 62 ALA N N 13.120 -0.505 -3.589 1.00 . A A . 62 ALA N 1 1 8 14061 1 1 62 ALA O O 10.969 1.329 -1.650 1.00 . A A . 62 ALA O 1 1 8 14062 1 1 63 LYS C C 11.398 3.742 -3.377 1.00 . A A . 63 LYS C 1 1 8 14063 1 1 63 LYS CA C 12.560 3.475 -2.418 1.00 . A A . 63 LYS CA 1 1 8 14064 1 1 63 LYS CB C 13.779 4.366 -2.667 1.00 . A A . 63 LYS CB 1 1 8 14065 1 1 63 LYS CD C 15.533 5.477 -1.234 1.00 . A A . 63 LYS CD 1 1 8 14066 1 1 63 LYS CE C 15.959 5.500 0.235 1.00 . A A . 63 LYS CE 1 1 8 14067 1 1 63 LYS CG C 14.840 4.158 -1.584 1.00 . A A . 63 LYS CG 1 1 8 14068 1 1 63 LYS H H 13.846 1.896 -2.857 1.00 . A A . 63 LYS H 1 1 8 14069 1 1 63 LYS HA H 12.221 3.669 -1.401 1.00 . A A . 63 LYS HA 1 1 8 14070 1 1 63 LYS HB2 H 14.204 4.143 -3.645 1.00 . A A . 63 LYS HB2 1 1 8 14071 1 1 63 LYS HB3 H 13.472 5.412 -2.684 1.00 . A A . 63 LYS HB3 1 1 8 14072 1 1 63 LYS HD2 H 16.406 5.613 -1.872 1.00 . A A . 63 LYS HD2 1 1 8 14073 1 1 63 LYS HD3 H 14.859 6.310 -1.435 1.00 . A A . 63 LYS HD3 1 1 8 14074 1 1 63 LYS HE2 H 15.906 4.494 0.651 1.00 . A A . 63 LYS HE2 1 1 8 14075 1 1 63 LYS HE3 H 16.997 5.823 0.314 1.00 . A A . 63 LYS HE3 1 1 8 14076 1 1 63 LYS HG2 H 14.376 3.739 -0.691 1.00 . A A . 63 LYS HG2 1 1 8 14077 1 1 63 LYS HG3 H 15.579 3.435 -1.928 1.00 . A A . 63 LYS HG3 1 1 8 14078 1 1 63 LYS HZ1 H 15.270 7.385 0.796 1.00 . A A . 63 LYS HZ1 1 1 8 14079 1 1 63 LYS HZ2 H 14.106 6.247 0.828 1.00 . A A . 63 LYS HZ2 1 1 8 14080 1 1 63 LYS N N 12.931 2.072 -2.493 1.00 . A A . 63 LYS N 1 1 8 14081 1 1 63 LYS NZ N 15.089 6.411 1.012 1.00 . A A . 63 LYS NZ 1 1 8 14082 1 1 63 LYS O O 10.721 4.763 -3.267 1.00 . A A . 63 LYS O 1 1 8 14083 1 1 64 GLY C C 8.763 2.883 -4.593 1.00 . A A . 64 GLY C 1 1 8 14084 1 1 64 GLY CA C 10.134 2.929 -5.271 1.00 . A A . 64 GLY CA 1 1 8 14085 1 1 64 GLY H H 11.757 1.979 -4.376 1.00 . A A . 64 GLY H 1 1 8 14086 1 1 64 GLY HA2 H 10.241 3.865 -5.818 1.00 . A A . 64 GLY HA2 1 1 8 14087 1 1 64 GLY HA3 H 10.210 2.123 -6.001 1.00 . A A . 64 GLY HA3 1 1 8 14088 1 1 64 GLY N N 11.202 2.807 -4.294 1.00 . A A . 64 GLY N 1 1 8 14089 1 1 64 GLY O O 8.213 1.806 -4.368 1.00 . A A . 64 GLY O 1 1 8 14090 1 1 65 TYR C C 5.885 3.406 -4.419 1.00 . A A . 65 TYR C 1 1 8 14091 1 1 65 TYR CA C 6.954 4.174 -3.639 1.00 . A A . 65 TYR CA 1 1 8 14092 1 1 65 TYR CB C 6.602 5.663 -3.646 1.00 . A A . 65 TYR CB 1 1 8 14093 1 1 65 TYR CD1 C 4.846 5.883 -1.850 1.00 . A A . 65 TYR CD1 1 1 8 14094 1 1 65 TYR CD2 C 4.215 6.325 -4.113 1.00 . A A . 65 TYR CD2 1 1 8 14095 1 1 65 TYR CE1 C 3.502 6.169 -1.419 1.00 . A A . 65 TYR CE1 1 1 8 14096 1 1 65 TYR CE2 C 2.871 6.611 -3.682 1.00 . A A . 65 TYR CE2 1 1 8 14097 1 1 65 TYR CG C 5.174 5.967 -3.188 1.00 . A A . 65 TYR CG 1 1 8 14098 1 1 65 TYR CZ C 2.581 6.520 -2.357 1.00 . A A . 65 TYR CZ 1 1 8 14099 1 1 65 TYR H H 8.703 4.937 -4.474 1.00 . A A . 65 TYR H 1 1 8 14100 1 1 65 TYR HA H 7.041 3.747 -2.640 1.00 . A A . 65 TYR HA 1 1 8 14101 1 1 65 TYR HB2 H 7.301 6.194 -2.999 1.00 . A A . 65 TYR HB2 1 1 8 14102 1 1 65 TYR HB3 H 6.741 6.054 -4.654 1.00 . A A . 65 TYR HB3 1 1 8 14103 1 1 65 TYR HD1 H 5.604 5.600 -1.120 1.00 . A A . 65 TYR HD1 1 1 8 14104 1 1 65 TYR HD2 H 4.474 6.391 -5.170 1.00 . A A . 65 TYR HD2 1 1 8 14105 1 1 65 TYR HE1 H 3.229 6.107 -0.366 1.00 . A A . 65 TYR HE1 1 1 8 14106 1 1 65 TYR HE2 H 2.103 6.896 -4.402 1.00 . A A . 65 TYR HE2 1 1 8 14107 1 1 65 TYR HH H 1.318 7.532 -1.280 1.00 . A A . 65 TYR HH 1 1 8 14108 1 1 65 TYR N N 8.250 4.065 -4.287 1.00 . A A . 65 TYR N 1 1 8 14109 1 1 65 TYR O O 5.025 2.757 -3.826 1.00 . A A . 65 TYR O 1 1 8 14110 1 1 65 TYR OH O 1.311 6.790 -1.950 1.00 . A A . 65 TYR OH 1 1 8 14111 1 1 66 TYR C C 5.401 1.357 -6.786 1.00 . A A . 66 TYR C 1 1 8 14112 1 1 66 TYR CA C 5.025 2.829 -6.604 1.00 . A A . 66 TYR CA 1 1 8 14113 1 1 66 TYR CB C 5.112 3.536 -7.958 1.00 . A A . 66 TYR CB 1 1 8 14114 1 1 66 TYR CD1 C 5.469 1.735 -9.686 1.00 . A A . 66 TYR CD1 1 1 8 14115 1 1 66 TYR CD2 C 3.365 2.869 -9.650 1.00 . A A . 66 TYR CD2 1 1 8 14116 1 1 66 TYR CE1 C 5.018 0.935 -10.796 1.00 . A A . 66 TYR CE1 1 1 8 14117 1 1 66 TYR CE2 C 2.914 2.069 -10.759 1.00 . A A . 66 TYR CE2 1 1 8 14118 1 1 66 TYR CG C 4.633 2.685 -9.137 1.00 . A A . 66 TYR CG 1 1 8 14119 1 1 66 TYR CZ C 3.763 1.141 -11.277 1.00 . A A . 66 TYR CZ 1 1 8 14120 1 1 66 TYR H H 6.677 4.035 -6.212 1.00 . A A . 66 TYR H 1 1 8 14121 1 1 66 TYR HA H 4.041 2.890 -6.139 1.00 . A A . 66 TYR HA 1 1 8 14122 1 1 66 TYR HB2 H 4.519 4.450 -7.918 1.00 . A A . 66 TYR HB2 1 1 8 14123 1 1 66 TYR HB3 H 6.145 3.834 -8.135 1.00 . A A . 66 TYR HB3 1 1 8 14124 1 1 66 TYR HD1 H 6.470 1.590 -9.281 1.00 . A A . 66 TYR HD1 1 1 8 14125 1 1 66 TYR HD2 H 2.705 3.620 -9.215 1.00 . A A . 66 TYR HD2 1 1 8 14126 1 1 66 TYR HE1 H 5.668 0.181 -11.239 1.00 . A A . 66 TYR HE1 1 1 8 14127 1 1 66 TYR HE2 H 1.915 2.203 -11.173 1.00 . A A . 66 TYR HE2 1 1 8 14128 1 1 66 TYR HH H 3.290 0.944 -13.152 1.00 . A A . 66 TYR HH 1 1 8 14129 1 1 66 TYR N N 5.974 3.505 -5.737 1.00 . A A . 66 TYR N 1 1 8 14130 1 1 66 TYR O O 4.724 0.623 -7.505 1.00 . A A . 66 TYR O 1 1 8 14131 1 1 66 TYR OH O 3.337 0.385 -12.324 1.00 . A A . 66 TYR OH 1 1 8 14132 1 1 67 HIS C C 6.512 -1.172 -4.956 1.00 . A A . 67 HIS C 1 1 8 14133 1 1 67 HIS CA C 6.954 -0.403 -6.202 1.00 . A A . 67 HIS CA 1 1 8 14134 1 1 67 HIS CB C 8.469 -0.442 -6.417 1.00 . A A . 67 HIS CB 1 1 8 14135 1 1 67 HIS CD2 C 9.568 -1.751 -4.439 1.00 . A A . 67 HIS CD2 1 1 8 14136 1 1 67 HIS CE1 C 10.080 -3.581 -5.524 1.00 . A A . 67 HIS CE1 1 1 8 14137 1 1 67 HIS CG C 9.157 -1.598 -5.731 1.00 . A A . 67 HIS CG 1 1 8 14138 1 1 67 HIS H H 7.025 1.571 -5.540 1.00 . A A . 67 HIS H 1 1 8 14139 1 1 67 HIS HA H 6.483 -0.846 -7.079 1.00 . A A . 67 HIS HA 1 1 8 14140 1 1 67 HIS HB2 H 8.672 -0.494 -7.486 1.00 . A A . 67 HIS HB2 1 1 8 14141 1 1 67 HIS HB3 H 8.901 0.491 -6.055 1.00 . A A . 67 HIS HB3 1 1 8 14142 1 1 67 HIS HD1 H 9.324 -2.964 -7.356 1.00 . A A . 67 HIS HD1 1 1 8 14143 1 1 67 HIS HD2 H 9.457 -1.014 -3.644 1.00 . A A . 67 HIS HD2 1 1 8 14144 1 1 67 HIS HE1 H 10.460 -4.580 -5.740 1.00 . A A . 67 HIS HE1 1 1 8 14145 1 1 67 HIS N N 6.480 0.968 -6.122 1.00 . A A . 67 HIS N 1 1 8 14146 1 1 67 HIS ND1 N 9.494 -2.767 -6.390 1.00 . A A . 67 HIS ND1 1 1 8 14147 1 1 67 HIS NE2 N 10.124 -2.950 -4.316 1.00 . A A . 67 HIS NE2 1 1 8 14148 1 1 67 HIS O O 6.402 -2.397 -4.984 1.00 . A A . 67 HIS O 1 1 8 14149 1 1 68 VAL C C 4.316 -0.993 -2.559 1.00 . A A . 68 VAL C 1 1 8 14150 1 1 68 VAL CA C 5.844 -1.017 -2.636 1.00 . A A . 68 VAL CA 1 1 8 14151 1 1 68 VAL CB C 6.513 -0.301 -1.462 1.00 . A A . 68 VAL CB 1 1 8 14152 1 1 68 VAL CG1 C 7.960 -0.767 -1.287 1.00 . A A . 68 VAL CG1 1 1 8 14153 1 1 68 VAL CG2 C 6.443 1.218 -1.634 1.00 . A A . 68 VAL CG2 1 1 8 14154 1 1 68 VAL H H 6.363 0.574 -3.876 1.00 . A A . 68 VAL H 1 1 8 14155 1 1 68 VAL HA H 6.179 -2.055 -2.634 1.00 . A A . 68 VAL HA 1 1 8 14156 1 1 68 VAL HB H 5.966 -0.560 -0.555 1.00 . A A . 68 VAL HB 1 1 8 14157 1 1 68 VAL HG11 H 8.019 -1.841 -1.465 1.00 . A A . 68 VAL HG11 1 1 8 14158 1 1 68 VAL HG12 H 8.598 -0.244 -2.000 1.00 . A A . 68 VAL HG12 1 1 8 14159 1 1 68 VAL HG13 H 8.292 -0.548 -0.273 1.00 . A A . 68 VAL HG13 1 1 8 14160 1 1 68 VAL HG21 H 5.490 1.489 -2.088 1.00 . A A . 68 VAL HG21 1 1 8 14161 1 1 68 VAL HG22 H 6.532 1.699 -0.660 1.00 . A A . 68 VAL HG22 1 1 8 14162 1 1 68 VAL HG23 H 7.259 1.548 -2.278 1.00 . A A . 68 VAL HG23 1 1 8 14163 1 1 68 VAL N N 6.271 -0.421 -3.891 1.00 . A A . 68 VAL N 1 1 8 14164 1 1 68 VAL O O 3.738 -1.302 -1.518 1.00 . A A . 68 VAL O 1 1 8 14165 1 1 69 MET C C 1.711 -1.530 -4.793 1.00 . A A . 69 MET C 1 1 8 14166 1 1 69 MET CA C 2.255 -0.555 -3.747 1.00 . A A . 69 MET CA 1 1 8 14167 1 1 69 MET CB C 1.829 0.870 -4.107 1.00 . A A . 69 MET CB 1 1 8 14168 1 1 69 MET CE C 2.742 2.265 -0.479 1.00 . A A . 69 MET CE 1 1 8 14169 1 1 69 MET CG C 2.488 1.891 -3.176 1.00 . A A . 69 MET CG 1 1 8 14170 1 1 69 MET H H 4.182 -0.375 -4.518 1.00 . A A . 69 MET H 1 1 8 14171 1 1 69 MET HA H 1.899 -0.838 -2.756 1.00 . A A . 69 MET HA 1 1 8 14172 1 1 69 MET HB2 H 2.101 1.085 -5.140 1.00 . A A . 69 MET HB2 1 1 8 14173 1 1 69 MET HB3 H 0.744 0.957 -4.038 1.00 . A A . 69 MET HB3 1 1 8 14174 1 1 69 MET HE1 H 3.705 2.444 -0.956 1.00 . A A . 69 MET HE1 1 1 8 14175 1 1 69 MET HE2 H 2.510 3.092 0.193 1.00 . A A . 69 MET HE2 1 1 8 14176 1 1 69 MET HE3 H 2.784 1.336 0.089 1.00 . A A . 69 MET HE3 1 1 8 14177 1 1 69 MET HG2 H 3.477 1.541 -2.881 1.00 . A A . 69 MET HG2 1 1 8 14178 1 1 69 MET HG3 H 2.628 2.836 -3.701 1.00 . A A . 69 MET HG3 1 1 8 14179 1 1 69 MET N N 3.705 -0.624 -3.675 1.00 . A A . 69 MET N 1 1 8 14180 1 1 69 MET O O 0.509 -1.785 -4.844 1.00 . A A . 69 MET O 1 1 8 14181 1 1 69 MET SD S 1.473 2.141 -1.729 1.00 . A A . 69 MET SD 1 1 8 14182 1 1 70 HIS C C 3.223 -4.171 -6.642 1.00 . A A . 70 HIS C 1 1 8 14183 1 1 70 HIS CA C 2.250 -2.991 -6.644 1.00 . A A . 70 HIS CA 1 1 8 14184 1 1 70 HIS CB C 2.168 -2.292 -8.003 1.00 . A A . 70 HIS CB 1 1 8 14185 1 1 70 HIS CD2 C 0.204 -0.606 -8.368 1.00 . A A . 70 HIS CD2 1 1 8 14186 1 1 70 HIS CE1 C 1.181 1.185 -7.578 1.00 . A A . 70 HIS CE1 1 1 8 14187 1 1 70 HIS CG C 1.459 -0.959 -7.967 1.00 . A A . 70 HIS CG 1 1 8 14188 1 1 70 HIS H H 3.599 -1.837 -5.554 1.00 . A A . 70 HIS H 1 1 8 14189 1 1 70 HIS HA H 1.252 -3.352 -6.396 1.00 . A A . 70 HIS HA 1 1 8 14190 1 1 70 HIS HB2 H 3.178 -2.145 -8.386 1.00 . A A . 70 HIS HB2 1 1 8 14191 1 1 70 HIS HB3 H 1.653 -2.947 -8.706 1.00 . A A . 70 HIS HB3 1 1 8 14192 1 1 70 HIS HD1 H 2.977 0.260 -7.103 1.00 . A A . 70 HIS HD1 1 1 8 14193 1 1 70 HIS HD2 H -0.536 -1.274 -8.808 1.00 . A A . 70 HIS HD2 1 1 8 14194 1 1 70 HIS HE1 H 1.350 2.218 -7.274 1.00 . A A . 70 HIS HE1 1 1 8 14195 1 1 70 HIS N N 2.623 -2.049 -5.602 1.00 . A A . 70 HIS N 1 1 8 14196 1 1 70 HIS ND1 N 2.051 0.191 -7.474 1.00 . A A . 70 HIS ND1 1 1 8 14197 1 1 70 HIS NE2 N 0.038 0.689 -8.132 1.00 . A A . 70 HIS NE2 1 1 8 14198 1 1 70 HIS O O 2.823 -5.309 -6.398 1.00 . A A . 70 HIS O 1 1 8 14199 1 1 71 ASP C C 5.255 -5.899 -5.837 1.00 . A A . 71 ASP C 1 1 8 14200 1 1 71 ASP CA C 5.514 -4.881 -6.950 1.00 . A A . 71 ASP CA 1 1 8 14201 1 1 71 ASP CB C 6.898 -4.272 -6.721 1.00 . A A . 71 ASP CB 1 1 8 14202 1 1 71 ASP CG C 8.030 -4.917 -7.524 1.00 . A A . 71 ASP CG 1 1 8 14203 1 1 71 ASP H H 4.797 -2.932 -7.114 1.00 . A A . 71 ASP H 1 1 8 14204 1 1 71 ASP HA H 5.447 -5.325 -7.944 1.00 . A A . 71 ASP HA 1 1 8 14205 1 1 71 ASP HB2 H 6.857 -3.211 -6.967 1.00 . A A . 71 ASP HB2 1 1 8 14206 1 1 71 ASP HB3 H 7.140 -4.344 -5.660 1.00 . A A . 71 ASP HB3 1 1 8 14207 1 1 71 ASP N N 4.481 -3.860 -6.917 1.00 . A A . 71 ASP N 1 1 8 14208 1 1 71 ASP O O 5.235 -5.544 -4.659 1.00 . A A . 71 ASP O 1 1 8 14209 1 1 71 ASP OD1 O 8.568 -5.932 -7.032 1.00 . A A . 71 ASP OD1 1 1 8 14210 1 1 71 ASP OD2 O 8.331 -4.380 -8.612 1.00 . A A . 71 ASP OD2 1 1 8 14211 1 1 72 LYS C C 6.136 -8.839 -4.872 1.00 . A A . 72 LYS C 1 1 8 14212 1 1 72 LYS CA C 4.807 -8.214 -5.301 1.00 . A A . 72 LYS CA 1 1 8 14213 1 1 72 LYS CB C 3.815 -9.221 -5.887 1.00 . A A . 72 LYS CB 1 1 8 14214 1 1 72 LYS CD C 2.549 -8.541 -7.959 1.00 . A A . 72 LYS CD 1 1 8 14215 1 1 72 LYS CE C 2.123 -7.185 -8.525 1.00 . A A . 72 LYS CE 1 1 8 14216 1 1 72 LYS CG C 2.571 -8.514 -6.429 1.00 . A A . 72 LYS CG 1 1 8 14217 1 1 72 LYS H H 5.082 -7.424 -7.209 1.00 . A A . 72 LYS H 1 1 8 14218 1 1 72 LYS HA H 4.335 -7.769 -4.425 1.00 . A A . 72 LYS HA 1 1 8 14219 1 1 72 LYS HB2 H 4.293 -9.787 -6.686 1.00 . A A . 72 LYS HB2 1 1 8 14220 1 1 72 LYS HB3 H 3.523 -9.939 -5.119 1.00 . A A . 72 LYS HB3 1 1 8 14221 1 1 72 LYS HD2 H 3.537 -8.802 -8.336 1.00 . A A . 72 LYS HD2 1 1 8 14222 1 1 72 LYS HD3 H 1.862 -9.314 -8.302 1.00 . A A . 72 LYS HD3 1 1 8 14223 1 1 72 LYS HE2 H 1.295 -6.783 -7.940 1.00 . A A . 72 LYS HE2 1 1 8 14224 1 1 72 LYS HE3 H 2.946 -6.474 -8.441 1.00 . A A . 72 LYS HE3 1 1 8 14225 1 1 72 LYS HG2 H 1.675 -8.996 -6.040 1.00 . A A . 72 LYS HG2 1 1 8 14226 1 1 72 LYS HG3 H 2.554 -7.481 -6.080 1.00 . A A . 72 LYS HG3 1 1 8 14227 1 1 72 LYS HZ1 H 0.915 -7.927 -10.052 1.00 . A A . 72 LYS HZ1 1 1 8 14228 1 1 72 LYS HZ2 H 1.467 -6.425 -10.352 1.00 . A A . 72 LYS HZ2 1 1 8 14229 1 1 72 LYS N N 5.064 -7.143 -6.249 1.00 . A A . 72 LYS N 1 1 8 14230 1 1 72 LYS NZ N 1.718 -7.318 -9.942 1.00 . A A . 72 LYS NZ 1 1 8 14231 1 1 72 LYS O O 6.240 -9.397 -3.780 1.00 . A A . 72 LYS O 1 1 8 14232 1 1 73 ASN C C 9.200 -8.317 -4.560 1.00 . A A . 73 ASN C 1 1 8 14233 1 1 73 ASN CA C 8.436 -9.272 -5.479 1.00 . A A . 73 ASN CA 1 1 8 14234 1 1 73 ASN CB C 9.245 -9.435 -6.768 1.00 . A A . 73 ASN CB 1 1 8 14235 1 1 73 ASN CG C 8.669 -10.554 -7.638 1.00 . A A . 73 ASN CG 1 1 8 14236 1 1 73 ASN H H 7.026 -8.270 -6.638 1.00 . A A . 73 ASN H 1 1 8 14237 1 1 73 ASN HA H 8.253 -10.241 -5.014 1.00 . A A . 73 ASN HA 1 1 8 14238 1 1 73 ASN HB2 H 9.240 -8.498 -7.324 1.00 . A A . 73 ASN HB2 1 1 8 14239 1 1 73 ASN HB3 H 10.284 -9.656 -6.525 1.00 . A A . 73 ASN HB3 1 1 8 14240 1 1 73 ASN HD21 H 10.101 -11.789 -6.914 1.00 . A A . 73 ASN HD21 1 1 8 14241 1 1 73 ASN HD22 H 9.014 -12.504 -8.057 1.00 . A A . 73 ASN HD22 1 1 8 14242 1 1 73 ASN N N 7.119 -8.725 -5.753 1.00 . A A . 73 ASN N 1 1 8 14243 1 1 73 ASN ND2 N 9.315 -11.711 -7.527 1.00 . A A . 73 ASN ND2 1 1 8 14244 1 1 73 ASN O O 10.146 -7.660 -4.990 1.00 . A A . 73 ASN O 1 1 8 14245 1 1 73 ASN OD1 O 7.704 -10.378 -8.363 1.00 . A A . 73 ASN OD1 1 1 8 14246 1 1 74 THR C C 9.645 -8.172 -1.029 1.00 . A A . 74 THR C 1 1 8 14247 1 1 74 THR CA C 9.389 -7.405 -2.327 1.00 . A A . 74 THR CA 1 1 8 14248 1 1 74 THR CB C 8.499 -6.175 -2.141 1.00 . A A . 74 THR CB 1 1 8 14249 1 1 74 THR CG2 C 8.274 -5.411 -3.447 1.00 . A A . 74 THR CG2 1 1 8 14250 1 1 74 THR H H 7.989 -8.807 -2.969 1.00 . A A . 74 THR H 1 1 8 14251 1 1 74 THR HA H 10.360 -7.096 -2.713 1.00 . A A . 74 THR HA 1 1 8 14252 1 1 74 THR HB H 8.900 -5.518 -1.369 1.00 . A A . 74 THR HB 1 1 8 14253 1 1 74 THR HG1 H 6.858 -7.215 -2.620 1.00 . A A . 74 THR HG1 1 1 8 14254 1 1 74 THR HG21 H 9.041 -5.691 -4.169 1.00 . A A . 74 THR HG21 1 1 8 14255 1 1 74 THR HG22 H 7.291 -5.657 -3.848 1.00 . A A . 74 THR HG22 1 1 8 14256 1 1 74 THR HG23 H 8.330 -4.339 -3.255 1.00 . A A . 74 THR HG23 1 1 8 14257 1 1 74 THR N N 8.759 -8.270 -3.311 1.00 . A A . 74 THR N 1 1 8 14258 1 1 74 THR O O 9.012 -9.196 -0.773 1.00 . A A . 74 THR O 1 1 8 14259 1 1 74 THR OG1 O 7.218 -6.717 -1.831 1.00 . A A . 74 THR OG1 1 1 8 14260 1 1 75 LYS C C 9.722 -8.201 1.968 1.00 . A A . 75 LYS C 1 1 8 14261 1 1 75 LYS CA C 10.923 -8.272 1.022 1.00 . A A . 75 LYS CA 1 1 8 14262 1 1 75 LYS CB C 12.195 -7.645 1.596 1.00 . A A . 75 LYS CB 1 1 8 14263 1 1 75 LYS CD C 14.056 -8.123 3.230 1.00 . A A . 75 LYS CD 1 1 8 14264 1 1 75 LYS CE C 14.283 -7.349 4.529 1.00 . A A . 75 LYS CE 1 1 8 14265 1 1 75 LYS CG C 12.562 -8.281 2.939 1.00 . A A . 75 LYS CG 1 1 8 14266 1 1 75 LYS H H 11.085 -6.816 -0.459 1.00 . A A . 75 LYS H 1 1 8 14267 1 1 75 LYS HA H 11.143 -9.320 0.821 1.00 . A A . 75 LYS HA 1 1 8 14268 1 1 75 LYS HB2 H 13.018 -7.773 0.892 1.00 . A A . 75 LYS HB2 1 1 8 14269 1 1 75 LYS HB3 H 12.051 -6.573 1.725 1.00 . A A . 75 LYS HB3 1 1 8 14270 1 1 75 LYS HD2 H 14.521 -9.106 3.302 1.00 . A A . 75 LYS HD2 1 1 8 14271 1 1 75 LYS HD3 H 14.538 -7.603 2.403 1.00 . A A . 75 LYS HD3 1 1 8 14272 1 1 75 LYS HE2 H 13.447 -6.671 4.706 1.00 . A A . 75 LYS HE2 1 1 8 14273 1 1 75 LYS HE3 H 14.316 -8.040 5.371 1.00 . A A . 75 LYS HE3 1 1 8 14274 1 1 75 LYS HG2 H 11.982 -7.816 3.736 1.00 . A A . 75 LYS HG2 1 1 8 14275 1 1 75 LYS HG3 H 12.299 -9.339 2.928 1.00 . A A . 75 LYS HG3 1 1 8 14276 1 1 75 LYS HZ1 H 16.185 -6.832 5.207 1.00 . A A . 75 LYS HZ1 1 1 8 14277 1 1 75 LYS HZ2 H 16.038 -6.734 3.588 1.00 . A A . 75 LYS HZ2 1 1 8 14278 1 1 75 LYS N N 10.575 -7.649 -0.243 1.00 . A A . 75 LYS N 1 1 8 14279 1 1 75 LYS NZ N 15.546 -6.580 4.461 1.00 . A A . 75 LYS NZ 1 1 8 14280 1 1 75 LYS O O 9.589 -9.026 2.870 1.00 . A A . 75 LYS O 1 1 8 14281 1 1 76 PHE C C 6.421 -7.143 1.709 1.00 . A A . 76 PHE C 1 1 8 14282 1 1 76 PHE CA C 7.694 -7.018 2.549 1.00 . A A . 76 PHE CA 1 1 8 14283 1 1 76 PHE CB C 7.788 -5.595 3.103 1.00 . A A . 76 PHE CB 1 1 8 14284 1 1 76 PHE CD1 C 9.010 -6.076 5.255 1.00 . A A . 76 PHE CD1 1 1 8 14285 1 1 76 PHE CD2 C 9.959 -4.485 3.744 1.00 . A A . 76 PHE CD2 1 1 8 14286 1 1 76 PHE CE1 C 10.111 -5.872 6.161 1.00 . A A . 76 PHE CE1 1 1 8 14287 1 1 76 PHE CE2 C 11.060 -4.281 4.650 1.00 . A A . 76 PHE CE2 1 1 8 14288 1 1 76 PHE CG C 8.957 -5.379 4.066 1.00 . A A . 76 PHE CG 1 1 8 14289 1 1 76 PHE CZ C 11.081 -4.985 5.814 1.00 . A A . 76 PHE CZ 1 1 8 14290 1 1 76 PHE H H 8.995 -6.541 0.993 1.00 . A A . 76 PHE H 1 1 8 14291 1 1 76 PHE HA H 7.690 -7.791 3.318 1.00 . A A . 76 PHE HA 1 1 8 14292 1 1 76 PHE HB2 H 7.881 -4.898 2.271 1.00 . A A . 76 PHE HB2 1 1 8 14293 1 1 76 PHE HB3 H 6.858 -5.355 3.618 1.00 . A A . 76 PHE HB3 1 1 8 14294 1 1 76 PHE HD1 H 8.219 -6.782 5.509 1.00 . A A . 76 PHE HD1 1 1 8 14295 1 1 76 PHE HD2 H 9.917 -3.934 2.805 1.00 . A A . 76 PHE HD2 1 1 8 14296 1 1 76 PHE HE1 H 10.165 -6.416 7.104 1.00 . A A . 76 PHE HE1 1 1 8 14297 1 1 76 PHE HE2 H 11.857 -3.579 4.409 1.00 . A A . 76 PHE HE2 1 1 8 14298 1 1 76 PHE HZ H 11.902 -4.913 6.572 1.00 . A A . 76 PHE HZ 1 1 8 14299 1 1 76 PHE N N 8.879 -7.208 1.729 1.00 . A A . 76 PHE N 1 1 8 14300 1 1 76 PHE O O 6.453 -6.952 0.494 1.00 . A A . 76 PHE O 1 1 8 14301 1 1 77 LYS C C 3.632 -6.272 1.116 1.00 . A A . 77 LYS C 1 1 8 14302 1 1 77 LYS CA C 4.049 -7.614 1.722 1.00 . A A . 77 LYS CA 1 1 8 14303 1 1 77 LYS CB C 3.012 -8.205 2.679 1.00 . A A . 77 LYS CB 1 1 8 14304 1 1 77 LYS CD C 2.373 -10.260 3.993 1.00 . A A . 77 LYS CD 1 1 8 14305 1 1 77 LYS CE C 2.688 -11.736 4.248 1.00 . A A . 77 LYS CE 1 1 8 14306 1 1 77 LYS CG C 3.203 -9.716 2.829 1.00 . A A . 77 LYS CG 1 1 8 14307 1 1 77 LYS H H 5.312 -7.614 3.378 1.00 . A A . 77 LYS H 1 1 8 14308 1 1 77 LYS HA H 4.186 -8.331 0.912 1.00 . A A . 77 LYS HA 1 1 8 14309 1 1 77 LYS HB2 H 3.097 -7.726 3.655 1.00 . A A . 77 LYS HB2 1 1 8 14310 1 1 77 LYS HB3 H 2.009 -7.996 2.309 1.00 . A A . 77 LYS HB3 1 1 8 14311 1 1 77 LYS HD2 H 2.579 -9.680 4.893 1.00 . A A . 77 LYS HD2 1 1 8 14312 1 1 77 LYS HD3 H 1.312 -10.144 3.775 1.00 . A A . 77 LYS HD3 1 1 8 14313 1 1 77 LYS HE2 H 3.240 -12.147 3.403 1.00 . A A . 77 LYS HE2 1 1 8 14314 1 1 77 LYS HE3 H 3.329 -11.831 5.124 1.00 . A A . 77 LYS HE3 1 1 8 14315 1 1 77 LYS HG2 H 2.911 -10.216 1.905 1.00 . A A . 77 LYS HG2 1 1 8 14316 1 1 77 LYS HG3 H 4.257 -9.939 2.993 1.00 . A A . 77 LYS HG3 1 1 8 14317 1 1 77 LYS HZ1 H 0.962 -12.231 5.306 1.00 . A A . 77 LYS HZ1 1 1 8 14318 1 1 77 LYS HZ2 H 0.783 -12.372 3.693 1.00 . A A . 77 LYS HZ2 1 1 8 14319 1 1 77 LYS N N 5.330 -7.461 2.390 1.00 . A A . 77 LYS N 1 1 8 14320 1 1 77 LYS NZ N 1.440 -12.504 4.454 1.00 . A A . 77 LYS NZ 1 1 8 14321 1 1 77 LYS O O 3.600 -5.257 1.809 1.00 . A A . 77 LYS O 1 1 8 14322 1 1 78 SER C C 1.383 -5.062 -0.977 1.00 . A A . 78 SER C 1 1 8 14323 1 1 78 SER CA C 2.908 -5.111 -0.879 1.00 . A A . 78 SER CA 1 1 8 14324 1 1 78 SER CB C 3.533 -5.052 -2.275 1.00 . A A . 78 SER CB 1 1 8 14325 1 1 78 SER H H 3.350 -7.142 -0.729 1.00 . A A . 78 SER H 1 1 8 14326 1 1 78 SER HA H 3.280 -4.281 -0.280 1.00 . A A . 78 SER HA 1 1 8 14327 1 1 78 SER HB2 H 3.636 -4.011 -2.582 1.00 . A A . 78 SER HB2 1 1 8 14328 1 1 78 SER HB3 H 4.536 -5.476 -2.241 1.00 . A A . 78 SER HB3 1 1 8 14329 1 1 78 SER HG H 3.158 -5.652 -4.147 1.00 . A A . 78 SER HG 1 1 8 14330 1 1 78 SER N N 3.322 -6.312 -0.172 1.00 . A A . 78 SER N 1 1 8 14331 1 1 78 SER O O 0.713 -6.082 -0.822 1.00 . A A . 78 SER O 1 1 8 14332 1 1 78 SER OG O 2.753 -5.755 -3.238 1.00 . A A . 78 SER OG 1 1 8 14333 1 1 79 CYS C C -1.117 -4.759 -2.270 1.00 . A A . 79 CYS C 1 1 8 14334 1 1 79 CYS CA C -0.558 -3.668 -1.355 1.00 . A A . 79 CYS CA 1 1 8 14335 1 1 79 CYS CB C -0.896 -2.266 -1.865 1.00 . A A . 79 CYS CB 1 1 8 14336 1 1 79 CYS H H 1.428 -3.039 -1.359 1.00 . A A . 79 CYS H 1 1 8 14337 1 1 79 CYS HA H -0.971 -3.756 -0.350 1.00 . A A . 79 CYS HA 1 1 8 14338 1 1 79 CYS HB2 H -0.551 -2.177 -2.895 1.00 . A A . 79 CYS HB2 1 1 8 14339 1 1 79 CYS HB3 H -1.980 -2.152 -1.882 1.00 . A A . 79 CYS HB3 1 1 8 14340 1 1 79 CYS N N 0.877 -3.864 -1.234 1.00 . A A . 79 CYS N 1 1 8 14341 1 1 79 CYS O O -1.867 -5.625 -1.823 1.00 . A A . 79 CYS O 1 1 8 14342 1 1 79 CYS SG S -0.178 -0.898 -0.885 1.00 . A A . 79 CYS SG 1 1 8 14343 1 1 80 VAL C C -0.654 -7.037 -4.141 1.00 . A A . 80 VAL C 1 1 8 14344 1 1 80 VAL CA C -1.183 -5.652 -4.517 1.00 . A A . 80 VAL CA 1 1 8 14345 1 1 80 VAL CB C -0.761 -5.212 -5.920 1.00 . A A . 80 VAL CB 1 1 8 14346 1 1 80 VAL CG1 C -1.092 -6.289 -6.955 1.00 . A A . 80 VAL CG1 1 1 8 14347 1 1 80 VAL CG2 C -1.408 -3.876 -6.293 1.00 . A A . 80 VAL CG2 1 1 8 14348 1 1 80 VAL H H -0.118 -3.974 -3.890 1.00 . A A . 80 VAL H 1 1 8 14349 1 1 80 VAL HA H -2.272 -5.671 -4.482 1.00 . A A . 80 VAL HA 1 1 8 14350 1 1 80 VAL HB H 0.319 -5.070 -5.917 1.00 . A A . 80 VAL HB 1 1 8 14351 1 1 80 VAL HG11 H -2.139 -6.576 -6.859 1.00 . A A . 80 VAL HG11 1 1 8 14352 1 1 80 VAL HG12 H -0.913 -5.898 -7.957 1.00 . A A . 80 VAL HG12 1 1 8 14353 1 1 80 VAL HG13 H -0.459 -7.160 -6.787 1.00 . A A . 80 VAL HG13 1 1 8 14354 1 1 80 VAL HG21 H -2.270 -3.698 -5.650 1.00 . A A . 80 VAL HG21 1 1 8 14355 1 1 80 VAL HG22 H -0.684 -3.072 -6.162 1.00 . A A . 80 VAL HG22 1 1 8 14356 1 1 80 VAL HG23 H -1.732 -3.907 -7.334 1.00 . A A . 80 VAL HG23 1 1 8 14357 1 1 80 VAL N N -0.729 -4.682 -3.535 1.00 . A A . 80 VAL N 1 1 8 14358 1 1 80 VAL O O -1.332 -8.042 -4.350 1.00 . A A . 80 VAL O 1 1 8 14359 1 1 81 GLY C C 0.256 -9.100 -2.273 1.00 . A A . 81 GLY C 1 1 8 14360 1 1 81 GLY CA C 1.181 -8.292 -3.187 1.00 . A A . 81 GLY CA 1 1 8 14361 1 1 81 GLY H H 1.097 -6.224 -3.427 1.00 . A A . 81 GLY H 1 1 8 14362 1 1 81 GLY HA2 H 1.432 -8.881 -4.068 1.00 . A A . 81 GLY HA2 1 1 8 14363 1 1 81 GLY HA3 H 2.115 -8.080 -2.668 1.00 . A A . 81 GLY HA3 1 1 8 14364 1 1 81 GLY N N 0.553 -7.046 -3.593 1.00 . A A . 81 GLY N 1 1 8 14365 1 1 81 GLY O O -0.097 -10.235 -2.589 1.00 . A A . 81 GLY O 1 1 8 14366 1 1 82 CYS C C -2.339 -9.373 -0.870 1.00 . A A . 82 CYS C 1 1 8 14367 1 1 82 CYS CA C -0.986 -9.130 -0.199 1.00 . A A . 82 CYS CA 1 1 8 14368 1 1 82 CYS CB C -1.125 -8.307 1.084 1.00 . A A . 82 CYS CB 1 1 8 14369 1 1 82 CYS H H 0.181 -7.558 -0.911 1.00 . A A . 82 CYS H 1 1 8 14370 1 1 82 CYS HA H -0.512 -10.074 0.071 1.00 . A A . 82 CYS HA 1 1 8 14371 1 1 82 CYS HB2 H -0.140 -8.104 1.504 1.00 . A A . 82 CYS HB2 1 1 8 14372 1 1 82 CYS HB3 H -1.581 -7.343 0.860 1.00 . A A . 82 CYS HB3 1 1 8 14373 1 1 82 CYS N N -0.110 -8.482 -1.160 1.00 . A A . 82 CYS N 1 1 8 14374 1 1 82 CYS O O -2.916 -10.451 -0.739 1.00 . A A . 82 CYS O 1 1 8 14375 1 1 82 CYS SG S -2.148 -9.213 2.301 1.00 . A A . 82 CYS SG 1 1 8 14376 1 1 83 HIS C C -4.095 -9.683 -3.159 1.00 . A A . 83 HIS C 1 1 8 14377 1 1 83 HIS CA C -4.082 -8.441 -2.265 1.00 . A A . 83 HIS CA 1 1 8 14378 1 1 83 HIS CB C -4.373 -7.152 -3.036 1.00 . A A . 83 HIS CB 1 1 8 14379 1 1 83 HIS CD2 C -4.760 -5.780 -0.845 1.00 . A A . 83 HIS CD2 1 1 8 14380 1 1 83 HIS CE1 C -6.003 -4.189 -1.690 1.00 . A A . 83 HIS CE1 1 1 8 14381 1 1 83 HIS CG C -4.907 -6.031 -2.178 1.00 . A A . 83 HIS CG 1 1 8 14382 1 1 83 HIS H H -2.331 -7.478 -1.675 1.00 . A A . 83 HIS H 1 1 8 14383 1 1 83 HIS HA H -4.847 -8.549 -1.497 1.00 . A A . 83 HIS HA 1 1 8 14384 1 1 83 HIS HB2 H -3.457 -6.818 -3.524 1.00 . A A . 83 HIS HB2 1 1 8 14385 1 1 83 HIS HB3 H -5.093 -7.368 -3.825 1.00 . A A . 83 HIS HB3 1 1 8 14386 1 1 83 HIS HD1 H -5.985 -4.912 -3.635 1.00 . A A . 83 HIS HD1 1 1 8 14387 1 1 83 HIS HD2 H -4.194 -6.390 -0.141 1.00 . A A . 83 HIS HD2 1 1 8 14388 1 1 83 HIS HE1 H -6.613 -3.289 -1.768 1.00 . A A . 83 HIS HE1 1 1 8 14389 1 1 83 HIS N N -2.807 -8.352 -1.574 1.00 . A A . 83 HIS N 1 1 8 14390 1 1 83 HIS ND1 N -5.696 -5.011 -2.683 1.00 . A A . 83 HIS ND1 1 1 8 14391 1 1 83 HIS NE2 N -5.421 -4.667 -0.552 1.00 . A A . 83 HIS NE2 1 1 8 14392 1 1 83 HIS O O -5.078 -10.421 -3.188 1.00 . A A . 83 HIS O 1 1 8 14393 1 1 84 VAL C C -3.080 -12.304 -3.968 1.00 . A A . 84 VAL C 1 1 8 14394 1 1 84 VAL CA C -2.863 -11.014 -4.760 1.00 . A A . 84 VAL CA 1 1 8 14395 1 1 84 VAL CB C -1.511 -10.970 -5.474 1.00 . A A . 84 VAL CB 1 1 8 14396 1 1 84 VAL CG1 C -1.291 -12.232 -6.310 1.00 . A A . 84 VAL CG1 1 1 8 14397 1 1 84 VAL CG2 C -1.386 -9.712 -6.336 1.00 . A A . 84 VAL CG2 1 1 8 14398 1 1 84 VAL H H -2.196 -9.269 -3.838 1.00 . A A . 84 VAL H 1 1 8 14399 1 1 84 VAL HA H -3.646 -10.929 -5.515 1.00 . A A . 84 VAL HA 1 1 8 14400 1 1 84 VAL HB H -0.731 -10.933 -4.712 1.00 . A A . 84 VAL HB 1 1 8 14401 1 1 84 VAL HG11 H -1.326 -13.108 -5.662 1.00 . A A . 84 VAL HG11 1 1 8 14402 1 1 84 VAL HG12 H -2.073 -12.308 -7.066 1.00 . A A . 84 VAL HG12 1 1 8 14403 1 1 84 VAL HG13 H -0.318 -12.180 -6.798 1.00 . A A . 84 VAL HG13 1 1 8 14404 1 1 84 VAL HG21 H -2.215 -9.039 -6.119 1.00 . A A . 84 VAL HG21 1 1 8 14405 1 1 84 VAL HG22 H -0.444 -9.211 -6.113 1.00 . A A . 84 VAL HG22 1 1 8 14406 1 1 84 VAL HG23 H -1.409 -9.990 -7.390 1.00 . A A . 84 VAL HG23 1 1 8 14407 1 1 84 VAL N N -2.991 -9.874 -3.867 1.00 . A A . 84 VAL N 1 1 8 14408 1 1 84 VAL O O -3.679 -13.253 -4.471 1.00 . A A . 84 VAL O 1 1 8 14409 1 1 85 GLU C C -4.145 -13.567 -1.348 1.00 . A A . 85 GLU C 1 1 8 14410 1 1 85 GLU CA C -2.712 -13.457 -1.873 1.00 . A A . 85 GLU CA 1 1 8 14411 1 1 85 GLU CB C -1.708 -13.395 -0.720 1.00 . A A . 85 GLU CB 1 1 8 14412 1 1 85 GLU CD C -0.351 -15.383 0.034 1.00 . A A . 85 GLU CD 1 1 8 14413 1 1 85 GLU CG C -0.488 -14.271 -1.009 1.00 . A A . 85 GLU CG 1 1 8 14414 1 1 85 GLU H H -2.095 -11.522 -2.338 1.00 . A A . 85 GLU H 1 1 8 14415 1 1 85 GLU HA H -2.482 -14.317 -2.502 1.00 . A A . 85 GLU HA 1 1 8 14416 1 1 85 GLU HB2 H -1.391 -12.364 -0.564 1.00 . A A . 85 GLU HB2 1 1 8 14417 1 1 85 GLU HB3 H -2.187 -13.725 0.202 1.00 . A A . 85 GLU HB3 1 1 8 14418 1 1 85 GLU HG2 H -0.577 -14.710 -2.003 1.00 . A A . 85 GLU HG2 1 1 8 14419 1 1 85 GLU HG3 H 0.413 -13.658 -1.011 1.00 . A A . 85 GLU HG3 1 1 8 14420 1 1 85 GLU N N -2.581 -12.298 -2.740 1.00 . A A . 85 GLU N 1 1 8 14421 1 1 85 GLU O O -4.655 -14.669 -1.151 1.00 . A A . 85 GLU O 1 1 8 14422 1 1 85 GLU OE1 O -1.058 -16.402 -0.127 1.00 . A A . 85 GLU OE1 1 1 8 14423 1 1 85 GLU OE2 O 0.456 -15.189 0.968 1.00 . A A . 85 GLU OE2 1 1 8 14424 1 1 86 VAL C C -7.082 -12.738 -1.762 1.00 . A A . 86 VAL C 1 1 8 14425 1 1 86 VAL CA C -6.117 -12.362 -0.635 1.00 . A A . 86 VAL CA 1 1 8 14426 1 1 86 VAL CB C -6.407 -10.985 -0.035 1.00 . A A . 86 VAL CB 1 1 8 14427 1 1 86 VAL CG1 C -7.846 -10.902 0.477 1.00 . A A . 86 VAL CG1 1 1 8 14428 1 1 86 VAL CG2 C -5.410 -10.651 1.076 1.00 . A A . 86 VAL CG2 1 1 8 14429 1 1 86 VAL H H -4.332 -11.517 -1.298 1.00 . A A . 86 VAL H 1 1 8 14430 1 1 86 VAL HA H -6.202 -13.102 0.161 1.00 . A A . 86 VAL HA 1 1 8 14431 1 1 86 VAL HB H -6.289 -10.243 -0.825 1.00 . A A . 86 VAL HB 1 1 8 14432 1 1 86 VAL HG11 H -8.502 -11.462 -0.190 1.00 . A A . 86 VAL HG11 1 1 8 14433 1 1 86 VAL HG12 H -7.900 -11.326 1.480 1.00 . A A . 86 VAL HG12 1 1 8 14434 1 1 86 VAL HG13 H -8.162 -9.859 0.506 1.00 . A A . 86 VAL HG13 1 1 8 14435 1 1 86 VAL HG21 H -4.858 -11.549 1.352 1.00 . A A . 86 VAL HG21 1 1 8 14436 1 1 86 VAL HG22 H -4.713 -9.891 0.722 1.00 . A A . 86 VAL HG22 1 1 8 14437 1 1 86 VAL HG23 H -5.948 -10.273 1.946 1.00 . A A . 86 VAL HG23 1 1 8 14438 1 1 86 VAL N N -4.754 -12.410 -1.135 1.00 . A A . 86 VAL N 1 1 8 14439 1 1 86 VAL O O -7.886 -13.657 -1.614 1.00 . A A . 86 VAL O 1 1 8 14440 1 1 87 ALA C C -7.509 -13.635 -4.589 1.00 . A A . 87 ALA C 1 1 8 14441 1 1 87 ALA CA C -7.822 -12.253 -4.013 1.00 . A A . 87 ALA CA 1 1 8 14442 1 1 87 ALA CB C -7.627 -11.136 -5.040 1.00 . A A . 87 ALA CB 1 1 8 14443 1 1 87 ALA H H -6.312 -11.263 -2.974 1.00 . A A . 87 ALA H 1 1 8 14444 1 1 87 ALA HA H -8.856 -12.238 -3.669 1.00 . A A . 87 ALA HA 1 1 8 14445 1 1 87 ALA HB1 H -7.378 -10.208 -4.524 1.00 . A A . 87 ALA HB1 1 1 8 14446 1 1 87 ALA HB2 H -6.818 -11.403 -5.719 1.00 . A A . 87 ALA HB2 1 1 8 14447 1 1 87 ALA HB3 H -8.548 -11.000 -5.608 1.00 . A A . 87 ALA HB3 1 1 8 14448 1 1 87 ALA N N -6.970 -12.008 -2.862 1.00 . A A . 87 ALA N 1 1 8 14449 1 1 87 ALA O O -8.414 -14.360 -5.001 1.00 . A A . 87 ALA O 1 1 8 14450 1 1 88 GLY C C -6.583 -15.639 -6.360 1.00 . A A . 88 GLY C 1 1 8 14451 1 1 88 GLY CA C -5.781 -15.242 -5.119 1.00 . A A . 88 GLY CA 1 1 8 14452 1 1 88 GLY H H -5.495 -13.365 -4.262 1.00 . A A . 88 GLY H 1 1 8 14453 1 1 88 GLY HA2 H -4.721 -15.191 -5.367 1.00 . A A . 88 GLY HA2 1 1 8 14454 1 1 88 GLY HA3 H -5.891 -16.008 -4.350 1.00 . A A . 88 GLY HA3 1 1 8 14455 1 1 88 GLY N N -6.224 -13.960 -4.600 1.00 . A A . 88 GLY N 1 1 8 14456 1 1 88 GLY O O -6.583 -14.920 -7.359 1.00 . A A . 88 GLY O 1 1 8 14457 1 1 89 ALA C C -9.528 -17.258 -6.958 1.00 . A A . 89 ALA C 1 1 8 14458 1 1 89 ALA CA C -8.051 -17.281 -7.358 1.00 . A A . 89 ALA CA 1 1 8 14459 1 1 89 ALA CB C -7.573 -18.683 -7.744 1.00 . A A . 89 ALA CB 1 1 8 14460 1 1 89 ALA H H -7.241 -17.358 -5.440 1.00 . A A . 89 ALA H 1 1 8 14461 1 1 89 ALA HA H -7.903 -16.614 -8.207 1.00 . A A . 89 ALA HA 1 1 8 14462 1 1 89 ALA HB1 H -7.141 -19.172 -6.871 1.00 . A A . 89 ALA HB1 1 1 8 14463 1 1 89 ALA HB2 H -8.418 -19.267 -8.107 1.00 . A A . 89 ALA HB2 1 1 8 14464 1 1 89 ALA HB3 H -6.820 -18.607 -8.528 1.00 . A A . 89 ALA HB3 1 1 8 14465 1 1 89 ALA N N -7.247 -16.781 -6.256 1.00 . A A . 89 ALA N 1 1 8 14466 1 1 89 ALA O O -10.181 -18.299 -6.924 1.00 . A A . 89 ALA O 1 1 8 14467 1 1 90 ASP C C -12.148 -15.136 -7.368 1.00 . A A . 90 ASP C 1 1 8 14468 1 1 90 ASP CA C -11.397 -15.887 -6.267 1.00 . A A . 90 ASP CA 1 1 8 14469 1 1 90 ASP CB C -11.503 -15.069 -4.979 1.00 . A A . 90 ASP CB 1 1 8 14470 1 1 90 ASP CG C -12.741 -15.361 -4.128 1.00 . A A . 90 ASP CG 1 1 8 14471 1 1 90 ASP H H -9.471 -15.217 -6.695 1.00 . A A . 90 ASP H 1 1 8 14472 1 1 90 ASP HA H -11.779 -16.897 -6.116 1.00 . A A . 90 ASP HA 1 1 8 14473 1 1 90 ASP HB2 H -10.614 -15.252 -4.376 1.00 . A A . 90 ASP HB2 1 1 8 14474 1 1 90 ASP HB3 H -11.500 -14.010 -5.238 1.00 . A A . 90 ASP HB3 1 1 8 14475 1 1 90 ASP N N -10.010 -16.059 -6.665 1.00 . A A . 90 ASP N 1 1 8 14476 1 1 90 ASP O O -13.377 -15.156 -7.410 1.00 . A A . 90 ASP O 1 1 8 14477 1 1 90 ASP OD1 O -13.835 -14.931 -4.551 1.00 . A A . 90 ASP OD1 1 1 8 14478 1 1 90 ASP OD2 O -12.564 -16.008 -3.073 1.00 . A A . 90 ASP OD2 1 1 8 14479 1 1 91 ALA C C -12.834 -12.616 -8.766 1.00 . A A . 91 ALA C 1 1 8 14480 1 1 91 ALA CA C -11.956 -13.734 -9.330 1.00 . A A . 91 ALA CA 1 1 8 14481 1 1 91 ALA CB C -12.733 -14.679 -10.248 1.00 . A A . 91 ALA CB 1 1 8 14482 1 1 91 ALA H H -10.379 -14.480 -8.191 1.00 . A A . 91 ALA H 1 1 8 14483 1 1 91 ALA HA H -11.136 -13.291 -9.895 1.00 . A A . 91 ALA HA 1 1 8 14484 1 1 91 ALA HB1 H -12.474 -15.711 -10.011 1.00 . A A . 91 ALA HB1 1 1 8 14485 1 1 91 ALA HB2 H -13.803 -14.531 -10.101 1.00 . A A . 91 ALA HB2 1 1 8 14486 1 1 91 ALA HB3 H -12.477 -14.469 -11.286 1.00 . A A . 91 ALA HB3 1 1 8 14487 1 1 91 ALA N N -11.378 -14.491 -8.232 1.00 . A A . 91 ALA N 1 1 8 14488 1 1 91 ALA O O -13.456 -12.779 -7.717 1.00 . A A . 91 ALA O 1 1 8 14489 1 1 92 ALA C C -12.852 -9.535 -8.057 1.00 . A A . 92 ALA C 1 1 8 14490 1 1 92 ALA CA C -13.649 -10.359 -9.071 1.00 . A A . 92 ALA CA 1 1 8 14491 1 1 92 ALA CB C -14.987 -10.840 -8.508 1.00 . A A . 92 ALA CB 1 1 8 14492 1 1 92 ALA H H -12.349 -11.380 -10.339 1.00 . A A . 92 ALA H 1 1 8 14493 1 1 92 ALA HA H -13.838 -9.749 -9.954 1.00 . A A . 92 ALA HA 1 1 8 14494 1 1 92 ALA HB1 H -15.267 -11.779 -8.987 1.00 . A A . 92 ALA HB1 1 1 8 14495 1 1 92 ALA HB2 H -14.895 -10.995 -7.433 1.00 . A A . 92 ALA HB2 1 1 8 14496 1 1 92 ALA HB3 H -15.754 -10.091 -8.703 1.00 . A A . 92 ALA HB3 1 1 8 14497 1 1 92 ALA N N -12.857 -11.504 -9.487 1.00 . A A . 92 ALA N 1 1 8 14498 1 1 92 ALA O O -12.718 -8.322 -8.207 1.00 . A A . 92 ALA O 1 1 8 14499 1 1 93 LYS C C -10.255 -9.061 -6.609 1.00 . A A . 93 LYS C 1 1 8 14500 1 1 93 LYS CA C -11.566 -9.575 -6.010 1.00 . A A . 93 LYS CA 1 1 8 14501 1 1 93 LYS CB C -11.371 -10.513 -4.817 1.00 . A A . 93 LYS CB 1 1 8 14502 1 1 93 LYS CD C -12.768 -10.156 -2.748 1.00 . A A . 93 LYS CD 1 1 8 14503 1 1 93 LYS CE C -14.046 -10.557 -2.008 1.00 . A A . 93 LYS CE 1 1 8 14504 1 1 93 LYS CG C -12.706 -10.810 -4.129 1.00 . A A . 93 LYS CG 1 1 8 14505 1 1 93 LYS H H -12.459 -11.214 -6.934 1.00 . A A . 93 LYS H 1 1 8 14506 1 1 93 LYS HA H -12.143 -8.720 -5.657 1.00 . A A . 93 LYS HA 1 1 8 14507 1 1 93 LYS HB2 H -10.916 -11.445 -5.152 1.00 . A A . 93 LYS HB2 1 1 8 14508 1 1 93 LYS HB3 H -10.683 -10.061 -4.103 1.00 . A A . 93 LYS HB3 1 1 8 14509 1 1 93 LYS HD2 H -11.897 -10.450 -2.162 1.00 . A A . 93 LYS HD2 1 1 8 14510 1 1 93 LYS HD3 H -12.730 -9.071 -2.853 1.00 . A A . 93 LYS HD3 1 1 8 14511 1 1 93 LYS HE2 H -14.856 -9.878 -2.275 1.00 . A A . 93 LYS HE2 1 1 8 14512 1 1 93 LYS HE3 H -14.353 -11.556 -2.317 1.00 . A A . 93 LYS HE3 1 1 8 14513 1 1 93 LYS HG2 H -13.526 -10.444 -4.747 1.00 . A A . 93 LYS HG2 1 1 8 14514 1 1 93 LYS HG3 H -12.837 -11.887 -4.032 1.00 . A A . 93 LYS HG3 1 1 8 14515 1 1 93 LYS HZ1 H -13.952 -11.443 -0.124 1.00 . A A . 93 LYS HZ1 1 1 8 14516 1 1 93 LYS HZ2 H -12.893 -10.219 -0.306 1.00 . A A . 93 LYS HZ2 1 1 8 14517 1 1 93 LYS N N -12.345 -10.227 -7.048 1.00 . A A . 93 LYS N 1 1 8 14518 1 1 93 LYS NZ N -13.828 -10.528 -0.544 1.00 . A A . 93 LYS NZ 1 1 8 14519 1 1 93 LYS O O -9.847 -7.932 -6.342 1.00 . A A . 93 LYS O 1 1 8 14520 1 1 94 LYS C C -8.608 -8.403 -9.015 1.00 . A A . 94 LYS C 1 1 8 14521 1 1 94 LYS CA C -8.375 -9.563 -8.045 1.00 . A A . 94 LYS CA 1 1 8 14522 1 1 94 LYS CB C -7.741 -10.793 -8.698 1.00 . A A . 94 LYS CB 1 1 8 14523 1 1 94 LYS CD C -5.560 -12.054 -8.805 1.00 . A A . 94 LYS CD 1 1 8 14524 1 1 94 LYS CE C -5.329 -12.471 -10.259 1.00 . A A . 94 LYS CE 1 1 8 14525 1 1 94 LYS CG C -6.216 -10.674 -8.728 1.00 . A A . 94 LYS CG 1 1 8 14526 1 1 94 LYS H H -9.970 -10.833 -7.618 1.00 . A A . 94 LYS H 1 1 8 14527 1 1 94 LYS HA H -7.694 -9.227 -7.263 1.00 . A A . 94 LYS HA 1 1 8 14528 1 1 94 LYS HB2 H -8.029 -11.690 -8.150 1.00 . A A . 94 LYS HB2 1 1 8 14529 1 1 94 LYS HB3 H -8.121 -10.906 -9.714 1.00 . A A . 94 LYS HB3 1 1 8 14530 1 1 94 LYS HD2 H -4.610 -12.040 -8.271 1.00 . A A . 94 LYS HD2 1 1 8 14531 1 1 94 LYS HD3 H -6.193 -12.790 -8.308 1.00 . A A . 94 LYS HD3 1 1 8 14532 1 1 94 LYS HE2 H -6.231 -12.935 -10.658 1.00 . A A . 94 LYS HE2 1 1 8 14533 1 1 94 LYS HE3 H -5.127 -11.590 -10.868 1.00 . A A . 94 LYS HE3 1 1 8 14534 1 1 94 LYS HG2 H -5.911 -10.075 -9.586 1.00 . A A . 94 LYS HG2 1 1 8 14535 1 1 94 LYS HG3 H -5.871 -10.153 -7.835 1.00 . A A . 94 LYS HG3 1 1 8 14536 1 1 94 LYS HZ1 H -4.448 -14.267 -10.844 1.00 . A A . 94 LYS HZ1 1 1 8 14537 1 1 94 LYS HZ2 H -3.405 -13.016 -10.846 1.00 . A A . 94 LYS HZ2 1 1 8 14538 1 1 94 LYS N N -9.631 -9.916 -7.406 1.00 . A A . 94 LYS N 1 1 8 14539 1 1 94 LYS NZ N -4.194 -13.417 -10.352 1.00 . A A . 94 LYS NZ 1 1 8 14540 1 1 94 LYS O O -7.656 -7.810 -9.519 1.00 . A A . 94 LYS O 1 1 8 14541 1 1 95 LYS C C -10.611 -5.795 -9.329 1.00 . A A . 95 LYS C 1 1 8 14542 1 1 95 LYS CA C -10.252 -7.037 -10.148 1.00 . A A . 95 LYS CA 1 1 8 14543 1 1 95 LYS CB C -11.362 -7.490 -11.097 1.00 . A A . 95 LYS CB 1 1 8 14544 1 1 95 LYS CD C -11.796 -7.993 -13.530 1.00 . A A . 95 LYS CD 1 1 8 14545 1 1 95 LYS CE C -10.868 -9.044 -14.142 1.00 . A A . 95 LYS CE 1 1 8 14546 1 1 95 LYS CG C -11.040 -7.103 -12.542 1.00 . A A . 95 LYS CG 1 1 8 14547 1 1 95 LYS H H -10.649 -8.602 -8.832 1.00 . A A . 95 LYS H 1 1 8 14548 1 1 95 LYS HA H -9.379 -6.807 -10.759 1.00 . A A . 95 LYS HA 1 1 8 14549 1 1 95 LYS HB2 H -11.488 -8.571 -11.026 1.00 . A A . 95 LYS HB2 1 1 8 14550 1 1 95 LYS HB3 H -12.308 -7.040 -10.798 1.00 . A A . 95 LYS HB3 1 1 8 14551 1 1 95 LYS HD2 H -12.624 -8.487 -13.021 1.00 . A A . 95 LYS HD2 1 1 8 14552 1 1 95 LYS HD3 H -12.229 -7.380 -14.320 1.00 . A A . 95 LYS HD3 1 1 8 14553 1 1 95 LYS HE2 H -9.911 -9.041 -13.620 1.00 . A A . 95 LYS HE2 1 1 8 14554 1 1 95 LYS HE3 H -11.299 -10.037 -14.014 1.00 . A A . 95 LYS HE3 1 1 8 14555 1 1 95 LYS HG2 H -11.307 -6.059 -12.710 1.00 . A A . 95 LYS HG2 1 1 8 14556 1 1 95 LYS HG3 H -9.968 -7.190 -12.715 1.00 . A A . 95 LYS HG3 1 1 8 14557 1 1 95 LYS HZ1 H -10.540 -9.625 -16.117 1.00 . A A . 95 LYS HZ1 1 1 8 14558 1 1 95 LYS HZ2 H -11.435 -8.271 -15.993 1.00 . A A . 95 LYS HZ2 1 1 8 14559 1 1 95 LYS N N -9.881 -8.115 -9.247 1.00 . A A . 95 LYS N 1 1 8 14560 1 1 95 LYS NZ N -10.655 -8.771 -15.582 1.00 . A A . 95 LYS NZ 1 1 8 14561 1 1 95 LYS O O -10.694 -4.693 -9.870 1.00 . A A . 95 LYS O 1 1 8 14562 1 1 96 ASP C C -10.115 -4.829 -6.033 1.00 . A A . 96 ASP C 1 1 8 14563 1 1 96 ASP CA C -11.165 -4.927 -7.141 1.00 . A A . 96 ASP CA 1 1 8 14564 1 1 96 ASP CB C -12.525 -5.172 -6.483 1.00 . A A . 96 ASP CB 1 1 8 14565 1 1 96 ASP CG C -13.642 -4.231 -6.938 1.00 . A A . 96 ASP CG 1 1 8 14566 1 1 96 ASP H H -10.746 -6.914 -7.607 1.00 . A A . 96 ASP H 1 1 8 14567 1 1 96 ASP HA H -11.195 -4.036 -7.768 1.00 . A A . 96 ASP HA 1 1 8 14568 1 1 96 ASP HB2 H -12.830 -6.199 -6.684 1.00 . A A . 96 ASP HB2 1 1 8 14569 1 1 96 ASP HB3 H -12.410 -5.080 -5.402 1.00 . A A . 96 ASP HB3 1 1 8 14570 1 1 96 ASP N N -10.816 -6.015 -8.039 1.00 . A A . 96 ASP N 1 1 8 14571 1 1 96 ASP O O -10.253 -4.027 -5.110 1.00 . A A . 96 ASP O 1 1 8 14572 1 1 96 ASP OD1 O -13.339 -3.031 -7.110 1.00 . A A . 96 ASP OD1 1 1 8 14573 1 1 96 ASP OD2 O -14.775 -4.734 -7.104 1.00 . A A . 96 ASP OD2 1 1 8 14574 1 1 97 LEU C C -6.680 -5.426 -5.889 1.00 . A A . 97 LEU C 1 1 8 14575 1 1 97 LEU CA C -8.014 -5.672 -5.181 1.00 . A A . 97 LEU CA 1 1 8 14576 1 1 97 LEU CB C -8.049 -6.969 -4.370 1.00 . A A . 97 LEU CB 1 1 8 14577 1 1 97 LEU CD1 C -8.931 -8.233 -2.374 1.00 . A A . 97 LEU CD1 1 1 8 14578 1 1 97 LEU CD2 C -9.474 -5.773 -2.667 1.00 . A A . 97 LEU CD2 1 1 8 14579 1 1 97 LEU CG C -9.200 -7.103 -3.370 1.00 . A A . 97 LEU CG 1 1 8 14580 1 1 97 LEU H H -8.982 -6.305 -6.914 1.00 . A A . 97 LEU H 1 1 8 14581 1 1 97 LEU HA H -8.193 -4.852 -4.486 1.00 . A A . 97 LEU HA 1 1 8 14582 1 1 97 LEU HB2 H -8.097 -7.808 -5.064 1.00 . A A . 97 LEU HB2 1 1 8 14583 1 1 97 LEU HB3 H -7.109 -7.059 -3.825 1.00 . A A . 97 LEU HB3 1 1 8 14584 1 1 97 LEU HD11 H -8.554 -9.106 -2.908 1.00 . A A . 97 LEU HD11 1 1 8 14585 1 1 97 LEU HD12 H -8.191 -7.906 -1.644 1.00 . A A . 97 LEU HD12 1 1 8 14586 1 1 97 LEU HD13 H -9.857 -8.493 -1.861 1.00 . A A . 97 LEU HD13 1 1 8 14587 1 1 97 LEU HD21 H -8.540 -5.222 -2.555 1.00 . A A . 97 LEU HD21 1 1 8 14588 1 1 97 LEU HD22 H -10.173 -5.185 -3.261 1.00 . A A . 97 LEU HD22 1 1 8 14589 1 1 97 LEU HD23 H -9.903 -5.963 -1.683 1.00 . A A . 97 LEU HD23 1 1 8 14590 1 1 97 LEU HG H -10.102 -7.368 -3.921 1.00 . A A . 97 LEU HG 1 1 8 14591 1 1 97 LEU N N -9.087 -5.656 -6.160 1.00 . A A . 97 LEU N 1 1 8 14592 1 1 97 LEU O O -5.879 -4.606 -5.443 1.00 . A A . 97 LEU O 1 1 8 14593 1 1 98 THR C C -5.567 -5.475 -9.149 1.00 . A A . 98 THR C 1 1 8 14594 1 1 98 THR CA C -5.260 -6.021 -7.754 1.00 . A A . 98 THR CA 1 1 8 14595 1 1 98 THR CB C -4.567 -7.385 -7.774 1.00 . A A . 98 THR CB 1 1 8 14596 1 1 98 THR CG2 C -4.654 -8.107 -6.428 1.00 . A A . 98 THR CG2 1 1 8 14597 1 1 98 THR H H -7.140 -6.815 -7.336 1.00 . A A . 98 THR H 1 1 8 14598 1 1 98 THR HA H -4.616 -5.293 -7.260 1.00 . A A . 98 THR HA 1 1 8 14599 1 1 98 THR HB H -3.530 -7.290 -8.099 1.00 . A A . 98 THR HB 1 1 8 14600 1 1 98 THR HG1 H -5.168 -7.953 -9.597 1.00 . A A . 98 THR HG1 1 1 8 14601 1 1 98 THR HG21 H -5.700 -8.216 -6.142 1.00 . A A . 98 THR HG21 1 1 8 14602 1 1 98 THR HG22 H -4.195 -9.092 -6.513 1.00 . A A . 98 THR HG22 1 1 8 14603 1 1 98 THR HG23 H -4.129 -7.526 -5.670 1.00 . A A . 98 THR HG23 1 1 8 14604 1 1 98 THR N N -6.483 -6.151 -6.980 1.00 . A A . 98 THR N 1 1 8 14605 1 1 98 THR O O -4.683 -5.408 -10.002 1.00 . A A . 98 THR O 1 1 8 14606 1 1 98 THR OG1 O -5.376 -8.173 -8.643 1.00 . A A . 98 THR OG1 1 1 8 14607 1 1 99 GLY C C -6.532 -3.250 -10.936 1.00 . A A . 99 GLY C 1 1 8 14608 1 1 99 GLY CA C -7.257 -4.559 -10.617 1.00 . A A . 99 GLY CA 1 1 8 14609 1 1 99 GLY H H -7.535 -5.155 -8.640 1.00 . A A . 99 GLY H 1 1 8 14610 1 1 99 GLY HA2 H -7.066 -5.286 -11.406 1.00 . A A . 99 GLY HA2 1 1 8 14611 1 1 99 GLY HA3 H -8.333 -4.387 -10.596 1.00 . A A . 99 GLY HA3 1 1 8 14612 1 1 99 GLY N N -6.822 -5.097 -9.339 1.00 . A A . 99 GLY N 1 1 8 14613 1 1 99 GLY O O -6.297 -2.434 -10.046 1.00 . A A . 99 GLY O 1 1 8 14614 1 1 100 CYS C C -6.528 -0.767 -12.789 1.00 . A A . 100 CYS C 1 1 8 14615 1 1 100 CYS CA C -5.503 -1.895 -12.655 1.00 . A A . 100 CYS CA 1 1 8 14616 1 1 100 CYS CB C -4.745 -2.136 -13.962 1.00 . A A . 100 CYS CB 1 1 8 14617 1 1 100 CYS H H -6.392 -3.759 -12.925 1.00 . A A . 100 CYS H 1 1 8 14618 1 1 100 CYS HA H -4.764 -1.657 -11.890 1.00 . A A . 100 CYS HA 1 1 8 14619 1 1 100 CYS HB2 H -5.360 -2.759 -14.612 1.00 . A A . 100 CYS HB2 1 1 8 14620 1 1 100 CYS HB3 H -4.611 -1.181 -14.469 1.00 . A A . 100 CYS HB3 1 1 8 14621 1 1 100 CYS N N -6.197 -3.091 -12.208 1.00 . A A . 100 CYS N 1 1 8 14622 1 1 100 CYS O O -6.319 0.331 -12.275 1.00 . A A . 100 CYS O 1 1 8 14623 1 1 100 CYS SG S -3.109 -2.930 -13.764 1.00 . A A . 100 CYS SG 1 1 8 14624 1 1 101 LYS C C -9.998 -0.681 -13.196 1.00 . A A . 101 LYS C 1 1 8 14625 1 1 101 LYS CA C -8.671 -0.101 -13.691 1.00 . A A . 101 LYS CA 1 1 8 14626 1 1 101 LYS CB C -8.704 0.349 -15.153 1.00 . A A . 101 LYS CB 1 1 8 14627 1 1 101 LYS CD C -9.911 1.840 -16.789 1.00 . A A . 101 LYS CD 1 1 8 14628 1 1 101 LYS CE C -8.910 2.787 -17.454 1.00 . A A . 101 LYS CE 1 1 8 14629 1 1 101 LYS CG C -9.555 1.609 -15.319 1.00 . A A . 101 LYS CG 1 1 8 14630 1 1 101 LYS H H -7.776 -1.971 -13.897 1.00 . A A . 101 LYS H 1 1 8 14631 1 1 101 LYS HA H -8.431 0.775 -13.089 1.00 . A A . 101 LYS HA 1 1 8 14632 1 1 101 LYS HB2 H -7.690 0.542 -15.501 1.00 . A A . 101 LYS HB2 1 1 8 14633 1 1 101 LYS HB3 H -9.107 -0.451 -15.774 1.00 . A A . 101 LYS HB3 1 1 8 14634 1 1 101 LYS HD2 H -9.922 0.887 -17.319 1.00 . A A . 101 LYS HD2 1 1 8 14635 1 1 101 LYS HD3 H -10.916 2.257 -16.863 1.00 . A A . 101 LYS HD3 1 1 8 14636 1 1 101 LYS HE2 H -9.251 3.818 -17.349 1.00 . A A . 101 LYS HE2 1 1 8 14637 1 1 101 LYS HE3 H -7.946 2.718 -16.951 1.00 . A A . 101 LYS HE3 1 1 8 14638 1 1 101 LYS HG2 H -10.468 1.516 -14.731 1.00 . A A . 101 LYS HG2 1 1 8 14639 1 1 101 LYS HG3 H -9.013 2.472 -14.933 1.00 . A A . 101 LYS HG3 1 1 8 14640 1 1 101 LYS HZ1 H -8.516 1.479 -19.026 1.00 . A A . 101 LYS HZ1 1 1 8 14641 1 1 101 LYS HZ2 H -9.605 2.626 -19.412 1.00 . A A . 101 LYS HZ2 1 1 8 14642 1 1 101 LYS N N -7.614 -1.076 -13.482 1.00 . A A . 101 LYS N 1 1 8 14643 1 1 101 LYS NZ N -8.754 2.454 -18.887 1.00 . A A . 101 LYS NZ 1 1 8 14644 1 1 101 LYS O O -10.255 -1.874 -13.353 1.00 . A A . 101 LYS O 1 1 8 14645 1 1 102 LYS C C -11.890 -1.149 -10.889 1.00 . A A . 102 LYS C 1 1 8 14646 1 1 102 LYS CA C -12.098 -0.221 -12.088 1.00 . A A . 102 LYS CA 1 1 8 14647 1 1 102 LYS CB C -12.951 -0.835 -13.200 1.00 . A A . 102 LYS CB 1 1 8 14648 1 1 102 LYS CD C -14.304 1.197 -13.834 1.00 . A A . 102 LYS CD 1 1 8 14649 1 1 102 LYS CE C -15.191 1.633 -15.002 1.00 . A A . 102 LYS CE 1 1 8 14650 1 1 102 LYS CG C -13.246 0.192 -14.295 1.00 . A A . 102 LYS CG 1 1 8 14651 1 1 102 LYS H H -10.587 1.158 -12.484 1.00 . A A . 102 LYS H 1 1 8 14652 1 1 102 LYS HA H -12.612 0.677 -11.745 1.00 . A A . 102 LYS HA 1 1 8 14653 1 1 102 LYS HB2 H -12.434 -1.692 -13.630 1.00 . A A . 102 LYS HB2 1 1 8 14654 1 1 102 LYS HB3 H -13.888 -1.205 -12.782 1.00 . A A . 102 LYS HB3 1 1 8 14655 1 1 102 LYS HD2 H -14.919 0.750 -13.053 1.00 . A A . 102 LYS HD2 1 1 8 14656 1 1 102 LYS HD3 H -13.818 2.069 -13.398 1.00 . A A . 102 LYS HD3 1 1 8 14657 1 1 102 LYS HE2 H -14.757 2.506 -15.490 1.00 . A A . 102 LYS HE2 1 1 8 14658 1 1 102 LYS HE3 H -15.236 0.840 -15.748 1.00 . A A . 102 LYS HE3 1 1 8 14659 1 1 102 LYS HG2 H -12.330 0.720 -14.560 1.00 . A A . 102 LYS HG2 1 1 8 14660 1 1 102 LYS HG3 H -13.591 -0.318 -15.194 1.00 . A A . 102 LYS HG3 1 1 8 14661 1 1 102 LYS HZ1 H -16.556 2.287 -13.569 1.00 . A A . 102 LYS HZ1 1 1 8 14662 1 1 102 LYS HZ2 H -16.997 2.670 -15.089 1.00 . A A . 102 LYS HZ2 1 1 8 14663 1 1 102 LYS N N -10.805 0.190 -12.608 1.00 . A A . 102 LYS N 1 1 8 14664 1 1 102 LYS NZ N -16.556 1.951 -14.526 1.00 . A A . 102 LYS NZ 1 1 8 14665 1 1 102 LYS O O -12.500 -2.214 -10.812 1.00 . A A . 102 LYS O 1 1 8 14666 1 1 103 SER C C -11.040 -0.666 -7.541 1.00 . A A . 103 SER C 1 1 8 14667 1 1 103 SER CA C -10.731 -1.488 -8.794 1.00 . A A . 103 SER CA 1 1 8 14668 1 1 103 SER CB C -9.271 -1.944 -8.783 1.00 . A A . 103 SER CB 1 1 8 14669 1 1 103 SER H H -10.536 0.158 -10.055 1.00 . A A . 103 SER H 1 1 8 14670 1 1 103 SER HA H -11.383 -2.360 -8.849 1.00 . A A . 103 SER HA 1 1 8 14671 1 1 103 SER HB2 H -8.979 -2.200 -7.764 1.00 . A A . 103 SER HB2 1 1 8 14672 1 1 103 SER HB3 H -9.169 -2.849 -9.381 1.00 . A A . 103 SER HB3 1 1 8 14673 1 1 103 SER HG H -8.742 -0.033 -9.054 1.00 . A A . 103 SER HG 1 1 8 14674 1 1 103 SER N N -11.027 -0.710 -9.985 1.00 . A A . 103 SER N 1 1 8 14675 1 1 103 SER O O -11.556 0.447 -7.636 1.00 . A A . 103 SER O 1 1 8 14676 1 1 103 SER OG O -8.394 -0.941 -9.289 1.00 . A A . 103 SER OG 1 1 8 14677 1 1 104 LYS C C -9.912 0.530 -4.936 1.00 . A A . 104 LYS C 1 1 8 14678 1 1 104 LYS CA C -10.948 -0.580 -5.126 1.00 . A A . 104 LYS CA 1 1 8 14679 1 1 104 LYS CB C -10.974 -1.598 -3.984 1.00 . A A . 104 LYS CB 1 1 8 14680 1 1 104 LYS CD C -13.435 -1.951 -3.565 1.00 . A A . 104 LYS CD 1 1 8 14681 1 1 104 LYS CE C -14.018 -2.835 -2.460 1.00 . A A . 104 LYS CE 1 1 8 14682 1 1 104 LYS CG C -12.153 -2.561 -4.135 1.00 . A A . 104 LYS CG 1 1 8 14683 1 1 104 LYS H H -10.292 -2.150 -6.327 1.00 . A A . 104 LYS H 1 1 8 14684 1 1 104 LYS HA H -11.937 -0.125 -5.174 1.00 . A A . 104 LYS HA 1 1 8 14685 1 1 104 LYS HB2 H -10.040 -2.160 -3.971 1.00 . A A . 104 LYS HB2 1 1 8 14686 1 1 104 LYS HB3 H -11.044 -1.077 -3.029 1.00 . A A . 104 LYS HB3 1 1 8 14687 1 1 104 LYS HD2 H -13.224 -0.958 -3.168 1.00 . A A . 104 LYS HD2 1 1 8 14688 1 1 104 LYS HD3 H -14.168 -1.827 -4.362 1.00 . A A . 104 LYS HD3 1 1 8 14689 1 1 104 LYS HE2 H -13.701 -3.867 -2.606 1.00 . A A . 104 LYS HE2 1 1 8 14690 1 1 104 LYS HE3 H -13.633 -2.517 -1.491 1.00 . A A . 104 LYS HE3 1 1 8 14691 1 1 104 LYS HG2 H -12.297 -2.802 -5.188 1.00 . A A . 104 LYS HG2 1 1 8 14692 1 1 104 LYS HG3 H -11.931 -3.496 -3.621 1.00 . A A . 104 LYS HG3 1 1 8 14693 1 1 104 LYS HZ1 H -15.895 -3.135 -3.314 1.00 . A A . 104 LYS HZ1 1 1 8 14694 1 1 104 LYS HZ2 H -15.904 -3.278 -1.692 1.00 . A A . 104 LYS HZ2 1 1 8 14695 1 1 104 LYS N N -10.711 -1.245 -6.396 1.00 . A A . 104 LYS N 1 1 8 14696 1 1 104 LYS NZ N -15.496 -2.758 -2.461 1.00 . A A . 104 LYS NZ 1 1 8 14697 1 1 104 LYS O O -10.179 1.525 -4.263 1.00 . A A . 104 LYS O 1 1 8 14698 1 1 105 CYS C C -7.885 2.352 -6.535 1.00 . A A . 105 CYS C 1 1 8 14699 1 1 105 CYS CA C -7.675 1.294 -5.448 1.00 . A A . 105 CYS CA 1 1 8 14700 1 1 105 CYS CB C -6.302 0.629 -5.558 1.00 . A A . 105 CYS CB 1 1 8 14701 1 1 105 CYS H H -8.543 -0.488 -6.089 1.00 . A A . 105 CYS H 1 1 8 14702 1 1 105 CYS HA H -7.741 1.741 -4.456 1.00 . A A . 105 CYS HA 1 1 8 14703 1 1 105 CYS HB2 H -6.155 0.242 -6.567 1.00 . A A . 105 CYS HB2 1 1 8 14704 1 1 105 CYS HB3 H -5.517 1.364 -5.381 1.00 . A A . 105 CYS HB3 1 1 8 14705 1 1 105 CYS N N -8.752 0.324 -5.542 1.00 . A A . 105 CYS N 1 1 8 14706 1 1 105 CYS O O -8.215 3.498 -6.235 1.00 . A A . 105 CYS O 1 1 8 14707 1 1 105 CYS SG S -6.168 -0.733 -4.342 1.00 . A A . 105 CYS SG 1 1 8 14708 1 1 106 HIS C C -9.275 2.714 -9.446 1.00 . A A . 106 HIS C 1 1 8 14709 1 1 106 HIS CA C -7.847 2.824 -8.906 1.00 . A A . 106 HIS CA 1 1 8 14710 1 1 106 HIS CB C -6.787 2.549 -9.974 1.00 . A A . 106 HIS CB 1 1 8 14711 1 1 106 HIS CD2 C -4.314 1.862 -9.476 1.00 . A A . 106 HIS CD2 1 1 8 14712 1 1 106 HIS CE1 C -3.631 3.756 -8.620 1.00 . A A . 106 HIS CE1 1 1 8 14713 1 1 106 HIS CG C -5.367 2.728 -9.490 1.00 . A A . 106 HIS CG 1 1 8 14714 1 1 106 HIS H H -7.416 0.994 -8.009 1.00 . A A . 106 HIS H 1 1 8 14715 1 1 106 HIS HA H -7.687 3.835 -8.531 1.00 . A A . 106 HIS HA 1 1 8 14716 1 1 106 HIS HB2 H -6.909 1.529 -10.338 1.00 . A A . 106 HIS HB2 1 1 8 14717 1 1 106 HIS HB3 H -6.958 3.213 -10.821 1.00 . A A . 106 HIS HB3 1 1 8 14718 1 1 106 HIS HD1 H -5.443 4.747 -8.817 1.00 . A A . 106 HIS HD1 1 1 8 14719 1 1 106 HIS HD2 H -4.331 0.832 -9.834 1.00 . A A . 106 HIS HD2 1 1 8 14720 1 1 106 HIS HE1 H -2.987 4.510 -8.168 1.00 . A A . 106 HIS HE1 1 1 8 14721 1 1 106 HIS N N -7.685 1.928 -7.774 1.00 . A A . 106 HIS N 1 1 8 14722 1 1 106 HIS ND1 N -4.906 3.914 -8.944 1.00 . A A . 106 HIS ND1 1 1 8 14723 1 1 106 HIS NE2 N -3.266 2.484 -8.950 1.00 . A A . 106 HIS NE2 1 1 8 14724 1 1 106 HIS O O -9.827 1.619 -9.533 1.00 . A A . 106 HIS O 1 1 8 14725 1 1 107 GLU C C -11.250 4.852 -11.530 1.00 . A A . 107 GLU C 1 1 8 14726 1 1 107 GLU CA C -11.184 3.912 -10.325 1.00 . A A . 107 GLU CA 1 1 8 14727 1 1 107 GLU CB C -12.180 4.335 -9.244 1.00 . A A . 107 GLU CB 1 1 8 14728 1 1 107 GLU CD C -13.615 3.492 -7.349 1.00 . A A . 107 GLU CD 1 1 8 14729 1 1 107 GLU CG C -12.389 3.216 -8.222 1.00 . A A . 107 GLU CG 1 1 8 14730 1 1 107 GLU H H -9.375 4.752 -9.722 1.00 . A A . 107 GLU H 1 1 8 14731 1 1 107 GLU HA H -11.408 2.893 -10.638 1.00 . A A . 107 GLU HA 1 1 8 14732 1 1 107 GLU HB2 H -11.817 5.230 -8.739 1.00 . A A . 107 GLU HB2 1 1 8 14733 1 1 107 GLU HB3 H -13.134 4.595 -9.705 1.00 . A A . 107 GLU HB3 1 1 8 14734 1 1 107 GLU HG2 H -12.514 2.265 -8.740 1.00 . A A . 107 GLU HG2 1 1 8 14735 1 1 107 GLU HG3 H -11.504 3.122 -7.593 1.00 . A A . 107 GLU HG3 1 1 8 14736 1 1 107 GLU N N -9.831 3.865 -9.796 1.00 . A A . 107 GLU N 1 1 8 14737 1 1 107 GLU O O -11.613 6.019 -11.392 1.00 . A A . 107 GLU O 1 1 8 14738 1 1 107 GLU OXT O -10.920 4.378 -12.638 1.00 . A A . 107 GLU OXT 1 1 8 14739 1 1 107 GLU OE1 O -14.573 4.087 -7.888 1.00 . A A . 107 GLU OE1 1 1 8 14740 1 1 107 GLU OE2 O -13.566 3.102 -6.163 1.00 . A A . 107 GLU OE2 1 1 8 14741 2 2 1 HEC C1A C -1.170 5.404 9.219 1.00 . B A . 108 HEC C1A 1 1 8 14742 2 2 1 HEC C1B C -2.038 2.216 12.003 1.00 . B A . 108 HEC C1B 1 1 8 14743 2 2 1 HEC C1C C -2.177 -0.609 8.692 1.00 . B A . 108 HEC C1C 1 1 8 14744 2 2 1 HEC C1D C -1.153 2.572 5.952 1.00 . B A . 108 HEC C1D 1 1 8 14745 2 2 1 HEC C2A C -1.068 6.461 10.197 1.00 . B A . 108 HEC C2A 1 1 8 14746 2 2 1 HEC C2B C -2.464 1.304 13.039 1.00 . B A . 108 HEC C2B 1 1 8 14747 2 2 1 HEC C2C C -2.209 -1.672 7.715 1.00 . B A . 108 HEC C2C 1 1 8 14748 2 2 1 HEC C2D C -0.755 3.505 4.925 1.00 . B A . 108 HEC C2D 1 1 8 14749 2 2 1 HEC C3A C -1.268 5.902 11.409 1.00 . B A . 108 HEC C3A 1 1 8 14750 2 2 1 HEC C3B C -2.649 0.101 12.457 1.00 . B A . 108 HEC C3B 1 1 8 14751 2 2 1 HEC C3C C -1.910 -1.122 6.519 1.00 . B A . 108 HEC C3C 1 1 8 14752 2 2 1 HEC C3D C -0.661 4.720 5.507 1.00 . B A . 108 HEC C3D 1 1 8 14753 2 2 1 HEC C4A C -1.497 4.492 11.193 1.00 . B A . 108 HEC C4A 1 1 8 14754 2 2 1 HEC C4B C -2.340 0.255 11.055 1.00 . B A . 108 HEC C4B 1 1 8 14755 2 2 1 HEC C4C C -1.689 0.287 6.744 1.00 . B A . 108 HEC C4C 1 1 8 14756 2 2 1 HEC C4D C -1.001 4.550 6.900 1.00 . B A . 108 HEC C4D 1 1 8 14757 2 2 1 HEC CAA C -0.789 7.902 9.879 1.00 . B A . 108 HEC CAA 1 1 8 14758 2 2 1 HEC CAB C -3.091 -1.180 13.103 1.00 . B A . 108 HEC CAB 1 1 8 14759 2 2 1 HEC CAC C -1.813 -1.805 5.186 1.00 . B A . 108 HEC CAC 1 1 8 14760 2 2 1 HEC CAD C -0.282 6.024 4.868 1.00 . B A . 108 HEC CAD 1 1 8 14761 2 2 1 HEC CBA C 0.125 8.594 10.886 1.00 . B A . 108 HEC CBA 1 1 8 14762 2 2 1 HEC CBB C -4.345 -1.043 13.961 1.00 . B A . 108 HEC CBB 1 1 8 14763 2 2 1 HEC CBC C -2.749 -3.000 5.032 1.00 . B A . 108 HEC CBC 1 1 8 14764 2 2 1 HEC CBD C -0.867 6.225 3.473 1.00 . B A . 108 HEC CBD 1 1 8 14765 2 2 1 HEC CGA C -0.616 9.693 11.632 1.00 . B A . 108 HEC CGA 1 1 8 14766 2 2 1 HEC CGD C 0.234 6.365 2.432 1.00 . B A . 108 HEC CGD 1 1 8 14767 2 2 1 HEC CHA C -1.021 5.589 7.848 1.00 . B A . 108 HEC CHA 1 1 8 14768 2 2 1 HEC CHB C -1.747 3.559 12.216 1.00 . B A . 108 HEC CHB 1 1 8 14769 2 2 1 HEC CHC C -2.412 -0.779 10.104 1.00 . B A . 108 HEC CHC 1 1 8 14770 2 2 1 HEC CHD C -1.354 1.212 5.738 1.00 . B A . 108 HEC CHD 1 1 8 14771 2 2 1 HEC CMA C -1.264 6.576 12.750 1.00 . B A . 108 HEC CMA 1 1 8 14772 2 2 1 HEC CMB C -2.651 1.671 14.483 1.00 . B A . 108 HEC CMB 1 1 8 14773 2 2 1 HEC CMC C -2.522 -3.108 8.019 1.00 . B A . 108 HEC CMC 1 1 8 14774 2 2 1 HEC CMD C -0.502 3.146 3.490 1.00 . B A . 108 HEC CMD 1 1 8 14775 2 2 1 HEC FE FE -1.639 2.393 8.969 1.00 . B A . 108 HEC FE 1 1 8 14776 2 2 1 HEC HAA1 H -0.305 7.971 8.904 1.00 . B A . 108 HEC HAA1 1 1 8 14777 2 2 1 HEC HAA2 H -1.726 8.458 9.859 1.00 . B A . 108 HEC HAA2 1 1 8 14778 2 2 1 HEC HAB H -3.308 -1.920 12.333 1.00 . B A . 108 HEC HAB 1 1 8 14779 2 2 1 HEC HAC H -2.063 -1.096 4.396 1.00 . B A . 108 HEC HAC 1 1 8 14780 2 2 1 HEC HAD1 H -0.635 6.848 5.487 1.00 . B A . 108 HEC HAD1 1 1 8 14781 2 2 1 HEC HAD2 H 0.803 6.079 4.772 1.00 . B A . 108 HEC HAD2 1 1 8 14782 2 2 1 HEC HBA1 H 0.487 7.864 11.610 1.00 . B A . 108 HEC HBA1 1 1 8 14783 2 2 1 HEC HBA2 H 0.972 9.038 10.363 1.00 . B A . 108 HEC HBA2 1 1 8 14784 2 2 1 HEC HBB1 H -4.061 -0.964 15.010 1.00 . B A . 108 HEC HBB1 1 1 8 14785 2 2 1 HEC HBB2 H -4.891 -0.147 13.665 1.00 . B A . 108 HEC HBB2 1 1 8 14786 2 2 1 HEC HBB3 H -4.979 -1.918 13.821 1.00 . B A . 108 HEC HBB3 1 1 8 14787 2 2 1 HEC HBC1 H -3.031 -3.108 3.984 1.00 . B A . 108 HEC HBC1 1 1 8 14788 2 2 1 HEC HBC2 H -2.242 -3.904 5.367 1.00 . B A . 108 HEC HBC2 1 1 8 14789 2 2 1 HEC HBC3 H -3.644 -2.841 5.634 1.00 . B A . 108 HEC HBC3 1 1 8 14790 2 2 1 HEC HBD1 H -1.487 5.368 3.212 1.00 . B A . 108 HEC HBD1 1 1 8 14791 2 2 1 HEC HBD2 H -1.475 7.130 3.462 1.00 . B A . 108 HEC HBD2 1 1 8 14792 2 2 1 HEC HHA H -0.912 6.609 7.479 1.00 . B A . 108 HEC HHA 1 1 8 14793 2 2 1 HEC HHB H -1.709 3.918 13.244 1.00 . B A . 108 HEC HHB 1 1 8 14794 2 2 1 HEC HHC H -2.632 -1.783 10.468 1.00 . B A . 108 HEC HHC 1 1 8 14795 2 2 1 HEC HHD H -1.245 0.833 4.722 1.00 . B A . 108 HEC HHD 1 1 8 14796 2 2 1 HEC HMA1 H -0.235 6.724 13.079 1.00 . B A . 108 HEC HMA1 1 1 8 14797 2 2 1 HEC HMA2 H -1.763 7.542 12.673 1.00 . B A . 108 HEC HMA2 1 1 8 14798 2 2 1 HEC HMA3 H -1.790 5.951 13.472 1.00 . B A . 108 HEC HMA3 1 1 8 14799 2 2 1 HEC HMB1 H -1.841 1.245 15.074 1.00 . B A . 108 HEC HMB1 1 1 8 14800 2 2 1 HEC HMB2 H -2.644 2.757 14.585 1.00 . B A . 108 HEC HMB2 1 1 8 14801 2 2 1 HEC HMB3 H -3.605 1.279 14.836 1.00 . B A . 108 HEC HMB3 1 1 8 14802 2 2 1 HEC HMC1 H -1.721 -3.743 7.640 1.00 . B A . 108 HEC HMC1 1 1 8 14803 2 2 1 HEC HMC2 H -2.610 -3.240 9.098 1.00 . B A . 108 HEC HMC2 1 1 8 14804 2 2 1 HEC HMC3 H -3.461 -3.385 7.541 1.00 . B A . 108 HEC HMC3 1 1 8 14805 2 2 1 HEC HMD1 H 0.126 3.909 3.030 1.00 . B A . 108 HEC HMD1 1 1 8 14806 2 2 1 HEC HMD2 H 0.002 2.181 3.440 1.00 . B A . 108 HEC HMD2 1 1 8 14807 2 2 1 HEC HMD3 H -1.452 3.088 2.957 1.00 . B A . 108 HEC HMD3 1 1 8 14808 2 2 1 HEC NA N -1.434 4.197 9.842 1.00 . B A . 108 HEC NA 1 1 8 14809 2 2 1 HEC NB N -1.966 1.560 10.787 1.00 . B A . 108 HEC NB 1 1 8 14810 2 2 1 HEC NC N -1.856 0.592 8.084 1.00 . B A . 108 HEC NC 1 1 8 14811 2 2 1 HEC ND N -1.301 3.225 7.163 1.00 . B A . 108 HEC ND 1 1 8 14812 2 2 1 HEC O1A O -0.305 9.877 12.829 1.00 . B A . 108 HEC O1A 1 1 8 14813 2 2 1 HEC O1D O 1.289 5.727 2.633 1.00 . B A . 108 HEC O1D 1 1 8 14814 2 2 1 HEC O2A O -1.481 10.330 10.993 1.00 . B A . 108 HEC O2A 1 1 8 14815 2 2 1 HEC O2D O -0.001 7.107 1.454 1.00 . B A . 108 HEC O2D 1 1 8 14816 3 2 1 HEC C1A C 9.614 -1.705 1.739 1.00 . C A . 109 HEC C1A 1 1 8 14817 3 2 1 HEC C1B C 5.758 -0.032 2.743 1.00 . C A . 109 HEC C1B 1 1 8 14818 3 2 1 HEC C1C C 7.756 2.990 5.213 1.00 . C A . 109 HEC C1C 1 1 8 14819 3 2 1 HEC C1D C 11.584 1.487 3.886 1.00 . C A . 109 HEC C1D 1 1 8 14820 3 2 1 HEC C2A C 9.121 -2.786 0.918 1.00 . C A . 109 HEC C2A 1 1 8 14821 3 2 1 HEC C2B C 4.398 0.334 3.061 1.00 . C A . 109 HEC C2B 1 1 8 14822 3 2 1 HEC C2C C 8.262 4.134 5.934 1.00 . C A . 109 HEC C2C 1 1 8 14823 3 2 1 HEC C2D C 12.937 1.072 3.601 1.00 . C A . 109 HEC C2D 1 1 8 14824 3 2 1 HEC C3A C 7.777 -2.674 0.880 1.00 . C A . 109 HEC C3A 1 1 8 14825 3 2 1 HEC C3B C 4.457 1.378 3.914 1.00 . C A . 109 HEC C3B 1 1 8 14826 3 2 1 HEC C3C C 9.605 4.128 5.794 1.00 . C A . 109 HEC C3C 1 1 8 14827 3 2 1 HEC C3D C 12.859 -0.067 2.881 1.00 . C A . 109 HEC C3D 1 1 8 14828 3 2 1 HEC C4A C 7.424 -1.523 1.678 1.00 . C A . 109 HEC C4A 1 1 8 14829 3 2 1 HEC C4B C 5.855 1.669 4.133 1.00 . C A . 109 HEC C4B 1 1 8 14830 3 2 1 HEC C4C C 9.943 2.981 4.985 1.00 . C A . 109 HEC C4C 1 1 8 14831 3 2 1 HEC C4D C 11.457 -0.369 2.714 1.00 . C A . 109 HEC C4D 1 1 8 14832 3 2 1 HEC CAA C 9.982 -3.819 0.250 1.00 . C A . 109 HEC CAA 1 1 8 14833 3 2 1 HEC CAB C 3.316 2.125 4.542 1.00 . C A . 109 HEC CAB 1 1 8 14834 3 2 1 HEC CAC C 10.596 5.107 6.354 1.00 . C A . 109 HEC CAC 1 1 8 14835 3 2 1 HEC CAD C 13.987 -0.896 2.338 1.00 . C A . 109 HEC CAD 1 1 8 14836 3 2 1 HEC CBA C 10.258 -3.538 -1.224 1.00 . C A . 109 HEC CBA 1 1 8 14837 3 2 1 HEC CBB C 2.274 1.227 5.201 1.00 . C A . 109 HEC CBB 1 1 8 14838 3 2 1 HEC CBC C 10.578 5.205 7.877 1.00 . C A . 109 HEC CBC 1 1 8 14839 3 2 1 HEC CBD C 15.179 -1.018 3.283 1.00 . C A . 109 HEC CBD 1 1 8 14840 3 2 1 HEC CGA C 11.075 -4.658 -1.852 1.00 . C A . 109 HEC CGA 1 1 8 14841 3 2 1 HEC CGD C 16.243 0.021 2.959 1.00 . C A . 109 HEC CGD 1 1 8 14842 3 2 1 HEC CHA C 10.959 -1.485 2.016 1.00 . C A . 109 HEC CHA 1 1 8 14843 3 2 1 HEC CHB C 6.108 -1.072 1.887 1.00 . C A . 109 HEC CHB 1 1 8 14844 3 2 1 HEC CHC C 6.335 2.695 4.966 1.00 . C A . 109 HEC CHC 1 1 8 14845 3 2 1 HEC CHD C 11.252 2.626 4.612 1.00 . C A . 109 HEC CHD 1 1 8 14846 3 2 1 HEC CMA C 6.796 -3.554 0.161 1.00 . C A . 109 HEC CMA 1 1 8 14847 3 2 1 HEC CMB C 3.175 -0.348 2.520 1.00 . C A . 109 HEC CMB 1 1 8 14848 3 2 1 HEC CMC C 7.415 5.119 6.685 1.00 . C A . 109 HEC CMC 1 1 8 14849 3 2 1 HEC CMD C 14.171 1.804 4.042 1.00 . C A . 109 HEC CMD 1 1 8 14850 3 2 1 HEC FE FE 8.672 0.686 3.394 1.00 . C A . 109 HEC FE 1 1 8 14851 3 2 1 HEC HAA1 H 10.947 -3.868 0.754 1.00 . C A . 109 HEC HAA1 1 1 8 14852 3 2 1 HEC HAA2 H 9.492 -4.791 0.306 1.00 . C A . 109 HEC HAA2 1 1 8 14853 3 2 1 HEC HAB H 3.700 2.793 5.313 1.00 . C A . 109 HEC HAB 1 1 8 14854 3 2 1 HEC HAC H 11.603 4.810 6.062 1.00 . C A . 109 HEC HAC 1 1 8 14855 3 2 1 HEC HAD1 H 13.631 -1.906 2.137 1.00 . C A . 109 HEC HAD1 1 1 8 14856 3 2 1 HEC HAD2 H 14.354 -0.449 1.413 1.00 . C A . 109 HEC HAD2 1 1 8 14857 3 2 1 HEC HBA1 H 9.313 -3.453 -1.761 1.00 . C A . 109 HEC HBA1 1 1 8 14858 3 2 1 HEC HBA2 H 10.814 -2.605 -1.318 1.00 . C A . 109 HEC HBA2 1 1 8 14859 3 2 1 HEC HBB1 H 2.159 1.510 6.247 1.00 . C A . 109 HEC HBB1 1 1 8 14860 3 2 1 HEC HBB2 H 1.319 1.341 4.687 1.00 . C A . 109 HEC HBB2 1 1 8 14861 3 2 1 HEC HBB3 H 2.598 0.188 5.139 1.00 . C A . 109 HEC HBB3 1 1 8 14862 3 2 1 HEC HBC1 H 10.536 4.204 8.305 1.00 . C A . 109 HEC HBC1 1 1 8 14863 3 2 1 HEC HBC2 H 11.483 5.708 8.219 1.00 . C A . 109 HEC HBC2 1 1 8 14864 3 2 1 HEC HBC3 H 9.704 5.774 8.194 1.00 . C A . 109 HEC HBC3 1 1 8 14865 3 2 1 HEC HBD1 H 14.846 -0.867 4.309 1.00 . C A . 109 HEC HBD1 1 1 8 14866 3 2 1 HEC HBD2 H 15.620 -2.010 3.186 1.00 . C A . 109 HEC HBD2 1 1 8 14867 3 2 1 HEC HHA H 11.681 -2.225 1.671 1.00 . C A . 109 HEC HHA 1 1 8 14868 3 2 1 HEC HHB H 5.311 -1.574 1.339 1.00 . C A . 109 HEC HHB 1 1 8 14869 3 2 1 HEC HHC H 5.598 3.310 5.483 1.00 . C A . 109 HEC HHC 1 1 8 14870 3 2 1 HEC HHD H 12.059 3.293 4.916 1.00 . C A . 109 HEC HHD 1 1 8 14871 3 2 1 HEC HMA1 H 7.228 -4.546 0.028 1.00 . C A . 109 HEC HMA1 1 1 8 14872 3 2 1 HEC HMA2 H 5.880 -3.632 0.746 1.00 . C A . 109 HEC HMA2 1 1 8 14873 3 2 1 HEC HMA3 H 6.569 -3.123 -0.815 1.00 . C A . 109 HEC HMA3 1 1 8 14874 3 2 1 HEC HMB1 H 2.295 0.001 3.059 1.00 . C A . 109 HEC HMB1 1 1 8 14875 3 2 1 HEC HMB2 H 3.069 -0.115 1.460 1.00 . C A . 109 HEC HMB2 1 1 8 14876 3 2 1 HEC HMB3 H 3.275 -1.426 2.646 1.00 . C A . 109 HEC HMB3 1 1 8 14877 3 2 1 HEC HMC1 H 7.827 5.265 7.684 1.00 . C A . 109 HEC HMC1 1 1 8 14878 3 2 1 HEC HMC2 H 7.406 6.070 6.153 1.00 . C A . 109 HEC HMC2 1 1 8 14879 3 2 1 HEC HMC3 H 6.397 4.737 6.765 1.00 . C A . 109 HEC HMC3 1 1 8 14880 3 2 1 HEC HMD1 H 14.837 1.114 4.560 1.00 . C A . 109 HEC HMD1 1 1 8 14881 3 2 1 HEC HMD2 H 14.681 2.216 3.171 1.00 . C A . 109 HEC HMD2 1 1 8 14882 3 2 1 HEC HMD3 H 13.892 2.614 4.716 1.00 . C A . 109 HEC HMD3 1 1 8 14883 3 2 1 HEC NA N 8.561 -0.935 2.201 1.00 . C A . 109 HEC NA 1 1 8 14884 3 2 1 HEC NB N 6.646 0.795 3.407 1.00 . C A . 109 HEC NB 1 1 8 14885 3 2 1 HEC NC N 8.798 2.288 4.633 1.00 . C A . 109 HEC NC 1 1 8 14886 3 2 1 HEC ND N 10.682 0.594 3.336 1.00 . C A . 109 HEC ND 1 1 8 14887 3 2 1 HEC O1A O 11.959 -5.182 -1.140 1.00 . C A . 109 HEC O1A 1 1 8 14888 3 2 1 HEC O1D O 16.885 0.495 3.921 1.00 . C A . 109 HEC O1D 1 1 8 14889 3 2 1 HEC O2A O 10.800 -4.969 -3.030 1.00 . C A . 109 HEC O2A 1 1 8 14890 3 2 1 HEC O2D O 16.395 0.322 1.755 1.00 . C A . 109 HEC O2D 1 1 8 14891 4 2 1 HEC C1A C -8.659 -3.395 0.390 1.00 . D A . 110 HEC C1A 1 1 8 14892 4 2 1 HEC C1B C -4.946 -1.205 0.092 1.00 . D A . 110 HEC C1B 1 1 8 14893 4 2 1 HEC C1C C -2.858 -4.494 1.997 1.00 . D A . 110 HEC C1C 1 1 8 14894 4 2 1 HEC C1D C -6.586 -6.653 2.331 1.00 . D A . 110 HEC C1D 1 1 8 14895 4 2 1 HEC C2A C -9.489 -2.415 -0.270 1.00 . D A . 110 HEC C2A 1 1 8 14896 4 2 1 HEC C2B C -3.790 -0.364 -0.113 1.00 . D A . 110 HEC C2B 1 1 8 14897 4 2 1 HEC C2C C -2.014 -5.521 2.560 1.00 . D A . 110 HEC C2C 1 1 8 14898 4 2 1 HEC C2D C -7.757 -7.441 2.635 1.00 . D A . 110 HEC C2D 1 1 8 14899 4 2 1 HEC C3A C -8.687 -1.387 -0.620 1.00 . D A . 110 HEC C3A 1 1 8 14900 4 2 1 HEC C3B C -2.739 -0.987 0.462 1.00 . D A . 110 HEC C3B 1 1 8 14901 4 2 1 HEC C3C C -2.813 -6.562 2.875 1.00 . D A . 110 HEC C3C 1 1 8 14902 4 2 1 HEC C3D C -8.823 -6.776 2.142 1.00 . D A . 110 HEC C3D 1 1 8 14903 4 2 1 HEC C4A C -7.353 -1.720 -0.180 1.00 . D A . 110 HEC C4A 1 1 8 14904 4 2 1 HEC C4B C -3.235 -2.220 1.028 1.00 . D A . 110 HEC C4B 1 1 8 14905 4 2 1 HEC C4C C -4.160 -6.190 2.509 1.00 . D A . 110 HEC C4C 1 1 8 14906 4 2 1 HEC C4D C -8.323 -5.569 1.528 1.00 . D A . 110 HEC C4D 1 1 8 14907 4 2 1 HEC CAA C -10.965 -2.555 -0.501 1.00 . D A . 110 HEC CAA 1 1 8 14908 4 2 1 HEC CAB C -1.312 -0.525 0.525 1.00 . D A . 110 HEC CAB 1 1 8 14909 4 2 1 HEC CAC C -2.422 -7.875 3.489 1.00 . D A . 110 HEC CAC 1 1 8 14910 4 2 1 HEC CAD C -10.269 -7.175 2.199 1.00 . D A . 110 HEC CAD 1 1 8 14911 4 2 1 HEC CBA C -11.805 -2.450 0.768 1.00 . D A . 110 HEC CBA 1 1 8 14912 4 2 1 HEC CBB C -1.147 0.918 0.993 1.00 . D A . 110 HEC CBB 1 1 8 14913 4 2 1 HEC CBC C -1.128 -7.821 4.296 1.00 . D A . 110 HEC CBC 1 1 8 14914 4 2 1 HEC CBD C -10.968 -7.169 0.842 1.00 . D A . 110 HEC CBD 1 1 8 14915 4 2 1 HEC CGA C -12.446 -1.074 0.888 1.00 . D A . 110 HEC CGA 1 1 8 14916 4 2 1 HEC CGD C -12.198 -6.273 0.864 1.00 . D A . 110 HEC CGD 1 1 8 14917 4 2 1 HEC CHA C -9.127 -4.602 0.897 1.00 . D A . 110 HEC CHA 1 1 8 14918 4 2 1 HEC CHB C -6.225 -0.898 -0.360 1.00 . D A . 110 HEC CHB 1 1 8 14919 4 2 1 HEC CHC C -2.442 -3.156 1.717 1.00 . D A . 110 HEC CHC 1 1 8 14920 4 2 1 HEC CHD C -5.289 -7.012 2.680 1.00 . D A . 110 HEC CHD 1 1 8 14921 4 2 1 HEC CMA C -9.066 -0.120 -1.330 1.00 . D A . 110 HEC CMA 1 1 8 14922 4 2 1 HEC CMB C -3.801 0.951 -0.837 1.00 . D A . 110 HEC CMB 1 1 8 14923 4 2 1 HEC CMC C -0.529 -5.407 2.743 1.00 . D A . 110 HEC CMC 1 1 8 14924 4 2 1 HEC CMD C -7.743 -8.752 3.366 1.00 . D A . 110 HEC CMD 1 1 8 14925 4 2 1 HEC FE FE -5.765 -3.930 1.213 1.00 . D A . 110 HEC FE 1 1 8 14926 4 2 1 HEC HAA1 H -11.304 -1.770 -1.177 1.00 . D A . 110 HEC HAA1 1 1 8 14927 4 2 1 HEC HAA2 H -11.172 -3.530 -0.943 1.00 . D A . 110 HEC HAA2 1 1 8 14928 4 2 1 HEC HAB H -0.757 -1.154 1.221 1.00 . D A . 110 HEC HAB 1 1 8 14929 4 2 1 HEC HAC H -3.209 -8.209 4.164 1.00 . D A . 110 HEC HAC 1 1 8 14930 4 2 1 HEC HAD1 H -10.351 -8.186 2.598 1.00 . D A . 110 HEC HAD1 1 1 8 14931 4 2 1 HEC HAD2 H -10.812 -6.485 2.844 1.00 . D A . 110 HEC HAD2 1 1 8 14932 4 2 1 HEC HBA1 H -12.594 -3.201 0.746 1.00 . D A . 110 HEC HBA1 1 1 8 14933 4 2 1 HEC HBA2 H -11.170 -2.615 1.639 1.00 . D A . 110 HEC HBA2 1 1 8 14934 4 2 1 HEC HBB1 H -0.562 1.473 0.259 1.00 . D A . 110 HEC HBB1 1 1 8 14935 4 2 1 HEC HBB2 H -2.129 1.380 1.099 1.00 . D A . 110 HEC HBB2 1 1 8 14936 4 2 1 HEC HBB3 H -0.633 0.932 1.954 1.00 . D A . 110 HEC HBB3 1 1 8 14937 4 2 1 HEC HBC1 H -1.117 -8.637 5.019 1.00 . D A . 110 HEC HBC1 1 1 8 14938 4 2 1 HEC HBC2 H -0.276 -7.919 3.624 1.00 . D A . 110 HEC HBC2 1 1 8 14939 4 2 1 HEC HBC3 H -1.068 -6.869 4.823 1.00 . D A . 110 HEC HBC3 1 1 8 14940 4 2 1 HEC HBD1 H -10.281 -6.799 0.081 1.00 . D A . 110 HEC HBD1 1 1 8 14941 4 2 1 HEC HBD2 H -11.279 -8.182 0.589 1.00 . D A . 110 HEC HBD2 1 1 8 14942 4 2 1 HEC HHA H -10.191 -4.819 0.802 1.00 . D A . 110 HEC HHA 1 1 8 14943 4 2 1 HEC HHB H -6.369 0.043 -0.891 1.00 . D A . 110 HEC HHB 1 1 8 14944 4 2 1 HEC HHC H -1.448 -2.838 2.032 1.00 . D A . 110 HEC HHC 1 1 8 14945 4 2 1 HEC HHD H -5.131 -7.998 3.117 1.00 . D A . 110 HEC HHD 1 1 8 14946 4 2 1 HEC HMA1 H -8.559 -0.078 -2.294 1.00 . D A . 110 HEC HMA1 1 1 8 14947 4 2 1 HEC HMA2 H -10.145 -0.099 -1.485 1.00 . D A . 110 HEC HMA2 1 1 8 14948 4 2 1 HEC HMA3 H -8.769 0.738 -0.727 1.00 . D A . 110 HEC HMA3 1 1 8 14949 4 2 1 HEC HMB1 H -3.885 1.763 -0.114 1.00 . D A . 110 HEC HMB1 1 1 8 14950 4 2 1 HEC HMB2 H -2.876 1.062 -1.403 1.00 . D A . 110 HEC HMB2 1 1 8 14951 4 2 1 HEC HMB3 H -4.651 0.983 -1.519 1.00 . D A . 110 HEC HMB3 1 1 8 14952 4 2 1 HEC HMC1 H -0.150 -4.584 2.137 1.00 . D A . 110 HEC HMC1 1 1 8 14953 4 2 1 HEC HMC2 H -0.305 -5.219 3.793 1.00 . D A . 110 HEC HMC2 1 1 8 14954 4 2 1 HEC HMC3 H -0.052 -6.337 2.432 1.00 . D A . 110 HEC HMC3 1 1 8 14955 4 2 1 HEC HMD1 H -8.651 -8.846 3.961 1.00 . D A . 110 HEC HMD1 1 1 8 14956 4 2 1 HEC HMD2 H -7.694 -9.569 2.647 1.00 . D A . 110 HEC HMD2 1 1 8 14957 4 2 1 HEC HMD3 H -6.873 -8.793 4.022 1.00 . D A . 110 HEC HMD3 1 1 8 14958 4 2 1 HEC NA N -7.346 -2.957 0.439 1.00 . D A . 110 HEC NA 1 1 8 14959 4 2 1 HEC NB N -4.593 -2.344 0.794 1.00 . D A . 110 HEC NB 1 1 8 14960 4 2 1 HEC NC N -4.176 -4.916 1.970 1.00 . D A . 110 HEC NC 1 1 8 14961 4 2 1 HEC ND N -6.946 -5.503 1.649 1.00 . D A . 110 HEC ND 1 1 8 14962 4 2 1 HEC O1A O -11.757 -0.170 1.407 1.00 . D A . 110 HEC O1A 1 1 8 14963 4 2 1 HEC O1D O -13.001 -6.435 1.808 1.00 . D A . 110 HEC O1D 1 1 8 14964 4 2 1 HEC O2A O -13.614 -0.953 0.458 1.00 . D A . 110 HEC O2A 1 1 8 14965 4 2 1 HEC O2D O -12.312 -5.442 -0.062 1.00 . D A . 110 HEC O2D 1 1 8 14966 5 2 1 HEC C1A C -0.022 4.159 -9.205 1.00 . E A . 111 HEC C1A 1 1 8 14967 5 2 1 HEC C1B C -1.297 0.714 -11.482 1.00 . E A . 111 HEC C1B 1 1 8 14968 5 2 1 HEC C1C C -3.090 -0.973 -7.895 1.00 . E A . 111 HEC C1C 1 1 8 14969 5 2 1 HEC C1D C -1.835 2.500 -5.651 1.00 . E A . 111 HEC C1D 1 1 8 14970 5 2 1 HEC C2A C 0.604 4.862 -10.300 1.00 . E A . 111 HEC C2A 1 1 8 14971 5 2 1 HEC C2B C -1.461 -0.439 -12.337 1.00 . E A . 111 HEC C2B 1 1 8 14972 5 2 1 HEC C2C C -3.853 -1.593 -6.838 1.00 . E A . 111 HEC C2C 1 1 8 14973 5 2 1 HEC C2D C -1.371 3.513 -4.734 1.00 . E A . 111 HEC C2D 1 1 8 14974 5 2 1 HEC C3A C 0.422 4.114 -11.408 1.00 . E A . 111 HEC C3A 1 1 8 14975 5 2 1 HEC C3B C -2.066 -1.395 -11.601 1.00 . E A . 111 HEC C3B 1 1 8 14976 5 2 1 HEC C3C C -3.761 -0.789 -5.758 1.00 . E A . 111 HEC C3C 1 1 8 14977 5 2 1 HEC C3D C -0.661 4.406 -5.455 1.00 . E A . 111 HEC C3D 1 1 8 14978 5 2 1 HEC C4A C -0.319 2.940 -11.010 1.00 . E A . 111 HEC C4A 1 1 8 14979 5 2 1 HEC C4B C -2.283 -0.845 -10.284 1.00 . E A . 111 HEC C4B 1 1 8 14980 5 2 1 HEC C4C C -2.940 0.337 -6.135 1.00 . E A . 111 HEC C4C 1 1 8 14981 5 2 1 HEC C4D C -0.678 3.954 -6.826 1.00 . E A . 111 HEC C4D 1 1 8 14982 5 2 1 HEC CAA C 1.315 6.179 -10.181 1.00 . E A . 111 HEC CAA 1 1 8 14983 5 2 1 HEC CAB C -2.457 -2.780 -12.028 1.00 . E A . 111 HEC CAB 1 1 8 14984 5 2 1 HEC CAC C -4.377 -0.987 -4.403 1.00 . E A . 111 HEC CAC 1 1 8 14985 5 2 1 HEC CAD C 0.032 5.646 -4.967 1.00 . E A . 111 HEC CAD 1 1 8 14986 5 2 1 HEC CBA C 2.714 6.187 -10.791 1.00 . E A . 111 HEC CBA 1 1 8 14987 5 2 1 HEC CBB C -1.429 -3.852 -11.676 1.00 . E A . 111 HEC CBB 1 1 8 14988 5 2 1 HEC CBC C -4.179 -2.387 -3.830 1.00 . E A . 111 HEC CBC 1 1 8 14989 5 2 1 HEC CBD C -0.905 6.826 -4.727 1.00 . E A . 111 HEC CBD 1 1 8 14990 5 2 1 HEC CGA C 2.854 7.295 -11.824 1.00 . E A . 111 HEC CGA 1 1 8 14991 5 2 1 HEC CGD C -0.210 8.147 -5.026 1.00 . E A . 111 HEC CGD 1 1 8 14992 5 2 1 HEC CHA C -0.044 4.618 -7.892 1.00 . E A . 111 HEC CHA 1 1 8 14993 5 2 1 HEC CHB C -0.709 1.909 -11.884 1.00 . E A . 111 HEC CHB 1 1 8 14994 5 2 1 HEC CHC C -2.893 -1.536 -9.222 1.00 . E A . 111 HEC CHC 1 1 8 14995 5 2 1 HEC CHD C -2.607 1.403 -5.280 1.00 . E A . 111 HEC CHD 1 1 8 14996 5 2 1 HEC CMA C 0.882 4.405 -12.807 1.00 . E A . 111 HEC CMA 1 1 8 14997 5 2 1 HEC CMB C -1.023 -0.513 -13.770 1.00 . E A . 111 HEC CMB 1 1 8 14998 5 2 1 HEC CMC C -4.595 -2.892 -6.963 1.00 . E A . 111 HEC CMC 1 1 8 14999 5 2 1 HEC CMD C -1.652 3.530 -3.259 1.00 . E A . 111 HEC CMD 1 1 8 15000 5 2 1 HEC FE FE -1.582 1.606 -8.566 1.00 . E A . 111 HEC FE 1 1 8 15001 5 2 1 HEC HAA1 H 0.738 6.951 -10.690 1.00 . E A . 111 HEC HAA1 1 1 8 15002 5 2 1 HEC HAA2 H 1.422 6.440 -9.128 1.00 . E A . 111 HEC HAA2 1 1 8 15003 5 2 1 HEC HAB H -3.392 -3.059 -11.543 1.00 . E A . 111 HEC HAB 1 1 8 15004 5 2 1 HEC HAC H -3.935 -0.285 -3.697 1.00 . E A . 111 HEC HAC 1 1 8 15005 5 2 1 HEC HAD1 H 0.532 5.434 -4.022 1.00 . E A . 111 HEC HAD1 1 1 8 15006 5 2 1 HEC HAD2 H 0.768 5.964 -5.705 1.00 . E A . 111 HEC HAD2 1 1 8 15007 5 2 1 HEC HBA1 H 3.452 6.346 -10.005 1.00 . E A . 111 HEC HBA1 1 1 8 15008 5 2 1 HEC HBA2 H 2.903 5.230 -11.279 1.00 . E A . 111 HEC HBA2 1 1 8 15009 5 2 1 HEC HBB1 H -0.493 -3.643 -12.194 1.00 . E A . 111 HEC HBB1 1 1 8 15010 5 2 1 HEC HBB2 H -1.256 -3.849 -10.599 1.00 . E A . 111 HEC HBB2 1 1 8 15011 5 2 1 HEC HBB3 H -1.803 -4.829 -11.981 1.00 . E A . 111 HEC HBB3 1 1 8 15012 5 2 1 HEC HBC1 H -3.113 -2.611 -3.778 1.00 . E A . 111 HEC HBC1 1 1 8 15013 5 2 1 HEC HBC2 H -4.608 -2.434 -2.829 1.00 . E A . 111 HEC HBC2 1 1 8 15014 5 2 1 HEC HBC3 H -4.673 -3.116 -4.472 1.00 . E A . 111 HEC HBC3 1 1 8 15015 5 2 1 HEC HBD1 H -1.777 6.736 -5.374 1.00 . E A . 111 HEC HBD1 1 1 8 15016 5 2 1 HEC HBD2 H -1.225 6.830 -3.685 1.00 . E A . 111 HEC HBD2 1 1 8 15017 5 2 1 HEC HHA H 0.462 5.557 -7.670 1.00 . E A . 111 HEC HHA 1 1 8 15018 5 2 1 HEC HHB H -0.537 2.061 -12.950 1.00 . E A . 111 HEC HHB 1 1 8 15019 5 2 1 HEC HHC H -3.219 -2.559 -9.408 1.00 . E A . 111 HEC HHC 1 1 8 15020 5 2 1 HEC HHD H -2.981 1.363 -4.258 1.00 . E A . 111 HEC HHD 1 1 8 15021 5 2 1 HEC HMA1 H 0.016 4.526 -13.457 1.00 . E A . 111 HEC HMA1 1 1 8 15022 5 2 1 HEC HMA2 H 1.471 5.323 -12.811 1.00 . E A . 111 HEC HMA2 1 1 8 15023 5 2 1 HEC HMA3 H 1.495 3.579 -13.167 1.00 . E A . 111 HEC HMA3 1 1 8 15024 5 2 1 HEC HMB1 H -0.087 0.032 -13.894 1.00 . E A . 111 HEC HMB1 1 1 8 15025 5 2 1 HEC HMB2 H -0.875 -1.556 -14.051 1.00 . E A . 111 HEC HMB2 1 1 8 15026 5 2 1 HEC HMB3 H -1.789 -0.071 -14.408 1.00 . E A . 111 HEC HMB3 1 1 8 15027 5 2 1 HEC HMC1 H -4.134 -3.638 -6.314 1.00 . E A . 111 HEC HMC1 1 1 8 15028 5 2 1 HEC HMC2 H -5.634 -2.747 -6.668 1.00 . E A . 111 HEC HMC2 1 1 8 15029 5 2 1 HEC HMC3 H -4.555 -3.236 -7.996 1.00 . E A . 111 HEC HMC3 1 1 8 15030 5 2 1 HEC HMD1 H -1.112 4.356 -2.796 1.00 . E A . 111 HEC HMD1 1 1 8 15031 5 2 1 HEC HMD2 H -2.722 3.657 -3.094 1.00 . E A . 111 HEC HMD2 1 1 8 15032 5 2 1 HEC HMD3 H -1.325 2.589 -2.816 1.00 . E A . 111 HEC HMD3 1 1 8 15033 5 2 1 HEC NA N -0.587 2.978 -9.653 1.00 . E A . 111 HEC NA 1 1 8 15034 5 2 1 HEC NB N -1.807 0.453 -10.222 1.00 . E A . 111 HEC NB 1 1 8 15035 5 2 1 HEC NC N -2.533 0.214 -7.452 1.00 . E A . 111 HEC NC 1 1 8 15036 5 2 1 HEC ND N -1.403 2.781 -6.936 1.00 . E A . 111 HEC ND 1 1 8 15037 5 2 1 HEC O1A O 2.838 8.471 -11.401 1.00 . E A . 111 HEC O1A 1 1 8 15038 5 2 1 HEC O1D O 0.661 8.527 -4.214 1.00 . E A . 111 HEC O1D 1 1 8 15039 5 2 1 HEC O2A O 2.976 6.946 -13.018 1.00 . E A . 111 HEC O2A 1 1 8 15040 5 2 1 HEC O2D O -0.562 8.751 -6.062 1.00 . E A . 111 HEC O2D 1 1 9 15041 1 1 1 ALA C C -1.626 3.762 20.951 1.00 . A A . 1 ALA C 1 1 9 15042 1 1 1 ALA CA C -0.502 2.945 21.593 1.00 . A A . 1 ALA CA 1 1 9 15043 1 1 1 ALA CB C -0.095 1.742 20.739 1.00 . A A . 1 ALA CB 1 1 9 15044 1 1 1 ALA H1 H -1.879 2.797 23.077 1.00 . A A . 1 ALA H1 1 1 9 15045 1 1 1 ALA H2 H -0.894 1.474 22.935 1.00 . A A . 1 ALA H2 1 1 9 15046 1 1 1 ALA HA H 0.368 3.586 21.733 1.00 . A A . 1 ALA HA 1 1 9 15047 1 1 1 ALA HB1 H -0.752 0.901 20.959 1.00 . A A . 1 ALA HB1 1 1 9 15048 1 1 1 ALA HB2 H -0.178 2.001 19.683 1.00 . A A . 1 ALA HB2 1 1 9 15049 1 1 1 ALA HB3 H 0.935 1.468 20.965 1.00 . A A . 1 ALA HB3 1 1 9 15050 1 1 1 ALA N N -0.929 2.487 22.903 1.00 . A A . 1 ALA N 1 1 9 15051 1 1 1 ALA O O -2.778 3.677 21.373 1.00 . A A . 1 ALA O 1 1 9 15052 1 1 2 PRO C C -3.082 4.543 18.285 1.00 . A A . 2 PRO C 1 1 9 15053 1 1 2 PRO CA C -2.203 5.385 19.212 1.00 . A A . 2 PRO CA 1 1 9 15054 1 1 2 PRO CB C -1.365 6.410 18.465 1.00 . A A . 2 PRO CB 1 1 9 15055 1 1 2 PRO CD C 0.115 4.679 19.388 1.00 . A A . 2 PRO CD 1 1 9 15056 1 1 2 PRO CG C 0.041 5.834 18.403 1.00 . A A . 2 PRO CG 1 1 9 15057 1 1 2 PRO HA H -2.827 5.819 19.861 1.00 . A A . 2 PRO HA 1 1 9 15058 1 1 2 PRO HB2 H -1.760 6.583 17.464 1.00 . A A . 2 PRO HB2 1 1 9 15059 1 1 2 PRO HB3 H -1.371 7.371 18.980 1.00 . A A . 2 PRO HB3 1 1 9 15060 1 1 2 PRO HD2 H 0.436 3.760 18.898 1.00 . A A . 2 PRO HD2 1 1 9 15061 1 1 2 PRO HD3 H 0.832 4.883 20.184 1.00 . A A . 2 PRO HD3 1 1 9 15062 1 1 2 PRO HG2 H 0.268 5.490 17.394 1.00 . A A . 2 PRO HG2 1 1 9 15063 1 1 2 PRO HG3 H 0.778 6.597 18.653 1.00 . A A . 2 PRO HG3 1 1 9 15064 1 1 2 PRO N N -1.241 4.554 19.915 1.00 . A A . 2 PRO N 1 1 9 15065 1 1 2 PRO O O -2.599 3.613 17.641 1.00 . A A . 2 PRO O 1 1 9 15066 1 1 3 LYS C C -5.102 4.592 15.952 1.00 . A A . 3 LYS C 1 1 9 15067 1 1 3 LYS CA C -5.309 4.186 17.413 1.00 . A A . 3 LYS CA 1 1 9 15068 1 1 3 LYS CB C -6.737 4.408 17.916 1.00 . A A . 3 LYS CB 1 1 9 15069 1 1 3 LYS CD C -8.727 3.244 18.938 1.00 . A A . 3 LYS CD 1 1 9 15070 1 1 3 LYS CE C -9.328 1.875 18.611 1.00 . A A . 3 LYS CE 1 1 9 15071 1 1 3 LYS CG C -7.206 3.229 18.771 1.00 . A A . 3 LYS CG 1 1 9 15072 1 1 3 LYS H H -4.743 5.655 18.776 1.00 . A A . 3 LYS H 1 1 9 15073 1 1 3 LYS HA H -5.095 3.121 17.509 1.00 . A A . 3 LYS HA 1 1 9 15074 1 1 3 LYS HB2 H -6.781 5.327 18.501 1.00 . A A . 3 LYS HB2 1 1 9 15075 1 1 3 LYS HB3 H -7.409 4.537 17.068 1.00 . A A . 3 LYS HB3 1 1 9 15076 1 1 3 LYS HD2 H -8.982 3.522 19.961 1.00 . A A . 3 LYS HD2 1 1 9 15077 1 1 3 LYS HD3 H -9.160 4.001 18.285 1.00 . A A . 3 LYS HD3 1 1 9 15078 1 1 3 LYS HE2 H -8.921 1.509 17.668 1.00 . A A . 3 LYS HE2 1 1 9 15079 1 1 3 LYS HE3 H -9.048 1.156 19.380 1.00 . A A . 3 LYS HE3 1 1 9 15080 1 1 3 LYS HG2 H -6.897 2.293 18.307 1.00 . A A . 3 LYS HG2 1 1 9 15081 1 1 3 LYS HG3 H -6.729 3.273 19.750 1.00 . A A . 3 LYS HG3 1 1 9 15082 1 1 3 LYS HZ1 H -11.254 1.690 19.385 1.00 . A A . 3 LYS HZ1 1 1 9 15083 1 1 3 LYS HZ2 H -11.113 2.908 18.313 1.00 . A A . 3 LYS HZ2 1 1 9 15084 1 1 3 LYS N N -4.358 4.898 18.249 1.00 . A A . 3 LYS N 1 1 9 15085 1 1 3 LYS NZ N -10.802 1.965 18.519 1.00 . A A . 3 LYS NZ 1 1 9 15086 1 1 3 LYS O O -4.358 5.528 15.664 1.00 . A A . 3 LYS O 1 1 9 15087 1 1 4 ALA C C -6.298 5.505 13.346 1.00 . A A . 4 ALA C 1 1 9 15088 1 1 4 ALA CA C -5.673 4.141 13.645 1.00 . A A . 4 ALA CA 1 1 9 15089 1 1 4 ALA CB C -6.338 3.009 12.860 1.00 . A A . 4 ALA CB 1 1 9 15090 1 1 4 ALA H H -6.378 3.109 15.312 1.00 . A A . 4 ALA H 1 1 9 15091 1 1 4 ALA HA H -4.614 4.172 13.388 1.00 . A A . 4 ALA HA 1 1 9 15092 1 1 4 ALA HB1 H -5.993 2.049 13.243 1.00 . A A . 4 ALA HB1 1 1 9 15093 1 1 4 ALA HB2 H -7.420 3.077 12.971 1.00 . A A . 4 ALA HB2 1 1 9 15094 1 1 4 ALA HB3 H -6.075 3.095 11.806 1.00 . A A . 4 ALA HB3 1 1 9 15095 1 1 4 ALA N N -5.774 3.868 15.069 1.00 . A A . 4 ALA N 1 1 9 15096 1 1 4 ALA O O -7.155 5.976 14.093 1.00 . A A . 4 ALA O 1 1 9 15097 1 1 5 PRO C C -7.740 7.297 11.214 1.00 . A A . 5 PRO C 1 1 9 15098 1 1 5 PRO CA C -6.339 7.417 11.817 1.00 . A A . 5 PRO CA 1 1 9 15099 1 1 5 PRO CB C -5.311 7.947 10.830 1.00 . A A . 5 PRO CB 1 1 9 15100 1 1 5 PRO CD C -4.820 5.588 11.316 1.00 . A A . 5 PRO CD 1 1 9 15101 1 1 5 PRO CG C -4.514 6.737 10.369 1.00 . A A . 5 PRO CG 1 1 9 15102 1 1 5 PRO HA H -6.434 8.017 12.611 1.00 . A A . 5 PRO HA 1 1 9 15103 1 1 5 PRO HB2 H -5.796 8.439 9.988 1.00 . A A . 5 PRO HB2 1 1 9 15104 1 1 5 PRO HB3 H -4.662 8.685 11.302 1.00 . A A . 5 PRO HB3 1 1 9 15105 1 1 5 PRO HD2 H -5.188 4.717 10.775 1.00 . A A . 5 PRO HD2 1 1 9 15106 1 1 5 PRO HD3 H -3.928 5.274 11.858 1.00 . A A . 5 PRO HD3 1 1 9 15107 1 1 5 PRO HG2 H -4.782 6.471 9.347 1.00 . A A . 5 PRO HG2 1 1 9 15108 1 1 5 PRO HG3 H -3.447 6.960 10.371 1.00 . A A . 5 PRO HG3 1 1 9 15109 1 1 5 PRO N N -5.834 6.116 12.224 1.00 . A A . 5 PRO N 1 1 9 15110 1 1 5 PRO O O -8.210 6.193 10.943 1.00 . A A . 5 PRO O 1 1 9 15111 1 1 6 ALA C C -9.706 7.754 9.112 1.00 . A A . 6 ALA C 1 1 9 15112 1 1 6 ALA CA C -9.705 8.486 10.455 1.00 . A A . 6 ALA CA 1 1 9 15113 1 1 6 ALA CB C -10.164 9.940 10.329 1.00 . A A . 6 ALA CB 1 1 9 15114 1 1 6 ALA H H -7.977 9.341 11.244 1.00 . A A . 6 ALA H 1 1 9 15115 1 1 6 ALA HA H -10.371 7.966 11.144 1.00 . A A . 6 ALA HA 1 1 9 15116 1 1 6 ALA HB1 H -9.305 10.603 10.428 1.00 . A A . 6 ALA HB1 1 1 9 15117 1 1 6 ALA HB2 H -10.628 10.090 9.354 1.00 . A A . 6 ALA HB2 1 1 9 15118 1 1 6 ALA HB3 H -10.888 10.162 11.113 1.00 . A A . 6 ALA HB3 1 1 9 15119 1 1 6 ALA N N -8.367 8.448 11.021 1.00 . A A . 6 ALA N 1 1 9 15120 1 1 6 ALA O O -8.665 7.287 8.654 1.00 . A A . 6 ALA O 1 1 9 15121 1 1 7 ASP C C -10.921 8.042 6.111 1.00 . A A . 7 ASP C 1 1 9 15122 1 1 7 ASP CA C -11.039 7.011 7.235 1.00 . A A . 7 ASP CA 1 1 9 15123 1 1 7 ASP CB C -12.410 6.342 7.121 1.00 . A A . 7 ASP CB 1 1 9 15124 1 1 7 ASP CG C -12.874 5.598 8.375 1.00 . A A . 7 ASP CG 1 1 9 15125 1 1 7 ASP H H -11.730 8.061 8.896 1.00 . A A . 7 ASP H 1 1 9 15126 1 1 7 ASP HA H -10.243 6.267 7.204 1.00 . A A . 7 ASP HA 1 1 9 15127 1 1 7 ASP HB2 H -13.150 7.103 6.874 1.00 . A A . 7 ASP HB2 1 1 9 15128 1 1 7 ASP HB3 H -12.386 5.639 6.288 1.00 . A A . 7 ASP HB3 1 1 9 15129 1 1 7 ASP N N -10.888 7.678 8.517 1.00 . A A . 7 ASP N 1 1 9 15130 1 1 7 ASP O O -10.855 9.243 6.371 1.00 . A A . 7 ASP O 1 1 9 15131 1 1 7 ASP OD1 O -12.083 4.762 8.864 1.00 . A A . 7 ASP OD1 1 1 9 15132 1 1 7 ASP OD2 O -14.008 5.883 8.817 1.00 . A A . 7 ASP OD2 1 1 9 15133 1 1 8 GLY C C -9.352 8.893 3.540 1.00 . A A . 8 GLY C 1 1 9 15134 1 1 8 GLY CA C -10.789 8.399 3.723 1.00 . A A . 8 GLY CA 1 1 9 15135 1 1 8 GLY H H -10.953 6.559 4.685 1.00 . A A . 8 GLY H 1 1 9 15136 1 1 8 GLY HA2 H -11.107 7.856 2.833 1.00 . A A . 8 GLY HA2 1 1 9 15137 1 1 8 GLY HA3 H -11.459 9.251 3.833 1.00 . A A . 8 GLY HA3 1 1 9 15138 1 1 8 GLY N N -10.898 7.536 4.887 1.00 . A A . 8 GLY N 1 1 9 15139 1 1 8 GLY O O -9.124 9.931 2.920 1.00 . A A . 8 GLY O 1 1 9 15140 1 1 9 LEU C C -6.511 8.164 2.585 1.00 . A A . 9 LEU C 1 1 9 15141 1 1 9 LEU CA C -7.014 8.474 3.996 1.00 . A A . 9 LEU CA 1 1 9 15142 1 1 9 LEU CB C -6.216 7.779 5.100 1.00 . A A . 9 LEU CB 1 1 9 15143 1 1 9 LEU CD1 C -4.218 6.435 4.352 1.00 . A A . 9 LEU CD1 1 1 9 15144 1 1 9 LEU CD2 C -4.235 8.957 4.075 1.00 . A A . 9 LEU CD2 1 1 9 15145 1 1 9 LEU CG C -4.696 7.771 4.925 1.00 . A A . 9 LEU CG 1 1 9 15146 1 1 9 LEU H H -8.617 7.285 4.592 1.00 . A A . 9 LEU H 1 1 9 15147 1 1 9 LEU HA H -6.931 9.548 4.164 1.00 . A A . 9 LEU HA 1 1 9 15148 1 1 9 LEU HB2 H -6.449 8.262 6.049 1.00 . A A . 9 LEU HB2 1 1 9 15149 1 1 9 LEU HB3 H -6.559 6.747 5.175 1.00 . A A . 9 LEU HB3 1 1 9 15150 1 1 9 LEU HD11 H -4.888 5.640 4.677 1.00 . A A . 9 LEU HD11 1 1 9 15151 1 1 9 LEU HD12 H -4.215 6.486 3.263 1.00 . A A . 9 LEU HD12 1 1 9 15152 1 1 9 LEU HD13 H -3.208 6.228 4.708 1.00 . A A . 9 LEU HD13 1 1 9 15153 1 1 9 LEU HD21 H -4.953 9.772 4.169 1.00 . A A . 9 LEU HD21 1 1 9 15154 1 1 9 LEU HD22 H -3.257 9.292 4.419 1.00 . A A . 9 LEU HD22 1 1 9 15155 1 1 9 LEU HD23 H -4.168 8.651 3.031 1.00 . A A . 9 LEU HD23 1 1 9 15156 1 1 9 LEU HG H -4.238 7.882 5.908 1.00 . A A . 9 LEU HG 1 1 9 15157 1 1 9 LEU N N -8.422 8.127 4.090 1.00 . A A . 9 LEU N 1 1 9 15158 1 1 9 LEU O O -6.225 7.012 2.263 1.00 . A A . 9 LEU O 1 1 9 15159 1 1 10 LYS C C -4.567 9.699 0.277 1.00 . A A . 10 LYS C 1 1 9 15160 1 1 10 LYS CA C -5.954 9.067 0.411 1.00 . A A . 10 LYS CA 1 1 9 15161 1 1 10 LYS CB C -6.985 9.634 -0.567 1.00 . A A . 10 LYS CB 1 1 9 15162 1 1 10 LYS CD C -7.666 11.763 -1.735 1.00 . A A . 10 LYS CD 1 1 9 15163 1 1 10 LYS CE C -7.907 11.438 -3.210 1.00 . A A . 10 LYS CE 1 1 9 15164 1 1 10 LYS CG C -6.496 10.949 -1.178 1.00 . A A . 10 LYS CG 1 1 9 15165 1 1 10 LYS H H -6.652 10.147 2.050 1.00 . A A . 10 LYS H 1 1 9 15166 1 1 10 LYS HA H -5.869 8.000 0.207 1.00 . A A . 10 LYS HA 1 1 9 15167 1 1 10 LYS HB2 H -7.177 8.910 -1.359 1.00 . A A . 10 LYS HB2 1 1 9 15168 1 1 10 LYS HB3 H -7.930 9.798 -0.050 1.00 . A A . 10 LYS HB3 1 1 9 15169 1 1 10 LYS HD2 H -8.567 11.551 -1.160 1.00 . A A . 10 LYS HD2 1 1 9 15170 1 1 10 LYS HD3 H -7.459 12.827 -1.622 1.00 . A A . 10 LYS HD3 1 1 9 15171 1 1 10 LYS HE2 H -7.660 12.304 -3.824 1.00 . A A . 10 LYS HE2 1 1 9 15172 1 1 10 LYS HE3 H -7.248 10.627 -3.522 1.00 . A A . 10 LYS HE3 1 1 9 15173 1 1 10 LYS HG2 H -5.970 11.532 -0.422 1.00 . A A . 10 LYS HG2 1 1 9 15174 1 1 10 LYS HG3 H -5.781 10.741 -1.974 1.00 . A A . 10 LYS HG3 1 1 9 15175 1 1 10 LYS HZ1 H -9.529 10.932 -4.416 1.00 . A A . 10 LYS HZ1 1 1 9 15176 1 1 10 LYS HZ2 H -9.549 10.177 -2.973 1.00 . A A . 10 LYS HZ2 1 1 9 15177 1 1 10 LYS N N -6.417 9.213 1.780 1.00 . A A . 10 LYS N 1 1 9 15178 1 1 10 LYS NZ N -9.318 11.052 -3.432 1.00 . A A . 10 LYS NZ 1 1 9 15179 1 1 10 LYS O O -4.218 10.605 1.032 1.00 . A A . 10 LYS O 1 1 9 15180 1 1 11 MET C C -2.275 10.045 -2.409 1.00 . A A . 11 MET C 1 1 9 15181 1 1 11 MET CA C -2.472 9.698 -0.932 1.00 . A A . 11 MET CA 1 1 9 15182 1 1 11 MET CB C -1.447 8.641 -0.514 1.00 . A A . 11 MET CB 1 1 9 15183 1 1 11 MET CE C -0.495 5.096 -0.168 1.00 . A A . 11 MET CE 1 1 9 15184 1 1 11 MET CG C -1.719 7.307 -1.213 1.00 . A A . 11 MET CG 1 1 9 15185 1 1 11 MET H H -4.104 8.458 -1.299 1.00 . A A . 11 MET H 1 1 9 15186 1 1 11 MET HA H -2.383 10.599 -0.325 1.00 . A A . 11 MET HA 1 1 9 15187 1 1 11 MET HB2 H -0.442 8.987 -0.760 1.00 . A A . 11 MET HB2 1 1 9 15188 1 1 11 MET HB3 H -1.481 8.504 0.566 1.00 . A A . 11 MET HB3 1 1 9 15189 1 1 11 MET HE1 H 0.358 5.774 -0.126 1.00 . A A . 11 MET HE1 1 1 9 15190 1 1 11 MET HE2 H -0.423 4.372 0.643 1.00 . A A . 11 MET HE2 1 1 9 15191 1 1 11 MET HE3 H -0.496 4.573 -1.124 1.00 . A A . 11 MET HE3 1 1 9 15192 1 1 11 MET HG2 H -2.585 7.400 -1.867 1.00 . A A . 11 MET HG2 1 1 9 15193 1 1 11 MET HG3 H -0.871 7.038 -1.843 1.00 . A A . 11 MET HG3 1 1 9 15194 1 1 11 MET N N -3.813 9.195 -0.689 1.00 . A A . 11 MET N 1 1 9 15195 1 1 11 MET O O -2.346 9.170 -3.270 1.00 . A A . 11 MET O 1 1 9 15196 1 1 11 MET SD S -2.007 6.030 0.001 1.00 . A A . 11 MET SD 1 1 9 15197 1 1 12 GLU C C -0.364 12.207 -4.216 1.00 . A A . 12 GLU C 1 1 9 15198 1 1 12 GLU CA C -1.824 11.797 -4.014 1.00 . A A . 12 GLU CA 1 1 9 15199 1 1 12 GLU CB C -2.769 12.955 -4.341 1.00 . A A . 12 GLU CB 1 1 9 15200 1 1 12 GLU CD C -1.691 14.190 -6.258 1.00 . A A . 12 GLU CD 1 1 9 15201 1 1 12 GLU CG C -2.805 13.225 -5.847 1.00 . A A . 12 GLU CG 1 1 9 15202 1 1 12 GLU H H -1.974 12.029 -1.949 1.00 . A A . 12 GLU H 1 1 9 15203 1 1 12 GLU HA H -2.062 10.949 -4.656 1.00 . A A . 12 GLU HA 1 1 9 15204 1 1 12 GLU HB2 H -3.772 12.722 -3.986 1.00 . A A . 12 GLU HB2 1 1 9 15205 1 1 12 GLU HB3 H -2.445 13.853 -3.815 1.00 . A A . 12 GLU HB3 1 1 9 15206 1 1 12 GLU HG2 H -2.697 12.286 -6.391 1.00 . A A . 12 GLU HG2 1 1 9 15207 1 1 12 GLU HG3 H -3.773 13.643 -6.122 1.00 . A A . 12 GLU HG3 1 1 9 15208 1 1 12 GLU N N -2.031 11.323 -2.656 1.00 . A A . 12 GLU N 1 1 9 15209 1 1 12 GLU O O -0.066 13.386 -4.401 1.00 . A A . 12 GLU O 1 1 9 15210 1 1 12 GLU OE1 O -1.707 15.328 -5.741 1.00 . A A . 12 GLU OE1 1 1 9 15211 1 1 12 GLU OE2 O -0.849 13.768 -7.079 1.00 . A A . 12 GLU OE2 1 1 9 15212 1 1 13 ALA C C 2.309 11.202 -5.811 1.00 . A A . 13 ALA C 1 1 9 15213 1 1 13 ALA CA C 1.931 11.453 -4.350 1.00 . A A . 13 ALA CA 1 1 9 15214 1 1 13 ALA CB C 2.722 10.571 -3.382 1.00 . A A . 13 ALA CB 1 1 9 15215 1 1 13 ALA H H 0.259 10.254 -4.023 1.00 . A A . 13 ALA H 1 1 9 15216 1 1 13 ALA HA H 2.122 12.498 -4.108 1.00 . A A . 13 ALA HA 1 1 9 15217 1 1 13 ALA HB1 H 2.428 10.800 -2.358 1.00 . A A . 13 ALA HB1 1 1 9 15218 1 1 13 ALA HB2 H 2.515 9.522 -3.594 1.00 . A A . 13 ALA HB2 1 1 9 15219 1 1 13 ALA HB3 H 3.788 10.762 -3.505 1.00 . A A . 13 ALA HB3 1 1 9 15220 1 1 13 ALA N N 0.509 11.210 -4.174 1.00 . A A . 13 ALA N 1 1 9 15221 1 1 13 ALA O O 3.388 11.595 -6.252 1.00 . A A . 13 ALA O 1 1 9 15222 1 1 14 THR C C 0.460 10.743 -8.773 1.00 . A A . 14 THR C 1 1 9 15223 1 1 14 THR CA C 1.627 10.239 -7.922 1.00 . A A . 14 THR CA 1 1 9 15224 1 1 14 THR CB C 1.861 8.732 -8.043 1.00 . A A . 14 THR CB 1 1 9 15225 1 1 14 THR CG2 C 2.639 8.163 -6.854 1.00 . A A . 14 THR CG2 1 1 9 15226 1 1 14 THR H H 0.527 10.231 -6.153 1.00 . A A . 14 THR H 1 1 9 15227 1 1 14 THR HA H 2.518 10.774 -8.252 1.00 . A A . 14 THR HA 1 1 9 15228 1 1 14 THR HB H 2.355 8.489 -8.983 1.00 . A A . 14 THR HB 1 1 9 15229 1 1 14 THR HG1 H 0.104 8.546 -7.103 1.00 . A A . 14 THR HG1 1 1 9 15230 1 1 14 THR HG21 H 3.574 8.710 -6.736 1.00 . A A . 14 THR HG21 1 1 9 15231 1 1 14 THR HG22 H 2.042 8.264 -5.948 1.00 . A A . 14 THR HG22 1 1 9 15232 1 1 14 THR HG23 H 2.855 7.110 -7.032 1.00 . A A . 14 THR HG23 1 1 9 15233 1 1 14 THR N N 1.401 10.548 -6.520 1.00 . A A . 14 THR N 1 1 9 15234 1 1 14 THR O O -0.514 11.275 -8.245 1.00 . A A . 14 THR O 1 1 9 15235 1 1 14 THR OG1 O 0.560 8.167 -7.908 1.00 . A A . 14 THR OG1 1 1 9 15236 1 1 15 LYS C C -1.705 10.172 -10.764 1.00 . A A . 15 LYS C 1 1 9 15237 1 1 15 LYS CA C -0.433 10.987 -11.008 1.00 . A A . 15 LYS CA 1 1 9 15238 1 1 15 LYS CB C 0.080 10.912 -12.448 1.00 . A A . 15 LYS CB 1 1 9 15239 1 1 15 LYS CD C -0.176 11.940 -14.736 1.00 . A A . 15 LYS CD 1 1 9 15240 1 1 15 LYS CE C -1.133 11.733 -15.911 1.00 . A A . 15 LYS CE 1 1 9 15241 1 1 15 LYS CG C -0.868 11.637 -13.405 1.00 . A A . 15 LYS CG 1 1 9 15242 1 1 15 LYS H H 1.394 10.123 -10.500 1.00 . A A . 15 LYS H 1 1 9 15243 1 1 15 LYS HA H -0.647 12.034 -10.797 1.00 . A A . 15 LYS HA 1 1 9 15244 1 1 15 LYS HB2 H 1.073 11.356 -12.508 1.00 . A A . 15 LYS HB2 1 1 9 15245 1 1 15 LYS HB3 H 0.179 9.869 -12.748 1.00 . A A . 15 LYS HB3 1 1 9 15246 1 1 15 LYS HD2 H 0.187 12.968 -14.735 1.00 . A A . 15 LYS HD2 1 1 9 15247 1 1 15 LYS HD3 H 0.695 11.295 -14.853 1.00 . A A . 15 LYS HD3 1 1 9 15248 1 1 15 LYS HE2 H -1.939 11.059 -15.618 1.00 . A A . 15 LYS HE2 1 1 9 15249 1 1 15 LYS HE3 H -1.595 12.682 -16.184 1.00 . A A . 15 LYS HE3 1 1 9 15250 1 1 15 LYS HG2 H -1.751 11.023 -13.582 1.00 . A A . 15 LYS HG2 1 1 9 15251 1 1 15 LYS HG3 H -1.211 12.565 -12.950 1.00 . A A . 15 LYS HG3 1 1 9 15252 1 1 15 LYS HZ1 H 0.568 11.004 -16.870 1.00 . A A . 15 LYS HZ1 1 1 9 15253 1 1 15 LYS HZ2 H -0.804 10.289 -17.378 1.00 . A A . 15 LYS HZ2 1 1 9 15254 1 1 15 LYS N N 0.598 10.557 -10.078 1.00 . A A . 15 LYS N 1 1 9 15255 1 1 15 LYS NZ N -0.411 11.173 -17.076 1.00 . A A . 15 LYS NZ 1 1 9 15256 1 1 15 LYS O O -2.767 10.501 -11.291 1.00 . A A . 15 LYS O 1 1 9 15257 1 1 16 GLN C C -2.853 8.155 -8.130 1.00 . A A . 16 GLN C 1 1 9 15258 1 1 16 GLN CA C -2.679 8.261 -9.647 1.00 . A A . 16 GLN CA 1 1 9 15259 1 1 16 GLN CB C -2.503 6.878 -10.276 1.00 . A A . 16 GLN CB 1 1 9 15260 1 1 16 GLN CD C -3.335 6.792 -12.656 1.00 . A A . 16 GLN CD 1 1 9 15261 1 1 16 GLN CG C -2.116 6.993 -11.752 1.00 . A A . 16 GLN CG 1 1 9 15262 1 1 16 GLN H H -0.688 8.866 -9.541 1.00 . A A . 16 GLN H 1 1 9 15263 1 1 16 GLN HA H -3.551 8.746 -10.086 1.00 . A A . 16 GLN HA 1 1 9 15264 1 1 16 GLN HB2 H -1.734 6.324 -9.737 1.00 . A A . 16 GLN HB2 1 1 9 15265 1 1 16 GLN HB3 H -3.429 6.311 -10.182 1.00 . A A . 16 GLN HB3 1 1 9 15266 1 1 16 GLN HE21 H -3.497 4.906 -11.938 1.00 . A A . 16 GLN HE21 1 1 9 15267 1 1 16 GLN HE22 H -4.688 5.357 -13.112 1.00 . A A . 16 GLN HE22 1 1 9 15268 1 1 16 GLN HG2 H -1.676 7.972 -11.942 1.00 . A A . 16 GLN HG2 1 1 9 15269 1 1 16 GLN HG3 H -1.355 6.250 -11.991 1.00 . A A . 16 GLN HG3 1 1 9 15270 1 1 16 GLN N N -1.555 9.126 -9.966 1.00 . A A . 16 GLN N 1 1 9 15271 1 1 16 GLN NE2 N -3.885 5.585 -12.561 1.00 . A A . 16 GLN NE2 1 1 9 15272 1 1 16 GLN O O -2.130 7.411 -7.470 1.00 . A A . 16 GLN O 1 1 9 15273 1 1 16 GLN OE1 O -3.748 7.674 -13.390 1.00 . A A . 16 GLN OE1 1 1 9 15274 1 1 17 PRO C C -4.854 7.655 -5.768 1.00 . A A . 17 PRO C 1 1 9 15275 1 1 17 PRO CA C -4.119 8.932 -6.184 1.00 . A A . 17 PRO CA 1 1 9 15276 1 1 17 PRO CB C -4.934 10.192 -5.942 1.00 . A A . 17 PRO CB 1 1 9 15277 1 1 17 PRO CD C -4.717 9.825 -8.362 1.00 . A A . 17 PRO CD 1 1 9 15278 1 1 17 PRO CG C -5.476 10.604 -7.301 1.00 . A A . 17 PRO CG 1 1 9 15279 1 1 17 PRO HA H -3.265 8.937 -5.663 1.00 . A A . 17 PRO HA 1 1 9 15280 1 1 17 PRO HB2 H -5.746 10.003 -5.239 1.00 . A A . 17 PRO HB2 1 1 9 15281 1 1 17 PRO HB3 H -4.316 10.980 -5.512 1.00 . A A . 17 PRO HB3 1 1 9 15282 1 1 17 PRO HD2 H -5.397 9.265 -9.005 1.00 . A A . 17 PRO HD2 1 1 9 15283 1 1 17 PRO HD3 H -4.144 10.490 -9.008 1.00 . A A . 17 PRO HD3 1 1 9 15284 1 1 17 PRO HG2 H -6.544 10.396 -7.365 1.00 . A A . 17 PRO HG2 1 1 9 15285 1 1 17 PRO HG3 H -5.351 11.676 -7.452 1.00 . A A . 17 PRO HG3 1 1 9 15286 1 1 17 PRO N N -3.841 8.931 -7.610 1.00 . A A . 17 PRO N 1 1 9 15287 1 1 17 PRO O O -5.431 6.966 -6.607 1.00 . A A . 17 PRO O 1 1 9 15288 1 1 18 VAL C C -6.085 6.538 -2.579 1.00 . A A . 18 VAL C 1 1 9 15289 1 1 18 VAL CA C -5.463 6.199 -3.935 1.00 . A A . 18 VAL CA 1 1 9 15290 1 1 18 VAL CB C -4.470 5.038 -3.864 1.00 . A A . 18 VAL CB 1 1 9 15291 1 1 18 VAL CG1 C -5.097 3.821 -3.181 1.00 . A A . 18 VAL CG1 1 1 9 15292 1 1 18 VAL CG2 C -3.947 4.677 -5.256 1.00 . A A . 18 VAL CG2 1 1 9 15293 1 1 18 VAL H H -4.338 7.946 -3.797 1.00 . A A . 18 VAL H 1 1 9 15294 1 1 18 VAL HA H -6.259 5.920 -4.627 1.00 . A A . 18 VAL HA 1 1 9 15295 1 1 18 VAL HB H -3.621 5.360 -3.261 1.00 . A A . 18 VAL HB 1 1 9 15296 1 1 18 VAL HG11 H -6.150 3.754 -3.454 1.00 . A A . 18 VAL HG11 1 1 9 15297 1 1 18 VAL HG12 H -4.580 2.917 -3.504 1.00 . A A . 18 VAL HG12 1 1 9 15298 1 1 18 VAL HG13 H -5.007 3.924 -2.100 1.00 . A A . 18 VAL HG13 1 1 9 15299 1 1 18 VAL HG21 H -4.668 4.995 -6.009 1.00 . A A . 18 VAL HG21 1 1 9 15300 1 1 18 VAL HG22 H -2.996 5.181 -5.429 1.00 . A A . 18 VAL HG22 1 1 9 15301 1 1 18 VAL HG23 H -3.804 3.598 -5.322 1.00 . A A . 18 VAL HG23 1 1 9 15302 1 1 18 VAL N N -4.809 7.380 -4.473 1.00 . A A . 18 VAL N 1 1 9 15303 1 1 18 VAL O O -5.630 7.453 -1.895 1.00 . A A . 18 VAL O 1 1 9 15304 1 1 19 VAL C C -7.723 4.714 -0.131 1.00 . A A . 19 VAL C 1 1 9 15305 1 1 19 VAL CA C -7.805 5.991 -0.969 1.00 . A A . 19 VAL CA 1 1 9 15306 1 1 19 VAL CB C -9.243 6.445 -1.227 1.00 . A A . 19 VAL CB 1 1 9 15307 1 1 19 VAL CG1 C -10.073 6.393 0.057 1.00 . A A . 19 VAL CG1 1 1 9 15308 1 1 19 VAL CG2 C -9.273 7.845 -1.844 1.00 . A A . 19 VAL CG2 1 1 9 15309 1 1 19 VAL H H -7.479 5.039 -2.793 1.00 . A A . 19 VAL H 1 1 9 15310 1 1 19 VAL HA H -7.287 6.792 -0.441 1.00 . A A . 19 VAL HA 1 1 9 15311 1 1 19 VAL HB H -9.689 5.755 -1.943 1.00 . A A . 19 VAL HB 1 1 9 15312 1 1 19 VAL HG11 H -9.428 6.132 0.896 1.00 . A A . 19 VAL HG11 1 1 9 15313 1 1 19 VAL HG12 H -10.526 7.369 0.236 1.00 . A A . 19 VAL HG12 1 1 9 15314 1 1 19 VAL HG13 H -10.856 5.642 -0.047 1.00 . A A . 19 VAL HG13 1 1 9 15315 1 1 19 VAL HG21 H -8.454 7.947 -2.555 1.00 . A A . 19 VAL HG21 1 1 9 15316 1 1 19 VAL HG22 H -10.222 7.995 -2.359 1.00 . A A . 19 VAL HG22 1 1 9 15317 1 1 19 VAL HG23 H -9.165 8.591 -1.056 1.00 . A A . 19 VAL HG23 1 1 9 15318 1 1 19 VAL N N -7.116 5.782 -2.231 1.00 . A A . 19 VAL N 1 1 9 15319 1 1 19 VAL O O -8.278 3.683 -0.507 1.00 . A A . 19 VAL O 1 1 9 15320 1 1 20 PHE C C -7.810 3.797 3.082 1.00 . A A . 20 PHE C 1 1 9 15321 1 1 20 PHE CA C -6.864 3.691 1.885 1.00 . A A . 20 PHE CA 1 1 9 15322 1 1 20 PHE CB C -5.419 3.752 2.386 1.00 . A A . 20 PHE CB 1 1 9 15323 1 1 20 PHE CD1 C -4.875 1.303 2.638 1.00 . A A . 20 PHE CD1 1 1 9 15324 1 1 20 PHE CD2 C -4.748 2.698 4.576 1.00 . A A . 20 PHE CD2 1 1 9 15325 1 1 20 PHE CE1 C -4.481 0.167 3.431 1.00 . A A . 20 PHE CE1 1 1 9 15326 1 1 20 PHE CE2 C -4.354 1.561 5.368 1.00 . A A . 20 PHE CE2 1 1 9 15327 1 1 20 PHE CG C -5.000 2.545 3.228 1.00 . A A . 20 PHE CG 1 1 9 15328 1 1 20 PHE CZ C -4.240 0.352 4.756 1.00 . A A . 20 PHE CZ 1 1 9 15329 1 1 20 PHE H H -6.577 5.666 1.290 1.00 . A A . 20 PHE H 1 1 9 15330 1 1 20 PHE HA H -7.097 2.785 1.327 1.00 . A A . 20 PHE HA 1 1 9 15331 1 1 20 PHE HB2 H -4.751 3.833 1.528 1.00 . A A . 20 PHE HB2 1 1 9 15332 1 1 20 PHE HB3 H -5.289 4.658 2.978 1.00 . A A . 20 PHE HB3 1 1 9 15333 1 1 20 PHE HD1 H -5.075 1.183 1.574 1.00 . A A . 20 PHE HD1 1 1 9 15334 1 1 20 PHE HD2 H -4.847 3.679 5.041 1.00 . A A . 20 PHE HD2 1 1 9 15335 1 1 20 PHE HE1 H -4.378 -0.819 2.978 1.00 . A A . 20 PHE HE1 1 1 9 15336 1 1 20 PHE HE2 H -4.151 1.668 6.434 1.00 . A A . 20 PHE HE2 1 1 9 15337 1 1 20 PHE HZ H -3.919 -0.585 5.279 1.00 . A A . 20 PHE HZ 1 1 9 15338 1 1 20 PHE N N -7.026 4.824 0.991 1.00 . A A . 20 PHE N 1 1 9 15339 1 1 20 PHE O O -8.347 4.869 3.361 1.00 . A A . 20 PHE O 1 1 9 15340 1 1 21 ASN C C -8.255 1.692 5.970 1.00 . A A . 21 ASN C 1 1 9 15341 1 1 21 ASN CA C -8.860 2.625 4.919 1.00 . A A . 21 ASN CA 1 1 9 15342 1 1 21 ASN CB C -10.242 2.085 4.547 1.00 . A A . 21 ASN CB 1 1 9 15343 1 1 21 ASN CG C -10.985 3.061 3.633 1.00 . A A . 21 ASN CG 1 1 9 15344 1 1 21 ASN H H -7.547 1.805 3.526 1.00 . A A . 21 ASN H 1 1 9 15345 1 1 21 ASN HA H -8.930 3.656 5.267 1.00 . A A . 21 ASN HA 1 1 9 15346 1 1 21 ASN HB2 H -10.138 1.122 4.048 1.00 . A A . 21 ASN HB2 1 1 9 15347 1 1 21 ASN HB3 H -10.825 1.914 5.452 1.00 . A A . 21 ASN HB3 1 1 9 15348 1 1 21 ASN HD21 H -10.019 2.243 2.053 1.00 . A A . 21 ASN HD21 1 1 9 15349 1 1 21 ASN HD22 H -11.115 3.527 1.666 1.00 . A A . 21 ASN HD22 1 1 9 15350 1 1 21 ASN N N -7.987 2.672 3.759 1.00 . A A . 21 ASN N 1 1 9 15351 1 1 21 ASN ND2 N -10.681 2.933 2.344 1.00 . A A . 21 ASN ND2 1 1 9 15352 1 1 21 ASN O O -7.726 0.634 5.635 1.00 . A A . 21 ASN O 1 1 9 15353 1 1 21 ASN OD1 O -11.781 3.877 4.068 1.00 . A A . 21 ASN OD1 1 1 9 15354 1 1 22 HIS C C -8.934 0.474 8.923 1.00 . A A . 22 HIS C 1 1 9 15355 1 1 22 HIS CA C -7.822 1.335 8.323 1.00 . A A . 22 HIS CA 1 1 9 15356 1 1 22 HIS CB C -7.149 2.239 9.357 1.00 . A A . 22 HIS CB 1 1 9 15357 1 1 22 HIS CD2 C -4.548 1.998 9.259 1.00 . A A . 22 HIS CD2 1 1 9 15358 1 1 22 HIS CE1 C -4.106 3.839 8.162 1.00 . A A . 22 HIS CE1 1 1 9 15359 1 1 22 HIS CG C -5.732 2.626 9.006 1.00 . A A . 22 HIS CG 1 1 9 15360 1 1 22 HIS H H -8.785 2.981 7.485 1.00 . A A . 22 HIS H 1 1 9 15361 1 1 22 HIS HA H -7.056 0.684 7.902 1.00 . A A . 22 HIS HA 1 1 9 15362 1 1 22 HIS HB2 H -7.743 3.145 9.475 1.00 . A A . 22 HIS HB2 1 1 9 15363 1 1 22 HIS HB3 H -7.147 1.732 10.322 1.00 . A A . 22 HIS HB3 1 1 9 15364 1 1 22 HIS HD1 H -6.076 4.462 7.984 1.00 . A A . 22 HIS HD1 1 1 9 15365 1 1 22 HIS HD2 H -4.428 1.054 9.791 1.00 . A A . 22 HIS HD2 1 1 9 15366 1 1 22 HIS HE1 H -3.552 4.630 7.657 1.00 . A A . 22 HIS HE1 1 1 9 15367 1 1 22 HIS N N -8.353 2.119 7.221 1.00 . A A . 22 HIS N 1 1 9 15368 1 1 22 HIS ND1 N -5.420 3.783 8.314 1.00 . A A . 22 HIS ND1 1 1 9 15369 1 1 22 HIS NE2 N -3.566 2.731 8.748 1.00 . A A . 22 HIS NE2 1 1 9 15370 1 1 22 HIS O O -8.661 -0.524 9.589 1.00 . A A . 22 HIS O 1 1 9 15371 1 1 23 SER C C -11.560 -1.090 8.337 1.00 . A A . 23 SER C 1 1 9 15372 1 1 23 SER CA C -11.321 0.169 9.172 1.00 . A A . 23 SER CA 1 1 9 15373 1 1 23 SER CB C -12.569 1.054 9.167 1.00 . A A . 23 SER CB 1 1 9 15374 1 1 23 SER H H -10.379 1.702 8.123 1.00 . A A . 23 SER H 1 1 9 15375 1 1 23 SER HA H -11.068 -0.096 10.199 1.00 . A A . 23 SER HA 1 1 9 15376 1 1 23 SER HB2 H -12.340 1.999 8.674 1.00 . A A . 23 SER HB2 1 1 9 15377 1 1 23 SER HB3 H -13.353 0.571 8.584 1.00 . A A . 23 SER HB3 1 1 9 15378 1 1 23 SER HG H -13.372 0.461 10.902 1.00 . A A . 23 SER HG 1 1 9 15379 1 1 23 SER N N -10.166 0.890 8.666 1.00 . A A . 23 SER N 1 1 9 15380 1 1 23 SER O O -12.480 -1.858 8.614 1.00 . A A . 23 SER O 1 1 9 15381 1 1 23 SER OG O -13.047 1.310 10.484 1.00 . A A . 23 SER OG 1 1 9 15382 1 1 24 THR C C -9.705 -3.418 6.748 1.00 . A A . 24 THR C 1 1 9 15383 1 1 24 THR CA C -10.823 -2.416 6.453 1.00 . A A . 24 THR CA 1 1 9 15384 1 1 24 THR CB C -10.821 -1.912 5.008 1.00 . A A . 24 THR CB 1 1 9 15385 1 1 24 THR CG2 C -10.893 -3.052 3.990 1.00 . A A . 24 THR CG2 1 1 9 15386 1 1 24 THR H H -9.969 -0.635 7.113 1.00 . A A . 24 THR H 1 1 9 15387 1 1 24 THR HA H -11.767 -2.920 6.661 1.00 . A A . 24 THR HA 1 1 9 15388 1 1 24 THR HB H -9.956 -1.276 4.819 1.00 . A A . 24 THR HB 1 1 9 15389 1 1 24 THR HG1 H -12.025 -0.339 5.294 1.00 . A A . 24 THR HG1 1 1 9 15390 1 1 24 THR HG21 H -11.510 -3.857 4.390 1.00 . A A . 24 THR HG21 1 1 9 15391 1 1 24 THR HG22 H -11.333 -2.683 3.063 1.00 . A A . 24 THR HG22 1 1 9 15392 1 1 24 THR HG23 H -9.889 -3.427 3.792 1.00 . A A . 24 THR HG23 1 1 9 15393 1 1 24 THR N N -10.715 -1.264 7.331 1.00 . A A . 24 THR N 1 1 9 15394 1 1 24 THR O O -9.918 -4.628 6.685 1.00 . A A . 24 THR O 1 1 9 15395 1 1 24 THR OG1 O -12.072 -1.244 4.872 1.00 . A A . 24 THR OG1 1 1 9 15396 1 1 25 HIS C C -7.248 -3.859 8.886 1.00 . A A . 25 HIS C 1 1 9 15397 1 1 25 HIS CA C -7.386 -3.709 7.370 1.00 . A A . 25 HIS CA 1 1 9 15398 1 1 25 HIS CB C -6.122 -3.150 6.712 1.00 . A A . 25 HIS CB 1 1 9 15399 1 1 25 HIS CD2 C -5.754 -3.752 4.195 1.00 . A A . 25 HIS CD2 1 1 9 15400 1 1 25 HIS CE1 C -6.818 -2.057 3.310 1.00 . A A . 25 HIS CE1 1 1 9 15401 1 1 25 HIS CG C -6.232 -2.983 5.215 1.00 . A A . 25 HIS CG 1 1 9 15402 1 1 25 HIS H H -8.373 -1.892 7.115 1.00 . A A . 25 HIS H 1 1 9 15403 1 1 25 HIS HA H -7.582 -4.688 6.933 1.00 . A A . 25 HIS HA 1 1 9 15404 1 1 25 HIS HB2 H -5.890 -2.184 7.159 1.00 . A A . 25 HIS HB2 1 1 9 15405 1 1 25 HIS HB3 H -5.286 -3.813 6.933 1.00 . A A . 25 HIS HB3 1 1 9 15406 1 1 25 HIS HD1 H -7.360 -1.179 5.111 1.00 . A A . 25 HIS HD1 1 1 9 15407 1 1 25 HIS HD2 H -5.178 -4.670 4.306 1.00 . A A . 25 HIS HD2 1 1 9 15408 1 1 25 HIS HE1 H -7.243 -1.380 2.570 1.00 . A A . 25 HIS HE1 1 1 9 15409 1 1 25 HIS N N -8.537 -2.877 7.065 1.00 . A A . 25 HIS N 1 1 9 15410 1 1 25 HIS ND1 N -6.897 -1.922 4.626 1.00 . A A . 25 HIS ND1 1 1 9 15411 1 1 25 HIS NE2 N -6.109 -3.192 3.045 1.00 . A A . 25 HIS NE2 1 1 9 15412 1 1 25 HIS O O -6.137 -3.950 9.406 1.00 . A A . 25 HIS O 1 1 9 15413 1 1 26 LYS C C -7.905 -5.406 11.384 1.00 . A A . 26 LYS C 1 1 9 15414 1 1 26 LYS CA C -8.413 -4.015 11.000 1.00 . A A . 26 LYS CA 1 1 9 15415 1 1 26 LYS CB C -9.806 -3.696 11.548 1.00 . A A . 26 LYS CB 1 1 9 15416 1 1 26 LYS CD C -11.688 -2.018 11.592 1.00 . A A . 26 LYS CD 1 1 9 15417 1 1 26 LYS CE C -11.613 -1.028 12.755 1.00 . A A . 26 LYS CE 1 1 9 15418 1 1 26 LYS CG C -10.292 -2.334 11.050 1.00 . A A . 26 LYS CG 1 1 9 15419 1 1 26 LYS H H -9.292 -3.804 9.123 1.00 . A A . 26 LYS H 1 1 9 15420 1 1 26 LYS HA H -7.728 -3.272 11.408 1.00 . A A . 26 LYS HA 1 1 9 15421 1 1 26 LYS HB2 H -10.508 -4.471 11.241 1.00 . A A . 26 LYS HB2 1 1 9 15422 1 1 26 LYS HB3 H -9.782 -3.702 12.637 1.00 . A A . 26 LYS HB3 1 1 9 15423 1 1 26 LYS HD2 H -12.306 -1.604 10.795 1.00 . A A . 26 LYS HD2 1 1 9 15424 1 1 26 LYS HD3 H -12.170 -2.938 11.923 1.00 . A A . 26 LYS HD3 1 1 9 15425 1 1 26 LYS HE2 H -11.282 -1.541 13.657 1.00 . A A . 26 LYS HE2 1 1 9 15426 1 1 26 LYS HE3 H -10.874 -0.257 12.538 1.00 . A A . 26 LYS HE3 1 1 9 15427 1 1 26 LYS HG2 H -9.593 -1.558 11.362 1.00 . A A . 26 LYS HG2 1 1 9 15428 1 1 26 LYS HG3 H -10.311 -2.326 9.960 1.00 . A A . 26 LYS HG3 1 1 9 15429 1 1 26 LYS HZ1 H -13.697 -1.010 12.708 1.00 . A A . 26 LYS HZ1 1 1 9 15430 1 1 26 LYS HZ2 H -13.082 -0.182 13.968 1.00 . A A . 26 LYS HZ2 1 1 9 15431 1 1 26 LYS N N -8.392 -3.879 9.553 1.00 . A A . 26 LYS N 1 1 9 15432 1 1 26 LYS NZ N -12.935 -0.403 12.990 1.00 . A A . 26 LYS NZ 1 1 9 15433 1 1 26 LYS O O -7.220 -5.564 12.393 1.00 . A A . 26 LYS O 1 1 9 15434 1 1 27 SER C C -6.370 -7.925 10.449 1.00 . A A . 27 SER C 1 1 9 15435 1 1 27 SER CA C -7.849 -7.753 10.799 1.00 . A A . 27 SER CA 1 1 9 15436 1 1 27 SER CB C -8.704 -8.733 9.993 1.00 . A A . 27 SER CB 1 1 9 15437 1 1 27 SER H H -8.818 -6.243 9.740 1.00 . A A . 27 SER H 1 1 9 15438 1 1 27 SER HA H -8.012 -7.920 11.864 1.00 . A A . 27 SER HA 1 1 9 15439 1 1 27 SER HB2 H -8.473 -9.753 10.301 1.00 . A A . 27 SER HB2 1 1 9 15440 1 1 27 SER HB3 H -9.757 -8.564 10.215 1.00 . A A . 27 SER HB3 1 1 9 15441 1 1 27 SER HG H -8.202 -9.479 8.205 1.00 . A A . 27 SER HG 1 1 9 15442 1 1 27 SER N N -8.260 -6.380 10.559 1.00 . A A . 27 SER N 1 1 9 15443 1 1 27 SER O O -5.749 -8.915 10.832 1.00 . A A . 27 SER O 1 1 9 15444 1 1 27 SER OG O -8.488 -8.601 8.591 1.00 . A A . 27 SER OG 1 1 9 15445 1 1 28 VAL C C -3.591 -6.365 10.422 1.00 . A A . 28 VAL C 1 1 9 15446 1 1 28 VAL CA C -4.454 -6.977 9.317 1.00 . A A . 28 VAL CA 1 1 9 15447 1 1 28 VAL CB C -4.287 -6.273 7.969 1.00 . A A . 28 VAL CB 1 1 9 15448 1 1 28 VAL CG1 C -2.862 -6.439 7.437 1.00 . A A . 28 VAL CG1 1 1 9 15449 1 1 28 VAL CG2 C -5.313 -6.780 6.954 1.00 . A A . 28 VAL CG2 1 1 9 15450 1 1 28 VAL H H -6.361 -6.144 9.416 1.00 . A A . 28 VAL H 1 1 9 15451 1 1 28 VAL HA H -4.172 -8.022 9.189 1.00 . A A . 28 VAL HA 1 1 9 15452 1 1 28 VAL HB H -4.465 -5.209 8.122 1.00 . A A . 28 VAL HB 1 1 9 15453 1 1 28 VAL HG11 H -2.436 -7.366 7.822 1.00 . A A . 28 VAL HG11 1 1 9 15454 1 1 28 VAL HG12 H -2.882 -6.473 6.348 1.00 . A A . 28 VAL HG12 1 1 9 15455 1 1 28 VAL HG13 H -2.252 -5.596 7.763 1.00 . A A . 28 VAL HG13 1 1 9 15456 1 1 28 VAL HG21 H -6.017 -7.447 7.452 1.00 . A A . 28 VAL HG21 1 1 9 15457 1 1 28 VAL HG22 H -5.853 -5.934 6.529 1.00 . A A . 28 VAL HG22 1 1 9 15458 1 1 28 VAL HG23 H -4.801 -7.321 6.158 1.00 . A A . 28 VAL HG23 1 1 9 15459 1 1 28 VAL N N -5.849 -6.946 9.724 1.00 . A A . 28 VAL N 1 1 9 15460 1 1 28 VAL O O -4.002 -5.410 11.078 1.00 . A A . 28 VAL O 1 1 9 15461 1 1 29 LYS C C -0.877 -5.137 11.155 1.00 . A A . 29 LYS C 1 1 9 15462 1 1 29 LYS CA C -1.486 -6.465 11.609 1.00 . A A . 29 LYS CA 1 1 9 15463 1 1 29 LYS CB C -0.446 -7.540 11.933 1.00 . A A . 29 LYS CB 1 1 9 15464 1 1 29 LYS CD C 0.807 -8.308 13.983 1.00 . A A . 29 LYS CD 1 1 9 15465 1 1 29 LYS CE C 0.916 -7.778 15.414 1.00 . A A . 29 LYS CE 1 1 9 15466 1 1 29 LYS CG C -0.569 -8.001 13.387 1.00 . A A . 29 LYS CG 1 1 9 15467 1 1 29 LYS H H -2.084 -7.719 10.056 1.00 . A A . 29 LYS H 1 1 9 15468 1 1 29 LYS HA H -2.061 -6.289 12.518 1.00 . A A . 29 LYS HA 1 1 9 15469 1 1 29 LYS HB2 H -0.577 -8.392 11.266 1.00 . A A . 29 LYS HB2 1 1 9 15470 1 1 29 LYS HB3 H 0.555 -7.147 11.755 1.00 . A A . 29 LYS HB3 1 1 9 15471 1 1 29 LYS HD2 H 0.978 -9.385 13.976 1.00 . A A . 29 LYS HD2 1 1 9 15472 1 1 29 LYS HD3 H 1.584 -7.858 13.364 1.00 . A A . 29 LYS HD3 1 1 9 15473 1 1 29 LYS HE2 H 1.486 -6.850 15.421 1.00 . A A . 29 LYS HE2 1 1 9 15474 1 1 29 LYS HE3 H -0.078 -7.546 15.798 1.00 . A A . 29 LYS HE3 1 1 9 15475 1 1 29 LYS HG2 H -1.060 -7.227 13.977 1.00 . A A . 29 LYS HG2 1 1 9 15476 1 1 29 LYS HG3 H -1.198 -8.889 13.439 1.00 . A A . 29 LYS HG3 1 1 9 15477 1 1 29 LYS HZ1 H 1.851 -9.605 15.774 1.00 . A A . 29 LYS HZ1 1 1 9 15478 1 1 29 LYS HZ2 H 2.406 -8.407 16.728 1.00 . A A . 29 LYS HZ2 1 1 9 15479 1 1 29 LYS N N -2.411 -6.942 10.594 1.00 . A A . 29 LYS N 1 1 9 15480 1 1 29 LYS NZ N 1.571 -8.777 16.288 1.00 . A A . 29 LYS NZ 1 1 9 15481 1 1 29 LYS O O -0.548 -4.970 9.982 1.00 . A A . 29 LYS O 1 1 9 15482 1 1 30 CYS C C 1.257 -3.110 11.340 1.00 . A A . 30 CYS C 1 1 9 15483 1 1 30 CYS CA C -0.182 -2.919 11.821 1.00 . A A . 30 CYS CA 1 1 9 15484 1 1 30 CYS CB C -0.259 -1.991 13.035 1.00 . A A . 30 CYS CB 1 1 9 15485 1 1 30 CYS H H -1.015 -4.371 13.061 1.00 . A A . 30 CYS H 1 1 9 15486 1 1 30 CYS HA H -0.797 -2.478 11.037 1.00 . A A . 30 CYS HA 1 1 9 15487 1 1 30 CYS HB2 H 0.570 -2.221 13.704 1.00 . A A . 30 CYS HB2 1 1 9 15488 1 1 30 CYS HB3 H -0.122 -0.963 12.699 1.00 . A A . 30 CYS HB3 1 1 9 15489 1 1 30 CYS N N -0.746 -4.227 12.109 1.00 . A A . 30 CYS N 1 1 9 15490 1 1 30 CYS O O 1.764 -2.312 10.553 1.00 . A A . 30 CYS O 1 1 9 15491 1 1 30 CYS SG S -1.822 -2.094 13.982 1.00 . A A . 30 CYS SG 1 1 9 15492 1 1 31 GLY C C 3.308 -5.148 10.088 1.00 . A A . 31 GLY C 1 1 9 15493 1 1 31 GLY CA C 3.247 -4.480 11.464 1.00 . A A . 31 GLY CA 1 1 9 15494 1 1 31 GLY H H 1.456 -4.818 12.473 1.00 . A A . 31 GLY H 1 1 9 15495 1 1 31 GLY HA2 H 3.838 -3.564 11.454 1.00 . A A . 31 GLY HA2 1 1 9 15496 1 1 31 GLY HA3 H 3.691 -5.137 12.211 1.00 . A A . 31 GLY HA3 1 1 9 15497 1 1 31 GLY N N 1.876 -4.173 11.833 1.00 . A A . 31 GLY N 1 1 9 15498 1 1 31 GLY O O 4.391 -5.437 9.582 1.00 . A A . 31 GLY O 1 1 9 15499 1 1 32 ASP C C 2.278 -4.952 7.131 1.00 . A A . 32 ASP C 1 1 9 15500 1 1 32 ASP CA C 2.037 -6.002 8.216 1.00 . A A . 32 ASP CA 1 1 9 15501 1 1 32 ASP CB C 0.648 -6.603 7.993 1.00 . A A . 32 ASP CB 1 1 9 15502 1 1 32 ASP CG C 0.539 -7.555 6.800 1.00 . A A . 32 ASP CG 1 1 9 15503 1 1 32 ASP H H 1.255 -5.135 9.941 1.00 . A A . 32 ASP H 1 1 9 15504 1 1 32 ASP HA H 2.799 -6.782 8.218 1.00 . A A . 32 ASP HA 1 1 9 15505 1 1 32 ASP HB2 H 0.350 -7.138 8.894 1.00 . A A . 32 ASP HB2 1 1 9 15506 1 1 32 ASP HB3 H -0.065 -5.790 7.856 1.00 . A A . 32 ASP HB3 1 1 9 15507 1 1 32 ASP N N 2.131 -5.374 9.523 1.00 . A A . 32 ASP N 1 1 9 15508 1 1 32 ASP O O 2.841 -5.257 6.081 1.00 . A A . 32 ASP O 1 1 9 15509 1 1 32 ASP OD1 O 1.114 -7.211 5.745 1.00 . A A . 32 ASP OD1 1 1 9 15510 1 1 32 ASP OD2 O -0.117 -8.605 6.970 1.00 . A A . 32 ASP OD2 1 1 9 15511 1 1 33 CYS C C 3.124 -1.732 6.991 1.00 . A A . 33 CYS C 1 1 9 15512 1 1 33 CYS CA C 2.000 -2.638 6.483 1.00 . A A . 33 CYS CA 1 1 9 15513 1 1 33 CYS CB C 0.693 -1.868 6.283 1.00 . A A . 33 CYS CB 1 1 9 15514 1 1 33 CYS H H 1.383 -3.496 8.278 1.00 . A A . 33 CYS H 1 1 9 15515 1 1 33 CYS HA H 2.265 -3.082 5.524 1.00 . A A . 33 CYS HA 1 1 9 15516 1 1 33 CYS HB2 H 0.112 -1.877 7.205 1.00 . A A . 33 CYS HB2 1 1 9 15517 1 1 33 CYS HB3 H 0.907 -0.825 6.051 1.00 . A A . 33 CYS HB3 1 1 9 15518 1 1 33 CYS N N 1.840 -3.736 7.421 1.00 . A A . 33 CYS N 1 1 9 15519 1 1 33 CYS O O 4.090 -1.474 6.275 1.00 . A A . 33 CYS O 1 1 9 15520 1 1 33 CYS SG S -0.277 -2.624 4.927 1.00 . A A . 33 CYS SG 1 1 9 15521 1 1 34 HIS C C 5.167 -1.224 9.256 1.00 . A A . 34 HIS C 1 1 9 15522 1 1 34 HIS CA C 3.947 -0.401 8.835 1.00 . A A . 34 HIS CA 1 1 9 15523 1 1 34 HIS CB C 3.333 0.385 9.995 1.00 . A A . 34 HIS CB 1 1 9 15524 1 1 34 HIS CD2 C 0.834 1.065 9.644 1.00 . A A . 34 HIS CD2 1 1 9 15525 1 1 34 HIS CE1 C 1.168 3.063 8.816 1.00 . A A . 34 HIS CE1 1 1 9 15526 1 1 34 HIS CG C 2.181 1.274 9.593 1.00 . A A . 34 HIS CG 1 1 9 15527 1 1 34 HIS H H 2.170 -1.488 8.799 1.00 . A A . 34 HIS H 1 1 9 15528 1 1 34 HIS HA H 4.249 0.315 8.071 1.00 . A A . 34 HIS HA 1 1 9 15529 1 1 34 HIS HB2 H 2.989 -0.317 10.755 1.00 . A A . 34 HIS HB2 1 1 9 15530 1 1 34 HIS HB3 H 4.108 0.998 10.455 1.00 . A A . 34 HIS HB3 1 1 9 15531 1 1 34 HIS HD1 H 3.240 2.988 8.902 1.00 . A A . 34 HIS HD1 1 1 9 15532 1 1 34 HIS HD2 H 0.343 0.163 10.009 1.00 . A A . 34 HIS HD2 1 1 9 15533 1 1 34 HIS HE1 H 0.976 4.051 8.397 1.00 . A A . 34 HIS HE1 1 1 9 15534 1 1 34 HIS N N 2.959 -1.273 8.223 1.00 . A A . 34 HIS N 1 1 9 15535 1 1 34 HIS ND1 N 2.360 2.541 9.066 1.00 . A A . 34 HIS ND1 1 1 9 15536 1 1 34 HIS NE2 N 0.224 2.147 9.176 1.00 . A A . 34 HIS NE2 1 1 9 15537 1 1 34 HIS O O 5.532 -1.243 10.431 1.00 . A A . 34 HIS O 1 1 9 15538 1 1 35 HIS C C 7.881 -1.970 9.479 1.00 . A A . 35 HIS C 1 1 9 15539 1 1 35 HIS CA C 6.935 -2.705 8.528 1.00 . A A . 35 HIS CA 1 1 9 15540 1 1 35 HIS CB C 7.609 -3.110 7.215 1.00 . A A . 35 HIS CB 1 1 9 15541 1 1 35 HIS CD2 C 7.767 -1.363 5.278 1.00 . A A . 35 HIS CD2 1 1 9 15542 1 1 35 HIS CE1 C 9.565 -0.313 5.951 1.00 . A A . 35 HIS CE1 1 1 9 15543 1 1 35 HIS CG C 8.183 -1.951 6.436 1.00 . A A . 35 HIS CG 1 1 9 15544 1 1 35 HIS H H 5.461 -1.861 7.321 1.00 . A A . 35 HIS H 1 1 9 15545 1 1 35 HIS HA H 6.579 -3.614 9.013 1.00 . A A . 35 HIS HA 1 1 9 15546 1 1 35 HIS HB2 H 8.408 -3.819 7.433 1.00 . A A . 35 HIS HB2 1 1 9 15547 1 1 35 HIS HB3 H 6.882 -3.630 6.591 1.00 . A A . 35 HIS HB3 1 1 9 15548 1 1 35 HIS HD1 H 9.860 -1.461 7.654 1.00 . A A . 35 HIS HD1 1 1 9 15549 1 1 35 HIS HD2 H 6.897 -1.656 4.691 1.00 . A A . 35 HIS HD2 1 1 9 15550 1 1 35 HIS HE1 H 10.392 0.396 5.988 1.00 . A A . 35 HIS HE1 1 1 9 15551 1 1 35 HIS N N 5.764 -1.883 8.274 1.00 . A A . 35 HIS N 1 1 9 15552 1 1 35 HIS ND1 N 9.318 -1.267 6.836 1.00 . A A . 35 HIS ND1 1 1 9 15553 1 1 35 HIS NE2 N 8.602 -0.373 4.986 1.00 . A A . 35 HIS NE2 1 1 9 15554 1 1 35 HIS O O 7.944 -0.742 9.472 1.00 . A A . 35 HIS O 1 1 9 15555 1 1 36 PRO C C 10.819 -1.717 10.547 1.00 . A A . 36 PRO C 1 1 9 15556 1 1 36 PRO CA C 9.555 -2.213 11.250 1.00 . A A . 36 PRO CA 1 1 9 15557 1 1 36 PRO CB C 9.826 -3.335 12.240 1.00 . A A . 36 PRO CB 1 1 9 15558 1 1 36 PRO CD C 8.566 -4.233 10.331 1.00 . A A . 36 PRO CD 1 1 9 15559 1 1 36 PRO CG C 9.395 -4.616 11.546 1.00 . A A . 36 PRO CG 1 1 9 15560 1 1 36 PRO HA H 9.158 -1.412 11.698 1.00 . A A . 36 PRO HA 1 1 9 15561 1 1 36 PRO HB2 H 10.882 -3.372 12.508 1.00 . A A . 36 PRO HB2 1 1 9 15562 1 1 36 PRO HB3 H 9.268 -3.184 13.163 1.00 . A A . 36 PRO HB3 1 1 9 15563 1 1 36 PRO HD2 H 8.976 -4.665 9.418 1.00 . A A . 36 PRO HD2 1 1 9 15564 1 1 36 PRO HD3 H 7.541 -4.593 10.421 1.00 . A A . 36 PRO HD3 1 1 9 15565 1 1 36 PRO HG2 H 10.266 -5.199 11.245 1.00 . A A . 36 PRO HG2 1 1 9 15566 1 1 36 PRO HG3 H 8.813 -5.240 12.224 1.00 . A A . 36 PRO HG3 1 1 9 15567 1 1 36 PRO N N 8.614 -2.774 10.295 1.00 . A A . 36 PRO N 1 1 9 15568 1 1 36 PRO O O 11.620 -2.517 10.064 1.00 . A A . 36 PRO O 1 1 9 15569 1 1 37 VAL C C 13.274 0.264 10.871 1.00 . A A . 37 VAL C 1 1 9 15570 1 1 37 VAL CA C 12.114 0.212 9.874 1.00 . A A . 37 VAL CA 1 1 9 15571 1 1 37 VAL CB C 11.738 1.589 9.322 1.00 . A A . 37 VAL CB 1 1 9 15572 1 1 37 VAL CG1 C 12.988 2.413 9.007 1.00 . A A . 37 VAL CG1 1 1 9 15573 1 1 37 VAL CG2 C 10.842 1.459 8.089 1.00 . A A . 37 VAL CG2 1 1 9 15574 1 1 37 VAL H H 10.305 0.243 10.906 1.00 . A A . 37 VAL H 1 1 9 15575 1 1 37 VAL HA H 12.401 -0.421 9.035 1.00 . A A . 37 VAL HA 1 1 9 15576 1 1 37 VAL HB H 11.175 2.116 10.092 1.00 . A A . 37 VAL HB 1 1 9 15577 1 1 37 VAL HG11 H 13.705 1.794 8.468 1.00 . A A . 37 VAL HG11 1 1 9 15578 1 1 37 VAL HG12 H 12.712 3.270 8.392 1.00 . A A . 37 VAL HG12 1 1 9 15579 1 1 37 VAL HG13 H 13.437 2.762 9.937 1.00 . A A . 37 VAL HG13 1 1 9 15580 1 1 37 VAL HG21 H 10.393 0.466 8.069 1.00 . A A . 37 VAL HG21 1 1 9 15581 1 1 37 VAL HG22 H 10.054 2.212 8.132 1.00 . A A . 37 VAL HG22 1 1 9 15582 1 1 37 VAL HG23 H 11.438 1.607 7.189 1.00 . A A . 37 VAL HG23 1 1 9 15583 1 1 37 VAL N N 10.960 -0.400 10.511 1.00 . A A . 37 VAL N 1 1 9 15584 1 1 37 VAL O O 13.343 1.168 11.702 1.00 . A A . 37 VAL O 1 1 9 15585 1 1 38 ASN C C 14.831 -0.949 13.082 1.00 . A A . 38 ASN C 1 1 9 15586 1 1 38 ASN CA C 15.308 -0.796 11.636 1.00 . A A . 38 ASN CA 1 1 9 15587 1 1 38 ASN CB C 16.155 0.475 11.550 1.00 . A A . 38 ASN CB 1 1 9 15588 1 1 38 ASN CG C 17.162 0.386 10.401 1.00 . A A . 38 ASN CG 1 1 9 15589 1 1 38 ASN H H 14.092 -1.450 10.076 1.00 . A A . 38 ASN H 1 1 9 15590 1 1 38 ASN HA H 15.875 -1.661 11.291 1.00 . A A . 38 ASN HA 1 1 9 15591 1 1 38 ASN HB2 H 15.506 1.339 11.403 1.00 . A A . 38 ASN HB2 1 1 9 15592 1 1 38 ASN HB3 H 16.683 0.629 12.491 1.00 . A A . 38 ASN HB3 1 1 9 15593 1 1 38 ASN HD21 H 18.653 0.385 11.772 1.00 . A A . 38 ASN HD21 1 1 9 15594 1 1 38 ASN HD22 H 19.165 0.294 10.120 1.00 . A A . 38 ASN HD22 1 1 9 15595 1 1 38 ASN N N 14.156 -0.718 10.755 1.00 . A A . 38 ASN N 1 1 9 15596 1 1 38 ASN ND2 N 18.431 0.352 10.797 1.00 . A A . 38 ASN ND2 1 1 9 15597 1 1 38 ASN O O 15.348 -0.291 13.983 1.00 . A A . 38 ASN O 1 1 9 15598 1 1 38 ASN OD1 O 16.810 0.351 9.234 1.00 . A A . 38 ASN OD1 1 1 9 15599 1 1 39 GLY C C 12.357 -0.935 15.000 1.00 . A A . 39 GLY C 1 1 9 15600 1 1 39 GLY CA C 13.295 -2.068 14.578 1.00 . A A . 39 GLY CA 1 1 9 15601 1 1 39 GLY H H 13.434 -2.352 12.520 1.00 . A A . 39 GLY H 1 1 9 15602 1 1 39 GLY HA2 H 12.753 -3.013 14.578 1.00 . A A . 39 GLY HA2 1 1 9 15603 1 1 39 GLY HA3 H 14.104 -2.164 15.303 1.00 . A A . 39 GLY HA3 1 1 9 15604 1 1 39 GLY N N 13.849 -1.821 13.258 1.00 . A A . 39 GLY N 1 1 9 15605 1 1 39 GLY O O 11.787 -0.970 16.090 1.00 . A A . 39 GLY O 1 1 9 15606 1 1 40 LYS C C 9.939 0.858 13.932 1.00 . A A . 40 LYS C 1 1 9 15607 1 1 40 LYS CA C 11.365 1.182 14.382 1.00 . A A . 40 LYS CA 1 1 9 15608 1 1 40 LYS CB C 11.939 2.447 13.740 1.00 . A A . 40 LYS CB 1 1 9 15609 1 1 40 LYS CD C 14.068 3.651 13.126 1.00 . A A . 40 LYS CD 1 1 9 15610 1 1 40 LYS CE C 15.596 3.599 13.192 1.00 . A A . 40 LYS CE 1 1 9 15611 1 1 40 LYS CG C 13.445 2.554 13.991 1.00 . A A . 40 LYS CG 1 1 9 15612 1 1 40 LYS H H 12.691 0.062 13.231 1.00 . A A . 40 LYS H 1 1 9 15613 1 1 40 LYS HA H 11.359 1.342 15.460 1.00 . A A . 40 LYS HA 1 1 9 15614 1 1 40 LYS HB2 H 11.746 2.436 12.668 1.00 . A A . 40 LYS HB2 1 1 9 15615 1 1 40 LYS HB3 H 11.436 3.325 14.145 1.00 . A A . 40 LYS HB3 1 1 9 15616 1 1 40 LYS HD2 H 13.741 3.535 12.093 1.00 . A A . 40 LYS HD2 1 1 9 15617 1 1 40 LYS HD3 H 13.719 4.628 13.463 1.00 . A A . 40 LYS HD3 1 1 9 15618 1 1 40 LYS HE2 H 15.983 3.040 12.340 1.00 . A A . 40 LYS HE2 1 1 9 15619 1 1 40 LYS HE3 H 16.003 4.608 13.123 1.00 . A A . 40 LYS HE3 1 1 9 15620 1 1 40 LYS HG2 H 13.627 2.769 15.045 1.00 . A A . 40 LYS HG2 1 1 9 15621 1 1 40 LYS HG3 H 13.922 1.599 13.774 1.00 . A A . 40 LYS HG3 1 1 9 15622 1 1 40 LYS HZ1 H 15.725 3.479 15.268 1.00 . A A . 40 LYS HZ1 1 1 9 15623 1 1 40 LYS HZ2 H 15.685 2.019 14.547 1.00 . A A . 40 LYS HZ2 1 1 9 15624 1 1 40 LYS N N 12.224 0.041 14.115 1.00 . A A . 40 LYS N 1 1 9 15625 1 1 40 LYS NZ N 16.039 2.964 14.453 1.00 . A A . 40 LYS NZ 1 1 9 15626 1 1 40 LYS O O 9.679 0.714 12.738 1.00 . A A . 40 LYS O 1 1 9 15627 1 1 41 GLU C C 6.770 1.631 15.012 1.00 . A A . 41 GLU C 1 1 9 15628 1 1 41 GLU CA C 7.661 0.446 14.631 1.00 . A A . 41 GLU CA 1 1 9 15629 1 1 41 GLU CB C 7.221 -0.826 15.358 1.00 . A A . 41 GLU CB 1 1 9 15630 1 1 41 GLU CD C 5.448 -2.568 14.929 1.00 . A A . 41 GLU CD 1 1 9 15631 1 1 41 GLU CG C 6.687 -1.865 14.370 1.00 . A A . 41 GLU CG 1 1 9 15632 1 1 41 GLU H H 9.273 0.871 15.879 1.00 . A A . 41 GLU H 1 1 9 15633 1 1 41 GLU HA H 7.612 0.278 13.555 1.00 . A A . 41 GLU HA 1 1 9 15634 1 1 41 GLU HB2 H 8.064 -1.243 15.909 1.00 . A A . 41 GLU HB2 1 1 9 15635 1 1 41 GLU HB3 H 6.450 -0.584 16.089 1.00 . A A . 41 GLU HB3 1 1 9 15636 1 1 41 GLU HG2 H 6.439 -1.380 13.425 1.00 . A A . 41 GLU HG2 1 1 9 15637 1 1 41 GLU HG3 H 7.462 -2.602 14.156 1.00 . A A . 41 GLU HG3 1 1 9 15638 1 1 41 GLU N N 9.053 0.752 14.911 1.00 . A A . 41 GLU N 1 1 9 15639 1 1 41 GLU O O 6.325 1.735 16.154 1.00 . A A . 41 GLU O 1 1 9 15640 1 1 41 GLU OE1 O 5.549 -3.075 16.067 1.00 . A A . 41 GLU OE1 1 1 9 15641 1 1 41 GLU OE2 O 4.429 -2.582 14.207 1.00 . A A . 41 GLU OE2 1 1 9 15642 1 1 42 ASP C C 4.675 3.772 13.130 1.00 . A A . 42 ASP C 1 1 9 15643 1 1 42 ASP CA C 5.708 3.667 14.253 1.00 . A A . 42 ASP CA 1 1 9 15644 1 1 42 ASP CB C 6.549 4.945 14.243 1.00 . A A . 42 ASP CB 1 1 9 15645 1 1 42 ASP CG C 6.247 5.927 15.377 1.00 . A A . 42 ASP CG 1 1 9 15646 1 1 42 ASP H H 6.903 2.402 13.108 1.00 . A A . 42 ASP H 1 1 9 15647 1 1 42 ASP HA H 5.249 3.515 15.230 1.00 . A A . 42 ASP HA 1 1 9 15648 1 1 42 ASP HB2 H 7.603 4.669 14.292 1.00 . A A . 42 ASP HB2 1 1 9 15649 1 1 42 ASP HB3 H 6.398 5.455 13.291 1.00 . A A . 42 ASP HB3 1 1 9 15650 1 1 42 ASP N N 6.537 2.494 14.034 1.00 . A A . 42 ASP N 1 1 9 15651 1 1 42 ASP O O 4.760 3.056 12.134 1.00 . A A . 42 ASP O 1 1 9 15652 1 1 42 ASP OD1 O 6.332 5.489 16.544 1.00 . A A . 42 ASP OD1 1 1 9 15653 1 1 42 ASP OD2 O 5.938 7.093 15.050 1.00 . A A . 42 ASP OD2 1 1 9 15654 1 1 43 TYR C C 2.926 6.152 11.534 1.00 . A A . 43 TYR C 1 1 9 15655 1 1 43 TYR CA C 2.673 4.880 12.346 1.00 . A A . 43 TYR CA 1 1 9 15656 1 1 43 TYR CB C 1.376 5.047 13.141 1.00 . A A . 43 TYR CB 1 1 9 15657 1 1 43 TYR CD1 C 1.482 2.594 13.717 1.00 . A A . 43 TYR CD1 1 1 9 15658 1 1 43 TYR CD2 C 0.315 4.058 15.204 1.00 . A A . 43 TYR CD2 1 1 9 15659 1 1 43 TYR CE1 C 1.172 1.478 14.572 1.00 . A A . 43 TYR CE1 1 1 9 15660 1 1 43 TYR CE2 C 0.005 2.942 16.059 1.00 . A A . 43 TYR CE2 1 1 9 15661 1 1 43 TYR CG C 1.047 3.861 14.050 1.00 . A A . 43 TYR CG 1 1 9 15662 1 1 43 TYR CZ C 0.449 1.707 15.701 1.00 . A A . 43 TYR CZ 1 1 9 15663 1 1 43 TYR H H 3.660 5.251 14.142 1.00 . A A . 43 TYR H 1 1 9 15664 1 1 43 TYR HA H 2.668 4.023 11.672 1.00 . A A . 43 TYR HA 1 1 9 15665 1 1 43 TYR HB2 H 1.449 5.949 13.750 1.00 . A A . 43 TYR HB2 1 1 9 15666 1 1 43 TYR HB3 H 0.552 5.198 12.445 1.00 . A A . 43 TYR HB3 1 1 9 15667 1 1 43 TYR HD1 H 2.060 2.439 12.806 1.00 . A A . 43 TYR HD1 1 1 9 15668 1 1 43 TYR HD2 H -0.028 5.059 15.467 1.00 . A A . 43 TYR HD2 1 1 9 15669 1 1 43 TYR HE1 H 1.509 0.473 14.321 1.00 . A A . 43 TYR HE1 1 1 9 15670 1 1 43 TYR HE2 H -0.572 3.084 16.973 1.00 . A A . 43 TYR HE2 1 1 9 15671 1 1 43 TYR HH H -0.671 0.846 17.037 1.00 . A A . 43 TYR HH 1 1 9 15672 1 1 43 TYR N N 3.722 4.672 13.329 1.00 . A A . 43 TYR N 1 1 9 15673 1 1 43 TYR O O 2.498 7.237 11.924 1.00 . A A . 43 TYR O 1 1 9 15674 1 1 43 TYR OH O 0.156 0.653 16.509 1.00 . A A . 43 TYR OH 1 1 9 15675 1 1 44 ARG C C 3.415 6.833 8.136 1.00 . A A . 44 ARG C 1 1 9 15676 1 1 44 ARG CA C 3.938 7.095 9.550 1.00 . A A . 44 ARG CA 1 1 9 15677 1 1 44 ARG CB C 5.447 7.339 9.492 1.00 . A A . 44 ARG CB 1 1 9 15678 1 1 44 ARG CD C 7.305 8.833 10.313 1.00 . A A . 44 ARG CD 1 1 9 15679 1 1 44 ARG CG C 5.802 8.718 10.050 1.00 . A A . 44 ARG CG 1 1 9 15680 1 1 44 ARG CZ C 8.733 8.664 12.359 1.00 . A A . 44 ARG CZ 1 1 9 15681 1 1 44 ARG H H 3.966 5.089 10.110 1.00 . A A . 44 ARG H 1 1 9 15682 1 1 44 ARG HA H 3.434 7.950 10.002 1.00 . A A . 44 ARG HA 1 1 9 15683 1 1 44 ARG HB2 H 5.965 6.568 10.061 1.00 . A A . 44 ARG HB2 1 1 9 15684 1 1 44 ARG HB3 H 5.792 7.260 8.461 1.00 . A A . 44 ARG HB3 1 1 9 15685 1 1 44 ARG HD2 H 7.819 7.956 9.921 1.00 . A A . 44 ARG HD2 1 1 9 15686 1 1 44 ARG HD3 H 7.709 9.700 9.789 1.00 . A A . 44 ARG HD3 1 1 9 15687 1 1 44 ARG HE H 6.808 9.283 12.345 1.00 . A A . 44 ARG HE 1 1 9 15688 1 1 44 ARG HG2 H 5.492 9.490 9.345 1.00 . A A . 44 ARG HG2 1 1 9 15689 1 1 44 ARG HG3 H 5.253 8.892 10.975 1.00 . A A . 44 ARG HG3 1 1 9 15690 1 1 44 ARG HH11 H 9.683 8.111 10.637 1.00 . A A . 44 ARG HH11 1 1 9 15691 1 1 44 ARG HH12 H 10.645 8.005 12.074 1.00 . A A . 44 ARG HH12 1 1 9 15692 1 1 44 ARG HH21 H 9.680 8.617 14.180 1.00 . A A . 44 ARG HH21 1 1 9 15693 1 1 44 ARG N N 3.622 5.976 10.420 1.00 . A A . 44 ARG N 1 1 9 15694 1 1 44 ARG NE N 7.556 8.959 11.766 1.00 . A A . 44 ARG NE 1 1 9 15695 1 1 44 ARG NH1 N 9.777 8.222 11.627 1.00 . A A . 44 ARG NH1 1 1 9 15696 1 1 44 ARG NH2 N 8.846 8.813 13.665 1.00 . A A . 44 ARG NH2 1 1 9 15697 1 1 44 ARG O O 2.905 5.751 7.849 1.00 . A A . 44 ARG O 1 1 9 15698 1 1 45 LYS C C 4.198 7.062 5.075 1.00 . A A . 45 LYS C 1 1 9 15699 1 1 45 LYS CA C 3.109 7.734 5.912 1.00 . A A . 45 LYS CA 1 1 9 15700 1 1 45 LYS CB C 2.681 9.104 5.380 1.00 . A A . 45 LYS CB 1 1 9 15701 1 1 45 LYS CD C 1.937 10.530 7.322 1.00 . A A . 45 LYS CD 1 1 9 15702 1 1 45 LYS CE C 1.378 11.947 7.184 1.00 . A A . 45 LYS CE 1 1 9 15703 1 1 45 LYS CG C 1.482 9.645 6.160 1.00 . A A . 45 LYS CG 1 1 9 15704 1 1 45 LYS H H 3.976 8.719 7.530 1.00 . A A . 45 LYS H 1 1 9 15705 1 1 45 LYS HA H 2.225 7.096 5.907 1.00 . A A . 45 LYS HA 1 1 9 15706 1 1 45 LYS HB2 H 3.513 9.804 5.454 1.00 . A A . 45 LYS HB2 1 1 9 15707 1 1 45 LYS HB3 H 2.426 9.024 4.324 1.00 . A A . 45 LYS HB3 1 1 9 15708 1 1 45 LYS HD2 H 1.607 10.096 8.266 1.00 . A A . 45 LYS HD2 1 1 9 15709 1 1 45 LYS HD3 H 3.026 10.566 7.352 1.00 . A A . 45 LYS HD3 1 1 9 15710 1 1 45 LYS HE2 H 1.004 12.100 6.172 1.00 . A A . 45 LYS HE2 1 1 9 15711 1 1 45 LYS HE3 H 0.533 12.079 7.859 1.00 . A A . 45 LYS HE3 1 1 9 15712 1 1 45 LYS HG2 H 0.838 10.218 5.493 1.00 . A A . 45 LYS HG2 1 1 9 15713 1 1 45 LYS HG3 H 0.887 8.815 6.542 1.00 . A A . 45 LYS HG3 1 1 9 15714 1 1 45 LYS HZ1 H 3.037 13.111 6.696 1.00 . A A . 45 LYS HZ1 1 1 9 15715 1 1 45 LYS HZ2 H 2.028 13.847 7.741 1.00 . A A . 45 LYS HZ2 1 1 9 15716 1 1 45 LYS N N 3.560 7.842 7.289 1.00 . A A . 45 LYS N 1 1 9 15717 1 1 45 LYS NZ N 2.424 12.949 7.488 1.00 . A A . 45 LYS NZ 1 1 9 15718 1 1 45 LYS O O 5.373 7.409 5.183 1.00 . A A . 45 LYS O 1 1 9 15719 1 1 46 CYS C C 5.407 6.397 2.502 1.00 . A A . 46 CYS C 1 1 9 15720 1 1 46 CYS CA C 4.693 5.386 3.402 1.00 . A A . 46 CYS CA 1 1 9 15721 1 1 46 CYS CB C 3.981 4.303 2.590 1.00 . A A . 46 CYS CB 1 1 9 15722 1 1 46 CYS H H 2.811 5.835 4.175 1.00 . A A . 46 CYS H 1 1 9 15723 1 1 46 CYS HA H 5.402 4.885 4.061 1.00 . A A . 46 CYS HA 1 1 9 15724 1 1 46 CYS HB2 H 3.568 4.756 1.689 1.00 . A A . 46 CYS HB2 1 1 9 15725 1 1 46 CYS HB3 H 4.717 3.566 2.268 1.00 . A A . 46 CYS HB3 1 1 9 15726 1 1 46 CYS N N 3.769 6.111 4.258 1.00 . A A . 46 CYS N 1 1 9 15727 1 1 46 CYS O O 6.631 6.365 2.377 1.00 . A A . 46 CYS O 1 1 9 15728 1 1 46 CYS SG S 2.636 3.437 3.480 1.00 . A A . 46 CYS SG 1 1 9 15729 1 1 47 GLY C C 5.758 9.443 1.812 1.00 . A A . 47 GLY C 1 1 9 15730 1 1 47 GLY CA C 5.154 8.286 1.013 1.00 . A A . 47 GLY CA 1 1 9 15731 1 1 47 GLY H H 3.619 7.287 2.006 1.00 . A A . 47 GLY H 1 1 9 15732 1 1 47 GLY HA2 H 5.917 7.846 0.371 1.00 . A A . 47 GLY HA2 1 1 9 15733 1 1 47 GLY HA3 H 4.366 8.662 0.361 1.00 . A A . 47 GLY HA3 1 1 9 15734 1 1 47 GLY N N 4.613 7.269 1.898 1.00 . A A . 47 GLY N 1 1 9 15735 1 1 47 GLY O O 5.440 10.605 1.566 1.00 . A A . 47 GLY O 1 1 9 15736 1 1 48 THR C C 8.645 10.435 3.023 1.00 . A A . 48 THR C 1 1 9 15737 1 1 48 THR CA C 7.270 10.078 3.590 1.00 . A A . 48 THR CA 1 1 9 15738 1 1 48 THR CB C 7.325 9.531 5.018 1.00 . A A . 48 THR CB 1 1 9 15739 1 1 48 THR CG2 C 8.393 10.221 5.869 1.00 . A A . 48 THR CG2 1 1 9 15740 1 1 48 THR H H 6.873 8.137 2.947 1.00 . A A . 48 THR H 1 1 9 15741 1 1 48 THR HA H 6.670 10.988 3.572 1.00 . A A . 48 THR HA 1 1 9 15742 1 1 48 THR HB H 7.467 8.450 5.015 1.00 . A A . 48 THR HB 1 1 9 15743 1 1 48 THR HG1 H 5.792 9.285 6.281 1.00 . A A . 48 THR HG1 1 1 9 15744 1 1 48 THR HG21 H 9.337 10.238 5.324 1.00 . A A . 48 THR HG21 1 1 9 15745 1 1 48 THR HG22 H 8.081 11.242 6.086 1.00 . A A . 48 THR HG22 1 1 9 15746 1 1 48 THR HG23 H 8.523 9.674 6.803 1.00 . A A . 48 THR HG23 1 1 9 15747 1 1 48 THR N N 6.619 9.084 2.753 1.00 . A A . 48 THR N 1 1 9 15748 1 1 48 THR O O 9.430 9.550 2.686 1.00 . A A . 48 THR O 1 1 9 15749 1 1 48 THR OG1 O 6.094 9.951 5.599 1.00 . A A . 48 THR OG1 1 1 9 15750 1 1 49 ALA C C 11.309 11.586 3.204 1.00 . A A . 49 ALA C 1 1 9 15751 1 1 49 ALA CA C 10.161 12.218 2.414 1.00 . A A . 49 ALA CA 1 1 9 15752 1 1 49 ALA CB C 10.186 13.747 2.472 1.00 . A A . 49 ALA CB 1 1 9 15753 1 1 49 ALA H H 8.251 12.446 3.211 1.00 . A A . 49 ALA H 1 1 9 15754 1 1 49 ALA HA H 10.233 11.905 1.372 1.00 . A A . 49 ALA HA 1 1 9 15755 1 1 49 ALA HB1 H 10.034 14.073 3.501 1.00 . A A . 49 ALA HB1 1 1 9 15756 1 1 49 ALA HB2 H 11.150 14.108 2.114 1.00 . A A . 49 ALA HB2 1 1 9 15757 1 1 49 ALA HB3 H 9.392 14.147 1.842 1.00 . A A . 49 ALA HB3 1 1 9 15758 1 1 49 ALA N N 8.895 11.733 2.935 1.00 . A A . 49 ALA N 1 1 9 15759 1 1 49 ALA O O 11.517 11.912 4.372 1.00 . A A . 49 ALA O 1 1 9 15760 1 1 50 GLY C C 12.886 8.506 3.258 1.00 . A A . 50 GLY C 1 1 9 15761 1 1 50 GLY CA C 13.144 10.011 3.161 1.00 . A A . 50 GLY CA 1 1 9 15762 1 1 50 GLY H H 11.848 10.433 1.586 1.00 . A A . 50 GLY H 1 1 9 15763 1 1 50 GLY HA2 H 14.052 10.192 2.586 1.00 . A A . 50 GLY HA2 1 1 9 15764 1 1 50 GLY HA3 H 13.312 10.420 4.158 1.00 . A A . 50 GLY HA3 1 1 9 15765 1 1 50 GLY N N 12.024 10.692 2.536 1.00 . A A . 50 GLY N 1 1 9 15766 1 1 50 GLY O O 13.804 7.731 3.522 1.00 . A A . 50 GLY O 1 1 9 15767 1 1 51 CYS C C 11.041 6.235 1.668 1.00 . A A . 51 CYS C 1 1 9 15768 1 1 51 CYS CA C 11.242 6.739 3.098 1.00 . A A . 51 CYS CA 1 1 9 15769 1 1 51 CYS CB C 9.992 6.537 3.956 1.00 . A A . 51 CYS CB 1 1 9 15770 1 1 51 CYS H H 10.892 8.774 2.824 1.00 . A A . 51 CYS H 1 1 9 15771 1 1 51 CYS HA H 12.059 6.207 3.585 1.00 . A A . 51 CYS HA 1 1 9 15772 1 1 51 CYS HB2 H 9.191 7.189 3.606 1.00 . A A . 51 CYS HB2 1 1 9 15773 1 1 51 CYS HB3 H 9.634 5.512 3.857 1.00 . A A . 51 CYS HB3 1 1 9 15774 1 1 51 CYS N N 11.633 8.138 3.039 1.00 . A A . 51 CYS N 1 1 9 15775 1 1 51 CYS O O 11.983 5.763 1.034 1.00 . A A . 51 CYS O 1 1 9 15776 1 1 51 CYS SG S 10.370 6.899 5.710 1.00 . A A . 51 CYS SG 1 1 9 15777 1 1 52 HIS C C 9.201 7.134 -1.027 1.00 . A A . 52 HIS C 1 1 9 15778 1 1 52 HIS CA C 9.469 5.915 -0.142 1.00 . A A . 52 HIS CA 1 1 9 15779 1 1 52 HIS CB C 8.296 4.933 -0.115 1.00 . A A . 52 HIS CB 1 1 9 15780 1 1 52 HIS CD2 C 8.190 3.066 1.711 1.00 . A A . 52 HIS CD2 1 1 9 15781 1 1 52 HIS CE1 C 9.554 1.635 0.774 1.00 . A A . 52 HIS CE1 1 1 9 15782 1 1 52 HIS CG C 8.619 3.609 0.536 1.00 . A A . 52 HIS CG 1 1 9 15783 1 1 52 HIS H H 9.045 6.739 1.724 1.00 . A A . 52 HIS H 1 1 9 15784 1 1 52 HIS HA H 10.340 5.383 -0.525 1.00 . A A . 52 HIS HA 1 1 9 15785 1 1 52 HIS HB2 H 7.462 5.393 0.414 1.00 . A A . 52 HIS HB2 1 1 9 15786 1 1 52 HIS HB3 H 7.964 4.752 -1.137 1.00 . A A . 52 HIS HB3 1 1 9 15787 1 1 52 HIS HD1 H 9.959 2.789 -0.902 1.00 . A A . 52 HIS HD1 1 1 9 15788 1 1 52 HIS HD2 H 7.500 3.533 2.415 1.00 . A A . 52 HIS HD2 1 1 9 15789 1 1 52 HIS HE1 H 10.151 0.739 0.605 1.00 . A A . 52 HIS HE1 1 1 9 15790 1 1 52 HIS N N 9.806 6.353 1.201 1.00 . A A . 52 HIS N 1 1 9 15791 1 1 52 HIS ND1 N 9.478 2.684 -0.031 1.00 . A A . 52 HIS ND1 1 1 9 15792 1 1 52 HIS NE2 N 8.755 1.873 1.854 1.00 . A A . 52 HIS NE2 1 1 9 15793 1 1 52 HIS O O 8.062 7.381 -1.421 1.00 . A A . 52 HIS O 1 1 9 15794 1 1 53 ASP C C 11.249 9.012 -3.222 1.00 . A A . 53 ASP C 1 1 9 15795 1 1 53 ASP CA C 10.164 9.051 -2.145 1.00 . A A . 53 ASP CA 1 1 9 15796 1 1 53 ASP CB C 10.364 10.322 -1.317 1.00 . A A . 53 ASP CB 1 1 9 15797 1 1 53 ASP CG C 9.616 11.553 -1.831 1.00 . A A . 53 ASP CG 1 1 9 15798 1 1 53 ASP H H 11.192 7.655 -0.990 1.00 . A A . 53 ASP H 1 1 9 15799 1 1 53 ASP HA H 9.158 9.018 -2.564 1.00 . A A . 53 ASP HA 1 1 9 15800 1 1 53 ASP HB2 H 10.048 10.124 -0.293 1.00 . A A . 53 ASP HB2 1 1 9 15801 1 1 53 ASP HB3 H 11.429 10.551 -1.283 1.00 . A A . 53 ASP HB3 1 1 9 15802 1 1 53 ASP N N 10.269 7.864 -1.314 1.00 . A A . 53 ASP N 1 1 9 15803 1 1 53 ASP O O 12.258 9.708 -3.117 1.00 . A A . 53 ASP O 1 1 9 15804 1 1 53 ASP OD1 O 9.891 11.943 -2.986 1.00 . A A . 53 ASP OD1 1 1 9 15805 1 1 53 ASP OD2 O 8.785 12.077 -1.057 1.00 . A A . 53 ASP OD2 1 1 9 15806 1 1 54 SER C C 11.406 8.747 -6.579 1.00 . A A . 54 SER C 1 1 9 15807 1 1 54 SER CA C 11.950 8.053 -5.329 1.00 . A A . 54 SER CA 1 1 9 15808 1 1 54 SER CB C 12.239 6.580 -5.623 1.00 . A A . 54 SER CB 1 1 9 15809 1 1 54 SER H H 10.182 7.629 -4.311 1.00 . A A . 54 SER H 1 1 9 15810 1 1 54 SER HA H 12.863 8.541 -4.987 1.00 . A A . 54 SER HA 1 1 9 15811 1 1 54 SER HB2 H 12.600 6.093 -4.717 1.00 . A A . 54 SER HB2 1 1 9 15812 1 1 54 SER HB3 H 11.314 6.078 -5.908 1.00 . A A . 54 SER HB3 1 1 9 15813 1 1 54 SER HG H 14.125 6.548 -6.294 1.00 . A A . 54 SER HG 1 1 9 15814 1 1 54 SER N N 11.005 8.192 -4.233 1.00 . A A . 54 SER N 1 1 9 15815 1 1 54 SER O O 12.176 9.210 -7.420 1.00 . A A . 54 SER O 1 1 9 15816 1 1 54 SER OG O 13.203 6.422 -6.661 1.00 . A A . 54 SER OG 1 1 9 15817 1 1 55 MET C C 9.941 8.846 -9.116 1.00 . A A . 55 MET C 1 1 9 15818 1 1 55 MET CA C 9.430 9.427 -7.796 1.00 . A A . 55 MET CA 1 1 9 15819 1 1 55 MET CB C 9.693 10.934 -7.766 1.00 . A A . 55 MET CB 1 1 9 15820 1 1 55 MET CE C 7.581 10.253 -5.103 1.00 . A A . 55 MET CE 1 1 9 15821 1 1 55 MET CG C 8.468 11.694 -7.251 1.00 . A A . 55 MET CG 1 1 9 15822 1 1 55 MET H H 9.467 8.419 -5.974 1.00 . A A . 55 MET H 1 1 9 15823 1 1 55 MET HA H 8.369 9.207 -7.681 1.00 . A A . 55 MET HA 1 1 9 15824 1 1 55 MET HB2 H 10.550 11.144 -7.127 1.00 . A A . 55 MET HB2 1 1 9 15825 1 1 55 MET HB3 H 9.948 11.283 -8.767 1.00 . A A . 55 MET HB3 1 1 9 15826 1 1 55 MET HE1 H 7.120 9.876 -6.016 1.00 . A A . 55 MET HE1 1 1 9 15827 1 1 55 MET HE2 H 8.263 9.502 -4.703 1.00 . A A . 55 MET HE2 1 1 9 15828 1 1 55 MET HE3 H 6.806 10.469 -4.367 1.00 . A A . 55 MET HE3 1 1 9 15829 1 1 55 MET HG2 H 8.463 12.707 -7.653 1.00 . A A . 55 MET HG2 1 1 9 15830 1 1 55 MET HG3 H 7.556 11.208 -7.599 1.00 . A A . 55 MET HG3 1 1 9 15831 1 1 55 MET N N 10.085 8.798 -6.662 1.00 . A A . 55 MET N 1 1 9 15832 1 1 55 MET O O 10.059 9.562 -10.109 1.00 . A A . 55 MET O 1 1 9 15833 1 1 55 MET SD S 8.488 11.747 -5.467 1.00 . A A . 55 MET SD 1 1 9 15834 1 1 56 ASP C C 10.017 5.520 -10.403 1.00 . A A . 56 ASP C 1 1 9 15835 1 1 56 ASP CA C 10.726 6.869 -10.266 1.00 . A A . 56 ASP CA 1 1 9 15836 1 1 56 ASP CB C 12.229 6.605 -10.160 1.00 . A A . 56 ASP CB 1 1 9 15837 1 1 56 ASP CG C 13.118 7.831 -10.378 1.00 . A A . 56 ASP CG 1 1 9 15838 1 1 56 ASP H H 10.131 6.978 -8.273 1.00 . A A . 56 ASP H 1 1 9 15839 1 1 56 ASP HA H 10.510 7.539 -11.098 1.00 . A A . 56 ASP HA 1 1 9 15840 1 1 56 ASP HB2 H 12.441 6.191 -9.174 1.00 . A A . 56 ASP HB2 1 1 9 15841 1 1 56 ASP HB3 H 12.502 5.843 -10.890 1.00 . A A . 56 ASP HB3 1 1 9 15842 1 1 56 ASP N N 10.230 7.554 -9.085 1.00 . A A . 56 ASP N 1 1 9 15843 1 1 56 ASP O O 10.592 4.478 -10.091 1.00 . A A . 56 ASP O 1 1 9 15844 1 1 56 ASP OD1 O 13.349 8.161 -11.561 1.00 . A A . 56 ASP OD1 1 1 9 15845 1 1 56 ASP OD2 O 13.546 8.410 -9.357 1.00 . A A . 56 ASP OD2 1 1 9 15846 1 1 57 LYS C C 8.857 3.289 -11.679 1.00 . A A . 57 LYS C 1 1 9 15847 1 1 57 LYS CA C 7.986 4.378 -11.052 1.00 . A A . 57 LYS CA 1 1 9 15848 1 1 57 LYS CB C 6.718 4.688 -11.850 1.00 . A A . 57 LYS CB 1 1 9 15849 1 1 57 LYS CD C 6.089 3.232 -13.811 1.00 . A A . 57 LYS CD 1 1 9 15850 1 1 57 LYS CE C 4.816 3.757 -14.478 1.00 . A A . 57 LYS CE 1 1 9 15851 1 1 57 LYS CG C 6.020 3.399 -12.292 1.00 . A A . 57 LYS CG 1 1 9 15852 1 1 57 LYS H H 8.319 6.434 -11.122 1.00 . A A . 57 LYS H 1 1 9 15853 1 1 57 LYS HA H 7.671 4.043 -10.064 1.00 . A A . 57 LYS HA 1 1 9 15854 1 1 57 LYS HB2 H 6.037 5.284 -11.242 1.00 . A A . 57 LYS HB2 1 1 9 15855 1 1 57 LYS HB3 H 6.971 5.286 -12.725 1.00 . A A . 57 LYS HB3 1 1 9 15856 1 1 57 LYS HD2 H 6.955 3.766 -14.200 1.00 . A A . 57 LYS HD2 1 1 9 15857 1 1 57 LYS HD3 H 6.225 2.179 -14.058 1.00 . A A . 57 LYS HD3 1 1 9 15858 1 1 57 LYS HE2 H 3.940 3.307 -14.010 1.00 . A A . 57 LYS HE2 1 1 9 15859 1 1 57 LYS HE3 H 4.739 4.834 -14.330 1.00 . A A . 57 LYS HE3 1 1 9 15860 1 1 57 LYS HG2 H 6.489 2.543 -11.806 1.00 . A A . 57 LYS HG2 1 1 9 15861 1 1 57 LYS HG3 H 4.979 3.417 -11.970 1.00 . A A . 57 LYS HG3 1 1 9 15862 1 1 57 LYS HZ1 H 5.767 3.389 -16.295 1.00 . A A . 57 LYS HZ1 1 1 9 15863 1 1 57 LYS HZ2 H 4.372 2.565 -16.128 1.00 . A A . 57 LYS HZ2 1 1 9 15864 1 1 57 LYS N N 8.779 5.582 -10.870 1.00 . A A . 57 LYS N 1 1 9 15865 1 1 57 LYS NZ N 4.825 3.449 -15.926 1.00 . A A . 57 LYS NZ 1 1 9 15866 1 1 57 LYS O O 8.837 2.141 -11.237 1.00 . A A . 57 LYS O 1 1 9 15867 1 1 58 LYS C C 11.785 2.615 -12.610 1.00 . A A . 58 LYS C 1 1 9 15868 1 1 58 LYS CA C 10.479 2.758 -13.393 1.00 . A A . 58 LYS CA 1 1 9 15869 1 1 58 LYS CB C 10.677 3.192 -14.847 1.00 . A A . 58 LYS CB 1 1 9 15870 1 1 58 LYS CD C 9.544 3.392 -17.091 1.00 . A A . 58 LYS CD 1 1 9 15871 1 1 58 LYS CE C 9.679 2.376 -18.227 1.00 . A A . 58 LYS CE 1 1 9 15872 1 1 58 LYS CG C 9.531 2.693 -15.730 1.00 . A A . 58 LYS CG 1 1 9 15873 1 1 58 LYS H H 9.613 4.622 -13.053 1.00 . A A . 58 LYS H 1 1 9 15874 1 1 58 LYS HA H 9.980 1.789 -13.412 1.00 . A A . 58 LYS HA 1 1 9 15875 1 1 58 LYS HB2 H 10.737 4.279 -14.901 1.00 . A A . 58 LYS HB2 1 1 9 15876 1 1 58 LYS HB3 H 11.625 2.803 -15.220 1.00 . A A . 58 LYS HB3 1 1 9 15877 1 1 58 LYS HD2 H 8.625 3.965 -17.218 1.00 . A A . 58 LYS HD2 1 1 9 15878 1 1 58 LYS HD3 H 10.370 4.102 -17.132 1.00 . A A . 58 LYS HD3 1 1 9 15879 1 1 58 LYS HE2 H 10.054 2.872 -19.123 1.00 . A A . 58 LYS HE2 1 1 9 15880 1 1 58 LYS HE3 H 10.409 1.613 -17.956 1.00 . A A . 58 LYS HE3 1 1 9 15881 1 1 58 LYS HG2 H 9.618 1.616 -15.869 1.00 . A A . 58 LYS HG2 1 1 9 15882 1 1 58 LYS HG3 H 8.579 2.875 -15.232 1.00 . A A . 58 LYS HG3 1 1 9 15883 1 1 58 LYS HZ1 H 7.897 2.188 -19.290 1.00 . A A . 58 LYS HZ1 1 1 9 15884 1 1 58 LYS HZ2 H 8.472 0.762 -18.754 1.00 . A A . 58 LYS HZ2 1 1 9 15885 1 1 58 LYS N N 9.602 3.686 -12.700 1.00 . A A . 58 LYS N 1 1 9 15886 1 1 58 LYS NZ N 8.373 1.742 -18.514 1.00 . A A . 58 LYS NZ 1 1 9 15887 1 1 58 LYS O O 12.861 2.908 -13.131 1.00 . A A . 58 LYS O 1 1 9 15888 1 1 59 ASP C C 12.429 1.062 -9.348 1.00 . A A . 59 ASP C 1 1 9 15889 1 1 59 ASP CA C 12.806 1.981 -10.511 1.00 . A A . 59 ASP CA 1 1 9 15890 1 1 59 ASP CB C 13.276 3.314 -9.927 1.00 . A A . 59 ASP CB 1 1 9 15891 1 1 59 ASP CG C 14.580 3.247 -9.130 1.00 . A A . 59 ASP CG 1 1 9 15892 1 1 59 ASP H H 10.771 1.929 -10.955 1.00 . A A . 59 ASP H 1 1 9 15893 1 1 59 ASP HA H 13.574 1.548 -11.153 1.00 . A A . 59 ASP HA 1 1 9 15894 1 1 59 ASP HB2 H 13.403 4.026 -10.743 1.00 . A A . 59 ASP HB2 1 1 9 15895 1 1 59 ASP HB3 H 12.492 3.707 -9.280 1.00 . A A . 59 ASP HB3 1 1 9 15896 1 1 59 ASP N N 11.650 2.165 -11.372 1.00 . A A . 59 ASP N 1 1 9 15897 1 1 59 ASP O O 11.858 1.513 -8.356 1.00 . A A . 59 ASP O 1 1 9 15898 1 1 59 ASP OD1 O 15.643 3.179 -9.785 1.00 . A A . 59 ASP OD1 1 1 9 15899 1 1 59 ASP OD2 O 14.485 3.264 -7.884 1.00 . A A . 59 ASP OD2 1 1 9 15900 1 1 60 LYS C C 13.686 -1.364 -7.574 1.00 . A A . 60 LYS C 1 1 9 15901 1 1 60 LYS CA C 12.466 -1.197 -8.483 1.00 . A A . 60 LYS CA 1 1 9 15902 1 1 60 LYS CB C 11.990 -2.504 -9.119 1.00 . A A . 60 LYS CB 1 1 9 15903 1 1 60 LYS CD C 10.770 -2.284 -11.316 1.00 . A A . 60 LYS CD 1 1 9 15904 1 1 60 LYS CE C 10.122 -1.026 -11.896 1.00 . A A . 60 LYS CE 1 1 9 15905 1 1 60 LYS CG C 10.628 -2.322 -9.793 1.00 . A A . 60 LYS CG 1 1 9 15906 1 1 60 LYS H H 13.227 -0.569 -10.318 1.00 . A A . 60 LYS H 1 1 9 15907 1 1 60 LYS HA H 11.641 -0.809 -7.886 1.00 . A A . 60 LYS HA 1 1 9 15908 1 1 60 LYS HB2 H 12.720 -2.843 -9.854 1.00 . A A . 60 LYS HB2 1 1 9 15909 1 1 60 LYS HB3 H 11.922 -3.280 -8.357 1.00 . A A . 60 LYS HB3 1 1 9 15910 1 1 60 LYS HD2 H 11.826 -2.313 -11.587 1.00 . A A . 60 LYS HD2 1 1 9 15911 1 1 60 LYS HD3 H 10.306 -3.170 -11.750 1.00 . A A . 60 LYS HD3 1 1 9 15912 1 1 60 LYS HE2 H 9.044 -1.168 -11.973 1.00 . A A . 60 LYS HE2 1 1 9 15913 1 1 60 LYS HE3 H 10.286 -0.183 -11.226 1.00 . A A . 60 LYS HE3 1 1 9 15914 1 1 60 LYS HG2 H 9.965 -3.137 -9.506 1.00 . A A . 60 LYS HG2 1 1 9 15915 1 1 60 LYS HG3 H 10.167 -1.398 -9.444 1.00 . A A . 60 LYS HG3 1 1 9 15916 1 1 60 LYS HZ1 H 9.975 -0.397 -13.878 1.00 . A A . 60 LYS HZ1 1 1 9 15917 1 1 60 LYS HZ2 H 11.396 0.000 -13.188 1.00 . A A . 60 LYS HZ2 1 1 9 15918 1 1 60 LYS N N 12.763 -0.210 -9.508 1.00 . A A . 60 LYS N 1 1 9 15919 1 1 60 LYS NZ N 10.685 -0.722 -13.231 1.00 . A A . 60 LYS NZ 1 1 9 15920 1 1 60 LYS O O 14.823 -1.322 -8.041 1.00 . A A . 60 LYS O 1 1 9 15921 1 1 61 SER C C 13.889 -1.656 -3.898 1.00 . A A . 61 SER C 1 1 9 15922 1 1 61 SER CA C 14.467 -1.723 -5.313 1.00 . A A . 61 SER CA 1 1 9 15923 1 1 61 SER CB C 15.559 -0.666 -5.491 1.00 . A A . 61 SER CB 1 1 9 15924 1 1 61 SER H H 12.479 -1.583 -5.920 1.00 . A A . 61 SER H 1 1 9 15925 1 1 61 SER HA H 14.883 -2.711 -5.510 1.00 . A A . 61 SER HA 1 1 9 15926 1 1 61 SER HB2 H 16.187 -0.933 -6.341 1.00 . A A . 61 SER HB2 1 1 9 15927 1 1 61 SER HB3 H 15.099 0.294 -5.723 1.00 . A A . 61 SER HB3 1 1 9 15928 1 1 61 SER HG H 17.068 0.165 -4.473 1.00 . A A . 61 SER HG 1 1 9 15929 1 1 61 SER N N 13.407 -1.550 -6.292 1.00 . A A . 61 SER N 1 1 9 15930 1 1 61 SER O O 14.014 -2.607 -3.127 1.00 . A A . 61 SER O 1 1 9 15931 1 1 61 SER OG O 16.369 -0.535 -4.326 1.00 . A A . 61 SER OG 1 1 9 15932 1 1 62 ALA C C 12.212 1.133 -2.165 1.00 . A A . 62 ALA C 1 1 9 15933 1 1 62 ALA CA C 12.670 -0.321 -2.291 1.00 . A A . 62 ALA CA 1 1 9 15934 1 1 62 ALA CB C 13.674 -0.713 -1.205 1.00 . A A . 62 ALA CB 1 1 9 15935 1 1 62 ALA H H 13.170 0.243 -4.233 1.00 . A A . 62 ALA H 1 1 9 15936 1 1 62 ALA HA H 11.801 -0.975 -2.218 1.00 . A A . 62 ALA HA 1 1 9 15937 1 1 62 ALA HB1 H 14.646 -0.904 -1.660 1.00 . A A . 62 ALA HB1 1 1 9 15938 1 1 62 ALA HB2 H 13.764 0.099 -0.484 1.00 . A A . 62 ALA HB2 1 1 9 15939 1 1 62 ALA HB3 H 13.328 -1.613 -0.697 1.00 . A A . 62 ALA HB3 1 1 9 15940 1 1 62 ALA N N 13.268 -0.525 -3.600 1.00 . A A . 62 ALA N 1 1 9 15941 1 1 62 ALA O O 11.150 1.407 -1.609 1.00 . A A . 62 ALA O 1 1 9 15942 1 1 63 LYS C C 11.591 3.751 -3.620 1.00 . A A . 63 LYS C 1 1 9 15943 1 1 63 LYS CA C 12.729 3.447 -2.643 1.00 . A A . 63 LYS CA 1 1 9 15944 1 1 63 LYS CB C 13.991 4.276 -2.891 1.00 . A A . 63 LYS CB 1 1 9 15945 1 1 63 LYS CD C 16.047 4.211 -4.350 1.00 . A A . 63 LYS CD 1 1 9 15946 1 1 63 LYS CE C 16.747 2.892 -4.018 1.00 . A A . 63 LYS CE 1 1 9 15947 1 1 63 LYS CG C 14.526 4.050 -4.307 1.00 . A A . 63 LYS CG 1 1 9 15948 1 1 63 LYS H H 13.898 1.796 -3.142 1.00 . A A . 63 LYS H 1 1 9 15949 1 1 63 LYS HA H 12.388 3.674 -1.633 1.00 . A A . 63 LYS HA 1 1 9 15950 1 1 63 LYS HB2 H 13.769 5.334 -2.747 1.00 . A A . 63 LYS HB2 1 1 9 15951 1 1 63 LYS HB3 H 14.755 4.009 -2.162 1.00 . A A . 63 LYS HB3 1 1 9 15952 1 1 63 LYS HD2 H 16.353 4.550 -5.340 1.00 . A A . 63 LYS HD2 1 1 9 15953 1 1 63 LYS HD3 H 16.355 4.979 -3.641 1.00 . A A . 63 LYS HD3 1 1 9 15954 1 1 63 LYS HE2 H 16.603 2.651 -2.964 1.00 . A A . 63 LYS HE2 1 1 9 15955 1 1 63 LYS HE3 H 16.300 2.081 -4.593 1.00 . A A . 63 LYS HE3 1 1 9 15956 1 1 63 LYS HG2 H 14.252 3.052 -4.648 1.00 . A A . 63 LYS HG2 1 1 9 15957 1 1 63 LYS HG3 H 14.062 4.760 -4.992 1.00 . A A . 63 LYS HG3 1 1 9 15958 1 1 63 LYS HZ1 H 18.487 3.938 -4.488 1.00 . A A . 63 LYS HZ1 1 1 9 15959 1 1 63 LYS HZ2 H 18.763 2.631 -3.557 1.00 . A A . 63 LYS HZ2 1 1 9 15960 1 1 63 LYS N N 13.036 2.027 -2.691 1.00 . A A . 63 LYS N 1 1 9 15961 1 1 63 LYS NZ N 18.193 2.982 -4.319 1.00 . A A . 63 LYS NZ 1 1 9 15962 1 1 63 LYS O O 11.090 4.873 -3.664 1.00 . A A . 63 LYS O 1 1 9 15963 1 1 64 GLY C C 8.777 2.820 -4.673 1.00 . A A . 64 GLY C 1 1 9 15964 1 1 64 GLY CA C 10.148 2.875 -5.352 1.00 . A A . 64 GLY CA 1 1 9 15965 1 1 64 GLY H H 11.630 1.821 -4.336 1.00 . A A . 64 GLY H 1 1 9 15966 1 1 64 GLY HA2 H 10.258 3.822 -5.880 1.00 . A A . 64 GLY HA2 1 1 9 15967 1 1 64 GLY HA3 H 10.221 2.084 -6.097 1.00 . A A . 64 GLY HA3 1 1 9 15968 1 1 64 GLY N N 11.217 2.731 -4.378 1.00 . A A . 64 GLY N 1 1 9 15969 1 1 64 GLY O O 8.227 1.739 -4.467 1.00 . A A . 64 GLY O 1 1 9 15970 1 1 65 TYR C C 5.906 3.320 -4.471 1.00 . A A . 65 TYR C 1 1 9 15971 1 1 65 TYR CA C 6.972 4.096 -3.694 1.00 . A A . 65 TYR CA 1 1 9 15972 1 1 65 TYR CB C 6.609 5.583 -3.700 1.00 . A A . 65 TYR CB 1 1 9 15973 1 1 65 TYR CD1 C 4.823 5.684 -1.923 1.00 . A A . 65 TYR CD1 1 1 9 15974 1 1 65 TYR CD2 C 4.244 6.333 -4.150 1.00 . A A . 65 TYR CD2 1 1 9 15975 1 1 65 TYR CE1 C 3.477 5.960 -1.493 1.00 . A A . 65 TYR CE1 1 1 9 15976 1 1 65 TYR CE2 C 2.898 6.609 -3.719 1.00 . A A . 65 TYR CE2 1 1 9 15977 1 1 65 TYR CG C 5.179 5.876 -3.243 1.00 . A A . 65 TYR CG 1 1 9 15978 1 1 65 TYR CZ C 2.581 6.409 -2.412 1.00 . A A . 65 TYR CZ 1 1 9 15979 1 1 65 TYR H H 8.721 4.871 -4.517 1.00 . A A . 65 TYR H 1 1 9 15980 1 1 65 TYR HA H 7.064 3.671 -2.695 1.00 . A A . 65 TYR HA 1 1 9 15981 1 1 65 TYR HB2 H 7.303 6.119 -3.053 1.00 . A A . 65 TYR HB2 1 1 9 15982 1 1 65 TYR HB3 H 6.745 5.975 -4.708 1.00 . A A . 65 TYR HB3 1 1 9 15983 1 1 65 TYR HD1 H 5.561 5.323 -1.207 1.00 . A A . 65 TYR HD1 1 1 9 15984 1 1 65 TYR HD2 H 4.525 6.484 -5.192 1.00 . A A . 65 TYR HD2 1 1 9 15985 1 1 65 TYR HE1 H 3.183 5.813 -0.454 1.00 . A A . 65 TYR HE1 1 1 9 15986 1 1 65 TYR HE2 H 2.150 6.970 -4.425 1.00 . A A . 65 TYR HE2 1 1 9 15987 1 1 65 TYR HH H 0.749 5.845 -2.086 1.00 . A A . 65 TYR HH 1 1 9 15988 1 1 65 TYR N N 8.267 3.997 -4.345 1.00 . A A . 65 TYR N 1 1 9 15989 1 1 65 TYR O O 5.066 2.647 -3.876 1.00 . A A . 65 TYR O 1 1 9 15990 1 1 65 TYR OH O 1.309 6.670 -2.006 1.00 . A A . 65 TYR OH 1 1 9 15991 1 1 66 TYR C C 5.411 1.288 -6.835 1.00 . A A . 66 TYR C 1 1 9 15992 1 1 66 TYR CA C 5.028 2.758 -6.653 1.00 . A A . 66 TYR CA 1 1 9 15993 1 1 66 TYR CB C 5.109 3.465 -8.008 1.00 . A A . 66 TYR CB 1 1 9 15994 1 1 66 TYR CD1 C 5.497 1.644 -9.708 1.00 . A A . 66 TYR CD1 1 1 9 15995 1 1 66 TYR CD2 C 3.398 2.786 -9.731 1.00 . A A . 66 TYR CD2 1 1 9 15996 1 1 66 TYR CE1 C 5.068 0.833 -10.818 1.00 . A A . 66 TYR CE1 1 1 9 15997 1 1 66 TYR CE2 C 2.969 1.976 -10.841 1.00 . A A . 66 TYR CE2 1 1 9 15998 1 1 66 TYR CG C 4.653 2.604 -9.187 1.00 . A A . 66 TYR CG 1 1 9 15999 1 1 66 TYR CZ C 3.825 1.039 -11.330 1.00 . A A . 66 TYR CZ 1 1 9 16000 1 1 66 TYR H H 6.663 3.989 -6.265 1.00 . A A . 66 TYR H 1 1 9 16001 1 1 66 TYR HA H 4.045 2.815 -6.186 1.00 . A A . 66 TYR HA 1 1 9 16002 1 1 66 TYR HB2 H 4.499 4.367 -7.973 1.00 . A A . 66 TYR HB2 1 1 9 16003 1 1 66 TYR HB3 H 6.138 3.782 -8.180 1.00 . A A . 66 TYR HB3 1 1 9 16004 1 1 66 TYR HD1 H 6.489 1.499 -9.279 1.00 . A A . 66 TYR HD1 1 1 9 16005 1 1 66 TYR HD2 H 2.731 3.545 -9.319 1.00 . A A . 66 TYR HD2 1 1 9 16006 1 1 66 TYR HE1 H 5.725 0.072 -11.239 1.00 . A A . 66 TYR HE1 1 1 9 16007 1 1 66 TYR HE2 H 1.980 2.110 -11.279 1.00 . A A . 66 TYR HE2 1 1 9 16008 1 1 66 TYR HH H 2.973 0.845 -13.066 1.00 . A A . 66 TYR HH 1 1 9 16009 1 1 66 TYR N N 5.976 3.440 -5.789 1.00 . A A . 66 TYR N 1 1 9 16010 1 1 66 TYR O O 4.719 0.544 -7.528 1.00 . A A . 66 TYR O 1 1 9 16011 1 1 66 TYR OH O 3.419 0.273 -12.378 1.00 . A A . 66 TYR OH 1 1 9 16012 1 1 67 HIS C C 6.568 -1.226 -5.032 1.00 . A A . 67 HIS C 1 1 9 16013 1 1 67 HIS CA C 6.994 -0.455 -6.283 1.00 . A A . 67 HIS CA 1 1 9 16014 1 1 67 HIS CB C 8.507 -0.484 -6.511 1.00 . A A . 67 HIS CB 1 1 9 16015 1 1 67 HIS CD2 C 9.613 -1.804 -4.544 1.00 . A A . 67 HIS CD2 1 1 9 16016 1 1 67 HIS CE1 C 10.157 -3.612 -5.650 1.00 . A A . 67 HIS CE1 1 1 9 16017 1 1 67 HIS CG C 9.207 -1.639 -5.836 1.00 . A A . 67 HIS CG 1 1 9 16018 1 1 67 HIS H H 7.068 1.524 -5.638 1.00 . A A . 67 HIS H 1 1 9 16019 1 1 67 HIS HA H 6.518 -0.902 -7.155 1.00 . A A . 67 HIS HA 1 1 9 16020 1 1 67 HIS HB2 H 8.702 -0.530 -7.582 1.00 . A A . 67 HIS HB2 1 1 9 16021 1 1 67 HIS HB3 H 8.937 0.449 -6.148 1.00 . A A . 67 HIS HB3 1 1 9 16022 1 1 67 HIS HD1 H 9.402 -2.982 -7.477 1.00 . A A . 67 HIS HD1 1 1 9 16023 1 1 67 HIS HD2 H 9.488 -1.079 -3.740 1.00 . A A . 67 HIS HD2 1 1 9 16024 1 1 67 HIS HE1 H 10.552 -4.602 -5.876 1.00 . A A . 67 HIS HE1 1 1 9 16025 1 1 67 HIS N N 6.511 0.913 -6.200 1.00 . A A . 67 HIS N 1 1 9 16026 1 1 67 HIS ND1 N 9.564 -2.795 -6.508 1.00 . A A . 67 HIS ND1 1 1 9 16027 1 1 67 HIS NE2 N 10.186 -2.996 -4.433 1.00 . A A . 67 HIS NE2 1 1 9 16028 1 1 67 HIS O O 6.492 -2.454 -5.051 1.00 . A A . 67 HIS O 1 1 9 16029 1 1 68 VAL C C 4.357 -1.052 -2.629 1.00 . A A . 68 VAL C 1 1 9 16030 1 1 68 VAL CA C 5.884 -1.072 -2.717 1.00 . A A . 68 VAL CA 1 1 9 16031 1 1 68 VAL CB C 6.561 -0.355 -1.548 1.00 . A A . 68 VAL CB 1 1 9 16032 1 1 68 VAL CG1 C 7.993 -0.856 -1.351 1.00 . A A . 68 VAL CG1 1 1 9 16033 1 1 68 VAL CG2 C 6.533 1.162 -1.745 1.00 . A A . 68 VAL CG2 1 1 9 16034 1 1 68 VAL H H 6.364 0.524 -3.968 1.00 . A A . 68 VAL H 1 1 9 16035 1 1 68 VAL HA H 6.222 -2.109 -2.718 1.00 . A A . 68 VAL HA 1 1 9 16036 1 1 68 VAL HB H 5.998 -0.585 -0.643 1.00 . A A . 68 VAL HB 1 1 9 16037 1 1 68 VAL HG11 H 8.042 -1.918 -1.592 1.00 . A A . 68 VAL HG11 1 1 9 16038 1 1 68 VAL HG12 H 8.665 -0.304 -2.007 1.00 . A A . 68 VAL HG12 1 1 9 16039 1 1 68 VAL HG13 H 8.292 -0.705 -0.314 1.00 . A A . 68 VAL HG13 1 1 9 16040 1 1 68 VAL HG21 H 5.537 1.469 -2.065 1.00 . A A . 68 VAL HG21 1 1 9 16041 1 1 68 VAL HG22 H 6.781 1.655 -0.805 1.00 . A A . 68 VAL HG22 1 1 9 16042 1 1 68 VAL HG23 H 7.261 1.443 -2.506 1.00 . A A . 68 VAL HG23 1 1 9 16043 1 1 68 VAL N N 6.300 -0.474 -3.975 1.00 . A A . 68 VAL N 1 1 9 16044 1 1 68 VAL O O 3.788 -1.348 -1.579 1.00 . A A . 68 VAL O 1 1 9 16045 1 1 69 MET C C 1.737 -1.618 -4.842 1.00 . A A . 69 MET C 1 1 9 16046 1 1 69 MET CA C 2.286 -0.635 -3.806 1.00 . A A . 69 MET CA 1 1 9 16047 1 1 69 MET CB C 1.852 0.786 -4.171 1.00 . A A . 69 MET CB 1 1 9 16048 1 1 69 MET CE C 2.709 2.062 -0.504 1.00 . A A . 69 MET CE 1 1 9 16049 1 1 69 MET CG C 2.470 1.810 -3.217 1.00 . A A . 69 MET CG 1 1 9 16050 1 1 69 MET H H 4.206 -0.459 -4.595 1.00 . A A . 69 MET H 1 1 9 16051 1 1 69 MET HA H 1.938 -0.913 -2.811 1.00 . A A . 69 MET HA 1 1 9 16052 1 1 69 MET HB2 H 2.152 1.010 -5.195 1.00 . A A . 69 MET HB2 1 1 9 16053 1 1 69 MET HB3 H 0.765 0.859 -4.135 1.00 . A A . 69 MET HB3 1 1 9 16054 1 1 69 MET HE1 H 3.627 1.612 -0.882 1.00 . A A . 69 MET HE1 1 1 9 16055 1 1 69 MET HE2 H 2.897 3.103 -0.241 1.00 . A A . 69 MET HE2 1 1 9 16056 1 1 69 MET HE3 H 2.374 1.518 0.379 1.00 . A A . 69 MET HE3 1 1 9 16057 1 1 69 MET HG2 H 3.472 1.493 -2.930 1.00 . A A . 69 MET HG2 1 1 9 16058 1 1 69 MET HG3 H 2.571 2.772 -3.719 1.00 . A A . 69 MET HG3 1 1 9 16059 1 1 69 MET N N 3.736 -0.699 -3.745 1.00 . A A . 69 MET N 1 1 9 16060 1 1 69 MET O O 0.534 -1.870 -4.889 1.00 . A A . 69 MET O 1 1 9 16061 1 1 69 MET SD S 1.447 1.985 -1.764 1.00 . A A . 69 MET SD 1 1 9 16062 1 1 70 HIS C C 3.263 -4.261 -6.696 1.00 . A A . 70 HIS C 1 1 9 16063 1 1 70 HIS CA C 2.268 -3.098 -6.680 1.00 . A A . 70 HIS CA 1 1 9 16064 1 1 70 HIS CB C 2.145 -2.404 -8.038 1.00 . A A . 70 HIS CB 1 1 9 16065 1 1 70 HIS CD2 C 0.190 -0.696 -8.339 1.00 . A A . 70 HIS CD2 1 1 9 16066 1 1 70 HIS CE1 C 1.216 1.087 -7.592 1.00 . A A . 70 HIS CE1 1 1 9 16067 1 1 70 HIS CG C 1.454 -1.063 -7.982 1.00 . A A . 70 HIS CG 1 1 9 16068 1 1 70 HIS H H 3.623 -1.939 -5.603 1.00 . A A . 70 HIS H 1 1 9 16069 1 1 70 HIS HA H 1.283 -3.478 -6.411 1.00 . A A . 70 HIS HA 1 1 9 16070 1 1 70 HIS HB2 H 3.142 -2.270 -8.458 1.00 . A A . 70 HIS HB2 1 1 9 16071 1 1 70 HIS HB3 H 1.598 -3.055 -8.719 1.00 . A A . 70 HIS HB3 1 1 9 16072 1 1 70 HIS HD1 H 3.016 0.141 -7.178 1.00 . A A . 70 HIS HD1 1 1 9 16073 1 1 70 HIS HD2 H -0.573 -1.357 -8.749 1.00 . A A . 70 HIS HD2 1 1 9 16074 1 1 70 HIS HE1 H 1.408 2.119 -7.299 1.00 . A A . 70 HIS HE1 1 1 9 16075 1 1 70 HIS N N 2.646 -2.148 -5.648 1.00 . A A . 70 HIS N 1 1 9 16076 1 1 70 HIS ND1 N 2.077 0.082 -7.516 1.00 . A A . 70 HIS ND1 1 1 9 16077 1 1 70 HIS NE2 N 0.047 0.602 -8.102 1.00 . A A . 70 HIS NE2 1 1 9 16078 1 1 70 HIS O O 2.892 -5.403 -6.432 1.00 . A A . 70 HIS O 1 1 9 16079 1 1 71 ASP C C 5.327 -5.966 -5.960 1.00 . A A . 71 ASP C 1 1 9 16080 1 1 71 ASP CA C 5.557 -4.932 -7.064 1.00 . A A . 71 ASP CA 1 1 9 16081 1 1 71 ASP CB C 6.933 -4.301 -6.841 1.00 . A A . 71 ASP CB 1 1 9 16082 1 1 71 ASP CG C 8.064 -4.903 -7.677 1.00 . A A . 71 ASP CG 1 1 9 16083 1 1 71 ASP H H 4.800 -2.998 -7.223 1.00 . A A . 71 ASP H 1 1 9 16084 1 1 71 ASP HA H 5.488 -5.364 -8.062 1.00 . A A . 71 ASP HA 1 1 9 16085 1 1 71 ASP HB2 H 6.867 -3.235 -7.060 1.00 . A A . 71 ASP HB2 1 1 9 16086 1 1 71 ASP HB3 H 7.192 -4.393 -5.786 1.00 . A A . 71 ASP HB3 1 1 9 16087 1 1 71 ASP N N 4.507 -3.929 -7.010 1.00 . A A . 71 ASP N 1 1 9 16088 1 1 71 ASP O O 5.047 -5.608 -4.818 1.00 . A A . 71 ASP O 1 1 9 16089 1 1 71 ASP OD1 O 8.667 -5.885 -7.192 1.00 . A A . 71 ASP OD1 1 1 9 16090 1 1 71 ASP OD2 O 8.299 -4.368 -8.782 1.00 . A A . 71 ASP OD2 1 1 9 16091 1 1 72 LYS C C 6.616 -8.726 -4.816 1.00 . A A . 72 LYS C 1 1 9 16092 1 1 72 LYS CA C 5.262 -8.318 -5.398 1.00 . A A . 72 LYS CA 1 1 9 16093 1 1 72 LYS CB C 4.504 -9.471 -6.058 1.00 . A A . 72 LYS CB 1 1 9 16094 1 1 72 LYS CD C 2.166 -10.406 -6.210 1.00 . A A . 72 LYS CD 1 1 9 16095 1 1 72 LYS CE C 2.232 -11.109 -4.853 1.00 . A A . 72 LYS CE 1 1 9 16096 1 1 72 LYS CG C 3.019 -9.135 -6.211 1.00 . A A . 72 LYS CG 1 1 9 16097 1 1 72 LYS H H 5.681 -7.512 -7.273 1.00 . A A . 72 LYS H 1 1 9 16098 1 1 72 LYS HA H 4.636 -7.942 -4.589 1.00 . A A . 72 LYS HA 1 1 9 16099 1 1 72 LYS HB2 H 4.935 -9.682 -7.037 1.00 . A A . 72 LYS HB2 1 1 9 16100 1 1 72 LYS HB3 H 4.616 -10.375 -5.459 1.00 . A A . 72 LYS HB3 1 1 9 16101 1 1 72 LYS HD2 H 1.132 -10.154 -6.443 1.00 . A A . 72 LYS HD2 1 1 9 16102 1 1 72 LYS HD3 H 2.514 -11.082 -6.991 1.00 . A A . 72 LYS HD3 1 1 9 16103 1 1 72 LYS HE2 H 2.711 -10.458 -4.122 1.00 . A A . 72 LYS HE2 1 1 9 16104 1 1 72 LYS HE3 H 1.224 -11.307 -4.490 1.00 . A A . 72 LYS HE3 1 1 9 16105 1 1 72 LYS HG2 H 2.705 -8.482 -5.397 1.00 . A A . 72 LYS HG2 1 1 9 16106 1 1 72 LYS HG3 H 2.860 -8.587 -7.139 1.00 . A A . 72 LYS HG3 1 1 9 16107 1 1 72 LYS HZ1 H 3.855 -12.262 -5.470 1.00 . A A . 72 LYS HZ1 1 1 9 16108 1 1 72 LYS HZ2 H 3.223 -12.759 -4.054 1.00 . A A . 72 LYS HZ2 1 1 9 16109 1 1 72 LYS N N 5.453 -7.229 -6.341 1.00 . A A . 72 LYS N 1 1 9 16110 1 1 72 LYS NZ N 2.984 -12.379 -4.963 1.00 . A A . 72 LYS NZ 1 1 9 16111 1 1 72 LYS O O 6.737 -8.946 -3.612 1.00 . A A . 72 LYS O 1 1 9 16112 1 1 73 ASN C C 9.482 -8.151 -4.303 1.00 . A A . 73 ASN C 1 1 9 16113 1 1 73 ASN CA C 8.943 -9.192 -5.286 1.00 . A A . 73 ASN CA 1 1 9 16114 1 1 73 ASN CB C 9.892 -9.248 -6.484 1.00 . A A . 73 ASN CB 1 1 9 16115 1 1 73 ASN CG C 10.264 -10.692 -6.823 1.00 . A A . 73 ASN CG 1 1 9 16116 1 1 73 ASN H H 7.495 -8.633 -6.675 1.00 . A A . 73 ASN H 1 1 9 16117 1 1 73 ASN HA H 8.836 -10.178 -4.832 1.00 . A A . 73 ASN HA 1 1 9 16118 1 1 73 ASN HB2 H 9.421 -8.777 -7.347 1.00 . A A . 73 ASN HB2 1 1 9 16119 1 1 73 ASN HB3 H 10.795 -8.678 -6.264 1.00 . A A . 73 ASN HB3 1 1 9 16120 1 1 73 ASN HD21 H 10.613 -10.106 -8.729 1.00 . A A . 73 ASN HD21 1 1 9 16121 1 1 73 ASN HD22 H 10.872 -11.789 -8.413 1.00 . A A . 73 ASN HD22 1 1 9 16122 1 1 73 ASN N N 7.602 -8.814 -5.697 1.00 . A A . 73 ASN N 1 1 9 16123 1 1 73 ASN ND2 N 10.612 -10.877 -8.093 1.00 . A A . 73 ASN ND2 1 1 9 16124 1 1 73 ASN O O 10.228 -7.254 -4.691 1.00 . A A . 73 ASN O 1 1 9 16125 1 1 73 ASN OD1 O 10.237 -11.580 -5.987 1.00 . A A . 73 ASN OD1 1 1 9 16126 1 1 74 THR C C 9.708 -8.138 -0.685 1.00 . A A . 74 THR C 1 1 9 16127 1 1 74 THR CA C 9.518 -7.391 -2.007 1.00 . A A . 74 THR CA 1 1 9 16128 1 1 74 THR CB C 8.498 -6.254 -1.922 1.00 . A A . 74 THR CB 1 1 9 16129 1 1 74 THR CG2 C 8.285 -5.557 -3.267 1.00 . A A . 74 THR CG2 1 1 9 16130 1 1 74 THR H H 8.478 -9.040 -2.741 1.00 . A A . 74 THR H 1 1 9 16131 1 1 74 THR HA H 10.491 -6.987 -2.288 1.00 . A A . 74 THR HA 1 1 9 16132 1 1 74 THR HB H 8.779 -5.536 -1.151 1.00 . A A . 74 THR HB 1 1 9 16133 1 1 74 THR HG1 H 7.028 -6.853 -0.703 1.00 . A A . 74 THR HG1 1 1 9 16134 1 1 74 THR HG21 H 9.244 -5.435 -3.770 1.00 . A A . 74 THR HG21 1 1 9 16135 1 1 74 THR HG22 H 7.623 -6.160 -3.888 1.00 . A A . 74 THR HG22 1 1 9 16136 1 1 74 THR HG23 H 7.835 -4.578 -3.102 1.00 . A A . 74 THR HG23 1 1 9 16137 1 1 74 THR N N 9.084 -8.307 -3.048 1.00 . A A . 74 THR N 1 1 9 16138 1 1 74 THR O O 9.026 -9.128 -0.424 1.00 . A A . 74 THR O 1 1 9 16139 1 1 74 THR OG1 O 7.261 -6.916 -1.674 1.00 . A A . 74 THR OG1 1 1 9 16140 1 1 75 LYS C C 9.697 -8.116 2.307 1.00 . A A . 75 LYS C 1 1 9 16141 1 1 75 LYS CA C 10.925 -8.242 1.402 1.00 . A A . 75 LYS CA 1 1 9 16142 1 1 75 LYS CB C 12.197 -7.643 2.005 1.00 . A A . 75 LYS CB 1 1 9 16143 1 1 75 LYS CD C 12.074 -7.190 4.483 1.00 . A A . 75 LYS CD 1 1 9 16144 1 1 75 LYS CE C 11.874 -7.877 5.835 1.00 . A A . 75 LYS CE 1 1 9 16145 1 1 75 LYS CG C 12.458 -8.205 3.404 1.00 . A A . 75 LYS CG 1 1 9 16146 1 1 75 LYS H H 11.187 -6.829 -0.105 1.00 . A A . 75 LYS H 1 1 9 16147 1 1 75 LYS HA H 11.118 -9.301 1.229 1.00 . A A . 75 LYS HA 1 1 9 16148 1 1 75 LYS HB2 H 13.047 -7.858 1.358 1.00 . A A . 75 LYS HB2 1 1 9 16149 1 1 75 LYS HB3 H 12.103 -6.558 2.057 1.00 . A A . 75 LYS HB3 1 1 9 16150 1 1 75 LYS HD2 H 12.852 -6.432 4.568 1.00 . A A . 75 LYS HD2 1 1 9 16151 1 1 75 LYS HD3 H 11.158 -6.675 4.194 1.00 . A A . 75 LYS HD3 1 1 9 16152 1 1 75 LYS HE2 H 10.814 -7.894 6.088 1.00 . A A . 75 LYS HE2 1 1 9 16153 1 1 75 LYS HE3 H 12.204 -8.914 5.775 1.00 . A A . 75 LYS HE3 1 1 9 16154 1 1 75 LYS HG2 H 11.888 -9.123 3.543 1.00 . A A . 75 LYS HG2 1 1 9 16155 1 1 75 LYS HG3 H 13.512 -8.466 3.504 1.00 . A A . 75 LYS HG3 1 1 9 16156 1 1 75 LYS HZ1 H 12.018 -6.774 7.597 1.00 . A A . 75 LYS HZ1 1 1 9 16157 1 1 75 LYS HZ2 H 13.274 -7.786 7.376 1.00 . A A . 75 LYS HZ2 1 1 9 16158 1 1 75 LYS N N 10.637 -7.635 0.114 1.00 . A A . 75 LYS N 1 1 9 16159 1 1 75 LYS NZ N 12.630 -7.170 6.893 1.00 . A A . 75 LYS NZ 1 1 9 16160 1 1 75 LYS O O 9.539 -8.882 3.256 1.00 . A A . 75 LYS O 1 1 9 16161 1 1 76 PHE C C 6.404 -7.073 1.882 1.00 . A A . 76 PHE C 1 1 9 16162 1 1 76 PHE CA C 7.651 -6.905 2.752 1.00 . A A . 76 PHE CA 1 1 9 16163 1 1 76 PHE CB C 7.734 -5.454 3.230 1.00 . A A . 76 PHE CB 1 1 9 16164 1 1 76 PHE CD1 C 8.839 -5.812 5.468 1.00 . A A . 76 PHE CD1 1 1 9 16165 1 1 76 PHE CD2 C 9.891 -4.338 3.907 1.00 . A A . 76 PHE CD2 1 1 9 16166 1 1 76 PHE CE1 C 9.897 -5.565 6.413 1.00 . A A . 76 PHE CE1 1 1 9 16167 1 1 76 PHE CE2 C 10.949 -4.092 4.852 1.00 . A A . 76 PHE CE2 1 1 9 16168 1 1 76 PHE CG C 8.858 -5.193 4.234 1.00 . A A . 76 PHE CG 1 1 9 16169 1 1 76 PHE CZ C 10.900 -4.718 6.058 1.00 . A A . 76 PHE CZ 1 1 9 16170 1 1 76 PHE H H 8.995 -6.523 1.207 1.00 . A A . 76 PHE H 1 1 9 16171 1 1 76 PHE HA H 7.621 -7.634 3.562 1.00 . A A . 76 PHE HA 1 1 9 16172 1 1 76 PHE HB2 H 7.874 -4.805 2.366 1.00 . A A . 76 PHE HB2 1 1 9 16173 1 1 76 PHE HB3 H 6.782 -5.177 3.685 1.00 . A A . 76 PHE HB3 1 1 9 16174 1 1 76 PHE HD1 H 8.023 -6.486 5.726 1.00 . A A . 76 PHE HD1 1 1 9 16175 1 1 76 PHE HD2 H 9.906 -3.850 2.932 1.00 . A A . 76 PHE HD2 1 1 9 16176 1 1 76 PHE HE1 H 9.894 -6.048 7.391 1.00 . A A . 76 PHE HE1 1 1 9 16177 1 1 76 PHE HE2 H 11.771 -3.420 4.606 1.00 . A A . 76 PHE HE2 1 1 9 16178 1 1 76 PHE HZ H 11.684 -4.610 6.851 1.00 . A A . 76 PHE HZ 1 1 9 16179 1 1 76 PHE N N 8.859 -7.142 1.981 1.00 . A A . 76 PHE N 1 1 9 16180 1 1 76 PHE O O 6.476 -6.966 0.659 1.00 . A A . 76 PHE O 1 1 9 16181 1 1 77 LYS C C 3.602 -6.192 1.215 1.00 . A A . 77 LYS C 1 1 9 16182 1 1 77 LYS CA C 4.026 -7.517 1.850 1.00 . A A . 77 LYS CA 1 1 9 16183 1 1 77 LYS CB C 2.976 -8.113 2.791 1.00 . A A . 77 LYS CB 1 1 9 16184 1 1 77 LYS CD C 2.184 -10.503 2.924 1.00 . A A . 77 LYS CD 1 1 9 16185 1 1 77 LYS CE C 1.947 -11.421 4.125 1.00 . A A . 77 LYS CE 1 1 9 16186 1 1 77 LYS CG C 3.345 -9.543 3.189 1.00 . A A . 77 LYS CG 1 1 9 16187 1 1 77 LYS H H 5.237 -7.419 3.543 1.00 . A A . 77 LYS H 1 1 9 16188 1 1 77 LYS HA H 4.195 -8.243 1.055 1.00 . A A . 77 LYS HA 1 1 9 16189 1 1 77 LYS HB2 H 2.889 -7.494 3.684 1.00 . A A . 77 LYS HB2 1 1 9 16190 1 1 77 LYS HB3 H 2.001 -8.107 2.303 1.00 . A A . 77 LYS HB3 1 1 9 16191 1 1 77 LYS HD2 H 1.278 -9.934 2.712 1.00 . A A . 77 LYS HD2 1 1 9 16192 1 1 77 LYS HD3 H 2.398 -11.103 2.040 1.00 . A A . 77 LYS HD3 1 1 9 16193 1 1 77 LYS HE2 H 2.859 -11.972 4.354 1.00 . A A . 77 LYS HE2 1 1 9 16194 1 1 77 LYS HE3 H 1.705 -10.824 5.004 1.00 . A A . 77 LYS HE3 1 1 9 16195 1 1 77 LYS HG2 H 4.223 -9.866 2.629 1.00 . A A . 77 LYS HG2 1 1 9 16196 1 1 77 LYS HG3 H 3.613 -9.573 4.245 1.00 . A A . 77 LYS HG3 1 1 9 16197 1 1 77 LYS HZ1 H 0.828 -12.653 2.870 1.00 . A A . 77 LYS HZ1 1 1 9 16198 1 1 77 LYS HZ2 H 0.922 -13.215 4.396 1.00 . A A . 77 LYS HZ2 1 1 9 16199 1 1 77 LYS N N 5.288 -7.333 2.547 1.00 . A A . 77 LYS N 1 1 9 16200 1 1 77 LYS NZ N 0.845 -12.369 3.843 1.00 . A A . 77 LYS NZ 1 1 9 16201 1 1 77 LYS O O 3.554 -5.163 1.888 1.00 . A A . 77 LYS O 1 1 9 16202 1 1 78 SER C C 1.359 -5.037 -0.909 1.00 . A A . 78 SER C 1 1 9 16203 1 1 78 SER CA C 2.885 -5.077 -0.808 1.00 . A A . 78 SER CA 1 1 9 16204 1 1 78 SER CB C 3.510 -5.045 -2.204 1.00 . A A . 78 SER CB 1 1 9 16205 1 1 78 SER H H 3.344 -7.099 -0.615 1.00 . A A . 78 SER H 1 1 9 16206 1 1 78 SER HA H 3.252 -4.231 -0.227 1.00 . A A . 78 SER HA 1 1 9 16207 1 1 78 SER HB2 H 3.993 -4.081 -2.363 1.00 . A A . 78 SER HB2 1 1 9 16208 1 1 78 SER HB3 H 4.288 -5.805 -2.270 1.00 . A A . 78 SER HB3 1 1 9 16209 1 1 78 SER HG H 2.993 -5.311 -4.119 1.00 . A A . 78 SER HG 1 1 9 16210 1 1 78 SER N N 3.303 -6.259 -0.074 1.00 . A A . 78 SER N 1 1 9 16211 1 1 78 SER O O 0.693 -6.052 -0.711 1.00 . A A . 78 SER O 1 1 9 16212 1 1 78 SER OG O 2.543 -5.266 -3.227 1.00 . A A . 78 SER OG 1 1 9 16213 1 1 79 CYS C C -1.136 -4.779 -2.242 1.00 . A A . 79 CYS C 1 1 9 16214 1 1 79 CYS CA C -0.587 -3.668 -1.346 1.00 . A A . 79 CYS CA 1 1 9 16215 1 1 79 CYS CB C -0.931 -2.277 -1.884 1.00 . A A . 79 CYS CB 1 1 9 16216 1 1 79 CYS H H 1.397 -3.033 -1.376 1.00 . A A . 79 CYS H 1 1 9 16217 1 1 79 CYS HA H -1.003 -3.739 -0.341 1.00 . A A . 79 CYS HA 1 1 9 16218 1 1 79 CYS HB2 H -0.595 -2.211 -2.919 1.00 . A A . 79 CYS HB2 1 1 9 16219 1 1 79 CYS HB3 H -2.015 -2.165 -1.894 1.00 . A A . 79 CYS HB3 1 1 9 16220 1 1 79 CYS N N 0.849 -3.853 -1.217 1.00 . A A . 79 CYS N 1 1 9 16221 1 1 79 CYS O O -1.889 -5.637 -1.783 1.00 . A A . 79 CYS O 1 1 9 16222 1 1 79 CYS SG S -0.205 -0.887 -0.941 1.00 . A A . 79 CYS SG 1 1 9 16223 1 1 80 VAL C C -0.658 -7.097 -4.057 1.00 . A A . 80 VAL C 1 1 9 16224 1 1 80 VAL CA C -1.182 -5.720 -4.470 1.00 . A A . 80 VAL CA 1 1 9 16225 1 1 80 VAL CB C -0.746 -5.312 -5.878 1.00 . A A . 80 VAL CB 1 1 9 16226 1 1 80 VAL CG1 C -1.063 -6.413 -6.892 1.00 . A A . 80 VAL CG1 1 1 9 16227 1 1 80 VAL CG2 C -1.390 -3.986 -6.289 1.00 . A A . 80 VAL CG2 1 1 9 16228 1 1 80 VAL H H -0.126 -4.028 -3.870 1.00 . A A . 80 VAL H 1 1 9 16229 1 1 80 VAL HA H -2.272 -5.738 -4.446 1.00 . A A . 80 VAL HA 1 1 9 16230 1 1 80 VAL HB H 0.335 -5.169 -5.866 1.00 . A A . 80 VAL HB 1 1 9 16231 1 1 80 VAL HG11 H -1.920 -6.991 -6.544 1.00 . A A . 80 VAL HG11 1 1 9 16232 1 1 80 VAL HG12 H -1.296 -5.963 -7.857 1.00 . A A . 80 VAL HG12 1 1 9 16233 1 1 80 VAL HG13 H -0.200 -7.071 -6.996 1.00 . A A . 80 VAL HG13 1 1 9 16234 1 1 80 VAL HG21 H -2.263 -3.797 -5.665 1.00 . A A . 80 VAL HG21 1 1 9 16235 1 1 80 VAL HG22 H -0.670 -3.178 -6.162 1.00 . A A . 80 VAL HG22 1 1 9 16236 1 1 80 VAL HG23 H -1.695 -4.039 -7.334 1.00 . A A . 80 VAL HG23 1 1 9 16237 1 1 80 VAL N N -0.738 -4.728 -3.505 1.00 . A A . 80 VAL N 1 1 9 16238 1 1 80 VAL O O -1.343 -8.104 -4.232 1.00 . A A . 80 VAL O 1 1 9 16239 1 1 81 GLY C C 0.249 -9.114 -2.146 1.00 . A A . 81 GLY C 1 1 9 16240 1 1 81 GLY CA C 1.176 -8.333 -3.079 1.00 . A A . 81 GLY CA 1 1 9 16241 1 1 81 GLY H H 1.103 -6.273 -3.379 1.00 . A A . 81 GLY H 1 1 9 16242 1 1 81 GLY HA2 H 1.426 -8.946 -3.945 1.00 . A A . 81 GLY HA2 1 1 9 16243 1 1 81 GLY HA3 H 2.112 -8.111 -2.566 1.00 . A A . 81 GLY HA3 1 1 9 16244 1 1 81 GLY N N 0.552 -7.097 -3.518 1.00 . A A . 81 GLY N 1 1 9 16245 1 1 81 GLY O O -0.110 -10.255 -2.433 1.00 . A A . 81 GLY O 1 1 9 16246 1 1 82 CYS C C -2.343 -9.347 -0.734 1.00 . A A . 82 CYS C 1 1 9 16247 1 1 82 CYS CA C -0.990 -9.089 -0.069 1.00 . A A . 82 CYS CA 1 1 9 16248 1 1 82 CYS CB C -1.127 -8.232 1.192 1.00 . A A . 82 CYS CB 1 1 9 16249 1 1 82 CYS H H 0.185 -7.541 -0.820 1.00 . A A . 82 CYS H 1 1 9 16250 1 1 82 CYS HA H -0.518 -10.026 0.226 1.00 . A A . 82 CYS HA 1 1 9 16251 1 1 82 CYS HB2 H -0.140 -7.994 1.589 1.00 . A A . 82 CYS HB2 1 1 9 16252 1 1 82 CYS HB3 H -1.609 -7.286 0.947 1.00 . A A . 82 CYS HB3 1 1 9 16253 1 1 82 CYS N N -0.112 -8.469 -1.046 1.00 . A A . 82 CYS N 1 1 9 16254 1 1 82 CYS O O -2.911 -10.429 -0.594 1.00 . A A . 82 CYS O 1 1 9 16255 1 1 82 CYS SG S -2.108 -9.126 2.452 1.00 . A A . 82 CYS SG 1 1 9 16256 1 1 83 HIS C C -4.105 -9.688 -3.011 1.00 . A A . 83 HIS C 1 1 9 16257 1 1 83 HIS CA C -4.097 -8.438 -2.130 1.00 . A A . 83 HIS CA 1 1 9 16258 1 1 83 HIS CB C -4.398 -7.158 -2.913 1.00 . A A . 83 HIS CB 1 1 9 16259 1 1 83 HIS CD2 C -4.762 -5.748 -0.742 1.00 . A A . 83 HIS CD2 1 1 9 16260 1 1 83 HIS CE1 C -6.068 -4.209 -1.587 1.00 . A A . 83 HIS CE1 1 1 9 16261 1 1 83 HIS CG C -4.939 -6.032 -2.065 1.00 . A A . 83 HIS CG 1 1 9 16262 1 1 83 HIS H H -2.352 -7.458 -1.552 1.00 . A A . 83 HIS H 1 1 9 16263 1 1 83 HIS HA H -4.859 -8.542 -1.358 1.00 . A A . 83 HIS HA 1 1 9 16264 1 1 83 HIS HB2 H -3.485 -6.823 -3.405 1.00 . A A . 83 HIS HB2 1 1 9 16265 1 1 83 HIS HB3 H -5.118 -7.386 -3.698 1.00 . A A . 83 HIS HB3 1 1 9 16266 1 1 83 HIS HD1 H -6.083 -4.974 -3.515 1.00 . A A . 83 HIS HD1 1 1 9 16267 1 1 83 HIS HD2 H -4.163 -6.328 -0.041 1.00 . A A . 83 HIS HD2 1 1 9 16268 1 1 83 HIS HE1 H -6.703 -3.327 -1.668 1.00 . A A . 83 HIS HE1 1 1 9 16269 1 1 83 HIS N N -2.820 -8.334 -1.443 1.00 . A A . 83 HIS N 1 1 9 16270 1 1 83 HIS ND1 N -5.767 -5.045 -2.569 1.00 . A A . 83 HIS ND1 1 1 9 16271 1 1 83 HIS NE2 N -5.444 -4.646 -0.455 1.00 . A A . 83 HIS NE2 1 1 9 16272 1 1 83 HIS O O -5.088 -10.428 -3.035 1.00 . A A . 83 HIS O 1 1 9 16273 1 1 84 VAL C C -3.078 -12.317 -3.789 1.00 . A A . 84 VAL C 1 1 9 16274 1 1 84 VAL CA C -2.868 -11.033 -4.595 1.00 . A A . 84 VAL CA 1 1 9 16275 1 1 84 VAL CB C -1.515 -10.992 -5.309 1.00 . A A . 84 VAL CB 1 1 9 16276 1 1 84 VAL CG1 C -1.264 -12.288 -6.083 1.00 . A A . 84 VAL CG1 1 1 9 16277 1 1 84 VAL CG2 C -1.420 -9.775 -6.233 1.00 . A A . 84 VAL CG2 1 1 9 16278 1 1 84 VAL H H -2.205 -9.279 -3.688 1.00 . A A . 84 VAL H 1 1 9 16279 1 1 84 VAL HA H -3.651 -10.961 -5.350 1.00 . A A . 84 VAL HA 1 1 9 16280 1 1 84 VAL HB H -0.738 -10.898 -4.551 1.00 . A A . 84 VAL HB 1 1 9 16281 1 1 84 VAL HG11 H -1.509 -13.141 -5.451 1.00 . A A . 84 VAL HG11 1 1 9 16282 1 1 84 VAL HG12 H -1.889 -12.306 -6.975 1.00 . A A . 84 VAL HG12 1 1 9 16283 1 1 84 VAL HG13 H -0.214 -12.340 -6.373 1.00 . A A . 84 VAL HG13 1 1 9 16284 1 1 84 VAL HG21 H -2.316 -9.163 -6.120 1.00 . A A . 84 VAL HG21 1 1 9 16285 1 1 84 VAL HG22 H -0.542 -9.186 -5.968 1.00 . A A . 84 VAL HG22 1 1 9 16286 1 1 84 VAL HG23 H -1.336 -10.110 -7.266 1.00 . A A . 84 VAL HG23 1 1 9 16287 1 1 84 VAL N N -3.000 -9.886 -3.714 1.00 . A A . 84 VAL N 1 1 9 16288 1 1 84 VAL O O -3.677 -13.272 -4.280 1.00 . A A . 84 VAL O 1 1 9 16289 1 1 85 GLU C C -4.127 -13.549 -1.143 1.00 . A A . 85 GLU C 1 1 9 16290 1 1 85 GLU CA C -2.699 -13.448 -1.684 1.00 . A A . 85 GLU CA 1 1 9 16291 1 1 85 GLU CB C -1.683 -13.378 -0.543 1.00 . A A . 85 GLU CB 1 1 9 16292 1 1 85 GLU CD C -0.313 -15.358 0.207 1.00 . A A . 85 GLU CD 1 1 9 16293 1 1 85 GLU CG C -0.463 -14.252 -0.840 1.00 . A A . 85 GLU CG 1 1 9 16294 1 1 85 GLU H H -2.088 -11.516 -2.171 1.00 . A A . 85 GLU H 1 1 9 16295 1 1 85 GLU HA H -2.477 -14.314 -2.307 1.00 . A A . 85 GLU HA 1 1 9 16296 1 1 85 GLU HB2 H -1.368 -12.345 -0.394 1.00 . A A . 85 GLU HB2 1 1 9 16297 1 1 85 GLU HB3 H -2.152 -13.705 0.386 1.00 . A A . 85 GLU HB3 1 1 9 16298 1 1 85 GLU HG2 H -0.562 -14.695 -1.831 1.00 . A A . 85 GLU HG2 1 1 9 16299 1 1 85 GLU HG3 H 0.435 -13.635 -0.854 1.00 . A A . 85 GLU HG3 1 1 9 16300 1 1 85 GLU N N -2.574 -12.297 -2.563 1.00 . A A . 85 GLU N 1 1 9 16301 1 1 85 GLU O O -4.640 -14.648 -0.938 1.00 . A A . 85 GLU O 1 1 9 16302 1 1 85 GLU OE1 O -0.302 -15.006 1.406 1.00 . A A . 85 GLU OE1 1 1 9 16303 1 1 85 GLU OE2 O -0.212 -16.530 -0.216 1.00 . A A . 85 GLU OE2 1 1 9 16304 1 1 86 VAL C C -7.062 -12.736 -1.519 1.00 . A A . 86 VAL C 1 1 9 16305 1 1 86 VAL CA C -6.085 -12.333 -0.413 1.00 . A A . 86 VAL CA 1 1 9 16306 1 1 86 VAL CB C -6.371 -10.943 0.160 1.00 . A A . 86 VAL CB 1 1 9 16307 1 1 86 VAL CG1 C -7.808 -10.849 0.679 1.00 . A A . 86 VAL CG1 1 1 9 16308 1 1 86 VAL CG2 C -5.368 -10.585 1.258 1.00 . A A . 86 VAL CG2 1 1 9 16309 1 1 86 VAL H H -4.303 -11.499 -1.096 1.00 . A A . 86 VAL H 1 1 9 16310 1 1 86 VAL HA H -6.159 -13.054 0.400 1.00 . A A . 86 VAL HA 1 1 9 16311 1 1 86 VAL HB H -6.258 -10.218 -0.646 1.00 . A A . 86 VAL HB 1 1 9 16312 1 1 86 VAL HG11 H -8.451 -11.500 0.087 1.00 . A A . 86 VAL HG11 1 1 9 16313 1 1 86 VAL HG12 H -7.838 -11.159 1.723 1.00 . A A . 86 VAL HG12 1 1 9 16314 1 1 86 VAL HG13 H -8.158 -9.820 0.595 1.00 . A A . 86 VAL HG13 1 1 9 16315 1 1 86 VAL HG21 H -4.421 -11.089 1.063 1.00 . A A . 86 VAL HG21 1 1 9 16316 1 1 86 VAL HG22 H -5.209 -9.507 1.268 1.00 . A A . 86 VAL HG22 1 1 9 16317 1 1 86 VAL HG23 H -5.757 -10.904 2.225 1.00 . A A . 86 VAL HG23 1 1 9 16318 1 1 86 VAL N N -4.727 -12.388 -0.927 1.00 . A A . 86 VAL N 1 1 9 16319 1 1 86 VAL O O -7.878 -13.637 -1.334 1.00 . A A . 86 VAL O 1 1 9 16320 1 1 87 ALA C C -7.522 -13.732 -4.306 1.00 . A A . 87 ALA C 1 1 9 16321 1 1 87 ALA CA C -7.808 -12.323 -3.783 1.00 . A A . 87 ALA CA 1 1 9 16322 1 1 87 ALA CB C -7.600 -11.250 -4.853 1.00 . A A . 87 ALA CB 1 1 9 16323 1 1 87 ALA H H -6.279 -11.317 -2.789 1.00 . A A . 87 ALA H 1 1 9 16324 1 1 87 ALA HA H -8.840 -12.277 -3.435 1.00 . A A . 87 ALA HA 1 1 9 16325 1 1 87 ALA HB1 H -6.838 -10.546 -4.519 1.00 . A A . 87 ALA HB1 1 1 9 16326 1 1 87 ALA HB2 H -7.277 -11.721 -5.782 1.00 . A A . 87 ALA HB2 1 1 9 16327 1 1 87 ALA HB3 H -8.537 -10.719 -5.022 1.00 . A A . 87 ALA HB3 1 1 9 16328 1 1 87 ALA N N -6.946 -12.049 -2.646 1.00 . A A . 87 ALA N 1 1 9 16329 1 1 87 ALA O O -8.435 -14.438 -4.731 1.00 . A A . 87 ALA O 1 1 9 16330 1 1 88 GLY C C -6.166 -15.601 -6.203 1.00 . A A . 88 GLY C 1 1 9 16331 1 1 88 GLY CA C -5.832 -15.411 -4.722 1.00 . A A . 88 GLY CA 1 1 9 16332 1 1 88 GLY H H -5.513 -13.519 -3.911 1.00 . A A . 88 GLY H 1 1 9 16333 1 1 88 GLY HA2 H -4.759 -15.530 -4.570 1.00 . A A . 88 GLY HA2 1 1 9 16334 1 1 88 GLY HA3 H -6.325 -16.184 -4.132 1.00 . A A . 88 GLY HA3 1 1 9 16335 1 1 88 GLY N N -6.250 -14.100 -4.258 1.00 . A A . 88 GLY N 1 1 9 16336 1 1 88 GLY O O -5.537 -14.993 -7.068 1.00 . A A . 88 GLY O 1 1 9 16337 1 1 89 ALA C C -8.999 -16.190 -8.017 1.00 . A A . 89 ALA C 1 1 9 16338 1 1 89 ALA CA C -7.580 -16.725 -7.811 1.00 . A A . 89 ALA CA 1 1 9 16339 1 1 89 ALA CB C -7.479 -18.228 -8.081 1.00 . A A . 89 ALA CB 1 1 9 16340 1 1 89 ALA H H -7.661 -16.938 -5.741 1.00 . A A . 89 ALA H 1 1 9 16341 1 1 89 ALA HA H -6.902 -16.201 -8.484 1.00 . A A . 89 ALA HA 1 1 9 16342 1 1 89 ALA HB1 H -6.526 -18.601 -7.706 1.00 . A A . 89 ALA HB1 1 1 9 16343 1 1 89 ALA HB2 H -8.295 -18.744 -7.576 1.00 . A A . 89 ALA HB2 1 1 9 16344 1 1 89 ALA HB3 H -7.543 -18.409 -9.154 1.00 . A A . 89 ALA HB3 1 1 9 16345 1 1 89 ALA N N -7.155 -16.448 -6.450 1.00 . A A . 89 ALA N 1 1 9 16346 1 1 89 ALA O O -9.680 -16.576 -8.966 1.00 . A A . 89 ALA O 1 1 9 16347 1 1 90 ASP C C -10.657 -13.415 -7.983 1.00 . A A . 90 ASP C 1 1 9 16348 1 1 90 ASP CA C -10.727 -14.718 -7.184 1.00 . A A . 90 ASP CA 1 1 9 16349 1 1 90 ASP CB C -11.257 -14.387 -5.787 1.00 . A A . 90 ASP CB 1 1 9 16350 1 1 90 ASP CG C -12.750 -14.056 -5.724 1.00 . A A . 90 ASP CG 1 1 9 16351 1 1 90 ASP H H -8.841 -15.000 -6.345 1.00 . A A . 90 ASP H 1 1 9 16352 1 1 90 ASP HA H -11.351 -15.470 -7.666 1.00 . A A . 90 ASP HA 1 1 9 16353 1 1 90 ASP HB2 H -11.061 -15.235 -5.130 1.00 . A A . 90 ASP HB2 1 1 9 16354 1 1 90 ASP HB3 H -10.696 -13.541 -5.392 1.00 . A A . 90 ASP HB3 1 1 9 16355 1 1 90 ASP N N -9.401 -15.309 -7.113 1.00 . A A . 90 ASP N 1 1 9 16356 1 1 90 ASP O O -10.537 -12.335 -7.407 1.00 . A A . 90 ASP O 1 1 9 16357 1 1 90 ASP OD1 O -13.095 -12.916 -6.105 1.00 . A A . 90 ASP OD1 1 1 9 16358 1 1 90 ASP OD2 O -13.512 -14.950 -5.297 1.00 . A A . 90 ASP OD2 1 1 9 16359 1 1 91 ALA C C -11.637 -11.330 -9.667 1.00 . A A . 91 ALA C 1 1 9 16360 1 1 91 ALA CA C -10.682 -12.409 -10.182 1.00 . A A . 91 ALA CA 1 1 9 16361 1 1 91 ALA CB C -11.013 -12.846 -11.611 1.00 . A A . 91 ALA CB 1 1 9 16362 1 1 91 ALA H H -10.833 -14.443 -9.758 1.00 . A A . 91 ALA H 1 1 9 16363 1 1 91 ALA HA H -9.663 -12.021 -10.161 1.00 . A A . 91 ALA HA 1 1 9 16364 1 1 91 ALA HB1 H -11.902 -13.476 -11.601 1.00 . A A . 91 ALA HB1 1 1 9 16365 1 1 91 ALA HB2 H -11.199 -11.966 -12.226 1.00 . A A . 91 ALA HB2 1 1 9 16366 1 1 91 ALA HB3 H -10.174 -13.407 -12.023 1.00 . A A . 91 ALA HB3 1 1 9 16367 1 1 91 ALA N N -10.735 -13.560 -9.298 1.00 . A A . 91 ALA N 1 1 9 16368 1 1 91 ALA O O -11.259 -10.166 -9.549 1.00 . A A . 91 ALA O 1 1 9 16369 1 1 92 ALA C C -13.254 -9.948 -7.794 1.00 . A A . 92 ALA C 1 1 9 16370 1 1 92 ALA CA C -13.869 -10.842 -8.873 1.00 . A A . 92 ALA CA 1 1 9 16371 1 1 92 ALA CB C -15.067 -11.640 -8.355 1.00 . A A . 92 ALA CB 1 1 9 16372 1 1 92 ALA H H -13.156 -12.705 -9.471 1.00 . A A . 92 ALA H 1 1 9 16373 1 1 92 ALA HA H -14.194 -10.220 -9.706 1.00 . A A . 92 ALA HA 1 1 9 16374 1 1 92 ALA HB1 H -14.776 -12.680 -8.212 1.00 . A A . 92 ALA HB1 1 1 9 16375 1 1 92 ALA HB2 H -15.400 -11.221 -7.405 1.00 . A A . 92 ALA HB2 1 1 9 16376 1 1 92 ALA HB3 H -15.879 -11.586 -9.080 1.00 . A A . 92 ALA HB3 1 1 9 16377 1 1 92 ALA N N -12.856 -11.757 -9.373 1.00 . A A . 92 ALA N 1 1 9 16378 1 1 92 ALA O O -13.703 -8.822 -7.585 1.00 . A A . 92 ALA O 1 1 9 16379 1 1 93 LYS C C -10.233 -9.198 -6.625 1.00 . A A . 93 LYS C 1 1 9 16380 1 1 93 LYS CA C -11.554 -9.748 -6.085 1.00 . A A . 93 LYS CA 1 1 9 16381 1 1 93 LYS CB C -11.393 -10.622 -4.839 1.00 . A A . 93 LYS CB 1 1 9 16382 1 1 93 LYS CD C -12.752 -10.224 -2.752 1.00 . A A . 93 LYS CD 1 1 9 16383 1 1 93 LYS CE C -14.181 -10.093 -2.221 1.00 . A A . 93 LYS CE 1 1 9 16384 1 1 93 LYS CG C -12.740 -10.847 -4.149 1.00 . A A . 93 LYS CG 1 1 9 16385 1 1 93 LYS H H -11.876 -11.399 -7.313 1.00 . A A . 93 LYS H 1 1 9 16386 1 1 93 LYS HA H -12.191 -8.908 -5.808 1.00 . A A . 93 LYS HA 1 1 9 16387 1 1 93 LYS HB2 H -10.958 -11.581 -5.117 1.00 . A A . 93 LYS HB2 1 1 9 16388 1 1 93 LYS HB3 H -10.700 -10.147 -4.145 1.00 . A A . 93 LYS HB3 1 1 9 16389 1 1 93 LYS HD2 H -12.162 -10.838 -2.071 1.00 . A A . 93 LYS HD2 1 1 9 16390 1 1 93 LYS HD3 H -12.280 -9.241 -2.784 1.00 . A A . 93 LYS HD3 1 1 9 16391 1 1 93 LYS HE2 H -14.247 -9.243 -1.543 1.00 . A A . 93 LYS HE2 1 1 9 16392 1 1 93 LYS HE3 H -14.865 -9.896 -3.047 1.00 . A A . 93 LYS HE3 1 1 9 16393 1 1 93 LYS HG2 H -13.538 -10.413 -4.751 1.00 . A A . 93 LYS HG2 1 1 9 16394 1 1 93 LYS HG3 H -12.941 -11.916 -4.076 1.00 . A A . 93 LYS HG3 1 1 9 16395 1 1 93 LYS HZ1 H -14.100 -11.442 -0.635 1.00 . A A . 93 LYS HZ1 1 1 9 16396 1 1 93 LYS HZ2 H -15.579 -11.339 -1.308 1.00 . A A . 93 LYS HZ2 1 1 9 16397 1 1 93 LYS N N -12.235 -10.483 -7.137 1.00 . A A . 93 LYS N 1 1 9 16398 1 1 93 LYS NZ N -14.587 -11.330 -1.517 1.00 . A A . 93 LYS NZ 1 1 9 16399 1 1 93 LYS O O -9.854 -8.069 -6.317 1.00 . A A . 93 LYS O 1 1 9 16400 1 1 94 LYS C C -8.518 -8.449 -8.955 1.00 . A A . 94 LYS C 1 1 9 16401 1 1 94 LYS CA C -8.297 -9.632 -8.009 1.00 . A A . 94 LYS CA 1 1 9 16402 1 1 94 LYS CB C -7.623 -10.833 -8.675 1.00 . A A . 94 LYS CB 1 1 9 16403 1 1 94 LYS CD C -7.240 -12.005 -10.874 1.00 . A A . 94 LYS CD 1 1 9 16404 1 1 94 LYS CE C -6.129 -11.791 -11.905 1.00 . A A . 94 LYS CE 1 1 9 16405 1 1 94 LYS CG C -7.621 -10.687 -10.198 1.00 . A A . 94 LYS CG 1 1 9 16406 1 1 94 LYS H H -9.884 -10.938 -7.669 1.00 . A A . 94 LYS H 1 1 9 16407 1 1 94 LYS HA H -7.648 -9.307 -7.196 1.00 . A A . 94 LYS HA 1 1 9 16408 1 1 94 LYS HB2 H -6.600 -10.927 -8.313 1.00 . A A . 94 LYS HB2 1 1 9 16409 1 1 94 LYS HB3 H -8.145 -11.748 -8.394 1.00 . A A . 94 LYS HB3 1 1 9 16410 1 1 94 LYS HD2 H -6.909 -12.722 -10.122 1.00 . A A . 94 LYS HD2 1 1 9 16411 1 1 94 LYS HD3 H -8.115 -12.435 -11.361 1.00 . A A . 94 LYS HD3 1 1 9 16412 1 1 94 LYS HE2 H -5.916 -12.729 -12.419 1.00 . A A . 94 LYS HE2 1 1 9 16413 1 1 94 LYS HE3 H -6.460 -11.081 -12.663 1.00 . A A . 94 LYS HE3 1 1 9 16414 1 1 94 LYS HG2 H -8.607 -10.371 -10.538 1.00 . A A . 94 LYS HG2 1 1 9 16415 1 1 94 LYS HG3 H -6.918 -9.907 -10.490 1.00 . A A . 94 LYS HG3 1 1 9 16416 1 1 94 LYS HZ1 H -5.020 -10.346 -10.893 1.00 . A A . 94 LYS HZ1 1 1 9 16417 1 1 94 LYS HZ2 H -4.628 -11.866 -10.461 1.00 . A A . 94 LYS HZ2 1 1 9 16418 1 1 94 LYS N N -9.568 -10.021 -7.423 1.00 . A A . 94 LYS N 1 1 9 16419 1 1 94 LYS NZ N -4.902 -11.288 -11.248 1.00 . A A . 94 LYS NZ 1 1 9 16420 1 1 94 LYS O O -7.559 -7.841 -9.428 1.00 . A A . 94 LYS O 1 1 9 16421 1 1 95 LYS C C -10.546 -5.847 -9.240 1.00 . A A . 95 LYS C 1 1 9 16422 1 1 95 LYS CA C -10.145 -7.060 -10.082 1.00 . A A . 95 LYS CA 1 1 9 16423 1 1 95 LYS CB C -11.221 -7.500 -11.077 1.00 . A A . 95 LYS CB 1 1 9 16424 1 1 95 LYS CD C -11.637 -7.823 -13.544 1.00 . A A . 95 LYS CD 1 1 9 16425 1 1 95 LYS CE C -10.646 -8.510 -14.486 1.00 . A A . 95 LYS CE 1 1 9 16426 1 1 95 LYS CG C -10.904 -6.995 -12.486 1.00 . A A . 95 LYS CG 1 1 9 16427 1 1 95 LYS H H -10.561 -8.658 -8.812 1.00 . A A . 95 LYS H 1 1 9 16428 1 1 95 LYS HA H -9.258 -6.801 -10.660 1.00 . A A . 95 LYS HA 1 1 9 16429 1 1 95 LYS HB2 H -11.292 -8.588 -11.085 1.00 . A A . 95 LYS HB2 1 1 9 16430 1 1 95 LYS HB3 H -12.192 -7.120 -10.761 1.00 . A A . 95 LYS HB3 1 1 9 16431 1 1 95 LYS HD2 H -12.260 -8.572 -13.056 1.00 . A A . 95 LYS HD2 1 1 9 16432 1 1 95 LYS HD3 H -12.303 -7.179 -14.118 1.00 . A A . 95 LYS HD3 1 1 9 16433 1 1 95 LYS HE2 H -10.695 -8.051 -15.473 1.00 . A A . 95 LYS HE2 1 1 9 16434 1 1 95 LYS HE3 H -9.629 -8.370 -14.119 1.00 . A A . 95 LYS HE3 1 1 9 16435 1 1 95 LYS HG2 H -11.193 -5.947 -12.575 1.00 . A A . 95 LYS HG2 1 1 9 16436 1 1 95 LYS HG3 H -9.829 -7.044 -12.661 1.00 . A A . 95 LYS HG3 1 1 9 16437 1 1 95 LYS HZ1 H -10.321 -10.429 -15.232 1.00 . A A . 95 LYS HZ1 1 1 9 16438 1 1 95 LYS HZ2 H -10.861 -10.426 -13.695 1.00 . A A . 95 LYS HZ2 1 1 9 16439 1 1 95 LYS N N -9.787 -8.158 -9.201 1.00 . A A . 95 LYS N 1 1 9 16440 1 1 95 LYS NZ N -10.947 -9.955 -14.589 1.00 . A A . 95 LYS NZ 1 1 9 16441 1 1 95 LYS O O -10.546 -4.719 -9.731 1.00 . A A . 95 LYS O 1 1 9 16442 1 1 96 ASP C C -10.235 -4.931 -5.964 1.00 . A A . 96 ASP C 1 1 9 16443 1 1 96 ASP CA C -11.281 -5.065 -7.072 1.00 . A A . 96 ASP CA 1 1 9 16444 1 1 96 ASP CB C -12.625 -5.387 -6.418 1.00 . A A . 96 ASP CB 1 1 9 16445 1 1 96 ASP CG C -13.804 -4.548 -6.916 1.00 . A A . 96 ASP CG 1 1 9 16446 1 1 96 ASP H H -10.875 -7.040 -7.596 1.00 . A A . 96 ASP H 1 1 9 16447 1 1 96 ASP HA H -11.355 -4.167 -7.686 1.00 . A A . 96 ASP HA 1 1 9 16448 1 1 96 ASP HB2 H -12.851 -6.440 -6.586 1.00 . A A . 96 ASP HB2 1 1 9 16449 1 1 96 ASP HB3 H -12.530 -5.249 -5.341 1.00 . A A . 96 ASP HB3 1 1 9 16450 1 1 96 ASP N N -10.878 -6.120 -7.987 1.00 . A A . 96 ASP N 1 1 9 16451 1 1 96 ASP O O -10.386 -4.112 -5.058 1.00 . A A . 96 ASP O 1 1 9 16452 1 1 96 ASP OD1 O -13.961 -4.468 -8.153 1.00 . A A . 96 ASP OD1 1 1 9 16453 1 1 96 ASP OD2 O -14.522 -4.007 -6.048 1.00 . A A . 96 ASP OD2 1 1 9 16454 1 1 97 LEU C C -6.797 -5.464 -5.793 1.00 . A A . 97 LEU C 1 1 9 16455 1 1 97 LEU CA C -8.127 -5.732 -5.088 1.00 . A A . 97 LEU CA 1 1 9 16456 1 1 97 LEU CB C -8.137 -7.021 -4.263 1.00 . A A . 97 LEU CB 1 1 9 16457 1 1 97 LEU CD1 C -8.959 -8.268 -2.231 1.00 . A A . 97 LEU CD1 1 1 9 16458 1 1 97 LEU CD2 C -9.510 -5.810 -2.529 1.00 . A A . 97 LEU CD2 1 1 9 16459 1 1 97 LEU CG C -9.257 -7.147 -3.228 1.00 . A A . 97 LEU CG 1 1 9 16460 1 1 97 LEU H H -9.082 -6.412 -6.810 1.00 . A A . 97 LEU H 1 1 9 16461 1 1 97 LEU HA H -8.327 -4.909 -4.402 1.00 . A A . 97 LEU HA 1 1 9 16462 1 1 97 LEU HB2 H -8.205 -7.866 -4.948 1.00 . A A . 97 LEU HB2 1 1 9 16463 1 1 97 LEU HB3 H -7.181 -7.105 -3.747 1.00 . A A . 97 LEU HB3 1 1 9 16464 1 1 97 LEU HD11 H -8.679 -9.171 -2.773 1.00 . A A . 97 LEU HD11 1 1 9 16465 1 1 97 LEU HD12 H -8.139 -7.966 -1.579 1.00 . A A . 97 LEU HD12 1 1 9 16466 1 1 97 LEU HD13 H -9.847 -8.466 -1.631 1.00 . A A . 97 LEU HD13 1 1 9 16467 1 1 97 LEU HD21 H -8.556 -5.350 -2.267 1.00 . A A . 97 LEU HD21 1 1 9 16468 1 1 97 LEU HD22 H -10.061 -5.148 -3.197 1.00 . A A . 97 LEU HD22 1 1 9 16469 1 1 97 LEU HD23 H -10.092 -5.978 -1.623 1.00 . A A . 97 LEU HD23 1 1 9 16470 1 1 97 LEU HG H -10.176 -7.415 -3.750 1.00 . A A . 97 LEU HG 1 1 9 16471 1 1 97 LEU N N -9.198 -5.748 -6.070 1.00 . A A . 97 LEU N 1 1 9 16472 1 1 97 LEU O O -6.056 -4.561 -5.407 1.00 . A A . 97 LEU O 1 1 9 16473 1 1 98 THR C C -5.605 -5.581 -8.978 1.00 . A A . 98 THR C 1 1 9 16474 1 1 98 THR CA C -5.305 -6.124 -7.579 1.00 . A A . 98 THR CA 1 1 9 16475 1 1 98 THR CB C -4.601 -7.482 -7.593 1.00 . A A . 98 THR CB 1 1 9 16476 1 1 98 THR CG2 C -4.702 -8.208 -6.251 1.00 . A A . 98 THR CG2 1 1 9 16477 1 1 98 THR H H -7.142 -6.995 -7.125 1.00 . A A . 98 THR H 1 1 9 16478 1 1 98 THR HA H -4.672 -5.391 -7.080 1.00 . A A . 98 THR HA 1 1 9 16479 1 1 98 THR HB H -3.561 -7.378 -7.902 1.00 . A A . 98 THR HB 1 1 9 16480 1 1 98 THR HG1 H -4.835 -9.009 -8.866 1.00 . A A . 98 THR HG1 1 1 9 16481 1 1 98 THR HG21 H -5.746 -8.261 -5.944 1.00 . A A . 98 THR HG21 1 1 9 16482 1 1 98 THR HG22 H -4.301 -9.217 -6.352 1.00 . A A . 98 THR HG22 1 1 9 16483 1 1 98 THR HG23 H -4.129 -7.664 -5.499 1.00 . A A . 98 THR HG23 1 1 9 16484 1 1 98 THR N N -6.534 -6.264 -6.816 1.00 . A A . 98 THR N 1 1 9 16485 1 1 98 THR O O -4.733 -5.575 -9.845 1.00 . A A . 98 THR O 1 1 9 16486 1 1 98 THR OG1 O -5.390 -8.274 -8.476 1.00 . A A . 98 THR OG1 1 1 9 16487 1 1 99 GLY C C -6.490 -3.319 -10.771 1.00 . A A . 99 GLY C 1 1 9 16488 1 1 99 GLY CA C -7.267 -4.593 -10.431 1.00 . A A . 99 GLY CA 1 1 9 16489 1 1 99 GLY H H -7.544 -5.145 -8.442 1.00 . A A . 99 GLY H 1 1 9 16490 1 1 99 GLY HA2 H -7.116 -5.335 -11.215 1.00 . A A . 99 GLY HA2 1 1 9 16491 1 1 99 GLY HA3 H -8.334 -4.375 -10.400 1.00 . A A . 99 GLY HA3 1 1 9 16492 1 1 99 GLY N N -6.841 -5.137 -9.153 1.00 . A A . 99 GLY N 1 1 9 16493 1 1 99 GLY O O -6.113 -2.561 -9.879 1.00 . A A . 99 GLY O 1 1 9 16494 1 1 100 CYS C C -6.534 -0.790 -12.644 1.00 . A A . 100 CYS C 1 1 9 16495 1 1 100 CYS CA C -5.548 -1.955 -12.532 1.00 . A A . 100 CYS CA 1 1 9 16496 1 1 100 CYS CB C -4.833 -2.227 -13.858 1.00 . A A . 100 CYS CB 1 1 9 16497 1 1 100 CYS H H -6.584 -3.745 -12.783 1.00 . A A . 100 CYS H 1 1 9 16498 1 1 100 CYS HA H -4.781 -1.743 -11.787 1.00 . A A . 100 CYS HA 1 1 9 16499 1 1 100 CYS HB2 H -5.478 -2.846 -14.481 1.00 . A A . 100 CYS HB2 1 1 9 16500 1 1 100 CYS HB3 H -4.697 -1.281 -14.381 1.00 . A A . 100 CYS HB3 1 1 9 16501 1 1 100 CYS N N -6.273 -3.123 -12.064 1.00 . A A . 100 CYS N 1 1 9 16502 1 1 100 CYS O O -6.198 0.345 -12.310 1.00 . A A . 100 CYS O 1 1 9 16503 1 1 100 CYS SG S -3.206 -3.048 -13.698 1.00 . A A . 100 CYS SG 1 1 9 16504 1 1 101 LYS C C -10.098 -0.668 -12.769 1.00 . A A . 101 LYS C 1 1 9 16505 1 1 101 LYS CA C -8.767 -0.106 -13.273 1.00 . A A . 101 LYS CA 1 1 9 16506 1 1 101 LYS CB C -8.816 0.387 -14.721 1.00 . A A . 101 LYS CB 1 1 9 16507 1 1 101 LYS CD C -9.374 2.322 -16.239 1.00 . A A . 101 LYS CD 1 1 9 16508 1 1 101 LYS CE C -10.572 1.702 -16.961 1.00 . A A . 101 LYS CE 1 1 9 16509 1 1 101 LYS CG C -9.298 1.837 -14.790 1.00 . A A . 101 LYS CG 1 1 9 16510 1 1 101 LYS H H -7.995 -2.038 -13.382 1.00 . A A . 101 LYS H 1 1 9 16511 1 1 101 LYS HA H -8.493 0.746 -12.651 1.00 . A A . 101 LYS HA 1 1 9 16512 1 1 101 LYS HB2 H -7.826 0.307 -15.170 1.00 . A A . 101 LYS HB2 1 1 9 16513 1 1 101 LYS HB3 H -9.482 -0.250 -15.303 1.00 . A A . 101 LYS HB3 1 1 9 16514 1 1 101 LYS HD2 H -9.455 3.408 -16.259 1.00 . A A . 101 LYS HD2 1 1 9 16515 1 1 101 LYS HD3 H -8.455 2.060 -16.762 1.00 . A A . 101 LYS HD3 1 1 9 16516 1 1 101 LYS HE2 H -10.656 0.647 -16.702 1.00 . A A . 101 LYS HE2 1 1 9 16517 1 1 101 LYS HE3 H -11.492 2.185 -16.632 1.00 . A A . 101 LYS HE3 1 1 9 16518 1 1 101 LYS HG2 H -10.280 1.921 -14.322 1.00 . A A . 101 LYS HG2 1 1 9 16519 1 1 101 LYS HG3 H -8.621 2.477 -14.224 1.00 . A A . 101 LYS HG3 1 1 9 16520 1 1 101 LYS HZ1 H -10.893 2.679 -18.774 1.00 . A A . 101 LYS HZ1 1 1 9 16521 1 1 101 LYS HZ2 H -9.454 1.920 -18.706 1.00 . A A . 101 LYS HZ2 1 1 9 16522 1 1 101 LYS N N -7.730 -1.112 -13.113 1.00 . A A . 101 LYS N 1 1 9 16523 1 1 101 LYS NZ N -10.426 1.849 -18.427 1.00 . A A . 101 LYS NZ 1 1 9 16524 1 1 101 LYS O O -10.337 -1.872 -12.846 1.00 . A A . 101 LYS O 1 1 9 16525 1 1 102 LYS C C -12.038 -1.077 -10.538 1.00 . A A . 102 LYS C 1 1 9 16526 1 1 102 LYS CA C -12.230 -0.159 -11.747 1.00 . A A . 102 LYS CA 1 1 9 16527 1 1 102 LYS CB C -13.085 -0.773 -12.856 1.00 . A A . 102 LYS CB 1 1 9 16528 1 1 102 LYS CD C -14.954 0.571 -13.887 1.00 . A A . 102 LYS CD 1 1 9 16529 1 1 102 LYS CE C -15.939 1.645 -13.422 1.00 . A A . 102 LYS CE 1 1 9 16530 1 1 102 LYS CG C -14.546 -0.339 -12.726 1.00 . A A . 102 LYS CG 1 1 9 16531 1 1 102 LYS H H -10.727 1.209 -12.205 1.00 . A A . 102 LYS H 1 1 9 16532 1 1 102 LYS HA H -12.735 0.748 -11.415 1.00 . A A . 102 LYS HA 1 1 9 16533 1 1 102 LYS HB2 H -12.698 -0.471 -13.829 1.00 . A A . 102 LYS HB2 1 1 9 16534 1 1 102 LYS HB3 H -13.019 -1.860 -12.811 1.00 . A A . 102 LYS HB3 1 1 9 16535 1 1 102 LYS HD2 H -14.068 1.044 -14.311 1.00 . A A . 102 LYS HD2 1 1 9 16536 1 1 102 LYS HD3 H -15.407 -0.025 -14.679 1.00 . A A . 102 LYS HD3 1 1 9 16537 1 1 102 LYS HE2 H -15.814 1.823 -12.354 1.00 . A A . 102 LYS HE2 1 1 9 16538 1 1 102 LYS HE3 H -15.727 2.586 -13.929 1.00 . A A . 102 LYS HE3 1 1 9 16539 1 1 102 LYS HG2 H -15.190 -1.219 -12.706 1.00 . A A . 102 LYS HG2 1 1 9 16540 1 1 102 LYS HG3 H -14.691 0.184 -11.781 1.00 . A A . 102 LYS HG3 1 1 9 16541 1 1 102 LYS HZ1 H -17.838 1.926 -14.232 1.00 . A A . 102 LYS HZ1 1 1 9 16542 1 1 102 LYS HZ2 H -17.369 0.367 -14.237 1.00 . A A . 102 LYS HZ2 1 1 9 16543 1 1 102 LYS N N -10.929 0.232 -12.264 1.00 . A A . 102 LYS N 1 1 9 16544 1 1 102 LYS NZ N -17.331 1.227 -13.701 1.00 . A A . 102 LYS NZ 1 1 9 16545 1 1 102 LYS O O -12.795 -2.029 -10.351 1.00 . A A . 102 LYS O 1 1 9 16546 1 1 103 SER C C -11.002 -0.720 -7.305 1.00 . A A . 103 SER C 1 1 9 16547 1 1 103 SER CA C -10.722 -1.544 -8.563 1.00 . A A . 103 SER CA 1 1 9 16548 1 1 103 SER CB C -9.269 -2.022 -8.573 1.00 . A A . 103 SER CB 1 1 9 16549 1 1 103 SER H H -10.412 0.017 -9.907 1.00 . A A . 103 SER H 1 1 9 16550 1 1 103 SER HA H -11.387 -2.406 -8.612 1.00 . A A . 103 SER HA 1 1 9 16551 1 1 103 SER HB2 H -8.871 -1.992 -7.558 1.00 . A A . 103 SER HB2 1 1 9 16552 1 1 103 SER HB3 H -9.230 -3.060 -8.899 1.00 . A A . 103 SER HB3 1 1 9 16553 1 1 103 SER HG H -8.471 -0.272 -9.127 1.00 . A A . 103 SER HG 1 1 9 16554 1 1 103 SER N N -11.023 -0.759 -9.748 1.00 . A A . 103 SER N 1 1 9 16555 1 1 103 SER O O -11.547 0.380 -7.387 1.00 . A A . 103 SER O 1 1 9 16556 1 1 103 SER OG O -8.451 -1.226 -9.426 1.00 . A A . 103 SER OG 1 1 9 16557 1 1 104 LYS C C -9.807 0.523 -4.754 1.00 . A A . 104 LYS C 1 1 9 16558 1 1 104 LYS CA C -10.820 -0.615 -4.896 1.00 . A A . 104 LYS CA 1 1 9 16559 1 1 104 LYS CB C -10.775 -1.624 -3.747 1.00 . A A . 104 LYS CB 1 1 9 16560 1 1 104 LYS CD C -13.134 -1.542 -2.858 1.00 . A A . 104 LYS CD 1 1 9 16561 1 1 104 LYS CE C -14.512 -1.637 -3.515 1.00 . A A . 104 LYS CE 1 1 9 16562 1 1 104 LYS CG C -12.103 -2.374 -3.624 1.00 . A A . 104 LYS CG 1 1 9 16563 1 1 104 LYS H H -10.175 -2.178 -6.111 1.00 . A A . 104 LYS H 1 1 9 16564 1 1 104 LYS HA H -11.822 -0.185 -4.908 1.00 . A A . 104 LYS HA 1 1 9 16565 1 1 104 LYS HB2 H -9.966 -2.335 -3.914 1.00 . A A . 104 LYS HB2 1 1 9 16566 1 1 104 LYS HB3 H -10.557 -1.108 -2.812 1.00 . A A . 104 LYS HB3 1 1 9 16567 1 1 104 LYS HD2 H -13.194 -1.890 -1.827 1.00 . A A . 104 LYS HD2 1 1 9 16568 1 1 104 LYS HD3 H -12.813 -0.501 -2.825 1.00 . A A . 104 LYS HD3 1 1 9 16569 1 1 104 LYS HE2 H -14.413 -1.546 -4.597 1.00 . A A . 104 LYS HE2 1 1 9 16570 1 1 104 LYS HE3 H -14.950 -2.615 -3.316 1.00 . A A . 104 LYS HE3 1 1 9 16571 1 1 104 LYS HG2 H -12.486 -2.609 -4.617 1.00 . A A . 104 LYS HG2 1 1 9 16572 1 1 104 LYS HG3 H -11.943 -3.323 -3.111 1.00 . A A . 104 LYS HG3 1 1 9 16573 1 1 104 LYS HZ1 H -15.667 0.085 -3.727 1.00 . A A . 104 LYS HZ1 1 1 9 16574 1 1 104 LYS HZ2 H -16.266 -0.951 -2.623 1.00 . A A . 104 LYS HZ2 1 1 9 16575 1 1 104 LYS N N -10.617 -1.283 -6.169 1.00 . A A . 104 LYS N 1 1 9 16576 1 1 104 LYS NZ N -15.405 -0.573 -3.002 1.00 . A A . 104 LYS NZ 1 1 9 16577 1 1 104 LYS O O -10.074 1.517 -4.081 1.00 . A A . 104 LYS O 1 1 9 16578 1 1 105 CYS C C -7.832 2.323 -6.504 1.00 . A A . 105 CYS C 1 1 9 16579 1 1 105 CYS CA C -7.610 1.337 -5.355 1.00 . A A . 105 CYS CA 1 1 9 16580 1 1 105 CYS CB C -6.222 0.696 -5.413 1.00 . A A . 105 CYS CB 1 1 9 16581 1 1 105 CYS H H -8.456 -0.473 -5.946 1.00 . A A . 105 CYS H 1 1 9 16582 1 1 105 CYS HA H -7.696 1.840 -4.392 1.00 . A A . 105 CYS HA 1 1 9 16583 1 1 105 CYS HB2 H -6.004 0.373 -6.430 1.00 . A A . 105 CYS HB2 1 1 9 16584 1 1 105 CYS HB3 H -5.462 1.430 -5.142 1.00 . A A . 105 CYS HB3 1 1 9 16585 1 1 105 CYS N N -8.665 0.339 -5.400 1.00 . A A . 105 CYS N 1 1 9 16586 1 1 105 CYS O O -8.136 3.492 -6.273 1.00 . A A . 105 CYS O 1 1 9 16587 1 1 105 CYS SG S -6.144 -0.733 -4.273 1.00 . A A . 105 CYS SG 1 1 9 16588 1 1 106 HIS C C -9.278 2.478 -9.425 1.00 . A A . 106 HIS C 1 1 9 16589 1 1 106 HIS CA C -7.849 2.635 -8.902 1.00 . A A . 106 HIS CA 1 1 9 16590 1 1 106 HIS CB C -6.792 2.304 -9.957 1.00 . A A . 106 HIS CB 1 1 9 16591 1 1 106 HIS CD2 C -4.311 1.688 -9.409 1.00 . A A . 106 HIS CD2 1 1 9 16592 1 1 106 HIS CE1 C -3.642 3.659 -8.737 1.00 . A A . 106 HIS CE1 1 1 9 16593 1 1 106 HIS CG C -5.372 2.540 -9.499 1.00 . A A . 106 HIS CG 1 1 9 16594 1 1 106 HIS H H -7.423 0.862 -7.896 1.00 . A A . 106 HIS H 1 1 9 16595 1 1 106 HIS HA H -7.697 3.669 -8.592 1.00 . A A . 106 HIS HA 1 1 9 16596 1 1 106 HIS HB2 H -6.899 1.259 -10.249 1.00 . A A . 106 HIS HB2 1 1 9 16597 1 1 106 HIS HB3 H -6.980 2.904 -10.847 1.00 . A A . 106 HIS HB3 1 1 9 16598 1 1 106 HIS HD1 H -5.464 4.612 -9.016 1.00 . A A . 106 HIS HD1 1 1 9 16599 1 1 106 HIS HD2 H -4.320 0.629 -9.670 1.00 . A A . 106 HIS HD2 1 1 9 16600 1 1 106 HIS HE1 H -3.003 4.458 -8.361 1.00 . A A . 106 HIS HE1 1 1 9 16601 1 1 106 HIS N N -7.671 1.814 -7.717 1.00 . A A . 106 HIS N 1 1 9 16602 1 1 106 HIS ND1 N -4.919 3.775 -9.068 1.00 . A A . 106 HIS ND1 1 1 9 16603 1 1 106 HIS NE2 N -3.267 2.365 -8.949 1.00 . A A . 106 HIS NE2 1 1 9 16604 1 1 106 HIS O O -9.868 1.404 -9.316 1.00 . A A . 106 HIS O 1 1 9 16605 1 1 107 GLU C C -11.217 4.443 -11.770 1.00 . A A . 107 GLU C 1 1 9 16606 1 1 107 GLU CA C -11.142 3.560 -10.523 1.00 . A A . 107 GLU CA 1 1 9 16607 1 1 107 GLU CB C -12.156 4.012 -9.469 1.00 . A A . 107 GLU CB 1 1 9 16608 1 1 107 GLU CD C -13.460 3.342 -7.417 1.00 . A A . 107 GLU CD 1 1 9 16609 1 1 107 GLU CG C -12.461 2.884 -8.482 1.00 . A A . 107 GLU CG 1 1 9 16610 1 1 107 GLU H H -9.307 4.433 -10.068 1.00 . A A . 107 GLU H 1 1 9 16611 1 1 107 GLU HA H -11.344 2.523 -10.790 1.00 . A A . 107 GLU HA 1 1 9 16612 1 1 107 GLU HB2 H -11.766 4.876 -8.931 1.00 . A A . 107 GLU HB2 1 1 9 16613 1 1 107 GLU HB3 H -13.076 4.331 -9.958 1.00 . A A . 107 GLU HB3 1 1 9 16614 1 1 107 GLU HG2 H -12.864 2.025 -9.018 1.00 . A A . 107 GLU HG2 1 1 9 16615 1 1 107 GLU HG3 H -11.538 2.556 -8.003 1.00 . A A . 107 GLU HG3 1 1 9 16616 1 1 107 GLU N N -9.793 3.564 -9.983 1.00 . A A . 107 GLU N 1 1 9 16617 1 1 107 GLU O O -11.446 3.947 -12.873 1.00 . A A . 107 GLU O 1 1 9 16618 1 1 107 GLU OXT O -11.037 5.669 -11.609 1.00 . A A . 107 GLU OXT 1 1 9 16619 1 1 107 GLU OE1 O -13.253 4.456 -6.887 1.00 . A A . 107 GLU OE1 1 1 9 16620 1 1 107 GLU OE2 O -14.407 2.569 -7.158 1.00 . A A . 107 GLU OE2 1 1 9 16621 2 2 1 HEC C1A C -1.219 5.444 9.172 1.00 . B A . 108 HEC C1A 1 1 9 16622 2 2 1 HEC C1B C -2.096 2.296 12.000 1.00 . B A . 108 HEC C1B 1 1 9 16623 2 2 1 HEC C1C C -2.255 -0.571 8.723 1.00 . B A . 108 HEC C1C 1 1 9 16624 2 2 1 HEC C1D C -1.148 2.557 5.955 1.00 . B A . 108 HEC C1D 1 1 9 16625 2 2 1 HEC C2A C -1.150 6.520 10.132 1.00 . B A . 108 HEC C2A 1 1 9 16626 2 2 1 HEC C2B C -2.525 1.398 13.046 1.00 . B A . 108 HEC C2B 1 1 9 16627 2 2 1 HEC C2C C -2.299 -1.645 7.758 1.00 . B A . 108 HEC C2C 1 1 9 16628 2 2 1 HEC C2D C -0.744 3.475 4.916 1.00 . B A . 108 HEC C2D 1 1 9 16629 2 2 1 HEC C3A C -1.363 5.980 11.350 1.00 . B A . 108 HEC C3A 1 1 9 16630 2 2 1 HEC C3B C -2.693 0.183 12.482 1.00 . B A . 108 HEC C3B 1 1 9 16631 2 2 1 HEC C3C C -1.967 -1.117 6.561 1.00 . B A . 108 HEC C3C 1 1 9 16632 2 2 1 HEC C3D C -0.663 4.700 5.478 1.00 . B A . 108 HEC C3D 1 1 9 16633 2 2 1 HEC C4A C -1.566 4.563 11.157 1.00 . B A . 108 HEC C4A 1 1 9 16634 2 2 1 HEC C4B C -2.369 0.317 11.081 1.00 . B A . 108 HEC C4B 1 1 9 16635 2 2 1 HEC C4C C -1.715 0.289 6.773 1.00 . B A . 108 HEC C4C 1 1 9 16636 2 2 1 HEC C4D C -1.015 4.552 6.871 1.00 . B A . 108 HEC C4D 1 1 9 16637 2 2 1 HEC CAA C -0.887 7.958 9.792 1.00 . B A . 108 HEC CAA 1 1 9 16638 2 2 1 HEC CAB C -3.130 -1.091 13.144 1.00 . B A . 108 HEC CAB 1 1 9 16639 2 2 1 HEC CAC C -1.867 -1.818 5.238 1.00 . B A . 108 HEC CAC 1 1 9 16640 2 2 1 HEC CAD C -0.283 5.995 4.821 1.00 . B A . 108 HEC CAD 1 1 9 16641 2 2 1 HEC CBA C -0.041 8.696 10.826 1.00 . B A . 108 HEC CBA 1 1 9 16642 2 2 1 HEC CBB C -4.397 -0.951 13.983 1.00 . B A . 108 HEC CBB 1 1 9 16643 2 2 1 HEC CBC C -2.894 -2.930 5.046 1.00 . B A . 108 HEC CBC 1 1 9 16644 2 2 1 HEC CBD C -0.865 6.175 3.422 1.00 . B A . 108 HEC CBD 1 1 9 16645 2 2 1 HEC CGA C -0.906 9.582 11.711 1.00 . B A . 108 HEC CGA 1 1 9 16646 2 2 1 HEC CGD C 0.236 6.375 2.392 1.00 . B A . 108 HEC CGD 1 1 9 16647 2 2 1 HEC CHA C -1.049 5.607 7.801 1.00 . B A . 108 HEC CHA 1 1 9 16648 2 2 1 HEC CHB C -1.819 3.645 12.192 1.00 . B A . 108 HEC CHB 1 1 9 16649 2 2 1 HEC CHC C -2.421 -0.734 10.147 1.00 . B A . 108 HEC CHC 1 1 9 16650 2 2 1 HEC CHD C -1.340 1.193 5.762 1.00 . B A . 108 HEC CHD 1 1 9 16651 2 2 1 HEC CMA C -1.392 6.678 12.679 1.00 . B A . 108 HEC CMA 1 1 9 16652 2 2 1 HEC CMB C -2.733 1.787 14.480 1.00 . B A . 108 HEC CMB 1 1 9 16653 2 2 1 HEC CMC C -2.653 -3.069 8.074 1.00 . B A . 108 HEC CMC 1 1 9 16654 2 2 1 HEC CMD C -0.476 3.093 3.490 1.00 . B A . 108 HEC CMD 1 1 9 16655 2 2 1 HEC FE FE -1.671 2.427 8.967 1.00 . B A . 108 HEC FE 1 1 9 16656 2 2 1 HEC HAA1 H -0.357 8.016 8.842 1.00 . B A . 108 HEC HAA1 1 1 9 16657 2 2 1 HEC HAA2 H -1.834 8.492 9.713 1.00 . B A . 108 HEC HAA2 1 1 9 16658 2 2 1 HEC HAB H -3.329 -1.846 12.384 1.00 . B A . 108 HEC HAB 1 1 9 16659 2 2 1 HEC HAC H -2.018 -1.098 4.433 1.00 . B A . 108 HEC HAC 1 1 9 16660 2 2 1 HEC HAD1 H -0.639 6.828 5.427 1.00 . B A . 108 HEC HAD1 1 1 9 16661 2 2 1 HEC HAD2 H 0.802 6.050 4.728 1.00 . B A . 108 HEC HAD2 1 1 9 16662 2 2 1 HEC HBA1 H 0.476 7.972 11.455 1.00 . B A . 108 HEC HBA1 1 1 9 16663 2 2 1 HEC HBA2 H 0.692 9.322 10.316 1.00 . B A . 108 HEC HBA2 1 1 9 16664 2 2 1 HEC HBB1 H -4.139 -0.567 14.970 1.00 . B A . 108 HEC HBB1 1 1 9 16665 2 2 1 HEC HBB2 H -5.083 -0.262 13.492 1.00 . B A . 108 HEC HBB2 1 1 9 16666 2 2 1 HEC HBB3 H -4.873 -1.926 14.087 1.00 . B A . 108 HEC HBB3 1 1 9 16667 2 2 1 HEC HBC1 H -3.818 -2.664 5.558 1.00 . B A . 108 HEC HBC1 1 1 9 16668 2 2 1 HEC HBC2 H -3.092 -3.062 3.982 1.00 . B A . 108 HEC HBC2 1 1 9 16669 2 2 1 HEC HBC3 H -2.504 -3.860 5.460 1.00 . B A . 108 HEC HBC3 1 1 9 16670 2 2 1 HEC HBD1 H -1.440 5.289 3.151 1.00 . B A . 108 HEC HBD1 1 1 9 16671 2 2 1 HEC HBD2 H -1.517 7.049 3.410 1.00 . B A . 108 HEC HBD2 1 1 9 16672 2 2 1 HEC HHA H -0.934 6.620 7.417 1.00 . B A . 108 HEC HHA 1 1 9 16673 2 2 1 HEC HHB H -1.796 4.022 13.215 1.00 . B A . 108 HEC HHB 1 1 9 16674 2 2 1 HEC HHC H -2.603 -1.738 10.529 1.00 . B A . 108 HEC HHC 1 1 9 16675 2 2 1 HEC HHD H -1.191 0.792 4.759 1.00 . B A . 108 HEC HHD 1 1 9 16676 2 2 1 HEC HMA1 H -1.967 7.600 12.592 1.00 . B A . 108 HEC HMA1 1 1 9 16677 2 2 1 HEC HMA2 H -1.856 6.029 13.421 1.00 . B A . 108 HEC HMA2 1 1 9 16678 2 2 1 HEC HMA3 H -0.374 6.913 12.988 1.00 . B A . 108 HEC HMA3 1 1 9 16679 2 2 1 HEC HMB1 H -2.760 0.891 15.100 1.00 . B A . 108 HEC HMB1 1 1 9 16680 2 2 1 HEC HMB2 H -1.913 2.429 14.805 1.00 . B A . 108 HEC HMB2 1 1 9 16681 2 2 1 HEC HMB3 H -3.676 2.325 14.578 1.00 . B A . 108 HEC HMB3 1 1 9 16682 2 2 1 HEC HMC1 H -3.093 -3.122 9.070 1.00 . B A . 108 HEC HMC1 1 1 9 16683 2 2 1 HEC HMC2 H -3.370 -3.436 7.340 1.00 . B A . 108 HEC HMC2 1 1 9 16684 2 2 1 HEC HMC3 H -1.753 -3.683 8.042 1.00 . B A . 108 HEC HMC3 1 1 9 16685 2 2 1 HEC HMD1 H -1.423 2.949 2.968 1.00 . B A . 108 HEC HMD1 1 1 9 16686 2 2 1 HEC HMD2 H 0.090 3.887 3.002 1.00 . B A . 108 HEC HMD2 1 1 9 16687 2 2 1 HEC HMD3 H 0.098 2.167 3.463 1.00 . B A . 108 HEC HMD3 1 1 9 16688 2 2 1 HEC NA N -1.475 4.244 9.813 1.00 . B A . 108 HEC NA 1 1 9 16689 2 2 1 HEC NB N -2.003 1.620 10.795 1.00 . B A . 108 HEC NB 1 1 9 16690 2 2 1 HEC NC N -1.895 0.614 8.106 1.00 . B A . 108 HEC NC 1 1 9 16691 2 2 1 HEC ND N -1.311 3.230 7.154 1.00 . B A . 108 HEC ND 1 1 9 16692 2 2 1 HEC O1A O -0.648 9.585 12.934 1.00 . B A . 108 HEC O1A 1 1 9 16693 2 2 1 HEC O1D O 0.030 7.224 1.498 1.00 . B A . 108 HEC O1D 1 1 9 16694 2 2 1 HEC O2A O -1.808 10.238 11.148 1.00 . B A . 108 HEC O2A 1 1 9 16695 2 2 1 HEC O2D O 1.265 5.676 2.517 1.00 . B A . 108 HEC O2D 1 1 9 16696 3 2 1 HEC C1A C 9.616 -1.680 1.796 1.00 . C A . 109 HEC C1A 1 1 9 16697 3 2 1 HEC C1B C 5.755 0.005 2.761 1.00 . C A . 109 HEC C1B 1 1 9 16698 3 2 1 HEC C1C C 7.740 3.080 5.163 1.00 . C A . 109 HEC C1C 1 1 9 16699 3 2 1 HEC C1D C 11.578 1.538 3.914 1.00 . C A . 109 HEC C1D 1 1 9 16700 3 2 1 HEC C2A C 9.126 -2.778 0.996 1.00 . C A . 109 HEC C2A 1 1 9 16701 3 2 1 HEC C2B C 4.393 0.349 3.099 1.00 . C A . 109 HEC C2B 1 1 9 16702 3 2 1 HEC C2C C 8.242 4.237 5.866 1.00 . C A . 109 HEC C2C 1 1 9 16703 3 2 1 HEC C2D C 12.932 1.140 3.603 1.00 . C A . 109 HEC C2D 1 1 9 16704 3 2 1 HEC C3A C 7.782 -2.665 0.949 1.00 . C A . 109 HEC C3A 1 1 9 16705 3 2 1 HEC C3B C 4.448 1.406 3.936 1.00 . C A . 109 HEC C3B 1 1 9 16706 3 2 1 HEC C3C C 9.587 4.219 5.752 1.00 . C A . 109 HEC C3C 1 1 9 16707 3 2 1 HEC C3D C 12.856 -0.005 2.893 1.00 . C A . 109 HEC C3D 1 1 9 16708 3 2 1 HEC C4A C 7.426 -1.497 1.720 1.00 . C A . 109 HEC C4A 1 1 9 16709 3 2 1 HEC C4B C 5.843 1.727 4.126 1.00 . C A . 109 HEC C4B 1 1 9 16710 3 2 1 HEC C4C C 9.931 3.050 4.978 1.00 . C A . 109 HEC C4C 1 1 9 16711 3 2 1 HEC C4D C 11.456 -0.328 2.756 1.00 . C A . 109 HEC C4D 1 1 9 16712 3 2 1 HEC CAA C 9.988 -3.826 0.356 1.00 . C A . 109 HEC CAA 1 1 9 16713 3 2 1 HEC CAB C 3.303 2.139 4.574 1.00 . C A . 109 HEC CAB 1 1 9 16714 3 2 1 HEC CAC C 10.574 5.203 6.308 1.00 . C A . 109 HEC CAC 1 1 9 16715 3 2 1 HEC CAD C 13.985 -0.820 2.332 1.00 . C A . 109 HEC CAD 1 1 9 16716 3 2 1 HEC CBA C 10.250 -3.591 -1.130 1.00 . C A . 109 HEC CBA 1 1 9 16717 3 2 1 HEC CBB C 2.262 1.227 5.215 1.00 . C A . 109 HEC CBB 1 1 9 16718 3 2 1 HEC CBC C 10.531 5.335 7.827 1.00 . C A . 109 HEC CBC 1 1 9 16719 3 2 1 HEC CBD C 15.210 -0.891 3.239 1.00 . C A . 109 HEC CBD 1 1 9 16720 3 2 1 HEC CGA C 11.061 -4.731 -1.730 1.00 . C A . 109 HEC CGA 1 1 9 16721 3 2 1 HEC CGD C 16.362 -0.077 2.668 1.00 . C A . 109 HEC CGD 1 1 9 16722 3 2 1 HEC CHA C 10.960 -1.455 2.076 1.00 . C A . 109 HEC CHA 1 1 9 16723 3 2 1 HEC CHB C 6.110 -1.039 1.913 1.00 . C A . 109 HEC CHB 1 1 9 16724 3 2 1 HEC CHC C 6.317 2.774 4.936 1.00 . C A . 109 HEC CHC 1 1 9 16725 3 2 1 HEC CHD C 11.245 2.676 4.639 1.00 . C A . 109 HEC CHD 1 1 9 16726 3 2 1 HEC CMA C 6.804 -3.559 0.244 1.00 . C A . 109 HEC CMA 1 1 9 16727 3 2 1 HEC CMB C 3.176 -0.365 2.589 1.00 . C A . 109 HEC CMB 1 1 9 16728 3 2 1 HEC CMC C 7.388 5.246 6.577 1.00 . C A . 109 HEC CMC 1 1 9 16729 3 2 1 HEC CMD C 14.163 1.893 4.016 1.00 . C A . 109 HEC CMD 1 1 9 16730 3 2 1 HEC FE FE 8.667 0.736 3.411 1.00 . C A . 109 HEC FE 1 1 9 16731 3 2 1 HEC HAA1 H 10.958 -3.852 0.853 1.00 . C A . 109 HEC HAA1 1 1 9 16732 3 2 1 HEC HAA2 H 9.506 -4.799 0.447 1.00 . C A . 109 HEC HAA2 1 1 9 16733 3 2 1 HEC HAB H 3.683 2.794 5.358 1.00 . C A . 109 HEC HAB 1 1 9 16734 3 2 1 HEC HAC H 11.585 4.894 6.040 1.00 . C A . 109 HEC HAC 1 1 9 16735 3 2 1 HEC HAD1 H 13.647 -1.843 2.167 1.00 . C A . 109 HEC HAD1 1 1 9 16736 3 2 1 HEC HAD2 H 14.310 -0.388 1.385 1.00 . C A . 109 HEC HAD2 1 1 9 16737 3 2 1 HEC HBA1 H 9.300 -3.522 -1.659 1.00 . C A . 109 HEC HBA1 1 1 9 16738 3 2 1 HEC HBA2 H 10.806 -2.663 -1.258 1.00 . C A . 109 HEC HBA2 1 1 9 16739 3 2 1 HEC HBB1 H 1.798 1.741 6.057 1.00 . C A . 109 HEC HBB1 1 1 9 16740 3 2 1 HEC HBB2 H 1.499 0.973 4.479 1.00 . C A . 109 HEC HBB2 1 1 9 16741 3 2 1 HEC HBB3 H 2.744 0.315 5.567 1.00 . C A . 109 HEC HBB3 1 1 9 16742 3 2 1 HEC HBC1 H 10.415 4.348 8.275 1.00 . C A . 109 HEC HBC1 1 1 9 16743 3 2 1 HEC HBC2 H 11.459 5.786 8.179 1.00 . C A . 109 HEC HBC2 1 1 9 16744 3 2 1 HEC HBC3 H 9.689 5.965 8.114 1.00 . C A . 109 HEC HBC3 1 1 9 16745 3 2 1 HEC HBD1 H 14.957 -0.496 4.223 1.00 . C A . 109 HEC HBD1 1 1 9 16746 3 2 1 HEC HBD2 H 15.531 -1.928 3.336 1.00 . C A . 109 HEC HBD2 1 1 9 16747 3 2 1 HEC HHA H 11.683 -2.201 1.746 1.00 . C A . 109 HEC HHA 1 1 9 16748 3 2 1 HEC HHB H 5.317 -1.540 1.359 1.00 . C A . 109 HEC HHB 1 1 9 16749 3 2 1 HEC HHC H 5.577 3.395 5.439 1.00 . C A . 109 HEC HHC 1 1 9 16750 3 2 1 HEC HHD H 12.054 3.327 4.970 1.00 . C A . 109 HEC HHD 1 1 9 16751 3 2 1 HEC HMA1 H 6.885 -3.410 -0.832 1.00 . C A . 109 HEC HMA1 1 1 9 16752 3 2 1 HEC HMA2 H 7.024 -4.600 0.484 1.00 . C A . 109 HEC HMA2 1 1 9 16753 3 2 1 HEC HMA3 H 5.791 -3.318 0.569 1.00 . C A . 109 HEC HMA3 1 1 9 16754 3 2 1 HEC HMB1 H 3.419 -0.881 1.660 1.00 . C A . 109 HEC HMB1 1 1 9 16755 3 2 1 HEC HMB2 H 2.842 -1.090 3.331 1.00 . C A . 109 HEC HMB2 1 1 9 16756 3 2 1 HEC HMB3 H 2.381 0.358 2.405 1.00 . C A . 109 HEC HMB3 1 1 9 16757 3 2 1 HEC HMC1 H 6.462 5.395 6.022 1.00 . C A . 109 HEC HMC1 1 1 9 16758 3 2 1 HEC HMC2 H 7.157 4.885 7.579 1.00 . C A . 109 HEC HMC2 1 1 9 16759 3 2 1 HEC HMC3 H 7.925 6.192 6.647 1.00 . C A . 109 HEC HMC3 1 1 9 16760 3 2 1 HEC HMD1 H 13.910 2.939 4.185 1.00 . C A . 109 HEC HMD1 1 1 9 16761 3 2 1 HEC HMD2 H 14.562 1.462 4.934 1.00 . C A . 109 HEC HMD2 1 1 9 16762 3 2 1 HEC HMD3 H 14.913 1.823 3.227 1.00 . C A . 109 HEC HMD3 1 1 9 16763 3 2 1 HEC NA N 8.562 -0.899 2.237 1.00 . C A . 109 HEC NA 1 1 9 16764 3 2 1 HEC NB N 6.638 0.859 3.398 1.00 . C A . 109 HEC NB 1 1 9 16765 3 2 1 HEC NC N 8.788 2.356 4.620 1.00 . C A . 109 HEC NC 1 1 9 16766 3 2 1 HEC ND N 10.679 0.627 3.387 1.00 . C A . 109 HEC ND 1 1 9 16767 3 2 1 HEC O1A O 11.178 -4.750 -2.974 1.00 . C A . 109 HEC O1A 1 1 9 16768 3 2 1 HEC O1D O 16.500 -0.082 1.426 1.00 . C A . 109 HEC O1D 1 1 9 16769 3 2 1 HEC O2A O 11.548 -5.562 -0.933 1.00 . C A . 109 HEC O2A 1 1 9 16770 3 2 1 HEC O2D O 17.083 0.536 3.485 1.00 . C A . 109 HEC O2D 1 1 9 16771 4 2 1 HEC C1A C -8.670 -3.360 0.527 1.00 . D A . 110 HEC C1A 1 1 9 16772 4 2 1 HEC C1B C -4.965 -1.174 0.122 1.00 . D A . 110 HEC C1B 1 1 9 16773 4 2 1 HEC C1C C -2.846 -4.412 2.072 1.00 . D A . 110 HEC C1C 1 1 9 16774 4 2 1 HEC C1D C -6.552 -6.602 2.445 1.00 . D A . 110 HEC C1D 1 1 9 16775 4 2 1 HEC C2A C -9.512 -2.394 -0.137 1.00 . D A . 110 HEC C2A 1 1 9 16776 4 2 1 HEC C2B C -3.813 -0.337 -0.120 1.00 . D A . 110 HEC C2B 1 1 9 16777 4 2 1 HEC C2C C -1.992 -5.420 2.655 1.00 . D A . 110 HEC C2C 1 1 9 16778 4 2 1 HEC C2D C -7.710 -7.412 2.741 1.00 . D A . 110 HEC C2D 1 1 9 16779 4 2 1 HEC C3A C -8.718 -1.372 -0.520 1.00 . D A . 110 HEC C3A 1 1 9 16780 4 2 1 HEC C3B C -2.752 -0.950 0.445 1.00 . D A . 110 HEC C3B 1 1 9 16781 4 2 1 HEC C3C C -2.779 -6.467 2.981 1.00 . D A . 110 HEC C3C 1 1 9 16782 4 2 1 HEC C3D C -8.788 -6.751 2.267 1.00 . D A . 110 HEC C3D 1 1 9 16783 4 2 1 HEC C4A C -7.376 -1.695 -0.096 1.00 . D A . 110 HEC C4A 1 1 9 16784 4 2 1 HEC C4B C -3.235 -2.172 1.042 1.00 . D A . 110 HEC C4B 1 1 9 16785 4 2 1 HEC C4C C -4.128 -6.117 2.603 1.00 . D A . 110 HEC C4C 1 1 9 16786 4 2 1 HEC C4D C -8.307 -5.526 1.673 1.00 . D A . 110 HEC C4D 1 1 9 16787 4 2 1 HEC CAA C -10.992 -2.542 -0.342 1.00 . D A . 110 HEC CAA 1 1 9 16788 4 2 1 HEC CAB C -1.324 -0.487 0.472 1.00 . D A . 110 HEC CAB 1 1 9 16789 4 2 1 HEC CAC C -2.374 -7.765 3.616 1.00 . D A . 110 HEC CAC 1 1 9 16790 4 2 1 HEC CAD C -10.228 -7.171 2.323 1.00 . D A . 110 HEC CAD 1 1 9 16791 4 2 1 HEC CBA C -11.836 -1.648 0.563 1.00 . D A . 110 HEC CBA 1 1 9 16792 4 2 1 HEC CBB C -1.151 0.967 0.902 1.00 . D A . 110 HEC CBB 1 1 9 16793 4 2 1 HEC CBC C -1.072 -7.690 4.407 1.00 . D A . 110 HEC CBC 1 1 9 16794 4 2 1 HEC CBD C -10.943 -7.118 0.977 1.00 . D A . 110 HEC CBD 1 1 9 16795 4 2 1 HEC CGA C -13.068 -2.385 1.066 1.00 . D A . 110 HEC CGA 1 1 9 16796 4 2 1 HEC CGD C -12.208 -6.275 1.061 1.00 . D A . 110 HEC CGD 1 1 9 16797 4 2 1 HEC CHA C -9.128 -4.558 1.066 1.00 . D A . 110 HEC CHA 1 1 9 16798 4 2 1 HEC CHB C -6.253 -0.875 -0.310 1.00 . D A . 110 HEC CHB 1 1 9 16799 4 2 1 HEC CHC C -2.429 -3.096 1.732 1.00 . D A . 110 HEC CHC 1 1 9 16800 4 2 1 HEC CHD C -5.248 -6.951 2.780 1.00 . D A . 110 HEC CHD 1 1 9 16801 4 2 1 HEC CMA C -9.111 -0.120 -1.248 1.00 . D A . 110 HEC CMA 1 1 9 16802 4 2 1 HEC CMB C -3.839 0.965 -0.866 1.00 . D A . 110 HEC CMB 1 1 9 16803 4 2 1 HEC CMC C -0.509 -5.285 2.844 1.00 . D A . 110 HEC CMC 1 1 9 16804 4 2 1 HEC CMD C -7.675 -8.736 3.447 1.00 . D A . 110 HEC CMD 1 1 9 16805 4 2 1 HEC FE FE -5.761 -3.879 1.304 1.00 . D A . 110 HEC FE 1 1 9 16806 4 2 1 HEC HAA1 H -11.243 -2.286 -1.371 1.00 . D A . 110 HEC HAA1 1 1 9 16807 4 2 1 HEC HAA2 H -11.286 -3.572 -0.140 1.00 . D A . 110 HEC HAA2 1 1 9 16808 4 2 1 HEC HAB H -0.757 -1.099 1.173 1.00 . D A . 110 HEC HAB 1 1 9 16809 4 2 1 HEC HAC H -3.152 -8.090 4.307 1.00 . D A . 110 HEC HAC 1 1 9 16810 4 2 1 HEC HAD1 H -10.293 -8.198 2.682 1.00 . D A . 110 HEC HAD1 1 1 9 16811 4 2 1 HEC HAD2 H -10.771 -6.514 3.002 1.00 . D A . 110 HEC HAD2 1 1 9 16812 4 2 1 HEC HBA1 H -11.241 -1.335 1.421 1.00 . D A . 110 HEC HBA1 1 1 9 16813 4 2 1 HEC HBA2 H -12.159 -0.769 0.005 1.00 . D A . 110 HEC HBA2 1 1 9 16814 4 2 1 HEC HBB1 H -0.862 1.569 0.041 1.00 . D A . 110 HEC HBB1 1 1 9 16815 4 2 1 HEC HBB2 H -2.092 1.340 1.307 1.00 . D A . 110 HEC HBB2 1 1 9 16816 4 2 1 HEC HBB3 H -0.376 1.030 1.666 1.00 . D A . 110 HEC HBB3 1 1 9 16817 4 2 1 HEC HBC1 H -1.137 -6.884 5.138 1.00 . D A . 110 HEC HBC1 1 1 9 16818 4 2 1 HEC HBC2 H -0.904 -8.635 4.923 1.00 . D A . 110 HEC HBC2 1 1 9 16819 4 2 1 HEC HBC3 H -0.243 -7.496 3.725 1.00 . D A . 110 HEC HBC3 1 1 9 16820 4 2 1 HEC HBD1 H -10.281 -6.680 0.230 1.00 . D A . 110 HEC HBD1 1 1 9 16821 4 2 1 HEC HBD2 H -11.217 -8.128 0.671 1.00 . D A . 110 HEC HBD2 1 1 9 16822 4 2 1 HEC HHA H -10.197 -4.766 1.016 1.00 . D A . 110 HEC HHA 1 1 9 16823 4 2 1 HEC HHB H -6.407 0.057 -0.852 1.00 . D A . 110 HEC HHB 1 1 9 16824 4 2 1 HEC HHC H -1.421 -2.781 2.002 1.00 . D A . 110 HEC HHC 1 1 9 16825 4 2 1 HEC HHD H -5.076 -7.938 3.211 1.00 . D A . 110 HEC HHD 1 1 9 16826 4 2 1 HEC HMA1 H -8.618 0.738 -0.789 1.00 . D A . 110 HEC HMA1 1 1 9 16827 4 2 1 HEC HMA2 H -8.807 -0.197 -2.293 1.00 . D A . 110 HEC HMA2 1 1 9 16828 4 2 1 HEC HMA3 H -10.191 0.010 -1.192 1.00 . D A . 110 HEC HMA3 1 1 9 16829 4 2 1 HEC HMB1 H -4.673 1.571 -0.511 1.00 . D A . 110 HEC HMB1 1 1 9 16830 4 2 1 HEC HMB2 H -2.905 1.499 -0.697 1.00 . D A . 110 HEC HMB2 1 1 9 16831 4 2 1 HEC HMB3 H -3.959 0.771 -1.932 1.00 . D A . 110 HEC HMB3 1 1 9 16832 4 2 1 HEC HMC1 H -0.262 -5.423 3.897 1.00 . D A . 110 HEC HMC1 1 1 9 16833 4 2 1 HEC HMC2 H 0.003 -6.041 2.249 1.00 . D A . 110 HEC HMC2 1 1 9 16834 4 2 1 HEC HMC3 H -0.191 -4.293 2.523 1.00 . D A . 110 HEC HMC3 1 1 9 16835 4 2 1 HEC HMD1 H -8.690 -9.037 3.705 1.00 . D A . 110 HEC HMD1 1 1 9 16836 4 2 1 HEC HMD2 H -7.229 -9.485 2.792 1.00 . D A . 110 HEC HMD2 1 1 9 16837 4 2 1 HEC HMD3 H -7.079 -8.648 4.355 1.00 . D A . 110 HEC HMD3 1 1 9 16838 4 2 1 HEC NA N -7.358 -2.920 0.547 1.00 . D A . 110 HEC NA 1 1 9 16839 4 2 1 HEC NB N -4.598 -2.300 0.838 1.00 . D A . 110 HEC NB 1 1 9 16840 4 2 1 HEC NC N -4.158 -4.851 2.045 1.00 . D A . 110 HEC NC 1 1 9 16841 4 2 1 HEC ND N -6.931 -5.444 1.788 1.00 . D A . 110 HEC ND 1 1 9 16842 4 2 1 HEC O1A O -13.373 -2.226 2.268 1.00 . D A . 110 HEC O1A 1 1 9 16843 4 2 1 HEC O1D O -12.394 -5.439 0.150 1.00 . D A . 110 HEC O1D 1 1 9 16844 4 2 1 HEC O2A O -13.682 -3.095 0.241 1.00 . D A . 110 HEC O2A 1 1 9 16845 4 2 1 HEC O2D O -12.965 -6.483 2.033 1.00 . D A . 110 HEC O2D 1 1 9 16846 5 2 1 HEC C1A C -0.017 4.060 -9.189 1.00 . E A . 111 HEC C1A 1 1 9 16847 5 2 1 HEC C1B C -1.305 0.610 -11.451 1.00 . E A . 111 HEC C1B 1 1 9 16848 5 2 1 HEC C1C C -3.101 -1.058 -7.858 1.00 . E A . 111 HEC C1C 1 1 9 16849 5 2 1 HEC C1D C -1.810 2.406 -5.621 1.00 . E A . 111 HEC C1D 1 1 9 16850 5 2 1 HEC C2A C 0.611 4.756 -10.286 1.00 . E A . 111 HEC C2A 1 1 9 16851 5 2 1 HEC C2B C -1.487 -0.541 -12.304 1.00 . E A . 111 HEC C2B 1 1 9 16852 5 2 1 HEC C2C C -3.863 -1.673 -6.796 1.00 . E A . 111 HEC C2C 1 1 9 16853 5 2 1 HEC C2D C -1.326 3.412 -4.705 1.00 . E A . 111 HEC C2D 1 1 9 16854 5 2 1 HEC C3A C 0.426 4.003 -11.391 1.00 . E A . 111 HEC C3A 1 1 9 16855 5 2 1 HEC C3B C -2.093 -1.492 -11.564 1.00 . E A . 111 HEC C3B 1 1 9 16856 5 2 1 HEC C3C C -3.758 -0.870 -5.716 1.00 . E A . 111 HEC C3C 1 1 9 16857 5 2 1 HEC C3D C -0.621 4.305 -5.432 1.00 . E A . 111 HEC C3D 1 1 9 16858 5 2 1 HEC C4A C -0.317 2.833 -10.989 1.00 . E A . 111 HEC C4A 1 1 9 16859 5 2 1 HEC C4B C -2.294 -0.940 -10.245 1.00 . E A . 111 HEC C4B 1 1 9 16860 5 2 1 HEC C4C C -2.930 0.249 -6.098 1.00 . E A . 111 HEC C4C 1 1 9 16861 5 2 1 HEC C4D C -0.660 3.859 -6.805 1.00 . E A . 111 HEC C4D 1 1 9 16862 5 2 1 HEC CAA C 1.325 6.072 -10.173 1.00 . E A . 111 HEC CAA 1 1 9 16863 5 2 1 HEC CAB C -2.501 -2.873 -11.988 1.00 . E A . 111 HEC CAB 1 1 9 16864 5 2 1 HEC CAC C -4.367 -1.064 -4.358 1.00 . E A . 111 HEC CAC 1 1 9 16865 5 2 1 HEC CAD C 0.086 5.537 -4.949 1.00 . E A . 111 HEC CAD 1 1 9 16866 5 2 1 HEC CBA C 2.738 6.062 -10.749 1.00 . E A . 111 HEC CBA 1 1 9 16867 5 2 1 HEC CBB C -1.459 -3.947 -11.687 1.00 . E A . 111 HEC CBB 1 1 9 16868 5 2 1 HEC CBC C -4.223 -2.481 -3.810 1.00 . E A . 111 HEC CBC 1 1 9 16869 5 2 1 HEC CBD C -0.841 6.718 -4.675 1.00 . E A . 111 HEC CBD 1 1 9 16870 5 2 1 HEC CGA C 2.976 7.275 -11.637 1.00 . E A . 111 HEC CGA 1 1 9 16871 5 2 1 HEC CGD C -0.066 8.027 -4.640 1.00 . E A . 111 HEC CGD 1 1 9 16872 5 2 1 HEC CHA C -0.039 4.525 -7.878 1.00 . E A . 111 HEC CHA 1 1 9 16873 5 2 1 HEC CHB C -0.710 1.799 -11.858 1.00 . E A . 111 HEC CHB 1 1 9 16874 5 2 1 HEC CHC C -2.901 -1.626 -9.177 1.00 . E A . 111 HEC CHC 1 1 9 16875 5 2 1 HEC CHD C -2.582 1.312 -5.245 1.00 . E A . 111 HEC CHD 1 1 9 16876 5 2 1 HEC CMA C 0.888 4.288 -12.791 1.00 . E A . 111 HEC CMA 1 1 9 16877 5 2 1 HEC CMB C -1.062 -0.619 -13.742 1.00 . E A . 111 HEC CMB 1 1 9 16878 5 2 1 HEC CMC C -4.616 -2.965 -6.917 1.00 . E A . 111 HEC CMC 1 1 9 16879 5 2 1 HEC CMD C -1.585 3.423 -3.227 1.00 . E A . 111 HEC CMD 1 1 9 16880 5 2 1 HEC FE FE -1.579 1.512 -8.536 1.00 . E A . 111 HEC FE 1 1 9 16881 5 2 1 HEC HAA1 H 0.764 6.837 -10.710 1.00 . E A . 111 HEC HAA1 1 1 9 16882 5 2 1 HEC HAA2 H 1.407 6.351 -9.123 1.00 . E A . 111 HEC HAA2 1 1 9 16883 5 2 1 HEC HAB H -3.415 -3.158 -11.468 1.00 . E A . 111 HEC HAB 1 1 9 16884 5 2 1 HEC HAC H -3.887 -0.393 -3.646 1.00 . E A . 111 HEC HAC 1 1 9 16885 5 2 1 HEC HAD1 H 0.608 5.315 -4.018 1.00 . E A . 111 HEC HAD1 1 1 9 16886 5 2 1 HEC HAD2 H 0.806 5.861 -5.701 1.00 . E A . 111 HEC HAD2 1 1 9 16887 5 2 1 HEC HBA1 H 3.462 6.080 -9.934 1.00 . E A . 111 HEC HBA1 1 1 9 16888 5 2 1 HEC HBA2 H 2.882 5.161 -11.344 1.00 . E A . 111 HEC HBA2 1 1 9 16889 5 2 1 HEC HBB1 H -1.226 -4.494 -12.601 1.00 . E A . 111 HEC HBB1 1 1 9 16890 5 2 1 HEC HBB2 H -0.553 -3.478 -11.303 1.00 . E A . 111 HEC HBB2 1 1 9 16891 5 2 1 HEC HBB3 H -1.854 -4.638 -10.942 1.00 . E A . 111 HEC HBB3 1 1 9 16892 5 2 1 HEC HBC1 H -5.068 -3.086 -4.141 1.00 . E A . 111 HEC HBC1 1 1 9 16893 5 2 1 HEC HBC2 H -3.296 -2.920 -4.176 1.00 . E A . 111 HEC HBC2 1 1 9 16894 5 2 1 HEC HBC3 H -4.205 -2.448 -2.720 1.00 . E A . 111 HEC HBC3 1 1 9 16895 5 2 1 HEC HBD1 H -1.593 6.779 -5.461 1.00 . E A . 111 HEC HBD1 1 1 9 16896 5 2 1 HEC HBD2 H -1.332 6.578 -3.712 1.00 . E A . 111 HEC HBD2 1 1 9 16897 5 2 1 HEC HHA H 0.459 5.470 -7.662 1.00 . E A . 111 HEC HHA 1 1 9 16898 5 2 1 HEC HHB H -0.534 1.945 -12.924 1.00 . E A . 111 HEC HHB 1 1 9 16899 5 2 1 HEC HHC H -3.224 -2.651 -9.357 1.00 . E A . 111 HEC HHC 1 1 9 16900 5 2 1 HEC HHD H -2.945 1.272 -4.218 1.00 . E A . 111 HEC HHD 1 1 9 16901 5 2 1 HEC HMA1 H 0.714 5.338 -13.025 1.00 . E A . 111 HEC HMA1 1 1 9 16902 5 2 1 HEC HMA2 H 1.953 4.069 -12.874 1.00 . E A . 111 HEC HMA2 1 1 9 16903 5 2 1 HEC HMA3 H 0.333 3.663 -13.491 1.00 . E A . 111 HEC HMA3 1 1 9 16904 5 2 1 HEC HMB1 H -1.809 -0.130 -14.368 1.00 . E A . 111 HEC HMB1 1 1 9 16905 5 2 1 HEC HMB2 H -0.102 -0.119 -13.865 1.00 . E A . 111 HEC HMB2 1 1 9 16906 5 2 1 HEC HMB3 H -0.969 -1.664 -14.037 1.00 . E A . 111 HEC HMB3 1 1 9 16907 5 2 1 HEC HMC1 H -5.673 -2.790 -6.716 1.00 . E A . 111 HEC HMC1 1 1 9 16908 5 2 1 HEC HMC2 H -4.499 -3.361 -7.926 1.00 . E A . 111 HEC HMC2 1 1 9 16909 5 2 1 HEC HMC3 H -4.223 -3.684 -6.198 1.00 . E A . 111 HEC HMC3 1 1 9 16910 5 2 1 HEC HMD1 H -1.520 4.446 -2.854 1.00 . E A . 111 HEC HMD1 1 1 9 16911 5 2 1 HEC HMD2 H -2.581 3.027 -3.030 1.00 . E A . 111 HEC HMD2 1 1 9 16912 5 2 1 HEC HMD3 H -0.842 2.805 -2.723 1.00 . E A . 111 HEC HMD3 1 1 9 16913 5 2 1 HEC NA N -0.585 2.878 -9.632 1.00 . E A . 111 HEC NA 1 1 9 16914 5 2 1 HEC NB N -1.806 0.353 -10.186 1.00 . E A . 111 HEC NB 1 1 9 16915 5 2 1 HEC NC N -2.531 0.124 -7.418 1.00 . E A . 111 HEC NC 1 1 9 16916 5 2 1 HEC ND N -1.394 2.691 -6.910 1.00 . E A . 111 HEC ND 1 1 9 16917 5 2 1 HEC O1A O 2.016 7.661 -12.339 1.00 . E A . 111 HEC O1A 1 1 9 16918 5 2 1 HEC O1D O 0.537 8.301 -3.579 1.00 . E A . 111 HEC O1D 1 1 9 16919 5 2 1 HEC O2A O 4.113 7.793 -11.598 1.00 . E A . 111 HEC O2A 1 1 9 16920 5 2 1 HEC O2D O -0.090 8.729 -5.674 1.00 . E A . 111 HEC O2D 1 1 10 16921 1 1 1 ALA C C -2.687 5.471 20.869 1.00 . A A . 1 ALA C 1 1 10 16922 1 1 1 ALA CA C -1.956 4.576 21.872 1.00 . A A . 1 ALA CA 1 1 10 16923 1 1 1 ALA CB C -1.782 3.146 21.357 1.00 . A A . 1 ALA CB 1 1 10 16924 1 1 1 ALA H1 H -2.363 5.304 23.722 1.00 . A A . 1 ALA H1 1 1 10 16925 1 1 1 ALA H2 H -3.681 4.682 22.936 1.00 . A A . 1 ALA H2 1 1 10 16926 1 1 1 ALA HA H -0.971 4.999 22.073 1.00 . A A . 1 ALA HA 1 1 10 16927 1 1 1 ALA HB1 H -2.266 2.451 22.043 1.00 . A A . 1 ALA HB1 1 1 10 16928 1 1 1 ALA HB2 H -2.236 3.057 20.370 1.00 . A A . 1 ALA HB2 1 1 10 16929 1 1 1 ALA HB3 H -0.720 2.910 21.291 1.00 . A A . 1 ALA HB3 1 1 10 16930 1 1 1 ALA N N -2.693 4.555 23.124 1.00 . A A . 1 ALA N 1 1 10 16931 1 1 1 ALA O O -3.858 5.796 21.061 1.00 . A A . 1 ALA O 1 1 10 16932 1 1 2 PRO C C -3.471 5.918 17.866 1.00 . A A . 2 PRO C 1 1 10 16933 1 1 2 PRO CA C -2.513 6.706 18.762 1.00 . A A . 2 PRO CA 1 1 10 16934 1 1 2 PRO CB C -1.315 7.260 18.008 1.00 . A A . 2 PRO CB 1 1 10 16935 1 1 2 PRO CD C -0.558 5.489 19.534 1.00 . A A . 2 PRO CD 1 1 10 16936 1 1 2 PRO CG C -0.151 6.342 18.344 1.00 . A A . 2 PRO CG 1 1 10 16937 1 1 2 PRO HA H -3.061 7.434 19.174 1.00 . A A . 2 PRO HA 1 1 10 16938 1 1 2 PRO HB2 H -1.503 7.276 16.935 1.00 . A A . 2 PRO HB2 1 1 10 16939 1 1 2 PRO HB3 H -1.104 8.285 18.310 1.00 . A A . 2 PRO HB3 1 1 10 16940 1 1 2 PRO HD2 H -0.464 4.426 19.311 1.00 . A A . 2 PRO HD2 1 1 10 16941 1 1 2 PRO HD3 H 0.073 5.690 20.400 1.00 . A A . 2 PRO HD3 1 1 10 16942 1 1 2 PRO HG2 H 0.097 5.712 17.490 1.00 . A A . 2 PRO HG2 1 1 10 16943 1 1 2 PRO HG3 H 0.739 6.925 18.579 1.00 . A A . 2 PRO HG3 1 1 10 16944 1 1 2 PRO N N -1.948 5.854 19.794 1.00 . A A . 2 PRO N 1 1 10 16945 1 1 2 PRO O O -4.065 6.476 16.944 1.00 . A A . 2 PRO O 1 1 10 16946 1 1 3 LYS C C -4.352 4.111 15.916 1.00 . A A . 3 LYS C 1 1 10 16947 1 1 3 LYS CA C -4.468 3.764 17.402 1.00 . A A . 3 LYS CA 1 1 10 16948 1 1 3 LYS CB C -5.899 3.835 17.939 1.00 . A A . 3 LYS CB 1 1 10 16949 1 1 3 LYS CD C -6.554 6.144 18.713 1.00 . A A . 3 LYS CD 1 1 10 16950 1 1 3 LYS CE C -7.583 7.256 18.501 1.00 . A A . 3 LYS CE 1 1 10 16951 1 1 3 LYS CG C -6.567 5.154 17.547 1.00 . A A . 3 LYS CG 1 1 10 16952 1 1 3 LYS H H -3.107 4.188 18.920 1.00 . A A . 3 LYS H 1 1 10 16953 1 1 3 LYS HA H -4.120 2.741 17.546 1.00 . A A . 3 LYS HA 1 1 10 16954 1 1 3 LYS HB2 H -6.480 2.999 17.550 1.00 . A A . 3 LYS HB2 1 1 10 16955 1 1 3 LYS HB3 H -5.889 3.737 19.025 1.00 . A A . 3 LYS HB3 1 1 10 16956 1 1 3 LYS HD2 H -6.767 5.618 19.644 1.00 . A A . 3 LYS HD2 1 1 10 16957 1 1 3 LYS HD3 H -5.559 6.579 18.814 1.00 . A A . 3 LYS HD3 1 1 10 16958 1 1 3 LYS HE2 H -7.482 7.666 17.497 1.00 . A A . 3 LYS HE2 1 1 10 16959 1 1 3 LYS HE3 H -8.590 6.846 18.579 1.00 . A A . 3 LYS HE3 1 1 10 16960 1 1 3 LYS HG2 H -6.050 5.588 16.691 1.00 . A A . 3 LYS HG2 1 1 10 16961 1 1 3 LYS HG3 H -7.595 4.967 17.236 1.00 . A A . 3 LYS HG3 1 1 10 16962 1 1 3 LYS HZ1 H -7.477 7.981 20.452 1.00 . A A . 3 LYS HZ1 1 1 10 16963 1 1 3 LYS HZ2 H -6.490 8.770 19.425 1.00 . A A . 3 LYS HZ2 1 1 10 16964 1 1 3 LYS N N -3.593 4.634 18.168 1.00 . A A . 3 LYS N 1 1 10 16965 1 1 3 LYS NZ N -7.400 8.330 19.503 1.00 . A A . 3 LYS NZ 1 1 10 16966 1 1 3 LYS O O -3.359 4.698 15.488 1.00 . A A . 3 LYS O 1 1 10 16967 1 1 4 ALA C C -6.028 5.372 13.492 1.00 . A A . 4 ALA C 1 1 10 16968 1 1 4 ALA CA C -5.405 3.997 13.742 1.00 . A A . 4 ALA CA 1 1 10 16969 1 1 4 ALA CB C -6.162 2.876 13.028 1.00 . A A . 4 ALA CB 1 1 10 16970 1 1 4 ALA H H -6.183 3.257 15.526 1.00 . A A . 4 ALA H 1 1 10 16971 1 1 4 ALA HA H -4.374 4.005 13.387 1.00 . A A . 4 ALA HA 1 1 10 16972 1 1 4 ALA HB1 H -7.134 2.735 13.502 1.00 . A A . 4 ALA HB1 1 1 10 16973 1 1 4 ALA HB2 H -6.303 3.141 11.981 1.00 . A A . 4 ALA HB2 1 1 10 16974 1 1 4 ALA HB3 H -5.589 1.951 13.094 1.00 . A A . 4 ALA HB3 1 1 10 16975 1 1 4 ALA N N -5.379 3.734 15.170 1.00 . A A . 4 ALA N 1 1 10 16976 1 1 4 ALA O O -6.830 5.848 14.293 1.00 . A A . 4 ALA O 1 1 10 16977 1 1 5 PRO C C -7.571 7.202 11.466 1.00 . A A . 5 PRO C 1 1 10 16978 1 1 5 PRO CA C -6.134 7.298 11.983 1.00 . A A . 5 PRO CA 1 1 10 16979 1 1 5 PRO CB C -5.161 7.822 10.940 1.00 . A A . 5 PRO CB 1 1 10 16980 1 1 5 PRO CD C -4.675 5.453 11.376 1.00 . A A . 5 PRO CD 1 1 10 16981 1 1 5 PRO CG C -4.411 6.606 10.421 1.00 . A A . 5 PRO CG 1 1 10 16982 1 1 5 PRO HA H -6.172 7.892 12.787 1.00 . A A . 5 PRO HA 1 1 10 16983 1 1 5 PRO HB2 H -5.689 8.329 10.133 1.00 . A A . 5 PRO HB2 1 1 10 16984 1 1 5 PRO HB3 H -4.474 8.548 11.376 1.00 . A A . 5 PRO HB3 1 1 10 16985 1 1 5 PRO HD2 H -5.088 4.591 10.851 1.00 . A A . 5 PRO HD2 1 1 10 16986 1 1 5 PRO HD3 H -3.757 5.122 11.860 1.00 . A A . 5 PRO HD3 1 1 10 16987 1 1 5 PRO HG2 H -4.745 6.352 9.415 1.00 . A A . 5 PRO HG2 1 1 10 16988 1 1 5 PRO HG3 H -3.343 6.814 10.360 1.00 . A A . 5 PRO HG3 1 1 10 16989 1 1 5 PRO N N -5.624 5.987 12.348 1.00 . A A . 5 PRO N 1 1 10 16990 1 1 5 PRO O O -8.127 6.110 11.365 1.00 . A A . 5 PRO O 1 1 10 16991 1 1 6 ALA C C -9.567 7.696 9.303 1.00 . A A . 6 ALA C 1 1 10 16992 1 1 6 ALA CA C -9.492 8.422 10.648 1.00 . A A . 6 ALA CA 1 1 10 16993 1 1 6 ALA CB C -9.934 9.884 10.547 1.00 . A A . 6 ALA CB 1 1 10 16994 1 1 6 ALA H H -7.672 9.246 11.236 1.00 . A A . 6 ALA H 1 1 10 16995 1 1 6 ALA HA H -10.135 7.910 11.364 1.00 . A A . 6 ALA HA 1 1 10 16996 1 1 6 ALA HB1 H -9.638 10.417 11.450 1.00 . A A . 6 ALA HB1 1 1 10 16997 1 1 6 ALA HB2 H -9.462 10.347 9.680 1.00 . A A . 6 ALA HB2 1 1 10 16998 1 1 6 ALA HB3 H -11.018 9.929 10.438 1.00 . A A . 6 ALA HB3 1 1 10 16999 1 1 6 ALA N N -8.131 8.361 11.152 1.00 . A A . 6 ALA N 1 1 10 17000 1 1 6 ALA O O -8.567 7.163 8.825 1.00 . A A . 6 ALA O 1 1 10 17001 1 1 7 ASP C C -10.873 8.083 6.330 1.00 . A A . 7 ASP C 1 1 10 17002 1 1 7 ASP CA C -10.980 7.047 7.451 1.00 . A A . 7 ASP CA 1 1 10 17003 1 1 7 ASP CB C -12.374 6.420 7.383 1.00 . A A . 7 ASP CB 1 1 10 17004 1 1 7 ASP CG C -13.535 7.411 7.481 1.00 . A A . 7 ASP CG 1 1 10 17005 1 1 7 ASP H H -11.570 8.136 9.126 1.00 . A A . 7 ASP H 1 1 10 17006 1 1 7 ASP HA H -10.208 6.280 7.385 1.00 . A A . 7 ASP HA 1 1 10 17007 1 1 7 ASP HB2 H -12.463 5.871 6.445 1.00 . A A . 7 ASP HB2 1 1 10 17008 1 1 7 ASP HB3 H -12.468 5.692 8.189 1.00 . A A . 7 ASP HB3 1 1 10 17009 1 1 7 ASP N N -10.762 7.699 8.731 1.00 . A A . 7 ASP N 1 1 10 17010 1 1 7 ASP O O -10.833 9.285 6.593 1.00 . A A . 7 ASP O 1 1 10 17011 1 1 7 ASP OD1 O -13.450 8.299 8.357 1.00 . A A . 7 ASP OD1 1 1 10 17012 1 1 7 ASP OD2 O -14.480 7.260 6.677 1.00 . A A . 7 ASP OD2 1 1 10 17013 1 1 8 GLY C C -9.283 8.910 3.730 1.00 . A A . 8 GLY C 1 1 10 17014 1 1 8 GLY CA C -10.726 8.448 3.944 1.00 . A A . 8 GLY CA 1 1 10 17015 1 1 8 GLY H H -10.861 6.602 4.900 1.00 . A A . 8 GLY H 1 1 10 17016 1 1 8 GLY HA2 H -11.077 7.919 3.058 1.00 . A A . 8 GLY HA2 1 1 10 17017 1 1 8 GLY HA3 H -11.373 9.315 4.075 1.00 . A A . 8 GLY HA3 1 1 10 17018 1 1 8 GLY N N -10.828 7.581 5.105 1.00 . A A . 8 GLY N 1 1 10 17019 1 1 8 GLY O O -9.045 9.969 3.150 1.00 . A A . 8 GLY O 1 1 10 17020 1 1 9 LEU C C -6.505 8.167 2.633 1.00 . A A . 9 LEU C 1 1 10 17021 1 1 9 LEU CA C -6.943 8.405 4.079 1.00 . A A . 9 LEU CA 1 1 10 17022 1 1 9 LEU CB C -6.124 7.622 5.107 1.00 . A A . 9 LEU CB 1 1 10 17023 1 1 9 LEU CD1 C -4.188 6.285 4.201 1.00 . A A . 9 LEU CD1 1 1 10 17024 1 1 9 LEU CD2 C -4.152 8.819 4.089 1.00 . A A . 9 LEU CD2 1 1 10 17025 1 1 9 LEU CG C -4.612 7.590 4.877 1.00 . A A . 9 LEU CG 1 1 10 17026 1 1 9 LEU H H -8.558 7.234 4.680 1.00 . A A . 9 LEU H 1 1 10 17027 1 1 9 LEU HA H -6.820 9.464 4.308 1.00 . A A . 9 LEU HA 1 1 10 17028 1 1 9 LEU HB2 H -6.313 8.047 6.093 1.00 . A A . 9 LEU HB2 1 1 10 17029 1 1 9 LEU HB3 H -6.490 6.595 5.128 1.00 . A A . 9 LEU HB3 1 1 10 17030 1 1 9 LEU HD11 H -4.782 5.461 4.597 1.00 . A A . 