NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
508537 | 2ep3 | 11170 | cing | 4-filtered-FRED | STAR | entry | full | 537 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2ep3 # This FRED archive file contains, for PDB entry <2ep3>: # # - Coordinates and sequence information from the PDB mmCIF file # - NMR restraints from the PDB MR file # # In this file, the coordinates and NMR restraints share the same atom names, # and in this way can differ from the data deposited at the wwPDB. To achieve # this aim, the NMR restraints were parsed from their original format files, and # the coordinates and NMR restraints information were subsequently harmonized. # # Due to the complexity of this harmonization process and the filtering process # used in creating these files, the NMR restraints information in these files # may differ significantly from that in the originally deposited file. Other # modifications could have occurred to the NMR restraints information, or data # could have been lost because of parsing or conversion errors. The PDB file # remains the authoritative reference for the atomic coordinates and the # originally deposited restraints files remain the primary reference for these # data. # # This file is generated at the BioMagResBank (BMRB) in collaboration with the # PDBe (formerly MSD) group at the European Bioinformatics Institute (EBI) and # the CMBI/IMM group at the Radboud University of Nijmegen. # # Several software packages were used to produce this file: # # - Wattos (BMRB and CMBI/IMM). # - FormatConverter and NMRStarExport (PDBe). # - CCPN framework (http://www.ccpn.ac.uk/). # # More information about this process can be found in the references below. # Please cite the original reference for this PDB entry. # # JF Doreleijers, A Nederveen, W Vranken, J Lin, AM Bonvin, R Kaptein, JL # Markley, and EL Ulrich (2005). BioMagResBank databases DOCR and FRED # containing converted and filtered sets of experimental NMR restraints and # coordinates from over 500 protein PDB structures. J. Biomol. NMR 32, 1-12. # # WF Vranken, W Boucher, TJ Stevens, RH Fogh, A Pajon, M Llinas, EL Ulrich, JL # Markley, J Ionides, ED Laue (2005). The CCPN data model for NMR spectroscopy: # development of a software pipeline. Proteins 59, 687-696. # # JF Doreleijers, WF Vranken, C Schulte, J Lin, JR Wedell, CJ Penkett, GW Vuister, # G Vriend, JL Markley, and EL Ulrich (2009). The NMR Restraints Grid at BMRB for # 5,266 Protein and Nucleic Acid PDB Entries. J Biomol. NMR 45, 389?396. save_Conversion_project_for_entry_Name_1 _Study_list.Sf_category study_list _Study_list.Entry_ID 1 _Study_list.ID 1 loop_ _Study.ID _Study.Name _Study.Type _Study.Details _Study.Entry_ID _Study.Study_list_ID 1 "Conversion project for entry 1" NMR . 1 1 stop_ save_ save_originalConstraints_1 _Entry.PDB_coordinate_file_version . _Entry.Sf_category entry_information _Entry.ID 1 _Entry.Title "Data for entry 1" _Entry.NMR_STAR_version 3.1.0.8 _Entry.Experimental_method NMR _Entry.Details . save_ save_assembly_2ep3 _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2ep3 _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all other bound" _Assembly.Molecular_mass 4790.48 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 $Zinc_finger_protein_484 A . 1 1 2 . 2 $ZINC_ION B . 1 1 stop_ loop_ _PDBX_nonpoly_scheme.Entity_assembly_ID _PDBX_nonpoly_scheme.Entity_ID _PDBX_nonpoly_scheme.Mon_ID _PDBX_nonpoly_scheme.Comp_index_ID _PDBX_nonpoly_scheme.Comp_ID _PDBX_nonpoly_scheme.Entry_ID _PDBX_nonpoly_scheme.Assembly_ID 2 2 ZN 1 ZN 1 1 stop_ save_ save_Zinc_finger_protein_484 _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Zinc finger protein 484" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GSSGSSGTGEKPYRCAECGKAFTDRSNLFTHQKIHTGEKPSGPSSG _Entity.Number_of_monomers 46 loop_ _Entity_comp_index.ID _Entity_comp_index.Comp_ID _Entity_comp_index.Comp_label _Entity_comp_index.Entry_ID _Entity_comp_index.Entity_ID 1 GLY . 1 1 2 SER . 1 1 3 SER . 1 1 4 GLY . 1 1 5 SER . 1 1 6 SER . 1 1 7 GLY . 1 1 8 THR . 1 1 9 GLY . 1 1 10 GLU . 1 1 11 LYS . 1 1 12 PRO . 1 1 13 TYR . 1 1 14 ARG . 1 1 15 CYS . 1 1 16 ALA . 1 1 17 GLU . 1 1 18 CYS . 1 1 19 GLY . 1 1 20 LYS . 1 1 21 ALA . 1 1 22 PHE . 1 1 23 THR . 1 1 24 ASP . 1 1 25 ARG . 1 1 26 SER . 1 1 27 ASN . 1 1 28 LEU . 1 1 29 PHE . 1 1 30 THR . 1 1 31 HIS . 1 1 32 GLN . 1 1 33 LYS . 1 1 34 ILE . 1 1 35 HIS . 1 1 36 THR . 1 1 37 GLY . 1 1 38 GLU . 1 1 39 LYS . 1 1 40 PRO . 1 1 41 SER . 1 1 42 GLY . 1 1 43 PRO . 1 1 44 SER . 1 1 45 SER . 1 1 46 GLY . 1 1 stop_ loop_ _Entity_poly_seq.Mon_ID _Entity_poly_seq.Num _Entity_poly_seq.Comp_index_ID _Entity_poly_seq.Entry_ID _Entity_poly_seq.Entity_ID GLY 1 1 1 1 SER 2 2 1 1 SER 3 3 1 1 GLY 4 4 1 1 SER 5 5 1 1 SER 6 6 1 1 GLY 7 7 1 1 THR 8 8 1 1 GLY 9 9 1 1 GLU 10 10 1 1 LYS 11 11 1 1 PRO 12 12 1 1 TYR 13 13 1 1 ARG 14 14 1 1 CYS 15 15 1 1 ALA 16 16 1 1 GLU 17 17 1 1 CYS 18 18 1 1 GLY 19 19 1 1 LYS 20 20 1 1 ALA 21 21 1 1 PHE 22 22 1 1 THR 23 23 1 1 ASP 24 24 1 1 ARG 25 25 1 1 SER 26 26 1 1 ASN 27 27 1 1 LEU 28 28 1 1 PHE 29 29 1 1 THR 30 30 1 1 HIS 31 31 1 1 GLN 32 32 1 1 LYS 33 33 1 1 ILE 34 34 1 1 HIS 35 35 1 1 THR 36 36 1 1 GLY 37 37 1 1 GLU 38 38 1 1 LYS 39 39 1 1 PRO 40 40 1 1 SER 41 41 1 1 GLY 42 42 1 1 PRO 43 43 1 1 SER 44 44 1 1 SER 45 45 1 1 GLY 46 46 1 1 stop_ save_ save_ZINC_ION _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 2 _Entity.Name "ZINC ION" _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 ZN $ZN 1 2 stop_ save_ save_ZN _Chem_comp.Sf_category chem_comp _Chem_comp.Entry_ID 1 _Chem_comp.ID ZN _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 "general distance" _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 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 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 15 CYS SG . 15 CYSS SG 1 1 1 1 2 2 2 1 ZN ZN . 201 ZN ZN 1 1 2 1 1 1 1 15 CYS CB . 15 CYSS CB 1 1 2 1 2 2 2 1 ZN ZN . 201 ZN ZN 1 1 3 1 1 1 1 18 CYS SG . 18 CYSS SG 1 1 3 1 2 2 2 1 ZN ZN . 201 ZN ZN 1 1 4 1 1 1 1 18 CYS CB . 18 CYSS CB 1 1 4 1 2 2 2 1 ZN ZN . 201 ZN ZN 1 1 5 1 1 1 1 31 HIS NE2 . 31 HIS NE2 1 1 5 1 2 2 2 1 ZN ZN . 201 ZN ZN 1 1 6 1 1 1 1 35 HIS NE2 . 35 HIS NE2 1 1 6 1 2 2 2 1 ZN ZN . 201 ZN ZN 1 1 7 1 1 1 1 15 CYS SG . 15 CYSS SG 1 1 7 1 2 1 1 18 CYS SG . 18 CYSS SG 1 1 8 1 1 1 1 15 CYS SG . 15 CYSS SG 1 1 8 1 2 1 1 31 HIS NE2 . 31 HIS NE2 1 1 9 1 1 1 1 15 CYS SG . 15 CYSS SG 1 1 9 1 2 1 1 35 HIS NE2 . 35 HIS NE2 1 1 10 1 1 1 1 18 CYS SG . 18 CYSS SG 1 1 10 1 2 1 1 31 HIS NE2 . 31 HIS NE2 1 1 11 1 1 1 1 18 CYS SG . 18 CYSS SG 1 1 11 1 2 1 1 35 HIS NE2 . 35 HIS NE2 1 1 12 1 1 1 1 31 HIS NE2 . 31 HIS NE2 1 1 12 1 2 1 1 35 HIS NE2 . 35 HIS NE2 1 1 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . 2.19 2.39 1 1 2 1 . . . . . . 3.25 3.51 1 1 3 1 . . . . . . 2.19 2.39 1 1 4 1 . . . . . . 3.25 3.51 1 1 5 1 . . . . . . 1.9 2.1 1 1 6 1 . . . . . . 1.9 2.1 1 1 7 1 . . . . . . 3.56 3.96 1 1 8 1 . . . . . . 3.32 3.72 1 1 9 1 . . . . . . 3.32 3.72 1 1 10 1 . . . . . . 3.32 3.72 1 1 11 1 . . . . . . 3.32 3.72 1 1 12 1 . . . . . . 3.0 3.6 1 1 stop_ save_ save_DYANA/DIANA_distance_constraints_5_1 _Distance_constraint_list.Sf_category distance_constraints _Distance_constraint_list.Entry_ID 1 _Distance_constraint_list.ID 2 _Distance_constraint_list.Constraint_type NOE _Distance_constraint_list.Constraint_file_ID . _Distance_constraint_list.Block_ID . loop_ _Dist_constraint_tree.Constraint_ID _Dist_constraint_tree.Node_ID _Dist_constraint_tree.Down_node_ID _Dist_constraint_tree.Right_node_ID _Dist_constraint_tree.Logic_operation _Dist_constraint_tree.Entry_ID _Dist_constraint_tree.Distance_constraint_list_ID 1 1 . . . 1 2 2 1 . . . 1 2 3 1 . . . 1 2 4 1 . . . 1 2 5 1 . . . 1 2 6 1 . . . 1 2 7 1 . . . 1 2 8 1 . . . 1 2 9 1 . . . 1 2 10 1 . . . 1 2 11 1 . . . 1 2 12 1 . . . 1 2 13 1 . . . 1 2 14 1 . . . 1 2 15 1 . . . 1 2 16 1 . . . 1 2 17 1 . . . 1 2 18 1 . . . 1 2 19 1 . . . 1 2 20 1 . . . 1 2 21 1 . . . 1 2 22 1 . . . 1 2 23 1 . . . 1 2 24 1 . . . 1 2 25 1 . . . 1 2 26 1 . . . 1 2 27 1 . . . 1 2 28 1 . . . 1 2 29 1 . . . 1 2 30 1 . . . 1 2 31 1 . . . 1 2 32 1 . . . 1 2 33 1 . . . 1 2 34 1 . . . 1 2 35 1 . . . 1 2 36 1 . . . 1 2 37 1 . . . 1 2 38 1 . . . 1 2 39 1 . . . 1 2 40 1 . . . 1 2 41 1 . . . 1 2 42 1 . . . 1 2 43 1 . . . 1 2 44 1 . . . 1 2 45 1 . . . 1 2 46 1 . . . 1 2 47 1 . . . 1 2 48 1 . . . 1 2 49 1 . . . 1 2 50 1 . . . 1 2 51 1 . . . 1 2 52 1 . . . 1 2 53 1 . . . 1 2 54 1 . . . 1 2 55 1 . . . 1 2 56 1 . . . 1 2 57 1 . . . 1 2 58 1 . . . 1 2 59 1 . . . 1 2 60 1 . . . 1 2 61 1 . . . 1 2 62 1 . . . 1 2 63 1 . . . 1 2 64 1 . . . 1 2 65 1 . . . 1 2 66 1 . . . 1 2 67 1 . . . 1 2 68 1 . . . 1 2 69 1 . . . 1 2 70 1 . . . 1 2 71 1 . . . 1 2 72 1 . . . 1 2 73 1 . . . 1 2 74 1 . . . 1 2 75 1 . . . 1 2 76 1 . . . 1 2 77 1 . . . 1 2 78 1 . . . 1 2 79 1 . . . 1 2 80 1 . . . 1 2 81 1 . . . 1 2 82 1 . . . 1 2 83 1 . . . 1 2 84 1 . . . 1 2 85 1 . . . 1 2 86 1 . . . 1 2 87 1 . . . 1 2 88 1 . . . 1 2 89 1 . . . 1 2 90 1 . . . 1 2 91 1 . . . 1 2 92 1 . . . 1 2 93 1 . . . 1 2 94 1 . . . 1 2 95 1 . . . 1 2 96 1 . . . 1 2 97 1 . . . 1 2 98 1 . . . 1 2 99 1 . . . 1 2 100 1 . . . 1 2 101 1 . . . 1 2 102 1 . . . 1 2 103 1 . . . 1 2 104 1 . . . 1 2 105 1 . . . 1 2 106 1 . . . 1 2 107 1 . . . 1 2 108 1 . . . 1 2 109 1 . . . 1 2 110 1 . . . 1 2 111 1 . . . 1 2 112 1 . . . 1 2 113 1 . . . 1 2 114 1 . . . 1 2 115 1 . . . 1 2 116 1 . . . 1 2 117 1 . . . 1 2 118 1 . . . 1 2 119 1 . . . 1 2 120 1 . . . 1 2 121 1 . . . 1 2 122 1 . . . 1 2 123 1 . . . 1 2 124 1 . . . 1 2 125 1 . . . 1 2 126 1 . . . 1 2 127 1 . . . 1 2 128 1 . . . 1 2 129 1 . . . 1 2 130 1 . . . 1 2 131 1 . . . 1 2 132 1 . . . 1 2 133 1 . . . 1 2 134 1 . . . 1 2 135 1 . . . 1 2 136 1 . . . 1 2 137 1 . . . 1 2 138 1 . . . 1 2 139 1 . . . 1 2 140 1 . . . 1 2 141 1 . . . 1 2 142 1 . . . 1 2 143 1 . . . 1 2 144 1 . . . 1 2 145 1 . . . 1 2 146 1 . . . 1 2 147 1 . . . 1 2 148 1 . . . 1 2 149 1 . . . 1 2 150 1 . . . 1 2 151 1 . . . 1 2 152 1 . . . 1 2 153 1 . . . 1 2 154 1 . . . 1 2 155 1 . . . 1 2 156 1 . . . 1 2 157 1 . . . 1 2 158 1 . . . 1 2 159 1 . . . 1 2 160 1 . . . 1 2 161 1 . . . 1 2 162 1 . . . 1 2 163 1 . . . 1 2 164 1 . . . 1 2 165 1 . . . 1 2 166 1 . . . 1 2 167 1 . . . 1 2 168 1 . . . 1 2 169 1 . . . 1 2 170 1 . . . 1 2 171 1 . . . 1 2 172 1 . . . 1 2 173 1 . . . 1 2 174 1 . . . 1 2 175 1 . . . 1 2 176 1 . . . 1 2 177 1 . . . 1 2 178 1 . . . 1 2 179 1 . . . 1 2 180 1 . . . 1 2 181 1 . . . 1 2 182 1 . . . 1 2 183 1 . . . 1 2 184 1 . . . 1 2 185 1 . . . 1 2 186 1 . . . 1 2 187 1 . . . 1 2 188 1 . . . 1 2 189 1 . . . 1 2 190 1 . . . 1 2 191 1 . . . 1 2 192 1 . . . 1 2 193 1 . . . 1 2 194 1 . . . 1 2 195 1 . . . 1 2 196 1 . . . 1 2 197 1 . . . 1 2 198 1 . . . 1 2 199 1 . . . 1 2 200 1 . . . 1 2 201 1 . . . 1 2 202 1 . . . 1 2 203 1 . . . 1 2 204 1 . . . 1 2 205 1 . . . 1 2 206 1 . . . 1 2 207 1 . . . 1 2 208 1 . . . 1 2 209 1 . . . 1 2 210 1 . . . 1 2 211 1 . . . 1 2 212 1 . . . 1 2 213 1 . . . 1 2 214 1 . . . 1 2 215 1 . . . 1 2 216 1 . . . 1 2 217 1 . . . 1 2 218 1 . . . 1 2 219 1 . . . 1 2 220 1 . . . 1 2 221 1 . . . 1 2 222 1 . . . 1 2 223 1 . . . 1 2 224 1 . . . 1 2 225 1 . . . 1 2 226 1 . . . 1 2 227 1 . . . 1 2 228 1 . . . 1 2 229 1 . . . 1 2 230 1 . . . 1 2 231 1 . . . 1 2 232 1 . . . 1 2 233 1 . . . 1 2 234 1 . . . 1 2 235 1 . . . 1 2 236 1 . . . 1 2 237 1 . . . 1 2 238 1 . . . 1 2 239 1 . . . 1 2 240 1 . . . 1 2 241 1 . . . 1 2 242 1 . . . 1 2 243 1 . . . 1 2 244 1 . . . 1 2 245 1 . . . 1 2 246 1 . . . 1 2 247 1 . . . 1 2 248 1 . . . 1 2 249 1 . . . 1 2 250 1 . . . 1 2 251 1 . . . 1 2 252 1 . . . 1 2 253 1 . . . 1 2 254 1 . . . 1 2 255 1 . . . 1 2 256 1 . . . 1 2 257 1 . . . 1 2 258 1 . . . 1 2 259 1 . . . 1 2 260 1 . . . 1 2 261 1 . . . 1 2 262 1 . . . 1 2 263 1 . . . 1 2 264 1 . . . 1 2 265 1 . . . 1 2 266 1 . . . 1 2 267 1 . . . 1 2 268 1 . . . 1 2 269 1 . . . 1 2 270 1 . . . 1 2 271 1 . . . 1 2 272 1 . . . 1 2 273 1 . . . 1 2 274 1 . . . 1 2 275 1 . . . 1 2 276 1 . . . 1 2 277 1 . . . 1 2 278 1 . . . 1 2 279 1 . . . 1 2 280 1 . . . 1 2 281 1 . . . 1 2 282 1 . . . 1 2 283 1 . . . 1 2 284 1 . . . 1 2 285 1 . . . 1 2 286 1 . . . 1 2 287 1 . . . 1 2 288 1 . . . 1 2 289 1 . . . 1 2 290 1 . . . 1 2 291 1 . . . 1 2 292 1 . . . 1 2 293 1 . . . 1 2 294 1 . . . 1 2 295 1 . . . 1 2 296 1 . . . 1 2 297 1 . . . 1 2 298 1 . . . 1 2 299 1 . . . 1 2 300 1 . . . 1 2 301 1 . . . 1 2 302 1 . . . 1 2 303 1 . . . 1 2 304 1 . . . 1 2 305 1 . . . 1 2 306 1 . . . 1 2 307 1 . . . 1 2 308 1 . . . 1 2 309 1 . . . 1 2 310 1 . . . 1 2 311 1 . . . 1 2 312 1 . . . 1 2 313 1 . . . 1 2 314 1 . . . 1 2 315 1 . . . 1 2 316 1 . . . 1 2 317 1 . . . 1 2 318 1 . . . 1 2 319 1 . . . 1 2 320 1 . . . 1 2 321 1 . . . 1 2 322 1 . . . 1 2 323 1 . . . 1 2 324 1 . . . 1 2 325 1 . . . 1 2 326 1 . . . 1 2 327 1 . . . 1 2 328 1 . . . 1 2 329 1 . . . 1 2 330 1 . . . 1 2 331 1 . . . 1 2 332 1 . . . 1 2 333 1 . . . 1 2 334 1 . . . 1 2 335 1 . . . 1 2 336 1 . . . 1 2 337 1 . . . 1 2 338 1 . . . 1 2 339 1 . . . 1 2 340 1 . . . 1 2 341 1 . . . 1 2 342 1 . . . 1 2 343 1 . . . 1 2 344 1 . . . 1 2 345 1 . . . 1 2 346 1 . . . 1 2 347 1 . . . 1 2 348 1 . . . 1 2 349 1 . . . 1 2 350 1 . . . 1 2 351 1 . . . 1 2 352 1 . . . 1 2 353 1 . . . 1 2 354 1 . . . 1 2 355 1 . . . 1 2 356 1 . . . 1 2 357 1 . . . 1 2 358 1 . . . 1 2 359 1 . . . 1 2 360 1 . . . 1 2 361 1 . . . 1 2 362 1 . . . 1 2 363 1 . . . 1 2 364 1 . . . 1 2 365 1 . . . 1 2 366 1 . . . 1 2 367 1 . . . 1 2 368 1 . . . 1 2 369 1 . . . 1 2 370 1 . . . 1 2 371 1 . . . 1 2 372 1 . . . 1 2 373 1 . . . 1 2 374 1 . . . 1 2 375 1 . . . 1 2 376 1 . . . 1 2 377 1 . . . 1 2 378 1 . . . 1 2 379 1 . . . 1 2 380 1 . . . 1 2 381 1 . . . 1 2 382 1 . . . 1 2 383 1 . . . 1 2 384 1 . . . 1 2 385 1 . . . 1 2 386 1 . . . 1 2 387 1 . . . 1 2 388 1 . . . 1 2 389 1 . . . 1 2 390 1 . . . 1 2 391 1 . . . 1 2 392 1 . . . 1 2 393 1 . . . 1 2 394 1 . . . 1 2 395 1 . . . 1 2 396 1 . . . 1 2 397 1 . . . 1 2 398 1 . . . 1 2 399 1 . . . 1 2 400 1 . . . 1 2 401 1 . . . 1 2 402 1 . . . 1 2 403 1 . . . 1 2 404 1 . . . 1 2 405 1 . . . 1 2 406 1 . . . 1 2 407 1 . . . 1 2 408 1 . . . 1 2 409 1 . . . 1 2 410 1 . . . 1 2 411 1 . . . 1 2 412 1 . . . 1 2 413 1 . . . 1 2 414 1 . . . 1 2 415 1 . . . 1 2 416 1 . . . 1 2 417 1 . . . 1 2 418 1 . . . 1 2 419 1 . . . 1 2 420 1 . . . 1 2 421 1 . . . 1 2 422 1 . . . 1 2 423 1 . . . 1 2 424 1 . . . 1 2 425 1 . . . 1 2 426 1 . . . 1 2 427 1 . . . 1 2 428 1 . . . 1 2 429 1 . . . 1 2 430 1 . . . 1 2 431 1 . . . 1 2 432 1 . . . 1 2 433 1 . . . 1 2 434 1 . . . 1 2 435 1 . . . 1 2 436 1 . . . 1 2 437 1 . . . 1 2 438 1 . . . 1 2 439 1 . . . 1 2 440 1 . . . 1 2 441 1 . . . 1 2 442 1 . . . 1 2 443 1 . . . 1 2 444 1 . . . 1 2 445 1 . . . 1 2 446 1 . . . 1 2 447 1 . . . 1 2 448 1 . . . 1 2 449 1 . . . 1 2 450 1 . . . 1 2 451 1 . . . 1 2 452 1 . . . 1 2 453 1 . . . 1 2 454 1 . . . 1 2 455 1 . . . 1 2 456 1 . . . 1 2 457 1 . . . 1 2 458 1 . . . 1 2 459 1 . . . 1 2 460 1 . . . 1 2 461 1 . . . 1 2 462 1 . . . 1 2 463 1 . . . 1 2 464 1 . . . 1 2 465 1 . . . 1 2 466 1 . . . 1 2 467 1 . . . 1 2 468 1 . . . 1 2 469 1 . . . 1 2 470 1 . . . 1 2 471 1 . . . 1 2 472 1 . . . 1 2 473 1 . . . 1 2 474 1 . . . 1 2 475 1 . . . 1 2 476 1 . . . 1 2 477 1 . . . 1 2 478 1 . . . 1 2 479 1 . . . 1 2 480 1 . . . 1 2 481 1 . . . 1 2 482 1 . . . 1 2 483 1 . . . 1 2 484 1 . . . 1 2 485 1 . . . 1 2 486 1 . . . 1 2 487 1 . . . 1 2 488 1 . . . 1 2 489 1 . . . 1 2 490 1 . . . 1 2 491 1 . . . 1 2 492 1 . . . 1 2 493 1 . . . 1 2 494 1 . . . 1 2 495 1 . . . 1 2 496 1 . . . 1 2 497 1 . . . 1 2 498 1 . . . 1 2 499 1 . . . 1 2 500 1 . . . 1 2 501 1 . . . 1 2 502 1 . . . 1 2 503 1 . . . 1 2 504 1 . . . 1 2 505 1 . . . 1 2 506 1 . . . 1 2 507 1 . . . 