9 LEU HD11 1 1 10 17031 1 1 9 LEU HD12 H -4.346 6.363 3.126 1.00 . A A . 9 LEU HD12 1 1 10 17032 1 1 9 LEU HD13 H -3.132 6.099 4.400 1.00 . A A . 9 LEU HD13 1 1 10 17033 1 1 9 LEU HD21 H -4.812 9.658 4.307 1.00 . A A . 9 LEU HD21 1 1 10 17034 1 1 9 LEU HD22 H -3.132 9.074 4.378 1.00 . A A . 9 LEU HD22 1 1 10 17035 1 1 9 LEU HD23 H -4.183 8.599 3.022 1.00 . A A . 9 LEU HD23 1 1 10 17036 1 1 9 LEU HG H -4.118 7.626 5.847 1.00 . A A . 9 LEU HG 1 1 10 17037 1 1 9 LEU N N -8.356 8.093 4.210 1.00 . A A . 9 LEU N 1 1 10 17038 1 1 9 LEU O O -6.237 7.032 2.241 1.00 . A A . 9 LEU O 1 1 10 17039 1 1 10 LYS C C -4.615 9.706 0.340 1.00 . A A . 10 LYS C 1 1 10 17040 1 1 10 LYS CA C -6.044 9.178 0.485 1.00 . A A . 10 LYS CA 1 1 10 17041 1 1 10 LYS CB C -7.059 9.899 -0.405 1.00 . A A . 10 LYS CB 1 1 10 17042 1 1 10 LYS CD C -7.384 11.044 -2.628 1.00 . A A . 10 LYS CD 1 1 10 17043 1 1 10 LYS CE C -6.943 12.490 -2.396 1.00 . A A . 10 LYS CE 1 1 10 17044 1 1 10 LYS CG C -6.518 10.071 -1.826 1.00 . A A . 10 LYS CG 1 1 10 17045 1 1 10 LYS H H -6.665 10.174 2.206 1.00 . A A . 10 LYS H 1 1 10 17046 1 1 10 LYS HA H -6.055 8.127 0.199 1.00 . A A . 10 LYS HA 1 1 10 17047 1 1 10 LYS HB2 H -7.991 9.334 -0.432 1.00 . A A . 10 LYS HB2 1 1 10 17048 1 1 10 LYS HB3 H -7.292 10.876 0.020 1.00 . A A . 10 LYS HB3 1 1 10 17049 1 1 10 LYS HD2 H -7.317 10.805 -3.690 1.00 . A A . 10 LYS HD2 1 1 10 17050 1 1 10 LYS HD3 H -8.429 10.928 -2.341 1.00 . A A . 10 LYS HD3 1 1 10 17051 1 1 10 LYS HE2 H -6.201 12.527 -1.599 1.00 . A A . 10 LYS HE2 1 1 10 17052 1 1 10 LYS HE3 H -6.464 12.879 -3.295 1.00 . A A . 10 LYS HE3 1 1 10 17053 1 1 10 LYS HG2 H -5.493 10.439 -1.786 1.00 . A A . 10 LYS HG2 1 1 10 17054 1 1 10 LYS HG3 H -6.491 9.104 -2.328 1.00 . A A . 10 LYS HG3 1 1 10 17055 1 1 10 LYS HZ1 H -8.605 13.658 -2.861 1.00 . A A . 10 LYS HZ1 1 1 10 17056 1 1 10 LYS HZ2 H -8.774 12.838 -1.464 1.00 . A A . 10 LYS HZ2 1 1 10 17057 1 1 10 LYS N N -6.445 9.255 1.879 1.00 . A A . 10 LYS N 1 1 10 17058 1 1 10 LYS NZ N -8.104 13.335 -2.040 1.00 . A A . 10 LYS NZ 1 1 10 17059 1 1 10 LYS O O -4.214 10.625 1.053 1.00 . A A . 10 LYS O 1 1 10 17060 1 1 11 MET C C -2.305 9.876 -2.303 1.00 . A A . 11 MET C 1 1 10 17061 1 1 11 MET CA C -2.511 9.499 -0.835 1.00 . A A . 11 MET CA 1 1 10 17062 1 1 11 MET CB C -1.573 8.348 -0.466 1.00 . A A . 11 MET CB 1 1 10 17063 1 1 11 MET CE C -0.637 4.861 -0.318 1.00 . A A . 11 MET CE 1 1 10 17064 1 1 11 MET CG C -1.913 7.087 -1.263 1.00 . A A . 11 MET CG 1 1 10 17065 1 1 11 MET H H -4.221 8.356 -1.163 1.00 . A A . 11 MET H 1 1 10 17066 1 1 11 MET HA H -2.340 10.370 -0.201 1.00 . A A . 11 MET HA 1 1 10 17067 1 1 11 MET HB2 H -0.541 8.639 -0.661 1.00 . A A . 11 MET HB2 1 1 10 17068 1 1 11 MET HB3 H -1.650 8.140 0.601 1.00 . A A . 11 MET HB3 1 1 10 17069 1 1 11 MET HE1 H -0.347 4.835 -1.368 1.00 . A A . 11 MET HE1 1 1 10 17070 1 1 11 MET HE2 H 0.128 5.381 0.258 1.00 . A A . 11 MET HE2 1 1 10 17071 1 1 11 MET HE3 H -0.743 3.842 0.054 1.00 . A A . 11 MET HE3 1 1 10 17072 1 1 11 MET HG2 H -2.801 7.260 -1.872 1.00 . A A . 11 MET HG2 1 1 10 17073 1 1 11 MET HG3 H -1.099 6.850 -1.948 1.00 . A A . 11 MET HG3 1 1 10 17074 1 1 11 MET N N -3.887 9.102 -0.588 1.00 . A A . 11 MET N 1 1 10 17075 1 1 11 MET O O -2.220 9.003 -3.166 1.00 . A A . 11 MET O 1 1 10 17076 1 1 11 MET SD S -2.193 5.719 -0.152 1.00 . A A . 11 MET SD 1 1 10 17077 1 1 12 GLU C C -0.577 12.095 -4.098 1.00 . A A . 12 GLU C 1 1 10 17078 1 1 12 GLU CA C -2.035 11.680 -3.892 1.00 . A A . 12 GLU CA 1 1 10 17079 1 1 12 GLU CB C -2.983 12.844 -4.185 1.00 . A A . 12 GLU CB 1 1 10 17080 1 1 12 GLU CD C -1.952 14.156 -6.076 1.00 . A A . 12 GLU CD 1 1 10 17081 1 1 12 GLU CG C -3.033 13.147 -5.684 1.00 . A A . 12 GLU CG 1 1 10 17082 1 1 12 GLU H H -2.299 11.880 -1.835 1.00 . A A . 12 GLU H 1 1 10 17083 1 1 12 GLU HA H -2.279 10.846 -4.550 1.00 . A A . 12 GLU HA 1 1 10 17084 1 1 12 GLU HB2 H -3.984 12.603 -3.826 1.00 . A A . 12 GLU HB2 1 1 10 17085 1 1 12 GLU HB3 H -2.655 13.731 -3.642 1.00 . A A . 12 GLU HB3 1 1 10 17086 1 1 12 GLU HG2 H -2.897 12.225 -6.249 1.00 . A A . 12 GLU HG2 1 1 10 17087 1 1 12 GLU HG3 H -4.015 13.540 -5.947 1.00 . A A . 12 GLU HG3 1 1 10 17088 1 1 12 GLU N N -2.230 11.177 -2.542 1.00 . A A . 12 GLU N 1 1 10 17089 1 1 12 GLU O O -0.285 13.274 -4.291 1.00 . A A . 12 GLU O 1 1 10 17090 1 1 12 GLU OE1 O -2.143 15.348 -5.749 1.00 . A A . 12 GLU OE1 1 1 10 17091 1 1 12 GLU OE2 O -0.959 13.714 -6.693 1.00 . A A . 12 GLU OE2 1 1 10 17092 1 1 13 ALA C C 2.084 11.160 -5.705 1.00 . A A . 13 ALA C 1 1 10 17093 1 1 13 ALA CA C 1.720 11.349 -4.231 1.00 . A A . 13 ALA CA 1 1 10 17094 1 1 13 ALA CB C 2.520 10.426 -3.310 1.00 . A A . 13 ALA CB 1 1 10 17095 1 1 13 ALA H H 0.054 10.146 -3.895 1.00 . A A . 13 ALA H 1 1 10 17096 1 1 13 ALA HA H 1.916 12.384 -3.947 1.00 . A A . 13 ALA HA 1 1 10 17097 1 1 13 ALA HB1 H 1.860 9.660 -2.901 1.00 . A A . 13 ALA HB1 1 1 10 17098 1 1 13 ALA HB2 H 3.320 9.950 -3.877 1.00 . A A . 13 ALA HB2 1 1 10 17099 1 1 13 ALA HB3 H 2.949 11.008 -2.495 1.00 . A A . 13 ALA HB3 1 1 10 17100 1 1 13 ALA N N 0.300 11.102 -4.052 1.00 . A A . 13 ALA N 1 1 10 17101 1 1 13 ALA O O 3.169 11.550 -6.135 1.00 . A A . 13 ALA O 1 1 10 17102 1 1 14 THR C C 0.150 10.773 -8.662 1.00 . A A . 14 THR C 1 1 10 17103 1 1 14 THR CA C 1.367 10.316 -7.855 1.00 . A A . 14 THR CA 1 1 10 17104 1 1 14 THR CB C 1.692 8.831 -8.034 1.00 . A A . 14 THR CB 1 1 10 17105 1 1 14 THR CG2 C 2.868 8.380 -7.165 1.00 . A A . 14 THR CG2 1 1 10 17106 1 1 14 THR H H 0.278 10.248 -6.081 1.00 . A A . 14 THR H 1 1 10 17107 1 1 14 THR HA H 2.214 10.916 -8.186 1.00 . A A . 14 THR HA 1 1 10 17108 1 1 14 THR HB H 1.870 8.596 -9.083 1.00 . A A . 14 THR HB 1 1 10 17109 1 1 14 THR HG1 H -0.273 8.651 -7.700 1.00 . A A . 14 THR HG1 1 1 10 17110 1 1 14 THR HG21 H 3.193 9.208 -6.535 1.00 . A A . 14 THR HG21 1 1 10 17111 1 1 14 THR HG22 H 2.557 7.545 -6.537 1.00 . A A . 14 THR HG22 1 1 10 17112 1 1 14 THR HG23 H 3.693 8.066 -7.805 1.00 . A A . 14 THR HG23 1 1 10 17113 1 1 14 THR N N 1.157 10.562 -6.438 1.00 . A A . 14 THR N 1 1 10 17114 1 1 14 THR O O -0.842 11.224 -8.092 1.00 . A A . 14 THR O 1 1 10 17115 1 1 14 THR OG1 O 0.568 8.160 -7.472 1.00 . A A . 14 THR OG1 1 1 10 17116 1 1 15 LYS C C -2.034 10.156 -10.600 1.00 . A A . 15 LYS C 1 1 10 17117 1 1 15 LYS CA C -0.810 11.036 -10.866 1.00 . A A . 15 LYS CA 1 1 10 17118 1 1 15 LYS CB C -0.339 11.011 -12.321 1.00 . A A . 15 LYS CB 1 1 10 17119 1 1 15 LYS CD C -1.188 11.229 -14.686 1.00 . A A . 15 LYS CD 1 1 10 17120 1 1 15 LYS CE C -2.502 11.361 -15.458 1.00 . A A . 15 LYS CE 1 1 10 17121 1 1 15 LYS CG C -1.354 11.696 -13.238 1.00 . A A . 15 LYS CG 1 1 10 17122 1 1 15 LYS H H 1.078 10.273 -10.430 1.00 . A A . 15 LYS H 1 1 10 17123 1 1 15 LYS HA H -1.069 12.068 -10.628 1.00 . A A . 15 LYS HA 1 1 10 17124 1 1 15 LYS HB2 H 0.626 11.510 -12.404 1.00 . A A . 15 LYS HB2 1 1 10 17125 1 1 15 LYS HB3 H -0.192 9.979 -12.642 1.00 . A A . 15 LYS HB3 1 1 10 17126 1 1 15 LYS HD2 H -0.414 11.819 -15.175 1.00 . A A . 15 LYS HD2 1 1 10 17127 1 1 15 LYS HD3 H -0.855 10.191 -14.701 1.00 . A A . 15 LYS HD3 1 1 10 17128 1 1 15 LYS HE2 H -3.005 10.395 -15.499 1.00 . A A . 15 LYS HE2 1 1 10 17129 1 1 15 LYS HE3 H -3.170 12.046 -14.937 1.00 . A A . 15 LYS HE3 1 1 10 17130 1 1 15 LYS HG2 H -2.365 11.477 -12.895 1.00 . A A . 15 LYS HG2 1 1 10 17131 1 1 15 LYS HG3 H -1.227 12.777 -13.184 1.00 . A A . 15 LYS HG3 1 1 10 17132 1 1 15 LYS HZ1 H -2.519 12.824 -16.942 1.00 . A A . 15 LYS HZ1 1 1 10 17133 1 1 15 LYS HZ2 H -1.269 11.790 -17.082 1.00 . A A . 15 LYS HZ2 1 1 10 17134 1 1 15 LYS N N 0.268 10.641 -9.975 1.00 . A A . 15 LYS N 1 1 10 17135 1 1 15 LYS NZ N -2.250 11.853 -16.831 1.00 . A A . 15 LYS NZ 1 1 10 17136 1 1 15 LYS O O -3.139 10.477 -11.033 1.00 . A A . 15 LYS O 1 1 10 17137 1 1 16 GLN C C -3.040 8.045 -8.044 1.00 . A A . 16 GLN C 1 1 10 17138 1 1 16 GLN CA C -2.862 8.135 -9.561 1.00 . A A . 16 GLN CA 1 1 10 17139 1 1 16 GLN CB C -2.594 6.755 -10.165 1.00 . A A . 16 GLN CB 1 1 10 17140 1 1 16 GLN CD C -3.428 6.579 -12.538 1.00 . A A . 16 GLN CD 1 1 10 17141 1 1 16 GLN CG C -2.220 6.867 -11.645 1.00 . A A . 16 GLN CG 1 1 10 17142 1 1 16 GLN H H -0.892 8.810 -9.540 1.00 . A A . 16 GLN H 1 1 10 17143 1 1 16 GLN HA H -3.760 8.555 -10.015 1.00 . A A . 16 GLN HA 1 1 10 17144 1 1 16 GLN HB2 H -1.788 6.266 -9.619 1.00 . A A . 16 GLN HB2 1 1 10 17145 1 1 16 GLN HB3 H -3.479 6.128 -10.056 1.00 . A A . 16 GLN HB3 1 1 10 17146 1 1 16 GLN HE21 H -3.470 4.696 -11.795 1.00 . A A . 16 GLN HE21 1 1 10 17147 1 1 16 GLN HE22 H -4.692 5.056 -12.968 1.00 . A A . 16 GLN HE22 1 1 10 17148 1 1 16 GLN HG2 H -1.840 7.867 -11.852 1.00 . A A . 16 GLN HG2 1 1 10 17149 1 1 16 GLN HG3 H -1.418 6.167 -11.875 1.00 . A A . 16 GLN HG3 1 1 10 17150 1 1 16 GLN N N -1.794 9.064 -9.889 1.00 . A A . 16 GLN N 1 1 10 17151 1 1 16 GLN NE2 N -3.902 5.341 -12.425 1.00 . A A . 16 GLN NE2 1 1 10 17152 1 1 16 GLN O O -2.312 7.315 -7.373 1.00 . A A . 16 GLN O 1 1 10 17153 1 1 16 GLN OE1 O -3.898 7.424 -13.282 1.00 . A A . 16 GLN OE1 1 1 10 17154 1 1 17 PRO C C -5.044 7.552 -5.682 1.00 . A A . 17 PRO C 1 1 10 17155 1 1 17 PRO CA C -4.320 8.831 -6.110 1.00 . A A . 17 PRO CA 1 1 10 17156 1 1 17 PRO CB C -5.148 10.085 -5.886 1.00 . A A . 17 PRO CB 1 1 10 17157 1 1 17 PRO CD C -4.919 9.693 -8.300 1.00 . A A . 17 PRO CD 1 1 10 17158 1 1 17 PRO CG C -5.690 10.477 -7.251 1.00 . A A . 17 PRO CG 1 1 10 17159 1 1 17 PRO HA H -3.468 8.850 -5.588 1.00 . A A . 17 PRO HA 1 1 10 17160 1 1 17 PRO HB2 H -5.959 9.898 -5.182 1.00 . A A . 17 PRO HB2 1 1 10 17161 1 1 17 PRO HB3 H -4.539 10.885 -5.463 1.00 . A A . 17 PRO HB3 1 1 10 17162 1 1 17 PRO HD2 H -5.592 9.119 -8.939 1.00 . A A . 17 PRO HD2 1 1 10 17163 1 1 17 PRO HD3 H -4.351 10.357 -8.952 1.00 . A A . 17 PRO HD3 1 1 10 17164 1 1 17 PRO HG2 H -6.755 10.258 -7.316 1.00 . A A . 17 PRO HG2 1 1 10 17165 1 1 17 PRO HG3 H -5.575 11.549 -7.414 1.00 . A A . 17 PRO HG3 1 1 10 17166 1 1 17 PRO N N -4.037 8.817 -7.536 1.00 . A A . 17 PRO N 1 1 10 17167 1 1 17 PRO O O -5.658 6.877 -6.506 1.00 . A A . 17 PRO O 1 1 10 17168 1 1 18 VAL C C -6.156 6.399 -2.465 1.00 . A A . 18 VAL C 1 1 10 17169 1 1 18 VAL CA C -5.584 6.073 -3.846 1.00 . A A . 18 VAL CA 1 1 10 17170 1 1 18 VAL CB C -4.592 4.909 -3.823 1.00 . A A . 18 VAL CB 1 1 10 17171 1 1 18 VAL CG1 C -5.164 3.716 -3.054 1.00 . A A . 18 VAL CG1 1 1 10 17172 1 1 18 VAL CG2 C -4.188 4.504 -5.242 1.00 . A A . 18 VAL CG2 1 1 10 17173 1 1 18 VAL H H -4.445 7.814 -3.730 1.00 . A A . 18 VAL H 1 1 10 17174 1 1 18 VAL HA H -6.405 5.804 -4.511 1.00 . A A . 18 VAL HA 1 1 10 17175 1 1 18 VAL HB H -3.695 5.244 -3.303 1.00 . A A . 18 VAL HB 1 1 10 17176 1 1 18 VAL HG11 H -5.471 4.039 -2.059 1.00 . A A . 18 VAL HG11 1 1 10 17177 1 1 18 VAL HG12 H -6.027 3.319 -3.589 1.00 . A A . 18 VAL HG12 1 1 10 17178 1 1 18 VAL HG13 H -4.402 2.941 -2.967 1.00 . A A . 18 VAL HG13 1 1 10 17179 1 1 18 VAL HG21 H -5.028 4.666 -5.919 1.00 . A A . 18 VAL HG21 1 1 10 17180 1 1 18 VAL HG22 H -3.340 5.108 -5.565 1.00 . A A . 18 VAL HG22 1 1 10 17181 1 1 18 VAL HG23 H -3.909 3.451 -5.254 1.00 . A A . 18 VAL HG23 1 1 10 17182 1 1 18 VAL N N -4.947 7.259 -4.394 1.00 . A A . 18 VAL N 1 1 10 17183 1 1 18 VAL O O -5.587 7.202 -1.727 1.00 . A A . 18 VAL O 1 1 10 17184 1 1 19 VAL C C -7.853 4.686 -0.051 1.00 . A A . 19 VAL C 1 1 10 17185 1 1 19 VAL CA C -7.931 5.971 -0.878 1.00 . A A . 19 VAL CA 1 1 10 17186 1 1 19 VAL CB C -9.365 6.454 -1.099 1.00 . A A . 19 VAL CB 1 1 10 17187 1 1 19 VAL CG1 C -10.168 6.401 0.202 1.00 . A A . 19 VAL CG1 1 1 10 17188 1 1 19 VAL CG2 C -9.384 7.862 -1.698 1.00 . A A . 19 VAL CG2 1 1 10 17189 1 1 19 VAL H H -7.731 5.108 -2.763 1.00 . A A . 19 VAL H 1 1 10 17190 1 1 19 VAL HA H -7.386 6.758 -0.356 1.00 . A A . 19 VAL HA 1 1 10 17191 1 1 19 VAL HB H -9.840 5.780 -1.813 1.00 . A A . 19 VAL HB 1 1 10 17192 1 1 19 VAL HG11 H -10.087 5.406 0.639 1.00 . A A . 19 VAL HG11 1 1 10 17193 1 1 19 VAL HG12 H -9.774 7.138 0.902 1.00 . A A . 19 VAL HG12 1 1 10 17194 1 1 19 VAL HG13 H -11.215 6.622 -0.007 1.00 . A A . 19 VAL HG13 1 1 10 17195 1 1 19 VAL HG21 H -8.373 8.146 -1.989 1.00 . A A . 19 VAL HG21 1 1 10 17196 1 1 19 VAL HG22 H -10.032 7.875 -2.575 1.00 . A A . 19 VAL HG22 1 1 10 17197 1 1 19 VAL HG23 H -9.760 8.567 -0.957 1.00 . A A . 19 VAL HG23 1 1 10 17198 1 1 19 VAL N N -7.275 5.759 -2.157 1.00 . A A . 19 VAL N 1 1 10 17199 1 1 19 VAL O O -8.425 3.665 -0.429 1.00 . A A . 19 VAL O 1 1 10 17200 1 1 20 PHE C C -7.846 3.786 3.198 1.00 . A A . 20 PHE C 1 1 10 17201 1 1 20 PHE CA C -6.980 3.636 1.945 1.00 . A A . 20 PHE CA 1 1 10 17202 1 1 20 PHE CB C -5.507 3.624 2.356 1.00 . A A . 20 PHE CB 1 1 10 17203 1 1 20 PHE CD1 C -4.854 1.209 2.672 1.00 . A A . 20 PHE CD1 1 1 10 17204 1 1 20 PHE CD2 C -5.030 2.599 4.610 1.00 . A A . 20 PHE CD2 1 1 10 17205 1 1 20 PHE CE1 C -4.487 0.094 3.506 1.00 . A A . 20 PHE CE1 1 1 10 17206 1 1 20 PHE CE2 C -4.663 1.483 5.443 1.00 . A A . 20 PHE CE2 1 1 10 17207 1 1 20 PHE CG C -5.117 2.439 3.242 1.00 . A A . 20 PHE CG 1 1 10 17208 1 1 20 PHE CZ C -4.410 0.285 4.850 1.00 . A A . 20 PHE CZ 1 1 10 17209 1 1 20 PHE H H -6.678 5.613 1.362 1.00 . A A . 20 PHE H 1 1 10 17210 1 1 20 PHE HA H -7.292 2.744 1.401 1.00 . A A . 20 PHE HA 1 1 10 17211 1 1 20 PHE HB2 H -4.889 3.612 1.458 1.00 . A A . 20 PHE HB2 1 1 10 17212 1 1 20 PHE HB3 H -5.280 4.550 2.886 1.00 . A A . 20 PHE HB3 1 1 10 17213 1 1 20 PHE HD1 H -4.924 1.083 1.592 1.00 . A A . 20 PHE HD1 1 1 10 17214 1 1 20 PHE HD2 H -5.238 3.569 5.059 1.00 . A A . 20 PHE HD2 1 1 10 17215 1 1 20 PHE HE1 H -4.277 -0.883 3.069 1.00 . A A . 20 PHE HE1 1 1 10 17216 1 1 20 PHE HE2 H -4.590 1.595 6.525 1.00 . A A . 20 PHE HE2 1 1 10 17217 1 1 20 PHE HZ H -4.155 -0.522 5.582 1.00 . A A . 20 PHE HZ 1 1 10 17218 1 1 20 PHE N N -7.140 4.779 1.062 1.00 . A A . 20 PHE N 1 1 10 17219 1 1 20 PHE O O -8.303 4.883 3.513 1.00 . A A . 20 PHE O 1 1 10 17220 1 1 21 ASN C C -8.215 1.713 6.110 1.00 . A A . 21 ASN C 1 1 10 17221 1 1 21 ASN CA C -8.849 2.659 5.089 1.00 . A A . 21 ASN CA 1 1 10 17222 1 1 21 ASN CB C -10.269 2.165 4.805 1.00 . A A . 21 ASN CB 1 1 10 17223 1 1 21 ASN CG C -11.049 3.187 3.974 1.00 . A A . 21 ASN CG 1 1 10 17224 1 1 21 ASN H H -7.670 1.778 3.614 1.00 . A A . 21 ASN H 1 1 10 17225 1 1 21 ASN HA H -8.861 3.694 5.430 1.00 . A A . 21 ASN HA 1 1 10 17226 1 1 21 ASN HB2 H -10.228 1.215 4.273 1.00 . A A . 21 ASN HB2 1 1 10 17227 1 1 21 ASN HB3 H -10.789 1.983 5.745 1.00 . A A . 21 ASN HB3 1 1 10 17228 1 1 21 ASN HD21 H -10.186 2.423 2.310 1.00 . A A . 21 ASN HD21 1 1 10 17229 1 1 21 ASN HD22 H -11.284 3.734 2.039 1.00 . A A . 21 ASN HD22 1 1 10 17230 1 1 21 ASN N N -8.046 2.666 3.878 1.00 . A A . 21 ASN N 1 1 10 17231 1 1 21 ASN ND2 N -10.821 3.108 2.666 1.00 . A A . 21 ASN ND2 1 1 10 17232 1 1 21 ASN O O -7.639 0.690 5.741 1.00 . A A . 21 ASN O 1 1 10 17233 1 1 21 ASN OD1 O -11.807 3.993 4.487 1.00 . A A . 21 ASN OD1 1 1 10 17234 1 1 22 HIS C C -8.884 0.403 9.050 1.00 . A A . 22 HIS C 1 1 10 17235 1 1 22 HIS CA C -7.788 1.286 8.452 1.00 . A A . 22 HIS CA 1 1 10 17236 1 1 22 HIS CB C -7.106 2.174 9.495 1.00 . A A . 22 HIS CB 1 1 10 17237 1 1 22 HIS CD2 C -4.505 1.939 9.384 1.00 . A A . 22 HIS CD2 1 1 10 17238 1 1 22 HIS CE1 C -4.072 3.785 8.292 1.00 . A A . 22 HIS CE1 1 1 10 17239 1 1 22 HIS CG C -5.692 2.565 9.139 1.00 . A A . 22 HIS CG 1 1 10 17240 1 1 22 HIS H H -8.811 2.921 7.666 1.00 . A A . 22 HIS H 1 1 10 17241 1 1 22 HIS HA H -7.023 0.649 8.007 1.00 . A A . 22 HIS HA 1 1 10 17242 1 1 22 HIS HB2 H -7.700 3.078 9.631 1.00 . A A . 22 HIS HB2 1 1 10 17243 1 1 22 HIS HB3 H -7.098 1.651 10.452 1.00 . A A . 22 HIS HB3 1 1 10 17244 1 1 22 HIS HD1 H -6.046 4.405 8.126 1.00 . A A . 22 HIS HD1 1 1 10 17245 1 1 22 HIS HD2 H -4.381 0.993 9.912 1.00 . A A . 22 HIS HD2 1 1 10 17246 1 1 22 HIS HE1 H -3.523 4.580 7.788 1.00 . A A . 22 HIS HE1 1 1 10 17247 1 1 22 HIS N N -8.342 2.088 7.375 1.00 . A A . 22 HIS N 1 1 10 17248 1 1 22 HIS ND1 N -5.387 3.726 8.450 1.00 . A A . 22 HIS ND1 1 1 10 17249 1 1 22 HIS NE2 N -3.528 2.676 8.872 1.00 . A A . 22 HIS NE2 1 1 10 17250 1 1 22 HIS O O -8.597 -0.646 9.625 1.00 . A A . 22 HIS O 1 1 10 17251 1 1 23 SER C C -11.515 -1.117 8.556 1.00 . A A . 23 SER C 1 1 10 17252 1 1 23 SER CA C -11.260 0.125 9.413 1.00 . A A . 23 SER CA 1 1 10 17253 1 1 23 SER CB C -12.509 1.007 9.456 1.00 . A A . 23 SER CB 1 1 10 17254 1 1 23 SER H H -10.343 1.714 8.426 1.00 . A A . 23 SER H 1 1 10 17255 1 1 23 SER HA H -10.982 -0.161 10.428 1.00 . A A . 23 SER HA 1 1 10 17256 1 1 23 SER HB2 H -12.705 1.407 8.462 1.00 . A A . 23 SER HB2 1 1 10 17257 1 1 23 SER HB3 H -13.372 0.400 9.731 1.00 . A A . 23 SER HB3 1 1 10 17258 1 1 23 SER HG H -11.528 2.586 10.197 1.00 . A A . 23 SER HG 1 1 10 17259 1 1 23 SER N N -10.118 0.860 8.895 1.00 . A A . 23 SER N 1 1 10 17260 1 1 23 SER O O -12.391 -1.922 8.869 1.00 . A A . 23 SER O 1 1 10 17261 1 1 23 SER OG O -12.372 2.082 10.381 1.00 . A A . 23 SER OG 1 1 10 17262 1 1 24 THR C C -9.731 -3.362 6.814 1.00 . A A . 24 THR C 1 1 10 17263 1 1 24 THR CA C -10.866 -2.362 6.587 1.00 . A A . 24 THR CA 1 1 10 17264 1 1 24 THR CB C -10.921 -1.819 5.158 1.00 . A A . 24 THR CB 1 1 10 17265 1 1 24 THR CG2 C -11.098 -2.927 4.117 1.00 . A A . 24 THR CG2 1 1 10 17266 1 1 24 THR H H -10.025 -0.573 7.244 1.00 . A A . 24 THR H 1 1 10 17267 1 1 24 THR HA H -11.799 -2.879 6.816 1.00 . A A . 24 THR HA 1 1 10 17268 1 1 24 THR HB H -10.042 -1.214 4.937 1.00 . A A . 24 THR HB 1 1 10 17269 1 1 24 THR HG1 H -12.909 -1.696 5.355 1.00 . A A . 24 THR HG1 1 1 10 17270 1 1 24 THR HG21 H -11.291 -3.873 4.622 1.00 . A A . 24 THR HG21 1 1 10 17271 1 1 24 THR HG22 H -11.939 -2.684 3.467 1.00 . A A . 24 THR HG22 1 1 10 17272 1 1 24 THR HG23 H -10.190 -3.012 3.520 1.00 . A A . 24 THR HG23 1 1 10 17273 1 1 24 THR N N -10.735 -1.232 7.492 1.00 . A A . 24 THR N 1 1 10 17274 1 1 24 THR O O -9.919 -4.567 6.653 1.00 . A A . 24 THR O 1 1 10 17275 1 1 24 THR OG1 O -12.148 -1.096 5.107 1.00 . A A . 24 THR OG1 1 1 10 17276 1 1 25 HIS C C -7.227 -3.838 8.943 1.00 . A A . 25 HIS C 1 1 10 17277 1 1 25 HIS CA C -7.412 -3.655 7.435 1.00 . A A . 25 HIS CA 1 1 10 17278 1 1 25 HIS CB C -6.173 -3.073 6.752 1.00 . A A . 25 HIS CB 1 1 10 17279 1 1 25 HIS CD2 C -5.792 -3.712 4.246 1.00 . A A . 25 HIS CD2 1 1 10 17280 1 1 25 HIS CE1 C -6.947 -2.094 3.332 1.00 . A A . 25 HIS CE1 1 1 10 17281 1 1 25 HIS CG C -6.302 -2.946 5.253 1.00 . A A . 25 HIS CG 1 1 10 17282 1 1 25 HIS H H -8.434 -1.844 7.314 1.00 . A A . 25 HIS H 1 1 10 17283 1 1 25 HIS HA H -7.616 -4.626 6.983 1.00 . A A . 25 HIS HA 1 1 10 17284 1 1 25 HIS HB2 H -5.967 -2.089 7.173 1.00 . A A . 25 HIS HB2 1 1 10 17285 1 1 25 HIS HB3 H -5.314 -3.704 6.980 1.00 . A A . 25 HIS HB3 1 1 10 17286 1 1 25 HIS HD1 H -7.521 -1.205 5.117 1.00 . A A . 25 HIS HD1 1 1 10 17287 1 1 25 HIS HD2 H -5.169 -4.598 4.373 1.00 . A A . 25 HIS HD2 1 1 10 17288 1 1 25 HIS HE1 H -7.412 -1.457 2.580 1.00 . A A . 25 HIS HE1 1 1 10 17289 1 1 25 HIS N N -8.578 -2.825 7.185 1.00 . A A . 25 HIS N 1 1 10 17290 1 1 25 HIS ND1 N -7.024 -1.934 4.645 1.00 . A A . 25 HIS ND1 1 1 10 17291 1 1 25 HIS NE2 N -6.183 -3.197 3.087 1.00 . A A . 25 HIS NE2 1 1 10 17292 1 1 25 HIS O O -6.099 -3.901 9.430 1.00 . A A . 25 HIS O 1 1 10 17293 1 1 26 LYS C C -7.776 -5.481 11.415 1.00 . A A . 26 LYS C 1 1 10 17294 1 1 26 LYS CA C -8.326 -4.092 11.082 1.00 . A A . 26 LYS CA 1 1 10 17295 1 1 26 LYS CB C -9.709 -3.820 11.678 1.00 . A A . 26 LYS CB 1 1 10 17296 1 1 26 LYS CD C -11.635 -2.197 11.803 1.00 . A A . 26 LYS CD 1 1 10 17297 1 1 26 LYS CE C -11.552 -1.375 13.090 1.00 . A A . 26 LYS CE 1 1 10 17298 1 1 26 LYS CG C -10.241 -2.458 11.228 1.00 . A A . 26 LYS CG 1 1 10 17299 1 1 26 LYS H H -9.264 -3.867 9.235 1.00 . A A . 26 LYS H 1 1 10 17300 1 1 26 LYS HA H -7.647 -3.344 11.490 1.00 . A A . 26 LYS HA 1 1 10 17301 1 1 26 LYS HB2 H -10.402 -4.604 11.373 1.00 . A A . 26 LYS HB2 1 1 10 17302 1 1 26 LYS HB3 H -9.653 -3.851 12.766 1.00 . A A . 26 LYS HB3 1 1 10 17303 1 1 26 LYS HD2 H -12.242 -1.668 11.068 1.00 . A A . 26 LYS HD2 1 1 10 17304 1 1 26 LYS HD3 H -12.133 -3.145 12.004 1.00 . A A . 26 LYS HD3 1 1 10 17305 1 1 26 LYS HE2 H -10.663 -1.659 13.654 1.00 . A A . 26 LYS HE2 1 1 10 17306 1 1 26 LYS HE3 H -11.450 -0.317 12.848 1.00 . A A . 26 LYS HE3 1 1 10 17307 1 1 26 LYS HG2 H -9.558 -1.672 11.550 1.00 . A A . 26 LYS HG2 1 1 10 17308 1 1 26 LYS HG3 H -10.280 -2.420 10.139 1.00 . A A . 26 LYS HG3 1 1 10 17309 1 1 26 LYS HZ1 H -13.104 -0.719 14.316 1.00 . A A . 26 LYS HZ1 1 1 10 17310 1 1 26 LYS HZ2 H -13.522 -1.987 13.384 1.00 . A A . 26 LYS HZ2 1 1 10 17311 1 1 26 LYS N N -8.351 -3.918 9.639 1.00 . A A . 26 LYS N 1 1 10 17312 1 1 26 LYS NZ N -12.760 -1.586 13.919 1.00 . A A . 26 LYS NZ 1 1 10 17313 1 1 26 LYS O O -6.954 -5.626 12.318 1.00 . A A . 26 LYS O 1 1 10 17314 1 1 27 SER C C -6.340 -7.980 10.498 1.00 . A A . 27 SER C 1 1 10 17315 1 1 27 SER CA C -7.818 -7.837 10.871 1.00 . A A . 27 SER CA 1 1 10 17316 1 1 27 SER CB C -8.668 -8.811 10.053 1.00 . A A . 27 SER CB 1 1 10 17317 1 1 27 SER H H -8.919 -6.338 9.933 1.00 . A A . 27 SER H 1 1 10 17318 1 1 27 SER HA H -7.964 -8.031 11.934 1.00 . A A . 27 SER HA 1 1 10 17319 1 1 27 SER HB2 H -8.522 -9.824 10.431 1.00 . A A . 27 SER HB2 1 1 10 17320 1 1 27 SER HB3 H -9.723 -8.571 10.185 1.00 . A A . 27 SER HB3 1 1 10 17321 1 1 27 SER HG H -7.362 -8.924 8.541 1.00 . A A . 27 SER HG 1 1 10 17322 1 1 27 SER N N -8.251 -6.465 10.667 1.00 . A A . 27 SER N 1 1 10 17323 1 1 27 SER O O -5.706 -8.979 10.834 1.00 . A A . 27 SER O 1 1 10 17324 1 1 27 SER OG O -8.342 -8.771 8.667 1.00 . A A . 27 SER OG 1 1 10 17325 1 1 28 VAL C C -3.580 -6.365 10.497 1.00 . A A . 28 VAL C 1 1 10 17326 1 1 28 VAL CA C -4.446 -6.967 9.387 1.00 . A A . 28 VAL CA 1 1 10 17327 1 1 28 VAL CB C -4.304 -6.231 8.053 1.00 . A A . 28 VAL CB 1 1 10 17328 1 1 28 VAL CG1 C -2.887 -6.378 7.495 1.00 . A A . 28 VAL CG1 1 1 10 17329 1 1 28 VAL CG2 C -5.345 -6.721 7.044 1.00 . A A . 28 VAL CG2 1 1 10 17330 1 1 28 VAL H H -6.359 -6.157 9.541 1.00 . A A . 28 VAL H 1 1 10 17331 1 1 28 VAL HA H -4.149 -8.004 9.234 1.00 . A A . 28 VAL HA 1 1 10 17332 1 1 28 VAL HB H -4.485 -5.172 8.234 1.00 . A A . 28 VAL HB 1 1 10 17333 1 1 28 VAL HG11 H -2.564 -7.414 7.591 1.00 . A A . 28 VAL HG11 1 1 10 17334 1 1 28 VAL HG12 H -2.880 -6.091 6.443 1.00 . A A . 28 VAL HG12 1 1 10 17335 1 1 28 VAL HG13 H -2.208 -5.732 8.052 1.00 . A A . 28 VAL HG13 1 1 10 17336 1 1 28 VAL HG21 H -5.727 -7.692 7.359 1.00 . A A . 28 VAL HG21 1 1 10 17337 1 1 28 VAL HG22 H -6.167 -6.006 6.994 1.00 . A A . 28 VAL HG22 1 1 10 17338 1 1 28 VAL HG23 H -4.883 -6.813 6.061 1.00 . A A . 28 VAL HG23 1 1 10 17339 1 1 28 VAL N N -5.836 -6.966 9.810 1.00 . A A . 28 VAL N 1 1 10 17340 1 1 28 VAL O O -3.994 -5.421 11.168 1.00 . A A . 28 VAL O 1 1 10 17341 1 1 29 LYS C C -0.838 -5.153 11.213 1.00 . A A . 29 LYS C 1 1 10 17342 1 1 29 LYS CA C -1.469 -6.469 11.671 1.00 . A A . 29 LYS CA 1 1 10 17343 1 1 29 LYS CB C -0.447 -7.557 12.006 1.00 . A A . 29 LYS CB 1 1 10 17344 1 1 29 LYS CD C -0.335 -9.532 13.570 1.00 . A A . 29 LYS CD 1 1 10 17345 1 1 29 LYS CE C -0.234 -9.958 15.036 1.00 . A A . 29 LYS CE 1 1 10 17346 1 1 29 LYS CG C -0.604 -8.031 13.452 1.00 . A A . 29 LYS CG 1 1 10 17347 1 1 29 LYS H H -2.067 -7.704 10.104 1.00 . A A . 29 LYS H 1 1 10 17348 1 1 29 LYS HA H -2.045 -6.279 12.576 1.00 . A A . 29 LYS HA 1 1 10 17349 1 1 29 LYS HB2 H -0.573 -8.401 11.328 1.00 . A A . 29 LYS HB2 1 1 10 17350 1 1 29 LYS HB3 H 0.562 -7.174 11.852 1.00 . A A . 29 LYS HB3 1 1 10 17351 1 1 29 LYS HD2 H -1.134 -10.088 13.080 1.00 . A A . 29 LYS HD2 1 1 10 17352 1 1 29 LYS HD3 H 0.591 -9.781 13.051 1.00 . A A . 29 LYS HD3 1 1 10 17353 1 1 29 LYS HE2 H 0.025 -11.014 15.097 1.00 . A A . 29 LYS HE2 1 1 10 17354 1 1 29 LYS HE3 H 0.566 -9.404 15.528 1.00 . A A . 29 LYS HE3 1 1 10 17355 1 1 29 LYS HG2 H 0.085 -7.482 14.095 1.00 . A A . 29 LYS HG2 1 1 10 17356 1 1 29 LYS HG3 H -1.612 -7.809 13.804 1.00 . A A . 29 LYS HG3 1 1 10 17357 1 1 29 LYS HZ1 H -2.200 -10.436 15.536 1.00 . A A . 29 LYS HZ1 1 1 10 17358 1 1 29 LYS HZ2 H -1.401 -9.689 16.743 1.00 . A A . 29 LYS HZ2 1 1 10 17359 1 1 29 LYS N N -2.396 -6.937 10.655 1.00 . A A . 29 LYS N 1 1 10 17360 1 1 29 LYS NZ N -1.516 -9.715 15.735 1.00 . A A . 29 LYS NZ 1 1 10 17361 1 1 29 LYS O O -0.539 -4.982 10.032 1.00 . A A . 29 LYS O 1 1 10 17362 1 1 30 CYS C C 1.363 -3.184 11.376 1.00 . A A . 30 CYS C 1 1 10 17363 1 1 30 CYS CA C -0.064 -2.961 11.880 1.00 . A A . 30 CYS CA 1 1 10 17364 1 1 30 CYS CB C -0.101 -2.036 13.099 1.00 . A A . 30 CYS CB 1 1 10 17365 1 1 30 CYS H H -0.899 -4.403 13.129 1.00 . A A . 30 CYS H 1 1 10 17366 1 1 30 CYS HA H -0.680 -2.503 11.106 1.00 . A A . 30 CYS HA 1 1 10 17367 1 1 30 CYS HB2 H 0.747 -2.272 13.742 1.00 . A A . 30 CYS HB2 1 1 10 17368 1 1 30 CYS HB3 H 0.032 -1.008 12.762 1.00 . A A . 30 CYS HB3 1 1 10 17369 1 1 30 CYS N N -0.654 -4.256 12.171 1.00 . A A . 30 CYS N 1 1 10 17370 1 1 30 CYS O O 1.856 -2.429 10.540 1.00 . A A . 30 CYS O 1 1 10 17371 1 1 30 CYS SG S -1.635 -2.135 14.091 1.00 . A A . 30 CYS SG 1 1 10 17372 1 1 31 GLY C C 3.381 -5.235 10.150 1.00 . A A . 31 GLY C 1 1 10 17373 1 1 31 GLY CA C 3.349 -4.558 11.522 1.00 . A A . 31 GLY CA 1 1 10 17374 1 1 31 GLY H H 1.580 -4.835 12.587 1.00 . A A . 31 GLY H 1 1 10 17375 1 1 31 GLY HA2 H 3.955 -3.653 11.499 1.00 . A A . 31 GLY HA2 1 1 10 17376 1 1 31 GLY HA3 H 3.790 -5.219 12.268 1.00 . A A . 31 GLY HA3 1 1 10 17377 1 1 31 GLY N N 1.988 -4.226 11.907 1.00 . A A . 31 GLY N 1 1 10 17378 1 1 31 GLY O O 4.452 -5.543 9.631 1.00 . A A . 31 GLY O 1 1 10 17379 1 1 32 ASP C C 2.277 -5.033 7.206 1.00 . A A . 32 ASP C 1 1 10 17380 1 1 32 ASP CA C 2.071 -6.081 8.301 1.00 . A A . 32 ASP CA 1 1 10 17381 1 1 32 ASP CB C 0.682 -6.693 8.115 1.00 . A A . 32 ASP CB 1 1 10 17382 1 1 32 ASP CG C 0.541 -7.624 6.908 1.00 . A A . 32 ASP CG 1 1 10 17383 1 1 32 ASP H H 1.326 -5.193 10.031 1.00 . A A . 32 ASP H 1 1 10 17384 1 1 32 ASP HA H 2.839 -6.855 8.287 1.00 . A A . 32 ASP HA 1 1 10 17385 1 1 32 ASP HB2 H 0.422 -7.249 9.015 1.00 . A A . 32 ASP HB2 1 1 10 17386 1 1 32 ASP HB3 H -0.045 -5.886 8.018 1.00 . A A . 32 ASP HB3 1 1 10 17387 1 1 32 ASP N N 2.193 -5.446 9.602 1.00 . A A . 32 ASP N 1 1 10 17388 1 1 32 ASP O O 2.790 -5.345 6.132 1.00 . A A . 32 ASP O 1 1 10 17389 1 1 32 ASP OD1 O 1.003 -7.216 5.820 1.00 . A A . 32 ASP OD1 1 1 10 17390 1 1 32 ASP OD2 O -0.024 -8.721 7.101 1.00 . A A . 32 ASP OD2 1 1 10 17391 1 1 33 CYS C C 3.132 -1.805 7.048 1.00 . A A . 33 CYS C 1 1 10 17392 1 1 33 CYS CA C 1.999 -2.716 6.570 1.00 . A A . 33 CYS CA 1 1 10 17393 1 1 33 CYS CB C 0.684 -1.952 6.402 1.00 . A A . 33 CYS CB 1 1 10 17394 1 1 33 CYS H H 1.451 -3.567 8.391 1.00 . A A . 33 CYS H 1 1 10 17395 1 1 33 CYS HA H 2.242 -3.162 5.606 1.00 . A A . 33 CYS HA 1 1 10 17396 1 1 33 CYS HB2 H 0.107 -1.997 7.325 1.00 . A A . 33 CYS HB2 1 1 10 17397 1 1 33 CYS HB3 H 0.889 -0.900 6.205 1.00 . A A . 33 CYS HB3 1 1 10 17398 1 1 33 CYS N N 1.867 -3.812 7.515 1.00 . A A . 33 CYS N 1 1 10 17399 1 1 33 CYS O O 4.083 -1.552 6.310 1.00 . A A . 33 CYS O 1 1 10 17400 1 1 33 CYS SG S -0.283 -2.669 5.024 1.00 . A A . 33 CYS SG 1 1 10 17401 1 1 34 HIS C C 5.214 -1.278 9.280 1.00 . A A . 34 HIS C 1 1 10 17402 1 1 34 HIS CA C 3.992 -0.458 8.863 1.00 . A A . 34 HIS CA 1 1 10 17403 1 1 34 HIS CB C 3.397 0.349 10.019 1.00 . A A . 34 HIS CB 1 1 10 17404 1 1 34 HIS CD2 C 0.890 1.031 9.729 1.00 . A A . 34 HIS CD2 1 1 10 17405 1 1 34 HIS CE1 C 1.204 2.989 8.805 1.00 . A A . 34 HIS CE1 1 1 10 17406 1 1 34 HIS CG C 2.235 1.228 9.620 1.00 . A A . 34 HIS CG 1 1 10 17407 1 1 34 HIS H H 2.216 -1.547 8.873 1.00 . A A . 34 HIS H 1 1 10 17408 1 1 34 HIS HA H 4.285 0.245 8.083 1.00 . A A . 34 HIS HA 1 1 10 17409 1 1 34 HIS HB2 H 3.068 -0.339 10.798 1.00 . A A . 34 HIS HB2 1 1 10 17410 1 1 34 HIS HB3 H 4.178 0.972 10.454 1.00 . A A . 34 HIS HB3 1 1 10 17411 1 1 34 HIS HD1 H 3.277 2.903 8.818 1.00 . A A . 34 HIS HD1 1 1 10 17412 1 1 34 HIS HD2 H 0.407 0.148 10.150 1.00 . A A . 34 HIS HD2 1 1 10 17413 1 1 34 HIS HE1 H 1.002 3.959 8.350 1.00 . A A . 34 HIS HE1 1 1 10 17414 1 1 34 HIS N N 2.992 -1.336 8.279 1.00 . A A . 34 HIS N 1 1 10 17415 1 1 34 HIS ND1 N 2.402 2.470 9.033 1.00 . A A . 34 HIS ND1 1 1 10 17416 1 1 34 HIS NE2 N 0.269 2.095 9.237 1.00 . A A . 34 HIS NE2 1 1 10 17417 1 1 34 HIS O O 5.589 -1.288 10.452 1.00 . A A . 34 HIS O 1 1 10 17418 1 1 35 HIS C C 7.948 -2.009 9.453 1.00 . A A . 35 HIS C 1 1 10 17419 1 1 35 HIS CA C 6.974 -2.767 8.549 1.00 . A A . 35 HIS CA 1 1 10 17420 1 1 35 HIS CB C 7.614 -3.216 7.234 1.00 . A A . 35 HIS CB 1 1 10 17421 1 1 35 HIS CD2 C 7.763 -1.486 5.280 1.00 . A A . 35 HIS CD2 1 1 10 17422 1 1 35 HIS CE1 C 9.638 -0.520 5.861 1.00 . A A . 35 HIS CE1 1 1 10 17423 1 1 35 HIS CG C 8.205 -2.089 6.421 1.00 . A A . 35 HIS CG 1 1 10 17424 1 1 35 HIS H H 5.491 -1.932 7.348 1.00 . A A . 35 HIS H 1 1 10 17425 1 1 35 HIS HA H 6.626 -3.658 9.071 1.00 . A A . 35 HIS HA 1 1 10 17426 1 1 35 HIS HB2 H 8.397 -3.942 7.452 1.00 . A A . 35 HIS HB2 1 1 10 17427 1 1 35 HIS HB3 H 6.863 -3.729 6.633 1.00 . A A . 35 HIS HB3 1 1 10 17428 1 1 35 HIS HD1 H 9.959 -1.675 7.555 1.00 . A A . 35 HIS HD1 1 1 10 17429 1 1 35 HIS HD2 H 6.853 -1.740 4.737 1.00 . A A . 35 HIS HD2 1 1 10 17430 1 1 35 HIS HE1 H 10.498 0.149 5.854 1.00 . A A . 35 HIS HE1 1 1 10 17431 1 1 35 HIS N N 5.802 -1.946 8.299 1.00 . A A . 35 HIS N 1 1 10 17432 1 1 35 HIS ND1 N 9.388 -1.459 6.763 1.00 . A A . 35 HIS ND1 1 1 10 17433 1 1 35 HIS NE2 N 8.629 -0.538 4.943 1.00 . A A . 35 HIS NE2 1 1 10 17434 1 1 35 HIS O O 8.012 -0.781 9.412 1.00 . A A . 35 HIS O 1 1 10 17435 1 1 36 PRO C C 10.915 -1.732 10.431 1.00 . A A . 36 PRO C 1 1 10 17436 1 1 36 PRO CA C 9.670 -2.208 11.183 1.00 . A A . 36 PRO CA 1 1 10 17437 1 1 36 PRO CB C 9.969 -3.303 12.194 1.00 . A A . 36 PRO CB 1 1 10 17438 1 1 36 PRO CD C 8.654 -4.249 10.345 1.00 . A A . 36 PRO CD 1 1 10 17439 1 1 36 PRO CG C 9.517 -4.602 11.546 1.00 . A A . 36 PRO CG 1 1 10 17440 1 1 36 PRO HA H 9.288 -1.394 11.620 1.00 . A A . 36 PRO HA 1 1 10 17441 1 1 36 PRO HB2 H 11.031 -3.335 12.433 1.00 . A A . 36 PRO HB2 1 1 10 17442 1 1 36 PRO HB3 H 9.436 -3.127 13.128 1.00 . A A . 36 PRO HB3 1 1 10 17443 1 1 36 PRO HD2 H 9.039 -4.706 9.434 1.00 . A A . 36 PRO HD2 1 1 10 17444 1 1 36 PRO HD3 H 7.632 -4.606 10.474 1.00 . A A . 36 PRO HD3 1 1 10 17445 1 1 36 PRO HG2 H 10.379 -5.194 11.236 1.00 . A A . 36 PRO HG2 1 1 10 17446 1 1 36 PRO HG3 H 8.954 -5.207 12.256 1.00 . A A . 36 PRO HG3 1 1 10 17447 1 1 36 PRO N N 8.703 -2.792 10.270 1.00 . A A . 36 PRO N 1 1 10 17448 1 1 36 PRO O O 11.513 -2.492 9.670 1.00 . A A . 36 PRO O 1 1 10 17449 1 1 37 VAL C C 13.455 0.507 11.094 1.00 . A A . 37 VAL C 1 1 10 17450 1 1 37 VAL CA C 12.433 0.107 10.027 1.00 . A A . 37 VAL CA 1 1 10 17451 1 1 37 VAL CB C 12.005 1.278 9.140 1.00 . A A . 37 VAL CB 1 1 10 17452 1 1 37 VAL CG1 C 13.216 1.926 8.467 1.00 . A A . 37 VAL CG1 1 1 10 17453 1 1 37 VAL CG2 C 10.974 0.831 8.102 1.00 . A A . 37 VAL CG2 1 1 10 17454 1 1 37 VAL H H 10.779 0.132 11.293 1.00 . A A . 37 VAL H 1 1 10 17455 1 1 37 VAL HA H 12.874 -0.657 9.387 1.00 . A A . 37 VAL HA 1 1 10 17456 1 1 37 VAL HB H 11.535 2.027 9.778 1.00 . A A . 37 VAL HB 1 1 10 17457 1 1 37 VAL HG11 H 13.895 1.150 8.113 1.00 . A A . 37 VAL HG11 1 1 10 17458 1 1 37 VAL HG12 H 12.883 2.529 7.622 1.00 . A A . 37 VAL HG12 1 1 10 17459 1 1 37 VAL HG13 H 13.734 2.562 9.185 1.00 . A A . 37 VAL HG13 1 1 10 17460 1 1 37 VAL HG21 H 11.218 -0.173 7.757 1.00 . A A . 37 VAL HG21 1 1 10 17461 1 1 37 VAL HG22 H 9.982 0.830 8.553 1.00 . A A . 37 VAL HG22 1 1 10 17462 1 1 37 VAL HG23 H 10.988 1.520 7.257 1.00 . A A . 37 VAL HG23 1 1 10 17463 1 1 37 VAL N N 11.270 -0.479 10.672 1.00 . A A . 37 VAL N 1 1 10 17464 1 1 37 VAL O O 13.167 1.339 11.952 1.00 . A A . 37 VAL O 1 1 10 17465 1 1 38 ASN C C 15.467 -0.643 13.223 1.00 . A A . 38 ASN C 1 1 10 17466 1 1 38 ASN CA C 15.692 0.176 11.951 1.00 . A A . 38 ASN CA 1 1 10 17467 1 1 38 ASN CB C 15.709 1.656 12.337 1.00 . A A . 38 ASN CB 1 1 10 17468 1 1 38 ASN CG C 17.136 2.137 12.606 1.00 . A A . 38 ASN CG 1 1 10 17469 1 1 38 ASN H H 14.852 -0.781 10.302 1.00 . A A . 38 ASN H 1 1 10 17470 1 1 38 ASN HA H 16.612 -0.098 11.435 1.00 . A A . 38 ASN HA 1 1 10 17471 1 1 38 ASN HB2 H 15.266 2.250 11.538 1.00 . A A . 38 ASN HB2 1 1 10 17472 1 1 38 ASN HB3 H 15.096 1.811 13.226 1.00 . A A . 38 ASN HB3 1 1 10 17473 1 1 38 ASN HD21 H 16.380 3.534 13.860 1.00 . A A . 38 ASN HD21 1 1 10 17474 1 1 38 ASN HD22 H 18.104 3.540 13.698 1.00 . A A . 38 ASN HD22 1 1 10 17475 1 1 38 ASN N N 14.626 -0.105 11.004 1.00 . A A . 38 ASN N 1 1 10 17476 1 1 38 ASN ND2 N 17.213 3.154 13.459 1.00 . A A . 38 ASN ND2 1 1 10 17477 1 1 38 ASN O O 16.270 -0.584 14.154 1.00 . A A . 38 ASN O 1 1 10 17478 1 1 38 ASN OD1 O 18.104 1.618 12.074 1.00 . A A . 38 ASN OD1 1 1 10 17479 1 1 39 GLY C C 12.944 -1.556 15.219 1.00 . A A . 39 GLY C 1 1 10 17480 1 1 39 GLY CA C 14.030 -2.217 14.367 1.00 . A A . 39 GLY CA 1 1 10 17481 1 1 39 GLY H H 13.724 -1.430 12.463 1.00 . A A . 39 GLY H 1 1 10 17482 1 1 39 GLY HA2 H 13.685 -3.192 14.024 1.00 . A A . 39 GLY HA2 1 1 10 17483 1 1 39 GLY HA3 H 14.919 -2.389 14.974 1.00 . A A . 39 GLY HA3 1 1 10 17484 1 1 39 GLY N N 14.371 -1.388 13.224 1.00 . A A . 39 GLY N 1 1 10 17485 1 1 39 GLY O O 12.492 -2.130 16.209 1.00 . A A . 39 GLY O 1 1 10 17486 1 1 40 LYS C C 10.215 0.299 14.744 1.00 . A A . 40 LYS C 1 1 10 17487 1 1 40 LYS CA C 11.533 0.385 15.516 1.00 . A A . 40 LYS CA 1 1 10 17488 1 1 40 LYS CB C 11.998 1.819 15.779 1.00 . A A . 40 LYS CB 1 1 10 17489 1 1 40 LYS CD C 12.880 3.794 14.482 1.00 . A A . 40 LYS CD 1 1 10 17490 1 1 40 LYS CE C 12.867 4.504 13.127 1.00 . A A . 40 LYS CE 1 1 10 17491 1 1 40 LYS CG C 11.823 2.690 14.533 1.00 . A A . 40 LYS CG 1 1 10 17492 1 1 40 LYS H H 12.930 0.100 13.997 1.00 . A A . 40 LYS H 1 1 10 17493 1 1 40 LYS HA H 11.397 -0.093 16.486 1.00 . A A . 40 LYS HA 1 1 10 17494 1 1 40 LYS HB2 H 11.431 2.244 16.607 1.00 . A A . 40 LYS HB2 1 1 10 17495 1 1 40 LYS HB3 H 13.046 1.816 16.080 1.00 . A A . 40 LYS HB3 1 1 10 17496 1 1 40 LYS HD2 H 12.696 4.516 15.277 1.00 . A A . 40 LYS HD2 1 1 10 17497 1 1 40 LYS HD3 H 13.867 3.366 14.663 1.00 . A A . 40 LYS HD3 1 1 10 17498 1 1 40 LYS HE2 H 12.353 3.886 12.391 1.00 . A A . 40 LYS HE2 1 1 10 17499 1 1 40 LYS HE3 H 12.310 5.437 13.204 1.00 . A A . 40 LYS HE3 1 1 10 17500 1 1 40 LYS HG2 H 11.895 2.070 13.639 1.00 . A A . 40 LYS HG2 1 1 10 17501 1 1 40 LYS HG3 H 10.828 3.134 14.533 1.00 . A A . 40 LYS HG3 1 1 10 17502 1 1 40 LYS HZ1 H 14.637 4.007 12.146 1.00 . A A . 40 LYS HZ1 1 1 10 17503 1 1 40 LYS HZ2 H 14.295 5.597 12.073 1.00 . A A . 40 LYS HZ2 1 1 10 17504 1 1 40 LYS N N 12.557 -0.359 14.803 1.00 . A A . 40 LYS N 1 1 10 17505 1 1 40 LYS NZ N 14.248 4.780 12.673 1.00 . A A . 40 LYS NZ 1 1 10 17506 1 1 40 LYS O O 10.215 0.126 13.526 1.00 . A A . 40 LYS O 1 1 10 17507 1 1 41 GLU C C 6.998 1.613 15.238 1.00 . A A . 41 GLU C 1 1 10 17508 1 1 41 GLU CA C 7.801 0.360 14.884 1.00 . A A . 41 GLU CA 1 1 10 17509 1 1 41 GLU CB C 7.061 -0.907 15.319 1.00 . A A . 41 GLU CB 1 1 10 17510 1 1 41 GLU CD C 8.144 -3.181 15.188 1.00 . A A . 41 GLU CD 1 1 10 17511 1 1 41 GLU CG C 7.412 -2.086 14.409 1.00 . A A . 41 GLU CG 1 1 10 17512 1 1 41 GLU H H 9.132 0.563 16.474 1.00 . A A . 41 GLU H 1 1 10 17513 1 1 41 GLU HA H 7.973 0.322 13.808 1.00 . A A . 41 GLU HA 1 1 10 17514 1 1 41 GLU HB2 H 7.321 -1.148 16.350 1.00 . A A . 41 GLU HB2 1 1 10 17515 1 1 41 GLU HB3 H 5.986 -0.731 15.294 1.00 . A A . 41 GLU HB3 1 1 10 17516 1 1 41 GLU HG2 H 6.502 -2.494 13.969 1.00 . A A . 41 GLU HG2 1 1 10 17517 1 1 41 GLU HG3 H 8.037 -1.741 13.585 1.00 . A A . 41 GLU HG3 1 1 10 17518 1 1 41 GLU N N 9.123 0.423 15.484 1.00 . A A . 41 GLU N 1 1 10 17519 1 1 41 GLU O O 6.777 1.901 16.413 1.00 . A A . 41 GLU O 1 1 10 17520 1 1 41 GLU OE1 O 9.193 -2.850 15.782 1.00 . A A . 41 GLU OE1 1 1 10 17521 1 1 41 GLU OE2 O 7.638 -4.324 15.172 1.00 . A A . 41 GLU OE2 1 1 10 17522 1 1 42 ASP C C 4.826 3.697 13.224 1.00 . A A . 42 ASP C 1 1 10 17523 1 1 42 ASP CA C 5.808 3.539 14.387 1.00 . A A . 42 ASP CA 1 1 10 17524 1 1 42 ASP CB C 6.715 4.771 14.411 1.00 . A A . 42 ASP CB 1 1 10 17525 1 1 42 ASP CG C 7.312 5.161 13.057 1.00 . A A . 42 ASP CG 1 1 10 17526 1 1 42 ASP H H 6.766 2.082 13.247 1.00 . A A . 42 ASP H 1 1 10 17527 1 1 42 ASP HA H 5.304 3.413 15.345 1.00 . A A . 42 ASP HA 1 1 10 17528 1 1 42 ASP HB2 H 6.144 5.616 14.797 1.00 . A A . 42 ASP HB2 1 1 10 17529 1 1 42 ASP HB3 H 7.530 4.590 15.112 1.00 . A A . 42 ASP HB3 1 1 10 17530 1 1 42 ASP N N 6.582 2.324 14.200 1.00 . A A . 42 ASP N 1 1 10 17531 1 1 42 ASP O O 5.046 3.152 12.144 1.00 . A A . 42 ASP O 1 1 10 17532 1 1 42 ASP OD1 O 6.514 5.541 12.173 1.00 . A A . 42 ASP OD1 1 1 10 17533 1 1 42 ASP OD2 O 8.553 5.070 12.937 1.00 . A A . 42 ASP OD2 1 1 10 17534 1 1 43 TYR C C 3.065 5.941 11.663 1.00 . A A . 43 TYR C 1 1 10 17535 1 1 43 TYR CA C 2.749 4.682 12.474 1.00 . A A . 43 TYR CA 1 1 10 17536 1 1 43 TYR CB C 1.439 4.895 13.235 1.00 . A A . 43 TYR CB 1 1 10 17537 1 1 43 TYR CD1 C 1.467 2.470 13.922 1.00 . A A . 43 TYR CD1 1 1 10 17538 1 1 43 TYR CD2 C 0.412 4.048 15.376 1.00 . A A . 43 TYR CD2 1 1 10 17539 1 1 43 TYR CE1 C 1.143 1.408 14.840 1.00 . A A . 43 TYR CE1 1 1 10 17540 1 1 43 TYR CE2 C 0.088 2.986 16.293 1.00 . A A . 43 TYR CE2 1 1 10 17541 1 1 43 TYR CG C 1.094 3.767 14.209 1.00 . A A . 43 TYR CG 1 1 10 17542 1 1 43 TYR CZ C 0.470 1.719 15.980 1.00 . A A . 43 TYR CZ 1 1 10 17543 1 1 43 TYR H H 3.595 4.886 14.367 1.00 . A A . 43 TYR H 1 1 10 17544 1 1 43 TYR HA H 2.734 3.822 11.805 1.00 . A A . 43 TYR HA 1 1 10 17545 1 1 43 TYR HB2 H 1.499 5.833 13.787 1.00 . A A . 43 TYR HB2 1 1 10 17546 1 1 43 TYR HB3 H 0.626 5.001 12.516 1.00 . A A . 43 TYR HB3 1 1 10 17547 1 1 43 TYR HD1 H 2.006 2.249 13.001 1.00 . A A . 43 TYR HD1 1 1 10 17548 1 1 43 TYR HD2 H 0.118 5.073 15.602 1.00 . A A . 43 TYR HD2 1 1 10 17549 1 1 43 TYR HE1 H 1.431 0.379 14.625 1.00 . A A . 43 TYR HE1 1 1 10 17550 1 1 43 TYR HE2 H -0.450 3.193 17.218 1.00 . A A . 43 TYR HE2 1 1 10 17551 1 1 43 TYR HH H 0.821 0.703 17.600 1.00 . A A . 43 TYR HH 1 1 10 17552 1 1 43 TYR N N 3.765 4.446 13.485 1.00 . A A . 43 TYR N 1 1 10 17553 1 1 43 TYR O O 2.766 7.053 12.096 1.00 . A A . 43 TYR O 1 1 10 17554 1 1 43 TYR OH O 0.164 0.716 16.846 1.00 . A A . 43 TYR OH 1 1 10 17555 1 1 44 ARG C C 3.484 6.582 8.216 1.00 . A A . 44 ARG C 1 1 10 17556 1 1 44 ARG CA C 4.023 6.826 9.627 1.00 . A A . 44 ARG CA 1 1 10 17557 1 1 44 ARG CB C 5.542 7.005 9.561 1.00 . A A . 44 ARG CB 1 1 10 17558 1 1 44 ARG CD C 7.478 8.473 10.233 1.00 . A A . 44 ARG CD 1 1 10 17559 1 1 44 ARG CG C 5.957 8.372 10.110 1.00 . A A . 44 ARG CG 1 1 10 17560 1 1 44 ARG CZ C 8.992 9.518 11.928 1.00 . A A . 44 ARG CZ 1 1 10 17561 1 1 44 ARG H H 3.903 4.815 10.157 1.00 . A A . 44 ARG H 1 1 10 17562 1 1 44 ARG HA H 3.559 7.703 10.078 1.00 . A A . 44 ARG HA 1 1 10 17563 1 1 44 ARG HB2 H 6.029 6.216 10.134 1.00 . A A . 44 ARG HB2 1 1 10 17564 1 1 44 ARG HB3 H 5.879 6.905 8.530 1.00 . A A . 44 ARG HB3 1 1 10 17565 1 1 44 ARG HD2 H 7.936 7.515 9.989 1.00 . A A . 44 ARG HD2 1 1 10 17566 1 1 44 ARG HD3 H 7.862 9.201 9.518 1.00 . A A . 44 ARG HD3 1 1 10 17567 1 1 44 ARG HE H 7.213 8.655 12.349 1.00 . A A . 44 ARG HE 1 1 10 17568 1 1 44 ARG HG2 H 5.588 9.158 9.452 1.00 . A A . 44 ARG HG2 1 1 10 17569 1 1 44 ARG HG3 H 5.498 8.531 11.085 1.00 . A A . 44 ARG HG3 1 1 10 17570 1 1 44 ARG HH11 H 9.706 9.601 10.016 1.00 . A A . 44 ARG HH11 1 1 10 17571 1 1 44 ARG HH12 H 10.732 10.316 11.215 1.00 . A A . 44 ARG HH12 1 1 10 17572 1 1 44 ARG HH21 H 10.041 10.303 13.509 1.00 . A A . 44 ARG HH21 1 1 10 17573 1 1 44 ARG N N 3.664 5.723 10.502 1.00 . A A . 44 ARG N 1 1 10 17574 1 1 44 ARG NE N 7.849 8.874 11.609 1.00 . A A . 44 ARG NE 1 1 10 17575 1 1 44 ARG NH1 N 9.887 9.840 10.970 1.00 . A A . 44 ARG NH1 1 1 10 17576 1 1 44 ARG NH2 N 9.221 9.828 13.190 1.00 . A A . 44 ARG NH2 1 1 10 17577 1 1 44 ARG O O 2.970 5.504 7.922 1.00 . A A . 44 ARG O 1 1 10 17578 1 1 45 LYS C C 4.236 6.860 5.146 1.00 . A A . 45 LYS C 1 1 10 17579 1 1 45 LYS CA C 3.152 7.511 6.008 1.00 . A A . 45 LYS CA 1 1 10 17580 1 1 45 LYS CB C 2.708 8.885 5.502 1.00 . A A . 45 LYS CB 1 1 10 17581 1 1 45 LYS CD C 1.665 10.189 7.392 1.00 . A A . 45 LYS CD 1 1 10 17582 1 1 45 LYS CE C 1.479 11.672 7.060 1.00 . A A . 45 LYS CE 1 1 10 17583 1 1 45 LYS CG C 1.398 9.316 6.165 1.00 . A A . 45 LYS CG 1 1 10 17584 1 1 45 LYS H H 4.039 8.475 7.628 1.00 . A A . 45 LYS H 1 1 10 17585 1 1 45 LYS HA H 2.274 6.866 6.004 1.00 . A A . 45 LYS HA 1 1 10 17586 1 1 45 LYS HB2 H 3.484 9.622 5.709 1.00 . A A . 45 LYS HB2 1 1 10 17587 1 1 45 LYS HB3 H 2.579 8.854 4.420 1.00 . A A . 45 LYS HB3 1 1 10 17588 1 1 45 LYS HD2 H 0.989 9.906 8.199 1.00 . A A . 45 LYS HD2 1 1 10 17589 1 1 45 LYS HD3 H 2.680 10.018 7.751 1.00 . A A . 45 LYS HD3 1 1 10 17590 1 1 45 LYS HE2 H 2.196 12.269 7.624 1.00 . A A . 45 LYS HE2 1 1 10 17591 1 1 45 LYS HE3 H 1.684 11.842 6.003 1.00 . A A . 45 LYS HE3 1 1 10 17592 1 1 45 LYS HG2 H 0.787 9.865 5.448 1.00 . A A . 45 LYS HG2 1 1 10 17593 1 1 45 LYS HG3 H 0.828 8.434 6.459 1.00 . A A . 45 LYS HG3 1 1 10 17594 1 1 45 LYS HZ1 H -0.294 12.687 6.649 1.00 . A A . 45 LYS HZ1 1 1 10 17595 1 1 45 LYS HZ2 H -0.527 11.318 7.500 1.00 . A A . 45 LYS HZ2 1 1 10 17596 1 1 45 LYS N N 3.620 7.601 7.381 1.00 . A A . 45 LYS N 1 1 10 17597 1 1 45 LYS NZ N 0.101 12.106 7.380 1.00 . A A . 45 LYS NZ 1 1 10 17598 1 1 45 LYS O O 5.413 7.199 5.262 1.00 . A A . 45 LYS O 1 1 10 17599 1 1 46 CYS C C 5.460 6.271 2.575 1.00 . A A . 46 CYS C 1 1 10 17600 1 1 46 CYS CA C 4.719 5.234 3.422 1.00 . A A . 46 CYS CA 1 1 10 17601 1 1 46 CYS CB C 3.994 4.202 2.555 1.00 . A A . 46 CYS CB 1 1 10 17602 1 1 46 CYS H H 2.842 5.667 4.214 1.00 . A A . 46 CYS H 1 1 10 17603 1 1 46 CYS HA H 5.413 4.690 4.063 1.00 . A A . 46 CYS HA 1 1 10 17604 1 1 46 CYS HB2 H 3.577 4.709 1.684 1.00 . A A . 46 CYS HB2 1 1 10 17605 1 1 46 CYS HB3 H 4.724 3.482 2.185 1.00 . A A . 46 CYS HB3 1 1 10 17606 1 1 46 CYS N N 3.800 5.936 4.302 1.00 . A A . 46 CYS N 1 1 10 17607 1 1 46 CYS O O 6.687 6.243 2.487 1.00 . A A . 46 CYS O 1 1 10 17608 1 1 46 CYS SG S 2.652 3.294 3.404 1.00 . A A . 46 CYS SG 1 1 10 17609 1 1 47 GLY C C 5.835 9.335 1.990 1.00 . A A . 47 GLY C 1 1 10 17610 1 1 47 GLY CA C 5.252 8.205 1.138 1.00 . A A . 47 GLY CA 1 1 10 17611 1 1 47 GLY H H 3.688 7.178 2.052 1.00 . A A . 47 GLY H 1 1 10 17612 1 1 47 GLY HA2 H 6.032 7.784 0.504 1.00 . A A . 47 GLY HA2 1 1 10 17613 1 1 47 GLY HA3 H 4.484 8.604 0.476 1.00 . A A . 47 GLY HA3 1 1 10 17614 1 1 47 GLY N N 4.685 7.162 1.975 1.00 . A A . 47 GLY N 1 1 10 17615 1 1 47 GLY O O 5.513 10.503 1.782 1.00 . A A . 47 GLY O 1 1 10 17616 1 1 48 THR C C 8.670 10.340 3.257 1.00 . A A . 48 THR C 1 1 10 17617 1 1 48 THR CA C 7.312 9.911 3.817 1.00 . A A . 48 THR CA 1 1 10 17618 1 1 48 THR CB C 7.399 9.288 5.211 1.00 . A A . 48 THR CB 1 1 10 17619 1 1 48 THR CG2 C 8.410 10.002 6.110 1.00 . A A . 48 THR CG2 1 1 10 17620 1 1 48 THR H H 6.938 7.993 3.095 1.00 . A A . 48 THR H 1 1 10 17621 1 1 48 THR HA H 6.685 10.802 3.855 1.00 . A A . 48 THR HA 1 1 10 17622 1 1 48 THR HB H 7.619 8.222 5.148 1.00 . A A . 48 THR HB 1 1 10 17623 1 1 48 THR HG1 H 5.398 9.314 5.188 1.00 . A A . 48 THR HG1 1 1 10 17624 1 1 48 THR HG21 H 8.762 10.907 5.614 1.00 . A A . 48 THR HG21 1 1 10 17625 1 1 48 THR HG22 H 7.934 10.267 7.054 1.00 . A A . 48 THR HG22 1 1 10 17626 1 1 48 THR HG23 H 9.256 9.342 6.302 1.00 . A A . 48 THR HG23 1 1 10 17627 1 1 48 THR N N 6.682 8.946 2.932 1.00 . A A . 48 THR N 1 1 10 17628 1 1 48 THR O O 9.479 9.500 2.868 1.00 . A A . 48 THR O 1 1 10 17629 1 1 48 THR OG1 O 6.137 9.585 5.804 1.00 . A A . 48 THR OG1 1 1 10 17630 1 1 49 ALA C C 11.297 11.573 3.484 1.00 . A A . 49 ALA C 1 1 10 17631 1 1 49 ALA CA C 10.123 12.200 2.729 1.00 . A A . 49 ALA CA 1 1 10 17632 1 1 49 ALA CB C 10.096 13.724 2.857 1.00 . A A . 49 ALA CB 1 1 10 17633 1 1 49 ALA H H 8.214 12.326 3.554 1.00 . A A . 49 ALA H 1 1 10 17634 1 1 49 ALA HA H 10.198 11.938 1.674 1.00 . A A . 49 ALA HA 1 1 10 17635 1 1 49 ALA HB1 H 9.071 14.080 2.751 1.00 . A A . 49 ALA HB1 1 1 10 17636 1 1 49 ALA HB2 H 10.482 14.014 3.834 1.00 . A A . 49 ALA HB2 1 1 10 17637 1 1 49 ALA HB3 H 10.716 14.166 2.076 1.00 . A A . 49 ALA HB3 1 1 10 17638 1 1 49 ALA N N 8.877 11.649 3.235 1.00 . A A . 49 ALA N 1 1 10 17639 1 1 49 ALA O O 11.570 11.935 4.627 1.00 . A A . 49 ALA O 1 1 10 17640 1 1 50 GLY C C 12.862 8.450 3.466 1.00 . A A . 50 GLY C 1 1 10 17641 1 1 50 GLY CA C 13.098 9.960 3.406 1.00 . A A . 50 GLY CA 1 1 10 17642 1 1 50 GLY H H 11.732 10.353 1.883 1.00 . A A . 50 GLY H 1 1 10 17643 1 1 50 GLY HA2 H 13.996 10.169 2.823 1.00 . A A . 50 GLY HA2 1 1 10 17644 1 1 50 GLY HA3 H 13.274 10.345 4.411 1.00 . A A . 50 GLY HA3 1 1 10 17645 1 1 50 GLY N N 11.960 10.642 2.813 1.00 . A A . 50 GLY N 1 1 10 17646 1 1 50 GLY O O 13.771 7.688 3.794 1.00 . A A . 50 GLY O 1 1 10 17647 1 1 51 CYS C C 11.083 6.194 1.712 1.00 . A A . 51 CYS C 1 1 10 17648 1 1 51 CYS CA C 11.270 6.656 3.159 1.00 . A A . 51 CYS CA 1 1 10 17649 1 1 51 CYS CB C 10.019 6.406 4.004 1.00 . A A . 51 CYS CB 1 1 10 17650 1 1 51 CYS H H 10.903 8.687 2.880 1.00 . A A . 51 CYS H 1 1 10 17651 1 1 51 CYS HA H 12.093 6.122 3.633 1.00 . A A . 51 CYS HA 1 1 10 17652 1 1 51 CYS HB2 H 9.208 7.054 3.669 1.00 . A A . 51 CYS HB2 1 1 10 17653 1 1 51 CYS HB3 H 9.680 5.378 3.873 1.00 . A A . 51 CYS HB3 1 1 10 17654 1 1 51 CYS N N 11.637 8.061 3.145 1.00 . A A . 51 CYS N 1 1 10 17655 1 1 51 CYS O O 12.050 5.832 1.043 1.00 . A A . 51 CYS O 1 1 10 17656 1 1 51 CYS SG S 10.382 6.723 5.769 1.00 . A A . 51 CYS SG 1 1 10 17657 1 1 52 HIS C C 9.252 7.045 -0.947 1.00 . A A . 52 HIS C 1 1 10 17658 1 1 52 HIS CA C 9.508 5.809 -0.082 1.00 . A A . 52 HIS CA 1 1 10 17659 1 1 52 HIS CB C 8.332 4.830 -0.084 1.00 . A A . 52 HIS CB 1 1 10 17660 1 1 52 HIS CD2 C 8.219 2.933 1.710 1.00 . A A . 52 HIS CD2 1 1 10 17661 1 1 52 HIS CE1 C 9.561 1.504 0.736 1.00 . A A . 52 HIS CE1 1 1 10 17662 1 1 52 HIS CG C 8.645 3.492 0.541 1.00 . A A . 52 HIS CG 1 1 10 17663 1 1 52 HIS H H 9.053 6.517 1.824 1.00 . A A . 52 HIS H 1 1 10 17664 1 1 52 HIS HA H 10.380 5.281 -0.467 1.00 . A A . 52 HIS HA 1 1 10 17665 1 1 52 HIS HB2 H 7.495 5.282 0.449 1.00 . A A . 52 HIS HB2 1 1 10 17666 1 1 52 HIS HB3 H 8.006 4.672 -1.112 1.00 . A A . 52 HIS HB3 1 1 10 17667 1 1 52 HIS HD1 H 9.965 2.684 -0.922 1.00 . A A . 52 HIS HD1 1 1 10 17668 1 1 52 HIS HD2 H 7.540 3.394 2.426 1.00 . A A . 52 HIS HD2 1 1 10 17669 1 1 52 HIS HE1 H 10.146 0.605 0.546 1.00 . A A . 52 HIS HE1 1 1 10 17670 1 1 52 HIS N N 9.833 6.221 1.273 1.00 . A A . 52 HIS N 1 1 10 17671 1 1 52 HIS ND1 N 9.490 2.568 -0.050 1.00 . A A . 52 HIS ND1 1 1 10 17672 1 1 52 HIS NE2 N 8.773 1.732 1.826 1.00 . A A . 52 HIS NE2 1 1 10 17673 1 1 52 HIS O O 8.108 7.350 -1.278 1.00 . A A . 52 HIS O 1 1 10 17674 1 1 53 ASP C C 11.274 8.838 -3.238 1.00 . A A . 53 ASP C 1 1 10 17675 1 1 53 ASP CA C 10.246 8.920 -2.108 1.00 . A A . 53 ASP CA 1 1 10 17676 1 1 53 ASP CB C 10.545 10.175 -1.286 1.00 . A A . 53 ASP CB 1 1 10 17677 1 1 53 ASP CG C 11.000 11.388 -2.100 1.00 . A A . 53 ASP CG 1 1 10 17678 1 1 53 ASP H H 11.266 7.468 -1.015 1.00 . A A . 53 ASP H 1 1 10 17679 1 1 53 ASP HA H 9.221 8.935 -2.478 1.00 . A A . 53 ASP HA 1 1 10 17680 1 1 53 ASP HB2 H 9.650 10.446 -0.727 1.00 . A A . 53 ASP HB2 1 1 10 17681 1 1 53 ASP HB3 H 11.317 9.937 -0.555 1.00 . A A . 53 ASP HB3 1 1 10 17682 1 1 53 ASP N N 10.338 7.723 -1.288 1.00 . A A . 53 ASP N 1 1 10 17683 1 1 53 ASP O O 12.342 9.443 -3.155 1.00 . A A . 53 ASP O 1 1 10 17684 1 1 53 ASP OD1 O 10.729 11.386 -3.321 1.00 . A A . 53 ASP OD1 1 1 10 17685 1 1 53 ASP OD2 O 11.607 12.290 -1.484 1.00 . A A . 53 ASP OD2 1 1 10 17686 1 1 54 SER C C 11.231 8.671 -6.620 1.00 . A A . 54 SER C 1 1 10 17687 1 1 54 SER CA C 11.795 7.918 -5.414 1.00 . A A . 54 SER CA 1 1 10 17688 1 1 54 SER CB C 11.981 6.438 -5.752 1.00 . A A . 54 SER CB 1 1 10 17689 1 1 54 SER H H 10.045 7.598 -4.328 1.00 . A A . 54 SER H 1 1 10 17690 1 1 54 SER HA H 12.751 8.344 -5.109 1.00 . A A . 54 SER HA 1 1 10 17691 1 1 54 SER HB2 H 12.804 6.328 -6.459 1.00 . A A . 54 SER HB2 1 1 10 17692 1 1 54 SER HB3 H 12.261 5.892 -4.851 1.00 . A A . 54 SER HB3 1 1 10 17693 1 1 54 SER HG H 9.994 6.217 -5.833 1.00 . A A . 54 SER HG 1 1 10 17694 1 1 54 SER N N 10.916 8.086 -4.268 1.00 . A A . 54 SER N 1 1 10 17695 1 1 54 SER O O 11.982 9.092 -7.499 1.00 . A A . 54 SER O 1 1 10 17696 1 1 54 SER OG O 10.801 5.864 -6.306 1.00 . A A . 54 SER OG 1 1 10 17697 1 1 55 MET C C 9.859 9.147 -9.060 1.00 . A A . 55 MET C 1 1 10 17698 1 1 55 MET CA C 9.242 9.514 -7.708 1.00 . A A . 55 MET CA 1 1 10 17699 1 1 55 MET CB C 9.349 11.024 -7.491 1.00 . A A . 55 MET CB 1 1 10 17700 1 1 55 MET CE C 7.161 9.816 -5.032 1.00 . A A . 55 MET CE 1 1 10 17701 1 1 55 MET CG C 8.048 11.589 -6.916 1.00 . A A . 55 MET CG 1 1 10 17702 1 1 55 MET H H 9.311 8.474 -5.905 1.00 . A A . 55 MET H 1 1 10 17703 1 1 55 MET HA H 8.205 9.180 -7.672 1.00 . A A . 55 MET HA 1 1 10 17704 1 1 55 MET HB2 H 10.175 11.240 -6.813 1.00 . A A . 55 MET HB2 1 1 10 17705 1 1 55 MET HB3 H 9.576 11.516 -8.436 1.00 . A A . 55 MET HB3 1 1 10 17706 1 1 55 MET HE1 H 6.743 9.560 -6.006 1.00 . A A . 55 MET HE1 1 1 10 17707 1 1 55 MET HE2 H 7.857 9.038 -4.720 1.00 . A A . 55 MET HE2 1 1 10 17708 1 1 55 MET HE3 H 6.355 9.896 -4.302 1.00 . A A . 55 MET HE3 1 1 10 17709 1 1 55 MET HG2 H 7.960 12.646 -7.165 1.00 . A A . 55 MET HG2 1 1 10 17710 1 1 55 MET HG3 H 7.193 11.083 -7.364 1.00 . A A . 55 MET HG3 1 1 10 17711 1 1 55 MET N N 9.915 8.819 -6.624 1.00 . A A . 55 MET N 1 1 10 17712 1 1 55 MET O O 9.948 9.988 -9.954 1.00 . A A . 55 MET O 1 1 10 17713 1 1 55 MET SD S 8.021 11.376 -5.144 1.00 . A A . 55 MET SD 1 1 10 17714 1 1 56 ASP C C 9.909 6.441 -11.087 1.00 . A A . 56 ASP C 1 1 10 17715 1 1 56 ASP CA C 10.875 7.404 -10.394 1.00 . A A . 56 ASP CA 1 1 10 17716 1 1 56 ASP CB C 12.172 6.646 -10.104 1.00 . A A . 56 ASP CB 1 1 10 17717 1 1 56 ASP CG C 13.348 7.004 -11.016 1.00 . A A . 56 ASP CG 1 1 10 17718 1 1 56 ASP H H 10.193 7.215 -8.435 1.00 . A A . 56 ASP H 1 1 10 17719 1 1 56 ASP HA H 11.074 8.296 -10.989 1.00 . A A . 56 ASP HA 1 1 10 17720 1 1 56 ASP HB2 H 12.463 6.835 -9.071 1.00 . A A . 56 ASP HB2 1 1 10 17721 1 1 56 ASP HB3 H 11.977 5.577 -10.189 1.00 . A A . 56 ASP HB3 1 1 10 17722 1 1 56 ASP N N 10.269 7.892 -9.166 1.00 . A A . 56 ASP N 1 1 10 17723 1 1 56 ASP O O 9.751 6.485 -12.306 1.00 . A A . 56 ASP O 1 1 10 17724 1 1 56 ASP OD1 O 13.401 6.429 -12.124 1.00 . A A . 56 ASP OD1 1 1 10 17725 1 1 56 ASP OD2 O 14.166 7.844 -10.584 1.00 . A A . 56 ASP OD2 1 1 10 17726 1 1 57 LYS C C 9.097 3.567 -11.613 1.00 . A A . 57 LYS C 1 1 10 17727 1 1 57 LYS CA C 8.343 4.621 -10.800 1.00 . A A . 57 LYS CA 1 1 10 17728 1 1 57 LYS CB C 7.230 5.321 -11.583 1.00 . A A . 57 LYS CB 1 1 10 17729 1 1 57 LYS CD C 6.548 3.658 -13.351 1.00 . A A . 57 LYS CD 1 1 10 17730 1 1 57 LYS CE C 5.519 3.966 -14.441 1.00 . A A . 57 LYS CE 1 1 10 17731 1 1 57 LYS CG C 6.161 4.322 -12.028 1.00 . A A . 57 LYS CG 1 1 10 17732 1 1 57 LYS H H 9.422 5.564 -9.289 1.00 . A A . 57 LYS H 1 1 10 17733 1 1 57 LYS HA H 7.876 4.130 -9.946 1.00 . A A . 57 LYS HA 1 1 10 17734 1 1 57 LYS HB2 H 6.775 6.094 -10.963 1.00 . A A . 57 LYS HB2 1 1 10 17735 1 1 57 LYS HB3 H 7.653 5.820 -12.455 1.00 . A A . 57 LYS HB3 1 1 10 17736 1 1 57 LYS HD2 H 7.531 4.010 -13.665 1.00 . A A . 57 LYS HD2 1 1 10 17737 1 1 57 LYS HD3 H 6.625 2.580 -13.212 1.00 . A A . 57 LYS HD3 1 1 10 17738 1 1 57 LYS HE2 H 5.463 3.133 -15.142 1.00 . A A . 57 LYS HE2 1 1 10 17739 1 1 57 LYS HE3 H 4.530 4.074 -13.995 1.00 . A A . 57 LYS HE3 1 1 10 17740 1 1 57 LYS HG2 H 6.027 3.560 -11.260 1.00 . A A . 57 LYS HG2 1 1 10 17741 1 1 57 LYS HG3 H 5.204 4.833 -12.140 1.00 . A A . 57 LYS HG3 1 1 10 17742 1 1 57 LYS HZ1 H 6.834 5.176 -15.513 1.00 . A A . 57 LYS HZ1 1 1 10 17743 1 1 57 LYS HZ2 H 5.281 5.371 -15.961 1.00 . A A . 57 LYS HZ2 1 1 10 17744 1 1 57 LYS N N 9.288 5.594 -10.280 1.00 . A A . 57 LYS N 1 1 10 17745 1 1 57 LYS NZ N 5.883 5.206 -15.163 1.00 . A A . 57 LYS NZ 1 1 10 17746 1 1 57 LYS O O 9.131 2.396 -11.239 1.00 . A A . 57 LYS O 1 1 10 17747 1 1 58 LYS C C 11.748 2.747 -12.897 1.00 . A A . 58 LYS C 1 1 10 17748 1 1 58 LYS CA C 10.435 3.132 -13.581 1.00 . A A . 58 LYS CA 1 1 10 17749 1 1 58 LYS CB C 10.623 3.765 -14.961 1.00 . A A . 58 LYS CB 1 1 10 17750 1 1 58 LYS CD C 9.704 2.043 -16.557 1.00 . A A . 58 LYS CD 1 1 10 17751 1 1 58 LYS CE C 8.416 1.507 -17.186 1.00 . A A . 58 LYS CE 1 1 10 17752 1 1 58 LYS CG C 9.467 3.401 -15.894 1.00 . A A . 58 LYS CG 1 1 10 17753 1 1 58 LYS H H 9.651 4.976 -13.009 1.00 . A A . 58 LYS H 1 1 10 17754 1 1 58 LYS HA H 9.839 2.230 -13.719 1.00 . A A . 58 LYS HA 1 1 10 17755 1 1 58 LYS HB2 H 10.688 4.849 -14.862 1.00 . A A . 58 LYS HB2 1 1 10 17756 1 1 58 LYS HB3 H 11.565 3.428 -15.394 1.00 . A A . 58 LYS HB3 1 1 10 17757 1 1 58 LYS HD2 H 10.475 2.137 -17.322 1.00 . A A . 58 LYS HD2 1 1 10 17758 1 1 58 LYS HD3 H 10.074 1.333 -15.817 1.00 . A A . 58 LYS HD3 1 1 10 17759 1 1 58 LYS HE2 H 8.554 0.467 -17.480 1.00 . A A . 58 LYS HE2 1 1 10 17760 1 1 58 LYS HE3 H 7.610 1.527 -16.452 1.00 . A A . 58 LYS HE3 1 1 10 17761 1 1 58 LYS HG2 H 8.534 3.376 -15.330 1.00 . A A . 58 LYS HG2 1 1 10 17762 1 1 58 LYS HG3 H 9.356 4.169 -16.659 1.00 . A A . 58 LYS HG3 1 1 10 17763 1 1 58 LYS HZ1 H 8.638 2.127 -19.163 1.00 . A A . 58 LYS HZ1 1 1 10 17764 1 1 58 LYS HZ2 H 7.088 2.136 -18.663 1.00 . A A . 58 LYS HZ2 1 1 10 17765 1 1 58 LYS N N 9.684 4.021 -12.711 1.00 . A A . 58 LYS N 1 1 10 17766 1 1 58 LYS NZ N 8.040 2.317 -18.366 1.00 . A A . 58 LYS NZ 1 1 10 17767 1 1 58 LYS O O 12.828 3.069 -13.391 1.00 . A A . 58 LYS O 1 1 10 17768 1 1 59 ASP C C 12.322 0.735 -9.858 1.00 . A A . 59 ASP C 1 1 10 17769 1 1 59 ASP CA C 12.775 1.629 -11.013 1.00 . A A . 59 ASP CA 1 1 10 17770 1 1 59 ASP CB C 13.522 2.825 -10.420 1.00 . A A . 59 ASP CB 1 1 10 17771 1 1 59 ASP CG C 12.806 3.527 -9.264 1.00 . A A . 59 ASP CG 1 1 10 17772 1 1 59 ASP H H 10.731 1.804 -11.375 1.00 . A A . 59 ASP H 1 1 10 17773 1 1 59 ASP HA H 13.403 1.099 -11.730 1.00 . A A . 59 ASP HA 1 1 10 17774 1 1 59 ASP HB2 H 14.498 2.488 -10.071 1.00 . A A . 59 ASP HB2 1 1 10 17775 1 1 59 ASP HB3 H 13.701 3.553 -11.212 1.00 . A A . 59 ASP HB3 1 1 10 17776 1 1 59 ASP N N 11.613 2.062 -11.770 1.00 . A A . 59 ASP N 1 1 10 17777 1 1 59 ASP O O 12.648 0.996 -8.701 1.00 . A A . 59 ASP O 1 1 10 17778 1 1 59 ASP OD1 O 11.603 3.238 -9.083 1.00 . A A . 59 ASP OD1 1 1 10 17779 1 1 59 ASP OD2 O 13.477 4.336 -8.588 1.00 . A A . 59 ASP OD2 1 1 10 17780 1 1 60 LYS C C 12.163 -1.498 -8.175 1.00 . A A . 60 LYS C 1 1 10 17781 1 1 60 LYS CA C 11.075 -1.237 -9.219 1.00 . A A . 60 LYS CA 1 1 10 17782 1 1 60 LYS CB C 10.553 -2.507 -9.894 1.00 . A A . 60 LYS CB 1 1 10 17783 1 1 60 LYS CD C 8.125 -2.733 -10.536 1.00 . A A . 60 LYS CD 1 1 10 17784 1 1 60 LYS CE C 7.065 -2.416 -11.593 1.00 . A A . 60 LYS CE 1 1 10 17785 1 1 60 LYS CG C 9.490 -2.173 -10.942 1.00 . A A . 60 LYS CG 1 1 10 17786 1 1 60 LYS H H 11.316 -0.508 -11.155 1.00 . A A . 60 LYS H 1 1 10 17787 1 1 60 LYS HA H 10.227 -0.763 -8.723 1.00 . A A . 60 LYS HA 1 1 10 17788 1 1 60 LYS HB2 H 11.379 -3.039 -10.365 1.00 . A A . 60 LYS HB2 1 1 10 17789 1 1 60 LYS HB3 H 10.132 -3.175 -9.143 1.00 . A A . 60 LYS HB3 1 1 10 17790 1 1 60 LYS HD2 H 8.196 -3.812 -10.400 1.00 . A A . 60 LYS HD2 1 1 10 17791 1 1 60 LYS HD3 H 7.825 -2.310 -9.577 1.00 . A A . 60 LYS HD3 1 1 10 17792 1 1 60 LYS HE2 H 7.021 -1.340 -11.760 1.00 . A A . 60 LYS HE2 1 1 10 17793 1 1 60 LYS HE3 H 7.342 -2.875 -12.542 1.00 . A A . 60 LYS HE3 1 1 10 17794 1 1 60 LYS HG2 H 9.421 -1.092 -11.064 1.00 . A A . 60 LYS HG2 1 1 10 17795 1 1 60 LYS HG3 H 9.783 -2.585 -11.907 1.00 . A A . 60 LYS HG3 1 1 10 17796 1 1 60 LYS HZ1 H 4.997 -2.260 -11.391 1.00 . A A . 60 LYS HZ1 1 1 10 17797 1 1 60 LYS HZ2 H 5.502 -3.793 -11.606 1.00 . A A . 60 LYS HZ2 1 1 10 17798 1 1 60 LYS N N 11.577 -0.302 -10.212 1.00 . A A . 60 LYS N 1 1 10 17799 1 1 60 LYS NZ N 5.739 -2.912 -11.163 1.00 . A A . 60 LYS NZ 1 1 10 17800 1 1 60 LYS O O 13.055 -2.315 -8.394 1.00 . A A . 60 LYS O 1 1 10 17801 1 1 61 SER C C 12.357 -0.594 -4.644 1.00 . A A . 61 SER C 1 1 10 17802 1 1 61 SER CA C 13.016 -0.933 -5.983 1.00 . A A . 61 SER CA 1 1 10 17803 1 1 61 SER CB C 14.238 -0.042 -6.214 1.00 . A A . 61 SER CB 1 1 10 17804 1 1 61 SER H H 11.323 -0.125 -6.891 1.00 . A A . 61 SER H 1 1 10 17805 1 1 61 SER HA H 13.320 -1.979 -6.006 1.00 . A A . 61 SER HA 1 1 10 17806 1 1 61 SER HB2 H 14.856 -0.035 -5.316 1.00 . A A . 61 SER HB2 1 1 10 17807 1 1 61 SER HB3 H 14.846 -0.460 -7.016 1.00 . A A . 61 SER HB3 1 1 10 17808 1 1 61 SER HG H 12.919 1.462 -6.285 1.00 . A A . 61 SER HG 1 1 10 17809 1 1 61 SER N N 12.052 -0.788 -7.062 1.00 . A A . 61 SER N 1 1 10 17810 1 1 61 SER O O 11.216 -0.136 -4.608 1.00 . A A . 61 SER O 1 1 10 17811 1 1 61 SER OG O 13.870 1.294 -6.546 1.00 . A A . 61 SER OG 1 1 10 17812 1 1 62 ALA C C 12.146 0.897 -2.159 1.00 . A A . 62 ALA C 1 1 10 17813 1 1 62 ALA CA C 12.607 -0.559 -2.239 1.00 . A A . 62 ALA CA 1 1 10 17814 1 1 62 ALA CB C 13.696 -0.883 -1.214 1.00 . A A . 62 ALA CB 1 1 10 17815 1 1 62 ALA H H 14.032 -1.205 -3.615 1.00 . A A . 62 ALA H 1 1 10 17816 1 1 62 ALA HA H 11.753 -1.213 -2.062 1.00 . A A . 62 ALA HA 1 1 10 17817 1 1 62 ALA HB1 H 14.271 -1.744 -1.554 1.00 . A A . 62 ALA HB1 1 1 10 17818 1 1 62 ALA HB2 H 14.358 -0.024 -1.104 1.00 . A A . 62 ALA HB2 1 1 10 17819 1 1 62 ALA HB3 H 13.234 -1.111 -0.253 1.00 . A A . 62 ALA HB3 1 1 10 17820 1 1 62 ALA N N 13.104 -0.833 -3.577 1.00 . A A . 62 ALA N 1 1 10 17821 1 1 62 ALA O O 11.044 1.178 -1.689 1.00 . A A . 62 ALA O 1 1 10 17822 1 1 63 LYS C C 11.522 3.478 -3.543 1.00 . A A . 63 LYS C 1 1 10 17823 1 1 63 LYS CA C 12.705 3.206 -2.613 1.00 . A A . 63 LYS CA 1 1 10 17824 1 1 63 LYS CB C 13.953 4.025 -2.949 1.00 . A A . 63 LYS CB 1 1 10 17825 1 1 63 LYS CD C 14.809 5.635 -1.207 1.00 . A A . 63 LYS CD 1 1 10 17826 1 1 63 LYS CE C 15.799 5.835 -0.057 1.00 . A A . 63 LYS CE 1 1 10 17827 1 1 63 LYS CG C 14.847 4.194 -1.718 1.00 . A A . 63 LYS CG 1 1 10 17828 1 1 63 LYS H H 13.904 1.549 -3.007 1.00 . A A . 63 LYS H 1 1 10 17829 1 1 63 LYS HA H 12.413 3.468 -1.596 1.00 . A A . 63 LYS HA 1 1 10 17830 1 1 63 LYS HB2 H 14.513 3.533 -3.744 1.00 . A A . 63 LYS HB2 1 1 10 17831 1 1 63 LYS HB3 H 13.659 5.005 -3.326 1.00 . A A . 63 LYS HB3 1 1 10 17832 1 1 63 LYS HD2 H 15.048 6.320 -2.020 1.00 . A A . 63 LYS HD2 1 1 10 17833 1 1 63 LYS HD3 H 13.802 5.879 -0.871 1.00 . A A . 63 LYS HD3 1 1 10 17834 1 1 63 LYS HE2 H 15.540 6.734 0.502 1.00 . A A . 63 LYS HE2 1 1 10 17835 1 1 63 LYS HE3 H 15.733 4.998 0.637 1.00 . A A . 63 LYS HE3 1 1 10 17836 1 1 63 LYS HG2 H 14.518 3.516 -0.931 1.00 . A A . 63 LYS HG2 1 1 10 17837 1 1 63 LYS HG3 H 15.872 3.919 -1.969 1.00 . A A . 63 LYS HG3 1 1 10 17838 1 1 63 LYS HZ1 H 17.588 5.040 -0.771 1.00 . A A . 63 LYS HZ1 1 1 10 17839 1 1 63 LYS HZ2 H 17.219 6.479 -1.439 1.00 . A A . 63 LYS HZ2 1 1 10 17840 1 1 63 LYS N N 13.011 1.786 -2.626 1.00 . A A . 63 LYS N 1 1 10 17841 1 1 63 LYS NZ N 17.180 5.948 -0.577 1.00 . A A . 63 LYS NZ 1 1 10 17842 1 1 63 LYS O O 10.859 4.507 -3.426 1.00 . A A . 63 LYS O 1 1 10 17843 1 1 64 GLY C C 8.847 2.608 -4.688 1.00 . A A . 64 GLY C 1 1 10 17844 1 1 64 GLY CA C 10.201 2.661 -5.398 1.00 . A A . 64 GLY CA 1 1 10 17845 1 1 64 GLY H H 11.837 1.702 -4.536 1.00 . A A . 64 GLY H 1 1 10 17846 1 1 64 GLY HA2 H 10.294 3.601 -5.942 1.00 . A A . 64 GLY HA2 1 1 10 17847 1 1 64 GLY HA3 H 10.262 1.860 -6.134 1.00 . A A . 64 GLY HA3 1 1 10 17848 1 1 64 GLY N N 11.293 2.536 -4.447 1.00 . A A . 64 GLY N 1 1 10 17849 1 1 64 GLY O O 8.263 1.536 -4.536 1.00 . A A . 64 GLY O 1 1 10 17850 1 1 65 TYR C C 6.005 3.176 -4.368 1.00 . A A . 65 TYR C 1 1 10 17851 1 1 65 TYR CA C 7.112 3.879 -3.581 1.00 . A A . 65 TYR CA 1 1 10 17852 1 1 65 TYR CB C 6.794 5.373 -3.499 1.00 . A A . 65 TYR CB 1 1 10 17853 1 1 65 TYR CD1 C 4.954 5.470 -1.777 1.00 . A A . 65 TYR CD1 1 1 10 17854 1 1 65 TYR CD2 C 4.456 6.168 -4.009 1.00 . A A . 65 TYR CD2 1 1 10 17855 1 1 65 TYR CE1 C 3.599 5.760 -1.384 1.00 . A A . 65 TYR CE1 1 1 10 17856 1 1 65 TYR CE2 C 3.101 6.457 -3.615 1.00 . A A . 65 TYR CE2 1 1 10 17857 1 1 65 TYR CG C 5.354 5.681 -3.081 1.00 . A A . 65 TYR CG 1 1 10 17858 1 1 65 TYR CZ C 2.740 6.239 -2.322 1.00 . A A . 65 TYR CZ 1 1 10 17859 1 1 65 TYR H H 8.868 4.646 -4.400 1.00 . A A . 65 TYR H 1 1 10 17860 1 1 65 TYR HA H 7.218 3.398 -2.609 1.00 . A A . 65 TYR HA 1 1 10 17861 1 1 65 TYR HB2 H 7.475 5.841 -2.788 1.00 . A A . 65 TYR HB2 1 1 10 17862 1 1 65 TYR HB3 H 6.984 5.829 -4.471 1.00 . A A . 65 TYR HB3 1 1 10 17863 1 1 65 TYR HD1 H 5.664 5.085 -1.045 1.00 . A A . 65 TYR HD1 1 1 10 17864 1 1 65 TYR HD2 H 4.771 6.334 -5.038 1.00 . A A . 65 TYR HD2 1 1 10 17865 1 1 65 TYR HE1 H 3.271 5.598 -0.357 1.00 . A A . 65 TYR HE1 1 1 10 17866 1 1 65 TYR HE2 H 2.381 6.842 -4.338 1.00 . A A . 65 TYR HE2 1 1 10 17867 1 1 65 TYR HH H 1.359 6.398 -0.963 1.00 . A A . 65 TYR HH 1 1 10 17868 1 1 65 TYR N N 8.387 3.779 -4.272 1.00 . A A . 65 TYR N 1 1 10 17869 1 1 65 TYR O O 5.117 2.559 -3.782 1.00 . A A . 65 TYR O 1 1 10 17870 1 1 65 TYR OH O 1.460 6.512 -1.951 1.00 . A A . 65 TYR OH 1 1 10 17871 1 1 66 TYR C C 5.406 1.189 -6.755 1.00 . A A . 66 TYR C 1 1 10 17872 1 1 66 TYR CA C 5.109 2.677 -6.559 1.00 . A A . 66 TYR CA 1 1 10 17873 1 1 66 TYR CB C 5.235 3.392 -7.906 1.00 . A A . 66 TYR CB 1 1 10 17874 1 1 66 TYR CD1 C 5.488 1.571 -9.631 1.00 . A A . 66 TYR CD1 1 1 10 17875 1 1 66 TYR CD2 C 3.471 2.854 -9.625 1.00 . A A . 66 TYR CD2 1 1 10 17876 1 1 66 TYR CE1 C 4.998 0.806 -10.748 1.00 . A A . 66 TYR CE1 1 1 10 17877 1 1 66 TYR CE2 C 2.981 2.089 -10.742 1.00 . A A . 66 TYR CE2 1 1 10 17878 1 1 66 TYR CG C 4.714 2.579 -9.093 1.00 . A A . 66 TYR CG 1 1 10 17879 1 1 66 TYR CZ C 3.768 1.102 -11.248 1.00 . A A . 66 TYR CZ 1 1 10 17880 1 1 66 TYR H H 6.818 3.797 -6.154 1.00 . A A . 66 TYR H 1 1 10 17881 1 1 66 TYR HA H 4.130 2.786 -6.093 1.00 . A A . 66 TYR HA 1 1 10 17882 1 1 66 TYR HB2 H 4.690 4.335 -7.858 1.00 . A A . 66 TYR HB2 1 1 10 17883 1 1 66 TYR HB3 H 6.283 3.638 -8.079 1.00 . A A . 66 TYR HB3 1 1 10 17884 1 1 66 TYR HD1 H 6.470 1.354 -9.211 1.00 . A A . 66 TYR HD1 1 1 10 17885 1 1 66 TYR HD2 H 2.860 3.650 -9.200 1.00 . A A . 66 TYR HD2 1 1 10 17886 1 1 66 TYR HE1 H 5.598 0.007 -11.183 1.00 . A A . 66 TYR HE1 1 1 10 17887 1 1 66 TYR HE2 H 2.001 2.295 -11.172 1.00 . A A . 66 TYR HE2 1 1 10 17888 1 1 66 TYR HH H 3.831 0.599 -13.125 1.00 . A A . 66 TYR HH 1 1 10 17889 1 1 66 TYR N N 6.093 3.293 -5.685 1.00 . A A . 66 TYR N 1 1 10 17890 1 1 66 TYR O O 4.650 0.484 -7.423 1.00 . A A . 66 TYR O 1 1 10 17891 1 1 66 TYR OH O 3.305 0.380 -12.304 1.00 . A A . 66 TYR OH 1 1 10 17892 1 1 67 HIS C C 6.499 -1.386 -4.995 1.00 . A A . 67 HIS C 1 1 10 17893 1 1 67 HIS CA C 6.914 -0.637 -6.263 1.00 . A A . 67 HIS CA 1 1 10 17894 1 1 67 HIS CB C 8.413 -0.745 -6.552 1.00 . A A . 67 HIS CB 1 1 10 17895 1 1 67 HIS CD2 C 9.546 -2.060 -4.597 1.00 . A A . 67 HIS CD2 1 1 10 17896 1 1 67 HIS CE1 C 9.942 -3.927 -5.666 1.00 . A A . 67 HIS CE1 1 1 10 17897 1 1 67 HIS CG C 9.086 -1.914 -5.873 1.00 . A A . 67 HIS CG 1 1 10 17898 1 1 67 HIS H H 7.117 1.334 -5.620 1.00 . A A . 67 HIS H 1 1 10 17899 1 1 67 HIS HA H 6.380 -1.057 -7.115 1.00 . A A . 67 HIS HA 1 1 10 17900 1 1 67 HIS HB2 H 8.559 -0.830 -7.628 1.00 . A A . 67 HIS HB2 1 1 10 17901 1 1 67 HIS HB3 H 8.901 0.176 -6.235 1.00 . A A . 67 HIS HB3 1 1 10 17902 1 1 67 HIS HD1 H 9.132 -3.316 -7.475 1.00 . A A . 67 HIS HD1 1 1 10 17903 1 1 67 HIS HD2 H 9.498 -1.305 -3.812 1.00 . A A . 67 HIS HD2 1 1 10 17904 1 1 67 HIS HE1 H 10.275 -4.944 -5.877 1.00 . A A . 67 HIS HE1 1 1 10 17905 1 1 67 HIS N N 6.508 0.755 -6.161 1.00 . A A . 67 HIS N 1 1 10 17906 1 1 67 HIS ND1 N 9.350 -3.108 -6.522 1.00 . A A . 67 HIS ND1 1 1 10 17907 1 1 67 HIS NE2 N 10.062 -3.276 -4.473 1.00 . A A . 67 HIS NE2 1 1 10 17908 1 1 67 HIS O O 6.431 -2.614 -4.990 1.00 . A A . 67 HIS O 1 1 10 17909 1 1 68 VAL C C 4.300 -1.145 -2.569 1.00 . A A . 68 VAL C 1 1 10 17910 1 1 68 VAL CA C 5.825 -1.191 -2.680 1.00 . A A . 68 VAL CA 1 1 10 17911 1 1 68 VAL CB C 6.530 -0.470 -1.530 1.00 . A A . 68 VAL CB 1 1 10 17912 1 1 68 VAL CG1 C 7.969 -0.966 -1.371 1.00 . A A . 68 VAL CG1 1 1 10 17913 1 1 68 VAL CG2 C 6.493 1.047 -1.728 1.00 . A A . 68 VAL CG2 1 1 10 17914 1 1 68 VAL H H 6.289 0.383 -3.964 1.00 . A A . 68 VAL H 1 1 10 17915 1 1 68 VAL HA H 6.147 -2.232 -2.673 1.00 . A A . 68 VAL HA 1 1 10 17916 1 1 68 VAL HB H 5.993 -0.701 -0.610 1.00 . A A . 68 VAL HB 1 1 10 17917 1 1 68 VAL HG11 H 8.005 -2.040 -1.556 1.00 . A A . 68 VAL HG11 1 1 10 17918 1 1 68 VAL HG12 H 8.612 -0.453 -2.086 1.00 . A A . 68 VAL HG12 1 1 10 17919 1 1 68 VAL HG13 H 8.314 -0.760 -0.358 1.00 . A A . 68 VAL HG13 1 1 10 17920 1 1 68 VAL HG21 H 5.479 1.355 -1.984 1.00 . A A . 68 VAL HG21 1 1 10 17921 1 1 68 VAL HG22 H 6.801 1.541 -0.807 1.00 . A A . 68 VAL HG22 1 1 10 17922 1 1 68 VAL HG23 H 7.172 1.325 -2.534 1.00 . A A . 68 VAL HG23 1 1 10 17923 1 1 68 VAL N N 6.232 -0.615 -3.951 1.00 . A A . 68 VAL N 1 1 10 17924 1 1 68 VAL O O 3.743 -1.424 -1.509 1.00 . A A . 68 VAL O 1 1 10 17925 1 1 69 MET C C 1.641 -1.666 -4.760 1.00 . A A . 69 MET C 1 1 10 17926 1 1 69 MET CA C 2.218 -0.705 -3.719 1.00 . A A . 69 MET CA 1 1 10 17927 1 1 69 MET CB C 1.801 0.727 -4.059 1.00 . A A . 69 MET CB 1 1 10 17928 1 1 69 MET CE C 2.785 2.036 -0.373 1.00 . A A . 69 MET CE 1 1 10 17929 1 1 69 MET CG C 2.396 1.723 -3.062 1.00 . A A . 69 MET CG 1 1 10 17930 1 1 69 MET H H 4.129 -0.567 -4.537 1.00 . A A . 69 MET H 1 1 10 17931 1 1 69 MET HA H 1.880 -0.992 -2.723 1.00 . A A . 69 MET HA 1 1 10 17932 1 1 69 MET HB2 H 2.131 0.976 -5.068 1.00 . A A . 69 MET HB2 1 1 10 17933 1 1 69 MET HB3 H 0.714 0.804 -4.051 1.00 . A A . 69 MET HB3 1 1 10 17934 1 1 69 MET HE1 H 3.627 1.369 -0.558 1.00 . A A . 69 MET HE1 1 1 10 17935 1 1 69 MET HE2 H 3.107 3.070 -0.496 1.00 . A A . 69 MET HE2 1 1 10 17936 1 1 69 MET HE3 H 2.421 1.888 0.644 1.00 . A A . 69 MET HE3 1 1 10 17937 1 1 69 MET HG2 H 3.442 1.481 -2.873 1.00 . A A . 69 MET HG2 1 1 10 17938 1 1 69 MET HG3 H 2.372 2.729 -3.481 1.00 . A A . 69 MET HG3 1 1 10 17939 1 1 69 MET N N 3.668 -0.791 -3.679 1.00 . A A . 69 MET N 1 1 10 17940 1 1 69 MET O O 0.427 -1.856 -4.830 1.00 . A A . 69 MET O 1 1 10 17941 1 1 69 MET SD S 1.476 1.678 -1.532 1.00 . A A . 69 MET SD 1 1 10 17942 1 1 70 HIS C C 3.072 -4.390 -6.576 1.00 . A A . 70 HIS C 1 1 10 17943 1 1 70 HIS CA C 2.132 -3.183 -6.579 1.00 . A A . 70 HIS CA 1 1 10 17944 1 1 70 HIS CB C 2.060 -2.490 -7.941 1.00 . A A . 70 HIS CB 1 1 10 17945 1 1 70 HIS CD2 C 0.145 -0.745 -8.285 1.00 . A A . 70 HIS CD2 1 1 10 17946 1 1 70 HIS CE1 C 1.196 1.023 -7.538 1.00 . A A . 70 HIS CE1 1 1 10 17947 1 1 70 HIS CG C 1.396 -1.134 -7.906 1.00 . A A . 70 HIS CG 1 1 10 17948 1 1 70 HIS H H 3.522 -2.087 -5.482 1.00 . A A . 70 HIS H 1 1 10 17949 1 1 70 HIS HA H 1.126 -3.517 -6.323 1.00 . A A . 70 HIS HA 1 1 10 17950 1 1 70 HIS HB2 H 3.071 -2.378 -8.334 1.00 . A A . 70 HIS HB2 1 1 10 17951 1 1 70 HIS HB3 H 1.518 -3.131 -8.636 1.00 . A A . 70 HIS HB3 1 1 10 17952 1 1 70 HIS HD1 H 2.970 0.044 -7.090 1.00 . A A . 70 HIS HD1 1 1 10 17953 1 1 70 HIS HD2 H -0.626 -1.394 -8.701 1.00 . A A . 70 HIS HD2 1 1 10 17954 1 1 70 HIS HE1 H 1.405 2.053 -7.251 1.00 . A A . 70 HIS HE1 1 1 10 17955 1 1 70 HIS N N 2.537 -2.247 -5.544 1.00 . A A . 70 HIS N 1 1 10 17956 1 1 70 HIS ND1 N 2.035 0.002 -7.441 1.00 . A A . 70 HIS ND1 1 1 10 17957 1 1 70 HIS NE2 N 0.025 0.558 -8.061 1.00 . A A . 70 HIS NE2 1 1 10 17958 1 1 70 HIS O O 2.643 -5.516 -6.330 1.00 . A A . 70 HIS O 1 1 10 17959 1 1 71 ASP C C 5.067 -6.163 -5.763 1.00 . A A . 71 ASP C 1 1 10 17960 1 1 71 ASP CA C 5.343 -5.162 -6.887 1.00 . A A . 71 ASP CA 1 1 10 17961 1 1 71 ASP CB C 6.745 -4.589 -6.675 1.00 . A A . 71 ASP CB 1 1 10 17962 1 1 71 ASP CG C 7.857 -5.292 -7.457 1.00 . A A . 71 ASP CG 1 1 10 17963 1 1 71 ASP H H 4.679 -3.195 -7.054 1.00 . A A . 71 ASP H 1 1 10 17964 1 1 71 ASP HA H 5.255 -5.612 -7.876 1.00 . A A . 71 ASP HA 1 1 10 17965 1 1 71 ASP HB2 H 6.736 -3.535 -6.954 1.00 . A A . 71 ASP HB2 1 1 10 17966 1 1 71 ASP HB3 H 6.984 -4.635 -5.613 1.00 . A A . 71 ASP HB3 1 1 10 17967 1 1 71 ASP N N 4.338 -4.114 -6.854 1.00 . A A . 71 ASP N 1 1 10 17968 1 1 71 ASP O O 4.693 -5.773 -4.658 1.00 . A A . 71 ASP O 1 1 10 17969 1 1 71 ASP OD1 O 8.137 -6.461 -7.117 1.00 . A A . 71 ASP OD1 1 1 10 17970 1 1 71 ASP OD2 O 8.401 -4.644 -8.378 1.00 . A A . 71 ASP OD2 1 1 10 17971 1 1 72 LYS C C 6.387 -9.030 -4.633 1.00 . A A . 72 LYS C 1 1 10 17972 1 1 72 LYS CA C 5.038 -8.493 -5.115 1.00 . A A . 72 LYS CA 1 1 10 17973 1 1 72 LYS CB C 4.121 -9.569 -5.700 1.00 . A A . 72 LYS CB 1 1 10 17974 1 1 72 LYS CD C 2.084 -10.015 -7.119 1.00 . A A . 72 LYS CD 1 1 10 17975 1 1 72 LYS CE C 1.830 -9.701 -8.594 1.00 . A A . 72 LYS CE 1 1 10 17976 1 1 72 LYS CG C 2.960 -8.940 -6.472 1.00 . A A . 72 LYS CG 1 1 10 17977 1 1 72 LYS H H 5.566 -7.742 -6.985 1.00 . A A . 72 LYS H 1 1 10 17978 1 1 72 LYS HA H 4.517 -8.053 -4.265 1.00 . A A . 72 LYS HA 1 1 10 17979 1 1 72 LYS HB2 H 4.693 -10.219 -6.362 1.00 . A A . 72 LYS HB2 1 1 10 17980 1 1 72 LYS HB3 H 3.732 -10.196 -4.898 1.00 . A A . 72 LYS HB3 1 1 10 17981 1 1 72 LYS HD2 H 2.570 -10.987 -7.029 1.00 . A A . 72 LYS HD2 1 1 10 17982 1 1 72 LYS HD3 H 1.134 -10.083 -6.588 1.00 . A A . 72 LYS HD3 1 1 10 17983 1 1 72 LYS HE2 H 2.779 -9.609 -9.122 1.00 . A A . 72 LYS HE2 1 1 10 17984 1 1 72 LYS HE3 H 1.285 -10.523 -9.059 1.00 . A A . 72 LYS HE3 1 1 10 17985 1 1 72 LYS HG2 H 2.357 -8.332 -5.797 1.00 . A A . 72 LYS HG2 1 1 10 17986 1 1 72 LYS HG3 H 3.349 -8.272 -7.241 1.00 . A A . 72 LYS HG3 1 1 10 17987 1 1 72 LYS HZ1 H 0.131 -8.610 -9.113 1.00 . A A . 72 LYS HZ1 1 1 10 17988 1 1 72 LYS HZ2 H 0.927 -7.981 -7.839 1.00 . A A . 72 LYS HZ2 1 1 10 17989 1 1 72 LYS N N 5.262 -7.434 -6.084 1.00 . A A . 72 LYS N 1 1 10 17990 1 1 72 LYS NZ N 1.056 -8.446 -8.731 1.00 . A A . 72 LYS NZ 1 1 10 17991 1 1 72 LYS O O 6.525 -9.421 -3.475 1.00 . A A . 72 LYS O 1 1 10 17992 1 1 73 ASN C C 9.353 -8.543 -4.258 1.00 . A A . 73 ASN C 1 1 10 17993 1 1 73 ASN CA C 8.680 -9.516 -5.228 1.00 . A A . 73 ASN CA 1 1 10 17994 1 1 73 ASN CB C 9.548 -9.606 -6.485 1.00 . A A . 73 ASN CB 1 1 10 17995 1 1 73 ASN CG C 10.601 -10.708 -6.347 1.00 . A A . 73 ASN CG 1 1 10 17996 1 1 73 ASN H H 7.227 -8.713 -6.485 1.00 . A A . 73 ASN H 1 1 10 17997 1 1 73 ASN HA H 8.531 -10.503 -4.791 1.00 . A A . 73 ASN HA 1 1 10 17998 1 1 73 ASN HB2 H 8.918 -9.807 -7.352 1.00 . A A . 73 ASN HB2 1 1 10 17999 1 1 73 ASN HB3 H 10.038 -8.649 -6.662 1.00 . A A . 73 ASN HB3 1 1 10 18000 1 1 73 ASN HD21 H 10.132 -11.326 -8.217 1.00 . A A . 73 ASN HD21 1 1 10 18001 1 1 73 ASN HD22 H 11.373 -12.238 -7.424 1.00 . A A . 73 ASN HD22 1 1 10 18002 1 1 73 ASN N N 7.347 -9.033 -5.545 1.00 . A A . 73 ASN N 1 1 10 18003 1 1 73 ASN ND2 N 10.711 -11.488 -7.418 1.00 . A A . 73 ASN ND2 1 1 10 18004 1 1 73 ASN O O 10.339 -7.894 -4.608 1.00 . A A . 73 ASN O 1 1 10 18005 1 1 73 ASN OD1 O 11.269 -10.840 -5.335 1.00 . A A . 73 ASN OD1 1 1 10 18006 1 1 74 THR C C 9.509 -8.344 -0.719 1.00 . A A . 74 THR C 1 1 10 18007 1 1 74 THR CA C 9.328 -7.587 -2.036 1.00 . A A . 74 THR CA 1 1 10 18008 1 1 74 THR CB C 8.395 -6.380 -1.920 1.00 . A A . 74 THR CB 1 1 10 18009 1 1 74 THR CG2 C 8.188 -5.669 -3.259 1.00 . A A . 74 THR CG2 1 1 10 18010 1 1 74 THR H H 7.994 -9.002 -2.783 1.00 . A A . 74 THR H 1 1 10 18011 1 1 74 THR HA H 10.317 -7.254 -2.352 1.00 . A A . 74 THR HA 1 1 10 18012 1 1 74 THR HB H 8.751 -5.685 -1.160 1.00 . A A . 74 THR HB 1 1 10 18013 1 1 74 THR HG1 H 6.856 -6.737 -0.692 1.00 . A A . 74 THR HG1 1 1 10 18014 1 1 74 THR HG21 H 8.555 -6.302 -4.067 1.00 . A A . 74 THR HG21 1 1 10 18015 1 1 74 THR HG22 H 7.126 -5.472 -3.405 1.00 . A A . 74 THR HG22 1 1 10 18016 1 1 74 THR HG23 H 8.736 -4.727 -3.258 1.00 . A A . 74 THR HG23 1 1 10 18017 1 1 74 THR N N 8.795 -8.471 -3.059 1.00 . A A . 74 THR N 1 1 10 18018 1 1 74 THR O O 8.796 -9.309 -0.451 1.00 . A A . 74 THR O 1 1 10 18019 1 1 74 THR OG1 O 7.122 -6.952 -1.631 1.00 . A A . 74 THR OG1 1 1 10 18020 1 1 75 LYS C C 9.539 -8.339 2.269 1.00 . A A . 75 LYS C 1 1 10 18021 1 1 75 LYS CA C 10.752 -8.498 1.350 1.00 . A A . 75 LYS CA 1 1 10 18022 1 1 75 LYS CB C 12.048 -7.938 1.941 1.00 . A A . 75 LYS CB 1 1 10 18023 1 1 75 LYS CD C 13.195 -7.494 4.142 1.00 . A A . 75 LYS CD 1 1 10 18024 1 1 75 LYS CE C 14.642 -7.687 3.684 1.00 . A A . 75 LYS CE 1 1 10 18025 1 1 75 LYS CG C 12.250 -8.423 3.378 1.00 . A A . 75 LYS CG 1 1 10 18026 1 1 75 LYS H H 11.043 -7.091 -0.158 1.00 . A A . 75 LYS H 1 1 10 18027 1 1 75 LYS HA H 10.913 -9.561 1.170 1.00 . A A . 75 LYS HA 1 1 10 18028 1 1 75 LYS HB2 H 12.894 -8.246 1.327 1.00 . A A . 75 LYS HB2 1 1 10 18029 1 1 75 LYS HB3 H 12.020 -6.849 1.921 1.00 . A A . 75 LYS HB3 1 1 10 18030 1 1 75 LYS HD2 H 12.896 -6.458 3.988 1.00 . A A . 75 LYS HD2 1 1 10 18031 1 1 75 LYS HD3 H 13.119 -7.692 5.212 1.00 . A A . 75 LYS HD3 1 1 10 18032 1 1 75 LYS HE2 H 14.658 -8.060 2.660 1.00 . A A . 75 LYS HE2 1 1 10 18033 1 1 75 LYS HE3 H 15.160 -6.727 3.682 1.00 . A A . 75 LYS HE3 1 1 10 18034 1 1 75 LYS HG2 H 11.288 -8.469 3.888 1.00 . A A . 75 LYS HG2 1 1 10 18035 1 1 75 LYS HG3 H 12.655 -9.435 3.371 1.00 . A A . 75 LYS HG3 1 1 10 18036 1 1 75 LYS HZ1 H 15.622 -8.201 5.449 1.00 . A A . 75 LYS HZ1 1 1 10 18037 1 1 75 LYS HZ2 H 14.768 -9.434 4.813 1.00 . A A . 75 LYS HZ2 1 1 10 18038 1 1 75 LYS N N 10.467 -7.877 0.068 1.00 . A A . 75 LYS N 1 1 10 18039 1 1 75 LYS NZ N 15.346 -8.635 4.575 1.00 . A A . 75 LYS NZ 1 1 10 18040 1 1 75 LYS O O 9.331 -9.146 3.174 1.00 . A A . 75 LYS O 1 1 10 18041 1 1 76 PHE C C 6.314 -7.165 1.954 1.00 . A A . 76 PHE C 1 1 10 18042 1 1 76 PHE CA C 7.582 -7.019 2.797 1.00 . A A . 76 PHE CA 1 1 10 18043 1 1 76 PHE CB C 7.710 -5.565 3.257 1.00 . A A . 76 PHE CB 1 1 10 18044 1 1 76 PHE CD1 C 8.867 -5.835 5.481 1.00 . A A . 76 PHE CD1 1 1 10 18045 1 1 76 PHE CD2 C 9.964 -4.563 3.780 1.00 . A A . 76 PHE CD2 1 1 10 18046 1 1 76 PHE CE1 C 9.974 -5.597 6.371 1.00 . A A . 76 PHE CE1 1 1 10 18047 1 1 76 PHE CE2 C 11.070 -4.325 4.670 1.00 . A A . 76 PHE CE2 1 1 10 18048 1 1 76 PHE CG C 8.885 -5.313 4.203 1.00 . A A . 76 PHE CG 1 1 10 18049 1 1 76 PHE CZ C 11.020 -4.854 5.922 1.00 . A A . 76 PHE CZ 1 1 10 18050 1 1 76 PHE H H 8.945 -6.642 1.267 1.00 . A A . 76 PHE H 1 1 10 18051 1 1 76 PHE HA H 7.550 -7.738 3.616 1.00 . A A . 76 PHE HA 1 1 10 18052 1 1 76 PHE HB2 H 7.818 -4.926 2.381 1.00 . A A . 76 PHE HB2 1 1 10 18053 1 1 76 PHE HB3 H 6.786 -5.270 3.755 1.00 . A A . 76 PHE HB3 1 1 10 18054 1 1 76 PHE HD1 H 8.016 -6.427 5.815 1.00 . A A . 76 PHE HD1 1 1 10 18055 1 1 76 PHE HD2 H 9.978 -4.150 2.771 1.00 . A A . 76 PHE HD2 1 1 10 18056 1 1 76 PHE HE1 H 9.972 -6.004 7.383 1.00 . A A . 76 PHE HE1 1 1 10 18057 1 1 76 PHE HE2 H 11.928 -3.735 4.348 1.00 . A A . 76 PHE HE2 1 1 10 18058 1 1 76 PHE HZ H 11.838 -4.745 6.679 1.00 . A A . 76 PHE HZ 1 1 10 18059 1 1 76 PHE N N 8.769 -7.293 2.005 1.00 . A A . 76 PHE N 1 1 10 18060 1 1 76 PHE O O 6.360 -7.038 0.731 1.00 . A A . 76 PHE O 1 1 10 18061 1 1 77 LYS C C 3.534 -6.273 1.311 1.00 . A A . 77 LYS C 1 1 10 18062 1 1 77 LYS CA C 3.934 -7.595 1.969 1.00 . A A . 77 LYS CA 1 1 10 18063 1 1 77 LYS CB C 2.886 -8.139 2.941 1.00 . A A . 77 LYS CB 1 1 10 18064 1 1 77 LYS CD C 1.806 -10.294 2.199 1.00 . A A . 77 LYS CD 1 1 10 18065 1 1 77 LYS CE C 2.182 -10.402 0.720 1.00 . A A . 77 LYS CE 1 1 10 18066 1 1 77 LYS CG C 2.942 -9.667 3.009 1.00 . A A . 77 LYS CG 1 1 10 18067 1 1 77 LYS H H 5.184 -7.531 3.635 1.00 . A A . 77 LYS H 1 1 10 18068 1 1 77 LYS HA H 4.069 -8.343 1.188 1.00 . A A . 77 LYS HA 1 1 10 18069 1 1 77 LYS HB2 H 3.052 -7.721 3.934 1.00 . A A . 77 LYS HB2 1 1 10 18070 1 1 77 LYS HB3 H 1.892 -7.822 2.625 1.00 . A A . 77 LYS HB3 1 1 10 18071 1 1 77 LYS HD2 H 1.577 -11.285 2.593 1.00 . A A . 77 LYS HD2 1 1 10 18072 1 1 77 LYS HD3 H 0.903 -9.693 2.306 1.00 . A A . 77 LYS HD3 1 1 10 18073 1 1 77 LYS HE2 H 1.526 -9.767 0.124 1.00 . A A . 77 LYS HE2 1 1 10 18074 1 1 77 LYS HE3 H 3.199 -10.040 0.569 1.00 . A A . 77 LYS HE3 1 1 10 18075 1 1 77 LYS HG2 H 3.902 -10.016 2.627 1.00 . A A . 77 LYS HG2 1 1 10 18076 1 1 77 LYS HG3 H 2.875 -9.991 4.047 1.00 . A A . 77 LYS HG3 1 1 10 18077 1 1 77 LYS HZ1 H 1.171 -12.000 -0.156 1.00 . A A . 77 LYS HZ1 1 1 10 18078 1 1 77 LYS HZ2 H 2.774 -12.028 -0.441 1.00 . A A . 77 LYS HZ2 1 1 10 18079 1 1 77 LYS N N 5.213 -7.429 2.640 1.00 . A A . 77 LYS N 1 1 10 18080 1 1 77 LYS NZ N 2.076 -11.804 0.259 1.00 . A A . 77 LYS NZ 1 1 10 18081 1 1 77 LYS O O 3.491 -5.235 1.970 1.00 . A A . 77 LYS O 1 1 10 18082 1 1 78 SER C C 1.335 -5.131 -0.877 1.00 . A A . 78 SER C 1 1 10 18083 1 1 78 SER CA C 2.858 -5.177 -0.736 1.00 . A A . 78 SER CA 1 1 10 18084 1 1 78 SER CB C 3.519 -5.160 -2.116 1.00 . A A . 78 SER CB 1 1 10 18085 1 1 78 SER H H 3.290 -7.202 -0.510 1.00 . A A . 78 SER H 1 1 10 18086 1 1 78 SER HA H 3.213 -4.327 -0.153 1.00 . A A . 78 SER HA 1 1 10 18087 1 1 78 SER HB2 H 3.635 -4.129 -2.450 1.00 . A A . 78 SER HB2 1 1 10 18088 1 1 78 SER HB3 H 4.519 -5.586 -2.043 1.00 . A A . 78 SER HB3 1 1 10 18089 1 1 78 SER HG H 3.275 -5.959 -3.935 1.00 . A A . 78 SER HG 1 1 10 18090 1 1 78 SER N N 3.252 -6.354 0.019 1.00 . A A . 78 SER N 1 1 10 18091 1 1 78 SER O O 0.670 -6.164 -0.803 1.00 . A A . 78 SER O 1 1 10 18092 1 1 78 SER OG O 2.762 -5.888 -3.079 1.00 . A A . 78 SER OG 1 1 10 18093 1 1 79 CYS C C -1.148 -4.842 -2.130 1.00 . A A . 79 CYS C 1 1 10 18094 1 1 79 CYS CA C -0.605 -3.731 -1.228 1.00 . A A . 79 CYS CA 1 1 10 18095 1 1 79 CYS CB C -0.934 -2.340 -1.776 1.00 . A A . 79 CYS CB 1 1 10 18096 1 1 79 CYS H H 1.374 -3.090 -1.137 1.00 . A A . 79 CYS H 1 1 10 18097 1 1 79 CYS HA H -1.038 -3.797 -0.230 1.00 . A A . 79 CYS HA 1 1 10 18098 1 1 79 CYS HB2 H -0.590 -2.281 -2.808 1.00 . A A . 79 CYS HB2 1 1 10 18099 1 1 79 CYS HB3 H -2.017 -2.219 -1.793 1.00 . A A . 79 CYS HB3 1 1 10 18100 1 1 79 CYS N N 0.827 -3.924 -1.077 1.00 . A A . 79 CYS N 1 1 10 18101 1 1 79 CYS O O -1.913 -5.694 -1.680 1.00 . A A . 79 CYS O 1 1 10 18102 1 1 79 CYS SG S -0.202 -0.952 -0.834 1.00 . A A . 79 CYS SG 1 1 10 18103 1 1 80 VAL C C -0.660 -7.168 -3.928 1.00 . A A . 80 VAL C 1 1 10 18104 1 1 80 VAL CA C -1.165 -5.788 -4.356 1.00 . A A . 80 VAL CA 1 1 10 18105 1 1 80 VAL CB C -0.700 -5.389 -5.758 1.00 . A A . 80 VAL CB 1 1 10 18106 1 1 80 VAL CG1 C -1.051 -6.471 -6.780 1.00 . A A . 80 VAL CG1 1 1 10 18107 1 1 80 VAL CG2 C -1.287 -4.037 -6.166 1.00 . A A . 80 VAL CG2 1 1 10 18108 1 1 80 VAL H H -0.108 -4.101 -3.745 1.00 . A A . 80 VAL H 1 1 10 18109 1 1 80 VAL HA H -2.255 -5.797 -4.351 1.00 . A A . 80 VAL HA 1 1 10 18110 1 1 80 VAL HB H 0.386 -5.290 -5.735 1.00 . A A . 80 VAL HB 1 1 10 18111 1 1 80 VAL HG11 H -2.105 -6.734 -6.685 1.00 . A A . 80 VAL HG11 1 1 10 18112 1 1 80 VAL HG12 H -0.860 -6.097 -7.786 1.00 . A A . 80 VAL HG12 1 1 10 18113 1 1 80 VAL HG13 H -0.439 -7.355 -6.600 1.00 . A A . 80 VAL HG13 1 1 10 18114 1 1 80 VAL HG21 H -1.134 -3.317 -5.362 1.00 . A A . 80 VAL HG21 1 1 10 18115 1 1 80 VAL HG22 H -0.792 -3.684 -7.070 1.00 . A A . 80 VAL HG22 1 1 10 18116 1 1 80 VAL HG23 H -2.355 -4.148 -6.356 1.00 . A A . 80 VAL HG23 1 1 10 18117 1 1 80 VAL N N -0.730 -4.797 -3.387 1.00 . A A . 80 VAL N 1 1 10 18118 1 1 80 VAL O O -1.361 -8.166 -4.087 1.00 . A A . 80 VAL O 1 1 10 18119 1 1 81 GLY C C 0.213 -9.191 -2.022 1.00 . A A . 81 GLY C 1 1 10 18120 1 1 81 GLY CA C 1.160 -8.421 -2.944 1.00 . A A . 81 GLY CA 1 1 10 18121 1 1 81 GLY H H 1.116 -6.364 -3.269 1.00 . A A . 81 GLY H 1 1 10 18122 1 1 81 GLY HA2 H 1.417 -9.038 -3.805 1.00 . A A . 81 GLY HA2 1 1 10 18123 1 1 81 GLY HA3 H 2.090 -8.204 -2.417 1.00 . A A . 81 GLY HA3 1 1 10 18124 1 1 81 GLY N N 0.553 -7.180 -3.395 1.00 . A A . 81 GLY N 1 1 10 18125 1 1 81 GLY O O -0.160 -10.326 -2.317 1.00 . A A . 81 GLY O 1 1 10 18126 1 1 82 CYS C C -2.397 -9.389 -0.635 1.00 . A A . 82 CYS C 1 1 10 18127 1 1 82 CYS CA C -1.046 -9.155 0.043 1.00 . A A . 82 CYS CA 1 1 10 18128 1 1 82 CYS CB C -1.181 -8.302 1.306 1.00 . A A . 82 CYS CB 1 1 10 18129 1 1 82 CYS H H 0.158 -7.622 -0.691 1.00 . A A . 82 CYS H 1 1 10 18130 1 1 82 CYS HA H -0.592 -10.101 0.337 1.00 . A A . 82 CYS HA 1 1 10 18131 1 1 82 CYS HB2 H -0.196 -8.097 1.724 1.00 . A A . 82 CYS HB2 1 1 10 18132 1 1 82 CYS HB3 H -1.629 -7.339 1.059 1.00 . A A . 82 CYS HB3 1 1 10 18133 1 1 82 CYS N N -0.150 -8.544 -0.924 1.00 . A A . 82 CYS N 1 1 10 18134 1 1 82 CYS O O -2.989 -10.458 -0.496 1.00 . A A . 82 CYS O 1 1 10 18135 1 1 82 CYS SG S -2.214 -9.172 2.541 1.00 . A A . 82 CYS SG 1 1 10 18136 1 1 83 HIS C C -4.141 -9.706 -2.931 1.00 . A A . 83 HIS C 1 1 10 18137 1 1 83 HIS CA C -4.117 -8.452 -2.054 1.00 . A A . 83 HIS CA 1 1 10 18138 1 1 83 HIS CB C -4.384 -7.170 -2.846 1.00 . A A . 83 HIS CB 1 1 10 18139 1 1 83 HIS CD2 C -4.795 -5.776 -0.673 1.00 . A A . 83 HIS CD2 1 1 10 18140 1 1 83 HIS CE1 C -5.966 -4.155 -1.560 1.00 . A A . 83 HIS CE1 1 1 10 18141 1 1 83 HIS CG C -4.911 -6.029 -2.008 1.00 . A A . 83 HIS CG 1 1 10 18142 1 1 83 HIS H H -2.359 -7.504 -1.463 1.00 . A A . 83 HIS H 1 1 10 18143 1 1 83 HIS HA H -4.890 -8.538 -1.291 1.00 . A A . 83 HIS HA 1 1 10 18144 1 1 83 HIS HB2 H -3.460 -6.855 -3.330 1.00 . A A . 83 HIS HB2 1 1 10 18145 1 1 83 HIS HB3 H -5.101 -7.387 -3.638 1.00 . A A . 83 HIS HB3 1 1 10 18146 1 1 83 HIS HD1 H -5.913 -4.887 -3.500 1.00 . A A . 83 HIS HD1 1 1 10 18147 1 1 83 HIS HD2 H -4.268 -6.399 0.050 1.00 . A A . 83 HIS HD2 1 1 10 18148 1 1 83 HIS HE1 H -6.547 -3.238 -1.660 1.00 . A A . 83 HIS HE1 1 1 10 18149 1 1 83 HIS N N -2.846 -8.371 -1.355 1.00 . A A . 83 HIS N 1 1 10 18150 1 1 83 HIS ND1 N -5.655 -4.990 -2.540 1.00 . A A . 83 HIS ND1 1 1 10 18151 1 1 83 HIS NE2 N -5.432 -4.643 -0.404 1.00 . A A . 83 HIS NE2 1 1 10 18152 1 1 83 HIS O O -5.134 -10.431 -2.955 1.00 . A A . 83 HIS O 1 1 10 18153 1 1 84 VAL C C -3.173 -12.351 -3.699 1.00 . A A . 84 VAL C 1 1 10 18154 1 1 84 VAL CA C -2.918 -11.075 -4.505 1.00 . A A . 84 VAL CA 1 1 10 18155 1 1 84 VAL CB C -1.554 -11.069 -5.197 1.00 . A A . 84 VAL CB 1 1 10 18156 1 1 84 VAL CG1 C -1.344 -12.350 -6.007 1.00 . A A . 84 VAL CG1 1 1 10 18157 1 1 84 VAL CG2 C -1.393 -9.830 -6.080 1.00 . A A . 84 VAL CG2 1 1 10 18158 1 1 84 VAL H H -2.233 -9.327 -3.603 1.00 . A A . 84 VAL H 1 1 10 18159 1 1 84 VAL HA H -3.687 -10.986 -5.272 1.00 . A A . 84 VAL HA 1 1 10 18160 1 1 84 VAL HB H -0.786 -11.032 -4.425 1.00 . A A . 84 VAL HB 1 1 10 18161 1 1 84 VAL HG11 H -2.078 -13.097 -5.703 1.00 . A A . 84 VAL HG11 1 1 10 18162 1 1 84 VAL HG12 H -1.466 -12.133 -7.069 1.00 . A A . 84 VAL HG12 1 1 10 18163 1 1 84 VAL HG13 H -0.340 -12.733 -5.827 1.00 . A A . 84 VAL HG13 1 1 10 18164 1 1 84 VAL HG21 H -2.270 -9.191 -5.973 1.00 . A A . 84 VAL HG21 1 1 10 18165 1 1 84 VAL HG22 H -0.503 -9.279 -5.774 1.00 . A A . 84 VAL HG22 1 1 10 18166 1 1 84 VAL HG23 H -1.291 -10.136 -7.121 1.00 . A A . 84 VAL HG23 1 1 10 18167 1 1 84 VAL N N -3.036 -9.922 -3.629 1.00 . A A . 84 VAL N 1 1 10 18168 1 1 84 VAL O O -3.768 -13.301 -4.205 1.00 . A A . 84 VAL O 1 1 10 18169 1 1 85 GLU C C -4.321 -13.538 -1.063 1.00 . A A . 85 GLU C 1 1 10 18170 1 1 85 GLU CA C -2.881 -13.473 -1.576 1.00 . A A . 85 GLU CA 1 1 10 18171 1 1 85 GLU CB C -1.886 -13.424 -0.415 1.00 . A A . 85 GLU CB 1 1 10 18172 1 1 85 GLU CD C -0.581 -15.438 0.358 1.00 . A A . 85 GLU CD 1 1 10 18173 1 1 85 GLU CG C -0.680 -14.325 -0.687 1.00 . A A . 85 GLU CG 1 1 10 18174 1 1 85 GLU H H -2.228 -11.553 -2.053 1.00 . A A . 85 GLU H 1 1 10 18175 1 1 85 GLU HA H -2.668 -14.347 -2.191 1.00 . A A . 85 GLU HA 1 1 10 18176 1 1 85 GLU HB2 H -1.551 -12.398 -0.262 1.00 . A A . 85 GLU HB2 1 1 10 18177 1 1 85 GLU HB3 H -2.379 -13.738 0.505 1.00 . A A . 85 GLU HB3 1 1 10 18178 1 1 85 GLU HG2 H -0.765 -14.762 -1.682 1.00 . A A . 85 GLU HG2 1 1 10 18179 1 1 85 GLU HG3 H 0.233 -13.729 -0.677 1.00 . A A . 85 GLU HG3 1 1 10 18180 1 1 85 GLU N N -2.711 -12.330 -2.457 1.00 . A A . 85 GLU N 1 1 10 18181 1 1 85 GLU O O -4.863 -14.623 -0.860 1.00 . A A . 85 GLU O 1 1 10 18182 1 1 85 GLU OE1 O -1.554 -16.216 0.453 1.00 . A A . 85 GLU OE1 1 1 10 18183 1 1 85 GLU OE2 O 0.467 -15.486 1.038 1.00 . A A . 85 GLU OE2 1 1 10 18184 1 1 86 VAL C C -7.229 -12.634 -1.511 1.00 . A A . 86 VAL C 1 1 10 18185 1 1 86 VAL CA C -6.265 -12.271 -0.381 1.00 . A A . 86 VAL CA 1 1 10 18186 1 1 86 VAL CB C -6.522 -10.879 0.200 1.00 . A A . 86 VAL CB 1 1 10 18187 1 1 86 VAL CG1 C -7.954 -10.760 0.726 1.00 . A A . 86 VAL CG1 1 1 10 18188 1 1 86 VAL CG2 C -5.506 -10.545 1.295 1.00 . A A . 86 VAL CG2 1 1 10 18189 1 1 86 VAL H H -4.450 -11.484 -1.035 1.00 . A A . 86 VAL H 1 1 10 18190 1 1 86 VAL HA H -6.377 -12.998 0.424 1.00 . A A . 86 VAL HA 1 1 10 18191 1 1 86 VAL HB H -6.398 -10.153 -0.603 1.00 . A A . 86 VAL HB 1 1 10 18192 1 1 86 VAL HG11 H -8.642 -11.206 0.008 1.00 . A A . 86 VAL HG11 1 1 10 18193 1 1 86 VAL HG12 H -8.035 -11.281 1.680 1.00 . A A . 86 VAL HG12 1 1 10 18194 1 1 86 VAL HG13 H -8.204 -9.708 0.864 1.00 . A A . 86 VAL HG13 1 1 10 18195 1 1 86 VAL HG21 H -4.739 -11.319 1.326 1.00 . A A . 86 VAL HG21 1 1 10 18196 1 1 86 VAL HG22 H -5.043 -9.582 1.080 1.00 . A A . 86 VAL HG22 1 1 10 18197 1 1 86 VAL HG23 H -6.013 -10.498 2.259 1.00 . A A . 86 VAL HG23 1 1 10 18198 1 1 86 VAL N N -4.898 -12.362 -0.867 1.00 . A A . 86 VAL N 1 1 10 18199 1 1 86 VAL O O -8.073 -13.516 -1.353 1.00 . A A . 86 VAL O 1 1 10 18200 1 1 87 ALA C C -7.670 -13.589 -4.310 1.00 . A A . 87 ALA C 1 1 10 18201 1 1 87 ALA CA C -7.920 -12.175 -3.783 1.00 . A A . 87 ALA CA 1 1 10 18202 1 1 87 ALA CB C -7.652 -11.103 -4.841 1.00 . A A . 87 ALA CB 1 1 10 18203 1 1 87 ALA H H -6.384 -11.222 -2.747 1.00 . A A . 87 ALA H 1 1 10 18204 1 1 87 ALA HA H -8.957 -12.095 -3.457 1.00 . A A . 87 ALA HA 1 1 10 18205 1 1 87 ALA HB1 H -7.781 -10.115 -4.399 1.00 . A A . 87 ALA HB1 1 1 10 18206 1 1 87 ALA HB2 H -6.632 -11.204 -5.212 1.00 . A A . 87 ALA HB2 1 1 10 18207 1 1 87 ALA HB3 H -8.352 -11.225 -5.668 1.00 . A A . 87 ALA HB3 1 1 10 18208 1 1 87 ALA N N -7.073 -11.937 -2.627 1.00 . A A . 87 ALA N 1 1 10 18209 1 1 87 ALA O O -8.508 -14.150 -5.015 1.00 . A A . 87 ALA O 1 1 10 18210 1 1 88 GLY C C -6.642 -15.743 -5.795 1.00 . A A . 88 GLY C 1 1 10 18211 1 1 88 GLY CA C -6.144 -15.464 -4.376 1.00 . A A . 88 GLY CA 1 1 10 18212 1 1 88 GLY H H -5.838 -13.663 -3.374 1.00 . A A . 88 GLY H 1 1 10 18213 1 1 88 GLY HA2 H -5.060 -15.575 -4.338 1.00 . A A . 88 GLY HA2 1 1 10 18214 1 1 88 GLY HA3 H -6.563 -16.199 -3.688 1.00 . A A . 88 GLY HA3 1 1 10 18215 1 1 88 GLY N N -6.514 -14.126 -3.948 1.00 . A A . 88 GLY N 1 1 10 18216 1 1 88 GLY O O -6.400 -14.955 -6.708 1.00 . A A . 88 GLY O 1 1 10 18217 1 1 89 ALA C C -9.273 -16.695 -7.388 1.00 . A A . 89 ALA C 1 1 10 18218 1 1 89 ALA CA C -7.861 -17.262 -7.230 1.00 . A A . 89 ALA CA 1 1 10 18219 1 1 89 ALA CB C -7.827 -18.786 -7.354 1.00 . A A . 89 ALA CB 1 1 10 18220 1 1 89 ALA H H -7.519 -17.504 -5.189 1.00 . A A . 89 ALA H 1 1 10 18221 1 1 89 ALA HA H -7.218 -16.833 -7.999 1.00 . A A . 89 ALA HA 1 1 10 18222 1 1 89 ALA HB1 H -6.819 -19.146 -7.148 1.00 . A A . 89 ALA HB1 1 1 10 18223 1 1 89 ALA HB2 H -8.523 -19.224 -6.638 1.00 . A A . 89 ALA HB2 1 1 10 18224 1 1 89 ALA HB3 H -8.117 -19.075 -8.364 1.00 . A A . 89 ALA HB3 1 1 10 18225 1 1 89 ALA N N -7.327 -16.868 -5.937 1.00 . A A . 89 ALA N 1 1 10 18226 1 1 89 ALA O O -10.254 -17.433 -7.316 1.00 . A A . 89 ALA O 1 1 10 18227 1 1 90 ASP C C -10.408 -13.461 -8.625 1.00 . A A . 90 ASP C 1 1 10 18228 1 1 90 ASP CA C -10.607 -14.714 -7.769 1.00 . A A . 90 ASP CA 1 1 10 18229 1 1 90 ASP CB C -11.182 -14.278 -6.420 1.00 . A A . 90 ASP CB 1 1 10 18230 1 1 90 ASP CG C -12.658 -13.874 -6.446 1.00 . A A . 90 ASP CG 1 1 10 18231 1 1 90 ASP H H -8.529 -14.795 -7.658 1.00 . A A . 90 ASP H 1 1 10 18232 1 1 90 ASP HA H -11.258 -15.446 -8.247 1.00 . A A . 90 ASP HA 1 1 10 18233 1 1 90 ASP HB2 H -11.057 -15.094 -5.708 1.00 . A A . 90 ASP HB2 1 1 10 18234 1 1 90 ASP HB3 H -10.598 -13.437 -6.047 1.00 . A A . 90 ASP HB3 1 1 10 18235 1 1 90 ASP N N -9.332 -15.388 -7.601 1.00 . A A . 90 ASP N 1 1 10 18236 1 1 90 ASP O O -10.156 -12.378 -8.097 1.00 . A A . 90 ASP O 1 1 10 18237 1 1 90 ASP OD1 O -13.015 -13.085 -7.346 1.00 . A A . 90 ASP OD1 1 1 10 18238 1 1 90 ASP OD2 O -13.396 -14.365 -5.564 1.00 . A A . 90 ASP OD2 1 1 10 18239 1 1 91 ALA C C -11.066 -11.307 -10.311 1.00 . A A . 91 ALA C 1 1 10 18240 1 1 91 ALA CA C -10.364 -12.549 -10.864 1.00 . A A . 91 ALA CA 1 1 10 18241 1 1 91 ALA CB C -10.901 -12.959 -12.237 1.00 . A A . 91 ALA CB 1 1 10 18242 1 1 91 ALA H H -10.733 -14.534 -10.351 1.00 . A A . 91 ALA H 1 1 10 18243 1 1 91 ALA HA H -9.297 -12.344 -10.951 1.00 . A A . 91 ALA HA 1 1 10 18244 1 1 91 ALA HB1 H -10.990 -14.044 -12.283 1.00 . A A . 91 ALA HB1 1 1 10 18245 1 1 91 ALA HB2 H -11.880 -12.507 -12.394 1.00 . A A . 91 ALA HB2 1 1 10 18246 1 1 91 ALA HB3 H -10.214 -12.618 -13.012 1.00 . A A . 91 ALA HB3 1 1 10 18247 1 1 91 ALA N N -10.528 -13.650 -9.931 1.00 . A A . 91 ALA N 1 1 10 18248 1 1 91 ALA O O -10.475 -10.230 -10.250 1.00 . A A . 91 ALA O 1 1 10 18249 1 1 92 ALA C C -12.248 -9.602 -8.398 1.00 . A A . 92 ALA C 1 1 10 18250 1 1 92 ALA CA C -13.107 -10.408 -9.375 1.00 . A A . 92 ALA CA 1 1 10 18251 1 1 92 ALA CB C -14.368 -10.971 -8.715 1.00 . A A . 92 ALA CB 1 1 10 18252 1 1 92 ALA H H -12.791 -12.378 -9.973 1.00 . A A . 92 ALA H 1 1 10 18253 1 1 92 ALA HA H -13.402 -9.765 -10.203 1.00 . A A . 92 ALA HA 1 1 10 18254 1 1 92 ALA HB1 H -14.660 -11.893 -9.216 1.00 . A A . 92 ALA HB1 1 1 10 18255 1 1 92 ALA HB2 H -14.166 -11.177 -7.663 1.00 . A A . 92 ALA HB2 1 1 10 18256 1 1 92 ALA HB3 H -15.175 -10.243 -8.794 1.00 . A A . 92 ALA HB3 1 1 10 18257 1 1 92 ALA N N -12.318 -11.499 -9.920 1.00 . A A . 92 ALA N 1 1 10 18258 1 1 92 ALA O O -11.989 -8.421 -8.623 1.00 . A A . 92 ALA O 1 1 10 18259 1 1 93 LYS C C -9.658 -9.250 -6.937 1.00 . A A . 93 LYS C 1 1 10 18260 1 1 93 LYS CA C -11.006 -9.633 -6.323 1.00 . A A . 93 LYS CA 1 1 10 18261 1 1 93 LYS CB C -10.887 -10.525 -5.086 1.00 . A A . 93 LYS CB 1 1 10 18262 1 1 93 LYS CD C -12.272 -9.160 -3.481 1.00 . A A . 93 LYS CD 1 1 10 18263 1 1 93 LYS CE C -13.723 -8.862 -3.098 1.00 . A A . 93 LYS CE 1 1 10 18264 1 1 93 LYS CG C -12.168 -10.478 -4.251 1.00 . A A . 93 LYS CG 1 1 10 18265 1 1 93 LYS H H -12.045 -11.233 -7.160 1.00 . A A . 93 LYS H 1 1 10 18266 1 1 93 LYS HA H -11.517 -8.721 -6.015 1.00 . A A . 93 LYS HA 1 1 10 18267 1 1 93 LYS HB2 H -10.685 -11.552 -5.391 1.00 . A A . 93 LYS HB2 1 1 10 18268 1 1 93 LYS HB3 H -10.041 -10.202 -4.480 1.00 . A A . 93 LYS HB3 1 1 10 18269 1 1 93 LYS HD2 H -11.658 -9.210 -2.582 1.00 . A A . 93 LYS HD2 1 1 10 18270 1 1 93 LYS HD3 H -11.879 -8.347 -4.091 1.00 . A A . 93 LYS HD3 1 1 10 18271 1 1 93 LYS HE2 H -14.292 -9.791 -3.056 1.00 . A A . 93 LYS HE2 1 1 10 18272 1 1 93 LYS HE3 H -13.759 -8.422 -2.101 1.00 . A A . 93 LYS HE3 1 1 10 18273 1 1 93 LYS HG2 H -13.035 -10.593 -4.902 1.00 . A A . 93 LYS HG2 1 1 10 18274 1 1 93 LYS HG3 H -12.182 -11.314 -3.552 1.00 . A A . 93 LYS HG3 1 1 10 18275 1 1 93 LYS HZ1 H -13.813 -7.898 -4.943 1.00 . A A . 93 LYS HZ1 1 1 10 18276 1 1 93 LYS HZ2 H -15.283 -8.219 -4.320 1.00 . A A . 93 LYS HZ2 1 1 10 18277 1 1 93 LYS N N -11.830 -10.273 -7.335 1.00 . A A . 93 LYS N 1 1 10 18278 1 1 93 LYS NZ N -14.339 -7.940 -4.077 1.00 . A A . 93 LYS NZ 1 1 10 18279 1 1 93 LYS O O -9.056 -8.251 -6.548 1.00 . A A . 93 LYS O 1 1 10 18280 1 1 94 LYS C C -8.114 -8.653 -9.528 1.00 . A A . 94 LYS C 1 1 10 18281 1 1 94 LYS CA C -7.957 -9.825 -8.558 1.00 . A A . 94 LYS CA 1 1 10 18282 1 1 94 LYS CB C -7.450 -11.108 -9.220 1.00 . A A . 94 LYS CB 1 1 10 18283 1 1 94 LYS CD C -5.604 -12.795 -8.894 1.00 . A A . 94 LYS CD 1 1 10 18284 1 1 94 LYS CE C -5.276 -13.339 -10.286 1.00 . A A . 94 LYS CE 1 1 10 18285 1 1 94 LYS CG C -5.956 -11.307 -8.956 1.00 . A A . 94 LYS CG 1 1 10 18286 1 1 94 LYS H H -9.719 -10.877 -8.198 1.00 . A A . 94 LYS H 1 1 10 18287 1 1 94 LYS HA H -7.230 -9.547 -7.794 1.00 . A A . 94 LYS HA 1 1 10 18288 1 1 94 LYS HB2 H -8.007 -11.964 -8.839 1.00 . A A . 94 LYS HB2 1 1 10 18289 1 1 94 LYS HB3 H -7.630 -11.063 -10.294 1.00 . A A . 94 LYS HB3 1 1 10 18290 1 1 94 LYS HD2 H -4.751 -12.944 -8.232 1.00 . A A . 94 LYS HD2 1 1 10 18291 1 1 94 LYS HD3 H -6.438 -13.353 -8.469 1.00 . A A . 94 LYS HD3 1 1 10 18292 1 1 94 LYS HE2 H -6.140 -13.866 -10.690 1.00 . A A . 94 LYS HE2 1 1 10 18293 1 1 94 LYS HE3 H -5.061 -12.513 -10.964 1.00 . A A . 94 LYS HE3 1 1 10 18294 1 1 94 LYS HG2 H -5.376 -10.825 -9.743 1.00 . A A . 94 LYS HG2 1 1 10 18295 1 1 94 LYS HG3 H -5.681 -10.826 -8.017 1.00 . A A . 94 LYS HG3 1 1 10 18296 1 1 94 LYS HZ1 H -3.346 -13.932 -10.804 1.00 . A A . 94 LYS HZ1 1 1 10 18297 1 1 94 LYS HZ2 H -3.751 -14.345 -9.282 1.00 . A A . 94 LYS HZ2 1 1 10 18298 1 1 94 LYS N N -9.223 -10.066 -7.887 1.00 . A A . 94 LYS N 1 1 10 18299 1 1 94 LYS NZ N -4.114 -14.253 -10.225 1.00 . A A . 94 LYS NZ 1 1 10 18300 1 1 94 LYS O O -7.154 -8.256 -10.188 1.00 . A A . 94 LYS O 1 1 10 18301 1 1 95 LYS C C -10.089 -5.819 -9.625 1.00 . A A . 95 LYS C 1 1 10 18302 1 1 95 LYS CA C -9.625 -7.012 -10.463 1.00 . A A . 95 LYS CA 1 1 10 18303 1 1 95 LYS CB C -10.623 -7.429 -11.544 1.00 . A A . 95 LYS CB 1 1 10 18304 1 1 95 LYS CD C -10.873 -7.569 -14.050 1.00 . A A . 95 LYS CD 1 1 10 18305 1 1 95 LYS CE C -9.762 -8.184 -14.904 1.00 . A A . 95 LYS CE 1 1 10 18306 1 1 95 LYS CG C -10.288 -6.770 -12.884 1.00 . A A . 95 LYS CG 1 1 10 18307 1 1 95 LYS H H -10.105 -8.459 -9.043 1.00 . A A . 95 LYS H 1 1 10 18308 1 1 95 LYS HA H -8.698 -6.740 -10.968 1.00 . A A . 95 LYS HA 1 1 10 18309 1 1 95 LYS HB2 H -10.613 -8.513 -11.656 1.00 . A A . 95 LYS HB2 1 1 10 18310 1 1 95 LYS HB3 H -11.632 -7.150 -11.240 1.00 . A A . 95 LYS HB3 1 1 10 18311 1 1 95 LYS HD2 H -11.521 -8.357 -13.667 1.00 . A A . 95 LYS HD2 1 1 10 18312 1 1 95 LYS HD3 H -11.493 -6.918 -14.667 1.00 . A A . 95 LYS HD3 1 1 10 18313 1 1 95 LYS HE2 H -8.800 -8.054 -14.409 1.00 . A A . 95 LYS HE2 1 1 10 18314 1 1 95 LYS HE3 H -9.926 -9.257 -15.005 1.00 . A A . 95 LYS HE3 1 1 10 18315 1 1 95 LYS HG2 H -10.681 -5.753 -12.901 1.00 . A A . 95 LYS HG2 1 1 10 18316 1 1 95 LYS HG3 H -9.206 -6.695 -12.996 1.00 . A A . 95 LYS HG3 1 1 10 18317 1 1 95 LYS HZ1 H -10.296 -8.058 -16.915 1.00 . A A . 95 LYS HZ1 1 1 10 18318 1 1 95 LYS HZ2 H -10.074 -6.601 -16.223 1.00 . A A . 95 LYS HZ2 1 1 10 18319 1 1 95 LYS N N -9.330 -8.131 -9.584 1.00 . A A . 95 LYS N 1 1 10 18320 1 1 95 LYS NZ N -9.728 -7.554 -16.243 1.00 . A A . 95 LYS NZ 1 1 10 18321 1 1 95 LYS O O -10.320 -4.734 -10.157 1.00 . A A . 95 LYS O 1 1 10 18322 1 1 96 ASP C C -9.557 -4.790 -6.357 1.00 . A A . 96 ASP C 1 1 10 18323 1 1 96 ASP CA C -10.643 -5.019 -7.411 1.00 . A A . 96 ASP CA 1 1 10 18324 1 1 96 ASP CB C -11.928 -5.422 -6.686 1.00 . A A . 96 ASP CB 1 1 10 18325 1 1 96 ASP CG C -13.150 -4.558 -7.006 1.00 . A A . 96 ASP CG 1 1 10 18326 1 1 96 ASP H H -10.020 -6.945 -7.903 1.00 . A A . 96 ASP H 1 1 10 18327 1 1 96 ASP HA H -10.811 -4.140 -8.033 1.00 . A A . 96 ASP HA 1 1 10 18328 1 1 96 ASP HB2 H -12.159 -6.458 -6.936 1.00 . A A . 96 ASP HB2 1 1 10 18329 1 1 96 ASP HB3 H -11.748 -5.386 -5.611 1.00 . A A . 96 ASP HB3 1 1 10 18330 1 1 96 ASP N N -10.210 -6.060 -8.328 1.00 . A A . 96 ASP N 1 1 10 18331 1 1 96 ASP O O -9.283 -3.652 -5.980 1.00 . A A . 96 ASP O 1 1 10 18332 1 1 96 ASP OD1 O -12.993 -3.642 -7.842 1.00 . A A . 96 ASP OD1 1 1 10 18333 1 1 96 ASP OD2 O -14.212 -4.834 -6.408 1.00 . A A . 96 ASP OD2 1 1 10 18334 1 1 97 LEU C C -6.569 -5.641 -5.600 1.00 . A A . 97 LEU C 1 1 10 18335 1 1 97 LEU CA C -7.921 -5.825 -4.907 1.00 . A A . 97 LEU CA 1 1 10 18336 1 1 97 LEU CB C -7.979 -7.048 -3.990 1.00 . A A . 97 LEU CB 1 1 10 18337 1 1 97 LEU CD1 C -8.972 -8.212 -1.985 1.00 . A A . 97 LEU CD1 1 1 10 18338 1 1 97 LEU CD2 C -9.400 -5.741 -2.366 1.00 . A A . 97 LEU CD2 1 1 10 18339 1 1 97 LEU CG C -9.163 -7.103 -3.021 1.00 . A A . 97 LEU CG 1 1 10 18340 1 1 97 LEU H H -9.199 -6.813 -6.223 1.00 . A A . 97 LEU H 1 1 10 18341 1 1 97 LEU HA H -8.115 -4.948 -4.289 1.00 . A A . 97 LEU HA 1 1 10 18342 1 1 97 LEU HB2 H -8.002 -7.943 -4.611 1.00 . A A . 97 LEU HB2 1 1 10 18343 1 1 97 LEU HB3 H -7.058 -7.086 -3.408 1.00 . A A . 97 LEU HB3 1 1 10 18344 1 1 97 LEU HD11 H -8.300 -8.972 -2.385 1.00 . A A . 97 LEU HD11 1 1 10 18345 1 1 97 LEU HD12 H -8.542 -7.791 -1.076 1.00 . A A . 97 LEU HD12 1 1 10 18346 1 1 97 LEU HD13 H -9.936 -8.665 -1.755 1.00 . A A . 97 LEU HD13 1 1 10 18347 1 1 97 LEU HD21 H -8.455 -5.201 -2.299 1.00 . A A . 97 LEU HD21 1 1 10 18348 1 1 97 LEU HD22 H -10.105 -5.167 -2.967 1.00 . A A . 97 LEU HD22 1 1 10 18349 1 1 97 LEU HD23 H -9.808 -5.885 -1.366 1.00 . A A . 97 LEU HD23 1 1 10 18350 1 1 97 LEU HG H -10.060 -7.347 -3.591 1.00 . A A . 97 LEU HG 1 1 10 18351 1 1 97 LEU N N -8.969 -5.891 -5.911 1.00 . A A . 97 LEU N 1 1 10 18352 1 1 97 LEU O O -5.663 -5.020 -5.046 1.00 . A A . 97 LEU O 1 1 10 18353 1 1 98 THR C C -5.546 -5.567 -8.981 1.00 . A A . 98 THR C 1 1 10 18354 1 1 98 THR CA C -5.250 -6.095 -7.576 1.00 . A A . 98 THR CA 1 1 10 18355 1 1 98 THR CB C -4.580 -7.470 -7.572 1.00 . A A . 98 THR CB 1 1 10 18356 1 1 98 THR CG2 C -4.676 -8.165 -6.212 1.00 . A A . 98 THR CG2 1 1 10 18357 1 1 98 THR H H -7.218 -6.693 -7.246 1.00 . A A . 98 THR H 1 1 10 18358 1 1 98 THR HA H -4.595 -5.370 -7.094 1.00 . A A . 98 THR HA 1 1 10 18359 1 1 98 THR HB H -3.543 -7.399 -7.901 1.00 . A A . 98 THR HB 1 1 10 18360 1 1 98 THR HG1 H -4.837 -8.789 -9.055 1.00 . A A . 98 THR HG1 1 1 10 18361 1 1 98 THR HG21 H -5.710 -8.153 -5.870 1.00 . A A . 98 THR HG21 1 1 10 18362 1 1 98 THR HG22 H -4.336 -9.196 -6.306 1.00 . A A . 98 THR HG22 1 1 10 18363 1 1 98 THR HG23 H -4.049 -7.640 -5.491 1.00 . A A . 98 THR HG23 1 1 10 18364 1 1 98 THR N N -6.476 -6.191 -6.802 1.00 . A A . 98 THR N 1 1 10 18365 1 1 98 THR O O -4.703 -5.657 -9.872 1.00 . A A . 98 THR O 1 1 10 18366 1 1 98 THR OG1 O -5.405 -8.261 -8.424 1.00 . A A . 98 THR OG1 1 1 10 18367 1 1 99 GLY C C -6.323 -3.267 -10.798 1.00 . A A . 99 GLY C 1 1 10 18368 1 1 99 GLY CA C -7.165 -4.487 -10.417 1.00 . A A . 99 GLY CA 1 1 10 18369 1 1 99 GLY H H -7.427 -4.959 -8.405 1.00 . A A . 99 GLY H 1 1 10 18370 1 1 99 GLY HA2 H -7.072 -5.252 -11.187 1.00 . A A . 99 GLY HA2 1 1 10 18371 1 1 99 GLY HA3 H -8.218 -4.207 -10.371 1.00 . A A . 99 GLY HA3 1 1 10 18372 1 1 99 GLY N N -6.747 -5.029 -9.135 1.00 . A A . 99 GLY N 1 1 10 18373 1 1 99 GLY O O -5.808 -2.568 -9.927 1.00 . A A . 99 GLY O 1 1 10 18374 1 1 100 CYS C C -6.377 -0.729 -12.755 1.00 . A A . 100 CYS C 1 1 10 18375 1 1 100 CYS CA C -5.438 -1.928 -12.607 1.00 . A A . 100 CYS CA 1 1 10 18376 1 1 100 CYS CB C -4.738 -2.271 -13.923 1.00 . A A . 100 CYS CB 1 1 10 18377 1 1 100 CYS H H -6.632 -3.624 -12.801 1.00 . A A . 100 CYS H 1 1 10 18378 1 1 100 CYS HA H -4.662 -1.723 -11.870 1.00 . A A . 100 CYS HA 1 1 10 18379 1 1 100 CYS HB2 H -5.303 -3.056 -14.425 1.00 . A A . 100 CYS HB2 1 1 10 18380 1 1 100 CYS HB3 H -4.763 -1.395 -14.571 1.00 . A A . 100 CYS HB3 1 1 10 18381 1 1 100 CYS N N -6.209 -3.050 -12.100 1.00 . A A . 100 CYS N 1 1 10 18382 1 1 100 CYS O O -6.127 0.334 -12.187 1.00 . A A . 100 CYS O 1 1 10 18383 1 1 100 CYS SG S -3.001 -2.820 -13.748 1.00 . A A . 100 CYS SG 1 1 10 18384 1 1 101 LYS C C -9.799 -0.384 -13.335 1.00 . A A . 101 LYS C 1 1 10 18385 1 1 101 LYS CA C -8.413 0.112 -13.752 1.00 . A A . 101 LYS CA 1 1 10 18386 1 1 101 LYS CB C -8.345 0.598 -15.202 1.00 . A A . 101 LYS CB 1 1 10 18387 1 1 101 LYS CD C -9.670 1.935 -16.880 1.00 . A A . 101 LYS CD 1 1 10 18388 1 1 101 LYS CE C -11.179 1.731 -17.033 1.00 . A A . 101 LYS CE 1 1 10 18389 1 1 101 LYS CG C -9.247 1.816 -15.415 1.00 . A A . 101 LYS CG 1 1 10 18390 1 1 101 LYS H H -7.633 -1.806 -13.980 1.00 . A A . 101 LYS H 1 1 10 18391 1 1 101 LYS HA H -8.142 0.955 -13.117 1.00 . A A . 101 LYS HA 1 1 10 18392 1 1 101 LYS HB2 H -7.317 0.853 -15.456 1.00 . A A . 101 LYS HB2 1 1 10 18393 1 1 101 LYS HB3 H -8.649 -0.205 -15.873 1.00 . A A . 101 LYS HB3 1 1 10 18394 1 1 101 LYS HD2 H -9.392 2.917 -17.264 1.00 . A A . 101 LYS HD2 1 1 10 18395 1 1 101 LYS HD3 H -9.137 1.196 -17.478 1.00 . A A . 101 LYS HD3 1 1 10 18396 1 1 101 LYS HE2 H -11.378 1.066 -17.874 1.00 . A A . 101 LYS HE2 1 1 10 18397 1 1 101 LYS HE3 H -11.578 1.246 -16.142 1.00 . A A . 101 LYS HE3 1 1 10 18398 1 1 101 LYS HG2 H -10.131 1.734 -14.782 1.00 . A A . 101 LYS HG2 1 1 10 18399 1 1 101 LYS HG3 H -8.720 2.720 -15.110 1.00 . A A . 101 LYS HG3 1 1 10 18400 1 1 101 LYS HZ1 H -12.812 2.909 -17.570 1.00 . A A . 101 LYS HZ1 1 1 10 18401 1 1 101 LYS HZ2 H -11.905 3.577 -16.394 1.00 . A A . 101 LYS HZ2 1 1 10 18402 1 1 101 LYS N N -7.437 -0.938 -13.522 1.00 . A A . 101 LYS N 1 1 10 18403 1 1 101 LYS NZ N -11.859 3.028 -17.246 1.00 . A A . 101 LYS NZ 1 1 10 18404 1 1 101 LYS O O -10.150 -1.537 -13.583 1.00 . A A . 101 LYS O 1 1 10 18405 1 1 102 LYS C C -11.795 -0.817 -11.092 1.00 . A A . 102 LYS C 1 1 10 18406 1 1 102 LYS CA C -11.888 0.177 -12.252 1.00 . A A . 102 LYS CA 1 1 10 18407 1 1 102 LYS CB C -12.742 -0.319 -13.420 1.00 . A A . 102 LYS CB 1 1 10 18408 1 1 102 LYS CD C -14.835 0.264 -14.702 1.00 . A A . 102 LYS CD 1 1 10 18409 1 1 102 LYS CE C -16.079 0.436 -13.829 1.00 . A A . 102 LYS CE 1 1 10 18410 1 1 102 LYS CG C -13.592 0.814 -13.998 1.00 . A A . 102 LYS CG 1 1 10 18411 1 1 102 LYS H H -10.256 1.445 -12.510 1.00 . A A . 102 LYS H 1 1 10 18412 1 1 102 LYS HA H -12.346 1.095 -11.885 1.00 . A A . 102 LYS HA 1 1 10 18413 1 1 102 LYS HB2 H -12.099 -0.730 -14.198 1.00 . A A . 102 LYS HB2 1 1 10 18414 1 1 102 LYS HB3 H -13.390 -1.129 -13.083 1.00 . A A . 102 LYS HB3 1 1 10 18415 1 1 102 LYS HD2 H -14.978 0.781 -15.651 1.00 . A A . 102 LYS HD2 1 1 10 18416 1 1 102 LYS HD3 H -14.689 -0.791 -14.932 1.00 . A A . 102 LYS HD3 1 1 10 18417 1 1 102 LYS HE2 H -16.691 -0.465 -13.876 1.00 . A A . 102 LYS HE2 1 1 10 18418 1 1 102 LYS HE3 H -15.785 0.567 -12.787 1.00 . A A . 102 LYS HE3 1 1 10 18419 1 1 102 LYS HG2 H -13.892 1.493 -13.200 1.00 . A A . 102 LYS HG2 1 1 10 18420 1 1 102 LYS HG3 H -12.998 1.395 -14.704 1.00 . A A . 102 LYS HG3 1 1 10 18421 1 1 102 LYS HZ1 H -16.638 2.442 -13.758 1.00 . A A . 102 LYS HZ1 1 1 10 18422 1 1 102 LYS HZ2 H -16.716 1.812 -15.258 1.00 . A A . 102 LYS HZ2 1 1 10 18423 1 1 102 LYS N N -10.549 0.510 -12.707 1.00 . A A . 102 LYS N 1 1 10 18424 1 1 102 LYS NZ N -16.871 1.603 -14.278 1.00 . A A . 102 LYS NZ 1 1 10 18425 1 1 102 LYS O O -12.497 -1.827 -11.078 1.00 . A A . 102 LYS O 1 1 10 18426 1 1 103 SER C C -11.037 -0.566 -7.708 1.00 . A A . 103 SER C 1 1 10 18427 1 1 103 SER CA C -10.729 -1.347 -8.987 1.00 . A A . 103 SER CA 1 1 10 18428 1 1 103 SER CB C -9.304 -1.900 -8.941 1.00 . A A . 103 SER CB 1 1 10 18429 1 1 103 SER H H -10.356 0.328 -10.167 1.00 . A A . 103 SER H 1 1 10 18430 1 1 103 SER HA H -11.434 -2.170 -9.112 1.00 . A A . 103 SER HA 1 1 10 18431 1 1 103 SER HB2 H -8.952 -1.912 -7.910 1.00 . A A . 103 SER HB2 1 1 10 18432 1 1 103 SER HB3 H -9.304 -2.933 -9.290 1.00 . A A . 103 SER HB3 1 1 10 18433 1 1 103 SER HG H -8.384 -0.186 -9.413 1.00 . A A . 103 SER HG 1 1 10 18434 1 1 103 SER N N -10.923 -0.495 -10.148 1.00 . A A . 103 SER N 1 1 10 18435 1 1 103 SER O O -11.522 0.563 -7.767 1.00 . A A . 103 SER O 1 1 10 18436 1 1 103 SER OG O -8.407 -1.131 -9.738 1.00 . A A . 103 SER OG 1 1 10 18437 1 1 104 LYS C C -9.919 0.495 -5.039 1.00 . A A . 104 LYS C 1 1 10 18438 1 1 104 LYS CA C -10.982 -0.577 -5.290 1.00 . A A . 104 LYS CA 1 1 10 18439 1 1 104 LYS CB C -11.056 -1.638 -4.190 1.00 . A A . 104 LYS CB 1 1 10 18440 1 1 104 LYS CD C -13.451 -1.945 -3.463 1.00 . A A . 104 LYS CD 1 1 10 18441 1 1 104 LYS CE C -14.327 -3.081 -2.929 1.00 . A A . 104 LYS CE 1 1 10 18442 1 1 104 LYS CG C -12.318 -2.491 -4.335 1.00 . A A . 104 LYS CG 1 1 10 18443 1 1 104 LYS H H -10.348 -2.116 -6.542 1.00 . A A . 104 LYS H 1 1 10 18444 1 1 104 LYS HA H -11.957 -0.092 -5.336 1.00 . A A . 104 LYS HA 1 1 10 18445 1 1 104 LYS HB2 H -10.174 -2.277 -4.236 1.00 . A A . 104 LYS HB2 1 1 10 18446 1 1 104 LYS HB3 H -11.049 -1.156 -3.213 1.00 . A A . 104 LYS HB3 1 1 10 18447 1 1 104 LYS HD2 H -13.034 -1.380 -2.630 1.00 . A A . 104 LYS HD2 1 1 10 18448 1 1 104 LYS HD3 H -14.061 -1.254 -4.044 1.00 . A A . 104 LYS HD3 1 1 10 18449 1 1 104 LYS HE2 H -13.697 -3.878 -2.533 1.00 . A A . 104 LYS HE2 1 1 10 18450 1 1 104 LYS HE3 H -14.939 -2.718 -2.103 1.00 . A A . 104 LYS HE3 1 1 10 18451 1 1 104 LYS HG2 H -12.633 -2.506 -5.379 1.00 . A A . 104 LYS HG2 1 1 10 18452 1 1 104 LYS HG3 H -12.100 -3.520 -4.052 1.00 . A A . 104 LYS HG3 1 1 10 18453 1 1 104 LYS HZ1 H -15.304 -2.956 -4.765 1.00 . A A . 104 LYS HZ1 1 1 10 18454 1 1 104 LYS HZ2 H -14.826 -4.469 -4.400 1.00 . A A . 104 LYS HZ2 1 1 10 18455 1 1 104 LYS N N -10.743 -1.198 -6.581 1.00 . A A . 104 LYS N 1 1 10 18456 1 1 104 LYS NZ N -15.196 -3.614 -4.001 1.00 . A A . 104 LYS NZ 1 1 10 18457 1 1 104 LYS O O -10.181 1.487 -4.361 1.00 . A A . 104 LYS O 1 1 10 18458 1 1 105 CYS C C -7.789 2.291 -6.500 1.00 . A A . 105 CYS C 1 1 10 18459 1 1 105 CYS CA C -7.639 1.191 -5.447 1.00 . A A . 105 CYS CA 1 1 10 18460 1 1 105 CYS CB C -6.285 0.486 -5.546 1.00 . A A . 105 CYS CB 1 1 10 18461 1 1 105 CYS H H -8.538 -0.551 -6.152 1.00 . A A . 105 CYS H 1 1 10 18462 1 1 105 CYS HA H -7.717 1.605 -4.441 1.00 . A A . 105 CYS HA 1 1 10 18463 1 1 105 CYS HB2 H -6.179 0.020 -6.526 1.00 . A A . 105 CYS HB2 1 1 10 18464 1 1 105 CYS HB3 H -5.479 1.214 -5.451 1.00 . A A . 105 CYS HB3 1 1 10 18465 1 1 105 CYS N N -8.743 0.259 -5.601 1.00 . A A . 105 CYS N 1 1 10 18466 1 1 105 CYS O O -7.999 3.454 -6.162 1.00 . A A . 105 CYS O 1 1 10 18467 1 1 105 CYS SG S -6.141 -0.781 -4.234 1.00 . A A . 105 CYS SG 1 1 10 18468 1 1 106 HIS C C -9.220 2.783 -9.411 1.00 . A A . 106 HIS C 1 1 10 18469 1 1 106 HIS CA C -7.794 2.819 -8.860 1.00 . A A . 106 HIS CA 1 1 10 18470 1 1 106 HIS CB C -6.737 2.536 -9.930 1.00 . A A . 106 HIS CB 1 1 10 18471 1 1 106 HIS CD2 C -4.282 1.811 -9.401 1.00 . A A . 106 HIS CD2 1 1 10 18472 1 1 106 HIS CE1 C -3.559 3.717 -8.606 1.00 . A A . 106 HIS CE1 1 1 10 18473 1 1 106 HIS CG C -5.316 2.700 -9.448 1.00 . A A . 106 HIS CG 1 1 10 18474 1 1 106 HIS H H -7.503 0.935 -8.022 1.00 . A A . 106 HIS H 1 1 10 18475 1 1 106 HIS HA H -7.596 3.811 -8.452 1.00 . A A . 106 HIS HA 1 1 10 18476 1 1 106 HIS HB2 H -6.870 1.518 -10.296 1.00 . A A . 106 HIS HB2 1 1 10 18477 1 1 106 HIS HB3 H -6.903 3.203 -10.775 1.00 . A A . 106 HIS HB3 1 1 10 18478 1 1 106 HIS HD1 H -5.349 4.741 -8.840 1.00 . A A . 106 HIS HD1 1 1 10 18479 1 1 106 HIS HD2 H -4.320 0.772 -9.726 1.00 . A A . 106 HIS HD2 1 1 10 18480 1 1 106 HIS HE1 H -2.900 4.472 -8.177 1.00 . A A . 106 HIS HE1 1 1 10 18481 1 1 106 HIS N N -7.674 1.883 -7.755 1.00 . A A . 106 HIS N 1 1 10 18482 1 1 106 HIS ND1 N -4.830 3.892 -8.939 1.00 . A A . 106 HIS ND1 1 1 10 18483 1 1 106 HIS NE2 N -3.221 2.427 -8.893 1.00 . A A . 106 HIS NE2 1 1 10 18484 1 1 106 HIS O O -9.840 1.722 -9.469 1.00 . A A . 106 HIS O 1 1 10 18485 1 1 107 GLU C C -10.986 4.551 -11.799 1.00 . A A . 107 GLU C 1 1 10 18486 1 1 107 GLU CA C -11.042 4.071 -10.347 1.00 . A A . 107 GLU CA 1 1 10 18487 1 1 107 GLU CB C -11.901 5.004 -9.493 1.00 . A A . 107 GLU CB 1 1 10 18488 1 1 107 GLU CD C -14.007 3.998 -8.538 1.00 . A A . 107 GLU CD 1 1 10 18489 1 1 107 GLU CG C -12.516 4.254 -8.309 1.00 . A A . 107 GLU CG 1 1 10 18490 1 1 107 GLU H H -9.188 4.813 -9.752 1.00 . A A . 107 GLU H 1 1 10 18491 1 1 107 GLU HA H -11.458 3.064 -10.306 1.00 . A A . 107 GLU HA 1 1 10 18492 1 1 107 GLU HB2 H -11.293 5.832 -9.127 1.00 . A A . 107 GLU HB2 1 1 10 18493 1 1 107 GLU HB3 H -12.693 5.437 -10.105 1.00 . A A . 107 GLU HB3 1 1 10 18494 1 1 107 GLU HG2 H -11.998 3.306 -8.167 1.00 . A A . 107 GLU HG2 1 1 10 18495 1 1 107 GLU HG3 H -12.378 4.834 -7.396 1.00 . A A . 107 GLU HG3 1 1 10 18496 1 1 107 GLU N N -9.699 3.955 -9.803 1.00 . A A . 107 GLU N 1 1 10 18497 1 1 107 GLU O O -11.946 5.133 -12.301 1.00 . A A . 107 GLU O 1 1 10 18498 1 1 107 GLU OXT O -9.932 4.324 -12.432 1.00 . A A . 107 GLU OXT 1 1 10 18499 1 1 107 GLU OE1 O -14.341 3.549 -9.655 1.00 . A A . 107 GLU OE1 1 1 10 18500 1 1 107 GLU OE2 O -14.779 4.258 -7.589 1.00 . A A . 107 GLU OE2 1 1 10 18501 2 2 1 HEC C1A C -1.144 5.396 9.260 1.00 . B A . 108 HEC C1A 1 1 10 18502 2 2 1 HEC C1B C -1.999 2.261 12.108 1.00 . B A . 108 HEC C1B 1 1 10 18503 2 2 1 HEC C1C C -2.217 -0.615 8.843 1.00 . B A . 108 HEC C1C 1 1 10 18504 2 2 1 HEC C1D C -1.148 2.502 6.048 1.00 . B A . 108 HEC C1D 1 1 10 18505 2 2 1 HEC C2A C -1.028 6.470 10.218 1.00 . B A . 108 HEC C2A 1 1 10 18506 2 2 1 HEC C2B C -2.390 1.359 13.165 1.00 . B A . 108 HEC C2B 1 1 10 18507 2 2 1 HEC C2C C -2.269 -1.693 7.885 1.00 . B A . 108 HEC C2C 1 1 10 18508 2 2 1 HEC C2D C -0.744 3.414 5.003 1.00 . B A . 108 HEC C2D 1 1 10 18509 2 2 1 HEC C3A C -1.232 5.936 11.441 1.00 . B A . 108 HEC C3A 1 1 10 18510 2 2 1 HEC C3B C -2.559 0.142 12.607 1.00 . B A . 108 HEC C3B 1 1 10 18511 2 2 1 HEC C3C C -1.959 -1.169 6.680 1.00 . B A . 108 HEC C3C 1 1 10 18512 2 2 1 HEC C3D C -0.643 4.638 5.562 1.00 . B A . 108 HEC C3D 1 1 10 18513 2 2 1 HEC C4A C -1.475 4.525 11.252 1.00 . B A . 108 HEC C4A 1 1 10 18514 2 2 1 HEC C4B C -2.274 0.278 11.198 1.00 . B A . 108 HEC C4B 1 1 10 18515 2 2 1 HEC C4C C -1.712 0.239 6.881 1.00 . B A . 108 HEC C4C 1 1 10 18516 2 2 1 HEC C4D C -0.984 4.498 6.958 1.00 . B A . 108 HEC C4D 1 1 10 18517 2 2 1 HEC CAA C -0.735 7.901 9.873 1.00 . B A . 108 HEC CAA 1 1 10 18518 2 2 1 HEC CAB C -2.964 -1.136 13.282 1.00 . B A . 108 HEC CAB 1 1 10 18519 2 2 1 HEC CAC C -1.876 -1.876 5.358 1.00 . B A . 108 HEC CAC 1 1 10 18520 2 2 1 HEC CAD C -0.254 5.927 4.898 1.00 . B A . 108 HEC CAD 1 1 10 18521 2 2 1 HEC CBA C 0.318 8.552 10.765 1.00 . B A . 108 HEC CBA 1 1 10 18522 2 2 1 HEC CBB C -4.206 -1.009 14.158 1.00 . B A . 108 HEC CBB 1 1 10 18523 2 2 1 HEC CBC C -2.895 -2.999 5.190 1.00 . B A . 108 HEC CBC 1 1 10 18524 2 2 1 HEC CBD C -0.843 6.108 3.502 1.00 . B A . 108 HEC CBD 1 1 10 18525 2 2 1 HEC CGA C -0.252 9.761 11.493 1.00 . B A . 108 HEC CGA 1 1 10 18526 2 2 1 HEC CGD C 0.255 6.302 2.466 1.00 . B A . 108 HEC CGD 1 1 10 18527 2 2 1 HEC CHA C -0.997 5.555 7.886 1.00 . B A . 108 HEC CHA 1 1 10 18528 2 2 1 HEC CHB C -1.733 3.614 12.292 1.00 . B A . 108 HEC CHB 1 1 10 18529 2 2 1 HEC CHC C -2.338 -0.774 10.266 1.00 . B A . 108 HEC CHC 1 1 10 18530 2 2 1 HEC CHD C -1.358 1.140 5.860 1.00 . B A . 108 HEC CHD 1 1 10 18531 2 2 1 HEC CMA C -1.217 6.634 12.769 1.00 . B A . 108 HEC CMA 1 1 10 18532 2 2 1 HEC CMB C -2.564 1.748 14.605 1.00 . B A . 108 HEC CMB 1 1 10 18533 2 2 1 HEC CMC C -2.610 -3.118 8.212 1.00 . B A . 108 HEC CMC 1 1 10 18534 2 2 1 HEC CMD C -0.493 3.026 3.575 1.00 . B A . 108 HEC CMD 1 1 10 18535 2 2 1 HEC FE FE -1.629 2.385 9.067 1.00 . B A . 108 HEC FE 1 1 10 18536 2 2 1 HEC HAA1 H -0.369 7.960 8.848 1.00 . B A . 108 HEC HAA1 1 1 10 18537 2 2 1 HEC HAA2 H -1.646 8.492 9.967 1.00 . B A . 108 HEC HAA2 1 1 10 18538 2 2 1 HEC HAB H -3.179 -1.893 12.528 1.00 . B A . 108 HEC HAB 1 1 10 18539 2 2 1 HEC HAC H -2.048 -1.162 4.553 1.00 . B A . 108 HEC HAC 1 1 10 18540 2 2 1 HEC HAD1 H -0.598 6.766 5.503 1.00 . B A . 108 HEC HAD1 1 1 10 18541 2 2 1 HEC HAD2 H 0.830 5.972 4.798 1.00 . B A . 108 HEC HAD2 1 1 10 18542 2 2 1 HEC HBA1 H 0.663 7.830 11.505 1.00 . B A . 108 HEC HBA1 1 1 10 18543 2 2 1 HEC HBA2 H 1.160 8.878 10.155 1.00 . B A . 108 HEC HBA2 1 1 10 18544 2 2 1 HEC HBB1 H -3.919 -0.649 15.146 1.00 . B A . 108 HEC HBB1 1 1 10 18545 2 2 1 HEC HBB2 H -4.902 -0.303 13.703 1.00 . B A . 108 HEC HBB2 1 1 10 18546 2 2 1 HEC HBB3 H -4.686 -1.983 14.252 1.00 . B A . 108 HEC HBB3 1 1 10 18547 2 2 1 HEC HBC1 H -3.108 -3.141 4.130 1.00 . B A . 108 HEC HBC1 1 1 10 18548 2 2 1 HEC HBC2 H -2.492 -3.922 5.606 1.00 . B A . 108 HEC HBC2 1 1 10 18549 2 2 1 HEC HBC3 H -3.815 -2.736 5.713 1.00 . B A . 108 HEC HBC3 1 1 10 18550 2 2 1 HEC HBD1 H -1.423 5.225 3.234 1.00 . B A . 108 HEC HBD1 1 1 10 18551 2 2 1 HEC HBD2 H -1.491 6.985 3.492 1.00 . B A . 108 HEC HBD2 1 1 10 18552 2 2 1 HEC HHA H -0.884 6.567 7.497 1.00 . B A . 108 HEC HHA 1 1 10 18553 2 2 1 HEC HHB H -1.722 3.999 13.312 1.00 . B A . 108 HEC HHB 1 1 10 18554 2 2 1 HEC HHC H -2.500 -1.780 10.654 1.00 . B A . 108 HEC HHC 1 1 10 18555 2 2 1 HEC HHD H -1.241 0.739 4.853 1.00 . B A . 108 HEC HHD 1 1 10 18556 2 2 1 HEC HMA1 H -1.730 6.020 13.509 1.00 . B A . 108 HEC HMA1 1 1 10 18557 2 2 1 HEC HMA2 H -0.186 6.795 13.083 1.00 . B A . 108 HEC HMA2 1 1 10 18558 2 2 1 HEC HMA3 H -1.724 7.595 12.680 1.00 . B A . 108 HEC HMA3 1 1 10 18559 2 2 1 HEC HMB1 H -2.455 0.865 15.235 1.00 . B A . 108 HEC HMB1 1 1 10 18560 2 2 1 HEC HMB2 H -1.808 2.484 14.876 1.00 . B A . 108 HEC HMB2 1 1 10 18561 2 2 1 HEC HMB3 H -3.556 2.176 14.748 1.00 . B A . 108 HEC HMB3 1 1 10 18562 2 2 1 HEC HMC1 H -3.678 -3.280 8.064 1.00 . B A . 108 HEC HMC1 1 1 10 18563 2 2 1 HEC HMC2 H -2.047 -3.786 7.560 1.00 . B A . 108 HEC HMC2 1 1 10 18564 2 2 1 HEC HMC3 H -2.352 -3.323 9.252 1.00 . B A . 108 HEC HMC3 1 1 10 18565 2 2 1 HEC HMD1 H 0.023 2.066 3.544 1.00 . B A . 108 HEC HMD1 1 1 10 18566 2 2 1 HEC HMD2 H -1.444 2.943 3.049 1.00 . B A . 108 HEC HMD2 1 1 10 18567 2 2 1 HEC HMD3 H 0.123 3.785 3.095 1.00 . B A . 108 HEC HMD3 1 1 10 18568 2 2 1 HEC NA N -1.419 4.204 9.906 1.00 . B A . 108 HEC NA 1 1 10 18569 2 2 1 HEC NB N -1.931 1.585 10.901 1.00 . B A . 108 HEC NB 1 1 10 18570 2 2 1 HEC NC N -1.873 0.570 8.215 1.00 . B A . 108 HEC NC 1 1 10 18571 2 2 1 HEC ND N -1.293 3.180 7.246 1.00 . B A . 108 HEC ND 1 1 10 18572 2 2 1 HEC O1A O -0.692 10.694 10.786 1.00 . B A . 108 HEC O1A 1 1 10 18573 2 2 1 HEC O1D O 0.060 7.172 1.589 1.00 . B A . 108 HEC O1D 1 1 10 18574 2 2 1 HEC O2A O -0.238 9.730 12.743 1.00 . B A . 108 HEC O2A 1 1 10 18575 2 2 1 HEC O2D O 1.268 5.578 2.569 1.00 . B A . 108 HEC O2D 1 1 10 18576 3 2 1 HEC C1A C 9.633 -1.834 1.758 1.00 . C A . 109 HEC C1A 1 1 10 18577 3 2 1 HEC C1B C 5.775 -0.136 2.713 1.00 . C A . 109 HEC C1B 1 1 10 18578 3 2 1 HEC C1C C 7.765 2.908 5.157 1.00 . C A . 109 HEC C1C 1 1 10 18579 3 2 1 HEC C1D C 11.599 1.373 3.887 1.00 . C A . 109 HEC C1D 1 1 10 18580 3 2 1 HEC C2A C 9.141 -2.934 0.962 1.00 . C A . 109 HEC C2A 1 1 10 18581 3 2 1 HEC C2B C 4.413 0.216 3.041 1.00 . C A . 109 HEC C2B 1 1 10 18582 3 2 1 HEC C2C C 8.269 4.054 5.877 1.00 . C A . 109 HEC C2C 1 1 10 18583 3 2 1 HEC C2D C 12.953 0.957 3.605 1.00 . C A . 109 HEC C2D 1 1 10 18584 3 2 1 HEC C3A C 7.797 -2.816 0.911 1.00 . C A . 109 HEC C3A 1 1 10 18585 3 2 1 HEC C3B C 4.468 1.266 3.887 1.00 . C A . 109 HEC C3B 1 1 10 18586 3 2 1 HEC C3C C 9.613 4.038 5.755 1.00 . C A . 109 HEC C3C 1 1 10 18587 3 2 1 HEC C3D C 12.876 -0.187 2.894 1.00 . C A . 109 HEC C3D 1 1 10 18588 3 2 1 HEC C4A C 7.444 -1.642 1.674 1.00 . C A . 109 HEC C4A 1 1 10 18589 3 2 1 HEC C4B C 5.864 1.575 4.091 1.00 . C A . 109 HEC C4B 1 1 10 18590 3 2 1 HEC C4C C 9.954 2.883 4.958 1.00 . C A . 109 HEC C4C 1 1 10 18591 3 2 1 HEC C4D C 11.474 -0.492 2.729 1.00 . C A . 109 HEC C4D 1 1 10 18592 3 2 1 HEC CAA C 10.000 -3.989 0.329 1.00 . C A . 109 HEC CAA 1 1 10 18593 3 2 1 HEC CAB C 3.324 2.004 4.519 1.00 . C A . 109 HEC CAB 1 1 10 18594 3 2 1 HEC CAC C 10.604 5.014 6.321 1.00 . C A . 109 HEC CAC 1 1 10 18595 3 2 1 HEC CAD C 14.005 -1.019 2.356 1.00 . C A . 109 HEC CAD 1 1 10 18596 3 2 1 HEC CBA C 10.235 -3.785 -1.164 1.00 . C A . 109 HEC CBA 1 1 10 18597 3 2 1 HEC CBB C 2.298 1.098 5.195 1.00 . C A . 109 HEC CBB 1 1 10 18598 3 2 1 HEC CBC C 10.582 5.107 7.844 1.00 . C A . 109 HEC CBC 1 1 10 18599 3 2 1 HEC CBD C 15.210 -1.106 3.289 1.00 . C A . 109 HEC CBD 1 1 10 18600 3 2 1 HEC CGA C 10.948 -4.982 -1.776 1.00 . C A . 109 HEC CGA 1 1 10 18601 3 2 1 HEC CGD C 16.240 -0.037 2.955 1.00 . C A . 109 HEC CGD 1 1 10 18602 3 2 1 HEC CHA C 10.977 -1.613 2.039 1.00 . C A . 109 HEC CHA 1 1 10 18603 3 2 1 HEC CHB C 6.130 -1.177 1.862 1.00 . C A . 109 HEC CHB 1 1 10 18604 3 2 1 HEC CHC C 6.339 2.613 4.913 1.00 . C A . 109 HEC CHC 1 1 10 18605 3 2 1 HEC CHD C 11.266 2.517 4.605 1.00 . C A . 109 HEC CHD 1 1 10 18606 3 2 1 HEC CMA C 6.817 -3.710 0.208 1.00 . C A . 109 HEC CMA 1 1 10 18607 3 2 1 HEC CMB C 3.195 -0.485 2.515 1.00 . C A . 109 HEC CMB 1 1 10 18608 3 2 1 HEC CMC C 7.419 5.050 6.610 1.00 . C A . 109 HEC CMC 1 1 10 18609 3 2 1 HEC CMD C 14.186 1.693 4.042 1.00 . C A . 109 HEC CMD 1 1 10 18610 3 2 1 HEC FE FE 8.687 0.582 3.374 1.00 . C A . 109 HEC FE 1 1 10 18611 3 2 1 HEC HAA1 H 10.979 -3.997 0.810 1.00 . C A . 109 HEC HAA1 1 1 10 18612 3 2 1 HEC HAA2 H 9.528 -4.964 0.451 1.00 . C A . 109 HEC HAA2 1 1 10 18613 3 2 1 HEC HAB H 3.706 2.682 5.282 1.00 . C A . 109 HEC HAB 1 1 10 18614 3 2 1 HEC HAC H 11.612 4.718 6.031 1.00 . C A . 109 HEC HAC 1 1 10 18615 3 2 1 HEC HAD1 H 13.656 -2.037 2.185 1.00 . C A . 109 HEC HAD1 1 1 10 18616 3 2 1 HEC HAD2 H 14.355 -0.592 1.417 1.00 . C A . 109 HEC HAD2 1 1 10 18617 3 2 1 HEC HBA1 H 9.277 -3.656 -1.668 1.00 . C A . 109 HEC HBA1 1 1 10 18618 3 2 1 HEC HBA2 H 10.848 -2.897 -1.318 1.00 . C A . 109 HEC HBA2 1 1 10 18619 3 2 1 HEC HBB1 H 2.061 1.491 6.183 1.00 . C A . 109 HEC HBB1 1 1 10 18620 3 2 1 HEC HBB2 H 1.392 1.061 4.590 1.00 . C A . 109 HEC HBB2 1 1 10 18621 3 2 1 HEC HBB3 H 2.710 0.093 5.293 1.00 . C A . 109 HEC HBB3 1 1 10 18622 3 2 1 HEC HBC1 H 11.561 5.425 8.203 1.00 . C A . 109 HEC HBC1 1 1 10 18623 3 2 1 HEC HBC2 H 9.829 5.831 8.153 1.00 . C A . 109 HEC HBC2 1 1 10 18624 3 2 1 HEC HBC3 H 10.341 4.130 8.264 1.00 . C A . 109 HEC HBC3 1 1 10 18625 3 2 1 HEC HBD1 H 14.883 -0.966 4.319 1.00 . C A . 109 HEC HBD1 1 1 10 18626 3 2 1 HEC HBD2 H 15.678 -2.085 3.186 1.00 . C A . 109 HEC HBD2 1 1 10 18627 3 2 1 HEC HHA H 11.700 -2.358 1.704 1.00 . C A . 109 HEC HHA 1 1 10 18628 3 2 1 HEC HHB H 5.338 -1.670 1.298 1.00 . C A . 109 HEC HHB 1 1 10 18629 3 2 1 HEC HHC H 5.598 3.233 5.419 1.00 . C A . 109 HEC HHC 1 1 10 18630 3 2 1 HEC HHD H 12.074 3.178 4.918 1.00 . C A . 109 HEC HHD 1 1 10 18631 3 2 1 HEC HMA1 H 7.241 -4.038 -0.741 1.00 . C A . 109 HEC HMA1 1 1 10 18632 3 2 1 HEC HMA2 H 6.605 -4.578 0.832 1.00 . C A . 109 HEC HMA2 1 1 10 18633 3 2 1 HEC HMA3 H 5.893 -3.161 0.023 1.00 . C A . 109 HEC HMA3 1 1 10 18634 3 2 1 HEC HMB1 H 2.430 -0.515 3.291 1.00 . C A . 109 HEC HMB1 1 1 10 18635 3 2 1 HEC HMB2 H 2.812 0.054 1.648 1.00 . C A . 109 HEC HMB2 1 1 10 18636 3 2 1 HEC HMB3 H 3.457 -1.502 2.224 1.00 . C A . 109 HEC HMB3 1 1 10 18637 3 2 1 HEC HMC1 H 6.506 4.565 6.954 1.00 . C A . 109 HEC HMC1 1 1 10 18638 3 2 1 HEC HMC2 H 7.970 5.437 7.467 1.00 . C A . 109 HEC HMC2 1 1 10 18639 3 2 1 HEC HMC3 H 7.164 5.872 5.941 1.00 . C A . 109 HEC HMC3 1 1 10 18640 3 2 1 HEC HMD1 H 14.839 1.014 4.590 1.00 . C A . 109 HEC HMD1 1 1 10 18641 3 2 1 HEC HMD2 H 14.711 2.075 3.166 1.00 . C A . 109 HEC HMD2 1 1 10 18642 3 2 1 HEC HMD3 H 13.903 2.525 4.687 1.00 . C A . 109 HEC HMD3 1 1 10 18643 3 2 1 HEC NA N 8.582 -1.045 2.191 1.00 . C A . 109 HEC NA 1 1 10 18644 3 2 1 HEC NB N 6.659 0.706 3.365 1.00 . C A . 109 HEC NB 1 1 10 18645 3 2 1 HEC NC N 8.810 2.195 4.596 1.00 . C A . 109 HEC NC 1 1 10 18646 3 2 1 HEC ND N 10.698 0.474 3.344 1.00 . C A . 109 HEC ND 1 1 10 18647 3 2 1 HEC O1A O 11.532 -5.758 -0.988 1.00 . C A . 109 HEC O1A 1 1 10 18648 3 2 1 HEC O1D O 16.909 0.423 3.905 1.00 . C A . 109 HEC O1D 1 1 10 18649 3 2 1 HEC O2A O 10.897 -5.100 -3.019 1.00 . C A . 109 HEC O2A 1 1 10 18650 3 2 1 HEC O2D O 16.338 0.302 1.755 1.00 . C A . 109 HEC O2D 1 1 10 18651 4 2 1 HEC C1A C -8.677 -3.383 0.469 1.00 . D A . 110 HEC C1A 1 1 10 18652 4 2 1 HEC C1B C -4.964 -1.192 0.176 1.00 . D A . 110 HEC C1B 1 1 10 18653 4 2 1 HEC C1C C -2.894 -4.451 2.153 1.00 . D A . 110 HEC C1C 1 1 10 18654 4 2 1 HEC C1D C -6.625 -6.602 2.495 1.00 . D A . 110 HEC C1D 1 1 10 18655 4 2 1 HEC C2A C -9.487 -2.446 -0.272 1.00 . D A . 110 HEC C2A 1 1 10 18656 4 2 1 HEC C2B C -3.799 -0.373 -0.064 1.00 . D A . 110 HEC C2B 1 1 10 18657 4 2 1 HEC C2C C -2.054 -5.470 2.738 1.00 . D A . 110 HEC C2C 1 1 10 18658 4 2 1 HEC C2D C -7.798 -7.391 2.792 1.00 . D A . 110 HEC C2D 1 1 10 18659 4 2 1 HEC C3A C -8.682 -1.424 -0.633 1.00 . D A . 110 HEC C3A 1 1 10 18660 4 2 1 HEC C3B C -2.754 -0.985 0.532 1.00 . D A . 110 HEC C3B 1 1 10 18661 4 2 1 HEC C3C C -2.856 -6.505 3.065 1.00 . D A . 110 HEC C3C 1 1 10 18662 4 2 1 HEC C3D C -8.859 -6.733 2.280 1.00 . D A . 110 HEC C3D 1 1 10 18663 4 2 1 HEC C4A C -7.366 -1.718 -0.118 1.00 . D A . 110 HEC C4A 1 1 10 18664 4 2 1 HEC C4B C -3.261 -2.189 1.147 1.00 . D A . 110 HEC C4B 1 1 10 18665 4 2 1 HEC C4C C -4.200 -6.137 2.686 1.00 . D A . 110 HEC C4C 1 1 10 18666 4 2 1 HEC C4D C -8.354 -5.530 1.660 1.00 . D A . 110 HEC C4D 1 1 10 18667 4 2 1 HEC CAA C -10.949 -2.618 -0.564 1.00 . D A . 110 HEC CAA 1 1 10 18668 4 2 1 HEC CAB C -1.322 -0.536 0.574 1.00 . D A . 110 HEC CAB 1 1 10 18669 4 2 1 HEC CAC C -2.470 -7.808 3.703 1.00 . D A . 110 HEC CAC 1 1 10 18670 4 2 1 HEC CAD C -10.304 -7.137 2.321 1.00 . D A . 110 HEC CAD 1 1 10 18671 4 2 1 HEC CBA C -11.867 -2.122 0.549 1.00 . D A . 110 HEC CBA 1 1 10 18672 4 2 1 HEC CBB C -1.138 0.914 1.011 1.00 . D A . 110 HEC CBB 1 1 10 18673 4 2 1 HEC CBC C -1.171 -7.747 4.500 1.00 . D A . 110 HEC CBC 1 1 10 18674 4 2 1 HEC CBD C -10.922 -7.376 0.947 1.00 . D A . 110 HEC CBD 1 1 10 18675 4 2 1 HEC CGA C -12.827 -3.215 0.996 1.00 . D A . 110 HEC CGA 1 1 10 18676 4 2 1 HEC CGD C -11.694 -8.687 0.913 1.00 . D A . 110 HEC CGD 1 1 10 18677 4 2 1 HEC CHA C -9.154 -4.572 1.011 1.00 . D A . 110 HEC CHA 1 1 10 18678 4 2 1 HEC CHB C -6.241 -0.890 -0.284 1.00 . D A . 110 HEC CHB 1 1 10 18679 4 2 1 HEC CHC C -2.477 -3.106 1.870 1.00 . D A . 110 HEC CHC 1 1 10 18680 4 2 1 HEC CHD C -5.331 -6.955 2.864 1.00 . D A . 110 HEC CHD 1 1 10 18681 4 2 1 HEC CMA C -9.043 -0.197 -1.418 1.00 . D A . 110 HEC CMA 1 1 10 18682 4 2 1 HEC CMB C -3.798 0.913 -0.838 1.00 . D A . 110 HEC CMB 1 1 10 18683 4 2 1 HEC CMC C -0.570 -5.355 2.928 1.00 . D A . 110 HEC CMC 1 1 10 18684 4 2 1 HEC CMD C -7.789 -8.695 3.536 1.00 . D A . 110 HEC CMD 1 1 10 18685 4 2 1 HEC FE FE -5.796 -3.891 1.352 1.00 . D A . 110 HEC FE 1 1 10 18686 4 2 1 HEC HAA1 H -11.207 -2.063 -1.466 1.00 . D A . 110 HEC HAA1 1 1 10 18687 4 2 1 HEC HAA2 H -11.168 -3.676 -0.714 1.00 . D A . 110 HEC HAA2 1 1 10 18688 4 2 1 HEC HAB H -0.767 -1.157 1.278 1.00 . D A . 110 HEC HAB 1 1 10 18689 4 2 1 HEC HAC H -3.255 -8.123 4.390 1.00 . D A . 110 HEC HAC 1 1 10 18690 4 2 1 HEC HAD1 H -10.407 -8.064 2.886 1.00 . D A . 110 HEC HAD1 1 1 10 18691 4 2 1 HEC HAD2 H -10.887 -6.352 2.803 1.00 . D A . 110 HEC HAD2 1 1 10 18692 4 2 1 HEC HBA1 H -11.266 -1.814 1.405 1.00 . D A . 110 HEC HBA1 1 1 10 18693 4 2 1 HEC HBA2 H -12.448 -1.273 0.189 1.00 . D A . 110 HEC HBA2 1 1 10 18694 4 2 1 HEC HBB1 H -0.074 1.138 1.089 1.00 . D A . 110 HEC HBB1 1 1 10 18695 4 2 1 HEC HBB2 H -1.596 1.576 0.276 1.00 . D A . 110 HEC HBB2 1 1 10 18696 4 2 1 HEC HBB3 H -1.613 1.064 1.981 1.00 . D A . 110 HEC HBB3 1 1 10 18697 4 2 1 HEC HBC1 H -1.108 -6.792 5.021 1.00 . D A . 110 HEC HBC1 1 1 10 18698 4 2 1 HEC HBC2 H -1.153 -8.559 5.228 1.00 . D A . 110 HEC HBC2 1 1 10 18699 4 2 1 HEC HBC3 H -0.323 -7.848 3.822 1.00 . D A . 110 HEC HBC3 1 1 10 18700 4 2 1 HEC HBD1 H -11.607 -6.562 0.709 1.00 . D A . 110 HEC HBD1 1 1 10 18701 4 2 1 HEC HBD2 H -10.133 -7.417 0.196 1.00 . D A . 110 HEC HBD2 1 1 10 18702 4 2 1 HEC HHA H -10.221 -4.780 0.928 1.00 . D A . 110 HEC HHA 1 1 10 18703 4 2 1 HEC HHB H -6.385 0.054 -0.811 1.00 . D A . 110 HEC HHB 1 1 10 18704 4 2 1 HEC HHC H -1.488 -2.779 2.191 1.00 . D A . 110 HEC HHC 1 1 10 18705 4 2 1 HEC HHD H -5.178 -7.931 3.323 1.00 . D A . 110 HEC HHD 1 1 10 18706 4 2 1 HEC HMA1 H -8.642 0.685 -0.918 1.00 . D A . 110 HEC HMA1 1 1 10 18707 4 2 1 HEC HMA2 H -8.620 -0.269 -2.420 1.00 . D A . 110 HEC HMA2 1 1 10 18708 4 2 1 HEC HMA3 H -10.127 -0.115 -1.487 1.00 . D A . 110 HEC HMA3 1 1 10 18709 4 2 1 HEC HMB1 H -4.688 0.959 -1.466 1.00 . D A . 110 HEC HMB1 1 1 10 18710 4 2 1 HEC HMB2 H -3.799 1.754 -0.145 1.00 . D A . 110 HEC HMB2 1 1 10 18711 4 2 1 HEC HMB3 H -2.908 0.959 -1.465 1.00 . D A . 110 HEC HMB3 1 1 10 18712 4 2 1 HEC HMC1 H -0.191 -4.522 2.336 1.00 . D A . 110 HEC HMC1 1 1 10 18713 4 2 1 HEC HMC2 H -0.350 -5.183 3.981 1.00 . D A . 110 HEC HMC2 1 1 10 18714 4 2 1 HEC HMC3 H -0.090 -6.279 2.603 1.00 . D A . 110 HEC HMC3 1 1 10 18715 4 2 1 HEC HMD1 H -8.706 -8.787 4.118 1.00 . D A . 110 HEC HMD1 1 1 10 18716 4 2 1 HEC HMD2 H -7.727 -9.519 2.824 1.00 . D A . 110 HEC HMD2 1 1 10 18717 4 2 1 HEC HMD3 H -6.929 -8.727 4.204 1.00 . D A . 110 HEC HMD3 1 1 10 18718 4 2 1 HEC NA N -7.373 -2.925 0.559 1.00 . D A . 110 HEC NA 1 1 10 18719 4 2 1 HEC NB N -4.621 -2.307 0.922 1.00 . D A . 110 HEC NB 1 1 10 18720 4 2 1 HEC NC N -4.212 -4.872 2.126 1.00 . D A . 110 HEC NC 1 1 10 18721 4 2 1 HEC ND N -6.979 -5.460 1.799 1.00 . D A . 110 HEC ND 1 1 10 18722 4 2 1 HEC O1A O -14.047 -2.939 0.982 1.00 . D A . 110 HEC O1A 1 1 10 18723 4 2 1 HEC O1D O -12.911 -8.636 1.192 1.00 . D A . 110 HEC O1D 1 1 10 18724 4 2 1 HEC O2A O -12.325 -4.305 1.342 1.00 . D A . 110 HEC O2A 1 1 10 18725 4 2 1 HEC O2D O -11.052 -9.716 0.610 1.00 . D A . 110 HEC O2D 1 1 10 18726 5 2 1 HEC C1A C 0.027 4.045 -9.132 1.00 . E A . 111 HEC C1A 1 1 10 18727 5 2 1 HEC C1B C -1.276 0.623 -11.427 1.00 . E A . 111 HEC C1B 1 1 10 18728 5 2 1 HEC C1C C -3.127 -1.051 -7.847 1.00 . E A . 111 HEC C1C 1 1 10 18729 5 2 1 HEC C1D C -1.794 2.380 -5.584 1.00 . E A . 111 HEC C1D 1 1 10 18730 5 2 1 HEC C2A C 0.615 4.774 -10.231 1.00 . E A . 111 HEC C2A 1 1 10 18731 5 2 1 HEC C2B C -1.432 -0.531 -12.281 1.00 . E A . 111 HEC C2B 1 1 10 18732 5 2 1 HEC C2C C -3.875 -1.678 -6.783 1.00 . E A . 111 HEC C2C 1 1 10 18733 5 2 1 HEC C2D C -1.262 3.345 -4.651 1.00 . E A . 111 HEC C2D 1 1 10 18734 5 2 1 HEC C3A C 0.423 4.035 -11.345 1.00 . E A . 111 HEC C3A 1 1 10 18735 5 2 1 HEC C3B C -2.055 -1.481 -11.553 1.00 . E A . 111 HEC C3B 1 1 10 18736 5 2 1 HEC C3C C -3.765 -0.882 -5.698 1.00 . E A . 111 HEC C3C 1 1 10 18737 5 2 1 HEC C3D C -0.534 4.228 -5.366 1.00 . E A . 111 HEC C3D 1 1 10 18738 5 2 1 HEC C4A C -0.285 2.841 -10.946 1.00 . E A . 111 HEC C4A 1 1 10 18739 5 2 1 HEC C4B C -2.291 -0.925 -10.242 1.00 . E A . 111 HEC C4B 1 1 10 18740 5 2 1 HEC C4C C -2.949 0.246 -6.081 1.00 . E A . 111 HEC C4C 1 1 10 18741 5 2 1 HEC C4D C -0.608 3.819 -6.749 1.00 . E A . 111 HEC C4D 1 1 10 18742 5 2 1 HEC CAA C 1.301 6.103 -10.111 1.00 . E A . 111 HEC CAA 1 1 10 18743 5 2 1 HEC CAB C -2.448 -2.865 -11.983 1.00 . E A . 111 HEC CAB 1 1 10 18744 5 2 1 HEC CAC C -4.360 -1.089 -4.336 1.00 . E A . 111 HEC CAC 1 1 10 18745 5 2 1 HEC CAD C 0.225 5.422 -4.863 1.00 . E A . 111 HEC CAD 1 1 10 18746 5 2 1 HEC CBA C 2.707 6.131 -10.704 1.00 . E A . 111 HEC CBA 1 1 10 18747 5 2 1 HEC CBB C -1.365 -3.916 -11.755 1.00 . E A . 111 HEC CBB 1 1 10 18748 5 2 1 HEC CBC C -4.194 -2.506 -3.795 1.00 . E A . 111 HEC CBC 1 1 10 18749 5 2 1 HEC CBD C -0.639 6.663 -4.654 1.00 . E A . 111 HEC CBD 1 1 10 18750 5 2 1 HEC CGA C 2.802 7.136 -11.843 1.00 . E A . 111 HEC CGA 1 1 10 18751 5 2 1 HEC CGD C 0.211 7.861 -4.255 1.00 . E A . 111 HEC CGD 1 1 10 18752 5 2 1 HEC CHA C 0.023 4.488 -7.813 1.00 . E A . 111 HEC CHA 1 1 10 18753 5 2 1 HEC CHB C -0.673 1.813 -11.824 1.00 . E A . 111 HEC CHB 1 1 10 18754 5 2 1 HEC CHC C -2.924 -1.609 -9.188 1.00 . E A . 111 HEC CHC 1 1 10 18755 5 2 1 HEC CHD C -2.601 1.306 -5.223 1.00 . E A . 111 HEC CHD 1 1 10 18756 5 2 1 HEC CMA C 0.848 4.352 -12.749 1.00 . E A . 111 HEC CMA 1 1 10 18757 5 2 1 HEC CMB C -0.971 -0.613 -13.707 1.00 . E A . 111 HEC CMB 1 1 10 18758 5 2 1 HEC CMC C -4.620 -2.976 -6.905 1.00 . E A . 111 HEC CMC 1 1 10 18759 5 2 1 HEC CMD C -1.500 3.328 -3.169 1.00 . E A . 111 HEC CMD 1 1 10 18760 5 2 1 HEC FE FE -1.570 1.510 -8.509 1.00 . E A . 111 HEC FE 1 1 10 18761 5 2 1 HEC HAA1 H 0.717 6.862 -10.632 1.00 . E A . 111 HEC HAA1 1 1 10 18762 5 2 1 HEC HAA2 H 1.390 6.372 -9.059 1.00 . E A . 111 HEC HAA2 1 1 10 18763 5 2 1 HEC HAB H -3.328 -3.183 -11.424 1.00 . E A . 111 HEC HAB 1 1 10 18764 5 2 1 HEC HAC H -3.882 -0.416 -3.625 1.00 . E A . 111 HEC HAC 1 1 10 18765 5 2 1 HEC HAD1 H 0.683 5.183 -3.904 1.00 . E A . 111 HEC HAD1 1 1 10 18766 5 2 1 HEC HAD2 H 1.001 5.688 -5.581 1.00 . E A . 111 HEC HAD2 1 1 10 18767 5 2 1 HEC HBA1 H 3.422 6.412 -9.930 1.00 . E A . 111 HEC HBA1 1 1 10 18768 5 2 1 HEC HBA2 H 2.959 5.143 -11.089 1.00 . E A . 111 HEC HBA2 1 1 10 18769 5 2 1 HEC HBB1 H -1.147 -3.987 -10.689 1.00 . E A . 111 HEC HBB1 1 1 10 18770 5 2 1 HEC HBB2 H -1.715 -4.882 -12.120 1.00 . E A . 111 HEC HBB2 1 1 10 18771 5 2 1 HEC HBB3 H -0.462 -3.630 -12.293 1.00 . E A . 111 HEC HBB3 1 1 10 18772 5 2 1 HEC HBC1 H -5.010 -3.132 -4.158 1.00 . E A . 111 HEC HBC1 1 1 10 18773 5 2 1 HEC HBC2 H -3.244 -2.917 -4.136 1.00 . E A . 111 HEC HBC2 1 1 10 18774 5 2 1 HEC HBC3 H -4.210 -2.484 -2.705 1.00 . E A . 111 HEC HBC3 1 1 10 18775 5 2 1 HEC HBD1 H -1.164 6.900 -5.578 1.00 . E A . 111 HEC HBD1 1 1 10 18776 5 2 1 HEC HBD2 H -1.364 6.471 -3.862 1.00 . E A . 111 HEC HBD2 1 1 10 18777 5 2 1 HEC HHA H 0.544 5.418 -7.585 1.00 . E A . 111 HEC HHA 1 1 10 18778 5 2 1 HEC HHB H -0.487 1.963 -12.887 1.00 . E A . 111 HEC HHB 1 1 10 18779 5 2 1 HEC HHC H -3.277 -2.621 -9.385 1.00 . E A . 111 HEC HHC 1 1 10 18780 5 2 1 HEC HHD H -2.993 1.279 -4.207 1.00 . E A . 111 HEC HHD 1 1 10 18781 5 2 1 HEC HMA1 H 1.471 5.246 -12.747 1.00 . E A . 111 HEC HMA1 1 1 10 18782 5 2 1 HEC HMA2 H 1.414 3.515 -13.156 1.00 . E A . 111 HEC HMA2 1 1 10 18783 5 2 1 HEC HMA3 H -0.035 4.527 -13.365 1.00 . E A . 111 HEC HMA3 1 1 10 18784 5 2 1 HEC HMB1 H -0.489 -1.576 -13.878 1.00 . E A . 111 HEC HMB1 1 1 10 18785 5 2 1 HEC HMB2 H -1.828 -0.513 -14.373 1.00 . E A . 111 HEC HMB2 1 1 10 18786 5 2 1 HEC HMB3 H -0.260 0.190 -13.906 1.00 . E A . 111 HEC HMB3 1 1 10 18787 5 2 1 HEC HMC1 H -4.281 -3.664 -6.131 1.00 . E A . 111 HEC HMC1 1 1 10 18788 5 2 1 HEC HMC2 H -5.688 -2.793 -6.788 1.00 . E A . 111 HEC HMC2 1 1 10 18789 5 2 1 HEC HMC3 H -4.431 -3.412 -7.886 1.00 . E A . 111 HEC HMC3 1 1 10 18790 5 2 1 HEC HMD1 H -2.032 4.234 -2.877 1.00 . E A . 111 HEC HMD1 1 1 10 18791 5 2 1 HEC HMD2 H -2.098 2.455 -2.907 1.00 . E A . 111 HEC HMD2 1 1 10 18792 5 2 1 HEC HMD3 H -0.544 3.284 -2.648 1.00 . E A . 111 HEC HMD3 1 1 10 18793 5 2 1 HEC NA N -0.524 2.858 -9.583 1.00 . E A . 111 HEC NA 1 1 10 18794 5 2 1 HEC NB N -1.808 0.370 -10.175 1.00 . E A . 111 HEC NB 1 1 10 18795 5 2 1 HEC NC N -2.562 0.132 -7.405 1.00 . E A . 111 HEC NC 1 1 10 18796 5 2 1 HEC ND N -1.386 2.681 -6.872 1.00 . E A . 111 HEC ND 1 1 10 18797 5 2 1 HEC O1A O 2.429 8.305 -11.601 1.00 . E A . 111 HEC O1A 1 1 10 18798 5 2 1 HEC O1D O 0.975 8.330 -5.127 1.00 . E A . 111 HEC O1D 1 1 10 18799 5 2 1 HEC O2A O 3.245 6.718 -12.934 1.00 . E A . 111 HEC O2A 1 1 10 18800 5 2 1 HEC O2D O 0.081 8.286 -3.087 1.00 . E A . 111 HEC O2D 1 1 11 18801 1 1 1 ALA C C -0.091 3.222 19.926 1.00 . A A . 1 ALA C 1 1 11 18802 1 1 1 ALA CA C 1.257 2.502 19.856 1.00 . A A . 1 ALA CA 1 1 11 18803 1 1 1 ALA CB C 1.109 0.981 19.929 1.00 . A A . 1 ALA CB 1 1 11 18804 1 1 1 ALA H1 H 1.666 2.732 21.831 1.00 . A A . 1 ALA H1 1 1 11 18805 1 1 1 ALA H2 H 3.006 2.503 20.886 1.00 . A A . 1 ALA H2 1 1 11 18806 1 1 1 ALA HA H 1.750 2.762 18.920 1.00 . A A . 1 ALA HA 1 1 11 18807 1 1 1 ALA HB1 H 1.275 0.648 20.954 1.00 . A A . 1 ALA HB1 1 1 11 18808 1 1 1 ALA HB2 H 0.105 0.697 19.614 1.00 . A A . 1 ALA HB2 1 1 11 18809 1 1 1 ALA HB3 H 1.842 0.513 19.272 1.00 . A A . 1 ALA HB3 1 1 11 18810 1 1 1 ALA N N 2.103 2.960 20.945 1.00 . A A . 1 ALA N 1 1 11 18811 1 1 1 ALA O O -0.986 2.803 20.658 1.00 . A A . 1 ALA O 1 1 11 18812 1 1 2 PRO C C -2.510 4.384 18.302 1.00 . A A . 2 PRO C 1 1 11 18813 1 1 2 PRO CA C -1.421 5.105 19.099 1.00 . A A . 2 PRO CA 1 1 11 18814 1 1 2 PRO CB C -1.019 6.436 18.485 1.00 . A A . 2 PRO CB 1 1 11 18815 1 1 2 PRO CD C 0.842 4.848 18.253 1.00 . A A . 2 PRO CD 1 1 11 18816 1 1 2 PRO CG C 0.302 6.187 17.775 1.00 . A A . 2 PRO CG 1 1 11 18817 1 1 2 PRO HA H -1.787 5.218 20.022 1.00 . A A . 2 PRO HA 1 1 11 18818 1 1 2 PRO HB2 H -1.777 6.789 17.786 1.00 . A A . 2 PRO HB2 1 1 11 18819 1 1 2 PRO HB3 H -0.911 7.203 19.252 1.00 . A A . 2 PRO HB3 1 1 11 18820 1 1 2 PRO HD2 H 1.030 4.175 17.416 1.00 . A A . 2 PRO HD2 1 1 11 18821 1 1 2 PRO HD3 H 1.787 4.969 18.783 1.00 . A A . 2 PRO HD3 1 1 11 18822 1 1 2 PRO HG2 H 0.158 6.176 16.695 1.00 . A A . 2 PRO HG2 1 1 11 18823 1 1 2 PRO HG3 H 1.010 6.985 17.995 1.00 . A A . 2 PRO HG3 1 1 11 18824 1 1 2 PRO N N -0.197 4.322 19.133 1.00 . A A . 2 PRO N 1 1 11 18825 1 1 2 PRO O O -2.315 3.254 17.858 1.00 . A A . 2 PRO O 1 1 11 18826 1 1 3 LYS C C -4.612 4.854 15.927 1.00 . A A . 3 LYS C 1 1 11 18827 1 1 3 LYS CA C -4.755 4.507 17.410 1.00 . A A . 3 LYS CA 1 1 11 18828 1 1 3 LYS CB C -6.080 4.963 18.024 1.00 . A A . 3 LYS CB 1 1 11 18829 1 1 3 LYS CD C -8.047 4.210 19.412 1.00 . A A . 3 LYS CD 1 1 11 18830 1 1 3 LYS CE C -9.223 3.235 19.344 1.00 . A A . 3 LYS CE 1 1 11 18831 1 1 3 LYS CG C -6.912 3.765 18.487 1.00 . A A . 3 LYS CG 1 1 11 18832 1 1 3 LYS H H -3.785 5.987 18.509 1.00 . A A . 3 LYS H 1 1 11 18833 1 1 3 LYS HA H -4.707 3.423 17.518 1.00 . A A . 3 LYS HA 1 1 11 18834 1 1 3 LYS HB2 H -5.886 5.624 18.868 1.00 . A A . 3 LYS HB2 1 1 11 18835 1 1 3 LYS HB3 H -6.644 5.541 17.291 1.00 . A A . 3 LYS HB3 1 1 11 18836 1 1 3 LYS HD2 H -7.681 4.274 20.437 1.00 . A A . 3 LYS HD2 1 1 11 18837 1 1 3 LYS HD3 H -8.380 5.209 19.129 1.00 . A A . 3 LYS HD3 1 1 11 18838 1 1 3 LYS HE2 H -10.162 3.789 19.324 1.00 . A A . 3 LYS HE2 1 1 11 18839 1 1 3 LYS HE3 H -9.173 2.659 18.420 1.00 . A A . 3 LYS HE3 1 1 11 18840 1 1 3 LYS HG2 H -7.325 3.249 17.621 1.00 . A A . 3 LYS HG2 1 1 11 18841 1 1 3 LYS HG3 H -6.271 3.053 19.007 1.00 . A A . 3 LYS HG3 1 1 11 18842 1 1 3 LYS HZ1 H -8.771 1.431 20.285 1.00 . A A . 3 LYS HZ1 1 1 11 18843 1 1 3 LYS HZ2 H -8.692 2.710 21.290 1.00 . A A . 3 LYS HZ2 1 1 11 18844 1 1 3 LYS N N -3.634 5.068 18.145 1.00 . A A . 3 LYS N 1 1 11 18845 1 1 3 LYS NZ N -9.205 2.320 20.507 1.00 . A A . 3 LYS NZ 1 1 11 18846 1 1 3 LYS O O -3.888 5.782 15.570 1.00 . A A . 3 LYS O 1 1 11 18847 1 1 4 ALA C C -5.886 5.667 13.342 1.00 . A A . 4 ALA C 1 1 11 18848 1 1 4 ALA CA C -5.273 4.304 13.667 1.00 . A A . 4 ALA CA 1 1 11 18849 1 1 4 ALA CB C -5.995 3.156 12.958 1.00 . A A . 4 ALA CB 1 1 11 18850 1 1 4 ALA H H -5.899 3.336 15.402 1.00 . A A . 4 ALA H 1 1 11 18851 1 1 4 ALA HA H -4.227 4.303 13.360 1.00 . A A . 4 ALA HA 1 1 11 18852 1 1 4 ALA HB1 H -5.885 2.242 13.542 1.00 . A A . 4 ALA HB1 1 1 11 18853 1 1 4 ALA HB2 H -7.052 3.398 12.858 1.00 . A A . 4 ALA HB2 1 1 11 18854 1 1 4 ALA HB3 H -5.560 3.009 11.969 1.00 . A A . 4 ALA HB3 1 1 11 18855 1 1 4 ALA N N -5.313 4.089 15.103 1.00 . A A . 4 ALA N 1 1 11 18856 1 1 4 ALA O O -6.710 6.177 14.099 1.00 . A A . 4 ALA O 1 1 11 18857 1 1 5 PRO C C -7.369 7.411 11.197 1.00 . A A . 5 PRO C 1 1 11 18858 1 1 5 PRO CA C -5.947 7.527 11.750 1.00 . A A . 5 PRO CA 1 1 11 18859 1 1 5 PRO CB C -4.944 8.006 10.713 1.00 . A A . 5 PRO CB 1 1 11 18860 1 1 5 PRO CD C -4.475 5.657 11.262 1.00 . A A . 5 PRO CD 1 1 11 18861 1 1 5 PRO CG C -4.182 6.768 10.267 1.00 . A A . 5 PRO CG 1 1 11 18862 1 1 5 PRO HA H -6.006 8.155 12.526 1.00 . A A . 5 PRO HA 1 1 11 18863 1 1 5 PRO HB2 H -5.449 8.478 9.870 1.00 . A A . 5 PRO HB2 1 1 11 18864 1 1 5 PRO HB3 H -4.269 8.749 11.137 1.00 . A A . 5 PRO HB3 1 1 11 18865 1 1 5 PRO HD2 H -4.875 4.774 10.764 1.00 . A A . 5 PRO HD2 1 1 11 18866 1 1 5 PRO HD3 H -3.571 5.346 11.785 1.00 . A A . 5 PRO HD3 1 1 11 18867 1 1 5 PRO HG2 H -4.488 6.472 9.264 1.00 . A A . 5 PRO HG2 1 1 11 18868 1 1 5 PRO HG3 H -3.112 6.973 10.227 1.00 . A A . 5 PRO HG3 1 1 11 18869 1 1 5 PRO N N -5.450 6.233 12.184 1.00 . A A . 5 PRO N 1 1 11 18870 1 1 5 PRO O O -7.851 6.308 10.941 1.00 . A A . 5 PRO O 1 1 11 18871 1 1 6 ALA C C -9.413 7.859 9.177 1.00 . A A . 6 ALA C 1 1 11 18872 1 1 6 ALA CA C -9.358 8.604 10.512 1.00 . A A . 6 ALA CA 1 1 11 18873 1 1 6 ALA CB C -9.812 10.060 10.387 1.00 . A A . 6 ALA CB 1 1 11 18874 1 1 6 ALA H H -7.601 9.455 11.239 1.00 . A A . 6 ALA H 1 1 11 18875 1 1 6 ALA HA H -10.002 8.096 11.229 1.00 . A A . 6 ALA HA 1 1 11 18876 1 1 6 ALA HB1 H -8.949 10.719 10.472 1.00 . A A . 6 ALA HB1 1 1 11 18877 1 1 6 ALA HB2 H -10.289 10.209 9.418 1.00 . A A . 6 ALA HB2 1 1 11 18878 1 1 6 ALA HB3 H -10.523 10.288 11.181 1.00 . A A . 6 ALA HB3 1 1 11 18879 1 1 6 ALA N N -8.001 8.563 11.029 1.00 . A A . 6 ALA N 1 1 11 18880 1 1 6 ALA O O -8.402 7.334 8.712 1.00 . A A . 6 ALA O 1 1 11 18881 1 1 7 ASP C C -10.698 8.186 6.190 1.00 . A A . 7 ASP C 1 1 11 18882 1 1 7 ASP CA C -10.804 7.165 7.324 1.00 . A A . 7 ASP CA 1 1 11 18883 1 1 7 ASP CB C -12.191 6.522 7.253 1.00 . A A . 7 ASP CB 1 1 11 18884 1 1 7 ASP CG C -13.329 7.478 6.891 1.00 . A A . 7 ASP CG 1 1 11 18885 1 1 7 ASP H H -11.421 8.267 8.981 1.00 . A A . 7 ASP H 1 1 11 18886 1 1 7 ASP HA H -10.024 6.405 7.276 1.00 . A A . 7 ASP HA 1 1 11 18887 1 1 7 ASP HB2 H -12.165 5.717 6.518 1.00 . A A . 7 ASP HB2 1 1 11 18888 1 1 7 ASP HB3 H -12.413 6.065 8.218 1.00 . A A . 7 ASP HB3 1 1 11 18889 1 1 7 ASP N N -10.604 7.837 8.597 1.00 . A A . 7 ASP N 1 1 11 18890 1 1 7 ASP O O -10.498 9.375 6.437 1.00 . A A . 7 ASP O 1 1 11 18891 1 1 7 ASP OD1 O -13.496 7.728 5.678 1.00 . A A . 7 ASP OD1 1 1 11 18892 1 1 7 ASP OD2 O -14.007 7.937 7.836 1.00 . A A . 7 ASP OD2 1 1 11 18893 1 1 8 GLY C C -9.328 9.036 3.576 1.00 . A A . 8 GLY C 1 1 11 18894 1 1 8 GLY CA C -10.758 8.540 3.798 1.00 . A A . 8 GLY CA 1 1 11 18895 1 1 8 GLY H H -10.999 6.718 4.779 1.00 . A A . 8 GLY H 1 1 11 18896 1 1 8 GLY HA2 H -11.097 7.990 2.920 1.00 . A A . 8 GLY HA2 1 1 11 18897 1 1 8 GLY HA3 H -11.428 9.392 3.919 1.00 . A A . 8 GLY HA3 1 1 11 18898 1 1 8 GLY N N -10.837 7.686 4.971 1.00 . A A . 8 GLY N 1 1 11 18899 1 1 8 GLY O O -9.119 10.097 2.989 1.00 . A A . 8 GLY O 1 1 11 18900 1 1 9 LEU C C -6.535 8.347 2.473 1.00 . A A . 9 LEU C 1 1 11 18901 1 1 9 LEU CA C -6.976 8.591 3.917 1.00 . A A . 9 LEU CA 1 1 11 18902 1 1 9 LEU CB C -6.134 7.840 4.951 1.00 . A A . 9 LEU CB 1 1 11 18903 1 1 9 LEU CD1 C -4.104 6.668 4.023 1.00 . A A . 9 LEU CD1 1 1 11 18904 1 1 9 LEU CD2 C -4.211 9.202 4.053 1.00 . A A . 9 LEU CD2 1 1 11 18905 1 1 9 LEU CG C -4.618 7.906 4.758 1.00 . A A . 9 LEU CG 1 1 11 18906 1 1 9 LEU H H -8.558 7.384 4.532 1.00 . A A . 9 LEU H 1 1 11 18907 1 1 9 LEU HA H -6.878 9.655 4.134 1.00 . A A . 9 LEU HA 1 1 11 18908 1 1 9 LEU HB2 H -6.372 8.234 5.939 1.00 . A A . 9 LEU HB2 1 1 11 18909 1 1 9 LEU HB3 H -6.436 6.793 4.944 1.00 . A A . 9 LEU HB3 1 1 11 18910 1 1 9 LEU HD11 H -4.762 5.823 4.229 1.00 . A A . 9 LEU HD11 1 1 11 18911 1 1 9 LEU HD12 H -4.089 6.862 2.950 1.00 . A A . 9 LEU HD12 1 1 11 18912 1 1 9 LEU HD13 H -3.095 6.435 4.364 1.00 . A A . 9 LEU HD13 1 1 11 18913 1 1 9 LEU HD21 H -4.871 10.010 4.369 1.00 . A A . 9 LEU HD21 1 1 11 18914 1 1 9 LEU HD22 H -3.182 9.450 4.314 1.00 . A A . 9 LEU HD22 1 1 11 18915 1 1 9 LEU HD23 H -4.291 9.068 2.974 1.00 . A A . 9 LEU HD23 1 1 11 18916 1 1 9 LEU HG H -4.148 7.915 5.742 1.00 . A A . 9 LEU HG 1 1 11 18917 1 1 9 LEU N N -8.380 8.245 4.056 1.00 . A A . 9 LEU N 1 1 11 18918 1 1 9 LEU O O -6.214 7.220 2.099 1.00 . A A . 9 LEU O 1 1 11 18919 1 1 10 LYS C C -4.706 9.854 0.152 1.00 . A A . 10 LYS C 1 1 11 18920 1 1 10 LYS CA C -6.139 9.340 0.303 1.00 . A A . 10 LYS CA 1 1 11 18921 1 1 10 LYS CB C -7.150 10.069 -0.585 1.00 . A A . 10 LYS CB 1 1 11 18922 1 1 10 LYS CD C -7.459 11.334 -2.744 1.00 . A A . 10 LYS CD 1 1 11 18923 1 1 10 LYS CE C -7.264 12.790 -2.316 1.00 . A A . 10 LYS CE 1 1 11 18924 1 1 10 LYS CG C -6.543 10.402 -1.949 1.00 . A A . 10 LYS CG 1 1 11 18925 1 1 10 LYS H H -6.797 10.336 2.010 1.00 . A A . 10 LYS H 1 1 11 18926 1 1 10 LYS HA H -6.161 8.288 0.019 1.00 . A A . 10 LYS HA 1 1 11 18927 1 1 10 LYS HB2 H -8.037 9.449 -0.718 1.00 . A A . 10 LYS HB2 1 1 11 18928 1 1 10 LYS HB3 H -7.475 10.987 -0.094 1.00 . A A . 10 LYS HB3 1 1 11 18929 1 1 10 LYS HD2 H -7.250 11.233 -3.809 1.00 . A A . 10 LYS HD2 1 1 11 18930 1 1 10 LYS HD3 H -8.499 11.043 -2.595 1.00 . A A . 10 LYS HD3 1 1 11 18931 1 1 10 LYS HE2 H -8.179 13.354 -2.498 1.00 . A A . 10 LYS HE2 1 1 11 18932 1 1 10 LYS HE3 H -7.067 12.837 -1.245 1.00 . A A . 10 LYS HE3 1 1 11 18933 1 1 10 LYS HG2 H -5.569 10.872 -1.813 1.00 . A A . 10 LYS HG2 1 1 11 18934 1 1 10 LYS HG3 H -6.377 9.482 -2.511 1.00 . A A . 10 LYS HG3 1 1 11 18935 1 1 10 LYS HZ1 H -5.278 13.385 -2.528 1.00 . A A . 10 LYS HZ1 1 1 11 18936 1 1 10 LYS HZ2 H -5.957 12.922 -3.934 1.00 . A A . 10 LYS HZ2 1 1 11 18937 1 1 10 LYS N N -6.534 9.423 1.699 1.00 . A A . 10 LYS N 1 1 11 18938 1 1 10 LYS NZ N -6.141 13.403 -3.060 1.00 . A A . 10 LYS NZ 1 1 11 18939 1 1 10 LYS O O -4.300 10.785 0.845 1.00 . A A . 10 LYS O 1 1 11 18940 1 1 11 MET C C -2.403 10.027 -2.467 1.00 . A A . 11 MET C 1 1 11 18941 1 1 11 MET CA C -2.599 9.605 -1.009 1.00 . A A . 11 MET CA 1 1 11 18942 1 1 11 MET CB C -1.677 8.426 -0.691 1.00 . A A . 11 MET CB 1 1 11 18943 1 1 11 MET CE C -0.269 5.524 -0.232 1.00 . A A . 11 MET CE 1 1 11 18944 1 1 11 MET CG C -2.260 7.115 -1.222 1.00 . A A . 11 MET CG 1 1 11 18945 1 1 11 MET H H -4.316 8.467 -1.319 1.00 . A A . 11 MET H 1 1 11 18946 1 1 11 MET HA H -2.404 10.450 -0.350 1.00 . A A . 11 MET HA 1 1 11 18947 1 1 11 MET HB2 H -0.696 8.597 -1.133 1.00 . A A . 11 MET HB2 1 1 11 18948 1 1 11 MET HB3 H -1.533 8.354 0.387 1.00 . A A . 11 MET HB3 1 1 11 18949 1 1 11 MET HE1 H -0.988 5.725 0.562 1.00 . A A . 11 MET HE1 1 1 11 18950 1 1 11 MET HE2 H -0.057 4.455 -0.269 1.00 . A A . 11 MET HE2 1 1 11 18951 1 1 11 MET HE3 H 0.654 6.070 -0.033 1.00 . A A . 11 MET HE3 1 1 11 18952 1 1 11 MET HG2 H -2.828 6.615 -0.437 1.00 . A A . 11 MET HG2 1 1 11 18953 1 1 11 MET HG3 H -2.956 7.320 -2.036 1.00 . A A . 11 MET HG3 1 1 11 18954 1 1 11 MET N N -3.978 9.224 -0.759 1.00 . A A . 11 MET N 1 1 11 18955 1 1 11 MET O O -2.391 9.186 -3.364 1.00 . A A . 11 MET O 1 1 11 18956 1 1 11 MET SD S -0.947 6.051 -1.796 1.00 . A A . 11 MET SD 1 1 11 18957 1 1 12 GLU C C -0.598 12.280 -4.190 1.00 . A A . 12 GLU C 1 1 11 18958 1 1 12 GLU CA C -2.059 11.874 -3.991 1.00 . A A . 12 GLU CA 1 1 11 18959 1 1 12 GLU CB C -2.996 13.057 -4.242 1.00 . A A . 12 GLU CB 1 1 11 18960 1 1 12 GLU CD C -1.920 14.405 -6.082 1.00 . A A . 12 GLU CD 1 1 11 18961 1 1 12 GLU CG C -3.035 13.418 -5.728 1.00 . A A . 12 GLU CG 1 1 11 18962 1 1 12 GLU H H -2.264 12.007 -1.922 1.00 . A A . 12 GLU H 1 1 11 18963 1 1 12 GLU HA H -2.315 11.064 -4.674 1.00 . A A . 12 GLU HA 1 1 11 18964 1 1 12 GLU HB2 H -4.001 12.809 -3.898 1.00 . A A . 12 GLU HB2 1 1 11 18965 1 1 12 GLU HB3 H -2.664 13.918 -3.663 1.00 . A A . 12 GLU HB3 1 1 11 18966 1 1 12 GLU HG2 H -2.931 12.515 -6.329 1.00 . A A . 12 GLU HG2 1 1 11 18967 1 1 12 GLU HG3 H -4.003 13.855 -5.975 1.00 . A A . 12 GLU HG3 1 1 11 18968 1 1 12 GLU N N -2.254 11.330 -2.657 1.00 . A A . 12 GLU N 1 1 11 18969 1 1 12 GLU O O -0.288 13.466 -4.293 1.00 . A A . 12 GLU O 1 1 11 18970 1 1 12 GLU OE1 O -1.971 15.534 -5.549 1.00 . A A . 12 GLU OE1 1 1 11 18971 1 1 12 GLU OE2 O -1.041 14.007 -6.877 1.00 . A A . 12 GLU OE2 1 1 11 18972 1 1 13 ALA C C 2.045 11.296 -5.894 1.00 . A A . 13 ALA C 1 1 11 18973 1 1 13 ALA CA C 1.684 11.511 -4.423 1.00 . A A . 13 ALA CA 1 1 11 18974 1 1 13 ALA CB C 2.480 10.598 -3.488 1.00 . A A . 13 ALA CB 1 1 11 18975 1 1 13 ALA H H 0.002 10.311 -4.154 1.00 . A A . 13 ALA H 1 1 11 18976 1 1 13 ALA HA H 1.884 12.548 -4.156 1.00 . A A . 13 ALA HA 1 1 11 18977 1 1 13 ALA HB1 H 1.985 10.552 -2.517 1.00 . A A . 13 ALA HB1 1 1 11 18978 1 1 13 ALA HB2 H 2.533 9.597 -3.916 1.00 . A A . 13 ALA HB2 1 1 11 18979 1 1 13 ALA HB3 H 3.487 10.995 -3.364 1.00 . A A . 13 ALA HB3 1 1 11 18980 1 1 13 ALA N N 0.262 11.273 -4.238 1.00 . A A . 13 ALA N 1 1 11 18981 1 1 13 ALA O O 3.145 11.641 -6.324 1.00 . A A . 13 ALA O 1 1 11 18982 1 1 14 THR C C 0.101 10.943 -8.853 1.00 . A A . 14 THR C 1 1 11 18983 1 1 14 THR CA C 1.304 10.461 -8.040 1.00 . A A . 14 THR CA 1 1 11 18984 1 1 14 THR CB C 1.589 8.967 -8.204 1.00 . A A . 14 THR CB 1 1 11 18985 1 1 14 THR CG2 C 2.748 8.492 -7.326 1.00 . A A . 14 THR CG2 1 1 11 18986 1 1 14 THR H H 0.207 10.449 -6.269 1.00 . A A . 14 THR H 1 1 11 18987 1 1 14 THR HA H 2.168 11.035 -8.375 1.00 . A A . 14 THR HA 1 1 11 18988 1 1 14 THR HB H 1.765 8.717 -9.250 1.00 . A A . 14 THR HB 1 1 11 18989 1 1 14 THR HG1 H -0.382 8.841 -7.880 1.00 . A A . 14 THR HG1 1 1 11 18990 1 1 14 THR HG21 H 2.752 9.055 -6.393 1.00 . A A . 14 THR HG21 1 1 11 18991 1 1 14 THR HG22 H 2.628 7.431 -7.109 1.00 . A A . 14 THR HG22 1 1 11 18992 1 1 14 THR HG23 H 3.690 8.651 -7.850 1.00 . A A . 14 THR HG23 1 1 11 18993 1 1 14 THR N N 1.099 10.726 -6.626 1.00 . A A . 14 THR N 1 1 11 18994 1 1 14 THR O O -0.886 11.413 -8.289 1.00 . A A . 14 THR O 1 1 11 18995 1 1 14 THR OG1 O 0.444 8.331 -7.641 1.00 . A A . 14 THR OG1 1 1 11 18996 1 1 15 LYS C C -2.081 10.369 -10.808 1.00 . A A . 15 LYS C 1 1 11 18997 1 1 15 LYS CA C -0.841 11.228 -11.062 1.00 . A A . 15 LYS CA 1 1 11 18998 1 1 15 LYS CB C -0.360 11.200 -12.515 1.00 . A A . 15 LYS CB 1 1 11 18999 1 1 15 LYS CD C -0.786 12.054 -14.849 1.00 . A A . 15 LYS CD 1 1 11 19000 1 1 15 LYS CE C 0.188 13.231 -14.934 1.00 . A A . 15 LYS CE 1 1 11 19001 1 1 15 LYS CG C -1.353 11.913 -13.435 1.00 . A A . 15 LYS CG 1 1 11 19002 1 1 15 LYS H H 1.030 10.429 -10.616 1.00 . A A . 15 LYS H 1 1 11 19003 1 1 15 LYS HA H -1.083 12.264 -10.823 1.00 . A A . 15 LYS HA 1 1 11 19004 1 1 15 LYS HB2 H 0.617 11.677 -12.588 1.00 . A A . 15 LYS HB2 1 1 11 19005 1 1 15 LYS HB3 H -0.235 10.167 -12.840 1.00 . A A . 15 LYS HB3 1 1 11 19006 1 1 15 LYS HD2 H -0.275 11.134 -15.133 1.00 . A A . 15 LYS HD2 1 1 11 19007 1 1 15 LYS HD3 H -1.600 12.199 -15.558 1.00 . A A . 15 LYS HD3 1 1 11 19008 1 1 15 LYS HE2 H 0.892 13.189 -14.104 1.00 . A A . 15 LYS HE2 1 1 11 19009 1 1 15 LYS HE3 H 0.772 13.162 -15.852 1.00 . A A . 15 LYS HE3 1 1 11 19010 1 1 15 LYS HG2 H -2.289 11.356 -13.468 1.00 . A A . 15 LYS HG2 1 1 11 19011 1 1 15 LYS HG3 H -1.584 12.899 -13.032 1.00 . A A . 15 LYS HG3 1 1 11 19012 1 1 15 LYS HZ1 H -1.406 14.449 -14.368 1.00 . A A . 15 LYS HZ1 1 1 11 19013 1 1 15 LYS HZ2 H 0.002 15.259 -14.488 1.00 . A A . 15 LYS HZ2 1 1 11 19014 1 1 15 LYS N N 0.224 10.811 -10.166 1.00 . A A . 15 LYS N 1 1 11 19015 1 1 15 LYS NZ N -0.548 14.515 -14.904 1.00 . A A . 15 LYS NZ 1 1 11 19016 1 1 15 LYS O O -3.176 10.705 -11.257 1.00 . A A . 15 LYS O 1 1 11 19017 1 1 16 GLN C C -3.115 8.242 -8.253 1.00 . A A . 16 GLN C 1 1 11 19018 1 1 16 GLN CA C -2.956 8.368 -9.769 1.00 . A A . 16 GLN CA 1 1 11 19019 1 1 16 GLN CB C -2.731 6.998 -10.413 1.00 . A A . 16 GLN CB 1 1 11 19020 1 1 16 GLN CD C -3.573 6.894 -12.788 1.00 . A A . 16 GLN CD 1 1 11 19021 1 1 16 GLN CG C -2.359 7.140 -11.890 1.00 . A A . 16 GLN CG 1 1 11 19022 1 1 16 GLN H H -0.975 9.012 -9.726 1.00 . A A . 16 GLN H 1 1 11 19023 1 1 16 GLN HA H -3.849 8.822 -10.199 1.00 . A A . 16 GLN HA 1 1 11 19024 1 1 16 GLN HB2 H -1.938 6.469 -9.883 1.00 . A A . 16 GLN HB2 1 1 11 19025 1 1 16 GLN HB3 H -3.634 6.395 -10.318 1.00 . A A . 16 GLN HB3 1 1 11 19026 1 1 16 GLN HE21 H -3.649 4.997 -12.084 1.00 . A A . 16 GLN HE21 1 1 11 19027 1 1 16 GLN HE22 H -4.866 5.406 -13.248 1.00 . A A . 16 GLN HE22 1 1 11 19028 1 1 16 GLN HG2 H -1.962 8.139 -12.074 1.00 . A A . 16 GLN HG2 1 1 11 19029 1 1 16 GLN HG3 H -1.568 6.433 -12.139 1.00 . A A . 16 GLN HG3 1 1 11 19030 1 1 16 GLN N N -1.869 9.278 -10.088 1.00 . A A . 16 GLN N 1 1 11 19031 1 1 16 GLN NE2 N -4.070 5.664 -12.699 1.00 . A A . 16 GLN NE2 1 1 11 19032 1 1 16 GLN O O -2.394 7.480 -7.610 1.00 . A A . 16 GLN O 1 1 11 19033 1 1 16 GLN OE1 O -4.028 7.764 -13.512 1.00 . A A . 16 GLN OE1 1 1 11 19034 1 1 17 PRO C C -5.096 7.730 -5.876 1.00 . A A . 17 PRO C 1 1 11 19035 1 1 17 PRO CA C -4.352 9.004 -6.281 1.00 . A A . 17 PRO CA 1 1 11 19036 1 1 17 PRO CB C -5.150 10.269 -6.013 1.00 . A A . 17 PRO CB 1 1 11 19037 1 1 17 PRO CD C -4.962 9.935 -8.440 1.00 . A A . 17 PRO CD 1 1 11 19038 1 1 17 PRO CG C -5.702 10.708 -7.360 1.00 . A A . 17 PRO CG 1 1 11 19039 1 1 17 PRO HA H -3.492 8.992 -5.771 1.00 . A A . 17 PRO HA 1 1 11 19040 1 1 17 PRO HB2 H -5.955 10.080 -5.304 1.00 . A A . 17 PRO HB2 1 1 11 19041 1 1 17 PRO HB3 H -4.518 11.045 -5.579 1.00 . A A . 17 PRO HB3 1 1 11 19042 1 1 17 PRO HD2 H -5.655 9.392 -9.083 1.00 . A A . 17 PRO HD2 1 1 11 19043 1 1 17 PRO HD3 H -4.389 10.603 -9.083 1.00 . A A . 17 PRO HD3 1 1 11 19044 1 1 17 PRO HG2 H -6.773 10.512 -7.416 1.00 . A A . 17 PRO HG2 1 1 11 19045 1 1 17 PRO HG3 H -5.566 11.780 -7.497 1.00 . A A . 17 PRO HG3 1 1 11 19046 1 1 17 PRO N N -4.089 9.021 -7.710 1.00 . A A . 17 PRO N 1 1 11 19047 1 1 17 PRO O O -5.680 7.052 -6.721 1.00 . A A . 17 PRO O 1 1 11 19048 1 1 18 VAL C C -6.286 6.580 -2.672 1.00 . A A . 18 VAL C 1 1 11 19049 1 1 18 VAL CA C -5.715 6.263 -4.056 1.00 . A A . 18 VAL CA 1 1 11 19050 1 1 18 VAL CB C -4.746 5.079 -4.046 1.00 . A A . 18 VAL CB 1 1 11 19051 1 1 18 VAL CG1 C -5.351 3.882 -3.310 1.00 . A A . 18 VAL CG1 1 1 11 19052 1 1 18 VAL CG2 C -4.332 4.697 -5.469 1.00 . A A . 18 VAL CG2 1 1 11 19053 1 1 18 VAL H H -4.576 8.000 -3.903 1.00 . A A . 18 VAL H 1 1 11 19054 1 1 18 VAL HA H -6.538 6.020 -4.728 1.00 . A A . 18 VAL HA 1 1 11 19055 1 1 18 VAL HB H -3.849 5.385 -3.507 1.00 . A A . 18 VAL HB 1 1 11 19056 1 1 18 VAL HG11 H -6.423 3.840 -3.505 1.00 . A A . 18 VAL HG11 1 1 11 19057 1 1 18 VAL HG12 H -4.882 2.963 -3.664 1.00 . A A . 18 VAL HG12 1 1 11 19058 1 1 18 VAL HG13 H -5.180 3.988 -2.239 1.00 . A A . 18 VAL HG13 1 1 11 19059 1 1 18 VAL HG21 H -5.146 4.927 -6.157 1.00 . A A . 18 VAL HG21 1 1 11 19060 1 1 18 VAL HG22 H -3.445 5.262 -5.753 1.00 . A A . 18 VAL HG22 1 1 11 19061 1 1 18 VAL HG23 H -4.113 3.630 -5.509 1.00 . A A . 18 VAL HG23 1 1 11 19062 1 1 18 VAL N N -5.052 7.443 -4.583 1.00 . A A . 18 VAL N 1 1 11 19063 1 1 18 VAL O O -5.775 7.450 -1.970 1.00 . A A . 18 VAL O 1 1 11 19064 1 1 19 VAL C C -7.881 4.760 -0.218 1.00 . A A . 19 VAL C 1 1 11 19065 1 1 19 VAL CA C -7.986 6.049 -1.035 1.00 . A A . 19 VAL CA 1 1 11 19066 1 1 19 VAL CB C -9.430 6.512 -1.240 1.00 . A A . 19 VAL CB 1 1 11 19067 1 1 19 VAL CG1 C -10.212 6.464 0.075 1.00 . A A . 19 VAL CG1 1 1 11 19068 1 1 19 VAL CG2 C -9.476 7.912 -1.854 1.00 . A A . 19 VAL CG2 1 1 11 19069 1 1 19 VAL H H -7.750 5.150 -2.899 1.00 . A A . 19 VAL H 1 1 11 19070 1 1 19 VAL HA H -7.449 6.840 -0.513 1.00 . A A . 19 VAL HA 1 1 11 19071 1 1 19 VAL HB H -9.907 5.824 -1.938 1.00 . A A . 19 VAL HB 1 1 11 19072 1 1 19 VAL HG11 H -9.515 6.474 0.913 1.00 . A A . 19 VAL HG11 1 1 11 19073 1 1 19 VAL HG12 H -10.870 7.331 0.138 1.00 . A A . 19 VAL HG12 1 1 11 19074 1 1 19 VAL HG13 H -10.809 5.552 0.109 1.00 . A A . 19 VAL HG13 1 1 11 19075 1 1 19 VAL HG21 H -8.480 8.189 -2.201 1.00 . A A . 19 VAL HG21 1 1 11 19076 1 1 19 VAL HG22 H -10.169 7.918 -2.695 1.00 . A A . 19 VAL HG22 1 1 11 19077 1 1 19 VAL HG23 H -9.811 8.628 -1.102 1.00 . A A . 19 VAL HG23 1 1 11 19078 1 1 19 VAL N N -7.340 5.856 -2.322 1.00 . A A . 19 VAL N 1 1 11 19079 1 1 19 VAL O O -8.409 3.723 -0.617 1.00 . A A . 19 VAL O 1 1 11 19080 1 1 20 PHE C C -7.875 3.854 3.046 1.00 . A A . 20 PHE C 1 1 11 19081 1 1 20 PHE CA C -7.015 3.722 1.788 1.00 . A A . 20 PHE CA 1 1 11 19082 1 1 20 PHE CB C -5.539 3.729 2.190 1.00 . A A . 20 PHE CB 1 1 11 19083 1 1 20 PHE CD1 C -4.935 1.301 2.506 1.00 . A A . 20 PHE CD1 1 1 11 19084 1 1 20 PHE CD2 C -4.952 2.724 4.427 1.00 . A A . 20 PHE CD2 1 1 11 19085 1 1 20 PHE CE1 C -4.549 0.189 3.334 1.00 . A A . 20 PHE CE1 1 1 11 19086 1 1 20 PHE CE2 C -4.566 1.611 5.255 1.00 . A A . 20 PHE CE2 1 1 11 19087 1 1 20 PHE CG C -5.129 2.546 3.070 1.00 . A A . 20 PHE CG 1 1 11 19088 1 1 20 PHE CZ C -4.384 0.398 4.668 1.00 . A A . 20 PHE CZ 1 1 11 19089 1 1 20 PHE H H -6.770 5.714 1.229 1.00 . A A . 20 PHE H 1 1 11 19090 1 1 20 PHE HA H -7.318 2.829 1.241 1.00 . A A . 20 PHE HA 1 1 11 19091 1 1 20 PHE HB2 H -4.927 3.727 1.288 1.00 . A A . 20 PHE HB2 1 1 11 19092 1 1 20 PHE HB3 H -5.322 4.656 2.721 1.00 . A A . 20 PHE HB3 1 1 11 19093 1 1 20 PHE HD1 H -5.075 1.161 1.434 1.00 . A A . 20 PHE HD1 1 1 11 19094 1 1 20 PHE HD2 H -5.105 3.708 4.872 1.00 . A A . 20 PHE HD2 1 1 11 19095 1 1 20 PHE HE1 H -4.393 -0.800 2.902 1.00 . A A . 20 PHE HE1 1 1 11 19096 1 1 20 PHE HE2 H -4.423 1.738 6.328 1.00 . A A . 20 PHE HE2 1 1 11 19097 1 1 20 PHE HZ H -4.062 -0.521 5.220 1.00 . A A . 20 PHE HZ 1 1 11 19098 1 1 20 PHE N N -7.196 4.867 0.911 1.00 . A A . 20 PHE N 1 1 11 19099 1 1 20 PHE O O -8.380 4.935 3.347 1.00 . A A . 20 PHE O 1 1 11 19100 1 1 21 ASN C C -8.117 1.824 6.000 1.00 . A A . 21 ASN C 1 1 11 19101 1 1 21 ASN CA C -8.807 2.716 4.966 1.00 . A A . 21 ASN CA 1 1 11 19102 1 1 21 ASN CB C -10.203 2.146 4.706 1.00 . A A . 21 ASN CB 1 1 11 19103 1 1 21 ASN CG C -11.050 3.122 3.887 1.00 . A A . 21 ASN CG 1 1 11 19104 1 1 21 ASN H H -7.602 1.864 3.495 1.00 . A A . 21 ASN H 1 1 11 19105 1 1 21 ASN HA H -8.868 3.756 5.287 1.00 . A A . 21 ASN HA 1 1 11 19106 1 1 21 ASN HB2 H -10.120 1.197 4.176 1.00 . A A . 21 ASN HB2 1 1 11 19107 1 1 21 ASN HB3 H -10.697 1.939 5.656 1.00 . A A . 21 ASN HB3 1 1 11 19108 1 1 21 ASN HD21 H -10.160 2.413 2.212 1.00 . A A . 21 ASN HD21 1 1 11 19109 1 1 21 ASN HD22 H -11.337 3.658 1.956 1.00 . A A . 21 ASN HD22 1 1 11 19110 1 1 21 ASN N N -8.016 2.739 3.747 1.00 . A A . 21 ASN N 1 1 11 19111 1 1 21 ASN ND2 N -10.831 3.059 2.576 1.00 . A A . 21 ASN ND2 1 1 11 19112 1 1 21 ASN O O -7.446 0.856 5.641 1.00 . A A . 21 ASN O 1 1 11 19113 1 1 21 ASN OD1 O -11.849 3.881 4.409 1.00 . A A . 21 ASN OD1 1 1 11 19114 1 1 22 HIS C C -8.770 0.532 8.997 1.00 . A A . 22 HIS C 1 1 11 19115 1 1 22 HIS CA C -7.708 1.424 8.350 1.00 . A A . 22 HIS CA 1 1 11 19116 1 1 22 HIS CB C -7.028 2.359 9.352 1.00 . A A . 22 HIS CB 1 1 11 19117 1 1 22 HIS CD2 C -4.429 2.087 9.289 1.00 . A A . 22 HIS CD2 1 1 11 19118 1 1 22 HIS CE1 C -3.959 3.863 8.102 1.00 . A A . 22 HIS CE1 1 1 11 19119 1 1 22 HIS CG C -5.605 2.713 8.994 1.00 . A A . 22 HIS CG 1 1 11 19120 1 1 22 HIS H H -8.852 2.968 7.545 1.00 . A A . 22 HIS H 1 1 11 19121 1 1 22 HIS HA H -6.937 0.794 7.907 1.00 . A A . 22 HIS HA 1 1 11 19122 1 1 22 HIS HB2 H -7.611 3.276 9.431 1.00 . A A . 22 HIS HB2 1 1 11 19123 1 1 22 HIS HB3 H -7.038 1.889 10.336 1.00 . A A . 22 HIS HB3 1 1 11 19124 1 1 22 HIS HD1 H -5.922 4.497 7.876 1.00 . A A . 22 HIS HD1 1 1 11 19125 1 1 22 HIS HD2 H -4.324 1.170 9.870 1.00 . A A . 22 HIS HD2 1 1 11 19126 1 1 22 HIS HE1 H -3.392 4.622 7.562 1.00 . A A . 22 HIS HE1 1 1 11 19127 1 1 22 HIS N N -8.305 2.180 7.262 1.00 . A A . 22 HIS N 1 1 11 19128 1 1 22 HIS ND1 N -5.275 3.829 8.245 1.00 . A A . 22 HIS ND1 1 1 11 19129 1 1 22 HIS NE2 N -3.436 2.782 8.749 1.00 . A A . 22 HIS NE2 1 1 11 19130 1 1 22 HIS O O -8.439 -0.428 9.692 1.00 . A A . 22 HIS O 1 1 11 19131 1 1 23 SER C C -11.386 -1.126 8.450 1.00 . A A . 23 SER C 1 1 11 19132 1 1 23 SER CA C -11.135 0.124 9.296 1.00 . A A . 23 SER CA 1 1 11 19133 1 1 23 SER CB C -12.401 0.979 9.368 1.00 . A A . 23 SER CB 1 1 11 19134 1 1 23 SER H H -10.283 1.663 8.180 1.00 . A A . 23 SER H 1 1 11 19135 1 1 23 SER HA H -10.826 -0.152 10.304 1.00 . A A . 23 SER HA 1 1 11 19136 1 1 23 SER HB2 H -12.161 1.945 9.813 1.00 . A A . 23 SER HB2 1 1 11 19137 1 1 23 SER HB3 H -12.765 1.174 8.359 1.00 . A A . 23 SER HB3 1 1 11 19138 1 1 23 SER HG H -13.708 0.943 10.883 1.00 . A A . 23 SER HG 1 1 11 19139 1 1 23 SER N N -10.023 0.881 8.746 1.00 . A A . 23 SER N 1 1 11 19140 1 1 23 SER O O -12.246 -1.941 8.781 1.00 . A A . 23 SER O 1 1 11 19141 1 1 23 SER OG O -13.429 0.349 10.129 1.00 . A A . 23 SER OG 1 1 11 19142 1 1 24 THR C C -9.616 -3.374 6.718 1.00 . A A . 24 THR C 1 1 11 19143 1 1 24 THR CA C -10.750 -2.374 6.479 1.00 . A A . 24 THR CA 1 1 11 19144 1 1 24 THR CB C -10.799 -1.843 5.045 1.00 . A A . 24 THR CB 1 1 11 19145 1 1 24 THR CG2 C -10.906 -2.963 4.008 1.00 . A A . 24 THR CG2 1 1 11 19146 1 1 24 THR H H -9.924 -0.570 7.113 1.00 . A A . 24 THR H 1 1 11 19147 1 1 24 THR HA H -11.683 -2.888 6.708 1.00 . A A . 24 THR HA 1 1 11 19148 1 1 24 THR HB H -9.941 -1.202 4.838 1.00 . A A . 24 THR HB 1 1 11 19149 1 1 24 THR HG1 H -12.783 -1.776 5.292 1.00 . A A . 24 THR HG1 1 1 11 19150 1 1 24 THR HG21 H -11.198 -3.889 4.503 1.00 . A A . 24 THR HG21 1 1 11 19151 1 1 24 THR HG22 H -11.656 -2.698 3.263 1.00 . A A . 24 THR HG22 1 1 11 19152 1 1 24 THR HG23 H -9.941 -3.101 3.520 1.00 . A A . 24 THR HG23 1 1 11 19153 1 1 24 THR N N -10.621 -1.238 7.374 1.00 . A A . 24 THR N 1 1 11 19154 1 1 24 THR O O -9.807 -4.580 6.573 1.00 . A A . 24 THR O 1 1 11 19155 1 1 24 THR OG1 O -12.054 -1.174 4.965 1.00 . A A . 24 THR OG1 1 1 11 19156 1 1 25 HIS C C -7.120 -3.839 8.851 1.00 . A A . 25 HIS C 1 1 11 19157 1 1 25 HIS CA C -7.297 -3.664 7.341 1.00 . A A . 25 HIS CA 1 1 11 19158 1 1 25 HIS CB C -6.055 -3.085 6.662 1.00 . A A . 25 HIS CB 1 1 11 19159 1 1 25 HIS CD2 C -5.704 -3.704 4.146 1.00 . A A . 25 HIS CD2 1 1 11 19160 1 1 25 HIS CE1 C -6.817 -2.042 3.259 1.00 . A A . 25 HIS CE1 1 1 11 19161 1 1 25 HIS CG C -6.187 -2.935 5.165 1.00 . A A . 25 HIS CG 1 1 11 19162 1 1 25 HIS H H -8.315 -1.852 7.196 1.00 . A A . 25 HIS H 1 1 11 19163 1 1 25 HIS HA H -7.499 -4.636 6.892 1.00 . A A . 25 HIS HA 1 1 11 19164 1 1 25 HIS HB2 H -5.837 -2.109 7.096 1.00 . A A . 25 HIS HB2 1 1 11 19165 1 1 25 HIS HB3 H -5.202 -3.728 6.878 1.00 . A A . 25 HIS HB3 1 1 11 19166 1 1 25 HIS HD1 H -7.357 -1.159 5.057 1.00 . A A . 25 HIS HD1 1 1 11 19167 1 1 25 HIS HD2 H -5.106 -4.608 4.259 1.00 . A A . 25 HIS HD2 1 1 11 19168 1 1 25 HIS HE1 H -7.268 -1.383 2.517 1.00 . A A . 25 HIS HE1 1 1 11 19169 1 1 25 HIS N N -8.462 -2.834 7.081 1.00 . A A . 25 HIS N 1 1 11 19170 1 1 25 HIS ND1 N -6.884 -1.896 4.574 1.00 . A A . 25 HIS ND1 1 1 11 19171 1 1 25 HIS NE2 N -6.086 -3.164 2.996 1.00 . A A . 25 HIS NE2 1 1 11 19172 1 1 25 HIS O O -5.995 -3.893 9.345 1.00 . A A . 25 HIS O 1 1 11 19173 1 1 26 LYS C C -7.657 -5.468 11.326 1.00 . A A . 26 LYS C 1 1 11 19174 1 1 26 LYS CA C -8.231 -4.092 10.984 1.00 . A A . 26 LYS CA 1 1 11 19175 1 1 26 LYS CB C -9.623 -3.844 11.568 1.00 . A A . 26 LYS CB 1 1 11 19176 1 1 26 LYS CD C -11.593 -2.271 11.644 1.00 . A A . 26 LYS CD 1 1 11 19177 1 1 26 LYS CE C -11.586 -1.809 13.103 1.00 . A A . 26 LYS CE 1 1 11 19178 1 1 26 LYS CG C -10.168 -2.483 11.129 1.00 . A A . 26 LYS CG 1 1 11 19179 1 1 26 LYS H H -9.159 -3.879 9.131 1.00 . A A . 26 LYS H 1 1 11 19180 1 1 26 LYS HA H -7.569 -3.329 11.394 1.00 . A A . 26 LYS HA 1 1 11 19181 1 1 26 LYS HB2 H -10.303 -4.633 11.247 1.00 . A A . 26 LYS HB2 1 1 11 19182 1 1 26 LYS HB3 H -9.578 -3.888 12.657 1.00 . A A . 26 LYS HB3 1 1 11 19183 1 1 26 LYS HD2 H -12.100 -1.529 11.027 1.00 . A A . 26 LYS HD2 1 1 11 19184 1 1 26 LYS HD3 H -12.158 -3.199 11.556 1.00 . A A . 26 LYS HD3 1 1 11 19185 1 1 26 LYS HE2 H -10.585 -1.920 13.521 1.00 . A A . 26 LYS HE2 1 1 11 19186 1 1 26 LYS HE3 H -11.838 -0.751 13.157 1.00 . A A . 26 LYS HE3 1 1 11 19187 1 1 26 LYS HG2 H -9.520 -1.690 11.504 1.00 . A A . 26 LYS HG2 1 1 11 19188 1 1 26 LYS HG3 H -10.157 -2.417 10.042 1.00 . A A . 26 LYS HG3 1 1 11 19189 1 1 26 LYS HZ1 H -13.357 -2.045 14.176 1.00 . A A . 26 LYS HZ1 1 1 11 19190 1 1 26 LYS HZ2 H -12.906 -3.396 13.387 1.00 . A A . 26 LYS HZ2 1 1 11 19191 1 1 26 LYS N N -8.248 -3.924 9.541 1.00 . A A . 26 LYS N 1 1 11 19192 1 1 26 LYS NZ N -12.552 -2.597 13.901 1.00 . A A . 26 LYS NZ 1 1 11 19193 1 1 26 LYS O O -6.846 -5.596 12.243 1.00 . A A . 26 LYS O 1 1 11 19194 1 1 27 SER C C -6.168 -7.949 10.384 1.00 . A A . 27 SER C 1 1 11 19195 1 1 27 SER CA C -7.639 -7.825 10.784 1.00 . A A . 27 SER CA 1 1 11 19196 1 1 27 SER CB C -8.490 -8.823 9.994 1.00 . A A . 27 SER CB 1 1 11 19197 1 1 27 SER H H -8.758 -6.351 9.828 1.00 . A A . 27 SER H 1 1 11 19198 1 1 27 SER HA H -7.763 -8.008 11.851 1.00 . A A . 27 SER HA 1 1 11 19199 1 1 27 SER HB2 H -8.319 -9.828 10.379 1.00 . A A . 27 SER HB2 1 1 11 19200 1 1 27 SER HB3 H -9.545 -8.599 10.146 1.00 . A A . 27 SER HB3 1 1 11 19201 1 1 27 SER HG H -8.129 -7.844 8.286 1.00 . A A . 27 SER HG 1 1 11 19202 1 1 27 SER N N -8.099 -6.463 10.571 1.00 . A A . 27 SER N 1 1 11 19203 1 1 27 SER O O -5.517 -8.943 10.700 1.00 . A A . 27 SER O 1 1 11 19204 1 1 27 SER OG O -8.193 -8.791 8.601 1.00 . A A . 27 SER OG 1 1 11 19205 1 1 28 VAL C C -3.424 -6.315 10.352 1.00 . A A . 28 VAL C 1 1 11 19206 1 1 28 VAL CA C -4.304 -6.906 9.248 1.00 . A A . 28 VAL CA 1 1 11 19207 1 1 28 VAL CB C -4.192 -6.149 7.924 1.00 . A A . 28 VAL CB 1 1 11 19208 1 1 28 VAL CG1 C -2.764 -6.209 7.377 1.00 . A A . 28 VAL CG1 1 1 11 19209 1 1 28 VAL CG2 C -5.194 -6.684 6.899 1.00 . A A . 28 VAL CG2 1 1 11 19210 1 1 28 VAL H H -6.223 -6.119 9.442 1.00 . A A . 28 VAL H 1 1 11 19211 1 1 28 VAL HA H -4.001 -7.939 9.073 1.00 . A A . 28 VAL HA 1 1 11 19212 1 1 28 VAL HB H -4.434 -5.103 8.114 1.00 . A A . 28 VAL HB 1 1 11 19213 1 1 28 VAL HG11 H -2.070 -5.841 8.133 1.00 . A A . 28 VAL HG11 1 1 11 19214 1 1 28 VAL HG12 H -2.514 -7.240 7.126 1.00 . A A . 28 VAL HG12 1 1 11 19215 1 1 28 VAL HG13 H -2.691 -5.589 6.484 1.00 . A A . 28 VAL HG13 1 1 11 19216 1 1 28 VAL HG21 H -5.547 -7.666 7.215 1.00 . A A . 28 VAL HG21 1 1 11 19217 1 1 28 VAL HG22 H -6.040 -6.001 6.827 1.00 . A A . 28 VAL HG22 1 1 11 19218 1 1 28 VAL HG23 H -4.710 -6.768 5.926 1.00 . A A . 28 VAL HG23 1 1 11 19219 1 1 28 VAL N N -5.687 -6.925 9.695 1.00 . A A . 28 VAL N 1 1 11 19220 1 1 28 VAL O O -3.809 -5.347 11.005 1.00 . A A . 28 VAL O 1 1 11 19221 1 1 29 LYS C C -0.709 -5.137 11.100 1.00 . A A . 29 LYS C 1 1 11 19222 1 1 29 LYS CA C -1.322 -6.469 11.538 1.00 . A A . 29 LYS CA 1 1 11 19223 1 1 29 LYS CB C -0.286 -7.555 11.834 1.00 . A A . 29 LYS CB 1 1 11 19224 1 1 29 LYS CD C -1.485 -9.129 13.398 1.00 . A A . 29 LYS CD 1 1 11 19225 1 1 29 LYS CE C -1.869 -9.359 14.861 1.00 . A A . 29 LYS CE 1 1 11 19226 1 1 29 LYS CG C -0.407 -8.050 13.277 1.00 . A A . 29 LYS CG 1 1 11 19227 1 1 29 LYS H H -1.954 -7.710 9.989 1.00 . A A . 29 LYS H 1 1 11 19228 1 1 29 LYS HA H -1.887 -6.304 12.455 1.00 . A A . 29 LYS HA 1 1 11 19229 1 1 29 LYS HB2 H -0.422 -8.390 11.147 1.00 . A A . 29 LYS HB2 1 1 11 19230 1 1 29 LYS HB3 H 0.717 -7.162 11.664 1.00 . A A . 29 LYS HB3 1 1 11 19231 1 1 29 LYS HD2 H -2.366 -8.834 12.828 1.00 . A A . 29 LYS HD2 1 1 11 19232 1 1 29 LYS HD3 H -1.121 -10.061 12.963 1.00 . A A . 29 LYS HD3 1 1 11 19233 1 1 29 LYS HE2 H -2.241 -10.375 14.990 1.00 . A A . 29 LYS HE2 1 1 11 19234 1 1 29 LYS HE3 H -0.989 -9.258 15.495 1.00 . A A . 29 LYS HE3 1 1 11 19235 1 1 29 LYS HG2 H 0.551 -8.448 13.610 1.00 . A A . 29 LYS HG2 1 1 11 19236 1 1 29 LYS HG3 H -0.650 -7.214 13.933 1.00 . A A . 29 LYS HG3 1 1 11 19237 1 1 29 LYS HZ1 H -3.193 -7.785 14.520 1.00 . A A . 29 LYS HZ1 1 1 11 19238 1 1 29 LYS HZ2 H -3.741 -8.850 15.624 1.00 . A A . 29 LYS HZ2 1 1 11 19239 1 1 29 LYS N N -2.260 -6.923 10.525 1.00 . A A . 29 LYS N 1 1 11 19240 1 1 29 LYS NZ N -2.905 -8.389 15.282 1.00 . A A . 29 LYS NZ 1 1 11 19241 1 1 29 LYS O O -0.306 -4.985 9.948 1.00 . A A . 29 LYS O 1 1 11 19242 1 1 30 CYS C C 1.335 -3.074 11.275 1.00 . A A . 30 CYS C 1 1 11 19243 1 1 30 CYS CA C -0.102 -2.893 11.767 1.00 . A A . 30 CYS CA 1 1 11 19244 1 1 30 CYS CB C -0.175 -1.980 12.992 1.00 . A A . 30 CYS CB 1 1 11 19245 1 1 30 CYS H H -0.989 -4.339 12.976 1.00 . A A . 30 CYS H 1 1 11 19246 1 1 30 CYS HA H -0.724 -2.446 10.991 1.00 . A A . 30 CYS HA 1 1 11 19247 1 1 30 CYS HB2 H 0.653 -2.222 13.658 1.00 . A A . 30 CYS HB2 1 1 11 19248 1 1 30 CYS HB3 H -0.034 -0.949 12.669 1.00 . A A . 30 CYS HB3 1 1 11 19249 1 1 30 CYS N N -0.659 -4.207 12.042 1.00 . A A . 30 CYS N 1 1 11 19250 1 1 30 CYS O O 1.837 -2.260 10.501 1.00 . A A . 30 CYS O 1 1 11 19251 1 1 30 CYS SG S -1.738 -2.089 13.938 1.00 . A A . 30 CYS SG 1 1 11 19252 1 1 31 GLY C C 3.382 -5.090 9.976 1.00 . A A . 31 GLY C 1 1 11 19253 1 1 31 GLY CA C 3.327 -4.443 11.361 1.00 . A A . 31 GLY CA 1 1 11 19254 1 1 31 GLY H H 1.542 -4.802 12.373 1.00 . A A . 31 GLY H 1 1 11 19255 1 1 31 GLY HA2 H 3.916 -3.525 11.361 1.00 . A A . 31 GLY HA2 1 1 11 19256 1 1 31 GLY HA3 H 3.777 -5.110 12.097 1.00 . A A . 31 GLY HA3 1 1 11 19257 1 1 31 GLY N N 1.957 -4.145 11.744 1.00 . A A . 31 GLY N 1 1 11 19258 1 1 31 GLY O O 4.463 -5.348 9.450 1.00 . A A . 31 GLY O 1 1 11 19259 1 1 32 ASP C C 2.343 -4.885 7.038 1.00 . A A . 32 ASP C 1 1 11 19260 1 1 32 ASP CA C 2.101 -5.947 8.112 1.00 . A A . 32 ASP CA 1 1 11 19261 1 1 32 ASP CB C 0.709 -6.540 7.886 1.00 . A A . 32 ASP CB 1 1 11 19262 1 1 32 ASP CG C 0.612 -7.542 6.734 1.00 . A A . 32 ASP CG 1 1 11 19263 1 1 32 ASP H H 1.327 -5.121 9.861 1.00 . A A . 32 ASP H 1 1 11 19264 1 1 32 ASP HA H 2.859 -6.730 8.103 1.00 . A A . 32 ASP HA 1 1 11 19265 1 1 32 ASP HB2 H 0.386 -7.031 8.804 1.00 . A A . 32 ASP HB2 1 1 11 19266 1 1 32 ASP HB3 H 0.010 -5.725 7.698 1.00 . A A . 32 ASP HB3 1 1 11 19267 1 1 32 ASP N N 2.201 -5.334 9.426 1.00 . A A . 32 ASP N 1 1 11 19268 1 1 32 ASP O O 2.901 -5.180 5.983 1.00 . A A . 32 ASP O 1 1 11 19269 1 1 32 ASP OD1 O 1.205 -7.248 5.674 1.00 . A A . 32 ASP OD1 1 1 11 19270 1 1 32 ASP OD2 O -0.054 -8.580 6.940 1.00 . A A . 32 ASP OD2 1 1 11 19271 1 1 33 CYS C C 3.207 -1.671 6.931 1.00 . A A . 33 CYS C 1 1 11 19272 1 1 33 CYS CA C 2.074 -2.562 6.419 1.00 . A A . 33 CYS CA 1 1 11 19273 1 1 33 CYS CB C 0.771 -1.781 6.238 1.00 . A A . 33 CYS CB 1 1 11 19274 1 1 33 CYS H H 1.459 -3.438 8.206 1.00 . A A . 33 CYS H 1 1 11 19275 1 1 33 CYS HA H 2.330 -2.996 5.453 1.00 . A A . 33 CYS HA 1 1 11 19276 1 1 33 CYS HB2 H 0.186 -1.814 7.157 1.00 . A A . 33 CYS HB2 1 1 11 19277 1 1 33 CYS HB3 H 0.991 -0.733 6.037 1.00 . A A . 33 CYS HB3 1 1 11 19278 1 1 33 CYS N N 1.911 -3.670 7.345 1.00 . A A . 33 CYS N 1 1 11 19279 1 1 33 CYS O O 4.166 -1.403 6.209 1.00 . A A . 33 CYS O 1 1 11 19280 1 1 33 CYS SG S -0.197 -2.492 4.857 1.00 . A A . 33 CYS SG 1 1 11 19281 1 1 34 HIS C C 5.272 -1.217 9.196 1.00 . A A . 34 HIS C 1 1 11 19282 1 1 34 HIS CA C 4.058 -0.379 8.791 1.00 . A A . 34 HIS CA 1 1 11 19283 1 1 34 HIS CB C 3.457 0.400 9.963 1.00 . A A . 34 HIS CB 1 1 11 19284 1 1 34 HIS CD2 C 0.958 1.098 9.647 1.00 . A A . 34 HIS CD2 1 1 11 19285 1 1 34 HIS CE1 C 1.295 3.096 8.820 1.00 . A A . 34 HIS CE1 1 1 11 19286 1 1 34 HIS CG C 2.306 1.298 9.578 1.00 . A A . 34 HIS CG 1 1 11 19287 1 1 34 HIS H H 2.276 -1.458 8.755 1.00 . A A . 34 HIS H 1 1 11 19288 1 1 34 HIS HA H 4.362 0.343 8.033 1.00 . A A . 34 HIS HA 1 1 11 19289 1 1 34 HIS HB2 H 3.115 -0.308 10.719 1.00 . A A . 34 HIS HB2 1 1 11 19290 1 1 34 HIS HB3 H 4.238 1.004 10.423 1.00 . A A . 34 HIS HB3 1 1 11 19291 1 1 34 HIS HD1 H 3.368 3.006 8.878 1.00 . A A . 34 HIS HD1 1 1 11 19292 1 1 34 HIS HD2 H 0.465 0.198 10.015 1.00 . A A . 34 HIS HD2 1 1 11 19293 1 1 34 HIS HE1 H 1.105 4.086 8.407 1.00 . A A . 34 HIS HE1 1 1 11 19294 1 1 34 HIS N N 3.059 -1.235 8.174 1.00 . A A . 34 HIS N 1 1 11 19295 1 1 34 HIS ND1 N 2.487 2.565 9.053 1.00 . A A . 34 HIS ND1 1 1 11 19296 1 1 34 HIS NE2 N 0.349 2.185 9.189 1.00 . A A . 34 HIS NE2 1 1 11 19297 1 1 34 HIS O O 5.662 -1.228 10.362 1.00 . A A . 34 HIS O 1 1 11 19298 1 1 35 HIS C C 7.943 -2.038 9.429 1.00 . A A . 35 HIS C 1 1 11 19299 1 1 35 HIS CA C 6.999 -2.736 8.448 1.00 . A A . 35 HIS CA 1 1 11 19300 1 1 35 HIS CB C 7.681 -3.108 7.130 1.00 . A A . 35 HIS CB 1 1 11 19301 1 1 35 HIS CD2 C 7.837 -1.367 5.186 1.00 . A A . 35 HIS CD2 1 1 11 19302 1 1 35 HIS CE1 C 9.544 -0.219 5.932 1.00 . A A . 35 HIS CE1 1 1 11 19303 1 1 35 HIS CG C 8.229 -1.925 6.368 1.00 . A A . 35 HIS CG 1 1 11 19304 1 1 35 HIS H H 5.514 -1.883 7.263 1.00 . A A . 35 HIS H 1 1 11 19305 1 1 35 HIS HA H 6.632 -3.657 8.903 1.00 . A A . 35 HIS HA 1 1 11 19306 1 1 35 HIS HB2 H 8.496 -3.802 7.337 1.00 . A A . 35 HIS HB2 1 1 11 19307 1 1 35 HIS HB3 H 6.966 -3.634 6.498 1.00 . A A . 35 HIS HB3 1 1 11 19308 1 1 35 HIS HD1 H 9.820 -1.340 7.656 1.00 . A A . 35 HIS HD1 1 1 11 19309 1 1 35 HIS HD2 H 7.011 -1.709 4.563 1.00 . A A . 35 HIS HD2 1 1 11 19310 1 1 35 HIS HE1 H 10.331 0.533 5.999 1.00 . A A . 35 HIS HE1 1 1 11 19311 1 1 35 HIS N N 5.837 -1.898 8.209 1.00 . A A . 35 HIS N 1 1 11 19312 1 1 35 HIS ND1 N 9.307 -1.180 6.813 1.00 . A A . 35 HIS ND1 1 1 11 19313 1 1 35 HIS NE2 N 8.632 -0.336 4.925 1.00 . A A . 35 HIS NE2 1 1 11 19314 1 1 35 HIS O O 8.027 -0.811 9.448 1.00 . A A . 35 HIS O 1 1 11 19315 1 1 36 PRO C C 10.868 -1.859 10.547 1.00 . A A . 36 PRO C 1 1 11 19316 1 1 36 PRO CA C 9.583 -2.347 11.220 1.00 . A A . 36 PRO CA 1 1 11 19317 1 1 36 PRO CB C 9.819 -3.492 12.191 1.00 . A A . 36 PRO CB 1 1 11 19318 1 1 36 PRO CD C 8.574 -4.329 10.245 1.00 . A A . 36 PRO CD 1 1 11 19319 1 1 36 PRO CG C 9.377 -4.752 11.464 1.00 . A A . 36 PRO CG 1 1 11 19320 1 1 36 PRO HA H 9.194 -1.547 11.678 1.00 . A A . 36 PRO HA 1 1 11 19321 1 1 36 PRO HB2 H 10.870 -3.553 12.475 1.00 . A A . 36 PRO HB2 1 1 11 19322 1 1 36 PRO HB3 H 9.249 -3.350 13.109 1.00 . A A . 36 PRO HB3 1 1 11 19323 1 1 36 PRO HD2 H 8.992 -4.750 9.330 1.00 . A A . 36 PRO HD2 1 1 11 19324 1 1 36 PRO HD3 H 7.542 -4.673 10.312 1.00 . A A . 36 PRO HD3 1 1 11 19325 1 1 36 PRO HG2 H 10.243 -5.344 11.165 1.00 . A A . 36 PRO HG2 1 1 11 19326 1 1 36 PRO HG3 H 8.774 -5.379 12.120 1.00 . A A . 36 PRO HG3 1 1 11 19327 1 1 36 PRO N N 8.648 -2.871 10.240 1.00 . A A . 36 PRO N 1 1 11 19328 1 1 36 PRO O O 11.568 -2.637 9.901 1.00 . A A . 36 PRO O 1 1 11 19329 1 1 37 VAL C C 13.388 0.205 11.226 1.00 . A A . 37 VAL C 1 1 11 19330 1 1 37 VAL CA C 12.326 0.027 10.139 1.00 . A A . 37 VAL CA 1 1 11 19331 1 1 37 VAL CB C 11.960 1.338 9.440 1.00 . A A . 37 VAL CB 1 1 11 19332 1 1 37 VAL CG1 C 13.215 2.135 9.078 1.00 . A A . 37 VAL CG1 1 1 11 19333 1 1 37 VAL CG2 C 11.100 1.078 8.203 1.00 . A A . 37 VAL CG2 1 1 11 19334 1 1 37 VAL H H 10.564 0.052 11.250 1.00 . A A . 37 VAL H 1 1 11 19335 1 1 37 VAL HA H 12.707 -0.662 9.386 1.00 . A A . 37 VAL HA 1 1 11 19336 1 1 37 VAL HB H 11.373 1.936 10.137 1.00 . A A . 37 VAL HB 1 1 11 19337 1 1 37 VAL HG11 H 13.855 1.532 8.433 1.00 . A A . 37 VAL HG11 1 1 11 19338 1 1 37 VAL HG12 H 12.928 3.047 8.555 1.00 . A A . 37 VAL HG12 1 1 11 19339 1 1 37 VAL HG13 H 13.757 2.393 9.988 1.00 . A A . 37 VAL HG13 1 1 11 19340 1 1 37 VAL HG21 H 10.245 0.460 8.478 1.00 . A A . 37 VAL HG21 1 1 11 19341 1 1 37 VAL HG22 H 10.747 2.027 7.799 1.00 . A A . 37 VAL HG22 1 1 11 19342 1 1 37 VAL HG23 H 11.694 0.561 7.449 1.00 . A A . 37 VAL HG23 1 1 11 19343 1 1 37 VAL N N 11.139 -0.574 10.722 1.00 . A A . 37 VAL N 1 1 11 19344 1 1 37 VAL O O 13.201 0.982 12.161 1.00 . A A . 37 VAL O 1 1 11 19345 1 1 38 ASN C C 15.257 -1.367 13.216 1.00 . A A . 38 ASN C 1 1 11 19346 1 1 38 ASN CA C 15.572 -0.462 12.024 1.00 . A A . 38 ASN CA 1 1 11 19347 1 1 38 ASN CB C 15.758 0.963 12.549 1.00 . A A . 38 ASN CB 1 1 11 19348 1 1 38 ASN CG C 17.242 1.321 12.650 1.00 . A A . 38 ASN CG 1 1 11 19349 1 1 38 ASN H H 14.625 -1.158 10.304 1.00 . A A . 38 ASN H 1 1 11 19350 1 1 38 ASN HA H 16.455 -0.789 11.474 1.00 . A A . 38 ASN HA 1 1 11 19351 1 1 38 ASN HB2 H 15.255 1.667 11.886 1.00 . A A . 38 ASN HB2 1 1 11 19352 1 1 38 ASN HB3 H 15.290 1.058 13.528 1.00 . A A . 38 ASN HB3 1 1 11 19353 1 1 38 ASN HD21 H 17.098 1.147 14.662 1.00 . A A . 38 ASN HD21 1 1 11 19354 1 1 38 ASN HD22 H 18.668 1.573 14.066 1.00 . A A . 38 ASN HD22 1 1 11 19355 1 1 38 ASN N N 14.480 -0.529 11.067 1.00 . A A . 38 ASN N 1 1 11 19356 1 1 38 ASN ND2 N 17.708 1.349 13.895 1.00 . A A . 38 ASN ND2 1 1 11 19357 1 1 38 ASN O O 16.090 -1.546 14.102 1.00 . A A . 38 ASN O 1 1 11 19358 1 1 38 ASN OD1 O 17.920 1.555 11.663 1.00 . A A . 38 ASN OD1 1 1 11 19359 1 1 39 GLY C C 12.568 -2.115 15.149 1.00 . A A . 39 GLY C 1 1 11 19360 1 1 39 GLY CA C 13.614 -2.798 14.267 1.00 . A A . 39 GLY CA 1 1 11 19361 1 1 39 GLY H H 13.378 -1.766 12.473 1.00 . A A . 39 GLY H 1 1 11 19362 1 1 39 GLY HA2 H 13.197 -3.711 13.842 1.00 . A A . 39 GLY HA2 1 1 11 19363 1 1 39 GLY HA3 H 14.471 -3.092 14.874 1.00 . A A . 39 GLY HA3 1 1 11 19364 1 1 39 GLY N N 14.050 -1.916 13.198 1.00 . A A . 39 GLY N 1 1 11 19365 1 1 39 GLY O O 12.086 -2.703 16.117 1.00 . A A . 39 GLY O 1 1 11 19366 1 1 40 LYS C C 9.980 0.001 14.709 1.00 . A A . 40 LYS C 1 1 11 19367 1 1 40 LYS CA C 11.265 -0.113 15.531 1.00 . A A . 40 LYS CA 1 1 11 19368 1 1 40 LYS CB C 11.850 1.238 15.949 1.00 . A A . 40 LYS CB 1 1 11 19369 1 1 40 LYS CD C 12.255 3.628 15.254 1.00 . A A . 40 LYS CD 1 1 11 19370 1 1 40 LYS CE C 12.420 4.568 14.057 1.00 . A A . 40 LYS CE 1 1 11 19371 1 1 40 LYS CG C 11.762 2.251 14.805 1.00 . A A . 40 LYS CG 1 1 11 19372 1 1 40 LYS H H 12.642 -0.412 13.996 1.00 . A A . 40 LYS H 1 1 11 19373 1 1 40 LYS HA H 11.044 -0.664 16.444 1.00 . A A . 40 LYS HA 1 1 11 19374 1 1 40 LYS HB2 H 11.313 1.618 16.818 1.00 . A A . 40 LYS HB2 1 1 11 19375 1 1 40 LYS HB3 H 12.890 1.111 16.248 1.00 . A A . 40 LYS HB3 1 1 11 19376 1 1 40 LYS HD2 H 11.549 4.058 15.964 1.00 . A A . 40 LYS HD2 1 1 11 19377 1 1 40 LYS HD3 H 13.208 3.526 15.774 1.00 . A A . 40 LYS HD3 1 1 11 19378 1 1 40 LYS HE2 H 12.205 4.030 13.133 1.00 . A A . 40 LYS HE2 1 1 11 19379 1 1 40 LYS HE3 H 11.699 5.383 14.126 1.00 . A A . 40 LYS HE3 1 1 11 19380 1 1 40 LYS HG2 H 12.358 1.904 13.961 1.00 . A A . 40 LYS HG2 1 1 11 19381 1 1 40 LYS HG3 H 10.731 2.325 14.459 1.00 . A A . 40 LYS HG3 1 1 11 19382 1 1 40 LYS HZ1 H 13.868 5.905 13.381 1.00 . A A . 40 LYS HZ1 1 1 11 19383 1 1 40 LYS HZ2 H 14.104 5.437 14.923 1.00 . A A . 40 LYS HZ2 1 1 11 19384 1 1 40 LYS N N 12.246 -0.883 14.784 1.00 . A A . 40 LYS N 1 1 11 19385 1 1 40 LYS NZ N 13.794 5.115 14.013 1.00 . A A . 40 LYS NZ 1 1 11 19386 1 1 40 LYS O O 10.029 0.108 13.485 1.00 . A A . 40 LYS O 1 1 11 19387 1 1 41 GLU C C 6.986 1.479 14.946 1.00 . A A . 41 GLU C 1 1 11 19388 1 1 41 GLU CA C 7.563 0.073 14.767 1.00 . A A . 41 GLU CA 1 1 11 19389 1 1 41 GLU CB C 6.599 -0.987 15.304 1.00 . A A . 41 GLU CB 1 1 11 19390 1 1 41 GLU CD C 5.615 -3.276 14.916 1.00 . A A . 41 GLU CD 1 1 11 19391 1 1 41 GLU CG C 6.459 -2.149 14.319 1.00 . A A . 41 GLU CG 1 1 11 19392 1 1 41 GLU H H 8.828 -0.112 16.412 1.00 . A A . 41 GLU H 1 1 11 19393 1 1 41 GLU HA H 7.752 -0.117 13.711 1.00 . A A . 41 GLU HA 1 1 11 19394 1 1 41 GLU HB2 H 6.960 -1.360 16.262 1.00 . A A . 41 GLU HB2 1 1 11 19395 1 1 41 GLU HB3 H 5.622 -0.538 15.483 1.00 . A A . 41 GLU HB3 1 1 11 19396 1 1 41 GLU HG2 H 5.999 -1.795 13.396 1.00 . A A . 41 GLU HG2 1 1 11 19397 1 1 41 GLU HG3 H 7.447 -2.530 14.057 1.00 . A A . 41 GLU HG3 1 1 11 19398 1 1 41 GLU N N 8.859 -0.025 15.416 1.00 . A A . 41 GLU N 1 1 11 19399 1 1 41 GLU O O 7.049 2.046 16.035 1.00 . A A . 41 GLU O 1 1 11 19400 1 1 41 GLU OE1 O 5.952 -3.702 16.042 1.00 . A A . 41 GLU OE1 1 1 11 19401 1 1 41 GLU OE2 O 4.651 -3.686 14.234 1.00 . A A . 41 GLU OE2 1 1 11 19402 1 1 42 ASP C C 4.683 3.384 12.892 1.00 . A A . 42 ASP C 1 1 11 19403 1 1 42 ASP CA C 5.849 3.330 13.881 1.00 . A A . 42 ASP CA 1 1 11 19404 1 1 42 ASP CB C 6.870 4.391 13.467 1.00 . A A . 42 ASP CB 1 1 11 19405 1 1 42 ASP CG C 7.133 5.478 14.510 1.00 . A A . 42 ASP CG 1 1 11 19406 1 1 42 ASP H H 6.389 1.533 12.976 1.00 . A A . 42 ASP H 1 1 11 19407 1 1 42 ASP HA H 5.529 3.484 14.912 1.00 . A A . 42 ASP HA 1 1 11 19408 1 1 42 ASP HB2 H 7.813 3.895 13.235 1.00 . A A . 42 ASP HB2 1 1 11 19409 1 1 42 ASP HB3 H 6.526 4.866 12.548 1.00 . A A . 42 ASP HB3 1 1 11 19410 1 1 42 ASP N N 6.437 2.001 13.859 1.00 . A A . 42 ASP N 1 1 11 19411 1 1 42 ASP O O 4.554 2.516 12.031 1.00 . A A . 42 ASP O 1 1 11 19412 1 1 42 ASP OD1 O 6.149 5.888 15.163 1.00 . A A . 42 ASP OD1 1 1 11 19413 1 1 42 ASP OD2 O 8.313 5.875 14.632 1.00 . A A . 42 ASP OD2 1 1 11 19414 1 1 43 TYR C C 2.788 5.926 11.437 1.00 . A A . 43 TYR C 1 1 11 19415 1 1 43 TYR CA C 2.712 4.592 12.181 1.00 . A A . 43 TYR CA 1 1 11 19416 1 1 43 TYR CB C 1.489 4.603 13.099 1.00 . A A . 43 TYR CB 1 1 11 19417 1 1 43 TYR CD1 C 1.952 2.179 13.618 1.00 . A A . 43 TYR CD1 1 1 11 19418 1 1 43 TYR CD2 C 0.706 3.460 15.206 1.00 . A A . 43 TYR CD2 1 1 11 19419 1 1 43 TYR CE1 C 1.848 1.023 14.469 1.00 . A A . 43 TYR CE1 1 1 11 19420 1 1 43 TYR CE2 C 0.602 2.303 16.057 1.00 . A A . 43 TYR CE2 1 1 11 19421 1 1 43 TYR CG C 1.378 3.374 14.004 1.00 . A A . 43 TYR CG 1 1 11 19422 1 1 43 TYR CZ C 1.179 1.141 15.647 1.00 . A A . 43 TYR CZ 1 1 11 19423 1 1 43 TYR H H 3.976 5.115 13.752 1.00 . A A . 43 TYR H 1 1 11 19424 1 1 43 TYR HA H 2.709 3.779 11.454 1.00 . A A . 43 TYR HA 1 1 11 19425 1 1 43 TYR HB2 H 1.522 5.497 13.722 1.00 . A A . 43 TYR HB2 1 1 11 19426 1 1 43 TYR HB3 H 0.589 4.673 12.488 1.00 . A A . 43 TYR HB3 1 1 11 19427 1 1 43 TYR HD1 H 2.483 2.112 12.668 1.00 . A A . 43 TYR HD1 1 1 11 19428 1 1 43 TYR HD2 H 0.253 4.403 15.511 1.00 . A A . 43 TYR HD2 1 1 11 19429 1 1 43 TYR HE1 H 2.297 0.073 14.176 1.00 . A A . 43 TYR HE1 1 1 11 19430 1 1 43 TYR HE2 H 0.074 2.357 17.009 1.00 . A A . 43 TYR HE2 1 1 11 19431 1 1 43 TYR HH H 0.705 -0.722 15.937 1.00 . A A . 43 TYR HH 1 1 11 19432 1 1 43 TYR N N 3.863 4.413 13.049 1.00 . A A . 43 TYR N 1 1 11 19433 1 1 43 TYR O O 2.143 6.898 11.828 1.00 . A A . 43 TYR O 1 1 11 19434 1 1 43 TYR OH O 1.081 0.049 16.451 1.00 . A A . 43 TYR OH 1 1 11 19435 1 1 44 ARG C C 3.313 6.872 8.132 1.00 . A A . 44 ARG C 1 1 11 19436 1 1 44 ARG CA C 3.752 7.131 9.574 1.00 . A A . 44 ARG CA 1 1 11 19437 1 1 44 ARG CB C 5.209 7.597 9.581 1.00 . A A . 44 ARG CB 1 1 11 19438 1 1 44 ARG CD C 6.680 9.208 10.847 1.00 . A A . 44 ARG CD 1 1 11 19439 1 1 44 ARG CG C 5.331 9.011 10.153 1.00 . A A . 44 ARG CG 1 1 11 19440 1 1 44 ARG CZ C 6.541 11.347 12.134 1.00 . A A . 44 ARG CZ 1 1 11 19441 1 1 44 ARG H H 4.104 5.138 10.064 1.00 . A A . 44 ARG H 1 1 11 19442 1 1 44 ARG HA H 3.115 7.877 10.050 1.00 . A A . 44 ARG HA 1 1 11 19443 1 1 44 ARG HB2 H 5.812 6.909 10.173 1.00 . A A . 44 ARG HB2 1 1 11 19444 1 1 44 ARG HB3 H 5.606 7.577 8.566 1.00 . A A . 44 ARG HB3 1 1 11 19445 1 1 44 ARG HD2 H 6.684 8.692 11.806 1.00 . A A . 44 ARG HD2 1 1 11 19446 1 1 44 ARG HD3 H 7.475 8.768 10.245 1.00 . A A . 44 ARG HD3 1 1 11 19447 1 1 44 ARG HE H 7.441 11.142 10.336 1.00 . A A . 44 ARG HE 1 1 11 19448 1 1 44 ARG HG2 H 5.219 9.742 9.352 1.00 . A A . 44 ARG HG2 1 1 11 19449 1 1 44 ARG HG3 H 4.523 9.191 10.863 1.00 . A A . 44 ARG HG3 1 1 11 19450 1 1 44 ARG HH11 H 5.647 9.762 13.062 1.00 . A A . 44 ARG HH11 1 1 11 19451 1 1 44 ARG HH12 H 5.568 11.260 13.928 1.00 . A A . 44 ARG HH12 1 1 11 19452 1 1 44 ARG HH21 H 6.568 13.220 12.979 1.00 . A A . 44 ARG HH21 1 1 11 19453 1 1 44 ARG N N 3.583 5.932 10.376 1.00 . A A . 44 ARG N 1 1 11 19454 1 1 44 ARG NE N 6.939 10.651 11.048 1.00 . A A . 44 ARG NE 1 1 11 19455 1 1 44 ARG NH1 N 5.860 10.737 13.127 1.00 . A A . 44 ARG NH1 1 1 11 19456 1 1 44 ARG NH2 N 6.826 12.634 12.210 1.00 . A A . 44 ARG NH2 1 1 11 19457 1 1 44 ARG O O 2.880 5.769 7.800 1.00 . A A . 44 ARG O 1 1 11 19458 1 1 45 LYS C C 4.201 7.148 5.129 1.00 . A A . 45 LYS C 1 1 11 19459 1 1 45 LYS CA C 3.063 7.803 5.914 1.00 . A A . 45 LYS CA 1 1 11 19460 1 1 45 LYS CB C 2.648 9.171 5.369 1.00 . A A . 45 LYS CB 1 1 11 19461 1 1 45 LYS CD C 1.831 10.399 7.415 1.00 . A A . 45 LYS CD 1 1 11 19462 1 1 45 LYS CE C 0.989 11.653 7.657 1.00 . A A . 45 LYS CE 1 1 11 19463 1 1 45 LYS CG C 1.423 9.709 6.111 1.00 . A A . 45 LYS CG 1 1 11 19464 1 1 45 LYS H H 3.795 8.799 7.591 1.00 . A A . 45 LYS H 1 1 11 19465 1 1 45 LYS HA H 2.188 7.155 5.858 1.00 . A A . 45 LYS HA 1 1 11 19466 1 1 45 LYS HB2 H 3.476 9.873 5.470 1.00 . A A . 45 LYS HB2 1 1 11 19467 1 1 45 LYS HB3 H 2.427 9.091 4.305 1.00 . A A . 45 LYS HB3 1 1 11 19468 1 1 45 LYS HD2 H 1.710 9.708 8.249 1.00 . A A . 45 LYS HD2 1 1 11 19469 1 1 45 LYS HD3 H 2.886 10.667 7.373 1.00 . A A . 45 LYS HD3 1 1 11 19470 1 1 45 LYS HE2 H 1.264 12.427 6.941 1.00 . A A . 45 LYS HE2 1 1 11 19471 1 1 45 LYS HE3 H -0.065 11.428 7.494 1.00 . A A . 45 LYS HE3 1 1 11 19472 1 1 45 LYS HG2 H 0.888 10.413 5.475 1.00 . A A . 45 LYS HG2 1 1 11 19473 1 1 45 LYS HG3 H 0.737 8.890 6.328 1.00 . A A . 45 LYS HG3 1 1 11 19474 1 1 45 LYS HZ1 H 2.063 11.829 9.435 1.00 . A A . 45 LYS HZ1 1 1 11 19475 1 1 45 LYS HZ2 H 1.204 13.165 9.075 1.00 . A A . 45 LYS HZ2 1 1 11 19476 1 1 45 LYS N N 3.441 7.905 7.313 1.00 . A A . 45 LYS N 1 1 11 19477 1 1 45 LYS NZ N 1.188 12.152 9.037 1.00 . A A . 45 LYS NZ 1 1 11 19478 1 1 45 LYS O O 5.368 7.487 5.321 1.00 . A A . 45 LYS O 1 1 11 19479 1 1 46 CYS C C 5.530 6.540 2.579 1.00 . A A . 46 CYS C 1 1 11 19480 1 1 46 CYS CA C 4.797 5.515 3.447 1.00 . A A . 46 CYS CA 1 1 11 19481 1 1 46 CYS CB C 4.142 4.418 2.605 1.00 . A A . 46 CYS CB 1 1 11 19482 1 1 46 CYS H H 2.871 5.951 4.111 1.00 . A A . 46 CYS H 1 1 11 19483 1 1 46 CYS HA H 5.486 5.027 4.136 1.00 . A A . 46 CYS HA 1 1 11 19484 1 1 46 CYS HB2 H 3.782 4.860 1.675 1.00 . A A . 46 CYS HB2 1 1 11 19485 1 1 46 CYS HB3 H 4.901 3.684 2.336 1.00 . A A . 46 CYS HB3 1 1 11 19486 1 1 46 CYS N N 3.822 6.221 4.261 1.00 . A A . 46 CYS N 1 1 11 19487 1 1 46 CYS O O 6.759 6.541 2.519 1.00 . A A . 46 CYS O 1 1 11 19488 1 1 46 CYS SG S 2.751 3.552 3.419 1.00 . A A . 46 CYS SG 1 1 11 19489 1 1 47 GLY C C 5.906 9.555 1.893 1.00 . A A . 47 GLY C 1 1 11 19490 1 1 47 GLY CA C 5.306 8.414 1.068 1.00 . A A . 47 GLY CA 1 1 11 19491 1 1 47 GLY H H 3.748 7.379 1.985 1.00 . A A . 47 GLY H 1 1 11 19492 1 1 47 GLY HA2 H 6.074 7.979 0.429 1.00 . A A . 47 GLY HA2 1 1 11 19493 1 1 47 GLY HA3 H 4.529 8.806 0.411 1.00 . A A . 47 GLY HA3 1 1 11 19494 1 1 47 GLY N N 4.746 7.387 1.930 1.00 . A A . 47 GLY N 1 1 11 19495 1 1 47 GLY O O 5.574 10.720 1.681 1.00 . A A . 47 GLY O 1 1 11 19496 1 1 48 THR C C 8.807 10.519 3.119 1.00 . A A . 48 THR C 1 1 11 19497 1 1 48 THR CA C 7.428 10.155 3.674 1.00 . A A . 48 THR CA 1 1 11 19498 1 1 48 THR CB C 7.475 9.582 5.091 1.00 . A A . 48 THR CB 1 1 11 19499 1 1 48 THR CG2 C 8.552 10.243 5.955 1.00 . A A . 48 THR CG2 1 1 11 19500 1 1 48 THR H H 7.044 8.229 2.981 1.00 . A A . 48 THR H 1 1 11 19501 1 1 48 THR HA H 6.831 11.067 3.669 1.00 . A A . 48 THR HA 1 1 11 19502 1 1 48 THR HB H 7.603 8.500 5.070 1.00 . A A . 48 THR HB 1 1 11 19503 1 1 48 THR HG1 H 6.223 11.007 5.728 1.00 . A A . 48 THR HG1 1 1 11 19504 1 1 48 THR HG21 H 8.424 11.325 5.931 1.00 . A A . 48 THR HG21 1 1 11 19505 1 1 48 THR HG22 H 8.462 9.888 6.982 1.00 . A A . 48 THR HG22 1 1 11 19506 1 1 48 THR HG23 H 9.538 9.985 5.566 1.00 . A A . 48 THR HG23 1 1 11 19507 1 1 48 THR N N 6.779 9.179 2.816 1.00 . A A . 48 THR N 1 1 11 19508 1 1 48 THR O O 9.587 9.639 2.758 1.00 . A A . 48 THR O 1 1 11 19509 1 1 48 THR OG1 O 6.249 10.009 5.679 1.00 . A A . 48 THR OG1 1 1 11 19510 1 1 49 ALA C C 11.478 11.650 3.342 1.00 . A A . 49 ALA C 1 1 11 19511 1 1 49 ALA CA C 10.337 12.308 2.565 1.00 . A A . 49 ALA CA 1 1 11 19512 1 1 49 ALA CB C 10.370 13.835 2.662 1.00 . A A . 49 ALA CB 1 1 11 19513 1 1 49 ALA H H 8.427 12.527 3.365 1.00 . A A . 49 ALA H 1 1 11 19514 1 1 49 ALA HA H 10.411 12.022 1.516 1.00 . A A . 49 ALA HA 1 1 11 19515 1 1 49 ALA HB1 H 9.684 14.164 3.442 1.00 . A A . 49 ALA HB1 1 1 11 19516 1 1 49 ALA HB2 H 11.381 14.161 2.907 1.00 . A A . 49 ALA HB2 1 1 11 19517 1 1 49 ALA HB3 H 10.069 14.267 1.708 1.00 . A A . 49 ALA HB3 1 1 11 19518 1 1 49 ALA N N 9.066 11.817 3.069 1.00 . A A . 49 ALA N 1 1 11 19519 1 1 49 ALA O O 11.699 11.962 4.512 1.00 . A A . 49 ALA O 1 1 11 19520 1 1 50 GLY C C 13.018 8.539 3.328 1.00 . A A . 50 GLY C 1 1 11 19521 1 1 50 GLY CA C 13.286 10.045 3.274 1.00 . A A . 50 GLY CA 1 1 11 19522 1 1 50 GLY H H 11.988 10.502 1.711 1.00 . A A . 50 GLY H 1 1 11 19523 1 1 50 GLY HA2 H 14.198 10.235 2.708 1.00 . A A . 50 GLY HA2 1 1 11 19524 1 1 50 GLY HA3 H 13.452 10.424 4.283 1.00 . A A . 50 GLY HA3 1 1 11 19525 1 1 50 GLY N N 12.174 10.750 2.662 1.00 . A A . 50 GLY N 1 1 11 19526 1 1 50 GLY O O 13.928 7.751 3.582 1.00 . A A . 50 GLY O 1 1 11 19527 1 1 51 CYS C C 11.167 6.326 1.658 1.00 . A A . 51 CYS C 1 1 11 19528 1 1 51 CYS CA C 11.365 6.788 3.103 1.00 . A A . 51 CYS CA 1 1 11 19529 1 1 51 CYS CB C 10.109 6.570 3.949 1.00 . A A . 51 CYS CB 1 1 11 19530 1 1 51 CYS H H 11.031 8.832 2.879 1.00 . A A . 51 CYS H 1 1 11 19531 1 1 51 CYS HA H 12.176 6.236 3.578 1.00 . A A . 51 CYS HA 1 1 11 19532 1 1 51 CYS HB2 H 9.312 7.231 3.609 1.00 . A A . 51 CYS HB2 1 1 11 19533 1 1 51 CYS HB3 H 9.750 5.548 3.826 1.00 . A A . 51 CYS HB3 1 1 11 19534 1 1 51 CYS N N 11.765 8.185 3.085 1.00 . A A . 51 CYS N 1 1 11 19535 1 1 51 CYS O O 12.125 5.947 0.987 1.00 . A A . 51 CYS O 1 1 11 19536 1 1 51 CYS SG S 10.478 6.893 5.712 1.00 . A A . 51 CYS SG 1 1 11 19537 1 1 52 HIS C C 9.340 7.204 -0.998 1.00 . A A . 52 HIS C 1 1 11 19538 1 1 52 HIS CA C 9.581 5.966 -0.132 1.00 . A A . 52 HIS CA 1 1 11 19539 1 1 52 HIS CB C 8.391 5.004 -0.129 1.00 . A A . 52 HIS CB 1 1 11 19540 1 1 52 HIS CD2 C 8.262 3.120 1.679 1.00 . A A . 52 HIS CD2 1 1 11 19541 1 1 52 HIS CE1 C 9.566 1.660 0.701 1.00 . A A . 52 HIS CE1 1 1 11 19542 1 1 52 HIS CG C 8.686 3.664 0.501 1.00 . A A . 52 HIS CG 1 1 11 19543 1 1 52 HIS H H 9.143 6.685 1.773 1.00 . A A . 52 HIS H 1 1 11 19544 1 1 52 HIS HA H 10.444 5.425 -0.519 1.00 . A A . 52 HIS HA 1 1 11 19545 1 1 52 HIS HB2 H 7.561 5.470 0.403 1.00 . A A . 52 HIS HB2 1 1 11 19546 1 1 52 HIS HB3 H 8.062 4.846 -1.156 1.00 . A A . 52 HIS HB3 1 1 11 19547 1 1 52 HIS HD1 H 9.974 2.822 -0.970 1.00 . A A . 52 HIS HD1 1 1 11 19548 1 1 52 HIS HD2 H 7.600 3.599 2.399 1.00 . A A . 52 HIS HD2 1 1 11 19549 1 1 52 HIS HE1 H 10.133 0.749 0.510 1.00 . A A . 52 HIS HE1 1 1 11 19550 1 1 52 HIS N N 9.917 6.375 1.221 1.00 . A A . 52 HIS N 1 1 11 19551 1 1 52 HIS ND1 N 9.506 2.720 -0.092 1.00 . A A . 52 HIS ND1 1 1 11 19552 1 1 52 HIS NE2 N 8.794 1.910 1.797 1.00 . A A . 52 HIS NE2 1 1 11 19553 1 1 52 HIS O O 8.213 7.463 -1.417 1.00 . A A . 52 HIS O 1 1 11 19554 1 1 53 ASP C C 11.442 9.117 -3.103 1.00 . A A . 53 ASP C 1 1 11 19555 1 1 53 ASP CA C 10.337 9.142 -2.046 1.00 . A A . 53 ASP CA 1 1 11 19556 1 1 53 ASP CB C 10.532 10.394 -1.188 1.00 . A A . 53 ASP CB 1 1 11 19557 1 1 53 ASP CG C 9.826 11.649 -1.705 1.00 . A A . 53 ASP CG 1 1 11 19558 1 1 53 ASP H H 11.330 7.719 -0.893 1.00 . A A . 53 ASP H 1 1 11 19559 1 1 53 ASP HA H 9.339 9.127 -2.485 1.00 . A A . 53 ASP HA 1 1 11 19560 1 1 53 ASP HB2 H 10.176 10.184 -0.180 1.00 . A A . 53 ASP HB2 1 1 11 19561 1 1 53 ASP HB3 H 11.599 10.601 -1.112 1.00 . A A . 53 ASP HB3 1 1 11 19562 1 1 53 ASP N N 10.417 7.937 -1.238 1.00 . A A . 53 ASP N 1 1 11 19563 1 1 53 ASP O O 12.458 9.796 -2.961 1.00 . A A . 53 ASP O 1 1 11 19564 1 1 53 ASP OD1 O 8.752 11.482 -2.324 1.00 . A A . 53 ASP OD1 1 1 11 19565 1 1 53 ASP OD2 O 10.375 12.747 -1.470 1.00 . A A . 53 ASP OD2 1 1 11 19566 1 1 54 SER C C 11.602 8.820 -6.501 1.00 . A A . 54 SER C 1 1 11 19567 1 1 54 SER CA C 12.170 8.203 -5.221 1.00 . A A . 54 SER CA 1 1 11 19568 1 1 54 SER CB C 12.548 6.740 -5.459 1.00 . A A . 54 SER CB 1 1 11 19569 1 1 54 SER H H 10.378 7.778 -4.249 1.00 . A A . 54 SER H 1 1 11 19570 1 1 54 SER HA H 13.050 8.755 -4.889 1.00 . A A . 54 SER HA 1 1 11 19571 1 1 54 SER HB2 H 13.570 6.685 -5.833 1.00 . A A . 54 SER HB2 1 1 11 19572 1 1 54 SER HB3 H 12.526 6.201 -4.512 1.00 . A A . 54 SER HB3 1 1 11 19573 1 1 54 SER HG H 11.937 5.150 -6.511 1.00 . A A . 54 SER HG 1 1 11 19574 1 1 54 SER N N 11.207 8.326 -4.141 1.00 . A A . 54 SER N 1 1 11 19575 1 1 54 SER O O 12.355 9.259 -7.370 1.00 . A A . 54 SER O 1 1 11 19576 1 1 54 SER OG O 11.670 6.106 -6.385 1.00 . A A . 54 SER OG 1 1 11 19577 1 1 55 MET C C 10.111 8.744 -9.029 1.00 . A A . 55 MET C 1 1 11 19578 1 1 55 MET CA C 9.602 9.387 -7.737 1.00 . A A . 55 MET CA 1 1 11 19579 1 1 55 MET CB C 9.838 10.898 -7.792 1.00 . A A . 55 MET CB 1 1 11 19580 1 1 55 MET CE C 7.350 10.281 -5.452 1.00 . A A . 55 MET CE 1 1 11 19581 1 1 55 MET CG C 8.551 11.665 -7.482 1.00 . A A . 55 MET CG 1 1 11 19582 1 1 55 MET H H 9.675 8.474 -5.867 1.00 . A A . 55 MET H 1 1 11 19583 1 1 55 MET HA H 8.547 9.155 -7.598 1.00 . A A . 55 MET HA 1 1 11 19584 1 1 55 MET HB2 H 10.612 11.175 -7.076 1.00 . A A . 55 MET HB2 1 1 11 19585 1 1 55 MET HB3 H 10.203 11.177 -8.780 1.00 . A A . 55 MET HB3 1 1 11 19586 1 1 55 MET HE1 H 6.465 10.302 -6.089 1.00 . A A . 55 MET HE1 1 1 11 19587 1 1 55 MET HE2 H 7.955 9.408 -5.700 1.00 . A A . 55 MET HE2 1 1 11 19588 1 1 55 MET HE3 H 7.045 10.227 -4.407 1.00 . A A . 55 MET HE3 1 1 11 19589 1 1 55 MET HG2 H 8.604 12.668 -7.906 1.00 . A A . 55 MET HG2 1 1 11 19590 1 1 55 MET HG3 H 7.700 11.167 -7.947 1.00 . A A . 55 MET HG3 1 1 11 19591 1 1 55 MET N N 10.280 8.833 -6.577 1.00 . A A . 55 MET N 1 1 11 19592 1 1 55 MET O O 10.201 9.405 -10.062 1.00 . A A . 55 MET O 1 1 11 19593 1 1 55 MET SD S 8.309 11.763 -5.716 1.00 . A A . 55 MET SD 1 1 11 19594 1 1 56 ASP C C 10.143 5.416 -10.213 1.00 . A A . 56 ASP C 1 1 11 19595 1 1 56 ASP CA C 10.927 6.722 -10.075 1.00 . A A . 56 ASP CA 1 1 11 19596 1 1 56 ASP CB C 12.406 6.371 -9.905 1.00 . A A . 56 ASP CB 1 1 11 19597 1 1 56 ASP CG C 13.331 7.565 -9.660 1.00 . A A . 56 ASP CG 1 1 11 19598 1 1 56 ASP H H 10.354 6.932 -8.084 1.00 . A A . 56 ASP H 1 1 11 19599 1 1 56 ASP HA H 10.785 7.386 -10.928 1.00 . A A . 56 ASP HA 1 1 11 19600 1 1 56 ASP HB2 H 12.505 5.676 -9.071 1.00 . A A . 56 ASP HB2 1 1 11 19601 1 1 56 ASP HB3 H 12.745 5.846 -10.798 1.00 . A A . 56 ASP HB3 1 1 11 19602 1 1 56 ASP N N 10.430 7.462 -8.928 1.00 . A A . 56 ASP N 1 1 11 19603 1 1 56 ASP O O 10.643 4.348 -9.862 1.00 . A A . 56 ASP O 1 1 11 19604 1 1 56 ASP OD1 O 13.156 8.575 -10.375 1.00 . A A . 56 ASP OD1 1 1 11 19605 1 1 56 ASP OD2 O 14.193 7.440 -8.762 1.00 . A A . 56 ASP OD2 1 1 11 19606 1 1 57 LYS C C 8.909 3.212 -11.422 1.00 . A A . 57 LYS C 1 1 11 19607 1 1 57 LYS CA C 8.070 4.386 -10.913 1.00 . A A . 57 LYS CA 1 1 11 19608 1 1 57 LYS CB C 6.889 4.736 -11.820 1.00 . A A . 57 LYS CB 1 1 11 19609 1 1 57 LYS CD C 6.143 3.184 -13.663 1.00 . A A . 57 LYS CD 1 1 11 19610 1 1 57 LYS CE C 5.037 3.918 -14.424 1.00 . A A . 57 LYS CE 1 1 11 19611 1 1 57 LYS CG C 6.073 3.488 -12.165 1.00 . A A . 57 LYS CG 1 1 11 19612 1 1 57 LYS H H 8.529 6.415 -11.009 1.00 . A A . 57 LYS H 1 1 11 19613 1 1 57 LYS HA H 7.661 4.121 -9.939 1.00 . A A . 57 LYS HA 1 1 11 19614 1 1 57 LYS HB2 H 6.250 5.468 -11.326 1.00 . A A . 57 LYS HB2 1 1 11 19615 1 1 57 LYS HB3 H 7.254 5.201 -12.736 1.00 . A A . 57 LYS HB3 1 1 11 19616 1 1 57 LYS HD2 H 7.116 3.481 -14.053 1.00 . A A . 57 LYS HD2 1 1 11 19617 1 1 57 LYS HD3 H 6.050 2.110 -13.824 1.00 . A A . 57 LYS HD3 1 1 11 19618 1 1 57 LYS HE2 H 4.061 3.591 -14.063 1.00 . A A . 57 LYS HE2 1 1 11 19619 1 1 57 LYS HE3 H 5.104 4.989 -14.233 1.00 . A A . 57 LYS HE3 1 1 11 19620 1 1 57 LYS HG2 H 6.449 2.636 -11.599 1.00 . A A . 57 LYS HG2 1 1 11 19621 1 1 57 LYS HG3 H 5.035 3.635 -11.868 1.00 . A A . 57 LYS HG3 1 1 11 19622 1 1 57 LYS HZ1 H 4.652 4.353 -16.425 1.00 . A A . 57 LYS HZ1 1 1 11 19623 1 1 57 LYS HZ2 H 6.111 3.669 -16.192 1.00 . A A . 57 LYS HZ2 1 1 11 19624 1 1 57 LYS N N 8.928 5.543 -10.725 1.00 . A A . 57 LYS N 1 1 11 19625 1 1 57 LYS NZ N 5.147 3.659 -15.877 1.00 . A A . 57 LYS NZ 1 1 11 19626 1 1 57 LYS O O 8.939 2.151 -10.801 1.00 . A A . 57 LYS O 1 1 11 19627 1 1 58 LYS C C 11.755 2.378 -12.426 1.00 . A A . 58 LYS C 1 1 11 19628 1 1 58 LYS CA C 10.406 2.416 -13.147 1.00 . A A . 58 LYS CA 1 1 11 19629 1 1 58 LYS CB C 10.522 2.634 -14.657 1.00 . A A . 58 LYS CB 1 1 11 19630 1 1 58 LYS CD C 11.099 0.364 -15.591 1.00 . A A . 58 LYS CD 1 1 11 19631 1 1 58 LYS CE C 11.896 0.596 -16.876 1.00 . A A . 58 LYS CE 1 1 11 19632 1 1 58 LYS CG C 10.003 1.419 -15.428 1.00 . A A . 58 LYS CG 1 1 11 19633 1 1 58 LYS H H 9.540 4.308 -13.046 1.00 . A A . 58 LYS H 1 1 11 19634 1 1 58 LYS HA H 9.907 1.459 -12.997 1.00 . A A . 58 LYS HA 1 1 11 19635 1 1 58 LYS HB2 H 9.957 3.521 -14.945 1.00 . A A . 58 LYS HB2 1 1 11 19636 1 1 58 LYS HB3 H 11.563 2.820 -14.922 1.00 . A A . 58 LYS HB3 1 1 11 19637 1 1 58 LYS HD2 H 11.769 0.394 -14.732 1.00 . A A . 58 LYS HD2 1 1 11 19638 1 1 58 LYS HD3 H 10.651 -0.630 -15.611 1.00 . A A . 58 LYS HD3 1 1 11 19639 1 1 58 LYS HE2 H 12.080 1.662 -17.009 1.00 . A A . 58 LYS HE2 1 1 11 19640 1 1 58 LYS HE3 H 12.870 0.112 -16.799 1.00 . A A . 58 LYS HE3 1 1 11 19641 1 1 58 LYS HG2 H 9.152 0.986 -14.901 1.00 . A A . 58 LYS HG2 1 1 11 19642 1 1 58 LYS HG3 H 9.645 1.732 -16.409 1.00 . A A . 58 LYS HG3 1 1 11 19643 1 1 58 LYS HZ1 H 11.068 0.753 -18.782 1.00 . A A . 58 LYS HZ1 1 1 11 19644 1 1 58 LYS HZ2 H 11.629 -0.739 -18.453 1.00 . A A . 58 LYS HZ2 1 1 11 19645 1 1 58 LYS N N 9.569 3.442 -12.547 1.00 . A A . 58 LYS N 1 1 11 19646 1 1 58 LYS NZ N 11.162 0.063 -18.045 1.00 . A A . 58 LYS NZ 1 1 11 19647 1 1 58 LYS O O 12.785 2.709 -13.011 1.00 . A A . 58 LYS O 1 1 11 19648 1 1 59 ASP C C 12.839 0.641 -9.473 1.00 . A A . 59 ASP C 1 1 11 19649 1 1 59 ASP CA C 12.910 1.888 -10.358 1.00 . A A . 59 ASP CA 1 1 11 19650 1 1 59 ASP CB C 13.048 3.108 -9.445 1.00 . A A . 59 ASP CB 1 1 11 19651 1 1 59 ASP CG C 14.315 3.133 -8.587 1.00 . A A . 59 ASP CG 1 1 11 19652 1 1 59 ASP H H 10.863 1.705 -10.697 1.00 . A A . 59 ASP H 1 1 11 19653 1 1 59 ASP HA H 13.731 1.846 -11.073 1.00 . A A . 59 ASP HA 1 1 11 19654 1 1 59 ASP HB2 H 13.026 4.007 -10.061 1.00 . A A . 59 ASP HB2 1 1 11 19655 1 1 59 ASP HB3 H 12.181 3.151 -8.787 1.00 . A A . 59 ASP HB3 1 1 11 19656 1 1 59 ASP N N 11.705 1.972 -11.165 1.00 . A A . 59 ASP N 1 1 11 19657 1 1 59 ASP O O 13.724 -0.212 -9.525 1.00 . A A . 59 ASP O 1 1 11 19658 1 1 59 ASP OD1 O 14.627 2.072 -8.005 1.00 . A A . 59 ASP OD1 1 1 11 19659 1 1 59 ASP OD2 O 14.942 4.213 -8.533 1.00 . A A . 59 ASP OD2 1 1 11 19660 1 1 60 LYS C C 12.678 -0.549 -6.721 1.00 . A A . 60 LYS C 1 1 11 19661 1 1 60 LYS CA C 11.581 -0.552 -7.787 1.00 . A A . 60 LYS CA 1 1 11 19662 1 1 60 LYS CB C 11.498 -1.857 -8.581 1.00 . A A . 60 LYS CB 1 1 11 19663 1 1 60 LYS CD C 11.238 -1.665 -11.082 1.00 . A A . 60 LYS CD 1 1 11 19664 1 1 60 LYS CE C 10.516 -2.498 -12.142 1.00 . A A . 60 LYS CE 1 1 11 19665 1 1 60 LYS CG C 10.506 -1.732 -9.740 1.00 . A A . 60 LYS CG 1 1 11 19666 1 1 60 LYS H H 11.063 1.274 -8.646 1.00 . A A . 60 LYS H 1 1 11 19667 1 1 60 LYS HA H 10.619 -0.413 -7.294 1.00 . A A . 60 LYS HA 1 1 11 19668 1 1 60 LYS HB2 H 12.483 -2.117 -8.967 1.00 . A A . 60 LYS HB2 1 1 11 19669 1 1 60 LYS HB3 H 11.191 -2.669 -7.921 1.00 . A A . 60 LYS HB3 1 1 11 19670 1 1 60 LYS HD2 H 11.305 -0.628 -11.412 1.00 . A A . 60 LYS HD2 1 1 11 19671 1 1 60 LYS HD3 H 12.259 -2.028 -10.962 1.00 . A A . 60 LYS HD3 1 1 11 19672 1 1 60 LYS HE2 H 10.384 -3.519 -11.783 1.00 . A A . 60 LYS HE2 1 1 11 19673 1 1 60 LYS HE3 H 9.520 -2.091 -12.317 1.00 . A A . 60 LYS HE3 1 1 11 19674 1 1 60 LYS HG2 H 9.826 -2.584 -9.734 1.00 . A A . 60 LYS HG2 1 1 11 19675 1 1 60 LYS HG3 H 9.898 -0.838 -9.608 1.00 . A A . 60 LYS HG3 1 1 11 19676 1 1 60 LYS HZ1 H 11.460 -3.448 -13.739 1.00 . A A . 60 LYS HZ1 1 1 11 19677 1 1 60 LYS HZ2 H 10.797 -2.019 -14.151 1.00 . A A . 60 LYS HZ2 1 1 11 19678 1 1 60 LYS N N 11.778 0.576 -8.682 1.00 . A A . 60 LYS N 1 1 11 19679 1 1 60 LYS NZ N 11.284 -2.506 -13.407 1.00 . A A . 60 LYS NZ 1 1 11 19680 1 1 60 LYS O O 13.130 0.511 -6.292 1.00 . A A . 60 LYS O 1 1 11 19681 1 1 61 SER C C 13.497 -1.808 -3.917 1.00 . A A . 61 SER C 1 1 11 19682 1 1 61 SER CA C 14.111 -1.899 -5.315 1.00 . A A . 61 SER CA 1 1 11 19683 1 1 61 SER CB C 15.202 -0.840 -5.485 1.00 . A A . 61 SER CB 1 1 11 19684 1 1 61 SER H H 12.703 -2.607 -6.677 1.00 . A A . 61 SER H 1 1 11 19685 1 1 61 SER HA H 14.536 -2.888 -5.483 1.00 . A A . 61 SER HA 1 1 11 19686 1 1 61 SER HB2 H 15.238 -0.520 -6.527 1.00 . A A . 61 SER HB2 1 1 11 19687 1 1 61 SER HB3 H 14.951 0.038 -4.891 1.00 . A A . 61 SER HB3 1 1 11 19688 1 1 61 SER HG H 17.084 -1.387 -5.892 1.00 . A A . 61 SER HG 1 1 11 19689 1 1 61 SER N N 13.076 -1.749 -6.324 1.00 . A A . 61 SER N 1 1 11 19690 1 1 61 SER O O 13.414 -2.808 -3.206 1.00 . A A . 61 SER O 1 1 11 19691 1 1 61 SER OG O 16.483 -1.326 -5.094 1.00 . A A . 61 SER OG 1 1 11 19692 1 1 62 ALA C C 12.004 1.086 -2.181 1.00 . A A . 62 ALA C 1 1 11 19693 1 1 62 ALA CA C 12.478 -0.366 -2.264 1.00 . A A . 62 ALA CA 1 1 11 19694 1 1 62 ALA CB C 13.483 -0.715 -1.164 1.00 . A A . 62 ALA CB 1 1 11 19695 1 1 62 ALA H H 13.153 0.208 -4.149 1.00 . A A . 62 ALA H 1 1 11 19696 1 1 62 ALA HA H 11.616 -1.027 -2.174 1.00 . A A . 62 ALA HA 1 1 11 19697 1 1 62 ALA HB1 H 14.166 -1.484 -1.526 1.00 . A A . 62 ALA HB1 1 1 11 19698 1 1 62 ALA HB2 H 14.050 0.175 -0.894 1.00 . A A . 62 ALA HB2 1 1 11 19699 1 1 62 ALA HB3 H 12.950 -1.086 -0.289 1.00 . A A . 62 ALA HB3 1 1 11 19700 1 1 62 ALA N N 13.082 -0.600 -3.565 1.00 . A A . 62 ALA N 1 1 11 19701 1 1 62 ALA O O 10.886 1.354 -1.744 1.00 . A A . 62 ALA O 1 1 11 19702 1 1 63 LYS C C 11.410 3.681 -3.552 1.00 . A A . 63 LYS C 1 1 11 19703 1 1 63 LYS CA C 12.563 3.404 -2.585 1.00 . A A . 63 LYS CA 1 1 11 19704 1 1 63 LYS CB C 13.816 4.236 -2.868 1.00 . A A . 63 LYS CB 1 1 11 19705 1 1 63 LYS CD C 14.846 5.523 -0.959 1.00 . A A . 63 LYS CD 1 1 11 19706 1 1 63 LYS CE C 16.087 5.612 -0.068 1.00 . A A . 63 LYS CE 1 1 11 19707 1 1 63 LYS CG C 14.789 4.179 -1.688 1.00 . A A . 63 LYS CG 1 1 11 19708 1 1 63 LYS H H 13.786 1.760 -2.961 1.00 . A A . 63 LYS H 1 1 11 19709 1 1 63 LYS HA H 12.234 3.651 -1.576 1.00 . A A . 63 LYS HA 1 1 11 19710 1 1 63 LYS HB2 H 14.307 3.866 -3.767 1.00 . A A . 63 LYS HB2 1 1 11 19711 1 1 63 LYS HB3 H 13.534 5.271 -3.062 1.00 . A A . 63 LYS HB3 1 1 11 19712 1 1 63 LYS HD2 H 14.858 6.335 -1.686 1.00 . A A . 63 LYS HD2 1 1 11 19713 1 1 63 LYS HD3 H 13.949 5.651 -0.353 1.00 . A A . 63 LYS HD3 1 1 11 19714 1 1 63 LYS HE2 H 16.062 4.819 0.680 1.00 . A A . 63 LYS HE2 1 1 11 19715 1 1 63 LYS HE3 H 16.984 5.456 -0.668 1.00 . A A . 63 LYS HE3 1 1 11 19716 1 1 63 LYS HG2 H 14.480 3.398 -0.994 1.00 . A A . 63 LYS HG2 1 1 11 19717 1 1 63 LYS HG3 H 15.784 3.913 -2.046 1.00 . A A . 63 LYS HG3 1 1 11 19718 1 1 63 LYS HZ1 H 16.678 6.892 1.466 1.00 . A A . 63 LYS HZ1 1 1 11 19719 1 1 63 LYS HZ2 H 16.600 7.630 0.016 1.00 . A A . 63 LYS HZ2 1 1 11 19720 1 1 63 LYS N N 12.878 1.986 -2.606 1.00 . A A . 63 LYS N 1 1 11 19721 1 1 63 LYS NZ N 16.153 6.931 0.599 1.00 . A A . 63 LYS NZ 1 1 11 19722 1 1 63 LYS O O 10.830 4.765 -3.538 1.00 . A A . 63 LYS O 1 1 11 19723 1 1 64 GLY C C 8.677 2.856 -4.651 1.00 . A A . 64 GLY C 1 1 11 19724 1 1 64 GLY CA C 10.041 2.803 -5.343 1.00 . A A . 64 GLY CA 1 1 11 19725 1 1 64 GLY H H 11.591 1.803 -4.376 1.00 . A A . 64 GLY H 1 1 11 19726 1 1 64 GLY HA2 H 10.186 3.705 -5.938 1.00 . A A . 64 GLY HA2 1 1 11 19727 1 1 64 GLY HA3 H 10.072 1.959 -6.031 1.00 . A A . 64 GLY HA3 1 1 11 19728 1 1 64 GLY N N 11.114 2.681 -4.370 1.00 . A A . 64 GLY N 1 1 11 19729 1 1 64 GLY O O 8.073 1.818 -4.383 1.00 . A A . 64 GLY O 1 1 11 19730 1 1 65 TYR C C 5.833 3.545 -4.473 1.00 . A A . 65 TYR C 1 1 11 19731 1 1 65 TYR CA C 6.951 4.275 -3.727 1.00 . A A . 65 TYR CA 1 1 11 19732 1 1 65 TYR CB C 6.683 5.781 -3.777 1.00 . A A . 65 TYR CB 1 1 11 19733 1 1 65 TYR CD1 C 5.040 6.253 -1.924 1.00 . A A . 65 TYR CD1 1 1 11 19734 1 1 65 TYR CD2 C 4.294 6.476 -4.184 1.00 . A A . 65 TYR CD2 1 1 11 19735 1 1 65 TYR CE1 C 3.732 6.631 -1.455 1.00 . A A . 65 TYR CE1 1 1 11 19736 1 1 65 TYR CE2 C 2.986 6.854 -3.715 1.00 . A A . 65 TYR CE2 1 1 11 19737 1 1 65 TYR CG C 5.294 6.183 -3.279 1.00 . A A . 65 TYR CG 1 1 11 19738 1 1 65 TYR CZ C 2.770 6.913 -2.374 1.00 . A A . 65 TYR CZ 1 1 11 19739 1 1 65 TYR H H 8.730 4.913 -4.604 1.00 . A A . 65 TYR H 1 1 11 19740 1 1 65 TYR HA H 7.024 3.875 -2.716 1.00 . A A . 65 TYR HA 1 1 11 19741 1 1 65 TYR HB2 H 7.436 6.293 -3.177 1.00 . A A . 65 TYR HB2 1 1 11 19742 1 1 65 TYR HB3 H 6.804 6.127 -4.803 1.00 . A A . 65 TYR HB3 1 1 11 19743 1 1 65 TYR HD1 H 5.830 6.021 -1.209 1.00 . A A . 65 TYR HD1 1 1 11 19744 1 1 65 TYR HD2 H 4.495 6.420 -5.254 1.00 . A A . 65 TYR HD2 1 1 11 19745 1 1 65 TYR HE1 H 3.518 6.690 -0.388 1.00 . A A . 65 TYR HE1 1 1 11 19746 1 1 65 TYR HE2 H 2.188 7.088 -4.419 1.00 . A A . 65 TYR HE2 1 1 11 19747 1 1 65 TYR HH H 1.490 8.261 -1.803 1.00 . A A . 65 TYR HH 1 1 11 19748 1 1 65 TYR N N 8.232 4.074 -4.382 1.00 . A A . 65 TYR N 1 1 11 19749 1 1 65 TYR O O 4.916 3.007 -3.854 1.00 . A A . 65 TYR O 1 1 11 19750 1 1 65 TYR OH O 1.535 7.270 -1.931 1.00 . A A . 65 TYR OH 1 1 11 19751 1 1 66 TYR C C 5.279 1.411 -6.807 1.00 . A A . 66 TYR C 1 1 11 19752 1 1 66 TYR CA C 4.954 2.896 -6.631 1.00 . A A . 66 TYR CA 1 1 11 19753 1 1 66 TYR CB C 5.031 3.587 -7.994 1.00 . A A . 66 TYR CB 1 1 11 19754 1 1 66 TYR CD1 C 5.354 1.734 -9.673 1.00 . A A . 66 TYR CD1 1 1 11 19755 1 1 66 TYR CD2 C 3.288 2.934 -9.694 1.00 . A A . 66 TYR CD2 1 1 11 19756 1 1 66 TYR CE1 C 4.894 0.921 -10.768 1.00 . A A . 66 TYR CE1 1 1 11 19757 1 1 66 TYR CE2 C 2.827 2.121 -10.790 1.00 . A A . 66 TYR CE2 1 1 11 19758 1 1 66 TYR CG C 4.542 2.724 -9.158 1.00 . A A . 66 TYR CG 1 1 11 19759 1 1 66 TYR CZ C 3.653 1.155 -11.273 1.00 . A A . 66 TYR CZ 1 1 11 19760 1 1 66 TYR H H 6.694 3.990 -6.290 1.00 . A A . 66 TYR H 1 1 11 19761 1 1 66 TYR HA H 3.984 2.993 -6.143 1.00 . A A . 66 TYR HA 1 1 11 19762 1 1 66 TYR HB2 H 4.440 4.502 -7.960 1.00 . A A . 66 TYR HB2 1 1 11 19763 1 1 66 TYR HB3 H 6.063 3.882 -8.183 1.00 . A A . 66 TYR HB3 1 1 11 19764 1 1 66 TYR HD1 H 6.345 1.567 -9.249 1.00 . A A . 66 TYR HD1 1 1 11 19765 1 1 66 TYR HD2 H 2.646 3.716 -9.288 1.00 . A A . 66 TYR HD2 1 1 11 19766 1 1 66 TYR HE1 H 5.525 0.136 -11.184 1.00 . A A . 66 TYR HE1 1 1 11 19767 1 1 66 TYR HE2 H 1.839 2.277 -11.222 1.00 . A A . 66 TYR HE2 1 1 11 19768 1 1 66 TYR HH H 2.470 -0.204 -12.004 1.00 . A A . 66 TYR HH 1 1 11 19769 1 1 66 TYR N N 5.945 3.550 -5.794 1.00 . A A . 66 TYR N 1 1 11 19770 1 1 66 TYR O O 4.559 0.692 -7.497 1.00 . A A . 66 TYR O 1 1 11 19771 1 1 66 TYR OH O 3.218 0.387 -12.308 1.00 . A A . 66 TYR OH 1 1 11 19772 1 1 67 HIS C C 6.340 -1.138 -4.992 1.00 . A A . 67 HIS C 1 1 11 19773 1 1 67 HIS CA C 6.794 -0.389 -6.247 1.00 . A A . 67 HIS CA 1 1 11 19774 1 1 67 HIS CB C 8.304 -0.478 -6.476 1.00 . A A . 67 HIS CB 1 1 11 19775 1 1 67 HIS CD2 C 9.334 -1.832 -4.492 1.00 . A A . 67 HIS CD2 1 1 11 19776 1 1 67 HIS CE1 C 9.859 -3.648 -5.593 1.00 . A A . 67 HIS CE1 1 1 11 19777 1 1 67 HIS CG C 8.961 -1.653 -5.792 1.00 . A A . 67 HIS CG 1 1 11 19778 1 1 67 HIS H H 6.944 1.588 -5.609 1.00 . A A . 67 HIS H 1 1 11 19779 1 1 67 HIS HA H 6.300 -0.822 -7.116 1.00 . A A . 67 HIS HA 1 1 11 19780 1 1 67 HIS HB2 H 8.495 -0.542 -7.547 1.00 . A A . 67 HIS HB2 1 1 11 19781 1 1 67 HIS HB3 H 8.770 0.442 -6.123 1.00 . A A . 67 HIS HB3 1 1 11 19782 1 1 67 HIS HD1 H 9.161 -2.993 -7.434 1.00 . A A . 67 HIS HD1 1 1 11 19783 1 1 67 HIS HD2 H 9.209 -1.108 -3.687 1.00 . A A . 67 HIS HD2 1 1 11 19784 1 1 67 HIS HE1 H 10.236 -4.647 -5.815 1.00 . A A . 67 HIS HE1 1 1 11 19785 1 1 67 HIS N N 6.365 0.997 -6.169 1.00 . A A . 67 HIS N 1 1 11 19786 1 1 67 HIS ND1 N 9.306 -2.814 -6.461 1.00 . A A . 67 HIS ND1 1 1 11 19787 1 1 67 HIS NE2 N 9.876 -3.038 -4.373 1.00 . A A . 67 HIS NE2 1 1 11 19788 1 1 67 HIS O O 6.107 -2.345 -5.035 1.00 . A A . 67 HIS O 1 1 11 19789 1 1 68 VAL C C 4.281 -0.931 -2.549 1.00 . A A . 68 VAL C 1 1 11 19790 1 1 68 VAL CA C 5.807 -0.969 -2.639 1.00 . A A . 68 VAL CA 1 1 11 19791 1 1 68 VAL CB C 6.492 -0.244 -1.478 1.00 . A A . 68 VAL CB 1 1 11 19792 1 1 68 VAL CG1 C 7.940 -0.711 -1.318 1.00 . A A . 68 VAL CG1 1 1 11 19793 1 1 68 VAL CG2 C 6.422 1.273 -1.662 1.00 . A A . 68 VAL CG2 1 1 11 19794 1 1 68 VAL H H 6.420 0.590 -3.877 1.00 . A A . 68 VAL H 1 1 11 19795 1 1 68 VAL HA H 6.134 -2.008 -2.627 1.00 . A A . 68 VAL HA 1 1 11 19796 1 1 68 VAL HB H 5.956 -0.495 -0.563 1.00 . A A . 68 VAL HB 1 1 11 19797 1 1 68 VAL HG11 H 7.998 -1.784 -1.498 1.00 . A A . 68 VAL HG11 1 1 11 19798 1 1 68 VAL HG12 H 8.572 -0.188 -2.036 1.00 . A A . 68 VAL HG12 1 1 11 19799 1 1 68 VAL HG13 H 8.283 -0.493 -0.307 1.00 . A A . 68 VAL HG13 1 1 11 19800 1 1 68 VAL HG21 H 5.573 1.524 -2.297 1.00 . A A . 68 VAL HG21 1 1 11 19801 1 1 68 VAL HG22 H 6.302 1.752 -0.690 1.00 . A A . 68 VAL HG22 1 1 11 19802 1 1 68 VAL HG23 H 7.342 1.626 -2.129 1.00 . A A . 68 VAL HG23 1 1 11 19803 1 1 68 VAL N N 6.229 -0.391 -3.904 1.00 . A A . 68 VAL N 1 1 11 19804 1 1 68 VAL O O 3.710 -1.204 -1.494 1.00 . A A . 68 VAL O 1 1 11 19805 1 1 69 MET C C 1.654 -1.503 -4.758 1.00 . A A . 69 MET C 1 1 11 19806 1 1 69 MET CA C 2.213 -0.514 -3.732 1.00 . A A . 69 MET CA 1 1 11 19807 1 1 69 MET CB C 1.792 0.907 -4.111 1.00 . A A . 69 MET CB 1 1 11 19808 1 1 69 MET CE C 2.894 2.644 -0.621 1.00 . A A . 69 MET CE 1 1 11 19809 1 1 69 MET CG C 2.501 1.941 -3.234 1.00 . A A . 69 MET CG 1 1 11 19810 1 1 69 MET H H 4.134 -0.371 -4.525 1.00 . A A . 69 MET H 1 1 11 19811 1 1 69 MET HA H 1.863 -0.778 -2.734 1.00 . A A . 69 MET HA 1 1 11 19812 1 1 69 MET HB2 H 2.027 1.092 -5.160 1.00 . A A . 69 MET HB2 1 1 11 19813 1 1 69 MET HB3 H 0.713 1.013 -4.003 1.00 . A A . 69 MET HB3 1 1 11 19814 1 1 69 MET HE1 H 3.608 3.287 -1.135 1.00 . A A . 69 MET HE1 1 1 11 19815 1 1 69 MET HE2 H 2.485 3.171 0.242 1.00 . A A . 69 MET HE2 1 1 11 19816 1 1 69 MET HE3 H 3.397 1.737 -0.287 1.00 . A A . 69 MET HE3 1 1 11 19817 1 1 69 MET HG2 H 3.505 1.595 -2.989 1.00 . A A . 69 MET HG2 1 1 11 19818 1 1 69 MET HG3 H 2.612 2.879 -3.780 1.00 . A A . 69 MET HG3 1 1 11 19819 1 1 69 MET N N 3.662 -0.591 -3.671 1.00 . A A . 69 MET N 1 1 11 19820 1 1 69 MET O O 0.449 -1.747 -4.797 1.00 . A A . 69 MET O 1 1 11 19821 1 1 69 MET SD S 1.569 2.214 -1.737 1.00 . A A . 69 MET SD 1 1 11 19822 1 1 70 HIS C C 3.139 -4.183 -6.577 1.00 . A A . 70 HIS C 1 1 11 19823 1 1 70 HIS CA C 2.168 -3.000 -6.585 1.00 . A A . 70 HIS CA 1 1 11 19824 1 1 70 HIS CB C 2.072 -2.323 -7.954 1.00 . A A . 70 HIS CB 1 1 11 19825 1 1 70 HIS CD2 C 0.117 -0.628 -8.328 1.00 . A A . 70 HIS CD2 1 1 11 19826 1 1 70 HIS CE1 C 1.108 1.165 -7.561 1.00 . A A . 70 HIS CE1 1 1 11 19827 1 1 70 HIS CG C 1.372 -0.985 -7.929 1.00 . A A . 70 HIS CG 1 1 11 19828 1 1 70 HIS H H 3.534 -1.840 -5.524 1.00 . A A . 70 HIS H 1 1 11 19829 1 1 70 HIS HA H 1.173 -3.356 -6.320 1.00 . A A . 70 HIS HA 1 1 11 19830 1 1 70 HIS HB2 H 3.077 -2.187 -8.352 1.00 . A A . 70 HIS HB2 1 1 11 19831 1 1 70 HIS HB3 H 1.544 -2.985 -8.639 1.00 . A A . 70 HIS HB3 1 1 11 19832 1 1 70 HIS HD1 H 2.900 0.234 -7.085 1.00 . A A . 70 HIS HD1 1 1 11 19833 1 1 70 HIS HD2 H -0.629 -1.297 -8.757 1.00 . A A . 70 HIS HD2 1 1 11 19834 1 1 70 HIS HE1 H 1.285 2.201 -7.270 1.00 . A A . 70 HIS HE1 1 1 11 19835 1 1 70 HIS N N 2.556 -2.044 -5.562 1.00 . A A . 70 HIS N 1 1 11 19836 1 1 70 HIS ND1 N 1.972 0.167 -7.451 1.00 . A A . 70 HIS ND1 1 1 11 19837 1 1 70 HIS NE2 N -0.041 0.670 -8.104 1.00 . A A . 70 HIS NE2 1 1 11 19838 1 1 70 HIS O O 2.733 -5.322 -6.349 1.00 . A A . 70 HIS O 1 1 11 19839 1 1 71 ASP C C 5.153 -5.923 -5.754 1.00 . A A . 71 ASP C 1 1 11 19840 1 1 71 ASP CA C 5.434 -4.896 -6.852 1.00 . A A . 71 ASP CA 1 1 11 19841 1 1 71 ASP CB C 6.815 -4.292 -6.592 1.00 . A A . 71 ASP CB 1 1 11 19842 1 1 71 ASP CG C 7.976 -5.010 -7.283 1.00 . A A . 71 ASP CG 1 1 11 19843 1 1 71 ASP H H 4.724 -2.944 -7.012 1.00 . A A . 71 ASP H 1 1 11 19844 1 1 71 ASP HA H 5.384 -5.329 -7.851 1.00 . A A . 71 ASP HA 1 1 11 19845 1 1 71 ASP HB2 H 6.807 -3.251 -6.917 1.00 . A A . 71 ASP HB2 1 1 11 19846 1 1 71 ASP HB3 H 6.997 -4.289 -5.517 1.00 . A A . 71 ASP HB3 1 1 11 19847 1 1 71 ASP N N 4.402 -3.873 -6.828 1.00 . A A . 71 ASP N 1 1 11 19848 1 1 71 ASP O O 4.946 -5.560 -4.597 1.00 . A A . 71 ASP O 1 1 11 19849 1 1 71 ASP OD1 O 8.254 -4.650 -8.447 1.00 . A A . 71 ASP OD1 1 1 11 19850 1 1 71 ASP OD2 O 8.559 -5.904 -6.631 1.00 . A A . 71 ASP OD2 1 1 11 19851 1 1 72 LYS C C 6.233 -8.890 -4.794 1.00 . A A . 72 LYS C 1 1 11 19852 1 1 72 LYS CA C 4.901 -8.269 -5.220 1.00 . A A . 72 LYS CA 1 1 11 19853 1 1 72 LYS CB C 3.917 -9.275 -5.818 1.00 . A A . 72 LYS CB 1 1 11 19854 1 1 72 LYS CD C 1.822 -9.564 -7.193 1.00 . A A . 72 LYS CD 1 1 11 19855 1 1 72 LYS CE C 2.245 -10.131 -8.550 1.00 . A A . 72 LYS CE 1 1 11 19856 1 1 72 LYS CG C 2.858 -8.568 -6.668 1.00 . A A . 72 LYS CG 1 1 11 19857 1 1 72 LYS H H 5.323 -7.473 -7.098 1.00 . A A . 72 LYS H 1 1 11 19858 1 1 72 LYS HA H 4.425 -7.836 -4.340 1.00 . A A . 72 LYS HA 1 1 11 19859 1 1 72 LYS HB2 H 4.456 -9.998 -6.430 1.00 . A A . 72 LYS HB2 1 1 11 19860 1 1 72 LYS HB3 H 3.431 -9.835 -5.018 1.00 . A A . 72 LYS HB3 1 1 11 19861 1 1 72 LYS HD2 H 1.699 -10.377 -6.478 1.00 . A A . 72 LYS HD2 1 1 11 19862 1 1 72 LYS HD3 H 0.854 -9.072 -7.286 1.00 . A A . 72 LYS HD3 1 1 11 19863 1 1 72 LYS HE2 H 1.436 -10.009 -9.270 1.00 . A A . 72 LYS HE2 1 1 11 19864 1 1 72 LYS HE3 H 3.099 -9.572 -8.934 1.00 . A A . 72 LYS HE3 1 1 11 19865 1 1 72 LYS HG2 H 2.362 -7.802 -6.073 1.00 . A A . 72 LYS HG2 1 1 11 19866 1 1 72 LYS HG3 H 3.338 -8.062 -7.505 1.00 . A A . 72 LYS HG3 1 1 11 19867 1 1 72 LYS HZ1 H 3.600 -11.705 -8.381 1.00 . A A . 72 LYS HZ1 1 1 11 19868 1 1 72 LYS HZ2 H 2.203 -11.980 -7.591 1.00 . A A . 72 LYS HZ2 1 1 11 19869 1 1 72 LYS N N 5.154 -7.186 -6.155 1.00 . A A . 72 LYS N 1 1 11 19870 1 1 72 LYS NZ N 2.597 -11.563 -8.427 1.00 . A A . 72 LYS NZ 1 1 11 19871 1 1 72 LYS O O 6.342 -9.444 -3.701 1.00 . A A . 72 LYS O 1 1 11 19872 1 1 73 ASN C C 9.282 -8.382 -4.463 1.00 . A A . 73 ASN C 1 1 11 19873 1 1 73 ASN CA C 8.532 -9.321 -5.409 1.00 . A A . 73 ASN CA 1 1 11 19874 1 1 73 ASN CB C 9.349 -9.449 -6.696 1.00 . A A . 73 ASN CB 1 1 11 19875 1 1 73 ASN CG C 8.596 -10.269 -7.745 1.00 . A A . 73 ASN CG 1 1 11 19876 1 1 73 ASN H H 7.115 -8.325 -6.566 1.00 . A A . 73 ASN H 1 1 11 19877 1 1 73 ASN HA H 8.352 -10.302 -4.967 1.00 . A A . 73 ASN HA 1 1 11 19878 1 1 73 ASN HB2 H 9.568 -8.457 -7.092 1.00 . A A . 73 ASN HB2 1 1 11 19879 1 1 73 ASN HB3 H 10.307 -9.922 -6.477 1.00 . A A . 73 ASN HB3 1 1 11 19880 1 1 73 ASN HD21 H 9.575 -11.916 -7.092 1.00 . A A . 73 ASN HD21 1 1 11 19881 1 1 73 ASN HD22 H 8.463 -12.182 -8.393 1.00 . A A . 73 ASN HD22 1 1 11 19882 1 1 73 ASN N N 7.212 -8.777 -5.679 1.00 . A A . 73 ASN N 1 1 11 19883 1 1 73 ASN ND2 N 8.904 -11.563 -7.743 1.00 . A A . 73 ASN ND2 1 1 11 19884 1 1 73 ASN O O 10.314 -7.820 -4.829 1.00 . A A . 73 ASN O 1 1 11 19885 1 1 73 ASN OD1 O 7.790 -9.760 -8.506 1.00 . A A . 73 ASN OD1 1 1 11 19886 1 1 74 THR C C 9.571 -8.149 -0.964 1.00 . A A . 74 THR C 1 1 11 19887 1 1 74 THR CA C 9.339 -7.377 -2.264 1.00 . A A . 74 THR CA 1 1 11 19888 1 1 74 THR CB C 8.440 -6.151 -2.091 1.00 . A A . 74 THR CB 1 1 11 19889 1 1 74 THR CG2 C 8.226 -5.392 -3.402 1.00 . A A . 74 THR CG2 1 1 11 19890 1 1 74 THR H H 7.896 -8.699 -2.975 1.00 . A A . 74 THR H 1 1 11 19891 1 1 74 THR HA H 10.318 -7.062 -2.627 1.00 . A A . 74 THR HA 1 1 11 19892 1 1 74 THR HB H 8.829 -5.489 -1.317 1.00 . A A . 74 THR HB 1 1 11 19893 1 1 74 THR HG1 H 6.671 -6.103 -1.156 1.00 . A A . 74 THR HG1 1 1 11 19894 1 1 74 THR HG21 H 9.180 -5.280 -3.917 1.00 . A A . 74 THR HG21 1 1 11 19895 1 1 74 THR HG22 H 7.534 -5.948 -4.034 1.00 . A A . 74 THR HG22 1 1 11 19896 1 1 74 THR HG23 H 7.812 -4.407 -3.188 1.00 . A A . 74 THR HG23 1 1 11 19897 1 1 74 THR N N 8.735 -8.239 -3.265 1.00 . A A . 74 THR N 1 1 11 19898 1 1 74 THR O O 8.901 -9.148 -0.703 1.00 . A A . 74 THR O 1 1 11 19899 1 1 74 THR OG1 O 7.159 -6.699 -1.794 1.00 . A A . 74 THR OG1 1 1 11 19900 1 1 75 LYS C C 9.649 -8.183 2.029 1.00 . A A . 75 LYS C 1 1 11 19901 1 1 75 LYS CA C 10.849 -8.290 1.085 1.00 . A A . 75 LYS CA 1 1 11 19902 1 1 75 LYS CB C 12.138 -7.700 1.660 1.00 . A A . 75 LYS CB 1 1 11 19903 1 1 75 LYS CD C 13.763 -7.773 3.587 1.00 . A A . 75 LYS CD 1 1 11 19904 1 1 75 LYS CE C 14.155 -8.553 4.844 1.00 . A A . 75 LYS CE 1 1 11 19905 1 1 75 LYS CG C 12.383 -8.201 3.085 1.00 . A A . 75 LYS CG 1 1 11 19906 1 1 75 LYS H H 11.060 -6.845 -0.401 1.00 . A A . 75 LYS H 1 1 11 19907 1 1 75 LYS HA H 11.038 -9.344 0.885 1.00 . A A . 75 LYS HA 1 1 11 19908 1 1 75 LYS HB2 H 12.981 -7.970 1.025 1.00 . A A . 75 LYS HB2 1 1 11 19909 1 1 75 LYS HB3 H 12.076 -6.611 1.660 1.00 . A A . 75 LYS HB3 1 1 11 19910 1 1 75 LYS HD2 H 14.505 -7.938 2.806 1.00 . A A . 75 LYS HD2 1 1 11 19911 1 1 75 LYS HD3 H 13.760 -6.705 3.803 1.00 . A A . 75 LYS HD3 1 1 11 19912 1 1 75 LYS HE2 H 15.068 -8.135 5.268 1.00 . A A . 75 LYS HE2 1 1 11 19913 1 1 75 LYS HE3 H 13.377 -8.450 5.600 1.00 . A A . 75 LYS HE3 1 1 11 19914 1 1 75 LYS HG2 H 11.613 -7.810 3.749 1.00 . A A . 75 LYS HG2 1 1 11 19915 1 1 75 LYS HG3 H 12.304 -9.288 3.110 1.00 . A A . 75 LYS HG3 1 1 11 19916 1 1 75 LYS HZ1 H 14.919 -10.453 5.226 1.00 . A A . 75 LYS HZ1 1 1 11 19917 1 1 75 LYS HZ2 H 13.481 -10.488 4.464 1.00 . A A . 75 LYS HZ2 1 1 11 19918 1 1 75 LYS N N 10.521 -7.658 -0.182 1.00 . A A . 75 LYS N 1 1 11 19919 1 1 75 LYS NZ N 14.358 -9.983 4.524 1.00 . A A . 75 LYS NZ 1 1 11 19920 1 1 75 LYS O O 9.501 -8.992 2.944 1.00 . A A . 75 LYS O 1 1 11 19921 1 1 76 PHE C C 6.366 -7.105 1.759 1.00 . A A . 76 PHE C 1 1 11 19922 1 1 76 PHE CA C 7.642 -6.957 2.590 1.00 . A A . 76 PHE CA 1 1 11 19923 1 1 76 PHE CB C 7.743 -5.516 3.095 1.00 . A A . 76 PHE CB 1 1 11 19924 1 1 76 PHE CD1 C 8.885 -5.944 5.301 1.00 . A A . 76 PHE CD1 1 1 11 19925 1 1 76 PHE CD2 C 9.906 -4.413 3.775 1.00 . A A . 76 PHE CD2 1 1 11 19926 1 1 76 PHE CE1 C 9.958 -5.726 6.237 1.00 . A A . 76 PHE CE1 1 1 11 19927 1 1 76 PHE CE2 C 10.978 -4.195 4.711 1.00 . A A . 76 PHE CE2 1 1 11 19928 1 1 76 PHE CG C 8.882 -5.284 4.089 1.00 . A A . 76 PHE CG 1 1 11 19929 1 1 76 PHE CZ C 10.951 -4.862 5.896 1.00 . A A . 76 PHE CZ 1 1 11 19930 1 1 76 PHE H H 8.951 -6.526 1.028 1.00 . A A . 76 PHE H 1 1 11 19931 1 1 76 PHE HA H 7.637 -7.702 3.385 1.00 . A A . 76 PHE HA 1 1 11 19932 1 1 76 PHE HB2 H 7.879 -4.851 2.241 1.00 . A A . 76 PHE HB2 1 1 11 19933 1 1 76 PHE HB3 H 6.800 -5.240 3.567 1.00 . A A . 76 PHE HB3 1 1 11 19934 1 1 76 PHE HD1 H 8.077 -6.632 5.549 1.00 . A A . 76 PHE HD1 1 1 11 19935 1 1 76 PHE HD2 H 9.903 -3.891 2.818 1.00 . A A . 76 PHE HD2 1 1 11 19936 1 1 76 PHE HE1 H 9.973 -6.241 7.198 1.00 . A A . 76 PHE HE1 1 1 11 19937 1 1 76 PHE HE2 H 11.793 -3.510 4.476 1.00 . A A . 76 PHE HE2 1 1 11 19938 1 1 76 PHE HZ H 11.747 -4.777 6.679 1.00 . A A . 76 PHE HZ 1 1 11 19939 1 1 76 PHE N N 8.823 -7.179 1.774 1.00 . A A . 76 PHE N 1 1 11 19940 1 1 76 PHE O O 6.401 -6.989 0.535 1.00 . A A . 76 PHE O 1 1 11 19941 1 1 77 LYS C C 3.564 -6.194 1.169 1.00 . A A . 77 LYS C 1 1 11 19942 1 1 77 LYS CA C 3.984 -7.524 1.799 1.00 . A A . 77 LYS CA 1 1 11 19943 1 1 77 LYS CB C 2.953 -8.096 2.774 1.00 . A A . 77 LYS CB 1 1 11 19944 1 1 77 LYS CD C 1.956 -10.210 3.720 1.00 . A A . 77 LYS CD 1 1 11 19945 1 1 77 LYS CE C 1.326 -11.401 2.994 1.00 . A A . 77 LYS CE 1 1 11 19946 1 1 77 LYS CG C 3.103 -9.613 2.902 1.00 . A A . 77 LYS CG 1 1 11 19947 1 1 77 LYS H H 5.249 -7.450 3.453 1.00 . A A . 77 LYS H 1 1 11 19948 1 1 77 LYS HA H 4.117 -8.256 1.003 1.00 . A A . 77 LYS HA 1 1 11 19949 1 1 77 LYS HB2 H 3.073 -7.631 3.752 1.00 . A A . 77 LYS HB2 1 1 11 19950 1 1 77 LYS HB3 H 1.947 -7.854 2.428 1.00 . A A . 77 LYS HB3 1 1 11 19951 1 1 77 LYS HD2 H 2.326 -10.529 4.695 1.00 . A A . 77 LYS HD2 1 1 11 19952 1 1 77 LYS HD3 H 1.198 -9.448 3.901 1.00 . A A . 77 LYS HD3 1 1 11 19953 1 1 77 LYS HE2 H 0.447 -11.744 3.540 1.00 . A A . 77 LYS HE2 1 1 11 19954 1 1 77 LYS HE3 H 0.987 -11.093 2.005 1.00 . A A . 77 LYS HE3 1 1 11 19955 1 1 77 LYS HG2 H 3.121 -10.066 1.911 1.00 . A A . 77 LYS HG2 1 1 11 19956 1 1 77 LYS HG3 H 4.055 -9.849 3.378 1.00 . A A . 77 LYS HG3 1 1 11 19957 1 1 77 LYS HZ1 H 2.605 -12.851 3.772 1.00 . A A . 77 LYS HZ1 1 1 11 19958 1 1 77 LYS HZ2 H 1.916 -13.298 2.366 1.00 . A A . 77 LYS HZ2 1 1 11 19959 1 1 77 LYS N N 5.269 -7.358 2.457 1.00 . A A . 77 LYS N 1 1 11 19960 1 1 77 LYS NZ N 2.302 -12.506 2.868 1.00 . A A . 77 LYS NZ 1 1 11 19961 1 1 77 LYS O O 3.486 -5.175 1.854 1.00 . A A . 77 LYS O 1 1 11 19962 1 1 78 SER C C 1.367 -5.018 -0.975 1.00 . A A . 78 SER C 1 1 11 19963 1 1 78 SER CA C 2.892 -5.060 -0.859 1.00 . A A . 78 SER CA 1 1 11 19964 1 1 78 SER CB C 3.532 -5.019 -2.248 1.00 . A A . 78 SER CB 1 1 11 19965 1 1 78 SER H H 3.368 -7.080 -0.678 1.00 . A A . 78 SER H 1 1 11 19966 1 1 78 SER HA H 3.254 -4.218 -0.268 1.00 . A A . 78 SER HA 1 1 11 19967 1 1 78 SER HB2 H 3.557 -3.989 -2.605 1.00 . A A . 78 SER HB2 1 1 11 19968 1 1 78 SER HB3 H 4.566 -5.358 -2.181 1.00 . A A . 78 SER HB3 1 1 11 19969 1 1 78 SER HG H 3.415 -6.038 -3.966 1.00 . A A . 78 SER HG 1 1 11 19970 1 1 78 SER N N 3.303 -6.247 -0.129 1.00 . A A . 78 SER N 1 1 11 19971 1 1 78 SER O O 0.705 -6.049 -0.872 1.00 . A A . 78 SER O 1 1 11 19972 1 1 78 SER OG O 2.827 -5.829 -3.184 1.00 . A A . 78 SER OG 1 1 11 19973 1 1 79 CYS C C -1.132 -4.741 -2.210 1.00 . A A . 79 CYS C 1 1 11 19974 1 1 79 CYS CA C -0.580 -3.625 -1.320 1.00 . A A . 79 CYS CA 1 1 11 19975 1 1 79 CYS CB C -0.919 -2.237 -1.868 1.00 . A A . 79 CYS CB 1 1 11 19976 1 1 79 CYS H H 1.401 -2.981 -1.272 1.00 . A A . 79 CYS H 1 1 11 19977 1 1 79 CYS HA H -0.997 -3.689 -0.315 1.00 . A A . 79 CYS HA 1 1 11 19978 1 1 79 CYS HB2 H -0.578 -2.177 -2.901 1.00 . A A . 79 CYS HB2 1 1 11 19979 1 1 79 CYS HB3 H -2.003 -2.123 -1.883 1.00 . A A . 79 CYS HB3 1 1 11 19980 1 1 79 CYS N N 0.855 -3.815 -1.189 1.00 . A A . 