1 2 508 1 . . . 1 2 509 1 . . . 1 2 510 1 . . . 1 2 511 1 . . . 1 2 512 1 . . . 1 2 513 1 . . . 1 2 514 1 . . . 1 2 515 1 . . . 1 2 516 1 . . . 1 2 517 1 . . . 1 2 518 1 . . . 1 2 519 1 . . . 1 2 520 1 . . . 1 2 521 1 . . . 1 2 522 1 . . . 1 2 523 1 . . . 1 2 524 1 . . . 1 2 stop_ loop_ _Dist_constraint.Tree_node_member_constraint_ID _Dist_constraint.Tree_node_member_node_ID _Dist_constraint.Constraint_tree_node_member_ID _Dist_constraint.Entity_assembly_ID _Dist_constraint.Entity_ID _Dist_constraint.Comp_index_ID _Dist_constraint.Comp_ID _Dist_constraint.Atom_ID _Dist_constraint.Auth_asym_ID _Dist_constraint.Auth_seq_ID _Dist_constraint.Auth_comp_ID _Dist_constraint.Auth_atom_ID _Dist_constraint.Entry_ID _Dist_constraint.Distance_constraint_list_ID 1 1 1 1 1 9 GLY H . 9 GLY HN 1 2 1 1 2 1 1 10 GLU HA . 10 GLU HA 1 2 2 1 1 1 1 38 GLU H . 38 GLU HN 1 2 2 1 2 1 1 39 LYS H . 39 LYS HN 1 2 3 1 1 1 1 10 GLU H . 10 GLU HN 1 2 3 1 2 1 1 11 LYS HA . 11 LYS HA 1 2 4 1 1 1 1 36 THR HB . 36 THR HB 1 2 4 1 2 1 1 37 GLY H . 37 GLY HN 1 2 5 1 1 1 1 38 GLU H . 38 GLU HN 1 2 5 1 2 1 1 38 GLU HG2 . 38 GLU HG2 1 2 6 1 1 1 1 38 GLU H . 38 GLU HN 1 2 6 1 2 1 1 38 GLU HG3 . 38 GLU HG3 1 2 7 1 1 1 1 10 GLU H . 10 GLU HN 1 2 7 1 2 1 1 10 GLU HG2 . 10 GLU HG2 1 2 8 1 1 1 1 10 GLU H . 10 GLU HN 1 2 8 1 2 1 1 10 GLU HG3 . 10 GLU HG3 1 2 9 1 1 1 1 26 SER H . 26 SER HN 1 2 9 1 2 1 1 27 ASN H . 27 ASN HN 1 2 10 1 1 1 1 27 ASN H . 27 ASN HN 1 2 10 1 2 1 1 27 ASN HD22 . 27 ASN HD22 1 2 11 1 1 1 1 26 SER QB . 26 SER QB 1 2 11 1 2 1 1 27 ASN H . 27 ASN HN 1 2 12 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 12 1 2 1 1 27 ASN H . 27 ASN HN 1 2 13 1 1 1 1 27 ASN H . 27 ASN HN 1 2 13 1 2 1 1 28 LEU HA . 28 LEU HA 1 2 14 1 1 1 1 25 ARG HA . 25 ARG HA 1 2 14 1 2 1 1 27 ASN H . 27 ASN HN 1 2 15 1 1 1 1 27 ASN H . 27 ASN HN 1 2 15 1 2 1 1 27 ASN HB2 . 27 ASN HB2 1 2 16 1 1 1 1 27 ASN H . 27 ASN HN 1 2 16 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 2 17 1 1 1 1 24 ASP H . 24 ASP HN 1 2 17 1 2 1 1 27 ASN H . 27 ASN HN 1 2 18 1 1 1 1 27 ASN H . 27 ASN HN 1 2 18 1 2 1 1 27 ASN HD21 . 27 ASN HD21 1 2 19 1 1 1 1 27 ASN H . 27 ASN HN 1 2 19 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 20 1 1 1 1 29 PHE H . 29 PHE HN 1 2 20 1 2 1 1 31 HIS H . 31 HIS HN 1 2 21 1 1 1 1 29 PHE H . 29 PHE HN 1 2 21 1 2 1 1 29 PHE QD . 29 PHE QD 1 2 22 1 1 1 1 26 SER HA . 26 SER HA 1 2 22 1 2 1 1 29 PHE H . 29 PHE HN 1 2 23 1 1 1 1 29 PHE H . 29 PHE HN 1 2 23 1 2 1 1 29 PHE QB . 29 PHE QB 1 2 24 1 1 1 1 25 ARG HA . 25 ARG HA 1 2 24 1 2 1 1 29 PHE H . 29 PHE HN 1 2 25 1 1 1 1 28 LEU HB3 . 28 LEU HB3 1 2 25 1 2 1 1 29 PHE H . 29 PHE HN 1 2 26 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 26 1 2 1 1 29 PHE H . 29 PHE HN 1 2 27 1 1 1 1 28 LEU HB2 . 28 LEU HB2 1 2 27 1 2 1 1 29 PHE H . 29 PHE HN 1 2 28 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 28 1 2 1 1 29 PHE H . 29 PHE HN 1 2 29 1 1 1 1 28 LEU MD2 . 28 LEU QD2 1 2 29 1 2 1 1 29 PHE H . 29 PHE HN 1 2 30 1 1 1 1 16 ALA H . 16 ALA HN 1 2 30 1 2 1 1 17 GLU H . 17 GLU HN 1 2 31 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 31 1 2 1 1 17 GLU H . 17 GLU HN 1 2 32 1 1 1 1 17 GLU H . 17 GLU HN 1 2 32 1 2 1 1 17 GLU HG2 . 17 GLU HG2 1 2 33 1 1 1 1 17 GLU H . 17 GLU HN 1 2 33 1 2 1 1 17 GLU HG3 . 17 GLU HG3 1 2 34 1 1 1 1 17 GLU H . 17 GLU HN 1 2 34 1 2 1 1 17 GLU HB2 . 17 GLU HB2 1 2 35 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 35 1 2 1 1 24 ASP H . 24 ASP HN 1 2 36 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 36 1 2 1 1 24 ASP H . 24 ASP HN 1 2 37 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 37 1 2 1 1 17 GLU H . 17 GLU HN 1 2 38 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 38 1 2 1 1 17 GLU H . 17 GLU HN 1 2 39 1 1 1 1 16 ALA MB . 16 ALA QB 1 2 39 1 2 1 1 17 GLU H . 17 GLU HN 1 2 40 1 1 1 1 23 THR MG . 23 THR QG2 1 2 40 1 2 1 1 24 ASP H . 24 ASP HN 1 2 41 1 1 1 1 23 THR H . 23 THR HN 1 2 41 1 2 1 1 24 ASP H . 24 ASP HN 1 2 42 1 1 1 1 23 THR HB . 23 THR HB 1 2 42 1 2 1 1 24 ASP H . 24 ASP HN 1 2 43 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 43 1 2 1 1 24 ASP H . 24 ASP HN 1 2 44 1 1 1 1 24 ASP H . 24 ASP HN 1 2 44 1 2 1 1 27 ASN HB2 . 27 ASN HB2 1 2 45 1 1 1 1 13 TYR H . 13 TYR HN 1 2 45 1 2 1 1 22 PHE H . 22 PHE HN 1 2 46 1 1 1 1 13 TYR H . 13 TYR HN 1 2 46 1 2 1 1 13 TYR QD . 13 TYR QD 1 2 47 1 1 1 1 13 TYR H . 13 TYR HN 1 2 47 1 2 1 1 21 ALA HA . 21 ALA HA 1 2 48 1 1 1 1 11 LYS HA . 11 LYS HA 1 2 48 1 2 1 1 13 TYR H . 13 TYR HN 1 2 49 1 1 1 1 12 PRO QD . 12 PRO QD 1 2 49 1 2 1 1 13 TYR H . 13 TYR HN 1 2 50 1 1 1 1 13 TYR H . 13 TYR HN 1 2 50 1 2 1 1 22 PHE HB3 . 22 PHE HB3 1 2 51 1 1 1 1 13 TYR H . 13 TYR HN 1 2 51 1 2 1 1 13 TYR HB3 . 13 TYR HB3 1 2 52 1 1 1 1 13 TYR H . 13 TYR HN 1 2 52 1 2 1 1 13 TYR HB2 . 13 TYR HB2 1 2 53 1 1 1 1 13 TYR H . 13 TYR HN 1 2 53 1 2 1 1 22 PHE HB2 . 22 PHE HB2 1 2 54 1 1 1 1 12 PRO HB3 . 12 PRO HB3 1 2 54 1 2 1 1 13 TYR H . 13 TYR HN 1 2 55 1 1 1 1 12 PRO HG2 . 12 PRO HG2 1 2 55 1 2 1 1 13 TYR H . 13 TYR HN 1 2 56 1 1 1 1 11 LYS HB2 . 11 LYS HB2 1 2 56 1 2 1 1 13 TYR H . 13 TYR HN 1 2 57 1 1 1 1 11 LYS HB3 . 11 LYS HB3 1 2 57 1 2 1 1 13 TYR H . 13 TYR HN 1 2 58 1 1 1 1 12 PRO HB2 . 12 PRO HB2 1 2 58 1 2 1 1 13 TYR H . 13 TYR HN 1 2 59 1 1 1 1 13 TYR H . 13 TYR HN 1 2 59 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 60 1 1 1 1 35 HIS H . 35 HIS HN 1 2 60 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 61 1 1 1 1 34 ILE H . 34 ILE HN 1 2 61 1 2 1 1 35 HIS H . 35 HIS HN 1 2 62 1 1 1 1 35 HIS H . 35 HIS HN 1 2 62 1 2 1 1 36 THR HA . 36 THR HA 1 2 63 1 1 1 1 35 HIS H . 35 HIS HN 1 2 63 1 2 1 1 36 THR HB . 36 THR HB 1 2 64 1 1 1 1 32 GLN HA . 32 GLN HA 1 2 64 1 2 1 1 35 HIS H . 35 HIS HN 1 2 65 1 1 1 1 35 HIS H . 35 HIS HN 1 2 65 1 2 1 1 35 HIS HB3 . 35 HIS HB3 1 2 66 1 1 1 1 35 HIS H . 35 HIS HN 1 2 66 1 2 1 1 35 HIS HB2 . 35 HIS HB2 1 2 67 1 1 1 1 34 ILE HB . 34 ILE HB 1 2 67 1 2 1 1 35 HIS H . 35 HIS HN 1 2 68 1 1 1 1 35 HIS H . 35 HIS HN 1 2 68 1 2 1 1 36 THR MG . 36 THR QG2 1 2 69 1 1 1 1 33 LYS H . 33 LYS HN 1 2 69 1 2 1 1 34 ILE HG12 . 34 ILE HG12 1 2 70 1 1 1 1 34 ILE HG12 . 34 ILE HG12 1 2 70 1 2 1 1 35 HIS H . 35 HIS HN 1 2 71 1 1 1 1 34 ILE HG13 . 34 ILE HG13 1 2 71 1 2 1 1 35 HIS H . 35 HIS HN 1 2 72 1 1 1 1 34 ILE MG . 34 ILE QG2 1 2 72 1 2 1 1 35 HIS H . 35 HIS HN 1 2 73 1 1 1 1 33 LYS H . 33 LYS HN 1 2 73 1 2 1 1 34 ILE H . 34 ILE HN 1 2 74 1 1 1 1 31 HIS H . 31 HIS HN 1 2 74 1 2 1 1 33 LYS H . 33 LYS HN 1 2 75 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 75 1 2 1 1 33 LYS H . 33 LYS HN 1 2 76 1 1 1 1 30 THR HA . 30 THR HA 1 2 76 1 2 1 1 33 LYS H . 33 LYS HN 1 2 77 1 1 1 1 31 HIS HB3 . 31 HIS HB3 1 2 77 1 2 1 1 33 LYS H . 33 LYS HN 1 2 78 1 1 1 1 32 GLN QG . 32 GLN QG 1 2 78 1 2 1 1 33 LYS H . 33 LYS HN 1 2 79 1 1 1 1 33 LYS H . 33 LYS HN 1 2 79 1 2 1 1 33 LYS HB2 . 33 LYS HB2 1 2 80 1 1 1 1 33 LYS H . 33 LYS HN 1 2 80 1 2 1 1 33 LYS HG3 . 33 LYS HG3 1 2 81 1 1 1 1 33 LYS H . 33 LYS HN 1 2 81 1 2 1 1 33 LYS HG2 . 33 LYS HG2 1 2 82 1 1 1 1 33 LYS H . 33 LYS HN 1 2 82 1 2 1 1 34 ILE MG . 34 ILE QG2 1 2 83 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 83 1 2 1 1 19 GLY H . 19 GLY HN 1 2 84 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 84 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 85 1 1 1 1 14 ARG HA . 14 ARG HA 1 2 85 1 2 1 1 15 CYS H . 15 CYSS HN 1 2 86 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 86 1 2 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 87 1 1 1 1 14 ARG HD2 . 14 ARG HD2 1 2 87 1 2 1 1 15 CYS H . 15 CYSS HN 1 2 88 1 1 1 1 14 ARG HD3 . 14 ARG HD3 1 2 88 1 2 1 1 15 CYS H . 15 CYSS HN 1 2 89 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 89 1 2 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 90 1 1 1 1 14 ARG QB . 14 ARG QB 1 2 90 1 2 1 1 15 CYS H . 15 CYSS HN 1 2 91 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 91 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 92 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 92 1 2 1 1 22 PHE QD . 22 PHE QD 1 2 93 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 93 1 2 1 1 22 PHE H . 22 PHE HN 1 2 94 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 94 1 2 1 1 22 PHE H . 22 PHE HN 1 2 95 1 1 1 1 22 PHE H . 22 PHE HN 1 2 95 1 2 1 1 22 PHE QD . 22 PHE QD 1 2 96 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 96 1 2 1 1 22 PHE H . 22 PHE HN 1 2 97 1 1 1 1 22 PHE H . 22 PHE HN 1 2 97 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 98 1 1 1 1 21 ALA HA . 21 ALA HA 1 2 98 1 2 1 1 22 PHE H . 22 PHE HN 1 2 99 1 1 1 1 22 PHE H . 22 PHE HN 1 2 99 1 2 1 1 22 PHE HB3 . 22 PHE HB3 1 2 100 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 100 1 2 1 1 22 PHE H . 22 PHE HN 1 2 101 1 1 1 1 22 PHE H . 22 PHE HN 1 2 101 1 2 1 1 22 PHE HB2 . 22 PHE HB2 1 2 102 1 1 1 1 11 LYS HB2 . 11 LYS HB2 1 2 102 1 2 1 1 22 PHE H . 22 PHE HN 1 2 103 1 1 1 1 11 LYS HB3 . 11 LYS HB3 1 2 103 1 2 1 1 22 PHE H . 22 PHE HN 1 2 104 1 1 1 1 21 ALA MB . 21 ALA QB 1 2 104 1 2 1 1 22 PHE H . 22 PHE HN 1 2 105 1 1 1 1 22 PHE H . 22 PHE HN 1 2 105 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 106 1 1 1 1 34 ILE H . 34 ILE HN 1 2 106 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 107 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 107 1 2 1 1 34 ILE H . 34 ILE HN 1 2 108 1 1 1 1 32 GLN HA . 32 GLN HA 1 2 108 1 2 1 1 34 ILE H . 34 ILE HN 1 2 109 1 1 1 1 34 ILE H . 34 ILE HN 1 2 109 1 2 1 1 35 HIS HB2 . 35 HIS HB2 1 2 110 1 1 1 1 33 LYS HB2 . 33 LYS HB2 1 2 110 1 2 1 1 34 ILE H . 34 ILE HN 1 2 111 1 1 1 1 34 ILE H . 34 ILE HN 1 2 111 1 2 1 1 34 ILE HB . 34 ILE HB 1 2 112 1 1 1 1 34 ILE H . 34 ILE HN 1 2 112 1 2 1 1 34 ILE HG12 . 34 ILE HG12 1 2 113 1 1 1 1 34 ILE H . 34 ILE HN 1 2 113 1 2 1 1 34 ILE HG13 . 34 ILE HG13 1 2 114 1 1 1 1 34 ILE H . 34 ILE HN 1 2 114 1 2 1 1 34 ILE MG . 34 ILE QG2 1 2 115 1 1 1 1 29 PHE H . 29 PHE HN 1 2 115 1 2 1 1 30 THR H . 30 THR HN 1 2 116 1 1 1 1 30 THR H . 30 THR HN 1 2 116 1 2 1 1 32 GLN H . 32 GLN HN 1 2 117 1 1 1 1 29 PHE QD . 29 PHE QD 1 2 117 1 2 1 1 30 THR H . 30 THR HN 1 2 118 1 1 1 1 28 LEU H . 28 LEU HN 1 2 118 1 2 1 1 30 THR H . 30 THR HN 1 2 119 1 1 1 1 27 ASN HA . 27 ASN HA 1 2 119 1 2 1 1 30 THR H . 30 THR HN 1 2 120 1 1 1 1 30 THR H . 30 THR HN 1 2 120 1 2 1 1 30 THR HB . 30 THR HB 1 2 121 1 1 1 1 29 PHE QB . 29 PHE QB 1 2 121 1 2 1 1 30 THR H . 30 THR HN 1 2 122 1 1 1 1 30 THR H . 30 THR HN 1 2 122 1 2 1 1 31 HIS HB2 . 31 HIS HB2 1 2 123 1 1 1 1 28 LEU HB3 . 28 LEU HB3 1 2 123 1 2 1 1 30 THR H . 30 THR HN 1 2 124 1 1 1 1 30 THR H . 30 THR HN 1 2 124 1 2 1 1 30 THR MG . 30 THR QG2 1 2 125 1 1 1 1 26 SER H . 26 SER HN 1 2 125 1 2 1 1 26 SER QB . 26 SER QB 1 2 126 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 126 1 2 1 1 16 ALA H . 16 ALA HN 1 2 127 1 1 1 1 16 ALA H . 16 ALA HN 1 2 127 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 128 1 1 1 1 16 ALA H . 16 ALA HN 1 2 128 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 129 1 1 1 1 32 GLN H . 32 GLN HN 1 2 129 1 2 1 1 34 ILE H . 34 ILE HN 1 2 130 1 1 1 1 32 GLN H . 32 GLN HN 1 2 130 1 2 1 1 33 LYS H . 33 LYS HN 1 2 131 1 1 1 1 31 HIS HD2 . 31 HIS HD2 1 2 131 1 2 1 1 32 GLN H . 32 GLN HN 1 2 132 1 1 1 1 29 PHE HA . 29 PHE HA 1 2 132 1 2 1 1 32 GLN H . 32 GLN HN 1 2 133 1 1 1 1 31 HIS HB3 . 31 HIS HB3 1 2 133 1 2 1 1 32 GLN H . 32 GLN HN 1 2 134 1 1 1 1 32 GLN H . 32 GLN HN 1 2 134 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 135 1 1 1 1 32 GLN H . 32 GLN HN 1 2 135 1 2 1 1 32 GLN HB2 . 32 GLN HB2 1 2 136 1 1 1 1 32 GLN H . 32 GLN HN 1 2 136 1 2 1 1 33 LYS HB2 . 33 LYS HB2 1 2 137 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 137 1 2 1 1 32 GLN H . 32 GLN HN 1 2 138 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 138 1 2 1 1 32 GLN H . 32 GLN HN 1 2 139 1 1 1 1 21 ALA H . 21 ALA HN 1 2 139 1 2 1 1 22 PHE H . 22 PHE HN 1 2 140 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 140 1 2 1 1 21 ALA H . 21 ALA HN 1 2 141 1 1 1 1 20 LYS HB3 . 20 LYS HB3 1 2 141 1 2 1 1 21 ALA H . 21 ALA HN 1 2 142 1 1 1 1 21 ALA H . 21 ALA HN 1 2 142 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 143 1 1 1 1 20 LYS HG3 . 20 LYS HG3 1 2 143 1 2 1 1 21 ALA H . 21 ALA HN 1 2 144 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 144 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 145 1 1 1 1 17 GLU H . 17 GLU HN 1 2 145 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 146 1 1 1 1 18 CYS H . 18 CYSS HN 1 2 146 1 2 1 1 19 GLY H . 19 GLY HN 1 2 147 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 147 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 148 1 1 1 1 18 CYS H . 18 CYSS HN 1 2 148 1 2 1 1 19 GLY HA2 . 19 GLY HA1 1 2 149 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 149 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 150 1 1 1 1 17 GLU HG2 . 17 GLU HG2 1 2 150 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 151 1 1 1 1 17 GLU HG3 . 17 GLU HG3 1 2 151 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 152 1 1 1 1 17 GLU HB3 . 17 GLU HB3 1 2 152 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 153 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 153 1 2 1 1 25 ARG H . 25 ARG HN 1 2 154 1 1 1 1 13 TYR QE . 13 TYR QE 1 2 154 1 2 1 1 25 ARG H . 25 ARG HN 1 2 155 1 1 1 1 25 ARG H . 25 ARG HN 1 2 155 1 2 1 1 25 ARG HB2 . 25 ARG HB2 1 2 156 1 1 1 1 25 ARG H . 25 ARG HN 1 2 156 1 2 1 1 25 ARG HB3 . 25 ARG HB3 1 2 157 1 1 1 1 25 ARG H . 25 ARG HN 1 2 157 1 2 1 1 25 ARG QG . 25 ARG QG 1 2 158 1 1 1 1 14 ARG H . 14 ARG HN 1 2 158 1 2 1 1 15 CYS H . 15 CYSS HN 1 2 159 1 1 1 1 13 TYR H . 13 TYR HN 1 2 159 1 2 1 1 14 ARG H . 14 ARG HN 1 2 160 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 160 1 2 1 1 14 ARG H . 14 ARG HN 1 2 161 1 1 1 1 13 TYR HA . 13 TYR HA 1 2 161 1 2 1 1 14 ARG H . 14 ARG HN 1 2 162 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 162 1 2 1 1 14 ARG H . 14 ARG HN 1 2 163 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 163 1 2 1 1 14 ARG H . 14 ARG HN 1 2 164 1 1 1 1 38 GLU HG2 . 38 GLU HG2 1 2 164 1 2 1 1 39 LYS H . 39 LYS HN 1 2 165 1 1 1 1 38 GLU HG3 . 38 GLU HG3 1 2 165 1 2 1 1 39 LYS H . 39 LYS HN 1 2 166 1 1 1 1 14 ARG H . 14 ARG HN 1 2 166 1 2 1 1 14 ARG QB . 14 ARG QB 1 2 167 1 1 1 1 14 ARG H . 14 ARG HN 1 2 167 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 168 1 1 1 1 38 GLU HA . 38 GLU HA 1 2 168 1 2 1 1 39 LYS H . 39 LYS HN 1 2 169 1 1 1 1 39 LYS H . 39 LYS HN 1 2 169 1 2 1 1 39 LYS QG . 39 LYS QG 1 2 170 1 1 1 1 19 GLY H . 19 GLY HN 1 2 170 1 2 1 1 19 GLY HA2 . 19 GLY HA1 1 2 171 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 171 1 2 1 1 19 GLY H . 19 GLY HN 1 2 172 1 1 1 1 17 GLU H . 17 GLU HN 1 2 172 1 2 1 1 19 GLY H . 19 GLY HN 1 2 173 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 173 1 2 1 1 19 GLY H . 19 GLY HN 1 2 174 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 174 1 2 1 1 20 LYS H . 20 LYS HN 1 2 175 1 1 1 1 20 LYS H . 20 LYS HN 1 2 175 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 176 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 176 1 2 1 1 20 LYS H . 20 LYS HN 1 2 177 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 177 1 2 1 1 20 LYS H . 20 LYS HN 1 2 178 1 1 1 1 20 LYS H . 20 LYS HN 1 2 178 1 2 1 1 20 LYS HB3 . 20 LYS HB3 1 2 179 1 1 1 1 20 LYS H . 20 LYS HN 1 2 179 1 2 1 1 20 LYS HB2 . 20 LYS HB2 1 2 180 1 1 1 1 19 GLY H . 19 GLY HN 1 2 180 1 2 1 1 20 LYS H . 20 LYS HN 1 2 181 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 181 1 2 1 1 23 THR H . 23 THR HN 1 2 182 1 1 1 1 10 GLU HA . 10 GLU HA 1 2 182 1 2 1 1 11 LYS H . 11 LYS HN 1 2 183 1 1 1 1 11 LYS H . 11 LYS HN 1 2 183 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 184 1 1 1 1 11 LYS H . 11 LYS HN 1 2 184 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 185 1 1 1 1 26 SER HA . 26 SER HA 1 2 185 1 2 1 1 28 LEU H . 28 LEU HN 1 2 186 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 186 1 2 1 1 28 LEU H . 28 LEU HN 1 2 187 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 187 1 2 1 1 28 LEU H . 28 LEU HN 1 2 188 1 1 1 1 25 ARG H . 25 ARG HN 1 2 188 1 2 1 1 28 LEU H . 28 LEU HN 1 2 189 1 1 1 1 26 SER H . 26 SER HN 1 2 189 1 2 1 1 28 LEU H . 28 LEU HN 1 2 190 1 1 1 1 36 THR H . 36 THR HN 1 2 190 1 2 1 1 37 GLY H . 37 GLY HN 1 2 191 1 1 1 1 28 LEU H . 28 LEU HN 1 2 191 1 2 1 1 29 PHE H . 29 PHE HN 1 2 192 1 1 1 1 27 ASN H . 27 ASN HN 1 2 192 1 2 1 1 28 LEU H . 28 LEU HN 1 2 193 1 1 1 1 27 ASN HB2 . 27 ASN HB2 1 2 193 1 2 1 1 28 LEU H . 28 LEU HN 1 2 194 1 1 1 1 27 ASN HB3 . 27 ASN HB3 1 2 194 1 2 1 1 28 LEU H . 28 LEU HN 1 2 195 1 1 1 1 28 LEU H . 28 LEU HN 1 2 195 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 2 196 1 1 1 1 28 LEU H . 28 LEU HN 1 2 196 1 2 1 1 28 LEU HG . 28 LEU HG 1 2 197 1 1 1 1 28 LEU H . 28 LEU HN 1 2 197 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 198 1 1 1 1 28 LEU H . 28 LEU HN 1 2 198 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 199 1 1 1 1 28 LEU H . 28 LEU HN 1 2 199 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 200 1 1 1 1 35 HIS H . 35 HIS HN 1 2 200 1 2 1 1 36 THR H . 36 THR HN 1 2 201 1 1 1 1 36 THR H . 36 THR HN 1 2 201 1 2 1 1 36 THR HB . 36 THR HB 1 2 202 1 1 1 1 33 LYS HA . 33 LYS HA 1 2 202 1 2 1 1 36 THR H . 36 THR HN 1 2 203 1 1 1 1 35 HIS HB3 . 35 HIS HB3 1 2 203 1 2 1 1 36 THR H . 36 THR HN 1 2 204 1 1 1 1 35 HIS HB2 . 35 HIS HB2 1 2 204 1 2 1 1 36 THR H . 36 THR HN 1 2 205 1 1 1 1 36 THR H . 36 THR HN 1 2 205 1 2 1 1 36 THR MG . 36 THR QG2 1 2 206 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 206 1 2 1 1 32 GLN HE21 . 32 GLN HE21 1 2 207 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 207 1 2 1 1 32 GLN HE22 . 32 GLN HE22 1 2 208 1 1 1 1 30 THR MG . 30 THR QG2 1 2 208 1 2 1 1 31 HIS H . 31 HIS HN 1 2 209 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 209 1 2 1 1 31 HIS H . 31 HIS HN 1 2 210 1 1 1 1 31 HIS H . 31 HIS HN 1 2 210 1 2 1 1 32 GLN H . 32 GLN HN 1 2 211 1 1 1 1 30 THR H . 30 THR HN 1 2 211 1 2 1 1 31 HIS H . 31 HIS HN 1 2 212 1 1 1 1 27 ASN HA . 27 ASN HA 1 2 212 1 2 1 1 31 HIS H . 31 HIS HN 1 2 213 1 1 1 1 29 PHE HA . 29 PHE HA 1 2 213 1 2 1 1 31 HIS H . 31 HIS HN 1 2 214 1 1 1 1 30 THR HB . 30 THR HB 1 2 214 1 2 1 1 31 HIS H . 31 HIS HN 1 2 215 1 1 1 1 31 HIS H . 31 HIS HN 1 2 215 1 2 1 1 31 HIS HB3 . 31 HIS HB3 1 2 216 1 1 1 1 31 HIS H . 31 HIS HN 1 2 216 1 2 1 1 31 HIS HB2 . 31 HIS HB2 1 2 217 1 1 1 1 12 PRO HG2 . 12 PRO HG2 1 2 217 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 218 1 1 1 1 13 TYR H . 13 TYR HN 1 2 218 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 219 1 1 1 1 13 TYR QE . 13 TYR QE 1 2 219 1 2 1 1 23 THR HA . 23 THR HA 1 2 220 1 1 1 1 12 PRO QD . 12 PRO QD 1 2 220 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 221 1 1 1 1 13 TYR QE . 13 TYR QE 1 2 221 1 2 1 1 25 ARG QD . 25 ARG QD 1 2 222 1 1 1 1 12 PRO HG3 . 12 PRO HG3 1 2 222 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 223 1 1 1 1 13 TYR QE . 13 TYR QE 1 2 223 1 2 1 1 25 ARG QG . 25 ARG QG 1 2 224 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 224 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 225 1 1 1 1 14 ARG HA . 14 ARG HA 1 2 225 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 226 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 226 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 227 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 227 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 228 1 1 1 1 28 LEU HB2 . 28 LEU HB2 1 2 228 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 229 1 1 1 1 12 PRO QD . 12 PRO QD 1 2 229 1 2 1 1 23 THR MG . 23 THR QG2 1 2 230 1 1 1 1 27 ASN HA . 27 ASN HA 1 2 230 1 2 1 1 30 THR MG . 30 THR QG2 1 2 231 1 1 1 1 30 THR HA . 30 THR HA 1 2 231 1 2 1 1 30 THR MG . 30 THR QG2 1 2 232 1 1 1 1 30 THR MG . 30 THR QG2 1 2 232 1 2 1 1 31 HIS HB2 . 31 HIS HB2 1 2 233 1 1 1 1 14 ARG QB . 14 ARG QB 1 2 233 1 2 1 1 19 GLY HA2 . 19 GLY HA1 1 2 234 1 1 1 1 14 ARG HG2 . 14 ARG HG2 1 2 234 1 2 1 1 19 GLY HA2 . 19 GLY HA1 1 2 235 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 235 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 236 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 236 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 237 1 1 1 1 29 PHE QB . 29 PHE QB 1 2 237 1 2 1 1 30 THR MG . 30 THR QG2 1 2 238 1 1 1 1 30 THR MG . 30 THR QG2 1 2 238 1 2 1 1 31 HIS HB3 . 31 HIS HB3 1 2 239 1 1 1 1 11 LYS QD . 11 LYS QD 1 2 239 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 240 1 1 1 1 12 PRO QD . 12 PRO QD 1 2 240 1 2 1 1 23 THR HB . 23 THR HB 1 2 241 1 1 1 1 11 LYS QE . 11 LYS QE 1 2 241 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 242 1 1 1 1 35 HIS HB2 . 35 HIS HB2 1 2 242 1 2 1 1 36 THR MG . 36 THR QG2 1 2 243 1 1 1 1 27 ASN HA . 27 ASN HA 1 2 243 1 2 1 1 30 THR HB . 30 THR HB 1 2 244 1 1 1 1 29 PHE QB . 29 PHE QB 1 2 244 1 2 1 1 30 THR HB . 30 THR HB 1 2 245 1 1 1 1 30 THR HB . 30 THR HB 1 2 245 1 2 1 1 31 HIS HB3 . 31 HIS HB3 1 2 246 1 1 1 1 42 GLY HA3 . 42 GLY HA2 1 2 246 1 2 1 1 43 PRO QD . 43 PRO QD 1 2 247 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 247 1 2 1 1 24 ASP H . 24 ASP HN 1 2 248 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 248 1 2 1 1 22 PHE HB2 . 22 PHE HB2 1 2 249 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 249 1 2 1 1 27 ASN HB2 . 27 ASN HB2 1 2 250 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 250 1 2 1 1 22 PHE HB3 . 22 PHE HB3 1 2 251 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 251 1 2 1 1 27 ASN HB3 . 27 ASN HB3 1 2 252 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 252 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 2 253 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 253 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 254 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 254 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 255 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 255 1 2 1 1 22 PHE HB2 . 22 PHE HB2 1 2 256 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 256 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 257 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 257 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 258 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 258 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 259 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 259 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 260 1 1 1 1 25 ARG QD . 25 ARG QD 1 2 260 1 2 1 1 29 PHE QD . 29 PHE QD 1 2 261 1 1 1 1 25 ARG HB2 . 25 ARG HB2 1 2 261 1 2 1 1 25 ARG QD . 25 ARG QD 1 2 262 1 1 1 1 25 ARG HB3 . 25 ARG HB3 1 2 262 1 2 1 1 25 ARG QD . 25 ARG QD 1 2 263 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 263 1 2 1 1 16 ALA MB . 16 ALA QB 1 2 264 1 1 1 1 29 PHE QB . 29 PHE QB 1 2 264 1 2 1 1 30 THR HA . 30 THR HA 1 2 265 1 1 1 1 30 THR HA . 30 THR HA 1 2 265 1 2 1 1 33 LYS HE2 . 33 LYS HE2 1 2 266 1 1 1 1 30 THR HA . 30 THR HA 1 2 266 1 2 1 1 33 LYS HB2 . 33 LYS HB2 1 2 267 1 1 1 1 30 THR HA . 30 THR HA 1 2 267 1 2 1 1 33 LYS QD . 33 LYS QD 1 2 268 1 1 1 1 30 THR HA . 30 THR HA 1 2 268 1 2 1 1 33 LYS HG2 . 33 LYS HG2 1 2 269 1 1 1 1 11 LYS QE . 11 LYS QE 1 2 269 1 2 1 1 11 LYS HG2 . 11 LYS HG2 1 2 270 1 1 1 1 11 LYS QE . 11 LYS QE 1 2 270 1 2 1 1 11 LYS HG3 . 11 LYS HG3 1 2 271 1 1 1 1 30 THR HA . 30 THR HA 1 2 271 1 2 1 1 33 LYS HE3 . 33 LYS HE3 1 2 272 1 1 1 1 28 LEU HB3 . 28 LEU HB3 1 2 272 1 2 1 1 29 PHE QD . 29 PHE QD 1 2 273 1 1 1 1 12 PRO QD . 12 PRO QD 1 2 273 1 2 1 1 23 THR HA . 23 THR HA 1 2 274 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 274 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 2 275 1 1 1 1 28 LEU HB3 . 28 LEU HB3 1 2 275 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 276 1 1 1 1 34 ILE HG12 . 34 ILE HG12 1 2 276 1 2 1 1 34 ILE MG . 34 ILE QG2 1 2 277 1 1 1 1 34 ILE MD . 34 ILE QD1 1 2 277 1 2 1 1 34 ILE MG . 34 ILE QG2 1 2 278 1 1 1 1 12 PRO HA . 12 PRO HA 1 2 278 1 2 1 1 13 TYR QD . 13 TYR QD 1 2 279 1 1 1 1 34 ILE HA . 34 ILE HA 1 2 279 1 2 1 1 34 ILE HB . 34 ILE HB 1 2 280 1 1 1 1 34 ILE HA . 34 ILE HA 1 2 280 1 2 1 1 34 ILE HG12 . 34 ILE HG12 1 2 281 1 1 1 1 34 ILE HA . 34 ILE HA 1 2 281 1 2 1 1 34 ILE HG13 . 34 ILE HG13 1 2 282 1 1 1 1 34 ILE HA . 34 ILE HA 1 2 282 1 2 1 1 34 ILE MG . 34 ILE QG2 1 2 283 1 1 1 1 27 ASN HB2 . 27 ASN HB2 1 2 283 1 2 1 1 28 LEU HA . 28 LEU HA 1 2 284 1 1 1 1 27 ASN HB3 . 27 ASN HB3 1 2 284 1 2 1 1 28 LEU HA . 28 LEU HA 1 2 285 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 285 1 2 1 1 22 PHE HB2 . 22 PHE HB2 1 2 286 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 286 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 2 287 1 1 1 1 36 THR HA . 36 THR HA 1 2 287 1 2 1 1 36 THR MG . 36 THR QG2 1 2 288 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 288 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 289 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 289 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 290 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 290 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 291 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 291 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 292 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 292 1 2 1 1 27 ASN HB3 . 27 ASN HB3 1 2 293 1 1 1 1 27 ASN H . 27 ASN HN 1 2 293 1 2 1 1 27 ASN HB3 . 27 ASN HB3 1 2 294 1 1 1 1 31 HIS HE1 . 31 HIS HE1 1 2 294 1 2 1 1 34 ILE MD . 34 ILE QD1 1 2 295 1 1 1 1 34 ILE H . 34 ILE HN 1 2 295 1 2 1 1 34 ILE MD . 34 ILE QD1 1 2 296 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 296 1 2 1 1 34 ILE MD . 34 ILE QD1 1 2 297 1 1 1 1 34 ILE HA . 34 ILE HA 1 2 297 1 2 1 1 34 ILE MD . 34 ILE QD1 1 2 298 1 1 1 1 34 ILE HB . 34 ILE HB 1 2 298 1 2 1 1 34 ILE MD . 34 ILE QD1 1 2 299 1 1 1 1 26 SER HA . 26 SER HA 1 2 299 1 2 1 1 29 PHE QD . 29 PHE QD 1 2 300 1 1 1 1 28 LEU H . 28 LEU HN 1 2 300 1 2 1 1 29 PHE QB . 29 PHE QB 1 2 301 1 1 1 1 13 TYR HA . 13 TYR HA 1 2 301 1 2 1 1 13 TYR QD . 13 TYR QD 1 2 302 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 302 1 2 1 1 23 THR HA . 23 THR HA 1 2 303 1 1 1 1 26 SER HA . 26 SER HA 1 2 303 1 2 1 1 29 PHE QB . 29 PHE QB 1 2 304 1 1 1 1 26 SER QB . 26 SER QB 1 2 304 1 2 1 1 29 PHE QB . 29 PHE QB 1 2 305 1 1 1 1 12 PRO QD . 12 PRO QD 1 2 305 1 2 1 1 13 TYR QD . 13 TYR QD 1 2 306 1 1 1 1 28 LEU HB3 . 28 LEU HB3 1 2 306 1 2 1 1 29 PHE QB . 29 PHE QB 1 2 307 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 307 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 308 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 308 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 309 1 1 1 1 21 ALA HA . 21 ALA HA 1 2 309 1 2 1 1 22 PHE QD . 22 PHE QD 1 2 310 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 310 1 2 1 1 28 LEU HA . 28 LEU HA 1 2 311 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 311 1 2 1 1 27 ASN HB2 . 27 ASN HB2 1 2 312 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 312 1 2 1 1 27 ASN HB3 . 27 ASN HB3 1 2 313 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 313 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 2 314 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 314 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 315 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 315 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 316 1 1 1 1 29 PHE HA . 29 PHE HA 1 2 316 1 2 1 1 29 PHE QD . 29 PHE QD 1 2 317 1 1 1 1 29 PHE HA . 29 PHE HA 1 2 317 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 318 1 1 1 1 29 PHE HA . 29 PHE HA 1 2 318 1 2 1 1 32 GLN HB2 . 32 GLN HB2 1 2 319 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 319 1 2 1 1 29 PHE HA . 29 PHE HA 1 2 320 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 320 1 2 1 1 29 PHE HA . 29 PHE HA 1 2 321 1 1 1 1 28 LEU MD2 . 28 LEU QD2 1 2 321 1 2 1 1 29 PHE HA . 29 PHE HA 1 2 322 1 1 1 1 25 ARG QD . 25 ARG QD 1 2 322 1 2 1 1 29 PHE QE . 29 PHE QE 1 2 323 1 1 1 1 29 PHE HA . 29 PHE HA 1 2 323 1 2 1 1 29 PHE QE . 29 PHE QE 1 2 324 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 324 1 2 1 1 29 PHE QD . 29 PHE QD 1 2 325 1 1 1 1 25 ARG QG . 25 ARG QG 1 2 325 1 2 1 1 29 PHE QE . 29 PHE QE 1 2 326 1 1 1 1 31 HIS HD2 . 31 HIS HD2 1 2 326 1 2 1 1 32 GLN HA . 32 GLN HA 1 2 327 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 327 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 328 1 1 1 1 21 ALA HA . 21 ALA HA 1 2 328 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 329 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 329 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 330 1 1 1 1 32 GLN HA . 32 GLN HA 1 2 330 1 2 1 1 35 HIS HB2 . 35 HIS HB2 1 2 331 1 1 1 1 31 HIS HB3 . 31 HIS HB3 1 2 331 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 332 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 332 1 2 1 1 31 HIS HB3 . 31 HIS HB3 1 2 333 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 333 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 334 1 1 1 1 32 GLN HA . 32 GLN HA 1 2 334 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 335 1 1 1 1 20 LYS HB3 . 20 LYS HB3 1 2 335 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 336 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 336 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 337 1 1 1 1 30 THR MG . 30 THR QG2 1 2 337 1 2 1 1 31 HIS HA . 31 HIS HA 1 2 338 1 1 1 1 20 LYS HB2 . 20 LYS HB2 1 2 338 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 339 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 339 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 340 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 340 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 341 1 1 1 1 32 GLN HA . 32 GLN HA 1 2 341 1 2 1 1 34 ILE HG12 . 34 ILE HG12 1 2 342 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 342 1 2 1 1 34 ILE HG12 . 34 ILE HG12 1 2 343 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 343 1 2 1 1 34 ILE MG . 34 ILE QG2 1 2 344 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 344 1 2 1 1 25 ARG HA . 25 ARG HA 1 2 345 1 1 1 1 25 ARG HA . 25 ARG HA 1 2 345 1 2 1 1 28 LEU H . 28 LEU HN 1 2 346 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 346 1 2 1 1 25 ARG HA . 25 ARG HA 1 2 347 1 1 1 1 25 ARG HA . 25 ARG HA 1 2 347 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 2 348 1 1 1 1 25 ARG HA . 25 ARG HA 1 2 348 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 349 1 1 1 1 25 ARG HA . 25 ARG HA 1 2 349 1 2 1 1 25 ARG QG . 25 ARG QG 1 2 350 1 1 1 1 33 LYS HA . 33 LYS HA 1 2 350 1 2 1 1 33 LYS HG3 . 33 LYS HG3 1 2 351 1 1 1 1 33 LYS HA . 33 LYS HA 1 2 351 1 2 1 1 33 LYS HG2 . 33 LYS HG2 1 2 352 1 1 1 1 33 LYS HA . 33 LYS HA 1 2 352 1 2 1 1 36 THR MG . 36 THR QG2 1 2 353 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 353 1 2 1 1 20 LYS HG3 . 20 LYS HG3 1 2 354 1 1 1 1 17 GLU HA . 17 GLU HA 1 2 354 1 2 1 1 17 GLU HG2 . 17 GLU HG2 1 2 355 1 1 1 1 17 GLU HA . 17 GLU HA 1 2 355 1 2 1 1 17 GLU HG3 . 17 GLU HG3 1 2 356 1 1 1 1 16 ALA MB . 16 ALA QB 1 2 356 1 2 1 1 17 GLU HA . 17 GLU HA 1 2 357 1 1 1 1 25 ARG QG . 25 ARG QG 1 2 357 1 2 1 1 29 PHE HZ . 29 PHE HZ 1 2 358 1 1 1 1 28 LEU HA . 28 LEU HA 1 2 358 1 2 1 1 32 GLN H . 32 GLN HN 1 2 359 1 1 1 1 28 LEU HA . 28 LEU HA 1 2 359 1 2 1 1 31 HIS H . 