79 CYS N 1 1 11 19981 1 1 79 CYS O O -1.883 -5.597 -1.744 1.00 . A A . 79 CYS O 1 1 11 19982 1 1 79 CYS SG S -0.195 -0.844 -0.929 1.00 . A A . 79 CYS SG 1 1 11 19983 1 1 80 VAL C C -0.656 -7.064 -4.020 1.00 . A A . 80 VAL C 1 1 11 19984 1 1 80 VAL CA C -1.187 -5.690 -4.434 1.00 . A A . 80 VAL CA 1 1 11 19985 1 1 80 VAL CB C -0.761 -5.285 -5.846 1.00 . A A . 80 VAL CB 1 1 11 19986 1 1 80 VAL CG1 C -1.134 -6.365 -6.863 1.00 . A A . 80 VAL CG1 1 1 11 19987 1 1 80 VAL CG2 C -1.364 -3.934 -6.234 1.00 . A A . 80 VAL CG2 1 1 11 19988 1 1 80 VAL H H -0.129 -3.995 -3.845 1.00 . A A . 80 VAL H 1 1 11 19989 1 1 80 VAL HA H -2.276 -5.711 -4.403 1.00 . A A . 80 VAL HA 1 1 11 19990 1 1 80 VAL HB H 0.324 -5.181 -5.852 1.00 . A A . 80 VAL HB 1 1 11 19991 1 1 80 VAL HG11 H -1.711 -7.147 -6.367 1.00 . A A . 80 VAL HG11 1 1 11 19992 1 1 80 VAL HG12 H -1.732 -5.923 -7.660 1.00 . A A . 80 VAL HG12 1 1 11 19993 1 1 80 VAL HG13 H -0.227 -6.796 -7.285 1.00 . A A . 80 VAL HG13 1 1 11 19994 1 1 80 VAL HG21 H -1.466 -3.312 -5.345 1.00 . A A . 80 VAL HG21 1 1 11 19995 1 1 80 VAL HG22 H -0.712 -3.437 -6.953 1.00 . A A . 80 VAL HG22 1 1 11 19996 1 1 80 VAL HG23 H -2.346 -4.090 -6.682 1.00 . A A . 80 VAL HG23 1 1 11 19997 1 1 80 VAL N N -0.740 -4.694 -3.474 1.00 . A A . 80 VAL N 1 1 11 19998 1 1 80 VAL O O -1.359 -8.067 -4.142 1.00 . A A . 80 VAL O 1 1 11 19999 1 1 81 GLY C C 0.297 -9.085 -2.165 1.00 . A A . 81 GLY C 1 1 11 20000 1 1 81 GLY CA C 1.211 -8.301 -3.108 1.00 . A A . 81 GLY CA 1 1 11 20001 1 1 81 GLY H H 1.143 -6.247 -3.444 1.00 . A A . 81 GLY H 1 1 11 20002 1 1 81 GLY HA2 H 1.453 -8.913 -3.977 1.00 . A A . 81 GLY HA2 1 1 11 20003 1 1 81 GLY HA3 H 2.151 -8.076 -2.605 1.00 . A A . 81 GLY HA3 1 1 11 20004 1 1 81 GLY N N 0.578 -7.067 -3.540 1.00 . A A . 81 GLY N 1 1 11 20005 1 1 81 GLY O O -0.057 -10.230 -2.445 1.00 . A A . 81 GLY O 1 1 11 20006 1 1 82 CYS C C -2.282 -9.332 -0.732 1.00 . A A . 82 CYS C 1 1 11 20007 1 1 82 CYS CA C -0.926 -9.061 -0.078 1.00 . A A . 82 CYS CA 1 1 11 20008 1 1 82 CYS CB C -1.061 -8.200 1.180 1.00 . A A . 82 CYS CB 1 1 11 20009 1 1 82 CYS H H 0.232 -7.508 -0.844 1.00 . A A . 82 CYS H 1 1 11 20010 1 1 82 CYS HA H -0.445 -9.993 0.217 1.00 . A A . 82 CYS HA 1 1 11 20011 1 1 82 CYS HB2 H -0.073 -7.970 1.581 1.00 . A A . 82 CYS HB2 1 1 11 20012 1 1 82 CYS HB3 H -1.532 -7.249 0.931 1.00 . A A . 82 CYS HB3 1 1 11 20013 1 1 82 CYS N N -0.060 -8.438 -1.065 1.00 . A A . 82 CYS N 1 1 11 20014 1 1 82 CYS O O -2.844 -10.415 -0.577 1.00 . A A . 82 CYS O 1 1 11 20015 1 1 82 CYS SG S -2.056 -9.080 2.437 1.00 . A A . 82 CYS SG 1 1 11 20016 1 1 83 HIS C C -4.058 -9.709 -2.991 1.00 . A A . 83 HIS C 1 1 11 20017 1 1 83 HIS CA C -4.049 -8.446 -2.126 1.00 . A A . 83 HIS CA 1 1 11 20018 1 1 83 HIS CB C -4.358 -7.179 -2.925 1.00 . A A . 83 HIS CB 1 1 11 20019 1 1 83 HIS CD2 C -4.731 -5.749 -0.768 1.00 . A A . 83 HIS CD2 1 1 11 20020 1 1 83 HIS CE1 C -6.025 -4.212 -1.633 1.00 . A A . 83 HIS CE1 1 1 11 20021 1 1 83 HIS CG C -4.900 -6.043 -2.090 1.00 . A A . 83 HIS CG 1 1 11 20022 1 1 83 HIS H H -2.305 -7.452 -1.570 1.00 . A A . 83 HIS H 1 1 11 20023 1 1 83 HIS HA H -4.807 -8.543 -1.349 1.00 . A A . 83 HIS HA 1 1 11 20024 1 1 83 HIS HB2 H -3.449 -6.846 -3.426 1.00 . A A . 83 HIS HB2 1 1 11 20025 1 1 83 HIS HB3 H -5.081 -7.420 -3.704 1.00 . A A . 83 HIS HB3 1 1 11 20026 1 1 83 HIS HD1 H -6.032 -4.993 -3.556 1.00 . A A . 83 HIS HD1 1 1 11 20027 1 1 83 HIS HD2 H -4.138 -6.326 -0.058 1.00 . A A . 83 HIS HD2 1 1 11 20028 1 1 83 HIS HE1 H -6.657 -3.328 -1.726 1.00 . A A . 83 HIS HE1 1 1 11 20029 1 1 83 HIS N N -2.769 -8.330 -1.449 1.00 . A A . 83 HIS N 1 1 11 20030 1 1 83 HIS ND1 N -5.721 -5.057 -2.607 1.00 . A A . 83 HIS ND1 1 1 11 20031 1 1 83 HIS NE2 N -5.410 -4.642 -0.495 1.00 . A A . 83 HIS NE2 1 1 11 20032 1 1 83 HIS O O -5.041 -10.449 -3.003 1.00 . A A . 83 HIS O 1 1 11 20033 1 1 84 VAL C C -3.041 -12.347 -3.736 1.00 . A A . 84 VAL C 1 1 11 20034 1 1 84 VAL CA C -2.823 -11.075 -4.558 1.00 . A A . 84 VAL CA 1 1 11 20035 1 1 84 VAL CB C -1.468 -11.047 -5.269 1.00 . A A . 84 VAL CB 1 1 11 20036 1 1 84 VAL CG1 C -1.285 -12.287 -6.147 1.00 . A A . 84 VAL CG1 1 1 11 20037 1 1 84 VAL CG2 C -1.305 -9.766 -6.088 1.00 . A A . 84 VAL CG2 1 1 11 20038 1 1 84 VAL H H -2.159 -9.308 -3.677 1.00 . A A . 84 VAL H 1 1 11 20039 1 1 84 VAL HA H -3.603 -11.009 -5.316 1.00 . A A . 84 VAL HA 1 1 11 20040 1 1 84 VAL HB H -0.690 -11.059 -4.506 1.00 . A A . 84 VAL HB 1 1 11 20041 1 1 84 VAL HG11 H -1.758 -13.144 -5.669 1.00 . A A . 84 VAL HG11 1 1 11 20042 1 1 84 VAL HG12 H -1.743 -12.114 -7.120 1.00 . A A . 84 VAL HG12 1 1 11 20043 1 1 84 VAL HG13 H -0.221 -12.485 -6.277 1.00 . A A . 84 VAL HG13 1 1 11 20044 1 1 84 VAL HG21 H -2.181 -9.131 -5.948 1.00 . A A . 84 VAL HG21 1 1 11 20045 1 1 84 VAL HG22 H -0.414 -9.233 -5.757 1.00 . A A . 84 VAL HG22 1 1 11 20046 1 1 84 VAL HG23 H -1.206 -10.019 -7.144 1.00 . A A . 84 VAL HG23 1 1 11 20047 1 1 84 VAL N N -2.954 -9.915 -3.693 1.00 . A A . 84 VAL N 1 1 11 20048 1 1 84 VAL O O -3.640 -13.307 -4.218 1.00 . A A . 84 VAL O 1 1 11 20049 1 1 85 GLU C C -4.107 -13.548 -1.088 1.00 . A A . 85 GLU C 1 1 11 20050 1 1 85 GLU CA C -2.674 -13.450 -1.615 1.00 . A A . 85 GLU CA 1 1 11 20051 1 1 85 GLU CB C -1.671 -13.363 -0.463 1.00 . A A . 85 GLU CB 1 1 11 20052 1 1 85 GLU CD C -0.310 -15.333 0.329 1.00 . A A . 85 GLU CD 1 1 11 20053 1 1 85 GLU CG C -0.447 -14.240 -0.734 1.00 . A A . 85 GLU CG 1 1 11 20054 1 1 85 GLU H H -2.056 -11.528 -2.125 1.00 . A A . 85 GLU H 1 1 11 20055 1 1 85 GLU HA H -2.444 -14.325 -2.224 1.00 . A A . 85 GLU HA 1 1 11 20056 1 1 85 GLU HB2 H -1.357 -12.328 -0.327 1.00 . A A . 85 GLU HB2 1 1 11 20057 1 1 85 GLU HB3 H -2.149 -13.675 0.465 1.00 . A A . 85 GLU HB3 1 1 11 20058 1 1 85 GLU HG2 H -0.533 -14.696 -1.720 1.00 . A A . 85 GLU HG2 1 1 11 20059 1 1 85 GLU HG3 H 0.452 -13.624 -0.745 1.00 . A A . 85 GLU HG3 1 1 11 20060 1 1 85 GLU N N -2.542 -12.312 -2.509 1.00 . A A . 85 GLU N 1 1 11 20061 1 1 85 GLU O O -4.620 -14.645 -0.872 1.00 . A A . 85 GLU O 1 1 11 20062 1 1 85 GLU OE1 O -1.292 -16.090 0.494 1.00 . A A . 85 GLU OE1 1 1 11 20063 1 1 85 GLU OE2 O 0.772 -15.387 0.951 1.00 . A A . 85 GLU OE2 1 1 11 20064 1 1 86 VAL C C -7.043 -12.710 -1.521 1.00 . A A . 86 VAL C 1 1 11 20065 1 1 86 VAL CA C -6.077 -12.326 -0.398 1.00 . A A . 86 VAL CA 1 1 11 20066 1 1 86 VAL CB C -6.360 -10.941 0.187 1.00 . A A . 86 VAL CB 1 1 11 20067 1 1 86 VAL CG1 C -7.794 -10.850 0.712 1.00 . A A . 86 VAL CG1 1 1 11 20068 1 1 86 VAL CG2 C -5.352 -10.592 1.284 1.00 . A A . 86 VAL CG2 1 1 11 20069 1 1 86 VAL H H -4.290 -11.498 -1.075 1.00 . A A . 86 VAL H 1 1 11 20070 1 1 86 VAL HA H -6.166 -13.056 0.406 1.00 . A A . 86 VAL HA 1 1 11 20071 1 1 86 VAL HB H -6.250 -10.210 -0.614 1.00 . A A . 86 VAL HB 1 1 11 20072 1 1 86 VAL HG11 H -8.348 -11.740 0.413 1.00 . A A . 86 VAL HG11 1 1 11 20073 1 1 86 VAL HG12 H -7.780 -10.781 1.800 1.00 . A A . 86 VAL HG12 1 1 11 20074 1 1 86 VAL HG13 H -8.278 -9.965 0.298 1.00 . A A . 86 VAL HG13 1 1 11 20075 1 1 86 VAL HG21 H -4.359 -10.926 0.983 1.00 . A A . 86 VAL HG21 1 1 11 20076 1 1 86 VAL HG22 H -5.341 -9.513 1.437 1.00 . A A . 86 VAL HG22 1 1 11 20077 1 1 86 VAL HG23 H -5.637 -11.088 2.211 1.00 . A A . 86 VAL HG23 1 1 11 20078 1 1 86 VAL N N -4.713 -12.385 -0.896 1.00 . A A . 86 VAL N 1 1 11 20079 1 1 86 VAL O O -7.847 -13.627 -1.366 1.00 . A A . 86 VAL O 1 1 11 20080 1 1 87 ALA C C -7.475 -13.628 -4.339 1.00 . A A . 87 ALA C 1 1 11 20081 1 1 87 ALA CA C -7.785 -12.241 -3.774 1.00 . A A . 87 ALA CA 1 1 11 20082 1 1 87 ALA CB C -7.590 -11.132 -4.810 1.00 . A A . 87 ALA CB 1 1 11 20083 1 1 87 ALA H H -6.274 -11.243 -2.744 1.00 . A A . 87 ALA H 1 1 11 20084 1 1 87 ALA HA H -8.819 -12.221 -3.430 1.00 . A A . 87 ALA HA 1 1 11 20085 1 1 87 ALA HB1 H -6.998 -10.327 -4.374 1.00 . A A . 87 ALA HB1 1 1 11 20086 1 1 87 ALA HB2 H -7.070 -11.534 -5.680 1.00 . A A . 87 ALA HB2 1 1 11 20087 1 1 87 ALA HB3 H -8.562 -10.744 -5.115 1.00 . A A . 87 ALA HB3 1 1 11 20088 1 1 87 ALA N N -6.931 -11.988 -2.626 1.00 . A A . 87 ALA N 1 1 11 20089 1 1 87 ALA O O -8.382 -14.362 -4.726 1.00 . A A . 87 ALA O 1 1 11 20090 1 1 88 GLY C C -6.554 -15.637 -6.116 1.00 . A A . 88 GLY C 1 1 11 20091 1 1 88 GLY CA C -5.747 -15.231 -4.881 1.00 . A A . 88 GLY CA 1 1 11 20092 1 1 88 GLY H H -5.456 -13.342 -4.053 1.00 . A A . 88 GLY H 1 1 11 20093 1 1 88 GLY HA2 H -4.688 -15.182 -5.135 1.00 . A A . 88 GLY HA2 1 1 11 20094 1 1 88 GLY HA3 H -5.854 -15.991 -4.107 1.00 . A A . 88 GLY HA3 1 1 11 20095 1 1 88 GLY N N -6.188 -13.945 -4.370 1.00 . A A . 88 GLY N 1 1 11 20096 1 1 88 GLY O O -6.780 -14.821 -7.010 1.00 . A A . 88 GLY O 1 1 11 20097 1 1 89 ALA C C -9.228 -17.405 -6.868 1.00 . A A . 89 ALA C 1 1 11 20098 1 1 89 ALA CA C -7.743 -17.419 -7.238 1.00 . A A . 89 ALA CA 1 1 11 20099 1 1 89 ALA CB C -7.244 -18.820 -7.595 1.00 . A A . 89 ALA CB 1 1 11 20100 1 1 89 ALA H H -6.779 -17.552 -5.397 1.00 . A A . 89 ALA H 1 1 11 20101 1 1 89 ALA HA H -7.584 -16.761 -8.093 1.00 . A A . 89 ALA HA 1 1 11 20102 1 1 89 ALA HB1 H -6.166 -18.792 -7.756 1.00 . A A . 89 ALA HB1 1 1 11 20103 1 1 89 ALA HB2 H -7.472 -19.506 -6.779 1.00 . A A . 89 ALA HB2 1 1 11 20104 1 1 89 ALA HB3 H -7.738 -19.161 -8.505 1.00 . A A . 89 ALA HB3 1 1 11 20105 1 1 89 ALA N N -6.966 -16.896 -6.127 1.00 . A A . 89 ALA N 1 1 11 20106 1 1 89 ALA O O -9.883 -18.446 -6.878 1.00 . A A . 89 ALA O 1 1 11 20107 1 1 90 ASP C C -11.849 -15.312 -7.295 1.00 . A A . 90 ASP C 1 1 11 20108 1 1 90 ASP CA C -11.109 -16.052 -6.178 1.00 . A A . 90 ASP CA 1 1 11 20109 1 1 90 ASP CB C -11.244 -15.228 -4.896 1.00 . A A . 90 ASP CB 1 1 11 20110 1 1 90 ASP CG C -12.426 -15.612 -4.002 1.00 . A A . 90 ASP CG 1 1 11 20111 1 1 90 ASP H H -9.175 -15.373 -6.546 1.00 . A A . 90 ASP H 1 1 11 20112 1 1 90 ASP HA H -11.486 -17.064 -6.028 1.00 . A A . 90 ASP HA 1 1 11 20113 1 1 90 ASP HB2 H -10.325 -15.328 -4.319 1.00 . A A . 90 ASP HB2 1 1 11 20114 1 1 90 ASP HB3 H -11.339 -14.177 -5.165 1.00 . A A . 90 ASP HB3 1 1 11 20115 1 1 90 ASP N N -9.715 -16.215 -6.551 1.00 . A A . 90 ASP N 1 1 11 20116 1 1 90 ASP O O -13.075 -15.363 -7.372 1.00 . A A . 90 ASP O 1 1 11 20117 1 1 90 ASP OD1 O -13.413 -16.138 -4.561 1.00 . A A . 90 ASP OD1 1 1 11 20118 1 1 90 ASP OD2 O -12.315 -15.370 -2.780 1.00 . A A . 90 ASP OD2 1 1 11 20119 1 1 91 ALA C C -12.579 -12.816 -8.696 1.00 . A A . 91 ALA C 1 1 11 20120 1 1 91 ALA CA C -11.637 -13.892 -9.241 1.00 . A A . 91 ALA CA 1 1 11 20121 1 1 91 ALA CB C -12.341 -14.852 -10.200 1.00 . A A . 91 ALA CB 1 1 11 20122 1 1 91 ALA H H -10.074 -14.605 -8.062 1.00 . A A . 91 ALA H 1 1 11 20123 1 1 91 ALA HA H -10.814 -13.408 -9.768 1.00 . A A . 91 ALA HA 1 1 11 20124 1 1 91 ALA HB1 H -12.064 -15.878 -9.956 1.00 . A A . 91 ALA HB1 1 1 11 20125 1 1 91 ALA HB2 H -13.421 -14.735 -10.105 1.00 . A A . 91 ALA HB2 1 1 11 20126 1 1 91 ALA HB3 H -12.040 -14.629 -11.224 1.00 . A A . 91 ALA HB3 1 1 11 20127 1 1 91 ALA N N -11.071 -14.641 -8.132 1.00 . A A . 91 ALA N 1 1 11 20128 1 1 91 ALA O O -13.174 -12.988 -7.633 1.00 . A A . 91 ALA O 1 1 11 20129 1 1 92 ALA C C -12.808 -9.749 -8.043 1.00 . A A . 92 ALA C 1 1 11 20130 1 1 92 ALA CA C -13.546 -10.628 -9.054 1.00 . A A . 92 ALA CA 1 1 11 20131 1 1 92 ALA CB C -14.861 -11.179 -8.498 1.00 . A A . 92 ALA CB 1 1 11 20132 1 1 92 ALA H H -12.199 -11.600 -10.312 1.00 . A A . 92 ALA H 1 1 11 20133 1 1 92 ALA HA H -13.761 -10.040 -9.946 1.00 . A A . 92 ALA HA 1 1 11 20134 1 1 92 ALA HB1 H -15.065 -12.152 -8.945 1.00 . A A . 92 ALA HB1 1 1 11 20135 1 1 92 ALA HB2 H -14.781 -11.286 -7.416 1.00 . A A . 92 ALA HB2 1 1 11 20136 1 1 92 ALA HB3 H -15.672 -10.492 -8.736 1.00 . A A . 92 ALA HB3 1 1 11 20137 1 1 92 ALA N N -12.686 -11.731 -9.448 1.00 . A A . 92 ALA N 1 1 11 20138 1 1 92 ALA O O -12.719 -8.535 -8.219 1.00 . A A . 92 ALA O 1 1 11 20139 1 1 93 LYS C C -10.255 -9.160 -6.538 1.00 . A A . 93 LYS C 1 1 11 20140 1 1 93 LYS CA C -11.572 -9.688 -5.965 1.00 . A A . 93 LYS CA 1 1 11 20141 1 1 93 LYS CB C -11.394 -10.578 -4.734 1.00 . A A . 93 LYS CB 1 1 11 20142 1 1 93 LYS CD C -12.533 -11.444 -2.657 1.00 . A A . 93 LYS CD 1 1 11 20143 1 1 93 LYS CE C -13.849 -11.984 -2.095 1.00 . A A . 93 LYS CE 1 1 11 20144 1 1 93 LYS CG C -12.736 -10.840 -4.048 1.00 . A A . 93 LYS CG 1 1 11 20145 1 1 93 LYS H H -12.375 -11.384 -6.869 1.00 . A A . 93 LYS H 1 1 11 20146 1 1 93 LYS HA H -12.182 -8.837 -5.661 1.00 . A A . 93 LYS HA 1 1 11 20147 1 1 93 LYS HB2 H -10.941 -11.525 -5.027 1.00 . A A . 93 LYS HB2 1 1 11 20148 1 1 93 LYS HB3 H -10.709 -10.102 -4.032 1.00 . A A . 93 LYS HB3 1 1 11 20149 1 1 93 LYS HD2 H -11.798 -12.248 -2.709 1.00 . A A . 93 LYS HD2 1 1 11 20150 1 1 93 LYS HD3 H -12.129 -10.687 -1.984 1.00 . A A . 93 LYS HD3 1 1 11 20151 1 1 93 LYS HE2 H -14.293 -11.250 -1.422 1.00 . A A . 93 LYS HE2 1 1 11 20152 1 1 93 LYS HE3 H -14.559 -12.143 -2.907 1.00 . A A . 93 LYS HE3 1 1 11 20153 1 1 93 LYS HG2 H -13.295 -9.908 -3.966 1.00 . A A . 93 LYS HG2 1 1 11 20154 1 1 93 LYS HG3 H -13.334 -11.517 -4.658 1.00 . A A . 93 LYS HG3 1 1 11 20155 1 1 93 LYS HZ1 H -12.752 -13.245 -0.851 1.00 . A A . 93 LYS HZ1 1 1 11 20156 1 1 93 LYS HZ2 H -14.360 -13.450 -0.705 1.00 . A A . 93 LYS HZ2 1 1 11 20157 1 1 93 LYS N N -12.299 -10.396 -7.005 1.00 . A A . 93 LYS N 1 1 11 20158 1 1 93 LYS NZ N -13.622 -13.255 -1.372 1.00 . A A . 93 LYS NZ 1 1 11 20159 1 1 93 LYS O O -9.859 -8.030 -6.255 1.00 . A A . 93 LYS O 1 1 11 20160 1 1 94 LYS C C -8.574 -8.470 -8.911 1.00 . A A . 94 LYS C 1 1 11 20161 1 1 94 LYS CA C -8.348 -9.637 -7.948 1.00 . A A . 94 LYS CA 1 1 11 20162 1 1 94 LYS CB C -7.696 -10.856 -8.601 1.00 . A A . 94 LYS CB 1 1 11 20163 1 1 94 LYS CD C -7.840 -12.451 -10.550 1.00 . A A . 94 LYS CD 1 1 11 20164 1 1 94 LYS CE C -7.085 -12.335 -11.876 1.00 . A A . 94 LYS CE 1 1 11 20165 1 1 94 LYS CG C -8.231 -11.070 -10.019 1.00 . A A . 94 LYS CG 1 1 11 20166 1 1 94 LYS H H -9.942 -10.920 -7.558 1.00 . A A . 94 LYS H 1 1 11 20167 1 1 94 LYS HA H -7.682 -9.303 -7.152 1.00 . A A . 94 LYS HA 1 1 11 20168 1 1 94 LYS HB2 H -6.615 -10.723 -8.633 1.00 . A A . 94 LYS HB2 1 1 11 20169 1 1 94 LYS HB3 H -7.890 -11.744 -7.998 1.00 . A A . 94 LYS HB3 1 1 11 20170 1 1 94 LYS HD2 H -7.218 -12.964 -9.817 1.00 . A A . 94 LYS HD2 1 1 11 20171 1 1 94 LYS HD3 H -8.735 -13.057 -10.689 1.00 . A A . 94 LYS HD3 1 1 11 20172 1 1 94 LYS HE2 H -6.250 -11.644 -11.766 1.00 . A A . 94 LYS HE2 1 1 11 20173 1 1 94 LYS HE3 H -6.665 -13.303 -12.148 1.00 . A A . 94 LYS HE3 1 1 11 20174 1 1 94 LYS HG2 H -9.316 -10.969 -10.021 1.00 . A A . 94 LYS HG2 1 1 11 20175 1 1 94 LYS HG3 H -7.838 -10.297 -10.680 1.00 . A A . 94 LYS HG3 1 1 11 20176 1 1 94 LYS HZ1 H -8.384 -12.631 -13.479 1.00 . A A . 94 LYS HZ1 1 1 11 20177 1 1 94 LYS HZ2 H -8.771 -11.330 -12.579 1.00 . A A . 94 LYS HZ2 1 1 11 20178 1 1 94 LYS N N -9.613 -10.003 -7.333 1.00 . A A . 94 LYS N 1 1 11 20179 1 1 94 LYS NZ N -7.990 -11.862 -12.948 1.00 . A A . 94 LYS NZ 1 1 11 20180 1 1 94 LYS O O -7.618 -7.863 -9.393 1.00 . A A . 94 LYS O 1 1 11 20181 1 1 95 LYS C C -10.560 -5.866 -9.240 1.00 . A A . 95 LYS C 1 1 11 20182 1 1 95 LYS CA C -10.208 -7.107 -10.062 1.00 . A A . 95 LYS CA 1 1 11 20183 1 1 95 LYS CB C -11.321 -7.551 -11.013 1.00 . A A . 95 LYS CB 1 1 11 20184 1 1 95 LYS CD C -11.699 -8.158 -13.432 1.00 . A A . 95 LYS CD 1 1 11 20185 1 1 95 LYS CE C -10.743 -9.187 -14.037 1.00 . A A . 95 LYS CE 1 1 11 20186 1 1 95 LYS CG C -10.963 -7.228 -12.465 1.00 . A A . 95 LYS CG 1 1 11 20187 1 1 95 LYS H H -10.616 -8.688 -8.768 1.00 . A A . 95 LYS H 1 1 11 20188 1 1 95 LYS HA H -9.334 -6.881 -10.672 1.00 . A A . 95 LYS HA 1 1 11 20189 1 1 95 LYS HB2 H -11.491 -8.622 -10.906 1.00 . A A . 95 LYS HB2 1 1 11 20190 1 1 95 LYS HB3 H -12.253 -7.053 -10.745 1.00 . A A . 95 LYS HB3 1 1 11 20191 1 1 95 LYS HD2 H -12.505 -8.670 -12.906 1.00 . A A . 95 LYS HD2 1 1 11 20192 1 1 95 LYS HD3 H -12.159 -7.571 -14.227 1.00 . A A . 95 LYS HD3 1 1 11 20193 1 1 95 LYS HE2 H -9.911 -8.677 -14.524 1.00 . A A . 95 LYS HE2 1 1 11 20194 1 1 95 LYS HE3 H -10.318 -9.807 -13.248 1.00 . A A . 95 LYS HE3 1 1 11 20195 1 1 95 LYS HG2 H -11.220 -6.192 -12.685 1.00 . A A . 95 LYS HG2 1 1 11 20196 1 1 95 LYS HG3 H -9.887 -7.326 -12.608 1.00 . A A . 95 LYS HG3 1 1 11 20197 1 1 95 LYS HZ1 H -12.085 -9.502 -15.600 1.00 . A A . 95 LYS HZ1 1 1 11 20198 1 1 95 LYS HZ2 H -10.809 -10.513 -15.643 1.00 . A A . 95 LYS HZ2 1 1 11 20199 1 1 95 LYS N N -9.844 -8.190 -9.164 1.00 . A A . 95 LYS N 1 1 11 20200 1 1 95 LYS NZ N -11.452 -10.039 -15.018 1.00 . A A . 95 LYS NZ 1 1 11 20201 1 1 95 LYS O O -10.645 -4.764 -9.780 1.00 . A A . 95 LYS O 1 1 11 20202 1 1 96 ASP C C -10.057 -4.927 -5.925 1.00 . A A . 96 ASP C 1 1 11 20203 1 1 96 ASP CA C -11.095 -4.998 -7.047 1.00 . A A . 96 ASP CA 1 1 11 20204 1 1 96 ASP CB C -12.467 -5.222 -6.408 1.00 . A A . 96 ASP CB 1 1 11 20205 1 1 96 ASP CG C -13.547 -4.224 -6.829 1.00 . A A . 96 ASP CG 1 1 11 20206 1 1 96 ASP H H -10.682 -6.985 -7.517 1.00 . A A . 96 ASP H 1 1 11 20207 1 1 96 ASP HA H -11.100 -4.103 -7.667 1.00 . A A . 96 ASP HA 1 1 11 20208 1 1 96 ASP HB2 H -12.807 -6.228 -6.655 1.00 . A A . 96 ASP HB2 1 1 11 20209 1 1 96 ASP HB3 H -12.358 -5.181 -5.324 1.00 . A A . 96 ASP HB3 1 1 11 20210 1 1 96 ASP N N -10.754 -6.086 -7.948 1.00 . A A . 96 ASP N 1 1 11 20211 1 1 96 ASP O O -10.200 -4.140 -4.990 1.00 . A A . 96 ASP O 1 1 11 20212 1 1 96 ASP OD1 O -13.159 -3.136 -7.307 1.00 . A A . 96 ASP OD1 1 1 11 20213 1 1 96 ASP OD2 O -14.736 -4.571 -6.663 1.00 . A A . 96 ASP OD2 1 1 11 20214 1 1 97 LEU C C -6.630 -5.549 -5.750 1.00 . A A . 97 LEU C 1 1 11 20215 1 1 97 LEU CA C -7.973 -5.802 -5.063 1.00 . A A . 97 LEU CA 1 1 11 20216 1 1 97 LEU CB C -8.025 -7.114 -4.277 1.00 . A A . 97 LEU CB 1 1 11 20217 1 1 97 LEU CD1 C -8.912 -8.392 -2.293 1.00 . A A . 97 LEU CD1 1 1 11 20218 1 1 97 LEU CD2 C -9.443 -5.926 -2.562 1.00 . A A . 97 LEU CD2 1 1 11 20219 1 1 97 LEU CG C -9.176 -7.252 -3.278 1.00 . A A . 97 LEU CG 1 1 11 20220 1 1 97 LEU H H -8.925 -6.397 -6.817 1.00 . A A . 97 LEU H 1 1 11 20221 1 1 97 LEU HA H -8.156 -4.994 -4.354 1.00 . A A . 97 LEU HA 1 1 11 20222 1 1 97 LEU HB2 H -8.087 -7.938 -4.988 1.00 . A A . 97 LEU HB2 1 1 11 20223 1 1 97 LEU HB3 H -7.085 -7.228 -3.737 1.00 . A A . 97 LEU HB3 1 1 11 20224 1 1 97 LEU HD11 H -8.175 -9.075 -2.716 1.00 . A A . 97 LEU HD11 1 1 11 20225 1 1 97 LEU HD12 H -8.532 -7.983 -1.356 1.00 . A A . 97 LEU HD12 1 1 11 20226 1 1 97 LEU HD13 H -9.841 -8.931 -2.103 1.00 . A A . 97 LEU HD13 1 1 11 20227 1 1 97 LEU HD21 H -8.503 -5.389 -2.430 1.00 . A A . 97 LEU HD21 1 1 11 20228 1 1 97 LEU HD22 H -10.125 -5.322 -3.160 1.00 . A A . 97 LEU HD22 1 1 11 20229 1 1 97 LEU HD23 H -9.889 -6.123 -1.588 1.00 . A A . 97 LEU HD23 1 1 11 20230 1 1 97 LEU HG H -10.080 -7.507 -3.831 1.00 . A A . 97 LEU HG 1 1 11 20231 1 1 97 LEU N N -9.035 -5.760 -6.054 1.00 . A A . 97 LEU N 1 1 11 20232 1 1 97 LEU O O -5.814 -4.771 -5.258 1.00 . A A . 97 LEU O 1 1 11 20233 1 1 98 THR C C -5.509 -5.562 -9.043 1.00 . A A . 98 THR C 1 1 11 20234 1 1 98 THR CA C -5.210 -6.080 -7.635 1.00 . A A . 98 THR CA 1 1 11 20235 1 1 98 THR CB C -4.490 -7.430 -7.624 1.00 . A A . 98 THR CB 1 1 11 20236 1 1 98 THR CG2 C -4.646 -8.166 -6.291 1.00 . A A . 98 THR CG2 1 1 11 20237 1 1 98 THR H H -7.110 -6.852 -7.269 1.00 . A A . 98 THR H 1 1 11 20238 1 1 98 THR HA H -4.588 -5.331 -7.144 1.00 . A A . 98 THR HA 1 1 11 20239 1 1 98 THR HB H -3.438 -7.312 -7.883 1.00 . A A . 98 THR HB 1 1 11 20240 1 1 98 THR HG1 H -4.614 -8.604 -9.240 1.00 . A A . 98 THR HG1 1 1 11 20241 1 1 98 THR HG21 H -5.705 -8.284 -6.063 1.00 . A A . 98 THR HG21 1 1 11 20242 1 1 98 THR HG22 H -4.178 -9.147 -6.361 1.00 . A A . 98 THR HG22 1 1 11 20243 1 1 98 THR HG23 H -4.166 -7.590 -5.500 1.00 . A A . 98 THR HG23 1 1 11 20244 1 1 98 THR N N -6.441 -6.221 -6.876 1.00 . A A . 98 THR N 1 1 11 20245 1 1 98 THR O O -4.615 -5.493 -9.885 1.00 . A A . 98 THR O 1 1 11 20246 1 1 98 THR OG1 O -5.228 -8.225 -8.547 1.00 . A A . 98 THR OG1 1 1 11 20247 1 1 99 GLY C C -6.396 -3.458 -10.938 1.00 . A A . 99 GLY C 1 1 11 20248 1 1 99 GLY CA C -7.196 -4.702 -10.547 1.00 . A A . 99 GLY CA 1 1 11 20249 1 1 99 GLY H H -7.489 -5.270 -8.564 1.00 . A A . 99 GLY H 1 1 11 20250 1 1 99 GLY HA2 H -7.070 -5.474 -11.306 1.00 . A A . 99 GLY HA2 1 1 11 20251 1 1 99 GLY HA3 H -8.259 -4.460 -10.513 1.00 . A A . 99 GLY HA3 1 1 11 20252 1 1 99 GLY N N -6.769 -5.211 -9.255 1.00 . A A . 99 GLY N 1 1 11 20253 1 1 99 GLY O O -5.929 -2.719 -10.073 1.00 . A A . 99 GLY O 1 1 11 20254 1 1 100 CYS C C -6.512 -0.972 -12.968 1.00 . A A . 100 CYS C 1 1 11 20255 1 1 100 CYS CA C -5.527 -2.123 -12.759 1.00 . A A . 100 CYS CA 1 1 11 20256 1 1 100 CYS CB C -4.773 -2.471 -14.044 1.00 . A A . 100 CYS CB 1 1 11 20257 1 1 100 CYS H H -6.647 -3.871 -12.939 1.00 . A A . 100 CYS H 1 1 11 20258 1 1 100 CYS HA H -4.783 -1.864 -12.006 1.00 . A A . 100 CYS HA 1 1 11 20259 1 1 100 CYS HB2 H -5.312 -3.264 -14.562 1.00 . A A . 100 CYS HB2 1 1 11 20260 1 1 100 CYS HB3 H -4.781 -1.600 -14.700 1.00 . A A . 100 CYS HB3 1 1 11 20261 1 1 100 CYS N N -6.263 -3.265 -12.242 1.00 . A A . 100 CYS N 1 1 11 20262 1 1 100 CYS O O -6.228 0.168 -12.602 1.00 . A A . 100 CYS O 1 1 11 20263 1 1 100 CYS SG S -3.040 -3.003 -13.797 1.00 . A A . 100 CYS SG 1 1 11 20264 1 1 101 LYS C C -10.020 -0.825 -13.287 1.00 . A A . 101 LYS C 1 1 11 20265 1 1 101 LYS CA C -8.679 -0.316 -13.820 1.00 . A A . 101 LYS CA 1 1 11 20266 1 1 101 LYS CB C -8.706 0.046 -15.306 1.00 . A A . 101 LYS CB 1 1 11 20267 1 1 101 LYS CD C -10.120 1.241 -17.019 1.00 . A A . 101 LYS CD 1 1 11 20268 1 1 101 LYS CE C -10.106 2.661 -17.588 1.00 . A A . 101 LYS CE 1 1 11 20269 1 1 101 LYS CG C -9.643 1.228 -15.566 1.00 . A A . 101 LYS CG 1 1 11 20270 1 1 101 LYS H H -7.874 -2.237 -13.852 1.00 . A A . 101 LYS H 1 1 11 20271 1 1 101 LYS HA H -8.409 0.587 -13.273 1.00 . A A . 101 LYS HA 1 1 11 20272 1 1 101 LYS HB2 H -7.700 0.295 -15.643 1.00 . A A . 101 LYS HB2 1 1 11 20273 1 1 101 LYS HB3 H -9.033 -0.816 -15.889 1.00 . A A . 101 LYS HB3 1 1 11 20274 1 1 101 LYS HD2 H -9.478 0.598 -17.622 1.00 . A A . 101 LYS HD2 1 1 11 20275 1 1 101 LYS HD3 H -11.128 0.831 -17.079 1.00 . A A . 101 LYS HD3 1 1 11 20276 1 1 101 LYS HE2 H -9.293 3.232 -17.139 1.00 . A A . 101 LYS HE2 1 1 11 20277 1 1 101 LYS HE3 H -9.917 2.628 -18.661 1.00 . A A . 101 LYS HE3 1 1 11 20278 1 1 101 LYS HG2 H -10.502 1.168 -14.898 1.00 . A A . 101 LYS HG2 1 1 11 20279 1 1 101 LYS HG3 H -9.128 2.161 -15.340 1.00 . A A . 101 LYS HG3 1 1 11 20280 1 1 101 LYS HZ1 H -11.301 4.346 -17.309 1.00 . A A . 101 LYS HZ1 1 1 11 20281 1 1 101 LYS HZ2 H -12.090 3.120 -18.034 1.00 . A A . 101 LYS HZ2 1 1 11 20282 1 1 101 LYS N N -7.650 -1.308 -13.557 1.00 . A A . 101 LYS N 1 1 11 20283 1 1 101 LYS NZ N -11.397 3.337 -17.326 1.00 . A A . 101 LYS NZ 1 1 11 20284 1 1 101 LYS O O -10.332 -2.008 -13.408 1.00 . A A . 101 LYS O 1 1 11 20285 1 1 102 LYS C C -11.888 -1.170 -10.951 1.00 . A A . 102 LYS C 1 1 11 20286 1 1 102 LYS CA C -12.077 -0.244 -12.154 1.00 . A A . 102 LYS CA 1 1 11 20287 1 1 102 LYS CB C -12.986 -0.825 -13.240 1.00 . A A . 102 LYS CB 1 1 11 20288 1 1 102 LYS CD C -15.107 0.397 -13.846 1.00 . A A . 102 LYS CD 1 1 11 20289 1 1 102 LYS CE C -15.438 1.638 -13.015 1.00 . A A . 102 LYS CE 1 1 11 20290 1 1 102 LYS CG C -13.601 0.287 -14.092 1.00 . A A . 102 LYS CG 1 1 11 20291 1 1 102 LYS H H -10.516 1.056 -12.613 1.00 . A A . 102 LYS H 1 1 11 20292 1 1 102 LYS HA H -12.538 0.681 -11.809 1.00 . A A . 102 LYS HA 1 1 11 20293 1 1 102 LYS HB2 H -12.414 -1.501 -13.875 1.00 . A A . 102 LYS HB2 1 1 11 20294 1 1 102 LYS HB3 H -13.778 -1.415 -12.778 1.00 . A A . 102 LYS HB3 1 1 11 20295 1 1 102 LYS HD2 H -15.632 0.443 -14.800 1.00 . A A . 102 LYS HD2 1 1 11 20296 1 1 102 LYS HD3 H -15.461 -0.496 -13.330 1.00 . A A . 102 LYS HD3 1 1 11 20297 1 1 102 LYS HE2 H -16.122 1.372 -12.210 1.00 . A A . 102 LYS HE2 1 1 11 20298 1 1 102 LYS HE3 H -14.531 2.023 -12.548 1.00 . A A . 102 LYS HE3 1 1 11 20299 1 1 102 LYS HG2 H -13.120 1.237 -13.859 1.00 . A A . 102 LYS HG2 1 1 11 20300 1 1 102 LYS HG3 H -13.414 0.086 -15.147 1.00 . A A . 102 LYS HG3 1 1 11 20301 1 1 102 LYS HZ1 H -16.756 3.212 -13.371 1.00 . A A . 102 LYS HZ1 1 1 11 20302 1 1 102 LYS HZ2 H -15.359 3.354 -14.195 1.00 . A A . 102 LYS HZ2 1 1 11 20303 1 1 102 LYS N N -10.777 0.096 -12.707 1.00 . A A . 102 LYS N 1 1 11 20304 1 1 102 LYS NZ N -16.046 2.685 -13.867 1.00 . A A . 102 LYS NZ 1 1 11 20305 1 1 102 LYS O O -12.526 -2.218 -10.863 1.00 . A A . 102 LYS O 1 1 11 20306 1 1 103 SER C C -11.054 -0.706 -7.610 1.00 . A A . 103 SER C 1 1 11 20307 1 1 103 SER CA C -10.728 -1.527 -8.859 1.00 . A A . 103 SER CA 1 1 11 20308 1 1 103 SER CB C -9.267 -1.981 -8.828 1.00 . A A . 103 SER CB 1 1 11 20309 1 1 103 SER H H -10.495 0.105 -10.132 1.00 . A A . 103 SER H 1 1 11 20310 1 1 103 SER HA H -11.377 -2.400 -8.923 1.00 . A A . 103 SER HA 1 1 11 20311 1 1 103 SER HB2 H -8.912 -1.992 -7.798 1.00 . A A . 103 SER HB2 1 1 11 20312 1 1 103 SER HB3 H -9.197 -3.004 -9.200 1.00 . A A . 103 SER HB3 1 1 11 20313 1 1 103 SER HG H -8.555 -0.181 -9.336 1.00 . A A . 103 SER HG 1 1 11 20314 1 1 103 SER N N -11.009 -0.749 -10.053 1.00 . A A . 103 SER N 1 1 11 20315 1 1 103 SER O O -11.577 0.403 -7.711 1.00 . A A . 103 SER O 1 1 11 20316 1 1 103 SER OG O -8.428 -1.135 -9.610 1.00 . A A . 103 SER OG 1 1 11 20317 1 1 104 LYS C C -9.951 0.492 -4.990 1.00 . A A . 104 LYS C 1 1 11 20318 1 1 104 LYS CA C -10.985 -0.617 -5.194 1.00 . A A . 104 LYS CA 1 1 11 20319 1 1 104 LYS CB C -11.028 -1.636 -4.053 1.00 . A A . 104 LYS CB 1 1 11 20320 1 1 104 LYS CD C -13.500 -2.025 -3.744 1.00 . A A . 104 LYS CD 1 1 11 20321 1 1 104 LYS CE C -14.086 -2.864 -2.606 1.00 . A A . 104 LYS CE 1 1 11 20322 1 1 104 LYS CG C -12.182 -2.622 -4.242 1.00 . A A . 104 LYS CG 1 1 11 20323 1 1 104 LYS H H -10.307 -2.184 -6.387 1.00 . A A . 104 LYS H 1 1 11 20324 1 1 104 LYS HA H -11.973 -0.161 -5.256 1.00 . A A . 104 LYS HA 1 1 11 20325 1 1 104 LYS HB2 H -10.084 -2.179 -4.010 1.00 . A A . 104 LYS HB2 1 1 11 20326 1 1 104 LYS HB3 H -11.140 -1.117 -3.101 1.00 . A A . 104 LYS HB3 1 1 11 20327 1 1 104 LYS HD2 H -13.334 -1.005 -3.399 1.00 . A A . 104 LYS HD2 1 1 11 20328 1 1 104 LYS HD3 H -14.213 -1.972 -4.566 1.00 . A A . 104 LYS HD3 1 1 11 20329 1 1 104 LYS HE2 H -13.591 -3.835 -2.570 1.00 . A A . 104 LYS HE2 1 1 11 20330 1 1 104 LYS HE3 H -13.897 -2.375 -1.651 1.00 . A A . 104 LYS HE3 1 1 11 20331 1 1 104 LYS HG2 H -12.273 -2.884 -5.296 1.00 . A A . 104 LYS HG2 1 1 11 20332 1 1 104 LYS HG3 H -11.969 -3.544 -3.702 1.00 . A A . 104 LYS HG3 1 1 11 20333 1 1 104 LYS HZ1 H -16.019 -2.169 -2.955 1.00 . A A . 104 LYS HZ1 1 1 11 20334 1 1 104 LYS HZ2 H -15.749 -3.644 -3.591 1.00 . A A . 104 LYS HZ2 1 1 11 20335 1 1 104 LYS N N -10.732 -1.282 -6.461 1.00 . A A . 104 LYS N 1 1 11 20336 1 1 104 LYS NZ N -15.542 -3.049 -2.796 1.00 . A A . 104 LYS NZ 1 1 11 20337 1 1 104 LYS O O -10.236 1.501 -4.346 1.00 . A A . 104 LYS O 1 1 11 20338 1 1 105 CYS C C -7.885 2.297 -6.520 1.00 . A A . 105 CYS C 1 1 11 20339 1 1 105 CYS CA C -7.693 1.235 -5.436 1.00 . A A . 105 CYS CA 1 1 11 20340 1 1 105 CYS CB C -6.320 0.566 -5.529 1.00 . A A . 105 CYS CB 1 1 11 20341 1 1 105 CYS H H -8.547 -0.556 -6.070 1.00 . A A . 105 CYS H 1 1 11 20342 1 1 105 CYS HA H -7.772 1.677 -4.443 1.00 . A A . 105 CYS HA 1 1 11 20343 1 1 105 CYS HB2 H -6.184 0.134 -6.520 1.00 . A A . 105 CYS HB2 1 1 11 20344 1 1 105 CYS HB3 H -5.534 1.309 -5.394 1.00 . A A . 105 CYS HB3 1 1 11 20345 1 1 105 CYS N N -8.771 0.268 -5.549 1.00 . A A . 105 CYS N 1 1 11 20346 1 1 105 CYS O O -8.139 3.462 -6.215 1.00 . A A . 105 CYS O 1 1 11 20347 1 1 105 CYS SG S -6.171 -0.738 -4.253 1.00 . A A . 105 CYS SG 1 1 11 20348 1 1 106 HIS C C -9.344 2.672 -9.424 1.00 . A A . 106 HIS C 1 1 11 20349 1 1 106 HIS CA C -7.911 2.757 -8.894 1.00 . A A . 106 HIS CA 1 1 11 20350 1 1 106 HIS CB C -6.863 2.463 -9.970 1.00 . A A . 106 HIS CB 1 1 11 20351 1 1 106 HIS CD2 C -4.391 1.802 -9.434 1.00 . A A . 106 HIS CD2 1 1 11 20352 1 1 106 HIS CE1 C -3.689 3.755 -8.743 1.00 . A A . 106 HIS CE1 1 1 11 20353 1 1 106 HIS CG C -5.439 2.672 -9.513 1.00 . A A . 106 HIS CG 1 1 11 20354 1 1 106 HIS H H -7.548 0.910 -8.002 1.00 . A A . 106 HIS H 1 1 11 20355 1 1 106 HIS HA H -7.730 3.764 -8.521 1.00 . A A . 106 HIS HA 1 1 11 20356 1 1 106 HIS HB2 H -6.979 1.432 -10.304 1.00 . A A . 106 HIS HB2 1 1 11 20357 1 1 106 HIS HB3 H -7.054 3.101 -10.833 1.00 . A A . 106 HIS HB3 1 1 11 20358 1 1 106 HIS HD1 H -5.496 4.740 -9.007 1.00 . A A . 106 HIS HD1 1 1 11 20359 1 1 106 HIS HD2 H -4.418 0.747 -9.706 1.00 . A A . 106 HIS HD2 1 1 11 20360 1 1 106 HIS HE1 H -3.037 4.540 -8.359 1.00 . A A . 106 HIS HE1 1 1 11 20361 1 1 106 HIS N N -7.755 1.858 -7.763 1.00 . A A . 106 HIS N 1 1 11 20362 1 1 106 HIS ND1 N -4.965 3.895 -9.070 1.00 . A A . 106 HIS ND1 1 1 11 20363 1 1 106 HIS NE2 N -3.335 2.458 -8.969 1.00 . A A . 106 HIS NE2 1 1 11 20364 1 1 106 HIS O O -9.877 1.579 -9.610 1.00 . A A . 106 HIS O 1 1 11 20365 1 1 107 GLU C C -11.307 4.560 -11.541 1.00 . A A . 107 GLU C 1 1 11 20366 1 1 107 GLU CA C -11.288 3.911 -10.156 1.00 . A A . 107 GLU CA 1 1 11 20367 1 1 107 GLU CB C -12.194 4.668 -9.182 1.00 . A A . 107 GLU CB 1 1 11 20368 1 1 107 GLU CD C -13.021 7.048 -9.275 1.00 . A A . 107 GLU CD 1 1 11 20369 1 1 107 GLU CG C -11.799 6.144 -9.101 1.00 . A A . 107 GLU CG 1 1 11 20370 1 1 107 GLU H H -9.486 4.724 -9.497 1.00 . A A . 107 GLU H 1 1 11 20371 1 1 107 GLU HA H -11.625 2.877 -10.227 1.00 . A A . 107 GLU HA 1 1 11 20372 1 1 107 GLU HB2 H -13.231 4.582 -9.505 1.00 . A A . 107 GLU HB2 1 1 11 20373 1 1 107 GLU HB3 H -12.129 4.215 -8.193 1.00 . A A . 107 GLU HB3 1 1 11 20374 1 1 107 GLU HG2 H -11.327 6.345 -8.140 1.00 . A A . 107 GLU HG2 1 1 11 20375 1 1 107 GLU HG3 H -11.062 6.370 -9.872 1.00 . A A . 107 GLU HG3 1 1 11 20376 1 1 107 GLU N N -9.927 3.839 -9.651 1.00 . A A . 107 GLU N 1 1 11 20377 1 1 107 GLU O O -12.252 4.371 -12.306 1.00 . A A . 107 GLU O 1 1 11 20378 1 1 107 GLU OXT O -10.330 5.278 -11.845 1.00 . A A . 107 GLU OXT 1 1 11 20379 1 1 107 GLU OE1 O -13.606 7.006 -10.379 1.00 . A A . 107 GLU OE1 1 1 11 20380 1 1 107 GLU OE2 O -13.343 7.761 -8.300 1.00 . A A . 107 GLU OE2 1 1 11 20381 2 2 1 HEC C1A C -1.012 5.491 9.226 1.00 . B A . 108 HEC C1A 1 1 11 20382 2 2 1 HEC C1B C -1.962 2.333 12.017 1.00 . B A . 108 HEC C1B 1 1 11 20383 2 2 1 HEC C1C C -2.149 -0.500 8.703 1.00 . B A . 108 HEC C1C 1 1 11 20384 2 2 1 HEC C1D C -1.043 2.654 5.964 1.00 . B A . 108 HEC C1D 1 1 11 20385 2 2 1 HEC C2A C -0.807 6.531 10.207 1.00 . B A . 108 HEC C2A 1 1 11 20386 2 2 1 HEC C2B C -2.396 1.428 13.055 1.00 . B A . 108 HEC C2B 1 1 11 20387 2 2 1 HEC C2C C -2.204 -1.563 7.726 1.00 . B A . 108 HEC C2C 1 1 11 20388 2 2 1 HEC C2D C -0.659 3.585 4.930 1.00 . B A . 108 HEC C2D 1 1 11 20389 2 2 1 HEC C3A C -1.025 5.981 11.420 1.00 . B A . 108 HEC C3A 1 1 11 20390 2 2 1 HEC C3B C -2.582 0.222 12.478 1.00 . B A . 108 HEC C3B 1 1 11 20391 2 2 1 HEC C3C C -1.880 -1.022 6.533 1.00 . B A . 108 HEC C3C 1 1 11 20392 2 2 1 HEC C3D C -0.555 4.800 5.508 1.00 . B A . 108 HEC C3D 1 1 11 20393 2 2 1 HEC C4A C -1.367 4.595 11.202 1.00 . B A . 108 HEC C4A 1 1 11 20394 2 2 1 HEC C4B C -2.265 0.369 11.077 1.00 . B A . 108 HEC C4B 1 1 11 20395 2 2 1 HEC C4C C -1.620 0.380 6.759 1.00 . B A . 108 HEC C4C 1 1 11 20396 2 2 1 HEC C4D C -0.874 4.634 6.907 1.00 . B A . 108 HEC C4D 1 1 11 20397 2 2 1 HEC CAA C -0.424 7.947 9.890 1.00 . B A . 108 HEC CAA 1 1 11 20398 2 2 1 HEC CAB C -3.032 -1.054 13.128 1.00 . B A . 108 HEC CAB 1 1 11 20399 2 2 1 HEC CAC C -1.792 -1.708 5.201 1.00 . B A . 108 HEC CAC 1 1 11 20400 2 2 1 HEC CAD C -0.183 6.103 4.861 1.00 . B A . 108 HEC CAD 1 1 11 20401 2 2 1 HEC CBA C -1.293 8.601 8.819 1.00 . B A . 108 HEC CBA 1 1 11 20402 2 2 1 HEC CBB C -4.292 -0.908 13.975 1.00 . B A . 108 HEC CBB 1 1 11 20403 2 2 1 HEC CBC C -2.809 -2.831 5.013 1.00 . B A . 108 HEC CBC 1 1 11 20404 2 2 1 HEC CBD C -0.803 6.310 3.482 1.00 . B A . 108 HEC CBD 1 1 11 20405 2 2 1 HEC CGA C -2.025 9.815 9.373 1.00 . B A . 108 HEC CGA 1 1 11 20406 2 2 1 HEC CGD C 0.271 6.533 2.427 1.00 . B A . 108 HEC CGD 1 1 11 20407 2 2 1 HEC CHA C -0.878 5.674 7.853 1.00 . B A . 108 HEC CHA 1 1 11 20408 2 2 1 HEC CHB C -1.667 3.677 12.225 1.00 . B A . 108 HEC CHB 1 1 11 20409 2 2 1 HEC CHC C -2.335 -0.669 10.130 1.00 . B A . 108 HEC CHC 1 1 11 20410 2 2 1 HEC CHD C -1.249 1.294 5.755 1.00 . B A . 108 HEC CHD 1 1 11 20411 2 2 1 HEC CMA C -0.940 6.643 12.764 1.00 . B A . 108 HEC CMA 1 1 11 20412 2 2 1 HEC CMB C -2.591 1.803 14.496 1.00 . B A . 108 HEC CMB 1 1 11 20413 2 2 1 HEC CMC C -2.562 -2.989 8.028 1.00 . B A . 108 HEC CMC 1 1 11 20414 2 2 1 HEC CMD C -0.429 3.224 3.491 1.00 . B A . 108 HEC CMD 1 1 11 20415 2 2 1 HEC FE FE -1.550 2.494 8.981 1.00 . B A . 108 HEC FE 1 1 11 20416 2 2 1 HEC HAA1 H -0.509 8.557 10.790 1.00 . B A . 108 HEC HAA1 1 1 11 20417 2 2 1 HEC HAA2 H 0.605 7.973 9.530 1.00 . B A . 108 HEC HAA2 1 1 11 20418 2 2 1 HEC HAB H -3.245 -1.797 12.359 1.00 . B A . 108 HEC HAB 1 1 11 20419 2 2 1 HEC HAC H -1.965 -0.982 4.406 1.00 . B A . 108 HEC HAC 1 1 11 20420 2 2 1 HEC HAD1 H -0.515 6.929 5.490 1.00 . B A . 108 HEC HAD1 1 1 11 20421 2 2 1 HEC HAD2 H 0.899 6.151 4.739 1.00 . B A . 108 HEC HAD2 1 1 11 20422 2 2 1 HEC HBA1 H -0.665 8.922 7.988 1.00 . B A . 108 HEC HBA1 1 1 11 20423 2 2 1 HEC HBA2 H -2.030 7.882 8.461 1.00 . B A . 108 HEC HBA2 1 1 11 20424 2 2 1 HEC HBB1 H -4.947 -0.162 13.527 1.00 . B A . 108 HEC HBB1 1 1 11 20425 2 2 1 HEC HBB2 H -4.811 -1.866 14.022 1.00 . B A . 108 HEC HBB2 1 1 11 20426 2 2 1 HEC HBB3 H -4.018 -0.594 14.982 1.00 . B A . 108 HEC HBB3 1 1 11 20427 2 2 1 HEC HBC1 H -2.420 -3.750 5.452 1.00 . B A . 108 HEC HBC1 1 1 11 20428 2 2 1 HEC HBC2 H -3.743 -2.561 5.504 1.00 . B A . 108 HEC HBC2 1 1 11 20429 2 2 1 HEC HBC3 H -2.988 -2.985 3.949 1.00 . B A . 108 HEC HBC3 1 1 11 20430 2 2 1 HEC HBD1 H -1.383 5.429 3.208 1.00 . B A . 108 HEC HBD1 1 1 11 20431 2 2 1 HEC HBD2 H -1.456 7.183 3.505 1.00 . B A . 108 HEC HBD2 1 1 11 20432 2 2 1 HEC HHA H -0.769 6.693 7.481 1.00 . B A . 108 HEC HHA 1 1 11 20433 2 2 1 HEC HHB H -1.667 4.049 13.249 1.00 . B A . 108 HEC HHB 1 1 11 20434 2 2 1 HEC HHC H -2.547 -1.673 10.499 1.00 . B A . 108 HEC HHC 1 1 11 20435 2 2 1 HEC HHD H -1.116 0.906 4.746 1.00 . B A . 108 HEC HHD 1 1 11 20436 2 2 1 HEC HMA1 H -0.609 5.917 13.507 1.00 . B A . 108 HEC HMA1 1 1 11 20437 2 2 1 HEC HMA2 H -0.228 7.467 12.719 1.00 . B A . 108 HEC HMA2 1 1 11 20438 2 2 1 HEC HMA3 H -1.921 7.026 13.043 1.00 . B A . 108 HEC HMA3 1 1 11 20439 2 2 1 HEC HMB1 H -2.649 0.899 15.102 1.00 . B A . 108 HEC HMB1 1 1 11 20440 2 2 1 HEC HMB2 H -1.749 2.410 14.830 1.00 . B A . 108 HEC HMB2 1 1 11 20441 2 2 1 HEC HMB3 H -3.514 2.372 14.601 1.00 . B A . 108 HEC HMB3 1 1 11 20442 2 2 1 HEC HMC1 H -1.666 -3.607 7.973 1.00 . B A . 108 HEC HMC1 1 1 11 20443 2 2 1 HEC HMC2 H -2.986 -3.053 9.031 1.00 . B A . 108 HEC HMC2 1 1 11 20444 2 2 1 HEC HMC3 H -3.292 -3.342 7.301 1.00 . B A . 108 HEC HMC3 1 1 11 20445 2 2 1 HEC HMD1 H -1.385 3.192 2.967 1.00 . B A . 108 HEC HMD1 1 1 11 20446 2 2 1 HEC HMD2 H 0.215 3.970 3.028 1.00 . B A . 108 HEC HMD2 1 1 11 20447 2 2 1 HEC HMD3 H 0.049 2.245 3.434 1.00 . B A . 108 HEC HMD3 1 1 11 20448 2 2 1 HEC NA N -1.356 4.304 9.849 1.00 . B A . 108 HEC NA 1 1 11 20449 2 2 1 HEC NB N -1.884 1.671 10.804 1.00 . B A . 108 HEC NB 1 1 11 20450 2 2 1 HEC NC N -1.789 0.691 8.097 1.00 . B A . 108 HEC NC 1 1 11 20451 2 2 1 HEC ND N -1.173 3.309 7.176 1.00 . B A . 108 HEC ND 1 1 11 20452 2 2 1 HEC O1A O -2.269 10.744 8.574 1.00 . B A . 108 HEC O1A 1 1 11 20453 2 2 1 HEC O1D O 0.060 7.430 1.583 1.00 . B A . 108 HEC O1D 1 1 11 20454 2 2 1 HEC O2A O -2.327 9.790 10.586 1.00 . B A . 108 HEC O2A 1 1 11 20455 2 2 1 HEC O2D O 1.284 5.802 2.485 1.00 . B A . 108 HEC O2D 1 1 11 20456 3 2 1 HEC C1A C 9.615 -1.661 1.730 1.00 . C A . 109 HEC C1A 1 1 11 20457 3 2 1 HEC C1B C 5.778 0.075 2.704 1.00 . C A . 109 HEC C1B 1 1 11 20458 3 2 1 HEC C1C C 7.810 3.109 5.123 1.00 . C A . 109 HEC C1C 1 1 11 20459 3 2 1 HEC C1D C 11.623 1.523 3.853 1.00 . C A . 109 HEC C1D 1 1 11 20460 3 2 1 HEC C2A C 9.108 -2.749 0.926 1.00 . C A . 109 HEC C2A 1 1 11 20461 3 2 1 HEC C2B C 4.422 0.437 3.044 1.00 . C A . 109 HEC C2B 1 1 11 20462 3 2 1 HEC C2C C 8.330 4.252 5.837 1.00 . C A . 109 HEC C2C 1 1 11 20463 3 2 1 HEC C2D C 12.971 1.089 3.571 1.00 . C A . 109 HEC C2D 1 1 11 20464 3 2 1 HEC C3A C 7.766 -2.616 0.880 1.00 . C A . 109 HEC C3A 1 1 11 20465 3 2 1 HEC C3B C 4.492 1.488 3.887 1.00 . C A . 109 HEC C3B 1 1 11 20466 3 2 1 HEC C3C C 9.673 4.219 5.714 1.00 . C A . 109 HEC C3C 1 1 11 20467 3 2 1 HEC C3D C 12.880 -0.056 2.861 1.00 . C A . 109 HEC C3D 1 1 11 20468 3 2 1 HEC C4A C 7.427 -1.446 1.655 1.00 . C A . 109 HEC C4A 1 1 11 20469 3 2 1 HEC C4B C 5.892 1.788 4.077 1.00 . C A . 109 HEC C4B 1 1 11 20470 3 2 1 HEC C4C C 9.999 3.056 4.922 1.00 . C A . 109 HEC C4C 1 1 11 20471 3 2 1 HEC C4D C 11.474 -0.342 2.697 1.00 . C A . 109 HEC C4D 1 1 11 20472 3 2 1 HEC CAA C 9.955 -3.806 0.280 1.00 . C A . 109 HEC CAA 1 1 11 20473 3 2 1 HEC CAB C 3.359 2.235 4.529 1.00 . C A . 109 HEC CAB 1 1 11 20474 3 2 1 HEC CAC C 10.676 5.185 6.275 1.00 . C A . 109 HEC CAC 1 1 11 20475 3 2 1 HEC CAD C 13.997 -0.902 2.325 1.00 . C A . 109 HEC CAD 1 1 11 20476 3 2 1 HEC CBA C 10.244 -3.555 -1.197 1.00 . C A . 109 HEC CBA 1 1 11 20477 3 2 1 HEC CBB C 2.286 1.334 5.134 1.00 . C A . 109 HEC CBB 1 1 11 20478 3 2 1 HEC CBC C 10.655 5.287 7.797 1.00 . C A . 109 HEC CBC 1 1 11 20479 3 2 1 HEC CBD C 15.206 -0.993 3.250 1.00 . C A . 109 HEC CBD 1 1 11 20480 3 2 1 HEC CGA C 11.033 -4.705 -1.804 1.00 . C A . 109 HEC CGA 1 1 11 20481 3 2 1 HEC CGD C 16.437 -0.370 2.607 1.00 . C A . 109 HEC CGD 1 1 11 20482 3 2 1 HEC CHA C 10.962 -1.457 2.009 1.00 . C A . 109 HEC CHA 1 1 11 20483 3 2 1 HEC CHB C 6.118 -0.970 1.851 1.00 . C A . 109 HEC CHB 1 1 11 20484 3 2 1 HEC CHC C 6.382 2.825 4.893 1.00 . C A . 109 HEC CHC 1 1 11 20485 3 2 1 HEC CHD C 11.306 2.672 4.570 1.00 . C A . 109 HEC CHD 1 1 11 20486 3 2 1 HEC CMA C 6.774 -3.493 0.172 1.00 . C A . 109 HEC CMA 1 1 11 20487 3 2 1 HEC CMB C 3.194 -0.257 2.531 1.00 . C A . 109 HEC CMB 1 1 11 20488 3 2 1 HEC CMC C 7.492 5.262 6.566 1.00 . C A . 109 HEC CMC 1 1 11 20489 3 2 1 HEC CMD C 14.214 1.809 4.007 1.00 . C A . 109 HEC CMD 1 1 11 20490 3 2 1 HEC FE FE 8.700 0.766 3.349 1.00 . C A . 109 HEC FE 1 1 11 20491 3 2 1 HEC HAA1 H 10.916 -3.864 0.791 1.00 . C A . 109 HEC HAA1 1 1 11 20492 3 2 1 HEC HAA2 H 9.449 -4.769 0.349 1.00 . C A . 109 HEC HAA2 1 1 11 20493 3 2 1 HEC HAB H 3.745 2.860 5.334 1.00 . C A . 109 HEC HAB 1 1 11 20494 3 2 1 HEC HAC H 11.680 4.873 5.988 1.00 . C A . 109 HEC HAC 1 1 11 20495 3 2 1 HEC HAD1 H 13.637 -1.919 2.164 1.00 . C A . 109 HEC HAD1 1 1 11 20496 3 2 1 HEC HAD2 H 14.346 -0.487 1.379 1.00 . C A . 109 HEC HAD2 1 1 11 20497 3 2 1 HEC HBA1 H 9.304 -3.452 -1.739 1.00 . C A . 109 HEC HBA1 1 1 11 20498 3 2 1 HEC HBA2 H 10.826 -2.639 -1.302 1.00 . C A . 109 HEC HBA2 1 1 11 20499 3 2 1 HEC HBB1 H 2.364 0.336 4.703 1.00 . C A . 109 HEC HBB1 1 1 11 20500 3 2 1 HEC HBB2 H 2.426 1.276 6.214 1.00 . C A . 109 HEC HBB2 1 1 11 20501 3 2 1 HEC HBB3 H 1.301 1.746 4.918 1.00 . C A . 109 HEC HBB3 1 1 11 20502 3 2 1 HEC HBC1 H 9.736 5.782 8.115 1.00 . C A . 109 HEC HBC1 1 1 11 20503 3 2 1 HEC HBC2 H 10.697 4.288 8.229 1.00 . C A . 109 HEC HBC2 1 1 11 20504 3 2 1 HEC HBC3 H 11.514 5.866 8.135 1.00 . C A . 109 HEC HBC3 1 1 11 20505 3 2 1 HEC HBD1 H 14.993 -0.464 4.180 1.00 . C A . 109 HEC HBD1 1 1 11 20506 3 2 1 HEC HBD2 H 15.419 -2.040 3.469 1.00 . C A . 109 HEC HBD2 1 1 11 20507 3 2 1 HEC HHA H 11.674 -2.211 1.673 1.00 . C A . 109 HEC HHA 1 1 11 20508 3 2 1 HEC HHB H 5.318 -1.456 1.293 1.00 . C A . 109 HEC HHB 1 1 11 20509 3 2 1 HEC HHC H 5.650 3.453 5.401 1.00 . C A . 109 HEC HHC 1 1 11 20510 3 2 1 HEC HHD H 12.122 3.322 4.882 1.00 . C A . 109 HEC HHD 1 1 11 20511 3 2 1 HEC HMA1 H 6.354 -4.210 0.877 1.00 . C A . 109 HEC HMA1 1 1 11 20512 3 2 1 HEC HMA2 H 5.975 -2.878 -0.241 1.00 . C A . 109 HEC HMA2 1 1 11 20513 3 2 1 HEC HMA3 H 7.274 -4.028 -0.636 1.00 . C A . 109 HEC HMA3 1 1 11 20514 3 2 1 HEC HMB1 H 3.338 -0.524 1.484 1.00 . C A . 109 HEC HMB1 1 1 11 20515 3 2 1 HEC HMB2 H 3.016 -1.160 3.115 1.00 . C A . 109 HEC HMB2 1 1 11 20516 3 2 1 HEC HMB3 H 2.336 0.409 2.622 1.00 . C A . 109 HEC HMB3 1 1 11 20517 3 2 1 HEC HMC1 H 8.084 6.158 6.752 1.00 . C A . 109 HEC HMC1 1 1 11 20518 3 2 1 HEC HMC2 H 6.623 5.519 5.961 1.00 . C A . 109 HEC HMC2 1 1 11 20519 3 2 1 HEC HMC3 H 7.162 4.842 7.516 1.00 . C A . 109 HEC HMC3 1 1 11 20520 3 2 1 HEC HMD1 H 14.379 1.638 5.070 1.00 . C A . 109 HEC HMD1 1 1 11 20521 3 2 1 HEC HMD2 H 15.068 1.435 3.441 1.00 . C A . 109 HEC HMD2 1 1 11 20522 3 2 1 HEC HMD3 H 14.098 2.877 3.824 1.00 . C A . 109 HEC HMD3 1 1 11 20523 3 2 1 HEC NA N 8.572 -0.866 2.174 1.00 . C A . 109 HEC NA 1 1 11 20524 3 2 1 HEC NB N 6.674 0.913 3.345 1.00 . C A . 109 HEC NB 1 1 11 20525 3 2 1 HEC NC N 8.845 2.381 4.564 1.00 . C A . 109 HEC NC 1 1 11 20526 3 2 1 HEC ND N 10.710 0.635 3.311 1.00 . C A . 109 HEC ND 1 1 11 20527 3 2 1 HEC O1A O 11.531 -5.533 -1.011 1.00 . C A . 109 HEC O1A 1 1 11 20528 3 2 1 HEC O1D O 16.243 0.563 1.798 1.00 . C A . 109 HEC O1D 1 1 11 20529 3 2 1 HEC O2A O 11.124 -4.736 -3.051 1.00 . C A . 109 HEC O2A 1 1 11 20530 3 2 1 HEC O2D O 17.548 -0.840 2.935 1.00 . C A . 109 HEC O2D 1 1 11 20531 4 2 1 HEC C1A C -8.638 -3.379 0.447 1.00 . D A . 110 HEC C1A 1 1 11 20532 4 2 1 HEC C1B C -4.955 -1.150 0.086 1.00 . D A . 110 HEC C1B 1 1 11 20533 4 2 1 HEC C1C C -2.816 -4.374 2.020 1.00 . D A . 110 HEC C1C 1 1 11 20534 4 2 1 HEC C1D C -6.508 -6.586 2.410 1.00 . D A . 110 HEC C1D 1 1 11 20535 4 2 1 HEC C2A C -9.483 -2.426 -0.233 1.00 . D A . 110 HEC C2A 1 1 11 20536 4 2 1 HEC C2B C -3.812 -0.296 -0.136 1.00 . D A . 110 HEC C2B 1 1 11 20537 4 2 1 HEC C2C C -1.955 -5.375 2.604 1.00 . D A . 110 HEC C2C 1 1 11 20538 4 2 1 HEC C2D C -7.657 -7.423 2.666 1.00 . D A . 110 HEC C2D 1 1 11 20539 4 2 1 HEC C3A C -8.697 -1.392 -0.602 1.00 . D A . 110 HEC C3A 1 1 11 20540 4 2 1 HEC C3B C -2.746 -0.905 0.425 1.00 . D A . 110 HEC C3B 1 1 11 20541 4 2 1 HEC C3C C -2.737 -6.420 2.948 1.00 . D A . 110 HEC C3C 1 1 11 20542 4 2 1 HEC C3D C -8.734 -6.780 2.168 1.00 . D A . 110 HEC C3D 1 1 11 20543 4 2 1 HEC C4A C -7.359 -1.695 -0.154 1.00 . D A . 110 HEC C4A 1 1 11 20544 4 2 1 HEC C4B C -3.219 -2.142 1.000 1.00 . D A . 110 HEC C4B 1 1 11 20545 4 2 1 HEC C4C C -4.091 -6.077 2.581 1.00 . D A . 110 HEC C4C 1 1 11 20546 4 2 1 HEC C4D C -8.264 -5.540 1.599 1.00 . D A . 110 HEC C4D 1 1 11 20547 4 2 1 HEC CAA C -10.956 -2.595 -0.464 1.00 . D A . 110 HEC CAA 1 1 11 20548 4 2 1 HEC CAB C -1.324 -0.426 0.468 1.00 . D A . 110 HEC CAB 1 1 11 20549 4 2 1 HEC CAC C -2.323 -7.712 3.592 1.00 . D A . 110 HEC CAC 1 1 11 20550 4 2 1 HEC CAD C -10.166 -7.231 2.181 1.00 . D A . 110 HEC CAD 1 1 11 20551 4 2 1 HEC CBA C -11.824 -2.138 0.705 1.00 . D A . 110 HEC CBA 1 1 11 20552 4 2 1 HEC CBB C -1.173 1.032 0.893 1.00 . D A . 110 HEC CBB 1 1 11 20553 4 2 1 HEC CBC C -1.017 -7.624 4.376 1.00 . D A . 110 HEC CBC 1 1 11 20554 4 2 1 HEC CBD C -10.753 -7.474 0.793 1.00 . D A . 110 HEC CBD 1 1 11 20555 4 2 1 HEC CGA C -12.725 -3.265 1.192 1.00 . D A . 110 HEC CGA 1 1 11 20556 4 2 1 HEC CGD C -11.215 -8.915 0.638 1.00 . D A . 110 HEC CGD 1 1 11 20557 4 2 1 HEC CHA C -9.089 -4.584 0.978 1.00 . D A . 110 HEC CHA 1 1 11 20558 4 2 1 HEC CHB C -6.244 -0.859 -0.348 1.00 . D A . 110 HEC CHB 1 1 11 20559 4 2 1 HEC CHC C -2.406 -3.068 1.680 1.00 . D A . 110 HEC CHC 1 1 11 20560 4 2 1 HEC CHD C -5.207 -6.910 2.778 1.00 . D A . 110 HEC CHD 1 1 11 20561 4 2 1 HEC CMA C -9.095 -0.146 -1.338 1.00 . D A . 110 HEC CMA 1 1 11 20562 4 2 1 HEC CMB C -3.849 1.018 -0.862 1.00 . D A . 110 HEC CMB 1 1 11 20563 4 2 1 HEC CMC C -0.470 -5.236 2.776 1.00 . D A . 110 HEC CMC 1 1 11 20564 4 2 1 HEC CMD C -7.612 -8.752 3.360 1.00 . D A . 110 HEC CMD 1 1 11 20565 4 2 1 HEC FE FE -5.733 -3.862 1.260 1.00 . D A . 110 HEC FE 1 1 11 20566 4 2 1 HEC HAA1 H -11.257 -2.013 -1.335 1.00 . D A . 110 HEC HAA1 1 1 11 20567 4 2 1 HEC HAA2 H -11.178 -3.648 -0.637 1.00 . D A . 110 HEC HAA2 1 1 11 20568 4 2 1 HEC HAB H -0.759 -1.029 1.179 1.00 . D A . 110 HEC HAB 1 1 11 20569 4 2 1 HEC HAC H -3.096 -8.034 4.289 1.00 . D A . 110 HEC HAC 1 1 11 20570 4 2 1 HEC HAD1 H -10.247 -8.168 2.733 1.00 . D A . 110 HEC HAD1 1 1 11 20571 4 2 1 HEC HAD2 H -10.782 -6.471 2.662 1.00 . D A . 110 HEC HAD2 1 1 11 20572 4 2 1 HEC HBA1 H -11.186 -1.821 1.529 1.00 . D A . 110 HEC HBA1 1 1 11 20573 4 2 1 HEC HBA2 H -12.450 -1.304 0.388 1.00 . D A . 110 HEC HBA2 1 1 11 20574 4 2 1 HEC HBB1 H -1.168 1.669 0.010 1.00 . D A . 110 HEC HBB1 1 1 11 20575 4 2 1 HEC HBB2 H -2.006 1.310 1.538 1.00 . D A . 110 HEC HBB2 1 1 11 20576 4 2 1 HEC HBB3 H -0.236 1.156 1.436 1.00 . D A . 110 HEC HBB3 1 1 11 20577 4 2 1 HEC HBC1 H -0.844 -8.564 4.899 1.00 . D A . 110 HEC HBC1 1 1 11 20578 4 2 1 HEC HBC2 H -0.193 -7.433 3.689 1.00 . D A . 110 HEC HBC2 1 1 11 20579 4 2 1 HEC HBC3 H -1.082 -6.812 5.100 1.00 . D A . 110 HEC HBC3 1 1 11 20580 4 2 1 HEC HBD1 H -11.608 -6.815 0.640 1.00 . D A . 110 HEC HBD1 1 1 11 20581 4 2 1 HEC HBD2 H -9.995 -7.268 0.037 1.00 . D A . 110 HEC HBD2 1 1 11 20582 4 2 1 HEC HHA H -10.153 -4.806 0.910 1.00 . D A . 110 HEC HHA 1 1 11 20583 4 2 1 HEC HHB H -6.406 0.080 -0.877 1.00 . D A . 110 HEC HHB 1 1 11 20584 4 2 1 HEC HHC H -1.399 -2.749 1.951 1.00 . D A . 110 HEC HHC 1 1 11 20585 4 2 1 HEC HHD H -5.035 -7.876 3.252 1.00 . D A . 110 HEC HHD 1 1 11 20586 4 2 1 HEC HMA1 H -9.407 -0.406 -2.350 1.00 . D A . 110 HEC HMA1 1 1 11 20587 4 2 1 HEC HMA2 H -9.921 0.336 -0.816 1.00 . D A . 110 HEC HMA2 1 1 11 20588 4 2 1 HEC HMA3 H -8.246 0.536 -1.384 1.00 . D A . 110 HEC HMA3 1 1 11 20589 4 2 1 HEC HMB1 H -3.506 0.876 -1.886 1.00 . D A . 110 HEC HMB1 1 1 11 20590 4 2 1 HEC HMB2 H -4.870 1.400 -0.869 1.00 . D A . 110 HEC HMB2 1 1 11 20591 4 2 1 HEC HMB3 H -3.198 1.731 -0.356 1.00 . D A . 110 HEC HMB3 1 1 11 20592 4 2 1 HEC HMC1 H 0.036 -6.020 2.213 1.00 . D A . 110 HEC HMC1 1 1 11 20593 4 2 1 HEC HMC2 H -0.152 -4.261 2.408 1.00 . D A . 110 HEC HMC2 1 1 11 20594 4 2 1 HEC HMC3 H -0.217 -5.327 3.832 1.00 . D A . 110 HEC HMC3 1 1 11 20595 4 2 1 HEC HMD1 H -8.528 -9.304 3.148 1.00 . D A . 110 HEC HMD1 1 1 11 20596 4 2 1 HEC HMD2 H -6.754 -9.321 3.002 1.00 . D A . 110 HEC HMD2 1 1 11 20597 4 2 1 HEC HMD3 H -7.522 -8.598 4.436 1.00 . D A . 110 HEC HMD3 1 1 11 20598 4 2 1 HEC NA N -7.333 -2.920 0.491 1.00 . D A . 110 HEC NA 1 1 11 20599 4 2 1 HEC NB N -4.579 -2.283 0.786 1.00 . D A . 110 HEC NB 1 1 11 20600 4 2 1 HEC NC N -4.128 -4.816 2.011 1.00 . D A . 110 HEC NC 1 1 11 20601 4 2 1 HEC ND N -6.893 -5.430 1.753 1.00 . D A . 110 HEC ND 1 1 11 20602 4 2 1 HEC O1A O -13.958 -3.090 1.088 1.00 . D A . 110 HEC O1A 1 1 11 20603 4 2 1 HEC O1D O -12.181 -9.122 -0.128 1.00 . D A . 110 HEC O1D 1 1 11 20604 4 2 1 HEC O2A O -12.163 -4.279 1.658 1.00 . D A . 110 HEC O2A 1 1 11 20605 4 2 1 HEC O2D O -10.595 -9.784 1.289 1.00 . D A . 110 HEC O2D 1 1 11 20606 5 2 1 HEC C1A C -0.115 4.145 -9.208 1.00 . E A . 111 HEC C1A 1 1 11 20607 5 2 1 HEC C1B C -1.352 0.679 -11.473 1.00 . E A . 111 HEC C1B 1 1 11 20608 5 2 1 HEC C1C C -3.176 -0.995 -7.886 1.00 . E A . 111 HEC C1C 1 1 11 20609 5 2 1 HEC C1D C -1.892 2.468 -5.643 1.00 . E A . 111 HEC C1D 1 1 11 20610 5 2 1 HEC C2A C 0.470 4.869 -10.311 1.00 . E A . 111 HEC C2A 1 1 11 20611 5 2 1 HEC C2B C -1.497 -0.481 -12.321 1.00 . E A . 111 HEC C2B 1 1 11 20612 5 2 1 HEC C2C C -3.908 -1.630 -6.815 1.00 . E A . 111 HEC C2C 1 1 11 20613 5 2 1 HEC C2D C -1.385 3.456 -4.720 1.00 . E A . 111 HEC C2D 1 1 11 20614 5 2 1 HEC C3A C 0.294 4.116 -11.418 1.00 . E A . 111 HEC C3A 1 1 11 20615 5 2 1 HEC C3B C -2.098 -1.438 -11.583 1.00 . E A . 111 HEC C3B 1 1 11 20616 5 2 1 HEC C3C C -3.805 -0.829 -5.734 1.00 . E A . 111 HEC C3C 1 1 11 20617 5 2 1 HEC C3D C -0.680 4.351 -5.443 1.00 . E A . 111 HEC C3D 1 1 11 20618 5 2 1 HEC C4A C -0.402 2.919 -11.010 1.00 . E A . 111 HEC C4A 1 1 11 20619 5 2 1 HEC C4B C -2.331 -0.881 -10.272 1.00 . E A . 111 HEC C4B 1 1 11 20620 5 2 1 HEC C4C C -3.007 0.310 -6.124 1.00 . E A . 111 HEC C4C 1 1 11 20621 5 2 1 HEC C4D C -0.744 3.927 -6.822 1.00 . E A . 111 HEC C4D 1 1 11 20622 5 2 1 HEC CAA C 1.140 6.208 -10.201 1.00 . E A . 111 HEC CAA 1 1 11 20623 5 2 1 HEC CAB C -2.473 -2.830 -12.004 1.00 . E A . 111 HEC CAB 1 1 11 20624 5 2 1 HEC CAC C -4.391 -1.040 -4.368 1.00 . E A . 111 HEC CAC 1 1 11 20625 5 2 1 HEC CAD C 0.048 5.569 -4.952 1.00 . E A . 111 HEC CAD 1 1 11 20626 5 2 1 HEC CBA C 2.552 6.245 -10.777 1.00 . E A . 111 HEC CBA 1 1 11 20627 5 2 1 HEC CBB C -1.399 -3.875 -11.715 1.00 . E A . 111 HEC CBB 1 1 11 20628 5 2 1 HEC CBC C -4.217 -2.458 -3.831 1.00 . E A . 111 HEC CBC 1 1 11 20629 5 2 1 HEC CBD C -0.820 6.821 -4.876 1.00 . E A . 111 HEC CBD 1 1 11 20630 5 2 1 HEC CGA C 2.888 7.628 -11.317 1.00 . E A . 111 HEC CGA 1 1 11 20631 5 2 1 HEC CGD C -0.006 8.025 -4.423 1.00 . E A . 111 HEC CGD 1 1 11 20632 5 2 1 HEC CHA C -0.130 4.601 -7.894 1.00 . E A . 111 HEC CHA 1 1 11 20633 5 2 1 HEC CHB C -0.773 1.877 -11.880 1.00 . E A . 111 HEC CHB 1 1 11 20634 5 2 1 HEC CHC C -2.942 -1.571 -9.209 1.00 . E A . 111 HEC CHC 1 1 11 20635 5 2 1 HEC CHD C -2.671 1.377 -5.271 1.00 . E A . 111 HEC CHD 1 1 11 20636 5 2 1 HEC CMA C 0.722 4.425 -12.823 1.00 . E A . 111 HEC CMA 1 1 11 20637 5 2 1 HEC CMB C -1.048 -0.562 -13.751 1.00 . E A . 111 HEC CMB 1 1 11 20638 5 2 1 HEC CMC C -4.635 -2.938 -6.931 1.00 . E A . 111 HEC CMC 1 1 11 20639 5 2 1 HEC CMD C -1.622 3.448 -3.238 1.00 . E A . 111 HEC CMD 1 1 11 20640 5 2 1 HEC FE FE -1.658 1.583 -8.562 1.00 . E A . 111 HEC FE 1 1 11 20641 5 2 1 HEC HAA1 H 0.553 6.953 -10.740 1.00 . E A . 111 HEC HAA1 1 1 11 20642 5 2 1 HEC HAA2 H 1.213 6.493 -9.152 1.00 . E A . 111 HEC HAA2 1 1 11 20643 5 2 1 HEC HAB H -3.374 -3.140 -11.474 1.00 . E A . 111 HEC HAB 1 1 11 20644 5 2 1 HEC HAC H -3.910 -0.366 -3.659 1.00 . E A . 111 HEC HAC 1 1 11 20645 5 2 1 HEC HAD1 H 0.433 5.382 -3.950 1.00 . E A . 111 HEC HAD1 1 1 11 20646 5 2 1 HEC HAD2 H 0.876 5.792 -5.624 1.00 . E A . 111 HEC HAD2 1 1 11 20647 5 2 1 HEC HBA1 H 3.270 5.991 -9.997 1.00 . E A . 111 HEC HBA1 1 1 11 20648 5 2 1 HEC HBA2 H 2.632 5.524 -11.591 1.00 . E A . 111 HEC HBA2 1 1 11 20649 5 2 1 HEC HBB1 H -0.951 -3.677 -10.742 1.00 . E A . 111 HEC HBB1 1 1 11 20650 5 2 1 HEC HBB2 H -1.850 -4.868 -11.712 1.00 . E A . 111 HEC HBB2 1 1 11 20651 5 2 1 HEC HBB3 H -0.630 -3.829 -12.486 1.00 . E A . 111 HEC HBB3 1 1 11 20652 5 2 1 HEC HBC1 H -5.075 -3.064 -4.122 1.00 . E A . 111 HEC HBC1 1 1 11 20653 5 2 1 HEC HBC2 H -3.307 -2.894 -4.245 1.00 . E A . 111 HEC HBC2 1 1 11 20654 5 2 1 HEC HBC3 H -4.144 -2.428 -2.744 1.00 . E A . 111 HEC HBC3 1 1 11 20655 5 2 1 HEC HBD1 H -1.240 7.034 -5.859 1.00 . E A . 111 HEC HBD1 1 1 11 20656 5 2 1 HEC HBD2 H -1.629 6.660 -4.163 1.00 . E A . 111 HEC HBD2 1 1 11 20657 5 2 1 HEC HHA H 0.365 5.547 -7.674 1.00 . E A . 111 HEC HHA 1 1 11 20658 5 2 1 HEC HHB H -0.592 2.022 -12.944 1.00 . E A . 111 HEC HHB 1 1 11 20659 5 2 1 HEC HHC H -3.262 -2.596 -9.393 1.00 . E A . 111 HEC HHC 1 1 11 20660 5 2 1 HEC HHD H -3.049 1.343 -4.250 1.00 . E A . 111 HEC HHD 1 1 11 20661 5 2 1 HEC HMA1 H 0.971 5.483 -12.903 1.00 . E A . 111 HEC HMA1 1 1 11 20662 5 2 1 HEC HMA2 H 1.596 3.826 -13.077 1.00 . E A . 111 HEC HMA2 1 1 11 20663 5 2 1 HEC HMA3 H -0.091 4.190 -13.510 1.00 . E A . 111 HEC HMA3 1 1 11 20664 5 2 1 HEC HMB1 H -0.860 -1.602 -14.015 1.00 . E A . 111 HEC HMB1 1 1 11 20665 5 2 1 HEC HMB2 H -1.826 -0.157 -14.399 1.00 . E A . 111 HEC HMB2 1 1 11 20666 5 2 1 HEC HMB3 H -0.133 0.017 -13.877 1.00 . E A . 111 HEC HMB3 1 1 11 20667 5 2 1 HEC HMC1 H -4.507 -3.338 -7.937 1.00 . E A . 111 HEC HMC1 1 1 11 20668 5 2 1 HEC HMC2 H -4.230 -3.644 -6.205 1.00 . E A . 111 HEC HMC2 1 1 11 20669 5 2 1 HEC HMC3 H -5.696 -2.783 -6.734 1.00 . E A . 111 HEC HMC3 1 1 11 20670 5 2 1 HEC HMD1 H -2.343 4.223 -2.981 1.00 . E A . 111 HEC HMD1 1 1 11 20671 5 2 1 HEC HMD2 H -2.012 2.475 -2.938 1.00 . E A . 111 HEC HMD2 1 1 11 20672 5 2 1 HEC HMD3 H -0.683 3.638 -2.718 1.00 . E A . 111 HEC HMD3 1 1 11 20673 5 2 1 HEC NA N -0.648 2.946 -9.649 1.00 . E A . 111 HEC NA 1 1 11 20674 5 2 1 HEC NB N -1.868 0.422 -10.215 1.00 . E A . 111 HEC NB 1 1 11 20675 5 2 1 HEC NC N -2.625 0.198 -7.449 1.00 . E A . 111 HEC NC 1 1 11 20676 5 2 1 HEC ND N -1.492 2.768 -6.934 1.00 . E A . 111 HEC ND 1 1 11 20677 5 2 1 HEC O1A O 1.961 8.264 -11.862 1.00 . E A . 111 HEC O1A 1 1 11 20678 5 2 1 HEC O1D O -0.138 8.385 -3.234 1.00 . E A . 111 HEC O1D 1 1 11 20679 5 2 1 HEC O2A O 4.065 8.022 -11.174 1.00 . E A . 111 HEC O2A 1 1 11 20680 5 2 1 HEC O2D O 0.733 8.563 -5.276 1.00 . E A . 111 HEC O2D 1 1 12 20681 1 1 1 ALA C C -1.562 4.047 21.025 1.00 . A A . 1 ALA C 1 1 12 20682 1 1 1 ALA CA C -0.461 3.205 21.674 1.00 . A A . 1 ALA CA 1 1 12 20683 1 1 1 ALA CB C -0.206 1.898 20.921 1.00 . A A . 1 ALA CB 1 1 12 20684 1 1 1 ALA H1 H -1.838 2.970 23.148 1.00 . A A . 1 ALA H1 1 1 12 20685 1 1 1 ALA H2 H -0.523 1.972 23.286 1.00 . A A . 1 ALA H2 1 1 12 20686 1 1 1 ALA HA H 0.462 3.784 21.696 1.00 . A A . 1 ALA HA 1 1 12 20687 1 1 1 ALA HB1 H 0.409 1.240 21.534 1.00 . A A . 1 ALA HB1 1 1 12 20688 1 1 1 ALA HB2 H -1.156 1.412 20.705 1.00 . A A . 1 ALA HB2 1 1 12 20689 1 1 1 ALA HB3 H 0.313 2.114 19.986 1.00 . A A . 1 ALA HB3 1 1 12 20690 1 1 1 ALA N N -0.830 2.909 23.048 1.00 . A A . 1 ALA N 1 1 12 20691 1 1 1 ALA O O -2.705 4.036 21.478 1.00 . A A . 1 ALA O 1 1 12 20692 1 1 2 PRO C C -3.049 4.783 18.364 1.00 . A A . 2 PRO C 1 1 12 20693 1 1 2 PRO CA C -2.107 5.621 19.231 1.00 . A A . 2 PRO CA 1 1 12 20694 1 1 2 PRO CB C -1.242 6.572 18.419 1.00 . A A . 2 PRO CB 1 1 12 20695 1 1 2 PRO CD C 0.178 4.813 19.382 1.00 . A A . 2 PRO CD 1 1 12 20696 1 1 2 PRO CG C 0.132 5.927 18.349 1.00 . A A . 2 PRO CG 1 1 12 20697 1 1 2 PRO HA H -2.693 6.112 19.875 1.00 . A A . 2 PRO HA 1 1 12 20698 1 1 2 PRO HB2 H -1.655 6.721 17.422 1.00 . A A . 2 PRO HB2 1 1 12 20699 1 1 2 PRO HB3 H -1.190 7.552 18.893 1.00 . A A . 2 PRO HB3 1 1 12 20700 1 1 2 PRO HD2 H 0.443 3.859 18.924 1.00 . A A . 2 PRO HD2 1 1 12 20701 1 1 2 PRO HD3 H 0.925 5.016 20.150 1.00 . A A . 2 PRO HD3 1 1 12 20702 1 1 2 PRO HG2 H 0.317 5.530 17.351 1.00 . A A . 2 PRO HG2 1 1 12 20703 1 1 2 PRO HG3 H 0.911 6.664 18.547 1.00 . A A . 2 PRO HG3 1 1 12 20704 1 1 2 PRO N N -1.167 4.775 19.946 1.00 . A A . 2 PRO N 1 1 12 20705 1 1 2 PRO O O -2.636 3.781 17.782 1.00 . A A . 2 PRO O 1 1 12 20706 1 1 3 LYS C C -5.112 4.866 16.041 1.00 . A A . 3 LYS C 1 1 12 20707 1 1 3 LYS CA C -5.301 4.526 17.520 1.00 . A A . 3 LYS CA 1 1 12 20708 1 1 3 LYS CB C -6.704 4.835 18.048 1.00 . A A . 3 LYS CB 1 1 12 20709 1 1 3 LYS CD C -8.556 6.544 18.139 1.00 . A A . 3 LYS CD 1 1 12 20710 1 1 3 LYS CE C -9.036 7.901 17.620 1.00 . A A . 3 LYS CE 1 1 12 20711 1 1 3 LYS CG C -7.117 6.267 17.700 1.00 . A A . 3 LYS CG 1 1 12 20712 1 1 3 LYS H H -4.625 6.040 18.782 1.00 . A A . 3 LYS H 1 1 12 20713 1 1 3 LYS HA H -5.135 3.457 17.653 1.00 . A A . 3 LYS HA 1 1 12 20714 1 1 3 LYS HB2 H -7.420 4.133 17.621 1.00 . A A . 3 LYS HB2 1 1 12 20715 1 1 3 LYS HB3 H -6.729 4.698 19.128 1.00 . A A . 3 LYS HB3 1 1 12 20716 1 1 3 LYS HD2 H -9.212 5.756 17.768 1.00 . A A . 3 LYS HD2 1 1 12 20717 1 1 3 LYS HD3 H -8.619 6.524 19.227 1.00 . A A . 3 LYS HD3 1 1 12 20718 1 1 3 LYS HE2 H -8.206 8.607 17.609 1.00 . A A . 3 LYS HE2 1 1 12 20719 1 1 3 LYS HE3 H -9.383 7.802 16.592 1.00 . A A . 3 LYS HE3 1 1 12 20720 1 1 3 LYS HG2 H -6.443 6.972 18.187 1.00 . A A . 3 LYS HG2 1 1 12 20721 1 1 3 LYS HG3 H -7.023 6.426 16.626 1.00 . A A . 3 LYS HG3 1 1 12 20722 1 1 3 LYS HZ1 H -10.534 9.272 18.089 1.00 . A A . 3 LYS HZ1 1 1 12 20723 1 1 3 LYS HZ2 H -10.885 7.757 18.570 1.00 . A A . 3 LYS HZ2 1 1 12 20724 1 1 3 LYS N N -4.297 5.224 18.306 1.00 . A A . 3 LYS N 1 1 12 20725 1 1 3 LYS NZ N -10.129 8.425 18.470 1.00 . A A . 3 LYS NZ 1 1 12 20726 1 1 3 LYS O O -4.417 5.824 15.704 1.00 . A A . 3 LYS O 1 1 12 20727 1 1 4 ALA C C -6.305 5.602 13.397 1.00 . A A . 4 ALA C 1 1 12 20728 1 1 4 ALA CA C -5.652 4.267 13.760 1.00 . A A . 4 ALA CA 1 1 12 20729 1 1 4 ALA CB C -6.298 3.085 13.035 1.00 . A A . 4 ALA CB 1 1 12 20730 1 1 4 ALA H H -6.306 3.287 15.478 1.00 . A A . 4 ALA H 1 1 12 20731 1 1 4 ALA HA H -4.595 4.305 13.497 1.00 . A A . 4 ALA HA 1 1 12 20732 1 1 4 ALA HB1 H -6.654 2.360 13.767 1.00 . A A . 4 ALA HB1 1 1 12 20733 1 1 4 ALA HB2 H -7.137 3.440 12.438 1.00 . A A . 4 ALA HB2 1 1 12 20734 1 1 4 ALA HB3 H -5.562 2.612 12.384 1.00 . A A . 4 ALA HB3 1 1 12 20735 1 1 4 ALA N N -5.742 4.063 15.196 1.00 . A A . 4 ALA N 1 1 12 20736 1 1 4 ALA O O -7.173 6.089 14.119 1.00 . A A . 4 ALA O 1 1 12 20737 1 1 5 PRO C C -7.779 7.260 11.180 1.00 . A A . 5 PRO C 1 1 12 20738 1 1 5 PRO CA C -6.382 7.438 11.779 1.00 . A A . 5 PRO CA 1 1 12 20739 1 1 5 PRO CB C -5.363 7.943 10.770 1.00 . A A . 5 PRO CB 1 1 12 20740 1 1 5 PRO CD C -4.824 5.620 11.366 1.00 . A A . 5 PRO CD 1 1 12 20741 1 1 5 PRO CG C -4.540 6.730 10.367 1.00 . A A . 5 PRO CG 1 1 12 20742 1 1 5 PRO HA H -6.491 8.072 12.544 1.00 . A A . 5 PRO HA 1 1 12 20743 1 1 5 PRO HB2 H -5.856 8.385 9.905 1.00 . A A . 5 PRO HB2 1 1 12 20744 1 1 5 PRO HB3 H -4.731 8.716 11.207 1.00 . A A . 5 PRO HB3 1 1 12 20745 1 1 5 PRO HD2 H -5.173 4.717 10.867 1.00 . A A . 5 PRO HD2 1 1 12 20746 1 1 5 PRO HD3 H -3.927 5.350 11.924 1.00 . A A . 5 PRO HD3 1 1 12 20747 1 1 5 PRO HG2 H -4.800 6.410 9.358 1.00 . A A . 5 PRO HG2 1 1 12 20748 1 1 5 PRO HG3 H -3.478 6.974 10.360 1.00 . A A . 5 PRO HG3 1 1 12 20749 1 1 5 PRO N N -5.851 6.169 12.247 1.00 . A A . 5 PRO N 1 1 12 20750 1 1 5 PRO O O -8.173 6.148 10.835 1.00 . A A . 5 PRO O 1 1 12 20751 1 1 6 ALA C C -9.802 7.714 9.136 1.00 . A A . 6 ALA C 1 1 12 20752 1 1 6 ALA CA C -9.833 8.356 10.524 1.00 . A A . 6 ALA CA 1 1 12 20753 1 1 6 ALA CB C -10.393 9.779 10.497 1.00 . A A . 6 ALA CB 1 1 12 20754 1 1 6 ALA H H -8.160 9.276 11.358 1.00 . A A . 6 ALA H 1 1 12 20755 1 1 6 ALA HA H -10.453 7.747 11.183 1.00 . A A . 6 ALA HA 1 1 12 20756 1 1 6 ALA HB1 H -10.211 10.260 11.458 1.00 . A A . 6 ALA HB1 1 1 12 20757 1 1 6 ALA HB2 H -9.903 10.348 9.707 1.00 . A A . 6 ALA HB2 1 1 12 20758 1 1 6 ALA HB3 H -11.466 9.744 10.306 1.00 . A A . 6 ALA HB3 1 1 12 20759 1 1 6 ALA N N -8.488 8.374 11.075 1.00 . A A . 6 ALA N 1 1 12 20760 1 1 6 ALA O O -8.785 7.155 8.729 1.00 . A A . 6 ALA O 1 1 12 20761 1 1 7 ASP C C -10.912 8.374 6.077 1.00 . A A . 7 ASP C 1 1 12 20762 1 1 7 ASP CA C -11.043 7.254 7.111 1.00 . A A . 7 ASP CA 1 1 12 20763 1 1 7 ASP CB C -12.403 6.583 6.912 1.00 . A A . 7 ASP CB 1 1 12 20764 1 1 7 ASP CG C -13.584 7.310 7.558 1.00 . A A . 7 ASP CG 1 1 12 20765 1 1 7 ASP H H -11.751 8.275 8.784 1.00 . A A . 7 ASP H 1 1 12 20766 1 1 7 ASP HA H -10.238 6.523 7.039 1.00 . A A . 7 ASP HA 1 1 12 20767 1 1 7 ASP HB2 H -12.593 6.492 5.843 1.00 . A A . 7 ASP HB2 1 1 12 20768 1 1 7 ASP HB3 H -12.355 5.571 7.314 1.00 . A A . 7 ASP HB3 1 1 12 20769 1 1 7 ASP N N -10.928 7.818 8.446 1.00 . A A . 7 ASP N 1 1 12 20770 1 1 7 ASP O O -10.925 9.553 6.428 1.00 . A A . 7 ASP O 1 1 12 20771 1 1 7 ASP OD1 O -13.615 8.555 7.444 1.00 . A A . 7 ASP OD1 1 1 12 20772 1 1 7 ASP OD2 O -14.429 6.606 8.151 1.00 . A A . 7 ASP OD2 1 1 12 20773 1 1 8 GLY C C -9.186 9.274 3.494 1.00 . A A . 8 GLY C 1 1 12 20774 1 1 8 GLY CA C -10.655 8.920 3.735 1.00 . A A . 8 GLY CA 1 1 12 20775 1 1 8 GLY H H -10.780 7.005 4.545 1.00 . A A . 8 GLY H 1 1 12 20776 1 1 8 GLY HA2 H -11.086 8.502 2.825 1.00 . A A . 8 GLY HA2 1 1 12 20777 1 1 8 GLY HA3 H -11.218 9.823 3.968 1.00 . A A . 8 GLY HA3 1 1 12 20778 1 1 8 GLY N N -10.789 7.965 4.823 1.00 . A A . 8 GLY N 1 1 12 20779 1 1 8 GLY O O -8.883 10.214 2.760 1.00 . A A . 8 GLY O 1 1 12 20780 1 1 9 LEU C C -6.424 8.233 2.617 1.00 . A A . 9 LEU C 1 1 12 20781 1 1 9 LEU CA C -6.884 8.726 3.991 1.00 . A A . 9 LEU CA 1 1 12 20782 1 1 9 LEU CB C -6.129 8.086 5.158 1.00 . A A . 9 LEU CB 1 1 12 20783 1 1 9 LEU CD1 C -4.125 6.906 4.184 1.00 . A A . 9 LEU CD1 1 1 12 20784 1 1 9 LEU CD2 C -4.083 9.419 4.528 1.00 . A A . 9 LEU CD2 1 1 12 20785 1 1 9 LEU CG C -4.603 8.076 5.045 1.00 . A A . 9 LEU CG 1 1 12 20786 1 1 9 LEU H H -8.568 7.742 4.722 1.00 . A A . 9 LEU H 1 1 12 20787 1 1 9 LEU HA H -6.713 9.801 4.048 1.00 . A A . 9 LEU HA 1 1 12 20788 1 1 9 LEU HB2 H -6.403 8.611 6.073 1.00 . A A . 9 LEU HB2 1 1 12 20789 1 1 9 LEU HB3 H -6.472 7.057 5.266 1.00 . A A . 9 LEU HB3 1 1 12 20790 1 1 9 LEU HD11 H -4.895 6.135 4.158 1.00 . A A . 9 LEU HD11 1 1 12 20791 1 1 9 LEU HD12 H -3.927 7.257 3.171 1.00 . A A . 9 LEU HD12 1 1 12 20792 1 1 9 LEU HD13 H -3.211 6.491 4.610 1.00 . A A . 9 LEU HD13 1 1 12 20793 1 1 9 LEU HD21 H -4.604 9.680 3.607 1.00 . A A . 9 LEU HD21 1 1 12 20794 1 1 9 LEU HD22 H -4.261 10.190 5.277 1.00 . A A . 9 LEU HD22 1 1 12 20795 1 1 9 LEU HD23 H -3.014 9.343 4.332 1.00 . A A . 9 LEU HD23 1 1 12 20796 1 1 9 LEU HG H -4.188 7.933 6.043 1.00 . A A . 9 LEU HG 1 1 12 20797 1 1 9 LEU N N -8.313 8.504 4.127 1.00 . A A . 9 LEU N 1 1 12 20798 1 1 9 LEU O O -6.156 7.047 2.437 1.00 . A A . 9 LEU O 1 1 12 20799 1 1 10 LYS C C -4.513 9.390 0.099 1.00 . A A . 10 LYS C 1 1 12 20800 1 1 10 LYS CA C -5.924 8.847 0.332 1.00 . A A . 10 LYS CA 1 1 12 20801 1 1 10 LYS CB C -6.951 9.348 -0.685 1.00 . A A . 10 LYS CB 1 1 12 20802 1 1 10 LYS CD C -8.042 11.533 -0.055 1.00 . A A . 10 LYS CD 1 1 12 20803 1 1 10 LYS CE C -9.080 12.111 -1.019 1.00 . A A . 10 LYS CE 1 1 12 20804 1 1 10 LYS CG C -6.893 10.872 -0.818 1.00 . A A . 10 LYS CG 1 1 12 20805 1 1 10 LYS H H -6.566 10.134 1.839 1.00 . A A . 10 LYS H 1 1 12 20806 1 1 10 LYS HA H -5.894 7.760 0.250 1.00 . A A . 10 LYS HA 1 1 12 20807 1 1 10 LYS HB2 H -6.764 8.888 -1.655 1.00 . A A . 10 LYS HB2 1 1 12 20808 1 1 10 LYS HB3 H -7.952 9.045 -0.377 1.00 . A A . 10 LYS HB3 1 1 12 20809 1 1 10 LYS HD2 H -8.516 10.803 0.601 1.00 . A A . 10 LYS HD2 1 1 12 20810 1 1 10 LYS HD3 H -7.651 12.326 0.582 1.00 . A A . 10 LYS HD3 1 1 12 20811 1 1 10 LYS HE2 H -9.462 13.054 -0.629 1.00 . A A . 10 LYS HE2 1 1 12 20812 1 1 10 LYS HE3 H -8.612 12.328 -1.979 1.00 . A A . 10 LYS HE3 1 1 12 20813 1 1 10 LYS HG2 H -5.940 11.237 -0.436 1.00 . A A . 10 LYS HG2 1 1 12 20814 1 1 10 LYS HG3 H -6.942 11.151 -1.870 1.00 . A A . 10 LYS HG3 1 1 12 20815 1 1 10 LYS HZ1 H -10.022 10.516 -1.974 1.00 . A A . 10 LYS HZ1 1 1 12 20816 1 1 10 LYS HZ2 H -10.359 10.593 -0.383 1.00 . A A . 10 LYS HZ2 1 1 12 20817 1 1 10 LYS N N -6.347 9.170 1.684 1.00 . A A . 10 LYS N 1 1 12 20818 1 1 10 LYS NZ N -10.197 11.158 -1.209 1.00 . A A . 10 LYS NZ 1 1 12 20819 1 1 10 LYS O O -4.063 10.286 0.812 1.00 . A A . 10 LYS O 1 1 12 20820 1 1 11 MET C C -2.468 9.959 -2.587 1.00 . A A . 11 MET C 1 1 12 20821 1 1 11 MET CA C -2.502 9.240 -1.236 1.00 . A A . 11 MET CA 1 1 12 20822 1 1 11 MET CB C -1.588 8.014 -1.287 1.00 . A A . 11 MET CB 1 1 12 20823 1 1 11 MET CE C -0.850 4.546 -0.542 1.00 . A A . 11 MET CE 1 1 12 20824 1 1 11 MET CG C -1.926 7.032 -0.164 1.00 . A A . 11 MET CG 1 1 12 20825 1 1 11 MET H H -4.226 8.096 -1.477 1.00 . A A . 11 MET H 1 1 12 20826 1 1 11 MET HA H -2.202 9.927 -0.444 1.00 . A A . 11 MET HA 1 1 12 20827 1 1 11 MET HB2 H -1.692 7.519 -2.252 1.00 . A A . 11 MET HB2 1 1 12 20828 1 1 11 MET HB3 H -0.548 8.328 -1.200 1.00 . A A . 11 MET HB3 1 1 12 20829 1 1 11 MET HE1 H -0.443 4.844 0.424 1.00 . A A . 11 MET HE1 1 1 12 20830 1 1 11 MET HE2 H -1.058 3.476 -0.534 1.00 . A A . 11 MET HE2 1 1 12 20831 1 1 11 MET HE3 H -0.127 4.769 -1.326 1.00 . A A . 11 MET HE3 1 1 12 20832 1 1 11 MET HG2 H -1.073 6.925 0.506 1.00 . A A . 11 MET HG2 1 1 12 20833 1 1 11 MET HG3 H -2.753 7.418 0.432 1.00 . A A . 11 MET HG3 1 1 12 20834 1 1 11 MET N N -3.853 8.824 -0.901 1.00 . A A . 11 MET N 1 1 12 20835 1 1 11 MET O O -3.028 9.470 -3.568 1.00 . A A . 11 MET O 1 1 12 20836 1 1 11 MET SD S -2.361 5.444 -0.853 1.00 . A A . 11 MET SD 1 1 12 20837 1 1 12 GLU C C -0.230 12.259 -4.071 1.00 . A A . 12 GLU C 1 1 12 20838 1 1 12 GLU CA C -1.694 11.897 -3.808 1.00 . A A . 12 GLU CA 1 1 12 20839 1 1 12 GLU CB C -2.562 13.154 -3.727 1.00 . A A . 12 GLU CB 1 1 12 20840 1 1 12 GLU CD C -1.523 15.384 -4.279 1.00 . A A . 12 GLU CD 1 1 12 20841 1 1 12 GLU CG C -2.208 14.138 -4.844 1.00 . A A . 12 GLU CG 1 1 12 20842 1 1 12 GLU H H -1.355 11.497 -1.792 1.00 . A A . 12 GLU H 1 1 12 20843 1 1 12 GLU HA H -2.066 11.256 -4.607 1.00 . A A . 12 GLU HA 1 1 12 20844 1 1 12 GLU HB2 H -3.615 12.878 -3.800 1.00 . A A . 12 GLU HB2 1 1 12 20845 1 1 12 GLU HB3 H -2.426 13.633 -2.758 1.00 . A A . 12 GLU HB3 1 1 12 20846 1 1 12 GLU HG2 H -1.552 13.653 -5.566 1.00 . A A . 12 GLU HG2 1 1 12 20847 1 1 12 GLU HG3 H -3.113 14.427 -5.378 1.00 . A A . 12 GLU HG3 1 1 12 20848 1 1 12 GLU N N -1.807 11.107 -2.594 1.00 . A A . 12 GLU N 1 1 12 20849 1 1 12 GLU O O 0.135 13.433 -4.058 1.00 . A A . 12 GLU O 1 1 12 20850 1 1 12 GLU OE1 O -2.108 15.983 -3.352 1.00 . A A . 12 GLU OE1 1 1 12 20851 1 1 12 GLU OE2 O -0.428 15.709 -4.788 1.00 . A A . 12 GLU OE2 1 1 12 20852 1 1 13 ALA C C 2.252 11.210 -6.061 1.00 . A A . 13 ALA C 1 1 12 20853 1 1 13 ALA CA C 1.983 11.421 -4.570 1.00 . A A . 13 ALA CA 1 1 12 20854 1 1 13 ALA CB C 2.802 10.475 -3.690 1.00 . A A . 13 ALA CB 1 1 12 20855 1 1 13 ALA H H 0.263 10.275 -4.314 1.00 . A A . 13 ALA H 1 1 12 20856 1 1 13 ALA HA H 2.233 12.449 -4.307 1.00 . A A . 13 ALA HA 1 1 12 20857 1 1 13 ALA HB1 H 2.469 10.560 -2.656 1.00 . A A . 13 ALA HB1 1 1 12 20858 1 1 13 ALA HB2 H 2.664 9.449 -4.033 1.00 . A A . 13 ALA HB2 1 1 12 20859 1 1 13 ALA HB3 H 3.858 10.740 -3.755 1.00 . A A . 13 ALA HB3 1 1 12 20860 1 1 13 ALA N N 0.568 11.227 -4.304 1.00 . A A . 13 ALA N 1 1 12 20861 1 1 13 ALA O O 3.292 11.621 -6.573 1.00 . A A . 13 ALA O 1 1 12 20862 1 1 14 THR C C 0.173 10.789 -8.883 1.00 . A A . 14 THR C 1 1 12 20863 1 1 14 THR CA C 1.416 10.296 -8.139 1.00 . A A . 14 THR CA 1 1 12 20864 1 1 14 THR CB C 1.675 8.798 -8.314 1.00 . A A . 14 THR CB 1 1 12 20865 1 1 14 THR CG2 C 2.527 8.215 -7.185 1.00 . A A . 14 THR CG2 1 1 12 20866 1 1 14 THR H H 0.453 10.236 -6.293 1.00 . A A . 14 THR H 1 1 12 20867 1 1 14 THR HA H 2.265 10.860 -8.526 1.00 . A A . 14 THR HA 1 1 12 20868 1 1 14 THR HB H 2.122 8.592 -9.286 1.00 . A A . 14 THR HB 1 1 12 20869 1 1 14 THR HG1 H -0.049 8.590 -7.319 1.00 . A A . 14 THR HG1 1 1 12 20870 1 1 14 THR HG21 H 3.030 9.024 -6.655 1.00 . A A . 14 THR HG21 1 1 12 20871 1 1 14 THR HG22 H 1.888 7.668 -6.492 1.00 . A A . 14 THR HG22 1 1 12 20872 1 1 14 THR HG23 H 3.272 7.539 -7.605 1.00 . A A . 14 THR HG23 1 1 12 20873 1 1 14 THR N N 1.296 10.568 -6.717 1.00 . A A . 14 THR N 1 1 12 20874 1 1 14 THR O O -0.766 11.290 -8.267 1.00 . A A . 14 THR O 1 1 12 20875 1 1 14 THR OG1 O 0.395 8.200 -8.126 1.00 . A A . 14 THR OG1 1 1 12 20876 1 1 15 LYS C C -2.095 10.123 -10.798 1.00 . A A . 15 LYS C 1 1 12 20877 1 1 15 LYS CA C -0.903 11.053 -11.033 1.00 . A A . 15 LYS CA 1 1 12 20878 1 1 15 LYS CB C -0.470 11.140 -12.498 1.00 . A A . 15 LYS CB 1 1 12 20879 1 1 15 LYS CD C -0.859 12.968 -14.191 1.00 . A A . 15 LYS CD 1 1 12 20880 1 1 15 LYS CE C -1.689 14.253 -14.177 1.00 . A A . 15 LYS CE 1 1 12 20881 1 1 15 LYS CG C -1.514 11.882 -13.335 1.00 . A A . 15 LYS CG 1 1 12 20882 1 1 15 LYS H H 0.976 10.222 -10.692 1.00 . A A . 15 LYS H 1 1 12 20883 1 1 15 LYS HA H -1.183 12.059 -10.719 1.00 . A A . 15 LYS HA 1 1 12 20884 1 1 15 LYS HB2 H 0.489 11.652 -12.568 1.00 . A A . 15 LYS HB2 1 1 12 20885 1 1 15 LYS HB3 H -0.325 10.137 -12.898 1.00 . A A . 15 LYS HB3 1 1 12 20886 1 1 15 LYS HD2 H 0.145 13.175 -13.818 1.00 . A A . 15 LYS HD2 1 1 12 20887 1 1 15 LYS HD3 H -0.750 12.612 -15.216 1.00 . A A . 15 LYS HD3 1 1 12 20888 1 1 15 LYS HE2 H -2.121 14.403 -13.187 1.00 . A A . 15 LYS HE2 1 1 12 20889 1 1 15 LYS HE3 H -1.046 15.110 -14.377 1.00 . A A . 15 LYS HE3 1 1 12 20890 1 1 15 LYS HG2 H -2.040 11.176 -13.977 1.00 . A A . 15 LYS HG2 1 1 12 20891 1 1 15 LYS HG3 H -2.259 12.332 -12.679 1.00 . A A . 15 LYS HG3 1 1 12 20892 1 1 15 LYS HZ1 H -2.659 13.387 -15.805 1.00 . A A . 15 LYS HZ1 1 1 12 20893 1 1 15 LYS HZ2 H -3.683 14.109 -14.764 1.00 . A A . 15 LYS HZ2 1 1 12 20894 1 1 15 LYS N N 0.208 10.630 -10.198 1.00 . A A . 15 LYS N 1 1 12 20895 1 1 15 LYS NZ N -2.766 14.186 -15.190 1.00 . A A . 15 LYS NZ 1 1 12 20896 1 1 15 LYS O O -3.186 10.365 -11.311 1.00 . A A . 15 LYS O 1 1 12 20897 1 1 16 GLN C C -2.965 7.884 -8.201 1.00 . A A . 16 GLN C 1 1 12 20898 1 1 16 GLN CA C -2.884 8.111 -9.712 1.00 . A A . 16 GLN CA 1 1 12 20899 1 1 16 GLN CB C -2.645 6.794 -10.453 1.00 . A A . 16 GLN CB 1 1 12 20900 1 1 16 GLN CD C -3.270 6.517 -12.880 1.00 . A A . 16 GLN CD 1 1 12 20901 1 1 16 GLN CG C -2.222 7.049 -11.901 1.00 . A A . 16 GLN CG 1 1 12 20902 1 1 16 GLN H H -0.955 8.890 -9.607 1.00 . A A . 16 GLN H 1 1 12 20903 1 1 16 GLN HA H -3.812 8.558 -10.069 1.00 . A A . 16 GLN HA 1 1 12 20904 1 1 16 GLN HB2 H -1.873 6.220 -9.940 1.00 . A A . 16 GLN HB2 1 1 12 20905 1 1 16 GLN HB3 H -3.554 6.193 -10.436 1.00 . A A . 16 GLN HB3 1 1 12 20906 1 1 16 GLN HE21 H -3.095 4.699 -12.007 1.00 . A A . 16 GLN HE21 1 1 12 20907 1 1 16 GLN HE22 H -4.229 4.788 -13.313 1.00 . A A . 16 GLN HE22 1 1 12 20908 1 1 16 GLN HG2 H -2.080 8.118 -12.059 1.00 . A A . 16 GLN HG2 1 1 12 20909 1 1 16 GLN HG3 H -1.263 6.568 -12.093 1.00 . A A . 16 GLN HG3 1 1 12 20910 1 1 16 GLN N N -1.846 9.079 -10.021 1.00 . A A . 16 GLN N 1 1 12 20911 1 1 16 GLN NE2 N -3.555 5.228 -12.720 1.00 . A A . 16 GLN NE2 1 1 12 20912 1 1 16 GLN O O -2.295 7.002 -7.666 1.00 . A A . 16 GLN O 1 1 12 20913 1 1 16 GLN OE1 O -3.787 7.230 -13.724 1.00 . A A . 16 GLN OE1 1 1 12 20914 1 1 17 PRO C C -4.845 7.398 -5.738 1.00 . A A . 17 PRO C 1 1 12 20915 1 1 17 PRO CA C -3.990 8.614 -6.100 1.00 . A A . 17 PRO CA 1 1 12 20916 1 1 17 PRO CB C -4.627 9.931 -5.688 1.00 . A A . 17 PRO CB 1 1 12 20917 1 1 17 PRO CD C -4.623 9.771 -8.140 1.00 . A A . 17 PRO CD 1 1 12 20918 1 1 17 PRO CG C -5.207 10.530 -6.959 1.00 . A A . 17 PRO CG 1 1 12 20919 1 1 17 PRO HA H -3.108 8.471 -5.651 1.00 . A A . 17 PRO HA 1 1 12 20920 1 1 17 PRO HB2 H -5.404 9.772 -4.941 1.00 . A A . 17 PRO HB2 1 1 12 20921 1 1 17 PRO HB3 H -3.889 10.599 -5.243 1.00 . A A . 17 PRO HB3 1 1 12 20922 1 1 17 PRO HD2 H -5.409 9.357 -8.771 1.00 . A A . 17 PRO HD2 1 1 12 20923 1 1 17 PRO HD3 H -4.018 10.424 -8.770 1.00 . A A . 17 PRO HD3 1 1 12 20924 1 1 17 PRO HG2 H -6.294 10.453 -6.955 1.00 . A A . 17 PRO HG2 1 1 12 20925 1 1 17 PRO HG3 H -4.962 11.590 -7.028 1.00 . A A . 17 PRO HG3 1 1 12 20926 1 1 17 PRO N N -3.813 8.716 -7.539 1.00 . A A . 17 PRO N 1 1 12 20927 1 1 17 PRO O O -5.345 6.701 -6.619 1.00 . A A . 17 PRO O 1 1 12 20928 1 1 18 VAL C C -6.276 6.374 -2.539 1.00 . A A . 18 VAL C 1 1 12 20929 1 1 18 VAL CA C -5.771 6.059 -3.948 1.00 . A A . 18 VAL CA 1 1 12 20930 1 1 18 VAL CB C -4.946 4.773 -4.015 1.00 . A A . 18 VAL CB 1 1 12 20931 1 1 18 VAL CG1 C -5.680 3.615 -3.336 1.00 . A A . 18 VAL CG1 1 1 12 20932 1 1 18 VAL CG2 C -4.591 4.424 -5.462 1.00 . A A . 18 VAL CG2 1 1 12 20933 1 1 18 VAL H H -4.576 7.751 -3.728 1.00 . A A . 18 VAL H 1 1 12 20934 1 1 18 VAL HA H -6.629 5.945 -4.611 1.00 . A A . 18 VAL HA 1 1 12 20935 1 1 18 VAL HB H -4.015 4.943 -3.474 1.00 . A A . 18 VAL HB 1 1 12 20936 1 1 18 VAL HG11 H -6.049 3.940 -2.363 1.00 . A A . 18 VAL HG11 1 1 12 20937 1 1 18 VAL HG12 H -6.518 3.302 -3.957 1.00 . A A . 18 VAL HG12 1 1 12 20938 1 1 18 VAL HG13 H -4.994 2.779 -3.202 1.00 . A A . 18 VAL HG13 1 1 12 20939 1 1 18 VAL HG21 H -5.486 4.487 -6.081 1.00 . A A . 18 VAL HG21 1 1 12 20940 1 1 18 VAL HG22 H -3.843 5.124 -5.832 1.00 . A A . 18 VAL HG22 1 1 12 20941 1 1 18 VAL HG23 H -4.192 3.410 -5.504 1.00 . A A . 18 VAL HG23 1 1 12 20942 1 1 18 VAL N N -4.986 7.180 -4.438 1.00 . A A . 18 VAL N 1 1 12 20943 1 1 18 VAL O O -5.595 7.050 -1.769 1.00 . A A . 18 VAL O 1 1 12 20944 1 1 19 VAL C C -7.980 4.798 -0.120 1.00 . A A . 19 VAL C 1 1 12 20945 1 1 19 VAL CA C -8.067 6.086 -0.940 1.00 . A A . 19 VAL CA 1 1 12 20946 1 1 19 VAL CB C -9.501 6.594 -1.105 1.00 . A A . 19 VAL CB 1 1 12 20947 1 1 19 VAL CG1 C -10.222 6.650 0.243 1.00 . A A . 19 VAL CG1 1 1 12 20948 1 1 19 VAL CG2 C -9.523 7.958 -1.797 1.00 . A A . 19 VAL CG2 1 1 12 20949 1 1 19 VAL H H -8.010 5.318 -2.875 1.00 . A A . 19 VAL H 1 1 12 20950 1 1 19 VAL HA H -7.491 6.862 -0.436 1.00 . A A . 19 VAL HA 1 1 12 20951 1 1 19 VAL HB H -10.035 5.888 -1.741 1.00 . A A . 19 VAL HB 1 1 12 20952 1 1 19 VAL HG11 H -9.613 7.205 0.957 1.00 . A A . 19 VAL HG11 1 1 12 20953 1 1 19 VAL HG12 H -11.184 7.149 0.121 1.00 . A A . 19 VAL HG12 1 1 12 20954 1 1 19 VAL HG13 H -10.382 5.637 0.612 1.00 . A A . 19 VAL HG13 1 1 12 20955 1 1 19 VAL HG21 H -8.536 8.175 -2.204 1.00 . A A . 19 VAL HG21 1 1 12 20956 1 1 19 VAL HG22 H -10.255 7.945 -2.604 1.00 . A A . 19 VAL HG22 1 1 12 20957 1 1 19 VAL HG23 H -9.795 8.728 -1.073 1.00 . A A . 19 VAL HG23 1 1 12 20958 1 1 19 VAL N N -7.464 5.868 -2.243 1.00 . A A . 19 VAL N 1 1 12 20959 1 1 19 VAL O O -8.571 3.783 -0.486 1.00 . A A . 19 VAL O 1 1 12 20960 1 1 20 PHE C C -7.991 3.825 3.065 1.00 . A A . 20 PHE C 1 1 12 20961 1 1 20 PHE CA C -7.066 3.732 1.850 1.00 . A A . 20 PHE CA 1 1 12 20962 1 1 20 PHE CB C -5.613 3.779 2.326 1.00 . A A . 20 PHE CB 1 1 12 20963 1 1 20 PHE CD1 C -4.860 1.380 2.515 1.00 . A A . 20 PHE CD1 1 1 12 20964 1 1 20 PHE CD2 C -5.132 2.645 4.525 1.00 . A A . 20 PHE CD2 1 1 12 20965 1 1 20 PHE CE1 C -4.460 0.234 3.289 1.00 . A A . 20 PHE CE1 1 1 12 20966 1 1 20 PHE CE2 C -4.732 1.498 5.300 1.00 . A A . 20 PHE CE2 1 1 12 20967 1 1 20 PHE CG C -5.188 2.562 3.149 1.00 . A A . 20 PHE CG 1 1 12 20968 1 1 20 PHE CZ C -4.415 0.350 4.644 1.00 . A A . 20 PHE CZ 1 1 12 20969 1 1 20 PHE H H -6.761 5.708 1.266 1.00 . A A . 20 PHE H 1 1 12 20970 1 1 20 PHE HA H -7.313 2.836 1.282 1.00 . A A . 20 PHE HA 1 1 12 20971 1 1 20 PHE HB2 H -4.959 3.864 1.457 1.00 . A A . 20 PHE HB2 1 1 12 20972 1 1 20 PHE HB3 H -5.466 4.679 2.924 1.00 . A A . 20 PHE HB3 1 1 12 20973 1 1 20 PHE HD1 H -4.904 1.315 1.428 1.00 . A A . 20 PHE HD1 1 1 12 20974 1 1 20 PHE HD2 H -5.391 3.578 5.026 1.00 . A A . 20 PHE HD2 1 1 12 20975 1 1 20 PHE HE1 H -4.198 -0.704 2.801 1.00 . A A . 20 PHE HE1 1 1 12 20976 1 1 20 PHE HE2 H -4.683 1.550 6.388 1.00 . A A . 20 PHE HE2 1 1 12 20977 1 1 20 PHE HZ H -4.139 -0.488 5.333 1.00 . A A . 20 PHE HZ 1 1 12 20978 1 1 20 PHE N N -7.238 4.879 0.975 1.00 . A A . 20 PHE N 1 1 12 20979 1 1 20 PHE O O -8.651 4.843 3.271 1.00 . A A . 20 PHE O 1 1 12 20980 1 1 21 ASN C C -8.197 1.769 6.057 1.00 . A A . 21 ASN C 1 1 12 20981 1 1 21 ASN CA C -8.844 2.697 5.027 1.00 . A A . 21 ASN CA 1 1 12 20982 1 1 21 ASN CB C -10.233 2.146 4.701 1.00 . A A . 21 ASN CB 1 1 12 20983 1 1 21 ASN CG C -11.004 3.104 3.791 1.00 . A A . 21 ASN CG 1 1 12 20984 1 1 21 ASN H H -7.470 1.926 3.664 1.00 . A A . 21 ASN H 1 1 12 20985 1 1 21 ASN HA H -8.909 3.727 5.376 1.00 . A A . 21 ASN HA 1 1 12 20986 1 1 21 ASN HB2 H -10.139 1.174 4.215 1.00 . A A . 21 ASN HB2 1 1 12 20987 1 1 21 ASN HB3 H -10.791 1.987 5.624 1.00 . A A . 21 ASN HB3 1 1 12 20988 1 1 21 ASN HD21 H -11.454 4.216 5.422 1.00 . A A . 21 ASN HD21 1 1 12 20989 1 1 21 ASN HD22 H -12.086 4.811 3.922 1.00 . A A . 21 ASN HD22 1 1 12 20990 1 1 21 ASN N N -8.010 2.749 3.838 1.00 . A A . 21 ASN N 1 1 12 20991 1 1 21 ASN ND2 N -11.561 4.128 4.431 1.00 . A A . 21 ASN ND2 1 1 12 20992 1 1 21 ASN O O -7.584 0.765 5.696 1.00 . A A . 21 ASN O 1 1 12 20993 1 1 21 ASN OD1 O -11.087 2.926 2.587 1.00 . A A . 21 ASN OD1 1 1 12 20994 1 1 22 HIS C C -8.886 0.473 9.021 1.00 . A A . 22 HIS C 1 1 12 20995 1 1 22 HIS CA C -7.794 1.351 8.405 1.00 . A A . 22 HIS CA 1 1 12 20996 1 1 22 HIS CB C -7.109 2.254 9.433 1.00 . A A . 22 HIS CB 1 1 12 20997 1 1 22 HIS CD2 C -4.510 1.990 9.350 1.00 . A A . 22 HIS CD2 1 1 12 20998 1 1 22 HIS CE1 C -4.049 3.800 8.211 1.00 . A A . 22 HIS CE1 1 1 12 20999 1 1 22 HIS CG C -5.688 2.621 9.078 1.00 . A A . 22 HIS CG 1 1 12 21000 1 1 22 HIS H H -8.855 2.955 7.605 1.00 . A A . 22 HIS H 1 1 12 21001 1 1 22 HIS HA H -7.030 0.710 7.964 1.00 . A A . 22 HIS HA 1 1 12 21002 1 1 22 HIS HB2 H -7.693 3.168 9.545 1.00 . A A . 22 HIS HB2 1 1 12 21003 1 1 22 HIS HB3 H -7.113 1.753 10.401 1.00 . A A . 22 HIS HB3 1 1 12 21004 1 1 22 HIS HD1 H -6.015 4.435 8.011 1.00 . A A . 22 HIS HD1 1 1 12 21005 1 1 22 HIS HD2 H -4.400 1.058 9.904 1.00 . A A . 22 HIS HD2 1 1 12 21006 1 1 22 HIS HE1 H -3.487 4.575 7.689 1.00 . A A . 22 HIS HE1 1 1 12 21007 1 1 22 HIS N N -8.356 2.137 7.320 1.00 . A A . 22 HIS N 1 1 12 21008 1 1 22 HIS ND1 N -5.365 3.759 8.359 1.00 . A A . 22 HIS ND1 1 1 12 21009 1 1 22 HIS NE2 N -3.521 2.703 8.825 1.00 . A A . 22 HIS NE2 1 1 12 21010 1 1 22 HIS O O -8.591 -0.544 9.646 1.00 . A A . 22 HIS O 1 1 12 21011 1 1 23 SER C C -11.520 -1.082 8.503 1.00 . A A . 23 SER C 1 1 12 21012 1 1 23 SER CA C -11.262 0.165 9.350 1.00 . A A . 23 SER CA 1 1 12 21013 1 1 23 SER CB C -12.513 1.045 9.394 1.00 . A A . 23 SER CB 1 1 12 21014 1 1 23 SER H H -10.356 1.727 8.312 1.00 . A A . 23 SER H 1 1 12 21015 1 1 23 SER HA H -10.979 -0.114 10.365 1.00 . A A . 23 SER HA 1 1 12 21016 1 1 23 SER HB2 H -12.219 2.094 9.370 1.00 . A A . 23 SER HB2 1 1 12 21017 1 1 23 SER HB3 H -13.116 0.862 8.505 1.00 . A A . 23 SER HB3 1 1 12 21018 1 1 23 SER HG H -13.251 1.586 11.174 1.00 . A A . 23 SER HG 1 1 12 21019 1 1 23 SER N N -10.125 0.899 8.822 1.00 . A A . 23 SER N 1 1 12 21020 1 1 23 SER O O -12.407 -1.876 8.813 1.00 . A A . 23 SER O 1 1 12 21021 1 1 23 SER OG O -13.298 0.799 10.558 1.00 . A A . 23 SER OG 1 1 12 21022 1 1 24 THR C C -9.729 -3.355 6.794 1.00 . A A . 24 THR C 1 1 12 21023 1 1 24 THR CA C -10.860 -2.353 6.553 1.00 . A A . 24 THR CA 1 1 12 21024 1 1 24 THR CB C -10.906 -1.822 5.119 1.00 . A A . 24 THR CB 1 1 12 21025 1 1 24 THR CG2 C -11.082 -2.939 4.088 1.00 . A A . 24 THR CG2 1 1 12 21026 1 1 24 THR H H -10.009 -0.566 7.203 1.00 . A A . 24 THR H 1 1 12 21027 1 1 24 THR HA H -11.794 -2.864 6.783 1.00 . A A . 24 THR HA 1 1 12 21028 1 1 24 THR HB H -10.024 -1.222 4.897 1.00 . A A . 24 THR HB 1 1 12 21029 1 1 24 THR HG1 H -12.216 -0.500 5.855 1.00 . A A . 24 THR HG1 1 1 12 21030 1 1 24 THR HG21 H -11.465 -3.832 4.581 1.00 . A A . 24 THR HG21 1 1 12 21031 1 1 24 THR HG22 H -11.786 -2.617 3.320 1.00 . A A . 24 THR HG22 1 1 12 21032 1 1 24 THR HG23 H -10.120 -3.162 3.627 1.00 . A A . 24 THR HG23 1 1 12 21033 1 1 24 THR N N -10.728 -1.216 7.449 1.00 . A A . 24 THR N 1 1 12 21034 1 1 24 THR O O -9.927 -4.562 6.669 1.00 . A A . 24 THR O 1 1 12 21035 1 1 24 THR OG1 O -12.131 -1.097 5.057 1.00 . A A . 24 THR OG1 1 1 12 21036 1 1 25 HIS C C -7.222 -3.819 8.904 1.00 . A A . 25 HIS C 1 1 12 21037 1 1 25 HIS CA C -7.405 -3.648 7.395 1.00 . A A . 25 HIS CA 1 1 12 21038 1 1 25 HIS CB C -6.163 -3.076 6.708 1.00 . A A . 25 HIS CB 1 1 12 21039 1 1 25 HIS CD2 C -5.789 -3.710 4.200 1.00 . A A . 25 HIS CD2 1 1 12 21040 1 1 25 HIS CE1 C -6.944 -2.089 3.293 1.00 . A A . 25 HIS CE1 1 1 12 21041 1 1 25 HIS CG C -6.295 -2.945 5.210 1.00 . A A . 25 HIS CG 1 1 12 21042 1 1 25 HIS H H -8.414 -1.833 7.236 1.00 . A A . 25 HIS H 1 1 12 21043 1 1 25 HIS HA H -7.611 -4.622 6.950 1.00 . A A . 25 HIS HA 1 1 12 21044 1 1 25 HIS HB2 H -5.947 -2.094 7.130 1.00 . A A . 25 HIS HB2 1 1 12 21045 1 1 25 HIS HB3 H -5.309 -3.714 6.933 1.00 . A A . 25 HIS HB3 1 1 12 21046 1 1 25 HIS HD1 H -7.512 -1.202 5.081 1.00 . A A . 25 HIS HD1 1 1 12 21047 1 1 25 HIS HD2 H -5.167 -4.597 4.323 1.00 . A A . 25 HIS HD2 1 1 12 21048 1 1 25 HIS HE1 H -7.410 -1.449 2.543 1.00 . A A . 25 HIS HE1 1 1 12 21049 1 1 25 HIS N N -8.567 -2.817 7.136 1.00 . A A . 25 HIS N 1 1 12 21050 1 1 25 HIS ND1 N -7.018 -1.931 4.606 1.00 . A A . 25 HIS ND1 1 1 12 21051 1 1 25 HIS NE2 N -6.183 -3.193 3.043 1.00 . A A . 25 HIS NE2 1 1 12 21052 1 1 25 HIS O O -6.095 -3.888 9.393 1.00 . A A . 25 HIS O 1 1 12 21053 1 1 26 LYS C C -7.768 -5.426 11.391 1.00 . A A . 26 LYS C 1 1 12 21054 1 1 26 LYS CA C -8.325 -4.044 11.045 1.00 . A A . 26 LYS CA 1 1 12 21055 1 1 26 LYS CB C -9.710 -3.773 11.635 1.00 . A A . 26 LYS CB 1 1 12 21056 1 1 26 LYS CD C -11.643 -2.157 11.744 1.00 . A A . 26 LYS CD 1 1 12 21057 1 1 26 LYS CE C -11.565 -1.475 13.111 1.00 . A A . 26 LYS CE 1 1 12 21058 1 1 26 LYS CG C -10.245 -2.414 11.178 1.00 . A A . 26 LYS CG 1 1 12 21059 1 1 26 LYS H H -9.259 -3.826 9.196 1.00 . A A . 26 LYS H 1 1 12 21060 1 1 26 LYS HA H -7.650 -3.288 11.448 1.00 . A A . 26 LYS HA 1 1 12 21061 1 1 26 LYS HB2 H -10.400 -4.560 11.331 1.00 . A A . 26 LYS HB2 1 1 12 21062 1 1 26 LYS HB3 H -9.657 -3.800 12.723 1.00 . A A . 26 LYS HB3 1 1 12 21063 1 1 26 LYS HD2 H -12.209 -1.532 11.053 1.00 . A A . 26 LYS HD2 1 1 12 21064 1 1 26 LYS HD3 H -12.182 -3.100 11.834 1.00 . A A . 26 LYS HD3 1 1 12 21065 1 1 26 LYS HE2 H -10.732 -0.772 13.126 1.00 . A A . 26 LYS HE2 1 1 12 21066 1 1 26 LYS HE3 H -12.472 -0.898 13.288 1.00 . A A . 26 LYS HE3 1 1 12 21067 1 1 26 LYS HG2 H -9.567 -1.625 11.503 1.00 . A A . 26 LYS HG2 1 1 12 21068 1 1 26 LYS HG3 H -10.277 -2.379 10.089 1.00 . A A . 26 LYS HG3 1 1 12 21069 1 1 26 LYS HZ1 H -11.650 -3.412 13.875 1.00 . A A . 26 LYS HZ1 1 1 12 21070 1 1 26 LYS HZ2 H -10.431 -2.533 14.503 1.00 . A A . 26 LYS HZ2 1 1 12 21071 1 1 26 LYS N N -8.347 -3.883 9.601 1.00 . A A . 26 LYS N 1 1 12 21072 1 1 26 LYS NZ N -11.392 -2.481 14.183 1.00 . A A . 26 LYS NZ 1 1 12 21073 1 1 26 LYS O O -6.939 -5.558 12.291 1.00 . A A . 26 LYS O 1 1 12 21074 1 1 27 SER C C -6.333 -7.933 10.493 1.00 . A A . 27 SER C 1 1 12 21075 1 1 27 SER CA C -7.806 -7.789 10.878 1.00 . A A . 27 SER CA 1 1 12 21076 1 1 27 SER CB C -8.662 -8.776 10.081 1.00 . A A . 27 SER CB 1 1 12 21077 1 1 27 SER H H -8.919 -6.306 9.929 1.00 . A A . 27 SER H 1 1 12 21078 1 1 27 SER HA H -7.943 -7.969 11.944 1.00 . A A . 27 SER HA 1 1 12 21079 1 1 27 SER HB2 H -8.238 -9.777 10.171 1.00 . A A . 27 SER HB2 1 1 12 21080 1 1 27 SER HB3 H -9.664 -8.815 10.508 1.00 . A A . 27 SER HB3 1 1 12 21081 1 1 27 SER HG H -9.335 -9.066 8.219 1.00 . A A . 27 SER HG 1 1 12 21082 1 1 27 SER N N -8.246 -6.422 10.659 1.00 . A A . 27 SER N 1 1 12 21083 1 1 27 SER O O -5.683 -8.909 10.865 1.00 . A A . 27 SER O 1 1 12 21084 1 1 27 SER OG O -8.746 -8.420 8.704 1.00 . A A . 27 SER OG 1 1 12 21085 1 1 28 VAL C C -3.581 -6.355 10.415 1.00 . A A . 28 VAL C 1 1 12 21086 1 1 28 VAL CA C -4.463 -6.951 9.315 1.00 . A A . 28 VAL CA 1 1 12 21087 1 1 28 VAL CB C -4.334 -6.214 7.981 1.00 . A A . 28 VAL CB 1 1 12 21088 1 1 28 VAL CG1 C -2.912 -6.326 7.427 1.00 . A A . 28 VAL CG1 1 1 12 21089 1 1 28 VAL CG2 C -5.359 -6.729 6.969 1.00 . A A . 28 VAL CG2 1 1 12 21090 1 1 28 VAL H H -6.383 -6.155 9.457 1.00 . A A . 28 VAL H 1 1 12 21091 1 1 28 VAL HA H -4.171 -7.989 9.156 1.00 . A A . 28 VAL HA 1 1 12 21092 1 1 28 VAL HB H -4.542 -5.159 8.159 1.00 . A A . 28 VAL HB 1 1 12 21093 1 1 28 VAL HG11 H -2.196 -6.231 8.243 1.00 . A A . 28 VAL HG11 1 1 12 21094 1 1 28 VAL HG12 H -2.786 -7.294 6.943 1.00 . A A . 28 VAL HG12 1 1 12 21095 1 1 28 VAL HG13 H -2.741 -5.531 6.700 1.00 . A A . 28 VAL HG13 1 1 12 21096 1 1 28 VAL HG21 H -5.508 -7.799 7.115 1.00 . A A . 28 VAL HG21 1 1 12 21097 1 1 28 VAL HG22 H -6.305 -6.208 7.112 1.00 . A A . 28 VAL HG22 1 1 12 21098 1 1 28 VAL HG23 H -4.994 -6.548 5.957 1.00 . A A . 28 VAL HG23 1 1 12 21099 1 1 28 VAL N N -5.848 -6.946 9.754 1.00 . A A . 28 VAL N 1 1 12 21100 1 1 28 VAL O O -3.969 -5.390 11.071 1.00 . A A . 28 VAL O 1 1 12 21101 1 1 29 LYS C C -0.860 -5.167 11.144 1.00 . A A . 29 LYS C 1 1 12 21102 1 1 29 LYS CA C -1.473 -6.496 11.591 1.00 . A A . 29 LYS CA 1 1 12 21103 1 1 29 LYS CB C -0.437 -7.581 11.892 1.00 . A A . 29 LYS CB 1 1 12 21104 1 1 29 LYS CD C -1.558 -9.220 13.447 1.00 . A A . 29 LYS CD 1 1 12 21105 1 1 29 LYS CE C -0.924 -10.433 14.131 1.00 . A A . 29 LYS CE 1 1 12 21106 1 1 29 LYS CG C -0.557 -8.067 13.338 1.00 . A A . 29 LYS CG 1 1 12 21107 1 1 29 LYS H H -2.104 -7.739 10.044 1.00 . A A . 29 LYS H 1 1 12 21108 1 1 29 LYS HA H -2.036 -6.325 12.508 1.00 . A A . 29 LYS HA 1 1 12 21109 1 1 29 LYS HB2 H -0.574 -8.420 11.210 1.00 . A A . 29 LYS HB2 1 1 12 21110 1 1 29 LYS HB3 H 0.565 -7.190 11.719 1.00 . A A . 29 LYS HB3 1 1 12 21111 1 1 29 LYS HD2 H -2.432 -8.895 14.012 1.00 . A A . 29 LYS HD2 1 1 12 21112 1 1 29 LYS HD3 H -1.906 -9.499 12.453 1.00 . A A . 29 LYS HD3 1 1 12 21113 1 1 29 LYS HE2 H -0.698 -11.199 13.389 1.00 . A A . 29 LYS HE2 1 1 12 21114 1 1 29 LYS HE3 H 0.022 -10.146 14.591 1.00 . A A . 29 LYS HE3 1 1 12 21115 1 1 29 LYS HG2 H 0.419 -8.393 13.698 1.00 . A A . 29 LYS HG2 1 1 12 21116 1 1 29 LYS HG3 H -0.875 -7.244 13.977 1.00 . A A . 29 LYS HG3 1 1 12 21117 1 1 29 LYS HZ1 H -1.871 -11.996 15.131 1.00 . A A . 29 LYS HZ1 1 1 12 21118 1 1 29 LYS HZ2 H -1.549 -10.726 16.097 1.00 . A A . 29 LYS HZ2 1 1 12 21119 1 1 29 LYS N N -2.412 -6.955 10.582 1.00 . A A . 29 LYS N 1 1 12 21120 1 1 29 LYS NZ N -1.835 -10.983 15.159 1.00 . A A . 29 LYS NZ 1 1 12 21121 1 1 29 LYS O O -0.535 -4.993 9.970 1.00 . A A . 29 LYS O 1 1 12 21122 1 1 30 CYS C C 1.280 -3.152 11.320 1.00 . A A . 30 CYS C 1 1 12 21123 1 1 30 CYS CA C -0.152 -2.956 11.823 1.00 . A A . 30 CYS CA 1 1 12 21124 1 1 30 CYS CB C -0.206 -2.041 13.048 1.00 . A A . 30 CYS CB 1 1 12 21125 1 1 30 CYS H H -0.987 -4.413 13.055 1.00 . A A . 30 CYS H 1 1 12 21126 1 1 30 CYS HA H -0.774 -2.503 11.051 1.00 . A A . 30 CYS HA 1 1 12 21127 1 1 30 CYS HB2 H 0.629 -2.286 13.704 1.00 . A A . 30 CYS HB2 1 1 12 21128 1 1 30 CYS HB3 H -0.064 -1.011 12.721 1.00 . A A . 30 CYS HB3 1 1 12 21129 1 1 30 CYS N N -0.720 -4.264 12.103 1.00 . A A . 30 CYS N 1 1 12 21130 1 1 30 CYS O O 1.752 -2.399 10.470 1.00 . A A . 30 CYS O 1 1 12 21131 1 1 30 CYS SG S -1.758 -2.142 14.012 1.00 . A A . 30 CYS SG 1 1 12 21132 1 1 31 GLY C C 3.348 -5.154 10.115 1.00 . A A . 31 GLY C 1 1 12 21133 1 1 31 GLY CA C 3.299 -4.473 11.484 1.00 . A A . 31 GLY CA 1 1 12 21134 1 1 31 GLY H H 1.540 -4.777 12.557 1.00 . A A . 31 GLY H 1 1 12 21135 1 1 31 GLY HA2 H 3.887 -3.555 11.459 1.00 . A A . 31 GLY HA2 1 1 12 21136 1 1 31 GLY HA3 H 3.754 -5.122 12.233 1.00 . A A . 31 GLY HA3 1 1 12 21137 1 1 31 GLY N N 1.931 -4.169 11.866 1.00 . A A . 31 GLY N 1 1 12 21138 1 1 31 GLY O O 4.426 -5.451 9.603 1.00 . A A . 31 GLY O 1 1 12 21139 1 1 32 ASP C C 2.277 -4.977 7.163 1.00 . A A . 32 ASP C 1 1 12 21140 1 1 32 ASP CA C 2.060 -6.021 8.260 1.00 . A A . 32 ASP CA 1 1 12 21141 1 1 32 ASP CB C 0.673 -6.635 8.060 1.00 . A A . 32 ASP CB 1 1 12 21142 1 1 32 ASP CG C 0.535 -7.535 6.831 1.00 . A A . 32 ASP CG 1 1 12 21143 1 1 32 ASP H H 1.294 -5.135 9.983 1.00 . A A . 32 ASP H 1 1 12 21144 1 1 32 ASP HA H 2.828 -6.794 8.258 1.00 . A A . 32 ASP HA 1 1 12 21145 1 1 32 ASP HB2 H 0.418 -7.215 8.947 1.00 . A A . 32 ASP HB2 1 1 12 21146 1 1 32 ASP HB3 H -0.057 -5.829 7.986 1.00 . A A . 32 ASP HB3 1 1 12 21147 1 1 32 ASP N N 2.166 -5.380 9.560 1.00 . A A . 32 ASP N 1 1 12 21148 1 1 32 ASP O O 2.811 -5.291 6.100 1.00 . A A . 32 ASP O 1 1 12 21149 1 1 32 ASP OD1 O 0.961 -7.083 5.746 1.00 . A A . 32 ASP OD1 1 1 12 21150 1 1 32 ASP OD2 O 0.007 -8.654 7.003 1.00 . A A . 32 ASP OD2 1 1 12 21151 1 1 33 CYS C C 3.130 -1.757 6.989 1.00 . A A . 33 CYS C 1 1 12 21152 1 1 33 CYS CA C 1.995 -2.665 6.511 1.00 . A A . 33 CYS CA 1 1 12 21153 1 1 33 CYS CB C 0.685 -1.895 6.334 1.00 . A A . 33 CYS CB 1 1 12 21154 1 1 33 CYS H H 1.422 -3.510 8.326 1.00 . A A . 33 CYS H 1 1 12 21155 1 1 33 CYS HA H 2.240 -3.115 5.549 1.00 . A A . 33 CYS HA 1 1 12 21156 1 1 33 CYS HB2 H 0.105 -1.933 7.257 1.00 . A A . 33 CYS HB2 1 1 12 21157 1 1 33 CYS HB3 H 0.895 -0.845 6.132 1.00 . A A . 33 CYS HB3 1 1 12 21158 1 1 33 CYS N N 1.854 -3.757 7.459 1.00 . A A . 33 CYS N 1 1 12 21159 1 1 33 CYS O O 4.077 -1.499 6.248 1.00 . A A . 33 CYS O 1 1 12 21160 1 1 33 CYS SG S -0.283 -2.615 4.958 1.00 . A A . 33 CYS SG 1 1 12 21161 1 1 34 HIS C C 5.223 -1.247 9.217 1.00 . A A . 34 HIS C 1 1 12 21162 1 1 34 HIS CA C 3.999 -0.424 8.811 1.00 . A A . 34 HIS CA 1 1 12 21163 1 1 34 HIS CB C 3.409 0.375 9.974 1.00 . A A . 34 HIS CB 1 1 12 21164 1 1 34 HIS CD2 C 0.899 1.047 9.695 1.00 . A A . 34 HIS CD2 1 1 12 21165 1 1 34 HIS CE1 C 1.202 3.019 8.795 1.00 . A A . 34 HIS CE1 1 1 12 21166 1 1 34 HIS CG C 2.243 1.253 9.588 1.00 . A A . 34 HIS CG 1 1 12 21167 1 1 34 HIS H H 2.223 -1.513 8.821 1.00 . A A . 34 HIS H 1 1 12 21168 1 1 34 HIS HA H 4.289 0.283 8.035 1.00 . A A . 34 HIS HA 1 1 12 21169 1 1 34 HIS HB2 H 3.087 -0.318 10.752 1.00 . A A . 34 HIS HB2 1 1 12 21170 1 1 34 HIS HB3 H 4.192 0.998 10.407 1.00 . A A . 34 HIS HB3 1 1 12 21171 1 1 34 HIS HD1 H 3.276 2.943 8.807 1.00 . A A . 34 HIS HD1 1 1 12 21172 1 1 34 HIS HD2 H 0.421 0.157 10.104 1.00 . A A . 34 HIS HD2 1 1 12 21173 1 1 34 HIS HE1 H 0.995 3.993 8.354 1.00 . A A . 34 HIS HE1 1 1 12 21174 1 1 34 HIS N N 2.997 -1.298 8.225 1.00 . A A . 34 HIS N 1 1 12 21175 1 1 34 HIS ND1 N 2.403 2.503 9.017 1.00 . A A . 34 HIS ND1 1 1 12 21176 1 1 34 HIS NE2 N 0.272 2.115 9.217 1.00 . A A . 34 HIS NE2 1 1 12 21177 1 1 34 HIS O O 5.578 -1.299 10.394 1.00 . A A . 34 HIS O 1 1 12 21178 1 1 35 HIS C C 7.994 -1.927 9.351 1.00 . A A . 35 HIS C 1 1 12 21179 1 1 35 HIS CA C 7.011 -2.689 8.460 1.00 . A A . 35 HIS CA 1 1 12 21180 1 1 35 HIS CB C 7.637 -3.140 7.138 1.00 . A A . 35 HIS CB 1 1 12 21181 1 1 35 HIS CD2 C 7.779 -1.411 5.183 1.00 . A A . 35 HIS CD2 1 1 12 21182 1 1 35 HIS CE1 C 9.662 -0.452 5.752 1.00 . A A . 35 HIS CE1 1 1 12 21183 1 1 35 HIS CG C 8.226 -2.015 6.322 1.00 . A A . 35 HIS CG 1 1 12 21184 1 1 35 HIS H H 5.540 -1.823 7.266 1.00 . A A . 35 HIS H 1 1 12 21185 1 1 35 HIS HA H 6.671 -3.580 8.987 1.00 . A A . 35 HIS HA 1 1 12 21186 1 1 35 HIS HB2 H 8.418 -3.871 7.348 1.00 . A A . 35 HIS HB2 1 1 12 21187 1 1 35 HIS HB3 H 6.878 -3.648 6.543 1.00 . A A . 35 HIS HB3 1 1 12 21188 1 1 35 HIS HD1 H 9.989 -1.607 7.445 1.00 . A A . 35 HIS HD1 1 1 12 21189 1 1 35 HIS HD2 H 6.865 -1.662 4.646 1.00 . A A . 35 HIS HD2 1 1 12 21190 1 1 35 HIS HE1 H 10.524 0.214 5.740 1.00 . A A . 35 HIS HE1 1 1 12 21191 1 1 35 HIS N N 5.835 -1.870 8.221 1.00 . A A . 35 HIS N 1 1 12 21192 1 1 35 HIS ND1 N 9.414 -1.389 6.656 1.00 . A A . 35 HIS ND1 1 1 12 21193 1 1 35 HIS NE2 N 8.647 -0.466 4.841 1.00 . A A . 35 HIS NE2 1 1 12 21194 1 1 35 HIS O O 8.057 -0.700 9.304 1.00 . A A . 35 HIS O 1 1 12 21195 1 1 36 PRO C C 10.971 -1.647 10.299 1.00 . A A . 36 PRO C 1 1 12 21196 1 1 36 PRO CA C 9.733 -2.119 11.065 1.00 . A A . 36 PRO CA 1 1 12 21197 1 1 36 PRO CB C 10.041 -3.210 12.077 1.00 . A A . 36 PRO CB 1 1 12 21198 1 1 36 PRO CD C 8.709 -4.164 10.246 1.00 . A A . 36 PRO CD 1 1 12 21199 1 1 36 PRO CG C 9.583 -4.512 11.440 1.00 . A A . 36 PRO CG 1 1 12 21200 1 1 36 PRO HA H 9.354 -1.303 11.502 1.00 . A A . 36 PRO HA 1 1 12 21201 1 1 36 PRO HB2 H 11.106 -3.241 12.306 1.00 . A A . 36 PRO HB2 1 1 12 21202 1 1 36 PRO HB3 H 9.518 -3.030 13.017 1.00 . A A . 36 PRO HB3 1 1 12 21203 1 1 36 PRO HD2 H 9.084 -4.625 9.333 1.00 . A A . 36 PRO HD2 1 1 12 21204 1 1 36 PRO HD3 H 7.688 -4.519 10.386 1.00 . A A . 36 PRO HD3 1 1 12 21205 1 1 36 PRO HG2 H 10.441 -5.105 11.124 1.00 . A A . 36 PRO HG2 1 1 12 21206 1 1 36 PRO HG3 H 9.027 -5.114 12.158 1.00 . A A . 36 PRO HG3 1 1 12 21207 1 1 36 PRO N N 8.756 -2.707 10.164 1.00 . A A . 36 PRO N 1 1 12 21208 1 1 36 PRO O O 11.547 -2.402 9.517 1.00 . A A . 36 PRO O 1 1 12 21209 1 1 37 VAL C C 13.581 0.472 10.939 1.00 . A A . 37 VAL C 1 1 12 21210 1 1 37 VAL CA C 12.502 0.181 9.895 1.00 . A A . 37 VAL CA 1 1 12 21211 1 1 37 VAL CB C 12.086 1.422 9.102 1.00 . A A . 37 VAL CB 1 1 12 21212 1 1 37 VAL CG1 C 13.312 2.211 8.637 1.00 . A A . 37 VAL CG1 1 1 12 21213 1 1 37 VAL CG2 C 11.196 1.043 7.917 1.00 . A A . 37 VAL CG2 1 1 12 21214 1 1 37 VAL H H 10.869 0.206 11.189 1.00 . A A . 37 VAL H 1 1 12 21215 1 1 37 VAL HA H 12.886 -0.557 9.190 1.00 . A A . 37 VAL HA 1 1 12 21216 1 1 37 VAL HB H 11.506 2.064 9.765 1.00 . A A . 37 VAL HB 1 1 12 21217 1 1 37 VAL HG11 H 14.187 1.561 8.644 1.00 . A A . 37 VAL HG11 1 1 12 21218 1 1 37 VAL HG12 H 13.143 2.582 7.626 1.00 . A A . 37 VAL HG12 1 1 12 21219 1 1 37 VAL HG13 H 13.479 3.052 9.309 1.00 . A A . 37 VAL HG13 1 1 12 21220 1 1 37 VAL HG21 H 11.024 -0.034 7.921 1.00 . A A . 37 VAL HG21 1 1 12 21221 1 1 37 VAL HG22 H 10.242 1.563 7.998 1.00 . A A . 37 VAL HG22 1 1 12 21222 1 1 37 VAL HG23 H 11.688 1.328 6.987 1.00 . A A . 37 VAL HG23 1 1 12 21223 1 1 37 VAL N N 11.343 -0.401 10.551 1.00 . A A . 37 VAL N 1 1 12 21224 1 1 37 VAL O O 13.404 1.338 11.795 1.00 . A A . 37 VAL O 1 1 12 21225 1 1 38 ASN C C 15.513 -0.914 13.026 1.00 . A A . 38 ASN C 1 1 12 21226 1 1 38 ASN CA C 15.783 -0.098 11.760 1.00 . A A . 38 ASN CA 1 1 12 21227 1 1 38 ASN CB C 15.943 1.368 12.167 1.00 . A A . 38 ASN CB 1 1 12 21228 1 1 38 ASN CG C 17.415 1.715 12.400 1.00 . A A . 38 ASN CG 1 1 12 21229 1 1 38 ASN H H 14.812 -0.968 10.135 1.00 . A A . 38 ASN H 1 1 12 21230 1 1 38 ASN HA H 16.663 -0.447 11.219 1.00 . A A . 38 ASN HA 1 1 12 21231 1 1 38 ASN HB2 H 15.533 2.012 11.389 1.00 . A A . 38 ASN HB2 1 1 12 21232 1 1 38 ASN HB3 H 15.372 1.561 13.075 1.00 . A A . 38 ASN HB3 1 1 12 21233 1 1 38 ASN HD21 H 16.826 3.497 13.159 1.00 . A A . 38 ASN HD21 1 1 12 21234 1 1 38 ASN HD22 H 18.537 3.232 13.134 1.00 . A A . 38 ASN HD22 1 1 12 21235 1 1 38 ASN N N 14.676 -0.266 10.835 1.00 . A A . 38 ASN N 1 1 12 21236 1 1 38 ASN ND2 N 17.609 2.914 12.943 1.00 . A A . 38 ASN ND2 1 1 12 21237 1 1 38 ASN O O 16.361 -0.987 13.914 1.00 . A A . 38 ASN O 1 1 12 21238 1 1 38 ASN OD1 O 18.315 0.945 12.107 1.00 . A A . 38 ASN OD1 1 1 12 21239 1 1 39 GLY C C 12.929 -1.569 15.088 1.00 . A A . 39 GLY C 1 1 12 21240 1 1 39 GLY CA C 13.936 -2.314 14.210 1.00 . A A . 39 GLY CA 1 1 12 21241 1 1 39 GLY H H 13.646 -1.443 12.341 1.00 . A A . 39 GLY H 1 1 12 21242 1 1 39 GLY HA2 H 13.500 -3.251 13.865 1.00 . A A . 39 GLY HA2 1 1 12 21243 1 1 39 GLY HA3 H 14.817 -2.570 14.799 1.00 . A A . 39 GLY HA3 1 1 12 21244 1 1 39 GLY N N 14.329 -1.507 13.068 1.00 . A A . 39 GLY N 1 1 12 21245 1 1 39 GLY O O 12.478 -2.094 16.105 1.00 . A A . 39 GLY O 1 1 12 21246 1 1 40 LYS C C 10.335 0.521 14.630 1.00 . A A . 40 LYS C 1 1 12 21247 1 1 40 LYS CA C 11.658 0.466 15.396 1.00 . A A . 40 LYS CA 1 1 12 21248 1 1 40 LYS CB C 12.259 1.843 15.687 1.00 . A A . 40 LYS CB 1 1 12 21249 1 1 40 LYS CD C 12.837 4.096 14.713 1.00 . A A . 40 LYS CD 1 1 12 21250 1 1 40 LYS CE C 12.029 5.279 14.175 1.00 . A A . 40 LYS CE 1 1 12 21251 1 1 40 LYS CG C 12.095 2.777 14.486 1.00 . A A . 40 LYS CG 1 1 12 21252 1 1 40 LYS H H 12.975 0.062 13.833 1.00 . A A . 40 LYS H 1 1 12 21253 1 1 40 LYS HA H 11.481 -0.018 16.357 1.00 . A A . 40 LYS HA 1 1 12 21254 1 1 40 LYS HB2 H 11.773 2.279 16.560 1.00 . A A . 40 LYS HB2 1 1 12 21255 1 1 40 LYS HB3 H 13.316 1.738 15.930 1.00 . A A . 40 LYS HB3 1 1 12 21256 1 1 40 LYS HD2 H 13.025 4.233 15.778 1.00 . A A . 40 LYS HD2 1 1 12 21257 1 1 40 LYS HD3 H 13.809 4.060 14.219 1.00 . A A . 40 LYS HD3 1 1 12 21258 1 1 40 LYS HE2 H 12.701 6.016 13.737 1.00 . A A . 40 LYS HE2 1 1 12 21259 1 1 40 LYS HE3 H 11.364 4.941 13.380 1.00 . A A . 40 LYS HE3 1 1 12 21260 1 1 40 LYS HG2 H 12.476 2.290 13.588 1.00 . A A . 40 LYS HG2 1 1 12 21261 1 1 40 LYS HG3 H 11.037 2.975 14.317 1.00 . A A . 40 LYS HG3 1 1 12 21262 1 1 40 LYS HZ1 H 11.828 6.256 16.004 1.00 . A A . 40 LYS HZ1 1 1 12 21263 1 1 40 LYS HZ2 H 10.685 6.683 14.926 1.00 . A A . 40 LYS HZ2 1 1 12 21264 1 1 40 LYS N N 12.604 -0.357 14.662 1.00 . A A . 40 LYS N 1 1 12 21265 1 1 40 LYS NZ N 11.238 5.902 15.260 1.00 . A A . 40 LYS NZ 1 1 12 21266 1 1 40 LYS O O 10.326 0.679 13.410 1.00 . A A . 40 LYS O 1 1 12 21267 1 1 41 GLU C C 7.228 1.745 15.111 1.00 . A A . 41 GLU C 1 1 12 21268 1 1 41 GLU CA C 7.923 0.421 14.784 1.00 . A A . 41 GLU CA 1 1 12 21269 1 1 41 GLU CB C 7.084 -0.769 15.252 1.00 . A A . 41 GLU CB 1 1 12 21270 1 1 41 GLU CD C 7.996 -3.119 15.163 1.00 . A A . 41 GLU CD 1 1 12 21271 1 1 41 GLU CG C 7.329 -1.994 14.368 1.00 . A A . 41 GLU CG 1 1 12 21272 1 1 41 GLU H H 9.265 0.261 16.370 1.00 . A A . 41 GLU H 1 1 12 21273 1 1 41 GLU HA H 8.085 0.344 13.709 1.00 . A A . 41 GLU HA 1 1 12 21274 1 1 41 GLU HB2 H 7.329 -1.008 16.287 1.00 . A A . 41 GLU HB2 1 1 12 21275 1 1 41 GLU HB3 H 6.027 -0.505 15.228 1.00 . A A . 41 GLU HB3 1 1 12 21276 1 1 41 GLU HG2 H 6.383 -2.345 13.957 1.00 . A A . 41 GLU HG2 1 1 12 21277 1 1 41 GLU HG3 H 7.960 -1.717 13.524 1.00 . A A . 41 GLU HG3 1 1 12 21278 1 1 41 GLU N N 9.249 0.389 15.378 1.00 . A A . 41 GLU N 1 1 12 21279 1 1 41 GLU O O 7.410 2.294 16.196 1.00 . A A . 41 GLU O 1 1 12 21280 1 1 41 GLU OE1 O 8.940 -2.799 15.916 1.00 . A A . 41 GLU OE1 1 1 12 21281 1 1 41 GLU OE2 O 7.545 -4.273 14.999 1.00 . A A . 41 GLU OE2 1 1 12 21282 1 1 42 ASP C C 4.692 3.612 13.202 1.00 . A A . 42 ASP C 1 1 12 21283 1 1 42 ASP CA C 5.723 3.467 14.323 1.00 . A A . 42 ASP CA 1 1 12 21284 1 1 42 ASP CB C 6.671 4.666 14.253 1.00 . A A . 42 ASP CB 1 1 12 21285 1 1 42 ASP CG C 6.093 5.978 14.786 1.00 . A A . 42 ASP CG 1 1 12 21286 1 1 42 ASP H H 6.304 1.765 13.271 1.00 . A A . 42 ASP H 1 1 12 21287 1 1 42 ASP HA H 5.262 3.397 15.308 1.00 . A A . 42 ASP HA 1 1 12 21288 1 1 42 ASP HB2 H 7.574 4.429 14.814 1.00 . A A . 42 ASP HB2 1 1 12 21289 1 1 42 ASP HB3 H 6.970 4.813 13.215 1.00 . A A . 42 ASP HB3 1 1 12 21290 1 1 42 ASP N N 6.446 2.218 14.151 1.00 . A A . 42 ASP N 1 1 12 21291 1 1 42 ASP O O 4.734 2.878 12.217 1.00 . A A . 42 ASP O 1 1 12 21292 1 1 42 ASP OD1 O 5.331 5.903 15.773 1.00 . A A . 42 ASP OD1 1 1 12 21293 1 1 42 ASP OD2 O 6.427 7.027 14.193 1.00 . A A . 42 ASP OD2 1 1 12 21294 1 1 43 TYR C C 3.058 6.073 11.593 1.00 . A A . 43 TYR C 1 1 12 21295 1 1 43 TYR CA C 2.750 4.815 12.408 1.00 . A A . 43 TYR CA 1 1 12 21296 1 1 43 TYR CB C 1.463 5.040 13.205 1.00 . A A . 43 TYR CB 1 1 12 21297 1 1 43 TYR CD1 C 1.541 2.600 13.836 1.00 . A A . 43 TYR CD1 1 1 12 21298 1 1 43 TYR CD2 C 0.287 4.090 15.222 1.00 . A A . 43 TYR CD2 1 1 12 21299 1 1 43 TYR CE1 C 1.184 1.501 14.694 1.00 . A A . 43 TYR CE1 1 1 12 21300 1 1 43 TYR CE2 C -0.070 2.990 16.081 1.00 . A A . 43 TYR CE2 1 1 12 21301 1 1 43 TYR CG C 1.084 3.872 14.117 1.00 . A A . 43 TYR CG 1 1 12 21302 1 1 43 TYR CZ C 0.396 1.750 15.775 1.00 . A A . 43 TYR CZ 1 1 12 21303 1 1 43 TYR H H 3.764 5.158 14.196 1.00 . A A . 43 TYR H 1 1 12 21304 1 1 43 TYR HA H 2.708 3.958 11.737 1.00 . A A . 43 TYR HA 1 1 12 21305 1 1 43 TYR HB2 H 1.575 5.939 13.810 1.00 . A A . 43 TYR HB2 1 1 12 21306 1 1 43 TYR HB3 H 0.645 5.224 12.509 1.00 . A A . 43 TYR HB3 1 1 12 21307 1 1 43 TYR HD1 H 2.171 2.428 12.963 1.00 . A A . 43 TYR HD1 1 1 12 21308 1 1 43 TYR HD2 H -0.074 5.094 15.444 1.00 . A A . 43 TYR HD2 1 1 12 21309 1 1 43 TYR HE1 H 1.537 0.491 14.484 1.00 . A A . 43 TYR HE1 1 1 12 21310 1 1 43 TYR HE2 H -0.700 3.149 16.956 1.00 . A A . 43 TYR HE2 1 1 12 21311 1 1 43 TYR HH H 0.121 0.992 17.544 1.00 . A A . 43 TYR HH 1 1 12 21312 1 1 43 TYR N N 3.791 4.565 13.391 1.00 . A A . 43 TYR N 1 1 12 21313 1 1 43 TYR O O 2.733 7.183 12.012 1.00 . A A . 43 TYR O 1 1 12 21314 1 1 43 TYR OH O 0.059 0.712 16.586 1.00 . A A . 43 TYR OH 1 1 12 21315 1 1 44 ARG C C 3.471 6.726 8.164 1.00 . A A . 44 ARG C 1 1 12 21316 1 1 44 ARG CA C 4.036 6.960 9.567 1.00 . A A . 44 ARG CA 1 1 12 21317 1 1 44 ARG CB C 5.554 7.125 9.477 1.00 . A A . 44 ARG CB 1 1 12 21318 1 1 44 ARG CD C 7.507 8.513 10.262 1.00 . A A . 44 ARG CD 1 1 12 21319 1 1 44 ARG CG C 5.993 8.476 10.044 1.00 . A A . 44 ARG CG 1 1 12 21320 1 1 44 ARG CZ C 8.970 8.522 12.290 1.00 . A A . 44 ARG CZ 1 1 12 21321 1 1 44 ARG H H 3.941 4.951 10.111 1.00 . A A . 44 ARG H 1 1 12 21322 1 1 44 ARG HA H 3.587 7.839 10.028 1.00 . A A . 44 ARG HA 1 1 12 21323 1 1 44 ARG HB2 H 6.044 6.320 10.024 1.00 . A A . 44 ARG HB2 1 1 12 21324 1 1 44 ARG HB3 H 5.871 7.043 8.437 1.00 . A A . 44 ARG HB3 1 1 12 21325 1 1 44 ARG HD2 H 7.997 7.809 9.589 1.00 . A A . 44 ARG HD2 1 1 12 21326 1 1 44 ARG HD3 H 7.893 9.504 10.023 1.00 . A A . 44 ARG HD3 1 1 12 21327 1 1 44 ARG HE H 7.148 7.651 12.187 1.00 . A A . 44 ARG HE 1 1 12 21328 1 1 44 ARG HG2 H 5.701 9.274 9.361 1.00 . A A . 44 ARG HG2 1 1 12 21329 1 1 44 ARG HG3 H 5.482 8.662 10.988 1.00 . A A . 44 ARG HG3 1 1 12 21330 1 1 44 ARG HH11 H 9.775 9.494 10.684 1.00 . A A . 44 ARG HH11 1 1 12 21331 1 1 44 ARG HH12 H 10.764 9.482 12.106 1.00 . A A . 44 ARG HH12 1 1 12 21332 1 1 44 ARG HH21 H 9.967 8.384 14.081 1.00 . A A . 44 ARG HH21 1 1 12 21333 1 1 44 ARG N N 3.680 5.858 10.444 1.00 . A A . 44 ARG N 1 1 12 21334 1 1 44 ARG NE N 7.825 8.173 11.667 1.00 . A A . 44 ARG NE 1 1 12 21335 1 1 44 ARG NH1 N 9.918 9.227 11.637 1.00 . A A . 44 ARG NH1 1 1 12 21336 1 1 44 ARG NH2 N 9.149 8.165 13.549 1.00 . A A . 44 ARG NH2 1 1 12 21337 1 1 44 ARG O O 2.876 5.683 7.897 1.00 . A A . 44 ARG O 1 1 12 21338 1 1 45 LYS C C 4.262 6.959 5.067 1.00 . A A . 45 LYS C 1 1 12 21339 1 1 45 LYS CA C 3.196 7.627 5.937 1.00 . A A . 45 LYS CA 1 1 12 21340 1 1 45 LYS CB C 2.767 9.007 5.433 1.00 . A A . 45 LYS CB 1 1 12 21341 1 1 45 LYS CD C 2.004 10.354 7.423 1.00 . A A . 45 LYS CD 1 1 12 21342 1 1 45 LYS CE C 1.220 11.665 7.507 1.00 . A A . 45 LYS CE 1 1 12 21343 1 1 45 LYS CG C 1.559 9.526 6.216 1.00 . A A . 45 LYS CG 1 1 12 21344 1 1 45 LYS H H 4.163 8.558 7.530 1.00 . A A . 45 LYS H 1 1 12 21345 1 1 45 LYS HA H 2.308 6.996 5.942 1.00 . A A . 45 LYS HA 1 1 12 21346 1 1 45 LYS HB2 H 3.596 9.708 5.529 1.00 . A A . 45 LYS HB2 1 1 12 21347 1 1 45 LYS HB3 H 2.520 8.950 4.372 1.00 . A A . 45 LYS HB3 1 1 12 21348 1 1 45 LYS HD2 H 1.855 9.779 8.337 1.00 . A A . 45 LYS HD2 1 1 12 21349 1 1 45 LYS HD3 H 3.070 10.567 7.350 1.00 . A A . 45 LYS HD3 1 1 12 21350 1 1 45 LYS HE2 H 1.222 12.159 6.535 1.00 . A A . 45 LYS HE2 1 1 12 21351 1 1 45 LYS HE3 H 0.180 11.459 7.758 1.00 . A A . 45 LYS HE3 1 1 12 21352 1 1 45 LYS HG2 H 0.933 10.134 5.564 1.00 . A A . 45 LYS HG2 1 1 12 21353 1 1 45 LYS HG3 H 0.950 8.686 6.550 1.00 . A A . 45 LYS HG3 1 1 12 21354 1 1 45 LYS HZ1 H 1.758 13.535 8.253 1.00 . A A . 45 LYS HZ1 1 1 12 21355 1 1 45 LYS HZ2 H 1.349 12.478 9.422 1.00 . A A . 45 LYS HZ2 1 1 12 21356 1 1 45 LYS N N 3.678 7.713 7.305 1.00 . A A . 45 LYS N 1 1 12 21357 1 1 45 LYS NZ N 1.815 12.560 8.525 1.00 . A A . 45 LYS NZ 1 1 12 21358 1 1 45 LYS O O 5.442 7.292 5.159 1.00 . A A . 45 LYS O 1 1 12 21359 1 1 46 CYS C C 5.424 6.328 2.468 1.00 . A A . 46 CYS C 1 1 12 21360 1 1 46 CYS CA C 4.707 5.308 3.356 1.00 . A A . 46 CYS CA 1 1 12 21361 1 1 46 CYS CB C 3.966 4.255 2.530 1.00 . A A . 46 CYS CB 1 1 12 21362 1 1 46 CYS H H 2.845 5.762 4.172 1.00 . A A . 46 CYS H 1 1 12 21363 1 1 46 CYS HA H 5.418 4.781 3.992 1.00 . A A . 46 CYS HA 1 1 12 21364 1 1 46 CYS HB2 H 3.535 4.738 1.653 1.00 . A A . 46 CYS HB2 1 1 12 21365 1 1 46 CYS HB3 H 4.688 3.523 2.168 1.00 . A A . 46 CYS HB3 1 1 12 21366 1 1 46 CYS N N 3.807 6.027 4.241 1.00 . A A . 46 CYS N 1 1 12 21367 1 1 46 CYS O O 6.648 6.297 2.345 1.00 . A A . 46 CYS O 1 1 12 21368 1 1 46 CYS SG S 2.637 3.372 3.426 1.00 . A A . 46 CYS SG 1 1 12 21369 1 1 47 GLY C C 5.785 9.378 1.814 1.00 . A A . 47 GLY C 1 1 12 21370 1 1 47 GLY CA C 5.176 8.234 1.001 1.00 . A A . 47 GLY CA 1 1 12 21371 1 1 47 GLY H H 3.638 7.226 1.979 1.00 . A A . 47 GLY H 1 1 12 21372 1 1 47 GLY HA2 H 5.936 7.800 0.352 1.00 . A A . 47 GLY HA2 1 1 12 21373 1 1 47 GLY HA3 H 4.389 8.622 0.354 1.00 . A A . 47 GLY HA3 1 1 12 21374 1 1 47 GLY N N 4.632 7.207 1.873 1.00 . A A . 47 GLY N 1 1 12 21375 1 1 47 GLY O O 5.464 10.544 1.589 1.00 . A A . 47 GLY O 1 1 12 21376 1 1 48 THR C C 8.655 10.395 2.990 1.00 . A A . 48 THR C 1 1 12 21377 1 1 48 THR CA C 7.309 9.985 3.592 1.00 . A A . 48 THR CA 1 1 12 21378 1 1 48 THR CB C 7.427 9.391 4.997 1.00 . A A . 48 THR CB 1 1 12 21379 1 1 48 THR CG2 C 8.462 10.120 5.856 1.00 . A A . 48 THR CG2 1 1 12 21380 1 1 48 THR H H 6.908 8.054 2.920 1.00 . A A . 48 THR H 1 1 12 21381 1 1 48 THR HA H 6.688 10.881 3.626 1.00 . A A . 48 THR HA 1 1 12 21382 1 1 48 THR HB H 7.641 8.324 4.951 1.00 . A A . 48 THR HB 1 1 12 21383 1 1 48 THR HG1 H 5.984 10.681 5.507 1.00 . A A . 48 THR HG1 1 1 12 21384 1 1 48 THR HG21 H 9.428 10.106 5.351 1.00 . A A . 48 THR HG21 1 1 12 21385 1 1 48 THR HG22 H 8.146 11.153 6.007 1.00 . A A . 48 THR HG22 1 1 12 21386 1 1 48 THR HG23 H 8.549 9.622 6.821 1.00 . A A . 48 THR HG23 1 1 12 21387 1 1 48 THR N N 6.653 9.005 2.743 1.00 . A A . 48 THR N 1 1 12 21388 1 1 48 THR O O 9.453 9.541 2.606 1.00 . A A . 48 THR O 1 1 12 21389 1 1 48 THR OG1 O 6.181 9.707 5.612 1.00 . A A . 48 THR OG1 1 1 12 21390 1 1 49 ALA C C 11.290 11.618 3.118 1.00 . A A . 49 ALA C 1 1 12 21391 1 1 49 ALA CA C 10.101 12.235 2.379 1.00 . A A . 49 ALA CA 1 1 12 21392 1 1 49 ALA CB C 10.084 13.762 2.473 1.00 . A A . 49 ALA CB 1 1 12 21393 1 1 49 ALA H H 8.211 12.389 3.242 1.00 . A A . 49 ALA H 1 1 12 21394 1 1 49 ALA HA H 10.148 11.949 1.328 1.00 . A A . 49 ALA HA 1 1 12 21395 1 1 49 ALA HB1 H 9.068 14.124 2.317 1.00 . A A . 49 ALA HB1 1 1 12 21396 1 1 49 ALA HB2 H 10.432 14.069 3.460 1.00 . A A . 49 ALA HB2 1 1 12 21397 1 1 49 ALA HB3 H 10.740 14.180 1.710 1.00 . A A . 49 ALA HB3 1 1 12 21398 1 1 49 ALA N N 8.865 11.701 2.927 1.00 . A A . 49 ALA N 1 1 12 21399 1 1 49 ALA O O 11.591 12.003 4.247 1.00 . A A . 49 ALA O 1 1 12 21400 1 1 50 GLY C C 12.842 8.489 3.129 1.00 . A A . 50 GLY C 1 1 12 21401 1 1 50 GLY CA C 13.083 9.997 3.030 1.00 . A A . 50 GLY CA 1 1 12 21402 1 1 50 GLY H H 11.682 10.364 1.533 1.00 . A A . 50 GLY H 1 1 12 21403 1 1 50 GLY HA2 H 13.966 10.188 2.422 1.00 . A A . 50 GLY HA2 1 1 12 21404 1 1 50 GLY HA3 H 13.285 10.402 4.022 1.00 . A A . 50 GLY HA3 1 1 12 21405 1 1 50 GLY N N 11.933 10.671 2.451 1.00 . A A . 50 GLY N 1 1 12 21406 1 1 50 GLY O O 13.756 7.730 3.446 1.00 . A A . 50 GLY O 1 1 12 21407 1 1 51 CYS C C 11.021 6.201 1.474 1.00 . A A . 51 CYS C 1 1 12 21408 1 1 51 CYS CA C 11.233 6.697 2.905 1.00 . A A . 51 CYS CA 1 1 12 21409 1 1 51 CYS CB C 9.995 6.473 3.776 1.00 . A A . 51 CYS CB 1 1 12 21410 1 1 51 CYS H H 10.868 8.724 2.594 1.00 . A A . 51 CYS H 1 1 12 21411 1 1 51 CYS HA H 12.062 6.170 3.378 1.00 . A A . 51 CYS HA 1 1 12 21412 1 1 51 CYS HB2 H 9.183 7.120 3.441 1.00 . A A . 51 CYS HB2 1 1 12 21413 1 1 51 CYS HB3 H 9.647 5.445 3.672 1.00 . A A . 51 CYS HB3 1 1 12 21414 1 1 51 CYS N N 11.606 8.100 2.852 1.00 . A A . 51 CYS N 1 1 12 21415 1 1 51 CYS O O 11.971 5.794 0.807 1.00 . A A . 51 CYS O 1 1 12 21416 1 1 51 CYS SG S 10.390 6.825 5.528 1.00 . A A . 51 CYS SG 1 1 12 21417 1 1 52 HIS C C 9.146 7.028 -1.181 1.00 . A A . 52 HIS C 1 1 12 21418 1 1 52 HIS CA C 9.420 5.811 -0.297 1.00 . A A . 52 HIS CA 1 1 12 21419 1 1 52 HIS CB C 8.247 4.829 -0.259 1.00 . A A . 52 HIS CB 1 1 12 21420 1 1 52 HIS CD2 C 8.171 2.967 1.574 1.00 . A A . 52 HIS CD2 1 1 12 21421 1 1 52 HIS CE1 C 9.500 1.523 0.607 1.00 . A A . 52 HIS CE1 1 1 12 21422 1 1 52 HIS CG C 8.575 3.504 0.387 1.00 . A A . 52 HIS CG 1 1 12 21423 1 1 52 HIS H H 9.002 6.582 1.592 1.00 . A A . 52 HIS H 1 1 12 21424 1 1 52 HIS HA H 10.287 5.277 -0.687 1.00 . A A . 52 HIS HA 1 1 12 21425 1 1 52 HIS HB2 H 7.419 5.290 0.281 1.00 . A A . 52 HIS HB2 1 1 12 21426 1 1 52 HIS HB3 H 7.903 4.650 -1.277 1.00 . A A . 52 HIS HB3 1 1 12 21427 1 1 52 HIS HD1 H 9.873 2.671 -1.081 1.00 . A A . 52 HIS HD1 1 1 12 21428 1 1 52 HIS HD2 H 7.502 3.440 2.293 1.00 . A A . 52 HIS HD2 1 1 12 21429 1 1 52 HIS HE1 H 10.086 0.622 0.424 1.00 . A A . 52 HIS HE1 1 1 12 21430 1 1 52 HIS N N 9.769 6.250 1.043 1.00 . A A . 52 HIS N 1 1 12 21431 1 1 52 HIS ND1 N 9.412 2.572 -0.199 1.00 . A A . 52 HIS ND1 1 1 12 21432 1 1 52 HIS NE2 N 8.730 1.770 1.705 1.00 . A A . 52 HIS NE2 1 1 12 21433 1 1 52 HIS O O 7.993 7.332 -1.486 1.00 . A A . 52 HIS O 1 1 12 21434 1 1 53 ASP C C 11.145 8.785 -3.539 1.00 . A A . 53 ASP C 1 1 12 21435 1 1 53 ASP CA C 10.115 8.872 -2.411 1.00 . A A . 53 ASP CA 1 1 12 21436 1 1 53 ASP CB C 10.392 10.148 -1.614 1.00 . A A . 53 ASP CB 1 1 12 21437 1 1 53 ASP CG C 10.778 11.365 -2.456 1.00 . A A . 53 ASP CG 1 1 12 21438 1 1 53 ASP H H 11.158 7.440 -1.316 1.00 . A A . 53 ASP H 1 1 12 21439 1 1 53 ASP HA H 9.090 8.864 -2.782 1.00 . A A . 53 ASP HA 1 1 12 21440 1 1 53 ASP HB2 H 9.505 10.394 -1.031 1.00 . A A . 53 ASP HB2 1 1 12 21441 1 1 53 ASP HB3 H 11.194 9.947 -0.904 1.00 . A A . 53 ASP HB3 1 1 12 21442 1 1 53 ASP N N 10.224 7.693 -1.568 1.00 . A A . 53 ASP N 1 1 12 21443 1 1 53 ASP O O 12.177 9.452 -3.494 1.00 . A A . 53 ASP O 1 1 12 21444 1 1 53 ASP OD1 O 9.853 11.964 -3.045 1.00 . A A . 53 ASP OD1 1 1 12 21445 1 1 53 ASP OD2 O 11.990 11.669 -2.492 1.00 . A A . 53 ASP OD2 1 1 12 21446 1 1 54 SER C C 11.186 8.550 -6.867 1.00 . A A . 54 SER C 1 1 12 21447 1 1 54 SER CA C 11.716 7.773 -5.660 1.00 . A A . 54 SER CA 1 1 12 21448 1 1 54 SER CB C 11.867 6.291 -6.008 1.00 . A A . 54 SER CB 1 1 12 21449 1 1 54 SER H H 9.988 7.418 -4.553 1.00 . A A . 54 SER H 1 1 12 21450 1 1 54 SER HA H 12.679 8.171 -5.342 1.00 . A A . 54 SER HA 1 1 12 21451 1 1 54 SER HB2 H 11.722 5.692 -5.109 1.00 . A A . 54 SER HB2 1 1 12 21452 1 1 54 SER HB3 H 11.087 6.003 -6.713 1.00 . A A . 54 SER HB3 1 1 12 21453 1 1 54 SER HG H 13.801 6.710 -6.308 1.00 . A A . 54 SER HG 1 1 12 21454 1 1 54 SER N N 10.830 7.957 -4.523 1.00 . A A . 54 SER N 1 1 12 21455 1 1 54 SER O O 11.959 9.158 -7.607 1.00 . A A . 54 SER O 1 1 12 21456 1 1 54 SER OG O 13.144 6.002 -6.569 1.00 . A A . 54 SER OG 1 1 12 21457 1 1 55 MET C C 9.825 8.760 -9.474 1.00 . A A . 55 MET C 1 1 12 21458 1 1 55 MET CA C 9.230 9.197 -8.134 1.00 . A A . 55 MET CA 1 1 12 21459 1 1 55 MET CB C 9.408 10.707 -7.964 1.00 . A A . 55 MET CB 1 1 12 21460 1 1 55 MET CE C 7.201 9.930 -5.325 1.00 . A A . 55 MET CE 1 1 12 21461 1 1 55 MET CG C 8.114 11.359 -7.471 1.00 . A A . 55 MET CG 1 1 12 21462 1 1 55 MET H H 9.250 8.009 -6.423 1.00 . A A . 55 MET H 1 1 12 21463 1 1 55 MET HA H 8.179 8.913 -8.086 1.00 . A A . 55 MET HA 1 1 12 21464 1 1 55 MET HB2 H 10.212 10.904 -7.255 1.00 . A A . 55 MET HB2 1 1 12 21465 1 1 55 MET HB3 H 9.704 11.151 -8.914 1.00 . A A . 55 MET HB3 1 1 12 21466 1 1 55 MET HE1 H 7.489 9.151 -6.031 1.00 . A A . 55 MET HE1 1 1 12 21467 1 1 55 MET HE2 H 7.429 9.604 -4.311 1.00 . A A . 55 MET HE2 1 1 12 21468 1 1 55 MET HE3 H 6.132 10.122 -5.413 1.00 . A A . 55 MET HE3 1 1 12 21469 1 1 55 MET HG2 H 8.025 12.364 -7.881 1.00 . A A . 55 MET HG2 1 1 12 21470 1 1 55 MET HG3 H 7.253 10.792 -7.826 1.00 . A A . 55 MET HG3 1 1 12 21471 1 1 55 MET N N 9.872 8.505 -7.029 1.00 . A A . 55 MET N 1 1 12 21472 1 1 55 MET O O 9.933 9.563 -10.401 1.00 . A A . 55 MET O 1 1 12 21473 1 1 55 MET SD S 8.105 11.426 -5.687 1.00 . A A . 55 MET SD 1 1 12 21474 1 1 56 ASP C C 9.813 5.917 -11.352 1.00 . A A . 56 ASP C 1 1 12 21475 1 1 56 ASP CA C 10.779 6.938 -10.746 1.00 . A A . 56 ASP CA 1 1 12 21476 1 1 56 ASP CB C 12.097 6.221 -10.447 1.00 . A A . 56 ASP CB 1 1 12 21477 1 1 56 ASP CG C 13.264 6.605 -11.359 1.00 . A A . 56 ASP CG 1 1 12 21478 1 1 56 ASP H H 10.105 6.844 -8.777 1.00 . A A . 56 ASP H 1 1 12 21479 1 1 56 ASP HA H 10.945 7.793 -11.401 1.00 . A A . 56 ASP HA 1 1 12 21480 1 1 56 ASP HB2 H 12.380 6.429 -9.415 1.00 . A A . 56 ASP HB2 1 1 12 21481 1 1 56 ASP HB3 H 11.935 5.146 -10.523 1.00 . A A . 56 ASP HB3 1 1 12 21482 1 1 56 ASP N N 10.197 7.490 -9.535 1.00 . A A . 56 ASP N 1 1 12 21483 1 1 56 ASP O O 9.732 5.781 -12.571 1.00 . A A . 56 ASP O 1 1 12 21484 1 1 56 ASP OD1 O 13.914 7.626 -11.050 1.00 . A A . 56 ASP OD1 1 1 12 21485 1 1 56 ASP OD2 O 13.478 5.869 -12.346 1.00 . A A . 56 ASP OD2 1 1 12 21486 1 1 57 LYS C C 8.902 3.016 -11.473 1.00 . A A . 57 LYS C 1 1 12 21487 1 1 57 LYS CA C 8.149 4.220 -10.903 1.00 . A A . 57 LYS CA 1 1 12 21488 1 1 57 LYS CB C 7.136 4.828 -11.875 1.00 . A A . 57 LYS CB 1 1 12 21489 1 1 57 LYS CD C 6.174 3.269 -13.608 1.00 . A A . 57 LYS CD 1 1 12 21490 1 1 57 LYS CE C 5.679 1.823 -13.679 1.00 . A A . 57 LYS CE 1 1 12 21491 1 1 57 LYS CG C 6.018 3.833 -12.195 1.00 . A A . 57 LYS CG 1 1 12 21492 1 1 57 LYS H H 9.178 5.341 -9.480 1.00 . A A . 57 LYS H 1 1 12 21493 1 1 57 LYS HA H 7.596 3.895 -10.022 1.00 . A A . 57 LYS HA 1 1 12 21494 1 1 57 LYS HB2 H 6.709 5.733 -11.443 1.00 . A A . 57 LYS HB2 1 1 12 21495 1 1 57 LYS HB3 H 7.640 5.122 -12.795 1.00 . A A . 57 LYS HB3 1 1 12 21496 1 1 57 LYS HD2 H 5.614 3.883 -14.313 1.00 . A A . 57 LYS HD2 1 1 12 21497 1 1 57 LYS HD3 H 7.221 3.313 -13.908 1.00 . A A . 57 LYS HD3 1 1 12 21498 1 1 57 LYS HE2 H 6.161 1.229 -12.902 1.00 . A A . 57 LYS HE2 1 1 12 21499 1 1 57 LYS HE3 H 4.607 1.789 -13.485 1.00 . A A . 57 LYS HE3 1 1 12 21500 1 1 57 LYS HG2 H 6.032 3.019 -11.470 1.00 . A A . 57 LYS HG2 1 1 12 21501 1 1 57 LYS HG3 H 5.050 4.326 -12.101 1.00 . A A . 57 LYS HG3 1 1 12 21502 1 1 57 LYS HZ1 H 5.128 1.140 -15.569 1.00 . A A . 57 LYS HZ1 1 1 12 21503 1 1 57 LYS HZ2 H 6.610 1.814 -15.543 1.00 . A A . 57 LYS HZ2 1 1 12 21504 1 1 57 LYS N N 9.106 5.225 -10.471 1.00 . A A . 57 LYS N 1 1 12 21505 1 1 57 LYS NZ N 5.967 1.240 -15.008 1.00 . A A . 57 LYS NZ 1 1 12 21506 1 1 57 LYS O O 8.800 1.910 -10.947 1.00 . A A . 57 LYS O 1 1 12 21507 1 1 58 LYS C C 11.790 2.129 -12.530 1.00 . A A . 58 LYS C 1 1 12 21508 1 1 58 LYS CA C 10.412 2.226 -13.189 1.00 . A A . 58 LYS CA 1 1 12 21509 1 1 58 LYS CB C 10.468 2.458 -14.701 1.00 . A A . 58 LYS CB 1 1 12 21510 1 1 58 LYS CD C 10.433 4.777 -15.690 1.00 . A A . 58 LYS CD 1 1 12 21511 1 1 58 LYS CE C 11.277 5.692 -16.580 1.00 . A A . 58 LYS CE 1 1 12 21512 1 1 58 LYS CG C 11.298 3.699 -15.034 1.00 . A A . 58 LYS CG 1 1 12 21513 1 1 58 LYS H H 9.720 4.177 -12.964 1.00 . A A . 58 LYS H 1 1 12 21514 1 1 58 LYS HA H 9.885 1.286 -13.027 1.00 . A A . 58 LYS HA 1 1 12 21515 1 1 58 LYS HB2 H 10.900 1.585 -15.191 1.00 . A A . 58 LYS HB2 1 1 12 21516 1 1 58 LYS HB3 H 9.458 2.575 -15.092 1.00 . A A . 58 LYS HB3 1 1 12 21517 1 1 58 LYS HD2 H 9.649 4.307 -16.285 1.00 . A A . 58 LYS HD2 1 1 12 21518 1 1 58 LYS HD3 H 9.937 5.369 -14.920 1.00 . A A . 58 LYS HD3 1 1 12 21519 1 1 58 LYS HE2 H 12.237 5.887 -16.103 1.00 . A A . 58 LYS HE2 1 1 12 21520 1 1 58 LYS HE3 H 11.486 5.196 -17.527 1.00 . A A . 58 LYS HE3 1 1 12 21521 1 1 58 LYS HG2 H 11.750 4.094 -14.124 1.00 . A A . 58 LYS HG2 1 1 12 21522 1 1 58 LYS HG3 H 12.114 3.427 -15.703 1.00 . A A . 58 LYS HG3 1 1 12 21523 1 1 58 LYS HZ1 H 11.216 7.735 -16.987 1.00 . A A . 58 LYS HZ1 1 1 12 21524 1 1 58 LYS HZ2 H 9.969 6.918 -17.641 1.00 . A A . 58 LYS HZ2 1 1 12 21525 1 1 58 LYS N N 9.642 3.274 -12.542 1.00 . A A . 58 LYS N 1 1 12 21526 1 1 58 LYS NZ N 10.571 6.969 -16.827 1.00 . A A . 58 LYS NZ 1 1 12 21527 1 1 58 LYS O O 12.805 2.420 -13.161 1.00 . A A . 58 LYS O 1 1 12 21528 1 1 59 ASP C C 12.906 0.379 -9.580 1.00 . A A . 59 ASP C 1 1 12 21529 1 1 59 ASP CA C 13.016 1.582 -10.519 1.00 . A A . 59 ASP CA 1 1 12 21530 1 1 59 ASP CB C 13.284 2.824 -9.666 1.00 . A A . 59 ASP CB 1 1 12 21531 1 1 59 ASP CG C 14.573 2.779 -8.844 1.00 . A A . 59 ASP CG 1 1 12 21532 1 1 59 ASP H H 10.950 1.485 -10.765 1.00 . A A . 59 ASP H 1 1 12 21533 1 1 59 ASP HA H 13.795 1.455 -11.270 1.00 . A A . 59 ASP HA 1 1 12 21534 1 1 59 ASP HB2 H 13.318 3.695 -10.321 1.00 . A A . 59 ASP HB2 1 1 12 21535 1 1 59 ASP HB3 H 12.443 2.968 -8.988 1.00 . A A . 59 ASP HB3 1 1 12 21536 1 1 59 ASP N N 11.780 1.720 -11.270 1.00 . A A . 59 ASP N 1 1 12 21537 1 1 59 ASP O O 13.772 -0.494 -9.581 1.00 . A A . 59 ASP O 1 1 12 21538 1 1 59 ASP OD1 O 15.566 2.237 -9.376 1.00 . A A . 59 ASP OD1 1 1 12 21539 1 1 59 ASP OD2 O 14.537 3.287 -7.703 1.00 . A A . 59 ASP OD2 1 1 12 21540 1 1 60 LYS C C 12.632 -0.633 -6.736 1.00 . A A . 60 LYS C 1 1 12 21541 1 1 60 LYS CA C 11.599 -0.709 -7.861 1.00 . A A . 60 LYS CA 1 1 12 21542 1 1 60 LYS CB C 11.578 -2.056 -8.586 1.00 . A A . 60 LYS CB 1 1 12 21543 1 1 60 LYS CD C 10.996 -2.866 -10.903 1.00 . A A . 60 LYS CD 1 1 12 21544 1 1 60 LYS CE C 10.219 -2.470 -12.160 1.00 . A A . 60 LYS CE 1 1 12 21545 1 1 60 LYS CG C 10.516 -2.069 -9.688 1.00 . A A . 60 LYS CG 1 1 12 21546 1 1 60 LYS H H 11.133 1.086 -8.809 1.00 . A A . 60 LYS H 1 1 12 21547 1 1 60 LYS HA H 10.608 -0.559 -7.431 1.00 . A A . 60 LYS HA 1 1 12 21548 1 1 60 LYS HB2 H 12.558 -2.257 -9.019 1.00 . A A . 60 LYS HB2 1 1 12 21549 1 1 60 LYS HB3 H 11.375 -2.855 -7.872 1.00 . A A . 60 LYS HB3 1 1 12 21550 1 1 60 LYS HD2 H 12.061 -2.691 -11.059 1.00 . A A . 60 LYS HD2 1 1 12 21551 1 1 60 LYS HD3 H 10.873 -3.932 -10.715 1.00 . A A . 60 LYS HD3 1 1 12 21552 1 1 60 LYS HE2 H 9.744 -1.501 -12.011 1.00 . A A . 60 LYS HE2 1 1 12 21553 1 1 60 LYS HE3 H 10.905 -2.364 -13.000 1.00 . A A . 60 LYS HE3 1 1 12 21554 1 1 60 LYS HG2 H 9.594 -2.505 -9.304 1.00 . A A . 60 LYS HG2 1 1 12 21555 1 1 60 LYS HG3 H 10.285 -1.047 -9.988 1.00 . A A . 60 LYS HG3 1 1 12 21556 1 1 60 LYS HZ1 H 9.281 -4.312 -11.890 1.00 . A A . 60 LYS HZ1 1 1 12 21557 1 1 60 LYS HZ2 H 8.252 -3.134 -12.344 1.00 . A A . 60 LYS HZ2 1 1 12 21558 1 1 60 LYS N N 11.833 0.372 -8.803 1.00 . A A . 60 LYS N 1 1 12 21559 1 1 60 LYS NZ N 9.193 -3.489 -12.476 1.00 . A A . 60 LYS NZ 1 1 12 21560 1 1 60 LYS O O 12.696 0.359 -6.012 1.00 . A A . 60 LYS O 1 1 12 21561 1 1 61 SER C C 13.800 -1.789 -4.212 1.00 . A A . 61 SER C 1 1 12 21562 1 1 61 SER CA C 14.445 -1.760 -5.599 1.00 . A A . 61 SER CA 1 1 12 21563 1 1 61 SER CB C 15.411 -0.579 -5.710 1.00 . A A . 61 SER CB 1 1 12 21564 1 1 61 SER H H 13.360 -2.498 -7.217 1.00 . A A . 61 SER H 1 1 12 21565 1 1 61 SER HA H 14.984 -2.688 -5.789 1.00 . A A . 61 SER HA 1 1 12 21566 1 1 61 SER HB2 H 15.806 -0.528 -6.725 1.00 . A A . 61 SER HB2 1 1 12 21567 1 1 61 SER HB3 H 14.870 0.350 -5.532 1.00 . A A . 61 SER HB3 1 1 12 21568 1 1 61 SER HG H 16.296 -1.395 -4.111 1.00 . A A . 61 SER HG 1 1 12 21569 1 1 61 SER N N 13.418 -1.695 -6.624 1.00 . A A . 61 SER N 1 1 12 21570 1 1 61 SER O O 13.765 -2.832 -3.561 1.00 . A A . 61 SER O 1 1 12 21571 1 1 61 SER OG O 16.491 -0.683 -4.786 1.00 . A A . 61 SER OG 1 1 12 21572 1 1 62 ALA C C 12.138 0.916 -2.329 1.00 . A A . 62 ALA C 1 1 12 21573 1 1 62 ALA CA C 12.663 -0.511 -2.502 1.00 . A A . 62 ALA CA 1 1 12 21574 1 1 62 ALA CB C 13.652 -0.906 -1.405 1.00 . A A . 62 ALA CB 1 1 12 21575 1 1 62 ALA H H 13.337 0.213 -4.336 1.00 . A A . 62 ALA H 1 1 12 21576 1 1 62 ALA HA H 11.821 -1.203 -2.483 1.00 . A A . 62 ALA HA 1 1 12 21577 1 1 62 ALA HB1 H 14.494 -1.436 -1.848 1.00 . A A . 62 ALA HB1 1 1 12 21578 1 1 62 ALA HB2 H 14.013 -0.009 -0.900 1.00 . A A . 62 ALA HB2 1 1 12 21579 1 1 62 ALA HB3 H 13.155 -1.553 -0.683 1.00 . A A . 62 ALA HB3 1 1 12 21580 1 1 62 ALA N N 13.305 -0.631 -3.800 1.00 . A A . 62 ALA N 1 1 12 21581 1 1 62 ALA O O 11.033 1.118 -1.827 1.00 . A A . 62 ALA O 1 1 12 21582 1 1 63 LYS C C 11.378 3.543 -3.546 1.00 . A A . 63 LYS C 1 1 12 21583 1 1 63 LYS CA C 12.587 3.271 -2.649 1.00 . A A . 63 LYS CA 1 1 12 21584 1 1 63 LYS CB C 13.792 4.164 -2.953 1.00 . A A . 63 LYS CB 1 1 12 21585 1 1 63 LYS CD C 14.726 5.353 -0.934 1.00 . A A . 63 LYS CD 1 1 12 21586 1 1 63 LYS CE C 15.915 5.433 0.025 1.00 . A A . 63 LYS CE 1 1 12 21587 1 1 63 LYS CG C 14.816 4.107 -1.818 1.00 . A A . 63 LYS CG 1 1 12 21588 1 1 63 LYS H H 13.852 1.696 -3.159 1.00 . A A . 63 LYS H 1 1 12 21589 1 1 63 LYS HA H 12.300 3.458 -1.615 1.00 . A A . 63 LYS HA 1 1 12 21590 1 1 63 LYS HB2 H 14.259 3.848 -3.885 1.00 . A A . 63 LYS HB2 1 1 12 21591 1 1 63 LYS HB3 H 13.459 5.193 -3.096 1.00 . A A . 63 LYS HB3 1 1 12 21592 1 1 63 LYS HD2 H 14.697 6.245 -1.559 1.00 . A A . 63 LYS HD2 1 1 12 21593 1 1 63 LYS HD3 H 13.796 5.332 -0.365 1.00 . A A . 63 LYS HD3 1 1 12 21594 1 1 63 LYS HE2 H 16.557 4.562 -0.109 1.00 . A A . 63 LYS HE2 1 1 12 21595 1 1 63 LYS HE3 H 16.518 6.311 -0.207 1.00 . A A . 63 LYS HE3 1 1 12 21596 1 1 63 LYS HG2 H 14.647 3.216 -1.214 1.00 . A A . 63 LYS HG2 1 1 12 21597 1 1 63 LYS HG3 H 15.821 4.024 -2.234 1.00 . A A . 63 LYS HG3 1 1 12 21598 1 1 63 LYS HZ1 H 14.776 4.771 1.639 1.00 . A A . 63 LYS HZ1 1 1 12 21599 1 1 63 LYS HZ2 H 16.210 5.399 2.088 1.00 . A A . 63 LYS HZ2 1 1 12 21600 1 1 63 LYS N N 12.955 1.869 -2.752 1.00 . A A . 63 LYS N 1 1 12 21601 1 1 63 LYS NZ N 15.447 5.501 1.427 1.00 . A A . 63 LYS NZ 1 1 12 21602 1 1 63 LYS O O 10.659 4.521 -3.343 1.00 . A A . 63 LYS O 1 1 12 21603 1 1 64 GLY C C 8.741 2.712 -4.714 1.00 . A A . 64 GLY C 1 1 12 21604 1 1 64 GLY CA C 10.082 2.796 -5.446 1.00 . A A . 64 GLY CA 1 1 12 21605 1 1 64 GLY H H 11.781 1.870 -4.675 1.00 . A A . 64 GLY H 1 1 12 21606 1 1 64 GLY HA2 H 10.154 3.749 -5.970 1.00 . A A . 64 GLY HA2 1 1 12 21607 1 1 64 GLY HA3 H 10.138 2.012 -6.201 1.00 . A A . 64 GLY HA3 1 1 12 21608 1 1 64 GLY N N 11.191 2.662 -4.517 1.00 . A A . 64 GLY N 1 1 12 21609 1 1 64 GLY O O 8.260 1.620 -4.415 1.00 . A A . 64 GLY O 1 1 12 21610 1 1 65 TYR C C 5.815 3.192 -4.521 1.00 . A A . 65 TYR C 1 1 12 21611 1 1 65 TYR CA C 6.899 3.951 -3.753 1.00 . A A . 65 TYR CA 1 1 12 21612 1 1 65 TYR CB C 6.529 5.435 -3.705 1.00 . A A . 65 TYR CB 1 1 12 21613 1 1 65 TYR CD1 C 4.720 5.473 -1.948 1.00 . A A . 65 TYR CD1 1 1 12 21614 1 1 65 TYR CD2 C 4.162 6.173 -4.165 1.00 . A A . 65 TYR CD2 1 1 12 21615 1 1 65 TYR CE1 C 3.367 5.725 -1.527 1.00 . A A . 65 TYR CE1 1 1 12 21616 1 1 65 TYR CE2 C 2.808 6.425 -3.744 1.00 . A A . 65 TYR CE2 1 1 12 21617 1 1 65 TYR CG C 5.090 5.703 -3.258 1.00 . A A . 65 TYR CG 1 1 12 21618 1 1 65 TYR CZ C 2.477 6.189 -2.446 1.00 . A A . 65 TYR CZ 1 1 12 21619 1 1 65 TYR H H 8.572 4.763 -4.692 1.00 . A A . 65 TYR H 1 1 12 21620 1 1 65 TYR HA H 7.024 3.497 -2.770 1.00 . A A . 65 TYR HA 1 1 12 21621 1 1 65 TYR HB2 H 7.210 5.947 -3.027 1.00 . A A . 65 TYR HB2 1 1 12 21622 1 1 65 TYR HB3 H 6.677 5.868 -4.694 1.00 . A A . 65 TYR HB3 1 1 12 21623 1 1 65 TYR HD1 H 5.454 5.101 -1.232 1.00 . A A . 65 TYR HD1 1 1 12 21624 1 1 65 TYR HD2 H 4.454 6.355 -5.199 1.00 . A A . 65 TYR HD2 1 1 12 21625 1 1 65 TYR HE1 H 3.062 5.549 -0.496 1.00 . A A . 65 TYR HE1 1 1 12 21626 1 1 65 TYR HE2 H 2.065 6.798 -4.449 1.00 . A A . 65 TYR HE2 1 1 12 21627 1 1 65 TYR HH H 1.028 7.412 -2.018 1.00 . A A . 65 TYR HH 1 1 12 21628 1 1 65 TYR N N 8.175 3.879 -4.445 1.00 . A A . 65 TYR N 1 1 12 21629 1 1 65 TYR O O 4.988 2.507 -3.921 1.00 . A A . 65 TYR O 1 1 12 21630 1 1 65 TYR OH O 1.199 6.427 -2.048 1.00 . A A . 65 TYR OH 1 1 12 21631 1 1 66 TYR C C 5.235 1.196 -6.874 1.00 . A A . 66 TYR C 1 1 12 21632 1 1 66 TYR CA C 4.886 2.675 -6.693 1.00 . A A . 66 TYR CA 1 1 12 21633 1 1 66 TYR CB C 4.972 3.377 -8.050 1.00 . A A . 66 TYR CB 1 1 12 21634 1 1 66 TYR CD1 C 5.256 1.529 -9.743 1.00 . A A . 66 TYR CD1 1 1 12 21635 1 1 66 TYR CD2 C 3.215 2.773 -9.755 1.00 . A A . 66 TYR CD2 1 1 12 21636 1 1 66 TYR CE1 C 4.778 0.734 -10.844 1.00 . A A . 66 TYR CE1 1 1 12 21637 1 1 66 TYR CE2 C 2.737 1.979 -10.856 1.00 . A A . 66 TYR CE2 1 1 12 21638 1 1 66 TYR CG C 4.464 2.532 -9.221 1.00 . A A . 66 TYR CG 1 1 12 21639 1 1 66 TYR CZ C 3.542 0.998 -11.347 1.00 . A A . 66 TYR CZ 1 1 12 21640 1 1 66 TYR H H 6.531 3.897 -6.318 1.00 . A A . 66 TYR H 1 1 12 21641 1 1 66 TYR HA H 3.908 2.754 -6.219 1.00 . A A . 66 TYR HA 1 1 12 21642 1 1 66 TYR HB2 H 4.397 4.302 -8.007 1.00 . A A . 66 TYR HB2 1 1 12 21643 1 1 66 TYR HB3 H 6.009 3.655 -8.239 1.00 . A A . 66 TYR HB3 1 1 12 21644 1 1 66 TYR HD1 H 6.243 1.339 -9.321 1.00 . A A . 66 TYR HD1 1 1 12 21645 1 1 66 TYR HD2 H 2.589 3.565 -9.343 1.00 . A A . 66 TYR HD2 1 1 12 21646 1 1 66 TYR HE1 H 5.393 -0.061 -11.266 1.00 . A A . 66 TYR HE1 1 1 12 21647 1 1 66 TYR HE2 H 1.752 2.158 -11.288 1.00 . A A . 66 TYR HE2 1 1 12 21648 1 1 66 TYR HH H 2.122 0.434 -12.548 1.00 . A A . 66 TYR HH 1 1 12 21649 1 1 66 TYR N N 5.854 3.338 -5.837 1.00 . A A . 66 TYR N 1 1 12 21650 1 1 66 TYR O O 4.514 0.462 -7.548 1.00 . A A . 66 TYR O 1 1 12 21651 1 1 66 TYR OH O 3.091 0.248 -12.387 1.00 . A A . 66 TYR OH 1 1 12 21652 1 1 67 HIS C C 6.374 -1.332 -5.085 1.00 . A A . 67 HIS C 1 1 12 21653 1 1 67 HIS CA C 6.796 -0.574 -6.345 1.00 . A A . 67 HIS CA 1 1 12 21654 1 1 67 HIS CB C 8.304 -0.634 -6.596 1.00 . A A . 67 HIS CB 1 1 12 21655 1 1 67 HIS CD2 C 9.498 -1.958 -4.684 1.00 . A A . 67 HIS CD2 1 1 12 21656 1 1 67 HIS CE1 C 9.828 -3.833 -5.762 1.00 . A A . 67 HIS CE1 1 1 12 21657 1 1 67 HIS CG C 8.989 -1.810 -5.941 1.00 . A A . 67 HIS CG 1 1 12 21658 1 1 67 HIS H H 6.923 1.407 -5.714 1.00 . A A . 67 HIS H 1 1 12 21659 1 1 67 HIS HA H 6.298 -1.015 -7.209 1.00 . A A . 67 HIS HA 1 1 12 21660 1 1 67 HIS HB2 H 8.482 -0.676 -7.670 1.00 . A A . 67 HIS HB2 1 1 12 21661 1 1 67 HIS HB3 H 8.760 0.287 -6.233 1.00 . A A . 67 HIS HB3 1 1 12 21662 1 1 67 HIS HD1 H 8.954 -3.216 -7.540 1.00 . A A . 67 HIS HD1 1 1 12 21663 1 1 67 HIS HD2 H 9.490 -1.200 -3.900 1.00 . A A . 67 HIS HD2 1 1 12 21664 1 1 67 HIS HE1 H 10.140 -4.853 -5.983 1.00 . A A . 67 HIS HE1 1 1 12 21665 1 1 67 HIS N N 6.342 0.804 -6.260 1.00 . A A . 67 HIS N 1 1 12 21666 1 1 67 HIS ND1 N 9.213 -3.008 -6.596 1.00 . A A . 67 HIS ND1 1 1 12 21667 1 1 67 HIS NE2 N 10.003 -3.180 -4.577 1.00 . A A . 67 HIS NE2 1 1 12 21668 1 1 67 HIS O O 6.258 -2.557 -5.103 1.00 . A A . 67 HIS O 1 1 12 21669 1 1 68 VAL C C 4.223 -1.120 -2.647 1.00 . A A . 68 VAL C 1 1 12 21670 1 1 68 VAL CA C 5.749 -1.158 -2.755 1.00 . A A . 68 VAL CA 1 1 12 21671 1 1 68 VAL CB C 6.449 -0.441 -1.599 1.00 . A A . 68 VAL CB 1 1 12 21672 1 1 68 VAL CG1 C 7.891 -0.928 -1.444 1.00 . A A . 68 VAL CG1 1 1 12 21673 1 1 68 VAL CG2 C 6.399 1.077 -1.785 1.00 . A A . 68 VAL CG2 1 1 12 21674 1 1 68 VAL H H 6.252 0.422 -4.016 1.00 . A A . 68 VAL H 1 1 12 21675 1 1 68 VAL HA H 6.075 -2.198 -2.754 1.00 . A A . 68 VAL HA 1 1 12 21676 1 1 68 VAL HB H 5.912 -0.683 -0.681 1.00 . A A . 68 VAL HB 1 1 12 21677 1 1 68 VAL HG11 H 7.905 -2.017 -1.410 1.00 . A A . 68 VAL HG11 1 1 12 21678 1 1 68 VAL HG12 H 8.484 -0.582 -2.290 1.00 . A A . 68 VAL HG12 1 1 12 21679 1 1 68 VAL HG13 H 8.311 -0.530 -0.520 1.00 . A A . 68 VAL HG13 1 1 12 21680 1 1 68 VAL HG21 H 5.395 1.373 -2.090 1.00 . A A . 68 VAL HG21 1 1 12 21681 1 1 68 VAL HG22 H 6.652 1.567 -0.845 1.00 . A A . 68 VAL HG22 1 1 12 21682 1 1 68 VAL HG23 H 7.114 1.372 -2.553 1.00 . A A . 68 VAL HG23 1 1 12 21683 1 1 68 VAL N N 6.156 -0.573 -4.022 1.00 . A A . 68 VAL N 1 1 12 21684 1 1 68 VAL O O 3.665 -1.420 -1.594 1.00 . A A . 68 VAL O 1 1 12 21685 1 1 69 MET C C 1.569 -1.647 -4.820 1.00 . A A . 69 MET C 1 1 12 21686 1 1 69 MET CA C 2.143 -0.667 -3.795 1.00 . A A . 69 MET CA 1 1 12 21687 1 1 69 MET CB C 1.722 0.758 -4.158 1.00 . A A . 69 MET CB 1 1 12 21688 1 1 69 MET CE C 2.580 1.830 -0.436 1.00 . A A . 69 MET CE 1 1 12 21689 1 1 69 MET CG C 2.282 1.768 -3.154 1.00 . A A . 69 MET CG 1 1 12 21690 1 1 69 MET H H 4.055 -0.507 -4.605 1.00 . A A . 69 MET H 1 1 12 21691 1 1 69 MET HA H 1.805 -0.938 -2.794 1.00 . A A . 69 MET HA 1 1 12 21692 1 1 69 MET HB2 H 2.076 1.001 -5.160 1.00 . A A . 69 MET HB2 1 1 12 21693 1 1 69 MET HB3 H 0.634 0.826 -4.179 1.00 . A A . 69 MET HB3 1 1 12 21694 1 1 69 MET HE1 H 3.269 1.000 -0.588 1.00 . A A . 69 MET HE1 1 1 12 21695 1 1 69 MET HE2 H 3.121 2.772 -0.524 1.00 . A A . 69 MET HE2 1 1 12 21696 1 1 69 MET HE3 H 2.136 1.757 0.557 1.00 . A A . 69 MET HE3 1 1 12 21697 1 1 69 MET HG2 H 3.315 1.518 -2.912 1.00 . A A . 69 MET HG2 1 1 12 21698 1 1 69 MET HG3 H 2.290 2.765 -3.595 1.00 . A A . 69 MET HG3 1 1 12 21699 1 1 69 MET N N 3.593 -0.749 -3.752 1.00 . A A . 69 MET N 1 1 12 21700 1 1 69 MET O O 0.366 -1.905 -4.831 1.00 . A A . 69 MET O 1 1 12 21701 1 1 69 MET SD S 1.291 1.766 -1.670 1.00 . A A . 69 MET SD 1 1 12 21702 1 1 70 HIS C C 2.986 -4.322 -6.662 1.00 . A A . 70 HIS C 1 1 12 21703 1 1 70 HIS CA C 2.052 -3.110 -6.684 1.00 . A A . 70 HIS CA 1 1 12 21704 1 1 70 HIS CB C 1.993 -2.431 -8.054 1.00 . A A . 70 HIS CB 1 1 12 21705 1 1 70 HIS CD2 C 0.033 -0.745 -8.441 1.00 . A A . 70 HIS CD2 1 1 12 21706 1 1 70 HIS CE1 C 1.031 1.063 -7.717 1.00 . A A . 70 HIS CE1 1 1 12 21707 1 1 70 HIS CG C 1.292 -1.094 -8.047 1.00 . A A . 70 HIS CG 1 1 12 21708 1 1 70 HIS H H 3.432 -1.950 -5.641 1.00 . A A . 70 HIS H 1 1 12 21709 1 1 70 HIS HA H 1.043 -3.435 -6.431 1.00 . A A . 70 HIS HA 1 1 12 21710 1 1 70 HIS HB2 H 3.009 -2.296 -8.425 1.00 . A A . 70 HIS HB2 1 1 12 21711 1 1 70 HIS HB3 H 1.484 -3.093 -8.755 1.00 . A A . 70 HIS HB3 1 1 12 21712 1 1 70 HIS HD1 H 2.828 0.141 -7.240 1.00 . A A . 70 HIS HD1 1 1 12 21713 1 1 70 HIS HD2 H -0.716 -1.422 -8.850 1.00 . A A . 70 HIS HD2 1 1 12 21714 1 1 70 HIS HE1 H 1.209 2.103 -7.446 1.00 . A A . 70 HIS HE1 1 1 12 21715 1 1 70 HIS N N 2.455 -2.165 -5.657 1.00 . A A . 70 HIS N 1 1 12 21716 1 1 70 HIS ND1 N 1.896 0.067 -7.596 1.00 . A A . 70 HIS ND1 1 1 12 21717 1 1 70 HIS NE2 N -0.123 0.557 -8.240 1.00 . A A . 70 HIS NE2 1 1 12 21718 1 1 70 HIS O O 2.550 -5.442 -6.399 1.00 . A A . 70 HIS O 1 1 12 21719 1 1 71 ASP C C 4.970 -6.093 -5.820 1.00 . A A . 71 ASP C 1 1 12 21720 1 1 71 ASP CA C 5.252 -5.112 -6.959 1.00 . A A . 71 ASP CA 1 1 12 21721 1 1 71 ASP CB C 6.658 -4.542 -6.756 1.00 . A A . 71 ASP CB 1 1 12 21722 1 1 71 ASP CG C 7.766 -5.264 -7.526 1.00 . A A . 71 ASP CG 1 1 12 21723 1 1 71 ASP H H 4.600 -3.143 -7.156 1.00 . A A . 71 ASP H 1 1 12 21724 1 1 71 ASP HA H 5.163 -5.576 -7.941 1.00 . A A . 71 ASP HA 1 1 12 21725 1 1 71 ASP HB2 H 6.655 -3.493 -7.051 1.00 . A A . 71 ASP HB2 1 1 12 21726 1 1 71 ASP HB3 H 6.896 -4.573 -5.692 1.00 . A A . 71 ASP HB3 1 1 12 21727 1 1 71 ASP N N 4.253 -4.057 -6.943 1.00 . A A . 71 ASP N 1 1 12 21728 1 1 71 ASP O O 4.616 -5.683 -4.716 1.00 . A A . 71 ASP O 1 1 12 21729 1 1 71 ASP OD1 O 8.161 -6.355 -7.062 1.00 . A A . 71 ASP OD1 1 1 12 21730 1 1 71 ASP OD2 O 8.191 -4.708 -8.561 1.00 . A A . 71 ASP OD2 1 1 12 21731 1 1 72 LYS C C 6.249 -8.990 -4.690 1.00 . A A . 72 LYS C 1 1 12 21732 1 1 72 LYS CA C 4.906 -8.414 -5.143 1.00 . A A . 72 LYS CA 1 1 12 21733 1 1 72 LYS CB C 3.941 -9.465 -5.694 1.00 . A A . 72 LYS CB 1 1 12 21734 1 1 72 LYS CD C 1.854 -9.859 -7.054 1.00 . A A . 72 LYS CD 1 1 12 21735 1 1 72 LYS CE C 1.116 -9.304 -8.274 1.00 . A A . 72 LYS CE 1 1 12 21736 1 1 72 LYS CG C 2.787 -8.806 -6.452 1.00 . A A . 72 LYS CG 1 1 12 21737 1 1 72 LYS H H 5.427 -7.696 -7.028 1.00 . A A . 72 LYS H 1 1 12 21738 1 1 72 LYS HA H 4.421 -7.951 -4.284 1.00 . A A . 72 LYS HA 1 1 12 21739 1 1 72 LYS HB2 H 4.476 -10.144 -6.358 1.00 . A A . 72 LYS HB2 1 1 12 21740 1 1 72 LYS HB3 H 3.546 -10.067 -4.875 1.00 . A A . 72 LYS HB3 1 1 12 21741 1 1 72 LYS HD2 H 2.430 -10.738 -7.342 1.00 . A A . 72 LYS HD2 1 1 12 21742 1 1 72 LYS HD3 H 1.132 -10.182 -6.304 1.00 . A A . 72 LYS HD3 1 1 12 21743 1 1 72 LYS HE2 H 0.293 -9.967 -8.542 1.00 . A A . 72 LYS HE2 1 1 12 21744 1 1 72 LYS HE3 H 0.678 -8.335 -8.033 1.00 . A A . 72 LYS HE3 1 1 12 21745 1 1 72 LYS HG2 H 2.225 -8.161 -5.777 1.00 . A A . 72 LYS HG2 1 1 12 21746 1 1 72 LYS HG3 H 3.183 -8.171 -7.244 1.00 . A A . 72 LYS HG3 1 1 12 21747 1 1 72 LYS HZ1 H 1.617 -8.662 -10.193 1.00 . A A . 72 LYS HZ1 1 1 12 21748 1 1 72 LYS HZ2 H 2.884 -8.658 -9.169 1.00 . A A . 72 LYS HZ2 1 1 12 21749 1 1 72 LYS N N 5.138 -7.371 -6.127 1.00 . A A . 72 LYS N 1 1 12 21750 1 1 72 LYS NZ N 2.041 -9.164 -9.421 1.00 . A A . 72 LYS NZ 1 1 12 21751 1 1 72 LYS O O 6.404 -9.377 -3.533 1.00 . A A . 72 LYS O 1 1 12 21752 1 1 73 ASN C C 9.244 -8.584 -4.406 1.00 . A A . 73 ASN C 1 1 12 21753 1 1 73 ASN CA C 8.511 -9.552 -5.337 1.00 . A A . 73 ASN CA 1 1 12 21754 1 1 73 ASN CB C 9.337 -9.695 -6.617 1.00 . A A . 73 ASN CB 1 1 12 21755 1 1 73 ASN CG C 9.136 -11.073 -7.248 1.00 . A A . 73 ASN CG 1 1 12 21756 1 1 73 ASN H H 7.052 -8.712 -6.565 1.00 . A A . 73 ASN H 1 1 12 21757 1 1 73 ASN HA H 8.341 -10.525 -4.877 1.00 . A A . 73 ASN HA 1 1 12 21758 1 1 73 ASN HB2 H 9.050 -8.920 -7.328 1.00 . A A . 73 ASN HB2 1 1 12 21759 1 1 73 ASN HB3 H 10.393 -9.545 -6.391 1.00 . A A . 73 ASN HB3 1 1 12 21760 1 1 73 ASN HD21 H 10.186 -11.877 -5.715 1.00 . A A . 73 ASN HD21 1 1 12 21761 1 1 73 ASN HD22 H 9.614 -13.009 -6.895 1.00 . A A . 73 ASN HD22 1 1 12 21762 1 1 73 ASN N N 7.186 -9.029 -5.626 1.00 . A A . 73 ASN N 1 1 12 21763 1 1 73 ASN ND2 N 9.691 -12.069 -6.563 1.00 . A A . 73 ASN ND2 1 1 12 21764 1 1 73 ASN O O 10.273 -8.020 -4.777 1.00 . A A . 73 ASN O 1 1 12 21765 1 1 73 ASN OD1 O 8.517 -11.224 -8.289 1.00 . A A . 73 ASN OD1 1 1 12 21766 1 1 74 THR C C 9.506 -8.274 -0.911 1.00 . A A . 74 THR C 1 1 12 21767 1 1 74 THR CA C 9.275 -7.532 -2.229 1.00 . A A . 74 THR CA 1 1 12 21768 1 1 74 THR CB C 8.361 -6.313 -2.087 1.00 . A A . 74 THR CB 1 1 12 21769 1 1 74 THR CG2 C 8.113 -5.608 -3.423 1.00 . A A . 74 THR CG2 1 1 12 21770 1 1 74 THR H H 7.850 -8.884 -2.922 1.00 . A A . 74 THR H 1 1 12 21771 1 1 74 THR HA H 10.252 -7.214 -2.592 1.00 . A A . 74 THR HA 1 1 12 21772 1 1 74 THR HB H 8.753 -5.616 -1.347 1.00 . A A . 74 THR HB 1 1 12 21773 1 1 74 THR HG1 H 7.186 -7.475 -0.958 1.00 . A A . 74 THR HG1 1 1 12 21774 1 1 74 THR HG21 H 8.604 -6.163 -4.223 1.00 . A A . 74 THR HG21 1 1 12 21775 1 1 74 THR HG22 H 7.042 -5.563 -3.616 1.00 . A A . 74 THR HG22 1 1 12 21776 1 1 74 THR HG23 H 8.518 -4.597 -3.381 1.00 . A A . 74 THR HG23 1 1 12 21777 1 1 74 THR N N 8.687 -8.422 -3.216 1.00 . A A . 74 THR N 1 1 12 21778 1 1 74 THR O O 8.827 -9.259 -0.622 1.00 . A A . 74 THR O 1 1 12 21779 1 1 74 THR OG1 O 7.093 -6.867 -1.747 1.00 . A A . 74 THR OG1 1 1 12 21780 1 1 75 LYS C C 9.598 -8.246 2.076 1.00 . A A . 75 LYS C 1 1 12 21781 1 1 75 LYS CA C 10.795 -8.378 1.132 1.00 . A A . 75 LYS CA 1 1 12 21782 1 1 75 LYS CB C 12.088 -7.779 1.691 1.00 . A A . 75 LYS CB 1 1 12 21783 1 1 75 LYS CD C 12.854 -7.328 4.050 1.00 . A A . 75 LYS CD 1 1 12 21784 1 1 75 LYS CE C 14.299 -7.534 4.510 1.00 . A A . 75 LYS CE 1 1 12 21785 1 1 75 LYS CG C 12.441 -8.403 3.043 1.00 . A A . 75 LYS CG 1 1 12 21786 1 1 75 LYS H H 11.013 -6.973 -0.390 1.00 . A A . 75 LYS H 1 1 12 21787 1 1 75 LYS HA H 10.981 -9.438 0.956 1.00 . A A . 75 LYS HA 1 1 12 21788 1 1 75 LYS HB2 H 12.903 -7.943 0.986 1.00 . A A . 75 LYS HB2 1 1 12 21789 1 1 75 LYS HB3 H 11.975 -6.701 1.801 1.00 . A A . 75 LYS HB3 1 1 12 21790 1 1 75 LYS HD2 H 12.750 -6.341 3.599 1.00 . A A . 75 LYS HD2 1 1 12 21791 1 1 75 LYS HD3 H 12.187 -7.356 4.912 1.00 . A A . 75 LYS HD3 1 1 12 21792 1 1 75 LYS HE2 H 14.808 -8.220 3.833 1.00 . A A . 75 LYS HE2 1 1 12 21793 1 1 75 LYS HE3 H 14.838 -6.588 4.471 1.00 . A A . 75 LYS HE3 1 1 12 21794 1 1 75 LYS HG2 H 11.585 -8.956 3.427 1.00 . A A . 75 LYS HG2 1 1 12 21795 1 1 75 LYS HG3 H 13.253 -9.119 2.916 1.00 . A A . 75 LYS HG3 1 1 12 21796 1 1 75 LYS HZ1 H 14.930 -7.525 6.497 1.00 . A A . 75 LYS HZ1 1 1 12 21797 1 1 75 LYS HZ2 H 13.412 -8.084 6.314 1.00 . A A . 75 LYS HZ2 1 1 12 21798 1 1 75 LYS N N 10.466 -7.774 -0.147 1.00 . A A . 75 LYS N 1 1 12 21799 1 1 75 LYS NZ N 14.332 -8.073 5.889 1.00 . A A . 75 LYS NZ 1 1 12 21800 1 1 75 LYS O O 9.441 -9.043 3.000 1.00 . A A . 75 LYS O 1 1 12 21801 1 1 76 PHE C C 6.329 -7.130 1.799 1.00 . A A . 76 PHE C 1 1 12 21802 1 1 76 PHE CA C 7.608 -6.987 2.627 1.00 . A A . 76 PHE CA 1 1 12 21803 1 1 76 PHE CB C 7.727 -5.542 3.114 1.00 . A A . 76 PHE CB 1 1 12 21804 1 1 76 PHE CD1 C 8.914 -5.836 5.319 1.00 . A A . 76 PHE CD1 1 1 12 21805 1 1 76 PHE CD2 C 9.983 -4.537 3.621 1.00 . A A . 76 PHE CD2 1 1 12 21806 1 1 76 PHE CE1 C 10.031 -5.605 6.199 1.00 . A A . 76 PHE CE1 1 1 12 21807 1 1 76 PHE CE2 C 11.100 -4.306 4.501 1.00 . A A . 76 PHE CE2 1 1 12 21808 1 1 76 PHE CG C 8.914 -5.297 4.049 1.00 . A A . 76 PHE CG 1 1 12 21809 1 1 76 PHE CZ C 11.069 -4.852 5.746 1.00 . A A . 76 PHE CZ 1 1 12 21810 1 1 76 PHE H H 8.920 -6.591 1.058 1.00 . A A . 76 PHE H 1 1 12 21811 1 1 76 PHE HA H 7.595 -7.723 3.431 1.00 . A A . 76 PHE HA 1 1 12 21812 1 1 76 PHE HB2 H 7.817 -4.884 2.250 1.00 . A A . 76 PHE HB2 1 1 12 21813 1 1 76 PHE HB3 H 6.808 -5.266 3.631 1.00 . A A . 76 PHE HB3 1 1 12 21814 1 1 76 PHE HD1 H 8.069 -6.436 5.657 1.00 . A A . 76 PHE HD1 1 1 12 21815 1 1 76 PHE HD2 H 9.983 -4.112 2.618 1.00 . A A . 76 PHE HD2 1 1 12 21816 1 1 76 PHE HE1 H 10.044 -6.024 7.205 1.00 . A A . 76 PHE HE1 1 1 12 21817 1 1 76 PHE HE2 H 11.951 -3.708 4.175 1.00 . A A . 76 PHE HE2 1 1 12 21818 1 1 76 PHE HZ H 11.896 -4.748 6.494 1.00 . A A . 76 PHE HZ 1 1 12 21819 1 1 76 PHE N N 8.785 -7.234 1.812 1.00 . A A . 76 PHE N 1 1 12 21820 1 1 76 PHE O O 6.355 -6.982 0.578 1.00 . A A . 76 PHE O 1 1 12 21821 1 1 77 LYS C C 3.539 -6.252 1.201 1.00 . A A . 77 LYS C 1 1 12 21822 1 1 77 LYS CA C 3.952 -7.578 1.842 1.00 . A A . 77 LYS CA 1 1 12 21823 1 1 77 LYS CB C 2.919 -8.136 2.823 1.00 . A A . 77 LYS CB 1 1 12 21824 1 1 77 LYS CD C 3.113 -10.334 4.044 1.00 . A A . 77 LYS CD 1 1 12 21825 1 1 77 LYS CE C 4.619 -10.385 4.310 1.00 . A A . 77 LYS CE 1 1 12 21826 1 1 77 LYS CG C 2.816 -9.658 2.704 1.00 . A A . 77 LYS CG 1 1 12 21827 1 1 77 LYS H H 5.226 -7.532 3.490 1.00 . A A . 77 LYS H 1 1 12 21828 1 1 77 LYS HA H 4.080 -8.319 1.053 1.00 . A A . 77 LYS HA 1 1 12 21829 1 1 77 LYS HB2 H 3.196 -7.865 3.842 1.00 . A A . 77 LYS HB2 1 1 12 21830 1 1 77 LYS HB3 H 1.946 -7.686 2.627 1.00 . A A . 77 LYS HB3 1 1 12 21831 1 1 77 LYS HD2 H 2.615 -9.792 4.847 1.00 . A A . 77 LYS HD2 1 1 12 21832 1 1 77 LYS HD3 H 2.706 -11.346 4.043 1.00 . A A . 77 LYS HD3 1 1 12 21833 1 1 77 LYS HE2 H 5.096 -9.495 3.900 1.00 . A A . 77 LYS HE2 1 1 12 21834 1 1 77 LYS HE3 H 4.804 -10.379 5.384 1.00 . A A . 77 LYS HE3 1 1 12 21835 1 1 77 LYS HG2 H 1.816 -9.933 2.368 1.00 . A A . 77 LYS HG2 1 1 12 21836 1 1 77 LYS HG3 H 3.516 -10.016 1.949 1.00 . A A . 77 LYS HG3 1 1 12 21837 1 1 77 LYS HZ1 H 4.890 -12.445 4.160 1.00 . A A . 77 LYS HZ1 1 1 12 21838 1 1 77 LYS HZ2 H 4.978 -11.685 2.722 1.00 . A A . 77 LYS HZ2 1 1 12 21839 1 1 77 LYS N N 5.239 -7.414 2.497 1.00 . A A . 77 LYS N 1 1 12 21840 1 1 77 LYS NZ N 5.212 -11.598 3.705 1.00 . A A . 77 LYS NZ 1 1 12 21841 1 1 77 LYS O O 3.500 -5.221 1.870 1.00 . A A . 77 LYS O 1 1 12 21842 1 1 78 SER C C 1.306 -5.107 -0.958 1.00 . A A . 78 SER C 1 1 12 21843 1 1 78 SER CA C 2.830 -5.141 -0.827 1.00 . A A . 78 SER CA 1 1 12 21844 1 1 78 SER CB C 3.482 -5.102 -2.210 1.00 . A A . 78 SER CB 1 1 12 21845 1 1 78 SER H H 3.272 -7.166 -0.624 1.00 . A A . 78 SER H 1 1 12 21846 1 1 78 SER HA H 3.182 -4.295 -0.236 1.00 . A A . 78 SER HA 1 1 12 21847 1 1 78 SER HB2 H 3.549 -4.069 -2.551 1.00 . A A . 78 SER HB2 1 1 12 21848 1 1 78 SER HB3 H 4.502 -5.482 -2.141 1.00 . A A . 78 SER HB3 1 1 12 21849 1 1 78 SER HG H 3.242 -5.881 -4.038 1.00 . A A . 78 SER HG 1 1 12 21850 1 1 78 SER N N 3.239 -6.323 -0.088 1.00 . A A . 78 SER N 1 1 12 21851 1 1 78 SER O O 0.646 -6.139 -0.845 1.00 . A A . 78 SER O 1 1 12 21852 1 1 78 SER OG O 2.754 -5.870 -3.165 1.00 . A A . 78 SER OG 1 1 12 21853 1 1 79 CYS C C -1.179 -4.841 -2.243 1.00 . A A . 79 CYS C 1 1 12 21854 1 1 79 CYS CA C -0.644 -3.727 -1.341 1.00 . A A . 79 CYS CA 1 1 12 21855 1 1 79 CYS CB C -0.985 -2.339 -1.885 1.00 . A A . 79 CYS CB 1 1 12 21856 1 1 79 CYS H H 1.334 -3.075 -1.284 1.00 . A A . 79 CYS H 1 1 12 21857 1 1 79 CYS HA H -1.073 -3.799 -0.341 1.00 . A A . 79 CYS HA 1 1 12 21858 1 1 79 CYS HB2 H -0.659 -2.280 -2.923 1.00 . A A . 79 CYS HB2 1 1 12 21859 1 1 79 CYS HB3 H -2.069 -2.220 -1.884 1.00 . A A . 79 CYS HB3 1 1 12 21860 1 1 79 CYS N N 0.790 -3.909 -1.194 1.00 . A A . 79 CYS N 1 1 12 21861 1 1 79 CYS O O -1.933 -5.702 -1.792 1.00 . A A . 79 CYS O 1 1 12 21862 1 1 79 CYS SG S -0.242 -0.947 -0.957 1.00 . A A . 79 CYS SG 1 1 12 21863 1 1 80 VAL C C -0.681 -7.157 -4.049 1.00 . A A . 80 VAL C 1 1 12 21864 1 1 80 VAL CA C -1.198 -5.781 -4.472 1.00 . A A . 80 VAL CA 1 1 12 21865 1 1 80 VAL CB C -0.740 -5.375 -5.874 1.00 . A A . 80 VAL CB 1 1 12 21866 1 1 80 VAL CG1 C -1.097 -6.452 -6.900 1.00 . A A . 80 VAL CG1 1 1 12 21867 1 1 80 VAL CG2 C -1.330 -4.021 -6.273 1.00 . A A . 80 VAL CG2 1 1 12 21868 1 1 80 VAL H H -0.156 -4.084 -3.861 1.00 . A A . 80 VAL H 1 1 12 21869 1 1 80 VAL HA H -2.288 -5.798 -4.464 1.00 . A A . 80 VAL HA 1 1 12 21870 1 1 80 VAL HB H 0.345 -5.275 -5.856 1.00 . A A . 80 VAL HB 1 1 12 21871 1 1 80 VAL HG11 H -1.358 -7.375 -6.383 1.00 . A A . 80 VAL HG11 1 1 12 21872 1 1 80 VAL HG12 H -1.945 -6.118 -7.498 1.00 . A A . 80 VAL HG12 1 1 12 21873 1 1 80 VAL HG13 H -0.241 -6.631 -7.551 1.00 . A A . 80 VAL HG13 1 1 12 21874 1 1 80 VAL HG21 H -1.199 -3.313 -5.455 1.00 . A A . 80 VAL HG21 1 1 12 21875 1 1 80 VAL HG22 H -0.818 -3.649 -7.161 1.00 . A A . 80 VAL HG22 1 1 12 21876 1 1 80 VAL HG23 H -2.392 -4.136 -6.488 1.00 . A A . 80 VAL HG23 1 1 12 21877 1 1 80 VAL N N -0.769 -4.788 -3.502 1.00 . A A . 80 VAL N 1 1 12 21878 1 1 80 VAL O O -1.362 -8.164 -4.234 1.00 . A A . 80 VAL O 1 1 12 21879 1 1 81 GLY C C 0.196 -9.169 -2.114 1.00 . A A . 81 GLY C 1 1 12 21880 1 1 81 GLY CA C 1.136 -8.392 -3.038 1.00 . A A . 81 GLY CA 1 1 12 21881 1 1 81 GLY H H 1.067 -6.333 -3.341 1.00 . A A . 81 GLY H 1 1 12 21882 1 1 81 GLY HA2 H 1.396 -9.008 -3.899 1.00 . A A . 81 GLY HA2 1 1 12 21883 1 1 81 GLY HA3 H 2.065 -8.170 -2.513 1.00 . A A . 81 GLY HA3 1 1 12 21884 1 1 81 GLY N N 0.520 -7.156 -3.488 1.00 . A A . 81 GLY N 1 1 12 21885 1 1 81 GLY O O -0.174 -10.304 -2.411 1.00 . A A . 81 GLY O 1 1 12 21886 1 1 82 CYS C C -2.408 -9.373 -0.713 1.00 . A A . 82 CYS C 1 1 12 21887 1 1 82 CYS CA C -1.052 -9.144 -0.043 1.00 . A A . 82 CYS CA 1 1 12 21888 1 1 82 CYS CB C -1.179 -8.298 1.227 1.00 . A A . 82 CYS CB 1 1 12 21889 1 1 82 CYS H H 0.143 -7.604 -0.778 1.00 . A A . 82 CYS H 1 1 12 21890 1 1 82 CYS HA H -0.596 -10.091 0.243 1.00 . A A . 82 CYS HA 1 1 12 21891 1 1 82 CYS HB2 H -0.191 -8.106 1.646 1.00 . A A . 82 CYS HB2 1 1 12 21892 1 1 82 CYS HB3 H -1.617 -7.329 0.986 1.00 . A A . 82 CYS HB3 1 1 12 21893 1 1 82 CYS N N -0.163 -8.527 -1.012 1.00 . A A . 82 CYS N 1 1 12 21894 1 1 82 CYS O O -3.001 -10.441 -0.571 1.00 . A A . 82 CYS O 1 1 12 21895 1 1 82 CYS SG S -2.221 -9.166 2.455 1.00 . A A . 82 CYS SG 1 1 12 21896 1 1 83 HIS C C -4.165 -9.684 -3.000 1.00 . A A . 83 HIS C 1 1 12 21897 1 1 83 HIS CA C -4.134 -8.432 -2.121 1.00 . A A . 83 HIS CA 1 1 12 21898 1 1 83 HIS CB C -4.404 -7.148 -2.908 1.00 . A A . 83 HIS CB 1 1 12 21899 1 1 83 HIS CD2 C -4.809 -5.759 -0.731 1.00 . A A . 83 HIS CD2 1 1 12 21900 1 1 83 HIS CE1 C -5.989 -4.140 -1.609 1.00 . A A . 83 HIS CE1 1 1 12 21901 1 1 83 HIS CG C -4.931 -6.010 -2.066 1.00 . A A . 83 HIS CG 1 1 12 21902 1 1 83 HIS H H -2.370 -7.489 -1.540 1.00 . A A . 83 HIS H 1 1 12 21903 1 1 83 HIS HA H -4.902 -8.518 -1.353 1.00 . A A . 83 HIS HA 1 1 12 21904 1 1 83 HIS HB2 H -3.481 -6.830 -3.393 1.00 . A A . 83 HIS HB2 1 1 12 21905 1 1 83 HIS HB3 H -5.122 -7.363 -3.700 1.00 . A A . 83 HIS HB3 1 1 12 21906 1 1 83 HIS HD1 H -5.943 -4.869 -3.552 1.00 . A A . 83 HIS HD1 1 1 12 21907 1 1 83 HIS HD2 H -4.277 -6.382 -0.012 1.00 . A A . 83 HIS HD2 1 1 12 21908 1 1 83 HIS HE1 H -6.574 -3.225 -1.705 1.00 . A A . 83 HIS HE1 1 1 12 21909 1 1 83 HIS N N -2.859 -8.354 -1.429 1.00 . A A . 83 HIS N 1 1 12 21910 1 1 83 HIS ND1 N -5.680 -4.972 -2.592 1.00 . A A . 83 HIS ND1 1 1 12 21911 1 1 83 HIS NE2 N -5.448 -4.629 -0.457 1.00 . A A . 83 HIS NE2 1 1 12 21912 1 1 83 HIS O O -5.159 -10.408 -3.020 1.00 . A A . 83 HIS O 1 1 12 21913 1 1 84 VAL C C -3.173 -12.330 -3.774 1.00 . A A . 84 VAL C 1 1 12 21914 1 1 84 VAL CA C -2.954 -11.051 -4.585 1.00 . A A . 84 VAL CA 1 1 12 21915 1 1 84 VAL CB C -1.608 -11.027 -5.312 1.00 . A A . 84 VAL CB 1 1 12 21916 1 1 84 VAL CG1 C -1.382 -12.325 -6.090 1.00 . A A . 84 VAL CG1 1 1 12 21917 1 1 84 VAL CG2 C -1.505 -9.810 -6.234 1.00 . A A . 84 VAL CG2 1 1 12 21918 1 1 84 VAL H H -2.261 -9.306 -3.684 1.00 . A A . 84 VAL H 1 1 12 21919 1 1 84 VAL HA H -3.743 -10.971 -5.333 1.00 . A A . 84 VAL HA 1 1 12 21920 1 1 84 VAL HB H -0.823 -10.945 -4.561 1.00 . A A . 84 VAL HB 1 1 12 21921 1 1 84 VAL HG11 H -2.316 -12.638 -6.555 1.00 . A A . 84 VAL HG11 1 1 12 21922 1 1 84 VAL HG12 H -0.629 -12.160 -6.861 1.00 . A A . 84 VAL HG12 1 1 12 21923 1 1 84 VAL HG13 H -1.038 -13.102 -5.407 1.00 . A A . 84 VAL HG13 1 1 12 21924 1 1 84 VAL HG21 H -2.381 -9.176 -6.098 1.00 . A A . 84 VAL HG21 1 1 12 21925 1 1 84 VAL HG22 H -0.605 -9.245 -5.990 1.00 . A A . 84 VAL HG22 1 1 12 21926 1 1 84 VAL HG23 H -1.455 -10.143 -7.271 1.00 . A A . 84 VAL HG23 1 1 12 21927 1 1 84 VAL N N -3.065 -9.900 -3.706 1.00 . A A . 84 VAL N 1 1 12 21928 1 1 84 VAL O O -3.791 -13.278 -4.257 1.00 . A A . 84 VAL O 1 1 12 21929 1 1 85 GLU C C -4.206 -13.543 -1.114 1.00 . A A . 85 GLU C 1 1 12 21930 1 1 85 GLU CA C -2.783 -13.462 -1.672 1.00 . A A . 85 GLU CA 1 1 12 21931 1 1 85 GLU CB C -1.753 -13.404 -0.543 1.00 . A A . 85 GLU CB 1 1 12 21932 1 1 85 GLU CD C -0.396 -15.398 0.191 1.00 . A A . 85 GLU CD 1 1 12 21933 1 1 85 GLU CG C -0.547 -14.292 -0.855 1.00 . A A . 85 GLU CG 1 1 12 21934 1 1 85 GLU H H -2.152 -11.540 -2.170 1.00 . A A . 85 GLU H 1 1 12 21935 1 1 85 GLU HA H -2.581 -14.332 -2.296 1.00 . A A . 85 GLU HA 1 1 12 21936 1 1 85 GLU HB2 H -1.424 -12.375 -0.399 1.00 . A A . 85 GLU HB2 1 1 12 21937 1 1 85 GLU HB3 H -2.214 -13.725 0.391 1.00 . A A . 85 GLU HB3 1 1 12 21938 1 1 85 GLU HG2 H -0.663 -14.735 -1.844 1.00 . A A . 85 GLU HG2 1 1 12 21939 1 1 85 GLU HG3 H 0.358 -13.686 -0.882 1.00 . A A . 85 GLU HG3 1 1 12 21940 1 1 85 GLU N N -2.653 -12.315 -2.555 1.00 . A A . 85 GLU N 1 1 12 21941 1 1 85 GLU O O -4.733 -14.634 -0.905 1.00 . A A . 85 GLU O 1 1 12 21942 1 1 85 GLU OE1 O -1.169 -16.376 0.099 1.00 . A A . 85 GLU OE1 1 1 12 21943 1 1 85 GLU OE2 O 0.490 -15.241 1.059 1.00 . A A . 85 GLU OE2 1 1 12 21944 1 1 86 VAL C C -7.132 -12.690 -1.450 1.00 . A A . 86 VAL C 1 1 12 21945 1 1 86 VAL CA C -6.136 -12.298 -0.357 1.00 . A A . 86 VAL CA 1 1 12 21946 1 1 86 VAL CB C -6.396 -10.904 0.217 1.00 . A A . 86 VAL CB 1 1 12 21947 1 1 86 VAL CG1 C -7.828 -10.786 0.743 1.00 . A A . 86 VAL CG1 1 1 12 21948 1 1 86 VAL CG2 C -5.381 -10.562 1.309 1.00 . A A . 86 VAL CG2 1 1 12 21949 1 1 86 VAL H H -4.350 -11.490 -1.061 1.00 . A A . 86 VAL H 1 1 12 21950 1 1 86 VAL HA H -6.210 -13.018 0.459 1.00 . A A . 86 VAL HA 1 1 12 21951 1 1 86 VAL HB H -6.276 -10.182 -0.590 1.00 . A A . 86 VAL HB 1 1 12 21952 1 1 86 VAL HG11 H -8.509 -11.292 0.060 1.00 . A A . 86 VAL HG11 1 1 12 21953 1 1 86 VAL HG12 H -7.892 -11.248 1.729 1.00 . A A . 86 VAL HG12 1 1 12 21954 1 1 86 VAL HG13 H -8.103 -9.734 0.817 1.00 . A A . 86 VAL HG13 1 1 12 21955 1 1 86 VAL HG21 H -4.538 -11.252 1.250 1.00 . A A . 86 VAL HG21 1 1 12 21956 1 1 86 VAL HG22 H -5.025 -9.542 1.168 1.00 . A A . 86 VAL HG22 1 1 12 21957 1 1 86 VAL HG23 H -5.855 -10.650 2.286 1.00 . A A . 86 VAL HG23 1 1 12 21958 1 1 86 VAL N N -4.786 -12.373 -0.888 1.00 . A A . 86 VAL N 1 1 12 21959 1 1 86 VAL O O -7.970 -13.568 -1.247 1.00 . A A . 86 VAL O 1 1 12 21960 1 1 87 ALA C C -7.650 -13.713 -4.212 1.00 . A A . 87 ALA C 1 1 12 21961 1 1 87 ALA CA C -7.887 -12.287 -3.713 1.00 . A A . 87 ALA CA 1 1 12 21962 1 1 87 ALA CB C -7.652 -11.240 -4.803 1.00 . A A . 87 ALA CB 1 1 12 21963 1 1 87 ALA H H -6.324 -11.308 -2.744 1.00 . A A . 87 ALA H 1 1 12 21964 1 1 87 ALA HA H -8.915 -12.201 -3.359 1.00 . A A . 87 ALA HA 1 1 12 21965 1 1 87 ALA HB1 H -7.628 -10.247 -4.355 1.00 . A A . 87 ALA HB1 1 1 12 21966 1 1 87 ALA HB2 H -6.701 -11.438 -5.298 1.00 . A A . 87 ALA HB2 1 1 12 21967 1 1 87 ALA HB3 H -8.459 -11.289 -5.534 1.00 . A A . 87 ALA HB3 1 1 12 21968 1 1 87 ALA N N -7.008 -12.020 -2.587 1.00 . A A . 87 ALA N 1 1 12 21969 1 1 87 ALA O O -8.517 -14.302 -4.856 1.00 . A A . 87 ALA O 1 1 12 21970 1 1 88 GLY C C -6.656 -15.890 -5.700 1.00 . A A . 88 GLY C 1 1 12 21971 1 1 88 GLY CA C -6.108 -15.574 -4.307 1.00 . A A . 88 GLY CA 1 1 12 21972 1 1 88 GLY H H -5.770 -13.743 -3.373 1.00 . A A . 88 GLY H 1 1 12 21973 1 1 88 GLY HA2 H -5.023 -15.679 -4.306 1.00 . A A . 88 GLY HA2 1 1 12 21974 1 1 88 GLY HA3 H -6.497 -16.294 -3.587 1.00 . A A . 88 GLY HA3 1 1 12 21975 1 1 88 GLY N N -6.470 -14.228 -3.897 1.00 . A A . 88 GLY N 1 1 12 21976 1 1 88 GLY O O -6.301 -15.229 -6.675 1.00 . A A . 88 GLY O 1 1 12 21977 1 1 89 ALA C C -9.529 -16.743 -7.102 1.00 . A A . 89 ALA C 1 1 12 21978 1 1 89 ALA CA C -8.111 -17.311 -7.008 1.00 . A A . 89 ALA CA 1 1 12 21979 1 1 89 ALA CB C -8.087 -18.838 -7.110 1.00 . A A . 89 ALA CB 1 1 12 21980 1 1 89 ALA H H -7.795 -17.432 -4.952 1.00 . A A . 89 ALA H 1 1 12 21981 1 1 89 ALA HA H -7.508 -16.896 -7.815 1.00 . A A . 89 ALA HA 1 1 12 21982 1 1 89 ALA HB1 H -8.446 -19.270 -6.176 1.00 . A A . 89 ALA HB1 1 1 12 21983 1 1 89 ALA HB2 H -8.731 -19.157 -7.930 1.00 . A A . 89 ALA HB2 1 1 12 21984 1 1 89 ALA HB3 H -7.067 -19.173 -7.297 1.00 . A A . 89 ALA HB3 1 1 12 21985 1 1 89 ALA N N -7.511 -16.900 -5.750 1.00 . A A . 89 ALA N 1 1 12 21986 1 1 89 ALA O O -10.506 -17.473 -6.939 1.00 . A A . 89 ALA O 1 1 12 21987 1 1 90 ASP C C -10.716 -13.528 -8.357 1.00 . A A . 90 ASP C 1 1 12 21988 1 1 90 ASP CA C -10.877 -14.772 -7.481 1.00 . A A . 90 ASP CA 1 1 12 21989 1 1 90 ASP CB C -11.391 -14.322 -6.111 1.00 . A A . 90 ASP CB 1 1 12 21990 1 1 90 ASP CG C -12.883 -13.991 -6.056 1.00 . A A . 90 ASP CG 1 1 12 21991 1 1 90 ASP H H -8.796 -14.860 -7.495 1.00 . A A . 90 ASP H 1 1 12 21992 1 1 90 ASP HA H -11.549 -15.508 -7.922 1.00 . A A . 90 ASP HA 1 1 12 21993 1 1 90 ASP HB2 H -11.181 -15.108 -5.385 1.00 . A A . 90 ASP HB2 1 1 12 21994 1 1 90 ASP HB3 H -10.827 -13.443 -5.799 1.00 . A A . 90 ASP HB3 1 1 12 21995 1 1 90 ASP N N -9.596 -15.446 -7.364 1.00 . A A . 90 ASP N 1 1 12 21996 1 1 90 ASP O O -10.398 -12.450 -7.857 1.00 . A A . 90 ASP O 1 1 12 21997 1 1 90 ASP OD1 O -13.566 -14.283 -7.062 1.00 . A A . 90 ASP OD1 1 1 12 21998 1 1 90 ASP OD2 O -13.307 -13.454 -5.010 1.00 . A A . 90 ASP OD2 1 1 12 21999 1 1 91 ALA C C -11.405 -11.353 -9.978 1.00 . A A . 91 ALA C 1 1 12 22000 1 1 91 ALA CA C -10.826 -12.626 -10.598 1.00 . A A . 91 ALA CA 1 1 12 22001 1 1 91 ALA CB C -11.524 -13.008 -11.905 1.00 . A A . 91 ALA CB 1 1 12 22002 1 1 91 ALA H H -11.201 -14.599 -10.046 1.00 . A A . 91 ALA H 1 1 12 22003 1 1 91 ALA HA H -9.766 -12.472 -10.799 1.00 . A A . 91 ALA HA 1 1 12 22004 1 1 91 ALA HB1 H -11.225 -14.015 -12.196 1.00 . A A . 91 ALA HB1 1 1 12 22005 1 1 91 ALA HB2 H -12.604 -12.978 -11.762 1.00 . A A . 91 ALA HB2 1 1 12 22006 1 1 91 ALA HB3 H -11.241 -12.304 -12.687 1.00 . A A . 91 ALA HB3 1 1 12 22007 1 1 91 ALA N N -10.943 -13.719 -9.648 1.00 . A A . 91 ALA N 1 1 12 22008 1 1 91 ALA O O -10.739 -10.320 -9.936 1.00 . A A . 91 ALA O 1 1 12 22009 1 1 92 ALA C C -12.326 -9.575 -8.017 1.00 . A A . 92 ALA C 1 1 12 22010 1 1 92 ALA CA C -13.317 -10.340 -8.896 1.00 . A A . 92 ALA CA 1 1 12 22011 1 1 92 ALA CB C -14.531 -10.839 -8.110 1.00 . A A . 92 ALA CB 1 1 12 22012 1 1 92 ALA H H -13.175 -12.313 -9.550 1.00 . A A . 92 ALA H 1 1 12 22013 1 1 92 ALA HA H -13.662 -9.684 -9.696 1.00 . A A . 92 ALA HA 1 1 12 22014 1 1 92 ALA HB1 H -14.455 -11.918 -7.971 1.00 . A A . 92 ALA HB1 1 1 12 22015 1 1 92 ALA HB2 H -14.559 -10.349 -7.137 1.00 . A A . 92 ALA HB2 1 1 12 22016 1 1 92 ALA HB3 H -15.441 -10.606 -8.661 1.00 . A A . 92 ALA HB3 1 1 12 22017 1 1 92 ALA N N -12.640 -11.469 -9.512 1.00 . A A . 92 ALA N 1 1 12 22018 1 1 92 ALA O O -12.008 -8.420 -8.294 1.00 . A A . 92 ALA O 1 1 12 22019 1 1 93 LYS C C -9.609 -9.361 -6.787 1.00 . A A . 93 LYS C 1 1 12 22020 1 1 93 LYS CA C -10.919 -9.648 -6.051 1.00 . A A . 93 LYS CA 1 1 12 22021 1 1 93 LYS CB C -10.747 -10.527 -4.810 1.00 . A A . 93 LYS CB 1 1 12 22022 1 1 93 LYS CD C -11.474 -10.665 -2.399 1.00 . A A . 93 LYS CD 1 1 12 22023 1 1 93 LYS CE C -11.609 -12.166 -2.134 1.00 . A A . 93 LYS CE 1 1 12 22024 1 1 93 LYS CG C -11.901 -10.320 -3.828 1.00 . A A . 93 LYS CG 1 1 12 22025 1 1 93 LYS H H -12.131 -11.190 -6.755 1.00 . A A . 93 LYS H 1 1 12 22026 1 1 93 LYS HA H -11.343 -8.701 -5.718 1.00 . A A . 93 LYS HA 1 1 12 22027 1 1 93 LYS HB2 H -10.700 -11.575 -5.106 1.00 . A A . 93 LYS HB2 1 1 12 22028 1 1 93 LYS HB3 H -9.802 -10.292 -4.321 1.00 . A A . 93 LYS HB3 1 1 12 22029 1 1 93 LYS HD2 H -10.441 -10.356 -2.240 1.00 . A A . 93 LYS HD2 1 1 12 22030 1 1 93 LYS HD3 H -12.086 -10.111 -1.689 1.00 . A A . 93 LYS HD3 1 1 12 22031 1 1 93 LYS HE2 H -12.641 -12.479 -2.294 1.00 . A A . 93 LYS HE2 1 1 12 22032 1 1 93 LYS HE3 H -10.994 -12.723 -2.841 1.00 . A A . 93 LYS HE3 1 1 12 22033 1 1 93 LYS HG2 H -12.238 -9.285 -3.870 1.00 . A A . 93 LYS HG2 1 1 12 22034 1 1 93 LYS HG3 H -12.747 -10.943 -4.118 1.00 . A A . 93 LYS HG3 1 1 12 22035 1 1 93 LYS HZ1 H -11.671 -13.309 -0.393 1.00 . A A . 93 LYS HZ1 1 1 12 22036 1 1 93 LYS HZ2 H -10.201 -12.670 -0.682 1.00 . A A . 93 LYS HZ2 1 1 12 22037 1 1 93 LYS N N -11.867 -10.250 -6.973 1.00 . A A . 93 LYS N 1 1 12 22038 1 1 93 LYS NZ N -11.196 -12.487 -0.750 1.00 . A A . 93 LYS NZ 1 1 12 22039 1 1 93 LYS O O -8.916 -8.394 -6.475 1.00 . A A . 93 LYS O 1 1 12 22040 1 1 94 LYS C C -8.220 -8.838 -9.433 1.00 . A A . 94 LYS C 1 1 12 22041 1 1 94 LYS CA C -8.094 -10.070 -8.535 1.00 . A A . 94 LYS CA 1 1 12 22042 1 1 94 LYS CB C -7.787 -11.359 -9.298 1.00 . A A . 94 LYS CB 1 1 12 22043 1 1 94 LYS CD C -6.103 -13.226 -9.501 1.00 . A A . 94 LYS CD 1 1 12 22044 1 1 94 LYS CE C -5.295 -13.360 -10.793 1.00 . A A . 94 LYS CE 1 1 12 22045 1 1 94 LYS CG C -6.318 -11.755 -9.139 1.00 . A A . 94 LYS CG 1 1 12 22046 1 1 94 LYS H H -9.878 -11.003 -7.999 1.00 . A A . 94 LYS H 1 1 12 22047 1 1 94 LYS HA H -7.273 -9.906 -7.836 1.00 . A A . 94 LYS HA 1 1 12 22048 1 1 94 LYS HB2 H -8.426 -12.164 -8.933 1.00 . A A . 94 LYS HB2 1 1 12 22049 1 1 94 LYS HB3 H -8.019 -11.224 -10.355 1.00 . A A . 94 LYS HB3 1 1 12 22050 1 1 94 LYS HD2 H -5.583 -13.732 -8.688 1.00 . A A . 94 LYS HD2 1 1 12 22051 1 1 94 LYS HD3 H -7.068 -13.720 -9.619 1.00 . A A . 94 LYS HD3 1 1 12 22052 1 1 94 LYS HE2 H -5.273 -12.404 -11.316 1.00 . A A . 94 LYS HE2 1 1 12 22053 1 1 94 LYS HE3 H -4.263 -13.618 -10.558 1.00 . A A . 94 LYS HE3 1 1 12 22054 1 1 94 LYS HG2 H -5.697 -11.125 -9.776 1.00 . A A . 94 LYS HG2 1 1 12 22055 1 1 94 LYS HG3 H -6.000 -11.580 -8.111 1.00 . A A . 94 LYS HG3 1 1 12 22056 1 1 94 LYS HZ1 H -6.452 -15.057 -11.147 1.00 . A A . 94 LYS HZ1 1 1 12 22057 1 1 94 LYS HZ2 H -6.484 -13.996 -12.383 1.00 . A A . 94 LYS HZ2 1 1 12 22058 1 1 94 LYS N N -9.309 -10.219 -7.751 1.00 . A A . 94 LYS N 1 1 12 22059 1 1 94 LYS NZ N -5.885 -14.397 -11.669 1.00 . A A . 94 LYS NZ 1 1 12 22060 1 1 94 LYS O O -7.255 -8.438 -10.082 1.00 . A A . 94 LYS O 1 1 12 22061 1 1 95 LYS C C -10.239 -5.982 -9.358 1.00 . A A . 95 LYS C 1 1 12 22062 1 1 95 LYS CA C -9.682 -7.093 -10.250 1.00 . A A . 95 LYS CA 1 1 12 22063 1 1 95 LYS CB C -10.588 -7.446 -11.431 1.00 . A A . 95 LYS CB 1 1 12 22064 1 1 95 LYS CD C -10.652 -7.423 -13.952 1.00 . A A . 95 LYS CD 1 1 12 22065 1 1 95 LYS CE C -9.547 -7.512 -15.007 1.00 . A A . 95 LYS CE 1 1 12 22066 1 1 95 LYS CG C -10.155 -6.704 -12.696 1.00 . A A . 95 LYS CG 1 1 12 22067 1 1 95 LYS H H -10.197 -8.603 -8.910 1.00 . A A . 95 LYS H 1 1 12 22068 1 1 95 LYS HA H -8.730 -6.760 -10.663 1.00 . A A . 95 LYS HA 1 1 12 22069 1 1 95 LYS HB2 H -10.560 -8.521 -11.608 1.00 . A A . 95 LYS HB2 1 1 12 22070 1 1 95 LYS HB3 H -11.620 -7.191 -11.191 1.00 . A A . 95 LYS HB3 1 1 12 22071 1 1 95 LYS HD2 H -10.993 -8.425 -13.691 1.00 . A A . 95 LYS HD2 1 1 12 22072 1 1 95 LYS HD3 H -11.511 -6.892 -14.363 1.00 . A A . 95 LYS HD3 1 1 12 22073 1 1 95 LYS HE2 H -9.978 -7.408 -16.003 1.00 . A A . 95 LYS HE2 1 1 12 22074 1 1 95 LYS HE3 H -8.844 -6.690 -14.876 1.00 . A A . 95 LYS HE3 1 1 12 22075 1 1 95 LYS HG2 H -10.545 -5.686 -12.677 1.00 . A A . 95 LYS HG2 1 1 12 22076 1 1 95 LYS HG3 H -9.068 -6.627 -12.723 1.00 . A A . 95 LYS HG3 1 1 12 22077 1 1 95 LYS HZ1 H -8.837 -9.164 -13.953 1.00 . A A . 95 LYS HZ1 1 1 12 22078 1 1 95 LYS HZ2 H -9.252 -9.518 -15.488 1.00 . A A . 95 LYS HZ2 1 1 12 22079 1 1 95 LYS N N -9.417 -8.271 -9.442 1.00 . A A . 95 LYS N 1 1 12 22080 1 1 95 LYS NZ N -8.834 -8.804 -14.901 1.00 . A A . 95 LYS NZ 1 1 12 22081 1 1 95 LYS O O -10.463 -4.864 -9.819 1.00 . A A . 95 LYS O 1 1 12 22082 1 1 96 ASP C C -9.905 -5.073 -6.083 1.00 . A A . 96 ASP C 1 1 12 22083 1 1 96 ASP CA C -10.974 -5.375 -7.135 1.00 . A A . 96 ASP CA 1 1 12 22084 1 1 96 ASP CB C -12.201 -5.939 -6.415 1.00 . A A . 96 ASP CB 1 1 12 22085 1 1 96 ASP CG C -13.532 -5.289 -6.799 1.00 . A A . 96 ASP CG 1 1 12 22086 1 1 96 ASP H H -10.262 -7.240 -7.729 1.00 . A A . 96 ASP H 1 1 12 22087 1 1 96 ASP HA H -11.242 -4.496 -7.722 1.00 . A A . 96 ASP HA 1 1 12 22088 1 1 96 ASP HB2 H -12.263 -7.008 -6.619 1.00 . A A . 96 ASP HB2 1 1 12 22089 1 1 96 ASP HB3 H -12.055 -5.827 -5.340 1.00 . A A . 96 ASP HB3 1 1 12 22090 1 1 96 ASP N N -10.447 -6.329 -8.096 1.00 . A A . 96 ASP N 1 1 12 22091 1 1 96 ASP O O -9.881 -3.984 -5.512 1.00 . A A . 96 ASP O 1 1 12 22092 1 1 96 ASP OD1 O -13.616 -4.802 -7.946 1.00 . A A . 96 ASP OD1 1 1 12 22093 1 1 96 ASP OD2 O -14.436 -5.295 -5.935 1.00 . A A . 96 ASP OD2 1 1 12 22094 1 1 97 LEU C C -6.654 -5.694 -5.617 1.00 . A A . 97 LEU C 1 1 12 22095 1 1 97 LEU CA C -7.979 -5.911 -4.885 1.00 . A A . 97 LEU CA 1 1 12 22096 1 1 97 LEU CB C -7.963 -7.102 -3.924 1.00 . A A . 97 LEU CB 1 1 12 22097 1 1 97 LEU CD1 C -8.949 -8.342 -1.962 1.00 . A A . 97 LEU CD1 1 1 12 22098 1 1 97 LEU CD2 C -9.443 -5.876 -2.293 1.00 . A A . 97 LEU CD2 1 1 12 22099 1 1 97 LEU CG C -9.158 -7.215 -2.975 1.00 . A A . 97 LEU CG 1 1 12 22100 1 1 97 LEU H H -9.074 -6.940 -6.327 1.00 . A A . 97 LEU H 1 1 12 22101 1 1 97 LEU HA H -8.196 -5.023 -4.293 1.00 . A A . 97 LEU HA 1 1 12 22102 1 1 97 LEU HB2 H -7.904 -8.018 -4.513 1.00 . A A . 97 LEU HB2 1 1 12 22103 1 1 97 LEU HB3 H -7.053 -7.049 -3.327 1.00 . A A . 97 LEU HB3 1 1 12 22104 1 1 97 LEU HD11 H -8.568 -9.225 -2.474 1.00 . A A . 97 LEU HD11 1 1 12 22105 1 1 97 LEU HD12 H -8.231 -8.022 -1.206 1.00 . A A . 97 LEU HD12 1 1 12 22106 1 1 97 LEU HD13 H -9.899 -8.581 -1.483 1.00 . A A . 97 LEU HD13 1 1 12 22107 1 1 97 LEU HD21 H -8.520 -5.301 -2.218 1.00 . A A . 97 LEU HD21 1 1 12 22108 1 1 97 LEU HD22 H -10.172 -5.317 -2.879 1.00 . A A . 97 LEU HD22 1 1 12 22109 1 1 97 LEU HD23 H -9.841 -6.055 -1.294 1.00 . A A . 97 LEU HD23 1 1 12 22110 1 1 97 LEU HG H -10.039 -7.470 -3.564 1.00 . A A . 97 LEU HG 1 1 12 22111 1 1 97 LEU N N -9.047 -6.058 -5.859 1.00 . A A . 97 LEU N 1 1 12 22112 1 1 97 LEU O O -5.752 -5.041 -5.096 1.00 . A A . 97 LEU O 1 1 12 22113 1 1 98 THR C C -5.726 -5.613 -9.021 1.00 . A A . 98 THR C 1 1 12 22114 1 1 98 THR CA C -5.377 -6.132 -7.625 1.00 . A A . 98 THR CA 1 1 12 22115 1 1 98 THR CB C -4.675 -7.491 -7.640 1.00 . A A . 98 THR CB 1 1 12 22116 1 1 98 THR CG2 C -4.699 -8.178 -6.273 1.00 . A A . 98 THR CG2 1 1 12 22117 1 1 98 THR H H -7.315 -6.785 -7.233 1.00 . A A . 98 THR H 1 1 12 22118 1 1 98 THR HA H -4.725 -5.391 -7.162 1.00 . A A . 98 THR HA 1 1 12 22119 1 1 98 THR HB H -3.654 -7.398 -8.011 1.00 . A A . 98 THR HB 1 1 12 22120 1 1 98 THR HG1 H -5.238 -9.264 -8.378 1.00 . A A . 98 THR HG1 1 1 12 22121 1 1 98 THR HG21 H -5.715 -8.166 -5.879 1.00 . A A . 98 THR HG21 1 1 12 22122 1 1 98 THR HG22 H -4.363 -9.210 -6.379 1.00 . A A . 98 THR HG22 1 1 12 22123 1 1 98 THR HG23 H -4.037 -7.648 -5.588 1.00 . A A . 98 THR HG23 1 1 12 22124 1 1 98 THR N N -6.577 -6.255 -6.815 1.00 . A A . 98 THR N 1 1 12 22125 1 1 98 THR O O -4.954 -5.786 -9.963 1.00 . A A . 98 THR O 1 1 12 22126 1 1 98 THR OG1 O -5.514 -8.306 -8.453 1.00 . A A . 98 THR OG1 1 1 12 22127 1 1 99 GLY C C -6.559 -3.187 -10.753 1.00 . A A . 99 GLY C 1 1 12 22128 1 1 99 GLY CA C -7.351 -4.440 -10.375 1.00 . A A . 99 GLY CA 1 1 12 22129 1 1 99 GLY H H -7.512 -4.848 -8.339 1.00 . A A . 99 GLY H 1 1 12 22130 1 1 99 GLY HA2 H -7.247 -5.191 -11.159 1.00 . A A . 99 GLY HA2 1 1 12 22131 1 1 99 GLY HA3 H -8.412 -4.198 -10.306 1.00 . A A . 99 GLY HA3 1 1 12 22132 1 1 99 GLY N N -6.890 -4.986 -9.110 1.00 . A A . 99 GLY N 1 1 12 22133 1 1 99 GLY O O -6.188 -2.398 -9.886 1.00 . A A . 99 GLY O 1 1 12 22134 1 1 100 CYS C C -6.548 -0.717 -12.674 1.00 . A A . 100 CYS C 1 1 12 22135 1 1 100 CYS CA C -5.584 -1.899 -12.553 1.00 . A A . 100 CYS CA 1 1 12 22136 1 1 100 CYS CB C -4.895 -2.211 -13.883 1.00 . A A . 100 CYS CB 1 1 12 22137 1 1 100 CYS H H -6.631 -3.688 -12.749 1.00 . A A . 100 CYS H 1 1 12 22138 1 1 100 CYS HA H -4.801 -1.687 -11.824 1.00 . A A . 100 CYS HA 1 1 12 22139 1 1 100 CYS HB2 H -5.588 -2.770 -14.512 1.00 . A A . 100 CYS HB2 1 1 12 22140 1 1 100 CYS HB3 H -4.684 -1.273 -14.396 1.00 . A A . 100 CYS HB3 1 1 12 22141 1 1 100 CYS N N -6.325 -3.042 -12.050 1.00 . A A . 100 CYS N 1 1 12 22142 1 1 100 CYS O O -6.336 0.327 -12.058 1.00 . A A . 100 CYS O 1 1 12 22143 1 1 100 CYS SG S -3.339 -3.163 -13.736 1.00 . A A . 100 CYS SG 1 1 12 22144 1 1 101 LYS C C -9.957 -0.413 -13.263 1.00 . A A . 101 LYS C 1 1 12 22145 1 1 101 LYS CA C -8.583 0.115 -13.680 1.00 . A A . 101 LYS CA 1 1 12 22146 1 1 101 LYS CB C -8.533 0.624 -15.123 1.00 . A A . 101 LYS CB 1 1 12 22147 1 1 101 LYS CD C -9.487 2.316 -16.730 1.00 . A A . 101 LYS CD 1 1 12 22148 1 1 101 LYS CE C -9.200 3.797 -16.985 1.00 . A A . 101 LYS CE 1 1 12 22149 1 1 101 LYS CG C -9.266 1.960 -15.259 1.00 . A A . 101 LYS CG 1 1 12 22150 1 1 101 LYS H H -7.752 -1.773 -13.967 1.00 . A A . 101 LYS H 1 1 12 22151 1 1 101 LYS HA H -8.325 0.954 -13.034 1.00 . A A . 101 LYS HA 1 1 12 22152 1 1 101 LYS HB2 H -7.495 0.741 -15.435 1.00 . A A . 101 LYS HB2 1 1 12 22153 1 1 101 LYS HB3 H -8.984 -0.112 -15.788 1.00 . A A . 101 LYS HB3 1 1 12 22154 1 1 101 LYS HD2 H -8.841 1.703 -17.358 1.00 . A A . 101 LYS HD2 1 1 12 22155 1 1 101 LYS HD3 H -10.515 2.088 -17.012 1.00 . A A . 101 LYS HD3 1 1 12 22156 1 1 101 LYS HE2 H -10.121 4.310 -17.261 1.00 . A A . 101 LYS HE2 1 1 12 22157 1 1 101 LYS HE3 H -8.836 4.266 -16.071 1.00 . A A . 101 LYS HE3 1 1 12 22158 1 1 101 LYS HG2 H -10.225 1.907 -14.745 1.00 . A A . 101 LYS HG2 1 1 12 22159 1 1 101 LYS HG3 H -8.688 2.747 -14.774 1.00 . A A . 101 LYS HG3 1 1 12 22160 1 1 101 LYS HZ1 H -7.270 3.672 -17.761 1.00 . A A . 101 LYS HZ1 1 1 12 22161 1 1 101 LYS HZ2 H -8.423 3.392 -18.876 1.00 . A A . 101 LYS HZ2 1 1 12 22162 1 1 101 LYS N N -7.586 -0.920 -13.471 1.00 . A A . 101 LYS N 1 1 12 22163 1 1 101 LYS NZ N -8.197 3.953 -18.062 1.00 . A A . 101 LYS NZ 1 1 12 22164 1 1 101 LYS O O -10.261 -1.588 -13.462 1.00 . A A . 101 LYS O 1 1 12 22165 1 1 102 LYS C C -11.977 -0.865 -11.077 1.00 . A A . 102 LYS C 1 1 12 22166 1 1 102 LYS CA C -12.085 0.119 -12.243 1.00 . A A . 102 LYS CA 1 1 12 22167 1 1 102 LYS CB C -12.920 -0.404 -13.414 1.00 . A A . 102 LYS CB 1 1 12 22168 1 1 102 LYS CD C -14.755 1.191 -14.083 1.00 . A A . 102 LYS CD 1 1 12 22169 1 1 102 LYS CE C -14.820 2.087 -12.844 1.00 . A A . 102 LYS CE 1 1 12 22170 1 1 102 LYS CG C -13.320 0.735 -14.354 1.00 . A A . 102 LYS CG 1 1 12 22171 1 1 102 LYS H H -10.496 1.435 -12.533 1.00 . A A . 102 LYS H 1 1 12 22172 1 1 102 LYS HA H -12.567 1.028 -11.885 1.00 . A A . 102 LYS HA 1 1 12 22173 1 1 102 LYS HB2 H -12.351 -1.153 -13.965 1.00 . A A . 102 LYS HB2 1 1 12 22174 1 1 102 LYS HB3 H -13.814 -0.899 -13.035 1.00 . A A . 102 LYS HB3 1 1 12 22175 1 1 102 LYS HD2 H -15.138 1.732 -14.948 1.00 . A A . 102 LYS HD2 1 1 12 22176 1 1 102 LYS HD3 H -15.396 0.322 -13.941 1.00 . A A . 102 LYS HD3 1 1 12 22177 1 1 102 LYS HE2 H -13.888 2.643 -12.741 1.00 . A A . 102 LYS HE2 1 1 12 22178 1 1 102 LYS HE3 H -15.618 2.821 -12.960 1.00 . A A . 102 LYS HE3 1 1 12 22179 1 1 102 LYS HG2 H -12.637 1.574 -14.225 1.00 . A A . 102 LYS HG2 1 1 12 22180 1 1 102 LYS HG3 H -13.229 0.405 -15.389 1.00 . A A . 102 LYS HG3 1 1 12 22181 1 1 102 LYS HZ1 H -14.901 1.808 -10.780 1.00 . A A . 102 LYS HZ1 1 1 12 22182 1 1 102 LYS HZ2 H -16.009 0.926 -11.586 1.00 . A A . 102 LYS HZ2 1 1 12 22183 1 1 102 LYS N N -10.751 0.481 -12.691 1.00 . A A . 102 LYS N 1 1 12 22184 1 1 102 LYS NZ N -15.058 1.276 -11.629 1.00 . A A . 102 LYS NZ 1 1 12 22185 1 1 102 LYS O O -12.634 -1.905 -11.074 1.00 . A A . 102 LYS O 1 1 12 22186 1 1 103 SER C C -11.207 -0.535 -7.670 1.00 . A A . 103 SER C 1 1 12 22187 1 1 103 SER CA C -10.941 -1.340 -8.943 1.00 . A A . 103 SER CA 1 1 12 22188 1 1 103 SER CB C -9.525 -1.919 -8.919 1.00 . A A . 103 SER CB 1 1 12 22189 1 1 103 SER H H -10.613 0.346 -10.122 1.00 . A A . 103 SER H 1 1 12 22190 1 1 103 SER HA H -11.663 -2.151 -9.041 1.00 . A A . 103 SER HA 1 1 12 22191 1 1 103 SER HB2 H -9.160 -1.939 -7.892 1.00 . A A . 103 SER HB2 1 1 12 22192 1 1 103 SER HB3 H -9.549 -2.951 -9.269 1.00 . A A . 103 SER HB3 1 1 12 22193 1 1 103 SER HG H -8.686 -0.194 -9.491 1.00 . A A . 103 SER HG 1 1 12 22194 1 1 103 SER N N -11.144 -0.502 -10.113 1.00 . A A . 103 SER N 1 1 12 22195 1 1 103 SER O O -11.658 0.608 -7.737 1.00 . A A . 103 SER O 1 1 12 22196 1 1 103 SER OG O -8.626 -1.164 -9.727 1.00 . A A . 103 SER OG 1 1 12 22197 1 1 104 LYS C C -10.011 0.509 -5.021 1.00 . A A . 104 LYS C 1 1 12 22198 1 1 104 LYS CA C -11.120 -0.518 -5.253 1.00 . A A . 104 LYS CA 1 1 12 22199 1 1 104 LYS CB C -11.232 -1.564 -4.142 1.00 . A A . 104 LYS CB 1 1 12 22200 1 1 104 LYS CD C -13.656 -1.998 -3.600 1.00 . A A . 104 LYS CD 1 1 12 22201 1 1 104 LYS CE C -14.331 -3.153 -2.857 1.00 . A A . 104 LYS CE 1 1 12 22202 1 1 104 LYS CG C -12.430 -2.486 -4.375 1.00 . A A . 104 LYS CG 1 1 12 22203 1 1 104 LYS H H -10.551 -2.092 -6.494 1.00 . A A . 104 LYS H 1 1 12 22204 1 1 104 LYS HA H -12.074 0.007 -5.297 1.00 . A A . 104 LYS HA 1 1 12 22205 1 1 104 LYS HB2 H -10.317 -2.155 -4.100 1.00 . A A . 104 LYS HB2 1 1 12 22206 1 1 104 LYS HB3 H -11.333 -1.067 -3.178 1.00 . A A . 104 LYS HB3 1 1 12 22207 1 1 104 LYS HD2 H -13.358 -1.228 -2.888 1.00 . A A . 104 LYS HD2 1 1 12 22208 1 1 104 LYS HD3 H -14.366 -1.539 -4.288 1.00 . A A . 104 LYS HD3 1 1 12 22209 1 1 104 LYS HE2 H -13.577 -3.760 -2.355 1.00 . A A . 104 LYS HE2 1 1 12 22210 1 1 104 LYS HE3 H -14.990 -2.760 -2.084 1.00 . A A . 104 LYS HE3 1 1 12 22211 1 1 104 LYS HG2 H -12.661 -2.527 -5.439 1.00 . A A . 104 LYS HG2 1 1 12 22212 1 1 104 LYS HG3 H -12.179 -3.500 -4.064 1.00 . A A . 104 LYS HG3 1 1 12 22213 1 1 104 LYS HZ1 H -15.283 -3.515 -4.675 1.00 . A A . 104 LYS HZ1 1 1 12 22214 1 1 104 LYS HZ2 H -14.622 -4.854 -4.026 1.00 . A A . 104 LYS HZ2 1 1 12 22215 1 1 104 LYS N N -10.918 -1.162 -6.540 1.00 . A A . 104 LYS N 1 1 12 22216 1 1 104 LYS NZ N -15.106 -3.992 -3.798 1.00 . A A . 104 LYS NZ 1 1 12 22217 1 1 104 LYS O O -10.215 1.501 -4.323 1.00 . A A . 104 LYS O 1 1 12 22218 1 1 105 CYS C C -7.861 2.248 -6.517 1.00 . A A . 105 CYS C 1 1 12 22219 1 1 105 CYS CA C -7.719 1.125 -5.487 1.00 . A A . 105 CYS CA 1 1 12 22220 1 1 105 CYS CB C -6.396 0.372 -5.643 1.00 . A A . 105 CYS CB 1 1 12 22221 1 1 105 CYS H H -8.704 -0.572 -6.186 1.00 . A A . 105 CYS H 1 1 12 22222 1 1 105 CYS HA H -7.749 1.523 -4.473 1.00 . A A . 105 CYS HA 1 1 12 22223 1 1 105 CYS HB2 H -6.374 -0.148 -6.601 1.00 . A A . 105 CYS HB2 1 1 12 22224 1 1 105 CYS HB3 H -5.565 1.078 -5.644 1.00 . A A . 105 CYS HB3 1 1 12 22225 1 1 105 CYS N N -8.861 0.236 -5.620 1.00 . A A . 105 CYS N 1 1 12 22226 1 1 105 CYS O O -7.967 3.418 -6.154 1.00 . A A . 105 CYS O 1 1 12 22227 1 1 105 CYS SG S -6.194 -0.828 -4.276 1.00 . A A . 105 CYS SG 1 1 12 22228 1 1 106 HIS C C -9.425 2.809 -9.386 1.00 . A A . 106 HIS C 1 1 12 22229 1 1 106 HIS CA C -7.987 2.810 -8.866 1.00 . A A . 106 HIS CA 1 1 12 22230 1 1 106 HIS CB C -6.959 2.527 -9.964 1.00 . A A . 106 HIS CB 1 1 12 22231 1 1 106 HIS CD2 C -4.490 1.788 -9.528 1.00 . A A . 106 HIS CD2 1 1 12 22232 1 1 106 HIS CE1 C -3.746 3.666 -8.689 1.00 . A A . 106 HIS CE1 1 1 12 22233 1 1 106 HIS CG C -5.525 2.677 -9.516 1.00 . A A . 106 HIS CG 1 1 12 22234 1 1 106 HIS H H -7.773 0.897 -8.068 1.00 . A A . 106 HIS H 1 1 12 22235 1 1 106 HIS HA H -7.762 3.790 -8.445 1.00 . A A . 106 HIS HA 1 1 12 22236 1 1 106 HIS HB2 H -7.109 1.514 -10.336 1.00 . A A . 106 HIS HB2 1 1 12 22237 1 1 106 HIS HB3 H -7.140 3.204 -10.799 1.00 . A A . 106 HIS HB3 1 1 12 22238 1 1 106 HIS HD1 H -5.541 4.695 -8.839 1.00 . A A . 106 HIS HD1 1 1 12 22239 1 1 106 HIS HD2 H -4.538 0.760 -9.887 1.00 . A A . 106 HIS HD2 1 1 12 22240 1 1 106 HIS HE1 H -3.075 4.406 -8.253 1.00 . A A . 106 HIS HE1 1 1 12 22241 1 1 106 HIS N N -7.859 1.852 -7.781 1.00 . A A . 106 HIS N 1 1 12 22242 1 1 106 HIS ND1 N -5.025 3.851 -8.981 1.00 . A A . 106 HIS ND1 1 1 12 22243 1 1 106 HIS NE2 N -3.416 2.387 -9.029 1.00 . A A . 106 HIS NE2 1 1 12 22244 1 1 106 HIS O O -10.059 1.757 -9.467 1.00 . A A . 106 HIS O 1 1 12 22245 1 1 107 GLU C C -11.246 4.973 -11.523 1.00 . A A . 107 GLU C 1 1 12 22246 1 1 107 GLU CA C -11.252 4.148 -10.234 1.00 . A A . 107 GLU CA 1 1 12 22247 1 1 107 GLU CB C -12.167 4.780 -9.183 1.00 . A A . 107 GLU CB 1 1 12 22248 1 1 107 GLU CD C -13.469 4.370 -7.062 1.00 . A A . 107 GLU CD 1 1 12 22249 1 1 107 GLU CG C -12.405 3.820 -8.015 1.00 . A A . 107 GLU CG 1 1 12 22250 1 1 107 GLU H H -9.378 4.849 -9.656 1.00 . A A . 107 GLU H 1 1 12 22251 1 1 107 GLU HA H -11.596 3.135 -10.444 1.00 . A A . 107 GLU HA 1 1 12 22252 1 1 107 GLU HB2 H -11.720 5.703 -8.814 1.00 . A A . 107 GLU HB2 1 1 12 22253 1 1 107 GLU HB3 H -13.120 5.047 -9.639 1.00 . A A . 107 GLU HB3 1 1 12 22254 1 1 107 GLU HG2 H -12.719 2.849 -8.396 1.00 . A A . 107 GLU HG2 1 1 12 22255 1 1 107 GLU HG3 H -11.472 3.664 -7.472 1.00 . A A . 107 GLU HG3 1 1 12 22256 1 1 107 GLU N N -9.900 3.999 -9.724 1.00 . A A . 107 GLU N 1 1 12 22257 1 1 107 GLU O O -12.278 5.119 -12.175 1.00 . A A . 107 GLU O 1 1 12 22258 1 1 107 GLU OXT O -10.156 5.478 -11.867 1.00 . A A . 107 GLU OXT 1 1 12 22259 1 1 107 GLU OE1 O -14.379 5.062 -7.567 1.00 . A A . 107 GLU OE1 1 1 12 22260 1 1 107 GLU OE2 O -13.349 4.084 -5.852 1.00 . A A . 107 GLU OE2 1 1 12 22261 2 2 1 HEC C1A C -1.154 5.422 9.242 1.00 . B A . 108 HEC C1A 1 1 12 22262 2 2 1 HEC C1B C -2.039 2.271 12.065 1.00 . B A . 108 HEC C1B 1 1 12 22263 2 2 1 HEC C1C C -2.235 -0.584 8.784 1.00 . B A . 108 HEC C1C 1 1 12 22264 2 2 1 HEC C1D C -1.117 2.542 6.018 1.00 . B A . 108 HEC C1D 1 1 12 22265 2 2 1 HEC C2A C -1.079 6.496 10.204 1.00 . B A . 108 HEC C2A 1 1 12 22266 2 2 1 HEC C2B C -2.470 1.372 13.109 1.00 . B A . 108 HEC C2B 1 1 12 22267 2 2 1 HEC C2C C -2.293 -1.655 7.817 1.00 . B A . 108 HEC C2C 1 1 12 22268 2 2 1 HEC C2D C -0.708 3.459 4.981 1.00 . B A . 108 HEC C2D 1 1 12 22269 2 2 1 HEC C3A C -1.295 5.954 11.422 1.00 . B A . 108 HEC C3A 1 1 12 22270 2 2 1 HEC C3B C -2.635 0.157 12.544 1.00 . B A . 108 HEC C3B 1 1 12 22271 2 2 1 HEC C3C C -1.964 -1.126 6.619 1.00 . B A . 108 HEC C3C 1 1 12 22272 2 2 1 HEC C3D C -0.613 4.681 5.546 1.00 . B A . 108 HEC C3D 1 1 12 22273 2 2 1 HEC C4A C -1.506 4.540 11.226 1.00 . B A . 108 HEC C4A 1 1 12 22274 2 2 1 HEC C4B C -2.307 0.293 11.144 1.00 . B A . 108 HEC C4B 1 1 12 22275 2 2 1 HEC C4C C -1.700 0.277 6.833 1.00 . B A . 108 HEC C4C 1 1 12 22276 2 2 1 HEC C4D C -0.962 4.533 6.939 1.00 . B A . 108 HEC C4D 1 1 12 22277 2 2 1 HEC CAA C -0.808 7.933 9.867 1.00 . B A . 108 HEC CAA 1 1 12 22278 2 2 1 HEC CAB C -3.073 -1.117 13.204 1.00 . B A . 108 HEC CAB 1 1 12 22279 2 2 1 HEC CAC C -1.877 -1.825 5.294 1.00 . B A . 108 HEC CAC 1 1 12 22280 2 2 1 HEC CAD C -0.222 5.974 4.891 1.00 . B A . 108 HEC CAD 1 1 12 22281 2 2 1 HEC CBA C 0.376 8.535 10.618 1.00 . B A . 108 HEC CBA 1 1 12 22282 2 2 1 HEC CBB C -4.328 -0.974 14.060 1.00 . B A . 108 HEC CBB 1 1 12 22283 2 2 1 HEC CBC C -2.896 -2.947 5.115 1.00 . B A . 108 HEC CBC 1 1 12 22284 2 2 1 HEC CBD C -0.849 6.187 3.516 1.00 . B A . 108 HEC CBD 1 1 12 22285 2 2 1 HEC CGA C -0.021 9.822 11.325 1.00 . B A . 108 HEC CGA 1 1 12 22286 2 2 1 HEC CGD C 0.208 6.555 2.483 1.00 . B A . 108 HEC CGD 1 1 12 22287 2 2 1 HEC CHA C -0.984 5.586 7.872 1.00 . B A . 108 HEC CHA 1 1 12 22288 2 2 1 HEC CHB C -1.765 3.621 12.259 1.00 . B A . 108 HEC CHB 1 1 12 22289 2 2 1 HEC CHC C -2.355 -0.757 10.209 1.00 . B A . 108 HEC CHC 1 1 12 22290 2 2 1 HEC CHD C -1.324 1.181 5.822 1.00 . B A . 108 HEC CHD 1 1 12 22291 2 2 1 HEC CMA C -1.320 6.650 12.751 1.00 . B A . 108 HEC CMA 1 1 12 22292 2 2 1 HEC CMB C -2.683 1.760 14.543 1.00 . B A . 108 HEC CMB 1 1 12 22293 2 2 1 HEC CMC C -2.656 -3.077 8.131 1.00 . B A . 108 HEC CMC 1 1 12 22294 2 2 1 HEC CMD C -0.447 3.078 3.552 1.00 . B A . 108 HEC CMD 1 1 12 22295 2 2 1 HEC FE FE -1.625 2.408 9.032 1.00 . B A . 108 HEC FE 1 1 12 22296 2 2 1 HEC HAA1 H -0.592 8.022 8.802 1.00 . B A . 108 HEC HAA1 1 1 12 22297 2 2 1 HEC HAA2 H -1.683 8.535 10.112 1.00 . B A . 108 HEC HAA2 1 1 12 22298 2 2 1 HEC HAB H -3.287 -1.866 12.442 1.00 . B A . 108 HEC HAB 1 1 12 22299 2 2 1 HEC HAC H -2.046 -1.106 4.492 1.00 . B A . 108 HEC HAC 1 1 12 22300 2 2 1 HEC HAD1 H -0.533 6.808 5.519 1.00 . B A . 108 HEC HAD1 1 1 12 22301 2 2 1 HEC HAD2 H 0.860 6.002 4.759 1.00 . B A . 108 HEC HAD2 1 1 12 22302 2 2 1 HEC HBA1 H 0.733 7.823 11.363 1.00 . B A . 108 HEC HBA1 1 1 12 22303 2 2 1 HEC HBA2 H 1.179 8.756 9.914 1.00 . B A . 108 HEC HBA2 1 1 12 22304 2 2 1 HEC HBB1 H -4.043 -0.756 15.089 1.00 . B A . 108 HEC HBB1 1 1 12 22305 2 2 1 HEC HBB2 H -4.941 -0.160 13.673 1.00 . B A . 108 HEC HBB2 1 1 12 22306 2 2 1 HEC HBB3 H -4.897 -1.903 14.030 1.00 . B A . 108 HEC HBB3 1 1 12 22307 2 2 1 HEC HBC1 H -2.506 -3.865 5.555 1.00 . B A . 108 HEC HBC1 1 1 12 22308 2 2 1 HEC HBC2 H -3.828 -2.674 5.610 1.00 . B A . 108 HEC HBC2 1 1 12 22309 2 2 1 HEC HBC3 H -3.081 -3.103 4.052 1.00 . B A . 108 HEC HBC3 1 1 12 22310 2 2 1 HEC HBD1 H -1.344 5.271 3.196 1.00 . B A . 108 HEC HBD1 1 1 12 22311 2 2 1 HEC HBD2 H -1.579 6.995 3.571 1.00 . B A . 108 HEC HBD2 1 1 12 22312 2 2 1 HEC HHA H -0.858 6.599 7.490 1.00 . B A . 108 HEC HHA 1 1 12 22313 2 2 1 HEC HHB H -1.748 3.997 13.282 1.00 . B A . 108 HEC HHB 1 1 12 22314 2 2 1 HEC HHC H -2.564 -1.758 10.586 1.00 . B A . 108 HEC HHC 1 1 12 22315 2 2 1 HEC HHD H -1.186 0.782 4.817 1.00 . B A . 108 HEC HHD 1 1 12 22316 2 2 1 HEC HMA1 H -0.904 5.992 13.514 1.00 . B A . 108 HEC HMA1 1 1 12 22317 2 2 1 HEC HMA2 H -0.725 7.562 12.695 1.00 . B A . 108 HEC HMA2 1 1 12 22318 2 2 1 HEC HMA3 H -2.348 6.903 13.010 1.00 . B A . 108 HEC HMA3 1 1 12 22319 2 2 1 HEC HMB1 H -2.502 0.897 15.184 1.00 . B A . 108 HEC HMB1 1 1 12 22320 2 2 1 HEC HMB2 H -1.992 2.561 14.809 1.00 . B A . 108 HEC HMB2 1 1 12 22321 2 2 1 HEC HMB3 H -3.708 2.105 14.678 1.00 . B A . 108 HEC HMB3 1 1 12 22322 2 2 1 HEC HMC1 H -3.392 -3.432 7.411 1.00 . B A . 108 HEC HMC1 1 1 12 22323 2 2 1 HEC HMC2 H -1.763 -3.701 8.076 1.00 . B A . 108 HEC HMC2 1 1 12 22324 2 2 1 HEC HMC3 H -3.075 -3.132 9.136 1.00 . B A . 108 HEC HMC3 1 1 12 22325 2 2 1 HEC HMD1 H -1.396 2.930 3.037 1.00 . B A . 108 HEC HMD1 1 1 12 22326 2 2 1 HEC HMD2 H 0.113 3.873 3.061 1.00 . B A . 108 HEC HMD2 1 1 12 22327 2 2 1 HEC HMD3 H 0.130 2.154 3.522 1.00 . B A . 108 HEC HMD3 1 1 12 22328 2 2 1 HEC NA N -1.417 4.222 9.882 1.00 . B A . 108 HEC NA 1 1 12 22329 2 2 1 HEC NB N -1.942 1.597 10.860 1.00 . B A . 108 HEC NB 1 1 12 22330 2 2 1 HEC NC N -1.870 0.600 8.168 1.00 . B A . 108 HEC NC 1 1 12 22331 2 2 1 HEC ND N -1.271 3.214 7.219 1.00 . B A . 108 HEC ND 1 1 12 22332 2 2 1 HEC O1A O 0.477 10.884 10.892 1.00 . B A . 108 HEC O1A 1 1 12 22333 2 2 1 HEC O1D O 0.221 7.739 2.082 1.00 . B A . 108 HEC O1D 1 1 12 22334 2 2 1 HEC O2A O -0.814 9.721 12.286 1.00 . B A . 108 HEC O2A 1 1 12 22335 2 2 1 HEC O2D O 0.982 5.646 2.115 1.00 . B A . 108 HEC O2D 1 1 12 22336 3 2 1 HEC C1A C 9.594 -1.775 1.639 1.00 . C A . 109 HEC C1A 1 1 12 22337 3 2 1 HEC C1B C 5.748 -0.094 2.672 1.00 . C A . 109 HEC C1B 1 1 12 22338 3 2 1 HEC C1C C 7.776 2.990 5.034 1.00 . C A . 109 HEC C1C 1 1 12 22339 3 2 1 HEC C1D C 11.590 1.458 3.701 1.00 . C A . 109 HEC C1D 1 1 12 22340 3 2 1 HEC C2A C 9.092 -2.867 0.840 1.00 . C A . 109 HEC C2A 1 1 12 22341 3 2 1 HEC C2B C 4.393 0.259 3.024 1.00 . C A . 109 HEC C2B 1 1 12 22342 3 2 1 HEC C2C C 8.289 4.149 5.724 1.00 . C A . 109 HEC C2C 1 1 12 22343 3 2 1 HEC C2D C 12.938 1.055 3.378 1.00 . C A . 109 HEC C2D 1 1 12 22344 3 2 1 HEC C3A C 7.746 -2.759 0.819 1.00 . C A . 109 HEC C3A 1 1 12 22345 3 2 1 HEC C3B C 4.462 1.321 3.854 1.00 . C A . 109 HEC C3B 1 1 12 22346 3 2 1 HEC C3C C 9.631 4.138 5.577 1.00 . C A . 109 HEC C3C 1 1 12 22347 3 2 1 HEC C3D C 12.851 -0.095 2.677 1.00 . C A . 109 HEC C3D 1 1 12 22348 3 2 1 HEC C4A C 7.402 -1.598 1.606 1.00 . C A . 109 HEC C4A 1 1 12 22349 3 2 1 HEC C4B C 5.861 1.636 4.025 1.00 . C A . 109 HEC C4B 1 1 12 22350 3 2 1 HEC C4C C 9.961 2.970 4.794 1.00 . C A . 109 HEC C4C 1 1 12 22351 3 2 1 HEC C4D C 11.448 -0.416 2.560 1.00 . C A . 109 HEC C4D 1 1 12 22352 3 2 1 HEC CAA C 9.945 -3.907 0.174 1.00 . C A . 109 HEC CAA 1 1 12 22353 3 2 1 HEC CAB C 3.330 2.065 4.500 1.00 . C A . 109 HEC CAB 1 1 12 22354 3 2 1 HEC CAC C 10.627 5.127 6.107 1.00 . C A . 109 HEC CAC 1 1 12 22355 3 2 1 HEC CAD C 13.971 -0.918 2.109 1.00 . C A . 109 HEC CAD 1 1 12 22356 3 2 1 HEC CBA C 10.161 -3.670 -1.318 1.00 . C A . 109 HEC CBA 1 1 12 22357 3 2 1 HEC CBB C 2.300 1.163 5.175 1.00 . C A . 109 HEC CBB 1 1 12 22358 3 2 1 HEC CBC C 10.632 5.248 7.628 1.00 . C A . 109 HEC CBC 1 1 12 22359 3 2 1 HEC CBD C 15.200 -0.999 3.010 1.00 . C A . 109 HEC CBD 1 1 12 22360 3 2 1 HEC CGA C 10.923 -4.826 -1.951 1.00 . C A . 109 HEC CGA 1 1 12 22361 3 2 1 HEC CGD C 16.226 0.060 2.632 1.00 . C A . 109 HEC CGD 1 1 12 22362 3 2 1 HEC CHA C 10.942 -1.548 1.894 1.00 . C A . 109 HEC CHA 1 1 12 22363 3 2 1 HEC CHB C 6.088 -1.145 1.828 1.00 . C A . 109 HEC CHB 1 1 12 22364 3 2 1 HEC CHC C 6.351 2.686 4.824 1.00 . C A . 109 HEC CHC 1 1 12 22365 3 2 1 HEC CHD C 11.267 2.603 4.422 1.00 . C A . 109 HEC CHD 1 1 12 22366 3 2 1 HEC CMA C 6.758 -3.650 0.126 1.00 . C A . 109 HEC CMA 1 1 12 22367 3 2 1 HEC CMB C 3.166 -0.451 2.532 1.00 . C A . 109 HEC CMB 1 1 12 22368 3 2 1 HEC CMC C 7.449 5.155 6.457 1.00 . C A . 109 HEC CMC 1 1 12 22369 3 2 1 HEC CMD C 14.176 1.808 3.769 1.00 . C A . 109 HEC CMD 1 1 12 22370 3 2 1 HEC FE FE 8.671 0.644 3.264 1.00 . C A . 109 HEC FE 1 1 12 22371 3 2 1 HEC HAA1 H 10.929 -3.925 0.643 1.00 . C A . 109 HEC HAA1 1 1 12 22372 3 2 1 HEC HAA2 H 9.475 -4.885 0.280 1.00 . C A . 109 HEC HAA2 1 1 12 22373 3 2 1 HEC HAB H 3.723 2.733 5.266 1.00 . C A . 109 HEC HAB 1 1 12 22374 3 2 1 HEC HAC H 11.631 4.828 5.805 1.00 . C A . 109 HEC HAC 1 1 12 22375 3 2 1 HEC HAD1 H 13.625 -1.938 1.944 1.00 . C A . 109 HEC HAD1 1 1 12 22376 3 2 1 HEC HAD2 H 14.294 -0.487 1.162 1.00 . C A . 109 HEC HAD2 1 1 12 22377 3 2 1 HEC HBA1 H 9.196 -3.575 -1.815 1.00 . C A . 109 HEC HBA1 1 1 12 22378 3 2 1 HEC HBA2 H 10.736 -2.755 -1.461 1.00 . C A . 109 HEC HBA2 1 1 12 22379 3 2 1 HEC HBB1 H 1.935 1.644 6.082 1.00 . C A . 109 HEC HBB1 1 1 12 22380 3 2 1 HEC HBB2 H 1.466 0.991 4.494 1.00 . C A . 109 HEC HBB2 1 1 12 22381 3 2 1 HEC HBB3 H 2.763 0.210 5.430 1.00 . C A . 109 HEC HBB3 1 1 12 22382 3 2 1 HEC HBC1 H 11.602 5.620 7.960 1.00 . C A . 109 HEC HBC1 1 1 12 22383 3 2 1 HEC HBC2 H 9.851 5.941 7.940 1.00 . C A . 109 HEC HBC2 1 1 12 22384 3 2 1 HEC HBC3 H 10.448 4.269 8.071 1.00 . C A . 109 HEC HBC3 1 1 12 22385 3 2 1 HEC HBD1 H 14.902 -0.842 4.046 1.00 . C A . 109 HEC HBD1 1 1 12 22386 3 2 1 HEC HBD2 H 15.660 -1.982 2.908 1.00 . C A . 109 HEC HBD2 1 1 12 22387 3 2 1 HEC HHA H 11.660 -2.296 1.557 1.00 . C A . 109 HEC HHA 1 1 12 22388 3 2 1 HEC HHB H 5.285 -1.658 1.299 1.00 . C A . 109 HEC HHB 1 1 12 22389 3 2 1 HEC HHC H 5.619 3.310 5.337 1.00 . C A . 109 HEC HHC 1 1 12 22390 3 2 1 HEC HHD H 12.080 3.265 4.722 1.00 . C A . 109 HEC HHD 1 1 12 22391 3 2 1 HEC HMA1 H 7.184 -4.005 -0.812 1.00 . C A . 109 HEC HMA1 1 1 12 22392 3 2 1 HEC HMA2 H 6.526 -4.502 0.765 1.00 . C A . 109 HEC HMA2 1 1 12 22393 3 2 1 HEC HMA3 H 5.845 -3.090 -0.079 1.00 . C A . 109 HEC HMA3 1 1 12 22394 3 2 1 HEC HMB1 H 2.380 -0.382 3.285 1.00 . C A . 109 HEC HMB1 1 1 12 22395 3 2 1 HEC HMB2 H 2.824 0.013 1.607 1.00 . C A . 109 HEC HMB2 1 1 12 22396 3 2 1 HEC HMB3 H 3.402 -1.499 2.348 1.00 . C A . 109 HEC HMB3 1 1 12 22397 3 2 1 HEC HMC1 H 8.088 5.944 6.851 1.00 . C A . 109 HEC HMC1 1 1 12 22398 3 2 1 HEC HMC2 H 6.719 5.586 5.772 1.00 . C A . 109 HEC HMC2 1 1 12 22399 3 2 1 HEC HMC3 H 6.929 4.663 7.279 1.00 . C A . 109 HEC HMC3 1 1 12 22400 3 2 1 HEC HMD1 H 14.658 2.205 2.876 1.00 . C A . 109 HEC HMD1 1 1 12 22401 3 2 1 HEC HMD2 H 13.908 2.629 4.433 1.00 . C A . 109 HEC HMD2 1 1 12 22402 3 2 1 HEC HMD3 H 14.863 1.135 4.284 1.00 . C A . 109 HEC HMD3 1 1 12 22403 3 2 1 HEC NA N 8.546 -1.000 2.105 1.00 . C A . 109 HEC NA 1 1 12 22404 3 2 1 HEC NB N 6.644 0.759 3.294 1.00 . C A . 109 HEC NB 1 1 12 22405 3 2 1 HEC NC N 8.813 2.271 4.465 1.00 . C A . 109 HEC NC 1 1 12 22406 3 2 1 HEC ND N 10.681 0.546 3.193 1.00 . C A . 109 HEC ND 1 1 12 22407 3 2 1 HEC O1A O 10.644 -5.107 -3.137 1.00 . C A . 109 HEC O1A 1 1 12 22408 3 2 1 HEC O1D O 16.903 0.551 3.562 1.00 . C A . 109 HEC O1D 1 1 12 22409 3 2 1 HEC O2A O 11.769 -5.407 -1.238 1.00 . C A . 109 HEC O2A 1 1 12 22410 3 2 1 HEC O2D O 16.316 0.358 1.422 1.00 . C A . 109 HEC O2D 1 1 12 22411 4 2 1 HEC C1A C -8.690 -3.373 0.430 1.00 . D A . 110 HEC C1A 1 1 12 22412 4 2 1 HEC C1B C -4.981 -1.175 0.138 1.00 . D A . 110 HEC C1B 1 1 12 22413 4 2 1 HEC C1C C -2.900 -4.444 2.086 1.00 . D A . 110 HEC C1C 1 1 12 22414 4 2 1 HEC C1D C -6.630 -6.597 2.439 1.00 . D A . 110 HEC C1D 1 1 12 22415 4 2 1 HEC C2A C -9.502 -2.435 -0.309 1.00 . D A . 110 HEC C2A 1 1 12 22416 4 2 1 HEC C2B C -3.816 -0.361 -0.117 1.00 . D A . 110 HEC C2B 1 1 12 22417 4 2 1 HEC C2C C -2.058 -5.465 2.663 1.00 . D A . 110 HEC C2C 1 1 12 22418 4 2 1 HEC C2D C -7.800 -7.388 2.736 1.00 . D A . 110 HEC C2D 1 1 12 22419 4 2 1 HEC C3A C -8.702 -1.407 -0.660 1.00 . D A . 110 HEC C3A 1 1 12 22420 4 2 1 HEC C3B C -2.764 -0.981 0.459 1.00 . D A . 110 HEC C3B 1 1 12 22421 4 2 1 HEC C3C C -2.858 -6.501 2.992 1.00 . D A . 110 HEC C3C 1 1 12 22422 4 2 1 HEC C3D C -8.864 -6.731 2.226 1.00 . D A . 110 HEC C3D 1 1 12 22423 4 2 1 HEC C4A C -7.385 -1.698 -0.142 1.00 . D A . 110 HEC C4A 1 1 12 22424 4 2 1 HEC C4B C -3.268 -2.186 1.077 1.00 . D A . 110 HEC C4B 1 1 12 22425 4 2 1 HEC C4C C -4.204 -6.131 2.623 1.00 . D A . 110 HEC C4C 1 1 12 22426 4 2 1 HEC C4D C -8.362 -5.527 1.608 1.00 . D A . 110 HEC C4D 1 1 12 22427 4 2 1 HEC CAA C -10.963 -2.612 -0.607 1.00 . D A . 110 HEC CAA 1 1 12 22428 4 2 1 HEC CAB C -1.330 -0.541 0.480 1.00 . D A . 110 HEC CAB 1 1 12 22429 4 2 1 HEC CAC C -2.469 -7.806 3.623 1.00 . D A . 110 HEC CAC 1 1 12 22430 4 2 1 HEC CAD C -10.308 -7.136 2.270 1.00 . D A . 110 HEC CAD 1 1 12 22431 4 2 1 HEC CBA C -11.872 -2.409 0.602 1.00 . D A . 110 HEC CBA 1 1 12 22432 4 2 1 HEC CBB C -1.130 0.904 0.927 1.00 . D A . 110 HEC CBB 1 1 12 22433 4 2 1 HEC CBC C -1.164 -7.748 4.413 1.00 . D A . 110 HEC CBC 1 1 12 22434 4 2 1 HEC CBD C -10.917 -7.412 0.898 1.00 . D A . 110 HEC CBD 1 1 12 22435 4 2 1 HEC CGA C -12.946 -1.371 0.311 1.00 . D A . 110 HEC CGA 1 1 12 22436 4 2 1 HEC CGD C -11.630 -8.756 0.875 1.00 . D A . 110 HEC CGD 1 1 12 22437 4 2 1 HEC CHA C -9.163 -4.568 0.961 1.00 . D A . 110 HEC CHA 1 1 12 22438 4 2 1 HEC CHB C -6.264 -0.863 -0.300 1.00 . D A . 110 HEC CHB 1 1 12 22439 4 2 1 HEC CHC C -2.477 -3.111 1.783 1.00 . D A . 110 HEC CHC 1 1 12 22440 4 2 1 HEC CHD C -5.335 -6.948 2.805 1.00 . D A . 110 HEC CHD 1 1 12 22441 4 2 1 HEC CMA C -9.065 -0.176 -1.438 1.00 . D A . 110 HEC CMA 1 1 12 22442 4 2 1 HEC CMB C -3.821 0.928 -0.885 1.00 . D A . 110 HEC CMB 1 1 12 22443 4 2 1 HEC CMC C -0.572 -5.352 2.843 1.00 . D A . 110 HEC CMC 1 1 12 22444 4 2 1 HEC CMD C -7.789 -8.693 3.478 1.00 . D A . 110 HEC CMD 1 1 12 22445 4 2 1 HEC FE FE -5.807 -3.881 1.303 1.00 . D A . 110 HEC FE 1 1 12 22446 4 2 1 HEC HAA1 H -11.269 -1.892 -1.365 1.00 . D A . 110 HEC HAA1 1 1 12 22447 4 2 1 HEC HAA2 H -11.139 -3.624 -0.974 1.00 . D A . 110 HEC HAA2 1 1 12 22448 4 2 1 HEC HAB H -0.766 -1.171 1.168 1.00 . D A . 110 HEC HAB 1 1 12 22449 4 2 1 HEC HAC H -3.250 -8.123 4.314 1.00 . D A . 110 HEC HAC 1 1 12 22450 4 2 1 HEC HAD1 H -10.412 -8.049 2.857 1.00 . D A . 110 HEC HAD1 1 1 12 22451 4 2 1 HEC HAD2 H -10.895 -6.340 2.728 1.00 . D A . 110 HEC HAD2 1 1 12 22452 4 2 1 HEC HBA1 H -12.358 -3.351 0.854 1.00 . D A . 110 HEC HBA1 1 1 12 22453 4 2 1 HEC HBA2 H -11.278 -2.068 1.450 1.00 . D A . 110 HEC HBA2 1 1 12 22454 4 2 1 HEC HBB1 H -2.040 1.265 1.406 1.00 . D A . 110 HEC HBB1 1 1 12 22455 4 2 1 HEC HBB2 H -0.303 0.955 1.635 1.00 . D A . 110 HEC HBB2 1 1 12 22456 4 2 1 HEC HBB3 H -0.905 1.525 0.060 1.00 . D A . 110 HEC HBB3 1 1 12 22457 4 2 1 HEC HBC1 H -1.138 -8.568 5.131 1.00 . D A . 110 HEC HBC1 1 1 12 22458 4 2 1 HEC HBC2 H -0.321 -7.838 3.728 1.00 . D A . 110 HEC HBC2 1 1 12 22459 4 2 1 HEC HBC3 H -1.102 -6.798 4.943 1.00 . D A . 110 HEC HBC3 1 1 12 22460 4 2 1 HEC HBD1 H -11.638 -6.631 0.657 1.00 . D A . 110 HEC HBD1 1 1 12 22461 4 2 1 HEC HBD2 H -10.128 -7.423 0.146 1.00 . D A . 110 HEC HBD2 1 1 12 22462 4 2 1 HEC HHA H -10.229 -4.781 0.873 1.00 . D A . 110 HEC HHA 1 1 12 22463 4 2 1 HEC HHB H -6.415 0.093 -0.800 1.00 . D A . 110 HEC HHB 1 1 12 22464 4 2 1 HEC HHC H -1.482 -2.790 2.089 1.00 . D A . 110 HEC HHC 1 1 12 22465 4 2 1 HEC HHD H -5.180 -7.924 3.266 1.00 . D A . 110 HEC HHD 1 1 12 22466 4 2 1 HEC HMA1 H -8.157 0.346 -1.738 1.00 . D A . 110 HEC HMA1 1 1 12 22467 4 2 1 HEC HMA2 H -9.631 -0.462 -2.326 1.00 . D A . 110 HEC HMA2 1 1 12 22468 4 2 1 HEC HMA3 H -9.673 0.481 -0.816 1.00 . D A . 110 HEC HMA3 1 1 12 22469 4 2 1 HEC HMB1 H -3.944 0.718 -1.947 1.00 . D A . 110 HEC HMB1 1 1 12 22470 4 2 1 HEC HMB2 H -4.645 1.553 -0.540 1.00 . D A . 110 HEC HMB2 1 1 12 22471 4 2 1 HEC HMB3 H -2.878 1.450 -0.725 1.00 . D A . 110 HEC HMB3 1 1 12 22472 4 2 1 HEC HMC1 H -0.094 -6.270 2.503 1.00 . D A . 110 HEC HMC1 1 1 12 22473 4 2 1 HEC HMC2 H -0.198 -4.510 2.260 1.00 . D A . 110 HEC HMC2 1 1 12 22474 4 2 1 HEC HMC3 H -0.345 -5.193 3.898 1.00 . D A . 110 HEC HMC3 1 1 12 22475 4 2 1 HEC HMD1 H -7.706 -9.514 2.766 1.00 . D A . 110 HEC HMD1 1 1 12 22476 4 2 1 HEC HMD2 H -6.940 -8.716 4.160 1.00 . D A . 110 HEC HMD2 1 1 12 22477 4 2 1 HEC HMD3 H -8.714 -8.796 4.046 1.00 . D A . 110 HEC HMD3 1 1 12 22478 4 2 1 HEC NA N -7.389 -2.910 0.526 1.00 . D A . 110 HEC NA 1 1 12 22479 4 2 1 HEC NB N -4.633 -2.295 0.873 1.00 . D A . 110 HEC NB 1 1 12 22480 4 2 1 HEC NC N -4.219 -4.864 2.066 1.00 . D A . 110 HEC NC 1 1 12 22481 4 2 1 HEC ND N -6.986 -5.454 1.745 1.00 . D A . 110 HEC ND 1 1 12 22482 4 2 1 HEC O1A O -14.110 -1.792 0.136 1.00 . D A . 110 HEC O1A 1 1 12 22483 4 2 1 HEC O1D O -11.035 -9.723 1.398 1.00 . D A . 110 HEC O1D 1 1 12 22484 4 2 1 HEC O2A O -12.583 -0.175 0.269 1.00 . D A . 110 HEC O2A 1 1 12 22485 4 2 1 HEC O2D O -12.757 -8.792 0.335 1.00 . D A . 110 HEC O2D 1 1 12 22486 5 2 1 HEC C1A C -0.182 4.038 -9.321 1.00 . E A . 111 HEC C1A 1 1 12 22487 5 2 1 HEC C1B C -1.470 0.577 -11.566 1.00 . E A . 111 HEC C1B 1 1 12 22488 5 2 1 HEC C1C C -3.272 -1.067 -7.967 1.00 . E A . 111 HEC C1C 1 1 12 22489 5 2 1 HEC C1D C -1.931 2.381 -5.735 1.00 . E A . 111 HEC C1D 1 1 12 22490 5 2 1 HEC C2A C 0.407 4.750 -10.431 1.00 . E A . 111 HEC C2A 1 1 12 22491 5 2 1 HEC C2B C -1.605 -0.593 -12.402 1.00 . E A . 111 HEC C2B 1 1 12 22492 5 2 1 HEC C2C C -3.987 -1.704 -6.886 1.00 . E A . 111 HEC C2C 1 1 12 22493 5 2 1 HEC C2D C -1.444 3.390 -4.825 1.00 . E A . 111 HEC C2D 1 1 12 22494 5 2 1 HEC C3A C 0.212 3.997 -11.534 1.00 . E A . 111 HEC C3A 1 1 12 22495 5 2 1 HEC C3B C -2.207 -1.545 -11.658 1.00 . E A . 111 HEC C3B 1 1 12 22496 5 2 1 HEC C3C C -3.856 -0.910 -5.802 1.00 . E A . 111 HEC C3C 1 1 12 22497 5 2 1 HEC C3D C -0.746 4.283 -5.559 1.00 . E A . 111 HEC C3D 1 1 12 22498 5 2 1 HEC C4A C -0.500 2.811 -11.118 1.00 . E A . 111 HEC C4A 1 1 12 22499 5 2 1 HEC C4B C -2.451 -0.974 -10.355 1.00 . E A . 111 HEC C4B 1 1 12 22500 5 2 1 HEC C4C C -3.059 0.226 -6.201 1.00 . E A . 111 HEC C4C 1 1 12 22501 5 2 1 HEC C4D C -0.795 3.835 -6.931 1.00 . E A . 111 HEC C4D 1 1 12 22502 5 2 1 HEC CAA C 1.098 6.079 -10.330 1.00 . E A . 111 HEC CAA 1 1 12 22503 5 2 1 HEC CAB C -2.572 -2.942 -12.066 1.00 . E A . 111 HEC CAB 1 1 12 22504 5 2 1 HEC CAC C -4.415 -1.126 -4.426 1.00 . E A . 111 HEC CAC 1 1 12 22505 5 2 1 HEC CAD C -0.038 5.518 -5.083 1.00 . E A . 111 HEC CAD 1 1 12 22506 5 2 1 HEC CBA C 2.470 6.117 -10.996 1.00 . E A . 111 HEC CBA 1 1 12 22507 5 2 1 HEC CBB C -1.466 -3.967 -11.830 1.00 . E A . 111 HEC CBB 1 1 12 22508 5 2 1 HEC CBC C -4.228 -2.545 -3.896 1.00 . E A . 111 HEC CBC 1 1 12 22509 5 2 1 HEC CBD C -0.971 6.680 -4.756 1.00 . E A . 111 HEC CBD 1 1 12 22510 5 2 1 HEC CGA C 2.602 7.326 -11.910 1.00 . E A . 111 HEC CGA 1 1 12 22511 5 2 1 HEC CGD C -0.185 7.953 -4.477 1.00 . E A . 111 HEC CGD 1 1 12 22512 5 2 1 HEC CHA C -0.183 4.499 -8.009 1.00 . E A . 111 HEC CHA 1 1 12 22513 5 2 1 HEC CHB C -0.893 1.773 -11.982 1.00 . E A . 111 HEC CHB 1 1 12 22514 5 2 1 HEC CHC C -3.066 -1.654 -9.288 1.00 . E A . 111 HEC CHC 1 1 12 22515 5 2 1 HEC CHD C -2.698 1.286 -5.350 1.00 . E A . 111 HEC CHD 1 1 12 22516 5 2 1 HEC CMA C 0.636 4.294 -12.943 1.00 . E A . 111 HEC CMA 1 1 12 22517 5 2 1 HEC CMB C -1.145 -0.687 -13.828 1.00 . E A . 111 HEC CMB 1 1 12 22518 5 2 1 HEC CMC C -4.725 -3.006 -6.994 1.00 . E A . 111 HEC CMC 1 1 12 22519 5 2 1 HEC CMD C -1.692 3.404 -3.344 1.00 . E A . 111 HEC CMD 1 1 12 22520 5 2 1 HEC FE FE -1.740 1.490 -8.657 1.00 . E A . 111 HEC FE 1 1 12 22521 5 2 1 HEC HAA1 H 0.487 6.844 -10.808 1.00 . E A . 111 HEC HAA1 1 1 12 22522 5 2 1 HEC HAA2 H 1.243 6.333 -9.280 1.00 . E A . 111 HEC HAA2 1 1 12 22523 5 2 1 HEC HAB H -3.441 -3.271 -11.497 1.00 . E A . 111 HEC HAB 1 1 12 22524 5 2 1 HEC HAC H -3.922 -0.453 -3.724 1.00 . E A . 111 HEC HAC 1 1 12 22525 5 2 1 HEC HAD1 H 0.522 5.290 -4.177 1.00 . E A . 111 HEC HAD1 1 1 12 22526 5 2 1 HEC HAD2 H 0.647 5.865 -5.857 1.00 . E A . 111 HEC HAD2 1 1 12 22527 5 2 1 HEC HBA1 H 3.244 6.173 -10.230 1.00 . E A . 111 HEC HBA1 1 1 12 22528 5 2 1 HEC HBA2 H 2.611 5.214 -11.590 1.00 . E A . 111 HEC HBA2 1 1 12 22529 5 2 1 HEC HBB1 H -1.769 -4.654 -11.040 1.00 . E A . 111 HEC HBB1 1 1 12 22530 5 2 1 HEC HBB2 H -1.287 -4.526 -12.749 1.00 . E A . 111 HEC HBB2 1 1 12 22531 5 2 1 HEC HBB3 H -0.552 -3.453 -11.534 1.00 . E A . 111 HEC HBB3 1 1 12 22532 5 2 1 HEC HBC1 H -4.175 -2.522 -2.807 1.00 . E A . 111 HEC HBC1 1 1 12 22533 5 2 1 HEC HBC2 H -5.070 -3.163 -4.206 1.00 . E A . 111 HEC HBC2 1 1 12 22534 5 2 1 HEC HBC3 H -3.304 -2.963 -4.295 1.00 . E A . 111 HEC HBC3 1 1 12 22535 5 2 1 HEC HBD1 H -1.638 6.860 -5.599 1.00 . E A . 111 HEC HBD1 1 1 12 22536 5 2 1 HEC HBD2 H -1.561 6.435 -3.872 1.00 . E A . 111 HEC HBD2 1 1 12 22537 5 2 1 HEC HHA H 0.325 5.440 -7.797 1.00 . E A . 111 HEC HHA 1 1 12 22538 5 2 1 HEC HHB H -0.732 1.919 -13.050 1.00 . E A . 111 HEC HHB 1 1 12 22539 5 2 1 HEC HHC H -3.409 -2.672 -9.473 1.00 . E A . 111 HEC HHC 1 1 12 22540 5 2 1 HEC HHD H -3.045 1.242 -4.318 1.00 . E A . 111 HEC HHD 1 1 12 22541 5 2 1 HEC HMA1 H 1.149 5.255 -12.973 1.00 . E A . 111 HEC HMA1 1 1 12 22542 5 2 1 HEC HMA2 H 1.309 3.511 -13.293 1.00 . E A . 111 HEC HMA2 1 1 12 22543 5 2 1 HEC HMA3 H -0.243 4.332 -13.587 1.00 . E A . 111 HEC HMA3 1 1 12 22544 5 2 1 HEC HMB1 H -1.784 -0.067 -14.457 1.00 . E A . 111 HEC HMB1 1 1 12 22545 5 2 1 HEC HMB2 H -0.115 -0.339 -13.902 1.00 . E A . 111 HEC HMB2 1 1 12 22546 5 2 1 HEC HMB3 H -1.203 -1.723 -14.161 1.00 . E A . 111 HEC HMB3 1 1 12 22547 5 2 1 HEC HMC1 H -5.798 -2.823 -6.935 1.00 . E A . 111 HEC HMC1 1 1 12 22548 5 2 1 HEC HMC2 H -4.489 -3.479 -7.948 1.00 . E A . 111 HEC HMC2 1 1 12 22549 5 2 1 HEC HMC3 H -4.423 -3.663 -6.178 1.00 . E A . 111 HEC HMC3 1 1 12 22550 5 2 1 HEC HMD1 H -2.765 3.401 -3.156 1.00 . E A . 111 HEC HMD1 1 1 12 22551 5 2 1 HEC HMD2 H -1.241 2.520 -2.892 1.00 . E A . 111 HEC HMD2 1 1 12 22552 5 2 1 HEC HMD3 H -1.249 4.300 -2.910 1.00 . E A . 111 HEC HMD3 1 1 12 22553 5 2 1 HEC NA N -0.738 2.847 -9.755 1.00 . E A . 111 HEC NA 1 1 12 22554 5 2 1 HEC NB N -1.993 0.332 -10.309 1.00 . E A . 111 HEC NB 1 1 12 22555 5 2 1 HEC NC N -2.705 0.119 -7.535 1.00 . E A . 111 HEC NC 1 1 12 22556 5 2 1 HEC ND N -1.526 2.664 -7.028 1.00 . E A . 111 HEC ND 1 1 12 22557 5 2 1 HEC O1A O 1.853 7.365 -12.910 1.00 . E A . 111 HEC O1A 1 1 12 22558 5 2 1 HEC O1D O 0.088 8.678 -5.458 1.00 . E A . 111 HEC O1D 1 1 12 22559 5 2 1 HEC O2A O 3.449 8.189 -11.592 1.00 . E A . 111 HEC O2A 1 1 12 22560 5 2 1 HEC O2D O 0.130 8.177 -3.288 1.00 . E A . 111 HEC O2D 1 1 13 22561 1 1 1 ALA C C -0.932 3.664 20.322 1.00 . A A . 1 ALA C 1 1 13 22562 1 1 1 ALA CA C 0.458 3.092 20.607 1.00 . A A . 1 ALA CA 1 1 13 22563 1 1 1 ALA CB C 0.526 1.582 20.372 1.00 . A A . 1 ALA CB 1 1 13 22564 1 1 1 ALA H1 H 1.700 2.923 22.204 1.00 . A A . 1 ALA H1 1 1 13 22565 1 1 1 ALA H2 H 0.935 4.387 22.096 1.00 . A A . 1 ALA H2 1 1 13 22566 1 1 1 ALA HA H 1.184 3.581 19.958 1.00 . A A . 1 ALA HA 1 1 13 22567 1 1 1 ALA HB1 H 1.145 1.121 21.143 1.00 . A A . 1 ALA HB1 1 1 13 22568 1 1 1 ALA HB2 H -0.478 1.161 20.415 1.00 . A A . 1 ALA HB2 1 1 13 22569 1 1 1 ALA HB3 H 0.961 1.385 19.392 1.00 . A A . 1 ALA HB3 1 1 13 22570 1 1 1 ALA N N 0.826 3.386 21.982 1.00 . A A . 1 ALA N 1 1 13 22571 1 1 1 ALA O O -1.922 3.211 20.892 1.00 . A A . 1 ALA O 1 1 13 22572 1 1 2 PRO C C -3.035 4.418 18.121 1.00 . A A . 2 PRO C 1 1 13 22573 1 1 2 PRO CA C -2.213 5.316 19.047 1.00 . A A . 2 PRO CA 1 1 13 22574 1 1 2 PRO CB C -1.808 6.628 18.395 1.00 . A A . 2 PRO CB 1 1 13 22575 1 1 2 PRO CD C 0.193 5.239 18.719 1.00 . A A . 2 PRO CD 1 1 13 22576 1 1 2 PRO CG C -0.348 6.467 18.004 1.00 . A A . 2 PRO CG 1 1 13 22577 1 1 2 PRO HA H -2.779 5.464 19.858 1.00 . A A . 2 PRO HA 1 1 13 22578 1 1 2 PRO HB2 H -2.426 6.838 17.522 1.00 . A A . 2 PRO HB2 1 1 13 22579 1 1 2 PRO HB3 H -1.937 7.463 19.084 1.00 . A A . 2 PRO HB3 1 1 13 22580 1 1 2 PRO HD2 H 0.617 4.525 18.013 1.00 . A A . 2 PRO HD2 1 1 13 22581 1 1 2 PRO HD3 H 0.986 5.506 19.417 1.00 . A A . 2 PRO HD3 1 1 13 22582 1 1 2 PRO HG2 H -0.253 6.352 16.924 1.00 . A A . 2 PRO HG2 1 1 13 22583 1 1 2 PRO HG3 H 0.222 7.353 18.282 1.00 . A A . 2 PRO HG3 1 1 13 22584 1 1 2 PRO N N -0.961 4.677 19.415 1.00 . A A . 2 PRO N 1 1 13 22585 1 1 2 PRO O O -2.492 3.522 17.476 1.00 . A A . 2 PRO O 1 1 13 22586 1 1 3 LYS C C -5.069 4.348 15.791 1.00 . A A . 3 LYS C 1 1 13 22587 1 1 3 LYS CA C -5.235 3.915 17.250 1.00 . A A . 3 LYS CA 1 1 13 22588 1 1 3 LYS CB C -6.671 4.028 17.765 1.00 . A A . 3 LYS CB 1 1 13 22589 1 1 3 LYS CD C -6.298 2.814 19.944 1.00 . A A . 3 LYS CD 1 1 13 22590 1 1 3 LYS CE C -7.224 3.224 21.091 1.00 . A A . 3 LYS CE 1 1 13 22591 1 1 3 LYS CG C -7.047 2.809 18.610 1.00 . A A . 3 LYS CG 1 1 13 22592 1 1 3 LYS H H -4.766 5.418 18.613 1.00 . A A . 3 LYS H 1 1 13 22593 1 1 3 LYS HA H -4.943 2.868 17.335 1.00 . A A . 3 LYS HA 1 1 13 22594 1 1 3 LYS HB2 H -6.778 4.935 18.361 1.00 . A A . 3 LYS HB2 1 1 13 22595 1 1 3 LYS HB3 H -7.358 4.117 16.924 1.00 . A A . 3 LYS HB3 1 1 13 22596 1 1 3 LYS HD2 H -5.888 1.823 20.139 1.00 . A A . 3 LYS HD2 1 1 13 22597 1 1 3 LYS HD3 H -5.455 3.503 19.889 1.00 . A A . 3 LYS HD3 1 1 13 22598 1 1 3 LYS HE2 H -6.919 4.195 21.483 1.00 . A A . 3 LYS HE2 1 1 13 22599 1 1 3 LYS HE3 H -8.243 3.335 20.722 1.00 . A A . 3 LYS HE3 1 1 13 22600 1 1 3 LYS HG2 H -8.122 2.807 18.793 1.00 . A A . 3 LYS HG2 1 1 13 22601 1 1 3 LYS HG3 H -6.815 1.896 18.062 1.00 . A A . 3 LYS HG3 1 1 13 22602 1 1 3 LYS HZ1 H -7.936 2.349 22.844 1.00 . A A . 3 LYS HZ1 1 1 13 22603 1 1 3 LYS HZ2 H -7.285 1.270 21.813 1.00 . A A . 3 LYS HZ2 1 1 13 22604 1 1 3 LYS N N -4.332 4.688 18.085 1.00 . A A . 3 LYS N 1 1 13 22605 1 1 3 LYS NZ N -7.188 2.213 22.172 1.00 . A A . 3 LYS NZ 1 1 13 22606 1 1 3 LYS O O -4.303 5.263 15.495 1.00 . A A . 3 LYS O 1 1 13 22607 1 1 4 ALA C C -6.308 5.373 13.258 1.00 . A A . 4 ALA C 1 1 13 22608 1 1 4 ALA CA C -5.744 3.971 13.500 1.00 . A A . 4 ALA CA 1 1 13 22609 1 1 4 ALA CB C -6.501 2.896 12.718 1.00 . A A . 4 ALA CB 1 1 13 22610 1 1 4 ALA H H -6.422 2.926 15.169 1.00 . A A . 4 ALA H 1 1 13 22611 1 1 4 ALA HA H -4.697 3.953 13.198 1.00 . A A . 4 ALA HA 1 1 13 22612 1 1 4 ALA HB1 H -7.330 2.525 13.321 1.00 . A A . 4 ALA HB1 1 1 13 22613 1 1 4 ALA HB2 H -6.888 3.324 11.793 1.00 . A A . 4 ALA HB2 1 1 13 22614 1 1 4 ALA HB3 H -5.826 2.074 12.483 1.00 . A A . 4 ALA HB3 1 1 13 22615 1 1 4 ALA N N -5.801 3.669 14.920 1.00 . A A . 4 ALA N 1 1 13 22616 1 1 4 ALA O O -7.157 5.844 14.014 1.00 . A A . 4 ALA O 1 1 13 22617 1 1 5 PRO C C -7.637 7.326 11.195 1.00 . A A . 5 PRO C 1 1 13 22618 1 1 5 PRO CA C -6.243 7.357 11.824 1.00 . A A . 5 PRO CA 1 1 13 22619 1 1 5 PRO CB C -5.177 7.890 10.880 1.00 . A A . 5 PRO CB 1 1 13 22620 1 1 5 PRO CD C -4.793 5.492 11.257 1.00 . A A . 5 PRO CD 1 1 13 22621 1 1 5 PRO CG C -4.424 6.672 10.372 1.00 . A A . 5 PRO CG 1 1 13 22622 1 1 5 PRO HA H -6.326 7.921 12.645 1.00 . A A . 5 PRO HA 1 1 13 22623 1 1 5 PRO HB2 H -5.627 8.443 10.056 1.00 . A A . 5 PRO HB2 1 1 13 22624 1 1 5 PRO HB3 H -4.507 8.577 11.396 1.00 . A A . 5 PRO HB3 1 1 13 22625 1 1 5 PRO HD2 H -5.188 4.664 10.668 1.00 . A A . 5 PRO HD2 1 1 13 22626 1 1 5 PRO HD3 H -3.924 5.115 11.796 1.00 . A A . 5 PRO HD3 1 1 13 22627 1 1 5 PRO HG2 H -4.685 6.467 9.334 1.00 . A A . 5 PRO HG2 1 1 13 22628 1 1 5 PRO HG3 H -3.348 6.849 10.401 1.00 . A A . 5 PRO HG3 1 1 13 22629 1 1 5 PRO N N -5.799 6.018 12.174 1.00 . A A . 5 PRO N 1 1 13 22630 1 1 5 PRO O O -8.148 6.257 10.862 1.00 . A A . 5 PRO O 1 1 13 22631 1 1 6 ALA C C -9.552 7.954 9.096 1.00 . A A . 6 ALA C 1 1 13 22632 1 1 6 ALA CA C -9.539 8.632 10.468 1.00 . A A . 6 ALA CA 1 1 13 22633 1 1 6 ALA CB C -9.930 10.109 10.392 1.00 . A A . 6 ALA CB 1 1 13 22634 1 1 6 ALA H H -7.791 9.374 11.324 1.00 . A A . 6 ALA H 1 1 13 22635 1 1 6 ALA HA H -10.239 8.116 11.125 1.00 . A A . 6 ALA HA 1 1 13 22636 1 1 6 ALA HB1 H -9.037 10.726 10.485 1.00 . A A . 6 ALA HB1 1 1 13 22637 1 1 6 ALA HB2 H -10.412 10.309 9.435 1.00 . A A . 6 ALA HB2 1 1 13 22638 1 1 6 ALA HB3 H -10.620 10.344 11.203 1.00 . A A . 6 ALA HB3 1 1 13 22639 1 1 6 ALA N N -8.213 8.510 11.051 1.00 . A A . 6 ALA N 1 1 13 22640 1 1 6 ALA O O -8.537 7.416 8.655 1.00 . A A . 6 ALA O 1 1 13 22641 1 1 7 ASP C C -10.714 8.477 6.073 1.00 . A A . 7 ASP C 1 1 13 22642 1 1 7 ASP CA C -10.872 7.399 7.147 1.00 . A A . 7 ASP CA 1 1 13 22643 1 1 7 ASP CB C -12.260 6.776 6.991 1.00 . A A . 7 ASP CB 1 1 13 22644 1 1 7 ASP CG C -12.832 6.145 8.262 1.00 . A A . 7 ASP CG 1 1 13 22645 1 1 7 ASP H H -11.533 8.441 8.825 1.00 . A A . 7 ASP H 1 1 13 22646 1 1 7 ASP HA H -10.097 6.635 7.087 1.00 . A A . 7 ASP HA 1 1 13 22647 1 1 7 ASP HB2 H -12.950 7.544 6.643 1.00 . A A . 7 ASP HB2 1 1 13 22648 1 1 7 ASP HB3 H -12.215 6.013 6.214 1.00 . A A . 7 ASP HB3 1 1 13 22649 1 1 7 ASP N N -10.713 8.002 8.459 1.00 . A A . 7 ASP N 1 1 13 22650 1 1 7 ASP O O -10.492 9.645 6.388 1.00 . A A . 7 ASP O 1 1 13 22651 1 1 7 ASP OD1 O -13.019 6.904 9.238 1.00 . A A . 7 ASP OD1 1 1 13 22652 1 1 7 ASP OD2 O -13.069 4.918 8.230 1.00 . A A . 7 ASP OD2 1 1 13 22653 1 1 8 GLY C C -9.247 9.349 3.474 1.00 . A A . 8 GLY C 1 1 13 22654 1 1 8 GLY CA C -10.709 8.961 3.703 1.00 . A A . 8 GLY CA 1 1 13 22655 1 1 8 GLY H H -11.017 7.095 4.577 1.00 . A A . 8 GLY H 1 1 13 22656 1 1 8 GLY HA2 H -11.111 8.495 2.803 1.00 . A A . 8 GLY HA2 1 1 13 22657 1 1 8 GLY HA3 H -11.302 9.856 3.890 1.00 . A A . 8 GLY HA3 1 1 13 22658 1 1 8 GLY N N -10.836 8.047 4.825 1.00 . A A . 8 GLY N 1 1 13 22659 1 1 8 GLY O O -8.961 10.318 2.773 1.00 . A A . 8 GLY O 1 1 13 22660 1 1 9 LEU C C -6.456 8.327 2.583 1.00 . A A . 9 LEU C 1 1 13 22661 1 1 9 LEU CA C -6.935 8.822 3.949 1.00 . A A . 9 LEU CA 1 1 13 22662 1 1 9 LEU CB C -6.174 8.210 5.127 1.00 . A A . 9 LEU CB 1 1 13 22663 1 1 9 LEU CD1 C -4.168 7.128 4.049 1.00 . A A . 9 LEU CD1 1 1 13 22664 1 1 9 LEU CD2 C -4.131 9.599 4.625 1.00 . A A . 9 LEU CD2 1 1 13 22665 1 1 9 LEU CG C -4.648 8.213 5.015 1.00 . A A . 9 LEU CG 1 1 13 22666 1 1 9 LEU H H -8.601 7.785 4.646 1.00 . A A . 9 LEU H 1 1 13 22667 1 1 9 LEU HA H -6.787 9.901 3.996 1.00 . A A . 9 LEU HA 1 1 13 22668 1 1 9 LEU HB2 H -6.454 8.747 6.033 1.00 . A A . 9 LEU HB2 1 1 13 22669 1 1 9 LEU HB3 H -6.508 7.179 5.252 1.00 . A A . 9 LEU HB3 1 1 13 22670 1 1 9 LEU HD11 H -4.870 6.295 4.059 1.00 . A A . 9 LEU HD11 1 1 13 22671 1 1 9 LEU HD12 H -4.107 7.540 3.041 1.00 . A A . 9 LEU HD12 1 1 13 22672 1 1 9 LEU HD13 H -3.183 6.777 4.358 1.00 . A A . 9 LEU HD13 1 1 13 22673 1 1 9 LEU HD21 H -4.756 10.363 5.085 1.00 . A A . 9 LEU HD21 1 1 13 22674 1 1 9 LEU HD22 H -3.103 9.713 4.970 1.00 . A A . 9 LEU HD22 1 1 13 22675 1 1 9 LEU HD23 H -4.163 9.707 3.540 1.00 . A A . 9 LEU HD23 1 1 13 22676 1 1 9 LEU HG H -4.233 7.978 5.995 1.00 . A A . 9 LEU HG 1 1 13 22677 1 1 9 LEU N N -8.360 8.572 4.078 1.00 . A A . 9 LEU N 1 1 13 22678 1 1 9 LEU O O -6.176 7.141 2.412 1.00 . A A . 9 LEU O 1 1 13 22679 1 1 10 LYS C C -4.518 9.465 0.088 1.00 . A A . 10 LYS C 1 1 13 22680 1 1 10 LYS CA C -5.936 8.932 0.300 1.00 . A A . 10 LYS CA 1 1 13 22681 1 1 10 LYS CB C -6.945 9.441 -0.732 1.00 . A A . 10 LYS CB 1 1 13 22682 1 1 10 LYS CD C -7.651 11.681 0.185 1.00 . A A . 10 LYS CD 1 1 13 22683 1 1 10 LYS CE C -8.336 12.926 -0.383 1.00 . A A . 10 LYS CE 1 1 13 22684 1 1 10 LYS CG C -6.844 10.959 -0.895 1.00 . A A . 10 LYS CG 1 1 13 22685 1 1 10 LYS H H -6.605 10.222 1.793 1.00 . A A . 10 LYS H 1 1 13 22686 1 1 10 LYS HA H -5.913 7.845 0.219 1.00 . A A . 10 LYS HA 1 1 13 22687 1 1 10 LYS HB2 H -6.765 8.956 -1.692 1.00 . A A . 10 LYS HB2 1 1 13 22688 1 1 10 LYS HB3 H -7.954 9.171 -0.423 1.00 . A A . 10 LYS HB3 1 1 13 22689 1 1 10 LYS HD2 H -8.401 11.005 0.597 1.00 . A A . 10 LYS HD2 1 1 13 22690 1 1 10 LYS HD3 H -6.994 11.967 1.006 1.00 . A A . 10 LYS HD3 1 1 13 22691 1 1 10 LYS HE2 H -7.792 13.280 -1.259 1.00 . A A . 10 LYS HE2 1 1 13 22692 1 1 10 LYS HE3 H -9.344 12.675 -0.714 1.00 . A A . 10 LYS HE3 1 1 13 22693 1 1 10 LYS HG2 H -5.799 11.265 -0.840 1.00 . A A . 10 LYS HG2 1 1 13 22694 1 1 10 LYS HG3 H -7.208 11.248 -1.881 1.00 . A A . 10 LYS HG3 1 1 13 22695 1 1 10 LYS HZ1 H -9.348 14.210 0.909 1.00 . A A . 10 LYS HZ1 1 1 13 22696 1 1 10 LYS HZ2 H -7.898 13.742 1.484 1.00 . A A . 10 LYS HZ2 1 1 13 22697 1 1 10 LYS N N -6.376 9.259 1.645 1.00 . A A . 10 LYS N 1 1 13 22698 1 1 10 LYS NZ N -8.395 13.996 0.637 1.00 . A A . 10 LYS NZ 1 1 13 22699 1 1 10 LYS O O -4.053 10.319 0.841 1.00 . A A . 10 LYS O 1 1 13 22700 1 1 11 MET C C -2.455 10.031 -2.628 1.00 . A A . 11 MET C 1 1 13 22701 1 1 11 MET CA C -2.513 9.349 -1.260 1.00 . A A . 11 MET CA 1 1 13 22702 1 1 11 MET CB C -1.595 8.125 -1.261 1.00 . A A . 11 MET CB 1 1 13 22703 1 1 11 MET CE C -0.627 4.786 -0.168 1.00 . A A . 11 MET CE 1 1 13 22704 1 1 11 MET CG C -1.921 7.194 -0.091 1.00 . A A . 11 MET CG 1 1 13 22705 1 1 11 MET H H -4.255 8.243 -1.548 1.00 . A A . 11 MET H 1 1 13 22706 1 1 11 MET HA H -2.230 10.057 -0.481 1.00 . A A . 11 MET HA 1 1 13 22707 1 1 11 MET HB2 H -1.704 7.584 -2.201 1.00 . A A . 11 MET HB2 1 1 13 22708 1 1 11 MET HB3 H -0.555 8.446 -1.197 1.00 . A A . 11 MET HB3 1 1 13 22709 1 1 11 MET HE1 H 0.173 5.524 -0.233 1.00 . A A . 11 MET HE1 1 1 13 22710 1 1 11 MET HE2 H -0.718 4.440 0.862 1.00 . A A . 11 MET HE2 1 1 13 22711 1 1 11 MET HE3 H -0.396 3.941 -0.816 1.00 . A A . 11 MET HE3 1 1 13 22712 1 1 11 MET HG2 H -1.109 7.214 0.637 1.00 . A A . 11 MET HG2 1 1 13 22713 1 1 11 MET HG3 H -2.817 7.542 0.422 1.00 . A A . 11 MET HG3 1 1 13 22714 1 1 11 MET N N -3.869 8.937 -0.940 1.00 . A A . 11 MET N 1 1 13 22715 1 1 11 MET O O -2.971 9.502 -3.612 1.00 . A A . 11 MET O 1 1 13 22716 1 1 11 MET SD S -2.165 5.529 -0.685 1.00 . A A . 11 MET SD 1 1 13 22717 1 1 12 GLU C C -0.228 12.329 -4.118 1.00 . A A . 12 GLU C 1 1 13 22718 1 1 12 GLU CA C -1.692 11.956 -3.879 1.00 . A A . 12 GLU CA 1 1 13 22719 1 1 12 GLU CB C -2.578 13.203 -3.850 1.00 . A A . 12 GLU CB 1 1 13 22720 1 1 12 GLU CD C -1.562 15.446 -4.396 1.00 . A A . 12 GLU CD 1 1 13 22721 1 1 12 GLU CG C -2.194 14.174 -4.968 1.00 . A A . 12 GLU CG 1 1 13 22722 1 1 12 GLU H H -1.407 11.618 -1.843 1.00 . A A . 12 GLU H 1 1 13 22723 1 1 12 GLU HA H -2.039 11.290 -4.669 1.00 . A A . 12 GLU HA 1 1 13 22724 1 1 12 GLU HB2 H -3.623 12.913 -3.958 1.00 . A A . 12 GLU HB2 1 1 13 22725 1 1 12 GLU HB3 H -2.484 13.699 -2.884 1.00 . A A . 12 GLU HB3 1 1 13 22726 1 1 12 GLU HG2 H -1.493 13.691 -5.649 1.00 . A A . 12 GLU HG2 1 1 13 22727 1 1 12 GLU HG3 H -3.078 14.433 -5.549 1.00 . A A . 12 GLU HG3 1 1 13 22728 1 1 12 GLU N N -1.824 11.195 -2.647 1.00 . A A . 12 GLU N 1 1 13 22729 1 1 12 GLU O O 0.123 13.508 -4.127 1.00 . A A . 12 GLU O 1 1 13 22730 1 1 12 GLU OE1 O -2.095 15.935 -3.376 1.00 . A A . 12 GLU OE1 1 1 13 22731 1 1 12 GLU OE2 O -0.561 15.899 -4.992 1.00 . A A . 12 GLU OE2 1 1 13 22732 1 1 13 ALA C C 2.307 11.282 -6.030 1.00 . A A . 13 ALA C 1 1 13 22733 1 1 13 ALA CA C 2.006 11.507 -4.547 1.00 . A A . 13 ALA CA 1 1 13 22734 1 1 13 ALA CB C 2.816 10.579 -3.640 1.00 . A A . 13 ALA CB 1 1 13 22735 1 1 13 ALA H H 0.295 10.346 -4.300 1.00 . A A . 13 ALA H 1 1 13 22736 1 1 13 ALA HA H 2.240 12.540 -4.290 1.00 . A A . 13 ALA HA 1 1 13 22737 1 1 13 ALA HB1 H 2.451 10.661 -2.616 1.00 . A A . 13 ALA HB1 1 1 13 22738 1 1 13 ALA HB2 H 2.707 9.550 -3.983 1.00 . A A . 13 ALA HB2 1 1 13 22739 1 1 13 ALA HB3 H 3.868 10.863 -3.675 1.00 . A A . 13 ALA HB3 1 1 13 22740 1 1 13 ALA N N 0.588 11.302 -4.308 1.00 . A A . 13 ALA N 1 1 13 22741 1 1 13 ALA O O 3.343 11.718 -6.530 1.00 . A A . 13 ALA O 1 1 13 22742 1 1 14 THR C C 0.317 10.809 -8.888 1.00 . A A . 14 THR C 1 1 13 22743 1 1 14 THR CA C 1.536 10.313 -8.108 1.00 . A A . 14 THR CA 1 1 13 22744 1 1 14 THR CB C 1.785 8.811 -8.260 1.00 . A A . 14 THR CB 1 1 13 22745 1 1 14 THR CG2 C 2.595 8.231 -7.099 1.00 . A A . 14 THR CG2 1 1 13 22746 1 1 14 THR H H 0.543 10.251 -6.277 1.00 . A A . 14 THR H 1 1 13 22747 1 1 14 THR HA H 2.400 10.864 -8.479 1.00 . A A . 14 THR HA 1 1 13 22748 1 1 14 THR HB H 2.260 8.590 -9.215 1.00 . A A . 14 THR HB 1 1 13 22749 1 1 14 THR HG1 H 0.034 8.619 -7.309 1.00 . A A . 14 THR HG1 1 1 13 22750 1 1 14 THR HG21 H 3.481 8.844 -6.932 1.00 . A A . 14 THR HG21 1 1 13 22751 1 1 14 THR HG22 H 1.984 8.224 -6.196 1.00 . A A . 14 THR HG22 1 1 13 22752 1 1 14 THR HG23 H 2.898 7.212 -7.340 1.00 . A A . 14 THR HG23 1 1 13 22753 1 1 14 THR N N 1.383 10.602 -6.692 1.00 . A A . 14 THR N 1 1 13 22754 1 1 14 THR O O -0.606 11.378 -8.308 1.00 . A A . 14 THR O 1 1 13 22755 1 1 14 THR OG1 O 0.493 8.228 -8.107 1.00 . A A . 14 THR OG1 1 1 13 22756 1 1 15 LYS C C -1.939 10.075 -10.832 1.00 . A A . 15 LYS C 1 1 13 22757 1 1 15 LYS CA C -0.735 10.992 -11.058 1.00 . A A . 15 LYS CA 1 1 13 22758 1 1 15 LYS CB C -0.270 11.050 -12.514 1.00 . A A . 15 LYS CB 1 1 13 22759 1 1 15 LYS CD C -1.149 11.389 -14.854 1.00 . A A . 15 LYS CD 1 1 13 22760 1 1 15 LYS CE C -0.524 12.516 -15.678 1.00 . A A . 15 LYS CE 1 1 13 22761 1 1 15 LYS CG C -1.285 11.794 -13.385 1.00 . A A . 15 LYS CG 1 1 13 22762 1 1 15 LYS H H 1.109 10.112 -10.656 1.00 . A A . 15 LYS H 1 1 13 22763 1 1 15 LYS HA H -1.014 12.006 -10.768 1.00 . A A . 15 LYS HA 1 1 13 22764 1 1 15 LYS HB2 H 0.698 11.547 -12.572 1.00 . A A . 15 LYS HB2 1 1 13 22765 1 1 15 LYS HB3 H -0.132 10.038 -12.896 1.00 . A A . 15 LYS HB3 1 1 13 22766 1 1 15 LYS HD2 H -0.533 10.493 -14.932 1.00 . A A . 15 LYS HD2 1 1 13 22767 1 1 15 LYS HD3 H -2.129 11.138 -15.258 1.00 . A A . 15 LYS HD3 1 1 13 22768 1 1 15 LYS HE2 H -1.206 13.366 -15.717 1.00 . A A . 15 LYS HE2 1 1 13 22769 1 1 15 LYS HE3 H 0.390 12.863 -15.197 1.00 . A A . 15 LYS HE3 1 1 13 22770 1 1 15 LYS HG2 H -2.295 11.580 -13.036 1.00 . A A . 15 LYS HG2 1 1 13 22771 1 1 15 LYS HG3 H -1.135 12.869 -13.285 1.00 . A A . 15 LYS HG3 1 1 13 22772 1 1 15 LYS HZ1 H 0.477 11.317 -17.058 1.00 . A A . 15 LYS HZ1 1 1 13 22773 1 1 15 LYS HZ2 H -1.045 11.675 -17.513 1.00 . A A . 15 LYS HZ2 1 1 13 22774 1 1 15 LYS N N 0.354 10.576 -10.192 1.00 . A A . 15 LYS N 1 1 13 22775 1 1 15 LYS NZ N -0.224 12.050 -17.050 1.00 . A A . 15 LYS NZ 1 1 13 22776 1 1 15 LYS O O -3.007 10.296 -11.402 1.00 . A A . 15 LYS O 1 1 13 22777 1 1 16 GLN C C -2.879 7.902 -8.180 1.00 . A A . 16 GLN C 1 1 13 22778 1 1 16 GLN CA C -2.781 8.116 -9.692 1.00 . A A . 16 GLN CA 1 1 13 22779 1 1 16 GLN CB C -2.553 6.789 -10.420 1.00 . A A . 16 GLN CB 1 1 13 22780 1 1 16 GLN CD C -3.484 6.854 -12.762 1.00 . A A . 16 GLN CD 1 1 13 22781 1 1 16 GLN CG C -2.233 7.023 -11.898 1.00 . A A . 16 GLN CG 1 1 13 22782 1 1 16 GLN H H -0.856 8.895 -9.540 1.00 . A A . 16 GLN H 1 1 13 22783 1 1 16 GLN HA H -3.700 8.572 -10.062 1.00 . A A . 16 GLN HA 1 1 13 22784 1 1 16 GLN HB2 H -1.732 6.248 -9.948 1.00 . A A . 16 GLN HB2 1 1 13 22785 1 1 16 GLN HB3 H -3.440 6.163 -10.330 1.00 . A A . 16 GLN HB3 1 1 13 22786 1 1 16 GLN HE21 H -3.576 4.921 -12.170 1.00 . A A . 16 GLN HE21 1 1 13 22787 1 1 16 GLN HE22 H -4.825 5.422 -13.261 1.00 . A A . 16 GLN HE22 1 1 13 22788 1 1 16 GLN HG2 H -1.826 8.025 -12.032 1.00 . A A . 16 GLN HG2 1 1 13 22789 1 1 16 GLN HG3 H -1.465 6.321 -12.223 1.00 . A A . 16 GLN HG3 1 1 13 22790 1 1 16 GLN N N -1.727 9.067 -10.000 1.00 . A A . 16 GLN N 1 1 13 22791 1 1 16 GLN NE2 N -4.005 5.631 -12.728 1.00 . A A . 16 GLN NE2 1 1 13 22792 1 1 16 GLN O O -2.209 7.030 -7.628 1.00 . A A . 16 GLN O 1 1 13 22793 1 1 16 GLN OE1 O -3.946 7.774 -13.417 1.00 . A A . 16 GLN OE1 1 1 13 22794 1 1 17 PRO C C -4.785 7.425 -5.736 1.00 . A A . 17 PRO C 1 1 13 22795 1 1 17 PRO CA C -3.935 8.644 -6.100 1.00 . A A . 17 PRO CA 1 1 13 22796 1 1 17 PRO CB C -4.587 9.960 -5.708 1.00 . A A . 17 PRO CB 1 1 13 22797 1 1 17 PRO CD C -4.552 9.777 -8.158 1.00 . A A . 17 PRO CD 1 1 13 22798 1 1 17 PRO CG C -5.155 10.542 -6.992 1.00 . A A . 17 PRO CG 1 1 13 22799 1 1 17 PRO HA H -3.058 8.513 -5.639 1.00 . A A . 17 PRO HA 1 1 13 22800 1 1 17 PRO HB2 H -5.372 9.803 -4.969 1.00 . A A . 17 PRO HB2 1 1 13 22801 1 1 17 PRO HB3 H -3.859 10.638 -5.261 1.00 . A A . 17 PRO HB3 1 1 13 22802 1 1 17 PRO HD2 H -5.326 9.350 -8.795 1.00 . A A . 17 PRO HD2 1 1 13 22803 1 1 17 PRO HD3 H -3.944 10.428 -8.787 1.00 . A A . 17 PRO HD3 1 1 13 22804 1 1 17 PRO HG2 H -6.242 10.457 -7.001 1.00 . A A . 17 PRO HG2 1 1 13 22805 1 1 17 PRO HG3 H -4.918 11.604 -7.068 1.00 . A A . 17 PRO HG3 1 1 13 22806 1 1 17 PRO N N -3.741 8.733 -7.537 1.00 . A A . 17 PRO N 1 1 13 22807 1 1 17 PRO O O -5.264 6.713 -6.617 1.00 . A A . 17 PRO O 1 1 13 22808 1 1 18 VAL C C -6.260 6.429 -2.548 1.00 . A A . 18 VAL C 1 1 13 22809 1 1 18 VAL CA C -5.730 6.101 -3.945 1.00 . A A . 18 VAL CA 1 1 13 22810 1 1 18 VAL CB C -4.893 4.821 -3.983 1.00 . A A . 18 VAL CB 1 1 13 22811 1 1 18 VAL CG1 C -5.626 3.666 -3.299 1.00 . A A . 18 VAL CG1 1 1 13 22812 1 1 18 VAL CG2 C -4.514 4.456 -5.420 1.00 . A A . 18 VAL CG2 1 1 13 22813 1 1 18 VAL H H -4.554 7.807 -3.727 1.00 . A A . 18 VAL H 1 1 13 22814 1 1 18 VAL HA H -6.576 5.971 -4.620 1.00 . A A . 18 VAL HA 1 1 13 22815 1 1 18 VAL HB H -3.971 5.007 -3.431 1.00 . A A . 18 VAL HB 1 1 13 22816 1 1 18 VAL HG11 H -6.693 3.736 -3.512 1.00 . A A . 18 VAL HG11 1 1 13 22817 1 1 18 VAL HG12 H -5.242 2.718 -3.675 1.00 . A A . 18 VAL HG12 1 1 13 22818 1 1 18 VAL HG13 H -5.466 3.722 -2.222 1.00 . A A . 18 VAL HG13 1 1 13 22819 1 1 18 VAL HG21 H -5.392 4.542 -6.060 1.00 . A A . 18 VAL HG21 1 1 13 22820 1 1 18 VAL HG22 H -3.737 5.134 -5.774 1.00 . A A . 18 VAL HG22 1 1 13 22821 1 1 18 VAL HG23 H -4.143 3.432 -5.448 1.00 . A A . 18 VAL HG23 1 1 13 22822 1 1 18 VAL N N -4.947 7.222 -4.437 1.00 . A A . 18 VAL N 1 1 13 22823 1 1 18 VAL O O -5.597 7.119 -1.775 1.00 . A A . 18 VAL O 1 1 13 22824 1 1 19 VAL C C -8.010 4.862 -0.146 1.00 . A A . 19 VAL C 1 1 13 22825 1 1 19 VAL CA C -8.075 6.146 -0.975 1.00 . A A . 19 VAL CA 1 1 13 22826 1 1 19 VAL CB C -9.503 6.660 -1.170 1.00 . A A . 19 VAL CB 1 1 13 22827 1 1 19 VAL CG1 C -10.251 6.719 0.163 1.00 . A A . 19 VAL CG1 1 1 13 22828 1 1 19 VAL CG2 C -9.505 8.025 -1.861 1.00 . A A . 19 VAL CG2 1 1 13 22829 1 1 19 VAL H H -7.981 5.356 -2.900 1.00 . A A . 19 VAL H 1 1 13 22830 1 1 19 VAL HA H -7.504 6.922 -0.465 1.00 . A A . 19 VAL HA 1 1 13 22831 1 1 19 VAL HB H -10.027 5.956 -1.817 1.00 . A A . 19 VAL HB 1 1 13 22832 1 1 19 VAL HG11 H -9.563 6.490 0.976 1.00 . A A . 19 VAL HG11 1 1 13 22833 1 1 19 VAL HG12 H -10.661 7.720 0.306 1.00 . A A . 19 VAL HG12 1 1 13 22834 1 1 19 VAL HG13 H -11.063 5.992 0.157 1.00 . A A . 19 VAL HG13 1 1 13 22835 1 1 19 VAL HG21 H -8.514 8.227 -2.268 1.00 . A A . 19 VAL HG21 1 1 13 22836 1 1 19 VAL HG22 H -10.236 8.022 -2.670 1.00 . A A . 19 VAL HG22 1 1 13 22837 1 1 19 VAL HG23 H -9.766 8.798 -1.138 1.00 . A A . 19 VAL HG23 1 1 13 22838 1 1 19 VAL N N -7.449 5.917 -2.266 1.00 . A A . 19 VAL N 1 1 13 22839 1 1 19 VAL O O -8.584 3.843 -0.527 1.00 . A A . 19 VAL O 1 1 13 22840 1 1 20 PHE C C -8.189 3.856 2.989 1.00 . A A . 20 PHE C 1 1 13 22841 1 1 20 PHE CA C -7.159 3.810 1.859 1.00 . A A . 20 PHE CA 1 1 13 22842 1 1 20 PHE CB C -5.756 3.921 2.459 1.00 . A A . 20 PHE CB 1 1 13 22843 1 1 20 PHE CD1 C -5.085 1.491 2.429 1.00 . A A . 20 PHE CD1 1 1 13 22844 1 1 20 PHE CD2 C -5.033 2.655 4.516 1.00 . A A . 20 PHE CD2 1 1 13 22845 1 1 20 PHE CE1 C -4.633 0.292 3.087 1.00 . A A . 20 PHE CE1 1 1 13 22846 1 1 20 PHE CE2 C -4.581 1.456 5.174 1.00 . A A . 20 PHE CE2 1 1 13 22847 1 1 20 PHE CG C -5.275 2.647 3.158 1.00 . A A . 20 PHE CG 1 1 13 22848 1 1 20 PHE CZ C -4.404 0.334 4.426 1.00 . A A . 20 PHE CZ 1 1 13 22849 1 1 20 PHE H H -6.843 5.785 1.276 1.00 . A A . 20 PHE H 1 1 13 22850 1 1 20 PHE HA H -7.315 2.906 1.271 1.00 . A A . 20 PHE HA 1 1 13 22851 1 1 20 PHE HB2 H -5.052 4.176 1.667 1.00 . A A . 20 PHE HB2 1 1 13 22852 1 1 20 PHE HB3 H -5.741 4.743 3.174 1.00 . A A . 20 PHE HB3 1 1 13 22853 1 1 20 PHE HD1 H -5.276 1.485 1.356 1.00 . A A . 20 PHE HD1 1 1 13 22854 1 1 20 PHE HD2 H -5.184 3.569 5.091 1.00 . A A . 20 PHE HD2 1 1 13 22855 1 1 20 PHE HE1 H -4.478 -0.628 2.523 1.00 . A A . 20 PHE HE1 1 1 13 22856 1 1 20 PHE HE2 H -4.386 1.448 6.246 1.00 . A A . 20 PHE HE2 1 1 13 22857 1 1 20 PHE HZ H -4.035 -0.640 4.839 1.00 . A A . 20 PHE HZ 1 1 13 22858 1 1 20 PHE N N -7.306 4.952 0.973 1.00 . A A . 20 PHE N 1 1 13 22859 1 1 20 PHE O O -8.979 4.795 3.076 1.00 . A A . 20 PHE O 1 1 13 22860 1 1 21 ASN C C -8.531 1.731 5.963 1.00 . A A . 21 ASN C 1 1 13 22861 1 1 21 ASN CA C -9.068 2.741 4.947 1.00 . A A . 21 ASN CA 1 1 13 22862 1 1 21 ASN CB C -10.448 2.265 4.490 1.00 . A A . 21 ASN CB 1 1 13 22863 1 1 21 ASN CG C -11.107 3.294 3.570 1.00 . A A . 21 ASN CG 1 1 13 22864 1 1 21 ASN H H -7.502 2.071 3.749 1.00 . A A . 21 ASN H 1 1 13 22865 1 1 21 ASN HA H -9.123 3.751 5.353 1.00 . A A . 21 ASN HA 1 1 13 22866 1 1 21 ASN HB2 H -10.353 1.313 3.968 1.00 . A A . 21 ASN HB2 1 1 13 22867 1 1 21 ASN HB3 H -11.082 2.089 5.359 1.00 . A A . 21 ASN HB3 1 1 13 22868 1 1 21 ASN HD21 H -10.090 2.488 2.017 1.00 . A A . 21 ASN HD21 1 1 13 22869 1 1 21 ASN HD22 H -11.118 3.822 1.616 1.00 . A A . 21 ASN HD22 1 1 13 22870 1 1 21 ASN N N -8.147 2.830 3.826 1.00 . A A . 21 ASN N 1 1 13 22871 1 1 21 ASN ND2 N -10.741 3.193 2.296 1.00 . A A . 21 ASN ND2 1 1 13 22872 1 1 21 ASN O O -8.341 0.560 5.639 1.00 . A A . 21 ASN O 1 1 13 22873 1 1 21 ASN OD1 O -11.895 4.126 3.990 1.00 . A A . 21 ASN OD1 1 1 13 22874 1 1 22 HIS C C -8.927 0.522 8.805 1.00 . A A . 22 HIS C 1 1 13 22875 1 1 22 HIS CA C -7.791 1.376 8.238 1.00 . A A . 22 HIS CA 1 1 13 22876 1 1 22 HIS CB C -7.089 2.215 9.308 1.00 . A A . 22 HIS CB 1 1 13 22877 1 1 22 HIS CD2 C -4.487 1.992 9.202 1.00 . A A . 22 HIS CD2 1 1 13 22878 1 1 22 HIS CE1 C -4.062 3.829 8.093 1.00 . A A . 22 HIS CE1 1 1 13 22879 1 1 22 HIS CG C -5.676 2.610 8.950 1.00 . A A . 22 HIS CG 1 1 13 22880 1 1 22 HIS H H -8.460 3.175 7.429 1.00 . A A . 22 HIS H 1 1 13 22881 1 1 22 HIS HA H -7.045 0.721 7.787 1.00 . A A . 22 HIS HA 1 1 13 22882 1 1 22 HIS HB2 H -7.673 3.117 9.488 1.00 . A A . 22 HIS HB2 1 1 13 22883 1 1 22 HIS HB3 H -7.073 1.654 10.242 1.00 . A A . 22 HIS HB3 1 1 13 22884 1 1 22 HIS HD1 H -6.038 4.438 7.919 1.00 . A A . 22 HIS HD1 1 1 13 22885 1 1 22 HIS HD2 H -4.359 1.052 9.739 1.00 . A A . 22 HIS HD2 1 1 13 22886 1 1 22 HIS HE1 H -3.515 4.622 7.582 1.00 . A A . 22 HIS HE1 1 1 13 22887 1 1 22 HIS N N -8.302 2.221 7.173 1.00 . A A . 22 HIS N 1 1 13 22888 1 1 22 HIS ND1 N -5.376 3.765 8.250 1.00 . A A . 22 HIS ND1 1 1 13 22889 1 1 22 HIS NE2 N -3.513 2.729 8.684 1.00 . A A . 22 HIS NE2 1 1 13 22890 1 1 22 HIS O O -8.680 -0.500 9.444 1.00 . A A . 22 HIS O 1 1 13 22891 1 1 23 SER C C -11.578 -0.970 8.158 1.00 . A A . 23 SER C 1 1 13 22892 1 1 23 SER CA C -11.321 0.262 9.029 1.00 . A A . 23 SER CA 1 1 13 22893 1 1 23 SER CB C -12.550 1.173 9.035 1.00 . A A . 23 SER CB 1 1 13 22894 1 1 23 SER H H -10.338 1.804 8.031 1.00 . A A . 23 SER H 1 1 13 22895 1 1 23 SER HA H -11.083 -0.035 10.050 1.00 . A A . 23 SER HA 1 1 13 22896 1 1 23 SER HB2 H -12.379 2.008 9.715 1.00 . A A . 23 SER HB2 1 1 13 22897 1 1 23 SER HB3 H -12.694 1.595 8.041 1.00 . A A . 23 SER HB3 1 1 13 22898 1 1 23 SER HG H -13.921 0.646 10.396 1.00 . A A . 23 SER HG 1 1 13 22899 1 1 23 SER N N -10.146 0.972 8.551 1.00 . A A . 23 SER N 1 1 13 22900 1 1 23 SER O O -12.523 -1.719 8.399 1.00 . A A . 23 SER O 1 1 13 22901 1 1 23 SER OG O -13.729 0.475 9.429 1.00 . A A . 23 SER OG 1 1 13 22902 1 1 24 THR C C -9.730 -3.288 6.518 1.00 . A A . 24 THR C 1 1 13 22903 1 1 24 THR CA C -10.841 -2.269 6.256 1.00 . A A . 24 THR CA 1 1 13 22904 1 1 24 THR CB C -10.842 -1.727 4.825 1.00 . A A . 24 THR CB 1 1 13 22905 1 1 24 THR CG2 C -10.934 -2.838 3.778 1.00 . A A . 24 THR CG2 1 1 13 22906 1 1 24 THR H H -9.952 -0.528 6.975 1.00 . A A . 24 THR H 1 1 13 22907 1 1 24 THR HA H -11.788 -2.770 6.456 1.00 . A A . 24 THR HA 1 1 13 22908 1 1 24 THR HB H -9.972 -1.095 4.648 1.00 . A A . 24 THR HB 1 1 13 22909 1 1 24 THR HG1 H -12.841 -1.697 4.739 1.00 . A A . 24 THR HG1 1 1 13 22910 1 1 24 THR HG21 H -10.800 -3.806 4.261 1.00 . A A . 24 THR HG21 1 1 13 22911 1 1 24 THR HG22 H -11.912 -2.805 3.297 1.00 . A A . 24 THR HG22 1 1 13 22912 1 1 24 THR HG23 H -10.156 -2.695 3.027 1.00 . A A . 24 THR HG23 1 1 13 22913 1 1 24 THR N N -10.719 -1.142 7.164 1.00 . A A . 24 THR N 1 1 13 22914 1 1 24 THR O O -9.927 -4.488 6.331 1.00 . A A . 24 THR O 1 1 13 22915 1 1 24 THR OG1 O -12.087 -1.042 4.715 1.00 . A A . 24 THR OG1 1 1 13 22916 1 1 25 HIS C C -7.307 -3.798 8.751 1.00 . A A . 25 HIS C 1 1 13 22917 1 1 25 HIS CA C -7.445 -3.623 7.238 1.00 . A A . 25 HIS CA 1 1 13 22918 1 1 25 HIS CB C -6.177 -3.069 6.586 1.00 . A A . 25 HIS CB 1 1 13 22919 1 1 25 HIS CD2 C -5.812 -3.695 4.075 1.00 . A A . 25 HIS CD2 1 1 13 22920 1 1 25 HIS CE1 C -6.829 -1.979 3.175 1.00 . A A . 25 HIS CE1 1 1 13 22921 1 1 25 HIS CG C -6.276 -2.908 5.088 1.00 . A A . 25 HIS CG 1 1 13 22922 1 1 25 HIS H H -8.436 -1.796 7.097 1.00 . A A . 25 HIS H 1 1 13 22923 1 1 25 HIS HA H -7.655 -4.593 6.786 1.00 . A A . 25 HIS HA 1 1 13 22924 1 1 25 HIS HB2 H -5.946 -2.100 7.030 1.00 . A A . 25 HIS HB2 1 1 13 22925 1 1 25 HIS HB3 H -5.343 -3.732 6.816 1.00 . A A . 25 HIS HB3 1 1 13 22926 1 1 25 HIS HD1 H -7.357 -1.077 4.968 1.00 . A A . 25 HIS HD1 1 1 13 22927 1 1 25 HIS HD2 H -5.260 -4.627 4.194 1.00 . A A . 25 HIS HD2 1 1 13 22928 1 1 25 HIS HE1 H -7.234 -1.296 2.428 1.00 . A A . 25 HIS HE1 1 1 13 22929 1 1 25 HIS N N -8.588 -2.773 6.948 1.00 . A A . 25 HIS N 1 1 13 22930 1 1 25 HIS ND1 N -6.911 -1.834 4.489 1.00 . A A . 25 HIS ND1 1 1 13 22931 1 1 25 HIS NE2 N -6.148 -3.133 2.920 1.00 . A A . 25 HIS NE2 1 1 13 22932 1 1 25 HIS O O -6.195 -3.858 9.273 1.00 . A A . 25 HIS O 1 1 13 22933 1 1 26 LYS C C -7.913 -5.420 11.214 1.00 . A A . 26 LYS C 1 1 13 22934 1 1 26 LYS CA C -8.472 -4.042 10.856 1.00 . A A . 26 LYS CA 1 1 13 22935 1 1 26 LYS CB C -9.878 -3.787 11.405 1.00 . A A . 26 LYS CB 1 1 13 22936 1 1 26 LYS CD C -11.908 -2.305 11.197 1.00 . A A . 26 LYS CD 1 1 13 22937 1 1 26 LYS CE C -12.212 -2.018 12.668 1.00 . A A . 26 LYS CE 1 1 13 22938 1 1 26 LYS CG C -10.400 -2.419 10.961 1.00 . A A . 26 LYS CG 1 1 13 22939 1 1 26 LYS H H -9.352 -3.825 8.980 1.00 . A A . 26 LYS H 1 1 13 22940 1 1 26 LYS HA H -7.818 -3.282 11.282 1.00 . A A . 26 LYS HA 1 1 13 22941 1 1 26 LYS HB2 H -10.555 -4.568 11.060 1.00 . A A . 26 LYS HB2 1 1 13 22942 1 1 26 LYS HB3 H -9.862 -3.838 12.494 1.00 . A A . 26 LYS HB3 1 1 13 22943 1 1 26 LYS HD2 H -12.317 -1.508 10.575 1.00 . A A . 26 LYS HD2 1 1 13 22944 1 1 26 LYS HD3 H -12.398 -3.230 10.894 1.00 . A A . 26 LYS HD3 1 1 13 22945 1 1 26 LYS HE2 H -11.748 -2.778 13.297 1.00 . A A . 26 LYS HE2 1 1 13 22946 1 1 26 LYS HE3 H -11.780 -1.059 12.955 1.00 . A A . 26 LYS HE3 1 1 13 22947 1 1 26 LYS HG2 H -9.882 -1.632 11.510 1.00 . A A . 26 LYS HG2 1 1 13 22948 1 1 26 LYS HG3 H -10.181 -2.267 9.904 1.00 . A A . 26 LYS HG3 1 1 13 22949 1 1 26 LYS HZ1 H -13.903 -1.757 13.858 1.00 . A A . 26 LYS HZ1 1 1 13 22950 1 1 26 LYS HZ2 H -14.144 -1.326 12.307 1.00 . A A . 26 LYS HZ2 1 1 13 22951 1 1 26 LYS N N -8.452 -3.875 9.413 1.00 . A A . 26 LYS N 1 1 13 22952 1 1 26 LYS NZ N -13.674 -1.999 12.901 1.00 . A A . 26 LYS NZ 1 1 13 22953 1 1 26 LYS O O -7.132 -5.551 12.155 1.00 . A A . 26 LYS O 1 1 13 22954 1 1 27 SER C C -6.404 -7.905 10.310 1.00 . A A . 27 SER C 1 1 13 22955 1 1 27 SER CA C -7.886 -7.776 10.669 1.00 . A A . 27 SER CA 1 1 13 22956 1 1 27 SER CB C -8.717 -8.770 9.856 1.00 . A A . 27 SER CB 1 1 13 22957 1 1 27 SER H H -8.970 -6.297 9.681 1.00 . A A . 27 SER H 1 1 13 22958 1 1 27 SER HA H -8.040 -7.959 11.732 1.00 . A A . 27 SER HA 1 1 13 22959 1 1 27 SER HB2 H -8.503 -9.784 10.194 1.00 . A A . 27 SER HB2 1 1 13 22960 1 1 27 SER HB3 H -9.777 -8.591 10.037 1.00 . A A . 27 SER HB3 1 1 13 22961 1 1 27 SER HG H -7.830 -7.909 8.282 1.00 . A A . 27 SER HG 1 1 13 22962 1 1 27 SER N N -8.335 -6.412 10.444 1.00 . A A . 27 SER N 1 1 13 22963 1 1 27 SER O O -5.761 -8.894 10.659 1.00 . A A . 27 SER O 1 1 13 22964 1 1 27 SER OG O -8.452 -8.671 8.459 1.00 . A A . 27 SER OG 1 1 13 22965 1 1 28 VAL C C -3.660 -6.277 10.328 1.00 . A A . 28 VAL C 1 1 13 22966 1 1 28 VAL CA C -4.511 -6.879 9.208 1.00 . A A . 28 VAL CA 1 1 13 22967 1 1 28 VAL CB C -4.363 -6.136 7.879 1.00 . A A . 28 VAL CB 1 1 13 22968 1 1 28 VAL CG1 C -2.938 -6.261 7.337 1.00 . A A . 28 VAL CG1 1 1 13 22969 1 1 28 VAL CG2 C -5.385 -6.635 6.855 1.00 . A A . 28 VAL CG2 1 1 13 22970 1 1 28 VAL H H -6.435 -6.090 9.339 1.00 . A A . 28 VAL H 1 1 13 22971 1 1 28 VAL HA H -4.205 -7.914 9.053 1.00 . A A . 28 VAL HA 1 1 13 22972 1 1 28 VAL HB H -4.560 -5.080 8.062 1.00 . A A . 28 VAL HB 1 1 13 22973 1 1 28 VAL HG11 H -2.226 -6.119 8.150 1.00 . A A . 28 VAL HG11 1 1 13 22974 1 1 28 VAL HG12 H -2.800 -7.252 6.903 1.00 . A A . 28 VAL HG12 1 1 13 22975 1 1 28 VAL HG13 H -2.772 -5.503 6.572 1.00 . A A . 28 VAL HG13 1 1 13 22976 1 1 28 VAL HG21 H -6.364 -6.717 7.329 1.00 . A A . 28 VAL HG21 1 1 13 22977 1 1 28 VAL HG22 H -5.442 -5.930 6.026 1.00 . A A . 28 VAL HG22 1 1 13 22978 1 1 28 VAL HG23 H -5.079 -7.611 6.482 1.00 . A A . 28 VAL HG23 1 1 13 22979 1 1 28 VAL N N -5.905 -6.891 9.618 1.00 . A A . 28 VAL N 1 1 13 22980 1 1 28 VAL O O -4.082 -5.332 10.993 1.00 . A A . 28 VAL O 1 1 13 22981 1 1 29 LYS C C -0.936 -5.057 11.083 1.00 . A A . 29 LYS C 1 1 13 22982 1 1 29 LYS CA C -1.564 -6.379 11.529 1.00 . A A . 29 LYS CA 1 1 13 22983 1 1 29 LYS CB C -0.539 -7.463 11.869 1.00 . A A . 29 LYS CB 1 1 13 22984 1 1 29 LYS CD C -0.428 -9.450 13.419 1.00 . A A . 29 LYS CD 1 1 13 22985 1 1 29 LYS CE C -1.709 -10.230 13.720 1.00 . A A . 29 LYS CE 1 1 13 22986 1 1 29 LYS CG C -0.712 -7.950 13.309 1.00 . A A . 29 LYS CG 1 1 13 22987 1 1 29 LYS H H -2.142 -7.616 9.955 1.00 . A A . 29 LYS H 1 1 13 22988 1 1 29 LYS HA H -2.150 -6.197 12.429 1.00 . A A . 29 LYS HA 1 1 13 22989 1 1 29 LYS HB2 H -0.649 -8.302 11.182 1.00 . A A . 29 LYS HB2 1 1 13 22990 1 1 29 LYS HB3 H 0.469 -7.071 11.733 1.00 . A A . 29 LYS HB3 1 1 13 22991 1 1 29 LYS HD2 H 0.011 -9.809 12.488 1.00 . A A . 29 LYS HD2 1 1 13 22992 1 1 29 LYS HD3 H 0.304 -9.628 14.207 1.00 . A A . 29 LYS HD3 1 1 13 22993 1 1 29 LYS HE2 H -2.559 -9.745 13.240 1.00 . A A . 29 LYS HE2 1 1 13 22994 1 1 29 LYS HE3 H -1.637 -11.234 13.301 1.00 . A A . 29 LYS HE3 1 1 13 22995 1 1 29 LYS HG2 H -0.040 -7.400 13.967 1.00 . A A . 29 LYS HG2 1 1 13 22996 1 1 29 LYS HG3 H -1.728 -7.744 13.646 1.00 . A A . 29 LYS HG3 1 1 13 22997 1 1 29 LYS HZ1 H -1.133 -10.693 15.669 1.00 . A A . 29 LYS HZ1 1 1 13 22998 1 1 29 LYS HZ2 H -2.122 -9.401 15.587 1.00 . A A . 29 LYS HZ2 1 1 13 22999 1 1 29 LYS N N -2.477 -6.848 10.501 1.00 . A A . 29 LYS N 1 1 13 23000 1 1 29 LYS NZ N -1.936 -10.311 15.180 1.00 . A A . 29 LYS NZ 1 1 13 23001 1 1 29 LYS O O -0.677 -4.858 9.898 1.00 . A A . 29 LYS O 1 1 13 23002 1 1 30 CYS C C 1.313 -3.112 11.284 1.00 . A A . 30 CYS C 1 1 13 23003 1 1 30 CYS CA C -0.117 -2.891 11.780 1.00 . A A . 30 CYS CA 1 1 13 23004 1 1 30 CYS CB C -0.161 -1.975 13.005 1.00 . A A . 30 CYS CB 1 1 13 23005 1 1 30 CYS H H -0.923 -4.359 13.019 1.00 . A A . 30 CYS H 1 1 13 23006 1 1 30 CYS HA H -0.728 -2.427 11.006 1.00 . A A . 30 CYS HA 1 1 13 23007 1 1 30 CYS HB2 H 0.675 -2.225 13.658 1.00 . A A . 30 CYS HB2 1 1 13 23008 1 1 30 CYS HB3 H -0.014 -0.946 12.678 1.00 . A A . 30 CYS HB3 1 1 13 23009 1 1 30 CYS N N -0.709 -4.188 12.057 1.00 . A A . 30 CYS N 1 1 13 23010 1 1 30 CYS O O 1.819 -2.338 10.472 1.00 . A A . 30 CYS O 1 1 13 23011 1 1 30 CYS SG S -1.710 -2.066 13.976 1.00 . A A . 30 CYS SG 1 1 13 23012 1 1 31 GLY C C 3.324 -5.175 10.038 1.00 . A A . 31 GLY C 1 1 13 23013 1 1 31 GLY CA C 3.287 -4.503 11.412 1.00 . A A . 31 GLY CA 1 1 13 23014 1 1 31 GLY H H 1.507 -4.795 12.452 1.00 . A A . 31 GLY H 1 1 13 23015 1 1 31 GLY HA2 H 3.895 -3.598 11.395 1.00 . A A . 31 GLY HA2 1 1 13 23016 1 1 31 GLY HA3 H 3.726 -5.167 12.157 1.00 . A A . 31 GLY HA3 1 1 13 23017 1 1 31 GLY N N 1.925 -4.171 11.793 1.00 . A A . 31 GLY N 1 1 13 23018 1 1 31 GLY O O 4.398 -5.482 9.521 1.00 . A A . 31 GLY O 1 1 13 23019 1 1 32 ASP C C 2.284 -4.971 7.090 1.00 . A A . 32 ASP C 1 1 13 23020 1 1 32 ASP CA C 2.021 -6.012 8.180 1.00 . A A . 32 ASP CA 1 1 13 23021 1 1 32 ASP CB C 0.616 -6.577 7.965 1.00 . A A . 32 ASP CB 1 1 13 23022 1 1 32 ASP CG C 0.484 -7.557 6.798 1.00 . A A . 32 ASP CG 1 1 13 23023 1 1 32 ASP H H 1.270 -5.129 9.910 1.00 . A A . 32 ASP H 1 1 13 23024 1 1 32 ASP HA H 2.762 -6.812 8.180 1.00 . A A . 32 ASP HA 1 1 13 23025 1 1 32 ASP HB2 H 0.298 -7.079 8.879 1.00 . A A . 32 ASP HB2 1 1 13 23026 1 1 32 ASP HB3 H -0.072 -5.747 7.802 1.00 . A A . 32 ASP HB3 1 1 13 23027 1 1 32 ASP N N 2.138 -5.382 9.484 1.00 . A A . 32 ASP N 1 1 13 23028 1 1 32 ASP O O 2.856 -5.288 6.048 1.00 . A A . 32 ASP O 1 1 13 23029 1 1 32 ASP OD1 O 0.990 -7.213 5.708 1.00 . A A . 32 ASP OD1 1 1 13 23030 1 1 32 ASP OD2 O -0.120 -8.628 7.022 1.00 . A A . 32 ASP OD2 1 1 13 23031 1 1 33 CYS C C 3.164 -1.762 6.937 1.00 . A A . 33 CYS C 1 1 13 23032 1 1 33 CYS CA C 2.036 -2.659 6.424 1.00 . A A . 33 CYS CA 1 1 13 23033 1 1 33 CYS CB C 0.739 -1.878 6.206 1.00 . A A . 33 CYS CB 1 1 13 23034 1 1 33 CYS H H 1.390 -3.499 8.217 1.00 . A A . 33 CYS H 1 1 13 23035 1 1 33 CYS HA H 2.306 -3.113 5.470 1.00 . A A . 33 CYS HA 1 1 13 23036 1 1 33 CYS HB2 H 0.159 -1.855 7.128 1.00 . A A . 33 CYS HB2 1 1 13 23037 1 1 33 CYS HB3 H 0.967 -0.843 5.947 1.00 . A A . 33 CYS HB3 1 1 13 23038 1 1 33 CYS N N 1.854 -3.749 7.367 1.00 . A A . 33 CYS N 1 1 13 23039 1 1 33 CYS O O 4.136 -1.513 6.226 1.00 . A A . 33 CYS O 1 1 13 23040 1 1 33 CYS SG S -0.243 -2.653 4.870 1.00 . A A . 33 CYS SG 1 1 13 23041 1 1 34 HIS C C 5.204 -1.264 9.199 1.00 . A A . 34 HIS C 1 1 13 23042 1 1 34 HIS CA C 3.987 -0.435 8.784 1.00 . A A . 34 HIS CA 1 1 13 23043 1 1 34 HIS CB C 3.377 0.347 9.949 1.00 . A A . 34 HIS CB 1 1 13 23044 1 1 34 HIS CD2 C 0.883 1.037 9.580 1.00 . A A . 34 HIS CD2 1 1 13 23045 1 1 34 HIS CE1 C 1.230 3.053 8.803 1.00 . A A . 34 HIS CE1 1 1 13 23046 1 1 34 HIS CG C 2.231 1.246 9.551 1.00 . A A . 34 HIS CG 1 1 13 23047 1 1 34 HIS H H 2.202 -1.507 8.739 1.00 . A A . 34 HIS H 1 1 13 23048 1 1 34 HIS HA H 4.291 0.284 8.023 1.00 . A A . 34 HIS HA 1 1 13 23049 1 1 34 HIS HB2 H 3.028 -0.358 10.703 1.00 . A A . 34 HIS HB2 1 1 13 23050 1 1 34 HIS HB3 H 4.155 0.952 10.414 1.00 . A A . 34 HIS HB3 1 1 13 23051 1 1 34 HIS HD1 H 3.300 2.974 8.915 1.00 . A A . 34 HIS HD1 1 1 13 23052 1 1 34 HIS HD2 H 0.387 0.127 9.916 1.00 . A A . 34 HIS HD2 1 1 13 23053 1 1 34 HIS HE1 H 1.044 4.050 8.405 1.00 . A A . 34 HIS HE1 1 1 13 23054 1 1 34 HIS N N 2.996 -1.300 8.167 1.00 . A A . 34 HIS N 1 1 13 23055 1 1 34 HIS ND1 N 2.418 2.525 9.057 1.00 . A A . 34 HIS ND1 1 1 13 23056 1 1 34 HIS NE2 N 0.280 2.130 9.129 1.00 . A A . 34 HIS NE2 1 1 13 23057 1 1 34 HIS O O 5.572 -1.289 10.373 1.00 . A A . 34 HIS O 1 1 13 23058 1 1 35 HIS C C 7.921 -2.019 9.403 1.00 . A A . 35 HIS C 1 1 13 23059 1 1 35 HIS CA C 6.963 -2.751 8.462 1.00 . A A . 35 HIS CA 1 1 13 23060 1 1 35 HIS CB C 7.626 -3.165 7.146 1.00 . A A . 35 HIS CB 1 1 13 23061 1 1 35 HIS CD2 C 7.825 -1.431 5.200 1.00 . A A . 35 HIS CD2 1 1 13 23062 1 1 35 HIS CE1 C 9.618 -0.387 5.895 1.00 . A A . 35 HIS CE1 1 1 13 23063 1 1 35 HIS CG C 8.219 -2.014 6.369 1.00 . A A . 35 HIS CG 1 1 13 23064 1 1 35 HIS H H 5.491 -1.897 7.261 1.00 . A A . 35 HIS H 1 1 13 23065 1 1 35 HIS HA H 6.606 -3.657 8.953 1.00 . A A . 35 HIS HA 1 1 13 23066 1 1 35 HIS HB2 H 8.412 -3.889 7.359 1.00 . A A . 35 HIS HB2 1 1 13 23067 1 1 35 HIS HB3 H 6.888 -3.669 6.522 1.00 . A A . 35 HIS HB3 1 1 13 23068 1 1 35 HIS HD1 H 9.879 -1.526 7.610 1.00 . A A . 35 HIS HD1 1 1 13 23069 1 1 35 HIS HD2 H 6.963 -1.724 4.601 1.00 . A A . 35 HIS HD2 1 1 13 23070 1 1 35 HIS HE1 H 10.448 0.317 5.940 1.00 . A A . 35 HIS HE1 1 1 13 23071 1 1 35 HIS N N 5.796 -1.923 8.213 1.00 . A A . 35 HIS N 1 1 13 23072 1 1 35 HIS ND1 N 9.351 -1.335 6.782 1.00 . A A . 35 HIS ND1 1 1 13 23073 1 1 35 HIS NE2 N 8.671 -0.449 4.915 1.00 . A A . 35 HIS NE2 1 1 13 23074 1 1 35 HIS O O 7.992 -0.791 9.391 1.00 . A A . 35 HIS O 1 1 13 23075 1 1 36 PRO C C 10.868 -1.781 10.450 1.00 . A A . 36 PRO C 1 1 13 23076 1 1 36 PRO CA C 9.605 -2.266 11.164 1.00 . A A . 36 PRO CA 1 1 13 23077 1 1 36 PRO CB C 9.876 -3.385 12.156 1.00 . A A . 36 PRO CB 1 1 13 23078 1 1 36 PRO CD C 8.597 -4.283 10.260 1.00 . A A . 36 PRO CD 1 1 13 23079 1 1 36 PRO CG C 9.432 -4.667 11.470 1.00 . A A . 36 PRO CG 1 1 13 23080 1 1 36 PRO HA H 9.217 -1.460 11.611 1.00 . A A . 36 PRO HA 1 1 13 23081 1 1 36 PRO HB2 H 10.933 -3.428 12.418 1.00 . A A . 36 PRO HB2 1 1 13 23082 1 1 36 PRO HB3 H 9.325 -3.227 13.083 1.00 . A A . 36 PRO HB3 1 1 13 23083 1 1 36 PRO HD2 H 8.999 -4.721 9.346 1.00 . A A . 36 PRO HD2 1 1 13 23084 1 1 36 PRO HD3 H 7.571 -4.636 10.359 1.00 . A A . 36 PRO HD3 1 1 13 23085 1 1 36 PRO HG2 H 10.297 -5.256 11.166 1.00 . A A . 36 PRO HG2 1 1 13 23086 1 1 36 PRO HG3 H 8.851 -5.285 12.155 1.00 . A A . 36 PRO HG3 1 1 13 23087 1 1 36 PRO N N 8.654 -2.825 10.218 1.00 . A A . 36 PRO N 1 1 13 23088 1 1 36 PRO O O 11.391 -2.465 9.572 1.00 . A A . 36 PRO O 1 1 13 23089 1 1 37 VAL C C 13.491 0.370 11.376 1.00 . A A . 37 VAL C 1 1 13 23090 1 1 37 VAL CA C 12.514 -0.019 10.264 1.00 . A A . 37 VAL CA 1 1 13 23091 1 1 37 VAL CB C 12.130 1.160 9.368 1.00 . A A . 37 VAL CB 1 1 13 23092 1 1 37 VAL CG1 C 13.373 1.903 8.876 1.00 . A A . 37 VAL CG1 1 1 13 23093 1 1 37 VAL CG2 C 11.268 0.696 8.192 1.00 . A A . 37 VAL CG2 1 1 13 23094 1 1 37 VAL H H 10.892 -0.054 11.570 1.00 . A A . 37 VAL H 1 1 13 23095 1 1 37 VAL HA H 12.980 -0.781 9.639 1.00 . A A . 37 VAL HA 1 1 13 23096 1 1 37 VAL HB H 11.538 1.855 9.963 1.00 . A A . 37 VAL HB 1 1 13 23097 1 1 37 VAL HG11 H 14.255 1.281 9.033 1.00 . A A . 37 VAL HG11 1 1 13 23098 1 1 37 VAL HG12 H 13.269 2.124 7.814 1.00 . A A . 37 VAL HG12 1 1 13 23099 1 1 37 VAL HG13 H 13.483 2.835 9.431 1.00 . A A . 37 VAL HG13 1 1 13 23100 1 1 37 VAL HG21 H 11.802 -0.070 7.630 1.00 . A A . 37 VAL HG21 1 1 13 23101 1 1 37 VAL HG22 H 10.331 0.284 8.568 1.00 . A A . 37 VAL HG22 1 1 13 23102 1 1 37 VAL HG23 H 11.055 1.543 7.540 1.00 . A A . 37 VAL HG23 1 1 13 23103 1 1 37 VAL N N 11.322 -0.604 10.855 1.00 . A A . 37 VAL N 1 1 13 23104 1 1 37 VAL O O 13.184 1.225 12.206 1.00 . A A . 37 VAL O 1 1 13 23105 1 1 38 ASN C C 15.355 -0.799 13.626 1.00 . A A . 38 ASN C 1 1 13 23106 1 1 38 ASN CA C 15.670 -0.009 12.354 1.00 . A A . 38 ASN CA 1 1 13 23107 1 1 38 ASN CB C 15.711 1.476 12.717 1.00 . A A . 38 ASN CB 1 1 13 23108 1 1 38 ASN CG C 17.136 1.919 13.055 1.00 . A A . 38 ASN CG 1 1 13 23109 1 1 38 ASN H H 14.889 -0.970 10.679 1.00 . A A . 38 ASN H 1 1 13 23110 1 1 38 ASN HA H 16.608 -0.320 11.892 1.00 . A A . 38 ASN HA 1 1 13 23111 1 1 38 ASN HB2 H 15.330 2.068 11.885 1.00 . A A . 38 ASN HB2 1 1 13 23112 1 1 38 ASN HB3 H 15.056 1.664 13.568 1.00 . A A . 38 ASN HB3 1 1 13 23113 1 1 38 ASN HD21 H 16.356 3.332 14.278 1.00 . A A . 38 ASN HD21 1 1 13 23114 1 1 38 ASN HD22 H 18.086 3.293 14.198 1.00 . A A . 38 ASN HD22 1 1 13 23115 1 1 38 ASN N N 14.647 -0.276 11.357 1.00 . A A . 38 ASN N 1 1 13 23116 1 1 38 ASN ND2 N 17.198 2.932 13.915 1.00 . A A . 38 ASN ND2 1 1 13 23117 1 1 38 ASN O O 16.116 -0.756 14.592 1.00 . A A . 38 ASN O 1 1 13 23118 1 1 38 ASN OD1 O 18.114 1.377 12.567 1.00 . A A . 38 ASN OD1 1 1 13 23119 1 1 39 GLY C C 12.707 -1.585 15.512 1.00 . A A . 39 GLY C 1 1 13 23120 1 1 39 GLY CA C 13.807 -2.298 14.724 1.00 . A A . 39 GLY CA 1 1 13 23121 1 1 39 GLY H H 13.619 -1.530 12.796 1.00 . A A . 39 GLY H 1 1 13 23122 1 1 39 GLY HA2 H 13.443 -3.266 14.378 1.00 . A A . 39 GLY HA2 1 1 13 23123 1 1 39 GLY HA3 H 14.659 -2.492 15.375 1.00 . A A . 39 GLY HA3 1 1 13 23124 1 1 39 GLY N N 14.232 -1.501 13.586 1.00 . A A . 39 GLY N 1 1 13 23125 1 1 39 GLY O O 12.217 -2.107 16.512 1.00 . A A . 39 GLY O 1 1 13 23126 1 1 40 LYS C C 10.042 0.341 14.837 1.00 . A A . 40 LYS C 1 1 13 23127 1 1 40 LYS CA C 11.317 0.387 15.680 1.00 . A A . 40 LYS CA 1 1 13 23128 1 1 40 LYS CB C 11.821 1.806 15.955 1.00 . A A . 40 LYS CB 1 1 13 23129 1 1 40 LYS CD C 12.930 3.638 14.623 1.00 . A A . 40 LYS CD 1 1 13 23130 1 1 40 LYS CE C 12.800 4.574 13.420 1.00 . A A . 40 LYS CE 1 1 13 23131 1 1 40 LYS CG C 11.749 2.668 14.693 1.00 . A A . 40 LYS CG 1 1 13 23132 1 1 40 LYS H H 12.754 0.015 14.218 1.00 . A A . 40 LYS H 1 1 13 23133 1 1 40 LYS HA H 11.110 -0.074 16.646 1.00 . A A . 40 LYS HA 1 1 13 23134 1 1 40 LYS HB2 H 11.224 2.261 16.746 1.00 . A A . 40 LYS HB2 1 1 13 23135 1 1 40 LYS HB3 H 12.849 1.767 16.315 1.00 . A A . 40 LYS HB3 1 1 13 23136 1 1 40 LYS HD2 H 12.978 4.225 15.541 1.00 . A A . 40 LYS HD2 1 1 13 23137 1 1 40 LYS HD3 H 13.862 3.078 14.554 1.00 . A A . 40 LYS HD3 1 1 13 23138 1 1 40 LYS HE2 H 13.151 4.069 12.520 1.00 . A A . 40 LYS HE2 1 1 13 23139 1 1 40 LYS HE3 H 11.752 4.823 13.257 1.00 . A A . 40 LYS HE3 1 1 13 23140 1 1 40 LYS HG2 H 11.747 2.028 13.811 1.00 . A A . 40 LYS HG2 1 1 13 23141 1 1 40 LYS HG3 H 10.813 3.227 14.683 1.00 . A A . 40 LYS HG3 1 1 13 23142 1 1 40 LYS HZ1 H 13.722 6.002 14.625 1.00 . A A . 40 LYS HZ1 1 1 13 23143 1 1 40 LYS HZ2 H 14.502 5.759 13.216 1.00 . A A . 40 LYS HZ2 1 1 13 23144 1 1 40 LYS N N 12.350 -0.403 15.032 1.00 . A A . 40 LYS N 1 1 13 23145 1 1 40 LYS NZ N 13.582 5.811 13.639 1.00 . A A . 40 LYS NZ 1 1 13 23146 1 1 40 LYS O O 10.106 0.295 13.609 1.00 . A A . 40 LYS O 1 1 13 23147 1 1 41 GLU C C 6.815 1.571 15.187 1.00 . A A . 41 GLU C 1 1 13 23148 1 1 41 GLU CA C 7.623 0.314 14.859 1.00 . A A . 41 GLU CA 1 1 13 23149 1 1 41 GLU CB C 6.848 -0.950 15.238 1.00 . A A . 41 GLU CB 1 1 13 23150 1 1 41 GLU CD C 5.421 -2.713 14.134 1.00 . A A . 41 GLU CD 1 1 13 23151 1 1 41 GLU CG C 6.705 -1.886 14.036 1.00 . A A . 41 GLU CG 1 1 13 23152 1 1 41 GLU H H 8.868 0.392 16.528 1.00 . A A . 41 GLU H 1 1 13 23153 1 1 41 GLU HA H 7.851 0.287 13.794 1.00 . A A . 41 GLU HA 1 1 13 23154 1 1 41 GLU HB2 H 7.363 -1.468 16.047 1.00 . A A . 41 GLU HB2 1 1 13 23155 1 1 41 GLU HB3 H 5.861 -0.678 15.611 1.00 . A A . 41 GLU HB3 1 1 13 23156 1 1 41 GLU HG2 H 6.696 -1.303 13.115 1.00 . A A . 41 GLU HG2 1 1 13 23157 1 1 41 GLU HG3 H 7.567 -2.551 13.984 1.00 . A A . 41 GLU HG3 1 1 13 23158 1 1 41 GLU N N 8.912 0.354 15.529 1.00 . A A . 41 GLU N 1 1 13 23159 1 1 41 GLU O O 6.525 1.841 16.351 1.00 . A A . 41 GLU O 1 1 13 23160 1 1 41 GLU OE1 O 5.483 -3.781 14.781 1.00 . A A . 41 GLU OE1 1 1 13 23161 1 1 41 GLU OE2 O 4.408 -2.258 13.561 1.00 . A A . 41 GLU OE2 1 1 13 23162 1 1 42 ASP C C 4.710 3.656 13.146 1.00 . A A . 42 ASP C 1 1 13 23163 1 1 42 ASP CA C 5.706 3.529 14.300 1.00 . A A . 42 ASP CA 1 1 13 23164 1 1 42 ASP CB C 6.616 4.759 14.276 1.00 . A A . 42 ASP CB 1 1 13 23165 1 1 42 ASP CG C 6.397 5.747 15.423 1.00 . A A . 42 ASP CG 1 1 13 23166 1 1 42 ASP H H 6.715 2.080 13.194 1.00 . A A . 42 ASP H 1 1 13 23167 1 1 42 ASP HA H 5.214 3.432 15.267 1.00 . A A . 42 ASP HA 1 1 13 23168 1 1 42 ASP HB2 H 7.654 4.425 14.298 1.00 . A A . 42 ASP HB2 1 1 13 23169 1 1 42 ASP HB3 H 6.469 5.283 13.332 1.00 . A A . 42 ASP HB3 1 1 13 23170 1 1 42 ASP N N 6.475 2.306 14.138 1.00 . A A . 42 ASP N 1 1 13 23171 1 1 42 ASP O O 4.774 2.898 12.179 1.00 . A A . 42 ASP O 1 1 13 23172 1 1 42 ASP OD1 O 6.008 5.275 16.514 1.00 . A A . 42 ASP OD1 1 1 13 23173 1 1 42 ASP OD2 O 6.622 6.953 15.184 1.00 . A A . 42 ASP OD2 1 1 13 23174 1 1 43 TYR C C 3.111 6.128 11.474 1.00 . A A . 43 TYR C 1 1 13 23175 1 1 43 TYR CA C 2.803 4.856 12.266 1.00 . A A . 43 TYR CA 1 1 13 23176 1 1 43 TYR CB C 1.482 5.043 13.015 1.00 . A A . 43 TYR CB 1 1 13 23177 1 1 43 TYR CD1 C 1.430 2.582 13.559 1.00 . A A . 43 TYR CD1 1 1 13 23178 1 1 43 TYR CD2 C 0.468 4.109 15.126 1.00 . A A . 43 TYR CD2 1 1 13 23179 1 1 43 TYR CE1 C 1.084 1.480 14.420 1.00 . A A . 43 TYR CE1 1 1 13 23180 1 1 43 TYR CE2 C 0.122 3.008 15.987 1.00 . A A . 43 TYR CE2 1 1 13 23181 1 1 43 TYR CG C 1.115 3.873 13.930 1.00 . A A . 43 TYR CG 1 1 13 23182 1 1 43 TYR CZ C 0.447 1.748 15.591 1.00 . A A . 43 TYR CZ 1 1 13 23183 1 1 43 TYR H H 3.766 5.233 14.074 1.00 . A A . 43 TYR H 1 1 13 23184 1 1 43 TYR HA H 2.806 4.004 11.586 1.00 . A A . 43 TYR HA 1 1 13 23185 1 1 43 TYR HB2 H 1.541 5.953 13.612 1.00 . A A . 43 TYR HB2 1 1 13 23186 1 1 43 TYR HB3 H 0.682 5.189 12.290 1.00 . A A . 43 TYR HB3 1 1 13 23187 1 1 43 TYR HD1 H 1.941 2.395 12.614 1.00 . A A . 43 TYR HD1 1 1 13 23188 1 1 43 TYR HD2 H 0.219 5.129 15.419 1.00 . A A . 43 TYR HD2 1 1 13 23189 1 1 43 TYR HE1 H 1.327 0.456 14.139 1.00 . A A . 43 TYR HE1 1 1 13 23190 1 1 43 TYR HE2 H -0.389 3.180 16.934 1.00 . A A . 43 TYR HE2 1 1 13 23191 1 1 43 TYR HH H 0.466 -0.148 16.020 1.00 . A A . 43 TYR HH 1 1 13 23192 1 1 43 TYR N N 3.812 4.620 13.285 1.00 . A A . 43 TYR N 1 1 13 23193 1 1 43 TYR O O 2.721 7.224 11.875 1.00 . A A . 43 TYR O 1 1 13 23194 1 1 43 TYR OH O 0.121 0.708 16.404 1.00 . A A . 43 TYR OH 1 1 13 23195 1 1 44 ARG C C 3.749 6.788 8.066 1.00 . A A . 44 ARG C 1 1 13 23196 1 1 44 ARG CA C 4.173 7.060 9.510 1.00 . A A . 44 ARG CA 1 1 13 23197 1 1 44 ARG CB C 5.680 7.316 9.553 1.00 . A A . 44 ARG CB 1 1 13 23198 1 1 44 ARG CD C 7.288 9.201 10.025 1.00 . A A . 44 ARG CD 1 1 13 23199 1 1 44 ARG CG C 5.992 8.796 9.320 1.00 . A A . 44 ARG CG 1 1 13 23200 1 1 44 ARG CZ C 7.029 11.629 10.564 1.00 . A A . 44 ARG CZ 1 1 13 23201 1 1 44 ARG H H 4.121 5.047 10.042 1.00 . A A . 44 ARG H 1 1 13 23202 1 1 44 ARG HA H 3.633 7.913 9.923 1.00 . A A . 44 ARG HA 1 1 13 23203 1 1 44 ARG HB2 H 6.079 7.005 10.519 1.00 . A A . 44 ARG HB2 1 1 13 23204 1 1 44 ARG HB3 H 6.177 6.712 8.793 1.00 . A A . 44 ARG HB3 1 1 13 23205 1 1 44 ARG HD2 H 7.211 8.993 11.093 1.00 . A A . 44 ARG HD2 1 1 13 23206 1 1 44 ARG HD3 H 8.120 8.608 9.644 1.00 . A A . 44 ARG HD3 1 1 13 23207 1 1 44 ARG HE H 8.160 10.897 9.056 1.00 . A A . 44 ARG HE 1 1 13 23208 1 1 44 ARG HG2 H 6.080 8.989 8.251 1.00 . A A . 44 ARG HG2 1 1 13 23209 1 1 44 ARG HG3 H 5.168 9.407 9.687 1.00 . A A . 44 ARG HG3 1 1 13 23210 1 1 44 ARG HH11 H 5.978 10.389 11.801 1.00 . A A . 44 ARG HH11 1 1 13 23211 1 1 44 ARG HH12 H 5.820 12.078 12.148 1.00 . A A . 44 ARG HH12 1 1 13 23212 1 1 44 ARG HH21 H 6.989 13.670 10.790 1.00 . A A . 44 ARG HH21 1 1 13 23213 1 1 44 ARG N N 3.808 5.941 10.362 1.00 . A A . 44 ARG N 1 1 13 23214 1 1 44 ARG NE N 7.554 10.641 9.809 1.00 . A A . 44 ARG NE 1 1 13 23215 1 1 44 ARG NH1 N 6.204 11.340 11.593 1.00 . A A . 44 ARG NH1 1 1 13 23216 1 1 44 ARG NH2 N 7.334 12.881 10.281 1.00 . A A . 44 ARG NH2 1 1 13 23217 1 1 44 ARG O O 3.600 5.635 7.666 1.00 . A A . 44 ARG O 1 1 13 23218 1 1 45 LYS C C 4.280 7.090 5.130 1.00 . A A . 45 LYS C 1 1 13 23219 1 1 45 LYS CA C 3.163 7.762 5.931 1.00 . A A . 45 LYS CA 1 1 13 23220 1 1 45 LYS CB C 2.752 9.130 5.384 1.00 . A A . 45 LYS CB 1 1 13 23221 1 1 45 LYS CD C 1.920 10.525 7.313 1.00 . A A . 45 LYS CD 1 1 13 23222 1 1 45 LYS CE C 1.099 11.815 7.363 1.00 . A A . 45 LYS CE 1 1 13 23223 1 1 45 LYS CG C 1.518 9.665 6.114 1.00 . A A . 45 LYS CG 1 1 13 23224 1 1 45 LYS H H 3.690 8.804 7.655 1.00 . A A . 45 LYS H 1 1 13 23225 1 1 45 LYS HA H 2.280 7.123 5.895 1.00 . A A . 45 LYS HA 1 1 13 23226 1 1 45 LYS HB2 H 3.578 9.834 5.496 1.00 . A A . 45 LYS HB2 1 1 13 23227 1 1 45 LYS HB3 H 2.543 9.052 4.317 1.00 . A A . 45 LYS HB3 1 1 13 23228 1 1 45 LYS HD2 H 1.774 9.961 8.235 1.00 . A A . 45 LYS HD2 1 1 13 23229 1 1 45 LYS HD3 H 2.981 10.767 7.253 1.00 . A A . 45 LYS HD3 1 1 13 23230 1 1 45 LYS HE2 H 1.751 12.660 7.581 1.00 . A A . 45 LYS HE2 1 1 13 23231 1 1 45 LYS HE3 H 0.648 12.003 6.388 1.00 . A A . 45 LYS HE3 1 1 13 23232 1 1 45 LYS HG2 H 0.911 10.254 5.426 1.00 . A A . 45 LYS HG2 1 1 13 23233 1 1 45 LYS HG3 H 0.901 8.832 6.450 1.00 . A A . 45 LYS HG3 1 1 13 23234 1 1 45 LYS HZ1 H -0.448 10.830 8.353 1.00 . A A . 45 LYS HZ1 1 1 13 23235 1 1 45 LYS HZ2 H 0.417 11.802 9.332 1.00 . A A . 45 LYS HZ2 1 1 13 23236 1 1 45 LYS N N 3.567 7.870 7.322 1.00 . A A . 45 LYS N 1 1 13 23237 1 1 45 LYS NZ N 0.041 11.717 8.394 1.00 . A A . 45 LYS NZ 1 1 13 23238 1 1 45 LYS O O 5.452 7.431 5.286 1.00 . A A . 45 LYS O 1 1 13 23239 1 1 46 CYS C C 5.563 6.434 2.579 1.00 . A A . 46 CYS C 1 1 13 23240 1 1 46 CYS CA C 4.832 5.424 3.466 1.00 . A A . 46 CYS CA 1 1 13 23241 1 1 46 CYS CB C 4.151 4.330 2.641 1.00 . A A . 46 CYS CB 1 1 13 23242 1 1 46 CYS H H 2.924 5.876 4.169 1.00 . A A . 46 CYS H 1 1 13 23243 1 1 46 CYS HA H 5.526 4.933 4.147 1.00 . A A . 46 CYS HA 1 1 13 23244 1 1 46 CYS HB2 H 3.761 4.773 1.725 1.00 . A A . 46 CYS HB2 1 1 13 23245 1 1 46 CYS HB3 H 4.901 3.596 2.346 1.00 . A A . 46 CYS HB3 1 1 13 23246 1 1 46 CYS N N 3.879 6.147 4.291 1.00 . A A . 46 CYS N 1 1 13 23247 1 1 46 CYS O O 6.790 6.414 2.492 1.00 . A A . 46 CYS O 1 1 13 23248 1 1 46 CYS SG S 2.787 3.461 3.498 1.00 . A A . 46 CYS SG 1 1 13 23249 1 1 47 GLY C C 5.946 9.456 1.876 1.00 . A A . 47 GLY C 1 1 13 23250 1 1 47 GLY CA C 5.337 8.308 1.068 1.00 . A A . 47 GLY CA 1 1 13 23251 1 1 47 GLY H H 3.783 7.302 2.021 1.00 . A A . 47 GLY H 1 1 13 23252 1 1 47 GLY HA2 H 6.101 7.863 0.429 1.00 . A A . 47 GLY HA2 1 1 13 23253 1 1 47 GLY HA3 H 4.558 8.695 0.411 1.00 . A A . 47 GLY HA3 1 1 13 23254 1 1 47 GLY N N 4.780 7.293 1.944 1.00 . A A . 47 GLY N 1 1 13 23255 1 1 47 GLY O O 5.628 10.621 1.644 1.00 . A A . 47 GLY O 1 1 13 23256 1 1 48 THR C C 8.857 10.403 3.103 1.00 . A A . 48 THR C 1 1 13 23257 1 1 48 THR CA C 7.468 10.070 3.653 1.00 . A A . 48 THR CA 1 1 13 23258 1 1 48 THR CB C 7.495 9.525 5.082 1.00 . A A . 48 THR CB 1 1 13 23259 1 1 48 THR CG2 C 8.619 10.135 5.921 1.00 . A A . 48 THR CG2 1 1 13 23260 1 1 48 THR H H 7.066 8.137 2.991 1.00 . A A . 48 THR H 1 1 13 23261 1 1 48 THR HA H 6.884 10.990 3.625 1.00 . A A . 48 THR HA 1 1 13 23262 1 1 48 THR HB H 7.556 8.436 5.082 1.00 . A A . 48 THR HB 1 1 13 23263 1 1 48 THR HG1 H 5.528 9.892 5.057 1.00 . A A . 48 THR HG1 1 1 13 23264 1 1 48 THR HG21 H 8.978 11.045 5.440 1.00 . A A . 48 THR HG21 1 1 13 23265 1 1 48 THR HG22 H 8.241 10.375 6.915 1.00 . A A . 48 THR HG22 1 1 13 23266 1 1 48 THR HG23 H 9.439 9.422 6.005 1.00 . A A . 48 THR HG23 1 1 13 23267 1 1 48 THR N N 6.812 9.086 2.809 1.00 . A A . 48 THR N 1 1 13 23268 1 1 48 THR O O 9.633 9.505 2.783 1.00 . A A . 48 THR O 1 1 13 23269 1 1 48 THR OG1 O 6.304 10.037 5.672 1.00 . A A . 48 THR OG1 1 1 13 23270 1 1 49 ALA C C 11.534 11.516 3.317 1.00 . A A . 49 ALA C 1 1 13 23271 1 1 49 ALA CA C 10.408 12.160 2.506 1.00 . A A . 49 ALA CA 1 1 13 23272 1 1 49 ALA CB C 10.455 13.688 2.556 1.00 . A A . 49 ALA CB 1 1 13 23273 1 1 49 ALA H H 8.490 12.422 3.274 1.00 . A A . 49 ALA H 1 1 13 23274 1 1 49 ALA HA H 10.490 11.840 1.467 1.00 . A A . 49 ALA HA 1 1 13 23275 1 1 49 ALA HB1 H 9.444 14.079 2.676 1.00 . A A . 49 ALA HB1 1 1 13 23276 1 1 49 ALA HB2 H 11.070 14.006 3.398 1.00 . A A . 49 ALA HB2 1 1 13 23277 1 1 49 ALA HB3 H 10.884 14.069 1.629 1.00 . A A . 49 ALA HB3 1 1 13 23278 1 1 49 ALA N N 9.127 11.697 3.011 1.00 . A A . 49 ALA N 1 1 13 23279 1 1 49 ALA O O 11.734 11.850 4.484 1.00 . A A . 49 ALA O 1 1 13 23280 1 1 50 GLY C C 13.077 8.403 3.378 1.00 . A A . 50 GLY C 1 1 13 23281 1 1 50 GLY CA C 13.342 9.908 3.312 1.00 . A A . 50 GLY CA 1 1 13 23282 1 1 50 GLY H H 12.073 10.337 1.717 1.00 . A A . 50 GLY H 1 1 13 23283 1 1 50 GLY HA2 H 14.266 10.095 2.765 1.00 . A A . 50 GLY HA2 1 1 13 23284 1 1 50 GLY HA3 H 13.483 10.301 4.319 1.00 . A A . 50 GLY HA3 1 1 13 23285 1 1 50 GLY N N 12.241 10.603 2.666 1.00 . A A . 50 GLY N 1 1 13 23286 1 1 50 GLY O O 13.992 7.619 3.625 1.00 . A A . 50 GLY O 1 1 13 23287 1 1 51 CYS C C 11.214 6.176 1.742 1.00 . A A . 51 CYS C 1 1 13 23288 1 1 51 CYS CA C 11.425 6.647 3.182 1.00 . A A . 51 CYS CA 1 1 13 23289 1 1 51 CYS CB C 10.178 6.432 4.043 1.00 . A A . 51 CYS CB 1 1 13 23290 1 1 51 CYS H H 11.084 8.689 2.951 1.00 . A A . 51 CYS H 1 1 13 23291 1 1 51 CYS HA H 12.242 6.100 3.652 1.00 . A A . 51 CYS HA 1 1 13 23292 1 1 51 CYS HB2 H 9.382 7.102 3.718 1.00 . A A . 51 CYS HB2 1 1 13 23293 1 1 51 CYS HB3 H 9.810 5.414 3.914 1.00 . A A . 51 CYS HB3 1 1 13 23294 1 1 51 CYS N N 11.822 8.045 3.152 1.00 . A A . 51 CYS N 1 1 13 23295 1 1 51 CYS O O 12.149 5.709 1.094 1.00 . A A . 51 CYS O 1 1 13 23296 1 1 51 CYS SG S 10.572 6.736 5.803 1.00 . A A . 51 CYS SG 1 1 13 23297 1 1 52 HIS C C 9.393 7.150 -0.931 1.00 . A A . 52 HIS C 1 1 13 23298 1 1 52 HIS CA C 9.632 5.910 -0.068 1.00 . A A . 52 HIS CA 1 1 13 23299 1 1 52 HIS CB C 8.437 4.954 -0.059 1.00 . A A . 52 HIS CB 1 1 13 23300 1 1 52 HIS CD2 C 8.305 3.038 1.714 1.00 . A A . 52 HIS CD2 1 1 13 23301 1 1 52 HIS CE1 C 9.624 1.603 0.720 1.00 . A A . 52 HIS CE1 1 1 13 23302 1 1 52 HIS CG C 8.734 3.605 0.550 1.00 . A A . 52 HIS CG 1 1 13 23303 1 1 52 HIS H H 9.223 6.697 1.817 1.00 . A A . 52 HIS H 1 1 13 23304 1 1 52 HIS HA H 10.490 5.365 -0.461 1.00 . A A . 52 HIS HA 1 1 13 23305 1 1 52 HIS HB2 H 7.619 5.418 0.492 1.00 . A A . 52 HIS HB2 1 1 13 23306 1 1 52 HIS HB3 H 8.091 4.811 -1.083 1.00 . A A . 52 HIS HB3 1 1 13 23307 1 1 52 HIS HD1 H 10.040 2.796 -0.926 1.00 . A A . 52 HIS HD1 1 1 13 23308 1 1 52 HIS HD2 H 7.633 3.500 2.437 1.00 . A A . 52 HIS HD2 1 1 13 23309 1 1 52 HIS HE1 H 10.197 0.698 0.518 1.00 . A A . 52 HIS HE1 1 1 13 23310 1 1 52 HIS N N 9.978 6.315 1.283 1.00 . A A . 52 HIS N 1 1 13 23311 1 1 52 HIS ND1 N 9.565 2.677 -0.054 1.00 . A A . 52 HIS ND1 1 1 13 23312 1 1 52 HIS NE2 N 8.842 1.828 1.815 1.00 . A A . 52 HIS NE2 1 1 13 23313 1 1 52 HIS O O 8.285 7.366 -1.421 1.00 . A A . 52 HIS O 1 1 13 23314 1 1 53 ASP C C 11.366 9.062 -3.043 1.00 . A A . 53 ASP C 1 1 13 23315 1 1 53 ASP CA C 10.368 9.147 -1.886 1.00 . A A . 53 ASP CA 1 1 13 23316 1 1 53 ASP CB C 10.719 10.378 -1.049 1.00 . A A . 53 ASP CB 1 1 13 23317 1 1 53 ASP CG C 12.185 10.476 -0.624 1.00 . A A . 53 ASP CG 1 1 13 23318 1 1 53 ASP H H 11.347 7.750 -0.690 1.00 . A A . 53 ASP H 1 1 13 23319 1 1 53 ASP HA H 9.335 9.195 -2.230 1.00 . A A . 53 ASP HA 1 1 13 23320 1 1 53 ASP HB2 H 10.460 11.271 -1.618 1.00 . A A . 53 ASP HB2 1 1 13 23321 1 1 53 ASP HB3 H 10.096 10.380 -0.154 1.00 . A A . 53 ASP HB3 1 1 13 23322 1 1 53 ASP N N 10.449 7.933 -1.091 1.00 . A A . 53 ASP N 1 1 13 23323 1 1 53 ASP O O 12.269 9.890 -3.150 1.00 . A A . 53 ASP O 1 1 13 23324 1 1 53 ASP OD1 O 12.861 9.425 -0.674 1.00 . A A . 53 ASP OD1 1 1 13 23325 1 1 53 ASP OD2 O 12.597 11.598 -0.260 1.00 . A A . 53 ASP OD2 1 1 13 23326 1 1 54 SER C C 11.470 8.560 -6.250 1.00 . A A . 54 SER C 1 1 13 23327 1 1 54 SER CA C 12.042 7.848 -5.023 1.00 . A A . 54 SER CA 1 1 13 23328 1 1 54 SER CB C 12.230 6.358 -5.313 1.00 . A A . 54 SER CB 1 1 13 23329 1 1 54 SER H H 10.433 7.384 -3.784 1.00 . A A . 54 SER H 1 1 13 23330 1 1 54 SER HA H 12.999 8.286 -4.738 1.00 . A A . 54 SER HA 1 1 13 23331 1 1 54 SER HB2 H 12.435 5.831 -4.382 1.00 . A A . 54 SER HB2 1 1 13 23332 1 1 54 SER HB3 H 11.303 5.947 -5.714 1.00 . A A . 54 SER HB3 1 1 13 23333 1 1 54 SER HG H 13.325 5.154 -6.477 1.00 . A A . 54 SER HG 1 1 13 23334 1 1 54 SER N N 11.170 8.053 -3.879 1.00 . A A . 54 SER N 1 1 13 23335 1 1 54 SER O O 12.185 9.285 -6.942 1.00 . A A . 54 SER O 1 1 13 23336 1 1 54 SER OG O 13.291 6.123 -6.235 1.00 . A A . 54 SER OG 1 1 13 23337 1 1 55 MET C C 10.130 8.480 -8.938 1.00 . A A . 55 MET C 1 1 13 23338 1 1 55 MET CA C 9.511 8.940 -7.616 1.00 . A A . 55 MET CA 1 1 13 23339 1 1 55 MET CB C 9.608 10.463 -7.510 1.00 . A A . 55 MET CB 1 1 13 23340 1 1 55 MET CE C 7.080 10.042 -4.922 1.00 . A A . 55 MET CE 1 1 13 23341 1 1 55 MET CG C 8.249 11.077 -7.167 1.00 . A A . 55 MET CG 1 1 13 23342 1 1 55 MET H H 9.612 7.740 -5.917 1.00 . A A . 55 MET H 1 1 13 23343 1 1 55 MET HA H 8.476 8.603 -7.556 1.00 . A A . 55 MET HA 1 1 13 23344 1 1 55 MET HB2 H 10.336 10.731 -6.744 1.00 . A A . 55 MET HB2 1 1 13 23345 1 1 55 MET HB3 H 9.970 10.875 -8.452 1.00 . A A . 55 MET HB3 1 1 13 23346 1 1 55 MET HE1 H 7.188 9.218 -5.627 1.00 . A A . 55 MET HE1 1 1 13 23347 1 1 55 MET HE2 H 7.358 9.705 -3.923 1.00 . A A . 55 MET HE2 1 1 13 23348 1 1 55 MET HE3 H 6.044 10.382 -4.916 1.00 . A A . 55 MET HE3 1 1 13 23349 1 1 55 MET HG2 H 8.112 12.007 -7.718 1.00 . A A . 55 MET HG2 1 1 13 23350 1 1 55 MET HG3 H 7.449 10.403 -7.474 1.00 . A A . 55 MET HG3 1 1 13 23351 1 1 55 MET N N 10.186 8.330 -6.484 1.00 . A A . 55 MET N 1 1 13 23352 1 1 55 MET O O 10.205 9.250 -9.894 1.00 . A A . 55 MET O 1 1 13 23353 1 1 55 MET SD S 8.145 11.388 -5.412 1.00 . A A . 55 MET SD 1 1 13 23354 1 1 56 ASP C C 10.134 5.807 -10.880 1.00 . A A . 56 ASP C 1 1 13 23355 1 1 56 ASP CA C 11.169 6.654 -10.137 1.00 . A A . 56 ASP CA 1 1 13 23356 1 1 56 ASP CB C 12.346 5.748 -9.769 1.00 . A A . 56 ASP CB 1 1 13 23357 1 1 56 ASP CG C 13.521 6.457 -9.092 1.00 . A A . 56 ASP CG 1 1 13 23358 1 1 56 ASP H H 10.493 6.606 -8.167 1.00 . A A . 56 ASP H 1 1 13 23359 1 1 56 ASP HA H 11.508 7.508 -10.723 1.00 . A A . 56 ASP HA 1 1 13 23360 1 1 56 ASP HB2 H 11.986 4.961 -9.107 1.00 . A A . 56 ASP HB2 1 1 13 23361 1 1 56 ASP HB3 H 12.707 5.262 -10.675 1.00 . A A . 56 ASP HB3 1 1 13 23362 1 1 56 ASP N N 10.558 7.226 -8.949 1.00 . A A . 56 ASP N 1 1 13 23363 1 1 56 ASP O O 10.094 5.807 -12.109 1.00 . A A . 56 ASP O 1 1 13 23364 1 1 56 ASP OD1 O 13.511 7.707 -9.101 1.00 . A A . 56 ASP OD1 1 1 13 23365 1 1 56 ASP OD2 O 14.403 5.732 -8.582 1.00 . A A . 56 ASP OD2 1 1 13 23366 1 1 57 LYS C C 8.948 3.100 -11.429 1.00 . A A . 57 LYS C 1 1 13 23367 1 1 57 LYS CA C 8.290 4.256 -10.672 1.00 . A A . 57 LYS CA 1 1 13 23368 1 1 57 LYS CB C 7.327 5.082 -11.526 1.00 . A A . 57 LYS CB 1 1 13 23369 1 1 57 LYS CD C 6.408 3.961 -13.590 1.00 . A A . 57 LYS CD 1 1 13 23370 1 1 57 LYS CE C 5.100 3.527 -14.254 1.00 . A A . 57 LYS CE 1 1 13 23371 1 1 57 LYS CG C 6.208 4.206 -12.093 1.00 . A A . 57 LYS CG 1 1 13 23372 1 1 57 LYS H H 9.361 5.111 -9.103 1.00 . A A . 57 LYS H 1 1 13 23373 1 1 57 LYS HA H 7.714 3.843 -9.844 1.00 . A A . 57 LYS HA 1 1 13 23374 1 1 57 LYS HB2 H 6.898 5.883 -10.926 1.00 . A A . 57 LYS HB2 1 1 13 23375 1 1 57 LYS HB3 H 7.873 5.554 -12.343 1.00 . A A . 57 LYS HB3 1 1 13 23376 1 1 57 LYS HD2 H 6.776 4.871 -14.065 1.00 . A A . 57 LYS HD2 1 1 13 23377 1 1 57 LYS HD3 H 7.168 3.194 -13.739 1.00 . A A . 57 LYS HD3 1 1 13 23378 1 1 57 LYS HE2 H 4.252 3.931 -13.701 1.00 . A A . 57 LYS HE2 1 1 13 23379 1 1 57 LYS HE3 H 5.045 3.934 -15.264 1.00 . A A . 57 LYS HE3 1 1 13 23380 1 1 57 LYS HG2 H 6.185 3.252 -11.565 1.00 . A A . 57 LYS HG2 1 1 13 23381 1 1 57 LYS HG3 H 5.245 4.687 -11.925 1.00 . A A . 57 LYS HG3 1 1 13 23382 1 1 57 LYS HZ1 H 5.279 1.624 -13.423 1.00 . A A . 57 LYS HZ1 1 1 13 23383 1 1 57 LYS HZ2 H 4.067 1.734 -14.504 1.00 . A A . 57 LYS HZ2 1 1 13 23384 1 1 57 LYS N N 9.323 5.106 -10.102 1.00 . A A . 57 LYS N 1 1 13 23385 1 1 57 LYS NZ N 5.009 2.050 -14.302 1.00 . A A . 57 LYS NZ 1 1 13 23386 1 1 57 LYS O O 8.946 1.964 -10.957 1.00 . A A . 57 LYS O 1 1 13 23387 1 1 58 LYS C C 11.579 2.214 -12.905 1.00 . A A . 58 LYS C 1 1 13 23388 1 1 58 LYS CA C 10.154 2.433 -13.417 1.00 . A A . 58 LYS CA 1 1 13 23389 1 1 58 LYS CB C 10.084 2.831 -14.892 1.00 . A A . 58 LYS CB 1 1 13 23390 1 1 58 LYS CD C 10.224 4.973 -16.215 1.00 . A A . 58 LYS CD 1 1 13 23391 1 1 58 LYS CE C 11.098 5.096 -17.465 1.00 . A A . 58 LYS CE 1 1 13 23392 1 1 58 LYS CG C 10.900 4.098 -15.158 1.00 . A A . 58 LYS CG 1 1 13 23393 1 1 58 LYS H H 9.492 4.356 -12.966 1.00 . A A . 58 LYS H 1 1 13 23394 1 1 58 LYS HA H 9.600 1.501 -13.308 1.00 . A A . 58 LYS HA 1 1 13 23395 1 1 58 LYS HB2 H 10.460 2.016 -15.511 1.00 . A A . 58 LYS HB2 1 1 13 23396 1 1 58 LYS HB3 H 9.046 2.996 -15.180 1.00 . A A . 58 LYS HB3 1 1 13 23397 1 1 58 LYS HD2 H 9.258 4.546 -16.483 1.00 . A A . 58 LYS HD2 1 1 13 23398 1 1 58 LYS HD3 H 10.032 5.964 -15.803 1.00 . A A . 58 LYS HD3 1 1 13 23399 1 1 58 LYS HE2 H 11.553 6.086 -17.502 1.00 . A A . 58 LYS HE2 1 1 13 23400 1 1 58 LYS HE3 H 11.912 4.373 -17.420 1.00 . A A . 58 LYS HE3 1 1 13 23401 1 1 58 LYS HG2 H 11.014 4.662 -14.232 1.00 . A A . 58 LYS HG2 1 1 13 23402 1 1 58 LYS HG3 H 11.901 3.826 -15.491 1.00 . A A . 58 LYS HG3 1 1 13 23403 1 1 58 LYS HZ1 H 9.428 4.377 -18.483 1.00 . A A . 58 LYS HZ1 1 1 13 23404 1 1 58 LYS HZ2 H 10.037 5.738 -19.140 1.00 . A A . 58 LYS HZ2 1 1 13 23405 1 1 58 LYS N N 9.494 3.430 -12.590 1.00 . A A . 58 LYS N 1 1 13 23406 1 1 58 LYS NZ N 10.292 4.868 -18.685 1.00 . A A . 58 LYS NZ 1 1 13 23407 1 1 58 LYS O O 12.544 2.602 -13.561 1.00 . A A . 58 LYS O 1 1 13 23408 1 1 59 ASP C C 12.879 0.004 -10.351 1.00 . A A . 59 ASP C 1 1 13 23409 1 1 59 ASP CA C 12.957 1.319 -11.131 1.00 . A A . 59 ASP CA 1 1 13 23410 1 1 59 ASP CB C 13.352 2.426 -10.152 1.00 . A A . 59 ASP CB 1 1 13 23411 1 1 59 ASP CG C 14.795 2.918 -10.280 1.00 . A A . 59 ASP CG 1 1 13 23412 1 1 59 ASP H H 10.875 1.281 -11.210 1.00 . A A . 59 ASP H 1 1 13 23413 1 1 59 ASP HA H 13.660 1.270 -11.962 1.00 . A A . 59 ASP HA 1 1 13 23414 1 1 59 ASP HB2 H 12.681 3.273 -10.295 1.00 . A A . 59 ASP HB2 1 1 13 23415 1 1 59 ASP HB3 H 13.196 2.064 -9.135 1.00 . A A . 59 ASP HB3 1 1 13 23416 1 1 59 ASP N N 11.666 1.594 -11.738 1.00 . A A . 59 ASP N 1 1 13 23417 1 1 59 ASP O O 13.586 -0.951 -10.668 1.00 . A A . 59 ASP O 1 1 13 23418 1 1 59 ASP OD1 O 15.418 2.585 -11.311 1.00 . A A . 59 ASP OD1 1 1 13 23419 1 1 59 ASP OD2 O 15.242 3.616 -9.345 1.00 . A A . 59 ASP OD2 1 1 13 23420 1 1 60 LYS C C 13.110 -1.430 -7.710 1.00 . A A . 60 LYS C 1 1 13 23421 1 1 60 LYS CA C 11.836 -1.183 -8.520 1.00 . A A . 60 LYS CA 1 1 13 23422 1 1 60 LYS CB C 11.411 -2.377 -9.377 1.00 . A A . 60 LYS CB 1 1 13 23423 1 1 60 LYS CD C 9.947 -2.610 -11.417 1.00 . A A . 60 LYS CD 1 1 13 23424 1 1 60 LYS CE C 9.386 -1.497 -12.303 1.00 . A A . 60 LYS CE 1 1 13 23425 1 1 60 LYS CG C 10.010 -2.167 -9.953 1.00 . A A . 60 LYS CG 1 1 13 23426 1 1 60 LYS H H 11.443 0.780 -9.097 1.00 . A A . 60 LYS H 1 1 13 23427 1 1 60 LYS HA H 11.021 -0.976 -7.827 1.00 . A A . 60 LYS HA 1 1 13 23428 1 1 60 LYS HB2 H 12.125 -2.520 -10.188 1.00 . A A . 60 LYS HB2 1 1 13 23429 1 1 60 LYS HB3 H 11.428 -3.286 -8.774 1.00 . A A . 60 LYS HB3 1 1 13 23430 1 1 60 LYS HD2 H 10.944 -2.886 -11.760 1.00 . A A . 60 LYS HD2 1 1 13 23431 1 1 60 LYS HD3 H 9.323 -3.499 -11.505 1.00 . A A . 60 LYS HD3 1 1 13 23432 1 1 60 LYS HE2 H 8.936 -0.722 -11.682 1.00 . A A . 60 LYS HE2 1 1 13 23433 1 1 60 LYS HE3 H 10.194 -1.027 -12.863 1.00 . A A . 60 LYS HE3 1 1 13 23434 1 1 60 LYS HG2 H 9.283 -2.731 -9.368 1.00 . A A . 60 LYS HG2 1 1 13 23435 1 1 60 LYS HG3 H 9.734 -1.115 -9.876 1.00 . A A . 60 LYS HG3 1 1 13 23436 1 1 60 LYS HZ1 H 8.439 -3.047 -13.325 1.00 . A A . 60 LYS HZ1 1 1 13 23437 1 1 60 LYS HZ2 H 7.430 -1.829 -12.941 1.00 . A A . 60 LYS HZ2 1 1 13 23438 1 1 60 LYS N N 12.015 -0.002 -9.347 1.00 . A A . 60 LYS N 1 1 13 23439 1 1 60 LYS NZ N 8.376 -2.039 -13.239 1.00 . A A . 60 LYS NZ 1 1 13 23440 1 1 60 LYS O O 14.197 -1.542 -8.274 1.00 . A A . 60 LYS O 1 1 13 23441 1 1 61 SER C C 13.590 -1.662 -4.050 1.00 . A A . 61 SER C 1 1 13 23442 1 1 61 SER CA C 14.056 -1.738 -5.505 1.00 . A A . 61 SER CA 1 1 13 23443 1 1 61 SER CB C 15.177 -0.729 -5.756 1.00 . A A . 61 SER CB 1 1 13 23444 1 1 61 SER H H 12.046 -1.415 -5.948 1.00 . A A . 61 SER H 1 1 13 23445 1 1 61 SER HA H 14.411 -2.741 -5.741 1.00 . A A . 61 SER HA 1 1 13 23446 1 1 61 SER HB2 H 14.973 -0.182 -6.677 1.00 . A A . 61 SER HB2 1 1 13 23447 1 1 61 SER HB3 H 15.194 0.003 -4.949 1.00 . A A . 61 SER HB3 1 1 13 23448 1 1 61 SER HG H 16.573 -1.747 -6.766 1.00 . A A . 61 SER HG 1 1 13 23449 1 1 61 SER N N 12.934 -1.507 -6.399 1.00 . A A . 61 SER N 1 1 13 23450 1 1 61 SER O O 13.653 -2.651 -3.321 1.00 . A A . 61 SER O 1 1 13 23451 1 1 61 SER OG O 16.452 -1.359 -5.852 1.00 . A A . 61 SER OG 1 1 13 23452 1 1 62 ALA C C 12.142 1.175 -2.183 1.00 . A A . 62 ALA C 1 1 13 23453 1 1 62 ALA CA C 12.655 -0.261 -2.314 1.00 . A A . 62 ALA CA 1 1 13 23454 1 1 62 ALA CB C 13.778 -0.572 -1.322 1.00 . A A . 62 ALA CB 1 1 13 23455 1 1 62 ALA H H 13.082 0.321 -4.268 1.00 . A A . 62 ALA H 1 1 13 23456 1 1 62 ALA HA H 11.830 -0.950 -2.138 1.00 . A A . 62 ALA HA 1 1 13 23457 1 1 62 ALA HB1 H 14.595 -1.070 -1.843 1.00 . A A . 62 ALA HB1 1 1 13 23458 1 1 62 ALA HB2 H 14.141 0.357 -0.882 1.00 . A A . 62 ALA HB2 1 1 13 23459 1 1 62 ALA HB3 H 13.397 -1.223 -0.536 1.00 . A A . 62 ALA HB3 1 1 13 23460 1 1 62 ALA N N 13.131 -0.479 -3.670 1.00 . A A . 62 ALA N 1 1 13 23461 1 1 62 ALA O O 11.019 1.398 -1.734 1.00 . A A . 62 ALA O 1 1 13 23462 1 1 63 LYS C C 11.469 3.793 -3.466 1.00 . A A . 63 LYS C 1 1 13 23463 1 1 63 LYS CA C 12.637 3.519 -2.517 1.00 . A A . 63 LYS CA 1 1 13 23464 1 1 63 LYS CB C 13.864 4.392 -2.783 1.00 . A A . 63 LYS CB 1 1 13 23465 1 1 63 LYS CD C 15.137 5.384 -0.845 1.00 . A A . 63 LYS CD 1 1 13 23466 1 1 63 LYS CE C 16.383 6.170 -1.259 1.00 . A A . 63 LYS CE 1 1 13 23467 1 1 63 LYS CG C 14.948 4.151 -1.731 1.00 . A A . 63 LYS CG 1 1 13 23468 1 1 63 LYS H H 13.901 1.921 -2.949 1.00 . A A . 63 LYS H 1 1 13 23469 1 1 63 LYS HA H 12.309 3.725 -1.498 1.00 . A A . 63 LYS HA 1 1 13 23470 1 1 63 LYS HB2 H 14.261 4.177 -3.775 1.00 . A A . 63 LYS HB2 1 1 13 23471 1 1 63 LYS HB3 H 13.575 5.443 -2.778 1.00 . A A . 63 LYS HB3 1 1 13 23472 1 1 63 LYS HD2 H 14.258 6.025 -0.915 1.00 . A A . 63 LYS HD2 1 1 13 23473 1 1 63 LYS HD3 H 15.226 5.077 0.197 1.00 . A A . 63 LYS HD3 1 1 13 23474 1 1 63 LYS HE2 H 17.202 5.952 -0.573 1.00 . A A . 63 LYS HE2 1 1 13 23475 1 1 63 LYS HE3 H 16.706 5.856 -2.251 1.00 . A A . 63 LYS HE3 1 1 13 23476 1 1 63 LYS HG2 H 14.676 3.294 -1.114 1.00 . A A . 63 LYS HG2 1 1 13 23477 1 1 63 LYS HG3 H 15.889 3.904 -2.223 1.00 . A A . 63 LYS HG3 1 1 13 23478 1 1 63 LYS HZ1 H 16.898 8.163 -1.582 1.00 . A A . 63 LYS HZ1 1 1 13 23479 1 1 63 LYS HZ2 H 15.323 7.859 -1.863 1.00 . A A . 63 LYS HZ2 1 1 13 23480 1 1 63 LYS N N 12.990 2.111 -2.584 1.00 . A A . 63 LYS N 1 1 13 23481 1 1 63 LYS NZ N 16.102 7.623 -1.259 1.00 . A A . 63 LYS NZ 1 1 13 23482 1 1 63 LYS O O 10.776 4.800 -3.329 1.00 . A A . 63 LYS O 1 1 13 23483 1 1 64 GLY C C 8.845 2.902 -4.706 1.00 . A A . 64 GLY C 1 1 13 23484 1 1 64 GLY CA C 10.214 3.010 -5.380 1.00 . A A . 64 GLY CA 1 1 13 23485 1 1 64 GLY H H 11.854 2.063 -4.512 1.00 . A A . 64 GLY H 1 1 13 23486 1 1 64 GLY HA2 H 10.297 3.970 -5.891 1.00 . A A . 64 GLY HA2 1 1 13 23487 1 1 64 GLY HA3 H 10.311 2.235 -6.141 1.00 . A A . 64 GLY HA3 1 1 13 23488 1 1 64 GLY N N 11.286 2.879 -4.408 1.00 . A A . 64 GLY N 1 1 13 23489 1 1 64 GLY O O 8.340 1.801 -4.493 1.00 . A A . 64 GLY O 1 1 13 23490 1 1 65 TYR C C 5.955 3.283 -4.516 1.00 . A A . 65 TYR C 1 1 13 23491 1 1 65 TYR CA C 6.984 4.108 -3.741 1.00 . A A . 65 TYR CA 1 1 13 23492 1 1 65 TYR CB C 6.560 5.577 -3.758 1.00 . A A . 65 TYR CB 1 1 13 23493 1 1 65 TYR CD1 C 4.800 5.567 -1.952 1.00 . A A . 65 TYR CD1 1 1 13 23494 1 1 65 TYR CD2 C 4.171 6.286 -4.143 1.00 . A A . 65 TYR CD2 1 1 13 23495 1 1 65 TYR CE1 C 3.455 5.793 -1.491 1.00 . A A . 65 TYR CE1 1 1 13 23496 1 1 65 TYR CE2 C 2.825 6.512 -3.682 1.00 . A A . 65 TYR CE2 1 1 13 23497 1 1 65 TYR CG C 5.130 5.818 -3.268 1.00 . A A . 65 TYR CG 1 1 13 23498 1 1 65 TYR CZ C 2.534 6.255 -2.379 1.00 . A A . 65 TYR CZ 1 1 13 23499 1 1 65 TYR H H 8.702 4.950 -4.564 1.00 . A A . 65 TYR H 1 1 13 23500 1 1 65 TYR HA H 7.091 3.693 -2.739 1.00 . A A . 65 TYR HA 1 1 13 23501 1 1 65 TYR HB2 H 7.247 6.151 -3.136 1.00 . A A . 65 TYR HB2 1 1 13 23502 1 1 65 TYR HB3 H 6.654 5.960 -4.774 1.00 . A A . 65 TYR HB3 1 1 13 23503 1 1 65 TYR HD1 H 5.558 5.198 -1.261 1.00 . A A . 65 TYR HD1 1 1 13 23504 1 1 65 TYR HD2 H 4.431 6.484 -5.183 1.00 . A A . 65 TYR HD2 1 1 13 23505 1 1 65 TYR HE1 H 3.181 5.599 -0.454 1.00 . A A . 65 TYR HE1 1 1 13 23506 1 1 65 TYR HE2 H 2.058 6.881 -4.362 1.00 . A A . 65 TYR HE2 1 1 13 23507 1 1 65 TYR HH H 0.690 5.678 -2.160 1.00 . A A . 65 TYR HH 1 1 13 23508 1 1 65 TYR N N 8.285 4.059 -4.387 1.00 . A A . 65 TYR N 1 1 13 23509 1 1 65 TYR O O 5.193 2.520 -3.924 1.00 . A A . 65 TYR O 1 1 13 23510 1 1 65 TYR OH O 1.263 6.468 -1.944 1.00 . A A . 65 TYR OH 1 1 13 23511 1 1 66 TYR C C 5.468 1.285 -6.854 1.00 . A A . 66 TYR C 1 1 13 23512 1 1 66 TYR CA C 5.043 2.746 -6.690 1.00 . A A . 66 TYR CA 1 1 13 23513 1 1 66 TYR CB C 5.111 3.440 -8.052 1.00 . A A . 66 TYR CB 1 1 13 23514 1 1 66 TYR CD1 C 5.409 1.606 -9.756 1.00 . A A . 66 TYR CD1 1 1 13 23515 1 1 66 TYR CD2 C 3.333 2.791 -9.718 1.00 . A A . 66 TYR CD2 1 1 13 23516 1 1 66 TYR CE1 C 4.930 0.800 -10.849 1.00 . A A . 66 TYR CE1 1 1 13 23517 1 1 66 TYR CE2 C 2.854 1.985 -10.811 1.00 . A A . 66 TYR CE2 1 1 13 23518 1 1 66 TYR CG C 4.601 2.584 -9.213 1.00 . A A . 66 TYR CG 1 1 13 23519 1 1 66 TYR CZ C 3.675 1.029 -11.322 1.00 . A A . 66 TYR CZ 1 1 13 23520 1 1 66 TYR H H 6.590 4.086 -6.302 1.00 . A A . 66 TYR H 1 1 13 23521 1 1 66 TYR HA H 4.056 2.779 -6.229 1.00 . A A . 66 TYR HA 1 1 13 23522 1 1 66 TYR HB2 H 4.528 4.360 -8.009 1.00 . A A . 66 TYR HB2 1 1 13 23523 1 1 66 TYR HB3 H 6.143 3.727 -8.251 1.00 . A A . 66 TYR HB3 1 1 13 23524 1 1 66 TYR HD1 H 6.411 1.443 -9.357 1.00 . A A . 66 TYR HD1 1 1 13 23525 1 1 66 TYR HD2 H 2.695 3.563 -9.290 1.00 . A A . 66 TYR HD2 1 1 13 23526 1 1 66 TYR HE1 H 5.557 0.024 -11.287 1.00 . A A . 66 TYR HE1 1 1 13 23527 1 1 66 TYR HE2 H 1.855 2.137 -11.219 1.00 . A A . 66 TYR HE2 1 1 13 23528 1 1 66 TYR HH H 2.259 0.471 -12.531 1.00 . A A . 66 TYR HH 1 1 13 23529 1 1 66 TYR N N 5.966 3.464 -5.828 1.00 . A A . 66 TYR N 1 1 13 23530 1 1 66 TYR O O 4.802 0.515 -7.544 1.00 . A A . 66 TYR O 1 1 13 23531 1 1 66 TYR OH O 3.223 0.269 -12.355 1.00 . A A . 66 TYR OH 1 1 13 23532 1 1 67 HIS C C 6.708 -1.168 -5.007 1.00 . A A . 67 HIS C 1 1 13 23533 1 1 67 HIS CA C 7.098 -0.405 -6.275 1.00 . A A . 67 HIS CA 1 1 13 23534 1 1 67 HIS CB C 8.608 -0.394 -6.518 1.00 . A A . 67 HIS CB 1 1 13 23535 1 1 67 HIS CD2 C 9.716 -1.638 -4.504 1.00 . A A . 67 HIS CD2 1 1 13 23536 1 1 67 HIS CE1 C 10.418 -3.409 -5.581 1.00 . A A . 67 HIS CE1 1 1 13 23537 1 1 67 HIS CG C 9.353 -1.501 -5.812 1.00 . A A . 67 HIS CG 1 1 13 23538 1 1 67 HIS H H 7.111 1.582 -5.650 1.00 . A A . 67 HIS H 1 1 13 23539 1 1 67 HIS HA H 6.626 -0.881 -7.134 1.00 . A A . 67 HIS HA 1 1 13 23540 1 1 67 HIS HB2 H 8.794 -0.471 -7.590 1.00 . A A . 67 HIS HB2 1 1 13 23541 1 1 67 HIS HB3 H 9.011 0.566 -6.194 1.00 . A A . 67 HIS HB3 1 1 13 23542 1 1 67 HIS HD1 H 9.700 -2.830 -7.439 1.00 . A A . 67 HIS HD1 1 1 13 23543 1 1 67 HIS HD2 H 9.513 -0.922 -3.708 1.00 . A A . 67 HIS HD2 1 1 13 23544 1 1 67 HIS HE1 H 10.885 -4.372 -5.787 1.00 . A A . 67 HIS HE1 1 1 13 23545 1 1 67 HIS N N 6.576 0.949 -6.209 1.00 . A A . 67 HIS N 1 1 13 23546 1 1 67 HIS ND1 N 9.810 -2.632 -6.465 1.00 . A A . 67 HIS ND1 1 1 13 23547 1 1 67 HIS NE2 N 10.359 -2.791 -4.366 1.00 . A A . 67 HIS NE2 1 1 13 23548 1 1 67 HIS O O 6.782 -2.395 -4.969 1.00 . A A . 67 HIS O 1 1 13 23549 1 1 68 VAL C C 4.374 -0.973 -2.625 1.00 . A A . 68 VAL C 1 1 13 23550 1 1 68 VAL CA C 5.900 -0.998 -2.734 1.00 . A A . 68 VAL CA 1 1 13 23551 1 1 68 VAL CB C 6.594 -0.276 -1.577 1.00 . A A . 68 VAL CB 1 1 13 23552 1 1 68 VAL CG1 C 8.028 -0.776 -1.400 1.00 . A A . 68 VAL CG1 1 1 13 23553 1 1 68 VAL CG2 C 6.562 1.240 -1.781 1.00 . A A . 68 VAL CG2 1 1 13 23554 1 1 68 VAL H H 6.244 0.588 -4.039 1.00 . A A . 68 VAL H 1 1 13 23555 1 1 68 VAL HA H 6.235 -2.036 -2.733 1.00 . A A . 68 VAL HA 1 1 13 23556 1 1 68 VAL HB H 6.044 -0.502 -0.663 1.00 . A A . 68 VAL HB 1 1 13 23557 1 1 68 VAL HG11 H 8.083 -1.829 -1.676 1.00 . A A . 68 VAL HG11 1 1 13 23558 1 1 68 VAL HG12 H 8.697 -0.198 -2.038 1.00 . A A . 68 VAL HG12 1 1 13 23559 1 1 68 VAL HG13 H 8.328 -0.658 -0.358 1.00 . A A . 68 VAL HG13 1 1 13 23560 1 1 68 VAL HG21 H 5.541 1.558 -1.990 1.00 . A A . 68 VAL HG21 1 1 13 23561 1 1 68 VAL HG22 H 6.920 1.735 -0.878 1.00 . A A . 68 VAL HG22 1 1 13 23562 1 1 68 VAL HG23 H 7.205 1.508 -2.620 1.00 . A A . 68 VAL HG23 1 1 13 23563 1 1 68 VAL N N 6.301 -0.409 -4.000 1.00 . A A . 68 VAL N 1 1 13 23564 1 1 68 VAL O O 3.818 -1.283 -1.573 1.00 . A A . 68 VAL O 1 1 13 23565 1 1 69 MET C C 1.722 -1.529 -4.781 1.00 . A A . 69 MET C 1 1 13 23566 1 1 69 MET CA C 2.290 -0.531 -3.770 1.00 . A A . 69 MET CA 1 1 13 23567 1 1 69 MET CB C 1.858 0.886 -4.154 1.00 . A A . 69 MET CB 1 1 13 23568 1 1 69 MET CE C 2.698 1.988 -0.477 1.00 . A A . 69 MET CE 1 1 13 23569 1 1 69 MET CG C 2.462 1.919 -3.201 1.00 . A A . 69 MET CG 1 1 13 23570 1 1 69 MET H H 4.201 -0.351 -4.580 1.00 . A A . 69 MET H 1 1 13 23571 1 1 69 MET HA H 1.955 -0.790 -2.766 1.00 . A A . 69 MET HA 1 1 13 23572 1 1 69 MET HB2 H 2.171 1.101 -5.175 1.00 . A A . 69 MET HB2 1 1 13 23573 1 1 69 MET HB3 H 0.771 0.957 -4.131 1.00 . A A . 69 MET HB3 1 1 13 23574 1 1 69 MET HE1 H 3.605 2.480 -0.830 1.00 . A A . 69 MET HE1 1 1 13 23575 1 1 69 MET HE2 H 2.341 2.487 0.424 1.00 . A A . 69 MET HE2 1 1 13 23576 1 1 69 MET HE3 H 2.916 0.944 -0.252 1.00 . A A . 69 MET HE3 1 1 13 23577 1 1 69 MET HG2 H 3.471 1.620 -2.919 1.00 . A A . 69 MET HG2 1 1 13 23578 1 1 69 MET HG3 H 2.543 2.884 -3.702 1.00 . A A . 69 MET HG3 1 1 13 23579 1 1 69 MET N N 3.741 -0.601 -3.728 1.00 . A A . 69 MET N 1 1 13 23580 1 1 69 MET O O 0.524 -1.810 -4.776 1.00 . A A . 69 MET O 1 1 13 23581 1 1 69 MET SD S 1.443 2.075 -1.743 1.00 . A A . 69 MET SD 1 1 13 23582 1 1 70 HIS C C 3.175 -4.185 -6.630 1.00 . A A . 70 HIS C 1 1 13 23583 1 1 70 HIS CA C 2.210 -2.999 -6.639 1.00 . A A . 70 HIS CA 1 1 13 23584 1 1 70 HIS CB C 2.108 -2.329 -8.011 1.00 . A A . 70 HIS CB 1 1 13 23585 1 1 70 HIS CD2 C 0.142 -0.642 -8.364 1.00 . A A . 70 HIS CD2 1 1 13 23586 1 1 70 HIS CE1 C 1.150 1.164 -7.653 1.00 . A A . 70 HIS CE1 1 1 13 23587 1 1 70 HIS CG C 1.406 -0.992 -7.991 1.00 . A A . 70 HIS CG 1 1 13 23588 1 1 70 HIS H H 3.580 -1.804 -5.622 1.00 . A A . 70 HIS H 1 1 13 23589 1 1 70 HIS HA H 1.215 -3.349 -6.365 1.00 . A A . 70 HIS HA 1 1 13 23590 1 1 70 HIS HB2 H 3.111 -2.195 -8.415 1.00 . A A . 70 HIS HB2 1 1 13 23591 1 1 70 HIS HB3 H 1.577 -2.995 -8.691 1.00 . A A . 70 HIS HB3 1 1 13 23592 1 1 70 HIS HD1 H 2.954 0.243 -7.205 1.00 . A A . 70 HIS HD1 1 1 13 23593 1 1 70 HIS HD2 H -0.614 -1.319 -8.764 1.00 . A A . 70 HIS HD2 1 1 13 23594 1 1 70 HIS HE1 H 1.332 2.205 -7.383 1.00 . A A . 70 HIS HE1 1 1 13 23595 1 1 70 HIS N N 2.608 -2.038 -5.624 1.00 . A A . 70 HIS N 1 1 13 23596 1 1 70 HIS ND1 N 2.017 0.169 -7.547 1.00 . A A . 70 HIS ND1 1 1 13 23597 1 1 70 HIS NE2 N -0.012 0.660 -8.158 1.00 . A A . 70 HIS NE2 1 1 13 23598 1 1 70 HIS O O 2.775 -5.314 -6.350 1.00 . A A . 70 HIS O 1 1 13 23599 1 1 71 ASP C C 5.214 -5.907 -5.828 1.00 . A A . 71 ASP C 1 1 13 23600 1 1 71 ASP CA C 5.455 -4.918 -6.970 1.00 . A A . 71 ASP CA 1 1 13 23601 1 1 71 ASP CB C 6.848 -4.312 -6.784 1.00 . A A . 71 ASP CB 1 1 13 23602 1 1 71 ASP CG C 7.942 -4.927 -7.660 1.00 . A A . 71 ASP CG 1 1 13 23603 1 1 71 ASP H H 4.747 -2.969 -7.165 1.00 . A A . 71 ASP H 1 1 13 23604 1 1 71 ASP HA H 5.365 -5.383 -7.951 1.00 . A A . 71 ASP HA 1 1 13 23605 1 1 71 ASP HB2 H 6.794 -3.244 -6.992 1.00 . A A . 71 ASP HB2 1 1 13 23606 1 1 71 ASP HB3 H 7.137 -4.419 -5.739 1.00 . A A . 71 ASP HB3 1 1 13 23607 1 1 71 ASP N N 4.429 -3.889 -6.939 1.00 . A A . 71 ASP N 1 1 13 23608 1 1 71 ASP O O 5.126 -5.511 -4.667 1.00 . A A . 71 ASP O 1 1 13 23609 1 1 71 ASP OD1 O 8.047 -4.490 -8.826 1.00 . A A . 71 ASP OD1 1 1 13 23610 1 1 71 ASP OD2 O 8.649 -5.819 -7.142 1.00 . A A . 71 ASP OD2 1 1 13 23611 1 1 72 LYS C C 6.227 -8.818 -4.789 1.00 . A A . 72 LYS C 1 1 13 23612 1 1 72 LYS CA C 4.884 -8.225 -5.219 1.00 . A A . 72 LYS CA 1 1 13 23613 1 1 72 LYS CB C 3.900 -9.262 -5.766 1.00 . A A . 72 LYS CB 1 1 13 23614 1 1 72 LYS CD C 2.648 -8.784 -7.903 1.00 . A A . 72 LYS CD 1 1 13 23615 1 1 72 LYS CE C 1.914 -7.633 -8.594 1.00 . A A . 72 LYS CE 1 1 13 23616 1 1 72 LYS CG C 2.677 -8.584 -6.386 1.00 . A A . 72 LYS CG 1 1 13 23617 1 1 72 LYS H H 5.186 -7.489 -7.145 1.00 . A A . 72 LYS H 1 1 13 23618 1 1 72 LYS HA H 4.415 -7.764 -4.350 1.00 . A A . 72 LYS HA 1 1 13 23619 1 1 72 LYS HB2 H 4.396 -9.879 -6.515 1.00 . A A . 72 LYS HB2 1 1 13 23620 1 1 72 LYS HB3 H 3.584 -9.927 -4.963 1.00 . A A . 72 LYS HB3 1 1 13 23621 1 1 72 LYS HD2 H 3.667 -8.851 -8.283 1.00 . A A . 72 LYS HD2 1 1 13 23622 1 1 72 LYS HD3 H 2.156 -9.727 -8.139 1.00 . A A . 72 LYS HD3 1 1 13 23623 1 1 72 LYS HE2 H 0.839 -7.744 -8.455 1.00 . A A . 72 LYS HE2 1 1 13 23624 1 1 72 LYS HE3 H 2.199 -6.686 -8.136 1.00 . A A . 72 LYS HE3 1 1 13 23625 1 1 72 LYS HG2 H 1.768 -8.992 -5.944 1.00 . A A . 72 LYS HG2 1 1 13 23626 1 1 72 LYS HG3 H 2.691 -7.518 -6.156 1.00 . A A . 72 LYS HG3 1 1 13 23627 1 1 72 LYS HZ1 H 1.714 -6.890 -10.530 1.00 . A A . 72 LYS HZ1 1 1 13 23628 1 1 72 LYS HZ2 H 3.217 -7.426 -10.207 1.00 . A A . 72 LYS HZ2 1 1 13 23629 1 1 72 LYS N N 5.113 -7.176 -6.198 1.00 . A A . 72 LYS N 1 1 13 23630 1 1 72 LYS NZ N 2.234 -7.608 -10.039 1.00 . A A . 72 LYS NZ 1 1 13 23631 1 1 72 LYS O O 6.388 -9.229 -3.641 1.00 . A A . 72 LYS O 1 1 13 23632 1 1 73 ASN C C 9.233 -8.427 -4.535 1.00 . A A . 73 ASN C 1 1 13 23633 1 1 73 ASN CA C 8.479 -9.380 -5.466 1.00 . A A . 73 ASN CA 1 1 13 23634 1 1 73 ASN CB C 9.289 -9.518 -6.757 1.00 . A A . 73 ASN CB 1 1 13 23635 1 1 73 ASN CG C 8.528 -10.345 -7.795 1.00 . A A . 73 ASN CG 1 1 13 23636 1 1 73 ASN H H 7.016 -8.507 -6.664 1.00 . A A . 73 ASN H 1 1 13 23637 1 1 73 ASN HA H 8.307 -10.356 -5.012 1.00 . A A . 73 ASN HA 1 1 13 23638 1 1 73 ASN HB2 H 9.505 -8.529 -7.162 1.00 . A A . 73 ASN HB2 1 1 13 23639 1 1 73 ASN HB3 H 10.247 -9.991 -6.541 1.00 . A A . 73 ASN HB3 1 1 13 23640 1 1 73 ASN HD21 H 9.814 -11.871 -7.453 1.00 . A A . 73 ASN HD21 1 1 13 23641 1 1 73 ASN HD22 H 8.588 -12.186 -8.634 1.00 . A A . 73 ASN HD22 1 1 13 23642 1 1 73 ASN N N 7.156 -8.843 -5.733 1.00 . A A . 73 ASN N 1 1 13 23643 1 1 73 ASN ND2 N 9.017 -11.568 -7.976 1.00 . A A . 73 ASN ND2 1 1 13 23644 1 1 73 ASN O O 10.253 -7.857 -4.918 1.00 . A A . 73 ASN O 1 1 13 23645 1 1 73 ASN OD1 O 7.561 -9.901 -8.392 1.00 . A A . 73 ASN OD1 1 1 13 23646 1 1 74 THR C C 9.570 -8.175 -1.042 1.00 . A A . 74 THR C 1 1 13 23647 1 1 74 THR CA C 9.310 -7.411 -2.342 1.00 . A A . 74 THR CA 1 1 13 23648 1 1 74 THR CB C 8.398 -6.195 -2.160 1.00 . A A . 74 THR CB 1 1 13 23649 1 1 74 THR CG2 C 8.144 -5.453 -3.473 1.00 . A A . 74 THR CG2 1 1 13 23650 1 1 74 THR H H 7.871 -8.753 -3.026 1.00 . A A . 74 THR H 1 1 13 23651 1 1 74 THR HA H 10.278 -7.086 -2.721 1.00 . A A . 74 THR HA 1 1 13 23652 1 1 74 THR HB H 8.796 -5.521 -1.402 1.00 . A A . 74 THR HB 1 1 13 23653 1 1 74 THR HG1 H 6.479 -6.030 -1.616 1.00 . A A . 74 THR HG1 1 1 13 23654 1 1 74 THR HG21 H 8.610 -5.996 -4.294 1.00 . A A . 74 THR HG21 1 1 13 23655 1 1 74 THR HG22 H 7.070 -5.381 -3.648 1.00 . A A . 74 THR HG22 1 1 13 23656 1 1 74 THR HG23 H 8.569 -4.451 -3.412 1.00 . A A . 74 THR HG23 1 1 13 23657 1 1 74 THR N N 8.701 -8.285 -3.330 1.00 . A A . 74 THR N 1 1 13 23658 1 1 74 THR O O 8.916 -9.179 -0.766 1.00 . A A . 74 THR O 1 1 13 23659 1 1 74 THR OG1 O 7.132 -6.758 -1.828 1.00 . A A . 74 THR OG1 1 1 13 23660 1 1 75 LYS C C 9.698 -8.195 1.949 1.00 . A A . 75 LYS C 1 1 13 23661 1 1 75 LYS CA C 10.883 -8.293 0.986 1.00 . A A . 75 LYS CA 1 1 13 23662 1 1 75 LYS CB C 12.175 -7.687 1.537 1.00 . A A . 75 LYS CB 1 1 13 23663 1 1 75 LYS CD C 12.863 -7.387 3.945 1.00 . A A . 75 LYS CD 1 1 13 23664 1 1 75 LYS CE C 12.867 -8.077 5.311 1.00 . A A . 75 LYS CE 1 1 13 23665 1 1 75 LYS CG C 12.608 -8.395 2.822 1.00 . A A . 75 LYS CG 1 1 13 23666 1 1 75 LYS H H 11.055 -6.853 -0.509 1.00 . A A . 75 LYS H 1 1 13 23667 1 1 75 LYS HA H 11.080 -9.346 0.787 1.00 . A A . 75 LYS HA 1 1 13 23668 1 1 75 LYS HB2 H 12.965 -7.764 0.791 1.00 . A A . 75 LYS HB2 1 1 13 23669 1 1 75 LYS HB3 H 12.027 -6.625 1.735 1.00 . A A . 75 LYS HB3 1 1 13 23670 1 1 75 LYS HD2 H 13.818 -6.889 3.782 1.00 . A A . 75 LYS HD2 1 1 13 23671 1 1 75 LYS HD3 H 12.093 -6.615 3.927 1.00 . A A . 75 LYS HD3 1 1 13 23672 1 1 75 LYS HE2 H 12.359 -7.450 6.043 1.00 . A A . 75 LYS HE2 1 1 13 23673 1 1 75 LYS HE3 H 12.313 -9.014 5.253 1.00 . A A . 75 LYS HE3 1 1 13 23674 1 1 75 LYS HG2 H 11.837 -9.101 3.131 1.00 . A A . 75 LYS HG2 1 1 13 23675 1 1 75 LYS HG3 H 13.513 -8.973 2.636 1.00 . A A . 75 LYS HG3 1 1 13 23676 1 1 75 LYS HZ1 H 14.781 -7.485 5.885 1.00 . A A . 75 LYS HZ1 1 1 13 23677 1 1 75 LYS HZ2 H 14.284 -8.842 6.634 1.00 . A A . 75 LYS HZ2 1 1 13 23678 1 1 75 LYS N N 10.528 -7.670 -0.278 1.00 . A A . 75 LYS N 1 1 13 23679 1 1 75 LYS NZ N 14.255 -8.342 5.753 1.00 . A A . 75 LYS NZ 1 1 13 23680 1 1 75 LYS O O 9.580 -8.993 2.877 1.00 . A A . 75 LYS O 1 1 13 23681 1 1 76 PHE C C 6.393 -7.109 1.705 1.00 . A A . 76 PHE C 1 1 13 23682 1 1 76 PHE CA C 7.678 -6.997 2.527 1.00 . A A . 76 PHE CA 1 1 13 23683 1 1 76 PHE CB C 7.800 -5.571 3.070 1.00 . A A . 76 PHE CB 1 1 13 23684 1 1 76 PHE CD1 C 9.037 -6.048 5.214 1.00 . A A . 76 PHE CD1 1 1 13 23685 1 1 76 PHE CD2 C 9.999 -4.495 3.673 1.00 . A A . 76 PHE CD2 1 1 13 23686 1 1 76 PHE CE1 C 10.151 -5.854 6.105 1.00 . A A . 76 PHE CE1 1 1 13 23687 1 1 76 PHE CE2 C 11.113 -4.300 4.564 1.00 . A A . 76 PHE CE2 1 1 13 23688 1 1 76 PHE CG C 8.984 -5.365 4.016 1.00 . A A . 76 PHE CG 1 1 13 23689 1 1 76 PHE CZ C 11.134 -4.989 5.736 1.00 . A A . 76 PHE CZ 1 1 13 23690 1 1 76 PHE H H 8.953 -6.565 0.937 1.00 . A A . 76 PHE H 1 1 13 23691 1 1 76 PHE HA H 7.673 -7.763 3.302 1.00 . A A . 76 PHE HA 1 1 13 23692 1 1 76 PHE HB2 H 7.894 -4.881 2.231 1.00 . A A . 76 PHE HB2 1 1 13 23693 1 1 76 PHE HB3 H 6.879 -5.313 3.594 1.00 . A A . 76 PHE HB3 1 1 13 23694 1 1 76 PHE HD1 H 8.236 -6.735 5.486 1.00 . A A . 76 PHE HD1 1 1 13 23695 1 1 76 PHE HD2 H 9.957 -3.955 2.727 1.00 . A A . 76 PHE HD2 1 1 13 23696 1 1 76 PHE HE1 H 10.206 -6.387 7.054 1.00 . A A . 76 PHE HE1 1 1 13 23697 1 1 76 PHE HE2 H 11.921 -3.616 4.305 1.00 . A A . 76 PHE HE2 1 1 13 23698 1 1 76 PHE HZ H 11.965 -4.924 6.484 1.00 . A A . 76 PHE HZ 1 1 13 23699 1 1 76 PHE N N 8.850 -7.209 1.694 1.00 . A A . 76 PHE N 1 1 13 23700 1 1 76 PHE O O 6.411 -6.920 0.489 1.00 . A A . 76 PHE O 1 1 13 23701 1 1 77 LYS C C 3.603 -6.209 1.152 1.00 . A A . 77 LYS C 1 1 13 23702 1 1 77 LYS CA C 4.016 -7.556 1.750 1.00 . A A . 77 LYS CA 1 1 13 23703 1 1 77 LYS CB C 2.988 -8.139 2.720 1.00 . A A . 77 LYS CB 1 1 13 23704 1 1 77 LYS CD C 2.414 -10.395 3.692 1.00 . A A . 77 LYS CD 1 1 13 23705 1 1 77 LYS CE C 0.966 -10.889 3.702 1.00 . A A . 77 LYS CE 1 1 13 23706 1 1 77 LYS CG C 2.717 -9.613 2.412 1.00 . A A . 77 LYS CG 1 1 13 23707 1 1 77 LYS H H 5.302 -7.568 3.389 1.00 . A A . 77 LYS H 1 1 13 23708 1 1 77 LYS HA H 4.136 -8.272 0.937 1.00 . A A . 77 LYS HA 1 1 13 23709 1 1 77 LYS HB2 H 3.349 -8.039 3.744 1.00 . A A . 77 LYS HB2 1 1 13 23710 1 1 77 LYS HB3 H 2.058 -7.574 2.654 1.00 . A A . 77 LYS HB3 1 1 13 23711 1 1 77 LYS HD2 H 3.093 -11.244 3.773 1.00 . A A . 77 LYS HD2 1 1 13 23712 1 1 77 LYS HD3 H 2.592 -9.761 4.560 1.00 . A A . 77 LYS HD3 1 1 13 23713 1 1 77 LYS HE2 H 0.362 -10.248 4.343 1.00 . A A . 77 LYS HE2 1 1 13 23714 1 1 77 LYS HE3 H 0.546 -10.825 2.699 1.00 . A A . 77 LYS HE3 1 1 13 23715 1 1 77 LYS HG2 H 1.876 -9.696 1.723 1.00 . A A . 77 LYS HG2 1 1 13 23716 1 1 77 LYS HG3 H 3.582 -10.048 1.912 1.00 . A A . 77 LYS HG3 1 1 13 23717 1 1 77 LYS HZ1 H 0.758 -12.336 5.188 1.00 . A A . 77 LYS HZ1 1 1 13 23718 1 1 77 LYS HZ2 H 0.139 -12.801 3.755 1.00 . A A . 77 LYS HZ2 1 1 13 23719 1 1 77 LYS N N 5.308 -7.416 2.400 1.00 . A A . 77 LYS N 1 1 13 23720 1 1 77 LYS NZ N 0.900 -12.287 4.185 1.00 . A A . 77 LYS NZ 1 1 13 23721 1 1 77 LYS O O 3.584 -5.196 1.849 1.00 . A A . 77 LYS O 1 1 13 23722 1 1 78 SER C C 1.346 -4.990 -0.941 1.00 . A A . 78 SER C 1 1 13 23723 1 1 78 SER CA C 2.871 -5.037 -0.833 1.00 . A A . 78 SER CA 1 1 13 23724 1 1 78 SER CB C 3.504 -4.964 -2.224 1.00 . A A . 78 SER CB 1 1 13 23725 1 1 78 SER H H 3.301 -7.070 -0.693 1.00 . A A . 78 SER H 1 1 13 23726 1 1 78 SER HA H 3.237 -4.210 -0.224 1.00 . A A . 78 SER HA 1 1 13 23727 1 1 78 SER HB2 H 3.545 -3.925 -2.550 1.00 . A A . 78 SER HB2 1 1 13 23728 1 1 78 SER HB3 H 4.532 -5.323 -2.174 1.00 . A A . 78 SER HB3 1 1 13 23729 1 1 78 SER HG H 3.234 -5.688 -4.070 1.00 . A A . 78 SER HG 1 1 13 23730 1 1 78 SER N N 3.283 -6.242 -0.133 1.00 . A A . 78 SER N 1 1 13 23731 1 1 78 SER O O 0.676 -6.009 -0.779 1.00 . A A . 78 SER O 1 1 13 23732 1 1 78 SER OG O 2.780 -5.733 -3.181 1.00 . A A . 78 SER OG 1 1 13 23733 1 1 79 CYS C C -1.148 -4.710 -2.243 1.00 . A A . 79 CYS C 1 1 13 23734 1 1 79 CYS CA C -0.594 -3.602 -1.345 1.00 . A A . 79 CYS CA 1 1 13 23735 1 1 79 CYS CB C -0.930 -2.210 -1.883 1.00 . A A . 79 CYS CB 1 1 13 23736 1 1 79 CYS H H 1.392 -2.971 -1.344 1.00 . A A . 79 CYS H 1 1 13 23737 1 1 79 CYS HA H -1.012 -3.671 -0.341 1.00 . A A . 79 CYS HA 1 1 13 23738 1 1 79 CYS HB2 H -0.581 -2.140 -2.914 1.00 . A A . 79 CYS HB2 1 1 13 23739 1 1 79 CYS HB3 H -2.013 -2.095 -1.905 1.00 . A A . 79 CYS HB3 1 1 13 23740 1 1 79 CYS N N 0.840 -3.795 -1.214 1.00 . A A . 79 CYS N 1 1 13 23741 1 1 79 CYS O O -1.899 -5.569 -1.783 1.00 . A A . 79 CYS O 1 1 13 23742 1 1 79 CYS SG S -0.213 -0.823 -0.927 1.00 . A A . 79 CYS SG 1 1 13 23743 1 1 80 VAL C C -0.679 -7.021 -4.069 1.00 . A A . 80 VAL C 1 1 13 23744 1 1 80 VAL CA C -1.205 -5.642 -4.473 1.00 . A A . 80 VAL CA 1 1 13 23745 1 1 80 VAL CB C -0.776 -5.229 -5.882 1.00 . A A . 80 VAL CB 1 1 13 23746 1 1 80 VAL CG1 C -1.118 -6.318 -6.901 1.00 . A A . 80 VAL CG1 1 1 13 23747 1 1 80 VAL CG2 C -1.406 -3.891 -6.277 1.00 . A A . 80 VAL CG2 1 1 13 23748 1 1 80 VAL H H -0.146 -3.953 -3.873 1.00 . A A . 80 VAL H 1 1 13 23749 1 1 80 VAL HA H -2.295 -5.660 -4.444 1.00 . A A . 80 VAL HA 1 1 13 23750 1 1 80 VAL HB H 0.307 -5.101 -5.879 1.00 . A A . 80 VAL HB 1 1 13 23751 1 1 80 VAL HG11 H -0.989 -7.298 -6.442 1.00 . A A . 80 VAL HG11 1 1 13 23752 1 1 80 VAL HG12 H -2.152 -6.201 -7.225 1.00 . A A . 80 VAL HG12 1 1 13 23753 1 1 80 VAL HG13 H -0.456 -6.230 -7.763 1.00 . A A . 80 VAL HG13 1 1 13 23754 1 1 80 VAL HG21 H -2.326 -3.743 -5.713 1.00 . A A . 80 VAL HG21 1 1 13 23755 1 1 80 VAL HG22 H -0.709 -3.083 -6.056 1.00 . A A . 80 VAL HG22 1 1 13 23756 1 1 80 VAL HG23 H -1.630 -3.896 -7.344 1.00 . A A . 80 VAL HG23 1 1 13 23757 1 1 80 VAL N N -0.757 -4.654 -3.507 1.00 . A A . 80 VAL N 1 1 13 23758 1 1 80 VAL O O -1.368 -8.026 -4.237 1.00 . A A . 80 VAL O 1 1 13 23759 1 1 81 GLY C C 0.236 -9.054 -2.188 1.00 . A A . 81 GLY C 1 1 13 23760 1 1 81 GLY CA C 1.163 -8.263 -3.113 1.00 . A A . 81 GLY CA 1 1 13 23761 1 1 81 GLY H H 1.090 -6.202 -3.409 1.00 . A A . 81 GLY H 1 1 13 23762 1 1 81 GLY HA2 H 1.417 -8.867 -3.983 1.00 . A A . 81 GLY HA2 1 1 13 23763 1 1 81 GLY HA3 H 2.096 -8.042 -2.595 1.00 . A A . 81 GLY HA3 1 1 13 23764 1 1 81 GLY N N 0.537 -7.024 -3.543 1.00 . A A . 81 GLY N 1 1 13 23765 1 1 81 GLY O O -0.110 -10.198 -2.481 1.00 . A A . 81 GLY O 1 1 13 23766 1 1 82 CYS C C -2.369 -9.306 -0.796 1.00 . A A . 82 CYS C 1 1 13 23767 1 1 82 CYS CA C -1.021 -9.043 -0.122 1.00 . A A . 82 CYS CA 1 1 13 23768 1 1 82 CYS CB C -1.171 -8.194 1.142 1.00 . A A . 82 CYS CB 1 1 13 23769 1 1 82 CYS H H 0.144 -7.483 -0.861 1.00 . A A . 82 CYS H 1 1 13 23770 1 1 82 CYS HA H -0.546 -9.980 0.171 1.00 . A A . 82 CYS HA 1 1 13 23771 1 1 82 CYS HB2 H -0.189 -7.968 1.557 1.00 . A A . 82 CYS HB2 1 1 13 23772 1 1 82 CYS HB3 H -1.640 -7.241 0.896 1.00 . A A . 82 CYS HB3 1 1 13 23773 1 1 82 CYS N N -0.141 -8.413 -1.091 1.00 . A A . 82 CYS N 1 1 13 23774 1 1 82 CYS O O -2.940 -10.386 -0.652 1.00 . A A . 82 CYS O 1 1 13 23775 1 1 82 CYS SG S -2.182 -9.086 2.379 1.00 . A A . 82 CYS SG 1 1 13 23776 1 1 83 HIS C C -4.112 -9.665 -3.086 1.00 . A A . 83 HIS C 1 1 13 23777 1 1 83 HIS CA C -4.110 -8.407 -2.215 1.00 . A A . 83 HIS CA 1 1 13 23778 1 1 83 HIS CB C -4.403 -7.134 -3.011 1.00 . A A . 83 HIS CB 1 1 13 23779 1 1 83 HIS CD2 C -4.795 -5.724 -0.846 1.00 . A A . 83 HIS CD2 1 1 13 23780 1 1 83 HIS CE1 C -6.023 -4.140 -1.724 1.00 . A A . 83 HIS CE1 1 1 13 23781 1 1 83 HIS CG C -4.936 -5.996 -2.175 1.00 . A A . 83 HIS CG 1 1 13 23782 1 1 83 HIS H H -2.369 -7.424 -1.631 1.00 . A A . 83 HIS H 1 1 13 23783 1 1 83 HIS HA H -4.879 -8.505 -1.449 1.00 . A A . 83 HIS HA 1 1 13 23784 1 1 83 HIS HB2 H -3.488 -6.810 -3.508 1.00 . A A . 83 HIS HB2 1 1 13 23785 1 1 83 HIS HB3 H -5.125 -7.366 -3.794 1.00 . A A . 83 HIS HB3 1 1 13 23786 1 1 83 HIS HD1 H -5.998 -4.895 -3.656 1.00 . A A . 83 HIS HD1 1 1 13 23787 1 1 83 HIS HD2 H -4.237 -6.326 -0.128 1.00 . A A . 83 HIS HD2 1 1 13 23788 1 1 83 HIS HE1 H -6.627 -3.238 -1.821 1.00 . A A . 83 HIS HE1 1 1 13 23789 1 1 83 HIS N N -2.839 -8.299 -1.518 1.00 . A A . 83 HIS N 1 1 13 23790 1 1 83 HIS ND1 N -5.715 -4.980 -2.701 1.00 . A A . 83 HIS ND1 1 1 13 23791 1 1 83 HIS NE2 N -5.451 -4.602 -0.575 1.00 . A A . 83 HIS NE2 1 1 13 23792 1 1 83 HIS O O -5.094 -10.406 -3.110 1.00 . A A . 83 HIS O 1 1 13 23793 1 1 84 VAL C C -3.088 -12.299 -3.837 1.00 . A A . 84 VAL C 1 1 13 23794 1 1 84 VAL CA C -2.863 -11.023 -4.651 1.00 . A A . 84 VAL CA 1 1 13 23795 1 1 84 VAL CB C -1.503 -10.991 -5.350 1.00 . A A . 84 VAL CB 1 1 13 23796 1 1 84 VAL CG1 C -1.290 -12.250 -6.193 1.00 . A A . 84 VAL CG1 1 1 13 23797 1 1 84 VAL CG2 C -1.353 -9.729 -6.201 1.00 . A A . 84 VAL CG2 1 1 13 23798 1 1 84 VAL H H -2.208 -9.260 -3.755 1.00 . A A . 84 VAL H 1 1 13 23799 1 1 84 VAL HA H -3.637 -10.953 -5.415 1.00 . A A . 84 VAL HA 1 1 13 23800 1 1 84 VAL HB H -0.731 -10.969 -4.580 1.00 . A A . 84 VAL HB 1 1 13 23801 1 1 84 VAL HG11 H -1.336 -13.130 -5.550 1.00 . A A . 84 VAL HG11 1 1 13 23802 1 1 84 VAL HG12 H -2.069 -12.314 -6.953 1.00 . A A . 84 VAL HG12 1 1 13 23803 1 1 84 VAL HG13 H -0.314 -12.203 -6.675 1.00 . A A . 84 VAL HG13 1 1 13 23804 1 1 84 VAL HG21 H -2.190 -9.059 -6.008 1.00 . A A . 84 VAL HG21 1 1 13 23805 1 1 84 VAL HG22 H -0.419 -9.227 -5.946 1.00 . A A . 84 VAL HG22 1 1 13 23806 1 1 84 VAL HG23 H -1.342 -10.002 -7.256 1.00 . A A . 84 VAL HG23 1 1 13 23807 1 1 84 VAL N N -3.002 -9.867 -3.780 1.00 . A A . 84 VAL N 1 1 13 23808 1 1 84 VAL O O -3.689 -13.254 -4.327 1.00 . A A . 84 VAL O 1 1 13 23809 1 1 85 GLU C C -4.170 -13.517 -1.206 1.00 . A A . 85 GLU C 1 1 13 23810 1 1 85 GLU CA C -2.733 -13.417 -1.722 1.00 . A A . 85 GLU CA 1 1 13 23811 1 1 85 GLU CB C -1.738 -13.335 -0.562 1.00 . A A . 85 GLU CB 1 1 13 23812 1 1 85 GLU CD C -0.371 -15.297 0.238 1.00 . A A . 85 GLU CD 1 1 13 23813 1 1 85 GLU CG C -0.512 -14.210 -0.829 1.00 . A A . 85 GLU CG 1 1 13 23814 1 1 85 GLU H H -2.107 -11.493 -2.217 1.00 . A A . 85 GLU H 1 1 13 23815 1 1 85 GLU HA H -2.497 -14.288 -2.334 1.00 . A A . 85 GLU HA 1 1 13 23816 1 1 85 GLU HB2 H -1.427 -12.301 -0.417 1.00 . A A . 85 GLU HB2 1 1 13 23817 1 1 85 GLU HB3 H -2.223 -13.655 0.361 1.00 . A A . 85 GLU HB3 1 1 13 23818 1 1 85 GLU HG2 H -0.596 -14.670 -1.813 1.00 . A A . 85 GLU HG2 1 1 13 23819 1 1 85 GLU HG3 H 0.385 -13.590 -0.843 1.00 . A A . 85 GLU HG3 1 1 13 23820 1 1 85 GLU N N -2.594 -12.274 -2.608 1.00 . A A . 85 GLU N 1 1 13 23821 1 1 85 GLU O O -4.682 -14.615 -0.996 1.00 . A A . 85 GLU O 1 1 13 23822 1 1 85 GLU OE1 O -1.423 -15.701 0.779 1.00 . A A . 85 GLU OE1 1 1 13 23823 1 1 85 GLU OE2 O 0.786 -15.700 0.489 1.00 . A A . 85 GLU OE2 1 1 13 23824 1 1 86 VAL C C -7.101 -12.716 -1.651 1.00 . A A . 86 VAL C 1 1 13 23825 1 1 86 VAL CA C -6.147 -12.299 -0.530 1.00 . A A . 86 VAL CA 1 1 13 23826 1 1 86 VAL CB C -6.447 -10.905 0.024 1.00 . A A . 86 VAL CB 1 1 13 23827 1 1 86 VAL CG1 C -7.898 -10.805 0.500 1.00 . A A . 86 VAL CG1 1 1 13 23828 1 1 86 VAL CG2 C -5.475 -10.539 1.147 1.00 . A A . 86 VAL CG2 1 1 13 23829 1 1 86 VAL H H -4.355 -11.467 -1.191 1.00 . A A . 86 VAL H 1 1 13 23830 1 1 86 VAL HA H -6.234 -13.013 0.289 1.00 . A A . 86 VAL HA 1 1 13 23831 1 1 86 VAL HB H -6.310 -10.186 -0.785 1.00 . A A . 86 VAL HB 1 1 13 23832 1 1 86 VAL HG11 H -8.268 -11.800 0.749 1.00 . A A . 86 VAL HG11 1 1 13 23833 1 1 86 VAL HG12 H -7.947 -10.167 1.383 1.00 . A A . 86 VAL HG12 1 1 13 23834 1 1 86 VAL HG13 H -8.512 -10.377 -0.292 1.00 . A A . 86 VAL HG13 1 1 13 23835 1 1 86 VAL HG21 H -4.513 -11.018 0.965 1.00 . A A . 86 VAL HG21 1 1 13 23836 1 1 86 VAL HG22 H -5.343 -9.457 1.176 1.00 . A A . 86 VAL HG22 1 1 13 23837 1 1 86 VAL HG23 H -5.876 -10.881 2.101 1.00 . A A . 86 VAL HG23 1 1 13 23838 1 1 86 VAL N N -4.779 -12.356 -1.017 1.00 . A A . 86 VAL N 1 1 13 23839 1 1 86 VAL O O -7.943 -13.592 -1.460 1.00 . A A . 86 VAL O 1 1 13 23840 1 1 87 ALA C C -7.420 -13.747 -4.490 1.00 . A A . 87 ALA C 1 1 13 23841 1 1 87 ALA CA C -7.774 -12.361 -3.947 1.00 . A A . 87 ALA CA 1 1 13 23842 1 1 87 ALA CB C -7.600 -11.261 -4.996 1.00 . A A . 87 ALA CB 1 1 13 23843 1 1 87 ALA H H -6.250 -11.357 -2.942 1.00 . A A . 87 ALA H 1 1 13 23844 1 1 87 ALA HA H -8.811 -12.364 -3.611 1.00 . A A . 87 ALA HA 1 1 13 23845 1 1 87 ALA HB1 H -6.667 -10.728 -4.813 1.00 . A A . 87 ALA HB1 1 1 13 23846 1 1 87 ALA HB2 H -7.573 -11.709 -5.990 1.00 . A A . 87 ALA HB2 1 1 13 23847 1 1 87 ALA HB3 H -8.435 -10.564 -4.934 1.00 . A A . 87 ALA HB3 1 1 13 23848 1 1 87 ALA N N -6.937 -12.068 -2.795 1.00 . A A . 87 ALA N 1 1 13 23849 1 1 87 ALA O O -8.100 -14.262 -5.376 1.00 . A A . 87 ALA O 1 1 13 23850 1 1 88 GLY C C -7.092 -16.538 -4.673 1.00 . A A . 88 GLY C 1 1 13 23851 1 1 88 GLY CA C -5.906 -15.627 -4.353 1.00 . A A . 88 GLY CA 1 1 13 23852 1 1 88 GLY H H -5.811 -13.885 -3.214 1.00 . A A . 88 GLY H 1 1 13 23853 1 1 88 GLY HA2 H -5.266 -15.534 -5.231 1.00 . A A . 88 GLY HA2 1 1 13 23854 1 1 88 GLY HA3 H -5.301 -16.075 -3.565 1.00 . A A . 88 GLY HA3 1 1 13 23855 1 1 88 GLY N N -6.358 -14.311 -3.935 1.00 . A A . 88 GLY N 1 1 13 23856 1 1 88 GLY O O -7.941 -16.783 -3.817 1.00 . A A . 88 GLY O 1 1 13 23857 1 1 89 ALA C C -9.529 -17.197 -6.147 1.00 . A A . 89 ALA C 1 1 13 23858 1 1 89 ALA CA C -8.183 -17.894 -6.353 1.00 . A A . 89 ALA CA 1 1 13 23859 1 1 89 ALA CB C -8.094 -19.225 -5.604 1.00 . A A . 89 ALA CB 1 1 13 23860 1 1 89 ALA H H -6.420 -16.812 -6.600 1.00 . A A . 89 ALA H 1 1 13 23861 1 1 89 ALA HA H -8.039 -18.080 -7.418 1.00 . A A . 89 ALA HA 1 1 13 23862 1 1 89 ALA HB1 H -7.048 -19.488 -5.452 1.00 . A A . 89 ALA HB1 1 1 13 23863 1 1 89 ALA HB2 H -8.589 -19.132 -4.637 1.00 . A A . 89 ALA HB2 1 1 13 23864 1 1 89 ALA HB3 H -8.584 -20.004 -6.188 1.00 . A A . 89 ALA HB3 1 1 13 23865 1 1 89 ALA N N -7.114 -17.016 -5.909 1.00 . A A . 89 ALA N 1 1 13 23866 1 1 89 ALA O O -10.336 -17.628 -5.324 1.00 . A A . 89 ALA O 1 1 13 23867 1 1 90 ASP C C -11.194 -14.623 -8.134 1.00 . A A . 90 ASP C 1 1 13 23868 1 1 90 ASP CA C -10.965 -15.370 -6.818 1.00 . A A . 90 ASP CA 1 1 13 23869 1 1 90 ASP CB C -10.894 -14.336 -5.693 1.00 . A A . 90 ASP CB 1 1 13 23870 1 1 90 ASP CG C -12.245 -13.783 -5.237 1.00 . A A . 90 ASP CG 1 1 13 23871 1 1 90 ASP H H -9.069 -15.788 -7.575 1.00 . A A . 90 ASP H 1 1 13 23872 1 1 90 ASP HA H -11.742 -16.107 -6.616 1.00 . A A . 90 ASP HA 1 1 13 23873 1 1 90 ASP HB2 H -10.395 -14.788 -4.836 1.00 . A A . 90 ASP HB2 1 1 13 23874 1 1 90 ASP HB3 H -10.270 -13.505 -6.023 1.00 . A A . 90 ASP HB3 1 1 13 23875 1 1 90 ASP N N -9.730 -16.131 -6.908 1.00 . A A . 90 ASP N 1 1 13 23876 1 1 90 ASP O O -12.291 -14.660 -8.690 1.00 . A A . 90 ASP O 1 1 13 23877 1 1 90 ASP OD1 O -12.883 -13.092 -6.061 1.00 . A A . 90 ASP OD1 1 1 13 23878 1 1 90 ASP OD2 O -12.610 -14.063 -4.075 1.00 . A A . 90 ASP OD2 1 1 13 23879 1 1 91 ALA C C -11.021 -11.927 -9.597 1.00 . A A . 91 ALA C 1 1 13 23880 1 1 91 ALA CA C -10.215 -13.206 -9.832 1.00 . A A . 91 ALA CA 1 1 13 23881 1 1 91 ALA CB C -10.820 -14.083 -10.930 1.00 . A A . 91 ALA CB 1 1 13 23882 1 1 91 ALA H H -9.254 -13.936 -8.134 1.00 . A A . 91 ALA H 1 1 13 23883 1 1 91 ALA HA H -9.198 -12.938 -10.118 1.00 . A A . 91 ALA HA 1 1 13 23884 1 1 91 ALA HB1 H -11.106 -15.047 -10.508 1.00 . A A . 91 ALA HB1 1 1 13 23885 1 1 91 ALA HB2 H -11.701 -13.592 -11.343 1.00 . A A . 91 ALA HB2 1 1 13 23886 1 1 91 ALA HB3 H -10.085 -14.235 -11.720 1.00 . A A . 91 ALA HB3 1 1 13 23887 1 1 91 ALA N N -10.142 -13.961 -8.593 1.00 . A A . 91 ALA N 1 1 13 23888 1 1 91 ALA O O -10.463 -10.831 -9.584 1.00 . A A . 91 ALA O 1 1 13 23889 1 1 92 ALA C C -12.571 -10.037 -8.167 1.00 . A A . 92 ALA C 1 1 13 23890 1 1 92 ALA CA C -13.210 -10.983 -9.186 1.00 . A A . 92 ALA CA 1 1 13 23891 1 1 92 ALA CB C -14.576 -11.497 -8.728 1.00 . A A . 92 ALA CB 1 1 13 23892 1 1 92 ALA H H -12.768 -13.004 -9.431 1.00 . A A . 92 ALA H 1 1 13 23893 1 1 92 ALA HA H -13.332 -10.455 -10.132 1.00 . A A . 92 ALA HA 1 1 13 23894 1 1 92 ALA HB1 H -14.790 -12.447 -9.217 1.00 . A A . 92 ALA HB1 1 1 13 23895 1 1 92 ALA HB2 H -14.568 -11.638 -7.647 1.00 . A A . 92 ALA HB2 1 1 13 23896 1 1 92 ALA HB3 H -15.345 -10.771 -8.993 1.00 . A A . 92 ALA HB3 1 1 13 23897 1 1 92 ALA N N -12.321 -12.109 -9.419 1.00 . A A . 92 ALA N 1 1 13 23898 1 1 92 ALA O O -12.636 -8.818 -8.320 1.00 . A A . 92 ALA O 1 1 13 23899 1 1 93 LYS C C -10.072 -9.184 -6.679 1.00 . A A . 93 LYS C 1 1 13 23900 1 1 93 LYS CA C -11.319 -9.861 -6.105 1.00 . A A . 93 LYS CA 1 1 13 23901 1 1 93 LYS CB C -11.036 -10.739 -4.885 1.00 . A A . 93 LYS CB 1 1 13 23902 1 1 93 LYS CD C -12.744 -9.839 -3.262 1.00 . A A . 93 LYS CD 1 1 13 23903 1 1 93 LYS CE C -14.106 -9.302 -3.707 1.00 . A A . 93 LYS CE 1 1 13 23904 1 1 93 LYS CG C -12.323 -11.038 -4.114 1.00 . A A . 93 LYS CG 1 1 13 23905 1 1 93 LYS H H -11.920 -11.626 -7.032 1.00 . A A . 93 LYS H 1 1 13 23906 1 1 93 LYS HA H -12.018 -9.086 -5.790 1.00 . A A . 93 LYS HA 1 1 13 23907 1 1 93 LYS HB2 H -10.573 -11.673 -5.203 1.00 . A A . 93 LYS HB2 1 1 13 23908 1 1 93 LYS HB3 H -10.323 -10.238 -4.229 1.00 . A A . 93 LYS HB3 1 1 13 23909 1 1 93 LYS HD2 H -12.788 -10.131 -2.213 1.00 . A A . 93 LYS HD2 1 1 13 23910 1 1 93 LYS HD3 H -11.994 -9.051 -3.342 1.00 . A A . 93 LYS HD3 1 1 13 23911 1 1 93 LYS HE2 H -14.151 -9.265 -4.795 1.00 . A A . 93 LYS HE2 1 1 13 23912 1 1 93 LYS HE3 H -14.895 -9.977 -3.377 1.00 . A A . 93 LYS HE3 1 1 13 23913 1 1 93 LYS HG2 H -13.120 -11.289 -4.814 1.00 . A A . 93 LYS HG2 1 1 13 23914 1 1 93 LYS HG3 H -12.174 -11.908 -3.475 1.00 . A A . 93 LYS HG3 1 1 13 23915 1 1 93 LYS HZ1 H -14.667 -7.986 -2.191 1.00 . A A . 93 LYS HZ1 1 1 13 23916 1 1 93 LYS HZ2 H -13.491 -7.391 -3.148 1.00 . A A . 93 LYS HZ2 1 1 13 23917 1 1 93 LYS N N -11.969 -10.634 -7.149 1.00 . A A . 93 LYS N 1 1 13 23918 1 1 93 LYS NZ N -14.336 -7.950 -3.149 1.00 . A A . 93 LYS NZ 1 1 13 23919 1 1 93 LYS O O -9.774 -8.038 -6.344 1.00 . A A . 93 LYS O 1 1 13 23920 1 1 94 LYS C C -8.533 -8.237 -9.073 1.00 . A A . 94 LYS C 1 1 13 23921 1 1 94 LYS CA C -8.170 -9.406 -8.156 1.00 . A A . 94 LYS CA 1 1 13 23922 1 1 94 LYS CB C -7.411 -10.531 -8.863 1.00 . A A . 94 LYS CB 1 1 13 23923 1 1 94 LYS CD C -6.307 -12.559 -7.850 1.00 . A A . 94 LYS CD 1 1 13 23924 1 1 94 LYS CE C -5.728 -13.255 -9.084 1.00 . A A . 94 LYS CE 1 1 13 23925 1 1 94 LYS CG C -6.253 -11.038 -8.002 1.00 . A A . 94 LYS CG 1 1 13 23926 1 1 94 LYS H H -9.628 -10.852 -7.800 1.00 . A A . 94 LYS H 1 1 13 23927 1 1 94 LYS HA H -7.525 -9.034 -7.359 1.00 . A A . 94 LYS HA 1 1 13 23928 1 1 94 LYS HB2 H -8.093 -11.353 -9.083 1.00 . A A . 94 LYS HB2 1 1 13 23929 1 1 94 LYS HB3 H -7.029 -10.171 -9.819 1.00 . A A . 94 LYS HB3 1 1 13 23930 1 1 94 LYS HD2 H -5.749 -12.859 -6.963 1.00 . A A . 94 LYS HD2 1 1 13 23931 1 1 94 LYS HD3 H -7.339 -12.876 -7.699 1.00 . A A . 94 LYS HD3 1 1 13 23932 1 1 94 LYS HE2 H -5.376 -12.509 -9.797 1.00 . A A . 94 LYS HE2 1 1 13 23933 1 1 94 LYS HE3 H -4.865 -13.856 -8.798 1.00 . A A . 94 LYS HE3 1 1 13 23934 1 1 94 LYS HG2 H -5.305 -10.747 -8.455 1.00 . A A . 94 LYS HG2 1 1 13 23935 1 1 94 LYS HG3 H -6.293 -10.568 -7.019 1.00 . A A . 94 LYS HG3 1 1 13 23936 1 1 94 LYS HZ1 H -7.623 -14.115 -9.204 1.00 . A A . 94 LYS HZ1 1 1 13 23937 1 1 94 LYS HZ2 H -6.968 -13.812 -10.663 1.00 . A A . 94 LYS HZ2 1 1 13 23938 1 1 94 LYS N N -9.378 -9.921 -7.533 1.00 . A A . 94 LYS N 1 1 13 23939 1 1 94 LYS NZ N -6.750 -14.115 -9.720 1.00 . A A . 94 LYS NZ 1 1 13 23940 1 1 94 LYS O O -7.652 -7.543 -9.578 1.00 . A A . 94 LYS O 1 1 13 23941 1 1 95 LYS C C -10.746 -5.799 -9.233 1.00 . A A . 95 LYS C 1 1 13 23942 1 1 95 LYS CA C -10.322 -6.981 -10.108 1.00 . A A . 95 LYS CA 1 1 13 23943 1 1 95 LYS CB C -11.429 -7.491 -11.032 1.00 . A A . 95 LYS CB 1 1 13 23944 1 1 95 LYS CD C -11.874 -8.059 -13.448 1.00 . A A . 95 LYS CD 1 1 13 23945 1 1 95 LYS CE C -10.918 -9.107 -14.021 1.00 . A A . 95 LYS CE 1 1 13 23946 1 1 95 LYS CG C -11.144 -7.118 -12.488 1.00 . A A . 95 LYS CG 1 1 13 23947 1 1 95 LYS H H -10.542 -8.622 -8.845 1.00 . A A . 95 LYS H 1 1 13 23948 1 1 95 LYS HA H -9.495 -6.662 -10.742 1.00 . A A . 95 LYS HA 1 1 13 23949 1 1 95 LYS HB2 H -11.515 -8.574 -10.940 1.00 . A A . 95 LYS HB2 1 1 13 23950 1 1 95 LYS HB3 H -12.387 -7.069 -10.725 1.00 . A A . 95 LYS HB3 1 1 13 23951 1 1 95 LYS HD2 H -12.692 -8.555 -12.925 1.00 . A A . 95 LYS HD2 1 1 13 23952 1 1 95 LYS HD3 H -12.318 -7.483 -14.260 1.00 . A A . 95 LYS HD3 1 1 13 23953 1 1 95 LYS HE2 H -11.079 -9.205 -15.095 1.00 . A A . 95 LYS HE2 1 1 13 23954 1 1 95 LYS HE3 H -9.887 -8.782 -13.882 1.00 . A A . 95 LYS HE3 1 1 13 23955 1 1 95 LYS HG2 H -11.457 -6.090 -12.672 1.00 . A A . 95 LYS HG2 1 1 13 23956 1 1 95 LYS HG3 H -10.071 -7.162 -12.675 1.00 . A A . 95 LYS HG3 1 1 13 23957 1 1 95 LYS HZ1 H -11.560 -11.090 -13.981 1.00 . A A . 95 LYS HZ1 1 1 13 23958 1 1 95 LYS HZ2 H -10.254 -10.824 -13.045 1.00 . A A . 95 LYS HZ2 1 1 13 23959 1 1 95 LYS N N -9.832 -8.054 -9.260 1.00 . A A . 95 LYS N 1 1 13 23960 1 1 95 LYS NZ N -11.127 -10.415 -13.361 1.00 . A A . 95 LYS NZ 1 1 13 23961 1 1 95 LYS O O -10.942 -4.692 -9.732 1.00 . A A . 95 LYS O 1 1 13 23962 1 1 96 ASP C C -10.218 -4.942 -5.893 1.00 . A A . 96 ASP C 1 1 13 23963 1 1 96 ASP CA C -11.274 -5.048 -6.995 1.00 . A A . 96 ASP CA 1 1 13 23964 1 1 96 ASP CB C -12.611 -5.395 -6.337 1.00 . A A . 96 ASP CB 1 1 13 23965 1 1 96 ASP CG C -13.771 -4.467 -6.702 1.00 . A A . 96 ASP CG 1 1 13 23966 1 1 96 ASP H H -10.714 -6.978 -7.546 1.00 . A A . 96 ASP H 1 1 13 23967 1 1 96 ASP HA H -11.358 -4.134 -7.582 1.00 . A A . 96 ASP HA 1 1 13 23968 1 1 96 ASP HB2 H -12.880 -6.415 -6.613 1.00 . A A . 96 ASP HB2 1 1 13 23969 1 1 96 ASP HB3 H -12.480 -5.381 -5.255 1.00 . A A . 96 ASP HB3 1 1 13 23970 1 1 96 ASP N N -10.876 -6.075 -7.944 1.00 . A A . 96 ASP N 1 1 13 23971 1 1 96 ASP O O -10.387 -4.186 -4.938 1.00 . A A . 96 ASP O 1 1 13 23972 1 1 96 ASP OD1 O -13.479 -3.302 -7.049 1.00 . A A . 96 ASP OD1 1 1 13 23973 1 1 96 ASP OD2 O -14.924 -4.944 -6.627 1.00 . A A . 96 ASP OD2 1 1 13 23974 1 1 97 LEU C C -6.746 -5.439 -5.813 1.00 . A A . 97 LEU C 1 1 13 23975 1 1 97 LEU CA C -8.069 -5.712 -5.094 1.00 . A A . 97 LEU CA 1 1 13 23976 1 1 97 LEU CB C -8.073 -7.011 -4.287 1.00 . A A . 97 LEU CB 1 1 13 23977 1 1 97 LEU CD1 C -8.990 -8.371 -2.372 1.00 . A A . 97 LEU CD1 1 1 13 23978 1 1 97 LEU CD2 C -9.528 -5.899 -2.554 1.00 . A A . 97 LEU CD2 1 1 13 23979 1 1 97 LEU CG C -9.241 -7.194 -3.316 1.00 . A A . 97 LEU CG 1 1 13 23980 1 1 97 LEU H H -9.022 -6.322 -6.843 1.00 . A A . 97 LEU H 1 1 13 23981 1 1 97 LEU HA H -8.256 -4.897 -4.394 1.00 . A A . 97 LEU HA 1 1 13 23982 1 1 97 LEU HB2 H -8.073 -7.849 -4.985 1.00 . A A . 97 LEU HB2 1 1 13 23983 1 1 97 LEU HB3 H -7.144 -7.068 -3.721 1.00 . A A . 97 LEU HB3 1 1 13 23984 1 1 97 LEU HD11 H -8.283 -9.062 -2.832 1.00 . A A . 97 LEU HD11 1 1 13 23985 1 1 97 LEU HD12 H -8.579 -8.002 -1.432 1.00 . A A . 97 LEU HD12 1 1 13 23986 1 1 97 LEU HD13 H -9.930 -8.889 -2.178 1.00 . A A . 97 LEU HD13 1 1 13 23987 1 1 97 LEU HD21 H -8.615 -5.308 -2.485 1.00 . A A . 97 LEU HD21 1 1 13 23988 1 1 97 LEU HD22 H -10.291 -5.328 -3.082 1.00 . A A . 97 LEU HD22 1 1 13 23989 1 1 97 LEU HD23 H -9.883 -6.138 -1.551 1.00 . A A . 97 LEU HD23 1 1 13 23990 1 1 97 LEU HG H -10.134 -7.431 -3.895 1.00 . A A . 97 LEU HG 1 1 13 23991 1 1 97 LEU N N -9.152 -5.710 -6.063 1.00 . A A . 97 LEU N 1 1 13 23992 1 1 97 LEU O O -5.977 -4.573 -5.399 1.00 . A A . 97 LEU O 1 1 13 23993 1 1 98 THR C C -5.625 -5.465 -9.039 1.00 . A A . 98 THR C 1 1 13 23994 1 1 98 THR CA C -5.306 -6.045 -7.659 1.00 . A A . 98 THR CA 1 1 13 23995 1 1 98 THR CB C -4.612 -7.407 -7.719 1.00 . A A . 98 THR CB 1 1 13 23996 1 1 98 THR CG2 C -4.677 -8.156 -6.386 1.00 . A A . 98 THR CG2 1 1 13 23997 1 1 98 THR H H -7.153 -6.896 -7.209 1.00 . A A . 98 THR H 1 1 13 23998 1 1 98 THR HA H -4.659 -5.329 -7.154 1.00 . A A . 98 THR HA 1 1 13 23999 1 1 98 THR HB H -3.582 -7.305 -8.059 1.00 . A A . 98 THR HB 1 1 13 24000 1 1 98 THR HG1 H -5.316 -7.871 -9.534 1.00 . A A . 98 THR HG1 1 1 13 24001 1 1 98 THR HG21 H -5.718 -8.270 -6.084 1.00 . A A . 98 THR HG21 1 1 13 24002 1 1 98 THR HG22 H -4.221 -9.140 -6.499 1.00 . A A . 98 THR HG22 1 1 13 24003 1 1 98 THR HG23 H -4.138 -7.591 -5.626 1.00 . A A . 98 THR HG23 1 1 13 24004 1 1 98 THR N N -6.522 -6.194 -6.879 1.00 . A A . 98 THR N 1 1 13 24005 1 1 98 THR O O -4.746 -5.367 -9.894 1.00 . A A . 98 THR O 1 1 13 24006 1 1 98 THR OG1 O -5.435 -8.178 -8.590 1.00 . A A . 98 THR OG1 1 1 13 24007 1 1 99 GLY C C -6.515 -3.286 -10.836 1.00 . A A . 99 GLY C 1 1 13 24008 1 1 99 GLY CA C -7.332 -4.528 -10.474 1.00 . A A . 99 GLY CA 1 1 13 24009 1 1 99 GLY H H -7.594 -5.178 -8.512 1.00 . A A . 99 GLY H 1 1 13 24010 1 1 99 GLY HA2 H -7.239 -5.273 -11.264 1.00 . A A . 99 GLY HA2 1 1 13 24011 1 1 99 GLY HA3 H -8.388 -4.266 -10.405 1.00 . A A . 99 GLY HA3 1 1 13 24012 1 1 99 GLY N N -6.886 -5.095 -9.213 1.00 . A A . 99 GLY N 1 1 13 24013 1 1 99 GLY O O -6.090 -2.539 -9.956 1.00 . A A . 99 GLY O 1 1 13 24014 1 1 100 CYS C C -6.513 -0.777 -12.764 1.00 . A A . 100 CYS C 1 1 13 24015 1 1 100 CYS CA C -5.560 -1.966 -12.623 1.00 . A A . 100 CYS CA 1 1 13 24016 1 1 100 CYS CB C -4.847 -2.285 -13.939 1.00 . A A . 100 CYS CB 1 1 13 24017 1 1 100 CYS H H -6.668 -3.716 -12.843 1.00 . A A . 100 CYS H 1 1 13 24018 1 1 100 CYS HA H -4.791 -1.759 -11.879 1.00 . A A . 100 CYS HA 1 1 13 24019 1 1 100 CYS HB2 H -5.479 -2.952 -14.526 1.00 . A A . 100 CYS HB2 1 1 13 24020 1 1 100 CYS HB3 H -4.740 -1.363 -14.511 1.00 . A A . 100 CYS HB3 1 1 13 24021 1 1 100 CYS N N -6.319 -3.104 -12.134 1.00 . A A . 100 CYS N 1 1 13 24022 1 1 100 CYS O O -6.253 0.299 -12.229 1.00 . A A . 100 CYS O 1 1 13 24023 1 1 100 CYS SG S -3.198 -3.055 -13.751 1.00 . A A . 100 CYS SG 1 1 13 24024 1 1 101 LYS C C -9.979 -0.524 -13.368 1.00 . A A . 101 LYS C 1 1 13 24025 1 1 101 LYS CA C -8.592 0.025 -13.706 1.00 . A A . 101 LYS CA 1 1 13 24026 1 1 101 LYS CB C -8.480 0.583 -15.126 1.00 . A A . 101 LYS CB 1 1 13 24027 1 1 101 LYS CD C -10.785 0.942 -16.084 1.00 . A A . 101 LYS CD 1 1 13 24028 1 1 101 LYS CE C -10.885 1.366 -17.551 1.00 . A A . 101 LYS CE 1 1 13 24029 1 1 101 LYS CG C -9.585 1.604 -15.403 1.00 . A A . 101 LYS CG 1 1 13 24030 1 1 101 LYS H H -7.803 -1.891 -13.919 1.00 . A A . 101 LYS H 1 1 13 24031 1 1 101 LYS HA H -8.367 0.842 -13.020 1.00 . A A . 101 LYS HA 1 1 13 24032 1 1 101 LYS HB2 H -7.505 1.052 -15.261 1.00 . A A . 101 LYS HB2 1 1 13 24033 1 1 101 LYS HB3 H -8.543 -0.231 -15.847 1.00 . A A . 101 LYS HB3 1 1 13 24034 1 1 101 LYS HD2 H -10.691 -0.142 -16.020 1.00 . A A . 101 LYS HD2 1 1 13 24035 1 1 101 LYS HD3 H -11.701 1.214 -15.560 1.00 . A A . 101 LYS HD3 1 1 13 24036 1 1 101 LYS HE2 H -11.450 2.295 -17.629 1.00 . A A . 101 LYS HE2 1 1 13 24037 1 1 101 LYS HE3 H -9.889 1.564 -17.947 1.00 . A A . 101 LYS HE3 1 1 13 24038 1 1 101 LYS HG2 H -9.903 2.064 -14.467 1.00 . A A . 101 LYS HG2 1 1 13 24039 1 1 101 LYS HG3 H -9.198 2.403 -16.035 1.00 . A A . 101 LYS HG3 1 1 13 24040 1 1 101 LYS HZ1 H -12.528 0.501 -18.497 1.00 . A A . 101 LYS HZ1 1 1 13 24041 1 1 101 LYS HZ2 H -11.124 0.212 -19.270 1.00 . A A . 101 LYS HZ2 1 1 13 24042 1 1 101 LYS N N -7.598 -1.013 -13.488 1.00 . A A . 101 LYS N 1 1 13 24043 1 1 101 LYS NZ N -11.543 0.310 -18.351 1.00 . A A . 101 LYS NZ 1 1 13 24044 1 1 101 LYS O O -10.335 -1.624 -13.789 1.00 . A A . 101 LYS O 1 1 13 24045 1 1 102 LYS C C -11.981 -1.054 -11.000 1.00 . A A . 102 LYS C 1 1 13 24046 1 1 102 LYS CA C -12.066 -0.126 -12.213 1.00 . A A . 102 LYS CA 1 1 13 24047 1 1 102 LYS CB C -12.822 -0.731 -13.398 1.00 . A A . 102 LYS CB 1 1 13 24048 1 1 102 LYS CD C -15.116 -1.618 -13.955 1.00 . A A . 102 LYS CD 1 1 13 24049 1 1 102 LYS CE C -16.039 -2.335 -12.967 1.00 . A A . 102 LYS CE 1 1 13 24050 1 1 102 LYS CG C -14.329 -0.505 -13.260 1.00 . A A . 102 LYS CG 1 1 13 24051 1 1 102 LYS H H -10.429 1.161 -12.274 1.00 . A A . 102 LYS H 1 1 13 24052 1 1 102 LYS HA H -12.599 0.779 -11.919 1.00 . A A . 102 LYS HA 1 1 13 24053 1 1 102 LYS HB2 H -12.468 -0.285 -14.327 1.00 . A A . 102 LYS HB2 1 1 13 24054 1 1 102 LYS HB3 H -12.615 -1.799 -13.459 1.00 . A A . 102 LYS HB3 1 1 13 24055 1 1 102 LYS HD2 H -15.706 -1.197 -14.769 1.00 . A A . 102 LYS HD2 1 1 13 24056 1 1 102 LYS HD3 H -14.425 -2.334 -14.399 1.00 . A A . 102 LYS HD3 1 1 13 24057 1 1 102 LYS HE2 H -16.323 -3.309 -13.367 1.00 . A A . 102 LYS HE2 1 1 13 24058 1 1 102 LYS HE3 H -15.510 -2.516 -12.032 1.00 . A A . 102 LYS HE3 1 1 13 24059 1 1 102 LYS HG2 H -14.600 -0.468 -12.204 1.00 . A A . 102 LYS HG2 1 1 13 24060 1 1 102 LYS HG3 H -14.597 0.459 -13.692 1.00 . A A . 102 LYS HG3 1 1 13 24061 1 1 102 LYS HZ1 H -17.031 -0.644 -12.261 1.00 . A A . 102 LYS HZ1 1 1 13 24062 1 1 102 LYS HZ2 H -17.750 -1.305 -13.564 1.00 . A A . 102 LYS HZ2 1 1 13 24063 1 1 102 LYS N N -10.726 0.267 -12.612 1.00 . A A . 102 LYS N 1 1 13 24064 1 1 102 LYS NZ N -17.252 -1.526 -12.709 1.00 . A A . 102 LYS NZ 1 1 13 24065 1 1 102 LYS O O -12.707 -2.043 -10.918 1.00 . A A . 102 LYS O 1 1 13 24066 1 1 103 SER C C -11.163 -0.630 -7.645 1.00 . A A . 103 SER C 1 1 13 24067 1 1 103 SER CA C -10.897 -1.491 -8.882 1.00 . A A . 103 SER CA 1 1 13 24068 1 1 103 SER CB C -9.486 -2.079 -8.826 1.00 . A A . 103 SER CB 1 1 13 24069 1 1 103 SER H H -10.501 0.105 -10.161 1.00 . A A . 103 SER H 1 1 13 24070 1 1 103 SER HA H -11.625 -2.299 -8.949 1.00 . A A . 103 SER HA 1 1 13 24071 1 1 103 SER HB2 H -9.133 -2.076 -7.794 1.00 . A A . 103 SER HB2 1 1 13 24072 1 1 103 SER HB3 H -9.514 -3.119 -9.149 1.00 . A A . 103 SER HB3 1 1 13 24073 1 1 103 SER HG H -8.599 -0.382 -9.406 1.00 . A A . 103 SER HG 1 1 13 24074 1 1 103 SER N N -11.087 -0.701 -10.087 1.00 . A A . 103 SER N 1 1 13 24075 1 1 103 SER O O -11.614 0.508 -7.762 1.00 . A A . 103 SER O 1 1 13 24076 1 1 103 SER OG O -8.572 -1.353 -9.643 1.00 . A A . 103 SER OG 1 1 13 24077 1 1 104 LYS C C -9.980 0.548 -5.058 1.00 . A A . 104 LYS C 1 1 13 24078 1 1 104 LYS CA C -11.075 -0.506 -5.232 1.00 . A A . 104 LYS CA 1 1 13 24079 1 1 104 LYS CB C -11.160 -1.501 -4.072 1.00 . A A . 104 LYS CB 1 1 13 24080 1 1 104 LYS CD C -13.504 -1.803 -3.192 1.00 . A A . 104 LYS CD 1 1 13 24081 1 1 104 LYS CE C -14.251 -2.953 -2.513 1.00 . A A . 104 LYS CE 1 1 13 24082 1 1 104 LYS CG C -12.441 -2.333 -4.156 1.00 . A A . 104 LYS CG 1 1 13 24083 1 1 104 LYS H H -10.506 -2.133 -6.402 1.00 . A A . 104 LYS H 1 1 13 24084 1 1 104 LYS HA H -12.037 0.002 -5.292 1.00 . A A . 104 LYS HA 1 1 13 24085 1 1 104 LYS HB2 H -10.292 -2.160 -4.088 1.00 . A A . 104 LYS HB2 1 1 13 24086 1 1 104 LYS HB3 H -11.133 -0.963 -3.124 1.00 . A A . 104 LYS HB3 1 1 13 24087 1 1 104 LYS HD2 H -13.033 -1.174 -2.436 1.00 . A A . 104 LYS HD2 1 1 13 24088 1 1 104 LYS HD3 H -14.211 -1.175 -3.734 1.00 . A A . 104 LYS HD3 1 1 13 24089 1 1 104 LYS HE2 H -13.542 -3.717 -2.196 1.00 . A A . 104 LYS HE2 1 1 13 24090 1 1 104 LYS HE3 H -14.752 -2.589 -1.616 1.00 . A A . 104 LYS HE3 1 1 13 24091 1 1 104 LYS HG2 H -12.827 -2.311 -5.176 1.00 . A A . 104 LYS HG2 1 1 13 24092 1 1 104 LYS HG3 H -12.219 -3.374 -3.922 1.00 . A A . 104 LYS HG3 1 1 13 24093 1 1 104 LYS HZ1 H -16.191 -3.457 -3.083 1.00 . A A . 104 LYS HZ1 1 1 13 24094 1 1 104 LYS HZ2 H -15.230 -3.094 -4.347 1.00 . A A . 104 LYS HZ2 1 1 13 24095 1 1 104 LYS N N -10.872 -1.207 -6.489 1.00 . A A . 104 LYS N 1 1 13 24096 1 1 104 LYS NZ N -15.245 -3.543 -3.438 1.00 . A A . 104 LYS NZ 1 1 13 24097 1 1 104 LYS O O -10.192 1.567 -4.403 1.00 . A A . 104 LYS O 1 1 13 24098 1 1 105 CYS C C -7.863 2.239 -6.667 1.00 . A A . 105 CYS C 1 1 13 24099 1 1 105 CYS CA C -7.703 1.178 -5.576 1.00 . A A . 105 CYS CA 1 1 13 24100 1 1 105 CYS CB C -6.369 0.438 -5.691 1.00 . A A . 105 CYS CB 1 1 13 24101 1 1 105 CYS H H -8.667 -0.564 -6.188 1.00 . A A . 105 CYS H 1 1 13 24102 1 1 105 CYS HA H -7.738 1.633 -4.586 1.00 . A A . 105 CYS HA 1 1 13 24103 1 1 105 CYS HB2 H -6.319 -0.094 -6.641 1.00 . A A . 105 CYS HB2 1 1 13 24104 1 1 105 CYS HB3 H -5.545 1.152 -5.683 1.00 . A A . 105 CYS HB3 1 1 13 24105 1 1 105 CYS N N -8.832 0.267 -5.657 1.00 . A A . 105 CYS N 1 1 13 24106 1 1 105 CYS O O -8.051 3.417 -6.370 1.00 . A A . 105 CYS O 1 1 13 24107 1 1 105 CYS SG S -6.187 -0.743 -4.305 1.00 . A A . 105 CYS SG 1 1 13 24108 1 1 106 HIS C C -9.333 2.580 -9.611 1.00 . A A . 106 HIS C 1 1 13 24109 1 1 106 HIS CA C -7.915 2.677 -9.045 1.00 . A A . 106 HIS CA 1 1 13 24110 1 1 106 HIS CB C -6.838 2.388 -10.093 1.00 . A A . 106 HIS CB 1 1 13 24111 1 1 106 HIS CD2 C -4.365 1.757 -9.530 1.00 . A A . 106 HIS CD2 1 1 13 24112 1 1 106 HIS CE1 C -3.715 3.699 -8.760 1.00 . A A . 106 HIS CE1 1 1 13 24113 1 1 106 HIS CG C -5.428 2.609 -9.601 1.00 . A A . 106 HIS CG 1 1 13 24114 1 1 106 HIS H H -7.629 0.822 -8.142 1.00 . A A . 106 HIS H 1 1 13 24115 1 1 106 HIS HA H -7.751 3.687 -8.670 1.00 . A A . 106 HIS HA 1 1 13 24116 1 1 106 HIS HB2 H -6.938 1.355 -10.427 1.00 . A A . 106 HIS HB2 1 1 13 24117 1 1 106 HIS HB3 H -7.012 3.022 -10.962 1.00 . A A . 106 HIS HB3 1 1 13 24118 1 1 106 HIS HD1 H -5.536 4.657 -9.029 1.00 . A A . 106 HIS HD1 1 1 13 24119 1 1 106 HIS HD2 H -4.365 0.711 -9.837 1.00 . A A . 106 HIS HD2 1 1 13 24120 1 1 106 HIS HE1 H -3.086 4.483 -8.338 1.00 . A A . 106 HIS HE1 1 1 13 24121 1 1 106 HIS N N -7.782 1.782 -7.908 1.00 . A A . 106 HIS N 1 1 13 24122 1 1 106 HIS ND1 N -4.987 3.825 -9.108 1.00 . A A . 106 HIS ND1 1 1 13 24123 1 1 106 HIS NE2 N -3.331 2.417 -9.023 1.00 . A A . 106 HIS NE2 1 1 13 24124 1 1 106 HIS O O -9.828 1.485 -9.872 1.00 . A A . 106 HIS O 1 1 13 24125 1 1 107 GLU C C -11.287 4.366 -11.736 1.00 . A A . 107 GLU C 1 1 13 24126 1 1 107 GLU CA C -11.299 3.802 -10.314 1.00 . A A . 107 GLU CA 1 1 13 24127 1 1 107 GLU CB C -12.208 4.630 -9.403 1.00 . A A . 107 GLU CB 1 1 13 24128 1 1 107 GLU CD C -13.899 3.974 -7.652 1.00 . A A . 107 GLU CD 1 1 13 24129 1 1 107 GLU CG C -12.426 3.929 -8.061 1.00 . A A . 107 GLU CG 1 1 13 24130 1 1 107 GLU H H -9.537 4.628 -9.570 1.00 . A A . 107 GLU H 1 1 13 24131 1 1 107 GLU HA H -11.651 2.771 -10.327 1.00 . A A . 107 GLU HA 1 1 13 24132 1 1 107 GLU HB2 H -11.765 5.612 -9.237 1.00 . A A . 107 GLU HB2 1 1 13 24133 1 1 107 GLU HB3 H -13.168 4.793 -9.893 1.00 . A A . 107 GLU HB3 1 1 13 24134 1 1 107 GLU HG2 H -12.096 2.892 -8.131 1.00 . A A . 107 GLU HG2 1 1 13 24135 1 1 107 GLU HG3 H -11.816 4.407 -7.294 1.00 . A A . 107 GLU HG3 1 1 13 24136 1 1 107 GLU N N -9.947 3.742 -9.784 1.00 . A A . 107 GLU N 1 1 13 24137 1 1 107 GLU O O -10.341 5.047 -12.130 1.00 . A A . 107 GLU O 1 1 13 24138 1 1 107 GLU OXT O -12.271 4.101 -12.460 1.00 . A A . 107 GLU OXT 1 1 13 24139 1 1 107 GLU OE1 O -14.719 3.424 -8.418 1.00 . A A . 107 GLU OE1 1 1 13 24140 1 1 107 GLU OE2 O -14.173 4.559 -6.581 1.00 . A A . 107 GLU OE2 1 1 13 24141 2 2 1 HEC C1A C -1.150 5.430 9.080 1.00 . B A . 108 HEC C1A 1 1 13 24142 2 2 1 HEC C1B C -1.997 2.311 11.949 1.00 . B A . 108 HEC C1B 1 1 13 24143 2 2 1 HEC C1C C -2.204 -0.592 8.676 1.00 . B A . 108 HEC C1C 1 1 13 24144 2 2 1 HEC C1D C -1.073 2.511 5.890 1.00 . B A . 108 HEC C1D 1 1 13 24145 2 2 1 HEC C2A C -1.063 6.514 10.029 1.00 . B A . 108 HEC C2A 1 1 13 24146 2 2 1 HEC C2B C -2.394 1.421 13.015 1.00 . B A . 108 HEC C2B 1 1 13 24147 2 2 1 HEC C2C C -2.263 -1.669 7.717 1.00 . B A . 108 HEC C2C 1 1 13 24148 2 2 1 HEC C2D C -0.643 3.417 4.850 1.00 . B A . 108 HEC C2D 1 1 13 24149 2 2 1 HEC C3A C -1.256 5.985 11.256 1.00 . B A . 108 HEC C3A 1 1 13 24150 2 2 1 HEC C3B C -2.595 0.206 12.462 1.00 . B A . 108 HEC C3B 1 1 13 24151 2 2 1 HEC C3C C -1.926 -1.151 6.517 1.00 . B A . 108 HEC C3C 1 1 13 24152 2 2 1 HEC C3D C -0.569 4.647 5.401 1.00 . B A . 108 HEC C3D 1 1 13 24153 2 2 1 HEC C4A C -1.463 4.567 11.078 1.00 . B A . 108 HEC C4A 1 1 13 24154 2 2 1 HEC C4B C -2.325 0.331 11.050 1.00 . B A . 108 HEC C4B 1 1 13 24155 2 2 1 HEC C4C C -1.653 0.252 6.722 1.00 . B A . 108 HEC C4C 1 1 13 24156 2 2 1 HEC C4D C -0.952 4.515 6.787 1.00 . B A . 108 HEC C4D 1 1 13 24157 2 2 1 HEC CAA C -0.806 7.949 9.672 1.00 . B A . 108 HEC CAA 1 1 13 24158 2 2 1 HEC CAB C -3.018 -1.061 13.146 1.00 . B A . 108 HEC CAB 1 1 13 24159 2 2 1 HEC CAC C -1.836 -1.859 5.196 1.00 . B A . 108 HEC CAC 1 1 13 24160 2 2 1 HEC CAD C -0.169 5.933 4.739 1.00 . B A . 108 HEC CAD 1 1 13 24161 2 2 1 HEC CBA C 0.283 8.612 10.511 1.00 . B A . 108 HEC CBA 1 1 13 24162 2 2 1 HEC CBB C -4.258 -0.909 14.023 1.00 . B A . 108 HEC CBB 1 1 13 24163 2 2 1 HEC CBC C -2.855 -2.982 5.024 1.00 . B A . 108 HEC CBC 1 1 13 24164 2 2 1 HEC CBD C -0.741 6.113 3.336 1.00 . B A . 108 HEC CBD 1 1 13 24165 2 2 1 HEC CGA C -0.295 9.716 11.385 1.00 . B A . 108 HEC CGA 1 1 13 24166 2 2 1 HEC CGD C 0.355 6.450 2.336 1.00 . B A . 108 HEC CGD 1 1 13 24167 2 2 1 HEC CHA C -1.003 5.580 7.705 1.00 . B A . 108 HEC CHA 1 1 13 24168 2 2 1 HEC CHB C -1.700 3.658 12.126 1.00 . B A . 108 HEC CHB 1 1 13 24169 2 2 1 HEC CHC C -2.423 -0.722 10.122 1.00 . B A . 108 HEC CHC 1 1 13 24170 2 2 1 HEC CHD C -1.267 1.146 5.707 1.00 . B A . 108 HEC CHD 1 1 13 24171 2 2 1 HEC CMA C -1.262 6.695 12.578 1.00 . B A . 108 HEC CMA 1 1 13 24172 2 2 1 HEC CMB C -2.541 1.817 14.455 1.00 . B A . 108 HEC CMB 1 1 13 24173 2 2 1 HEC CMC C -2.636 -3.087 8.039 1.00 . B A . 108 HEC CMC 1 1 13 24174 2 2 1 HEC CMD C -0.345 3.019 3.434 1.00 . B A . 108 HEC CMD 1 1 13 24175 2 2 1 HEC FE FE -1.611 2.413 8.903 1.00 . B A . 108 HEC FE 1 1 13 24176 2 2 1 HEC HAA1 H -0.493 8.014 8.630 1.00 . B A . 108 HEC HAA1 1 1 13 24177 2 2 1 HEC HAA2 H -1.718 8.528 9.814 1.00 . B A . 108 HEC HAA2 1 1 13 24178 2 2 1 HEC HAB H -3.246 -1.820 12.398 1.00 . B A . 108 HEC HAB 1 1 13 24179 2 2 1 HEC HAC H -2.004 -1.146 4.390 1.00 . B A . 108 HEC HAC 1 1 13 24180 2 2 1 HEC HAD1 H -0.517 6.774 5.339 1.00 . B A . 108 HEC HAD1 1 1 13 24181 2 2 1 HEC HAD2 H 0.917 5.974 4.651 1.00 . B A . 108 HEC HAD2 1 1 13 24182 2 2 1 HEC HBA1 H 0.750 7.867 11.155 1.00 . B A . 108 HEC HBA1 1 1 13 24183 2 2 1 HEC HBA2 H 1.035 9.047 9.853 1.00 . B A . 108 HEC HBA2 1 1 13 24184 2 2 1 HEC HBB1 H -3.991 -0.390 14.944 1.00 . B A . 108 HEC HBB1 1 1 13 24185 2 2 1 HEC HBB2 H -5.013 -0.333 13.488 1.00 . B A . 108 HEC HBB2 1 1 13 24186 2 2 1 HEC HBB3 H -4.656 -1.895 14.264 1.00 . B A . 108 HEC HBB3 1 1 13 24187 2 2 1 HEC HBC1 H -3.086 -3.104 3.966 1.00 . B A . 108 HEC HBC1 1 1 13 24188 2 2 1 HEC HBC2 H -2.442 -3.912 5.415 1.00 . B A . 108 HEC HBC2 1 1 13 24189 2 2 1 HEC HBC3 H -3.766 -2.733 5.569 1.00 . B A . 108 HEC HBC3 1 1 13 24190 2 2 1 HEC HBD1 H -1.229 5.190 3.021 1.00 . B A . 108 HEC HBD1 1 1 13 24191 2 2 1 HEC HBD2 H -1.469 6.925 3.342 1.00 . B A . 108 HEC HBD2 1 1 13 24192 2 2 1 HEC HHA H -0.922 6.591 7.307 1.00 . B A . 108 HEC HHA 1 1 13 24193 2 2 1 HEC HHB H -1.645 4.041 13.145 1.00 . B A . 108 HEC HHB 1 1 13 24194 2 2 1 HEC HHC H -2.678 -1.709 10.507 1.00 . B A . 108 HEC HHC 1 1 13 24195 2 2 1 HEC HHD H -1.110 0.736 4.709 1.00 . B A . 108 HEC HHD 1 1 13 24196 2 2 1 HEC HMA1 H -0.715 7.634 12.489 1.00 . B A . 108 HEC HMA1 1 1 13 24197 2 2 1 HEC HMA2 H -2.290 6.900 12.875 1.00 . B A . 108 HEC HMA2 1 1 13 24198 2 2 1 HEC HMA3 H -0.785 6.067 13.330 1.00 . B A . 108 HEC HMA3 1 1 13 24199 2 2 1 HEC HMB1 H -3.578 2.093 14.651 1.00 . B A . 108 HEC HMB1 1 1 13 24200 2 2 1 HEC HMB2 H -2.261 0.980 15.093 1.00 . B A . 108 HEC HMB2 1 1 13 24201 2 2 1 HEC HMB3 H -1.893 2.668 14.666 1.00 . B A . 108 HEC HMB3 1 1 13 24202 2 2 1 HEC HMC1 H -2.441 -3.283 9.093 1.00 . B A . 108 HEC HMC1 1 1 13 24203 2 2 1 HEC HMC2 H -3.695 -3.240 7.831 1.00 . B A . 108 HEC HMC2 1 1 13 24204 2 2 1 HEC HMC3 H -2.044 -3.767 7.427 1.00 . B A . 108 HEC HMC3 1 1 13 24205 2 2 1 HEC HMD1 H 0.272 3.784 2.964 1.00 . B A . 108 HEC HMD1 1 1 13 24206 2 2 1 HEC HMD2 H 0.189 2.068 3.428 1.00 . B A . 108 HEC HMD2 1 1 13 24207 2 2 1 HEC HMD3 H -1.278 2.915 2.882 1.00 . B A . 108 HEC HMD3 1 1 13 24208 2 2 1 HEC NA N -1.396 4.236 9.736 1.00 . B A . 108 HEC NA 1 1 13 24209 2 2 1 HEC NB N -1.958 1.631 10.745 1.00 . B A . 108 HEC NB 1 1 13 24210 2 2 1 HEC NC N -1.828 0.586 8.054 1.00 . B A . 108 HEC NC 1 1 13 24211 2 2 1 HEC ND N -1.261 3.198 7.077 1.00 . B A . 108 HEC ND 1 1 13 24212 2 2 1 HEC O1A O -1.203 10.417 10.888 1.00 . B A . 108 HEC O1A 1 1 13 24213 2 2 1 HEC O1D O 0.564 7.661 2.109 1.00 . B A . 108 HEC O1D 1 1 13 24214 2 2 1 HEC O2A O 0.181 9.839 12.534 1.00 . B A . 108 HEC O2A 1 1 13 24215 2 2 1 HEC O2D O 0.964 5.489 1.817 1.00 . B A . 108 HEC O2D 1 1 13 24216 3 2 1 HEC C1A C 9.637 -1.732 1.681 1.00 . C A . 109 HEC C1A 1 1 13 24217 3 2 1 HEC C1B C 5.813 -0.008 2.722 1.00 . C A . 109 HEC C1B 1 1 13 24218 3 2 1 HEC C1C C 7.868 2.982 5.169 1.00 . C A . 109 HEC C1C 1 1 13 24219 3 2 1 HEC C1D C 11.669 1.408 3.847 1.00 . C A . 109 HEC C1D 1 1 13 24220 3 2 1 HEC C2A C 9.124 -2.795 0.850 1.00 . C A . 109 HEC C2A 1 1 13 24221 3 2 1 HEC C2B C 4.463 0.348 3.086 1.00 . C A . 109 HEC C2B 1 1 13 24222 3 2 1 HEC C2C C 8.395 4.107 5.905 1.00 . C A . 109 HEC C2C 1 1 13 24223 3 2 1 HEC C2D C 13.014 0.983 3.537 1.00 . C A . 109 HEC C2D 1 1 13 24224 3 2 1 HEC C3A C 7.781 -2.663 0.822 1.00 . C A . 109 HEC C3A 1 1 13 24225 3 2 1 HEC C3B C 4.543 1.395 3.934 1.00 . C A . 109 HEC C3B 1 1 13 24226 3 2 1 HEC C3C C 9.738 4.071 5.775 1.00 . C A . 109 HEC C3C 1 1 13 24227 3 2 1 HEC C3D C 12.914 -0.147 2.806 1.00 . C A . 109 HEC C3D 1 1 13 24228 3 2 1 HEC C4A C 7.450 -1.517 1.635 1.00 . C A . 109 HEC C4A 1 1 13 24229 3 2 1 HEC C4B C 5.945 1.698 4.103 1.00 . C A . 109 HEC C4B 1 1 13 24230 3 2 1 HEC C4C C 10.056 2.924 4.957 1.00 . C A . 109 HEC C4C 1 1 13 24231 3 2 1 HEC C4D C 11.507 -0.432 2.655 1.00 . C A . 109 HEC C4D 1 1 13 24232 3 2 1 HEC CAA C 9.965 -3.833 0.165 1.00 . C A . 109 HEC CAA 1 1 13 24233 3 2 1 HEC CAB C 3.419 2.136 4.598 1.00 . C A . 109 HEC CAB 1 1 13 24234 3 2 1 HEC CAC C 10.748 5.021 6.352 1.00 . C A . 109 HEC CAC 1 1 13 24235 3 2 1 HEC CAD C 14.025 -0.980 2.237 1.00 . C A . 109 HEC CAD 1 1 13 24236 3 2 1 HEC CBA C 10.194 -3.565 -1.319 1.00 . C A . 109 HEC CBA 1 1 13 24237 3 2 1 HEC CBB C 2.370 1.229 5.235 1.00 . C A . 109 HEC CBB 1 1 13 24238 3 2 1 HEC CBC C 10.716 5.110 7.875 1.00 . C A . 109 HEC CBC 1 1 13 24239 3 2 1 HEC CBD C 15.262 -1.057 3.127 1.00 . C A . 109 HEC CBD 1 1 13 24240 3 2 1 HEC CGA C 10.956 -4.710 -1.972 1.00 . C A . 109 HEC CGA 1 1 13 24241 3 2 1 HEC CGD C 16.421 -0.277 2.523 1.00 . C A . 109 HEC CGD 1 1 13 24242 3 2 1 HEC CHA C 10.987 -1.535 1.952 1.00 . C A . 109 HEC CHA 1 1 13 24243 3 2 1 HEC CHB C 6.142 -1.048 1.858 1.00 . C A . 109 HEC CHB 1 1 13 24244 3 2 1 HEC CHC C 6.446 2.731 4.916 1.00 . C A . 109 HEC CHC 1 1 13 24245 3 2 1 HEC CHD C 11.359 2.542 4.591 1.00 . C A . 109 HEC CHD 1 1 13 24246 3 2 1 HEC CMA C 6.783 -3.520 0.098 1.00 . C A . 109 HEC CMA 1 1 13 24247 3 2 1 HEC CMB C 3.228 -0.345 2.589 1.00 . C A . 109 HEC CMB 1 1 13 24248 3 2 1 HEC CMC C 7.565 5.104 6.659 1.00 . C A . 109 HEC CMC 1 1 13 24249 3 2 1 HEC CMD C 14.261 1.697 3.970 1.00 . C A . 109 HEC CMD 1 1 13 24250 3 2 1 HEC FE FE 8.741 0.667 3.350 1.00 . C A . 109 HEC FE 1 1 13 24251 3 2 1 HEC HAA1 H 10.945 -3.877 0.640 1.00 . C A . 109 HEC HAA1 1 1 13 24252 3 2 1 HEC HAA2 H 9.479 -4.805 0.245 1.00 . C A . 109 HEC HAA2 1 1 13 24253 3 2 1 HEC HAB H 3.819 2.770 5.388 1.00 . C A . 109 HEC HAB 1 1 13 24254 3 2 1 HEC HAC H 11.750 4.701 6.069 1.00 . C A . 109 HEC HAC 1 1 13 24255 3 2 1 HEC HAD1 H 13.674 -2.001 2.086 1.00 . C A . 109 HEC HAD1 1 1 13 24256 3 2 1 HEC HAD2 H 14.342 -0.560 1.282 1.00 . C A . 109 HEC HAD2 1 1 13 24257 3 2 1 HEC HBA1 H 9.233 -3.455 -1.822 1.00 . C A . 109 HEC HBA1 1 1 13 24258 3 2 1 HEC HBA2 H 10.773 -2.649 -1.438 1.00 . C A . 109 HEC HBA2 1 1 13 24259 3 2 1 HEC HBB1 H 2.022 1.675 6.167 1.00 . C A . 109 HEC HBB1 1 1 13 24260 3 2 1 HEC HBB2 H 1.529 1.110 4.553 1.00 . C A . 109 HEC HBB2 1 1 13 24261 3 2 1 HEC HBB3 H 2.810 0.253 5.442 1.00 . C A . 109 HEC HBB3 1 1 13 24262 3 2 1 HEC HBC1 H 9.893 5.755 8.184 1.00 . C A . 109 HEC HBC1 1 1 13 24263 3 2 1 HEC HBC2 H 10.574 4.114 8.295 1.00 . C A . 109 HEC HBC2 1 1 13 24264 3 2 1 HEC HBC3 H 11.658 5.525 8.234 1.00 . C A . 109 HEC HBC3 1 1 13 24265 3 2 1 HEC HBD1 H 15.032 -0.636 4.106 1.00 . C A . 109 HEC HBD1 1 1 13 24266 3 2 1 HEC HBD2 H 15.564 -2.098 3.241 1.00 . C A . 109 HEC HBD2 1 1 13 24267 3 2 1 HEC HHA H 11.696 -2.283 1.597 1.00 . C A . 109 HEC HHA 1 1 13 24268 3 2 1 HEC HHB H 5.333 -1.536 1.314 1.00 . C A . 109 HEC HHB 1 1 13 24269 3 2 1 HEC HHC H 5.721 3.378 5.410 1.00 . C A . 109 HEC HHC 1 1 13 24270 3 2 1 HEC HHD H 12.180 3.182 4.915 1.00 . C A . 109 HEC HHD 1 1 13 24271 3 2 1 HEC HMA1 H 5.905 -3.666 0.728 1.00 . C A . 109 HEC HMA1 1 1 13 24272 3 2 1 HEC HMA2 H 6.487 -3.029 -0.829 1.00 . C A . 109 HEC HMA2 1 1 13 24273 3 2 1 HEC HMA3 H 7.232 -4.487 -0.129 1.00 . C A . 109 HEC HMA3 1 1 13 24274 3 2 1 HEC HMB1 H 2.346 0.209 2.910 1.00 . C A . 109 HEC HMB1 1 1 13 24275 3 2 1 HEC HMB2 H 3.251 -0.393 1.500 1.00 . C A . 109 HEC HMB2 1 1 13 24276 3 2 1 HEC HMB3 H 3.190 -1.356 2.996 1.00 . C A . 109 HEC HMB3 1 1 13 24277 3 2 1 HEC HMC1 H 6.622 5.261 6.137 1.00 . C A . 109 HEC HMC1 1 1 13 24278 3 2 1 HEC HMC2 H 7.367 4.727 7.663 1.00 . C A . 109 HEC HMC2 1 1 13 24279 3 2 1 HEC HMC3 H 8.105 6.049 6.726 1.00 . C A . 109 HEC HMC3 1 1 13 24280 3 2 1 HEC HMD1 H 14.051 2.761 4.082 1.00 . C A . 109 HEC HMD1 1 1 13 24281 3 2 1 HEC HMD2 H 14.600 1.292 4.924 1.00 . C A . 109 HEC HMD2 1 1 13 24282 3 2 1 HEC HMD3 H 15.039 1.557 3.219 1.00 . C A . 109 HEC HMD3 1 1 13 24283 3 2 1 HEC NA N 8.599 -0.951 2.158 1.00 . C A . 109 HEC NA 1 1 13 24284 3 2 1 HEC NB N 6.718 0.828 3.353 1.00 . C A . 109 HEC NB 1 1 13 24285 3 2 1 HEC NC N 8.898 2.261 4.590 1.00 . C A . 109 HEC NC 1 1 13 24286 3 2 1 HEC ND N 10.750 0.531 3.299 1.00 . C A . 109 HEC ND 1 1 13 24287 3 2 1 HEC O1A O 11.788 -5.315 -1.262 1.00 . C A . 109 HEC O1A 1 1 13 24288 3 2 1 HEC O1D O 17.172 0.330 3.316 1.00 . C A . 109 HEC O1D 1 1 13 24289 3 2 1 HEC O2A O 10.692 -4.958 -3.168 1.00 . C A . 109 HEC O2A 1 1 13 24290 3 2 1 HEC O2D O 16.535 -0.303 1.278 1.00 . C A . 109 HEC O2D 1 1 13 24291 4 2 1 HEC C1A C -8.687 -3.302 0.334 1.00 . D A . 110 HEC C1A 1 1 13 24292 4 2 1 HEC C1B C -4.977 -1.104 0.055 1.00 . D A . 110 HEC C1B 1 1 13 24293 4 2 1 HEC C1C C -2.899 -4.374 1.984 1.00 . D A . 110 HEC C1C 1 1 13 24294 4 2 1 HEC C1D C -6.622 -6.542 2.311 1.00 . D A . 110 HEC C1D 1 1 13 24295 4 2 1 HEC C2A C -9.508 -2.340 -0.363 1.00 . D A . 110 HEC C2A 1 1 13 24296 4 2 1 HEC C2B C -3.824 -0.257 -0.136 1.00 . D A . 110 HEC C2B 1 1 13 24297 4 2 1 HEC C2C C -2.058 -5.389 2.573 1.00 . D A . 110 HEC C2C 1 1 13 24298 4 2 1 HEC C2D C -7.787 -7.358 2.564 1.00 . D A . 110 HEC C2D 1 1 13 24299 4 2 1 HEC C3A C -8.708 -1.308 -0.705 1.00 . D A . 110 HEC C3A 1 1 13 24300 4 2 1 HEC C3B C -2.769 -0.892 0.417 1.00 . D A . 110 HEC C3B 1 1 13 24301 4 2 1 HEC C3C C -2.857 -6.427 2.899 1.00 . D A . 110 HEC C3C 1 1 13 24302 4 2 1 HEC C3D C -8.850 -6.701 2.053 1.00 . D A . 110 HEC C3D 1 1 13 24303 4 2 1 HEC C4A C -7.384 -1.621 -0.222 1.00 . D A . 110 HEC C4A 1 1 13 24304 4 2 1 HEC C4B C -3.259 -2.139 0.956 1.00 . D A . 110 HEC C4B 1 1 13 24305 4 2 1 HEC C4C C -4.201 -6.065 2.515 1.00 . D A . 110 HEC C4C 1 1 13 24306 4 2 1 HEC C4D C -8.354 -5.472 1.479 1.00 . D A . 110 HEC C4D 1 1 13 24307 4 2 1 HEC CAA C -10.976 -2.501 -0.636 1.00 . D A . 110 HEC CAA 1 1 13 24308 4 2 1 HEC CAB C -1.343 -0.429 0.483 1.00 . D A . 110 HEC CAB 1 1 13 24309 4 2 1 HEC CAC C -2.468 -7.727 3.540 1.00 . D A . 110 HEC CAC 1 1 13 24310 4 2 1 HEC CAD C -10.289 -7.127 2.058 1.00 . D A . 110 HEC CAD 1 1 13 24311 4 2 1 HEC CBA C -11.845 -2.481 0.618 1.00 . D A . 110 HEC CBA 1 1 13 24312 4 2 1 HEC CBB C -1.181 1.023 0.926 1.00 . D A . 110 HEC CBB 1 1 13 24313 4 2 1 HEC CBC C -1.181 -7.656 4.357 1.00 . D A . 110 HEC CBC 1 1 13 24314 4 2 1 HEC CBD C -10.872 -7.361 0.667 1.00 . D A . 110 HEC CBD 1 1 13 24315 4 2 1 HEC CGA C -11.638 -1.197 1.409 1.00 . D A . 110 HEC CGA 1 1 13 24316 4 2 1 HEC CGD C -11.697 -8.639 0.627 1.00 . D A . 110 HEC CGD 1 1 13 24317 4 2 1 HEC CHA C -9.158 -4.507 0.845 1.00 . D A . 110 HEC CHA 1 1 13 24318 4 2 1 HEC CHB C -6.260 -0.789 -0.381 1.00 . D A . 110 HEC CHB 1 1 13 24319 4 2 1 HEC CHC C -2.461 -3.090 1.617 1.00 . D A . 110 HEC CHC 1 1 13 24320 4 2 1 HEC CHD C -5.330 -6.886 2.691 1.00 . D A . 110 HEC CHD 1 1 13 24321 4 2 1 HEC CMA C -9.080 -0.056 -1.444 1.00 . D A . 110 HEC CMA 1 1 13 24322 4 2 1 HEC CMB C -3.842 1.076 -0.827 1.00 . D A . 110 HEC CMB 1 1 13 24323 4 2 1 HEC CMC C -0.574 -5.268 2.767 1.00 . D A . 110 HEC CMC 1 1 13 24324 4 2 1 HEC CMD C -7.771 -8.683 3.267 1.00 . D A . 110 HEC CMD 1 1 13 24325 4 2 1 HEC FE FE -5.800 -3.823 1.185 1.00 . D A . 110 HEC FE 1 1 13 24326 4 2 1 HEC HAA1 H -11.317 -1.689 -1.277 1.00 . D A . 110 HEC HAA1 1 1 13 24327 4 2 1 HEC HAA2 H -11.151 -3.455 -1.133 1.00 . D A . 110 HEC HAA2 1 1 13 24328 4 2 1 HEC HAB H -0.793 -1.045 1.194 1.00 . D A . 110 HEC HAB 1 1 13 24329 4 2 1 HEC HAC H -3.260 -8.051 4.215 1.00 . D A . 110 HEC HAC 1 1 13 24330 4 2 1 HEC HAD1 H -10.389 -8.062 2.610 1.00 . D A . 110 HEC HAD1 1 1 13 24331 4 2 1 HEC HAD2 H -10.895 -6.357 2.535 1.00 . D A . 110 HEC HAD2 1 1 13 24332 4 2 1 HEC HBA1 H -12.895 -2.550 0.334 1.00 . D A . 110 HEC HBA1 1 1 13 24333 4 2 1 HEC HBA2 H -11.585 -3.327 1.254 1.00 . D A . 110 HEC HBA2 1 1 13 24334 4 2 1 HEC HBB1 H -1.518 1.128 1.957 1.00 . D A . 110 HEC HBB1 1 1 13 24335 4 2 1 HEC HBB2 H -0.131 1.309 0.856 1.00 . D A . 110 HEC HBB2 1 1 13 24336 4 2 1 HEC HBB3 H -1.777 1.668 0.281 1.00 . D A . 110 HEC HBB3 1 1 13 24337 4 2 1 HEC HBC1 H -1.103 -6.676 4.828 1.00 . D A . 110 HEC HBC1 1 1 13 24338 4 2 1 HEC HBC2 H -1.194 -8.429 5.125 1.00 . D A . 110 HEC HBC2 1 1 13 24339 4 2 1 HEC HBC3 H -0.324 -7.812 3.700 1.00 . D A . 110 HEC HBC3 1 1 13 24340 4 2 1 HEC HBD1 H -11.514 -6.523 0.397 1.00 . D A . 110 HEC HBD1 1 1 13 24341 4 2 1 HEC HBD2 H -10.062 -7.447 -0.057 1.00 . D A . 110 HEC HBD2 1 1 13 24342 4 2 1 HEC HHA H -10.222 -4.723 0.750 1.00 . D A . 110 HEC HHA 1 1 13 24343 4 2 1 HEC HHB H -6.410 0.168 -0.882 1.00 . D A . 110 HEC HHB 1 1 13 24344 4 2 1 HEC HHC H -1.439 -2.803 1.866 1.00 . D A . 110 HEC HHC 1 1 13 24345 4 2 1 HEC HHD H -5.175 -7.859 3.158 1.00 . D A . 110 HEC HHD 1 1 13 24346 4 2 1 HEC HMA1 H -9.106 -0.260 -2.514 1.00 . D A . 110 HEC HMA1 1 1 13 24347 4 2 1 HEC HMA2 H -10.062 0.282 -1.115 1.00 . D A . 110 HEC HMA2 1 1 13 24348 4 2 1 HEC HMA3 H -8.341 0.719 -1.240 1.00 . D A . 110 HEC HMA3 1 1 13 24349 4 2 1 HEC HMB1 H -2.924 1.200 -1.401 1.00 . D A . 110 HEC HMB1 1 1 13 24350 4 2 1 HEC HMB2 H -4.699 1.125 -1.498 1.00 . D A . 110 HEC HMB2 1 1 13 24351 4 2 1 HEC HMB3 H -3.917 1.869 -0.084 1.00 . D A . 110 HEC HMB3 1 1 13 24352 4 2 1 HEC HMC1 H -0.186 -4.482 2.120 1.00 . D A . 110 HEC HMC1 1 1 13 24353 4 2 1 HEC HMC2 H -0.363 -5.021 3.807 1.00 . D A . 110 HEC HMC2 1 1 13 24354 4 2 1 HEC HMC3 H -0.097 -6.215 2.514 1.00 . D A . 110 HEC HMC3 1 1 13 24355 4 2 1 HEC HMD1 H -8.714 -9.200 3.091 1.00 . D A . 110 HEC HMD1 1 1 13 24356 4 2 1 HEC HMD2 H -6.948 -9.288 2.886 1.00 . D A . 110 HEC HMD2 1 1 13 24357 4 2 1 HEC HMD3 H -7.638 -8.525 4.338 1.00 . D A . 110 HEC HMD3 1 1 13 24358 4 2 1 HEC NA N -7.382 -2.849 0.415 1.00 . D A . 110 HEC NA 1 1 13 24359 4 2 1 HEC NB N -4.618 -2.259 0.728 1.00 . D A . 110 HEC NB 1 1 13 24360 4 2 1 HEC NC N -4.216 -4.800 1.953 1.00 . D A . 110 HEC NC 1 1 13 24361 4 2 1 HEC ND N -6.983 -5.385 1.643 1.00 . D A . 110 HEC ND 1 1 13 24362 4 2 1 HEC O1A O -12.664 -0.575 1.760 1.00 . D A . 110 HEC O1A 1 1 13 24363 4 2 1 HEC O1D O -12.941 -8.511 0.617 1.00 . D A . 110 HEC O1D 1 1 13 24364 4 2 1 HEC O2A O -10.458 -0.861 1.646 1.00 . D A . 110 HEC O2A 1 1 13 24365 4 2 1 HEC O2D O -11.070 -9.720 0.606 1.00 . D A . 110 HEC O2D 1 1 13 24366 5 2 1 HEC C1A C -0.096 4.103 -9.284 1.00 . E A . 111 HEC C1A 1 1 13 24367 5 2 1 HEC C1B C -1.350 0.618 -11.510 1.00 . E A . 111 HEC C1B 1 1 13 24368 5 2 1 HEC C1C C -3.171 -1.008 -7.912 1.00 . E A . 111 HEC C1C 1 1 13 24369 5 2 1 HEC C1D C -1.881 2.473 -5.702 1.00 . E A . 111 HEC C1D 1 1 13 24370 5 2 1 HEC C2A C 0.530 4.792 -10.388 1.00 . E A . 111 HEC C2A 1 1 13 24371 5 2 1 HEC C2B C -1.519 -0.545 -12.350 1.00 . E A . 111 HEC C2B 1 1 13 24372 5 2 1 HEC C2C C -3.915 -1.626 -6.839 1.00 . E A . 111 HEC C2C 1 1 13 24373 5 2 1 HEC C2D C -1.397 3.487 -4.794 1.00 . E A . 111 HEC C2D 1 1 13 24374 5 2 1 HEC C3A C 0.356 4.025 -11.484 1.00 . E A . 111 HEC C3A 1 1 13 24375 5 2 1 HEC C3B C -2.123 -1.491 -11.601 1.00 . E A . 111 HEC C3B 1 1 13 24376 5 2 1 HEC C3C C -3.806 -0.817 -5.764 1.00 . E A . 111 HEC C3C 1 1 13 24377 5 2 1 HEC C3D C -0.698 4.377 -5.530 1.00 . E A . 111 HEC C3D 1 1 13 24378 5 2 1 HEC C4A C -0.379 2.853 -11.070 1.00 . E A . 111 HEC C4A 1 1 13 24379 5 2 1 HEC C4B C -2.335 -0.924 -10.290 1.00 . E A . 111 HEC C4B 1 1 13 24380 5 2 1 HEC C4C C -2.994 0.309 -6.160 1.00 . E A . 111 HEC C4C 1 1 13 24381 5 2 1 HEC C4D C -0.741 3.923 -6.900 1.00 . E A . 111 HEC C4D 1 1 13 24382 5 2 1 HEC CAA C 1.233 6.115 -10.287 1.00 . E A . 111 HEC CAA 1 1 13 24383 5 2 1 HEC CAB C -2.519 -2.880 -12.010 1.00 . E A . 111 HEC CAB 1 1 13 24384 5 2 1 HEC CAC C -4.399 -1.011 -4.399 1.00 . E A . 111 HEC CAC 1 1 13 24385 5 2 1 HEC CAD C 0.007 5.615 -5.057 1.00 . E A . 111 HEC CAD 1 1 13 24386 5 2 1 HEC CBA C 2.612 6.136 -10.941 1.00 . E A . 111 HEC CBA 1 1 13 24387 5 2 1 HEC CBB C -1.485 -3.948 -11.663 1.00 . E A . 111 HEC CBB 1 1 13 24388 5 2 1 HEC CBC C -4.201 -2.413 -3.829 1.00 . E A . 111 HEC CBC 1 1 13 24389 5 2 1 HEC CBD C -0.930 6.766 -4.702 1.00 . E A . 111 HEC CBD 1 1 13 24390 5 2 1 HEC CGA C 2.847 7.444 -11.682 1.00 . E A . 111 HEC CGA 1 1 13 24391 5 2 1 HEC CGD C -0.148 8.038 -4.409 1.00 . E A . 111 HEC CGD 1 1 13 24392 5 2 1 HEC CHA C -0.126 4.583 -7.979 1.00 . E A . 111 HEC CHA 1 1 13 24393 5 2 1 HEC CHB C -0.761 1.806 -11.929 1.00 . E A . 111 HEC CHB 1 1 13 24394 5 2 1 HEC CHC C -2.942 -1.601 -9.217 1.00 . E A . 111 HEC CHC 1 1 13 24395 5 2 1 HEC CHD C -2.649 1.380 -5.315 1.00 . E A . 111 HEC CHD 1 1 13 24396 5 2 1 HEC CMA C 0.821 4.297 -12.886 1.00 . E A . 111 HEC CMA 1 1 13 24397 5 2 1 HEC CMB C -1.086 -0.638 -13.785 1.00 . E A . 111 HEC CMB 1 1 13 24398 5 2 1 HEC CMC C -4.656 -2.927 -6.946 1.00 . E A . 111 HEC CMC 1 1 13 24399 5 2 1 HEC CMD C -1.651 3.507 -3.315 1.00 . E A . 111 HEC CMD 1 1 13 24400 5 2 1 HEC FE FE -1.647 1.554 -8.609 1.00 . E A . 111 HEC FE 1 1 13 24401 5 2 1 HEC HAA1 H 0.634 6.883 -10.776 1.00 . E A . 111 HEC HAA1 1 1 13 24402 5 2 1 HEC HAA2 H 1.371 6.374 -9.238 1.00 . E A . 111 HEC HAA2 1 1 13 24403 5 2 1 HEC HAB H -3.447 -3.156 -11.510 1.00 . E A . 111 HEC HAB 1 1 13 24404 5 2 1 HEC HAC H -3.938 -0.312 -3.700 1.00 . E A . 111 HEC HAC 1 1 13 24405 5 2 1 HEC HAD1 H 0.586 5.384 -4.163 1.00 . E A . 111 HEC HAD1 1 1 13 24406 5 2 1 HEC HAD2 H 0.676 5.973 -5.840 1.00 . E A . 111 HEC HAD2 1 1 13 24407 5 2 1 HEC HBA1 H 3.379 6.027 -10.174 1.00 . E A . 111 HEC HBA1 1 1 13 24408 5 2 1 HEC HBA2 H 2.690 5.314 -11.652 1.00 . E A . 111 HEC HBA2 1 1 13 24409 5 2 1 HEC HBB1 H -1.550 -4.183 -10.600 1.00 . E A . 111 HEC HBB1 1 1 13 24410 5 2 1 HEC HBB2 H -1.681 -4.847 -12.247 1.00 . E A . 111 HEC HBB2 1 1 13 24411 5 2 1 HEC HBB3 H -0.487 -3.575 -11.892 1.00 . E A . 111 HEC HBB3 1 1 13 24412 5 2 1 HEC HBC1 H -3.259 -2.823 -4.194 1.00 . E A . 111 HEC HBC1 1 1 13 24413 5 2 1 HEC HBC2 H -4.178 -2.363 -2.740 1.00 . E A . 111 HEC HBC2 1 1 13 24414 5 2 1 HEC HBC3 H -5.024 -3.053 -4.146 1.00 . E A . 111 HEC HBC3 1 1 13 24415 5 2 1 HEC HBD1 H -1.604 6.956 -5.537 1.00 . E A . 111 HEC HBD1 1 1 13 24416 5 2 1 HEC HBD2 H -1.511 6.502 -3.819 1.00 . E A . 111 HEC HBD2 1 1 13 24417 5 2 1 HEC HHA H 0.359 5.537 -7.773 1.00 . E A . 111 HEC HHA 1 1 13 24418 5 2 1 HEC HHB H -0.580 1.939 -12.996 1.00 . E A . 111 HEC HHB 1 1 13 24419 5 2 1 HEC HHC H -3.254 -2.632 -9.385 1.00 . E A . 111 HEC HHC 1 1 13 24420 5 2 1 HEC HHD H -3.009 1.345 -4.287 1.00 . E A . 111 HEC HHD 1 1 13 24421 5 2 1 HEC HMA1 H 1.125 5.340 -12.972 1.00 . E A . 111 HEC HMA1 1 1 13 24422 5 2 1 HEC HMA2 H 1.667 3.651 -13.120 1.00 . E A . 111 HEC HMA2 1 1 13 24423 5 2 1 HEC HMA3 H 0.007 4.096 -13.583 1.00 . E A . 111 HEC HMA3 1 1 13 24424 5 2 1 HEC HMB1 H -0.172 -0.061 -13.927 1.00 . E A . 111 HEC HMB1 1 1 13 24425 5 2 1 HEC HMB2 H -0.901 -1.681 -14.041 1.00 . E A . 111 HEC HMB2 1 1 13 24426 5 2 1 HEC HMB3 H -1.871 -0.239 -14.427 1.00 . E A . 111 HEC HMB3 1 1 13 24427 5 2 1 HEC HMC1 H -5.707 -2.768 -6.702 1.00 . E A . 111 HEC HMC1 1 1 13 24428 5 2 1 HEC HMC2 H -4.573 -3.310 -7.964 1.00 . E A . 111 HEC HMC2 1 1 13 24429 5 2 1 HEC HMC3 H -4.227 -3.648 -6.251 1.00 . E A . 111 HEC HMC3 1 1 13 24430 5 2 1 HEC HMD1 H -1.239 4.421 -2.888 1.00 . E A . 111 HEC HMD1 1 1 13 24431 5 2 1 HEC HMD2 H -2.724 3.470 -3.130 1.00 . E A . 111 HEC HMD2 1 1 13 24432 5 2 1 HEC HMD3 H -1.173 2.643 -2.853 1.00 . E A . 111 HEC HMD3 1 1 13 24433 5 2 1 HEC NA N -0.652 2.912 -9.715 1.00 . E A . 111 HEC NA 1 1 13 24434 5 2 1 HEC NB N -1.855 0.373 -10.245 1.00 . E A . 111 HEC NB 1 1 13 24435 5 2 1 HEC NC N -2.609 0.181 -7.483 1.00 . E A . 111 HEC NC 1 1 13 24436 5 2 1 HEC ND N -1.472 2.751 -6.995 1.00 . E A . 111 HEC ND 1 1 13 24437 5 2 1 HEC O1A O 3.938 8.021 -11.482 1.00 . E A . 111 HEC O1A 1 1 13 24438 5 2 1 HEC O1D O 0.043 8.821 -5.365 1.00 . E A . 111 HEC O1D 1 1 13 24439 5 2 1 HEC O2A O 1.931 7.844 -12.433 1.00 . E A . 111 HEC O2A 1 1 13 24440 5 2 1 HEC O2D O 0.244 8.205 -3.234 1.00 . E A . 111 HEC O2D 1 1 14 24441 1 1 1 ALA C C -0.284 3.144 19.863 1.00 . A A . 1 ALA C 1 1 14 24442 1 1 1 ALA CA C 0.584 1.941 19.486 1.00 . A A . 1 ALA CA 1 1 14 24443 1 1 1 ALA CB C 0.045 0.630 20.061 1.00 . A A . 1 ALA CB 1 1 14 24444 1 1 1 ALA H1 H 2.103 1.593 20.786 1.00 . A A . 1 ALA H1 1 1 14 24445 1 1 1 ALA H2 H 2.598 1.899 19.236 1.00 . A A . 1 ALA H2 1 1 14 24446 1 1 1 ALA HA H 0.623 1.858 18.399 1.00 . A A . 1 ALA HA 1 1 14 24447 1 1 1 ALA HB1 H 0.656 0.329 20.912 1.00 . A A . 1 ALA HB1 1 1 14 24448 1 1 1 ALA HB2 H -0.986 0.772 20.386 1.00 . A A . 1 ALA HB2 1 1 14 24449 1 1 1 ALA HB3 H 0.081 -0.145 19.295 1.00 . A A . 1 ALA HB3 1 1 14 24450 1 1 1 ALA N N 1.939 2.159 19.962 1.00 . A A . 1 ALA N 1 1 14 24451 1 1 1 ALA O O -0.945 3.136 20.900 1.00 . A A . 1 ALA O 1 1 14 24452 1 1 2 PRO C C -2.514 5.141 18.927 1.00 . A A . 2 PRO C 1 1 14 24453 1 1 2 PRO CA C -1.029 5.382 19.206 1.00 . A A . 2 PRO CA 1 1 14 24454 1 1 2 PRO CB C -0.414 6.426 18.288 1.00 . A A . 2 PRO CB 1 1 14 24455 1 1 2 PRO CD C 0.517 4.219 17.738 1.00 . A A . 2 PRO CD 1 1 14 24456 1 1 2 PRO CG C 0.375 5.650 17.245 1.00 . A A . 2 PRO CG 1 1 14 24457 1 1 2 PRO HA H -0.972 5.654 20.167 1.00 . A A . 2 PRO HA 1 1 14 24458 1 1 2 PRO HB2 H -1.185 7.037 17.819 1.00 . A A . 2 PRO HB2 1 1 14 24459 1 1 2 PRO HB3 H 0.235 7.102 18.844 1.00 . A A . 2 PRO HB3 1 1 14 24460 1 1 2 PRO HD2 H 0.133 3.509 17.006 1.00 . A A . 2 PRO HD2 1 1 14 24461 1 1 2 PRO HD3 H 1.562 3.963 17.912 1.00 . A A . 2 PRO HD3 1 1 14 24462 1 1 2 PRO HG2 H -0.138 5.674 16.284 1.00 . A A . 2 PRO HG2 1 1 14 24463 1 1 2 PRO HG3 H 1.355 6.102 17.094 1.00 . A A . 2 PRO HG3 1 1 14 24464 1 1 2 PRO N N -0.253 4.175 18.977 1.00 . A A . 2 PRO N 1 1 14 24465 1 1 2 PRO O O -3.306 4.988 19.855 1.00 . A A . 2 PRO O 1 1 14 24466 1 1 3 LYS C C -4.331 5.085 15.718 1.00 . A A . 3 LYS C 1 1 14 24467 1 1 3 LYS CA C -4.221 4.896 17.232 1.00 . A A . 3 LYS CA 1 1 14 24468 1 1 3 LYS CB C -5.170 5.790 18.033 1.00 . A A . 3 LYS CB 1 1 14 24469 1 1 3 LYS CD C -7.571 6.523 18.277 1.00 . A A . 3 LYS CD 1 1 14 24470 1 1 3 LYS CE C -8.384 5.436 18.982 1.00 . A A . 3 LYS CE 1 1 14 24471 1 1 3 LYS CG C -6.529 5.908 17.340 1.00 . A A . 3 LYS CG 1 1 14 24472 1 1 3 LYS H H -2.195 5.241 16.896 1.00 . A A . 3 LYS H 1 1 14 24473 1 1 3 LYS HA H -4.473 3.863 17.471 1.00 . A A . 3 LYS HA 1 1 14 24474 1 1 3 LYS HB2 H -5.303 5.380 19.035 1.00 . A A . 3 LYS HB2 1 1 14 24475 1 1 3 LYS HB3 H -4.731 6.780 18.151 1.00 . A A . 3 LYS HB3 1 1 14 24476 1 1 3 LYS HD2 H -7.074 7.149 19.018 1.00 . A A . 3 LYS HD2 1 1 14 24477 1 1 3 LYS HD3 H -8.238 7.170 17.708 1.00 . A A . 3 LYS HD3 1 1 14 24478 1 1 3 LYS HE2 H -9.448 5.605 18.819 1.00 . A A . 3 LYS HE2 1 1 14 24479 1 1 3 LYS HE3 H -8.147 4.461 18.555 1.00 . A A . 3 LYS HE3 1 1 14 24480 1 1 3 LYS HG2 H -6.432 6.521 16.444 1.00 . A A . 3 LYS HG2 1 1 14 24481 1 1 3 LYS HG3 H -6.863 4.922 17.016 1.00 . A A . 3 LYS HG3 1 1 14 24482 1 1 3 LYS HZ1 H -8.490 4.621 20.897 1.00 . A A . 3 LYS HZ1 1 1 14 24483 1 1 3 LYS HZ2 H -7.097 5.418 20.621 1.00 . A A . 3 LYS HZ2 1 1 14 24484 1 1 3 LYS N N -2.846 5.116 17.645 1.00 . A A . 3 LYS N 1 1 14 24485 1 1 3 LYS NZ N -8.093 5.431 20.433 1.00 . A A . 3 LYS NZ 1 1 14 24486 1 1 3 LYS O O -3.715 5.989 15.155 1.00 . A A . 3 LYS O 1 1 14 24487 1 1 4 ALA C C -6.025 5.584 13.303 1.00 . A A . 4 ALA C 1 1 14 24488 1 1 4 ALA CA C -5.318 4.276 13.663 1.00 . A A . 4 ALA CA 1 1 14 24489 1 1 4 ALA CB C -6.101 3.045 13.204 1.00 . A A . 4 ALA CB 1 1 14 24490 1 1 4 ALA H H -5.617 3.485 15.566 1.00 . A A . 4 ALA H 1 1 14 24491 1 1 4 ALA HA H -4.335 4.263 13.191 1.00 . A A . 4 ALA HA 1 1 14 24492 1 1 4 ALA HB1 H -6.989 2.927 13.825 1.00 . A A . 4 ALA HB1 1 1 14 24493 1 1 4 ALA HB2 H -6.400 3.171 12.163 1.00 . A A . 4 ALA HB2 1 1 14 24494 1 1 4 ALA HB3 H -5.472 2.159 13.296 1.00 . A A . 4 ALA HB3 1 1 14 24495 1 1 4 ALA N N -5.120 4.217 15.101 1.00 . A A . 4 ALA N 1 1 14 24496 1 1 4 ALA O O -6.902 6.042 14.035 1.00 . A A . 4 ALA O 1 1 14 24497 1 1 5 PRO C C -7.587 7.180 11.101 1.00 . A A . 5 PRO C 1 1 14 24498 1 1 5 PRO CA C -6.190 7.411 11.681 1.00 . A A . 5 PRO CA 1 1 14 24499 1 1 5 PRO CB C -5.204 7.950 10.658 1.00 . A A . 5 PRO CB 1 1 14 24500 1 1 5 PRO CD C -4.571 5.652 11.255 1.00 . A A . 5 PRO CD 1 1 14 24501 1 1 5 PRO CG C -4.341 6.768 10.248 1.00 . A A . 5 PRO CG 1 1 14 24502 1 1 5 PRO HA H -6.314 8.044 12.446 1.00 . A A . 5 PRO HA 1 1 14 24503 1 1 5 PRO HB2 H -5.724 8.371 9.798 1.00 . A A . 5 PRO HB2 1 1 14 24504 1 1 5 PRO HB3 H -4.596 8.748 11.085 1.00 . A A . 5 PRO HB3 1 1 14 24505 1 1 5 PRO HD2 H -4.892 4.734 10.762 1.00 . A A . 5 PRO HD2 1 1 14 24506 1 1 5 PRO HD3 H -3.658 5.418 11.802 1.00 . A A . 5 PRO HD3 1 1 14 24507 1 1 5 PRO HG2 H -4.601 6.435 9.243 1.00 . A A . 5 PRO HG2 1 1 14 24508 1 1 5 PRO HG3 H -3.289 7.052 10.227 1.00 . A A . 5 PRO HG3 1 1 14 24509 1 1 5 PRO N N -5.607 6.165 12.147 1.00 . A A . 5 PRO N 1 1 14 24510 1 1 5 PRO O O -7.932 6.058 10.733 1.00 . A A . 5 PRO O 1 1 14 24511 1 1 6 ALA C C -9.666 7.575 9.105 1.00 . A A . 6 ALA C 1 1 14 24512 1 1 6 ALA CA C -9.704 8.188 10.507 1.00 . A A . 6 ALA CA 1 1 14 24513 1 1 6 ALA CB C -10.331 9.583 10.517 1.00 . A A . 6 ALA CB 1 1 14 24514 1 1 6 ALA H H -8.064 9.168 11.337 1.00 . A A . 6 ALA H 1 1 14 24515 1 1 6 ALA HA H -10.283 7.538 11.163 1.00 . A A . 6 ALA HA 1 1 14 24516 1 1 6 ALA HB1 H -9.620 10.304 10.112 1.00 . A A . 6 ALA HB1 1 1 14 24517 1 1 6 ALA HB2 H -11.233 9.581 9.905 1.00 . A A . 6 ALA HB2 1 1 14 24518 1 1 6 ALA HB3 H -10.586 9.860 11.540 1.00 . A A . 6 ALA HB3 1 1 14 24519 1 1 6 ALA N N -8.353 8.259 11.036 1.00 . A A . 6 ALA N 1 1 14 24520 1 1 6 ALA O O -8.592 7.295 8.575 1.00 . A A . 6 ALA O 1 1 14 24521 1 1 7 ASP C C -10.914 7.931 6.174 1.00 . A A . 7 ASP C 1 1 14 24522 1 1 7 ASP CA C -10.968 6.811 7.215 1.00 . A A . 7 ASP CA 1 1 14 24523 1 1 7 ASP CB C -12.298 6.074 7.048 1.00 . A A . 7 ASP CB 1 1 14 24524 1 1 7 ASP CG C -12.505 5.415 5.683 1.00 . A A . 7 ASP CG 1 1 14 24525 1 1 7 ASP H H -11.721 7.617 8.983 1.00 . A A . 7 ASP H 1 1 14 24526 1 1 7 ASP HA H -10.130 6.120 7.128 1.00 . A A . 7 ASP HA 1 1 14 24527 1 1 7 ASP HB2 H -12.370 5.307 7.819 1.00 . A A . 7 ASP HB2 1 1 14 24528 1 1 7 ASP HB3 H -13.111 6.778 7.222 1.00 . A A . 7 ASP HB3 1 1 14 24529 1 1 7 ASP N N -10.852 7.386 8.545 1.00 . A A . 7 ASP N 1 1 14 24530 1 1 7 ASP O O -10.988 9.109 6.520 1.00 . A A . 7 ASP O 1 1 14 24531 1 1 7 ASP OD1 O -12.927 6.145 4.759 1.00 . A A . 7 ASP OD1 1 1 14 24532 1 1 7 ASP OD2 O -12.237 4.198 5.593 1.00 . A A . 7 ASP OD2 1 1 14 24533 1 1 8 GLY C C -9.288 8.966 3.608 1.00 . A A . 8 GLY C 1 1 14 24534 1 1 8 GLY CA C -10.722 8.478 3.826 1.00 . A A . 8 GLY CA 1 1 14 24535 1 1 8 GLY H H -10.727 6.564 4.647 1.00 . A A . 8 GLY H 1 1 14 24536 1 1 8 GLY HA2 H -11.095 8.016 2.912 1.00 . A A . 8 GLY HA2 1 1 14 24537 1 1 8 GLY HA3 H -11.370 9.328 4.041 1.00 . A A . 8 GLY HA3 1 1 14 24538 1 1 8 GLY N N -10.786 7.524 4.920 1.00 . A A . 8 GLY N 1 1 14 24539 1 1 8 GLY O O -9.067 9.983 2.952 1.00 . A A . 8 GLY O 1 1 14 24540 1 1 9 LEU C C -6.462 8.217 2.637 1.00 . A A . 9 LEU C 1 1 14 24541 1 1 9 LEU CA C -6.944 8.562 4.047 1.00 . A A . 9 LEU CA 1 1 14 24542 1 1 9 LEU CB C -6.129 7.894 5.157 1.00 . A A . 9 LEU CB 1 1 14 24543 1 1 9 LEU CD1 C -4.226 6.448 4.355 1.00 . A A . 9 LEU CD1 1 1 14 24544 1 1 9 LEU CD2 C -4.138 8.963 4.038 1.00 . A A . 9 LEU CD2 1 1 14 24545 1 1 9 LEU CG C -4.620 7.812 4.924 1.00 . A A . 9 LEU CG 1 1 14 24546 1 1 9 LEU H H -8.538 7.393 4.704 1.00 . A A . 9 LEU H 1 1 14 24547 1 1 9 LEU HA H -6.858 9.639 4.188 1.00 . A A . 9 LEU HA 1 1 14 24548 1 1 9 LEU HB2 H -6.305 8.436 6.086 1.00 . A A . 9 LEU HB2 1 1 14 24549 1 1 9 LEU HB3 H -6.510 6.883 5.301 1.00 . A A . 9 LEU HB3 1 1 14 24550 1 1 9 LEU HD11 H -4.872 5.678 4.776 1.00 . A A . 9 LEU HD11 1 1 14 24551 1 1 9 LEU HD12 H -4.336 6.460 3.270 1.00 . A A . 9 LEU HD12 1 1 14 24552 1 1 9 LEU HD13 H -3.189 6.232 4.612 1.00 . A A . 9 LEU HD13 1 1 14 24553 1 1 9 LEU HD21 H -4.812 9.813 4.148 1.00 . A A . 9 LEU HD21 1 1 14 24554 1 1 9 LEU HD22 H -3.132 9.255 4.337 1.00 . A A . 9 LEU HD22 1 1 14 24555 1 1 9 LEU HD23 H -4.128 8.640 2.997 1.00 . A A . 9 LEU HD23 1 1 14 24556 1 1 9 LEU HG H -4.119 7.916 5.886 1.00 . A A . 9 LEU HG 1 1 14 24557 1 1 9 LEU N N -8.351 8.218 4.172 1.00 . A A . 9 LEU N 1 1 14 24558 1 1 9 LEU O O -6.230 7.050 2.325 1.00 . A A . 9 LEU O 1 1 14 24559 1 1 10 LYS C C -4.471 9.664 0.301 1.00 . A A . 10 LYS C 1 1 14 24560 1 1 10 LYS CA C -5.874 9.074 0.453 1.00 . A A . 10 LYS CA 1 1 14 24561 1 1 10 LYS CB C -6.896 9.655 -0.527 1.00 . A A . 10 LYS CB 1 1 14 24562 1 1 10 LYS CD C -7.532 11.780 -1.726 1.00 . A A . 10 LYS CD 1 1 14 24563 1 1 10 LYS CE C -7.415 11.898 -3.247 1.00 . A A . 10 LYS CE 1 1 14 24564 1 1 10 LYS CG C -6.381 10.954 -1.149 1.00 . A A . 10 LYS CG 1 1 14 24565 1 1 10 LYS H H -6.515 10.199 2.085 1.00 . A A . 10 LYS H 1 1 14 24566 1 1 10 LYS HA H -5.820 8.002 0.264 1.00 . A A . 10 LYS HA 1 1 14 24567 1 1 10 LYS HB2 H -7.105 8.929 -1.313 1.00 . A A . 10 LYS HB2 1 1 14 24568 1 1 10 LYS HB3 H -7.836 9.843 -0.009 1.00 . A A . 10 LYS HB3 1 1 14 24569 1 1 10 LYS HD2 H -8.483 11.316 -1.466 1.00 . A A . 10 LYS HD2 1 1 14 24570 1 1 10 LYS HD3 H -7.531 12.774 -1.279 1.00 . A A . 10 LYS HD3 1 1 14 24571 1 1 10 LYS HE2 H -6.665 11.197 -3.615 1.00 . A A . 10 LYS HE2 1 1 14 24572 1 1 10 LYS HE3 H -8.362 11.625 -3.713 1.00 . A A . 10 LYS HE3 1 1 14 24573 1 1 10 LYS HG2 H -5.852 11.538 -0.396 1.00 . A A . 10 LYS HG2 1 1 14 24574 1 1 10 LYS HG3 H -5.663 10.725 -1.937 1.00 . A A . 10 LYS HG3 1 1 14 24575 1 1 10 LYS HZ1 H -7.847 13.896 -3.648 1.00 . A A . 10 LYS HZ1 1 1 14 24576 1 1 10 LYS HZ2 H -6.373 13.684 -2.991 1.00 . A A . 10 LYS HZ2 1 1 14 24577 1 1 10 LYS N N -6.324 9.253 1.823 1.00 . A A . 10 LYS N 1 1 14 24578 1 1 10 LYS NZ N -7.044 13.278 -3.633 1.00 . A A . 10 LYS NZ 1 1 14 24579 1 1 10 LYS O O -4.072 10.534 1.074 1.00 . A A . 10 LYS O 1 1 14 24580 1 1 11 MET C C -2.238 10.013 -2.437 1.00 . A A . 11 MET C 1 1 14 24581 1 1 11 MET CA C -2.410 9.635 -0.965 1.00 . A A . 11 MET CA 1 1 14 24582 1 1 11 MET CB C -1.409 8.537 -0.599 1.00 . A A . 11 MET CB 1 1 14 24583 1 1 11 MET CE C -0.717 5.006 -0.055 1.00 . A A . 11 MET CE 1 1 14 24584 1 1 11 MET CG C -1.777 7.214 -1.273 1.00 . A A . 11 MET CG 1 1 14 24585 1 1 11 MET H H -4.092 8.461 -1.326 1.00 . A A . 11 MET H 1 1 14 24586 1 1 11 MET HA H -2.278 10.517 -0.338 1.00 . A A . 11 MET HA 1 1 14 24587 1 1 11 MET HB2 H -0.407 8.838 -0.902 1.00 . A A . 11 MET HB2 1 1 14 24588 1 1 11 MET HB3 H -1.388 8.405 0.483 1.00 . A A . 11 MET HB3 1 1 14 24589 1 1 11 MET HE1 H 0.151 5.650 0.091 1.00 . A A . 11 MET HE1 1 1 14 24590 1 1 11 MET HE2 H -0.762 4.270 0.748 1.00 . A A . 11 MET HE2 1 1 14 24591 1 1 11 MET HE3 H -0.633 4.494 -1.013 1.00 . A A . 11 MET HE3 1 1 14 24592 1 1 11 MET HG2 H -2.616 7.363 -1.953 1.00 . A A . 11 MET HG2 1 1 14 24593 1 1 11 MET HG3 H -0.940 6.857 -1.874 1.00 . A A . 11 MET HG3 1 1 14 24594 1 1 11 MET N N -3.760 9.168 -0.701 1.00 . A A . 11 MET N 1 1 14 24595 1 1 11 MET O O -2.270 9.148 -3.312 1.00 . A A . 11 MET O 1 1 14 24596 1 1 11 MET SD S -2.202 5.997 -0.038 1.00 . A A . 11 MET SD 1 1 14 24597 1 1 12 GLU C C -0.427 12.224 -4.244 1.00 . A A . 12 GLU C 1 1 14 24598 1 1 12 GLU CA C -1.882 11.809 -4.018 1.00 . A A . 12 GLU CA 1 1 14 24599 1 1 12 GLU CB C -2.835 12.972 -4.299 1.00 . A A . 12 GLU CB 1 1 14 24600 1 1 12 GLU CD C -1.807 14.231 -6.228 1.00 . A A . 12 GLU CD 1 1 14 24601 1 1 12 GLU CG C -2.914 13.266 -5.799 1.00 . A A . 12 GLU CG 1 1 14 24602 1 1 12 GLU H H -2.034 12.002 -1.950 1.00 . A A . 12 GLU H 1 1 14 24603 1 1 12 GLU HA H -2.135 10.975 -4.673 1.00 . A A . 12 GLU HA 1 1 14 24604 1 1 12 GLU HB2 H -3.828 12.734 -3.918 1.00 . A A . 12 GLU HB2 1 1 14 24605 1 1 12 GLU HB3 H -2.495 13.862 -3.768 1.00 . A A . 12 GLU HB3 1 1 14 24606 1 1 12 GLU HG2 H -2.829 12.336 -6.360 1.00 . A A . 12 GLU HG2 1 1 14 24607 1 1 12 GLU HG3 H -3.888 13.695 -6.038 1.00 . A A . 12 GLU HG3 1 1 14 24608 1 1 12 GLU N N -2.059 11.306 -2.667 1.00 . A A . 12 GLU N 1 1 14 24609 1 1 12 GLU O O -0.136 13.406 -4.420 1.00 . A A . 12 GLU O 1 1 14 24610 1 1 12 GLU OE1 O -1.869 15.399 -5.786 1.00 . A A . 12 GLU OE1 1 1 14 24611 1 1 12 GLU OE2 O -0.924 13.779 -6.988 1.00 . A A . 12 GLU OE2 1 1 14 24612 1 1 13 ALA C C 2.220 11.226 -5.898 1.00 . A A . 13 ALA C 1 1 14 24613 1 1 13 ALA CA C 1.865 11.477 -4.431 1.00 . A A . 13 ALA CA 1 1 14 24614 1 1 13 ALA CB C 2.677 10.599 -3.477 1.00 . A A . 13 ALA CB 1 1 14 24615 1 1 13 ALA H H 0.203 10.271 -4.087 1.00 . A A . 13 ALA H 1 1 14 24616 1 1 13 ALA HA H 2.056 12.523 -4.194 1.00 . A A . 13 ALA HA 1 1 14 24617 1 1 13 ALA HB1 H 2.123 9.685 -3.263 1.00 . A A . 13 ALA HB1 1 1 14 24618 1 1 13 ALA HB2 H 3.631 10.345 -3.939 1.00 . A A . 13 ALA HB2 1 1 14 24619 1 1 13 ALA HB3 H 2.856 11.141 -2.548 1.00 . A A . 13 ALA HB3 1 1 14 24620 1 1 13 ALA N N 0.448 11.229 -4.231 1.00 . A A . 13 ALA N 1 1 14 24621 1 1 13 ALA O O 3.298 11.605 -6.354 1.00 . A A . 13 ALA O 1 1 14 24622 1 1 14 THR C C 0.303 10.767 -8.831 1.00 . A A . 14 THR C 1 1 14 24623 1 1 14 THR CA C 1.494 10.281 -8.003 1.00 . A A . 14 THR CA 1 1 14 24624 1 1 14 THR CB C 1.747 8.777 -8.127 1.00 . A A . 14 THR CB 1 1 14 24625 1 1 14 THR CG2 C 2.552 8.219 -6.952 1.00 . A A . 14 THR CG2 1 1 14 24626 1 1 14 THR H H 0.419 10.283 -6.219 1.00 . A A . 14 THR H 1 1 14 24627 1 1 14 THR HA H 2.371 10.827 -8.352 1.00 . A A . 14 THR HA 1 1 14 24628 1 1 14 THR HB H 2.228 8.540 -9.076 1.00 . A A . 14 THR HB 1 1 14 24629 1 1 14 THR HG1 H -0.008 8.597 -7.182 1.00 . A A . 14 THR HG1 1 1 14 24630 1 1 14 THR HG21 H 3.475 8.788 -6.842 1.00 . A A . 14 THR HG21 1 1 14 24631 1 1 14 THR HG22 H 1.964 8.300 -6.038 1.00 . A A . 14 THR HG22 1 1 14 24632 1 1 14 THR HG23 H 2.790 7.172 -7.139 1.00 . A A . 14 THR HG23 1 1 14 24633 1 1 14 THR N N 1.293 10.588 -6.597 1.00 . A A . 14 THR N 1 1 14 24634 1 1 14 THR O O -0.674 11.274 -8.282 1.00 . A A . 14 THR O 1 1 14 24635 1 1 14 THR OG1 O 0.456 8.194 -7.971 1.00 . A A . 14 THR OG1 1 1 14 24636 1 1 15 LYS C C -1.884 10.174 -10.787 1.00 . A A . 15 LYS C 1 1 14 24637 1 1 15 LYS CA C -0.631 11.012 -11.049 1.00 . A A . 15 LYS CA 1 1 14 24638 1 1 15 LYS CB C -0.143 10.953 -12.497 1.00 . A A . 15 LYS CB 1 1 14 24639 1 1 15 LYS CD C -0.437 12.037 -14.755 1.00 . A A . 15 LYS CD 1 1 14 24640 1 1 15 LYS CE C -1.472 12.406 -15.820 1.00 . A A . 15 LYS CE 1 1 14 24641 1 1 15 LYS CG C -1.116 11.672 -13.434 1.00 . A A . 15 LYS CG 1 1 14 24642 1 1 15 LYS H H 1.221 10.182 -10.578 1.00 . A A . 15 LYS H 1 1 14 24643 1 1 15 LYS HA H -0.860 12.054 -10.828 1.00 . A A . 15 LYS HA 1 1 14 24644 1 1 15 LYS HB2 H 0.844 11.409 -12.572 1.00 . A A . 15 LYS HB2 1 1 14 24645 1 1 15 LYS HB3 H -0.037 9.913 -12.807 1.00 . A A . 15 LYS HB3 1 1 14 24646 1 1 15 LYS HD2 H 0.243 12.874 -14.599 1.00 . A A . 15 LYS HD2 1 1 14 24647 1 1 15 LYS HD3 H 0.164 11.197 -15.103 1.00 . A A . 15 LYS HD3 1 1 14 24648 1 1 15 LYS HE2 H -2.386 11.832 -15.661 1.00 . A A . 15 LYS HE2 1 1 14 24649 1 1 15 LYS HE3 H -1.737 13.459 -15.728 1.00 . A A . 15 LYS HE3 1 1 14 24650 1 1 15 LYS HG2 H -1.979 11.034 -13.627 1.00 . A A . 15 LYS HG2 1 1 14 24651 1 1 15 LYS HG3 H -1.490 12.575 -12.951 1.00 . A A . 15 LYS HG3 1 1 14 24652 1 1 15 LYS HZ1 H -0.128 12.708 -17.383 1.00 . A A . 15 LYS HZ1 1 1 14 24653 1 1 15 LYS HZ2 H -0.656 11.171 -17.287 1.00 . A A . 15 LYS HZ2 1 1 14 24654 1 1 15 LYS N N 0.423 10.596 -10.139 1.00 . A A . 15 LYS N 1 1 14 24655 1 1 15 LYS NZ N -0.940 12.138 -17.175 1.00 . A A . 15 LYS NZ 1 1 14 24656 1 1 15 LYS O O -2.961 10.488 -11.291 1.00 . A A . 15 LYS O 1 1 14 24657 1 1 16 GLN C C -2.958 8.133 -8.146 1.00 . A A . 16 GLN C 1 1 14 24658 1 1 16 GLN CA C -2.804 8.239 -9.665 1.00 . A A . 16 GLN CA 1 1 14 24659 1 1 16 GLN CB C -2.608 6.858 -10.293 1.00 . A A . 16 GLN CB 1 1 14 24660 1 1 16 GLN CD C -3.481 6.783 -12.658 1.00 . A A . 16 GLN CD 1 1 14 24661 1 1 16 GLN CG C -2.247 6.976 -11.775 1.00 . A A . 16 GLN CG 1 1 14 24662 1 1 16 GLN H H -0.822 8.876 -9.593 1.00 . A A . 16 GLN H 1 1 14 24663 1 1 16 GLN HA H -3.690 8.705 -10.095 1.00 . A A . 16 GLN HA 1 1 14 24664 1 1 16 GLN HB2 H -1.819 6.322 -9.765 1.00 . A A . 16 GLN HB2 1 1 14 24665 1 1 16 GLN HB3 H -3.520 6.271 -10.183 1.00 . A A . 16 GLN HB3 1 1 14 24666 1 1 16 GLN HE21 H -3.644 4.898 -11.936 1.00 . A A . 16 GLN HE21 1 1 14 24667 1 1 16 GLN HE22 H -4.851 5.356 -13.090 1.00 . A A . 16 GLN HE22 1 1 14 24668 1 1 16 GLN HG2 H -1.806 7.955 -11.969 1.00 . A A . 16 GLN HG2 1 1 14 24669 1 1 16 GLN HG3 H -1.493 6.231 -12.030 1.00 . A A . 16 GLN HG3 1 1 14 24670 1 1 16 GLN N N -1.701 9.124 -9.999 1.00 . A A . 16 GLN N 1 1 14 24671 1 1 16 GLN NE2 N -4.038 5.580 -12.552 1.00 . A A . 16 GLN NE2 1 1 14 24672 1 1 16 GLN O O -2.226 7.389 -7.494 1.00 . A A . 16 GLN O 1 1 14 24673 1 1 16 GLN OE1 O -3.901 7.667 -13.386 1.00 . A A . 16 GLN OE1 1 1 14 24674 1 1 17 PRO C C -4.927 7.632 -5.757 1.00 . A A . 17 PRO C 1 1 14 24675 1 1 17 PRO CA C -4.199 8.908 -6.183 1.00 . A A . 17 PRO CA 1 1 14 24676 1 1 17 PRO CB C -5.012 10.168 -5.931 1.00 . A A . 17 PRO CB 1 1 14 24677 1 1 17 PRO CD C -4.826 9.800 -8.353 1.00 . A A . 17 PRO CD 1 1 14 24678 1 1 17 PRO CG C -5.572 10.580 -7.282 1.00 . A A . 17 PRO CG 1 1 14 24679 1 1 17 PRO HA H -3.338 8.915 -5.674 1.00 . A A . 17 PRO HA 1 1 14 24680 1 1 17 PRO HB2 H -5.814 9.979 -5.217 1.00 . A A . 17 PRO HB2 1 1 14 24681 1 1 17 PRO HB3 H -4.389 10.957 -5.509 1.00 . A A . 17 PRO HB3 1 1 14 24682 1 1 17 PRO HD2 H -5.514 9.240 -8.987 1.00 . A A . 17 PRO HD2 1 1 14 24683 1 1 17 PRO HD3 H -4.262 10.466 -9.007 1.00 . A A . 17 PRO HD3 1 1 14 24684 1 1 17 PRO HG2 H -6.641 10.370 -7.333 1.00 . A A . 17 PRO HG2 1 1 14 24685 1 1 17 PRO HG3 H -5.450 11.652 -7.436 1.00 . A A . 17 PRO HG3 1 1 14 24686 1 1 17 PRO N N -3.940 8.908 -7.612 1.00 . A A . 17 PRO N 1 1 14 24687 1 1 17 PRO O O -5.484 6.922 -6.594 1.00 . A A . 17 PRO O 1 1 14 24688 1 1 18 VAL C C -6.124 6.533 -2.531 1.00 . A A . 18 VAL C 1 1 14 24689 1 1 18 VAL CA C -5.551 6.200 -3.910 1.00 . A A . 18 VAL CA 1 1 14 24690 1 1 18 VAL CB C -4.569 5.027 -3.882 1.00 . A A . 18 VAL CB 1 1 14 24691 1 1 18 VAL CG1 C -5.166 3.831 -3.137 1.00 . A A . 18 VAL CG1 1 1 14 24692 1 1 18 VAL CG2 C -4.143 4.634 -5.298 1.00 . A A . 18 VAL CG2 1 1 14 24693 1 1 18 VAL H H -4.446 7.962 -3.783 1.00 . A A . 18 VAL H 1 1 14 24694 1 1 18 VAL HA H -6.371 5.938 -4.578 1.00 . A A . 18 VAL HA 1 1 14 24695 1 1 18 VAL HB H -3.679 5.348 -3.341 1.00 . A A . 18 VAL HB 1 1 14 24696 1 1 18 VAL HG11 H -6.167 3.629 -3.517 1.00 . A A . 18 VAL HG11 1 1 14 24697 1 1 18 VAL HG12 H -4.535 2.955 -3.291 1.00 . A A . 18 VAL HG12 1 1 14 24698 1 1 18 VAL HG13 H -5.220 4.056 -2.072 1.00 . A A . 18 VAL HG13 1 1 14 24699 1 1 18 VAL HG21 H -4.943 4.877 -5.998 1.00 . A A . 18 VAL HG21 1 1 14 24700 1 1 18 VAL HG22 H -3.241 5.181 -5.571 1.00 . A A . 18 VAL HG22 1 1 14 24701 1 1 18 VAL HG23 H -3.943 3.563 -5.333 1.00 . A A . 18 VAL HG23 1 1 14 24702 1 1 18 VAL N N -4.900 7.379 -4.457 1.00 . A A . 18 VAL N 1 1 14 24703 1 1 18 VAL O O -5.617 7.415 -1.840 1.00 . A A . 18 VAL O 1 1 14 24704 1 1 19 VAL C C -7.736 4.730 -0.064 1.00 . A A . 19 VAL C 1 1 14 24705 1 1 19 VAL CA C -7.823 6.016 -0.889 1.00 . A A . 19 VAL CA 1 1 14 24706 1 1 19 VAL CB C -9.260 6.495 -1.100 1.00 . A A . 19 VAL CB 1 1 14 24707 1 1 19 VAL CG1 C -10.058 6.428 0.204 1.00 . A A . 19 VAL CG1 1 1 14 24708 1 1 19 VAL CG2 C -9.287 7.908 -1.686 1.00 . A A . 19 VAL CG2 1 1 14 24709 1 1 19 VAL H H -7.581 5.093 -2.740 1.00 . A A . 19 VAL H 1 1 14 24710 1 1 19 VAL HA H -7.278 6.804 -0.368 1.00 . A A . 19 VAL HA 1 1 14 24711 1 1 19 VAL HB H -9.735 5.826 -1.818 1.00 . A A . 19 VAL HB 1 1 14 24712 1 1 19 VAL HG11 H -9.453 6.820 1.021 1.00 . A A . 19 VAL HG11 1 1 14 24713 1 1 19 VAL HG12 H -10.966 7.023 0.106 1.00 . A A . 19 VAL HG12 1 1 14 24714 1 1 19 VAL HG13 H -10.324 5.392 0.414 1.00 . A A . 19 VAL HG13 1 1 14 24715 1 1 19 VAL HG21 H -8.485 8.013 -2.418 1.00 . A A . 19 VAL HG21 1 1 14 24716 1 1 19 VAL HG22 H -10.247 8.082 -2.172 1.00 . A A . 19 VAL HG22 1 1 14 24717 1 1 19 VAL HG23 H -9.147 8.636 -0.887 1.00 . A A . 19 VAL HG23 1 1 14 24718 1 1 19 VAL N N -7.174 5.809 -2.172 1.00 . A A . 19 VAL N 1 1 14 24719 1 1 19 VAL O O -8.314 3.710 -0.437 1.00 . A A . 19 VAL O 1 1 14 24720 1 1 20 PHE C C -7.849 3.715 3.070 1.00 . A A . 20 PHE C 1 1 14 24721 1 1 20 PHE CA C -6.841 3.677 1.920 1.00 . A A . 20 PHE CA 1 1 14 24722 1 1 20 PHE CB C -5.427 3.791 2.493 1.00 . A A . 20 PHE CB 1 1 14 24723 1 1 20 PHE CD1 C -4.931 1.326 2.679 1.00 . A A . 20 PHE CD1 1 1 14 24724 1 1 20 PHE CD2 C -4.615 2.695 4.613 1.00 . A A . 20 PHE CD2 1 1 14 24725 1 1 20 PHE CE1 C -4.507 0.171 3.426 1.00 . A A . 20 PHE CE1 1 1 14 24726 1 1 20 PHE CE2 C -4.190 1.539 5.360 1.00 . A A . 20 PHE CE2 1 1 14 24727 1 1 20 PHE CG C -4.976 2.564 3.287 1.00 . A A . 20 PHE CG 1 1 14 24728 1 1 20 PHE CZ C -4.157 0.335 4.730 1.00 . A A . 20 PHE CZ 1 1 14 24729 1 1 20 PHE H H -6.545 5.654 1.337 1.00 . A A . 20 PHE H 1 1 14 24730 1 1 20 PHE HA H -7.006 2.773 1.333 1.00 . A A . 20 PHE HA 1 1 14 24731 1 1 20 PHE HB2 H -4.727 3.959 1.674 1.00 . A A . 20 PHE HB2 1 1 14 24732 1 1 20 PHE HB3 H -5.378 4.668 3.139 1.00 . A A . 20 PHE HB3 1 1 14 24733 1 1 20 PHE HD1 H -5.217 1.223 1.632 1.00 . A A . 20 PHE HD1 1 1 14 24734 1 1 20 PHE HD2 H -4.650 3.672 5.094 1.00 . A A . 20 PHE HD2 1 1 14 24735 1 1 20 PHE HE1 H -4.467 -0.812 2.958 1.00 . A A . 20 PHE HE1 1 1 14 24736 1 1 20 PHE HE2 H -3.902 1.629 6.408 1.00 . A A . 20 PHE HE2 1 1 14 24737 1 1 20 PHE HZ H -3.836 -0.503 5.400 1.00 . A A . 20 PHE HZ 1 1 14 24738 1 1 20 PHE N N -7.011 4.821 1.041 1.00 . A A . 20 PHE N 1 1 14 24739 1 1 20 PHE O O -8.613 4.671 3.200 1.00 . A A . 20 PHE O 1 1 14 24740 1 1 21 ASN C C -8.076 1.702 6.097 1.00 . A A . 21 ASN C 1 1 14 24741 1 1 21 ASN CA C -8.721 2.566 5.012 1.00 . A A . 21 ASN CA 1 1 14 24742 1 1 21 ASN CB C -10.043 1.909 4.609 1.00 . A A . 21 ASN CB 1 1 14 24743 1 1 21 ASN CG C -10.564 2.487 3.292 1.00 . A A . 21 ASN CG 1 1 14 24744 1 1 21 ASN H H -7.195 1.891 3.765 1.00 . A A . 21 ASN H 1 1 14 24745 1 1 21 ASN HA H -8.884 3.593 5.338 1.00 . A A . 21 ASN HA 1 1 14 24746 1 1 21 ASN HB2 H -9.903 0.833 4.509 1.00 . A A . 21 ASN HB2 1 1 14 24747 1 1 21 ASN HB3 H -10.783 2.062 5.395 1.00 . A A . 21 ASN HB3 1 1 14 24748 1 1 21 ASN HD21 H -11.080 4.171 4.288 1.00 . A A . 21 ASN HD21 1 1 14 24749 1 1 21 ASN HD22 H -11.433 4.176 2.592 1.00 . A A . 21 ASN HD22 1 1 14 24750 1 1 21 ASN N N -7.819 2.664 3.877 1.00 . A A . 21 ASN N 1 1 14 24751 1 1 21 ASN ND2 N -11.067 3.713 3.400 1.00 . A A . 21 ASN ND2 1 1 14 24752 1 1 21 ASN O O -7.426 0.702 5.795 1.00 . A A . 21 ASN O 1 1 14 24753 1 1 21 ASN OD1 O -10.511 1.860 2.246 1.00 . A A . 21 ASN OD1 1 1 14 24754 1 1 22 HIS C C -8.814 0.551 9.124 1.00 . A A . 22 HIS C 1 1 14 24755 1 1 22 HIS CA C -7.721 1.398 8.470 1.00 . A A . 22 HIS CA 1 1 14 24756 1 1 22 HIS CB C -7.050 2.361 9.453 1.00 . A A . 22 HIS CB 1 1 14 24757 1 1 22 HIS CD2 C -4.459 2.022 9.416 1.00 . A A . 22 HIS CD2 1 1 14 24758 1 1 22 HIS CE1 C -3.929 3.799 8.255 1.00 . A A . 22 HIS CE1 1 1 14 24759 1 1 22 HIS CG C -5.614 2.681 9.114 1.00 . A A . 22 HIS CG 1 1 14 24760 1 1 22 HIS H H -8.806 2.935 7.575 1.00 . A A . 22 HIS H 1 1 14 24761 1 1 22 HIS HA H -6.950 0.738 8.073 1.00 . A A . 22 HIS HA 1 1 14 24762 1 1 22 HIS HB2 H -7.621 3.289 9.484 1.00 . A A . 22 HIS HB2 1 1 14 24763 1 1 22 HIS HB3 H -7.090 1.929 10.453 1.00 . A A . 22 HIS HB3 1 1 14 24764 1 1 22 HIS HD1 H -5.872 4.486 8.013 1.00 . A A . 22 HIS HD1 1 1 14 24765 1 1 22 HIS HD2 H -4.384 1.097 9.987 1.00 . A A . 22 HIS HD2 1 1 14 24766 1 1 22 HIS HE1 H -3.337 4.549 7.730 1.00 . A A . 22 HIS HE1 1 1 14 24767 1 1 22 HIS N N -8.276 2.121 7.338 1.00 . A A . 22 HIS N 1 1 14 24768 1 1 22 HIS ND1 N -5.247 3.797 8.383 1.00 . A A . 22 HIS ND1 1 1 14 24769 1 1 22 HIS NE2 N -3.442 2.697 8.895 1.00 . A A . 22 HIS NE2 1 1 14 24770 1 1 22 HIS O O -8.519 -0.402 9.844 1.00 . A A . 22 HIS O 1 1 14 24771 1 1 23 SER C C -11.469 -1.047 8.580 1.00 . A A . 23 SER C 1 1 14 24772 1 1 23 SER CA C -11.193 0.214 9.402 1.00 . A A . 23 SER CA 1 1 14 24773 1 1 23 SER CB C -12.436 1.105 9.440 1.00 . A A . 23 SER CB 1 1 14 24774 1 1 23 SER H H -10.286 1.703 8.262 1.00 . A A . 23 SER H 1 1 14 24775 1 1 23 SER HA H -10.903 -0.049 10.419 1.00 . A A . 23 SER HA 1 1 14 24776 1 1 23 SER HB2 H -12.151 2.135 9.222 1.00 . A A . 23 SER HB2 1 1 14 24777 1 1 23 SER HB3 H -13.129 0.795 8.659 1.00 . A A . 23 SER HB3 1 1 14 24778 1 1 23 SER HG H -14.083 1.044 10.575 1.00 . A A . 23 SER HG 1 1 14 24779 1 1 23 SER N N -10.054 0.927 8.849 1.00 . A A . 23 SER N 1 1 14 24780 1 1 23 SER O O -12.347 -1.837 8.925 1.00 . A A . 23 SER O 1 1 14 24781 1 1 23 SER OG O -13.092 1.052 10.704 1.00 . A A . 23 SER OG 1 1 14 24782 1 1 24 THR C C -9.731 -3.354 6.880 1.00 . A A . 24 THR C 1 1 14 24783 1 1 24 THR CA C -10.856 -2.347 6.635 1.00 . A A . 24 THR CA 1 1 14 24784 1 1 24 THR CB C -10.915 -1.841 5.192 1.00 . A A . 24 THR CB 1 1 14 24785 1 1 24 THR CG2 C -11.061 -2.978 4.179 1.00 . A A . 24 THR CG2 1 1 14 24786 1 1 24 THR H H -9.993 -0.549 7.235 1.00 . A A . 24 THR H 1 1 14 24787 1 1 24 THR HA H -11.792 -2.847 6.884 1.00 . A A . 24 THR HA 1 1 14 24788 1 1 24 THR HB H -10.049 -1.222 4.961 1.00 . A A . 24 THR HB 1 1 14 24789 1 1 24 THR HG1 H -12.003 -0.191 4.873 1.00 . A A . 24 THR HG1 1 1 14 24790 1 1 24 THR HG21 H -10.307 -3.739 4.375 1.00 . A A . 24 THR HG21 1 1 14 24791 1 1 24 THR HG22 H -12.054 -3.419 4.268 1.00 . A A . 24 THR HG22 1 1 14 24792 1 1 24 THR HG23 H -10.928 -2.585 3.171 1.00 . A A . 24 THR HG23 1 1 14 24793 1 1 24 THR N N -10.704 -1.196 7.509 1.00 . A A . 24 THR N 1 1 14 24794 1 1 24 THR O O -9.938 -4.562 6.766 1.00 . A A . 24 THR O 1 1 14 24795 1 1 24 THR OG1 O -12.159 -1.148 5.118 1.00 . A A . 24 THR OG1 1 1 14 24796 1 1 25 HIS C C -7.228 -3.832 8.982 1.00 . A A . 25 HIS C 1 1 14 24797 1 1 25 HIS CA C -7.406 -3.658 7.473 1.00 . A A . 25 HIS CA 1 1 14 24798 1 1 25 HIS CB C -6.160 -3.090 6.791 1.00 . A A . 25 HIS CB 1 1 14 24799 1 1 25 HIS CD2 C -5.773 -3.710 4.281 1.00 . A A . 25 HIS CD2 1 1 14 24800 1 1 25 HIS CE1 C -6.938 -2.093 3.377 1.00 . A A . 25 HIS CE1 1 1 14 24801 1 1 25 HIS CG C -6.288 -2.953 5.292 1.00 . A A . 25 HIS CG 1 1 14 24802 1 1 25 HIS H H -8.404 -1.838 7.302 1.00 . A A . 25 HIS H 1 1 14 24803 1 1 25 HIS HA H -7.615 -4.630 7.026 1.00 . A A . 25 HIS HA 1 1 14 24804 1 1 25 HIS HB2 H -5.939 -2.111 7.217 1.00 . A A . 25 HIS HB2 1 1 14 24805 1 1 25 HIS HB3 H -5.310 -3.734 7.015 1.00 . A A . 25 HIS HB3 1 1 14 24806 1 1 25 HIS HD1 H -7.518 -1.219 5.168 1.00 . A A . 25 HIS HD1 1 1 14 24807 1 1 25 HIS HD2 H -5.145 -4.592 4.402 1.00 . A A . 25 HIS HD2 1 1 14 24808 1 1 25 HIS HE1 H -7.406 -1.453 2.630 1.00 . A A . 25 HIS HE1 1 1 14 24809 1 1 25 HIS N N -8.564 -2.821 7.211 1.00 . A A . 25 HIS N 1 1 14 24810 1 1 25 HIS ND1 N -7.017 -1.942 4.691 1.00 . A A . 25 HIS ND1 1 1 14 24811 1 1 25 HIS NE2 N -6.167 -3.189 3.125 1.00 . A A . 25 HIS NE2 1 1 14 24812 1 1 25 HIS O O -6.103 -3.914 9.473 1.00 . A A . 25 HIS O 1 1 14 24813 1 1 26 LYS C C -7.804 -5.436 11.467 1.00 . A A . 26 LYS C 1 1 14 24814 1 1 26 LYS CA C -8.339 -4.045 11.120 1.00 . A A . 26 LYS CA 1 1 14 24815 1 1 26 LYS CB C -9.720 -3.754 11.708 1.00 . A A . 26 LYS CB 1 1 14 24816 1 1 26 LYS CD C -11.651 -2.132 11.765 1.00 . A A . 26 LYS CD 1 1 14 24817 1 1 26 LYS CE C -11.643 -1.553 13.180 1.00 . A A . 26 LYS CE 1 1 14 24818 1 1 26 LYS CG C -10.226 -2.379 11.266 1.00 . A A . 26 LYS CG 1 1 14 24819 1 1 26 LYS H H -9.266 -3.816 9.269 1.00 . A A . 26 LYS H 1 1 14 24820 1 1 26 LYS HA H -7.653 -3.301 11.524 1.00 . A A . 26 LYS HA 1 1 14 24821 1 1 26 LYS HB2 H -10.425 -4.523 11.392 1.00 . A A . 26 LYS HB2 1 1 14 24822 1 1 26 LYS HB3 H -9.673 -3.795 12.797 1.00 . A A . 26 LYS HB3 1 1 14 24823 1 1 26 LYS HD2 H -12.163 -1.446 11.090 1.00 . A A . 26 LYS HD2 1 1 14 24824 1 1 26 LYS HD3 H -12.211 -3.067 11.754 1.00 . A A . 26 LYS HD3 1 1 14 24825 1 1 26 LYS HE2 H -10.858 -2.026 13.769 1.00 . A A . 26 LYS HE2 1 1 14 24826 1 1 26 LYS HE3 H -11.415 -0.487 13.142 1.00 . A A . 26 LYS HE3 1 1 14 24827 1 1 26 LYS HG2 H -9.563 -1.603 11.649 1.00 . A A . 26 LYS HG2 1 1 14 24828 1 1 26 LYS HG3 H -10.201 -2.312 10.178 1.00 . A A . 26 LYS HG3 1 1 14 24829 1 1 26 LYS HZ1 H -12.856 -2.054 14.799 1.00 . A A . 26 LYS HZ1 1 1 14 24830 1 1 26 LYS HZ2 H -13.516 -0.917 13.838 1.00 . A A . 26 LYS HZ2 1 1 14 24831 1 1 26 LYS N N -8.355 -3.883 9.676 1.00 . A A . 26 LYS N 1 1 14 24832 1 1 26 LYS NZ N -12.955 -1.762 13.833 1.00 . A A . 26 LYS NZ 1 1 14 24833 1 1 26 LYS O O -7.055 -5.595 12.430 1.00 . A A . 26 LYS O 1 1 14 24834 1 1 27 SER C C -6.311 -7.937 10.474 1.00 . A A . 27 SER C 1 1 14 24835 1 1 27 SER CA C -7.780 -7.781 10.873 1.00 . A A . 27 SER CA 1 1 14 24836 1 1 27 SER CB C -8.651 -8.757 10.080 1.00 . A A . 27 SER CB 1 1 14 24837 1 1 27 SER H H -8.818 -6.271 9.882 1.00 . A A . 27 SER H 1 1 14 24838 1 1 27 SER HA H -7.909 -7.963 11.939 1.00 . A A . 27 SER HA 1 1 14 24839 1 1 27 SER HB2 H -8.382 -9.780 10.345 1.00 . A A . 27 SER HB2 1 1 14 24840 1 1 27 SER HB3 H -9.696 -8.620 10.360 1.00 . A A . 27 SER HB3 1 1 14 24841 1 1 27 SER HG H -7.547 -8.451 8.440 1.00 . A A . 27 SER HG 1 1 14 24842 1 1 27 SER N N -8.209 -6.408 10.663 1.00 . A A . 27 SER N 1 1 14 24843 1 1 27 SER O O -5.687 -8.953 10.776 1.00 . A A . 27 SER O 1 1 14 24844 1 1 27 SER OG O -8.510 -8.578 8.674 1.00 . A A . 27 SER OG 1 1 14 24845 1 1 28 VAL C C -3.531 -6.333 10.455 1.00 . A A . 28 VAL C 1 1 14 24846 1 1 28 VAL CA C -4.418 -6.926 9.359 1.00 . A A . 28 VAL CA 1 1 14 24847 1 1 28 VAL CB C -4.290 -6.189 8.024 1.00 . A A . 28 VAL CB 1 1 14 24848 1 1 28 VAL CG1 C -2.869 -6.303 7.469 1.00 . A A . 28 VAL CG1 1 1 14 24849 1 1 28 VAL CG2 C -5.317 -6.705 7.013 1.00 . A A . 28 VAL CG2 1 1 14 24850 1 1 28 VAL H H -6.316 -6.092 9.561 1.00 . A A . 28 VAL H 1 1 14 24851 1 1 28 VAL HA H -4.132 -7.965 9.199 1.00 . A A . 28 VAL HA 1 1 14 24852 1 1 28 VAL HB H -4.497 -5.134 8.202 1.00 . A A . 28 VAL HB 1 1 14 24853 1 1 28 VAL HG11 H -2.609 -7.355 7.350 1.00 . A A . 28 VAL HG11 1 1 14 24854 1 1 28 VAL HG12 H -2.816 -5.804 6.501 1.00 . A A . 28 VAL HG12 1 1 14 24855 1 1 28 VAL HG13 H -2.170 -5.832 8.160 1.00 . A A . 28 VAL HG13 1 1 14 24856 1 1 28 VAL HG21 H -5.348 -7.794 7.050 1.00 . A A . 28 VAL HG21 1 1 14 24857 1 1 28 VAL HG22 H -6.301 -6.305 7.258 1.00 . A A . 28 VAL HG22 1 1 14 24858 1 1 28 VAL HG23 H -5.033 -6.383 6.011 1.00 . A A . 28 VAL HG23 1 1 14 24859 1 1 28 VAL N N -5.802 -6.915 9.802 1.00 . A A . 28 VAL N 1 1 14 24860 1 1 28 VAL O O -3.898 -5.345 11.089 1.00 . A A . 28 VAL O 1 1 14 24861 1 1 29 LYS C C -0.843 -5.167 11.226 1.00 . A A . 29 LYS C 1 1 14 24862 1 1 29 LYS CA C -1.438 -6.510 11.655 1.00 . A A . 29 LYS CA 1 1 14 24863 1 1 29 LYS CB C -0.388 -7.588 11.929 1.00 . A A . 29 LYS CB 1 1 14 24864 1 1 29 LYS CD C 0.913 -8.429 13.920 1.00 . A A . 29 LYS CD 1 1 14 24865 1 1 29 LYS CE C 1.243 -7.586 15.154 1.00 . A A . 29 LYS CE 1 1 14 24866 1 1 29 LYS CG C -0.474 -8.083 13.375 1.00 . A A . 29 LYS CG 1 1 14 24867 1 1 29 LYS H H -2.089 -7.765 10.125 1.00 . A A . 29 LYS H 1 1 14 24868 1 1 29 LYS HA H -1.996 -6.361 12.579 1.00 . A A . 29 LYS HA 1 1 14 24869 1 1 29 LYS HB2 H -0.533 -8.425 11.246 1.00 . A A . 29 LYS HB2 1 1 14 24870 1 1 29 LYS HB3 H 0.608 -7.189 11.736 1.00 . A A . 29 LYS HB3 1 1 14 24871 1 1 29 LYS HD2 H 0.954 -9.487 14.176 1.00 . A A . 29 LYS HD2 1 1 14 24872 1 1 29 LYS HD3 H 1.664 -8.259 13.148 1.00 . A A . 29 LYS HD3 1 1 14 24873 1 1 29 LYS HE2 H 1.930 -6.785 14.881 1.00 . A A . 29 LYS HE2 1 1 14 24874 1 1 29 LYS HE3 H 0.336 -7.114 15.532 1.00 . A A . 29 LYS HE3 1 1 14 24875 1 1 29 LYS HG2 H -0.933 -7.316 13.998 1.00 . A A . 29 LYS HG2 1 1 14 24876 1 1 29 LYS HG3 H -1.118 -8.961 13.424 1.00 . A A . 29 LYS HG3 1 1 14 24877 1 1 29 LYS HZ1 H 2.583 -9.025 15.845 1.00 . A A . 29 LYS HZ1 1 1 14 24878 1 1 29 LYS HZ2 H 2.260 -7.872 16.950 1.00 . A A . 29 LYS HZ2 1 1 14 24879 1 1 29 LYS N N -2.380 -6.962 10.646 1.00 . A A . 29 LYS N 1 1 14 24880 1 1 29 LYS NZ N 1.848 -8.429 16.209 1.00 . A A . 29 LYS NZ 1 1 14 24881 1 1 29 LYS O O -0.523 -4.972 10.055 1.00 . A A . 29 LYS O 1 1 14 24882 1 1 30 CYS C C 1.266 -3.128 11.415 1.00 . A A . 30 CYS C 1 1 14 24883 1 1 30 CYS CA C -0.163 -2.957 11.936 1.00 . A A . 30 CYS CA 1 1 14 24884 1 1 30 CYS CB C -0.215 -2.066 13.178 1.00 . A A . 30 CYS CB 1 1 14 24885 1 1 30 CYS H H -0.976 -4.443 13.149 1.00 . A A . 30 CYS H 1 1 14 24886 1 1 30 CYS HA H -0.799 -2.498 11.179 1.00 . A A . 30 CYS HA 1 1 14 24887 1 1 30 CYS HB2 H 0.604 -2.343 13.842 1.00 . A A . 30 CYS HB2 1 1 14 24888 1 1 30 CYS HB3 H -0.042 -1.033 12.874 1.00 . A A . 30 CYS HB3 1 1 14 24889 1 1 30 CYS N N -0.713 -4.276 12.198 1.00 . A A . 30 CYS N 1 1 14 24890 1 1 30 CYS O O 1.752 -2.302 10.644 1.00 . A A . 30 CYS O 1 1 14 24891 1 1 30 CYS SG S -1.784 -2.146 14.116 1.00 . A A . 30 CYS SG 1 1 14 24892 1 1 31 GLY C C 3.287 -5.183 10.080 1.00 . A A . 31 GLY C 1 1 14 24893 1 1 31 GLY CA C 3.261 -4.494 11.445 1.00 . A A . 31 GLY CA 1 1 14 24894 1 1 31 GLY H H 1.495 -4.872 12.484 1.00 . A A . 31 GLY H 1 1 14 24895 1 1 31 GLY HA2 H 3.835 -3.569 11.400 1.00 . A A . 31 GLY HA2 1 1 14 24896 1 1 31 GLY HA3 H 3.742 -5.131 12.188 1.00 . A A . 31 GLY HA3 1 1 14 24897 1 1 31 GLY N N 1.898 -4.205 11.857 1.00 . A A . 31 GLY N 1 1 14 24898 1 1 31 GLY O O 4.356 -5.500 9.561 1.00 . A A . 31 GLY O 1 1 14 24899 1 1 32 ASP C C 2.188 -5.008 7.137 1.00 . A A . 32 ASP C 1 1 14 24900 1 1 32 ASP CA C 1.970 -6.043 8.242 1.00 . A A . 32 ASP CA 1 1 14 24901 1 1 32 ASP CB C 0.574 -6.642 8.061 1.00 . A A . 32 ASP CB 1 1 14 24902 1 1 32 ASP CG C 0.430 -7.598 6.875 1.00 . A A . 32 ASP CG 1 1 14 24903 1 1 32 ASP H H 1.232 -5.135 9.966 1.00 . A A . 32 ASP H 1 1 14 24904 1 1 32 ASP HA H 2.729 -6.825 8.237 1.00 . A A . 32 ASP HA 1 1 14 24905 1 1 32 ASP HB2 H 0.302 -7.174 8.972 1.00 . A A . 32 ASP HB2 1 1 14 24906 1 1 32 ASP HB3 H -0.142 -5.828 7.941 1.00 . A A . 32 ASP HB3 1 1 14 24907 1 1 32 ASP N N 2.097 -5.396 9.537 1.00 . A A . 32 ASP N 1 1 14 24908 1 1 32 ASP O O 2.593 -5.354 6.028 1.00 . A A . 32 ASP O 1 1 14 24909 1 1 32 ASP OD1 O 1.021 -7.285 5.819 1.00 . A A . 32 ASP OD1 1 1 14 24910 1 1 32 ASP OD2 O -0.269 -8.619 7.051 1.00 . A A . 32 ASP OD2 1 1 14 24911 1 1 33 CYS C C 3.207 -1.771 7.013 1.00 . A A . 33 CYS C 1 1 14 24912 1 1 33 CYS CA C 2.069 -2.670 6.527 1.00 . A A . 33 CYS CA 1 1 14 24913 1 1 33 CYS CB C 0.767 -1.890 6.336 1.00 . A A . 33 CYS CB 1 1 14 24914 1 1 33 CYS H H 1.580 -3.484 8.381 1.00 . A A . 33 CYS H 1 1 14 24915 1 1 33 CYS HA H 2.318 -3.126 5.568 1.00 . A A . 33 CYS HA 1 1 14 24916 1 1 33 CYS HB2 H 0.182 -1.913 7.255 1.00 . A A . 33 CYS HB2 1 1 14 24917 1 1 33 CYS HB3 H 0.988 -0.843 6.125 1.00 . A A . 33 CYS HB3 1 1 14 24918 1 1 33 CYS N N 1.909 -3.758 7.477 1.00 . A A . 33 CYS N 1 1 14 24919 1 1 33 CYS O O 4.162 -1.520 6.279 1.00 . A A . 33 CYS O 1 1 14 24920 1 1 33 CYS SG S -0.200 -2.613 4.961 1.00 . A A . 33 CYS SG 1 1 14 24921 1 1 34 HIS C C 5.299 -1.271 9.232 1.00 . A A . 34 HIS C 1 1 14 24922 1 1 34 HIS CA C 4.073 -0.443 8.840 1.00 . A A . 34 HIS CA 1 1 14 24923 1 1 34 HIS CB C 3.488 0.342 10.016 1.00 . A A . 34 HIS CB 1 1 14 24924 1 1 34 HIS CD2 C 0.973 0.999 9.742 1.00 . A A . 34 HIS CD2 1 1 14 24925 1 1 34 HIS CE1 C 1.263 2.994 8.893 1.00 . A A . 34 HIS CE1 1 1 14 24926 1 1 34 HIS CG C 2.316 1.219 9.646 1.00 . A A . 34 HIS CG 1 1 14 24927 1 1 34 HIS H H 2.289 -1.518 8.838 1.00 . A A . 34 HIS H 1 1 14 24928 1 1 34 HIS HA H 4.360 0.274 8.071 1.00 . A A . 34 HIS HA 1 1 14 24929 1 1 34 HIS HB2 H 3.174 -0.360 10.788 1.00 . A A . 34 HIS HB2 1 1 14 24930 1 1 34 HIS HB3 H 4.271 0.964 10.450 1.00 . A A . 34 HIS HB3 1 1 14 24931 1 1 34 HIS HD1 H 3.337 2.937 8.911 1.00 . A A . 34 HIS HD1 1 1 14 24932 1 1 34 HIS HD2 H 0.501 0.095 10.127 1.00 . A A . 34 HIS HD2 1 1 14 24933 1 1 34 HIS HE1 H 1.049 3.978 8.474 1.00 . A A . 34 HIS HE1 1 1 14 24934 1 1 34 HIS N N 3.068 -1.310 8.248 1.00 . A A . 34 HIS N 1 1 14 24935 1 1 34 HIS ND1 N 2.467 2.484 9.106 1.00 . A A . 34 HIS ND1 1 1 14 24936 1 1 34 HIS NE2 N 0.338 2.073 9.288 1.00 . A A . 34 HIS NE2 1 1 14 24937 1 1 34 HIS O O 5.657 -1.339 10.406 1.00 . A A . 34 HIS O 1 1 14 24938 1 1 35 HIS C C 8.049 -1.972 9.386 1.00 . A A . 35 HIS C 1 1 14 24939 1 1 35 HIS CA C 7.085 -2.702 8.449 1.00 . A A . 35 HIS CA 1 1 14 24940 1 1 35 HIS CB C 7.733 -3.096 7.121 1.00 . A A . 35 HIS CB 1 1 14 24941 1 1 35 HIS CD2 C 7.851 -1.361 5.170 1.00 . A A . 35 HIS CD2 1 1 14 24942 1 1 35 HIS CE1 C 9.620 -0.260 5.838 1.00 . A A . 35 HIS CE1 1 1 14 24943 1 1 35 HIS CG C 8.279 -1.929 6.334 1.00 . A A . 35 HIS CG 1 1 14 24944 1 1 35 HIS H H 5.609 -1.821 7.272 1.00 . A A . 35 HIS H 1 1 14 24945 1 1 35 HIS HA H 6.741 -3.615 8.935 1.00 . A A . 35 HIS HA 1 1 14 24946 1 1 35 HIS HB2 H 8.543 -3.799 7.318 1.00 . A A . 35 HIS HB2 1 1 14 24947 1 1 35 HIS HB3 H 6.998 -3.621 6.511 1.00 . A A . 35 HIS HB3 1 1 14 24948 1 1 35 HIS HD1 H 9.941 -1.388 7.550 1.00 . A A . 35 HIS HD1 1 1 14 24949 1 1 35 HIS HD2 H 6.989 -1.681 4.584 1.00 . A A . 35 HIS HD2 1 1 14 24950 1 1 35 HIS HE1 H 10.428 0.470 5.870 1.00 . A A . 35 HIS HE1 1 1 14 24951 1 1 35 HIS N N 5.907 -1.881 8.225 1.00 . A A . 35 HIS N 1 1 14 24952 1 1 35 HIS ND1 N 9.396 -1.214 6.730 1.00 . A A . 35 HIS ND1 1 1 14 24953 1 1 35 HIS NE2 N 8.661 -0.352 4.872 1.00 . A A . 35 HIS NE2 1 1 14 24954 1 1 35 HIS O O 8.120 -0.744 9.376 1.00 . A A . 35 HIS O 1 1 14 24955 1 1 36 PRO C C 11.002 -1.737 10.415 1.00 . A A . 36 PRO C 1 1 14 24956 1 1 36 PRO CA C 9.743 -2.223 11.136 1.00 . A A . 36 PRO CA 1 1 14 24957 1 1 36 PRO CB C 10.021 -3.344 12.124 1.00 . A A . 36 PRO CB 1 1 14 24958 1 1 36 PRO CD C 8.729 -4.238 10.234 1.00 . A A . 36 PRO CD 1 1 14 24959 1 1 36 PRO CG C 9.572 -4.625 11.438 1.00 . A A . 36 PRO CG 1 1 14 24960 1 1 36 PRO HA H 9.359 -1.418 11.587 1.00 . A A . 36 PRO HA 1 1 14 24961 1 1 36 PRO HB2 H 11.080 -3.388 12.378 1.00 . A A . 36 PRO HB2 1 1 14 24962 1 1 36 PRO HB3 H 9.476 -3.188 13.055 1.00 . A A . 36 PRO HB3 1 1 14 24963 1 1 36 PRO HD2 H 9.125 -4.674 9.317 1.00 . A A . 36 PRO HD2 1 1 14 24964 1 1 36 PRO HD3 H 7.703 -4.591 10.338 1.00 . A A . 36 PRO HD3 1 1 14 24965 1 1 36 PRO HG2 H 10.435 -5.214 11.127 1.00 . A A . 36 PRO HG2 1 1 14 24966 1 1 36 PRO HG3 H 8.995 -5.244 12.125 1.00 . A A . 36 PRO HG3 1 1 14 24967 1 1 36 PRO N N 8.786 -2.779 10.195 1.00 . A A . 36 PRO N 1 1 14 24968 1 1 36 PRO O O 11.702 -2.524 9.780 1.00 . A A . 36 PRO O 1 1 14 24969 1 1 37 VAL C C 13.633 -0.017 10.814 1.00 . A A . 37 VAL C 1 1 14 24970 1 1 37 VAL CA C 12.415 0.159 9.905 1.00 . A A . 37 VAL CA 1 1 14 24971 1 1 37 VAL CB C 12.128 1.624 9.568 1.00 . A A . 37 VAL CB 1 1 14 24972 1 1 37 VAL CG1 C 13.411 2.356 9.171 1.00 . A A . 37 VAL CG1 1 1 14 24973 1 1 37 VAL CG2 C 11.070 1.736 8.468 1.00 . A A . 37 VAL CG2 1 1 14 24974 1 1 37 VAL H H 10.679 0.192 11.056 1.00 . A A . 37 VAL H 1 1 14 24975 1 1 37 VAL HA H 12.593 -0.374 8.971 1.00 . A A . 37 VAL HA 1 1 14 24976 1 1 37 VAL HB H 11.732 2.103 10.463 1.00 . A A . 37 VAL HB 1 1 14 24977 1 1 37 VAL HG11 H 14.151 2.249 9.964 1.00 . A A . 37 VAL HG11 1 1 14 24978 1 1 37 VAL HG12 H 13.804 1.928 8.248 1.00 . A A . 37 VAL HG12 1 1 14 24979 1 1 37 VAL HG13 H 13.194 3.413 9.017 1.00 . A A . 37 VAL HG13 1 1 14 24980 1 1 37 VAL HG21 H 10.769 0.738 8.151 1.00 . A A . 37 VAL HG21 1 1 14 24981 1 1 37 VAL HG22 H 10.202 2.272 8.852 1.00 . A A . 37 VAL HG22 1 1 14 24982 1 1 37 VAL HG23 H 11.485 2.278 7.618 1.00 . A A . 37 VAL HG23 1 1 14 24983 1 1 37 VAL N N 11.252 -0.441 10.538 1.00 . A A . 37 VAL N 1 1 14 24984 1 1 37 VAL O O 14.517 -0.822 10.524 1.00 . A A . 37 VAL O 1 1 14 24985 1 1 38 ASN C C 14.410 -0.351 13.926 1.00 . A A . 38 ASN C 1 1 14 24986 1 1 38 ASN CA C 14.735 0.686 12.849 1.00 . A A . 38 ASN CA 1 1 14 24987 1 1 38 ASN CB C 14.941 2.036 13.539 1.00 . A A . 38 ASN CB 1 1 14 24988 1 1 38 ASN CG C 16.415 2.448 13.508 1.00 . A A . 38 ASN CG 1 1 14 24989 1 1 38 ASN H H 12.916 1.399 12.125 1.00 . A A . 38 ASN H 1 1 14 24990 1 1 38 ASN HA H 15.612 0.415 12.260 1.00 . A A . 38 ASN HA 1 1 14 24991 1 1 38 ASN HB2 H 14.337 2.797 13.045 1.00 . A A . 38 ASN HB2 1 1 14 24992 1 1 38 ASN HB3 H 14.598 1.977 14.572 1.00 . A A . 38 ASN HB3 1 1 14 24993 1 1 38 ASN HD21 H 15.836 4.298 12.925 1.00 . A A . 38 ASN HD21 1 1 14 24994 1 1 38 ASN HD22 H 17.545 4.076 13.096 1.00 . A A . 38 ASN HD22 1 1 14 24995 1 1 38 ASN N N 13.640 0.748 11.896 1.00 . A A . 38 ASN N 1 1 14 24996 1 1 38 ASN ND2 N 16.615 3.712 13.146 1.00 . A A . 38 ASN ND2 1 1 14 24997 1 1 38 ASN O O 14.705 -0.142 15.102 1.00 . A A . 38 ASN O 1 1 14 24998 1 1 38 ASN OD1 O 17.310 1.669 13.793 1.00 . A A . 38 ASN OD1 1 1 14 24999 1 1 39 GLY C C 12.219 -2.126 15.235 1.00 . A A . 39 GLY C 1 1 14 25000 1 1 39 GLY CA C 13.439 -2.515 14.398 1.00 . A A . 39 GLY CA 1 1 14 25001 1 1 39 GLY H H 13.572 -1.607 12.528 1.00 . A A . 39 GLY H 1 1 14 25002 1 1 39 GLY HA2 H 13.223 -3.422 13.833 1.00 . A A . 39 GLY HA2 1 1 14 25003 1 1 39 GLY HA3 H 14.278 -2.742 15.056 1.00 . A A . 39 GLY HA3 1 1 14 25004 1 1 39 GLY N N 13.807 -1.446 13.486 1.00 . A A . 39 GLY N 1 1 14 25005 1 1 39 GLY O O 11.769 -2.899 16.079 1.00 . A A . 39 GLY O 1 1 14 25006 1 1 40 LYS C C 9.423 -0.164 14.696 1.00 . A A . 40 LYS C 1 1 14 25007 1 1 40 LYS CA C 10.558 -0.428 15.689 1.00 . A A . 40 LYS CA 1 1 14 25008 1 1 40 LYS CB C 10.935 0.793 16.530 1.00 . A A . 40 LYS CB 1 1 14 25009 1 1 40 LYS CD C 12.115 3.010 16.299 1.00 . A A . 40 LYS CD 1 1 14 25010 1 1 40 LYS CE C 11.514 4.415 16.358 1.00 . A A . 40 LYS CE 1 1 14 25011 1 1 40 LYS CG C 11.143 2.025 15.646 1.00 . A A . 40 LYS CG 1 1 14 25012 1 1 40 LYS H H 12.089 -0.306 14.282 1.00 . A A . 40 LYS H 1 1 14 25013 1 1 40 LYS HA H 10.238 -1.209 16.379 1.00 . A A . 40 LYS HA 1 1 14 25014 1 1 40 LYS HB2 H 10.150 0.993 17.260 1.00 . A A . 40 LYS HB2 1 1 14 25015 1 1 40 LYS HB3 H 11.846 0.585 17.091 1.00 . A A . 40 LYS HB3 1 1 14 25016 1 1 40 LYS HD2 H 12.359 2.672 17.306 1.00 . A A . 40 LYS HD2 1 1 14 25017 1 1 40 LYS HD3 H 13.048 3.033 15.736 1.00 . A A . 40 LYS HD3 1 1 14 25018 1 1 40 LYS HE2 H 12.235 5.142 15.983 1.00 . A A . 40 LYS HE2 1 1 14 25019 1 1 40 LYS HE3 H 10.639 4.471 15.711 1.00 . A A . 40 LYS HE3 1 1 14 25020 1 1 40 LYS HG2 H 11.529 1.718 14.674 1.00 . A A . 40 LYS HG2 1 1 14 25021 1 1 40 LYS HG3 H 10.186 2.516 15.469 1.00 . A A . 40 LYS HG3 1 1 14 25022 1 1 40 LYS HZ1 H 11.203 3.960 18.368 1.00 . A A . 40 LYS HZ1 1 1 14 25023 1 1 40 LYS HZ2 H 11.723 5.485 18.135 1.00 . A A . 40 LYS HZ2 1 1 14 25024 1 1 40 LYS N N 11.717 -0.929 14.971 1.00 . A A . 40 LYS N 1 1 14 25025 1 1 40 LYS NZ N 11.132 4.758 17.747 1.00 . A A . 40 LYS NZ 1 1 14 25026 1 1 40 LYS O O 9.608 0.551 13.713 1.00 . A A . 40 LYS O 1 1 14 25027 1 1 41 GLU C C 6.481 0.783 14.350 1.00 . A A . 41 GLU C 1 1 14 25028 1 1 41 GLU CA C 7.110 -0.595 14.135 1.00 . A A . 41 GLU CA 1 1 14 25029 1 1 41 GLU CB C 6.090 -1.708 14.382 1.00 . A A . 41 GLU CB 1 1 14 25030 1 1 41 GLU CD C 3.653 -1.785 13.737 1.00 . A A . 41 GLU CD 1 1 14 25031 1 1 41 GLU CG C 5.095 -1.806 13.224 1.00 . A A . 41 GLU CG 1 1 14 25032 1 1 41 GLU H H 8.133 -1.336 15.792 1.00 . A A . 41 GLU H 1 1 14 25033 1 1 41 GLU HA H 7.486 -0.675 13.115 1.00 . A A . 41 GLU HA 1 1 14 25034 1 1 41 GLU HB2 H 6.607 -2.659 14.503 1.00 . A A . 41 GLU HB2 1 1 14 25035 1 1 41 GLU HB3 H 5.555 -1.515 15.311 1.00 . A A . 41 GLU HB3 1 1 14 25036 1 1 41 GLU HG2 H 5.251 -0.977 12.534 1.00 . A A . 41 GLU HG2 1 1 14 25037 1 1 41 GLU HG3 H 5.272 -2.724 12.665 1.00 . A A . 41 GLU HG3 1 1 14 25038 1 1 41 GLU N N 8.275 -0.756 14.989 1.00 . A A . 41 GLU N 1 1 14 25039 1 1 41 GLU O O 5.556 0.930 15.146 1.00 . A A . 41 GLU O 1 1 14 25040 1 1 41 GLU OE1 O 3.449 -2.257 14.876 1.00 . A A . 41 GLU OE1 1 1 14 25041 1 1 41 GLU OE2 O 2.788 -1.296 12.978 1.00 . A A . 41 GLU OE2 1 1 14 25042 1 1 42 ASP C C 5.235 3.255 12.894 1.00 . A A . 42 ASP C 1 1 14 25043 1 1 42 ASP CA C 6.511 3.120 13.727 1.00 . A A . 42 ASP CA 1 1 14 25044 1 1 42 ASP CB C 7.534 4.123 13.190 1.00 . A A . 42 ASP CB 1 1 14 25045 1 1 42 ASP CG C 7.116 5.591 13.292 1.00 . A A . 42 ASP CG 1 1 14 25046 1 1 42 ASP H H 7.761 1.632 12.979 1.00 . A A . 42 ASP H 1 1 14 25047 1 1 42 ASP HA H 6.334 3.282 14.790 1.00 . A A . 42 ASP HA 1 1 14 25048 1 1 42 ASP HB2 H 8.470 3.989 13.731 1.00 . A A . 42 ASP HB2 1 1 14 25049 1 1 42 ASP HB3 H 7.735 3.890 12.144 1.00 . A A . 42 ASP HB3 1 1 14 25050 1 1 42 ASP N N 7.009 1.759 13.625 1.00 . A A . 42 ASP N 1 1 14 25051 1 1 42 ASP O O 4.962 2.423 12.029 1.00 . A A . 42 ASP O 1 1 14 25052 1 1 42 ASP OD1 O 7.224 6.135 14.413 1.00 . A A . 42 ASP OD1 1 1 14 25053 1 1 42 ASP OD2 O 6.698 6.136 12.248 1.00 . A A . 42 ASP OD2 1 1 14 25054 1 1 43 TYR C C 3.307 5.895 11.719 1.00 . A A . 43 TYR C 1 1 14 25055 1 1 43 TYR CA C 3.245 4.564 12.471 1.00 . A A . 43 TYR CA 1 1 14 25056 1 1 43 TYR CB C 2.155 4.647 13.541 1.00 . A A . 43 TYR CB 1 1 14 25057 1 1 43 TYR CD1 C 1.560 2.209 13.779 1.00 . A A . 43 TYR CD1 1 1 14 25058 1 1 43 TYR CD2 C 2.306 3.387 15.720 1.00 . A A . 43 TYR CD2 1 1 14 25059 1 1 43 TYR CE1 C 1.416 1.009 14.562 1.00 . A A . 43 TYR CE1 1 1 14 25060 1 1 43 TYR CE2 C 2.162 2.188 16.503 1.00 . A A . 43 TYR CE2 1 1 14 25061 1 1 43 TYR CG C 2.002 3.373 14.374 1.00 . A A . 43 TYR CG 1 1 14 25062 1 1 43 TYR CZ C 1.725 1.058 15.886 1.00 . A A . 43 TYR CZ 1 1 14 25063 1 1 43 TYR H H 4.715 4.982 13.887 1.00 . A A . 43 TYR H 1 1 14 25064 1 1 43 TYR HA H 3.097 3.757 11.754 1.00 . A A . 43 TYR HA 1 1 14 25065 1 1 43 TYR HB2 H 2.377 5.480 14.208 1.00 . A A . 43 TYR HB2 1 1 14 25066 1 1 43 TYR HB3 H 1.203 4.870 13.059 1.00 . A A . 43 TYR HB3 1 1 14 25067 1 1 43 TYR HD1 H 1.320 2.197 12.715 1.00 . A A . 43 TYR HD1 1 1 14 25068 1 1 43 TYR HD2 H 2.655 4.307 16.190 1.00 . A A . 43 TYR HD2 1 1 14 25069 1 1 43 TYR HE1 H 1.068 0.083 14.105 1.00 . A A . 43 TYR HE1 1 1 14 25070 1 1 43 TYR HE2 H 2.399 2.186 17.567 1.00 . A A . 43 TYR HE2 1 1 14 25071 1 1 43 TYR HH H 0.627 -0.217 16.861 1.00 . A A . 43 TYR HH 1 1 14 25072 1 1 43 TYR N N 4.486 4.310 13.182 1.00 . A A . 43 TYR N 1 1 14 25073 1 1 43 TYR O O 2.863 6.922 12.230 1.00 . A A . 43 TYR O 1 1 14 25074 1 1 43 TYR OH O 1.589 -0.075 16.626 1.00 . A A . 43 TYR OH 1 1 14 25075 1 1 44 ARG C C 3.503 6.733 8.268 1.00 . A A . 44 ARG C 1 1 14 25076 1 1 44 ARG CA C 3.989 7.022 9.690 1.00 . A A . 44 ARG CA 1 1 14 25077 1 1 44 ARG CB C 5.439 7.505 9.637 1.00 . A A . 44 ARG CB 1 1 14 25078 1 1 44 ARG CD C 7.002 9.225 10.617 1.00 . A A . 44 ARG CD 1 1 14 25079 1 1 44 ARG CG C 5.564 8.927 10.186 1.00 . A A . 44 ARG CG 1 1 14 25080 1 1 44 ARG CZ C 7.987 10.420 12.580 1.00 . A A . 44 ARG CZ 1 1 14 25081 1 1 44 ARG H H 4.221 4.995 10.109 1.00 . A A . 44 ARG H 1 1 14 25082 1 1 44 ARG HA H 3.359 7.768 10.176 1.00 . A A . 44 ARG HA 1 1 14 25083 1 1 44 ARG HB2 H 6.072 6.831 10.216 1.00 . A A . 44 ARG HB2 1 1 14 25084 1 1 44 ARG HB3 H 5.799 7.475 8.609 1.00 . A A . 44 ARG HB3 1 1 14 25085 1 1 44 ARG HD2 H 7.623 8.340 10.476 1.00 . A A . 44 ARG HD2 1 1 14 25086 1 1 44 ARG HD3 H 7.422 10.013 9.992 1.00 . A A . 44 ARG HD3 1 1 14 25087 1 1 44 ARG HE H 6.291 9.321 12.633 1.00 . A A . 44 ARG HE 1 1 14 25088 1 1 44 ARG HG2 H 5.254 9.643 9.425 1.00 . A A . 44 ARG HG2 1 1 14 25089 1 1 44 ARG HG3 H 4.893 9.054 11.035 1.00 . A A . 44 ARG HG3 1 1 14 25090 1 1 44 ARG HH11 H 9.057 10.640 10.854 1.00 . A A . 44 ARG HH11 1 1 14 25091 1 1 44 ARG HH12 H 9.713 11.456 12.234 1.00 . A A . 44 ARG HH12 1 1 14 25092 1 1 44 ARG HH21 H 8.579 11.300 14.339 1.00 . A A . 44 ARG HH21 1 1 14 25093 1 1 44 ARG N N 3.862 5.834 10.517 1.00 . A A . 44 ARG N 1 1 14 25094 1 1 44 ARG NE N 7.029 9.639 12.038 1.00 . A A . 44 ARG NE 1 1 14 25095 1 1 44 ARG NH1 N 9.007 10.878 11.824 1.00 . A A . 44 ARG NH1 1 1 14 25096 1 1 44 ARG NH2 N 7.912 10.728 13.862 1.00 . A A . 44 ARG NH2 1 1 14 25097 1 1 44 ARG O O 3.147 5.600 7.949 1.00 . A A . 44 ARG O 1 1 14 25098 1 1 45 LYS C C 4.185 7.014 5.246 1.00 . A A . 45 LYS C 1 1 14 25099 1 1 45 LYS CA C 3.066 7.650 6.073 1.00 . A A . 45 LYS CA 1 1 14 25100 1 1 45 LYS CB C 2.594 9.002 5.534 1.00 . A A . 45 LYS CB 1 1 14 25101 1 1 45 LYS CD C 1.435 10.222 7.412 1.00 . A A . 45 LYS CD 1 1 14 25102 1 1 45 LYS CE C 0.101 10.787 7.903 1.00 . A A . 45 LYS CE 1 1 14 25103 1 1 45 LYS CG C 1.245 9.393 6.141 1.00 . A A . 45 LYS CG 1 1 14 25104 1 1 45 LYS H H 3.794 8.696 7.721 1.00 . A A . 45 LYS H 1 1 14 25105 1 1 45 LYS HA H 2.206 6.981 6.063 1.00 . A A . 45 LYS HA 1 1 14 25106 1 1 45 LYS HB2 H 3.335 9.768 5.761 1.00 . A A . 45 LYS HB2 1 1 14 25107 1 1 45 LYS HB3 H 2.508 8.954 4.448 1.00 . A A . 45 LYS HB3 1 1 14 25108 1 1 45 LYS HD2 H 1.881 9.603 8.191 1.00 . A A . 45 LYS HD2 1 1 14 25109 1 1 45 LYS HD3 H 2.131 11.039 7.217 1.00 . A A . 45 LYS HD3 1 1 14 25110 1 1 45 LYS HE2 H -0.722 10.206 7.488 1.00 . A A . 45 LYS HE2 1 1 14 25111 1 1 45 LYS HE3 H 0.039 10.698 8.988 1.00 . A A . 45 LYS HE3 1 1 14 25112 1 1 45 LYS HG2 H 0.667 9.963 5.413 1.00 . A A . 45 LYS HG2 1 1 14 25113 1 1 45 LYS HG3 H 0.671 8.495 6.370 1.00 . A A . 45 LYS HG3 1 1 14 25114 1 1 45 LYS HZ1 H -0.312 12.305 6.536 1.00 . A A . 45 LYS HZ1 1 1 14 25115 1 1 45 LYS HZ2 H -0.738 12.689 8.061 1.00 . A A . 45 LYS HZ2 1 1 14 25116 1 1 45 LYS N N 3.503 7.777 7.453 1.00 . A A . 45 LYS N 1 1 14 25117 1 1 45 LYS NZ N -0.038 12.207 7.508 1.00 . A A . 45 LYS NZ 1 1 14 25118 1 1 45 LYS O O 5.360 7.315 5.449 1.00 . A A . 45 LYS O 1 1 14 25119 1 1 46 CYS C C 5.423 6.513 2.593 1.00 . A A . 46 CYS C 1 1 14 25120 1 1 46 CYS CA C 4.733 5.466 3.470 1.00 . A A . 46 CYS CA 1 1 14 25121 1 1 46 CYS CB C 4.062 4.374 2.634 1.00 . A A . 46 CYS CB 1 1 14 25122 1 1 46 CYS H H 2.822 5.908 4.170 1.00 . A A . 46 CYS H 1 1 14 25123 1 1 46 CYS HA H 5.452 4.976 4.127 1.00 . A A . 46 CYS HA 1 1 14 25124 1 1 46 CYS HB2 H 3.677 4.823 1.719 1.00 . A A . 46 CYS HB2 1 1 14 25125 1 1 46 CYS HB3 H 4.818 3.646 2.339 1.00 . A A . 46 CYS HB3 1 1 14 25126 1 1 46 CYS N N 3.780 6.147 4.329 1.00 . A A . 46 CYS N 1 1 14 25127 1 1 46 CYS O O 6.650 6.598 2.572 1.00 . A A . 46 CYS O 1 1 14 25128 1 1 46 CYS SG S 2.696 3.493 3.476 1.00 . A A . 46 CYS SG 1 1 14 25129 1 1 47 GLY C C 5.676 9.495 1.824 1.00 . A A . 47 GLY C 1 1 14 25130 1 1 47 GLY CA C 5.120 8.321 1.016 1.00 . A A . 47 GLY CA 1 1 14 25131 1 1 47 GLY H H 3.607 7.208 1.916 1.00 . A A . 47 GLY H 1 1 14 25132 1 1 47 GLY HA2 H 5.905 7.909 0.380 1.00 . A A . 47 GLY HA2 1 1 14 25133 1 1 47 GLY HA3 H 4.327 8.672 0.356 1.00 . A A . 47 GLY HA3 1 1 14 25134 1 1 47 GLY N N 4.604 7.284 1.892 1.00 . A A . 47 GLY N 1 1 14 25135 1 1 47 GLY O O 5.275 10.640 1.618 1.00 . A A . 47 GLY O 1 1 14 25136 1 1 48 THR C C 8.615 10.508 3.069 1.00 . A A . 48 THR C 1 1 14 25137 1 1 48 THR CA C 7.205 10.185 3.567 1.00 . A A . 48 THR CA 1 1 14 25138 1 1 48 THR CB C 7.171 9.684 5.012 1.00 . A A . 48 THR CB 1 1 14 25139 1 1 48 THR CG2 C 8.298 10.273 5.863 1.00 . A A . 48 THR CG2 1 1 14 25140 1 1 48 THR H H 6.911 8.238 2.887 1.00 . A A . 48 THR H 1 1 14 25141 1 1 48 THR HA H 6.619 11.100 3.485 1.00 . A A . 48 THR HA 1 1 14 25142 1 1 48 THR HB H 7.185 8.595 5.048 1.00 . A A . 48 THR HB 1 1 14 25143 1 1 48 THR HG1 H 6.054 11.264 5.526 1.00 . A A . 48 THR HG1 1 1 14 25144 1 1 48 THR HG21 H 8.636 11.210 5.419 1.00 . A A . 48 THR HG21 1 1 14 25145 1 1 48 THR HG22 H 7.932 10.460 6.872 1.00 . A A . 48 THR HG22 1 1 14 25146 1 1 48 THR HG23 H 9.130 9.569 5.902 1.00 . A A . 48 THR HG23 1 1 14 25147 1 1 48 THR N N 6.590 9.171 2.726 1.00 . A A . 48 THR N 1 1 14 25148 1 1 48 THR O O 9.358 9.611 2.673 1.00 . A A . 48 THR O 1 1 14 25149 1 1 48 THR OG1 O 5.988 10.266 5.553 1.00 . A A . 48 THR OG1 1 1 14 25150 1 1 49 ALA C C 11.333 11.480 3.422 1.00 . A A . 49 ALA C 1 1 14 25151 1 1 49 ALA CA C 10.248 12.244 2.660 1.00 . A A . 49 ALA CA 1 1 14 25152 1 1 49 ALA CB C 10.357 13.758 2.852 1.00 . A A . 49 ALA CB 1 1 14 25153 1 1 49 ALA H H 8.330 12.515 3.427 1.00 . A A . 49 ALA H 1 1 14 25154 1 1 49 ALA HA H 10.334 12.018 1.597 1.00 . A A . 49 ALA HA 1 1 14 25155 1 1 49 ALA HB1 H 9.472 14.123 3.374 1.00 . A A . 49 ALA HB1 1 1 14 25156 1 1 49 ALA HB2 H 11.245 13.987 3.441 1.00 . A A . 49 ALA HB2 1 1 14 25157 1 1 49 ALA HB3 H 10.431 14.244 1.879 1.00 . A A . 49 ALA HB3 1 1 14 25158 1 1 49 ALA N N 8.940 11.792 3.103 1.00 . A A . 49 ALA N 1 1 14 25159 1 1 49 ALA O O 11.356 11.489 4.652 1.00 . A A . 49 ALA O 1 1 14 25160 1 1 50 GLY C C 13.001 8.569 3.175 1.00 . A A . 50 GLY C 1 1 14 25161 1 1 50 GLY CA C 13.290 10.070 3.247 1.00 . A A . 50 GLY CA 1 1 14 25162 1 1 50 GLY H H 12.180 10.836 1.660 1.00 . A A . 50 GLY H 1 1 14 25163 1 1 50 GLY HA2 H 14.221 10.291 2.725 1.00 . A A . 50 GLY HA2 1 1 14 25164 1 1 50 GLY HA3 H 13.429 10.368 4.287 1.00 . A A . 50 GLY HA3 1 1 14 25165 1 1 50 GLY N N 12.205 10.838 2.660 1.00 . A A . 50 GLY N 1 1 14 25166 1 1 50 GLY O O 13.924 7.756 3.164 1.00 . A A . 50 GLY O 1 1 14 25167 1 1 51 CYS C C 11.068 6.500 1.589 1.00 . A A . 51 CYS C 1 1 14 25168 1 1 51 CYS CA C 11.295 6.859 3.059 1.00 . A A . 51 CYS CA 1 1 14 25169 1 1 51 CYS CB C 10.049 6.603 3.908 1.00 . A A . 51 CYS CB 1 1 14 25170 1 1 51 CYS H H 10.973 8.916 3.138 1.00 . A A . 51 CYS H 1 1 14 25171 1 1 51 CYS HA H 12.104 6.265 3.482 1.00 . A A . 51 CYS HA 1 1 14 25172 1 1 51 CYS HB2 H 9.232 7.243 3.573 1.00 . A A . 51 CYS HB2 1 1 14 25173 1 1 51 CYS HB3 H 9.718 5.572 3.782 1.00 . A A . 51 CYS HB3 1 1 14 25174 1 1 51 CYS N N 11.717 8.248 3.129 1.00 . A A . 51 CYS N 1 1 14 25175 1 1 51 CYS O O 12.021 6.376 0.822 1.00 . A A . 51 CYS O 1 1 14 25176 1 1 51 CYS SG S 10.415 6.930 5.671 1.00 . A A . 51 CYS SG 1 1 14 25177 1 1 52 HIS C C 9.136 7.278 -0.911 1.00 . A A . 52 HIS C 1 1 14 25178 1 1 52 HIS CA C 9.434 6.001 -0.124 1.00 . A A . 52 HIS CA 1 1 14 25179 1 1 52 HIS CB C 8.271 5.007 -0.142 1.00 . A A . 52 HIS CB 1 1 14 25180 1 1 52 HIS CD2 C 8.187 3.109 1.653 1.00 . A A . 52 HIS CD2 1 1 14 25181 1 1 52 HIS CE1 C 9.520 1.684 0.663 1.00 . A A . 52 HIS CE1 1 1 14 25182 1 1 52 HIS CG C 8.597 3.669 0.479 1.00 . A A . 52 HIS CG 1 1 14 25183 1 1 52 HIS H H 9.029 6.447 1.870 1.00 . A A . 52 HIS H 1 1 14 25184 1 1 52 HIS HA H 10.300 5.506 -0.564 1.00 . A A . 52 HIS HA 1 1 14 25185 1 1 52 HIS HB2 H 7.424 5.445 0.387 1.00 . A A . 52 HIS HB2 1 1 14 25186 1 1 52 HIS HB3 H 7.957 4.850 -1.173 1.00 . A A . 52 HIS HB3 1 1 14 25187 1 1 52 HIS HD1 H 9.900 2.865 -1.001 1.00 . A A . 52 HIS HD1 1 1 14 25188 1 1 52 HIS HD2 H 7.516 3.568 2.379 1.00 . A A . 52 HIS HD2 1 1 14 25189 1 1 52 HIS HE1 H 10.106 0.786 0.465 1.00 . A A . 52 HIS HE1 1 1 14 25190 1 1 52 HIS N N 9.799 6.344 1.240 1.00 . A A . 52 HIS N 1 1 14 25191 1 1 52 HIS ND1 N 9.436 2.748 -0.123 1.00 . A A . 52 HIS ND1 1 1 14 25192 1 1 52 HIS NE2 N 8.745 1.909 1.762 1.00 . A A . 52 HIS NE2 1 1 14 25193 1 1 52 HIS O O 7.983 7.552 -1.242 1.00 . A A . 52 HIS O 1 1 14 25194 1 1 53 ASP C C 10.658 9.088 -3.328 1.00 . A A . 53 ASP C 1 1 14 25195 1 1 53 ASP CA C 10.059 9.267 -1.931 1.00 . A A . 53 ASP CA 1 1 14 25196 1 1 53 ASP CB C 10.809 10.406 -1.238 1.00 . A A . 53 ASP CB 1 1 14 25197 1 1 53 ASP CG C 12.284 10.539 -1.623 1.00 . A A . 53 ASP CG 1 1 14 25198 1 1 53 ASP H H 11.128 7.795 -0.916 1.00 . A A . 53 ASP H 1 1 14 25199 1 1 53 ASP HA H 8.989 9.469 -1.959 1.00 . A A . 53 ASP HA 1 1 14 25200 1 1 53 ASP HB2 H 10.304 11.345 -1.467 1.00 . A A . 53 ASP HB2 1 1 14 25201 1 1 53 ASP HB3 H 10.741 10.263 -0.160 1.00 . A A . 53 ASP HB3 1 1 14 25202 1 1 53 ASP N N 10.194 8.025 -1.189 1.00 . A A . 53 ASP N 1 1 14 25203 1 1 53 ASP O O 10.958 10.068 -4.009 1.00 . A A . 53 ASP O 1 1 14 25204 1 1 53 ASP OD1 O 12.966 9.491 -1.623 1.00 . A A . 53 ASP OD1 1 1 14 25205 1 1 53 ASP OD2 O 12.696 11.684 -1.908 1.00 . A A . 53 ASP OD2 1 1 14 25206 1 1 54 SER C C 10.284 7.615 -6.091 1.00 . A A . 54 SER C 1 1 14 25207 1 1 54 SER CA C 11.370 7.511 -5.018 1.00 . A A . 54 SER CA 1 1 14 25208 1 1 54 SER CB C 11.990 6.112 -5.024 1.00 . A A . 54 SER CB 1 1 14 25209 1 1 54 SER H H 10.565 7.039 -3.155 1.00 . A A . 54 SER H 1 1 14 25210 1 1 54 SER HA H 12.149 8.253 -5.188 1.00 . A A . 54 SER HA 1 1 14 25211 1 1 54 SER HB2 H 12.553 5.961 -4.103 1.00 . A A . 54 SER HB2 1 1 14 25212 1 1 54 SER HB3 H 11.197 5.364 -5.039 1.00 . A A . 54 SER HB3 1 1 14 25213 1 1 54 SER HG H 12.334 6.019 -6.993 1.00 . A A . 54 SER HG 1 1 14 25214 1 1 54 SER N N 10.813 7.830 -3.714 1.00 . A A . 54 SER N 1 1 14 25215 1 1 54 SER O O 9.439 6.729 -6.212 1.00 . A A . 54 SER O 1 1 14 25216 1 1 54 SER OG O 12.849 5.914 -6.143 1.00 . A A . 54 SER OG 1 1 14 25217 1 1 55 MET C C 9.849 8.325 -9.221 1.00 . A A . 55 MET C 1 1 14 25218 1 1 55 MET CA C 9.374 8.936 -7.901 1.00 . A A . 55 MET CA 1 1 14 25219 1 1 55 MET CB C 9.164 10.441 -8.081 1.00 . A A . 55 MET CB 1 1 14 25220 1 1 55 MET CE C 7.212 9.844 -5.294 1.00 . A A . 55 MET CE 1 1 14 25221 1 1 55 MET CG C 7.712 10.830 -7.796 1.00 . A A . 55 MET CG 1 1 14 25222 1 1 55 MET H H 11.033 9.420 -6.738 1.00 . A A . 55 MET H 1 1 14 25223 1 1 55 MET HA H 8.459 8.444 -7.573 1.00 . A A . 55 MET HA 1 1 14 25224 1 1 55 MET HB2 H 9.829 10.987 -7.411 1.00 . A A . 55 MET HB2 1 1 14 25225 1 1 55 MET HB3 H 9.429 10.730 -9.098 1.00 . A A . 55 MET HB3 1 1 14 25226 1 1 55 MET HE1 H 7.892 9.080 -5.670 1.00 . A A . 55 MET HE1 1 1 14 25227 1 1 55 MET HE2 H 7.354 9.961 -4.220 1.00 . A A . 55 MET HE2 1 1 14 25228 1 1 55 MET HE3 H 6.183 9.546 -5.494 1.00 . A A . 55 MET HE3 1 1 14 25229 1 1 55 MET HG2 H 7.395 11.614 -8.483 1.00 . A A . 55 MET HG2 1 1 14 25230 1 1 55 MET HG3 H 7.058 9.974 -7.965 1.00 . A A . 55 MET HG3 1 1 14 25231 1 1 55 MET N N 10.342 8.704 -6.842 1.00 . A A . 55 MET N 1 1 14 25232 1 1 55 MET O O 9.607 8.884 -10.290 1.00 . A A . 55 MET O 1 1 14 25233 1 1 55 MET SD S 7.551 11.395 -6.110 1.00 . A A . 55 MET SD 1 1 14 25234 1 1 56 ASP C C 10.169 5.257 -10.545 1.00 . A A . 56 ASP C 1 1 14 25235 1 1 56 ASP CA C 11.027 6.494 -10.274 1.00 . A A . 56 ASP CA 1 1 14 25236 1 1 56 ASP CB C 12.469 6.031 -10.055 1.00 . A A . 56 ASP CB 1 1 14 25237 1 1 56 ASP CG C 13.391 7.069 -9.413 1.00 . A A . 56 ASP CG 1 1 14 25238 1 1 56 ASP H H 10.708 6.739 -8.230 1.00 . A A . 56 ASP H 1 1 14 25239 1 1 56 ASP HA H 10.975 7.223 -11.083 1.00 . A A . 56 ASP HA 1 1 14 25240 1 1 56 ASP HB2 H 12.456 5.140 -9.426 1.00 . A A . 56 ASP HB2 1 1 14 25241 1 1 56 ASP HB3 H 12.890 5.737 -11.016 1.00 . A A . 56 ASP HB3 1 1 14 25242 1 1 56 ASP N N 10.516 7.187 -9.104 1.00 . A A . 56 ASP N 1 1 14 25243 1 1 56 ASP O O 10.672 4.135 -10.542 1.00 . A A . 56 ASP O 1 1 14 25244 1 1 56 ASP OD1 O 12.995 8.255 -9.410 1.00 . A A . 56 ASP OD1 1 1 14 25245 1 1 56 ASP OD2 O 14.471 6.654 -8.940 1.00 . A A . 56 ASP OD2 1 1 14 25246 1 1 57 LYS C C 8.614 3.407 -11.978 1.00 . A A . 57 LYS C 1 1 14 25247 1 1 57 LYS CA C 7.954 4.424 -11.045 1.00 . A A . 57 LYS CA 1 1 14 25248 1 1 57 LYS CB C 6.631 4.980 -11.578 1.00 . A A . 57 LYS CB 1 1 14 25249 1 1 57 LYS CD C 5.249 4.112 -13.500 1.00 . A A . 57 LYS CD 1 1 14 25250 1 1 57 LYS CE C 5.013 2.798 -14.247 1.00 . A A . 57 LYS CE 1 1 14 25251 1 1 57 LYS CG C 5.721 3.852 -12.068 1.00 . A A . 57 LYS CG 1 1 14 25252 1 1 57 LYS H H 8.485 6.420 -10.774 1.00 . A A . 57 LYS H 1 1 14 25253 1 1 57 LYS HA H 7.738 3.933 -10.096 1.00 . A A . 57 LYS HA 1 1 14 25254 1 1 57 LYS HB2 H 6.127 5.544 -10.794 1.00 . A A . 57 LYS HB2 1 1 14 25255 1 1 57 LYS HB3 H 6.828 5.675 -12.394 1.00 . A A . 57 LYS HB3 1 1 14 25256 1 1 57 LYS HD2 H 4.328 4.695 -13.483 1.00 . A A . 57 LYS HD2 1 1 14 25257 1 1 57 LYS HD3 H 5.993 4.707 -14.030 1.00 . A A . 57 LYS HD3 1 1 14 25258 1 1 57 LYS HE2 H 5.751 2.059 -13.936 1.00 . A A . 57 LYS HE2 1 1 14 25259 1 1 57 LYS HE3 H 4.032 2.397 -13.989 1.00 . A A . 57 LYS HE3 1 1 14 25260 1 1 57 LYS HG2 H 6.255 2.903 -12.024 1.00 . A A . 57 LYS HG2 1 1 14 25261 1 1 57 LYS HG3 H 4.859 3.763 -11.407 1.00 . A A . 57 LYS HG3 1 1 14 25262 1 1 57 LYS HZ1 H 5.512 3.907 -15.939 1.00 . A A . 57 LYS HZ1 1 1 14 25263 1 1 57 LYS HZ2 H 5.667 2.302 -16.162 1.00 . A A . 57 LYS HZ2 1 1 14 25264 1 1 57 LYS N N 8.887 5.504 -10.773 1.00 . A A . 57 LYS N 1 1 14 25265 1 1 57 LYS NZ N 5.100 3.010 -15.709 1.00 . A A . 57 LYS NZ 1 1 14 25266 1 1 57 LYS O O 8.401 2.204 -11.841 1.00 . A A . 57 LYS O 1 1 14 25267 1 1 58 LYS C C 11.508 2.791 -13.349 1.00 . A A . 58 LYS C 1 1 14 25268 1 1 58 LYS CA C 10.096 3.082 -13.862 1.00 . A A . 58 LYS CA 1 1 14 25269 1 1 58 LYS CB C 10.065 3.711 -15.256 1.00 . A A . 58 LYS CB 1 1 14 25270 1 1 58 LYS CD C 8.521 2.361 -16.722 1.00 . A A . 58 LYS CD 1 1 14 25271 1 1 58 LYS CE C 8.432 1.663 -18.081 1.00 . A A . 58 LYS CE 1 1 14 25272 1 1 58 LYS CG C 9.976 2.636 -16.341 1.00 . A A . 58 LYS CG 1 1 14 25273 1 1 58 LYS H H 9.571 4.909 -13.010 1.00 . A A . 58 LYS H 1 1 14 25274 1 1 58 LYS HA H 9.549 2.141 -13.921 1.00 . A A . 58 LYS HA 1 1 14 25275 1 1 58 LYS HB2 H 9.213 4.386 -15.336 1.00 . A A . 58 LYS HB2 1 1 14 25276 1 1 58 LYS HB3 H 10.962 4.313 -15.407 1.00 . A A . 58 LYS HB3 1 1 14 25277 1 1 58 LYS HD2 H 8.053 1.739 -15.958 1.00 . A A . 58 LYS HD2 1 1 14 25278 1 1 58 LYS HD3 H 7.965 3.298 -16.753 1.00 . A A . 58 LYS HD3 1 1 14 25279 1 1 58 LYS HE2 H 8.081 2.367 -18.835 1.00 . A A . 58 LYS HE2 1 1 14 25280 1 1 58 LYS HE3 H 9.423 1.331 -18.391 1.00 . A A . 58 LYS HE3 1 1 14 25281 1 1 58 LYS HG2 H 10.532 2.957 -17.222 1.00 . A A . 58 LYS HG2 1 1 14 25282 1 1 58 LYS HG3 H 10.444 1.718 -15.987 1.00 . A A . 58 LYS HG3 1 1 14 25283 1 1 58 LYS HZ1 H 8.013 -0.369 -17.883 1.00 . A A . 58 LYS HZ1 1 1 14 25284 1 1 58 LYS HZ2 H 6.861 0.584 -17.238 1.00 . A A . 58 LYS HZ2 1 1 14 25285 1 1 58 LYS N N 9.403 3.929 -12.906 1.00 . A A . 58 LYS N 1 1 14 25286 1 1 58 LYS NZ N 7.514 0.504 -18.010 1.00 . A A . 58 LYS NZ 1 1 14 25287 1 1 58 LYS O O 12.491 3.232 -13.943 1.00 . A A . 58 LYS O 1 1 14 25288 1 1 59 ASP C C 12.669 0.425 -10.818 1.00 . A A . 59 ASP C 1 1 14 25289 1 1 59 ASP CA C 12.839 1.696 -11.652 1.00 . A A . 59 ASP CA 1 1 14 25290 1 1 59 ASP CB C 13.340 2.806 -10.726 1.00 . A A . 59 ASP CB 1 1 14 25291 1 1 59 ASP CG C 14.801 2.675 -10.291 1.00 . A A . 59 ASP CG 1 1 14 25292 1 1 59 ASP H H 10.759 1.696 -11.775 1.00 . A A . 59 ASP H 1 1 14 25293 1 1 59 ASP HA H 13.520 1.556 -12.491 1.00 . A A . 59 ASP HA 1 1 14 25294 1 1 59 ASP HB2 H 13.210 3.764 -11.229 1.00 . A A . 59 ASP HB2 1 1 14 25295 1 1 59 ASP HB3 H 12.712 2.827 -9.835 1.00 . A A . 59 ASP HB3 1 1 14 25296 1 1 59 ASP N N 11.563 2.051 -12.252 1.00 . A A . 59 ASP N 1 1 14 25297 1 1 59 ASP O O 13.476 -0.498 -10.915 1.00 . A A . 59 ASP O 1 1 14 25298 1 1 59 ASP OD1 O 15.501 1.837 -10.900 1.00 . A A . 59 ASP OD1 1 1 14 25299 1 1 59 ASP OD2 O 15.184 3.416 -9.360 1.00 . A A . 59 ASP OD2 1 1 14 25300 1 1 60 LYS C C 12.438 -0.869 -8.123 1.00 . A A . 60 LYS C 1 1 14 25301 1 1 60 LYS CA C 11.328 -0.725 -9.166 1.00 . A A . 60 LYS CA 1 1 14 25302 1 1 60 LYS CB C 11.111 -1.982 -10.011 1.00 . A A . 60 LYS CB 1 1 14 25303 1 1 60 LYS CD C 9.901 -1.793 -12.215 1.00 . A A . 60 LYS CD 1 1 14 25304 1 1 60 LYS CE C 8.810 -0.885 -12.786 1.00 . A A . 60 LYS CE 1 1 14 25305 1 1 60 LYS CG C 9.746 -1.950 -10.701 1.00 . A A . 60 LYS CG 1 1 14 25306 1 1 60 LYS H H 10.961 1.172 -9.944 1.00 . A A . 60 LYS H 1 1 14 25307 1 1 60 LYS HA H 10.391 -0.520 -8.647 1.00 . A A . 60 LYS HA 1 1 14 25308 1 1 60 LYS HB2 H 11.900 -2.062 -10.759 1.00 . A A . 60 LYS HB2 1 1 14 25309 1 1 60 LYS HB3 H 11.183 -2.867 -9.378 1.00 . A A . 60 LYS HB3 1 1 14 25310 1 1 60 LYS HD2 H 10.882 -1.375 -12.443 1.00 . A A . 60 LYS HD2 1 1 14 25311 1 1 60 LYS HD3 H 9.852 -2.771 -12.693 1.00 . A A . 60 LYS HD3 1 1 14 25312 1 1 60 LYS HE2 H 8.638 -0.045 -12.113 1.00 . A A . 60 LYS HE2 1 1 14 25313 1 1 60 LYS HE3 H 9.137 -0.468 -13.739 1.00 . A A . 60 LYS HE3 1 1 14 25314 1 1 60 LYS HG2 H 9.203 -2.869 -10.481 1.00 . A A . 60 LYS HG2 1 1 14 25315 1 1 60 LYS HG3 H 9.153 -1.126 -10.305 1.00 . A A . 60 LYS HG3 1 1 14 25316 1 1 60 LYS HZ1 H 6.777 -1.036 -13.221 1.00 . A A . 60 LYS HZ1 1 1 14 25317 1 1 60 LYS HZ2 H 7.631 -2.332 -13.714 1.00 . A A . 60 LYS HZ2 1 1 14 25318 1 1 60 LYS N N 11.613 0.417 -10.017 1.00 . A A . 60 LYS N 1 1 14 25319 1 1 60 LYS NZ N 7.552 -1.642 -12.975 1.00 . A A . 60 LYS NZ 1 1 14 25320 1 1 60 LYS O O 13.511 -1.390 -8.421 1.00 . A A . 60 LYS O 1 1 14 25321 1 1 61 SER C C 12.397 -0.214 -4.497 1.00 . A A . 61 SER C 1 1 14 25322 1 1 61 SER CA C 13.101 -0.466 -5.832 1.00 . A A . 61 SER CA 1 1 14 25323 1 1 61 SER CB C 14.235 0.541 -6.033 1.00 . A A . 61 SER CB 1 1 14 25324 1 1 61 SER H H 11.266 0.025 -6.686 1.00 . A A . 61 SER H 1 1 14 25325 1 1 61 SER HA H 13.504 -1.478 -5.866 1.00 . A A . 61 SER HA 1 1 14 25326 1 1 61 SER HB2 H 14.267 0.847 -7.078 1.00 . A A . 61 SER HB2 1 1 14 25327 1 1 61 SER HB3 H 14.034 1.436 -5.445 1.00 . A A . 61 SER HB3 1 1 14 25328 1 1 61 SER HG H 15.498 -0.232 -4.686 1.00 . A A . 61 SER HG 1 1 14 25329 1 1 61 SER N N 12.141 -0.397 -6.921 1.00 . A A . 61 SER N 1 1 14 25330 1 1 61 SER O O 11.240 0.201 -4.470 1.00 . A A . 61 SER O 1 1 14 25331 1 1 61 SER OG O 15.500 0.002 -5.658 1.00 . A A . 61 SER OG 1 1 14 25332 1 1 62 ALA C C 11.988 1.123 -1.982 1.00 . A A . 62 ALA C 1 1 14 25333 1 1 62 ALA CA C 12.586 -0.282 -2.087 1.00 . A A . 62 ALA CA 1 1 14 25334 1 1 62 ALA CB C 13.685 -0.526 -1.051 1.00 . A A . 62 ALA CB 1 1 14 25335 1 1 62 ALA H H 14.067 -0.812 -3.452 1.00 . A A . 62 ALA H 1 1 14 25336 1 1 62 ALA HA H 11.795 -1.016 -1.939 1.00 . A A . 62 ALA HA 1 1 14 25337 1 1 62 ALA HB1 H 14.319 -1.349 -1.382 1.00 . A A . 62 ALA HB1 1 1 14 25338 1 1 62 ALA HB2 H 14.287 0.375 -0.940 1.00 . A A . 62 ALA HB2 1 1 14 25339 1 1 62 ALA HB3 H 13.231 -0.780 -0.093 1.00 . A A . 62 ALA HB3 1 1 14 25340 1 1 62 ALA N N 13.126 -0.475 -3.422 1.00 . A A . 62 ALA N 1 1 14 25341 1 1 62 ALA O O 10.838 1.283 -1.575 1.00 . A A . 62 ALA O 1 1 14 25342 1 1 63 LYS C C 11.208 3.693 -3.293 1.00 . A A . 63 LYS C 1 1 14 25343 1 1 63 LYS CA C 12.361 3.490 -2.307 1.00 . A A . 63 LYS CA 1 1 14 25344 1 1 63 LYS CB C 13.544 4.431 -2.543 1.00 . A A . 63 LYS CB 1 1 14 25345 1 1 63 LYS CD C 15.298 5.220 -0.911 1.00 . A A . 63 LYS CD 1 1 14 25346 1 1 63 LYS CE C 16.496 4.811 -0.052 1.00 . A A . 63 LYS CE 1 1 14 25347 1 1 63 LYS CG C 14.747 4.024 -1.689 1.00 . A A . 63 LYS CG 1 1 14 25348 1 1 63 LYS H H 13.729 1.966 -2.685 1.00 . A A . 63 LYS H 1 1 14 25349 1 1 63 LYS HA H 11.991 3.682 -1.300 1.00 . A A . 63 LYS HA 1 1 14 25350 1 1 63 LYS HB2 H 13.820 4.418 -3.597 1.00 . A A . 63 LYS HB2 1 1 14 25351 1 1 63 LYS HB3 H 13.253 5.454 -2.303 1.00 . A A . 63 LYS HB3 1 1 14 25352 1 1 63 LYS HD2 H 15.596 6.005 -1.607 1.00 . A A . 63 LYS HD2 1 1 14 25353 1 1 63 LYS HD3 H 14.516 5.638 -0.277 1.00 . A A . 63 LYS HD3 1 1 14 25354 1 1 63 LYS HE2 H 17.232 4.294 -0.667 1.00 . A A . 63 LYS HE2 1 1 14 25355 1 1 63 LYS HE3 H 16.983 5.700 0.350 1.00 . A A . 63 LYS HE3 1 1 14 25356 1 1 63 LYS HG2 H 14.454 3.237 -0.994 1.00 . A A . 63 LYS HG2 1 1 14 25357 1 1 63 LYS HG3 H 15.527 3.611 -2.329 1.00 . A A . 63 LYS HG3 1 1 14 25358 1 1 63 LYS HZ1 H 16.752 3.221 1.270 1.00 . A A . 63 LYS HZ1 1 1 14 25359 1 1 63 LYS HZ2 H 15.901 4.452 1.913 1.00 . A A . 63 LYS HZ2 1 1 14 25360 1 1 63 LYS N N 12.796 2.105 -2.355 1.00 . A A . 63 LYS N 1 1 14 25361 1 1 63 LYS NZ N 16.062 3.932 1.057 1.00 . A A . 63 LYS NZ 1 1 14 25362 1 1 63 LYS O O 10.403 4.609 -3.133 1.00 . A A . 63 LYS O 1 1 14 25363 1 1 64 GLY C C 8.736 2.815 -4.669 1.00 . A A . 64 GLY C 1 1 14 25364 1 1 64 GLY CA C 10.126 2.895 -5.304 1.00 . A A . 64 GLY CA 1 1 14 25365 1 1 64 GLY H H 11.825 2.081 -4.415 1.00 . A A . 64 GLY H 1 1 14 25366 1 1 64 GLY HA2 H 10.221 3.826 -5.863 1.00 . A A . 64 GLY HA2 1 1 14 25367 1 1 64 GLY HA3 H 10.251 2.081 -6.018 1.00 . A A . 64 GLY HA3 1 1 14 25368 1 1 64 GLY N N 11.166 2.823 -4.292 1.00 . A A . 64 GLY N 1 1 14 25369 1 1 64 GLY O O 8.182 1.728 -4.515 1.00 . A A . 64 GLY O 1 1 14 25370 1 1 65 TYR C C 5.873 3.251 -4.501 1.00 . A A . 65 TYR C 1 1 14 25371 1 1 65 TYR CA C 6.900 4.056 -3.701 1.00 . A A . 65 TYR CA 1 1 14 25372 1 1 65 TYR CB C 6.505 5.534 -3.728 1.00 . A A . 65 TYR CB 1 1 14 25373 1 1 65 TYR CD1 C 4.750 5.569 -1.918 1.00 . A A . 65 TYR CD1 1 1 14 25374 1 1 65 TYR CD2 C 4.132 6.293 -4.111 1.00 . A A . 65 TYR CD2 1 1 14 25375 1 1 65 TYR CE1 C 3.411 5.826 -1.455 1.00 . A A . 65 TYR CE1 1 1 14 25376 1 1 65 TYR CE2 C 2.793 6.551 -3.648 1.00 . A A . 65 TYR CE2 1 1 14 25377 1 1 65 TYR CG C 5.083 5.807 -3.236 1.00 . A A . 65 TYR CG 1 1 14 25378 1 1 65 TYR CZ C 2.499 6.305 -2.343 1.00 . A A . 65 TYR CZ 1 1 14 25379 1 1 65 TYR H H 8.671 4.860 -4.445 1.00 . A A . 65 TYR H 1 1 14 25380 1 1 65 TYR HA H 6.974 3.639 -2.697 1.00 . A A . 65 TYR HA 1 1 14 25381 1 1 65 TYR HB2 H 7.206 6.097 -3.112 1.00 . A A . 65 TYR HB2 1 1 14 25382 1 1 65 TYR HB3 H 6.605 5.907 -4.747 1.00 . A A . 65 TYR HB3 1 1 14 25383 1 1 65 TYR HD1 H 5.501 5.185 -1.228 1.00 . A A . 65 TYR HD1 1 1 14 25384 1 1 65 TYR HD2 H 4.395 6.482 -5.152 1.00 . A A . 65 TYR HD2 1 1 14 25385 1 1 65 TYR HE1 H 3.135 5.642 -0.417 1.00 . A A . 65 TYR HE1 1 1 14 25386 1 1 65 TYR HE2 H 2.032 6.934 -4.328 1.00 . A A . 65 TYR HE2 1 1 14 25387 1 1 65 TYR HH H 0.716 5.694 -1.866 1.00 . A A . 65 TYR HH 1 1 14 25388 1 1 65 TYR N N 8.214 3.980 -4.316 1.00 . A A . 65 TYR N 1 1 14 25389 1 1 65 TYR O O 5.057 2.533 -3.925 1.00 . A A . 65 TYR O 1 1 14 25390 1 1 65 TYR OH O 1.234 6.548 -1.906 1.00 . A A . 65 TYR OH 1 1 14 25391 1 1 66 TYR C C 5.446 1.232 -6.863 1.00 . A A . 66 TYR C 1 1 14 25392 1 1 66 TYR CA C 5.033 2.696 -6.700 1.00 . A A . 66 TYR CA 1 1 14 25393 1 1 66 TYR CB C 5.136 3.397 -8.056 1.00 . A A . 66 TYR CB 1 1 14 25394 1 1 66 TYR CD1 C 5.397 1.588 -9.793 1.00 . A A . 66 TYR CD1 1 1 14 25395 1 1 66 TYR CD2 C 3.337 2.797 -9.717 1.00 . A A . 66 TYR CD2 1 1 14 25396 1 1 66 TYR CE1 C 4.899 0.807 -10.895 1.00 . A A . 66 TYR CE1 1 1 14 25397 1 1 66 TYR CE2 C 2.838 2.016 -10.819 1.00 . A A . 66 TYR CE2 1 1 14 25398 1 1 66 TYR CG C 4.606 2.567 -9.227 1.00 . A A . 66 TYR CG 1 1 14 25399 1 1 66 TYR CZ C 3.644 1.059 -11.354 1.00 . A A . 66 TYR CZ 1 1 14 25400 1 1 66 TYR H H 6.613 3.985 -6.275 1.00 . A A . 66 TYR H 1 1 14 25401 1 1 66 TYR HA H 4.038 2.737 -6.257 1.00 . A A . 66 TYR HA 1 1 14 25402 1 1 66 TYR HB2 H 4.584 4.336 -8.010 1.00 . A A . 66 TYR HB2 1 1 14 25403 1 1 66 TYR HB3 H 6.179 3.649 -8.245 1.00 . A A . 66 TYR HB3 1 1 14 25404 1 1 66 TYR HD1 H 6.400 1.406 -9.405 1.00 . A A . 66 TYR HD1 1 1 14 25405 1 1 66 TYR HD2 H 2.712 3.570 -9.270 1.00 . A A . 66 TYR HD2 1 1 14 25406 1 1 66 TYR HE1 H 5.513 0.031 -11.351 1.00 . A A . 66 TYR HE1 1 1 14 25407 1 1 66 TYR HE2 H 1.837 2.187 -11.216 1.00 . A A . 66 TYR HE2 1 1 14 25408 1 1 66 TYR HH H 3.908 0.146 -13.049 1.00 . A A . 66 TYR HH 1 1 14 25409 1 1 66 TYR N N 5.946 3.399 -5.815 1.00 . A A . 66 TYR N 1 1 14 25410 1 1 66 TYR O O 4.798 0.477 -7.586 1.00 . A A . 66 TYR O 1 1 14 25411 1 1 66 TYR OH O 3.173 0.322 -12.395 1.00 . A A . 66 TYR OH 1 1 14 25412 1 1 67 HIS C C 6.657 -1.231 -4.957 1.00 . A A . 67 HIS C 1 1 14 25413 1 1 67 HIS CA C 7.031 -0.486 -6.240 1.00 . A A . 67 HIS CA 1 1 14 25414 1 1 67 HIS CB C 8.537 -0.492 -6.511 1.00 . A A . 67 HIS CB 1 1 14 25415 1 1 67 HIS CD2 C 9.703 -1.829 -4.591 1.00 . A A . 67 HIS CD2 1 1 14 25416 1 1 67 HIS CE1 C 10.262 -3.604 -5.742 1.00 . A A . 67 HIS CE1 1 1 14 25417 1 1 67 HIS CG C 9.271 -1.646 -5.872 1.00 . A A . 67 HIS CG 1 1 14 25418 1 1 67 HIS H H 7.045 1.494 -5.593 1.00 . A A . 67 HIS H 1 1 14 25419 1 1 67 HIS HA H 6.539 -0.966 -7.085 1.00 . A A . 67 HIS HA 1 1 14 25420 1 1 67 HIS HB2 H 8.702 -0.521 -7.588 1.00 . A A . 67 HIS HB2 1 1 14 25421 1 1 67 HIS HB3 H 8.965 0.443 -6.148 1.00 . A A . 67 HIS HB3 1 1 14 25422 1 1 67 HIS HD1 H 9.463 -2.952 -7.543 1.00 . A A . 67 HIS HD1 1 1 14 25423 1 1 67 HIS HD2 H 9.579 -1.122 -3.770 1.00 . A A . 67 HIS HD2 1 1 14 25424 1 1 67 HIS HE1 H 10.672 -4.581 -5.995 1.00 . A A . 67 HIS HE1 1 1 14 25425 1 1 67 HIS N N 6.523 0.874 -6.179 1.00 . A A . 67 HIS N 1 1 14 25426 1 1 67 HIS ND1 N 9.638 -2.782 -6.574 1.00 . A A . 67 HIS ND1 1 1 14 25427 1 1 67 HIS NE2 N 10.301 -3.011 -4.514 1.00 . A A . 67 HIS NE2 1 1 14 25428 1 1 67 HIS O O 6.800 -2.450 -4.879 1.00 . A A . 67 HIS O 1 1 14 25429 1 1 68 VAL C C 4.263 -1.020 -2.596 1.00 . A A . 68 VAL C 1 1 14 25430 1 1 68 VAL CA C 5.789 -1.039 -2.707 1.00 . A A . 68 VAL CA 1 1 14 25431 1 1 68 VAL CB C 6.481 -0.296 -1.563 1.00 . A A . 68 VAL CB 1 1 14 25432 1 1 68 VAL CG1 C 7.918 -0.788 -1.379 1.00 . A A . 68 VAL CG1 1 1 14 25433 1 1 68 VAL CG2 C 6.444 1.217 -1.790 1.00 . A A . 68 VAL CG2 1 1 14 25434 1 1 68 VAL H H 6.071 0.524 -4.055 1.00 . A A . 68 VAL H 1 1 14 25435 1 1 68 VAL HA H 6.129 -2.075 -2.692 1.00 . A A . 68 VAL HA 1 1 14 25436 1 1 68 VAL HB H 5.933 -0.510 -0.645 1.00 . A A . 68 VAL HB 1 1 14 25437 1 1 68 VAL HG11 H 7.941 -1.876 -1.450 1.00 . A A . 68 VAL HG11 1 1 14 25438 1 1 68 VAL HG12 H 8.551 -0.360 -2.156 1.00 . A A . 68 VAL HG12 1 1 14 25439 1 1 68 VAL HG13 H 8.285 -0.480 -0.400 1.00 . A A . 68 VAL HG13 1 1 14 25440 1 1 68 VAL HG21 H 5.422 1.527 -2.006 1.00 . A A . 68 VAL HG21 1 1 14 25441 1 1 68 VAL HG22 H 6.797 1.727 -0.894 1.00 . A A . 68 VAL HG22 1 1 14 25442 1 1 68 VAL HG23 H 7.088 1.473 -2.632 1.00 . A A . 68 VAL HG23 1 1 14 25443 1 1 68 VAL N N 6.185 -0.467 -3.983 1.00 . A A . 68 VAL N 1 1 14 25444 1 1 68 VAL O O 3.710 -1.321 -1.539 1.00 . A A . 68 VAL O 1 1 14 25445 1 1 69 MET C C 1.612 -1.581 -4.774 1.00 . A A . 69 MET C 1 1 14 25446 1 1 69 MET CA C 2.174 -0.602 -3.742 1.00 . A A . 69 MET CA 1 1 14 25447 1 1 69 MET CB C 1.734 0.820 -4.094 1.00 . A A . 69 MET CB 1 1 14 25448 1 1 69 MET CE C 2.700 2.186 -0.447 1.00 . A A . 69 MET CE 1 1 14 25449 1 1 69 MET CG C 2.357 1.839 -3.138 1.00 . A A . 69 MET CG 1 1 14 25450 1 1 69 MET H H 4.082 -0.422 -4.558 1.00 . A A . 69 MET H 1 1 14 25451 1 1 69 MET HA H 1.842 -0.885 -2.743 1.00 . A A . 69 MET HA 1 1 14 25452 1 1 69 MET HB2 H 2.024 1.051 -5.118 1.00 . A A . 69 MET HB2 1 1 14 25453 1 1 69 MET HB3 H 0.647 0.890 -4.047 1.00 . A A . 69 MET HB3 1 1 14 25454 1 1 69 MET HE1 H 3.457 2.846 -0.870 1.00 . A A . 69 MET HE1 1 1 14 25455 1 1 69 MET HE2 H 2.288 2.637 0.456 1.00 . A A . 69 MET HE2 1 1 14 25456 1 1 69 MET HE3 H 3.152 1.225 -0.200 1.00 . A A . 69 MET HE3 1 1 14 25457 1 1 69 MET HG2 H 3.382 1.551 -2.903 1.00 . A A . 69 MET HG2 1 1 14 25458 1 1 69 MET HG3 H 2.404 2.818 -3.617 1.00 . A A . 69 MET HG3 1 1 14 25459 1 1 69 MET N N 3.625 -0.665 -3.702 1.00 . A A . 69 MET N 1 1 14 25460 1 1 69 MET O O 0.405 -1.814 -4.821 1.00 . A A . 69 MET O 1 1 14 25461 1 1 69 MET SD S 1.394 1.940 -1.639 1.00 . A A . 69 MET SD 1 1 14 25462 1 1 70 HIS C C 3.078 -4.272 -6.593 1.00 . A A . 70 HIS C 1 1 14 25463 1 1 70 HIS CA C 2.122 -3.078 -6.605 1.00 . A A . 70 HIS CA 1 1 14 25464 1 1 70 HIS CB C 2.043 -2.395 -7.971 1.00 . A A . 70 HIS CB 1 1 14 25465 1 1 70 HIS CD2 C 0.084 -0.707 -8.354 1.00 . A A . 70 HIS CD2 1 1 14 25466 1 1 70 HIS CE1 C 1.068 1.091 -7.589 1.00 . A A . 70 HIS CE1 1 1 14 25467 1 1 70 HIS CG C 1.339 -1.059 -7.951 1.00 . A A . 70 HIS CG 1 1 14 25468 1 1 70 HIS H H 3.493 -1.935 -5.531 1.00 . A A . 70 HIS H 1 1 14 25469 1 1 70 HIS HA H 1.120 -3.423 -6.347 1.00 . A A . 70 HIS HA 1 1 14 25470 1 1 70 HIS HB2 H 3.054 -2.255 -8.355 1.00 . A A . 70 HIS HB2 1 1 14 25471 1 1 70 HIS HB3 H 1.526 -3.056 -8.667 1.00 . A A . 70 HIS HB3 1 1 14 25472 1 1 70 HIS HD1 H 2.861 0.166 -7.105 1.00 . A A . 70 HIS HD1 1 1 14 25473 1 1 70 HIS HD2 H -0.659 -1.379 -8.784 1.00 . A A . 70 HIS HD2 1 1 14 25474 1 1 70 HIS HE1 H 1.240 2.127 -7.299 1.00 . A A . 70 HIS HE1 1 1 14 25475 1 1 70 HIS N N 2.513 -2.129 -5.576 1.00 . A A . 70 HIS N 1 1 14 25476 1 1 70 HIS ND1 N 1.934 0.095 -7.474 1.00 . A A . 70 HIS ND1 1 1 14 25477 1 1 70 HIS NE2 N -0.079 0.591 -8.134 1.00 . A A . 70 HIS NE2 1 1 14 25478 1 1 70 HIS O O 2.661 -5.404 -6.353 1.00 . A A . 70 HIS O 1 1 14 25479 1 1 71 ASP C C 5.091 -6.015 -5.753 1.00 . A A . 71 ASP C 1 1 14 25480 1 1 71 ASP CA C 5.363 -5.013 -6.877 1.00 . A A . 71 ASP CA 1 1 14 25481 1 1 71 ASP CB C 6.755 -4.420 -6.655 1.00 . A A . 71 ASP CB 1 1 14 25482 1 1 71 ASP CG C 7.870 -5.058 -7.487 1.00 . A A . 71 ASP CG 1 1 14 25483 1 1 71 ASP H H 4.675 -3.055 -7.048 1.00 . A A . 71 ASP H 1 1 14 25484 1 1 71 ASP HA H 5.289 -5.466 -7.866 1.00 . A A . 71 ASP HA 1 1 14 25485 1 1 71 ASP HB2 H 6.720 -3.354 -6.880 1.00 . A A . 71 ASP HB2 1 1 14 25486 1 1 71 ASP HB3 H 7.010 -4.515 -5.600 1.00 . A A . 71 ASP HB3 1 1 14 25487 1 1 71 ASP N N 4.344 -3.978 -6.854 1.00 . A A . 71 ASP N 1 1 14 25488 1 1 71 ASP O O 4.748 -5.625 -4.638 1.00 . A A . 71 ASP O 1 1 14 25489 1 1 71 ASP OD1 O 8.329 -6.147 -7.080 1.00 . A A . 71 ASP OD1 1 1 14 25490 1 1 71 ASP OD2 O 8.238 -4.442 -8.511 1.00 . A A . 71 ASP OD2 1 1 14 25491 1 1 72 LYS C C 6.379 -8.896 -4.647 1.00 . A A . 72 LYS C 1 1 14 25492 1 1 72 LYS CA C 5.030 -8.348 -5.118 1.00 . A A . 72 LYS CA 1 1 14 25493 1 1 72 LYS CB C 4.102 -9.417 -5.699 1.00 . A A . 72 LYS CB 1 1 14 25494 1 1 72 LYS CD C 2.050 -9.847 -7.101 1.00 . A A . 72 LYS CD 1 1 14 25495 1 1 72 LYS CE C 1.349 -9.325 -8.357 1.00 . A A . 72 LYS CE 1 1 14 25496 1 1 72 LYS CG C 2.964 -8.778 -6.499 1.00 . A A . 72 LYS CG 1 1 14 25497 1 1 72 LYS H H 5.533 -7.596 -6.994 1.00 . A A . 72 LYS H 1 1 14 25498 1 1 72 LYS HA H 4.519 -7.907 -4.262 1.00 . A A . 72 LYS HA 1 1 14 25499 1 1 72 LYS HB2 H 4.671 -10.088 -6.343 1.00 . A A . 72 LYS HB2 1 1 14 25500 1 1 72 LYS HB3 H 3.689 -10.023 -4.893 1.00 . A A . 72 LYS HB3 1 1 14 25501 1 1 72 LYS HD2 H 2.635 -10.733 -7.348 1.00 . A A . 72 LYS HD2 1 1 14 25502 1 1 72 LYS HD3 H 1.307 -10.152 -6.365 1.00 . A A . 72 LYS HD3 1 1 14 25503 1 1 72 LYS HE2 H 0.336 -9.010 -8.110 1.00 . A A . 72 LYS HE2 1 1 14 25504 1 1 72 LYS HE3 H 1.873 -8.446 -8.734 1.00 . A A . 72 LYS HE3 1 1 14 25505 1 1 72 LYS HG2 H 2.384 -8.121 -5.851 1.00 . A A . 72 LYS HG2 1 1 14 25506 1 1 72 LYS HG3 H 3.377 -8.157 -7.294 1.00 . A A . 72 LYS HG3 1 1 14 25507 1 1 72 LYS HZ1 H 1.202 -11.300 -9.006 1.00 . A A . 72 LYS HZ1 1 1 14 25508 1 1 72 LYS HZ2 H 0.538 -10.237 -10.045 1.00 . A A . 72 LYS HZ2 1 1 14 25509 1 1 72 LYS N N 5.254 -7.287 -6.085 1.00 . A A . 72 LYS N 1 1 14 25510 1 1 72 LYS NZ N 1.309 -10.372 -9.401 1.00 . A A . 72 LYS NZ 1 1 14 25511 1 1 72 LYS O O 6.526 -9.283 -3.489 1.00 . A A . 72 LYS O 1 1 14 25512 1 1 73 ASN C C 9.358 -8.428 -4.314 1.00 . A A . 73 ASN C 1 1 14 25513 1 1 73 ASN CA C 8.662 -9.405 -5.263 1.00 . A A . 73 ASN CA 1 1 14 25514 1 1 73 ASN CB C 9.512 -9.521 -6.530 1.00 . A A . 73 ASN CB 1 1 14 25515 1 1 73 ASN CG C 10.601 -10.582 -6.365 1.00 . A A . 73 ASN CG 1 1 14 25516 1 1 73 ASN H H 7.203 -8.594 -6.509 1.00 . A A . 73 ASN H 1 1 14 25517 1 1 73 ASN HA H 8.507 -10.385 -4.812 1.00 . A A . 73 ASN HA 1 1 14 25518 1 1 73 ASN HB2 H 8.875 -9.777 -7.377 1.00 . A A . 73 ASN HB2 1 1 14 25519 1 1 73 ASN HB3 H 9.968 -8.557 -6.755 1.00 . A A . 73 ASN HB3 1 1 14 25520 1 1 73 ASN HD21 H 11.988 -9.135 -6.658 1.00 . A A . 73 ASN HD21 1 1 14 25521 1 1 73 ASN HD22 H 12.621 -10.725 -6.386 1.00 . A A . 73 ASN HD22 1 1 14 25522 1 1 73 ASN N N 7.330 -8.911 -5.569 1.00 . A A . 73 ASN N 1 1 14 25523 1 1 73 ASN ND2 N 11.839 -10.108 -6.479 1.00 . A A . 73 ASN ND2 1 1 14 25524 1 1 73 ASN O O 10.370 -7.826 -4.670 1.00 . A A . 73 ASN O 1 1 14 25525 1 1 73 ASN OD1 O 10.336 -11.752 -6.148 1.00 . A A . 73 ASN OD1 1 1 14 25526 1 1 74 THR C C 9.563 -8.152 -0.805 1.00 . A A . 74 THR C 1 1 14 25527 1 1 74 THR CA C 9.342 -7.405 -2.122 1.00 . A A . 74 THR CA 1 1 14 25528 1 1 74 THR CB C 8.402 -6.205 -1.990 1.00 . A A . 74 THR CB 1 1 14 25529 1 1 74 THR CG2 C 8.158 -5.503 -3.327 1.00 . A A . 74 THR CG2 1 1 14 25530 1 1 74 THR H H 7.966 -8.793 -2.843 1.00 . A A . 74 THR H 1 1 14 25531 1 1 74 THR HA H 10.319 -7.067 -2.466 1.00 . A A . 74 THR HA 1 1 14 25532 1 1 74 THR HB H 8.772 -5.502 -1.243 1.00 . A A . 74 THR HB 1 1 14 25533 1 1 74 THR HG1 H 6.413 -6.110 -1.789 1.00 . A A . 74 THR HG1 1 1 14 25534 1 1 74 THR HG21 H 8.912 -5.819 -4.047 1.00 . A A . 74 THR HG21 1 1 14 25535 1 1 74 THR HG22 H 7.167 -5.765 -3.699 1.00 . A A . 74 THR HG22 1 1 14 25536 1 1 74 THR HG23 H 8.219 -4.423 -3.187 1.00 . A A . 74 THR HG23 1 1 14 25537 1 1 74 THR N N 8.788 -8.300 -3.125 1.00 . A A . 74 THR N 1 1 14 25538 1 1 74 THR O O 8.880 -9.135 -0.523 1.00 . A A . 74 THR O 1 1 14 25539 1 1 74 THR OG1 O 7.142 -6.785 -1.666 1.00 . A A . 74 THR OG1 1 1 14 25540 1 1 75 LYS C C 9.641 -8.125 2.185 1.00 . A A . 75 LYS C 1 1 14 25541 1 1 75 LYS CA C 10.840 -8.264 1.245 1.00 . A A . 75 LYS CA 1 1 14 25542 1 1 75 LYS CB C 12.135 -7.675 1.809 1.00 . A A . 75 LYS CB 1 1 14 25543 1 1 75 LYS CD C 13.686 -7.596 3.796 1.00 . A A . 75 LYS CD 1 1 14 25544 1 1 75 LYS CE C 13.499 -6.325 4.627 1.00 . A A . 75 LYS CE 1 1 14 25545 1 1 75 LYS CG C 12.345 -8.105 3.263 1.00 . A A . 75 LYS CG 1 1 14 25546 1 1 75 LYS H H 11.071 -6.856 -0.272 1.00 . A A . 75 LYS H 1 1 14 25547 1 1 75 LYS HA H 11.019 -9.325 1.068 1.00 . A A . 75 LYS HA 1 1 14 25548 1 1 75 LYS HB2 H 12.981 -8.000 1.204 1.00 . A A . 75 LYS HB2 1 1 14 25549 1 1 75 LYS HB3 H 12.100 -6.587 1.749 1.00 . A A . 75 LYS HB3 1 1 14 25550 1 1 75 LYS HD2 H 14.155 -8.368 4.407 1.00 . A A . 75 LYS HD2 1 1 14 25551 1 1 75 LYS HD3 H 14.360 -7.395 2.964 1.00 . A A . 75 LYS HD3 1 1 14 25552 1 1 75 LYS HE2 H 13.276 -5.484 3.971 1.00 . A A . 75 LYS HE2 1 1 14 25553 1 1 75 LYS HE3 H 12.646 -6.443 5.296 1.00 . A A . 75 LYS HE3 1 1 14 25554 1 1 75 LYS HG2 H 11.534 -7.719 3.881 1.00 . A A . 75 LYS HG2 1 1 14 25555 1 1 75 LYS HG3 H 12.310 -9.192 3.333 1.00 . A A . 75 LYS HG3 1 1 14 25556 1 1 75 LYS HZ1 H 15.038 -5.083 5.286 1.00 . A A . 75 LYS HZ1 1 1 14 25557 1 1 75 LYS HZ2 H 14.567 -6.164 6.410 1.00 . A A . 75 LYS HZ2 1 1 14 25558 1 1 75 LYS N N 10.520 -7.656 -0.035 1.00 . A A . 75 LYS N 1 1 14 25559 1 1 75 LYS NZ N 14.718 -6.037 5.415 1.00 . A A . 75 LYS NZ 1 1 14 25560 1 1 75 LYS O O 9.482 -8.915 3.115 1.00 . A A . 75 LYS O 1 1 14 25561 1 1 76 PHE C C 6.371 -7.031 1.895 1.00 . A A . 76 PHE C 1 1 14 25562 1 1 76 PHE CA C 7.648 -6.864 2.720 1.00 . A A . 76 PHE CA 1 1 14 25563 1 1 76 PHE CB C 7.756 -5.409 3.181 1.00 . A A . 76 PHE CB 1 1 14 25564 1 1 76 PHE CD1 C 8.920 -5.770 5.388 1.00 . A A . 76 PHE CD1 1 1 14 25565 1 1 76 PHE CD2 C 9.931 -4.294 3.803 1.00 . A A . 76 PHE CD2 1 1 14 25566 1 1 76 PHE CE1 C 10.002 -5.525 6.306 1.00 . A A . 76 PHE CE1 1 1 14 25567 1 1 76 PHE CE2 C 11.013 -4.050 4.720 1.00 . A A . 76 PHE CE2 1 1 14 25568 1 1 76 PHE CG C 8.907 -5.149 4.156 1.00 . A A . 76 PHE CG 1 1 14 25569 1 1 76 PHE CZ C 10.996 -4.677 5.927 1.00 . A A . 76 PHE CZ 1 1 14 25570 1 1 76 PHE H H 8.964 -6.479 1.152 1.00 . A A . 76 PHE H 1 1 14 25571 1 1 76 PHE HA H 7.640 -7.584 3.537 1.00 . A A . 76 PHE HA 1 1 14 25572 1 1 76 PHE HB2 H 7.883 -4.770 2.307 1.00 . A A . 76 PHE HB2 1 1 14 25573 1 1 76 PHE HB3 H 6.819 -5.118 3.655 1.00 . A A . 76 PHE HB3 1 1 14 25574 1 1 76 PHE HD1 H 8.111 -6.445 5.667 1.00 . A A . 76 PHE HD1 1 1 14 25575 1 1 76 PHE HD2 H 9.920 -3.804 2.829 1.00 . A A . 76 PHE HD2 1 1 14 25576 1 1 76 PHE HE1 H 10.025 -6.009 7.283 1.00 . A A . 76 PHE HE1 1 1 14 25577 1 1 76 PHE HE2 H 11.828 -3.377 4.454 1.00 . A A . 76 PHE HE2 1 1 14 25578 1 1 76 PHE HZ H 11.800 -4.570 6.698 1.00 . A A . 76 PHE HZ 1 1 14 25579 1 1 76 PHE N N 8.828 -7.116 1.910 1.00 . A A . 76 PHE N 1 1 14 25580 1 1 76 PHE O O 6.402 -6.931 0.669 1.00 . A A . 76 PHE O 1 1 14 25581 1 1 77 LYS C C 3.572 -6.152 1.281 1.00 . A A . 77 LYS C 1 1 14 25582 1 1 77 LYS CA C 3.992 -7.464 1.947 1.00 . A A . 77 LYS CA 1 1 14 25583 1 1 77 LYS CB C 2.960 -8.007 2.938 1.00 . A A . 77 LYS CB 1 1 14 25584 1 1 77 LYS CD C 2.753 -9.835 4.663 1.00 . A A . 77 LYS CD 1 1 14 25585 1 1 77 LYS CE C 1.923 -11.120 4.658 1.00 . A A . 77 LYS CE 1 1 14 25586 1 1 77 LYS CG C 3.224 -9.482 3.251 1.00 . A A . 77 LYS CG 1 1 14 25587 1 1 77 LYS H H 5.260 -7.360 3.596 1.00 . A A . 77 LYS H 1 1 14 25588 1 1 77 LYS HA H 4.123 -8.219 1.172 1.00 . A A . 77 LYS HA 1 1 14 25589 1 1 77 LYS HB2 H 2.993 -7.425 3.859 1.00 . A A . 77 LYS HB2 1 1 14 25590 1 1 77 LYS HB3 H 1.958 -7.893 2.525 1.00 . A A . 77 LYS HB3 1 1 14 25591 1 1 77 LYS HD2 H 3.616 -9.958 5.318 1.00 . A A . 77 LYS HD2 1 1 14 25592 1 1 77 LYS HD3 H 2.160 -9.016 5.069 1.00 . A A . 77 LYS HD3 1 1 14 25593 1 1 77 LYS HE2 H 0.862 -10.875 4.698 1.00 . A A . 77 LYS HE2 1 1 14 25594 1 1 77 LYS HE3 H 2.089 -11.664 3.728 1.00 . A A . 77 LYS HE3 1 1 14 25595 1 1 77 LYS HG2 H 2.709 -10.109 2.524 1.00 . A A . 77 LYS HG2 1 1 14 25596 1 1 77 LYS HG3 H 4.290 -9.692 3.156 1.00 . A A . 77 LYS HG3 1 1 14 25597 1 1 77 LYS HZ1 H 1.575 -11.955 6.536 1.00 . A A . 77 LYS HZ1 1 1 14 25598 1 1 77 LYS HZ2 H 2.401 -12.946 5.542 1.00 . A A . 77 LYS HZ2 1 1 14 25599 1 1 77 LYS N N 5.277 -7.282 2.599 1.00 . A A . 77 LYS N 1 1 14 25600 1 1 77 LYS NZ N 2.284 -11.975 5.811 1.00 . A A . 77 LYS NZ 1 1 14 25601 1 1 77 LYS O O 3.521 -5.109 1.932 1.00 . A A . 77 LYS O 1 1 14 25602 1 1 78 SER C C 1.346 -5.057 -0.907 1.00 . A A . 78 SER C 1 1 14 25603 1 1 78 SER CA C 2.869 -5.080 -0.770 1.00 . A A . 78 SER CA 1 1 14 25604 1 1 78 SER CB C 3.527 -5.064 -2.152 1.00 . A A . 78 SER CB 1 1 14 25605 1 1 78 SER H H 3.326 -7.098 -0.530 1.00 . A A . 78 SER H 1 1 14 25606 1 1 78 SER HA H 3.215 -4.222 -0.194 1.00 . A A . 78 SER HA 1 1 14 25607 1 1 78 SER HB2 H 3.565 -4.039 -2.522 1.00 . A A . 78 SER HB2 1 1 14 25608 1 1 78 SER HB3 H 4.556 -5.411 -2.068 1.00 . A A . 78 SER HB3 1 1 14 25609 1 1 78 SER HG H 3.169 -5.714 -4.010 1.00 . A A . 78 SER HG 1 1 14 25610 1 1 78 SER N N 3.283 -6.247 -0.008 1.00 . A A . 78 SER N 1 1 14 25611 1 1 78 SER O O 0.696 -6.098 -0.824 1.00 . A A . 78 SER O 1 1 14 25612 1 1 78 SER OG O 2.826 -5.879 -3.086 1.00 . A A . 78 SER OG 1 1 14 25613 1 1 79 CYS C C -1.141 -4.799 -2.171 1.00 . A A . 79 CYS C 1 1 14 25614 1 1 79 CYS CA C -0.615 -3.686 -1.263 1.00 . A A . 79 CYS CA 1 1 14 25615 1 1 79 CYS CB C -0.965 -2.297 -1.801 1.00 . A A . 79 CYS CB 1 1 14 25616 1 1 79 CYS H H 1.356 -3.017 -1.181 1.00 . A A . 79 CYS H 1 1 14 25617 1 1 79 CYS HA H -1.045 -3.765 -0.264 1.00 . A A . 79 CYS HA 1 1 14 25618 1 1 79 CYS HB2 H -0.637 -2.231 -2.838 1.00 . A A . 79 CYS HB2 1 1 14 25619 1 1 79 CYS HB3 H -2.049 -2.186 -1.802 1.00 . A A . 79 CYS HB3 1 1 14 25620 1 1 79 CYS N N 0.820 -3.858 -1.114 1.00 . A A . 79 CYS N 1 1 14 25621 1 1 79 CYS O O -1.891 -5.666 -1.725 1.00 . A A . 79 CYS O 1 1 14 25622 1 1 79 CYS SG S -0.234 -0.905 -0.865 1.00 . A A . 79 CYS SG 1 1 14 25623 1 1 80 VAL C C -0.623 -7.106 -3.983 1.00 . A A . 80 VAL C 1 1 14 25624 1 1 80 VAL CA C -1.147 -5.731 -4.403 1.00 . A A . 80 VAL CA 1 1 14 25625 1 1 80 VAL CB C -0.687 -5.317 -5.802 1.00 . A A . 80 VAL CB 1 1 14 25626 1 1 80 VAL CG1 C -1.023 -6.398 -6.831 1.00 . A A . 80 VAL CG1 1 1 14 25627 1 1 80 VAL CG2 C -1.294 -3.971 -6.203 1.00 . A A . 80 VAL CG2 1 1 14 25628 1 1 80 VAL H H -0.116 -4.030 -3.782 1.00 . A A . 80 VAL H 1 1 14 25629 1 1 80 VAL HA H -2.237 -5.754 -4.399 1.00 . A A . 80 VAL HA 1 1 14 25630 1 1 80 VAL HB H 0.396 -5.202 -5.778 1.00 . A A . 80 VAL HB 1 1 14 25631 1 1 80 VAL HG11 H -1.806 -7.046 -6.436 1.00 . A A . 80 VAL HG11 1 1 14 25632 1 1 80 VAL HG12 H -1.371 -5.928 -7.751 1.00 . A A . 80 VAL HG12 1 1 14 25633 1 1 80 VAL HG13 H -0.132 -6.990 -7.040 1.00 . A A . 80 VAL HG13 1 1 14 25634 1 1 80 VAL HG21 H -1.153 -3.254 -5.394 1.00 . A A . 80 VAL HG21 1 1 14 25635 1 1 80 VAL HG22 H -0.801 -3.604 -7.103 1.00 . A A . 80 VAL HG22 1 1 14 25636 1 1 80 VAL HG23 H -2.359 -4.096 -6.397 1.00 . A A . 80 VAL HG23 1 1 14 25637 1 1 80 VAL N N -0.727 -4.739 -3.428 1.00 . A A . 80 VAL N 1 1 14 25638 1 1 80 VAL O O -1.295 -8.117 -4.181 1.00 . A A . 80 VAL O 1 1 14 25639 1 1 81 GLY C C 0.253 -9.121 -2.049 1.00 . A A . 81 GLY C 1 1 14 25640 1 1 81 GLY CA C 1.194 -8.333 -2.963 1.00 . A A . 81 GLY CA 1 1 14 25641 1 1 81 GLY H H 1.112 -6.272 -3.254 1.00 . A A . 81 GLY H 1 1 14 25642 1 1 81 GLY HA2 H 1.464 -8.943 -3.825 1.00 . A A . 81 GLY HA2 1 1 14 25643 1 1 81 GLY HA3 H 2.118 -8.107 -2.431 1.00 . A A . 81 GLY HA3 1 1 14 25644 1 1 81 GLY N N 0.572 -7.099 -3.411 1.00 . A A . 81 GLY N 1 1 14 25645 1 1 81 GLY O O -0.111 -10.255 -2.356 1.00 . A A . 81 GLY O 1 1 14 25646 1 1 82 CYS C C -2.357 -9.347 -0.662 1.00 . A A . 82 CYS C 1 1 14 25647 1 1 82 CYS CA C -1.006 -9.116 0.016 1.00 . A A . 82 CYS CA 1 1 14 25648 1 1 82 CYS CB C -1.143 -8.280 1.291 1.00 . A A . 82 CYS CB 1 1 14 25649 1 1 82 CYS H H 0.186 -7.566 -0.702 1.00 . A A . 82 CYS H 1 1 14 25650 1 1 82 CYS HA H -0.546 -10.063 0.297 1.00 . A A . 82 CYS HA 1 1 14 25651 1 1 82 CYS HB2 H -0.159 -8.093 1.720 1.00 . A A . 82 CYS HB2 1 1 14 25652 1 1 82 CYS HB3 H -1.577 -7.309 1.054 1.00 . A A . 82 CYS HB3 1 1 14 25653 1 1 82 CYS N N -0.115 -8.488 -0.944 1.00 . A A . 82 CYS N 1 1 14 25654 1 1 82 CYS O O -2.943 -10.422 -0.537 1.00 . A A . 82 CYS O 1 1 14 25655 1 1 82 CYS SG S -2.197 -9.156 2.503 1.00 . A A . 82 CYS SG 1 1 14 25656 1 1 83 HIS C C -4.105 -9.642 -2.957 1.00 . A A . 83 HIS C 1 1 14 25657 1 1 83 HIS CA C -4.085 -8.400 -2.065 1.00 . A A . 83 HIS CA 1 1 14 25658 1 1 83 HIS CB C -4.360 -7.109 -2.839 1.00 . A A . 83 HIS CB 1 1 14 25659 1 1 83 HIS CD2 C -4.762 -5.721 -0.660 1.00 . A A . 83 HIS CD2 1 1 14 25660 1 1 83 HIS CE1 C -6.041 -4.165 -1.513 1.00 . A A . 83 HIS CE1 1 1 14 25661 1 1 83 HIS CG C -4.912 -5.989 -1.989 1.00 . A A . 83 HIS CG 1 1 14 25662 1 1 83 HIS H H -2.331 -7.451 -1.464 1.00 . A A . 83 HIS H 1 1 14 25663 1 1 83 HIS HA H -4.856 -8.500 -1.301 1.00 . A A . 83 HIS HA 1 1 14 25664 1 1 83 HIS HB2 H -3.435 -6.774 -3.307 1.00 . A A . 83 HIS HB2 1 1 14 25665 1 1 83 HIS HB3 H -5.065 -7.323 -3.642 1.00 . A A . 83 HIS HB3 1 1 14 25666 1 1 83 HIS HD1 H -6.021 -4.908 -3.451 1.00 . A A . 83 HIS HD1 1 1 14 25667 1 1 83 HIS HD2 H -4.180 -6.313 0.047 1.00 . A A . 83 HIS HD2 1 1 14 25668 1 1 83 HIS HE1 H -6.669 -3.278 -1.598 1.00 . A A . 83 HIS HE1 1 1 14 25669 1 1 83 HIS N N -2.813 -8.322 -1.366 1.00 . A A . 83 HIS N 1 1 14 25670 1 1 83 HIS ND1 N -5.724 -4.991 -2.499 1.00 . A A . 83 HIS ND1 1 1 14 25671 1 1 83 HIS NE2 N -5.443 -4.619 -0.375 1.00 . A A . 83 HIS NE2 1 1 14 25672 1 1 83 HIS O O -5.096 -10.370 -2.993 1.00 . A A . 83 HIS O 1 1 14 25673 1 1 84 VAL C C -3.125 -12.274 -3.759 1.00 . A A . 84 VAL C 1 1 14 25674 1 1 84 VAL CA C -2.876 -10.988 -4.548 1.00 . A A . 84 VAL CA 1 1 14 25675 1 1 84 VAL CB C -1.513 -10.966 -5.242 1.00 . A A . 84 VAL CB 1 1 14 25676 1 1 84 VAL CG1 C -1.259 -12.276 -5.992 1.00 . A A . 84 VAL CG1 1 1 14 25677 1 1 84 VAL CG2 C -1.395 -9.764 -6.182 1.00 . A A . 84 VAL CG2 1 1 14 25678 1 1 84 VAL H H -2.197 -9.249 -3.623 1.00 . A A . 84 VAL H 1 1 14 25679 1 1 84 VAL HA H -3.647 -10.891 -5.314 1.00 . A A . 84 VAL HA 1 1 14 25680 1 1 84 VAL HB H -0.747 -10.866 -4.473 1.00 . A A . 84 VAL HB 1 1 14 25681 1 1 84 VAL HG11 H -2.118 -12.936 -5.872 1.00 . A A . 84 VAL HG11 1 1 14 25682 1 1 84 VAL HG12 H -1.108 -12.065 -7.051 1.00 . A A . 84 VAL HG12 1 1 14 25683 1 1 84 VAL HG13 H -0.370 -12.759 -5.588 1.00 . A A . 84 VAL HG13 1 1 14 25684 1 1 84 VAL HG21 H -2.212 -9.069 -5.987 1.00 . A A . 84 VAL HG21 1 1 14 25685 1 1 84 VAL HG22 H -0.443 -9.262 -6.012 1.00 . A A . 84 VAL HG22 1 1 14 25686 1 1 84 VAL HG23 H -1.447 -10.105 -7.216 1.00 . A A . 84 VAL HG23 1 1 14 25687 1 1 84 VAL N N -2.999 -9.846 -3.657 1.00 . A A . 84 VAL N 1 1 14 25688 1 1 84 VAL O O -3.745 -13.208 -4.265 1.00 . A A . 84 VAL O 1 1 14 25689 1 1 85 GLU C C -4.222 -13.513 -1.138 1.00 . A A . 85 GLU C 1 1 14 25690 1 1 85 GLU CA C -2.788 -13.439 -1.666 1.00 . A A . 85 GLU CA 1 1 14 25691 1 1 85 GLU CB C -1.781 -13.407 -0.515 1.00 . A A . 85 GLU CB 1 1 14 25692 1 1 85 GLU CD C -0.452 -15.414 0.238 1.00 . A A . 85 GLU CD 1 1 14 25693 1 1 85 GLU CG C -0.580 -14.308 -0.812 1.00 . A A . 85 GLU CG 1 1 14 25694 1 1 85 GLU H H -2.125 -11.519 -2.126 1.00 . A A . 85 GLU H 1 1 14 25695 1 1 85 GLU HA H -2.582 -14.303 -2.297 1.00 . A A . 85 GLU HA 1 1 14 25696 1 1 85 GLU HB2 H -1.441 -12.384 -0.353 1.00 . A A . 85 GLU HB2 1 1 14 25697 1 1 85 GLU HB3 H -2.265 -13.732 0.406 1.00 . A A . 85 GLU HB3 1 1 14 25698 1 1 85 GLU HG2 H -0.690 -14.752 -1.801 1.00 . A A . 85 GLU HG2 1 1 14 25699 1 1 85 GLU HG3 H 0.331 -13.711 -0.829 1.00 . A A . 85 GLU HG3 1 1 14 25700 1 1 85 GLU N N -2.628 -12.282 -2.530 1.00 . A A . 85 GLU N 1 1 14 25701 1 1 85 GLU O O -4.763 -14.601 -0.950 1.00 . A A . 85 GLU O 1 1 14 25702 1 1 85 GLU OE1 O -1.509 -15.968 0.610 1.00 . A A . 85 GLU OE1 1 1 14 25703 1 1 85 GLU OE2 O 0.700 -15.680 0.644 1.00 . A A . 85 GLU OE2 1 1 14 25704 1 1 86 VAL C C -7.133 -12.636 -1.525 1.00 . A A . 86 VAL C 1 1 14 25705 1 1 86 VAL CA C -6.157 -12.258 -0.409 1.00 . A A . 86 VAL CA 1 1 14 25706 1 1 86 VAL CB C -6.419 -10.865 0.167 1.00 . A A . 86 VAL CB 1 1 14 25707 1 1 86 VAL CG1 C -7.861 -10.739 0.663 1.00 . A A . 86 VAL CG1 1 1 14 25708 1 1 86 VAL CG2 C -5.424 -10.538 1.283 1.00 . A A . 86 VAL CG2 1 1 14 25709 1 1 86 VAL H H -4.350 -11.459 -1.068 1.00 . A A . 86 VAL H 1 1 14 25710 1 1 86 VAL HA H -6.253 -12.982 0.400 1.00 . A A . 86 VAL HA 1 1 14 25711 1 1 86 VAL HB H -6.275 -10.139 -0.633 1.00 . A A . 86 VAL HB 1 1 14 25712 1 1 86 VAL HG11 H -8.447 -11.580 0.293 1.00 . A A . 86 VAL HG11 1 1 14 25713 1 1 86 VAL HG12 H -7.871 -10.740 1.753 1.00 . A A . 86 VAL HG12 1 1 14 25714 1 1 86 VAL HG13 H -8.291 -9.807 0.297 1.00 . A A . 86 VAL HG13 1 1 14 25715 1 1 86 VAL HG21 H -4.551 -11.184 1.192 1.00 . A A . 86 VAL HG21 1 1 14 25716 1 1 86 VAL HG22 H -5.115 -9.496 1.200 1.00 . A A . 86 VAL HG22 1 1 14 25717 1 1 86 VAL HG23 H -5.898 -10.700 2.251 1.00 . A A . 86 VAL HG23 1 1 14 25718 1 1 86 VAL N N -4.797 -12.340 -0.913 1.00 . A A . 86 VAL N 1 1 14 25719 1 1 86 VAL O O -7.976 -13.514 -1.347 1.00 . A A . 86 VAL O 1 1 14 25720 1 1 87 ALA C C -7.596 -13.626 -4.312 1.00 . A A . 87 ALA C 1 1 14 25721 1 1 87 ALA CA C -7.845 -12.207 -3.797 1.00 . A A . 87 ALA CA 1 1 14 25722 1 1 87 ALA CB C -7.593 -11.145 -4.869 1.00 . A A . 87 ALA CB 1 1 14 25723 1 1 87 ALA H H -6.299 -11.242 -2.789 1.00 . A A . 87 ALA H 1 1 14 25724 1 1 87 ALA HA H -8.879 -12.128 -3.460 1.00 . A A . 87 ALA HA 1 1 14 25725 1 1 87 ALA HB1 H -6.530 -11.117 -5.110 1.00 . A A . 87 ALA HB1 1 1 14 25726 1 1 87 ALA HB2 H -8.163 -11.390 -5.765 1.00 . A A . 87 ALA HB2 1 1 14 25727 1 1 87 ALA HB3 H -7.906 -10.170 -4.495 1.00 . A A . 87 ALA HB3 1 1 14 25728 1 1 87 ALA N N -6.987 -11.954 -2.652 1.00 . A A . 87 ALA N 1 1 14 25729 1 1 87 ALA O O -8.517 -14.288 -4.788 1.00 . A A . 87 ALA O 1 1 14 25730 1 1 88 GLY C C -6.441 -15.632 -6.080 1.00 . A A . 88 GLY C 1 1 14 25731 1 1 88 GLY CA C -5.964 -15.379 -4.648 1.00 . A A . 88 GLY CA 1 1 14 25732 1 1 88 GLY H H -5.603 -13.506 -3.811 1.00 . A A . 88 GLY H 1 1 14 25733 1 1 88 GLY HA2 H -4.880 -15.486 -4.598 1.00 . A A . 88 GLY HA2 1 1 14 25734 1 1 88 GLY HA3 H -6.389 -16.129 -3.981 1.00 . A A . 88 GLY HA3 1 1 14 25735 1 1 88 GLY N N -6.346 -14.051 -4.199 1.00 . A A . 88 GLY N 1 1 14 25736 1 1 88 GLY O O -5.926 -15.035 -7.024 1.00 . A A . 88 GLY O 1 1 14 25737 1 1 89 ALA C C -9.494 -16.717 -7.451 1.00 . A A . 89 ALA C 1 1 14 25738 1 1 89 ALA CA C -7.971 -16.858 -7.496 1.00 . A A . 89 ALA CA 1 1 14 25739 1 1 89 ALA CB C -7.528 -18.270 -7.886 1.00 . A A . 89 ALA CB 1 1 14 25740 1 1 89 ALA H H -7.832 -16.999 -5.422 1.00 . A A . 89 ALA H 1 1 14 25741 1 1 89 ALA HA H -7.570 -16.151 -8.222 1.00 . A A . 89 ALA HA 1 1 14 25742 1 1 89 ALA HB1 H -7.304 -18.842 -6.986 1.00 . A A . 89 ALA HB1 1 1 14 25743 1 1 89 ALA HB2 H -8.327 -18.761 -8.440 1.00 . A A . 89 ALA HB2 1 1 14 25744 1 1 89 ALA HB3 H -6.636 -18.211 -8.510 1.00 . A A . 89 ALA HB3 1 1 14 25745 1 1 89 ALA N N -7.419 -16.518 -6.195 1.00 . A A . 89 ALA N 1 1 14 25746 1 1 89 ALA O O -10.217 -17.694 -7.643 1.00 . A A . 89 ALA O 1 1 14 25747 1 1 90 ASP C C -11.775 -14.387 -8.343 1.00 . A A . 90 ASP C 1 1 14 25748 1 1 90 ASP CA C -11.360 -15.213 -7.124 1.00 . A A . 90 ASP CA 1 1 14 25749 1 1 90 ASP CB C -11.698 -14.406 -5.869 1.00 . A A . 90 ASP CB 1 1 14 25750 1 1 90 ASP CG C -13.111 -13.819 -5.839 1.00 . A A . 90 ASP CG 1 1 14 25751 1 1 90 ASP H H -9.341 -14.705 -7.042 1.00 . A A . 90 ASP H 1 1 14 25752 1 1 90 ASP HA H -11.843 -16.189 -7.097 1.00 . A A . 90 ASP HA 1 1 14 25753 1 1 90 ASP HB2 H -11.569 -15.048 -4.997 1.00 . A A . 90 ASP HB2 1 1 14 25754 1 1 90 ASP HB3 H -10.980 -13.592 -5.774 1.00 . A A . 90 ASP HB3 1 1 14 25755 1 1 90 ASP N N -9.936 -15.494 -7.197 1.00 . A A . 90 ASP N 1 1 14 25756 1 1 90 ASP O O -12.945 -14.377 -8.721 1.00 . A A . 90 ASP O 1 1 14 25757 1 1 90 ASP OD1 O -14.059 -14.627 -5.738 1.00 . A A . 90 ASP OD1 1 1 14 25758 1 1 90 ASP OD2 O -13.210 -12.575 -5.919 1.00 . A A . 90 ASP OD2 1 1 14 25759 1 1 91 ALA C C -11.619 -11.544 -9.648 1.00 . A A . 91 ALA C 1 1 14 25760 1 1 91 ALA CA C -11.041 -12.888 -10.094 1.00 . A A . 91 ALA CA 1 1 14 25761 1 1 91 ALA CB C -11.969 -13.631 -11.057 1.00 . A A . 91 ALA CB 1 1 14 25762 1 1 91 ALA H H -9.843 -13.729 -8.612 1.00 . A A . 91 ALA H 1 1 14 25763 1 1 91 ALA HA H -10.085 -12.717 -10.589 1.00 . A A . 91 ALA HA 1 1 14 25764 1 1 91 ALA HB1 H -12.084 -14.663 -10.727 1.00 . A A . 91 ALA HB1 1 1 14 25765 1 1 91 ALA HB2 H -12.944 -13.143 -11.072 1.00 . A A . 91 ALA HB2 1 1 14 25766 1 1 91 ALA HB3 H -11.540 -13.616 -12.059 1.00 . A A . 91 ALA HB3 1 1 14 25767 1 1 91 ALA N N -10.792 -13.715 -8.925 1.00 . A A . 91 ALA N 1 1 14 25768 1 1 91 ALA O O -10.909 -10.540 -9.613 1.00 . A A . 91 ALA O 1 1 14 25769 1 1 92 ALA C C -12.661 -9.570 -7.950 1.00 . A A . 92 ALA C 1 1 14 25770 1 1 92 ALA CA C -13.584 -10.363 -8.877 1.00 . A A . 92 ALA CA 1 1 14 25771 1 1 92 ALA CB C -14.904 -10.741 -8.202 1.00 . A A . 92 ALA CB 1 1 14 25772 1 1 92 ALA H H -13.473 -12.388 -9.351 1.00 . A A . 92 ALA H 1 1 14 25773 1 1 92 ALA HA H -13.801 -9.761 -9.760 1.00 . A A . 92 ALA HA 1 1 14 25774 1 1 92 ALA HB1 H -15.412 -11.500 -8.797 1.00 . A A . 92 ALA HB1 1 1 14 25775 1 1 92 ALA HB2 H -14.703 -11.135 -7.206 1.00 . A A . 92 ALA HB2 1 1 14 25776 1 1 92 ALA HB3 H -15.538 -9.858 -8.122 1.00 . A A . 92 ALA HB3 1 1 14 25777 1 1 92 ALA N N -12.903 -11.567 -9.319 1.00 . A A . 92 ALA N 1 1 14 25778 1 1 92 ALA O O -12.417 -8.386 -8.174 1.00 . A A . 92 ALA O 1 1 14 25779 1 1 93 LYS C C -9.943 -9.324 -6.638 1.00 . A A . 93 LYS C 1 1 14 25780 1 1 93 LYS CA C -11.282 -9.631 -5.964 1.00 . A A . 93 LYS CA 1 1 14 25781 1 1 93 LYS CB C -11.154 -10.499 -4.710 1.00 . A A . 93 LYS CB 1 1 14 25782 1 1 93 LYS CD C -12.636 -9.072 -3.251 1.00 . A A . 93 LYS CD 1 1 14 25783 1 1 93 LYS CE C -13.998 -8.488 -3.631 1.00 . A A . 93 LYS CE 1 1 14 25784 1 1 93 LYS CG C -12.438 -10.454 -3.878 1.00 . A A . 93 LYS CG 1 1 14 25785 1 1 93 LYS H H -12.376 -11.219 -6.751 1.00 . A A . 93 LYS H 1 1 14 25786 1 1 93 LYS HA H -11.739 -8.690 -5.658 1.00 . A A . 93 LYS HA 1 1 14 25787 1 1 93 LYS HB2 H -10.938 -11.529 -4.996 1.00 . A A . 93 LYS HB2 1 1 14 25788 1 1 93 LYS HB3 H -10.314 -10.153 -4.108 1.00 . A A . 93 LYS HB3 1 1 14 25789 1 1 93 LYS HD2 H -12.558 -9.147 -2.167 1.00 . A A . 93 LYS HD2 1 1 14 25790 1 1 93 LYS HD3 H -11.843 -8.402 -3.582 1.00 . A A . 93 LYS HD3 1 1 14 25791 1 1 93 LYS HE2 H -13.882 -7.448 -3.935 1.00 . A A . 93 LYS HE2 1 1 14 25792 1 1 93 LYS HE3 H -14.405 -9.026 -4.487 1.00 . A A . 93 LYS HE3 1 1 14 25793 1 1 93 LYS HG2 H -13.293 -10.697 -4.509 1.00 . A A . 93 LYS HG2 1 1 14 25794 1 1 93 LYS HG3 H -12.394 -11.210 -3.095 1.00 . A A . 93 LYS HG3 1 1 14 25795 1 1 93 LYS HZ1 H -15.878 -8.803 -2.789 1.00 . A A . 93 LYS HZ1 1 1 14 25796 1 1 93 LYS HZ2 H -14.659 -9.289 -1.824 1.00 . A A . 93 LYS HZ2 1 1 14 25797 1 1 93 LYS N N -12.173 -10.256 -6.926 1.00 . A A . 93 LYS N 1 1 14 25798 1 1 93 LYS NZ N -14.936 -8.576 -2.490 1.00 . A A . 93 LYS NZ 1 1 14 25799 1 1 93 LYS O O -9.311 -8.312 -6.339 1.00 . A A . 93 LYS O 1 1 14 25800 1 1 94 LYS C C -8.377 -8.802 -9.130 1.00 . A A . 94 LYS C 1 1 14 25801 1 1 94 LYS CA C -8.298 -10.054 -8.254 1.00 . A A . 94 LYS CA 1 1 14 25802 1 1 94 LYS CB C -7.957 -11.327 -9.031 1.00 . A A . 94 LYS CB 1 1 14 25803 1 1 94 LYS CD C -6.241 -11.855 -10.802 1.00 . A A . 94 LYS CD 1 1 14 25804 1 1 94 LYS CE C -4.753 -12.065 -11.085 1.00 . A A . 94 LYS CE 1 1 14 25805 1 1 94 LYS CG C -6.465 -11.383 -9.364 1.00 . A A . 94 LYS CG 1 1 14 25806 1 1 94 LYS H H -10.070 -11.037 -7.772 1.00 . A A . 94 LYS H 1 1 14 25807 1 1 94 LYS HA H -7.512 -9.908 -7.512 1.00 . A A . 94 LYS HA 1 1 14 25808 1 1 94 LYS HB2 H -8.235 -12.202 -8.443 1.00 . A A . 94 LYS HB2 1 1 14 25809 1 1 94 LYS HB3 H -8.540 -11.364 -9.950 1.00 . A A . 94 LYS HB3 1 1 14 25810 1 1 94 LYS HD2 H -6.783 -12.786 -10.972 1.00 . A A . 94 LYS HD2 1 1 14 25811 1 1 94 LYS HD3 H -6.647 -11.120 -11.497 1.00 . A A . 94 LYS HD3 1 1 14 25812 1 1 94 LYS HE2 H -4.188 -12.008 -10.155 1.00 . A A . 94 LYS HE2 1 1 14 25813 1 1 94 LYS HE3 H -4.592 -13.062 -11.496 1.00 . A A . 94 LYS HE3 1 1 14 25814 1 1 94 LYS HG2 H -6.021 -10.397 -9.228 1.00 . A A . 94 LYS HG2 1 1 14 25815 1 1 94 LYS HG3 H -5.959 -12.058 -8.673 1.00 . A A . 94 LYS HG3 1 1 14 25816 1 1 94 LYS HZ1 H -3.576 -10.427 -11.609 1.00 . A A . 94 LYS HZ1 1 1 14 25817 1 1 94 LYS HZ2 H -3.808 -11.464 -12.843 1.00 . A A . 94 LYS HZ2 1 1 14 25818 1 1 94 LYS N N -9.550 -10.217 -7.535 1.00 . A A . 94 LYS N 1 1 14 25819 1 1 94 LYS NZ N -4.257 -11.045 -12.036 1.00 . A A . 94 LYS NZ 1 1 14 25820 1 1 94 LYS O O -7.368 -8.357 -9.675 1.00 . A A . 94 LYS O 1 1 14 25821 1 1 95 LYS C C -10.339 -5.957 -9.140 1.00 . A A . 95 LYS C 1 1 14 25822 1 1 95 LYS CA C -9.809 -7.077 -10.038 1.00 . A A . 95 LYS CA 1 1 14 25823 1 1 95 LYS CB C -10.717 -7.394 -11.228 1.00 . A A . 95 LYS CB 1 1 14 25824 1 1 95 LYS CD C -10.678 -7.512 -13.747 1.00 . A A . 95 LYS CD 1 1 14 25825 1 1 95 LYS CE C -9.517 -7.879 -14.673 1.00 . A A . 95 LYS CE 1 1 14 25826 1 1 95 LYS CG C -10.178 -6.760 -12.512 1.00 . A A . 95 LYS CG 1 1 14 25827 1 1 95 LYS H H -10.401 -8.637 -8.790 1.00 . A A . 95 LYS H 1 1 14 25828 1 1 95 LYS HA H -8.844 -6.769 -10.441 1.00 . A A . 95 LYS HA 1 1 14 25829 1 1 95 LYS HB2 H -10.793 -8.474 -11.356 1.00 . A A . 95 LYS HB2 1 1 14 25830 1 1 95 LYS HB3 H -11.723 -7.025 -11.030 1.00 . A A . 95 LYS HB3 1 1 14 25831 1 1 95 LYS HD2 H -11.202 -8.417 -13.438 1.00 . A A . 95 LYS HD2 1 1 14 25832 1 1 95 LYS HD3 H -11.398 -6.897 -14.286 1.00 . A A . 95 LYS HD3 1 1 14 25833 1 1 95 LYS HE2 H -8.619 -7.340 -14.371 1.00 . A A . 95 LYS HE2 1 1 14 25834 1 1 95 LYS HE3 H -9.294 -8.943 -14.583 1.00 . A A . 95 LYS HE3 1 1 14 25835 1 1 95 LYS HG2 H -10.491 -5.717 -12.566 1.00 . A A . 95 LYS HG2 1 1 14 25836 1 1 95 LYS HG3 H -9.088 -6.765 -12.495 1.00 . A A . 95 LYS HG3 1 1 14 25837 1 1 95 LYS HZ1 H -9.821 -8.372 -16.675 1.00 . A A . 95 LYS HZ1 1 1 14 25838 1 1 95 LYS HZ2 H -10.781 -7.160 -16.165 1.00 . A A . 95 LYS HZ2 1 1 14 25839 1 1 95 LYS N N -9.585 -8.269 -9.237 1.00 . A A . 95 LYS N 1 1 14 25840 1 1 95 LYS NZ N -9.851 -7.553 -16.077 1.00 . A A . 95 LYS NZ 1 1 14 25841 1 1 95 LYS O O -10.467 -4.815 -9.578 1.00 . A A . 95 LYS O 1 1 14 25842 1 1 96 ASP C C -10.108 -5.147 -5.838 1.00 . A A . 96 ASP C 1 1 14 25843 1 1 96 ASP CA C -11.147 -5.365 -6.939 1.00 . A A . 96 ASP CA 1 1 14 25844 1 1 96 ASP CB C -12.431 -5.877 -6.282 1.00 . A A . 96 ASP CB 1 1 14 25845 1 1 96 ASP CG C -13.709 -5.152 -6.708 1.00 . A A . 96 ASP CG 1 1 14 25846 1 1 96 ASP H H -10.526 -7.256 -7.554 1.00 . A A . 96 ASP H 1 1 14 25847 1 1 96 ASP HA H -11.343 -4.460 -7.513 1.00 . A A . 96 ASP HA 1 1 14 25848 1 1 96 ASP HB2 H -12.539 -6.938 -6.510 1.00 . A A . 96 ASP HB2 1 1 14 25849 1 1 96 ASP HB3 H -12.326 -5.793 -5.201 1.00 . A A . 96 ASP HB3 1 1 14 25850 1 1 96 ASP N N -10.633 -6.324 -7.902 1.00 . A A . 96 ASP N 1 1 14 25851 1 1 96 ASP O O -10.263 -4.260 -5.000 1.00 . A A . 96 ASP O 1 1 14 25852 1 1 96 ASP OD1 O -13.683 -3.902 -6.696 1.00 . A A . 96 ASP OD1 1 1 14 25853 1 1 96 ASP OD2 O -14.683 -5.864 -7.035 1.00 . A A . 96 ASP OD2 1 1 14 25854 1 1 97 LEU C C -6.681 -5.599 -5.604 1.00 . A A . 97 LEU C 1 1 14 25855 1 1 97 LEU CA C -8.005 -5.879 -4.892 1.00 . A A . 