31 HIS HN 1 2 360 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 360 1 2 1 1 28 LEU HA . 28 LEU HA 1 2 361 1 1 1 1 25 ARG QD . 25 ARG QD 1 2 361 1 2 1 1 29 PHE HZ . 29 PHE HZ 1 2 362 1 1 1 1 28 LEU HA . 28 LEU HA 1 2 362 1 2 1 1 28 LEU HG . 28 LEU HG 1 2 363 1 1 1 1 28 LEU HA . 28 LEU HA 1 2 363 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 364 1 1 1 1 22 PHE HZ . 22 PHE HZ 1 2 364 1 2 1 1 31 HIS HE1 . 31 HIS HE1 1 2 365 1 1 1 1 20 LYS HB3 . 20 LYS HB3 1 2 365 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 366 1 1 1 1 20 LYS HB2 . 20 LYS HB2 1 2 366 1 2 1 1 21 ALA H . 21 ALA HN 1 2 367 1 1 1 1 22 PHE HZ . 22 PHE HZ 1 2 367 1 2 1 1 31 HIS HB3 . 31 HIS HB3 1 2 368 1 1 1 1 22 PHE HZ . 22 PHE HZ 1 2 368 1 2 1 1 31 HIS HB2 . 31 HIS HB2 1 2 369 1 1 1 1 20 LYS HD3 . 20 LYS HD3 1 2 369 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 370 1 1 1 1 20 LYS HB2 . 20 LYS HB2 1 2 370 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 371 1 1 1 1 11 LYS HB2 . 11 LYS HB2 1 2 371 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 372 1 1 1 1 32 GLN HA . 32 GLN HA 1 2 372 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 373 1 1 1 1 35 HIS HB2 . 35 HIS HB2 1 2 373 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 374 1 1 1 1 32 GLN QG . 32 GLN QG 1 2 374 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 375 1 1 1 1 17 GLU HB2 . 17 GLU HB2 1 2 375 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 376 1 1 1 1 31 HIS HD2 . 31 HIS HD2 1 2 376 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 377 1 1 1 1 31 HIS H . 31 HIS HN 1 2 377 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 378 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 378 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 379 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 379 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 380 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 380 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 381 1 1 1 1 31 HIS HB3 . 31 HIS HB3 1 2 381 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 382 1 1 1 1 31 HIS HD2 . 31 HIS HD2 1 2 382 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 383 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 383 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 384 1 1 1 1 14 ARG HA . 14 ARG HA 1 2 384 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 385 1 1 1 1 11 LYS HA . 11 LYS HA 1 2 385 1 2 1 1 11 LYS QD . 11 LYS QD 1 2 386 1 1 1 1 11 LYS HA . 11 LYS HA 1 2 386 1 2 1 1 11 LYS HG2 . 11 LYS HG2 1 2 387 1 1 1 1 25 ARG HB2 . 25 ARG HB2 1 2 387 1 2 1 1 26 SER H . 26 SER HN 1 2 388 1 1 1 1 25 ARG HB3 . 25 ARG HB3 1 2 388 1 2 1 1 26 SER H . 26 SER HN 1 2 389 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 389 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 390 1 1 1 1 14 ARG HA . 14 ARG HA 1 2 390 1 2 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 391 1 1 1 1 14 ARG HA . 14 ARG HA 1 2 391 1 2 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 392 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 392 1 2 1 1 20 LYS HB3 . 20 LYS HB3 1 2 393 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 393 1 2 1 1 20 LYS HB3 . 20 LYS HB3 1 2 394 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 394 1 2 1 1 20 LYS HB2 . 20 LYS HB2 1 2 395 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 395 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 396 1 1 1 1 17 GLU H . 17 GLU HN 1 2 396 1 2 1 1 17 GLU HB3 . 17 GLU HB3 1 2 397 1 1 1 1 20 LYS HD3 . 20 LYS HD3 1 2 397 1 2 1 1 31 HIS HE1 . 31 HIS HE1 1 2 398 1 1 1 1 17 GLU HB2 . 17 GLU HB2 1 2 398 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 399 1 1 1 1 17 GLU HB3 . 17 GLU HB3 1 2 399 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 400 1 1 1 1 20 LYS HD2 . 20 LYS HD2 1 2 400 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 401 1 1 1 1 33 LYS H . 33 LYS HN 1 2 401 1 2 1 1 33 LYS QD . 33 LYS QD 1 2 402 1 1 1 1 33 LYS HA . 33 LYS HA 1 2 402 1 2 1 1 33 LYS QD . 33 LYS QD 1 2 403 1 1 1 1 33 LYS HB2 . 33 LYS HB2 1 2 403 1 2 1 1 33 LYS QD . 33 LYS QD 1 2 404 1 1 1 1 31 HIS HB2 . 31 HIS HB2 1 2 404 1 2 1 1 32 GLN H . 32 GLN HN 1 2 405 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 405 1 2 1 1 31 HIS HB2 . 31 HIS HB2 1 2 406 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 406 1 2 1 1 31 HIS HB2 . 31 HIS HB2 1 2 407 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 407 1 2 1 1 31 HIS HB3 . 31 HIS HB3 1 2 408 1 1 1 1 32 GLN H . 32 GLN HN 1 2 408 1 2 1 1 32 GLN HB3 . 32 GLN HB3 1 2 409 1 1 1 1 29 PHE HA . 29 PHE HA 1 2 409 1 2 1 1 32 GLN HB3 . 32 GLN HB3 1 2 410 1 1 1 1 14 ARG HG3 . 14 ARG HG3 1 2 410 1 2 1 1 19 GLY HA2 . 19 GLY HA1 1 2 411 1 1 1 1 25 ARG QG . 25 ARG QG 1 2 411 1 2 1 1 26 SER H . 26 SER HN 1 2 412 1 1 1 1 25 ARG QG . 25 ARG QG 1 2 412 1 2 1 1 29 PHE QD . 29 PHE QD 1 2 413 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 413 1 2 1 1 25 ARG QG . 25 ARG QG 1 2 414 1 1 1 1 39 LYS HA . 39 LYS HA 1 2 414 1 2 1 1 40 PRO HD3 . 40 PRO HD3 1 2 415 1 1 1 1 39 LYS HA . 39 LYS HA 1 2 415 1 2 1 1 40 PRO HD2 . 40 PRO HD2 1 2 416 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 416 1 2 1 1 21 ALA HA . 21 ALA HA 1 2 417 1 1 1 1 12 PRO HG3 . 12 PRO HG3 1 2 417 1 2 1 1 13 TYR H . 13 TYR HN 1 2 418 1 1 1 1 11 LYS HA . 11 LYS HA 1 2 418 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 419 1 1 1 1 14 ARG QB . 14 ARG QB 1 2 419 1 2 1 1 21 ALA HA . 21 ALA HA 1 2 420 1 1 1 1 11 LYS HB3 . 11 LYS HB3 1 2 420 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 421 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 421 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 422 1 1 1 1 28 LEU MD2 . 28 LEU QD2 1 2 422 1 2 1 1 29 PHE QD . 29 PHE QD 1 2 423 1 1 1 1 13 TYR HA . 13 TYR HA 1 2 423 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 424 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 424 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 425 1 1 1 1 28 LEU HB2 . 28 LEU HB2 1 2 425 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 426 1 1 1 1 20 LYS H . 20 LYS HN 1 2 426 1 2 1 1 20 LYS HG2 . 20 LYS HG2 1 2 427 1 1 1 1 20 LYS H . 20 LYS HN 1 2 427 1 2 1 1 20 LYS HG3 . 20 LYS HG3 1 2 428 1 1 1 1 20 LYS HG2 . 20 LYS HG2 1 2 428 1 2 1 1 21 ALA H . 21 ALA HN 1 2 429 1 1 1 1 42 GLY HA2 . 42 GLY HA1 1 2 429 1 2 1 1 43 PRO QD . 43 PRO QD 1 2 430 1 1 1 1 30 THR HA . 30 THR HA 1 2 430 1 2 1 1 33 LYS HG3 . 33 LYS HG3 1 2 431 1 1 1 1 11 LYS HA . 11 LYS HA 1 2 431 1 2 1 1 11 LYS HG3 . 11 LYS HG3 1 2 432 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 432 1 2 1 1 20 LYS HB2 . 20 LYS HB2 1 2 433 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 433 1 2 1 1 20 LYS HG2 . 20 LYS HG2 1 2 434 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 434 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 435 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 435 1 2 1 1 31 HIS HA . 31 HIS HA 1 2 436 1 1 1 1 22 PHE HZ . 22 PHE HZ 1 2 436 1 2 1 1 31 HIS HA . 31 HIS HA 1 2 437 1 1 1 1 29 PHE H . 29 PHE HN 1 2 437 1 2 1 1 29 PHE QE . 29 PHE QE 1 2 438 1 1 1 1 31 HIS HE1 . 31 HIS HE1 1 2 438 1 2 1 1 34 ILE MG . 34 ILE QG2 1 2 439 1 1 1 1 31 HIS HE1 . 31 HIS HE1 1 2 439 1 2 1 1 34 ILE HG12 . 34 ILE HG12 1 2 440 1 1 1 1 17 GLU HB2 . 17 GLU HB2 1 2 440 1 2 1 1 35 HIS HE1 . 35 HIS HE1 1 2 441 1 1 1 1 20 LYS HD2 . 20 LYS HD2 1 2 441 1 2 1 1 31 HIS HE1 . 31 HIS HE1 1 2 442 1 1 1 1 34 ILE HG12 . 34 ILE HG12 1 2 442 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 443 1 1 1 1 32 GLN HB2 . 32 GLN HB2 1 2 443 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 444 1 1 1 1 32 GLN HB3 . 32 GLN HB3 1 2 444 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 445 1 1 1 1 18 CYS HA . 18 CYSS HA 1 2 445 1 2 1 1 35 HIS HE1 . 35 HIS HE1 1 2 446 1 1 1 1 31 HIS HE1 . 31 HIS HE1 1 2 446 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 447 1 1 1 1 10 GLU H . 10 GLU HN 1 2 447 1 2 1 1 10 GLU QB . 10 GLU QB 1 2 448 1 1 1 1 10 GLU H . 10 GLU HN 1 2 448 1 2 1 1 10 GLU QG . 10 GLU QG 1 2 449 1 1 1 1 10 GLU QG . 10 GLU QG 1 2 449 1 2 1 1 11 LYS H . 11 LYS HN 1 2 450 1 1 1 1 11 LYS H . 11 LYS HN 1 2 450 1 2 1 1 11 LYS QB . 11 LYS QB 1 2 451 1 1 1 1 11 LYS H . 11 LYS HN 1 2 451 1 2 1 1 11 LYS QG . 11 LYS QG 1 2 452 1 1 1 1 11 LYS HA . 11 LYS HA 1 2 452 1 2 1 1 11 LYS QG . 11 LYS QG 1 2 453 1 1 1 1 11 LYS QB . 11 LYS QB 1 2 453 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 454 1 1 1 1 11 LYS QB . 11 LYS QB 1 2 454 1 2 1 1 13 TYR H . 13 TYR HN 1 2 455 1 1 1 1 11 LYS QB . 11 LYS QB 1 2 455 1 2 1 1 21 ALA HA . 21 ALA HA 1 2 456 1 1 1 1 11 LYS QB . 11 LYS QB 1 2 456 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 457 1 1 1 1 11 LYS QB . 11 LYS QB 1 2 457 1 2 1 1 22 PHE H . 22 PHE HN 1 2 458 1 1 1 1 11 LYS QG . 11 LYS QG 1 2 458 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 459 1 1 1 1 11 LYS QG . 11 LYS QG 1 2 459 1 2 1 1 22 PHE H . 22 PHE HN 1 2 460 1 1 1 1 11 LYS QG . 11 LYS QG 1 2 460 1 2 1 1 23 THR H . 23 THR HN 1 2 461 1 1 1 1 11 LYS QG . 11 LYS QG 1 2 461 1 2 1 1 23 THR HA . 23 THR HA 1 2 462 1 1 1 1 12 PRO QB . 12 PRO QB 1 2 462 1 2 1 1 13 TYR H . 13 TYR HN 1 2 463 1 1 1 1 12 PRO QB . 12 PRO QB 1 2 463 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 464 1 1 1 1 12 PRO QG . 12 PRO QG 1 2 464 1 2 1 1 13 TYR QD . 13 TYR QD 1 2 465 1 1 1 1 12 PRO QG . 12 PRO QG 1 2 465 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 466 1 1 1 1 12 PRO QG . 12 PRO QG 1 2 466 1 2 1 1 23 THR HA . 23 THR HA 1 2 467 1 1 1 1 13 TYR QE . 13 TYR QE 1 2 467 1 2 1 1 25 ARG QB . 25 ARG QB 1 2 468 1 1 1 1 14 ARG H . 14 ARG HN 1 2 468 1 2 1 1 14 ARG QG . 14 ARG QG 1 2 469 1 1 1 1 14 ARG H . 14 ARG HN 1 2 469 1 2 1 1 14 ARG QD . 14 ARG QD 1 2 470 1 1 1 1 14 ARG QB . 14 ARG QB 1 2 470 1 2 1 1 14 ARG QD . 14 ARG QD 1 2 471 1 1 1 1 14 ARG QG . 14 ARG QG 1 2 471 1 2 1 1 15 CYS H . 15 CYSS HN 1 2 472 1 1 1 1 14 ARG QG . 14 ARG QG 1 2 472 1 2 1 1 19 GLY H . 19 GLY HN 1 2 473 1 1 1 1 14 ARG QG . 14 ARG QG 1 2 473 1 2 1 1 19 GLY HA2 . 19 GLY HA1 1 2 474 1 1 1 1 14 ARG QG . 14 ARG QG 1 2 474 1 2 1 1 19 GLY HA3 . 19 GLY HA2 1 2 475 1 1 1 1 14 ARG QD . 14 ARG QD 1 2 475 1 2 1 1 15 CYS H . 15 CYSS HN 1 2 476 1 1 1 1 14 ARG QD . 14 ARG QD 1 2 476 1 2 1 1 19 GLY H . 19 GLY HN 1 2 477 1 1 1 1 14 ARG QD . 14 ARG QD 1 2 477 1 2 1 1 19 GLY HA2 . 19 GLY HA1 1 2 478 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 478 1 2 1 1 20 LYS QB . 20 LYS QB 1 2 479 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 479 1 2 1 1 32 GLN QE . 32 GLN QE2 1 2 480 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 480 1 2 1 1 20 LYS QB . 20 LYS QB 1 2 481 1 1 1 1 17 GLU H . 17 GLU HN 1 2 481 1 2 1 1 17 GLU QG . 17 GLU QG 1 2 482 1 1 1 1 17 GLU HA . 17 GLU HA 1 2 482 1 2 1 1 17 GLU QG . 17 GLU QG 1 2 483 1 1 1 1 18 CYS H . 18 CYSS HN 1 2 483 1 2 1 1 18 CYS QB . 18 CYSS QB 1 2 484 1 1 1 1 18 CYS QB . 18 CYSS QB 1 2 484 1 2 1 1 35 HIS HE1 . 35 HIS HE1 1 2 485 1 1 1 1 19 GLY H . 19 GLY HN 1 2 485 1 2 1 1 20 LYS QB . 20 LYS QB 1 2 486 1 1 1 1 20 LYS H . 20 LYS HN 1 2 486 1 2 1 1 20 LYS QB . 20 LYS QB 1 2 487 1 1 1 1 20 LYS H . 20 LYS HN 1 2 487 1 2 1 1 20 LYS QG . 20 LYS QG 1 2 488 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 488 1 2 1 1 20 LYS QG . 20 LYS QG 1 2 489 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 489 1 2 1 1 20 LYS QD . 20 LYS QD 1 2 490 1 1 1 1 20 LYS QB . 20 LYS QB 1 2 490 1 2 1 1 21 ALA H . 21 ALA HN 1 2 491 1 1 1 1 20 LYS QB . 20 LYS QB 1 2 491 1 2 1 1 22 PHE QD . 22 PHE QD 1 2 492 1 1 1 1 20 LYS QB . 20 LYS QB 1 2 492 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 493 1 1 1 1 20 LYS QB . 20 LYS QB 1 2 493 1 2 1 1 31 HIS HE1 . 31 HIS HE1 1 2 494 1 1 1 1 20 LYS QG . 20 LYS QG 1 2 494 1 2 1 1 21 ALA H . 21 ALA HN 1 2 495 1 1 1 1 20 LYS QG . 20 LYS QG 1 2 495 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 496 1 1 1 1 20 LYS QD . 20 LYS QD 1 2 496 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 497 1 1 1 1 20 LYS QD . 20 LYS QD 1 2 497 1 2 1 1 31 HIS HE1 . 31 HIS HE1 1 2 498 1 1 1 1 24 ASP QB . 24 ASP QB 1 2 498 1 2 1 1 25 ARG H . 25 ARG HN 1 2 499 1 1 1 1 24 ASP QB . 24 ASP QB 1 2 499 1 2 1 1 26 SER H . 26 SER HN 1 2 500 1 1 1 1 24 ASP QB . 24 ASP QB 1 2 500 1 2 1 1 27 ASN H . 27 ASN HN 1 2 501 1 1 1 1 25 ARG H . 25 ARG HN 1 2 501 1 2 1 1 25 ARG QB . 25 ARG QB 1 2 502 1 1 1 1 25 ARG QB . 25 ARG QB 1 2 502 1 2 1 1 26 SER H . 26 SER HN 1 2 503 1 1 1 1 25 ARG QB . 25 ARG QB 1 2 503 1 2 1 1 27 ASN H . 27 ASN HN 1 2 504 1 1 1 1 27 ASN H . 27 ASN HN 1 2 504 1 2 1 1 27 ASN QD . 27 ASN QD2 1 2 505 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 505 1 2 1 1 32 GLN QE . 32 GLN QE2 1 2 506 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 506 1 2 1 1 32 GLN QE . 32 GLN QE2 1 2 507 1 1 1 1 28 LEU MD2 . 28 LEU QD2 1 2 507 1 2 1 1 32 GLN QE . 32 GLN QE2 1 2 508 1 1 1 1 29 PHE HA . 29 PHE HA 1 2 508 1 2 1 1 32 GLN QB . 32 GLN QB 1 2 509 1 1 1 1 30 THR H . 30 THR HN 1 2 509 1 2 1 1 33 LYS QE . 33 LYS QE 1 2 510 1 1 1 1 30 THR MG . 30 THR QG2 1 2 510 1 2 1 1 33 LYS QE . 33 LYS QE 1 2 511 1 1 1 1 31 HIS HD2 . 31 HIS HD2 1 2 511 1 2 1 1 32 GLN QB . 32 GLN QB 1 2 512 1 1 1 1 31 HIS HD2 . 31 HIS HD2 1 2 512 1 2 1 1 32 GLN QE . 32 GLN QE2 1 2 513 1 1 1 1 32 GLN H . 32 GLN HN 1 2 513 1 2 1 1 32 GLN QB . 32 GLN QB 1 2 514 1 1 1 1 32 GLN QB . 32 GLN QB 1 2 514 1 2 1 1 33 LYS H . 33 LYS HN 1 2 515 1 1 1 1 32 GLN QB . 32 GLN QB 1 2 515 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 516 1 1 1 1 33 LYS H . 33 LYS HN 1 2 516 1 2 1 1 33 LYS QG . 33 LYS QG 1 2 517 1 1 1 1 33 LYS H . 33 LYS HN 1 2 517 1 2 1 1 33 LYS QE . 33 LYS QE 1 2 518 1 1 1 1 33 LYS HA . 33 LYS HA 1 2 518 1 2 1 1 33 LYS QG . 33 LYS QG 1 2 519 1 1 1 1 38 GLU H . 38 GLU HN 1 2 519 1 2 1 1 38 GLU QB . 38 GLU QB 1 2 520 1 1 1 1 38 GLU H . 38 GLU HN 1 2 520 1 2 1 1 38 GLU QG . 38 GLU QG 1 2 521 1 1 1 1 38 GLU QB . 38 GLU QB 1 2 521 1 2 1 1 39 LYS H . 39 LYS HN 1 2 522 1 1 1 1 39 LYS H . 39 LYS HN 1 2 522 1 2 1 1 39 LYS QB . 39 LYS QB 1 2 523 1 1 1 1 39 LYS HA . 39 LYS HA 1 2 523 1 2 1 1 40 PRO QD . 40 PRO QD 1 2 524 1 1 1 1 39 LYS QB . 39 LYS QB 1 2 524 1 2 1 1 40 PRO QD . 40 PRO QD 1 2 stop_ loop_ _Dist_constraint_value.Constraint_ID _Dist_constraint_value.Tree_node_ID _Dist_constraint_value.Source_experiment_ID _Dist_constraint_value.Spectral_peak_ID _Dist_constraint_value.Intensity_val _Dist_constraint_value.Intensity_lower_val_err _Dist_constraint_value.Intensity_upper_val_err _Dist_constraint_value.Distance_val _Dist_constraint_value.Distance_lower_bound_val _Dist_constraint_value.Distance_upper_bound_val _Dist_constraint_value.Entry_ID _Dist_constraint_value.Distance_constraint_list_ID 1 1 . . . . . . . 4.72 1 2 2 1 . . . . . . . 4.6 1 2 3 1 . . . . . . . 5.14 1 2 4 1 . . . . . . . 4.76 1 2 5 1 . . . . . . . 5.31 1 2 6 1 . . . . . . . 5.31 1 2 7 1 . . . . . . . 5.33 1 2 8 1 . . . . . . . 5.33 1 2 9 1 . . . . . . . 3.81 1 2 10 1 . . . . . . . 5.0 1 2 11 1 . . . . . . . 3.59 1 2 12 1 . . . . . . . 5.0 1 2 13 1 . . . . . . . 5.37 1 2 14 1 . . . . . . . 4.69 1 2 15 1 . . . . . . . 3.12 1 2 16 1 . . . . . . . 4.84 1 2 17 1 . . . . . . . 4.72 1 2 18 1 . . . . . . . 5.0 1 2 19 1 . . . . . . . 5.5 1 2 20 1 . . . . . . . 4.76 1 2 21 1 . . . . . . . 4.25 1 2 22 1 . . . . . . . 4.0 1 2 23 1 . . . . . . . 2.76 1 2 24 1 . . . . . . . 4.18 1 2 25 1 . . . . . . . 3.22 1 2 26 1 . . . . . . . 3.98 1 2 27 1 . . . . . . . 3.95 1 2 28 1 . . . . . . . 4.51 1 2 29 1 . . . . . . . 4.76 1 2 30 1 . . . . . . . 3.97 1 2 31 1 . . . . . . . 4.82 1 2 32 1 . . . . . . . 4.25 1 2 33 1 . . . . . . . 4.25 1 2 34 1 . . . . . . . 3.02 1 2 35 1 . . . . . . . 4.67 1 2 36 1 . . . . . . . 4.37 1 2 37 1 . . . . . . . 4.21 1 2 38 1 . . . . . . . 