97 LEU CA 1 1 14 25856 1 1 97 LEU CB C -7.978 -7.131 -4.013 1.00 . A A . 97 LEU CB 1 1 14 25857 1 1 97 LEU CD1 C -8.829 -8.363 -1.984 1.00 . A A . 97 LEU CD1 1 1 14 25858 1 1 97 LEU CD2 C -9.462 -5.936 -2.361 1.00 . A A . 97 LEU CD2 1 1 14 25859 1 1 97 LEU CG C -9.132 -7.277 -3.018 1.00 . A A . 97 LEU CG 1 1 14 25860 1 1 97 LEU H H -8.951 -6.689 -6.562 1.00 . A A . 97 LEU H 1 1 14 25861 1 1 97 LEU HA H -8.233 -5.034 -4.242 1.00 . A A . 97 LEU HA 1 1 14 25862 1 1 97 LEU HB2 H -7.972 -8.006 -4.663 1.00 . A A . 97 LEU HB2 1 1 14 25863 1 1 97 LEU HB3 H -7.041 -7.140 -3.457 1.00 . A A . 97 LEU HB3 1 1 14 25864 1 1 97 LEU HD11 H -8.488 -9.265 -2.493 1.00 . A A . 97 LEU HD11 1 1 14 25865 1 1 97 LEU HD12 H -8.050 -8.013 -1.306 1.00 . A A . 97 LEU HD12 1 1 14 25866 1 1 97 LEU HD13 H -9.732 -8.586 -1.416 1.00 . A A . 97 LEU HD13 1 1 14 25867 1 1 97 LEU HD21 H -8.546 -5.479 -1.987 1.00 . A A . 97 LEU HD21 1 1 14 25868 1 1 97 LEU HD22 H -9.925 -5.276 -3.095 1.00 . A A . 97 LEU HD22 1 1 14 25869 1 1 97 LEU HD23 H -10.152 -6.097 -1.532 1.00 . A A . 97 LEU HD23 1 1 14 25870 1 1 97 LEU HG H -10.019 -7.594 -3.567 1.00 . A A . 97 LEU HG 1 1 14 25871 1 1 97 LEU N N -9.070 -5.970 -5.876 1.00 . A A . 97 LEU N 1 1 14 25872 1 1 97 LEU O O -5.891 -4.772 -5.152 1.00 . A A . 97 LEU O 1 1 14 25873 1 1 98 THR C C -5.594 -5.635 -8.892 1.00 . A A . 98 THR C 1 1 14 25874 1 1 98 THR CA C -5.263 -6.142 -7.487 1.00 . A A . 98 THR CA 1 1 14 25875 1 1 98 THR CB C -4.518 -7.478 -7.483 1.00 . A A . 98 THR CB 1 1 14 25876 1 1 98 THR CG2 C -4.605 -8.193 -6.134 1.00 . A A . 98 THR CG2 1 1 14 25877 1 1 98 THR H H -7.126 -6.974 -7.069 1.00 . A A . 98 THR H 1 1 14 25878 1 1 98 THR HA H -4.647 -5.380 -7.009 1.00 . A A . 98 THR HA 1 1 14 25879 1 1 98 THR HB H -3.479 -7.345 -7.787 1.00 . A A . 98 THR HB 1 1 14 25880 1 1 98 THR HG1 H -6.193 -8.450 -7.988 1.00 . A A . 98 THR HG1 1 1 14 25881 1 1 98 THR HG21 H -5.648 -8.257 -5.823 1.00 . A A . 98 THR HG21 1 1 14 25882 1 1 98 THR HG22 H -4.192 -9.198 -6.228 1.00 . A A . 98 THR HG22 1 1 14 25883 1 1 98 THR HG23 H -4.037 -7.635 -5.389 1.00 . A A . 98 THR HG23 1 1 14 25884 1 1 98 THR N N -6.479 -6.304 -6.708 1.00 . A A . 98 THR N 1 1 14 25885 1 1 98 THR O O -4.785 -5.765 -9.809 1.00 . A A . 98 THR O 1 1 14 25886 1 1 98 THR OG1 O -5.278 -8.302 -8.363 1.00 . A A . 98 THR OG1 1 1 14 25887 1 1 99 GLY C C -6.351 -3.374 -10.746 1.00 . A A . 99 GLY C 1 1 14 25888 1 1 99 GLY CA C -7.233 -4.540 -10.294 1.00 . A A . 99 GLY CA 1 1 14 25889 1 1 99 GLY H H -7.436 -4.964 -8.265 1.00 . A A . 99 GLY H 1 1 14 25890 1 1 99 GLY HA2 H -7.211 -5.329 -11.045 1.00 . A A . 99 GLY HA2 1 1 14 25891 1 1 99 GLY HA3 H -8.267 -4.207 -10.211 1.00 . A A . 99 GLY HA3 1 1 14 25892 1 1 99 GLY N N -6.785 -5.067 -9.016 1.00 . A A . 99 GLY N 1 1 14 25893 1 1 99 GLY O O -5.714 -2.717 -9.923 1.00 . A A . 99 GLY O 1 1 14 25894 1 1 100 CYS C C -6.461 -0.867 -12.836 1.00 . A A . 100 CYS C 1 1 14 25895 1 1 100 CYS CA C -5.549 -2.076 -12.623 1.00 . A A . 100 CYS CA 1 1 14 25896 1 1 100 CYS CB C -4.861 -2.508 -13.920 1.00 . A A . 100 CYS CB 1 1 14 25897 1 1 100 CYS H H -6.864 -3.689 -12.714 1.00 . A A . 100 CYS H 1 1 14 25898 1 1 100 CYS HA H -4.765 -1.848 -11.900 1.00 . A A . 100 CYS HA 1 1 14 25899 1 1 100 CYS HB2 H -5.462 -3.286 -14.391 1.00 . A A . 100 CYS HB2 1 1 14 25900 1 1 100 CYS HB3 H -4.843 -1.660 -14.604 1.00 . A A . 100 CYS HB3 1 1 14 25901 1 1 100 CYS N N -6.342 -3.151 -12.052 1.00 . A A . 100 CYS N 1 1 14 25902 1 1 100 CYS O O -6.089 0.261 -12.514 1.00 . A A . 100 CYS O 1 1 14 25903 1 1 100 CYS SG S -3.153 -3.131 -13.712 1.00 . A A . 100 CYS SG 1 1 14 25904 1 1 101 LYS C C -9.984 -0.538 -13.144 1.00 . A A . 101 LYS C 1 1 14 25905 1 1 101 LYS CA C -8.607 -0.091 -13.638 1.00 . A A . 101 LYS CA 1 1 14 25906 1 1 101 LYS CB C -8.582 0.307 -15.115 1.00 . A A . 101 LYS CB 1 1 14 25907 1 1 101 LYS CD C -9.808 1.696 -16.826 1.00 . A A . 101 LYS CD 1 1 14 25908 1 1 101 LYS CE C -8.986 2.774 -17.534 1.00 . A A . 101 LYS CE 1 1 14 25909 1 1 101 LYS CG C -9.403 1.576 -15.355 1.00 . A A . 101 LYS CG 1 1 14 25910 1 1 101 LYS H H -7.934 -2.062 -13.636 1.00 . A A . 101 LYS H 1 1 14 25911 1 1 101 LYS HA H -8.302 0.784 -13.063 1.00 . A A . 101 LYS HA 1 1 14 25912 1 1 101 LYS HB2 H -7.553 0.470 -15.435 1.00 . A A . 101 LYS HB2 1 1 14 25913 1 1 101 LYS HB3 H -8.979 -0.507 -15.721 1.00 . A A . 101 LYS HB3 1 1 14 25914 1 1 101 LYS HD2 H -9.666 0.738 -17.325 1.00 . A A . 101 LYS HD2 1 1 14 25915 1 1 101 LYS HD3 H -10.869 1.938 -16.895 1.00 . A A . 101 LYS HD3 1 1 14 25916 1 1 101 LYS HE2 H -9.498 3.091 -18.443 1.00 . A A . 101 LYS HE2 1 1 14 25917 1 1 101 LYS HE3 H -8.899 3.653 -16.895 1.00 . A A . 101 LYS HE3 1 1 14 25918 1 1 101 LYS HG2 H -10.294 1.560 -14.728 1.00 . A A . 101 LYS HG2 1 1 14 25919 1 1 101 LYS HG3 H -8.822 2.450 -15.062 1.00 . A A . 101 LYS HG3 1 1 14 25920 1 1 101 LYS HZ1 H -7.362 1.496 -17.265 1.00 . A A . 101 LYS HZ1 1 1 14 25921 1 1 101 LYS HZ2 H -7.590 1.917 -18.822 1.00 . A A . 101 LYS HZ2 1 1 14 25922 1 1 101 LYS N N -7.639 -1.142 -13.377 1.00 . A A . 101 LYS N 1 1 14 25923 1 1 101 LYS NZ N -7.639 2.262 -17.870 1.00 . A A . 101 LYS NZ 1 1 14 25924 1 1 101 LYS O O -10.353 -1.702 -13.293 1.00 . A A . 101 LYS O 1 1 14 25925 1 1 102 LYS C C -11.924 -0.826 -10.859 1.00 . A A . 102 LYS C 1 1 14 25926 1 1 102 LYS CA C -12.036 0.128 -12.050 1.00 . A A . 102 LYS CA 1 1 14 25927 1 1 102 LYS CB C -12.947 -0.387 -13.167 1.00 . A A . 102 LYS CB 1 1 14 25928 1 1 102 LYS CD C -14.815 0.849 -14.326 1.00 . A A . 102 LYS CD 1 1 14 25929 1 1 102 LYS CE C -15.161 1.803 -15.471 1.00 . A A . 102 LYS CE 1 1 14 25930 1 1 102 LYS CG C -13.300 0.734 -14.147 1.00 . A A . 102 LYS CG 1 1 14 25931 1 1 102 LYS H H -10.400 1.355 -12.450 1.00 . A A . 102 LYS H 1 1 14 25932 1 1 102 LYS HA H -12.457 1.070 -11.700 1.00 . A A . 102 LYS HA 1 1 14 25933 1 1 102 LYS HB2 H -12.452 -1.199 -13.700 1.00 . A A . 102 LYS HB2 1 1 14 25934 1 1 102 LYS HB3 H -13.859 -0.799 -12.736 1.00 . A A . 102 LYS HB3 1 1 14 25935 1 1 102 LYS HD2 H -15.236 -0.136 -14.529 1.00 . A A . 102 LYS HD2 1 1 14 25936 1 1 102 LYS HD3 H -15.268 1.205 -13.401 1.00 . A A . 102 LYS HD3 1 1 14 25937 1 1 102 LYS HE2 H -15.863 2.560 -15.121 1.00 . A A . 102 LYS HE2 1 1 14 25938 1 1 102 LYS HE3 H -14.264 2.327 -15.799 1.00 . A A . 102 LYS HE3 1 1 14 25939 1 1 102 LYS HG2 H -12.901 1.680 -13.782 1.00 . A A . 102 LYS HG2 1 1 14 25940 1 1 102 LYS HG3 H -12.830 0.540 -15.111 1.00 . A A . 102 LYS HG3 1 1 14 25941 1 1 102 LYS HZ1 H -15.872 1.646 -17.424 1.00 . A A . 102 LYS HZ1 1 1 14 25942 1 1 102 LYS HZ2 H -15.170 0.277 -16.890 1.00 . A A . 102 LYS HZ2 1 1 14 25943 1 1 102 LYS N N -10.708 0.410 -12.567 1.00 . A A . 102 LYS N 1 1 14 25944 1 1 102 LYS NZ N -15.750 1.058 -16.606 1.00 . A A . 102 LYS NZ 1 1 14 25945 1 1 102 LYS O O -12.659 -1.809 -10.775 1.00 . A A . 102 LYS O 1 1 14 25946 1 1 103 SER C C -11.076 -0.504 -7.526 1.00 . A A . 103 SER C 1 1 14 25947 1 1 103 SER CA C -10.779 -1.319 -8.786 1.00 . A A . 103 SER CA 1 1 14 25948 1 1 103 SER CB C -9.348 -1.857 -8.746 1.00 . A A . 103 SER CB 1 1 14 25949 1 1 103 SER H H -10.404 0.299 -10.044 1.00 . A A . 103 SER H 1 1 14 25950 1 1 103 SER HA H -11.477 -2.151 -8.877 1.00 . A A . 103 SER HA 1 1 14 25951 1 1 103 SER HB2 H -8.993 -1.866 -7.715 1.00 . A A . 103 SER HB2 1 1 14 25952 1 1 103 SER HB3 H -9.339 -2.890 -9.094 1.00 . A A . 103 SER HB3 1 1 14 25953 1 1 103 SER HG H -8.505 -0.119 -9.269 1.00 . A A . 103 SER HG 1 1 14 25954 1 1 103 SER N N -10.998 -0.503 -9.969 1.00 . A A . 103 SER N 1 1 14 25955 1 1 103 SER O O -11.557 0.625 -7.611 1.00 . A A . 103 SER O 1 1 14 25956 1 1 103 SER OG O -8.462 -1.079 -9.545 1.00 . A A . 103 SER OG 1 1 14 25957 1 1 104 LYS C C -9.940 0.622 -4.894 1.00 . A A . 104 LYS C 1 1 14 25958 1 1 104 LYS CA C -11.007 -0.453 -5.109 1.00 . A A . 104 LYS CA 1 1 14 25959 1 1 104 LYS CB C -11.075 -1.486 -3.981 1.00 . A A . 104 LYS CB 1 1 14 25960 1 1 104 LYS CD C -13.521 -2.035 -3.708 1.00 . A A . 104 LYS CD 1 1 14 25961 1 1 104 LYS CE C -14.229 -3.146 -2.930 1.00 . A A . 104 LYS CE 1 1 14 25962 1 1 104 LYS CG C -12.173 -2.517 -4.248 1.00 . A A . 104 LYS CG 1 1 14 25963 1 1 104 LYS H H -10.387 -2.027 -6.325 1.00 . A A . 104 LYS H 1 1 14 25964 1 1 104 LYS HA H -11.981 0.032 -5.161 1.00 . A A . 104 LYS HA 1 1 14 25965 1 1 104 LYS HB2 H -10.113 -1.990 -3.885 1.00 . A A . 104 LYS HB2 1 1 14 25966 1 1 104 LYS HB3 H -11.266 -0.982 -3.034 1.00 . A A . 104 LYS HB3 1 1 14 25967 1 1 104 LYS HD2 H -13.370 -1.172 -3.060 1.00 . A A . 104 LYS HD2 1 1 14 25968 1 1 104 LYS HD3 H -14.151 -1.706 -4.534 1.00 . A A . 104 LYS HD3 1 1 14 25969 1 1 104 LYS HE2 H -13.492 -3.779 -2.436 1.00 . A A . 104 LYS HE2 1 1 14 25970 1 1 104 LYS HE3 H -14.851 -2.711 -2.148 1.00 . A A . 104 LYS HE3 1 1 14 25971 1 1 104 LYS HG2 H -12.252 -2.701 -5.320 1.00 . A A . 104 LYS HG2 1 1 14 25972 1 1 104 LYS HG3 H -11.908 -3.465 -3.780 1.00 . A A . 104 LYS HG3 1 1 14 25973 1 1 104 LYS HZ1 H -14.701 -4.905 -3.943 1.00 . A A . 104 LYS HZ1 1 1 14 25974 1 1 104 LYS HZ2 H -16.017 -4.052 -3.501 1.00 . A A . 104 LYS HZ2 1 1 14 25975 1 1 104 LYS N N -10.778 -1.109 -6.385 1.00 . A A . 104 LYS N 1 1 14 25976 1 1 104 LYS NZ N -15.064 -3.964 -3.838 1.00 . A A . 104 LYS NZ 1 1 14 25977 1 1 104 LYS O O -10.195 1.632 -4.238 1.00 . A A . 104 LYS O 1 1 14 25978 1 1 105 CYS C C -7.836 2.395 -6.395 1.00 . A A . 105 CYS C 1 1 14 25979 1 1 105 CYS CA C -7.662 1.304 -5.337 1.00 . A A . 105 CYS CA 1 1 14 25980 1 1 105 CYS CB C -6.310 0.599 -5.460 1.00 . A A . 105 CYS CB 1 1 14 25981 1 1 105 CYS H H -8.570 -0.453 -5.990 1.00 . A A . 105 CYS H 1 1 14 25982 1 1 105 CYS HA H -7.718 1.726 -4.333 1.00 . A A . 105 CYS HA 1 1 14 25983 1 1 105 CYS HB2 H -6.206 0.166 -6.455 1.00 . A A . 105 CYS HB2 1 1 14 25984 1 1 105 CYS HB3 H -5.502 1.321 -5.340 1.00 . A A . 105 CYS HB3 1 1 14 25985 1 1 105 CYS N N -8.769 0.370 -5.459 1.00 . A A . 105 CYS N 1 1 14 25986 1 1 105 CYS O O -8.024 3.564 -6.062 1.00 . A A . 105 CYS O 1 1 14 25987 1 1 105 CYS SG S -6.170 -0.712 -4.191 1.00 . A A . 105 CYS SG 1 1 14 25988 1 1 106 HIS C C -9.361 2.886 -9.252 1.00 . A A . 106 HIS C 1 1 14 25989 1 1 106 HIS CA C -7.913 2.901 -8.759 1.00 . A A . 106 HIS CA 1 1 14 25990 1 1 106 HIS CB C -6.906 2.585 -9.867 1.00 . A A . 106 HIS CB 1 1 14 25991 1 1 106 HIS CD2 C -4.447 1.826 -9.412 1.00 . A A . 106 HIS CD2 1 1 14 25992 1 1 106 HIS CE1 C -3.655 3.741 -8.710 1.00 . A A . 106 HIS CE1 1 1 14 25993 1 1 106 HIS CG C -5.464 2.734 -9.448 1.00 . A A . 106 HIS CG 1 1 14 25994 1 1 106 HIS H H -7.613 1.021 -7.912 1.00 . A A . 106 HIS H 1 1 14 25995 1 1 106 HIS HA H -7.680 3.892 -8.371 1.00 . A A . 106 HIS HA 1 1 14 25996 1 1 106 HIS HB2 H -7.070 1.564 -10.212 1.00 . A A . 106 HIS HB2 1 1 14 25997 1 1 106 HIS HB3 H -7.097 3.242 -10.716 1.00 . A A . 106 HIS HB3 1 1 14 25998 1 1 106 HIS HD1 H -5.431 4.794 -8.907 1.00 . A A . 106 HIS HD1 1 1 14 25999 1 1 106 HIS HD2 H -4.519 0.777 -9.701 1.00 . A A . 106 HIS HD2 1 1 14 26000 1 1 106 HIS HE1 H -2.964 4.495 -8.333 1.00 . A A . 106 HIS HE1 1 1 14 26001 1 1 106 HIS N N -7.766 1.974 -7.650 1.00 . A A . 106 HIS N 1 1 14 26002 1 1 106 HIS ND1 N -4.934 3.932 -8.999 1.00 . A A . 106 HIS ND1 1 1 14 26003 1 1 106 HIS NE2 N -3.355 2.435 -8.968 1.00 . A A . 106 HIS NE2 1 1 14 26004 1 1 106 HIS O O -10.018 1.847 -9.230 1.00 . A A . 106 HIS O 1 1 14 26005 1 1 107 GLU C C -11.206 5.112 -11.400 1.00 . A A . 107 GLU C 1 1 14 26006 1 1 107 GLU CA C -11.175 4.187 -10.182 1.00 . A A . 107 GLU CA 1 1 14 26007 1 1 107 GLU CB C -12.113 4.695 -9.085 1.00 . A A . 107 GLU CB 1 1 14 26008 1 1 107 GLU CD C -13.530 2.820 -8.170 1.00 . A A . 107 GLU CD 1 1 14 26009 1 1 107 GLU CG C -12.265 3.658 -7.970 1.00 . A A . 107 GLU CG 1 1 14 26010 1 1 107 GLU H H -9.276 4.894 -9.700 1.00 . A A . 107 GLU H 1 1 14 26011 1 1 107 GLU HA H -11.479 3.182 -10.473 1.00 . A A . 107 GLU HA 1 1 14 26012 1 1 107 GLU HB2 H -11.723 5.625 -8.670 1.00 . A A . 107 GLU HB2 1 1 14 26013 1 1 107 GLU HB3 H -13.090 4.922 -9.512 1.00 . A A . 107 GLU HB3 1 1 14 26014 1 1 107 GLU HG2 H -11.392 3.007 -7.953 1.00 . A A . 107 GLU HG2 1 1 14 26015 1 1 107 GLU HG3 H -12.307 4.161 -7.004 1.00 . A A . 107 GLU HG3 1 1 14 26016 1 1 107 GLU N N -9.817 4.053 -9.685 1.00 . A A . 107 GLU N 1 1 14 26017 1 1 107 GLU O O -11.668 6.249 -11.310 1.00 . A A . 107 GLU O 1 1 14 26018 1 1 107 GLU OXT O -10.744 4.658 -12.469 1.00 . A A . 107 GLU OXT 1 1 14 26019 1 1 107 GLU OE1 O -13.808 2.484 -9.341 1.00 . A A . 107 GLU OE1 1 1 14 26020 1 1 107 GLU OE2 O -14.189 2.536 -7.147 1.00 . A A . 107 GLU OE2 1 1 14 26021 2 2 1 HEC C1A C -1.026 5.371 9.274 1.00 . B A . 108 HEC C1A 1 1 14 26022 2 2 1 HEC C1B C -1.874 2.234 12.122 1.00 . B A . 108 HEC C1B 1 1 14 26023 2 2 1 HEC C1C C -2.134 -0.634 8.827 1.00 . B A . 108 HEC C1C 1 1 14 26024 2 2 1 HEC C1D C -1.098 2.502 6.041 1.00 . B A . 108 HEC C1D 1 1 14 26025 2 2 1 HEC C2A C -0.864 6.435 10.237 1.00 . B A . 108 HEC C2A 1 1 14 26026 2 2 1 HEC C2B C -2.320 1.357 13.179 1.00 . B A . 108 HEC C2B 1 1 14 26027 2 2 1 HEC C2C C -2.189 -1.708 7.864 1.00 . B A . 108 HEC C2C 1 1 14 26028 2 2 1 HEC C2D C -0.723 3.423 4.994 1.00 . B A . 108 HEC C2D 1 1 14 26029 2 2 1 HEC C3A C -1.026 5.890 11.461 1.00 . B A . 108 HEC C3A 1 1 14 26030 2 2 1 HEC C3B C -2.573 0.156 12.618 1.00 . B A . 108 HEC C3B 1 1 14 26031 2 2 1 HEC C3C C -1.889 -1.177 6.660 1.00 . B A . 108 HEC C3C 1 1 14 26032 2 2 1 HEC C3D C -0.619 4.644 5.559 1.00 . B A . 108 HEC C3D 1 1 14 26033 2 2 1 HEC C4A C -1.289 4.484 11.269 1.00 . B A . 108 HEC C4A 1 1 14 26034 2 2 1 HEC C4B C -2.287 0.277 11.208 1.00 . B A . 108 HEC C4B 1 1 14 26035 2 2 1 HEC C4C C -1.645 0.232 6.866 1.00 . B A . 108 HEC C4C 1 1 14 26036 2 2 1 HEC C4D C -0.928 4.491 6.961 1.00 . B A . 108 HEC C4D 1 1 14 26037 2 2 1 HEC CAA C -0.572 7.867 9.894 1.00 . B A . 108 HEC CAA 1 1 14 26038 2 2 1 HEC CAB C -3.061 -1.094 13.291 1.00 . B A . 108 HEC CAB 1 1 14 26039 2 2 1 HEC CAC C -1.811 -1.877 5.334 1.00 . B A . 108 HEC CAC 1 1 14 26040 2 2 1 HEC CAD C -0.255 5.941 4.897 1.00 . B A . 108 HEC CAD 1 1 14 26041 2 2 1 HEC CBA C 0.602 8.462 10.666 1.00 . B A . 108 HEC CBA 1 1 14 26042 2 2 1 HEC CBB C -4.311 -0.893 14.143 1.00 . B A . 108 HEC CBB 1 1 14 26043 2 2 1 HEC CBC C -2.795 -3.033 5.184 1.00 . B A . 108 HEC CBC 1 1 14 26044 2 2 1 HEC CBD C -0.899 6.141 3.527 1.00 . B A . 108 HEC CBD 1 1 14 26045 2 2 1 HEC CGA C 0.140 9.576 11.594 1.00 . B A . 108 HEC CGA 1 1 14 26046 2 2 1 HEC CGD C 0.148 6.469 2.472 1.00 . B A . 108 HEC CGD 1 1 14 26047 2 2 1 HEC CHA C -0.929 5.542 7.897 1.00 . B A . 108 HEC CHA 1 1 14 26048 2 2 1 HEC CHB C -1.515 3.564 12.310 1.00 . B A . 108 HEC CHB 1 1 14 26049 2 2 1 HEC CHC C -2.427 -0.765 10.273 1.00 . B A . 108 HEC CHC 1 1 14 26050 2 2 1 HEC CHD C -1.301 1.139 5.848 1.00 . B A . 108 HEC CHD 1 1 14 26051 2 2 1 HEC CMA C -0.955 6.576 12.795 1.00 . B A . 108 HEC CMA 1 1 14 26052 2 2 1 HEC CMB C -2.460 1.752 14.621 1.00 . B A . 108 HEC CMB 1 1 14 26053 2 2 1 HEC CMC C -2.522 -3.136 8.186 1.00 . B A . 108 HEC CMC 1 1 14 26054 2 2 1 HEC CMD C -0.502 3.047 3.558 1.00 . B A . 108 HEC CMD 1 1 14 26055 2 2 1 HEC FE FE -1.541 2.365 9.071 1.00 . B A . 108 HEC FE 1 1 14 26056 2 2 1 HEC HAA1 H -0.332 7.945 8.834 1.00 . B A . 108 HEC HAA1 1 1 14 26057 2 2 1 HEC HAA2 H -1.446 8.479 10.116 1.00 . B A . 108 HEC HAA2 1 1 14 26058 2 2 1 HEC HAB H -3.303 -1.843 12.537 1.00 . B A . 108 HEC HAB 1 1 14 26059 2 2 1 HEC HAC H -2.026 -1.166 4.535 1.00 . B A . 108 HEC HAC 1 1 14 26060 2 2 1 HEC HAD1 H -0.573 6.772 5.525 1.00 . B A . 108 HEC HAD1 1 1 14 26061 2 2 1 HEC HAD2 H 0.825 5.985 4.754 1.00 . B A . 108 HEC HAD2 1 1 14 26062 2 2 1 HEC HBA1 H 1.076 7.684 11.264 1.00 . B A . 108 HEC HBA1 1 1 14 26063 2 2 1 HEC HBA2 H 1.328 8.873 9.964 1.00 . B A . 108 HEC HBA2 1 1 14 26064 2 2 1 HEC HBB1 H -4.661 0.134 14.038 1.00 . B A . 108 HEC HBB1 1 1 14 26065 2 2 1 HEC HBB2 H -5.091 -1.578 13.810 1.00 . B A . 108 HEC HBB2 1 1 14 26066 2 2 1 HEC HBB3 H -4.075 -1.092 15.188 1.00 . B A . 108 HEC HBB3 1 1 14 26067 2 2 1 HEC HBC1 H -3.105 -3.114 4.143 1.00 . B A . 108 HEC HBC1 1 1 14 26068 2 2 1 HEC HBC2 H -2.314 -3.961 5.493 1.00 . B A . 108 HEC HBC2 1 1 14 26069 2 2 1 HEC HBC3 H -3.668 -2.851 5.811 1.00 . B A . 108 HEC HBC3 1 1 14 26070 2 2 1 HEC HBD1 H -1.416 5.228 3.233 1.00 . B A . 108 HEC HBD1 1 1 14 26071 2 2 1 HEC HBD2 H -1.612 6.963 3.578 1.00 . B A . 108 HEC HBD2 1 1 14 26072 2 2 1 HEC HHA H -0.848 6.558 7.512 1.00 . B A . 108 HEC HHA 1 1 14 26073 2 2 1 HEC HHB H -1.400 3.925 13.332 1.00 . B A . 108 HEC HHB 1 1 14 26074 2 2 1 HEC HHC H -2.747 -1.737 10.649 1.00 . B A . 108 HEC HHC 1 1 14 26075 2 2 1 HEC HHD H -1.188 0.743 4.839 1.00 . B A . 108 HEC HHD 1 1 14 26076 2 2 1 HEC HMA1 H -0.818 5.832 13.579 1.00 . B A . 108 HEC HMA1 1 1 14 26077 2 2 1 HEC HMA2 H -0.116 7.271 12.802 1.00 . B A . 108 HEC HMA2 1 1 14 26078 2 2 1 HEC HMA3 H -1.881 7.123 12.972 1.00 . B A . 108 HEC HMA3 1 1 14 26079 2 2 1 HEC HMB1 H -1.488 2.054 15.011 1.00 . B A . 108 HEC HMB1 1 1 14 26080 2 2 1 HEC HMB2 H -3.160 2.583 14.703 1.00 . B A . 108 HEC HMB2 1 1 14 26081 2 2 1 HEC HMB3 H -2.834 0.904 15.195 1.00 . B A . 108 HEC HMB3 1 1 14 26082 2 2 1 HEC HMC1 H -3.495 -3.386 7.763 1.00 . B A . 108 HEC HMC1 1 1 14 26083 2 2 1 HEC HMC2 H -1.761 -3.791 7.763 1.00 . B A . 108 HEC HMC2 1 1 14 26084 2 2 1 HEC HMC3 H -2.553 -3.266 9.268 1.00 . B A . 108 HEC HMC3 1 1 14 26085 2 2 1 HEC HMD1 H -0.034 2.064 3.508 1.00 . B A . 108 HEC HMD1 1 1 14 26086 2 2 1 HEC HMD2 H -1.459 3.021 3.038 1.00 . B A . 108 HEC HMD2 1 1 14 26087 2 2 1 HEC HMD3 H 0.148 3.783 3.086 1.00 . B A . 108 HEC HMD3 1 1 14 26088 2 2 1 HEC NA N -1.287 4.175 9.920 1.00 . B A . 108 HEC NA 1 1 14 26089 2 2 1 HEC NB N -1.857 1.559 10.914 1.00 . B A . 108 HEC NB 1 1 14 26090 2 2 1 HEC NC N -1.799 0.555 8.203 1.00 . B A . 108 HEC NC 1 1 14 26091 2 2 1 HEC ND N -1.221 3.169 7.247 1.00 . B A . 108 HEC ND 1 1 14 26092 2 2 1 HEC O1A O 0.743 10.669 11.514 1.00 . B A . 108 HEC O1A 1 1 14 26093 2 2 1 HEC O1D O 0.061 7.583 1.913 1.00 . B A . 108 HEC O1D 1 1 14 26094 2 2 1 HEC O2A O -0.808 9.315 12.366 1.00 . B A . 108 HEC O2A 1 1 14 26095 2 2 1 HEC O2D O 1.016 5.599 2.245 1.00 . B A . 108 HEC O2D 1 1 14 26096 3 2 1 HEC C1A C 9.614 -1.645 1.708 1.00 . C A . 109 HEC C1A 1 1 14 26097 3 2 1 HEC C1B C 5.764 0.039 2.717 1.00 . C A . 109 HEC C1B 1 1 14 26098 3 2 1 HEC C1C C 7.774 3.120 5.104 1.00 . C A . 109 HEC C1C 1 1 14 26099 3 2 1 HEC C1D C 11.594 1.569 3.811 1.00 . C A . 109 HEC C1D 1 1 14 26100 3 2 1 HEC C2A C 9.116 -2.738 0.906 1.00 . C A . 109 HEC C2A 1 1 14 26101 3 2 1 HEC C2B C 4.407 0.382 3.072 1.00 . C A . 109 HEC C2B 1 1 14 26102 3 2 1 HEC C2C C 8.289 4.263 5.821 1.00 . C A . 109 HEC C2C 1 1 14 26103 3 2 1 HEC C2D C 12.945 1.102 3.602 1.00 . C A . 109 HEC C2D 1 1 14 26104 3 2 1 HEC C3A C 7.771 -2.625 0.874 1.00 . C A . 109 HEC C3A 1 1 14 26105 3 2 1 HEC C3B C 4.471 1.439 3.909 1.00 . C A . 109 HEC C3B 1 1 14 26106 3 2 1 HEC C3C C 9.631 4.249 5.678 1.00 . C A . 109 HEC C3C 1 1 14 26107 3 2 1 HEC C3D C 12.864 -0.049 2.904 1.00 . C A . 109 HEC C3D 1 1 14 26108 3 2 1 HEC C4A C 7.424 -1.462 1.656 1.00 . C A . 109 HEC C4A 1 1 14 26109 3 2 1 HEC C4B C 5.868 1.761 4.080 1.00 . C A . 109 HEC C4B 1 1 14 26110 3 2 1 HEC C4C C 9.960 3.098 4.871 1.00 . C A . 109 HEC C4C 1 1 14 26111 3 2 1 HEC C4D C 11.462 -0.308 2.673 1.00 . C A . 109 HEC C4D 1 1 14 26112 3 2 1 HEC CAA C 9.972 -3.782 0.250 1.00 . C A . 109 HEC CAA 1 1 14 26113 3 2 1 HEC CAB C 3.334 2.171 4.561 1.00 . C A . 109 HEC CAB 1 1 14 26114 3 2 1 HEC CAC C 10.630 5.223 6.233 1.00 . C A . 109 HEC CAC 1 1 14 26115 3 2 1 HEC CAD C 13.988 -0.927 2.435 1.00 . C A . 109 HEC CAD 1 1 14 26116 3 2 1 HEC CBA C 10.184 -3.561 -1.245 1.00 . C A . 109 HEC CBA 1 1 14 26117 3 2 1 HEC CBB C 2.282 1.257 5.182 1.00 . C A . 109 HEC CBB 1 1 14 26118 3 2 1 HEC CBC C 10.615 5.326 7.756 1.00 . C A . 109 HEC CBC 1 1 14 26119 3 2 1 HEC CBD C 15.113 -1.091 3.453 1.00 . C A . 109 HEC CBD 1 1 14 26120 3 2 1 HEC CGA C 10.943 -4.723 -1.868 1.00 . C A . 109 HEC CGA 1 1 14 26121 3 2 1 HEC CGD C 16.255 -0.126 3.167 1.00 . C A . 109 HEC CGD 1 1 14 26122 3 2 1 HEC CHA C 10.961 -1.422 1.974 1.00 . C A . 109 HEC CHA 1 1 14 26123 3 2 1 HEC CHB C 6.110 -1.005 1.865 1.00 . C A . 109 HEC CHB 1 1 14 26124 3 2 1 HEC CHC C 6.351 2.809 4.884 1.00 . C A . 109 HEC CHC 1 1 14 26125 3 2 1 HEC CHD C 11.266 2.734 4.496 1.00 . C A . 109 HEC CHD 1 1 14 26126 3 2 1 HEC CMA C 6.786 -3.515 0.174 1.00 . C A . 109 HEC CMA 1 1 14 26127 3 2 1 HEC CMB C 3.184 -0.334 2.578 1.00 . C A . 109 HEC CMB 1 1 14 26128 3 2 1 HEC CMC C 7.450 5.255 6.572 1.00 . C A . 109 HEC CMC 1 1 14 26129 3 2 1 HEC CMD C 14.180 1.802 4.090 1.00 . C A . 109 HEC CMD 1 1 14 26130 3 2 1 HEC FE FE 8.680 0.783 3.316 1.00 . C A . 109 HEC FE 1 1 14 26131 3 2 1 HEC HAA1 H 10.957 -3.791 0.717 1.00 . C A . 109 HEC HAA1 1 1 14 26132 3 2 1 HEC HAA2 H 9.505 -4.760 0.368 1.00 . C A . 109 HEC HAA2 1 1 14 26133 3 2 1 HEC HAB H 3.720 2.805 5.358 1.00 . C A . 109 HEC HAB 1 1 14 26134 3 2 1 HEC HAC H 11.635 4.919 5.941 1.00 . C A . 109 HEC HAC 1 1 14 26135 3 2 1 HEC HAD1 H 13.604 -1.923 2.216 1.00 . C A . 109 HEC HAD1 1 1 14 26136 3 2 1 HEC HAD2 H 14.429 -0.502 1.533 1.00 . C A . 109 HEC HAD2 1 1 14 26137 3 2 1 HEC HBA1 H 9.217 -3.470 -1.739 1.00 . C A . 109 HEC HBA1 1 1 14 26138 3 2 1 HEC HBA2 H 10.758 -2.647 -1.399 1.00 . C A . 109 HEC HBA2 1 1 14 26139 3 2 1 HEC HBB1 H 1.930 1.691 6.118 1.00 . C A . 109 HEC HBB1 1 1 14 26140 3 2 1 HEC HBB2 H 1.443 1.148 4.494 1.00 . C A . 109 HEC HBB2 1 1 14 26141 3 2 1 HEC HBB3 H 2.720 0.278 5.378 1.00 . C A . 109 HEC HBB3 1 1 14 26142 3 2 1 HEC HBC1 H 10.375 4.353 8.184 1.00 . C A . 109 HEC HBC1 1 1 14 26143 3 2 1 HEC HBC2 H 11.597 5.644 8.107 1.00 . C A . 109 HEC HBC2 1 1 14 26144 3 2 1 HEC HBC3 H 9.865 6.054 8.064 1.00 . C A . 109 HEC HBC3 1 1 14 26145 3 2 1 HEC HBD1 H 14.730 -0.892 4.453 1.00 . C A . 109 HEC HBD1 1 1 14 26146 3 2 1 HEC HBD2 H 15.498 -2.110 3.407 1.00 . C A . 109 HEC HBD2 1 1 14 26147 3 2 1 HEC HHA H 11.682 -2.158 1.619 1.00 . C A . 109 HEC HHA 1 1 14 26148 3 2 1 HEC HHB H 5.310 -1.507 1.321 1.00 . C A . 109 HEC HHB 1 1 14 26149 3 2 1 HEC HHC H 5.616 3.432 5.394 1.00 . C A . 109 HEC HHC 1 1 14 26150 3 2 1 HEC HHD H 12.074 3.415 4.762 1.00 . C A . 109 HEC HHD 1 1 14 26151 3 2 1 HEC HMA1 H 5.886 -2.947 -0.060 1.00 . C A . 109 HEC HMA1 1 1 14 26152 3 2 1 HEC HMA2 H 7.228 -3.892 -0.749 1.00 . C A . 109 HEC HMA2 1 1 14 26153 3 2 1 HEC HMA3 H 6.528 -4.353 0.822 1.00 . C A . 109 HEC HMA3 1 1 14 26154 3 2 1 HEC HMB1 H 3.176 -1.352 2.967 1.00 . C A . 109 HEC HMB1 1 1 14 26155 3 2 1 HEC HMB2 H 2.292 0.193 2.919 1.00 . C A . 109 HEC HMB2 1 1 14 26156 3 2 1 HEC HMB3 H 3.194 -0.361 1.488 1.00 . C A . 109 HEC HMB3 1 1 14 26157 3 2 1 HEC HMC1 H 7.936 5.502 7.516 1.00 . C A . 109 HEC HMC1 1 1 14 26158 3 2 1 HEC HMC2 H 7.335 6.160 5.975 1.00 . C A . 109 HEC HMC2 1 1 14 26159 3 2 1 HEC HMC3 H 6.468 4.824 6.771 1.00 . C A . 109 HEC HMC3 1 1 14 26160 3 2 1 HEC HMD1 H 13.896 2.622 4.751 1.00 . C A . 109 HEC HMD1 1 1 14 26161 3 2 1 HEC HMD2 H 14.806 1.096 4.635 1.00 . C A . 109 HEC HMD2 1 1 14 26162 3 2 1 HEC HMD3 H 14.734 2.197 3.239 1.00 . C A . 109 HEC HMD3 1 1 14 26163 3 2 1 HEC NA N 8.565 -0.866 2.164 1.00 . C A . 109 HEC NA 1 1 14 26164 3 2 1 HEC NB N 6.655 0.894 3.342 1.00 . C A . 109 HEC NB 1 1 14 26165 3 2 1 HEC NC N 8.810 2.411 4.523 1.00 . C A . 109 HEC NC 1 1 14 26166 3 2 1 HEC ND N 10.690 0.693 3.235 1.00 . C A . 109 HEC ND 1 1 14 26167 3 2 1 HEC O1A O 10.692 -4.989 -3.064 1.00 . C A . 109 HEC O1A 1 1 14 26168 3 2 1 HEC O1D O 16.860 0.345 4.154 1.00 . C A . 109 HEC O1D 1 1 14 26169 3 2 1 HEC O2A O 11.759 -5.325 -1.138 1.00 . C A . 109 HEC O2A 1 1 14 26170 3 2 1 HEC O2D O 16.501 0.123 1.967 1.00 . C A . 109 HEC O2D 1 1 14 26171 4 2 1 HEC C1A C -8.676 -3.344 0.536 1.00 . D A . 110 HEC C1A 1 1 14 26172 4 2 1 HEC C1B C -4.958 -1.162 0.233 1.00 . D A . 110 HEC C1B 1 1 14 26173 4 2 1 HEC C1C C -2.885 -4.433 2.167 1.00 . D A . 110 HEC C1C 1 1 14 26174 4 2 1 HEC C1D C -6.612 -6.595 2.495 1.00 . D A . 110 HEC C1D 1 1 14 26175 4 2 1 HEC C2A C -9.497 -2.380 -0.159 1.00 . D A . 110 HEC C2A 1 1 14 26176 4 2 1 HEC C2B C -3.793 -0.345 -0.011 1.00 . D A . 110 HEC C2B 1 1 14 26177 4 2 1 HEC C2C C -2.042 -5.457 2.737 1.00 . D A . 110 HEC C2C 1 1 14 26178 4 2 1 HEC C2D C -7.777 -7.409 2.749 1.00 . D A . 110 HEC C2D 1 1 14 26179 4 2 1 HEC C3A C -8.693 -1.354 -0.510 1.00 . D A . 110 HEC C3A 1 1 14 26180 4 2 1 HEC C3B C -2.743 -0.970 0.562 1.00 . D A . 110 HEC C3B 1 1 14 26181 4 2 1 HEC C3C C -2.842 -6.496 3.059 1.00 . D A . 110 HEC C3C 1 1 14 26182 4 2 1 HEC C3D C -8.841 -6.746 2.248 1.00 . D A . 110 HEC C3D 1 1 14 26183 4 2 1 HEC C4A C -7.367 -1.672 -0.036 1.00 . D A . 110 HEC C4A 1 1 14 26184 4 2 1 HEC C4B C -3.247 -2.181 1.166 1.00 . D A . 110 HEC C4B 1 1 14 26185 4 2 1 HEC C4C C -4.188 -6.125 2.691 1.00 . D A . 110 HEC C4C 1 1 14 26186 4 2 1 HEC C4D C -8.345 -5.516 1.679 1.00 . D A . 110 HEC C4D 1 1 14 26187 4 2 1 HEC CAA C -10.967 -2.534 -0.419 1.00 . D A . 110 HEC CAA 1 1 14 26188 4 2 1 HEC CAB C -1.309 -0.529 0.591 1.00 . D A . 110 HEC CAB 1 1 14 26189 4 2 1 HEC CAC C -2.451 -7.805 3.681 1.00 . D A . 110 HEC CAC 1 1 14 26190 4 2 1 HEC CAD C -10.281 -7.169 2.258 1.00 . D A . 110 HEC CAD 1 1 14 26191 4 2 1 HEC CBA C -11.856 -1.877 0.633 1.00 . D A . 110 HEC CBA 1 1 14 26192 4 2 1 HEC CBB C -1.111 0.911 1.056 1.00 . D A . 110 HEC CBB 1 1 14 26193 4 2 1 HEC CBC C -1.149 -7.751 4.474 1.00 . D A . 110 HEC CBC 1 1 14 26194 4 2 1 HEC CBD C -10.868 -7.406 0.870 1.00 . D A . 110 HEC CBD 1 1 14 26195 4 2 1 HEC CGA C -12.834 -2.880 1.227 1.00 . D A . 110 HEC CGA 1 1 14 26196 4 2 1 HEC CGD C -11.538 -8.770 0.784 1.00 . D A . 110 HEC CGD 1 1 14 26197 4 2 1 HEC CHA C -9.149 -4.544 1.055 1.00 . D A . 110 HEC CHA 1 1 14 26198 4 2 1 HEC CHB C -6.240 -0.847 -0.206 1.00 . D A . 110 HEC CHB 1 1 14 26199 4 2 1 HEC CHC C -2.458 -3.112 1.865 1.00 . D A . 110 HEC CHC 1 1 14 26200 4 2 1 HEC CHD C -5.318 -6.945 2.867 1.00 . D A . 110 HEC CHD 1 1 14 26201 4 2 1 HEC CMA C -9.064 -0.102 -1.251 1.00 . D A . 110 HEC CMA 1 1 14 26202 4 2 1 HEC CMB C -3.796 0.952 -0.766 1.00 . D A . 110 HEC CMB 1 1 14 26203 4 2 1 HEC CMC C -0.557 -5.343 2.920 1.00 . D A . 110 HEC CMC 1 1 14 26204 4 2 1 HEC CMD C -7.761 -8.739 3.446 1.00 . D A . 110 HEC CMD 1 1 14 26205 4 2 1 HEC FE FE -5.788 -3.869 1.385 1.00 . D A . 110 HEC FE 1 1 14 26206 4 2 1 HEC HAA1 H -11.215 -2.080 -1.379 1.00 . D A . 110 HEC HAA1 1 1 14 26207 4 2 1 HEC HAA2 H -11.223 -3.593 -0.441 1.00 . D A . 110 HEC HAA2 1 1 14 26208 4 2 1 HEC HAB H -0.746 -1.167 1.273 1.00 . D A . 110 HEC HAB 1 1 14 26209 4 2 1 HEC HAC H -3.234 -8.128 4.367 1.00 . D A . 110 HEC HAC 1 1 14 26210 4 2 1 HEC HAD1 H -10.383 -8.101 2.814 1.00 . D A . 110 HEC HAD1 1 1 14 26211 4 2 1 HEC HAD2 H -10.884 -6.395 2.734 1.00 . D A . 110 HEC HAD2 1 1 14 26212 4 2 1 HEC HBA1 H -11.235 -1.478 1.435 1.00 . D A . 110 HEC HBA1 1 1 14 26213 4 2 1 HEC HBA2 H -12.423 -1.066 0.175 1.00 . D A . 110 HEC HBA2 1 1 14 26214 4 2 1 HEC HBB1 H -1.538 1.592 0.320 1.00 . D A . 110 HEC HBB1 1 1 14 26215 4 2 1 HEC HBB2 H -1.608 1.055 2.015 1.00 . D A . 110 HEC HBB2 1 1 14 26216 4 2 1 HEC HBB3 H -0.046 1.115 1.164 1.00 . D A . 110 HEC HBB3 1 1 14 26217 4 2 1 HEC HBC1 H -0.994 -8.702 4.983 1.00 . D A . 110 HEC HBC1 1 1 14 26218 4 2 1 HEC HBC2 H -0.318 -7.562 3.796 1.00 . D A . 110 HEC HBC2 1 1 14 26219 4 2 1 HEC HBC3 H -1.206 -6.950 5.211 1.00 . D A . 110 HEC HBC3 1 1 14 26220 4 2 1 HEC HBD1 H -11.611 -6.638 0.654 1.00 . D A . 110 HEC HBD1 1 1 14 26221 4 2 1 HEC HBD2 H -10.072 -7.360 0.126 1.00 . D A . 110 HEC HBD2 1 1 14 26222 4 2 1 HEC HHA H -10.216 -4.752 0.974 1.00 . D A . 110 HEC HHA 1 1 14 26223 4 2 1 HEC HHB H -6.386 0.105 -0.717 1.00 . D A . 110 HEC HHB 1 1 14 26224 4 2 1 HEC HHC H -1.460 -2.797 2.169 1.00 . D A . 110 HEC HHC 1 1 14 26225 4 2 1 HEC HHD H -5.163 -7.921 3.326 1.00 . D A . 110 HEC HHD 1 1 14 26226 4 2 1 HEC HMA1 H -8.161 0.462 -1.485 1.00 . D A . 110 HEC HMA1 1 1 14 26227 4 2 1 HEC HMA2 H -9.578 -0.366 -2.175 1.00 . D A . 110 HEC HMA2 1 1 14 26228 4 2 1 HEC HMA3 H -9.721 0.507 -0.630 1.00 . D A . 110 HEC HMA3 1 1 14 26229 4 2 1 HEC HMB1 H -4.712 1.028 -1.353 1.00 . D A . 110 HEC HMB1 1 1 14 26230 4 2 1 HEC HMB2 H -3.747 1.783 -0.062 1.00 . D A . 110 HEC HMB2 1 1 14 26231 4 2 1 HEC HMB3 H -2.934 0.988 -1.431 1.00 . D A . 110 HEC HMB3 1 1 14 26232 4 2 1 HEC HMC1 H -0.310 -5.467 3.974 1.00 . D A . 110 HEC HMC1 1 1 14 26233 4 2 1 HEC HMC2 H -0.059 -6.118 2.336 1.00 . D A . 110 HEC HMC2 1 1 14 26234 4 2 1 HEC HMC3 H -0.223 -4.363 2.581 1.00 . D A . 110 HEC HMC3 1 1 14 26235 4 2 1 HEC HMD1 H -8.563 -9.364 3.054 1.00 . D A . 110 HEC HMD1 1 1 14 26236 4 2 1 HEC HMD2 H -6.802 -9.227 3.273 1.00 . D A . 110 HEC HMD2 1 1 14 26237 4 2 1 HEC HMD3 H -7.905 -8.590 4.516 1.00 . D A . 110 HEC HMD3 1 1 14 26238 4 2 1 HEC NA N -7.367 -2.898 0.606 1.00 . D A . 110 HEC NA 1 1 14 26239 4 2 1 HEC NB N -4.611 -2.289 0.957 1.00 . D A . 110 HEC NB 1 1 14 26240 4 2 1 HEC NC N -4.203 -4.854 2.143 1.00 . D A . 110 HEC NC 1 1 14 26241 4 2 1 HEC ND N -6.972 -5.433 1.836 1.00 . D A . 110 HEC ND 1 1 14 26242 4 2 1 HEC O1A O -12.356 -3.774 1.958 1.00 . D A . 110 HEC O1A 1 1 14 26243 4 2 1 HEC O1D O -10.807 -9.744 0.500 1.00 . D A . 110 HEC O1D 1 1 14 26244 4 2 1 HEC O2A O -14.042 -2.734 0.939 1.00 . D A . 110 HEC O2A 1 1 14 26245 4 2 1 HEC O2D O -12.768 -8.813 1.003 1.00 . D A . 110 HEC O2D 1 1 14 26246 5 2 1 HEC C1A C -0.102 4.061 -9.229 1.00 . E A . 111 HEC C1A 1 1 14 26247 5 2 1 HEC C1B C -1.401 0.601 -11.470 1.00 . E A . 111 HEC C1B 1 1 14 26248 5 2 1 HEC C1C C -3.232 -1.020 -7.872 1.00 . E A . 111 HEC C1C 1 1 14 26249 5 2 1 HEC C1D C -1.908 2.443 -5.653 1.00 . E A . 111 HEC C1D 1 1 14 26250 5 2 1 HEC C2A C 0.509 4.759 -10.336 1.00 . E A . 111 HEC C2A 1 1 14 26251 5 2 1 HEC C2B C -1.544 -0.568 -12.305 1.00 . E A . 111 HEC C2B 1 1 14 26252 5 2 1 HEC C2C C -3.951 -1.652 -6.791 1.00 . E A . 111 HEC C2C 1 1 14 26253 5 2 1 HEC C2D C -1.424 3.455 -4.744 1.00 . E A . 111 HEC C2D 1 1 14 26254 5 2 1 HEC C3A C 0.316 4.003 -11.437 1.00 . E A . 111 HEC C3A 1 1 14 26255 5 2 1 HEC C3B C -2.155 -1.514 -11.561 1.00 . E A . 111 HEC C3B 1 1 14 26256 5 2 1 HEC C3C C -3.832 -0.849 -5.712 1.00 . E A . 111 HEC C3C 1 1 14 26257 5 2 1 HEC C3D C -0.709 4.336 -5.475 1.00 . E A . 111 HEC C3D 1 1 14 26258 5 2 1 HEC C4A C -0.417 2.830 -11.023 1.00 . E A . 111 HEC C4A 1 1 14 26259 5 2 1 HEC C4B C -2.396 -0.940 -10.258 1.00 . E A . 111 HEC C4B 1 1 14 26260 5 2 1 HEC C4C C -3.038 0.288 -6.115 1.00 . E A . 111 HEC C4C 1 1 14 26261 5 2 1 HEC C4D C -0.742 3.877 -6.844 1.00 . E A . 111 HEC C4D 1 1 14 26262 5 2 1 HEC CAA C 1.217 6.078 -10.233 1.00 . E A . 111 HEC CAA 1 1 14 26263 5 2 1 HEC CAB C -2.531 -2.909 -11.968 1.00 . E A . 111 HEC CAB 1 1 14 26264 5 2 1 HEC CAC C -4.399 -1.056 -4.338 1.00 . E A . 111 HEC CAC 1 1 14 26265 5 2 1 HEC CAD C 0.003 5.569 -5.000 1.00 . E A . 111 HEC CAD 1 1 14 26266 5 2 1 HEC CBA C 2.612 6.084 -10.852 1.00 . E A . 111 HEC CBA 1 1 14 26267 5 2 1 HEC CBB C -1.443 -3.947 -11.705 1.00 . E A . 111 HEC CBB 1 1 14 26268 5 2 1 HEC CBC C -4.250 -2.482 -3.814 1.00 . E A . 111 HEC CBC 1 1 14 26269 5 2 1 HEC CBD C -0.927 6.733 -4.669 1.00 . E A . 111 HEC CBD 1 1 14 26270 5 2 1 HEC CGA C 2.815 7.306 -11.736 1.00 . E A . 111 HEC CGA 1 1 14 26271 5 2 1 HEC CGD C -0.145 8.028 -4.498 1.00 . E A . 111 HEC CGD 1 1 14 26272 5 2 1 HEC CHA C -0.110 4.528 -7.919 1.00 . E A . 111 HEC CHA 1 1 14 26273 5 2 1 HEC CHB C -0.815 1.792 -11.886 1.00 . E A . 111 HEC CHB 1 1 14 26274 5 2 1 HEC CHC C -3.018 -1.615 -9.192 1.00 . E A . 111 HEC CHC 1 1 14 26275 5 2 1 HEC CHD C -2.689 1.357 -5.270 1.00 . E A . 111 HEC CHD 1 1 14 26276 5 2 1 HEC CMA C 0.759 4.288 -12.843 1.00 . E A . 111 HEC CMA 1 1 14 26277 5 2 1 HEC CMB C -1.084 -0.667 -13.730 1.00 . E A . 111 HEC CMB 1 1 14 26278 5 2 1 HEC CMC C -4.681 -2.960 -6.893 1.00 . E A . 111 HEC CMC 1 1 14 26279 5 2 1 HEC CMD C -1.692 3.482 -3.267 1.00 . E A . 111 HEC CMD 1 1 14 26280 5 2 1 HEC FE FE -1.688 1.530 -8.566 1.00 . E A . 111 HEC FE 1 1 14 26281 5 2 1 HEC HAA1 H 0.635 6.844 -10.746 1.00 . E A . 111 HEC HAA1 1 1 14 26282 5 2 1 HEC HAA2 H 1.330 6.350 -9.184 1.00 . E A . 111 HEC HAA2 1 1 14 26283 5 2 1 HEC HAB H -3.415 -3.224 -11.414 1.00 . E A . 111 HEC HAB 1 1 14 26284 5 2 1 HEC HAC H -3.891 -0.400 -3.632 1.00 . E A . 111 HEC HAC 1 1 14 26285 5 2 1 HEC HAD1 H 0.564 5.339 -4.094 1.00 . E A . 111 HEC HAD1 1 1 14 26286 5 2 1 HEC HAD2 H 0.688 5.915 -5.774 1.00 . E A . 111 HEC HAD2 1 1 14 26287 5 2 1 HEC HBA1 H 3.361 6.099 -10.060 1.00 . E A . 111 HEC HBA1 1 1 14 26288 5 2 1 HEC HBA2 H 2.744 5.188 -11.459 1.00 . E A . 111 HEC HBA2 1 1 14 26289 5 2 1 HEC HBB1 H -0.503 -3.606 -12.139 1.00 . E A . 111 HEC HBB1 1 1 14 26290 5 2 1 HEC HBB2 H -1.320 -4.080 -10.630 1.00 . E A . 111 HEC HBB2 1 1 14 26291 5 2 1 HEC HBB3 H -1.729 -4.896 -12.158 1.00 . E A . 111 HEC HBB3 1 1 14 26292 5 2 1 HEC HBC1 H -4.113 -2.459 -2.733 1.00 . E A . 111 HEC HBC1 1 1 14 26293 5 2 1 HEC HBC2 H -5.147 -3.053 -4.055 1.00 . E A . 111 HEC HBC2 1 1 14 26294 5 2 1 HEC HBC3 H -3.385 -2.952 -4.281 1.00 . E A . 111 HEC HBC3 1 1 14 26295 5 2 1 HEC HBD1 H -1.646 6.865 -5.477 1.00 . E A . 111 HEC HBD1 1 1 14 26296 5 2 1 HEC HBD2 H -1.458 6.522 -3.741 1.00 . E A . 111 HEC HBD2 1 1 14 26297 5 2 1 HEC HHA H 0.408 5.463 -7.706 1.00 . E A . 111 HEC HHA 1 1 14 26298 5 2 1 HEC HHB H -0.650 1.936 -12.954 1.00 . E A . 111 HEC HHB 1 1 14 26299 5 2 1 HEC HHC H -3.360 -2.634 -9.373 1.00 . E A . 111 HEC HHC 1 1 14 26300 5 2 1 HEC HHD H -3.058 1.329 -4.245 1.00 . E A . 111 HEC HHD 1 1 14 26301 5 2 1 HEC HMA1 H -0.101 4.243 -13.511 1.00 . E A . 111 HEC HMA1 1 1 14 26302 5 2 1 HEC HMA2 H 1.204 5.282 -12.889 1.00 . E A . 111 HEC HMA2 1 1 14 26303 5 2 1 HEC HMA3 H 1.496 3.545 -13.149 1.00 . E A . 111 HEC HMA3 1 1 14 26304 5 2 1 HEC HMB1 H -0.982 -1.717 -14.007 1.00 . E A . 111 HEC HMB1 1 1 14 26305 5 2 1 HEC HMB2 H -1.816 -0.189 -14.382 1.00 . E A . 111 HEC HMB2 1 1 14 26306 5 2 1 HEC HMB3 H -0.121 -0.168 -13.837 1.00 . E A . 111 HEC HMB3 1 1 14 26307 5 2 1 HEC HMC1 H -4.305 -3.646 -6.134 1.00 . E A . 111 HEC HMC1 1 1 14 26308 5 2 1 HEC HMC2 H -5.747 -2.794 -6.737 1.00 . E A . 111 HEC HMC2 1 1 14 26309 5 2 1 HEC HMC3 H -4.520 -3.389 -7.882 1.00 . E A . 111 HEC HMC3 1 1 14 26310 5 2 1 HEC HMD1 H -2.542 2.839 -3.040 1.00 . E A . 111 HEC HMD1 1 1 14 26311 5 2 1 HEC HMD2 H -0.813 3.125 -2.732 1.00 . E A . 111 HEC HMD2 1 1 14 26312 5 2 1 HEC HMD3 H -1.916 4.503 -2.957 1.00 . E A . 111 HEC HMD3 1 1 14 26313 5 2 1 HEC NA N -0.668 2.875 -9.663 1.00 . E A . 111 HEC NA 1 1 14 26314 5 2 1 HEC NB N -1.929 0.362 -10.213 1.00 . E A . 111 HEC NB 1 1 14 26315 5 2 1 HEC NC N -2.674 0.172 -7.446 1.00 . E A . 111 HEC NC 1 1 14 26316 5 2 1 HEC ND N -1.482 2.712 -6.942 1.00 . E A . 111 HEC ND 1 1 14 26317 5 2 1 HEC O1A O 3.059 8.388 -11.161 1.00 . E A . 111 HEC O1A 1 1 14 26318 5 2 1 HEC O1D O -0.099 8.797 -5.483 1.00 . E A . 111 HEC O1D 1 1 14 26319 5 2 1 HEC O2A O 2.721 7.134 -12.971 1.00 . E A . 111 HEC O2A 1 1 14 26320 5 2 1 HEC O2D O 0.392 8.224 -3.387 1.00 . E A . 111 HEC O2D 1 1 15 26321 1 1 1 ALA C C -0.909 4.260 20.629 1.00 . A A . 1 ALA C 1 1 15 26322 1 1 1 ALA CA C 0.202 3.366 21.185 1.00 . A A . 1 ALA CA 1 1 15 26323 1 1 1 ALA CB C 0.019 1.898 20.795 1.00 . A A . 1 ALA CB 1 1 15 26324 1 1 1 ALA H1 H 1.141 3.188 22.976 1.00 . A A . 1 ALA H1 1 1 15 26325 1 1 1 ALA H2 H 0.071 4.449 22.897 1.00 . A A . 1 ALA H2 1 1 15 26326 1 1 1 ALA HA H 1.162 3.714 20.802 1.00 . A A . 1 ALA HA 1 1 15 26327 1 1 1 ALA HB1 H 0.579 1.266 21.485 1.00 . A A . 1 ALA HB1 1 1 15 26328 1 1 1 ALA HB2 H -1.039 1.639 20.843 1.00 . A A . 1 ALA HB2 1 1 15 26329 1 1 1 ALA HB3 H 0.386 1.743 19.781 1.00 . A A . 1 ALA HB3 1 1 15 26330 1 1 1 ALA N N 0.234 3.484 22.633 1.00 . A A . 1 ALA N 1 1 15 26331 1 1 1 ALA O O -2.009 4.303 21.178 1.00 . A A . 1 ALA O 1 1 15 26332 1 1 2 PRO C C -2.582 5.067 18.102 1.00 . A A . 2 PRO C 1 1 15 26333 1 1 2 PRO CA C -1.531 5.859 18.882 1.00 . A A . 2 PRO CA 1 1 15 26334 1 1 2 PRO CB C -0.695 6.768 17.997 1.00 . A A . 2 PRO CB 1 1 15 26335 1 1 2 PRO CD C 0.718 4.943 18.840 1.00 . A A . 2 PRO CD 1 1 15 26336 1 1 2 PRO CG C 0.637 6.058 17.811 1.00 . A A . 2 PRO CG 1 1 15 26337 1 1 2 PRO HA H -2.036 6.377 19.573 1.00 . A A . 2 PRO HA 1 1 15 26338 1 1 2 PRO HB2 H -1.184 6.937 17.038 1.00 . A A . 2 PRO HB2 1 1 15 26339 1 1 2 PRO HB3 H -0.555 7.744 18.460 1.00 . A A . 2 PRO HB3 1 1 15 26340 1 1 2 PRO HD2 H 0.897 3.978 18.365 1.00 . A A . 2 PRO HD2 1 1 15 26341 1 1 2 PRO HD3 H 1.536 5.109 19.541 1.00 . A A . 2 PRO HD3 1 1 15 26342 1 1 2 PRO HG2 H 0.716 5.653 16.802 1.00 . A A . 2 PRO HG2 1 1 15 26343 1 1 2 PRO HG3 H 1.463 6.757 17.940 1.00 . A A . 2 PRO HG3 1 1 15 26344 1 1 2 PRO N N -0.575 4.969 19.518 1.00 . A A . 2 PRO N 1 1 15 26345 1 1 2 PRO O O -2.271 4.041 17.499 1.00 . A A . 2 PRO O 1 1 15 26346 1 1 3 LYS C C -4.784 5.196 15.943 1.00 . A A . 3 LYS C 1 1 15 26347 1 1 3 LYS CA C -4.905 4.925 17.444 1.00 . A A . 3 LYS CA 1 1 15 26348 1 1 3 LYS CB C -6.246 5.359 18.040 1.00 . A A . 3 LYS CB 1 1 15 26349 1 1 3 LYS CD C -7.824 3.434 18.447 1.00 . A A . 3 LYS CD 1 1 15 26350 1 1 3 LYS CE C -8.664 2.765 19.537 1.00 . A A . 3 LYS CE 1 1 15 26351 1 1 3 LYS CG C -6.750 4.335 19.060 1.00 . A A . 3 LYS CG 1 1 15 26352 1 1 3 LYS H H -4.051 6.408 18.632 1.00 . A A . 3 LYS H 1 1 15 26353 1 1 3 LYS HA H -4.811 3.852 17.611 1.00 . A A . 3 LYS HA 1 1 15 26354 1 1 3 LYS HB2 H -6.138 6.332 18.520 1.00 . A A . 3 LYS HB2 1 1 15 26355 1 1 3 LYS HB3 H -6.981 5.477 17.244 1.00 . A A . 3 LYS HB3 1 1 15 26356 1 1 3 LYS HD2 H -8.470 4.023 17.796 1.00 . A A . 3 LYS HD2 1 1 15 26357 1 1 3 LYS HD3 H -7.354 2.672 17.826 1.00 . A A . 3 LYS HD3 1 1 15 26358 1 1 3 LYS HE2 H -9.132 1.863 19.141 1.00 . A A . 3 LYS HE2 1 1 15 26359 1 1 3 LYS HE3 H -8.022 2.455 20.361 1.00 . A A . 3 LYS HE3 1 1 15 26360 1 1 3 LYS HG2 H -5.917 3.726 19.411 1.00 . A A . 3 LYS HG2 1 1 15 26361 1 1 3 LYS HG3 H -7.156 4.852 19.929 1.00 . A A . 3 LYS HG3 1 1 15 26362 1 1 3 LYS HZ1 H -9.304 4.511 20.477 1.00 . A A . 3 LYS HZ1 1 1 15 26363 1 1 3 LYS HZ2 H -10.302 4.028 19.285 1.00 . A A . 3 LYS HZ2 1 1 15 26364 1 1 3 LYS N N -3.806 5.573 18.140 1.00 . A A . 3 LYS N 1 1 15 26365 1 1 3 LYS NZ N -9.705 3.693 20.032 1.00 . A A . 3 LYS NZ 1 1 15 26366 1 1 3 LYS O O -4.131 6.154 15.532 1.00 . A A . 3 LYS O 1 1 15 26367 1 1 4 ALA C C -6.091 5.768 13.317 1.00 . A A . 4 ALA C 1 1 15 26368 1 1 4 ALA CA C -5.393 4.467 13.719 1.00 . A A . 4 ALA CA 1 1 15 26369 1 1 4 ALA CB C -6.040 3.237 13.079 1.00 . A A . 4 ALA CB 1 1 15 26370 1 1 4 ALA H H -5.951 3.557 15.507 1.00 . A A . 4 ALA H 1 1 15 26371 1 1 4 ALA HA H -4.348 4.515 13.411 1.00 . A A . 4 ALA HA 1 1 15 26372 1 1 4 ALA HB1 H -6.037 2.413 13.792 1.00 . A A . 4 ALA HB1 1 1 15 26373 1 1 4 ALA HB2 H -7.067 3.471 12.798 1.00 . A A . 4 ALA HB2 1 1 15 26374 1 1 4 ALA HB3 H -5.477 2.951 12.191 1.00 . A A . 4 ALA HB3 1 1 15 26375 1 1 4 ALA N N -5.422 4.334 15.165 1.00 . A A . 4 ALA N 1 1 15 26376 1 1 4 ALA O O -6.975 6.247 14.025 1.00 . A A . 4 ALA O 1 1 15 26377 1 1 5 PRO C C -7.618 7.312 11.054 1.00 . A A . 5 PRO C 1 1 15 26378 1 1 5 PRO CA C -6.228 7.554 11.647 1.00 . A A . 5 PRO CA 1 1 15 26379 1 1 5 PRO CB C -5.227 8.063 10.623 1.00 . A A . 5 PRO CB 1 1 15 26380 1 1 5 PRO CD C -4.610 5.778 11.286 1.00 . A A . 5 PRO CD 1 1 15 26381 1 1 5 PRO CG C -4.363 6.867 10.255 1.00 . A A . 5 PRO CG 1 1 15 26382 1 1 5 PRO HA H -6.359 8.206 12.394 1.00 . A A . 5 PRO HA 1 1 15 26383 1 1 5 PRO HB2 H -5.734 8.463 9.746 1.00 . A A . 5 PRO HB2 1 1 15 26384 1 1 5 PRO HB3 H -4.621 8.869 11.037 1.00 . A A . 5 PRO HB3 1 1 15 26385 1 1 5 PRO HD2 H -4.928 4.850 10.813 1.00 . A A . 5 PRO HD2 1 1 15 26386 1 1 5 PRO HD3 H -3.705 5.555 11.851 1.00 . A A . 5 PRO HD3 1 1 15 26387 1 1 5 PRO HG2 H -4.612 6.510 9.255 1.00 . A A . 5 PRO HG2 1 1 15 26388 1 1 5 PRO HG3 H -3.310 7.147 10.240 1.00 . A A . 5 PRO HG3 1 1 15 26389 1 1 5 PRO N N -5.655 6.318 12.151 1.00 . A A . 5 PRO N 1 1 15 26390 1 1 5 PRO O O -7.930 6.202 10.626 1.00 . A A . 5 PRO O 1 1 15 26391 1 1 6 ALA C C -9.711 7.755 9.083 1.00 . A A . 6 ALA C 1 1 15 26392 1 1 6 ALA CA C -9.765 8.287 10.516 1.00 . A A . 6 ALA CA 1 1 15 26393 1 1 6 ALA CB C -10.434 9.660 10.603 1.00 . A A . 6 ALA CB 1 1 15 26394 1 1 6 ALA H H -8.154 9.270 11.398 1.00 . A A . 6 ALA H 1 1 15 26395 1 1 6 ALA HA H -10.323 7.585 11.135 1.00 . A A . 6 ALA HA 1 1 15 26396 1 1 6 ALA HB1 H -9.743 10.425 10.247 1.00 . A A . 6 ALA HB1 1 1 15 26397 1 1 6 ALA HB2 H -11.332 9.667 9.985 1.00 . A A . 6 ALA HB2 1 1 15 26398 1 1 6 ALA HB3 H -10.704 9.868 11.638 1.00 . A A . 6 ALA HB3 1 1 15 26399 1 1 6 ALA N N -8.416 8.370 11.048 1.00 . A A . 6 ALA N 1 1 15 26400 1 1 6 ALA O O -8.630 7.522 8.543 1.00 . A A . 6 ALA O 1 1 15 26401 1 1 7 ASP C C -10.959 8.253 6.170 1.00 . A A . 7 ASP C 1 1 15 26402 1 1 7 ASP CA C -10.992 7.076 7.146 1.00 . A A . 7 ASP CA 1 1 15 26403 1 1 7 ASP CB C -12.306 6.322 6.933 1.00 . A A . 7 ASP CB 1 1 15 26404 1 1 7 ASP CG C -12.485 5.077 7.804 1.00 . A A . 7 ASP CG 1 1 15 26405 1 1 7 ASP H H -11.765 7.769 8.952 1.00 . A A . 7 ASP H 1 1 15 26406 1 1 7 ASP HA H -10.139 6.408 7.023 1.00 . A A . 7 ASP HA 1 1 15 26407 1 1 7 ASP HB2 H -13.134 7.004 7.125 1.00 . A A . 7 ASP HB2 1 1 15 26408 1 1 7 ASP HB3 H -12.372 6.027 5.886 1.00 . A A . 7 ASP HB3 1 1 15 26409 1 1 7 ASP N N -10.891 7.577 8.506 1.00 . A A . 7 ASP N 1 1 15 26410 1 1 7 ASP O O -11.160 9.400 6.567 1.00 . A A . 7 ASP O 1 1 15 26411 1 1 7 ASP OD1 O -11.580 4.216 7.757 1.00 . A A . 7 ASP OD1 1 1 15 26412 1 1 7 ASP OD2 O -13.524 5.014 8.497 1.00 . A A . 7 ASP OD2 1 1 15 26413 1 1 8 GLY C C -9.196 9.384 3.622 1.00 . A A . 8 GLY C 1 1 15 26414 1 1 8 GLY CA C -10.640 8.946 3.874 1.00 . A A . 8 GLY CA 1 1 15 26415 1 1 8 GLY H H -10.540 6.995 4.596 1.00 . A A . 8 GLY H 1 1 15 26416 1 1 8 GLY HA2 H -11.073 8.558 2.952 1.00 . A A . 8 GLY HA2 1 1 15 26417 1 1 8 GLY HA3 H -11.239 9.808 4.169 1.00 . A A . 8 GLY HA3 1 1 15 26418 1 1 8 GLY N N -10.703 7.930 4.911 1.00 . A A . 8 GLY N 1 1 15 26419 1 1 8 GLY O O -8.957 10.433 3.026 1.00 . A A . 8 GLY O 1 1 15 26420 1 1 9 LEU C C -6.458 8.593 2.466 1.00 . A A . 9 LEU C 1 1 15 26421 1 1 9 LEU CA C -6.857 8.846 3.921 1.00 . A A . 9 LEU CA 1 1 15 26422 1 1 9 LEU CB C -6.025 8.056 4.933 1.00 . A A . 9 LEU CB 1 1 15 26423 1 1 9 LEU CD1 C -4.082 6.909 3.807 1.00 . A A . 9 LEU CD1 1 1 15 26424 1 1 9 LEU CD2 C -4.045 9.420 4.171 1.00 . A A . 9 LEU CD2 1 1 15 26425 1 1 9 LEU CG C -4.511 8.066 4.711 1.00 . A A . 9 LEU CG 1 1 15 26426 1 1 9 LEU H H -8.474 7.706 4.572 1.00 . A A . 9 LEU H 1 1 15 26427 1 1 9 LEU HA H -6.711 9.904 4.140 1.00 . A A . 9 LEU HA 1 1 15 26428 1 1 9 LEU HB2 H -6.229 8.451 5.929 1.00 . A A . 9 LEU HB2 1 1 15 26429 1 1 9 LEU HB3 H -6.367 7.021 4.925 1.00 . A A . 9 LEU HB3 1 1 15 26430 1 1 9 LEU HD11 H -4.954 6.310 3.545 1.00 . A A . 9 LEU HD11 1 1 15 26431 1 1 9 LEU HD12 H -3.629 7.307 2.899 1.00 . A A . 9 LEU HD12 1 1 15 26432 1 1 9 LEU HD13 H -3.358 6.287 4.332 1.00 . A A . 9 LEU HD13 1 1 15 26433 1 1 9 LEU HD21 H -4.706 10.205 4.539 1.00 . A A . 9 LEU HD21 1 1 15 26434 1 1 9 LEU HD22 H -3.027 9.614 4.507 1.00 . A A . 9 LEU HD22 1 1 15 26435 1 1 9 LEU HD23 H -4.072 9.404 3.081 1.00 . A A . 9 LEU HD23 1 1 15 26436 1 1 9 LEU HG H -4.024 7.919 5.675 1.00 . A A . 9 LEU HG 1 1 15 26437 1 1 9 LEU N N -8.271 8.558 4.088 1.00 . A A . 9 LEU N 1 1 15 26438 1 1 9 LEU O O -6.125 7.467 2.097 1.00 . A A . 9 LEU O 1 1 15 26439 1 1 10 LYS C C -4.651 9.809 0.109 1.00 . A A . 10 LYS C 1 1 15 26440 1 1 10 LYS CA C -6.152 9.564 0.272 1.00 . A A . 10 LYS CA 1 1 15 26441 1 1 10 LYS CB C -7.023 10.506 -0.562 1.00 . A A . 10 LYS CB 1 1 15 26442 1 1 10 LYS CD C -7.201 11.742 -2.753 1.00 . A A . 10 LYS CD 1 1 15 26443 1 1 10 LYS CE C -7.896 11.205 -4.006 1.00 . A A . 10 LYS CE 1 1 15 26444 1 1 10 LYS CG C -6.495 10.616 -1.994 1.00 . A A . 10 LYS CG 1 1 15 26445 1 1 10 LYS H H -6.776 10.569 1.987 1.00 . A A . 10 LYS H 1 1 15 26446 1 1 10 LYS HA H -6.374 8.548 -0.054 1.00 . A A . 10 LYS HA 1 1 15 26447 1 1 10 LYS HB2 H -8.050 10.142 -0.576 1.00 . A A . 10 LYS HB2 1 1 15 26448 1 1 10 LYS HB3 H -7.042 11.494 -0.101 1.00 . A A . 10 LYS HB3 1 1 15 26449 1 1 10 LYS HD2 H -7.934 12.220 -2.103 1.00 . A A . 10 LYS HD2 1 1 15 26450 1 1 10 LYS HD3 H -6.477 12.506 -3.034 1.00 . A A . 10 LYS HD3 1 1 15 26451 1 1 10 LYS HE2 H -7.674 11.850 -4.857 1.00 . A A . 10 LYS HE2 1 1 15 26452 1 1 10 LYS HE3 H -7.510 10.215 -4.248 1.00 . A A . 10 LYS HE3 1 1 15 26453 1 1 10 LYS HG2 H -5.421 10.803 -1.976 1.00 . A A . 10 LYS HG2 1 1 15 26454 1 1 10 LYS HG3 H -6.646 9.671 -2.515 1.00 . A A . 10 LYS HG3 1 1 15 26455 1 1 10 LYS HZ1 H -9.604 10.548 -3.009 1.00 . A A . 10 LYS HZ1 1 1 15 26456 1 1 10 LYS HZ2 H -9.761 12.050 -3.618 1.00 . A A . 10 LYS HZ2 1 1 15 26457 1 1 10 LYS N N -6.504 9.657 1.679 1.00 . A A . 10 LYS N 1 1 15 26458 1 1 10 LYS NZ N -9.360 11.137 -3.798 1.00 . A A . 10 LYS NZ 1 1 15 26459 1 1 10 LYS O O -4.059 10.580 0.863 1.00 . A A . 10 LYS O 1 1 15 26460 1 1 11 MET C C -2.417 9.892 -2.528 1.00 . A A . 11 MET C 1 1 15 26461 1 1 11 MET CA C -2.657 9.272 -1.150 1.00 . A A . 11 MET CA 1 1 15 26462 1 1 11 MET CB C -1.992 7.896 -1.087 1.00 . A A . 11 MET CB 1 1 15 26463 1 1 11 MET CE C -0.364 5.391 -0.062 1.00 . A A . 11 MET CE 1 1 15 26464 1 1 11 MET CG C -2.490 7.102 0.123 1.00 . A A . 11 MET CG 1 1 15 26465 1 1 11 MET H H -4.567 8.513 -1.488 1.00 . A A . 11 MET H 1 1 15 26466 1 1 11 MET HA H -2.272 9.935 -0.374 1.00 . A A . 11 MET HA 1 1 15 26467 1 1 11 MET HB2 H -2.205 7.343 -2.002 1.00 . A A . 11 MET HB2 1 1 15 26468 1 1 11 MET HB3 H -0.910 8.012 -1.029 1.00 . A A . 11 MET HB3 1 1 15 26469 1 1 11 MET HE1 H -0.017 6.423 -0.009 1.00 . A A . 11 MET HE1 1 1 15 26470 1 1 11 MET HE2 H -0.014 4.845 0.814 1.00 . A A . 11 MET HE2 1 1 15 26471 1 1 11 MET HE3 H 0.028 4.922 -0.964 1.00 . A A . 11 MET HE3 1 1 15 26472 1 1 11 MET HG2 H -2.003 7.460 1.029 1.00 . A A . 11 MET HG2 1 1 15 26473 1 1 11 MET HG3 H -3.561 7.256 0.254 1.00 . A A . 11 MET HG3 1 1 15 26474 1 1 11 MET N N -4.078 9.138 -0.879 1.00 . A A . 11 MET N 1 1 15 26475 1 1 11 MET O O -2.396 9.186 -3.535 1.00 . A A . 11 MET O 1 1 15 26476 1 1 11 MET SD S -2.148 5.364 -0.105 1.00 . A A . 11 MET SD 1 1 15 26477 1 1 12 GLU C C -0.526 12.288 -3.897 1.00 . A A . 12 GLU C 1 1 15 26478 1 1 12 GLU CA C -2.007 11.928 -3.767 1.00 . A A . 12 GLU CA 1 1 15 26479 1 1 12 GLU CB C -2.884 13.179 -3.848 1.00 . A A . 12 GLU CB 1 1 15 26480 1 1 12 GLU CD C -1.772 15.003 -5.188 1.00 . A A . 12 GLU CD 1 1 15 26481 1 1 12 GLU CG C -2.769 13.842 -5.222 1.00 . A A . 12 GLU CG 1 1 15 26482 1 1 12 GLU H H -2.263 11.773 -1.706 1.00 . A A . 12 GLU H 1 1 15 26483 1 1 12 GLU HA H -2.293 11.241 -4.563 1.00 . A A . 12 GLU HA 1 1 15 26484 1 1 12 GLU HB2 H -3.924 12.913 -3.655 1.00 . A A . 12 GLU HB2 1 1 15 26485 1 1 12 GLU HB3 H -2.588 13.886 -3.073 1.00 . A A . 12 GLU HB3 1 1 15 26486 1 1 12 GLU HG2 H -2.451 13.106 -5.959 1.00 . A A . 12 GLU HG2 1 1 15 26487 1 1 12 GLU HG3 H -3.747 14.207 -5.537 1.00 . A A . 12 GLU HG3 1 1 15 26488 1 1 12 GLU N N -2.244 11.205 -2.529 1.00 . A A . 12 GLU N 1 1 15 26489 1 1 12 GLU O O -0.166 13.464 -3.889 1.00 . A A . 12 GLU O 1 1 15 26490 1 1 12 GLU OE1 O -1.785 15.733 -4.174 1.00 . A A . 12 GLU OE1 1 1 15 26491 1 1 12 GLU OE2 O -1.019 15.133 -6.178 1.00 . A A . 12 GLU OE2 1 1 15 26492 1 1 13 ALA C C 2.147 11.153 -5.588 1.00 . A A . 13 ALA C 1 1 15 26493 1 1 13 ALA CA C 1.727 11.445 -4.146 1.00 . A A . 13 ALA CA 1 1 15 26494 1 1 13 ALA CB C 2.456 10.557 -3.135 1.00 . A A . 13 ALA CB 1 1 15 26495 1 1 13 ALA H H -0.008 10.300 -4.020 1.00 . A A . 13 ALA H 1 1 15 26496 1 1 13 ALA HA H 1.945 12.488 -3.917 1.00 . A A . 13 ALA HA 1 1 15 26497 1 1 13 ALA HB1 H 1.758 9.828 -2.722 1.00 . A A . 13 ALA HB1 1 1 15 26498 1 1 13 ALA HB2 H 3.273 10.035 -3.634 1.00 . A A . 13 ALA HB2 1 1 15 26499 1 1 13 ALA HB3 H 2.856 11.174 -2.331 1.00 . A A . 13 ALA HB3 1 1 15 26500 1 1 13 ALA N N 0.293 11.253 -4.014 1.00 . A A . 13 ALA N 1 1 15 26501 1 1 13 ALA O O 3.258 11.488 -5.995 1.00 . A A . 13 ALA O 1 1 15 26502 1 1 14 THR C C 0.351 10.672 -8.602 1.00 . A A . 14 THR C 1 1 15 26503 1 1 14 THR CA C 1.497 10.191 -7.709 1.00 . A A . 14 THR CA 1 1 15 26504 1 1 14 THR CB C 1.736 8.682 -7.788 1.00 . A A . 14 THR CB 1 1 15 26505 1 1 14 THR CG2 C 2.469 8.140 -6.560 1.00 . A A . 14 THR CG2 1 1 15 26506 1 1 14 THR H H 0.333 10.263 -5.983 1.00 . A A . 14 THR H 1 1 15 26507 1 1 14 THR HA H 2.395 10.719 -8.030 1.00 . A A . 14 THR HA 1 1 15 26508 1 1 14 THR HB H 2.264 8.419 -8.705 1.00 . A A . 14 THR HB 1 1 15 26509 1 1 14 THR HG1 H -0.021 8.441 -6.859 1.00 . A A . 14 THR HG1 1 1 15 26510 1 1 14 THR HG21 H 1.941 8.447 -5.657 1.00 . A A . 14 THR HG21 1 1 15 26511 1 1 14 THR HG22 H 2.503 7.052 -6.608 1.00 . A A . 14 THR HG22 1 1 15 26512 1 1 14 THR HG23 H 3.484 8.535 -6.539 1.00 . A A . 14 THR HG23 1 1 15 26513 1 1 14 THR N N 1.235 10.532 -6.321 1.00 . A A . 14 THR N 1 1 15 26514 1 1 14 THR O O -0.644 11.203 -8.109 1.00 . A A . 14 THR O 1 1 15 26515 1 1 14 THR OG1 O 0.431 8.118 -7.691 1.00 . A A . 14 THR OG1 1 1 15 26516 1 1 15 LYS C C -1.753 10.062 -10.640 1.00 . A A . 15 LYS C 1 1 15 26517 1 1 15 LYS CA C -0.478 10.877 -10.865 1.00 . A A . 15 LYS CA 1 1 15 26518 1 1 15 LYS CB C 0.074 10.776 -12.288 1.00 . A A . 15 LYS CB 1 1 15 26519 1 1 15 LYS CD C -0.068 12.317 -14.279 1.00 . A A . 15 LYS CD 1 1 15 26520 1 1 15 LYS CE C -0.973 13.345 -14.961 1.00 . A A . 15 LYS CE 1 1 15 26521 1 1 15 LYS CG C -0.860 11.462 -13.288 1.00 . A A . 15 LYS CG 1 1 15 26522 1 1 15 LYS H H 1.340 10.038 -10.291 1.00 . A A . 15 LYS H 1 1 15 26523 1 1 15 LYS HA H -0.702 11.927 -10.680 1.00 . A A . 15 LYS HA 1 1 15 26524 1 1 15 LYS HB2 H 1.061 11.235 -12.333 1.00 . A A . 15 LYS HB2 1 1 15 26525 1 1 15 LYS HB3 H 0.198 9.728 -12.561 1.00 . A A . 15 LYS HB3 1 1 15 26526 1 1 15 LYS HD2 H 0.741 12.829 -13.759 1.00 . A A . 15 LYS HD2 1 1 15 26527 1 1 15 LYS HD3 H 0.392 11.677 -15.032 1.00 . A A . 15 LYS HD3 1 1 15 26528 1 1 15 LYS HE2 H -1.346 12.942 -15.903 1.00 . A A . 15 LYS HE2 1 1 15 26529 1 1 15 LYS HE3 H -1.842 13.547 -14.334 1.00 . A A . 15 LYS HE3 1 1 15 26530 1 1 15 LYS HG2 H -1.435 10.711 -13.828 1.00 . A A . 15 LYS HG2 1 1 15 26531 1 1 15 LYS HG3 H -1.575 12.087 -12.753 1.00 . A A . 15 LYS HG3 1 1 15 26532 1 1 15 LYS HZ1 H 0.500 14.480 -15.902 1.00 . A A . 15 LYS HZ1 1 1 15 26533 1 1 15 LYS HZ2 H -0.840 15.339 -15.555 1.00 . A A . 15 LYS HZ2 1 1 15 26534 1 1 15 LYS N N 0.529 10.470 -9.899 1.00 . A A . 15 LYS N 1 1 15 26535 1 1 15 LYS NZ N -0.233 14.602 -15.212 1.00 . A A . 15 LYS NZ 1 1 15 26536 1 1 15 LYS O O -2.801 10.374 -11.204 1.00 . A A . 15 LYS O 1 1 15 26537 1 1 16 GLN C C -2.917 8.030 -7.996 1.00 . A A . 16 GLN C 1 1 15 26538 1 1 16 GLN CA C -2.751 8.170 -9.510 1.00 . A A . 16 GLN CA 1 1 15 26539 1 1 16 GLN CB C -2.590 6.801 -10.174 1.00 . A A . 16 GLN CB 1 1 15 26540 1 1 16 GLN CD C -3.437 6.830 -12.549 1.00 . A A . 16 GLN CD 1 1 15 26541 1 1 16 GLN CG C -2.206 6.947 -11.647 1.00 . A A . 16 GLN CG 1 1 15 26542 1 1 16 GLN H H -0.766 8.786 -9.361 1.00 . A A . 16 GLN H 1 1 15 26543 1 1 16 GLN HA H -3.621 8.672 -9.933 1.00 . A A . 16 GLN HA 1 1 15 26544 1 1 16 GLN HB2 H -1.825 6.227 -9.650 1.00 . A A . 16 GLN HB2 1 1 15 26545 1 1 16 GLN HB3 H -3.521 6.241 -10.091 1.00 . A A . 16 GLN HB3 1 1 15 26546 1 1 16 GLN HE21 H -3.700 4.943 -11.864 1.00 . A A . 16 GLN HE21 1 1 15 26547 1 1 16 GLN HE22 H -4.868 5.480 -13.025 1.00 . A A . 16 GLN HE22 1 1 15 26548 1 1 16 GLN HG2 H -1.724 7.912 -11.807 1.00 . A A . 16 GLN HG2 1 1 15 26549 1 1 16 GLN HG3 H -1.480 6.180 -11.916 1.00 . A A . 16 GLN HG3 1 1 15 26550 1 1 16 GLN N N -1.622 9.033 -9.816 1.00 . A A . 16 GLN N 1 1 15 26551 1 1 16 GLN NE2 N -4.052 5.654 -12.473 1.00 . A A . 16 GLN NE2 1 1 15 26552 1 1 16 GLN O O -2.248 7.210 -7.368 1.00 . A A . 16 GLN O 1 1 15 26553 1 1 16 GLN OE1 O -3.803 7.747 -13.266 1.00 . A A . 16 GLN OE1 1 1 15 26554 1 1 17 PRO C C -4.926 7.613 -5.624 1.00 . A A . 17 PRO C 1 1 15 26555 1 1 17 PRO CA C -4.098 8.840 -6.010 1.00 . A A . 17 PRO CA 1 1 15 26556 1 1 17 PRO CB C -4.808 10.152 -5.719 1.00 . A A . 17 PRO CB 1 1 15 26557 1 1 17 PRO CD C -4.646 9.847 -8.151 1.00 . A A . 17 PRO CD 1 1 15 26558 1 1 17 PRO CG C -5.331 10.649 -7.057 1.00 . A A . 17 PRO CG 1 1 15 26559 1 1 17 PRO HA H -3.240 8.762 -5.501 1.00 . A A . 17 PRO HA 1 1 15 26560 1 1 17 PRO HB2 H -5.624 10.005 -5.011 1.00 . A A . 17 PRO HB2 1 1 15 26561 1 1 17 PRO HB3 H -4.126 10.875 -5.273 1.00 . A A . 17 PRO HB3 1 1 15 26562 1 1 17 PRO HD2 H -5.374 9.363 -8.802 1.00 . A A . 17 PRO HD2 1 1 15 26563 1 1 17 PRO HD3 H -4.029 10.485 -8.783 1.00 . A A . 17 PRO HD3 1 1 15 26564 1 1 17 PRO HG2 H -6.412 10.527 -7.114 1.00 . A A . 17 PRO HG2 1 1 15 26565 1 1 17 PRO HG3 H -5.123 11.712 -7.176 1.00 . A A . 17 PRO HG3 1 1 15 26566 1 1 17 PRO N N -3.835 8.863 -7.439 1.00 . A A . 17 PRO N 1 1 15 26567 1 1 17 PRO O O -5.497 6.948 -6.488 1.00 . A A . 17 PRO O 1 1 15 26568 1 1 18 VAL C C -6.247 6.544 -2.420 1.00 . A A . 18 VAL C 1 1 15 26569 1 1 18 VAL CA C -5.715 6.214 -3.816 1.00 . A A . 18 VAL CA 1 1 15 26570 1 1 18 VAL CB C -4.843 4.957 -3.842 1.00 . A A . 18 VAL CB 1 1 15 26571 1 1 18 VAL CG1 C -5.535 3.794 -3.128 1.00 . A A . 18 VAL CG1 1 1 15 26572 1 1 18 VAL CG2 C -4.470 4.577 -5.276 1.00 . A A . 18 VAL CG2 1 1 15 26573 1 1 18 VAL H H -4.500 7.895 -3.630 1.00 . A A . 18 VAL H 1 1 15 26574 1 1 18 VAL HA H -6.561 6.051 -4.484 1.00 . A A . 18 VAL HA 1 1 15 26575 1 1 18 VAL HB H -3.921 5.179 -3.304 1.00 . A A . 18 VAL HB 1 1 15 26576 1 1 18 VAL HG11 H -6.615 3.895 -3.233 1.00 . A A . 18 VAL HG11 1 1 15 26577 1 1 18 VAL HG12 H -5.214 2.852 -3.572 1.00 . A A . 18 VAL HG12 1 1 15 26578 1 1 18 VAL HG13 H -5.269 3.807 -2.071 1.00 . A A . 18 VAL HG13 1 1 15 26579 1 1 18 VAL HG21 H -5.329 4.735 -5.928 1.00 . A A . 18 VAL HG21 1 1 15 26580 1 1 18 VAL HG22 H -3.640 5.198 -5.612 1.00 . A A . 18 VAL HG22 1 1 15 26581 1 1 18 VAL HG23 H -4.177 3.528 -5.309 1.00 . A A . 18 VAL HG23 1 1 15 26582 1 1 18 VAL N N -4.966 7.350 -4.326 1.00 . A A . 18 VAL N 1 1 15 26583 1 1 18 VAL O O -5.640 7.327 -1.690 1.00 . A A . 18 VAL O 1 1 15 26584 1 1 19 VAL C C -7.999 4.840 -0.007 1.00 . A A . 19 VAL C 1 1 15 26585 1 1 19 VAL CA C -7.995 6.152 -0.795 1.00 . A A . 19 VAL CA 1 1 15 26586 1 1 19 VAL CB C -9.394 6.744 -0.979 1.00 . A A . 19 VAL CB 1 1 15 26587 1 1 19 VAL CG1 C -10.171 6.732 0.339 1.00 . A A . 19 VAL CG1 1 1 15 26588 1 1 19 VAL CG2 C -9.319 8.158 -1.558 1.00 . A A . 19 VAL CG2 1 1 15 26589 1 1 19 VAL H H -7.862 5.297 -2.690 1.00 . A A . 19 VAL H 1 1 15 26590 1 1 19 VAL HA H -7.387 6.881 -0.259 1.00 . A A . 19 VAL HA 1 1 15 26591 1 1 19 VAL HB H -9.932 6.118 -1.691 1.00 . A A . 19 VAL HB 1 1 15 26592 1 1 19 VAL HG11 H -9.600 7.259 1.103 1.00 . A A . 19 VAL HG11 1 1 15 26593 1 1 19 VAL HG12 H -11.132 7.226 0.199 1.00 . A A . 19 VAL HG12 1 1 15 26594 1 1 19 VAL HG13 H -10.335 5.701 0.655 1.00 . A A . 19 VAL HG13 1 1 15 26595 1 1 19 VAL HG21 H -8.284 8.397 -1.801 1.00 . A A . 19 VAL HG21 1 1 15 26596 1 1 19 VAL HG22 H -9.926 8.213 -2.462 1.00 . A A . 19 VAL HG22 1 1 15 26597 1 1 19 VAL HG23 H -9.695 8.872 -0.825 1.00 . A A . 19 VAL HG23 1 1 15 26598 1 1 19 VAL N N -7.375 5.932 -2.091 1.00 . A A . 19 VAL N 1 1 15 26599 1 1 19 VAL O O -8.684 3.889 -0.382 1.00 . A A . 19 VAL O 1 1 15 26600 1 1 20 PHE C C -8.078 3.759 3.112 1.00 . A A . 20 PHE C 1 1 15 26601 1 1 20 PHE CA C -7.134 3.652 1.913 1.00 . A A . 20 PHE CA 1 1 15 26602 1 1 20 PHE CB C -5.690 3.609 2.418 1.00 . A A . 20 PHE CB 1 1 15 26603 1 1 20 PHE CD1 C -5.035 1.176 2.514 1.00 . A A . 20 PHE CD1 1 1 15 26604 1 1 20 PHE CD2 C -5.329 2.352 4.574 1.00 . A A . 20 PHE CD2 1 1 15 26605 1 1 20 PHE CE1 C -4.706 -0.020 3.244 1.00 . A A . 20 PHE CE1 1 1 15 26606 1 1 20 PHE CE2 C -5.000 1.156 5.305 1.00 . A A . 20 PHE CE2 1 1 15 26607 1 1 20 PHE CG C -5.340 2.338 3.194 1.00 . A A . 20 PHE CG 1 1 15 26608 1 1 20 PHE CZ C -4.704 0.029 4.603 1.00 . A A . 20 PHE CZ 1 1 15 26609 1 1 20 PHE H H -6.674 5.609 1.367 1.00 . A A . 20 PHE H 1 1 15 26610 1 1 20 PHE HA H -7.416 2.787 1.314 1.00 . A A . 20 PHE HA 1 1 15 26611 1 1 20 PHE HB2 H -5.015 3.700 1.567 1.00 . A A . 20 PHE HB2 1 1 15 26612 1 1 20 PHE HB3 H -5.514 4.473 3.059 1.00 . A A . 20 PHE HB3 1 1 15 26613 1 1 20 PHE HD1 H -5.043 1.165 1.424 1.00 . A A . 20 PHE HD1 1 1 15 26614 1 1 20 PHE HD2 H -5.570 3.270 5.111 1.00 . A A . 20 PHE HD2 1 1 15 26615 1 1 20 PHE HE1 H -4.463 -0.944 2.720 1.00 . A A . 20 PHE HE1 1 1 15 26616 1 1 20 PHE HE2 H -4.988 1.154 6.394 1.00 . A A . 20 PHE HE2 1 1 15 26617 1 1 20 PHE HZ H -4.415 -0.944 5.078 1.00 . A A . 20 PHE HZ 1 1 15 26618 1 1 20 PHE N N -7.227 4.832 1.069 1.00 . A A . 20 PHE N 1 1 15 26619 1 1 20 PHE O O -8.714 4.792 3.316 1.00 . A A . 20 PHE O 1 1 15 26620 1 1 21 ASN C C -8.353 1.744 6.112 1.00 . A A . 21 ASN C 1 1 15 26621 1 1 21 ASN CA C -8.996 2.636 5.047 1.00 . A A . 21 ASN CA 1 1 15 26622 1 1 21 ASN CB C -10.368 2.051 4.707 1.00 . A A . 21 ASN CB 1 1 15 26623 1 1 21 ASN CG C -11.131 2.965 3.746 1.00 . A A . 21 ASN CG 1 1 15 26624 1 1 21 ASN H H -7.619 1.841 3.702 1.00 . A A . 21 ASN H 1 1 15 26625 1 1 21 ASN HA H -9.088 3.672 5.371 1.00 . A A . 21 ASN HA 1 1 15 26626 1 1 21 ASN HB2 H -10.247 1.066 4.258 1.00 . A A . 21 ASN HB2 1 1 15 26627 1 1 21 ASN HB3 H -10.947 1.916 5.621 1.00 . A A . 21 ASN HB3 1 1 15 26628 1 1 21 ASN HD21 H -10.126 2.110 2.211 1.00 . A A . 21 ASN HD21 1 1 15 26629 1 1 21 ASN HD22 H -11.256 3.343 1.760 1.00 . A A . 21 ASN HD22 1 1 15 26630 1 1 21 ASN N N -8.140 2.677 3.874 1.00 . A A . 21 ASN N 1 1 15 26631 1 1 21 ASN ND2 N -10.811 2.792 2.467 1.00 . A A . 21 ASN ND2 1 1 15 26632 1 1 21 ASN O O -7.890 0.646 5.809 1.00 . A A . 21 ASN O 1 1 15 26633 1 1 21 ASN OD1 O -11.954 3.775 4.139 1.00 . A A . 21 ASN OD1 1 1 15 26634 1 1 22 HIS C C -8.849 0.669 9.121 1.00 . A A . 22 HIS C 1 1 15 26635 1 1 22 HIS CA C -7.767 1.514 8.447 1.00 . A A . 22 HIS CA 1 1 15 26636 1 1 22 HIS CB C -7.063 2.463 9.420 1.00 . A A . 22 HIS CB 1 1 15 26637 1 1 22 HIS CD2 C -4.470 2.148 9.345 1.00 . A A . 22 HIS CD2 1 1 15 26638 1 1 22 HIS CE1 C -3.981 3.884 8.106 1.00 . A A . 22 HIS CE1 1 1 15 26639 1 1 22 HIS CG C -5.637 2.784 9.041 1.00 . A A . 22 HIS CG 1 1 15 26640 1 1 22 HIS H H -8.725 3.145 7.574 1.00 . A A . 22 HIS H 1 1 15 26641 1 1 22 HIS HA H -7.012 0.852 8.024 1.00 . A A . 22 HIS HA 1 1 15 26642 1 1 22 HIS HB2 H -7.631 3.391 9.480 1.00 . A A . 22 HIS HB2 1 1 15 26643 1 1 22 HIS HB3 H -7.073 2.018 10.415 1.00 . A A . 22 HIS HB3 1 1 15 26644 1 1 22 HIS HD1 H -5.935 4.541 7.876 1.00 . A A . 22 HIS HD1 1 1 15 26645 1 1 22 HIS HD2 H -4.374 1.247 9.951 1.00 . A A . 22 HIS HD2 1 1 15 26646 1 1 22 HIS HE1 H -3.407 4.618 7.541 1.00 . A A . 22 HIS HE1 1 1 15 26647 1 1 22 HIS N N -8.346 2.251 7.336 1.00 . A A . 22 HIS N 1 1 15 26648 1 1 22 HIS ND1 N -5.297 3.874 8.260 1.00 . A A . 22 HIS ND1 1 1 15 26649 1 1 22 HIS NE2 N -3.470 2.813 8.779 1.00 . A A . 22 HIS NE2 1 1 15 26650 1 1 22 HIS O O -8.547 -0.181 9.958 1.00 . A A . 22 HIS O 1 1 15 26651 1 1 23 SER C C -11.485 -1.058 8.465 1.00 . A A . 23 SER C 1 1 15 26652 1 1 23 SER CA C -11.217 0.204 9.288 1.00 . A A . 23 SER CA 1 1 15 26653 1 1 23 SER CB C -12.468 1.083 9.335 1.00 . A A . 23 SER CB 1 1 15 26654 1 1 23 SER H H -10.325 1.622 8.050 1.00 . A A . 23 SER H 1 1 15 26655 1 1 23 SER HA H -10.919 -0.058 10.303 1.00 . A A . 23 SER HA 1 1 15 26656 1 1 23 SER HB2 H -12.462 1.768 8.487 1.00 . A A . 23 SER HB2 1 1 15 26657 1 1 23 SER HB3 H -13.355 0.457 9.233 1.00 . A A . 23 SER HB3 1 1 15 26658 1 1 23 SER HG H -11.634 1.992 10.911 1.00 . A A . 23 SER HG 1 1 15 26659 1 1 23 SER N N -10.088 0.930 8.731 1.00 . A A . 23 SER N 1 1 15 26660 1 1 23 SER O O -12.352 -1.858 8.813 1.00 . A A . 23 SER O 1 1 15 26661 1 1 23 SER OG O -12.551 1.829 10.546 1.00 . A A . 23 SER OG 1 1 15 26662 1 1 24 THR C C -9.738 -3.347 6.754 1.00 . A A . 24 THR C 1 1 15 26663 1 1 24 THR CA C -10.870 -2.346 6.512 1.00 . A A . 24 THR CA 1 1 15 26664 1 1 24 THR CB C -10.933 -1.837 5.071 1.00 . A A . 24 THR CB 1 1 15 26665 1 1 24 THR CG2 C -11.023 -2.975 4.052 1.00 . A A . 24 THR CG2 1 1 15 26666 1 1 24 THR H H -10.022 -0.540 7.112 1.00 . A A . 24 THR H 1 1 15 26667 1 1 24 THR HA H -11.803 -2.852 6.761 1.00 . A A . 24 THR HA 1 1 15 26668 1 1 24 THR HB H -10.089 -1.184 4.851 1.00 . A A . 24 THR HB 1 1 15 26669 1 1 24 THR HG1 H -12.083 -0.236 4.722 1.00 . A A . 24 THR HG1 1 1 15 26670 1 1 24 THR HG21 H -10.876 -3.929 4.558 1.00 . A A . 24 THR HG21 1 1 15 26671 1 1 24 THR HG22 H -12.005 -2.963 3.579 1.00 . A A . 24 THR HG22 1 1 15 26672 1 1 24 THR HG23 H -10.253 -2.844 3.292 1.00 . A A . 24 THR HG23 1 1 15 26673 1 1 24 THR N N -10.725 -1.196 7.388 1.00 . A A . 24 THR N 1 1 15 26674 1 1 24 THR O O -9.930 -4.553 6.610 1.00 . A A . 24 THR O 1 1 15 26675 1 1 24 THR OG1 O -12.202 -1.194 4.985 1.00 . A A . 24 THR OG1 1 1 15 26676 1 1 25 HIS C C -7.236 -3.800 8.891 1.00 . A A . 25 HIS C 1 1 15 26677 1 1 25 HIS CA C -7.421 -3.639 7.381 1.00 . A A . 25 HIS CA 1 1 15 26678 1 1 25 HIS CB C -6.180 -3.072 6.689 1.00 . A A . 25 HIS CB 1 1 15 26679 1 1 25 HIS CD2 C -5.773 -3.695 4.183 1.00 . A A . 25 HIS CD2 1 1 15 26680 1 1 25 HIS CE1 C -6.996 -2.127 3.270 1.00 . A A . 25 HIS CE1 1 1 15 26681 1 1 25 HIS CG C -6.314 -2.951 5.190 1.00 . A A . 25 HIS CG 1 1 15 26682 1 1 25 HIS H H -8.436 -1.826 7.233 1.00 . A A . 25 HIS H 1 1 15 26683 1 1 25 HIS HA H -7.628 -4.616 6.943 1.00 . A A . 25 HIS HA 1 1 15 26684 1 1 25 HIS HB2 H -5.962 -2.088 7.105 1.00 . A A . 25 HIS HB2 1 1 15 26685 1 1 25 HIS HB3 H -5.326 -3.710 6.916 1.00 . A A . 25 HIS HB3 1 1 15 26686 1 1 25 HIS HD1 H -7.606 -1.263 5.055 1.00 . A A . 25 HIS HD1 1 1 15 26687 1 1 25 HIS HD2 H -5.113 -4.553 4.310 1.00 . A A . 25 HIS HD2 1 1 15 26688 1 1 25 HIS HE1 H -7.488 -1.510 2.518 1.00 . A A . 25 HIS HE1 1 1 15 26689 1 1 25 HIS N N -8.583 -2.809 7.118 1.00 . A A . 25 HIS N 1 1 15 26690 1 1 25 HIS ND1 N -7.080 -1.970 4.583 1.00 . A A . 25 HIS ND1 1 1 15 26691 1 1 25 HIS NE2 N -6.186 -3.197 3.024 1.00 . A A . 25 HIS NE2 1 1 15 26692 1 1 25 HIS O O -6.108 -3.859 9.380 1.00 . A A . 25 HIS O 1 1 15 26693 1 1 26 LYS C C -7.784 -5.401 11.388 1.00 . A A . 26 LYS C 1 1 15 26694 1 1 26 LYS CA C -8.337 -4.019 11.034 1.00 . A A . 26 LYS CA 1 1 15 26695 1 1 26 LYS CB C -9.720 -3.740 11.625 1.00 . A A . 26 LYS CB 1 1 15 26696 1 1 26 LYS CD C -11.658 -2.128 11.704 1.00 . A A . 26 LYS CD 1 1 15 26697 1 1 26 LYS CE C -11.606 -1.518 13.106 1.00 . A A . 26 LYS CE 1 1 15 26698 1 1 26 LYS CG C -10.249 -2.380 11.163 1.00 . A A . 26 LYS CG 1 1 15 26699 1 1 26 LYS H H -9.273 -3.818 9.184 1.00 . A A . 26 LYS H 1 1 15 26700 1 1 26 LYS HA H -7.658 -3.264 11.431 1.00 . A A . 26 LYS HA 1 1 15 26701 1 1 26 LYS HB2 H -10.413 -4.525 11.324 1.00 . A A . 26 LYS HB2 1 1 15 26702 1 1 26 LYS HB3 H -9.666 -3.762 12.713 1.00 . A A . 26 LYS HB3 1 1 15 26703 1 1 26 LYS HD2 H -12.195 -1.459 11.031 1.00 . A A . 26 LYS HD2 1 1 15 26704 1 1 26 LYS HD3 H -12.214 -3.066 11.732 1.00 . A A . 26 LYS HD3 1 1 15 26705 1 1 26 LYS HE2 H -11.380 -2.292 13.838 1.00 . A A . 26 LYS HE2 1 1 15 26706 1 1 26 LYS HE3 H -10.803 -0.783 13.159 1.00 . A A . 26 LYS HE3 1 1 15 26707 1 1 26 LYS HG2 H -9.579 -1.591 11.503 1.00 . A A . 26 LYS HG2 1 1 15 26708 1 1 26 LYS HG3 H -10.261 -2.342 10.074 1.00 . A A . 26 LYS HG3 1 1 15 26709 1 1 26 LYS HZ1 H -13.051 -0.826 14.440 1.00 . A A . 26 LYS HZ1 1 1 15 26710 1 1 26 LYS HZ2 H -12.950 0.076 13.088 1.00 . A A . 26 LYS HZ2 1 1 15 26711 1 1 26 LYS N N -8.360 -3.867 9.589 1.00 . A A . 26 LYS N 1 1 15 26712 1 1 26 LYS NZ N -12.897 -0.874 13.438 1.00 . A A . 26 LYS NZ 1 1 15 26713 1 1 26 LYS O O -7.043 -5.548 12.358 1.00 . A A . 26 LYS O 1 1 15 26714 1 1 27 SER C C -6.245 -7.881 10.410 1.00 . A A . 27 SER C 1 1 15 26715 1 1 27 SER CA C -7.719 -7.746 10.797 1.00 . A A . 27 SER CA 1 1 15 26716 1 1 27 SER CB C -8.570 -8.736 10.000 1.00 . A A . 27 SER CB 1 1 15 26717 1 1 27 SER H H -8.769 -6.253 9.793 1.00 . A A . 27 SER H 1 1 15 26718 1 1 27 SER HA H -7.853 -7.928 11.863 1.00 . A A . 27 SER HA 1 1 15 26719 1 1 27 SER HB2 H -8.258 -9.754 10.236 1.00 . A A . 27 SER HB2 1 1 15 26720 1 1 27 SER HB3 H -9.613 -8.644 10.303 1.00 . A A . 27 SER HB3 1 1 15 26721 1 1 27 SER HG H -9.115 -7.820 8.306 1.00 . A A . 27 SER HG 1 1 15 26722 1 1 27 SER N N -8.166 -6.380 10.581 1.00 . A A . 27 SER N 1 1 15 26723 1 1 27 SER O O -5.597 -8.868 10.753 1.00 . A A . 27 SER O 1 1 15 26724 1 1 27 SER OG O -8.464 -8.522 8.595 1.00 . A A . 27 SER OG 1 1 15 26725 1 1 28 VAL C C -3.496 -6.270 10.363 1.00 . A A . 28 VAL C 1 1 15 26726 1 1 28 VAL CA C -4.373 -6.868 9.261 1.00 . A A . 28 VAL CA 1 1 15 26727 1 1 28 VAL CB C -4.248 -6.126 7.929 1.00 . A A . 28 VAL CB 1 1 15 26728 1 1 28 VAL CG1 C -2.827 -6.232 7.373 1.00 . A A . 28 VAL CG1 1 1 15 26729 1 1 28 VAL CG2 C -5.273 -6.640 6.917 1.00 . A A . 28 VAL CG2 1 1 15 26730 1 1 28 VAL H H -6.292 -6.074 9.424 1.00 . A A . 28 VAL H 1 1 15 26731 1 1 28 VAL HA H -4.075 -7.904 9.099 1.00 . A A . 28 VAL HA 1 1 15 26732 1 1 28 VAL HB H -4.458 -5.072 8.112 1.00 . A A . 28 VAL HB 1 1 15 26733 1 1 28 VAL HG11 H -2.134 -6.448 8.186 1.00 . A A . 28 VAL HG11 1 1 15 26734 1 1 28 VAL HG12 H -2.784 -7.035 6.637 1.00 . A A . 28 VAL HG12 1 1 15 26735 1 1 28 VAL HG13 H -2.550 -5.290 6.900 1.00 . A A . 28 VAL HG13 1 1 15 26736 1 1 28 VAL HG21 H -6.225 -6.813 7.419 1.00 . A A . 28 VAL HG21 1 1 15 26737 1 1 28 VAL HG22 H -5.408 -5.899 6.128 1.00 . A A . 28 VAL HG22 1 1 15 26738 1 1 28 VAL HG23 H -4.917 -7.573 6.481 1.00 . A A . 28 VAL HG23 1 1 15 26739 1 1 28 VAL N N -5.758 -6.874 9.699 1.00 . A A . 28 VAL N 1 1 15 26740 1 1 28 VAL O O -3.878 -5.291 11.003 1.00 . A A . 28 VAL O 1 1 15 26741 1 1 29 LYS C C -0.803 -5.086 11.132 1.00 . A A . 29 LYS C 1 1 15 26742 1 1 29 LYS CA C -1.404 -6.425 11.566 1.00 . A A . 29 LYS CA 1 1 15 26743 1 1 29 LYS CB C -0.358 -7.502 11.859 1.00 . A A . 29 LYS CB 1 1 15 26744 1 1 29 LYS CD C 0.647 -8.988 13.632 1.00 . A A . 29 LYS CD 1 1 15 26745 1 1 29 LYS CE C 0.134 -10.429 13.635 1.00 . A A . 29 LYS CE 1 1 15 26746 1 1 29 LYS CG C -0.478 -8.006 13.299 1.00 . A A . 29 LYS CG 1 1 15 26747 1 1 29 LYS H H -2.034 -7.680 10.028 1.00 . A A . 29 LYS H 1 1 15 26748 1 1 29 LYS HA H -1.970 -6.267 12.484 1.00 . A A . 29 LYS HA 1 1 15 26749 1 1 29 LYS HB2 H -0.484 -8.335 11.167 1.00 . A A . 29 LYS HB2 1 1 15 26750 1 1 29 LYS HB3 H 0.641 -7.099 11.693 1.00 . A A . 29 LYS HB3 1 1 15 26751 1 1 29 LYS HD2 H 1.451 -8.887 12.902 1.00 . A A . 29 LYS HD2 1 1 15 26752 1 1 29 LYS HD3 H 1.070 -8.746 14.607 1.00 . A A . 29 LYS HD3 1 1 15 26753 1 1 29 LYS HE2 H 0.614 -10.991 14.437 1.00 . A A . 29 LYS HE2 1 1 15 26754 1 1 29 LYS HE3 H -0.937 -10.440 13.837 1.00 . A A . 29 LYS HE3 1 1 15 26755 1 1 29 LYS HG2 H -0.444 -7.162 13.987 1.00 . A A . 29 LYS HG2 1 1 15 26756 1 1 29 LYS HG3 H -1.443 -8.493 13.438 1.00 . A A . 29 LYS HG3 1 1 15 26757 1 1 29 LYS HZ1 H 0.161 -12.064 12.343 1.00 . A A . 29 LYS HZ1 1 1 15 26758 1 1 29 LYS HZ2 H -0.120 -10.653 11.579 1.00 . A A . 29 LYS HZ2 1 1 15 26759 1 1 29 LYS N N -2.337 -6.884 10.552 1.00 . A A . 29 LYS N 1 1 15 26760 1 1 29 LYS NZ N 0.406 -11.080 12.334 1.00 . A A . 29 LYS NZ 1 1 15 26761 1 1 29 LYS O O -0.437 -4.914 9.970 1.00 . A A . 29 LYS O 1 1 15 26762 1 1 30 CYS C C 1.263 -3.027 11.314 1.00 . A A . 30 CYS C 1 1 15 26763 1 1 30 CYS CA C -0.171 -2.855 11.819 1.00 . A A . 30 CYS CA 1 1 15 26764 1 1 30 CYS CB C -0.238 -1.951 13.051 1.00 . A A . 30 CYS CB 1 1 15 26765 1 1 30 CYS H H -1.020 -4.321 13.031 1.00 . A A . 30 CYS H 1 1 15 26766 1 1 30 CYS HA H -0.800 -2.405 11.051 1.00 . A A . 30 CYS HA 1 1 15 26767 1 1 30 CYS HB2 H 0.587 -2.206 13.717 1.00 . A A . 30 CYS HB2 1 1 15 26768 1 1 30 CYS HB3 H -0.086 -0.919 12.736 1.00 . A A . 30 CYS HB3 1 1 15 26769 1 1 30 CYS N N -0.720 -4.173 12.088 1.00 . A A . 30 CYS N 1 1 15 26770 1 1 30 CYS O O 1.746 -2.222 10.519 1.00 . A A . 30 CYS O 1 1 15 26771 1 1 30 CYS SG S -1.804 -2.053 13.993 1.00 . A A . 30 CYS SG 1 1 15 26772 1 1 31 GLY C C 3.323 -5.030 10.027 1.00 . A A . 31 GLY C 1 1 15 26773 1 1 31 GLY CA C 3.274 -4.368 11.406 1.00 . A A . 31 GLY CA 1 1 15 26774 1 1 31 GLY H H 1.505 -4.731 12.444 1.00 . A A . 31 GLY H 1 1 15 26775 1 1 31 GLY HA2 H 3.853 -3.445 11.391 1.00 . A A . 31 GLY HA2 1 1 15 26776 1 1 31 GLY HA3 H 3.737 -5.023 12.144 1.00 . A A . 31 GLY HA3 1 1 15 26777 1 1 31 GLY N N 1.905 -4.081 11.797 1.00 . A A . 31 GLY N 1 1 15 26778 1 1 31 GLY O O 4.402 -5.300 9.502 1.00 . A A . 31 GLY O 1 1 15 26779 1 1 32 ASP C C 2.266 -4.842 7.088 1.00 . A A . 32 ASP C 1 1 15 26780 1 1 32 ASP CA C 2.035 -5.896 8.172 1.00 . A A . 32 ASP CA 1 1 15 26781 1 1 32 ASP CB C 0.643 -6.496 7.960 1.00 . A A . 32 ASP CB 1 1 15 26782 1 1 32 ASP CG C 0.510 -7.401 6.733 1.00 . A A . 32 ASP CG 1 1 15 26783 1 1 32 ASP H H 1.268 -5.048 9.913 1.00 . A A . 32 ASP H 1 1 15 26784 1 1 32 ASP HA H 2.796 -6.676 8.165 1.00 . A A . 32 ASP HA 1 1 15 26785 1 1 32 ASP HB2 H 0.372 -7.069 8.847 1.00 . A A . 32 ASP HB2 1 1 15 26786 1 1 32 ASP HB3 H -0.077 -5.683 7.873 1.00 . A A . 32 ASP HB3 1 1 15 26787 1 1 32 ASP N N 2.141 -5.271 9.480 1.00 . A A . 32 ASP N 1 1 15 26788 1 1 32 ASP O O 2.736 -5.162 5.997 1.00 . A A . 32 ASP O 1 1 15 26789 1 1 32 ASP OD1 O 1.019 -6.992 5.668 1.00 . A A . 32 ASP OD1 1 1 15 26790 1 1 32 ASP OD2 O -0.097 -8.483 6.889 1.00 . A A . 32 ASP OD2 1 1 15 26791 1 1 33 CYS C C 3.213 -1.603 7.009 1.00 . A A . 33 CYS C 1 1 15 26792 1 1 33 CYS CA C 2.089 -2.504 6.494 1.00 . A A . 33 CYS CA 1 1 15 26793 1 1 33 CYS CB C 0.783 -1.732 6.296 1.00 . A A . 33 CYS CB 1 1 15 26794 1 1 33 CYS H H 1.543 -3.356 8.315 1.00 . A A . 33 CYS H 1 1 15 26795 1 1 33 CYS HA H 2.355 -2.944 5.532 1.00 . A A . 33 CYS HA 1 1 15 26796 1 1 33 CYS HB2 H 0.185 -1.773 7.207 1.00 . A A . 33 CYS HB2 1 1 15 26797 1 1 33 CYS HB3 H 0.998 -0.681 6.104 1.00 . A A . 33 CYS HB3 1 1 15 26798 1 1 33 CYS N N 1.925 -3.607 7.425 1.00 . A A . 33 CYS N 1 1 15 26799 1 1 33 CYS O O 4.169 -1.324 6.288 1.00 . A A . 33 CYS O 1 1 15 26800 1 1 33 CYS SG S -0.159 -2.442 4.897 1.00 . A A . 33 CYS SG 1 1 15 26801 1 1 34 HIS C C 5.265 -1.139 9.293 1.00 . A A . 34 HIS C 1 1 15 26802 1 1 34 HIS CA C 4.050 -0.309 8.873 1.00 . A A . 34 HIS CA 1 1 15 26803 1 1 34 HIS CB C 3.436 0.473 10.036 1.00 . A A . 34 HIS CB 1 1 15 26804 1 1 34 HIS CD2 C 0.932 1.143 9.702 1.00 . A A . 34 HIS CD2 1 1 15 26805 1 1 34 HIS CE1 C 1.252 3.137 8.861 1.00 . A A . 34 HIS CE1 1 1 15 26806 1 1 34 HIS CG C 2.277 1.356 9.638 1.00 . A A . 34 HIS CG 1 1 15 26807 1 1 34 HIS H H 2.279 -1.406 8.833 1.00 . A A . 34 HIS H 1 1 15 26808 1 1 34 HIS HA H 4.357 0.410 8.113 1.00 . A A . 34 HIS HA 1 1 15 26809 1 1 34 HIS HB2 H 3.099 -0.231 10.796 1.00 . A A . 34 HIS HB2 1 1 15 26810 1 1 34 HIS HB3 H 4.209 1.090 10.493 1.00 . A A . 34 HIS HB3 1 1 15 26811 1 1 34 HIS HD1 H 3.325 3.069 8.929 1.00 . A A . 34 HIS HD1 1 1 15 26812 1 1 34 HIS HD2 H 0.447 0.241 10.075 1.00 . A A . 34 HIS HD2 1 1 15 26813 1 1 34 HIS HE1 H 1.053 4.122 8.438 1.00 . A A . 34 HIS HE1 1 1 15 26814 1 1 34 HIS N N 3.060 -1.173 8.253 1.00 . A A . 34 HIS N 1 1 15 26815 1 1 34 HIS ND1 N 2.448 2.621 9.103 1.00 . A A . 34 HIS ND1 1 1 15 26816 1 1 34 HIS NE2 N 0.313 2.220 9.233 1.00 . A A . 34 HIS NE2 1 1 15 26817 1 1 34 HIS O O 5.652 -1.133 10.460 1.00 . A A . 34 HIS O 1 1 15 26818 1 1 35 HIS C C 7.968 -1.926 9.490 1.00 . A A . 35 HIS C 1 1 15 26819 1 1 35 HIS CA C 6.995 -2.667 8.571 1.00 . A A . 35 HIS CA 1 1 15 26820 1 1 35 HIS CB C 7.642 -3.111 7.258 1.00 . A A . 35 HIS CB 1 1 15 26821 1 1 35 HIS CD2 C 7.786 -1.358 5.324 1.00 . A A . 35 HIS CD2 1 1 15 26822 1 1 35 HIS CE1 C 9.679 -0.420 5.894 1.00 . A A . 35 HIS CE1 1 1 15 26823 1 1 35 HIS CG C 8.235 -1.980 6.452 1.00 . A A . 35 HIS CG 1 1 15 26824 1 1 35 HIS H H 5.512 -1.833 7.370 1.00 . A A . 35 HIS H 1 1 15 26825 1 1 35 HIS HA H 6.634 -3.560 9.082 1.00 . A A . 35 HIS HA 1 1 15 26826 1 1 35 HIS HB2 H 8.426 -3.837 7.477 1.00 . A A . 35 HIS HB2 1 1 15 26827 1 1 35 HIS HB3 H 6.895 -3.623 6.651 1.00 . A A . 35 HIS HB3 1 1 15 26828 1 1 35 HIS HD1 H 10.008 -1.600 7.569 1.00 . A A . 35 HIS HD1 1 1 15 26829 1 1 35 HIS HD2 H 6.867 -1.595 4.789 1.00 . A A . 35 HIS HD2 1 1 15 26830 1 1 35 HIS HE1 H 10.547 0.239 5.885 1.00 . A A . 35 HIS HE1 1 1 15 26831 1 1 35 HIS N N 5.832 -1.834 8.317 1.00 . A A . 35 HIS N 1 1 15 26832 1 1 35 HIS ND1 N 9.430 -1.367 6.787 1.00 . A A . 35 HIS ND1 1 1 15 26833 1 1 35 HIS NE2 N 8.659 -0.416 4.989 1.00 . A A . 35 HIS NE2 1 1 15 26834 1 1 35 HIS O O 8.052 -0.699 9.451 1.00 . A A . 35 HIS O 1 1 15 26835 1 1 36 PRO C C 10.924 -1.699 10.513 1.00 . A A . 36 PRO C 1 1 15 26836 1 1 36 PRO CA C 9.660 -2.154 11.245 1.00 . A A . 36 PRO CA 1 1 15 26837 1 1 36 PRO CB C 9.925 -3.255 12.259 1.00 . A A . 36 PRO CB 1 1 15 26838 1 1 36 PRO CD C 8.624 -4.178 10.391 1.00 . A A . 36 PRO CD 1 1 15 26839 1 1 36 PRO CG C 9.462 -4.546 11.604 1.00 . A A . 36 PRO CG 1 1 15 26840 1 1 36 PRO HA H 9.284 -1.334 11.677 1.00 . A A . 36 PRO HA 1 1 15 26841 1 1 36 PRO HB2 H 10.984 -3.304 12.515 1.00 . A A . 36 PRO HB2 1 1 15 26842 1 1 36 PRO HB3 H 9.382 -3.071 13.186 1.00 . A A . 36 PRO HB3 1 1 15 26843 1 1 36 PRO HD2 H 9.014 -4.641 9.485 1.00 . A A . 36 PRO HD2 1 1 15 26844 1 1 36 PRO HD3 H 7.594 -4.518 10.504 1.00 . A A . 36 PRO HD3 1 1 15 26845 1 1 36 PRO HG2 H 10.319 -5.151 11.307 1.00 . A A . 36 PRO HG2 1 1 15 26846 1 1 36 PRO HG3 H 8.879 -5.142 12.306 1.00 . A A . 36 PRO HG3 1 1 15 26847 1 1 36 PRO N N 8.697 -2.722 10.317 1.00 . A A . 36 PRO N 1 1 15 26848 1 1 36 PRO O O 11.574 -2.494 9.835 1.00 . A A . 36 PRO O 1 1 15 26849 1 1 37 VAL C C 13.494 0.383 11.090 1.00 . A A . 37 VAL C 1 1 15 26850 1 1 37 VAL CA C 12.409 0.150 10.036 1.00 . A A . 37 VAL CA 1 1 15 26851 1 1 37 VAL CB C 12.026 1.424 9.280 1.00 . A A . 37 VAL CB 1 1 15 26852 1 1 37 VAL CG1 C 13.267 2.251 8.937 1.00 . A A . 37 VAL CG1 1 1 15 26853 1 1 37 VAL CG2 C 11.222 1.094 8.021 1.00 . A A . 37 VAL CG2 1 1 15 26854 1 1 37 VAL H H 10.701 0.219 11.227 1.00 . A A . 37 VAL H 1 1 15 26855 1 1 37 VAL HA H 12.775 -0.576 9.310 1.00 . A A . 37 VAL HA 1 1 15 26856 1 1 37 VAL HB H 11.394 2.024 9.934 1.00 . A A . 37 VAL HB 1 1 15 26857 1 1 37 VAL HG11 H 14.163 1.680 9.180 1.00 . A A . 37 VAL HG11 1 1 15 26858 1 1 37 VAL HG12 H 13.264 2.486 7.872 1.00 . A A . 37 VAL HG12 1 1 15 26859 1 1 37 VAL HG13 H 13.258 3.176 9.513 1.00 . A A . 37 VAL HG13 1 1 15 26860 1 1 37 VAL HG21 H 10.807 0.089 8.108 1.00 . A A . 37 VAL HG21 1 1 15 26861 1 1 37 VAL HG22 H 10.410 1.813 7.910 1.00 . A A . 37 VAL HG22 1 1 15 26862 1 1 37 VAL HG23 H 11.874 1.144 7.150 1.00 . A A . 37 VAL HG23 1 1 15 26863 1 1 37 VAL N N 11.235 -0.421 10.674 1.00 . A A . 37 VAL N 1 1 15 26864 1 1 37 VAL O O 13.330 1.215 11.980 1.00 . A A . 37 VAL O 1 1 15 26865 1 1 38 ASN C C 15.411 -1.122 13.111 1.00 . A A . 38 ASN C 1 1 15 26866 1 1 38 ASN CA C 15.688 -0.254 11.882 1.00 . A A . 38 ASN CA 1 1 15 26867 1 1 38 ASN CB C 15.866 1.191 12.354 1.00 . A A . 38 ASN CB 1 1 15 26868 1 1 38 ASN CG C 17.347 1.531 12.532 1.00 . A A . 38 ASN CG 1 1 15 26869 1 1 38 ASN H H 14.702 -1.042 10.226 1.00 . A A . 38 ASN H 1 1 15 26870 1 1 38 ASN HA H 16.563 -0.588 11.325 1.00 . A A . 38 ASN HA 1 1 15 26871 1 1 38 ASN HB2 H 15.417 1.871 11.631 1.00 . A A . 38 ASN HB2 1 1 15 26872 1 1 38 ASN HB3 H 15.340 1.336 13.298 1.00 . A A . 38 ASN HB3 1 1 15 26873 1 1 38 ASN HD21 H 17.198 0.958 14.468 1.00 . A A . 38 ASN HD21 1 1 15 26874 1 1 38 ASN HD22 H 18.765 1.507 13.976 1.00 . A A . 38 ASN HD22 1 1 15 26875 1 1 38 ASN N N 14.577 -0.368 10.953 1.00 . A A . 38 ASN N 1 1 15 26876 1 1 38 ASN ND2 N 17.808 1.314 13.760 1.00 . A A . 38 ASN ND2 1 1 15 26877 1 1 38 ASN O O 16.275 -1.279 13.972 1.00 . A A . 38 ASN O 1 1 15 26878 1 1 38 ASN OD1 O 18.026 1.963 11.615 1.00 . A A . 38 ASN OD1 1 1 15 26879 1 1 39 GLY C C 12.779 -1.800 15.154 1.00 . A A . 39 GLY C 1 1 15 26880 1 1 39 GLY CA C 13.800 -2.511 14.263 1.00 . A A . 39 GLY CA 1 1 15 26881 1 1 39 GLY H H 13.505 -1.530 12.449 1.00 . A A . 39 GLY H 1 1 15 26882 1 1 39 GLY HA2 H 13.372 -3.437 13.880 1.00 . A A . 39 GLY HA2 1 1 15 26883 1 1 39 GLY HA3 H 14.675 -2.783 14.852 1.00 . A A . 39 GLY HA3 1 1 15 26884 1 1 39 GLY N N 14.202 -1.663 13.153 1.00 . A A . 39 GLY N 1 1 15 26885 1 1 39 GLY O O 12.339 -2.352 16.161 1.00 . A A . 39 GLY O 1 1 15 26886 1 1 40 LYS C C 10.155 0.270 14.723 1.00 . A A . 40 LYS C 1 1 15 26887 1 1 40 LYS CA C 11.471 0.205 15.500 1.00 . A A . 40 LYS CA 1 1 15 26888 1 1 40 LYS CB C 12.056 1.578 15.836 1.00 . A A . 40 LYS CB 1 1 15 26889 1 1 40 LYS CD C 13.188 3.481 14.629 1.00 . A A . 40 LYS CD 1 1 15 26890 1 1 40 LYS CE C 13.351 4.156 13.265 1.00 . A A . 40 LYS CE 1 1 15 26891 1 1 40 LYS CG C 12.008 2.507 14.620 1.00 . A A . 40 LYS CG 1 1 15 26892 1 1 40 LYS H H 12.795 -0.146 13.929 1.00 . A A . 40 LYS H 1 1 15 26893 1 1 40 LYS HA H 11.291 -0.308 16.444 1.00 . A A . 40 LYS HA 1 1 15 26894 1 1 40 LYS HB2 H 11.498 2.023 16.660 1.00 . A A . 40 LYS HB2 1 1 15 26895 1 1 40 LYS HB3 H 13.086 1.467 16.173 1.00 . A A . 40 LYS HB3 1 1 15 26896 1 1 40 LYS HD2 H 13.034 4.238 15.398 1.00 . A A . 40 LYS HD2 1 1 15 26897 1 1 40 LYS HD3 H 14.103 2.948 14.886 1.00 . A A . 40 LYS HD3 1 1 15 26898 1 1 40 LYS HE2 H 12.910 3.532 12.488 1.00 . A A . 40 LYS HE2 1 1 15 26899 1 1 40 LYS HE3 H 12.812 5.104 13.256 1.00 . A A . 40 LYS HE3 1 1 15 26900 1 1 40 LYS HG2 H 12.027 1.915 13.705 1.00 . A A . 40 LYS HG2 1 1 15 26901 1 1 40 LYS HG3 H 11.072 3.064 14.620 1.00 . A A . 40 LYS HG3 1 1 15 26902 1 1 40 LYS HZ1 H 15.051 4.009 12.069 1.00 . A A . 40 LYS HZ1 1 1 15 26903 1 1 40 LYS HZ2 H 15.010 5.378 12.952 1.00 . A A . 40 LYS HZ2 1 1 15 26904 1 1 40 LYS N N 12.432 -0.587 14.750 1.00 . A A . 40 LYS N 1 1 15 26905 1 1 40 LYS NZ N 14.782 4.390 12.970 1.00 . A A . 40 LYS NZ 1 1 15 26906 1 1 40 LYS O O 10.156 0.307 13.494 1.00 . A A . 40 LYS O 1 1 15 26907 1 1 41 GLU C C 7.105 1.709 15.122 1.00 . A A . 41 GLU C 1 1 15 26908 1 1 41 GLU CA C 7.742 0.341 14.871 1.00 . A A . 41 GLU CA 1 1 15 26909 1 1 41 GLU CB C 6.848 -0.785 15.397 1.00 . A A . 41 GLU CB 1 1 15 26910 1 1 41 GLU CD C 4.963 -2.197 14.495 1.00 . A A . 41 GLU CD 1 1 15 26911 1 1 41 GLU CG C 6.391 -1.699 14.258 1.00 . A A . 41 GLU CG 1 1 15 26912 1 1 41 GLU H H 9.070 0.251 16.473 1.00 . A A . 41 GLU H 1 1 15 26913 1 1 41 GLU HA H 7.904 0.199 13.803 1.00 . A A . 41 GLU HA 1 1 15 26914 1 1 41 GLU HB2 H 7.391 -1.368 16.140 1.00 . A A . 41 GLU HB2 1 1 15 26915 1 1 41 GLU HB3 H 5.979 -0.359 15.898 1.00 . A A . 41 GLU HB3 1 1 15 26916 1 1 41 GLU HG2 H 6.439 -1.159 13.312 1.00 . A A . 41 GLU HG2 1 1 15 26917 1 1 41 GLU HG3 H 7.067 -2.549 14.175 1.00 . A A . 41 GLU HG3 1 1 15 26918 1 1 41 GLU N N 9.062 0.281 15.473 1.00 . A A . 41 GLU N 1 1 15 26919 1 1 41 GLU O O 7.194 2.246 16.225 1.00 . A A . 41 GLU O 1 1 15 26920 1 1 41 GLU OE1 O 4.034 -1.405 14.226 1.00 . A A . 41 GLU OE1 1 1 15 26921 1 1 41 GLU OE2 O 4.834 -3.358 14.939 1.00 . A A . 41 GLU OE2 1 1 15 26922 1 1 42 ASP C C 4.755 3.638 13.086 1.00 . A A . 42 ASP C 1 1 15 26923 1 1 42 ASP CA C 5.825 3.530 14.174 1.00 . A A . 42 ASP CA 1 1 15 26924 1 1 42 ASP CB C 6.828 4.666 13.966 1.00 . A A . 42 ASP CB 1 1 15 26925 1 1 42 ASP CG C 6.321 6.055 14.359 1.00 . A A . 42 ASP CG 1 1 15 26926 1 1 42 ASP H H 6.408 1.790 13.187 1.00 . A A . 42 ASP H 1 1 15 26927 1 1 42 ASP HA H 5.403 3.566 15.179 1.00 . A A . 42 ASP HA 1 1 15 26928 1 1 42 ASP HB2 H 7.727 4.448 14.543 1.00 . A A . 42 ASP HB2 1 1 15 26929 1 1 42 ASP HB3 H 7.120 4.686 12.916 1.00 . A A . 42 ASP HB3 1 1 15 26930 1 1 42 ASP N N 6.476 2.234 14.080 1.00 . A A . 42 ASP N 1 1 15 26931 1 1 42 ASP O O 4.771 2.879 12.118 1.00 . A A . 42 ASP O 1 1 15 26932 1 1 42 ASP OD1 O 6.286 6.323 15.579 1.00 . A A . 42 ASP OD1 1 1 15 26933 1 1 42 ASP OD2 O 5.981 6.819 13.429 1.00 . A A . 42 ASP OD2 1 1 15 26934 1 1 43 TYR C C 2.993 6.099 11.542 1.00 . A A . 43 TYR C 1 1 15 26935 1 1 43 TYR CA C 2.777 4.804 12.328 1.00 . A A . 43 TYR CA 1 1 15 26936 1 1 43 TYR CB C 1.498 4.933 13.158 1.00 . A A . 43 TYR CB 1 1 15 26937 1 1 43 TYR CD1 C 1.824 2.510 13.774 1.00 . A A . 43 TYR CD1 1 1 15 26938 1 1 43 TYR CD2 C 0.293 3.812 15.068 1.00 . A A . 43 TYR CD2 1 1 15 26939 1 1 43 TYR CE1 C 1.539 1.361 14.594 1.00 . A A . 43 TYR CE1 1 1 15 26940 1 1 43 TYR CE2 C 0.007 2.663 15.887 1.00 . A A . 43 TYR CE2 1 1 15 26941 1 1 43 TYR CG C 1.195 3.712 14.028 1.00 . A A . 43 TYR CG 1 1 15 26942 1 1 43 TYR CZ C 0.645 1.494 15.609 1.00 . A A . 43 TYR CZ 1 1 15 26943 1 1 43 TYR H H 3.847 5.200 14.071 1.00 . A A . 43 TYR H 1 1 15 26944 1 1 43 TYR HA H 2.767 3.964 11.634 1.00 . A A . 43 TYR HA 1 1 15 26945 1 1 43 TYR HB2 H 1.579 5.812 13.798 1.00 . A A . 43 TYR HB2 1 1 15 26946 1 1 43 TYR HB3 H 0.657 5.105 12.486 1.00 . A A . 43 TYR HB3 1 1 15 26947 1 1 43 TYR HD1 H 2.537 2.431 12.953 1.00 . A A . 43 TYR HD1 1 1 15 26948 1 1 43 TYR HD2 H -0.204 4.761 15.268 1.00 . A A . 43 TYR HD2 1 1 15 26949 1 1 43 TYR HE1 H 2.029 0.406 14.404 1.00 . A A . 43 TYR HE1 1 1 15 26950 1 1 43 TYR HE2 H -0.703 2.728 16.711 1.00 . A A . 43 TYR HE2 1 1 15 26951 1 1 43 TYR HH H 0.028 0.701 17.274 1.00 . A A . 43 TYR HH 1 1 15 26952 1 1 43 TYR N N 3.852 4.587 13.281 1.00 . A A . 43 TYR N 1 1 15 26953 1 1 43 TYR O O 2.518 7.160 11.944 1.00 . A A . 43 TYR O 1 1 15 26954 1 1 43 TYR OH O 0.376 0.408 16.383 1.00 . A A . 43 TYR OH 1 1 15 26955 1 1 44 ARG C C 3.492 6.866 8.168 1.00 . A A . 44 ARG C 1 1 15 26956 1 1 44 ARG CA C 3.997 7.116 9.591 1.00 . A A . 44 ARG CA 1 1 15 26957 1 1 44 ARG CB C 5.499 7.407 9.547 1.00 . A A . 44 ARG CB 1 1 15 26958 1 1 44 ARG CD C 7.276 8.905 10.526 1.00 . A A . 44 ARG CD 1 1 15 26959 1 1 44 ARG CG C 5.805 8.793 10.121 1.00 . A A . 44 ARG CG 1 1 15 26960 1 1 44 ARG CZ C 8.471 10.057 12.397 1.00 . A A . 44 ARG CZ 1 1 15 26961 1 1 44 ARG H H 4.094 5.102 10.117 1.00 . A A . 44 ARG H 1 1 15 26962 1 1 44 ARG HA H 3.464 7.945 10.056 1.00 . A A . 44 ARG HA 1 1 15 26963 1 1 44 ARG HB2 H 6.037 6.648 10.115 1.00 . A A . 44 ARG HB2 1 1 15 26964 1 1 44 ARG HB3 H 5.855 7.349 8.519 1.00 . A A . 44 ARG HB3 1 1 15 26965 1 1 44 ARG HD2 H 7.620 7.959 10.943 1.00 . A A . 44 ARG HD2 1 1 15 26966 1 1 44 ARG HD3 H 7.889 9.109 9.649 1.00 . A A . 44 ARG HD3 1 1 15 26967 1 1 44 ARG HE H 6.755 10.710 11.550 1.00 . A A . 44 ARG HE 1 1 15 26968 1 1 44 ARG HG2 H 5.569 9.557 9.380 1.00 . A A . 44 ARG HG2 1 1 15 26969 1 1 44 ARG HG3 H 5.170 8.980 10.986 1.00 . A A . 44 ARG HG3 1 1 15 26970 1 1 44 ARG HH11 H 9.384 8.344 11.760 1.00 . A A . 44 ARG HH11 1 1 15 26971 1 1 44 ARG HH12 H 10.188 9.166 13.056 1.00 . A A . 44 ARG HH12 1 1 15 26972 1 1 44 ARG HH21 H 9.247 11.193 13.922 1.00 . A A . 44 ARG HH21 1 1 15 26973 1 1 44 ARG N N 3.712 5.969 10.436 1.00 . A A . 44 ARG N 1 1 15 26974 1 1 44 ARG NE N 7.445 9.986 11.523 1.00 . A A . 44 ARG NE 1 1 15 26975 1 1 44 ARG NH1 N 9.431 9.107 12.405 1.00 . A A . 44 ARG NH1 1 1 15 26976 1 1 44 ARG NH2 N 8.523 11.068 13.244 1.00 . A A . 44 ARG NH2 1 1 15 26977 1 1 44 ARG O O 3.000 5.781 7.863 1.00 . A A . 44 ARG O 1 1 15 26978 1 1 45 LYS C C 4.287 7.114 5.125 1.00 . A A . 45 LYS C 1 1 15 26979 1 1 45 LYS CA C 3.195 7.792 5.954 1.00 . A A . 45 LYS CA 1 1 15 26980 1 1 45 LYS CB C 2.787 9.168 5.425 1.00 . A A . 45 LYS CB 1 1 15 26981 1 1 45 LYS CD C 2.045 10.738 7.255 1.00 . A A . 45 LYS CD 1 1 15 26982 1 1 45 LYS CE C 1.045 11.889 7.373 1.00 . A A . 45 LYS CE 1 1 15 26983 1 1 45 LYS CG C 1.592 9.723 6.204 1.00 . A A . 45 LYS CG 1 1 15 26984 1 1 45 LYS H H 4.033 8.767 7.594 1.00 . A A . 45 LYS H 1 1 15 26985 1 1 45 LYS HA H 2.305 7.163 5.935 1.00 . A A . 45 LYS HA 1 1 15 26986 1 1 45 LYS HB2 H 3.628 9.857 5.504 1.00 . A A . 45 LYS HB2 1 1 15 26987 1 1 45 LYS HB3 H 2.534 9.095 4.367 1.00 . A A . 45 LYS HB3 1 1 15 26988 1 1 45 LYS HD2 H 2.152 10.243 8.220 1.00 . A A . 45 LYS HD2 1 1 15 26989 1 1 45 LYS HD3 H 3.026 11.130 6.988 1.00 . A A . 45 LYS HD3 1 1 15 26990 1 1 45 LYS HE2 H 0.037 11.525 7.174 1.00 . A A . 45 LYS HE2 1 1 15 26991 1 1 45 LYS HE3 H 1.047 12.278 8.391 1.00 . A A . 45 LYS HE3 1 1 15 26992 1 1 45 LYS HG2 H 0.892 10.196 5.514 1.00 . A A . 45 LYS HG2 1 1 15 26993 1 1 45 LYS HG3 H 1.058 8.905 6.688 1.00 . A A . 45 LYS HG3 1 1 15 26994 1 1 45 LYS HZ1 H 2.368 13.217 6.463 1.00 . A A . 45 LYS HZ1 1 1 15 26995 1 1 45 LYS HZ2 H 1.187 12.709 5.463 1.00 . A A . 45 LYS HZ2 1 1 15 26996 1 1 45 LYS N N 3.632 7.887 7.337 1.00 . A A . 45 LYS N 1 1 15 26997 1 1 45 LYS NZ N 1.385 12.971 6.422 1.00 . A A . 45 LYS NZ 1 1 15 26998 1 1 45 LYS O O 5.463 7.455 5.242 1.00 . A A . 45 LYS O 1 1 15 26999 1 1 46 CYS C C 5.534 6.444 2.583 1.00 . A A . 46 CYS C 1 1 15 27000 1 1 46 CYS CA C 4.786 5.435 3.457 1.00 . A A . 46 CYS CA 1 1 15 27001 1 1 46 CYS CB C 4.070 4.374 2.618 1.00 . A A . 46 CYS CB 1 1 15 27002 1 1 46 CYS H H 2.901 5.893 4.216 1.00 . A A . 46 CYS H 1 1 15 27003 1 1 46 CYS HA H 5.475 4.913 4.122 1.00 . A A . 46 CYS HA 1 1 15 27004 1 1 46 CYS HB2 H 3.671 4.848 1.722 1.00 . A A . 46 CYS HB2 1 1 15 27005 1 1 46 CYS HB3 H 4.802 3.636 2.290 1.00 . A A . 46 CYS HB3 1 1 15 27006 1 1 46 CYS N N 3.859 6.165 4.305 1.00 . A A . 46 CYS N 1 1 15 27007 1 1 46 CYS O O 6.756 6.376 2.457 1.00 . A A . 46 CYS O 1 1 15 27008 1 1 46 CYS SG S 2.708 3.507 3.478 1.00 . A A . 46 CYS SG 1 1 15 27009 1 1 47 GLY C C 5.933 9.523 1.972 1.00 . A A . 47 GLY C 1 1 15 27010 1 1 47 GLY CA C 5.345 8.378 1.144 1.00 . A A . 47 GLY CA 1 1 15 27011 1 1 47 GLY H H 3.777 7.406 2.111 1.00 . A A . 47 GLY H 1 1 15 27012 1 1 47 GLY HA2 H 6.123 7.939 0.521 1.00 . A A . 47 GLY HA2 1 1 15 27013 1 1 47 GLY HA3 H 4.580 8.767 0.472 1.00 . A A . 47 GLY HA3 1 1 15 27014 1 1 47 GLY N N 4.770 7.357 2.003 1.00 . A A . 47 GLY N 1 1 15 27015 1 1 47 GLY O O 5.639 10.691 1.721 1.00 . A A . 47 GLY O 1 1 15 27016 1 1 48 THR C C 8.795 10.450 3.312 1.00 . A A . 48 THR C 1 1 15 27017 1 1 48 THR CA C 7.384 10.129 3.810 1.00 . A A . 48 THR CA 1 1 15 27018 1 1 48 THR CB C 7.353 9.585 5.240 1.00 . A A . 48 THR CB 1 1 15 27019 1 1 48 THR CG2 C 8.455 10.183 6.117 1.00 . A A . 48 THR CG2 1 1 15 27020 1 1 48 THR H H 6.987 8.196 3.141 1.00 . A A . 48 THR H 1 1 15 27021 1 1 48 THR HA H 6.809 11.053 3.759 1.00 . A A . 48 THR HA 1 1 15 27022 1 1 48 THR HB H 7.400 8.496 5.243 1.00 . A A . 48 THR HB 1 1 15 27023 1 1 48 THR HG1 H 6.134 9.979 6.777 1.00 . A A . 48 THR HG1 1 1 15 27024 1 1 48 THR HG21 H 9.413 10.100 5.604 1.00 . A A . 48 THR HG21 1 1 15 27025 1 1 48 THR HG22 H 8.236 11.233 6.310 1.00 . A A . 48 THR HG22 1 1 15 27026 1 1 48 THR HG23 H 8.501 9.642 7.062 1.00 . A A . 48 THR HG23 1 1 15 27027 1 1 48 THR N N 6.753 9.148 2.943 1.00 . A A . 48 THR N 1 1 15 27028 1 1 48 THR O O 9.521 9.559 2.874 1.00 . A A . 48 THR O 1 1 15 27029 1 1 48 THR OG1 O 6.149 10.115 5.786 1.00 . A A . 48 THR OG1 1 1 15 27030 1 1 49 ALA C C 11.530 11.367 3.681 1.00 . A A . 49 ALA C 1 1 15 27031 1 1 49 ALA CA C 10.451 12.177 2.960 1.00 . A A . 49 ALA CA 1 1 15 27032 1 1 49 ALA CB C 10.584 13.681 3.212 1.00 . A A . 49 ALA CB 1 1 15 27033 1 1 49 ALA H H 8.544 12.445 3.755 1.00 . A A . 49 ALA H 1 1 15 27034 1 1 49 ALA HA H 10.525 11.993 1.888 1.00 . A A . 49 ALA HA 1 1 15 27035 1 1 49 ALA HB1 H 9.716 14.034 3.768 1.00 . A A . 49 ALA HB1 1 1 15 27036 1 1 49 ALA HB2 H 11.489 13.873 3.789 1.00 . A A . 49 ALA HB2 1 1 15 27037 1 1 49 ALA HB3 H 10.643 14.205 2.258 1.00 . A A . 49 ALA HB3 1 1 15 27038 1 1 49 ALA N N 9.141 11.727 3.397 1.00 . A A . 49 ALA N 1 1 15 27039 1 1 49 ALA O O 11.584 11.354 4.910 1.00 . A A . 49 ALA O 1 1 15 27040 1 1 50 GLY C C 13.105 8.411 3.336 1.00 . A A . 50 GLY C 1 1 15 27041 1 1 50 GLY CA C 13.438 9.901 3.433 1.00 . A A . 50 GLY CA 1 1 15 27042 1 1 50 GLY H H 12.313 10.728 1.888 1.00 . A A . 50 GLY H 1 1 15 27043 1 1 50 GLY HA2 H 14.363 10.106 2.895 1.00 . A A . 50 GLY HA2 1 1 15 27044 1 1 50 GLY HA3 H 13.608 10.172 4.475 1.00 . A A . 50 GLY HA3 1 1 15 27045 1 1 50 GLY N N 12.363 10.712 2.886 1.00 . A A . 50 GLY N 1 1 15 27046 1 1 50 GLY O O 14.003 7.571 3.301 1.00 . A A . 50 GLY O 1 1 15 27047 1 1 51 CYS C C 11.101 6.428 1.729 1.00 . A A . 51 CYS C 1 1 15 27048 1 1 51 CYS CA C 11.348 6.754 3.203 1.00 . A A . 51 CYS CA 1 1 15 27049 1 1 51 CYS CB C 10.100 6.519 4.056 1.00 . A A . 51 CYS CB 1 1 15 27050 1 1 51 CYS H H 11.087 8.817 3.324 1.00 . A A . 51 CYS H 1 1 15 27051 1 1 51 CYS HA H 12.142 6.128 3.610 1.00 . A A . 51 CYS HA 1 1 15 27052 1 1 51 CYS HB2 H 9.295 7.176 3.727 1.00 . A A . 51 CYS HB2 1 1 15 27053 1 1 51 CYS HB3 H 9.749 5.496 3.928 1.00 . A A . 51 CYS HB3 1 1 15 27054 1 1 51 CYS N N 11.811 8.128 3.295 1.00 . A A . 51 CYS N 1 1 15 27055 1 1 51 CYS O O 12.044 6.317 0.947 1.00 . A A . 51 CYS O 1 1 15 27056 1 1 51 CYS SG S 10.479 6.832 5.819 1.00 . A A . 51 CYS SG 1 1 15 27057 1 1 52 HIS C C 9.138 7.267 -0.729 1.00 . A A . 52 HIS C 1 1 15 27058 1 1 52 HIS CA C 9.444 5.972 0.026 1.00 . A A . 52 HIS CA 1 1 15 27059 1 1 52 HIS CB C 8.279 4.982 0.001 1.00 . A A . 52 HIS CB 1 1 15 27060 1 1 52 HIS CD2 C 8.196 3.077 1.789 1.00 . A A . 52 HIS CD2 1 1 15 27061 1 1 52 HIS CE1 C 9.512 1.648 0.783 1.00 . A A . 52 HIS CE1 1 1 15 27062 1 1 52 HIS CG C 8.600 3.640 0.614 1.00 . A A . 52 HIS CG 1 1 15 27063 1 1 52 HIS H H 9.066 6.376 2.035 1.00 . A A . 52 HIS H 1 1 15 27064 1 1 52 HIS HA H 10.304 5.486 -0.436 1.00 . A A . 52 HIS HA 1 1 15 27065 1 1 52 HIS HB2 H 7.432 5.419 0.531 1.00 . A A . 52 HIS HB2 1 1 15 27066 1 1 52 HIS HB3 H 7.965 4.832 -1.032 1.00 . A A . 52 HIS HB3 1 1 15 27067 1 1 52 HIS HD1 H 9.886 2.833 -0.879 1.00 . A A . 52 HIS HD1 1 1 15 27068 1 1 52 HIS HD2 H 7.534 3.538 2.522 1.00 . A A . 52 HIS HD2 1 1 15 27069 1 1 52 HIS HE1 H 10.090 0.747 0.577 1.00 . A A . 52 HIS HE1 1 1 15 27070 1 1 52 HIS N N 9.827 6.284 1.393 1.00 . A A . 52 HIS N 1 1 15 27071 1 1 52 HIS ND1 N 9.428 2.715 0.002 1.00 . A A . 52 HIS ND1 1 1 15 27072 1 1 52 HIS NE2 N 8.747 1.874 1.890 1.00 . A A . 52 HIS NE2 1 1 15 27073 1 1 52 HIS O O 7.985 7.543 -1.054 1.00 . A A . 52 HIS O 1 1 15 27074 1 1 53 ASP C C 10.624 9.140 -3.106 1.00 . A A . 53 ASP C 1 1 15 27075 1 1 53 ASP CA C 10.051 9.288 -1.695 1.00 . A A . 53 ASP CA 1 1 15 27076 1 1 53 ASP CB C 10.818 10.408 -0.989 1.00 . A A . 53 ASP CB 1 1 15 27077 1 1 53 ASP CG C 12.284 10.548 -1.402 1.00 . A A . 53 ASP CG 1 1 15 27078 1 1 53 ASP H H 11.127 7.797 -0.717 1.00 . A A . 53 ASP H 1 1 15 27079 1 1 53 ASP HA H 8.981 9.496 -1.699 1.00 . A A . 53 ASP HA 1 1 15 27080 1 1 53 ASP HB2 H 10.309 11.353 -1.181 1.00 . A A . 53 ASP HB2 1 1 15 27081 1 1 53 ASP HB3 H 10.774 10.235 0.087 1.00 . A A . 53 ASP HB3 1 1 15 27082 1 1 53 ASP N N 10.192 8.028 -0.985 1.00 . A A . 53 ASP N 1 1 15 27083 1 1 53 ASP O O 10.954 10.133 -3.753 1.00 . A A . 53 ASP O 1 1 15 27084 1 1 53 ASP OD1 O 12.993 9.521 -1.338 1.00 . A A . 53 ASP OD1 1 1 15 27085 1 1 53 ASP OD2 O 12.663 11.680 -1.774 1.00 . A A . 53 ASP OD2 1 1 15 27086 1 1 54 SER C C 10.164 7.815 -5.920 1.00 . A A . 54 SER C 1 1 15 27087 1 1 54 SER CA C 11.251 7.602 -4.865 1.00 . A A . 54 SER CA 1 1 15 27088 1 1 54 SER CB C 11.791 6.173 -4.940 1.00 . A A . 54 SER CB 1 1 15 27089 1 1 54 SER H H 10.452 7.091 -3.010 1.00 . A A . 54 SER H 1 1 15 27090 1 1 54 SER HA H 12.069 8.308 -5.010 1.00 . A A . 54 SER HA 1 1 15 27091 1 1 54 SER HB2 H 12.279 5.920 -3.999 1.00 . A A . 54 SER HB2 1 1 15 27092 1 1 54 SER HB3 H 10.962 5.478 -5.066 1.00 . A A . 54 SER HB3 1 1 15 27093 1 1 54 SER HG H 12.737 6.833 -6.576 1.00 . A A . 54 SER HG 1 1 15 27094 1 1 54 SER N N 10.723 7.893 -3.542 1.00 . A A . 54 SER N 1 1 15 27095 1 1 54 SER O O 9.281 6.975 -6.085 1.00 . A A . 54 SER O 1 1 15 27096 1 1 54 SER OG O 12.715 6.008 -6.012 1.00 . A A . 54 SER OG 1 1 15 27097 1 1 55 MET C C 9.736 8.720 -8.998 1.00 . A A . 55 MET C 1 1 15 27098 1 1 55 MET CA C 9.300 9.278 -7.642 1.00 . A A . 55 MET CA 1 1 15 27099 1 1 55 MET CB C 9.159 10.798 -7.737 1.00 . A A . 55 MET CB 1 1 15 27100 1 1 55 MET CE C 7.306 10.099 -4.959 1.00 . A A . 55 MET CE 1 1 15 27101 1 1 55 MET CG C 7.731 11.238 -7.408 1.00 . A A . 55 MET CG 1 1 15 27102 1 1 55 MET H H 10.986 9.622 -6.467 1.00 . A A . 55 MET H 1 1 15 27103 1 1 55 MET HA H 8.365 8.811 -7.332 1.00 . A A . 55 MET HA 1 1 15 27104 1 1 55 MET HB2 H 9.858 11.275 -7.049 1.00 . A A . 55 MET HB2 1 1 15 27105 1 1 55 MET HB3 H 9.424 11.130 -8.741 1.00 . A A . 55 MET HB3 1 1 15 27106 1 1 55 MET HE1 H 7.061 9.383 -5.744 1.00 . A A . 55 MET HE1 1 1 15 27107 1 1 55 MET HE2 H 8.195 9.764 -4.426 1.00 . A A . 55 MET HE2 1 1 15 27108 1 1 55 MET HE3 H 6.471 10.172 -4.261 1.00 . A A . 55 MET HE3 1 1 15 27109 1 1 55 MET HG2 H 7.447 12.081 -8.038 1.00 . A A . 55 MET HG2 1 1 15 27110 1 1 55 MET HG3 H 7.034 10.429 -7.624 1.00 . A A . 55 MET HG3 1 1 15 27111 1 1 55 MET N N 10.264 8.944 -6.607 1.00 . A A . 55 MET N 1 1 15 27112 1 1 55 MET O O 9.497 9.339 -10.034 1.00 . A A . 55 MET O 1 1 15 27113 1 1 55 MET SD S 7.615 11.698 -5.687 1.00 . A A . 55 MET SD 1 1 15 27114 1 1 56 ASP C C 10.110 5.575 -10.337 1.00 . A A . 56 ASP C 1 1 15 27115 1 1 56 ASP CA C 10.840 6.908 -10.160 1.00 . A A . 56 ASP CA 1 1 15 27116 1 1 56 ASP CB C 12.340 6.619 -10.082 1.00 . A A . 56 ASP CB 1 1 15 27117 1 1 56 ASP CG C 13.057 6.554 -11.431 1.00 . A A . 56 ASP CG 1 1 15 27118 1 1 56 ASP H H 10.558 7.059 -8.101 1.00 . A A . 56 ASP H 1 1 15 27119 1 1 56 ASP HA H 10.624 7.612 -10.964 1.00 . A A . 56 ASP HA 1 1 15 27120 1 1 56 ASP HB2 H 12.812 7.390 -9.473 1.00 . A A . 56 ASP HB2 1 1 15 27121 1 1 56 ASP HB3 H 12.485 5.670 -9.564 1.00 . A A . 56 ASP HB3 1 1 15 27122 1 1 56 ASP N N 10.368 7.556 -8.948 1.00 . A A . 56 ASP N 1 1 15 27123 1 1 56 ASP O O 10.682 4.513 -10.096 1.00 . A A . 56 ASP O 1 1 15 27124 1 1 56 ASP OD1 O 12.423 6.061 -12.388 1.00 . A A . 56 ASP OD1 1 1 15 27125 1 1 56 ASP OD2 O 14.224 6.999 -11.476 1.00 . A A . 56 ASP OD2 1 1 15 27126 1 1 57 LYS C C 8.898 3.398 -11.616 1.00 . A A . 57 LYS C 1 1 15 27127 1 1 57 LYS CA C 8.043 4.489 -10.969 1.00 . A A . 57 LYS CA 1 1 15 27128 1 1 57 LYS CB C 6.786 4.839 -11.768 1.00 . A A . 57 LYS CB 1 1 15 27129 1 1 57 LYS CD C 6.776 3.367 -13.815 1.00 . A A . 57 LYS CD 1 1 15 27130 1 1 57 LYS CE C 5.757 2.700 -14.741 1.00 . A A . 57 LYS CE 1 1 15 27131 1 1 57 LYS CG C 6.187 3.592 -12.422 1.00 . A A . 57 LYS CG 1 1 15 27132 1 1 57 LYS H H 8.399 6.542 -10.952 1.00 . A A . 57 LYS H 1 1 15 27133 1 1 57 LYS HA H 7.716 4.138 -9.991 1.00 . A A . 57 LYS HA 1 1 15 27134 1 1 57 LYS HB2 H 6.048 5.299 -11.109 1.00 . A A . 57 LYS HB2 1 1 15 27135 1 1 57 LYS HB3 H 7.030 5.575 -12.534 1.00 . A A . 57 LYS HB3 1 1 15 27136 1 1 57 LYS HD2 H 7.089 4.321 -14.240 1.00 . A A . 57 LYS HD2 1 1 15 27137 1 1 57 LYS HD3 H 7.668 2.744 -13.741 1.00 . A A . 57 LYS HD3 1 1 15 27138 1 1 57 LYS HE2 H 6.271 2.230 -15.579 1.00 . A A . 57 LYS HE2 1 1 15 27139 1 1 57 LYS HE3 H 5.233 1.909 -14.204 1.00 . A A . 57 LYS HE3 1 1 15 27140 1 1 57 LYS HG2 H 6.380 2.721 -11.796 1.00 . A A . 57 LYS HG2 1 1 15 27141 1 1 57 LYS HG3 H 5.104 3.699 -12.494 1.00 . A A . 57 LYS HG3 1 1 15 27142 1 1 57 LYS HZ1 H 5.239 4.454 -15.739 1.00 . A A . 57 LYS HZ1 1 1 15 27143 1 1 57 LYS HZ2 H 4.117 3.283 -15.887 1.00 . A A . 57 LYS HZ2 1 1 15 27144 1 1 57 LYS N N 8.857 5.674 -10.757 1.00 . A A . 57 LYS N 1 1 15 27145 1 1 57 LYS NZ N 4.784 3.695 -15.244 1.00 . A A . 57 LYS NZ 1 1 15 27146 1 1 57 LYS O O 8.989 2.286 -11.097 1.00 . A A . 57 LYS O 1 1 15 27147 1 1 58 LYS C C 11.666 2.638 -12.709 1.00 . A A . 58 LYS C 1 1 15 27148 1 1 58 LYS CA C 10.347 2.816 -13.464 1.00 . A A . 58 LYS CA 1 1 15 27149 1 1 58 LYS CB C 10.525 3.267 -14.915 1.00 . A A . 58 LYS CB 1 1 15 27150 1 1 58 LYS CD C 9.677 3.012 -17.276 1.00 . A A . 58 LYS CD 1 1 15 27151 1 1 58 LYS CE C 8.694 4.175 -17.421 1.00 . A A . 58 LYS CE 1 1 15 27152 1 1 58 LYS CG C 9.646 2.442 -15.857 1.00 . A A . 58 LYS CG 1 1 15 27153 1 1 58 LYS H H 9.424 4.659 -13.156 1.00 . A A . 58 LYS H 1 1 15 27154 1 1 58 LYS HA H 9.828 1.858 -13.485 1.00 . A A . 58 LYS HA 1 1 15 27155 1 1 58 LYS HB2 H 10.271 4.323 -15.006 1.00 . A A . 58 LYS HB2 1 1 15 27156 1 1 58 LYS HB3 H 11.571 3.165 -15.205 1.00 . A A . 58 LYS HB3 1 1 15 27157 1 1 58 LYS HD2 H 10.685 3.351 -17.514 1.00 . A A . 58 LYS HD2 1 1 15 27158 1 1 58 LYS HD3 H 9.427 2.228 -17.992 1.00 . A A . 58 LYS HD3 1 1 15 27159 1 1 58 LYS HE2 H 8.519 4.381 -18.477 1.00 . A A . 58 LYS HE2 1 1 15 27160 1 1 58 LYS HE3 H 7.733 3.904 -16.986 1.00 . A A . 58 LYS HE3 1 1 15 27161 1 1 58 LYS HG2 H 9.990 1.407 -15.868 1.00 . A A . 58 LYS HG2 1 1 15 27162 1 1 58 LYS HG3 H 8.620 2.432 -15.487 1.00 . A A . 58 LYS HG3 1 1 15 27163 1 1 58 LYS HZ1 H 10.213 5.516 -16.933 1.00 . A A . 58 LYS HZ1 1 1 15 27164 1 1 58 LYS HZ2 H 8.755 6.229 -17.071 1.00 . A A . 58 LYS HZ2 1 1 15 27165 1 1 58 LYS N N 9.503 3.752 -12.740 1.00 . A A . 58 LYS N 1 1 15 27166 1 1 58 LYS NZ N 9.223 5.386 -16.755 1.00 . A A . 58 LYS NZ 1 1 15 27167 1 1 58 LYS O O 12.729 2.994 -13.216 1.00 . A A . 58 LYS O 1 1 15 27168 1 1 59 ASP C C 12.314 1.076 -9.430 1.00 . A A . 59 ASP C 1 1 15 27169 1 1 59 ASP CA C 12.725 1.856 -10.680 1.00 . A A . 59 ASP CA 1 1 15 27170 1 1 59 ASP CB C 13.349 3.178 -10.229 1.00 . A A . 59 ASP CB 1 1 15 27171 1 1 59 ASP CG C 14.755 3.061 -9.636 1.00 . A A . 59 ASP CG 1 1 15 27172 1 1 59 ASP H H 10.687 1.798 -11.105 1.00 . A A . 59 ASP H 1 1 15 27173 1 1 59 ASP HA H 13.418 1.298 -11.311 1.00 . A A . 59 ASP HA 1 1 15 27174 1 1 59 ASP HB2 H 13.386 3.855 -11.082 1.00 . A A . 59 ASP HB2 1 1 15 27175 1 1 59 ASP HB3 H 12.695 3.636 -9.487 1.00 . A A . 59 ASP HB3 1 1 15 27176 1 1 59 ASP N N 11.555 2.086 -11.510 1.00 . A A . 59 ASP N 1 1 15 27177 1 1 59 ASP O O 11.906 1.667 -8.431 1.00 . A A . 59 ASP O 1 1 15 27178 1 1 59 ASP OD1 O 15.606 2.445 -10.313 1.00 . A A . 59 ASP OD1 1 1 15 27179 1 1 59 ASP OD2 O 14.946 3.590 -8.520 1.00 . A A . 59 ASP OD2 1 1 15 27180 1 1 60 LYS C C 13.317 -1.348 -7.547 1.00 . A A . 60 LYS C 1 1 15 27181 1 1 60 LYS CA C 12.080 -1.107 -8.415 1.00 . A A . 60 LYS CA 1 1 15 27182 1 1 60 LYS CB C 11.427 -2.393 -8.926 1.00 . A A . 60 LYS CB 1 1 15 27183 1 1 60 LYS CD C 12.503 -3.051 -11.110 1.00 . A A . 60 LYS CD 1 1 15 27184 1 1 60 LYS CE C 12.201 -4.335 -11.886 1.00 . A A . 60 LYS CE 1 1 15 27185 1 1 60 LYS CG C 12.458 -3.300 -9.601 1.00 . A A . 60 LYS CG 1 1 15 27186 1 1 60 LYS H H 12.767 -0.713 -10.341 1.00 . A A . 60 LYS H 1 1 15 27187 1 1 60 LYS HA H 11.335 -0.583 -7.817 1.00 . A A . 60 LYS HA 1 1 15 27188 1 1 60 LYS HB2 H 10.959 -2.923 -8.096 1.00 . A A . 60 LYS HB2 1 1 15 27189 1 1 60 LYS HB3 H 10.636 -2.147 -9.633 1.00 . A A . 60 LYS HB3 1 1 15 27190 1 1 60 LYS HD2 H 11.779 -2.282 -11.377 1.00 . A A . 60 LYS HD2 1 1 15 27191 1 1 60 LYS HD3 H 13.487 -2.675 -11.391 1.00 . A A . 60 LYS HD3 1 1 15 27192 1 1 60 LYS HE2 H 13.039 -5.027 -11.796 1.00 . A A . 60 LYS HE2 1 1 15 27193 1 1 60 LYS HE3 H 11.331 -4.831 -11.456 1.00 . A A . 60 LYS HE3 1 1 15 27194 1 1 60 LYS HG2 H 13.443 -3.121 -9.169 1.00 . A A . 60 LYS HG2 1 1 15 27195 1 1 60 LYS HG3 H 12.211 -4.344 -9.408 1.00 . A A . 60 LYS HG3 1 1 15 27196 1 1 60 LYS HZ1 H 11.253 -4.645 -13.716 1.00 . A A . 60 LYS HZ1 1 1 15 27197 1 1 60 LYS HZ2 H 11.621 -3.082 -13.447 1.00 . A A . 60 LYS HZ2 1 1 15 27198 1 1 60 LYS N N 12.435 -0.240 -9.526 1.00 . A A . 60 LYS N 1 1 15 27199 1 1 60 LYS NZ N 11.952 -4.031 -13.313 1.00 . A A . 60 LYS NZ 1 1 15 27200 1 1 60 LYS O O 14.424 -1.490 -8.063 1.00 . A A . 60 LYS O 1 1 15 27201 1 1 61 SER C C 13.625 -1.588 -3.867 1.00 . A A . 61 SER C 1 1 15 27202 1 1 61 SER CA C 14.168 -1.607 -5.297 1.00 . A A . 61 SER CA 1 1 15 27203 1 1 61 SER CB C 15.267 -0.555 -5.462 1.00 . A A . 61 SER CB 1 1 15 27204 1 1 61 SER H H 12.182 -1.270 -5.830 1.00 . A A . 61 SER H 1 1 15 27205 1 1 61 SER HA H 14.568 -2.591 -5.542 1.00 . A A . 61 SER HA 1 1 15 27206 1 1 61 SER HB2 H 16.022 -0.697 -4.690 1.00 . A A . 61 SER HB2 1 1 15 27207 1 1 61 SER HB3 H 15.762 -0.697 -6.423 1.00 . A A . 61 SER HB3 1 1 15 27208 1 1 61 SER HG H 15.192 1.266 -4.636 1.00 . A A . 61 SER HG 1 1 15 27209 1 1 61 SER N N 13.086 -1.386 -6.242 1.00 . A A . 61 SER N 1 1 15 27210 1 1 61 SER O O 13.721 -2.582 -3.149 1.00 . A A . 61 SER O 1 1 15 27211 1 1 61 SER OG O 14.752 0.771 -5.385 1.00 . A A . 61 SER OG 1 1 15 27212 1 1 62 ALA C C 11.915 1.120 -2.031 1.00 . A A . 62 ALA C 1 1 15 27213 1 1 62 ALA CA C 12.509 -0.283 -2.164 1.00 . A A . 62 ALA CA 1 1 15 27214 1 1 62 ALA CB C 13.592 -0.559 -1.119 1.00 . A A . 62 ALA CB 1 1 15 27215 1 1 62 ALA H H 12.992 0.359 -4.085 1.00 . A A . 62 ALA H 1 1 15 27216 1 1 62 ALA HA H 11.712 -1.018 -2.046 1.00 . A A . 62 ALA HA 1 1 15 27217 1 1 62 ALA HB1 H 14.422 -1.088 -1.588 1.00 . A A . 62 ALA HB1 1 1 15 27218 1 1 62 ALA HB2 H 13.949 0.385 -0.707 1.00 . A A . 62 ALA HB2 1 1 15 27219 1 1 62 ALA HB3 H 13.177 -1.171 -0.318 1.00 . A A . 62 ALA HB3 1 1 15 27220 1 1 62 ALA N N 13.066 -0.445 -3.495 1.00 . A A . 62 ALA N 1 1 15 27221 1 1 62 ALA O O 10.771 1.277 -1.608 1.00 . A A . 62 ALA O 1 1 15 27222 1 1 63 LYS C C 11.129 3.712 -3.301 1.00 . A A . 63 LYS C 1 1 15 27223 1 1 63 LYS CA C 12.289 3.491 -2.328 1.00 . A A . 63 LYS CA 1 1 15 27224 1 1 63 LYS CB C 13.472 4.433 -2.559 1.00 . A A . 63 LYS CB 1 1 15 27225 1 1 63 LYS CD C 15.531 5.189 -1.314 1.00 . A A . 63 LYS CD 1 1 15 27226 1 1 63 LYS CE C 16.861 5.237 -2.068 1.00 . A A . 63 LYS CE 1 1 15 27227 1 1 63 LYS CG C 14.694 3.986 -1.754 1.00 . A A . 63 LYS CG 1 1 15 27228 1 1 63 LYS H H 13.649 1.970 -2.744 1.00 . A A . 63 LYS H 1 1 15 27229 1 1 63 LYS HA H 11.929 3.669 -1.315 1.00 . A A . 63 LYS HA 1 1 15 27230 1 1 63 LYS HB2 H 13.721 4.459 -3.620 1.00 . A A . 63 LYS HB2 1 1 15 27231 1 1 63 LYS HB3 H 13.195 5.448 -2.273 1.00 . A A . 63 LYS HB3 1 1 15 27232 1 1 63 LYS HD2 H 14.974 6.109 -1.492 1.00 . A A . 63 LYS HD2 1 1 15 27233 1 1 63 LYS HD3 H 15.719 5.133 -0.242 1.00 . A A . 63 LYS HD3 1 1 15 27234 1 1 63 LYS HE2 H 17.372 4.279 -1.977 1.00 . A A . 63 LYS HE2 1 1 15 27235 1 1 63 LYS HE3 H 16.678 5.401 -3.130 1.00 . A A . 63 LYS HE3 1 1 15 27236 1 1 63 LYS HG2 H 14.371 3.424 -0.878 1.00 . A A . 63 LYS HG2 1 1 15 27237 1 1 63 LYS HG3 H 15.305 3.314 -2.356 1.00 . A A . 63 LYS HG3 1 1 15 27238 1 1 63 LYS HZ1 H 18.649 5.982 -1.298 1.00 . A A . 63 LYS HZ1 1 1 15 27239 1 1 63 LYS HZ2 H 17.842 7.071 -2.202 1.00 . A A . 63 LYS HZ2 1 1 15 27240 1 1 63 LYS N N 12.720 2.106 -2.401 1.00 . A A . 63 LYS N 1 1 15 27241 1 1 63 LYS NZ N 17.721 6.317 -1.535 1.00 . A A . 63 LYS NZ 1 1 15 27242 1 1 63 LYS O O 10.342 4.643 -3.134 1.00 . A A . 63 LYS O 1 1 15 27243 1 1 64 GLY C C 8.625 2.866 -4.645 1.00 . A A . 64 GLY C 1 1 15 27244 1 1 64 GLY CA C 10.009 2.928 -5.296 1.00 . A A . 64 GLY CA 1 1 15 27245 1 1 64 GLY H H 11.703 2.085 -4.425 1.00 . A A . 64 GLY H 1 1 15 27246 1 1 64 GLY HA2 H 10.110 3.858 -5.855 1.00 . A A . 64 GLY HA2 1 1 15 27247 1 1 64 GLY HA3 H 10.114 2.113 -6.012 1.00 . A A . 64 GLY HA3 1 1 15 27248 1 1 64 GLY N N 11.059 2.840 -4.296 1.00 . A A . 64 GLY N 1 1 15 27249 1 1 64 GLY O O 8.109 1.783 -4.378 1.00 . A A . 64 GLY O 1 1 15 27250 1 1 65 TYR C C 5.718 3.330 -4.582 1.00 . A A . 65 TYR C 1 1 15 27251 1 1 65 TYR CA C 6.752 4.137 -3.794 1.00 . A A . 65 TYR CA 1 1 15 27252 1 1 65 TYR CB C 6.369 5.618 -3.841 1.00 . A A . 65 TYR CB 1 1 15 27253 1 1 65 TYR CD1 C 4.703 5.745 -1.952 1.00 . A A . 65 TYR CD1 1 1 15 27254 1 1 65 TYR CD2 C 3.978 6.358 -4.146 1.00 . A A . 65 TYR CD2 1 1 15 27255 1 1 65 TYR CE1 C 3.387 6.026 -1.439 1.00 . A A . 65 TYR CE1 1 1 15 27256 1 1 65 TYR CE2 C 2.663 6.639 -3.633 1.00 . A A . 65 TYR CE2 1 1 15 27257 1 1 65 TYR CG C 4.971 5.917 -3.295 1.00 . A A . 65 TYR CG 1 1 15 27258 1 1 65 TYR CZ C 2.432 6.459 -2.305 1.00 . A A . 65 TYR CZ 1 1 15 27259 1 1 65 TYR H H 8.492 4.920 -4.630 1.00 . A A . 65 TYR H 1 1 15 27260 1 1 65 TYR HA H 6.824 3.734 -2.784 1.00 . A A . 65 TYR HA 1 1 15 27261 1 1 65 TYR HB2 H 7.101 6.190 -3.270 1.00 . A A . 65 TYR HB2 1 1 15 27262 1 1 65 TYR HB3 H 6.428 5.965 -4.872 1.00 . A A . 65 TYR HB3 1 1 15 27263 1 1 65 TYR HD1 H 5.487 5.397 -1.280 1.00 . A A . 65 TYR HD1 1 1 15 27264 1 1 65 TYR HD2 H 4.190 6.493 -5.207 1.00 . A A . 65 TYR HD2 1 1 15 27265 1 1 65 TYR HE1 H 3.162 5.895 -0.381 1.00 . A A . 65 TYR HE1 1 1 15 27266 1 1 65 TYR HE2 H 1.870 6.988 -4.294 1.00 . A A . 65 TYR HE2 1 1 15 27267 1 1 65 TYR HH H 0.527 6.741 -2.569 1.00 . A A . 65 TYR HH 1 1 15 27268 1 1 65 TYR N N 8.065 4.043 -4.409 1.00 . A A . 65 TYR N 1 1 15 27269 1 1 65 TYR O O 4.900 2.623 -3.996 1.00 . A A . 65 TYR O 1 1 15 27270 1 1 65 TYR OH O 1.189 6.725 -1.820 1.00 . A A . 65 TYR OH 1 1 15 27271 1 1 66 TYR C C 5.267 1.285 -6.911 1.00 . A A . 66 TYR C 1 1 15 27272 1 1 66 TYR CA C 4.870 2.756 -6.773 1.00 . A A . 66 TYR CA 1 1 15 27273 1 1 66 TYR CB C 4.982 3.433 -8.140 1.00 . A A . 66 TYR CB 1 1 15 27274 1 1 66 TYR CD1 C 5.327 1.608 -9.844 1.00 . A A . 66 TYR CD1 1 1 15 27275 1 1 66 TYR CD2 C 3.227 2.750 -9.816 1.00 . A A . 66 TYR CD2 1 1 15 27276 1 1 66 TYR CE1 C 4.869 0.794 -10.941 1.00 . A A . 66 TYR CE1 1 1 15 27277 1 1 66 TYR CE2 C 2.770 1.936 -10.912 1.00 . A A . 66 TYR CE2 1 1 15 27278 1 1 66 TYR CG C 4.496 2.569 -9.305 1.00 . A A . 66 TYR CG 1 1 15 27279 1 1 66 TYR CZ C 3.613 0.998 -11.420 1.00 . A A . 66 TYR CZ 1 1 15 27280 1 1 66 TYR H H 6.458 4.041 -6.366 1.00 . A A . 66 TYR H 1 1 15 27281 1 1 66 TYR HA H 3.874 2.816 -6.333 1.00 . A A . 66 TYR HA 1 1 15 27282 1 1 66 TYR HB2 H 4.407 4.359 -8.124 1.00 . A A . 66 TYR HB2 1 1 15 27283 1 1 66 TYR HB3 H 6.023 3.707 -8.314 1.00 . A A . 66 TYR HB3 1 1 15 27284 1 1 66 TYR HD1 H 6.329 1.465 -9.441 1.00 . A A . 66 TYR HD1 1 1 15 27285 1 1 66 TYR HD2 H 2.571 3.509 -9.390 1.00 . A A . 66 TYR HD2 1 1 15 27286 1 1 66 TYR HE1 H 5.515 0.031 -11.376 1.00 . A A . 66 TYR HE1 1 1 15 27287 1 1 66 TYR HE2 H 1.770 2.068 -11.325 1.00 . A A . 66 TYR HE2 1 1 15 27288 1 1 66 TYR HH H 3.266 0.734 -13.315 1.00 . A A . 66 TYR HH 1 1 15 27289 1 1 66 TYR N N 5.789 3.464 -5.898 1.00 . A A . 66 TYR N 1 1 15 27290 1 1 66 TYR O O 4.629 0.532 -7.646 1.00 . A A . 66 TYR O 1 1 15 27291 1 1 66 TYR OH O 3.181 0.229 -12.456 1.00 . A A . 66 TYR OH 1 1 15 27292 1 1 67 HIS C C 6.356 -1.188 -4.968 1.00 . A A . 67 HIS C 1 1 15 27293 1 1 67 HIS CA C 6.810 -0.448 -6.228 1.00 . A A . 67 HIS CA 1 1 15 27294 1 1 67 HIS CB C 8.328 -0.476 -6.418 1.00 . A A . 67 HIS CB 1 1 15 27295 1 1 67 HIS CD2 C 9.429 -1.700 -4.388 1.00 . A A . 67 HIS CD2 1 1 15 27296 1 1 67 HIS CE1 C 9.944 -3.573 -5.395 1.00 . A A . 67 HIS CE1 1 1 15 27297 1 1 67 HIS CG C 9.018 -1.601 -5.685 1.00 . A A . 67 HIS CG 1 1 15 27298 1 1 67 HIS H H 6.833 1.538 -5.599 1.00 . A A . 67 HIS H 1 1 15 27299 1 1 67 HIS HA H 6.357 -0.921 -7.100 1.00 . A A . 67 HIS HA 1 1 15 27300 1 1 67 HIS HB2 H 8.549 -0.561 -7.483 1.00 . A A . 67 HIS HB2 1 1 15 27301 1 1 67 HIS HB3 H 8.744 0.473 -6.081 1.00 . A A . 67 HIS HB3 1 1 15 27302 1 1 67 HIS HD1 H 9.187 -3.035 -7.250 1.00 . A A . 67 HIS HD1 1 1 15 27303 1 1 67 HIS HD2 H 9.318 -0.930 -3.624 1.00 . A A . 67 HIS HD2 1 1 15 27304 1 1 67 HIS HE1 H 10.326 -4.579 -5.568 1.00 . A A . 67 HIS HE1 1 1 15 27305 1 1 67 HIS N N 6.319 0.919 -6.194 1.00 . A A . 67 HIS N 1 1 15 27306 1 1 67 HIS ND1 N 9.357 -2.797 -6.294 1.00 . A A . 67 HIS ND1 1 1 15 27307 1 1 67 HIS NE2 N 9.987 -2.891 -4.214 1.00 . A A . 67 HIS NE2 1 1 15 27308 1 1 67 HIS O O 6.121 -2.395 -5.003 1.00 . A A . 67 HIS O 1 1 15 27309 1 1 68 VAL C C 4.299 -0.965 -2.527 1.00 . A A . 68 VAL C 1 1 15 27310 1 1 68 VAL CA C 5.826 -1.001 -2.616 1.00 . A A . 68 VAL CA 1 1 15 27311 1 1 68 VAL CB C 6.509 -0.267 -1.461 1.00 . A A . 68 VAL CB 1 1 15 27312 1 1 68 VAL CG1 C 7.963 -0.719 -1.307 1.00 . A A . 68 VAL CG1 1 1 15 27313 1 1 68 VAL CG2 C 6.423 1.249 -1.648 1.00 . A A . 68 VAL CG2 1 1 15 27314 1 1 68 VAL H H 6.439 0.549 -3.865 1.00 . A A . 68 VAL H 1 1 15 27315 1 1 68 VAL HA H 6.154 -2.040 -2.596 1.00 . A A . 68 VAL HA 1 1 15 27316 1 1 68 VAL HB H 5.980 -0.521 -0.542 1.00 . A A . 68 VAL HB 1 1 15 27317 1 1 68 VAL HG11 H 8.050 -1.766 -1.596 1.00 . A A . 68 VAL HG11 1 1 15 27318 1 1 68 VAL HG12 H 8.602 -0.111 -1.947 1.00 . A A . 68 VAL HG12 1 1 15 27319 1 1 68 VAL HG13 H 8.271 -0.601 -0.268 1.00 . A A . 68 VAL HG13 1 1 15 27320 1 1 68 VAL HG21 H 5.496 1.500 -2.164 1.00 . A A . 68 VAL HG21 1 1 15 27321 1 1 68 VAL HG22 H 6.441 1.737 -0.674 1.00 . A A . 68 VAL HG22 1 1 15 27322 1 1 68 VAL HG23 H 7.272 1.591 -2.241 1.00 . A A . 68 VAL HG23 1 1 15 27323 1 1 68 VAL N N 6.247 -0.433 -3.885 1.00 . A A . 68 VAL N 1 1 15 27324 1 1 68 VAL O O 3.728 -1.244 -1.474 1.00 . A A . 68 VAL O 1 1 15 27325 1 1 69 MET C C 1.676 -1.506 -4.760 1.00 . A A . 69 MET C 1 1 15 27326 1 1 69 MET CA C 2.231 -0.543 -3.709 1.00 . A A . 69 MET CA 1 1 15 27327 1 1 69 MET CB C 1.809 0.887 -4.053 1.00 . A A . 69 MET CB 1 1 15 27328 1 1 69 MET CE C 2.747 2.366 -0.462 1.00 . A A . 69 MET CE 1 1 15 27329 1 1 69 MET CG C 2.513 1.899 -3.147 1.00 . A A . 69 MET CG 1 1 15 27330 1 1 69 MET H H 4.153 -0.395 -4.500 1.00 . A A . 69 MET H 1 1 15 27331 1 1 69 MET HA H 1.880 -0.833 -2.719 1.00 . A A . 69 MET HA 1 1 15 27332 1 1 69 MET HB2 H 2.047 1.099 -5.095 1.00 . A A . 69 MET HB2 1 1 15 27333 1 1 69 MET HB3 H 0.729 0.987 -3.946 1.00 . A A . 69 MET HB3 1 1 15 27334 1 1 69 MET HE1 H 3.437 1.528 -0.564 1.00 . A A . 69 MET HE1 1 1 15 27335 1 1 69 MET HE2 H 3.295 3.302 -0.570 1.00 . A A . 69 MET HE2 1 1 15 27336 1 1 69 MET HE3 H 2.276 2.331 0.520 1.00 . A A . 69 MET HE3 1 1 15 27337 1 1 69 MET HG2 H 3.475 1.502 -2.822 1.00 . A A . 69 MET HG2 1 1 15 27338 1 1 69 MET HG3 H 2.718 2.815 -3.701 1.00 . A A . 69 MET HG3 1 1 15 27339 1 1 69 MET N N 3.681 -0.620 -3.647 1.00 . A A . 69 MET N 1 1 15 27340 1 1 69 MET O O 0.468 -1.729 -4.826 1.00 . A A . 69 MET O 1 1 15 27341 1 1 69 MET SD S 1.493 2.261 -1.728 1.00 . A A . 69 MET SD 1 1 15 27342 1 1 70 HIS C C 3.156 -4.179 -6.599 1.00 . A A . 70 HIS C 1 1 15 27343 1 1 70 HIS CA C 2.200 -2.985 -6.601 1.00 . A A . 70 HIS CA 1 1 15 27344 1 1 70 HIS CB C 2.131 -2.282 -7.959 1.00 . A A . 70 HIS CB 1 1 15 27345 1 1 70 HIS CD2 C 0.132 -0.645 -8.352 1.00 . A A . 70 HIS CD2 1 1 15 27346 1 1 70 HIS CE1 C 1.053 1.170 -7.549 1.00 . A A . 70 HIS CE1 1 1 15 27347 1 1 70 HIS CG C 1.390 -0.967 -7.933 1.00 . A A . 70 HIS CG 1 1 15 27348 1 1 70 HIS H H 3.564 -1.865 -5.496 1.00 . A A . 70 HIS H 1 1 15 27349 1 1 70 HIS HA H 1.196 -3.333 -6.356 1.00 . A A . 70 HIS HA 1 1 15 27350 1 1 70 HIS HB2 H 3.146 -2.109 -8.318 1.00 . A A . 70 HIS HB2 1 1 15 27351 1 1 70 HIS HB3 H 1.649 -2.946 -8.676 1.00 . A A . 70 HIS HB3 1 1 15 27352 1 1 70 HIS HD1 H 2.864 0.289 -7.049 1.00 . A A . 70 HIS HD1 1 1 15 27353 1 1 70 HIS HD2 H -0.585 -1.332 -8.802 1.00 . A A . 70 HIS HD2 1 1 15 27354 1 1 70 HIS HE1 H 1.192 2.207 -7.244 1.00 . A A . 70 HIS HE1 1 1 15 27355 1 1 70 HIS N N 2.584 -2.051 -5.556 1.00 . A A . 70 HIS N 1 1 15 27356 1 1 70 HIS ND1 N 1.945 0.197 -7.433 1.00 . A A . 70 HIS ND1 1 1 15 27357 1 1 70 HIS NE2 N -0.070 0.646 -8.118 1.00 . A A . 70 HIS NE2 1 1 15 27358 1 1 70 HIS O O 2.733 -5.317 -6.403 1.00 . A A . 70 HIS O 1 1 15 27359 1 1 71 ASP C C 5.155 -5.939 -5.749 1.00 . A A . 71 ASP C 1 1 15 27360 1 1 71 ASP CA C 5.447 -4.914 -6.846 1.00 . A A . 71 ASP CA 1 1 15 27361 1 1 71 ASP CB C 6.835 -4.326 -6.587 1.00 . A A . 71 ASP CB 1 1 15 27362 1 1 71 ASP CG C 7.986 -5.051 -7.287 1.00 . A A . 71 ASP CG 1 1 15 27363 1 1 71 ASP H H 4.763 -2.950 -6.978 1.00 . A A . 71 ASP H 1 1 15 27364 1 1 71 ASP HA H 5.391 -5.345 -7.846 1.00 . A A . 71 ASP HA 1 1 15 27365 1 1 71 ASP HB2 H 6.837 -3.283 -6.904 1.00 . A A . 71 ASP HB2 1 1 15 27366 1 1 71 ASP HB3 H 7.022 -4.333 -5.513 1.00 . A A . 71 ASP HB3 1 1 15 27367 1 1 71 ASP N N 4.427 -3.879 -6.820 1.00 . A A . 71 ASP N 1 1 15 27368 1 1 71 ASP O O 4.857 -5.571 -4.614 1.00 . A A . 71 ASP O 1 1 15 27369 1 1 71 ASP OD1 O 8.388 -6.114 -6.766 1.00 . A A . 71 ASP OD1 1 1 15 27370 1 1 71 ASP OD2 O 8.438 -4.526 -8.328 1.00 . A A . 71 ASP OD2 1 1 15 27371 1 1 72 LYS C C 6.336 -8.867 -4.717 1.00 . A A . 72 LYS C 1 1 15 27372 1 1 72 LYS CA C 5.001 -8.287 -5.188 1.00 . A A . 72 LYS CA 1 1 15 27373 1 1 72 LYS CB C 4.064 -9.326 -5.806 1.00 . A A . 72 LYS CB 1 1 15 27374 1 1 72 LYS CD C 2.041 -9.684 -7.269 1.00 . A A . 72 LYS CD 1 1 15 27375 1 1 72 LYS CE C 1.461 -9.112 -8.564 1.00 . A A . 72 LYS CE 1 1 15 27376 1 1 72 LYS CG C 2.912 -8.650 -6.554 1.00 . A A . 72 LYS CG 1 1 15 27377 1 1 72 LYS H H 5.495 -7.497 -7.051 1.00 . A A . 72 LYS H 1 1 15 27378 1 1 72 LYS HA H 4.487 -7.860 -4.327 1.00 . A A . 72 LYS HA 1 1 15 27379 1 1 72 LYS HB2 H 4.622 -9.964 -6.492 1.00 . A A . 72 LYS HB2 1 1 15 27380 1 1 72 LYS HB3 H 3.665 -9.972 -5.024 1.00 . A A . 72 LYS HB3 1 1 15 27381 1 1 72 LYS HD2 H 2.632 -10.572 -7.493 1.00 . A A . 72 LYS HD2 1 1 15 27382 1 1 72 LYS HD3 H 1.230 -9.999 -6.611 1.00 . A A . 72 LYS HD3 1 1 15 27383 1 1 72 LYS HE2 H 0.544 -8.564 -8.348 1.00 . A A . 72 LYS HE2 1 1 15 27384 1 1 72 LYS HE3 H 2.162 -8.400 -9.000 1.00 . A A . 72 LYS HE3 1 1 15 27385 1 1 72 LYS HG2 H 2.304 -8.079 -5.853 1.00 . A A . 72 LYS HG2 1 1 15 27386 1 1 72 LYS HG3 H 3.312 -7.942 -7.280 1.00 . A A . 72 LYS HG3 1 1 15 27387 1 1 72 LYS HZ1 H 0.187 -10.360 -9.642 1.00 . A A . 72 LYS HZ1 1 1 15 27388 1 1 72 LYS HZ2 H 1.549 -9.988 -10.453 1.00 . A A . 72 LYS HZ2 1 1 15 27389 1 1 72 LYS N N 5.252 -7.206 -6.126 1.00 . A A . 72 LYS N 1 1 15 27390 1 1 72 LYS NZ N 1.182 -10.196 -9.531 1.00 . A A . 72 LYS NZ 1 1 15 27391 1 1 72 LYS O O 6.463 -9.288 -3.568 1.00 . A A . 72 LYS O 1 1 15 27392 1 1 73 ASN C C 9.335 -8.428 -4.371 1.00 . A A . 73 ASN C 1 1 15 27393 1 1 73 ASN CA C 8.619 -9.391 -5.320 1.00 . A A . 73 ASN CA 1 1 15 27394 1 1 73 ASN CB C 9.468 -9.524 -6.586 1.00 . A A . 73 ASN CB 1 1 15 27395 1 1 73 ASN CG C 8.877 -10.570 -7.534 1.00 . A A . 73 ASN CG 1 1 15 27396 1 1 73 ASN H H 7.187 -8.525 -6.560 1.00 . A A . 73 ASN H 1 1 15 27397 1 1 73 ASN HA H 8.443 -10.368 -4.869 1.00 . A A . 73 ASN HA 1 1 15 27398 1 1 73 ASN HB2 H 9.526 -8.561 -7.092 1.00 . A A . 73 ASN HB2 1 1 15 27399 1 1 73 ASN HB3 H 10.486 -9.806 -6.318 1.00 . A A . 73 ASN HB3 1 1 15 27400 1 1 73 ASN HD21 H 10.157 -9.926 -8.965 1.00 . A A . 73 ASN HD21 1 1 15 27401 1 1 73 ASN HD22 H 9.107 -11.221 -9.438 1.00 . A A . 73 ASN HD22 1 1 15 27402 1 1 73 ASN N N 7.298 -8.870 -5.628 1.00 . A A . 73 ASN N 1 1 15 27403 1 1 73 ASN ND2 N 9.426 -10.573 -8.746 1.00 . A A . 73 ASN ND2 1 1 15 27404 1 1 73 ASN O O 10.375 -7.869 -4.715 1.00 . A A . 73 ASN O 1 1 15 27405 1 1 73 ASN OD1 O 7.983 -11.325 -7.189 1.00 . A A . 73 ASN OD1 1 1 15 27406 1 1 74 THR C C 9.549 -8.131 -0.882 1.00 . A A . 74 THR C 1 1 15 27407 1 1 74 THR CA C 9.317 -7.376 -2.193 1.00 . A A . 74 THR CA 1 1 15 27408 1 1 74 THR CB C 8.384 -6.172 -2.044 1.00 . A A . 74 THR CB 1 1 15 27409 1 1 74 THR CG2 C 8.171 -5.430 -3.364 1.00 . A A . 74 THR CG2 1 1 15 27410 1 1 74 THR H H 7.903 -8.721 -2.921 1.00 . A A . 74 THR H 1 1 15 27411 1 1 74 THR HA H 10.292 -7.040 -2.545 1.00 . A A . 74 THR HA 1 1 15 27412 1 1 74 THR HB H 8.745 -5.495 -1.270 1.00 . A A . 74 THR HB 1 1 15 27413 1 1 74 THR HG1 H 7.001 -6.865 -0.774 1.00 . A A . 74 THR HG1 1 1 15 27414 1 1 74 THR HG21 H 8.945 -5.722 -4.074 1.00 . A A . 74 THR HG21 1 1 15 27415 1 1 74 THR HG22 H 7.191 -5.683 -3.769 1.00 . A A . 74 THR HG22 1 1 15 27416 1 1 74 THR HG23 H 8.225 -4.355 -3.190 1.00 . A A . 74 THR HG23 1 1 15 27417 1 1 74 THR N N 8.748 -8.263 -3.194 1.00 . A A . 74 THR N 1 1 15 27418 1 1 74 THR O O 8.884 -9.130 -0.611 1.00 . A A . 74 THR O 1 1 15 27419 1 1 74 THR OG1 O 7.113 -6.751 -1.761 1.00 . A A . 74 THR OG1 1 1 15 27420 1 1 75 LYS C C 9.617 -8.135 2.107 1.00 . A A . 75 LYS C 1 1 15 27421 1 1 75 LYS CA C 10.823 -8.239 1.171 1.00 . A A . 75 LYS CA 1 1 15 27422 1 1 75 LYS CB C 12.102 -7.628 1.746 1.00 . A A . 75 LYS CB 1 1 15 27423 1 1 75 LYS CD C 13.414 -7.310 3.876 1.00 . A A . 75 LYS CD 1 1 15 27424 1 1 75 LYS CE C 13.620 -7.798 5.312 1.00 . A A . 75 LYS CE 1 1 15 27425 1 1 75 LYS CG C 12.397 -8.184 3.140 1.00 . A A . 75 LYS CG 1 1 15 27426 1 1 75 LYS H H 11.030 -6.812 -0.333 1.00 . A A . 75 LYS H 1 1 15 27427 1 1 75 LYS HA H 11.025 -9.293 0.983 1.00 . A A . 75 LYS HA 1 1 15 27428 1 1 75 LYS HB2 H 12.941 -7.838 1.082 1.00 . A A . 75 LYS HB2 1 1 15 27429 1 1 75 LYS HB3 H 12.001 -6.544 1.797 1.00 . A A . 75 LYS HB3 1 1 15 27430 1 1 75 LYS HD2 H 14.365 -7.324 3.343 1.00 . A A . 75 LYS HD2 1 1 15 27431 1 1 75 LYS HD3 H 13.070 -6.275 3.886 1.00 . A A . 75 LYS HD3 1 1 15 27432 1 1 75 LYS HE2 H 12.695 -8.232 5.690 1.00 . A A . 75 LYS HE2 1 1 15 27433 1 1 75 LYS HE3 H 14.373 -8.585 5.330 1.00 . A A . 75 LYS HE3 1 1 15 27434 1 1 75 LYS HG2 H 11.473 -8.238 3.717 1.00 . A A . 75 LYS HG2 1 1 15 27435 1 1 75 LYS HG3 H 12.780 -9.201 3.057 1.00 . A A . 75 LYS HG3 1 1 15 27436 1 1 75 LYS HZ1 H 14.814 -6.155 5.783 1.00 . A A . 75 LYS HZ1 1 1 15 27437 1 1 75 LYS HZ2 H 13.291 -6.018 6.345 1.00 . A A . 75 LYS HZ2 1 1 15 27438 1 1 75 LYS N N 10.494 -7.625 -0.104 1.00 . A A . 75 LYS N 1 1 15 27439 1 1 75 LYS NZ N 14.043 -6.679 6.183 1.00 . A A . 75 LYS NZ 1 1 15 27440 1 1 75 LYS O O 9.485 -8.921 3.044 1.00 . A A . 75 LYS O 1 1 15 27441 1 1 76 PHE C C 6.311 -7.080 1.781 1.00 . A A . 76 PHE C 1 1 15 27442 1 1 76 PHE CA C 7.578 -6.942 2.627 1.00 . A A . 76 PHE CA 1 1 15 27443 1 1 76 PHE CB C 7.677 -5.506 3.147 1.00 . A A . 76 PHE CB 1 1 15 27444 1 1 76 PHE CD1 C 8.810 -5.853 5.372 1.00 . A A . 76 PHE CD1 1 1 15 27445 1 1 76 PHE CD2 C 9.904 -4.487 3.743 1.00 . A A . 76 PHE CD2 1 1 15 27446 1 1 76 PHE CE1 C 9.900 -5.634 6.287 1.00 . A A . 76 PHE CE1 1 1 15 27447 1 1 76 PHE CE2 C 10.994 -4.269 4.659 1.00 . A A . 76 PHE CE2 1 1 15 27448 1 1 76 PHE CG C 8.835 -5.274 4.119 1.00 . A A . 76 PHE CG 1 1 15 27449 1 1 76 PHE CZ C 10.939 -4.853 5.885 1.00 . A A . 76 PHE CZ 1 1 15 27450 1 1 76 PHE H H 8.883 -6.524 1.057 1.00 . A A . 76 PHE H 1 1 15 27451 1 1 76 PHE HA H 7.564 -7.695 3.415 1.00 . A A . 76 PHE HA 1 1 15 27452 1 1 76 PHE HB2 H 7.787 -4.831 2.298 1.00 . A A . 76 PHE HB2 1 1 15 27453 1 1 76 PHE HB3 H 6.742 -5.246 3.642 1.00 . A A . 76 PHE HB3 1 1 15 27454 1 1 76 PHE HD1 H 7.966 -6.474 5.669 1.00 . A A . 76 PHE HD1 1 1 15 27455 1 1 76 PHE HD2 H 9.924 -4.031 2.753 1.00 . A A . 76 PHE HD2 1 1 15 27456 1 1 76 PHE HE1 H 9.893 -6.085 7.280 1.00 . A A . 76 PHE HE1 1 1 15 27457 1 1 76 PHE HE2 H 11.845 -3.649 4.374 1.00 . A A . 76 PHE HE2 1 1 15 27458 1 1 76 PHE HZ H 11.744 -4.762 6.657 1.00 . A A . 76 PHE HZ 1 1 15 27459 1 1 76 PHE N N 8.768 -7.159 1.821 1.00 . A A . 76 PHE N 1 1 15 27460 1 1 76 PHE O O 6.354 -6.919 0.562 1.00 . A A . 76 PHE O 1 1 15 27461 1 1 77 LYS C C 3.513 -6.200 1.177 1.00 . A A . 77 LYS C 1 1 15 27462 1 1 77 LYS CA C 3.936 -7.538 1.787 1.00 . A A . 77 LYS CA 1 1 15 27463 1 1 77 LYS CB C 2.899 -8.135 2.740 1.00 . A A . 77 LYS CB 1 1 15 27464 1 1 77 LYS CD C 1.885 -10.267 3.625 1.00 . A A . 77 LYS CD 1 1 15 27465 1 1 77 LYS CE C 0.859 -10.968 2.732 1.00 . A A . 77 LYS CE 1 1 15 27466 1 1 77 LYS CG C 3.014 -9.660 2.790 1.00 . A A . 77 LYS CG 1 1 15 27467 1 1 77 LYS H H 5.187 -7.505 3.452 1.00 . A A . 77 LYS H 1 1 15 27468 1 1 77 LYS HA H 4.082 -8.255 0.979 1.00 . A A . 77 LYS HA 1 1 15 27469 1 1 77 LYS HB2 H 3.039 -7.723 3.740 1.00 . A A . 77 LYS HB2 1 1 15 27470 1 1 77 LYS HB3 H 1.898 -7.852 2.417 1.00 . A A . 77 LYS HB3 1 1 15 27471 1 1 77 LYS HD2 H 2.298 -10.980 4.338 1.00 . A A . 77 LYS HD2 1 1 15 27472 1 1 77 LYS HD3 H 1.394 -9.485 4.204 1.00 . A A . 77 LYS HD3 1 1 15 27473 1 1 77 LYS HE2 H 0.287 -10.226 2.174 1.00 . A A . 77 LYS HE2 1 1 15 27474 1 1 77 LYS HE3 H 1.371 -11.592 2.000 1.00 . A A . 77 LYS HE3 1 1 15 27475 1 1 77 LYS HG2 H 2.980 -10.064 1.778 1.00 . A A . 77 LYS HG2 1 1 15 27476 1 1 77 LYS HG3 H 3.977 -9.942 3.214 1.00 . A A . 77 LYS HG3 1 1 15 27477 1 1 77 LYS HZ1 H -1.017 -11.729 3.229 1.00 . A A . 77 LYS HZ1 1 1 15 27478 1 1 77 LYS HZ2 H 0.192 -12.780 3.516 1.00 . A A . 77 LYS HZ2 1 1 15 27479 1 1 77 LYS N N 5.213 -7.376 2.461 1.00 . A A . 77 LYS N 1 1 15 27480 1 1 77 LYS NZ N -0.057 -11.798 3.547 1.00 . A A . 77 LYS NZ 1 1 15 27481 1 1 77 LYS O O 3.435 -5.192 1.878 1.00 . A A . 77 LYS O 1 1 15 27482 1 1 78 SER C C 1.315 -5.005 -0.964 1.00 . A A . 78 SER C 1 1 15 27483 1 1 78 SER CA C 2.839 -5.036 -0.833 1.00 . A A . 78 SER CA 1 1 15 27484 1 1 78 SER CB C 3.491 -4.965 -2.215 1.00 . A A . 78 SER CB 1 1 15 27485 1 1 78 SER H H 3.317 -7.058 -0.683 1.00 . A A . 78 SER H 1 1 15 27486 1 1 78 SER HA H 3.188 -4.203 -0.223 1.00 . A A . 78 SER HA 1 1 15 27487 1 1 78 SER HB2 H 3.557 -3.923 -2.531 1.00 . A A . 78 SER HB2 1 1 15 27488 1 1 78 SER HB3 H 4.511 -5.344 -2.154 1.00 . A A . 78 SER HB3 1 1 15 27489 1 1 78 SER HG H 3.382 -6.023 -3.910 1.00 . A A . 78 SER HG 1 1 15 27490 1 1 78 SER N N 3.251 -6.234 -0.121 1.00 . A A . 78 SER N 1 1 15 27491 1 1 78 SER O O 0.657 -6.038 -0.853 1.00 . A A . 78 SER O 1 1 15 27492 1 1 78 SER OG O 2.765 -5.710 -3.188 1.00 . A A . 78 SER OG 1 1 15 27493 1 1 79 CYS C C -1.170 -4.738 -2.252 1.00 . A A . 79 CYS C 1 1 15 27494 1 1 79 CYS CA C -0.637 -3.627 -1.344 1.00 . A A . 79 CYS CA 1 1 15 27495 1 1 79 CYS CB C -0.980 -2.236 -1.882 1.00 . A A . 79 CYS CB 1 1 15 27496 1 1 79 CYS H H 1.340 -2.972 -1.287 1.00 . A A . 79 CYS H 1 1 15 27497 1 1 79 CYS HA H -1.066 -3.705 -0.345 1.00 . A A . 79 CYS HA 1 1 15 27498 1 1 79 CYS HB2 H -0.642 -2.168 -2.915 1.00 . A A . 79 CYS HB2 1 1 15 27499 1 1 79 CYS HB3 H -2.064 -2.124 -1.893 1.00 . A A . 79 CYS HB3 1 1 15 27500 1 1 79 CYS N N 0.798 -3.807 -1.198 1.00 . A A . 79 CYS N 1 1 15 27501 1 1 79 CYS O O -1.918 -5.605 -1.804 1.00 . A A . 79 CYS O 1 1 15 27502 1 1 79 CYS SG S -0.257 -0.848 -0.935 1.00 . A A . 79 CYS SG 1 1 15 27503 1 1 80 VAL C C -0.659 -7.038 -4.079 1.00 . A A . 80 VAL C 1 1 15 27504 1 1 80 VAL CA C -1.192 -5.663 -4.486 1.00 . A A . 80 VAL CA 1 1 15 27505 1 1 80 VAL CB C -0.749 -5.241 -5.889 1.00 . A A . 80 VAL CB 1 1 15 27506 1 1 80 VAL CG1 C -1.051 -6.338 -6.912 1.00 . A A . 80 VAL CG1 1 1 15 27507 1 1 80 VAL CG2 C -1.401 -3.918 -6.295 1.00 . A A . 80 VAL CG2 1 1 15 27508 1 1 80 VAL H H -0.155 -3.965 -3.868 1.00 . A A . 80 VAL H 1 1 15 27509 1 1 80 VAL HA H -2.282 -5.690 -4.471 1.00 . A A . 80 VAL HA 1 1 15 27510 1 1 80 VAL HB H 0.330 -5.090 -5.868 1.00 . A A . 80 VAL HB 1 1 15 27511 1 1 80 VAL HG11 H -1.044 -7.309 -6.417 1.00 . A A . 80 VAL HG11 1 1 15 27512 1 1 80 VAL HG12 H -2.031 -6.163 -7.354 1.00 . A A . 80 VAL HG12 1 1 15 27513 1 1 80 VAL HG13 H -0.292 -6.324 -7.694 1.00 . A A . 80 VAL HG13 1 1 15 27514 1 1 80 VAL HG21 H -2.347 -3.802 -5.767 1.00 . A A . 80 VAL HG21 1 1 15 27515 1 1 80 VAL HG22 H -0.737 -3.092 -6.039 1.00 . A A . 80 VAL HG22 1 1 15 27516 1 1 80 VAL HG23 H -1.582 -3.918 -7.370 1.00 . A A . 80 VAL HG23 1 1 15 27517 1 1 80 VAL N N -0.764 -4.674 -3.512 1.00 . A A . 80 VAL N 1 1 15 27518 1 1 80 VAL O O -1.337 -8.049 -4.259 1.00 . A A . 80 VAL O 1 1 15 27519 1 1 81 GLY C C 0.257 -9.062 -2.182 1.00 . A A . 81 GLY C 1 1 15 27520 1 1 81 GLY CA C 1.182 -8.267 -3.105 1.00 . A A . 81 GLY CA 1 1 15 27521 1 1 81 GLY H H 1.095 -6.206 -3.396 1.00 . A A . 81 GLY H 1 1 15 27522 1 1 81 GLY HA2 H 1.442 -8.871 -3.974 1.00 . A A . 81 GLY HA2 1 1 15 27523 1 1 81 GLY HA3 H 2.113 -8.040 -2.585 1.00 . A A . 81 GLY HA3 1 1 15 27524 1 1 81 GLY N N 0.550 -7.032 -3.539 1.00 . A A . 81 GLY N 1 1 15 27525 1 1 81 GLY O O -0.096 -10.201 -2.482 1.00 . A A . 81 GLY O 1 1 15 27526 1 1 82 CYS C C -2.342 -9.312 -0.777 1.00 . A A . 82 CYS C 1 1 15 27527 1 1 82 CYS CA C -0.988 -9.063 -0.108 1.00 . A A . 82 CYS CA 1 1 15 27528 1 1 82 CYS CB C -1.126 -8.224 1.164 1.00 . A A . 82 CYS CB 1 1 15 27529 1 1 82 CYS H H 0.180 -7.502 -0.841 1.00 . A A . 82 CYS H 1 1 15 27530 1 1 82 CYS HA H -0.516 -10.004 0.173 1.00 . A A . 82 CYS HA 1 1 15 27531 1 1 82 CYS HB2 H -0.140 -8.013 1.579 1.00 . A A . 82 CYS HB2 1 1 15 27532 1 1 82 CYS HB3 H -1.585 -7.264 0.929 1.00 . A A . 82 CYS HB3 1 1 15 27533 1 1 82 CYS N N -0.111 -8.429 -1.077 1.00 . A A . 82 CYS N 1 1 15 27534 1 1 82 CYS O O -2.914 -10.393 -0.645 1.00 . A A . 82 CYS O 1 1 15 27535 1 1 82 CYS SG S -2.144 -9.118 2.395 1.00 . A A . 82 CYS SG 1 1 15 27536 1 1 83 HIS C C -4.104 -9.637 -3.054 1.00 . A A . 83 HIS C 1 1 15 27537 1 1 83 HIS CA C -4.090 -8.389 -2.169 1.00 . A A . 83 HIS CA 1 1 15 27538 1 1 83 HIS CB C -4.383 -7.106 -2.950 1.00 . A A . 83 HIS CB 1 1 15 27539 1 1 83 HIS CD2 C -4.787 -5.729 -0.765 1.00 . A A . 83 HIS CD2 1 1 15 27540 1 1 83 HIS CE1 C -5.999 -4.124 -1.627 1.00 . A A . 83 HIS CE1 1 1 15 27541 1 1 83 HIS CG C -4.918 -5.978 -2.099 1.00 . A A . 83 HIS CG 1 1 15 27542 1 1 83 HIS H H -2.343 -7.418 -1.583 1.00 . A A . 83 HIS H 1 1 15 27543 1 1 83 HIS HA H -4.855 -8.491 -1.399 1.00 . A A . 83 HIS HA 1 1 15 27544 1 1 83 HIS HB2 H -3.468 -6.774 -3.440 1.00 . A A . 83 HIS HB2 1 1 15 27545 1 1 83 HIS HB3 H -5.104 -7.327 -3.736 1.00 . A A . 83 HIS HB3 1 1 15 27546 1 1 83 HIS HD1 H -5.962 -4.847 -3.571 1.00 . A A . 83 HIS HD1 1 1 15 27547 1 1 83 HIS HD2 H -4.239 -6.346 -0.052 1.00 . A A . 83 HIS HD2 1 1 15 27548 1 1 83 HIS HE1 H -6.598 -3.218 -1.714 1.00 . A A . 83 HIS HE1 1 1 15 27549 1 1 83 HIS N N -2.815 -8.294 -1.480 1.00 . A A . 83 HIS N 1 1 15 27550 1 1 83 HIS ND1 N -5.688 -4.950 -2.615 1.00 . A A . 83 HIS ND1 1 1 15 27551 1 1 83 HIS NE2 N -5.440 -4.609 -0.481 1.00 . A A . 83 HIS NE2 1 1 15 27552 1 1 83 HIS O O -5.088 -10.375 -3.078 1.00 . A A . 83 HIS O 1 1 15 27553 1 1 84 VAL C C -3.135 -12.263 -3.852 1.00 . A A . 84 VAL C 1 1 15 27554 1 1 84 VAL CA C -2.874 -10.981 -4.644 1.00 . A A . 84 VAL CA 1 1 15 27555 1 1 84 VAL CB C -1.503 -10.967 -5.324 1.00 . A A . 84 VAL CB 1 1 15 27556 1 1 84 VAL CG1 C -1.270 -12.258 -6.113 1.00 . A A . 84 VAL CG1 1 1 15 27557 1 1 84 VAL CG2 C -1.349 -9.739 -6.224 1.00 . A A . 84 VAL CG2 1 1 15 27558 1 1 84 VAL H H -2.205 -9.230 -3.735 1.00 . A A . 84 VAL H 1 1 15 27559 1 1 84 VAL HA H -3.635 -10.885 -5.418 1.00 . A A . 84 VAL HA 1 1 15 27560 1 1 84 VAL HB H -0.743 -10.909 -4.545 1.00 . A A . 84 VAL HB 1 1 15 27561 1 1 84 VAL HG11 H -2.196 -12.555 -6.606 1.00 . A A . 84 VAL HG11 1 1 15 27562 1 1 84 VAL HG12 H -0.497 -12.090 -6.863 1.00 . A A . 84 VAL HG12 1 1 15 27563 1 1 84 VAL HG13 H -0.951 -13.047 -5.432 1.00 . A A . 84 VAL HG13 1 1 15 27564 1 1 84 VAL HG21 H -2.228 -9.102 -6.122 1.00 . A A . 84 VAL HG21 1 1 15 27565 1 1 84 VAL HG22 H -0.460 -9.182 -5.929 1.00 . A A . 84 VAL HG22 1 1 15 27566 1 1 84 VAL HG23 H -1.250 -10.059 -7.261 1.00 . A A . 84 VAL HG23 1 1 15 27567 1 1 84 VAL N N -3.001 -9.835 -3.760 1.00 . A A . 84 VAL N 1 1 15 27568 1 1 84 VAL O O -3.755 -13.196 -4.360 1.00 . A A . 84 VAL O 1 1 15 27569 1 1 85 GLU C C -4.259 -13.479 -1.227 1.00 . A A . 85 GLU C 1 1 15 27570 1 1 85 GLU CA C -2.823 -13.420 -1.751 1.00 . A A . 85 GLU CA 1 1 15 27571 1 1 85 GLU CB C -1.818 -13.393 -0.597 1.00 . A A . 85 GLU CB 1 1 15 27572 1 1 85 GLU CD C -0.525 -15.418 0.168 1.00 . A A . 85 GLU CD 1 1 15 27573 1 1 85 GLU CG C -0.629 -14.312 -0.884 1.00 . A A . 85 GLU CG 1 1 15 27574 1 1 85 GLU H H -2.147 -11.505 -2.213 1.00 . A A . 85 GLU H 1 1 15 27575 1 1 85 GLU HA H -2.622 -14.288 -2.379 1.00 . A A . 85 GLU HA 1 1 15 27576 1 1 85 GLU HB2 H -1.465 -12.374 -0.441 1.00 . A A . 85 GLU HB2 1 1 15 27577 1 1 85 GLU HB3 H -2.309 -13.705 0.325 1.00 . A A . 85 GLU HB3 1 1 15 27578 1 1 85 GLU HG2 H -0.738 -14.756 -1.873 1.00 . A A . 85 GLU HG2 1 1 15 27579 1 1 85 GLU HG3 H 0.291 -13.729 -0.895 1.00 . A A . 85 GLU HG3 1 1 15 27580 1 1 85 GLU N N -2.650 -12.268 -2.619 1.00 . A A . 85 GLU N 1 1 15 27581 1 1 85 GLU O O -4.809 -14.562 -1.033 1.00 . A A . 85 GLU O 1 1 15 27582 1 1 85 GLU OE1 O -0.452 -15.060 1.363 1.00 . A A . 85 GLU OE1 1 1 15 27583 1 1 85 GLU OE2 O -0.521 -16.598 -0.247 1.00 . A A . 85 GLU OE2 1 1 15 27584 1 1 86 VAL C C -7.161 -12.595 -1.626 1.00 . A A . 86 VAL C 1 1 15 27585 1 1 86 VAL CA C -6.187 -12.204 -0.513 1.00 . A A . 86 VAL CA 1 1 15 27586 1 1 86 VAL CB C -6.443 -10.800 0.040 1.00 . A A . 86 VAL CB 1 1 15 27587 1 1 86 VAL CG1 C -7.877 -10.669 0.557 1.00 . A A . 86 VAL CG1 1 1 15 27588 1 1 86 VAL CG2 C -5.431 -10.449 1.133 1.00 . A A . 86 VAL CG2 1 1 15 27589 1 1 86 VAL H H -4.371 -11.424 -1.172 1.00 . A A . 86 VAL H 1 1 15 27590 1 1 86 VAL HA H -6.287 -12.914 0.308 1.00 . A A . 86 VAL HA 1 1 15 27591 1 1 86 VAL HB H -6.315 -10.090 -0.776 1.00 . A A . 86 VAL HB 1 1 15 27592 1 1 86 VAL HG11 H -8.399 -11.616 0.425 1.00 . A A . 86 VAL HG11 1 1 15 27593 1 1 86 VAL HG12 H -7.859 -10.408 1.616 1.00 . A A . 86 VAL HG12 1 1 15 27594 1 1 86 VAL HG13 H -8.394 -9.888 0.000 1.00 . A A . 86 VAL HG13 1 1 15 27595 1 1 86 VAL HG21 H -4.464 -10.888 0.887 1.00 . A A . 86 VAL HG21 1 1 15 27596 1 1 86 VAL HG22 H -5.332 -9.365 1.201 1.00 . A A . 86 VAL HG22 1 1 15 27597 1 1 86 VAL HG23 H -5.777 -10.843 2.088 1.00 . A A . 86 VAL HG23 1 1 15 27598 1 1 86 VAL N N -4.825 -12.300 -1.012 1.00 . A A . 86 VAL N 1 1 15 27599 1 1 86 VAL O O -8.010 -13.464 -1.434 1.00 . A A . 86 VAL O 1 1 15 27600 1 1 87 ALA C C -7.623 -13.633 -4.394 1.00 . A A . 87 ALA C 1 1 15 27601 1 1 87 ALA CA C -7.863 -12.202 -3.907 1.00 . A A . 87 ALA CA 1 1 15 27602 1 1 87 ALA CB C -7.599 -11.162 -4.997 1.00 . A A . 87 ALA CB 1 1 15 27603 1 1 87 ALA H H -6.313 -11.229 -2.911 1.00 . A A . 87 ALA H 1 1 15 27604 1 1 87 ALA HA H -8.897 -12.109 -3.576 1.00 . A A . 87 ALA HA 1 1 15 27605 1 1 87 ALA HB1 H -6.525 -11.006 -5.098 1.00 . A A . 87 ALA HB1 1 1 15 27606 1 1 87 ALA HB2 H -8.004 -11.518 -5.945 1.00 . A A . 87 ALA HB2 1 1 15 27607 1 1 87 ALA HB3 H -8.079 -10.222 -4.727 1.00 . A A . 87 ALA HB3 1 1 15 27608 1 1 87 ALA N N -7.007 -11.935 -2.764 1.00 . A A . 87 ALA N 1 1 15 27609 1 1 87 ALA O O -8.535 -14.277 -4.910 1.00 . A A . 87 ALA O 1 1 15 27610 1 1 88 GLY C C -6.584 -15.749 -6.015 1.00 . A A . 88 GLY C 1 1 15 27611 1 1 88 GLY CA C -6.020 -15.428 -4.629 1.00 . A A . 88 GLY CA 1 1 15 27612 1 1 88 GLY H H -5.656 -13.556 -3.793 1.00 . A A . 88 GLY H 1 1 15 27613 1 1 88 GLY HA2 H -4.934 -15.521 -4.645 1.00 . A A . 88 GLY HA2 1 1 15 27614 1 1 88 GLY HA3 H -6.391 -16.153 -3.905 1.00 . A A . 88 GLY HA3 1 1 15 27615 1 1 88 GLY N N -6.391 -14.087 -4.214 1.00 . A A . 88 GLY N 1 1 15 27616 1 1 88 GLY O O -6.086 -15.251 -7.023 1.00 . A A . 88 GLY O 1 1 15 27617 1 1 89 ALA C C -9.762 -16.737 -7.158 1.00 . A A . 89 ALA C 1 1 15 27618 1 1 89 ALA CA C -8.254 -16.973 -7.265 1.00 . A A . 89 ALA CA 1 1 15 27619 1 1 89 ALA CB C -7.913 -18.432 -7.575 1.00 . A A . 89 ALA CB 1 1 15 27620 1 1 89 ALA H H -8.017 -16.980 -5.196 1.00 . A A . 89 ALA H 1 1 15 27621 1 1 89 ALA HA H -7.852 -16.343 -8.058 1.00 . A A . 89 ALA HA 1 1 15 27622 1 1 89 ALA HB1 H -7.466 -18.895 -6.695 1.00 . A A . 89 ALA HB1 1 1 15 27623 1 1 89 ALA HB2 H -8.823 -18.968 -7.845 1.00 . A A . 89 ALA HB2 1 1 15 27624 1 1 89 ALA HB3 H -7.208 -18.472 -8.405 1.00 . A A . 89 ALA HB3 1 1 15 27625 1 1 89 ALA N N -7.617 -16.579 -6.020 1.00 . A A . 89 ALA N 1 1 15 27626 1 1 89 ALA O O -10.551 -17.673 -7.280 1.00 . A A . 89 ALA O 1 1 15 27627 1 1 90 ASP C C -11.960 -14.371 -8.071 1.00 . A A . 90 ASP C 1 1 15 27628 1 1 90 ASP CA C -11.517 -15.110 -6.807 1.00 . A A . 90 ASP CA 1 1 15 27629 1 1 90 ASP CB C -11.735 -14.177 -5.614 1.00 . A A . 90 ASP CB 1 1 15 27630 1 1 90 ASP CG C -13.140 -13.580 -5.508 1.00 . A A . 90 ASP CG 1 1 15 27631 1 1 90 ASP H H -9.470 -14.725 -6.835 1.00 . A A . 90 ASP H 1 1 15 27632 1 1 90 ASP HA H -12.051 -16.049 -6.664 1.00 . A A . 90 ASP HA 1 1 15 27633 1 1 90 ASP HB2 H -11.520 -14.727 -4.698 1.00 . A A . 90 ASP HB2 1 1 15 27634 1 1 90 ASP HB3 H -11.014 -13.362 -5.673 1.00 . A A . 90 ASP HB3 1 1 15 27635 1 1 90 ASP N N -10.118 -15.481 -6.932 1.00 . A A . 90 ASP N 1 1 15 27636 1 1 90 ASP O O -13.147 -14.335 -8.390 1.00 . A A . 90 ASP O 1 1 15 27637 1 1 90 ASP OD1 O -13.462 -12.731 -6.367 1.00 . A A . 90 ASP OD1 1 1 15 27638 1 1 90 ASP OD2 O -13.859 -13.986 -4.570 1.00 . A A . 90 ASP OD2 1 1 15 27639 1 1 91 ALA C C -11.745 -11.660 -9.626 1.00 . A A . 91 ALA C 1 1 15 27640 1 1 91 ALA CA C -11.254 -13.065 -9.981 1.00 . A A . 91 ALA CA 1 1 15 27641 1 1 91 ALA CB C -12.266 -13.839 -10.828 1.00 . A A . 91 ALA CB 1 1 15 27642 1 1 91 ALA H H -10.017 -13.835 -8.493 1.00 . A A . 91 ALA H 1 1 15 27643 1 1 91 ALA HA H -10.320 -12.985 -10.536 1.00 . A A . 91 ALA HA 1 1 15 27644 1 1 91 ALA HB1 H -12.201 -14.901 -10.590 1.00 . A A . 91 ALA HB1 1 1 15 27645 1 1 91 ALA HB2 H -13.272 -13.479 -10.611 1.00 . A A . 91 ALA HB2 1 1 15 27646 1 1 91 ALA HB3 H -12.046 -13.690 -11.884 1.00 . A A . 91 ALA HB3 1 1 15 27647 1 1 91 ALA N N -10.981 -13.801 -8.758 1.00 . A A . 91 ALA N 1 1 15 27648 1 1 91 ALA O O -11.013 -10.684 -9.784 1.00 . A A . 91 ALA O 1 1 15 27649 1 1 92 ALA C C -12.579 -9.532 -7.938 1.00 . A A . 92 ALA C 1 1 15 27650 1 1 92 ALA CA C -13.579 -10.332 -8.775 1.00 . A A . 92 ALA CA 1 1 15 27651 1 1 92 ALA CB C -14.891 -10.587 -8.030 1.00 . A A . 92 ALA CB 1 1 15 27652 1 1 92 ALA H H -13.570 -12.400 -9.027 1.00 . A A . 92 ALA H 1 1 15 27653 1 1 92 ALA HA H -13.796 -9.782 -9.691 1.00 . A A . 92 ALA HA 1 1 15 27654 1 1 92 ALA HB1 H -15.118 -11.653 -8.049 1.00 . A A . 92 ALA HB1 1 1 15 27655 1 1 92 ALA HB2 H -14.792 -10.254 -6.997 1.00 . A A . 92 ALA HB2 1 1 15 27656 1 1 92 ALA HB3 H -15.696 -10.035 -8.514 1.00 . A A . 92 ALA HB3 1 1 15 27657 1 1 92 ALA N N -12.981 -11.601 -9.153 1.00 . A A . 92 ALA N 1 1 15 27658 1 1 92 ALA O O -12.247 -8.397 -8.279 1.00 . A A . 92 ALA O 1 1 15 27659 1 1 93 LYS C C -9.854 -9.294 -6.719 1.00 . A A . 93 LYS C 1 1 15 27660 1 1 93 LYS CA C -11.171 -9.514 -5.972 1.00 . A A . 93 LYS CA 1 1 15 27661 1 1 93 LYS CB C -11.018 -10.319 -4.680 1.00 . A A . 93 LYS CB 1 1 15 27662 1 1 93 LYS CD C -11.997 -10.806 -2.407 1.00 . A A . 93 LYS CD 1 1 15 27663 1 1 93 LYS CE C -12.952 -11.999 -2.324 1.00 . A A . 93 LYS CE 1 1 15 27664 1 1 93 LYS CG C -12.181 -10.047 -3.723 1.00 . A A . 93 LYS CG 1 1 15 27665 1 1 93 LYS H H -12.401 -11.077 -6.590 1.00 . A A . 93 LYS H 1 1 15 27666 1 1 93 LYS HA H -11.580 -8.541 -5.699 1.00 . A A . 93 LYS HA 1 1 15 27667 1 1 93 LYS HB2 H -10.974 -11.383 -4.912 1.00 . A A . 93 LYS HB2 1 1 15 27668 1 1 93 LYS HB3 H -10.076 -10.061 -4.196 1.00 . A A . 93 LYS HB3 1 1 15 27669 1 1 93 LYS HD2 H -10.967 -11.154 -2.325 1.00 . A A . 93 LYS HD2 1 1 15 27670 1 1 93 LYS HD3 H -12.175 -10.134 -1.568 1.00 . A A . 93 LYS HD3 1 1 15 27671 1 1 93 LYS HE2 H -13.417 -12.168 -3.295 1.00 . A A . 93 LYS HE2 1 1 15 27672 1 1 93 LYS HE3 H -12.394 -12.902 -2.076 1.00 . A A . 93 LYS HE3 1 1 15 27673 1 1 93 LYS HG2 H -12.250 -8.978 -3.524 1.00 . A A . 93 LYS HG2 1 1 15 27674 1 1 93 LYS HG3 H -13.119 -10.346 -4.191 1.00 . A A . 93 LYS HG3 1 1 15 27675 1 1 93 LYS HZ1 H -14.117 -10.769 -1.111 1.00 . A A . 93 LYS HZ1 1 1 15 27676 1 1 93 LYS HZ2 H -14.900 -12.113 -1.592 1.00 . A A . 93 LYS HZ2 1 1 15 27677 1 1 93 LYS N N -12.126 -10.154 -6.860 1.00 . A A . 93 LYS N 1 1 15 27678 1 1 93 LYS NZ N -13.995 -11.757 -1.303 1.00 . A A . 93 LYS NZ 1 1 15 27679 1 1 93 LYS O O -9.147 -8.321 -6.464 1.00 . A A . 93 LYS O 1 1 15 27680 1 1 94 LYS C C -8.397 -8.886 -9.299 1.00 . A A . 94 LYS C 1 1 15 27681 1 1 94 LYS CA C -8.346 -10.133 -8.414 1.00 . A A . 94 LYS CA 1 1 15 27682 1 1 94 LYS CB C -8.123 -11.431 -9.192 1.00 . A A . 94 LYS CB 1 1 15 27683 1 1 94 LYS CD C -6.717 -11.797 -11.253 1.00 . A A . 94 LYS CD 1 1 15 27684 1 1 94 LYS CE C -5.610 -12.786 -11.625 1.00 . A A . 94 LYS CE 1 1 15 27685 1 1 94 LYS CG C -6.701 -11.497 -9.753 1.00 . A A . 94 LYS CG 1 1 15 27686 1 1 94 LYS H H -10.147 -11.002 -7.830 1.00 . A A . 94 LYS H 1 1 15 27687 1 1 94 LYS HA H -7.515 -10.028 -7.717 1.00 . A A . 94 LYS HA 1 1 15 27688 1 1 94 LYS HB2 H -8.301 -12.286 -8.540 1.00 . A A . 94 LYS HB2 1 1 15 27689 1 1 94 LYS HB3 H -8.843 -11.498 -10.008 1.00 . A A . 94 LYS HB3 1 1 15 27690 1 1 94 LYS HD2 H -7.686 -12.208 -11.535 1.00 . A A . 94 LYS HD2 1 1 15 27691 1 1 94 LYS HD3 H -6.587 -10.872 -11.814 1.00 . A A . 94 LYS HD3 1 1 15 27692 1 1 94 LYS HE2 H -4.987 -12.363 -12.414 1.00 . A A . 94 LYS HE2 1 1 15 27693 1 1 94 LYS HE3 H -4.962 -12.957 -10.766 1.00 . A A . 94 LYS HE3 1 1 15 27694 1 1 94 LYS HG2 H -6.192 -10.550 -9.573 1.00 . A A . 94 LYS HG2 1 1 15 27695 1 1 94 LYS HG3 H -6.136 -12.268 -9.229 1.00 . A A . 94 LYS HG3 1 1 15 27696 1 1 94 LYS HZ1 H -5.873 -14.324 -13.006 1.00 . A A . 94 LYS HZ1 1 1 15 27697 1 1 94 LYS HZ2 H -5.945 -14.836 -11.462 1.00 . A A . 94 LYS HZ2 1 1 15 27698 1 1 94 LYS N N -9.566 -10.214 -7.628 1.00 . A A . 94 LYS N 1 1 15 27699 1 1 94 LYS NZ N -6.192 -14.069 -12.078 1.00 . A A . 94 LYS NZ 1 1 15 27700 1 1 94 LYS O O -7.389 -8.496 -9.886 1.00 . A A . 94 LYS O 1 1 15 27701 1 1 95 LYS C C -10.328 -5.981 -9.286 1.00 . A A . 95 LYS C 1 1 15 27702 1 1 95 LYS CA C -9.776 -7.101 -10.170 1.00 . A A . 95 LYS CA 1 1 15 27703 1 1 95 LYS CB C -10.651 -7.411 -11.387 1.00 . A A . 95 LYS CB 1 1 15 27704 1 1 95 LYS CD C -10.574 -7.467 -13.907 1.00 . A A . 95 LYS CD 1 1 15 27705 1 1 95 LYS CE C -9.468 -7.523 -14.962 1.00 . A A . 95 LYS CE 1 1 15 27706 1 1 95 LYS CG C -10.093 -6.745 -12.646 1.00 . A A . 95 LYS CG 1 1 15 27707 1 1 95 LYS H H -10.396 -8.619 -8.885 1.00 . A A . 95 LYS H 1 1 15 27708 1 1 95 LYS HA H -8.799 -6.795 -10.545 1.00 . A A . 95 LYS HA 1 1 15 27709 1 1 95 LYS HB2 H -10.706 -8.489 -11.535 1.00 . A A . 95 LYS HB2 1 1 15 27710 1 1 95 LYS HB3 H -11.668 -7.062 -11.206 1.00 . A A . 95 LYS HB3 1 1 15 27711 1 1 95 LYS HD2 H -10.891 -8.478 -13.652 1.00 . A A . 95 LYS HD2 1 1 15 27712 1 1 95 LYS HD3 H -11.445 -6.954 -14.314 1.00 . A A . 95 LYS HD3 1 1 15 27713 1 1 95 LYS HE2 H -9.907 -7.650 -15.952 1.00 . A A . 95 LYS HE2 1 1 15 27714 1 1 95 LYS HE3 H -8.921 -6.581 -14.974 1.00 . A A . 95 LYS HE3 1 1 15 27715 1 1 95 LYS HG2 H -10.406 -5.701 -12.679 1.00 . A A . 95 LYS HG2 1 1 15 27716 1 1 95 LYS HG3 H -9.004 -6.750 -12.613 1.00 . A A . 95 LYS HG3 1 1 15 27717 1 1 95 LYS HZ1 H -8.076 -8.531 -13.783 1.00 . A A . 95 LYS HZ1 1 1 15 27718 1 1 95 LYS HZ2 H -9.014 -9.534 -14.658 1.00 . A A . 95 LYS HZ2 1 1 15 27719 1 1 95 LYS N N -9.581 -8.295 -9.366 1.00 . A A . 95 LYS N 1 1 15 27720 1 1 95 LYS NZ N -8.538 -8.639 -14.679 1.00 . A A . 95 LYS NZ 1 1 15 27721 1 1 95 LYS O O -10.493 -4.850 -9.741 1.00 . A A . 95 LYS O 1 1 15 27722 1 1 96 ASP C C -10.084 -5.111 -5.997 1.00 . A A . 96 ASP C 1 1 15 27723 1 1 96 ASP CA C -11.127 -5.373 -7.085 1.00 . A A . 96 ASP CA 1 1 15 27724 1 1 96 ASP CB C -12.392 -5.907 -6.409 1.00 . A A . 96 ASP CB 1 1 15 27725 1 1 96 ASP CG C -13.688 -5.203 -6.815 1.00 . A A . 96 ASP CG 1 1 15 27726 1 1 96 ASP H H -10.460 -7.256 -7.675 1.00 . A A . 96 ASP H 1 1 15 27727 1 1 96 ASP HA H -11.351 -4.482 -7.672 1.00 . A A . 96 ASP HA 1 1 15 27728 1 1 96 ASP HB2 H -12.486 -6.969 -6.636 1.00 . A A . 96 ASP HB2 1 1 15 27729 1 1 96 ASP HB3 H -12.272 -5.821 -5.329 1.00 . A A . 96 ASP HB3 1 1 15 27730 1 1 96 ASP N N -10.597 -6.334 -8.038 1.00 . A A . 96 ASP N 1 1 15 27731 1 1 96 ASP O O -10.211 -4.161 -5.227 1.00 . A A . 96 ASP O 1 1 15 27732 1 1 96 ASP OD1 O -13.587 -4.039 -7.259 1.00 . A A . 96 ASP OD1 1 1 15 27733 1 1 96 ASP OD2 O -14.751 -5.845 -6.671 1.00 . A A . 96 ASP OD2 1 1 15 27734 1 1 97 LEU C C -6.688 -5.580 -5.710 1.00 . A A . 97 LEU C 1 1 15 27735 1 1 97 LEU CA C -8.012 -5.844 -4.989 1.00 . A A . 97 LEU CA 1 1 15 27736 1 1 97 LEU CB C -7.979 -7.069 -4.073 1.00 . A A . 97 LEU CB 1 1 15 27737 1 1 97 LEU CD1 C -8.908 -8.344 -2.106 1.00 . A A . 97 LEU CD1 1 1 15 27738 1 1 97 LEU CD2 C -9.481 -5.893 -2.423 1.00 . A A . 97 LEU CD2 1 1 15 27739 1 1 97 LEU CG C -9.161 -7.221 -3.113 1.00 . A A . 97 LEU CG 1 1 15 27740 1 1 97 LEU H H -8.980 -6.740 -6.600 1.00 . A A . 97 LEU H 1 1 15 27741 1 1 97 LEU HA H -8.243 -4.981 -4.364 1.00 . A A . 97 LEU HA 1 1 15 27742 1 1 97 LEU HB2 H -7.925 -7.962 -4.695 1.00 . A A . 97 LEU HB2 1 1 15 27743 1 1 97 LEU HB3 H -7.062 -7.034 -3.485 1.00 . A A . 97 LEU HB3 1 1 15 27744 1 1 97 LEU HD11 H -8.414 -9.177 -2.606 1.00 . A A . 97 LEU HD11 1 1 15 27745 1 1 97 LEU HD12 H -8.273 -7.975 -1.301 1.00 . A A . 97 LEU HD12 1 1 15 27746 1 1 97 LEU HD13 H -9.859 -8.682 -1.692 1.00 . A A . 97 LEU HD13 1 1 15 27747 1 1 97 LEU HD21 H -8.576 -5.288 -2.362 1.00 . A A . 97 LEU HD21 1 1 15 27748 1 1 97 LEU HD22 H -10.238 -5.359 -2.997 1.00 . A A . 97 LEU HD22 1 1 15 27749 1 1 97 LEU HD23 H -9.857 -6.087 -1.418 1.00 . A A . 97 LEU HD23 1 1 15 27750 1 1 97 LEU HG H -10.039 -7.501 -3.695 1.00 . A A . 97 LEU HG 1 1 15 27751 1 1 97 LEU N N -9.076 -5.970 -5.970 1.00 . A A . 97 LEU N 1 1 15 27752 1 1 97 LEU O O -5.874 -4.781 -5.248 1.00 . A A . 97 LEU O 1 1 15 27753 1 1 98 THR C C -5.640 -5.599 -9.020 1.00 . A A . 98 THR C 1 1 15 27754 1 1 98 THR CA C -5.303 -6.115 -7.619 1.00 . A A . 98 THR CA 1 1 15 27755 1 1 98 THR CB C -4.573 -7.459 -7.625 1.00 . A A . 98 THR CB 1 1 15 27756 1 1 98 THR CG2 C -4.663 -8.181 -6.280 1.00 . A A . 98 THR CG2 1 1 15 27757 1 1 98 THR H H -7.181 -6.912 -7.199 1.00 . A A . 98 THR H 1 1 15 27758 1 1 98 THR HA H -4.675 -5.361 -7.144 1.00 . A A . 98 THR HA 1 1 15 27759 1 1 98 THR HB H -3.535 -7.337 -7.933 1.00 . A A . 98 THR HB 1 1 15 27760 1 1 98 THR HG1 H -4.965 -8.230 -9.430 1.00 . A A . 98 THR HG1 1 1 15 27761 1 1 98 THR HG21 H -5.710 -8.283 -5.991 1.00 . A A . 98 THR HG21 1 1 15 27762 1 1 98 THR HG22 H -4.213 -9.170 -6.366 1.00 . A A . 98 THR HG22 1 1 15 27763 1 1 98 THR HG23 H -4.132 -7.605 -5.522 1.00 . A A . 98 THR HG23 1 1 15 27764 1 1 98 THR N N -6.514 -6.265 -6.830 1.00 . A A . 98 THR N 1 1 15 27765 1 1 98 THR O O -4.838 -5.732 -9.943 1.00 . A A . 98 THR O 1 1 15 27766 1 1 98 THR OG1 O -5.346 -8.270 -8.507 1.00 . A A . 98 THR OG1 1 1 15 27767 1 1 99 GLY C C -6.459 -3.260 -10.808 1.00 . A A . 99 GLY C 1 1 15 27768 1 1 99 GLY CA C -7.280 -4.487 -10.406 1.00 . A A . 99 GLY CA 1 1 15 27769 1 1 99 GLY H H -7.473 -4.918 -8.377 1.00 . A A . 99 GLY H 1 1 15 27770 1 1 99 GLY HA2 H -7.198 -5.253 -11.177 1.00 . A A . 99 GLY HA2 1 1 15 27771 1 1 99 GLY HA3 H -8.334 -4.217 -10.337 1.00 . A A . 99 GLY HA3 1 1 15 27772 1 1 99 GLY N N -6.827 -5.022 -9.134 1.00 . A A . 99 GLY N 1 1 15 27773 1 1 99 GLY O O -6.015 -2.498 -9.951 1.00 . A A . 99 GLY O 1 1 15 27774 1 1 100 CYS C C -6.474 -0.803 -12.818 1.00 . A A . 100 CYS C 1 1 15 27775 1 1 100 CYS CA C -5.522 -1.987 -12.638 1.00 . A A . 100 CYS CA 1 1 15 27776 1 1 100 CYS CB C -4.809 -2.349 -13.943 1.00 . A A . 100 CYS CB 1 1 15 27777 1 1 100 CYS H H -6.647 -3.732 -12.803 1.00 . A A . 100 CYS H 1 1 15 27778 1 1 100 CYS HA H -4.753 -1.757 -11.901 1.00 . A A . 100 CYS HA 1 1 15 27779 1 1 100 CYS HB2 H -5.432 -3.049 -14.499 1.00 . A A . 100 CYS HB2 1 1 15 27780 1 1 100 CYS HB3 H -4.717 -1.450 -14.552 1.00 . A A . 100 CYS HB3 1 1 15 27781 1 1 100 CYS N N -6.282 -3.108 -12.112 1.00 . A A . 100 CYS N 1 1 15 27782 1 1 100 CYS O O -6.177 0.309 -12.384 1.00 . A A . 100 CYS O 1 1 15 27783 1 1 100 CYS SG S -3.147 -3.086 -13.730 1.00 . A A . 100 CYS SG 1 1 15 27784 1 1 101 LYS C C -9.970 -0.569 -13.270 1.00 . A A . 101 LYS C 1 1 15 27785 1 1 101 LYS CA C -8.597 -0.053 -13.703 1.00 . A A . 101 LYS CA 1 1 15 27786 1 1 101 LYS CB C -8.545 0.410 -15.160 1.00 . A A . 101 LYS CB 1 1 15 27787 1 1 101 LYS CD C -9.895 1.700 -16.855 1.00 . A A . 101 LYS CD 1 1 15 27788 1 1 101 LYS CE C -11.401 1.476 -17.002 1.00 . A A . 101 LYS CE 1 1 15 27789 1 1 101 LYS CG C -9.468 1.608 -15.388 1.00 . A A . 101 LYS CG 1 1 15 27790 1 1 101 LYS H H -7.833 -1.989 -13.809 1.00 . A A . 101 LYS H 1 1 15 27791 1 1 101 LYS HA H -8.339 0.805 -13.083 1.00 . A A . 101 LYS HA 1 1 15 27792 1 1 101 LYS HB2 H -7.522 0.679 -15.424 1.00 . A A . 101 LYS HB2 1 1 15 27793 1 1 101 LYS HB3 H -8.837 -0.410 -15.817 1.00 . A A . 101 LYS HB3 1 1 15 27794 1 1 101 LYS HD2 H -9.628 2.678 -17.254 1.00 . A A . 101 LYS HD2 1 1 15 27795 1 1 101 LYS HD3 H -9.354 0.958 -17.442 1.00 . A A . 101 LYS HD3 1 1 15 27796 1 1 101 LYS HE2 H -11.795 1.005 -16.101 1.00 . A A . 101 LYS HE2 1 1 15 27797 1 1 101 LYS HE3 H -11.909 2.435 -17.108 1.00 . A A . 101 LYS HE3 1 1 15 27798 1 1 101 LYS HG2 H -10.350 1.518 -14.754 1.00 . A A . 101 LYS HG2 1 1 15 27799 1 1 101 LYS HG3 H -8.958 2.526 -15.096 1.00 . A A . 101 LYS HG3 1 1 15 27800 1 1 101 LYS HZ1 H -12.675 0.603 -18.401 1.00 . A A . 101 LYS HZ1 1 1 15 27801 1 1 101 LYS HZ2 H -11.206 0.952 -19.010 1.00 . A A . 101 LYS HZ2 1 1 15 27802 1 1 101 LYS N N -7.599 -1.082 -13.460 1.00 . A A . 101 LYS N 1 1 15 27803 1 1 101 LYS NZ N -11.686 0.625 -18.179 1.00 . A A . 101 LYS NZ 1 1 15 27804 1 1 101 LYS O O -10.298 -1.734 -13.491 1.00 . A A . 101 LYS O 1 1 15 27805 1 1 102 LYS C C -11.952 -0.984 -11.007 1.00 . A A . 102 LYS C 1 1 15 27806 1 1 102 LYS CA C -12.068 -0.027 -12.195 1.00 . A A . 102 LYS CA 1 1 15 27807 1 1 102 LYS CB C -12.912 -0.577 -13.347 1.00 . A A . 102 LYS CB 1 1 15 27808 1 1 102 LYS CD C -15.057 -0.086 -14.580 1.00 . A A . 102 LYS CD 1 1 15 27809 1 1 102 LYS CE C -15.349 0.560 -15.936 1.00 . A A . 102 LYS CE 1 1 15 27810 1 1 102 LYS CG C -13.801 0.516 -13.946 1.00 . A A . 102 LYS CG 1 1 15 27811 1 1 102 LYS H H -10.463 1.269 -12.486 1.00 . A A . 102 LYS H 1 1 15 27812 1 1 102 LYS HA H -12.547 0.891 -11.854 1.00 . A A . 102 LYS HA 1 1 15 27813 1 1 102 LYS HB2 H -12.259 -0.983 -14.120 1.00 . A A . 102 LYS HB2 1 1 15 27814 1 1 102 LYS HB3 H -13.531 -1.399 -12.989 1.00 . A A . 102 LYS HB3 1 1 15 27815 1 1 102 LYS HD2 H -14.925 -1.161 -14.706 1.00 . A A . 102 LYS HD2 1 1 15 27816 1 1 102 LYS HD3 H -15.908 0.055 -13.914 1.00 . A A . 102 LYS HD3 1 1 15 27817 1 1 102 LYS HE2 H -16.276 1.131 -15.880 1.00 . A A . 102 LYS HE2 1 1 15 27818 1 1 102 LYS HE3 H -14.556 1.263 -16.189 1.00 . A A . 102 LYS HE3 1 1 15 27819 1 1 102 LYS HG2 H -14.086 1.224 -13.168 1.00 . A A . 102 LYS HG2 1 1 15 27820 1 1 102 LYS HG3 H -13.242 1.074 -14.696 1.00 . A A . 102 LYS HG3 1 1 15 27821 1 1 102 LYS HZ1 H -16.382 -0.892 -17.016 1.00 . A A . 102 LYS HZ1 1 1 15 27822 1 1 102 LYS HZ2 H -15.282 -0.094 -17.913 1.00 . A A . 102 LYS HZ2 1 1 15 27823 1 1 102 LYS N N -10.737 0.324 -12.661 1.00 . A A . 102 LYS N 1 1 15 27824 1 1 102 LYS NZ N -15.459 -0.473 -16.989 1.00 . A A . 102 LYS NZ 1 1 15 27825 1 1 102 LYS O O -12.626 -2.012 -10.965 1.00 . A A . 102 LYS O 1 1 15 27826 1 1 103 SER C C -11.169 -0.600 -7.627 1.00 . A A . 103 SER C 1 1 15 27827 1 1 103 SER CA C -10.880 -1.423 -8.884 1.00 . A A . 103 SER CA 1 1 15 27828 1 1 103 SER CB C -9.453 -1.973 -8.842 1.00 . A A . 103 SER CB 1 1 15 27829 1 1 103 SER H H -10.549 0.227 -10.111 1.00 . A A . 103 SER H 1 1 15 27830 1 1 103 SER HA H -11.585 -2.250 -8.970 1.00 . A A . 103 SER HA 1 1 15 27831 1 1 103 SER HB2 H -9.109 -2.010 -7.808 1.00 . A A . 103 SER HB2 1 1 15 27832 1 1 103 SER HB3 H -9.447 -2.996 -9.217 1.00 . A A . 103 SER HB3 1 1 15 27833 1 1 103 SER HG H -8.637 -0.219 -9.354 1.00 . A A . 103 SER HG 1 1 15 27834 1 1 103 SER N N -11.093 -0.611 -10.070 1.00 . A A . 103 SER N 1 1 15 27835 1 1 103 SER O O -11.644 0.531 -7.717 1.00 . A A . 103 SER O 1 1 15 27836 1 1 103 SER OG O -8.553 -1.181 -9.613 1.00 . A A . 103 SER OG 1 1 15 27837 1 1 104 LYS C C -10.023 0.539 -5.007 1.00 . A A . 104 LYS C 1 1 15 27838 1 1 104 LYS CA C -11.092 -0.537 -5.210 1.00 . A A . 104 LYS CA 1 1 15 27839 1 1 104 LYS CB C -11.156 -1.562 -4.077 1.00 . A A . 104 LYS CB 1 1 15 27840 1 1 104 LYS CD C -13.528 -2.008 -3.347 1.00 . A A . 104 LYS CD 1 1 15 27841 1 1 104 LYS CE C -14.251 -3.198 -2.713 1.00 . A A . 104 LYS CE 1 1 15 27842 1 1 104 LYS CG C -12.372 -2.477 -4.233 1.00 . A A . 104 LYS CG 1 1 15 27843 1 1 104 LYS H H -10.483 -2.120 -6.420 1.00 . A A . 104 LYS H 1 1 15 27844 1 1 104 LYS HA H -12.066 -0.051 -5.261 1.00 . A A . 104 LYS HA 1 1 15 27845 1 1 104 LYS HB2 H -10.245 -2.160 -4.070 1.00 . A A . 104 LYS HB2 1 1 15 27846 1 1 104 LYS HB3 H -11.205 -1.046 -3.118 1.00 . A A . 104 LYS HB3 1 1 15 27847 1 1 104 LYS HD2 H -13.149 -1.350 -2.566 1.00 . A A . 104 LYS HD2 1 1 15 27848 1 1 104 LYS HD3 H -14.233 -1.425 -3.941 1.00 . A A . 104 LYS HD3 1 1 15 27849 1 1 104 LYS HE2 H -13.570 -4.046 -2.636 1.00 . A A . 104 LYS HE2 1 1 15 27850 1 1 104 LYS HE3 H -14.560 -2.945 -1.699 1.00 . A A . 104 LYS HE3 1 1 15 27851 1 1 104 LYS HG2 H -12.690 -2.490 -5.275 1.00 . A A . 104 LYS HG2 1 1 15 27852 1 1 104 LYS HG3 H -12.099 -3.499 -3.970 1.00 . A A . 104 LYS HG3 1 1 15 27853 1 1 104 LYS HZ1 H -15.378 -3.219 -4.466 1.00 . A A . 104 LYS HZ1 1 1 15 27854 1 1 104 LYS HZ2 H -15.540 -4.582 -3.589 1.00 . A A . 104 LYS HZ2 1 1 15 27855 1 1 104 LYS N N -10.870 -1.200 -6.484 1.00 . A A . 104 LYS N 1 1 15 27856 1 1 104 LYS NZ N -15.434 -3.576 -3.519 1.00 . A A . 104 LYS NZ 1 1 15 27857 1 1 104 LYS O O -10.271 1.550 -4.353 1.00 . A A . 104 LYS O 1 1 15 27858 1 1 105 CYS C C -7.918 2.294 -6.544 1.00 . A A . 105 CYS C 1 1 15 27859 1 1 105 CYS CA C -7.748 1.218 -5.470 1.00 . A A . 105 CYS CA 1 1 15 27860 1 1 105 CYS CB C -6.397 0.508 -5.583 1.00 . A A . 105 CYS CB 1 1 15 27861 1 1 105 CYS H H -8.662 -0.541 -6.112 1.00 . A A . 105 CYS H 1 1 15 27862 1 1 105 CYS HA H -7.804 1.653 -4.473 1.00 . A A . 105 CYS HA 1 1 15 27863 1 1 105 CYS HB2 H -6.303 0.041 -6.564 1.00 . A A . 105 CYS HB2 1 1 15 27864 1 1 105 CYS HB3 H -5.588 1.234 -5.496 1.00 . A A . 105 CYS HB3 1 1 15 27865 1 1 105 CYS N N -8.856 0.284 -5.581 1.00 . A A . 105 CYS N 1 1 15 27866 1 1 105 CYS O O -8.125 3.465 -6.227 1.00 . A A . 105 CYS O 1 1 15 27867 1 1 105 CYS SG S -6.244 -0.758 -4.271 1.00 . A A . 105 CYS SG 1 1 15 27868 1 1 106 HIS C C -9.395 2.698 -9.460 1.00 . A A . 106 HIS C 1 1 15 27869 1 1 106 HIS CA C -7.967 2.773 -8.914 1.00 . A A . 106 HIS CA 1 1 15 27870 1 1 106 HIS CB C -6.909 2.489 -9.982 1.00 . A A . 106 HIS CB 1 1 15 27871 1 1 106 HIS CD2 C -4.438 1.794 -9.488 1.00 . A A . 106 HIS CD2 1 1 15 27872 1 1 106 HIS CE1 C -3.748 3.684 -8.629 1.00 . A A . 106 HIS CE1 1 1 15 27873 1 1 106 HIS CG C -5.488 2.664 -9.500 1.00 . A A . 106 HIS CG 1 1 15 27874 1 1 106 HIS H H -7.659 0.906 -8.042 1.00 . A A . 106 HIS H 1 1 15 27875 1 1 106 HIS HA H -7.788 3.775 -8.526 1.00 . A A . 106 HIS HA 1 1 15 27876 1 1 106 HIS HB2 H -7.036 1.468 -10.343 1.00 . A A . 106 HIS HB2 1 1 15 27877 1 1 106 HIS HB3 H -7.077 3.151 -10.831 1.00 . A A . 106 HIS HB3 1 1 15 27878 1 1 106 HIS HD1 H -5.557 4.681 -8.821 1.00 . A A . 106 HIS HD1 1 1 15 27879 1 1 106 HIS HD2 H -4.458 0.766 -9.849 1.00 . A A . 106 HIS HD2 1 1 15 27880 1 1 106 HIS HE1 H -3.101 4.436 -8.177 1.00 . A A . 106 HIS HE1 1 1 15 27881 1 1 106 HIS N N -7.826 1.860 -7.792 1.00 . A A . 106 HIS N 1 1 15 27882 1 1 106 HIS ND1 N -5.023 3.846 -8.951 1.00 . A A . 106 HIS ND1 1 1 15 27883 1 1 106 HIS NE2 N -3.387 2.412 -8.963 1.00 . A A . 106 HIS NE2 1 1 15 27884 1 1 106 HIS O O -9.898 1.612 -9.745 1.00 . A A . 106 HIS O 1 1 15 27885 1 1 107 GLU C C -11.410 4.798 -11.367 1.00 . A A . 107 GLU C 1 1 15 27886 1 1 107 GLU CA C -11.366 3.946 -10.096 1.00 . A A . 107 GLU CA 1 1 15 27887 1 1 107 GLU CB C -12.315 4.500 -9.032 1.00 . A A . 107 GLU CB 1 1 15 27888 1 1 107 GLU CD C -13.678 2.457 -8.459 1.00 . A A . 107 GLU CD 1 1 15 27889 1 1 107 GLU CG C -12.619 3.445 -7.966 1.00 . A A . 107 GLU CG 1 1 15 27890 1 1 107 GLU H H -9.590 4.744 -9.356 1.00 . A A . 107 GLU H 1 1 15 27891 1 1 107 GLU HA H -11.650 2.920 -10.329 1.00 . A A . 107 GLU HA 1 1 15 27892 1 1 107 GLU HB2 H -11.870 5.378 -8.564 1.00 . A A . 107 GLU HB2 1 1 15 27893 1 1 107 GLU HB3 H -13.244 4.825 -9.502 1.00 . A A . 107 GLU HB3 1 1 15 27894 1 1 107 GLU HG2 H -11.706 2.908 -7.710 1.00 . A A . 107 GLU HG2 1 1 15 27895 1 1 107 GLU HG3 H -12.967 3.933 -7.056 1.00 . A A . 107 GLU HG3 1 1 15 27896 1 1 107 GLU N N -10.006 3.866 -9.590 1.00 . A A . 107 GLU N 1 1 15 27897 1 1 107 GLU O O -11.675 4.286 -12.453 1.00 . A A . 107 GLU O 1 1 15 27898 1 1 107 GLU OXT O -11.166 6.018 -11.241 1.00 . A A . 107 GLU OXT 1 1 15 27899 1 1 107 GLU OE1 O -13.543 2.013 -9.620 1.00 . A A . 107 GLU OE1 1 1 15 27900 1 1 107 GLU OE2 O -14.598 2.168 -7.664 1.00 . A A . 107 GLU OE2 1 1 15 27901 2 2 1 HEC C1A C -1.096 5.516 9.227 1.00 . B A . 108 HEC C1A 1 1 15 27902 2 2 1 HEC C1B C -1.999 2.367 12.045 1.00 . B A . 108 HEC C1B 1 1 15 27903 2 2 1 HEC C1C C -2.163 -0.493 8.750 1.00 . B A . 108 HEC C1C 1 1 15 27904 2 2 1 HEC C1D C -1.043 2.643 5.997 1.00 . B A . 108 HEC C1D 1 1 15 27905 2 2 1 HEC C2A C -0.988 6.584 10.194 1.00 . B A . 108 HEC C2A 1 1 15 27906 2 2 1 HEC C2B C -2.441 1.472 13.089 1.00 . B A . 108 HEC C2B 1 1 15 27907 2 2 1 HEC C2C C -2.213 -1.562 7.780 1.00 . B A . 108 HEC C2C 1 1 15 27908 2 2 1 HEC C2D C -0.638 3.565 4.962 1.00 . B A . 108 HEC C2D 1 1 15 27909 2 2 1 HEC C3A C -1.196 6.039 11.411 1.00 . B A . 108 HEC C3A 1 1 15 27910 2 2 1 HEC C3B C -2.635 0.264 12.519 1.00 . B A . 108 HEC C3B 1 1 15 27911 2 2 1 HEC C3C C -1.878 -1.030 6.586 1.00 . B A . 108 HEC C3C 1 1 15 27912 2 2 1 HEC C3D C -0.555 4.787 5.529 1.00 . B A . 108 HEC C3D 1 1 15 27913 2 2 1 HEC C4A C -1.435 4.630 11.211 1.00 . B A . 108 HEC C4A 1 1 15 27914 2 2 1 HEC C4B C -2.315 0.398 11.118 1.00 . B A . 108 HEC C4B 1 1 15 27915 2 2 1 HEC C4C C -1.617 0.374 6.804 1.00 . B A . 108 HEC C4C 1 1 15 27916 2 2 1 HEC C4D C -0.909 4.634 6.921 1.00 . B A . 108 HEC C4D 1 1 15 27917 2 2 1 HEC CAA C -0.696 8.018 9.860 1.00 . B A . 108 HEC CAA 1 1 15 27918 2 2 1 HEC CAB C -3.094 -1.004 13.178 1.00 . B A . 108 HEC CAB 1 1 15 27919 2 2 1 HEC CAC C -1.781 -1.725 5.259 1.00 . B A . 108 HEC CAC 1 1 15 27920 2 2 1 HEC CAD C -0.174 6.084 4.877 1.00 . B A . 108 HEC CAD 1 1 15 27921 2 2 1 HEC CBA C 0.792 8.349 9.791 1.00 . B A . 108 HEC CBA 1 1 15 27922 2 2 1 HEC CBB C -4.347 -0.841 14.034 1.00 . B A . 108 HEC CBB 1 1 15 27923 2 2 1 HEC CBC C -2.751 -2.892 5.098 1.00 . B A . 108 HEC CBC 1 1 15 27924 2 2 1 HEC CBD C -0.778 6.283 3.490 1.00 . B A . 108 HEC CBD 1 1 15 27925 2 2 1 HEC CGA C 1.156 9.446 10.782 1.00 . B A . 108 HEC CGA 1 1 15 27926 2 2 1 HEC CGD C 0.300 6.598 2.463 1.00 . B A . 108 HEC CGD 1 1 15 27927 2 2 1 HEC CHA C -0.943 5.686 7.855 1.00 . B A . 108 HEC CHA 1 1 15 27928 2 2 1 HEC CHB C -1.694 3.710 12.243 1.00 . B A . 108 HEC CHB 1 1 15 27929 2 2 1 HEC CHC C -2.391 -0.646 10.179 1.00 . B A . 108 HEC CHC 1 1 15 27930 2 2 1 HEC CHD C -1.236 1.280 5.798 1.00 . B A . 108 HEC CHD 1 1 15 27931 2 2 1 HEC CMA C -1.189 6.728 12.745 1.00 . B A . 108 HEC CMA 1 1 15 27932 2 2 1 HEC CMB C -2.635 1.859 14.526 1.00 . B A . 108 HEC CMB 1 1 15 27933 2 2 1 HEC CMC C -2.576 -2.985 8.089 1.00 . B A . 108 HEC CMC 1 1 15 27934 2 2 1 HEC CMD C -0.369 3.189 3.534 1.00 . B A . 108 HEC CMD 1 1 15 27935 2 2 1 HEC FE FE -1.575 2.505 9.009 1.00 . B A . 108 HEC FE 1 1 15 27936 2 2 1 HEC HAA1 H -1.125 8.259 8.888 1.00 . B A . 108 HEC HAA1 1 1 15 27937 2 2 1 HEC HAA2 H -1.135 8.664 10.621 1.00 . B A . 108 HEC HAA2 1 1 15 27938 2 2 1 HEC HAB H -3.322 -1.748 12.415 1.00 . B A . 108 HEC HAB 1 1 15 27939 2 2 1 HEC HAC H -1.997 -1.015 4.460 1.00 . B A . 108 HEC HAC 1 1 15 27940 2 2 1 HEC HAD1 H -0.512 6.915 5.497 1.00 . B A . 108 HEC HAD1 1 1 15 27941 2 2 1 HEC HAD2 H 0.909 6.131 4.766 1.00 . B A . 108 HEC HAD2 1 1 15 27942 2 2 1 HEC HBA1 H 1.374 7.459 10.027 1.00 . B A . 108 HEC HBA1 1 1 15 27943 2 2 1 HEC HBA2 H 1.041 8.691 8.786 1.00 . B A . 108 HEC HBA2 1 1 15 27944 2 2 1 HEC HBB1 H -4.250 -1.442 14.938 1.00 . B A . 108 HEC HBB1 1 1 15 27945 2 2 1 HEC HBB2 H -4.466 0.208 14.307 1.00 . B A . 108 HEC HBB2 1 1 15 27946 2 2 1 HEC HBB3 H -5.219 -1.170 13.469 1.00 . B A . 108 HEC HBB3 1 1 15 27947 2 2 1 HEC HBC1 H -3.657 -2.693 5.669 1.00 . B A . 108 HEC HBC1 1 1 15 27948 2 2 1 HEC HBC2 H -3.004 -3.011 4.044 1.00 . B A . 108 HEC HBC2 1 1 15 27949 2 2 1 HEC HBC3 H -2.283 -3.806 5.464 1.00 . B A . 108 HEC HBC3 1 1 15 27950 2 2 1 HEC HBD1 H -1.294 5.373 3.184 1.00 . B A . 108 HEC HBD1 1 1 15 27951 2 2 1 HEC HBD2 H -1.486 7.111 3.517 1.00 . B A . 108 HEC HBD2 1 1 15 27952 2 2 1 HEC HHA H -0.841 6.701 7.473 1.00 . B A . 108 HEC HHA 1 1 15 27953 2 2 1 HEC HHB H -1.654 4.080 13.267 1.00 . B A . 108 HEC HHB 1 1 15 27954 2 2 1 HEC HHC H -2.622 -1.643 10.554 1.00 . B A . 108 HEC HHC 1 1 15 27955 2 2 1 HEC HHD H -1.083 0.883 4.795 1.00 . B A . 108 HEC HHD 1 1 15 27956 2 2 1 HEC HMA1 H -1.769 6.143 13.459 1.00 . B A . 108 HEC HMA1 1 1 15 27957 2 2 1 HEC HMA2 H -0.163 6.822 13.100 1.00 . B A . 108 HEC HMA2 1 1 15 27958 2 2 1 HEC HMA3 H -1.630 7.720 12.644 1.00 . B A . 108 HEC HMA3 1 1 15 27959 2 2 1 HEC HMB1 H -3.695 2.018 14.719 1.00 . B A . 108 HEC HMB1 1 1 15 27960 2 2 1 HEC HMB2 H -2.263 1.062 15.170 1.00 . B A . 108 HEC HMB2 1 1 15 27961 2 2 1 HEC HMB3 H -2.086 2.778 14.732 1.00 . B A . 108 HEC HMB3 1 1 15 27962 2 2 1 HEC HMC1 H -2.703 -3.103 9.165 1.00 . B A . 108 HEC HMC1 1 1 15 27963 2 2 1 HEC HMC2 H -3.507 -3.241 7.583 1.00 . B A . 108 HEC HMC2 1 1 15 27964 2 2 1 HEC HMC3 H -1.781 -3.646 7.742 1.00 . B A . 108 HEC HMC3 1 1 15 27965 2 2 1 HEC HMD1 H 0.188 3.989 3.046 1.00 . B A . 108 HEC HMD1 1 1 15 27966 2 2 1 HEC HMD2 H 0.215 2.269 3.504 1.00 . B A . 108 HEC HMD2 1 1 15 27967 2 2 1 HEC HMD3 H -1.315 3.035 3.015 1.00 . B A . 108 HEC HMD3 1 1 15 27968 2 2 1 HEC NA N -1.371 4.319 9.863 1.00 . B A . 108 HEC NA 1 1 15 27969 2 2 1 HEC NB N -1.925 1.696 10.837 1.00 . B A . 108 HEC NB 1 1 15 27970 2 2 1 HEC NC N -1.796 0.693 8.139 1.00 . B A . 108 HEC NC 1 1 15 27971 2 2 1 HEC ND N -1.207 3.312 7.198 1.00 . B A . 108 HEC ND 1 1 15 27972 2 2 1 HEC O1A O 0.568 9.432 11.885 1.00 . B A . 108 HEC O1A 1 1 15 27973 2 2 1 HEC O1D O 0.163 7.650 1.801 1.00 . B A . 108 HEC O1D 1 1 15 27974 2 2 1 HEC O2A O 2.015 10.278 10.417 1.00 . B A . 108 HEC O2A 1 1 15 27975 2 2 1 HEC O2D O 1.241 5.782 2.359 1.00 . B A . 108 HEC O2D 1 1 15 27976 3 2 1 HEC C1A C 9.590 -1.691 1.779 1.00 . C A . 109 HEC C1A 1 1 15 27977 3 2 1 HEC C1B C 5.760 0.035 2.796 1.00 . C A . 109 HEC C1B 1 1 15 27978 3 2 1 HEC C1C C 7.811 3.043 5.245 1.00 . C A . 109 HEC C1C 1 1 15 27979 3 2 1 HEC C1D C 11.611 1.484 3.901 1.00 . C A . 109 HEC C1D 1 1 15 27980 3 2 1 HEC C2A C 9.078 -2.768 0.963 1.00 . C A . 109 HEC C2A 1 1 15 27981 3 2 1 HEC C2B C 4.406 0.424 3.113 1.00 . C A . 109 HEC C2B 1 1 15 27982 3 2 1 HEC C2C C 8.338 4.179 5.965 1.00 . C A . 109 HEC C2C 1 1 15 27983 3 2 1 HEC C2D C 12.958 1.039 3.629 1.00 . C A . 109 HEC C2D 1 1 15 27984 3 2 1 HEC C3A C 7.735 -2.638 0.930 1.00 . C A . 109 HEC C3A 1 1 15 27985 3 2 1 HEC C3B C 4.483 1.466 3.968 1.00 . C A . 109 HEC C3B 1 1 15 27986 3 2 1 HEC C3C C 9.679 4.156 5.814 1.00 . C A . 109 HEC C3C 1 1 15 27987 3 2 1 HEC C3D C 12.862 -0.104 2.918 1.00 . C A . 109 HEC C3D 1 1 15 27988 3 2 1 HEC C4A C 7.401 -1.480 1.725 1.00 . C A . 109 HEC C4A 1 1 15 27989 3 2 1 HEC C4B C 5.885 1.732 4.189 1.00 . C A . 109 HEC C4B 1 1 15 27990 3 2 1 HEC C4C C 9.996 3.007 5.000 1.00 . C A . 109 HEC C4C 1 1 15 27991 3 2 1 HEC C4D C 11.455 -0.378 2.743 1.00 . C A . 109 HEC C4D 1 1 15 27992 3 2 1 HEC CAA C 9.922 -3.815 0.296 1.00 . C A . 109 HEC CAA 1 1 15 27993 3 2 1 HEC CAB C 3.355 2.232 4.595 1.00 . C A . 109 HEC CAB 1 1 15 27994 3 2 1 HEC CAC C 10.688 5.120 6.369 1.00 . C A . 109 HEC CAC 1 1 15 27995 3 2 1 HEC CAD C 13.976 -0.960 2.389 1.00 . C A . 109 HEC CAD 1 1 15 27996 3 2 1 HEC CBA C 10.170 -3.559 -1.188 1.00 . C A . 109 HEC CBA 1 1 15 27997 3 2 1 HEC CBB C 2.279 1.350 5.222 1.00 . C A . 109 HEC CBB 1 1 15 27998 3 2 1 HEC CBC C 10.684 5.214 7.892 1.00 . C A . 109 HEC CBC 1 1 15 27999 3 2 1 HEC CBD C 15.168 -1.080 3.334 1.00 . C A . 109 HEC CBD 1 1 15 28000 3 2 1 HEC CGA C 10.938 -4.710 -1.822 1.00 . C A . 109 HEC CGA 1 1 15 28001 3 2 1 HEC CGD C 16.428 -0.507 2.701 1.00 . C A . 109 HEC CGD 1 1 15 28002 3 2 1 HEC CHA C 10.939 -1.488 2.050 1.00 . C A . 109 HEC CHA 1 1 15 28003 3 2 1 HEC CHB C 6.093 -1.009 1.939 1.00 . C A . 109 HEC CHB 1 1 15 28004 3 2 1 HEC CHC C 6.383 2.748 5.024 1.00 . C A . 109 HEC CHC 1 1 15 28005 3 2 1 HEC CHD C 11.298 2.636 4.616 1.00 . C A . 109 HEC CHD 1 1 15 28006 3 2 1 HEC CMA C 6.740 -3.507 0.218 1.00 . C A . 109 HEC CMA 1 1 15 28007 3 2 1 HEC CMB C 3.173 -0.236 2.569 1.00 . C A . 109 HEC CMB 1 1 15 28008 3 2 1 HEC CMC C 7.510 5.173 6.725 1.00 . C A . 109 HEC CMC 1 1 15 28009 3 2 1 HEC CMD C 14.203 1.748 4.075 1.00 . C A . 109 HEC CMD 1 1 15 28010 3 2 1 HEC FE FE 8.686 0.719 3.428 1.00 . C A . 109 HEC FE 1 1 15 28011 3 2 1 HEC HAA1 H 10.897 -3.860 0.781 1.00 . C A . 109 HEC HAA1 1 1 15 28012 3 2 1 HEC HAA2 H 9.431 -4.784 0.377 1.00 . C A . 109 HEC HAA2 1 1 15 28013 3 2 1 HEC HAB H 3.746 2.873 5.386 1.00 . C A . 109 HEC HAB 1 1 15 28014 3 2 1 HEC HAC H 11.689 4.812 6.067 1.00 . C A . 109 HEC HAC 1 1 15 28015 3 2 1 HEC HAD1 H 13.605 -1.969 2.210 1.00 . C A . 109 HEC HAD1 1 1 15 28016 3 2 1 HEC HAD2 H 14.347 -0.538 1.455 1.00 . C A . 109 HEC HAD2 1 1 15 28017 3 2 1 HEC HBA1 H 9.215 -3.452 -1.703 1.00 . C A . 109 HEC HBA1 1 1 15 28018 3 2 1 HEC HBA2 H 10.751 -2.645 -1.307 1.00 . C A . 109 HEC HBA2 1 1 15 28019 3 2 1 HEC HBB1 H 1.324 1.876 5.208 1.00 . C A . 109 HEC HBB1 1 1 15 28020 3 2 1 HEC HBB2 H 2.191 0.424 4.653 1.00 . C A . 109 HEC HBB2 1 1 15 28021 3 2 1 HEC HBB3 H 2.552 1.119 6.252 1.00 . C A . 109 HEC HBB3 1 1 15 28022 3 2 1 HEC HBC1 H 11.522 5.830 8.220 1.00 . C A . 109 HEC HBC1 1 1 15 28023 3 2 1 HEC HBC2 H 9.750 5.664 8.227 1.00 . C A . 109 HEC HBC2 1 1 15 28024 3 2 1 HEC HBC3 H 10.780 4.215 8.317 1.00 . C A . 109 HEC HBC3 1 1 15 28025 3 2 1 HEC HBD1 H 14.960 -0.533 4.253 1.00 . C A . 109 HEC HBD1 1 1 15 28026 3 2 1 HEC HBD2 H 15.342 -2.130 3.568 1.00 . C A . 109 HEC HBD2 1 1 15 28027 3 2 1 HEC HHA H 11.649 -2.239 1.704 1.00 . C A . 109 HEC HHA 1 1 15 28028 3 2 1 HEC HHB H 5.287 -1.500 1.393 1.00 . C A . 109 HEC HHB 1 1 15 28029 3 2 1 HEC HHC H 5.656 3.358 5.561 1.00 . C A . 109 HEC HHC 1 1 15 28030 3 2 1 HEC HHD H 12.114 3.299 4.901 1.00 . C A . 109 HEC HHD 1 1 15 28031 3 2 1 HEC HMA1 H 6.795 -3.317 -0.854 1.00 . C A . 109 HEC HMA1 1 1 15 28032 3 2 1 HEC HMA2 H 6.966 -4.555 0.414 1.00 . C A . 109 HEC HMA2 1 1 15 28033 3 2 1 HEC HMA3 H 5.736 -3.278 0.576 1.00 . C A . 109 HEC HMA3 1 1 15 28034 3 2 1 HEC HMB1 H 2.330 0.452 2.642 1.00 . C A . 109 HEC HMB1 1 1 15 28035 3 2 1 HEC HMB2 H 3.334 -0.502 1.525 1.00 . C A . 109 HEC HMB2 1 1 15 28036 3 2 1 HEC HMB3 H 2.959 -1.136 3.145 1.00 . C A . 109 HEC HMB3 1 1 15 28037 3 2 1 HEC HMC1 H 6.454 4.922 6.621 1.00 . C A . 109 HEC HMC1 1 1 15 28038 3 2 1 HEC HMC2 H 7.787 5.147 7.779 1.00 . C A . 109 HEC HMC2 1 1 15 28039 3 2 1 HEC HMC3 H 7.687 6.172 6.328 1.00 . C A . 109 HEC HMC3 1 1 15 28040 3 2 1 HEC HMD1 H 15.056 1.376 3.507 1.00 . C A . 109 HEC HMD1 1 1 15 28041 3 2 1 HEC HMD2 H 14.092 2.819 3.904 1.00 . C A . 109 HEC HMD2 1 1 15 28042 3 2 1 HEC HMD3 H 14.366 1.565 5.137 1.00 . C A . 109 HEC HMD3 1 1 15 28043 3 2 1 HEC NA N 8.549 -0.905 2.243 1.00 . C A . 109 HEC NA 1 1 15 28044 3 2 1 HEC NB N 6.662 0.846 3.463 1.00 . C A . 109 HEC NB 1 1 15 28045 3 2 1 HEC NC N 8.840 2.329 4.655 1.00 . C A . 109 HEC NC 1 1 15 28046 3 2 1 HEC ND N 10.694 0.605 3.351 1.00 . C A . 109 HEC ND 1 1 15 28047 3 2 1 HEC O1A O 11.734 -5.333 -1.087 1.00 . C A . 109 HEC O1A 1 1 15 28048 3 2 1 HEC O1D O 16.553 -0.640 1.465 1.00 . C A . 109 HEC O1D 1 1 15 28049 3 2 1 HEC O2A O 10.714 -4.945 -3.029 1.00 . C A . 109 HEC O2A 1 1 15 28050 3 2 1 HEC O2D O 17.243 0.053 3.466 1.00 . C A . 109 HEC O2D 1 1 15 28051 4 2 1 HEC C1A C -8.689 -3.383 0.431 1.00 . D A . 110 HEC C1A 1 1 15 28052 4 2 1 HEC C1B C -5.001 -1.151 0.133 1.00 . D A . 110 HEC C1B 1 1 15 28053 4 2 1 HEC C1C C -2.883 -4.403 2.053 1.00 . D A . 110 HEC C1C 1 1 15 28054 4 2 1 HEC C1D C -6.586 -6.602 2.401 1.00 . D A . 110 HEC C1D 1 1 15 28055 4 2 1 HEC C2A C -9.520 -2.434 -0.271 1.00 . D A . 110 HEC C2A 1 1 15 28056 4 2 1 HEC C2B C -3.847 -0.317 -0.108 1.00 . D A . 110 HEC C2B 1 1 15 28057 4 2 1 HEC C2C C -2.027 -5.418 2.621 1.00 . D A . 110 HEC C2C 1 1 15 28058 4 2 1 HEC C2D C -7.744 -7.423 2.671 1.00 . D A . 110 HEC C2D 1 1 15 28059 4 2 1 HEC C3A C -8.731 -1.397 -0.621 1.00 . D A . 110 HEC C3A 1 1 15 28060 4 2 1 HEC C3B C -2.789 -0.929 0.466 1.00 . D A . 110 HEC C3B 1 1 15 28061 4 2 1 HEC C3C C -2.815 -6.464 2.949 1.00 . D A . 110 HEC C3C 1 1 15 28062 4 2 1 HEC C3D C -8.815 -6.774 2.168 1.00 . D A . 110 HEC C3D 1 1 15 28063 4 2 1 HEC C4A C -7.402 -1.694 -0.140 1.00 . D A . 110 HEC C4A 1 1 15 28064 4 2 1 HEC C4B C -3.277 -2.147 1.067 1.00 . D A . 110 HEC C4B 1 1 15 28065 4 2 1 HEC C4C C -4.167 -6.107 2.586 1.00 . D A . 110 HEC C4C 1 1 15 28066 4 2 1 HEC C4D C -8.332 -5.546 1.582 1.00 . D A . 110 HEC C4D 1 1 15 28067 4 2 1 HEC CAA C -10.987 -2.609 -0.539 1.00 . D A . 110 HEC CAA 1 1 15 28068 4 2 1 HEC CAB C -1.361 -0.468 0.497 1.00 . D A . 110 HEC CAB 1 1 15 28069 4 2 1 HEC CAC C -2.409 -7.768 3.572 1.00 . D A . 110 HEC CAC 1 1 15 28070 4 2 1 HEC CAD C -10.252 -7.208 2.190 1.00 . D A . 110 HEC CAD 1 1 15 28071 4 2 1 HEC CBA C -11.877 -2.312 0.664 1.00 . D A . 110 HEC CBA 1 1 15 28072 4 2 1 HEC CBB C -1.186 0.982 0.941 1.00 . D A . 110 HEC CBB 1 1 15 28073 4 2 1 HEC CBC C -1.105 -7.698 4.361 1.00 . D A . 110 HEC CBC 1 1 15 28074 4 2 1 HEC CBD C -10.855 -7.428 0.805 1.00 . D A . 110 HEC CBD 1 1 15 28075 4 2 1 HEC CGA C -12.856 -3.451 0.916 1.00 . D A . 110 HEC CGA 1 1 15 28076 4 2 1 HEC CGD C -11.583 -8.763 0.731 1.00 . D A . 110 HEC CGD 1 1 15 28077 4 2 1 HEC CHA C -9.147 -4.589 0.951 1.00 . D A . 110 HEC CHA 1 1 15 28078 4 2 1 HEC CHB C -6.286 -0.853 -0.307 1.00 . D A . 110 HEC CHB 1 1 15 28079 4 2 1 HEC CHC C -2.476 -3.069 1.766 1.00 . D A . 110 HEC CHC 1 1 15 28080 4 2 1 HEC CHD C -5.287 -6.937 2.770 1.00 . D A . 110 HEC CHD 1 1 15 28081 4 2 1 HEC CMA C -9.115 -0.153 -1.368 1.00 . D A . 110 HEC CMA 1 1 15 28082 4 2 1 HEC CMB C -3.867 0.981 -0.861 1.00 . D A . 110 HEC CMB 1 1 15 28083 4 2 1 HEC CMC C -0.542 -5.290 2.796 1.00 . D A . 110 HEC CMC 1 1 15 28084 4 2 1 HEC CMD C -7.713 -8.744 3.382 1.00 . D A . 110 HEC CMD 1 1 15 28085 4 2 1 HEC FE FE -5.796 -3.870 1.283 1.00 . D A . 110 HEC FE 1 1 15 28086 4 2 1 HEC HAA1 H -11.293 -1.937 -1.340 1.00 . D A . 110 HEC HAA1 1 1 15 28087 4 2 1 HEC HAA2 H -11.181 -3.640 -0.836 1.00 . D A . 110 HEC HAA2 1 1 15 28088 4 2 1 HEC HAB H -0.794 -1.088 1.192 1.00 . D A . 110 HEC HAB 1 1 15 28089 4 2 1 HEC HAC H -3.186 -8.099 4.261 1.00 . D A . 110 HEC HAC 1 1 15 28090 4 2 1 HEC HAD1 H -10.339 -8.150 2.732 1.00 . D A . 110 HEC HAD1 1 1 15 28091 4 2 1 HEC HAD2 H -10.854 -6.447 2.685 1.00 . D A . 110 HEC HAD2 1 1 15 28092 4 2 1 HEC HBA1 H -11.258 -2.182 1.551 1.00 . D A . 110 HEC HBA1 1 1 15 28093 4 2 1 HEC HBA2 H -12.445 -1.400 0.480 1.00 . D A . 110 HEC HBA2 1 1 15 28094 4 2 1 HEC HBB1 H -2.023 1.270 1.577 1.00 . D A . 110 HEC HBB1 1 1 15 28095 4 2 1 HEC HBB2 H -0.254 1.081 1.498 1.00 . D A . 110 HEC HBB2 1 1 15 28096 4 2 1 HEC HBB3 H -1.156 1.629 0.065 1.00 . D A . 110 HEC HBB3 1 1 15 28097 4 2 1 HEC HBC1 H -0.939 -8.647 4.872 1.00 . D A . 110 HEC HBC1 1 1 15 28098 4 2 1 HEC HBC2 H -0.277 -7.502 3.680 1.00 . D A . 110 HEC HBC2 1 1 15 28099 4 2 1 HEC HBC3 H -1.168 -6.896 5.097 1.00 . D A . 110 HEC HBC3 1 1 15 28100 4 2 1 HEC HBD1 H -11.566 -6.631 0.588 1.00 . D A . 110 HEC HBD1 1 1 15 28101 4 2 1 HEC HBD2 H -10.062 -7.422 0.058 1.00 . D A . 110 HEC HBD2 1 1 15 28102 4 2 1 HEC HHA H -10.211 -4.812 0.866 1.00 . D A . 110 HEC HHA 1 1 15 28103 4 2 1 HEC HHB H -6.445 0.097 -0.817 1.00 . D A . 110 HEC HHB 1 1 15 28104 4 2 1 HEC HHC H -1.488 -2.736 2.083 1.00 . D A . 110 HEC HHC 1 1 15 28105 4 2 1 HEC HHD H -5.122 -7.910 3.234 1.00 . D A . 110 HEC HHD 1 1 15 28106 4 2 1 HEC HMA1 H -10.201 -0.055 -1.377 1.00 . D A . 110 HEC HMA1 1 1 15 28107 4 2 1 HEC HMA2 H -8.677 0.716 -0.877 1.00 . D A . 110 HEC HMA2 1 1 15 28108 4 2 1 HEC HMA3 H -8.748 -0.216 -2.392 1.00 . D A . 110 HEC HMA3 1 1 15 28109 4 2 1 HEC HMB1 H -3.506 0.817 -1.876 1.00 . D A . 110 HEC HMB1 1 1 15 28110 4 2 1 HEC HMB2 H -4.887 1.365 -0.896 1.00 . D A . 110 HEC HMB2 1 1 15 28111 4 2 1 HEC HMB3 H -3.224 1.703 -0.358 1.00 . D A . 110 HEC HMB3 1 1 15 28112 4 2 1 HEC HMC1 H -0.229 -4.283 2.519 1.00 . D A . 110 HEC HMC1 1 1 15 28113 4 2 1 HEC HMC2 H -0.281 -5.478 3.837 1.00 . D A . 110 HEC HMC2 1 1 15 28114 4 2 1 HEC HMC3 H -0.037 -6.015 2.158 1.00 . D A . 110 HEC HMC3 1 1 15 28115 4 2 1 HEC HMD1 H -8.642 -9.281 3.191 1.00 . D A . 110 HEC HMD1 1 1 15 28116 4 2 1 HEC HMD2 H -6.872 -9.333 3.017 1.00 . D A . 110 HEC HMD2 1 1 15 28117 4 2 1 HEC HMD3 H -7.602 -8.578 4.453 1.00 . D A . 110 HEC HMD3 1 1 15 28118 4 2 1 HEC NA N -7.388 -2.918 0.506 1.00 . D A . 110 HEC NA 1 1 15 28119 4 2 1 HEC NB N -4.640 -2.274 0.857 1.00 . D A . 110 HEC NB 1 1 15 28120 4 2 1 HEC NC N -4.197 -4.837 2.036 1.00 . D A . 110 HEC NC 1 1 15 28121 4 2 1 HEC ND N -6.959 -5.451 1.731 1.00 . D A . 110 HEC ND 1 1 15 28122 4 2 1 HEC O1A O -12.403 -4.614 0.848 1.00 . D A . 110 HEC O1A 1 1 15 28123 4 2 1 HEC O1D O -12.832 -8.732 0.778 1.00 . D A . 110 HEC O1D 1 1 15 28124 4 2 1 HEC O2A O -14.038 -3.137 1.173 1.00 . D A . 110 HEC O2A 1 1 15 28125 4 2 1 HEC O2D O -10.878 -9.790 0.628 1.00 . D A . 110 HEC O2D 1 1 15 28126 5 2 1 HEC C1A C -0.138 4.094 -9.209 1.00 . E A . 111 HEC C1A 1 1 15 28127 5 2 1 HEC C1B C -1.385 0.621 -11.461 1.00 . E A . 111 HEC C1B 1 1 15 28128 5 2 1 HEC C1C C -3.220 -1.023 -7.875 1.00 . E A . 111 HEC C1C 1 1 15 28129 5 2 1 HEC C1D C -1.943 2.450 -5.644 1.00 . E A . 111 HEC C1D 1 1 15 28130 5 2 1 HEC C2A C 0.517 4.775 -10.302 1.00 . E A . 111 HEC C2A 1 1 15 28131 5 2 1 HEC C2B C -1.525 -0.544 -12.302 1.00 . E A . 111 HEC C2B 1 1 15 28132 5 2 1 HEC C2C C -3.966 -1.647 -6.808 1.00 . E A . 111 HEC C2C 1 1 15 28133 5 2 1 HEC C2D C -1.464 3.459 -4.730 1.00 . E A . 111 HEC C2D 1 1 15 28134 5 2 1 HEC C3A C 0.346 4.014 -11.403 1.00 . E A . 111 HEC C3A 1 1 15 28135 5 2 1 HEC C3B C -2.130 -1.497 -11.563 1.00 . E A . 111 HEC C3B 1 1 15 28136 5 2 1 HEC C3C C -3.863 -0.844 -5.728 1.00 . E A . 111 HEC C3C 1 1 15 28137 5 2 1 HEC C3D C -0.761 4.353 -5.458 1.00 . E A . 111 HEC C3D 1 1 15 28138 5 2 1 HEC C4A C -0.417 2.854 -11.004 1.00 . E A . 111 HEC C4A 1 1 15 28139 5 2 1 HEC C4B C -2.371 -0.932 -10.256 1.00 . E A . 111 HEC C4B 1 1 15 28140 5 2 1 HEC C4C C -3.052 0.287 -6.117 1.00 . E A . 111 HEC C4C 1 1 15 28141 5 2 1 HEC C4D C -0.799 3.905 -6.830 1.00 . E A . 111 HEC C4D 1 1 15 28142 5 2 1 HEC CAA C 1.242 6.084 -10.187 1.00 . E A . 111 HEC CAA 1 1 15 28143 5 2 1 HEC CAB C -2.501 -2.891 -11.977 1.00 . E A . 111 HEC CAB 1 1 15 28144 5 2 1 HEC CAC C -4.459 -1.045 -4.366 1.00 . E A . 111 HEC CAC 1 1 15 28145 5 2 1 HEC CAD C -0.058 5.589 -4.976 1.00 . E A . 111 HEC CAD 1 1 15 28146 5 2 1 HEC CBA C 2.646 6.071 -10.783 1.00 . E A . 111 HEC CBA 1 1 15 28147 5 2 1 HEC CBB C -1.460 -3.945 -11.612 1.00 . E A . 111 HEC CBB 1 1 15 28148 5 2 1 HEC CBC C -4.277 -2.455 -3.811 1.00 . E A . 111 HEC CBC 1 1 15 28149 5 2 1 HEC CBD C -0.999 6.712 -4.550 1.00 . E A . 111 HEC CBD 1 1 15 28150 5 2 1 HEC CGA C 3.080 7.470 -11.196 1.00 . E A . 111 HEC CGA 1 1 15 28151 5 2 1 HEC CGD C -0.266 8.043 -4.477 1.00 . E A . 111 HEC CGD 1 1 15 28152 5 2 1 HEC CHA C -0.179 4.571 -7.904 1.00 . E A . 111 HEC CHA 1 1 15 28153 5 2 1 HEC CHB C -0.803 1.817 -11.871 1.00 . E A . 111 HEC CHB 1 1 15 28154 5 2 1 HEC CHC C -2.987 -1.615 -9.193 1.00 . E A . 111 HEC CHC 1 1 15 28155 5 2 1 HEC CHD C -2.712 1.354 -5.266 1.00 . E A . 111 HEC CHD 1 1 15 28156 5 2 1 HEC CMA C 0.836 4.281 -12.797 1.00 . E A . 111 HEC CMA 1 1 15 28157 5 2 1 HEC CMB C -1.068 -0.633 -13.729 1.00 . E A . 111 HEC CMB 1 1 15 28158 5 2 1 HEC CMC C -4.703 -2.950 -6.923 1.00 . E A . 111 HEC CMC 1 1 15 28159 5 2 1 HEC CMD C -1.723 3.472 -3.251 1.00 . E A . 111 HEC CMD 1 1 15 28160 5 2 1 HEC FE FE -1.702 1.546 -8.557 1.00 . E A . 111 HEC FE 1 1 15 28161 5 2 1 HEC HAA1 H 0.678 6.858 -10.708 1.00 . E A . 111 HEC HAA1 1 1 15 28162 5 2 1 HEC HAA2 H 1.341 6.354 -9.135 1.00 . E A . 111 HEC HAA2 1 1 15 28163 5 2 1 HEC HAB H -3.434 -3.178 -11.491 1.00 . E A . 111 HEC HAB 1 1 15 28164 5 2 1 HEC HAC H -3.992 -0.358 -3.660 1.00 . E A . 111 HEC HAC 1 1 15 28165 5 2 1 HEC HAD1 H 0.560 5.342 -4.113 1.00 . E A . 111 HEC HAD1 1 1 15 28166 5 2 1 HEC HAD2 H 0.572 5.982 -5.774 1.00 . E A . 111 HEC HAD2 1 1 15 28167 5 2 1 HEC HBA1 H 3.351 5.692 -10.043 1.00 . E A . 111 HEC HBA1 1 1 15 28168 5 2 1 HEC HBA2 H 2.662 5.427 -11.662 1.00 . E A . 111 HEC HBA2 1 1 15 28169 5 2 1 HEC HBB1 H -1.099 -4.429 -12.519 1.00 . E A . 111 HEC HBB1 1 1 15 28170 5 2 1 HEC HBB2 H -0.626 -3.469 -11.097 1.00 . E A . 111 HEC HBB2 1 1 15 28171 5 2 1 HEC HBB3 H -1.912 -4.691 -10.958 1.00 . E A . 111 HEC HBB3 1 1 15 28172 5 2 1 HEC HBC1 H -5.123 -3.074 -4.108 1.00 . E A . 111 HEC HBC1 1 1 15 28173 5 2 1 HEC HBC2 H -3.356 -2.884 -4.205 1.00 . E A . 111 HEC HBC2 1 1 15 28174 5 2 1 HEC HBC3 H -4.221 -2.412 -2.723 1.00 . E A . 111 HEC HBC3 1 1 15 28175 5 2 1 HEC HBD1 H -1.811 6.800 -5.272 1.00 . E A . 111 HEC HBD1 1 1 15 28176 5 2 1 HEC HBD2 H -1.412 6.486 -3.566 1.00 . E A . 111 HEC HBD2 1 1 15 28177 5 2 1 HEC HHA H 0.301 5.527 -7.693 1.00 . E A . 111 HEC HHA 1 1 15 28178 5 2 1 HEC HHB H -0.634 1.964 -12.938 1.00 . E A . 111 HEC HHB 1 1 15 28179 5 2 1 HEC HHC H -3.309 -2.641 -9.373 1.00 . E A . 111 HEC HHC 1 1 15 28180 5 2 1 HEC HHD H -3.078 1.316 -4.240 1.00 . E A . 111 HEC HHD 1 1 15 28181 5 2 1 HEC HMA1 H 1.893 4.022 -12.866 1.00 . E A . 111 HEC HMA1 1 1 15 28182 5 2 1 HEC HMA2 H 0.267 3.678 -13.504 1.00 . E A . 111 HEC HMA2 1 1 15 28183 5 2 1 HEC HMA3 H 0.705 5.338 -13.031 1.00 . E A . 111 HEC HMA3 1 1 15 28184 5 2 1 HEC HMB1 H -0.105 -0.132 -13.835 1.00 . E A . 111 HEC HMB1 1 1 15 28185 5 2 1 HEC HMB2 H -0.965 -1.680 -14.013 1.00 . E A . 111 HEC HMB2 1 1 15 28186 5 2 1 HEC HMB3 H -1.801 -0.151 -14.377 1.00 . E A . 111 HEC HMB3 1 1 15 28187 5 2 1 HEC HMC1 H -5.757 -2.793 -6.692 1.00 . E A . 111 HEC HMC1 1 1 15 28188 5 2 1 HEC HMC2 H -4.608 -3.332 -7.939 1.00 . E A . 111 HEC HMC2 1 1 15 28189 5 2 1 HEC HMC3 H -4.281 -3.670 -6.222 1.00 . E A . 111 HEC HMC3 1 1 15 28190 5 2 1 HEC HMD1 H -2.797 3.444 -3.071 1.00 . E A . 111 HEC HMD1 1 1 15 28191 5 2 1 HEC HMD2 H -1.255 2.601 -2.793 1.00 . E A . 111 HEC HMD2 1 1 15 28192 5 2 1 HEC HMD3 H -1.304 4.380 -2.817 1.00 . E A . 111 HEC HMD3 1 1 15 28193 5 2 1 HEC NA N -0.709 2.914 -9.652 1.00 . E A . 111 HEC NA 1 1 15 28194 5 2 1 HEC NB N -1.908 0.372 -10.204 1.00 . E A . 111 HEC NB 1 1 15 28195 5 2 1 HEC NC N -2.662 0.166 -7.439 1.00 . E A . 111 HEC NC 1 1 15 28196 5 2 1 HEC ND N -1.528 2.734 -6.934 1.00 . E A . 111 HEC ND 1 1 15 28197 5 2 1 HEC O1A O 2.197 8.224 -11.658 1.00 . E A . 111 HEC O1A 1 1 15 28198 5 2 1 HEC O1D O 0.344 8.298 -3.416 1.00 . E A . 111 HEC O1D 1 1 15 28199 5 2 1 HEC O2A O 4.286 7.760 -11.042 1.00 . E A . 111 HEC O2A 1 1 15 28200 5 2 1 HEC O2D O -0.329 8.782 -5.483 1.00 . E A . 111 HEC O2D 1 1 16 28201 1 1 1 ALA C C -2.243 5.713 20.786 1.00 . A A . 1 ALA C 1 1 16 28202 1 1 1 ALA CA C -1.499 4.747 21.711 1.00 . A A . 1 ALA CA 1 1 16 28203 1 1 1 ALA CB C -1.651 3.289 21.274 1.00 . A A . 1 ALA CB 1 1 16 28204 1 1 1 ALA H1 H -1.495 4.273 23.685 1.00 . A A . 1 ALA H1 1 1 16 28205 1 1 1 ALA H2 H -1.857 5.859 23.372 1.00 . A A . 1 ALA H2 1 1 16 28206 1 1 1 ALA HA H -0.440 5.004 21.715 1.00 . A A . 1 ALA HA 1 1 16 28207 1 1 1 ALA HB1 H -2.500 2.841 21.790 1.00 . A A . 1 ALA HB1 1 1 16 28208 1 1 1 ALA HB2 H -1.817 3.247 20.198 1.00 . A A . 1 ALA HB2 1 1 16 28209 1 1 1 ALA HB3 H -0.743 2.738 21.524 1.00 . A A . 1 ALA HB3 1 1 16 28210 1 1 1 ALA N N -1.997 4.902 23.067 1.00 . A A . 1 ALA N 1 1 16 28211 1 1 1 ALA O O -3.343 6.160 21.106 1.00 . A A . 1 ALA O 1 1 16 28212 1 1 2 PRO C C -3.316 6.234 17.886 1.00 . A A . 2 PRO C 1 1 16 28213 1 1 2 PRO CA C -2.184 6.918 18.656 1.00 . A A . 2 PRO CA 1 1 16 28214 1 1 2 PRO CB C -1.029 7.340 17.763 1.00 . A A . 2 PRO CB 1 1 16 28215 1 1 2 PRO CD C -0.292 5.502 19.217 1.00 . A A . 2 PRO CD 1 1 16 28216 1 1 2 PRO CG C 0.063 6.305 17.976 1.00 . A A . 2 PRO CG 1 1 16 28217 1 1 2 PRO HA H -2.602 7.701 19.117 1.00 . A A . 2 PRO HA 1 1 16 28218 1 1 2 PRO HB2 H -1.336 7.375 16.717 1.00 . A A . 2 PRO HB2 1 1 16 28219 1 1 2 PRO HB3 H -0.678 8.339 18.024 1.00 . A A . 2 PRO HB3 1 1 16 28220 1 1 2 PRO HD2 H -0.336 4.435 18.999 1.00 . A A . 2 PRO HD2 1 1 16 28221 1 1 2 PRO HD3 H 0.452 5.637 20.002 1.00 . A A . 2 PRO HD3 1 1 16 28222 1 1 2 PRO HG2 H 0.144 5.651 17.108 1.00 . A A . 2 PRO HG2 1 1 16 28223 1 1 2 PRO HG3 H 1.031 6.791 18.100 1.00 . A A . 2 PRO HG3 1 1 16 28224 1 1 2 PRO N N -1.596 6.014 19.629 1.00 . A A . 2 PRO N 1 1 16 28225 1 1 2 PRO O O -4.134 6.902 17.254 1.00 . A A . 2 PRO O 1 1 16 28226 1 1 3 LYS C C -4.335 4.477 15.792 1.00 . A A . 3 LYS C 1 1 16 28227 1 1 3 LYS CA C -4.345 4.131 17.282 1.00 . A A . 3 LYS CA 1 1 16 28228 1 1 3 LYS CB C -5.708 4.326 17.949 1.00 . A A . 3 LYS CB 1 1 16 28229 1 1 3 LYS CD C -6.519 1.941 17.842 1.00 . A A . 3 LYS CD 1 1 16 28230 1 1 3 LYS CE C -7.203 0.826 18.635 1.00 . A A . 3 LYS CE 1 1 16 28231 1 1 3 LYS CG C -6.103 3.092 18.761 1.00 . A A . 3 LYS CG 1 1 16 28232 1 1 3 LYS H H -2.658 4.377 18.480 1.00 . A A . 3 LYS H 1 1 16 28233 1 1 3 LYS HA H -4.079 3.079 17.394 1.00 . A A . 3 LYS HA 1 1 16 28234 1 1 3 LYS HB2 H -5.676 5.200 18.601 1.00 . A A . 3 LYS HB2 1 1 16 28235 1 1 3 LYS HB3 H -6.464 4.524 17.190 1.00 . A A . 3 LYS HB3 1 1 16 28236 1 1 3 LYS HD2 H -7.197 2.313 17.073 1.00 . A A . 3 LYS HD2 1 1 16 28237 1 1 3 LYS HD3 H -5.643 1.544 17.330 1.00 . A A . 3 LYS HD3 1 1 16 28238 1 1 3 LYS HE2 H -6.470 0.069 18.916 1.00 . A A . 3 LYS HE2 1 1 16 28239 1 1 3 LYS HE3 H -7.615 1.229 19.560 1.00 . A A . 3 LYS HE3 1 1 16 28240 1 1 3 LYS HG2 H -5.266 2.779 19.385 1.00 . A A . 3 LYS HG2 1 1 16 28241 1 1 3 LYS HG3 H -6.925 3.341 19.433 1.00 . A A . 3 LYS HG3 1 1 16 28242 1 1 3 LYS HZ1 H -8.996 0.877 17.575 1.00 . A A . 3 LYS HZ1 1 1 16 28243 1 1 3 LYS HZ2 H -7.930 -0.197 16.972 1.00 . A A . 3 LYS HZ2 1 1 16 28244 1 1 3 LYS N N -3.327 4.912 17.964 1.00 . A A . 3 LYS N 1 1 16 28245 1 1 3 LYS NZ N -8.281 0.205 17.834 1.00 . A A . 3 LYS NZ 1 1 16 28246 1 1 3 LYS O O -3.556 5.323 15.353 1.00 . A A . 3 LYS O 1 1 16 28247 1 1 4 ALA C C -5.958 5.396 13.371 1.00 . A A . 4 ALA C 1 1 16 28248 1 1 4 ALA CA C -5.309 4.033 13.623 1.00 . A A . 4 ALA CA 1 1 16 28249 1 1 4 ALA CB C -6.092 2.887 12.979 1.00 . A A . 4 ALA CB 1 1 16 28250 1 1 4 ALA H H -5.838 3.121 15.420 1.00 . A A . 4 ALA H 1 1 16 28251 1 1 4 ALA HA H -4.298 4.040 13.216 1.00 . A A . 4 ALA HA 1 1 16 28252 1 1 4 ALA HB1 H -5.992 1.990 13.590 1.00 . A A . 4 ALA HB1 1 1 16 28253 1 1 4 ALA HB2 H -7.144 3.162 12.905 1.00 . A A . 4 ALA HB2 1 1 16 28254 1 1 4 ALA HB3 H -5.696 2.693 11.982 1.00 . A A . 4 ALA HB3 1 1 16 28255 1 1 4 ALA N N -5.208 3.807 15.055 1.00 . A A . 4 ALA N 1 1 16 28256 1 1 4 ALA O O -6.796 5.843 14.152 1.00 . A A . 4 ALA O 1 1 16 28257 1 1 5 PRO C C -7.481 7.215 11.320 1.00 . A A . 5 PRO C 1 1 16 28258 1 1 5 PRO CA C -6.064 7.338 11.883 1.00 . A A . 5 PRO CA 1 1 16 28259 1 1 5 PRO CB C -5.072 7.899 10.877 1.00 . A A . 5 PRO CB 1 1 16 28260 1 1 5 PRO CD C -4.543 5.536 11.299 1.00 . A A . 5 PRO CD 1 1 16 28261 1 1 5 PRO CG C -4.277 6.708 10.367 1.00 . A A . 5 PRO CG 1 1 16 28262 1 1 5 PRO HA H -6.141 7.920 12.692 1.00 . A A . 5 PRO HA 1 1 16 28263 1 1 5 PRO HB2 H -5.587 8.403 10.060 1.00 . A A . 5 PRO HB2 1 1 16 28264 1 1 5 PRO HB3 H -4.417 8.635 11.343 1.00 . A A . 5 PRO HB3 1 1 16 28265 1 1 5 PRO HD2 H -4.918 4.672 10.752 1.00 . A A . 5 PRO HD2 1 1 16 28266 1 1 5 PRO HD3 H -3.632 5.221 11.807 1.00 . A A . 5 PRO HD3 1 1 16 28267 1 1 5 PRO HG2 H -4.574 6.459 9.348 1.00 . A A . 5 PRO HG2 1 1 16 28268 1 1 5 PRO HG3 H -3.213 6.942 10.342 1.00 . A A . 5 PRO HG3 1 1 16 28269 1 1 5 PRO N N -5.534 6.035 12.248 1.00 . A A . 5 PRO N 1 1 16 28270 1 1 5 PRO O O -7.941 6.114 11.021 1.00 . A A . 5 PRO O 1 1 16 28271 1 1 6 ALA C C -9.495 7.861 9.238 1.00 . A A . 6 ALA C 1 1 16 28272 1 1 6 ALA CA C -9.491 8.395 10.672 1.00 . A A . 6 ALA CA 1 1 16 28273 1 1 6 ALA CB C -10.037 9.821 10.765 1.00 . A A . 6 ALA CB 1 1 16 28274 1 1 6 ALA H H -7.754 9.252 11.439 1.00 . A A . 6 ALA H 1 1 16 28275 1 1 6 ALA HA H -10.103 7.743 11.295 1.00 . A A . 6 ALA HA 1 1 16 28276 1 1 6 ALA HB1 H -9.615 10.316 11.639 1.00 . A A . 6 ALA HB1 1 1 16 28277 1 1 6 ALA HB2 H -9.763 10.375 9.867 1.00 . A A . 6 ALA HB2 1 1 16 28278 1 1 6 ALA HB3 H -11.123 9.789 10.854 1.00 . A A . 6 ALA HB3 1 1 16 28279 1 1 6 ALA N N -8.135 8.361 11.193 1.00 . A A . 6 ALA N 1 1 16 28280 1 1 6 ALA O O -8.437 7.672 8.639 1.00 . A A . 6 ALA O 1 1 16 28281 1 1 7 ASP C C -10.783 8.289 6.387 1.00 . A A . 7 ASP C 1 1 16 28282 1 1 7 ASP CA C -10.853 7.124 7.377 1.00 . A A . 7 ASP CA 1 1 16 28283 1 1 7 ASP CB C -12.207 6.434 7.201 1.00 . A A . 7 ASP CB 1 1 16 28284 1 1 7 ASP CG C -12.402 5.169 8.039 1.00 . A A . 7 ASP CG 1 1 16 28285 1 1 7 ASP H H -11.552 7.790 9.223 1.00 . A A . 7 ASP H 1 1 16 28286 1 1 7 ASP HA H -10.037 6.414 7.243 1.00 . A A . 7 ASP HA 1 1 16 28287 1 1 7 ASP HB2 H -12.995 7.144 7.453 1.00 . A A . 7 ASP HB2 1 1 16 28288 1 1 7 ASP HB3 H -12.333 6.178 6.149 1.00 . A A . 7 ASP HB3 1 1 16 28289 1 1 7 ASP N N -10.697 7.633 8.729 1.00 . A A . 7 ASP N 1 1 16 28290 1 1 7 ASP O O -10.868 9.451 6.783 1.00 . A A . 7 ASP O 1 1 16 28291 1 1 7 ASP OD1 O -11.471 4.335 8.032 1.00 . A A . 7 ASP OD1 1 1 16 28292 1 1 7 ASP OD2 O -13.477 5.065 8.667 1.00 . A A . 7 ASP OD2 1 1 16 28293 1 1 8 GLY C C -9.096 9.350 3.816 1.00 . A A . 8 GLY C 1 1 16 28294 1 1 8 GLY CA C -10.548 8.939 4.070 1.00 . A A . 8 GLY CA 1 1 16 28295 1 1 8 GLY H H -10.563 6.991 4.805 1.00 . A A . 8 GLY H 1 1 16 28296 1 1 8 GLY HA2 H -10.984 8.546 3.151 1.00 . A A . 8 GLY HA2 1 1 16 28297 1 1 8 GLY HA3 H -11.133 9.815 4.351 1.00 . A A . 8 GLY HA3 1 1 16 28298 1 1 8 GLY N N -10.630 7.938 5.119 1.00 . A A . 8 GLY N 1 1 16 28299 1 1 8 GLY O O -8.837 10.403 3.236 1.00 . A A . 8 GLY O 1 1 16 28300 1 1 9 LEU C C -6.381 8.518 2.632 1.00 . A A . 9 LEU C 1 1 16 28301 1 1 9 LEU CA C -6.767 8.758 4.093 1.00 . A A . 9 LEU CA 1 1 16 28302 1 1 9 LEU CB C -5.948 7.935 5.089 1.00 . A A . 9 LEU CB 1 1 16 28303 1 1 9 LEU CD1 C -3.993 6.740 4.036 1.00 . A A . 9 LEU CD1 1 1 16 28304 1 1 9 LEU CD2 C -3.968 9.266 4.270 1.00 . A A . 9 LEU CD2 1 1 16 28305 1 1 9 LEU CG C -4.432 7.940 4.877 1.00 . A A . 9 LEU CG 1 1 16 28306 1 1 9 LEU H H -8.405 7.642 4.734 1.00 . A A . 9 LEU H 1 1 16 28307 1 1 9 LEU HA H -6.598 9.809 4.327 1.00 . A A . 9 LEU HA 1 1 16 28308 1 1 9 LEU HB2 H -6.155 8.305 6.093 1.00 . A A . 9 LEU HB2 1 1 16 28309 1 1 9 LEU HB3 H -6.296 6.903 5.051 1.00 . A A . 9 LEU HB3 1 1 16 28310 1 1 9 LEU HD11 H -4.748 5.957 4.097 1.00 . A A . 9 LEU HD11 1 1 16 28311 1 1 9 LEU HD12 H -3.872 7.049 2.997 1.00 . A A . 9 LEU HD12 1 1 16 28312 1 1 9 LEU HD13 H -3.044 6.360 4.414 1.00 . A A . 9 LEU HD13 1 1 16 28313 1 1 9 LEU HD21 H -4.527 10.087 4.720 1.00 . A A . 9 LEU HD21 1 1 16 28314 1 1 9 LEU HD22 H -2.904 9.401 4.463 1.00 . A A . 9 LEU HD22 1 1 16 28315 1 1 9 LEU HD23 H -4.144 9.255 3.194 1.00 . A A . 9 LEU HD23 1 1 16 28316 1 1 9 LEU HG H -3.951 7.845 5.850 1.00 . A A . 9 LEU HG 1 1 16 28317 1 1 9 LEU N N -8.186 8.497 4.264 1.00 . A A . 9 LEU N 1 1 16 28318 1 1 9 LEU O O -6.063 7.393 2.247 1.00 . A A . 9 LEU O 1 1 16 28319 1 1 10 LYS C C -4.578 9.749 0.277 1.00 . A A . 10 LYS C 1 1 16 28320 1 1 10 LYS CA C -6.080 9.512 0.448 1.00 . A A . 10 LYS CA 1 1 16 28321 1 1 10 LYS CB C -6.951 10.469 -0.369 1.00 . A A . 10 LYS CB 1 1 16 28322 1 1 10 LYS CD C -7.381 11.452 -2.651 1.00 . A A . 10 LYS CD 1 1 16 28323 1 1 10 LYS CE C -7.046 12.909 -2.327 1.00 . A A . 10 LYS CE 1 1 16 28324 1 1 10 LYS CG C -6.511 10.495 -1.834 1.00 . A A . 10 LYS CG 1 1 16 28325 1 1 10 LYS H H -6.681 10.503 2.179 1.00 . A A . 10 LYS H 1 1 16 28326 1 1 10 LYS HA H -6.311 8.501 0.113 1.00 . A A . 10 LYS HA 1 1 16 28327 1 1 10 LYS HB2 H -7.995 10.163 -0.304 1.00 . A A . 10 LYS HB2 1 1 16 28328 1 1 10 LYS HB3 H -6.887 11.473 0.051 1.00 . A A . 10 LYS HB3 1 1 16 28329 1 1 10 LYS HD2 H -7.230 11.268 -3.715 1.00 . A A . 10 LYS HD2 1 1 16 28330 1 1 10 LYS HD3 H -8.434 11.262 -2.441 1.00 . A A . 10 LYS HD3 1 1 16 28331 1 1 10 LYS HE2 H -6.137 12.955 -1.728 1.00 . A A . 10 LYS HE2 1 1 16 28332 1 1 10 LYS HE3 H -6.847 13.457 -3.249 1.00 . A A . 10 LYS HE3 1 1 16 28333 1 1 10 LYS HG2 H -5.467 10.801 -1.899 1.00 . A A . 10 LYS HG2 1 1 16 28334 1 1 10 LYS HG3 H -6.575 9.491 -2.254 1.00 . A A . 10 LYS HG3 1 1 16 28335 1 1 10 LYS HZ1 H -7.972 14.521 -1.386 1.00 . A A . 10 LYS HZ1 1 1 16 28336 1 1 10 LYS HZ2 H -9.026 13.525 -2.125 1.00 . A A . 10 LYS HZ2 1 1 16 28337 1 1 10 LYS N N -6.422 9.592 1.858 1.00 . A A . 10 LYS N 1 1 16 28338 1 1 10 LYS NZ N -8.162 13.548 -1.595 1.00 . A A . 10 LYS NZ 1 1 16 28339 1 1 10 LYS O O -3.988 10.555 0.995 1.00 . A A . 10 LYS O 1 1 16 28340 1 1 11 MET C C -2.340 9.808 -2.314 1.00 . A A . 11 MET C 1 1 16 28341 1 1 11 MET CA C -2.582 9.155 -0.952 1.00 . A A . 11 MET CA 1 1 16 28342 1 1 11 MET CB C -1.937 7.768 -0.929 1.00 . A A . 11 MET CB 1 1 16 28343 1 1 11 MET CE C -0.468 5.056 0.010 1.00 . A A . 11 MET CE 1 1 16 28344 1 1 11 MET CG C -2.407 6.964 0.285 1.00 . A A . 11 MET CG 1 1 16 28345 1 1 11 MET H H -4.491 8.380 -1.257 1.00 . A A . 11 MET H 1 1 16 28346 1 1 11 MET HA H -2.185 9.790 -0.160 1.00 . A A . 11 MET HA 1 1 16 28347 1 1 11 MET HB2 H -2.187 7.231 -1.844 1.00 . A A . 11 MET HB2 1 1 16 28348 1 1 11 MET HB3 H -0.851 7.868 -0.904 1.00 . A A . 11 MET HB3 1 1 16 28349 1 1 11 MET HE1 H -0.012 6.045 -0.030 1.00 . A A . 11 MET HE1 1 1 16 28350 1 1 11 MET HE2 H -0.174 4.557 0.935 1.00 . A A . 11 MET HE2 1 1 16 28351 1 1 11 MET HE3 H -0.132 4.466 -0.843 1.00 . A A . 11 MET HE3 1 1 16 28352 1 1 11 MET HG2 H -1.820 7.235 1.161 1.00 . A A . 11 MET HG2 1 1 16 28353 1 1 11 MET HG3 H -3.446 7.205 0.510 1.00 . A A . 11 MET HG3 1 1 16 28354 1 1 11 MET N N -4.003 9.033 -0.678 1.00 . A A . 11 MET N 1 1 16 28355 1 1 11 MET O O -2.362 9.134 -3.342 1.00 . A A . 11 MET O 1 1 16 28356 1 1 11 MET SD S -2.245 5.216 -0.040 1.00 . A A . 11 MET SD 1 1 16 28357 1 1 12 GLU C C -0.386 12.220 -3.611 1.00 . A A . 12 GLU C 1 1 16 28358 1 1 12 GLU CA C -1.870 11.866 -3.495 1.00 . A A . 12 GLU CA 1 1 16 28359 1 1 12 GLU CB C -2.740 13.123 -3.547 1.00 . A A . 12 GLU CB 1 1 16 28360 1 1 12 GLU CD C -1.600 14.967 -4.837 1.00 . A A . 12 GLU CD 1 1 16 28361 1 1 12 GLU CG C -2.613 13.822 -4.903 1.00 . A A . 12 GLU CG 1 1 16 28362 1 1 12 GLU H H -2.099 11.654 -1.436 1.00 . A A . 12 GLU H 1 1 16 28363 1 1 12 GLU HA H -2.156 11.200 -4.309 1.00 . A A . 12 GLU HA 1 1 16 28364 1 1 12 GLU HB2 H -3.781 12.858 -3.367 1.00 . A A . 12 GLU HB2 1 1 16 28365 1 1 12 GLU HB3 H -2.443 13.808 -2.753 1.00 . A A . 12 GLU HB3 1 1 16 28366 1 1 12 GLU HG2 H -2.304 13.101 -5.660 1.00 . A A . 12 GLU HG2 1 1 16 28367 1 1 12 GLU HG3 H -3.585 14.208 -5.209 1.00 . A A . 12 GLU HG3 1 1 16 28368 1 1 12 GLU N N -2.115 11.113 -2.277 1.00 . A A . 12 GLU N 1 1 16 28369 1 1 12 GLU O O -0.018 13.392 -3.554 1.00 . A A . 12 GLU O 1 1 16 28370 1 1 12 GLU OE1 O -1.771 15.826 -3.946 1.00 . A A . 12 GLU OE1 1 1 16 28371 1 1 12 GLU OE2 O -0.677 14.957 -5.681 1.00 . A A . 12 GLU OE2 1 1 16 28372 1 1 13 ALA C C 2.287 11.076 -5.335 1.00 . A A . 13 ALA C 1 1 16 28373 1 1 13 ALA CA C 1.861 11.372 -3.896 1.00 . A A . 13 ALA CA 1 1 16 28374 1 1 13 ALA CB C 2.581 10.483 -2.880 1.00 . A A . 13 ALA CB 1 1 16 28375 1 1 13 ALA H H 0.117 10.234 -3.817 1.00 . A A . 13 ALA H 1 1 16 28376 1 1 13 ALA HA H 2.081 12.415 -3.668 1.00 . A A . 13 ALA HA 1 1 16 28377 1 1 13 ALA HB1 H 2.281 9.445 -3.028 1.00 . A A . 13 ALA HB1 1 1 16 28378 1 1 13 ALA HB2 H 3.659 10.573 -3.019 1.00 . A A . 13 ALA HB2 1 1 16 28379 1 1 13 ALA HB3 H 2.317 10.797 -1.870 1.00 . A A . 13 ALA HB3 1 1 16 28380 1 1 13 ALA N N 0.425 11.185 -3.772 1.00 . A A . 13 ALA N 1 1 16 28381 1 1 13 ALA O O 3.422 11.353 -5.720 1.00 . A A . 13 ALA O 1 1 16 28382 1 1 14 THR C C 0.476 10.666 -8.374 1.00 . A A . 14 THR C 1 1 16 28383 1 1 14 THR CA C 1.619 10.180 -7.480 1.00 . A A . 14 THR CA 1 1 16 28384 1 1 14 THR CB C 1.856 8.671 -7.564 1.00 . A A . 14 THR CB 1 1 16 28385 1 1 14 THR CG2 C 2.589 8.125 -6.337 1.00 . A A . 14 THR CG2 1 1 16 28386 1 1 14 THR H H 0.433 10.295 -5.771 1.00 . A A . 14 THR H 1 1 16 28387 1 1 14 THR HA H 2.518 10.708 -7.796 1.00 . A A . 14 THR HA 1 1 16 28388 1 1 14 THR HB H 2.384 8.411 -8.481 1.00 . A A . 14 THR HB 1 1 16 28389 1 1 14 THR HG1 H 0.055 8.524 -6.705 1.00 . A A . 14 THR HG1 1 1 16 28390 1 1 14 THR HG21 H 2.076 8.450 -5.432 1.00 . A A . 14 THR HG21 1 1 16 28391 1 1 14 THR HG22 H 2.602 7.036 -6.376 1.00 . A A . 14 THR HG22 1 1 16 28392 1 1 14 THR HG23 H 3.613 8.500 -6.328 1.00 . A A . 14 THR HG23 1 1 16 28393 1 1 14 THR N N 1.354 10.517 -6.092 1.00 . A A . 14 THR N 1 1 16 28394 1 1 14 THR O O -0.523 11.189 -7.882 1.00 . A A . 14 THR O 1 1 16 28395 1 1 14 THR OG1 O 0.551 8.108 -7.467 1.00 . A A . 14 THR OG1 1 1 16 28396 1 1 15 LYS C C -1.611 10.056 -10.438 1.00 . A A . 15 LYS C 1 1 16 28397 1 1 15 LYS CA C -0.343 10.887 -10.639 1.00 . A A . 15 LYS CA 1 1 16 28398 1 1 15 LYS CB C 0.221 10.815 -12.060 1.00 . A A . 15 LYS CB 1 1 16 28399 1 1 15 LYS CD C 0.064 12.572 -13.861 1.00 . A A . 15 LYS CD 1 1 16 28400 1 1 15 LYS CE C -0.755 13.856 -14.007 1.00 . A A . 15 LYS CE 1 1 16 28401 1 1 15 LYS CG C -0.702 11.523 -13.053 1.00 . A A . 15 LYS CG 1 1 16 28402 1 1 15 LYS H H 1.475 10.048 -10.064 1.00 . A A . 15 LYS H 1 1 16 28403 1 1 15 LYS HA H -0.579 11.932 -10.439 1.00 . A A . 15 LYS HA 1 1 16 28404 1 1 15 LYS HB2 H 1.210 11.273 -12.087 1.00 . A A . 15 LYS HB2 1 1 16 28405 1 1 15 LYS HB3 H 0.345 9.772 -12.353 1.00 . A A . 15 LYS HB3 1 1 16 28406 1 1 15 LYS HD2 H 1.011 12.795 -13.370 1.00 . A A . 15 LYS HD2 1 1 16 28407 1 1 15 LYS HD3 H 0.301 12.174 -14.848 1.00 . A A . 15 LYS HD3 1 1 16 28408 1 1 15 LYS HE2 H -1.316 14.043 -13.092 1.00 . A A . 15 LYS HE2 1 1 16 28409 1 1 15 LYS HE3 H -0.087 14.706 -14.151 1.00 . A A . 15 LYS HE3 1 1 16 28410 1 1 15 LYS HG2 H -1.146 10.791 -13.728 1.00 . A A . 15 LYS HG2 1 1 16 28411 1 1 15 LYS HG3 H -1.523 12.000 -12.516 1.00 . A A . 15 LYS HG3 1 1 16 28412 1 1 15 LYS HZ1 H -1.259 14.064 -16.019 1.00 . A A . 15 LYS HZ1 1 1 16 28413 1 1 15 LYS HZ2 H -1.992 12.796 -15.307 1.00 . A A . 15 LYS HZ2 1 1 16 28414 1 1 15 LYS N N 0.660 10.475 -9.672 1.00 . A A . 15 LYS N 1 1 16 28415 1 1 15 LYS NZ N -1.685 13.751 -15.154 1.00 . A A . 15 LYS NZ 1 1 16 28416 1 1 15 LYS O O -2.654 10.359 -11.015 1.00 . A A . 15 LYS O 1 1 16 28417 1 1 16 GLN C C -2.788 7.995 -7.821 1.00 . A A . 16 GLN C 1 1 16 28418 1 1 16 GLN CA C -2.603 8.147 -9.332 1.00 . A A . 16 GLN CA 1 1 16 28419 1 1 16 GLN CB C -2.417 6.784 -10.002 1.00 . A A . 16 GLN CB 1 1 16 28420 1 1 16 GLN CD C -3.225 6.798 -12.390 1.00 . A A . 16 GLN CD 1 1 16 28421 1 1 16 GLN CG C -2.013 6.944 -11.468 1.00 . A A . 16 GLN CG 1 1 16 28422 1 1 16 GLN H H -0.628 8.785 -9.151 1.00 . A A . 16 GLN H 1 1 16 28423 1 1 16 GLN HA H -3.473 8.641 -9.764 1.00 . A A . 16 GLN HA 1 1 16 28424 1 1 16 GLN HB2 H -1.654 6.215 -9.470 1.00 . A A . 16 GLN HB2 1 1 16 28425 1 1 16 GLN HB3 H -3.343 6.213 -9.936 1.00 . A A . 16 GLN HB3 1 1 16 28426 1 1 16 GLN HE21 H -3.432 4.893 -11.737 1.00 . A A . 16 GLN HE21 1 1 16 28427 1 1 16 GLN HE22 H -4.601 5.406 -12.908 1.00 . A A . 16 GLN HE22 1 1 16 28428 1 1 16 GLN HG2 H -1.553 7.921 -11.618 1.00 . A A . 16 GLN HG2 1 1 16 28429 1 1 16 GLN HG3 H -1.263 6.196 -11.726 1.00 . A A . 16 GLN HG3 1 1 16 28430 1 1 16 GLN N N -1.480 9.025 -9.616 1.00 . A A . 16 GLN N 1 1 16 28431 1 1 16 GLN NE2 N -3.800 5.600 -12.341 1.00 . A A . 16 GLN NE2 1 1 16 28432 1 1 16 GLN O O -2.147 7.153 -7.195 1.00 . A A . 16 GLN O 1 1 16 28433 1 1 16 GLN OE1 O -3.612 7.712 -13.099 1.00 . A A . 16 GLN OE1 1 1 16 28434 1 1 17 PRO C C -4.832 7.603 -5.475 1.00 . A A . 17 PRO C 1 1 16 28435 1 1 17 PRO CA C -3.970 8.814 -5.839 1.00 . A A . 17 PRO CA 1 1 16 28436 1 1 17 PRO CB C -4.651 10.139 -5.541 1.00 . A A . 17 PRO CB 1 1 16 28437 1 1 17 PRO CD C -4.471 9.856 -7.975 1.00 . A A . 17 PRO CD 1 1 16 28438 1 1 17 PRO CG C -5.147 10.663 -6.879 1.00 . A A . 17 PRO CG 1 1 16 28439 1 1 17 PRO HA H -3.120 8.709 -5.321 1.00 . A A . 17 PRO HA 1 1 16 28440 1 1 17 PRO HB2 H -5.478 10.006 -4.843 1.00 . A A . 17 PRO HB2 1 1 16 28441 1 1 17 PRO HB3 H -3.956 10.841 -5.080 1.00 . A A . 17 PRO HB3 1 1 16 28442 1 1 17 PRO HD2 H -5.204 9.396 -8.638 1.00 . A A . 17 PRO HD2 1 1 16 28443 1 1 17 PRO HD3 H -3.831 10.485 -8.594 1.00 . A A . 17 PRO HD3 1 1 16 28444 1 1 17 PRO HG2 H -6.231 10.568 -6.948 1.00 . A A . 17 PRO HG2 1 1 16 28445 1 1 17 PRO HG3 H -4.912 11.722 -6.985 1.00 . A A . 17 PRO HG3 1 1 16 28446 1 1 17 PRO N N -3.692 8.845 -7.264 1.00 . A A . 17 PRO N 1 1 16 28447 1 1 17 PRO O O -5.401 6.956 -6.352 1.00 . A A . 17 PRO O 1 1 16 28448 1 1 18 VAL C C -6.208 6.536 -2.287 1.00 . A A . 18 VAL C 1 1 16 28449 1 1 18 VAL CA C -5.685 6.213 -3.689 1.00 . A A . 18 VAL CA 1 1 16 28450 1 1 18 VAL CB C -4.850 4.932 -3.735 1.00 . A A . 18 VAL CB 1 1 16 28451 1 1 18 VAL CG1 C -5.592 3.770 -3.071 1.00 . A A . 18 VAL CG1 1 1 16 28452 1 1 18 VAL CG2 C -4.460 4.583 -5.173 1.00 . A A . 18 VAL CG2 1 1 16 28453 1 1 18 VAL H H -4.436 7.866 -3.472 1.00 . A A . 18 VAL H 1 1 16 28454 1 1 18 VAL HA H -6.535 6.087 -4.359 1.00 . A A . 18 VAL HA 1 1 16 28455 1 1 18 VAL HB H -3.933 5.109 -3.173 1.00 . A A . 18 VAL HB 1 1 16 28456 1 1 18 VAL HG11 H -6.655 3.838 -3.303 1.00 . A A . 18 VAL HG11 1 1 16 28457 1 1 18 VAL HG12 H -5.198 2.826 -3.445 1.00 . A A . 18 VAL HG12 1 1 16 28458 1 1 18 VAL HG13 H -5.452 3.819 -1.991 1.00 . A A . 18 VAL HG13 1 1 16 28459 1 1 18 VAL HG21 H -5.294 4.803 -5.839 1.00 . A A . 18 VAL HG21 1 1 16 28460 1 1 18 VAL HG22 H -3.594 5.175 -5.468 1.00 . A A . 18 VAL HG22 1 1 16 28461 1 1 18 VAL HG23 H -4.215 3.523 -5.236 1.00 . A A . 18 VAL HG23 1 1 16 28462 1 1 18 VAL N N -4.902 7.335 -4.179 1.00 . A A . 18 VAL N 1 1 16 28463 1 1 18 VAL O O -5.585 7.298 -1.549 1.00 . A A . 18 VAL O 1 1 16 28464 1 1 19 VAL C C -7.993 4.832 0.105 1.00 . A A . 19 VAL C 1 1 16 28465 1 1 19 VAL CA C -7.959 6.155 -0.663 1.00 . A A . 19 VAL CA 1 1 16 28466 1 1 19 VAL CB C -9.344 6.782 -0.836 1.00 . A A . 19 VAL CB 1 1 16 28467 1 1 19 VAL CG1 C -10.118 6.772 0.484 1.00 . A A . 19 VAL CG1 1 1 16 28468 1 1 19 VAL CG2 C -9.238 8.200 -1.398 1.00 . A A . 19 VAL CG2 1 1 16 28469 1 1 19 VAL H H -7.845 5.321 -2.569 1.00 . A A . 19 VAL H 1 1 16 28470 1 1 19 VAL HA H -7.334 6.862 -0.117 1.00 . A A . 19 VAL HA 1 1 16 28471 1 1 19 VAL HB H -9.898 6.177 -1.554 1.00 . A A . 19 VAL HB 1 1 16 28472 1 1 19 VAL HG11 H -10.051 5.782 0.937 1.00 . A A . 19 VAL HG11 1 1 16 28473 1 1 19 VAL HG12 H -9.691 7.511 1.161 1.00 . A A . 19 VAL HG12 1 1 16 28474 1 1 19 VAL HG13 H -11.164 7.014 0.293 1.00 . A A . 19 VAL HG13 1 1 16 28475 1 1 19 VAL HG21 H -8.198 8.417 -1.642 1.00 . A A . 19 VAL HG21 1 1 16 28476 1 1 19 VAL HG22 H -9.846 8.281 -2.299 1.00 . A A . 19 VAL HG22 1 1 16 28477 1 1 19 VAL HG23 H -9.593 8.914 -0.655 1.00 . A A . 19 VAL HG23 1 1 16 28478 1 1 19 VAL N N -7.346 5.940 -1.963 1.00 . A A . 19 VAL N 1 1 16 28479 1 1 19 VAL O O -8.705 3.905 -0.279 1.00 . A A . 19 VAL O 1 1 16 28480 1 1 20 PHE C C -8.092 3.699 3.199 1.00 . A A . 20 PHE C 1 1 16 28481 1 1 20 PHE CA C -7.147 3.592 2.001 1.00 . A A . 20 PHE CA 1 1 16 28482 1 1 20 PHE CB C -5.706 3.513 2.510 1.00 . A A . 20 PHE CB 1 1 16 28483 1 1 20 PHE CD1 C -5.260 1.046 2.781 1.00 . A A . 20 PHE CD1 1 1 16 28484 1 1 20 PHE CD2 C -5.314 2.411 4.743 1.00 . A A . 20 PHE CD2 1 1 16 28485 1 1 20 PHE CE1 C -4.989 -0.111 3.593 1.00 . A A . 20 PHE CE1 1 1 16 28486 1 1 20 PHE CE2 C -5.043 1.253 5.556 1.00 . A A . 20 PHE CE2 1 1 16 28487 1 1 20 PHE CG C -5.417 2.283 3.373 1.00 . A A . 20 PHE CG 1 1 16 28488 1 1 20 PHE CZ C -4.893 0.049 4.940 1.00 . A A . 20 PHE CZ 1 1 16 28489 1 1 20 PHE H H -6.639 5.545 1.482 1.00 . A A . 20 PHE H 1 1 16 28490 1 1 20 PHE HA H -7.444 2.742 1.388 1.00 . A A . 20 PHE HA 1 1 16 28491 1 1 20 PHE HB2 H -5.029 3.511 1.655 1.00 . A A . 20 PHE HB2 1 1 16 28492 1 1 20 PHE HB3 H -5.485 4.410 3.088 1.00 . A A . 20 PHE HB3 1 1 16 28493 1 1 20 PHE HD1 H -5.341 0.946 1.699 1.00 . A A . 20 PHE HD1 1 1 16 28494 1 1 20 PHE HD2 H -5.438 3.387 5.210 1.00 . A A . 20 PHE HD2 1 1 16 28495 1 1 20 PHE HE1 H -4.862 -1.094 3.139 1.00 . A A . 20 PHE HE1 1 1 16 28496 1 1 20 PHE HE2 H -4.959 1.339 6.639 1.00 . A A . 20 PHE HE2 1 1 16 28497 1 1 20 PHE HZ H -4.659 -0.903 5.481 1.00 . A A . 20 PHE HZ 1 1 16 28498 1 1 20 PHE N N -7.215 4.786 1.176 1.00 . A A . 20 PHE N 1 1 16 28499 1 1 20 PHE O O -8.622 4.772 3.483 1.00 . A A . 20 PHE O 1 1 16 28500 1 1 21 ASN C C -8.512 1.642 6.106 1.00 . A A . 21 ASN C 1 1 16 28501 1 1 21 ASN CA C -9.149 2.524 5.030 1.00 . A A . 21 ASN CA 1 1 16 28502 1 1 21 ASN CB C -10.510 1.925 4.672 1.00 . A A . 21 ASN CB 1 1 16 28503 1 1 21 ASN CG C -11.186 2.728 3.559 1.00 . A A . 21 ASN CG 1 1 16 28504 1 1 21 ASN H H -7.841 1.703 3.633 1.00 . A A . 21 ASN H 1 1 16 28505 1 1 21 ASN HA H -9.255 3.560 5.351 1.00 . A A . 21 ASN HA 1 1 16 28506 1 1 21 ASN HB2 H -10.383 0.890 4.353 1.00 . A A . 21 ASN HB2 1 1 16 28507 1 1 21 ASN HB3 H -11.149 1.910 5.555 1.00 . A A . 21 ASN HB3 1 1 16 28508 1 1 21 ASN HD21 H -11.801 4.057 4.957 1.00 . A A . 21 ASN HD21 1 1 16 28509 1 1 21 ASN HD22 H -12.280 4.417 3.332 1.00 . A A . 21 ASN HD22 1 1 16 28510 1 1 21 ASN N N -8.276 2.571 3.870 1.00 . A A . 21 ASN N 1 1 16 28511 1 1 21 ASN ND2 N -11.807 3.825 3.984 1.00 . A A . 21 ASN ND2 1 1 16 28512 1 1 21 ASN O O -8.065 0.532 5.820 1.00 . A A . 21 ASN O 1 1 16 28513 1 1 21 ASN OD1 O -11.147 2.376 2.392 1.00 . A A . 21 ASN OD1 1 1 16 28514 1 1 22 HIS C C -9.003 0.603 9.121 1.00 . A A . 22 HIS C 1 1 16 28515 1 1 22 HIS CA C -7.918 1.442 8.442 1.00 . A A . 22 HIS CA 1 1 16 28516 1 1 22 HIS CB C -7.217 2.399 9.408 1.00 . A A . 22 HIS CB 1 1 16 28517 1 1 22 HIS CD2 C -4.631 2.035 9.312 1.00 . A A . 22 HIS CD2 1 1 16 28518 1 1 22 HIS CE1 C -4.109 3.811 8.145 1.00 . A A . 22 HIS CE1 1 1 16 28519 1 1 22 HIS CG C -5.786 2.707 9.039 1.00 . A A . 22 HIS CG 1 1 16 28520 1 1 22 HIS H H -8.858 3.071 7.547 1.00 . A A . 22 HIS H 1 1 16 28521 1 1 22 HIS HA H -7.161 0.775 8.028 1.00 . A A . 22 HIS HA 1 1 16 28522 1 1 22 HIS HB2 H -7.780 3.332 9.451 1.00 . A A . 22 HIS HB2 1 1 16 28523 1 1 22 HIS HB3 H -7.239 1.969 10.410 1.00 . A A . 22 HIS HB3 1 1 16 28524 1 1 22 HIS HD1 H -6.051 4.517 7.949 1.00 . A A . 22 HIS HD1 1 1 16 28525 1 1 22 HIS HD2 H -4.552 1.107 9.879 1.00 . A A . 22 HIS HD2 1 1 16 28526 1 1 22 HIS HE1 H -3.522 4.556 7.609 1.00 . A A . 22 HIS HE1 1 1 16 28527 1 1 22 HIS N N -8.492 2.168 7.322 1.00 . A A . 22 HIS N 1 1 16 28528 1 1 22 HIS ND1 N -5.425 3.822 8.302 1.00 . A A . 22 HIS ND1 1 1 16 28529 1 1 22 HIS NE2 N -3.619 2.702 8.771 1.00 . A A . 22 HIS NE2 1 1 16 28530 1 1 22 HIS O O -8.708 -0.207 9.998 1.00 . A A . 22 HIS O 1 1 16 28531 1 1 23 SER C C -11.643 -1.152 8.411 1.00 . A A . 23 SER C 1 1 16 28532 1 1 23 SER CA C -11.365 0.101 9.243 1.00 . A A . 23 SER CA 1 1 16 28533 1 1 23 SER CB C -12.612 0.986 9.302 1.00 . A A . 23 SER CB 1 1 16 28534 1 1 23 SER H H -10.466 1.486 7.973 1.00 . A A . 23 SER H 1 1 16 28535 1 1 23 SER HA H -11.066 -0.170 10.255 1.00 . A A . 23 SER HA 1 1 16 28536 1 1 23 SER HB2 H -12.541 1.657 10.158 1.00 . A A . 23 SER HB2 1 1 16 28537 1 1 23 SER HB3 H -12.655 1.612 8.410 1.00 . A A . 23 SER HB3 1 1 16 28538 1 1 23 SER HG H -13.899 -0.156 10.323 1.00 . A A . 23 SER HG 1 1 16 28539 1 1 23 SER N N -10.235 0.826 8.688 1.00 . A A . 23 SER N 1 1 16 28540 1 1 23 SER O O -12.498 -1.962 8.767 1.00 . A A . 23 SER O 1 1 16 28541 1 1 23 SER OG O -13.808 0.218 9.400 1.00 . A A . 23 SER OG 1 1 16 28542 1 1 24 THR C C -9.936 -3.427 6.662 1.00 . A A . 24 THR C 1 1 16 28543 1 1 24 THR CA C -11.060 -2.414 6.432 1.00 . A A . 24 THR CA 1 1 16 28544 1 1 24 THR CB C -11.122 -1.893 4.995 1.00 . A A . 24 THR CB 1 1 16 28545 1 1 24 THR CG2 C -11.199 -3.021 3.965 1.00 . A A . 24 THR CG2 1 1 16 28546 1 1 24 THR H H -10.211 -0.611 7.035 1.00 . A A . 24 THR H 1 1 16 28547 1 1 24 THR HA H -11.997 -2.915 6.678 1.00 . A A . 24 THR HA 1 1 16 28548 1 1 24 THR HB H -10.283 -1.230 4.785 1.00 . A A . 24 THR HB 1 1 16 28549 1 1 24 THR HG1 H -12.280 -0.283 4.723 1.00 . A A . 24 THR HG1 1 1 16 28550 1 1 24 THR HG21 H -10.807 -3.939 4.402 1.00 . A A . 24 THR HG21 1 1 16 28551 1 1 24 THR HG22 H -12.238 -3.174 3.670 1.00 . A A . 24 THR HG22 1 1 16 28552 1 1 24 THR HG23 H -10.608 -2.754 3.089 1.00 . A A . 24 THR HG23 1 1 16 28553 1 1 24 THR N N -10.904 -1.273 7.318 1.00 . A A . 24 THR N 1 1 16 28554 1 1 24 THR O O -10.132 -4.628 6.487 1.00 . A A . 24 THR O 1 1 16 28555 1 1 24 THR OG1 O -12.396 -1.258 4.911 1.00 . A A . 24 THR OG1 1 1 16 28556 1 1 25 HIS C C -7.455 -3.936 8.818 1.00 . A A . 25 HIS C 1 1 16 28557 1 1 25 HIS CA C -7.628 -3.746 7.309 1.00 . A A . 25 HIS CA 1 1 16 28558 1 1 25 HIS CB C -6.378 -3.174 6.637 1.00 . A A . 25 HIS CB 1 1 16 28559 1 1 25 HIS CD2 C -5.947 -3.779 4.130 1.00 . A A . 25 HIS CD2 1 1 16 28560 1 1 25 HIS CE1 C -7.151 -2.197 3.217 1.00 . A A . 25 HIS CE1 1 1 16 28561 1 1 25 HIS CG C -6.495 -3.040 5.137 1.00 . A A . 25 HIS CG 1 1 16 28562 1 1 25 HIS H H -8.632 -1.925 7.194 1.00 . A A . 25 HIS H 1 1 16 28563 1 1 25 HIS HA H -7.838 -4.713 6.852 1.00 . A A . 25 HIS HA 1 1 16 28564 1 1 25 HIS HB2 H -6.165 -2.195 7.063 1.00 . A A . 25 HIS HB2 1 1 16 28565 1 1 25 HIS HB3 H -5.528 -3.815 6.869 1.00 . A A . 25 HIS HB3 1 1 16 28566 1 1 25 HIS HD1 H -7.776 -1.344 5.002 1.00 . A A . 25 HIS HD1 1 1 16 28567 1 1 25 HIS HD2 H -5.293 -4.642 4.257 1.00 . A A . 25 HIS HD2 1 1 16 28568 1 1 25 HIS HE1 H -7.631 -1.572 2.464 1.00 . A A . 25 HIS HE1 1 1 16 28569 1 1 25 HIS N N -8.783 -2.904 7.053 1.00 . A A . 25 HIS N 1 1 16 28570 1 1 25 HIS ND1 N -7.248 -2.050 4.530 1.00 . A A . 25 HIS ND1 1 1 16 28571 1 1 25 HIS NE2 N -6.344 -3.270 2.971 1.00 . A A . 25 HIS NE2 1 1 16 28572 1 1 25 HIS O O -6.332 -4.012 9.313 1.00 . A A . 25 HIS O 1 1 16 28573 1 1 26 LYS C C -8.033 -5.576 11.281 1.00 . A A . 26 LYS C 1 1 16 28574 1 1 26 LYS CA C -8.573 -4.184 10.948 1.00 . A A . 26 LYS CA 1 1 16 28575 1 1 26 LYS CB C -9.959 -3.905 11.534 1.00 . A A . 26 LYS CB 1 1 16 28576 1 1 26 LYS CD C -11.885 -2.280 11.629 1.00 . A A . 26 LYS CD 1 1 16 28577 1 1 26 LYS CE C -11.849 -1.641 13.019 1.00 . A A . 26 LYS CE 1 1 16 28578 1 1 26 LYS CG C -10.470 -2.529 11.103 1.00 . A A . 26 LYS CG 1 1 16 28579 1 1 26 LYS H H -9.495 -3.942 9.096 1.00 . A A . 26 LYS H 1 1 16 28580 1 1 26 LYS HA H -7.892 -3.440 11.364 1.00 . A A . 26 LYS HA 1 1 16 28581 1 1 26 LYS HB2 H -10.657 -4.675 11.208 1.00 . A A . 26 LYS HB2 1 1 16 28582 1 1 26 LYS HB3 H -9.914 -3.957 12.622 1.00 . A A . 26 LYS HB3 1 1 16 28583 1 1 26 LYS HD2 H -12.424 -1.630 10.940 1.00 . A A . 26 LYS HD2 1 1 16 28584 1 1 26 LYS HD3 H -12.431 -3.222 11.672 1.00 . A A . 26 LYS HD3 1 1 16 28585 1 1 26 LYS HE2 H -10.817 -1.557 13.361 1.00 . A A . 26 LYS HE2 1 1 16 28586 1 1 26 LYS HE3 H -12.252 -0.630 12.971 1.00 . A A . 26 LYS HE3 1 1 16 28587 1 1 26 LYS HG2 H -9.798 -1.755 11.476 1.00 . A A . 26 LYS HG2 1 1 16 28588 1 1 26 LYS HG3 H -10.465 -2.459 10.016 1.00 . A A . 26 LYS HG3 1 1 16 28589 1 1 26 LYS HZ1 H -12.038 -2.920 14.653 1.00 . A A . 26 LYS HZ1 1 1 16 28590 1 1 26 LYS HZ2 H -13.283 -1.880 14.512 1.00 . A A . 26 LYS HZ2 1 1 16 28591 1 1 26 LYS N N -8.585 -4.005 9.506 1.00 . A A . 26 LYS N 1 1 16 28592 1 1 26 LYS NZ N -12.632 -2.448 13.981 1.00 . A A . 26 LYS NZ 1 1 16 28593 1 1 26 LYS O O -7.271 -5.739 12.233 1.00 . A A . 26 LYS O 1 1 16 28594 1 1 27 SER C C -6.536 -8.057 10.318 1.00 . A A . 27 SER C 1 1 16 28595 1 1 27 SER CA C -8.017 -7.918 10.676 1.00 . A A . 27 SER CA 1 1 16 28596 1 1 27 SER CB C -8.858 -8.885 9.842 1.00 . A A . 27 SER CB 1 1 16 28597 1 1 27 SER H H -9.069 -6.404 9.707 1.00 . A A . 27 SER H 1 1 16 28598 1 1 27 SER HA H -8.175 -8.120 11.736 1.00 . A A . 27 SER HA 1 1 16 28599 1 1 27 SER HB2 H -8.770 -9.891 10.254 1.00 . A A . 27 SER HB2 1 1 16 28600 1 1 27 SER HB3 H -9.909 -8.604 9.910 1.00 . A A . 27 SER HB3 1 1 16 28601 1 1 27 SER HG H -9.205 -8.570 7.896 1.00 . A A . 27 SER HG 1 1 16 28602 1 1 27 SER N N -8.449 -6.544 10.479 1.00 . A A . 27 SER N 1 1 16 28603 1 1 27 SER O O -5.908 -9.065 10.639 1.00 . A A . 27 SER O 1 1 16 28604 1 1 27 SER OG O -8.458 -8.897 8.474 1.00 . A A . 27 SER OG 1 1 16 28605 1 1 28 VAL C C -3.774 -6.431 10.376 1.00 . A A . 28 VAL C 1 1 16 28606 1 1 28 VAL CA C -4.625 -7.025 9.253 1.00 . A A . 28 VAL CA 1 1 16 28607 1 1 28 VAL CB C -4.469 -6.281 7.925 1.00 . A A . 28 VAL CB 1 1 16 28608 1 1 28 VAL CG1 C -3.046 -6.426 7.380 1.00 . A A . 28 VAL CG1 1 1 16 28609 1 1 28 VAL CG2 C -5.500 -6.761 6.902 1.00 . A A . 28 VAL CG2 1 1 16 28610 1 1 28 VAL H H -6.538 -6.214 9.401 1.00 . A A . 28 VAL H 1 1 16 28611 1 1 28 VAL HA H -4.325 -8.061 9.096 1.00 . A A . 28 VAL HA 1 1 16 28612 1 1 28 VAL HB H -4.650 -5.222 8.112 1.00 . A A . 28 VAL HB 1 1 16 28613 1 1 28 VAL HG11 H -2.353 -6.572 8.209 1.00 . A A . 28 VAL HG11 1 1 16 28614 1 1 28 VAL HG12 H -2.999 -7.285 6.711 1.00 . A A . 28 VAL HG12 1 1 16 28615 1 1 28 VAL HG13 H -2.773 -5.523 6.833 1.00 . A A . 28 VAL HG13 1 1 16 28616 1 1 28 VAL HG21 H -5.502 -7.851 6.872 1.00 . A A . 28 VAL HG21 1 1 16 28617 1 1 28 VAL HG22 H -6.489 -6.403 7.188 1.00 . A A . 28 VAL HG22 1 1 16 28618 1 1 28 VAL HG23 H -5.242 -6.371 5.917 1.00 . A A . 28 VAL HG23 1 1 16 28619 1 1 28 VAL N N -6.021 -7.030 9.658 1.00 . A A . 28 VAL N 1 1 16 28620 1 1 28 VAL O O -4.179 -5.465 11.022 1.00 . A A . 28 VAL O 1 1 16 28621 1 1 29 LYS C C -1.053 -5.258 11.168 1.00 . A A . 29 LYS C 1 1 16 28622 1 1 29 LYS CA C -1.699 -6.573 11.610 1.00 . A A . 29 LYS CA 1 1 16 28623 1 1 29 LYS CB C -0.688 -7.668 11.957 1.00 . A A . 29 LYS CB 1 1 16 28624 1 1 29 LYS CD C 0.563 -8.352 14.037 1.00 . A A . 29 LYS CD 1 1 16 28625 1 1 29 LYS CE C 0.920 -7.283 15.072 1.00 . A A . 29 LYS CE 1 1 16 28626 1 1 29 LYS CG C -0.813 -8.083 13.425 1.00 . A A . 29 LYS CG 1 1 16 28627 1 1 29 LYS H H -2.288 -7.816 10.045 1.00 . A A . 29 LYS H 1 1 16 28628 1 1 29 LYS HA H -2.290 -6.384 12.506 1.00 . A A . 29 LYS HA 1 1 16 28629 1 1 29 LYS HB2 H -0.850 -8.535 11.316 1.00 . A A . 29 LYS HB2 1 1 16 28630 1 1 29 LYS HB3 H 0.322 -7.311 11.761 1.00 . A A . 29 LYS HB3 1 1 16 28631 1 1 29 LYS HD2 H 0.571 -9.335 14.507 1.00 . A A . 29 LYS HD2 1 1 16 28632 1 1 29 LYS HD3 H 1.318 -8.368 13.251 1.00 . A A . 29 LYS HD3 1 1 16 28633 1 1 29 LYS HE2 H 1.996 -7.105 15.064 1.00 . A A . 29 LYS HE2 1 1 16 28634 1 1 29 LYS HE3 H 0.439 -6.341 14.812 1.00 . A A . 29 LYS HE3 1 1 16 28635 1 1 29 LYS HG2 H -1.318 -7.298 13.987 1.00 . A A . 29 LYS HG2 1 1 16 28636 1 1 29 LYS HG3 H -1.430 -8.978 13.502 1.00 . A A . 29 LYS HG3 1 1 16 28637 1 1 29 LYS HZ1 H 1.274 -7.764 17.069 1.00 . A A . 29 LYS HZ1 1 1 16 28638 1 1 29 LYS HZ2 H -0.177 -7.065 16.830 1.00 . A A . 29 LYS HZ2 1 1 16 28639 1 1 29 LYS N N -2.610 -7.031 10.575 1.00 . A A . 29 LYS N 1 1 16 28640 1 1 29 LYS NZ N 0.494 -7.708 16.424 1.00 . A A . 29 LYS NZ 1 1 16 28641 1 1 29 LYS O O -0.651 -5.116 10.015 1.00 . A A . 29 LYS O 1 1 16 28642 1 1 30 CYS C C 1.053 -3.249 11.350 1.00 . A A . 30 CYS C 1 1 16 28643 1 1 30 CYS CA C -0.382 -3.031 11.833 1.00 . A A . 30 CYS CA 1 1 16 28644 1 1 30 CYS CB C -0.440 -2.111 13.054 1.00 . A A . 30 CYS CB 1 1 16 28645 1 1 30 CYS H H -1.301 -4.453 13.047 1.00 . A A . 30 CYS H 1 1 16 28646 1 1 30 CYS HA H -0.988 -2.573 11.052 1.00 . A A . 30 CYS HA 1 1 16 28647 1 1 30 CYS HB2 H 0.387 -2.360 13.718 1.00 . A A . 30 CYS HB2 1 1 16 28648 1 1 30 CYS HB3 H -0.287 -1.084 12.725 1.00 . A A . 30 CYS HB3 1 1 16 28649 1 1 30 CYS N N -0.972 -4.330 12.111 1.00 . A A . 30 CYS N 1 1 16 28650 1 1 30 CYS O O 1.565 -2.473 10.545 1.00 . A A . 30 CYS O 1 1 16 28651 1 1 30 CYS SG S -2.001 -2.196 14.006 1.00 . A A . 30 CYS SG 1 1 16 28652 1 1 31 GLY C C 3.081 -5.286 10.109 1.00 . A A . 31 GLY C 1 1 16 28653 1 1 31 GLY CA C 3.028 -4.638 11.494 1.00 . A A . 31 GLY CA 1 1 16 28654 1 1 31 GLY H H 1.237 -4.935 12.517 1.00 . A A . 31 GLY H 1 1 16 28655 1 1 31 GLY HA2 H 3.638 -3.735 11.500 1.00 . A A . 31 GLY HA2 1 1 16 28656 1 1 31 GLY HA3 H 3.454 -5.316 12.233 1.00 . A A . 31 GLY HA3 1 1 16 28657 1 1 31 GLY N N 1.661 -4.309 11.863 1.00 . A A . 31 GLY N 1 1 16 28658 1 1 31 GLY O O 4.161 -5.561 9.589 1.00 . A A . 31 GLY O 1 1 16 28659 1 1 32 ASP C C 2.088 -5.071 7.165 1.00 . A A . 32 ASP C 1 1 16 28660 1 1 32 ASP CA C 1.799 -6.124 8.237 1.00 . A A . 32 ASP CA 1 1 16 28661 1 1 32 ASP CB C 0.392 -6.673 7.992 1.00 . A A . 32 ASP CB 1 1 16 28662 1 1 32 ASP CG C 0.264 -7.610 6.790 1.00 . A A . 32 ASP CG 1 1 16 28663 1 1 32 ASP H H 1.026 -5.286 9.981 1.00 . A A . 32 ASP H 1 1 16 28664 1 1 32 ASP HA H 2.533 -6.930 8.238 1.00 . A A . 32 ASP HA 1 1 16 28665 1 1 32 ASP HB2 H 0.066 -7.206 8.885 1.00 . A A . 32 ASP HB2 1 1 16 28666 1 1 32 ASP HB3 H -0.290 -5.835 7.854 1.00 . A A . 32 ASP HB3 1 1 16 28667 1 1 32 ASP N N 1.901 -5.513 9.551 1.00 . A A . 32 ASP N 1 1 16 28668 1 1 32 ASP O O 2.676 -5.379 6.130 1.00 . A A . 32 ASP O 1 1 16 28669 1 1 32 ASP OD1 O 0.840 -7.264 5.736 1.00 . A A . 32 ASP OD1 1 1 16 28670 1 1 32 ASP OD2 O -0.407 -8.653 6.951 1.00 . A A . 32 ASP OD2 1 1 16 28671 1 1 33 CYS C C 2.998 -1.871 7.066 1.00 . A A . 33 CYS C 1 1 16 28672 1 1 33 CYS CA C 1.868 -2.749 6.525 1.00 . A A . 33 CYS CA 1 1 16 28673 1 1 33 CYS CB C 0.582 -1.951 6.301 1.00 . A A . 33 CYS CB 1 1 16 28674 1 1 33 CYS H H 1.186 -3.607 8.297 1.00 . A A . 33 CYS H 1 1 16 28675 1 1 33 CYS HA H 2.146 -3.192 5.569 1.00 . A A . 33 CYS HA 1 1 16 28676 1 1 33 CYS HB2 H -0.012 -1.938 7.214 1.00 . A A . 33 CYS HB2 1 1 16 28677 1 1 33 CYS HB3 H 0.824 -0.914 6.064 1.00 . A A . 33 CYS HB3 1 1 16 28678 1 1 33 CYS N N 1.662 -3.849 7.451 1.00 . A A . 33 CYS N 1 1 16 28679 1 1 33 CYS O O 3.978 -1.615 6.368 1.00 . A A . 33 CYS O 1 1 16 28680 1 1 33 CYS SG S -0.386 -2.693 4.937 1.00 . A A . 33 CYS SG 1 1 16 28681 1 1 34 HIS C C 5.014 -1.440 9.376 1.00 . A A . 34 HIS C 1 1 16 28682 1 1 34 HIS CA C 3.817 -0.589 8.946 1.00 . A A . 34 HIS CA 1 1 16 28683 1 1 34 HIS CB C 3.197 0.192 10.107 1.00 . A A . 34 HIS CB 1 1 16 28684 1 1 34 HIS CD2 C 0.718 0.918 9.708 1.00 . A A . 34 HIS CD2 1 1 16 28685 1 1 34 HIS CE1 C 1.102 2.931 8.943 1.00 . A A . 34 HIS CE1 1 1 16 28686 1 1 34 HIS CG C 2.069 1.108 9.698 1.00 . A A . 34 HIS CG 1 1 16 28687 1 1 34 HIS H H 2.024 -1.647 8.865 1.00 . A A . 34 HIS H 1 1 16 28688 1 1 34 HIS HA H 4.145 0.132 8.198 1.00 . A A . 34 HIS HA 1 1 16 28689 1 1 34 HIS HB2 H 2.827 -0.515 10.850 1.00 . A A . 34 HIS HB2 1 1 16 28690 1 1 34 HIS HB3 H 3.975 0.783 10.590 1.00 . A A . 34 HIS HB3 1 1 16 28691 1 1 34 HIS HD1 H 3.170 2.823 9.082 1.00 . A A . 34 HIS HD1 1 1 16 28692 1 1 34 HIS HD2 H 0.205 0.013 10.034 1.00 . A A . 34 HIS HD2 1 1 16 28693 1 1 34 HIS HE1 H 0.935 3.932 8.546 1.00 . A A . 34 HIS HE1 1 1 16 28694 1 1 34 HIS N N 2.824 -1.434 8.304 1.00 . A A . 34 HIS N 1 1 16 28695 1 1 34 HIS ND1 N 2.280 2.386 9.210 1.00 . A A . 34 HIS ND1 1 1 16 28696 1 1 34 HIS NE2 N 0.136 2.020 9.252 1.00 . A A . 34 HIS NE2 1 1 16 28697 1 1 34 HIS O O 5.199 -1.703 10.563 1.00 . A A . 34 HIS O 1 1 16 28698 1 1 35 HIS C C 7.971 -1.868 9.486 1.00 . A A . 35 HIS C 1 1 16 28699 1 1 35 HIS CA C 6.969 -2.664 8.647 1.00 . A A . 35 HIS CA 1 1 16 28700 1 1 35 HIS CB C 7.570 -3.183 7.340 1.00 . A A . 35 HIS CB 1 1 16 28701 1 1 35 HIS CD2 C 7.745 -1.442 5.398 1.00 . A A . 35 HIS CD2 1 1 16 28702 1 1 35 HIS CE1 C 9.759 -0.701 5.825 1.00 . A A . 35 HIS CE1 1 1 16 28703 1 1 35 HIS CG C 8.212 -2.112 6.491 1.00 . A A . 35 HIS CG 1 1 16 28704 1 1 35 HIS H H 5.638 -1.629 7.424 1.00 . A A . 35 HIS H 1 1 16 28705 1 1 35 HIS HA H 6.629 -3.525 9.223 1.00 . A A . 35 HIS HA 1 1 16 28706 1 1 35 HIS HB2 H 8.316 -3.944 7.573 1.00 . A A . 35 HIS HB2 1 1 16 28707 1 1 35 HIS HB3 H 6.787 -3.671 6.761 1.00 . A A . 35 HIS HB3 1 1 16 28708 1 1 35 HIS HD1 H 10.092 -1.917 7.473 1.00 . A A . 35 HIS HD1 1 1 16 28709 1 1 35 HIS HD2 H 6.769 -1.583 4.934 1.00 . A A . 35 HIS HD2 1 1 16 28710 1 1 35 HIS HE1 H 10.686 -0.132 5.749 1.00 . A A . 35 HIS HE1 1 1 16 28711 1 1 35 HIS N N 5.795 -1.847 8.387 1.00 . A A . 35 HIS N 1 1 16 28712 1 1 35 HIS ND1 N 9.484 -1.624 6.735 1.00 . A A . 35 HIS ND1 1 1 16 28713 1 1 35 HIS NE2 N 8.680 -0.590 4.997 1.00 . A A . 35 HIS NE2 1 1 16 28714 1 1 35 HIS O O 8.054 -0.647 9.368 1.00 . A A . 35 HIS O 1 1 16 28715 1 1 36 PRO C C 10.959 -1.584 10.396 1.00 . A A . 36 PRO C 1 1 16 28716 1 1 36 PRO CA C 9.720 -1.990 11.196 1.00 . A A . 36 PRO CA 1 1 16 28717 1 1 36 PRO CB C 10.018 -3.026 12.268 1.00 . A A . 36 PRO CB 1 1 16 28718 1 1 36 PRO CD C 8.656 -4.061 10.505 1.00 . A A . 36 PRO CD 1 1 16 28719 1 1 36 PRO CG C 9.534 -4.354 11.710 1.00 . A A . 36 PRO CG 1 1 16 28720 1 1 36 PRO HA H 9.358 -1.144 11.588 1.00 . A A . 36 PRO HA 1 1 16 28721 1 1 36 PRO HB2 H 11.084 -3.061 12.491 1.00 . A A . 36 PRO HB2 1 1 16 28722 1 1 36 PRO HB3 H 9.505 -2.783 13.199 1.00 . A A . 36 PRO HB3 1 1 16 28723 1 1 36 PRO HD2 H 9.016 -4.580 9.616 1.00 . A A . 36 PRO HD2 1 1 16 28724 1 1 36 PRO HD3 H 7.630 -4.391 10.672 1.00 . A A . 36 PRO HD3 1 1 16 28725 1 1 36 PRO HG2 H 10.380 -4.979 11.424 1.00 . A A . 36 PRO HG2 1 1 16 28726 1 1 36 PRO HG3 H 8.973 -4.904 12.466 1.00 . A A . 36 PRO HG3 1 1 16 28727 1 1 36 PRO N N 8.726 -2.613 10.338 1.00 . A A . 36 PRO N 1 1 16 28728 1 1 36 PRO O O 11.726 -2.439 9.957 1.00 . A A . 36 PRO O 1 1 16 28729 1 1 37 VAL C C 13.453 0.373 10.427 1.00 . A A . 37 VAL C 1 1 16 28730 1 1 37 VAL CA C 12.249 0.251 9.491 1.00 . A A . 37 VAL CA 1 1 16 28731 1 1 37 VAL CB C 11.868 1.578 8.831 1.00 . A A . 37 VAL CB 1 1 16 28732 1 1 37 VAL CG1 C 13.079 2.217 8.148 1.00 . A A . 37 VAL CG1 1 1 16 28733 1 1 37 VAL CG2 C 10.717 1.388 7.841 1.00 . A A . 37 VAL CG2 1 1 16 28734 1 1 37 VAL H H 10.488 0.410 10.592 1.00 . A A . 37 VAL H 1 1 16 28735 1 1 37 VAL HA H 12.489 -0.462 8.702 1.00 . A A . 37 VAL HA 1 1 16 28736 1 1 37 VAL HB H 11.529 2.256 9.614 1.00 . A A . 37 VAL HB 1 1 16 28737 1 1 37 VAL HG11 H 13.983 1.969 8.703 1.00 . A A . 37 VAL HG11 1 1 16 28738 1 1 37 VAL HG12 H 13.163 1.839 7.129 1.00 . A A . 37 VAL HG12 1 1 16 28739 1 1 37 VAL HG13 H 12.953 3.299 8.124 1.00 . A A . 37 VAL HG13 1 1 16 28740 1 1 37 VAL HG21 H 10.360 0.359 7.893 1.00 . A A . 37 VAL HG21 1 1 16 28741 1 1 37 VAL HG22 H 9.904 2.068 8.095 1.00 . A A . 37 VAL HG22 1 1 16 28742 1 1 37 VAL HG23 H 11.067 1.601 6.831 1.00 . A A . 37 VAL HG23 1 1 16 28743 1 1 37 VAL N N 11.116 -0.279 10.231 1.00 . A A . 37 VAL N 1 1 16 28744 1 1 37 VAL O O 13.682 1.428 11.015 1.00 . A A . 37 VAL O 1 1 16 28745 1 1 38 ASN C C 14.928 -0.625 12.854 1.00 . A A . 38 ASN C 1 1 16 28746 1 1 38 ASN CA C 15.364 -0.752 11.393 1.00 . A A . 38 ASN CA 1 1 16 28747 1 1 38 ASN CB C 16.305 0.411 11.076 1.00 . A A . 38 ASN CB 1 1 16 28748 1 1 38 ASN CG C 17.560 -0.080 10.352 1.00 . A A . 38 ASN CG 1 1 16 28749 1 1 38 ASN H H 13.996 -1.578 10.055 1.00 . A A . 38 ASN H 1 1 16 28750 1 1 38 ASN HA H 15.847 -1.707 11.184 1.00 . A A . 38 ASN HA 1 1 16 28751 1 1 38 ASN HB2 H 15.787 1.145 10.458 1.00 . A A . 38 ASN HB2 1 1 16 28752 1 1 38 ASN HB3 H 16.588 0.916 12.000 1.00 . A A . 38 ASN HB3 1 1 16 28753 1 1 38 ASN HD21 H 18.309 -0.660 12.141 1.00 . A A . 38 ASN HD21 1 1 16 28754 1 1 38 ASN HD22 H 19.333 -0.961 10.777 1.00 . A A . 38 ASN HD22 1 1 16 28755 1 1 38 ASN N N 14.190 -0.723 10.537 1.00 . A A . 38 ASN N 1 1 16 28756 1 1 38 ASN ND2 N 18.476 -0.611 11.156 1.00 . A A . 38 ASN ND2 1 1 16 28757 1 1 38 ASN O O 14.814 -1.625 13.561 1.00 . A A . 38 ASN O 1 1 16 28758 1 1 38 ASN OD1 O 17.688 0.017 9.142 1.00 . A A . 38 ASN OD1 1 1 16 28759 1 1 39 GLY C C 13.057 1.809 14.651 1.00 . A A . 39 GLY C 1 1 16 28760 1 1 39 GLY CA C 14.277 0.886 14.627 1.00 . A A . 39 GLY CA 1 1 16 28761 1 1 39 GLY H H 14.792 1.422 12.681 1.00 . A A . 39 GLY H 1 1 16 28762 1 1 39 GLY HA2 H 14.040 -0.051 15.131 1.00 . A A . 39 GLY HA2 1 1 16 28763 1 1 39 GLY HA3 H 15.097 1.346 15.179 1.00 . A A . 39 GLY HA3 1 1 16 28764 1 1 39 GLY N N 14.697 0.614 13.263 1.00 . A A . 39 GLY N 1 1 16 28765 1 1 39 GLY O O 12.595 2.205 15.720 1.00 . A A . 39 GLY O 1 1 16 28766 1 1 40 LYS C C 10.152 2.137 13.175 1.00 . A A . 40 LYS C 1 1 16 28767 1 1 40 LYS CA C 11.411 2.992 13.332 1.00 . A A . 40 LYS CA 1 1 16 28768 1 1 40 LYS CB C 11.618 3.996 12.196 1.00 . A A . 40 LYS CB 1 1 16 28769 1 1 40 LYS CD C 13.271 5.550 11.096 1.00 . A A . 40 LYS CD 1 1 16 28770 1 1 40 LYS CE C 14.512 5.352 10.224 1.00 . A A . 40 LYS CE 1 1 16 28771 1 1 40 LYS CG C 13.093 4.383 12.069 1.00 . A A . 40 LYS CG 1 1 16 28772 1 1 40 LYS H H 12.950 1.796 12.596 1.00 . A A . 40 LYS H 1 1 16 28773 1 1 40 LYS HA H 11.327 3.564 14.256 1.00 . A A . 40 LYS HA 1 1 16 28774 1 1 40 LYS HB2 H 11.269 3.566 11.257 1.00 . A A . 40 LYS HB2 1 1 16 28775 1 1 40 LYS HB3 H 11.019 4.888 12.380 1.00 . A A . 40 LYS HB3 1 1 16 28776 1 1 40 LYS HD2 H 12.388 5.640 10.464 1.00 . A A . 40 LYS HD2 1 1 16 28777 1 1 40 LYS HD3 H 13.360 6.483 11.654 1.00 . A A . 40 LYS HD3 1 1 16 28778 1 1 40 LYS HE2 H 14.521 6.089 9.421 1.00 . A A . 40 LYS HE2 1 1 16 28779 1 1 40 LYS HE3 H 15.412 5.516 10.817 1.00 . A A . 40 LYS HE3 1 1 16 28780 1 1 40 LYS HG2 H 13.486 4.657 13.048 1.00 . A A . 40 LYS HG2 1 1 16 28781 1 1 40 LYS HG3 H 13.670 3.525 11.723 1.00 . A A . 40 LYS HG3 1 1 16 28782 1 1 40 LYS HZ1 H 15.003 3.958 8.755 1.00 . A A . 40 LYS HZ1 1 1 16 28783 1 1 40 LYS HZ2 H 15.009 3.328 10.257 1.00 . A A . 40 LYS HZ2 1 1 16 28784 1 1 40 LYS N N 12.569 2.123 13.461 1.00 . A A . 40 LYS N 1 1 16 28785 1 1 40 LYS NZ N 14.531 3.987 9.652 1.00 . A A . 40 LYS NZ 1 1 16 28786 1 1 40 LYS O O 10.157 1.147 12.445 1.00 . A A . 40 LYS O 1 1 16 28787 1 1 41 GLU C C 6.818 2.494 14.746 1.00 . A A . 41 GLU C 1 1 16 28788 1 1 41 GLU CA C 7.840 1.834 13.819 1.00 . A A . 41 GLU CA 1 1 16 28789 1 1 41 GLU CB C 8.031 0.359 14.175 1.00 . A A . 41 GLU CB 1 1 16 28790 1 1 41 GLU CD C 6.106 -1.270 14.167 1.00 . A A . 41 GLU CD 1 1 16 28791 1 1 41 GLU CG C 7.138 -0.534 13.311 1.00 . A A . 