4.45 1 2 39 1 . . . . . . . 3.63 1 2 40 1 . . . . . . . 4.51 1 2 41 1 . . . . . . . 4.36 1 2 42 1 . . . . . . . 4.18 1 2 43 1 . . . . . . . 3.51 1 2 44 1 . . . . . . . 4.05 1 2 45 1 . . . . . . . 3.76 1 2 46 1 . . . . . . . 3.43 1 2 47 1 . . . . . . . 5.46 1 2 48 1 . . . . . . . 4.41 1 2 49 1 . . . . . . . 3.51 1 2 50 1 . . . . . . . 5.5 1 2 51 1 . . . . . . . 3.8 1 2 52 1 . . . . . . . 3.17 1 2 53 1 . . . . . . . 4.66 1 2 54 1 . . . . . . . 4.32 1 2 55 1 . . . . . . . 4.63 1 2 56 1 . . . . . . . 4.62 1 2 57 1 . . . . . . . 4.62 1 2 58 1 . . . . . . . 4.32 1 2 59 1 . . . . . . . 5.5 1 2 60 1 . . . . . . . 4.05 1 2 61 1 . . . . . . . 3.13 1 2 62 1 . . . . . . . 5.5 1 2 63 1 . . . . . . . 5.5 1 2 64 1 . . . . . . . 3.98 1 2 65 1 . . . . . . . 3.83 1 2 66 1 . . . . . . . 3.24 1 2 67 1 . . . . . . . 4.24 1 2 68 1 . . . . . . . 4.72 1 2 69 1 . . . . . . . 4.94 1 2 70 1 . . . . . . . 4.27 1 2 71 1 . . . . . . . 4.08 1 2 72 1 . . . . . . . 4.06 1 2 73 1 . . . . . . . 3.3 1 2 74 1 . . . . . . . 4.88 1 2 75 1 . . . . . . . 4.52 1 2 76 1 . . . . . . . 4.26 1 2 77 1 . . . . . . . 4.98 1 2 78 1 . . . . . . . 4.83 1 2 79 1 . . . . . . . 2.93 1 2 80 1 . . . . . . . 3.64 1 2 81 1 . . . . . . . 3.64 1 2 82 1 . . . . . . . 4.9 1 2 83 1 . . . . . . . 4.66 1 2 84 1 . . . . . . . 4.23 1 2 85 1 . . . . . . . 2.77 1 2 86 1 . . . . . . . 3.08 1 2 87 1 . . . . . . . 5.5 1 2 88 1 . . . . . . . 5.5 1 2 89 1 . . . . . . . 3.17 1 2 90 1 . . . . . . . 3.7 1 2 91 1 . . . . . . . 3.88 1 2 92 1 . . . . . . . 4.54 1 2 93 1 . . . . . . . 4.62 1 2 94 1 . . . . . . . 5.4 1 2 95 1 . . . . . . . 3.36 1 2 96 1 . . . . . . . 4.89 1 2 97 1 . . . . . . . 5.11 1 2 98 1 . . . . . . . 2.76 1 2 99 1 . . . . . . . 4.03 1 2 100 1 . . . . . . . 3.94 1 2 101 1 . . . . . . . 3.33 1 2 102 1 . . . . . . . 4.33 1 2 103 1 . . . . . . . 4.33 1 2 104 1 . . . . . . . 3.23 1 2 105 1 . . . . . . . 4.94 1 2 106 1 . . . . . . . 5.13 1 2 107 1 . . . . . . . 4.55 1 2 108 1 . . . . . . . 4.25 1 2 109 1 . . . . . . . 5.33 1 2 110 1 . . . . . . . 3.88 1 2 111 1 . . . . . . . 3.64 1 2 112 1 . . . . . . . 3.48 1 2 113 1 . . . . . . . 3.57 1 2 114 1 . . . . . . . 3.27 1 2 115 1 . . . . . . . 4.71 1 2 116 1 . . . . . . . 4.65 1 2 117 1 . . . . . . . 4.6 1 2 118 1 . . . . . . . 4.5 1 2 119 1 . . . . . . . 3.99 1 2 120 1 . . . . . . . 2.97 1 2 121 1 . . . . . . . 3.08 1 2 122 1 . . . . . . . 5.5 1 2 123 1 . . . . . . . 5.41 1 2 124 1 . . . . . . . 3.92 1 2 125 1 . . . . . . . 3.81 1 2 126 1 . . . . . . . 3.56 1 2 127 1 . . . . . . . 5.38 1 2 128 1 . . . . . . . 5.5 1 2 129 1 . . . . . . . 4.82 1 2 130 1 . . . . . . . 3.3 1 2 131 1 . . . . . . . 4.0 1 2 132 1 . . . . . . . 3.91 1 2 133 1 . . . . . . . 3.25 1 2 134 1 . . . . . . . 3.12 1 2 135 1 . . . . . . . 3.76 1 2 136 1 . . . . . . . 5.35 1 2 137 1 . . . . . . . 4.82 1 2 138 1 . . . . . . . 4.18 1 2 139 1 . . . . . . . 4.7 1 2 140 1 . . . . . . . 2.62 1 2 141 1 . . . . . . . 4.13 1 2 142 1 . . . . . . . 2.85 1 2 143 1 . . . . . . . 4.67 1 2 144 1 . . . . . . . 5.45 1 2 145 1 . . . . . . . 3.03 1 2 146 1 . . . . . . . 2.72 1 2 147 1 . . . . . . . 5.0 1 2 148 1 . . . . . . . 4.53 1 2 149 1 . . . . . . . 3.38 1 2 150 1 . . . . . . . 4.99 1 2 151 1 . . . . . . . 4.99 1 2 152 1 . . . . . . . 3.44 1 2 153 1 . . . . . . . 4.47 1 2 154 1 . . . . . . . 4.25 1 2 155 1 . . . . . . . 3.71 1 2 156 1 . . . . . . . 3.71 1 2 157 1 . . . . . . . 4.18 1 2 158 1 . . . . . . . 4.7 1 2 159 1 . . . . . . . 4.66 1 2 160 1 . . . . . . . 4.29 1 2 161 1 . . . . . . . 2.83 1 2 162 1 . . . . . . . 3.88 1 2 163 1 . . . . . . . 4.26 1 2 164 1 . . . . . . . 5.5 1 2 165 1 . . . . . . . 5.5 1 2 166 1 . . . . . . . 3.06 1 2 167 1 . . . . . . . 3.86 1 2 168 1 . . . . . . . 3.14 1 2 169 1 . . . . . . . 4.51 1 2 170 1 . . . . . . . 2.83 1 2 171 1 . . . . . . . 3.5 1 2 172 1 . . . . . . . 4.0 1 2 173 1 . . . . . . . 4.45 1 2 174 1 . . . . . . . 4.23 1 2 175 1 . . . . . . . 4.91 1 2 176 1 . . . . . . . 3.27 1 2 177 1 . . . . . . . 3.79 1 2 178 1 . . . . . . . 3.47 1 2 179 1 . . . . . . . 3.47 1 2 180 1 . . . . . . . 3.67 1 2 181 1 . . . . . . . 5.05 1 2 182 1 . . . . . . . 3.53 1 2 183 1 . . . . . . . 4.83 1 2 184 1 . . . . . . . 5.39 1 2 185 1 . . . . . . . 4.84 1 2 186 1 . . . . . . . 4.23 1 2 187 1 . . . . . . . 4.28 1 2 188 1 . . . . . . . 5.37 1 2 189 1 . . . . . . . 5.5 1 2 190 1 . . . . . . . 4.56 1 2 191 1 . . . . . . . 3.13 1 2 192 1 . . . . . . . 3.19 1 2 193 1 . . . . . . . 3.54 1 2 194 1 . . . . . . . 3.8 1 2 195 1 . . . . . . . 3.03 1 2 196 1 . . . . . . . 4.5 1 2 197 1 . . . . . . . 3.2 1 2 198 1 . . . . . . . 4.56 1 2 199 1 . . . . . . . 4.9 1 2 200 1 . . . . . . . 3.53 1 2 201 1 . . . . . . . 4.09 1 2 202 1 . . . . . . . 4.46 1 2 203 1 . . . . . . . 4.43 1 2 204 1 . . . . . . . 4.34 1 2 205 1 . . . . . . . 3.87 1 2 206 1 . . . . . . . 4.56 1 2 207 1 . . . . . . . 4.56 1 2 208 1 . . . . . . . 4.04 1 2 209 1 . . . . . . . 4.5 1 2 210 1 . . . . . . . 3.31 1 2 211 1 . . . . . . . 3.26 1 2 212 1 . . . . . . . 5.09 1 2 213 1 . . . . . . . 5.35 1 2 214 1 . . . . . . . 3.29 1 2 215 1 . . . . . . . 2.84 1 2 216 1 . . . . . . . 3.09 1 2 217 1 . . . . . . . 4.72 1 2 218 1 . . . . . . . 4.99 1 2 219 1 . . . . . . . 4.99 1 2 220 1 . . . . . . . 4.51 1 2 221 1 . . . . . . . 3.93 1 2 222 1 . . . . . . . 4.72 1 2 223 1 . . . . . . . 4.01 1 2 224 1 . . . . . . . 3.47 1 2 225 1 . . . . . . . 4.53 1 2 226 1 . . . . . . . 3.42 1 2 227 1 . . . . . . . 4.02 1 2 228 1 . . . . . . . 3.48 1 2 229 1 . . . . . . . 4.9 1 2 230 1 . . . . . . . 4.39 1 2 231 1 . . . . . . . 3.28 1 2 232 1 . . . . . . . 5.43 1 2 233 1 . . . . . . . 5.0 1 2 234 1 . . . . . . . 4.82 1 2 235 1 . . . . . . . 5.32 1 2 236 1 . . . . . . . 4.08 1 2 237 1 . . . . . . . 5.5 1 2 238 1 . . . . . . . 5.5 1 2 239 1 . . . . . . . 4.25 1 2 240 1 . . . . . . . 4.99 1 2 241 1 . . . . . . . 4.82 1 2 242 1 . . . . . . . 4.65 1 2 243 1 . . . . . . . 3.45 1 2 244 1 . . . . . . . 5.18 1 2 245 1 . . . . . . . 5.5 1 2 246 1 . . . . . . . 3.66 1 2 247 1 . . . . . . . 4.44 1 2 248 1 . . . . . . . 4.82 1 2 249 1 . . . . . . . 3.93 1 2 250 1 . . . . . . . 4.25 1 2 251 1 . . . . . . . 4.52 1 2 252 1 . . . . . . . 4.73 1 2 253 1 . . . . . . . 4.67 1 2 254 1 . . . . . . . 5.13 1 2 255 1 . . . . . . . 3.94 1 2 256 1 . . . . . . . 4.43 1 2 257 1 . . . . . . . 4.05 1 2 258 1 . . . . . . . 4.92 1 2 259 1 . . . . . . . 5.46 1 2 260 1 . . . . . . . 4.73 1 2 261 1 . . . . . . . 3.73 1 2 262 1 . . . . . . . 3.73 1 2 263 1 . . . . . . . 4.45 1 2 264 1 . . . . . . . 4.63 1 2 265 1 . . . . . . . 4.71 1 2 266 1 . . . . . . . 4.48 1 2 267 1 . . . . . . . 3.85 1 2 268 1 . . . . . . . 4.48 1 2 269 1 . . . . . . . 3.68 1 2 270 1 . . . . . . . 3.68 1 2 271 1 . . . . . . . 4.71 1 2 272 1 . . . . . . . 5.4 1 2 273 1 . . . . . . . 3.51 1 2 274 1 . . . . . . . 4.68 1 2 275 1 . . . . . . . 3.35 1 2 276 1 . . . . . . . 3.45 1 2 277 1 . . . . . . . 3.16 1 2 278 1 . . . . . . . 5.49 1 2 279 1 . . . . . . . 3.0 1 2 280 1 . . . . . . . 3.97 1 2 281 1 . . . . . . . 3.67 1 2 282 1 . . . . . . . 3.19 1 2 283 1 . . . . . . . 4.76 1 2 284 1 . . . . . . . 4.57 1 2 285 1 . . . . . . . 3.94 1 2 286 1 . . . . . . . 4.49 1 2 287 1 . . . . . . . 3.33 1 2 288 1 . . . . . . . 4.12 1 2 289 1 . . . . . . . 4.33 1 2 290 1 . . . . . . . 3.32 1 2 291 1 . . . . . . . 3.74 1 2 292 1 . . . . . . . 5.35 1 2 293 1 . . . . . . . 4.13 1 2 294 1 . . . . . . . 3.41 1 2 295 1 . . . . . . . 4.39 1 2 296 1 . . . . . . . 4.89 1 2 297 1 . . . . . . . 4.25 1 2 298 1 . . . . . . . 3.29 1 2 299 1 . . . . . . . 4.65 1 2 300 1 . . . . . . . 4.79 1 2 301 1 . . . . . . . 3.49 1 2 302 1 . . . . . . . 4.34 1 2 303 1 . . . . . . . 3.36 1 2 304 1 . . . . . . . 4.75 1 2 305 1 . . . . . . . 3.93 1 2 306 1 . . . . . . . 4.79 1 2 307 1 . . . . . . . 4.72 1 2 308 1 . . . . . . . 3.64 1 2 309 1 . . . . . . . 3.8 1 2 310 1 . . . . . . . 4.0 1 2 311 1 . . . . . . . 3.82 1 2 312 1 . . . . . . . 3.58 1 2 313 1 . . . . . . . 4.77 1 2 314 1 . . . . . . . 3.97 1 2 315 1 . . . . . . . 3.36 1 2 316 1 . . . . . . . 3.76 1 2 317 1 . . . . . . . 4.17 1 2 318 1 . . . . . . . 4.33 1 2 319 1 . . . . . . . 4.38 1 2 320 1 . . . . . . . 4.86 1 2 321 1 . . . . . . . 5.3 1 2 322 1 . . . . . . . 4.94 1 2 323 1 . . . . . . . 4.6 1 2 324 1 . . . . . . . 4.87 1 2 325 1 . . . . . . . 4.57 1 2 326 1 . . . . . . . 3.77 1 2 327 1 . . . . . . . 4.77 1 2 328 1 . . . . . . . 4.8 1 2 329 1 . . . . . . . 4.05 1 2 330 1 . . . . . . . 4.64 1 2 331 1 . . . . . . . 4.69 1 2 332 1 . . . . . . . 4.63 1 2 333 1 . . . . . . . 3.6 1 2 334 1 . . . . . . . 3.35 1 2 335 1 . . . . . . . 4.0 1 2 336 1 . . . . . . . 4.06 1 2 337 1 . . . . . . . 4.54 1 2 338 1 . . . . . . . 4.0 1 2 339 1 . . . . . . . 3.73 1 2 340 1 . . . . . . . 3.63 1 2 341 1 . . . . . . . 4.84 1 2 342 1 . . . . . . . 4.77 1 2 343 1 . . . . . . . 4.17 1 2 344 1 . . . . . . . 4.12 1 2 345 1 . . . . . . . 4.4 1 2 346 1 . . . . . . . 4.6 1 2 347 1 . . . . . . . 3.38 1 2 348 1 . . . . . . . 3.86 1 2 349 1 . . . . . . . 3.38 1 2 350 1 . . . . . . . 3.9 1 2 351 1 . . . . . . . 3.9 1 2 352 1 . . . . . . . 4.25 1 2 353 1 . . . . . . . 3.85 1 2 354 1 . . . . . . . 4.21 1 2 355 1 . . . . . . . 4.21 1 2 356 1 . . . . . . . 4.69 1 2 357 1 . . . . . . . 4.99 1 2 358 1 . . . . . . . 4.75 1 2 359 1 . . . . . . . 4.18 1 2 360 1 . . . . . . . 4.31 1 2 361 1 . . . . . . . 4.47 1 2 362 1 . . . . . . . 4.09 1 2 363 1 . . . . . . . 3.2 1 2 364 1 . . . . . . . 4.92 1 2 365 1 . . . . . . . 4.89 1 2 366 1 . . . . . . . 4.13 1 2 367 1 . . . . . . . 4.25 1 2 368 1 . . . . . . . 3.8 1 2 369 1 . . . . . . . 4.66 1 2 370 1 . . . . . . . 4.89 1 2 371 1 . . . . . . . 4.51 1 2 372 1 . . . . . . . 3.41 1 2 373 1 . . . . . . . 3.57 1 2 374 1 . . . . . . . 4.09 1 2 375 1 . . . . . . . 4.24 1 2 376 1 . . . . . . . 4.1 1 2 377 1 . . . . . . . 5.18 1 2 378 1 . . . . . . . 5.33 1 2 379 1 . . . . . . . 5.05 1 2 380 1 . . . . . . . 4.33 1 2 381 1 . . . . . . . 3.75 1 2 382 1 . . . . . . . 3.8 1 2 383 1 . . . . . . . 5.1 1 2 384 1 . . . . . . . 4.4 1 2 385 1 . . . . . . . 4.35 1 2 386 1 . . . . . . . 4.2 1 2 387 1 . . . . . . . 4.92 1 2 388 1 . . . . . . . 4.92 1 2 389 1 . . . . . . . 3.41 1 2 390 1 . . . . . . . 5.12 1 2 391 1 . . . . . . . 4.35 1 2 392 1 . . . . . . . 4.6 1 2 393 1 . . . . . . . 4.74 1 2 394 1 . . . . . . . 4.74 1 2 395 1 . . . . . . . 3.52 1 2 396 1 . . . . . . . 3.81 1 2 397 1 . . . . . . . 4.31 1 2 398 1 . . . . . . . 4.05 1 2 399 1 . . . . . . . 4.63 1 2 400 1 . . . . . . . 4.66 1 2 401 1 . . . . . . . 4.67 1 2 402 1 . . . . . . . 4.51 1 2 403 1 . . . . . . . 3.89 1 2 404 1 . . . . . . . 4.25 1 2 405 1 . . . . . . . 4.11 1 2 406 1 . . . . . . . 4.72 1 2 407 1 . . . . . . . 4.3 1 2 408 1 . . . . . . . 3.76 1 2 409 1 . . . . . . . 4.33 1 2 410 1 . . . . . . . 4.82 1 2 411 1 . . . . . . . 5.19 1 2 412 1 . . . . . . . 4.77 1 2 413 1 . . . . . . . 4.53 1 2 414 1 . . . . . . . 3.44 1 2 415 1 . . . . . . . 3.44 1 2 416 1 . . . . . . . 4.39 1 2 417 1 . . . . . . . 4.63 1 2 418 1 . . . . . . . 2.86 1 2 419 1 . . . . . . . 5.36 1 2 420 1 . . . . . . . 4.51 1 2 421 1 . . . . . . . 4.44 1 2 422 1 . . . . . . . 4.97 1 2 423 1 . . . . . . . 4.26 1 2 424 1 . . . . . . . 4.79 1 2 425 1 . . . . . . . 3.65 1 2 426 1 . . . . . . . 4.87 1 2 427 1 . . . . . . . 4.87 1 2 428 1 . . . . . . . 4.67 1 2 429 1 . . . . . . . 3.66 1 2 430 1 . . . . . . . 4.48 1 2 431 1 . . . . . . . 4.2 1 2 432 1 . . . . . . . 4.6 1 2 433 1 . . . . . . . 3.85 1 2 434 1 . . . . . . . 5.09 1 2 435 1 . . . . . . . 5.29 1 2 436 1 . . . . . . . 5.24 1 2 437 1 . . . . . . . 5.24 1 2 438 1 . . . . . . . 4.3 1 2 439 1 . . . . . . . 4.77 1 2 440 1 . . . . . . . 4.47 1 2 441 1 . . . . . . . 4.31 1 2 442 1 . . . . . . . 5.42 1 2 443 1 . . . . . . . 5.11 1 2 444 1 . . . . . . . 5.11 1 2 445 1 . . . . . . . 4.67 1 2 446 1 . . . . . . . 5.5 1 2 447 1 . . . . . . . 3.63 1 2 448 1 . . . . . . . 4.53 1 2 449 1 . . . . . . . 4.97 1 2 450 1 . . . . . . . 3.63 1 2 451 1 . . . . . . . 4.22 1 2 452 1 . . . . . . . 3.6 1 2 453 1 . . . . . . . 3.66 1 2 454 1 . . . . . . . 4.05 1 2 455 1 . . . . . . . 4.88 1 2 456 1 . . . . . . . 3.24 1 2 457 1 . . . . . . . 3.64 1 2 458 1 . . . . . . . 3.71 1 2 459 1 . . . . . . . 4.59 1 2 460 1 . . . . . . . 5.34 1 2 461 1 . . . . . . . 3.75 1 2 462 1 . . . . . . . 3.53 1 2 463 1 . . . . . . . 4.47 1 2 464 1 . . . . . . . 3.81 1 2 465 1 . . . . . . . 3.96 1 2 466 1 . . . . . . . 4.63 1 2 467 1 . . . . . . . 4.21 1 2 468 1 . . . . . . . 4.68 1 2 469 1 . . . . . . . 5.34 1 2 470 1 . . . . . . . 3.38 1 2 471 1 . . . . . . . 3.74 1 2 472 1 . . . . . . . 4.57 1 2 473 1 . . . . . . . 4.12 1 2 474 1 . . . . . . . 4.69 1 2 475 1 . . . . . . . 4.78 1 2 476 1 . . . . . . . 5.34 1 2 477 1 . . . . . . . 4.75 1 2 478 1 . . . . . . . 4.72 1 2 479 1 . . . . . . . 4.43 1 2 480 1 . . . . . . . 4.16 1 2 481 1 . . . . . . . 3.59 1 2 482 1 . . . . . . . 3.68 1 2 483 1 . . . . . . . 3.37 1 2 484 1 . . . . . . . 3.16 1 2 485 1 . . . . . . . 4.78 1 2 486 1 . . . . . . . 2.85 1 2 487 1 . . . . . . . 4.27 1 2 488 1 . . . . . . . 3.35 1 2 489 1 . . . . . . . 4.86 1 2 490 1 . . . . . . . 3.46 1 2 491 1 . . . . . . . 4.7 1 2 492 1 . . . . . . . 4.05 1 2 493 1 . . . . . . . 4.91 1 2 494 1 . . . . . . . 3.82 1 2 495 1 . . . . . . . 4.71 1 2 496 1 . . . . . . . 3.83 1 2 497 1 . . . . . . . 3.6 1 2 498 1 . . . . . . . 3.66 1 2 499 1 . . . . . . . 5.06 1 2 500 1 . . . . . . . 3.84 1 2 501 1 . . . . . . . 3.23 1 2 502 1 . . . . . . . 4.33 1 2 503 1 . . . . . . . 5.34 1 2 504 1 . . . . . . . 4.15 1 2 505 1 . . . . . . . 4.88 1 2 506 1 . . . . . . . 3.85 1 2 507 1 . . . . . . . 4.27 1 2 508 1 . . . . . . . 3.66 1 2 509 1 . . . . . . . 5.34 1 2 510 1 . . . . . . . 5.34 1 2 511 1 . . . . . . . 5.03 1 2 512 1 . . . . . . . 5.34 1 2 513 1 . . . . . . . 3.02 1 2 514 1 . . . . . . . 3.78 1 2 515 1 . . . . . . . 4.5 1 2 516 1 . . . . . . . 3.04 1 2 517 1 . . . . . . . 5.31 1 2 518 1 . . . . . . . 3.41 1 2 519 1 . . . . . . . 3.44 1 2 520 1 . . . . . . . 4.54 1 2 521 1 . . . . . . . 4.14 1 2 522 1 . . . . . . . 3.5 1 2 523 1 . . . . . . . 2.99 1 2 524 1 . . . . . . . 3.98 1 2 stop_ save_ save_DYANA/DIANA_dihedral_4 _Torsion_angle_constraint_list.Sf_category torsion_angle_constraints _Torsion_angle_constraint_list.Entry_ID 1 _Torsion_angle_constraint_list.ID 1 _Torsion_angle_constraint_list.Constraint_file_ID . _Torsion_angle_constraint_list.Block_ID . loop_ _Torsion_angle_constraint.ID _Torsion_angle_constraint.Torsion_angle_name _Torsion_angle_constraint.Entity_assembly_ID_1 _Torsion_angle_constraint.Entity_ID_1 _Torsion_angle_constraint.Comp_index_ID_1 _Torsion_angle_constraint.Comp_ID_1 _Torsion_angle_constraint.Atom_ID_1 _Torsion_angle_constraint.Entity_assembly_ID_2 _Torsion_angle_constraint.Entity_ID_2 _Torsion_angle_constraint.Comp_index_ID_2 _Torsion_angle_constraint.Comp_ID_2 _Torsion_angle_constraint.Atom_ID_2 _Torsion_angle_constraint.Entity_assembly_ID_3 _Torsion_angle_constraint.Entity_ID_3 _Torsion_angle_constraint.Comp_index_ID_3 _Torsion_angle_constraint.Comp_ID_3 _Torsion_angle_constraint.Atom_ID_3 _Torsion_angle_constraint.Entity_assembly_ID_4 _Torsion_angle_constraint.Entity_ID_4 _Torsion_angle_constraint.Comp_index_ID_4 _Torsion_angle_constraint.Comp_ID_4 _Torsion_angle_constraint.Atom_ID_4 _Torsion_angle_constraint.Angle_lower_bound_val _Torsion_angle_constraint.Angle_upper_bound_val _Torsion_angle_constraint.Auth_asym_ID_1 _Torsion_angle_constraint.Auth_seq_ID_1 _Torsion_angle_constraint.Auth_comp_ID_1 _Torsion_angle_constraint.Auth_atom_ID_1 _Torsion_angle_constraint.Auth_asym_ID_2 _Torsion_angle_constraint.Auth_seq_ID_2 _Torsion_angle_constraint.Auth_comp_ID_2 _Torsion_angle_constraint.Auth_atom_ID_2 _Torsion_angle_constraint.Auth_asym_ID_3 _Torsion_angle_constraint.Auth_seq_ID_3 _Torsion_angle_constraint.Auth_comp_ID_3 _Torsion_angle_constraint.Auth_atom_ID_3 _Torsion_angle_constraint.Auth_asym_ID_4 _Torsion_angle_constraint.Auth_seq_ID_4 _Torsion_angle_constraint.Auth_comp_ID_4 _Torsion_angle_constraint.Auth_atom_ID_4 _Torsion_angle_constraint.Entry_ID _Torsion_angle_constraint.Torsion_angle_constraint_list_ID 1 CHI1 1 1 18 CYS N 1 1 18 CYS CA 1 1 18 CYS CB 1 1 18 CYS SG 30.0 89.99999 . 