41 GLU CG 1 1 16 28792 1 1 41 GLU H H 9.108 3.357 14.463 1.00 . A A . 41 GLU H 1 1 16 28793 1 1 41 GLU HA H 7.506 1.912 12.784 1.00 . A A . 41 GLU HA 1 1 16 28794 1 1 41 GLU HB2 H 9.075 0.079 14.035 1.00 . A A . 41 GLU HB2 1 1 16 28795 1 1 41 GLU HB3 H 7.798 0.202 15.228 1.00 . A A . 41 GLU HB3 1 1 16 28796 1 1 41 GLU HG2 H 6.629 0.072 12.561 1.00 . A A . 41 GLU HG2 1 1 16 28797 1 1 41 GLU HG3 H 7.752 -1.256 12.773 1.00 . A A . 41 GLU HG3 1 1 16 28798 1 1 41 GLU N N 9.104 2.550 13.872 1.00 . A A . 41 GLU N 1 1 16 28799 1 1 41 GLU O O 6.575 2.013 15.852 1.00 . A A . 41 GLU O 1 1 16 28800 1 1 41 GLU OE1 O 6.483 -2.319 14.733 1.00 . A A . 41 GLU OE1 1 1 16 28801 1 1 41 GLU OE2 O 4.964 -0.767 14.236 1.00 . A A . 41 GLU OE2 1 1 16 28802 1 1 42 ASP C C 4.147 4.808 14.097 1.00 . A A . 42 ASP C 1 1 16 28803 1 1 42 ASP CA C 5.254 4.317 15.032 1.00 . A A . 42 ASP CA 1 1 16 28804 1 1 42 ASP CB C 5.876 5.539 15.711 1.00 . A A . 42 ASP CB 1 1 16 28805 1 1 42 ASP CG C 6.271 6.674 14.764 1.00 . A A . 42 ASP CG 1 1 16 28806 1 1 42 ASP H H 6.447 3.971 13.361 1.00 . A A . 42 ASP H 1 1 16 28807 1 1 42 ASP HA H 4.889 3.608 15.775 1.00 . A A . 42 ASP HA 1 1 16 28808 1 1 42 ASP HB2 H 5.169 5.927 16.445 1.00 . A A . 42 ASP HB2 1 1 16 28809 1 1 42 ASP HB3 H 6.761 5.219 16.260 1.00 . A A . 42 ASP HB3 1 1 16 28810 1 1 42 ASP N N 6.245 3.586 14.261 1.00 . A A . 42 ASP N 1 1 16 28811 1 1 42 ASP O O 3.747 5.970 14.159 1.00 . A A . 42 ASP O 1 1 16 28812 1 1 42 ASP OD1 O 6.914 6.360 13.739 1.00 . A A . 42 ASP OD1 1 1 16 28813 1 1 42 ASP OD2 O 5.920 7.830 15.086 1.00 . A A . 42 ASP OD2 1 1 16 28814 1 1 43 TYR C C 2.908 5.560 11.616 1.00 . A A . 43 TYR C 1 1 16 28815 1 1 43 TYR CA C 2.629 4.224 12.307 1.00 . A A . 43 TYR CA 1 1 16 28816 1 1 43 TYR CB C 1.345 4.347 13.130 1.00 . A A . 43 TYR CB 1 1 16 28817 1 1 43 TYR CD1 C 1.783 2.036 14.037 1.00 . A A . 43 TYR CD1 1 1 16 28818 1 1 43 TYR CD2 C 0.456 3.533 15.344 1.00 . A A . 43 TYR CD2 1 1 16 28819 1 1 43 TYR CE1 C 1.637 1.022 15.049 1.00 . A A . 43 TYR CE1 1 1 16 28820 1 1 43 TYR CE2 C 0.309 2.519 16.356 1.00 . A A . 43 TYR CE2 1 1 16 28821 1 1 43 TYR CG C 1.190 3.270 14.205 1.00 . A A . 43 TYR CG 1 1 16 28822 1 1 43 TYR CZ C 0.907 1.314 16.159 1.00 . A A . 43 TYR CZ 1 1 16 28823 1 1 43 TYR H H 4.012 2.955 13.210 1.00 . A A . 43 TYR H 1 1 16 28824 1 1 43 TYR HA H 2.596 3.435 11.556 1.00 . A A . 43 TYR HA 1 1 16 28825 1 1 43 TYR HB2 H 1.324 5.328 13.606 1.00 . A A . 43 TYR HB2 1 1 16 28826 1 1 43 TYR HB3 H 0.489 4.301 12.457 1.00 . A A . 43 TYR HB3 1 1 16 28827 1 1 43 TYR HD1 H 2.363 1.828 13.137 1.00 . A A . 43 TYR HD1 1 1 16 28828 1 1 43 TYR HD2 H -0.013 4.508 15.477 1.00 . A A . 43 TYR HD2 1 1 16 28829 1 1 43 TYR HE1 H 2.101 0.043 14.928 1.00 . A A . 43 TYR HE1 1 1 16 28830 1 1 43 TYR HE2 H -0.268 2.714 17.260 1.00 . A A . 43 TYR HE2 1 1 16 28831 1 1 43 TYR HH H -0.132 -0.072 17.042 1.00 . A A . 43 TYR HH 1 1 16 28832 1 1 43 TYR N N 3.682 3.898 13.254 1.00 . A A . 43 TYR N 1 1 16 28833 1 1 43 TYR O O 2.475 6.610 12.088 1.00 . A A . 43 TYR O 1 1 16 28834 1 1 43 TYR OH O 0.769 0.356 17.115 1.00 . A A . 43 TYR OH 1 1 16 28835 1 1 44 ARG C C 3.507 6.521 8.296 1.00 . A A . 44 ARG C 1 1 16 28836 1 1 44 ARG CA C 3.971 6.667 9.747 1.00 . A A . 44 ARG CA 1 1 16 28837 1 1 44 ARG CB C 5.480 6.921 9.769 1.00 . A A . 44 ARG CB 1 1 16 28838 1 1 44 ARG CD C 7.299 8.370 10.744 1.00 . A A . 44 ARG CD 1 1 16 28839 1 1 44 ARG CG C 5.802 8.253 10.449 1.00 . A A . 44 ARG CG 1 1 16 28840 1 1 44 ARG CZ C 7.889 10.788 10.501 1.00 . A A . 44 ARG CZ 1 1 16 28841 1 1 44 ARG H H 3.978 4.620 10.130 1.00 . A A . 44 ARG H 1 1 16 28842 1 1 44 ARG HA H 3.444 7.479 10.247 1.00 . A A . 44 ARG HA 1 1 16 28843 1 1 44 ARG HB2 H 5.981 6.109 10.296 1.00 . A A . 44 ARG HB2 1 1 16 28844 1 1 44 ARG HB3 H 5.867 6.925 8.750 1.00 . A A . 44 ARG HB3 1 1 16 28845 1 1 44 ARG HD2 H 7.459 8.487 11.816 1.00 . A A . 44 ARG HD2 1 1 16 28846 1 1 44 ARG HD3 H 7.810 7.455 10.444 1.00 . A A . 44 ARG HD3 1 1 16 28847 1 1 44 ARG HE H 8.265 9.365 9.114 1.00 . A A . 44 ARG HE 1 1 16 28848 1 1 44 ARG HG2 H 5.489 9.077 9.808 1.00 . A A . 44 ARG HG2 1 1 16 28849 1 1 44 ARG HG3 H 5.237 8.337 11.377 1.00 . A A . 44 ARG HG3 1 1 16 28850 1 1 44 ARG HH11 H 6.965 10.333 12.265 1.00 . A A . 44 ARG HH11 1 1 16 28851 1 1 44 ARG HH12 H 7.387 12.001 12.066 1.00 . A A . 44 ARG HH12 1 1 16 28852 1 1 44 ARG HH21 H 8.478 12.703 10.050 1.00 . A A . 44 ARG HH21 1 1 16 28853 1 1 44 ARG N N 3.629 5.478 10.507 1.00 . A A . 44 ARG N 1 1 16 28854 1 1 44 ARG NE N 7.869 9.527 10.019 1.00 . A A . 44 ARG NE 1 1 16 28855 1 1 44 ARG NH1 N 7.369 11.065 11.715 1.00 . A A . 44 ARG NH1 1 1 16 28856 1 1 44 ARG NH2 N 8.424 11.745 9.767 1.00 . A A . 44 ARG NH2 1 1 16 28857 1 1 44 ARG O O 3.024 5.462 7.899 1.00 . A A . 44 ARG O 1 1 16 28858 1 1 45 LYS C C 4.362 6.933 5.309 1.00 . A A . 45 LYS C 1 1 16 28859 1 1 45 LYS CA C 3.273 7.606 6.147 1.00 . A A . 45 LYS CA 1 1 16 28860 1 1 45 LYS CB C 2.937 9.027 5.691 1.00 . A A . 45 LYS CB 1 1 16 28861 1 1 45 LYS CD C 2.218 10.519 7.593 1.00 . A A . 45 LYS CD 1 1 16 28862 1 1 45 LYS CE C 1.144 11.554 7.932 1.00 . A A . 45 LYS CE 1 1 16 28863 1 1 45 LYS CG C 1.748 9.588 6.474 1.00 . A A . 45 LYS CG 1 1 16 28864 1 1 45 LYS H H 4.064 8.458 7.876 1.00 . A A . 45 LYS H 1 1 16 28865 1 1 45 LYS HA H 2.360 7.017 6.064 1.00 . A A . 45 LYS HA 1 1 16 28866 1 1 45 LYS HB2 H 3.805 9.672 5.829 1.00 . A A . 45 LYS HB2 1 1 16 28867 1 1 45 LYS HB3 H 2.708 9.026 4.625 1.00 . A A . 45 LYS HB3 1 1 16 28868 1 1 45 LYS HD2 H 2.457 9.934 8.481 1.00 . A A . 45 LYS HD2 1 1 16 28869 1 1 45 LYS HD3 H 3.134 11.026 7.289 1.00 . A A . 45 LYS HD3 1 1 16 28870 1 1 45 LYS HE2 H 0.203 11.280 7.456 1.00 . A A . 45 LYS HE2 1 1 16 28871 1 1 45 LYS HE3 H 0.966 11.563 9.008 1.00 . A A . 45 LYS HE3 1 1 16 28872 1 1 45 LYS HG2 H 1.087 10.130 5.798 1.00 . A A . 45 LYS HG2 1 1 16 28873 1 1 45 LYS HG3 H 1.168 8.768 6.897 1.00 . A A . 45 LYS HG3 1 1 16 28874 1 1 45 LYS HZ1 H 1.230 13.107 6.545 1.00 . A A . 45 LYS HZ1 1 1 16 28875 1 1 45 LYS HZ2 H 1.205 13.631 8.087 1.00 . A A . 45 LYS HZ2 1 1 16 28876 1 1 45 LYS N N 3.670 7.600 7.545 1.00 . A A . 45 LYS N 1 1 16 28877 1 1 45 LYS NZ N 1.561 12.900 7.481 1.00 . A A . 45 LYS NZ 1 1 16 28878 1 1 45 LYS O O 5.541 7.258 5.440 1.00 . A A . 45 LYS O 1 1 16 28879 1 1 46 CYS C C 5.577 6.298 2.722 1.00 . A A . 46 CYS C 1 1 16 28880 1 1 46 CYS CA C 4.852 5.284 3.609 1.00 . A A . 46 CYS CA 1 1 16 28881 1 1 46 CYS CB C 4.136 4.213 2.783 1.00 . A A . 46 CYS CB 1 1 16 28882 1 1 46 CYS H H 2.968 5.748 4.366 1.00 . A A . 46 CYS H 1 1 16 28883 1 1 46 CYS HA H 5.555 4.772 4.266 1.00 . A A . 46 CYS HA 1 1 16 28884 1 1 46 CYS HB2 H 3.733 4.677 1.883 1.00 . A A . 46 CYS HB2 1 1 16 28885 1 1 46 CYS HB3 H 4.869 3.474 2.459 1.00 . A A . 46 CYS HB3 1 1 16 28886 1 1 46 CYS N N 3.928 6.006 4.467 1.00 . A A . 46 CYS N 1 1 16 28887 1 1 46 CYS O O 6.797 6.241 2.577 1.00 . A A . 46 CYS O 1 1 16 28888 1 1 46 CYS SG S 2.779 3.350 3.656 1.00 . A A . 46 CYS SG 1 1 16 28889 1 1 47 GLY C C 6.001 9.347 2.101 1.00 . A A . 47 GLY C 1 1 16 28890 1 1 47 GLY CA C 5.348 8.230 1.284 1.00 . A A . 47 GLY CA 1 1 16 28891 1 1 47 GLY H H 3.804 7.244 2.276 1.00 . A A . 47 GLY H 1 1 16 28892 1 1 47 GLY HA2 H 6.085 7.786 0.615 1.00 . A A . 47 GLY HA2 1 1 16 28893 1 1 47 GLY HA3 H 4.558 8.646 0.659 1.00 . A A . 47 GLY HA3 1 1 16 28894 1 1 47 GLY N N 4.795 7.204 2.153 1.00 . A A . 47 GLY N 1 1 16 28895 1 1 47 GLY O O 5.708 10.524 1.895 1.00 . A A . 47 GLY O 1 1 16 28896 1 1 48 THR C C 8.931 10.243 3.260 1.00 . A A . 48 THR C 1 1 16 28897 1 1 48 THR CA C 7.569 9.890 3.860 1.00 . A A . 48 THR CA 1 1 16 28898 1 1 48 THR CB C 7.661 9.291 5.265 1.00 . A A . 48 THR CB 1 1 16 28899 1 1 48 THR CG2 C 8.726 9.975 6.125 1.00 . A A . 48 THR CG2 1 1 16 28900 1 1 48 THR H H 7.105 7.979 3.172 1.00 . A A . 48 THR H 1 1 16 28901 1 1 48 THR HA H 6.987 10.810 3.895 1.00 . A A . 48 THR HA 1 1 16 28902 1 1 48 THR HB H 7.831 8.215 5.219 1.00 . A A . 48 THR HB 1 1 16 28903 1 1 48 THR HG1 H 6.361 10.653 5.941 1.00 . A A . 48 THR HG1 1 1 16 28904 1 1 48 THR HG21 H 8.795 11.027 5.848 1.00 . A A . 48 THR HG21 1 1 16 28905 1 1 48 THR HG22 H 8.452 9.893 7.176 1.00 . A A . 48 THR HG22 1 1 16 28906 1 1 48 THR HG23 H 9.690 9.493 5.962 1.00 . A A . 48 THR HG23 1 1 16 28907 1 1 48 THR N N 6.873 8.938 3.011 1.00 . A A . 48 THR N 1 1 16 28908 1 1 48 THR O O 9.693 9.357 2.874 1.00 . A A . 48 THR O 1 1 16 28909 1 1 48 THR OG1 O 6.430 9.658 5.880 1.00 . A A . 48 THR OG1 1 1 16 28910 1 1 49 ALA C C 11.616 11.353 3.390 1.00 . A A . 49 ALA C 1 1 16 28911 1 1 49 ALA CA C 10.454 12.021 2.652 1.00 . A A . 49 ALA CA 1 1 16 28912 1 1 49 ALA CB C 10.502 13.547 2.749 1.00 . A A . 49 ALA CB 1 1 16 28913 1 1 49 ALA H H 8.573 12.254 3.516 1.00 . A A . 49 ALA H 1 1 16 28914 1 1 49 ALA HA H 10.490 11.735 1.601 1.00 . A A . 49 ALA HA 1 1 16 28915 1 1 49 ALA HB1 H 10.113 13.862 3.717 1.00 . A A . 49 ALA HB1 1 1 16 28916 1 1 49 ALA HB2 H 11.533 13.886 2.644 1.00 . A A . 49 ALA HB2 1 1 16 28917 1 1 49 ALA HB3 H 9.895 13.981 1.955 1.00 . A A . 49 ALA HB3 1 1 16 28918 1 1 49 ALA N N 9.197 11.540 3.199 1.00 . A A . 49 ALA N 1 1 16 28919 1 1 49 ALA O O 11.881 11.666 4.550 1.00 . A A . 49 ALA O 1 1 16 28920 1 1 50 GLY C C 13.121 8.229 3.336 1.00 . A A . 50 GLY C 1 1 16 28921 1 1 50 GLY CA C 13.405 9.731 3.262 1.00 . A A . 50 GLY CA 1 1 16 28922 1 1 50 GLY H H 12.056 10.197 1.745 1.00 . A A . 50 GLY H 1 1 16 28923 1 1 50 GLY HA2 H 14.297 9.907 2.660 1.00 . A A . 50 GLY HA2 1 1 16 28924 1 1 50 GLY HA3 H 13.613 10.115 4.260 1.00 . A A . 50 GLY HA3 1 1 16 28925 1 1 50 GLY N N 12.278 10.446 2.688 1.00 . A A . 50 GLY N 1 1 16 28926 1 1 50 GLY O O 14.028 7.433 3.576 1.00 . A A . 50 GLY O 1 1 16 28927 1 1 51 CYS C C 11.201 6.024 1.730 1.00 . A A . 51 CYS C 1 1 16 28928 1 1 51 CYS CA C 11.444 6.494 3.165 1.00 . A A . 51 CYS CA 1 1 16 28929 1 1 51 CYS CB C 10.210 6.297 4.047 1.00 . A A . 51 CYS CB 1 1 16 28930 1 1 51 CYS H H 11.127 8.540 2.930 1.00 . A A . 51 CYS H 1 1 16 28931 1 1 51 CYS HA H 12.262 5.937 3.622 1.00 . A A . 51 CYS HA 1 1 16 28932 1 1 51 CYS HB2 H 9.412 6.967 3.726 1.00 . A A . 51 CYS HB2 1 1 16 28933 1 1 51 CYS HB3 H 9.834 5.279 3.939 1.00 . A A . 51 CYS HB3 1 1 16 28934 1 1 51 CYS N N 11.859 7.886 3.125 1.00 . A A . 51 CYS N 1 1 16 28935 1 1 51 CYS O O 12.123 5.560 1.060 1.00 . A A . 51 CYS O 1 1 16 28936 1 1 51 CYS SG S 10.632 6.624 5.798 1.00 . A A . 51 CYS SG 1 1 16 28937 1 1 52 HIS C C 9.329 6.994 -0.904 1.00 . A A . 52 HIS C 1 1 16 28938 1 1 52 HIS CA C 9.580 5.754 -0.044 1.00 . A A . 52 HIS CA 1 1 16 28939 1 1 52 HIS CB C 8.381 4.804 -0.009 1.00 . A A . 52 HIS CB 1 1 16 28940 1 1 52 HIS CD2 C 8.266 2.914 1.793 1.00 . A A . 52 HIS CD2 1 1 16 28941 1 1 52 HIS CE1 C 9.556 1.455 0.797 1.00 . A A . 52 HIS CE1 1 1 16 28942 1 1 52 HIS CG C 8.679 3.461 0.614 1.00 . A A . 52 HIS CG 1 1 16 28943 1 1 52 HIS H H 9.212 6.538 1.850 1.00 . A A . 52 HIS H 1 1 16 28944 1 1 52 HIS HA H 10.427 5.204 -0.453 1.00 . A A . 52 HIS HA 1 1 16 28945 1 1 52 HIS HB2 H 7.571 5.278 0.545 1.00 . A A . 52 HIS HB2 1 1 16 28946 1 1 52 HIS HB3 H 8.023 4.649 -1.027 1.00 . A A . 52 HIS HB3 1 1 16 28947 1 1 52 HIS HD1 H 9.951 2.621 -0.873 1.00 . A A . 52 HIS HD1 1 1 16 28948 1 1 52 HIS HD2 H 7.612 3.392 2.522 1.00 . A A . 52 HIS HD2 1 1 16 28949 1 1 52 HIS HE1 H 10.119 0.543 0.598 1.00 . A A . 52 HIS HE1 1 1 16 28950 1 1 52 HIS N N 9.956 6.159 1.299 1.00 . A A . 52 HIS N 1 1 16 28951 1 1 52 HIS ND1 N 9.491 2.518 0.009 1.00 . A A . 52 HIS ND1 1 1 16 28952 1 1 52 HIS NE2 N 8.796 1.702 1.902 1.00 . A A . 52 HIS NE2 1 1 16 28953 1 1 52 HIS O O 8.203 7.236 -1.337 1.00 . A A . 52 HIS O 1 1 16 28954 1 1 53 ASP C C 11.348 8.903 -3.043 1.00 . A A . 53 ASP C 1 1 16 28955 1 1 53 ASP CA C 10.306 8.957 -1.924 1.00 . A A . 53 ASP CA 1 1 16 28956 1 1 53 ASP CB C 10.586 10.200 -1.077 1.00 . A A . 53 ASP CB 1 1 16 28957 1 1 53 ASP CG C 9.880 11.474 -1.544 1.00 . A A . 53 ASP CG 1 1 16 28958 1 1 53 ASP H H 11.308 7.543 -0.769 1.00 . A A . 53 ASP H 1 1 16 28959 1 1 53 ASP HA H 9.285 8.973 -2.306 1.00 . A A . 53 ASP HA 1 1 16 28960 1 1 53 ASP HB2 H 10.289 9.994 -0.049 1.00 . A A . 53 ASP HB2 1 1 16 28961 1 1 53 ASP HB3 H 11.661 10.380 -1.069 1.00 . A A . 53 ASP HB3 1 1 16 28962 1 1 53 ASP N N 10.396 7.747 -1.125 1.00 . A A . 53 ASP N 1 1 16 28963 1 1 53 ASP O O 12.388 9.554 -2.960 1.00 . A A . 53 ASP O 1 1 16 28964 1 1 53 ASP OD1 O 8.945 11.337 -2.363 1.00 . A A . 53 ASP OD1 1 1 16 28965 1 1 53 ASP OD2 O 10.291 12.556 -1.073 1.00 . A A . 53 ASP OD2 1 1 16 28966 1 1 54 SER C C 11.352 8.692 -6.419 1.00 . A A . 54 SER C 1 1 16 28967 1 1 54 SER CA C 11.929 7.972 -5.199 1.00 . A A . 54 SER CA 1 1 16 28968 1 1 54 SER CB C 12.172 6.496 -5.520 1.00 . A A . 54 SER CB 1 1 16 28969 1 1 54 SER H H 10.184 7.594 -4.125 1.00 . A A . 54 SER H 1 1 16 28970 1 1 54 SER HA H 12.865 8.435 -4.889 1.00 . A A . 54 SER HA 1 1 16 28971 1 1 54 SER HB2 H 12.138 5.914 -4.598 1.00 . A A . 54 SER HB2 1 1 16 28972 1 1 54 SER HB3 H 11.370 6.127 -6.159 1.00 . A A . 54 SER HB3 1 1 16 28973 1 1 54 SER HG H 13.492 5.345 -6.488 1.00 . A A . 54 SER HG 1 1 16 28974 1 1 54 SER N N 11.032 8.120 -4.065 1.00 . A A . 54 SER N 1 1 16 28975 1 1 54 SER O O 12.098 9.209 -7.249 1.00 . A A . 54 SER O 1 1 16 28976 1 1 54 SER OG O 13.425 6.289 -6.165 1.00 . A A . 54 SER OG 1 1 16 28977 1 1 55 MET C C 9.804 8.778 -8.937 1.00 . A A . 55 MET C 1 1 16 28978 1 1 55 MET CA C 9.343 9.351 -7.595 1.00 . A A . 55 MET CA 1 1 16 28979 1 1 55 MET CB C 9.623 10.854 -7.558 1.00 . A A . 55 MET CB 1 1 16 28980 1 1 55 MET CE C 7.644 10.274 -4.799 1.00 . A A . 55 MET CE 1 1 16 28981 1 1 55 MET CG C 8.405 11.627 -7.050 1.00 . A A . 55 MET CG 1 1 16 28982 1 1 55 MET H H 9.429 8.280 -5.810 1.00 . A A . 55 MET H 1 1 16 28983 1 1 55 MET HA H 8.284 9.141 -7.446 1.00 . A A . 55 MET HA 1 1 16 28984 1 1 55 MET HB2 H 10.479 11.053 -6.913 1.00 . A A . 55 MET HB2 1 1 16 28985 1 1 55 MET HB3 H 9.889 11.203 -8.557 1.00 . A A . 55 MET HB3 1 1 16 28986 1 1 55 MET HE1 H 7.306 9.749 -5.692 1.00 . A A . 55 MET HE1 1 1 16 28987 1 1 55 MET HE2 H 8.333 9.638 -4.243 1.00 . A A . 55 MET HE2 1 1 16 28988 1 1 55 MET HE3 H 6.786 10.515 -4.172 1.00 . A A . 55 MET HE3 1 1 16 28989 1 1 55 MET HG2 H 8.374 12.616 -7.508 1.00 . A A . 55 MET HG2 1 1 16 28990 1 1 55 MET HG3 H 7.489 11.112 -7.343 1.00 . A A . 55 MET HG3 1 1 16 28991 1 1 55 MET N N 10.029 8.703 -6.490 1.00 . A A . 55 MET N 1 1 16 28992 1 1 55 MET O O 9.902 9.504 -9.925 1.00 . A A . 55 MET O 1 1 16 28993 1 1 55 MET SD S 8.476 11.780 -5.273 1.00 . A A . 55 MET SD 1 1 16 28994 1 1 56 ASP C C 9.823 5.445 -10.238 1.00 . A A . 56 ASP C 1 1 16 28995 1 1 56 ASP CA C 10.521 6.802 -10.133 1.00 . A A . 56 ASP CA 1 1 16 28996 1 1 56 ASP CB C 12.031 6.556 -10.097 1.00 . A A . 56 ASP CB 1 1 16 28997 1 1 56 ASP CG C 12.712 6.512 -11.467 1.00 . A A . 56 ASP CG 1 1 16 28998 1 1 56 ASP H H 9.991 6.897 -8.121 1.00 . A A . 56 ASP H 1 1 16 28999 1 1 56 ASP HA H 10.259 7.471 -10.953 1.00 . A A . 56 ASP HA 1 1 16 29000 1 1 56 ASP HB2 H 12.498 7.339 -9.501 1.00 . A A . 56 ASP HB2 1 1 16 29001 1 1 56 ASP HB3 H 12.218 5.612 -9.585 1.00 . A A . 56 ASP HB3 1 1 16 29002 1 1 56 ASP N N 10.073 7.481 -8.929 1.00 . A A . 56 ASP N 1 1 16 29003 1 1 56 ASP O O 10.386 4.422 -9.852 1.00 . A A . 56 ASP O 1 1 16 29004 1 1 56 ASP OD1 O 11.974 6.610 -12.471 1.00 . A A . 56 ASP OD1 1 1 16 29005 1 1 56 ASP OD2 O 13.955 6.381 -11.479 1.00 . A A . 56 ASP OD2 1 1 16 29006 1 1 57 LYS C C 8.695 3.187 -11.573 1.00 . A A . 57 LYS C 1 1 16 29007 1 1 57 LYS CA C 7.826 4.266 -10.923 1.00 . A A . 57 LYS CA 1 1 16 29008 1 1 57 LYS CB C 6.533 4.557 -11.688 1.00 . A A . 57 LYS CB 1 1 16 29009 1 1 57 LYS CD C 5.971 3.096 -13.665 1.00 . A A . 57 LYS CD 1 1 16 29010 1 1 57 LYS CE C 4.597 3.214 -14.328 1.00 . A A . 57 LYS CE 1 1 16 29011 1 1 57 LYS CG C 5.863 3.260 -12.148 1.00 . A A . 57 LYS CG 1 1 16 29012 1 1 57 LYS H H 8.156 6.317 -11.075 1.00 . A A . 57 LYS H 1 1 16 29013 1 1 57 LYS HA H 7.541 3.926 -9.927 1.00 . A A . 57 LYS HA 1 1 16 29014 1 1 57 LYS HB2 H 5.848 5.118 -11.052 1.00 . A A . 57 LYS HB2 1 1 16 29015 1 1 57 LYS HB3 H 6.751 5.184 -12.552 1.00 . A A . 57 LYS HB3 1 1 16 29016 1 1 57 LYS HD2 H 6.641 3.855 -14.070 1.00 . A A . 57 LYS HD2 1 1 16 29017 1 1 57 LYS HD3 H 6.409 2.126 -13.899 1.00 . A A . 57 LYS HD3 1 1 16 29018 1 1 57 LYS HE2 H 4.587 2.649 -15.260 1.00 . A A . 57 LYS HE2 1 1 16 29019 1 1 57 LYS HE3 H 3.836 2.777 -13.682 1.00 . A A . 57 LYS HE3 1 1 16 29020 1 1 57 LYS HG2 H 6.332 2.410 -11.652 1.00 . A A . 57 LYS HG2 1 1 16 29021 1 1 57 LYS HG3 H 4.814 3.264 -11.852 1.00 . A A . 57 LYS HG3 1 1 16 29022 1 1 57 LYS HZ1 H 5.105 5.192 -14.745 1.00 . A A . 57 LYS HZ1 1 1 16 29023 1 1 57 LYS HZ2 H 3.695 4.740 -15.424 1.00 . A A . 57 LYS HZ2 1 1 16 29024 1 1 57 LYS N N 8.607 5.480 -10.763 1.00 . A A . 57 LYS N 1 1 16 29025 1 1 57 LYS NZ N 4.272 4.633 -14.597 1.00 . A A . 57 LYS NZ 1 1 16 29026 1 1 57 LYS O O 8.818 2.083 -11.046 1.00 . A A . 57 LYS O 1 1 16 29027 1 1 58 LYS C C 11.460 2.474 -12.698 1.00 . A A . 58 LYS C 1 1 16 29028 1 1 58 LYS CA C 10.129 2.622 -13.437 1.00 . A A . 58 LYS CA 1 1 16 29029 1 1 58 LYS CB C 10.280 3.067 -14.893 1.00 . A A . 58 LYS CB 1 1 16 29030 1 1 58 LYS CD C 11.015 2.247 -17.162 1.00 . A A . 58 LYS CD 1 1 16 29031 1 1 58 LYS CE C 11.954 3.281 -17.786 1.00 . A A . 58 LYS CE 1 1 16 29032 1 1 58 LYS CG C 11.237 2.145 -15.652 1.00 . A A . 58 LYS CG 1 1 16 29033 1 1 58 LYS H H 9.170 4.446 -13.131 1.00 . A A . 58 LYS H 1 1 16 29034 1 1 58 LYS HA H 9.629 1.653 -13.447 1.00 . A A . 58 LYS HA 1 1 16 29035 1 1 58 LYS HB2 H 9.305 3.066 -15.381 1.00 . A A . 58 LYS HB2 1 1 16 29036 1 1 58 LYS HB3 H 10.652 4.091 -14.928 1.00 . A A . 58 LYS HB3 1 1 16 29037 1 1 58 LYS HD2 H 11.182 1.274 -17.624 1.00 . A A . 58 LYS HD2 1 1 16 29038 1 1 58 LYS HD3 H 9.980 2.522 -17.363 1.00 . A A . 58 LYS HD3 1 1 16 29039 1 1 58 LYS HE2 H 11.727 4.272 -17.391 1.00 . A A . 58 LYS HE2 1 1 16 29040 1 1 58 LYS HE3 H 12.985 3.057 -17.511 1.00 . A A . 58 LYS HE3 1 1 16 29041 1 1 58 LYS HG2 H 12.267 2.409 -15.413 1.00 . A A . 58 LYS HG2 1 1 16 29042 1 1 58 LYS HG3 H 11.089 1.115 -15.327 1.00 . A A . 58 LYS HG3 1 1 16 29043 1 1 58 LYS HZ1 H 10.865 3.478 -19.552 1.00 . A A . 58 LYS HZ1 1 1 16 29044 1 1 58 LYS HZ2 H 12.406 3.985 -19.694 1.00 . A A . 58 LYS HZ2 1 1 16 29045 1 1 58 LYS N N 9.275 3.545 -12.709 1.00 . A A . 58 LYS N 1 1 16 29046 1 1 58 LYS NZ N 11.816 3.284 -19.259 1.00 . A A . 58 LYS NZ 1 1 16 29047 1 1 58 LYS O O 12.518 2.764 -13.253 1.00 . A A . 58 LYS O 1 1 16 29048 1 1 59 ASP C C 12.191 0.961 -9.429 1.00 . A A . 59 ASP C 1 1 16 29049 1 1 59 ASP CA C 12.547 1.834 -10.634 1.00 . A A . 59 ASP CA 1 1 16 29050 1 1 59 ASP CB C 13.074 3.171 -10.111 1.00 . A A . 59 ASP CB 1 1 16 29051 1 1 59 ASP CG C 14.553 3.175 -9.721 1.00 . A A . 59 ASP CG 1 1 16 29052 1 1 59 ASP H H 10.499 1.789 -11.011 1.00 . A A . 59 ASP H 1 1 16 29053 1 1 59 ASP HA H 13.278 1.361 -11.290 1.00 . A A . 59 ASP HA 1 1 16 29054 1 1 59 ASP HB2 H 12.913 3.932 -10.875 1.00 . A A . 59 ASP HB2 1 1 16 29055 1 1 59 ASP HB3 H 12.484 3.462 -9.242 1.00 . A A . 59 ASP HB3 1 1 16 29056 1 1 59 ASP N N 11.363 2.023 -11.456 1.00 . A A . 59 ASP N 1 1 16 29057 1 1 59 ASP O O 11.821 1.475 -8.374 1.00 . A A . 59 ASP O 1 1 16 29058 1 1 59 ASP OD1 O 14.959 2.223 -9.021 1.00 . A A . 59 ASP OD1 1 1 16 29059 1 1 59 ASP OD2 O 15.246 4.131 -10.132 1.00 . A A . 59 ASP OD2 1 1 16 29060 1 1 60 LYS C C 13.267 -1.526 -7.723 1.00 . A A . 60 LYS C 1 1 16 29061 1 1 60 LYS CA C 12.013 -1.292 -8.568 1.00 . A A . 60 LYS CA 1 1 16 29062 1 1 60 LYS CB C 11.417 -2.574 -9.152 1.00 . A A . 60 LYS CB 1 1 16 29063 1 1 60 LYS CD C 12.410 -3.036 -11.424 1.00 . A A . 60 LYS CD 1 1 16 29064 1 1 60 LYS CE C 13.812 -2.816 -11.996 1.00 . A A . 60 LYS CE 1 1 16 29065 1 1 60 LYS CG C 12.472 -3.363 -9.931 1.00 . A A . 60 LYS CG 1 1 16 29066 1 1 60 LYS H H 12.619 -0.752 -10.486 1.00 . A A . 60 LYS H 1 1 16 29067 1 1 60 LYS HA H 11.249 -0.841 -7.934 1.00 . A A . 60 LYS HA 1 1 16 29068 1 1 60 LYS HB2 H 11.015 -3.192 -8.350 1.00 . A A . 60 LYS HB2 1 1 16 29069 1 1 60 LYS HB3 H 10.585 -2.325 -9.811 1.00 . A A . 60 LYS HB3 1 1 16 29070 1 1 60 LYS HD2 H 11.919 -3.850 -11.958 1.00 . A A . 60 LYS HD2 1 1 16 29071 1 1 60 LYS HD3 H 11.805 -2.143 -11.580 1.00 . A A . 60 LYS HD3 1 1 16 29072 1 1 60 LYS HE2 H 14.104 -1.774 -11.866 1.00 . A A . 60 LYS HE2 1 1 16 29073 1 1 60 LYS HE3 H 14.534 -3.420 -11.447 1.00 . A A . 60 LYS HE3 1 1 16 29074 1 1 60 LYS HG2 H 13.464 -3.129 -9.545 1.00 . A A . 60 LYS HG2 1 1 16 29075 1 1 60 LYS HG3 H 12.315 -4.431 -9.782 1.00 . A A . 60 LYS HG3 1 1 16 29076 1 1 60 LYS HZ1 H 13.573 -4.136 -13.591 1.00 . A A . 60 LYS HZ1 1 1 16 29077 1 1 60 LYS HZ2 H 13.223 -2.594 -13.983 1.00 . A A . 60 LYS HZ2 1 1 16 29078 1 1 60 LYS N N 12.317 -0.343 -9.625 1.00 . A A . 60 LYS N 1 1 16 29079 1 1 60 LYS NZ N 13.848 -3.173 -13.432 1.00 . A A . 60 LYS NZ 1 1 16 29080 1 1 60 LYS O O 14.374 -1.595 -8.254 1.00 . A A . 60 LYS O 1 1 16 29081 1 1 61 SER C C 13.640 -1.818 -4.055 1.00 . A A . 61 SER C 1 1 16 29082 1 1 61 SER CA C 14.150 -1.865 -5.497 1.00 . A A . 61 SER CA 1 1 16 29083 1 1 61 SER CB C 15.261 -0.833 -5.701 1.00 . A A . 61 SER CB 1 1 16 29084 1 1 61 SER H H 12.148 -1.584 -5.996 1.00 . A A . 61 SER H 1 1 16 29085 1 1 61 SER HA H 14.530 -2.859 -5.736 1.00 . A A . 61 SER HA 1 1 16 29086 1 1 61 SER HB2 H 16.007 -0.943 -4.914 1.00 . A A . 61 SER HB2 1 1 16 29087 1 1 61 SER HB3 H 15.766 -1.026 -6.648 1.00 . A A . 61 SER HB3 1 1 16 29088 1 1 61 SER HG H 15.358 1.089 -5.153 1.00 . A A . 61 SER HG 1 1 16 29089 1 1 61 SER N N 13.051 -1.641 -6.420 1.00 . A A . 61 SER N 1 1 16 29090 1 1 61 SER O O 13.754 -2.798 -3.320 1.00 . A A . 61 SER O 1 1 16 29091 1 1 61 SER OG O 14.758 0.500 -5.695 1.00 . A A . 61 SER OG 1 1 16 29092 1 1 62 ALA C C 12.053 0.955 -2.207 1.00 . A A . 62 ALA C 1 1 16 29093 1 1 62 ALA CA C 12.561 -0.481 -2.353 1.00 . A A . 62 ALA CA 1 1 16 29094 1 1 62 ALA CB C 13.643 -0.823 -1.326 1.00 . A A . 62 ALA CB 1 1 16 29095 1 1 62 ALA H H 13.000 0.123 -4.298 1.00 . A A . 62 ALA H 1 1 16 29096 1 1 62 ALA HA H 11.726 -1.168 -2.226 1.00 . A A . 62 ALA HA 1 1 16 29097 1 1 62 ALA HB1 H 14.588 -0.374 -1.630 1.00 . A A . 62 ALA HB1 1 1 16 29098 1 1 62 ALA HB2 H 13.353 -0.434 -0.350 1.00 . A A . 62 ALA HB2 1 1 16 29099 1 1 62 ALA HB3 H 13.757 -1.906 -1.267 1.00 . A A . 62 ALA HB3 1 1 16 29100 1 1 62 ALA N N 13.089 -0.669 -3.694 1.00 . A A . 62 ALA N 1 1 16 29101 1 1 62 ALA O O 10.937 1.177 -1.738 1.00 . A A . 62 ALA O 1 1 16 29102 1 1 63 LYS C C 11.359 3.579 -3.461 1.00 . A A . 63 LYS C 1 1 16 29103 1 1 63 LYS CA C 12.545 3.300 -2.536 1.00 . A A . 63 LYS CA 1 1 16 29104 1 1 63 LYS CB C 13.768 4.174 -2.823 1.00 . A A . 63 LYS CB 1 1 16 29105 1 1 63 LYS CD C 14.635 5.763 -1.067 1.00 . A A . 63 LYS CD 1 1 16 29106 1 1 63 LYS CE C 15.169 5.843 0.364 1.00 . A A . 63 LYS CE 1 1 16 29107 1 1 63 LYS CG C 14.642 4.320 -1.575 1.00 . A A . 63 LYS CG 1 1 16 29108 1 1 63 LYS H H 13.800 1.703 -2.996 1.00 . A A . 63 LYS H 1 1 16 29109 1 1 63 LYS HA H 12.238 3.502 -1.510 1.00 . A A . 63 LYS HA 1 1 16 29110 1 1 63 LYS HB2 H 14.352 3.734 -3.631 1.00 . A A . 63 LYS HB2 1 1 16 29111 1 1 63 LYS HB3 H 13.444 5.158 -3.162 1.00 . A A . 63 LYS HB3 1 1 16 29112 1 1 63 LYS HD2 H 15.244 6.386 -1.722 1.00 . A A . 63 LYS HD2 1 1 16 29113 1 1 63 LYS HD3 H 13.620 6.160 -1.103 1.00 . A A . 63 LYS HD3 1 1 16 29114 1 1 63 LYS HE2 H 14.426 5.451 1.059 1.00 . A A . 63 LYS HE2 1 1 16 29115 1 1 63 LYS HE3 H 16.057 5.219 0.463 1.00 . A A . 63 LYS HE3 1 1 16 29116 1 1 63 LYS HG2 H 14.279 3.653 -0.793 1.00 . A A . 63 LYS HG2 1 1 16 29117 1 1 63 LYS HG3 H 15.663 4.016 -1.805 1.00 . A A . 63 LYS HG3 1 1 16 29118 1 1 63 LYS HZ1 H 16.252 7.610 0.150 1.00 . A A . 63 LYS HZ1 1 1 16 29119 1 1 63 LYS HZ2 H 14.705 7.862 0.590 1.00 . A A . 63 LYS HZ2 1 1 16 29120 1 1 63 LYS N N 12.895 1.892 -2.616 1.00 . A A . 63 LYS N 1 1 16 29121 1 1 63 LYS NZ N 15.497 7.242 0.718 1.00 . A A . 63 LYS NZ 1 1 16 29122 1 1 63 LYS O O 10.670 4.587 -3.307 1.00 . A A . 63 LYS O 1 1 16 29123 1 1 64 GLY C C 8.711 2.743 -4.645 1.00 . A A . 64 GLY C 1 1 16 29124 1 1 64 GLY CA C 10.066 2.806 -5.353 1.00 . A A . 64 GLY CA 1 1 16 29125 1 1 64 GLY H H 11.721 1.852 -4.521 1.00 . A A . 64 GLY H 1 1 16 29126 1 1 64 GLY HA2 H 10.159 3.752 -5.886 1.00 . A A . 64 GLY HA2 1 1 16 29127 1 1 64 GLY HA3 H 10.127 2.013 -6.099 1.00 . A A . 64 GLY HA3 1 1 16 29128 1 1 64 GLY N N 11.156 2.669 -4.403 1.00 . A A . 64 GLY N 1 1 16 29129 1 1 64 GLY O O 8.163 1.661 -4.440 1.00 . A A . 64 GLY O 1 1 16 29130 1 1 65 TYR C C 5.846 3.245 -4.373 1.00 . A A . 65 TYR C 1 1 16 29131 1 1 65 TYR CA C 6.929 4.010 -3.611 1.00 . A A . 65 TYR CA 1 1 16 29132 1 1 65 TYR CB C 6.568 5.497 -3.591 1.00 . A A . 65 TYR CB 1 1 16 29133 1 1 65 TYR CD1 C 4.847 5.567 -1.750 1.00 . A A . 65 TYR CD1 1 1 16 29134 1 1 65 TYR CD2 C 4.195 6.272 -3.939 1.00 . A A . 65 TYR CD2 1 1 16 29135 1 1 65 TYR CE1 C 3.519 5.841 -1.265 1.00 . A A . 65 TYR CE1 1 1 16 29136 1 1 65 TYR CE2 C 2.867 6.547 -3.454 1.00 . A A . 65 TYR CE2 1 1 16 29137 1 1 65 TYR CG C 5.157 5.788 -3.076 1.00 . A A . 65 TYR CG 1 1 16 29138 1 1 65 TYR CZ C 2.595 6.318 -2.141 1.00 . A A . 65 TYR CZ 1 1 16 29139 1 1 65 TYR H H 8.661 4.793 -4.462 1.00 . A A . 65 TYR H 1 1 16 29140 1 1 65 TYR HA H 7.043 3.572 -2.619 1.00 . A A . 65 TYR HA 1 1 16 29141 1 1 65 TYR HB2 H 7.288 6.027 -2.967 1.00 . A A . 65 TYR HB2 1 1 16 29142 1 1 65 TYR HB3 H 6.666 5.897 -4.600 1.00 . A A . 65 TYR HB3 1 1 16 29143 1 1 65 TYR HD1 H 5.608 5.185 -1.069 1.00 . A A . 65 TYR HD1 1 1 16 29144 1 1 65 TYR HD2 H 4.439 6.447 -4.986 1.00 . A A . 65 TYR HD2 1 1 16 29145 1 1 65 TYR HE1 H 3.261 5.671 -0.220 1.00 . A A . 65 TYR HE1 1 1 16 29146 1 1 65 TYR HE2 H 2.097 6.929 -4.124 1.00 . A A . 65 TYR HE2 1 1 16 29147 1 1 65 TYR HH H 0.707 5.873 -2.005 1.00 . A A . 65 TYR HH 1 1 16 29148 1 1 65 TYR N N 8.209 3.918 -4.292 1.00 . A A . 65 TYR N 1 1 16 29149 1 1 65 TYR O O 4.982 2.614 -3.766 1.00 . A A . 65 TYR O 1 1 16 29150 1 1 65 TYR OH O 1.340 6.577 -1.684 1.00 . A A . 65 TYR OH 1 1 16 29151 1 1 66 TYR C C 5.328 1.174 -6.720 1.00 . A A . 66 TYR C 1 1 16 29152 1 1 66 TYR CA C 4.964 2.650 -6.545 1.00 . A A . 66 TYR CA 1 1 16 29153 1 1 66 TYR CB C 5.042 3.346 -7.906 1.00 . A A . 66 TYR CB 1 1 16 29154 1 1 66 TYR CD1 C 5.389 1.513 -9.601 1.00 . A A . 66 TYR CD1 1 1 16 29155 1 1 66 TYR CD2 C 3.301 2.676 -9.602 1.00 . A A . 66 TYR CD2 1 1 16 29156 1 1 66 TYR CE1 C 4.938 0.701 -10.702 1.00 . A A . 66 TYR CE1 1 1 16 29157 1 1 66 TYR CE2 C 2.849 1.864 -10.702 1.00 . A A . 66 TYR CE2 1 1 16 29158 1 1 66 TYR CG C 4.562 2.483 -9.075 1.00 . A A . 66 TYR CG 1 1 16 29159 1 1 66 TYR CZ C 3.690 0.917 -11.198 1.00 . A A . 66 TYR CZ 1 1 16 29160 1 1 66 TYR H H 6.633 3.842 -6.180 1.00 . A A . 66 TYR H 1 1 16 29161 1 1 66 TYR HA H 3.986 2.721 -6.070 1.00 . A A . 66 TYR HA 1 1 16 29162 1 1 66 TYR HB2 H 4.445 4.257 -7.871 1.00 . A A . 66 TYR HB2 1 1 16 29163 1 1 66 TYR HB3 H 6.073 3.647 -8.090 1.00 . A A . 66 TYR HB3 1 1 16 29164 1 1 66 TYR HD1 H 6.385 1.360 -9.185 1.00 . A A . 66 TYR HD1 1 1 16 29165 1 1 66 TYR HD2 H 2.648 3.442 -9.186 1.00 . A A . 66 TYR HD2 1 1 16 29166 1 1 66 TYR HE1 H 5.581 -0.069 -11.127 1.00 . A A . 66 TYR HE1 1 1 16 29167 1 1 66 TYR HE2 H 1.856 2.006 -11.128 1.00 . A A . 66 TYR HE2 1 1 16 29168 1 1 66 TYR HH H 3.585 -0.790 -12.123 1.00 . A A . 66 TYR HH 1 1 16 29169 1 1 66 TYR N N 5.927 3.326 -5.693 1.00 . A A . 66 TYR N 1 1 16 29170 1 1 66 TYR O O 4.614 0.430 -7.390 1.00 . A A . 66 TYR O 1 1 16 29171 1 1 66 TYR OH O 3.263 0.150 -12.237 1.00 . A A . 66 TYR OH 1 1 16 29172 1 1 67 HIS C C 6.505 -1.332 -4.914 1.00 . A A . 67 HIS C 1 1 16 29173 1 1 67 HIS CA C 6.906 -0.579 -6.184 1.00 . A A . 67 HIS CA 1 1 16 29174 1 1 67 HIS CB C 8.412 -0.626 -6.450 1.00 . A A . 67 HIS CB 1 1 16 29175 1 1 67 HIS CD2 C 9.530 -1.877 -4.446 1.00 . A A . 67 HIS CD2 1 1 16 29176 1 1 67 HIS CE1 C 10.102 -3.706 -5.501 1.00 . A A . 67 HIS CE1 1 1 16 29177 1 1 67 HIS CG C 9.126 -1.753 -5.743 1.00 . A A . 67 HIS CG 1 1 16 29178 1 1 67 HIS H H 7.014 1.406 -5.561 1.00 . A A . 67 HIS H 1 1 16 29179 1 1 67 HIS HA H 6.404 -1.032 -7.038 1.00 . A A . 67 HIS HA 1 1 16 29180 1 1 67 HIS HB2 H 8.578 -0.720 -7.523 1.00 . A A . 67 HIS HB2 1 1 16 29181 1 1 67 HIS HB3 H 8.855 0.322 -6.141 1.00 . A A . 67 HIS HB3 1 1 16 29182 1 1 67 HIS HD1 H 9.345 -3.136 -7.347 1.00 . A A . 67 HIS HD1 1 1 16 29183 1 1 67 HIS HD2 H 9.393 -1.133 -3.661 1.00 . A A . 67 HIS HD2 1 1 16 29184 1 1 67 HIS HE1 H 10.512 -4.697 -5.700 1.00 . A A . 67 HIS HE1 1 1 16 29185 1 1 67 HIS N N 6.439 0.795 -6.105 1.00 . A A . 67 HIS N 1 1 16 29186 1 1 67 HIS ND1 N 9.501 -2.921 -6.383 1.00 . A A . 67 HIS ND1 1 1 16 29187 1 1 67 HIS NE2 N 10.119 -3.058 -4.301 1.00 . A A . 67 HIS NE2 1 1 16 29188 1 1 67 HIS O O 6.501 -2.561 -4.892 1.00 . A A . 67 HIS O 1 1 16 29189 1 1 68 VAL C C 4.250 -1.104 -2.503 1.00 . A A . 68 VAL C 1 1 16 29190 1 1 68 VAL CA C 5.776 -1.140 -2.616 1.00 . A A . 68 VAL CA 1 1 16 29191 1 1 68 VAL CB C 6.477 -0.415 -1.465 1.00 . A A . 68 VAL CB 1 1 16 29192 1 1 68 VAL CG1 C 7.896 -0.951 -1.264 1.00 . A A . 68 VAL CG1 1 1 16 29193 1 1 68 VAL CG2 C 6.490 1.097 -1.697 1.00 . A A . 68 VAL CG2 1 1 16 29194 1 1 68 VAL H H 6.183 0.438 -3.913 1.00 . A A . 68 VAL H 1 1 16 29195 1 1 68 VAL HA H 6.103 -2.180 -2.609 1.00 . A A . 68 VAL HA 1 1 16 29196 1 1 68 VAL HB H 5.913 -0.609 -0.553 1.00 . A A . 68 VAL HB 1 1 16 29197 1 1 68 VAL HG11 H 7.905 -2.028 -1.429 1.00 . A A . 68 VAL HG11 1 1 16 29198 1 1 68 VAL HG12 H 8.571 -0.470 -1.972 1.00 . A A . 68 VAL HG12 1 1 16 29199 1 1 68 VAL HG13 H 8.225 -0.737 -0.247 1.00 . A A . 68 VAL HG13 1 1 16 29200 1 1 68 VAL HG21 H 5.492 1.430 -1.981 1.00 . A A . 68 VAL HG21 1 1 16 29201 1 1 68 VAL HG22 H 6.795 1.603 -0.781 1.00 . A A . 68 VAL HG22 1 1 16 29202 1 1 68 VAL HG23 H 7.193 1.337 -2.496 1.00 . A A . 68 VAL HG23 1 1 16 29203 1 1 68 VAL N N 6.177 -0.562 -3.886 1.00 . A A . 68 VAL N 1 1 16 29204 1 1 68 VAL O O 3.695 -1.402 -1.446 1.00 . A A . 68 VAL O 1 1 16 29205 1 1 69 MET C C 1.591 -1.620 -4.685 1.00 . A A . 69 MET C 1 1 16 29206 1 1 69 MET CA C 2.166 -0.657 -3.644 1.00 . A A . 69 MET CA 1 1 16 29207 1 1 69 MET CB C 1.741 0.774 -3.983 1.00 . A A . 69 MET CB 1 1 16 29208 1 1 69 MET CE C 2.708 2.059 -0.305 1.00 . A A . 69 MET CE 1 1 16 29209 1 1 69 MET CG C 2.355 1.775 -3.001 1.00 . A A . 69 MET CG 1 1 16 29210 1 1 69 MET H H 4.075 -0.495 -4.461 1.00 . A A . 69 MET H 1 1 16 29211 1 1 69 MET HA H 1.830 -0.945 -2.648 1.00 . A A . 69 MET HA 1 1 16 29212 1 1 69 MET HB2 H 2.052 1.018 -4.999 1.00 . A A . 69 MET HB2 1 1 16 29213 1 1 69 MET HB3 H 0.654 0.851 -3.954 1.00 . A A . 69 MET HB3 1 1 16 29214 1 1 69 MET HE1 H 3.625 1.599 -0.674 1.00 . A A . 69 MET HE1 1 1 16 29215 1 1 69 MET HE2 H 2.871 3.126 -0.157 1.00 . A A . 69 MET HE2 1 1 16 29216 1 1 69 MET HE3 H 2.428 1.599 0.643 1.00 . A A . 69 MET HE3 1 1 16 29217 1 1 69 MET HG2 H 3.385 1.496 -2.782 1.00 . A A . 69 MET HG2 1 1 16 29218 1 1 69 MET HG3 H 2.382 2.767 -3.451 1.00 . A A . 69 MET HG3 1 1 16 29219 1 1 69 MET N N 3.616 -0.736 -3.606 1.00 . A A . 69 MET N 1 1 16 29220 1 1 69 MET O O 0.380 -1.825 -4.744 1.00 . A A . 69 MET O 1 1 16 29221 1 1 69 MET SD S 1.400 1.815 -1.494 1.00 . A A . 69 MET SD 1 1 16 29222 1 1 70 HIS C C 3.023 -4.329 -6.509 1.00 . A A . 70 HIS C 1 1 16 29223 1 1 70 HIS CA C 2.085 -3.121 -6.516 1.00 . A A . 70 HIS CA 1 1 16 29224 1 1 70 HIS CB C 2.021 -2.428 -7.879 1.00 . A A . 70 HIS CB 1 1 16 29225 1 1 70 HIS CD2 C 0.093 -0.702 -8.251 1.00 . A A . 70 HIS CD2 1 1 16 29226 1 1 70 HIS CE1 C 1.113 1.074 -7.481 1.00 . A A . 70 HIS CE1 1 1 16 29227 1 1 70 HIS CG C 1.342 -1.080 -7.852 1.00 . A A . 70 HIS CG 1 1 16 29228 1 1 70 HIS H H 3.471 -2.012 -5.426 1.00 . A A . 70 HIS H 1 1 16 29229 1 1 70 HIS HA H 1.077 -3.452 -6.264 1.00 . A A . 70 HIS HA 1 1 16 29230 1 1 70 HIS HB2 H 3.034 -2.306 -8.261 1.00 . A A . 70 HIS HB2 1 1 16 29231 1 1 70 HIS HB3 H 1.493 -3.076 -8.580 1.00 . A A . 70 HIS HB3 1 1 16 29232 1 1 70 HIS HD1 H 2.889 0.113 -7.006 1.00 . A A . 70 HIS HD1 1 1 16 29233 1 1 70 HIS HD2 H -0.664 -1.358 -8.681 1.00 . A A . 70 HIS HD2 1 1 16 29234 1 1 70 HIS HE1 H 1.306 2.106 -7.188 1.00 . A A . 70 HIS HE1 1 1 16 29235 1 1 70 HIS N N 2.487 -2.184 -5.481 1.00 . A A . 70 HIS N 1 1 16 29236 1 1 70 HIS ND1 N 1.960 0.061 -7.372 1.00 . A A . 70 HIS ND1 1 1 16 29237 1 1 70 HIS NE2 N -0.044 0.598 -8.025 1.00 . A A . 70 HIS NE2 1 1 16 29238 1 1 70 HIS O O 2.592 -5.452 -6.251 1.00 . A A . 70 HIS O 1 1 16 29239 1 1 71 ASP C C 5.013 -6.104 -5.695 1.00 . A A . 71 ASP C 1 1 16 29240 1 1 71 ASP CA C 5.290 -5.109 -6.824 1.00 . A A . 71 ASP CA 1 1 16 29241 1 1 71 ASP CB C 6.694 -4.538 -6.617 1.00 . A A . 71 ASP CB 1 1 16 29242 1 1 71 ASP CG C 7.799 -5.230 -7.418 1.00 . A A . 71 ASP CG 1 1 16 29243 1 1 71 ASP H H 4.630 -3.142 -7.003 1.00 . A A . 71 ASP H 1 1 16 29244 1 1 71 ASP HA H 5.200 -5.563 -7.811 1.00 . A A . 71 ASP HA 1 1 16 29245 1 1 71 ASP HB2 H 6.682 -3.480 -6.883 1.00 . A A . 71 ASP HB2 1 1 16 29246 1 1 71 ASP HB3 H 6.942 -4.597 -5.558 1.00 . A A . 71 ASP HB3 1 1 16 29247 1 1 71 ASP N N 4.287 -4.058 -6.795 1.00 . A A . 71 ASP N 1 1 16 29248 1 1 71 ASP O O 4.802 -5.706 -4.551 1.00 . A A . 71 ASP O 1 1 16 29249 1 1 71 ASP OD1 O 7.785 -5.073 -8.658 1.00 . A A . 71 ASP OD1 1 1 16 29250 1 1 71 ASP OD2 O 8.632 -5.902 -6.771 1.00 . A A . 71 ASP OD2 1 1 16 29251 1 1 72 LYS C C 6.111 -9.022 -4.629 1.00 . A A . 72 LYS C 1 1 16 29252 1 1 72 LYS CA C 4.775 -8.433 -5.089 1.00 . A A . 72 LYS CA 1 1 16 29253 1 1 72 LYS CB C 3.811 -9.472 -5.663 1.00 . A A . 72 LYS CB 1 1 16 29254 1 1 72 LYS CD C 2.655 -8.978 -7.849 1.00 . A A . 72 LYS CD 1 1 16 29255 1 1 72 LYS CE C 2.256 -7.688 -8.568 1.00 . A A . 72 LYS CE 1 1 16 29256 1 1 72 LYS CG C 2.611 -8.797 -6.331 1.00 . A A . 72 LYS CG 1 1 16 29257 1 1 72 LYS H H 5.196 -7.694 -6.990 1.00 . A A . 72 LYS H 1 1 16 29258 1 1 72 LYS HA H 4.284 -7.978 -4.228 1.00 . A A . 72 LYS HA 1 1 16 29259 1 1 72 LYS HB2 H 4.332 -10.096 -6.389 1.00 . A A . 72 LYS HB2 1 1 16 29260 1 1 72 LYS HB3 H 3.464 -10.132 -4.867 1.00 . A A . 72 LYS HB3 1 1 16 29261 1 1 72 LYS HD2 H 3.659 -9.273 -8.155 1.00 . A A . 72 LYS HD2 1 1 16 29262 1 1 72 LYS HD3 H 1.983 -9.785 -8.142 1.00 . A A . 72 LYS HD3 1 1 16 29263 1 1 72 LYS HE2 H 1.333 -7.296 -8.139 1.00 . A A . 72 LYS HE2 1 1 16 29264 1 1 72 LYS HE3 H 3.024 -6.929 -8.418 1.00 . A A . 72 LYS HE3 1 1 16 29265 1 1 72 LYS HG2 H 1.686 -9.218 -5.937 1.00 . A A . 72 LYS HG2 1 1 16 29266 1 1 72 LYS HG3 H 2.606 -7.734 -6.088 1.00 . A A . 72 LYS HG3 1 1 16 29267 1 1 72 LYS HZ1 H 1.665 -7.137 -10.489 1.00 . A A . 72 LYS HZ1 1 1 16 29268 1 1 72 LYS HZ2 H 2.948 -8.139 -10.481 1.00 . A A . 72 LYS HZ2 1 1 16 29269 1 1 72 LYS N N 5.023 -7.379 -6.057 1.00 . A A . 72 LYS N 1 1 16 29270 1 1 72 LYS NZ N 2.071 -7.936 -10.015 1.00 . A A . 72 LYS NZ 1 1 16 29271 1 1 72 LYS O O 6.254 -9.418 -3.473 1.00 . A A . 72 LYS O 1 1 16 29272 1 1 73 ASN C C 9.118 -8.624 -4.344 1.00 . A A . 73 ASN C 1 1 16 29273 1 1 73 ASN CA C 8.374 -9.595 -5.263 1.00 . A A . 73 ASN CA 1 1 16 29274 1 1 73 ASN CB C 9.198 -9.763 -6.541 1.00 . A A . 73 ASN CB 1 1 16 29275 1 1 73 ASN CG C 8.491 -10.690 -7.531 1.00 . A A . 73 ASN CG 1 1 16 29276 1 1 73 ASN H H 6.930 -8.736 -6.496 1.00 . A A . 73 ASN H 1 1 16 29277 1 1 73 ASN HA H 8.193 -10.560 -4.791 1.00 . A A . 73 ASN HA 1 1 16 29278 1 1 73 ASN HB2 H 9.363 -8.790 -7.003 1.00 . A A . 73 ASN HB2 1 1 16 29279 1 1 73 ASN HB3 H 10.179 -10.169 -6.294 1.00 . A A . 73 ASN HB3 1 1 16 29280 1 1 73 ASN HD21 H 7.818 -9.052 -8.512 1.00 . A A . 73 ASN HD21 1 1 16 29281 1 1 73 ASN HD22 H 7.328 -10.571 -9.185 1.00 . A A . 73 ASN HD22 1 1 16 29282 1 1 73 ASN N N 7.055 -9.061 -5.558 1.00 . A A . 73 ASN N 1 1 16 29283 1 1 73 ASN ND2 N 7.824 -10.052 -8.489 1.00 . A A . 73 ASN ND2 1 1 16 29284 1 1 73 ASN O O 10.132 -8.047 -4.736 1.00 . A A . 73 ASN O 1 1 16 29285 1 1 73 ASN OD1 O 8.547 -11.905 -7.433 1.00 . A A . 73 ASN OD1 1 1 16 29286 1 1 74 THR C C 9.444 -8.325 -0.850 1.00 . A A . 74 THR C 1 1 16 29287 1 1 74 THR CA C 9.189 -7.582 -2.163 1.00 . A A . 74 THR CA 1 1 16 29288 1 1 74 THR CB C 8.274 -6.366 -2.005 1.00 . A A . 74 THR CB 1 1 16 29289 1 1 74 THR CG2 C 8.025 -5.646 -3.332 1.00 . A A . 74 THR CG2 1 1 16 29290 1 1 74 THR H H 7.763 -8.947 -2.829 1.00 . A A . 74 THR H 1 1 16 29291 1 1 74 THR HA H 10.159 -7.261 -2.542 1.00 . A A . 74 THR HA 1 1 16 29292 1 1 74 THR HB H 8.666 -5.679 -1.256 1.00 . A A . 74 THR HB 1 1 16 29293 1 1 74 THR HG1 H 6.619 -7.394 -2.466 1.00 . A A . 74 THR HG1 1 1 16 29294 1 1 74 THR HG21 H 8.614 -6.117 -4.118 1.00 . A A . 74 THR HG21 1 1 16 29295 1 1 74 THR HG22 H 6.966 -5.706 -3.585 1.00 . A A . 74 THR HG22 1 1 16 29296 1 1 74 THR HG23 H 8.317 -4.600 -3.237 1.00 . A A . 74 THR HG23 1 1 16 29297 1 1 74 THR N N 8.587 -8.474 -3.140 1.00 . A A . 74 THR N 1 1 16 29298 1 1 74 THR O O 8.789 -9.325 -0.560 1.00 . A A . 74 THR O 1 1 16 29299 1 1 74 THR OG1 O 7.007 -6.926 -1.671 1.00 . A A . 74 THR OG1 1 1 16 29300 1 1 75 LYS C C 9.552 -8.311 2.136 1.00 . A A . 75 LYS C 1 1 16 29301 1 1 75 LYS CA C 10.747 -8.409 1.186 1.00 . A A . 75 LYS CA 1 1 16 29302 1 1 75 LYS CB C 12.027 -7.781 1.741 1.00 . A A . 75 LYS CB 1 1 16 29303 1 1 75 LYS CD C 13.802 -8.192 3.486 1.00 . A A . 75 LYS CD 1 1 16 29304 1 1 75 LYS CE C 14.239 -6.740 3.690 1.00 . A A . 75 LYS CE 1 1 16 29305 1 1 75 LYS CG C 12.309 -8.274 3.162 1.00 . A A . 75 LYS CG 1 1 16 29306 1 1 75 LYS H H 10.925 -6.993 -0.332 1.00 . A A . 75 LYS H 1 1 16 29307 1 1 75 LYS HA H 10.958 -9.462 1.003 1.00 . A A . 75 LYS HA 1 1 16 29308 1 1 75 LYS HB2 H 12.869 -8.027 1.094 1.00 . A A . 75 LYS HB2 1 1 16 29309 1 1 75 LYS HB3 H 11.934 -6.695 1.742 1.00 . A A . 75 LYS HB3 1 1 16 29310 1 1 75 LYS HD2 H 14.015 -8.770 4.385 1.00 . A A . 75 LYS HD2 1 1 16 29311 1 1 75 LYS HD3 H 14.378 -8.639 2.676 1.00 . A A . 75 LYS HD3 1 1 16 29312 1 1 75 LYS HE2 H 13.599 -6.076 3.109 1.00 . A A . 75 LYS HE2 1 1 16 29313 1 1 75 LYS HE3 H 14.120 -6.462 4.737 1.00 . A A . 75 LYS HE3 1 1 16 29314 1 1 75 LYS HG2 H 11.744 -7.676 3.877 1.00 . A A . 75 LYS HG2 1 1 16 29315 1 1 75 LYS HG3 H 11.966 -9.304 3.268 1.00 . A A . 75 LYS HG3 1 1 16 29316 1 1 75 LYS HZ1 H 15.738 -6.401 2.283 1.00 . A A . 75 LYS HZ1 1 1 16 29317 1 1 75 LYS HZ2 H 16.083 -5.771 3.744 1.00 . A A . 75 LYS HZ2 1 1 16 29318 1 1 75 LYS N N 10.397 -7.807 -0.089 1.00 . A A . 75 LYS N 1 1 16 29319 1 1 75 LYS NZ N 15.650 -6.561 3.280 1.00 . A A . 75 LYS NZ 1 1 16 29320 1 1 75 LYS O O 9.424 -9.109 3.063 1.00 . A A . 75 LYS O 1 1 16 29321 1 1 76 PHE C C 6.251 -7.218 1.857 1.00 . A A . 76 PHE C 1 1 16 29322 1 1 76 PHE CA C 7.527 -7.111 2.694 1.00 . A A . 76 PHE CA 1 1 16 29323 1 1 76 PHE CB C 7.646 -5.688 3.242 1.00 . A A . 76 PHE CB 1 1 16 29324 1 1 76 PHE CD1 C 8.899 -6.129 5.385 1.00 . A A . 76 PHE CD1 1 1 16 29325 1 1 76 PHE CD2 C 9.868 -4.632 3.793 1.00 . A A . 76 PHE CD2 1 1 16 29326 1 1 76 PHE CE1 C 10.026 -5.930 6.259 1.00 . A A . 76 PHE CE1 1 1 16 29327 1 1 76 PHE CE2 C 10.995 -4.433 4.667 1.00 . A A . 76 PHE CE2 1 1 16 29328 1 1 76 PHE CG C 8.843 -5.476 4.170 1.00 . A A . 76 PHE CG 1 1 16 29329 1 1 76 PHE CZ C 11.018 -5.092 5.857 1.00 . A A . 76 PHE CZ 1 1 16 29330 1 1 76 PHE H H 8.819 -6.679 1.118 1.00 . A A . 76 PHE H 1 1 16 29331 1 1 76 PHE HA H 7.511 -7.880 3.467 1.00 . A A . 76 PHE HA 1 1 16 29332 1 1 76 PHE HB2 H 7.720 -4.993 2.406 1.00 . A A . 76 PHE HB2 1 1 16 29333 1 1 76 PHE HB3 H 6.732 -5.440 3.782 1.00 . A A . 76 PHE HB3 1 1 16 29334 1 1 76 PHE HD1 H 8.090 -6.796 5.682 1.00 . A A . 76 PHE HD1 1 1 16 29335 1 1 76 PHE HD2 H 9.824 -4.116 2.834 1.00 . A A . 76 PHE HD2 1 1 16 29336 1 1 76 PHE HE1 H 10.083 -6.440 7.220 1.00 . A A . 76 PHE HE1 1 1 16 29337 1 1 76 PHE HE2 H 11.811 -3.769 4.382 1.00 . A A . 76 PHE HE2 1 1 16 29338 1 1 76 PHE HZ H 11.858 -5.021 6.594 1.00 . A A . 76 PHE HZ 1 1 16 29339 1 1 76 PHE N N 8.707 -7.324 1.874 1.00 . A A . 76 PHE N 1 1 16 29340 1 1 76 PHE O O 6.278 -7.003 0.646 1.00 . A A . 76 PHE O 1 1 16 29341 1 1 77 LYS C C 3.469 -6.340 1.276 1.00 . A A . 77 LYS C 1 1 16 29342 1 1 77 LYS CA C 3.879 -7.689 1.870 1.00 . A A . 77 LYS CA 1 1 16 29343 1 1 77 LYS CB C 2.840 -8.281 2.825 1.00 . A A . 77 LYS CB 1 1 16 29344 1 1 77 LYS CD C 2.706 -10.404 4.179 1.00 . A A . 77 LYS CD 1 1 16 29345 1 1 77 LYS CE C 4.019 -11.023 4.661 1.00 . A A . 77 LYS CE 1 1 16 29346 1 1 77 LYS CG C 2.861 -9.810 2.778 1.00 . A A . 77 LYS CG 1 1 16 29347 1 1 77 LYS H H 5.149 -7.724 3.520 1.00 . A A . 77 LYS H 1 1 16 29348 1 1 77 LYS HA H 4.009 -8.401 1.054 1.00 . A A . 77 LYS HA 1 1 16 29349 1 1 77 LYS HB2 H 3.041 -7.942 3.841 1.00 . A A . 77 LYS HB2 1 1 16 29350 1 1 77 LYS HB3 H 1.847 -7.919 2.559 1.00 . A A . 77 LYS HB3 1 1 16 29351 1 1 77 LYS HD2 H 2.389 -9.627 4.875 1.00 . A A . 77 LYS HD2 1 1 16 29352 1 1 77 LYS HD3 H 1.923 -11.163 4.172 1.00 . A A . 77 LYS HD3 1 1 16 29353 1 1 77 LYS HE2 H 3.896 -12.099 4.787 1.00 . A A . 77 LYS HE2 1 1 16 29354 1 1 77 LYS HE3 H 4.794 -10.877 3.909 1.00 . A A . 77 LYS HE3 1 1 16 29355 1 1 77 LYS HG2 H 2.056 -10.168 2.136 1.00 . A A . 77 LYS HG2 1 1 16 29356 1 1 77 LYS HG3 H 3.797 -10.152 2.336 1.00 . A A . 77 LYS HG3 1 1 16 29357 1 1 77 LYS HZ1 H 3.679 -10.361 6.608 1.00 . A A . 77 LYS HZ1 1 1 16 29358 1 1 77 LYS HZ2 H 5.185 -10.938 6.386 1.00 . A A . 77 LYS HZ2 1 1 16 29359 1 1 77 LYS N N 5.162 -7.551 2.536 1.00 . A A . 77 LYS N 1 1 16 29360 1 1 77 LYS NZ N 4.441 -10.412 5.941 1.00 . A A . 77 LYS NZ 1 1 16 29361 1 1 77 LYS O O 3.444 -5.330 1.978 1.00 . A A . 77 LYS O 1 1 16 29362 1 1 78 SER C C 1.226 -5.108 -0.824 1.00 . A A . 78 SER C 1 1 16 29363 1 1 78 SER CA C 2.751 -5.158 -0.708 1.00 . A A . 78 SER CA 1 1 16 29364 1 1 78 SER CB C 3.391 -5.080 -2.096 1.00 . A A . 78 SER CB 1 1 16 29365 1 1 78 SER H H 3.180 -7.192 -0.576 1.00 . A A . 78 SER H 1 1 16 29366 1 1 78 SER HA H 3.115 -4.334 -0.094 1.00 . A A . 78 SER HA 1 1 16 29367 1 1 78 SER HB2 H 3.911 -4.128 -2.202 1.00 . A A . 78 SER HB2 1 1 16 29368 1 1 78 SER HB3 H 4.140 -5.865 -2.194 1.00 . A A . 78 SER HB3 1 1 16 29369 1 1 78 SER HG H 2.884 -5.400 -4.005 1.00 . A A . 78 SER HG 1 1 16 29370 1 1 78 SER N N 3.158 -6.366 -0.012 1.00 . A A . 78 SER N 1 1 16 29371 1 1 78 SER O O 0.554 -6.124 -0.650 1.00 . A A . 78 SER O 1 1 16 29372 1 1 78 SER OG O 2.426 -5.211 -3.137 1.00 . A A . 78 SER OG 1 1 16 29373 1 1 79 CYS C C -1.257 -4.823 -2.165 1.00 . A A . 79 CYS C 1 1 16 29374 1 1 79 CYS CA C -0.708 -3.722 -1.255 1.00 . A A . 79 CYS CA 1 1 16 29375 1 1 79 CYS CB C -1.040 -2.326 -1.786 1.00 . A A . 79 CYS CB 1 1 16 29376 1 1 79 CYS H H 1.279 -3.096 -1.255 1.00 . A A . 79 CYS H 1 1 16 29377 1 1 79 CYS HA H -1.134 -3.799 -0.255 1.00 . A A . 79 CYS HA 1 1 16 29378 1 1 79 CYS HB2 H -0.686 -2.250 -2.814 1.00 . A A . 79 CYS HB2 1 1 16 29379 1 1 79 CYS HB3 H -2.124 -2.210 -1.812 1.00 . A A . 79 CYS HB3 1 1 16 29380 1 1 79 CYS N N 0.725 -3.917 -1.115 1.00 . A A . 79 CYS N 1 1 16 29381 1 1 79 CYS O O -2.020 -5.679 -1.719 1.00 . A A . 79 CYS O 1 1 16 29382 1 1 79 CYS SG S -0.327 -0.947 -0.817 1.00 . A A . 79 CYS SG 1 1 16 29383 1 1 80 VAL C C -0.779 -7.132 -3.990 1.00 . A A . 80 VAL C 1 1 16 29384 1 1 80 VAL CA C -1.286 -5.748 -4.399 1.00 . A A . 80 VAL CA 1 1 16 29385 1 1 80 VAL CB C -0.830 -5.335 -5.800 1.00 . A A . 80 VAL CB 1 1 16 29386 1 1 80 VAL CG1 C -1.211 -6.394 -6.836 1.00 . A A . 80 VAL CG1 1 1 16 29387 1 1 80 VAL CG2 C -1.399 -3.966 -6.181 1.00 . A A . 80 VAL CG2 1 1 16 29388 1 1 80 VAL H H -0.224 -4.068 -3.777 1.00 . A A . 80 VAL H 1 1 16 29389 1 1 80 VAL HA H -2.376 -5.757 -4.388 1.00 . A A . 80 VAL HA 1 1 16 29390 1 1 80 VAL HB H 0.257 -5.253 -5.788 1.00 . A A . 80 VAL HB 1 1 16 29391 1 1 80 VAL HG11 H -1.377 -7.348 -6.335 1.00 . A A . 80 VAL HG11 1 1 16 29392 1 1 80 VAL HG12 H -2.123 -6.089 -7.349 1.00 . A A . 80 VAL HG12 1 1 16 29393 1 1 80 VAL HG13 H -0.404 -6.500 -7.561 1.00 . A A . 80 VAL HG13 1 1 16 29394 1 1 80 VAL HG21 H -1.397 -3.316 -5.306 1.00 . A A . 80 VAL HG21 1 1 16 29395 1 1 80 VAL HG22 H -0.785 -3.523 -6.965 1.00 . A A . 80 VAL HG22 1 1 16 29396 1 1 80 VAL HG23 H -2.421 -4.085 -6.542 1.00 . A A . 80 VAL HG23 1 1 16 29397 1 1 80 VAL N N -0.846 -4.766 -3.423 1.00 . A A . 80 VAL N 1 1 16 29398 1 1 80 VAL O O -1.490 -8.125 -4.132 1.00 . A A . 80 VAL O 1 1 16 29399 1 1 81 GLY C C 0.117 -9.184 -2.143 1.00 . A A . 81 GLY C 1 1 16 29400 1 1 81 GLY CA C 1.059 -8.399 -3.057 1.00 . A A . 81 GLY CA 1 1 16 29401 1 1 81 GLY H H 1.019 -6.340 -3.375 1.00 . A A . 81 GLY H 1 1 16 29402 1 1 81 GLY HA2 H 1.314 -9.003 -3.928 1.00 . A A . 81 GLY HA2 1 1 16 29403 1 1 81 GLY HA3 H 1.990 -8.188 -2.532 1.00 . A A . 81 GLY HA3 1 1 16 29404 1 1 81 GLY N N 0.447 -7.153 -3.489 1.00 . A A . 81 GLY N 1 1 16 29405 1 1 81 GLY O O -0.238 -10.323 -2.442 1.00 . A A . 81 GLY O 1 1 16 29406 1 1 82 CYS C C -2.501 -9.416 -0.772 1.00 . A A . 82 CYS C 1 1 16 29407 1 1 82 CYS CA C -1.156 -9.168 -0.086 1.00 . A A . 82 CYS CA 1 1 16 29408 1 1 82 CYS CB C -1.308 -8.321 1.179 1.00 . A A . 82 CYS CB 1 1 16 29409 1 1 82 CYS H H 0.031 -7.617 -0.810 1.00 . A A . 82 CYS H 1 1 16 29410 1 1 82 CYS HA H -0.691 -10.110 0.208 1.00 . A A . 82 CYS HA 1 1 16 29411 1 1 82 CYS HB2 H -0.326 -8.107 1.604 1.00 . A A . 82 CYS HB2 1 1 16 29412 1 1 82 CYS HB3 H -1.764 -7.363 0.933 1.00 . A A . 82 CYS HB3 1 1 16 29413 1 1 82 CYS N N -0.262 -8.544 -1.046 1.00 . A A . 82 CYS N 1 1 16 29414 1 1 82 CYS O O -3.071 -10.499 -0.654 1.00 . A A . 82 CYS O 1 1 16 29415 1 1 82 CYS SG S -2.338 -9.206 2.405 1.00 . A A . 82 CYS SG 1 1 16 29416 1 1 83 HIS C C -4.243 -9.738 -3.057 1.00 . A A . 83 HIS C 1 1 16 29417 1 1 83 HIS CA C -4.236 -8.486 -2.177 1.00 . A A . 83 HIS CA 1 1 16 29418 1 1 83 HIS CB C -4.514 -7.206 -2.966 1.00 . A A . 83 HIS CB 1 1 16 29419 1 1 83 HIS CD2 C -4.921 -5.811 -0.794 1.00 . A A . 83 HIS CD2 1 1 16 29420 1 1 83 HIS CE1 C -6.130 -4.213 -1.671 1.00 . A A . 83 HIS CE1 1 1 16 29421 1 1 83 HIS CG C -5.049 -6.071 -2.126 1.00 . A A . 83 HIS CG 1 1 16 29422 1 1 83 HIS H H -2.498 -7.516 -1.563 1.00 . A A . 83 HIS H 1 1 16 29423 1 1 83 HIS HA H -5.010 -8.583 -1.416 1.00 . A A . 83 HIS HA 1 1 16 29424 1 1 83 HIS HB2 H -3.593 -6.882 -3.451 1.00 . A A . 83 HIS HB2 1 1 16 29425 1 1 83 HIS HB3 H -5.229 -7.427 -3.758 1.00 . A A . 83 HIS HB3 1 1 16 29426 1 1 83 HIS HD1 H -6.089 -4.951 -3.610 1.00 . A A . 83 HIS HD1 1 1 16 29427 1 1 83 HIS HD2 H -4.375 -6.422 -0.075 1.00 . A A . 83 HIS HD2 1 1 16 29428 1 1 83 HIS HE1 H -6.727 -3.306 -1.767 1.00 . A A . 83 HIS HE1 1 1 16 29429 1 1 83 HIS N N -2.968 -8.393 -1.473 1.00 . A A . 83 HIS N 1 1 16 29430 1 1 83 HIS ND1 N -5.817 -5.046 -2.652 1.00 . A A . 83 HIS ND1 1 1 16 29431 1 1 83 HIS NE2 N -5.574 -4.688 -0.520 1.00 . A A . 83 HIS NE2 1 1 16 29432 1 1 83 HIS O O -5.230 -10.472 -3.090 1.00 . A A . 83 HIS O 1 1 16 29433 1 1 84 VAL C C -3.277 -12.371 -3.832 1.00 . A A . 84 VAL C 1 1 16 29434 1 1 84 VAL CA C -2.998 -11.093 -4.626 1.00 . A A . 84 VAL CA 1 1 16 29435 1 1 84 VAL CB C -1.618 -11.090 -5.287 1.00 . A A . 84 VAL CB 1 1 16 29436 1 1 84 VAL CG1 C -1.424 -12.333 -6.157 1.00 . A A . 84 VAL CG1 1 1 16 29437 1 1 84 VAL CG2 C -1.404 -9.812 -6.101 1.00 . A A . 84 VAL CG2 1 1 16 29438 1 1 84 VAL H H -2.334 -9.342 -3.716 1.00 . A A . 84 VAL H 1 1 16 29439 1 1 84 VAL HA H -3.748 -10.997 -5.411 1.00 . A A . 84 VAL HA 1 1 16 29440 1 1 84 VAL HB H -0.868 -11.113 -4.497 1.00 . A A . 84 VAL HB 1 1 16 29441 1 1 84 VAL HG11 H -2.385 -12.822 -6.312 1.00 . A A . 84 VAL HG11 1 1 16 29442 1 1 84 VAL HG12 H -1.005 -12.040 -7.120 1.00 . A A . 84 VAL HG12 1 1 16 29443 1 1 84 VAL HG13 H -0.741 -13.022 -5.659 1.00 . A A . 84 VAL HG13 1 1 16 29444 1 1 84 VAL HG21 H -2.255 -9.145 -5.961 1.00 . A A . 84 VAL HG21 1 1 16 29445 1 1 84 VAL HG22 H -0.494 -9.315 -5.764 1.00 . A A . 84 VAL HG22 1 1 16 29446 1 1 84 VAL HG23 H -1.310 -10.065 -7.157 1.00 . A A . 84 VAL HG23 1 1 16 29447 1 1 84 VAL N N -3.132 -9.943 -3.748 1.00 . A A . 84 VAL N 1 1 16 29448 1 1 84 VAL O O -3.878 -13.310 -4.351 1.00 . A A . 84 VAL O 1 1 16 29449 1 1 85 GLU C C -4.468 -13.568 -1.225 1.00 . A A . 85 GLU C 1 1 16 29450 1 1 85 GLU CA C -3.020 -13.512 -1.715 1.00 . A A . 85 GLU CA 1 1 16 29451 1 1 85 GLU CB C -2.043 -13.477 -0.537 1.00 . A A . 85 GLU CB 1 1 16 29452 1 1 85 GLU CD C -0.775 -15.504 0.263 1.00 . A A . 85 GLU CD 1 1 16 29453 1 1 85 GLU CG C -0.847 -14.396 -0.790 1.00 . A A . 85 GLU CG 1 1 16 29454 1 1 85 GLU H H -2.339 -11.597 -2.171 1.00 . A A . 85 GLU H 1 1 16 29455 1 1 85 GLU HA H -2.804 -14.384 -2.332 1.00 . A A . 85 GLU HA 1 1 16 29456 1 1 85 GLU HB2 H -1.695 -12.456 -0.379 1.00 . A A . 85 GLU HB2 1 1 16 29457 1 1 85 GLU HB3 H -2.556 -13.784 0.374 1.00 . A A . 85 GLU HB3 1 1 16 29458 1 1 85 GLU HG2 H -0.926 -14.838 -1.783 1.00 . A A . 85 GLU HG2 1 1 16 29459 1 1 85 GLU HG3 H 0.074 -13.814 -0.773 1.00 . A A . 85 GLU HG3 1 1 16 29460 1 1 85 GLU N N -2.827 -12.365 -2.586 1.00 . A A . 85 GLU N 1 1 16 29461 1 1 85 GLU O O -5.021 -14.651 -1.035 1.00 . A A . 85 GLU O 1 1 16 29462 1 1 85 GLU OE1 O -0.216 -15.224 1.345 1.00 . A A . 85 GLU OE1 1 1 16 29463 1 1 85 GLU OE2 O -1.280 -16.607 -0.039 1.00 . A A . 85 GLU OE2 1 1 16 29464 1 1 86 VAL C C -7.362 -12.675 -1.706 1.00 . A A . 86 VAL C 1 1 16 29465 1 1 86 VAL CA C -6.414 -12.291 -0.568 1.00 . A A . 86 VAL CA 1 1 16 29466 1 1 86 VAL CB C -6.680 -10.889 -0.016 1.00 . A A . 86 VAL CB 1 1 16 29467 1 1 86 VAL CG1 C -8.139 -10.739 0.419 1.00 . A A . 86 VAL CG1 1 1 16 29468 1 1 86 VAL CG2 C -5.728 -10.564 1.137 1.00 . A A . 86 VAL CG2 1 1 16 29469 1 1 86 VAL H H -4.584 -11.514 -1.190 1.00 . A A . 86 VAL H 1 1 16 29470 1 1 86 VAL HA H -6.537 -13.004 0.247 1.00 . A A . 86 VAL HA 1 1 16 29471 1 1 86 VAL HB H -6.493 -10.172 -0.816 1.00 . A A . 86 VAL HB 1 1 16 29472 1 1 86 VAL HG11 H -8.795 -10.995 -0.414 1.00 . A A . 86 VAL HG11 1 1 16 29473 1 1 86 VAL HG12 H -8.339 -11.406 1.257 1.00 . A A . 86 VAL HG12 1 1 16 29474 1 1 86 VAL HG13 H -8.324 -9.709 0.723 1.00 . A A . 86 VAL HG13 1 1 16 29475 1 1 86 VAL HG21 H -4.698 -10.659 0.795 1.00 . A A . 86 VAL HG21 1 1 16 29476 1 1 86 VAL HG22 H -5.906 -9.545 1.479 1.00 . A A . 86 VAL HG22 1 1 16 29477 1 1 86 VAL HG23 H -5.904 -11.258 1.959 1.00 . A A . 86 VAL HG23 1 1 16 29478 1 1 86 VAL N N -5.041 -12.389 -1.033 1.00 . A A . 86 VAL N 1 1 16 29479 1 1 86 VAL O O -8.239 -13.519 -1.530 1.00 . A A . 86 VAL O 1 1 16 29480 1 1 87 ALA C C -7.760 -13.743 -4.473 1.00 . A A . 87 ALA C 1 1 16 29481 1 1 87 ALA CA C -7.978 -12.300 -4.015 1.00 . A A . 87 ALA CA 1 1 16 29482 1 1 87 ALA CB C -7.652 -11.284 -5.111 1.00 . A A . 87 ALA CB 1 1 16 29483 1 1 87 ALA H H -6.437 -11.351 -2.983 1.00 . A A . 87 ALA H 1 1 16 29484 1 1 87 ALA HA H -9.020 -12.175 -3.720 1.00 . A A . 87 ALA HA 1 1 16 29485 1 1 87 ALA HB1 H -6.595 -11.353 -5.368 1.00 . A A . 87 ALA HB1 1 1 16 29486 1 1 87 ALA HB2 H -8.255 -11.496 -5.994 1.00 . A A . 87 ALA HB2 1 1 16 29487 1 1 87 ALA HB3 H -7.874 -10.279 -4.753 1.00 . A A . 87 ALA HB3 1 1 16 29488 1 1 87 ALA N N -7.153 -12.036 -2.849 1.00 . A A . 87 ALA N 1 1 16 29489 1 1 87 ALA O O -8.654 -14.355 -5.056 1.00 . A A . 87 ALA O 1 1 16 29490 1 1 88 GLY C C -6.795 -15.958 -5.942 1.00 . A A . 88 GLY C 1 1 16 29491 1 1 88 GLY CA C -6.219 -15.604 -4.570 1.00 . A A . 88 GLY CA 1 1 16 29492 1 1 88 GLY H H -5.845 -13.740 -3.719 1.00 . A A . 88 GLY H 1 1 16 29493 1 1 88 GLY HA2 H -5.134 -15.715 -4.588 1.00 . A A . 88 GLY HA2 1 1 16 29494 1 1 88 GLY HA3 H -6.597 -16.301 -3.822 1.00 . A A . 88 GLY HA3 1 1 16 29495 1 1 88 GLY N N -6.566 -14.245 -4.193 1.00 . A A . 88 GLY N 1 1 16 29496 1 1 88 GLY O O -6.505 -15.288 -6.932 1.00 . A A . 88 GLY O 1 1 16 29497 1 1 89 ALA C C -9.614 -16.836 -7.315 1.00 . A A . 89 ALA C 1 1 16 29498 1 1 89 ALA CA C -8.222 -17.459 -7.191 1.00 . A A . 89 ALA CA 1 1 16 29499 1 1 89 ALA CB C -8.263 -18.989 -7.213 1.00 . A A . 89 ALA CB 1 1 16 29500 1 1 89 ALA H H -7.833 -17.548 -5.147 1.00 . A A . 89 ALA H 1 1 16 29501 1 1 89 ALA HA H -7.603 -17.113 -8.019 1.00 . A A . 89 ALA HA 1 1 16 29502 1 1 89 ALA HB1 H -7.758 -19.378 -6.330 1.00 . A A . 89 ALA HB1 1 1 16 29503 1 1 89 ALA HB2 H -9.300 -19.324 -7.217 1.00 . A A . 89 ALA HB2 1 1 16 29504 1 1 89 ALA HB3 H -7.761 -19.353 -8.109 1.00 . A A . 89 ALA HB3 1 1 16 29505 1 1 89 ALA N N -7.602 -17.009 -5.957 1.00 . A A . 89 ALA N 1 1 16 29506 1 1 89 ALA O O -10.581 -17.527 -7.633 1.00 . A A . 89 ALA O 1 1 16 29507 1 1 90 ASP C C -10.772 -13.629 -8.089 1.00 . A A . 90 ASP C 1 1 16 29508 1 1 90 ASP CA C -10.929 -14.815 -7.134 1.00 . A A . 90 ASP CA 1 1 16 29509 1 1 90 ASP CB C -11.336 -14.268 -5.764 1.00 . A A . 90 ASP CB 1 1 16 29510 1 1 90 ASP CG C -12.817 -13.912 -5.624 1.00 . A A . 90 ASP CG 1 1 16 29511 1 1 90 ASP H H -8.880 -14.984 -6.798 1.00 . A A . 90 ASP H 1 1 16 29512 1 1 90 ASP HA H -11.657 -15.543 -7.490 1.00 . A A . 90 ASP HA 1 1 16 29513 1 1 90 ASP HB2 H -11.082 -15.007 -5.005 1.00 . A A . 90 ASP HB2 1 1 16 29514 1 1 90 ASP HB3 H -10.742 -13.378 -5.554 1.00 . A A . 90 ASP HB3 1 1 16 29515 1 1 90 ASP N N -9.671 -15.538 -7.056 1.00 . A A . 90 ASP N 1 1 16 29516 1 1 90 ASP O O -10.436 -12.525 -7.663 1.00 . A A . 90 ASP O 1 1 16 29517 1 1 90 ASP OD1 O -13.557 -14.168 -6.598 1.00 . A A . 90 ASP OD1 1 1 16 29518 1 1 90 ASP OD2 O -13.176 -13.393 -4.545 1.00 . A A . 90 ASP OD2 1 1 16 29519 1 1 91 ALA C C -11.605 -11.594 -9.887 1.00 . A A . 91 ALA C 1 1 16 29520 1 1 91 ALA CA C -10.914 -12.867 -10.380 1.00 . A A . 91 ALA CA 1 1 16 29521 1 1 91 ALA CB C -11.507 -13.382 -11.693 1.00 . A A . 91 ALA CB 1 1 16 29522 1 1 91 ALA H H -11.296 -14.799 -9.700 1.00 . A A . 91 ALA H 1 1 16 29523 1 1 91 ALA HA H -9.854 -12.661 -10.530 1.00 . A A . 91 ALA HA 1 1 16 29524 1 1 91 ALA HB1 H -11.892 -14.391 -11.547 1.00 . A A . 91 ALA HB1 1 1 16 29525 1 1 91 ALA HB2 H -12.318 -12.725 -12.008 1.00 . A A . 91 ALA HB2 1 1 16 29526 1 1 91 ALA HB3 H -10.732 -13.396 -12.460 1.00 . A A . 91 ALA HB3 1 1 16 29527 1 1 91 ALA N N -11.023 -13.898 -9.361 1.00 . A A . 91 ALA N 1 1 16 29528 1 1 91 ALA O O -10.993 -10.528 -9.845 1.00 . A A . 91 ALA O 1 1 16 29529 1 1 92 ALA C C -12.770 -9.743 -8.152 1.00 . A A . 92 ALA C 1 1 16 29530 1 1 92 ALA CA C -13.652 -10.624 -9.040 1.00 . A A . 92 ALA CA 1 1 16 29531 1 1 92 ALA CB C -14.888 -11.142 -8.302 1.00 . A A . 92 ALA CB 1 1 16 29532 1 1 92 ALA H H -13.361 -12.619 -9.564 1.00 . A A . 92 ALA H 1 1 16 29533 1 1 92 ALA HA H -13.976 -10.045 -9.904 1.00 . A A . 92 ALA HA 1 1 16 29534 1 1 92 ALA HB1 H -15.201 -12.090 -8.740 1.00 . A A . 92 ALA HB1 1 1 16 29535 1 1 92 ALA HB2 H -14.647 -11.290 -7.249 1.00 . A A . 92 ALA HB2 1 1 16 29536 1 1 92 ALA HB3 H -15.695 -10.416 -8.391 1.00 . A A . 92 ALA HB3 1 1 16 29537 1 1 92 ALA N N -12.871 -11.748 -9.527 1.00 . A A . 92 ALA N 1 1 16 29538 1 1 92 ALA O O -12.543 -8.574 -8.462 1.00 . A A . 92 ALA O 1 1 16 29539 1 1 93 LYS C C -10.127 -9.263 -6.821 1.00 . A A . 93 LYS C 1 1 16 29540 1 1 93 LYS CA C -11.446 -9.620 -6.132 1.00 . A A . 93 LYS CA 1 1 16 29541 1 1 93 LYS CB C -11.269 -10.425 -4.843 1.00 . A A . 93 LYS CB 1 1 16 29542 1 1 93 LYS CD C -12.212 -10.608 -2.511 1.00 . A A . 93 LYS CD 1 1 16 29543 1 1 93 LYS CE C -12.925 -11.852 -1.979 1.00 . A A . 93 LYS CE 1 1 16 29544 1 1 93 LYS CG C -12.537 -10.380 -3.989 1.00 . A A . 93 LYS CG 1 1 16 29545 1 1 93 LYS H H -12.487 -11.288 -6.822 1.00 . A A . 93 LYS H 1 1 16 29546 1 1 93 LYS HA H -11.959 -8.695 -5.866 1.00 . A A . 93 LYS HA 1 1 16 29547 1 1 93 LYS HB2 H -11.027 -11.460 -5.086 1.00 . A A . 93 LYS HB2 1 1 16 29548 1 1 93 LYS HB3 H -10.428 -10.027 -4.274 1.00 . A A . 93 LYS HB3 1 1 16 29549 1 1 93 LYS HD2 H -11.135 -10.720 -2.386 1.00 . A A . 93 LYS HD2 1 1 16 29550 1 1 93 LYS HD3 H -12.512 -9.736 -1.931 1.00 . A A . 93 LYS HD3 1 1 16 29551 1 1 93 LYS HE2 H -13.136 -11.731 -0.916 1.00 . A A . 93 LYS HE2 1 1 16 29552 1 1 93 LYS HE3 H -13.885 -11.972 -2.482 1.00 . A A . 93 LYS HE3 1 1 16 29553 1 1 93 LYS HG2 H -13.028 -9.414 -4.112 1.00 . A A . 93 LYS HG2 1 1 16 29554 1 1 93 LYS HG3 H -13.239 -11.140 -4.332 1.00 . A A . 93 LYS HG3 1 1 16 29555 1 1 93 LYS HZ1 H -11.533 -12.989 -3.034 1.00 . A A . 93 LYS HZ1 1 1 16 29556 1 1 93 LYS HZ2 H -11.450 -13.215 -1.423 1.00 . A A . 93 LYS HZ2 1 1 16 29557 1 1 93 LYS N N -12.297 -10.337 -7.066 1.00 . A A . 93 LYS N 1 1 16 29558 1 1 93 LYS NZ N -12.093 -13.057 -2.191 1.00 . A A . 93 LYS NZ 1 1 16 29559 1 1 93 LYS O O -9.538 -8.220 -6.540 1.00 . A A . 93 LYS O 1 1 16 29560 1 1 94 LYS C C -8.604 -8.704 -9.331 1.00 . A A . 94 LYS C 1 1 16 29561 1 1 94 LYS CA C -8.464 -9.940 -8.440 1.00 . A A . 94 LYS CA 1 1 16 29562 1 1 94 LYS CB C -8.073 -11.207 -9.204 1.00 . A A . 94 LYS CB 1 1 16 29563 1 1 94 LYS CD C -6.130 -12.814 -9.261 1.00 . A A . 94 LYS CD 1 1 16 29564 1 1 94 LYS CE C -5.492 -13.234 -10.587 1.00 . A A . 94 LYS CE 1 1 16 29565 1 1 94 LYS CG C -6.551 -11.344 -9.297 1.00 . A A . 94 LYS CG 1 1 16 29566 1 1 94 LYS H H -10.187 -10.994 -7.933 1.00 . A A . 94 LYS H 1 1 16 29567 1 1 94 LYS HA H -7.680 -9.751 -7.707 1.00 . A A . 94 LYS HA 1 1 16 29568 1 1 94 LYS HB2 H -8.490 -12.081 -8.704 1.00 . A A . 94 LYS HB2 1 1 16 29569 1 1 94 LYS HB3 H -8.501 -11.179 -10.206 1.00 . A A . 94 LYS HB3 1 1 16 29570 1 1 94 LYS HD2 H -5.423 -12.974 -8.447 1.00 . A A . 94 LYS HD2 1 1 16 29571 1 1 94 LYS HD3 H -6.998 -13.440 -9.056 1.00 . A A . 94 LYS HD3 1 1 16 29572 1 1 94 LYS HE2 H -6.190 -13.850 -11.153 1.00 . A A . 94 LYS HE2 1 1 16 29573 1 1 94 LYS HE3 H -5.283 -12.352 -11.192 1.00 . A A . 94 LYS HE3 1 1 16 29574 1 1 94 LYS HG2 H -6.197 -10.882 -10.219 1.00 . A A . 94 LYS HG2 1 1 16 29575 1 1 94 LYS HG3 H -6.084 -10.807 -8.471 1.00 . A A . 94 LYS HG3 1 1 16 29576 1 1 94 LYS HZ1 H -4.327 -14.962 -10.606 1.00 . A A . 94 LYS HZ1 1 1 16 29577 1 1 94 LYS HZ2 H -3.463 -13.608 -10.875 1.00 . A A . 94 LYS HZ2 1 1 16 29578 1 1 94 LYS N N -9.702 -10.149 -7.710 1.00 . A A . 94 LYS N 1 1 16 29579 1 1 94 LYS NZ N -4.241 -13.985 -10.345 1.00 . A A . 94 LYS NZ 1 1 16 29580 1 1 94 LYS O O -7.622 -8.231 -9.901 1.00 . A A . 94 LYS O 1 1 16 29581 1 1 95 LYS C C -10.644 -5.924 -9.338 1.00 . A A . 95 LYS C 1 1 16 29582 1 1 95 LYS CA C -10.114 -7.045 -10.234 1.00 . A A . 95 LYS CA 1 1 16 29583 1 1 95 LYS CB C -11.052 -7.405 -11.388 1.00 . A A . 95 LYS CB 1 1 16 29584 1 1 95 LYS CD C -11.139 -7.533 -13.906 1.00 . A A . 95 LYS CD 1 1 16 29585 1 1 95 LYS CE C -10.040 -8.312 -14.631 1.00 . A A . 95 LYS CE 1 1 16 29586 1 1 95 LYS CG C -10.572 -6.780 -12.700 1.00 . A A . 95 LYS CG 1 1 16 29587 1 1 95 LYS H H -10.626 -8.607 -8.956 1.00 . A A . 95 LYS H 1 1 16 29588 1 1 95 LYS HA H -9.172 -6.718 -10.675 1.00 . A A . 95 LYS HA 1 1 16 29589 1 1 95 LYS HB2 H -11.104 -8.488 -11.495 1.00 . A A . 95 LYS HB2 1 1 16 29590 1 1 95 LYS HB3 H -12.060 -7.058 -11.164 1.00 . A A . 95 LYS HB3 1 1 16 29591 1 1 95 LYS HD2 H -11.919 -8.219 -13.576 1.00 . A A . 95 LYS HD2 1 1 16 29592 1 1 95 LYS HD3 H -11.604 -6.827 -14.594 1.00 . A A . 95 LYS HD3 1 1 16 29593 1 1 95 LYS HE2 H -9.233 -8.547 -13.937 1.00 . A A . 95 LYS HE2 1 1 16 29594 1 1 95 LYS HE3 H -10.436 -9.261 -14.992 1.00 . A A . 95 LYS HE3 1 1 16 29595 1 1 95 LYS HG2 H -10.879 -5.735 -12.743 1.00 . A A . 95 LYS HG2 1 1 16 29596 1 1 95 LYS HG3 H -9.483 -6.794 -12.737 1.00 . A A . 95 LYS HG3 1 1 16 29597 1 1 95 LYS HZ1 H -9.361 -8.099 -16.590 1.00 . A A . 95 LYS HZ1 1 1 16 29598 1 1 95 LYS HZ2 H -10.142 -6.779 -16.040 1.00 . A A . 95 LYS HZ2 1 1 16 29599 1 1 95 LYS N N -9.832 -8.217 -9.423 1.00 . A A . 95 LYS N 1 1 16 29600 1 1 95 LYS NZ N -9.510 -7.525 -15.767 1.00 . A A . 95 LYS NZ 1 1 16 29601 1 1 95 LYS O O -10.859 -4.804 -9.800 1.00 . A A . 95 LYS O 1 1 16 29602 1 1 96 ASP C C -10.313 -5.125 -5.987 1.00 . A A . 96 ASP C 1 1 16 29603 1 1 96 ASP CA C -11.341 -5.300 -7.107 1.00 . A A . 96 ASP CA 1 1 16 29604 1 1 96 ASP CB C -12.649 -5.782 -6.478 1.00 . A A . 96 ASP CB 1 1 16 29605 1 1 96 ASP CG C -13.884 -4.953 -6.839 1.00 . A A . 96 ASP CG 1 1 16 29606 1 1 96 ASP H H -10.661 -7.177 -7.705 1.00 . A A . 96 ASP H 1 1 16 29607 1 1 96 ASP HA H -11.500 -4.383 -7.674 1.00 . A A . 96 ASP HA 1 1 16 29608 1 1 96 ASP HB2 H -12.822 -6.815 -6.780 1.00 . A A . 96 ASP HB2 1 1 16 29609 1 1 96 ASP HB3 H -12.535 -5.781 -5.394 1.00 . A A . 96 ASP HB3 1 1 16 29610 1 1 96 ASP N N -10.839 -6.264 -8.073 1.00 . A A . 96 ASP N 1 1 16 29611 1 1 96 ASP O O -10.527 -4.345 -5.060 1.00 . A A . 96 ASP O 1 1 16 29612 1 1 96 ASP OD1 O -14.312 -5.054 -8.009 1.00 . A A . 96 ASP OD1 1 1 16 29613 1 1 96 ASP OD2 O -14.372 -4.239 -5.937 1.00 . A A . 96 ASP OD2 1 1 16 29614 1 1 97 LEU C C -6.833 -5.490 -5.816 1.00 . A A . 97 LEU C 1 1 16 29615 1 1 97 LEU CA C -8.159 -5.800 -5.119 1.00 . A A . 97 LEU CA 1 1 16 29616 1 1 97 LEU CB C -8.129 -7.082 -4.283 1.00 . A A . 97 LEU CB 1 1 16 29617 1 1 97 LEU CD1 C -9.040 -8.446 -2.367 1.00 . A A . 97 LEU CD1 1 1 16 29618 1 1 97 LEU CD2 C -9.657 -5.996 -2.595 1.00 . A A . 97 LEU CD2 1 1 16 29619 1 1 97 LEU CG C -9.311 -7.291 -3.333 1.00 . A A . 97 LEU CG 1 1 16 29620 1 1 97 LEU H H -9.054 -6.496 -6.867 1.00 . A A . 97 LEU H 1 1 16 29621 1 1 97 LEU HA H -8.394 -4.979 -4.441 1.00 . A A . 97 LEU HA 1 1 16 29622 1 1 97 LEU HB2 H -8.079 -7.933 -4.961 1.00 . A A . 97 LEU HB2 1 1 16 29623 1 1 97 LEU HB3 H -7.211 -7.087 -3.695 1.00 . A A . 97 LEU HB3 1 1 16 29624 1 1 97 LEU HD11 H -8.578 -9.271 -2.909 1.00 . A A . 97 LEU HD11 1 1 16 29625 1 1 97 LEU HD12 H -8.370 -8.109 -1.577 1.00 . A A . 97 LEU HD12 1 1 16 29626 1 1 97 LEU HD13 H -9.980 -8.781 -1.929 1.00 . A A . 97 LEU HD13 1 1 16 29627 1 1 97 LEU HD21 H -8.753 -5.400 -2.464 1.00 . A A . 97 LEU HD21 1 1 16 29628 1 1 97 LEU HD22 H -10.384 -5.429 -3.177 1.00 . A A . 97 LEU HD22 1 1 16 29629 1 1 97 LEU HD23 H -10.079 -6.235 -1.619 1.00 . A A . 97 LEU HD23 1 1 16 29630 1 1 97 LEU HG H -10.182 -7.565 -3.927 1.00 . A A . 97 LEU HG 1 1 16 29631 1 1 97 LEU N N -9.220 -5.864 -6.109 1.00 . A A . 97 LEU N 1 1 16 29632 1 1 97 LEU O O -6.104 -4.591 -5.400 1.00 . A A . 97 LEU O 1 1 16 29633 1 1 98 THR C C -5.645 -5.481 -9.003 1.00 . A A . 98 THR C 1 1 16 29634 1 1 98 THR CA C -5.336 -6.070 -7.625 1.00 . A A . 98 THR CA 1 1 16 29635 1 1 98 THR CB C -4.615 -7.418 -7.689 1.00 . A A . 98 THR CB 1 1 16 29636 1 1 98 THR CG2 C -4.703 -8.192 -6.372 1.00 . A A . 98 THR CG2 1 1 16 29637 1 1 98 THR H H -7.160 -6.981 -7.198 1.00 . A A . 98 THR H 1 1 16 29638 1 1 98 THR HA H -4.711 -5.347 -7.101 1.00 . A A . 98 THR HA 1 1 16 29639 1 1 98 THR HB H -3.577 -7.290 -7.996 1.00 . A A . 98 THR HB 1 1 16 29640 1 1 98 THR HG1 H -6.279 -8.414 -8.183 1.00 . A A . 98 THR HG1 1 1 16 29641 1 1 98 THR HG21 H -5.750 -8.344 -6.110 1.00 . A A . 98 THR HG21 1 1 16 29642 1 1 98 THR HG22 H -4.213 -9.159 -6.485 1.00 . A A . 98 THR HG22 1 1 16 29643 1 1 98 THR HG23 H -4.210 -7.625 -5.583 1.00 . A A . 98 THR HG23 1 1 16 29644 1 1 98 THR N N -6.562 -6.252 -6.866 1.00 . A A . 98 THR N 1 1 16 29645 1 1 98 THR O O -4.768 -5.412 -9.863 1.00 . A A . 98 THR O 1 1 16 29646 1 1 98 THR OG1 O -5.397 -8.188 -8.597 1.00 . A A . 98 THR OG1 1 1 16 29647 1 1 99 GLY C C -6.495 -3.255 -10.779 1.00 . A A . 99 GLY C 1 1 16 29648 1 1 99 GLY CA C -7.329 -4.489 -10.427 1.00 . A A . 99 GLY CA 1 1 16 29649 1 1 99 GLY H H -7.600 -5.129 -8.464 1.00 . A A . 99 GLY H 1 1 16 29650 1 1 99 GLY HA2 H -7.243 -5.229 -11.223 1.00 . A A . 99 GLY HA2 1 1 16 29651 1 1 99 GLY HA3 H -8.381 -4.214 -10.360 1.00 . A A . 99 GLY HA3 1 1 16 29652 1 1 99 GLY N N -6.893 -5.070 -9.169 1.00 . A A . 99 GLY N 1 1 16 29653 1 1 99 GLY O O -6.038 -2.536 -9.892 1.00 . A A . 99 GLY O 1 1 16 29654 1 1 100 CYS C C -6.490 -0.714 -12.688 1.00 . A A . 100 CYS C 1 1 16 29655 1 1 100 CYS CA C -5.550 -1.914 -12.557 1.00 . A A . 100 CYS CA 1 1 16 29656 1 1 100 CYS CB C -4.841 -2.230 -13.875 1.00 . A A . 100 CYS CB 1 1 16 29657 1 1 100 CYS H H -6.696 -3.638 -12.792 1.00 . A A . 100 CYS H 1 1 16 29658 1 1 100 CYS HA H -4.779 -1.722 -11.811 1.00 . A A . 100 CYS HA 1 1 16 29659 1 1 100 CYS HB2 H -5.464 -2.913 -14.452 1.00 . A A . 100 CYS HB2 1 1 16 29660 1 1 100 CYS HB3 H -4.754 -1.311 -14.454 1.00 . A A . 100 CYS HB3 1 1 16 29661 1 1 100 CYS N N -6.321 -3.048 -12.077 1.00 . A A . 100 CYS N 1 1 16 29662 1 1 100 CYS O O -6.268 0.324 -12.066 1.00 . A A . 100 CYS O 1 1 16 29663 1 1 100 CYS SG S -3.176 -2.968 -13.693 1.00 . A A . 100 CYS SG 1 1 16 29664 1 1 101 LYS C C -9.877 -0.329 -13.279 1.00 . A A . 101 LYS C 1 1 16 29665 1 1 101 LYS CA C -8.495 0.158 -13.721 1.00 . A A . 101 LYS CA 1 1 16 29666 1 1 101 LYS CB C -8.448 0.636 -15.174 1.00 . A A . 101 LYS CB 1 1 16 29667 1 1 101 LYS CD C -9.454 2.271 -16.809 1.00 . A A . 101 LYS CD 1 1 16 29668 1 1 101 LYS CE C -9.042 3.700 -17.169 1.00 . A A . 101 LYS CE 1 1 16 29669 1 1 101 LYS CG C -9.173 1.973 -15.335 1.00 . A A . 101 LYS CG 1 1 16 29670 1 1 101 LYS H H -7.694 -1.744 -14.002 1.00 . A A . 101 LYS H 1 1 16 29671 1 1 101 LYS HA H -8.210 1.003 -13.094 1.00 . A A . 101 LYS HA 1 1 16 29672 1 1 101 LYS HB2 H -7.411 0.739 -15.493 1.00 . A A . 101 LYS HB2 1 1 16 29673 1 1 101 LYS HB3 H -8.907 -0.111 -15.821 1.00 . A A . 101 LYS HB3 1 1 16 29674 1 1 101 LYS HD2 H -8.911 1.563 -17.436 1.00 . A A . 101 LYS HD2 1 1 16 29675 1 1 101 LYS HD3 H -10.515 2.132 -17.017 1.00 . A A . 101 LYS HD3 1 1 16 29676 1 1 101 LYS HE2 H -8.920 4.289 -16.260 1.00 . A A . 101 LYS HE2 1 1 16 29677 1 1 101 LYS HE3 H -8.076 3.690 -17.674 1.00 . A A . 101 LYS HE3 1 1 16 29678 1 1 101 LYS HG2 H -10.111 1.952 -14.780 1.00 . A A . 101 LYS HG2 1 1 16 29679 1 1 101 LYS HG3 H -8.568 2.773 -14.908 1.00 . A A . 101 LYS HG3 1 1 16 29680 1 1 101 LYS HZ1 H -10.141 3.851 -18.932 1.00 . A A . 101 LYS HZ1 1 1 16 29681 1 1 101 LYS HZ2 H -10.979 4.322 -17.618 1.00 . A A . 101 LYS HZ2 1 1 16 29682 1 1 101 LYS N N -7.521 -0.897 -13.500 1.00 . A A . 101 LYS N 1 1 16 29683 1 1 101 LYS NZ N -10.058 4.328 -18.042 1.00 . A A . 101 LYS NZ 1 1 16 29684 1 1 101 LYS O O -10.218 -1.496 -13.469 1.00 . A A . 101 LYS O 1 1 16 29685 1 1 102 LYS C C -11.872 -0.728 -11.067 1.00 . A A . 102 LYS C 1 1 16 29686 1 1 102 LYS CA C -11.970 0.267 -12.225 1.00 . A A . 102 LYS CA 1 1 16 29687 1 1 102 LYS CB C -12.844 -0.221 -13.383 1.00 . A A . 102 LYS CB 1 1 16 29688 1 1 102 LYS CD C -13.545 0.309 -15.747 1.00 . A A . 102 LYS CD 1 1 16 29689 1 1 102 LYS CE C -12.374 -0.159 -16.613 1.00 . A A . 102 LYS CE 1 1 16 29690 1 1 102 LYS CG C -13.049 0.886 -14.419 1.00 . A A . 102 LYS CG 1 1 16 29691 1 1 102 LYS H H -10.349 1.535 -12.546 1.00 . A A . 102 LYS H 1 1 16 29692 1 1 102 LYS HA H -12.416 1.189 -11.852 1.00 . A A . 102 LYS HA 1 1 16 29693 1 1 102 LYS HB2 H -12.378 -1.085 -13.856 1.00 . A A . 102 LYS HB2 1 1 16 29694 1 1 102 LYS HB3 H -13.810 -0.550 -13.000 1.00 . A A . 102 LYS HB3 1 1 16 29695 1 1 102 LYS HD2 H -14.217 -0.528 -15.555 1.00 . A A . 102 LYS HD2 1 1 16 29696 1 1 102 LYS HD3 H -14.121 1.063 -16.283 1.00 . A A . 102 LYS HD3 1 1 16 29697 1 1 102 LYS HE2 H -12.334 0.430 -17.529 1.00 . A A . 102 LYS HE2 1 1 16 29698 1 1 102 LYS HE3 H -11.435 0.009 -16.086 1.00 . A A . 102 LYS HE3 1 1 16 29699 1 1 102 LYS HG2 H -13.769 1.612 -14.043 1.00 . A A . 102 LYS HG2 1 1 16 29700 1 1 102 LYS HG3 H -12.112 1.419 -14.578 1.00 . A A . 102 LYS HG3 1 1 16 29701 1 1 102 LYS HZ1 H -12.872 -1.734 -17.883 1.00 . A A . 102 LYS HZ1 1 1 16 29702 1 1 102 LYS HZ2 H -11.629 -2.085 -16.892 1.00 . A A . 102 LYS HZ2 1 1 16 29703 1 1 102 LYS N N -10.634 0.589 -12.697 1.00 . A A . 102 LYS N 1 1 16 29704 1 1 102 LYS NZ N -12.515 -1.594 -16.944 1.00 . A A . 102 LYS NZ 1 1 16 29705 1 1 102 LYS O O -12.552 -1.753 -11.065 1.00 . A A . 102 LYS O 1 1 16 29706 1 1 103 SER C C -11.118 -0.456 -7.668 1.00 . A A . 103 SER C 1 1 16 29707 1 1 103 SER CA C -10.825 -1.241 -8.948 1.00 . A A . 103 SER CA 1 1 16 29708 1 1 103 SER CB C -9.403 -1.804 -8.912 1.00 . A A . 103 SER CB 1 1 16 29709 1 1 103 SER H H -10.472 0.446 -10.118 1.00 . A A . 103 SER H 1 1 16 29710 1 1 103 SER HA H -11.536 -2.059 -9.066 1.00 . A A . 103 SER HA 1 1 16 29711 1 1 103 SER HB2 H -9.050 -1.832 -7.880 1.00 . A A . 103 SER HB2 1 1 16 29712 1 1 103 SER HB3 H -9.410 -2.832 -9.273 1.00 . A A . 103 SER HB3 1 1 16 29713 1 1 103 SER HG H -8.557 -0.068 -9.436 1.00 . A A . 103 SER HG 1 1 16 29714 1 1 103 SER N N -11.021 -0.390 -10.109 1.00 . A A . 103 SER N 1 1 16 29715 1 1 103 SER O O -11.580 0.683 -7.727 1.00 . A A . 103 SER O 1 1 16 29716 1 1 103 SER OG O -8.502 -1.031 -9.700 1.00 . A A . 103 SER OG 1 1 16 29717 1 1 104 LYS C C -9.985 0.583 -5.000 1.00 . A A . 104 LYS C 1 1 16 29718 1 1 104 LYS CA C -11.066 -0.471 -5.250 1.00 . A A . 104 LYS CA 1 1 16 29719 1 1 104 LYS CB C -11.157 -1.531 -4.151 1.00 . A A . 104 LYS CB 1 1 16 29720 1 1 104 LYS CD C -13.570 -1.647 -3.426 1.00 . A A . 104 LYS CD 1 1 16 29721 1 1 104 LYS CE C -14.439 -2.693 -2.726 1.00 . A A . 104 LYS CE 1 1 16 29722 1 1 104 LYS CG C -12.468 -2.314 -4.252 1.00 . A A . 104 LYS CG 1 1 16 29723 1 1 104 LYS H H -10.462 -2.021 -6.504 1.00 . A A . 104 LYS H 1 1 16 29724 1 1 104 LYS HA H -12.033 0.030 -5.296 1.00 . A A . 104 LYS HA 1 1 16 29725 1 1 104 LYS HB2 H -10.313 -2.217 -4.231 1.00 . A A . 104 LYS HB2 1 1 16 29726 1 1 104 LYS HB3 H -11.089 -1.054 -3.174 1.00 . A A . 104 LYS HB3 1 1 16 29727 1 1 104 LYS HD2 H -13.123 -0.985 -2.684 1.00 . A A . 104 LYS HD2 1 1 16 29728 1 1 104 LYS HD3 H -14.190 -1.028 -4.073 1.00 . A A . 104 LYS HD3 1 1 16 29729 1 1 104 LYS HE2 H -13.805 -3.435 -2.240 1.00 . A A . 104 LYS HE2 1 1 16 29730 1 1 104 LYS HE3 H -15.030 -2.218 -1.943 1.00 . A A . 104 LYS HE3 1 1 16 29731 1 1 104 LYS HG2 H -12.779 -2.377 -5.295 1.00 . A A . 104 LYS HG2 1 1 16 29732 1 1 104 LYS HG3 H -12.314 -3.335 -3.903 1.00 . A A . 104 LYS HG3 1 1 16 29733 1 1 104 LYS HZ1 H -15.352 -4.364 -3.573 1.00 . A A . 104 LYS HZ1 1 1 16 29734 1 1 104 LYS HZ2 H -16.293 -3.035 -3.613 1.00 . A A . 104 LYS HZ2 1 1 16 29735 1 1 104 LYS N N -10.837 -1.095 -6.542 1.00 . A A . 104 LYS N 1 1 16 29736 1 1 104 LYS NZ N -15.335 -3.358 -3.698 1.00 . A A . 104 LYS NZ 1 1 16 29737 1 1 104 LYS O O -10.223 1.568 -4.303 1.00 . A A . 104 LYS O 1 1 16 29738 1 1 105 CYS C C -7.836 2.356 -6.483 1.00 . A A . 105 CYS C 1 1 16 29739 1 1 105 CYS CA C -7.701 1.254 -5.430 1.00 . A A . 105 CYS CA 1 1 16 29740 1 1 105 CYS CB C -6.358 0.528 -5.532 1.00 . A A . 105 CYS CB 1 1 16 29741 1 1 105 CYS H H -8.634 -0.465 -6.147 1.00 . A A . 105 CYS H 1 1 16 29742 1 1 105 CYS HA H -7.770 1.669 -4.424 1.00 . A A . 105 CYS HA 1 1 16 29743 1 1 105 CYS HB2 H -6.260 0.064 -6.514 1.00 . A A . 105 CYS HB2 1 1 16 29744 1 1 105 CYS HB3 H -5.541 1.242 -5.435 1.00 . A A . 105 CYS HB3 1 1 16 29745 1 1 105 CYS N N -8.820 0.339 -5.582 1.00 . A A . 105 CYS N 1 1 16 29746 1 1 105 CYS O O -7.990 3.528 -6.143 1.00 . A A . 105 CYS O 1 1 16 29747 1 1 105 CYS SG S -6.234 -0.746 -4.225 1.00 . A A . 105 CYS SG 1 1 16 29748 1 1 106 HIS C C -9.306 2.833 -9.412 1.00 . A A . 106 HIS C 1 1 16 29749 1 1 106 HIS CA C -7.886 2.878 -8.844 1.00 . A A . 106 HIS CA 1 1 16 29750 1 1 106 HIS CB C -6.816 2.603 -9.901 1.00 . A A . 106 HIS CB 1 1 16 29751 1 1 106 HIS CD2 C -4.358 1.868 -9.400 1.00 . A A . 106 HIS CD2 1 1 16 29752 1 1 106 HIS CE1 C -3.663 3.720 -8.466 1.00 . A A . 106 HIS CE1 1 1 16 29753 1 1 106 HIS CG C -5.400 2.747 -9.395 1.00 . A A . 106 HIS CG 1 1 16 29754 1 1 106 HIS H H -7.649 0.985 -8.007 1.00 . A A . 106 HIS H 1 1 16 29755 1 1 106 HIS HA H -7.700 3.870 -8.432 1.00 . A A . 106 HIS HA 1 1 16 29756 1 1 106 HIS HB2 H -6.951 1.592 -10.287 1.00 . A A . 106 HIS HB2 1 1 16 29757 1 1 106 HIS HB3 H -6.962 3.286 -10.738 1.00 . A A . 106 HIS HB3 1 1 16 29758 1 1 106 HIS HD1 H -5.461 4.740 -8.646 1.00 . A A . 106 HIS HD1 1 1 16 29759 1 1 106 HIS HD2 H -4.382 0.853 -9.797 1.00 . A A . 106 HIS HD2 1 1 16 29760 1 1 106 HIS HE1 H -3.015 4.449 -7.978 1.00 . A A . 106 HIS HE1 1 1 16 29761 1 1 106 HIS N N -7.773 1.941 -7.739 1.00 . A A . 106 HIS N 1 1 16 29762 1 1 106 HIS ND1 N -4.932 3.905 -8.799 1.00 . A A . 106 HIS ND1 1 1 16 29763 1 1 106 HIS NE2 N -3.309 2.457 -8.840 1.00 . A A . 106 HIS NE2 1 1 16 29764 1 1 106 HIS O O -9.897 1.761 -9.532 1.00 . A A . 106 HIS O 1 1 16 29765 1 1 107 GLU C C -11.132 4.959 -11.578 1.00 . A A . 107 GLU C 1 1 16 29766 1 1 107 GLU CA C -11.152 4.120 -10.298 1.00 . A A . 107 GLU CA 1 1 16 29767 1 1 107 GLU CB C -12.122 4.708 -9.272 1.00 . A A . 107 GLU CB 1 1 16 29768 1 1 107 GLU CD C -13.993 3.871 -7.802 1.00 . A A . 107 GLU CD 1 1 16 29769 1 1 107 GLU CG C -12.546 3.651 -8.250 1.00 . A A . 107 GLU CG 1 1 16 29770 1 1 107 GLU H H -9.325 4.878 -9.646 1.00 . A A . 107 GLU H 1 1 16 29771 1 1 107 GLU HA H -11.454 3.099 -10.531 1.00 . A A . 107 GLU HA 1 1 16 29772 1 1 107 GLU HB2 H -11.651 5.547 -8.759 1.00 . A A . 107 GLU HB2 1 1 16 29773 1 1 107 GLU HB3 H -13.003 5.101 -9.781 1.00 . A A . 107 GLU HB3 1 1 16 29774 1 1 107 GLU HG2 H -12.443 2.657 -8.685 1.00 . A A . 107 GLU HG2 1 1 16 29775 1 1 107 GLU HG3 H -11.884 3.691 -7.385 1.00 . A A . 107 GLU HG3 1 1 16 29776 1 1 107 GLU N N -9.813 4.011 -9.746 1.00 . A A . 107 GLU N 1 1 16 29777 1 1 107 GLU O O -12.156 5.513 -11.977 1.00 . A A . 107 GLU O 1 1 16 29778 1 1 107 GLU OXT O -10.041 5.049 -12.181 1.00 . A A . 107 GLU OXT 1 1 16 29779 1 1 107 GLU OE1 O -14.884 3.703 -8.662 1.00 . A A . 107 GLU OE1 1 1 16 29780 1 1 107 GLU OE2 O -14.174 4.201 -6.610 1.00 . A A . 107 GLU OE2 1 1 16 29781 2 2 1 HEC C1A C -1.118 5.308 9.246 1.00 . B A . 108 HEC C1A 1 1 16 29782 2 2 1 HEC C1B C -2.154 2.191 12.054 1.00 . B A . 108 HEC C1B 1 1 16 29783 2 2 1 HEC C1C C -2.359 -0.668 8.757 1.00 . B A . 108 HEC C1C 1 1 16 29784 2 2 1 HEC C1D C -1.174 2.446 6.005 1.00 . B A . 108 HEC C1D 1 1 16 29785 2 2 1 HEC C2A C -0.926 6.357 10.219 1.00 . B A . 108 HEC C2A 1 1 16 29786 2 2 1 HEC C2B C -2.587 1.296 13.101 1.00 . B A . 108 HEC C2B 1 1 16 29787 2 2 1 HEC C2C C -2.414 -1.739 7.790 1.00 . B A . 108 HEC C2C 1 1 16 29788 2 2 1 HEC C2D C -0.718 3.352 4.978 1.00 . B A . 108 HEC C2D 1 1 16 29789 2 2 1 HEC C3A C -1.162 5.820 11.435 1.00 . B A . 108 HEC C3A 1 1 16 29790 2 2 1 HEC C3B C -2.821 0.097 12.527 1.00 . B A . 108 HEC C3B 1 1 16 29791 2 2 1 HEC C3C C -2.076 -1.212 6.594 1.00 . B A . 108 HEC C3C 1 1 16 29792 2 2 1 HEC C3D C -0.590 4.568 5.550 1.00 . B A . 108 HEC C3D 1 1 16 29793 2 2 1 HEC C4A C -1.502 4.432 11.227 1.00 . B A . 108 HEC C4A 1 1 16 29794 2 2 1 HEC C4B C -2.536 0.237 11.119 1.00 . B A . 108 HEC C4B 1 1 16 29795 2 2 1 HEC C4C C -1.809 0.191 6.809 1.00 . B A . 108 HEC C4C 1 1 16 29796 2 2 1 HEC C4D C -0.966 4.427 6.937 1.00 . B A . 108 HEC C4D 1 1 16 29797 2 2 1 HEC CAA C -0.537 7.770 9.893 1.00 . B A . 108 HEC CAA 1 1 16 29798 2 2 1 HEC CAB C -3.289 -1.167 13.187 1.00 . B A . 108 HEC CAB 1 1 16 29799 2 2 1 HEC CAC C -1.984 -1.911 5.269 1.00 . B A . 108 HEC CAC 1 1 16 29800 2 2 1 HEC CAD C -0.145 5.850 4.907 1.00 . B A . 108 HEC CAD 1 1 16 29801 2 2 1 HEC CBA C 0.968 8.022 9.922 1.00 . B A . 108 HEC CBA 1 1 16 29802 2 2 1 HEC CBB C -4.552 -0.998 14.028 1.00 . B A . 108 HEC CBB 1 1 16 29803 2 2 1 HEC CBC C -2.996 -3.038 5.089 1.00 . B A . 108 HEC CBC 1 1 16 29804 2 2 1 HEC CBD C -0.714 6.072 3.508 1.00 . B A . 108 HEC CBD 1 1 16 29805 2 2 1 HEC CGA C 1.329 9.064 10.970 1.00 . B A . 108 HEC CGA 1 1 16 29806 2 2 1 HEC CGD C 0.398 6.300 2.494 1.00 . B A . 108 HEC CGD 1 1 16 29807 2 2 1 HEC CHA C -0.965 5.476 7.874 1.00 . B A . 108 HEC CHA 1 1 16 29808 2 2 1 HEC CHB C -1.817 3.525 12.255 1.00 . B A . 108 HEC CHB 1 1 16 29809 2 2 1 HEC CHC C -2.659 -0.797 10.173 1.00 . B A . 108 HEC CHC 1 1 16 29810 2 2 1 HEC CHD C -1.424 1.093 5.800 1.00 . B A . 108 HEC CHD 1 1 16 29811 2 2 1 HEC CMA C -1.095 6.496 12.773 1.00 . B A . 108 HEC CMA 1 1 16 29812 2 2 1 HEC CMB C -2.734 1.673 14.546 1.00 . B A . 108 HEC CMB 1 1 16 29813 2 2 1 HEC CMC C -2.783 -3.160 8.102 1.00 . B A . 108 HEC CMC 1 1 16 29814 2 2 1 HEC CMD C -0.449 2.969 3.552 1.00 . B A . 108 HEC CMD 1 1 16 29815 2 2 1 HEC FE FE -1.727 2.322 9.016 1.00 . B A . 108 HEC FE 1 1 16 29816 2 2 1 HEC HAA1 H -0.886 8.021 8.892 1.00 . B A . 108 HEC HAA1 1 1 16 29817 2 2 1 HEC HAA2 H -0.991 8.448 10.616 1.00 . B A . 108 HEC HAA2 1 1 16 29818 2 2 1 HEC HAB H -3.508 -1.915 12.425 1.00 . B A . 108 HEC HAB 1 1 16 29819 2 2 1 HEC HAC H -2.156 -1.193 4.467 1.00 . B A . 108 HEC HAC 1 1 16 29820 2 2 1 HEC HAD1 H -0.461 6.693 5.521 1.00 . B A . 108 HEC HAD1 1 1 16 29821 2 2 1 HEC HAD2 H 0.941 5.853 4.816 1.00 . B A . 108 HEC HAD2 1 1 16 29822 2 2 1 HEC HBA1 H 1.487 7.093 10.160 1.00 . B A . 108 HEC HBA1 1 1 16 29823 2 2 1 HEC HBA2 H 1.295 8.381 8.946 1.00 . B A . 108 HEC HBA2 1 1 16 29824 2 2 1 HEC HBB1 H -4.366 -1.360 15.039 1.00 . B A . 108 HEC HBB1 1 1 16 29825 2 2 1 HEC HBB2 H -4.826 0.056 14.063 1.00 . B A . 108 HEC HBB2 1 1 16 29826 2 2 1 HEC HBB3 H -5.365 -1.570 13.581 1.00 . B A . 108 HEC HBB3 1 1 16 29827 2 2 1 HEC HBC1 H -3.168 -3.206 4.026 1.00 . B A . 108 HEC HBC1 1 1 16 29828 2 2 1 HEC HBC2 H -2.609 -3.950 5.544 1.00 . B A . 108 HEC HBC2 1 1 16 29829 2 2 1 HEC HBC3 H -3.935 -2.763 5.570 1.00 . B A . 108 HEC HBC3 1 1 16 29830 2 2 1 HEC HBD1 H -1.288 5.196 3.206 1.00 . B A . 108 HEC HBD1 1 1 16 29831 2 2 1 HEC HBD2 H -1.364 6.948 3.516 1.00 . B A . 108 HEC HBD2 1 1 16 29832 2 2 1 HEC HHA H -0.836 6.490 7.494 1.00 . B A . 108 HEC HHA 1 1 16 29833 2 2 1 HEC HHB H -1.795 3.898 13.279 1.00 . B A . 108 HEC HHB 1 1 16 29834 2 2 1 HEC HHC H -2.967 -1.777 10.537 1.00 . B A . 108 HEC HHC 1 1 16 29835 2 2 1 HEC HHD H -1.315 0.700 4.789 1.00 . B A . 108 HEC HHD 1 1 16 29836 2 2 1 HEC HMA1 H -2.104 6.723 13.116 1.00 . B A . 108 HEC HMA1 1 1 16 29837 2 2 1 HEC HMA2 H -0.607 5.836 13.490 1.00 . B A . 108 HEC HMA2 1 1 16 29838 2 2 1 HEC HMA3 H -0.525 7.421 12.685 1.00 . B A . 108 HEC HMA3 1 1 16 29839 2 2 1 HEC HMB1 H -3.312 0.908 15.065 1.00 . B A . 108 HEC HMB1 1 1 16 29840 2 2 1 HEC HMB2 H -1.748 1.756 15.003 1.00 . B A . 108 HEC HMB2 1 1 16 29841 2 2 1 HEC HMB3 H -3.250 2.631 14.621 1.00 . B A . 108 HEC HMB3 1 1 16 29842 2 2 1 HEC HMC1 H -3.756 -3.386 7.667 1.00 . B A . 108 HEC HMC1 1 1 16 29843 2 2 1 HEC HMC2 H -2.033 -3.831 7.684 1.00 . B A . 108 HEC HMC2 1 1 16 29844 2 2 1 HEC HMC3 H -2.829 -3.294 9.183 1.00 . B A . 108 HEC HMC3 1 1 16 29845 2 2 1 HEC HMD1 H -0.032 1.962 3.519 1.00 . B A . 108 HEC HMD1 1 1 16 29846 2 2 1 HEC HMD2 H -1.380 2.995 2.987 1.00 . B A . 108 HEC HMD2 1 1 16 29847 2 2 1 HEC HMD3 H 0.261 3.670 3.115 1.00 . B A . 108 HEC HMD3 1 1 16 29848 2 2 1 HEC NA N -1.472 4.128 9.877 1.00 . B A . 108 HEC NA 1 1 16 29849 2 2 1 HEC NB N -2.126 1.529 10.838 1.00 . B A . 108 HEC NB 1 1 16 29850 2 2 1 HEC NC N -1.985 0.515 8.143 1.00 . B A . 108 HEC NC 1 1 16 29851 2 2 1 HEC ND N -1.324 3.118 7.206 1.00 . B A . 108 HEC ND 1 1 16 29852 2 2 1 HEC O1A O 1.230 8.722 12.168 1.00 . B A . 108 HEC O1A 1 1 16 29853 2 2 1 HEC O1D O 0.290 7.297 1.748 1.00 . B A . 108 HEC O1D 1 1 16 29854 2 2 1 HEC O2A O 1.696 10.184 10.554 1.00 . B A . 108 HEC O2A 1 1 16 29855 2 2 1 HEC O2D O 1.334 5.472 2.484 1.00 . B A . 108 HEC O2D 1 1 16 29856 3 2 1 HEC C1A C 9.571 -1.870 1.774 1.00 . C A . 109 HEC C1A 1 1 16 29857 3 2 1 HEC C1B C 5.776 -0.109 2.860 1.00 . C A . 109 HEC C1B 1 1 16 29858 3 2 1 HEC C1C C 7.893 2.879 5.263 1.00 . C A . 109 HEC C1C 1 1 16 29859 3 2 1 HEC C1D C 11.660 1.264 3.895 1.00 . C A . 109 HEC C1D 1 1 16 29860 3 2 1 HEC C2A C 9.035 -2.938 0.964 1.00 . C A . 109 HEC C2A 1 1 16 29861 3 2 1 HEC C2B C 4.433 0.258 3.241 1.00 . C A . 109 HEC C2B 1 1 16 29862 3 2 1 HEC C2C C 8.440 4.009 5.975 1.00 . C A . 109 HEC C2C 1 1 16 29863 3 2 1 HEC C2D C 12.997 0.810 3.592 1.00 . C A . 109 HEC C2D 1 1 16 29864 3 2 1 HEC C3A C 7.694 -2.792 0.951 1.00 . C A . 109 HEC C3A 1 1 16 29865 3 2 1 HEC C3B C 4.532 1.298 4.095 1.00 . C A . 109 HEC C3B 1 1 16 29866 3 2 1 HEC C3C C 9.780 3.964 5.821 1.00 . C A . 109 HEC C3C 1 1 16 29867 3 2 1 HEC C3D C 12.877 -0.325 2.871 1.00 . C A . 109 HEC C3D 1 1 16 29868 3 2 1 HEC C4A C 7.385 -1.631 1.752 1.00 . C A . 109 HEC C4A 1 1 16 29869 3 2 1 HEC C4B C 5.939 1.586 4.253 1.00 . C A . 109 HEC C4B 1 1 16 29870 3 2 1 HEC C4C C 10.076 2.805 5.012 1.00 . C A . 109 HEC C4C 1 1 16 29871 3 2 1 HEC C4D C 11.465 -0.585 2.720 1.00 . C A . 109 HEC C4D 1 1 16 29872 3 2 1 HEC CAA C 9.856 -3.994 0.282 1.00 . C A . 109 HEC CAA 1 1 16 29873 3 2 1 HEC CAB C 3.422 2.044 4.777 1.00 . C A . 109 HEC CAB 1 1 16 29874 3 2 1 HEC CAC C 10.806 4.914 6.367 1.00 . C A . 109 HEC CAC 1 1 16 29875 3 2 1 HEC CAD C 13.974 -1.185 2.313 1.00 . C A . 109 HEC CAD 1 1 16 29876 3 2 1 HEC CBA C 10.085 -3.738 -1.205 1.00 . C A . 109 HEC CBA 1 1 16 29877 3 2 1 HEC CBB C 2.374 1.143 5.424 1.00 . C A . 109 HEC CBB 1 1 16 29878 3 2 1 HEC CBC C 10.800 5.025 7.889 1.00 . C A . 109 HEC CBC 1 1 16 29879 3 2 1 HEC CBD C 15.193 -1.305 3.223 1.00 . C A . 109 HEC CBD 1 1 16 29880 3 2 1 HEC CGA C 10.839 -4.893 -1.849 1.00 . C A . 109 HEC CGA 1 1 16 29881 3 2 1 HEC CGD C 16.371 -0.519 2.667 1.00 . C A . 109 HEC CGD 1 1 16 29882 3 2 1 HEC CHA C 10.926 -1.684 2.027 1.00 . C A . 109 HEC CHA 1 1 16 29883 3 2 1 HEC CHB C 6.086 -1.145 1.985 1.00 . C A . 109 HEC CHB 1 1 16 29884 3 2 1 HEC CHC C 6.458 2.607 5.068 1.00 . C A . 109 HEC CHC 1 1 16 29885 3 2 1 HEC CHD C 11.370 2.410 4.627 1.00 . C A . 109 HEC CHD 1 1 16 29886 3 2 1 HEC CMA C 6.678 -3.646 0.250 1.00 . C A . 109 HEC CMA 1 1 16 29887 3 2 1 HEC CMB C 3.186 -0.420 2.752 1.00 . C A . 109 HEC CMB 1 1 16 29888 3 2 1 HEC CMC C 7.630 5.022 6.732 1.00 . C A . 109 HEC CMC 1 1 16 29889 3 2 1 HEC CMD C 14.257 1.504 4.021 1.00 . C A . 109 HEC CMD 1 1 16 29890 3 2 1 HEC FE FE 8.719 0.546 3.443 1.00 . C A . 109 HEC FE 1 1 16 29891 3 2 1 HEC HAA1 H 10.838 -4.051 0.753 1.00 . C A . 109 HEC HAA1 1 1 16 29892 3 2 1 HEC HAA2 H 9.354 -4.957 0.370 1.00 . C A . 109 HEC HAA2 1 1 16 29893 3 2 1 HEC HAB H 3.837 2.673 5.565 1.00 . C A . 109 HEC HAB 1 1 16 29894 3 2 1 HEC HAC H 11.801 4.583 6.073 1.00 . C A . 109 HEC HAC 1 1 16 29895 3 2 1 HEC HAD1 H 13.595 -2.193 2.146 1.00 . C A . 109 HEC HAD1 1 1 16 29896 3 2 1 HEC HAD2 H 14.318 -0.765 1.367 1.00 . C A . 109 HEC HAD2 1 1 16 29897 3 2 1 HEC HBA1 H 9.124 -3.626 -1.706 1.00 . C A . 109 HEC HBA1 1 1 16 29898 3 2 1 HEC HBA2 H 10.669 -2.827 -1.331 1.00 . C A . 109 HEC HBA2 1 1 16 29899 3 2 1 HEC HBB1 H 2.399 0.161 4.952 1.00 . C A . 109 HEC HBB1 1 1 16 29900 3 2 1 HEC HBB2 H 2.589 1.041 6.487 1.00 . C A . 109 HEC HBB2 1 1 16 29901 3 2 1 HEC HBB3 H 1.386 1.584 5.294 1.00 . C A . 109 HEC HBB3 1 1 16 29902 3 2 1 HEC HBC1 H 10.547 4.058 8.323 1.00 . C A . 109 HEC HBC1 1 1 16 29903 3 2 1 HEC HBC2 H 11.788 5.331 8.235 1.00 . C A . 109 HEC HBC2 1 1 16 29904 3 2 1 HEC HBC3 H 10.063 5.767 8.197 1.00 . C A . 109 HEC HBC3 1 1 16 29905 3 2 1 HEC HBD1 H 14.948 -0.915 4.211 1.00 . C A . 109 HEC HBD1 1 1 16 29906 3 2 1 HEC HBD2 H 15.481 -2.353 3.307 1.00 . C A . 109 HEC HBD2 1 1 16 29907 3 2 1 HEC HHA H 11.623 -2.440 1.663 1.00 . C A . 109 HEC HHA 1 1 16 29908 3 2 1 HEC HHB H 5.268 -1.616 1.440 1.00 . C A . 109 HEC HHB 1 1 16 29909 3 2 1 HEC HHC H 5.745 3.237 5.601 1.00 . C A . 109 HEC HHC 1 1 16 29910 3 2 1 HEC HHD H 12.200 3.050 4.926 1.00 . C A . 109 HEC HHD 1 1 16 29911 3 2 1 HEC HMA1 H 7.092 -4.004 -0.692 1.00 . C A . 109 HEC HMA1 1 1 16 29912 3 2 1 HEC HMA2 H 6.422 -4.497 0.882 1.00 . C A . 109 HEC HMA2 1 1 16 29913 3 2 1 HEC HMA3 H 5.782 -3.058 0.053 1.00 . C A . 109 HEC HMA3 1 1 16 29914 3 2 1 HEC HMB1 H 2.368 0.300 2.723 1.00 . C A . 109 HEC HMB1 1 1 16 29915 3 2 1 HEC HMB2 H 3.357 -0.816 1.750 1.00 . C A . 109 HEC HMB2 1 1 16 29916 3 2 1 HEC HMB3 H 2.928 -1.236 3.426 1.00 . C A . 109 HEC HMB3 1 1 16 29917 3 2 1 HEC HMC1 H 7.797 6.011 6.307 1.00 . C A . 109 HEC HMC1 1 1 16 29918 3 2 1 HEC HMC2 H 6.573 4.768 6.659 1.00 . C A . 109 HEC HMC2 1 1 16 29919 3 2 1 HEC HMC3 H 7.933 5.020 7.779 1.00 . C A . 109 HEC HMC3 1 1 16 29920 3 2 1 HEC HMD1 H 15.013 1.398 3.243 1.00 . C A . 109 HEC HMD1 1 1 16 29921 3 2 1 HEC HMD2 H 14.051 2.562 4.185 1.00 . C A . 109 HEC HMD2 1 1 16 29922 3 2 1 HEC HMD3 H 14.622 1.057 4.945 1.00 . C A . 109 HEC HMD3 1 1 16 29923 3 2 1 HEC NA N 8.547 -1.072 2.254 1.00 . C A . 109 HEC NA 1 1 16 29924 3 2 1 HEC NB N 6.695 0.714 3.488 1.00 . C A . 109 HEC NB 1 1 16 29925 3 2 1 HEC NC N 8.908 2.144 4.675 1.00 . C A . 109 HEC NC 1 1 16 29926 3 2 1 HEC ND N 10.725 0.398 3.354 1.00 . C A . 109 HEC ND 1 1 16 29927 3 2 1 HEC O1A O 11.682 -5.485 -1.142 1.00 . C A . 109 HEC O1A 1 1 16 29928 3 2 1 HEC O1D O 17.108 0.060 3.494 1.00 . C A . 109 HEC O1D 1 1 16 29929 3 2 1 HEC O2A O 10.558 -5.161 -3.037 1.00 . C A . 109 HEC O2A 1 1 16 29930 3 2 1 HEC O2D O 16.514 -0.512 1.425 1.00 . C A . 109 HEC O2D 1 1 16 29931 4 2 1 HEC C1A C -8.820 -3.422 0.368 1.00 . D A . 110 HEC C1A 1 1 16 29932 4 2 1 HEC C1B C -5.111 -1.221 0.106 1.00 . D A . 110 HEC C1B 1 1 16 29933 4 2 1 HEC C1C C -3.039 -4.486 2.050 1.00 . D A . 110 HEC C1C 1 1 16 29934 4 2 1 HEC C1D C -6.759 -6.665 2.344 1.00 . D A . 110 HEC C1D 1 1 16 29935 4 2 1 HEC C2A C -9.643 -2.452 -0.316 1.00 . D A . 110 HEC C2A 1 1 16 29936 4 2 1 HEC C2B C -3.953 -0.381 -0.095 1.00 . D A . 110 HEC C2B 1 1 16 29937 4 2 1 HEC C2C C -2.198 -5.505 2.632 1.00 . D A . 110 HEC C2C 1 1 16 29938 4 2 1 HEC C2D C -7.923 -7.483 2.590 1.00 . D A . 110 HEC C2D 1 1 16 29939 4 2 1 HEC C3A C -8.841 -1.422 -0.659 1.00 . D A . 110 HEC C3A 1 1 16 29940 4 2 1 HEC C3B C -2.907 -1.000 0.491 1.00 . D A . 110 HEC C3B 1 1 16 29941 4 2 1 HEC C3C C -2.996 -6.547 2.947 1.00 . D A . 110 HEC C3C 1 1 16 29942 4 2 1 HEC C3D C -8.985 -6.825 2.078 1.00 . D A . 110 HEC C3D 1 1 16 29943 4 2 1 HEC C4A C -7.513 -1.744 -0.192 1.00 . D A . 110 HEC C4A 1 1 16 29944 4 2 1 HEC C4B C -3.406 -2.229 1.061 1.00 . D A . 110 HEC C4B 1 1 16 29945 4 2 1 HEC C4C C -4.339 -6.184 2.562 1.00 . D A . 110 HEC C4C 1 1 16 29946 4 2 1 HEC C4D C -8.489 -5.594 1.510 1.00 . D A . 110 HEC C4D 1 1 16 29947 4 2 1 HEC CAA C -11.114 -2.603 -0.574 1.00 . D A . 110 HEC CAA 1 1 16 29948 4 2 1 HEC CAB C -1.481 -0.538 0.562 1.00 . D A . 110 HEC CAB 1 1 16 29949 4 2 1 HEC CAC C -2.606 -7.852 3.576 1.00 . D A . 110 HEC CAC 1 1 16 29950 4 2 1 HEC CAD C -10.424 -7.253 2.077 1.00 . D A . 110 HEC CAD 1 1 16 29951 4 2 1 HEC CBA C -11.999 -2.063 0.545 1.00 . D A . 110 HEC CBA 1 1 16 29952 4 2 1 HEC CBB C -1.321 0.916 0.999 1.00 . D A . 110 HEC CBB 1 1 16 29953 4 2 1 HEC CBC C -1.310 -7.791 4.380 1.00 . D A . 110 HEC CBC 1 1 16 29954 4 2 1 HEC CBD C -11.013 -7.445 0.682 1.00 . D A . 110 HEC CBD 1 1 16 29955 4 2 1 HEC CGA C -12.995 -3.116 1.013 1.00 . D A . 110 HEC CGA 1 1 16 29956 4 2 1 HEC CGD C -11.780 -8.756 0.588 1.00 . D A . 110 HEC CGD 1 1 16 29957 4 2 1 HEC CHA C -9.291 -4.627 0.877 1.00 . D A . 110 HEC CHA 1 1 16 29958 4 2 1 HEC CHB C -6.387 -0.917 -0.357 1.00 . D A . 110 HEC CHB 1 1 16 29959 4 2 1 HEC CHC C -2.619 -3.161 1.762 1.00 . D A . 110 HEC CHC 1 1 16 29960 4 2 1 HEC CHD C -5.467 -7.009 2.727 1.00 . D A . 110 HEC CHD 1 1 16 29961 4 2 1 HEC CMA C -9.213 -0.164 -1.388 1.00 . D A . 110 HEC CMA 1 1 16 29962 4 2 1 HEC CMB C -3.960 0.929 -0.827 1.00 . D A . 110 HEC CMB 1 1 16 29963 4 2 1 HEC CMC C -0.715 -5.383 2.831 1.00 . D A . 110 HEC CMC 1 1 16 29964 4 2 1 HEC CMD C -7.908 -8.811 3.289 1.00 . D A . 110 HEC CMD 1 1 16 29965 4 2 1 HEC FE FE -5.937 -3.938 1.237 1.00 . D A . 110 HEC FE 1 1 16 29966 4 2 1 HEC HAA1 H -11.380 -2.065 -1.483 1.00 . D A . 110 HEC HAA1 1 1 16 29967 4 2 1 HEC HAA2 H -11.355 -3.660 -0.693 1.00 . D A . 110 HEC HAA2 1 1 16 29968 4 2 1 HEC HAB H -0.935 -1.151 1.278 1.00 . D A . 110 HEC HAB 1 1 16 29969 4 2 1 HEC HAC H -3.392 -8.176 4.258 1.00 . D A . 110 HEC HAC 1 1 16 29970 4 2 1 HEC HAD1 H -10.521 -8.204 2.601 1.00 . D A . 110 HEC HAD1 1 1 16 29971 4 2 1 HEC HAD2 H -11.028 -6.498 2.580 1.00 . D A . 110 HEC HAD2 1 1 16 29972 4 2 1 HEC HBA1 H -11.378 -1.771 1.392 1.00 . D A . 110 HEC HBA1 1 1 16 29973 4 2 1 HEC HBA2 H -12.552 -1.196 0.184 1.00 . D A . 110 HEC HBA2 1 1 16 29974 4 2 1 HEC HBB1 H -0.991 1.516 0.151 1.00 . D A . 110 HEC HBB1 1 1 16 29975 4 2 1 HEC HBB2 H -2.277 1.293 1.362 1.00 . D A . 110 HEC HBB2 1 1 16 29976 4 2 1 HEC HBB3 H -0.580 0.975 1.797 1.00 . D A . 110 HEC HBB3 1 1 16 29977 4 2 1 HEC HBC1 H -1.155 -8.741 4.891 1.00 . D A . 110 HEC HBC1 1 1 16 29978 4 2 1 HEC HBC2 H -0.474 -7.599 3.708 1.00 . D A . 110 HEC HBC2 1 1 16 29979 4 2 1 HEC HBC3 H -1.377 -6.989 5.115 1.00 . D A . 110 HEC HBC3 1 1 16 29980 4 2 1 HEC HBD1 H -11.696 -6.625 0.460 1.00 . D A . 110 HEC HBD1 1 1 16 29981 4 2 1 HEC HBD2 H -10.209 -7.458 -0.053 1.00 . D A . 110 HEC HBD2 1 1 16 29982 4 2 1 HEC HHA H -10.356 -4.842 0.780 1.00 . D A . 110 HEC HHA 1 1 16 29983 4 2 1 HEC HHB H -6.529 0.025 -0.886 1.00 . D A . 110 HEC HHB 1 1 16 29984 4 2 1 HEC HHC H -1.622 -2.846 2.070 1.00 . D A . 110 HEC HHC 1 1 16 29985 4 2 1 HEC HHD H -5.312 -7.984 3.188 1.00 . D A . 110 HEC HHD 1 1 16 29986 4 2 1 HEC HMA1 H -8.794 0.696 -0.865 1.00 . D A . 110 HEC HMA1 1 1 16 29987 4 2 1 HEC HMA2 H -8.817 -0.200 -2.403 1.00 . D A . 110 HEC HMA2 1 1 16 29988 4 2 1 HEC HMA3 H -10.299 -0.073 -1.425 1.00 . D A . 110 HEC HMA3 1 1 16 29989 4 2 1 HEC HMB1 H -4.595 0.850 -1.709 1.00 . D A . 110 HEC HMB1 1 1 16 29990 4 2 1 HEC HMB2 H -4.345 1.710 -0.171 1.00 . D A . 110 HEC HMB2 1 1 16 29991 4 2 1 HEC HMB3 H -2.944 1.180 -1.133 1.00 . D A . 110 HEC HMB3 1 1 16 29992 4 2 1 HEC HMC1 H -0.471 -5.582 3.875 1.00 . D A . 110 HEC HMC1 1 1 16 29993 4 2 1 HEC HMC2 H -0.203 -6.105 2.194 1.00 . D A . 110 HEC HMC2 1 1 16 29994 4 2 1 HEC HMC3 H -0.394 -4.375 2.568 1.00 . D A . 110 HEC HMC3 1 1 16 29995 4 2 1 HEC HMD1 H -6.905 -9.234 3.244 1.00 . D A . 110 HEC HMD1 1 1 16 29996 4 2 1 HEC HMD2 H -8.198 -8.676 4.331 1.00 . D A . 110 HEC HMD2 1 1 16 29997 4 2 1 HEC HMD3 H -8.610 -9.487 2.801 1.00 . D A . 110 HEC HMD3 1 1 16 29998 4 2 1 HEC NA N -7.511 -2.976 0.439 1.00 . D A . 110 HEC NA 1 1 16 29999 4 2 1 HEC NB N -4.763 -2.355 0.818 1.00 . D A . 110 HEC NB 1 1 16 30000 4 2 1 HEC NC N -4.355 -4.914 2.011 1.00 . D A . 110 HEC NC 1 1 16 30001 4 2 1 HEC ND N -7.118 -5.505 1.679 1.00 . D A . 110 HEC ND 1 1 16 30002 4 2 1 HEC O1A O -14.163 -2.732 1.237 1.00 . D A . 110 HEC O1A 1 1 16 30003 4 2 1 HEC O1D O -11.227 -9.773 1.059 1.00 . D A . 110 HEC O1D 1 1 16 30004 4 2 1 HEC O2A O -12.569 -4.284 1.137 1.00 . D A . 110 HEC O2A 1 1 16 30005 4 2 1 HEC O2D O -12.906 -8.717 0.045 1.00 . D A . 110 HEC O2D 1 1 16 30006 5 2 1 HEC C1A C -0.025 4.081 -9.048 1.00 . E A . 111 HEC C1A 1 1 16 30007 5 2 1 HEC C1B C -1.333 0.676 -11.369 1.00 . E A . 111 HEC C1B 1 1 16 30008 5 2 1 HEC C1C C -3.194 -1.008 -7.817 1.00 . E A . 111 HEC C1C 1 1 16 30009 5 2 1 HEC C1D C -1.886 2.412 -5.523 1.00 . E A . 111 HEC C1D 1 1 16 30010 5 2 1 HEC C2A C 0.640 4.773 -10.127 1.00 . E A . 111 HEC C2A 1 1 16 30011 5 2 1 HEC C2B C -1.492 -0.470 -12.231 1.00 . E A . 111 HEC C2B 1 1 16 30012 5 2 1 HEC C2C C -3.954 -1.640 -6.764 1.00 . E A . 111 HEC C2C 1 1 16 30013 5 2 1 HEC C2D C -1.410 3.407 -4.592 1.00 . E A . 111 HEC C2D 1 1 16 30014 5 2 1 HEC C3A C 0.457 4.036 -11.243 1.00 . E A . 111 HEC C3A 1 1 16 30015 5 2 1 HEC C3B C -2.119 -1.425 -11.512 1.00 . E A . 111 HEC C3B 1 1 16 30016 5 2 1 HEC C3C C -3.848 -0.854 -5.672 1.00 . E A . 111 HEC C3C 1 1 16 30017 5 2 1 HEC C3D C -0.685 4.299 -5.300 1.00 . E A . 111 HEC C3D 1 1 16 30018 5 2 1 HEC C4A C -0.324 2.882 -10.867 1.00 . E A . 111 HEC C4A 1 1 16 30019 5 2 1 HEC C4B C -2.354 -0.878 -10.196 1.00 . E A . 111 HEC C4B 1 1 16 30020 5 2 1 HEC C4C C -3.022 0.272 -6.038 1.00 . E A . 111 HEC C4C 1 1 16 30021 5 2 1 HEC C4D C -0.704 3.865 -6.677 1.00 . E A . 111 HEC C4D 1 1 16 30022 5 2 1 HEC CAA C 1.386 6.068 -9.986 1.00 . E A . 111 HEC CAA 1 1 16 30023 5 2 1 HEC CAB C -2.515 -2.804 -11.953 1.00 . E A . 111 HEC CAB 1 1 16 30024 5 2 1 HEC CAC C -4.456 -1.069 -4.316 1.00 . E A . 111 HEC CAC 1 1 16 30025 5 2 1 HEC CAD C 0.024 5.522 -4.795 1.00 . E A . 111 HEC CAD 1 1 16 30026 5 2 1 HEC CBA C 2.787 6.046 -10.590 1.00 . E A . 111 HEC CBA 1 1 16 30027 5 2 1 HEC CBB C -1.456 -3.870 -11.684 1.00 . E A . 111 HEC CBB 1 1 16 30028 5 2 1 HEC CBC C -4.306 -2.493 -3.789 1.00 . E A . 111 HEC CBC 1 1 16 30029 5 2 1 HEC CBD C -0.911 6.645 -4.357 1.00 . E A . 111 HEC CBD 1 1 16 30030 5 2 1 HEC CGA C 3.063 7.317 -11.380 1.00 . E A . 111 HEC CGA 1 1 16 30031 5 2 1 HEC CGD C -0.159 7.962 -4.218 1.00 . E A . 111 HEC CGD 1 1 16 30032 5 2 1 HEC CHA C -0.059 4.533 -7.733 1.00 . E A . 111 HEC CHA 1 1 16 30033 5 2 1 HEC CHB C -0.727 1.867 -11.755 1.00 . E A . 111 HEC CHB 1 1 16 30034 5 2 1 HEC CHC C -2.989 -1.569 -9.148 1.00 . E A . 111 HEC CHC 1 1 16 30035 5 2 1 HEC CHD C -2.674 1.322 -5.168 1.00 . E A . 111 HEC CHD 1 1 16 30036 5 2 1 HEC CMA C 0.951 4.324 -12.631 1.00 . E A . 111 HEC CMA 1 1 16 30037 5 2 1 HEC CMB C -1.030 -0.543 -13.658 1.00 . E A . 111 HEC CMB 1 1 16 30038 5 2 1 HEC CMC C -4.707 -2.931 -6.905 1.00 . E A . 111 HEC CMC 1 1 16 30039 5 2 1 HEC CMD C -1.694 3.410 -3.118 1.00 . E A . 111 HEC CMD 1 1 16 30040 5 2 1 HEC FE FE -1.638 1.551 -8.449 1.00 . E A . 111 HEC FE 1 1 16 30041 5 2 1 HEC HAA1 H 0.832 6.862 -10.487 1.00 . E A . 111 HEC HAA1 1 1 16 30042 5 2 1 HEC HAA2 H 1.495 6.312 -8.929 1.00 . E A . 111 HEC HAA2 1 1 16 30043 5 2 1 HEC HAB H -3.419 -3.108 -11.425 1.00 . E A . 111 HEC HAB 1 1 16 30044 5 2 1 HEC HAC H -3.977 -0.407 -3.595 1.00 . E A . 111 HEC HAC 1 1 16 30045 5 2 1 HEC HAD1 H 0.636 5.258 -3.932 1.00 . E A . 111 HEC HAD1 1 1 16 30046 5 2 1 HEC HAD2 H 0.662 5.923 -5.583 1.00 . E A . 111 HEC HAD2 1 1 16 30047 5 2 1 HEC HBA1 H 3.525 5.965 -9.792 1.00 . E A . 111 HEC HBA1 1 1 16 30048 5 2 1 HEC HBA2 H 2.881 5.192 -11.260 1.00 . E A . 111 HEC HBA2 1 1 16 30049 5 2 1 HEC HBB1 H -1.069 -3.750 -10.672 1.00 . E A . 111 HEC HBB1 1 1 16 30050 5 2 1 HEC HBB2 H -1.902 -4.859 -11.788 1.00 . E A . 111 HEC HBB2 1 1 16 30051 5 2 1 HEC HBB3 H -0.641 -3.761 -12.399 1.00 . E A . 111 HEC HBB3 1 1 16 30052 5 2 1 HEC HBC1 H -3.377 -2.923 -4.161 1.00 . E A . 111 HEC HBC1 1 1 16 30053 5 2 1 HEC HBC2 H -4.288 -2.476 -2.699 1.00 . E A . 111 HEC HBC2 1 1 16 30054 5 2 1 HEC HBC3 H -5.148 -3.096 -4.128 1.00 . E A . 111 HEC HBC3 1 1 16 30055 5 2 1 HEC HBD1 H -1.700 6.771 -5.098 1.00 . E A . 111 HEC HBD1 1 1 16 30056 5 2 1 HEC HBD2 H -1.355 6.394 -3.394 1.00 . E A . 111 HEC HBD2 1 1 16 30057 5 2 1 HEC HHA H 0.448 5.469 -7.500 1.00 . E A . 111 HEC HHA 1 1 16 30058 5 2 1 HEC HHB H -0.550 2.031 -12.818 1.00 . E A . 111 HEC HHB 1 1 16 30059 5 2 1 HEC HHC H -3.338 -2.581 -9.351 1.00 . E A . 111 HEC HHC 1 1 16 30060 5 2 1 HEC HHD H -3.050 1.274 -4.146 1.00 . E A . 111 HEC HHD 1 1 16 30061 5 2 1 HEC HMA1 H 0.933 5.399 -12.808 1.00 . E A . 111 HEC HMA1 1 1 16 30062 5 2 1 HEC HMA2 H 1.972 3.955 -12.737 1.00 . E A . 111 HEC HMA2 1 1 16 30063 5 2 1 HEC HMA3 H 0.308 3.825 -13.356 1.00 . E A . 111 HEC HMA3 1 1 16 30064 5 2 1 HEC HMB1 H -0.122 0.048 -13.776 1.00 . E A . 111 HEC HMB1 1 1 16 30065 5 2 1 HEC HMB2 H -0.825 -1.580 -13.921 1.00 . E A . 111 HEC HMB2 1 1 16 30066 5 2 1 HEC HMB3 H -1.807 -0.148 -14.312 1.00 . E A . 111 HEC HMB3 1 1 16 30067 5 2 1 HEC HMC1 H -4.321 -3.655 -6.187 1.00 . E A . 111 HEC HMC1 1 1 16 30068 5 2 1 HEC HMC2 H -5.765 -2.757 -6.713 1.00 . E A . 111 HEC HMC2 1 1 16 30069 5 2 1 HEC HMC3 H -4.579 -3.318 -7.916 1.00 . E A . 111 HEC HMC3 1 1 16 30070 5 2 1 HEC HMD1 H -2.621 2.869 -2.926 1.00 . E A . 111 HEC HMD1 1 1 16 30071 5 2 1 HEC HMD2 H -0.874 2.924 -2.589 1.00 . E A . 111 HEC HMD2 1 1 16 30072 5 2 1 HEC HMD3 H -1.793 4.437 -2.769 1.00 . E A . 111 HEC HMD3 1 1 16 30073 5 2 1 HEC NA N -0.615 2.919 -9.514 1.00 . E A . 111 HEC NA 1 1 16 30074 5 2 1 HEC NB N -1.867 0.415 -10.119 1.00 . E A . 111 HEC NB 1 1 16 30075 5 2 1 HEC NC N -2.625 0.168 -7.359 1.00 . E A . 111 HEC NC 1 1 16 30076 5 2 1 HEC ND N -1.446 2.703 -6.803 1.00 . E A . 111 HEC ND 1 1 16 30077 5 2 1 HEC O1A O 3.119 8.386 -10.735 1.00 . E A . 111 HEC O1A 1 1 16 30078 5 2 1 HEC O1D O 0.341 8.214 -3.101 1.00 . E A . 111 HEC O1D 1 1 16 30079 5 2 1 HEC O2A O 3.213 7.196 -12.615 1.00 . E A . 111 HEC O2A 1 1 16 30080 5 2 1 HEC O2D O -0.098 8.690 -5.232 1.00 . E A . 111 HEC O2D 1 1 17 30081 1 1 1 ALA C C -1.987 5.648 20.788 1.00 . A A . 1 ALA C 1 1 17 30082 1 1 1 ALA CA C -1.284 4.628 21.685 1.00 . A A . 1 ALA CA 1 1 17 30083 1 1 1 ALA CB C -1.547 3.186 21.247 1.00 . A A . 1 ALA CB 1 1 17 30084 1 1 1 ALA H1 H -1.118 4.294 23.681 1.00 . A A . 1 ALA H1 1 1 17 30085 1 1 1 ALA H2 H -1.707 5.792 23.294 1.00 . A A . 1 ALA H2 1 1 17 30086 1 1 1 ALA HA H -0.210 4.812 21.659 1.00 . A A . 1 ALA HA 1 1 17 30087 1 1 1 ALA HB1 H -2.608 2.961 21.355 1.00 . A A . 1 ALA HB1 1 1 17 30088 1 1 1 ALA HB2 H -1.254 3.064 20.204 1.00 . A A . 1 ALA HB2 1 1 17 30089 1 1 1 ALA HB3 H -0.966 2.505 21.869 1.00 . A A . 1 ALA HB3 1 1 17 30090 1 1 1 ALA N N -1.731 4.807 23.056 1.00 . A A . 1 ALA N 1 1 17 30091 1 1 1 ALA O O -3.052 6.156 21.135 1.00 . A A . 1 ALA O 1 1 17 30092 1 1 2 PRO C C -3.085 6.269 17.916 1.00 . A A . 2 PRO C 1 1 17 30093 1 1 2 PRO CA C -1.899 6.874 18.670 1.00 . A A . 2 PRO CA 1 1 17 30094 1 1 2 PRO CB C -0.739 7.238 17.758 1.00 . A A . 2 PRO CB 1 1 17 30095 1 1 2 PRO CD C -0.084 5.341 19.176 1.00 . A A . 2 PRO CD 1 1 17 30096 1 1 2 PRO CG C 0.294 6.137 17.937 1.00 . A A . 2 PRO CG 1 1 17 30097 1 1 2 PRO HA H -2.259 7.674 19.149 1.00 . A A . 2 PRO HA 1 1 17 30098 1 1 2 PRO HB2 H -1.064 7.304 16.720 1.00 . A A . 2 PRO HB2 1 1 17 30099 1 1 2 PRO HB3 H -0.323 8.210 18.024 1.00 . A A . 2 PRO HB3 1 1 17 30100 1 1 2 PRO HD2 H -0.196 4.281 18.947 1.00 . A A . 2 PRO HD2 1 1 17 30101 1 1 2 PRO HD3 H 0.683 5.421 19.947 1.00 . A A . 2 PRO HD3 1 1 17 30102 1 1 2 PRO HG2 H 0.318 5.490 17.060 1.00 . A A . 2 PRO HG2 1 1 17 30103 1 1 2 PRO HG3 H 1.291 6.563 18.046 1.00 . A A . 2 PRO HG3 1 1 17 30104 1 1 2 PRO N N -1.346 5.924 19.620 1.00 . A A . 2 PRO N 1 1 17 30105 1 1 2 PRO O O -3.848 6.988 17.272 1.00 . A A . 2 PRO O 1 1 17 30106 1 1 3 LYS C C -4.251 4.561 15.860 1.00 . A A . 3 LYS C 1 1 17 30107 1 1 3 LYS CA C -4.282 4.243 17.357 1.00 . A A . 3 LYS CA 1 1 17 30108 1 1 3 LYS CB C -5.622 4.559 18.024 1.00 . A A . 3 LYS CB 1 1 17 30109 1 1 3 LYS CD C -7.025 2.648 18.882 1.00 . A A . 3 LYS CD 1 1 17 30110 1 1 3 LYS CE C -6.489 1.246 18.586 1.00 . A A . 3 LYS CE 1 1 17 30111 1 1 3 LYS CG C -5.884 3.616 19.200 1.00 . A A . 3 LYS CG 1 1 17 30112 1 1 3 LYS H H -2.578 4.376 18.547 1.00 . A A . 3 LYS H 1 1 17 30113 1 1 3 LYS HA H -4.101 3.177 17.487 1.00 . A A . 3 LYS HA 1 1 17 30114 1 1 3 LYS HB2 H -5.624 5.592 18.374 1.00 . A A . 3 LYS HB2 1 1 17 30115 1 1 3 LYS HB3 H -6.427 4.469 17.295 1.00 . A A . 3 LYS HB3 1 1 17 30116 1 1 3 LYS HD2 H -7.717 2.606 19.725 1.00 . A A . 3 LYS HD2 1 1 17 30117 1 1 3 LYS HD3 H -7.590 3.014 18.025 1.00 . A A . 3 LYS HD3 1 1 17 30118 1 1 3 LYS HE2 H -5.606 1.315 17.950 1.00 . A A . 3 LYS HE2 1 1 17 30119 1 1 3 LYS HE3 H -6.177 0.766 19.513 1.00 . A A . 3 LYS HE3 1 1 17 30120 1 1 3 LYS HG2 H -4.979 3.054 19.429 1.00 . A A . 3 LYS HG2 1 1 17 30121 1 1 3 LYS HG3 H -6.132 4.197 20.089 1.00 . A A . 3 LYS HG3 1 1 17 30122 1 1 3 LYS HZ1 H -8.427 0.886 17.912 1.00 . A A . 3 LYS HZ1 1 1 17 30123 1 1 3 LYS HZ2 H -7.288 0.227 16.953 1.00 . A A . 3 LYS HZ2 1 1 17 30124 1 1 3 LYS N N -3.203 4.953 18.021 1.00 . A A . 3 LYS N 1 1 17 30125 1 1 3 LYS NZ N -7.524 0.425 17.919 1.00 . A A . 3 LYS NZ 1 1 17 30126 1 1 3 LYS O O -3.419 5.345 15.406 1.00 . A A . 3 LYS O 1 1 17 30127 1 1 4 ALA C C -5.942 5.482 13.423 1.00 . A A . 4 ALA C 1 1 17 30128 1 1 4 ALA CA C -5.256 4.143 13.700 1.00 . A A . 4 ALA CA 1 1 17 30129 1 1 4 ALA CB C -5.994 2.966 13.060 1.00 . A A . 4 ALA CB 1 1 17 30130 1 1 4 ALA H H -5.842 3.301 15.514 1.00 . A A . 4 ALA H 1 1 17 30131 1 1 4 ALA HA H -4.240 4.176 13.307 1.00 . A A . 4 ALA HA 1 1 17 30132 1 1 4 ALA HB1 H -6.696 2.543 13.778 1.00 . A A . 4 ALA HB1 1 1 17 30133 1 1 4 ALA HB2 H -6.538 3.313 12.181 1.00 . A A . 4 ALA HB2 1 1 17 30134 1 1 4 ALA HB3 H -5.274 2.203 12.763 1.00 . A A . 4 ALA HB3 1 1 17 30135 1 1 4 ALA N N -5.168 3.937 15.136 1.00 . A A . 4 ALA N 1 1 17 30136 1 1 4 ALA O O -6.732 5.959 14.235 1.00 . A A . 4 ALA O 1 1 17 30137 1 1 5 PRO C C -7.630 7.171 11.389 1.00 . A A . 5 PRO C 1 1 17 30138 1 1 5 PRO CA C -6.180 7.341 11.846 1.00 . A A . 5 PRO CA 1 1 17 30139 1 1 5 PRO CB C -5.268 7.859 10.747 1.00 . A A . 5 PRO CB 1 1 17 30140 1 1 5 PRO CD C -4.673 5.530 11.254 1.00 . A A . 5 PRO CD 1 1 17 30141 1 1 5 PRO CG C -4.490 6.653 10.246 1.00 . A A . 5 PRO CG 1 1 17 30142 1 1 5 PRO HA H -6.211 7.964 12.627 1.00 . A A . 5 PRO HA 1 1 17 30143 1 1 5 PRO HB2 H -5.845 8.313 9.941 1.00 . A A . 5 PRO HB2 1 1 17 30144 1 1 5 PRO HB3 H -4.594 8.627 11.127 1.00 . A A . 5 PRO HB3 1 1 17 30145 1 1 5 PRO HD2 H -5.071 4.633 10.779 1.00 . A A . 5 PRO HD2 1 1 17 30146 1 1 5 PRO HD3 H -3.725 5.253 11.714 1.00 . A A . 5 PRO HD3 1 1 17 30147 1 1 5 PRO HG2 H -4.852 6.347 9.264 1.00 . A A . 5 PRO HG2 1 1 17 30148 1 1 5 PRO HG3 H -3.434 6.898 10.135 1.00 . A A . 5 PRO HG3 1 1 17 30149 1 1 5 PRO N N -5.605 6.066 12.241 1.00 . A A . 5 PRO N 1 1 17 30150 1 1 5 PRO O O -8.175 6.069 11.437 1.00 . A A . 5 PRO O 1 1 17 30151 1 1 6 ALA C C -9.648 7.640 9.097 1.00 . A A . 6 ALA C 1 1 17 30152 1 1 6 ALA CA C -9.591 8.266 10.492 1.00 . A A . 6 ALA CA 1 1 17 30153 1 1 6 ALA CB C -10.151 9.689 10.516 1.00 . A A . 6 ALA CB 1 1 17 30154 1 1 6 ALA H H -7.765 9.171 10.921 1.00 . A A . 6 ALA H 1 1 17 30155 1 1 6 ALA HA H -10.169 7.650 11.182 1.00 . A A . 6 ALA HA 1 1 17 30156 1 1 6 ALA HB1 H -9.720 10.236 11.354 1.00 . A A . 6 ALA HB1 1 1 17 30157 1 1 6 ALA HB2 H -9.897 10.195 9.584 1.00 . A A . 6 ALA HB2 1 1 17 30158 1 1 6 ALA HB3 H -11.235 9.652 10.625 1.00 . A A . 6 ALA HB3 1 1 17 30159 1 1 6 ALA N N -8.215 8.278 10.957 1.00 . A A . 6 ALA N 1 1 17 30160 1 1 6 ALA O O -8.686 7.016 8.653 1.00 . A A . 6 ALA O 1 1 17 30161 1 1 7 ASP C C -10.850 8.417 6.085 1.00 . A A . 7 ASP C 1 1 17 30162 1 1 7 ASP CA C -10.982 7.288 7.110 1.00 . A A . 7 ASP CA 1 1 17 30163 1 1 7 ASP CB C -12.376 6.676 6.962 1.00 . A A . 7 ASP CB 1 1 17 30164 1 1 7 ASP CG C -12.613 5.404 7.780 1.00 . A A . 7 ASP CG 1 1 17 30165 1 1 7 ASP H H -11.564 8.336 8.814 1.00 . A A . 7 ASP H 1 1 17 30166 1 1 7 ASP HA H -10.211 6.527 6.993 1.00 . A A . 7 ASP HA 1 1 17 30167 1 1 7 ASP HB2 H -13.117 7.420 7.254 1.00 . A A . 7 ASP HB2 1 1 17 30168 1 1 7 ASP HB3 H -12.547 6.450 5.910 1.00 . A A . 7 ASP HB3 1 1 17 30169 1 1 7 ASP N N -10.786 7.828 8.445 1.00 . A A . 7 ASP N 1 1 17 30170 1 1 7 ASP O O -10.819 9.591 6.450 1.00 . A A . 7 ASP O 1 1 17 30171 1 1 7 ASP OD1 O -11.720 4.531 7.743 1.00 . A A . 7 ASP OD1 1 1 17 30172 1 1 7 ASP OD2 O -13.683 5.334 8.422 1.00 . A A . 7 ASP OD2 1 1 17 30173 1 1 8 GLY C C -9.183 9.351 3.506 1.00 . A A . 8 GLY C 1 1 17 30174 1 1 8 GLY CA C -10.649 8.984 3.743 1.00 . A A . 8 GLY CA 1 1 17 30175 1 1 8 GLY H H -10.804 7.063 4.535 1.00 . A A . 8 GLY H 1 1 17 30176 1 1 8 GLY HA2 H -11.076 8.570 2.829 1.00 . A A . 8 GLY HA2 1 1 17 30177 1 1 8 GLY HA3 H -11.219 9.882 3.982 1.00 . A A . 8 GLY HA3 1 1 17 30178 1 1 8 GLY N N -10.777 8.021 4.823 1.00 . A A . 8 GLY N 1 1 17 30179 1 1 8 GLY O O -8.886 10.291 2.771 1.00 . A A . 8 GLY O 1 1 17 30180 1 1 9 LEU C C -6.409 8.335 2.641 1.00 . A A . 9 LEU C 1 1 17 30181 1 1 9 LEU CA C -6.878 8.825 4.013 1.00 . A A . 9 LEU CA 1 1 17 30182 1 1 9 LEU CB C -6.121 8.193 5.183 1.00 . A A . 9 LEU CB 1 1 17 30183 1 1 9 LEU CD1 C -4.173 6.951 4.171 1.00 . A A . 9 LEU CD1 1 1 17 30184 1 1 9 LEU CD2 C -4.044 9.460 4.522 1.00 . A A . 9 LEU CD2 1 1 17 30185 1 1 9 LEU CG C -4.599 8.134 5.044 1.00 . A A . 9 LEU CG 1 1 17 30186 1 1 9 LEU H H -8.556 7.828 4.740 1.00 . A A . 9 LEU H 1 1 17 30187 1 1 9 LEU HA H -6.716 9.901 4.069 1.00 . A A . 9 LEU HA 1 1 17 30188 1 1 9 LEU HB2 H -6.362 8.749 6.089 1.00 . A A . 9 LEU HB2 1 1 17 30189 1 1 9 LEU HB3 H -6.493 7.178 5.324 1.00 . A A . 9 LEU HB3 1 1 17 30190 1 1 9 LEU HD11 H -4.948 6.185 4.195 1.00 . A A . 9 LEU HD11 1 1 17 30191 1 1 9 LEU HD12 H -4.029 7.291 3.145 1.00 . A A . 9 LEU HD12 1 1 17 30192 1 1 9 LEU HD13 H -3.240 6.536 4.551 1.00 . A A . 9 LEU HD13 1 1 17 30193 1 1 9 LEU HD21 H -4.733 9.879 3.789 1.00 . A A . 9 LEU HD21 1 1 17 30194 1 1 9 LEU HD22 H -3.928 10.158 5.352 1.00 . A A . 9 LEU HD22 1 1 17 30195 1 1 9 LEU HD23 H -3.075 9.290 4.053 1.00 . A A . 9 LEU HD23 1 1 17 30196 1 1 9 LEU HG H -4.171 7.973 6.034 1.00 . A A . 9 LEU HG 1 1 17 30197 1 1 9 LEU N N -8.306 8.591 4.144 1.00 . A A . 9 LEU N 1 1 17 30198 1 1 9 LEU O O -6.122 7.152 2.465 1.00 . A A . 9 LEU O 1 1 17 30199 1 1 10 LYS C C -4.497 9.474 0.136 1.00 . A A . 10 LYS C 1 1 17 30200 1 1 10 LYS CA C -5.917 8.949 0.354 1.00 . A A . 10 LYS CA 1 1 17 30201 1 1 10 LYS CB C -6.929 9.470 -0.668 1.00 . A A . 10 LYS CB 1 1 17 30202 1 1 10 LYS CD C -7.830 11.676 0.159 1.00 . A A . 10 LYS CD 1 1 17 30203 1 1 10 LYS CE C -8.823 12.548 -0.612 1.00 . A A . 10 LYS CE 1 1 17 30204 1 1 10 LYS CG C -6.846 10.993 -0.794 1.00 . A A . 10 LYS CG 1 1 17 30205 1 1 10 LYS H H -6.581 10.230 1.856 1.00 . A A . 10 LYS H 1 1 17 30206 1 1 10 LYS HA H -5.901 7.862 0.266 1.00 . A A . 10 LYS HA 1 1 17 30207 1 1 10 LYS HB2 H -6.742 9.010 -1.638 1.00 . A A . 10 LYS HB2 1 1 17 30208 1 1 10 LYS HB3 H -7.936 9.180 -0.368 1.00 . A A . 10 LYS HB3 1 1 17 30209 1 1 10 LYS HD2 H -8.370 10.922 0.732 1.00 . A A . 10 LYS HD2 1 1 17 30210 1 1 10 LYS HD3 H -7.282 12.288 0.875 1.00 . A A . 10 LYS HD3 1 1 17 30211 1 1 10 LYS HE2 H -9.235 11.986 -1.450 1.00 . A A . 10 LYS HE2 1 1 17 30212 1 1 10 LYS HE3 H -9.660 12.814 0.035 1.00 . A A . 10 LYS HE3 1 1 17 30213 1 1 10 LYS HG2 H -5.832 11.325 -0.574 1.00 . A A . 10 LYS HG2 1 1 17 30214 1 1 10 LYS HG3 H -7.064 11.288 -1.820 1.00 . A A . 10 LYS HG3 1 1 17 30215 1 1 10 LYS HZ1 H -7.205 13.600 -1.398 1.00 . A A . 10 LYS HZ1 1 1 17 30216 1 1 10 LYS HZ2 H -8.643 14.172 -1.905 1.00 . A A . 10 LYS HZ2 1 1 17 30217 1 1 10 LYS N N -6.346 9.270 1.705 1.00 . A A . 10 LYS N 1 1 17 30218 1 1 10 LYS NZ N -8.160 13.775 -1.107 1.00 . A A . 10 LYS NZ 1 1 17 30219 1 1 10 LYS O O -4.027 10.332 0.881 1.00 . A A . 10 LYS O 1 1 17 30220 1 1 11 MET C C -2.439 10.022 -2.583 1.00 . A A . 11 MET C 1 1 17 30221 1 1 11 MET CA C -2.495 9.340 -1.215 1.00 . A A . 11 MET CA 1 1 17 30222 1 1 11 MET CB C -1.584 8.111 -1.219 1.00 . A A . 11 MET CB 1 1 17 30223 1 1 11 MET CE C -0.454 4.869 -0.188 1.00 . A A . 11 MET CE 1 1 17 30224 1 1 11 MET CG C -1.927 7.170 -0.062 1.00 . A A . 11 MET CG 1 1 17 30225 1 1 11 MET H H -4.241 8.239 -1.491 1.00 . A A . 11 MET H 1 1 17 30226 1 1 11 MET HA H -2.205 10.046 -0.437 1.00 . A A . 11 MET HA 1 1 17 30227 1 1 11 MET HB2 H -1.687 7.581 -2.166 1.00 . A A . 11 MET HB2 1 1 17 30228 1 1 11 MET HB3 H -0.543 8.425 -1.141 1.00 . A A . 11 MET HB3 1 1 17 30229 1 1 11 MET HE1 H 0.231 5.704 -0.038 1.00 . A A . 11 MET HE1 1 1 17 30230 1 1 11 MET HE2 H -0.541 4.301 0.738 1.00 . A A . 11 MET HE2 1 1 17 30231 1 1 11 MET HE3 H -0.070 4.222 -0.977 1.00 . A A . 11 MET HE3 1 1 17 30232 1 1 11 MET HG2 H -1.158 7.232 0.707 1.00 . A A . 11 MET HG2 1 1 17 30233 1 1 11 MET HG3 H -2.865 7.476 0.400 1.00 . A A . 11 MET HG3 1 1 17 30234 1 1 11 MET N N -3.852 8.936 -0.890 1.00 . A A . 11 MET N 1 1 17 30235 1 1 11 MET O O -2.935 9.482 -3.571 1.00 . A A . 11 MET O 1 1 17 30236 1 1 11 MET SD S -2.059 5.493 -0.658 1.00 . A A . 11 MET SD 1 1 17 30237 1 1 12 GLU C C -0.242 12.344 -4.067 1.00 . A A . 12 GLU C 1 1 17 30238 1 1 12 GLU CA C -1.703 11.961 -3.829 1.00 . A A . 12 GLU CA 1 1 17 30239 1 1 12 GLU CB C -2.598 13.201 -3.801 1.00 . A A . 12 GLU CB 1 1 17 30240 1 1 12 GLU CD C -1.601 15.331 -4.711 1.00 . A A . 12 GLU CD 1 1 17 30241 1 1 12 GLU CG C -2.384 14.060 -5.048 1.00 . A A . 12 GLU CG 1 1 17 30242 1 1 12 GLU H H -1.429 11.631 -1.790 1.00 . A A . 12 GLU H 1 1 17 30243 1 1 12 GLU HA H -2.044 11.292 -4.620 1.00 . A A . 12 GLU HA 1 1 17 30244 1 1 12 GLU HB2 H -3.644 12.898 -3.738 1.00 . A A . 12 GLU HB2 1 1 17 30245 1 1 12 GLU HB3 H -2.383 13.789 -2.908 1.00 . A A . 12 GLU HB3 1 1 17 30246 1 1 12 GLU HG2 H -1.845 13.486 -5.802 1.00 . A A . 12 GLU HG2 1 1 17 30247 1 1 12 GLU HG3 H -3.349 14.327 -5.480 1.00 . A A . 12 GLU HG3 1 1 17 30248 1 1 12 GLU N N -1.830 11.199 -2.598 1.00 . A A . 12 GLU N 1 1 17 30249 1 1 12 GLU O O 0.096 13.527 -4.097 1.00 . A A . 12 GLU O 1 1 17 30250 1 1 12 GLU OE1 O -1.848 15.875 -3.614 1.00 . A A . 12 GLU OE1 1 1 17 30251 1 1 12 GLU OE2 O -0.772 15.728 -5.559 1.00 . A A . 12 GLU OE2 1 1 17 30252 1 1 13 ALA C C 2.303 11.360 -5.954 1.00 . A A . 13 ALA C 1 1 17 30253 1 1 13 ALA CA C 2.004 11.538 -4.464 1.00 . A A . 13 ALA CA 1 1 17 30254 1 1 13 ALA CB C 2.817 10.584 -3.587 1.00 . A A . 13 ALA CB 1 1 17 30255 1 1 13 ALA H H 0.303 10.364 -4.204 1.00 . A A . 13 ALA H 1 1 17 30256 1 1 13 ALA HA H 2.236 12.564 -4.176 1.00 . A A . 13 ALA HA 1 1 17 30257 1 1 13 ALA HB1 H 2.197 10.229 -2.764 1.00 . A A . 13 ALA HB1 1 1 17 30258 1 1 13 ALA HB2 H 3.149 9.735 -4.185 1.00 . A A . 13 ALA HB2 1 1 17 30259 1 1 13 ALA HB3 H 3.685 11.109 -3.188 1.00 . A A . 13 ALA HB3 1 1 17 30260 1 1 13 ALA N N 0.586 11.323 -4.230 1.00 . A A . 13 ALA N 1 1 17 30261 1 1 13 ALA O O 3.322 11.840 -6.448 1.00 . A A . 13 ALA O 1 1 17 30262 1 1 14 THR C C 0.329 10.928 -8.817 1.00 . A A . 14 THR C 1 1 17 30263 1 1 14 THR CA C 1.551 10.419 -8.051 1.00 . A A . 14 THR CA 1 1 17 30264 1 1 14 THR CB C 1.810 8.924 -8.245 1.00 . A A . 14 THR CB 1 1 17 30265 1 1 14 THR CG2 C 2.657 8.325 -7.119 1.00 . A A . 14 THR CG2 1 1 17 30266 1 1 14 THR H H 0.571 10.280 -6.219 1.00 . A A . 14 THR H 1 1 17 30267 1 1 14 THR HA H 2.411 10.986 -8.408 1.00 . A A . 14 THR HA 1 1 17 30268 1 1 14 THR HB H 2.262 8.729 -9.217 1.00 . A A . 14 THR HB 1 1 17 30269 1 1 14 THR HG1 H 0.090 8.688 -7.250 1.00 . A A . 14 THR HG1 1 1 17 30270 1 1 14 THR HG21 H 3.309 9.095 -6.707 1.00 . A A . 14 THR HG21 1 1 17 30271 1 1 14 THR HG22 H 2.003 7.945 -6.335 1.00 . A A . 14 THR HG22 1 1 17 30272 1 1 14 THR HG23 H 3.263 7.510 -7.515 1.00 . A A . 14 THR HG23 1 1 17 30273 1 1 14 THR N N 1.397 10.667 -6.628 1.00 . A A . 14 THR N 1 1 17 30274 1 1 14 THR O O -0.595 11.480 -8.222 1.00 . A A . 14 THR O 1 1 17 30275 1 1 14 THR OG1 O 0.529 8.324 -8.071 1.00 . A A . 14 THR OG1 1 1 17 30276 1 1 15 LYS C C -1.934 10.235 -10.764 1.00 . A A . 15 LYS C 1 1 17 30277 1 1 15 LYS CA C -0.731 11.156 -10.980 1.00 . A A . 15 LYS CA 1 1 17 30278 1 1 15 LYS CB C -0.272 11.238 -12.437 1.00 . A A . 15 LYS CB 1 1 17 30279 1 1 15 LYS CD C -1.794 11.116 -14.444 1.00 . A A . 15 LYS CD 1 1 17 30280 1 1 15 LYS CE C -2.928 11.807 -15.205 1.00 . A A . 15 LYS CE 1 1 17 30281 1 1 15 LYS CG C -1.295 11.990 -13.292 1.00 . A A . 15 LYS CG 1 1 17 30282 1 1 15 LYS H H 1.118 10.273 -10.602 1.00 . A A . 15 LYS H 1 1 17 30283 1 1 15 LYS HA H -1.007 12.164 -10.671 1.00 . A A . 15 LYS HA 1 1 17 30284 1 1 15 LYS HB2 H 0.693 11.741 -12.491 1.00 . A A . 15 LYS HB2 1 1 17 30285 1 1 15 LYS HB3 H -0.129 10.233 -12.834 1.00 . A A . 15 LYS HB3 1 1 17 30286 1 1 15 LYS HD2 H -0.971 10.903 -15.127 1.00 . A A . 15 LYS HD2 1 1 17 30287 1 1 15 LYS HD3 H -2.142 10.159 -14.056 1.00 . A A . 15 LYS HD3 1 1 17 30288 1 1 15 LYS HE2 H -3.682 12.161 -14.502 1.00 . A A . 15 LYS HE2 1 1 17 30289 1 1 15 LYS HE3 H -2.543 12.683 -15.727 1.00 . A A . 15 LYS HE3 1 1 17 30290 1 1 15 LYS HG2 H -2.137 12.296 -12.672 1.00 . A A . 15 LYS HG2 1 1 17 30291 1 1 15 LYS HG3 H -0.844 12.899 -13.689 1.00 . A A . 15 LYS HG3 1 1 17 30292 1 1 15 LYS HZ1 H -2.903 10.142 -16.457 1.00 . A A . 15 LYS HZ1 1 1 17 30293 1 1 15 LYS HZ2 H -4.365 10.417 -15.794 1.00 . A A . 15 LYS HZ2 1 1 17 30294 1 1 15 LYS N N 0.363 10.724 -10.126 1.00 . A A . 15 LYS N 1 1 17 30295 1 1 15 LYS NZ N -3.544 10.875 -16.175 1.00 . A A . 15 LYS NZ 1 1 17 30296 1 1 15 LYS O O -3.005 10.468 -11.322 1.00 . A A . 15 LYS O 1 1 17 30297 1 1 16 GLN C C -2.881 8.036 -8.149 1.00 . A A . 16 GLN C 1 1 17 30298 1 1 16 GLN CA C -2.769 8.253 -9.659 1.00 . A A . 16 GLN CA 1 1 17 30299 1 1 16 GLN CB C -2.527 6.929 -10.386 1.00 . A A . 16 GLN CB 1 1 17 30300 1 1 16 GLN CD C -3.344 6.824 -12.770 1.00 . A A . 16 GLN CD 1 1 17 30301 1 1 16 GLN CG C -2.167 7.168 -11.854 1.00 . A A . 16 GLN CG 1 1 17 30302 1 1 16 GLN H H -0.842 9.028 -9.505 1.00 . A A . 16 GLN H 1 1 17 30303 1 1 16 GLN HA H -3.686 8.705 -10.037 1.00 . A A . 16 GLN HA 1 1 17 30304 1 1 16 GLN HB2 H -1.723 6.382 -9.895 1.00 . A A . 16 GLN HB2 1 1 17 30305 1 1 16 GLN HB3 H -3.420 6.307 -10.324 1.00 . A A . 16 GLN HB3 1 1 17 30306 1 1 16 GLN HE21 H -3.299 4.936 -12.042 1.00 . A A . 16 GLN HE21 1 1 17 30307 1 1 16 GLN HE22 H -4.519 5.242 -13.233 1.00 . A A . 16 GLN HE22 1 1 17 30308 1 1 16 GLN HG2 H -1.882 8.210 -11.998 1.00 . A A . 16 GLN HG2 1 1 17 30309 1 1 16 GLN HG3 H -1.303 6.561 -12.124 1.00 . A A . 16 GLN HG3 1 1 17 30310 1 1 16 GLN N N -1.716 9.209 -9.955 1.00 . A A . 16 GLN N 1 1 17 30311 1 1 16 GLN NE2 N -3.755 5.563 -12.674 1.00 . A A . 16 GLN NE2 1 1 17 30312 1 1 16 GLN O O -2.214 7.166 -7.592 1.00 . A A . 16 GLN O 1 1 17 30313 1 1 16 GLN OE1 O -3.846 7.650 -13.515 1.00 . A A . 16 GLN OE1 1 1 17 30314 1 1 17 PRO C C -4.810 7.550 -5.724 1.00 . A A . 17 PRO C 1 1 17 30315 1 1 17 PRO CA C -3.960 8.772 -6.077 1.00 . A A . 17 PRO CA 1 1 17 30316 1 1 17 PRO CB C -4.618 10.086 -5.689 1.00 . A A . 17 PRO CB 1 1 17 30317 1 1 17 PRO CD C -4.559 9.907 -8.139 1.00 . A A . 17 PRO CD 1 1 17 30318 1 1 17 PRO CG C -5.176 10.668 -6.977 1.00 . A A . 17 PRO CG 1 1 17 30319 1 1 17 PRO HA H -3.086 8.642 -5.607 1.00 . A A . 17 PRO HA 1 1 17 30320 1 1 17 PRO HB2 H -5.411 9.925 -4.958 1.00 . A A . 17 PRO HB2 1 1 17 30321 1 1 17 PRO HB3 H -3.898 10.764 -5.234 1.00 . A A . 17 PRO HB3 1 1 17 30322 1 1 17 PRO HD2 H -5.326 9.479 -8.785 1.00 . A A . 17 PRO HD2 1 1 17 30323 1 1 17 PRO HD3 H -3.948 10.561 -8.761 1.00 . A A . 17 PRO HD3 1 1 17 30324 1 1 17 PRO HG2 H -6.263 10.580 -6.997 1.00 . A A . 17 PRO HG2 1 1 17 30325 1 1 17 PRO HG3 H -4.941 11.730 -7.049 1.00 . A A . 17 PRO HG3 1 1 17 30326 1 1 17 PRO N N -3.752 8.864 -7.512 1.00 . A A . 17 PRO N 1 1 17 30327 1 1 17 PRO O O -5.307 6.858 -6.611 1.00 . A A . 17 PRO O 1 1 17 30328 1 1 18 VAL C C -6.238 6.497 -2.533 1.00 . A A . 18 VAL C 1 1 17 30329 1 1 18 VAL CA C -5.731 6.195 -3.945 1.00 . A A . 18 VAL CA 1 1 17 30330 1 1 18 VAL CB C -4.901 4.912 -4.020 1.00 . A A . 18 VAL CB 1 1 17 30331 1 1 18 VAL CG1 C -5.641 3.741 -3.371 1.00 . A A . 18 VAL CG1 1 1 17 30332 1 1 18 VAL CG2 C -4.523 4.588 -5.467 1.00 . A A . 18 VAL CG2 1 1 17 30333 1 1 18 VAL H H -4.543 7.890 -3.711 1.00 . A A . 18 VAL H 1 1 17 30334 1 1 18 VAL HA H -6.589 6.082 -4.608 1.00 . A A . 18 VAL HA 1 1 17 30335 1 1 18 VAL HB H -3.979 5.076 -3.462 1.00 . A A . 18 VAL HB 1 1 17 30336 1 1 18 VAL HG11 H -6.689 4.005 -3.233 1.00 . A A . 18 VAL HG11 1 1 17 30337 1 1 18 VAL HG12 H -5.569 2.864 -4.015 1.00 . A A . 18 VAL HG12 1 1 17 30338 1 1 18 VAL HG13 H -5.192 3.519 -2.403 1.00 . A A . 18 VAL HG13 1 1 17 30339 1 1 18 VAL HG21 H -5.409 4.660 -6.099 1.00 . A A . 18 VAL HG21 1 1 17 30340 1 1 18 VAL HG22 H -3.771 5.297 -5.814 1.00 . A A . 18 VAL HG22 1 1 17 30341 1 1 18 VAL HG23 H -4.121 3.576 -5.520 1.00 . A A . 18 VAL HG23 1 1 17 30342 1 1 18 VAL N N -4.951 7.322 -4.426 1.00 . A A . 18 VAL N 1 1 17 30343 1 1 18 VAL O O -5.564 7.177 -1.760 1.00 . A A . 18 VAL O 1 1 17 30344 1 1 19 VAL C C -7.925 4.890 -0.120 1.00 . A A . 19 VAL C 1 1 17 30345 1 1 19 VAL CA C -8.024 6.183 -0.933 1.00 . A A . 19 VAL CA 1 1 17 30346 1 1 19 VAL CB C -9.463 6.678 -1.095 1.00 . A A . 19 VAL CB 1 1 17 30347 1 1 19 VAL CG1 C -10.185 6.714 0.253 1.00 . A A . 19 VAL CG1 1 1 17 30348 1 1 19 VAL CG2 C -9.498 8.049 -1.772 1.00 . A A . 19 VAL CG2 1 1 17 30349 1 1 19 VAL H H -7.961 5.425 -2.873 1.00 . A A . 19 VAL H 1 1 17 30350 1 1 19 VAL HA H -7.455 6.961 -0.426 1.00 . A A . 19 VAL HA 1 1 17 30351 1 1 19 VAL HB H -9.990 5.973 -1.738 1.00 . A A . 19 VAL HB 1 1 17 30352 1 1 19 VAL HG11 H -9.561 6.243 1.013 1.00 . A A . 19 VAL HG11 1 1 17 30353 1 1 19 VAL HG12 H -10.381 7.748 0.534 1.00 . A A . 19 VAL HG12 1 1 17 30354 1 1 19 VAL HG13 H -11.129 6.174 0.175 1.00 . A A . 19 VAL HG13 1 1 17 30355 1 1 19 VAL HG21 H -8.515 8.276 -2.184 1.00 . A A . 19 VAL HG21 1 1 17 30356 1 1 19 VAL HG22 H -10.235 8.039 -2.575 1.00 . A A . 19 VAL HG22 1 1 17 30357 1 1 19 VAL HG23 H -9.769 8.809 -1.039 1.00 . A A . 19 VAL HG23 1 1 17 30358 1 1 19 VAL N N -7.420 5.977 -2.239 1.00 . A A . 19 VAL N 1 1 17 30359 1 1 19 VAL O O -8.522 3.878 -0.482 1.00 . A A . 19 VAL O 1 1 17 30360 1 1 20 PHE C C -7.873 3.912 3.068 1.00 . A A . 20 PHE C 1 1 17 30361 1 1 20 PHE CA C -6.980 3.816 1.829 1.00 . A A . 20 PHE CA 1 1 17 30362 1 1 20 PHE CB C -5.514 3.850 2.268 1.00 . A A . 20 PHE CB 1 1 17 30363 1 1 20 PHE CD1 C -5.002 1.392 2.495 1.00 . A A . 20 PHE CD1 1 1 17 30364 1 1 20 PHE CD2 C -4.772 2.780 4.427 1.00 . A A . 20 PHE CD2 1 1 17 30365 1 1 20 PHE CE1 C -4.595 0.248 3.269 1.00 . A A . 20 PHE CE1 1 1 17 30366 1 1 20 PHE CE2 C -4.365 1.636 5.201 1.00 . A A . 20 PHE CE2 1 1 17 30367 1 1 20 PHE CG C -5.082 2.635 3.090 1.00 . A A . 20 PHE CG 1 1 17 30368 1 1 20 PHE CZ C -4.297 0.426 4.583 1.00 . A A . 20 PHE CZ 1 1 17 30369 1 1 20 PHE H H -6.683 5.794 1.250 1.00 . A A . 20 PHE H 1 1 17 30370 1 1 20 PHE HA H -7.248 2.923 1.265 1.00 . A A . 20 PHE HA 1 1 17 30371 1 1 20 PHE HB2 H -4.882 3.921 1.383 1.00 . A A . 20 PHE HB2 1 1 17 30372 1 1 20 PHE HB3 H -5.343 4.753 2.855 1.00 . A A . 20 PHE HB3 1 1 17 30373 1 1 20 PHE HD1 H -5.247 1.277 1.439 1.00 . A A . 20 PHE HD1 1 1 17 30374 1 1 20 PHE HD2 H -4.835 3.762 4.897 1.00 . A A . 20 PHE HD2 1 1 17 30375 1 1 20 PHE HE1 H -4.528 -0.739 2.811 1.00 . A A . 20 PHE HE1 1 1 17 30376 1 1 20 PHE HE2 H -4.117 1.737 6.258 1.00 . A A . 20 PHE HE2 1 1 17 30377 1 1 20 PHE HZ H -3.971 -0.517 5.092 1.00 . A A . 20 PHE HZ 1 1 17 30378 1 1 20 PHE N N -7.165 4.967 0.963 1.00 . A A . 20 PHE N 1 1 17 30379 1 1 20 PHE O O -8.362 4.990 3.402 1.00 . A A . 20 PHE O 1 1 17 30380 1 1 21 ASN C C -8.225 1.790 5.935 1.00 . A A . 21 ASN C 1 1 17 30381 1 1 21 ASN CA C -8.884 2.713 4.909 1.00 . A A . 21 ASN CA 1 1 17 30382 1 1 21 ASN CB C -10.272 2.152 4.591 1.00 . A A . 21 ASN CB 1 1 17 30383 1 1 21 ASN CG C -11.065 3.118 3.709 1.00 . A A . 21 ASN CG 1 1 17 30384 1 1 21 ASN H H -7.656 1.898 3.436 1.00 . A A . 21 ASN H 1 1 17 30385 1 1 21 ASN HA H -8.955 3.743 5.258 1.00 . A A . 21 ASN HA 1 1 17 30386 1 1 21 ASN HB2 H -10.173 1.191 4.087 1.00 . A A . 21 ASN HB2 1 1 17 30387 1 1 21 ASN HB3 H -10.816 1.971 5.519 1.00 . A A . 21 ASN HB3 1 1 17 30388 1 1 21 ASN HD21 H -11.595 4.133 5.379 1.00 . A A . 21 ASN HD21 1 1 17 30389 1 1 21 ASN HD22 H -12.222 4.769 3.895 1.00 . A A . 21 ASN HD22 1 1 17 30390 1 1 21 ASN N N -8.058 2.771 3.715 1.00 . A A . 21 ASN N 1 1 17 30391 1 1 21 ASN ND2 N -11.678 4.087 4.383 1.00 . A A . 21 ASN ND2 1 1 17 30392 1 1 21 ASN O O -7.588 0.803 5.570 1.00 . A A . 21 ASN O 1 1 17 30393 1 1 21 ASN OD1 O -11.117 2.992 2.497 1.00 . A A . 21 ASN OD1 1 1 17 30394 1 1 22 HIS C C -8.911 0.466 8.894 1.00 . A A . 22 HIS C 1 1 17 30395 1 1 22 HIS CA C -7.830 1.359 8.282 1.00 . A A . 22 HIS CA 1 1 17 30396 1 1 22 HIS CB C -7.156 2.266 9.314 1.00 . A A . 22 HIS CB 1 1 17 30397 1 1 22 HIS CD2 C -4.559 1.977 9.262 1.00 . A A . 22 HIS CD2 1 1 17 30398 1 1 22 HIS CE1 C -4.066 3.790 8.141 1.00 . A A . 22 HIS CE1 1 1 17 30399 1 1 22 HIS CG C -5.727 2.622 8.979 1.00 . A A . 22 HIS CG 1 1 17 30400 1 1 22 HIS H H -8.920 2.947 7.489 1.00 . A A . 22 HIS H 1 1 17 30401 1 1 22 HIS HA H -7.059 0.729 7.839 1.00 . A A . 22 HIS HA 1 1 17 30402 1 1 22 HIS HB2 H -7.736 3.185 9.408 1.00 . A A . 22 HIS HB2 1 1 17 30403 1 1 22 HIS HB3 H -7.179 1.773 10.286 1.00 . A A . 22 HIS HB3 1 1 17 30404 1 1 22 HIS HD1 H -6.023 4.446 7.920 1.00 . A A . 22 HIS HD1 1 1 17 30405 1 1 22 HIS HD2 H -4.465 1.041 9.811 1.00 . A A . 22 HIS HD2 1 1 17 30406 1 1 22 HIS HE1 H -3.490 4.563 7.631 1.00 . A A . 22 HIS HE1 1 1 17 30407 1 1 22 HIS N N -8.401 2.143 7.200 1.00 . A A . 22 HIS N 1 1 17 30408 1 1 22 HIS ND1 N -5.384 3.761 8.272 1.00 . A A . 22 HIS ND1 1 1 17 30409 1 1 22 HIS NE2 N -3.557 2.684 8.754 1.00 . A A . 22 HIS NE2 1 1 17 30410 1 1 22 HIS O O -8.603 -0.530 9.546 1.00 . A A . 22 HIS O 1 1 17 30411 1 1 23 SER C C -11.539 -1.128 8.312 1.00 . A A . 23 SER C 1 1 17 30412 1 1 23 SER CA C -11.285 0.103 9.184 1.00 . A A . 23 SER CA 1 1 17 30413 1 1 23 SER CB C -12.542 0.973 9.253 1.00 . A A . 23 SER CB 1 1 17 30414 1 1 23 SER H H -10.399 1.667 8.131 1.00 . A A . 23 SER H 1 1 17 30415 1 1 23 SER HA H -10.994 -0.194 10.191 1.00 . A A . 23 SER HA 1 1 17 30416 1 1 23 SER HB2 H -12.306 1.911 9.756 1.00 . A A . 23 SER HB2 1 1 17 30417 1 1 23 SER HB3 H -12.864 1.226 8.243 1.00 . A A . 23 SER HB3 1 1 17 30418 1 1 23 SER HG H -14.362 0.144 9.311 1.00 . A A . 23 SER HG 1 1 17 30419 1 1 23 SER N N -10.156 0.856 8.663 1.00 . A A . 23 SER N 1 1 17 30420 1 1 23 SER O O -12.444 -1.914 8.591 1.00 . A A . 23 SER O 1 1 17 30421 1 1 23 SER OG O -13.606 0.320 9.941 1.00 . A A . 23 SER OG 1 1 17 30422 1 1 24 THR C C -9.730 -3.394 6.603 1.00 . A A . 24 THR C 1 1 17 30423 1 1 24 THR CA C -10.851 -2.381 6.361 1.00 . A A . 24 THR CA 1 1 17 30424 1 1 24 THR CB C -10.875 -1.829 4.935 1.00 . A A . 24 THR CB 1 1 17 30425 1 1 24 THR CG2 C -11.003 -2.932 3.882 1.00 . A A . 24 THR CG2 1 1 17 30426 1 1 24 THR H H -9.992 -0.615 7.056 1.00 . A A . 24 THR H 1 1 17 30427 1 1 24 THR HA H -11.792 -2.891 6.570 1.00 . A A . 24 THR HA 1 1 17 30428 1 1 24 THR HB H -10.000 -1.208 4.743 1.00 . A A . 24 THR HB 1 1 17 30429 1 1 24 THR HG1 H -12.876 -1.770 4.927 1.00 . A A . 24 THR HG1 1 1 17 30430 1 1 24 THR HG21 H -11.098 -3.898 4.378 1.00 . A A . 24 THR HG21 1 1 17 30431 1 1 24 THR HG22 H -11.887 -2.750 3.270 1.00 . A A . 24 THR HG22 1 1 17 30432 1 1 24 THR HG23 H -10.116 -2.935 3.248 1.00 . A A . 24 THR HG23 1 1 17 30433 1 1 24 THR N N -10.725 -1.259 7.275 1.00 . A A . 24 THR N 1 1 17 30434 1 1 24 THR O O -9.926 -4.596 6.431 1.00 . A A . 24 THR O 1 1 17 30435 1 1 24 THR OG1 O -12.113 -1.128 4.854 1.00 . A A . 24 THR OG1 1 1 17 30436 1 1 25 HIS C C -7.270 -3.909 8.772 1.00 . A A . 25 HIS C 1 1 17 30437 1 1 25 HIS CA C -7.425 -3.713 7.263 1.00 . A A . 25 HIS CA 1 1 17 30438 1 1 25 HIS CB C -6.168 -3.137 6.608 1.00 . A A . 25 HIS CB 1 1 17 30439 1 1 25 HIS CD2 C -5.786 -3.733 4.092 1.00 . A A . 25 HIS CD2 1 1 17 30440 1 1 25 HIS CE1 C -6.871 -2.054 3.205 1.00 . A A . 25 HIS CE1 1 1 17 30441 1 1 25 HIS CG C -6.277 -2.971 5.111 1.00 . A A . 25 HIS CG 1 1 17 30442 1 1 25 HIS H H -8.427 -1.891 7.135 1.00 . A A . 25 HIS H 1 1 17 30443 1 1 25 HIS HA H -7.629 -4.678 6.799 1.00 . A A . 25 HIS HA 1 1 17 30444 1 1 25 HIS HB2 H -5.949 -2.167 7.055 1.00 . A A . 25 HIS HB2 1 1 17 30445 1 1 25 HIS HB3 H -5.323 -3.788 6.831 1.00 . A A . 25 HIS HB3 1 1 17 30446 1 1 25 HIS HD1 H -7.430 -1.184 5.004 1.00 . A A . 25 HIS HD1 1 1 17 30447 1 1 25 HIS HD2 H -5.197 -4.644 4.204 1.00 . A A . 25 HIS HD2 1 1 17 30448 1 1 25 HIS HE1 H -7.305 -1.383 2.463 1.00 . A A . 25 HIS HE1 1 1 17 30449 1 1 25 HIS N N -8.578 -2.870 6.997 1.00 . A A . 25 HIS N 1 1 17 30450 1 1 25 HIS ND1 N -6.956 -1.920 4.520 1.00 . A A . 25 HIS ND1 1 1 17 30451 1 1 25 HIS NE2 N -6.146 -3.178 2.941 1.00 . A A . 25 HIS NE2 1 1 17 30452 1 1 25 HIS O O -6.152 -3.980 9.281 1.00 . A A . 25 HIS O 1 1 17 30453 1 1 26 LYS C C -7.840 -5.556 11.221 1.00 . A A . 26 LYS C 1 1 17 30454 1 1 26 LYS CA C -8.413 -4.177 10.887 1.00 . A A . 26 LYS CA 1 1 17 30455 1 1 26 LYS CB C -9.814 -3.940 11.453 1.00 . A A . 26 LYS CB 1 1 17 30456 1 1 26 LYS CD C -11.785 -2.368 11.526 1.00 . A A . 26 LYS CD 1 1 17 30457 1 1 26 LYS CE C -12.624 -3.627 11.298 1.00 . A A . 26 LYS CE 1 1 17 30458 1 1 26 LYS CG C -10.350 -2.569 11.035 1.00 . A A . 26 LYS CG 1 1 17 30459 1 1 26 LYS H H -9.313 -3.933 9.025 1.00 . A A . 26 LYS H 1 1 17 30460 1 1 26 LYS HA H -7.759 -3.418 11.317 1.00 . A A . 26 LYS HA 1 1 17 30461 1 1 26 LYS HB2 H -10.489 -4.720 11.103 1.00 . A A . 26 LYS HB2 1 1 17 30462 1 1 26 LYS HB3 H -9.787 -4.007 12.541 1.00 . A A . 26 LYS HB3 1 1 17 30463 1 1 26 LYS HD2 H -11.778 -2.118 12.586 1.00 . A A . 26 LYS HD2 1 1 17 30464 1 1 26 LYS HD3 H -12.237 -1.526 11.002 1.00 . A A . 26 LYS HD3 1 1 17 30465 1 1 26 LYS HE2 H -12.425 -4.029 10.305 1.00 . A A . 26 LYS HE2 1 1 17 30466 1 1 26 LYS HE3 H -12.339 -4.396 12.016 1.00 . A A . 26 LYS HE3 1 1 17 30467 1 1 26 LYS HG2 H -9.710 -1.785 11.440 1.00 . A A . 26 LYS HG2 1 1 17 30468 1 1 26 LYS HG3 H -10.317 -2.478 9.949 1.00 . A A . 26 LYS HG3 1 1 17 30469 1 1 26 LYS HZ1 H -14.265 -2.807 12.287 1.00 . A A . 26 LYS HZ1 1 1 17 30470 1 1 26 LYS HZ2 H -14.410 -2.759 10.665 1.00 . A A . 26 LYS HZ2 1 1 17 30471 1 1 26 LYS N N -8.408 -3.991 9.446 1.00 . A A . 26 LYS N 1 1 17 30472 1 1 26 LYS NZ N -14.065 -3.321 11.436 1.00 . A A . 26 LYS NZ 1 1 17 30473 1 1 26 LYS O O -7.038 -5.692 12.143 1.00 . A A . 26 LYS O 1 1 17 30474 1 1 27 SER C C -6.335 -8.021 10.286 1.00 . A A . 27 SER C 1 1 17 30475 1 1 27 SER CA C -7.815 -7.907 10.655 1.00 . A A . 27 SER CA 1 1 17 30476 1 1 27 SER CB C -8.645 -8.896 9.833 1.00 . A A . 27 SER CB 1 1 17 30477 1 1 27 SER H H -8.927 -6.424 9.704 1.00 . A A . 27 SER H 1 1 17 30478 1 1 27 SER HA H -7.962 -8.106 11.717 1.00 . A A . 27 SER HA 1 1 17 30479 1 1 27 SER HB2 H -8.367 -9.915 10.103 1.00 . A A . 27 SER HB2 1 1 17 30480 1 1 27 SER HB3 H -9.700 -8.778 10.081 1.00 . A A . 27 SER HB3 1 1 17 30481 1 1 27 SER HG H -8.037 -9.521 8.032 1.00 . A A . 27 SER HG 1 1 17 30482 1 1 27 SER N N -8.275 -6.544 10.452 1.00 . A A . 27 SER N 1 1 17 30483 1 1 27 SER O O -5.676 -8.997 10.644 1.00 . A A . 27 SER O 1 1 17 30484 1 1 27 SER OG O -8.463 -8.710 8.432 1.00 . A A . 27 SER OG 1 1 17 30485 1 1 28 VAL C C -3.607 -6.400 10.277 1.00 . A A . 28 VAL C 1 1 17 30486 1 1 28 VAL CA C -4.465 -6.986 9.154 1.00 . A A . 28 VAL CA 1 1 17 30487 1 1 28 VAL CB C -4.332 -6.219 7.837 1.00 . A A . 28 VAL CB 1 1 17 30488 1 1 28 VAL CG1 C -2.906 -6.315 7.289 1.00 . A A . 28 VAL CG1 1 1 17 30489 1 1 28 VAL CG2 C -5.349 -6.716 6.808 1.00 . A A . 28 VAL CG2 1 1 17 30490 1 1 28 VAL H H -6.398 -6.222 9.289 1.00 . A A . 28 VAL H 1 1 17 30491 1 1 28 VAL HA H -4.156 -8.017 8.978 1.00 . A A . 28 VAL HA 1 1 17 30492 1 1 28 VAL HB H -4.544 -5.169 8.037 1.00 . A A . 28 VAL HB 1 1 17 30493 1 1 28 VAL HG11 H -2.237 -6.662 8.076 1.00 . A A . 28 VAL HG11 1 1 17 30494 1 1 28 VAL HG12 H -2.884 -7.018 6.456 1.00 . A A . 28 VAL HG12 1 1 17 30495 1 1 28 VAL HG13 H -2.583 -5.333 6.944 1.00 . A A . 28 VAL HG13 1 1 17 30496 1 1 28 VAL HG21 H -5.500 -7.788 6.934 1.00 . A A . 28 VAL HG21 1 1 17 30497 1 1 28 VAL HG22 H -6.296 -6.196 6.953 1.00 . A A . 28 VAL HG22 1 1 17 30498 1 1 28 VAL HG23 H -4.977 -6.517 5.803 1.00 . A A . 28 VAL HG23 1 1 17 30499 1 1 28 VAL N N -5.856 -7.011 9.576 1.00 . A A . 28 VAL N 1 1 17 30500 1 1 28 VAL O O -4.019 -5.457 10.951 1.00 . A A . 28 VAL O 1 1 17 30501 1 1 29 LYS C C -0.877 -5.205 11.040 1.00 . A A . 29 LYS C 1 1 17 30502 1 1 29 LYS CA C -1.509 -6.530 11.472 1.00 . A A . 29 LYS CA 1 1 17 30503 1 1 29 LYS CB C -0.487 -7.621 11.795 1.00 . A A . 29 LYS CB 1 1 17 30504 1 1 29 LYS CD C -1.432 -9.336 13.384 1.00 . A A . 29 LYS CD 1 1 17 30505 1 1 29 LYS CE C -0.654 -10.430 14.119 1.00 . A A . 29 LYS CE 1 1 17 30506 1 1 29 LYS CG C -0.597 -8.061 13.257 1.00 . A A . 29 LYS CG 1 1 17 30507 1 1 29 LYS H H -2.101 -7.748 9.890 1.00 . A A . 29 LYS H 1 1 17 30508 1 1 29 LYS HA H -2.091 -6.356 12.377 1.00 . A A . 29 LYS HA 1 1 17 30509 1 1 29 LYS HB2 H -0.645 -8.479 11.141 1.00 . A A . 29 LYS HB2 1 1 17 30510 1 1 29 LYS HB3 H 0.520 -7.252 11.598 1.00 . A A . 29 LYS HB3 1 1 17 30511 1 1 29 LYS HD2 H -2.355 -9.118 13.921 1.00 . A A . 29 LYS HD2 1 1 17 30512 1 1 29 LYS HD3 H -1.716 -9.690 12.393 1.00 . A A . 29 LYS HD3 1 1 17 30513 1 1 29 LYS HE2 H -0.038 -9.984 14.900 1.00 . A A . 29 LYS HE2 1 1 17 30514 1 1 29 LYS HE3 H -1.349 -11.110 14.612 1.00 . A A . 29 LYS HE3 1 1 17 30515 1 1 29 LYS HG2 H 0.400 -8.232 13.665 1.00 . A A . 29 LYS HG2 1 1 17 30516 1 1 29 LYS HG3 H -1.050 -7.264 13.847 1.00 . A A . 29 LYS HG3 1 1 17 30517 1 1 29 LYS HZ1 H 0.639 -10.575 12.491 1.00 . A A . 29 LYS HZ1 1 1 17 30518 1 1 29 LYS HZ2 H 0.946 -11.679 13.648 1.00 . A A . 29 LYS HZ2 1 1 17 30519 1 1 29 LYS N N -2.428 -6.982 10.443 1.00 . A A . 29 LYS N 1 1 17 30520 1 1 29 LYS NZ N 0.199 -11.183 13.174 1.00 . A A . 29 LYS NZ 1 1 17 30521 1 1 29 LYS O O -0.507 -5.040 9.879 1.00 . A A . 29 LYS O 1 1 17 30522 1 1 30 CYS C C 1.239 -3.192 11.236 1.00 . A A . 30 CYS C 1 1 17 30523 1 1 30 CYS CA C -0.195 -2.989 11.729 1.00 . A A . 30 CYS CA 1 1 17 30524 1 1 30 CYS CB C -0.253 -2.081 12.960 1.00 . A A . 30 CYS CB 1 1 17 30525 1 1 30 CYS H H -1.079 -4.437 12.939 1.00 . A A . 30 CYS H 1 1 17 30526 1 1 30 CYS HA H -0.809 -2.527 10.956 1.00 . A A . 30 CYS HA 1 1 17 30527 1 1 30 CYS HB2 H 0.582 -2.328 13.615 1.00 . A A . 30 CYS HB2 1 1 17 30528 1 1 30 CYS HB3 H -0.112 -1.049 12.639 1.00 . A A . 30 CYS HB3 1 1 17 30529 1 1 30 CYS N N -0.775 -4.294 11.997 1.00 . A A . 30 CYS N 1 1 17 30530 1 1 30 CYS O O 1.722 -2.438 10.393 1.00 . A A . 30 CYS O 1 1 17 30531 1 1 30 CYS SG S -1.806 -2.191 13.922 1.00 . A A . 30 CYS SG 1 1 17 30532 1 1 31 GLY C C 3.303 -5.198 10.037 1.00 . A A . 31 GLY C 1 1 17 30533 1 1 31 GLY CA C 3.249 -4.526 11.411 1.00 . A A . 31 GLY CA 1 1 17 30534 1 1 31 GLY H H 1.479 -4.823 12.469 1.00 . A A . 31 GLY H 1 1 17 30535 1 1 31 GLY HA2 H 3.842 -3.612 11.396 1.00 . A A . 31 GLY HA2 1 1 17 30536 1 1 31 GLY HA3 H 3.693 -5.183 12.158 1.00 . A A . 31 GLY HA3 1 1 17 30537 1 1 31 GLY N N 1.879 -4.215 11.784 1.00 . A A . 31 GLY N 1 1 17 30538 1 1 31 GLY O O 4.384 -5.497 9.531 1.00 . A A . 31 GLY O 1 1 17 30539 1 1 32 ASP C C 2.248 -4.994 7.079 1.00 . A A . 32 ASP C 1 1 17 30540 1 1 32 ASP CA C 2.025 -6.045 8.167 1.00 . A A . 32 ASP CA 1 1 17 30541 1 1 32 ASP CB C 0.638 -6.657 7.956 1.00 . A A . 32 ASP CB 1 1 17 30542 1 1 32 ASP CG C 0.507 -7.551 6.721 1.00 . A A . 32 ASP CG 1 1 17 30543 1 1 32 ASP H H 1.250 -5.168 9.890 1.00 . A A . 32 ASP H 1 1 17 30544 1 1 32 ASP HA H 2.792 -6.819 8.164 1.00 . A A . 32 ASP HA 1 1 17 30545 1 1 32 ASP HB2 H 0.377 -7.241 8.838 1.00 . A A . 32 ASP HB2 1 1 17 30546 1 1 32 ASP HB3 H -0.091 -5.850 7.881 1.00 . A A . 32 ASP HB3 1 1 17 30547 1 1 32 ASP N N 2.125 -5.414 9.472 1.00 . A A . 32 ASP N 1 1 17 30548 1 1 32 ASP O O 2.774 -5.303 6.011 1.00 . A A . 32 ASP O 1 1 17 30549 1 1 32 ASP OD1 O 0.953 -7.100 5.644 1.00 . A A . 32 ASP OD1 1 1 17 30550 1 1 32 ASP OD2 O -0.036 -8.665 6.882 1.00 . A A . 32 ASP OD2 1 1 17 30551 1 1 33 CYS C C 3.117 -1.769 6.942 1.00 . A A . 33 CYS C 1 1 17 30552 1 1 33 CYS CA C 1.986 -2.673 6.448 1.00 . A A . 33 CYS CA 1 1 17 30553 1 1 33 CYS CB C 0.676 -1.903 6.268 1.00 . A A . 33 CYS CB 1 1 17 30554 1 1 33 CYS H H 1.410 -3.529 8.258 1.00 . A A . 33 CYS H 1 1 17 30555 1 1 33 CYS HA H 2.237 -3.117 5.485 1.00 . A A . 33 CYS HA 1 1 17 30556 1 1 33 CYS HB2 H 0.086 -1.953 7.183 1.00 . A A . 33 CYS HB2 1 1 17 30557 1 1 33 CYS HB3 H 0.887 -0.850 6.081 1.00 . A A . 33 CYS HB3 1 1 17 30558 1 1 33 CYS N N 1.837 -3.772 7.387 1.00 . A A . 33 CYS N 1 1 17 30559 1 1 33 CYS O O 4.073 -1.511 6.213 1.00 . A A . 33 CYS O 1 1 17 30560 1 1 33 CYS SG S -0.276 -2.605 4.872 1.00 . A A . 33 CYS SG 1 1 17 30561 1 1 34 HIS C C 5.190 -1.267 9.184 1.00 . A A . 34 HIS C 1 1 17 30562 1 1 34 HIS CA C 3.967 -0.442 8.777 1.00 . A A . 34 HIS CA 1 1 17 30563 1 1 34 HIS CB C 3.369 0.346 9.943 1.00 . A A . 34 HIS CB 1 1 17 30564 1 1 34 HIS CD2 C 0.858 1.015 9.654 1.00 . A A . 34 HIS CD2 1 1 17 30565 1 1 34 HIS CE1 C 1.163 2.995 8.774 1.00 . A A . 34 HIS CE1 1 1 17 30566 1 1 34 HIS CG C 2.203 1.225 9.557 1.00 . A A . 34 HIS CG 1 1 17 30567 1 1 34 HIS H H 2.189 -1.528 8.764 1.00 . A A . 34 HIS H 1 1 17 30568 1 1 34 HIS HA H 4.261 0.273 8.008 1.00 . A A . 34 HIS HA 1 1 17 30569 1 1 34 HIS HB2 H 3.043 -0.354 10.713 1.00 . A A . 34 HIS HB2 1 1 17 30570 1 1 34 HIS HB3 H 4.147 0.968 10.386 1.00 . A A . 34 HIS HB3 1 1 17 30571 1 1 34 HIS HD1 H 3.236 2.925 8.798 1.00 . A A . 34 HIS HD1 1 1 17 30572 1 1 34 HIS HD2 H 0.380 0.120 10.052 1.00 . A A . 34 HIS HD2 1 1 17 30573 1 1 34 HIS HE1 H 0.955 3.973 8.340 1.00 . A A . 34 HIS HE1 1 1 17 30574 1 1 34 HIS N N 2.970 -1.313 8.177 1.00 . A A . 34 HIS N 1 1 17 30575 1 1 34 HIS ND1 N 2.363 2.481 8.998 1.00 . A A . 34 HIS ND1 1 1 17 30576 1 1 34 HIS NE2 N 0.231 2.085 9.181 1.00 . A A . 34 HIS NE2 1 1 17 30577 1 1 34 HIS O O 5.572 -1.281 10.353 1.00 . A A . 34 HIS O 1 1 17 30578 1 1 35 HIS C C 7.904 -2.023 9.370 1.00 . A A . 35 HIS C 1 1 17 30579 1 1 35 HIS CA C 6.940 -2.759 8.437 1.00 . A A . 35 HIS CA 1 1 17 30580 1 1 35 HIS CB C 7.593 -3.174 7.117 1.00 . A A . 35 HIS CB 1 1 17 30581 1 1 35 HIS CD2 C 7.777 -1.415 5.193 1.00 . A A . 35 HIS CD2 1 1 17 30582 1 1 35 HIS CE1 C 9.615 -0.425 5.850 1.00 . A A . 35 HIS CE1 1 1 17 30583 1 1 35 HIS CG C 8.191 -2.026 6.340 1.00 . A A . 35 HIS CG 1 1 17 30584 1 1 35 HIS H H 5.451 -1.917 7.248 1.00 . A A . 35 HIS H 1 1 17 30585 1 1 35 HIS HA H 6.589 -3.664 8.933 1.00 . A A . 35 HIS HA 1 1 17 30586 1 1 35 HIS HB2 H 8.375 -3.905 7.324 1.00 . A A . 35 HIS HB2 1 1 17 30587 1 1 35 HIS HB3 H 6.848 -3.671 6.496 1.00 . A A . 35 HIS HB3 1 1 17 30588 1 1 35 HIS HD1 H 9.898 -1.597 7.538 1.00 . A A . 35 HIS HD1 1 1 17 30589 1 1 35 HIS HD2 H 6.890 -1.677 4.616 1.00 . A A . 35 HIS HD2 1 1 17 30590 1 1 35 HIS HE1 H 10.463 0.259 5.880 1.00 . A A . 35 HIS HE1 1 1 17 30591 1 1 35 HIS N N 5.769 -1.934 8.196 1.00 . A A . 35 HIS N 1 1 17 30592 1 1 35 HIS ND1 N 9.351 -1.380 6.730 1.00 . A A . 35 HIS ND1 1 1 17 30593 1 1 35 HIS NE2 N 8.638 -0.448 4.898 1.00 . A A . 35 HIS NE2 1 1 17 30594 1 1 35 HIS O O 7.967 -0.795 9.359 1.00 . A A . 35 HIS O 1 1 17 30595 1 1 36 PRO C C 10.860 -1.770 10.386 1.00 . A A . 36 PRO C 1 1 17 30596 1 1 36 PRO CA C 9.608 -2.263 11.112 1.00 . A A . 36 PRO CA 1 1 17 30597 1 1 36 PRO CB C 9.896 -3.382 12.100 1.00 . A A . 36 PRO CB 1 1 17 30598 1 1 36 PRO CD C 8.602 -4.284 10.215 1.00 . A A . 36 PRO CD 1 1 17 30599 1 1 36 PRO CG C 9.452 -4.666 11.417 1.00 . A A . 36 PRO CG 1 1 17 30600 1 1 36 PRO HA H 9.220 -1.460 11.565 1.00 . A A . 36 PRO HA 1 1 17 30601 1 1 36 PRO HB2 H 10.956 -3.420 12.350 1.00 . A A . 36 PRO HB2 1 1 17 30602 1 1 36 PRO HB3 H 9.353 -3.229 13.033 1.00 . A A . 36 PRO HB3 1 1 17 30603 1 1 36 PRO HD2 H 8.996 -4.719 9.297 1.00 . A A . 36 PRO HD2 1 1 17 30604 1 1 36 PRO HD3 H 7.578 -4.644 10.325 1.00 . A A . 36 PRO HD3 1 1 17 30605 1 1 36 PRO HG2 H 10.317 -5.250 11.102 1.00 . A A . 36 PRO HG2 1 1 17 30606 1 1 36 PRO HG3 H 8.881 -5.288 12.106 1.00 . A A . 36 PRO HG3 1 1 17 30607 1 1 36 PRO N N 8.650 -2.826 10.175 1.00 . A A . 36 PRO N 1 1 17 30608 1 1 36 PRO O O 11.401 -2.468 9.530 1.00 . A A . 36 PRO O 1 1 17 30609 1 1 37 VAL C C 13.454 0.418 11.247 1.00 . A A . 37 VAL C 1 1 17 30610 1 1 37 VAL CA C 12.464 0.025 10.148 1.00 . A A . 37 VAL CA 1 1 17 30611 1 1 37 VAL CB C 12.057 1.203 9.261 1.00 . A A . 37 VAL CB 1 1 17 30612 1 1 37 VAL CG1 C 13.289 1.905 8.684 1.00 . A A . 37 VAL CG1 1 1 17 30613 1 1 37 VAL CG2 C 11.112 0.750 8.146 1.00 . A A . 37 VAL CG2 1 1 17 30614 1 1 37 VAL H H 10.839 -0.009 11.452 1.00 . A A . 37 VAL H 1 1 17 30615 1 1 37 VAL HA H 12.926 -0.732 9.514 1.00 . A A . 37 VAL HA 1 1 17 30616 1 1 37 VAL HB H 11.523 1.922 9.882 1.00 . A A . 37 VAL HB 1 1 17 30617 1 1 37 VAL HG11 H 14.179 1.314 8.900 1.00 . A A . 37 VAL HG11 1 1 17 30618 1 1 37 VAL HG12 H 13.175 2.009 7.605 1.00 . A A . 37 VAL HG12 1 1 17 30619 1 1 37 VAL HG13 H 13.389 2.892 9.135 1.00 . A A . 37 VAL HG13 1 1 17 30620 1 1 37 VAL HG21 H 11.425 -0.229 7.781 1.00 . A A . 37 VAL HG21 1 1 17 30621 1 1 37 VAL HG22 H 10.096 0.685 8.535 1.00 . A A . 37 VAL HG22 1 1 17 30622 1 1 37 VAL HG23 H 11.143 1.469 7.328 1.00 . A A . 37 VAL HG23 1 1 17 30623 1 1 37 VAL N N 11.285 -0.570 10.754 1.00 . A A . 37 VAL N 1 1 17 30624 1 1 37 VAL O O 13.146 1.255 12.094 1.00 . A A . 37 VAL O 1 1 17 30625 1 1 38 ASN C C 15.357 -0.705 13.462 1.00 . A A . 38 ASN C 1 1 17 30626 1 1 38 ASN CA C 15.659 0.069 12.177 1.00 . A A . 38 ASN CA 1 1 17 30627 1 1 38 ASN CB C 15.710 1.558 12.524 1.00 . A A . 38 ASN CB 1 1 17 30628 1 1 38 ASN CG C 17.141 1.999 12.838 1.00 . A A . 38 ASN CG 1 1 17 30629 1 1 38 ASN H H 14.864 -0.884 10.504 1.00 . A A . 38 ASN H 1 1 17 30630 1 1 38 ASN HA H 16.589 -0.250 11.707 1.00 . A A . 38 ASN HA 1 1 17 30631 1 1 38 ASN HB2 H 15.320 2.143 11.690 1.00 . A A . 38 ASN HB2 1 1 17 30632 1 1 38 ASN HB3 H 15.067 1.758 13.381 1.00 . A A . 38 ASN HB3 1 1 17 30633 1 1 38 ASN HD21 H 16.932 1.196 14.685 1.00 . A A . 38 ASN HD21 1 1 17 30634 1 1 38 ASN HD22 H 18.469 1.927 14.365 1.00 . A A . 38 ASN HD22 1 1 17 30635 1 1 38 ASN N N 14.622 -0.205 11.197 1.00 . A A . 38 ASN N 1 1 17 30636 1 1 38 ASN ND2 N 17.548 1.681 14.064 1.00 . A A . 38 ASN ND2 1 1 17 30637 1 1 38 ASN O O 16.090 -0.597 14.443 1.00 . A A . 38 ASN O 1 1 17 30638 1 1 38 ASN OD1 O 17.830 2.589 12.022 1.00 . A A . 38 ASN OD1 1 1 17 30639 1 1 39 GLY C C 12.766 -1.551 15.354 1.00 . A A . 39 GLY C 1 1 17 30640 1 1 39 GLY CA C 13.866 -2.260 14.563 1.00 . A A . 39 GLY CA 1 1 17 30641 1 1 39 GLY H H 13.684 -1.551 12.612 1.00 . A A . 39 GLY H 1 1 17 30642 1 1 39 GLY HA2 H 13.509 -3.234 14.229 1.00 . A A . 39 GLY HA2 1 1 17 30643 1 1 39 GLY HA3 H 14.726 -2.441 15.209 1.00 . A A . 39 GLY HA3 1 1 17 30644 1 1 39 GLY N N 14.275 -1.469 13.415 1.00 . A A . 39 GLY N 1 1 17 30645 1 1 39 GLY O O 12.274 -2.079 16.350 1.00 . A A . 39 GLY O 1 1 17 30646 1 1 40 LYS C C 10.079 0.310 14.734 1.00 . A A . 40 LYS C 1 1 17 30647 1 1 40 LYS CA C 11.379 0.422 15.533 1.00 . A A . 40 LYS CA 1 1 17 30648 1 1 40 LYS CB C 11.852 1.863 15.737 1.00 . A A . 40 LYS CB 1 1 17 30649 1 1 40 LYS CD C 11.801 4.075 14.528 1.00 . A A . 40 LYS CD 1 1 17 30650 1 1 40 LYS CE C 12.985 4.876 13.982 1.00 . A A . 40 LYS CE 1 1 17 30651 1 1 40 LYS CG C 12.049 2.571 14.396 1.00 . A A . 40 LYS CG 1 1 17 30652 1 1 40 LYS H H 12.817 0.057 14.070 1.00 . A A . 40 LYS H 1 1 17 30653 1 1 40 LYS HA H 11.215 -0.007 16.521 1.00 . A A . 40 LYS HA 1 1 17 30654 1 1 40 LYS HB2 H 11.123 2.408 16.337 1.00 . A A . 40 LYS HB2 1 1 17 30655 1 1 40 LYS HB3 H 12.789 1.866 16.295 1.00 . A A . 40 LYS HB3 1 1 17 30656 1 1 40 LYS HD2 H 10.894 4.346 13.989 1.00 . A A . 40 LYS HD2 1 1 17 30657 1 1 40 LYS HD3 H 11.638 4.330 15.575 1.00 . A A . 40 LYS HD3 1 1 17 30658 1 1 40 LYS HE2 H 13.409 4.366 13.117 1.00 . A A . 40 LYS HE2 1 1 17 30659 1 1 40 LYS HE3 H 12.643 5.853 13.639 1.00 . A A . 40 LYS HE3 1 1 17 30660 1 1 40 LYS HG2 H 13.063 2.397 14.034 1.00 . A A . 40 LYS HG2 1 1 17 30661 1 1 40 LYS HG3 H 11.370 2.151 13.655 1.00 . A A . 40 LYS HG3 1 1 17 30662 1 1 40 LYS HZ1 H 14.691 4.284 15.020 1.00 . A A . 40 LYS HZ1 1 1 17 30663 1 1 40 LYS HZ2 H 14.550 5.902 14.899 1.00 . A A . 40 LYS HZ2 1 1 17 30664 1 1 40 LYS N N 12.412 -0.365 14.881 1.00 . A A . 40 LYS N 1 1 17 30665 1 1 40 LYS NZ N 14.022 5.045 15.024 1.00 . A A . 40 LYS NZ 1 1 17 30666 1 1 40 LYS O O 10.105 0.071 13.528 1.00 . A A . 40 LYS O 1 1 17 30667 1 1 41 GLU C C 6.820 1.630 15.186 1.00 . A A . 41 GLU C 1 1 17 30668 1 1 41 GLU CA C 7.663 0.410 14.811 1.00 . A A . 41 GLU CA 1 1 17 30669 1 1 41 GLU CB C 6.949 -0.888 15.193 1.00 . A A . 41 GLU CB 1 1 17 30670 1 1 41 GLU CD C 5.560 -2.666 14.066 1.00 . A A . 41 GLU CD 1 1 17 30671 1 1 41 GLU CG C 6.837 -1.827 13.990 1.00 . A A . 41 GLU CG 1 1 17 30672 1 1 41 GLU H H 8.958 0.683 16.420 1.00 . A A . 41 GLU H 1 1 17 30673 1 1 41 GLU HA H 7.856 0.409 13.739 1.00 . A A . 41 GLU HA 1 1 17 30674 1 1 41 GLU HB2 H 7.494 -1.385 15.996 1.00 . A A . 41 GLU HB2 1 1 17 30675 1 1 41 GLU HB3 H 5.954 -0.661 15.575 1.00 . A A . 41 GLU HB3 1 1 17 30676 1 1 41 GLU HG2 H 6.839 -1.244 13.068 1.00 . A A . 41 GLU HG2 1 1 17 30677 1 1 41 GLU HG3 H 7.706 -2.483 13.954 1.00 . A A . 41 GLU HG3 1 1 17 30678 1 1 41 GLU N N 8.971 0.488 15.439 1.00 . A A . 41 GLU N 1 1 17 30679 1 1 41 GLU O O 6.444 1.797 16.346 1.00 . A A . 41 GLU O 1 1 17 30680 1 1 41 GLU OE1 O 5.631 -3.753 14.678 1.00 . A A . 41 GLU OE1 1 1 17 30681 1 1 41 GLU OE2 O 4.542 -2.201 13.509 1.00 . A A . 41 GLU OE2 1 1 17 30682 1 1 42 ASP C C 4.799 3.840 13.216 1.00 . A A . 42 ASP C 1 1 17 30683 1 1 42 ASP CA C 5.756 3.653 14.394 1.00 . A A . 42 ASP CA 1 1 17 30684 1 1 42 ASP CB C 6.649 4.893 14.479 1.00 . A A . 42 ASP CB 1 1 17 30685 1 1 42 ASP CG C 7.789 4.800 15.495 1.00 . A A . 42 ASP CG 1 1 17 30686 1 1 42 ASP H H 6.857 2.309 13.244 1.00 . A A . 42 ASP H 1 1 17 30687 1 1 42 ASP HA H 5.232 3.489 15.336 1.00 . A A . 42 ASP HA 1 1 17 30688 1 1 42 ASP HB2 H 7.074 5.084 13.495 1.00 . A A . 42 ASP HB2 1 1 17 30689 1 1 42 ASP HB3 H 6.027 5.752 14.731 1.00 . A A . 42 ASP HB3 1 1 17 30690 1 1 42 ASP N N 6.548 2.452 14.184 1.00 . A A . 42 ASP N 1 1 17 30691 1 1 42 ASP O O 5.102 3.434 12.094 1.00 . A A . 42 ASP O 1 1 17 30692 1 1 42 ASP OD1 O 8.776 4.102 15.178 1.00 . A A . 42 ASP OD1 1 1 17 30693 1 1 42 ASP OD2 O 7.648 5.429 16.566 1.00 . A A . 42 ASP OD2 1 1 17 30694 1 1 43 TYR C C 2.984 5.964 11.692 1.00 . A A . 43 TYR C 1 1 17 30695 1 1 43 TYR CA C 2.658 4.699 12.489 1.00 . A A . 43 TYR CA 1 1 17 30696 1 1 43 TYR CB C 1.339 4.906 13.236 1.00 . A A . 43 TYR CB 1 1 17 30697 1 1 43 TYR CD1 C 1.481 2.479 13.901 1.00 . A A . 43 TYR CD1 1 1 17 30698 1 1 43 TYR CD2 C 0.016 3.908 15.136 1.00 . A A . 43 TYR CD2 1 1 17 30699 1 1 43 TYR CE1 C 1.099 1.367 14.733 1.00 . A A . 43 TYR CE1 1 1 17 30700 1 1 43 TYR CE2 C -0.367 2.797 15.968 1.00 . A A . 43 TYR CE2 1 1 17 30701 1 1 43 TYR CG C 0.932 3.726 14.120 1.00 . A A . 43 TYR CG 1 1 17 30702 1 1 43 TYR CZ C 0.193 1.581 15.726 1.00 . A A . 43 TYR CZ 1 1 17 30703 1 1 43 TYR H H 3.424 4.781 14.424 1.00 . A A . 43 TYR H 1 1 17 30704 1 1 43 TYR HA H 2.650 3.845 11.812 1.00 . A A . 43 TYR HA 1 1 17 30705 1 1 43 TYR HB2 H 1.421 5.800 13.855 1.00 . A A . 43 TYR HB2 1 1 17 30706 1 1 43 TYR HB3 H 0.548 5.093 12.510 1.00 . A A . 43 TYR HB3 1 1 17 30707 1 1 43 TYR HD1 H 2.205 2.335 13.099 1.00 . A A . 43 TYR HD1 1 1 17 30708 1 1 43 TYR HD2 H -0.417 4.893 15.308 1.00 . A A . 43 TYR HD2 1 1 17 30709 1 1 43 TYR HE1 H 1.525 0.377 14.571 1.00 . A A . 43 TYR HE1 1 1 17 30710 1 1 43 TYR HE2 H -1.089 2.927 16.774 1.00 . A A . 43 TYR HE2 1 1 17 30711 1 1 43 TYR HH H -0.772 -0.083 16.004 1.00 . A A . 43 TYR HH 1 1 17 30712 1 1 43 TYR N N 3.662 4.454 13.510 1.00 . A A . 43 TYR N 1 1 17 30713 1 1 43 TYR O O 2.661 7.072 12.120 1.00 . A A . 43 TYR O 1 1 17 30714 1 1 43 TYR OH O -0.168 0.532 16.511 1.00 . A A . 43 TYR OH 1 1 17 30715 1 1 44 ARG C C 3.456 6.646 8.272 1.00 . A A . 44 ARG C 1 1 17 30716 1 1 44 ARG CA C 3.992 6.868 9.688 1.00 . A A . 44 ARG CA 1 1 17 30717 1 1 44 ARG CB C 5.512 7.033 9.630 1.00 . A A . 44 ARG CB 1 1 17 30718 1 1 44 ARG CD C 7.457 8.449 10.387 1.00 . A A . 44 ARG CD 1 1 17 30719 1 1 44 ARG CG C 5.939 8.384 10.209 1.00 . A A . 44 ARG CG 1 1 17 30720 1 1 44 ARG CZ C 8.956 8.310 12.383 1.00 . A A . 44 ARG CZ 1 1 17 30721 1 1 44 ARG H H 3.877 4.854 10.207 1.00 . A A . 44 ARG H 1 1 17 30722 1 1 44 ARG HA H 3.533 7.743 10.148 1.00 . A A . 44 ARG HA 1 1 17 30723 1 1 44 ARG HB2 H 5.990 6.227 10.187 1.00 . A A . 44 ARG HB2 1 1 17 30724 1 1 44 ARG HB3 H 5.851 6.952 8.598 1.00 . A A . 44 ARG HB3 1 1 17 30725 1 1 44 ARG HD2 H 7.947 7.852 9.618 1.00 . A A . 44 ARG HD2 1 1 17 30726 1 1 44 ARG HD3 H 7.802 9.475 10.262 1.00 . A A . 44 ARG HD3 1 1 17 30727 1 1 44 ARG HE H 7.213 7.305 12.179 1.00 . A A . 44 ARG HE 1 1 17 30728 1 1 44 ARG HG2 H 5.611 9.186 9.548 1.00 . A A . 44 ARG HG2 1 1 17 30729 1 1 44 ARG HG3 H 5.449 8.543 11.170 1.00 . A A . 44 ARG HG3 1 1 17 30730 1 1 44 ARG HH11 H 9.642 9.556 10.918 1.00 . A A . 44 ARG HH11 1 1 17 30731 1 1 44 ARG HH12 H 10.657 9.438 12.316 1.00 . A A . 44 ARG HH12 1 1 17 30732 1 1 44 ARG HH21 H 9.998 8.016 14.129 1.00 . A A . 44 ARG HH21 1 1 17 30733 1 1 44 ARG N N 3.619 5.758 10.548 1.00 . A A . 44 ARG N 1 1 17 30734 1 1 44 ARG NE N 7.831 7.950 11.729 1.00 . A A . 44 ARG NE 1 1 17 30735 1 1 44 ARG NH1 N 9.827 9.176 11.824 1.00 . A A . 44 ARG NH1 1 1 17 30736 1 1 44 ARG NH2 N 9.191 7.802 13.579 1.00 . A A . 44 ARG NH2 1 1 17 30737 1 1 44 ARG O O 2.899 5.590 7.974 1.00 . A A . 44 ARG O 1 1 17 30738 1 1 45 LYS C C 4.271 6.942 5.199 1.00 . A A . 45 LYS C 1 1 17 30739 1 1 45 LYS CA C 3.184 7.587 6.061 1.00 . A A . 45 LYS CA 1 1 17 30740 1 1 45 LYS CB C 2.749 8.969 5.569 1.00 . A A . 45 LYS CB 1 1 17 30741 1 1 45 LYS CD C 1.647 10.212 7.467 1.00 . A A . 45 LYS CD 1 1 17 30742 1 1 45 LYS CE C 1.573 11.709 7.161 1.00 . A A . 45 LYS CE 1 1 17 30743 1 1 45 LYS CG C 1.418 9.382 6.202 1.00 . A A . 45 LYS CG 1 1 17 30744 1 1 45 LYS H H 4.096 8.513 7.689 1.00 . A A . 45 LYS H 1 1 17 30745 1 1 45 LYS HA H 2.303 6.946 6.043 1.00 . A A . 45 LYS HA 1 1 17 30746 1 1 45 LYS HB2 H 3.515 9.705 5.813 1.00 . A A . 45 LYS HB2 1 1 17 30747 1 1 45 LYS HB3 H 2.652 8.959 4.484 1.00 . A A . 45 LYS HB3 1 1 17 30748 1 1 45 LYS HD2 H 0.899 9.953 8.216 1.00 . A A . 45 LYS HD2 1 1 17 30749 1 1 45 LYS HD3 H 2.621 9.971 7.893 1.00 . A A . 45 LYS HD3 1 1 17 30750 1 1 45 LYS HE2 H 2.076 12.272 7.948 1.00 . A A . 45 LYS HE2 1 1 17 30751 1 1 45 LYS HE3 H 2.100 11.922 6.231 1.00 . A A . 45 LYS HE3 1 1 17 30752 1 1 45 LYS HG2 H 0.834 9.959 5.485 1.00 . A A . 45 LYS HG2 1 1 17 30753 1 1 45 LYS HG3 H 0.836 8.493 6.446 1.00 . A A . 45 LYS HG3 1 1 17 30754 1 1 45 LYS HZ1 H -0.279 11.795 6.210 1.00 . A A . 45 LYS HZ1 1 1 17 30755 1 1 45 LYS HZ2 H -0.395 11.827 7.834 1.00 . A A . 45 LYS HZ2 1 1 17 30756 1 1 45 LYS N N 3.642 7.658 7.438 1.00 . A A . 45 LYS N 1 1 17 30757 1 1 45 LYS NZ N 0.164 12.147 7.052 1.00 . A A . 45 LYS NZ 1 1 17 30758 1 1 45 LYS O O 5.451 7.260 5.341 1.00 . A A . 45 LYS O 1 1 17 30759 1 1 46 CYS C C 5.495 6.400 2.601 1.00 . A A . 46 CYS C 1 1 17 30760 1 1 46 CYS CA C 4.756 5.355 3.439 1.00 . A A . 46 CYS CA 1 1 17 30761 1 1 46 CYS CB C 4.036 4.327 2.565 1.00 . A A . 46 CYS CB 1 1 17 30762 1 1 46 CYS H H 2.874 5.795 4.215 1.00 . A A . 46 CYS H 1 1 17 30763 1 1 46 CYS HA H 5.451 4.809 4.077 1.00 . A A . 46 CYS HA 1 1 17 30764 1 1 46 CYS HB2 H 3.634 4.834 1.688 1.00 . A A . 46 CYS HB2 1 1 17 30765 1 1 46 CYS HB3 H 4.765 3.600 2.207 1.00 . A A . 46 CYS HB3 1 1 17 30766 1 1 46 CYS N N 3.835 6.048 4.324 1.00 . A A . 46 CYS N 1 1 17 30767 1 1 46 CYS O O 6.723 6.392 2.533 1.00 . A A . 46 CYS O 1 1 17 30768 1 1 46 CYS SG S 2.675 3.430 3.398 1.00 . A A . 46 CYS SG 1 1 17 30769 1 1 47 GLY C C 5.847 9.457 2.008 1.00 . A A . 47 GLY C 1 1 17 30770 1 1 47 GLY CA C 5.279 8.324 1.151 1.00 . A A . 47 GLY CA 1 1 17 30771 1 1 47 GLY H H 3.717 7.275 2.043 1.00 . A A . 47 GLY H 1 1 17 30772 1 1 47 GLY HA2 H 6.067 7.910 0.521 1.00 . A A . 47 GLY HA2 1 1 17 30773 1 1 47 GLY HA3 H 4.512 8.717 0.484 1.00 . A A . 47 GLY HA3 1 1 17 30774 1 1 47 GLY N N 4.715 7.275 1.983 1.00 . A A . 47 GLY N 1 1 17 30775 1 1 47 GLY O O 5.510 10.623 1.805 1.00 . A A . 47 GLY O 1 1 17 30776 1 1 48 THR C C 8.678 10.479 3.289 1.00 . A A . 48 THR C 1 1 17 30777 1 1 48 THR CA C 7.317 10.045 3.837 1.00 . A A . 48 THR CA 1 1 17 30778 1 1 48 THR CB C 7.394 9.424 5.233 1.00 . A A . 48 THR CB 1 1 17 30779 1 1 48 THR CG2 C 8.415 10.126 6.130 1.00 . A A . 48 THR CG2 1 1 17 30780 1 1 48 THR H H 6.969 8.125 3.106 1.00 . A A . 48 THR H 1 1 17 30781 1 1 48 THR HA H 6.687 10.933 3.868 1.00 . A A . 48 THR HA 1 1 17 30782 1 1 48 THR HB H 7.598 8.355 5.173 1.00 . A A . 48 THR HB 1 1 17 30783 1 1 48 THR HG1 H 6.034 9.255 6.691 1.00 . A A . 48 THR HG1 1 1 17 30784 1 1 48 THR HG21 H 9.361 10.224 5.597 1.00 . A A . 48 THR HG21 1 1 17 30785 1 1 48 THR HG22 H 8.045 11.115 6.398 1.00 . A A . 48 THR HG22 1 1 17 30786 1 1 48 THR HG23 H 8.568 9.538 7.036 1.00 . A A . 48 THR HG23 1 1 17 30787 1 1 48 THR N N 6.700 9.075 2.948 1.00 . A A . 48 THR N 1 1 17 30788 1 1 48 THR O O 9.484 9.643 2.883 1.00 . A A . 48 THR O 1 1 17 30789 1 1 48 THR OG1 O 6.137 9.741 5.824 1.00 . A A . 48 THR OG1 1 1 17 30790 1 1 49 ALA C C 11.312 11.688 3.542 1.00 . A A . 49 ALA C 1 1 17 30791 1 1 49 ALA CA C 10.142 12.342 2.804 1.00 . A A . 49 ALA CA 1 1 17 30792 1 1 49 ALA CB C 10.125 13.863 2.970 1.00 . A A . 49 ALA CB 1 1 17 30793 1 1 49 ALA H H 8.232 12.460 3.627 1.00 . A A . 49 ALA H 1 1 17 30794 1 1 49 ALA HA H 10.216 12.106 1.742 1.00 . A A . 49 ALA HA 1 1 17 30795 1 1 49 ALA HB1 H 9.094 14.216 2.980 1.00 . A A . 49 ALA HB1 1 1 17 30796 1 1 49 ALA HB2 H 10.611 14.131 3.908 1.00 . A A . 49 ALA HB2 1 1 17 30797 1 1 49 ALA HB3 H 10.659 14.325 2.139 1.00 . A A . 49 ALA HB3 1 1 17 30798 1 1 49 ALA N N 8.893 11.786 3.295 1.00 . A A . 49 ALA N 1 1 17 30799 1 1 49 ALA O O 11.578 12.010 4.699 1.00 . A A . 49 ALA O 1 1 17 30800 1 1 50 GLY C C 12.868 8.569 3.443 1.00 . A A . 50 GLY C 1 1 17 30801 1 1 50 GLY CA C 13.113 10.079 3.418 1.00 . A A . 50 GLY CA 1 1 17 30802 1 1 50 GLY H H 11.756 10.525 1.903 1.00 . A A . 50 GLY H 1 1 17 30803 1 1 50 GLY HA2 H 14.011 10.296 2.840 1.00 . A A . 50 GLY HA2 1 1 17 30804 1 1 50 GLY HA3 H 13.292 10.438 4.432 1.00 . A A . 50 GLY HA3 1 1 17 30805 1 1 50 GLY N N 11.979 10.781 2.843 1.00 . A A . 50 GLY N 1 1 17 30806 1 1 50 GLY O O 13.780 7.793 3.724 1.00 . A A . 50 GLY O 1 1 17 30807 1 1 51 CYS C C 11.072 6.362 1.671 1.00 . A A . 51 CYS C 1 1 17 30808 1 1 51 CYS CA C 11.256 6.794 3.128 1.00 . A A . 51 CYS CA 1 1 17 30809 1 1 51 CYS CB C 10.000 6.536 3.962 1.00 . A A . 51 CYS CB 1 1 17 30810 1 1 51 CYS H H 10.896 8.835 2.915 1.00 . A A . 51 CYS H 1 1 17 30811 1 1 51 CYS HA H 12.074 6.245 3.594 1.00 . A A . 51 CYS HA 1 1 17 30812 1 1 51 CYS HB2 H 9.188 7.180 3.622 1.00 . A A . 51 CYS HB2 1 1 17 30813 1 1 51 CYS HB3 H 9.668 5.506 3.827 1.00 . A A . 51 CYS HB3 1 1 17 30814 1 1 51 CYS N N 11.632 8.197 3.143 1.00 . A A . 51 CYS N 1 1 17 30815 1 1 51 CYS O O 12.047 6.090 0.973 1.00 . A A . 51 CYS O 1 1 17 30816 1 1 51 CYS SG S 10.348 6.852 5.731 1.00 . A A . 51 CYS SG 1 1 17 30817 1 1 52 HIS C C 9.222 7.164 -0.950 1.00 . A A . 52 HIS C 1 1 17 30818 1 1 52 HIS CA C 9.490 5.918 -0.104 1.00 . A A . 52 HIS CA 1 1 17 30819 1 1 52 HIS CB C 8.323 4.929 -0.119 1.00 . A A . 52 HIS CB 1 1 17 30820 1 1 52 HIS CD2 C 8.218 3.035 1.679 1.00 . A A . 52 HIS CD2 1 1 17 30821 1 1 52 HIS CE1 C 9.563 1.609 0.708 1.00 . A A . 52 HIS CE1 1 1 17 30822 1 1 52 HIS CG C 8.641 3.593 0.509 1.00 . A A . 52 HIS CG 1 1 17 30823 1 1 52 HIS H H 9.027 6.535 1.831 1.00 . A A . 52 HIS H 1 1 17 30824 1 1 52 HIS HA H 10.366 5.403 -0.497 1.00 . A A . 52 HIS HA 1 1 17 30825 1 1 52 HIS HB2 H 7.477 5.373 0.406 1.00 . A A . 52 HIS HB2 1 1 17 30826 1 1 52 HIS HB3 H 8.009 4.769 -1.150 1.00 . A A . 52 HIS HB3 1 1 17 30827 1 1 52 HIS HD1 H 9.962 2.786 -0.953 1.00 . A A . 52 HIS HD1 1 1 17 30828 1 1 52 HIS HD2 H 7.538 3.496 2.396 1.00 . A A . 52 HIS HD2 1 1 17 30829 1 1 52 HIS HE1 H 10.152 0.711 0.519 1.00 . A A . 52 HIS HE1 1 1 17 30830 1 1 52 HIS N N 9.814 6.312 1.257 1.00 . A A . 52 HIS N 1 1 17 30831 1 1 52 HIS ND1 N 9.488 2.671 -0.080 1.00 . A A . 52 HIS ND1 1 1 17 30832 1 1 52 HIS NE2 N 8.775 1.836 1.798 1.00 . A A . 52 HIS NE2 1 1 17 30833 1 1 52 HIS O O 8.073 7.477 -1.254 1.00 . A A . 52 HIS O 1 1 17 30834 1 1 53 ASP C C 11.260 9.012 -3.213 1.00 . A A . 53 ASP C 1 1 17 30835 1 1 53 ASP CA C 10.200 9.048 -2.110 1.00 . A A . 53 ASP CA 1 1 17 30836 1 1 53 ASP CB C 10.442 10.298 -1.262 1.00 . A A . 53 ASP CB 1 1 17 30837 1 1 53 ASP CG C 10.872 11.539 -2.047 1.00 . A A . 53 ASP CG 1 1 17 30838 1 1 53 ASP H H 11.236 7.581 -1.054 1.00 . A A . 53 ASP H 1 1 17 30839 1 1 53 ASP HA H 9.185 9.041 -2.507 1.00 . A A . 53 ASP HA 1 1 17 30840 1 1 53 ASP HB2 H 9.528 10.531 -0.716 1.00 . A A . 53 ASP HB2 1 1 17 30841 1 1 53 ASP HB3 H 11.208 10.073 -0.520 1.00 . A A . 53 ASP HB3 1 1 17 30842 1 1 53 ASP N N 10.304 7.842 -1.305 1.00 . A A . 53 ASP N 1 1 17 30843 1 1 53 ASP O O 12.301 9.658 -3.099 1.00 . A A . 53 ASP O 1 1 17 30844 1 1 53 ASP OD1 O 9.991 12.120 -2.717 1.00 . A A . 53 ASP OD1 1 1 17 30845 1 1 53 ASP OD2 O 12.072 11.877 -1.960 1.00 . A A . 53 ASP OD2 1 1 17 30846 1 1 54 SER C C 11.333 8.895 -6.582 1.00 . A A . 54 SER C 1 1 17 30847 1 1 54 SER CA C 11.873 8.123 -5.377 1.00 . A A . 54 SER CA 1 1 17 30848 1 1 54 SER CB C 12.093 6.653 -5.743 1.00 . A A . 54 SER CB 1 1 17 30849 1 1 54 SER H H 10.110 7.729 -4.339 1.00 . A A . 54 SER H 1 1 17 30850 1 1 54 SER HA H 12.813 8.556 -5.035 1.00 . A A . 54 SER HA 1 1 17 30851 1 1 54 SER HB2 H 13.063 6.542 -6.227 1.00 . A A . 54 SER HB2 1 1 17 30852 1 1 54 SER HB3 H 12.120 6.053 -4.833 1.00 . A A . 54 SER HB3 1 1 17 30853 1 1 54 SER HG H 11.362 5.297 -7.019 1.00 . A A . 54 SER HG 1 1 17 30854 1 1 54 SER N N 10.959 8.251 -4.254 1.00 . A A . 54 SER N 1 1 17 30855 1 1 54 SER O O 12.103 9.468 -7.352 1.00 . A A . 54 SER O 1 1 17 30856 1 1 54 SER OG O 11.072 6.160 -6.606 1.00 . A A . 54 SER OG 1 1 17 30857 1 1 55 MET C C 9.982 9.181 -9.149 1.00 . A A . 55 MET C 1 1 17 30858 1 1 55 MET CA C 9.363 9.577 -7.808 1.00 . A A . 55 MET CA 1 1 17 30859 1 1 55 MET CB C 9.496 11.088 -7.610 1.00 . A A . 55 MET CB 1 1 17 30860 1 1 55 MET CE C 7.252 10.187 -5.026 1.00 . A A . 55 MET CE 1 1 17 30861 1 1 55 MET CG C 8.183 11.694 -7.109 1.00 . A A . 55 MET CG 1 1 17 30862 1 1 55 MET H H 9.396 8.417 -6.078 1.00 . A A . 55 MET H 1 1 17 30863 1 1 55 MET HA H 8.320 9.263 -7.774 1.00 . A A . 55 MET HA 1 1 17 30864 1 1 55 MET HB2 H 10.293 11.297 -6.896 1.00 . A A . 55 MET HB2 1 1 17 30865 1 1 55 MET HB3 H 9.781 11.558 -8.552 1.00 . A A . 55 MET HB3 1 1 17 30866 1 1 55 MET HE1 H 7.268 9.570 -5.925 1.00 . A A . 55 MET HE1 1 1 17 30867 1 1 55 MET HE2 H 7.716 9.642 -4.203 1.00 . A A . 55 MET HE2 1 1 17 30868 1 1 55 MET HE3 H 6.220 10.425 -4.767 1.00 . A A . 55 MET HE3 1 1 17 30869 1 1 55 MET HG2 H 8.075 12.711 -7.485 1.00 . A A . 55 MET HG2 1 1 17 30870 1 1 55 MET HG3 H 7.339 11.121 -7.494 1.00 . A A . 55 MET HG3 1 1 17 30871 1 1 55 MET N N 10.014 8.885 -6.709 1.00 . A A . 55 MET N 1 1 17 30872 1 1 55 MET O O 10.090 10.005 -10.056 1.00 . A A . 55 MET O 1 1 17 30873 1 1 55 MET SD S 8.155 11.697 -5.325 1.00 . A A . 55 MET SD 1 1 17 30874 1 1 56 ASP C C 10.026 6.402 -11.106 1.00 . A A . 56 ASP C 1 1 17 30875 1 1 56 ASP CA C 10.980 7.402 -10.450 1.00 . A A . 56 ASP CA 1 1 17 30876 1 1 56 ASP CB C 12.291 6.674 -10.145 1.00 . A A . 56 ASP CB 1 1 17 30877 1 1 56 ASP CG C 13.247 6.541 -11.333 1.00 . A A . 56 ASP CG 1 1 17 30878 1 1 56 ASP H H 10.283 7.253 -8.493 1.00 . A A . 56 ASP H 1 1 17 30879 1 1 56 ASP HA H 11.160 8.277 -11.073 1.00 . A A . 56 ASP HA 1 1 17 30880 1 1 56 ASP HB2 H 12.805 7.203 -9.342 1.00 . A A . 56 ASP HB2 1 1 17 30881 1 1 56 ASP HB3 H 12.058 5.677 -9.772 1.00 . A A . 56 ASP HB3 1 1 17 30882 1 1 56 ASP N N 10.374 7.918 -9.234 1.00 . A A . 56 ASP N 1 1 17 30883 1 1 56 ASP O O 10.005 6.269 -12.329 1.00 . A A . 56 ASP O 1 1 17 30884 1 1 56 ASP OD1 O 12.733 6.397 -12.462 1.00 . A A . 56 ASP OD1 1 1 17 30885 1 1 56 ASP OD2 O 14.471 6.586 -11.083 1.00 . A A . 56 ASP OD2 1 1 17 30886 1 1 57 LYS C C 9.062 3.531 -11.299 1.00 . A A . 57 LYS C 1 1 17 30887 1 1 57 LYS CA C 8.305 4.741 -10.747 1.00 . A A . 57 LYS CA 1 1 17 30888 1 1 57 LYS CB C 7.344 5.376 -11.754 1.00 . A A . 57 LYS CB 1 1 17 30889 1 1 57 LYS CD C 6.614 3.581 -13.368 1.00 . A A . 57 LYS CD 1 1 17 30890 1 1 57 LYS CE C 5.464 3.530 -14.376 1.00 . A A . 57 LYS CE 1 1 17 30891 1 1 57 LYS CG C 6.228 4.401 -12.136 1.00 . A A . 57 LYS CG 1 1 17 30892 1 1 57 LYS H H 9.282 5.839 -9.271 1.00 . A A . 57 LYS H 1 1 17 30893 1 1 57 LYS HA H 7.710 4.416 -9.894 1.00 . A A . 57 LYS HA 1 1 17 30894 1 1 57 LYS HB2 H 6.911 6.281 -11.328 1.00 . A A . 57 LYS HB2 1 1 17 30895 1 1 57 LYS HB3 H 7.892 5.675 -12.647 1.00 . A A . 57 LYS HB3 1 1 17 30896 1 1 57 LYS HD2 H 7.495 4.017 -13.838 1.00 . A A . 57 LYS HD2 1 1 17 30897 1 1 57 LYS HD3 H 6.883 2.568 -13.066 1.00 . A A . 57 LYS HD3 1 1 17 30898 1 1 57 LYS HE2 H 4.512 3.641 -13.856 1.00 . A A . 57 LYS HE2 1 1 17 30899 1 1 57 LYS HE3 H 5.546 4.365 -15.072 1.00 . A A . 57 LYS HE3 1 1 17 30900 1 1 57 LYS HG2 H 6.022 3.733 -11.300 1.00 . A A . 57 LYS HG2 1 1 17 30901 1 1 57 LYS HG3 H 5.310 4.954 -12.335 1.00 . A A . 57 LYS HG3 1 1 17 30902 1 1 57 LYS HZ1 H 6.345 1.738 -14.972 1.00 . A A . 57 LYS HZ1 1 1 17 30903 1 1 57 LYS HZ2 H 4.725 1.639 -14.843 1.00 . A A . 57 LYS HZ2 1 1 17 30904 1 1 57 LYS N N 9.259 5.725 -10.264 1.00 . A A . 57 LYS N 1 1 17 30905 1 1 57 LYS NZ N 5.483 2.251 -15.121 1.00 . A A . 57 LYS NZ 1 1 17 30906 1 1 57 LYS O O 8.946 2.427 -10.769 1.00 . A A . 57 LYS O 1 1 17 30907 1 1 58 LYS C C 11.966 2.631 -12.309 1.00 . A A . 58 LYS C 1 1 17 30908 1 1 58 LYS CA C 10.597 2.724 -12.985 1.00 . A A . 58 LYS CA 1 1 17 30909 1 1 58 LYS CB C 10.672 2.944 -14.498 1.00 . A A . 58 LYS CB 1 1 17 30910 1 1 58 LYS CD C 10.020 1.096 -16.085 1.00 . A A . 58 LYS CD 1 1 17 30911 1 1 58 LYS CE C 10.339 1.269 -17.571 1.00 . A A . 58 LYS CE 1 1 17 30912 1 1 58 LYS CG C 11.136 1.674 -15.213 1.00 . A A . 58 LYS CG 1 1 17 30913 1 1 58 LYS H H 9.911 4.681 -12.780 1.00 . A A . 58 LYS H 1 1 17 30914 1 1 58 LYS HA H 10.066 1.787 -12.821 1.00 . A A . 58 LYS HA 1 1 17 30915 1 1 58 LYS HB2 H 9.694 3.241 -14.875 1.00 . A A . 58 LYS HB2 1 1 17 30916 1 1 58 LYS HB3 H 11.359 3.761 -14.717 1.00 . A A . 58 LYS HB3 1 1 17 30917 1 1 58 LYS HD2 H 9.887 0.038 -15.858 1.00 . A A . 58 LYS HD2 1 1 17 30918 1 1 58 LYS HD3 H 9.078 1.593 -15.852 1.00 . A A . 58 LYS HD3 1 1 17 30919 1 1 58 LYS HE2 H 9.874 2.180 -17.946 1.00 . A A . 58 LYS HE2 1 1 17 30920 1 1 58 LYS HE3 H 11.415 1.381 -17.707 1.00 . A A . 58 LYS HE3 1 1 17 30921 1 1 58 LYS HG2 H 12.006 1.898 -15.831 1.00 . A A . 58 LYS HG2 1 1 17 30922 1 1 58 LYS HG3 H 11.450 0.932 -14.479 1.00 . A A . 58 LYS HG3 1 1 17 30923 1 1 58 LYS HZ1 H 9.236 0.379 -19.099 1.00 . A A . 58 LYS HZ1 1 1 17 30924 1 1 58 LYS HZ2 H 10.617 -0.418 -18.764 1.00 . A A . 58 LYS HZ2 1 1 17 30925 1 1 58 LYS N N 9.821 3.780 -12.356 1.00 . A A . 58 LYS N 1 1 17 30926 1 1 58 LYS NZ N 9.855 0.103 -18.344 1.00 . A A . 58 LYS NZ 1 1 17 30927 1 1 58 LYS O O 12.993 2.876 -12.941 1.00 . A A . 58 LYS O 1 1 17 30928 1 1 59 ASP C C 13.105 0.869 -9.427 1.00 . A A . 59 ASP C 1 1 17 30929 1 1 59 ASP CA C 13.164 2.149 -10.264 1.00 . A A . 59 ASP CA 1 1 17 30930 1 1 59 ASP CB C 13.340 3.330 -9.308 1.00 . A A . 59 ASP CB 1 1 17 30931 1 1 59 ASP CG C 14.536 3.221 -8.359 1.00 . A A . 59 ASP CG 1 1 17 30932 1 1 59 ASP H H 11.098 2.079 -10.526 1.00 . A A . 59 ASP H 1 1 17 30933 1 1 59 ASP HA H 13.964 2.127 -11.003 1.00 . A A . 59 ASP HA 1 1 17 30934 1 1 59 ASP HB2 H 13.444 4.242 -9.896 1.00 . A A . 59 ASP HB2 1 1 17 30935 1 1 59 ASP HB3 H 12.433 3.436 -8.713 1.00 . A A . 59 ASP HB3 1 1 17 30936 1 1 59 ASP N N 11.938 2.277 -11.033 1.00 . A A . 59 ASP N 1 1 17 30937 1 1 59 ASP O O 13.990 0.020 -9.523 1.00 . A A . 59 ASP O 1 1 17 30938 1 1 59 ASP OD1 O 15.446 2.428 -8.682 1.00 . A A . 59 ASP OD1 1 1 17 30939 1 1 59 ASP OD2 O 14.512 3.934 -7.332 1.00 . A A . 59 ASP OD2 1 1 17 30940 1 1 60 LYS C C 12.938 -0.392 -6.681 1.00 . A A . 60 LYS C 1 1 17 30941 1 1 60 LYS CA C 11.868 -0.391 -7.774 1.00 . A A . 60 LYS CA 1 1 17 30942 1 1 60 LYS CB C 11.843 -1.672 -8.612 1.00 . A A . 60 LYS CB 1 1 17 30943 1 1 60 LYS CD C 11.533 -1.422 -11.102 1.00 . A A . 60 LYS CD 1 1 17 30944 1 1 60 LYS CE C 10.547 -1.605 -12.257 1.00 . A A . 60 LYS CE 1 1 17 30945 1 1 60 LYS CG C 10.828 -1.562 -9.752 1.00 . A A . 60 LYS CG 1 1 17 30946 1 1 60 LYS H H 11.338 1.466 -8.556 1.00 . A A . 60 LYS H 1 1 17 30947 1 1 60 LYS HA H 10.890 -0.297 -7.301 1.00 . A A . 60 LYS HA 1 1 17 30948 1 1 60 LYS HB2 H 12.835 -1.863 -9.021 1.00 . A A . 60 LYS HB2 1 1 17 30949 1 1 60 LYS HB3 H 11.592 -2.521 -7.977 1.00 . A A . 60 LYS HB3 1 1 17 30950 1 1 60 LYS HD2 H 12.002 -0.440 -11.172 1.00 . A A . 60 LYS HD2 1 1 17 30951 1 1 60 LYS HD3 H 12.330 -2.162 -11.179 1.00 . A A . 60 LYS HD3 1 1 17 30952 1 1 60 LYS HE2 H 9.663 -2.138 -11.907 1.00 . A A . 60 LYS HE2 1 1 17 30953 1 1 60 LYS HE3 H 10.212 -0.632 -12.615 1.00 . A A . 60 LYS HE3 1 1 17 30954 1 1 60 LYS HG2 H 10.189 -2.445 -9.761 1.00 . A A . 60 LYS HG2 1 1 17 30955 1 1 60 LYS HG3 H 10.180 -0.702 -9.585 1.00 . A A . 60 LYS HG3 1 1 17 30956 1 1 60 LYS HZ1 H 10.915 -3.335 -13.359 1.00 . A A . 60 LYS HZ1 1 1 17 30957 1 1 60 LYS HZ2 H 10.919 -1.987 -14.272 1.00 . A A . 60 LYS HZ2 1 1 17 30958 1 1 60 LYS N N 12.054 0.771 -8.627 1.00 . A A . 60 LYS N 1 1 17 30959 1 1 60 LYS NZ N 11.180 -2.357 -13.364 1.00 . A A . 60 LYS NZ 1 1 17 30960 1 1 60 LYS O O 13.261 0.655 -6.123 1.00 . A A . 60 LYS O 1 1 17 30961 1 1 61 SER C C 13.851 -1.695 -3.998 1.00 . A A . 61 SER C 1 1 17 30962 1 1 61 SER CA C 14.485 -1.731 -5.391 1.00 . A A . 61 SER CA 1 1 17 30963 1 1 61 SER CB C 15.550 -0.640 -5.517 1.00 . A A . 61 SER CB 1 1 17 30964 1 1 61 SER H H 13.190 -2.427 -6.867 1.00 . A A . 61 SER H 1 1 17 30965 1 1 61 SER HA H 14.938 -2.704 -5.580 1.00 . A A . 61 SER HA 1 1 17 30966 1 1 61 SER HB2 H 15.167 0.291 -5.098 1.00 . A A . 61 SER HB2 1 1 17 30967 1 1 61 SER HB3 H 16.425 -0.918 -4.929 1.00 . A A . 61 SER HB3 1 1 17 30968 1 1 61 SER HG H 15.804 0.533 -7.118 1.00 . A A . 61 SER HG 1 1 17 30969 1 1 61 SER N N 13.458 -1.580 -6.408 1.00 . A A . 61 SER N 1 1 17 30970 1 1 61 SER O O 13.791 -2.715 -3.313 1.00 . A A . 61 SER O 1 1 17 30971 1 1 61 SER OG O 15.938 -0.427 -6.872 1.00 . A A . 61 SER OG 1 1 17 30972 1 1 62 ALA C C 12.295 1.121 -2.188 1.00 . A A . 62 ALA C 1 1 17 30973 1 1 62 ALA CA C 12.769 -0.328 -2.323 1.00 . A A . 62 ALA CA 1 1 17 30974 1 1 62 ALA CB C 13.753 -0.725 -1.221 1.00 . A A . 62 ALA CB 1 1 17 30975 1 1 62 ALA H H 13.448 0.315 -4.184 1.00 . A A . 62 ALA H 1 1 17 30976 1 1 62 ALA HA H 11.904 -0.990 -2.276 1.00 . A A . 62 ALA HA 1 1 17 30977 1 1 62 ALA HB1 H 14.415 -1.507 -1.590 1.00 . A A . 62 ALA HB1 1 1 17 30978 1 1 62 ALA HB2 H 14.344 0.145 -0.931 1.00 . A A . 62 ALA HB2 1 1 17 30979 1 1 62 ALA HB3 H 13.201 -1.093 -0.356 1.00 . A A . 62 ALA HB3 1 1 17 30980 1 1 62 ALA N N 13.395 -0.510 -3.621 1.00 . A A . 62 ALA N 1 1 17 30981 1 1 62 ALA O O 11.199 1.376 -1.693 1.00 . A A . 62 ALA O 1 1 17 30982 1 1 63 LYS C C 11.628 3.739 -3.475 1.00 . A A . 63 LYS C 1 1 17 30983 1 1 63 LYS CA C 12.829 3.448 -2.573 1.00 . A A . 63 LYS CA 1 1 17 30984 1 1 63 LYS CB C 14.064 4.289 -2.903 1.00 . A A . 63 LYS CB 1 1 17 30985 1 1 63 LYS CD C 15.436 5.922 -1.558 1.00 . A A . 63 LYS CD 1 1 17 30986 1 1 63 LYS CE C 15.454 6.387 -0.100 1.00 . A A . 63 LYS CE 1 1 17 30987 1 1 63 LYS CG C 14.945 4.477 -1.666 1.00 . A A . 63 LYS CG 1 1 17 30988 1 1 63 LYS H H 14.036 1.816 -3.039 1.00 . A A . 63 LYS H 1 1 17 30989 1 1 63 LYS HA H 12.550 3.674 -1.544 1.00 . A A . 63 LYS HA 1 1 17 30990 1 1 63 LYS HB2 H 14.638 3.806 -3.693 1.00 . A A . 63 LYS HB2 1 1 17 30991 1 1 63 LYS HB3 H 13.754 5.262 -3.284 1.00 . A A . 63 LYS HB3 1 1 17 30992 1 1 63 LYS HD2 H 16.438 6.003 -1.980 1.00 . A A . 63 LYS HD2 1 1 17 30993 1 1 63 LYS HD3 H 14.790 6.575 -2.144 1.00 . A A . 63 LYS HD3 1 1 17 30994 1 1 63 LYS HE2 H 15.180 7.441 -0.045 1.00 . A A . 63 LYS HE2 1 1 17 30995 1 1 63 LYS HE3 H 14.709 5.834 0.473 1.00 . A A . 63 LYS HE3 1 1 17 30996 1 1 63 LYS HG2 H 14.383 4.212 -0.771 1.00 . A A . 63 LYS HG2 1 1 17 30997 1 1 63 LYS HG3 H 15.799 3.802 -1.718 1.00 . A A . 63 LYS HG3 1 1 17 30998 1 1 63 LYS HZ1 H 16.746 6.003 1.489 1.00 . A A . 63 LYS HZ1 1 1 17 30999 1 1 63 LYS HZ2 H 17.280 5.399 0.075 1.00 . A A . 63 LYS HZ2 1 1 17 31000 1 1 63 LYS N N 13.146 2.032 -2.637 1.00 . A A . 63 LYS N 1 1 17 31001 1 1 63 LYS NZ N 16.795 6.185 0.493 1.00 . A A . 63 LYS NZ 1 1 17 31002 1 1 63 LYS O O 10.958 4.758 -3.313 1.00 . A A . 63 LYS O 1 1 17 31003 1 1 64 GLY C C 8.943 2.874 -4.606 1.00 . A A . 64 GLY C 1 1 17 31004 1 1 64 GLY CA C 10.285 2.972 -5.334 1.00 . A A . 64 GLY CA 1 1 17 31005 1 1 64 GLY H H 11.943 2.000 -4.531 1.00 . A A . 64 GLY H 1 1 17 31006 1 1 64 GLY HA2 H 10.357 3.932 -5.844 1.00 . A A . 64 GLY HA2 1 1 17 31007 1 1 64 GLY HA3 H 10.343 2.199 -6.101 1.00 . A A . 64 GLY HA3 1 1 17 31008 1 1 64 GLY N N 11.393 2.826 -4.406 1.00 . A A . 64 GLY N 1 1 17 31009 1 1 64 GLY O O 8.484 1.779 -4.286 1.00 . A A . 64 GLY O 1 1 17 31010 1 1 65 TYR C C 5.998 3.325 -4.454 1.00 . A A . 65 TYR C 1 1 17 31011 1 1 65 TYR CA C 7.070 4.094 -3.680 1.00 . A A . 65 TYR CA 1 1 17 31012 1 1 65 TYR CB C 6.685 5.574 -3.634 1.00 . A A . 65 TYR CB 1 1 17 31013 1 1 65 TYR CD1 C 4.873 5.597 -1.880 1.00 . A A . 65 TYR CD1 1 1 17 31014 1 1 65 TYR CD2 C 4.313 6.289 -4.099 1.00 . A A . 65 TYR CD2 1 1 17 31015 1 1 65 TYR CE1 C 3.516 5.836 -1.463 1.00 . A A . 65 TYR CE1 1 1 17 31016 1 1 65 TYR CE2 C 2.955 6.528 -3.681 1.00 . A A . 65 TYR CE2 1 1 17 31017 1 1 65 TYR CG C 5.243 5.828 -3.190 1.00 . A A . 65 TYR CG 1 1 17 31018 1 1 65 TYR CZ C 2.624 6.290 -2.383 1.00 . A A . 65 TYR CZ 1 1 17 31019 1 1 65 TYR H H 8.730 4.922 -4.630 1.00 . A A . 65 TYR H 1 1 17 31020 1 1 65 TYR HA H 7.194 3.641 -2.697 1.00 . A A . 65 TYR HA 1 1 17 31021 1 1 65 TYR HB2 H 7.361 6.094 -2.954 1.00 . A A . 65 TYR HB2 1 1 17 31022 1 1 65 TYR HB3 H 6.832 6.009 -4.623 1.00 . A A . 65 TYR HB3 1 1 17 31023 1 1 65 TYR HD1 H 5.609 5.233 -1.163 1.00 . A A . 65 TYR HD1 1 1 17 31024 1 1 65 TYR HD2 H 4.605 6.472 -5.133 1.00 . A A . 65 TYR HD2 1 1 17 31025 1 1 65 TYR HE1 H 3.211 5.657 -0.432 1.00 . A A . 65 TYR HE1 1 1 17 31026 1 1 65 TYR HE2 H 2.210 6.892 -4.388 1.00 . A A . 65 TYR HE2 1 1 17 31027 1 1 65 TYR HH H 0.789 5.697 -2.141 1.00 . A A . 65 TYR HH 1 1 17 31028 1 1 65 TYR N N 8.351 4.035 -4.365 1.00 . A A . 65 TYR N 1 1 17 31029 1 1 65 TYR O O 5.215 2.582 -3.865 1.00 . A A . 65 TYR O 1 1 17 31030 1 1 65 TYR OH O 1.343 6.516 -1.988 1.00 . A A . 65 TYR OH 1 1 17 31031 1 1 66 TYR C C 5.409 1.396 -6.835 1.00 . A A . 66 TYR C 1 1 17 31032 1 1 66 TYR CA C 5.034 2.864 -6.624 1.00 . A A . 66 TYR CA 1 1 17 31033 1 1 66 TYR CB C 5.096 3.592 -7.968 1.00 . A A . 66 TYR CB 1 1 17 31034 1 1 66 TYR CD1 C 5.467 1.806 -9.709 1.00 . A A . 66 TYR CD1 1 1 17 31035 1 1 66 TYR CD2 C 3.358 2.932 -9.672 1.00 . A A . 66 TYR CD2 1 1 17 31036 1 1 66 TYR CE1 C 5.024 1.013 -10.826 1.00 . A A . 66 TYR CE1 1 1 17 31037 1 1 66 TYR CE2 C 2.915 2.138 -10.789 1.00 . A A . 66 TYR CE2 1 1 17 31038 1 1 66 TYR CG C 4.625 2.749 -9.155 1.00 . A A . 66 TYR CG 1 1 17 31039 1 1 66 TYR CZ C 3.770 1.218 -11.311 1.00 . A A . 66 TYR CZ 1 1 17 31040 1 1 66 TYR H H 6.638 4.135 -6.235 1.00 . A A . 66 TYR H 1 1 17 31041 1 1 66 TYR HA H 4.059 2.916 -6.140 1.00 . A A . 66 TYR HA 1 1 17 31042 1 1 66 TYR HB2 H 4.484 4.493 -7.910 1.00 . A A . 66 TYR HB2 1 1 17 31043 1 1 66 TYR HB3 H 6.121 3.914 -8.148 1.00 . A A . 66 TYR HB3 1 1 17 31044 1 1 66 TYR HD1 H 6.467 1.662 -9.300 1.00 . A A . 66 TYR HD1 1 1 17 31045 1 1 66 TYR HD2 H 2.693 3.677 -9.234 1.00 . A A . 66 TYR HD2 1 1 17 31046 1 1 66 TYR HE1 H 5.679 0.265 -11.273 1.00 . A A . 66 TYR HE1 1 1 17 31047 1 1 66 TYR HE2 H 1.918 2.272 -11.206 1.00 . A A . 66 TYR HE2 1 1 17 31048 1 1 66 TYR HH H 2.456 0.787 -12.677 1.00 . A A . 66 TYR HH 1 1 17 31049 1 1 66 TYR N N 5.997 3.529 -5.763 1.00 . A A . 66 TYR N 1 1 17 31050 1 1 66 TYR O O 4.709 0.667 -7.537 1.00 . A A . 66 TYR O 1 1 17 31051 1 1 66 TYR OH O 3.351 0.469 -12.366 1.00 . A A . 66 TYR OH 1 1 17 31052 1 1 67 HIS C C 6.582 -1.152 -5.082 1.00 . A A . 67 HIS C 1 1 17 31053 1 1 67 HIS CA C 6.990 -0.363 -6.327 1.00 . A A . 67 HIS CA 1 1 17 31054 1 1 67 HIS CB C 8.499 -0.393 -6.580 1.00 . A A . 67 HIS CB 1 1 17 31055 1 1 67 HIS CD2 C 9.708 -1.796 -4.735 1.00 . A A . 67 HIS CD2 1 1 17 31056 1 1 67 HIS CE1 C 10.060 -3.611 -5.905 1.00 . A A . 67 HIS CE1 1 1 17 31057 1 1 67 HIS CG C 9.198 -1.592 -5.984 1.00 . A A . 67 HIS CG 1 1 17 31058 1 1 67 HIS H H 7.077 1.604 -5.646 1.00 . A A . 67 HIS H 1 1 17 31059 1 1 67 HIS HA H 6.499 -0.795 -7.199 1.00 . A A . 67 HIS HA 1 1 17 31060 1 1 67 HIS HB2 H 8.677 -0.379 -7.655 1.00 . A A . 67 HIS HB2 1 1 17 31061 1 1 67 HIS HB3 H 8.944 0.515 -6.172 1.00 . A A . 67 HIS HB3 1 1 17 31062 1 1 67 HIS HD1 H 9.179 -2.917 -7.651 1.00 . A A . 67 HIS HD1 1 1 17 31063 1 1 67 HIS HD2 H 9.692 -1.078 -3.915 1.00 . A A . 67 HIS HD2 1 1 17 31064 1 1 67 HIS HE1 H 10.383 -4.616 -6.177 1.00 . A A . 67 HIS HE1 1 1 17 31065 1 1 67 HIS N N 6.513 1.005 -6.215 1.00 . A A . 67 HIS N 1 1 17 31066 1 1 67 HIS ND1 N 9.435 -2.753 -6.698 1.00 . A A . 67 HIS ND1 1 1 17 31067 1 1 67 HIS NE2 N 10.228 -3.016 -4.689 1.00 . A A . 67 HIS NE2 1 1 17 31068 1 1 67 HIS O O 6.531 -2.381 -5.110 1.00 . A A . 67 HIS O 1 1 17 31069 1 1 68 VAL C C 4.373 -1.011 -2.659 1.00 . A A . 68 VAL C 1 1 17 31070 1 1 68 VAL CA C 5.899 -1.029 -2.765 1.00 . A A . 68 VAL CA 1 1 17 31071 1 1 68 VAL CB C 6.588 -0.328 -1.593 1.00 . A A . 68 VAL CB 1 1 17 31072 1 1 68 VAL CG1 C 8.040 -0.791 -1.454 1.00 . A A . 68 VAL CG1 1 1 17 31073 1 1 68 VAL CG2 C 6.509 1.193 -1.740 1.00 . A A . 68 VAL CG2 1 1 17 31074 1 1 68 VAL H H 6.344 0.585 -4.004 1.00 . A A . 68 VAL H 1 1 17 31075 1 1 68 VAL HA H 6.237 -2.065 -2.784 1.00 . A A . 68 VAL HA 1 1 17 31076 1 1 68 VAL HB H 6.060 -0.604 -0.680 1.00 . A A . 68 VAL HB 1 1 17 31077 1 1 68 VAL HG11 H 8.066 -1.875 -1.343 1.00 . A A . 68 VAL HG11 1 1 17 31078 1 1 68 VAL HG12 H 8.600 -0.503 -2.343 1.00 . A A . 68 VAL HG12 1 1 17 31079 1 1 68 VAL HG13 H 8.487 -0.325 -0.576 1.00 . A A . 68 VAL HG13 1 1 17 31080 1 1 68 VAL HG21 H 5.489 1.481 -1.995 1.00 . A A . 68 VAL HG21 1 1 17 31081 1 1 68 VAL HG22 H 6.796 1.664 -0.801 1.00 . A A . 68 VAL HG22 1 1 17 31082 1 1 68 VAL HG23 H 7.186 1.517 -2.531 1.00 . A A . 68 VAL HG23 1 1 17 31083 1 1 68 VAL N N 6.301 -0.414 -4.018 1.00 . A A . 68 VAL N 1 1 17 31084 1 1 68 VAL O O 3.815 -1.344 -1.615 1.00 . A A . 68 VAL O 1 1 17 31085 1 1 69 MET C C 1.725 -1.547 -4.814 1.00 . A A . 69 MET C 1 1 17 31086 1 1 69 MET CA C 2.289 -0.551 -3.798 1.00 . A A . 69 MET CA 1 1 17 31087 1 1 69 MET CB C 1.854 0.866 -4.177 1.00 . A A . 69 MET CB 1 1 17 31088 1 1 69 MET CE C 2.734 1.927 -0.463 1.00 . A A . 69 MET CE 1 1 17 31089 1 1 69 MET CG C 2.394 1.891 -3.177 1.00 . A A . 69 MET CG 1 1 17 31090 1 1 69 MET H H 4.201 -0.349 -4.601 1.00 . A A . 69 MET H 1 1 17 31091 1 1 69 MET HA H 1.954 -0.815 -2.795 1.00 . A A . 69 MET HA 1 1 17 31092 1 1 69 MET HB2 H 2.213 1.106 -5.178 1.00 . A A . 69 MET HB2 1 1 17 31093 1 1 69 MET HB3 H 0.766 0.921 -4.207 1.00 . A A . 69 MET HB3 1 1 17 31094 1 1 69 MET HE1 H 3.699 1.961 -0.970 1.00 . A A . 69 MET HE1 1 1 17 31095 1 1 69 MET HE2 H 2.612 2.823 0.145 1.00 . A A . 69 MET HE2 1 1 17 31096 1 1 69 MET HE3 H 2.690 1.045 0.176 1.00 . A A . 69 MET HE3 1 1 17 31097 1 1 69 MET HG2 H 3.439 1.676 -2.952 1.00 . A A . 69 MET HG2 1 1 17 31098 1 1 69 MET HG3 H 2.361 2.889 -3.613 1.00 . A A . 69 MET HG3 1 1 17 31099 1 1 69 MET N N 3.740 -0.618 -3.755 1.00 . A A . 69 MET N 1 1 17 31100 1 1 69 MET O O 0.530 -1.841 -4.802 1.00 . A A . 69 MET O 1 1 17 31101 1 1 69 MET SD S 1.428 1.848 -1.677 1.00 . A A . 69 MET SD 1 1 17 31102 1 1 70 HIS C C 3.184 -4.178 -6.685 1.00 . A A . 70 HIS C 1 1 17 31103 1 1 70 HIS CA C 2.215 -2.994 -6.688 1.00 . A A . 70 HIS CA 1 1 17 31104 1 1 70 HIS CB C 2.111 -2.317 -8.056 1.00 . A A . 70 HIS CB 1 1 17 31105 1 1 70 HIS CD2 C 0.163 -0.605 -8.388 1.00 . A A . 70 HIS CD2 1 1 17 31106 1 1 70 HIS CE1 C 1.199 1.186 -7.676 1.00 . A A . 70 HIS CE1 1 1 17 31107 1 1 70 HIS CG C 1.426 -0.971 -8.025 1.00 . A A . 70 HIS CG 1 1 17 31108 1 1 70 HIS H H 3.580 -1.794 -5.671 1.00 . A A . 70 HIS H 1 1 17 31109 1 1 70 HIS HA H 1.221 -3.349 -6.417 1.00 . A A . 70 HIS HA 1 1 17 31110 1 1 70 HIS HB2 H 3.113 -2.194 -8.467 1.00 . A A . 70 HIS HB2 1 1 17 31111 1 1 70 HIS HB3 H 1.567 -2.974 -8.735 1.00 . A A . 70 HIS HB3 1 1 17 31112 1 1 70 HIS HD1 H 2.995 0.240 -7.246 1.00 . A A . 70 HIS HD1 1 1 17 31113 1 1 70 HIS HD2 H -0.604 -1.270 -8.784 1.00 . A A . 70 HIS HD2 1 1 17 31114 1 1 70 HIS HE1 H 1.396 2.223 -7.402 1.00 . A A . 70 HIS HE1 1 1 17 31115 1 1 70 HIS N N 2.610 -2.038 -5.668 1.00 . A A . 70 HIS N 1 1 17 31116 1 1 70 HIS ND1 N 2.054 0.179 -7.581 1.00 . A A . 70 HIS ND1 1 1 17 31117 1 1 70 HIS NE2 N 0.027 0.698 -8.175 1.00 . A A . 70 HIS NE2 1 1 17 31118 1 1 70 HIS O O 2.786 -5.310 -6.411 1.00 . A A . 70 HIS O 1 1 17 31119 1 1 71 ASP C C 5.249 -5.877 -5.870 1.00 . A A . 71 ASP C 1 1 17 31120 1 1 71 ASP CA C 5.466 -4.902 -7.029 1.00 . A A . 71 ASP CA 1 1 17 31121 1 1 71 ASP CB C 6.860 -4.290 -6.877 1.00 . A A . 71 ASP CB 1 1 17 31122 1 1 71 ASP CG C 7.946 -4.931 -7.744 1.00 . A A . 71 ASP CG 1 1 17 31123 1 1 71 ASP H H 4.752 -2.954 -7.214 1.00 . A A . 71 ASP H 1 1 17 31124 1 1 71 ASP HA H 5.359 -5.381 -8.002 1.00 . A A . 71 ASP HA 1 1 17 31125 1 1 71 ASP HB2 H 6.802 -3.228 -7.120 1.00 . A A . 71 ASP HB2 1 1 17 31126 1 1 71 ASP HB3 H 7.160 -4.361 -5.832 1.00 . A A . 71 ASP HB3 1 1 17 31127 1 1 71 ASP N N 4.437 -3.877 -6.993 1.00 . A A . 71 ASP N 1 1 17 31128 1 1 71 ASP O O 5.202 -5.468 -4.711 1.00 . A A . 71 ASP O 1 1 17 31129 1 1 71 ASP OD1 O 8.053 -4.516 -8.918 1.00 . A A . 71 ASP OD1 1 1 17 31130 1 1 71 ASP OD2 O 8.644 -5.821 -7.212 1.00 . A A . 71 ASP OD2 1 1 17 31131 1 1 72 LYS C C 6.267 -8.747 -4.788 1.00 . A A . 72 LYS C 1 1 17 31132 1 1 72 LYS CA C 4.913 -8.184 -5.227 1.00 . A A . 72 LYS CA 1 1 17 31133 1 1 72 LYS CB C 3.948 -9.247 -5.756 1.00 . A A . 72 LYS CB 1 1 17 31134 1 1 72 LYS CD C 2.773 -8.967 -7.970 1.00 . A A . 72 LYS CD 1 1 17 31135 1 1 72 LYS CE C 2.184 -10.361 -8.195 1.00 . A A . 72 LYS CE 1 1 17 31136 1 1 72 LYS CG C 2.767 -8.602 -6.484 1.00 . A A . 72 LYS CG 1 1 17 31137 1 1 72 LYS H H 5.164 -7.472 -7.168 1.00 . A A . 72 LYS H 1 1 17 31138 1 1 72 LYS HA H 4.438 -7.717 -4.365 1.00 . A A . 72 LYS HA 1 1 17 31139 1 1 72 LYS HB2 H 4.475 -9.918 -6.434 1.00 . A A . 72 LYS HB2 1 1 17 31140 1 1 72 LYS HB3 H 3.582 -9.855 -4.928 1.00 . A A . 72 LYS HB3 1 1 17 31141 1 1 72 LYS HD2 H 2.198 -8.230 -8.531 1.00 . A A . 72 LYS HD2 1 1 17 31142 1 1 72 LYS HD3 H 3.794 -8.933 -8.352 1.00 . A A . 72 LYS HD3 1 1 17 31143 1 1 72 LYS HE2 H 1.737 -10.726 -7.270 1.00 . A A . 72 LYS HE2 1 1 17 31144 1 1 72 LYS HE3 H 1.387 -10.310 -8.936 1.00 . A A . 72 LYS HE3 1 1 17 31145 1 1 72 LYS HG2 H 1.832 -8.930 -6.029 1.00 . A A . 72 LYS HG2 1 1 17 31146 1 1 72 LYS HG3 H 2.814 -7.519 -6.371 1.00 . A A . 72 LYS HG3 1 1 17 31147 1 1 72 LYS HZ1 H 3.192 -12.185 -8.158 1.00 . A A . 72 LYS HZ1 1 1 17 31148 1 1 72 LYS HZ2 H 3.152 -11.509 -9.639 1.00 . A A . 72 LYS HZ2 1 1 17 31149 1 1 72 LYS N N 5.124 -7.148 -6.223 1.00 . A A . 72 LYS N 1 1 17 31150 1 1 72 LYS NZ N 3.234 -11.299 -8.651 1.00 . A A . 72 LYS NZ 1 1 17 31151 1 1 72 LYS O O 6.432 -9.152 -3.639 1.00 . A A . 72 LYS O 1 1 17 31152 1 1 73 ASN C C 9.260 -8.293 -4.514 1.00 . A A . 73 ASN C 1 1 17 31153 1 1 73 ASN CA C 8.535 -9.260 -5.452 1.00 . A A . 73 ASN CA 1 1 17 31154 1 1 73 ASN CB C 9.356 -9.376 -6.738 1.00 . A A . 73 ASN CB 1 1 17 31155 1 1 73 ASN CG C 9.260 -10.786 -7.325 1.00 . A A . 73 ASN CG 1 1 17 31156 1 1 73 ASN H H 7.059 -8.422 -6.660 1.00 . A A . 73 ASN H 1 1 17 31157 1 1 73 ASN HA H 8.382 -10.241 -5.003 1.00 . A A . 73 ASN HA 1 1 17 31158 1 1 73 ASN HB2 H 9.000 -8.650 -7.468 1.00 . A A . 73 ASN HB2 1 1 17 31159 1 1 73 ASN HB3 H 10.399 -9.135 -6.531 1.00 . A A . 73 ASN HB3 1 1 17 31160 1 1 73 ASN HD21 H 7.305 -10.438 -7.718 1.00 . A A . 73 ASN HD21 1 1 17 31161 1 1 73 ASN HD22 H 7.888 -12.002 -8.182 1.00 . A A . 73 ASN HD22 1 1 17 31162 1 1 73 ASN N N 7.201 -8.754 -5.728 1.00 . A A . 73 ASN N 1 1 17 31163 1 1 73 ASN ND2 N 8.051 -11.102 -7.779 1.00 . A A . 73 ASN ND2 1 1 17 31164 1 1 73 ASN O O 10.182 -7.593 -4.930 1.00 . A A . 73 ASN O 1 1 17 31165 1 1 73 ASN OD1 O 10.221 -11.537 -7.362 1.00 . A A . 73 ASN OD1 1 1 17 31166 1 1 74 THR C C 9.625 -8.176 -0.957 1.00 . A A . 74 THR C 1 1 17 31167 1 1 74 THR CA C 9.409 -7.414 -2.266 1.00 . A A . 74 THR CA 1 1 17 31168 1 1 74 THR CB C 8.509 -6.187 -2.113 1.00 . A A . 74 THR CB 1 1 17 31169 1 1 74 THR CG2 C 8.304 -5.442 -3.434 1.00 . A A . 74 THR CG2 1 1 17 31170 1 1 74 THR H H 8.064 -8.857 -2.936 1.00 . A A . 74 THR H 1 1 17 31171 1 1 74 THR HA H 10.392 -7.104 -2.621 1.00 . A A . 74 THR HA 1 1 17 31172 1 1 74 THR HB H 8.893 -5.516 -1.344 1.00 . A A . 74 THR HB 1 1 17 31173 1 1 74 THR HG1 H 7.002 -6.578 -0.856 1.00 . A A . 74 THR HG1 1 1 17 31174 1 1 74 THR HG21 H 9.163 -5.612 -4.083 1.00 . A A . 74 THR HG21 1 1 17 31175 1 1 74 THR HG22 H 7.401 -5.810 -3.921 1.00 . A A . 74 THR HG22 1 1 17 31176 1 1 74 THR HG23 H 8.203 -4.375 -3.237 1.00 . A A . 74 THR HG23 1 1 17 31177 1 1 74 THR N N 8.815 -8.285 -3.266 1.00 . A A . 74 THR N 1 1 17 31178 1 1 74 THR O O 8.949 -9.170 -0.694 1.00 . A A . 74 THR O 1 1 17 31179 1 1 74 THR OG1 O 7.226 -6.731 -1.818 1.00 . A A . 74 THR OG1 1 1 17 31180 1 1 75 LYS C C 9.674 -8.190 2.034 1.00 . A A . 75 LYS C 1 1 17 31181 1 1 75 LYS CA C 10.884 -8.304 1.105 1.00 . A A . 75 LYS CA 1 1 17 31182 1 1 75 LYS CB C 12.167 -7.709 1.689 1.00 . A A . 75 LYS CB 1 1 17 31183 1 1 75 LYS CD C 13.893 -8.093 3.487 1.00 . A A . 75 LYS CD 1 1 17 31184 1 1 75 LYS CE C 14.043 -7.442 4.864 1.00 . A A . 75 LYS CE 1 1 17 31185 1 1 75 LYS CG C 12.418 -8.234 3.105 1.00 . A A . 75 LYS CG 1 1 17 31186 1 1 75 LYS H H 11.115 -6.873 -0.391 1.00 . A A . 75 LYS H 1 1 17 31187 1 1 75 LYS HA H 11.075 -9.360 0.915 1.00 . A A . 75 LYS HA 1 1 17 31188 1 1 75 LYS HB2 H 13.013 -7.959 1.049 1.00 . A A . 75 LYS HB2 1 1 17 31189 1 1 75 LYS HB3 H 12.092 -6.622 1.709 1.00 . A A . 75 LYS HB3 1 1 17 31190 1 1 75 LYS HD2 H 14.367 -9.075 3.492 1.00 . A A . 75 LYS HD2 1 1 17 31191 1 1 75 LYS HD3 H 14.411 -7.493 2.739 1.00 . A A . 75 LYS HD3 1 1 17 31192 1 1 75 LYS HE2 H 13.333 -6.621 4.964 1.00 . A A . 75 LYS HE2 1 1 17 31193 1 1 75 LYS HE3 H 13.804 -8.166 5.643 1.00 . A A . 75 LYS HE3 1 1 17 31194 1 1 75 LYS HG2 H 11.800 -7.685 3.815 1.00 . A A . 75 LYS HG2 1 1 17 31195 1 1 75 LYS HG3 H 12.121 -9.281 3.167 1.00 . A A . 75 LYS HG3 1 1 17 31196 1 1 75 LYS HZ1 H 15.823 -6.598 4.186 1.00 . A A . 75 LYS HZ1 1 1 17 31197 1 1 75 LYS HZ2 H 15.460 -6.174 5.716 1.00 . A A . 75 LYS HZ2 1 1 17 31198 1 1 75 LYS N N 10.570 -7.682 -0.170 1.00 . A A . 75 LYS N 1 1 17 31199 1 1 75 LYS NZ N 15.422 -6.940 5.052 1.00 . A A . 75 LYS NZ 1 1 17 31200 1 1 75 LYS O O 9.511 -8.997 2.949 1.00 . A A . 75 LYS O 1 1 17 31201 1 1 76 PHE C C 6.398 -7.115 1.729 1.00 . A A . 76 PHE C 1 1 17 31202 1 1 76 PHE CA C 7.666 -6.952 2.570 1.00 . A A . 76 PHE CA 1 1 17 31203 1 1 76 PHE CB C 7.758 -5.505 3.056 1.00 . A A . 76 PHE CB 1 1 17 31204 1 1 76 PHE CD1 C 8.818 -5.859 5.316 1.00 . A A . 76 PHE CD1 1 1 17 31205 1 1 76 PHE CD2 C 9.936 -4.441 3.750 1.00 . A A . 76 PHE CD2 1 1 17 31206 1 1 76 PHE CE1 C 9.868 -5.629 6.275 1.00 . A A . 76 PHE CE1 1 1 17 31207 1 1 76 PHE CE2 C 10.986 -4.211 4.709 1.00 . A A . 76 PHE CE2 1 1 17 31208 1 1 76 PHE CG C 8.874 -5.260 4.074 1.00 . A A . 76 PHE CG 1 1 17 31209 1 1 76 PHE CZ C 10.900 -4.816 5.924 1.00 . A A . 76 PHE CZ 1 1 17 31210 1 1 76 PHE H H 8.995 -6.531 1.022 1.00 . A A . 76 PHE H 1 1 17 31211 1 1 76 PHE HA H 7.656 -7.687 3.375 1.00 . A A . 76 PHE HA 1 1 17 31212 1 1 76 PHE HB2 H 7.916 -4.853 2.197 1.00 . A A . 76 PHE HB2 1 1 17 31213 1 1 76 PHE HB3 H 6.805 -5.220 3.502 1.00 . A A . 76 PHE HB3 1 1 17 31214 1 1 76 PHE HD1 H 7.979 -6.506 5.572 1.00 . A A . 76 PHE HD1 1 1 17 31215 1 1 76 PHE HD2 H 9.981 -3.968 2.769 1.00 . A A . 76 PHE HD2 1 1 17 31216 1 1 76 PHE HE1 H 9.836 -6.096 7.259 1.00 . A A . 76 PHE HE1 1 1 17 31217 1 1 76 PHE HE2 H 11.831 -3.566 4.466 1.00 . A A . 76 PHE HE2 1 1 17 31218 1 1 76 PHE HZ H 11.674 -4.718 6.727 1.00 . A A . 76 PHE HZ 1 1 17 31219 1 1 76 PHE N N 8.856 -7.182 1.768 1.00 . A A . 76 PHE N 1 1 17 31220 1 1 76 PHE O O 6.447 -7.027 0.503 1.00 . A A . 76 PHE O 1 1 17 31221 1 1 77 LYS C C 3.590 -6.203 1.116 1.00 . A A . 77 LYS C 1 1 17 31222 1 1 77 LYS CA C 4.015 -7.527 1.753 1.00 . A A . 77 LYS CA 1 1 17 31223 1 1 77 LYS CB C 2.980 -8.104 2.721 1.00 . A A . 77 LYS CB 1 1 17 31224 1 1 77 LYS CD C 1.919 -10.360 2.343 1.00 . A A . 77 LYS CD 1 1 17 31225 1 1 77 LYS CE C 2.157 -10.882 0.924 1.00 . A A . 77 LYS CE 1 1 17 31226 1 1 77 LYS CG C 3.150 -9.618 2.868 1.00 . A A . 77 LYS CG 1 1 17 31227 1 1 77 LYS H H 5.263 -7.421 3.418 1.00 . A A . 77 LYS H 1 1 17 31228 1 1 77 LYS HA H 4.159 -8.262 0.961 1.00 . A A . 77 LYS HA 1 1 17 31229 1 1 77 LYS HB2 H 3.082 -7.627 3.696 1.00 . A A . 77 LYS HB2 1 1 17 31230 1 1 77 LYS HB3 H 1.976 -7.880 2.361 1.00 . A A . 77 LYS HB3 1 1 17 31231 1 1 77 LYS HD2 H 1.683 -11.193 3.005 1.00 . A A . 77 LYS HD2 1 1 17 31232 1 1 77 LYS HD3 H 1.057 -9.694 2.349 1.00 . A A . 77 LYS HD3 1 1 17 31233 1 1 77 LYS HE2 H 1.798 -10.153 0.198 1.00 . A A . 77 LYS HE2 1 1 17 31234 1 1 77 LYS HE3 H 3.226 -11.005 0.750 1.00 . A A . 77 LYS HE3 1 1 17 31235 1 1 77 LYS HG2 H 4.035 -9.942 2.322 1.00 . A A . 77 LYS HG2 1 1 17 31236 1 1 77 LYS HG3 H 3.311 -9.869 3.916 1.00 . A A . 77 LYS HG3 1 1 17 31237 1 1 77 LYS HZ1 H 2.030 -12.830 0.196 1.00 . A A . 77 LYS HZ1 1 1 17 31238 1 1 77 LYS HZ2 H 1.239 -12.625 1.604 1.00 . A A . 77 LYS HZ2 1 1 17 31239 1 1 77 LYS N N 5.293 -7.351 2.421 1.00 . A A . 77 LYS N 1 1 17 31240 1 1 77 LYS NZ N 1.465 -12.175 0.724 1.00 . A A . 77 LYS NZ 1 1 17 31241 1 1 77 LYS O O 3.526 -5.177 1.791 1.00 . A A . 77 LYS O 1 1 17 31242 1 1 78 SER C C 1.368 -5.033 -0.998 1.00 . A A . 78 SER C 1 1 17 31243 1 1 78 SER CA C 2.895 -5.087 -0.914 1.00 . A A . 78 SER CA 1 1 17 31244 1 1 78 SER CB C 3.504 -5.069 -2.318 1.00 . A A . 78 SER CB 1 1 17 31245 1 1 78 SER H H 3.366 -7.107 -0.720 1.00 . A A . 78 SER H 1 1 17 31246 1 1 78 SER HA H 3.277 -4.241 -0.343 1.00 . A A . 78 SER HA 1 1 17 31247 1 1 78 SER HB2 H 3.545 -4.043 -2.682 1.00 . A A . 78 SER HB2 1 1 17 31248 1 1 78 SER HB3 H 4.531 -5.431 -2.272 1.00 . A A . 78 SER HB3 1 1 17 31249 1 1 78 SER HG H 3.310 -6.060 -4.045 1.00 . A A . 78 SER HG 1 1 17 31250 1 1 78 SER N N 3.312 -6.268 -0.178 1.00 . A A . 78 SER N 1 1 17 31251 1 1 78 SER O O 0.697 -6.047 -0.811 1.00 . A A . 78 SER O 1 1 17 31252 1 1 78 SER OG O 2.760 -5.869 -3.233 1.00 . A A . 78 SER OG 1 1 17 31253 1 1 79 CYS C C -1.139 -4.736 -2.294 1.00 . A A . 79 CYS C 1 1 17 31254 1 1 79 CYS CA C -0.571 -3.642 -1.389 1.00 . A A . 79 CYS CA 1 1 17 31255 1 1 79 CYS CB C -0.910 -2.241 -1.904 1.00 . A A . 79 CYS CB 1 1 17 31256 1 1 79 CYS H H 1.418 -3.021 -1.430 1.00 . A A . 79 CYS H 1 1 17 31257 1 1 79 CYS HA H -0.976 -3.724 -0.381 1.00 . A A . 79 CYS HA 1 1 17 31258 1 1 79 CYS HB2 H -0.572 -2.158 -2.937 1.00 . A A . 79 CYS HB2 1 1 17 31259 1 1 79 CYS HB3 H -1.993 -2.125 -1.913 1.00 . A A . 79 CYS HB3 1 1 17 31260 1 1 79 CYS N N 0.864 -3.841 -1.279 1.00 . A A . 79 CYS N 1 1 17 31261 1 1 79 CYS O O -1.903 -5.587 -1.840 1.00 . A A . 79 CYS O 1 1 17 31262 1 1 79 CYS SG S -0.181 -0.870 -0.936 1.00 . A A . 79 CYS SG 1 1 17 31263 1 1 80 VAL C C -0.700 -7.042 -4.135 1.00 . A A . 80 VAL C 1 1 17 31264 1 1 80 VAL CA C -1.207 -5.654 -4.531 1.00 . A A . 80 VAL CA 1 1 17 31265 1 1 80 VAL CB C -0.771 -5.237 -5.937 1.00 . A A . 80 VAL CB 1 1 17 31266 1 1 80 VAL CG1 C -1.104 -6.325 -6.959 1.00 . A A . 80 VAL CG1 1 1 17 31267 1 1 80 VAL CG2 C -1.402 -3.901 -6.333 1.00 . A A . 80 VAL CG2 1 1 17 31268 1 1 80 VAL H H -0.124 -3.983 -3.919 1.00 . A A . 80 VAL H 1 1 17 31269 1 1 80 VAL HA H -2.296 -5.657 -4.503 1.00 . A A . 80 VAL HA 1 1 17 31270 1 1 80 VAL HB H 0.311 -5.106 -5.927 1.00 . A A . 80 VAL HB 1 1 17 31271 1 1 80 VAL HG11 H -2.027 -6.826 -6.669 1.00 . A A . 80 VAL HG11 1 1 17 31272 1 1 80 VAL HG12 H -1.229 -5.873 -7.943 1.00 . A A . 80 VAL HG12 1 1 17 31273 1 1 80 VAL HG13 H -0.292 -7.052 -6.994 1.00 . A A . 80 VAL HG13 1 1 17 31274 1 1 80 VAL HG21 H -2.323 -3.753 -5.770 1.00 . A A . 80 VAL HG21 1 1 17 31275 1 1 80 VAL HG22 H -0.706 -3.091 -6.112 1.00 . A A . 80 VAL HG22 1 1 17 31276 1 1 80 VAL HG23 H -1.625 -3.907 -7.400 1.00 . A A . 80 VAL HG23 1 1 17 31277 1 1 80 VAL N N -0.746 -4.678 -3.558 1.00 . A A . 80 VAL N 1 1 17 31278 1 1 80 VAL O O -1.409 -8.034 -4.294 1.00 . A A . 80 VAL O 1 1 17 31279 1 1 81 GLY C C 0.196 -9.104 -2.287 1.00 . A A . 81 GLY C 1 1 17 31280 1 1 81 GLY CA C 1.133 -8.317 -3.206 1.00 . A A . 81 GLY CA 1 1 17 31281 1 1 81 GLY H H 1.093 -6.255 -3.499 1.00 . A A . 81 GLY H 1 1 17 31282 1 1 81 GLY HA2 H 1.379 -8.918 -4.081 1.00 . A A . 81 GLY HA2 1 1 17 31283 1 1 81 GLY HA3 H 2.069 -8.113 -2.687 1.00 . A A . 81 GLY HA3 1 1 17 31284 1 1 81 GLY N N 0.523 -7.067 -3.626 1.00 . A A . 81 GLY N 1 1 17 31285 1 1 81 GLY O O -0.172 -10.237 -2.593 1.00 . A A . 81 GLY O 1 1 17 31286 1 1 82 CYS C C -2.406 -9.330 -0.889 1.00 . A A . 82 CYS C 1 1 17 31287 1 1 82 CYS CA C -1.052 -9.097 -0.215 1.00 . A A . 82 CYS CA 1 1 17 31288 1 1 82 CYS CB C -1.185 -8.259 1.058 1.00 . A A . 82 CYS CB 1 1 17 31289 1 1 82 CYS H H 0.138 -7.549 -0.940 1.00 . A A . 82 CYS H 1 1 17 31290 1 1 82 CYS HA H -0.591 -10.044 0.065 1.00 . A A . 82 CYS HA 1 1 17 31291 1 1 82 CYS HB2 H -0.198 -8.047 1.468 1.00 . A A . 82 CYS HB2 1 1 17 31292 1 1 82 CYS HB3 H -1.646 -7.299 0.825 1.00 . A A . 82 CYS HB3 1 1 17 31293 1 1 82 CYS N N -0.165 -8.471 -1.181 1.00 . A A . 82 CYS N 1 1 17 31294 1 1 82 CYS O O -2.987 -10.408 -0.767 1.00 . A A . 82 CYS O 1 1 17 31295 1 1 82 CYS SG S -2.195 -9.155 2.294 1.00 . A A . 82 CYS SG 1 1 17 31296 1 1 83 HIS C C -4.169 -9.626 -3.167 1.00 . A A . 83 HIS C 1 1 17 31297 1 1 83 HIS CA C -4.146 -8.382 -2.277 1.00 . A A . 83 HIS CA 1 1 17 31298 1 1 83 HIS CB C -4.424 -7.093 -3.051 1.00 . A A . 83 HIS CB 1 1 17 31299 1 1 83 HIS CD2 C -4.800 -5.715 -0.862 1.00 . A A . 83 HIS CD2 1 1 17 31300 1 1 83 HIS CE1 C -6.010 -4.103 -1.713 1.00 . A A . 83 HIS CE1 1 1 17 31301 1 1 83 HIS CG C -4.945 -5.963 -2.196 1.00 . A A . 83 HIS CG 1 1 17 31302 1 1 83 HIS H H -2.392 -7.430 -1.679 1.00 . A A . 83 HIS H 1 1 17 31303 1 1 83 HIS HA H -4.913 -8.481 -1.509 1.00 . A A . 83 HIS HA 1 1 17 31304 1 1 83 HIS HB2 H -3.506 -6.770 -3.542 1.00 . A A . 83 HIS HB2 1 1 17 31305 1 1 83 HIS HB3 H -5.149 -7.303 -3.838 1.00 . A A . 83 HIS HB3 1 1 17 31306 1 1 83 HIS HD1 H -5.995 -4.825 -3.658 1.00 . A A . 83 HIS HD1 1 1 17 31307 1 1 83 HIS HD2 H -4.249 -6.335 -0.155 1.00 . A A . 83 HIS HD2 1 1 17 31308 1 1 83 HIS HE1 H -6.604 -3.192 -1.794 1.00 . A A . 83 HIS HE1 1 1 17 31309 1 1 83 HIS N N -2.871 -8.303 -1.584 1.00 . A A . 83 HIS N 1 1 17 31310 1 1 83 HIS ND1 N -5.713 -4.930 -2.704 1.00 . A A . 83 HIS ND1 1 1 17 31311 1 1 83 HIS NE2 N -5.443 -4.591 -0.572 1.00 . A A . 83 HIS NE2 1 1 17 31312 1 1 83 HIS O O -5.156 -10.360 -3.188 1.00 . A A . 83 HIS O 1 1 17 31313 1 1 84 VAL C C -3.160 -12.255 -3.973 1.00 . A A . 84 VAL C 1 1 17 31314 1 1 84 VAL CA C -2.953 -10.966 -4.772 1.00 . A A . 84 VAL CA 1 1 17 31315 1 1 84 VAL CB C -1.608 -10.925 -5.501 1.00 . A A . 84 VAL CB 1 1 17 31316 1 1 84 VAL CG1 C -1.309 -12.266 -6.175 1.00 . A A . 84 VAL CG1 1 1 17 31317 1 1 84 VAL CG2 C -1.569 -9.780 -6.515 1.00 . A A . 84 VAL CG2 1 1 17 31318 1 1 84 VAL H H -2.272 -9.223 -3.858 1.00 . A A . 84 VAL H 1 1 17 31319 1 1 84 VAL HA H -3.744 -10.885 -5.517 1.00 . A A . 84 VAL HA 1 1 17 31320 1 1 84 VAL HB H -0.831 -10.742 -4.759 1.00 . A A . 84 VAL HB 1 1 17 31321 1 1 84 VAL HG11 H -2.119 -12.517 -6.860 1.00 . A A . 84 VAL HG11 1 1 17 31322 1 1 84 VAL HG12 H -0.374 -12.192 -6.730 1.00 . A A . 84 VAL HG12 1 1 17 31323 1 1 84 VAL HG13 H -1.221 -13.042 -5.416 1.00 . A A . 84 VAL HG13 1 1 17 31324 1 1 84 VAL HG21 H -2.165 -8.946 -6.144 1.00 . A A . 84 VAL HG21 1 1 17 31325 1 1 84 VAL HG22 H -0.538 -9.456 -6.657 1.00 . A A . 84 VAL HG22 1 1 17 31326 1 1 84 VAL HG23 H -1.977 -10.123 -7.466 1.00 . A A . 84 VAL HG23 1 1 17 31327 1 1 84 VAL N N -3.070 -9.824 -3.881 1.00 . A A . 84 VAL N 1 1 17 31328 1 1 84 VAL O O -3.764 -13.205 -4.467 1.00 . A A . 84 VAL O 1 1 17 31329 1 1 85 GLU C C -4.198 -13.513 -1.343 1.00 . A A . 85 GLU C 1 1 17 31330 1 1 85 GLU CA C -2.770 -13.400 -1.879 1.00 . A A . 85 GLU CA 1 1 17 31331 1 1 85 GLU CB C -1.758 -13.331 -0.733 1.00 . A A . 85 GLU CB 1 1 17 31332 1 1 85 GLU CD C -0.392 -15.306 0.036 1.00 . A A . 85 GLU CD 1 1 17 31333 1 1 85 GLU CG C -0.541 -14.211 -1.022 1.00 . A A . 85 GLU CG 1 1 17 31334 1 1 85 GLU H H -2.159 -11.466 -2.356 1.00 . A A . 85 GLU H 1 1 17 31335 1 1 85 GLU HA H -2.540 -14.261 -2.506 1.00 . A A . 85 GLU HA 1 1 17 31336 1 1 85 GLU HB2 H -1.439 -12.299 -0.587 1.00 . A A . 85 GLU HB2 1 1 17 31337 1 1 85 GLU HB3 H -2.232 -13.652 0.195 1.00 . A A . 85 GLU HB3 1 1 17 31338 1 1 85 GLU HG2 H -0.641 -14.665 -2.008 1.00 . A A . 85 GLU HG2 1 1 17 31339 1 1 85 GLU HG3 H 0.360 -13.597 -1.044 1.00 . A A . 85 GLU HG3 1 1 17 31340 1 1 85 GLU N N -2.648 -12.244 -2.751 1.00 . A A . 85 GLU N 1 1 17 31341 1 1 85 GLU O O -4.696 -14.616 -1.120 1.00 . A A . 85 GLU O 1 1 17 31342 1 1 85 GLU OE1 O -0.367 -14.941 1.231 1.00 . A A . 85 GLU OE1 1 1 17 31343 1 1 85 GLU OE2 O -0.307 -16.484 -0.374 1.00 . A A . 85 GLU OE2 1 1 17 31344 1 1 86 VAL C C -7.148 -12.690 -1.768 1.00 . A A . 86 VAL C 1 1 17 31345 1 1 86 VAL CA C -6.179 -12.313 -0.646 1.00 . A A . 86 VAL CA 1 1 17 31346 1 1 86 VAL CB C -6.469 -10.936 -0.044 1.00 . A A . 86 VAL CB 1 1 17 31347 1 1 86 VAL CG1 C -7.909 -10.853 0.466 1.00 . A A . 86 VAL CG1 1 1 17 31348 1 1 86 VAL CG2 C -5.473 -10.604 1.069 1.00 . A A . 86 VAL CG2 1 1 17 31349 1 1 86 VAL H H -4.406 -11.465 -1.336 1.00 . A A . 86 VAL H 1 1 17 31350 1 1 86 VAL HA H -6.259 -13.053 0.150 1.00 . A A . 86 VAL HA 1 1 17 31351 1 1 86 VAL HB H -6.350 -10.194 -0.833 1.00 . A A . 86 VAL HB 1 1 17 31352 1 1 86 VAL HG11 H -8.246 -11.845 0.767 1.00 . A A . 86 VAL HG11 1 1 17 31353 1 1 86 VAL HG12 H -7.953 -10.180 1.322 1.00 . A A . 86 VAL HG12 1 1 17 31354 1 1 86 VAL HG13 H -8.554 -10.475 -0.327 1.00 . A A . 86 VAL HG13 1 1 17 31355 1 1 86 VAL HG21 H -4.556 -11.173 0.918 1.00 . A A . 86 VAL HG21 1 1 17 31356 1 1 86 VAL HG22 H -5.246 -9.538 1.047 1.00 . A A . 86 VAL HG22 1 1 17 31357 1 1 86 VAL HG23 H -5.907 -10.863 2.034 1.00 . A A . 86 VAL HG23 1 1 17 31358 1 1 86 VAL N N -4.818 -12.357 -1.152 1.00 . A A . 86 VAL N 1 1 17 31359 1 1 86 VAL O O -7.984 -13.577 -1.599 1.00 . A A . 86 VAL O 1 1 17 31360 1 1 87 ALA C C -7.487 -13.602 -4.656 1.00 . A A . 87 ALA C 1 1 17 31361 1 1 87 ALA CA C -7.856 -12.251 -4.039 1.00 . A A . 87 ALA CA 1 1 17 31362 1 1 87 ALA CB C -7.721 -11.098 -5.036 1.00 . A A . 87 ALA CB 1 1 17 31363 1 1 87 ALA H H -6.320 -11.280 -3.019 1.00 . A A . 87 ALA H 1 1 17 31364 1 1 87 ALA HA H -8.886 -12.291 -3.686 1.00 . A A . 87 ALA HA 1 1 17 31365 1 1 87 ALA HB1 H -7.989 -10.162 -4.548 1.00 . A A . 87 ALA HB1 1 1 17 31366 1 1 87 ALA HB2 H -6.692 -11.042 -5.390 1.00 . A A . 87 ALA HB2 1 1 17 31367 1 1 87 ALA HB3 H -8.387 -11.271 -5.882 1.00 . A A . 87 ALA HB3 1 1 17 31368 1 1 87 ALA N N -7.003 -11.999 -2.889 1.00 . A A . 87 ALA N 1 1 17 31369 1 1 87 ALA O O -8.209 -14.116 -5.509 1.00 . A A . 87 ALA O 1 1 17 31370 1 1 88 GLY C C -7.060 -16.368 -4.965 1.00 . A A . 88 GLY C 1 1 17 31371 1 1 88 GLY CA C -5.891 -15.418 -4.697 1.00 . A A . 88 GLY CA 1 1 17 31372 1 1 88 GLY H H -5.783 -13.713 -3.506 1.00 . A A . 88 GLY H 1 1 17 31373 1 1 88 GLY HA2 H -5.322 -15.269 -5.615 1.00 . A A . 88 GLY HA2 1 1 17 31374 1 1 88 GLY HA3 H -5.213 -15.866 -3.971 1.00 . A A . 88 GLY HA3 1 1 17 31375 1 1 88 GLY N N -6.364 -14.138 -4.200 1.00 . A A . 88 GLY N 1 1 17 31376 1 1 88 GLY O O -7.807 -16.713 -4.050 1.00 . A A . 88 GLY O 1 1 17 31377 1 1 89 ALA C C -9.540 -17.277 -5.902 1.00 . A A . 89 ALA C 1 1 17 31378 1 1 89 ALA CA C -8.248 -17.669 -6.623 1.00 . A A . 89 ALA CA 1 1 17 31379 1 1 89 ALA CB C -7.832 -19.111 -6.330 1.00 . A A . 89 ALA CB 1 1 17 31380 1 1 89 ALA H H -6.570 -16.481 -6.961 1.00 . A A . 89 ALA H 1 1 17 31381 1 1 89 ALA HA H -8.393 -17.556 -7.697 1.00 . A A . 89 ALA HA 1 1 17 31382 1 1 89 ALA HB1 H -6.846 -19.299 -6.757 1.00 . A A . 89 ALA HB1 1 1 17 31383 1 1 89 ALA HB2 H -7.796 -19.267 -5.252 1.00 . A A . 89 ALA HB2 1 1 17 31384 1 1 89 ALA HB3 H -8.556 -19.795 -6.772 1.00 . A A . 89 ALA HB3 1 1 17 31385 1 1 89 ALA N N -7.182 -16.765 -6.223 1.00 . A A . 89 ALA N 1 1 17 31386 1 1 89 ALA O O -9.817 -17.765 -4.808 1.00 . A A . 89 ALA O 1 1 17 31387 1 1 90 ASP C C -12.376 -15.251 -7.071 1.00 . A A . 90 ASP C 1 1 17 31388 1 1 90 ASP CA C -11.551 -15.936 -5.980 1.00 . A A . 90 ASP CA 1 1 17 31389 1 1 90 ASP CB C -11.310 -14.919 -4.862 1.00 . A A . 90 ASP CB 1 1 17 31390 1 1 90 ASP CG C -12.394 -14.874 -3.784 1.00 . A A . 90 ASP CG 1 1 17 31391 1 1 90 ASP H H -10.063 -16.007 -7.436 1.00 . A A . 90 ASP H 1 1 17 31392 1 1 90 ASP HA H -12.036 -16.830 -5.589 1.00 . A A . 90 ASP HA 1 1 17 31393 1 1 90 ASP HB2 H -10.355 -15.144 -4.387 1.00 . A A . 90 ASP HB2 1 1 17 31394 1 1 90 ASP HB3 H -11.219 -13.928 -5.306 1.00 . A A . 90 ASP HB3 1 1 17 31395 1 1 90 ASP N N -10.296 -16.399 -6.546 1.00 . A A . 90 ASP N 1 1 17 31396 1 1 90 ASP O O -13.582 -15.469 -7.171 1.00 . A A . 90 ASP O 1 1 17 31397 1 1 90 ASP OD1 O -13.545 -15.224 -4.122 1.00 . A A . 90 ASP OD1 1 1 17 31398 1 1 90 ASP OD2 O -12.047 -14.490 -2.646 1.00 . A A . 90 ASP OD2 1 1 17 31399 1 1 91 ALA C C -13.140 -12.547 -8.363 1.00 . A A . 91 ALA C 1 1 17 31400 1 1 91 ALA CA C -12.347 -13.720 -8.943 1.00 . A A . 91 ALA CA 1 1 17 31401 1 1 91 ALA CB C -13.230 -14.685 -9.736 1.00 . A A . 91 ALA CB 1 1 17 31402 1 1 91 ALA H H -10.711 -14.266 -7.775 1.00 . A A . 91 ALA H 1 1 17 31403 1 1 91 ALA HA H -11.570 -13.332 -9.602 1.00 . A A . 91 ALA HA 1 1 17 31404 1 1 91 ALA HB1 H -12.799 -15.685 -9.700 1.00 . A A . 91 ALA HB1 1 1 17 31405 1 1 91 ALA HB2 H -14.229 -14.703 -9.302 1.00 . A A . 91 ALA HB2 1 1 17 31406 1 1 91 ALA HB3 H -13.290 -14.353 -10.773 1.00 . A A . 91 ALA HB3 1 1 17 31407 1 1 91 ALA N N -11.692 -14.438 -7.863 1.00 . A A . 91 ALA N 1 1 17 31408 1 1 91 ALA O O -13.689 -12.646 -7.267 1.00 . A A . 91 ALA O 1 1 17 31409 1 1 92 ALA C C -12.989 -9.439 -7.787 1.00 . A A . 92 ALA C 1 1 17 31410 1 1 92 ALA CA C -13.890 -10.272 -8.700 1.00 . A A . 92 ALA CA 1 1 17 31411 1 1 92 ALA CB C -15.197 -10.679 -8.016 1.00 . A A . 92 ALA CB 1 1 17 31412 1 1 92 ALA H H -12.724 -11.391 -10.015 1.00 . A A . 92 ALA H 1 1 17 31413 1 1 92 ALA HA H -14.127 -9.692 -9.592 1.00 . A A . 92 ALA HA 1 1 17 31414 1 1 92 ALA HB1 H -15.499 -11.666 -8.367 1.00 . A A . 92 ALA HB1 1 1 17 31415 1 1 92 ALA HB2 H -15.048 -10.707 -6.936 1.00 . A A . 92 ALA HB2 1 1 17 31416 1 1 92 ALA HB3 H -15.974 -9.954 -8.256 1.00 . A A . 92 ALA HB3 1 1 17 31417 1 1 92 ALA N N -13.174 -11.463 -9.125 1.00 . A A . 92 ALA N 1 1 17 31418 1 1 92 ALA O O -12.857 -8.230 -7.974 1.00 . A A . 92 ALA O 1 1 17 31419 1 1 93 LYS C C -10.192 -9.103 -6.578 1.00 . A A . 93 LYS C 1 1 17 31420 1 1 93 LYS CA C -11.506 -9.454 -5.876 1.00 . A A . 93 LYS CA 1 1 17 31421 1 1 93 LYS CB C -11.323 -10.309 -4.621 1.00 . A A . 93 LYS CB 1 1 17 31422 1 1 93 LYS CD C -12.714 -9.188 -2.841 1.00 . A A . 93 LYS CD 1 1 17 31423 1 1 93 LYS CE C -14.174 -8.821 -2.569 1.00 . A A . 93 LYS CE 1 1 17 31424 1 1 93 LYS CG C -12.617 -10.371 -3.806 1.00 . A A . 93 LYS CG 1 1 17 31425 1 1 93 LYS H H -12.503 -11.100 -6.674 1.00 . A A . 93 LYS H 1 1 17 31426 1 1 93 LYS HA H -11.992 -8.529 -5.568 1.00 . A A . 93 LYS HA 1 1 17 31427 1 1 93 LYS HB2 H -11.018 -11.317 -4.903 1.00 . A A . 93 LYS HB2 1 1 17 31428 1 1 93 LYS HB3 H -10.523 -9.895 -4.008 1.00 . A A . 93 LYS HB3 1 1 17 31429 1 1 93 LYS HD2 H -12.217 -9.438 -1.903 1.00 . A A . 93 LYS HD2 1 1 17 31430 1 1 93 LYS HD3 H -12.191 -8.328 -3.260 1.00 . A A . 93 LYS HD3 1 1 17 31431 1 1 93 LYS HE2 H -14.795 -9.126 -3.411 1.00 . A A . 93 LYS HE2 1 1 17 31432 1 1 93 LYS HE3 H -14.535 -9.363 -1.695 1.00 . A A . 93 LYS HE3 1 1 17 31433 1 1 93 LYS HG2 H -13.475 -10.368 -4.479 1.00 . A A . 93 LYS HG2 1 1 17 31434 1 1 93 LYS HG3 H -12.654 -11.306 -3.247 1.00 . A A . 93 LYS HG3 1 1 17 31435 1 1 93 LYS HZ1 H -14.502 -6.865 -3.208 1.00 . A A . 93 LYS HZ1 1 1 17 31436 1 1 93 LYS HZ2 H -15.064 -7.146 -1.705 1.00 . A A . 93 LYS HZ2 1 1 17 31437 1 1 93 LYS N N -12.391 -10.117 -6.819 1.00 . A A . 93 LYS N 1 1 17 31438 1 1 93 LYS NZ N -14.309 -7.364 -2.346 1.00 . A A . 93 LYS NZ 1 1 17 31439 1 1 93 LYS O O -9.632 -8.031 -6.352 1.00 . A A . 93 LYS O 1 1 17 31440 1 1 94 LYS C C -8.664 -8.638 -9.099 1.00 . A A . 94 LYS C 1 1 17 31441 1 1 94 LYS CA C -8.502 -9.826 -8.149 1.00 . A A . 94 LYS CA 1 1 17 31442 1 1 94 LYS CB C -8.080 -11.120 -8.848 1.00 . A A . 94 LYS CB 1 1 17 31443 1 1 94 LYS CD C -6.378 -12.979 -8.929 1.00 . A A . 94 LYS CD 1 1 17 31444 1 1 94 LYS CE C -6.385 -14.169 -7.967 1.00 . A A . 94 LYS CE 1 1 17 31445 1 1 94 LYS CG C -6.811 -11.696 -8.217 1.00 . A A . 94 LYS CG 1 1 17 31446 1 1 94 LYS H H -10.201 -10.894 -7.592 1.00 . A A . 94 LYS H 1 1 17 31447 1 1 94 LYS HA H -7.726 -9.584 -7.423 1.00 . A A . 94 LYS HA 1 1 17 31448 1 1 94 LYS HB2 H -8.886 -11.851 -8.785 1.00 . A A . 94 LYS HB2 1 1 17 31449 1 1 94 LYS HB3 H -7.908 -10.926 -9.907 1.00 . A A . 94 LYS HB3 1 1 17 31450 1 1 94 LYS HD2 H -7.047 -13.178 -9.766 1.00 . A A . 94 LYS HD2 1 1 17 31451 1 1 94 LYS HD3 H -5.378 -12.848 -9.344 1.00 . A A . 94 LYS HD3 1 1 17 31452 1 1 94 LYS HE2 H -5.652 -14.909 -8.289 1.00 . A A . 94 LYS HE2 1 1 17 31453 1 1 94 LYS HE3 H -6.089 -13.840 -6.971 1.00 . A A . 94 LYS HE3 1 1 17 31454 1 1 94 LYS HG2 H -6.009 -10.959 -8.267 1.00 . A A . 94 LYS HG2 1 1 17 31455 1 1 94 LYS HG3 H -6.988 -11.903 -7.161 1.00 . A A . 94 LYS HG3 1 1 17 31456 1 1 94 LYS HZ1 H -8.103 -14.801 -6.972 1.00 . A A . 94 LYS HZ1 1 1 17 31457 1 1 94 LYS HZ2 H -8.399 -14.283 -8.487 1.00 . A A . 94 LYS HZ2 1 1 17 31458 1 1 94 LYS N N -9.739 -10.025 -7.414 1.00 . A A . 94 LYS N 1 1 17 31459 1 1 94 LYS NZ N -7.730 -14.785 -7.915 1.00 . A A . 94 LYS NZ 1 1 17 31460 1 1 94 LYS O O -7.685 -8.151 -9.663 1.00 . A A . 94 LYS O 1 1 17 31461 1 1 95 LYS C C -10.652 -5.889 -9.274 1.00 . A A . 95 LYS C 1 1 17 31462 1 1 95 LYS CA C -10.210 -7.084 -10.121 1.00 . A A . 95 LYS CA 1 1 17 31463 1 1 95 LYS CB C -11.230 -7.494 -11.186 1.00 . A A . 95 LYS CB 1 1 17 31464 1 1 95 LYS CD C -11.406 -7.949 -13.660 1.00 . A A . 95 LYS CD 1 1 17 31465 1 1 95 LYS CE C -10.383 -8.912 -14.264 1.00 . A A . 95 LYS CE 1 1 17 31466 1 1 95 LYS CG C -10.765 -7.074 -12.581 1.00 . A A . 95 LYS CG 1 1 17 31467 1 1 95 LYS H H -10.698 -8.607 -8.786 1.00 . A A . 95 LYS H 1 1 17 31468 1 1 95 LYS HA H -9.291 -6.818 -10.642 1.00 . A A . 95 LYS HA 1 1 17 31469 1 1 95 LYS HB2 H -11.377 -8.574 -11.158 1.00 . A A . 95 LYS HB2 1 1 17 31470 1 1 95 LYS HB3 H -12.194 -7.036 -10.966 1.00 . A A . 95 LYS HB3 1 1 17 31471 1 1 95 LYS HD2 H -12.233 -8.514 -13.230 1.00 . A A . 95 LYS HD2 1 1 17 31472 1 1 95 LYS HD3 H -11.824 -7.318 -14.444 1.00 . A A . 95 LYS HD3 1 1 17 31473 1 1 95 LYS HE2 H -9.375 -8.599 -13.992 1.00 . A A . 95 LYS HE2 1 1 17 31474 1 1 95 LYS HE3 H -10.527 -9.911 -13.852 1.00 . A A . 95 LYS HE3 1 1 17 31475 1 1 95 LYS HG2 H -11.023 -6.029 -12.755 1.00 . A A . 95 LYS HG2 1 1 17 31476 1 1 95 LYS HG3 H -9.680 -7.148 -12.645 1.00 . A A . 95 LYS HG3 1 1 17 31477 1 1 95 LYS HZ1 H -10.554 -8.024 -16.141 1.00 . A A . 95 LYS HZ1 1 1 17 31478 1 1 95 LYS HZ2 H -9.737 -9.432 -16.176 1.00 . A A . 95 LYS HZ2 1 1 17 31479 1 1 95 LYS N N -9.908 -8.206 -9.248 1.00 . A A . 95 LYS N 1 1 17 31480 1 1 95 LYS NZ N -10.516 -8.953 -15.737 1.00 . A A . 95 LYS NZ 1 1 17 31481 1 1 95 LYS O O -10.842 -4.791 -9.795 1.00 . A A . 95 LYS O 1 1 17 31482 1 1 96 ASP C C -10.178 -4.970 -5.944 1.00 . A A . 96 ASP C 1 1 17 31483 1 1 96 ASP CA C -11.218 -5.102 -7.058 1.00 . A A . 96 ASP CA 1 1 17 31484 1 1 96 ASP CB C -12.562 -5.443 -6.413 1.00 . A A . 96 ASP CB 1 1 17 31485 1 1 96 ASP CG C -13.727 -4.542 -6.829 1.00 . A A . 96 ASP CG 1 1 17 31486 1 1 96 ASP H H -10.645 -7.039 -7.567 1.00 . A A . 96 ASP H 1 1 17 31487 1 1 96 ASP HA H -11.299 -4.198 -7.663 1.00 . A A . 96 ASP HA 1 1 17 31488 1 1 96 ASP HB2 H -12.815 -6.475 -6.659 1.00 . A A . 96 ASP HB2 1 1 17 31489 1 1 96 ASP HB3 H -12.452 -5.392 -5.330 1.00 . A A . 96 ASP HB3 1 1 17 31490 1 1 96 ASP N N -10.802 -6.143 -7.983 1.00 . A A . 96 ASP N 1 1 17 31491 1 1 96 ASP O O -10.373 -4.211 -4.995 1.00 . A A . 96 ASP O 1 1 17 31492 1 1 96 ASP OD1 O -13.699 -4.078 -7.989 1.00 . A A . 96 ASP OD1 1 1 17 31493 1 1 96 ASP OD2 O -14.619 -4.338 -5.977 1.00 . A A . 96 ASP OD2 1 1 17 31494 1 1 97 LEU C C -6.696 -5.431 -5.821 1.00 . A A . 97 LEU C 1 1 17 31495 1 1 97 LEU CA C -8.026 -5.696 -5.113 1.00 . A A . 97 LEU CA 1 1 17 31496 1 1 97 LEU CB C -8.034 -6.980 -4.281 1.00 . A A . 97 LEU CB 1 1 17 31497 1 1 97 LEU CD1 C -9.009 -8.343 -2.397 1.00 . A A . 97 LEU CD1 1 1 17 31498 1 1 97 LEU CD2 C -9.554 -5.874 -2.600 1.00 . A A . 97 LEU CD2 1 1 17 31499 1 1 97 LEU CG C -9.234 -7.169 -3.350 1.00 . A A . 97 LEU CG 1 1 17 31500 1 1 97 LEU H H -8.946 -6.334 -6.870 1.00 . A A . 97 LEU H 1 1 17 31501 1 1 97 LEU HA H -8.226 -4.869 -4.432 1.00 . A A . 97 LEU HA 1 1 17 31502 1 1 97 LEU HB2 H -7.990 -7.831 -4.961 1.00 . A A . 97 LEU HB2 1 1 17 31503 1 1 97 LEU HB3 H -7.126 -7.006 -3.680 1.00 . A A . 97 LEU HB3 1 1 17 31504 1 1 97 LEU HD11 H -8.802 -9.245 -2.973 1.00 . A A . 97 LEU HD11 1 1 17 31505 1 1 97 LEU HD12 H -8.162 -8.126 -1.746 1.00 . A A . 97 LEU HD12 1 1 17 31506 1 1 97 LEU HD13 H -9.903 -8.496 -1.791 1.00 . A A . 97 LEU HD13 1 1 17 31507 1 1 97 LEU HD21 H -8.658 -5.258 -2.540 1.00 . A A . 97 LEU HD21 1 1 17 31508 1 1 97 LEU HD22 H -10.335 -5.330 -3.132 1.00 . A A . 97 LEU HD22 1 1 17 31509 1 1 97 LEU HD23 H -9.899 -6.113 -1.594 1.00 . A A . 97 LEU HD23 1 1 17 31510 1 1 97 LEU HG H -10.105 -7.411 -3.960 1.00 . A A . 97 LEU HG 1 1 17 31511 1 1 97 LEU N N -9.097 -5.720 -6.095 1.00 . A A . 97 LEU N 1 1 17 31512 1 1 97 LEU O O -5.925 -4.570 -5.400 1.00 . A A . 97 LEU O 1 1 17 31513 1 1 98 THR C C -5.550 -5.483 -9.045 1.00 . A A . 98 THR C 1 1 17 31514 1 1 98 THR CA C -5.243 -6.045 -7.655 1.00 . A A . 98 THR CA 1 1 17 31515 1 1 98 THR CB C -4.546 -7.406 -7.690 1.00 . A A . 98 THR CB 1 1 17 31516 1 1 98 THR CG2 C -4.667 -8.161 -6.365 1.00 . A A . 98 THR CG2 1 1 17 31517 1 1 98 THR H H -7.099 -6.886 -7.221 1.00 . A A . 98 THR H 1 1 17 31518 1 1 98 THR HA H -4.603 -5.321 -7.152 1.00 . A A . 98 THR HA 1 1 17 31519 1 1 98 THR HB H -3.501 -7.301 -7.984 1.00 . A A . 98 THR HB 1 1 17 31520 1 1 98 THR HG1 H -6.237 -8.338 -8.215 1.00 . A A . 98 THR HG1 1 1 17 31521 1 1 98 THR HG21 H -5.717 -8.232 -6.082 1.00 . A A . 98 THR HG21 1 1 17 31522 1 1 98 THR HG22 H -4.253 -9.163 -6.478 1.00 . A A . 98 THR HG22 1 1 17 31523 1 1 98 THR HG23 H -4.117 -7.626 -5.590 1.00 . A A . 98 THR HG23 1 1 17 31524 1 1 98 THR N N -6.467 -6.187 -6.885 1.00 . A A . 98 THR N 1 1 17 31525 1 1 98 THR O O -4.659 -5.377 -9.886 1.00 . A A . 98 THR O 1 1 17 31526 1 1 98 THR OG1 O -5.329 -8.175 -8.600 1.00 . A A . 98 THR OG1 1 1 17 31527 1 1 99 GLY C C -6.451 -3.337 -10.876 1.00 . A A . 99 GLY C 1 1 17 31528 1 1 99 GLY CA C -7.249 -4.592 -10.517 1.00 . A A . 99 GLY CA 1 1 17 31529 1 1 99 GLY H H -7.533 -5.229 -8.554 1.00 . A A . 99 GLY H 1 1 17 31530 1 1 99 GLY HA2 H -7.128 -5.341 -11.299 1.00 . A A . 99 GLY HA2 1 1 17 31531 1 1 99 GLY HA3 H -8.311 -4.350 -10.469 1.00 . A A . 99 GLY HA3 1 1 17 31532 1 1 99 GLY N N -6.814 -5.139 -9.243 1.00 . A A . 99 GLY N 1 1 17 31533 1 1 99 GLY O O -6.021 -2.597 -9.992 1.00 . A A . 99 GLY O 1 1 17 31534 1 1 100 CYS C C -6.509 -0.808 -12.785 1.00 . A A . 100 CYS C 1 1 17 31535 1 1 100 CYS CA C -5.538 -1.984 -12.660 1.00 . A A . 100 CYS CA 1 1 17 31536 1 1 100 CYS CB C -4.831 -2.283 -13.984 1.00 . A A . 100 CYS CB 1 1 17 31537 1 1 100 CYS H H -6.631 -3.743 -12.886 1.00 . A A . 100 CYS H 1 1 17 31538 1 1 100 CYS HA H -4.766 -1.772 -11.921 1.00 . A A . 100 CYS HA 1 1 17 31539 1 1 100 CYS HB2 H -5.434 -2.994 -14.549 1.00 . A A . 100 CYS HB2 1 1 17 31540 1 1 100 CYS HB3 H -4.786 -1.366 -14.571 1.00 . A A . 100 CYS HB3 1 1 17 31541 1 1 100 CYS N N -6.277 -3.136 -12.174 1.00 . A A . 100 CYS N 1 1 17 31542 1 1 100 CYS O O -6.290 0.248 -12.192 1.00 . A A . 100 CYS O 1 1 17 31543 1 1 100 CYS SG S -3.137 -2.954 -13.815 1.00 . A A . 100 CYS SG 1 1 17 31544 1 1 101 LYS C C -9.938 -0.546 -13.372 1.00 . A A . 101 LYS C 1 1 17 31545 1 1 101 LYS CA C -8.565 -0.001 -13.770 1.00 . A A . 101 LYS CA 1 1 17 31546 1 1 101 LYS CB C -8.504 0.522 -15.206 1.00 . A A . 101 LYS CB 1 1 17 31547 1 1 101 LYS CD C -10.903 0.876 -15.899 1.00 . A A . 101 LYS CD 1 1 17 31548 1 1 101 LYS CE C -11.395 1.443 -17.232 1.00 . A A . 101 LYS CE 1 1 17 31549 1 1 101 LYS CG C -9.604 1.555 -15.461 1.00 . A A . 101 LYS CG 1 1 17 31550 1 1 101 LYS H H -7.731 -1.891 -14.038 1.00 . A A . 101 LYS H 1 1 17 31551 1 1 101 LYS HA H -8.321 0.834 -13.112 1.00 . A A . 101 LYS HA 1 1 17 31552 1 1 101 LYS HB2 H -7.528 0.971 -15.393 1.00 . A A . 101 LYS HB2 1 1 17 31553 1 1 101 LYS HB3 H -8.611 -0.308 -15.904 1.00 . A A . 101 LYS HB3 1 1 17 31554 1 1 101 LYS HD2 H -10.742 -0.198 -15.994 1.00 . A A . 101 LYS HD2 1 1 17 31555 1 1 101 LYS HD3 H -11.667 1.017 -15.135 1.00 . A A . 101 LYS HD3 1 1 17 31556 1 1 101 LYS HE2 H -12.473 1.302 -17.318 1.00 . A A . 101 LYS HE2 1 1 17 31557 1 1 101 LYS HE3 H -11.211 2.517 -17.267 1.00 . A A . 101 LYS HE3 1 1 17 31558 1 1 101 LYS HG2 H -9.780 2.135 -14.555 1.00 . A A . 101 LYS HG2 1 1 17 31559 1 1 101 LYS HG3 H -9.278 2.256 -16.229 1.00 . A A . 101 LYS HG3 1 1 17 31560 1 1 101 LYS HZ1 H -9.953 1.344 -18.733 1.00 . A A . 101 LYS HZ1 1 1 17 31561 1 1 101 LYS HZ2 H -10.307 -0.111 -18.093 1.00 . A A . 101 LYS HZ2 1 1 17 31562 1 1 101 LYS N N -7.560 -1.029 -13.560 1.00 . A A . 101 LYS N 1 1 17 31563 1 1 101 LYS NZ N -10.710 0.779 -18.363 1.00 . A A . 101 LYS NZ 1 1 17 31564 1 1 101 LYS O O -10.247 -1.708 -13.631 1.00 . A A . 101 LYS O 1 1 17 31565 1 1 102 LYS C C -11.947 -0.982 -11.095 1.00 . A A . 102 LYS C 1 1 17 31566 1 1 102 LYS CA C -12.057 -0.062 -12.312 1.00 . A A . 102 LYS CA 1 1 17 31567 1 1 102 LYS CB C -12.848 -0.669 -13.472 1.00 . A A . 102 LYS CB 1 1 17 31568 1 1 102 LYS CD C -14.503 -0.150 -15.304 1.00 . A A . 102 LYS CD 1 1 17 31569 1 1 102 LYS CE C -15.650 0.761 -15.743 1.00 . A A . 102 LYS CE 1 1 17 31570 1 1 102 LYS CG C -13.946 0.286 -13.947 1.00 . A A . 102 LYS CG 1 1 17 31571 1 1 102 LYS H H -10.466 1.262 -12.542 1.00 . A A . 102 LYS H 1 1 17 31572 1 1 102 LYS HA H -12.575 0.849 -12.011 1.00 . A A . 102 LYS HA 1 1 17 31573 1 1 102 LYS HB2 H -12.175 -0.894 -14.299 1.00 . A A . 102 LYS HB2 1 1 17 31574 1 1 102 LYS HB3 H -13.294 -1.613 -13.159 1.00 . A A . 102 LYS HB3 1 1 17 31575 1 1 102 LYS HD2 H -13.710 -0.129 -16.051 1.00 . A A . 102 LYS HD2 1 1 17 31576 1 1 102 LYS HD3 H -14.855 -1.180 -15.242 1.00 . A A . 102 LYS HD3 1 1 17 31577 1 1 102 LYS HE2 H -16.098 1.239 -14.872 1.00 . A A . 102 LYS HE2 1 1 17 31578 1 1 102 LYS HE3 H -15.266 1.557 -16.381 1.00 . A A . 102 LYS HE3 1 1 17 31579 1 1 102 LYS HG2 H -14.750 0.315 -13.212 1.00 . A A . 102 LYS HG2 1 1 17 31580 1 1 102 LYS HG3 H -13.545 1.297 -14.022 1.00 . A A . 102 LYS HG3 1 1 17 31581 1 1 102 LYS HZ1 H -17.249 -0.572 -15.847 1.00 . A A . 102 LYS HZ1 1 1 17 31582 1 1 102 LYS HZ2 H -17.310 0.585 -16.992 1.00 . A A . 102 LYS HZ2 1 1 17 31583 1 1 102 LYS N N -10.725 0.319 -12.749 1.00 . A A . 102 LYS N 1 1 17 31584 1 1 102 LYS NZ N -16.678 -0.015 -16.473 1.00 . A A . 102 LYS NZ 1 1 17 31585 1 1 102 LYS O O -12.683 -1.961 -10.983 1.00 . A A . 102 LYS O 1 1 17 31586 1 1 103 SER C C -11.095 -0.566 -7.771 1.00 . A A . 103 SER C 1 1 17 31587 1 1 103 SER CA C -10.805 -1.418 -9.008 1.00 . A A . 103 SER CA 1 1 17 31588 1 1 103 SER CB C -9.376 -1.962 -8.954 1.00 . A A . 103 SER CB 1 1 17 31589 1 1 103 SER H H -10.427 0.163 -10.310 1.00 . A A . 103 SER H 1 1 17 31590 1 1 103 SER HA H -11.507 -2.249 -9.074 1.00 . A A . 103 SER HA 1 1 17 31591 1 1 103 SER HB2 H -9.029 -1.968 -7.920 1.00 . A A . 103 SER HB2 1 1 17 31592 1 1 103 SER HB3 H -9.368 -2.996 -9.298 1.00 . A A . 103 SER HB3 1 1 17 31593 1 1 103 SER HG H -8.545 -0.225 -9.499 1.00 . A A . 103 SER HG 1 1 17 31594 1 1 103 SER N N -11.021 -0.635 -10.213 1.00 . A A . 103 SER N 1 1 17 31595 1 1 103 SER O O -11.560 0.567 -7.888 1.00 . A A . 103 SER O 1 1 17 31596 1 1 103 SER OG O -8.480 -1.191 -9.750 1.00 . A A . 103 SER OG 1 1 17 31597 1 1 104 LYS C C -9.952 0.610 -5.162 1.00 . A A . 104 LYS C 1 1 17 31598 1 1 104 LYS CA C -11.035 -0.452 -5.356 1.00 . A A . 104 LYS CA 1 1 17 31599 1 1 104 LYS CB C -11.128 -1.453 -4.202 1.00 . A A . 104 LYS CB 1 1 17 31600 1 1 104 LYS CD C -13.542 -1.733 -3.527 1.00 . A A . 104 LYS CD 1 1 17 31601 1 1 104 LYS CE C -14.255 -2.818 -2.717 1.00 . A A . 104 LYS CE 1 1 17 31602 1 1 104 LYS CG C -12.381 -2.323 -4.330 1.00 . A A . 104 LYS CG 1 1 17 31603 1 1 104 LYS H H -10.432 -2.066 -6.527 1.00 . A A . 104 LYS H 1 1 17 31604 1 1 104 LYS HA H -12.001 0.048 -5.427 1.00 . A A . 104 LYS HA 1 1 17 31605 1 1 104 LYS HB2 H -10.241 -2.086 -4.193 1.00 . A A . 104 LYS HB2 1 1 17 31606 1 1 104 LYS HB3 H -11.148 -0.919 -3.253 1.00 . A A . 104 LYS HB3 1 1 17 31607 1 1 104 LYS HD2 H -13.168 -0.960 -2.855 1.00 . A A . 104 LYS HD2 1 1 17 31608 1 1 104 LYS HD3 H -14.250 -1.254 -4.202 1.00 . A A . 104 LYS HD3 1 1 17 31609 1 1 104 LYS HE2 H -13.521 -3.434 -2.198 1.00 . A A . 104 LYS HE2 1 1 17 31610 1 1 104 LYS HE3 H -14.882 -2.358 -1.954 1.00 . A A . 104 LYS HE3 1 1 17 31611 1 1 104 LYS HG2 H -12.665 -2.405 -5.379 1.00 . A A . 104 LYS HG2 1 1 17 31612 1 1 104 LYS HG3 H -12.165 -3.331 -3.978 1.00 . A A . 104 LYS HG3 1 1 17 31613 1 1 104 LYS HZ1 H -14.956 -3.431 -4.582 1.00 . A A . 104 LYS HZ1 1 1 17 31614 1 1 104 LYS HZ2 H -14.862 -4.649 -3.506 1.00 . A A . 104 LYS HZ2 1 1 17 31615 1 1 104 LYS N N -10.810 -1.144 -6.613 1.00 . A A . 104 LYS N 1 1 17 31616 1 1 104 LYS NZ N -15.084 -3.665 -3.604 1.00 . A A . 104 LYS NZ 1 1 17 31617 1 1 104 LYS O O -10.190 1.637 -4.528 1.00 . A A . 104 LYS O 1 1 17 31618 1 1 105 CYS C C -7.817 2.316 -6.697 1.00 . A A . 105 CYS C 1 1 17 31619 1 1 105 CYS CA C -7.662 1.245 -5.615 1.00 . A A . 105 CYS CA 1 1 17 31620 1 1 105 CYS CB C -6.322 0.516 -5.721 1.00 . A A . 105 CYS CB 1 1 17 31621 1 1 105 CYS H H -8.598 -0.510 -6.233 1.00 . A A . 105 CYS H 1 1 17 31622 1 1 105 CYS HA H -7.713 1.690 -4.621 1.00 . A A . 105 CYS HA 1 1 17 31623 1 1 105 CYS HB2 H -6.247 0.013 -6.686 1.00 . A A . 105 CYS HB2 1 1 17 31624 1 1 105 CYS HB3 H -5.503 1.233 -5.672 1.00 . A A . 105 CYS HB3 1 1 17 31625 1 1 105 CYS N N -8.783 0.327 -5.719 1.00 . A A . 105 CYS N 1 1 17 31626 1 1 105 CYS O O -8.003 3.492 -6.389 1.00 . A A . 105 CYS O 1 1 17 31627 1 1 105 CYS SG S -6.165 -0.705 -4.367 1.00 . A A . 105 CYS SG 1 1 17 31628 1 1 106 HIS C C -9.272 2.677 -9.651 1.00 . A A . 106 HIS C 1 1 17 31629 1 1 106 HIS CA C -7.860 2.776 -9.071 1.00 . A A . 106 HIS CA 1 1 17 31630 1 1 106 HIS CB C -6.771 2.504 -10.111 1.00 . A A . 106 HIS CB 1 1 17 31631 1 1 106 HIS CD2 C -4.302 1.851 -9.555 1.00 . A A . 106 HIS CD2 1 1 17 31632 1 1 106 HIS CE1 C -3.664 3.756 -8.689 1.00 . A A . 106 HIS CE1 1 1 17 31633 1 1 106 HIS CG C -5.366 2.704 -9.596 1.00 . A A . 106 HIS CG 1 1 17 31634 1 1 106 HIS H H -7.581 0.912 -8.184 1.00 . A A . 106 HIS H 1 1 17 31635 1 1 106 HIS HA H -7.705 3.783 -8.684 1.00 . A A . 106 HIS HA 1 1 17 31636 1 1 106 HIS HB2 H -6.874 1.480 -10.470 1.00 . A A . 106 HIS HB2 1 1 17 31637 1 1 106 HIS HB3 H -6.930 3.159 -10.968 1.00 . A A . 106 HIS HB3 1 1 17 31638 1 1 106 HIS HD1 H -5.484 4.723 -8.929 1.00 . A A . 106 HIS HD1 1 1 17 31639 1 1 106 HIS HD2 H -4.297 0.821 -9.911 1.00 . A A . 106 HIS HD2 1 1 17 31640 1 1 106 HIS HE1 H -3.040 4.520 -8.224 1.00 . A A . 106 HIS HE1 1 1 17 31641 1 1 106 HIS N N -7.733 1.871 -7.942 1.00 . A A . 106 HIS N 1 1 17 31642 1 1 106 HIS ND1 N -4.933 3.896 -9.042 1.00 . A A . 106 HIS ND1 1 1 17 31643 1 1 106 HIS NE2 N -3.275 2.488 -9.007 1.00 . A A . 106 HIS NE2 1 1 17 31644 1 1 106 HIS O O -9.819 1.583 -9.780 1.00 . A A . 106 HIS O 1 1 17 31645 1 1 107 GLU C C -11.151 4.681 -11.861 1.00 . A A . 107 GLU C 1 1 17 31646 1 1 107 GLU CA C -11.160 3.893 -10.550 1.00 . A A . 107 GLU CA 1 1 17 31647 1 1 107 GLU CB C -12.149 4.499 -9.552 1.00 . A A . 107 GLU CB 1 1 17 31648 1 1 107 GLU CD C -13.557 3.994 -7.522 1.00 . A A . 107 GLU CD 1 1 17 31649 1 1 107 GLU CG C -12.323 3.593 -8.332 1.00 . A A . 107 GLU CG 1 1 17 31650 1 1 107 GLU H H -9.370 4.721 -9.879 1.00 . A A . 107 GLU H 1 1 17 31651 1 1 107 GLU HA H -11.438 2.857 -10.743 1.00 . A A . 107 GLU HA 1 1 17 31652 1 1 107 GLU HB2 H -11.795 5.480 -9.234 1.00 . A A . 107 GLU HB2 1 1 17 31653 1 1 107 GLU HB3 H -13.114 4.651 -10.037 1.00 . A A . 107 GLU HB3 1 1 17 31654 1 1 107 GLU HG2 H -12.416 2.556 -8.655 1.00 . A A . 107 GLU HG2 1 1 17 31655 1 1 107 GLU HG3 H -11.435 3.652 -7.702 1.00 . A A . 107 GLU HG3 1 1 17 31656 1 1 107 GLU N N -9.822 3.835 -9.986 1.00 . A A . 107 GLU N 1 1 17 31657 1 1 107 GLU O O -10.255 4.510 -12.686 1.00 . A A . 107 GLU O 1 1 17 31658 1 1 107 GLU OXT O -12.085 5.492 -12.042 1.00 . A A . 107 GLU OXT 1 1 17 31659 1 1 107 GLU OE1 O -13.485 5.054 -6.865 1.00 . A A . 107 GLU OE1 1 1 17 31660 1 1 107 GLU OE2 O -14.546 3.230 -7.579 1.00 . A A . 107 GLU OE2 1 1 17 31661 2 2 1 HEC C1A C -1.195 5.391 9.215 1.00 . B A . 108 HEC C1A 1 1 17 31662 2 2 1 HEC C1B C -2.107 2.221 12.005 1.00 . B A . 108 HEC C1B 1 1 17 31663 2 2 1 HEC C1C C -2.264 -0.613 8.700 1.00 . B A . 108 HEC C1C 1 1 17 31664 2 2 1 HEC C1D C -1.122 2.536 5.970 1.00 . B A . 108 HEC C1D 1 1 17 31665 2 2 1 HEC C2A C -1.115 6.456 10.187 1.00 . B A . 108 HEC C2A 1 1 17 31666 2 2 1 HEC C2B C -2.539 1.311 13.040 1.00 . B A . 108 HEC C2B 1 1 17 31667 2 2 1 HEC C2C C -2.313 -1.676 7.724 1.00 . B A . 108 HEC C2C 1 1 17 31668 2 2 1 HEC C2D C -0.693 3.459 4.946 1.00 . B A . 108 HEC C2D 1 1 17 31669 2 2 1 HEC C3A C -1.344 5.906 11.398 1.00 . B A . 108 HEC C3A 1 1 17 31670 2 2 1 HEC C3B C -2.693 0.100 12.464 1.00 . B A . 108 HEC C3B 1 1 17 31671 2 2 1 HEC C3C C -1.974 -1.138 6.534 1.00 . B A . 108 HEC C3C 1 1 17 31672 2 2 1 HEC C3D C -0.605 4.677 5.521 1.00 . B A . 108 HEC C3D 1 1 17 31673 2 2 1 HEC C4A C -1.568 4.495 11.188 1.00 . B A . 108 HEC C4A 1 1 17 31674 2 2 1 HEC C4B C -2.359 0.248 11.067 1.00 . B A . 108 HEC C4B 1 1 17 31675 2 2 1 HEC C4C C -1.712 0.264 6.761 1.00 . B A . 108 HEC C4C 1 1 17 31676 2 2 1 HEC C4D C -0.979 4.520 6.907 1.00 . B A . 108 HEC C4D 1 1 17 31677 2 2 1 HEC CAA C -0.829 7.894 9.864 1.00 . B A . 108 HEC CAA 1 1 17 31678 2 2 1 HEC CAB C -3.127 -1.183 13.112 1.00 . B A . 108 HEC CAB 1 1 17 31679 2 2 1 HEC CAC C -1.875 -1.825 5.203 1.00 . B A . 108 HEC CAC 1 1 17 31680 2 2 1 HEC CAD C -0.202 5.973 4.882 1.00 . B A . 108 HEC CAD 1 1 17 31681 2 2 1 HEC CBA C 0.449 8.431 10.501 1.00 . B A . 108 HEC CBA 1 1 17 31682 2 2 1 HEC CBB C -4.394 -1.056 13.954 1.00 . B A . 108 HEC CBB 1 1 17 31683 2 2 1 HEC CBC C -2.888 -2.951 5.010 1.00 . B A . 108 HEC CBC 1 1 17 31684 2 2 1 HEC CBD C -0.800 6.195 3.496 1.00 . B A . 108 HEC CBD 1 1 17 31685 2 2 1 HEC CGA C 0.249 9.846 11.023 1.00 . B A . 108 HEC CGA 1 1 17 31686 2 2 1 HEC CGD C 0.277 6.568 2.487 1.00 . B A . 108 HEC CGD 1 1 17 31687 2 2 1 HEC CHA C -1.014 5.566 7.847 1.00 . B A . 108 HEC CHA 1 1 17 31688 2 2 1 HEC CHB C -1.841 3.570 12.212 1.00 . B A . 108 HEC CHB 1 1 17 31689 2 2 1 HEC CHC C -2.396 -0.795 10.123 1.00 . B A . 108 HEC CHC 1 1 17 31690 2 2 1 HEC CHD C -1.327 1.176 5.761 1.00 . B A . 108 HEC CHD 1 1 17 31691 2 2 1 HEC CMA C -1.372 6.591 12.733 1.00 . B A . 108 HEC CMA 1 1 17 31692 2 2 1 HEC CMB C -2.761 1.686 14.476 1.00 . B A . 108 HEC CMB 1 1 17 31693 2 2 1 HEC CMC C -2.678 -3.101 8.024 1.00 . B A . 108 HEC CMC 1 1 17 31694 2 2 1 HEC CMD C -0.410 3.088 3.519 1.00 . B A . 108 HEC CMD 1 1 17 31695 2 2 1 HEC FE FE -1.665 2.380 8.977 1.00 . B A . 108 HEC FE 1 1 17 31696 2 2 1 HEC HAA1 H -0.725 8.010 8.785 1.00 . B A . 108 HEC HAA1 1 1 17 31697 2 2 1 HEC HAA2 H -1.651 8.516 10.218 1.00 . B A . 108 HEC HAA2 1 1 17 31698 2 2 1 HEC HAB H -3.326 -1.929 12.343 1.00 . B A . 108 HEC HAB 1 1 17 31699 2 2 1 HEC HAC H -2.044 -1.101 4.406 1.00 . B A . 108 HEC HAC 1 1 17 31700 2 2 1 HEC HAD1 H -0.526 6.804 5.509 1.00 . B A . 108 HEC HAD1 1 1 17 31701 2 2 1 HEC HAD2 H 0.882 6.003 4.773 1.00 . B A . 108 HEC HAD2 1 1 17 31702 2 2 1 HEC HBA1 H 0.737 7.790 11.334 1.00 . B A . 108 HEC HBA1 1 1 17 31703 2 2 1 HEC HBA2 H 1.247 8.443 9.759 1.00 . B A . 108 HEC HBA2 1 1 17 31704 2 2 1 HEC HBB1 H -4.234 -1.526 14.924 1.00 . B A . 108 HEC HBB1 1 1 17 31705 2 2 1 HEC HBB2 H -4.631 -0.001 14.096 1.00 . B A . 108 HEC HBB2 1 1 17 31706 2 2 1 HEC HBB3 H -5.221 -1.549 13.443 1.00 . B A . 108 HEC HBB3 1 1 17 31707 2 2 1 HEC HBC1 H -3.062 -3.103 3.945 1.00 . B A . 108 HEC HBC1 1 1 17 31708 2 2 1 HEC HBC2 H -2.498 -3.869 5.449 1.00 . B A . 108 HEC HBC2 1 1 17 31709 2 2 1 HEC HBC3 H -3.825 -2.684 5.497 1.00 . B A . 108 HEC HBC3 1 1 17 31710 2 2 1 HEC HBD1 H -1.289 5.280 3.160 1.00 . B A . 108 HEC HBD1 1 1 17 31711 2 2 1 HEC HBD2 H -1.531 7.002 3.540 1.00 . B A . 108 HEC HBD2 1 1 17 31712 2 2 1 HEC HHA H -0.891 6.582 7.473 1.00 . B A . 108 HEC HHA 1 1 17 31713 2 2 1 HEC HHB H -1.844 3.941 13.237 1.00 . B A . 108 HEC HHB 1 1 17 31714 2 2 1 HEC HHC H -2.606 -1.799 10.491 1.00 . B A . 108 HEC HHC 1 1 17 31715 2 2 1 HEC HHD H -1.181 0.785 4.754 1.00 . B A . 108 HEC HHD 1 1 17 31716 2 2 1 HEC HMA1 H -1.226 5.854 13.523 1.00 . B A . 108 HEC HMA1 1 1 17 31717 2 2 1 HEC HMA2 H -0.575 7.333 12.778 1.00 . B A . 108 HEC HMA2 1 1 17 31718 2 2 1 HEC HMA3 H -2.335 7.083 12.870 1.00 . B A . 108 HEC HMA3 1 1 17 31719 2 2 1 HEC HMB1 H -2.303 0.937 15.123 1.00 . B A . 108 HEC HMB1 1 1 17 31720 2 2 1 HEC HMB2 H -2.309 2.659 14.671 1.00 . B A . 108 HEC HMB2 1 1 17 31721 2 2 1 HEC HMB3 H -3.831 1.735 14.678 1.00 . B A . 108 HEC HMB3 1 1 17 31722 2 2 1 HEC HMC1 H -1.786 -3.724 7.966 1.00 . B A . 108 HEC HMC1 1 1 17 31723 2 2 1 HEC HMC2 H -3.102 -3.164 9.026 1.00 . B A . 108 HEC HMC2 1 1 17 31724 2 2 1 HEC HMC3 H -3.412 -3.448 7.297 1.00 . B A . 108 HEC HMC3 1 1 17 31725 2 2 1 HEC HMD1 H 0.184 2.174 3.493 1.00 . B A . 108 HEC HMD1 1 1 17 31726 2 2 1 HEC HMD2 H -1.350 2.926 2.992 1.00 . B A . 108 HEC HMD2 1 1 17 31727 2 2 1 HEC HMD3 H 0.142 3.894 3.037 1.00 . B A . 