18 CYSS . . 18 CYSS . . 18 CYSS . . 18 CYSS . 1 1 stop_ save_ save_conformer_family_coord_set_1 _Conformer_family_coord_set.Sf_category conformer_family_coord_set _Conformer_family_coord_set.Entry_ID 1 _Conformer_family_coord_set.ID 1 loop_ _Atom_site.Model_ID _Atom_site.ID _Atom_site.Label_entity_assembly_ID _Atom_site.Label_entity_ID _Atom_site.Label_comp_index_ID _Atom_site.Label_comp_ID _Atom_site.Label_atom_ID _Atom_site.Type_symbol _Atom_site.Cartn_x _Atom_site.Cartn_y _Atom_site.Cartn_z _Atom_site.Occupancy _Atom_site.Uncertainty _Atom_site.PDBX_label_asym_ID _Atom_site.PDB_strand_ID _Atom_site.PDB_ins_code _Atom_site.PDB_residue_no _Atom_site.PDB_residue_name _Atom_site.PDB_atom_name _Atom_site.Entry_ID _Atom_site.Conformer_family_coord_set_ID 1 1 1 1 1 GLY C C -20.572 3.855 -13.601 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -21.326 5.150 -13.374 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -21.587 5.149 -11.273 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY HA2 H -22.017 5.301 -14.191 1.00 . A A . 1 GLY HA2 1 1 1 5 1 1 1 GLY HA3 H -20.619 5.967 -13.359 1.00 . A A . 1 GLY HA3 1 1 1 6 1 1 1 GLY N N -22.068 5.149 -12.127 1.00 . A A . 1 GLY N 1 1 1 7 1 1 1 GLY O O -20.561 2.976 -12.740 1.00 . A A . 1 GLY O 1 1 1 8 1 1 2 SER C C -17.781 2.592 -14.511 1.00 . A A . 2 SER C 1 1 1 9 1 1 2 SER CA C -19.185 2.536 -15.105 1.00 . A A . 2 SER CA 1 1 1 10 1 1 2 SER CB C -19.102 2.374 -16.624 1.00 . A A . 2 SER CB 1 1 1 11 1 1 2 SER H H -19.987 4.472 -15.411 1.00 . A A . 2 SER H 1 1 1 12 1 1 2 SER HA H -19.707 1.687 -14.689 1.00 . A A . 2 SER HA 1 1 1 13 1 1 2 SER HB2 H -18.629 1.432 -16.858 1.00 . A A . 2 SER HB2 1 1 1 14 1 1 2 SER HB3 H -20.099 2.389 -17.040 1.00 . A A . 2 SER HB3 1 1 1 15 1 1 2 SER HG H -17.730 3.770 -16.562 1.00 . A A . 2 SER HG 1 1 1 16 1 1 2 SER N N -19.941 3.736 -14.765 1.00 . A A . 2 SER N 1 1 1 17 1 1 2 SER O O -16.800 2.265 -15.178 1.00 . A A . 2 SER O 1 1 1 18 1 1 2 SER OG O -18.347 3.421 -17.209 1.00 . A A . 2 SER OG 1 1 1 19 1 1 3 SER C C -15.980 1.755 -12.016 1.00 . A A . 3 SER C 1 1 1 20 1 1 3 SER CA C -16.412 3.111 -12.567 1.00 . A A . 3 SER CA 1 1 1 21 1 1 3 SER CB C -16.496 4.132 -11.431 1.00 . A A . 3 SER CB 1 1 1 22 1 1 3 SER H H -18.514 3.254 -12.772 1.00 . A A . 3 SER H 1 1 1 23 1 1 3 SER HA H -15.678 3.444 -13.285 1.00 . A A . 3 SER HA 1 1 1 24 1 1 3 SER HB2 H -17.399 3.962 -10.864 1.00 . A A . 3 SER HB2 1 1 1 25 1 1 3 SER HB3 H -15.638 4.019 -10.784 1.00 . A A . 3 SER HB3 1 1 1 26 1 1 3 SER HG H -16.019 5.494 -12.756 1.00 . A A . 3 SER HG 1 1 1 27 1 1 3 SER N N -17.695 3.008 -13.251 1.00 . A A . 3 SER N 1 1 1 28 1 1 3 SER O O -16.754 0.799 -12.013 1.00 . A A . 3 SER O 1 1 1 29 1 1 3 SER OG O -16.516 5.456 -11.936 1.00 . A A . 3 SER OG 1 1 1 30 1 1 4 GLY C C -12.707 0.414 -10.948 1.00 . A A . 4 GLY C 1 1 1 31 1 1 4 GLY CA C -14.222 0.439 -11.003 1.00 . A A . 4 GLY CA 1 1 1 32 1 1 4 GLY H H -14.164 2.476 -11.578 1.00 . A A . 4 GLY H 1 1 1 33 1 1 4 GLY HA2 H -14.610 0.310 -10.004 1.00 . A A . 4 GLY HA2 1 1 1 34 1 1 4 GLY HA3 H -14.562 -0.380 -11.619 1.00 . A A . 4 GLY HA3 1 1 1 35 1 1 4 GLY N N -14.737 1.681 -11.550 1.00 . A A . 4 GLY N 1 1 1 36 1 1 4 GLY O O -12.039 1.022 -11.783 1.00 . A A . 4 GLY O 1 1 1 37 1 1 5 SER C C -10.150 -1.518 -10.651 1.00 . A A . 5 SER C 1 1 1 38 1 1 5 SER CA C -10.719 -0.389 -9.796 1.00 . A A . 5 SER CA 1 1 1 39 1 1 5 SER CB C -10.366 -0.620 -8.326 1.00 . A A . 5 SER CB 1 1 1 40 1 1 5 SER H H -12.751 -0.755 -9.326 1.00 . A A . 5 SER H 1 1 1 41 1 1 5 SER HA H -10.284 0.545 -10.120 1.00 . A A . 5 SER HA 1 1 1 42 1 1 5 SER HB2 H -10.747 -1.580 -8.013 1.00 . A A . 5 SER HB2 1 1 1 43 1 1 5 SER HB3 H -9.292 -0.603 -8.210 1.00 . A A . 5 SER HB3 1 1 1 44 1 1 5 SER HG H -11.739 0.056 -7.104 1.00 . A A . 5 SER HG 1 1 1 45 1 1 5 SER N N -12.164 -0.291 -9.961 1.00 . A A . 5 SER N 1 1 1 46 1 1 5 SER O O -9.236 -1.308 -11.448 1.00 . A A . 5 SER O 1 1 1 47 1 1 5 SER OG O -10.930 0.385 -7.502 1.00 . A A . 5 SER OG 1 1 1 48 1 1 6 SER C C -10.090 -3.545 -12.710 1.00 . A A . 6 SER C 1 1 1 49 1 1 6 SER CA C -10.244 -3.881 -11.230 1.00 . A A . 6 SER CA 1 1 1 50 1 1 6 SER CB C -11.227 -5.040 -11.058 1.00 . A A . 6 SER CB 1 1 1 51 1 1 6 SER H H -11.424 -2.820 -9.827 1.00 . A A . 6 SER H 1 1 1 52 1 1 6 SER HA H -9.282 -4.174 -10.837 1.00 . A A . 6 SER HA 1 1 1 53 1 1 6 SER HB2 H -11.446 -5.171 -10.009 1.00 . A A . 6 SER HB2 1 1 1 54 1 1 6 SER HB3 H -12.140 -4.817 -11.591 1.00 . A A . 6 SER HB3 1 1 1 55 1 1 6 SER HG H -9.731 -6.240 -11.457 1.00 . A A . 6 SER HG 1 1 1 56 1 1 6 SER N N -10.699 -2.716 -10.478 1.00 . A A . 6 SER N 1 1 1 57 1 1 6 SER O O -11.055 -3.179 -13.379 1.00 . A A . 6 SER O 1 1 1 58 1 1 6 SER OG O -10.685 -6.247 -11.565 1.00 . A A . 6 SER OG 1 1 1 59 1 1 7 GLY C C -7.125 -3.294 -14.921 1.00 . A A . 7 GLY C 1 1 1 60 1 1 7 GLY CA C -8.607 -3.379 -14.612 1.00 . A A . 7 GLY CA 1 1 1 61 1 1 7 GLY H H -8.135 -3.968 -12.634 1.00 . A A . 7 GLY H 1 1 1 62 1 1 7 GLY HA2 H -9.046 -4.156 -15.220 1.00 . A A . 7 GLY HA2 1 1 1 63 1 1 7 GLY HA3 H -9.069 -2.436 -14.862 1.00 . A A . 7 GLY HA3 1 1 1 64 1 1 7 GLY N N -8.867 -3.673 -13.215 1.00 . A A . 7 GLY N 1 1 1 65 1 1 7 GLY O O -6.478 -4.308 -15.187 1.00 . A A . 7 GLY O 1 1 1 66 1 1 8 THR C C -4.320 -3.002 -14.611 1.00 . A A . 8 THR C 1 1 1 67 1 1 8 THR CA C -5.170 -1.866 -15.168 1.00 . A A . 8 THR CA 1 1 1 68 1 1 8 THR CB C -4.675 -0.533 -14.576 1.00 . A A . 8 THR CB 1 1 1 69 1 1 8 THR CG2 C -4.855 -0.512 -13.065 1.00 . A A . 8 THR CG2 1 1 1 70 1 1 8 THR H H -7.151 -1.311 -14.668 1.00 . A A . 8 THR H 1 1 1 71 1 1 8 THR HA H -5.045 -1.828 -16.240 1.00 . A A . 8 THR HA 1 1 1 72 1 1 8 THR HB H -5.257 0.272 -15.004 1.00 . A A . 8 THR HB 1 1 1 73 1 1 8 THR HG1 H -2.870 -1.187 -15.025 1.00 . A A . 8 THR HG1 1 1 1 74 1 1 8 THR HG21 H -5.881 -0.742 -12.822 1.00 . A A . 8 THR HG21 1 1 1 75 1 1 8 THR HG22 H -4.608 0.469 -12.687 1.00 . A A . 8 THR HG22 1 1 1 76 1 1 8 THR HG23 H -4.204 -1.246 -12.615 1.00 . A A . 8 THR HG23 1 1 1 77 1 1 8 THR N N -6.584 -2.080 -14.887 1.00 . A A . 8 THR N 1 1 1 78 1 1 8 THR O O -3.380 -3.462 -15.258 1.00 . A A . 8 THR O 1 1 1 79 1 1 8 THR OG1 O -3.295 -0.335 -14.899 1.00 . A A . 8 THR OG1 1 1 1 80 1 1 9 GLY C C -4.702 -5.218 -11.684 1.00 . A A . 9 GLY C 1 1 1 81 1 1 9 GLY CA C -3.915 -4.532 -12.783 1.00 . A A . 9 GLY CA 1 1 1 82 1 1 9 GLY H H -5.416 -3.047 -12.936 1.00 . A A . 9 GLY H 1 1 1 83 1 1 9 GLY HA2 H -3.660 -5.261 -13.537 1.00 . A A . 9 GLY HA2 1 1 1 84 1 1 9 GLY HA3 H -3.005 -4.132 -12.361 1.00 . A A . 9 GLY HA3 1 1 1 85 1 1 9 GLY N N -4.657 -3.452 -13.406 1.00 . A A . 9 GLY N 1 1 1 86 1 1 9 GLY O O -5.461 -4.573 -10.961 1.00 . A A . 9 GLY O 1 1 1 87 1 1 10 GLU C C -4.265 -7.758 -9.446 1.00 . A A . 10 GLU C 1 1 1 88 1 1 10 GLU CA C -5.224 -7.302 -10.541 1.00 . A A . 10 GLU CA 1 1 1 89 1 1 10 GLU CB C -5.907 -8.517 -11.173 1.00 . A A . 10 GLU CB 1 1 1 90 1 1 10 GLU CD C -8.195 -9.399 -11.782 1.00 . A A . 10 GLU CD 1 1 1 91 1 1 10 GLU CG C -7.262 -8.203 -11.786 1.00 . A A . 10 GLU CG 1 1 1 92 1 1 10 GLU H H -3.904 -6.987 -12.166 1.00 . A A . 10 GLU H 1 1 1 93 1 1 10 GLU HA H -5.977 -6.666 -10.102 1.00 . A A . 10 GLU HA 1 1 1 94 1 1 10 GLU HB2 H -5.267 -8.913 -11.948 1.00 . A A . 10 GLU HB2 1 1 1 95 1 1 10 GLU HB3 H -6.046 -9.272 -10.413 1.00 . A A . 10 GLU HB3 1 1 1 96 1 1 10 GLU HG2 H -7.722 -7.406 -11.222 1.00 . A A . 10 GLU HG2 1 1 1 97 1 1 10 GLU HG3 H -7.115 -7.883 -12.807 1.00 . A A . 10 GLU HG3 1 1 1 98 1 1 10 GLU N N -4.522 -6.529 -11.559 1.00 . A A . 10 GLU N 1 1 1 99 1 1 10 GLU O O -3.713 -8.857 -9.504 1.00 . A A . 10 GLU O 1 1 1 100 1 1 10 GLU OE1 O -7.693 -10.542 -11.800 1.00 . A A . 10 GLU OE1 1 1 1 101 1 1 10 GLU OE2 O -9.426 -9.191 -11.761 1.00 . A A . 10 GLU OE2 1 1 1 102 1 1 11 LYS C C -3.970 -7.653 -6.108 1.00 . A A . 11 LYS C 1 1 1 103 1 1 11 LYS CA C -3.178 -7.216 -7.336 1.00 . A A . 11 LYS CA 1 1 1 104 1 1 11 LYS CB C -2.313 -6.001 -6.992 1.00 . A A . 11 LYS CB 1 1 1 105 1 1 11 LYS CD C -1.230 -5.781 -9.248 1.00 . A A . 11 LYS CD 1 1 1 106 1 1 11 LYS CE C 0.078 -5.555 -9.991 1.00 . A A . 11 LYS CE 1 1 1 107 1 1 11 LYS CG C -1.001 -5.953 -7.756 1.00 . A A . 11 LYS CG 1 1 1 108 1 1 11 LYS H H -4.538 -6.042 -8.456 1.00 . A A . 11 LYS H 1 1 1 109 1 1 11 LYS HA H -2.537 -8.028 -7.643 1.00 . A A . 11 LYS HA 1 1 1 110 1 1 11 LYS HB2 H -2.869 -5.103 -7.217 1.00 . A A . 11 LYS HB2 1 1 1 111 1 1 11 LYS HB3 H -2.089 -6.021 -5.935 1.00 . A A . 11 LYS HB3 1 1 1 112 1 1 11 LYS HD2 H -1.702 -6.672 -9.636 1.00 . A A . 11 LYS HD2 1 1 1 113 1 1 11 LYS HD3 H -1.877 -4.930 -9.408 1.00 . A A . 11 LYS HD3 1 1 1 114 1 1 11 LYS HE2 H 0.680 -4.857 -9.429 1.00 . A A . 11 LYS HE2 1 1 1 115 1 1 11 LYS HE3 H 0.599 -6.498 -10.070 1.00 . A A . 11 LYS HE3 1 1 1 116 1 1 11 LYS HG2 H -0.414 -5.121 -7.395 1.00 . A A . 11 LYS HG2 1 1 1 117 1 1 11 LYS HG3 H -0.463 -6.875 -7.587 1.00 . A A . 11 LYS HG3 1 1 1 118 1 1 11 LYS HZ1 H -1.040 -4.478 -11.388 1.00 . A A . 11 LYS HZ1 1 1 1 119 1 1 11 LYS HZ2 H -0.195 -5.786 -12.048 1.00 . A A . 11 LYS HZ2 1 1 1 120 1 1 11 LYS HZ3 H 0.632 -4.374 -11.622 1.00 . A A . 11 LYS HZ3 1 1 1 121 1 1 11 LYS N N -4.069 -6.904 -8.446 1.00 . A A . 11 LYS N 1 1 1 122 1 1 11 LYS NZ N -0.147 -5.010 -11.358 1.00 . A A . 11 LYS NZ 1 1 1 123 1 1 11 LYS O O -5.082 -7.186 -5.858 1.00 . A A . 11 LYS O 1 1 1 124 1 1 12 PRO C C -4.093 -8.040 -2.998 1.00 . A A . 12 PRO C 1 1 1 125 1 1 12 PRO CA C -4.020 -9.086 -4.104 1.00 . A A . 12 PRO CA 1 1 1 126 1 1 12 PRO CB C -3.102 -10.239 -3.690 1.00 . A A . 12 PRO CB 1 1 1 127 1 1 12 PRO CD C -2.063 -9.169 -5.557 1.00 . A A . 12 PRO CD 1 1 1 128 1 1 12 PRO CG C -1.775 -9.895 -4.272 1.00 . A A . 12 PRO CG 1 1 1 129 1 1 12 PRO HA H -5.011 -9.467 -4.305 1.00 . A A . 12 PRO HA 1 1 1 130 1 1 12 PRO HB2 H -3.058 -10.297 -2.611 1.00 . A A . 12 PRO HB2 1 1 1 131 1 1 12 PRO HB3 H -3.481 -11.168 -4.091 1.00 . A A . 12 PRO HB3 1 1 1 132 1 1 12 PRO HD2 H -1.319 -8.406 -5.734 1.00 . A A . 12 PRO HD2 1 1 1 133 1 1 12 PRO HD3 H -2.097 -9.863 -6.384 1.00 . A A . 12 PRO HD3 1 1 1 134 1 1 12 PRO HG2 H -1.231 -9.257 -3.594 1.00 . A A . 12 PRO HG2 1 1 1 135 1 1 12 PRO HG3 H -1.216 -10.798 -4.470 1.00 . A A . 12 PRO HG3 1 1 1 136 1 1 12 PRO N N -3.386 -8.569 -5.321 1.00 . A A . 12 PRO N 1 1 1 137 1 1 12 PRO O O -5.067 -7.983 -2.247 1.00 . A A . 12 PRO O 1 1 1 138 1 1 13 TYR C C -3.370 -4.811 -2.481 1.00 . A A . 13 TYR C 1 1 1 139 1 1 13 TYR CA C -3.005 -6.168 -1.888 1.00 . A A . 13 TYR CA 1 1 1 140 1 1 13 TYR CB C -1.610 -6.105 -1.264 1.00 . A A . 13 TYR CB 1 1 1 141 1 1 13 TYR CD1 C -1.435 -7.836 0.567 1.00 . A A . 13 TYR CD1 1 1 1 142 1 1 13 TYR CD2 C -0.360 -8.286 -1.513 1.00 . A A . 13 TYR CD2 1 1 1 143 1 1 13 TYR CE1 C -0.995 -9.048 1.062 1.00 . A A . 13 TYR CE1 1 1 1 144 1 1 13 TYR CE2 C 0.083 -9.500 -1.027 1.00 . A A . 13 TYR CE2 1 1 1 145 1 1 13 TYR CG C -1.126 -7.433 -0.727 1.00 . A A . 13 TYR CG 1 1 1 146 1 1 13 TYR CZ C -0.237 -9.877 0.261 1.00 . A A . 13 TYR CZ 1 1 1 147 1 1 13 TYR H H -2.312 -7.306 -3.531 1.00 . A A . 13 TYR H 1 1 1 148 1 1 13 TYR HA H -3.722 -6.416 -1.119 1.00 . A A . 13 TYR HA 1 1 1 149 1 1 13 TYR HB2 H -0.904 -5.773 -2.009 1.00 . A A . 13 TYR HB2 1 1 1 150 1 1 13 TYR HB3 H -1.621 -5.400 -0.445 1.00 . A A . 13 TYR HB3 1 1 1 151 1 1 13 TYR HD1 H -2.029 -7.185 1.192 1.00 . A A . 13 TYR HD1 1 1 1 152 1 1 13 TYR HD2 H -0.112 -7.987 -2.521 1.00 . A A . 13 TYR HD2 1 1 1 153 1 1 13 TYR HE1 H -1.245 -9.344 2.070 1.00 . A A . 13 TYR HE1 1 1 1 154 1 1 13 TYR HE2 H 0.677 -10.149 -1.653 1.00 . A A . 13 TYR HE2 1 1 1 155 1 1 13 TYR HH H -0.547 -11.599 1.057 1.00 . A A . 13 TYR HH 1 1 1 156 1 1 13 TYR N N -3.059 -7.212 -2.904 1.00 . A A . 13 TYR N 1 1 1 157 1 1 13 TYR O O -3.268 -4.602 -3.690 1.00 . A A . 13 TYR O 1 1 1 158 1 1 13 TYR OH O 0.204 -11.086 0.750 1.00 . A A . 13 TYR OH 1 1 1 159 1 1 14 ARG C C -3.991 -1.540 -0.934 1.00 . A A . 14 ARG C 1 1 1 160 1 1 14 ARG CA C -4.177 -2.554 -2.059 1.00 . A A . 14 ARG CA 1 1 1 161 1 1 14 ARG CB C -5.632 -2.545 -2.533 1.00 . A A . 14 ARG CB 1 1 1 162 1 1 14 ARG CD C -5.775 -1.051 -4.549 1.00 . A A . 14 ARG CD 1 1 1 163 1 1 14 ARG CG C -6.089 -1.198 -3.068 1.00 . A A . 14 ARG CG 1 1 1 164 1 1 14 ARG CZ C -6.415 0.381 -6.442 1.00 . A A . 14 ARG CZ 1 1 1 165 1 1 14 ARG H H -3.856 -4.118 -0.670 1.00 . A A . 14 ARG H 1 1 1 166 1 1 14 ARG HA H -3.538 -2.280 -2.884 1.00 . A A . 14 ARG HA 1 1 1 167 1 1 14 ARG HB2 H -5.748 -3.278 -3.318 1.00 . A A . 14 ARG HB2 1 1 1 168 1 1 14 ARG HB3 H -6.269 -2.813 -1.704 1.00 . A A . 14 ARG HB3 1 1 1 169 1 1 14 ARG HD2 H -4.718 -0.861 -4.661 1.00 . A A . 14 ARG HD2 1 1 1 170 1 1 14 ARG HD3 H -6.029 -1.973 -5.050 1.00 . A A . 14 ARG HD3 1 1 1 171 1 1 14 ARG HE H -7.131 0.554 -4.589 1.00 . A A . 14 ARG HE 1 1 1 172 1 1 14 ARG HG2 H -7.157 -1.109 -2.928 1.00 . A A . 14 ARG HG2 1 1 1 173 1 1 14 ARG HG3 H -5.586 -0.414 -2.522 1.00 . A A . 14 ARG HG3 1 1 1 174 1 1 14 ARG HH11 H -5.060 -1.052 -6.880 1.00 . A A . 14 ARG HH11 1 1 1 175 1 1 14 ARG HH12 H -5.520 -0.036 -8.206 1.00 . A A . 14 ARG HH12 1 1 1 176 1 1 14 ARG HH21 H -7.745 1.898 -6.326 1.00 . A A . 14 ARG HH21 1 1 1 177 1 1 14 ARG HH22 H -7.047 1.642 -7.889 1.00 . A A . 14 ARG HH22 1 1 1 178 1 1 14 ARG N N -3.796 -3.891 -1.621 1.00 . A A . 14 ARG N 1 1 1 179 1 1 14 ARG NE N -6.521 0.044 -5.161 1.00 . A A . 14 ARG NE 1 1 1 180 1 1 14 ARG NH1 N -5.597 -0.291 -7.241 1.00 . A A . 14 ARG NH1 1 1 1 181 1 1 14 ARG NH2 N -7.128 1.390 -6.926 1.00 . A A . 14 ARG NH2 1 1 1 182 1 1 14 ARG O O -4.272 -1.828 0.229 1.00 . A A . 14 ARG O 1 1 1 183 1 1 15 CYS C C -4.575 1.481 -0.042 1.00 . A A . 15 CYS C 1 1 1 184 1 1 15 CYS CA C -3.289 0.706 -0.311 1.00 . A A . 15 CYS CA 1 1 1 185 1 1 15 CYS CB C -2.199 1.660 -0.803 1.00 . A A . 15 CYS CB 1 1 1 186 1 1 15 CYS H H -3.309 -0.181 -2.233 1.00 . A A . 15 CYS H 1 1 1 187 1 1 15 CYS HA H -2.963 0.244 0.608 1.00 . A A . 15 CYS HA 1 1 1 188 1 1 15 CYS HB2 H -1.462 1.098 -1.358 1.00 . A A . 15 CYS HB2 1 1 1 189 1 1 15 CYS HB3 H -2.644 2.399 -1.452 1.00 . A A . 15 CYS HB3 1 1 1 190 1 1 15 CYS N N -3.514 -0.351 -1.289 1.00 . A A . 15 CYS N 1 1 1 191 1 1 15 CYS O O -5.068 2.205 -0.906 1.00 . A A . 15 CYS O 1 1 1 192 1 1 15 CYS SG S -1.328 2.545 0.531 1.00 . A A . 15 CYS SG 1 1 1 193 1 1 16 ALA C C -6.097 3.503 1.742 1.00 . A A . 16 ALA C 1 1 1 194 1 1 16 ALA CA C -6.341 2.010 1.548 1.00 . A A . 16 ALA CA 1 1 1 195 1 1 16 ALA CB C -6.912 1.397 2.818 1.00 . A A . 16 ALA CB 1 1 1 196 1 1 16 ALA H H -4.674 0.733 1.809 1.00 . A A . 16 ALA H 1 1 1 197 1 1 16 ALA HA H -7.062 1.873 0.755 1.00 . A A . 16 ALA HA 1 1 1 198 1 1 16 ALA HB1 H -6.467 0.427 2.981 1.00 . A A . 16 ALA HB1 1 1 1 199 1 1 16 ALA HB2 H -6.693 2.040 3.657 1.00 . A A . 16 ALA HB2 1 1 1 200 1 1 16 ALA HB3 H -7.982 1.290 2.715 1.00 . A A . 16 ALA HB3 1 1 1 201 1 1 16 ALA N N -5.113 1.323 1.163 1.00 . A A . 16 ALA N 1 1 1 202 1 1 16 ALA O O -7.026 4.262 2.013 1.00 . A A . 16 ALA O 1 1 1 203 1 1 17 GLU C C -4.624 6.074 0.446 1.00 . A A . 17 GLU C 1 1 1 204 1 1 17 GLU CA C -4.477 5.318 1.763 1.00 . A A . 17 GLU CA 1 1 1 205 1 1 17 GLU CB C -3.040 5.439 2.275 1.00 . A A . 17 GLU CB 1 1 1 206 1 1 17 GLU CD C -3.739 6.053 4.623 1.00 . A A . 17 GLU CD 1 1 1 207 1 1 17 GLU CG C -2.894 5.139 3.757 1.00 . A A . 17 GLU CG 1 1 1 208 1 1 17 GLU H H -4.144 3.262 1.384 1.00 . A A . 17 GLU H 1 1 1 209 1 1 17 GLU HA H -5.146 5.753 2.491 1.00 . A A . 17 GLU HA 1 1 1 210 1 1 17 GLU HB2 H -2.416 4.750 1.726 1.00 . A A . 17 GLU HB2 1 1 1 211 1 1 17 GLU HB3 H -2.691 6.446 2.097 1.00 . A A . 17 GLU HB3 1 1 1 212 1 1 17 GLU HG2 H -3.197 4.118 3.936 1.00 . A A . 17 GLU HG2 1 1 1 213 1 1 17 GLU HG3 H -1.858 5.260 4.036 1.00 . A A . 17 GLU HG3 1 1 1 214 1 1 17 GLU N N -4.841 3.916 1.601 1.00 . A A . 17 GLU N 1 1 1 215 1 1 17 GLU O O -5.369 7.052 0.358 1.00 . A A . 17 GLU O 1 1 1 216 1 1 17 GLU OE1 O -3.463 7.270 4.648 1.00 . A A . 17 GLU OE1 1 1 1 217 1 1 17 GLU OE2 O -4.678 5.549 5.276 1.00 . A A . 17 GLU OE2 1 1 1 218 1 1 18 CYS C C -4.735 5.384 -2.879 1.00 . A A . 18 CYS C 1 1 1 219 1 1 18 CYS CA C -3.959 6.247 -1.889 1.00 . A A . 18 CYS CA 1 1 1 220 1 1 18 CYS CB C -2.543 6.495 -2.412 1.00 . A A . 18 CYS CB 1 1 1 221 1 1 18 CYS H H -3.334 4.832 -0.444 1.00 . A A . 18 CYS H 1 1 1 222 1 1 18 CYS HA H -4.465 7.195 -1.783 1.00 . A A . 18 CYS HA 1 1 1 223 1 1 18 CYS HB2 H -2.602 6.901 -3.412 1.00 . A A . 18 CYS HB2 1 1 1 224 1 1 18 CYS HB3 H -2.049 7.207 -1.769 1.00 . A A . 18 CYS HB3 1 1 1 225 1 1 18 CYS N N -3.910 5.616 -0.576 1.00 . A A . 18 CYS N 1 1 1 226 1 1 18 CYS O O -5.615 5.872 -3.587 1.00 . A A . 18 CYS O 1 1 1 227 1 1 18 CYS SG S -1.505 4.999 -2.485 1.00 . A A . 18 CYS SG 1 1 1 228 1 1 19 GLY C C -4.119 2.497 -4.779 1.00 . A A . 19 GLY C 1 1 1 229 1 1 19 GLY CA C -5.078 3.187 -3.828 1.00 . A A . 19 GLY CA 1 1 1 230 1 1 19 GLY H H -3.693 3.764 -2.334 1.00 . A A . 19 GLY H 1 1 1 231 1 1 19 GLY HA2 H -5.595 2.437 -3.248 1.00 . A A . 19 GLY HA2 1 1 1 232 1 1 19 GLY HA3 H -5.801 3.743 -4.406 1.00 . A A . 19 GLY HA3 1 1 1 233 1 1 19 GLY N N -4.403 4.097 -2.922 1.00 . A A . 19 GLY N 1 1 1 234 1 1 19 GLY O O -4.461 2.226 -5.930 1.00 . A A . 19 GLY O 1 1 1 235 1 1 20 LYS C C -2.040 0.036 -5.028 1.00 . A A . 20 LYS C 1 1 1 236 1 1 20 LYS CA C -1.900 1.553 -5.112 1.00 . A A . 20 LYS CA 1 1 1 237 1 1 20 LYS CB C -0.499 1.972 -4.660 1.00 . A A . 20 LYS CB 1 1 1 238 1 1 20 LYS CD C 1.834 2.501 -5.426 1.00 . A A . 20 LYS CD 1 1 1 239 1 1 20 LYS CE C 3.083 1.791 -5.927 1.00 . A A . 20 LYS CE 1 1 1 240 1 1 20 LYS CG C 0.584 1.675 -5.682 1.00 . A A . 20 LYS CG 1 1 1 241 1 1 20 LYS H H -2.699 2.456 -3.372 1.00 . A A . 20 LYS H 1 1 1 242 1 1 20 LYS HA H -2.045 1.860 -6.136 1.00 . A A . 20 LYS HA 1 1 1 243 1 1 20 LYS HB2 H -0.500 3.035 -4.465 1.00 . A A . 20 LYS HB2 1 1 1 244 1 1 20 LYS HB3 H -0.257 1.448 -3.746 1.00 . A A . 20 LYS HB3 1 1 1 245 1 1 20 LYS HD2 H 1.741 3.447 -5.939 1.00 . A A . 20 LYS HD2 1 1 1 246 1 1 20 LYS HD3 H 1.930 2.673 -4.363 1.00 . A A . 20 LYS HD3 1 1 1 247 1 1 20 LYS HE2 H 3.931 2.140 -5.358 1.00 . A A . 20 LYS HE2 1 1 1 248 1 1 20 LYS HE3 H 2.961 0.729 -5.777 1.00 . A A . 20 LYS HE3 1 1 1 249 1 1 20 LYS HG2 H 0.841 0.627 -5.627 1.00 . A A . 20 LYS HG2 1 1 1 250 1 1 20 LYS HG3 H 0.208 1.904 -6.669 1.00 . A A . 20 LYS HG3 1 1 1 251 1 1 20 LYS HZ1 H 4.071 1.420 -7.729 1.00 . A A . 20 LYS HZ1 1 1 1 252 1 1 20 LYS HZ2 H 3.630 3.038 -7.510 1.00 . A A . 20 LYS HZ2 1 1 1 253 1 1 20 LYS HZ3 H 2.457 1.890 -7.917 1.00 . A A . 20 LYS HZ3 1 1 1 254 1 1 20 LYS N N -2.913 2.214 -4.298 1.00 . A A . 20 LYS N 1 1 1 255 1 1 20 LYS NZ N 3.327 2.053 -7.372 1.00 . A A . 20 LYS NZ 1 1 1 256 1 1 20 LYS O O -2.530 -0.497 -4.034 1.00 . A A . 20 LYS O 1 1 1 257 1 1 21 ALA C C -0.303 -2.733 -5.926 1.00 . A A . 21 ALA C 1 1 1 258 1 1 21 ALA CA C -1.679 -2.107 -6.122 1.00 . A A . 21 ALA CA 1 1 1 259 1 1 21 ALA CB C -2.286 -2.566 -7.440 1.00 . A A . 21 ALA CB 1 1 1 260 1 1 21 ALA H H -1.225 -0.170 -6.842 1.00 . A A . 21 ALA H 1 1 1 261 1 1 21 ALA HA H -2.329 -2.432 -5.322 1.00 . A A . 21 ALA HA 1 1 1 262 1 1 21 ALA HB1 H -2.488 -1.706 -8.062 1.00 . A A . 21 ALA HB1 1 1 1 263 1 1 21 ALA HB2 H -1.593 -3.222 -7.946 1.00 . A A . 21 ALA HB2 1 1 1 264 1 1 21 ALA HB3 H -3.208 -3.095 -7.247 1.00 . A A . 21 ALA HB3 1 1 1 265 1 1 21 ALA N N -1.605 -0.652 -6.079 1.00 . A A . 21 ALA N 1 1 1 266 1 1 21 ALA O O 0.696 -2.235 -6.445 1.00 . A A . 21 ALA O 1 1 1 267 1 1 22 PHE C C 0.827 -6.029 -5.050 1.00 . A A . 22 PHE C 1 1 1 268 1 1 22 PHE CA C 0.998 -4.519 -4.906 1.00 . A A . 22 PHE CA 1 1 1 269 1 1 22 PHE CB C 1.502 -4.184 -3.500 1.00 . A A . 22 PHE CB 1 1 1 270 1 1 22 PHE CD1 C 0.684 -1.910 -2.823 1.00 . A A . 22 PHE CD1 1 1 1 271 1 1 22 PHE CD2 C 2.954 -2.137 -3.517 1.00 . A A . 22 PHE CD2 1 1 1 272 1 1 22 PHE CE1 C 0.880 -0.558 -2.617 1.00 . A A . 22 PHE CE1 1 1 1 273 1 1 22 PHE CE2 C 3.156 -0.785 -3.312 1.00 . A A . 22 PHE CE2 1 1 1 274 1 1 22 PHE CG C 1.718 -2.714 -3.276 1.00 . A A . 22 PHE CG 1 1 1 275 1 1 22 PHE CZ C 2.117 0.005 -2.860 1.00 . A A . 22 PHE CZ 1 1 1 276 1 1 22 PHE H H -1.088 -4.175 -4.785 1.00 . A A . 22 PHE H 1 1 1 277 1 1 22 PHE HA H 1.723 -4.180 -5.629 1.00 . A A . 22 PHE HA 1 1 1 278 1 1 22 PHE HB2 H 0.780 -4.527 -2.775 1.00 . A A . 22 PHE HB2 1 1 1 279 1 1 22 PHE HB3 H 2.442 -4.688 -3.333 1.00 . A A . 22 PHE HB3 1 1 1 280 1 1 22 PHE HD1 H -0.284 -2.349 -2.631 1.00 . A A . 22 PHE HD1 1 1 1 281 1 1 22 PHE HD2 H 3.768 -2.755 -3.870 1.00 . A A . 22 PHE HD2 1 1 1 282 1 1 22 PHE HE1 H 0.066 0.058 -2.263 1.00 . A A . 22 PHE HE1 1 1 1 283 1 1 22 PHE HE2 H 4.125 -0.349 -3.503 1.00 . A A . 22 PHE HE2 1 1 1 284 1 1 22 PHE HZ H 2.272 1.062 -2.700 1.00 . A A . 22 PHE HZ 1 1 1 285 1 1 22 PHE N N -0.257 -3.826 -5.172 1.00 . A A . 22 PHE N 1 1 1 286 1 1 22 PHE O O -0.258 -6.567 -4.830 1.00 . A A . 22 PHE O 1 1 1 287 1 1 23 THR C C 2.130 -8.874 -4.277 1.00 . A A . 23 THR C 1 1 1 288 1 1 23 THR CA C 1.879 -8.154 -5.597 1.00 . A A . 23 THR CA 1 1 1 289 1 1 23 THR CB C 2.927 -8.616 -6.628 1.00 . A A . 23 THR CB 1 1 1 290 1 1 23 THR CG2 C 2.733 -10.084 -6.976 1.00 . A A . 23 THR CG2 1 1 1 291 1 1 23 THR H H 2.745 -6.223 -5.582 1.00 . A A . 23 THR H 1 1 1 292 1 1 23 THR HA H 0.900 -8.426 -5.964 1.00 . A A . 23 THR HA 1 1 1 293 1 1 23 THR HB H 3.911 -8.490 -6.200 1.00 . A A . 23 THR HB 1 1 1 294 1 1 23 THR HG1 H 3.248 -8.284 -8.545 1.00 . A A . 23 THR HG1 1 1 1 295 1 1 23 THR HG21 H 2.331 -10.606 -6.121 1.00 . A A . 23 THR HG21 1 1 1 296 1 1 23 THR HG22 H 3.683 -10.518 -7.249 1.00 . A A . 23 THR HG22 1 1 1 297 1 1 23 THR HG23 H 2.046 -10.170 -7.805 1.00 . A A . 23 THR HG23 1 1 1 298 1 1 23 THR N N 1.908 -6.708 -5.422 1.00 . A A . 23 THR N 1 1 1 299 1 1 23 THR O O 1.513 -9.899 -3.991 1.00 . A A . 23 THR O 1 1 1 300 1 1 23 THR OG1 O 2.829 -7.822 -7.815 1.00 . A A . 23 THR OG1 1 1 1 301 1 1 24 ASP C C 3.240 -7.889 -1.067 1.00 . A A . 24 ASP C 1 1 1 302 1 1 24 ASP CA C 3.371 -8.919 -2.184 1.00 . A A . 24 ASP CA 1 1 1 303 1 1 24 ASP CB C 4.792 -9.486 -2.208 1.00 . A A . 24 ASP CB 1 1 1 304 1 1 24 ASP CG C 5.822 -8.451 -2.614 1.00 . A A . 24 ASP CG 1 1 1 305 1 1 24 ASP H H 3.499 -7.511 -3.760 1.00 . A A . 24 ASP H 1 1 1 306 1 1 24 ASP HA H 2.676 -9.724 -1.998 1.00 . A A . 24 ASP HA 1 1 1 307 1 1 24 ASP HB2 H 5.044 -9.850 -1.222 1.00 . A A . 24 ASP HB2 1 1 1 308 1 1 24 ASP HB3 H 4.834 -10.305 -2.910 1.00 . A A . 24 ASP HB3 1 1 1 309 1 1 24 ASP N N 3.040 -8.330 -3.476 1.00 . A A . 24 ASP N 1 1 1 310 1 1 24 ASP O O 3.474 -6.698 -1.276 1.00 . A A . 24 ASP O 1 1 1 311 1 1 24 ASP OD1 O 5.926 -7.416 -1.924 1.00 . A A . 24 ASP OD1 1 1 1 312 1 1 24 ASP OD2 O 6.523 -8.675 -3.623 1.00 . A A . 24 ASP OD2 1 1 1 313 1 1 25 ARG C C 3.957 -6.642 1.502 1.00 . A A . 25 ARG C 1 1 1 314 1 1 25 ARG CA C 2.699 -7.473 1.269 1.00 . A A . 25 ARG CA 1 1 1 315 1 1 25 ARG CB C 2.375 -8.289 2.522 1.00 . A A . 25 ARG CB 1 1 1 316 1 1 25 ARG CD C 2.065 -8.322 5.016 1.00 . A A . 25 ARG CD 1 1 1 317 1 1 25 ARG CG C 2.293 -7.453 3.789 1.00 . A A . 25 ARG CG 1 1 1 318 1 1 25 ARG CZ C 2.924 -8.420 7.317 1.00 . A A . 25 ARG CZ 1 1 1 319 1 1 25 ARG H H 2.691 -9.314 0.224 1.00 . A A . 25 ARG H 1 1 1 320 1 1 25 ARG HA H 1.875 -6.807 1.061 1.00 . A A . 25 ARG HA 1 1 1 321 1 1 25 ARG HB2 H 1.425 -8.783 2.381 1.00 . A A . 25 ARG HB2 1 1 1 322 1 1 25 ARG HB3 H 3.142 -9.036 2.659 1.00 . A A . 25 ARG HB3 1 1 1 323 1 1 25 ARG HD2 H 1.002 -8.451 5.157 1.00 . A A . 25 ARG HD2 1 1 1 324 1 1 25 ARG HD3 H 2.525 -9.285 4.849 1.00 . A A . 25 ARG HD3 1 1 1 325 1 1 25 ARG HE H 2.807 -6.763 6.213 1.00 . A A . 25 ARG HE 1 1 1 326 1 1 25 ARG HG2 H 3.219 -6.912 3.912 1.00 . A A . 25 ARG HG2 1 1 1 327 1 1 25 ARG HG3 H 1.475 -6.755 3.696 1.00 . A A . 25 ARG HG3 1 1 1 328 1 1 25 ARG HH11 H 2.312 -10.191 6.562 1.00 . A A . 25 ARG HH11 1 1 1 329 1 1 25 ARG HH12 H 2.920 -10.246 8.184 1.00 . A A . 25 ARG HH12 1 1 1 330 1 1 25 ARG HH21 H 3.610 -6.822 8.348 1.00 . A A . 25 ARG HH21 1 1 1 331 1 1 25 ARG HH22 H 3.657 -8.329 9.199 1.00 . A A . 25 ARG HH22 1 1 1 332 1 1 25 ARG N N 2.863 -8.355 0.120 1.00 . A A . 25 ARG N 1 1 1 333 1 1 25 ARG NE N 2.634 -7.727 6.222 1.00 . A A . 25 ARG NE 1 1 1 334 1 1 25 ARG NH1 N 2.700 -9.726 7.358 1.00 . A A . 25 ARG NH1 1 1 1 335 1 1 25 ARG NH2 N 3.439 -7.806 8.375 1.00 . A A . 25 ARG NH2 1 1 1 336 1 1 25 ARG O O 3.908 -5.412 1.510 1.00 . A A . 25 ARG O 1 1 1 337 1 1 26 SER C C 6.438 -5.352 1.126 1.00 . A A . 26 SER C 1 1 1 338 1 1 26 SER CA C 6.354 -6.647 1.927 1.00 . A A . 26 SER CA 1 1 1 339 1 1 26 SER CB C 7.520 -7.566 1.557 1.00 . A A . 26 SER CB 1 1 1 340 1 1 26 SER H H 5.058 -8.302 1.672 1.00 . A A . 26 SER H 1 1 1 341 1 1 26 SER HA H 6.412 -6.411 2.979 1.00 . A A . 26 SER HA 1 1 1 342 1 1 26 SER HB2 H 8.449 -7.099 1.848 1.00 . A A . 26 SER HB2 1 1 1 343 1 1 26 SER HB3 H 7.412 -8.507 2.076 1.00 . A A . 26 SER HB3 1 1 1 344 1 1 26 SER HG H 7.286 -8.721 -0.008 1.00 . A A . 26 SER HG 1 1 1 345 1 1 26 SER N N 5.083 -7.323 1.690 1.00 . A A . 26 SER N 1 1 1 346 1 1 26 SER O O 6.872 -4.320 1.637 1.00 . A A . 26 SER O 1 1 1 347 1 1 26 SER OG O 7.551 -7.814 0.162 1.00 . A A . 26 SER OG 1 1 1 348 1 1 27 ASN C C 5.094 -3.166 -0.503 1.00 . A A . 27 ASN C 1 1 1 349 1 1 27 ASN CA C 6.047 -4.246 -1.007 1.00 . A A . 27 ASN CA 1 1 1 350 1 1 27 ASN CB C 5.674 -4.643 -2.437 1.00 . A A . 27 ASN CB 1 1 1 351 1 1 27 ASN CG C 6.882 -5.055 -3.256 1.00 . A A . 27 ASN CG 1 1 1 352 1 1 27 ASN H H 5.683 -6.265 -0.485 1.00 . A A . 27 ASN H 1 1 1 353 1 1 27 ASN HA H 7.053 -3.853 -1.003 1.00 . A A . 27 ASN HA 1 1 1 354 1 1 27 ASN HB2 H 4.985 -5.475 -2.405 1.00 . A A . 27 ASN HB2 1 1 1 355 1 1 27 ASN HB3 H 5.199 -3.806 -2.925 1.00 . A A . 27 ASN HB3 1 1 1 356 1 1 27 ASN HD21 H 7.739 -3.292 -2.924 1.00 . A A . 27 ASN HD21 1 1 1 357 1 1 27 ASN HD22 H 8.646 -4.397 -3.894 1.00 . A A . 27 ASN HD22 1 1 1 358 1 1 27 ASN N N 6.019 -5.414 -0.134 1.00 . A A . 27 ASN N 1 1 1 359 1 1 27 ASN ND2 N 7.854 -4.157 -3.369 1.00 . A A . 27 ASN ND2 1 1 1 360 1 1 27 ASN O O 5.457 -1.992 -0.420 1.00 . A A . 27 ASN O 1 1 1 361 1 1 27 ASN OD1 O 6.941 -6.168 -3.780 1.00 . A A . 27 ASN OD1 1 1 1 362 1 1 28 LEU C C 3.383 -1.885 1.553 1.00 . A A . 28 LEU C 1 1 1 363 1 1 28 LEU CA C 2.869 -2.639 0.331 1.00 . A A . 28 LEU CA 1 1 1 364 1 1 28 LEU CB C 1.582 -3.387 0.684 1.00 . A A . 28 LEU CB 1 1 1 365 1 1 28 LEU CD1 C -0.042 -1.525 0.262 1.00 . A A . 28 LEU CD1 1 1 1 366 1 1 28 LEU CD2 C -0.687 -3.430 1.749 1.00 . A A . 28 LEU CD2 1 1 1 367 1 1 28 LEU CG C 0.456 -2.542 1.278 1.00 . A A . 28 LEU CG 1 1 1 368 1 1 28 LEU H H 3.645 -4.520 -0.254 1.00 . A A . 28 LEU H 1 1 1 369 1 1 28 LEU HA H 2.659 -1.928 -0.454 1.00 . A A . 28 LEU HA 1 1 1 370 1 1 28 LEU HB2 H 1.209 -3.847 -0.219 1.00 . A A . 28 LEU HB2 1 1 1 371 1 1 28 LEU HB3 H 1.833 -4.157 1.400 1.00 . A A . 28 LEU HB3 1 1 1 372 1 1 28 LEU HD11 H -0.342 -2.035 -0.640 1.00 . A A . 28 LEU HD11 1 1 1 373 1 1 28 LEU HD12 H 0.751 -0.827 0.035 1.00 . A A . 28 LEU HD12 1 1 1 374 1 1 28 LEU HD13 H -0.885 -0.989 0.673 1.00 . A A . 28 LEU HD13 1 1 1 375 1 1 28 LEU HD21 H -1.629 -2.974 1.485 1.00 . A A . 28 LEU HD21 1 1 1 376 1 1 28 LEU HD22 H -0.631 -3.549 2.821 1.00 . A A . 28 LEU HD22 1 1 1 377 1 1 28 LEU HD23 H -0.609 -4.398 1.275 1.00 . A A . 28 LEU HD23 1 1 1 378 1 1 28 LEU HG H 0.834 -2.000 2.134 1.00 . A A . 28 LEU HG 1 1 1 379 1 1 28 LEU N N 3.875 -3.572 -0.166 1.00 . A A . 28 LEU N 1 1 1 380 1 1 28 LEU O O 3.415 -0.654 1.568 1.00 . A A . 28 LEU O 1 1 1 381 1 1 29 PHE C C 5.422 -1.044 3.497 1.00 . A A . 29 PHE C 1 1 1 382 1 1 29 PHE CA C 4.301 -2.033 3.803 1.00 . A A . 29 PHE CA 1 1 1 383 1 1 29 PHE CB C 4.809 -3.120 4.752 1.00 . A A . 29 PHE CB 1 1 1 384 1 1 29 PHE CD1 C 2.583 -4.223 5.106 1.00 . A A . 29 PHE CD1 1 1 1 385 1 1 29 PHE CD2 C 3.893 -3.676 7.021 1.00 . A A . 29 PHE CD2 1 1 1 386 1 1 29 PHE CE1 C 1.598 -4.742 5.924 1.00 . A A . 29 PHE CE1 1 1 1 387 1 1 29 PHE CE2 C 2.912 -4.194 7.845 1.00 . A A . 29 PHE CE2 1 1 1 388 1 1 29 PHE CG C 3.740 -3.684 5.644 1.00 . A A . 29 PHE CG 1 1 1 389 1 1 29 PHE CZ C 1.763 -4.729 7.296 1.00 . A A . 29 PHE CZ 1 1 1 390 1 1 29 PHE H H 3.737 -3.607 2.505 1.00 . A A . 29 PHE H 1 1 1 391 1 1 29 PHE HA H 3.490 -1.503 4.278 1.00 . A A . 29 PHE HA 1 1 1 392 1 1 29 PHE HB2 H 5.218 -3.933 4.171 1.00 . A A . 29 PHE HB2 1 1 1 393 1 1 29 PHE HB3 H 5.583 -2.706 5.380 1.00 . A A . 29 PHE HB3 1 1 1 394 1 1 29 PHE HD1 H 2.453 -4.236 4.033 1.00 . A A . 29 PHE HD1 1 1 1 395 1 1 29 PHE HD2 H 4.793 -3.258 7.452 1.00 . A A . 29 PHE HD2 1 1 1 396 1 1 29 PHE HE1 H 0.701 -5.160 5.492 1.00 . A A . 29 PHE HE1 1 1 1 397 1 1 29 PHE HE2 H 3.045 -4.182 8.917 1.00 . A A . 29 PHE HE2 1 1 1 398 1 1 29 PHE HZ H 0.995 -5.133 7.937 1.00 . A A . 29 PHE HZ 1 1 1 399 1 1 29 PHE N N 3.787 -2.631 2.576 1.00 . A A . 29 PHE N 1 1 1 400 1 1 29 PHE O O 5.467 0.054 4.052 1.00 . A A . 29 PHE O 1 1 1 401 1 1 30 THR C C 6.969 0.747 1.689 1.00 . A A . 30 THR C 1 1 1 402 1 1 30 THR CA C 7.452 -0.594 2.231 1.00 . A A . 30 THR CA 1 1 1 403 1 1 30 THR CB C 8.338 -1.275 1.171 1.00 . A A . 30 THR CB 1 1 1 404 1 1 30 THR CG2 C 9.471 -0.356 0.742 1.00 . A A . 30 THR CG2 1 1 1 405 1 1 30 THR H H 6.239 -2.329 2.202 1.00 . A A . 30 THR H 1 1 1 406 1 1 30 THR HA H 8.051 -0.420 3.113 1.00 . A A . 30 THR HA 1 1 1 407 1 1 30 THR HB H 7.730 -1.500 0.306 1.00 . A A . 30 THR HB 1 1 1 408 1 1 30 THR HG1 H 9.730 -2.320 2.097 1.00 . A A . 30 THR HG1 1 1 1 409 1 1 30 THR HG21 H 9.840 -0.667 -0.224 1.00 . A A . 30 THR HG21 1 1 1 410 1 1 30 THR HG22 H 10.271 -0.408 1.466 1.00 . A A . 30 THR HG22 1 1 1 411 1 1 30 THR HG23 H 9.108 0.659 0.679 1.00 . A A . 30 THR HG23 1 1 1 412 1 1 30 THR N N 6.329 -1.442 2.610 1.00 . A A . 30 THR N 1 1 1 413 1 1 30 THR O O 7.627 1.773 1.866 1.00 . A A . 30 THR O 1 1 1 414 1 1 30 THR OG1 O 8.877 -2.494 1.693 1.00 . A A . 30 THR OG1 1 1 1 415 1 1 31 HIS C C 4.549 2.775 1.536 1.00 . A A . 31 HIS C 1 1 1 416 1 1 31 HIS CA C 5.245 1.948 0.459 1.00 . A A . 31 HIS CA 1 1 1 417 1 1 31 HIS CB C 4.255 1.600 -0.653 1.00 . A A . 31 HIS CB 1 1 1 418 1 1 31 HIS CD2 C 1.990 2.864 -0.643 1.00 . A A . 31 HIS CD2 1 1 1 419 1 1 31 HIS CE1 C 2.594 4.616 -1.814 1.00 . A A . 31 HIS CE1 1 1 1 420 1 1 31 HIS CG C 3.295 2.706 -0.967 1.00 . A A . 31 HIS CG 1 1 1 421 1 1 31 HIS H H 5.339 -0.117 0.918 1.00 . A A . 31 HIS H 1 1 1 422 1 1 31 HIS HA H 6.052 2.530 0.042 1.00 . A A . 31 HIS HA 1 1 1 423 1 1 31 HIS HB2 H 4.804 1.372 -1.555 1.00 . A A . 31 HIS HB2 1 1 1 424 1 1 31 HIS HB3 H 3.681 0.734 -0.358 1.00 . A A . 31 HIS HB3 1 1 1 425 1 1 31 HIS HD1 H 4.527 4.001 -2.082 1.00 . A A . 31 HIS HD1 1 1 1 426 1 1 31 HIS HD2 H 1.384 2.178 -0.067 1.00 . A A . 31 HIS HD2 1 1 1 427 1 1 31 HIS HE1 H 2.571 5.561 -2.335 1.00 . A A . 31 HIS HE1 1 1 1 428 1 1 31 HIS N N 5.816 0.732 1.027 1.00 . A A . 31 HIS N 1 1 1 429 1 1 31 HIS ND1 N 3.643 3.820 -1.702 1.00 . A A . 31 HIS ND1 1 1 1 430 1 1 31 HIS NE2 N 1.578 4.058 -1.181 1.00 . A A . 31 HIS NE2 1 1 1 431 1 1 31 HIS O O 4.722 3.991 1.605 1.00 . A A . 31 HIS O 1 1 1 432 1 1 32 GLN C C 3.947 3.756 4.184 1.00 . A A . 32 GLN C 1 1 1 433 1 1 32 GLN CA C 3.038 2.780 3.443 1.00 . A A . 32 GLN CA 1 1 1 434 1 1 32 GLN CB C 2.464 1.756 4.424 1.00 . A A . 32 GLN CB 1 1 1 435 1 1 32 GLN CD C -0.013 1.529 3.983 1.00 . A A . 32 GLN CD 1 1 1 436 1 1 32 GLN CG C 1.358 0.899 3.830 1.00 . A A . 32 GLN CG 1 1 1 437 1 1 32 GLN H H 3.664 1.137 2.265 1.00 . A A . 