108 HEC HMD3 1 1 17 31728 2 2 1 HEC NA N -1.473 4.189 9.842 1.00 . B A . 108 HEC NA 1 1 17 31729 2 2 1 HEC NB N -2.000 1.556 10.796 1.00 . B A . 108 HEC NB 1 1 17 31730 2 2 1 HEC NC N -1.893 0.576 8.097 1.00 . B A . 108 HEC NC 1 1 17 31731 2 2 1 HEC ND N -1.295 3.199 7.173 1.00 . B A . 108 HEC ND 1 1 17 31732 2 2 1 HEC O1A O -0.442 10.617 10.322 1.00 . B A . 108 HEC O1A 1 1 17 31733 2 2 1 HEC O1D O 0.380 7.778 2.189 1.00 . B A . 108 HEC O1D 1 1 17 31734 2 2 1 HEC O2A O 0.790 10.132 12.113 1.00 . B A . 108 HEC O2A 1 1 17 31735 2 2 1 HEC O2D O 0.977 5.638 2.033 1.00 . B A . 108 HEC O2D 1 1 17 31736 3 2 1 HEC C1A C 9.648 -1.708 1.715 1.00 . C A . 109 HEC C1A 1 1 17 31737 3 2 1 HEC C1B C 5.781 -0.038 2.686 1.00 . C A . 109 HEC C1B 1 1 17 31738 3 2 1 HEC C1C C 7.756 3.020 5.121 1.00 . C A . 109 HEC C1C 1 1 17 31739 3 2 1 HEC C1D C 11.598 1.503 3.852 1.00 . C A . 109 HEC C1D 1 1 17 31740 3 2 1 HEC C2A C 9.163 -2.792 0.893 1.00 . C A . 109 HEC C2A 1 1 17 31741 3 2 1 HEC C2B C 4.419 0.316 3.007 1.00 . C A . 109 HEC C2B 1 1 17 31742 3 2 1 HEC C2C C 8.255 4.171 5.837 1.00 . C A . 109 HEC C2C 1 1 17 31743 3 2 1 HEC C2D C 12.954 1.096 3.567 1.00 . C A . 109 HEC C2D 1 1 17 31744 3 2 1 HEC C3A C 7.818 -2.684 0.847 1.00 . C A . 109 HEC C3A 1 1 17 31745 3 2 1 HEC C3B C 4.471 1.369 3.850 1.00 . C A . 109 HEC C3B 1 1 17 31746 3 2 1 HEC C3C C 9.599 4.162 5.716 1.00 . C A . 109 HEC C3C 1 1 17 31747 3 2 1 HEC C3D C 12.883 -0.048 2.854 1.00 . C A . 109 HEC C3D 1 1 17 31748 3 2 1 HEC C4A C 7.457 -1.531 1.639 1.00 . C A . 109 HEC C4A 1 1 17 31749 3 2 1 HEC C4B C 5.866 1.677 4.059 1.00 . C A . 109 HEC C4B 1 1 17 31750 3 2 1 HEC C4C C 9.946 3.006 4.924 1.00 . C A . 109 HEC C4C 1 1 17 31751 3 2 1 HEC C4D C 11.482 -0.360 2.690 1.00 . C A . 109 HEC C4D 1 1 17 31752 3 2 1 HEC CAA C 10.030 -3.824 0.234 1.00 . C A . 109 HEC CAA 1 1 17 31753 3 2 1 HEC CAB C 3.325 2.110 4.475 1.00 . C A . 109 HEC CAB 1 1 17 31754 3 2 1 HEC CAC C 10.585 5.144 6.280 1.00 . C A . 109 HEC CAC 1 1 17 31755 3 2 1 HEC CAD C 14.015 -0.872 2.313 1.00 . C A . 109 HEC CAD 1 1 17 31756 3 2 1 HEC CBA C 10.289 -3.563 -1.247 1.00 . C A . 109 HEC CBA 1 1 17 31757 3 2 1 HEC CBB C 2.270 1.204 5.105 1.00 . C A . 109 HEC CBB 1 1 17 31758 3 2 1 HEC CBC C 10.568 5.234 7.803 1.00 . C A . 109 HEC CBC 1 1 17 31759 3 2 1 HEC CBD C 15.220 -0.957 3.245 1.00 . C A . 109 HEC CBD 1 1 17 31760 3 2 1 HEC CGA C 11.071 -4.707 -1.877 1.00 . C A . 109 HEC CGA 1 1 17 31761 3 2 1 HEC CGD C 16.437 -0.280 2.629 1.00 . C A . 109 HEC CGD 1 1 17 31762 3 2 1 HEC CHA C 10.991 -1.483 2.000 1.00 . C A . 109 HEC CHA 1 1 17 31763 3 2 1 HEC CHB C 6.139 -1.082 1.839 1.00 . C A . 109 HEC CHB 1 1 17 31764 3 2 1 HEC CHC C 6.339 2.716 4.881 1.00 . C A . 109 HEC CHC 1 1 17 31765 3 2 1 HEC CHD C 11.260 2.644 4.573 1.00 . C A . 109 HEC CHD 1 1 17 31766 3 2 1 HEC CMA C 6.845 -3.568 0.123 1.00 . C A . 109 HEC CMA 1 1 17 31767 3 2 1 HEC CMB C 3.202 -0.384 2.477 1.00 . C A . 109 HEC CMB 1 1 17 31768 3 2 1 HEC CMC C 7.400 5.165 6.567 1.00 . C A . 109 HEC CMC 1 1 17 31769 3 2 1 HEC CMD C 14.183 1.838 4.003 1.00 . C A . 109 HEC CMD 1 1 17 31770 3 2 1 HEC FE FE 8.690 0.695 3.345 1.00 . C A . 109 HEC FE 1 1 17 31771 3 2 1 HEC HAA1 H 11.000 -3.854 0.730 1.00 . C A . 109 HEC HAA1 1 1 17 31772 3 2 1 HEC HAA2 H 9.554 -4.801 0.310 1.00 . C A . 109 HEC HAA2 1 1 17 31773 3 2 1 HEC HAB H 3.701 2.763 5.262 1.00 . C A . 109 HEC HAB 1 1 17 31774 3 2 1 HEC HAC H 11.594 4.856 5.985 1.00 . C A . 109 HEC HAC 1 1 17 31775 3 2 1 HEC HAD1 H 13.671 -1.892 2.139 1.00 . C A . 109 HEC HAD1 1 1 17 31776 3 2 1 HEC HAD2 H 14.363 -0.440 1.375 1.00 . C A . 109 HEC HAD2 1 1 17 31777 3 2 1 HEC HBA1 H 9.338 -3.462 -1.770 1.00 . C A . 109 HEC HBA1 1 1 17 31778 3 2 1 HEC HBA2 H 10.865 -2.644 -1.359 1.00 . C A . 109 HEC HBA2 1 1 17 31779 3 2 1 HEC HBB1 H 1.574 0.869 4.337 1.00 . C A . 109 HEC HBB1 1 1 17 31780 3 2 1 HEC HBB2 H 2.757 0.340 5.557 1.00 . C A . 109 HEC HBB2 1 1 17 31781 3 2 1 HEC HBB3 H 1.728 1.758 5.872 1.00 . C A . 109 HEC HBB3 1 1 17 31782 3 2 1 HEC HBC1 H 11.249 6.022 8.127 1.00 . C A . 109 HEC HBC1 1 1 17 31783 3 2 1 HEC HBC2 H 9.559 5.464 8.142 1.00 . C A . 109 HEC HBC2 1 1 17 31784 3 2 1 HEC HBC3 H 10.887 4.282 8.227 1.00 . C A . 109 HEC HBC3 1 1 17 31785 3 2 1 HEC HBD1 H 14.987 -0.463 4.188 1.00 . C A . 109 HEC HBD1 1 1 17 31786 3 2 1 HEC HBD2 H 15.462 -2.003 3.433 1.00 . C A . 109 HEC HBD2 1 1 17 31787 3 2 1 HEC HHA H 11.715 -2.225 1.667 1.00 . C A . 109 HEC HHA 1 1 17 31788 3 2 1 HEC HHB H 5.346 -1.591 1.290 1.00 . C A . 109 HEC HHB 1 1 17 31789 3 2 1 HEC HHC H 5.597 3.320 5.404 1.00 . C A . 109 HEC HHC 1 1 17 31790 3 2 1 HEC HHD H 12.065 3.307 4.889 1.00 . C A . 109 HEC HHD 1 1 17 31791 3 2 1 HEC HMA1 H 5.936 -3.007 -0.093 1.00 . C A . 109 HEC HMA1 1 1 17 31792 3 2 1 HEC HMA2 H 7.290 -3.912 -0.810 1.00 . C A . 109 HEC HMA2 1 1 17 31793 3 2 1 HEC HMA3 H 6.601 -4.427 0.748 1.00 . C A . 109 HEC HMA3 1 1 17 31794 3 2 1 HEC HMB1 H 2.439 0.352 2.225 1.00 . C A . 109 HEC HMB1 1 1 17 31795 3 2 1 HEC HMB2 H 3.468 -0.952 1.585 1.00 . C A . 109 HEC HMB2 1 1 17 31796 3 2 1 HEC HMB3 H 2.814 -1.063 3.237 1.00 . C A . 109 HEC HMB3 1 1 17 31797 3 2 1 HEC HMC1 H 7.970 6.078 6.738 1.00 . C A . 109 HEC HMC1 1 1 17 31798 3 2 1 HEC HMC2 H 6.518 5.395 5.968 1.00 . C A . 109 HEC HMC2 1 1 17 31799 3 2 1 HEC HMC3 H 7.090 4.745 7.523 1.00 . C A . 109 HEC HMC3 1 1 17 31800 3 2 1 HEC HMD1 H 14.021 2.909 3.889 1.00 . C A . 109 HEC HMD1 1 1 17 31801 3 2 1 HEC HMD2 H 14.392 1.612 5.049 1.00 . C A . 109 HEC HMD2 1 1 17 31802 3 2 1 HEC HMD3 H 15.030 1.531 3.389 1.00 . C A . 109 HEC HMD3 1 1 17 31803 3 2 1 HEC NA N 8.590 -0.938 2.168 1.00 . C A . 109 HEC NA 1 1 17 31804 3 2 1 HEC NB N 6.664 0.805 3.339 1.00 . C A . 109 HEC NB 1 1 17 31805 3 2 1 HEC NC N 8.805 2.311 4.563 1.00 . C A . 109 HEC NC 1 1 17 31806 3 2 1 HEC ND N 10.701 0.601 3.308 1.00 . C A . 109 HEC ND 1 1 17 31807 3 2 1 HEC O1A O 11.136 -4.731 -3.125 1.00 . C A . 109 HEC O1A 1 1 17 31808 3 2 1 HEC O1D O 16.590 -0.401 1.395 1.00 . C A . 109 HEC O1D 1 1 17 31809 3 2 1 HEC O2A O 11.590 -5.535 -1.098 1.00 . C A . 109 HEC O2A 1 1 17 31810 3 2 1 HEC O2D O 17.191 0.346 3.405 1.00 . C A . 109 HEC O2D 1 1 17 31811 4 2 1 HEC C1A C -8.663 -3.322 0.334 1.00 . D A . 110 HEC C1A 1 1 17 31812 4 2 1 HEC C1B C -4.947 -1.132 0.072 1.00 . D A . 110 HEC C1B 1 1 17 31813 4 2 1 HEC C1C C -2.877 -4.431 1.964 1.00 . D A . 110 HEC C1C 1 1 17 31814 4 2 1 HEC C1D C -6.610 -6.582 2.290 1.00 . D A . 110 HEC C1D 1 1 17 31815 4 2 1 HEC C2A C -9.474 -2.368 -0.385 1.00 . D A . 110 HEC C2A 1 1 17 31816 4 2 1 HEC C2B C -3.785 -0.301 -0.142 1.00 . D A . 110 HEC C2B 1 1 17 31817 4 2 1 HEC C2C C -2.037 -5.459 2.532 1.00 . D A . 110 HEC C2C 1 1 17 31818 4 2 1 HEC C2D C -7.777 -7.396 2.536 1.00 . D A . 110 HEC C2D 1 1 17 31819 4 2 1 HEC C3A C -8.670 -1.339 -0.725 1.00 . D A . 110 HEC C3A 1 1 17 31820 4 2 1 HEC C3B C -2.736 -0.934 0.425 1.00 . D A . 110 HEC C3B 1 1 17 31821 4 2 1 HEC C3C C -2.840 -6.496 2.853 1.00 . D A . 110 HEC C3C 1 1 17 31822 4 2 1 HEC C3D C -8.839 -6.730 2.034 1.00 . D A . 110 HEC C3D 1 1 17 31823 4 2 1 HEC C4A C -7.352 -1.645 -0.220 1.00 . D A . 110 HEC C4A 1 1 17 31824 4 2 1 HEC C4B C -3.238 -2.162 0.995 1.00 . D A . 110 HEC C4B 1 1 17 31825 4 2 1 HEC C4C C -4.185 -6.119 2.487 1.00 . D A . 110 HEC C4C 1 1 17 31826 4 2 1 HEC C4D C -8.339 -5.497 1.473 1.00 . D A . 110 HEC C4D 1 1 17 31827 4 2 1 HEC CAA C -10.938 -2.533 -0.677 1.00 . D A . 110 HEC CAA 1 1 17 31828 4 2 1 HEC CAB C -1.305 -0.484 0.478 1.00 . D A . 110 HEC CAB 1 1 17 31829 4 2 1 HEC CAC C -2.454 -7.807 3.474 1.00 . D A . 110 HEC CAC 1 1 17 31830 4 2 1 HEC CAD C -10.279 -7.151 2.037 1.00 . D A . 110 HEC CAD 1 1 17 31831 4 2 1 HEC CBA C -11.854 -1.867 0.345 1.00 . D A . 110 HEC CBA 1 1 17 31832 4 2 1 HEC CBB C -1.125 0.963 0.928 1.00 . D A . 110 HEC CBB 1 1 17 31833 4 2 1 HEC CBC C -1.155 -7.756 4.274 1.00 . D A . 110 HEC CBC 1 1 17 31834 4 2 1 HEC CBD C -10.855 -7.404 0.647 1.00 . D A . 110 HEC CBD 1 1 17 31835 4 2 1 HEC CGA C -11.336 -0.487 0.728 1.00 . D A . 110 HEC CGA 1 1 17 31836 4 2 1 HEC CGD C -11.563 -8.750 0.584 1.00 . D A . 110 HEC CGD 1 1 17 31837 4 2 1 HEC CHA C -9.140 -4.522 0.850 1.00 . D A . 110 HEC CHA 1 1 17 31838 4 2 1 HEC CHB C -6.227 -0.814 -0.371 1.00 . D A . 110 HEC CHB 1 1 17 31839 4 2 1 HEC CHC C -2.449 -3.105 1.679 1.00 . D A . 110 HEC CHC 1 1 17 31840 4 2 1 HEC CHD C -5.318 -6.935 2.664 1.00 . D A . 110 HEC CHD 1 1 17 31841 4 2 1 HEC CMA C -9.031 -0.095 -1.483 1.00 . D A . 110 HEC CMA 1 1 17 31842 4 2 1 HEC CMB C -3.791 1.013 -0.866 1.00 . D A . 110 HEC CMB 1 1 17 31843 4 2 1 HEC CMC C -0.551 -5.352 2.712 1.00 . D A . 110 HEC CMC 1 1 17 31844 4 2 1 HEC CMD C -7.765 -8.729 3.226 1.00 . D A . 110 HEC CMD 1 1 17 31845 4 2 1 HEC FE FE -5.781 -3.851 1.194 1.00 . D A . 110 HEC FE 1 1 17 31846 4 2 1 HEC HAA1 H -11.166 -2.093 -1.648 1.00 . D A . 110 HEC HAA1 1 1 17 31847 4 2 1 HEC HAA2 H -11.188 -3.593 -0.691 1.00 . D A . 110 HEC HAA2 1 1 17 31848 4 2 1 HEC HAB H -0.753 -1.110 1.179 1.00 . D A . 110 HEC HAB 1 1 17 31849 4 2 1 HEC HAC H -3.239 -8.131 4.156 1.00 . D A . 110 HEC HAC 1 1 17 31850 4 2 1 HEC HAD1 H -10.386 -8.076 2.603 1.00 . D A . 110 HEC HAD1 1 1 17 31851 4 2 1 HEC HAD2 H -10.885 -6.371 2.498 1.00 . D A . 110 HEC HAD2 1 1 17 31852 4 2 1 HEC HBA1 H -12.853 -1.760 -0.077 1.00 . D A . 110 HEC HBA1 1 1 17 31853 4 2 1 HEC HBA2 H -11.902 -2.482 1.244 1.00 . D A . 110 HEC HBA2 1 1 17 31854 4 2 1 HEC HBB1 H -0.538 1.504 0.186 1.00 . D A . 110 HEC HBB1 1 1 17 31855 4 2 1 HEC HBB2 H -2.102 1.435 1.033 1.00 . D A . 110 HEC HBB2 1 1 17 31856 4 2 1 HEC HBB3 H -0.606 0.983 1.887 1.00 . D A . 110 HEC HBB3 1 1 17 31857 4 2 1 HEC HBC1 H -1.130 -8.587 4.979 1.00 . D A . 110 HEC HBC1 1 1 17 31858 4 2 1 HEC HBC2 H -0.306 -7.831 3.594 1.00 . D A . 110 HEC HBC2 1 1 17 31859 4 2 1 HEC HBC3 H -1.101 -6.814 4.819 1.00 . D A . 110 HEC HBC3 1 1 17 31860 4 2 1 HEC HBD1 H -11.572 -6.621 0.402 1.00 . D A . 110 HEC HBD1 1 1 17 31861 4 2 1 HEC HBD2 H -10.048 -7.401 -0.087 1.00 . D A . 110 HEC HBD2 1 1 17 31862 4 2 1 HEC HHA H -10.208 -4.725 0.769 1.00 . D A . 110 HEC HHA 1 1 17 31863 4 2 1 HEC HHB H -6.373 0.144 -0.869 1.00 . D A . 110 HEC HHB 1 1 17 31864 4 2 1 HEC HHC H -1.450 -2.795 1.988 1.00 . D A . 110 HEC HHC 1 1 17 31865 4 2 1 HEC HHD H -5.167 -7.910 3.127 1.00 . D A . 110 HEC HHD 1 1 17 31866 4 2 1 HEC HMA1 H -8.614 0.774 -0.975 1.00 . D A . 110 HEC HMA1 1 1 17 31867 4 2 1 HEC HMA2 H -8.626 -0.154 -2.493 1.00 . D A . 110 HEC HMA2 1 1 17 31868 4 2 1 HEC HMA3 H -10.116 -0.001 -1.531 1.00 . D A . 110 HEC HMA3 1 1 17 31869 4 2 1 HEC HMB1 H -4.212 0.878 -1.862 1.00 . D A . 110 HEC HMB1 1 1 17 31870 4 2 1 HEC HMB2 H -4.395 1.731 -0.310 1.00 . D A . 110 HEC HMB2 1 1 17 31871 4 2 1 HEC HMB3 H -2.770 1.386 -0.950 1.00 . D A . 110 HEC HMB3 1 1 17 31872 4 2 1 HEC HMC1 H -0.075 -6.270 2.368 1.00 . D A . 110 HEC HMC1 1 1 17 31873 4 2 1 HEC HMC2 H -0.175 -4.508 2.133 1.00 . D A . 110 HEC HMC2 1 1 17 31874 4 2 1 HEC HMC3 H -0.323 -5.199 3.767 1.00 . D A . 110 HEC HMC3 1 1 17 31875 4 2 1 HEC HMD1 H -8.708 -9.243 3.041 1.00 . D A . 110 HEC HMD1 1 1 17 31876 4 2 1 HEC HMD2 H -6.942 -9.330 2.839 1.00 . D A . 110 HEC HMD2 1 1 17 31877 4 2 1 HEC HMD3 H -7.635 -8.583 4.298 1.00 . D A . 110 HEC HMD3 1 1 17 31878 4 2 1 HEC NA N -7.359 -2.867 0.430 1.00 . D A . 110 HEC NA 1 1 17 31879 4 2 1 HEC NB N -4.599 -2.274 0.772 1.00 . D A . 110 HEC NB 1 1 17 31880 4 2 1 HEC NC N -4.197 -4.847 1.941 1.00 . D A . 110 HEC NC 1 1 17 31881 4 2 1 HEC ND N -6.967 -5.416 1.635 1.00 . D A . 110 HEC ND 1 1 17 31882 4 2 1 HEC O1A O -11.647 0.463 -0.023 1.00 . D A . 110 HEC O1A 1 1 17 31883 4 2 1 HEC O1D O -12.722 -8.803 1.049 1.00 . D A . 110 HEC O1D 1 1 17 31884 4 2 1 HEC O2A O -10.641 -0.409 1.763 1.00 . D A . 110 HEC O2A 1 1 17 31885 4 2 1 HEC O2D O -10.933 -9.700 0.072 1.00 . D A . 110 HEC O2D 1 1 17 31886 5 2 1 HEC C1A C -0.048 4.169 -9.267 1.00 . E A . 111 HEC C1A 1 1 17 31887 5 2 1 HEC C1B C -1.309 0.714 -11.535 1.00 . E A . 111 HEC C1B 1 1 17 31888 5 2 1 HEC C1C C -3.117 -0.963 -7.948 1.00 . E A . 111 HEC C1C 1 1 17 31889 5 2 1 HEC C1D C -1.835 2.500 -5.704 1.00 . E A . 111 HEC C1D 1 1 17 31890 5 2 1 HEC C2A C 0.549 4.886 -10.368 1.00 . E A . 111 HEC C2A 1 1 17 31891 5 2 1 HEC C2B C -1.474 -0.440 -12.388 1.00 . E A . 111 HEC C2B 1 1 17 31892 5 2 1 HEC C2C C -3.873 -1.585 -6.886 1.00 . E A . 111 HEC C2C 1 1 17 31893 5 2 1 HEC C2D C -1.347 3.500 -4.784 1.00 . E A . 111 HEC C2D 1 1 17 31894 5 2 1 HEC C3A C 0.368 4.135 -11.475 1.00 . E A . 111 HEC C3A 1 1 17 31895 5 2 1 HEC C3B C -2.077 -1.396 -11.650 1.00 . E A . 111 HEC C3B 1 1 17 31896 5 2 1 HEC C3C C -3.772 -0.783 -5.805 1.00 . E A . 111 HEC C3C 1 1 17 31897 5 2 1 HEC C3D C -0.641 4.394 -5.507 1.00 . E A . 111 HEC C3D 1 1 17 31898 5 2 1 HEC C4A C -0.343 2.946 -11.070 1.00 . E A . 111 HEC C4A 1 1 17 31899 5 2 1 HEC C4B C -2.291 -0.844 -10.333 1.00 . E A . 111 HEC C4B 1 1 17 31900 5 2 1 HEC C4C C -2.952 0.343 -6.186 1.00 . E A . 111 HEC C4C 1 1 17 31901 5 2 1 HEC C4D C -0.685 3.957 -6.883 1.00 . E A . 111 HEC C4D 1 1 17 31902 5 2 1 HEC CAA C 1.234 6.217 -10.256 1.00 . E A . 111 HEC CAA 1 1 17 31903 5 2 1 HEC CAB C -2.468 -2.782 -12.074 1.00 . E A . 111 HEC CAB 1 1 17 31904 5 2 1 HEC CAC C -4.378 -0.983 -4.446 1.00 . E A . 111 HEC CAC 1 1 17 31905 5 2 1 HEC CAD C 0.072 5.622 -5.019 1.00 . E A . 111 HEC CAD 1 1 17 31906 5 2 1 HEC CBA C 2.597 6.273 -10.940 1.00 . E A . 111 HEC CBA 1 1 17 31907 5 2 1 HEC CBB C -1.394 -3.835 -11.820 1.00 . E A . 111 HEC CBB 1 1 17 31908 5 2 1 HEC CBC C -4.193 -2.390 -3.885 1.00 . E A . 111 HEC CBC 1 1 17 31909 5 2 1 HEC CBD C -0.856 6.788 -4.692 1.00 . E A . 111 HEC CBD 1 1 17 31910 5 2 1 HEC CGA C 2.660 7.415 -11.944 1.00 . E A . 111 HEC CGA 1 1 17 31911 5 2 1 HEC CGD C -0.062 8.053 -4.397 1.00 . E A . 111 HEC CGD 1 1 17 31912 5 2 1 HEC CHA C -0.064 4.626 -7.953 1.00 . E A . 111 HEC CHA 1 1 17 31913 5 2 1 HEC CHB C -0.723 1.908 -11.941 1.00 . E A . 111 HEC CHB 1 1 17 31914 5 2 1 HEC CHC C -2.898 -1.534 -9.268 1.00 . E A . 111 HEC CHC 1 1 17 31915 5 2 1 HEC CHD C -2.610 1.406 -5.331 1.00 . E A . 111 HEC CHD 1 1 17 31916 5 2 1 HEC CMA C 0.806 4.438 -12.879 1.00 . E A . 111 HEC CMA 1 1 17 31917 5 2 1 HEC CMB C -1.040 -0.516 -13.823 1.00 . E A . 111 HEC CMB 1 1 17 31918 5 2 1 HEC CMC C -4.618 -2.882 -7.009 1.00 . E A . 111 HEC CMC 1 1 17 31919 5 2 1 HEC CMD C -1.601 3.503 -3.305 1.00 . E A . 111 HEC CMD 1 1 17 31920 5 2 1 HEC FE FE -1.597 1.611 -8.620 1.00 . E A . 111 HEC FE 1 1 17 31921 5 2 1 HEC HAA1 H 0.612 6.986 -10.716 1.00 . E A . 111 HEC HAA1 1 1 17 31922 5 2 1 HEC HAA2 H 1.391 6.457 -9.205 1.00 . E A . 111 HEC HAA2 1 1 17 31923 5 2 1 HEC HAB H -3.359 -3.091 -11.527 1.00 . E A . 111 HEC HAB 1 1 17 31924 5 2 1 HEC HAC H -3.920 -0.292 -3.739 1.00 . E A . 111 HEC HAC 1 1 17 31925 5 2 1 HEC HAD1 H 0.623 5.384 -4.109 1.00 . E A . 111 HEC HAD1 1 1 17 31926 5 2 1 HEC HAD2 H 0.766 5.968 -5.785 1.00 . E A . 111 HEC HAD2 1 1 17 31927 5 2 1 HEC HBA1 H 3.374 6.425 -10.190 1.00 . E A . 111 HEC HBA1 1 1 17 31928 5 2 1 HEC HBA2 H 2.779 5.336 -11.466 1.00 . E A . 111 HEC HBA2 1 1 17 31929 5 2 1 HEC HBB1 H -1.646 -4.402 -10.924 1.00 . E A . 111 HEC HBB1 1 1 17 31930 5 2 1 HEC HBB2 H -1.339 -4.511 -12.674 1.00 . E A . 111 HEC HBB2 1 1 17 31931 5 2 1 HEC HBB3 H -0.431 -3.345 -11.681 1.00 . E A . 111 HEC HBB3 1 1 17 31932 5 2 1 HEC HBC1 H -3.275 -2.822 -4.283 1.00 . E A . 111 HEC HBC1 1 1 17 31933 5 2 1 HEC HBC2 H -4.131 -2.342 -2.798 1.00 . E A . 111 HEC HBC2 1 1 17 31934 5 2 1 HEC HBC3 H -5.041 -3.011 -4.174 1.00 . E A . 111 HEC HBC3 1 1 17 31935 5 2 1 HEC HBD1 H -1.513 6.979 -5.540 1.00 . E A . 111 HEC HBD1 1 1 17 31936 5 2 1 HEC HBD2 H -1.456 6.541 -3.816 1.00 . E A . 111 HEC HBD2 1 1 17 31937 5 2 1 HEC HHA H 0.438 5.569 -7.733 1.00 . E A . 111 HEC HHA 1 1 17 31938 5 2 1 HEC HHB H -0.543 2.054 -13.006 1.00 . E A . 111 HEC HHB 1 1 17 31939 5 2 1 HEC HHC H -3.216 -2.560 -9.450 1.00 . E A . 111 HEC HHC 1 1 17 31940 5 2 1 HEC HHD H -2.980 1.367 -4.307 1.00 . E A . 111 HEC HHD 1 1 17 31941 5 2 1 HEC HMA1 H -0.064 4.449 -13.536 1.00 . E A . 111 HEC HMA1 1 1 17 31942 5 2 1 HEC HMA2 H 1.294 5.412 -12.905 1.00 . E A . 111 HEC HMA2 1 1 17 31943 5 2 1 HEC HMA3 H 1.505 3.672 -13.215 1.00 . E A . 111 HEC HMA3 1 1 17 31944 5 2 1 HEC HMB1 H -1.795 -0.050 -14.456 1.00 . E A . 111 HEC HMB1 1 1 17 31945 5 2 1 HEC HMB2 H -0.091 0.006 -13.943 1.00 . E A . 111 HEC HMB2 1 1 17 31946 5 2 1 HEC HMB3 H -0.919 -1.561 -14.111 1.00 . E A . 111 HEC HMB3 1 1 17 31947 5 2 1 HEC HMC1 H -4.222 -3.598 -6.288 1.00 . E A . 111 HEC HMC1 1 1 17 31948 5 2 1 HEC HMC2 H -5.676 -2.714 -6.809 1.00 . E A . 111 HEC HMC2 1 1 17 31949 5 2 1 HEC HMC3 H -4.497 -3.277 -8.017 1.00 . E A . 111 HEC HMC3 1 1 17 31950 5 2 1 HEC HMD1 H -1.071 4.338 -2.846 1.00 . E A . 111 HEC HMD1 1 1 17 31951 5 2 1 HEC HMD2 H -2.671 3.607 -3.120 1.00 . E A . 111 HEC HMD2 1 1 17 31952 5 2 1 HEC HMD3 H -1.248 2.567 -2.873 1.00 . E A . 111 HEC HMD3 1 1 17 31953 5 2 1 HEC NA N -0.594 2.977 -9.709 1.00 . E A . 111 HEC NA 1 1 17 31954 5 2 1 HEC NB N -1.816 0.454 -10.273 1.00 . E A . 111 HEC NB 1 1 17 31955 5 2 1 HEC NC N -2.554 0.222 -7.506 1.00 . E A . 111 HEC NC 1 1 17 31956 5 2 1 HEC ND N -1.423 2.791 -6.993 1.00 . E A . 111 HEC ND 1 1 17 31957 5 2 1 HEC O1A O 2.489 8.571 -11.500 1.00 . E A . 111 HEC O1A 1 1 17 31958 5 2 1 HEC O1D O 0.219 8.786 -5.369 1.00 . E A . 111 HEC O1D 1 1 17 31959 5 2 1 HEC O2A O 2.878 7.110 -13.137 1.00 . E A . 111 HEC O2A 1 1 17 31960 5 2 1 HEC O2D O 0.248 8.263 -3.204 1.00 . E A . 111 HEC O2D 1 1 18 31961 1 1 1 ALA C C -0.967 3.088 20.955 1.00 . A A . 1 ALA C 1 1 18 31962 1 1 1 ALA CA C 0.293 2.334 21.386 1.00 . A A . 1 ALA CA 1 1 18 31963 1 1 1 ALA CB C 0.639 1.186 20.437 1.00 . A A . 1 ALA CB 1 1 18 31964 1 1 1 ALA H1 H -0.886 1.687 22.907 1.00 . A A . 1 ALA H1 1 1 18 31965 1 1 1 ALA H2 H 0.580 0.922 22.817 1.00 . A A . 1 ALA H2 1 1 18 31966 1 1 1 ALA HA H 1.131 3.031 21.415 1.00 . A A . 1 ALA HA 1 1 18 31967 1 1 1 ALA HB1 H -0.045 0.354 20.608 1.00 . A A . 1 ALA HB1 1 1 18 31968 1 1 1 ALA HB2 H 0.548 1.526 19.406 1.00 . A A . 1 ALA HB2 1 1 18 31969 1 1 1 ALA HB3 H 1.662 0.858 20.622 1.00 . A A . 1 ALA HB3 1 1 18 31970 1 1 1 ALA N N 0.104 1.814 22.730 1.00 . A A . 1 ALA N 1 1 18 31971 1 1 1 ALA O O -2.045 2.869 21.506 1.00 . A A . 1 ALA O 1 1 18 31972 1 1 2 PRO C C -2.812 3.916 18.558 1.00 . A A . 2 PRO C 1 1 18 31973 1 1 2 PRO CA C -1.894 4.769 19.435 1.00 . A A . 2 PRO CA 1 1 18 31974 1 1 2 PRO CB C -1.245 5.916 18.676 1.00 . A A . 2 PRO CB 1 1 18 31975 1 1 2 PRO CD C 0.477 4.268 19.271 1.00 . A A . 2 PRO CD 1 1 18 31976 1 1 2 PRO CG C 0.183 5.477 18.398 1.00 . A A . 2 PRO CG 1 1 18 31977 1 1 2 PRO HA H -2.463 5.098 20.188 1.00 . A A . 2 PRO HA 1 1 18 31978 1 1 2 PRO HB2 H -1.779 6.122 17.749 1.00 . A A . 2 PRO HB2 1 1 18 31979 1 1 2 PRO HB3 H -1.264 6.833 19.265 1.00 . A A . 2 PRO HB3 1 1 18 31980 1 1 2 PRO HD2 H 0.807 3.418 18.672 1.00 . A A . 2 PRO HD2 1 1 18 31981 1 1 2 PRO HD3 H 1.271 4.480 19.986 1.00 . A A . 2 PRO HD3 1 1 18 31982 1 1 2 PRO HG2 H 0.306 5.226 17.344 1.00 . A A . 2 PRO HG2 1 1 18 31983 1 1 2 PRO HG3 H 0.880 6.285 18.617 1.00 . A A . 2 PRO HG3 1 1 18 31984 1 1 2 PRO N N -0.785 3.982 19.947 1.00 . A A . 2 PRO N 1 1 18 31985 1 1 2 PRO O O -2.485 2.775 18.236 1.00 . A A . 2 PRO O 1 1 18 31986 1 1 3 LYS C C -4.770 4.289 15.917 1.00 . A A . 3 LYS C 1 1 18 31987 1 1 3 LYS CA C -4.912 3.810 17.363 1.00 . A A . 3 LYS CA 1 1 18 31988 1 1 3 LYS CB C -6.324 3.978 17.930 1.00 . A A . 3 LYS CB 1 1 18 31989 1 1 3 LYS CD C -7.960 5.743 18.684 1.00 . A A . 3 LYS CD 1 1 18 31990 1 1 3 LYS CE C -7.435 6.623 19.820 1.00 . A A . 3 LYS CE 1 1 18 31991 1 1 3 LYS CG C -6.843 5.399 17.697 1.00 . A A . 3 LYS CG 1 1 18 31992 1 1 3 LYS H H -4.202 5.431 18.461 1.00 . A A . 3 LYS H 1 1 18 31993 1 1 3 LYS HA H -4.675 2.747 17.400 1.00 . A A . 3 LYS HA 1 1 18 31994 1 1 3 LYS HB2 H -6.996 3.260 17.460 1.00 . A A . 3 LYS HB2 1 1 18 31995 1 1 3 LYS HB3 H -6.319 3.759 18.997 1.00 . A A . 3 LYS HB3 1 1 18 31996 1 1 3 LYS HD2 H -8.766 6.259 18.162 1.00 . A A . 3 LYS HD2 1 1 18 31997 1 1 3 LYS HD3 H -8.382 4.826 19.095 1.00 . A A . 3 LYS HD3 1 1 18 31998 1 1 3 LYS HE2 H -7.028 5.998 20.615 1.00 . A A . 3 LYS HE2 1 1 18 31999 1 1 3 LYS HE3 H -6.620 7.248 19.457 1.00 . A A . 3 LYS HE3 1 1 18 32000 1 1 3 LYS HG2 H -6.025 6.111 17.805 1.00 . A A . 3 LYS HG2 1 1 18 32001 1 1 3 LYS HG3 H -7.213 5.491 16.676 1.00 . A A . 3 LYS HG3 1 1 18 32002 1 1 3 LYS HZ1 H -8.162 8.208 20.962 1.00 . A A . 3 LYS HZ1 1 1 18 32003 1 1 3 LYS HZ2 H -9.045 7.932 19.622 1.00 . A A . 3 LYS HZ2 1 1 18 32004 1 1 3 LYS N N -3.944 4.503 18.196 1.00 . A A . 3 LYS N 1 1 18 32005 1 1 3 LYS NZ N -8.519 7.475 20.359 1.00 . A A . 3 LYS NZ 1 1 18 32006 1 1 3 LYS O O -4.007 5.213 15.637 1.00 . A A . 3 LYS O 1 1 18 32007 1 1 4 ALA C C -6.064 5.389 13.435 1.00 . A A . 4 ALA C 1 1 18 32008 1 1 4 ALA CA C -5.481 3.987 13.625 1.00 . A A . 4 ALA CA 1 1 18 32009 1 1 4 ALA CB C -6.236 2.928 12.819 1.00 . A A . 4 ALA CB 1 1 18 32010 1 1 4 ALA H H -6.134 2.889 15.271 1.00 . A A . 4 ALA H 1 1 18 32011 1 1 4 ALA HA H -4.438 3.991 13.309 1.00 . A A . 4 ALA HA 1 1 18 32012 1 1 4 ALA HB1 H -5.969 1.936 13.184 1.00 . A A . 4 ALA HB1 1 1 18 32013 1 1 4 ALA HB2 H -7.309 3.081 12.934 1.00 . A A . 4 ALA HB2 1 1 18 32014 1 1 4 ALA HB3 H -5.968 3.013 11.766 1.00 . A A . 4 ALA HB3 1 1 18 32015 1 1 4 ALA N N -5.516 3.639 15.035 1.00 . A A . 4 ALA N 1 1 18 32016 1 1 4 ALA O O -6.871 5.844 14.244 1.00 . A A . 4 ALA O 1 1 18 32017 1 1 5 PRO C C -7.517 7.362 11.478 1.00 . A A . 5 PRO C 1 1 18 32018 1 1 5 PRO CA C -6.090 7.392 12.027 1.00 . A A . 5 PRO CA 1 1 18 32019 1 1 5 PRO CB C -5.082 7.944 11.032 1.00 . A A . 5 PRO CB 1 1 18 32020 1 1 5 PRO CD C -4.666 5.544 11.353 1.00 . A A . 5 PRO CD 1 1 18 32021 1 1 5 PRO CG C -4.352 6.737 10.465 1.00 . A A . 5 PRO CG 1 1 18 32022 1 1 5 PRO HA H -6.129 7.945 12.860 1.00 . A A . 5 PRO HA 1 1 18 32023 1 1 5 PRO HB2 H -5.581 8.506 10.242 1.00 . A A . 5 PRO HB2 1 1 18 32024 1 1 5 PRO HB3 H -4.386 8.628 11.519 1.00 . A A . 5 PRO HB3 1 1 18 32025 1 1 5 PRO HD2 H -5.089 4.721 10.776 1.00 . A A . 5 PRO HD2 1 1 18 32026 1 1 5 PRO HD3 H -3.766 5.163 11.837 1.00 . A A . 5 PRO HD3 1 1 18 32027 1 1 5 PRO HG2 H -4.672 6.545 9.441 1.00 . A A . 5 PRO HG2 1 1 18 32028 1 1 5 PRO HG3 H -3.278 6.919 10.436 1.00 . A A . 5 PRO HG3 1 1 18 32029 1 1 5 PRO N N -5.621 6.052 12.333 1.00 . A A . 5 PRO N 1 1 18 32030 1 1 5 PRO O O -8.067 6.290 11.227 1.00 . A A . 5 PRO O 1 1 18 32031 1 1 6 ALA C C -9.504 8.033 9.405 1.00 . A A . 6 ALA C 1 1 18 32032 1 1 6 ALA CA C -9.430 8.674 10.792 1.00 . A A . 6 ALA CA 1 1 18 32033 1 1 6 ALA CB C -9.839 10.148 10.775 1.00 . A A . 6 ALA CB 1 1 18 32034 1 1 6 ALA H H -7.623 9.417 11.513 1.00 . A A . 6 ALA H 1 1 18 32035 1 1 6 ALA HA H -10.093 8.133 11.468 1.00 . A A . 6 ALA HA 1 1 18 32036 1 1 6 ALA HB1 H -8.956 10.768 10.617 1.00 . A A . 6 ALA HB1 1 1 18 32037 1 1 6 ALA HB2 H -10.551 10.319 9.969 1.00 . A A . 6 ALA HB2 1 1 18 32038 1 1 6 ALA HB3 H -10.299 10.408 11.728 1.00 . A A . 6 ALA HB3 1 1 18 32039 1 1 6 ALA N N -8.077 8.550 11.307 1.00 . A A . 6 ALA N 1 1 18 32040 1 1 6 ALA O O -8.543 8.090 8.639 1.00 . A A . 6 ALA O 1 1 18 32041 1 1 7 ASP C C -10.938 7.846 6.741 1.00 . A A . 7 ASP C 1 1 18 32042 1 1 7 ASP CA C -10.864 6.785 7.842 1.00 . A A . 7 ASP CA 1 1 18 32043 1 1 7 ASP CB C -12.178 6.001 7.832 1.00 . A A . 7 ASP CB 1 1 18 32044 1 1 7 ASP CG C -13.333 6.665 8.586 1.00 . A A . 7 ASP CG 1 1 18 32045 1 1 7 ASP H H -11.430 7.394 9.752 1.00 . A A . 7 ASP H 1 1 18 32046 1 1 7 ASP HA H -10.014 6.114 7.718 1.00 . A A . 7 ASP HA 1 1 18 32047 1 1 7 ASP HB2 H -12.483 5.844 6.797 1.00 . A A . 7 ASP HB2 1 1 18 32048 1 1 7 ASP HB3 H -12.000 5.017 8.265 1.00 . A A . 7 ASP HB3 1 1 18 32049 1 1 7 ASP N N -10.653 7.437 9.123 1.00 . A A . 7 ASP N 1 1 18 32050 1 1 7 ASP O O -11.402 8.960 6.979 1.00 . A A . 7 ASP O 1 1 18 32051 1 1 7 ASP OD1 O -13.408 7.911 8.524 1.00 . A A . 7 ASP OD1 1 1 18 32052 1 1 7 ASP OD2 O -14.113 5.911 9.206 1.00 . A A . 7 ASP OD2 1 1 18 32053 1 1 8 GLY C C -9.084 8.934 4.167 1.00 . A A . 8 GLY C 1 1 18 32054 1 1 8 GLY CA C -10.481 8.366 4.424 1.00 . A A . 8 GLY CA 1 1 18 32055 1 1 8 GLY H H -10.099 6.553 5.377 1.00 . A A . 8 GLY H 1 1 18 32056 1 1 8 GLY HA2 H -10.832 7.838 3.537 1.00 . A A . 8 GLY HA2 1 1 18 32057 1 1 8 GLY HA3 H -11.182 9.181 4.607 1.00 . A A . 8 GLY HA3 1 1 18 32058 1 1 8 GLY N N -10.474 7.462 5.561 1.00 . A A . 8 GLY N 1 1 18 32059 1 1 8 GLY O O -8.946 10.035 3.636 1.00 . A A . 8 GLY O 1 1 18 32060 1 1 9 LEU C C -6.324 8.438 2.898 1.00 . A A . 9 LEU C 1 1 18 32061 1 1 9 LEU CA C -6.702 8.571 4.374 1.00 . A A . 9 LEU CA 1 1 18 32062 1 1 9 LEU CB C -5.782 7.793 5.317 1.00 . A A . 9 LEU CB 1 1 18 32063 1 1 9 LEU CD1 C -3.799 6.887 4.048 1.00 . A A . 9 LEU CD1 1 1 18 32064 1 1 9 LEU CD2 C -3.931 9.356 4.616 1.00 . A A . 9 LEU CD2 1 1 18 32065 1 1 9 LEU CG C -4.281 7.933 5.056 1.00 . A A . 9 LEU CG 1 1 18 32066 1 1 9 LEU H H -8.204 7.264 4.987 1.00 . A A . 9 LEU H 1 1 18 32067 1 1 9 LEU HA H -6.636 9.622 4.654 1.00 . A A . 9 LEU HA 1 1 18 32068 1 1 9 LEU HB2 H -5.985 8.115 6.338 1.00 . A A . 9 LEU HB2 1 1 18 32069 1 1 9 LEU HB3 H -6.044 6.736 5.257 1.00 . A A . 9 LEU HB3 1 1 18 32070 1 1 9 LEU HD11 H -4.636 6.252 3.756 1.00 . A A . 9 LEU HD11 1 1 18 32071 1 1 9 LEU HD12 H -3.399 7.389 3.168 1.00 . A A . 9 LEU HD12 1 1 18 32072 1 1 9 LEU HD13 H -3.021 6.275 4.504 1.00 . A A . 9 LEU HD13 1 1 18 32073 1 1 9 LEU HD21 H -4.569 10.066 5.143 1.00 . A A . 9 LEU HD21 1 1 18 32074 1 1 9 LEU HD22 H -2.887 9.563 4.851 1.00 . A A . 9 LEU HD22 1 1 18 32075 1 1 9 LEU HD23 H -4.089 9.454 3.542 1.00 . A A . 9 LEU HD23 1 1 18 32076 1 1 9 LEU HG H -3.753 7.746 5.991 1.00 . A A . 9 LEU HG 1 1 18 32077 1 1 9 LEU N N -8.083 8.158 4.556 1.00 . A A . 9 LEU N 1 1 18 32078 1 1 9 LEU O O -6.035 7.341 2.424 1.00 . A A . 9 LEU O 1 1 18 32079 1 1 10 LYS C C -4.504 9.861 0.640 1.00 . A A . 10 LYS C 1 1 18 32080 1 1 10 LYS CA C -6.003 9.595 0.798 1.00 . A A . 10 LYS CA 1 1 18 32081 1 1 10 LYS CB C -6.886 10.598 0.054 1.00 . A A . 10 LYS CB 1 1 18 32082 1 1 10 LYS CD C -7.035 12.084 -1.979 1.00 . A A . 10 LYS CD 1 1 18 32083 1 1 10 LYS CE C -6.979 12.013 -3.506 1.00 . A A . 10 LYS CE 1 1 18 32084 1 1 10 LYS CG C -6.340 10.875 -1.349 1.00 . A A . 10 LYS CG 1 1 18 32085 1 1 10 LYS H H -6.576 10.460 2.605 1.00 . A A . 10 LYS H 1 1 18 32086 1 1 10 LYS HA H -6.223 8.608 0.393 1.00 . A A . 10 LYS HA 1 1 18 32087 1 1 10 LYS HB2 H -7.903 10.210 -0.018 1.00 . A A . 10 LYS HB2 1 1 18 32088 1 1 10 LYS HB3 H -6.940 11.530 0.617 1.00 . A A . 10 LYS HB3 1 1 18 32089 1 1 10 LYS HD2 H -8.074 12.123 -1.651 1.00 . A A . 10 LYS HD2 1 1 18 32090 1 1 10 LYS HD3 H -6.557 13.001 -1.636 1.00 . A A . 10 LYS HD3 1 1 18 32091 1 1 10 LYS HE2 H -5.947 12.108 -3.843 1.00 . A A . 10 LYS HE2 1 1 18 32092 1 1 10 LYS HE3 H -7.337 11.041 -3.845 1.00 . A A . 10 LYS HE3 1 1 18 32093 1 1 10 LYS HG2 H -5.267 11.054 -1.296 1.00 . A A . 10 LYS HG2 1 1 18 32094 1 1 10 LYS HG3 H -6.486 9.998 -1.979 1.00 . A A . 10 LYS HG3 1 1 18 32095 1 1 10 LYS HZ1 H -8.035 12.893 -5.073 1.00 . A A . 10 LYS HZ1 1 1 18 32096 1 1 10 LYS HZ2 H -8.681 13.212 -3.612 1.00 . A A . 10 LYS HZ2 1 1 18 32097 1 1 10 LYS N N -6.339 9.572 2.211 1.00 . A A . 10 LYS N 1 1 18 32098 1 1 10 LYS NZ N -7.803 13.087 -4.105 1.00 . A A . 10 LYS NZ 1 1 18 32099 1 1 10 LYS O O -3.904 10.559 1.456 1.00 . A A . 10 LYS O 1 1 18 32100 1 1 11 MET C C -2.290 9.799 -2.163 1.00 . A A . 11 MET C 1 1 18 32101 1 1 11 MET CA C -2.526 9.455 -0.691 1.00 . A A . 11 MET CA 1 1 18 32102 1 1 11 MET CB C -1.784 8.163 -0.343 1.00 . A A . 11 MET CB 1 1 18 32103 1 1 11 MET CE C -0.429 5.505 0.069 1.00 . A A . 11 MET CE 1 1 18 32104 1 1 11 MET CG C -2.648 6.936 -0.643 1.00 . A A . 11 MET CG 1 1 18 32105 1 1 11 MET H H -4.438 8.723 -1.074 1.00 . A A . 11 MET H 1 1 18 32106 1 1 11 MET HA H -2.200 10.282 -0.060 1.00 . A A . 11 MET HA 1 1 18 32107 1 1 11 MET HB2 H -0.857 8.107 -0.914 1.00 . A A . 11 MET HB2 1 1 18 32108 1 1 11 MET HB3 H -1.509 8.169 0.711 1.00 . A A . 11 MET HB3 1 1 18 32109 1 1 11 MET HE1 H -0.940 5.292 1.008 1.00 . A A . 11 MET HE1 1 1 18 32110 1 1 11 MET HE2 H 0.283 4.709 -0.147 1.00 . A A . 11 MET HE2 1 1 18 32111 1 1 11 MET HE3 H 0.100 6.454 0.151 1.00 . A A . 11 MET HE3 1 1 18 32112 1 1 11 MET HG2 H -3.173 6.622 0.259 1.00 . A A . 11 MET HG2 1 1 18 32113 1 1 11 MET HG3 H -3.408 7.189 -1.382 1.00 . A A . 11 MET HG3 1 1 18 32114 1 1 11 MET N N -3.943 9.289 -0.415 1.00 . A A . 11 MET N 1 1 18 32115 1 1 11 MET O O -2.293 8.916 -3.019 1.00 . A A . 11 MET O 1 1 18 32116 1 1 11 MET SD S -1.628 5.604 -1.251 1.00 . A A . 11 MET SD 1 1 18 32117 1 1 12 GLU C C -0.378 11.914 -3.953 1.00 . A A . 12 GLU C 1 1 18 32118 1 1 12 GLU CA C -1.854 11.558 -3.766 1.00 . A A . 12 GLU CA 1 1 18 32119 1 1 12 GLU CB C -2.753 12.752 -4.095 1.00 . A A . 12 GLU CB 1 1 18 32120 1 1 12 GLU CD C -1.628 13.953 -6.006 1.00 . A A . 12 GLU CD 1 1 18 32121 1 1 12 GLU CG C -2.774 13.023 -5.600 1.00 . A A . 12 GLU CG 1 1 18 32122 1 1 12 GLU H H -2.090 11.797 -1.710 1.00 . A A . 12 GLU H 1 1 18 32123 1 1 12 GLU HA H -2.119 10.722 -4.414 1.00 . A A . 12 GLU HA 1 1 18 32124 1 1 12 GLU HB2 H -3.766 12.557 -3.742 1.00 . A A . 12 GLU HB2 1 1 18 32125 1 1 12 GLU HB3 H -2.396 13.636 -3.567 1.00 . A A . 12 GLU HB3 1 1 18 32126 1 1 12 GLU HG2 H -2.694 12.082 -6.144 1.00 . A A . 12 GLU HG2 1 1 18 32127 1 1 12 GLU HG3 H -3.727 13.472 -5.879 1.00 . A A . 12 GLU HG3 1 1 18 32128 1 1 12 GLU N N -2.091 11.085 -2.412 1.00 . A A . 12 GLU N 1 1 18 32129 1 1 12 GLU O O -0.038 13.079 -4.149 1.00 . A A . 12 GLU O 1 1 18 32130 1 1 12 GLU OE1 O -1.325 14.863 -5.204 1.00 . A A . 12 GLU OE1 1 1 18 32131 1 1 12 GLU OE2 O -1.082 13.732 -7.108 1.00 . A A . 12 GLU OE2 1 1 18 32132 1 1 13 ALA C C 2.257 10.939 -5.523 1.00 . A A . 13 ALA C 1 1 18 32133 1 1 13 ALA CA C 1.890 11.079 -4.045 1.00 . A A . 13 ALA CA 1 1 18 32134 1 1 13 ALA CB C 2.639 10.080 -3.161 1.00 . A A . 13 ALA CB 1 1 18 32135 1 1 13 ALA H H 0.173 9.944 -3.725 1.00 . A A . 13 ALA H 1 1 18 32136 1 1 13 ALA HA H 2.129 12.090 -3.713 1.00 . A A . 13 ALA HA 1 1 18 32137 1 1 13 ALA HB1 H 2.068 9.901 -2.250 1.00 . A A . 13 ALA HB1 1 1 18 32138 1 1 13 ALA HB2 H 2.767 9.142 -3.700 1.00 . A A . 13 ALA HB2 1 1 18 32139 1 1 13 ALA HB3 H 3.617 10.486 -2.902 1.00 . A A . 13 ALA HB3 1 1 18 32140 1 1 13 ALA N N 0.458 10.889 -3.885 1.00 . A A . 13 ALA N 1 1 18 32141 1 1 13 ALA O O 3.334 11.362 -5.942 1.00 . A A . 13 ALA O 1 1 18 32142 1 1 14 THR C C 0.387 10.721 -8.499 1.00 . A A . 14 THR C 1 1 18 32143 1 1 14 THR CA C 1.556 10.144 -7.697 1.00 . A A . 14 THR CA 1 1 18 32144 1 1 14 THR CB C 1.776 8.649 -7.935 1.00 . A A . 14 THR CB 1 1 18 32145 1 1 14 THR CG2 C 2.456 7.961 -6.749 1.00 . A A . 14 THR CG2 1 1 18 32146 1 1 14 THR H H 0.468 10.004 -5.926 1.00 . A A . 14 THR H 1 1 18 32147 1 1 14 THR HA H 2.449 10.695 -7.991 1.00 . A A . 14 THR HA 1 1 18 32148 1 1 14 THR HB H 2.334 8.479 -8.856 1.00 . A A . 14 THR HB 1 1 18 32149 1 1 14 THR HG1 H -0.072 8.476 -7.188 1.00 . A A . 14 THR HG1 1 1 18 32150 1 1 14 THR HG21 H 2.941 8.710 -6.124 1.00 . A A . 14 THR HG21 1 1 18 32151 1 1 14 THR HG22 H 1.709 7.426 -6.163 1.00 . A A . 14 THR HG22 1 1 18 32152 1 1 14 THR HG23 H 3.202 7.256 -7.117 1.00 . A A . 14 THR HG23 1 1 18 32153 1 1 14 THR N N 1.341 10.345 -6.274 1.00 . A A . 14 THR N 1 1 18 32154 1 1 14 THR O O -0.557 11.262 -7.926 1.00 . A A . 14 THR O 1 1 18 32155 1 1 14 THR OG1 O 0.461 8.101 -7.947 1.00 . A A . 14 THR OG1 1 1 18 32156 1 1 15 LYS C C -1.845 10.320 -10.444 1.00 . A A . 15 LYS C 1 1 18 32157 1 1 15 LYS CA C -0.546 11.087 -10.700 1.00 . A A . 15 LYS CA 1 1 18 32158 1 1 15 LYS CB C -0.077 11.035 -12.155 1.00 . A A . 15 LYS CB 1 1 18 32159 1 1 15 LYS CD C -1.085 11.163 -14.464 1.00 . A A . 15 LYS CD 1 1 18 32160 1 1 15 LYS CE C -2.345 11.589 -15.219 1.00 . A A . 15 LYS CE 1 1 18 32161 1 1 15 LYS CG C -1.043 11.793 -13.070 1.00 . A A . 15 LYS CG 1 1 18 32162 1 1 15 LYS H H 1.261 10.144 -10.271 1.00 . A A . 15 LYS H 1 1 18 32163 1 1 15 LYS HA H -0.710 12.136 -10.451 1.00 . A A . 15 LYS HA 1 1 18 32164 1 1 15 LYS HB2 H 0.920 11.467 -12.236 1.00 . A A . 15 LYS HB2 1 1 18 32165 1 1 15 LYS HB3 H -0.002 9.998 -12.480 1.00 . A A . 15 LYS HB3 1 1 18 32166 1 1 15 LYS HD2 H -0.200 11.460 -15.027 1.00 . A A . 15 LYS HD2 1 1 18 32167 1 1 15 LYS HD3 H -1.058 10.077 -14.377 1.00 . A A . 15 LYS HD3 1 1 18 32168 1 1 15 LYS HE2 H -2.534 10.899 -16.042 1.00 . A A . 15 LYS HE2 1 1 18 32169 1 1 15 LYS HE3 H -3.208 11.539 -14.556 1.00 . A A . 15 LYS HE3 1 1 18 32170 1 1 15 LYS HG2 H -2.042 11.787 -12.634 1.00 . A A . 15 LYS HG2 1 1 18 32171 1 1 15 LYS HG3 H -0.734 12.835 -13.146 1.00 . A A . 15 LYS HG3 1 1 18 32172 1 1 15 LYS HZ1 H -2.667 13.087 -16.633 1.00 . A A . 15 LYS HZ1 1 1 18 32173 1 1 15 LYS HZ2 H -2.578 13.657 -15.111 1.00 . A A . 15 LYS HZ2 1 1 18 32174 1 1 15 LYS N N 0.490 10.586 -9.813 1.00 . A A . 15 LYS N 1 1 18 32175 1 1 15 LYS NZ N -2.194 12.965 -15.744 1.00 . A A . 15 LYS NZ 1 1 18 32176 1 1 15 LYS O O -2.908 10.717 -10.919 1.00 . A A . 15 LYS O 1 1 18 32177 1 1 16 GLN C C -3.019 8.281 -7.854 1.00 . A A . 16 GLN C 1 1 18 32178 1 1 16 GLN CA C -2.868 8.409 -9.372 1.00 . A A . 16 GLN CA 1 1 18 32179 1 1 16 GLN CB C -2.757 7.032 -10.030 1.00 . A A . 16 GLN CB 1 1 18 32180 1 1 16 GLN CD C -3.611 6.874 -12.397 1.00 . A A . 16 GLN CD 1 1 18 32181 1 1 16 GLN CG C -2.397 7.161 -11.511 1.00 . A A . 16 GLN CG 1 1 18 32182 1 1 16 GLN H H -0.849 8.919 -9.313 1.00 . A A . 16 GLN H 1 1 18 32183 1 1 16 GLN HA H -3.728 8.935 -9.786 1.00 . A A . 16 GLN HA 1 1 18 32184 1 1 16 GLN HB2 H -1.998 6.440 -9.518 1.00 . A A . 16 GLN HB2 1 1 18 32185 1 1 16 GLN HB3 H -3.701 6.498 -9.926 1.00 . A A . 16 GLN HB3 1 1 18 32186 1 1 16 GLN HE21 H -3.676 5.005 -11.622 1.00 . A A . 16 GLN HE21 1 1 18 32187 1 1 16 GLN HE22 H -4.897 5.362 -12.798 1.00 . A A . 16 GLN HE22 1 1 18 32188 1 1 16 GLN HG2 H -2.024 8.165 -11.713 1.00 . A A . 16 GLN HG2 1 1 18 32189 1 1 16 GLN HG3 H -1.593 6.467 -11.755 1.00 . A A . 16 GLN HG3 1 1 18 32190 1 1 16 GLN N N -1.717 9.235 -9.695 1.00 . A A . 16 GLN N 1 1 18 32191 1 1 16 GLN NE2 N -4.102 5.645 -12.261 1.00 . A A . 16 GLN NE2 1 1 18 32192 1 1 16 GLN O O -2.341 7.470 -7.226 1.00 . A A . 16 GLN O 1 1 18 32193 1 1 16 GLN OE1 O -4.072 7.713 -13.154 1.00 . A A . 16 GLN OE1 1 1 18 32194 1 1 17 PRO C C -5.005 7.874 -5.461 1.00 . A A . 17 PRO C 1 1 18 32195 1 1 17 PRO CA C -4.186 9.102 -5.864 1.00 . A A . 17 PRO CA 1 1 18 32196 1 1 17 PRO CB C -4.901 10.413 -5.578 1.00 . A A . 17 PRO CB 1 1 18 32197 1 1 17 PRO CD C -4.759 10.087 -8.009 1.00 . A A . 17 PRO CD 1 1 18 32198 1 1 17 PRO CG C -5.438 10.896 -6.916 1.00 . A A . 17 PRO CG 1 1 18 32199 1 1 17 PRO HA H -3.324 9.033 -5.363 1.00 . A A . 17 PRO HA 1 1 18 32200 1 1 17 PRO HB2 H -5.709 10.268 -4.862 1.00 . A A . 17 PRO HB2 1 1 18 32201 1 1 17 PRO HB3 H -4.218 11.143 -5.144 1.00 . A A . 17 PRO HB3 1 1 18 32202 1 1 17 PRO HD2 H -5.491 9.594 -8.649 1.00 . A A . 17 PRO HD2 1 1 18 32203 1 1 17 PRO HD3 H -4.151 10.724 -8.653 1.00 . A A . 17 PRO HD3 1 1 18 32204 1 1 17 PRO HG2 H -6.519 10.768 -6.962 1.00 . A A . 17 PRO HG2 1 1 18 32205 1 1 17 PRO HG3 H -5.237 11.959 -7.046 1.00 . A A . 17 PRO HG3 1 1 18 32206 1 1 17 PRO N N -3.937 9.115 -7.296 1.00 . A A . 17 PRO N 1 1 18 32207 1 1 17 PRO O O -5.703 7.290 -6.288 1.00 . A A . 17 PRO O 1 1 18 32208 1 1 18 VAL C C -6.139 6.699 -2.268 1.00 . A A . 18 VAL C 1 1 18 32209 1 1 18 VAL CA C -5.613 6.371 -3.666 1.00 . A A . 18 VAL CA 1 1 18 32210 1 1 18 VAL CB C -4.715 5.133 -3.692 1.00 . A A . 18 VAL CB 1 1 18 32211 1 1 18 VAL CG1 C -5.321 3.998 -2.865 1.00 . A A . 18 VAL CG1 1 1 18 32212 1 1 18 VAL CG2 C -4.446 4.681 -5.129 1.00 . A A . 18 VAL CG2 1 1 18 32213 1 1 18 VAL H H -4.323 8.000 -3.523 1.00 . A A . 18 VAL H 1 1 18 32214 1 1 18 VAL HA H -6.461 6.187 -4.326 1.00 . A A . 18 VAL HA 1 1 18 32215 1 1 18 VAL HB H -3.759 5.402 -3.242 1.00 . A A . 18 VAL HB 1 1 18 32216 1 1 18 VAL HG11 H -5.464 4.334 -1.838 1.00 . A A . 18 VAL HG11 1 1 18 32217 1 1 18 VAL HG12 H -6.282 3.711 -3.291 1.00 . A A . 18 VAL HG12 1 1 18 32218 1 1 18 VAL HG13 H -4.648 3.140 -2.876 1.00 . A A . 18 VAL HG13 1 1 18 32219 1 1 18 VAL HG21 H -3.969 5.490 -5.681 1.00 . A A . 18 VAL HG21 1 1 18 32220 1 1 18 VAL HG22 H -3.788 3.811 -5.119 1.00 . A A . 18 VAL HG22 1 1 18 32221 1 1 18 VAL HG23 H -5.388 4.418 -5.610 1.00 . A A . 18 VAL HG23 1 1 18 32222 1 1 18 VAL N N -4.892 7.519 -4.189 1.00 . A A . 18 VAL N 1 1 18 32223 1 1 18 VAL O O -5.590 7.557 -1.579 1.00 . A A . 18 VAL O 1 1 18 32224 1 1 19 VAL C C -7.805 4.882 0.187 1.00 . A A . 19 VAL C 1 1 18 32225 1 1 19 VAL CA C -7.804 6.203 -0.585 1.00 . A A . 19 VAL CA 1 1 18 32226 1 1 19 VAL CB C -9.203 6.801 -0.747 1.00 . A A . 19 VAL CB 1 1 18 32227 1 1 19 VAL CG1 C -9.995 6.705 0.559 1.00 . A A . 19 VAL CG1 1 1 18 32228 1 1 19 VAL CG2 C -9.127 8.248 -1.238 1.00 . A A . 19 VAL CG2 1 1 18 32229 1 1 19 VAL H H -7.638 5.300 -2.455 1.00 . A A . 19 VAL H 1 1 18 32230 1 1 19 VAL HA H -7.189 6.924 -0.046 1.00 . A A . 19 VAL HA 1 1 18 32231 1 1 19 VAL HB H -9.731 6.219 -1.502 1.00 . A A . 19 VAL HB 1 1 18 32232 1 1 19 VAL HG11 H -10.066 5.662 0.865 1.00 . A A . 19 VAL HG11 1 1 18 32233 1 1 19 VAL HG12 H -9.487 7.279 1.334 1.00 . A A . 19 VAL HG12 1 1 18 32234 1 1 19 VAL HG13 H -10.997 7.108 0.407 1.00 . A A . 19 VAL HG13 1 1 18 32235 1 1 19 VAL HG21 H -8.118 8.460 -1.589 1.00 . A A . 19 VAL HG21 1 1 18 32236 1 1 19 VAL HG22 H -9.834 8.392 -2.056 1.00 . A A . 19 VAL HG22 1 1 18 32237 1 1 19 VAL HG23 H -9.377 8.923 -0.419 1.00 . A A . 19 VAL HG23 1 1 18 32238 1 1 19 VAL N N -7.198 5.997 -1.889 1.00 . A A . 19 VAL N 1 1 18 32239 1 1 19 VAL O O -8.488 3.934 -0.198 1.00 . A A . 19 VAL O 1 1 18 32240 1 1 20 PHE C C -7.803 3.803 3.342 1.00 . A A . 20 PHE C 1 1 18 32241 1 1 20 PHE CA C -6.932 3.672 2.091 1.00 . A A . 20 PHE CA 1 1 18 32242 1 1 20 PHE CB C -5.465 3.573 2.514 1.00 . A A . 20 PHE CB 1 1 18 32243 1 1 20 PHE CD1 C -4.984 1.143 2.983 1.00 . A A . 20 PHE CD1 1 1 18 32244 1 1 20 PHE CD2 C -5.094 2.654 4.832 1.00 . A A . 20 PHE CD2 1 1 18 32245 1 1 20 PHE CE1 C -4.707 0.056 3.887 1.00 . A A . 20 PHE CE1 1 1 18 32246 1 1 20 PHE CE2 C -4.817 1.567 5.736 1.00 . A A . 20 PHE CE2 1 1 18 32247 1 1 20 PHE CG C -5.172 2.418 3.474 1.00 . A A . 20 PHE CG 1 1 18 32248 1 1 20 PHE CZ C -4.638 0.322 5.219 1.00 . A A . 20 PHE CZ 1 1 18 32249 1 1 20 PHE H H -6.478 5.637 1.568 1.00 . A A . 20 PHE H 1 1 18 32250 1 1 20 PHE HA H -7.279 2.823 1.503 1.00 . A A . 20 PHE HA 1 1 18 32251 1 1 20 PHE HB2 H -4.848 3.456 1.622 1.00 . A A . 20 PHE HB2 1 1 18 32252 1 1 20 PHE HB3 H -5.169 4.509 2.986 1.00 . A A . 20 PHE HB3 1 1 18 32253 1 1 20 PHE HD1 H -5.045 0.957 1.911 1.00 . A A . 20 PHE HD1 1 1 18 32254 1 1 20 PHE HD2 H -5.242 3.661 5.220 1.00 . A A . 20 PHE HD2 1 1 18 32255 1 1 20 PHE HE1 H -4.557 -0.956 3.512 1.00 . A A . 20 PHE HE1 1 1 18 32256 1 1 20 PHE HE2 H -4.753 1.739 6.811 1.00 . A A . 20 PHE HE2 1 1 18 32257 1 1 20 PHE HZ H -4.397 -0.581 5.835 1.00 . A A . 20 PHE HZ 1 1 18 32258 1 1 20 PHE N N -7.030 4.862 1.262 1.00 . A A . 20 PHE N 1 1 18 32259 1 1 20 PHE O O -8.009 4.905 3.848 1.00 . A A . 20 PHE O 1 1 18 32260 1 1 21 ASN C C -8.519 1.697 6.029 1.00 . A A . 21 ASN C 1 1 18 32261 1 1 21 ASN CA C -9.136 2.635 4.989 1.00 . A A . 21 ASN CA 1 1 18 32262 1 1 21 ASN CB C -10.535 2.115 4.654 1.00 . A A . 21 ASN CB 1 1 18 32263 1 1 21 ASN CG C -11.193 2.970 3.569 1.00 . A A . 21 ASN CG 1 1 18 32264 1 1 21 ASN H H -8.119 1.769 3.390 1.00 . A A . 21 ASN H 1 1 18 32265 1 1 21 ASN HA H -9.180 3.668 5.333 1.00 . A A . 21 ASN HA 1 1 18 32266 1 1 21 ASN HB2 H -10.472 1.080 4.319 1.00 . A A . 21 ASN HB2 1 1 18 32267 1 1 21 ASN HB3 H -11.154 2.122 5.552 1.00 . A A . 21 ASN HB3 1 1 18 32268 1 1 21 ASN HD21 H -11.676 4.324 4.994 1.00 . A A . 21 ASN HD21 1 1 18 32269 1 1 21 ASN HD22 H -12.181 4.728 3.387 1.00 . A A . 21 ASN HD22 1 1 18 32270 1 1 21 ASN N N -8.292 2.662 3.806 1.00 . A A . 21 ASN N 1 1 18 32271 1 1 21 ASN ND2 N -11.727 4.101 4.021 1.00 . A A . 21 ASN ND2 1 1 18 32272 1 1 21 ASN O O -8.176 0.558 5.717 1.00 . A A . 21 ASN O 1 1 18 32273 1 1 21 ASN OD1 O -11.213 2.625 2.399 1.00 . A A . 21 ASN OD1 1 1 18 32274 1 1 22 HIS C C -8.909 0.540 8.944 1.00 . A A . 22 HIS C 1 1 18 32275 1 1 22 HIS CA C -7.829 1.434 8.332 1.00 . A A . 22 HIS CA 1 1 18 32276 1 1 22 HIS CB C -7.162 2.349 9.361 1.00 . A A . 22 HIS CB 1 1 18 32277 1 1 22 HIS CD2 C -4.564 2.077 9.281 1.00 . A A . 22 HIS CD2 1 1 18 32278 1 1 22 HIS CE1 C -4.091 3.917 8.196 1.00 . A A . 22 HIS CE1 1 1 18 32279 1 1 22 HIS CG C -5.738 2.720 9.023 1.00 . A A . 22 HIS CG 1 1 18 32280 1 1 22 HIS H H -8.680 3.139 7.490 1.00 . A A . 22 HIS H 1 1 18 32281 1 1 22 HIS HA H -7.053 0.805 7.895 1.00 . A A . 22 HIS HA 1 1 18 32282 1 1 22 HIS HB2 H -7.751 3.261 9.458 1.00 . A A . 22 HIS HB2 1 1 18 32283 1 1 22 HIS HB3 H -7.177 1.856 10.333 1.00 . A A . 22 HIS HB3 1 1 18 32284 1 1 22 HIS HD1 H -6.053 4.565 8.007 1.00 . A A . 22 HIS HD1 1 1 18 32285 1 1 22 HIS HD2 H -4.459 1.129 9.810 1.00 . A A . 22 HIS HD2 1 1 18 32286 1 1 22 HIS HE1 H -3.524 4.704 7.700 1.00 . A A . 22 HIS HE1 1 1 18 32287 1 1 22 HIS N N -8.398 2.211 7.244 1.00 . A A . 22 HIS N 1 1 18 32288 1 1 22 HIS ND1 N -5.407 3.877 8.338 1.00 . A A . 22 HIS ND1 1 1 18 32289 1 1 22 HIS NE2 N -3.570 2.800 8.781 1.00 . A A . 22 HIS NE2 1 1 18 32290 1 1 22 HIS O O -8.601 -0.486 9.547 1.00 . A A . 22 HIS O 1 1 18 32291 1 1 23 SER C C -11.540 -1.019 8.429 1.00 . A A . 23 SER C 1 1 18 32292 1 1 23 SER CA C -11.279 0.214 9.295 1.00 . A A . 23 SER CA 1 1 18 32293 1 1 23 SER CB C -12.535 1.086 9.368 1.00 . A A . 23 SER CB 1 1 18 32294 1 1 23 SER H H -10.394 1.800 8.275 1.00 . A A . 23 SER H 1 1 18 32295 1 1 23 SER HA H -10.984 -0.081 10.302 1.00 . A A . 23 SER HA 1 1 18 32296 1 1 23 SER HB2 H -13.370 0.488 9.732 1.00 . A A . 23 SER HB2 1 1 18 32297 1 1 23 SER HB3 H -12.378 1.887 10.090 1.00 . A A . 23 SER HB3 1 1 18 32298 1 1 23 SER HG H -13.651 2.263 8.197 1.00 . A A . 23 SER HG 1 1 18 32299 1 1 23 SER N N -10.152 0.963 8.767 1.00 . A A . 23 SER N 1 1 18 32300 1 1 23 SER O O -12.431 -1.814 8.725 1.00 . A A . 23 SER O 1 1 18 32301 1 1 23 SER OG O -12.869 1.647 8.102 1.00 . A A . 23 SER OG 1 1 18 32302 1 1 24 THR C C -9.763 -3.282 6.703 1.00 . A A . 24 THR C 1 1 18 32303 1 1 24 THR CA C -10.880 -2.264 6.463 1.00 . A A . 24 THR CA 1 1 18 32304 1 1 24 THR CB C -10.904 -1.714 5.035 1.00 . A A . 24 THR CB 1 1 18 32305 1 1 24 THR CG2 C -11.016 -2.819 3.983 1.00 . A A . 24 THR CG2 1 1 18 32306 1 1 24 THR H H -10.024 -0.491 7.141 1.00 . A A . 24 THR H 1 1 18 32307 1 1 24 THR HA H -11.823 -2.768 6.674 1.00 . A A . 24 THR HA 1 1 18 32308 1 1 24 THR HB H -10.035 -1.083 4.847 1.00 . A A . 24 THR HB 1 1 18 32309 1 1 24 THR HG1 H -12.016 -0.053 5.140 1.00 . A A . 24 THR HG1 1 1 18 32310 1 1 24 THR HG21 H -11.134 -3.783 4.480 1.00 . A A . 24 THR HG21 1 1 18 32311 1 1 24 THR HG22 H -11.880 -2.630 3.348 1.00 . A A . 24 THR HG22 1 1 18 32312 1 1 24 THR HG23 H -10.112 -2.833 3.374 1.00 . A A . 24 THR HG23 1 1 18 32313 1 1 24 THR N N -10.746 -1.141 7.375 1.00 . A A . 24 THR N 1 1 18 32314 1 1 24 THR O O -9.972 -4.485 6.551 1.00 . A A . 24 THR O 1 1 18 32315 1 1 24 THR OG1 O -12.149 -1.026 4.949 1.00 . A A . 24 THR OG1 1 1 18 32316 1 1 25 HIS C C -7.277 -3.786 8.846 1.00 . A A . 25 HIS C 1 1 18 32317 1 1 25 HIS CA C -7.452 -3.611 7.336 1.00 . A A . 25 HIS CA 1 1 18 32318 1 1 25 HIS CB C -6.201 -3.056 6.654 1.00 . A A . 25 HIS CB 1 1 18 32319 1 1 25 HIS CD2 C -5.841 -3.685 4.142 1.00 . A A . 25 HIS CD2 1 1 18 32320 1 1 25 HIS CE1 C -6.959 -2.032 3.244 1.00 . A A . 25 HIS CE1 1 1 18 32321 1 1 25 HIS CG C -6.330 -2.914 5.156 1.00 . A A . 25 HIS CG 1 1 18 32322 1 1 25 HIS H H -8.441 -1.783 7.195 1.00 . A A . 25 HIS H 1 1 18 32323 1 1 25 HIS HA H -7.672 -4.582 6.890 1.00 . A A . 25 HIS HA 1 1 18 32324 1 1 25 HIS HB2 H -5.968 -2.081 7.082 1.00 . A A . 25 HIS HB2 1 1 18 32325 1 1 25 HIS HB3 H -5.358 -3.711 6.875 1.00 . A A . 25 HIS HB3 1 1 18 32326 1 1 25 HIS HD1 H -7.506 -1.143 5.037 1.00 . A A . 25 HIS HD1 1 1 18 32327 1 1 25 HIS HD2 H -5.240 -4.586 4.260 1.00 . A A . 25 HIS HD2 1 1 18 32328 1 1 25 HIS HE1 H -7.410 -1.377 2.498 1.00 . A A . 25 HIS HE1 1 1 18 32329 1 1 25 HIS N N -8.602 -2.763 7.074 1.00 . A A . 25 HIS N 1 1 18 32330 1 1 25 HIS ND1 N -7.029 -1.880 4.558 1.00 . A A . 25 HIS ND1 1 1 18 32331 1 1 25 HIS NE2 N -6.223 -3.151 2.988 1.00 . A A . 25 HIS NE2 1 1 18 32332 1 1 25 HIS O O -6.152 -3.846 9.341 1.00 . A A . 25 HIS O 1 1 18 32333 1 1 26 LYS C C -7.860 -5.419 11.323 1.00 . A A . 26 LYS C 1 1 18 32334 1 1 26 LYS CA C -8.391 -4.026 10.979 1.00 . A A . 26 LYS CA 1 1 18 32335 1 1 26 LYS CB C -9.772 -3.732 11.567 1.00 . A A . 26 LYS CB 1 1 18 32336 1 1 26 LYS CD C -11.685 -2.092 11.658 1.00 . A A . 26 LYS CD 1 1 18 32337 1 1 26 LYS CE C -11.597 -1.368 13.003 1.00 . A A . 26 LYS CE 1 1 18 32338 1 1 26 LYS CG C -10.291 -2.373 11.094 1.00 . A A . 26 LYS CG 1 1 18 32339 1 1 26 LYS H H -9.316 -3.811 9.126 1.00 . A A . 26 LYS H 1 1 18 32340 1 1 26 LYS HA H -7.703 -3.285 11.386 1.00 . A A . 26 LYS HA 1 1 18 32341 1 1 26 LYS HB2 H -10.471 -4.515 11.272 1.00 . A A . 26 LYS HB2 1 1 18 32342 1 1 26 LYS HB3 H -9.719 -3.747 12.655 1.00 . A A . 26 LYS HB3 1 1 18 32343 1 1 26 LYS HD2 H -12.252 -1.485 10.951 1.00 . A A . 26 LYS HD2 1 1 18 32344 1 1 26 LYS HD3 H -12.228 -3.029 11.780 1.00 . A A . 26 LYS HD3 1 1 18 32345 1 1 26 LYS HE2 H -11.925 -2.033 13.802 1.00 . A A . 26 LYS HE2 1 1 18 32346 1 1 26 LYS HE3 H -10.561 -1.105 13.214 1.00 . A A . 26 LYS HE3 1 1 18 32347 1 1 26 LYS HG2 H -9.603 -1.588 11.408 1.00 . A A . 26 LYS HG2 1 1 18 32348 1 1 26 LYS HG3 H -10.324 -2.351 10.005 1.00 . A A . 26 LYS HG3 1 1 18 32349 1 1 26 LYS HZ1 H -12.145 0.518 13.700 1.00 . A A . 26 LYS HZ1 1 1 18 32350 1 1 26 LYS HZ2 H -12.388 0.335 12.100 1.00 . A A . 26 LYS HZ2 1 1 18 32351 1 1 26 LYS N N -8.405 -3.861 9.536 1.00 . A A . 26 LYS N 1 1 18 32352 1 1 26 LYS NZ N -12.433 -0.147 12.991 1.00 . A A . 26 LYS NZ 1 1 18 32353 1 1 26 LYS O O -7.111 -5.582 12.286 1.00 . A A . 26 LYS O 1 1 18 32354 1 1 27 SER C C -6.376 -7.923 10.323 1.00 . A A . 27 SER C 1 1 18 32355 1 1 27 SER CA C -7.844 -7.763 10.725 1.00 . A A . 27 SER CA 1 1 18 32356 1 1 27 SER CB C -8.720 -8.736 9.934 1.00 . A A . 27 SER CB 1 1 18 32357 1 1 27 SER H H -8.877 -6.248 9.737 1.00 . A A . 27 SER H 1 1 18 32358 1 1 27 SER HA H -7.970 -7.946 11.792 1.00 . A A . 27 SER HA 1 1 18 32359 1 1 27 SER HB2 H -9.413 -8.172 9.308 1.00 . A A . 27 SER HB2 1 1 18 32360 1 1 27 SER HB3 H -8.094 -9.326 9.265 1.00 . A A . 27 SER HB3 1 1 18 32361 1 1 27 SER HG H -10.290 -9.912 10.329 1.00 . A A . 27 SER HG 1 1 18 32362 1 1 27 SER N N -8.268 -6.389 10.518 1.00 . A A . 27 SER N 1 1 18 32363 1 1 27 SER O O -5.762 -8.952 10.600 1.00 . A A . 27 SER O 1 1 18 32364 1 1 27 SER OG O -9.456 -9.608 10.788 1.00 . A A . 27 SER OG 1 1 18 32365 1 1 28 VAL C C -3.583 -6.326 10.333 1.00 . A A . 28 VAL C 1 1 18 32366 1 1 28 VAL CA C -4.473 -6.905 9.231 1.00 . A A . 28 VAL CA 1 1 18 32367 1 1 28 VAL CB C -4.342 -6.157 7.903 1.00 . A A . 28 VAL CB 1 1 18 32368 1 1 28 VAL CG1 C -2.919 -6.264 7.352 1.00 . A A . 28 VAL CG1 1 1 18 32369 1 1 28 VAL CG2 C -5.364 -6.666 6.884 1.00 . A A . 28 VAL CG2 1 1 18 32370 1 1 28 VAL H H -6.364 -6.057 9.453 1.00 . A A . 28 VAL H 1 1 18 32371 1 1 28 VAL HA H -4.192 -7.944 9.063 1.00 . A A . 28 VAL HA 1 1 18 32372 1 1 28 VAL HB H -4.551 -5.104 8.089 1.00 . A A . 28 VAL HB 1 1 18 32373 1 1 28 VAL HG11 H -2.205 -6.035 8.143 1.00 . A A . 28 VAL HG11 1 1 18 32374 1 1 28 VAL HG12 H -2.745 -7.277 6.988 1.00 . A A . 28 VAL HG12 1 1 18 32375 1 1 28 VAL HG13 H -2.793 -5.556 6.532 1.00 . A A . 28 VAL HG13 1 1 18 32376 1 1 28 VAL HG21 H -6.186 -7.155 7.407 1.00 . A A . 28 VAL HG21 1 1 18 32377 1 1 28 VAL HG22 H -5.749 -5.827 6.305 1.00 . A A . 28 VAL HG22 1 1 18 32378 1 1 28 VAL HG23 H -4.885 -7.380 6.214 1.00 . A A . 28 VAL HG23 1 1 18 32379 1 1 28 VAL N N -5.857 -6.891 9.675 1.00 . A A . 28 VAL N 1 1 18 32380 1 1 28 VAL O O -3.962 -5.365 11.001 1.00 . A A . 28 VAL O 1 1 18 32381 1 1 29 LYS C C -0.846 -5.167 11.059 1.00 . A A . 29 LYS C 1 1 18 32382 1 1 29 LYS CA C -1.471 -6.493 11.498 1.00 . A A . 29 LYS CA 1 1 18 32383 1 1 29 LYS CB C -0.444 -7.590 11.788 1.00 . A A . 29 LYS CB 1 1 18 32384 1 1 29 LYS CD C -0.240 -9.558 13.352 1.00 . A A . 29 LYS CD 1 1 18 32385 1 1 29 LYS CE C -1.003 -10.187 14.519 1.00 . A A . 29 LYS CE 1 1 18 32386 1 1 29 LYS CG C -0.543 -8.063 13.240 1.00 . A A . 29 LYS CG 1 1 18 32387 1 1 29 LYS H H -2.117 -7.716 9.941 1.00 . A A . 29 LYS H 1 1 18 32388 1 1 29 LYS HA H -2.030 -6.323 12.419 1.00 . A A . 29 LYS HA 1 1 18 32389 1 1 29 LYS HB2 H -0.607 -8.432 11.116 1.00 . A A . 29 LYS HB2 1 1 18 32390 1 1 29 LYS HB3 H 0.560 -7.215 11.591 1.00 . A A . 29 LYS HB3 1 1 18 32391 1 1 29 LYS HD2 H -0.513 -10.059 12.422 1.00 . A A . 29 LYS HD2 1 1 18 32392 1 1 29 LYS HD3 H 0.831 -9.707 13.491 1.00 . A A . 29 LYS HD3 1 1 18 32393 1 1 29 LYS HE2 H -2.033 -9.830 14.522 1.00 . A A . 29 LYS HE2 1 1 18 32394 1 1 29 LYS HE3 H -1.041 -11.269 14.396 1.00 . A A . 29 LYS HE3 1 1 18 32395 1 1 29 LYS HG2 H 0.157 -7.499 13.858 1.00 . A A . 29 LYS HG2 1 1 18 32396 1 1 29 LYS HG3 H -1.542 -7.861 13.625 1.00 . A A . 29 LYS HG3 1 1 18 32397 1 1 29 LYS HZ1 H 0.648 -9.716 15.701 1.00 . A A . 29 LYS HZ1 1 1 18 32398 1 1 29 LYS HZ2 H -0.723 -8.998 16.207 1.00 . A A . 29 LYS HZ2 1 1 18 32399 1 1 29 LYS N N -2.417 -6.935 10.489 1.00 . A A . 29 LYS N 1 1 18 32400 1 1 29 LYS NZ N -0.352 -9.851 15.805 1.00 . A A . 29 LYS NZ 1 1 18 32401 1 1 29 LYS O O -0.438 -5.020 9.908 1.00 . A A . 29 LYS O 1 1 18 32402 1 1 30 CYS C C 1.208 -3.121 11.215 1.00 . A A . 30 CYS C 1 1 18 32403 1 1 30 CYS CA C -0.222 -2.927 11.724 1.00 . A A . 30 CYS CA 1 1 18 32404 1 1 30 CYS CB C -0.271 -2.018 12.954 1.00 . A A . 30 CYS CB 1 1 18 32405 1 1 30 CYS H H -1.123 -4.363 12.934 1.00 . A A . 30 CYS H 1 1 18 32406 1 1 30 CYS HA H -0.847 -2.470 10.957 1.00 . A A . 30 CYS HA 1 1 18 32407 1 1 30 CYS HB2 H 0.567 -2.266 13.606 1.00 . A A . 30 CYS HB2 1 1 18 32408 1 1 30 CYS HB3 H -0.131 -0.986 12.632 1.00 . A A . 30 CYS HB3 1 1 18 32409 1 1 30 CYS N N -0.790 -4.236 12.000 1.00 . A A . 30 CYS N 1 1 18 32410 1 1 30 CYS O O 1.663 -2.390 10.337 1.00 . A A . 30 CYS O 1 1 18 32411 1 1 30 CYS SG S -1.819 -2.124 13.924 1.00 . A A . 30 CYS SG 1 1 18 32412 1 1 31 GLY C C 3.298 -5.063 10.023 1.00 . A A . 31 GLY C 1 1 18 32413 1 1 31 GLY CA C 3.246 -4.410 11.406 1.00 . A A . 31 GLY CA 1 1 18 32414 1 1 31 GLY H H 1.500 -4.700 12.504 1.00 . A A . 31 GLY H 1 1 18 32415 1 1 31 GLY HA2 H 3.835 -3.492 11.401 1.00 . A A . 31 GLY HA2 1 1 18 32416 1 1 31 GLY HA3 H 3.697 -5.074 12.143 1.00 . A A . 31 GLY HA3 1 1 18 32417 1 1 31 GLY N N 1.877 -4.110 11.790 1.00 . A A . 31 GLY N 1 1 18 32418 1 1 31 GLY O O 4.378 -5.326 9.497 1.00 . A A . 31 GLY O 1 1 18 32419 1 1 32 ASP C C 2.249 -4.864 7.085 1.00 . A A . 32 ASP C 1 1 18 32420 1 1 32 ASP CA C 2.013 -5.924 8.163 1.00 . A A . 32 ASP CA 1 1 18 32421 1 1 32 ASP CB C 0.621 -6.520 7.944 1.00 . A A . 32 ASP CB 1 1 18 32422 1 1 32 ASP CG C 0.492 -7.426 6.718 1.00 . A A . 32 ASP CG 1 1 18 32423 1 1 32 ASP H H 1.242 -5.089 9.909 1.00 . A A . 32 ASP H 1 1 18 32424 1 1 32 ASP HA H 2.773 -6.705 8.154 1.00 . A A . 32 ASP HA 1 1 18 32425 1 1 32 ASP HB2 H 0.343 -7.090 8.830 1.00 . A A . 32 ASP HB2 1 1 18 32426 1 1 32 ASP HB3 H -0.096 -5.705 7.851 1.00 . A A . 32 ASP HB3 1 1 18 32427 1 1 32 ASP N N 2.116 -5.306 9.474 1.00 . A A . 32 ASP N 1 1 18 32428 1 1 32 ASP O O 2.805 -5.161 6.029 1.00 . A A . 32 ASP O 1 1 18 32429 1 1 32 ASP OD1 O 0.960 -6.996 5.642 1.00 . A A . 32 ASP OD1 1 1 18 32430 1 1 32 ASP OD2 O -0.071 -8.530 6.885 1.00 . A A . 32 ASP OD2 1 1 18 32431 1 1 33 CYS C C 3.099 -1.644 6.968 1.00 . A A . 33 CYS C 1 1 18 32432 1 1 33 CYS CA C 1.972 -2.545 6.459 1.00 . A A . 33 CYS CA 1 1 18 32433 1 1 33 CYS CB C 0.664 -1.772 6.272 1.00 . A A . 33 CYS CB 1 1 18 32434 1 1 33 CYS H H 1.364 -3.416 8.250 1.00 . A A . 33 CYS H 1 1 18 32435 1 1 33 CYS HA H 2.231 -2.981 5.494 1.00 . A A . 33 CYS HA 1 1 18 32436 1 1 33 CYS HB2 H 0.073 -1.815 7.187 1.00 . A A . 33 CYS HB2 1 1 18 32437 1 1 33 CYS HB3 H 0.877 -0.721 6.079 1.00 . A A . 33 CYS HB3 1 1 18 32438 1 1 33 CYS N N 1.815 -3.650 7.389 1.00 . A A . 33 CYS N 1 1 18 32439 1 1 33 CYS O O 4.054 -1.370 6.244 1.00 . A A . 33 CYS O 1 1 18 32440 1 1 33 CYS SG S -0.289 -2.482 4.880 1.00 . A A . 33 CYS SG 1 1 18 32441 1 1 34 HIS C C 5.157 -1.174 9.243 1.00 . A A . 34 HIS C 1 1 18 32442 1 1 34 HIS CA C 3.942 -0.344 8.825 1.00 . A A . 34 HIS CA 1 1 18 32443 1 1 34 HIS CB C 3.333 0.442 9.988 1.00 . A A . 34 HIS CB 1 1 18 32444 1 1 34 HIS CD2 C 0.829 1.120 9.673 1.00 . A A . 34 HIS CD2 1 1 18 32445 1 1 34 HIS CE1 C 1.149 3.102 8.803 1.00 . A A . 34 HIS CE1 1 1 18 32446 1 1 34 HIS CG C 2.174 1.326 9.592 1.00 . A A . 34 HIS CG 1 1 18 32447 1 1 34 HIS H H 2.169 -1.436 8.793 1.00 . A A . 34 HIS H 1 1 18 32448 1 1 34 HIS HA H 4.248 0.373 8.063 1.00 . A A . 34 HIS HA 1 1 18 32449 1 1 34 HIS HB2 H 2.997 -0.260 10.751 1.00 . A A . 34 HIS HB2 1 1 18 32450 1 1 34 HIS HB3 H 4.109 1.059 10.441 1.00 . A A . 34 HIS HB3 1 1 18 32451 1 1 34 HIS HD1 H 3.222 3.025 8.850 1.00 . A A . 34 HIS HD1 1 1 18 32452 1 1 34 HIS HD2 H 0.343 0.225 10.062 1.00 . A A . 34 HIS HD2 1 1 18 32453 1 1 34 HIS HE1 H 0.950 4.082 8.370 1.00 . A A . 34 HIS HE1 1 1 18 32454 1 1 34 HIS N N 2.949 -1.208 8.210 1.00 . A A . 34 HIS N 1 1 18 32455 1 1 34 HIS ND1 N 2.345 2.583 9.039 1.00 . A A . 34 HIS ND1 1 1 18 32456 1 1 34 HIS NE2 N 0.211 2.194 9.197 1.00 . A A . 34 HIS NE2 1 1 18 32457 1 1 34 HIS O O 5.512 -1.214 10.420 1.00 . A A . 34 HIS O 1 1 18 32458 1 1 35 HIS C C 7.902 -1.898 9.420 1.00 . A A . 35 HIS C 1 1 18 32459 1 1 35 HIS CA C 6.930 -2.646 8.506 1.00 . A A . 35 HIS CA 1 1 18 32460 1 1 35 HIS CB C 7.574 -3.088 7.190 1.00 . A A . 35 HIS CB 1 1 18 32461 1 1 35 HIS CD2 C 7.711 -1.355 5.238 1.00 . A A . 35 HIS CD2 1 1 18 32462 1 1 35 HIS CE1 C 9.576 -0.372 5.824 1.00 . A A . 35 HIS CE1 1 1 18 32463 1 1 35 HIS CG C 8.156 -1.954 6.380 1.00 . A A . 35 HIS CG 1 1 18 32464 1 1 35 HIS H H 5.467 -1.781 7.300 1.00 . A A . 35 HIS H 1 1 18 32465 1 1 35 HIS HA H 6.575 -3.540 9.019 1.00 . A A . 35 HIS HA 1 1 18 32466 1 1 35 HIS HB2 H 8.363 -3.807 7.408 1.00 . A A . 35 HIS HB2 1 1 18 32467 1 1 35 HIS HB3 H 6.828 -3.606 6.588 1.00 . A A . 35 HIS HB3 1 1 18 32468 1 1 35 HIS HD1 H 9.904 -1.525 7.518 1.00 . A A . 35 HIS HD1 1 1 18 32469 1 1 35 HIS HD2 H 6.805 -1.617 4.693 1.00 . A A . 35 HIS HD2 1 1 18 32470 1 1 35 HIS HE1 H 10.431 0.305 5.820 1.00 . A A . 35 HIS HE1 1 1 18 32471 1 1 35 HIS N N 5.762 -1.818 8.255 1.00 . A A . 35 HIS N 1 1 18 32472 1 1 35 HIS ND1 N 9.333 -1.314 6.725 1.00 . A A . 35 HIS ND1 1 1 18 32473 1 1 35 HIS NE2 N 8.570 -0.399 4.904 1.00 . A A . 35 HIS NE2 1 1 18 32474 1 1 35 HIS O O 7.980 -0.672 9.379 1.00 . A A . 35 HIS O 1 1 18 32475 1 1 36 PRO C C 10.861 -1.656 10.433 1.00 . A A . 36 PRO C 1 1 18 32476 1 1 36 PRO CA C 9.601 -2.116 11.170 1.00 . A A . 36 PRO CA 1 1 18 32477 1 1 36 PRO CB C 9.875 -3.214 12.185 1.00 . A A . 36 PRO CB 1 1 18 32478 1 1 36 PRO CD C 8.571 -4.146 10.323 1.00 . A A . 36 PRO CD 1 1 18 32479 1 1 36 PRO CG C 9.416 -4.508 11.533 1.00 . A A . 36 PRO CG 1 1 18 32480 1 1 36 PRO HA H 9.223 -1.298 11.602 1.00 . A A . 36 PRO HA 1 1 18 32481 1 1 36 PRO HB2 H 10.935 -3.258 12.437 1.00 . A A . 36 PRO HB2 1 1 18 32482 1 1 36 PRO HB3 H 9.334 -3.031 13.114 1.00 . A A . 36 PRO HB3 1 1 18 32483 1 1 36 PRO HD2 H 8.961 -4.609 9.415 1.00 . A A . 36 PRO HD2 1 1 18 32484 1 1 36 PRO HD3 H 7.544 -4.490 10.439 1.00 . A A . 36 PRO HD3 1 1 18 32485 1 1 36 PRO HG2 H 10.274 -5.110 11.234 1.00 . A A . 36 PRO HG2 1 1 18 32486 1 1 36 PRO HG3 H 8.837 -5.106 12.238 1.00 . A A . 36 PRO HG3 1 1 18 32487 1 1 36 PRO N N 8.637 -2.690 10.246 1.00 . A A . 36 PRO N 1 1 18 32488 1 1 36 PRO O O 11.508 -2.448 9.749 1.00 . A A . 36 PRO O 1 1 18 32489 1 1 37 VAL C C 13.470 0.318 10.979 1.00 . A A . 37 VAL C 1 1 18 32490 1 1 37 VAL CA C 12.340 0.196 9.955 1.00 . A A . 37 VAL CA 1 1 18 32491 1 1 37 VAL CB C 11.976 1.533 9.304 1.00 . A A . 37 VAL CB 1 1 18 32492 1 1 37 VAL CG1 C 13.222 2.235 8.761 1.00 . A A . 37 VAL CG1 1 1 18 32493 1 1 37 VAL CG2 C 10.932 1.340 8.203 1.00 . A A . 37 VAL CG2 1 1 18 32494 1 1 37 VAL H H 10.638 0.258 11.155 1.00 . A A . 37 VAL H 1 1 18 32495 1 1 37 VAL HA H 12.653 -0.489 9.167 1.00 . A A . 37 VAL HA 1 1 18 32496 1 1 37 VAL HB H 11.540 2.171 10.072 1.00 . A A . 37 VAL HB 1 1 18 32497 1 1 37 VAL HG11 H 14.072 2.020 9.409 1.00 . A A . 37 VAL HG11 1 1 18 32498 1 1 37 VAL HG12 H 13.432 1.875 7.754 1.00 . A A . 37 VAL HG12 1 1 18 32499 1 1 37 VAL HG13 H 13.050 3.311 8.734 1.00 . A A . 37 VAL HG13 1 1 18 32500 1 1 37 VAL HG21 H 11.111 0.394 7.694 1.00 . A A . 37 VAL HG21 1 1 18 32501 1 1 37 VAL HG22 H 9.935 1.331 8.646 1.00 . A A . 37 VAL HG22 1 1 18 32502 1 1 37 VAL HG23 H 11.004 2.158 7.487 1.00 . A A . 37 VAL HG23 1 1 18 32503 1 1 37 VAL N N 11.170 -0.379 10.597 1.00 . A A . 37 VAL N 1 1 18 32504 1 1 37 VAL O O 13.391 1.126 11.903 1.00 . A A . 37 VAL O 1 1 18 32505 1 1 38 ASN C C 15.185 -0.883 13.082 1.00 . A A . 38 ASN C 1 1 18 32506 1 1 38 ASN CA C 15.641 -0.490 11.675 1.00 . A A . 38 ASN CA 1 1 18 32507 1 1 38 ASN CB C 16.271 0.901 11.754 1.00 . A A . 38 ASN CB 1 1 18 32508 1 1 38 ASN CG C 17.364 1.069 10.696 1.00 . A A . 38 ASN CG 1 1 18 32509 1 1 38 ASN H H 14.553 -1.150 10.026 1.00 . A A . 38 ASN H 1 1 18 32510 1 1 38 ASN HA H 16.341 -1.208 11.249 1.00 . A A . 38 ASN HA 1 1 18 32511 1 1 38 ASN HB2 H 15.503 1.661 11.612 1.00 . A A . 38 ASN HB2 1 1 18 32512 1 1 38 ASN HB3 H 16.694 1.058 12.746 1.00 . A A . 38 ASN HB3 1 1 18 32513 1 1 38 ASN HD21 H 18.280 2.396 11.919 1.00 . A A . 38 ASN HD21 1 1 18 32514 1 1 38 ASN HD22 H 19.079 2.105 10.410 1.00 . A A . 38 ASN HD22 1 1 18 32515 1 1 38 ASN N N 14.496 -0.496 10.780 1.00 . A A . 38 ASN N 1 1 18 32516 1 1 38 ASN ND2 N 18.320 1.928 11.036 1.00 . A A . 38 ASN ND2 1 1 18 32517 1 1 38 ASN O O 15.917 -0.692 14.052 1.00 . A A . 38 ASN O 1 1 18 32518 1 1 38 ASN OD1 O 17.340 0.458 9.640 1.00 . A A . 38 ASN OD1 1 1 18 32519 1 1 39 GLY C C 12.428 -0.803 14.955 1.00 . A A . 39 GLY C 1 1 18 32520 1 1 39 GLY CA C 13.414 -1.843 14.421 1.00 . A A . 39 GLY CA 1 1 18 32521 1 1 39 GLY H H 13.387 -1.574 12.356 1.00 . A A . 39 GLY H 1 1 18 32522 1 1 39 GLY HA2 H 12.908 -2.801 14.300 1.00 . A A . 39 GLY HA2 1 1 18 32523 1 1 39 GLY HA3 H 14.215 -1.995 15.145 1.00 . A A . 39 GLY HA3 1 1 18 32524 1 1 39 GLY N N 13.977 -1.423 13.149 1.00 . A A . 39 GLY N 1 1 18 32525 1 1 39 GLY O O 11.851 -0.981 16.026 1.00 . A A . 39 GLY O 1 1 18 32526 1 1 40 LYS C C 9.986 1.081 13.934 1.00 . A A . 40 LYS C 1 1 18 32527 1 1 40 LYS CA C 11.358 1.331 14.565 1.00 . A A . 40 LYS CA 1 1 18 32528 1 1 40 LYS CB C 11.958 2.694 14.212 1.00 . A A . 40 LYS CB 1 1 18 32529 1 1 40 LYS CD C 11.987 4.581 12.539 1.00 . A A . 40 LYS CD 1 1 18 32530 1 1 40 LYS CE C 12.957 4.504 11.358 1.00 . A A . 40 LYS CE 1 1 18 32531 1 1 40 LYS CG C 11.418 3.200 12.873 1.00 . A A . 40 LYS CG 1 1 18 32532 1 1 40 LYS H H 12.737 0.399 13.313 1.00 . A A . 40 LYS H 1 1 18 32533 1 1 40 LYS HA H 11.251 1.297 15.649 1.00 . A A . 40 LYS HA 1 1 18 32534 1 1 40 LYS HB2 H 11.724 3.413 14.997 1.00 . A A . 40 LYS HB2 1 1 18 32535 1 1 40 LYS HB3 H 13.044 2.616 14.165 1.00 . A A . 40 LYS HB3 1 1 18 32536 1 1 40 LYS HD2 H 11.173 5.266 12.301 1.00 . A A . 40 LYS HD2 1 1 18 32537 1 1 40 LYS HD3 H 12.501 4.987 13.411 1.00 . A A . 40 LYS HD3 1 1 18 32538 1 1 40 LYS HE2 H 12.607 3.762 10.641 1.00 . A A . 40 LYS HE2 1 1 18 32539 1 1 40 LYS HE3 H 12.984 5.462 10.839 1.00 . A A . 40 LYS HE3 1 1 18 32540 1 1 40 LYS HG2 H 11.677 2.496 12.082 1.00 . A A . 40 LYS HG2 1 1 18 32541 1 1 40 LYS HG3 H 10.330 3.250 12.910 1.00 . A A . 40 LYS HG3 1 1 18 32542 1 1 40 LYS HZ1 H 14.642 4.773 12.555 1.00 . A A . 40 LYS HZ1 1 1 18 32543 1 1 40 LYS HZ2 H 14.352 3.208 12.207 1.00 . A A . 40 LYS HZ2 1 1 18 32544 1 1 40 LYS N N 12.264 0.262 14.183 1.00 . A A . 40 LYS N 1 1 18 32545 1 1 40 LYS NZ N 14.315 4.148 11.826 1.00 . A A . 40 LYS NZ 1 1 18 32546 1 1 40 LYS O O 9.890 0.465 12.873 1.00 . A A . 40 LYS O 1 1 18 32547 1 1 41 GLU C C 6.625 2.187 15.021 1.00 . A A . 41 GLU C 1 1 18 32548 1 1 41 GLU CA C 7.598 1.409 14.132 1.00 . A A . 41 GLU CA 1 1 18 32549 1 1 41 GLU CB C 7.214 -0.071 14.063 1.00 . A A . 41 GLU CB 1 1 18 32550 1 1 41 GLU CD C 5.393 0.457 12.401 1.00 . A A . 41 GLU CD 1 1 18 32551 1 1 41 GLU CG C 6.612 -0.417 12.700 1.00 . A A . 41 GLU CG 1 1 18 32552 1 1 41 GLU H H 9.047 2.072 15.474 1.00 . A A . 41 GLU H 1 1 18 32553 1 1 41 GLU HA H 7.594 1.826 13.125 1.00 . A A . 41 GLU HA 1 1 18 32554 1 1 41 GLU HB2 H 8.095 -0.687 14.243 1.00 . A A . 41 GLU HB2 1 1 18 32555 1 1 41 GLU HB3 H 6.497 -0.301 14.851 1.00 . A A . 41 GLU HB3 1 1 18 32556 1 1 41 GLU HG2 H 7.362 -0.281 11.922 1.00 . A A . 41 GLU HG2 1 1 18 32557 1 1 41 GLU HG3 H 6.323 -1.468 12.684 1.00 . A A . 41 GLU HG3 1 1 18 32558 1 1 41 GLU N N 8.960 1.572 14.613 1.00 . A A . 41 GLU N 1 1 18 32559 1 1 41 GLU O O 6.314 1.758 16.131 1.00 . A A . 41 GLU O 1 1 18 32560 1 1 41 GLU OE1 O 5.614 1.614 11.980 1.00 . A A . 41 GLU OE1 1 1 18 32561 1 1 41 GLU OE2 O 4.268 -0.050 12.599 1.00 . A A . 41 GLU OE2 1 1 18 32562 1 1 42 ASP C C 4.276 4.821 14.246 1.00 . A A . 42 ASP C 1 1 18 32563 1 1 42 ASP CA C 5.241 4.159 15.231 1.00 . A A . 42 ASP CA 1 1 18 32564 1 1 42 ASP CB C 5.977 5.266 15.988 1.00 . A A . 42 ASP CB 1 1 18 32565 1 1 42 ASP CG C 6.533 4.856 17.353 1.00 . A A . 42 ASP CG 1 1 18 32566 1 1 42 ASP H H 6.429 3.658 13.595 1.00 . A A . 42 ASP H 1 1 18 32567 1 1 42 ASP HA H 4.734 3.489 15.925 1.00 . A A . 42 ASP HA 1 1 18 32568 1 1 42 ASP HB2 H 6.801 5.622 15.369 1.00 . A A . 42 ASP HB2 1 1 18 32569 1 1 42 ASP HB3 H 5.296 6.106 16.126 1.00 . A A . 42 ASP HB3 1 1 18 32570 1 1 42 ASP N N 6.172 3.317 14.499 1.00 . A A . 42 ASP N 1 1 18 32571 1 1 42 ASP O O 4.061 6.031 14.300 1.00 . A A . 42 ASP O 1 1 18 32572 1 1 42 ASP OD1 O 5.705 4.499 18.219 1.00 . A A . 42 ASP OD1 1 1 18 32573 1 1 42 ASP OD2 O 7.773 4.910 17.500 1.00 . A A . 42 ASP OD2 1 1 18 32574 1 1 43 TYR C C 3.351 5.703 11.635 1.00 . A A . 43 TYR C 1 1 18 32575 1 1 43 TYR CA C 2.782 4.490 12.373 1.00 . A A . 43 TYR CA 1 1 18 32576 1 1 43 TYR CB C 1.532 4.917 13.144 1.00 . A A . 43 TYR CB 1 1 18 32577 1 1 43 TYR CD1 C 1.289 2.522 13.896 1.00 . A A . 43 TYR CD1 1 1 18 32578 1 1 43 TYR CD2 C 0.246 4.231 15.201 1.00 . A A . 43 TYR CD2 1 1 18 32579 1 1 43 TYR CE1 C 0.793 1.523 14.807 1.00 . A A . 43 TYR CE1 1 1 18 32580 1 1 43 TYR CE2 C -0.250 3.232 16.112 1.00 . A A . 43 TYR CE2 1 1 18 32581 1 1 43 TYR CG C 1.005 3.855 14.112 1.00 . A A . 43 TYR CG 1 1 18 32582 1 1 43 TYR CZ C 0.048 1.928 15.870 1.00 . A A . 43 TYR CZ 1 1 18 32583 1 1 43 TYR H H 3.898 3.016 13.332 1.00 . A A . 43 TYR H 1 1 18 32584 1 1 43 TYR HA H 2.603 3.689 11.655 1.00 . A A . 43 TYR HA 1 1 18 32585 1 1 43 TYR HB2 H 1.755 5.825 13.703 1.00 . A A . 43 TYR HB2 1 1 18 32586 1 1 43 TYR HB3 H 0.745 5.166 12.432 1.00 . A A . 43 TYR HB3 1 1 18 32587 1 1 43 TYR HD1 H 1.889 2.226 13.035 1.00 . A A . 43 TYR HD1 1 1 18 32588 1 1 43 TYR HD2 H 0.021 5.284 15.372 1.00 . A A . 43 TYR HD2 1 1 18 32589 1 1 43 TYR HE1 H 1.010 0.467 14.648 1.00 . A A . 43 TYR HE1 1 1 18 32590 1 1 43 TYR HE2 H -0.851 3.516 16.977 1.00 . A A . 43 TYR HE2 1 1 18 32591 1 1 43 TYR HH H 0.207 0.206 16.759 1.00 . A A . 43 TYR HH 1 1 18 32592 1 1 43 TYR N N 3.719 3.999 13.369 1.00 . A A . 43 TYR N 1 1 18 32593 1 1 43 TYR O O 3.325 6.818 12.155 1.00 . A A . 43 TYR O 1 1 18 32594 1 1 43 TYR OH O -0.420 0.984 16.731 1.00 . A A . 43 TYR OH 1 1 18 32595 1 1 44 ARG C C 3.946 6.381 8.175 1.00 . A A . 44 ARG C 1 1 18 32596 1 1 44 ARG CA C 4.427 6.503 9.623 1.00 . A A . 44 ARG CA 1 1 18 32597 1 1 44 ARG CB C 5.956 6.450 9.651 1.00 . A A . 44 ARG CB 1 1 18 32598 1 1 44 ARG CD C 8.086 7.631 8.995 1.00 . A A . 44 ARG CD 1 1 18 32599 1 1 44 ARG CG C 6.560 7.627 8.882 1.00 . A A . 44 ARG CG 1 1 18 32600 1 1 44 ARG CZ C 9.789 9.106 10.081 1.00 . A A . 44 ARG CZ 1 1 18 32601 1 1 44 ARG H H 3.869 4.536 10.021 1.00 . A A . 44 ARG H 1 1 18 32602 1 1 44 ARG HA H 4.073 7.429 10.077 1.00 . A A . 44 ARG HA 1 1 18 32603 1 1 44 ARG HB2 H 6.305 6.468 10.683 1.00 . A A . 44 ARG HB2 1 1 18 32604 1 1 44 ARG HB3 H 6.299 5.512 9.215 1.00 . A A . 44 ARG HB3 1 1 18 32605 1 1 44 ARG HD2 H 8.438 6.649 9.312 1.00 . A A . 44 ARG HD2 1 1 18 32606 1 1 44 ARG HD3 H 8.530 7.829 8.019 1.00 . A A . 44 ARG HD3 1 1 18 32607 1 1 44 ARG HE H 7.829 9.052 10.574 1.00 . A A . 44 ARG HE 1 1 18 32608 1 1 44 ARG HG2 H 6.269 7.569 7.833 1.00 . A A . 44 ARG HG2 1 1 18 32609 1 1 44 ARG HG3 H 6.161 8.564 9.272 1.00 . A A . 44 ARG HG3 1 1 18 32610 1 1 44 ARG HH11 H 10.545 7.914 8.604 1.00 . A A . 44 ARG HH11 1 1 18 32611 1 1 44 ARG HH12 H 11.700 8.948 9.377 1.00 . A A . 44 ARG HH12 1 1 18 32612 1 1 44 ARG HH21 H 10.976 10.411 11.132 1.00 . A A . 44 ARG HH21 1 1 18 32613 1 1 44 ARG N N 3.852 5.446 10.436 1.00 . A A . 44 ARG N 1 1 18 32614 1 1 44 ARG NE N 8.519 8.661 9.965 1.00 . A A . 44 ARG NE 1 1 18 32615 1 1 44 ARG NH1 N 10.762 8.613 9.285 1.00 . A A . 44 ARG NH1 1 1 18 32616 1 1 44 ARG NH2 N 10.064 10.029 10.983 1.00 . A A . 44 ARG NH2 1 1 18 32617 1 1 44 ARG O O 3.752 5.275 7.674 1.00 . A A . 44 ARG O 1 1 18 32618 1 1 45 LYS C C 4.367 6.915 5.268 1.00 . A A . 45 LYS C 1 1 18 32619 1 1 45 LYS CA C 3.313 7.568 6.166 1.00 . A A . 45 LYS CA 1 1 18 32620 1 1 45 LYS CB C 2.957 8.998 5.755 1.00 . A A . 45 LYS CB 1 1 18 32621 1 1 45 LYS CD C 2.006 10.228 7.741 1.00 . A A . 45 LYS CD 1 1 18 32622 1 1 45 LYS CE C 0.818 11.083 8.188 1.00 . A A . 45 LYS CE 1 1 18 32623 1 1 45 LYS CG C 1.679 9.467 6.454 1.00 . A A . 45 LYS CG 1 1 18 32624 1 1 45 LYS H H 3.929 8.428 7.960 1.00 . A A . 45 LYS H 1 1 18 32625 1 1 45 LYS HA H 2.398 6.979 6.108 1.00 . A A . 45 LYS HA 1 1 18 32626 1 1 45 LYS HB2 H 3.780 9.668 6.006 1.00 . A A . 45 LYS HB2 1 1 18 32627 1 1 45 LYS HB3 H 2.824 9.049 4.675 1.00 . A A . 45 LYS HB3 1 1 18 32628 1 1 45 LYS HD2 H 2.267 9.522 8.529 1.00 . A A . 45 LYS HD2 1 1 18 32629 1 1 45 LYS HD3 H 2.877 10.863 7.581 1.00 . A A . 45 LYS HD3 1 1 18 32630 1 1 45 LYS HE2 H -0.012 10.954 7.495 1.00 . A A . 45 LYS HE2 1 1 18 32631 1 1 45 LYS HE3 H 0.471 10.751 9.167 1.00 . A A . 45 LYS HE3 1 1 18 32632 1 1 45 LYS HG2 H 1.108 10.109 5.783 1.00 . A A . 45 LYS HG2 1 1 18 32633 1 1 45 LYS HG3 H 1.050 8.608 6.685 1.00 . A A . 45 LYS HG3 1 1 18 32634 1 1 45 LYS HZ1 H 1.770 12.787 7.456 1.00 . A A . 45 LYS HZ1 1 1 18 32635 1 1 45 LYS HZ2 H 0.394 13.122 8.260 1.00 . A A . 45 LYS HZ2 1 1 18 32636 1 1 45 LYS N N 3.768 7.532 7.545 1.00 . A A . 45 LYS N 1 1 18 32637 1 1 45 LYS NZ N 1.203 12.511 8.251 1.00 . A A . 45 LYS NZ 1 1 18 32638 1 1 45 LYS O O 5.561 7.169 5.421 1.00 . A A . 45 LYS O 1 1 18 32639 1 1 46 CYS C C 5.504 6.444 2.590 1.00 . A A . 46 CYS C 1 1 18 32640 1 1 46 CYS CA C 4.772 5.396 3.431 1.00 . A A . 46 CYS CA 1 1 18 32641 1 1 46 CYS CB C 4.012 4.394 2.560 1.00 . A A . 46 CYS CB 1 1 18 32642 1 1 46 CYS H H 2.914 5.886 4.235 1.00 . A A . 46 CYS H 1 1 18 32643 1 1 46 CYS HA H 5.476 4.828 4.040 1.00 . A A . 46 CYS HA 1 1 18 32644 1 1 46 CYS HB2 H 3.612 4.919 1.692 1.00 . A A . 46 CYS HB2 1 1 18 32645 1 1 46 CYS HB3 H 4.716 3.651 2.186 1.00 . A A . 46 CYS HB3 1 1 18 32646 1 1 46 CYS N N 3.887 6.087 4.352 1.00 . A A . 46 CYS N 1 1 18 32647 1 1 46 CYS O O 6.732 6.439 2.517 1.00 . A A . 46 CYS O 1 1 18 32648 1 1 46 CYS SG S 2.639 3.528 3.405 1.00 . A A . 46 CYS SG 1 1 18 32649 1 1 47 GLY C C 5.856 9.497 2.000 1.00 . A A . 47 GLY C 1 1 18 32650 1 1 47 GLY CA C 5.277 8.369 1.144 1.00 . A A . 47 GLY CA 1 1 18 32651 1 1 47 GLY H H 3.721 7.314 2.042 1.00 . A A . 47 GLY H 1 1 18 32652 1 1 47 GLY HA2 H 6.056 7.955 0.504 1.00 . A A . 47 GLY HA2 1 1 18 32653 1 1 47 GLY HA3 H 4.503 8.766 0.487 1.00 . A A . 47 GLY HA3 1 1 18 32654 1 1 47 GLY N N 4.719 7.317 1.977 1.00 . A A . 47 GLY N 1 1 18 32655 1 1 47 GLY O O 5.517 10.663 1.807 1.00 . A A . 47 GLY O 1 1 18 32656 1 1 48 THR C C 8.704 10.509 3.251 1.00 . A A . 48 THR C 1 1 18 32657 1 1 48 THR CA C 7.350 10.073 3.813 1.00 . A A . 48 THR CA 1 1 18 32658 1 1 48 THR CB C 7.443 9.446 5.205 1.00 . A A . 48 THR CB 1 1 18 32659 1 1 48 THR CG2 C 8.445 10.169 6.107 1.00 . A A . 48 THR CG2 1 1 18 32660 1 1 48 THR H H 6.990 8.158 3.076 1.00 . A A . 48 THR H 1 1 18 32661 1 1 48 THR HA H 6.720 10.962 3.856 1.00 . A A . 48 THR HA 1 1 18 32662 1 1 48 THR HB H 7.675 8.383 5.138 1.00 . A A . 48 THR HB 1 1 18 32663 1 1 48 THR HG1 H 6.095 9.245 6.671 1.00 . A A . 48 THR HG1 1 1 18 32664 1 1 48 THR HG21 H 8.480 11.224 5.839 1.00 . A A . 48 THR HG21 1 1 18 32665 1 1 48 THR HG22 H 8.135 10.069 7.147 1.00 . A A . 48 THR HG22 1 1 18 32666 1 1 48 THR HG23 H 9.433 9.728 5.979 1.00 . A A . 48 THR HG23 1 1 18 32667 1 1 48 THR N N 6.720 9.109 2.927 1.00 . A A . 48 THR N 1 1 18 32668 1 1 48 THR O O 9.503 9.674 2.830 1.00 . A A . 48 THR O 1 1 18 32669 1 1 48 THR OG1 O 6.177 9.725 5.797 1.00 . A A . 48 THR OG1 1 1 18 32670 1 1 49 ALA C C 11.342 11.712 3.477 1.00 . A A . 49 ALA C 1 1 18 32671 1 1 49 ALA CA C 10.165 12.373 2.758 1.00 . A A . 49 ALA CA 1 1 18 32672 1 1 49 ALA CB C 10.153 13.893 2.935 1.00 . A A . 49 ALA CB 1 1 18 32673 1 1 49 ALA H H 8.266 12.489 3.606 1.00 . A A . 49 ALA H 1 1 18 32674 1 1 49 ALA HA H 10.224 12.144 1.694 1.00 . A A . 49 ALA HA 1 1 18 32675 1 1 49 ALA HB1 H 9.229 14.299 2.523 1.00 . A A . 49 ALA HB1 1 1 18 32676 1 1 49 ALA HB2 H 10.215 14.135 3.996 1.00 . A A . 49 ALA HB2 1 1 18 32677 1 1 49 ALA HB3 H 11.006 14.326 2.413 1.00 . A A . 49 ALA HB3 1 1 18 32678 1 1 49 ALA N N 8.921 11.816 3.262 1.00 . A A . 49 ALA N 1 1 18 32679 1 1 49 ALA O O 11.632 12.034 4.628 1.00 . A A . 49 ALA O 1 1 18 32680 1 1 50 GLY C C 12.872 8.580 3.357 1.00 . A A . 50 GLY C 1 1 18 32681 1 1 50 GLY CA C 13.129 10.089 3.324 1.00 . A A . 50 GLY CA 1 1 18 32682 1 1 50 GLY H H 11.748 10.542 1.832 1.00 . A A . 50 GLY H 1 1 18 32683 1 1 50 GLY HA2 H 14.018 10.297 2.728 1.00 . A A . 50 GLY HA2 1 1 18 32684 1 1 50 GLY HA3 H 13.330 10.449 4.332 1.00 . A A . 50 GLY HA3 1 1 18 32685 1 1 50 GLY N N 11.990 10.798 2.768 1.00 . A A . 50 GLY N 1 1 18 32686 1 1 50 GLY O O 13.779 7.799 3.639 1.00 . A A . 50 GLY O 1 1 18 32687 1 1 51 CYS C C 11.045 6.380 1.606 1.00 . A A . 51 CYS C 1 1 18 32688 1 1 51 CYS CA C 11.245 6.817 3.058 1.00 . A A . 51 CYS CA 1 1 18 32689 1 1 51 CYS CB C 9.994 6.572 3.905 1.00 . A A . 51 CYS CB 1 1 18 32690 1 1 51 CYS H H 10.901 8.859 2.836 1.00 . A A . 51 CYS H 1 1 18 32691 1 1 51 CYS HA H 12.063 6.263 3.520 1.00 . A A . 51 CYS HA 1 1 18 32692 1 1 51 CYS HB2 H 9.185 7.220 3.569 1.00 . A A . 51 CYS HB2 1 1 18 32693 1 1 51 CYS HB3 H 9.653 5.544 3.776 1.00 . A A . 51 CYS HB3 1 1 18 32694 1 1 51 CYS N N 11.632 8.217 3.065 1.00 . A A . 51 CYS N 1 1 18 32695 1 1 51 CYS O O 12.014 6.118 0.894 1.00 . A A . 51 CYS O 1 1 18 32696 1 1 51 CYS SG S 10.359 6.892 5.669 1.00 . A A . 51 CYS SG 1 1 18 32697 1 1 52 HIS C C 9.194 7.158 -1.002 1.00 . A A . 52 HIS C 1 1 18 32698 1 1 52 HIS CA C 9.444 5.915 -0.146 1.00 . A A . 52 HIS CA 1 1 18 32699 1 1 52 HIS CB C 8.259 4.947 -0.147 1.00 . A A . 52 HIS CB 1 1 18 32700 1 1 52 HIS CD2 C 8.151 3.065 1.664 1.00 . A A . 52 HIS CD2 1 1 18 32701 1 1 52 HIS CE1 C 9.441 1.603 0.672 1.00 . A A . 52 HIS CE1 1 1 18 32702 1 1 52 HIS CG C 8.560 3.607 0.482 1.00 . A A . 52 HIS CG 1 1 18 32703 1 1 52 HIS H H 9.001 6.530 1.794 1.00 . A A . 52 HIS H 1 1 18 32704 1 1 52 HIS HA H 10.309 5.381 -0.540 1.00 . A A . 52 HIS HA 1 1 18 32705 1 1 52 HIS HB2 H 7.427 5.407 0.386 1.00 . A A . 52 HIS HB2 1 1 18 32706 1 1 52 HIS HB3 H 7.932 4.789 -1.174 1.00 . A A . 52 HIS HB3 1 1 18 32707 1 1 52 HIS HD1 H 9.830 2.762 -1.005 1.00 . A A . 52 HIS HD1 1 1 18 32708 1 1 52 HIS HD2 H 7.498 3.545 2.393 1.00 . A A . 52 HIS HD2 1 1 18 32709 1 1 52 HIS HE1 H 10.004 0.690 0.475 1.00 . A A . 52 HIS HE1 1 1 18 32710 1 1 52 HIS N N 9.783 6.315 1.209 1.00 . A A . 52 HIS N 1 1 18 32711 1 1 52 HIS ND1 N 9.372 2.662 -0.121 1.00 . A A . 52 HIS ND1 1 1 18 32712 1 1 52 HIS NE2 N 8.683 1.854 1.778 1.00 . A A . 52 HIS NE2 1 1 18 32713 1 1 52 HIS O O 8.050 7.478 -1.319 1.00 . A A . 52 HIS O 1 1 18 32714 1 1 53 ASP C C 11.277 8.983 -3.248 1.00 . A A . 53 ASP C 1 1 18 32715 1 1 53 ASP CA C 10.198 9.027 -2.164 1.00 . A A . 53 ASP CA 1 1 18 32716 1 1 53 ASP CB C 10.427 10.281 -1.318 1.00 . A A . 53 ASP CB 1 1 18 32717 1 1 53 ASP CG C 10.897 11.510 -2.099 1.00 . A A . 53 ASP CG 1 1 18 32718 1 1 53 ASP H H 11.212 7.558 -1.090 1.00 . A A . 53 ASP H 1 1 18 32719 1 1 53 ASP HA H 9.190 9.020 -2.578 1.00 . A A . 53 ASP HA 1 1 18 32720 1 1 53 ASP HB2 H 9.499 10.529 -0.804 1.00 . A A . 53 ASP HB2 1 1 18 32721 1 1 53 ASP HB3 H 11.166 10.053 -0.550 1.00 . A A . 53 ASP HB3 1 1 18 32722 1 1 53 ASP N N 10.284 7.825 -1.352 1.00 . A A . 53 ASP N 1 1 18 32723 1 1 53 ASP O O 12.330 9.603 -3.105 1.00 . A A . 53 ASP O 1 1 18 32724 1 1 53 ASP OD1 O 10.143 11.931 -3.003 1.00 . A A . 53 ASP OD1 1 1 18 32725 1 1 53 ASP OD2 O 11.999 12.002 -1.774 1.00 . A A . 53 ASP OD2 1 1 18 32726 1 1 54 SER C C 11.339 8.791 -6.662 1.00 . A A . 54 SER C 1 1 18 32727 1 1 54 SER CA C 11.908 8.113 -5.414 1.00 . A A . 54 SER CA 1 1 18 32728 1 1 54 SER CB C 12.215 6.642 -5.703 1.00 . A A . 54 SER CB 1 1 18 32729 1 1 54 SER H H 10.118 7.746 -4.415 1.00 . A A . 54 SER H 1 1 18 32730 1 1 54 SER HA H 12.819 8.616 -5.087 1.00 . A A . 54 SER HA 1 1 18 32731 1 1 54 SER HB2 H 13.087 6.575 -6.353 1.00 . A A . 54 SER HB2 1 1 18 32732 1 1 54 SER HB3 H 12.472 6.136 -4.772 1.00 . A A . 54 SER HB3 1 1 18 32733 1 1 54 SER HG H 11.425 5.474 -7.122 1.00 . A A . 54 SER HG 1 1 18 32734 1 1 54 SER N N 10.977 8.246 -4.307 1.00 . A A . 54 SER N 1 1 18 32735 1 1 54 SER O O 12.086 9.334 -7.474 1.00 . A A . 54 SER O 1 1 18 32736 1 1 54 SER OG O 11.114 5.978 -6.316 1.00 . A A . 54 SER OG 1 1 18 32737 1 1 55 MET C C 9.954 8.866 -9.229 1.00 . A A . 55 MET C 1 1 18 32738 1 1 55 MET CA C 9.341 9.339 -7.910 1.00 . A A . 55 MET CA 1 1 18 32739 1 1 55 MET CB C 9.443 10.863 -7.817 1.00 . A A . 55 MET CB 1 1 18 32740 1 1 55 MET CE C 7.525 10.094 -4.983 1.00 . A A . 55 MET CE 1 1 18 32741 1 1 55 MET CG C 8.149 11.466 -7.265 1.00 . A A . 55 MET CG 1 1 18 32742 1 1 55 MET H H 9.419 8.294 -6.110 1.00 . A A . 55 MET H 1 1 18 32743 1 1 55 MET HA H 8.305 9.006 -7.842 1.00 . A A . 55 MET HA 1 1 18 32744 1 1 55 MET HB2 H 10.279 11.136 -7.173 1.00 . A A . 55 MET HB2 1 1 18 32745 1 1 55 MET HB3 H 9.650 11.278 -8.803 1.00 . A A . 55 MET HB3 1 1 18 32746 1 1 55 MET HE1 H 6.826 9.756 -5.748 1.00 . A A . 55 MET HE1 1 1 18 32747 1 1 55 MET HE2 H 8.305 9.345 -4.848 1.00 . A A . 55 MET HE2 1 1 18 32748 1 1 55 MET HE3 H 6.993 10.238 -4.043 1.00 . A A . 55 MET HE3 1 1 18 32749 1 1 55 MET HG2 H 7.968 12.439 -7.721 1.00 . A A . 55 MET HG2 1 1 18 32750 1 1 55 MET HG3 H 7.302 10.830 -7.523 1.00 . A A . 55 MET HG3 1 1 18 32751 1 1 55 MET N N 10.019 8.737 -6.775 1.00 . A A . 55 MET N 1 1 18 32752 1 1 55 MET O O 10.041 9.632 -10.187 1.00 . A A . 55 MET O 1 1 18 32753 1 1 55 MET SD S 8.263 11.637 -5.492 1.00 . A A . 55 MET SD 1 1 18 32754 1 1 56 ASP C C 9.995 6.012 -11.038 1.00 . A A . 56 ASP C 1 1 18 32755 1 1 56 ASP CA C 10.966 7.022 -10.422 1.00 . A A . 56 ASP CA 1 1 18 32756 1 1 56 ASP CB C 12.259 6.282 -10.075 1.00 . A A . 56 ASP CB 1 1 18 32757 1 1 56 ASP CG C 13.431 7.181 -9.674 1.00 . A A . 56 ASP CG 1 1 18 32758 1 1 56 ASP H H 10.288 6.989 -8.453 1.00 . A A . 56 ASP H 1 1 18 32759 1 1 56 ASP HA H 11.168 7.863 -11.085 1.00 . A A . 56 ASP HA 1 1 18 32760 1 1 56 ASP HB2 H 12.056 5.589 -9.259 1.00 . A A . 56 ASP HB2 1 1 18 32761 1 1 56 ASP HB3 H 12.559 5.682 -10.935 1.00 . A A . 56 ASP HB3 1 1 18 32762 1 1 56 ASP N N 10.363 7.606 -9.237 1.00 . A A . 56 ASP N 1 1 18 32763 1 1 56 ASP O O 9.960 5.842 -12.256 1.00 . A A . 56 ASP O 1 1 18 32764 1 1 56 ASP OD1 O 13.750 8.087 -10.474 1.00 . A A . 56 ASP OD1 1 1 18 32765 1 1 56 ASP OD2 O 13.980 6.942 -8.577 1.00 . A A . 56 ASP OD2 1 1 18 32766 1 1 57 LYS C C 9.001 3.172 -11.190 1.00 . A A . 57 LYS C 1 1 18 32767 1 1 57 LYS CA C 8.261 4.380 -10.612 1.00 . A A . 57 LYS CA 1 1 18 32768 1 1 57 LYS CB C 7.259 5.010 -11.582 1.00 . A A . 57 LYS CB 1 1 18 32769 1 1 57 LYS CD C 6.567 3.195 -13.191 1.00 . A A . 57 LYS CD 1 1 18 32770 1 1 57 LYS CE C 5.348 2.867 -14.056 1.00 . A A . 57 LYS CE 1 1 18 32771 1 1 57 LYS CG C 6.163 4.012 -11.962 1.00 . A A . 57 LYS CG 1 1 18 32772 1 1 57 LYS H H 9.264 5.513 -9.180 1.00 . A A . 57 LYS H 1 1 18 32773 1 1 57 LYS HA H 7.701 4.056 -9.735 1.00 . A A . 57 LYS HA 1 1 18 32774 1 1 57 LYS HB2 H 6.811 5.892 -11.126 1.00 . A A . 57 LYS HB2 1 1 18 32775 1 1 57 LYS HB3 H 7.779 5.344 -12.480 1.00 . A A . 57 LYS HB3 1 1 18 32776 1 1 57 LYS HD2 H 7.296 3.753 -13.779 1.00 . A A . 57 LYS HD2 1 1 18 32777 1 1 57 LYS HD3 H 7.052 2.272 -12.875 1.00 . A A . 57 LYS HD3 1 1 18 32778 1 1 57 LYS HE2 H 4.995 1.861 -13.830 1.00 . A A . 57 LYS HE2 1 1 18 32779 1 1 57 LYS HE3 H 4.534 3.552 -13.821 1.00 . A A . 57 LYS HE3 1 1 18 32780 1 1 57 LYS HG2 H 5.970 3.343 -11.124 1.00 . A A . 57 LYS HG2 1 1 18 32781 1 1 57 LYS HG3 H 5.235 4.546 -12.165 1.00 . A A . 57 LYS HG3 1 1 18 32782 1 1 57 LYS HZ1 H 5.500 2.105 -15.990 1.00 . A A . 57 LYS HZ1 1 1 18 32783 1 1 57 LYS HZ2 H 5.162 3.698 -15.958 1.00 . A A . 57 LYS HZ2 1 1 18 32784 1 1 57 LYS N N 9.230 5.369 -10.169 1.00 . A A . 57 LYS N 1 1 18 32785 1 1 57 LYS NZ N 5.690 2.968 -15.492 1.00 . A A . 57 LYS NZ 1 1 18 32786 1 1 57 LYS O O 9.095 2.130 -10.542 1.00 . A A . 57 LYS O 1 1 18 32787 1 1 58 LYS C C 11.629 2.164 -12.462 1.00 . A A . 58 LYS C 1 1 18 32788 1 1 58 LYS CA C 10.233 2.287 -13.074 1.00 . A A . 58 LYS CA 1 1 18 32789 1 1 58 LYS CB C 10.242 2.518 -14.586 1.00 . A A . 58 LYS CB 1 1 18 32790 1 1 58 LYS CD C 12.064 3.455 -16.057 1.00 . A A . 58 LYS CD 1 1 18 32791 1 1 58 LYS CE C 13.079 4.590 -16.204 1.00 . A A . 58 LYS CE 1 1 18 32792 1 1 58 LYS CG C 11.057 3.762 -14.946 1.00 . A A . 58 LYS CG 1 1 18 32793 1 1 58 LYS H H 9.424 4.201 -12.921 1.00 . A A . 58 LYS H 1 1 18 32794 1 1 58 LYS HA H 9.693 1.357 -12.893 1.00 . A A . 58 LYS HA 1 1 18 32795 1 1 58 LYS HB2 H 10.661 1.646 -15.089 1.00 . A A . 58 LYS HB2 1 1 18 32796 1 1 58 LYS HB3 H 9.220 2.631 -14.947 1.00 . A A . 58 LYS HB3 1 1 18 32797 1 1 58 LYS HD2 H 12.584 2.523 -15.834 1.00 . A A . 58 LYS HD2 1 1 18 32798 1 1 58 LYS HD3 H 11.537 3.309 -17.000 1.00 . A A . 58 LYS HD3 1 1 18 32799 1 1 58 LYS HE2 H 12.591 5.471 -16.621 1.00 . A A . 58 LYS HE2 1 1 18 32800 1 1 58 LYS HE3 H 13.463 4.872 -15.224 1.00 . A A . 58 LYS HE3 1 1 18 32801 1 1 58 LYS HG2 H 10.387 4.559 -15.268 1.00 . A A . 58 LYS HG2 1 1 18 32802 1 1 58 LYS HG3 H 11.583 4.124 -14.063 1.00 . A A . 58 LYS HG3 1 1 18 32803 1 1 58 LYS HZ1 H 14.398 4.866 -17.794 1.00 . A A . 58 LYS HZ1 1 1 18 32804 1 1 58 LYS HZ2 H 15.056 4.032 -16.560 1.00 . A A . 58 LYS HZ2 1 1 18 32805 1 1 58 LYS N N 9.505 3.350 -12.402 1.00 . A A . 58 LYS N 1 1 18 32806 1 1 58 LYS NZ N 14.197 4.174 -17.081 1.00 . A A . 58 LYS NZ 1 1 18 32807 1 1 58 LYS O O 12.631 2.350 -13.150 1.00 . A A . 58 LYS O 1 1 18 32808 1 1 59 ASP C C 12.840 0.462 -9.570 1.00 . A A . 59 ASP C 1 1 18 32809 1 1 59 ASP CA C 12.908 1.704 -10.461 1.00 . A A . 59 ASP CA 1 1 18 32810 1 1 59 ASP CB C 13.181 2.914 -9.566 1.00 . A A . 59 ASP CB 1 1 18 32811 1 1 59 ASP CG C 14.574 2.952 -8.936 1.00 . A A . 59 ASP CG 1 1 18 32812 1 1 59 ASP H H 10.831 1.704 -10.621 1.00 . A A . 59 ASP H 1 1 18 32813 1 1 59 ASP HA H 13.669 1.619 -11.237 1.00 . A A . 59 ASP HA 1 1 18 32814 1 1 59 ASP HB2 H 13.039 3.821 -10.153 1.00 . A A . 59 ASP HB2 1 1 18 32815 1 1 59 ASP HB3 H 12.438 2.931 -8.768 1.00 . A A . 59 ASP HB3 1 1 18 32816 1 1 59 ASP N N 11.651 1.853 -11.174 1.00 . A A . 59 ASP N 1 1 18 32817 1 1 59 ASP O O 13.657 -0.448 -9.704 1.00 . A A . 59 ASP O 1 1 18 32818 1 1 59 ASP OD1 O 15.527 3.261 -9.684 1.00 . A A . 59 ASP OD1 1 1 18 32819 1 1 59 ASP OD2 O 14.656 2.671 -7.720 1.00 . A A . 59 ASP OD2 1 1 18 32820 1 1 60 LYS C C 12.787 -0.635 -6.718 1.00 . A A . 60 LYS C 1 1 18 32821 1 1 60 LYS CA C 11.674 -0.651 -7.767 1.00 . A A . 60 LYS CA 1 1 18 32822 1 1 60 LYS CB C 11.576 -1.967 -8.541 1.00 . A A . 60 LYS CB 1 1 18 32823 1 1 60 LYS CD C 11.149 -2.263 -11.009 1.00 . A A . 60 LYS CD 1 1 18 32824 1 1 60 LYS CE C 10.097 -2.222 -12.119 1.00 . A A . 60 LYS CE 1 1 18 32825 1 1 60 LYS CG C 10.539 -1.868 -9.662 1.00 . A A . 60 LYS CG 1 1 18 32826 1 1 60 LYS H H 11.199 1.208 -8.578 1.00 . A A . 60 LYS H 1 1 18 32827 1 1 60 LYS HA H 10.720 -0.503 -7.261 1.00 . A A . 60 LYS HA 1 1 18 32828 1 1 60 LYS HB2 H 12.550 -2.218 -8.963 1.00 . A A . 60 LYS HB2 1 1 18 32829 1 1 60 LYS HB3 H 11.306 -2.774 -7.861 1.00 . A A . 60 LYS HB3 1 1 18 32830 1 1 60 LYS HD2 H 11.968 -1.588 -11.254 1.00 . A A . 60 LYS HD2 1 1 18 32831 1 1 60 LYS HD3 H 11.571 -3.266 -10.941 1.00 . A A . 60 LYS HD3 1 1 18 32832 1 1 60 LYS HE2 H 9.833 -3.237 -12.417 1.00 . A A . 60 LYS HE2 1 1 18 32833 1 1 60 LYS HE3 H 9.186 -1.752 -11.748 1.00 . A A . 60 LYS HE3 1 1 18 32834 1 1 60 LYS HG2 H 9.693 -2.517 -9.437 1.00 . A A . 60 LYS HG2 1 1 18 32835 1 1 60 LYS HG3 H 10.154 -0.850 -9.717 1.00 . A A . 60 LYS HG3 1 1 18 32836 1 1 60 LYS HZ1 H 11.619 -1.512 -13.354 1.00 . A A . 60 LYS HZ1 1 1 18 32837 1 1 60 LYS HZ2 H 10.243 -1.837 -14.162 1.00 . A A . 60 LYS HZ2 1 1 18 32838 1 1 60 LYS N N 11.859 0.464 -8.680 1.00 . A A . 60 LYS N 1 1 18 32839 1 1 60 LYS NZ N 10.608 -1.472 -13.289 1.00 . A A . 60 LYS NZ 1 1 18 32840 1 1 60 LYS O O 13.201 0.430 -6.262 1.00 . A A . 60 LYS O 1 1 18 32841 1 1 61 SER C C 13.717 -1.844 -3.969 1.00 . A A . 61 SER C 1 1 18 32842 1 1 61 SER CA C 14.299 -1.966 -5.378 1.00 . A A . 61 SER CA 1 1 18 32843 1 1 61 SER CB C 15.393 -0.919 -5.594 1.00 . A A . 61 SER CB 1 1 18 32844 1 1 61 SER H H 12.900 -2.691 -6.742 1.00 . A A . 61 SER H 1 1 18 32845 1 1 61 SER HA H 14.713 -2.962 -5.536 1.00 . A A . 61 SER HA 1 1 18 32846 1 1 61 SER HB2 H 15.219 -0.402 -6.538 1.00 . A A . 61 SER HB2 1 1 18 32847 1 1 61 SER HB3 H 15.337 -0.169 -4.805 1.00 . A A . 61 SER HB3 1 1 18 32848 1 1 61 SER HG H 16.663 -2.416 -5.203 1.00 . A A . 61 SER HG 1 1 18 32849 1 1 61 SER N N 13.241 -1.829 -6.366 1.00 . A A . 61 SER N 1 1 18 32850 1 1 61 SER O O 13.747 -2.800 -3.196 1.00 . A A . 61 SER O 1 1 18 32851 1 1 61 SER OG O 16.694 -1.500 -5.604 1.00 . A A . 61 SER OG 1 1 18 32852 1 1 62 ALA C C 12.215 1.076 -2.283 1.00 . A A . 62 ALA C 1 1 18 32853 1 1 62 ALA CA C 12.615 -0.399 -2.373 1.00 . A A . 62 ALA CA 1 1 18 32854 1 1 62 ALA CB C 13.604 -0.803 -1.278 1.00 . A A . 62 ALA CB 1 1 18 32855 1 1 62 ALA H H 13.181 0.114 -4.311 1.00 . A A . 62 ALA H 1 1 18 32856 1 1 62 ALA HA H 11.720 -1.015 -2.283 1.00 . A A . 62 ALA HA 1 1 18 32857 1 1 62 ALA HB1 H 14.600 -0.444 -1.537 1.00 . A A . 62 ALA HB1 1 1 18 32858 1 1 62 ALA HB2 H 13.295 -0.363 -0.329 1.00 . A A . 62 ALA HB2 1 1 18 32859 1 1 62 ALA HB3 H 13.621 -1.889 -1.186 1.00 . A A . 62 ALA HB3 1 1 18 32860 1 1 62 ALA N N 13.202 -0.659 -3.676 1.00 . A A . 62 ALA N 1 1 18 32861 1 1 62 ALA O O 11.129 1.400 -1.806 1.00 . A A . 62 ALA O 1 1 18 32862 1 1 63 LYS C C 11.694 3.687 -3.648 1.00 . A A . 63 LYS C 1 1 18 32863 1 1 63 LYS CA C 12.871 3.361 -2.726 1.00 . A A . 63 LYS CA 1 1 18 32864 1 1 63 LYS CB C 14.150 4.128 -3.068 1.00 . A A . 63 LYS CB 1 1 18 32865 1 1 63 LYS CD C 15.069 5.067 -0.915 1.00 . A A . 63 LYS CD 1 1 18 32866 1 1 63 LYS CE C 16.432 5.413 -0.312 1.00 . A A . 63 LYS CE 1 1 18 32867 1 1 63 LYS CG C 15.199 3.963 -1.966 1.00 . A A . 63 LYS CG 1 1 18 32868 1 1 63 LYS H H 13.997 1.656 -3.135 1.00 . A A . 63 LYS H 1 1 18 32869 1 1 63 LYS HA H 12.597 3.630 -1.706 1.00 . A A . 63 LYS HA 1 1 18 32870 1 1 63 LYS HB2 H 14.553 3.769 -4.015 1.00 . A A . 63 LYS HB2 1 1 18 32871 1 1 63 LYS HB3 H 13.920 5.185 -3.200 1.00 . A A . 63 LYS HB3 1 1 18 32872 1 1 63 LYS HD2 H 14.632 5.956 -1.368 1.00 . A A . 63 LYS HD2 1 1 18 32873 1 1 63 LYS HD3 H 14.390 4.745 -0.126 1.00 . A A . 63 LYS HD3 1 1 18 32874 1 1 63 LYS HE2 H 17.115 4.573 -0.435 1.00 . A A . 63 LYS HE2 1 1 18 32875 1 1 63 LYS HE3 H 16.868 6.259 -0.845 1.00 . A A . 63 LYS HE3 1 1 18 32876 1 1 63 LYS HG2 H 15.083 2.988 -1.492 1.00 . A A . 63 LYS HG2 1 1 18 32877 1 1 63 LYS HG3 H 16.198 3.987 -2.403 1.00 . A A . 63 LYS HG3 1 1 18 32878 1 1 63 LYS HZ1 H 15.380 5.496 1.485 1.00 . A A . 63 LYS HZ1 1 1 18 32879 1 1 63 LYS HZ2 H 16.976 5.251 1.693 1.00 . A A . 63 LYS HZ2 1 1 18 32880 1 1 63 LYS N N 13.116 1.929 -2.749 1.00 . A A . 63 LYS N 1 1 18 32881 1 1 63 LYS NZ N 16.295 5.742 1.125 1.00 . A A . 63 LYS NZ 1 1 18 32882 1 1 63 LYS O O 11.159 4.794 -3.608 1.00 . A A . 63 LYS O 1 1 18 32883 1 1 64 GLY C C 8.877 2.807 -4.658 1.00 . A A . 64 GLY C 1 1 18 32884 1 1 64 GLY CA C 10.222 2.873 -5.385 1.00 . A A . 64 GLY CA 1 1 18 32885 1 1 64 GLY H H 11.766 1.806 -4.481 1.00 . A A . 64 GLY H 1 1 18 32886 1 1 64 GLY HA2 H 10.316 3.831 -5.896 1.00 . A A . 64 GLY HA2 1 1 18 32887 1 1 64 GLY HA3 H 10.264 2.098 -6.150 1.00 . A A . 64 GLY HA3 1 1 18 32888 1 1 64 GLY N N 11.326 2.704 -4.455 1.00 . A A . 64 GLY N 1 1 18 32889 1 1 64 GLY O O 8.368 1.721 -4.384 1.00 . A A . 64 GLY O 1 1 18 32890 1 1 65 TYR C C 5.981 3.294 -4.424 1.00 . A A . 65 TYR C 1 1 18 32891 1 1 65 TYR CA C 7.065 4.071 -3.675 1.00 . A A . 65 TYR CA 1 1 18 32892 1 1 65 TYR CB C 6.695 5.556 -3.663 1.00 . A A . 65 TYR CB 1 1 18 32893 1 1 65 TYR CD1 C 4.962 5.752 -1.842 1.00 . A A . 65 TYR CD1 1 1 18 32894 1 1 65 TYR CD2 C 4.291 6.178 -4.096 1.00 . A A . 65 TYR CD2 1 1 18 32895 1 1 65 TYR CE1 C 3.620 6.018 -1.392 1.00 . A A . 65 TYR CE1 1 1 18 32896 1 1 65 TYR CE2 C 2.949 6.443 -3.646 1.00 . A A . 65 TYR CE2 1 1 18 32897 1 1 65 TYR CG C 5.269 5.838 -3.185 1.00 . A A . 65 TYR CG 1 1 18 32898 1 1 65 TYR CZ C 2.680 6.350 -2.316 1.00 . A A . 65 TYR CZ 1 1 18 32899 1 1 65 TYR H H 8.761 4.861 -4.592 1.00 . A A . 65 TYR H 1 1 18 32900 1 1 65 TYR HA H 7.189 3.641 -2.682 1.00 . A A . 65 TYR HA 1 1 18 32901 1 1 65 TYR HB2 H 7.395 6.089 -3.020 1.00 . A A . 65 TYR HB2 1 1 18 32902 1 1 65 TYR HB3 H 6.816 5.958 -4.669 1.00 . A A . 65 TYR HB3 1 1 18 32903 1 1 65 TYR HD1 H 5.735 5.483 -1.122 1.00 . A A . 65 TYR HD1 1 1 18 32904 1 1 65 TYR HD2 H 4.533 6.246 -5.157 1.00 . A A . 65 TYR HD2 1 1 18 32905 1 1 65 TYR HE1 H 3.364 5.954 -0.335 1.00 . A A . 65 TYR HE1 1 1 18 32906 1 1 65 TYR HE2 H 2.166 6.713 -4.355 1.00 . A A . 65 TYR HE2 1 1 18 32907 1 1 65 TYR HH H 0.845 5.786 -2.010 1.00 . A A . 65 TYR HH 1 1 18 32908 1 1 65 TYR N N 8.340 3.982 -4.366 1.00 . A A . 65 TYR N 1 1 18 32909 1 1 65 TYR O O 5.200 2.565 -3.813 1.00 . A A . 65 TYR O 1 1 18 32910 1 1 65 TYR OH O 1.413 6.601 -1.891 1.00 . A A . 65 TYR OH 1 1 18 32911 1 1 66 TYR C C 5.340 1.321 -6.741 1.00 . A A . 66 TYR C 1 1 18 32912 1 1 66 TYR CA C 4.990 2.801 -6.575 1.00 . A A . 66 TYR CA 1 1 18 32913 1 1 66 TYR CB C 5.063 3.486 -7.941 1.00 . A A . 66 TYR CB 1 1 18 32914 1 1 66 TYR CD1 C 5.326 1.620 -9.617 1.00 . A A . 66 TYR CD1 1 1 18 32915 1 1 66 TYR CD2 C 3.284 2.863 -9.616 1.00 . A A . 66 TYR CD2 1 1 18 32916 1 1 66 TYR CE1 C 4.835 0.813 -10.703 1.00 . A A . 66 TYR CE1 1 1 18 32917 1 1 66 TYR CE2 C 2.793 2.055 -10.703 1.00 . A A . 66 TYR CE2 1 1 18 32918 1 1 66 TYR CG C 4.541 2.628 -9.096 1.00 . A A . 66 TYR CG 1 1 18 32919 1 1 66 TYR CZ C 3.593 1.071 -11.193 1.00 . A A . 66 TYR CZ 1 1 18 32920 1 1 66 TYR H H 6.605 4.070 -6.226 1.00 . A A . 66 TYR H 1 1 18 32921 1 1 66 TYR HA H 4.017 2.885 -6.092 1.00 . A A . 66 TYR HA 1 1 18 32922 1 1 66 TYR HB2 H 4.490 4.412 -7.903 1.00 . A A . 66 TYR HB2 1 1 18 32923 1 1 66 TYR HB3 H 6.098 3.760 -8.145 1.00 . A A . 66 TYR HB3 1 1 18 32924 1 1 66 TYR HD1 H 6.319 1.435 -9.206 1.00 . A A . 66 TYR HD1 1 1 18 32925 1 1 66 TYR HD2 H 2.664 3.659 -9.205 1.00 . A A . 66 TYR HD2 1 1 18 32926 1 1 66 TYR HE1 H 5.445 0.014 -11.124 1.00 . A A . 66 TYR HE1 1 1 18 32927 1 1 66 TYR HE2 H 1.803 2.230 -11.123 1.00 . A A . 66 TYR HE2 1 1 18 32928 1 1 66 TYR HH H 3.858 0.152 -12.885 1.00 . A A . 66 TYR HH 1 1 18 32929 1 1 66 TYR N N 5.966 3.476 -5.737 1.00 . A A . 66 TYR N 1 1 18 32930 1 1 66 TYR O O 4.622 0.581 -7.411 1.00 . A A . 66 TYR O 1 1 18 32931 1 1 66 TYR OH O 3.129 0.308 -12.219 1.00 . A A . 66 TYR OH 1 1 18 32932 1 1 67 HIS C C 6.452 -1.198 -4.933 1.00 . A A . 67 HIS C 1 1 18 32933 1 1 67 HIS CA C 6.898 -0.446 -6.189 1.00 . A A . 67 HIS CA 1 1 18 32934 1 1 67 HIS CB C 8.410 -0.509 -6.412 1.00 . A A . 67 HIS CB 1 1 18 32935 1 1 67 HIS CD2 C 9.482 -1.734 -4.367 1.00 . A A . 67 HIS CD2 1 1 18 32936 1 1 67 HIS CE1 C 10.027 -3.599 -5.373 1.00 . A A . 67 HIS CE1 1 1 18 32937 1 1 67 HIS CG C 9.094 -1.633 -5.671 1.00 . A A . 67 HIS CG 1 1 18 32938 1 1 67 HIS H H 7.022 1.541 -5.575 1.00 . A A . 67 HIS H 1 1 18 32939 1 1 67 HIS HA H 6.414 -0.890 -7.059 1.00 . A A . 67 HIS HA 1 1 18 32940 1 1 67 HIS HB2 H 8.605 -0.619 -7.479 1.00 . A A . 67 HIS HB2 1 1 18 32941 1 1 67 HIS HB3 H 8.852 0.438 -6.104 1.00 . A A . 67 HIS HB3 1 1 18 32942 1 1 67 HIS HD1 H 9.301 -3.058 -7.239 1.00 . A A . 67 HIS HD1 1 1 18 32943 1 1 67 HIS HD2 H 9.352 -0.969 -3.603 1.00 . A A . 67 HIS HD2 1 1 18 32944 1 1 67 HIS HE1 H 10.418 -4.602 -5.543 1.00 . A A . 67 HIS HE1 1 1 18 32945 1 1 67 HIS N N 6.444 0.933 -6.119 1.00 . A A . 67 HIS N 1 1 18 32946 1 1 67 HIS ND1 N 9.451 -2.823 -6.279 1.00 . A A . 67 HIS ND1 1 1 18 32947 1 1 67 HIS NE2 N 10.045 -2.923 -4.188 1.00 . A A . 67 HIS NE2 1 1 18 32948 1 1 67 HIS O O 6.406 -2.427 -4.925 1.00 . A A . 67 HIS O 1 1 18 32949 1 1 68 VAL C C 4.165 -0.973 -2.581 1.00 . A A . 68 VAL C 1 1 18 32950 1 1 68 VAL CA C 5.693 -1.006 -2.645 1.00 . A A . 68 VAL CA 1 1 18 32951 1 1 68 VAL CB C 6.357 -0.278 -1.474 1.00 . A A . 68 VAL CB 1 1 18 32952 1 1 68 VAL CG1 C 7.813 -0.715 -1.310 1.00 . A A . 68 VAL CG1 1 1 18 32953 1 1 68 VAL CG2 C 6.256 1.240 -1.644 1.00 . A A . 68 VAL CG2 1 1 18 32954 1 1 68 VAL H H 6.173 0.571 -3.918 1.00 . A A . 68 VAL H 1 1 18 32955 1 1 68 VAL HA H 6.023 -2.045 -2.627 1.00 . A A . 68 VAL HA 1 1 18 32956 1 1 68 VAL HB H 5.821 -0.549 -0.564 1.00 . A A . 68 VAL HB 1 1 18 32957 1 1 68 VAL HG11 H 7.895 -1.785 -1.505 1.00 . A A . 68 VAL HG11 1 1 18 32958 1 1 68 VAL HG12 H 8.439 -0.169 -2.016 1.00 . A A . 68 VAL HG12 1 1 18 32959 1 1 68 VAL HG13 H 8.144 -0.505 -0.293 1.00 . A A . 68 VAL HG13 1 1 18 32960 1 1 68 VAL HG21 H 5.232 1.509 -1.903 1.00 . A A . 68 VAL HG21 1 1 18 32961 1 1 68 VAL HG22 H 6.536 1.729 -0.711 1.00 . A A . 68 VAL HG22 1 1 18 32962 1 1 68 VAL HG23 H 6.928 1.561 -2.439 1.00 . A A . 68 VAL HG23 1 1 18 32963 1 1 68 VAL N N 6.134 -0.428 -3.903 1.00 . A A . 68 VAL N 1 1 18 32964 1 1 68 VAL O O 3.578 -1.254 -1.537 1.00 . A A . 68 VAL O 1 1 18 32965 1 1 69 MET C C 1.576 -1.553 -4.822 1.00 . A A . 69 MET C 1 1 18 32966 1 1 69 MET CA C 2.116 -0.555 -3.795 1.00 . A A . 69 MET CA 1 1 18 32967 1 1 69 MET CB C 1.699 0.862 -4.193 1.00 . A A . 69 MET CB 1 1 18 32968 1 1 69 MET CE C 2.655 2.430 -0.556 1.00 . A A . 69 MET CE 1 1 18 32969 1 1 69 MET CG C 2.253 1.893 -3.208 1.00 . A A . 69 MET CG 1 1 18 32970 1 1 69 MET H H 4.050 -0.402 -4.555 1.00 . A A . 69 MET H 1 1 18 32971 1 1 69 MET HA H 1.751 -0.812 -2.801 1.00 . A A . 69 MET HA 1 1 18 32972 1 1 69 MET HB2 H 2.059 1.083 -5.197 1.00 . A A . 69 MET HB2 1 1 18 32973 1 1 69 MET HB3 H 0.611 0.930 -4.222 1.00 . A A . 69 MET HB3 1 1 18 32974 1 1 69 MET HE1 H 3.571 1.848 -0.653 1.00 . A A . 69 MET HE1 1 1 18 32975 1 1 69 MET HE2 H 2.852 3.467 -0.828 1.00 . A A . 69 MET HE2 1 1 18 32976 1 1 69 MET HE3 H 2.302 2.385 0.474 1.00 . A A . 69 MET HE3 1 1 18 32977 1 1 69 MET HG2 H 3.322 1.736 -3.067 1.00 . A A . 69 MET HG2 1 1 18 32978 1 1 69 MET HG3 H 2.130 2.898 -3.612 1.00 . A A . 69 MET HG3 1 1 18 32979 1 1 69 MET N N 3.565 -0.628 -3.710 1.00 . A A . 69 MET N 1 1 18 32980 1 1 69 MET O O 0.373 -1.803 -4.877 1.00 . A A . 69 MET O 1 1 18 32981 1 1 69 MET SD S 1.407 1.759 -1.642 1.00 . A A . 69 MET SD 1 1 18 32982 1 1 70 HIS C C 3.107 -4.233 -6.611 1.00 . A A . 70 HIS C 1 1 18 32983 1 1 70 HIS CA C 2.122 -3.062 -6.631 1.00 . A A . 70 HIS CA 1 1 18 32984 1 1 70 HIS CB C 2.028 -2.391 -8.003 1.00 . A A . 70 HIS CB 1 1 18 32985 1 1 70 HIS CD2 C 0.062 -0.702 -8.346 1.00 . A A . 70 HIS CD2 1 1 18 32986 1 1 70 HIS CE1 C 1.083 1.107 -7.662 1.00 . A A . 70 HIS CE1 1 1 18 32987 1 1 70 HIS CG C 1.330 -1.052 -7.985 1.00 . A A . 70 HIS CG 1 1 18 32988 1 1 70 HIS H H 3.468 -1.889 -5.558 1.00 . A A . 70 HIS H 1 1 18 32989 1 1 70 HIS HA H 1.129 -3.428 -6.371 1.00 . A A . 70 HIS HA 1 1 18 32990 1 1 70 HIS HB2 H 3.034 -2.260 -8.402 1.00 . A A . 70 HIS HB2 1 1 18 32991 1 1 70 HIS HB3 H 1.498 -3.056 -8.685 1.00 . A A . 70 HIS HB3 1 1 18 32992 1 1 70 HIS HD1 H 2.891 0.184 -7.229 1.00 . A A . 70 HIS HD1 1 1 18 32993 1 1 70 HIS HD2 H -0.700 -1.380 -8.731 1.00 . A A . 70 HIS HD2 1 1 18 32994 1 1 70 HIS HE1 H 1.272 2.149 -7.402 1.00 . A A . 70 HIS HE1 1 1 18 32995 1 1 70 HIS N N 2.492 -2.097 -5.609 1.00 . A A . 70 HIS N 1 1 18 32996 1 1 70 HIS ND1 N 1.949 0.110 -7.559 1.00 . A A . 70 HIS ND1 1 1 18 32997 1 1 70 HIS NE2 N -0.086 0.602 -8.149 1.00 . A A . 70 HIS NE2 1 1 18 32998 1 1 70 HIS O O 2.721 -5.368 -6.336 1.00 . A A . 70 HIS O 1 1 18 32999 1 1 71 ASP C C 5.164 -5.922 -5.784 1.00 . A A . 71 ASP C 1 1 18 33000 1 1 71 ASP CA C 5.401 -4.929 -6.924 1.00 . A A . 71 ASP CA 1 1 18 33001 1 1 71 ASP CB C 6.782 -4.302 -6.724 1.00 . A A . 71 ASP CB 1 1 18 33002 1 1 71 ASP CG C 7.898 -4.907 -7.579 1.00 . A A . 71 ASP CG 1 1 18 33003 1 1 71 ASP H H 4.665 -2.991 -7.127 1.00 . A A . 71 ASP H 1 1 18 33004 1 1 71 ASP HA H 5.329 -5.397 -7.906 1.00 . A A . 71 ASP HA 1 1 18 33005 1 1 71 ASP HB2 H 6.715 -3.236 -6.942 1.00 . A A . 71 ASP HB2 1 1 18 33006 1 1 71 ASP HB3 H 7.059 -4.395 -5.674 1.00 . A A . 71 ASP HB3 1 1 18 33007 1 1 71 ASP N N 4.359 -3.917 -6.905 1.00 . A A . 71 ASP N 1 1 18 33008 1 1 71 ASP O O 5.055 -5.526 -4.625 1.00 . A A . 71 ASP O 1 1 18 33009 1 1 71 ASP OD1 O 8.482 -5.912 -7.121 1.00 . A A . 71 ASP OD1 1 1 18 33010 1 1 71 ASP OD2 O 8.141 -4.350 -8.671 1.00 . A A . 71 ASP OD2 1 1 18 33011 1 1 72 LYS C C 6.213 -8.835 -4.754 1.00 . A A . 72 LYS C 1 1 18 33012 1 1 72 LYS CA C 4.867 -8.244 -5.177 1.00 . A A . 72 LYS CA 1 1 18 33013 1 1 72 LYS CB C 3.884 -9.282 -5.723 1.00 . A A . 72 LYS CB 1 1 18 33014 1 1 72 LYS CD C 2.605 -8.816 -7.846 1.00 . A A . 72 LYS CD 1 1 18 33015 1 1 72 LYS CE C 2.333 -10.283 -8.186 1.00 . A A . 72 LYS CE 1 1 18 33016 1 1 72 LYS CG C 2.654 -8.605 -6.331 1.00 . A A . 72 LYS CG 1 1 18 33017 1 1 72 LYS H H 5.181 -7.505 -7.100 1.00 . A A . 72 LYS H 1 1 18 33018 1 1 72 LYS HA H 4.401 -7.786 -4.305 1.00 . A A . 72 LYS HA 1 1 18 33019 1 1 72 LYS HB2 H 4.377 -9.894 -6.477 1.00 . A A . 72 LYS HB2 1 1 18 33020 1 1 72 LYS HB3 H 3.575 -9.952 -4.921 1.00 . A A . 72 LYS HB3 1 1 18 33021 1 1 72 LYS HD2 H 1.827 -8.188 -8.279 1.00 . A A . 72 LYS HD2 1 1 18 33022 1 1 72 LYS HD3 H 3.550 -8.505 -8.290 1.00 . A A . 72 LYS HD3 1 1 18 33023 1 1 72 LYS HE2 H 2.182 -10.853 -7.270 1.00 . A A . 72 LYS HE2 1 1 18 33024 1 1 72 LYS HE3 H 1.414 -10.363 -8.767 1.00 . A A . 72 LYS HE3 1 1 18 33025 1 1 72 LYS HG2 H 1.750 -9.008 -5.875 1.00 . A A . 72 LYS HG2 1 1 18 33026 1 1 72 LYS HG3 H 2.674 -7.538 -6.109 1.00 . A A . 72 LYS HG3 1 1 18 33027 1 1 72 LYS HZ1 H 3.346 -10.727 -9.953 1.00 . A A . 72 LYS HZ1 1 1 18 33028 1 1 72 LYS HZ2 H 4.347 -10.426 -8.704 1.00 . A A . 72 LYS HZ2 1 1 18 33029 1 1 72 LYS N N 5.090 -7.192 -6.154 1.00 . A A . 72 LYS N 1 1 18 33030 1 1 72 LYS NZ N 3.462 -10.855 -8.953 1.00 . A A . 72 LYS NZ 1 1 18 33031 1 1 72 LYS O O 6.362 -9.307 -3.628 1.00 . A A . 72 LYS O 1 1 18 33032 1 1 73 ASN C C 9.209 -8.399 -4.427 1.00 . A A . 73 ASN C 1 1 18 33033 1 1 73 ASN CA C 8.489 -9.316 -5.417 1.00 . A A . 73 ASN CA 1 1 18 33034 1 1 73 ASN CB C 9.322 -9.375 -6.699 1.00 . A A . 73 ASN CB 1 1 18 33035 1 1 73 ASN CG C 9.158 -10.726 -7.398 1.00 . A A . 73 ASN CG 1 1 18 33036 1 1 73 ASN H H 7.031 -8.405 -6.593 1.00 . A A . 73 ASN H 1 1 18 33037 1 1 73 ASN HA H 8.327 -10.317 -5.016 1.00 . A A . 73 ASN HA 1 1 18 33038 1 1 73 ASN HB2 H 9.017 -8.574 -7.372 1.00 . A A . 73 ASN HB2 1 1 18 33039 1 1 73 ASN HB3 H 10.373 -9.210 -6.462 1.00 . A A . 73 ASN HB3 1 1 18 33040 1 1 73 ASN HD21 H 9.308 -9.771 -9.177 1.00 . A A . 73 ASN HD21 1 1 18 33041 1 1 73 ASN HD22 H 9.088 -11.486 -9.273 1.00 . A A . 73 ASN HD22 1 1 18 33042 1 1 73 ASN N N 7.160 -8.791 -5.680 1.00 . A A . 73 ASN N 1 1 18 33043 1 1 73 ASN ND2 N 9.187 -10.655 -8.726 1.00 . A A . 73 ASN ND2 1 1 18 33044 1 1 73 ASN O O 10.261 -7.844 -4.741 1.00 . A A . 73 ASN O 1 1 18 33045 1 1 73 ASN OD1 O 9.014 -11.764 -6.773 1.00 . A A . 73 ASN OD1 1 1 18 33046 1 1 74 THR C C 9.357 -8.220 -0.916 1.00 . A A . 74 THR C 1 1 18 33047 1 1 74 THR CA C 9.185 -7.425 -2.213 1.00 . A A . 74 THR CA 1 1 18 33048 1 1 74 THR CB C 8.291 -6.194 -2.057 1.00 . A A . 74 THR CB 1 1 18 33049 1 1 74 THR CG2 C 8.128 -5.419 -3.366 1.00 . A A . 74 THR CG2 1 1 18 33050 1 1 74 THR H H 7.759 -8.722 -3.003 1.00 . A A . 74 THR H 1 1 18 33051 1 1 74 THR HA H 10.180 -7.115 -2.531 1.00 . A A . 74 THR HA 1 1 18 33052 1 1 74 THR HB H 8.658 -5.544 -1.263 1.00 . A A . 74 THR HB 1 1 18 33053 1 1 74 THR HG1 H 6.439 -6.072 -1.309 1.00 . A A . 74 THR HG1 1 1 18 33054 1 1 74 THR HG21 H 9.038 -5.511 -3.959 1.00 . A A . 74 THR HG21 1 1 18 33055 1 1 74 THR HG22 H 7.287 -5.826 -3.927 1.00 . A A . 74 THR HG22 1 1 18 33056 1 1 74 THR HG23 H 7.943 -4.368 -3.145 1.00 . A A . 74 THR HG23 1 1 18 33057 1 1 74 THR N N 8.614 -8.267 -3.250 1.00 . A A . 74 THR N 1 1 18 33058 1 1 74 THR O O 8.638 -9.189 -0.678 1.00 . A A . 74 THR O 1 1 18 33059 1 1 74 THR OG1 O 6.996 -6.734 -1.810 1.00 . A A . 74 THR OG1 1 1 18 33060 1 1 75 LYS C C 9.377 -8.288 2.075 1.00 . A A . 75 LYS C 1 1 18 33061 1 1 75 LYS CA C 10.589 -8.438 1.153 1.00 . A A . 75 LYS CA 1 1 18 33062 1 1 75 LYS CB C 11.891 -7.910 1.759 1.00 . A A . 75 LYS CB 1 1 18 33063 1 1 75 LYS CD C 13.535 -8.430 3.600 1.00 . A A . 75 LYS CD 1 1 18 33064 1 1 75 LYS CE C 13.692 -8.537 5.118 1.00 . A A . 75 LYS CE 1 1 18 33065 1 1 75 LYS CG C 12.058 -8.389 3.203 1.00 . A A . 75 LYS CG 1 1 18 33066 1 1 75 LYS H H 10.894 -6.990 -0.313 1.00 . A A . 75 LYS H 1 1 18 33067 1 1 75 LYS HA H 10.736 -9.497 0.946 1.00 . A A . 75 LYS HA 1 1 18 33068 1 1 75 LYS HB2 H 12.738 -8.245 1.161 1.00 . A A . 75 LYS HB2 1 1 18 33069 1 1 75 LYS HB3 H 11.894 -6.820 1.732 1.00 . A A . 75 LYS HB3 1 1 18 33070 1 1 75 LYS HD2 H 14.021 -9.279 3.119 1.00 . A A . 75 LYS HD2 1 1 18 33071 1 1 75 LYS HD3 H 14.036 -7.530 3.241 1.00 . A A . 75 LYS HD3 1 1 18 33072 1 1 75 LYS HE2 H 13.918 -7.556 5.536 1.00 . A A . 75 LYS HE2 1 1 18 33073 1 1 75 LYS HE3 H 12.753 -8.865 5.564 1.00 . A A . 75 LYS HE3 1 1 18 33074 1 1 75 LYS HG2 H 11.515 -7.726 3.875 1.00 . A A . 75 LYS HG2 1 1 18 33075 1 1 75 LYS HG3 H 11.621 -9.382 3.313 1.00 . A A . 75 LYS HG3 1 1 18 33076 1 1 75 LYS HZ1 H 14.960 -9.507 6.458 1.00 . A A . 75 LYS HZ1 1 1 18 33077 1 1 75 LYS HZ2 H 14.540 -10.439 5.190 1.00 . A A . 75 LYS HZ2 1 1 18 33078 1 1 75 LYS N N 10.313 -7.780 -0.112 1.00 . A A . 75 LYS N 1 1 18 33079 1 1 75 LYS NZ N 14.771 -9.490 5.461 1.00 . A A . 75 LYS NZ 1 1 18 33080 1 1 75 LYS O O 9.135 -9.137 2.932 1.00 . A A . 75 LYS O 1 1 18 33081 1 1 76 PHE C C 6.190 -7.090 1.840 1.00 . A A . 76 PHE C 1 1 18 33082 1 1 76 PHE CA C 7.465 -6.931 2.670 1.00 . A A . 76 PHE CA 1 1 18 33083 1 1 76 PHE CB C 7.588 -5.474 3.121 1.00 . A A . 76 PHE CB 1 1 18 33084 1 1 76 PHE CD1 C 8.677 -5.752 5.378 1.00 . A A . 76 PHE CD1 1 1 18 33085 1 1 76 PHE CD2 C 9.818 -4.463 3.720 1.00 . A A . 76 PHE CD2 1 1 18 33086 1 1 76 PHE CE1 C 9.754 -5.515 6.304 1.00 . A A . 76 PHE CE1 1 1 18 33087 1 1 76 PHE CE2 C 10.895 -4.225 4.647 1.00 . A A . 76 PHE CE2 1 1 18 33088 1 1 76 PHE CG C 8.732 -5.221 4.106 1.00 . A A . 76 PHE CG 1 1 18 33089 1 1 76 PHE CZ C 10.809 -4.762 5.893 1.00 . A A . 76 PHE CZ 1 1 18 33090 1 1 76 PHE H H 8.849 -6.517 1.169 1.00 . A A . 76 PHE H 1 1 18 33091 1 1 76 PHE HA H 7.446 -7.646 3.493 1.00 . A A . 76 PHE HA 1 1 18 33092 1 1 76 PHE HB2 H 7.732 -4.843 2.244 1.00 . A A . 76 PHE HB2 1 1 18 33093 1 1 76 PHE HB3 H 6.650 -5.167 3.584 1.00 . A A . 76 PHE HB3 1 1 18 33094 1 1 76 PHE HD1 H 7.819 -6.351 5.682 1.00 . A A . 76 PHE HD1 1 1 18 33095 1 1 76 PHE HD2 H 9.862 -4.043 2.715 1.00 . A A . 76 PHE HD2 1 1 18 33096 1 1 76 PHE HE1 H 9.723 -5.928 7.313 1.00 . A A . 76 PHE HE1 1 1 18 33097 1 1 76 PHE HE2 H 11.759 -3.628 4.356 1.00 . A A . 76 PHE HE2 1 1 18 33098 1 1 76 PHE HZ H 11.603 -4.654 6.676 1.00 . A A . 76 PHE HZ 1 1 18 33099 1 1 76 PHE N N 8.646 -7.202 1.868 1.00 . A A . 76 PHE N 1 1 18 33100 1 1 76 PHE O O 6.226 -6.986 0.615 1.00 . A A . 76 PHE O 1 1 18 33101 1 1 77 LYS C C 3.393 -6.195 1.227 1.00 . A A . 77 LYS C 1 1 18 33102 1 1 77 LYS CA C 3.809 -7.513 1.883 1.00 . A A . 77 LYS CA 1 1 18 33103 1 1 77 LYS CB C 2.775 -8.064 2.866 1.00 . A A . 77 LYS CB 1 1 18 33104 1 1 77 LYS CD C 1.895 -10.239 1.941 1.00 . A A . 77 LYS CD 1 1 18 33105 1 1 77 LYS CE C 2.616 -10.576 0.635 1.00 . A A . 77 LYS CE 1 1 18 33106 1 1 77 LYS CG C 2.851 -9.590 2.944 1.00 . A A . 77 LYS CG 1 1 18 33107 1 1 77 LYS H H 5.073 -7.421 3.537 1.00 . A A . 77 LYS H 1 1 18 33108 1 1 77 LYS HA H 3.941 -8.261 1.101 1.00 . A A . 77 LYS HA 1 1 18 33109 1 1 77 LYS HB2 H 2.943 -7.637 3.855 1.00 . A A . 77 LYS HB2 1 1 18 33110 1 1 77 LYS HB3 H 1.775 -7.762 2.555 1.00 . A A . 77 LYS HB3 1 1 18 33111 1 1 77 LYS HD2 H 1.471 -11.147 2.372 1.00 . A A . 77 LYS HD2 1 1 18 33112 1 1 77 LYS HD3 H 1.063 -9.565 1.738 1.00 . A A . 77 LYS HD3 1 1 18 33113 1 1 77 LYS HE2 H 2.845 -9.659 0.092 1.00 . A A . 77 LYS HE2 1 1 18 33114 1 1 77 LYS HE3 H 3.567 -11.064 0.853 1.00 . A A . 77 LYS HE3 1 1 18 33115 1 1 77 LYS HG2 H 3.871 -9.918 2.743 1.00 . A A . 77 LYS HG2 1 1 18 33116 1 1 77 LYS HG3 H 2.603 -9.920 3.953 1.00 . A A . 77 LYS HG3 1 1 18 33117 1 1 77 LYS HZ1 H 1.475 -12.287 0.298 1.00 . A A . 77 LYS HZ1 1 1 18 33118 1 1 77 LYS HZ2 H 0.943 -10.993 -0.535 1.00 . A A . 77 LYS HZ2 1 1 18 33119 1 1 77 LYS N N 5.094 -7.339 2.540 1.00 . A A . 77 LYS N 1 1 18 33120 1 1 77 LYS NZ N 1.780 -11.462 -0.206 1.00 . A A . 77 LYS NZ 1 1 18 33121 1 1 77 LYS O O 3.287 -5.170 1.899 1.00 . A A . 77 LYS O 1 1 18 33122 1 1 78 SER C C 1.244 -5.050 -0.967 1.00 . A A . 78 SER C 1 1 18 33123 1 1 78 SER CA C 2.768 -5.088 -0.830 1.00 . A A . 78 SER CA 1 1 18 33124 1 1 78 SER CB C 3.425 -5.069 -2.211 1.00 . A A . 78 SER CB 1 1 18 33125 1 1 78 SER H H 3.257 -7.102 -0.615 1.00 . A A . 78 SER H 1 1 18 33126 1 1 78 SER HA H 3.121 -4.238 -0.248 1.00 . A A . 78 SER HA 1 1 18 33127 1 1 78 SER HB2 H 4.199 -4.302 -2.234 1.00 . A A . 78 SER HB2 1 1 18 33128 1 1 78 SER HB3 H 3.918 -6.024 -2.392 1.00 . A A . 78 SER HB3 1 1 18 33129 1 1 78 SER HG H 2.854 -5.111 -4.129 1.00 . A A . 78 SER HG 1 1 18 33130 1 1 78 SER N N 3.169 -6.264 -0.076 1.00 . A A . 78 SER N 1 1 18 33131 1 1 78 SER O O 0.578 -6.073 -0.819 1.00 . A A . 78 SER O 1 1 18 33132 1 1 78 SER OG O 2.481 -4.819 -3.249 1.00 . A A . 78 SER OG 1 1 18 33133 1 1 79 CYS C C -1.230 -4.797 -2.293 1.00 . A A . 79 CYS C 1 1 18 33134 1 1 79 CYS CA C -0.695 -3.672 -1.405 1.00 . A A . 79 CYS CA 1 1 18 33135 1 1 79 CYS CB C -1.028 -2.291 -1.972 1.00 . A A . 79 CYS CB 1 1 18 33136 1 1 79 CYS H H 1.286 -3.031 -1.366 1.00 . A A . 79 CYS H 1 1 18 33137 1 1 79 CYS HA H -1.130 -3.727 -0.407 1.00 . A A . 79 CYS HA 1 1 18 33138 1 1 79 CYS HB2 H -0.679 -2.243 -3.004 1.00 . A A . 79 CYS HB2 1 1 18 33139 1 1 79 CYS HB3 H -2.111 -2.174 -1.996 1.00 . A A . 79 CYS HB3 1 1 18 33140 1 1 79 CYS N N 0.737 -3.858 -1.247 1.00 . A A . 79 CYS N 1 1 18 33141 1 1 79 CYS O O -1.983 -5.653 -1.831 1.00 . A A . 79 CYS O 1 1 18 33142 1 1 79 CYS SG S -0.307 -0.887 -1.045 1.00 . A A . 79 CYS SG 1 1 18 33143 1 1 80 VAL C C -0.720 -7.133 -4.078 1.00 . A A . 80 VAL C 1 1 18 33144 1 1 80 VAL CA C -1.250 -5.765 -4.510 1.00 . A A . 80 VAL CA 1 1 18 33145 1 1 80 VAL CB C -0.807 -5.368 -5.920 1.00 . A A . 80 VAL CB 1 1 18 33146 1 1 80 VAL CG1 C -1.118 -6.479 -6.925 1.00 . A A . 80 VAL CG1 1 1 18 33147 1 1 80 VAL CG2 C -1.449 -4.047 -6.346 1.00 . A A . 80 VAL CG2 1 1 18 33148 1 1 80 VAL H H -0.209 -4.059 -3.921 1.00 . A A . 80 VAL H 1 1 18 33149 1 1 80 VAL HA H -2.340 -5.790 -4.494 1.00 . A A . 80 VAL HA 1 1 18 33150 1 1 80 VAL HB H 0.274 -5.225 -5.903 1.00 . A A . 80 VAL HB 1 1 18 33151 1 1 80 VAL HG11 H -2.026 -7.001 -6.620 1.00 . A A . 80 VAL HG11 1 1 18 33152 1 1 80 VAL HG12 H -1.264 -6.044 -7.913 1.00 . A A . 80 VAL HG12 1 1 18 33153 1 1 80 VAL HG13 H -0.288 -7.184 -6.957 1.00 . A A . 80 VAL HG13 1 1 18 33154 1 1 80 VAL HG21 H -2.432 -3.955 -5.883 1.00 . A A . 80 VAL HG21 1 1 18 33155 1 1 80 VAL HG22 H -0.818 -3.217 -6.027 1.00 . A A . 80 VAL HG22 1 1 18 33156 1 1 80 VAL HG23 H -1.555 -4.027 -7.430 1.00 . A A . 80 VAL HG23 1 1 18 33157 1 1 80 VAL N N -0.821 -4.759 -3.553 1.00 . A A . 80 VAL N 1 1 18 33158 1 1 80 VAL O O -1.389 -8.149 -4.261 1.00 . A A . 80 VAL O 1 1 18 33159 1 1 81 GLY C C 0.175 -9.123 -2.127 1.00 . A A . 81 GLY C 1 1 18 33160 1 1 81 GLY CA C 1.108 -8.343 -3.055 1.00 . A A . 81 GLY CA 1 1 18 33161 1 1 81 GLY H H 1.017 -6.285 -3.368 1.00 . A A . 81 GLY H 1 1 18 33162 1 1 81 GLY HA2 H 1.375 -8.961 -3.912 1.00 . A A . 81 GLY HA2 1 1 18 33163 1 1 81 GLY HA3 H 2.034 -8.107 -2.531 1.00 . A A . 81 GLY HA3 1 1 18 33164 1 1 81 GLY N N 0.479 -7.116 -3.513 1.00 . A A . 81 GLY N 1 1 18 33165 1 1 81 GLY O O -0.186 -10.263 -2.418 1.00 . A A . 81 GLY O 1 1 18 33166 1 1 82 CYS C C -2.426 -9.348 -0.726 1.00 . A A . 82 CYS C 1 1 18 33167 1 1 82 CYS CA C -1.074 -9.099 -0.055 1.00 . A A . 82 CYS CA 1 1 18 33168 1 1 82 CYS CB C -1.211 -8.246 1.208 1.00 . A A . 82 CYS CB 1 1 18 33169 1 1 82 CYS H H 0.108 -7.552 -0.799 1.00 . A A . 82 CYS H 1 1 18 33170 1 1 82 CYS HA H -0.607 -10.039 0.237 1.00 . A A . 82 CYS HA 1 1 18 33171 1 1 82 CYS HB2 H -0.226 -8.042 1.628 1.00 . A A . 82 CYS HB2 1 1 18 33172 1 1 82 CYS HB3 H -1.658 -7.283 0.960 1.00 . A A . 82 CYS HB3 1 1 18 33173 1 1 82 CYS N N -0.190 -8.479 -1.028 1.00 . A A . 82 CYS N 1 1 18 33174 1 1 82 CYS O O -3.006 -10.423 -0.581 1.00 . A A . 82 CYS O 1 1 18 33175 1 1 82 CYS SG S -2.247 -9.116 2.440 1.00 . A A . 82 CYS SG 1 1 18 33176 1 1 83 HIS C C -4.179 -9.689 -3.011 1.00 . A A . 83 HIS C 1 1 18 33177 1 1 83 HIS CA C -4.163 -8.433 -2.138 1.00 . A A . 83 HIS CA 1 1 18 33178 1 1 83 HIS CB C -4.448 -7.155 -2.931 1.00 . A A . 83 HIS CB 1 1 18 33179 1 1 83 HIS CD2 C -4.840 -5.734 -0.772 1.00 . A A . 83 HIS CD2 1 1 18 33180 1 1 83 HIS CE1 C -6.132 -4.197 -1.642 1.00 . A A . 83 HIS CE1 1 1 18 33181 1 1 83 HIS CG C -4.999 -6.024 -2.096 1.00 . A A . 83 HIS CG 1 1 18 33182 1 1 83 HIS H H -2.412 -7.466 -1.558 1.00 . A A . 83 HIS H 1 1 18 33183 1 1 83 HIS HA H -4.931 -8.525 -1.369 1.00 . A A . 83 HIS HA 1 1 18 33184 1 1 83 HIS HB2 H -3.527 -6.825 -3.410 1.00 . A A . 83 HIS HB2 1 1 18 33185 1 1 83 HIS HB3 H -5.157 -7.385 -3.726 1.00 . A A . 83 HIS HB3 1 1 18 33186 1 1 83 HIS HD1 H -6.123 -4.972 -3.567 1.00 . A A . 83 HIS HD1 1 1 18 33187 1 1 83 HIS HD2 H -4.251 -6.311 -0.060 1.00 . A A . 83 HIS HD2 1 1 18 33188 1 1 83 HIS HE1 H -6.765 -3.315 -1.736 1.00 . A A . 83 HIS HE1 1 1 18 33189 1 1 83 HIS N N -2.890 -8.337 -1.445 1.00 . A A . 83 HIS N 1 1 18 33190 1 1 83 HIS ND1 N -5.819 -5.038 -2.616 1.00 . A A . 83 HIS ND1 1 1 18 33191 1 1 83 HIS NE2 N -5.524 -4.629 -0.500 1.00 . A A . 83 HIS NE2 1 1 18 33192 1 1 83 HIS O O -5.167 -10.421 -3.034 1.00 . A A . 83 HIS O 1 1 18 33193 1 1 84 VAL C C -3.209 -12.328 -3.776 1.00 . A A . 84 VAL C 1 1 18 33194 1 1 84 VAL CA C -2.947 -11.054 -4.582 1.00 . A A . 84 VAL CA 1 1 18 33195 1 1 84 VAL CB C -1.577 -11.048 -5.263 1.00 . A A . 84 VAL CB 1 1 18 33196 1 1 84 VAL CG1 C -1.326 -12.365 -6.000 1.00 . A A . 84 VAL CG1 1 1 18 33197 1 1 84 VAL CG2 C -1.440 -9.855 -6.210 1.00 . A A . 84 VAL CG2 1 1 18 33198 1 1 84 VAL H H -2.273 -9.299 -3.684 1.00 . A A . 84 VAL H 1 1 18 33199 1 1 84 VAL HA H -3.709 -10.965 -5.356 1.00 . A A . 84 VAL HA 1 1 18 33200 1 1 84 VAL HB H -0.817 -10.948 -4.487 1.00 . A A . 84 VAL HB 1 1 18 33201 1 1 84 VAL HG11 H -2.236 -12.965 -5.993 1.00 . A A . 84 VAL HG11 1 1 18 33202 1 1 84 VAL HG12 H -1.037 -12.156 -7.030 1.00 . A A . 84 VAL HG12 1 1 18 33203 1 1 84 VAL HG13 H -0.525 -12.913 -5.503 1.00 . A A . 84 VAL HG13 1 1 18 33204 1 1 84 VAL HG21 H -2.279 -9.175 -6.061 1.00 . A A . 84 VAL HG21 1 1 18 33205 1 1 84 VAL HG22 H -0.507 -9.331 -6.003 1.00 . A A . 84 VAL HG22 1 1 18 33206 1 1 84 VAL HG23 H -1.438 -10.208 -7.241 1.00 . A A . 84 VAL HG23 1 1 18 33207 1 1 84 VAL N N -3.073 -9.899 -3.709 1.00 . A A . 84 VAL N 1 1 18 33208 1 1 84 VAL O O -3.824 -13.268 -4.277 1.00 . A A . 84 VAL O 1 1 18 33209 1 1 85 GLU C C -4.345 -13.527 -1.156 1.00 . A A . 85 GLU C 1 1 18 33210 1 1 85 GLU CA C -2.903 -13.462 -1.662 1.00 . A A . 85 GLU CA 1 1 18 33211 1 1 85 GLU CB C -1.914 -13.412 -0.495 1.00 . A A . 85 GLU CB 1 1 18 33212 1 1 85 GLU CD C -0.593 -15.404 0.307 1.00 . A A . 85 GLU CD 1 1 18 33213 1 1 85 GLU CG C -0.707 -14.314 -0.760 1.00 . A A . 85 GLU CG 1 1 18 33214 1 1 85 GLU H H -2.229 -11.550 -2.142 1.00 . A A . 85 GLU H 1 1 18 33215 1 1 85 GLU HA H -2.686 -14.336 -2.276 1.00 . A A . 85 GLU HA 1 1 18 33216 1 1 85 GLU HB2 H -1.579 -12.386 -0.342 1.00 . A A . 85 GLU HB2 1 1 18 33217 1 1 85 GLU HB3 H -2.412 -13.725 0.422 1.00 . A A . 85 GLU HB3 1 1 18 33218 1 1 85 GLU HG2 H -0.801 -14.773 -1.745 1.00 . A A . 85 GLU HG2 1 1 18 33219 1 1 85 GLU HG3 H 0.203 -13.715 -0.773 1.00 . A A . 85 GLU HG3 1 1 18 33220 1 1 85 GLU N N -2.728 -12.318 -2.542 1.00 . A A . 85 GLU N 1 1 18 33221 1 1 85 GLU O O -4.890 -14.613 -0.961 1.00 . A A . 85 GLU O 1 1 18 33222 1 1 85 GLU OE1 O -1.230 -16.461 0.110 1.00 . A A . 85 GLU OE1 1 1 18 33223 1 1 85 GLU OE2 O 0.129 -15.156 1.297 1.00 . A A . 85 GLU OE2 1 1 18 33224 1 1 86 VAL C C -7.248 -12.672 -1.599 1.00 . A A . 86 VAL C 1 1 18 33225 1 1 86 VAL CA C -6.292 -12.262 -0.478 1.00 . A A . 86 VAL CA 1 1 18 33226 1 1 86 VAL CB C -6.567 -10.855 0.058 1.00 . A A . 86 VAL CB 1 1 18 33227 1 1 86 VAL CG1 C -8.007 -10.732 0.558 1.00 . A A . 86 VAL CG1 1 1 18 33228 1 1 86 VAL CG2 C -5.570 -10.483 1.157 1.00 . A A . 86 VAL CG2 1 1 18 33229 1 1 86 VAL H H -4.473 -11.473 -1.120 1.00 . A A . 86 VAL H 1 1 18 33230 1 1 86 VAL HA H -6.397 -12.965 0.348 1.00 . A A . 86 VAL HA 1 1 18 33231 1 1 86 VAL HB H -6.437 -10.152 -0.765 1.00 . A A . 86 VAL HB 1 1 18 33232 1 1 86 VAL HG11 H -8.218 -11.538 1.261 1.00 . A A . 86 VAL HG11 1 1 18 33233 1 1 86 VAL HG12 H -8.137 -9.772 1.058 1.00 . A A . 86 VAL HG12 1 1 18 33234 1 1 86 VAL HG13 H -8.693 -10.797 -0.287 1.00 . A A . 86 VAL HG13 1 1 18 33235 1 1 86 VAL HG21 H -4.612 -10.962 0.956 1.00 . A A . 86 VAL HG21 1 1 18 33236 1 1 86 VAL HG22 H -5.439 -9.401 1.177 1.00 . A A . 86 VAL HG22 1 1 18 33237 1 1 86 VAL HG23 H -5.950 -10.821 2.121 1.00 . A A . 86 VAL HG23 1 1 18 33238 1 1 86 VAL N N -4.923 -12.352 -0.958 1.00 . A A . 86 VAL N 1 1 18 33239 1 1 86 VAL O O -8.085 -13.555 -1.414 1.00 . A A . 86 VAL O 1 1 18 33240 1 1 87 ALA C C -7.664 -13.724 -4.371 1.00 . A A . 87 ALA C 1 1 18 33241 1 1 87 ALA CA C -7.934 -12.297 -3.888 1.00 . A A . 87 ALA CA 1 1 18 33242 1 1 87 ALA CB C -7.678 -11.255 -4.978 1.00 . A A . 87 ALA CB 1 1 18 33243 1 1 87 ALA H H -6.410 -11.296 -2.880 1.00 . A A . 87 ALA H 1 1 18 33244 1 1 87 ALA HA H -8.973 -12.222 -3.567 1.00 . A A . 87 ALA HA 1 1 18 33245 1 1 87 ALA HB1 H -7.552 -10.274 -4.520 1.00 . A A . 87 ALA HB1 1 1 18 33246 1 1 87 ALA HB2 H -6.774 -11.518 -5.528 1.00 . A A . 87 ALA HB2 1 1 18 33247 1 1 87 ALA HB3 H -8.525 -11.230 -5.664 1.00 . A A . 87 ALA HB3 1 1 18 33248 1 1 87 ALA N N -7.094 -12.012 -2.737 1.00 . A A . 87 ALA N 1 1 18 33249 1 1 87 ALA O O -8.558 -14.385 -4.896 1.00 . A A . 87 ALA O 1 1 18 33250 1 1 88 GLY C C -6.443 -15.770 -6.030 1.00 . A A . 88 GLY C 1 1 18 33251 1 1 88 GLY CA C -6.028 -15.492 -4.584 1.00 . A A . 88 GLY CA 1 1 18 33252 1 1 88 GLY H H -5.705 -13.613 -3.746 1.00 . A A . 88 GLY H 1 1 18 33253 1 1 88 GLY HA2 H -4.947 -15.599 -4.485 1.00 . A A . 88 GLY HA2 1 1 18 33254 1 1 88 GLY HA3 H -6.482 -16.230 -3.923 1.00 . A A . 88 GLY HA3 1 1 18 33255 1 1 88 GLY N N -6.427 -14.156 -4.175 1.00 . A A . 88 GLY N 1 1 18 33256 1 1 88 GLY O O -5.850 -15.234 -6.964 1.00 . A A . 88 GLY O 1 1 18 33257 1 1 89 ALA C C -9.489 -16.867 -7.487 1.00 . A A . 89 ALA C 1 1 18 33258 1 1 89 ALA CA C -7.962 -16.964 -7.485 1.00 . A A . 89 ALA CA 1 1 18 33259 1 1 89 ALA CB C -7.466 -18.362 -7.860 1.00 . A A . 89 ALA CB 1 1 18 33260 1 1 89 ALA H H -7.938 -17.040 -5.403 1.00 . A A . 89 ALA H 1 1 18 33261 1 1 89 ALA HA H -7.560 -16.246 -8.199 1.00 . A A . 89 ALA HA 1 1 18 33262 1 1 89 ALA HB1 H -6.607 -18.620 -7.241 1.00 . A A . 89 ALA HB1 1 1 18 33263 1 1 89 ALA HB2 H -8.264 -19.087 -7.694 1.00 . A A . 89 ALA HB2 1 1 18 33264 1 1 89 ALA HB3 H -7.176 -18.375 -8.910 1.00 . A A . 89 ALA HB3 1 1 18 33265 1 1 89 ALA N N -7.460 -16.608 -6.168 1.00 . A A . 89 ALA N 1 1 18 33266 1 1 89 ALA O O -10.178 -17.869 -7.674 1.00 . A A . 89 ALA O 1 1 18 33267 1 1 90 ASP C C -11.805 -14.602 -8.487 1.00 . A A . 90 ASP C 1 1 18 33268 1 1 90 ASP CA C -11.406 -15.411 -7.252 1.00 . A A . 90 ASP CA 1 1 18 33269 1 1 90 ASP CB C -11.808 -14.610 -6.012 1.00 . A A . 90 ASP CB 1 1 18 33270 1 1 90 ASP CG C -13.309 -14.345 -5.872 1.00 . A A . 90 ASP CG 1 1 18 33271 1 1 90 ASP H H -9.406 -14.842 -7.126 1.00 . A A . 90 ASP H 1 1 18 33272 1 1 90 ASP HA H -11.863 -16.400 -7.236 1.00 . A A . 90 ASP HA 1 1 18 33273 1 1 90 ASP HB2 H -11.464 -15.143 -5.126 1.00 . A A . 90 ASP HB2 1 1 18 33274 1 1 90 ASP HB3 H -11.286 -13.653 -6.031 1.00 . A A . 90 ASP HB3 1 1 18 33275 1 1 90 ASP N N -9.973 -15.652 -7.277 1.00 . A A . 90 ASP N 1 1 18 33276 1 1 90 ASP O O -12.965 -14.616 -8.896 1.00 . A A . 90 ASP O 1 1 18 33277 1 1 90 ASP OD1 O -14.052 -14.808 -6.763 1.00 . A A . 90 ASP OD1 1 1 18 33278 1 1 90 ASP OD2 O -13.678 -13.686 -4.876 1.00 . A A . 90 ASP OD2 1 1 18 33279 1 1 91 ALA C C -11.630 -11.749 -9.806 1.00 . A A . 91 ALA C 1 1 18 33280 1 1 91 ALA CA C -11.054 -13.101 -10.229 1.00 . A A . 91 ALA CA 1 1 18 33281 1 1 91 ALA CB C -11.975 -13.852 -11.193 1.00 . A A . 91 ALA CB 1 1 18 33282 1 1 91 ALA H H -9.879 -13.909 -8.711 1.00 . A A . 91 ALA H 1 1 18 33283 1 1 91 ALA HA H -10.092 -12.940 -10.717 1.00 . A A . 91 ALA HA 1 1 18 33284 1 1 91 ALA HB1 H -11.799 -14.924 -11.104 1.00 . A A . 91 ALA HB1 1 1 18 33285 1 1 91 ALA HB2 H -13.014 -13.633 -10.947 1.00 . A A . 91 ALA HB2 1 1 18 33286 1 1 91 ALA HB3 H -11.769 -13.533 -12.215 1.00 . A A . 91 ALA HB3 1 1 18 33287 1 1 91 ALA N N -10.820 -13.915 -9.049 1.00 . A A . 91 ALA N 1 1 18 33288 1 1 91 ALA O O -10.941 -10.731 -9.862 1.00 . A A . 91 ALA O 1 1 18 33289 1 1 92 ALA C C -12.617 -9.747 -8.084 1.00 . A A . 92 ALA C 1 1 18 33290 1 1 92 ALA CA C -13.565 -10.571 -8.958 1.00 . A A . 92 ALA CA 1 1 18 33291 1 1 92 ALA CB C -14.857 -10.942 -8.227 1.00 . A A . 92 ALA CB 1 1 18 33292 1 1 92 ALA H H -13.441 -12.614 -9.347 1.00 . A A . 92 ALA H 1 1 18 33293 1 1 92 ALA HA H -13.818 -9.996 -9.848 1.00 . A A . 92 ALA HA 1 1 18 33294 1 1 92 ALA HB1 H -15.190 -11.926 -8.556 1.00 . A A . 92 ALA HB1 1 1 18 33295 1 1 92 ALA HB2 H -14.674 -10.961 -7.153 1.00 . A A . 92 ALA HB2 1 1 18 33296 1 1 92 ALA HB3 H -15.626 -10.203 -8.452 1.00 . A A . 92 ALA HB3 1 1 18 33297 1 1 92 ALA N N -12.888 -11.782 -9.390 1.00 . A A . 92 ALA N 1 1 18 33298 1 1 92 ALA O O -12.313 -8.599 -8.404 1.00 . A A . 92 ALA O 1 1 18 33299 1 1 93 LYS C C -9.932 -9.453 -6.773 1.00 . A A . 93 LYS C 1 1 18 33300 1 1 93 LYS CA C -11.270 -9.702 -6.075 1.00 . A A . 93 LYS CA 1 1 18 33301 1 1 93 LYS CB C -11.148 -10.502 -4.777 1.00 . A A . 93 LYS CB 1 1 18 33302 1 1 93 LYS CD C -12.134 -10.864 -2.484 1.00 . A A . 93 LYS CD 1 1 18 33303 1 1 93 LYS CE C -12.906 -12.173 -2.304 1.00 . A A . 93 LYS CE 1 1 18 33304 1 1 93 LYS CG C -12.367 -10.279 -3.879 1.00 . A A . 93 LYS CG 1 1 18 33305 1 1 93 LYS H H -12.429 -11.299 -6.745 1.00 . A A . 93 LYS H 1 1 18 33306 1 1 93 LYS HA H -11.711 -8.738 -5.820 1.00 . A A . 93 LYS HA 1 1 18 33307 1 1 93 LYS HB2 H -11.050 -11.563 -5.006 1.00 . A A . 93 LYS HB2 1 1 18 33308 1 1 93 LYS HB3 H -10.243 -10.206 -4.247 1.00 . A A . 93 LYS HB3 1 1 18 33309 1 1 93 LYS HD2 H -11.069 -11.042 -2.333 1.00 . A A . 93 LYS HD2 1 1 18 33310 1 1 93 LYS HD3 H -12.448 -10.146 -1.727 1.00 . A A . 93 LYS HD3 1 1 18 33311 1 1 93 LYS HE2 H -13.083 -12.354 -1.244 1.00 . A A . 93 LYS HE2 1 1 18 33312 1 1 93 LYS HE3 H -13.882 -12.096 -2.782 1.00 . A A . 93 LYS HE3 1 1 18 33313 1 1 93 LYS HG2 H -12.574 -9.212 -3.799 1.00 . A A . 93 LYS HG2 1 1 18 33314 1 1 93 LYS HG3 H -13.244 -10.741 -4.330 1.00 . A A . 93 LYS HG3 1 1 18 33315 1 1 93 LYS HZ1 H -12.271 -13.365 -3.892 1.00 . A A . 93 LYS HZ1 1 1 18 33316 1 1 93 LYS HZ2 H -11.154 -13.225 -2.716 1.00 . A A . 93 LYS HZ2 1 1 18 33317 1 1 93 LYS N N -12.177 -10.364 -6.998 1.00 . A A . 93 LYS N 1 1 18 33318 1 1 93 LYS NZ N -12.150 -13.305 -2.887 1.00 . A A . 93 LYS NZ 1 1 18 33319 1 1 93 LYS O O -9.256 -8.465 -6.493 1.00 . A A . 93 LYS O 1 1 18 33320 1 1 94 LYS C C -8.384 -9.012 -9.291 1.00 . A A . 94 LYS C 1 1 18 33321 1 1 94 LYS CA C -8.342 -10.261 -8.408 1.00 . A A . 94 LYS CA 1 1 18 33322 1 1 94 LYS CB C -8.066 -11.551 -9.182 1.00 . A A . 94 LYS CB 1 1 18 33323 1 1 94 LYS CD C -6.340 -12.884 -10.449 1.00 . A A . 94 LYS CD 1 1 18 33324 1 1 94 LYS CE C -4.967 -12.826 -11.120 1.00 . A A . 94 LYS CE 1 1 18 33325 1 1 94 LYS CG C -6.604 -11.621 -9.628 1.00 . A A . 94 LYS CG 1 1 18 33326 1 1 94 LYS H H -10.144 -11.169 -7.891 1.00 . A A . 94 LYS H 1 1 18 33327 1 1 94 LYS HA H -7.540 -10.143 -7.680 1.00 . A A . 94 LYS HA 1 1 18 33328 1 1 94 LYS HB2 H -8.300 -12.413 -8.556 1.00 . A A . 94 LYS HB2 1 1 18 33329 1 1 94 LYS HB3 H -8.719 -11.604 -10.053 1.00 . A A . 94 LYS HB3 1 1 18 33330 1 1 94 LYS HD2 H -6.397 -13.761 -9.803 1.00 . A A . 94 LYS HD2 1 1 18 33331 1 1 94 LYS HD3 H -7.115 -12.997 -11.208 1.00 . A A . 94 LYS HD3 1 1 18 33332 1 1 94 LYS HE2 H -4.930 -13.533 -11.948 1.00 . A A . 94 LYS HE2 1 1 18 33333 1 1 94 LYS HE3 H -4.803 -11.833 -11.540 1.00 . A A . 94 LYS HE3 1 1 18 33334 1 1 94 LYS HG2 H -6.359 -10.739 -10.220 1.00 . A A . 94 LYS HG2 1 1 18 33335 1 1 94 LYS HG3 H -5.952 -11.608 -8.754 1.00 . A A . 94 LYS HG3 1 1 18 33336 1 1 94 LYS HZ1 H -3.719 -12.364 -9.516 1.00 . A A . 94 LYS HZ1 1 1 18 33337 1 1 94 LYS HZ2 H -4.137 -13.937 -9.564 1.00 . A A . 94 LYS HZ2 1 1 18 33338 1 1 94 LYS N N -9.589 -10.368 -7.668 1.00 . A A . 94 LYS N 1 1 18 33339 1 1 94 LYS NZ N -3.899 -13.140 -10.144 1.00 . A A . 94 LYS NZ 1 1 18 33340 1 1 94 LYS O O -7.363 -8.601 -9.840 1.00 . A A . 94 LYS O 1 1 18 33341 1 1 95 LYS C C -10.323 -6.128 -9.328 1.00 . A A . 95 LYS C 1 1 18 33342 1 1 95 LYS CA C -9.764 -7.249 -10.206 1.00 . A A . 95 LYS CA 1 1 18 33343 1 1 95 LYS CB C -10.627 -7.560 -11.430 1.00 . A A . 95 LYS CB 1 1 18 33344 1 1 95 LYS CD C -10.487 -7.672 -13.946 1.00 . A A . 95 LYS CD 1 1 18 33345 1 1 95 LYS CE C -9.561 -8.856 -14.229 1.00 . A A . 95 LYS CE 1 1 18 33346 1 1 95 LYS CG C -10.044 -6.917 -12.690 1.00 . A A . 95 LYS CG 1 1 18 33347 1 1 95 LYS H H -10.401 -8.782 -8.949 1.00 . A A . 95 LYS H 1 1 18 33348 1 1 95 LYS HA H -8.784 -6.944 -10.572 1.00 . A A . 95 LYS HA 1 1 18 33349 1 1 95 LYS HB2 H -10.696 -8.639 -11.566 1.00 . A A . 95 LYS HB2 1 1 18 33350 1 1 95 LYS HB3 H -11.641 -7.194 -11.267 1.00 . A A . 95 LYS HB3 1 1 18 33351 1 1 95 LYS HD2 H -11.510 -8.027 -13.819 1.00 . A A . 95 LYS HD2 1 1 18 33352 1 1 95 LYS HD3 H -10.489 -6.994 -14.800 1.00 . A A . 95 LYS HD3 1 1 18 33353 1 1 95 LYS HE2 H -8.597 -8.494 -14.585 1.00 . A A . 95 LYS HE2 1 1 18 33354 1 1 95 LYS HE3 H -9.375 -9.408 -13.308 1.00 . A A . 95 LYS HE3 1 1 18 33355 1 1 95 LYS HG2 H -10.365 -5.878 -12.754 1.00 . A A . 95 LYS HG2 1 1 18 33356 1 1 95 LYS HG3 H -8.956 -6.912 -12.630 1.00 . A A . 95 LYS HG3 1 1 18 33357 1 1 95 LYS HZ1 H -11.146 -9.927 -15.056 1.00 . A A . 95 LYS HZ1 1 1 18 33358 1 1 95 LYS HZ2 H -10.103 -9.370 -16.175 1.00 . A A . 95 LYS HZ2 1 1 18 33359 1 1 95 LYS N N -9.576 -8.442 -9.399 1.00 . A A . 95 LYS N 1 1 18 33360 1 1 95 LYS NZ N -10.164 -9.755 -15.239 1.00 . A A . 95 LYS NZ 1 1 18 33361 1 1 95 LYS O O -10.463 -4.992 -9.779 1.00 . A A . 95 LYS O 1 1 18 33362 1 1 96 ASP C C -10.152 -5.283 -6.029 1.00 . A A . 96 ASP C 1 1 18 33363 1 1 96 ASP CA C -11.171 -5.525 -7.144 1.00 . A A . 96 ASP CA 1 1 18 33364 1 1 96 ASP CB C -12.458 -6.048 -6.503 1.00 . A A . 96 ASP CB 1 1 18 33365 1 1 96 ASP CG C -13.738 -5.338 -6.950 1.00 . A A . 96 ASP CG 1 1 18 33366 1 1 96 ASP H H -10.513 -7.412 -7.731 1.00 . A A . 96 ASP H 1 1 18 33367 1 1 96 ASP HA H -11.369 -4.627 -7.730 1.00 . A A . 96 ASP HA 1 1 18 33368 1 1 96 ASP HB2 H -12.552 -7.110 -6.727 1.00 . A A . 96 ASP HB2 1 1 18 33369 1 1 96 ASP HB3 H -12.369 -5.957 -5.420 1.00 . A A . 96 ASP HB3 1 1 18 33370 1 1 96 ASP N N -10.629 -6.486 -8.090 1.00 . A A . 96 ASP N 1 1 18 33371 1 1 96 ASP O O -10.320 -4.376 -5.216 1.00 . A A . 96 ASP O 1 1 18 33372 1 1 96 ASP OD1 O -14.285 -5.758 -7.992 1.00 . A A . 96 ASP OD1 1 1 18 33373 1 1 96 ASP OD2 O -14.140 -4.392 -6.239 1.00 . A A . 96 ASP OD2 1 1 18 33374 1 1 97 LEU C C -6.735 -5.720 -5.718 1.00 . A A . 97 LEU C 1 1 18 33375 1 1 97 LEU CA C -8.071 -5.997 -5.025 1.00 . A A . 97 LEU CA 1 1 18 33376 1 1 97 LEU CB C -8.052 -7.236 -4.128 1.00 . A A . 97 LEU CB 1 1 18 33377 1 1 97 LEU CD1 C -8.967 -8.476 -2.132 1.00 . A A . 97 LEU CD1 1 1 18 33378 1 1 97 LEU CD2 C -9.615 -6.057 -2.539 1.00 . A A . 97 LEU CD2 1 1 18 33379 1 1 97 LEU CG C -9.242 -7.395 -3.180 1.00 . A A . 97 LEU CG 1 1 18 33380 1 1 97 LEU H H -8.987 -6.845 -6.693 1.00 . A A . 97 LEU H 1 1 18 33381 1 1 97 LEU HA H -8.315 -5.144 -4.392 1.00 . A A . 97 LEU HA 1 1 18 33382 1 1 97 LEU HB2 H -8.000 -8.120 -4.764 1.00 . A A . 97 LEU HB2 1 1 18 33383 1 1 97 LEU HB3 H -7.139 -7.217 -3.534 1.00 . A A . 97 LEU HB3 1 1 18 33384 1 1 97 LEU HD11 H -8.611 -9.379 -2.626 1.00 . A A . 97 LEU HD11 1 1 18 33385 1 1 97 LEU HD12 H -8.210 -8.120 -1.433 1.00 . A A . 97 LEU HD12 1 1 18 33386 1 1 97 LEU HD13 H -9.887 -8.698 -1.589 1.00 . A A . 97 LEU HD13 1 1 18 33387 1 1 97 LEU HD21 H -8.723 -5.598 -2.111 1.00 . A A . 97 LEU HD21 1 1 18 33388 1 1 97 LEU HD22 H -10.035 -5.396 -3.296 1.00 . A A . 97 LEU HD22 1 1 18 33389 1 1 97 LEU HD23 H -10.351 -6.223 -1.752 1.00 . A A . 97 LEU HD23 1 1 18 33390 1 1 97 LEU HG H -10.103 -7.724 -3.763 1.00 . A A . 97 LEU HG 1 1 18 33391 1 1 97 LEU N N -9.117 -6.110 -6.027 1.00 . A A . 97 LEU N 1 1 18 33392 1 1 97 LEU O O -5.938 -4.914 -5.238 1.00 . A A . 97 LEU O 1 1 18 33393 1 1 98 THR C C -5.618 -5.739 -9.009 1.00 . A A . 98 THR C 1 1 18 33394 1 1 98 THR CA C -5.305 -6.239 -7.598 1.00 . A A . 98 THR CA 1 1 18 33395 1 1 98 THR CB C -4.555 -7.573 -7.578 1.00 . A A . 98 THR CB 1 1 18 33396 1 1 98 THR CG2 C -4.660 -8.283 -6.227 1.00 . A A . 98 THR CG2 1 1 18 33397 1 1 98 THR H H -7.184 -7.055 -7.219 1.00 . A A . 98 THR H 1 1 18 33398 1 1 98 THR HA H -4.698 -5.474 -7.114 1.00 . A A . 98 THR HA 1 1 18 33399 1 1 98 THR HB H -3.513 -7.438 -7.868 1.00 . A A . 98 THR HB 1 1 18 33400 1 1 98 THR HG1 H -4.898 -9.318 -8.497 1.00 . A A . 98 THR HG1 1 1 18 33401 1 1 98 THR HG21 H -5.705 -8.330 -5.921 1.00 . A A . 98 THR HG21 1 1 18 33402 1 1 98 THR HG22 H -4.261 -9.294 -6.317 1.00 . A A . 98 THR HG22 1 1 18 33403 1 1 98 THR HG23 H -4.087 -7.732 -5.482 1.00 . A A . 98 THR HG23 1 1 18 33404 1 1 98 THR N N -6.531 -6.402 -6.835 1.00 . A A . 98 THR N 1 1 18 33405 1 1 98 THR O O -4.793 -5.863 -9.913 1.00 . A A . 98 THR O 1 1 18 33406 1 1 98 THR OG1 O -5.300 -8.403 -8.466 1.00 . A A . 98 THR OG1 1 1 18 33407 1 1 99 GLY C C -6.384 -3.472 -10.868 1.00 . A A . 99 GLY C 1 1 18 33408 1 1 99 GLY CA C -7.244 -4.663 -10.441 1.00 . A A . 99 GLY CA 1 1 18 33409 1 1 99 GLY H H -7.477 -5.085 -8.414 1.00 . A A . 99 GLY H 1 1 18 33410 1 1 99 GLY HA2 H -7.183 -5.449 -11.193 1.00 . A A . 99 GLY HA2 1 1 18 33411 1 1 99 GLY HA3 H -8.289 -4.359 -10.382 1.00 . A A . 99 GLY HA3 1 1 18 33412 1 1 99 GLY N N -6.812 -5.183 -9.154 1.00 . A A . 99 GLY N 1 1 18 33413 1 1 99 GLY O O -5.800 -2.790 -10.027 1.00 . A A . 99 GLY O 1 1 18 33414 1 1 100 CYS C C -6.484 -0.960 -12.915 1.00 . A A . 100 CYS C 1 1 18 33415 1 1 100 CYS CA C -5.555 -2.161 -12.723 1.00 . A A . 100 CYS CA 1 1 18 33416 1 1 100 CYS CB C -4.859 -2.558 -14.027 1.00 . A A . 100 CYS CB 1 1 18 33417 1 1 100 CYS H H -6.812 -3.816 -12.852 1.00 . A A . 100 CYS H 1 1 18 33418 1 1 100 CYS HA H -4.776 -1.935 -11.995 1.00 . A A . 100 CYS HA 1 1 18 33419 1 1 100 CYS HB2 H -5.372 -3.423 -14.447 1.00 . A A . 100 CYS HB2 1 1 18 33420 1 1 100 CYS HB3 H -4.969 -1.744 -14.743 1.00 . A A . 100 CYS HB3 1 1 18 33421 1 1 100 CYS N N -6.334 -3.257 -12.174 1.00 . A A . 100 CYS N 1 1 18 33422 1 1 100 CYS O O -6.092 0.179 -12.666 1.00 . A A . 100 CYS O 1 1 18 33423 1 1 100 CYS SG S -3.081 -2.955 -13.858 1.00 . A A . 100 CYS SG 1 1 18 33424 1 1 101 LYS C C -10.064 -0.725 -13.158 1.00 . A A . 101 LYS C 1 1 18 33425 1 1 101 LYS CA C -8.686 -0.216 -13.585 1.00 . A A . 101 LYS CA 1 1 18 33426 1 1 101 LYS CB C -8.630 0.266 -15.036 1.00 . A A . 101 LYS CB 1 1 18 33427 1 1 101 LYS CD C -10.953 0.702 -15.915 1.00 . A A . 101 LYS CD 1 1 18 33428 1 1 101 LYS CE C -11.091 1.086 -17.390 1.00 . A A . 101 LYS CE 1 1 18 33429 1 1 101 LYS CG C -9.699 1.328 -15.302 1.00 . A A . 101 LYS CG 1 1 18 33430 1 1 101 LYS H H -8.009 -2.186 -13.556 1.00 . A A . 101 LYS H 1 1 18 33431 1 1 101 LYS HA H -8.420 0.632 -12.953 1.00 . A A . 101 LYS HA 1 1 18 33432 1 1 101 LYS HB2 H -7.643 0.677 -15.249 1.00 . A A . 101 LYS HB2 1 1 18 33433 1 1 101 LYS HB3 H -8.776 -0.578 -15.709 1.00 . A A . 101 LYS HB3 1 1 18 33434 1 1 101 LYS HD2 H -10.906 -0.382 -15.821 1.00 . A A . 101 LYS HD2 1 1 18 33435 1 1 101 LYS HD3 H -11.835 1.032 -15.366 1.00 . A A . 101 LYS HD3 1 1 18 33436 1 1 101 LYS HE2 H -10.107 1.123 -17.856 1.00 . A A . 101 LYS HE2 1 1 18 33437 1 1 101 LYS HE3 H -11.665 0.324 -17.918 1.00 . A A . 101 LYS HE3 1 1 18 33438 1 1 101 LYS HG2 H -9.958 1.831 -14.370 1.00 . A A . 101 LYS HG2 1 1 18 33439 1 1 101 LYS HG3 H -9.302 2.089 -15.974 1.00 . A A . 101 LYS HG3 1 1 18 33440 1 1 101 LYS HZ1 H -12.017 2.788 -16.623 1.00 . A A . 101 LYS HZ1 1 1 18 33441 1 1 101 LYS HZ2 H -11.166 3.083 -17.980 1.00 . A A . 101 LYS HZ2 1 1 18 33442 1 1 101 LYS N N -7.698 -1.257 -13.356 1.00 . A A . 101 LYS N 1 1 18 33443 1 1 101 LYS NZ N -11.760 2.399 -17.524 1.00 . A A . 101 LYS NZ 1 1 18 33444 1 1 101 LYS O O -10.420 -1.869 -13.435 1.00 . A A . 101 LYS O 1 1 18 33445 1 1 102 LYS C C -12.019 -1.138 -10.824 1.00 . A A . 102 LYS C 1 1 18 33446 1 1 102 LYS CA C -12.134 -0.196 -12.024 1.00 . A A . 102 LYS CA 1 1 18 33447 1 1 102 LYS CB C -12.975 -0.761 -13.171 1.00 . A A . 102 LYS CB 1 1 18 33448 1 1 102 LYS CD C -15.290 -1.423 -13.919 1.00 . A A . 102 LYS CD 1 1 18 33449 1 1 102 LYS CE C -16.760 -1.013 -13.799 1.00 . A A . 102 LYS CE 1 1 18 33450 1 1 102 LYS CG C -14.457 -0.807 -12.793 1.00 . A A . 102 LYS CG 1 1 18 33451 1 1 102 LYS H H -10.506 1.079 -12.271 1.00 . A A . 102 LYS H 1 1 18 33452 1 1 102 LYS HA H -12.615 0.725 -11.695 1.00 . A A . 102 LYS HA 1 1 18 33453 1 1 102 LYS HB2 H -12.842 -0.146 -14.061 1.00 . A A . 102 LYS HB2 1 1 18 33454 1 1 102 LYS HB3 H -12.628 -1.763 -13.422 1.00 . A A . 102 LYS HB3 1 1 18 33455 1 1 102 LYS HD2 H -14.897 -1.102 -14.884 1.00 . A A . 102 LYS HD2 1 1 18 33456 1 1 102 LYS HD3 H -15.208 -2.509 -13.886 1.00 . A A . 102 LYS HD3 1 1 18 33457 1 1 102 LYS HE2 H -17.372 -1.643 -14.445 1.00 . A A . 102 LYS HE2 1 1 18 33458 1 1 102 LYS HE3 H -17.105 -1.172 -12.778 1.00 . A A . 102 LYS HE3 1 1 18 33459 1 1 102 LYS HG2 H -14.585 -1.390 -11.881 1.00 . A A . 102 LYS HG2 1 1 18 33460 1 1 102 LYS HG3 H -14.813 0.200 -12.581 1.00 . A A . 102 LYS HG3 1 1 18 33461 1 1 102 LYS HZ1 H -16.057 0.917 -14.151 1.00 . A A . 102 LYS HZ1 1 1 18 33462 1 1 102 LYS HZ2 H -17.310 0.511 -15.109 1.00 . A A . 102 LYS HZ2 1 1 18 33463 1 1 102 LYS N N -10.803 0.150 -12.492 1.00 . A A . 102 LYS N 1 1 18 33464 1 1 102 LYS NZ N -16.934 0.408 -14.173 1.00 . A A . 102 LYS NZ 1 1 18 33465 1 1 102 LYS O O -12.790 -2.089 -10.701 1.00 . A A . 102 LYS O 1 1 18 33466 1 1 103 SER C C -11.130 -0.834 -7.527 1.00 . A A . 103 SER C 1 1 18 33467 1 1 103 SER CA C -10.825 -1.651 -8.784 1.00 . A A . 103 SER CA 1 1 18 33468 1 1 103 SER CB C -9.388 -2.175 -8.741 1.00 . A A . 103 SER CB 1 1 18 33469 1 1 103 SER H H -10.429 -0.066 -10.077 1.00 . A A . 103 SER H 1 1 18 33470 1 1 103 SER HA H -11.515 -2.490 -8.872 1.00 . A A . 103 SER HA 1 1 18 33471 1 1 103 SER HB2 H -9.022 -2.145 -7.714 1.00 . A A . 103 SER HB2 1 1 18 33472 1 1 103 SER HB3 H -9.374 -3.219 -9.054 1.00 . A A . 103 SER HB3 1 1 18 33473 1 1 103 SER HG H -8.529 -0.457 -9.301 1.00 . A A . 103 SER HG 1 1 18 33474 1 1 103 SER N N -11.051 -0.842 -9.970 1.00 . A A . 103 SER N 1 1 18 33475 1 1 103 SER O O -11.649 0.278 -7.616 1.00 . A A . 103 SER O 1 1 18 33476 1 1 103 SER OG O -8.518 -1.418 -9.577 1.00 . A A . 103 SER OG 1 1 18 33477 1 1 104 LYS C C -9.997 0.363 -4.928 1.00 . A A . 104 LYS C 1 1 18 33478 1 1 104 LYS CA C -11.025 -0.756 -5.112 1.00 . A A . 104 LYS CA 1 1 18 33479 1 1 104 LYS CB C -11.033 -1.777 -3.973 1.00 . A A . 104 LYS CB 1 1 18 33480 1 1 104 LYS CD C -13.354 -2.158 -3.063 1.00 . A A . 104 LYS CD 1 1 18 33481 1 1 104 LYS CE C -13.870 -3.298 -2.183 1.00 . A A . 104 LYS CE 1 1 18 33482 1 1 104 LYS CG C -12.282 -2.658 -4.035 1.00 . A A . 104 LYS CG 1 1 18 33483 1 1 104 LYS H H -10.371 -2.320 -6.322 1.00 . A A . 104 LYS H 1 1 18 33484 1 1 104 LYS HA H -12.018 -0.309 -5.152 1.00 . A A . 104 LYS HA 1 1 18 33485 1 1 104 LYS HB2 H -10.141 -2.400 -4.031 1.00 . A A . 104 LYS HB2 1 1 18 33486 1 1 104 LYS HB3 H -10.996 -1.258 -3.015 1.00 . A A . 104 LYS HB3 1 1 18 33487 1 1 104 LYS HD2 H -12.942 -1.368 -2.436 1.00 . A A . 104 LYS HD2 1 1 18 33488 1 1 104 LYS HD3 H -14.182 -1.722 -3.622 1.00 . A A . 104 LYS HD3 1 1 18 33489 1 1 104 LYS HE2 H -13.035 -3.918 -1.855 1.00 . A A . 104 LYS HE2 1 1 18 33490 1 1 104 LYS HE3 H -14.336 -2.891 -1.286 1.00 . A A . 104 LYS HE3 1 1 18 33491 1 1 104 LYS HG2 H -12.680 -2.660 -5.050 1.00 . A A . 104 LYS HG2 1 1 18 33492 1 1 104 LYS HG3 H -12.018 -3.687 -3.793 1.00 . A A . 104 LYS HG3 1 1 18 33493 1 1 104 LYS HZ1 H -15.624 -3.573 -3.274 1.00 . A A . 104 LYS HZ1 1 1 18 33494 1 1 104 LYS HZ2 H -14.428 -4.581 -3.727 1.00 . A A . 104 LYS HZ2 1 1 18 33495 1 1 104 LYS N N -10.793 -1.416 -6.386 1.00 . A A . 104 LYS N 1 1 18 33496 1 1 104 LYS NZ N -14.848 -4.125 -2.925 1.00 . A A . 104 LYS NZ 1 1 18 33497 1 1 104 LYS O O -10.265 1.351 -4.246 1.00 . A A . 104 LYS O 1 1 18 33498 1 1 105 CYS C C -7.988 2.194 -6.560 1.00 . A A . 105 CYS C 1 1 18 33499 1 1 105 CYS CA C -7.774 1.150 -5.462 1.00 . A A . 105 CYS CA 1 1 18 33500 1 1 105 CYS CB C -6.395 0.494 -5.561 1.00 . A A . 105 CYS CB 1 1 18 33501 1 1 105 CYS H H -8.633 -0.636 -6.102 1.00 . A A . 105 CYS H 1 1 18 33502 1 1 105 CYS HA H -7.846 1.606 -4.475 1.00 . A A . 105 CYS HA 1 1 18 33503 1 1 105 CYS HB2 H -6.231 0.124 -6.573 1.00 . A A . 105 CYS HB2 1 1 18 33504 1 1 105 CYS HB3 H -5.617 1.231 -5.360 1.00 . A A . 105 CYS HB3 1 1 18 33505 1 1 105 CYS N N -8.843 0.170 -5.549 1.00 . A A . 105 CYS N 1 1 18 33506 1 1 105 CYS O O -8.287 3.352 -6.270 1.00 . A A . 105 CYS O 1 1 18 33507 1 1 105 CYS SG S -6.272 -0.886 -4.364 1.00 . A A . 105 CYS SG 1 1 18 33508 1 1 106 HIS C C -9.416 2.475 -9.497 1.00 . A A . 106 HIS C 1 1 18 33509 1 1 106 HIS CA C -7.999 2.629 -8.939 1.00 . A A . 106 HIS CA 1 1 18 33510 1 1 106 HIS CB C -6.917 2.374 -9.990 1.00 . A A . 106 HIS CB 1 1 18 33511 1 1 106 HIS CD2 C -4.433 1.731 -9.492 1.00 . A A . 106 HIS CD2 1 1 18 33512 1 1 106 HIS CE1 C -3.811 3.602 -8.544 1.00 . A A . 106 HIS CE1 1 1 18 33513 1 1 106 HIS CG C -5.509 2.569 -9.481 1.00 . A A . 106 HIS CG 1 1 18 33514 1 1 106 HIS H H -7.584 0.804 -8.023 1.00 . A A . 106 HIS H 1 1 18 33515 1 1 106 HIS HA H -7.872 3.647 -8.571 1.00 . A A . 106 HIS HA 1 1 18 33516 1 1 106 HIS HB2 H -7.020 1.355 -10.362 1.00 . A A . 106 HIS HB2 1 1 18 33517 1 1 106 HIS HB3 H -7.082 3.041 -10.836 1.00 . A A . 106 HIS HB3 1 1 18 33518 1 1 106 HIS HD1 H -5.647 4.553 -8.719 1.00 . A A . 106 HIS HD1 1 1 18 33519 1 1 106 HIS HD2 H -4.418 0.719 -9.896 1.00 . A A . 106 HIS HD2 1 1 18 33520 1 1 106 HIS HE1 H -3.192 4.352 -8.051 1.00 . A A . 106 HIS HE1 1 1 18 33521 1 1 106 HIS N N -7.827 1.747 -7.797 1.00 . A A . 106 HIS N 1 1 18 33522 1 1 106 HIS ND1 N -5.086 3.740 -8.877 1.00 . A A . 106 HIS ND1 1 1 18 33523 1 1 106 HIS NE2 N -3.408 2.356 -8.926 1.00 . A A . 106 HIS NE2 1 1 18 33524 1 1 106 HIS O O -9.991 1.389 -9.449 1.00 . A A . 106 HIS O 1 1 18 33525 1 1 107 GLU C C -11.208 3.737 -12.100 1.00 . A A . 107 GLU C 1 1 18 33526 1 1 107 GLU CA C -11.275 3.580 -10.579 1.00 . A A . 107 GLU CA 1 1 18 33527 1 1 107 GLU CB C -12.135 4.679 -9.952 1.00 . A A . 107 GLU CB 1 1 18 33528 1 1 107 GLU CD C -12.698 7.026 -10.684 1.00 . A A . 107 GLU CD 1 1 18 33529 1 1 107 GLU CG C -11.577 6.066 -10.280 1.00 . A A . 107 GLU CG 1 1 18 33530 1 1 107 GLU H H -9.462 4.458 -10.048 1.00 . A A . 107 GLU H 1 1 18 33531 1 1 107 GLU HA H -11.698 2.608 -10.326 1.00 . A A . 107 GLU HA 1 1 18 33532 1 1 107 GLU HB2 H -13.158 4.599 -10.318 1.00 . A A . 107 GLU HB2 1 1 18 33533 1 1 107 GLU HB3 H -12.171 4.545 -8.871 1.00 . A A . 107 GLU HB3 1 1 18 33534 1 1 107 GLU HG2 H -11.047 6.463 -9.415 1.00 . A A . 107 GLU HG2 1 1 18 33535 1 1 107 GLU HG3 H -10.852 5.987 -11.090 1.00 . A A . 107 GLU HG3 1 1 18 33536 1 1 107 GLU N N -9.937 3.578 -10.013 1.00 . A A . 107 GLU N 1 1 18 33537 1 1 107 GLU O O -11.699 2.884 -12.838 1.00 . A A . 107 GLU O 1 1 18 33538 1 1 107 GLU OXT O -10.638 4.759 -12.540 1.00 . A A . 107 GLU OXT 1 1 18 33539 1 1 107 GLU OE1 O -13.634 7.180 -9.869 1.00 . A A . 107 GLU OE1 1 1 18 33540 1 1 107 GLU OE2 O -12.594 7.583 -11.798 1.00 . A A . 107 GLU OE2 1 1 18 33541 2 2 1 HEC C1A C -1.128 5.475 9.266 1.00 . B A . 108 HEC C1A 1 1 18 33542 2 2 1 HEC C1B C -2.099 2.304 12.036 1.00 . B A . 108 HEC C1B 1 1 18 33543 2 2 1 HEC C1C C -2.276 -0.512 8.719 1.00 . B A . 108 HEC C1C 1 1 18 33544 2 2 1 HEC C1D C -1.144 2.647 5.996 1.00 . B A . 108 HEC C1D 1 1 18 33545 2 2 1 HEC C2A C -0.984 6.523 10.249 1.00 . B A . 108 HEC C2A 1 1 18 33546 2 2 1 HEC C2B C -2.525 1.389 13.069 1.00 . B A . 108 HEC C2B 1 1 18 33547 2 2 1 HEC C2C C -2.317 -1.574 7.742 1.00 . B A . 108 HEC C2C 1 1 18 33548 2 2 1 HEC C2D C -0.706 3.570 4.976 1.00 . B A . 108 HEC C2D 1 1 18 33549 2 2 1 HEC C3A C -1.221 5.969 11.457 1.00 . B A . 108 HEC C3A 1 1 18 33550 2 2 1 HEC C3B C -2.700 0.185 12.485 1.00 . B A . 108 HEC C3B 1 1 18 33551 2 2 1 HEC C3C C -1.992 -1.029 6.550 1.00 . B A . 108 HEC C3C 1 1 18 33552 2 2 1 HEC C3D C -0.589 4.781 5.561 1.00 . B A . 108 HEC C3D 1 1 18 33553 2 2 1 HEC C4A C -1.515 4.573 11.234 1.00 . B A . 108 HEC C4A 1 1 18 33554 2 2 1 HEC C4B C -2.384 0.342 11.085 1.00 . B A . 108 HEC C4B 1 1 18 33555 2 2 1 HEC C4C C -1.745 0.375 6.778 1.00 . B A . 108 HEC C4C 1 1 18 33556 2 2 1 HEC C4D C -0.954 4.619 6.948 1.00 . B A . 108 HEC C4D 1 1 18 33557 2 2 1 HEC CAA C -0.634 7.949 9.939 1.00 . B A . 108 HEC CAA 1 1 18 33558 2 2 1 HEC CAB C -3.137 -1.099 13.128 1.00 . B A . 108 HEC CAB 1 1 18 33559 2 2 1 HEC CAC C -1.893 -1.714 5.218 1.00 . B A . 108 HEC CAC 1 1 18 33560 2 2 1 HEC CAD C -0.165 6.075 4.929 1.00 . B A . 108 HEC CAD 1 1 18 33561 2 2 1 HEC CBA C 0.494 8.512 10.798 1.00 . B A . 108 HEC CBA 1 1 18 33562 2 2 1 HEC CBB C -4.396 -0.969 13.980 1.00 . B A . 108 HEC CBB 1 1 18 33563 2 2 1 HEC CBC C -2.898 -2.846 5.026 1.00 . B A . 108 HEC CBC 1 1 18 33564 2 2 1 HEC CBD C -0.767 6.317 3.547 1.00 . B A . 108 HEC CBD 1 1 18 33565 2 2 1 HEC CGA C -0.024 9.580 11.751 1.00 . B A . 108 HEC CGA 1 1 18 33566 2 2 1 HEC CGD C 0.316 6.639 2.527 1.00 . B A . 108 HEC CGD 1 1 18 33567 2 2 1 HEC CHA C -0.960 5.658 7.897 1.00 . B A . 108 HEC CHA 1 1 18 33568 2 2 1 HEC CHB C -1.817 3.649 12.251 1.00 . B A . 108 HEC CHB 1 1 18 33569 2 2 1 HEC CHC C -2.445 -0.691 10.132 1.00 . B A . 108 HEC CHC 1 1 18 33570 2 2 1 HEC CHD C -1.378 1.293 5.778 1.00 . B A . 108 HEC CHD 1 1 18 33571 2 2 1 HEC CMA C -1.195 6.637 12.801 1.00 . B A . 108 HEC CMA 1 1 18 33572 2 2 1 HEC CMB C -2.722 1.754 14.512 1.00 . B A . 108 HEC CMB 1 1 18 33573 2 2 1 HEC CMC C -2.664 -3.003 8.042 1.00 . B A . 108 HEC CMC 1 1 18 33574 2 2 1 HEC CMD C -0.442 3.205 3.544 1.00 . B A . 108 HEC CMD 1 1 18 33575 2 2 1 HEC FE FE -1.672 2.479 9.006 1.00 . B A . 108 HEC FE 1 1 18 33576 2 2 1 HEC HAA1 H -0.316 8.027 8.899 1.00 . B A . 108 HEC HAA1 1 1 18 33577 2 2 1 HEC HAA2 H -1.507 8.581 10.100 1.00 . B A . 108 HEC HAA2 1 1 18 33578 2 2 1 HEC HAB H -3.346 -1.839 12.355 1.00 . B A . 108 HEC HAB 1 1 18 33579 2 2 1 HEC HAC H -2.068 -0.989 4.424 1.00 . B A . 108 HEC HAC 1 1 18 33580 2 2 1 HEC HAD1 H -0.472 6.906 5.563 1.00 . B A . 108 HEC HAD1 1 1 18 33581 2 2 1 HEC HAD2 H 0.919 6.085 4.814 1.00 . B A . 108 HEC HAD2 1 1 18 33582 2 2 1 HEC HBA1 H 0.941 7.709 11.384 1.00 . B A . 108 HEC HBA1 1 1 18 33583 2 2 1 HEC HBA2 H 1.253 8.958 10.155 1.00 . B A . 108 HEC HBA2 1 1 18 33584 2 2 1 HEC HBB1 H -4.225 -0.241 14.773 1.00 . B A . 108 HEC HBB1 1 1 18 33585 2 2 1 HEC HBB2 H -5.225 -0.638 13.355 1.00 . B A . 108 HEC HBB2 1 1 18 33586 2 2 1 HEC HBB3 H -4.637 -1.936 14.421 1.00 . B A . 108 HEC HBB3 1 1 18 33587 2 2 1 HEC HBC1 H -3.813 -2.615 5.570 1.00 . B A . 108 HEC HBC1 1 1 18 33588 2 2 1 HEC HBC2 H -3.123 -2.955 3.965 1.00 . B A . 108 HEC HBC2 1 1 18 33589 2 2 1 HEC HBC3 H -2.474 -3.776 5.404 1.00 . B A . 108 HEC HBC3 1 1 18 33590 2 2 1 HEC HBD1 H -1.299 5.424 3.221 1.00 . B A . 108 HEC HBD1 1 1 18 33591 2 2 1 HEC HBD2 H -1.461 7.156 3.595 1.00 . B A . 108 HEC HBD2 1 1 18 33592 2 2 1 HEC HHA H -0.823 6.675 7.530 1.00 . B A . 108 HEC HHA 1 1 18 33593 2 2 1 HEC HHB H -1.831 4.017 13.277 1.00 . B A . 108 HEC HHB 1 1 18 33594 2 2 1 HEC HHC H -2.632 -1.701 10.497 1.00 . B A . 108 HEC HHC 1 1 18 33595 2 2 1 HEC HHD H -1.270 0.912 4.762 1.00 . B A . 108 HEC HHD 1 1 18 33596 2 2 1 HEC HMA1 H -1.176 5.879 13.583 1.00 . B A . 108 HEC HMA1 1 1 18 33597 2 2 1 HEC HMA2 H -0.306 7.263 12.879 1.00 . B A . 108 HEC HMA2 1 1 18 33598 2 2 1 HEC HMA3 H -2.086 7.256 12.916 1.00 . B A . 108 HEC HMA3 1 1 18 33599 2 2 1 HEC HMB1 H -3.759 2.048 14.673 1.00 . B A . 108 HEC HMB1 1 1 18 33600 2 2 1 HEC HMB2 H -2.486 0.895 15.139 1.00 . B A . 108 HEC HMB2 1 1 18 33601 2 2 1 HEC HMB3 H -2.065 2.584 14.769 1.00 . B A . 108 HEC HMB3 1 1 18 33602 2 2 1 HEC HMC1 H -2.116 -3.659 7.365 1.00 . B A . 108 HEC HMC1 1 1 18 33603 2 2 1 HEC HMC2 H -2.393 -3.234 9.072 1.00 . B A . 108 HEC HMC2 1 1 18 33604 2 2 1 HEC HMC3 H -3.735 -3.154 7.905 1.00 . B A . 108 HEC HMC3 1 1 18 33605 2 2 1 HEC HMD1 H -1.389 3.048 3.029 1.00 . B A . 108 HEC HMD1 1 1 18 33606 2 2 1 HEC HMD2 H 0.105 4.013 3.059 1.00 . B A . 108 HEC HMD2 1 1 18 33607 2 2 1 HEC HMD3 H 0.150 2.291 3.505 1.00 . B A . 108 HEC HMD3 1 1 18 33608 2 2 1 HEC NA N -1.455 4.280 9.883 1.00 . B A . 108 HEC NA 1 1 18 33609 2 2 1 HEC NB N -2.016 1.650 10.819 1.00 . B A . 108 HEC NB 1 1 18 33610 2 2 1 HEC NC N -1.923 0.683 8.116 1.00 . B A . 108 HEC NC 1 1 18 33611 2 2 1 HEC ND N -1.293 3.303 7.206 1.00 . B A . 108 HEC ND 1 1 18 33612 2 2 1 HEC O1A O 0.189 9.403 12.970 1.00 . B A . 108 HEC O1A 1 1 18 33613 2 2 1 HEC O1D O 1.191 5.768 2.335 1.00 . B A . 108 HEC O1D 1 1 18 33614 2 2 1 HEC O2A O -0.622 10.552 11.243 1.00 . B A . 108 HEC O2A 1 1 18 33615 2 2 1 HEC O2D O 0.248 7.751 1.959 1.00 . B A . 108 HEC O2D 1 1 18 33616 3 2 1 HEC C1A C 9.529 -1.700 1.733 1.00 . C A . 109 HEC C1A 1 1 18 33617 3 2 1 HEC C1B C 5.688 0.020 2.717 1.00 . C A . 109 HEC C1B 1 1 18 33618 3 2 1 HEC C1C C 7.715 3.090 5.098 1.00 . C A . 109 HEC C1C 1 1 18 33619 3 2 1 HEC C1D C 11.530 1.512 3.821 1.00 . C A . 109 HEC C1D 1 1 18 33620 3 2 1 HEC C2A C 9.027 -2.782 0.920 1.00 . C A . 109 HEC C2A 1 1 18 33621 3 2 1 HEC C2B C 4.332 0.394 3.043 1.00 . C A . 109 HEC C2B 1 1 18 33622 3 2 1 HEC C2C C 8.234 4.237 5.805 1.00 . C A . 109 HEC C2C 1 1 18 33623 3 2 1 HEC C2D C 12.879 1.073 3.552 1.00 . C A . 109 HEC C2D 1 1 18 33624 3 2 1 HEC C3A C 7.683 -2.660 0.881 1.00 . C A . 109 HEC C3A 1 1 18 33625 3 2 1 HEC C3B C 4.402 1.453 3.877 1.00 . C A . 109 HEC C3B 1 1 18 33626 3 2 1 HEC C3C C 9.577 4.211 5.673 1.00 . C A . 109 HEC C3C 1 1 18 33627 3 2 1 HEC C3D C 12.790 -0.080 2.855 1.00 . C A . 109 HEC C3D 1 1 18 33628 3 2 1 HEC C4A C 7.340 -1.500 1.670 1.00 . C A . 109 HEC C4A 1 1 18 33629 3 2 1 HEC C4B C 5.802 1.745 4.077 1.00 . C A . 109 HEC C4B 1 1 18 33630 3 2 1 HEC C4C C 9.903 3.048 4.882 1.00 . C A . 109 HEC C4C 1 1 18 33631 3 2 1 HEC C4D C 11.385 -0.366 2.686 1.00 . C A . 109 HEC C4D 1 1 18 33632 3 2 1 HEC CAA C 9.878 -3.827 0.259 1.00 . C A . 109 HEC CAA 1 1 18 33633 3 2 1 HEC CAB C 3.269 2.213 4.502 1.00 . C A . 109 HEC CAB 1 1 18 33634 3 2 1 HEC CAC C 10.579 5.184 6.224 1.00 . C A . 109 HEC CAC 1 1 18 33635 3 2 1 HEC CAD C 13.910 -0.934 2.336 1.00 . C A . 109 HEC CAD 1 1 18 33636 3 2 1 HEC CBA C 10.152 -3.562 -1.218 1.00 . C A . 109 HEC CBA 1 1 18 33637 3 2 1 HEC CBB C 2.194 1.325 5.123 1.00 . C A . 109 HEC CBB 1 1 18 33638 3 2 1 HEC CBC C 10.575 5.282 7.747 1.00 . C A . 109 HEC CBC 1 1 18 33639 3 2 1 HEC CBD C 15.102 -1.038 3.282 1.00 . C A . 109 HEC CBD 1 1 18 33640 3 2 1 HEC CGA C 11.045 -4.642 -1.812 1.00 . C A . 109 HEC CGA 1 1 18 33641 3 2 1 HEC CGD C 16.320 -0.328 2.709 1.00 . C A . 109 HEC CGD 1 1 18 33642 3 2 1 HEC CHA C 10.876 -1.489 2.008 1.00 . C A . 109 HEC CHA 1 1 18 33643 3 2 1 HEC CHB C 6.028 -1.035 1.877 1.00 . C A . 109 HEC CHB 1 1 18 33644 3 2 1 HEC CHC C 6.292 2.785 4.887 1.00 . C A . 109 HEC CHC 1 1 18 33645 3 2 1 HEC CHD C 11.210 2.670 4.521 1.00 . C A . 109 HEC CHD 1 1 18 33646 3 2 1 HEC CMA C 6.695 -3.536 0.169 1.00 . C A . 109 HEC CMA 1 1 18 33647 3 2 1 HEC CMB C 3.103 -0.296 2.525 1.00 . C A . 109 HEC CMB 1 1 18 33648 3 2 1 HEC CMC C 7.397 5.245 6.538 1.00 . C A . 109 HEC CMC 1 1 18 33649 3 2 1 HEC CMD C 14.120 1.797 3.986 1.00 . C A . 109 HEC CMD 1 1 18 33650 3 2 1 HEC FE FE 8.609 0.731 3.342 1.00 . C A . 109 HEC FE 1 1 18 33651 3 2 1 HEC HAA1 H 10.844 -3.879 0.762 1.00 . C A . 109 HEC HAA1 1 1 18 33652 3 2 1 HEC HAA2 H 9.382 -4.795 0.326 1.00 . C A . 109 HEC HAA2 1 1 18 33653 3 2 1 HEC HAB H 3.654 2.853 5.295 1.00 . C A . 109 HEC HAB 1 1 18 33654 3 2 1 HEC HAC H 11.582 4.881 5.924 1.00 . C A . 109 HEC HAC 1 1 18 33655 3 2 1 HEC HAD1 H 13.545 -1.947 2.166 1.00 . C A . 109 HEC HAD1 1 1 18 33656 3 2 1 HEC HAD2 H 14.279 -0.519 1.398 1.00 . C A . 109 HEC HAD2 1 1 18 33657 3 2 1 HEC HBA1 H 9.210 -3.549 -1.766 1.00 . C A . 109 HEC HBA1 1 1 18 33658 3 2 1 HEC HBA2 H 10.650 -2.599 -1.328 1.00 . C A . 109 HEC HBA2 1 1 18 33659 3 2 1 HEC HBB1 H 1.463 1.052 4.361 1.00 . C A . 109 HEC HBB1 1 1 18 33660 3 2 1 HEC HBB2 H 2.655 0.423 5.524 1.00 . C A . 109 HEC HBB2 1 1 18 33661 3 2 1 HEC HBB3 H 1.695 1.867 5.927 1.00 . C A . 109 HEC HBB3 1 1 18 33662 3 2 1 HEC HBC1 H 11.167 6.143 8.057 1.00 . C A . 109 HEC HBC1 1 1 18 33663 3 2 1 HEC HBC2 H 9.550 5.400 8.101 1.00 . C A . 109 HEC HBC2 1 1 18 33664 3 2 1 HEC HBC3 H 11.003 4.374 8.171 1.00 . C A . 109 HEC HBC3 1 1 18 33665 3 2 1 HEC HBD1 H 14.848 -0.579 4.238 1.00 . C A . 109 HEC HBD1 1 1 18 33666 3 2 1 HEC HBD2 H 15.351 -2.088 3.439 1.00 . C A . 109 HEC HBD2 1 1 18 33667 3 2 1 HEC HHA H 11.590 -2.243 1.678 1.00 . C A . 109 HEC HHA 1 1 18 33668 3 2 1 HEC HHB H 5.226 -1.540 1.339 1.00 . C A . 109 HEC HHB 1 1 18 33669 3 2 1 HEC HHC H 5.562 3.391 5.424 1.00 . C A . 109 HEC HHC 1 1 18 33670 3 2 1 HEC HHD H 12.024 3.333 4.814 1.00 . C A . 109 HEC HHD 1 1 18 33671 3 2 1 HEC HMA1 H 7.225 -4.341 -0.342 1.00 . C A . 109 HEC HMA1 1 1 18 33672 3 2 1 HEC HMA2 H 5.999 -3.961 0.891 1.00 . C A . 109 HEC HMA2 1 1 18 33673 3 2 1 HEC HMA3 H 6.144 -2.944 -0.562 1.00 . C A . 109 HEC HMA3 1 1 18 33674 3 2 1 HEC HMB1 H 2.626 0.330 1.771 1.00 . C A . 109 HEC HMB1 1 1 18 33675 3 2 1 HEC HMB2 H 3.383 -1.251 2.081 1.00 . C A . 109 HEC HMB2 1 1 18 33676 3 2 1 HEC HMB3 H 2.409 -0.466 3.348 1.00 . C A . 109 HEC HMB3 1 1 18 33677 3 2 1 HEC HMC1 H 6.389 5.251 6.122 1.00 . C A . 109 HEC HMC1 1 1 18 33678 3 2 1 HEC HMC2 H 7.352 4.980 7.595 1.00 . C A . 109 HEC HMC2 1 1 18 33679 3 2 1 HEC HMC3 H 7.841 6.234 6.430 1.00 . C A . 109 HEC HMC3 1 1 18 33680 3 2 1 HEC HMD1 H 13.944 2.872 3.953 1.00 . C A . 109 HEC HMD1 1 1 18 33681 3 2 1 HEC HMD2 H 14.375 1.502 5.004 1.00 . C A . 109 HEC HMD2 1 1 18 33682 3 2 1 HEC HMD3 H 14.942 1.542 3.318 1.00 . C A . 109 HEC HMD3 1 1 18 33683 3 2 1 HEC NA N 8.483 -0.917 2.190 1.00 . C A . 109 HEC NA 1 1 18 33684 3 2 1 HEC NB N 6.584 0.857 3.359 1.00 . C A . 109 HEC NB 1 1 18 33685 3 2 1 HEC NC N 8.751 2.366 4.534 1.00 . C A . 109 HEC NC 1 1 18 33686 3 2 1 HEC ND N 10.619 0.619 3.283 1.00 . C A . 109 HEC ND 1 1 18 33687 3 2 1 HEC O1A O 11.590 -4.388 -2.908 1.00 . C A . 109 HEC O1A 1 1 18 33688 3 2 1 HEC O1D O 16.583 -0.535 1.505 1.00 . C A . 109 HEC O1D 1 1 18 33689 3 2 1 HEC O2A O 11.167 -5.701 -1.159 1.00 . C A . 109 HEC O2A 1 1 18 33690 3 2 1 HEC O2D O 16.965 0.408 3.486 1.00 . C A . 109 HEC O2D 1 1 18 33691 4 2 1 HEC C1A C -8.754 -3.335 0.420 1.00 . D A . 110 HEC C1A 1 1 18 33692 4 2 1 HEC C1B C -5.039 -1.157 0.067 1.00 . D A . 110 HEC C1B 1 1 18 33693 4 2 1 HEC C1C C -2.953 -4.402 2.033 1.00 . D A . 110 HEC C1C 1 1 18 33694 4 2 1 HEC C1D C -6.677 -6.561 2.408 1.00 . D A . 110 HEC C1D 1 1 18 33695 4 2 1 HEC C2A C -9.582 -2.376 -0.272 1.00 . D A . 110 HEC C2A 1 1 18 33696 4 2 1 HEC C2B C -3.877 -0.337 -0.184 1.00 . D A . 110 HEC C2B 1 1 18 33697 4 2 1 HEC C2C C -2.108 -5.416 2.619 1.00 . D A . 110 HEC C2C 1 1 18 33698 4 2 1 HEC C2D C -7.843 -7.364 2.695 1.00 . D A . 110 HEC C2D 1 1 18 33699 4 2 1 HEC C3A C -8.781 -1.353 -0.640 1.00 . D A . 110 HEC C3A 1 1 18 33700 4 2 1 HEC C3B C -2.823 -0.956 0.388 1.00 . D A . 110 HEC C3B 1 1 18 33701 4 2 1 HEC C3C C -2.905 -6.452 2.956 1.00 . D A . 110 HEC C3C 1 1 18 33702 4 2 1 HEC C3D C -8.910 -6.707 2.192 1.00 . D A . 110 HEC C3D 1 1 18 33703 4 2 1 HEC C4A C -7.449 -1.670 -0.179 1.00 . D A . 110 HEC C4A 1 1 18 33704 4 2 1 HEC C4B C -3.322 -2.166 0.999 1.00 . D A . 110 HEC C4B 1 1 18 33705 4 2 1 HEC C4C C -4.252 -6.089 2.582 1.00 . D A . 110 HEC C4C 1 1 18 33706 4 2 1 HEC C4D C -8.415 -5.492 1.589 1.00 . D A . 110 HEC C4D 1 1 18 33707 4 2 1 HEC CAA C -11.055 -2.529 -0.514 1.00 . D A . 110 HEC CAA 1 1 18 33708 4 2 1 HEC CAB C -1.390 -0.511 0.410 1.00 . D A . 110 HEC CAB 1 1 18 33709 4 2 1 HEC CAC C -2.512 -7.750 3.598 1.00 . D A . 110 HEC CAC 1 1 18 33710 4 2 1 HEC CAD C -10.352 -7.122 2.230 1.00 . D A . 110 HEC CAD 1 1 18 33711 4 2 1 HEC CBA C -11.893 -2.563 0.760 1.00 . D A . 110 HEC CBA 1 1 18 33712 4 2 1 HEC CBB C -1.198 0.941 0.841 1.00 . D A . 110 HEC CBB 1 1 18 33713 4 2 1 HEC CBC C -1.214 -7.680 4.396 1.00 . D A . 110 HEC CBC 1 1 18 33714 4 2 1 HEC CBD C -10.957 -7.390 0.855 1.00 . D A . 110 HEC CBD 1 1 18 33715 4 2 1 HEC CGA C -12.040 -1.170 1.357 1.00 . D A . 110 HEC CGA 1 1 18 33716 4 2 1 HEC CGD C -11.655 -8.742 0.817 1.00 . D A . 110 HEC CGD 1 1 18 33717 4 2 1 HEC CHA C -9.223 -4.531 0.954 1.00 . D A . 110 HEC CHA 1 1 18 33718 4 2 1 HEC CHB C -6.323 -0.848 -0.369 1.00 . D A . 110 HEC CHB 1 1 18 33719 4 2 1 HEC CHC C -2.527 -3.091 1.700 1.00 . D A . 110 HEC CHC 1 1 18 33720 4 2 1 HEC CHD C -5.380 -6.909 2.770 1.00 . D A . 110 HEC CHD 1 1 18 33721 4 2 1 HEC CMA C -9.158 -0.107 -1.387 1.00 . D A . 110 HEC CMA 1 1 18 33722 4 2 1 HEC CMB C -3.888 0.956 -0.946 1.00 . D A . 110 HEC CMB 1 1 18 33723 4 2 1 HEC CMC C -0.623 -5.297 2.800 1.00 . D A . 110 HEC CMC 1 1 18 33724 4 2 1 HEC CMD C -7.824 -8.677 3.420 1.00 . D A . 110 HEC CMD 1 1 18 33725 4 2 1 HEC FE FE -5.860 -3.852 1.253 1.00 . D A . 110 HEC FE 1 1 18 33726 4 2 1 HEC HAA1 H -11.414 -1.691 -1.113 1.00 . D A . 110 HEC HAA1 1 1 18 33727 4 2 1 HEC HAA2 H -11.241 -3.461 -1.046 1.00 . D A . 110 HEC HAA2 1 1 18 33728 4 2 1 HEC HAB H -0.827 -1.130 1.108 1.00 . D A . 110 HEC HAB 1 1 18 33729 4 2 1 HEC HAC H -3.296 -8.068 4.285 1.00 . D A . 110 HEC HAC 1 1 18 33730 4 2 1 HEC HAD1 H -10.451 -8.040 2.809 1.00 . D A . 110 HEC HAD1 1 1 18 33731 4 2 1 HEC HAD2 H -10.945 -6.334 2.695 1.00 . D A . 110 HEC HAD2 1 1 18 33732 4 2 1 HEC HBA1 H -12.886 -2.951 0.532 1.00 . D A . 110 HEC HBA1 1 1 18 33733 4 2 1 HEC HBA2 H -11.411 -3.207 1.495 1.00 . D A . 110 HEC HBA2 1 1 18 33734 4 2 1 HEC HBB1 H -0.929 1.545 -0.025 1.00 . D A . 110 HEC HBB1 1 1 18 33735 4 2 1 HEC HBB2 H -2.125 1.317 1.273 1.00 . D A . 110 HEC HBB2 1 1 18 33736 4 2 1 HEC HBB3 H -0.402 0.997 1.584 1.00 . D A . 110 HEC HBB3 1 1 18 33737 4 2 1 HEC HBC1 H -1.275 -6.865 5.117 1.00 . D A . 110 HEC HBC1 1 1 18 33738 4 2 1 HEC HBC2 H -1.060 -8.621 4.924 1.00 . D A . 110 HEC HBC2 1 1 18 33739 4 2 1 HEC HBC3 H -0.379 -7.503 3.718 1.00 . D A . 110 HEC HBC3 1 1 18 33740 4 2 1 HEC HBD1 H -11.687 -6.614 0.622 1.00 . D A . 110 HEC HBD1 1 1 18 33741 4 2 1 HEC HBD2 H -10.168 -7.383 0.103 1.00 . D A . 110 HEC HBD2 1 1 18 33742 4 2 1 HEC HHA H -10.289 -4.743 0.876 1.00 . D A . 110 HEC HHA 1 1 18 33743 4 2 1 HEC HHB H -6.472 0.095 -0.895 1.00 . D A . 110 HEC HHB 1 1 18 33744 4 2 1 HEC HHC H -1.528 -2.773 1.996 1.00 . D A . 110 HEC HHC 1 1 18 33745 4 2 1 HEC HHD H -5.222 -7.883 3.233 1.00 . D A . 110 HEC HHD 1 1 18 33746 4 2 1 HEC HMA1 H -10.242 0.005 -1.383 1.00 . D A . 110 HEC HMA1 1 1 18 33747 4 2 1 HEC HMA2 H -8.702 0.758 -0.903 1.00 . D A . 110 HEC HMA2 1 1 18 33748 4 2 1 HEC HMA3 H -8.802 -0.177 -2.415 1.00 . D A . 110 HEC HMA3 1 1 18 33749 4 2 1 HEC HMB1 H -4.871 1.419 -0.862 1.00 . D A . 110 HEC HMB1 1 1 18 33750 4 2 1 HEC HMB2 H -3.134 1.627 -0.533 1.00 . D A . 110 HEC HMB2 1 1 18 33751 4 2 1 HEC HMB3 H -3.665 0.762 -1.995 1.00 . D A . 110 HEC HMB3 1 1 18 33752 4 2 1 HEC HMC1 H -0.120 -6.035 2.175 1.00 . D A . 110 HEC HMC1 1 1 18 33753 4 2 1 HEC HMC2 H -0.301 -4.296 2.510 1.00 . D A . 110 HEC HMC2 1 1 18 33754 4 2 1 HEC HMC3 H -0.368 -5.472 3.845 1.00 . D A . 110 HEC HMC3 1 1 18 33755 4 2 1 HEC HMD1 H -7.107 -9.345 2.943 1.00 . D A . 110 HEC HMD1 1 1 18 33756 4 2 1 HEC HMD2 H -7.534 -8.515 4.458 1.00 . D A . 110 HEC HMD2 1 1 18 33757 4 2 1 HEC HMD3 H -8.817 -9.126 3.386 1.00 . D A . 110 HEC HMD3 1 1 18 33758 4 2 1 HEC NA N -7.444 -2.891 0.472 1.00 . D A . 110 HEC NA 1 1 18 33759 4 2 1 HEC NB N -4.686 -2.280 0.796 1.00 . D A . 110 HEC NB 1 1 18 33760 4 2 1 HEC NC N -4.270 -4.827 2.015 1.00 . D A . 110 HEC NC 1 1 18 33761 4 2 1 HEC ND N -7.041 -5.412 1.727 1.00 . D A . 110 HEC ND 1 1 18 33762 4 2 1 HEC O1A O -11.047 -0.700 1.953 1.00 . D A . 110 HEC O1A 1 1 18 33763 4 2 1 HEC O1D O -11.058 -9.704 1.347 1.00 . D A . 110 HEC O1D 1 1 18 33764 4 2 1 HEC O2A O -13.143 -0.601 1.205 1.00 . D A . 110 HEC O2A 1 1 18 33765 4 2 1 HEC O2D O -12.772 -8.788 0.259 1.00 . D A . 110 HEC O2D 1 1 18 33766 5 2 1 HEC C1A C -0.197 4.089 -9.185 1.00 . E A . 111 HEC C1A 1 1 18 33767 5 2 1 HEC C1B C -1.402 0.639 -11.494 1.00 . E A . 111 HEC C1B 1 1 18 33768 5 2 1 HEC C1C C -3.207 -1.096 -7.930 1.00 . E A . 111 HEC C1C 1 1 18 33769 5 2 1 HEC C1D C -1.931 2.336 -5.636 1.00 . E A . 111 HEC C1D 1 1 18 33770 5 2 1 HEC C2A C 0.417 4.813 -10.273 1.00 . E A . 111 HEC C2A 1 1 18 33771 5 2 1 HEC C2B C -1.525 -0.516 -12.352 1.00 . E A . 111 HEC C2B 1 1 18 33772 5 2 1 HEC C2C C -3.975 -1.726 -6.882 1.00 . E A . 111 HEC C2C 1 1 18 33773 5 2 1 HEC C2D C -1.429 3.315 -4.701 1.00 . E A . 111 HEC C2D 1 1 18 33774 5 2 1 HEC C3A C 0.252 4.070 -11.388 1.00 . E A . 111 HEC C3A 1 1 18 33775 5 2 1 HEC C3B C -2.122 -1.486 -11.628 1.00 . E A . 111 HEC C3B 1 1 18 33776 5 2 1 HEC C3C C -3.870 -0.943 -5.787 1.00 . E A . 111 HEC C3C 1 1 18 33777 5 2 1 HEC C3D C -0.748 4.235 -5.417 1.00 . E A . 111 HEC C3D 1 1 18 33778 5 2 1 HEC C4A C -0.466 2.878 -11.002 1.00 . E A . 111 HEC C4A 1 1 18 33779 5 2 1 HEC C4B C -2.373 -0.943 -10.314 1.00 . E A . 111 HEC C4B 1 1 18 33780 5 2 1 HEC C4C C -3.036 0.179 -6.147 1.00 . E A . 111 HEC C4C 1 1 18 33781 5 2 1 HEC C4D C -0.821 3.833 -6.802 1.00 . E A . 111 HEC C4D 1 1 18 33782 5 2 1 HEC CAA C 1.100 6.143 -10.142 1.00 . E A . 111 HEC CAA 1 1 18 33783 5 2 1 HEC CAB C -2.476 -2.879 -12.064 1.00 . E A . 111 HEC CAB 1 1 18 33784 5 2 1 HEC CAC C -4.484 -1.159 -4.435 1.00 . E A . 111 HEC CAC 1 1 18 33785 5 2 1 HEC CAD C -0.035 5.456 -4.914 1.00 . E A . 111 HEC CAD 1 1 18 33786 5 2 1 HEC CBA C 2.496 6.187 -10.759 1.00 . E A . 111 HEC CBA 1 1 18 33787 5 2 1 HEC CBB C -1.369 -3.902 -11.829 1.00 . E A . 111 HEC CBB 1 1 18 33788 5 2 1 HEC CBC C -4.299 -2.571 -3.887 1.00 . E A . 111 HEC CBC 1 1 18 33789 5 2 1 HEC CBD C -0.954 6.642 -4.639 1.00 . E A . 111 HEC CBD 1 1 18 33790 5 2 1 HEC CGA C 2.695 7.458 -11.572 1.00 . E A . 111 HEC CGA 1 1 18 33791 5 2 1 HEC CGD C -0.227 7.961 -4.858 1.00 . E A . 111 HEC CGD 1 1 18 33792 5 2 1 HEC CHA C -0.232 4.536 -7.869 1.00 . E A . 111 HEC CHA 1 1 18 33793 5 2 1 HEC CHB C -0.833 1.846 -11.885 1.00 . E A . 111 HEC CHB 1 1 18 33794 5 2 1 HEC CHC C -2.986 -1.648 -9.263 1.00 . E A . 111 HEC CHC 1 1 18 33795 5 2 1 HEC CHD C -2.687 1.226 -5.274 1.00 . E A . 111 HEC CHD 1 1 18 33796 5 2 1 HEC CMA C 0.710 4.383 -12.783 1.00 . E A . 111 HEC CMA 1 1 18 33797 5 2 1 HEC CMB C -1.062 -0.579 -13.778 1.00 . E A . 111 HEC CMB 1 1 18 33798 5 2 1 HEC CMC C -4.733 -3.013 -7.028 1.00 . E A . 111 HEC CMC 1 1 18 33799 5 2 1 HEC CMD C -1.648 3.278 -3.217 1.00 . E A . 111 HEC CMD 1 1 18 33800 5 2 1 HEC FE FE -1.712 1.501 -8.570 1.00 . E A . 111 HEC FE 1 1 18 33801 5 2 1 HEC HAA1 H 0.504 6.908 -10.639 1.00 . E A . 111 HEC HAA1 1 1 18 33802 5 2 1 HEC HAA2 H 1.207 6.394 -9.086 1.00 . E A . 111 HEC HAA2 1 1 18 33803 5 2 1 HEC HAB H -3.352 -3.220 -11.513 1.00 . E A . 111 HEC HAB 1 1 18 33804 5 2 1 HEC HAC H -4.032 -0.474 -3.718 1.00 . E A . 111 HEC HAC 1 1 18 33805 5 2 1 HEC HAD1 H 0.474 5.220 -3.979 1.00 . E A . 111 HEC HAD1 1 1 18 33806 5 2 1 HEC HAD2 H 0.697 5.781 -5.654 1.00 . E A . 111 HEC HAD2 1 1 18 33807 5 2 1 HEC HBA1 H 3.244 6.159 -9.967 1.00 . E A . 111 HEC HBA1 1 1 18 33808 5 2 1 HEC HBA2 H 2.630 5.328 -11.416 1.00 . E A . 111 HEC HBA2 1 1 18 33809 5 2 1 HEC HBB1 H -0.567 -3.444 -11.251 1.00 . E A . 111 HEC HBB1 1 1 18 33810 5 2 1 HEC HBB2 H -1.772 -4.754 -11.280 1.00 . E A . 111 HEC HBB2 1 1 18 33811 5 2 1 HEC HBB3 H -0.977 -4.241 -12.788 1.00 . E A . 111 HEC HBB3 1 1 18 33812 5 2 1 HEC HBC1 H -4.284 -2.539 -2.798 1.00 . E A . 111 HEC HBC1 1 1 18 33813 5 2 1 HEC HBC2 H -5.124 -3.201 -4.220 1.00 . E A . 111 HEC HBC2 1 1 18 33814 5 2 1 HEC HBC3 H -3.358 -2.982 -4.252 1.00 . E A . 111 HEC HBC3 1 1 18 33815 5 2 1 HEC HBD1 H -1.812 6.601 -5.310 1.00 . E A . 111 HEC HBD1 1 1 18 33816 5 2 1 HEC HBD2 H -1.300 6.602 -3.605 1.00 . E A . 111 HEC HBD2 1 1 18 33817 5 2 1 HEC HHA H 0.228 5.499 -7.643 1.00 . E A . 111 HEC HHA 1 1 18 33818 5 2 1 HEC HHB H -0.658 2.009 -12.948 1.00 . E A . 111 HEC HHB 1 1 18 33819 5 2 1 HEC HHC H -3.309 -2.670 -9.465 1.00 . E A . 111 HEC HHC 1 1 18 33820 5 2 1 HEC HHD H -3.035 1.157 -4.243 1.00 . E A . 111 HEC HHD 1 1 18 33821 5 2 1 HEC HMA1 H 0.090 3.842 -13.498 1.00 . E A . 111 HEC HMA1 1 1 18 33822 5 2 1 HEC HMA2 H 0.622 5.454 -12.963 1.00 . E A . 111 HEC HMA2 1 1 18 33823 5 2 1 HEC HMA3 H 1.750 4.078 -12.901 1.00 . E A . 111 HEC HMA3 1 1 18 33824 5 2 1 HEC HMB1 H -1.854 -0.217 -14.434 1.00 . E A . 111 HEC HMB1 1 1 18 33825 5 2 1 HEC HMB2 H -0.176 0.044 -13.901 1.00 . E A . 111 HEC HMB2 1 1 18 33826 5 2 1 HEC HMB3 H -0.820 -1.610 -14.036 1.00 . E A . 111 HEC HMB3 1 1 18 33827 5 2 1 HEC HMC1 H -4.418 -3.711 -6.252 1.00 . E A . 111 HEC HMC1 1 1 18 33828 5 2 1 HEC HMC2 H -5.801 -2.819 -6.930 1.00 . E A . 111 HEC HMC2 1 1 18 33829 5 2 1 HEC HMC3 H -4.531 -3.445 -8.009 1.00 . E A . 111 HEC HMC3 1 1 18 33830 5 2 1 HEC HMD1 H -1.822 2.249 -2.901 1.00 . E A . 111 HEC HMD1 1 1 18 33831 5 2 1 HEC HMD2 H -0.767 3.670 -2.709 1.00 . E A . 111 HEC HMD2 1 1 18 33832 5 2 1 HEC HMD3 H -2.515 3.887 -2.962 1.00 . E A . 111 HEC HMD3 1 1 18 33833 5 2 1 HEC NA N -0.737 2.900 -9.644 1.00 . E A . 111 HEC NA 1 1 18 33834 5 2 1 HEC NB N -1.926 0.365 -10.243 1.00 . E A . 111 HEC NB 1 1 18 33835 5 2 1 HEC NC N -2.634 0.075 -7.467 1.00 . E A . 111 HEC NC 1 1 18 33836 5 2 1 HEC ND N -1.551 2.664 -6.925 1.00 . E A . 111 HEC ND 1 1 18 33837 5 2 1 HEC O1A O 3.699 8.152 -11.304 1.00 . E A . 111 HEC O1A 1 1 18 33838 5 2 1 HEC O1D O 0.655 8.268 -4.027 1.00 . E A . 111 HEC O1D 1 1 18 33839 5 2 1 HEC O2A O 1.839 7.712 -12.447 1.00 . E A . 111 HEC O2A 1 1 18 33840 5 2 1 HEC O2D O -0.568 8.638 -5.852 1.00 . E A . 111 HEC O2D 1 1 19 33841 1 1 1 ALA C C 0.122 3.553 19.928 1.00 . A A . 1 ALA C 1 1 19 33842 1 1 1 ALA CA C 1.545 2.991 19.926 1.00 . A A . 1 ALA CA 1 1 19 33843 1 1 1 ALA CB C 1.568 1.461 19.916 1.00 . A A . 1 ALA CB 1 1 19 33844 1 1 1 ALA H1 H 3.234 3.219 21.029 1.00 . A A . 1 ALA H1 1 1 19 33845 1 1 1 ALA H2 H 2.177 4.489 21.142 1.00 . A A . 1 ALA H2 1 1 19 33846 1 1 1 ALA HA H 2.069 3.356 19.043 1.00 . A A . 1 ALA HA 1 1 19 33847 1 1 1 ALA HB1 H 1.291 1.087 20.901 1.00 . A A . 1 ALA HB1 1 1 19 33848 1 1 1 ALA HB2 H 0.858 1.092 19.175 1.00 . A A . 1 ALA HB2 1 1 19 33849 1 1 1 ALA HB3 H 2.570 1.114 19.663 1.00 . A A . 1 ALA HB3 1 1 19 33850 1 1 1 ALA N N 2.256 3.479 21.095 1.00 . A A . 1 ALA N 1 1 19 33851 1 1 1 ALA O O -0.743 3.060 20.650 1.00 . A A . 1 ALA O 1 1 19 33852 1 1 2 PRO C C -2.358 4.369 18.190 1.00 . A A . 2 PRO C 1 1 19 33853 1 1 2 PRO CA C -1.385 5.239 18.989 1.00 . A A . 2 PRO CA 1 1 19 33854 1 1 2 PRO CB C -1.118 6.585 18.335 1.00 . A A . 2 PRO CB 1 1 19 33855 1 1 2 PRO CD C 0.919 5.215 18.220 1.00 . A A . 2 PRO CD 1 1 19 33856 1 1 2 PRO CG C 0.245 6.464 17.674 1.00 . A A . 2 PRO CG 1 1 19 33857 1 1 2 PRO HA H -1.793 5.342 19.896 1.00 . A A . 2 PRO HA 1 1 19 33858 1 1 2 PRO HB2 H -1.888 6.822 17.602 1.00 . A A . 2 PRO HB2 1 1 19 33859 1 1 2 PRO HB3 H -1.124 7.386 19.074 1.00 . A A . 2 PRO HB3 1 1 19 33860 1 1 2 PRO HD2 H 1.210 4.539 17.416 1.00 . A A . 2 PRO HD2 1 1 19 33861 1 1 2 PRO HD3 H 1.825 5.463 18.772 1.00 . A A . 2 PRO HD3 1 1 19 33862 1 1 2 PRO HG2 H 0.140 6.399 16.591 1.00 . A A . 2 PRO HG2 1 1 19 33863 1 1 2 PRO HG3 H 0.850 7.346 17.883 1.00 . A A . 2 PRO HG3 1 1 19 33864 1 1 2 PRO N N -0.082 4.604 19.090 1.00 . A A . 2 PRO N 1 1 19 33865 1 1 2 PRO O O -1.994 3.290 17.726 1.00 . A A . 2 PRO O 1 1 19 33866 1 1 3 LYS C C -4.539 4.546 15.843 1.00 . A A . 3 LYS C 1 1 19 33867 1 1 3 LYS CA C -4.605 4.153 17.321 1.00 . A A . 3 LYS CA 1 1 19 33868 1 1 3 LYS CB C -5.977 4.383 17.957 1.00 . A A . 3 LYS CB 1 1 19 33869 1 1 3 LYS CD C -7.571 3.428 19.663 1.00 . A A . 3 LYS CD 1 1 19 33870 1 1 3 LYS CE C -7.763 3.551 21.176 1.00 . A A . 3 LYS CE 1 1 19 33871 1 1 3 LYS CG C -6.102 3.622 19.279 1.00 . A A . 3 LYS CG 1 1 19 33872 1 1 3 LYS H H -3.865 5.750 18.436 1.00 . A A . 3 LYS H 1 1 19 33873 1 1 3 LYS HA H -4.384 3.089 17.406 1.00 . A A . 3 LYS HA 1 1 19 33874 1 1 3 LYS HB2 H -6.128 5.448 18.130 1.00 . A A . 3 LYS HB2 1 1 19 33875 1 1 3 LYS HB3 H -6.759 4.058 17.271 1.00 . A A . 3 LYS HB3 1 1 19 33876 1 1 3 LYS HD2 H -8.185 4.171 19.153 1.00 . A A . 3 LYS HD2 1 1 19 33877 1 1 3 LYS HD3 H -7.911 2.449 19.328 1.00 . A A . 3 LYS HD3 1 1 19 33878 1 1 3 LYS HE2 H -7.083 2.874 21.691 1.00 . A A . 3 LYS HE2 1 1 19 33879 1 1 3 LYS HE3 H -7.512 4.562 21.499 1.00 . A A . 3 LYS HE3 1 1 19 33880 1 1 3 LYS HG2 H -5.614 2.652 19.192 1.00 . A A . 3 LYS HG2 1 1 19 33881 1 1 3 LYS HG3 H -5.586 4.170 20.068 1.00 . A A . 3 LYS HG3 1 1 19 33882 1 1 3 LYS HZ1 H -9.745 4.067 21.563 1.00 . A A . 3 LYS HZ1 1 1 19 33883 1 1 3 LYS HZ2 H -9.590 2.588 20.898 1.00 . A A . 3 LYS HZ2 1 1 19 33884 1 1 3 LYS N N -3.577 4.871 18.055 1.00 . A A . 3 LYS N 1 1 19 33885 1 1 3 LYS NZ N -9.161 3.238 21.548 1.00 . A A . 3 LYS NZ 1 1 19 33886 1 1 3 LYS O O -3.803 5.459 15.472 1.00 . A A . 3 LYS O 1 1 19 33887 1 1 4 ALA C C -5.932 5.495 13.369 1.00 . A A . 4 ALA C 1 1 19 33888 1 1 4 ALA CA C -5.356 4.098 13.611 1.00 . A A . 4 ALA CA 1 1 19 33889 1 1 4 ALA CB C -6.165 3.004 12.913 1.00 . A A . 4 ALA CB 1 1 19 33890 1 1 4 ALA H H -5.912 3.094 15.350 1.00 . A A . 4 ALA H 1 1 19 33891 1 1 4 ALA HA H -4.331 4.068 13.241 1.00 . A A . 4 ALA HA 1 1 19 33892 1 1 4 ALA HB1 H -6.817 2.515 13.637 1.00 . A A . 4 ALA HB1 1 1 19 33893 1 1 4 ALA HB2 H -6.770 3.448 12.123 1.00 . A A . 4 ALA HB2 1 1 19 33894 1 1 4 ALA HB3 H -5.486 2.269 12.481 1.00 . A A . 4 ALA HB3 1 1 19 33895 1 1 4 ALA N N -5.317 3.836 15.040 1.00 . A A . 4 ALA N 1 1 19 33896 1 1 4 ALA O O -6.734 5.985 14.163 1.00 . A A . 4 ALA O 1 1 19 33897 1 1 5 PRO C C -7.382 7.397 11.341 1.00 . A A . 5 PRO C 1 1 19 33898 1 1 5 PRO CA C -5.953 7.442 11.884 1.00 . A A . 5 PRO CA 1 1 19 33899 1 1 5 PRO CB C -4.946 7.949 10.865 1.00 . A A . 5 PRO CB 1 1 19 33900 1 1 5 PRO CD C -4.540 5.561 11.278 1.00 . A A . 5 PRO CD 1 1 19 33901 1 1 5 PRO CG C -4.224 6.717 10.343 1.00 . A A . 5 PRO CG 1 1 19 33902 1 1 5 PRO HA H -5.987 8.026 12.695 1.00 . A A . 5 PRO HA 1 1 19 33903 1 1 5 PRO HB2 H -5.444 8.482 10.055 1.00 . A A . 5 PRO HB2 1 1 19 33904 1 1 5 PRO HB3 H -4.245 8.647 11.323 1.00 . A A . 5 PRO HB3 1 1 19 33905 1 1 5 PRO HD2 H -4.970 4.719 10.735 1.00 . A A . 5 PRO HD2 1 1 19 33906 1 1 5 PRO HD3 H -3.641 5.195 11.774 1.00 . A A . 5 PRO HD3 1 1 19 33907 1 1 5 PRO HG2 H -4.548 6.486 9.328 1.00 . A A . 5 PRO HG2 1 1 19 33908 1 1 5 PRO HG3 H -3.149 6.892 10.303 1.00 . A A . 5 PRO HG3 1 1 19 33909 1 1 5 PRO N N -5.490 6.111 12.241 1.00 . A A . 5 PRO N 1 1 19 33910 1 1 5 PRO O O -7.933 6.320 11.120 1.00 . A A . 5 PRO O 1 1 19 33911 1 1 6 ALA C C -9.407 7.909 9.317 1.00 . A A . 6 ALA C 1 1 19 33912 1 1 6 ALA CA C -9.298 8.691 10.628 1.00 . A A . 6 ALA CA 1 1 19 33913 1 1 6 ALA CB C -9.661 10.167 10.458 1.00 . A A . 6 ALA CB 1 1 19 33914 1 1 6 ALA H H -7.488 9.453 11.323 1.00 . A A . 6 ALA H 1 1 19 33915 1 1 6 ALA HA H -9.968 8.247 11.364 1.00 . A A . 6 ALA HA 1 1 19 33916 1 1 6 ALA HB1 H -8.878 10.672 9.892 1.00 . A A . 6 ALA HB1 1 1 19 33917 1 1 6 ALA HB2 H -10.607 10.249 9.923 1.00 . A A . 6 ALA HB2 1 1 19 33918 1 1 6 ALA HB3 H -9.758 10.633 11.439 1.00 . A A . 6 ALA HB3 1 1 19 33919 1 1 6 ALA N N -7.943 8.581 11.141 1.00 . A A . 6 ALA N 1 1 19 33920 1 1 6 ALA O O -8.401 7.451 8.778 1.00 . A A . 6 ALA O 1 1 19 33921 1 1 7 ASP C C -10.928 8.054 6.443 1.00 . A A . 7 ASP C 1 1 19 33922 1 1 7 ASP CA C -10.892 7.062 7.606 1.00 . A A . 7 ASP CA 1 1 19 33923 1 1 7 ASP CB C -12.241 6.341 7.655 1.00 . A A . 7 ASP CB 1 1 19 33924 1 1 7 ASP CG C -12.519 5.578 8.951 1.00 . A A . 7 ASP CG 1 1 19 33925 1 1 7 ASP H H -11.450 8.156 9.288 1.00 . A A . 7 ASP H 1 1 19 33926 1 1 7 ASP HA H -10.075 6.345 7.518 1.00 . A A . 7 ASP HA 1 1 19 33927 1 1 7 ASP HB2 H -13.033 7.075 7.505 1.00 . A A . 7 ASP HB2 1 1 19 33928 1 1 7 ASP HB3 H -12.292 5.642 6.821 1.00 . A A . 7 ASP HB3 1 1 19 33929 1 1 7 ASP N N -10.638 7.780 8.843 1.00 . A A . 7 ASP N 1 1 19 33930 1 1 7 ASP O O -11.164 9.245 6.644 1.00 . A A . 7 ASP O 1 1 19 33931 1 1 7 ASP OD1 O -11.906 4.502 9.119 1.00 . A A . 7 ASP OD1 1 1 19 33932 1 1 7 ASP OD2 O -13.339 6.088 9.745 1.00 . A A . 7 ASP OD2 1 1 19 33933 1 1 8 GLY C C -9.306 8.948 3.796 1.00 . A A . 8 GLY C 1 1 19 33934 1 1 8 GLY CA C -10.692 8.353 4.054 1.00 . A A . 8 GLY CA 1 1 19 33935 1 1 8 GLY H H -10.499 6.559 5.095 1.00 . A A . 8 GLY H 1 1 19 33936 1 1 8 GLY HA2 H -11.001 7.756 3.196 1.00 . A A . 8 GLY HA2 1 1 19 33937 1 1 8 GLY HA3 H -11.421 9.156 4.163 1.00 . A A . 8 GLY HA3 1 1 19 33938 1 1 8 GLY N N -10.690 7.528 5.250 1.00 . A A . 8 GLY N 1 1 19 33939 1 1 8 GLY O O -9.188 10.038 3.238 1.00 . A A . 8 GLY O 1 1 19 33940 1 1 9 LEU C C -6.520 8.479 2.568 1.00 . A A . 9 LEU C 1 1 19 33941 1 1 9 LEU CA C -6.918 8.646 4.036 1.00 . A A . 9 LEU CA 1 1 19 33942 1 1 9 LEU CB C -5.991 7.918 5.011 1.00 . A A . 9 LEU CB 1 1 19 33943 1 1 9 LEU CD1 C -4.026 6.998 3.726 1.00 . A A . 9 LEU CD1 1 1 19 33944 1 1 9 LEU CD2 C -4.138 9.469 4.290 1.00 . A A . 9 LEU CD2 1 1 19 33945 1 1 9 LEU CG C -4.492 8.049 4.736 1.00 . A A . 9 LEU CG 1 1 19 33946 1 1 9 LEU H H -8.396 7.320 4.667 1.00 . A A . 9 LEU H 1 1 19 33947 1 1 9 LEU HA H -6.880 9.706 4.286 1.00 . A A . 9 LEU HA 1 1 19 33948 1 1 9 LEU HB2 H -6.189 8.289 6.016 1.00 . A A . 9 LEU HB2 1 1 19 33949 1 1 9 LEU HB3 H -6.250 6.859 5.006 1.00 . A A . 9 LEU HB3 1 1 19 33950 1 1 9 LEU HD11 H -4.828 6.281 3.552 1.00 . A A . 9 LEU HD11 1 1 19 33951 1 1 9 LEU HD12 H -3.765 7.487 2.787 1.00 . A A . 9 LEU HD12 1 1 19 33952 1 1 9 LEU HD13 H -3.152 6.478 4.120 1.00 . A A . 9 LEU HD13 1 1 19 33953 1 1 9 LEU HD21 H -4.914 9.843 3.621 1.00 . A A . 9 LEU HD21 1 1 19 33954 1 1 9 LEU HD22 H -4.067 10.117 5.163 1.00 . A A . 9 LEU HD22 1 1 19 33955 1 1 9 LEU HD23 H -3.182 9.458 3.766 1.00 . A A . 9 LEU HD23 1 1 19 33956 1 1 9 LEU HG H -3.956 7.861 5.666 1.00 . A A . 9 LEU HG 1 1 19 33957 1 1 9 LEU N N -8.291 8.206 4.215 1.00 . A A . 9 LEU N 1 1 19 33958 1 1 9 LEU O O -6.079 7.406 2.159 1.00 . A A . 9 LEU O 1 1 19 33959 1 1 10 LYS C C -4.948 10.111 0.211 1.00 . A A . 10 LYS C 1 1 19 33960 1 1 10 LYS CA C -6.356 9.542 0.402 1.00 . A A . 10 LYS CA 1 1 19 33961 1 1 10 LYS CB C -7.429 10.269 -0.410 1.00 . A A . 10 LYS CB 1 1 19 33962 1 1 10 LYS CD C -7.787 11.587 -2.530 1.00 . A A . 10 LYS CD 1 1 19 33963 1 1 10 LYS CE C -8.145 11.204 -3.968 1.00 . A A . 10 LYS CE 1 1 19 33964 1 1 10 LYS CG C -6.972 10.482 -1.855 1.00 . A A . 10 LYS CG 1 1 19 33965 1 1 10 LYS H H -7.050 10.425 2.156 1.00 . A A . 10 LYS H 1 1 19 33966 1 1 10 LYS HA H -6.355 8.502 0.077 1.00 . A A . 10 LYS HA 1 1 19 33967 1 1 10 LYS HB2 H -8.353 9.692 -0.398 1.00 . A A . 10 LYS HB2 1 1 19 33968 1 1 10 LYS HB3 H -7.649 11.232 0.051 1.00 . A A . 10 LYS HB3 1 1 19 33969 1 1 10 LYS HD2 H -8.699 11.771 -1.962 1.00 . A A . 10 LYS HD2 1 1 19 33970 1 1 10 LYS HD3 H -7.218 12.516 -2.529 1.00 . A A . 10 LYS HD3 1 1 19 33971 1 1 10 LYS HE2 H -8.634 12.043 -4.463 1.00 . A A . 10 LYS HE2 1 1 19 33972 1 1 10 LYS HE3 H -7.237 10.987 -4.530 1.00 . A A . 10 LYS HE3 1 1 19 33973 1 1 10 LYS HG2 H -5.915 10.744 -1.871 1.00 . A A . 10 LYS HG2 1 1 19 33974 1 1 10 LYS HG3 H -7.079 9.553 -2.415 1.00 . A A . 10 LYS HG3 1 1 19 33975 1 1 10 LYS HZ1 H -8.847 9.393 -3.212 1.00 . A A . 10 LYS HZ1 1 1 19 33976 1 1 10 LYS HZ2 H -10.015 10.285 -3.911 1.00 . A A . 10 LYS HZ2 1 1 19 33977 1 1 10 LYS N N -6.691 9.556 1.816 1.00 . A A . 10 LYS N 1 1 19 33978 1 1 10 LYS NZ N -9.038 10.024 -3.983 1.00 . A A . 10 LYS NZ 1 1 19 33979 1 1 10 LYS O O -4.671 11.239 0.615 1.00 . A A . 10 LYS O 1 1 19 33980 1 1 11 MET C C -2.491 9.964 -2.147 1.00 . A A . 11 MET C 1 1 19 33981 1 1 11 MET CA C -2.726 9.714 -0.656 1.00 . A A . 11 MET CA 1 1 19 33982 1 1 11 MET CB C -1.770 8.625 -0.164 1.00 . A A . 11 MET CB 1 1 19 33983 1 1 11 MET CE C -0.679 5.046 -0.147 1.00 . A A . 11 MET CE 1 1 19 33984 1 1 11 MET CG C -1.996 7.314 -0.921 1.00 . A A . 11 MET CG 1 1 19 33985 1 1 11 MET H H -4.331 8.389 -0.733 1.00 . A A . 11 MET H 1 1 19 33986 1 1 11 MET HA H -2.591 10.641 -0.100 1.00 . A A . 11 MET HA 1 1 19 33987 1 1 11 MET HB2 H -0.739 8.953 -0.297 1.00 . A A . 11 MET HB2 1 1 19 33988 1 1 11 MET HB3 H -1.918 8.462 0.904 1.00 . A A . 11 MET HB3 1 1 19 33989 1 1 11 MET HE1 H 0.135 5.741 -0.356 1.00 . A A . 11 MET HE1 1 1 19 33990 1 1 11 MET HE2 H -0.412 4.418 0.703 1.00 . A A . 11 MET HE2 1 1 19 33991 1 1 11 MET HE3 H -0.854 4.418 -1.021 1.00 . A A . 11 MET HE3 1 1 19 33992 1 1 11 MET HG2 H -2.892 7.390 -1.537 1.00 . A A . 11 MET HG2 1 1 19 33993 1 1 11 MET HG3 H -1.160 7.127 -1.596 1.00 . A A . 11 MET HG3 1 1 19 33994 1 1 11 MET N N -4.097 9.305 -0.406 1.00 . A A . 11 MET N 1 1 19 33995 1 1 11 MET O O -2.459 9.024 -2.940 1.00 . A A . 11 MET O 1 1 19 33996 1 1 11 MET SD S -2.162 5.963 0.233 1.00 . A A . 11 MET SD 1 1 19 33997 1 1 12 GLU C C -0.657 12.092 -4.051 1.00 . A A . 12 GLU C 1 1 19 33998 1 1 12 GLU CA C -2.101 11.620 -3.866 1.00 . A A . 12 GLU CA 1 1 19 33999 1 1 12 GLU CB C -3.092 12.699 -4.307 1.00 . A A . 12 GLU CB 1 1 19 34000 1 1 12 GLU CD C -1.999 13.851 -6.267 1.00 . A A . 12 GLU CD 1 1 19 34001 1 1 12 GLU CG C -3.082 12.863 -5.828 1.00 . A A . 12 GLU CG 1 1 19 34002 1 1 12 GLU H H -2.358 11.993 -1.833 1.00 . A A . 12 GLU H 1 1 19 34003 1 1 12 GLU HA H -2.273 10.717 -4.451 1.00 . A A . 12 GLU HA 1 1 19 34004 1 1 12 GLU HB2 H -4.095 12.436 -3.972 1.00 . A A . 12 GLU HB2 1 1 19 34005 1 1 12 GLU HB3 H -2.837 13.648 -3.834 1.00 . A A . 12 GLU HB3 1 1 19 34006 1 1 12 GLU HG2 H -2.911 11.896 -6.301 1.00 . A A . 12 GLU HG2 1 1 19 34007 1 1 12 GLU HG3 H -4.058 13.214 -6.166 1.00 . A A . 12 GLU HG3 1 1 19 34008 1 1 12 GLU N N -2.332 11.235 -2.484 1.00 . A A . 12 GLU N 1 1 19 34009 1 1 12 GLU O O -0.413 13.273 -4.297 1.00 . A A . 12 GLU O 1 1 19 34010 1 1 12 GLU OE1 O -1.968 14.955 -5.682 1.00 . A A . 12 GLU OE1 1 1 19 34011 1 1 12 GLU OE2 O -1.227 13.479 -7.177 1.00 . A A . 12 GLU OE2 1 1 19 34012 1 1 13 ALA C C 2.075 11.279 -5.543 1.00 . A A . 13 ALA C 1 1 19 34013 1 1 13 ALA CA C 1.674 11.451 -4.077 1.00 . A A . 13 ALA CA 1 1 19 34014 1 1 13 ALA CB C 2.492 10.559 -3.141 1.00 . A A . 13 ALA CB 1 1 19 34015 1 1 13 ALA H H 0.055 10.189 -3.727 1.00 . A A . 13 ALA H 1 1 19 34016 1 1 13 ALA HA H 1.822 12.491 -3.788 1.00 . A A . 13 ALA HA 1 1 19 34017 1 1 13 ALA HB1 H 1.827 10.087 -2.417 1.00 . A A . 13 ALA HB1 1 1 19 34018 1 1 13 ALA HB2 H 3.000 9.790 -3.723 1.00 . A A . 13 ALA HB2 1 1 19 34019 1 1 13 ALA HB3 H 3.230 11.164 -2.615 1.00 . A A . 13 ALA HB3 1 1 19 34020 1 1 13 ALA N N 0.262 11.146 -3.927 1.00 . A A . 13 ALA N 1 1 19 34021 1 1 13 ALA O O 3.115 11.779 -5.969 1.00 . A A . 13 ALA O 1 1 19 34022 1 1 14 THR C C 0.277 10.749 -8.526 1.00 . A A . 14 THR C 1 1 19 34023 1 1 14 THR CA C 1.483 10.325 -7.685 1.00 . A A . 14 THR CA 1 1 19 34024 1 1 14 THR CB C 1.849 8.849 -7.851 1.00 . A A . 14 THR CB 1 1 19 34025 1 1 14 THR CG2 C 2.619 8.298 -6.648 1.00 . A A . 14 THR CG2 1 1 19 34026 1 1 14 THR H H 0.386 10.166 -5.922 1.00 . A A . 14 THR H 1 1 19 34027 1 1 14 THR HA H 2.323 10.945 -7.996 1.00 . A A . 14 THR HA 1 1 19 34028 1 1 14 THR HB H 2.404 8.686 -8.775 1.00 . A A . 14 THR HB 1 1 19 34029 1 1 14 THR HG1 H 0.125 8.387 -6.945 1.00 . A A . 14 THR HG1 1 1 19 34030 1 1 14 THR HG21 H 3.378 9.018 -6.342 1.00 . A A . 14 THR HG21 1 1 19 34031 1 1 14 THR HG22 H 1.928 8.125 -5.823 1.00 . A A . 14 THR HG22 1 1 19 34032 1 1 14 THR HG23 H 3.099 7.359 -6.923 1.00 . A A . 14 THR HG23 1 1 19 34033 1 1 14 THR N N 1.230 10.569 -6.276 1.00 . A A . 14 THR N 1 1 19 34034 1 1 14 THR O O -0.729 11.210 -7.987 1.00 . A A . 14 THR O 1 1 19 34035 1 1 14 THR OG1 O 0.596 8.172 -7.800 1.00 . A A . 14 THR OG1 1 1 19 34036 1 1 15 LYS C C -1.866 10.049 -10.489 1.00 . A A . 15 LYS C 1 1 19 34037 1 1 15 LYS CA C -0.649 10.939 -10.752 1.00 . A A . 15 LYS CA 1 1 19 34038 1 1 15 LYS CB C -0.149 10.886 -12.197 1.00 . A A . 15 LYS CB 1 1 19 34039 1 1 15 LYS CD C -0.458 12.248 -14.297 1.00 . A A . 15 LYS CD 1 1 19 34040 1 1 15 LYS CE C -1.134 11.947 -15.637 1.00 . A A . 15 LYS CE 1 1 19 34041 1 1 15 LYS CG C -1.164 11.520 -13.151 1.00 . A A . 15 LYS CG 1 1 19 34042 1 1 15 LYS H H 1.238 10.203 -10.262 1.00 . A A . 15 LYS H 1 1 19 34043 1 1 15 LYS HA H -0.925 11.972 -10.544 1.00 . A A . 15 LYS HA 1 1 19 34044 1 1 15 LYS HB2 H 0.804 11.408 -12.276 1.00 . A A . 15 LYS HB2 1 1 19 34045 1 1 15 LYS HB3 H 0.030 9.851 -12.487 1.00 . A A . 15 LYS HB3 1 1 19 34046 1 1 15 LYS HD2 H -0.471 13.323 -14.113 1.00 . A A . 15 LYS HD2 1 1 19 34047 1 1 15 LYS HD3 H 0.588 11.944 -14.337 1.00 . A A . 15 LYS HD3 1 1 19 34048 1 1 15 LYS HE2 H -0.643 11.100 -16.116 1.00 . A A . 15 LYS HE2 1 1 19 34049 1 1 15 LYS HE3 H -2.173 11.663 -15.471 1.00 . A A . 15 LYS HE3 1 1 19 34050 1 1 15 LYS HG2 H -1.819 10.748 -13.555 1.00 . A A . 15 LYS HG2 1 1 19 34051 1 1 15 LYS HG3 H -1.795 12.220 -12.604 1.00 . A A . 15 LYS HG3 1 1 19 34052 1 1 15 LYS HZ1 H -1.218 12.882 -17.497 1.00 . A A . 15 LYS HZ1 1 1 19 34053 1 1 15 LYS HZ2 H -1.779 13.818 -16.289 1.00 . A A . 15 LYS HZ2 1 1 19 34054 1 1 15 LYS N N 0.417 10.579 -9.832 1.00 . A A . 15 LYS N 1 1 19 34055 1 1 15 LYS NZ N -1.073 13.130 -16.525 1.00 . A A . 15 LYS NZ 1 1 19 34056 1 1 15 LYS O O -2.954 10.314 -10.998 1.00 . A A . 15 LYS O 1 1 19 34057 1 1 16 GLN C C -2.847 7.964 -7.840 1.00 . A A . 16 GLN C 1 1 19 34058 1 1 16 GLN CA C -2.705 8.083 -9.359 1.00 . A A . 16 GLN CA 1 1 19 34059 1 1 16 GLN CB C -2.458 6.713 -9.995 1.00 . A A . 16 GLN CB 1 1 19 34060 1 1 16 GLN CD C -3.335 6.581 -12.356 1.00 . A A . 16 GLN CD 1 1 19 34061 1 1 16 GLN CG C -2.111 6.852 -11.479 1.00 . A A . 16 GLN CG 1 1 19 34062 1 1 16 GLN H H -0.753 8.805 -9.286 1.00 . A A . 16 GLN H 1 1 19 34063 1 1 16 GLN HA H -3.612 8.515 -9.783 1.00 . A A . 16 GLN HA 1 1 19 34064 1 1 16 GLN HB2 H -1.645 6.208 -9.474 1.00 . A A . 16 GLN HB2 1 1 19 34065 1 1 16 GLN HB3 H -3.345 6.090 -9.883 1.00 . A A . 16 GLN HB3 1 1 19 34066 1 1 16 GLN HE21 H -3.342 4.674 -11.675 1.00 . A A . 16 GLN HE21 1 1 19 34067 1 1 16 GLN HE22 H -4.592 5.060 -12.810 1.00 . A A . 16 GLN HE22 1 1 19 34068 1 1 16 GLN HG2 H -1.734 7.856 -11.675 1.00 . A A . 16 GLN HG2 1 1 19 34069 1 1 16 GLN HG3 H -1.313 6.156 -11.736 1.00 . A A . 16 GLN HG3 1 1 19 34070 1 1 16 GLN N N -1.641 9.013 -9.696 1.00 . A A . 16 GLN N 1 1 19 34071 1 1 16 GLN NE2 N -3.794 5.336 -12.274 1.00 . A A . 16 GLN NE2 1 1 19 34072 1 1 16 GLN O O -2.115 7.209 -7.202 1.00 . A A . 16 GLN O 1 1 19 34073 1 1 16 GLN OE1 O -3.829 7.445 -13.061 1.00 . A A . 16 GLN OE1 1 1 19 34074 1 1 17 PRO C C -4.799 7.457 -5.439 1.00 . A A . 17 PRO C 1 1 19 34075 1 1 17 PRO CA C -4.065 8.731 -5.860 1.00 . A A . 17 PRO CA 1 1 19 34076 1 1 17 PRO CB C -4.865 9.995 -5.589 1.00 . A A . 17 PRO CB 1 1 19 34077 1 1 17 PRO CD C -4.704 9.648 -8.016 1.00 . A A . 17 PRO CD 1 1 19 34078 1 1 17 PRO CG C -5.434 10.424 -6.932 1.00 . A A . 17 PRO CG 1 1 19 34079 1 1 17 PRO HA H -3.200 8.726 -5.358 1.00 . A A . 17 PRO HA 1 1 19 34080 1 1 17 PRO HB2 H -5.662 9.806 -4.870 1.00 . A A . 17 PRO HB2 1 1 19 34081 1 1 17 PRO HB3 H -4.232 10.775 -5.166 1.00 . A A . 17 PRO HB3 1 1 19 34082 1 1 17 PRO HD2 H -5.401 9.099 -8.649 1.00 . A A . 17 PRO HD2 1 1 19 34083 1 1 17 PRO HD3 H -4.140 10.315 -8.668 1.00 . A A . 17 PRO HD3 1 1 19 34084 1 1 17 PRO HG2 H -6.505 10.223 -6.975 1.00 . A A . 17 PRO HG2 1 1 19 34085 1 1 17 PRO HG3 H -5.305 11.496 -7.076 1.00 . A A . 17 PRO HG3 1 1 19 34086 1 1 17 PRO N N -3.818 8.742 -7.291 1.00 . A A . 17 PRO N 1 1 19 34087 1 1 17 PRO O O -5.357 6.752 -6.279 1.00 . A A . 17 PRO O 1 1 19 34088 1 1 18 VAL C C -6.071 6.373 -2.252 1.00 . A A . 18 VAL C 1 1 19 34089 1 1 18 VAL CA C -5.433 6.022 -3.598 1.00 . A A . 18 VAL CA 1 1 19 34090 1 1 18 VAL CB C -4.436 4.865 -3.503 1.00 . A A . 18 VAL CB 1 1 19 34091 1 1 18 VAL CG1 C -5.040 3.684 -2.740 1.00 . A A . 18 VAL CG1 1 1 19 34092 1 1 18 VAL CG2 C -3.961 4.436 -4.892 1.00 . A A . 18 VAL CG2 1 1 19 34093 1 1 18 VAL H H -4.320 7.779 -3.463 1.00 . A A . 18 VAL H 1 1 19 34094 1 1 18 VAL HA H -6.219 5.734 -4.295 1.00 . A A . 18 VAL HA 1 1 19 34095 1 1 18 VAL HB H -3.568 5.215 -2.945 1.00 . A A . 18 VAL HB 1 1 19 34096 1 1 18 VAL HG11 H -5.464 4.036 -1.800 1.00 . A A . 18 VAL HG11 1 1 19 34097 1 1 18 VAL HG12 H -5.823 3.224 -3.342 1.00 . A A . 18 VAL HG12 1 1 19 34098 1 1 18 VAL HG13 H -4.261 2.948 -2.535 1.00 . A A . 18 VAL HG13 1 1 19 34099 1 1 18 VAL HG21 H -4.716 4.699 -5.632 1.00 . A A . 18 VAL HG21 1 1 19 34100 1 1 18 VAL HG22 H -3.026 4.944 -5.130 1.00 . A A . 18 VAL HG22 1 1 19 34101 1 1 18 VAL HG23 H -3.801 3.357 -4.904 1.00 . A A . 18 VAL HG23 1 1 19 34102 1 1 18 VAL N N -4.776 7.200 -4.140 1.00 . A A . 18 VAL N 1 1 19 34103 1 1 18 VAL O O -5.600 7.269 -1.552 1.00 . A A . 18 VAL O 1 1 19 34104 1 1 19 VAL C C -7.799 4.597 0.160 1.00 . A A . 19 VAL C 1 1 19 34105 1 1 19 VAL CA C -7.841 5.874 -0.682 1.00 . A A . 19 VAL CA 1 1 19 34106 1 1 19 VAL CB C -9.266 6.355 -0.967 1.00 . A A . 19 VAL CB 1 1 19 34107 1 1 19 VAL CG1 C -10.129 6.290 0.294 1.00 . A A . 19 VAL CG1 1 1 19 34108 1 1 19 VAL CG2 C -9.260 7.767 -1.556 1.00 . A A . 19 VAL CG2 1 1 19 34109 1 1 19 VAL H H -7.510 4.924 -2.506 1.00 . A A . 19 VAL H 1 1 19 34110 1 1 19 VAL HA H -7.319 6.666 -0.145 1.00 . A A . 19 VAL HA 1 1 19 34111 1 1 19 VAL HB H -9.704 5.686 -1.707 1.00 . A A . 19 VAL HB 1 1 19 34112 1 1 19 VAL HG11 H -9.486 6.242 1.173 1.00 . A A . 19 VAL HG11 1 1 19 34113 1 1 19 VAL HG12 H -10.756 7.180 0.352 1.00 . A A . 19 VAL HG12 1 1 19 34114 1 1 19 VAL HG13 H -10.760 5.402 0.257 1.00 . A A . 19 VAL HG13 1 1 19 34115 1 1 19 VAL HG21 H -8.233 8.125 -1.632 1.00 . A A . 19 VAL HG21 1 1 19 34116 1 1 19 VAL HG22 H -9.714 7.750 -2.546 1.00 . A A . 19 VAL HG22 1 1 19 34117 1 1 19 VAL HG23 H -9.829 8.434 -0.907 1.00 . A A . 19 VAL HG23 1 1 19 34118 1 1 19 VAL N N -7.133 5.650 -1.931 1.00 . A A . 19 VAL N 1 1 19 34119 1 1 19 VAL O O -8.375 3.579 -0.221 1.00 . A A . 19 VAL O 1 1 19 34120 1 1 20 PHE C C -7.823 3.764 3.450 1.00 . A A . 20 PHE C 1 1 19 34121 1 1 20 PHE CA C -6.985 3.558 2.186 1.00 . A A . 20 PHE CA 1 1 19 34122 1 1 20 PHE CB C -5.507 3.489 2.575 1.00 . A A . 20 PHE CB 1 1 19 34123 1 1 20 PHE CD1 C -4.890 1.067 2.901 1.00 . A A . 20 PHE CD1 1 1 19 34124 1 1 20 PHE CD2 C -5.096 2.454 4.837 1.00 . A A . 20 PHE CD2 1 1 19 34125 1 1 20 PHE CE1 C -4.556 -0.055 3.741 1.00 . A A . 20 PHE CE1 1 1 19 34126 1 1 20 PHE CE2 C -4.763 1.333 5.676 1.00 . A A . 20 PHE CE2 1 1 19 34127 1 1 20 PHE CG C -5.153 2.298 3.467 1.00 . A A . 20 PHE CG 1 1 19 34128 1 1 20 PHE CZ C -4.510 0.133 5.087 1.00 . A A . 20 PHE CZ 1 1 19 34129 1 1 20 PHE H H -6.645 5.525 1.590 1.00 . A A . 20 PHE H 1 1 19 34130 1 1 20 PHE HA H -7.344 2.672 1.662 1.00 . A A . 20 PHE HA 1 1 19 34131 1 1 20 PHE HB2 H -4.905 3.442 1.667 1.00 . A A . 20 PHE HB2 1 1 19 34132 1 1 20 PHE HB3 H -5.234 4.410 3.091 1.00 . A A . 20 PHE HB3 1 1 19 34133 1 1 20 PHE HD1 H -4.934 0.943 1.819 1.00 . A A . 20 PHE HD1 1 1 19 34134 1 1 20 PHE HD2 H -5.304 3.427 5.283 1.00 . A A . 20 PHE HD2 1 1 19 34135 1 1 20 PHE HE1 H -4.346 -1.033 3.307 1.00 . A A . 20 PHE HE1 1 1 19 34136 1 1 20 PHE HE2 H -4.715 1.442 6.760 1.00 . A A . 20 PHE HE2 1 1 19 34137 1 1 20 PHE HZ H -4.221 -0.790 5.650 1.00 . A A . 20 PHE HZ 1 1 19 34138 1 1 20 PHE N N -7.111 4.693 1.288 1.00 . A A . 20 PHE N 1 1 19 34139 1 1 20 PHE O O -7.860 4.862 4.003 1.00 . A A . 20 PHE O 1 1 19 34140 1 1 21 ASN C C -8.774 1.750 6.095 1.00 . A A . 21 ASN C 1 1 19 34141 1 1 21 ASN CA C -9.311 2.739 5.058 1.00 . A A . 21 ASN CA 1 1 19 34142 1 1 21 ASN CB C -10.754 2.346 4.733 1.00 . A A . 21 ASN CB 1 1 19 34143 1 1 21 ASN CG C -11.487 3.488 4.026 1.00 . A A . 21 ASN CG 1 1 19 34144 1 1 21 ASN H H -8.440 1.800 3.415 1.00 . A A . 21 ASN H 1 1 19 34145 1 1 21 ASN HA H -9.260 3.772 5.401 1.00 . A A . 21 ASN HA 1 1 19 34146 1 1 21 ASN HB2 H -10.759 1.459 4.100 1.00 . A A . 21 ASN HB2 1 1 19 34147 1 1 21 ASN HB3 H -11.279 2.086 5.652 1.00 . A A . 21 ASN HB3 1 1 19 34148 1 1 21 ASN HD21 H -12.886 2.155 3.425 1.00 . A A . 21 ASN HD21 1 1 19 34149 1 1 21 ASN HD22 H -13.149 3.788 2.911 1.00 . A A . 21 ASN HD22 1 1 19 34150 1 1 21 ASN N N -8.476 2.690 3.870 1.00 . A A . 21 ASN N 1 1 19 34151 1 1 21 ASN ND2 N -12.599 3.113 3.402 1.00 . A A . 21 ASN ND2 1 1 19 34152 1 1 21 ASN O O -8.808 0.539 5.879 1.00 . A A . 21 ASN O 1 1 19 34153 1 1 21 ASN OD1 O -11.070 4.635 4.046 1.00 . A A . 21 ASN OD1 1 1 19 34154 1 1 22 HIS C C -8.860 0.624 8.872 1.00 . A A . 22 HIS C 1 1 19 34155 1 1 22 HIS CA C -7.748 1.484 8.269 1.00 . A A . 22 HIS CA 1 1 19 34156 1 1 22 HIS CB C -7.039 2.353 9.310 1.00 . A A . 22 HIS CB 1 1 19 34157 1 1 22 HIS CD2 C -4.443 2.067 9.209 1.00 . A A . 22 HIS CD2 1 1 19 34158 1 1 22 HIS CE1 C -3.974 3.878 8.075 1.00 . A A . 22 HIS CE1 1 1 19 34159 1 1 22 HIS CG C -5.617 2.709 8.947 1.00 . A A . 22 HIS CG 1 1 19 34160 1 1 22 HIS H H -8.268 3.288 7.366 1.00 . A A . 22 HIS H 1 1 19 34161 1 1 22 HIS HA H -7.001 0.832 7.816 1.00 . A A . 22 HIS HA 1 1 19 34162 1 1 22 HIS HB2 H -7.609 3.272 9.450 1.00 . A A . 22 HIS HB2 1 1 19 34163 1 1 22 HIS HB3 H -7.039 1.829 10.266 1.00 . A A . 22 HIS HB3 1 1 19 34164 1 1 22 HIS HD1 H -5.935 4.531 7.890 1.00 . A A . 22 HIS HD1 1 1 19 34165 1 1 22 HIS HD2 H -4.337 1.132 9.759 1.00 . A A . 22 HIS HD2 1 1 19 34166 1 1 22 HIS HE1 H -3.408 4.650 7.553 1.00 . A A . 22 HIS HE1 1 1 19 34167 1 1 22 HIS N N -8.292 2.303 7.198 1.00 . A A . 22 HIS N 1 1 19 34168 1 1 22 HIS ND1 N -5.289 3.847 8.231 1.00 . A A . 22 HIS ND1 1 1 19 34169 1 1 22 HIS NE2 N -3.451 2.773 8.681 1.00 . A A . 22 HIS NE2 1 1 19 34170 1 1 22 HIS O O -8.587 -0.400 9.498 1.00 . A A . 22 HIS O 1 1 19 34171 1 1 23 SER C C -11.507 -0.892 8.335 1.00 . A A . 23 SER C 1 1 19 34172 1 1 23 SER CA C -11.244 0.355 9.180 1.00 . A A . 23 SER CA 1 1 19 34173 1 1 23 SER CB C -12.483 1.252 9.202 1.00 . A A . 23 SER CB 1 1 19 34174 1 1 23 SER H H -10.302 1.905 8.154 1.00 . A A . 23 SER H 1 1 19 34175 1 1 23 SER HA H -10.979 0.078 10.200 1.00 . A A . 23 SER HA 1 1 19 34176 1 1 23 SER HB2 H -13.279 0.757 9.759 1.00 . A A . 23 SER HB2 1 1 19 34177 1 1 23 SER HB3 H -12.252 2.177 9.731 1.00 . A A . 23 SER HB3 1 1 19 34178 1 1 23 SER HG H -12.250 1.305 7.215 1.00 . A A . 23 SER HG 1 1 19 34179 1 1 23 SER N N -10.089 1.071 8.664 1.00 . A A . 23 SER N 1 1 19 34180 1 1 23 SER O O -12.403 -1.677 8.641 1.00 . A A . 23 SER O 1 1 19 34181 1 1 23 SER OG O -12.944 1.559 7.889 1.00 . A A . 23 SER OG 1 1 19 34182 1 1 24 THR C C -9.743 -3.202 6.668 1.00 . A A . 24 THR C 1 1 19 34183 1 1 24 THR CA C -10.844 -2.176 6.394 1.00 . A A . 24 THR CA 1 1 19 34184 1 1 24 THR CB C -10.843 -1.653 4.957 1.00 . A A . 24 THR CB 1 1 19 34185 1 1 24 THR CG2 C -10.856 -2.781 3.923 1.00 . A A . 24 THR CG2 1 1 19 34186 1 1 24 THR H H -9.982 -0.394 7.044 1.00 . A A . 24 THR H 1 1 19 34187 1 1 24 THR HA H -11.796 -2.665 6.603 1.00 . A A . 24 THR HA 1 1 19 34188 1 1 24 THR HB H -10.003 -0.980 4.788 1.00 . A A . 24 THR HB 1 1 19 34189 1 1 24 THR HG1 H -12.165 -0.209 5.373 1.00 . A A . 24 THR HG1 1 1 19 34190 1 1 24 THR HG21 H -10.980 -3.737 4.431 1.00 . A A . 24 THR HG21 1 1 19 34191 1 1 24 THR HG22 H -11.682 -2.628 3.229 1.00 . A A . 24 THR HG22 1 1 19 34192 1 1 24 THR HG23 H -9.915 -2.781 3.374 1.00 . A A . 24 THR HG23 1 1 19 34193 1 1 24 THR N N -10.709 -1.037 7.287 1.00 . A A . 24 THR N 1 1 19 34194 1 1 24 THR O O -9.963 -4.405 6.536 1.00 . A A . 24 THR O 1 1 19 34195 1 1 24 THR OG1 O -12.119 -1.035 4.811 1.00 . A A . 24 THR OG1 1 1 19 34196 1 1 25 HIS C C -7.288 -3.690 8.854 1.00 . A A . 25 HIS C 1 1 19 34197 1 1 25 HIS CA C -7.445 -3.546 7.339 1.00 . A A . 25 HIS CA 1 1 19 34198 1 1 25 HIS CB C -6.178 -3.020 6.660 1.00 . A A . 25 HIS CB 1 1 19 34199 1 1 25 HIS CD2 C -5.793 -3.669 4.158 1.00 . A A . 25 HIS CD2 1 1 19 34200 1 1 25 HIS CE1 C -6.910 -2.030 3.235 1.00 . A A . 25 HIS CE1 1 1 19 34201 1 1 25 HIS CG C -6.294 -2.892 5.160 1.00 . A A . 25 HIS CG 1 1 19 34202 1 1 25 HIS H H -8.410 -1.709 7.152 1.00 . A A . 25 HIS H 1 1 19 34203 1 1 25 HIS HA H -7.670 -4.522 6.911 1.00 . A A . 25 HIS HA 1 1 19 34204 1 1 25 HIS HB2 H -5.931 -2.045 7.080 1.00 . A A . 25 HIS HB2 1 1 19 34205 1 1 25 HIS HB3 H -5.349 -3.688 6.894 1.00 . A A . 25 HIS HB3 1 1 19 34206 1 1 25 HIS HD1 H -7.479 -1.128 5.015 1.00 . A A . 25 HIS HD1 1 1 19 34207 1 1 25 HIS HD2 H -5.188 -4.567 4.289 1.00 . A A . 25 HIS HD2 1 1 19 34208 1 1 25 HIS HE1 H -7.358 -1.385 2.479 1.00 . A A . 25 HIS HE1 1 1 19 34209 1 1 25 HIS N N -8.581 -2.689 7.046 1.00 . A A . 25 HIS N 1 1 19 34210 1 1 25 HIS ND1 N -6.993 -1.867 4.547 1.00 . A A . 25 HIS ND1 1 1 19 34211 1 1 25 HIS NE2 N -6.166 -3.148 2.995 1.00 . A A . 25 HIS NE2 1 1 19 34212 1 1 25 HIS O O -6.170 -3.752 9.364 1.00 . A A . 25 HIS O 1 1 19 34213 1 1 26 LYS C C -7.907 -5.260 11.359 1.00 . A A . 26 LYS C 1 1 19 34214 1 1 26 LYS CA C -8.429 -3.873 10.979 1.00 . A A . 26 LYS CA 1 1 19 34215 1 1 26 LYS CB C -9.818 -3.563 11.543 1.00 . A A . 26 LYS CB 1 1 19 34216 1 1 26 LYS CD C -11.740 -1.931 11.547 1.00 . A A . 26 LYS CD 1 1 19 34217 1 1 26 LYS CE C -11.709 -1.238 12.911 1.00 . A A . 26 LYS CE 1 1 19 34218 1 1 26 LYS CG C -10.323 -2.209 11.041 1.00 . A A . 26 LYS CG 1 1 19 34219 1 1 26 LYS H H -9.331 -3.686 9.111 1.00 . A A . 26 LYS H 1 1 19 34220 1 1 26 LYS HA H -7.745 -3.125 11.379 1.00 . A A . 26 LYS HA 1 1 19 34221 1 1 26 LYS HB2 H -10.516 -4.347 11.251 1.00 . A A . 26 LYS HB2 1 1 19 34222 1 1 26 LYS HB3 H -9.779 -3.560 12.632 1.00 . A A . 26 LYS HB3 1 1 19 34223 1 1 26 LYS HD2 H -12.271 -1.306 10.830 1.00 . A A . 26 LYS HD2 1 1 19 34224 1 1 26 LYS HD3 H -12.293 -2.868 11.624 1.00 . A A . 26 LYS HD3 1 1 19 34225 1 1 26 LYS HE2 H -10.699 -1.271 13.319 1.00 . A A . 26 LYS HE2 1 1 19 34226 1 1 26 LYS HE3 H -11.973 -0.187 12.797 1.00 . A A . 26 LYS HE3 1 1 19 34227 1 1 26 LYS HG2 H -9.652 -1.419 11.377 1.00 . A A . 26 LYS HG2 1 1 19 34228 1 1 26 LYS HG3 H -10.314 -2.194 9.951 1.00 . A A . 26 LYS HG3 1 1 19 34229 1 1 26 LYS HZ1 H -13.580 -1.980 13.453 1.00 . A A . 26 LYS HZ1 1 1 19 34230 1 1 26 LYS HZ2 H -12.348 -2.829 14.096 1.00 . A A . 26 LYS HZ2 1 1 19 34231 1 1 26 LYS N N -8.426 -3.738 9.533 1.00 . A A . 26 LYS N 1 1 19 34232 1 1 26 LYS NZ N -12.650 -1.894 13.847 1.00 . A A . 26 LYS NZ 1 1 19 34233 1 1 26 LYS O O -7.184 -5.407 12.343 1.00 . A A . 26 LYS O 1 1 19 34234 1 1 27 SER C C -6.396 -7.778 10.436 1.00 . A A . 27 SER C 1 1 19 34235 1 1 27 SER CA C -7.873 -7.612 10.799 1.00 . A A . 27 SER CA 1 1 19 34236 1 1 27 SER CB C -8.729 -8.599 10.002 1.00 . A A . 27 SER CB 1 1 19 34237 1 1 27 SER H H -8.882 -6.114 9.760 1.00 . A A . 27 SER H 1 1 19 34238 1 1 27 SER HA H -8.026 -7.779 11.865 1.00 . A A . 27 SER HA 1 1 19 34239 1 1 27 SER HB2 H -8.503 -9.616 10.322 1.00 . A A . 27 SER HB2 1 1 19 34240 1 1 27 SER HB3 H -9.783 -8.423 10.219 1.00 . A A . 27 SER HB3 1 1 19 34241 1 1 27 SER HG H -7.707 -7.914 8.423 1.00 . A A . 27 SER HG 1 1 19 34242 1 1 27 SER N N -8.293 -6.242 10.558 1.00 . A A . 27 SER N 1 1 19 34243 1 1 27 SER O O -5.765 -8.760 10.823 1.00 . A A . 27 SER O 1 1 19 34244 1 1 27 SER OG O -8.510 -8.483 8.598 1.00 . A A . 27 SER OG 1 1 19 34245 1 1 28 VAL C C -3.625 -6.226 10.379 1.00 . A A . 28 VAL C 1 1 19 34246 1 1 28 VAL CA C -4.498 -6.829 9.276 1.00 . A A . 28 VAL CA 1 1 19 34247 1 1 28 VAL CB C -4.343 -6.112 7.933 1.00 . A A . 28 VAL CB 1 1 19 34248 1 1 28 VAL CG1 C -2.919 -6.261 7.393 1.00 . A A . 28 VAL CG1 1 1 19 34249 1 1 28 VAL CG2 C -5.370 -6.621 6.919 1.00 . A A . 28 VAL CG2 1 1 19 34250 1 1 28 VAL H H -6.409 -6.008 9.385 1.00 . A A . 28 VAL H 1 1 19 34251 1 1 28 VAL HA H -4.216 -7.872 9.136 1.00 . A A . 28 VAL HA 1 1 19 34252 1 1 28 VAL HB H -4.531 -5.051 8.096 1.00 . A A . 28 VAL HB 1 1 19 34253 1 1 28 VAL HG11 H -2.220 -6.326 8.227 1.00 . A A . 28 VAL HG11 1 1 19 34254 1 1 28 VAL HG12 H -2.852 -7.166 6.791 1.00 . A A . 28 VAL HG12 1 1 19 34255 1 1 28 VAL HG13 H -2.672 -5.396 6.778 1.00 . A A . 28 VAL HG13 1 1 19 34256 1 1 28 VAL HG21 H -5.718 -7.609 7.219 1.00 . A A . 28 VAL HG21 1 1 19 34257 1 1 28 VAL HG22 H -6.215 -5.933 6.882 1.00 . A A . 28 VAL HG22 1 1 19 34258 1 1 28 VAL HG23 H -4.908 -6.682 5.934 1.00 . A A . 28 VAL HG23 1 1 19 34259 1 1 28 VAL N N -5.889 -6.803 9.696 1.00 . A A . 28 VAL N 1 1 19 34260 1 1 28 VAL O O -4.016 -5.254 11.023 1.00 . A A . 28 VAL O 1 1 19 34261 1 1 29 LYS C C -0.884 -5.057 11.111 1.00 . A A . 29 LYS C 1 1 19 34262 1 1 29 LYS CA C -1.529 -6.364 11.577 1.00 . A A . 29 LYS CA 1 1 19 34263 1 1 29 LYS CB C -0.518 -7.460 11.920 1.00 . A A . 29 LYS CB 1 1 19 34264 1 1 29 LYS CD C 0.643 -8.396 13.954 1.00 . A A . 29 LYS CD 1 1 19 34265 1 1 29 LYS CE C 0.447 -9.007 15.342 1.00 . A A . 29 LYS CE 1 1 19 34266 1 1 29 LYS CG C -0.691 -7.933 13.365 1.00 . A A . 29 LYS CG 1 1 19 34267 1 1 29 LYS H H -2.149 -7.619 10.035 1.00 . A A . 29 LYS H 1 1 19 34268 1 1 29 LYS HA H -2.104 -6.162 12.481 1.00 . A A . 29 LYS HA 1 1 19 34269 1 1 29 LYS HB2 H -0.645 -8.303 11.240 1.00 . A A . 29 LYS HB2 1 1 19 34270 1 1 29 LYS HB3 H 0.495 -7.084 11.775 1.00 . A A . 29 LYS HB3 1 1 19 34271 1 1 29 LYS HD2 H 1.103 -9.129 13.291 1.00 . A A . 29 LYS HD2 1 1 19 34272 1 1 29 LYS HD3 H 1.328 -7.550 14.018 1.00 . A A . 29 LYS HD3 1 1 19 34273 1 1 29 LYS HE2 H 0.101 -8.243 16.037 1.00 . A A . 29 LYS HE2 1 1 19 34274 1 1 29 LYS HE3 H -0.326 -9.775 15.302 1.00 . A A . 29 LYS HE3 1 1 19 34275 1 1 29 LYS HG2 H -1.099 -7.124 13.970 1.00 . A A . 29 LYS HG2 1 1 19 34276 1 1 29 LYS HG3 H -1.411 -8.751 13.399 1.00 . A A . 29 LYS HG3 1 1 19 34277 1 1 29 LYS HZ1 H 1.747 -10.599 15.688 1.00 . A A . 29 LYS HZ1 1 1 19 34278 1 1 29 LYS HZ2 H 2.522 -9.204 15.363 1.00 . A A . 29 LYS HZ2 1 1 19 34279 1 1 29 LYS N N -2.460 -6.829 10.563 1.00 . A A . 29 LYS N 1 1 19 34280 1 1 29 LYS NZ N 1.713 -9.596 15.833 1.00 . A A . 29 LYS NZ 1 1 19 34281 1 1 29 LYS O O -0.600 -4.889 9.926 1.00 . A A . 29 LYS O 1 1 19 34282 1 1 30 CYS C C 1.363 -3.121 11.281 1.00 . A A . 30 CYS C 1 1 19 34283 1 1 30 CYS CA C -0.066 -2.878 11.769 1.00 . A A . 30 CYS CA 1 1 19 34284 1 1 30 CYS CB C -0.104 -1.941 12.979 1.00 . A A . 30 CYS CB 1 1 19 34285 1 1 30 CYS H H -0.906 -4.309 13.029 1.00 . A A . 30 CYS H 1 1 19 34286 1 1 30 CYS HA H -0.671 -2.421 10.986 1.00 . A A . 30 CYS HA 1 1 19 34287 1 1 30 CYS HB2 H 0.745 -2.168 13.623 1.00 . A A . 30 CYS HB2 1 1 19 34288 1 1 30 CYS HB3 H 0.024 -0.916 12.631 1.00 . A A . 30 CYS HB3 1 1 19 34289 1 1 30 CYS N N -0.672 -4.165 12.067 1.00 . A A . 30 CYS N 1 1 19 34290 1 1 30 CYS O O 1.878 -2.368 10.457 1.00 . A A . 30 CYS O 1 1 19 34291 1 1 30 CYS SG S -1.637 -2.035 13.974 1.00 . A A . 30 CYS SG 1 1 19 34292 1 1 31 GLY C C 3.362 -5.190 10.059 1.00 . A A . 31 GLY C 1 1 19 34293 1 1 31 GLY CA C 3.323 -4.529 11.439 1.00 . A A . 31 GLY CA 1 1 19 34294 1 1 31 GLY H H 1.538 -4.785 12.480 1.00 . A A . 31 GLY H 1 1 19 34295 1 1 31 GLY HA2 H 3.946 -3.634 11.434 1.00 . A A . 31 GLY HA2 1 1 19 34296 1 1 31 GLY HA3 H 3.744 -5.206 12.182 1.00 . A A . 31 GLY HA3 1 1 19 34297 1 1 31 GLY N N 1.964 -4.177 11.810 1.00 . A A . 31 GLY N 1 1 19 34298 1 1 31 GLY O O 4.436 -5.489 9.539 1.00 . A A . 31 GLY O 1 1 19 34299 1 1 32 ASP C C 2.320 -4.970 7.115 1.00 . A A . 32 ASP C 1 1 19 34300 1 1 32 ASP CA C 2.060 -6.020 8.197 1.00 . A A . 32 ASP CA 1 1 19 34301 1 1 32 ASP CB C 0.656 -6.587 7.979 1.00 . A A . 32 ASP CB 1 1 19 34302 1 1 32 ASP CG C 0.523 -7.546 6.795 1.00 . A A . 32 ASP CG 1 1 19 34303 1 1 32 ASP H H 1.307 -5.154 9.936 1.00 . A A . 32 ASP H 1 1 19 34304 1 1 32 ASP HA H 2.803 -6.818 8.192 1.00 . A A . 32 ASP HA 1 1 19 34305 1 1 32 ASP HB2 H 0.345 -7.106 8.885 1.00 . A A . 32 ASP HB2 1 1 19 34306 1 1 32 ASP HB3 H -0.036 -5.757 7.834 1.00 . A A . 32 ASP HB3 1 1 19 34307 1 1 32 ASP N N 2.176 -5.399 9.506 1.00 . A A . 32 ASP N 1 1 19 34308 1 1 32 ASP O O 2.884 -5.281 6.067 1.00 . A A . 32 ASP O 1 1 19 34309 1 1 32 ASP OD1 O 0.962 -7.153 5.693 1.00 . A A . 32 ASP OD1 1 1 19 34310 1 1 32 ASP OD2 O -0.016 -8.652 7.018 1.00 . A A . 32 ASP OD2 1 1 19 34311 1 1 33 CYS C C 3.202 -1.757 6.991 1.00 . A A . 33 CYS C 1 1 19 34312 1 1 33 CYS CA C 2.076 -2.652 6.471 1.00 . A A . 33 CYS CA 1 1 19 34313 1 1 33 CYS CB C 0.777 -1.871 6.259 1.00 . A A . 33 CYS CB 1 1 19 34314 1 1 33 CYS H H 1.439 -3.505 8.261 1.00 . A A . 33 CYS H 1 1 19 34315 1 1 33 CYS HA H 2.347 -3.098 5.514 1.00 . A A . 33 CYS HA 1 1 19 34316 1 1 33 CYS HB2 H 0.193 -1.864 7.179 1.00 . A A . 33 CYS HB2 1 1 19 34317 1 1 33 CYS HB3 H 1.003 -0.832 6.017 1.00 . A A . 33 CYS HB3 1 1 19 34318 1 1 33 CYS N N 1.896 -3.749 7.406 1.00 . A A . 33 CYS N 1 1 19 34319 1 1 33 CYS O O 4.173 -1.499 6.281 1.00 . A A . 33 CYS O 1 1 19 34320 1 1 33 CYS SG S -0.196 -2.629 4.907 1.00 . A A . 33 CYS SG 1 1 19 34321 1 1 34 HIS C C 5.234 -1.279 9.276 1.00 . A A . 34 HIS C 1 1 19 34322 1 1 34 HIS CA C 4.025 -0.445 8.849 1.00 . A A . 34 HIS CA 1 1 19 34323 1 1 34 HIS CB C 3.408 0.342 10.007 1.00 . A A . 34 HIS CB 1 1 19 34324 1 1 34 HIS CD2 C 0.922 1.050 9.626 1.00 . A A . 34 HIS CD2 1 1 19 34325 1 1 34 HIS CE1 C 1.287 3.055 8.829 1.00 . A A . 34 HIS CE1 1 1 19 34326 1 1 34 HIS CG C 2.271 1.247 9.598 1.00 . A A . 34 HIS CG 1 1 19 34327 1 1 34 HIS H H 2.242 -1.521 8.796 1.00 . A A . 34 HIS H 1 1 19 34328 1 1 34 HIS HA H 4.338 0.271 8.090 1.00 . A A . 34 HIS HA 1 1 19 34329 1 1 34 HIS HB2 H 3.048 -0.360 10.759 1.00 . A A . 34 HIS HB2 1 1 19 34330 1 1 34 HIS HB3 H 4.186 0.943 10.479 1.00 . A A . 34 HIS HB3 1 1 19 34331 1 1 34 HIS HD1 H 3.357 2.959 8.946 1.00 . A A . 34 HIS HD1 1 1 19 34332 1 1 34 HIS HD2 H 0.416 0.148 9.971 1.00 . A A . 34 HIS HD2 1 1 19 34333 1 1 34 HIS HE1 H 1.111 4.050 8.419 1.00 . A A . 34 HIS HE1 1 1 19 34334 1 1 34 HIS N N 3.035 -1.307 8.226 1.00 . A A . 34 HIS N 1 1 19 34335 1 1 34 HIS ND1 N 2.470 2.519 9.090 1.00 . A A . 34 HIS ND1 1 1 19 34336 1 1 34 HIS NE2 N 0.329 2.144 9.162 1.00 . A A . 34 HIS NE2 1 1 19 34337 1 1 34 HIS O O 5.595 -1.298 10.452 1.00 . A A . 34 HIS O 1 1 19 34338 1 1 35 HIS C C 7.947 -2.048 9.498 1.00 . A A . 35 HIS C 1 1 19 34339 1 1 35 HIS CA C 6.988 -2.782 8.558 1.00 . A A . 35 HIS CA 1 1 19 34340 1 1 35 HIS CB C 7.654 -3.210 7.249 1.00 . A A . 35 HIS CB 1 1 19 34341 1 1 35 HIS CD2 C 7.826 -1.476 5.301 1.00 . A A . 35 HIS CD2 1 1 19 34342 1 1 35 HIS CE1 C 9.654 -0.462 5.946 1.00 . A A . 35 HIS CE1 1 1 19 34343 1 1 35 HIS CG C 8.243 -2.067 6.457 1.00 . A A . 35 HIS CG 1 1 19 34344 1 1 35 HIS H H 5.527 -1.926 7.344 1.00 . A A . 35 HIS H 1 1 19 34345 1 1 35 HIS HA H 6.623 -3.681 9.055 1.00 . A A . 35 HIS HA 1 1 19 34346 1 1 35 HIS HB2 H 8.443 -3.929 7.472 1.00 . A A . 35 HIS HB2 1 1 19 34347 1 1 35 HIS HB3 H 6.918 -3.726 6.631 1.00 . A A . 35 HIS HB3 1 1 19 34348 1 1 35 HIS HD1 H 9.945 -1.609 7.652 1.00 . A A . 35 HIS HD1 1 1 19 34349 1 1 35 HIS HD2 H 6.942 -1.753 4.726 1.00 . A A . 35 HIS HD2 1 1 19 34350 1 1 35 HIS HE1 H 10.497 0.229 5.969 1.00 . A A . 35 HIS HE1 1 1 19 34351 1 1 35 HIS N N 5.827 -1.948 8.298 1.00 . A A . 35 HIS N 1 1 19 34352 1 1 35 HIS ND1 N 9.398 -1.407 6.839 1.00 . A A . 35 HIS ND1 1 1 19 34353 1 1 35 HIS NE2 N 8.679 -0.506 4.994 1.00 . A A . 35 HIS NE2 1 1 19 34354 1 1 35 HIS O O 8.025 -0.821 9.477 1.00 . A A . 35 HIS O 1 1 19 34355 1 1 36 PRO C C 10.891 -1.820 10.556 1.00 . A A . 36 PRO C 1 1 19 34356 1 1 36 PRO CA C 9.622 -2.292 11.268 1.00 . A A . 36 PRO CA 1 1 19 34357 1 1 36 PRO CB C 9.882 -3.405 12.270 1.00 . A A . 36 PRO CB 1 1 19 34358 1 1 36 PRO CD C 8.605 -4.309 10.375 1.00 . A A . 36 PRO CD 1 1 19 34359 1 1 36 PRO CG C 9.433 -4.689 11.592 1.00 . A A . 36 PRO CG 1 1 19 34360 1 1 36 PRO HA H 9.237 -1.480 11.707 1.00 . A A . 36 PRO HA 1 1 19 34361 1 1 36 PRO HB2 H 10.938 -3.452 12.536 1.00 . A A . 36 PRO HB2 1 1 19 34362 1 1 36 PRO HB3 H 9.328 -3.237 13.193 1.00 . A A . 36 PRO HB3 1 1 19 34363 1 1 36 PRO HD2 H 9.008 -4.757 9.467 1.00 . A A . 36 PRO HD2 1 1 19 34364 1 1 36 PRO HD3 H 7.576 -4.655 10.472 1.00 . A A . 36 PRO HD3 1 1 19 34365 1 1 36 PRO HG2 H 10.295 -5.286 11.296 1.00 . A A . 36 PRO HG2 1 1 19 34366 1 1 36 PRO HG3 H 8.845 -5.298 12.279 1.00 . A A . 36 PRO HG3 1 1 19 34367 1 1 36 PRO N N 8.671 -2.852 10.322 1.00 . A A . 36 PRO N 1 1 19 34368 1 1 36 PRO O O 11.612 -2.624 9.967 1.00 . A A . 36 PRO O 1 1 19 34369 1 1 37 VAL C C 13.474 0.018 10.976 1.00 . A A . 37 VAL C 1 1 19 34370 1 1 37 VAL CA C 12.295 0.070 10.003 1.00 . A A . 37 VAL CA 1 1 19 34371 1 1 37 VAL CB C 11.975 1.489 9.528 1.00 . A A . 37 VAL CB 1 1 19 34372 1 1 37 VAL CG1 C 13.254 2.250 9.172 1.00 . A A . 37 VAL CG1 1 1 19 34373 1 1 37 VAL CG2 C 11.004 1.465 8.345 1.00 . A A . 37 VAL CG2 1 1 19 34374 1 1 37 VAL H H 10.534 0.129 11.115 1.00 . A A . 37 VAL H 1 1 19 34375 1 1 37 VAL HA H 12.535 -0.533 9.128 1.00 . A A . 37 VAL HA 1 1 19 34376 1 1 37 VAL HB H 11.489 2.016 10.349 1.00 . A A . 37 VAL HB 1 1 19 34377 1 1 37 VAL HG11 H 14.111 1.584 9.270 1.00 . A A . 37 VAL HG11 1 1 19 34378 1 1 37 VAL HG12 H 13.189 2.610 8.145 1.00 . A A . 37 VAL HG12 1 1 19 34379 1 1 37 VAL HG13 H 13.372 3.097 9.847 1.00 . A A . 37 VAL HG13 1 1 19 34380 1 1 37 VAL HG21 H 11.021 0.479 7.881 1.00 . A A . 37 VAL HG21 1 1 19 34381 1 1 37 VAL HG22 H 9.996 1.684 8.698 1.00 . A A . 37 VAL HG22 1 1 19 34382 1 1 37 VAL HG23 H 11.304 2.216 7.614 1.00 . A A . 37 VAL HG23 1 1 19 34383 1 1 37 VAL N N 11.125 -0.518 10.633 1.00 . A A . 37 VAL N 1 1 19 34384 1 1 37 VAL O O 14.439 -0.710 10.749 1.00 . A A . 37 VAL O 1 1 19 34385 1 1 38 ASN C C 14.023 -0.060 14.217 1.00 . A A . 38 ASN C 1 1 19 34386 1 1 38 ASN CA C 14.402 0.851 13.048 1.00 . A A . 38 ASN CA 1 1 19 34387 1 1 38 ASN CB C 14.572 2.271 13.593 1.00 . A A . 38 ASN CB 1 1 19 34388 1 1 38 ASN CG C 16.024 2.738 13.464 1.00 . A A . 38 ASN CG 1 1 19 34389 1 1 38 ASN H H 12.569 1.388 12.217 1.00 . A A . 38 ASN H 1 1 19 34390 1 1 38 ASN HA H 15.308 0.522 12.539 1.00 . A A . 38 ASN HA 1 1 19 34391 1 1 38 ASN HB2 H 13.917 2.953 13.050 1.00 . A A . 38 ASN HB2 1 1 19 34392 1 1 38 ASN HB3 H 14.268 2.302 14.639 1.00 . A A . 38 ASN HB3 1 1 19 34393 1 1 38 ASN HD21 H 15.467 4.528 14.229 1.00 . A A . 38 ASN HD21 1 1 19 34394 1 1 38 ASN HD22 H 17.146 4.382 13.830 1.00 . A A . 38 ASN HD22 1 1 19 34395 1 1 38 ASN N N 13.358 0.799 12.040 1.00 . A A . 38 ASN N 1 1 19 34396 1 1 38 ASN ND2 N 16.229 3.986 13.875 1.00 . A A . 38 ASN ND2 1 1 19 34397 1 1 38 ASN O O 14.331 0.240 15.369 1.00 . A A . 38 ASN O 1 1 19 34398 1 1 38 ASN OD1 O 16.899 2.013 13.019 1.00 . A A . 38 ASN OD1 1 1 19 34399 1 1 39 GLY C C 11.642 -1.658 15.566 1.00 . A A . 39 GLY C 1 1 19 34400 1 1 39 GLY CA C 12.935 -2.114 14.886 1.00 . A A . 39 GLY CA 1 1 19 34401 1 1 39 GLY H H 13.113 -1.394 12.940 1.00 . A A . 39 GLY H 1 1 19 34402 1 1 39 GLY HA2 H 12.782 -3.089 14.424 1.00 . A A . 39 GLY HA2 1 1 19 34403 1 1 39 GLY HA3 H 13.720 -2.235 15.633 1.00 . A A . 39 GLY HA3 1 1 19 34404 1 1 39 GLY N N 13.360 -1.157 13.879 1.00 . A A . 39 GLY N 1 1 19 34405 1 1 39 GLY O O 11.126 -2.342 16.448 1.00 . A A . 39 GLY O 1 1 19 34406 1 1 40 LYS C C 8.884 0.169 14.580 1.00 . A A . 40 LYS C 1 1 19 34407 1 1 40 LYS CA C 9.936 0.052 15.686 1.00 . A A . 40 LYS CA 1 1 19 34408 1 1 40 LYS CB C 10.225 1.373 16.402 1.00 . A A . 40 LYS CB 1 1 19 34409 1 1 40 LYS CD C 11.065 3.736 16.135 1.00 . A A . 40 LYS CD 1 1 19 34410 1 1 40 LYS CE C 12.178 4.473 15.387 1.00 . A A . 40 LYS CE 1 1 19 34411 1 1 40 LYS CG C 10.677 2.446 15.409 1.00 . A A . 40 LYS CG 1 1 19 34412 1 1 40 LYS H H 11.584 0.046 14.412 1.00 . A A . 40 LYS H 1 1 19 34413 1 1 40 LYS HA H 9.570 -0.648 16.437 1.00 . A A . 40 LYS HA 1 1 19 34414 1 1 40 LYS HB2 H 9.332 1.711 16.926 1.00 . A A . 40 LYS HB2 1 1 19 34415 1 1 40 LYS HB3 H 10.998 1.221 17.155 1.00 . A A . 40 LYS HB3 1 1 19 34416 1 1 40 LYS HD2 H 10.193 4.383 16.227 1.00 . A A . 40 LYS HD2 1 1 19 34417 1 1 40 LYS HD3 H 11.396 3.502 17.147 1.00 . A A . 40 LYS HD3 1 1 19 34418 1 1 40 LYS HE2 H 12.815 3.755 14.872 1.00 . A A . 40 LYS HE2 1 1 19 34419 1 1 40 LYS HE3 H 11.744 5.119 14.624 1.00 . A A . 40 LYS HE3 1 1 19 34420 1 1 40 LYS HG2 H 11.527 2.079 14.833 1.00 . A A . 40 LYS HG2 1 1 19 34421 1 1 40 LYS HG3 H 9.875 2.651 14.700 1.00 . A A . 40 LYS HG3 1 1 19 34422 1 1 40 LYS HZ1 H 12.799 5.040 17.294 1.00 . A A . 40 LYS HZ1 1 1 19 34423 1 1 40 LYS HZ2 H 13.983 5.148 16.180 1.00 . A A . 40 LYS HZ2 1 1 19 34424 1 1 40 LYS N N 11.158 -0.504 15.130 1.00 . A A . 40 LYS N 1 1 19 34425 1 1 40 LYS NZ N 12.988 5.280 16.327 1.00 . A A . 40 LYS NZ 1 1 19 34426 1 1 40 LYS O O 9.223 0.381 13.417 1.00 . A A . 40 LYS O 1 1 19 34427 1 1 41 GLU C C 5.929 1.520 14.052 1.00 . A A . 41 GLU C 1 1 19 34428 1 1 41 GLU CA C 6.528 0.112 14.040 1.00 . A A . 41 GLU CA 1 1 19 34429 1 1 41 GLU CB C 5.460 -0.939 14.348 1.00 . A A . 41 GLU CB 1 1 19 34430 1 1 41 GLU CD C 5.710 -3.426 14.687 1.00 . A A . 41 GLU CD 1 1 19 34431 1 1 41 GLU CG C 5.798 -2.275 13.683 1.00 . A A . 41 GLU CG 1 1 19 34432 1 1 41 GLU H H 7.363 -0.147 15.931 1.00 . A A . 41 GLU H 1 1 19 34433 1 1 41 GLU HA H 6.964 -0.097 13.064 1.00 . A A . 41 GLU HA 1 1 19 34434 1 1 41 GLU HB2 H 5.379 -1.077 15.426 1.00 . A A . 41 GLU HB2 1 1 19 34435 1 1 41 GLU HB3 H 4.489 -0.590 13.998 1.00 . A A . 41 GLU HB3 1 1 19 34436 1 1 41 GLU HG2 H 5.112 -2.457 12.855 1.00 . A A . 41 GLU HG2 1 1 19 34437 1 1 41 GLU HG3 H 6.802 -2.231 13.261 1.00 . A A . 41 GLU HG3 1 1 19 34438 1 1 41 GLU N N 7.630 0.025 14.983 1.00 . A A . 41 GLU N 1 1 19 34439 1 1 41 GLU O O 4.878 1.747 14.649 1.00 . A A . 41 GLU O 1 1 19 34440 1 1 41 GLU OE1 O 6.374 -3.312 15.740 1.00 . A A . 41 GLU OE1 1 1 19 34441 1 1 41 GLU OE2 O 4.982 -4.394 14.379 1.00 . A A . 41 GLU OE2 1 1 19 34442 1 1 42 ASP C C 5.012 3.910 12.322 1.00 . A A . 42 ASP C 1 1 19 34443 1 1 42 ASP CA C 6.176 3.809 13.310 1.00 . A A . 42 ASP CA 1 1 19 34444 1 1 42 ASP CB C 7.296 4.727 12.816 1.00 . A A . 42 ASP CB 1 1 19 34445 1 1 42 ASP CG C 8.099 4.188 11.631 1.00 . A A . 42 ASP CG 1 1 19 34446 1 1 42 ASP H H 7.479 2.236 12.901 1.00 . A A . 42 ASP H 1 1 19 34447 1 1 42 ASP HA H 5.883 4.070 14.327 1.00 . A A . 42 ASP HA 1 1 19 34448 1 1 42 ASP HB2 H 6.861 5.687 12.535 1.00 . A A . 42 ASP HB2 1 1 19 34449 1 1 42 ASP HB3 H 7.980 4.917 13.643 1.00 . A A . 42 ASP HB3 1 1 19 34450 1 1 42 ASP N N 6.625 2.429 13.384 1.00 . A A . 42 ASP N 1 1 19 34451 1 1 42 ASP O O 5.123 3.466 11.179 1.00 . A A . 42 ASP O 1 1 19 34452 1 1 42 ASP OD1 O 7.551 3.312 10.926 1.00 . A A . 42 ASP OD1 1 1 19 34453 1 1 42 ASP OD2 O 9.241 4.663 11.456 1.00 . A A . 42 ASP OD2 1 1 19 34454 1 1 43 TYR C C 2.779 5.988 11.213 1.00 . A A . 43 TYR C 1 1 19 34455 1 1 43 TYR CA C 2.739 4.659 11.970 1.00 . A A . 43 TYR CA 1 1 19 34456 1 1 43 TYR CB C 1.550 4.669 12.932 1.00 . A A . 43 TYR CB 1 1 19 34457 1 1 43 TYR CD1 C 1.857 2.197 13.320 1.00 . A A . 43 TYR CD1 1 1 19 34458 1 1 43 TYR CD2 C 0.953 3.519 15.095 1.00 . A A . 43 TYR CD2 1 1 19 34459 1 1 43 TYR CE1 C 1.763 1.022 14.147 1.00 . A A . 43 TYR CE1 1 1 19 34460 1 1 43 TYR CE2 C 0.859 2.344 15.922 1.00 . A A . 43 TYR CE2 1 1 19 34461 1 1 43 TYR CG C 1.450 3.421 13.811 1.00 . A A . 43 TYR CG 1 1 19 34462 1 1 43 TYR CZ C 1.268 1.153 15.408 1.00 . A A . 43 TYR CZ 1 1 19 34463 1 1 43 TYR H H 3.841 4.853 13.727 1.00 . A A . 43 TYR H 1 1 19 34464 1 1 43 TYR HA H 2.716 3.841 11.250 1.00 . A A . 43 TYR HA 1 1 19 34465 1 1 43 TYR HB2 H 1.622 5.548 13.574 1.00 . A A . 43 TYR HB2 1 1 19 34466 1 1 43 TYR HB3 H 0.630 4.770 12.356 1.00 . A A . 43 TYR HB3 1 1 19 34467 1 1 43 TYR HD1 H 2.249 2.120 12.306 1.00 . A A . 43 TYR HD1 1 1 19 34468 1 1 43 TYR HD2 H 0.633 4.486 15.483 1.00 . A A . 43 TYR HD2 1 1 19 34469 1 1 43 TYR HE1 H 2.080 0.049 13.772 1.00 . A A . 43 TYR HE1 1 1 19 34470 1 1 43 TYR HE2 H 0.469 2.407 16.938 1.00 . A A . 43 TYR HE2 1 1 19 34471 1 1 43 TYR HH H 0.239 -0.294 16.197 1.00 . A A . 43 TYR HH 1 1 19 34472 1 1 43 TYR N N 3.923 4.495 12.797 1.00 . A A . 43 TYR N 1 1 19 34473 1 1 43 TYR O O 2.085 6.936 11.579 1.00 . A A . 43 TYR O 1 1 19 34474 1 1 43 TYR OH O 1.180 0.044 16.189 1.00 . A A . 43 TYR OH 1 1 19 34475 1 1 44 ARG C C 3.353 6.920 7.910 1.00 . A A . 44 ARG C 1 1 19 34476 1 1 44 ARG CA C 3.739 7.213 9.361 1.00 . A A . 44 ARG CA 1 1 19 34477 1 1 44 ARG CB C 5.174 7.743 9.403 1.00 . A A . 44 ARG CB 1 1 19 34478 1 1 44 ARG CD C 6.595 9.493 10.533 1.00 . A A . 44 ARG CD 1 1 19 34479 1 1 44 ARG CG C 5.216 9.169 9.954 1.00 . A A . 44 ARG CG 1 1 19 34480 1 1 44 ARG CZ C 8.020 11.547 10.503 1.00 . A A . 44 ARG CZ 1 1 19 34481 1 1 44 ARG H H 4.160 5.241 9.882 1.00 . A A . 44 ARG H 1 1 19 34482 1 1 44 ARG HA H 3.056 7.935 9.810 1.00 . A A . 44 ARG HA 1 1 19 34483 1 1 44 ARG HB2 H 5.787 7.090 10.025 1.00 . A A . 44 ARG HB2 1 1 19 34484 1 1 44 ARG HB3 H 5.602 7.723 8.401 1.00 . A A . 44 ARG HB3 1 1 19 34485 1 1 44 ARG HD2 H 6.676 9.095 11.545 1.00 . A A . 44 ARG HD2 1 1 19 34486 1 1 44 ARG HD3 H 7.370 9.011 9.939 1.00 . A A . 44 ARG HD3 1 1 19 34487 1 1 44 ARG HE H 6.001 11.547 10.594 1.00 . A A . 44 ARG HE 1 1 19 34488 1 1 44 ARG HG2 H 4.976 9.877 9.161 1.00 . A A . 44 ARG HG2 1 1 19 34489 1 1 44 ARG HG3 H 4.456 9.287 10.727 1.00 . A A . 44 ARG HG3 1 1 19 34490 1 1 44 ARG HH11 H 9.080 9.802 10.426 1.00 . A A . 44 ARG HH11 1 1 19 34491 1 1 44 ARG HH12 H 10.038 11.245 10.406 1.00 . A A . 44 ARG HH12 1 1 19 34492 1 1 44 ARG HH21 H 8.950 13.378 10.491 1.00 . A A . 44 ARG HH21 1 1 19 34493 1 1 44 ARG N N 3.599 6.016 10.172 1.00 . A A . 44 ARG N 1 1 19 34494 1 1 44 ARG NE N 6.807 10.958 10.548 1.00 . A A . 44 ARG NE 1 1 19 34495 1 1 44 ARG NH1 N 9.143 10.800 10.440 1.00 . A A . 44 ARG NH1 1 1 19 34496 1 1 44 ARG NH2 N 8.093 12.865 10.521 1.00 . A A . 44 ARG NH2 1 1 19 34497 1 1 44 ARG O O 3.076 5.774 7.558 1.00 . A A . 44 ARG O 1 1 19 34498 1 1 45 LYS C C 4.154 7.169 4.957 1.00 . A A . 45 LYS C 1 1 19 34499 1 1 45 LYS CA C 3.001 7.844 5.703 1.00 . A A . 45 LYS CA 1 1 19 34500 1 1 45 LYS CB C 2.602 9.201 5.121 1.00 . A A . 45 LYS CB 1 1 19 34501 1 1 45 LYS CD C 1.781 10.651 7.014 1.00 . A A . 45 LYS CD 1 1 19 34502 1 1 45 LYS CE C 1.122 12.028 6.919 1.00 . A A . 45 LYS CE 1 1 19 34503 1 1 45 LYS CG C 1.372 9.765 5.836 1.00 . A A . 45 LYS CG 1 1 19 34504 1 1 45 LYS H H 3.575 8.902 7.403 1.00 . A A . 45 LYS H 1 1 19 34505 1 1 45 LYS HA H 2.125 7.197 5.642 1.00 . A A . 45 LYS HA 1 1 19 34506 1 1 45 LYS HB2 H 3.434 9.900 5.216 1.00 . A A . 45 LYS HB2 1 1 19 34507 1 1 45 LYS HB3 H 2.393 9.098 4.057 1.00 . A A . 45 LYS HB3 1 1 19 34508 1 1 45 LYS HD2 H 1.495 10.171 7.951 1.00 . A A . 45 LYS HD2 1 1 19 34509 1 1 45 LYS HD3 H 2.865 10.763 7.031 1.00 . A A . 45 LYS HD3 1 1 19 34510 1 1 45 LYS HE2 H 0.910 12.265 5.876 1.00 . A A . 45 LYS HE2 1 1 19 34511 1 1 45 LYS HE3 H 0.166 12.018 7.443 1.00 . A A . 45 LYS HE3 1 1 19 34512 1 1 45 LYS HG2 H 0.772 10.342 5.133 1.00 . A A . 45 LYS HG2 1 1 19 34513 1 1 45 LYS HG3 H 0.747 8.946 6.192 1.00 . A A . 45 LYS HG3 1 1 19 34514 1 1 45 LYS HZ1 H 2.983 12.865 7.340 1.00 . A A . 45 LYS HZ1 1 1 19 34515 1 1 45 LYS HZ2 H 1.823 13.982 7.105 1.00 . A A . 45 LYS HZ2 1 1 19 34516 1 1 45 LYS N N 3.348 7.974 7.108 1.00 . A A . 45 LYS N 1 1 19 34517 1 1 45 LYS NZ N 2.003 13.066 7.500 1.00 . A A . 45 LYS NZ 1 1 19 34518 1 1 45 LYS O O 5.301 7.602 5.060 1.00 . A A . 45 LYS O 1 1 19 34519 1 1 46 CYS C C 5.560 6.373 2.573 1.00 . A A . 46 CYS C 1 1 19 34520 1 1 46 CYS CA C 4.802 5.383 3.461 1.00 . A A . 46 CYS CA 1 1 19 34521 1 1 46 CYS CB C 4.165 4.256 2.645 1.00 . A A . 46 CYS CB 1 1 19 34522 1 1 46 CYS H H 2.874 5.777 4.145 1.00 . A A . 46 CYS H 1 1 19 34523 1 1 46 CYS HA H 5.473 4.921 4.185 1.00 . A A . 46 CYS HA 1 1 19 34524 1 1 46 CYS HB2 H 3.805 4.668 1.703 1.00 . A A . 46 CYS HB2 1 1 19 34525 1 1 46 CYS HB3 H 4.935 3.525 2.399 1.00 . A A . 46 CYS HB3 1 1 19 34526 1 1 46 CYS N N 3.810 6.122 4.223 1.00 . A A . 46 CYS N 1 1 19 34527 1 1 46 CYS O O 6.787 6.332 2.500 1.00 . A A . 46 CYS O 1 1 19 34528 1 1 46 CYS SG S 2.782 3.394 3.477 1.00 . A A . 46 CYS SG 1 1 19 34529 1 1 47 GLY C C 5.961 9.402 1.844 1.00 . A A . 47 GLY C 1 1 19 34530 1 1 47 GLY CA C 5.380 8.236 1.041 1.00 . A A . 47 GLY CA 1 1 19 34531 1 1 47 GLY H H 3.799 7.264 1.987 1.00 . A A . 47 GLY H 1 1 19 34532 1 1 47 GLY HA2 H 6.165 7.779 0.438 1.00 . A A . 47 GLY HA2 1 1 19 34533 1 1 47 GLY HA3 H 4.622 8.606 0.352 1.00 . A A . 47 GLY HA3 1 1 19 34534 1 1 47 GLY N N 4.797 7.238 1.921 1.00 . A A . 47 GLY N 1 1 19 34535 1 1 47 GLY O O 5.650 10.561 1.573 1.00 . A A . 47 GLY O 1 1 19 34536 1 1 48 THR C C 8.811 10.408 3.128 1.00 . A A . 48 THR C 1 1 19 34537 1 1 48 THR CA C 7.419 10.059 3.658 1.00 . A A . 48 THR CA 1 1 19 34538 1 1 48 THR CB C 7.431 9.529 5.093 1.00 . A A . 48 THR CB 1 1 19 34539 1 1 48 THR CG2 C 8.559 10.134 5.931 1.00 . A A . 48 THR CG2 1 1 19 34540 1 1 48 THR H H 7.040 8.110 3.027 1.00 . A A . 48 THR H 1 1 19 34541 1 1 48 THR HA H 6.821 10.969 3.611 1.00 . A A . 48 THR HA 1 1 19 34542 1 1 48 THR HB H 7.477 8.440 5.106 1.00 . A A . 48 THR HB 1 1 19 34543 1 1 48 THR HG1 H 5.476 9.446 5.512 1.00 . A A . 48 THR HG1 1 1 19 34544 1 1 48 THR HG21 H 9.508 10.008 5.409 1.00 . A A . 48 THR HG21 1 1 19 34545 1 1 48 THR HG22 H 8.368 11.196 6.086 1.00 . A A . 48 THR HG22 1 1 19 34546 1 1 48 THR HG23 H 8.607 9.629 6.896 1.00 . A A . 48 THR HG23 1 1 19 34547 1 1 48 THR N N 6.793 9.055 2.815 1.00 . A A . 48 THR N 1 1 19 34548 1 1 48 THR O O 9.576 9.522 2.751 1.00 . A A . 48 THR O 1 1 19 34549 1 1 48 THR OG1 O 6.244 10.065 5.671 1.00 . A A . 48 THR OG1 1 1 19 34550 1 1 49 ALA C C 11.502 11.494 3.424 1.00 . A A . 49 ALA C 1 1 19 34551 1 1 49 ALA CA C 10.383 12.180 2.637 1.00 . A A . 49 ALA CA 1 1 19 34552 1 1 49 ALA CB C 10.437 13.704 2.754 1.00 . A A . 49 ALA CB 1 1 19 34553 1 1 49 ALA H H 8.469 12.416 3.424 1.00 . A A . 49 ALA H 1 1 19 34554 1 1 49 ALA HA H 10.469 11.905 1.585 1.00 . A A . 49 ALA HA 1 1 19 34555 1 1 49 ALA HB1 H 9.502 14.130 2.390 1.00 . A A . 49 ALA HB1 1 1 19 34556 1 1 49 ALA HB2 H 10.581 13.983 3.798 1.00 . A A . 49 ALA HB2 1 1 19 34557 1 1 49 ALA HB3 H 11.267 14.085 2.158 1.00 . A A . 49 ALA HB3 1 1 19 34558 1 1 49 ALA N N 9.097 11.702 3.115 1.00 . A A . 49 ALA N 1 1 19 34559 1 1 49 ALA O O 11.688 11.766 4.609 1.00 . A A . 49 ALA O 1 1 19 34560 1 1 50 GLY C C 13.032 8.387 3.368 1.00 . A A . 50 GLY C 1 1 19 34561 1 1 50 GLY CA C 13.311 9.891 3.353 1.00 . A A . 50 GLY CA 1 1 19 34562 1 1 50 GLY H H 12.058 10.403 1.770 1.00 . A A . 50 GLY H 1 1 19 34563 1 1 50 GLY HA2 H 14.236 10.088 2.810 1.00 . A A . 50 GLY HA2 1 1 19 34564 1 1 50 GLY HA3 H 13.458 10.247 4.372 1.00 . A A . 50 GLY HA3 1 1 19 34565 1 1 50 GLY N N 12.216 10.618 2.733 1.00 . A A . 50 GLY N 1 1 19 34566 1 1 50 GLY O O 13.943 7.585 3.568 1.00 . A A . 50 GLY O 1 1 19 34567 1 1 51 CYS C C 11.134 6.235 1.686 1.00 . A A . 51 CYS C 1 1 19 34568 1 1 51 CYS CA C 11.358 6.656 3.140 1.00 . A A . 51 CYS CA 1 1 19 34569 1 1 51 CYS CB C 10.113 6.425 3.999 1.00 . A A . 51 CYS CB 1 1 19 34570 1 1 51 CYS H H 11.034 8.708 2.991 1.00 . A A . 51 CYS H 1 1 19 34571 1 1 51 CYS HA H 12.172 6.085 3.587 1.00 . A A . 51 CYS HA 1 1 19 34572 1 1 51 CYS HB2 H 9.306 7.077 3.667 1.00 . A A . 51 CYS HB2 1 1 19 34573 1 1 51 CYS HB3 H 9.765 5.399 3.880 1.00 . A A . 51 CYS HB3 1 1 19 34574 1 1 51 CYS N N 11.769 8.050 3.153 1.00 . A A . 51 CYS N 1 1 19 34575 1 1 51 CYS O O 12.089 5.956 0.962 1.00 . A A . 51 CYS O 1 1 19 34576 1 1 51 CYS SG S 10.497 6.754 5.758 1.00 . A A . 51 CYS SG 1 1 19 34577 1 1 52 HIS C C 9.225 7.076 -0.883 1.00 . A A . 52 HIS C 1 1 19 34578 1 1 52 HIS CA C 9.505 5.821 -0.053 1.00 . A A . 52 HIS CA 1 1 19 34579 1 1 52 HIS CB C 8.330 4.841 -0.046 1.00 . A A . 52 HIS CB 1 1 19 34580 1 1 52 HIS CD2 C 8.242 2.952 1.759 1.00 . A A . 52 HIS CD2 1 1 19 34581 1 1 52 HIS CE1 C 9.561 1.514 0.769 1.00 . A A . 52 HIS CE1 1 1 19 34582 1 1 52 HIS CG C 8.649 3.505 0.580 1.00 . A A . 52 HIS CG 1 1 19 34583 1 1 52 HIS H H 9.096 6.433 1.895 1.00 . A A . 52 HIS H 1 1 19 34584 1 1 52 HIS HA H 10.367 5.304 -0.473 1.00 . A A . 52 HIS HA 1 1 19 34585 1 1 52 HIS HB2 H 7.497 5.293 0.492 1.00 . A A . 52 HIS HB2 1 1 19 34586 1 1 52 HIS HB3 H 7.997 4.681 -1.071 1.00 . A A . 52 HIS HB3 1 1 19 34587 1 1 52 HIS HD1 H 9.941 2.685 -0.902 1.00 . A A . 52 HIS HD1 1 1 19 34588 1 1 52 HIS HD2 H 7.577 3.420 2.485 1.00 . A A . 52 HIS HD2 1 1 19 34589 1 1 52 HIS HE1 H 10.140 0.612 0.573 1.00 . A A . 52 HIS HE1 1 1 19 34590 1 1 52 HIS N N 9.866 6.204 1.301 1.00 . A A . 52 HIS N 1 1 19 34591 1 1 52 HIS ND1 N 9.480 2.575 -0.021 1.00 . A A . 52 HIS ND1 1 1 19 34592 1 1 52 HIS NE2 N 8.793 1.750 1.871 1.00 . A A . 52 HIS NE2 1 1 19 34593 1 1 52 HIS O O 8.075 7.360 -1.217 1.00 . A A . 52 HIS O 1 1 19 34594 1 1 53 ASP C C 11.239 9.004 -3.080 1.00 . A A . 53 ASP C 1 1 19 34595 1 1 53 ASP CA C 10.179 9.011 -1.977 1.00 . A A . 53 ASP CA 1 1 19 34596 1 1 53 ASP CB C 10.409 10.249 -1.108 1.00 . A A . 53 ASP CB 1 1 19 34597 1 1 53 ASP CG C 9.649 11.500 -1.553 1.00 . A A . 53 ASP CG 1 1 19 34598 1 1 53 ASP H H 11.226 7.555 -0.917 1.00 . A A . 53 ASP H 1 1 19 34599 1 1 53 ASP HA H 9.164 9.000 -2.373 1.00 . A A . 53 ASP HA 1 1 19 34600 1 1 53 ASP HB2 H 10.123 10.014 -0.083 1.00 . A A . 53 ASP HB2 1 1 19 34601 1 1 53 ASP HB3 H 11.475 10.474 -1.098 1.00 . A A . 53 ASP HB3 1 1 19 34602 1 1 53 ASP N N 10.295 7.793 -1.193 1.00 . A A . 53 ASP N 1 1 19 34603 1 1 53 ASP O O 12.265 9.673 -2.965 1.00 . A A . 53 ASP O 1 1 19 34604 1 1 53 ASP OD1 O 8.439 11.568 -1.248 1.00 . A A . 53 ASP OD1 1 1 19 34605 1 1 53 ASP OD2 O 10.295 12.362 -2.187 1.00 . A A . 53 ASP OD2 1 1 19 34606 1 1 54 SER C C 11.322 8.921 -6.444 1.00 . A A . 54 SER C 1 1 19 34607 1 1 54 SER CA C 11.870 8.138 -5.249 1.00 . A A . 54 SER CA 1 1 19 34608 1 1 54 SER CB C 12.106 6.677 -5.635 1.00 . A A . 54 SER CB 1 1 19 34609 1 1 54 SER H H 10.117 7.700 -4.212 1.00 . A A . 54 SER H 1 1 19 34610 1 1 54 SER HA H 12.805 8.577 -4.900 1.00 . A A . 54 SER HA 1 1 19 34611 1 1 54 SER HB2 H 12.288 6.089 -4.735 1.00 . A A . 54 SER HB2 1 1 19 34612 1 1 54 SER HB3 H 11.207 6.275 -6.102 1.00 . A A . 54 SER HB3 1 1 19 34613 1 1 54 SER HG H 13.723 5.704 -6.302 1.00 . A A . 54 SER HG 1 1 19 34614 1 1 54 SER N N 10.954 8.241 -4.125 1.00 . A A . 54 SER N 1 1 19 34615 1 1 54 SER O O 12.085 9.524 -7.198 1.00 . A A . 54 SER O 1 1 19 34616 1 1 54 SER OG O 13.209 6.532 -6.526 1.00 . A A . 54 SER OG 1 1 19 34617 1 1 55 MET C C 9.959 9.198 -9.018 1.00 . A A . 55 MET C 1 1 19 34618 1 1 55 MET CA C 9.346 9.585 -7.670 1.00 . A A . 55 MET CA 1 1 19 34619 1 1 55 MET CB C 9.479 11.095 -7.464 1.00 . A A . 55 MET CB 1 1 19 34620 1 1 55 MET CE C 7.341 10.012 -4.872 1.00 . A A . 55 MET CE 1 1 19 34621 1 1 55 MET CG C 8.201 11.681 -6.860 1.00 . A A . 55 MET CG 1 1 19 34622 1 1 55 MET H H 9.392 8.394 -5.962 1.00 . A A . 55 MET H 1 1 19 34623 1 1 55 MET HA H 8.304 9.270 -7.633 1.00 . A A . 55 MET HA 1 1 19 34624 1 1 55 MET HB2 H 10.324 11.303 -6.807 1.00 . A A . 55 MET HB2 1 1 19 34625 1 1 55 MET HB3 H 9.691 11.579 -8.417 1.00 . A A . 55 MET HB3 1 1 19 34626 1 1 55 MET HE1 H 7.598 9.324 -5.678 1.00 . A A . 55 MET HE1 1 1 19 34627 1 1 55 MET HE2 H 7.604 9.563 -3.914 1.00 . A A . 55 MET HE2 1 1 19 34628 1 1 55 MET HE3 H 6.271 10.217 -4.896 1.00 . A A . 55 MET HE3 1 1 19 34629 1 1 55 MET HG2 H 8.100 12.728 -7.147 1.00 . A A . 55 MET HG2 1 1 19 34630 1 1 55 MET HG3 H 7.330 11.157 -7.255 1.00 . A A . 55 MET HG3 1 1 19 34631 1 1 55 MET N N 10.005 8.887 -6.579 1.00 . A A . 55 MET N 1 1 19 34632 1 1 55 MET O O 10.083 10.035 -9.910 1.00 . A A . 55 MET O 1 1 19 34633 1 1 55 MET SD S 8.244 11.538 -5.082 1.00 . A A . 55 MET SD 1 1 19 34634 1 1 56 ASP C C 9.936 6.472 -11.033 1.00 . A A . 56 ASP C 1 1 19 34635 1 1 56 ASP CA C 10.921 7.421 -10.347 1.00 . A A . 56 ASP CA 1 1 19 34636 1 1 56 ASP CB C 12.203 6.640 -10.051 1.00 . A A . 56 ASP CB 1 1 19 34637 1 1 56 ASP CG C 13.410 7.499 -9.670 1.00 . A A . 56 ASP CG 1 1 19 34638 1 1 56 ASP H H 10.219 7.255 -8.392 1.00 . A A . 56 ASP H 1 1 19 34639 1 1 56 ASP HA H 11.137 8.304 -10.948 1.00 . A A . 56 ASP HA 1 1 19 34640 1 1 56 ASP HB2 H 12.005 5.938 -9.241 1.00 . A A . 56 ASP HB2 1 1 19 34641 1 1 56 ASP HB3 H 12.460 6.047 -10.929 1.00 . A A . 56 ASP HB3 1 1 19 34642 1 1 56 ASP N N 10.325 7.929 -9.123 1.00 . A A . 56 ASP N 1 1 19 34643 1 1 56 ASP O O 9.728 6.556 -12.242 1.00 . A A . 56 ASP O 1 1 19 34644 1 1 56 ASP OD1 O 13.175 8.596 -9.120 1.00 . A A . 56 ASP OD1 1 1 19 34645 1 1 56 ASP OD2 O 14.541 7.038 -9.937 1.00 . A A . 56 ASP OD2 1 1 19 34646 1 1 57 LYS C C 9.133 3.597 -11.608 1.00 . A A . 57 LYS C 1 1 19 34647 1 1 57 LYS CA C 8.400 4.627 -10.746 1.00 . A A . 57 LYS CA 1 1 19 34648 1 1 57 LYS CB C 7.261 5.340 -11.477 1.00 . A A . 57 LYS CB 1 1 19 34649 1 1 57 LYS CD C 6.059 4.260 -13.413 1.00 . A A . 57 LYS CD 1 1 19 34650 1 1 57 LYS CE C 5.003 5.230 -13.946 1.00 . A A . 57 LYS CE 1 1 19 34651 1 1 57 LYS CG C 6.169 4.351 -11.890 1.00 . A A . 57 LYS CG 1 1 19 34652 1 1 57 LYS H H 9.531 5.529 -9.248 1.00 . A A . 57 LYS H 1 1 19 34653 1 1 57 LYS HA H 7.961 4.112 -9.891 1.00 . A A . 57 LYS HA 1 1 19 34654 1 1 57 LYS HB2 H 6.835 6.109 -10.832 1.00 . A A . 57 LYS HB2 1 1 19 34655 1 1 57 LYS HB3 H 7.651 5.846 -12.360 1.00 . A A . 57 LYS HB3 1 1 19 34656 1 1 57 LYS HD2 H 7.025 4.485 -13.865 1.00 . A A . 57 LYS HD2 1 1 19 34657 1 1 57 LYS HD3 H 5.802 3.241 -13.703 1.00 . A A . 57 LYS HD3 1 1 19 34658 1 1 57 LYS HE2 H 4.063 4.702 -14.105 1.00 . A A . 57 LYS HE2 1 1 19 34659 1 1 57 LYS HE3 H 4.810 6.008 -13.207 1.00 . A A . 57 LYS HE3 1 1 19 34660 1 1 57 LYS HG2 H 6.391 3.367 -11.478 1.00 . A A . 57 LYS HG2 1 1 19 34661 1 1 57 LYS HG3 H 5.213 4.663 -11.471 1.00 . A A . 57 LYS HG3 1 1 19 34662 1 1 57 LYS HZ1 H 6.083 6.623 -15.057 1.00 . A A . 57 LYS HZ1 1 1 19 34663 1 1 57 LYS HZ2 H 5.950 5.181 -15.801 1.00 . A A . 57 LYS HZ2 1 1 19 34664 1 1 57 LYS N N 9.357 5.591 -10.231 1.00 . A A . 57 LYS N 1 1 19 34665 1 1 57 LYS NZ N 5.454 5.843 -15.215 1.00 . A A . 57 LYS NZ 1 1 19 34666 1 1 57 LYS O O 9.122 2.405 -11.302 1.00 . A A . 57 LYS O 1 1 19 34667 1 1 58 LYS C C 11.814 2.825 -12.926 1.00 . A A . 58 LYS C 1 1 19 34668 1 1 58 LYS CA C 10.490 3.231 -13.576 1.00 . A A . 58 LYS CA 1 1 19 34669 1 1 58 LYS CB C 10.656 3.905 -14.940 1.00 . A A . 58 LYS CB 1 1 19 34670 1 1 58 LYS CD C 11.575 2.222 -16.577 1.00 . A A . 58 LYS CD 1 1 19 34671 1 1 58 LYS CE C 11.616 2.194 -18.106 1.00 . A A . 58 LYS CE 1 1 19 34672 1 1 58 LYS CG C 10.319 2.937 -16.075 1.00 . A A . 58 LYS CG 1 1 19 34673 1 1 58 LYS H H 9.757 5.063 -12.910 1.00 . A A . 58 LYS H 1 1 19 34674 1 1 58 LYS HA H 9.891 2.333 -13.732 1.00 . A A . 58 LYS HA 1 1 19 34675 1 1 58 LYS HB2 H 10.007 4.780 -14.998 1.00 . A A . 58 LYS HB2 1 1 19 34676 1 1 58 LYS HB3 H 11.680 4.261 -15.051 1.00 . A A . 58 LYS HB3 1 1 19 34677 1 1 58 LYS HD2 H 12.462 2.727 -16.195 1.00 . A A . 58 LYS HD2 1 1 19 34678 1 1 58 LYS HD3 H 11.597 1.204 -16.190 1.00 . A A . 58 LYS HD3 1 1 19 34679 1 1 58 LYS HE2 H 11.860 1.190 -18.451 1.00 . A A . 58 LYS HE2 1 1 19 34680 1 1 58 LYS HE3 H 10.633 2.440 -18.507 1.00 . A A . 58 LYS HE3 1 1 19 34681 1 1 58 LYS HG2 H 9.592 2.202 -15.728 1.00 . A A . 58 LYS HG2 1 1 19 34682 1 1 58 LYS HG3 H 9.854 3.482 -16.897 1.00 . A A . 58 LYS HG3 1 1 19 34683 1 1 58 LYS HZ1 H 13.433 3.211 -18.013 1.00 . A A . 58 LYS HZ1 1 1 19 34684 1 1 58 LYS HZ2 H 12.954 2.903 -19.538 1.00 . A A . 58 LYS HZ2 1 1 19 34685 1 1 58 LYS N N 9.753 4.093 -12.668 1.00 . A A . 58 LYS N 1 1 19 34686 1 1 58 LYS NZ N 12.619 3.156 -18.615 1.00 . A A . 58 LYS NZ 1 1 19 34687 1 1 58 LYS O O 12.884 3.085 -13.474 1.00 . A A . 58 LYS O 1 1 19 34688 1 1 59 ASP C C 12.434 0.891 -9.848 1.00 . A A . 59 ASP C 1 1 19 34689 1 1 59 ASP CA C 12.872 1.751 -11.035 1.00 . A A . 59 ASP CA 1 1 19 34690 1 1 59 ASP CB C 13.664 2.941 -10.490 1.00 . A A . 59 ASP CB 1 1 19 34691 1 1 59 ASP CG C 15.156 2.680 -10.275 1.00 . A A . 59 ASP CG 1 1 19 34692 1 1 59 ASP H H 10.823 1.987 -11.328 1.00 . A A . 59 ASP H 1 1 19 34693 1 1 59 ASP HA H 13.465 1.191 -11.759 1.00 . A A . 59 ASP HA 1 1 19 34694 1 1 59 ASP HB2 H 13.553 3.778 -11.179 1.00 . A A . 59 ASP HB2 1 1 19 34695 1 1 59 ASP HB3 H 13.224 3.248 -9.542 1.00 . A A . 59 ASP HB3 1 1 19 34696 1 1 59 ASP N N 11.698 2.195 -11.766 1.00 . A A . 59 ASP N 1 1 19 34697 1 1 59 ASP O O 12.771 1.189 -8.703 1.00 . A A . 59 ASP O 1 1 19 34698 1 1 59 ASP OD1 O 15.624 1.625 -10.756 1.00 . A A . 59 ASP OD1 1 1 19 34699 1 1 59 ASP OD2 O 15.796 3.542 -9.634 1.00 . A A . 59 ASP OD2 1 1 19 34700 1 1 60 LYS C C 12.302 -1.294 -8.098 1.00 . A A . 60 LYS C 1 1 19 34701 1 1 60 LYS CA C 11.200 -1.063 -9.134 1.00 . A A . 60 LYS CA 1 1 19 34702 1 1 60 LYS CB C 10.668 -2.352 -9.764 1.00 . A A . 60 LYS CB 1 1 19 34703 1 1 60 LYS CD C 11.476 -4.471 -10.866 1.00 . A A . 60 LYS CD 1 1 19 34704 1 1 60 LYS CE C 12.542 -5.095 -11.768 1.00 . A A . 60 LYS CE 1 1 19 34705 1 1 60 LYS CG C 11.702 -2.966 -10.710 1.00 . A A . 60 LYS CG 1 1 19 34706 1 1 60 LYS H H 11.419 -0.394 -11.095 1.00 . A A . 60 LYS H 1 1 19 34707 1 1 60 LYS HA H 10.359 -0.574 -8.642 1.00 . A A . 60 LYS HA 1 1 19 34708 1 1 60 LYS HB2 H 10.417 -3.067 -8.981 1.00 . A A . 60 LYS HB2 1 1 19 34709 1 1 60 LYS HB3 H 9.749 -2.141 -10.311 1.00 . A A . 60 LYS HB3 1 1 19 34710 1 1 60 LYS HD2 H 11.497 -4.950 -9.887 1.00 . A A . 60 LYS HD2 1 1 19 34711 1 1 60 LYS HD3 H 10.487 -4.653 -11.288 1.00 . A A . 60 LYS HD3 1 1 19 34712 1 1 60 LYS HE2 H 12.257 -4.979 -12.814 1.00 . A A . 60 LYS HE2 1 1 19 34713 1 1 60 LYS HE3 H 13.490 -4.573 -11.637 1.00 . A A . 60 LYS HE3 1 1 19 34714 1 1 60 LYS HG2 H 11.640 -2.483 -11.685 1.00 . A A . 60 LYS HG2 1 1 19 34715 1 1 60 LYS HG3 H 12.705 -2.783 -10.327 1.00 . A A . 60 LYS HG3 1 1 19 34716 1 1 60 LYS HZ1 H 12.863 -6.686 -10.460 1.00 . A A . 60 LYS HZ1 1 1 19 34717 1 1 60 LYS HZ2 H 11.902 -7.078 -11.715 1.00 . A A . 60 LYS HZ2 1 1 19 34718 1 1 60 LYS N N 11.688 -0.158 -10.161 1.00 . A A . 60 LYS N 1 1 19 34719 1 1 60 LYS NZ N 12.714 -6.531 -11.451 1.00 . A A . 60 LYS NZ 1 1 19 34720 1 1 60 LYS O O 13.290 -1.971 -8.378 1.00 . A A . 60 LYS O 1 1 19 34721 1 1 61 SER C C 12.408 -0.475 -4.511 1.00 . A A . 61 SER C 1 1 19 34722 1 1 61 SER CA C 13.058 -0.852 -5.844 1.00 . A A . 61 SER CA 1 1 19 34723 1 1 61 SER CB C 14.293 0.016 -6.096 1.00 . A A . 61 SER CB 1 1 19 34724 1 1 61 SER H H 11.288 -0.169 -6.703 1.00 . A A . 61 SER H 1 1 19 34725 1 1 61 SER HA H 13.348 -1.903 -5.844 1.00 . A A . 61 SER HA 1 1 19 34726 1 1 61 SER HB2 H 14.328 0.299 -7.148 1.00 . A A . 61 SER HB2 1 1 19 34727 1 1 61 SER HB3 H 14.211 0.938 -5.521 1.00 . A A . 61 SER HB3 1 1 19 34728 1 1 61 SER HG H 16.040 -0.839 -6.567 1.00 . A A . 61 SER HG 1 1 19 34729 1 1 61 SER N N 12.095 -0.718 -6.923 1.00 . A A . 61 SER N 1 1 19 34730 1 1 61 SER O O 11.290 0.039 -4.485 1.00 . A A . 61 SER O 1 1 19 34731 1 1 61 SER OG O 15.499 -0.656 -5.746 1.00 . A A . 61 SER OG 1 1 19 34732 1 1 62 ALA C C 12.215 1.028 -2.046 1.00 . A A . 62 ALA C 1 1 19 34733 1 1 62 ALA CA C 12.642 -0.440 -2.104 1.00 . A A . 62 ALA CA 1 1 19 34734 1 1 62 ALA CB C 13.721 -0.775 -1.072 1.00 . A A . 62 ALA CB 1 1 19 34735 1 1 62 ALA H H 14.043 -1.162 -3.467 1.00 . A A . 62 ALA H 1 1 19 34736 1 1 62 ALA HA H 11.772 -1.070 -1.920 1.00 . A A . 62 ALA HA 1 1 19 34737 1 1 62 ALA HB1 H 14.255 -1.673 -1.383 1.00 . A A . 62 ALA HB1 1 1 19 34738 1 1 62 ALA HB2 H 14.422 0.057 -0.997 1.00 . A A . 62 ALA HB2 1 1 19 34739 1 1 62 ALA HB3 H 13.255 -0.946 -0.102 1.00 . A A . 62 ALA HB3 1 1 19 34740 1 1 62 ALA N N 13.135 -0.744 -3.437 1.00 . A A . 62 ALA N 1 1 19 34741 1 1 62 ALA O O 11.118 1.342 -1.586 1.00 . A A . 62 ALA O 1 1 19 34742 1 1 63 LYS C C 11.658 3.603 -3.463 1.00 . A A . 63 LYS C 1 1 19 34743 1 1 63 LYS CA C 12.833 3.317 -2.527 1.00 . A A . 63 LYS CA 1 1 19 34744 1 1 63 LYS CB C 14.100 4.101 -2.872 1.00 . A A . 63 LYS CB 1 1 19 34745 1 1 63 LYS CD C 15.116 5.294 -0.896 1.00 . A A . 63 LYS CD 1 1 19 34746 1 1 63 LYS CE C 16.522 5.627 -0.393 1.00 . A A . 63 LYS CE 1 1 19 34747 1 1 63 LYS CG C 15.124 4.016 -1.738 1.00 . A A . 63 LYS CG 1 1 19 34748 1 1 63 LYS H H 13.994 1.626 -2.892 1.00 . A A . 63 LYS H 1 1 19 34749 1 1 63 LYS HA H 12.545 3.599 -1.514 1.00 . A A . 63 LYS HA 1 1 19 34750 1 1 63 LYS HB2 H 14.537 3.708 -3.791 1.00 . A A . 63 LYS HB2 1 1 19 34751 1 1 63 LYS HB3 H 13.847 5.144 -3.061 1.00 . A A . 63 LYS HB3 1 1 19 34752 1 1 63 LYS HD2 H 14.733 6.123 -1.490 1.00 . A A . 63 LYS HD2 1 1 19 34753 1 1 63 LYS HD3 H 14.442 5.171 -0.048 1.00 . A A . 63 LYS HD3 1 1 19 34754 1 1 63 LYS HE2 H 16.552 5.553 0.694 1.00 . A A . 63 LYS HE2 1 1 19 34755 1 1 63 LYS HE3 H 17.236 4.901 -0.782 1.00 . A A . 63 LYS HE3 1 1 19 34756 1 1 63 LYS HG2 H 14.900 3.158 -1.105 1.00 . A A . 63 LYS HG2 1 1 19 34757 1 1 63 LYS HG3 H 16.119 3.855 -2.152 1.00 . A A . 63 LYS HG3 1 1 19 34758 1 1 63 LYS HZ1 H 16.111 7.552 -1.078 1.00 . A A . 63 LYS HZ1 1 1 19 34759 1 1 63 LYS HZ2 H 17.392 7.494 -0.075 1.00 . A A . 63 LYS HZ2 1 1 19 34760 1 1 63 LYS N N 13.104 1.889 -2.519 1.00 . A A . 63 LYS N 1 1 19 34761 1 1 63 LYS NZ N 16.913 6.991 -0.813 1.00 . A A . 63 LYS NZ 1 1 19 34762 1 1 63 LYS O O 11.014 4.646 -3.357 1.00 . A A . 63 LYS O 1 1 19 34763 1 1 64 GLY C C 8.969 2.714 -4.617 1.00 . A A . 64 GLY C 1 1 19 34764 1 1 64 GLY CA C 10.327 2.798 -5.315 1.00 . A A . 64 GLY CA 1 1 19 34765 1 1 64 GLY H H 11.941 1.814 -4.440 1.00 . A A . 64 GLY H 1 1 19 34766 1 1 64 GLY HA2 H 10.415 3.752 -5.835 1.00 . A A . 64 GLY HA2 1 1 19 34767 1 1 64 GLY HA3 H 10.400 2.016 -6.071 1.00 . A A . 64 GLY HA3 1 1 19 34768 1 1 64 GLY N N 11.413 2.659 -4.360 1.00 . A A . 64 GLY N 1 1 19 34769 1 1 64 GLY O O 8.423 1.626 -4.441 1.00 . A A . 64 GLY O 1 1 19 34770 1 1 65 TYR C C 6.096 3.217 -4.358 1.00 . A A . 65 TYR C 1 1 19 34771 1 1 65 TYR CA C 7.177 3.950 -3.561 1.00 . A A . 65 TYR CA 1 1 19 34772 1 1 65 TYR CB C 6.821 5.436 -3.490 1.00 . A A . 65 TYR CB 1 1 19 34773 1 1 65 TYR CD1 C 4.957 5.426 -1.792 1.00 . A A . 65 TYR CD1 1 1 19 34774 1 1 65 TYR CD2 C 4.485 6.242 -3.989 1.00 . A A . 65 TYR CD2 1 1 19 34775 1 1 65 TYR CE1 C 3.595 5.684 -1.403 1.00 . A A . 65 TYR CE1 1 1 19 34776 1 1 65 TYR CE2 C 3.122 6.500 -3.600 1.00 . A A . 65 TYR CE2 1 1 19 34777 1 1 65 TYR CG C 5.374 5.710 -3.077 1.00 . A A . 65 TYR CG 1 1 19 34778 1 1 65 TYR CZ C 2.745 6.208 -2.326 1.00 . A A . 65 TYR CZ 1 1 19 34779 1 1 65 TYR H H 8.912 4.759 -4.384 1.00 . A A . 65 TYR H 1 1 19 34780 1 1 65 TYR HA H 7.284 3.476 -2.585 1.00 . A A . 65 TYR HA 1 1 19 34781 1 1 65 TYR HB2 H 7.489 5.926 -2.781 1.00 . A A . 65 TYR HB2 1 1 19 34782 1 1 65 TYR HB3 H 7.002 5.890 -4.464 1.00 . A A . 65 TYR HB3 1 1 19 34783 1 1 65 TYR HD1 H 5.659 5.006 -1.072 1.00 . A A . 65 TYR HD1 1 1 19 34784 1 1 65 TYR HD2 H 4.814 6.467 -5.003 1.00 . A A . 65 TYR HD2 1 1 19 34785 1 1 65 TYR HE1 H 3.253 5.463 -0.392 1.00 . A A . 65 TYR HE1 1 1 19 34786 1 1 65 TYR HE2 H 2.410 6.919 -4.310 1.00 . A A . 65 TYR HE2 1 1 19 34787 1 1 65 TYR HH H 1.424 7.221 -1.322 1.00 . A A . 65 TYR HH 1 1 19 34788 1 1 65 TYR N N 8.462 3.878 -4.237 1.00 . A A . 65 TYR N 1 1 19 34789 1 1 65 TYR O O 5.241 2.547 -3.780 1.00 . A A . 65 TYR O 1 1 19 34790 1 1 65 TYR OH O 1.458 6.451 -1.959 1.00 . A A . 65 TYR OH 1 1 19 34791 1 1 66 TYR C C 5.538 1.246 -6.742 1.00 . A A . 66 TYR C 1 1 19 34792 1 1 66 TYR CA C 5.208 2.728 -6.553 1.00 . A A . 66 TYR CA 1 1 19 34793 1 1 66 TYR CB C 5.332 3.442 -7.901 1.00 . A A . 66 TYR CB 1 1 19 34794 1 1 66 TYR CD1 C 5.679 1.609 -9.598 1.00 . A A . 66 TYR CD1 1 1 19 34795 1 1 66 TYR CD2 C 3.633 2.844 -9.666 1.00 . A A . 66 TYR CD2 1 1 19 34796 1 1 66 TYR CE1 C 5.240 0.821 -10.720 1.00 . A A . 66 TYR CE1 1 1 19 34797 1 1 66 TYR CE2 C 3.195 2.056 -10.788 1.00 . A A . 66 TYR CE2 1 1 19 34798 1 1 66 TYR CG C 4.866 2.604 -9.094 1.00 . A A . 66 TYR CG 1 1 19 34799 1 1 66 TYR CZ C 4.020 1.083 -11.260 1.00 . A A . 66 TYR CZ 1 1 19 34800 1 1 66 TYR H H 6.869 3.914 -6.134 1.00 . A A . 66 TYR H 1 1 19 34801 1 1 66 TYR HA H 4.222 2.818 -6.097 1.00 . A A . 66 TYR HA 1 1 19 34802 1 1 66 TYR HB2 H 4.751 4.363 -7.868 1.00 . A A . 66 TYR HB2 1 1 19 34803 1 1 66 TYR HB3 H 6.373 3.727 -8.055 1.00 . A A . 66 TYR HB3 1 1 19 34804 1 1 66 TYR HD1 H 6.653 1.420 -9.146 1.00 . A A . 66 TYR HD1 1 1 19 34805 1 1 66 TYR HD2 H 2.992 3.630 -9.268 1.00 . A A . 66 TYR HD2 1 1 19 34806 1 1 66 TYR HE1 H 5.872 0.032 -11.128 1.00 . A A . 66 TYR HE1 1 1 19 34807 1 1 66 TYR HE2 H 2.223 2.235 -11.249 1.00 . A A . 66 TYR HE2 1 1 19 34808 1 1 66 TYR HH H 2.913 -0.320 -12.026 1.00 . A A . 66 TYR HH 1 1 19 34809 1 1 66 TYR N N 6.170 3.368 -5.672 1.00 . A A . 66 TYR N 1 1 19 34810 1 1 66 TYR O O 4.829 0.534 -7.451 1.00 . A A . 66 TYR O 1 1 19 34811 1 1 66 TYR OH O 3.606 0.339 -12.320 1.00 . A A . 66 TYR OH 1 1 19 34812 1 1 67 HIS C C 6.628 -1.309 -4.918 1.00 . A A . 67 HIS C 1 1 19 34813 1 1 67 HIS CA C 7.048 -0.559 -6.183 1.00 . A A . 67 HIS CA 1 1 19 34814 1 1 67 HIS CB C 8.552 -0.642 -6.450 1.00 . A A . 67 HIS CB 1 1 19 34815 1 1 67 HIS CD2 C 9.660 -1.915 -4.454 1.00 . A A . 67 HIS CD2 1 1 19 34816 1 1 67 HIS CE1 C 10.151 -3.771 -5.503 1.00 . A A . 67 HIS CE1 1 1 19 34817 1 1 67 HIS CG C 9.239 -1.787 -5.745 1.00 . A A . 67 HIS CG 1 1 19 34818 1 1 67 HIS H H 7.186 1.411 -5.520 1.00 . A A . 67 HIS H 1 1 19 34819 1 1 67 HIS HA H 6.534 -0.993 -7.041 1.00 . A A . 67 HIS HA 1 1 19 34820 1 1 67 HIS HB2 H 8.716 -0.739 -7.523 1.00 . A A . 67 HIS HB2 1 1 19 34821 1 1 67 HIS HB3 H 9.018 0.294 -6.140 1.00 . A A . 67 HIS HB3 1 1 19 34822 1 1 67 HIS HD1 H 9.383 -3.190 -7.341 1.00 . A A . 67 HIS HD1 1 1 19 34823 1 1 67 HIS HD2 H 9.562 -1.160 -3.674 1.00 . A A . 67 HIS HD2 1 1 19 34824 1 1 67 HIS HE1 H 10.523 -4.777 -5.700 1.00 . A A . 67 HIS HE1 1 1 19 34825 1 1 67 HIS N N 6.615 0.826 -6.095 1.00 . A A . 67 HIS N 1 1 19 34826 1 1 67 HIS ND1 N 9.563 -2.973 -6.381 1.00 . A A . 67 HIS ND1 1 1 19 34827 1 1 67 HIS NE2 N 10.210 -3.114 -4.309 1.00 . A A . 67 HIS NE2 1 1 19 34828 1 1 67 HIS O O 6.650 -2.539 -4.885 1.00 . A A . 67 HIS O 1 1 19 34829 1 1 68 VAL C C 4.305 -1.078 -2.556 1.00 . A A . 68 VAL C 1 1 19 34830 1 1 68 VAL CA C 5.832 -1.114 -2.642 1.00 . A A . 68 VAL CA 1 1 19 34831 1 1 68 VAL CB C 6.514 -0.388 -1.481 1.00 . A A . 68 VAL CB 1 1 19 34832 1 1 68 VAL CG1 C 7.951 -0.878 -1.296 1.00 . A A . 68 VAL CG1 1 1 19 34833 1 1 68 VAL CG2 C 6.474 1.128 -1.684 1.00 . A A . 68 VAL CG2 1 1 19 34834 1 1 68 VAL H H 6.241 0.461 -3.942 1.00 . A A . 68 VAL H 1 1 19 34835 1 1 68 VAL HA H 6.160 -2.154 -2.629 1.00 . A A . 68 VAL HA 1 1 19 34836 1 1 68 VAL HB H 5.961 -0.618 -0.571 1.00 . A A . 68 VAL HB 1 1 19 34837 1 1 68 VAL HG11 H 7.984 -1.961 -1.422 1.00 . A A . 68 VAL HG11 1 1 19 34838 1 1 68 VAL HG12 H 8.595 -0.406 -2.037 1.00 . A A . 68 VAL HG12 1 1 19 34839 1 1 68 VAL HG13 H 8.297 -0.619 -0.295 1.00 . A A . 68 VAL HG13 1 1 19 34840 1 1 68 VAL HG21 H 5.455 1.437 -1.917 1.00 . A A . 68 VAL HG21 1 1 19 34841 1 1 68 VAL HG22 H 6.806 1.626 -0.773 1.00 . A A . 68 VAL HG22 1 1 19 34842 1 1 68 VAL HG23 H 7.133 1.402 -2.508 1.00 . A A . 68 VAL HG23 1 1 19 34843 1 1 68 VAL N N 6.256 -0.538 -3.907 1.00 . A A . 68 VAL N 1 1 19 34844 1 1 68 VAL O O 3.732 -1.370 -1.508 1.00 . A A . 68 VAL O 1 1 19 34845 1 1 69 MET C C 1.681 -1.635 -4.753 1.00 . A A . 69 MET C 1 1 19 34846 1 1 69 MET CA C 2.240 -0.637 -3.737 1.00 . A A . 69 MET CA 1 1 19 34847 1 1 69 MET CB C 1.823 0.781 -4.131 1.00 . A A . 69 MET CB 1 1 19 34848 1 1 69 MET CE C 2.751 2.169 -0.454 1.00 . A A . 69 MET CE 1 1 19 34849 1 1 69 MET CG C 2.368 1.809 -3.138 1.00 . A A . 69 MET CG 1 1 19 34850 1 1 69 MET H H 4.164 -0.480 -4.521 1.00 . A A . 69 MET H 1 1 19 34851 1 1 69 MET HA H 1.889 -0.891 -2.736 1.00 . A A . 69 MET HA 1 1 19 34852 1 1 69 MET HB2 H 2.191 1.007 -5.132 1.00 . A A . 69 MET HB2 1 1 19 34853 1 1 69 MET HB3 H 0.736 0.847 -4.168 1.00 . A A . 69 MET HB3 1 1 19 34854 1 1 69 MET HE1 H 3.646 2.456 -1.007 1.00 . A A . 69 MET HE1 1 1 19 34855 1 1 69 MET HE2 H 2.416 3.009 0.155 1.00 . A A . 69 MET HE2 1 1 19 34856 1 1 69 MET HE3 H 2.979 1.321 0.190 1.00 . A A . 69 MET HE3 1 1 19 34857 1 1 69 MET HG2 H 3.428 1.626 -2.957 1.00 . A A . 69 MET HG2 1 1 19 34858 1 1 69 MET HG3 H 2.286 2.812 -3.558 1.00 . A A . 69 MET HG3 1 1 19 34859 1 1 69 MET N N 3.690 -0.716 -3.673 1.00 . A A . 69 MET N 1 1 19 34860 1 1 69 MET O O 0.481 -1.904 -4.768 1.00 . A A . 69 MET O 1 1 19 34861 1 1 69 MET SD S 1.463 1.715 -1.603 1.00 . A A . 69 MET SD 1 1 19 34862 1 1 70 HIS C C 3.158 -4.303 -6.577 1.00 . A A . 70 HIS C 1 1 19 34863 1 1 70 HIS CA C 2.189 -3.120 -6.593 1.00 . A A . 70 HIS CA 1 1 19 34864 1 1 70 HIS CB C 2.093 -2.451 -7.966 1.00 . A A . 70 HIS CB 1 1 19 34865 1 1 70 HIS CD2 C 0.178 -0.704 -8.304 1.00 . A A . 70 HIS CD2 1 1 19 34866 1 1 70 HIS CE1 C 1.250 1.072 -7.607 1.00 . A A . 70 HIS CE1 1 1 19 34867 1 1 70 HIS CG C 1.434 -1.092 -7.942 1.00 . A A . 70 HIS CG 1 1 19 34868 1 1 70 HIS H H 3.552 -1.934 -5.557 1.00 . A A . 70 HIS H 1 1 19 34869 1 1 70 HIS HA H 1.193 -3.473 -6.325 1.00 . A A . 70 HIS HA 1 1 19 34870 1 1 70 HIS HB2 H 3.096 -2.350 -8.381 1.00 . A A . 70 HIS HB2 1 1 19 34871 1 1 70 HIS HB3 H 1.534 -3.102 -8.638 1.00 . A A . 70 HIS HB3 1 1 19 34872 1 1 70 HIS HD1 H 3.028 0.094 -7.175 1.00 . A A . 70 HIS HD1 1 1 19 34873 1 1 70 HIS HD2 H -0.603 -1.357 -8.694 1.00 . A A . 70 HIS HD2 1 1 19 34874 1 1 70 HIS HE1 H 1.468 2.106 -7.342 1.00 . A A . 70 HIS HE1 1 1 19 34875 1 1 70 HIS N N 2.578 -2.158 -5.576 1.00 . A A . 70 HIS N 1 1 19 34876 1 1 70 HIS ND1 N 2.086 0.049 -7.508 1.00 . A A . 70 HIS ND1 1 1 19 34877 1 1 70 HIS NE2 N 0.068 0.603 -8.100 1.00 . A A . 70 HIS NE2 1 1 19 34878 1 1 70 HIS O O 2.758 -5.434 -6.304 1.00 . A A . 70 HIS O 1 1 19 34879 1 1 71 ASP C C 5.206 -6.010 -5.749 1.00 . A A . 71 ASP C 1 1 19 34880 1 1 71 ASP CA C 5.443 -5.028 -6.898 1.00 . A A . 71 ASP CA 1 1 19 34881 1 1 71 ASP CB C 6.834 -4.416 -6.717 1.00 . A A . 71 ASP CB 1 1 19 34882 1 1 71 ASP CG C 7.926 -5.022 -7.600 1.00 . A A . 71 ASP CG 1 1 19 34883 1 1 71 ASP H H 4.731 -3.081 -7.095 1.00 . A A . 71 ASP H 1 1 19 34884 1 1 71 ASP HA H 5.354 -5.501 -7.876 1.00 . A A . 71 ASP HA 1 1 19 34885 1 1 71 ASP HB2 H 6.774 -3.347 -6.921 1.00 . A A . 71 ASP HB2 1 1 19 34886 1 1 71 ASP HB3 H 7.129 -4.525 -5.673 1.00 . A A . 71 ASP HB3 1 1 19 34887 1 1 71 ASP N N 4.414 -4.003 -6.874 1.00 . A A . 71 ASP N 1 1 19 34888 1 1 71 ASP O O 5.114 -5.605 -4.591 1.00 . A A . 71 ASP O 1 1 19 34889 1 1 71 ASP OD1 O 7.742 -4.986 -8.836 1.00 . A A . 71 ASP OD1 1 1 19 34890 1 1 71 ASP OD2 O 8.921 -5.508 -7.019 1.00 . A A . 71 ASP OD2 1 1 19 34891 1 1 72 LYS C C 6.231 -8.922 -4.702 1.00 . A A . 72 LYS C 1 1 19 34892 1 1 72 LYS CA C 4.887 -8.324 -5.122 1.00 . A A . 72 LYS CA 1 1 19 34893 1 1 72 LYS CB C 3.892 -9.358 -5.654 1.00 . A A . 72 LYS CB 1 1 19 34894 1 1 72 LYS CD C 2.658 -8.898 -7.804 1.00 . A A . 72 LYS CD 1 1 19 34895 1 1 72 LYS CE C 1.968 -7.734 -8.519 1.00 . A A . 72 LYS CE 1 1 19 34896 1 1 72 LYS CG C 2.680 -8.676 -6.290 1.00 . A A . 72 LYS CG 1 1 19 34897 1 1 72 LYS H H 5.189 -7.602 -7.053 1.00 . A A . 72 LYS H 1 1 19 34898 1 1 72 LYS HA H 4.430 -7.856 -4.251 1.00 . A A . 72 LYS HA 1 1 19 34899 1 1 72 LYS HB2 H 4.383 -9.996 -6.389 1.00 . A A . 72 LYS HB2 1 1 19 34900 1 1 72 LYS HB3 H 3.565 -10.005 -4.840 1.00 . A A . 72 LYS HB3 1 1 19 34901 1 1 72 LYS HD2 H 3.678 -9.003 -8.174 1.00 . A A . 72 LYS HD2 1 1 19 34902 1 1 72 LYS HD3 H 2.139 -9.828 -8.032 1.00 . A A . 72 LYS HD3 1 1 19 34903 1 1 72 LYS HE2 H 0.894 -7.773 -8.336 1.00 . A A . 72 LYS HE2 1 1 19 34904 1 1 72 LYS HE3 H 2.326 -6.787 -8.113 1.00 . A A . 72 LYS HE3 1 1 19 34905 1 1 72 LYS HG2 H 1.764 -9.069 -5.849 1.00 . A A . 72 LYS HG2 1 1 19 34906 1 1 72 LYS HG3 H 2.704 -7.608 -6.076 1.00 . A A . 72 LYS HG3 1 1 19 34907 1 1 72 LYS HZ1 H 3.176 -8.101 -10.177 1.00 . A A . 72 LYS HZ1 1 1 19 34908 1 1 72 LYS HZ2 H 1.604 -8.426 -10.450 1.00 . A A . 72 LYS HZ2 1 1 19 34909 1 1 72 LYS N N 5.113 -7.281 -6.109 1.00 . A A . 72 LYS N 1 1 19 34910 1 1 72 LYS NZ N 2.233 -7.789 -9.974 1.00 . A A . 72 LYS NZ 1 1 19 34911 1 1 72 LYS O O 6.387 -9.373 -3.568 1.00 . A A . 72 LYS O 1 1 19 34912 1 1 73 ASN C C 9.240 -8.508 -4.428 1.00 . A A . 73 ASN C 1 1 19 34913 1 1 73 ASN CA C 8.493 -9.444 -5.381 1.00 . A A . 73 ASN CA 1 1 19 34914 1 1 73 ASN CB C 9.306 -9.550 -6.673 1.00 . A A . 73 ASN CB 1 1 19 34915 1 1 73 ASN CG C 9.417 -8.189 -7.364 1.00 . A A . 73 ASN CG 1 1 19 34916 1 1 73 ASN H H 7.033 -8.539 -6.559 1.00 . A A . 73 ASN H 1 1 19 34917 1 1 73 ASN HA H 8.324 -10.430 -4.950 1.00 . A A . 73 ASN HA 1 1 19 34918 1 1 73 ASN HB2 H 10.303 -9.930 -6.449 1.00 . A A . 73 ASN HB2 1 1 19 34919 1 1 73 ASN HB3 H 8.835 -10.266 -7.345 1.00 . A A . 73 ASN HB3 1 1 19 34920 1 1 73 ASN HD21 H 7.688 -8.595 -8.337 1.00 . A A . 73 ASN HD21 1 1 19 34921 1 1 73 ASN HD22 H 8.403 -7.062 -8.706 1.00 . A A . 73 ASN HD22 1 1 19 34922 1 1 73 ASN N N 7.168 -8.908 -5.639 1.00 . A A . 73 ASN N 1 1 19 34923 1 1 73 ASN ND2 N 8.420 -7.927 -8.205 1.00 . A A . 73 ASN ND2 1 1 19 34924 1 1 73 ASN O O 10.246 -7.908 -4.803 1.00 . A A . 73 ASN O 1 1 19 34925 1 1 73 ASN OD1 O 10.345 -7.428 -7.148 1.00 . A A . 73 ASN OD1 1 1 19 34926 1 1 74 THR C C 9.528 -8.339 -0.902 1.00 . A A . 74 THR C 1 1 19 34927 1 1 74 THR CA C 9.323 -7.561 -2.204 1.00 . A A . 74 THR CA 1 1 19 34928 1 1 74 THR CB C 8.440 -6.323 -2.040 1.00 . A A . 74 THR CB 1 1 19 34929 1 1 74 THR CG2 C 8.257 -5.556 -3.351 1.00 . A A . 74 THR CG2 1 1 19 34930 1 1 74 THR H H 7.900 -8.906 -2.916 1.00 . A A . 74 THR H 1 1 19 34931 1 1 74 THR HA H 10.310 -7.260 -2.555 1.00 . A A . 74 THR HA 1 1 19 34932 1 1 74 THR HB H 8.826 -5.670 -1.257 1.00 . A A . 74 THR HB 1 1 19 34933 1 1 74 THR HG1 H 7.108 -7.195 -0.826 1.00 . A A . 74 THR HG1 1 1 19 34934 1 1 74 THR HG21 H 9.136 -5.697 -3.980 1.00 . A A . 74 THR HG21 1 1 19 34935 1 1 74 THR HG22 H 7.375 -5.929 -3.871 1.00 . A A . 74 THR HG22 1 1 19 34936 1 1 74 THR HG23 H 8.131 -4.495 -3.136 1.00 . A A . 74 THR HG23 1 1 19 34937 1 1 74 THR N N 8.719 -8.414 -3.213 1.00 . A A . 74 THR N 1 1 19 34938 1 1 74 THR O O 8.840 -9.328 -0.651 1.00 . A A . 74 THR O 1 1 19 34939 1 1 74 THR OG1 O 7.146 -6.854 -1.765 1.00 . A A . 74 THR OG1 1 1 19 34940 1 1 75 LYS C C 9.573 -8.371 2.094 1.00 . A A . 75 LYS C 1 1 19 34941 1 1 75 LYS CA C 10.779 -8.500 1.161 1.00 . A A . 75 LYS CA 1 1 19 34942 1 1 75 LYS CB C 12.074 -7.936 1.749 1.00 . A A . 75 LYS CB 1 1 19 34943 1 1 75 LYS CD C 13.900 -8.788 3.265 1.00 . A A . 75 LYS CD 1 1 19 34944 1 1 75 LYS CE C 14.546 -7.574 3.936 1.00 . A A . 75 LYS CE 1 1 19 34945 1 1 75 LYS CG C 12.393 -8.584 3.098 1.00 . A A . 75 LYS CG 1 1 19 34946 1 1 75 LYS H H 11.029 -7.057 -0.320 1.00 . A A . 75 LYS H 1 1 19 34947 1 1 75 LYS HA H 10.950 -9.558 0.962 1.00 . A A . 75 LYS HA 1 1 19 34948 1 1 75 LYS HB2 H 12.897 -8.106 1.055 1.00 . A A . 75 LYS HB2 1 1 19 34949 1 1 75 LYS HB3 H 11.981 -6.857 1.873 1.00 . A A . 75 LYS HB3 1 1 19 34950 1 1 75 LYS HD2 H 14.085 -9.680 3.863 1.00 . A A . 75 LYS HD2 1 1 19 34951 1 1 75 LYS HD3 H 14.358 -8.957 2.291 1.00 . A A . 75 LYS HD3 1 1 19 34952 1 1 75 LYS HE2 H 15.380 -7.219 3.332 1.00 . A A . 75 LYS HE2 1 1 19 34953 1 1 75 LYS HE3 H 13.826 -6.758 3.997 1.00 . A A . 75 LYS HE3 1 1 19 34954 1 1 75 LYS HG2 H 12.015 -7.956 3.905 1.00 . A A . 75 LYS HG2 1 1 19 34955 1 1 75 LYS HG3 H 11.881 -9.543 3.174 1.00 . A A . 75 LYS HG3 1 1 19 34956 1 1 75 LYS HZ1 H 15.930 -8.376 5.272 1.00 . A A . 75 LYS HZ1 1 1 19 34957 1 1 75 LYS HZ2 H 15.114 -7.108 5.886 1.00 . A A . 75 LYS HZ2 1 1 19 34958 1 1 75 LYS N N 10.475 -7.862 -0.108 1.00 . A A . 75 LYS N 1 1 19 34959 1 1 75 LYS NZ N 15.023 -7.925 5.293 1.00 . A A . 75 LYS NZ 1 1 19 34960 1 1 75 LYS O O 9.374 -9.203 2.977 1.00 . A A . 75 LYS O 1 1 19 34961 1 1 76 PHE C C 6.343 -7.201 1.839 1.00 . A A . 76 PHE C 1 1 19 34962 1 1 76 PHE CA C 7.618 -7.070 2.675 1.00 . A A . 76 PHE CA 1 1 19 34963 1 1 76 PHE CB C 7.743 -5.628 3.170 1.00 . A A . 76 PHE CB 1 1 19 34964 1 1 76 PHE CD1 C 8.898 -5.999 5.380 1.00 . A A . 76 PHE CD1 1 1 19 34965 1 1 76 PHE CD2 C 9.967 -4.598 3.765 1.00 . A A . 76 PHE CD2 1 1 19 34966 1 1 76 PHE CE1 C 9.994 -5.785 6.290 1.00 . A A . 76 PHE CE1 1 1 19 34967 1 1 76 PHE CE2 C 11.062 -4.384 4.674 1.00 . A A . 76 PHE CE2 1 1 19 34968 1 1 76 PHE CG C 8.907 -5.401 4.137 1.00 . A A . 76 PHE CG 1 1 19 34969 1 1 76 PHE CZ C 11.022 -4.988 5.892 1.00 . A A . 76 PHE CZ 1 1 19 34970 1 1 76 PHE H H 8.967 -6.647 1.145 1.00 . A A . 76 PHE H 1 1 19 34971 1 1 76 PHE HA H 7.596 -7.810 3.475 1.00 . A A . 76 PHE HA 1 1 19 34972 1 1 76 PHE HB2 H 7.864 -4.969 2.310 1.00 . A A . 76 PHE HB2 1 1 19 34973 1 1 76 PHE HB3 H 6.814 -5.342 3.663 1.00 . A A . 76 PHE HB3 1 1 19 34974 1 1 76 PHE HD1 H 8.062 -6.633 5.674 1.00 . A A . 76 PHE HD1 1 1 19 34975 1 1 76 PHE HD2 H 9.974 -4.126 2.782 1.00 . A A . 76 PHE HD2 1 1 19 34976 1 1 76 PHE HE1 H 9.999 -6.251 7.275 1.00 . A A . 76 PHE HE1 1 1 19 34977 1 1 76 PHE HE2 H 11.905 -3.753 4.393 1.00 . A A . 76 PHE HE2 1 1 19 34978 1 1 76 PHE HZ H 11.833 -4.902 6.659 1.00 . A A . 76 PHE HZ 1 1 19 34979 1 1 76 PHE N N 8.799 -7.320 1.866 1.00 . A A . 76 PHE N 1 1 19 34980 1 1 76 PHE O O 6.380 -7.059 0.618 1.00 . A A . 76 PHE O 1 1 19 34981 1 1 77 LYS C C 3.568 -6.293 1.217 1.00 . A A . 77 LYS C 1 1 19 34982 1 1 77 LYS CA C 3.962 -7.621 1.867 1.00 . A A . 77 LYS CA 1 1 19 34983 1 1 77 LYS CB C 2.915 -8.162 2.843 1.00 . A A . 77 LYS CB 1 1 19 34984 1 1 77 LYS CD C 2.050 -10.207 4.038 1.00 . A A . 77 LYS CD 1 1 19 34985 1 1 77 LYS CE C 2.308 -11.684 4.343 1.00 . A A . 77 LYS CE 1 1 19 34986 1 1 77 LYS CG C 3.050 -9.677 3.009 1.00 . A A . 77 LYS CG 1 1 19 34987 1 1 77 LYS H H 5.224 -7.583 3.524 1.00 . A A . 77 LYS H 1 1 19 34988 1 1 77 LYS HA H 4.086 -8.367 1.082 1.00 . A A . 77 LYS HA 1 1 19 34989 1 1 77 LYS HB2 H 3.029 -7.675 3.812 1.00 . A A . 77 LYS HB2 1 1 19 34990 1 1 77 LYS HB3 H 1.916 -7.919 2.481 1.00 . A A . 77 LYS HB3 1 1 19 34991 1 1 77 LYS HD2 H 2.124 -9.624 4.956 1.00 . A A . 77 LYS HD2 1 1 19 34992 1 1 77 LYS HD3 H 1.035 -10.082 3.662 1.00 . A A . 77 LYS HD3 1 1 19 34993 1 1 77 LYS HE2 H 2.946 -12.114 3.571 1.00 . A A . 77 LYS HE2 1 1 19 34994 1 1 77 LYS HE3 H 2.843 -11.778 5.288 1.00 . A A . 77 LYS HE3 1 1 19 34995 1 1 77 LYS HG2 H 2.884 -10.167 2.049 1.00 . A A . 77 LYS HG2 1 1 19 34996 1 1 77 LYS HG3 H 4.064 -9.923 3.322 1.00 . A A . 77 LYS HG3 1 1 19 34997 1 1 77 LYS HZ1 H 0.622 -12.567 3.494 1.00 . A A . 77 LYS HZ1 1 1 19 34998 1 1 77 LYS HZ2 H 1.151 -13.350 4.820 1.00 . A A . 77 LYS HZ2 1 1 19 34999 1 1 77 LYS N N 5.246 -7.469 2.530 1.00 . A A . 77 LYS N 1 1 19 35000 1 1 77 LYS NZ N 1.032 -12.430 4.412 1.00 . A A . 77 LYS NZ 1 1 19 35001 1 1 77 LYS O O 3.542 -5.257 1.879 1.00 . A A . 77 LYS O 1 1 19 35002 1 1 78 SER C C 1.359 -5.126 -0.951 1.00 . A A . 78 SER C 1 1 19 35003 1 1 78 SER CA C 2.883 -5.184 -0.820 1.00 . A A . 78 SER CA 1 1 19 35004 1 1 78 SER CB C 3.535 -5.166 -2.204 1.00 . A A . 78 SER CB 1 1 19 35005 1 1 78 SER H H 3.297 -7.214 -0.604 1.00 . A A . 78 SER H 1 1 19 35006 1 1 78 SER HA H 3.249 -4.340 -0.236 1.00 . A A . 78 SER HA 1 1 19 35007 1 1 78 SER HB2 H 3.593 -4.139 -2.565 1.00 . A A . 78 SER HB2 1 1 19 35008 1 1 78 SER HB3 H 4.558 -5.535 -2.127 1.00 . A A . 78 SER HB3 1 1 19 35009 1 1 78 SER HG H 3.214 -5.855 -4.055 1.00 . A A . 78 SER HG 1 1 19 35010 1 1 78 SER N N 3.273 -6.367 -0.073 1.00 . A A . 78 SER N 1 1 19 35011 1 1 78 SER O O 0.687 -6.154 -0.875 1.00 . A A . 78 SER O 1 1 19 35012 1 1 78 SER OG O 2.815 -5.959 -3.144 1.00 . A A . 78 SER OG 1 1 19 35013 1 1 79 CYS C C -1.128 -4.813 -2.190 1.00 . A A . 79 CYS C 1 1 19 35014 1 1 79 CYS CA C -0.572 -3.710 -1.288 1.00 . A A . 79 CYS CA 1 1 19 35015 1 1 79 CYS CB C -0.893 -2.315 -1.828 1.00 . A A . 79 CYS CB 1 1 19 35016 1 1 79 CYS H H 1.413 -3.085 -1.207 1.00 . A A . 79 CYS H 1 1 19 35017 1 1 79 CYS HA H -0.998 -3.777 -0.287 1.00 . A A . 79 CYS HA 1 1 19 35018 1 1 79 CYS HB2 H -0.541 -2.250 -2.857 1.00 . A A . 79 CYS HB2 1 1 19 35019 1 1 79 CYS HB3 H -1.976 -2.191 -1.853 1.00 . A A . 79 CYS HB3 1 1 19 35020 1 1 79 CYS N N 0.859 -3.915 -1.146 1.00 . A A . 79 CYS N 1 1 19 35021 1 1 79 CYS O O -1.896 -5.661 -1.738 1.00 . A A . 79 CYS O 1 1 19 35022 1 1 79 CYS SG S -0.166 -0.935 -0.871 1.00 . A A . 79 CYS SG 1 1 19 35023 1 1 80 VAL C C -0.667 -7.136 -4.001 1.00 . A A . 80 VAL C 1 1 19 35024 1 1 80 VAL CA C -1.166 -5.752 -4.419 1.00 . A A . 80 VAL CA 1 1 19 35025 1 1 80 VAL CB C -0.709 -5.350 -5.822 1.00 . A A . 80 VAL CB 1 1 19 35026 1 1 80 VAL CG1 C -1.095 -6.415 -6.851 1.00 . A A . 80 VAL CG1 1 1 19 35027 1 1 80 VAL CG2 C -1.273 -3.981 -6.212 1.00 . A A . 80 VAL CG2 1 1 19 35028 1 1 80 VAL H H -0.093 -4.074 -3.808 1.00 . A A . 80 VAL H 1 1 19 35029 1 1 80 VAL HA H -2.256 -5.753 -4.406 1.00 . A A . 80 VAL HA 1 1 19 35030 1 1 80 VAL HB H 0.378 -5.273 -5.812 1.00 . A A . 80 VAL HB 1 1 19 35031 1 1 80 VAL HG11 H -2.096 -6.787 -6.630 1.00 . A A . 80 VAL HG11 1 1 19 35032 1 1 80 VAL HG12 H -1.082 -5.977 -7.849 1.00 . A A . 80 VAL HG12 1 1 19 35033 1 1 80 VAL HG13 H -0.383 -7.238 -6.806 1.00 . A A . 80 VAL HG13 1 1 19 35034 1 1 80 VAL HG21 H -1.205 -3.305 -5.360 1.00 . A A . 80 VAL HG21 1 1 19 35035 1 1 80 VAL HG22 H -0.698 -3.576 -7.045 1.00 . A A . 80 VAL HG22 1 1 19 35036 1 1 80 VAL HG23 H -2.316 -4.089 -6.509 1.00 . A A . 80 VAL HG23 1 1 19 35037 1 1 80 VAL N N -0.718 -4.767 -3.449 1.00 . A A . 80 VAL N 1 1 19 35038 1 1 80 VAL O O -1.373 -8.130 -4.166 1.00 . A A . 80 VAL O 1 1 19 35039 1 1 81 GLY C C 0.199 -9.175 -2.108 1.00 . A A . 81 GLY C 1 1 19 35040 1 1 81 GLY CA C 1.148 -8.403 -3.026 1.00 . A A . 81 GLY CA 1 1 19 35041 1 1 81 GLY H H 1.113 -6.344 -3.338 1.00 . A A . 81 GLY H 1 1 19 35042 1 1 81 GLY HA2 H 1.401 -9.016 -3.892 1.00 . A A . 81 GLY HA2 1 1 19 35043 1 1 81 GLY HA3 H 2.079 -8.194 -2.500 1.00 . A A . 81 GLY HA3 1 1 19 35044 1 1 81 GLY N N 0.546 -7.157 -3.469 1.00 . A A . 81 GLY N 1 1 19 35045 1 1 81 GLY O O -0.171 -10.310 -2.404 1.00 . A A . 81 GLY O 1 1 19 35046 1 1 82 CYS C C -2.415 -9.376 -0.730 1.00 . A A . 82 CYS C 1 1 19 35047 1 1 82 CYS CA C -1.067 -9.140 -0.047 1.00 . A A . 82 CYS CA 1 1 19 35048 1 1 82 CYS CB C -1.208 -8.287 1.215 1.00 . A A . 82 CYS CB 1 1 19 35049 1 1 82 CYS H H 0.137 -7.605 -0.778 1.00 . A A . 82 CYS H 1 1 19 35050 1 1 82 CYS HA H -0.612 -10.085 0.249 1.00 . A A . 82 CYS HA 1 1 19 35051 1 1 82 CYS HB2 H -0.224 -8.075 1.633 1.00 . A A . 82 CYS HB2 1 1 19 35052 1 1 82 CYS HB3 H -1.662 -7.327 0.967 1.00 . A A . 82 CYS HB3 1 1 19 35053 1 1 82 CYS N N -0.168 -8.528 -1.011 1.00 . A A . 82 CYS N 1 1 19 35054 1 1 82 CYS O O -3.002 -10.449 -0.599 1.00 . A A . 82 CYS O 1 1 19 35055 1 1 82 CYS SG S -2.235 -9.162 2.451 1.00 . A A . 82 CYS SG 1 1 19 35056 1 1 83 HIS C C -4.152 -9.688 -3.031 1.00 . A A . 83 HIS C 1 1 19 35057 1 1 83 HIS CA C -4.136 -8.439 -2.147 1.00 . A A . 83 HIS CA 1 1 19 35058 1 1 83 HIS CB C -4.408 -7.154 -2.932 1.00 . A A . 83 HIS CB 1 1 19 35059 1 1 83 HIS CD2 C -4.786 -5.738 -0.767 1.00 . A A . 83 HIS CD2 1 1 19 35060 1 1 83 HIS CE1 C -6.080 -4.197 -1.625 1.00 . A A . 83 HIS CE1 1 1 19 35061 1 1 83 HIS CG C -4.952 -6.024 -2.090 1.00 . A A . 83 HIS CG 1 1 19 35062 1 1 83 HIS H H -2.384 -7.486 -1.546 1.00 . A A . 83 HIS H 1 1 19 35063 1 1 83 HIS HA H -4.911 -8.533 -1.386 1.00 . A A . 83 HIS HA 1 1 19 35064 1 1 83 HIS HB2 H -3.482 -6.827 -3.405 1.00 . A A . 83 HIS HB2 1 1 19 35065 1 1 83 HIS HB3 H -5.115 -7.371 -3.732 1.00 . A A . 83 HIS HB3 1 1 19 35066 1 1 83 HIS HD1 H -6.082 -4.965 -3.552 1.00 . A A . 83 HIS HD1 1 1 19 35067 1 1 83 HIS HD2 H -4.194 -6.318 -0.059 1.00 . A A . 83 HIS HD2 1 1 19 35068 1 1 83 HIS HE1 H -6.712 -3.313 -1.713 1.00 . A A . 83 HIS HE1 1 1 19 35069 1 1 83 HIS N N -2.868 -8.356 -1.444 1.00 . A A . 83 HIS N 1 1 19 35070 1 1 83 HIS ND1 N -5.773 -5.035 -2.603 1.00 . A A . 83 HIS ND1 1 1 19 35071 1 1 83 HIS NE2 N -5.467 -4.634 -0.488 1.00 . A A . 83 HIS NE2 1 1 19 35072 1 1 83 HIS O O -5.144 -10.414 -3.068 1.00 . A A . 83 HIS O 1 1 19 35073 1 1 84 VAL C C -3.152 -12.328 -3.803 1.00 . A A . 84 VAL C 1 1 19 35074 1 1 84 VAL CA C -2.915 -11.047 -4.604 1.00 . A A . 84 VAL CA 1 1 19 35075 1 1 84 VAL CB C -1.555 -11.022 -5.304 1.00 . A A . 84 VAL CB 1 1 19 35076 1 1 84 VAL CG1 C -1.344 -12.288 -6.136 1.00 . A A . 84 VAL CG1 1 1 19 35077 1 1 84 VAL CG2 C -1.405 -9.767 -6.166 1.00 . A A . 84 VAL CG2 1 1 19 35078 1 1 84 VAL H H -2.239 -9.303 -3.686 1.00 . A A . 84 VAL H 1 1 19 35079 1 1 84 VAL HA H -3.689 -10.962 -5.367 1.00 . A A . 84 VAL HA 1 1 19 35080 1 1 84 VAL HB H -0.783 -10.994 -4.535 1.00 . A A . 84 VAL HB 1 1 19 35081 1 1 84 VAL HG11 H -1.707 -13.153 -5.581 1.00 . A A . 84 VAL HG11 1 1 19 35082 1 1 84 VAL HG12 H -1.891 -12.202 -7.074 1.00 . A A . 84 VAL HG12 1 1 19 35083 1 1 84 VAL HG13 H -0.281 -12.412 -6.345 1.00 . A A . 84 VAL HG13 1 1 19 35084 1 1 84 VAL HG21 H -2.251 -9.103 -5.992 1.00 . A A . 84 VAL HG21 1 1 19 35085 1 1 84 VAL HG22 H -0.480 -9.254 -5.904 1.00 . A A . 84 VAL HG22 1 1 19 35086 1 1 84 VAL HG23 H -1.377 -10.051 -7.219 1.00 . A A . 84 VAL HG23 1 1 19 35087 1 1 84 VAL N N -3.042 -9.899 -3.722 1.00 . A A . 84 VAL N 1 1 19 35088 1 1 84 VAL O O -3.757 -13.275 -4.304 1.00 . A A . 84 VAL O 1 1 19 35089 1 1 85 GLU C C -4.252 -13.557 -1.180 1.00 . A A . 85 GLU C 1 1 19 35090 1 1 85 GLU CA C -2.814 -13.467 -1.696 1.00 . A A . 85 GLU CA 1 1 19 35091 1 1 85 GLU CB C -1.819 -13.407 -0.536 1.00 . A A . 85 GLU CB 1 1 19 35092 1 1 85 GLU CD C -0.471 -15.396 0.231 1.00 . A A . 85 GLU CD 1 1 19 35093 1 1 85 GLU CG C -0.598 -14.286 -0.815 1.00 . A A . 85 GLU CG 1 1 19 35094 1 1 85 GLU H H -2.173 -11.543 -2.171 1.00 . A A . 85 GLU H 1 1 19 35095 1 1 85 GLU HA H -2.588 -14.335 -2.316 1.00 . A A . 85 GLU HA 1 1 19 35096 1 1 85 GLU HB2 H -1.500 -12.377 -0.377 1.00 . A A . 85 GLU HB2 1 1 19 35097 1 1 85 GLU HB3 H -2.305 -13.735 0.383 1.00 . A A . 85 GLU HB3 1 1 19 35098 1 1 85 GLU HG2 H -0.682 -14.726 -1.809 1.00 . A A . 85 GLU HG2 1 1 19 35099 1 1 85 GLU HG3 H 0.304 -13.674 -0.812 1.00 . A A . 85 GLU HG3 1 1 19 35100 1 1 85 GLU N N -2.664 -12.317 -2.571 1.00 . A A . 85 GLU N 1 1 19 35101 1 1 85 GLU O O -4.776 -14.652 -0.979 1.00 . A A . 85 GLU O 1 1 19 35102 1 1 85 GLU OE1 O -1.467 -16.133 0.400 1.00 . A A . 85 GLU OE1 1 1 19 35103 1 1 85 GLU OE2 O 0.619 -15.483 0.837 1.00 . A A . 85 GLU OE2 1 1 19 35104 1 1 86 VAL C C -7.177 -12.691 -1.626 1.00 . A A . 86 VAL C 1 1 19 35105 1 1 86 VAL CA C -6.216 -12.325 -0.493 1.00 . A A . 86 VAL CA 1 1 19 35106 1 1 86 VAL CB C -6.493 -10.942 0.102 1.00 . A A . 86 VAL CB 1 1 19 35107 1 1 86 VAL CG1 C -7.934 -10.840 0.605 1.00 . A A . 86 VAL CG1 1 1 19 35108 1 1 86 VAL CG2 C -5.498 -10.616 1.217 1.00 . A A . 86 VAL CG2 1 1 19 35109 1 1 86 VAL H H -4.416 -11.505 -1.147 1.00 . A A . 86 VAL H 1 1 19 35110 1 1 86 VAL HA H -6.317 -13.061 0.305 1.00 . A A . 86 VAL HA 1 1 19 35111 1 1 86 VAL HB H -6.361 -10.205 -0.690 1.00 . A A . 86 VAL HB 1 1 19 35112 1 1 86 VAL HG11 H -8.211 -11.769 1.104 1.00 . A A . 86 VAL HG11 1 1 19 35113 1 1 86 VAL HG12 H -8.015 -10.012 1.309 1.00 . A A . 86 VAL HG12 1 1 19 35114 1 1 86 VAL HG13 H -8.602 -10.667 -0.239 1.00 . A A . 86 VAL HG13 1 1 19 35115 1 1 86 VAL HG21 H -4.524 -11.040 0.972 1.00 . A A . 86 VAL HG21 1 1 19 35116 1 1 86 VAL HG22 H -5.407 -9.534 1.319 1.00 . A A . 86 VAL HG22 1 1 19 35117 1 1 86 VAL HG23 H -5.853 -11.040 2.156 1.00 . A A . 86 VAL HG23 1 1 19 35118 1 1 86 VAL N N -4.849 -12.391 -0.981 1.00 . A A . 86 VAL N 1 1 19 35119 1 1 86 VAL O O -8.009 -13.585 -1.474 1.00 . A A . 86 VAL O 1 1 19 35120 1 1 87 ALA C C -7.556 -13.602 -4.475 1.00 . A A . 87 ALA C 1 1 19 35121 1 1 87 ALA CA C -7.874 -12.223 -3.894 1.00 . A A . 87 ALA CA 1 1 19 35122 1 1 87 ALA CB C -7.673 -11.100 -4.913 1.00 . A A . 87 ALA CB 1 1 19 35123 1 1 87 ALA H H -6.350 -11.259 -2.851 1.00 . A A . 87 ALA H 1 1 19 35124 1 1 87 ALA HA H -8.910 -12.210 -3.557 1.00 . A A . 87 ALA HA 1 1 19 35125 1 1 87 ALA HB1 H -6.656 -10.714 -4.833 1.00 . A A . 87 ALA HB1 1 1 19 35126 1 1 87 ALA HB2 H -7.835 -11.489 -5.919 1.00 . A A . 87 ALA HB2 1 1 19 35127 1 1 87 ALA HB3 H -8.383 -10.297 -4.715 1.00 . A A . 87 ALA HB3 1 1 19 35128 1 1 87 ALA N N -7.030 -11.983 -2.736 1.00 . A A . 87 ALA N 1 1 19 35129 1 1 87 ALA O O -8.456 -14.316 -4.916 1.00 . A A . 87 ALA O 1 1 19 35130 1 1 88 GLY C C -6.588 -15.587 -6.250 1.00 . A A . 88 GLY C 1 1 19 35131 1 1 88 GLY CA C -5.826 -15.216 -4.976 1.00 . A A . 88 GLY CA 1 1 19 35132 1 1 88 GLY H H -5.549 -13.349 -4.095 1.00 . A A . 88 GLY H 1 1 19 35133 1 1 88 GLY HA2 H -4.758 -15.174 -5.186 1.00 . A A . 88 GLY HA2 1 1 19 35134 1 1 88 GLY HA3 H -5.972 -15.990 -4.222 1.00 . A A . 88 GLY HA3 1 1 19 35135 1 1 88 GLY N N -6.274 -13.936 -4.456 1.00 . A A . 88 GLY N 1 1 19 35136 1 1 88 GLY O O -6.705 -14.775 -7.166 1.00 . A A . 88 GLY O 1 1 19 35137 1 1 89 ALA C C -9.326 -17.314 -7.077 1.00 . A A . 89 ALA C 1 1 19 35138 1 1 89 ALA CA C -7.833 -17.304 -7.413 1.00 . A A . 89 ALA CA 1 1 19 35139 1 1 89 ALA CB C -7.315 -18.688 -7.808 1.00 . A A . 89 ALA CB 1 1 19 35140 1 1 89 ALA H H -6.987 -17.469 -5.517 1.00 . A A . 89 ALA H 1 1 19 35141 1 1 89 ALA HA H -7.660 -16.615 -8.240 1.00 . A A . 89 ALA HA 1 1 19 35142 1 1 89 ALA HB1 H -6.393 -18.899 -7.267 1.00 . A A . 89 ALA HB1 1 1 19 35143 1 1 89 ALA HB2 H -8.063 -19.441 -7.558 1.00 . A A . 89 ALA HB2 1 1 19 35144 1 1 89 ALA HB3 H -7.121 -18.711 -8.880 1.00 . A A . 89 ALA HB3 1 1 19 35145 1 1 89 ALA N N -7.087 -16.815 -6.267 1.00 . A A . 89 ALA N 1 1 19 35146 1 1 89 ALA O O -9.969 -18.362 -7.120 1.00 . A A . 89 ALA O 1 1 19 35147 1 1 90 ASP C C -11.954 -15.212 -7.511 1.00 . A A . 90 ASP C 1 1 19 35148 1 1 90 ASP CA C -11.240 -15.995 -6.408 1.00 . A A . 90 ASP CA 1 1 19 35149 1 1 90 ASP CB C -11.412 -15.227 -5.096 1.00 . A A . 90 ASP CB 1 1 19 35150 1 1 90 ASP CG C -12.580 -15.693 -4.223 1.00 . A A . 90 ASP CG 1 1 19 35151 1 1 90 ASP H H -9.306 -15.287 -6.720 1.00 . A A . 90 ASP H 1 1 19 35152 1 1 90 ASP HA H -11.614 -17.014 -6.311 1.00 . A A . 90 ASP HA 1 1 19 35153 1 1 90 ASP HB2 H -10.491 -15.312 -4.519 1.00 . A A . 90 ASP HB2 1 1 19 35154 1 1 90 ASP HB3 H -11.548 -14.171 -5.325 1.00 . A A . 90 ASP HB3 1 1 19 35155 1 1 90 ASP N N -9.835 -16.135 -6.751 1.00 . A A . 90 ASP N 1 1 19 35156 1 1 90 ASP O O -13.180 -15.249 -7.610 1.00 . A A . 90 ASP O 1 1 19 35157 1 1 90 ASP OD1 O -13.727 -15.343 -4.576 1.00 . A A . 90 ASP OD1 1 1 19 35158 1 1 90 ASP OD2 O -12.299 -16.387 -3.223 1.00 . A A . 90 ASP OD2 1 1 19 35159 1 1 91 ALA C C -12.642 -12.665 -8.840 1.00 . A A . 91 ALA C 1 1 19 35160 1 1 91 ALA CA C -11.699 -13.729 -9.405 1.00 . A A . 91 ALA CA 1 1 19 35161 1 1 91 ALA CB C -12.395 -14.652 -10.408 1.00 . A A . 91 ALA CB 1 1 19 35162 1 1 91 ALA H H -10.162 -14.496 -8.226 1.00 . A A . 91 ALA H 1 1 19 35163 1 1 91 ALA HA H -10.864 -13.236 -9.903 1.00 . A A . 91 ALA HA 1 1 19 35164 1 1 91 ALA HB1 H -12.436 -15.663 -10.003 1.00 . A A . 91 ALA HB1 1 1 19 35165 1 1 91 ALA HB2 H -13.407 -14.292 -10.590 1.00 . A A . 91 ALA HB2 1 1 19 35166 1 1 91 ALA HB3 H -11.837 -14.657 -11.344 1.00 . A A . 91 ALA HB3 1 1 19 35167 1 1 91 ALA N N -11.158 -14.521 -8.313 1.00 . A A . 91 ALA N 1 1 19 35168 1 1 91 ALA O O -13.236 -12.857 -7.780 1.00 . A A . 91 ALA O 1 1 19 35169 1 1 92 ALA C C -12.875 -9.616 -8.123 1.00 . A A . 92 ALA C 1 1 19 35170 1 1 92 ALA CA C -13.610 -10.472 -9.157 1.00 . A A . 92 ALA CA 1 1 19 35171 1 1 92 ALA CB C -14.927 -11.033 -8.619 1.00 . A A . 92 ALA CB 1 1 19 35172 1 1 92 ALA H H -12.263 -11.419 -10.433 1.00 . A A . 92 ALA H 1 1 19 35173 1 1 92 ALA HA H -13.820 -9.863 -10.036 1.00 . A A . 92 ALA HA 1 1 19 35174 1 1 92 ALA HB1 H -15.135 -11.992 -9.095 1.00 . A A . 92 ALA HB1 1 1 19 35175 1 1 92 ALA HB2 H -14.850 -11.172 -7.541 1.00 . A A . 92 ALA HB2 1 1 19 35176 1 1 92 ALA HB3 H -15.736 -10.336 -8.839 1.00 . A A . 92 ALA HB3 1 1 19 35177 1 1 92 ALA N N -12.750 -11.567 -9.572 1.00 . A A . 92 ALA N 1 1 19 35178 1 1 92 ALA O O -12.788 -8.398 -8.269 1.00 . A A . 92 ALA O 1 1 19 35179 1 1 93 LYS C C -10.316 -9.078 -6.594 1.00 . A A . 93 LYS C 1 1 19 35180 1 1 93 LYS CA C -11.643 -9.604 -6.042 1.00 . A A . 93 LYS CA 1 1 19 35181 1 1 93 LYS CB C -11.483 -10.518 -4.825 1.00 . A A . 93 LYS CB 1 1 19 35182 1 1 93 LYS CD C -12.639 -11.361 -2.749 1.00 . A A . 93 LYS CD 1 1 19 35183 1 1 93 LYS CE C -13.146 -12.803 -2.694 1.00 . A A . 93 LYS CE 1 1 19 35184 1 1 93 LYS CG C -12.831 -10.765 -4.145 1.00 . A A . 93 LYS CG 1 1 19 35185 1 1 93 LYS H H -12.442 -11.278 -6.989 1.00 . A A . 93 LYS H 1 1 19 35186 1 1 93 LYS HA H -12.248 -8.753 -5.729 1.00 . A A . 93 LYS HA 1 1 19 35187 1 1 93 LYS HB2 H -11.048 -11.468 -5.134 1.00 . A A . 93 LYS HB2 1 1 19 35188 1 1 93 LYS HB3 H -10.791 -10.066 -4.115 1.00 . A A . 93 LYS HB3 1 1 19 35189 1 1 93 LYS HD2 H -11.583 -11.332 -2.479 1.00 . A A . 93 LYS HD2 1 1 19 35190 1 1 93 LYS HD3 H -13.172 -10.756 -2.015 1.00 . A A . 93 LYS HD3 1 1 19 35191 1 1 93 LYS HE2 H -14.205 -12.833 -2.954 1.00 . A A . 93 LYS HE2 1 1 19 35192 1 1 93 LYS HE3 H -12.620 -13.408 -3.431 1.00 . A A . 93 LYS HE3 1 1 19 35193 1 1 93 LYS HG2 H -13.383 -9.828 -4.072 1.00 . A A . 93 LYS HG2 1 1 19 35194 1 1 93 LYS HG3 H -13.431 -11.441 -4.753 1.00 . A A . 93 LYS HG3 1 1 19 35195 1 1 93 LYS HZ1 H -12.235 -12.871 -0.821 1.00 . A A . 93 LYS HZ1 1 1 19 35196 1 1 93 LYS HZ2 H -13.793 -13.340 -0.787 1.00 . A A . 93 LYS HZ2 1 1 19 35197 1 1 93 LYS N N -12.366 -10.288 -7.100 1.00 . A A . 93 LYS N 1 1 19 35198 1 1 93 LYS NZ N -12.946 -13.372 -1.342 1.00 . A A . 93 LYS NZ 1 1 19 35199 1 1 93 LYS O O -9.910 -7.960 -6.282 1.00 . A A . 93 LYS O 1 1 19 35200 1 1 94 LYS C C -8.614 -8.354 -8.945 1.00 . A A . 94 LYS C 1 1 19 35201 1 1 94 LYS CA C -8.406 -9.542 -8.003 1.00 . A A . 94 LYS CA 1 1 19 35202 1 1 94 LYS CB C -7.761 -10.755 -8.676 1.00 . A A . 94 LYS CB 1 1 19 35203 1 1 94 LYS CD C -8.274 -12.501 -10.422 1.00 . A A . 94 LYS CD 1 1 19 35204 1 1 94 LYS CE C -8.840 -12.756 -11.821 1.00 . A A . 94 LYS CE 1 1 19 35205 1 1 94 LYS CG C -8.392 -11.024 -10.044 1.00 . A A . 94 LYS CG 1 1 19 35206 1 1 94 LYS H H -10.016 -10.817 -7.654 1.00 . A A . 94 LYS H 1 1 19 35207 1 1 94 LYS HA H -7.743 -9.231 -7.196 1.00 . A A . 94 LYS HA 1 1 19 35208 1 1 94 LYS HB2 H -6.690 -10.585 -8.793 1.00 . A A . 94 LYS HB2 1 1 19 35209 1 1 94 LYS HB3 H -7.876 -11.633 -8.040 1.00 . A A . 94 LYS HB3 1 1 19 35210 1 1 94 LYS HD2 H -7.228 -12.807 -10.388 1.00 . A A . 94 LYS HD2 1 1 19 35211 1 1 94 LYS HD3 H -8.808 -13.111 -9.693 1.00 . A A . 94 LYS HD3 1 1 19 35212 1 1 94 LYS HE2 H -9.426 -13.675 -11.820 1.00 . A A . 94 LYS HE2 1 1 19 35213 1 1 94 LYS HE3 H -9.515 -11.948 -12.099 1.00 . A A . 94 LYS HE3 1 1 19 35214 1 1 94 LYS HG2 H -9.442 -10.732 -10.027 1.00 . A A . 94 LYS HG2 1 1 19 35215 1 1 94 LYS HG3 H -7.903 -10.410 -10.801 1.00 . A A . 94 LYS HG3 1 1 19 35216 1 1 94 LYS HZ1 H -7.207 -13.712 -12.696 1.00 . A A . 94 LYS HZ1 1 1 19 35217 1 1 94 LYS HZ2 H -8.094 -12.860 -13.764 1.00 . A A . 94 LYS HZ2 1 1 19 35218 1 1 94 LYS N N -9.678 -9.909 -7.405 1.00 . A A . 94 LYS N 1 1 19 35219 1 1 94 LYS NZ N -7.745 -12.860 -12.812 1.00 . A A . 94 LYS NZ 1 1 19 35220 1 1 94 LYS O O -7.649 -7.751 -9.411 1.00 . A A . 94 LYS O 1 1 19 35221 1 1 95 LYS C C -10.574 -5.722 -9.229 1.00 . A A . 95 LYS C 1 1 19 35222 1 1 95 LYS CA C -10.226 -6.949 -10.074 1.00 . A A . 95 LYS CA 1 1 19 35223 1 1 95 LYS CB C -11.336 -7.363 -11.043 1.00 . A A . 95 LYS CB 1 1 19 35224 1 1 95 LYS CD C -11.734 -7.834 -13.488 1.00 . A A . 95 LYS CD 1 1 19 35225 1 1 95 LYS CE C -10.795 -8.861 -14.124 1.00 . A A . 95 LYS CE 1 1 19 35226 1 1 95 LYS CG C -10.989 -6.960 -12.478 1.00 . A A . 95 LYS CG 1 1 19 35227 1 1 95 LYS H H -10.659 -8.550 -8.812 1.00 . A A . 95 LYS H 1 1 19 35228 1 1 95 LYS HA H -9.345 -6.719 -10.672 1.00 . A A . 95 LYS HA 1 1 19 35229 1 1 95 LYS HB2 H -11.486 -8.441 -10.991 1.00 . A A . 95 LYS HB2 1 1 19 35230 1 1 95 LYS HB3 H -12.275 -6.896 -10.747 1.00 . A A . 95 LYS HB3 1 1 19 35231 1 1 95 LYS HD2 H -12.558 -8.347 -12.993 1.00 . A A . 95 LYS HD2 1 1 19 35232 1 1 95 LYS HD3 H -12.171 -7.206 -14.265 1.00 . A A . 95 LYS HD3 1 1 19 35233 1 1 95 LYS HE2 H -9.879 -8.370 -14.452 1.00 . A A . 95 LYS HE2 1 1 19 35234 1 1 95 LYS HE3 H -10.508 -9.608 -13.383 1.00 . A A . 95 LYS HE3 1 1 19 35235 1 1 95 LYS HG2 H -11.246 -5.913 -12.637 1.00 . A A . 95 LYS HG2 1 1 19 35236 1 1 95 LYS HG3 H -9.914 -7.052 -12.635 1.00 . A A . 95 LYS HG3 1 1 19 35237 1 1 95 LYS HZ1 H -11.531 -8.902 -16.073 1.00 . A A . 95 LYS HZ1 1 1 19 35238 1 1 95 LYS HZ2 H -10.937 -10.338 -15.587 1.00 . A A . 95 LYS HZ2 1 1 19 35239 1 1 95 LYS N N -9.880 -8.054 -9.196 1.00 . A A . 95 LYS N 1 1 19 35240 1 1 95 LYS NZ N -11.450 -9.522 -15.274 1.00 . A A . 95 LYS NZ 1 1 19 35241 1 1 95 LYS O O -10.620 -4.604 -9.741 1.00 . A A . 95 LYS O 1 1 19 35242 1 1 96 ASP C C -10.112 -4.844 -5.910 1.00 . A A . 96 ASP C 1 1 19 35243 1 1 96 ASP CA C -11.153 -4.901 -7.029 1.00 . A A . 96 ASP CA 1 1 19 35244 1 1 96 ASP CB C -12.522 -5.141 -6.390 1.00 . A A . 96 ASP CB 1 1 19 35245 1 1 96 ASP CG C -13.628 -4.191 -6.854 1.00 . A A . 96 ASP CG 1 1 19 35246 1 1 96 ASP H H -10.771 -6.884 -7.541 1.00 . A A . 96 ASP H 1 1 19 35247 1 1 96 ASP HA H -11.164 -3.995 -7.635 1.00 . A A . 96 ASP HA 1 1 19 35248 1 1 96 ASP HB2 H -12.831 -6.165 -6.602 1.00 . A A . 96 ASP HB2 1 1 19 35249 1 1 96 ASP HB3 H -12.421 -5.056 -5.308 1.00 . A A . 96 ASP HB3 1 1 19 35250 1 1 96 ASP N N -10.810 -5.972 -7.950 1.00 . A A . 96 ASP N 1 1 19 35251 1 1 96 ASP O O -10.245 -4.059 -4.972 1.00 . A A . 96 ASP O 1 1 19 35252 1 1 96 ASP OD1 O -13.284 -3.033 -7.174 1.00 . A A . 96 ASP OD1 1 1 19 35253 1 1 96 ASP OD2 O -14.792 -4.645 -6.880 1.00 . A A . 96 ASP OD2 1 1 19 35254 1 1 97 LEU C C -6.692 -5.493 -5.743 1.00 . A A . 97 LEU C 1 1 19 35255 1 1 97 LEU CA C -8.035 -5.743 -5.055 1.00 . A A . 97 LEU CA 1 1 19 35256 1 1 97 LEU CB C -8.094 -7.060 -4.279 1.00 . A A . 97 LEU CB 1 1 19 35257 1 1 97 LEU CD1 C -8.997 -8.354 -2.313 1.00 . A A . 97 LEU CD1 1 1 19 35258 1 1 97 LEU CD2 C -9.519 -5.885 -2.562 1.00 . A A . 97 LEU CD2 1 1 19 35259 1 1 97 LEU CG C -9.251 -7.204 -3.289 1.00 . A A . 97 LEU CG 1 1 19 35260 1 1 97 LEU H H -8.997 -6.322 -6.810 1.00 . A A . 97 LEU H 1 1 19 35261 1 1 97 LEU HA H -8.212 -4.939 -4.340 1.00 . A A . 97 LEU HA 1 1 19 35262 1 1 97 LEU HB2 H -8.151 -7.879 -4.997 1.00 . A A . 97 LEU HB2 1 1 19 35263 1 1 97 LEU HB3 H -7.158 -7.179 -3.734 1.00 . A A . 97 LEU HB3 1 1 19 35264 1 1 97 LEU HD11 H -8.320 -9.076 -2.770 1.00 . A A . 97 LEU HD11 1 1 19 35265 1 1 97 LEU HD12 H -8.549 -7.964 -1.399 1.00 . A A . 97 LEU HD12 1 1 19 35266 1 1 97 LEU HD13 H -9.942 -8.843 -2.074 1.00 . A A . 97 LEU HD13 1 1 19 35267 1 1 97 LEU HD21 H -8.580 -5.348 -2.425 1.00 . A A . 97 LEU HD21 1 1 19 35268 1 1 97 LEU HD22 H -10.202 -5.276 -3.155 1.00 . A A . 97 LEU HD22 1 1 19 35269 1 1 97 LEU HD23 H -9.966 -6.089 -1.590 1.00 . A A . 97 LEU HD23 1 1 19 35270 1 1 97 LEU HG H -10.153 -7.451 -3.850 1.00 . A A . 97 LEU HG 1 1 19 35271 1 1 97 LEU N N -9.098 -5.687 -6.044 1.00 . A A . 97 LEU N 1 1 19 35272 1 1 97 LEU O O -5.880 -4.704 -5.260 1.00 . A A . 97 LEU O 1 1 19 35273 1 1 98 THR C C -5.558 -5.496 -9.016 1.00 . A A . 98 THR C 1 1 19 35274 1 1 98 THR CA C -5.266 -6.043 -7.617 1.00 . A A . 98 THR CA 1 1 19 35275 1 1 98 THR CB C -4.565 -7.403 -7.631 1.00 . A A . 98 THR CB 1 1 19 35276 1 1 98 THR CG2 C -4.690 -8.140 -6.296 1.00 . A A . 98 THR CG2 1 1 19 35277 1 1 98 THR H H -7.163 -6.819 -7.245 1.00 . A A . 98 THR H 1 1 19 35278 1 1 98 THR HA H -4.632 -5.313 -7.115 1.00 . A A . 98 THR HA 1 1 19 35279 1 1 98 THR HB H -3.520 -7.300 -7.923 1.00 . A A . 98 THR HB 1 1 19 35280 1 1 98 THR HG1 H -6.264 -8.318 -8.165 1.00 . A A . 98 THR HG1 1 1 19 35281 1 1 98 THR HG21 H -5.744 -8.259 -6.044 1.00 . A A . 98 THR HG21 1 1 19 35282 1 1 98 THR HG22 H -4.224 -9.122 -6.378 1.00 . A A . 98 THR HG22 1 1 19 35283 1 1 98 THR HG23 H -4.193 -7.565 -5.516 1.00 . A A . 98 THR HG23 1 1 19 35284 1 1 98 THR N N -6.497 -6.180 -6.859 1.00 . A A . 98 THR N 1 1 19 35285 1 1 98 THR O O -4.672 -5.453 -9.868 1.00 . A A . 98 THR O 1 1 19 35286 1 1 98 THR OG1 O -5.344 -8.185 -8.533 1.00 . A A . 98 THR OG1 1 1 19 35287 1 1 99 GLY C C -6.422 -3.297 -10.846 1.00 . A A . 99 GLY C 1 1 19 35288 1 1 99 GLY CA C -7.226 -4.549 -10.490 1.00 . A A . 99 GLY CA 1 1 19 35289 1 1 99 GLY H H -7.520 -5.129 -8.511 1.00 . A A . 99 GLY H 1 1 19 35290 1 1 99 GLY HA2 H -7.097 -5.302 -11.267 1.00 . A A . 99 GLY HA2 1 1 19 35291 1 1 99 GLY HA3 H -8.288 -4.306 -10.454 1.00 . A A . 99 GLY HA3 1 1 19 35292 1 1 99 GLY N N -6.805 -5.091 -9.209 1.00 . A A . 99 GLY N 1 1 19 35293 1 1 99 GLY O O -5.995 -2.557 -9.961 1.00 . A A . 99 GLY O 1 1 19 35294 1 1 100 CYS C C -6.465 -0.775 -12.774 1.00 . A A . 100 CYS C 1 1 19 35295 1 1 100 CYS CA C -5.495 -1.950 -12.627 1.00 . A A . 100 CYS CA 1 1 19 35296 1 1 100 CYS CB C -4.769 -2.257 -13.939 1.00 . A A . 100 CYS CB 1 1 19 35297 1 1 100 CYS H H -6.591 -3.706 -12.856 1.00 . A A . 100 CYS H 1 1 19 35298 1 1 100 CYS HA H -4.734 -1.732 -11.878 1.00 . A A . 100 CYS HA 1 1 19 35299 1 1 100 CYS HB2 H -5.377 -2.950 -14.520 1.00 . A A . 100 CYS HB2 1 1 19 35300 1 1 100 CYS HB3 H -4.691 -1.338 -14.519 1.00 . A A . 100 CYS HB3 1 1 19 35301 1 1 100 CYS N N -6.240 -3.099 -12.143 1.00 . A A . 100 CYS N 1 1 19 35302 1 1 100 CYS O O -6.271 0.275 -12.163 1.00 . A A . 100 CYS O 1 1 19 35303 1 1 100 CYS SG S -3.095 -2.970 -13.741 1.00 . A A . 100 CYS SG 1 1 19 35304 1 1 101 LYS C C -9.856 -0.477 -13.368 1.00 . A A . 101 LYS C 1 1 19 35305 1 1 101 LYS CA C -8.488 0.036 -13.822 1.00 . A A . 101 LYS CA 1 1 19 35306 1 1 101 LYS CB C -8.455 0.491 -15.282 1.00 . A A . 101 LYS CB 1 1 19 35307 1 1 101 LYS CD C -10.868 0.696 -15.987 1.00 . A A . 101 LYS CD 1 1 19 35308 1 1 101 LYS CE C -11.135 0.837 -17.487 1.00 . A A . 101 LYS CE 1 1 19 35309 1 1 101 LYS CG C -9.604 1.457 -15.581 1.00 . A A . 101 LYS CG 1 1 19 35310 1 1 101 LYS H H -7.639 -1.849 -14.080 1.00 . A A . 101 LYS H 1 1 19 35311 1 1 101 LYS HA H -8.221 0.897 -13.210 1.00 . A A . 101 LYS HA 1 1 19 35312 1 1 101 LYS HB2 H -7.503 0.977 -15.495 1.00 . A A . 101 LYS HB2 1 1 19 35313 1 1 101 LYS HB3 H -8.524 -0.376 -15.939 1.00 . A A . 101 LYS HB3 1 1 19 35314 1 1 101 LYS HD2 H -10.760 -0.358 -15.731 1.00 . A A . 101 LYS HD2 1 1 19 35315 1 1 101 LYS HD3 H -11.722 1.074 -15.425 1.00 . A A . 101 LYS HD3 1 1 19 35316 1 1 101 LYS HE2 H -12.209 0.884 -17.668 1.00 . A A . 101 LYS HE2 1 1 19 35317 1 1 101 LYS HE3 H -10.710 1.772 -17.851 1.00 . A A . 101 LYS HE3 1 1 19 35318 1 1 101 LYS HG2 H -9.810 2.067 -14.701 1.00 . A A . 101 LYS HG2 1 1 19 35319 1 1 101 LYS HG3 H -9.313 2.138 -16.380 1.00 . A A . 101 LYS HG3 1 1 19 35320 1 1 101 LYS HZ1 H -9.836 -0.004 -18.882 1.00 . A A . 101 LYS HZ1 1 1 19 35321 1 1 101 LYS HZ2 H -10.116 -0.976 -17.606 1.00 . A A . 101 LYS HZ2 1 1 19 35322 1 1 101 LYS N N -7.488 -0.992 -13.587 1.00 . A A . 101 LYS N 1 1 19 35323 1 1 101 LYS NZ N -10.550 -0.303 -18.227 1.00 . A A . 101 LYS NZ 1 1 19 35324 1 1 101 LYS O O -10.220 -1.617 -13.650 1.00 . A A . 101 LYS O 1 1 19 35325 1 1 102 LYS C C -11.752 -0.902 -10.978 1.00 . A A . 102 LYS C 1 1 19 35326 1 1 102 LYS CA C -11.896 0.039 -12.176 1.00 . A A . 102 LYS CA 1 1 19 35327 1 1 102 LYS CB C -12.759 -0.530 -13.304 1.00 . A A . 102 LYS CB 1 1 19 35328 1 1 102 LYS CD C -15.133 -0.334 -14.133 1.00 . A A . 102 LYS CD 1 1 19 35329 1 1 102 LYS CE C -15.917 0.473 -15.169 1.00 . A A . 102 LYS CE 1 1 19 35330 1 1 102 LYS CG C -13.894 0.431 -13.665 1.00 . A A . 102 LYS CG 1 1 19 35331 1 1 102 LYS H H -10.273 1.316 -12.447 1.00 . A A . 102 LYS H 1 1 19 35332 1 1 102 LYS HA H -12.373 0.959 -11.838 1.00 . A A . 102 LYS HA 1 1 19 35333 1 1 102 LYS HB2 H -12.141 -0.714 -14.183 1.00 . A A . 102 LYS HB2 1 1 19 35334 1 1 102 LYS HB3 H -13.174 -1.491 -13.000 1.00 . A A . 102 LYS HB3 1 1 19 35335 1 1 102 LYS HD2 H -14.833 -1.290 -14.562 1.00 . A A . 102 LYS HD2 1 1 19 35336 1 1 102 LYS HD3 H -15.772 -0.555 -13.278 1.00 . A A . 102 LYS HD3 1 1 19 35337 1 1 102 LYS HE2 H -15.731 1.538 -15.026 1.00 . A A . 102 LYS HE2 1 1 19 35338 1 1 102 LYS HE3 H -15.574 0.221 -16.172 1.00 . A A . 102 LYS HE3 1 1 19 35339 1 1 102 LYS HG2 H -14.145 1.044 -12.799 1.00 . A A . 102 LYS HG2 1 1 19 35340 1 1 102 LYS HG3 H -13.563 1.111 -14.450 1.00 . A A . 102 LYS HG3 1 1 19 35341 1 1 102 LYS HZ1 H -17.915 1.051 -15.029 1.00 . A A . 102 LYS HZ1 1 1 19 35342 1 1 102 LYS HZ2 H -17.713 -0.354 -15.828 1.00 . A A . 102 LYS HZ2 1 1 19 35343 1 1 102 LYS N N -10.576 0.390 -12.672 1.00 . A A . 102 LYS N 1 1 19 35344 1 1 102 LYS NZ N -17.367 0.198 -15.051 1.00 . A A . 102 LYS NZ 1 1 19 35345 1 1 102 LYS O O -12.394 -1.950 -10.926 1.00 . A A . 102 LYS O 1 1 19 35346 1 1 103 SER C C -10.967 -0.455 -7.601 1.00 . A A . 103 SER C 1 1 19 35347 1 1 103 SER CA C -10.670 -1.287 -8.850 1.00 . A A . 103 SER CA 1 1 19 35348 1 1 103 SER CB C -9.231 -1.807 -8.810 1.00 . A A . 103 SER CB 1 1 19 35349 1 1 103 SER H H -10.388 0.361 -10.093 1.00 . A A . 103 SER H 1 1 19 35350 1 1 103 SER HA H -11.358 -2.129 -8.922 1.00 . A A . 103 SER HA 1 1 19 35351 1 1 103 SER HB2 H -8.882 -1.831 -7.778 1.00 . A A . 103 SER HB2 1 1 19 35352 1 1 103 SER HB3 H -9.207 -2.833 -9.179 1.00 . A A . 103 SER HB3 1 1 19 35353 1 1 103 SER HG H -8.475 -0.037 -9.359 1.00 . A A . 103 SER HG 1 1 19 35354 1 1 103 SER N N -10.906 -0.493 -10.044 1.00 . A A . 103 SER N 1 1 19 35355 1 1 103 SER O O -11.437 0.678 -7.703 1.00 . A A . 103 SER O 1 1 19 35356 1 1 103 SER OG O -8.351 -1.002 -9.590 1.00 . A A . 103 SER OG 1 1 19 35357 1 1 104 LYS C C -9.830 0.684 -4.969 1.00 . A A . 104 LYS C 1 1 19 35358 1 1 104 LYS CA C -10.913 -0.376 -5.184 1.00 . A A . 104 LYS CA 1 1 19 35359 1 1 104 LYS CB C -11.012 -1.395 -4.047 1.00 . A A . 104 LYS CB 1 1 19 35360 1 1 104 LYS CD C -13.454 -1.528 -3.433 1.00 . A A . 104 LYS CD 1 1 19 35361 1 1 104 LYS CE C -14.121 -2.478 -2.437 1.00 . A A . 104 LYS CE 1 1 19 35362 1 1 104 LYS CG C -12.297 -2.217 -4.158 1.00 . A A . 104 LYS CG 1 1 19 35363 1 1 104 LYS H H -10.299 -1.969 -6.377 1.00 . A A . 104 LYS H 1 1 19 35364 1 1 104 LYS HA H -11.878 0.126 -5.252 1.00 . A A . 104 LYS HA 1 1 19 35365 1 1 104 LYS HB2 H -10.147 -2.058 -4.072 1.00 . A A . 104 LYS HB2 1 1 19 35366 1 1 104 LYS HB3 H -10.988 -0.878 -3.088 1.00 . A A . 104 LYS HB3 1 1 19 35367 1 1 104 LYS HD2 H -13.085 -0.646 -2.909 1.00 . A A . 104 LYS HD2 1 1 19 35368 1 1 104 LYS HD3 H -14.189 -1.183 -4.160 1.00 . A A . 104 LYS HD3 1 1 19 35369 1 1 104 LYS HE2 H -13.881 -3.510 -2.693 1.00 . A A . 104 LYS HE2 1 1 19 35370 1 1 104 LYS HE3 H -13.729 -2.299 -1.436 1.00 . A A . 104 LYS HE3 1 1 19 35371 1 1 104 LYS HG2 H -12.553 -2.358 -5.208 1.00 . A A . 104 LYS HG2 1 1 19 35372 1 1 104 LYS HG3 H -12.136 -3.208 -3.734 1.00 . A A . 104 LYS HG3 1 1 19 35373 1 1 104 LYS HZ1 H -16.077 -3.112 -2.776 1.00 . A A . 104 LYS HZ1 1 1 19 35374 1 1 104 LYS HZ2 H -15.949 -2.089 -1.516 1.00 . A A . 104 LYS HZ2 1 1 19 35375 1 1 104 LYS N N -10.681 -1.048 -6.451 1.00 . A A . 104 LYS N 1 1 19 35376 1 1 104 LYS NZ N -15.589 -2.288 -2.442 1.00 . A A . 104 LYS NZ 1 1 19 35377 1 1 104 LYS O O -10.080 1.713 -4.344 1.00 . A A . 104 LYS O 1 1 19 35378 1 1 105 CYS C C -7.679 2.404 -6.429 1.00 . A A . 105 CYS C 1 1 19 35379 1 1 105 CYS CA C -7.529 1.309 -5.371 1.00 . A A . 105 CYS CA 1 1 19 35380 1 1 105 CYS CB C -6.188 0.581 -5.489 1.00 . A A . 105 CYS CB 1 1 19 35381 1 1 105 CYS H H -8.456 -0.445 -6.005 1.00 . A A . 105 CYS H 1 1 19 35382 1 1 105 CYS HA H -7.581 1.731 -4.367 1.00 . A A . 105 CYS HA 1 1 19 35383 1 1 105 CYS HB2 H -6.094 0.134 -6.479 1.00 . A A . 105 CYS HB2 1 1 19 35384 1 1 105 CYS HB3 H -5.369 1.290 -5.381 1.00 . A A . 105 CYS HB3 1 1 19 35385 1 1 105 CYS N N -8.651 0.394 -5.498 1.00 . A A . 105 CYS N 1 1 19 35386 1 1 105 CYS O O -7.811 3.580 -6.095 1.00 . A A . 105 CYS O 1 1 19 35387 1 1 105 CYS SG S -6.065 -0.717 -4.205 1.00 . A A . 105 CYS SG 1 1 19 35388 1 1 106 HIS C C -9.210 2.844 -9.348 1.00 . A A . 106 HIS C 1 1 19 35389 1 1 106 HIS CA C -7.786 2.907 -8.792 1.00 . A A . 106 HIS CA 1 1 19 35390 1 1 106 HIS CB C -6.721 2.636 -9.857 1.00 . A A . 106 HIS CB 1 1 19 35391 1 1 106 HIS CD2 C -4.255 1.899 -9.405 1.00 . A A . 106 HIS CD2 1 1 19 35392 1 1 106 HIS CE1 C -3.565 3.718 -8.403 1.00 . A A . 106 HIS CE1 1 1 19 35393 1 1 106 HIS CG C -5.303 2.770 -9.356 1.00 . A A . 106 HIS CG 1 1 19 35394 1 1 106 HIS H H -7.547 1.018 -7.945 1.00 . A A . 106 HIS H 1 1 19 35395 1 1 106 HIS HA H -7.606 3.903 -8.388 1.00 . A A . 106 HIS HA 1 1 19 35396 1 1 106 HIS HB2 H -6.863 1.629 -10.250 1.00 . A A . 106 HIS HB2 1 1 19 35397 1 1 106 HIS HB3 H -6.869 3.326 -10.688 1.00 . A A . 106 HIS HB3 1 1 19 35398 1 1 106 HIS HD1 H -5.371 4.731 -8.529 1.00 . A A . 106 HIS HD1 1 1 19 35399 1 1 106 HIS HD2 H -4.275 0.901 -9.842 1.00 . A A . 106 HIS HD2 1 1 19 35400 1 1 106 HIS HE1 H -2.919 4.432 -7.892 1.00 . A A . 106 HIS HE1 1 1 19 35401 1 1 106 HIS N N -7.654 1.977 -7.683 1.00 . A A . 106 HIS N 1 1 19 35402 1 1 106 HIS ND1 N -4.838 3.907 -8.719 1.00 . A A . 106 HIS ND1 1 1 19 35403 1 1 106 HIS NE2 N -3.205 2.473 -8.829 1.00 . A A . 106 HIS NE2 1 1 19 35404 1 1 106 HIS O O -9.829 1.782 -9.361 1.00 . A A . 106 HIS O 1 1 19 35405 1 1 107 GLU C C -10.967 4.534 -11.811 1.00 . A A . 107 GLU C 1 1 19 35406 1 1 107 GLU CA C -11.028 4.087 -10.349 1.00 . A A . 107 GLU CA 1 1 19 35407 1 1 107 GLU CB C -11.902 5.032 -9.521 1.00 . A A . 107 GLU CB 1 1 19 35408 1 1 107 GLU CD C -12.378 7.447 -8.976 1.00 . A A . 107 GLU CD 1 1 19 35409 1 1 107 GLU CG C -11.380 6.468 -9.597 1.00 . A A . 107 GLU CG 1 1 19 35410 1 1 107 GLU H H -9.178 4.857 -9.780 1.00 . A A . 107 GLU H 1 1 19 35411 1 1 107 GLU HA H -11.435 3.078 -10.287 1.00 . A A . 107 GLU HA 1 1 19 35412 1 1 107 GLU HB2 H -12.929 4.995 -9.885 1.00 . A A . 107 GLU HB2 1 1 19 35413 1 1 107 GLU HB3 H -11.919 4.701 -8.483 1.00 . A A . 107 GLU HB3 1 1 19 35414 1 1 107 GLU HG2 H -10.424 6.539 -9.077 1.00 . A A . 107 GLU HG2 1 1 19 35415 1 1 107 GLU HG3 H -11.198 6.739 -10.637 1.00 . A A . 107 GLU HG3 1 1 19 35416 1 1 107 GLU N N -9.688 3.997 -9.793 1.00 . A A . 107 GLU N 1 1 19 35417 1 1 107 GLU O O -11.811 5.307 -12.262 1.00 . A A . 107 GLU O 1 1 19 35418 1 1 107 GLU OXT O -10.033 4.080 -12.505 1.00 . A A . 107 GLU OXT 1 1 19 35419 1 1 107 GLU OE1 O -13.372 7.758 -9.667 1.00 . A A . 107 GLU OE1 1 1 19 35420 1 1 107 GLU OE2 O -12.125 7.863 -7.825 1.00 . A A . 107 GLU OE2 1 1 19 35421 2 2 1 HEC C1A C -1.027 5.448 9.100 1.00 . B A . 108 HEC C1A 1 1 19 35422 2 2 1 HEC C1B C -1.934 2.346 11.968 1.00 . B A . 108 HEC C1B 1 1 19 35423 2 2 1 HEC C1C C -2.151 -0.558 8.711 1.00 . B A . 108 HEC C1C 1 1 19 35424 2 2 1 HEC C1D C -1.041 2.535 5.905 1.00 . B A . 108 HEC C1D 1 1 19 35425 2 2 1 HEC C2A C -0.853 6.517 10.054 1.00 . B A . 108 HEC C2A 1 1 19 35426 2 2 1 HEC C2B C -2.312 1.453 13.038 1.00 . B A . 108 HEC C2B 1 1 19 35427 2 2 1 HEC C2C C -2.208 -1.641 7.757 1.00 . B A . 108 HEC C2C 1 1 19 35428 2 2 1 HEC C2D C -0.657 3.443 4.851 1.00 . B A . 108 HEC C2D 1 1 19 35429 2 2 1 HEC C3A C -1.053 5.992 11.281 1.00 . B A . 108 HEC C3A 1 1 19 35430 2 2 1 HEC C3B C -2.533 0.242 12.484 1.00 . B A . 108 HEC C3B 1 1 19 35431 2 2 1 HEC C3C C -1.880 -1.128 6.553 1.00 . B A . 108 HEC C3C 1 1 19 35432 2 2 1 HEC C3D C -0.562 4.672 5.401 1.00 . B A . 108 HEC C3D 1 1 19 35433 2 2 1 HEC C4A C -1.353 4.591 11.099 1.00 . B A . 108 HEC C4A 1 1 19 35434 2 2 1 HEC C4B C -2.295 0.374 11.066 1.00 . B A . 108 HEC C4B 1 1 19 35435 2 2 1 HEC C4C C -1.616 0.278 6.749 1.00 . B A . 108 HEC C4C 1 1 19 35436 2 2 1 HEC C4D C -0.886 4.537 6.801 1.00 . B A . 108 HEC C4D 1 1 19 35437 2 2 1 HEC CAA C -0.512 7.936 9.701 1.00 . B A . 108 HEC CAA 1 1 19 35438 2 2 1 HEC CAB C -2.949 -1.026 13.171 1.00 . B A . 108 HEC CAB 1 1 19 35439 2 2 1 HEC CAC C -1.792 -1.842 5.236 1.00 . B A . 108 HEC CAC 1 1 19 35440 2 2 1 HEC CAD C -0.193 5.961 4.725 1.00 . B A . 108 HEC CAD 1 1 19 35441 2 2 1 HEC CBA C -1.396 8.534 8.611 1.00 . B A . 108 HEC CBA 1 1 19 35442 2 2 1 HEC CBB C -4.177 -0.875 14.064 1.00 . B A . 108 HEC CBB 1 1 19 35443 2 2 1 HEC CBC C -2.806 -2.971 5.074 1.00 . B A . 108 HEC CBC 1 1 19 35444 2 2 1 HEC CBD C -0.776 6.116 3.324 1.00 . B A . 108 HEC CBD 1 1 19 35445 2 2 1 HEC CGA C -2.171 9.736 9.131 1.00 . B A . 108 HEC CGA 1 1 19 35446 2 2 1 HEC CGD C 0.326 6.282 2.287 1.00 . B A . 108 HEC CGD 1 1 19 35447 2 2 1 HEC CHA C -0.900 5.600 7.723 1.00 . B A . 108 HEC CHA 1 1 19 35448 2 2 1 HEC CHB C -1.625 3.691 12.145 1.00 . B A . 108 HEC CHB 1 1 19 35449 2 2 1 HEC CHC C -2.421 -0.674 10.136 1.00 . B A . 108 HEC CHC 1 1 19 35450 2 2 1 HEC CHD C -1.240 1.169 5.728 1.00 . B A . 108 HEC CHD 1 1 19 35451 2 2 1 HEC CMA C -0.987 6.690 12.608 1.00 . B A . 108 HEC CMA 1 1 19 35452 2 2 1 HEC CMB C -2.424 1.843 14.483 1.00 . B A . 108 HEC CMB 1 1 19 35453 2 2 1 HEC CMC C -2.571 -3.060 8.089 1.00 . B A . 108 HEC CMC 1 1 19 35454 2 2 1 HEC CMD C -0.419 3.049 3.422 1.00 . B A . 108 HEC CMD 1 1 19 35455 2 2 1 HEC FE FE -1.557 2.444 8.924 1.00 . B A . 108 HEC FE 1 1 19 35456 2 2 1 HEC HAA1 H -0.620 8.566 10.584 1.00 . B A . 108 HEC HAA1 1 1 19 35457 2 2 1 HEC HAA2 H 0.516 7.985 9.344 1.00 . B A . 108 HEC HAA2 1 1 19 35458 2 2 1 HEC HAB H -3.185 -1.784 12.424 1.00 . B A . 108 HEC HAB 1 1 19 35459 2 2 1 HEC HAC H -1.967 -1.134 4.426 1.00 . B A . 108 HEC HAC 1 1 19 35460 2 2 1 HEC HAD1 H -0.556 6.799 5.319 1.00 . B A . 108 HEC HAD1 1 1 19 35461 2 2 1 HEC HAD2 H 0.891 6.025 4.631 1.00 . B A . 108 HEC HAD2 1 1 19 35462 2 2 1 HEC HBA1 H -0.775 8.855 7.774 1.00 . B A . 108 HEC HBA1 1 1 19 35463 2 2 1 HEC HBA2 H -2.108 7.783 8.267 1.00 . B A . 108 HEC HBA2 1 1 19 35464 2 2 1 HEC HBB1 H -4.382 0.183 14.224 1.00 . B A . 108 HEC HBB1 1 1 19 35465 2 2 1 HEC HBB2 H -5.036 -1.342 13.581 1.00 . B A . 108 HEC HBB2 1 1 19 35466 2 2 1 HEC HBB3 H -3.992 -1.359 15.022 1.00 . B A . 108 HEC HBB3 1 1 19 35467 2 2 1 HEC HBC1 H -3.716 -2.724 5.620 1.00 . B A . 108 HEC HBC1 1 1 19 35468 2 2 1 HEC HBC2 H -3.040 -3.101 4.017 1.00 . B A . 108 HEC HBC2 1 1 19 35469 2 2 1 HEC HBC3 H -2.386 -3.896 5.470 1.00 . B A . 108 HEC HBC3 1 1 19 35470 2 2 1 HEC HBD1 H -1.360 5.230 3.073 1.00 . B A . 108 HEC HBD1 1 1 19 35471 2 2 1 HEC HBD2 H -1.419 6.996 3.293 1.00 . B A . 108 HEC HBD2 1 1 19 35472 2 2 1 HEC HHA H -0.804 6.610 7.326 1.00 . B A . 108 HEC HHA 1 1 19 35473 2 2 1 HEC HHB H -1.590 4.078 13.163 1.00 . B A . 108 HEC HHB 1 1 19 35474 2 2 1 HEC HHC H -2.731 -1.648 10.514 1.00 . B A . 108 HEC HHC 1 1 19 35475 2 2 1 HEC HHD H -1.095 0.757 4.729 1.00 . B A . 108 HEC HHD 1 1 19 35476 2 2 1 HEC HMA1 H 0.024 6.614 13.009 1.00 . B A . 108 HEC HMA1 1 1 19 35477 2 2 1 HEC HMA2 H -1.248 7.741 12.479 1.00 . B A . 108 HEC HMA2 1 1 19 35478 2 2 1 HEC HMA3 H -1.689 6.224 13.299 1.00 . B A . 108 HEC HMA3 1 1 19 35479 2 2 1 HEC HMB1 H -1.476 2.261 14.821 1.00 . B A . 108 HEC HMB1 1 1 19 35480 2 2 1 HEC HMB2 H -3.212 2.587 14.598 1.00 . B A . 108 HEC HMB2 1 1 19 35481 2 2 1 HEC HMB3 H -2.666 0.962 15.079 1.00 . B A . 108 HEC HMB3 1 1 19 35482 2 2 1 HEC HMC1 H -3.538 -3.300 7.648 1.00 . B A . 108 HEC HMC1 1 1 19 35483 2 2 1 HEC HMC2 H -1.812 -3.732 7.689 1.00 . B A . 108 HEC HMC2 1 1 19 35484 2 2 1 HEC HMC3 H -2.627 -3.177 9.171 1.00 . B A . 108 HEC HMC3 1 1 19 35485 2 2 1 HEC HMD1 H -1.373 2.842 2.938 1.00 . B A . 108 HEC HMD1 1 1 19 35486 2 2 1 HEC HMD2 H 0.085 3.863 2.900 1.00 . B A . 108 HEC HMD2 1 1 19 35487 2 2 1 HEC HMD3 H 0.206 2.156 3.391 1.00 . B A . 108 HEC HMD3 1 1 19 35488 2 2 1 HEC NA N -1.335 4.267 9.753 1.00 . B A . 108 HEC NA 1 1 19 35489 2 2 1 HEC NB N -1.927 1.672 10.760 1.00 . B A . 108 HEC NB 1 1 19 35490 2 2 1 HEC NC N -1.786 0.618 8.080 1.00 . B A . 108 HEC NC 1 1 19 35491 2 2 1 HEC ND N -1.179 3.218 7.101 1.00 . B A . 108 HEC ND 1 1 19 35492 2 2 1 HEC O1A O -2.486 9.728 10.341 1.00 . B A . 108 HEC O1A 1 1 19 35493 2 2 1 HEC O1D O 1.351 5.583 2.432 1.00 . B A . 108 HEC O1D 1 1 19 35494 2 2 1 HEC O2A O -2.434 10.641 8.310 1.00 . B A . 108 HEC O2A 1 1 19 35495 2 2 1 HEC O2D O 0.121 7.105 1.369 1.00 . B A . 108 HEC O2D 1 1 19 35496 3 2 1 HEC C1A C 9.634 -1.810 1.797 1.00 . C A . 109 HEC C1A 1 1 19 35497 3 2 1 HEC C1B C 5.800 -0.086 2.797 1.00 . C A . 109 HEC C1B 1 1 19 35498 3 2 1 HEC C1C C 7.837 2.960 5.198 1.00 . C A . 109 HEC C1C 1 1 19 35499 3 2 1 HEC C1D C 11.646 1.374 3.915 1.00 . C A . 109 HEC C1D 1 1 19 35500 3 2 1 HEC C2A C 9.127 -2.887 0.979 1.00 . C A . 109 HEC C2A 1 1 19 35501 3 2 1 HEC C2B C 4.445 0.284 3.133 1.00 . C A . 109 HEC C2B 1 1 19 35502 3 2 1 HEC C2C C 8.359 4.106 5.904 1.00 . C A . 109 HEC C2C 1 1 19 35503 3 2 1 HEC C2D C 12.994 0.926 3.654 1.00 . C A . 109 HEC C2D 1 1 19 35504 3 2 1 HEC C3A C 7.784 -2.758 0.941 1.00 . C A . 109 HEC C3A 1 1 19 35505 3 2 1 HEC C3B C 4.518 1.334 3.978 1.00 . C A . 109 HEC C3B 1 1 19 35506 3 2 1 HEC C3C C 9.701 4.077 5.772 1.00 . C A . 109 HEC C3C 1 1 19 35507 3 2 1 HEC C3D C 12.901 -0.220 2.948 1.00 . C A . 109 HEC C3D 1 1 19 35508 3 2 1 HEC C4A C 7.446 -1.600 1.735 1.00 . C A . 109 HEC C4A 1 1 19 35509 3 2 1 HEC C4B C 5.919 1.624 4.175 1.00 . C A . 109 HEC C4B 1 1 19 35510 3 2 1 HEC C4C C 10.025 2.912 4.982 1.00 . C A . 109 HEC C4C 1 1 19 35511 3 2 1 HEC C4D C 11.495 -0.493 2.764 1.00 . C A . 109 HEC C4D 1 1 19 35512 3 2 1 HEC CAA C 9.975 -3.932 0.314 1.00 . C A . 109 HEC CAA 1 1 19 35513 3 2 1 HEC CAB C 3.387 2.086 4.617 1.00 . C A . 109 HEC CAB 1 1 19 35514 3 2 1 HEC CAC C 10.706 5.047 6.323 1.00 . C A . 109 HEC CAC 1 1 19 35515 3 2 1 HEC CAD C 14.018 -1.080 2.431 1.00 . C A . 109 HEC CAD 1 1 19 35516 3 2 1 HEC CBA C 10.262 -3.654 -1.159 1.00 . C A . 109 HEC CBA 1 1 19 35517 3 2 1 HEC CBB C 2.321 1.191 5.243 1.00 . C A . 109 HEC CBB 1 1 19 35518 3 2 1 HEC CBC C 10.696 5.153 7.845 1.00 . C A . 109 HEC CBC 1 1 19 35519 3 2 1 HEC CBD C 15.194 -1.215 3.393 1.00 . C A . 109 HEC CBD 1 1 19 35520 3 2 1 HEC CGA C 11.185 -4.713 -1.746 1.00 . C A . 109 HEC CGA 1 1 19 35521 3 2 1 HEC CGD C 16.451 -0.580 2.815 1.00 . C A . 109 HEC CGD 1 1 19 35522 3 2 1 HEC CHA C 10.982 -1.606 2.073 1.00 . C A . 109 HEC CHA 1 1 19 35523 3 2 1 HEC CHB C 6.137 -1.131 1.944 1.00 . C A . 109 HEC CHB 1 1 19 35524 3 2 1 HEC CHC C 6.412 2.655 4.995 1.00 . C A . 109 HEC CHC 1 1 19 35525 3 2 1 HEC CHD C 11.330 2.530 4.622 1.00 . C A . 109 HEC CHD 1 1 19 35526 3 2 1 HEC CMA C 6.793 -3.627 0.224 1.00 . C A . 109 HEC CMA 1 1 19 35527 3 2 1 HEC CMB C 3.214 -0.400 2.613 1.00 . C A . 109 HEC CMB 1 1 19 35528 3 2 1 HEC CMC C 7.524 5.117 6.636 1.00 . C A . 109 HEC CMC 1 1 19 35529 3 2 1 HEC CMD C 14.238 1.635 4.105 1.00 . C A . 109 HEC CMD 1 1 19 35530 3 2 1 HEC FE FE 8.723 0.612 3.424 1.00 . C A . 109 HEC FE 1 1 19 35531 3 2 1 HEC HAA1 H 10.936 -3.998 0.823 1.00 . C A . 109 HEC HAA1 1 1 19 35532 3 2 1 HEC HAA2 H 9.469 -4.897 0.366 1.00 . C A . 109 HEC HAA2 1 1 19 35533 3 2 1 HEC HAB H 3.777 2.724 5.410 1.00 . C A . 109 HEC HAB 1 1 19 35534 3 2 1 HEC HAC H 11.709 4.738 6.028 1.00 . C A . 109 HEC HAC 1 1 19 35535 3 2 1 HEC HAD1 H 13.643 -2.086 2.239 1.00 . C A . 109 HEC HAD1 1 1 19 35536 3 2 1 HEC HAD2 H 14.406 -0.654 1.506 1.00 . C A . 109 HEC HAD2 1 1 19 35537 3 2 1 HEC HBA1 H 9.327 -3.658 -1.718 1.00 . C A . 109 HEC HBA1 1 1 19 35538 3 2 1 HEC HBA2 H 10.741 -2.680 -1.258 1.00 . C A . 109 HEC HBA2 1 1 19 35539 3 2 1 HEC HBB1 H 2.763 0.230 5.507 1.00 . C A . 109 HEC HBB1 1 1 19 35540 3 2 1 HEC HBB2 H 1.927 1.669 6.140 1.00 . C A . 109 HEC HBB2 1 1 19 35541 3 2 1 HEC HBB3 H 1.512 1.036 4.528 1.00 . C A . 109 HEC HBB3 1 1 19 35542 3 2 1 HEC HBC1 H 9.676 5.318 8.191 1.00 . C A . 109 HEC HBC1 1 1 19 35543 3 2 1 HEC HBC2 H 11.081 4.229 8.276 1.00 . C A . 109 HEC HBC2 1 1 19 35544 3 2 1 HEC HBC3 H 11.325 5.988 8.155 1.00 . C A . 109 HEC HBC3 1 1 19 35545 3 2 1 HEC HBD1 H 14.953 -0.718 4.333 1.00 . C A . 109 HEC HBD1 1 1 19 35546 3 2 1 HEC HBD2 H 15.392 -2.270 3.581 1.00 . C A . 109 HEC HBD2 1 1 19 35547 3 2 1 HEC HHA H 11.694 -2.358 1.732 1.00 . C A . 109 HEC HHA 1 1 19 35548 3 2 1 HEC HHB H 5.333 -1.624 1.396 1.00 . C A . 109 HEC HHB 1 1 19 35549 3 2 1 HEC HHC H 5.683 3.271 5.521 1.00 . C A . 109 HEC HHC 1 1 19 35550 3 2 1 HEC HHD H 12.147 3.187 4.920 1.00 . C A . 109 HEC HHD 1 1 19 35551 3 2 1 HEC HMA1 H 7.324 -4.375 -0.364 1.00 . C A . 109 HEC HMA1 1 1 19 35552 3 2 1 HEC HMA2 H 6.153 -4.125 0.953 1.00 . C A . 109 HEC HMA2 1 1 19 35553 3 2 1 HEC HMA3 H 6.181 -3.013 -0.436 1.00 . C A . 109 HEC HMA3 1 1 19 35554 3 2 1 HEC HMB1 H 3.351 -0.642 1.559 1.00 . C A . 109 HEC HMB1 1 1 19 35555 3 2 1 HEC HMB2 H 3.043 -1.317 3.177 1.00 . C A . 109 HEC HMB2 1 1 19 35556 3 2 1 HEC HMB3 H 2.356 0.262 2.725 1.00 . C A . 109 HEC HMB3 1 1 19 35557 3 2 1 HEC HMC1 H 7.090 4.656 7.523 1.00 . C A . 109 HEC HMC1 1 1 19 35558 3 2 1 HEC HMC2 H 8.150 5.958 6.933 1.00 . C A . 109 HEC HMC2 1 1 19 35559 3 2 1 HEC HMC3 H 6.726 5.470 5.983 1.00 . C A . 109 HEC HMC3 1 1 19 35560 3 2 1 HEC HMD1 H 14.002 2.676 4.328 1.00 . C A . 109 HEC HMD1 1 1 19 35561 3 2 1 HEC HMD2 H 14.628 1.151 5.001 1.00 . C A . 109 HEC HMD2 1 1 19 35562 3 2 1 HEC HMD3 H 14.987 1.594 3.314 1.00 . C A . 109 HEC HMD3 1 1 19 35563 3 2 1 HEC NA N 8.592 -1.025 2.257 1.00 . C A . 109 HEC NA 1 1 19 35564 3 2 1 HEC NB N 6.699 0.745 3.444 1.00 . C A . 109 HEC NB 1 1 19 35565 3 2 1 HEC NC N 8.870 2.232 4.634 1.00 . C A . 109 HEC NC 1 1 19 35566 3 2 1 HEC ND N 10.732 0.494 3.363 1.00 . C A . 109 HEC ND 1 1 19 35567 3 2 1 HEC O1A O 11.354 -5.753 -1.075 1.00 . C A . 109 HEC O1A 1 1 19 35568 3 2 1 HEC O1D O 16.291 0.368 2.015 1.00 . C A . 109 HEC O1D 1 1 19 35569 3 2 1 HEC O2A O 11.703 -4.461 -2.855 1.00 . C A . 109 HEC O2A 1 1 19 35570 3 2 1 HEC O2D O 17.547 -1.053 3.184 1.00 . C A . 109 HEC O2D 1 1 19 35571 4 2 1 HEC C1A C -8.676 -3.312 0.412 1.00 . D A . 110 HEC C1A 1 1 19 35572 4 2 1 HEC C1B C -4.937 -1.169 0.095 1.00 . D A . 110 HEC C1B 1 1 19 35573 4 2 1 HEC C1C C -2.898 -4.443 2.056 1.00 . D A . 110 HEC C1C 1 1 19 35574 4 2 1 HEC C1D C -6.644 -6.569 2.396 1.00 . D A . 110 HEC C1D 1 1 19 35575 4 2 1 HEC C2A C -9.490 -2.340 -0.280 1.00 . D A . 110 HEC C2A 1 1 19 35576 4 2 1 HEC C2B C -3.771 -0.344 -0.117 1.00 . D A . 110 HEC C2B 1 1 19 35577 4 2 1 HEC C2C C -2.066 -5.467 2.641 1.00 . D A . 110 HEC C2C 1 1 19 35578 4 2 1 HEC C2D C -7.814 -7.381 2.634 1.00 . D A . 110 HEC C2D 1 1 19 35579 4 2 1 HEC C3A C -8.675 -1.327 -0.643 1.00 . D A . 110 HEC C3A 1 1 19 35580 4 2 1 HEC C3B C -2.729 -0.972 0.468 1.00 . D A . 110 HEC C3B 1 1 19 35581 4 2 1 HEC C3C C -2.876 -6.495 2.973 1.00 . D A . 110 HEC C3C 1 1 19 35582 4 2 1 HEC C3D C -8.871 -6.713 2.125 1.00 . D A . 110 HEC C3D 1 1 19 35583 4 2 1 HEC C4A C -7.349 -1.662 -0.179 1.00 . D A . 110 HEC C4A 1 1 19 35584 4 2 1 HEC C4B C -3.240 -2.191 1.048 1.00 . D A . 110 HEC C4B 1 1 19 35585 4 2 1 HEC C4C C -4.218 -6.117 2.596 1.00 . D A . 110 HEC C4C 1 1 19 35586 4 2 1 HEC C4D C -8.366 -5.481 1.568 1.00 . D A . 110 HEC C4D 1 1 19 35587 4 2 1 HEC CAA C -10.964 -2.474 -0.526 1.00 . D A . 110 HEC CAA 1 1 19 35588 4 2 1 HEC CAB C -1.298 -0.526 0.529 1.00 . D A . 110 HEC CAB 1 1 19 35589 4 2 1 HEC CAC C -2.499 -7.799 3.612 1.00 . D A . 110 HEC CAC 1 1 19 35590 4 2 1 HEC CAD C -10.313 -7.132 2.118 1.00 . D A . 110 HEC CAD 1 1 19 35591 4 2 1 HEC CBA C -11.833 -1.760 0.505 1.00 . D A . 110 HEC CBA 1 1 19 35592 4 2 1 HEC CBB C -1.117 0.925 0.967 1.00 . D A . 110 HEC CBB 1 1 19 35593 4 2 1 HEC CBC C -1.207 -7.743 4.422 1.00 . D A . 110 HEC CBC 1 1 19 35594 4 2 1 HEC CBD C -10.885 -7.362 0.723 1.00 . D A . 110 HEC CBD 1 1 19 35595 4 2 1 HEC CGA C -12.942 -2.671 1.013 1.00 . D A . 110 HEC CGA 1 1 19 35596 4 2 1 HEC CGD C -11.563 -8.721 0.626 1.00 . D A . 110 HEC CGD 1 1 19 35597 4 2 1 HEC CHA C -9.161 -4.504 0.941 1.00 . D A . 110 HEC CHA 1 1 19 35598 4 2 1 HEC CHB C -6.212 -0.854 -0.364 1.00 . D A . 110 HEC CHB 1 1 19 35599 4 2 1 HEC CHC C -2.460 -3.128 1.751 1.00 . D A . 110 HEC CHC 1 1 19 35600 4 2 1 HEC CHD C -5.355 -6.924 2.779 1.00 . D A . 110 HEC CHD 1 1 19 35601 4 2 1 HEC CMA C -9.034 -0.073 -1.386 1.00 . D A . 110 HEC CMA 1 1 19 35602 4 2 1 HEC CMB C -3.766 0.961 -0.858 1.00 . D A . 110 HEC CMB 1 1 19 35603 4 2 1 HEC CMC C -0.580 -5.365 2.826 1.00 . D A . 110 HEC CMC 1 1 19 35604 4 2 1 HEC CMD C -7.809 -8.715 3.323 1.00 . D A . 110 HEC CMD 1 1 19 35605 4 2 1 HEC FE FE -5.794 -3.860 1.263 1.00 . D A . 110 HEC FE 1 1 19 35606 4 2 1 HEC HAA1 H -11.209 -2.053 -1.501 1.00 . D A . 110 HEC HAA1 1 1 19 35607 4 2 1 HEC HAA2 H -11.242 -3.528 -0.506 1.00 . D A . 110 HEC HAA2 1 1 19 35608 4 2 1 HEC HAB H -0.753 -1.147 1.240 1.00 . D A . 110 HEC HAB 1 1 19 35609 4 2 1 HEC HAC H -3.292 -8.113 4.292 1.00 . D A . 110 HEC HAC 1 1 19 35610 4 2 1 HEC HAD1 H -10.422 -8.066 2.669 1.00 . D A . 110 HEC HAD1 1 1 19 35611 4 2 1 HEC HAD2 H -10.918 -6.358 2.591 1.00 . D A . 110 HEC HAD2 1 1 19 35612 4 2 1 HEC HBA1 H -11.217 -1.455 1.351 1.00 . D A . 110 HEC HBA1 1 1 19 35613 4 2 1 HEC HBA2 H -12.287 -0.879 0.050 1.00 . D A . 110 HEC HBA2 1 1 19 35614 4 2 1 HEC HBB1 H -0.920 1.546 0.094 1.00 . D A . 110 HEC HBB1 1 1 19 35615 4 2 1 HEC HBB2 H -2.025 1.270 1.461 1.00 . D A . 110 HEC HBB2 1 1 19 35616 4 2 1 HEC HBB3 H -0.278 0.994 1.659 1.00 . D A . 110 HEC HBB3 1 1 19 35617 4 2 1 HEC HBC1 H -1.225 -8.517 5.189 1.00 . D A . 110 HEC HBC1 1 1 19 35618 4 2 1 HEC HBC2 H -0.356 -7.906 3.761 1.00 . D A . 110 HEC HBC2 1 1 19 35619 4 2 1 HEC HBC3 H -1.117 -6.765 4.896 1.00 . D A . 110 HEC HBC3 1 1 19 35620 4 2 1 HEC HBD1 H -11.621 -6.589 0.500 1.00 . D A . 110 HEC HBD1 1 1 19 35621 4 2 1 HEC HBD2 H -10.081 -7.320 -0.012 1.00 . D A . 110 HEC HBD2 1 1 19 35622 4 2 1 HEC HHA H -10.231 -4.699 0.866 1.00 . D A . 110 HEC HHA 1 1 19 35623 4 2 1 HEC HHB H -6.344 0.084 -0.904 1.00 . D A . 110 HEC HHB 1 1 19 35624 4 2 1 HEC HHC H -1.461 -2.819 2.060 1.00 . D A . 110 HEC HHC 1 1 19 35625 4 2 1 HEC HHD H -5.211 -7.895 3.254 1.00 . D A . 110 HEC HHD 1 1 19 35626 4 2 1 HEC HMA1 H -8.661 0.793 -0.840 1.00 . D A . 110 HEC HMA1 1 1 19 35627 4 2 1 HEC HMA2 H -8.585 -0.099 -2.379 1.00 . D A . 110 HEC HMA2 1 1 19 35628 4 2 1 HEC HMA3 H -10.118 -0.004 -1.479 1.00 . D A . 110 HEC HMA3 1 1 19 35629 4 2 1 HEC HMB1 H -4.658 1.029 -1.481 1.00 . D A . 110 HEC HMB1 1 1 19 35630 4 2 1 HEC HMB2 H -3.759 1.784 -0.143 1.00 . D A . 110 HEC HMB2 1 1 19 35631 4 2 1 HEC HMB3 H -2.878 1.019 -1.487 1.00 . D A . 110 HEC HMB3 1 1 19 35632 4 2 1 HEC HMC1 H -0.187 -4.579 2.181 1.00 . D A . 110 HEC HMC1 1 1 19 35633 4 2 1 HEC HMC2 H -0.359 -5.125 3.867 1.00 . D A . 110 HEC HMC2 1 1 19 35634 4 2 1 HEC HMC3 H -0.115 -6.315 2.566 1.00 . D A . 110 HEC HMC3 1 1 19 35635 4 2 1 HEC HMD1 H -6.937 -9.285 3.003 1.00 . D A . 110 HEC HMD1 1 1 19 35636 4 2 1 HEC HMD2 H -7.769 -8.566 4.402 1.00 . D A . 110 HEC HMD2 1 1 19 35637 4 2 1 HEC HMD3 H -8.716 -9.261 3.064 1.00 . D A . 110 HEC HMD3 1 1 19 35638 4 2 1 HEC NA N -7.361 -2.885 0.468 1.00 . D A . 110 HEC NA 1 1 19 35639 4 2 1 HEC NB N -4.600 -2.303 0.813 1.00 . D A . 110 HEC NB 1 1 19 35640 4 2 1 HEC NC N -4.220 -4.852 2.033 1.00 . D A . 110 HEC NC 1 1 19 35641 4 2 1 HEC ND N -6.995 -5.402 1.739 1.00 . D A . 110 HEC ND 1 1 19 35642 4 2 1 HEC O1A O -12.640 -3.864 1.230 1.00 . D A . 110 HEC O1A 1 1 19 35643 4 2 1 HEC O1D O -10.825 -9.711 0.436 1.00 . D A . 110 HEC O1D 1 1 19 35644 4 2 1 HEC O2A O -14.070 -2.157 1.174 1.00 . D A . 110 HEC O2A 1 1 19 35645 4 2 1 HEC O2D O -12.807 -8.744 0.743 1.00 . D A . 110 HEC O2D 1 1 19 35646 5 2 1 HEC C1A C 0.056 4.104 -9.111 1.00 . E A . 111 HEC C1A 1 1 19 35647 5 2 1 HEC C1B C -1.289 0.706 -11.419 1.00 . E A . 111 HEC C1B 1 1 19 35648 5 2 1 HEC C1C C -3.076 -0.997 -7.839 1.00 . E A . 111 HEC C1C 1 1 19 35649 5 2 1 HEC C1D C -1.722 2.411 -5.555 1.00 . E A . 111 HEC C1D 1 1 19 35650 5 2 1 HEC C2A C 0.667 4.820 -10.206 1.00 . E A . 111 HEC C2A 1 1 19 35651 5 2 1 HEC C2B C -1.455 -0.440 -12.282 1.00 . E A . 111 HEC C2B 1 1 19 35652 5 2 1 HEC C2C C -3.828 -1.626 -6.779 1.00 . E A . 111 HEC C2C 1 1 19 35653 5 2 1 HEC C2D C -1.232 3.405 -4.629 1.00 . E A . 111 HEC C2D 1 1 19 35654 5 2 1 HEC C3A C 0.459 4.090 -11.322 1.00 . E A . 111 HEC C3A 1 1 19 35655 5 2 1 HEC C3B C -2.063 -1.400 -11.553 1.00 . E A . 111 HEC C3B 1 1 19 35656 5 2 1 HEC C3C C -3.701 -0.845 -5.685 1.00 . E A . 111 HEC C3C 1 1 19 35657 5 2 1 HEC C3D C -0.522 4.301 -5.347 1.00 . E A . 111 HEC C3D 1 1 19 35658 5 2 1 HEC C4A C -0.283 2.916 -10.930 1.00 . E A . 111 HEC C4A 1 1 19 35659 5 2 1 HEC C4B C -2.279 -0.858 -10.232 1.00 . E A . 111 HEC C4B 1 1 19 35660 5 2 1 HEC C4C C -2.869 0.275 -6.058 1.00 . E A . 111 HEC C4C 1 1 19 35661 5 2 1 HEC C4D C -0.565 3.870 -6.725 1.00 . E A . 111 HEC C4D 1 1 19 35662 5 2 1 HEC CAA C 1.390 6.129 -10.079 1.00 . E A . 111 HEC CAA 1 1 19 35663 5 2 1 HEC CAB C -2.458 -2.780 -11.990 1.00 . E A . 111 HEC CAB 1 1 19 35664 5 2 1 HEC CAC C -4.292 -1.060 -4.322 1.00 . E A . 111 HEC CAC 1 1 19 35665 5 2 1 HEC CAD C 0.192 5.524 -4.852 1.00 . E A . 111 HEC CAD 1 1 19 35666 5 2 1 HEC CBA C 2.764 6.147 -10.743 1.00 . E A . 111 HEC CBA 1 1 19 35667 5 2 1 HEC CBB C -1.384 -3.838 -11.753 1.00 . E A . 111 HEC CBB 1 1 19 35668 5 2 1 HEC CBC C -4.153 -2.489 -3.803 1.00 . E A . 111 HEC CBC 1 1 19 35669 5 2 1 HEC CBD C -0.738 6.664 -4.445 1.00 . E A . 111 HEC CBD 1 1 19 35670 5 2 1 HEC CGA C 3.019 7.476 -11.439 1.00 . E A . 111 HEC CGA 1 1 19 35671 5 2 1 HEC CGD C 0.004 7.993 -4.417 1.00 . E A . 111 HEC CGD 1 1 19 35672 5 2 1 HEC CHA C 0.060 4.543 -7.791 1.00 . E A . 111 HEC CHA 1 1 19 35673 5 2 1 HEC CHB C -0.697 1.902 -11.813 1.00 . E A . 111 HEC CHB 1 1 19 35674 5 2 1 HEC CHC C -2.891 -1.555 -9.175 1.00 . E A . 111 HEC CHC 1 1 19 35675 5 2 1 HEC CHD C -2.501 1.318 -5.189 1.00 . E A . 111 HEC CHD 1 1 19 35676 5 2 1 HEC CMA C 0.897 4.401 -12.724 1.00 . E A . 111 HEC CMA 1 1 19 35677 5 2 1 HEC CMB C -1.018 -0.506 -13.716 1.00 . E A . 111 HEC CMB 1 1 19 35678 5 2 1 HEC CMC C -4.594 -2.910 -6.914 1.00 . E A . 111 HEC CMC 1 1 19 35679 5 2 1 HEC CMD C -1.491 3.403 -3.151 1.00 . E A . 111 HEC CMD 1 1 19 35680 5 2 1 HEC FE FE -1.530 1.562 -8.489 1.00 . E A . 111 HEC FE 1 1 19 35681 5 2 1 HEC HAA1 H 0.798 6.918 -10.543 1.00 . E A . 111 HEC HAA1 1 1 19 35682 5 2 1 HEC HAA2 H 1.540 6.361 -9.024 1.00 . E A . 111 HEC HAA2 1 1 19 35683 5 2 1 HEC HAB H -3.346 -3.095 -11.442 1.00 . E A . 111 HEC HAB 1 1 19 35684 5 2 1 HEC HAC H -3.797 -0.407 -3.604 1.00 . E A . 111 HEC HAC 1 1 19 35685 5 2 1 HEC HAD1 H 0.789 5.267 -3.977 1.00 . E A . 111 HEC HAD1 1 1 19 35686 5 2 1 HEC HAD2 H 0.845 5.907 -5.637 1.00 . E A . 111 HEC HAD2 1 1 19 35687 5 2 1 HEC HBA1 H 3.535 5.996 -9.987 1.00 . E A . 111 HEC HBA1 1 1 19 35688 5 2 1 HEC HBA2 H 2.820 5.349 -11.483 1.00 . E A . 111 HEC HBA2 1 1 19 35689 5 2 1 HEC HBB1 H -1.324 -4.496 -12.619 1.00 . E A . 111 HEC HBB1 1 1 19 35690 5 2 1 HEC HBB2 H -0.421 -3.350 -11.599 1.00 . E A . 111 HEC HBB2 1 1 19 35691 5 2 1 HEC HBB3 H -1.640 -4.423 -10.869 1.00 . E A . 111 HEC HBB3 1 1 19 35692 5 2 1 HEC HBC1 H -4.075 -2.474 -2.716 1.00 . E A . 111 HEC HBC1 1 1 19 35693 5 2 1 HEC HBC2 H -5.027 -3.069 -4.098 1.00 . E A . 111 HEC HBC2 1 1 19 35694 5 2 1 HEC HBC3 H -3.256 -2.942 -4.226 1.00 . E A . 111 HEC HBC3 1 1 19 35695 5 2 1 HEC HBD1 H -1.557 6.737 -5.159 1.00 . E A . 111 HEC HBD1 1 1 19 35696 5 2 1 HEC HBD2 H -1.138 6.468 -3.450 1.00 . E A . 111 HEC HBD2 1 1 19 35697 5 2 1 HEC HHA H 0.582 5.471 -7.562 1.00 . E A . 111 HEC HHA 1 1 19 35698 5 2 1 HEC HHB H -0.541 2.069 -12.879 1.00 . E A . 111 HEC HHB 1 1 19 35699 5 2 1 HEC HHC H -3.238 -2.568 -9.375 1.00 . E A . 111 HEC HHC 1 1 19 35700 5 2 1 HEC HHD H -2.852 1.262 -4.159 1.00 . E A . 111 HEC HHD 1 1 19 35701 5 2 1 HEC HMA1 H 0.189 3.969 -13.430 1.00 . E A . 111 HEC HMA1 1 1 19 35702 5 2 1 HEC HMA2 H 0.935 5.482 -12.862 1.00 . E A . 111 HEC HMA2 1 1 19 35703 5 2 1 HEC HMA3 H 1.887 3.978 -12.898 1.00 . E A . 111 HEC HMA3 1 1 19 35704 5 2 1 HEC HMB1 H -1.895 -0.551 -14.362 1.00 . E A . 111 HEC HMB1 1 1 19 35705 5 2 1 HEC HMB2 H -0.434 0.382 -13.959 1.00 . E A . 111 HEC HMB2 1 1 19 35706 5 2 1 HEC HMB3 H -0.407 -1.395 -13.869 1.00 . E A . 111 HEC HMB3 1 1 19 35707 5 2 1 HEC HMC1 H -4.229 -3.629 -6.180 1.00 . E A . 111 HEC HMC1 1 1 19 35708 5 2 1 HEC HMC2 H -5.653 -2.721 -6.742 1.00 . E A . 111 HEC HMC2 1 1 19 35709 5 2 1 HEC HMC3 H -4.454 -3.313 -7.917 1.00 . E A . 111 HEC HMC3 1 1 19 35710 5 2 1 HEC HMD1 H -2.321 2.733 -2.928 1.00 . E A . 111 HEC HMD1 1 1 19 35711 5 2 1 HEC HMD2 H -0.598 3.062 -2.626 1.00 . E A . 111 HEC HMD2 1 1 19 35712 5 2 1 HEC HMD3 H -1.741 4.412 -2.824 1.00 . E A . 111 HEC HMD3 1 1 19 35713 5 2 1 HEC NA N -0.526 2.934 -9.568 1.00 . E A . 111 HEC NA 1 1 19 35714 5 2 1 HEC NB N -1.799 0.438 -10.161 1.00 . E A . 111 HEC NB 1 1 19 35715 5 2 1 HEC NC N -2.490 0.171 -7.385 1.00 . E A . 111 HEC NC 1 1 19 35716 5 2 1 HEC ND N -1.306 2.707 -6.841 1.00 . E A . 111 HEC ND 1 1 19 35717 5 2 1 HEC O1A O 3.809 8.267 -10.880 1.00 . E A . 111 HEC O1A 1 1 19 35718 5 2 1 HEC O1D O 0.812 8.173 -3.480 1.00 . E A . 111 HEC O1D 1 1 19 35719 5 2 1 HEC O2A O 2.420 7.675 -12.518 1.00 . E A . 111 HEC O2A 1 1 19 35720 5 2 1 HEC O2D O -0.251 8.804 -5.334 1.00 . E A . 111 HEC O2D 1 1 20 35721 1 1 1 ALA C C -0.426 3.387 20.024 1.00 . A A . 1 ALA C 1 1 20 35722 1 1 1 ALA CA C 1.018 2.883 20.006 1.00 . A A . 1 ALA CA 1 1 20 35723 1 1 1 ALA CB C 1.104 1.357 20.076 1.00 . A A . 1 ALA CB 1 1 20 35724 1 1 1 ALA H1 H 2.259 2.732 21.606 1.00 . A A . 1 ALA H1 1 1 20 35725 1 1 1 ALA H2 H 2.389 4.164 20.783 1.00 . A A . 1 ALA H2 1 1 20 35726 1 1 1 ALA HA H 1.501 3.220 19.088 1.00 . A A . 1 ALA HA 1 1 20 35727 1 1 1 ALA HB1 H 1.523 1.060 21.037 1.00 . A A . 1 ALA HB1 1 1 20 35728 1 1 1 ALA HB2 H 0.106 0.932 19.967 1.00 . A A . 1 ALA HB2 1 1 20 35729 1 1 1 ALA HB3 H 1.744 0.992 19.272 1.00 . A A . 1 ALA HB3 1 1 20 35730 1 1 1 ALA N N 1.743 3.461 21.125 1.00 . A A . 1 ALA N 1 1 20 35731 1 1 1 ALA O O -1.274 2.829 20.718 1.00 . A A . 1 ALA O 1 1 20 35732 1 1 2 PRO C C -2.928 4.180 18.307 1.00 . A A . 2 PRO C 1 1 20 35733 1 1 2 PRO CA C -1.995 5.052 19.149 1.00 . A A . 2 PRO CA 1 1 20 35734 1 1 2 PRO CB C -1.778 6.435 18.557 1.00 . A A . 2 PRO CB 1 1 20 35735 1 1 2 PRO CD C 0.312 5.153 18.395 1.00 . A A . 2 PRO CD 1 1 20 35736 1 1 2 PRO CG C -0.408 6.397 17.900 1.00 . A A . 2 PRO CG 1 1 20 35737 1 1 2 PRO HA H -2.410 5.098 20.058 1.00 . A A . 2 PRO HA 1 1 20 35738 1 1 2 PRO HB2 H -2.554 6.674 17.829 1.00 . A A . 2 PRO HB2 1 1 20 35739 1 1 2 PRO HB3 H -1.820 7.202 19.331 1.00 . A A . 2 PRO HB3 1 1 20 35740 1 1 2 PRO HD2 H 0.634 4.525 17.565 1.00 . A A . 2 PRO HD2 1 1 20 35741 1 1 2 PRO HD3 H 1.205 5.412 18.964 1.00 . A A . 2 PRO HD3 1 1 20 35742 1 1 2 PRO HG2 H -0.506 6.376 16.815 1.00 . A A . 2 PRO HG2 1 1 20 35743 1 1 2 PRO HG3 H 0.160 7.293 18.152 1.00 . A A . 2 PRO HG3 1 1 20 35744 1 1 2 PRO N N -0.668 4.466 19.231 1.00 . A A . 2 PRO N 1 1 20 35745 1 1 2 PRO O O -2.550 3.089 17.882 1.00 . A A . 2 PRO O 1 1 20 35746 1 1 3 LYS C C -5.017 4.407 15.842 1.00 . A A . 3 LYS C 1 1 20 35747 1 1 3 LYS CA C -5.121 3.976 17.306 1.00 . A A . 3 LYS CA 1 1 20 35748 1 1 3 LYS CB C -6.516 4.162 17.905 1.00 . A A . 3 LYS CB 1 1 20 35749 1 1 3 LYS CD C -6.316 3.243 20.245 1.00 . A A . 3 LYS CD 1 1 20 35750 1 1 3 LYS CE C -7.446 3.336 21.272 1.00 . A A . 3 LYS CE 1 1 20 35751 1 1 3 LYS CG C -6.871 3.004 18.840 1.00 . A A . 3 LYS CG 1 1 20 35752 1 1 3 LYS H H -4.430 5.582 18.438 1.00 . A A . 3 LYS H 1 1 20 35753 1 1 3 LYS HA H -4.881 2.914 17.371 1.00 . A A . 3 LYS HA 1 1 20 35754 1 1 3 LYS HB2 H -6.558 5.103 18.454 1.00 . A A . 3 LYS HB2 1 1 20 35755 1 1 3 LYS HB3 H -7.253 4.228 17.105 1.00 . A A . 3 LYS HB3 1 1 20 35756 1 1 3 LYS HD2 H -5.640 2.433 20.516 1.00 . A A . 3 LYS HD2 1 1 20 35757 1 1 3 LYS HD3 H -5.732 4.164 20.258 1.00 . A A . 3 LYS HD3 1 1 20 35758 1 1 3 LYS HE2 H -8.402 3.448 20.761 1.00 . A A . 3 LYS HE2 1 1 20 35759 1 1 3 LYS HE3 H -7.500 2.412 21.848 1.00 . A A . 3 LYS HE3 1 1 20 35760 1 1 3 LYS HG2 H -7.954 2.889 18.887 1.00 . A A . 3 LYS HG2 1 1 20 35761 1 1 3 LYS HG3 H -6.469 2.073 18.440 1.00 . A A . 3 LYS HG3 1 1 20 35762 1 1 3 LYS HZ1 H -8.094 4.821 22.583 1.00 . A A . 3 LYS HZ1 1 1 20 35763 1 1 3 LYS HZ2 H -6.620 4.240 22.959 1.00 . A A . 3 LYS HZ2 1 1 20 35764 1 1 3 LYS N N -4.130 4.694 18.090 1.00 . A A . 3 LYS N 1 1 20 35765 1 1 3 LYS NZ N -7.227 4.482 22.183 1.00 . A A . 3 LYS NZ 1 1 20 35766 1 1 3 LYS O O -4.287 5.343 15.517 1.00 . A A . 3 LYS O 1 1 20 35767 1 1 4 ALA C C -6.347 5.399 13.352 1.00 . A A . 4 ALA C 1 1 20 35768 1 1 4 ALA CA C -5.759 4.004 13.575 1.00 . A A . 4 ALA CA 1 1 20 35769 1 1 4 ALA CB C -6.532 2.918 12.825 1.00 . A A . 4 ALA CB 1 1 20 35770 1 1 4 ALA H H -6.349 2.946 15.270 1.00 . A A . 4 ALA H 1 1 20 35771 1 1 4 ALA HA H -4.723 3.997 13.234 1.00 . A A . 4 ALA HA 1 1 20 35772 1 1 4 ALA HB1 H -6.654 2.048 13.470 1.00 . A A . 4 ALA HB1 1 1 20 35773 1 1 4 ALA HB2 H -7.513 3.300 12.542 1.00 . A A . 4 ALA HB2 1 1 20 35774 1 1 4 ALA HB3 H -5.981 2.632 11.929 1.00 . A A . 4 ALA HB3 1 1 20 35775 1 1 4 ALA N N -5.758 3.705 14.997 1.00 . A A . 4 ALA N 1 1 20 35776 1 1 4 ALA O O -7.192 5.851 14.123 1.00 . A A . 4 ALA O 1 1 20 35777 1 1 5 PRO C C -7.736 7.345 11.321 1.00 . A A . 5 PRO C 1 1 20 35778 1 1 5 PRO CA C -6.333 7.393 11.931 1.00 . A A . 5 PRO CA 1 1 20 35779 1 1 5 PRO CB C -5.290 7.949 10.976 1.00 . A A . 5 PRO CB 1 1 20 35780 1 1 5 PRO CD C -4.863 5.555 11.330 1.00 . A A . 5 PRO CD 1 1 20 35781 1 1 5 PRO CG C -4.524 6.746 10.449 1.00 . A A . 5 PRO CG 1 1 20 35782 1 1 5 PRO HA H -6.414 7.950 12.758 1.00 . A A . 5 PRO HA 1 1 20 35783 1 1 5 PRO HB2 H -5.760 8.501 10.162 1.00 . A A . 5 PRO HB2 1 1 20 35784 1 1 5 PRO HB3 H -4.622 8.643 11.488 1.00 . A A . 5 PRO HB3 1 1 20 35785 1 1 5 PRO HD2 H -5.253 4.725 10.741 1.00 . A A . 5 PRO HD2 1 1 20 35786 1 1 5 PRO HD3 H -3.981 5.187 11.855 1.00 . A A . 5 PRO HD3 1 1 20 35787 1 1 5 PRO HG2 H -4.797 6.544 9.413 1.00 . A A . 5 PRO HG2 1 1 20 35788 1 1 5 PRO HG3 H -3.452 6.940 10.464 1.00 . A A . 5 PRO HG3 1 1 20 35789 1 1 5 PRO N N -5.864 6.059 12.266 1.00 . A A . 5 PRO N 1 1 20 35790 1 1 5 PRO O O -8.244 6.269 11.009 1.00 . A A . 5 PRO O 1 1 20 35791 1 1 6 ALA C C -9.684 7.930 9.243 1.00 . A A . 6 ALA C 1 1 20 35792 1 1 6 ALA CA C -9.656 8.628 10.604 1.00 . A A . 6 ALA CA 1 1 20 35793 1 1 6 ALA CB C -10.057 10.102 10.512 1.00 . A A . 6 ALA CB 1 1 20 35794 1 1 6 ALA H H -7.902 9.393 11.427 1.00 . A A . 6 ALA H 1 1 20 35795 1 1 6 ALA HA H -10.344 8.119 11.279 1.00 . A A . 6 ALA HA 1 1 20 35796 1 1 6 ALA HB1 H -9.173 10.727 10.636 1.00 . A A . 6 ALA HB1 1 1 20 35797 1 1 6 ALA HB2 H -10.505 10.296 9.538 1.00 . A A . 6 ALA HB2 1 1 20 35798 1 1 6 ALA HB3 H -10.778 10.333 11.296 1.00 . A A . 6 ALA HB3 1 1 20 35799 1 1 6 ALA N N -8.322 8.523 11.171 1.00 . A A . 6 ALA N 1 1 20 35800 1 1 6 ALA O O -8.668 7.867 8.553 1.00 . A A . 6 ALA O 1 1 20 35801 1 1 7 ASP C C -11.111 7.758 6.502 1.00 . A A . 7 ASP C 1 1 20 35802 1 1 7 ASP CA C -11.032 6.731 7.633 1.00 . A A . 7 ASP CA 1 1 20 35803 1 1 7 ASP CB C -12.328 5.917 7.623 1.00 . A A . 7 ASP CB 1 1 20 35804 1 1 7 ASP CG C -12.835 5.492 9.003 1.00 . A A . 7 ASP CG 1 1 20 35805 1 1 7 ASP H H -11.680 7.478 9.466 1.00 . A A . 7 ASP H 1 1 20 35806 1 1 7 ASP HA H -10.165 6.077 7.543 1.00 . A A . 7 ASP HA 1 1 20 35807 1 1 7 ASP HB2 H -13.104 6.504 7.133 1.00 . A A . 7 ASP HB2 1 1 20 35808 1 1 7 ASP HB3 H -12.174 5.024 7.018 1.00 . A A . 7 ASP HB3 1 1 20 35809 1 1 7 ASP N N -10.859 7.423 8.899 1.00 . A A . 7 ASP N 1 1 20 35810 1 1 7 ASP O O -11.567 8.882 6.709 1.00 . A A . 7 ASP O 1 1 20 35811 1 1 7 ASP OD1 O -13.547 6.310 9.623 1.00 . A A . 7 ASP OD1 1 1 20 35812 1 1 7 ASP OD2 O -12.498 4.357 9.406 1.00 . A A . 7 ASP OD2 1 1 20 35813 1 1 8 GLY C C -9.282 8.787 3.900 1.00 . A A . 8 GLY C 1 1 20 35814 1 1 8 GLY CA C -10.672 8.206 4.166 1.00 . A A . 8 GLY CA 1 1 20 35815 1 1 8 GLY H H -10.290 6.421 5.169 1.00 . A A . 8 GLY H 1 1 20 35816 1 1 8 GLY HA2 H -11.009 7.646 3.293 1.00 . A A . 8 GLY HA2 1 1 20 35817 1 1 8 GLY HA3 H -11.386 9.015 4.320 1.00 . A A . 8 GLY HA3 1 1 20 35818 1 1 8 GLY N N -10.659 7.336 5.330 1.00 . A A . 8 GLY N 1 1 20 35819 1 1 8 GLY O O -9.156 9.860 3.311 1.00 . A A . 8 GLY O 1 1 20 35820 1 1 9 LEU C C -6.490 8.273 2.707 1.00 . A A . 9 LEU C 1 1 20 35821 1 1 9 LEU CA C -6.898 8.484 4.166 1.00 . A A . 9 LEU CA 1 1 20 35822 1 1 9 LEU CB C -5.980 7.781 5.169 1.00 . A A . 9 LEU CB 1 1 20 35823 1 1 9 LEU CD1 C -3.930 6.932 3.970 1.00 . A A . 9 LEU CD1 1 1 20 35824 1 1 9 LEU CD2 C -4.165 9.401 4.505 1.00 . A A . 9 LEU CD2 1 1 20 35825 1 1 9 LEU CG C -4.478 7.971 4.951 1.00 . A A . 9 LEU CG 1 1 20 35826 1 1 9 LEU H H -8.385 7.183 4.826 1.00 . A A . 9 LEU H 1 1 20 35827 1 1 9 LEU HA H -6.857 9.551 4.386 1.00 . A A . 9 LEU HA 1 1 20 35828 1 1 9 LEU HB2 H -6.229 8.134 6.169 1.00 . A A . 9 LEU HB2 1 1 20 35829 1 1 9 LEU HB3 H -6.199 6.713 5.144 1.00 . A A . 9 LEU HB3 1 1 20 35830 1 1 9 LEU HD11 H -4.741 6.282 3.639 1.00 . A A . 9 LEU HD11 1 1 20 35831 1 1 9 LEU HD12 H -3.497 7.439 3.108 1.00 . A A . 9 LEU HD12 1 1 20 35832 1 1 9 LEU HD13 H -3.164 6.335 4.463 1.00 . A A . 9 LEU HD13 1 1 20 35833 1 1 9 LEU HD21 H -4.921 10.078 4.901 1.00 . A A . 9 LEU HD21 1 1 20 35834 1 1 9 LEU HD22 H -3.184 9.692 4.880 1.00 . A A . 9 LEU HD22 1 1 20 35835 1 1 9 LEU HD23 H -4.166 9.450 3.416 1.00 . A A . 9 LEU HD23 1 1 20 35836 1 1 9 LEU HG H -3.971 7.812 5.903 1.00 . A A . 9 LEU HG 1 1 20 35837 1 1 9 LEU N N -8.274 8.054 4.348 1.00 . A A . 9 LEU N 1 1 20 35838 1 1 9 LEU O O -6.237 7.145 2.286 1.00 . A A . 9 LEU O 1 1 20 35839 1 1 10 LYS C C -4.620 9.794 0.414 1.00 . A A . 10 LYS C 1 1 20 35840 1 1 10 LYS CA C -6.068 9.326 0.571 1.00 . A A . 10 LYS CA 1 1 20 35841 1 1 10 LYS CB C -7.065 10.118 -0.276 1.00 . A A . 10 LYS CB 1 1 20 35842 1 1 10 LYS CD C -7.432 11.267 -2.491 1.00 . A A . 10 LYS CD 1 1 20 35843 1 1 10 LYS CE C -6.584 12.372 -3.127 1.00 . A A . 10 LYS CE 1 1 20 35844 1 1 10 LYS CG C -6.556 10.286 -1.709 1.00 . A A . 10 LYS CG 1 1 20 35845 1 1 10 LYS H H -6.647 10.289 2.324 1.00 . A A . 10 LYS H 1 1 20 35846 1 1 10 LYS HA H -6.131 8.285 0.253 1.00 . A A . 10 LYS HA 1 1 20 35847 1 1 10 LYS HB2 H -8.028 9.607 -0.286 1.00 . A A . 10 LYS HB2 1 1 20 35848 1 1 10 LYS HB3 H -7.231 11.098 0.172 1.00 . A A . 10 LYS HB3 1 1 20 35849 1 1 10 LYS HD2 H -7.980 10.733 -3.267 1.00 . A A . 10 LYS HD2 1 1 20 35850 1 1 10 LYS HD3 H -8.172 11.710 -1.825 1.00 . A A . 10 LYS HD3 1 1 20 35851 1 1 10 LYS HE2 H -5.653 12.487 -2.573 1.00 . A A . 10 LYS HE2 1 1 20 35852 1 1 10 LYS HE3 H -6.317 12.092 -4.146 1.00 . A A . 10 LYS HE3 1 1 20 35853 1 1 10 LYS HG2 H -5.527 10.644 -1.694 1.00 . A A . 10 LYS HG2 1 1 20 35854 1 1 10 LYS HG3 H -6.549 9.319 -2.212 1.00 . A A . 10 LYS HG3 1 1 20 35855 1 1 10 LYS HZ1 H -6.703 14.452 -3.088 1.00 . A A . 10 LYS HZ1 1 1 20 35856 1 1 10 LYS HZ2 H -7.881 13.764 -3.977 1.00 . A A . 10 LYS HZ2 1 1 20 35857 1 1 10 LYS N N -6.440 9.376 1.974 1.00 . A A . 10 LYS N 1 1 20 35858 1 1 10 LYS NZ N -7.325 13.653 -3.136 1.00 . A A . 10 LYS NZ 1 1 20 35859 1 1 10 LYS O O -4.161 10.662 1.155 1.00 . A A . 10 LYS O 1 1 20 35860 1 1 11 MET C C -2.361 9.971 -2.273 1.00 . A A . 11 MET C 1 1 20 35861 1 1 11 MET CA C -2.553 9.542 -0.817 1.00 . A A . 11 MET CA 1 1 20 35862 1 1 11 MET CB C -1.662 8.335 -0.518 1.00 . A A . 11 MET CB 1 1 20 35863 1 1 11 MET CE C -0.317 5.495 0.054 1.00 . A A . 11 MET CE 1 1 20 35864 1 1 11 MET CG C -2.322 7.036 -0.986 1.00 . A A . 11 MET CG 1 1 20 35865 1 1 11 MET H H -4.321 8.492 -1.153 1.00 . A A . 11 MET H 1 1 20 35866 1 1 11 MET HA H -2.328 10.376 -0.153 1.00 . A A . 11 MET HA 1 1 20 35867 1 1 11 MET HB2 H -0.699 8.458 -1.015 1.00 . A A . 11 MET HB2 1 1 20 35868 1 1 11 MET HB3 H -1.463 8.281 0.552 1.00 . A A . 11 MET HB3 1 1 20 35869 1 1 11 MET HE1 H -1.053 5.607 0.850 1.00 . A A . 11 MET HE1 1 1 20 35870 1 1 11 MET HE2 H 0.052 4.469 0.041 1.00 . A A . 11 MET HE2 1 1 20 35871 1 1 11 MET HE3 H 0.515 6.177 0.230 1.00 . A A . 11 MET HE3 1 1 20 35872 1 1 11 MET HG2 H -2.911 6.606 -0.176 1.00 . A A . 11 MET HG2 1 1 20 35873 1 1 11 MET HG3 H -3.011 7.243 -1.805 1.00 . A A . 11 MET HG3 1 1 20 35874 1 1 11 MET N N -3.940 9.198 -0.554 1.00 . A A . 11 MET N 1 1 20 35875 1 1 11 MET O O -2.353 9.134 -3.175 1.00 . A A . 11 MET O 1 1 20 35876 1 1 11 MET SD S -1.076 5.875 -1.517 1.00 . A A . 11 MET SD 1 1 20 35877 1 1 12 GLU C C -0.557 12.219 -3.996 1.00 . A A . 12 GLU C 1 1 20 35878 1 1 12 GLU CA C -2.021 11.824 -3.789 1.00 . A A . 12 GLU CA 1 1 20 35879 1 1 12 GLU CB C -2.949 13.016 -4.029 1.00 . A A . 12 GLU CB 1 1 20 35880 1 1 12 GLU CD C -1.880 14.389 -5.854 1.00 . A A . 12 GLU CD 1 1 20 35881 1 1 12 GLU CG C -2.989 13.392 -5.511 1.00 . A A . 12 GLU CG 1 1 20 35882 1 1 12 GLU H H -2.219 11.948 -1.720 1.00 . A A . 12 GLU H 1 1 20 35883 1 1 12 GLU HA H -2.287 11.020 -4.476 1.00 . A A . 12 GLU HA 1 1 20 35884 1 1 12 GLU HB2 H -3.954 12.774 -3.684 1.00 . A A . 12 GLU HB2 1 1 20 35885 1 1 12 GLU HB3 H -2.609 13.870 -3.443 1.00 . A A . 12 GLU HB3 1 1 20 35886 1 1 12 GLU HG2 H -2.877 12.495 -6.120 1.00 . A A . 12 GLU HG2 1 1 20 35887 1 1 12 GLU HG3 H -3.960 13.823 -5.755 1.00 . A A . 12 GLU HG3 1 1 20 35888 1 1 12 GLU N N -2.212 11.274 -2.458 1.00 . A A . 12 GLU N 1 1 20 35889 1 1 12 GLU O O -0.240 13.401 -4.113 1.00 . A A . 12 GLU O 1 1 20 35890 1 1 12 GLU OE1 O -2.082 15.586 -5.557 1.00 . A A . 12 GLU OE1 1 1 20 35891 1 1 12 GLU OE2 O -0.856 13.932 -6.406 1.00 . A A . 12 GLU OE2 1 1 20 35892 1 1 13 ALA C C 2.069 11.238 -5.701 1.00 . A A . 13 ALA C 1 1 20 35893 1 1 13 ALA CA C 1.719 11.432 -4.224 1.00 . A A . 13 ALA CA 1 1 20 35894 1 1 13 ALA CB C 2.511 10.497 -3.309 1.00 . A A . 13 ALA CB 1 1 20 35895 1 1 13 ALA H H 0.030 10.247 -3.939 1.00 . A A . 13 ALA H 1 1 20 35896 1 1 13 ALA HA H 1.931 12.463 -3.942 1.00 . A A . 13 ALA HA 1 1 20 35897 1 1 13 ALA HB1 H 1.884 10.190 -2.472 1.00 . A A . 13 ALA HB1 1 1 20 35898 1 1 13 ALA HB2 H 2.823 9.616 -3.871 1.00 . A A . 13 ALA HB2 1 1 20 35899 1 1 13 ALA HB3 H 3.392 11.017 -2.932 1.00 . A A . 13 ALA HB3 1 1 20 35900 1 1 13 ALA N N 0.296 11.206 -4.035 1.00 . A A . 13 ALA N 1 1 20 35901 1 1 13 ALA O O 3.179 11.556 -6.126 1.00 . A A . 13 ALA O 1 1 20 35902 1 1 14 THR C C 0.074 10.946 -8.653 1.00 . A A . 14 THR C 1 1 20 35903 1 1 14 THR CA C 1.296 10.475 -7.862 1.00 . A A . 14 THR CA 1 1 20 35904 1 1 14 THR CB C 1.606 8.989 -8.051 1.00 . A A . 14 THR CB 1 1 20 35905 1 1 14 THR CG2 C 2.788 8.524 -7.197 1.00 . A A . 14 THR CG2 1 1 20 35906 1 1 14 THR H H 0.203 10.460 -6.088 1.00 . A A . 14 THR H 1 1 20 35907 1 1 14 THR HA H 2.144 11.070 -8.199 1.00 . A A . 14 THR HA 1 1 20 35908 1 1 14 THR HB H 1.771 8.757 -9.104 1.00 . A A . 14 THR HB 1 1 20 35909 1 1 14 THR HG1 H -0.356 8.823 -7.698 1.00 . A A . 14 THR HG1 1 1 20 35910 1 1 14 THR HG21 H 2.728 8.987 -6.212 1.00 . A A . 14 THR HG21 1 1 20 35911 1 1 14 THR HG22 H 2.756 7.440 -7.093 1.00 . A A . 14 THR HG22 1 1 20 35912 1 1 14 THR HG23 H 3.721 8.815 -7.679 1.00 . A A . 14 THR HG23 1 1 20 35913 1 1 14 THR N N 1.103 10.716 -6.442 1.00 . A A . 14 THR N 1 1 20 35914 1 1 14 THR O O -0.910 11.401 -8.071 1.00 . A A . 14 THR O 1 1 20 35915 1 1 14 THR OG1 O 0.483 8.324 -7.481 1.00 . A A . 14 THR OG1 1 1 20 35916 1 1 15 LYS C C -2.134 10.356 -10.573 1.00 . A A . 15 LYS C 1 1 20 35917 1 1 15 LYS CA C -0.908 11.229 -10.846 1.00 . A A . 15 LYS CA 1 1 20 35918 1 1 15 LYS CB C -0.451 11.210 -12.306 1.00 . A A . 15 LYS CB 1 1 20 35919 1 1 15 LYS CD C -1.205 11.597 -14.681 1.00 . A A . 15 LYS CD 1 1 20 35920 1 1 15 LYS CE C -2.003 12.530 -15.593 1.00 . A A . 15 LYS CE 1 1 20 35921 1 1 15 LYS CG C -1.468 11.913 -13.208 1.00 . A A . 15 LYS CG 1 1 20 35922 1 1 15 LYS H H 0.980 10.450 -10.434 1.00 . A A . 15 LYS H 1 1 20 35923 1 1 15 LYS HA H -1.156 12.261 -10.599 1.00 . A A . 15 LYS HA 1 1 20 35924 1 1 15 LYS HB2 H 0.518 11.699 -12.395 1.00 . A A . 15 LYS HB2 1 1 20 35925 1 1 15 LYS HB3 H -0.319 10.179 -12.636 1.00 . A A . 15 LYS HB3 1 1 20 35926 1 1 15 LYS HD2 H -0.141 11.697 -14.894 1.00 . A A . 15 LYS HD2 1 1 20 35927 1 1 15 LYS HD3 H -1.475 10.561 -14.889 1.00 . A A . 15 LYS HD3 1 1 20 35928 1 1 15 LYS HE2 H -3.061 12.485 -15.333 1.00 . A A . 15 LYS HE2 1 1 20 35929 1 1 15 LYS HE3 H -1.682 13.560 -15.440 1.00 . A A . 15 LYS HE3 1 1 20 35930 1 1 15 LYS HG2 H -2.477 11.598 -12.939 1.00 . A A . 15 LYS HG2 1 1 20 35931 1 1 15 LYS HG3 H -1.417 12.990 -13.048 1.00 . A A . 15 LYS HG3 1 1 20 35932 1 1 15 LYS HZ1 H -0.846 11.964 -17.231 1.00 . A A . 15 LYS HZ1 1 1 20 35933 1 1 15 LYS HZ2 H -2.340 11.317 -17.254 1.00 . A A . 15 LYS HZ2 1 1 20 35934 1 1 15 LYS N N 0.176 10.821 -9.968 1.00 . A A . 15 LYS N 1 1 20 35935 1 1 15 LYS NZ N -1.818 12.152 -17.012 1.00 . A A . 15 LYS NZ 1 1 20 35936 1 1 15 LYS O O -3.242 10.687 -10.994 1.00 . A A . 15 LYS O 1 1 20 35937 1 1 16 GLN C C -3.107 8.210 -8.019 1.00 . A A . 16 GLN C 1 1 20 35938 1 1 16 GLN CA C -2.967 8.335 -9.537 1.00 . A A . 16 GLN CA 1 1 20 35939 1 1 16 GLN CB C -2.732 6.968 -10.181 1.00 . A A . 16 GLN CB 1 1 20 35940 1 1 16 GLN CD C -3.658 6.888 -12.525 1.00 . A A . 16 GLN CD 1 1 20 35941 1 1 16 GLN CG C -2.409 7.110 -11.670 1.00 . A A . 16 GLN CG 1 1 20 35942 1 1 16 GLN H H -0.992 8.997 -9.532 1.00 . A A . 16 GLN H 1 1 20 35943 1 1 16 GLN HA H -3.871 8.777 -9.957 1.00 . A A . 16 GLN HA 1 1 20 35944 1 1 16 GLN HB2 H -1.912 6.459 -9.674 1.00 . A A . 16 GLN HB2 1 1 20 35945 1 1 16 GLN HB3 H -3.619 6.345 -10.055 1.00 . A A . 16 GLN HB3 1 1 20 35946 1 1 16 GLN HE21 H -3.763 5.001 -11.799 1.00 . A A . 16 GLN HE21 1 1 20 35947 1 1 16 GLN HE22 H -5.004 5.430 -12.928 1.00 . A A . 16 GLN HE22 1 1 20 35948 1 1 16 GLN HG2 H -2.003 8.102 -11.864 1.00 . A A . 16 GLN HG2 1 1 20 35949 1 1 16 GLN HG3 H -1.640 6.390 -11.949 1.00 . A A . 16 GLN HG3 1 1 20 35950 1 1 16 GLN N N -1.895 9.258 -9.871 1.00 . A A . 16 GLN N 1 1 20 35951 1 1 16 GLN NE2 N -4.185 5.672 -12.408 1.00 . A A . 16 GLN NE2 1 1 20 35952 1 1 16 GLN O O -2.377 7.449 -7.385 1.00 . A A . 16 GLN O 1 1 20 35953 1 1 16 GLN OE1 O -4.113 7.762 -13.245 1.00 . A A . 16 GLN OE1 1 1 20 35954 1 1 17 PRO C C -5.058 7.699 -5.617 1.00 . A A . 17 PRO C 1 1 20 35955 1 1 17 PRO CA C -4.319 8.973 -6.032 1.00 . A A . 17 PRO CA 1 1 20 35956 1 1 17 PRO CB C -5.113 10.238 -5.754 1.00 . A A . 17 PRO CB 1 1 20 35957 1 1 17 PRO CD C -4.957 9.903 -8.184 1.00 . A A . 17 PRO CD 1 1 20 35958 1 1 17 PRO CG C -5.682 10.676 -7.094 1.00 . A A . 17 PRO CG 1 1 20 35959 1 1 17 PRO HA H -3.453 8.962 -5.532 1.00 . A A . 17 PRO HA 1 1 20 35960 1 1 17 PRO HB2 H -5.910 10.049 -5.035 1.00 . A A . 17 PRO HB2 1 1 20 35961 1 1 17 PRO HB3 H -4.477 11.014 -5.328 1.00 . A A . 17 PRO HB3 1 1 20 35962 1 1 17 PRO HD2 H -5.658 9.359 -8.817 1.00 . A A . 17 PRO HD2 1 1 20 35963 1 1 17 PRO HD3 H -4.392 10.571 -8.833 1.00 . A A . 17 PRO HD3 1 1 20 35964 1 1 17 PRO HG2 H -6.754 10.480 -7.136 1.00 . A A . 17 PRO HG2 1 1 20 35965 1 1 17 PRO HG3 H -5.549 11.748 -7.234 1.00 . A A . 17 PRO HG3 1 1 20 35966 1 1 17 PRO N N -4.074 8.989 -7.464 1.00 . A A . 17 PRO N 1 1 20 35967 1 1 17 PRO O O -5.681 7.040 -6.447 1.00 . A A . 17 PRO O 1 1 20 35968 1 1 18 VAL C C -6.170 6.523 -2.405 1.00 . A A . 18 VAL C 1 1 20 35969 1 1 18 VAL CA C -5.615 6.208 -3.796 1.00 . A A . 18 VAL CA 1 1 20 35970 1 1 18 VAL CB C -4.641 5.028 -3.798 1.00 . A A . 18 VAL CB 1 1 20 35971 1 1 18 VAL CG1 C -5.225 3.834 -3.040 1.00 . A A . 18 VAL CG1 1 1 20 35972 1 1 18 VAL CG2 C -4.258 4.636 -5.227 1.00 . A A . 18 VAL CG2 1 1 20 35973 1 1 18 VAL H H -4.455 7.933 -3.662 1.00 . A A . 18 VAL H 1 1 20 35974 1 1 18 VAL HA H -6.445 5.962 -4.457 1.00 . A A . 18 VAL HA 1 1 20 35975 1 1 18 VAL HB H -3.734 5.342 -3.282 1.00 . A A . 18 VAL HB 1 1 20 35976 1 1 18 VAL HG11 H -5.468 4.135 -2.021 1.00 . A A . 18 VAL HG11 1 1 20 35977 1 1 18 VAL HG12 H -6.128 3.491 -3.543 1.00 . A A . 18 VAL HG12 1 1 20 35978 1 1 18 VAL HG13 H -4.493 3.027 -3.015 1.00 . A A . 18 VAL HG13 1 1 20 35979 1 1 18 VAL HG21 H -5.148 4.642 -5.856 1.00 . A A . 18 VAL HG21 1 1 20 35980 1 1 18 VAL HG22 H -3.532 5.350 -5.616 1.00 . A A . 18 VAL HG22 1 1 20 35981 1 1 18 VAL HG23 H -3.820 3.638 -5.224 1.00 . A A . 18 VAL HG23 1 1 20 35982 1 1 18 VAL N N -4.963 7.391 -4.331 1.00 . A A . 18 VAL N 1 1 20 35983 1 1 18 VAL O O -5.648 7.390 -1.706 1.00 . A A . 18 VAL O 1 1 20 35984 1 1 19 VAL C C -7.782 4.687 0.044 1.00 . A A . 19 VAL C 1 1 20 35985 1 1 19 VAL CA C -7.853 5.992 -0.751 1.00 . A A . 19 VAL CA 1 1 20 35986 1 1 19 VAL CB C -9.283 6.502 -0.937 1.00 . A A . 19 VAL CB 1 1 20 35987 1 1 19 VAL CG1 C -10.073 6.409 0.370 1.00 . A A . 19 VAL CG1 1 1 20 35988 1 1 19 VAL CG2 C -9.289 7.932 -1.481 1.00 . A A . 19 VAL CG2 1 1 20 35989 1 1 19 VAL H H -7.639 5.097 -2.620 1.00 . A A . 19 VAL H 1 1 20 35990 1 1 19 VAL HA H -7.288 6.758 -0.219 1.00 . A A . 19 VAL HA 1 1 20 35991 1 1 19 VAL HB H -9.774 5.863 -1.671 1.00 . A A . 19 VAL HB 1 1 20 35992 1 1 19 VAL HG11 H -10.098 5.373 0.707 1.00 . A A . 19 VAL HG11 1 1 20 35993 1 1 19 VAL HG12 H -9.591 7.026 1.130 1.00 . A A . 19 VAL HG12 1 1 20 35994 1 1 19 VAL HG13 H -11.090 6.764 0.206 1.00 . A A . 19 VAL HG13 1 1 20 35995 1 1 19 VAL HG21 H -8.269 8.234 -1.720 1.00 . A A . 19 VAL HG21 1 1 20 35996 1 1 19 VAL HG22 H -9.902 7.976 -2.381 1.00 . A A . 19 VAL HG22 1 1 20 35997 1 1 19 VAL HG23 H -9.700 8.605 -0.729 1.00 . A A . 19 VAL HG23 1 1 20 35998 1 1 19 VAL N N -7.221 5.801 -2.045 1.00 . A A . 19 VAL N 1 1 20 35999 1 1 19 VAL O O -8.347 3.674 -0.367 1.00 . A A . 19 VAL O 1 1 20 36000 1 1 20 PHE C C -7.793 3.716 3.282 1.00 . A A . 20 PHE C 1 1 20 36001 1 1 20 PHE CA C -6.932 3.588 2.024 1.00 . A A . 20 PHE CA 1 1 20 36002 1 1 20 PHE CB C -5.457 3.554 2.432 1.00 . A A . 20 PHE CB 1 1 20 36003 1 1 20 PHE CD1 C -4.888 1.130 2.828 1.00 . A A . 20 PHE CD1 1 1 20 36004 1 1 20 PHE CD2 C -4.970 2.597 4.713 1.00 . A A . 20 PHE CD2 1 1 20 36005 1 1 20 PHE CE1 C -4.546 0.034 3.696 1.00 . A A . 20 PHE CE1 1 1 20 36006 1 1 20 PHE CE2 C -4.628 1.501 5.581 1.00 . A A . 20 PHE CE2 1 1 20 36007 1 1 20 PHE CG C -5.093 2.389 3.354 1.00 . A A . 20 PHE CG 1 1 20 36008 1 1 20 PHE CZ C -4.432 0.273 5.030 1.00 . A A . 20 PHE CZ 1 1 20 36009 1 1 20 PHE H H -6.628 5.580 1.495 1.00 . A A . 20 PHE H 1 1 20 36010 1 1 20 PHE HA H -7.252 2.712 1.461 1.00 . A A . 20 PHE HA 1 1 20 36011 1 1 20 PHE HB2 H -4.844 3.498 1.533 1.00 . A A . 20 PHE HB2 1 1 20 36012 1 1 20 PHE HB3 H -5.207 4.491 2.930 1.00 . A A . 20 PHE HB3 1 1 20 36013 1 1 20 PHE HD1 H -4.986 0.966 1.754 1.00 . A A . 20 PHE HD1 1 1 20 36014 1 1 20 PHE HD2 H -5.132 3.592 5.129 1.00 . A A . 20 PHE HD2 1 1 20 36015 1 1 20 PHE HE1 H -4.381 -0.966 3.293 1.00 . A A . 20 PHE HE1 1 1 20 36016 1 1 20 PHE HE2 H -4.527 1.651 6.656 1.00 . A A . 20 PHE HE2 1 1 20 36017 1 1 20 PHE HZ H -4.142 -0.636 5.616 1.00 . A A . 20 PHE HZ 1 1 20 36018 1 1 20 PHE N N -7.084 4.753 1.168 1.00 . A A . 20 PHE N 1 1 20 36019 1 1 20 PHE O O -7.967 4.813 3.811 1.00 . A A . 20 PHE O 1 1 20 36020 1 1 21 ASN C C -8.523 1.622 5.952 1.00 . A A . 21 ASN C 1 1 20 36021 1 1 21 ASN CA C -9.150 2.551 4.910 1.00 . A A . 21 ASN CA 1 1 20 36022 1 1 21 ASN CB C -10.547 2.019 4.583 1.00 . A A . 21 ASN CB 1 1 20 36023 1 1 21 ASN CG C -11.168 2.790 3.417 1.00 . A A . 21 ASN CG 1 1 20 36024 1 1 21 ASN H H -8.164 1.691 3.288 1.00 . A A . 21 ASN H 1 1 20 36025 1 1 21 ASN HA H -9.201 3.585 5.250 1.00 . A A . 21 ASN HA 1 1 20 36026 1 1 21 ASN HB2 H -10.487 0.959 4.332 1.00 . A A . 21 ASN HB2 1 1 20 36027 1 1 21 ASN HB3 H -11.187 2.102 5.461 1.00 . A A . 21 ASN HB3 1 1 20 36028 1 1 21 ASN HD21 H -11.602 4.292 4.703 1.00 . A A . 21 ASN HD21 1 1 20 36029 1 1 21 ASN HD22 H -12.087 4.559 3.062 1.00 . A A . 21 ASN HD22 1 1 20 36030 1 1 21 ASN N N -8.311 2.579 3.724 1.00 . A A . 21 ASN N 1 1 20 36031 1 1 21 ASN ND2 N -11.660 3.978 3.755 1.00 . A A . 21 ASN ND2 1 1 20 36032 1 1 21 ASN O O -8.163 0.488 5.641 1.00 . A A . 21 ASN O 1 1 20 36033 1 1 21 ASN OD1 O -11.199 2.336 2.285 1.00 . A A . 21 ASN OD1 1 1 20 36034 1 1 22 HIS C C -8.895 0.448 8.854 1.00 . A A . 22 HIS C 1 1 20 36035 1 1 22 HIS CA C -7.832 1.370 8.256 1.00 . A A . 22 HIS CA 1 1 20 36036 1 1 22 HIS CB C -7.196 2.296 9.296 1.00 . A A . 22 HIS CB 1 1 20 36037 1 1 22 HIS CD2 C -4.594 2.058 9.248 1.00 . A A . 22 HIS CD2 1 1 20 36038 1 1 22 HIS CE1 C -4.131 3.916 8.189 1.00 . A A . 22 HIS CE1 1 1 20 36039 1 1 22 HIS CG C -5.773 2.689 8.980 1.00 . A A . 22 HIS CG 1 1 20 36040 1 1 22 HIS H H -8.705 3.063 7.411 1.00 . A A . 22 HIS H 1 1 20 36041 1 1 22 HIS HA H -7.037 0.763 7.823 1.00 . A A . 22 HIS HA 1 1 20 36042 1 1 22 HIS HB2 H -7.801 3.198 9.382 1.00 . A A . 22 HIS HB2 1 1 20 36043 1 1 22 HIS HB3 H -7.219 1.803 10.268 1.00 . A A . 22 HIS HB3 1 1 20 36044 1 1 22 HIS HD1 H -6.098 4.541 7.980 1.00 . A A . 22 HIS HD1 1 1 20 36045 1 1 22 HIS HD2 H -4.484 1.106 9.768 1.00 . A A . 22 HIS HD2 1 1 20 36046 1 1 22 HIS HE1 H -3.567 4.716 7.709 1.00 . A A . 22 HIS HE1 1 1 20 36047 1 1 22 HIS N N -8.410 2.139 7.166 1.00 . A A . 22 HIS N 1 1 20 36048 1 1 22 HIS ND1 N -5.449 3.857 8.313 1.00 . A A . 22 HIS ND1 1 1 20 36049 1 1 22 HIS NE2 N -3.603 2.800 8.769 1.00 . A A . 22 HIS NE2 1 1 20 36050 1 1 22 HIS O O -8.570 -0.597 9.417 1.00 . A A . 22 HIS O 1 1 20 36051 1 1 23 SER C C -11.501 -1.133 8.345 1.00 . A A . 23 SER C 1 1 20 36052 1 1 23 SER CA C -11.257 0.091 9.231 1.00 . A A . 23 SER CA 1 1 20 36053 1 1 23 SER CB C -12.526 0.941 9.322 1.00 . A A . 23 SER CB 1 1 20 36054 1 1 23 SER H H -10.400 1.717 8.252 1.00 . A A . 23 SER H 1 1 20 36055 1 1 23 SER HA H -10.953 -0.216 10.232 1.00 . A A . 23 SER HA 1 1 20 36056 1 1 23 SER HB2 H -13.364 0.310 9.620 1.00 . A A . 23 SER HB2 1 1 20 36057 1 1 23 SER HB3 H -12.402 1.694 10.100 1.00 . A A . 23 SER HB3 1 1 20 36058 1 1 23 SER HG H -12.233 2.371 7.954 1.00 . A A . 23 SER HG 1 1 20 36059 1 1 23 SER N N -10.144 0.866 8.711 1.00 . A A . 23 SER N 1 1 20 36060 1 1 23 SER O O -12.367 -1.955 8.641 1.00 . A A . 23 SER O 1 1 20 36061 1 1 23 SER OG O -12.830 1.581 8.086 1.00 . A A . 23 SER OG 1 1 20 36062 1 1 24 THR C C -9.719 -3.338 6.577 1.00 . A A . 24 THR C 1 1 20 36063 1 1 24 THR CA C -10.842 -2.325 6.346 1.00 . A A . 24 THR CA 1 1 20 36064 1 1 24 THR CB C -10.862 -1.752 4.928 1.00 . A A . 24 THR CB 1 1 20 36065 1 1 24 THR CG2 C -10.942 -2.842 3.857 1.00 . A A . 24 THR CG2 1 1 20 36066 1 1 24 THR H H -10.019 -0.543 7.044 1.00 . A A . 24 THR H 1 1 20 36067 1 1 24 THR HA H -11.783 -2.839 6.544 1.00 . A A . 24 THR HA 1 1 20 36068 1 1 24 THR HB H -10.003 -1.102 4.759 1.00 . A A . 24 THR HB 1 1 20 36069 1 1 24 THR HG1 H -12.029 -0.143 5.162 1.00 . A A . 24 THR HG1 1 1 20 36070 1 1 24 THR HG21 H -11.819 -3.463 4.037 1.00 . A A . 24 THR HG21 1 1 20 36071 1 1 24 THR HG22 H -11.020 -2.379 2.873 1.00 . A A . 24 THR HG22 1 1 20 36072 1 1 24 THR HG23 H -10.045 -3.459 3.899 1.00 . A A . 24 THR HG23 1 1 20 36073 1 1 24 THR N N -10.722 -1.215 7.277 1.00 . A A . 24 THR N 1 1 20 36074 1 1 24 THR O O -9.909 -4.537 6.375 1.00 . A A . 24 THR O 1 1 20 36075 1 1 24 THR OG1 O -12.118 -1.086 4.840 1.00 . A A . 24 THR OG1 1 1 20 36076 1 1 25 HIS C C -7.253 -3.855 8.764 1.00 . A A . 25 HIS C 1 1 20 36077 1 1 25 HIS CA C -7.421 -3.665 7.255 1.00 . A A . 25 HIS CA 1 1 20 36078 1 1 25 HIS CB C -6.169 -3.095 6.586 1.00 . A A . 25 HIS CB 1 1 20 36079 1 1 25 HIS CD2 C -5.823 -3.698 4.066 1.00 . A A . 25 HIS CD2 1 1 20 36080 1 1 25 HIS CE1 C -6.899 -2.006 3.191 1.00 . A A . 25 HIS CE1 1 1 20 36081 1 1 25 HIS CG C -6.293 -2.929 5.090 1.00 . A A . 25 HIS CG 1 1 20 36082 1 1 25 HIS H H -8.428 -1.844 7.157 1.00 . A A . 25 HIS H 1 1 20 36083 1 1 25 HIS HA H -7.632 -4.631 6.797 1.00 . A A . 25 HIS HA 1 1 20 36084 1 1 25 HIS HB2 H -5.940 -2.127 7.031 1.00 . A A . 25 HIS HB2 1 1 20 36085 1 1 25 HIS HB3 H -5.325 -3.751 6.800 1.00 . A A . 25 HIS HB3 1 1 20 36086 1 1 25 HIS HD1 H -7.426 -1.129 4.996 1.00 . A A . 25 HIS HD1 1 1 20 36087 1 1 25 HIS HD2 H -5.243 -4.615 4.172 1.00 . A A . 25 HIS HD2 1 1 20 36088 1 1 25 HIS HE1 H -7.333 -1.331 2.454 1.00 . A A . 25 HIS HE1 1 1 20 36089 1 1 25 HIS N N -8.574 -2.820 6.996 1.00 . A A . 25 HIS N 1 1 20 36090 1 1 25 HIS ND1 N -6.966 -1.870 4.507 1.00 . A A . 25 HIS ND1 1 1 20 36091 1 1 25 HIS NE2 N -6.190 -3.139 2.920 1.00 . A A . 25 HIS NE2 1 1 20 36092 1 1 25 HIS O O -6.131 -3.897 9.267 1.00 . A A . 25 HIS O 1 1 20 36093 1 1 26 LYS C C -7.829 -5.538 11.215 1.00 . A A . 26 LYS C 1 1 20 36094 1 1 26 LYS CA C -8.377 -4.148 10.885 1.00 . A A . 26 LYS CA 1 1 20 36095 1 1 26 LYS CB C -9.767 -3.881 11.467 1.00 . A A . 26 LYS CB 1 1 20 36096 1 1 26 LYS CD C -11.709 -2.274 11.554 1.00 . A A . 26 LYS CD 1 1 20 36097 1 1 26 LYS CE C -11.656 -1.513 12.880 1.00 . A A . 26 LYS CE 1 1 20 36098 1 1 26 LYS CG C -10.302 -2.523 11.008 1.00 . A A . 26 LYS CG 1 1 20 36099 1 1 26 LYS H H -9.293 -3.929 9.027 1.00 . A A . 26 LYS H 1 1 20 36100 1 1 26 LYS HA H -7.703 -3.402 11.306 1.00 . A A . 26 LYS HA 1 1 20 36101 1 1 26 LYS HB2 H -10.453 -4.669 11.158 1.00 . A A . 26 LYS HB2 1 1 20 36102 1 1 26 LYS HB3 H -9.721 -3.908 12.556 1.00 . A A . 26 LYS HB3 1 1 20 36103 1 1 26 LYS HD2 H -12.290 -1.707 10.827 1.00 . A A . 26 LYS HD2 1 1 20 36104 1 1 26 LYS HD3 H -12.220 -3.226 11.697 1.00 . A A . 26 LYS HD3 1 1 20 36105 1 1 26 LYS HE2 H -10.939 -1.987 13.550 1.00 . A A . 26 LYS HE2 1 1 20 36106 1 1 26 LYS HE3 H -11.307 -0.495 12.708 1.00 . A A . 26 LYS HE3 1 1 20 36107 1 1 26 LYS HG2 H -9.632 -1.731 11.345 1.00 . A A . 26 LYS HG2 1 1 20 36108 1 1 26 LYS HG3 H -10.318 -2.484 9.919 1.00 . A A . 26 LYS HG3 1 1 20 36109 1 1 26 LYS HZ1 H -13.278 -2.400 13.843 1.00 . A A . 26 LYS HZ1 1 1 20 36110 1 1 26 LYS HZ2 H -13.020 -0.863 14.315 1.00 . A A . 26 LYS HZ2 1 1 20 36111 1 1 26 LYS N N -8.385 -3.964 9.444 1.00 . A A . 26 LYS N 1 1 20 36112 1 1 26 LYS NZ N -12.993 -1.484 13.514 1.00 . A A . 26 LYS NZ 1 1 20 36113 1 1 26 LYS O O -7.069 -5.700 12.168 1.00 . A A . 26 LYS O 1 1 20 36114 1 1 27 SER C C -6.323 -8.014 10.212 1.00 . A A . 27 SER C 1 1 20 36115 1 1 27 SER CA C -7.797 -7.877 10.601 1.00 . A A . 27 SER CA 1 1 20 36116 1 1 27 SER CB C -8.653 -8.851 9.789 1.00 . A A . 27 SER CB 1 1 20 36117 1 1 27 SER H H -8.855 -6.366 9.634 1.00 . A A . 27 SER H 1 1 20 36118 1 1 27 SER HA H -7.931 -8.076 11.665 1.00 . A A . 27 SER HA 1 1 20 36119 1 1 27 SER HB2 H -8.627 -9.835 10.258 1.00 . A A . 27 SER HB2 1 1 20 36120 1 1 27 SER HB3 H -9.691 -8.519 9.802 1.00 . A A . 27 SER HB3 1 1 20 36121 1 1 27 SER HG H -7.287 -9.349 8.414 1.00 . A A . 27 SER HG 1 1 20 36122 1 1 27 SER N N -8.237 -6.506 10.407 1.00 . A A . 27 SER N 1 1 20 36123 1 1 27 SER O O -5.706 -9.049 10.459 1.00 . A A . 27 SER O 1 1 20 36124 1 1 27 SER OG O -8.206 -8.957 8.440 1.00 . A A . 27 SER OG 1 1 20 36125 1 1 28 VAL C C -3.546 -6.360 10.300 1.00 . A A . 28 VAL C 1 1 20 36126 1 1 28 VAL CA C -4.414 -6.944 9.183 1.00 . A A . 28 VAL CA 1 1 20 36127 1 1 28 VAL CB C -4.278 -6.185 7.862 1.00 . A A . 28 VAL CB 1 1 20 36128 1 1 28 VAL CG1 C -2.870 -6.340 7.283 1.00 . A A . 28 VAL CG1 1 1 20 36129 1 1 28 VAL CG2 C -5.337 -6.641 6.856 1.00 . A A . 28 VAL CG2 1 1 20 36130 1 1 28 VAL H H -6.312 -6.117 9.413 1.00 . A A . 28 VAL H 1 1 20 36131 1 1 28 VAL HA H -4.114 -7.978 9.011 1.00 . A A . 28 VAL HA 1 1 20 36132 1 1 28 VAL HB H -4.443 -5.127 8.065 1.00 . A A . 28 VAL HB 1 1 20 36133 1 1 28 VAL HG11 H -2.153 -6.452 8.097 1.00 . A A . 28 VAL HG11 1 1 20 36134 1 1 28 VAL HG12 H -2.835 -7.222 6.643 1.00 . A A . 28 VAL HG12 1 1 20 36135 1 1 28 VAL HG13 H -2.619 -5.456 6.697 1.00 . A A . 28 VAL HG13 1 1 20 36136 1 1 28 VAL HG21 H -5.996 -7.370 7.328 1.00 . A A . 28 VAL HG21 1 1 20 36137 1 1 28 VAL HG22 H -5.921 -5.781 6.529 1.00 . A A . 28 VAL HG22 1 1 20 36138 1 1 28 VAL HG23 H -4.848 -7.098 5.996 1.00 . A A . 28 VAL HG23 1 1 20 36139 1 1 28 VAL N N -5.803 -6.955 9.610 1.00 . A A . 28 VAL N 1 1 20 36140 1 1 28 VAL O O -3.957 -5.424 10.984 1.00 . A A . 28 VAL O 1 1 20 36141 1 1 29 LYS C C -0.836 -5.140 11.053 1.00 . A A . 29 LYS C 1 1 20 36142 1 1 29 LYS CA C -1.435 -6.484 11.472 1.00 . A A . 29 LYS CA 1 1 20 36143 1 1 29 LYS CB C -0.387 -7.562 11.758 1.00 . A A . 29 LYS CB 1 1 20 36144 1 1 29 LYS CD C 0.715 -8.923 13.573 1.00 . A A . 29 LYS CD 1 1 20 36145 1 1 29 LYS CE C 1.659 -8.170 14.514 1.00 . A A . 29 LYS CE 1 1 20 36146 1 1 29 LYS CG C -0.492 -8.059 13.202 1.00 . A A . 29 LYS CG 1 1 20 36147 1 1 29 LYS H H -2.036 -7.697 9.889 1.00 . A A . 29 LYS H 1 1 20 36148 1 1 29 LYS HA H -2.005 -6.338 12.389 1.00 . A A . 29 LYS HA 1 1 20 36149 1 1 29 LYS HB2 H -0.521 -8.398 11.071 1.00 . A A . 29 LYS HB2 1 1 20 36150 1 1 29 LYS HB3 H 0.611 -7.161 11.580 1.00 . A A . 29 LYS HB3 1 1 20 36151 1 1 29 LYS HD2 H 0.376 -9.842 14.051 1.00 . A A . 29 LYS HD2 1 1 20 36152 1 1 29 LYS HD3 H 1.252 -9.212 12.670 1.00 . A A . 29 LYS HD3 1 1 20 36153 1 1 29 LYS HE2 H 2.627 -8.031 14.032 1.00 . A A . 29 LYS HE2 1 1 20 36154 1 1 29 LYS HE3 H 1.260 -7.178 14.721 1.00 . A A . 29 LYS HE3 1 1 20 36155 1 1 29 LYS HG2 H -0.557 -7.208 13.879 1.00 . A A . 29 LYS HG2 1 1 20 36156 1 1 29 LYS HG3 H -1.408 -8.636 13.325 1.00 . A A . 29 LYS HG3 1 1 20 36157 1 1 29 LYS HZ1 H 2.715 -9.413 15.811 1.00 . A A . 29 LYS HZ1 1 1 20 36158 1 1 29 LYS HZ2 H 1.811 -8.304 16.588 1.00 . A A . 29 LYS HZ2 1 1 20 36159 1 1 29 LYS N N -2.363 -6.936 10.450 1.00 . A A . 29 LYS N 1 1 20 36160 1 1 29 LYS NZ N 1.831 -8.917 15.780 1.00 . A A . 29 LYS NZ 1 1 20 36161 1 1 29 LYS O O -0.444 -4.964 9.901 1.00 . A A . 29 LYS O 1 1 20 36162 1 1 30 CYS C C 1.203 -3.063 11.273 1.00 . A A . 30 CYS C 1 1 20 36163 1 1 30 CYS CA C -0.240 -2.904 11.756 1.00 . A A . 30 CYS CA 1 1 20 36164 1 1 30 CYS CB C -0.332 -2.006 12.992 1.00 . A A . 30 CYS CB 1 1 20 36165 1 1 30 CYS H H -1.105 -4.379 12.947 1.00 . A A . 30 CYS H 1 1 20 36166 1 1 30 CYS HA H -0.860 -2.455 10.981 1.00 . A A . 30 CYS HA 1 1 20 36167 1 1 30 CYS HB2 H 0.491 -2.250 13.663 1.00 . A A . 30 CYS HB2 1 1 20 36168 1 1 30 CYS HB3 H -0.195 -0.970 12.682 1.00 . A A . 30 CYS HB3 1 1 20 36169 1 1 30 CYS N N -0.784 -4.227 12.012 1.00 . A A . 30 CYS N 1 1 20 36170 1 1 30 CYS O O 1.704 -2.232 10.518 1.00 . A A . 30 CYS O 1 1 20 36171 1 1 30 CYS SG S -1.904 -2.137 13.920 1.00 . A A . 30 CYS SG 1 1 20 36172 1 1 31 GLY C C 3.278 -5.044 9.961 1.00 . A A . 31 GLY C 1 1 20 36173 1 1 31 GLY CA C 3.207 -4.416 11.354 1.00 . A A . 31 GLY CA 1 1 20 36174 1 1 31 GLY H H 1.417 -4.809 12.344 1.00 . A A . 31 GLY H 1 1 20 36175 1 1 31 GLY HA2 H 3.786 -3.492 11.370 1.00 . A A . 31 GLY HA2 1 1 20 36176 1 1 31 GLY HA3 H 3.658 -5.088 12.083 1.00 . A A . 31 GLY HA3 1 1 20 36177 1 1 31 GLY N N 1.831 -4.137 11.730 1.00 . A A . 31 GLY N 1 1 20 36178 1 1 31 GLY O O 4.366 -5.292 9.442 1.00 . A A . 31 GLY O 1 1 20 36179 1 1 32 ASP C C 2.270 -4.801 7.015 1.00 . A A . 32 ASP C 1 1 20 36180 1 1 32 ASP CA C 2.020 -5.879 8.071 1.00 . A A . 32 ASP CA 1 1 20 36181 1 1 32 ASP CB C 0.633 -6.474 7.822 1.00 . A A . 32 ASP CB 1 1 20 36182 1 1 32 ASP CG C 0.533 -7.393 6.603 1.00 . A A . 32 ASP CG 1 1 20 36183 1 1 32 ASP H H 1.225 -5.079 9.822 1.00 . A A . 32 ASP H 1 1 20 36184 1 1 32 ASP HA H 2.782 -6.659 8.059 1.00 . A A . 32 ASP HA 1 1 20 36185 1 1 32 ASP HB2 H 0.330 -7.034 8.707 1.00 . A A . 32 ASP HB2 1 1 20 36186 1 1 32 ASP HB3 H -0.079 -5.657 7.702 1.00 . A A . 32 ASP HB3 1 1 20 36187 1 1 32 ASP N N 2.105 -5.284 9.394 1.00 . A A . 32 ASP N 1 1 20 36188 1 1 32 ASP O O 2.846 -5.078 5.964 1.00 . A A . 32 ASP O 1 1 20 36189 1 1 32 ASP OD1 O 1.006 -6.965 5.529 1.00 . A A . 32 ASP OD1 1 1 20 36190 1 1 32 ASP OD2 O -0.015 -8.504 6.774 1.00 . A A . 32 ASP OD2 1 1 20 36191 1 1 33 CYS C C 3.106 -1.578 6.962 1.00 . A A . 33 CYS C 1 1 20 36192 1 1 33 CYS CA C 1.990 -2.473 6.421 1.00 . A A . 33 CYS CA 1 1 20 36193 1 1 33 CYS CB C 0.683 -1.702 6.228 1.00 . A A . 33 CYS CB 1 1 20 36194 1 1 33 CYS H H 1.356 -3.377 8.187 1.00 . A A . 33 CYS H 1 1 20 36195 1 1 33 CYS HA H 2.265 -2.893 5.453 1.00 . A A . 33 CYS HA 1 1 20 36196 1 1 33 CYS HB2 H 0.090 -1.740 7.142 1.00 . A A . 33 CYS HB2 1 1 20 36197 1 1 33 CYS HB3 H 0.896 -0.652 6.030 1.00 . A A . 33 CYS HB3 1 1 20 36198 1 1 33 CYS N N 1.823 -3.594 7.330 1.00 . A A . 33 CYS N 1 1 20 36199 1 1 33 CYS O O 4.069 -1.283 6.254 1.00 . A A . 33 CYS O 1 1 20 36200 1 1 33 CYS SG S -0.267 -2.418 4.837 1.00 . A A . 33 CYS SG 1 1 20 36201 1 1 34 HIS C C 5.138 -1.147 9.268 1.00 . A A . 34 HIS C 1 1 20 36202 1 1 34 HIS CA C 3.923 -0.314 8.855 1.00 . A A . 34 HIS CA 1 1 20 36203 1 1 34 HIS CB C 3.297 0.443 10.028 1.00 . A A . 34 HIS CB 1 1 20 36204 1 1 34 HIS CD2 C 0.797 1.122 9.680 1.00 . A A . 34 HIS CD2 1 1 20 36205 1 1 34 HIS CE1 C 1.128 3.136 8.892 1.00 . A A . 34 HIS CE1 1 1 20 36206 1 1 34 HIS CG C 2.144 1.336 9.638 1.00 . A A . 34 HIS CG 1 1 20 36207 1 1 34 HIS H H 2.156 -1.415 8.780 1.00 . A A . 34 HIS H 1 1 20 36208 1 1 34 HIS HA H 4.232 0.421 8.112 1.00 . A A . 34 HIS HA 1 1 20 36209 1 1 34 HIS HB2 H 2.951 -0.278 10.769 1.00 . A A . 34 HIS HB2 1 1 20 36210 1 1 34 HIS HB3 H 4.066 1.049 10.508 1.00 . A A . 34 HIS HB3 1 1 20 36211 1 1 34 HIS HD1 H 3.200 3.066 8.985 1.00 . A A . 34 HIS HD1 1 1 20 36212 1 1 34 HIS HD2 H 0.307 0.211 10.025 1.00 . A A . 34 HIS HD2 1 1 20 36213 1 1 34 HIS HE1 H 0.934 4.131 8.491 1.00 . A A . 34 HIS HE1 1 1 20 36214 1 1 34 HIS N N 2.941 -1.170 8.212 1.00 . A A . 34 HIS N 1 1 20 36215 1 1 34 HIS ND1 N 2.321 2.613 9.137 1.00 . A A . 34 HIS ND1 1 1 20 36216 1 1 34 HIS NE2 N 0.185 2.210 9.230 1.00 . A A . 34 HIS NE2 1 1 20 36217 1 1 34 HIS O O 5.512 -1.169 10.439 1.00 . A A . 34 HIS O 1 1 20 36218 1 1 35 HIS C C 7.837 -1.927 9.489 1.00 . A A . 35 HIS C 1 1 20 36219 1 1 35 HIS CA C 6.887 -2.644 8.527 1.00 . A A . 35 HIS CA 1 1 20 36220 1 1 35 HIS CB C 7.562 -3.037 7.211 1.00 . A A . 35 HIS CB 1 1 20 36221 1 1 35 HIS CD2 C 7.717 -1.318 5.248 1.00 . A A . 35 HIS CD2 1 1 20 36222 1 1 35 HIS CE1 C 9.443 -0.181 5.965 1.00 . A A . 35 HIS CE1 1 1 20 36223 1 1 35 HIS CG C 8.114 -1.868 6.431 1.00 . A A . 35 HIS CG 1 1 20 36224 1 1 35 HIS H H 5.412 -1.788 7.331 1.00 . A A . 35 HIS H 1 1 20 36225 1 1 35 HIS HA H 6.526 -3.557 9.000 1.00 . A A . 35 HIS HA 1 1 20 36226 1 1 35 HIS HB2 H 8.372 -3.734 7.424 1.00 . A A . 35 HIS HB2 1 1 20 36227 1 1 35 HIS HB3 H 6.840 -3.567 6.589 1.00 . A A . 35 HIS HB3 1 1 20 36228 1 1 35 HIS HD1 H 9.724 -1.287 7.698 1.00 . A A . 35 HIS HD1 1 1 20 36229 1 1 35 HIS HD2 H 6.881 -1.658 4.636 1.00 . A A . 35 HIS HD2 1 1 20 36230 1 1 35 HIS HE1 H 10.238 0.563 6.017 1.00 . A A . 35 HIS HE1 1 1 20 36231 1 1 35 HIS N N 5.722 -1.812 8.281 1.00 . A A . 35 HIS N 1 1 20 36232 1 1 35 HIS ND1 N 9.205 -1.130 6.858 1.00 . A A . 35 HIS ND1 1 1 20 36233 1 1 35 HIS NE2 N 8.520 -0.299 4.968 1.00 . A A . 35 HIS NE2 1 1 20 36234 1 1 35 HIS O O 7.916 -0.699 9.489 1.00 . A A . 35 HIS O 1 1 20 36235 1 1 36 PRO C C 10.770 -1.718 10.579 1.00 . A A . 36 PRO C 1 1 20 36236 1 1 36 PRO CA C 9.494 -2.202 11.270 1.00 . A A . 36 PRO CA 1 1 20 36237 1 1 36 PRO CB C 9.744 -3.332 12.255 1.00 . A A . 36 PRO CB 1 1 20 36238 1 1 36 PRO CD C 8.486 -4.203 10.333 1.00 . A A . 36 PRO CD 1 1 20 36239 1 1 36 PRO CG C 9.302 -4.604 11.551 1.00 . A A . 36 PRO CG 1 1 20 36240 1 1 36 PRO HA H 9.105 -1.397 11.720 1.00 . A A . 36 PRO HA 1 1 20 36241 1 1 36 PRO HB2 H 10.797 -3.384 12.531 1.00 . A A . 36 PRO HB2 1 1 20 36242 1 1 36 PRO HB3 H 9.181 -3.179 13.176 1.00 . A A . 36 PRO HB3 1 1 20 36243 1 1 36 PRO HD2 H 8.897 -4.635 9.421 1.00 . A A . 36 PRO HD2 1 1 20 36244 1 1 36 PRO HD3 H 7.456 -4.550 10.414 1.00 . A A . 36 PRO HD3 1 1 20 36245 1 1 36 PRO HG2 H 10.167 -5.196 11.253 1.00 . A A . 36 PRO HG2 1 1 20 36246 1 1 36 PRO HG3 H 8.707 -5.224 12.222 1.00 . A A . 36 PRO HG3 1 1 20 36247 1 1 36 PRO N N 8.553 -2.745 10.306 1.00 . A A . 36 PRO N 1 1 20 36248 1 1 36 PRO O O 11.344 -2.431 9.757 1.00 . A A . 36 PRO O 1 1 20 36249 1 1 37 VAL C C 13.392 0.347 11.472 1.00 . A A . 37 VAL C 1 1 20 36250 1 1 37 VAL CA C 12.375 0.078 10.361 1.00 . A A . 37 VAL CA 1 1 20 36251 1 1 37 VAL CB C 12.012 1.334 9.566 1.00 . A A . 37 VAL CB 1 1 20 36252 1 1 37 VAL CG1 C 13.269 2.083 9.119 1.00 . A A . 37 VAL CG1 1 1 20 36253 1 1 37 VAL CG2 C 11.125 0.987 8.368 1.00 . A A . 37 VAL CG2 1 1 20 36254 1 1 37 VAL H H 10.706 0.064 11.606 1.00 . A A . 37 VAL H 1 1 20 36255 1 1 37 VAL HA H 12.798 -0.650 9.668 1.00 . A A . 37 VAL HA 1 1 20 36256 1 1 37 VAL HB H 11.445 1.993 10.222 1.00 . A A . 37 VAL HB 1 1 20 36257 1 1 37 VAL HG11 H 13.979 2.126 9.945 1.00 . A A . 37 VAL HG11 1 1 20 36258 1 1 37 VAL HG12 H 13.723 1.561 8.277 1.00 . A A . 37 VAL HG12 1 1 20 36259 1 1 37 VAL HG13 H 13.001 3.095 8.817 1.00 . A A . 37 VAL HG13 1 1 20 36260 1 1 37 VAL HG21 H 10.304 0.351 8.696 1.00 . A A . 37 VAL HG21 1 1 20 36261 1 1 37 VAL HG22 H 10.725 1.904 7.935 1.00 . A A . 37 VAL HG22 1 1 20 36262 1 1 37 VAL HG23 H 11.716 0.460 7.619 1.00 . A A . 37 VAL HG23 1 1 20 36263 1 1 37 VAL N N 11.178 -0.509 10.937 1.00 . A A . 37 VAL N 1 1 20 36264 1 1 37 VAL O O 13.165 1.197 12.333 1.00 . A A . 37 VAL O 1 1 20 36265 1 1 38 ASN C C 15.181 -1.058 13.654 1.00 . A A . 38 ASN C 1 1 20 36266 1 1 38 ASN CA C 15.542 -0.244 12.410 1.00 . A A . 38 ASN CA 1 1 20 36267 1 1 38 ASN CB C 15.699 1.219 12.831 1.00 . A A . 38 ASN CB 1 1 20 36268 1 1 38 ASN CG C 17.167 1.556 13.101 1.00 . A A . 38 ASN CG 1 1 20 36269 1 1 38 ASN H H 14.667 -1.080 10.715 1.00 . A A . 38 ASN H 1 1 20 36270 1 1 38 ASN HA H 16.447 -0.605 11.923 1.00 . A A . 38 ASN HA 1 1 20 36271 1 1 38 ASN HB2 H 15.310 1.870 12.049 1.00 . A A . 38 ASN HB2 1 1 20 36272 1 1 38 ASN HB3 H 15.108 1.408 13.727 1.00 . A A . 38 ASN HB3 1 1 20 36273 1 1 38 ASN HD21 H 16.587 2.515 14.787 1.00 . A A . 38 ASN HD21 1 1 20 36274 1 1 38 ASN HD22 H 18.291 2.527 14.477 1.00 . A A . 38 ASN HD22 1 1 20 36275 1 1 38 ASN N N 14.490 -0.392 11.418 1.00 . A A . 38 ASN N 1 1 20 36276 1 1 38 ASN ND2 N 17.365 2.257 14.214 1.00 . A A . 38 ASN ND2 1 1 20 36277 1 1 38 ASN O O 15.938 -1.084 14.624 1.00 . A A . 38 ASN O 1 1 20 36278 1 1 38 ASN OD1 O 18.060 1.203 12.349 1.00 . A A . 38 ASN OD1 1 1 20 36279 1 1 39 GLY C C 12.497 -1.772 15.509 1.00 . A A . 39 GLY C 1 1 20 36280 1 1 39 GLY CA C 13.557 -2.516 14.695 1.00 . A A . 39 GLY CA 1 1 20 36281 1 1 39 GLY H H 13.417 -1.678 12.793 1.00 . A A . 39 GLY H 1 1 20 36282 1 1 39 GLY HA2 H 13.140 -3.450 14.316 1.00 . A A . 39 GLY HA2 1 1 20 36283 1 1 39 GLY HA3 H 14.396 -2.780 15.338 1.00 . A A . 39 GLY HA3 1 1 20 36284 1 1 39 GLY N N 14.026 -1.704 13.586 1.00 . A A . 39 GLY N 1 1 20 36285 1 1 39 GLY O O 11.972 -2.305 16.486 1.00 . A A . 39 GLY O 1 1 20 36286 1 1 40 LYS C C 9.938 0.297 14.930 1.00 . A A . 40 LYS C 1 1 20 36287 1 1 40 LYS CA C 11.226 0.271 15.755 1.00 . A A . 40 LYS CA 1 1 20 36288 1 1 40 LYS CB C 11.796 1.660 16.049 1.00 . A A . 40 LYS CB 1 1 20 36289 1 1 40 LYS CD C 12.984 3.378 14.636 1.00 . A A . 40 LYS CD 1 1 20 36290 1 1 40 LYS CE C 12.677 4.761 14.057 1.00 . A A . 40 LYS CE 1 1 20 36291 1 1 40 LYS CG C 11.701 2.563 14.818 1.00 . A A . 40 LYS CG 1 1 20 36292 1 1 40 LYS H H 12.645 -0.126 14.283 1.00 . A A . 40 LYS H 1 1 20 36293 1 1 40 LYS HA H 11.012 -0.199 16.715 1.00 . A A . 40 LYS HA 1 1 20 36294 1 1 40 LYS HB2 H 11.253 2.112 16.879 1.00 . A A . 40 LYS HB2 1 1 20 36295 1 1 40 LYS HB3 H 12.837 1.571 16.361 1.00 . A A . 40 LYS HB3 1 1 20 36296 1 1 40 LYS HD2 H 13.490 3.485 15.595 1.00 . A A . 40 LYS HD2 1 1 20 36297 1 1 40 LYS HD3 H 13.666 2.845 13.973 1.00 . A A . 40 LYS HD3 1 1 20 36298 1 1 40 LYS HE2 H 11.636 4.805 13.739 1.00 . A A . 40 LYS HE2 1 1 20 36299 1 1 40 LYS HE3 H 12.808 5.521 14.828 1.00 . A A . 40 LYS HE3 1 1 20 36300 1 1 40 LYS HG2 H 11.522 1.957 13.930 1.00 . A A . 40 LYS HG2 1 1 20 36301 1 1 40 LYS HG3 H 10.850 3.236 14.921 1.00 . A A . 40 LYS HG3 1 1 20 36302 1 1 40 LYS HZ1 H 14.345 4.405 12.860 1.00 . A A . 40 LYS HZ1 1 1 20 36303 1 1 40 LYS HZ2 H 13.076 4.988 12.024 1.00 . A A . 40 LYS HZ2 1 1 20 36304 1 1 40 LYS N N 12.214 -0.552 15.078 1.00 . A A . 40 LYS N 1 1 20 36305 1 1 40 LYS NZ N 13.566 5.051 12.910 1.00 . A A . 40 LYS NZ 1 1 20 36306 1 1 40 LYS O O 9.984 0.339 13.701 1.00 . A A . 40 LYS O 1 1 20 36307 1 1 41 GLU C C 6.785 1.595 15.307 1.00 . A A . 41 GLU C 1 1 20 36308 1 1 41 GLU CA C 7.520 0.291 14.986 1.00 . A A . 41 GLU CA 1 1 20 36309 1 1 41 GLU CB C 6.684 -0.924 15.393 1.00 . A A . 41 GLU CB 1 1 20 36310 1 1 41 GLU CD C 4.841 -2.189 14.225 1.00 . A A . 41 GLU CD 1 1 20 36311 1 1 41 GLU CG C 6.311 -1.766 14.171 1.00 . A A . 41 GLU CG 1 1 20 36312 1 1 41 GLU H H 8.789 0.238 16.637 1.00 . A A . 41 GLU H 1 1 20 36313 1 1 41 GLU HA H 7.731 0.239 13.918 1.00 . A A . 41 GLU HA 1 1 20 36314 1 1 41 GLU HB2 H 7.243 -1.534 16.103 1.00 . A A . 41 GLU HB2 1 1 20 36315 1 1 41 GLU HB3 H 5.778 -0.593 15.901 1.00 . A A . 41 GLU HB3 1 1 20 36316 1 1 41 GLU HG2 H 6.496 -1.195 13.261 1.00 . A A . 41 GLU HG2 1 1 20 36317 1 1 41 GLU HG3 H 6.946 -2.651 14.127 1.00 . A A . 41 GLU HG3 1 1 20 36318 1 1 41 GLU N N 8.818 0.271 15.638 1.00 . A A . 41 GLU N 1 1 20 36319 1 1 41 GLU O O 6.597 1.935 16.474 1.00 . A A . 41 GLU O 1 1 20 36320 1 1 41 GLU OE1 O 4.499 -2.934 15.168 1.00 . A A . 41 GLU OE1 1 1 20 36321 1 1 41 GLU OE2 O 4.093 -1.758 13.321 1.00 . A A . 41 GLU OE2 1 1 20 36322 1 1 42 ASP C C 4.690 3.715 13.249 1.00 . A A . 42 ASP C 1 1 20 36323 1 1 42 ASP CA C 5.679 3.547 14.404 1.00 . A A . 42 ASP CA 1 1 20 36324 1 1 42 ASP CB C 6.646 4.732 14.375 1.00 . A A . 42 ASP CB 1 1 20 36325 1 1 42 ASP CG C 7.068 5.188 12.977 1.00 . A A . 42 ASP CG 1 1 20 36326 1 1 42 ASP H H 6.545 2.005 13.304 1.00 . A A . 42 ASP H 1 1 20 36327 1 1 42 ASP HA H 5.182 3.479 15.372 1.00 . A A . 42 ASP HA 1 1 20 36328 1 1 42 ASP HB2 H 6.183 5.573 14.891 1.00 . A A . 42 ASP HB2 1 1 20 36329 1 1 42 ASP HB3 H 7.540 4.466 14.939 1.00 . A A . 42 ASP HB3 1 1 20 36330 1 1 42 ASP N N 6.389 2.289 14.250 1.00 . A A . 42 ASP N 1 1 20 36331 1 1 42 ASP O O 4.860 3.112 12.190 1.00 . A A . 42 ASP O 1 1 20 36332 1 1 42 ASP OD1 O 7.088 4.319 12.078 1.00 . A A . 42 ASP OD1 1 1 20 36333 1 1 42 ASP OD2 O 7.361 6.395 12.838 1.00 . A A . 42 ASP OD2 1 1 20 36334 1 1 43 TYR C C 2.961 6.082 11.719 1.00 . A A . 43 TYR C 1 1 20 36335 1 1 43 TYR CA C 2.664 4.791 12.484 1.00 . A A . 43 TYR CA 1 1 20 36336 1 1 43 TYR CB C 1.347 4.955 13.246 1.00 . A A . 43 TYR CB 1 1 20 36337 1 1 43 TYR CD1 C 1.189 2.458 13.559 1.00 . A A . 43 TYR CD1 1 1 20 36338 1 1 43 TYR CD2 C 0.318 3.873 15.278 1.00 . A A . 43 TYR CD2 1 1 20 36339 1 1 43 TYR CE1 C 0.804 1.297 14.320 1.00 . A A . 43 TYR CE1 1 1 20 36340 1 1 43 TYR CE2 C -0.067 2.713 16.038 1.00 . A A . 43 TYR CE2 1 1 20 36341 1 1 43 TYR CG C 0.938 3.722 14.054 1.00 . A A . 43 TYR CG 1 1 20 36342 1 1 43 TYR CZ C 0.195 1.482 15.522 1.00 . A A . 43 TYR CZ 1 1 20 36343 1 1 43 TYR H H 3.549 5.023 14.355 1.00 . A A . 43 TYR H 1 1 20 36344 1 1 43 TYR HA H 2.666 3.955 11.785 1.00 . A A . 43 TYR HA 1 1 20 36345 1 1 43 TYR HB2 H 1.433 5.807 13.920 1.00 . A A . 43 TYR HB2 1 1 20 36346 1 1 43 TYR HB3 H 0.555 5.190 12.535 1.00 . A A . 43 TYR HB3 1 1 20 36347 1 1 43 TYR HD1 H 1.679 2.338 12.593 1.00 . A A . 43 TYR HD1 1 1 20 36348 1 1 43 TYR HD2 H 0.120 4.871 15.668 1.00 . A A . 43 TYR HD2 1 1 20 36349 1 1 43 TYR HE1 H 0.997 0.294 13.941 1.00 . A A . 43 TYR HE1 1 1 20 36350 1 1 43 TYR HE2 H -0.557 2.818 17.006 1.00 . A A . 43 TYR HE2 1 1 20 36351 1 1 43 TYR HH H -0.981 -0.034 15.836 1.00 . A A . 43 TYR HH 1 1 20 36352 1 1 43 TYR N N 3.680 4.536 13.491 1.00 . A A . 43 TYR N 1 1 20 36353 1 1 43 TYR O O 2.640 7.173 12.188 1.00 . A A . 43 TYR O 1 1 20 36354 1 1 43 TYR OH O -0.168 0.386 16.240 1.00 . A A . 43 TYR OH 1 1 20 36355 1 1 44 ARG C C 3.431 6.829 8.287 1.00 . A A . 44 ARG C 1 1 20 36356 1 1 44 ARG CA C 3.915 7.055 9.721 1.00 . A A . 44 ARG CA 1 1 20 36357 1 1 44 ARG CB C 5.426 7.293 9.710 1.00 . A A . 44 ARG CB 1 1 20 36358 1 1 44 ARG CD C 7.283 8.837 10.436 1.00 . A A . 44 ARG CD 1 1 20 36359 1 1 44 ARG CG C 5.770 8.666 10.292 1.00 . A A . 44 ARG CG 1 1 20 36360 1 1 44 ARG CZ C 8.727 10.580 11.499 1.00 . A A . 44 ARG CZ 1 1 20 36361 1 1 44 ARG H H 3.828 5.025 10.181 1.00 . A A . 44 ARG H 1 1 20 36362 1 1 44 ARG HA H 3.403 7.901 10.179 1.00 . A A . 44 ARG HA 1 1 20 36363 1 1 44 ARG HB2 H 5.925 6.514 10.288 1.00 . A A . 44 ARG HB2 1 1 20 36364 1 1 44 ARG HB3 H 5.802 7.221 8.689 1.00 . A A . 44 ARG HB3 1 1 20 36365 1 1 44 ARG HD2 H 7.740 7.889 10.720 1.00 . A A . 44 ARG HD2 1 1 20 36366 1 1 44 ARG HD3 H 7.718 9.125 9.478 1.00 . A A . 44 ARG HD3 1 1 20 36367 1 1 44 ARG HE H 6.890 10.048 12.155 1.00 . A A . 44 ARG HE 1 1 20 36368 1 1 44 ARG HG2 H 5.371 9.448 9.645 1.00 . A A . 44 ARG HG2 1 1 20 36369 1 1 44 ARG HG3 H 5.293 8.782 11.265 1.00 . A A . 44 ARG HG3 1 1 20 36370 1 1 44 ARG HH11 H 9.566 9.697 9.859 1.00 . A A . 44 ARG HH11 1 1 20 36371 1 1 44 ARG HH12 H 10.541 10.910 10.620 1.00 . A A . 44 ARG HH12 1 1 20 36372 1 1 44 ARG HH21 H 9.704 12.043 12.558 1.00 . A A . 44 ARG HH21 1 1 20 36373 1 1 44 ARG N N 3.571 5.916 10.555 1.00 . A A . 44 ARG N 1 1 20 36374 1 1 44 ARG NE N 7.581 9.868 11.455 1.00 . A A . 44 ARG NE 1 1 20 36375 1 1 44 ARG NH1 N 9.695 10.378 10.580 1.00 . A A . 44 ARG NH1 1 1 20 36376 1 1 44 ARG NH2 N 8.887 11.476 12.455 1.00 . A A . 44 ARG NH2 1 1 20 36377 1 1 44 ARG O O 2.998 5.731 7.940 1.00 . A A . 44 ARG O 1 1 20 36378 1 1 45 LYS C C 4.198 7.156 5.272 1.00 . A A . 45 LYS C 1 1 20 36379 1 1 45 LYS CA C 3.097 7.816 6.105 1.00 . A A . 45 LYS CA 1 1 20 36380 1 1 45 LYS CB C 2.690 9.201 5.599 1.00 . A A . 45 LYS CB 1 1 20 36381 1 1 45 LYS CD C 1.862 10.481 7.608 1.00 . A A . 45 LYS CD 1 1 20 36382 1 1 45 LYS CE C 0.727 11.389 8.085 1.00 . A A . 45 LYS CE 1 1 20 36383 1 1 45 LYS CG C 1.458 9.717 6.345 1.00 . A A . 45 LYS CG 1 1 20 36384 1 1 45 LYS H H 3.875 8.774 7.783 1.00 . A A . 45 LYS H 1 1 20 36385 1 1 45 LYS HA H 2.209 7.185 6.065 1.00 . A A . 45 LYS HA 1 1 20 36386 1 1 45 LYS HB2 H 3.518 9.898 5.730 1.00 . A A . 45 LYS HB2 1 1 20 36387 1 1 45 LYS HB3 H 2.480 9.155 4.530 1.00 . A A . 45 LYS HB3 1 1 20 36388 1 1 45 LYS HD2 H 2.124 9.776 8.396 1.00 . A A . 45 LYS HD2 1 1 20 36389 1 1 45 LYS HD3 H 2.751 11.079 7.406 1.00 . A A . 45 LYS HD3 1 1 20 36390 1 1 45 LYS HE2 H -0.123 11.305 7.409 1.00 . A A . 45 LYS HE2 1 1 20 36391 1 1 45 LYS HE3 H 0.385 11.067 9.069 1.00 . A A . 45 LYS HE3 1 1 20 36392 1 1 45 LYS HG2 H 0.879 10.369 5.691 1.00 . A A . 45 LYS HG2 1 1 20 36393 1 1 45 LYS HG3 H 0.813 8.880 6.613 1.00 . A A . 45 LYS HG3 1 1 20 36394 1 1 45 LYS HZ1 H 2.184 12.878 8.019 1.00 . A A . 45 LYS HZ1 1 1 20 36395 1 1 45 LYS HZ2 H 0.746 13.369 7.434 1.00 . A A . 45 LYS HZ2 1 1 20 36396 1 1 45 LYS N N 3.521 7.885 7.493 1.00 . A A . 45 LYS N 1 1 20 36397 1 1 45 LYS NZ N 1.181 12.797 8.149 1.00 . A A . 45 LYS NZ 1 1 20 36398 1 1 45 LYS O O 5.375 7.478 5.426 1.00 . A A . 45 LYS O 1 1 20 36399 1 1 46 CYS C C 5.451 6.565 2.693 1.00 . A A . 46 CYS C 1 1 20 36400 1 1 46 CYS CA C 4.713 5.536 3.552 1.00 . A A . 46 CYS CA 1 1 20 36401 1 1 46 CYS CB C 4.010 4.479 2.697 1.00 . A A . 46 CYS CB 1 1 20 36402 1 1 46 CYS H H 2.818 5.988 4.289 1.00 . A A . 46 CYS H 1 1 20 36403 1 1 46 CYS HA H 5.406 5.012 4.210 1.00 . A A . 46 CYS HA 1 1 20 36404 1 1 46 CYS HB2 H 3.625 4.957 1.797 1.00 . A A . 46 CYS HB2 1 1 20 36405 1 1 46 CYS HB3 H 4.746 3.742 2.378 1.00 . A A . 46 CYS HB3 1 1 20 36406 1 1 46 CYS N N 3.777 6.244 4.408 1.00 . A A . 46 CYS N 1 1 20 36407 1 1 46 CYS O O 6.678 6.546 2.614 1.00 . A A . 46 CYS O 1 1 20 36408 1 1 46 CYS SG S 2.633 3.609 3.533 1.00 . A A . 46 CYS SG 1 1 20 36409 1 1 47 GLY C C 5.835 9.604 2.059 1.00 . A A . 47 GLY C 1 1 20 36410 1 1 47 GLY CA C 5.237 8.472 1.222 1.00 . A A . 47 GLY CA 1 1 20 36411 1 1 47 GLY H H 3.675 7.446 2.142 1.00 . A A . 47 GLY H 1 1 20 36412 1 1 47 GLY HA2 H 6.008 8.042 0.582 1.00 . A A . 47 GLY HA2 1 1 20 36413 1 1 47 GLY HA3 H 4.464 8.870 0.565 1.00 . A A . 47 GLY HA3 1 1 20 36414 1 1 47 GLY N N 4.672 7.438 2.072 1.00 . A A . 47 GLY N 1 1 20 36415 1 1 47 GLY O O 5.511 10.773 1.852 1.00 . A A . 47 GLY O 1 1 20 36416 1 1 48 THR C C 8.713 10.576 3.299 1.00 . A A . 48 THR C 1 1 20 36417 1 1 48 THR CA C 7.343 10.187 3.858 1.00 . A A . 48 THR CA 1 1 20 36418 1 1 48 THR CB C 7.408 9.589 5.265 1.00 . A A . 48 THR CB 1 1 20 36419 1 1 48 THR CG2 C 8.474 10.256 6.136 1.00 . A A . 48 THR CG2 1 1 20 36420 1 1 48 THR H H 6.955 8.266 3.150 1.00 . A A . 48 THR H 1 1 20 36421 1 1 48 THR HA H 6.736 11.092 3.875 1.00 . A A . 48 THR HA 1 1 20 36422 1 1 48 THR HB H 7.559 8.510 5.222 1.00 . A A . 48 THR HB 1 1 20 36423 1 1 48 THR HG1 H 6.073 10.972 5.821 1.00 . A A . 48 THR HG1 1 1 20 36424 1 1 48 THR HG21 H 8.509 11.323 5.914 1.00 . A A . 48 THR HG21 1 1 20 36425 1 1 48 THR HG22 H 8.226 10.112 7.188 1.00 . A A . 48 THR HG22 1 1 20 36426 1 1 48 THR HG23 H 9.446 9.809 5.927 1.00 . A A . 48 THR HG23 1 1 20 36427 1 1 48 THR N N 6.697 9.219 2.988 1.00 . A A . 48 THR N 1 1 20 36428 1 1 48 THR O O 9.493 9.712 2.902 1.00 . A A . 48 THR O 1 1 20 36429 1 1 48 THR OG1 O 6.176 9.978 5.865 1.00 . A A . 48 THR OG1 1 1 20 36430 1 1 49 ALA C C 11.379 11.716 3.525 1.00 . A A . 49 ALA C 1 1 20 36431 1 1 49 ALA CA C 10.225 12.391 2.781 1.00 . A A . 49 ALA CA 1 1 20 36432 1 1 49 ALA CB C 10.250 13.914 2.925 1.00 . A A . 49 ALA CB 1 1 20 36433 1 1 49 ALA H H 8.323 12.573 3.610 1.00 . A A . 49 ALA H 1 1 20 36434 1 1 49 ALA HA H 10.288 12.137 1.723 1.00 . A A . 49 ALA HA 1 1 20 36435 1 1 49 ALA HB1 H 9.305 14.254 3.347 1.00 . A A . 49 ALA HB1 1 1 20 36436 1 1 49 ALA HB2 H 11.068 14.203 3.586 1.00 . A A . 49 ALA HB2 1 1 20 36437 1 1 49 ALA HB3 H 10.397 14.369 1.945 1.00 . A A . 49 ALA HB3 1 1 20 36438 1 1 49 ALA N N 8.963 11.877 3.286 1.00 . A A . 49 ALA N 1 1 20 36439 1 1 49 ALA O O 11.626 12.009 4.694 1.00 . A A . 49 ALA O 1 1 20 36440 1 1 50 GLY C C 12.909 8.598 3.422 1.00 . A A . 50 GLY C 1 1 20 36441 1 1 50 GLY CA C 13.178 10.104 3.395 1.00 . A A . 50 GLY CA 1 1 20 36442 1 1 50 GLY H H 11.850 10.591 1.867 1.00 . A A . 50 GLY H 1 1 20 36443 1 1 50 GLY HA2 H 14.081 10.306 2.818 1.00 . A A . 50 GLY HA2 1 1 20 36444 1 1 50 GLY HA3 H 13.361 10.462 4.408 1.00 . A A . 50 GLY HA3 1 1 20 36445 1 1 50 GLY N N 12.056 10.823 2.817 1.00 . A A . 50 GLY N 1 1 20 36446 1 1 50 GLY O O 13.819 7.805 3.659 1.00 . A A . 50 GLY O 1 1 20 36447 1 1 51 CYS C C 11.046 6.420 1.715 1.00 . A A . 51 CYS C 1 1 20 36448 1 1 51 CYS CA C 11.255 6.852 3.168 1.00 . A A . 51 CYS CA 1 1 20 36449 1 1 51 CYS CB C 10.005 6.618 4.018 1.00 . A A . 51 CYS CB 1 1 20 36450 1 1 51 CYS H H 10.921 8.900 2.983 1.00 . A A . 51 CYS H 1 1 20 36451 1 1 51 CYS HA H 12.069 6.291 3.626 1.00 . A A . 51 CYS HA 1 1 20 36452 1 1 51 CYS HB2 H 9.203 7.280 3.691 1.00 . A A . 51 CYS HB2 1 1 20 36453 1 1 51 CYS HB3 H 9.649 5.596 3.884 1.00 . A A . 51 CYS HB3 1 1 20 36454 1 1 51 CYS N N 11.655 8.249 3.175 1.00 . A A . 51 CYS N 1 1 20 36455 1 1 51 CYS O O 12.007 6.111 1.012 1.00 . A A . 51 CYS O 1 1 20 36456 1 1 51 CYS SG S 10.383 6.920 5.783 1.00 . A A . 51 CYS SG 1 1 20 36457 1 1 52 HIS C C 9.193 7.272 -0.894 1.00 . A A . 52 HIS C 1 1 20 36458 1 1 52 HIS CA C 9.438 6.022 -0.047 1.00 . A A . 52 HIS CA 1 1 20 36459 1 1 52 HIS CB C 8.246 5.062 -0.048 1.00 . A A . 52 HIS CB 1 1 20 36460 1 1 52 HIS CD2 C 8.129 3.160 1.741 1.00 . A A . 52 HIS CD2 1 1 20 36461 1 1 52 HIS CE1 C 9.417 1.705 0.734 1.00 . A A . 52 HIS CE1 1 1 20 36462 1 1 52 HIS CG C 8.542 3.714 0.565 1.00 . A A . 52 HIS CG 1 1 20 36463 1 1 52 HIS H H 9.009 6.664 1.888 1.00 . A A . 52 HIS H 1 1 20 36464 1 1 52 HIS HA H 10.298 5.484 -0.447 1.00 . A A . 52 HIS HA 1 1 20 36465 1 1 52 HIS HB2 H 7.421 5.523 0.494 1.00 . A A . 52 HIS HB2 1 1 20 36466 1 1 52 HIS HB3 H 7.911 4.917 -1.075 1.00 . A A . 52 HIS HB3 1 1 20 36467 1 1 52 HIS HD1 H 9.812 2.882 -0.928 1.00 . A A . 52 HIS HD1 1 1 20 36468 1 1 52 HIS HD2 H 7.476 3.634 2.474 1.00 . A A . 52 HIS HD2 1 1 20 36469 1 1 52 HIS HE1 H 9.977 0.794 0.528 1.00 . A A . 52 HIS HE1 1 1 20 36470 1 1 52 HIS N N 9.785 6.411 1.309 1.00 . A A . 52 HIS N 1 1 20 36471 1 1 52 HIS ND1 N 9.353 2.774 -0.047 1.00 . A A . 52 HIS ND1 1 1 20 36472 1 1 52 HIS NE2 N 8.657 1.946 1.841 1.00 . A A . 52 HIS NE2 1 1 20 36473 1 1 52 HIS O O 8.048 7.669 -1.104 1.00 . A A . 52 HIS O 1 1 20 36474 1 1 53 ASP C C 11.273 8.992 -3.270 1.00 . A A . 53 ASP C 1 1 20 36475 1 1 53 ASP CA C 10.206 9.055 -2.176 1.00 . A A . 53 ASP CA 1 1 20 36476 1 1 53 ASP CB C 10.459 10.312 -1.341 1.00 . A A . 53 ASP CB 1 1 20 36477 1 1 53 ASP CG C 10.957 11.524 -2.130 1.00 . A A . 53 ASP CG 1 1 20 36478 1 1 53 ASP H H 11.215 7.528 -1.181 1.00 . A A . 53 ASP H 1 1 20 36479 1 1 53 ASP HA H 9.194 9.057 -2.580 1.00 . A A . 53 ASP HA 1 1 20 36480 1 1 53 ASP HB2 H 9.534 10.583 -0.831 1.00 . A A . 53 ASP HB2 1 1 20 36481 1 1 53 ASP HB3 H 11.191 10.075 -0.568 1.00 . A A . 53 ASP HB3 1 1 20 36482 1 1 53 ASP N N 10.288 7.858 -1.357 1.00 . A A . 53 ASP N 1 1 20 36483 1 1 53 ASP O O 12.342 9.586 -3.135 1.00 . A A . 53 ASP O 1 1 20 36484 1 1 53 ASP OD1 O 10.118 12.125 -2.836 1.00 . A A . 53 ASP OD1 1 1 20 36485 1 1 53 ASP OD2 O 12.165 11.822 -2.011 1.00 . A A . 53 ASP OD2 1 1 20 36486 1 1 54 SER C C 11.305 8.833 -6.681 1.00 . A A . 54 SER C 1 1 20 36487 1 1 54 SER CA C 11.863 8.120 -5.448 1.00 . A A . 54 SER CA 1 1 20 36488 1 1 54 SER CB C 12.119 6.644 -5.758 1.00 . A A . 54 SER CB 1 1 20 36489 1 1 54 SER H H 10.074 7.789 -4.433 1.00 . A A . 54 SER H 1 1 20 36490 1 1 54 SER HA H 12.792 8.589 -5.123 1.00 . A A . 54 SER HA 1 1 20 36491 1 1 54 SER HB2 H 12.219 6.089 -4.825 1.00 . A A . 54 SER HB2 1 1 20 36492 1 1 54 SER HB3 H 11.260 6.230 -6.285 1.00 . A A . 54 SER HB3 1 1 20 36493 1 1 54 SER HG H 13.327 5.523 -6.894 1.00 . A A . 54 SER HG 1 1 20 36494 1 1 54 SER N N 10.946 8.268 -4.331 1.00 . A A . 54 SER N 1 1 20 36495 1 1 54 SER O O 12.064 9.289 -7.535 1.00 . A A . 54 SER O 1 1 20 36496 1 1 54 SER OG O 13.292 6.460 -6.546 1.00 . A A . 54 SER OG 1 1 20 36497 1 1 55 MET C C 9.930 9.126 -9.184 1.00 . A A . 55 MET C 1 1 20 36498 1 1 55 MET CA C 9.314 9.555 -7.850 1.00 . A A . 55 MET CA 1 1 20 36499 1 1 55 MET CB C 9.428 11.073 -7.700 1.00 . A A . 55 MET CB 1 1 20 36500 1 1 55 MET CE C 7.185 10.057 -5.158 1.00 . A A . 55 MET CE 1 1 20 36501 1 1 55 MET CG C 8.128 11.669 -7.156 1.00 . A A . 55 MET CG 1 1 20 36502 1 1 55 MET H H 9.373 8.532 -6.036 1.00 . A A . 55 MET H 1 1 20 36503 1 1 55 MET HA H 8.276 9.227 -7.800 1.00 . A A . 55 MET HA 1 1 20 36504 1 1 55 MET HB2 H 10.252 11.315 -7.029 1.00 . A A . 55 MET HB2 1 1 20 36505 1 1 55 MET HB3 H 9.661 11.521 -8.666 1.00 . A A . 55 MET HB3 1 1 20 36506 1 1 55 MET HE1 H 6.938 9.640 -6.135 1.00 . A A . 55 MET HE1 1 1 20 36507 1 1 55 MET HE2 H 7.786 9.340 -4.599 1.00 . A A . 55 MET HE2 1 1 20 36508 1 1 55 MET HE3 H 6.267 10.267 -4.610 1.00 . A A . 55 MET HE3 1 1 20 36509 1 1 55 MET HG2 H 8.034 12.708 -7.471 1.00 . A A . 55 MET HG2 1 1 20 36510 1 1 55 MET HG3 H 7.272 11.133 -7.568 1.00 . A A . 55 MET HG3 1 1 20 36511 1 1 55 MET N N 9.983 8.906 -6.735 1.00 . A A . 55 MET N 1 1 20 36512 1 1 55 MET O O 10.017 9.923 -10.116 1.00 . A A . 55 MET O 1 1 20 36513 1 1 55 MET SD S 8.109 11.569 -5.374 1.00 . A A . 55 MET SD 1 1 20 36514 1 1 56 ASP C C 9.973 6.346 -11.094 1.00 . A A . 56 ASP C 1 1 20 36515 1 1 56 ASP CA C 10.948 7.324 -10.435 1.00 . A A . 56 ASP CA 1 1 20 36516 1 1 56 ASP CB C 12.234 6.561 -10.108 1.00 . A A . 56 ASP CB 1 1 20 36517 1 1 56 ASP CG C 13.237 6.462 -11.259 1.00 . A A . 56 ASP CG 1 1 20 36518 1 1 56 ASP H H 10.268 7.226 -8.468 1.00 . A A . 56 ASP H 1 1 20 36519 1 1 56 ASP HA H 11.162 8.188 -11.064 1.00 . A A . 56 ASP HA 1 1 20 36520 1 1 56 ASP HB2 H 12.721 7.046 -9.262 1.00 . A A . 56 ASP HB2 1 1 20 36521 1 1 56 ASP HB3 H 11.969 5.553 -9.789 1.00 . A A . 56 ASP HB3 1 1 20 36522 1 1 56 ASP N N 10.342 7.868 -9.231 1.00 . A A . 56 ASP N 1 1 20 36523 1 1 56 ASP O O 9.872 6.296 -12.319 1.00 . A A . 56 ASP O 1 1 20 36524 1 1 56 ASP OD1 O 12.772 6.464 -12.419 1.00 . A A . 56 ASP OD1 1 1 20 36525 1 1 56 ASP OD2 O 14.446 6.386 -10.952 1.00 . A A . 56 ASP OD2 1 1 20 36526 1 1 57 LYS C C 9.059 3.477 -11.434 1.00 . A A . 57 LYS C 1 1 20 36527 1 1 57 LYS CA C 8.317 4.620 -10.738 1.00 . A A . 57 LYS CA 1 1 20 36528 1 1 57 LYS CB C 7.267 5.299 -11.621 1.00 . A A . 57 LYS CB 1 1 20 36529 1 1 57 LYS CD C 6.444 3.748 -13.431 1.00 . A A . 57 LYS CD 1 1 20 36530 1 1 57 LYS CE C 5.962 4.716 -14.513 1.00 . A A . 57 LYS CE 1 1 20 36531 1 1 57 LYS CG C 6.175 4.310 -12.033 1.00 . A A . 57 LYS CG 1 1 20 36532 1 1 57 LYS H H 9.368 5.641 -9.257 1.00 . A A . 57 LYS H 1 1 20 36533 1 1 57 LYS HA H 7.795 4.215 -9.871 1.00 . A A . 57 LYS HA 1 1 20 36534 1 1 57 LYS HB2 H 6.821 6.136 -11.084 1.00 . A A . 57 LYS HB2 1 1 20 36535 1 1 57 LYS HB3 H 7.746 5.710 -12.510 1.00 . A A . 57 LYS HB3 1 1 20 36536 1 1 57 LYS HD2 H 7.511 3.562 -13.553 1.00 . A A . 57 LYS HD2 1 1 20 36537 1 1 57 LYS HD3 H 5.938 2.789 -13.545 1.00 . A A . 57 LYS HD3 1 1 20 36538 1 1 57 LYS HE2 H 5.056 4.328 -14.979 1.00 . A A . 57 LYS HE2 1 1 20 36539 1 1 57 LYS HE3 H 5.704 5.675 -14.063 1.00 . A A . 57 LYS HE3 1 1 20 36540 1 1 57 LYS HG2 H 6.127 3.494 -11.312 1.00 . A A . 57 LYS HG2 1 1 20 36541 1 1 57 LYS HG3 H 5.205 4.807 -12.017 1.00 . A A . 57 LYS HG3 1 1 20 36542 1 1 57 LYS HZ1 H 7.923 5.063 -15.126 1.00 . A A . 57 LYS HZ1 1 1 20 36543 1 1 57 LYS HZ2 H 7.096 4.106 -16.151 1.00 . A A . 57 LYS HZ2 1 1 20 36544 1 1 57 LYS N N 9.280 5.593 -10.252 1.00 . A A . 57 LYS N 1 1 20 36545 1 1 57 LYS NZ N 7.010 4.910 -15.540 1.00 . A A . 57 LYS NZ 1 1 20 36546 1 1 57 LYS O O 9.047 2.343 -10.958 1.00 . A A . 57 LYS O 1 1 20 36547 1 1 58 LYS C C 11.745 2.516 -12.592 1.00 . A A . 58 LYS C 1 1 20 36548 1 1 58 LYS CA C 10.435 2.833 -13.316 1.00 . A A . 58 LYS CA 1 1 20 36549 1 1 58 LYS CB C 10.628 3.310 -14.756 1.00 . A A . 58 LYS CB 1 1 20 36550 1 1 58 LYS CD C 11.343 2.349 -16.976 1.00 . A A . 58 LYS CD 1 1 20 36551 1 1 58 LYS CE C 11.384 1.079 -17.828 1.00 . A A . 58 LYS CE 1 1 20 36552 1 1 58 LYS CG C 10.456 2.155 -15.745 1.00 . A A . 58 LYS CG 1 1 20 36553 1 1 58 LYS H H 9.694 4.741 -12.930 1.00 . A A . 58 LYS H 1 1 20 36554 1 1 58 LYS HA H 9.834 1.924 -13.355 1.00 . A A . 58 LYS HA 1 1 20 36555 1 1 58 LYS HB2 H 9.909 4.097 -14.983 1.00 . A A . 58 LYS HB2 1 1 20 36556 1 1 58 LYS HB3 H 11.622 3.744 -14.869 1.00 . A A . 58 LYS HB3 1 1 20 36557 1 1 58 LYS HD2 H 10.967 3.180 -17.573 1.00 . A A . 58 LYS HD2 1 1 20 36558 1 1 58 LYS HD3 H 12.353 2.614 -16.663 1.00 . A A . 58 LYS HD3 1 1 20 36559 1 1 58 LYS HE2 H 10.839 0.280 -17.326 1.00 . A A . 58 LYS HE2 1 1 20 36560 1 1 58 LYS HE3 H 10.884 1.257 -18.780 1.00 . A A . 58 LYS HE3 1 1 20 36561 1 1 58 LYS HG2 H 10.706 1.213 -15.256 1.00 . A A . 58 LYS HG2 1 1 20 36562 1 1 58 LYS HG3 H 9.412 2.087 -16.052 1.00 . A A . 58 LYS HG3 1 1 20 36563 1 1 58 LYS HZ1 H 13.370 0.813 -17.254 1.00 . A A . 58 LYS HZ1 1 1 20 36564 1 1 58 LYS HZ2 H 12.851 -0.325 -18.297 1.00 . A A . 58 LYS HZ2 1 1 20 36565 1 1 58 LYS N N 9.689 3.816 -12.550 1.00 . A A . 58 LYS N 1 1 20 36566 1 1 58 LYS NZ N 12.783 0.660 -18.067 1.00 . A A . 58 LYS NZ 1 1 20 36567 1 1 58 LYS O O 12.826 2.694 -13.151 1.00 . A A . 58 LYS O 1 1 20 36568 1 1 59 ASP C C 12.322 0.833 -9.378 1.00 . A A . 59 ASP C 1 1 20 36569 1 1 59 ASP CA C 12.764 1.708 -10.552 1.00 . A A . 59 ASP CA 1 1 20 36570 1 1 59 ASP CB C 13.430 2.963 -9.983 1.00 . A A . 59 ASP CB 1 1 20 36571 1 1 59 ASP CG C 14.953 3.004 -10.118 1.00 . A A . 59 ASP CG 1 1 20 36572 1 1 59 ASP H H 10.722 1.909 -10.912 1.00 . A A . 59 ASP H 1 1 20 36573 1 1 59 ASP HA H 13.440 1.187 -11.230 1.00 . A A . 59 ASP HA 1 1 20 36574 1 1 59 ASP HB2 H 13.012 3.836 -10.483 1.00 . A A . 59 ASP HB2 1 1 20 36575 1 1 59 ASP HB3 H 13.172 3.046 -8.928 1.00 . A A . 59 ASP HB3 1 1 20 36576 1 1 59 ASP N N 11.605 2.051 -11.359 1.00 . A A . 59 ASP N 1 1 20 36577 1 1 59 ASP O O 11.903 1.345 -8.341 1.00 . A A . 59 ASP O 1 1 20 36578 1 1 59 ASP OD1 O 15.416 3.239 -11.256 1.00 . A A . 59 ASP OD1 1 1 20 36579 1 1 59 ASP OD2 O 15.621 2.801 -9.081 1.00 . A A . 59 ASP OD2 1 1 20 36580 1 1 60 LYS C C 13.256 -1.720 -7.661 1.00 . A A . 60 LYS C 1 1 20 36581 1 1 60 LYS CA C 12.047 -1.423 -8.550 1.00 . A A . 60 LYS CA 1 1 20 36582 1 1 60 LYS CB C 11.425 -2.671 -9.179 1.00 . A A . 60 LYS CB 1 1 20 36583 1 1 60 LYS CD C 10.071 -2.961 -11.287 1.00 . A A . 60 LYS CD 1 1 20 36584 1 1 60 LYS CE C 8.647 -3.387 -11.650 1.00 . A A . 60 LYS CE 1 1 20 36585 1 1 60 LYS CG C 10.115 -2.330 -9.894 1.00 . A A . 60 LYS CG 1 1 20 36586 1 1 60 LYS H H 12.773 -0.880 -10.426 1.00 . A A . 60 LYS H 1 1 20 36587 1 1 60 LYS HA H 11.277 -0.951 -7.940 1.00 . A A . 60 LYS HA 1 1 20 36588 1 1 60 LYS HB2 H 12.125 -3.114 -9.887 1.00 . A A . 60 LYS HB2 1 1 20 36589 1 1 60 LYS HB3 H 11.239 -3.417 -8.407 1.00 . A A . 60 LYS HB3 1 1 20 36590 1 1 60 LYS HD2 H 10.440 -2.248 -12.024 1.00 . A A . 60 LYS HD2 1 1 20 36591 1 1 60 LYS HD3 H 10.733 -3.826 -11.320 1.00 . A A . 60 LYS HD3 1 1 20 36592 1 1 60 LYS HE2 H 7.953 -3.054 -10.878 1.00 . A A . 60 LYS HE2 1 1 20 36593 1 1 60 LYS HE3 H 8.344 -2.907 -12.580 1.00 . A A . 60 LYS HE3 1 1 20 36594 1 1 60 LYS HG2 H 9.271 -2.685 -9.302 1.00 . A A . 60 LYS HG2 1 1 20 36595 1 1 60 LYS HG3 H 10.013 -1.248 -9.977 1.00 . A A . 60 LYS HG3 1 1 20 36596 1 1 60 LYS HZ1 H 7.661 -5.218 -11.520 1.00 . A A . 60 LYS HZ1 1 1 20 36597 1 1 60 LYS HZ2 H 8.722 -5.154 -12.753 1.00 . A A . 60 LYS HZ2 1 1 20 36598 1 1 60 LYS N N 12.431 -0.472 -9.580 1.00 . A A . 60 LYS N 1 1 20 36599 1 1 60 LYS NZ N 8.568 -4.858 -11.796 1.00 . A A . 60 LYS NZ 1 1 20 36600 1 1 60 LYS O O 14.354 -1.960 -8.159 1.00 . A A . 60 LYS O 1 1 20 36601 1 1 61 SER C C 13.503 -1.903 -3.973 1.00 . A A . 61 SER C 1 1 20 36602 1 1 61 SER CA C 14.067 -1.958 -5.394 1.00 . A A . 61 SER CA 1 1 20 36603 1 1 61 SER CB C 15.216 -0.959 -5.549 1.00 . A A . 61 SER CB 1 1 20 36604 1 1 61 SER H H 12.116 -1.499 -5.961 1.00 . A A . 61 SER H 1 1 20 36605 1 1 61 SER HA H 14.425 -2.961 -5.625 1.00 . A A . 61 SER HA 1 1 20 36606 1 1 61 SER HB2 H 15.149 -0.477 -6.524 1.00 . A A . 61 SER HB2 1 1 20 36607 1 1 61 SER HB3 H 15.118 -0.175 -4.798 1.00 . A A . 61 SER HB3 1 1 20 36608 1 1 61 SER HG H 16.977 -1.556 -6.289 1.00 . A A . 61 SER HG 1 1 20 36609 1 1 61 SER N N 13.012 -1.694 -6.358 1.00 . A A . 61 SER N 1 1 20 36610 1 1 61 SER O O 13.404 -2.928 -3.301 1.00 . A A . 61 SER O 1 1 20 36611 1 1 61 SER OG O 16.489 -1.586 -5.416 1.00 . A A . 61 SER OG 1 1 20 36612 1 1 62 ALA C C 12.164 0.967 -2.078 1.00 . A A . 62 ALA C 1 1 20 36613 1 1 62 ALA CA C 12.597 -0.493 -2.229 1.00 . A A . 62 ALA CA 1 1 20 36614 1 1 62 ALA CB C 13.631 -0.906 -1.179 1.00 . A A . 62 ALA CB 1 1 20 36615 1 1 62 ALA H H 13.232 0.133 -4.112 1.00 . A A . 62 ALA H 1 1 20 36616 1 1 62 ALA HA H 11.722 -1.135 -2.132 1.00 . A A . 62 ALA HA 1 1 20 36617 1 1 62 ALA HB1 H 14.345 -1.598 -1.625 1.00 . A A . 62 ALA HB1 1 1 20 36618 1 1 62 ALA HB2 H 14.157 -0.022 -0.820 1.00 . A A . 62 ALA HB2 1 1 20 36619 1 1 62 ALA HB3 H 13.126 -1.392 -0.345 1.00 . A A . 62 ALA HB3 1 1 20 36620 1 1 62 ALA N N 13.148 -0.695 -3.558 1.00 . A A . 62 ALA N 1 1 20 36621 1 1 62 ALA O O 11.094 1.248 -1.541 1.00 . A A . 62 ALA O 1 1 20 36622 1 1 63 LYS C C 11.608 3.625 -3.460 1.00 . A A . 63 LYS C 1 1 20 36623 1 1 63 LYS CA C 12.737 3.281 -2.486 1.00 . A A . 63 LYS CA 1 1 20 36624 1 1 63 LYS CB C 14.014 4.092 -2.714 1.00 . A A . 63 LYS CB 1 1 20 36625 1 1 63 LYS CD C 16.094 3.921 -4.131 1.00 . A A . 63 LYS CD 1 1 20 36626 1 1 63 LYS CE C 16.696 2.523 -3.977 1.00 . A A . 63 LYS CE 1 1 20 36627 1 1 63 LYS CG C 14.565 3.864 -4.123 1.00 . A A . 63 LYS CG 1 1 20 36628 1 1 63 LYS H H 13.887 1.620 -2.997 1.00 . A A . 63 LYS H 1 1 20 36629 1 1 63 LYS HA H 12.397 3.494 -1.473 1.00 . A A . 63 LYS HA 1 1 20 36630 1 1 63 LYS HB2 H 13.808 5.152 -2.568 1.00 . A A . 63 LYS HB2 1 1 20 36631 1 1 63 LYS HB3 H 14.765 3.809 -1.976 1.00 . A A . 63 LYS HB3 1 1 20 36632 1 1 63 LYS HD2 H 16.440 4.369 -5.062 1.00 . A A . 63 LYS HD2 1 1 20 36633 1 1 63 LYS HD3 H 16.441 4.562 -3.320 1.00 . A A . 63 LYS HD3 1 1 20 36634 1 1 63 LYS HE2 H 16.169 1.820 -4.622 1.00 . A A . 63 LYS HE2 1 1 20 36635 1 1 63 LYS HE3 H 17.737 2.531 -4.298 1.00 . A A . 63 LYS HE3 1 1 20 36636 1 1 63 LYS HG2 H 14.232 2.895 -4.495 1.00 . A A . 63 LYS HG2 1 1 20 36637 1 1 63 LYS HG3 H 14.166 4.619 -4.800 1.00 . A A . 63 LYS HG3 1 1 20 36638 1 1 63 LYS HZ1 H 16.947 2.778 -1.924 1.00 . A A . 63 LYS HZ1 1 1 20 36639 1 1 63 LYS HZ2 H 15.655 1.860 -2.297 1.00 . A A . 63 LYS HZ2 1 1 20 36640 1 1 63 LYS N N 13.018 1.857 -2.561 1.00 . A A . 63 LYS N 1 1 20 36641 1 1 63 LYS NZ N 16.608 2.073 -2.569 1.00 . A A . 63 LYS NZ 1 1 20 36642 1 1 63 LYS O O 11.117 4.753 -3.472 1.00 . A A . 63 LYS O 1 1 20 36643 1 1 64 GLY C C 8.796 2.810 -4.551 1.00 . A A . 64 GLY C 1 1 20 36644 1 1 64 GLY CA C 10.169 2.817 -5.227 1.00 . A A . 64 GLY CA 1 1 20 36645 1 1 64 GLY H H 11.635 1.719 -4.236 1.00 . A A . 64 GLY H 1 1 20 36646 1 1 64 GLY HA2 H 10.314 3.760 -5.754 1.00 . A A . 64 GLY HA2 1 1 20 36647 1 1 64 GLY HA3 H 10.214 2.025 -5.974 1.00 . A A . 64 GLY HA3 1 1 20 36648 1 1 64 GLY N N 11.230 2.633 -4.252 1.00 . A A . 64 GLY N 1 1 20 36649 1 1 64 GLY O O 8.187 1.755 -4.386 1.00 . A A . 64 GLY O 1 1 20 36650 1 1 65 TYR C C 5.961 3.432 -4.315 1.00 . A A . 65 TYR C 1 1 20 36651 1 1 65 TYR CA C 7.060 4.145 -3.525 1.00 . A A . 65 TYR CA 1 1 20 36652 1 1 65 TYR CB C 6.763 5.646 -3.504 1.00 . A A . 65 TYR CB 1 1 20 36653 1 1 65 TYR CD1 C 4.989 5.940 -1.737 1.00 . A A . 65 TYR CD1 1 1 20 36654 1 1 65 TYR CD2 C 4.399 6.357 -4.016 1.00 . A A . 65 TYR CD2 1 1 20 36655 1 1 65 TYR CE1 C 3.646 6.266 -1.330 1.00 . A A . 65 TYR CE1 1 1 20 36656 1 1 65 TYR CE2 C 3.057 6.683 -3.609 1.00 . A A . 65 TYR CE2 1 1 20 36657 1 1 65 TYR CG C 5.337 5.993 -3.071 1.00 . A A . 65 TYR CG 1 1 20 36658 1 1 65 TYR CZ C 2.747 6.622 -2.286 1.00 . A A . 65 TYR CZ 1 1 20 36659 1 1 65 TYR H H 8.850 4.855 -4.318 1.00 . A A . 65 TYR H 1 1 20 36660 1 1 65 TYR HA H 7.134 3.697 -2.534 1.00 . A A . 65 TYR HA 1 1 20 36661 1 1 65 TYR HB2 H 7.466 6.135 -2.828 1.00 . A A . 65 TYR HB2 1 1 20 36662 1 1 65 TYR HB3 H 6.940 6.055 -4.498 1.00 . A A . 65 TYR HB3 1 1 20 36663 1 1 65 TYR HD1 H 5.730 5.652 -0.991 1.00 . A A . 65 TYR HD1 1 1 20 36664 1 1 65 TYR HD2 H 4.675 6.399 -5.070 1.00 . A A . 65 TYR HD2 1 1 20 36665 1 1 65 TYR HE1 H 3.358 6.229 -0.280 1.00 . A A . 65 TYR HE1 1 1 20 36666 1 1 65 TYR HE2 H 2.307 6.973 -4.345 1.00 . A A . 65 TYR HE2 1 1 20 36667 1 1 65 TYR HH H 1.452 7.856 -1.525 1.00 . A A . 65 TYR HH 1 1 20 36668 1 1 65 TYR N N 8.349 4.001 -4.180 1.00 . A A . 65 TYR N 1 1 20 36669 1 1 65 TYR O O 5.055 2.840 -3.730 1.00 . A A . 65 TYR O 1 1 20 36670 1 1 65 TYR OH O 1.479 6.930 -1.902 1.00 . A A . 65 TYR OH 1 1 20 36671 1 1 66 TYR C C 5.429 1.399 -6.712 1.00 . A A . 66 TYR C 1 1 20 36672 1 1 66 TYR CA C 5.104 2.881 -6.509 1.00 . A A . 66 TYR CA 1 1 20 36673 1 1 66 TYR CB C 5.215 3.604 -7.852 1.00 . A A . 66 TYR CB 1 1 20 36674 1 1 66 TYR CD1 C 5.472 1.798 -9.592 1.00 . A A . 66 TYR CD1 1 1 20 36675 1 1 66 TYR CD2 C 3.443 3.060 -9.560 1.00 . A A . 66 TYR CD2 1 1 20 36676 1 1 66 TYR CE1 C 4.981 1.035 -10.711 1.00 . A A . 66 TYR CE1 1 1 20 36677 1 1 66 TYR CE2 C 2.951 2.298 -10.679 1.00 . A A . 66 TYR CE2 1 1 20 36678 1 1 66 TYR CG C 4.693 2.794 -9.040 1.00 . A A . 66 TYR CG 1 1 20 36679 1 1 66 TYR CZ C 3.744 1.323 -11.198 1.00 . A A . 66 TYR CZ 1 1 20 36680 1 1 66 TYR H H 6.817 3.994 -6.101 1.00 . A A . 66 TYR H 1 1 20 36681 1 1 66 TYR HA H 4.123 2.969 -6.042 1.00 . A A . 66 TYR HA 1 1 20 36682 1 1 66 TYR HB2 H 4.664 4.543 -7.795 1.00 . A A . 66 TYR HB2 1 1 20 36683 1 1 66 TYR HB3 H 6.260 3.859 -8.031 1.00 . A A . 66 TYR HB3 1 1 20 36684 1 1 66 TYR HD1 H 6.460 1.588 -9.182 1.00 . A A . 66 TYR HD1 1 1 20 36685 1 1 66 TYR HD2 H 2.827 3.847 -9.124 1.00 . A A . 66 TYR HD2 1 1 20 36686 1 1 66 TYR HE1 H 5.585 0.246 -11.156 1.00 . A A . 66 TYR HE1 1 1 20 36687 1 1 66 TYR HE2 H 1.965 2.497 -11.099 1.00 . A A . 66 TYR HE2 1 1 20 36688 1 1 66 TYR HH H 2.980 -0.301 -11.948 1.00 . A A . 66 TYR HH 1 1 20 36689 1 1 66 TYR N N 6.077 3.511 -5.633 1.00 . A A . 66 TYR N 1 1 20 36690 1 1 66 TYR O O 4.718 0.697 -7.430 1.00 . A A . 66 TYR O 1 1 20 36691 1 1 66 TYR OH O 3.280 0.603 -12.255 1.00 . A A . 66 TYR OH 1 1 20 36692 1 1 67 HIS C C 6.562 -1.164 -4.886 1.00 . A A . 67 HIS C 1 1 20 36693 1 1 67 HIS CA C 6.931 -0.417 -6.169 1.00 . A A . 67 HIS CA 1 1 20 36694 1 1 67 HIS CB C 8.423 -0.502 -6.497 1.00 . A A . 67 HIS CB 1 1 20 36695 1 1 67 HIS CD2 C 9.517 -1.724 -4.461 1.00 . A A . 67 HIS CD2 1 1 20 36696 1 1 67 HIS CE1 C 10.176 -3.533 -5.501 1.00 . A A . 67 HIS CE1 1 1 20 36697 1 1 67 HIS CG C 9.149 -1.609 -5.769 1.00 . A A . 67 HIS CG 1 1 20 36698 1 1 67 HIS H H 7.076 1.545 -5.486 1.00 . A A . 67 HIS H 1 1 20 36699 1 1 67 HIS HA H 6.382 -0.854 -7.004 1.00 . A A . 67 HIS HA 1 1 20 36700 1 1 67 HIS HB2 H 8.541 -0.649 -7.570 1.00 . A A . 67 HIS HB2 1 1 20 36701 1 1 67 HIS HB3 H 8.893 0.450 -6.251 1.00 . A A . 67 HIS HB3 1 1 20 36702 1 1 67 HIS HD1 H 9.458 -2.982 -7.368 1.00 . A A . 67 HIS HD1 1 1 20 36703 1 1 67 HIS HD2 H 9.333 -0.985 -3.681 1.00 . A A . 67 HIS HD2 1 1 20 36704 1 1 67 HIS HE1 H 10.621 -4.510 -5.688 1.00 . A A . 67 HIS HE1 1 1 20 36705 1 1 67 HIS N N 6.503 0.968 -6.068 1.00 . A A . 67 HIS N 1 1 20 36706 1 1 67 HIS ND1 N 9.578 -2.764 -6.399 1.00 . A A . 67 HIS ND1 1 1 20 36707 1 1 67 HIS NE2 N 10.136 -2.887 -4.300 1.00 . A A . 67 HIS NE2 1 1 20 36708 1 1 67 HIS O O 6.692 -2.385 -4.815 1.00 . A A . 67 HIS O 1 1 20 36709 1 1 68 VAL C C 4.193 -0.993 -2.526 1.00 . A A . 68 VAL C 1 1 20 36710 1 1 68 VAL CA C 5.719 -0.973 -2.627 1.00 . A A . 68 VAL CA 1 1 20 36711 1 1 68 VAL CB C 6.384 -0.204 -1.484 1.00 . A A . 68 VAL CB 1 1 20 36712 1 1 68 VAL CG1 C 7.828 -0.665 -1.280 1.00 . A A . 68 VAL CG1 1 1 20 36713 1 1 68 VAL CG2 C 6.320 1.306 -1.728 1.00 . A A . 68 VAL CG2 1 1 20 36714 1 1 68 VAL H H 6.004 0.594 -3.971 1.00 . A A . 68 VAL H 1 1 20 36715 1 1 68 VAL HA H 6.086 -1.999 -2.602 1.00 . A A . 68 VAL HA 1 1 20 36716 1 1 68 VAL HB H 5.831 -0.418 -0.569 1.00 . A A . 68 VAL HB 1 1 20 36717 1 1 68 VAL HG11 H 7.877 -1.751 -1.359 1.00 . A A . 68 VAL HG11 1 1 20 36718 1 1 68 VAL HG12 H 8.465 -0.216 -2.043 1.00 . A A . 68 VAL HG12 1 1 20 36719 1 1 68 VAL HG13 H 8.172 -0.357 -0.292 1.00 . A A . 68 VAL HG13 1 1 20 36720 1 1 68 VAL HG21 H 5.291 1.596 -1.941 1.00 . A A . 68 VAL HG21 1 1 20 36721 1 1 68 VAL HG22 H 6.669 1.832 -0.840 1.00 . A A . 68 VAL HG22 1 1 20 36722 1 1 68 VAL HG23 H 6.954 1.564 -2.576 1.00 . A A . 68 VAL HG23 1 1 20 36723 1 1 68 VAL N N 6.108 -0.399 -3.904 1.00 . A A . 68 VAL N 1 1 20 36724 1 1 68 VAL O O 3.641 -1.314 -1.474 1.00 . A A . 68 VAL O 1 1 20 36725 1 1 69 MET C C 1.572 -1.548 -4.778 1.00 . A A . 69 MET C 1 1 20 36726 1 1 69 MET CA C 2.101 -0.620 -3.681 1.00 . A A . 69 MET CA 1 1 20 36727 1 1 69 MET CB C 1.624 0.809 -3.948 1.00 . A A . 69 MET CB 1 1 20 36728 1 1 69 MET CE C 3.062 2.956 -0.926 1.00 . A A . 69 MET CE 1 1 20 36729 1 1 69 MET CG C 1.435 1.577 -2.638 1.00 . A A . 69 MET CG 1 1 20 36730 1 1 69 MET H H 4.009 -0.387 -4.484 1.00 . A A . 69 MET H 1 1 20 36731 1 1 69 MET HA H 1.769 -0.974 -2.705 1.00 . A A . 69 MET HA 1 1 20 36732 1 1 69 MET HB2 H 2.349 1.327 -4.576 1.00 . A A . 69 MET HB2 1 1 20 36733 1 1 69 MET HB3 H 0.684 0.786 -4.499 1.00 . A A . 69 MET HB3 1 1 20 36734 1 1 69 MET HE1 H 3.105 1.919 -0.594 1.00 . A A . 69 MET HE1 1 1 20 36735 1 1 69 MET HE2 H 4.056 3.400 -0.862 1.00 . A A . 69 MET HE2 1 1 20 36736 1 1 69 MET HE3 H 2.373 3.513 -0.290 1.00 . A A . 69 MET HE3 1 1 20 36737 1 1 69 MET HG2 H 0.394 1.879 -2.531 1.00 . A A . 69 MET HG2 1 1 20 36738 1 1 69 MET HG3 H 1.669 0.931 -1.791 1.00 . A A . 69 MET HG3 1 1 20 36739 1 1 69 MET N N 3.553 -0.646 -3.633 1.00 . A A . 69 MET N 1 1 20 36740 1 1 69 MET O O 0.364 -1.742 -4.902 1.00 . A A . 69 MET O 1 1 20 36741 1 1 69 MET SD S 2.491 3.016 -2.616 1.00 . A A . 69 MET SD 1 1 20 36742 1 1 70 HIS C C 3.060 -4.224 -6.595 1.00 . A A . 70 HIS C 1 1 20 36743 1 1 70 HIS CA C 2.146 -2.997 -6.627 1.00 . A A . 70 HIS CA 1 1 20 36744 1 1 70 HIS CB C 2.176 -2.270 -7.972 1.00 . A A . 70 HIS CB 1 1 20 36745 1 1 70 HIS CD2 C 0.199 -0.592 -8.298 1.00 . A A . 70 HIS CD2 1 1 20 36746 1 1 70 HIS CE1 C 1.234 1.233 -7.677 1.00 . A A . 70 HIS CE1 1 1 20 36747 1 1 70 HIS CG C 1.477 -0.932 -7.963 1.00 . A A . 70 HIS CG 1 1 20 36748 1 1 70 HIS H H 3.484 -1.932 -5.437 1.00 . A A . 70 HIS H 1 1 20 36749 1 1 70 HIS HA H 1.120 -3.315 -6.443 1.00 . A A . 70 HIS HA 1 1 20 36750 1 1 70 HIS HB2 H 3.214 -2.124 -8.272 1.00 . A A . 70 HIS HB2 1 1 20 36751 1 1 70 HIS HB3 H 1.714 -2.905 -8.727 1.00 . A A . 70 HIS HB3 1 1 20 36752 1 1 70 HIS HD1 H 3.053 0.322 -7.273 1.00 . A A . 70 HIS HD1 1 1 20 36753 1 1 70 HIS HD2 H -0.572 -1.278 -8.649 1.00 . A A . 70 HIS HD2 1 1 20 36754 1 1 70 HIS HE1 H 1.427 2.280 -7.444 1.00 . A A . 70 HIS HE1 1 1 20 36755 1 1 70 HIS N N 2.503 -2.095 -5.545 1.00 . A A . 70 HIS N 1 1 20 36756 1 1 70 HIS ND1 N 2.104 0.239 -7.576 1.00 . A A . 70 HIS ND1 1 1 20 36757 1 1 70 HIS NE2 N 0.053 0.716 -8.124 1.00 . A A . 70 HIS NE2 1 1 20 36758 1 1 70 HIS O O 2.593 -5.346 -6.406 1.00 . A A . 70 HIS O 1 1 20 36759 1 1 71 ASP C C 4.969 -6.053 -5.693 1.00 . A A . 71 ASP C 1 1 20 36760 1 1 71 ASP CA C 5.330 -5.038 -6.779 1.00 . A A . 71 ASP CA 1 1 20 36761 1 1 71 ASP CB C 6.729 -4.498 -6.475 1.00 . A A . 71 ASP CB 1 1 20 36762 1 1 71 ASP CG C 7.876 -5.269 -7.132 1.00 . A A . 71 ASP CG 1 1 20 36763 1 1 71 ASP H H 4.719 -3.053 -6.936 1.00 . A A . 71 ASP H 1 1 20 36764 1 1 71 ASP HA H 5.291 -5.467 -7.780 1.00 . A A . 71 ASP HA 1 1 20 36765 1 1 71 ASP HB2 H 6.779 -3.458 -6.797 1.00 . A A . 71 ASP HB2 1 1 20 36766 1 1 71 ASP HB3 H 6.878 -4.505 -5.395 1.00 . A A . 71 ASP HB3 1 1 20 36767 1 1 71 ASP N N 4.347 -3.969 -6.783 1.00 . A A . 71 ASP N 1 1 20 36768 1 1 71 ASP O O 4.668 -5.676 -4.561 1.00 . A A . 71 ASP O 1 1 20 36769 1 1 71 ASP OD1 O 8.169 -6.380 -6.639 1.00 . A A . 71 ASP OD1 1 1 20 36770 1 1 71 ASP OD2 O 8.434 -4.730 -8.112 1.00 . A A . 71 ASP OD2 1 1 20 36771 1 1 72 LYS C C 5.982 -9.084 -4.708 1.00 . A A . 72 LYS C 1 1 20 36772 1 1 72 LYS CA C 4.690 -8.393 -5.148 1.00 . A A . 72 LYS CA 1 1 20 36773 1 1 72 LYS CB C 3.663 -9.345 -5.764 1.00 . A A . 72 LYS CB 1 1 20 36774 1 1 72 LYS CD C 2.497 -8.700 -7.905 1.00 . A A . 72 LYS CD 1 1 20 36775 1 1 72 LYS CE C 1.893 -10.036 -8.341 1.00 . A A . 72 LYS CE 1 1 20 36776 1 1 72 LYS CG C 2.497 -8.570 -6.380 1.00 . A A . 72 LYS CG 1 1 20 36777 1 1 72 LYS H H 5.255 -7.619 -6.998 1.00 . A A . 72 LYS H 1 1 20 36778 1 1 72 LYS HA H 4.225 -7.940 -4.273 1.00 . A A . 72 LYS HA 1 1 20 36779 1 1 72 LYS HB2 H 4.141 -9.958 -6.528 1.00 . A A . 72 LYS HB2 1 1 20 36780 1 1 72 LYS HB3 H 3.288 -10.026 -4.999 1.00 . A A . 72 LYS HB3 1 1 20 36781 1 1 72 LYS HD2 H 1.928 -7.879 -8.343 1.00 . A A . 72 LYS HD2 1 1 20 36782 1 1 72 LYS HD3 H 3.516 -8.618 -8.281 1.00 . A A . 72 LYS HD3 1 1 20 36783 1 1 72 LYS HE2 H 2.246 -10.833 -7.686 1.00 . A A . 72 LYS HE2 1 1 20 36784 1 1 72 LYS HE3 H 0.808 -10.001 -8.244 1.00 . A A . 72 LYS HE3 1 1 20 36785 1 1 72 LYS HG2 H 1.554 -8.944 -5.980 1.00 . A A . 72 LYS HG2 1 1 20 36786 1 1 72 LYS HG3 H 2.567 -7.518 -6.101 1.00 . A A . 72 LYS HG3 1 1 20 36787 1 1 72 LYS HZ1 H 1.666 -11.053 -10.146 1.00 . A A . 72 LYS HZ1 1 1 20 36788 1 1 72 LYS HZ2 H 2.187 -9.522 -10.339 1.00 . A A . 72 LYS HZ2 1 1 20 36789 1 1 72 LYS N N 5.010 -7.321 -6.075 1.00 . A A . 72 LYS N 1 1 20 36790 1 1 72 LYS NZ N 2.261 -10.339 -9.742 1.00 . A A . 72 LYS NZ 1 1 20 36791 1 1 72 LYS O O 6.016 -9.744 -3.671 1.00 . A A . 72 LYS O 1 1 20 36792 1 1 73 ASN C C 9.102 -8.571 -4.313 1.00 . A A . 73 ASN C 1 1 20 36793 1 1 73 ASN CA C 8.307 -9.506 -5.227 1.00 . A A . 73 ASN CA 1 1 20 36794 1 1 73 ASN CB C 9.118 -9.718 -6.507 1.00 . A A . 73 ASN CB 1 1 20 36795 1 1 73 ASN CG C 8.650 -10.971 -7.251 1.00 . A A . 73 ASN CG 1 1 20 36796 1 1 73 ASN H H 6.980 -8.368 -6.361 1.00 . A A . 73 ASN H 1 1 20 36797 1 1 73 ASN HA H 8.079 -10.460 -4.752 1.00 . A A . 73 ASN HA 1 1 20 36798 1 1 73 ASN HB2 H 9.017 -8.847 -7.155 1.00 . A A . 73 ASN HB2 1 1 20 36799 1 1 73 ASN HB3 H 10.175 -9.811 -6.260 1.00 . A A . 73 ASN HB3 1 1 20 36800 1 1 73 ASN HD21 H 10.559 -11.646 -7.217 1.00 . A A . 73 ASN HD21 1 1 20 36801 1 1 73 ASN HD22 H 9.416 -12.693 -7.990 1.00 . A A . 73 ASN HD22 1 1 20 36802 1 1 73 ASN N N 7.015 -8.908 -5.519 1.00 . A A . 73 ASN N 1 1 20 36803 1 1 73 ASN ND2 N 9.622 -11.842 -7.507 1.00 . A A . 73 ASN ND2 1 1 20 36804 1 1 73 ASN O O 10.213 -8.165 -4.650 1.00 . A A . 73 ASN O 1 1 20 36805 1 1 73 ASN OD1 O 7.485 -11.135 -7.571 1.00 . A A . 73 ASN OD1 1 1 20 36806 1 1 74 THR C C 9.395 -8.123 -0.897 1.00 . A A . 74 THR C 1 1 20 36807 1 1 74 THR CA C 9.140 -7.379 -2.209 1.00 . A A . 74 THR CA 1 1 20 36808 1 1 74 THR CB C 8.259 -6.139 -2.044 1.00 . A A . 74 THR CB 1 1 20 36809 1 1 74 THR CG2 C 8.027 -5.405 -3.366 1.00 . A A . 74 THR CG2 1 1 20 36810 1 1 74 THR H H 7.598 -8.594 -2.907 1.00 . A A . 74 THR H 1 1 20 36811 1 1 74 THR HA H 10.113 -7.084 -2.603 1.00 . A A . 74 THR HA 1 1 20 36812 1 1 74 THR HB H 8.670 -5.466 -1.292 1.00 . A A . 74 THR HB 1 1 20 36813 1 1 74 THR HG1 H 6.665 -6.282 -0.842 1.00 . A A . 74 THR HG1 1 1 20 36814 1 1 74 THR HG21 H 8.514 -5.950 -4.175 1.00 . A A . 74 THR HG21 1 1 20 36815 1 1 74 THR HG22 H 6.957 -5.341 -3.564 1.00 . A A . 74 THR HG22 1 1 20 36816 1 1 74 THR HG23 H 8.446 -4.400 -3.302 1.00 . A A . 74 THR HG23 1 1 20 36817 1 1 74 THR N N 8.502 -8.258 -3.174 1.00 . A A . 74 THR N 1 1 20 36818 1 1 74 THR O O 8.746 -9.128 -0.613 1.00 . A A . 74 THR O 1 1 20 36819 1 1 74 THR OG1 O 6.977 -6.666 -1.711 1.00 . A A . 74 THR OG1 1 1 20 36820 1 1 75 LYS C C 9.492 -8.105 2.093 1.00 . A A . 75 LYS C 1 1 20 36821 1 1 75 LYS CA C 10.689 -8.201 1.145 1.00 . A A . 75 LYS CA 1 1 20 36822 1 1 75 LYS CB C 11.967 -7.572 1.703 1.00 . A A . 75 LYS CB 1 1 20 36823 1 1 75 LYS CD C 13.814 -8.187 3.306 1.00 . A A . 75 LYS CD 1 1 20 36824 1 1 75 LYS CE C 14.151 -8.143 4.798 1.00 . A A . 75 LYS CE 1 1 20 36825 1 1 75 LYS CG C 12.301 -8.141 3.083 1.00 . A A . 75 LYS CG 1 1 20 36826 1 1 75 LYS H H 10.863 -6.780 -0.369 1.00 . A A . 75 LYS H 1 1 20 36827 1 1 75 LYS HA H 10.901 -9.254 0.962 1.00 . A A . 75 LYS HA 1 1 20 36828 1 1 75 LYS HB2 H 12.796 -7.756 1.019 1.00 . A A . 75 LYS HB2 1 1 20 36829 1 1 75 LYS HB3 H 11.845 -6.491 1.771 1.00 . A A . 75 LYS HB3 1 1 20 36830 1 1 75 LYS HD2 H 14.223 -9.096 2.864 1.00 . A A . 75 LYS HD2 1 1 20 36831 1 1 75 LYS HD3 H 14.286 -7.346 2.798 1.00 . A A . 75 LYS HD3 1 1 20 36832 1 1 75 LYS HE2 H 13.541 -7.387 5.292 1.00 . A A . 75 LYS HE2 1 1 20 36833 1 1 75 LYS HE3 H 13.908 -9.100 5.260 1.00 . A A . 75 LYS HE3 1 1 20 36834 1 1 75 LYS HG2 H 11.835 -7.529 3.855 1.00 . A A . 75 LYS HG2 1 1 20 36835 1 1 75 LYS HG3 H 11.885 -9.144 3.177 1.00 . A A . 75 LYS HG3 1 1 20 36836 1 1 75 LYS HZ1 H 15.729 -7.132 5.709 1.00 . A A . 75 LYS HZ1 1 1 20 36837 1 1 75 LYS HZ2 H 16.111 -8.657 5.285 1.00 . A A . 75 LYS HZ2 1 1 20 36838 1 1 75 LYS N N 10.340 -7.599 -0.131 1.00 . A A . 75 LYS N 1 1 20 36839 1 1 75 LYS NZ N 15.585 -7.839 4.997 1.00 . A A . 75 LYS NZ 1 1 20 36840 1 1 75 LYS O O 9.354 -8.916 3.008 1.00 . A A . 75 LYS O 1 1 20 36841 1 1 76 PHE C C 6.200 -7.037 1.833 1.00 . A A . 76 PHE C 1 1 20 36842 1 1 76 PHE CA C 7.477 -6.894 2.663 1.00 . A A . 76 PHE CA 1 1 20 36843 1 1 76 PHE CB C 7.577 -5.458 3.181 1.00 . A A . 76 PHE CB 1 1 20 36844 1 1 76 PHE CD1 C 8.742 -5.873 5.378 1.00 . A A . 76 PHE CD1 1 1 20 36845 1 1 76 PHE CD2 C 9.761 -4.373 3.820 1.00 . A A . 76 PHE CD2 1 1 20 36846 1 1 76 PHE CE1 C 9.828 -5.656 6.298 1.00 . A A . 76 PHE CE1 1 1 20 36847 1 1 76 PHE CE2 C 10.847 -4.156 4.740 1.00 . A A . 76 PHE CE2 1 1 20 36848 1 1 76 PHE CG C 8.731 -5.227 4.158 1.00 . A A . 76 PHE CG 1 1 20 36849 1 1 76 PHE CZ C 10.827 -4.808 5.933 1.00 . A A . 76 PHE CZ 1 1 20 36850 1 1 76 PHE H H 8.778 -6.452 1.097 1.00 . A A . 76 PHE H 1 1 20 36851 1 1 76 PHE HA H 7.476 -7.647 3.451 1.00 . A A . 76 PHE HA 1 1 20 36852 1 1 76 PHE HB2 H 7.693 -4.784 2.332 1.00 . A A . 76 PHE HB2 1 1 20 36853 1 1 76 PHE HB3 H 6.640 -5.194 3.672 1.00 . A A . 76 PHE HB3 1 1 20 36854 1 1 76 PHE HD1 H 7.928 -6.548 5.644 1.00 . A A . 76 PHE HD1 1 1 20 36855 1 1 76 PHE HD2 H 9.752 -3.863 2.857 1.00 . A A . 76 PHE HD2 1 1 20 36856 1 1 76 PHE HE1 H 9.849 -6.160 7.264 1.00 . A A . 76 PHE HE1 1 1 20 36857 1 1 76 PHE HE2 H 11.667 -3.484 4.486 1.00 . A A . 76 PHE HE2 1 1 20 36858 1 1 76 PHE HZ H 11.634 -4.723 6.705 1.00 . A A . 76 PHE HZ 1 1 20 36859 1 1 76 PHE N N 8.658 -7.107 1.843 1.00 . A A . 76 PHE N 1 1 20 36860 1 1 76 PHE O O 6.227 -6.881 0.613 1.00 . A A . 76 PHE O 1 1 20 36861 1 1 77 LYS C C 3.421 -6.180 1.211 1.00 . A A . 77 LYS C 1 1 20 36862 1 1 77 LYS CA C 3.826 -7.499 1.870 1.00 . A A . 77 LYS CA 1 1 20 36863 1 1 77 LYS CB C 2.787 -8.039 2.855 1.00 . A A . 77 LYS CB 1 1 20 36864 1 1 77 LYS CD C 1.382 -10.080 3.328 1.00 . A A . 77 LYS CD 1 1 20 36865 1 1 77 LYS CE C 1.490 -11.537 3.779 1.00 . A A . 77 LYS CE 1 1 20 36866 1 1 77 LYS CG C 2.725 -9.567 2.803 1.00 . A A . 77 LYS CG 1 1 20 36867 1 1 77 LYS H H 5.098 -7.458 3.520 1.00 . A A . 77 LYS H 1 1 20 36868 1 1 77 LYS HA H 3.953 -8.250 1.091 1.00 . A A . 77 LYS HA 1 1 20 36869 1 1 77 LYS HB2 H 3.034 -7.716 3.866 1.00 . A A . 77 LYS HB2 1 1 20 36870 1 1 77 LYS HB3 H 1.807 -7.624 2.619 1.00 . A A . 77 LYS HB3 1 1 20 36871 1 1 77 LYS HD2 H 1.053 -9.460 4.162 1.00 . A A . 77 LYS HD2 1 1 20 36872 1 1 77 LYS HD3 H 0.625 -9.992 2.548 1.00 . A A . 77 LYS HD3 1 1 20 36873 1 1 77 LYS HE2 H 2.090 -12.102 3.066 1.00 . A A . 77 LYS HE2 1 1 20 36874 1 1 77 LYS HE3 H 2.003 -11.589 4.740 1.00 . A A . 77 LYS HE3 1 1 20 36875 1 1 77 LYS HG2 H 2.872 -9.906 1.778 1.00 . A A . 77 LYS HG2 1 1 20 36876 1 1 77 LYS HG3 H 3.536 -9.988 3.397 1.00 . A A . 77 LYS HG3 1 1 20 36877 1 1 77 LYS HZ1 H 0.144 -13.121 3.620 1.00 . A A . 77 LYS HZ1 1 1 20 36878 1 1 77 LYS HZ2 H -0.207 -12.107 4.846 1.00 . A A . 77 LYS HZ2 1 1 20 36879 1 1 77 LYS N N 5.111 -7.333 2.528 1.00 . A A . 77 LYS N 1 1 20 36880 1 1 77 LYS NZ N 0.145 -12.145 3.896 1.00 . A A . 77 LYS NZ 1 1 20 36881 1 1 77 LYS O O 3.317 -5.153 1.880 1.00 . A A . 77 LYS O 1 1 20 36882 1 1 78 SER C C 1.290 -5.029 -1.002 1.00 . A A . 78 SER C 1 1 20 36883 1 1 78 SER CA C 2.812 -5.073 -0.852 1.00 . A A . 78 SER CA 1 1 20 36884 1 1 78 SER CB C 3.482 -5.056 -2.227 1.00 . A A . 78 SER CB 1 1 20 36885 1 1 78 SER H H 3.290 -7.088 -0.631 1.00 . A A . 78 SER H 1 1 20 36886 1 1 78 SER HA H 3.163 -4.223 -0.267 1.00 . A A . 78 SER HA 1 1 20 36887 1 1 78 SER HB2 H 3.669 -4.024 -2.526 1.00 . A A . 78 SER HB2 1 1 20 36888 1 1 78 SER HB3 H 4.452 -5.550 -2.165 1.00 . A A . 78 SER HB3 1 1 20 36889 1 1 78 SER HG H 3.233 -5.879 -4.034 1.00 . A A . 78 SER HG 1 1 20 36890 1 1 78 SER N N 3.203 -6.249 -0.094 1.00 . A A . 78 SER N 1 1 20 36891 1 1 78 SER O O 0.623 -6.057 -0.894 1.00 . A A . 78 SER O 1 1 20 36892 1 1 78 SER OG O 2.685 -5.700 -3.217 1.00 . A A . 78 SER OG 1 1 20 36893 1 1 79 CYS C C -1.175 -4.748 -2.324 1.00 . A A . 79 CYS C 1 1 20 36894 1 1 79 CYS CA C -0.645 -3.638 -1.415 1.00 . A A . 79 CYS CA 1 1 20 36895 1 1 79 CYS CB C -0.970 -2.247 -1.963 1.00 . A A . 79 CYS CB 1 1 20 36896 1 1 79 CYS H H 1.336 -2.998 -1.335 1.00 . A A . 79 CYS H 1 1 20 36897 1 1 79 CYS HA H -1.087 -3.707 -0.421 1.00 . A A . 79 CYS HA 1 1 20 36898 1 1 79 CYS HB2 H -0.622 -2.187 -2.994 1.00 . A A . 79 CYS HB2 1 1 20 36899 1 1 79 CYS HB3 H -2.053 -2.125 -1.985 1.00 . A A . 79 CYS HB3 1 1 20 36900 1 1 79 CYS N N 0.786 -3.829 -1.249 1.00 . A A . 79 CYS N 1 1 20 36901 1 1 79 CYS O O -1.936 -5.608 -1.882 1.00 . A A . 79 CYS O 1 1 20 36902 1 1 79 CYS SG S -0.242 -0.860 -1.016 1.00 . A A . 79 CYS SG 1 1 20 36903 1 1 80 VAL C C -0.659 -7.061 -4.135 1.00 . A A . 80 VAL C 1 1 20 36904 1 1 80 VAL CA C -1.177 -5.683 -4.555 1.00 . A A . 80 VAL CA 1 1 20 36905 1 1 80 VAL CB C -0.714 -5.271 -5.953 1.00 . A A . 80 VAL CB 1 1 20 36906 1 1 80 VAL CG1 C -1.053 -6.350 -6.984 1.00 . A A . 80 VAL CG1 1 1 20 36907 1 1 80 VAL CG2 C -1.315 -3.922 -6.354 1.00 . A A . 80 VAL CG2 1 1 20 36908 1 1 80 VAL H H -0.135 -3.991 -3.931 1.00 . A A . 80 VAL H 1 1 20 36909 1 1 80 VAL HA H -2.267 -5.702 -4.552 1.00 . A A . 80 VAL HA 1 1 20 36910 1 1 80 VAL HB H 0.370 -5.160 -5.928 1.00 . A A . 80 VAL HB 1 1 20 36911 1 1 80 VAL HG11 H -1.899 -6.938 -6.629 1.00 . A A . 80 VAL HG11 1 1 20 36912 1 1 80 VAL HG12 H -1.309 -5.879 -7.932 1.00 . A A . 80 VAL HG12 1 1 20 36913 1 1 80 VAL HG13 H -0.191 -7.003 -7.123 1.00 . A A . 80 VAL HG13 1 1 20 36914 1 1 80 VAL HG21 H -1.298 -3.248 -5.498 1.00 . A A . 80 VAL HG21 1 1 20 36915 1 1 80 VAL HG22 H -0.731 -3.492 -7.168 1.00 . A A . 80 VAL HG22 1 1 20 36916 1 1 80 VAL HG23 H -2.344 -4.067 -6.683 1.00 . A A . 80 VAL HG23 1 1 20 36917 1 1 80 VAL N N -0.753 -4.694 -3.579 1.00 . A A . 80 VAL N 1 1 20 36918 1 1 80 VAL O O -1.340 -8.068 -4.323 1.00 . A A . 80 VAL O 1 1 20 36919 1 1 81 GLY C C 0.219 -9.079 -2.209 1.00 . A A . 81 GLY C 1 1 20 36920 1 1 81 GLY CA C 1.159 -8.298 -3.129 1.00 . A A . 81 GLY CA 1 1 20 36921 1 1 81 GLY H H 1.089 -6.237 -3.427 1.00 . A A . 81 GLY H 1 1 20 36922 1 1 81 GLY HA2 H 1.421 -8.910 -3.991 1.00 . A A . 81 GLY HA2 1 1 20 36923 1 1 81 GLY HA3 H 2.087 -8.076 -2.602 1.00 . A A . 81 GLY HA3 1 1 20 36924 1 1 81 GLY N N 0.542 -7.061 -3.576 1.00 . A A . 81 GLY N 1 1 20 36925 1 1 81 GLY O O -0.140 -10.217 -2.504 1.00 . A A . 81 GLY O 1 1 20 36926 1 1 82 CYS C C -2.395 -9.298 -0.826 1.00 . A A . 82 CYS C 1 1 20 36927 1 1 82 CYS CA C -1.045 -9.055 -0.147 1.00 . A A . 82 CYS CA 1 1 20 36928 1 1 82 CYS CB C -1.187 -8.207 1.119 1.00 . A A . 82 CYS CB 1 1 20 36929 1 1 82 CYS H H 0.143 -7.509 -0.879 1.00 . A A . 82 CYS H 1 1 20 36930 1 1 82 CYS HA H -0.584 -9.998 0.145 1.00 . A A . 82 CYS HA 1 1 20 36931 1 1 82 CYS HB2 H -0.204 -7.996 1.538 1.00 . A A . 82 CYS HB2 1 1 20 36932 1 1 82 CYS HB3 H -1.642 -7.247 0.873 1.00 . A A . 82 CYS HB3 1 1 20 36933 1 1 82 CYS N N -0.154 -8.435 -1.112 1.00 . A A . 82 CYS N 1 1 20 36934 1 1 82 CYS O O -2.976 -10.373 -0.692 1.00 . A A . 82 CYS O 1 1 20 36935 1 1 82 CYS SG S -2.215 -9.087 2.351 1.00 . A A . 82 CYS SG 1 1 20 36936 1 1 83 HIS C C -4.136 -9.619 -3.123 1.00 . A A . 83 HIS C 1 1 20 36937 1 1 83 HIS CA C -4.123 -8.370 -2.240 1.00 . A A . 83 HIS CA 1 1 20 36938 1 1 83 HIS CB C -4.403 -7.086 -3.024 1.00 . A A . 83 HIS CB 1 1 20 36939 1 1 83 HIS CD2 C -4.804 -5.687 -0.853 1.00 . A A . 83 HIS CD2 1 1 20 36940 1 1 83 HIS CE1 C -6.063 -4.121 -1.720 1.00 . A A . 83 HIS CE1 1 1 20 36941 1 1 83 HIS CG C -4.949 -5.958 -2.182 1.00 . A A . 83 HIS CG 1 1 20 36942 1 1 83 HIS H H -2.374 -7.409 -1.644 1.00 . A A . 83 HIS H 1 1 20 36943 1 1 83 HIS HA H -4.895 -8.467 -1.476 1.00 . A A . 83 HIS HA 1 1 20 36944 1 1 83 HIS HB2 H -3.480 -6.756 -3.501 1.00 . A A . 83 HIS HB2 1 1 20 36945 1 1 83 HIS HB3 H -5.112 -7.307 -3.822 1.00 . A A . 83 HIS HB3 1 1 20 36946 1 1 83 HIS HD1 H -6.038 -4.872 -3.655 1.00 . A A . 83 HIS HD1 1 1 20 36947 1 1 83 HIS HD2 H -4.233 -6.281 -0.140 1.00 . A A . 83 HIS HD2 1 1 20 36948 1 1 83 HIS HE1 H -6.682 -3.229 -1.811 1.00 . A A . 83 HIS HE1 1 1 20 36949 1 1 83 HIS N N -2.853 -8.280 -1.540 1.00 . A A . 83 HIS N 1 1 20 36950 1 1 83 HIS ND1 N -5.748 -4.954 -2.701 1.00 . A A . 83 HIS ND1 1 1 20 36951 1 1 83 HIS NE2 N -5.477 -4.577 -0.576 1.00 . A A . 83 HIS NE2 1 1 20 36952 1 1 83 HIS O O -5.122 -10.354 -3.151 1.00 . A A . 83 HIS O 1 1 20 36953 1 1 84 VAL C C -3.109 -12.252 -3.898 1.00 . A A . 84 VAL C 1 1 20 36954 1 1 84 VAL CA C -2.901 -10.969 -4.705 1.00 . A A . 84 VAL CA 1 1 20 36955 1 1 84 VAL CB C -1.551 -10.927 -5.424 1.00 . A A . 84 VAL CB 1 1 20 36956 1 1 84 VAL CG1 C -1.268 -12.251 -6.136 1.00 . A A . 84 VAL CG1 1 1 20 36957 1 1 84 VAL CG2 C -1.489 -9.753 -6.404 1.00 . A A . 84 VAL CG2 1 1 20 36958 1 1 84 VAL H H -2.231 -9.219 -3.794 1.00 . A A . 84 VAL H 1 1 20 36959 1 1 84 VAL HA H -3.687 -10.895 -5.456 1.00 . A A . 84 VAL HA 1 1 20 36960 1 1 84 VAL HB H -0.775 -10.778 -4.674 1.00 . A A . 84 VAL HB 1 1 20 36961 1 1 84 VAL HG11 H -2.149 -12.891 -6.077 1.00 . A A . 84 VAL HG11 1 1 20 36962 1 1 84 VAL HG12 H -1.030 -12.058 -7.182 1.00 . A A . 84 VAL HG12 1 1 20 36963 1 1 84 VAL HG13 H -0.425 -12.749 -5.657 1.00 . A A . 84 VAL HG13 1 1 20 36964 1 1 84 VAL HG21 H -2.216 -8.996 -6.111 1.00 . A A . 84 VAL HG21 1 1 20 36965 1 1 84 VAL HG22 H -0.488 -9.321 -6.390 1.00 . A A . 84 VAL HG22 1 1 20 36966 1 1 84 VAL HG23 H -1.718 -10.107 -7.410 1.00 . A A . 84 VAL HG23 1 1 20 36967 1 1 84 VAL N N -3.029 -9.821 -3.822 1.00 . A A . 84 VAL N 1 1 20 36968 1 1 84 VAL O O -3.707 -13.208 -4.389 1.00 . A A . 84 VAL O 1 1 20 36969 1 1 85 GLU C C -4.154 -13.493 -1.261 1.00 . A A . 85 GLU C 1 1 20 36970 1 1 85 GLU CA C -2.725 -13.383 -1.795 1.00 . A A . 85 GLU CA 1 1 20 36971 1 1 85 GLU CB C -1.715 -13.306 -0.647 1.00 . A A . 85 GLU CB 1 1 20 36972 1 1 85 GLU CD C -0.324 -15.262 0.125 1.00 . A A . 85 GLU CD 1 1 20 36973 1 1 85 GLU CG C -0.489 -14.173 -0.937 1.00 . A A . 85 GLU CG 1 1 20 36974 1 1 85 GLU H H -2.117 -11.451 -2.282 1.00 . A A . 85 GLU H 1 1 20 36975 1 1 85 GLU HA H -2.494 -14.248 -2.416 1.00 . A A . 85 GLU HA 1 1 20 36976 1 1 85 GLU HB2 H -1.407 -12.271 -0.498 1.00 . A A . 85 GLU HB2 1 1 20 36977 1 1 85 GLU HB3 H -2.187 -13.634 0.279 1.00 . A A . 85 GLU HB3 1 1 20 36978 1 1 85 GLU HG2 H -0.587 -14.632 -1.921 1.00 . A A . 85 GLU HG2 1 1 20 36979 1 1 85 GLU HG3 H 0.404 -13.549 -0.965 1.00 . A A . 85 GLU HG3 1 1 20 36980 1 1 85 GLU N N -2.602 -12.232 -2.674 1.00 . A A . 85 GLU N 1 1 20 36981 1 1 85 GLU O O -4.658 -14.595 -1.048 1.00 . A A . 85 GLU O 1 1 20 36982 1 1 85 GLU OE1 O 0.227 -14.930 1.197 1.00 . A A . 85 GLU OE1 1 1 20 36983 1 1 85 GLU OE2 O -0.752 -16.401 -0.159 1.00 . A A . 85 GLU OE2 1 1 20 36984 1 1 86 VAL C C -7.098 -12.678 -1.673 1.00 . A A . 86 VAL C 1 1 20 36985 1 1 86 VAL CA C -6.129 -12.290 -0.554 1.00 . A A . 86 VAL CA 1 1 20 36986 1 1 86 VAL CB C -6.421 -10.908 0.036 1.00 . A A . 86 VAL CB 1 1 20 36987 1 1 86 VAL CG1 C -7.861 -10.823 0.547 1.00 . A A . 86 VAL CG1 1 1 20 36988 1 1 86 VAL CG2 C -5.425 -10.564 1.145 1.00 . A A . 86 VAL CG2 1 1 20 36989 1 1 86 VAL H H -4.351 -11.444 -1.235 1.00 . A A . 86 VAL H 1 1 20 36990 1 1 86 VAL HA H -6.208 -13.023 0.248 1.00 . A A . 86 VAL HA 1 1 20 36991 1 1 86 VAL HB H -6.304 -10.172 -0.759 1.00 . A A . 86 VAL HB 1 1 20 36992 1 1 86 VAL HG11 H -8.024 -11.592 1.302 1.00 . A A . 86 VAL HG11 1 1 20 36993 1 1 86 VAL HG12 H -8.034 -9.840 0.984 1.00 . A A . 86 VAL HG12 1 1 20 36994 1 1 86 VAL HG13 H -8.550 -10.978 -0.283 1.00 . A A . 86 VAL HG13 1 1 20 36995 1 1 86 VAL HG21 H -4.497 -11.113 0.983 1.00 . A A . 86 VAL HG21 1 1 20 36996 1 1 86 VAL HG22 H -5.221 -9.494 1.131 1.00 . A A . 86 VAL HG22 1 1 20 36997 1 1 86 VAL HG23 H -5.847 -10.841 2.111 1.00 . A A . 86 VAL HG23 1 1 20 36998 1 1 86 VAL N N -4.768 -12.337 -1.059 1.00 . A A . 86 VAL N 1 1 20 36999 1 1 86 VAL O O -7.913 -13.584 -1.507 1.00 . A A . 86 VAL O 1 1 20 37000 1 1 87 ALA C C -7.495 -13.609 -4.514 1.00 . A A . 87 ALA C 1 1 20 37001 1 1 87 ALA CA C -7.831 -12.234 -3.935 1.00 . A A . 87 ALA CA 1 1 20 37002 1 1 87 ALA CB C -7.663 -11.112 -4.962 1.00 . A A . 87 ALA CB 1 1 20 37003 1 1 87 ALA H H -6.310 -11.239 -2.916 1.00 . A A . 87 ALA H 1 1 20 37004 1 1 87 ALA HA H -8.863 -12.238 -3.585 1.00 . A A . 87 ALA HA 1 1 20 37005 1 1 87 ALA HB1 H -7.939 -10.160 -4.508 1.00 . A A . 87 ALA HB1 1 1 20 37006 1 1 87 ALA HB2 H -6.624 -11.071 -5.289 1.00 . A A . 87 ALA HB2 1 1 20 37007 1 1 87 ALA HB3 H -8.306 -11.306 -5.820 1.00 . A A . 87 ALA HB3 1 1 20 37008 1 1 87 ALA N N -6.976 -11.974 -2.789 1.00 . A A . 87 ALA N 1 1 20 37009 1 1 87 ALA O O -8.389 -14.350 -4.922 1.00 . A A . 87 ALA O 1 1 20 37010 1 1 88 GLY C C -6.543 -15.594 -6.292 1.00 . A A . 88 GLY C 1 1 20 37011 1 1 88 GLY CA C -5.741 -15.184 -5.055 1.00 . A A . 88 GLY CA 1 1 20 37012 1 1 88 GLY H H -5.485 -13.302 -4.199 1.00 . A A . 88 GLY H 1 1 20 37013 1 1 88 GLY HA2 H -4.683 -15.112 -5.310 1.00 . A A . 88 GLY HA2 1 1 20 37014 1 1 88 GLY HA3 H -5.832 -15.952 -4.287 1.00 . A A . 88 GLY HA3 1 1 20 37015 1 1 88 GLY N N -6.205 -13.910 -4.532 1.00 . A A . 88 GLY N 1 1 20 37016 1 1 88 GLY O O -6.670 -14.819 -7.239 1.00 . A A . 88 GLY O 1 1 20 37017 1 1 89 ALA C C -9.329 -17.334 -6.961 1.00 . A A . 89 ALA C 1 1 20 37018 1 1 89 ALA CA C -7.849 -17.334 -7.349 1.00 . A A . 89 ALA CA 1 1 20 37019 1 1 89 ALA CB C -7.343 -18.729 -7.720 1.00 . A A . 89 ALA CB 1 1 20 37020 1 1 89 ALA H H -6.955 -17.435 -5.470 1.00 . A A . 89 ALA H 1 1 20 37021 1 1 89 ALA HA H -7.706 -16.670 -8.201 1.00 . A A . 89 ALA HA 1 1 20 37022 1 1 89 ALA HB1 H -6.253 -18.733 -7.718 1.00 . A A . 89 ALA HB1 1 1 20 37023 1 1 89 ALA HB2 H -7.711 -19.454 -6.994 1.00 . A A . 89 ALA HB2 1 1 20 37024 1 1 89 ALA HB3 H -7.705 -18.994 -8.714 1.00 . A A . 89 ALA HB3 1 1 20 37025 1 1 89 ALA N N -7.063 -16.811 -6.244 1.00 . A A . 89 ALA N 1 1 20 37026 1 1 89 ALA O O -9.966 -18.386 -6.931 1.00 . A A . 89 ALA O 1 1 20 37027 1 1 90 ASP C C -11.972 -15.223 -7.377 1.00 . A A . 90 ASP C 1 1 20 37028 1 1 90 ASP CA C -11.226 -15.994 -6.287 1.00 . A A . 90 ASP CA 1 1 20 37029 1 1 90 ASP CB C -11.354 -15.208 -4.980 1.00 . A A . 90 ASP CB 1 1 20 37030 1 1 90 ASP CG C -12.490 -15.662 -4.062 1.00 . A A . 90 ASP CG 1 1 20 37031 1 1 90 ASP H H -9.308 -15.293 -6.699 1.00 . A A . 90 ASP H 1 1 20 37032 1 1 90 ASP HA H -11.600 -17.010 -6.164 1.00 . A A . 90 ASP HA 1 1 20 37033 1 1 90 ASP HB2 H -10.414 -15.283 -4.435 1.00 . A A . 90 ASP HB2 1 1 20 37034 1 1 90 ASP HB3 H -11.500 -14.155 -5.220 1.00 . A A . 90 ASP HB3 1 1 20 37035 1 1 90 ASP N N -9.833 -16.143 -6.672 1.00 . A A . 90 ASP N 1 1 20 37036 1 1 90 ASP O O -13.202 -15.191 -7.390 1.00 . A A . 90 ASP O 1 1 20 37037 1 1 90 ASP OD1 O -12.353 -16.767 -3.493 1.00 . A A . 90 ASP OD1 1 1 20 37038 1 1 90 ASP OD2 O -13.470 -14.894 -3.948 1.00 . A A . 90 ASP OD2 1 1 20 37039 1 1 91 ALA C C -12.621 -12.715 -8.786 1.00 . A A . 91 ALA C 1 1 20 37040 1 1 91 ALA CA C -11.769 -13.851 -9.359 1.00 . A A . 91 ALA CA 1 1 20 37041 1 1 91 ALA CB C -12.573 -14.779 -10.271 1.00 . A A . 91 ALA CB 1 1 20 37042 1 1 91 ALA H H -10.198 -14.650 -8.250 1.00 . A A . 91 ALA H 1 1 20 37043 1 1 91 ALA HA H -10.946 -13.423 -9.931 1.00 . A A . 91 ALA HA 1 1 20 37044 1 1 91 ALA HB1 H -13.262 -15.373 -9.670 1.00 . A A . 91 ALA HB1 1 1 20 37045 1 1 91 ALA HB2 H -13.138 -14.184 -10.989 1.00 . A A . 91 ALA HB2 1 1 20 37046 1 1 91 ALA HB3 H -11.893 -15.443 -10.805 1.00 . A A . 91 ALA HB3 1 1 20 37047 1 1 91 ALA N N -11.197 -14.620 -8.267 1.00 . A A . 91 ALA N 1 1 20 37048 1 1 91 ALA O O -13.122 -12.815 -7.667 1.00 . A A . 91 ALA O 1 1 20 37049 1 1 92 ALA C C -12.707 -9.652 -8.210 1.00 . A A . 92 ALA C 1 1 20 37050 1 1 92 ALA CA C -13.539 -10.510 -9.165 1.00 . A A . 92 ALA CA 1 1 20 37051 1 1 92 ALA CB C -14.850 -10.983 -8.533 1.00 . A A . 92 ALA CB 1 1 20 37052 1 1 92 ALA H H -12.346 -11.590 -10.488 1.00 . A A . 92 ALA H 1 1 20 37053 1 1 92 ALA HA H -13.769 -9.928 -10.057 1.00 . A A . 92 ALA HA 1 1 20 37054 1 1 92 ALA HB1 H -15.211 -11.865 -9.061 1.00 . A A . 92 ALA HB1 1 1 20 37055 1 1 92 ALA HB2 H -14.679 -11.231 -7.485 1.00 . A A . 92 ALA HB2 1 1 20 37056 1 1 92 ALA HB3 H -15.593 -10.188 -8.602 1.00 . A A . 92 ALA HB3 1 1 20 37057 1 1 92 ALA N N -12.757 -11.663 -9.579 1.00 . A A . 92 ALA N 1 1 20 37058 1 1 92 ALA O O -12.540 -8.454 -8.432 1.00 . A A . 92 ALA O 1 1 20 37059 1 1 93 LYS C C -10.050 -9.233 -6.799 1.00 . A A . 93 LYS C 1 1 20 37060 1 1 93 LYS CA C -11.397 -9.610 -6.178 1.00 . A A . 93 LYS CA 1 1 20 37061 1 1 93 LYS CB C -11.273 -10.452 -4.906 1.00 . A A . 93 LYS CB 1 1 20 37062 1 1 93 LYS CD C -12.421 -11.052 -2.743 1.00 . A A . 93 LYS CD 1 1 20 37063 1 1 93 LYS CE C -13.670 -10.800 -1.896 1.00 . A A . 93 LYS CE 1 1 20 37064 1 1 93 LYS CG C -12.611 -10.530 -4.168 1.00 . A A . 93 LYS CG 1 1 20 37065 1 1 93 LYS H H -12.347 -11.274 -6.995 1.00 . A A . 93 LYS H 1 1 20 37066 1 1 93 LYS HA H -11.921 -8.693 -5.907 1.00 . A A . 93 LYS HA 1 1 20 37067 1 1 93 LYS HB2 H -10.935 -11.456 -5.162 1.00 . A A . 93 LYS HB2 1 1 20 37068 1 1 93 LYS HB3 H -10.517 -10.019 -4.251 1.00 . A A . 93 LYS HB3 1 1 20 37069 1 1 93 LYS HD2 H -12.204 -12.120 -2.768 1.00 . A A . 93 LYS HD2 1 1 20 37070 1 1 93 LYS HD3 H -11.561 -10.563 -2.284 1.00 . A A . 93 LYS HD3 1 1 20 37071 1 1 93 LYS HE2 H -13.483 -9.987 -1.194 1.00 . A A . 93 LYS HE2 1 1 20 37072 1 1 93 LYS HE3 H -14.493 -10.485 -2.536 1.00 . A A . 93 LYS HE3 1 1 20 37073 1 1 93 LYS HG2 H -13.073 -9.543 -4.140 1.00 . A A . 93 LYS HG2 1 1 20 37074 1 1 93 LYS HG3 H -13.292 -11.186 -4.712 1.00 . A A . 93 LYS HG3 1 1 20 37075 1 1 93 LYS HZ1 H -14.134 -11.856 -0.160 1.00 . A A . 93 LYS HZ1 1 1 20 37076 1 1 93 LYS HZ2 H -14.941 -12.395 -1.467 1.00 . A A . 93 LYS HZ2 1 1 20 37077 1 1 93 LYS N N -12.207 -10.299 -7.168 1.00 . A A . 93 LYS N 1 1 20 37078 1 1 93 LYS NZ N -14.050 -12.024 -1.156 1.00 . A A . 93 LYS NZ 1 1 20 37079 1 1 93 LYS O O -9.511 -8.164 -6.520 1.00 . A A . 93 LYS O 1 1 20 37080 1 1 94 LYS C C -8.392 -8.698 -9.222 1.00 . A A . 94 LYS C 1 1 20 37081 1 1 94 LYS CA C -8.273 -9.909 -8.295 1.00 . A A . 94 LYS CA 1 1 20 37082 1 1 94 LYS CB C -7.807 -11.182 -9.003 1.00 . A A . 94 LYS CB 1 1 20 37083 1 1 94 LYS CD C -5.326 -11.304 -8.567 1.00 . A A . 94 LYS CD 1 1 20 37084 1 1 94 LYS CE C -4.523 -12.292 -9.415 1.00 . A A . 94 LYS CE 1 1 20 37085 1 1 94 LYS CG C -6.698 -11.877 -8.209 1.00 . A A . 94 LYS CG 1 1 20 37086 1 1 94 LYS H H -9.992 -11.000 -7.853 1.00 . A A . 94 LYS H 1 1 20 37087 1 1 94 LYS HA H -7.538 -9.682 -7.523 1.00 . A A . 94 LYS HA 1 1 20 37088 1 1 94 LYS HB2 H -8.649 -11.863 -9.129 1.00 . A A . 94 LYS HB2 1 1 20 37089 1 1 94 LYS HB3 H -7.444 -10.936 -10.001 1.00 . A A . 94 LYS HB3 1 1 20 37090 1 1 94 LYS HD2 H -5.449 -10.367 -9.111 1.00 . A A . 94 LYS HD2 1 1 20 37091 1 1 94 LYS HD3 H -4.776 -11.071 -7.655 1.00 . A A . 94 LYS HD3 1 1 20 37092 1 1 94 LYS HE2 H -4.566 -13.284 -8.967 1.00 . A A . 94 LYS HE2 1 1 20 37093 1 1 94 LYS HE3 H -4.966 -12.371 -10.408 1.00 . A A . 94 LYS HE3 1 1 20 37094 1 1 94 LYS HG2 H -6.880 -11.755 -7.141 1.00 . A A . 94 LYS HG2 1 1 20 37095 1 1 94 LYS HG3 H -6.714 -12.947 -8.415 1.00 . A A . 94 LYS HG3 1 1 20 37096 1 1 94 LYS HZ1 H -2.823 -11.757 -10.495 1.00 . A A . 94 LYS HZ1 1 1 20 37097 1 1 94 LYS HZ2 H -2.960 -10.954 -9.085 1.00 . A A . 94 LYS HZ2 1 1 20 37098 1 1 94 LYS N N -9.547 -10.133 -7.631 1.00 . A A . 94 LYS N 1 1 20 37099 1 1 94 LYS NZ N -3.114 -11.853 -9.529 1.00 . A A . 94 LYS NZ 1 1 20 37100 1 1 94 LYS O O -7.389 -8.195 -9.724 1.00 . A A . 94 LYS O 1 1 20 37101 1 1 95 LYS C C -10.397 -5.956 -9.429 1.00 . A A . 95 LYS C 1 1 20 37102 1 1 95 LYS CA C -9.892 -7.123 -10.280 1.00 . A A . 95 LYS CA 1 1 20 37103 1 1 95 LYS CB C -10.842 -7.513 -11.414 1.00 . A A . 95 LYS CB 1 1 20 37104 1 1 95 LYS CD C -10.903 -7.813 -13.917 1.00 . A A . 95 LYS CD 1 1 20 37105 1 1 95 LYS CE C -9.873 -8.820 -14.432 1.00 . A A . 95 LYS CE 1 1 20 37106 1 1 95 LYS CG C -10.334 -6.990 -12.759 1.00 . A A . 95 LYS CG 1 1 20 37107 1 1 95 LYS H H -10.440 -8.680 -9.009 1.00 . A A . 95 LYS H 1 1 20 37108 1 1 95 LYS HA H -8.946 -6.833 -10.738 1.00 . A A . 95 LYS HA 1 1 20 37109 1 1 95 LYS HB2 H -10.941 -8.598 -11.455 1.00 . A A . 95 LYS HB2 1 1 20 37110 1 1 95 LYS HB3 H -11.836 -7.111 -11.215 1.00 . A A . 95 LYS HB3 1 1 20 37111 1 1 95 LYS HD2 H -11.799 -8.340 -13.588 1.00 . A A . 95 LYS HD2 1 1 20 37112 1 1 95 LYS HD3 H -11.203 -7.148 -14.727 1.00 . A A . 95 LYS HD3 1 1 20 37113 1 1 95 LYS HE2 H -9.604 -8.580 -15.461 1.00 . A A . 95 LYS HE2 1 1 20 37114 1 1 95 LYS HE3 H -8.960 -8.750 -13.841 1.00 . A A . 95 LYS HE3 1 1 20 37115 1 1 95 LYS HG2 H -10.618 -5.944 -12.878 1.00 . A A . 95 LYS HG2 1 1 20 37116 1 1 95 LYS HG3 H -9.245 -7.029 -12.781 1.00 . A A . 95 LYS HG3 1 1 20 37117 1 1 95 LYS HZ1 H -11.369 -10.247 -14.696 1.00 . A A . 95 LYS HZ1 1 1 20 37118 1 1 95 LYS HZ2 H -9.871 -10.846 -14.921 1.00 . A A . 95 LYS HZ2 1 1 20 37119 1 1 95 LYS N N -9.629 -8.265 -9.422 1.00 . A A . 95 LYS N 1 1 20 37120 1 1 95 LYS NZ N -10.413 -10.196 -14.361 1.00 . A A . 95 LYS NZ 1 1 20 37121 1 1 95 LYS O O -10.533 -4.837 -9.921 1.00 . A A . 95 LYS O 1 1 20 37122 1 1 96 ASP C C -10.141 -5.078 -6.102 1.00 . A A . 96 ASP C 1 1 20 37123 1 1 96 ASP CA C -11.147 -5.247 -7.241 1.00 . A A . 96 ASP CA 1 1 20 37124 1 1 96 ASP CB C -12.488 -5.660 -6.631 1.00 . A A . 96 ASP CB 1 1 20 37125 1 1 96 ASP CG C -13.684 -4.811 -7.064 1.00 . A A . 96 ASP CG 1 1 20 37126 1 1 96 ASP H H -10.546 -7.170 -7.773 1.00 . A A . 96 ASP H 1 1 20 37127 1 1 96 ASP HA H -11.257 -4.342 -7.838 1.00 . A A . 96 ASP HA 1 1 20 37128 1 1 96 ASP HB2 H -12.684 -6.700 -6.893 1.00 . A A . 96 ASP HB2 1 1 20 37129 1 1 96 ASP HB3 H -12.404 -5.616 -5.545 1.00 . A A . 96 ASP HB3 1 1 20 37130 1 1 96 ASP N N -10.660 -6.257 -8.166 1.00 . A A . 96 ASP N 1 1 20 37131 1 1 96 ASP O O -10.361 -4.285 -5.187 1.00 . A A . 96 ASP O 1 1 20 37132 1 1 96 ASP OD1 O -14.229 -5.110 -8.149 1.00 . A A . 96 ASP OD1 1 1 20 37133 1 1 96 ASP OD2 O -14.028 -3.883 -6.301 1.00 . A A . 96 ASP OD2 1 1 20 37134 1 1 97 LEU C C -6.670 -5.509 -5.855 1.00 . A A . 97 LEU C 1 1 20 37135 1 1 97 LEU CA C -8.017 -5.779 -5.181 1.00 . A A . 97 LEU CA 1 1 20 37136 1 1 97 LEU CB C -8.032 -7.047 -4.326 1.00 . A A . 97 LEU CB 1 1 20 37137 1 1 97 LEU CD1 C -8.994 -8.344 -2.388 1.00 . A A . 97 LEU CD1 1 1 20 37138 1 1 97 LEU CD2 C -9.552 -5.887 -2.682 1.00 . A A . 97 LEU CD2 1 1 20 37139 1 1 97 LEU CG C -9.228 -7.207 -3.384 1.00 . A A . 97 LEU CG 1 1 20 37140 1 1 97 LEU H H -8.886 -6.477 -6.941 1.00 . A A . 97 LEU H 1 1 20 37141 1 1 97 LEU HA H -8.247 -4.942 -4.522 1.00 . A A . 97 LEU HA 1 1 20 37142 1 1 97 LEU HB2 H -8.001 -7.911 -4.990 1.00 . A A . 97 LEU HB2 1 1 20 37143 1 1 97 LEU HB3 H -7.120 -7.071 -3.729 1.00 . A A . 97 LEU HB3 1 1 20 37144 1 1 97 LEU HD11 H -8.245 -9.028 -2.787 1.00 . A A . 97 LEU HD11 1 1 20 37145 1 1 97 LEU HD12 H -8.643 -7.932 -1.442 1.00 . A A . 97 LEU HD12 1 1 20 37146 1 1 97 LEU HD13 H -9.928 -8.882 -2.226 1.00 . A A . 97 LEU HD13 1 1 20 37147 1 1 97 LEU HD21 H -8.642 -5.296 -2.580 1.00 . A A . 97 LEU HD21 1 1 20 37148 1 1 97 LEU HD22 H -10.282 -5.331 -3.270 1.00 . A A . 97 LEU HD22 1 1 20 37149 1 1 97 LEU HD23 H -9.963 -6.093 -1.693 1.00 . A A . 97 LEU HD23 1 1 20 37150 1 1 97 LEU HG H -10.099 -7.476 -3.981 1.00 . A A . 97 LEU HG 1 1 20 37151 1 1 97 LEU N N -9.057 -5.835 -6.194 1.00 . A A . 97 LEU N 1 1 20 37152 1 1 97 LEU O O -5.897 -4.671 -5.392 1.00 . A A . 97 LEU O 1 1 20 37153 1 1 98 THR C C -5.472 -5.568 -9.092 1.00 . A A . 98 THR C 1 1 20 37154 1 1 98 THR CA C -5.189 -6.083 -7.679 1.00 . A A . 98 THR CA 1 1 20 37155 1 1 98 THR CB C -4.458 -7.427 -7.657 1.00 . A A . 98 THR CB 1 1 20 37156 1 1 98 THR CG2 C -4.619 -8.159 -6.323 1.00 . A A . 98 THR CG2 1 1 20 37157 1 1 98 THR H H -7.063 -6.913 -7.308 1.00 . A A . 98 THR H 1 1 20 37158 1 1 98 THR HA H -4.580 -5.329 -7.181 1.00 . A A . 98 THR HA 1 1 20 37159 1 1 98 THR HB H -3.405 -7.301 -7.908 1.00 . A A . 98 THR HB 1 1 20 37160 1 1 98 THR HG1 H -6.115 -8.377 -8.255 1.00 . A A . 98 THR HG1 1 1 20 37161 1 1 98 THR HG21 H -5.679 -8.248 -6.083 1.00 . A A . 98 THR HG21 1 1 20 37162 1 1 98 THR HG22 H -4.179 -9.153 -6.399 1.00 . A A . 98 THR HG22 1 1 20 37163 1 1 98 THR HG23 H -4.115 -7.597 -5.537 1.00 . A A . 98 THR HG23 1 1 20 37164 1 1 98 THR N N -6.430 -6.234 -6.938 1.00 . A A . 98 THR N 1 1 20 37165 1 1 98 THR O O -4.596 -5.598 -9.955 1.00 . A A . 98 THR O 1 1 20 37166 1 1 98 THR OG1 O -5.183 -8.231 -8.584 1.00 . A A . 98 THR OG1 1 1 20 37167 1 1 99 GLY C C -6.301 -3.342 -10.950 1.00 . A A . 99 GLY C 1 1 20 37168 1 1 99 GLY CA C -7.109 -4.588 -10.579 1.00 . A A . 99 GLY CA 1 1 20 37169 1 1 99 GLY H H -7.406 -5.086 -8.578 1.00 . A A . 99 GLY H 1 1 20 37170 1 1 99 GLY HA2 H -6.974 -5.354 -11.342 1.00 . A A . 99 GLY HA2 1 1 20 37171 1 1 99 GLY HA3 H -8.171 -4.344 -10.557 1.00 . A A . 99 GLY HA3 1 1 20 37172 1 1 99 GLY N N -6.700 -5.108 -9.285 1.00 . A A . 99 GLY N 1 1 20 37173 1 1 99 GLY O O -5.823 -2.624 -10.073 1.00 . A A . 99 GLY O 1 1 20 37174 1 1 100 CYS C C -6.404 -0.808 -12.904 1.00 . A A . 100 CYS C 1 1 20 37175 1 1 100 CYS CA C -5.432 -1.979 -12.748 1.00 . A A . 100 CYS CA 1 1 20 37176 1 1 100 CYS CB C -4.709 -2.298 -14.058 1.00 . A A . 100 CYS CB 1 1 20 37177 1 1 100 CYS H H -6.566 -3.713 -12.957 1.00 . A A . 100 CYS H 1 1 20 37178 1 1 100 CYS HA H -4.669 -1.752 -12.003 1.00 . A A . 100 CYS HA 1 1 20 37179 1 1 100 CYS HB2 H -5.275 -3.061 -14.592 1.00 . A A . 100 CYS HB2 1 1 20 37180 1 1 100 CYS HB3 H -4.708 -1.406 -14.683 1.00 . A A . 100 CYS HB3 1 1 20 37181 1 1 100 CYS N N -6.174 -3.124 -12.250 1.00 . A A . 100 CYS N 1 1 20 37182 1 1 100 CYS O O -6.198 0.257 -12.323 1.00 . A A . 100 CYS O 1 1 20 37183 1 1 100 CYS SG S -2.985 -2.878 -13.861 1.00 . A A . 100 CYS SG 1 1 20 37184 1 1 101 LYS C C -9.822 -0.557 -13.521 1.00 . A A . 101 LYS C 1 1 20 37185 1 1 101 LYS CA C -8.448 -0.022 -13.930 1.00 . A A . 101 LYS CA 1 1 20 37186 1 1 101 LYS CB C -8.385 0.463 -15.380 1.00 . A A . 101 LYS CB 1 1 20 37187 1 1 101 LYS CD C -10.749 0.415 -16.257 1.00 . A A . 101 LYS CD 1 1 20 37188 1 1 101 LYS CE C -10.792 0.426 -17.786 1.00 . A A . 101 LYS CE 1 1 20 37189 1 1 101 LYS CG C -9.616 1.300 -15.733 1.00 . A A . 101 LYS CG 1 1 20 37190 1 1 101 LYS H H -7.605 -1.913 -14.159 1.00 . A A . 101 LYS H 1 1 20 37191 1 1 101 LYS HA H -8.206 0.830 -13.295 1.00 . A A . 101 LYS HA 1 1 20 37192 1 1 101 LYS HB2 H -7.482 1.055 -15.531 1.00 . A A . 101 LYS HB2 1 1 20 37193 1 1 101 LYS HB3 H -8.318 -0.394 -16.051 1.00 . A A . 101 LYS HB3 1 1 20 37194 1 1 101 LYS HD2 H -10.612 -0.606 -15.901 1.00 . A A . 101 LYS HD2 1 1 20 37195 1 1 101 LYS HD3 H -11.702 0.766 -15.860 1.00 . A A . 101 LYS HD3 1 1 20 37196 1 1 101 LYS HE2 H -9.801 0.207 -18.185 1.00 . A A . 101 LYS HE2 1 1 20 37197 1 1 101 LYS HE3 H -11.459 -0.358 -18.143 1.00 . A A . 101 LYS HE3 1 1 20 37198 1 1 101 LYS HG2 H -9.953 1.846 -14.853 1.00 . A A . 101 LYS HG2 1 1 20 37199 1 1 101 LYS HG3 H -9.351 2.042 -16.487 1.00 . A A . 101 LYS HG3 1 1 20 37200 1 1 101 LYS HZ1 H -11.933 2.166 -17.660 1.00 . A A . 101 LYS HZ1 1 1 20 37201 1 1 101 LYS HZ2 H -10.489 2.402 -18.375 1.00 . A A . 101 LYS HZ2 1 1 20 37202 1 1 101 LYS N N -7.444 -1.044 -13.691 1.00 . A A . 101 LYS N 1 1 20 37203 1 1 101 LYS NZ N -11.253 1.742 -18.282 1.00 . A A . 101 LYS NZ 1 1 20 37204 1 1 101 LYS O O -10.179 -1.685 -13.858 1.00 . A A . 101 LYS O 1 1 20 37205 1 1 102 LYS C C -11.754 -1.037 -11.139 1.00 . A A . 102 LYS C 1 1 20 37206 1 1 102 LYS CA C -11.882 -0.097 -12.340 1.00 . A A . 102 LYS CA 1 1 20 37207 1 1 102 LYS CB C -12.703 -0.680 -13.492 1.00 . A A . 102 LYS CB 1 1 20 37208 1 1 102 LYS CD C -13.539 1.529 -14.377 1.00 . A A . 102 LYS CD 1 1 20 37209 1 1 102 LYS CE C -14.302 2.674 -13.707 1.00 . A A . 102 LYS CE 1 1 20 37210 1 1 102 LYS CG C -13.937 0.180 -13.775 1.00 . A A . 102 LYS CG 1 1 20 37211 1 1 102 LYS H H -10.258 1.194 -12.530 1.00 . A A . 102 LYS H 1 1 20 37212 1 1 102 LYS HA H -12.385 0.813 -12.014 1.00 . A A . 102 LYS HA 1 1 20 37213 1 1 102 LYS HB2 H -12.086 -0.743 -14.388 1.00 . A A . 102 LYS HB2 1 1 20 37214 1 1 102 LYS HB3 H -13.012 -1.696 -13.245 1.00 . A A . 102 LYS HB3 1 1 20 37215 1 1 102 LYS HD2 H -12.466 1.683 -14.256 1.00 . A A . 102 LYS HD2 1 1 20 37216 1 1 102 LYS HD3 H -13.742 1.528 -15.447 1.00 . A A . 102 LYS HD3 1 1 20 37217 1 1 102 LYS HE2 H -14.967 2.277 -12.941 1.00 . A A . 102 LYS HE2 1 1 20 37218 1 1 102 LYS HE3 H -13.601 3.342 -13.206 1.00 . A A . 102 LYS HE3 1 1 20 37219 1 1 102 LYS HG2 H -14.601 -0.346 -14.461 1.00 . A A . 102 LYS HG2 1 1 20 37220 1 1 102 LYS HG3 H -14.494 0.339 -12.852 1.00 . A A . 102 LYS HG3 1 1 20 37221 1 1 102 LYS HZ1 H -14.667 4.329 -14.920 1.00 . A A . 102 LYS HZ1 1 1 20 37222 1 1 102 LYS HZ2 H -15.163 2.929 -15.588 1.00 . A A . 102 LYS HZ2 1 1 20 37223 1 1 102 LYS N N -10.556 0.278 -12.799 1.00 . A A . 102 LYS N 1 1 20 37224 1 1 102 LYS NZ N -15.086 3.430 -14.710 1.00 . A A . 102 LYS NZ 1 1 20 37225 1 1 102 LYS O O -12.428 -2.064 -11.075 1.00 . A A . 102 LYS O 1 1 20 37226 1 1 103 SER C C -10.988 -0.623 -7.775 1.00 . A A . 103 SER C 1 1 20 37227 1 1 103 SER CA C -10.660 -1.447 -9.022 1.00 . A A . 103 SER CA 1 1 20 37228 1 1 103 SER CB C -9.217 -1.951 -8.959 1.00 . A A . 103 SER CB 1 1 20 37229 1 1 103 SER H H -10.341 0.186 -10.276 1.00 . A A . 103 SER H 1 1 20 37230 1 1 103 SER HA H -11.337 -2.296 -9.108 1.00 . A A . 103 SER HA 1 1 20 37231 1 1 103 SER HB2 H -8.882 -1.967 -7.922 1.00 . A A . 103 SER HB2 1 1 20 37232 1 1 103 SER HB3 H -9.176 -2.978 -9.323 1.00 . A A . 103 SER HB3 1 1 20 37233 1 1 103 SER HG H -8.451 -0.178 -9.484 1.00 . A A . 103 SER HG 1 1 20 37234 1 1 103 SER N N -10.885 -0.651 -10.217 1.00 . A A . 103 SER N 1 1 20 37235 1 1 103 SER O O -11.487 0.497 -7.880 1.00 . A A . 103 SER O 1 1 20 37236 1 1 103 SER OG O -8.334 -1.140 -9.730 1.00 . A A . 103 SER OG 1 1 20 37237 1 1 104 LYS C C -9.908 0.555 -5.141 1.00 . A A . 104 LYS C 1 1 20 37238 1 1 104 LYS CA C -10.953 -0.542 -5.358 1.00 . A A . 104 LYS CA 1 1 20 37239 1 1 104 LYS CB C -11.019 -1.562 -4.219 1.00 . A A . 104 LYS CB 1 1 20 37240 1 1 104 LYS CD C -13.506 -1.753 -3.851 1.00 . A A . 104 LYS CD 1 1 20 37241 1 1 104 LYS CE C -14.465 -2.746 -3.190 1.00 . A A . 104 LYS CE 1 1 20 37242 1 1 104 LYS CG C -12.248 -2.461 -4.359 1.00 . A A . 104 LYS CG 1 1 20 37243 1 1 104 LYS H H -10.289 -2.119 -6.547 1.00 . A A . 104 LYS H 1 1 20 37244 1 1 104 LYS HA H -11.935 -0.075 -5.429 1.00 . A A . 104 LYS HA 1 1 20 37245 1 1 104 LYS HB2 H -10.116 -2.172 -4.220 1.00 . A A . 104 LYS HB2 1 1 20 37246 1 1 104 LYS HB3 H -11.051 -1.042 -3.262 1.00 . A A . 104 LYS HB3 1 1 20 37247 1 1 104 LYS HD2 H -13.228 -0.979 -3.136 1.00 . A A . 104 LYS HD2 1 1 20 37248 1 1 104 LYS HD3 H -14.008 -1.255 -4.681 1.00 . A A . 104 LYS HD3 1 1 20 37249 1 1 104 LYS HE2 H -13.907 -3.603 -2.813 1.00 . A A . 104 LYS HE2 1 1 20 37250 1 1 104 LYS HE3 H -14.948 -2.277 -2.333 1.00 . A A . 104 LYS HE3 1 1 20 37251 1 1 104 LYS HG2 H -12.381 -2.741 -5.404 1.00 . A A . 104 LYS HG2 1 1 20 37252 1 1 104 LYS HG3 H -12.095 -3.384 -3.799 1.00 . A A . 104 LYS HG3 1 1 20 37253 1 1 104 LYS HZ1 H -16.365 -3.431 -3.702 1.00 . A A . 104 LYS HZ1 1 1 20 37254 1 1 104 LYS HZ2 H -15.698 -2.490 -4.851 1.00 . A A . 104 LYS HZ2 1 1 20 37255 1 1 104 LYS N N -10.694 -1.208 -6.623 1.00 . A A . 104 LYS N 1 1 20 37256 1 1 104 LYS NZ N -15.489 -3.199 -4.157 1.00 . A A . 104 LYS NZ 1 1 20 37257 1 1 104 LYS O O -10.192 1.571 -4.510 1.00 . A A . 104 LYS O 1 1 20 37258 1 1 105 CYS C C -7.798 2.330 -6.637 1.00 . A A . 105 CYS C 1 1 20 37259 1 1 105 CYS CA C -7.633 1.265 -5.550 1.00 . A A . 105 CYS CA 1 1 20 37260 1 1 105 CYS CB C -6.267 0.579 -5.627 1.00 . A A . 105 CYS CB 1 1 20 37261 1 1 105 CYS H H -8.499 -0.518 -6.190 1.00 . A A . 105 CYS H 1 1 20 37262 1 1 105 CYS HA H -7.719 1.708 -4.558 1.00 . A A . 105 CYS HA 1 1 20 37263 1 1 105 CYS HB2 H -6.124 0.145 -6.616 1.00 . A A . 105 CYS HB2 1 1 20 37264 1 1 105 CYS HB3 H -5.474 1.313 -5.483 1.00 . A A . 105 CYS HB3 1 1 20 37265 1 1 105 CYS N N -8.721 0.311 -5.677 1.00 . A A . 105 CYS N 1 1 20 37266 1 1 105 CYS O O -8.001 3.505 -6.334 1.00 . A A . 105 CYS O 1 1 20 37267 1 1 105 CYS SG S -6.150 -0.725 -4.349 1.00 . A A . 105 CYS SG 1 1 20 37268 1 1 106 HIS C C -9.252 2.667 -9.592 1.00 . A A . 106 HIS C 1 1 20 37269 1 1 106 HIS CA C -7.840 2.780 -9.013 1.00 . A A . 106 HIS CA 1 1 20 37270 1 1 106 HIS CB C -6.750 2.514 -10.052 1.00 . A A . 106 HIS CB 1 1 20 37271 1 1 106 HIS CD2 C -4.282 1.856 -9.497 1.00 . A A . 106 HIS CD2 1 1 20 37272 1 1 106 HIS CE1 C -3.644 3.754 -8.615 1.00 . A A . 106 HIS CE1 1 1 20 37273 1 1 106 HIS CG C -5.345 2.709 -9.533 1.00 . A A . 106 HIS CG 1 1 20 37274 1 1 106 HIS H H -7.539 0.924 -8.118 1.00 . A A . 106 HIS H 1 1 20 37275 1 1 106 HIS HA H -7.694 3.790 -8.630 1.00 . A A . 106 HIS HA 1 1 20 37276 1 1 106 HIS HB2 H -6.853 1.492 -10.417 1.00 . A A . 106 HIS HB2 1 1 20 37277 1 1 106 HIS HB3 H -6.906 3.174 -10.905 1.00 . A A . 106 HIS HB3 1 1 20 37278 1 1 106 HIS HD1 H -5.464 4.722 -8.850 1.00 . A A . 106 HIS HD1 1 1 20 37279 1 1 106 HIS HD2 H -4.276 0.829 -9.862 1.00 . A A . 106 HIS HD2 1 1 20 37280 1 1 106 HIS HE1 H -3.021 4.514 -8.143 1.00 . A A . 106 HIS HE1 1 1 20 37281 1 1 106 HIS N N -7.704 1.881 -7.880 1.00 . A A . 106 HIS N 1 1 20 37282 1 1 106 HIS ND1 N -4.913 3.897 -8.969 1.00 . A A . 106 HIS ND1 1 1 20 37283 1 1 106 HIS NE2 N -3.255 2.488 -8.943 1.00 . A A . 106 HIS NE2 1 1 20 37284 1 1 106 HIS O O -9.751 1.563 -9.809 1.00 . A A . 106 HIS O 1 1 20 37285 1 1 107 GLU C C -11.159 4.272 -11.849 1.00 . A A . 107 GLU C 1 1 20 37286 1 1 107 GLU CA C -11.201 3.866 -10.375 1.00 . A A . 107 GLU CA 1 1 20 37287 1 1 107 GLU CB C -12.091 4.816 -9.570 1.00 . A A . 107 GLU CB 1 1 20 37288 1 1 107 GLU CD C -13.863 4.752 -7.778 1.00 . A A . 107 GLU CD 1 1 20 37289 1 1 107 GLU CG C -12.529 4.173 -8.253 1.00 . A A . 107 GLU CG 1 1 20 37290 1 1 107 GLU H H -9.443 4.715 -9.646 1.00 . A A . 107 GLU H 1 1 20 37291 1 1 107 GLU HA H -11.585 2.851 -10.281 1.00 . A A . 107 GLU HA 1 1 20 37292 1 1 107 GLU HB2 H -11.551 5.740 -9.365 1.00 . A A . 107 GLU HB2 1 1 20 37293 1 1 107 GLU HB3 H -12.968 5.083 -10.158 1.00 . A A . 107 GLU HB3 1 1 20 37294 1 1 107 GLU HG2 H -12.622 3.095 -8.384 1.00 . A A . 107 GLU HG2 1 1 20 37295 1 1 107 GLU HG3 H -11.766 4.337 -7.492 1.00 . A A . 107 GLU HG3 1 1 20 37296 1 1 107 GLU N N -9.856 3.822 -9.825 1.00 . A A . 107 GLU N 1 1 20 37297 1 1 107 GLU O O -12.073 4.931 -12.342 1.00 . A A . 107 GLU O 1 1 20 37298 1 1 107 GLU OXT O -10.164 3.903 -12.511 1.00 . A A . 107 GLU OXT 1 1 20 37299 1 1 107 GLU OE1 O -13.940 5.996 -7.681 1.00 . A A . 107 GLU OE1 1 1 20 37300 1 1 107 GLU OE2 O -14.776 3.937 -7.522 1.00 . A A . 107 GLU OE2 1 1 20 37301 2 2 1 HEC C1A C -1.233 5.503 9.272 1.00 . B A . 108 HEC C1A 1 1 20 37302 2 2 1 HEC C1B C -2.140 2.305 12.033 1.00 . B A . 108 HEC C1B 1 1 20 37303 2 2 1 HEC C1C C -2.272 -0.502 8.698 1.00 . B A . 108 HEC C1C 1 1 20 37304 2 2 1 HEC C1D C -1.164 2.683 5.996 1.00 . B A . 108 HEC C1D 1 1 20 37305 2 2 1 HEC C2A C -1.145 6.557 10.255 1.00 . B A . 108 HEC C2A 1 1 20 37306 2 2 1 HEC C2B C -2.571 1.388 13.061 1.00 . B A . 108 HEC C2B 1 1 20 37307 2 2 1 HEC C2C C -2.313 -1.556 7.712 1.00 . B A . 108 HEC C2C 1 1 20 37308 2 2 1 HEC C2D C -0.744 3.619 4.980 1.00 . B A . 108 HEC C2D 1 1 20 37309 2 2 1 HEC C3A C -1.362 5.993 11.462 1.00 . B A . 108 HEC C3A 1 1 20 37310 2 2 1 HEC C3B C -2.753 0.187 12.472 1.00 . B A . 108 HEC C3B 1 1 20 37311 2 2 1 HEC C3C C -1.983 -1.003 6.526 1.00 . B A . 108 HEC C3C 1 1 20 37312 2 2 1 HEC C3D C -0.661 4.831 5.568 1.00 . B A . 108 HEC C3D 1 1 20 37313 2 2 1 HEC C4A C -1.586 4.584 11.238 1.00 . B A . 108 HEC C4A 1 1 20 37314 2 2 1 HEC C4B C -2.437 0.349 11.072 1.00 . B A . 108 HEC C4B 1 1 20 37315 2 2 1 HEC C4C C -1.735 0.399 6.766 1.00 . B A . 108 HEC C4C 1 1 20 37316 2 2 1 HEC C4D C -1.029 4.658 6.953 1.00 . B A . 108 HEC C4D 1 1 20 37317 2 2 1 HEC CAA C -0.863 7.998 9.946 1.00 . B A . 108 HEC CAA 1 1 20 37318 2 2 1 HEC CAB C -3.199 -1.097 13.108 1.00 . B A . 108 HEC CAB 1 1 20 37319 2 2 1 HEC CAC C -1.880 -1.677 5.189 1.00 . B A . 108 HEC CAC 1 1 20 37320 2 2 1 HEC CAD C -0.267 6.137 4.941 1.00 . B A . 108 HEC CAD 1 1 20 37321 2 2 1 HEC CBA C 0.302 8.586 10.737 1.00 . B A . 108 HEC CBA 1 1 20 37322 2 2 1 HEC CBB C -4.467 -0.967 13.946 1.00 . B A . 108 HEC CBB 1 1 20 37323 2 2 1 HEC CBC C -2.869 -2.824 4.995 1.00 . B A . 108 HEC CBC 1 1 20 37324 2 2 1 HEC CBD C -0.861 6.364 3.554 1.00 . B A . 108 HEC CBD 1 1 20 37325 2 2 1 HEC CGA C -0.138 9.804 11.537 1.00 . B A . 108 HEC CGA 1 1 20 37326 2 2 1 HEC CGD C 0.223 6.714 2.544 1.00 . B A . 108 HEC CGD 1 1 20 37327 2 2 1 HEC CHA C -1.066 5.694 7.904 1.00 . B A . 108 HEC CHA 1 1 20 37328 2 2 1 HEC CHB C -1.850 3.647 12.254 1.00 . B A . 108 HEC CHB 1 1 20 37329 2 2 1 HEC CHC C -2.504 -0.679 10.115 1.00 . B A . 108 HEC CHC 1 1 20 37330 2 2 1 HEC CHD C -1.363 1.324 5.773 1.00 . B A . 108 HEC CHD 1 1 20 37331 2 2 1 HEC CMA C -1.376 6.662 12.806 1.00 . B A . 108 HEC CMA 1 1 20 37332 2 2 1 HEC CMB C -2.767 1.747 14.505 1.00 . B A . 108 HEC CMB 1 1 20 37333 2 2 1 HEC CMC C -2.662 -2.987 8.000 1.00 . B A . 108 HEC CMC 1 1 20 37334 2 2 1 HEC CMD C -0.464 3.264 3.549 1.00 . B A . 108 HEC CMD 1 1 20 37335 2 2 1 HEC FE FE -1.704 2.495 9.003 1.00 . B A . 108 HEC FE 1 1 20 37336 2 2 1 HEC HAA1 H -0.618 8.102 8.889 1.00 . B A . 108 HEC HAA1 1 1 20 37337 2 2 1 HEC HAA2 H -1.743 8.599 10.176 1.00 . B A . 108 HEC HAA2 1 1 20 37338 2 2 1 HEC HAB H -3.400 -1.836 12.333 1.00 . B A . 108 HEC HAB 1 1 20 37339 2 2 1 HEC HAC H -2.072 -0.950 4.400 1.00 . B A . 108 HEC HAC 1 1 20 37340 2 2 1 HEC HAD1 H -0.602 6.959 5.573 1.00 . B A . 108 HEC HAD1 1 1 20 37341 2 2 1 HEC HAD2 H 0.818 6.177 4.837 1.00 . B A . 108 HEC HAD2 1 1 20 37342 2 2 1 HEC HBA1 H 0.687 7.836 11.428 1.00 . B A . 108 HEC HBA1 1 1 20 37343 2 2 1 HEC HBA2 H 1.093 8.888 10.050 1.00 . B A . 108 HEC HBA2 1 1 20 37344 2 2 1 HEC HBB1 H -5.097 -1.843 13.790 1.00 . B A . 108 HEC HBB1 1 1 20 37345 2 2 1 HEC HBB2 H -4.200 -0.895 15.001 1.00 . B A . 108 HEC HBB2 1 1 20 37346 2 2 1 HEC HBB3 H -5.010 -0.071 13.647 1.00 . B A . 108 HEC HBB3 1 1 20 37347 2 2 1 HEC HBC1 H -3.786 -2.610 5.543 1.00 . B A . 108 HEC HBC1 1 1 20 37348 2 2 1 HEC HBC2 H -3.096 -2.932 3.934 1.00 . B A . 108 HEC HBC2 1 1 20 37349 2 2 1 HEC HBC3 H -2.430 -3.749 5.368 1.00 . B A . 108 HEC HBC3 1 1 20 37350 2 2 1 HEC HBD1 H -1.367 5.457 3.222 1.00 . B A . 108 HEC HBD1 1 1 20 37351 2 2 1 HEC HBD2 H -1.577 7.185 3.595 1.00 . B A . 108 HEC HBD2 1 1 20 37352 2 2 1 HEC HHA H -0.957 6.715 7.540 1.00 . B A . 108 HEC HHA 1 1 20 37353 2 2 1 HEC HHB H -1.823 4.002 13.284 1.00 . B A . 108 HEC HHB 1 1 20 37354 2 2 1 HEC HHC H -2.724 -1.685 10.473 1.00 . B A . 108 HEC HHC 1 1 20 37355 2 2 1 HEC HHD H -1.222 0.945 4.761 1.00 . B A . 108 HEC HHD 1 1 20 37356 2 2 1 HEC HMA1 H -0.970 5.982 13.555 1.00 . B A . 108 HEC HMA1 1 1 20 37357 2 2 1 HEC HMA2 H -0.767 7.565 12.768 1.00 . B A . 108 HEC HMA2 1 1 20 37358 2 2 1 HEC HMA3 H -2.400 6.925 13.070 1.00 . B A . 108 HEC HMA3 1 1 20 37359 2 2 1 HEC HMB1 H -2.620 0.861 15.124 1.00 . B A . 108 HEC HMB1 1 1 20 37360 2 2 1 HEC HMB2 H -2.046 2.513 14.790 1.00 . B A . 108 HEC HMB2 1 1 20 37361 2 2 1 HEC HMB3 H -3.778 2.128 14.651 1.00 . B A . 108 HEC HMB3 1 1 20 37362 2 2 1 HEC HMC1 H -2.431 -3.216 9.040 1.00 . B A . 108 HEC HMC1 1 1 20 37363 2 2 1 HEC HMC2 H -3.726 -3.145 7.821 1.00 . B A . 108 HEC HMC2 1 1 20 37364 2 2 1 HEC HMC3 H -2.084 -3.641 7.347 1.00 . B A . 108 HEC HMC3 1 1 20 37365 2 2 1 HEC HMD1 H 0.112 4.064 3.083 1.00 . B A . 108 HEC HMD1 1 1 20 37366 2 2 1 HEC HMD2 H 0.106 2.336 3.509 1.00 . B A . 108 HEC HMD2 1 1 20 37367 2 2 1 HEC HMD3 H -1.405 3.136 3.015 1.00 . B A . 108 HEC HMD3 1 1 20 37368 2 2 1 HEC NA N -1.505 4.294 9.887 1.00 . B A . 108 HEC NA 1 1 20 37369 2 2 1 HEC NB N -2.061 1.656 10.813 1.00 . B A . 108 HEC NB 1 1 20 37370 2 2 1 HEC NC N -1.916 0.697 8.105 1.00 . B A . 108 HEC NC 1 1 20 37371 2 2 1 HEC ND N -1.336 3.332 7.206 1.00 . B A . 108 HEC ND 1 1 20 37372 2 2 1 HEC O1A O 0.543 10.844 11.409 1.00 . B A . 108 HEC O1A 1 1 20 37373 2 2 1 HEC O1D O 1.118 5.862 2.355 1.00 . B A . 108 HEC O1D 1 1 20 37374 2 2 1 HEC O2A O -1.148 9.672 12.262 1.00 . B A . 108 HEC O2A 1 1 20 37375 2 2 1 HEC O2D O 0.136 7.826 1.980 1.00 . B A . 108 HEC O2D 1 1 20 37376 3 2 1 HEC C1A C 9.469 -1.619 1.757 1.00 . C A . 109 HEC C1A 1 1 20 37377 3 2 1 HEC C1B C 5.645 0.117 2.778 1.00 . C A . 109 HEC C1B 1 1 20 37378 3 2 1 HEC C1C C 7.704 3.146 5.180 1.00 . C A . 109 HEC C1C 1 1 20 37379 3 2 1 HEC C1D C 11.503 1.557 3.869 1.00 . C A . 109 HEC C1D 1 1 20 37380 3 2 1 HEC C2A C 8.953 -2.700 0.951 1.00 . C A . 109 HEC C2A 1 1 20 37381 3 2 1 HEC C2B C 4.293 0.476 3.137 1.00 . C A . 109 HEC C2B 1 1 20 37382 3 2 1 HEC C2C C 8.233 4.281 5.899 1.00 . C A . 109 HEC C2C 1 1 20 37383 3 2 1 HEC C2D C 12.847 1.120 3.575 1.00 . C A . 109 HEC C2D 1 1 20 37384 3 2 1 HEC C3A C 7.611 -2.567 0.920 1.00 . C A . 109 HEC C3A 1 1 20 37385 3 2 1 HEC C3B C 4.372 1.526 3.982 1.00 . C A . 109 HEC C3B 1 1 20 37386 3 2 1 HEC C3C C 9.576 4.246 5.763 1.00 . C A . 109 HEC C3C 1 1 20 37387 3 2 1 HEC C3D C 12.747 -0.022 2.864 1.00 . C A . 109 HEC C3D 1 1 20 37388 3 2 1 HEC C4A C 7.281 -1.401 1.706 1.00 . C A . 109 HEC C4A 1 1 20 37389 3 2 1 HEC C4B C 5.774 1.827 4.154 1.00 . C A . 109 HEC C4B 1 1 20 37390 3 2 1 HEC C4C C 9.891 3.090 4.959 1.00 . C A . 109 HEC C4C 1 1 20 37391 3 2 1 HEC C4D C 11.339 -0.305 2.710 1.00 . C A . 109 HEC C4D 1 1 20 37392 3 2 1 HEC CAA C 9.793 -3.754 0.290 1.00 . C A . 109 HEC CAA 1 1 20 37393 3 2 1 HEC CAB C 3.247 2.270 4.640 1.00 . C A . 109 HEC CAB 1 1 20 37394 3 2 1 HEC CAC C 10.586 5.205 6.324 1.00 . C A . 109 HEC CAC 1 1 20 37395 3 2 1 HEC CAD C 13.858 -0.870 2.316 1.00 . C A . 109 HEC CAD 1 1 20 37396 3 2 1 HEC CBA C 10.053 -3.501 -1.193 1.00 . C A . 109 HEC CBA 1 1 20 37397 3 2 1 HEC CBB C 2.186 1.366 5.262 1.00 . C A . 109 HEC CBB 1 1 20 37398 3 2 1 HEC CBC C 10.583 5.289 7.847 1.00 . C A . 109 HEC CBC 1 1 20 37399 3 2 1 HEC CBD C 15.068 -0.980 3.239 1.00 . C A . 109 HEC CBD 1 1 20 37400 3 2 1 HEC CGA C 10.843 -4.644 -1.813 1.00 . C A . 109 HEC CGA 1 1 20 37401 3 2 1 HEC CGD C 16.115 0.071 2.897 1.00 . C A . 109 HEC CGD 1 1 20 37402 3 2 1 HEC CHA C 10.819 -1.417 2.024 1.00 . C A . 109 HEC CHA 1 1 20 37403 3 2 1 HEC CHB C 5.975 -0.926 1.919 1.00 . C A . 109 HEC CHB 1 1 20 37404 3 2 1 HEC CHC C 6.274 2.862 4.966 1.00 . C A . 109 HEC CHC 1 1 20 37405 3 2 1 HEC CHD C 11.194 2.705 4.591 1.00 . C A . 109 HEC CHD 1 1 20 37406 3 2 1 HEC CMA C 6.612 -3.438 0.215 1.00 . C A . 109 HEC CMA 1 1 20 37407 3 2 1 HEC CMB C 3.059 -0.218 2.639 1.00 . C A . 109 HEC CMB 1 1 20 37408 3 2 1 HEC CMC C 7.405 5.287 6.645 1.00 . C A . 109 HEC CMC 1 1 20 37409 3 2 1 HEC CMD C 14.095 1.837 4.002 1.00 . C A . 109 HEC CMD 1 1 20 37410 3 2 1 HEC FE FE 8.574 0.806 3.391 1.00 . C A . 109 HEC FE 1 1 20 37411 3 2 1 HEC HAA1 H 10.764 -3.807 0.782 1.00 . C A . 109 HEC HAA1 1 1 20 37412 3 2 1 HEC HAA2 H 9.293 -4.719 0.368 1.00 . C A . 109 HEC HAA2 1 1 20 37413 3 2 1 HEC HAB H 3.644 2.896 5.439 1.00 . C A . 109 HEC HAB 1 1 20 37414 3 2 1 HEC HAC H 11.587 4.896 6.021 1.00 . C A . 109 HEC HAC 1 1 20 37415 3 2 1 HEC HAD1 H 13.491 -1.883 2.145 1.00 . C A . 109 HEC HAD1 1 1 20 37416 3 2 1 HEC HAD2 H 14.208 -0.447 1.375 1.00 . C A . 109 HEC HAD2 1 1 20 37417 3 2 1 HEC HBA1 H 9.102 -3.409 -1.718 1.00 . C A . 109 HEC HBA1 1 1 20 37418 3 2 1 HEC HBA2 H 10.623 -2.579 -1.309 1.00 . C A . 109 HEC HBA2 1 1 20 37419 3 2 1 HEC HBB1 H 1.381 1.205 4.545 1.00 . C A . 109 HEC HBB1 1 1 20 37420 3 2 1 HEC HBB2 H 2.634 0.408 5.527 1.00 . C A . 109 HEC HBB2 1 1 20 37421 3 2 1 HEC HBB3 H 1.785 1.840 6.158 1.00 . C A . 109 HEC HBB3 1 1 20 37422 3 2 1 HEC HBC1 H 10.645 4.286 8.267 1.00 . C A . 109 HEC HBC1 1 1 20 37423 3 2 1 HEC HBC2 H 11.439 5.876 8.180 1.00 . C A . 109 HEC HBC2 1 1 20 37424 3 2 1 HEC HBC3 H 9.663 5.767 8.182 1.00 . C A . 109 HEC HBC3 1 1 20 37425 3 2 1 HEC HBD1 H 14.752 -0.833 4.272 1.00 . C A . 109 HEC HBD1 1 1 20 37426 3 2 1 HEC HBD2 H 15.517 -1.967 3.134 1.00 . C A . 109 HEC HBD2 1 1 20 37427 3 2 1 HEC HHA H 11.527 -2.171 1.679 1.00 . C A . 109 HEC HHA 1 1 20 37428 3 2 1 HEC HHB H 5.168 -1.411 1.369 1.00 . C A . 109 HEC HHB 1 1 20 37429 3 2 1 HEC HHC H 5.548 3.489 5.484 1.00 . C A . 109 HEC HHC 1 1 20 37430 3 2 1 HEC HHD H 12.014 3.355 4.895 1.00 . C A . 109 HEC HHD 1 1 20 37431 3 2 1 HEC HMA1 H 6.648 -3.240 -0.856 1.00 . C A . 109 HEC HMA1 1 1 20 37432 3 2 1 HEC HMA2 H 6.849 -4.485 0.400 1.00 . C A . 109 HEC HMA2 1 1 20 37433 3 2 1 HEC HMA3 H 5.612 -3.221 0.591 1.00 . C A . 109 HEC HMA3 1 1 20 37434 3 2 1 HEC HMB1 H 2.612 0.368 1.836 1.00 . C A . 109 HEC HMB1 1 1 20 37435 3 2 1 HEC HMB2 H 3.324 -1.206 2.263 1.00 . C A . 109 HEC HMB2 1 1 20 37436 3 2 1 HEC HMB3 H 2.345 -0.319 3.456 1.00 . C A . 109 HEC HMB3 1 1 20 37437 3 2 1 HEC HMC1 H 7.690 5.283 7.697 1.00 . C A . 109 HEC HMC1 1 1 20 37438 3 2 1 HEC HMC2 H 7.575 6.279 6.226 1.00 . C A . 109 HEC HMC2 1 1 20 37439 3 2 1 HEC HMC3 H 6.351 5.029 6.554 1.00 . C A . 109 HEC HMC3 1 1 20 37440 3 2 1 HEC HMD1 H 14.618 2.211 3.122 1.00 . C A . 109 HEC HMD1 1 1 20 37441 3 2 1 HEC HMD2 H 13.831 2.672 4.650 1.00 . C A . 109 HEC HMD2 1 1 20 37442 3 2 1 HEC HMD3 H 14.743 1.147 4.543 1.00 . C A . 109 HEC HMD3 1 1 20 37443 3 2 1 HEC NA N 8.432 -0.826 2.217 1.00 . C A . 109 HEC NA 1 1 20 37444 3 2 1 HEC NB N 6.548 0.955 3.409 1.00 . C A . 109 HEC NB 1 1 20 37445 3 2 1 HEC NC N 8.733 2.420 4.605 1.00 . C A . 109 HEC NC 1 1 20 37446 3 2 1 HEC ND N 10.583 0.673 3.332 1.00 . C A . 109 HEC ND 1 1 20 37447 3 2 1 HEC O1A O 11.722 -5.178 -1.102 1.00 . C A . 109 HEC O1A 1 1 20 37448 3 2 1 HEC O1D O 16.216 0.400 1.695 1.00 . C A . 109 HEC O1D 1 1 20 37449 3 2 1 HEC O2A O 10.554 -4.962 -2.987 1.00 . C A . 109 HEC O2A 1 1 20 37450 3 2 1 HEC O2D O 16.794 0.524 3.843 1.00 . C A . 109 HEC O2D 1 1 20 37451 4 2 1 HEC C1A C -8.710 -3.307 0.328 1.00 . D A . 110 HEC C1A 1 1 20 37452 4 2 1 HEC C1B C -4.998 -1.118 0.015 1.00 . D A . 110 HEC C1B 1 1 20 37453 4 2 1 HEC C1C C -2.920 -4.367 1.984 1.00 . D A . 110 HEC C1C 1 1 20 37454 4 2 1 HEC C1D C -6.636 -6.550 2.292 1.00 . D A . 110 HEC C1D 1 1 20 37455 4 2 1 HEC C2A C -9.531 -2.353 -0.377 1.00 . D A . 110 HEC C2A 1 1 20 37456 4 2 1 HEC C2B C -3.836 -0.293 -0.223 1.00 . D A . 110 HEC C2B 1 1 20 37457 4 2 1 HEC C2C C -2.076 -5.382 2.569 1.00 . D A . 110 HEC C2C 1 1 20 37458 4 2 1 HEC C2D C -7.798 -7.372 2.539 1.00 . D A . 110 HEC C2D 1 1 20 37459 4 2 1 HEC C3A C -8.730 -1.328 -0.738 1.00 . D A . 110 HEC C3A 1 1 20 37460 4 2 1 HEC C3B C -2.787 -0.909 0.361 1.00 . D A . 110 HEC C3B 1 1 20 37461 4 2 1 HEC C3C C -2.872 -6.426 2.885 1.00 . D A . 110 HEC C3C 1 1 20 37462 4 2 1 HEC C3D C -8.864 -6.711 2.039 1.00 . D A . 110 HEC C3D 1 1 20 37463 4 2 1 HEC C4A C -7.404 -1.638 -0.258 1.00 . D A . 110 HEC C4A 1 1 20 37464 4 2 1 HEC C4B C -3.288 -2.121 0.966 1.00 . D A . 110 HEC C4B 1 1 20 37465 4 2 1 HEC C4C C -4.216 -6.067 2.498 1.00 . D A . 110 HEC C4C 1 1 20 37466 4 2 1 HEC C4D C -8.373 -5.475 1.479 1.00 . D A . 110 HEC C4D 1 1 20 37467 4 2 1 HEC CAA C -11.001 -2.512 -0.639 1.00 . D A . 110 HEC CAA 1 1 20 37468 4 2 1 HEC CAB C -1.356 -0.458 0.400 1.00 . D A . 110 HEC CAB 1 1 20 37469 4 2 1 HEC CAC C -2.478 -7.729 3.518 1.00 . D A . 110 HEC CAC 1 1 20 37470 4 2 1 HEC CAD C -10.302 -7.141 2.044 1.00 . D A . 110 HEC CAD 1 1 20 37471 4 2 1 HEC CBA C -11.890 -1.697 0.297 1.00 . D A . 110 HEC CBA 1 1 20 37472 4 2 1 HEC CBB C -1.173 0.992 0.841 1.00 . D A . 110 HEC CBB 1 1 20 37473 4 2 1 HEC CBC C -1.179 -7.664 4.316 1.00 . D A . 110 HEC CBC 1 1 20 37474 4 2 1 HEC CBD C -10.882 -7.384 0.653 1.00 . D A . 110 HEC CBD 1 1 20 37475 4 2 1 HEC CGA C -11.144 -0.491 0.849 1.00 . D A . 110 HEC CGA 1 1 20 37476 4 2 1 HEC CGD C -11.529 -8.759 0.562 1.00 . D A . 110 HEC CGD 1 1 20 37477 4 2 1 HEC CHA C -9.181 -4.504 0.859 1.00 . D A . 110 HEC CHA 1 1 20 37478 4 2 1 HEC CHB C -6.278 -0.813 -0.435 1.00 . D A . 110 HEC CHB 1 1 20 37479 4 2 1 HEC CHC C -2.498 -3.044 1.675 1.00 . D A . 110 HEC CHC 1 1 20 37480 4 2 1 HEC CHD C -5.341 -6.896 2.664 1.00 . D A . 110 HEC CHD 1 1 20 37481 4 2 1 HEC CMA C -9.102 -0.085 -1.492 1.00 . D A . 110 HEC CMA 1 1 20 37482 4 2 1 HEC CMB C -3.843 1.001 -0.983 1.00 . D A . 110 HEC CMB 1 1 20 37483 4 2 1 HEC CMC C -0.594 -5.256 2.770 1.00 . D A . 110 HEC CMC 1 1 20 37484 4 2 1 HEC CMD C -7.776 -8.706 3.226 1.00 . D A . 110 HEC CMD 1 1 20 37485 4 2 1 HEC FE FE -5.821 -3.820 1.182 1.00 . D A . 110 HEC FE 1 1 20 37486 4 2 1 HEC HAA1 H -11.226 -2.192 -1.656 1.00 . D A . 110 HEC HAA1 1 1 20 37487 4 2 1 HEC HAA2 H -11.280 -3.559 -0.517 1.00 . D A . 110 HEC HAA2 1 1 20 37488 4 2 1 HEC HAB H -0.798 -1.079 1.100 1.00 . D A . 110 HEC HAB 1 1 20 37489 4 2 1 HEC HAC H -3.262 -8.051 4.204 1.00 . D A . 110 HEC HAC 1 1 20 37490 4 2 1 HEC HAD1 H -10.401 -8.073 2.601 1.00 . D A . 110 HEC HAD1 1 1 20 37491 4 2 1 HEC HAD2 H -10.911 -6.370 2.515 1.00 . D A . 110 HEC HAD2 1 1 20 37492 4 2 1 HEC HBA1 H -12.766 -1.346 -0.248 1.00 . D A . 110 HEC HBA1 1 1 20 37493 4 2 1 HEC HBA2 H -12.208 -2.322 1.132 1.00 . D A . 110 HEC HBA2 1 1 20 37494 4 2 1 HEC HBB1 H -1.500 1.658 0.042 1.00 . D A . 110 HEC HBB1 1 1 20 37495 4 2 1 HEC HBB2 H -1.768 1.177 1.735 1.00 . D A . 110 HEC HBB2 1 1 20 37496 4 2 1 HEC HBB3 H -0.122 1.176 1.060 1.00 . D A . 110 HEC HBB3 1 1 20 37497 4 2 1 HEC HBC1 H -1.021 -8.613 4.830 1.00 . D A . 110 HEC HBC1 1 1 20 37498 4 2 1 HEC HBC2 H -0.346 -7.474 3.639 1.00 . D A . 110 HEC HBC2 1 1 20 37499 4 2 1 HEC HBC3 H -1.243 -6.860 5.049 1.00 . D A . 110 HEC HBC3 1 1 20 37500 4 2 1 HEC HBD1 H -11.637 -6.629 0.437 1.00 . D A . 110 HEC HBD1 1 1 20 37501 4 2 1 HEC HBD2 H -10.085 -7.324 -0.088 1.00 . D A . 110 HEC HBD2 1 1 20 37502 4 2 1 HEC HHA H -10.250 -4.707 0.792 1.00 . D A . 110 HEC HHA 1 1 20 37503 4 2 1 HEC HHB H -6.424 0.130 -0.963 1.00 . D A . 110 HEC HHB 1 1 20 37504 4 2 1 HEC HHC H -1.508 -2.718 1.994 1.00 . D A . 110 HEC HHC 1 1 20 37505 4 2 1 HEC HHD H -5.182 -7.875 3.115 1.00 . D A . 110 HEC HHD 1 1 20 37506 4 2 1 HEC HMA1 H -10.088 0.252 -1.173 1.00 . D A . 110 HEC HMA1 1 1 20 37507 4 2 1 HEC HMA2 H -8.368 0.695 -1.290 1.00 . D A . 110 HEC HMA2 1 1 20 37508 4 2 1 HEC HMA3 H -9.119 -0.300 -2.561 1.00 . D A . 110 HEC HMA3 1 1 20 37509 4 2 1 HEC HMB1 H -2.945 1.066 -1.598 1.00 . D A . 110 HEC HMB1 1 1 20 37510 4 2 1 HEC HMB2 H -4.725 1.042 -1.622 1.00 . D A . 110 HEC HMB2 1 1 20 37511 4 2 1 HEC HMB3 H -3.863 1.835 -0.281 1.00 . D A . 110 HEC HMB3 1 1 20 37512 4 2 1 HEC HMC1 H -0.359 -5.379 3.827 1.00 . D A . 110 HEC HMC1 1 1 20 37513 4 2 1 HEC HMC2 H -0.083 -6.025 2.191 1.00 . D A . 110 HEC HMC2 1 1 20 37514 4 2 1 HEC HMC3 H -0.265 -4.271 2.437 1.00 . D A . 110 HEC HMC3 1 1 20 37515 4 2 1 HEC HMD1 H -6.879 -9.251 2.932 1.00 . D A . 110 HEC HMD1 1 1 20 37516 4 2 1 HEC HMD2 H -7.773 -8.557 4.306 1.00 . D A . 110 HEC HMD2 1 1 20 37517 4 2 1 HEC HMD3 H -8.659 -9.276 2.940 1.00 . D A . 110 HEC HMD3 1 1 20 37518 4 2 1 HEC NA N -7.402 -2.858 0.396 1.00 . D A . 110 HEC NA 1 1 20 37519 4 2 1 HEC NB N -4.649 -2.239 0.747 1.00 . D A . 110 HEC NB 1 1 20 37520 4 2 1 HEC NC N -4.234 -4.799 1.945 1.00 . D A . 110 HEC NC 1 1 20 37521 4 2 1 HEC ND N -7.001 -5.386 1.639 1.00 . D A . 110 HEC ND 1 1 20 37522 4 2 1 HEC O1A O -11.547 0.637 0.493 1.00 . D A . 110 HEC O1A 1 1 20 37523 4 2 1 HEC O1D O -10.765 -9.737 0.414 1.00 . D A . 110 HEC O1D 1 1 20 37524 4 2 1 HEC O2A O -10.184 -0.720 1.616 1.00 . D A . 110 HEC O2A 1 1 20 37525 4 2 1 HEC O2D O -12.775 -8.806 0.641 1.00 . D A . 110 HEC O2D 1 1 20 37526 5 2 1 HEC C1A C -0.050 4.200 -9.164 1.00 . E A . 111 HEC C1A 1 1 20 37527 5 2 1 HEC C1B C -1.261 0.765 -11.490 1.00 . E A . 111 HEC C1B 1 1 20 37528 5 2 1 HEC C1C C -3.106 -0.969 -7.938 1.00 . E A . 111 HEC C1C 1 1 20 37529 5 2 1 HEC C1D C -1.803 2.441 -5.627 1.00 . E A . 111 HEC C1D 1 1 20 37530 5 2 1 HEC C2A C 0.534 4.945 -10.254 1.00 . E A . 111 HEC C2A 1 1 20 37531 5 2 1 HEC C2B C -1.399 -0.382 -12.357 1.00 . E A . 111 HEC C2B 1 1 20 37532 5 2 1 HEC C2C C -3.870 -1.604 -6.890 1.00 . E A . 111 HEC C2C 1 1 20 37533 5 2 1 HEC C2D C -1.275 3.399 -4.683 1.00 . E A . 111 HEC C2D 1 1 20 37534 5 2 1 HEC C3A C 0.366 4.209 -11.373 1.00 . E A . 111 HEC C3A 1 1 20 37535 5 2 1 HEC C3B C -2.000 -1.353 -11.637 1.00 . E A . 111 HEC C3B 1 1 20 37536 5 2 1 HEC C3C C -3.762 -0.826 -5.792 1.00 . E A . 111 HEC C3C 1 1 20 37537 5 2 1 HEC C3D C -0.580 4.313 -5.392 1.00 . E A . 111 HEC C3D 1 1 20 37538 5 2 1 HEC C4A C -0.323 3.001 -10.987 1.00 . E A . 111 HEC C4A 1 1 20 37539 5 2 1 HEC C4B C -2.239 -0.818 -10.318 1.00 . E A . 111 HEC C4B 1 1 20 37540 5 2 1 HEC C4C C -2.930 0.299 -6.150 1.00 . E A . 111 HEC C4C 1 1 20 37541 5 2 1 HEC C4D C -0.670 3.931 -6.782 1.00 . E A . 111 HEC C4D 1 1 20 37542 5 2 1 HEC CAA C 1.195 6.286 -10.121 1.00 . E A . 111 HEC CAA 1 1 20 37543 5 2 1 HEC CAB C -2.367 -2.739 -12.081 1.00 . E A . 111 HEC CAB 1 1 20 37544 5 2 1 HEC CAC C -4.371 -1.047 -4.439 1.00 . E A . 111 HEC CAC 1 1 20 37545 5 2 1 HEC CAD C 0.161 5.513 -4.878 1.00 . E A . 111 HEC CAD 1 1 20 37546 5 2 1 HEC CBA C 2.607 6.343 -10.696 1.00 . E A . 111 HEC CBA 1 1 20 37547 5 2 1 HEC CBB C -1.288 -3.784 -11.814 1.00 . E A . 111 HEC CBB 1 1 20 37548 5 2 1 HEC CBC C -4.222 -2.473 -3.917 1.00 . E A . 111 HEC CBC 1 1 20 37549 5 2 1 HEC CBD C -0.712 6.753 -4.703 1.00 . E A . 111 HEC CBD 1 1 20 37550 5 2 1 HEC CGA C 2.827 7.626 -11.484 1.00 . E A . 111 HEC CGA 1 1 20 37551 5 2 1 HEC CGD C 0.120 7.952 -4.273 1.00 . E A . 111 HEC CGD 1 1 20 37552 5 2 1 HEC CHA C -0.073 4.635 -7.844 1.00 . E A . 111 HEC CHA 1 1 20 37553 5 2 1 HEC CHB C -0.684 1.970 -11.875 1.00 . E A . 111 HEC CHB 1 1 20 37554 5 2 1 HEC CHC C -2.852 -1.527 -9.268 1.00 . E A . 111 HEC CHC 1 1 20 37555 5 2 1 HEC CHD C -2.579 1.342 -5.274 1.00 . E A . 111 HEC CHD 1 1 20 37556 5 2 1 HEC CMA C 0.797 4.543 -12.772 1.00 . E A . 111 HEC CMA 1 1 20 37557 5 2 1 HEC CMB C -0.945 -0.438 -13.786 1.00 . E A . 111 HEC CMB 1 1 20 37558 5 2 1 HEC CMC C -4.627 -2.891 -7.039 1.00 . E A . 111 HEC CMC 1 1 20 37559 5 2 1 HEC CMD C -1.487 3.348 -3.198 1.00 . E A . 111 HEC CMD 1 1 20 37560 5 2 1 HEC FE FE -1.578 1.617 -8.563 1.00 . E A . 111 HEC FE 1 1 20 37561 5 2 1 HEC HAA1 H 0.604 7.037 -10.646 1.00 . E A . 111 HEC HAA1 1 1 20 37562 5 2 1 HEC HAA2 H 1.266 6.553 -9.066 1.00 . E A . 111 HEC HAA2 1 1 20 37563 5 2 1 HEC HAB H -3.266 -3.063 -11.556 1.00 . E A . 111 HEC HAB 1 1 20 37564 5 2 1 HEC HAC H -3.895 -0.387 -3.714 1.00 . E A . 111 HEC HAC 1 1 20 37565 5 2 1 HEC HAD1 H 0.592 5.284 -3.904 1.00 . E A . 111 HEC HAD1 1 1 20 37566 5 2 1 HEC HAD2 H 0.956 5.776 -5.576 1.00 . E A . 111 HEC HAD2 1 1 20 37567 5 2 1 HEC HBA1 H 3.333 6.304 -9.883 1.00 . E A . 111 HEC HBA1 1 1 20 37568 5 2 1 HEC HBA2 H 2.763 5.494 -11.362 1.00 . E A . 111 HEC HBA2 1 1 20 37569 5 2 1 HEC HBB1 H -1.011 -3.759 -10.760 1.00 . E A . 111 HEC HBB1 1 1 20 37570 5 2 1 HEC HBB2 H -1.669 -4.773 -12.066 1.00 . E A . 111 HEC HBB2 1 1 20 37571 5 2 1 HEC HBB3 H -0.412 -3.566 -12.425 1.00 . E A . 111 HEC HBB3 1 1 20 37572 5 2 1 HEC HBC1 H -3.344 -2.935 -4.367 1.00 . E A . 111 HEC HBC1 1 1 20 37573 5 2 1 HEC HBC2 H -4.106 -2.453 -2.833 1.00 . E A . 111 HEC HBC2 1 1 20 37574 5 2 1 HEC HBC3 H -5.110 -3.049 -4.176 1.00 . E A . 111 HEC HBC3 1 1 20 37575 5 2 1 HEC HBD1 H -1.201 6.989 -5.648 1.00 . E A . 111 HEC HBD1 1 1 20 37576 5 2 1 HEC HBD2 H -1.467 6.561 -3.941 1.00 . E A . 111 HEC HBD2 1 1 20 37577 5 2 1 HEC HHA H 0.403 5.587 -7.610 1.00 . E A . 111 HEC HHA 1 1 20 37578 5 2 1 HEC HHB H -0.498 2.133 -12.936 1.00 . E A . 111 HEC HHB 1 1 20 37579 5 2 1 HEC HHC H -3.203 -2.537 -9.481 1.00 . E A . 111 HEC HHC 1 1 20 37580 5 2 1 HEC HHD H -2.943 1.281 -4.248 1.00 . E A . 111 HEC HHD 1 1 20 37581 5 2 1 HEC HMA1 H 1.608 3.879 -13.071 1.00 . E A . 111 HEC HMA1 1 1 20 37582 5 2 1 HEC HMA2 H -0.045 4.416 -13.452 1.00 . E A . 111 HEC HMA2 1 1 20 37583 5 2 1 HEC HMA3 H 1.142 5.576 -12.809 1.00 . E A . 111 HEC HMA3 1 1 20 37584 5 2 1 HEC HMB1 H -1.814 -0.450 -14.444 1.00 . E A . 111 HEC HMB1 1 1 20 37585 5 2 1 HEC HMB2 H -0.334 0.438 -14.008 1.00 . E A . 111 HEC HMB2 1 1 20 37586 5 2 1 HEC HMB3 H -0.356 -1.341 -13.945 1.00 . E A . 111 HEC HMB3 1 1 20 37587 5 2 1 HEC HMC1 H -4.488 -3.280 -8.047 1.00 . E A . 111 HEC HMC1 1 1 20 37588 5 2 1 HEC HMC2 H -4.256 -3.617 -6.315 1.00 . E A . 111 HEC HMC2 1 1 20 37589 5 2 1 HEC HMC3 H -5.688 -2.711 -6.862 1.00 . E A . 111 HEC HMC3 1 1 20 37590 5 2 1 HEC HMD1 H -0.562 3.621 -2.690 1.00 . E A . 111 HEC HMD1 1 1 20 37591 5 2 1 HEC HMD2 H -2.275 4.047 -2.919 1.00 . E A . 111 HEC HMD2 1 1 20 37592 5 2 1 HEC HMD3 H -1.777 2.338 -2.907 1.00 . E A . 111 HEC HMD3 1 1 20 37593 5 2 1 HEC NA N -0.574 3.005 -9.626 1.00 . E A . 111 HEC NA 1 1 20 37594 5 2 1 HEC NB N -1.781 0.485 -10.238 1.00 . E A . 111 HEC NB 1 1 20 37595 5 2 1 HEC NC N -2.532 0.201 -7.472 1.00 . E A . 111 HEC NC 1 1 20 37596 5 2 1 HEC ND N -1.424 2.778 -6.915 1.00 . E A . 111 HEC ND 1 1 20 37597 5 2 1 HEC O1A O 3.962 8.146 -11.416 1.00 . E A . 111 HEC O1A 1 1 20 37598 5 2 1 HEC O1D O 0.888 8.447 -5.127 1.00 . E A . 111 HEC O1D 1 1 20 37599 5 2 1 HEC O2A O 1.857 8.062 -12.140 1.00 . E A . 111 HEC O2A 1 1 20 37600 5 2 1 HEC O2D O -0.026 8.352 -3.098 1.00 . E A . 111 HEC O2D 1 1 stop_ save_
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