32 GLN H 1 1 1 438 1 1 32 GLN HA H 2.225 3.333 2.998 1.00 . A A . 32 GLN HA 1 1 1 439 1 1 32 GLN HB2 H 3.260 1.103 4.750 1.00 . A A . 32 GLN HB2 1 1 1 440 1 1 32 GLN HB3 H 2.065 2.279 5.280 1.00 . A A . 32 GLN HB3 1 1 1 441 1 1 32 GLN HE21 H -0.826 0.085 2.884 1.00 . A A . 32 GLN HE21 1 1 1 442 1 1 32 GLN HE22 H -1.918 1.290 3.466 1.00 . A A . 32 GLN HE22 1 1 1 443 1 1 32 GLN HG2 H 1.555 0.756 2.778 1.00 . A A . 32 GLN HG2 1 1 1 444 1 1 32 GLN HG3 H 1.355 -0.059 4.328 1.00 . A A . 32 GLN HG3 1 1 1 445 1 1 32 GLN N N 3.761 2.106 2.372 1.00 . A A . 32 GLN N 1 1 1 446 1 1 32 GLN NE2 N -1.021 0.906 3.383 1.00 . A A . 32 GLN NE2 1 1 1 447 1 1 32 GLN O O 3.476 4.693 4.828 1.00 . A A . 32 GLN O 1 1 1 448 1 1 32 GLN OE1 O -0.165 2.564 4.632 1.00 . A A . 32 GLN OE1 1 1 1 449 1 1 33 LYS C C 5.961 5.858 4.432 1.00 . A A . 33 LYS C 1 1 1 450 1 1 33 LYS CA C 6.229 4.389 4.746 1.00 . A A . 33 LYS CA 1 1 1 451 1 1 33 LYS CB C 7.647 4.014 4.308 1.00 . A A . 33 LYS CB 1 1 1 452 1 1 33 LYS CD C 9.658 2.638 4.918 1.00 . A A . 33 LYS CD 1 1 1 453 1 1 33 LYS CE C 10.155 1.432 5.700 1.00 . A A . 33 LYS CE 1 1 1 454 1 1 33 LYS CG C 8.140 2.706 4.904 1.00 . A A . 33 LYS CG 1 1 1 455 1 1 33 LYS H H 5.567 2.767 3.558 1.00 . A A . 33 LYS H 1 1 1 456 1 1 33 LYS HA H 6.138 4.239 5.811 1.00 . A A . 33 LYS HA 1 1 1 457 1 1 33 LYS HB2 H 7.667 3.926 3.232 1.00 . A A . 33 LYS HB2 1 1 1 458 1 1 33 LYS HB3 H 8.324 4.800 4.610 1.00 . A A . 33 LYS HB3 1 1 1 459 1 1 33 LYS HD2 H 10.017 2.566 3.902 1.00 . A A . 33 LYS HD2 1 1 1 460 1 1 33 LYS HD3 H 10.046 3.538 5.375 1.00 . A A . 33 LYS HD3 1 1 1 461 1 1 33 LYS HE2 H 9.632 1.391 6.644 1.00 . A A . 33 LYS HE2 1 1 1 462 1 1 33 LYS HE3 H 9.942 0.539 5.132 1.00 . A A . 33 LYS HE3 1 1 1 463 1 1 33 LYS HG2 H 7.778 2.623 5.917 1.00 . A A . 33 LYS HG2 1 1 1 464 1 1 33 LYS HG3 H 7.758 1.886 4.314 1.00 . A A . 33 LYS HG3 1 1 1 465 1 1 33 LYS HZ1 H 11.944 2.491 5.906 1.00 . A A . 33 LYS HZ1 1 1 1 466 1 1 33 LYS HZ2 H 12.135 0.941 5.255 1.00 . A A . 33 LYS HZ2 1 1 1 467 1 1 33 LYS HZ3 H 11.833 1.132 6.907 1.00 . A A . 33 LYS HZ3 1 1 1 468 1 1 33 LYS N N 5.252 3.530 4.087 1.00 . A A . 33 LYS N 1 1 1 469 1 1 33 LYS NZ N 11.619 1.504 5.960 1.00 . A A . 33 LYS NZ 1 1 1 470 1 1 33 LYS O O 5.960 6.703 5.328 1.00 . A A . 33 LYS O 1 1 1 471 1 1 34 ILE C C 4.141 8.024 3.299 1.00 . A A . 34 ILE C 1 1 1 472 1 1 34 ILE CA C 5.462 7.520 2.727 1.00 . A A . 34 ILE CA 1 1 1 473 1 1 34 ILE CB C 5.419 7.628 1.191 1.00 . A A . 34 ILE CB 1 1 1 474 1 1 34 ILE CD1 C 3.666 7.450 -0.646 1.00 . A A . 34 ILE CD1 1 1 1 475 1 1 34 ILE CG1 C 4.213 6.866 0.638 1.00 . A A . 34 ILE CG1 1 1 1 476 1 1 34 ILE CG2 C 6.710 7.099 0.586 1.00 . A A . 34 ILE CG2 1 1 1 477 1 1 34 ILE H H 5.748 5.436 2.490 1.00 . A A . 34 ILE H 1 1 1 478 1 1 34 ILE HA H 6.262 8.148 3.090 1.00 . A A . 34 ILE HA 1 1 1 479 1 1 34 ILE HB H 5.328 8.671 0.929 1.00 . A A . 34 ILE HB 1 1 1 480 1 1 34 ILE HD11 H 4.195 7.027 -1.488 1.00 . A A . 34 ILE HD11 1 1 1 481 1 1 34 ILE HD12 H 2.615 7.217 -0.729 1.00 . A A . 34 ILE HD12 1 1 1 482 1 1 34 ILE HD13 H 3.799 8.522 -0.640 1.00 . A A . 34 ILE HD13 1 1 1 483 1 1 34 ILE HG12 H 4.499 5.845 0.441 1.00 . A A . 34 ILE HG12 1 1 1 484 1 1 34 ILE HG13 H 3.421 6.878 1.373 1.00 . A A . 34 ILE HG13 1 1 1 485 1 1 34 ILE HG21 H 6.487 6.559 -0.322 1.00 . A A . 34 ILE HG21 1 1 1 486 1 1 34 ILE HG22 H 7.367 7.925 0.360 1.00 . A A . 34 ILE HG22 1 1 1 487 1 1 34 ILE HG23 H 7.193 6.437 1.289 1.00 . A A . 34 ILE HG23 1 1 1 488 1 1 34 ILE N N 5.734 6.154 3.157 1.00 . A A . 34 ILE N 1 1 1 489 1 1 34 ILE O O 3.866 9.224 3.291 1.00 . A A . 34 ILE O 1 1 1 490 1 1 35 HIS C C 2.155 7.670 5.879 1.00 . A A . 35 HIS C 1 1 1 491 1 1 35 HIS CA C 2.034 7.449 4.374 1.00 . A A . 35 HIS CA 1 1 1 492 1 1 35 HIS CB C 1.009 6.351 4.089 1.00 . A A . 35 HIS CB 1 1 1 493 1 1 35 HIS CD2 C 0.554 5.467 1.694 1.00 . A A . 35 HIS CD2 1 1 1 494 1 1 35 HIS CE1 C -0.576 7.183 0.928 1.00 . A A . 35 HIS CE1 1 1 1 495 1 1 35 HIS CG C 0.475 6.379 2.690 1.00 . A A . 35 HIS CG 1 1 1 496 1 1 35 HIS H H 3.601 6.158 3.773 1.00 . A A . 35 HIS H 1 1 1 497 1 1 35 HIS HA H 1.703 8.367 3.914 1.00 . A A . 35 HIS HA 1 1 1 498 1 1 35 HIS HB2 H 1.470 5.387 4.248 1.00 . A A . 35 HIS HB2 1 1 1 499 1 1 35 HIS HB3 H 0.175 6.461 4.767 1.00 . A A . 35 HIS HB3 1 1 1 500 1 1 35 HIS HD1 H -0.464 8.265 2.661 1.00 . A A . 35 HIS HD1 1 1 1 501 1 1 35 HIS HD2 H 1.045 4.505 1.742 1.00 . A A . 35 HIS HD2 1 1 1 502 1 1 35 HIS HE1 H -1.139 7.834 0.277 1.00 . A A . 35 HIS HE1 1 1 1 503 1 1 35 HIS N N 3.326 7.098 3.796 1.00 . A A . 35 HIS N 1 1 1 504 1 1 35 HIS ND1 N -0.238 7.443 2.178 1.00 . A A . 35 HIS ND1 1 1 1 505 1 1 35 HIS NE2 N -0.107 5.990 0.609 1.00 . A A . 35 HIS NE2 1 1 1 506 1 1 35 HIS O O 1.694 8.682 6.408 1.00 . A A . 35 HIS O 1 1 1 507 1 1 36 THR C C 4.215 7.591 8.358 1.00 . A A . 36 THR C 1 1 1 508 1 1 36 THR CA C 2.956 6.805 8.008 1.00 . A A . 36 THR CA 1 1 1 509 1 1 36 THR CB C 3.041 5.408 8.652 1.00 . A A . 36 THR CB 1 1 1 510 1 1 36 THR CG2 C 4.166 4.594 8.030 1.00 . A A . 36 THR CG2 1 1 1 511 1 1 36 THR H H 3.122 5.933 6.087 1.00 . A A . 36 THR H 1 1 1 512 1 1 36 THR HA H 2.098 7.317 8.420 1.00 . A A . 36 THR HA 1 1 1 513 1 1 36 THR HB H 2.106 4.893 8.481 1.00 . A A . 36 THR HB 1 1 1 514 1 1 36 THR HG1 H 2.665 6.197 10.420 1.00 . A A . 36 THR HG1 1 1 1 515 1 1 36 THR HG21 H 4.962 5.255 7.724 1.00 . A A . 36 THR HG21 1 1 1 516 1 1 36 THR HG22 H 3.791 4.060 7.170 1.00 . A A . 36 THR HG22 1 1 1 517 1 1 36 THR HG23 H 4.542 3.888 8.756 1.00 . A A . 36 THR HG23 1 1 1 518 1 1 36 THR N N 2.777 6.716 6.565 1.00 . A A . 36 THR N 1 1 1 519 1 1 36 THR O O 5.023 7.155 9.178 1.00 . A A . 36 THR O 1 1 1 520 1 1 36 THR OG1 O 3.257 5.531 10.062 1.00 . A A . 36 THR OG1 1 1 1 521 1 1 37 GLY C C 5.347 11.011 7.530 1.00 . A A . 37 GLY C 1 1 1 522 1 1 37 GLY CA C 5.539 9.580 7.991 1.00 . A A . 37 GLY CA 1 1 1 523 1 1 37 GLY H H 3.699 9.049 7.088 1.00 . A A . 37 GLY H 1 1 1 524 1 1 37 GLY HA2 H 5.739 9.579 9.052 1.00 . A A . 37 GLY HA2 1 1 1 525 1 1 37 GLY HA3 H 6.389 9.159 7.474 1.00 . A A . 37 GLY HA3 1 1 1 526 1 1 37 GLY N N 4.376 8.752 7.732 1.00 . A A . 37 GLY N 1 1 1 527 1 1 37 GLY O O 6.282 11.643 7.040 1.00 . A A . 37 GLY O 1 1 1 528 1 1 38 GLU C C 2.704 13.473 8.144 1.00 . A A . 38 GLU C 1 1 1 529 1 1 38 GLU CA C 3.818 12.888 7.279 1.00 . A A . 38 GLU CA 1 1 1 530 1 1 38 GLU CB C 3.407 12.924 5.806 1.00 . A A . 38 GLU CB 1 1 1 531 1 1 38 GLU CD C 1.756 12.173 4.047 1.00 . A A . 38 GLU CD 1 1 1 532 1 1 38 GLU CG C 2.222 12.028 5.483 1.00 . A A . 38 GLU CG 1 1 1 533 1 1 38 GLU H H 3.425 10.970 8.083 1.00 . A A . 38 GLU H 1 1 1 534 1 1 38 GLU HA H 4.708 13.485 7.409 1.00 . A A . 38 GLU HA 1 1 1 535 1 1 38 GLU HB2 H 3.148 13.938 5.541 1.00 . A A . 38 GLU HB2 1 1 1 536 1 1 38 GLU HB3 H 4.245 12.607 5.203 1.00 . A A . 38 GLU HB3 1 1 1 537 1 1 38 GLU HG2 H 2.508 11.001 5.650 1.00 . A A . 38 GLU HG2 1 1 1 538 1 1 38 GLU HG3 H 1.404 12.285 6.139 1.00 . A A . 38 GLU HG3 1 1 1 539 1 1 38 GLU N N 4.130 11.523 7.686 1.00 . A A . 38 GLU N 1 1 1 540 1 1 38 GLU O O 1.862 12.744 8.668 1.00 . A A . 38 GLU O 1 1 1 541 1 1 38 GLU OE1 O 2.598 12.487 3.180 1.00 . A A . 38 GLU OE1 1 1 1 542 1 1 38 GLU OE2 O 0.550 11.973 3.791 1.00 . A A . 38 GLU OE2 1 1 1 543 1 1 39 LYS C C 0.301 14.965 8.757 1.00 . A A . 39 LYS C 1 1 1 544 1 1 39 LYS CA C 1.699 15.478 9.088 1.00 . A A . 39 LYS CA 1 1 1 545 1 1 39 LYS CB C 1.768 16.989 8.850 1.00 . A A . 39 LYS CB 1 1 1 546 1 1 39 LYS CD C 4.250 17.380 8.865 1.00 . A A . 39 LYS CD 1 1 1 547 1 1 39 LYS CE C 5.351 18.304 9.362 1.00 . A A . 39 LYS CE 1 1 1 548 1 1 39 LYS CG C 2.929 17.663 9.561 1.00 . A A . 39 LYS CG 1 1 1 549 1 1 39 LYS H H 3.406 15.321 7.846 1.00 . A A . 39 LYS H 1 1 1 550 1 1 39 LYS HA H 1.906 15.276 10.128 1.00 . A A . 39 LYS HA 1 1 1 551 1 1 39 LYS HB2 H 1.868 17.170 7.790 1.00 . A A . 39 LYS HB2 1 1 1 552 1 1 39 LYS HB3 H 0.850 17.438 9.199 1.00 . A A . 39 LYS HB3 1 1 1 553 1 1 39 LYS HD2 H 4.538 16.358 9.060 1.00 . A A . 39 LYS HD2 1 1 1 554 1 1 39 LYS HD3 H 4.124 17.524 7.801 1.00 . A A . 39 LYS HD3 1 1 1 555 1 1 39 LYS HE2 H 6.131 18.346 8.618 1.00 . A A . 39 LYS HE2 1 1 1 556 1 1 39 LYS HE3 H 4.937 19.291 9.506 1.00 . A A . 39 LYS HE3 1 1 1 557 1 1 39 LYS HG2 H 2.762 18.730 9.572 1.00 . A A . 39 LYS HG2 1 1 1 558 1 1 39 LYS HG3 H 2.981 17.295 10.576 1.00 . A A . 39 LYS HG3 1 1 1 559 1 1 39 LYS HZ1 H 6.181 16.823 10.579 1.00 . A A . 39 LYS HZ1 1 1 1 560 1 1 39 LYS HZ2 H 5.246 17.955 11.419 1.00 . A A . 39 LYS HZ2 1 1 1 561 1 1 39 LYS HZ3 H 6.791 18.373 10.874 1.00 . A A . 39 LYS HZ3 1 1 1 562 1 1 39 LYS N N 2.708 14.794 8.289 1.00 . A A . 39 LYS N 1 1 1 563 1 1 39 LYS NZ N 5.933 17.830 10.649 1.00 . A A . 39 LYS NZ 1 1 1 564 1 1 39 LYS O O -0.014 14.647 7.610 1.00 . A A . 39 LYS O 1 1 1 565 1 1 40 PRO C C -2.803 15.398 8.851 1.00 . A A . 40 PRO C 1 1 1 566 1 1 40 PRO CA C -1.937 14.410 9.625 1.00 . A A . 40 PRO CA 1 1 1 567 1 1 40 PRO CB C -2.435 14.277 11.066 1.00 . A A . 40 PRO CB 1 1 1 568 1 1 40 PRO CD C -0.251 15.244 11.177 1.00 . A A . 40 PRO CD 1 1 1 569 1 1 40 PRO CG C -1.598 15.233 11.845 1.00 . A A . 40 PRO CG 1 1 1 570 1 1 40 PRO HA H -1.973 13.445 9.140 1.00 . A A . 40 PRO HA 1 1 1 571 1 1 40 PRO HB2 H -3.482 14.538 11.114 1.00 . A A . 40 PRO HB2 1 1 1 572 1 1 40 PRO HB3 H -2.295 13.262 11.407 1.00 . A A . 40 PRO HB3 1 1 1 573 1 1 40 PRO HD2 H 0.189 16.228 11.232 1.00 . A A . 40 PRO HD2 1 1 1 574 1 1 40 PRO HD3 H 0.401 14.511 11.630 1.00 . A A . 40 PRO HD3 1 1 1 575 1 1 40 PRO HG2 H -2.040 16.217 11.814 1.00 . A A . 40 PRO HG2 1 1 1 576 1 1 40 PRO HG3 H -1.507 14.893 12.866 1.00 . A A . 40 PRO HG3 1 1 1 577 1 1 40 PRO N N -0.559 14.882 9.783 1.00 . A A . 40 PRO N 1 1 1 578 1 1 40 PRO O O -2.377 16.515 8.558 1.00 . A A . 40 PRO O 1 1 1 579 1 1 41 SER C C -6.196 16.122 8.607 1.00 . A A . 41 SER C 1 1 1 580 1 1 41 SER CA C -4.947 15.828 7.781 1.00 . A A . 41 SER CA 1 1 1 581 1 1 41 SER CB C -5.339 15.158 6.463 1.00 . A A . 41 SER CB 1 1 1 582 1 1 41 SER H H -4.304 14.079 8.786 1.00 . A A . 41 SER H 1 1 1 583 1 1 41 SER HA H -4.444 16.759 7.567 1.00 . A A . 41 SER HA 1 1 1 584 1 1 41 SER HB2 H -5.788 14.198 6.669 1.00 . A A . 41 SER HB2 1 1 1 585 1 1 41 SER HB3 H -6.050 15.784 5.942 1.00 . A A . 41 SER HB3 1 1 1 586 1 1 41 SER HG H -3.889 14.064 5.731 1.00 . A A . 41 SER HG 1 1 1 587 1 1 41 SER N N -4.022 14.980 8.524 1.00 . A A . 41 SER N 1 1 1 588 1 1 41 SER O O -6.369 15.592 9.703 1.00 . A A . 41 SER O 1 1 1 589 1 1 41 SER OG O -4.208 14.964 5.633 1.00 . A A . 41 SER OG 1 1 1 590 1 1 42 GLY C C -9.383 17.785 7.828 1.00 . A A . 42 GLY C 1 1 1 591 1 1 42 GLY CA C -8.287 17.325 8.770 1.00 . A A . 42 GLY CA 1 1 1 592 1 1 42 GLY H H -6.875 17.366 7.193 1.00 . A A . 42 GLY H 1 1 1 593 1 1 42 GLY HA2 H -8.637 16.462 9.317 1.00 . A A . 42 GLY HA2 1 1 1 594 1 1 42 GLY HA3 H -8.073 18.120 9.469 1.00 . A A . 42 GLY HA3 1 1 1 595 1 1 42 GLY N N -7.065 16.973 8.070 1.00 . A A . 42 GLY N 1 1 1 596 1 1 42 GLY O O -9.124 18.412 6.800 1.00 . A A . 42 GLY O 1 1 1 597 1 1 43 PRO C C -12.068 19.345 7.393 1.00 . A A . 43 PRO C 1 1 1 598 1 1 43 PRO CA C -11.802 17.844 7.367 1.00 . A A . 43 PRO CA 1 1 1 599 1 1 43 PRO CB C -12.955 17.085 8.030 1.00 . A A . 43 PRO CB 1 1 1 600 1 1 43 PRO CD C -11.020 16.723 9.387 1.00 . A A . 43 PRO CD 1 1 1 601 1 1 43 PRO CG C -12.515 16.884 9.439 1.00 . A A . 43 PRO CG 1 1 1 602 1 1 43 PRO HA H -11.695 17.516 6.343 1.00 . A A . 43 PRO HA 1 1 1 603 1 1 43 PRO HB2 H -13.857 17.679 7.978 1.00 . A A . 43 PRO HB2 1 1 1 604 1 1 43 PRO HB3 H -13.108 16.143 7.526 1.00 . A A . 43 PRO HB3 1 1 1 605 1 1 43 PRO HD2 H -10.564 17.154 10.266 1.00 . A A . 43 PRO HD2 1 1 1 606 1 1 43 PRO HD3 H -10.756 15.680 9.296 1.00 . A A . 43 PRO HD3 1 1 1 607 1 1 43 PRO HG2 H -12.779 17.746 10.033 1.00 . A A . 43 PRO HG2 1 1 1 608 1 1 43 PRO HG3 H -12.973 15.993 9.843 1.00 . A A . 43 PRO HG3 1 1 1 609 1 1 43 PRO N N -10.639 17.469 8.176 1.00 . A A . 43 PRO N 1 1 1 610 1 1 43 PRO O O -12.184 19.946 8.461 1.00 . A A . 43 PRO O 1 1 1 611 1 1 44 SER C C -11.717 22.139 7.224 1.00 . A A . 44 SER C 1 1 1 612 1 1 44 SER CA C -12.412 21.378 6.099 1.00 . A A . 44 SER CA 1 1 1 613 1 1 44 SER CB C -13.916 21.660 6.130 1.00 . A A . 44 SER CB 1 1 1 614 1 1 44 SER H H -12.062 19.412 5.395 1.00 . A A . 44 SER H 1 1 1 615 1 1 44 SER HA H -12.011 21.711 5.153 1.00 . A A . 44 SER HA 1 1 1 616 1 1 44 SER HB2 H -14.379 21.046 6.887 1.00 . A A . 44 SER HB2 1 1 1 617 1 1 44 SER HB3 H -14.079 22.702 6.362 1.00 . A A . 44 SER HB3 1 1 1 618 1 1 44 SER HG H -14.665 20.426 4.806 1.00 . A A . 44 SER HG 1 1 1 619 1 1 44 SER N N -12.164 19.945 6.211 1.00 . A A . 44 SER N 1 1 1 620 1 1 44 SER O O -12.313 23.007 7.862 1.00 . A A . 44 SER O 1 1 1 621 1 1 44 SER OG O -14.514 21.371 4.878 1.00 . A A . 44 SER OG 1 1 1 622 1 1 45 SER C C -8.182 22.381 8.207 1.00 . A A . 45 SER C 1 1 1 623 1 1 45 SER CA C -9.675 22.457 8.510 1.00 . A A . 45 SER CA 1 1 1 624 1 1 45 SER CB C -9.966 21.807 9.865 1.00 . A A . 45 SER CB 1 1 1 625 1 1 45 SER H H -10.032 21.108 6.918 1.00 . A A . 45 SER H 1 1 1 626 1 1 45 SER HA H -9.971 23.495 8.548 1.00 . A A . 45 SER HA 1 1 1 627 1 1 45 SER HB2 H -11.002 21.509 9.903 1.00 . A A . 45 SER HB2 1 1 1 628 1 1 45 SER HB3 H -9.336 20.938 9.986 1.00 . A A . 45 SER HB3 1 1 1 629 1 1 45 SER HG H -10.513 22.835 11.440 1.00 . A A . 45 SER HG 1 1 1 630 1 1 45 SER N N -10.452 21.808 7.460 1.00 . A A . 45 SER N 1 1 1 631 1 1 45 SER O O -7.607 21.296 8.132 1.00 . A A . 45 SER O 1 1 1 632 1 1 45 SER OG O -9.711 22.709 10.928 1.00 . A A . 45 SER OG 1 1 1 633 1 1 46 GLY C C -5.820 23.096 6.343 1.00 . A A . 46 GLY C 1 1 1 634 1 1 46 GLY CA C -6.139 23.588 7.741 1.00 . A A . 46 GLY CA 1 1 1 635 1 1 46 GLY H H -8.070 24.378 8.106 1.00 . A A . 46 GLY H 1 1 1 636 1 1 46 GLY HA2 H -5.794 24.606 7.841 1.00 . A A . 46 GLY HA2 1 1 1 637 1 1 46 GLY HA3 H -5.616 22.969 8.455 1.00 . A A . 46 GLY HA3 1 1 1 638 1 1 46 GLY N N -7.560 23.544 8.034 1.00 . A A . 46 GLY N 1 1 1 639 1 1 46 GLY O O -4.864 23.583 5.740 1.00 . A A . 46 GLY O 1 1 1 640 2 2 1 ZN ZN ZN -0.403 4.366 -0.685 1.00 . B A . 201 ZN ZN 1 1 2 641 1 1 1 GLY C C -16.193 7.412 -12.592 1.00 . A A . 1 GLY C 1 1 2 642 1 1 1 GLY CA C -16.915 8.236 -13.640 1.00 . A A . 1 GLY CA 1 1 2 643 1 1 1 GLY H1 H -15.584 9.769 -14.240 1.00 . A A . 1 GLY H1 1 1 2 644 1 1 1 GLY HA2 H -17.965 8.276 -13.392 1.00 . A A . 1 GLY HA2 1 1 2 645 1 1 1 GLY HA3 H -16.801 7.755 -14.601 1.00 . A A . 1 GLY HA3 1 1 2 646 1 1 1 GLY N N -16.402 9.590 -13.732 1.00 . A A . 1 GLY N 1 1 2 647 1 1 1 GLY O O -16.080 7.825 -11.438 1.00 . A A . 1 GLY O 1 1 2 648 1 1 2 SER C C -14.037 4.445 -12.840 1.00 . A A . 2 SER C 1 1 2 649 1 1 2 SER CA C -14.995 5.356 -12.079 1.00 . A A . 2 SER CA 1 1 2 650 1 1 2 SER CB C -15.989 4.514 -11.278 1.00 . A A . 2 SER CB 1 1 2 651 1 1 2 SER H H -15.827 5.969 -13.927 1.00 . A A . 2 SER H 1 1 2 652 1 1 2 SER HA H -14.425 5.970 -11.398 1.00 . A A . 2 SER HA 1 1 2 653 1 1 2 SER HB2 H -16.904 5.071 -11.144 1.00 . A A . 2 SER HB2 1 1 2 654 1 1 2 SER HB3 H -16.199 3.601 -11.816 1.00 . A A . 2 SER HB3 1 1 2 655 1 1 2 SER HG H -14.703 3.609 -10.109 1.00 . A A . 2 SER HG 1 1 2 656 1 1 2 SER N N -15.705 6.243 -12.994 1.00 . A A . 2 SER N 1 1 2 657 1 1 2 SER O O -14.275 4.103 -13.998 1.00 . A A . 2 SER O 1 1 2 658 1 1 2 SER OG O -15.466 4.183 -10.003 1.00 . A A . 2 SER OG 1 1 2 659 1 1 3 SER C C -11.908 1.832 -12.094 1.00 . A A . 3 SER C 1 1 2 660 1 1 3 SER CA C -11.953 3.187 -12.794 1.00 . A A . 3 SER CA 1 1 2 661 1 1 3 SER CB C -10.573 3.846 -12.745 1.00 . A A . 3 SER CB 1 1 2 662 1 1 3 SER H H -12.816 4.362 -11.258 1.00 . A A . 3 SER H 1 1 2 663 1 1 3 SER HA H -12.234 3.037 -13.826 1.00 . A A . 3 SER HA 1 1 2 664 1 1 3 SER HB2 H -9.910 3.338 -13.429 1.00 . A A . 3 SER HB2 1 1 2 665 1 1 3 SER HB3 H -10.662 4.884 -13.033 1.00 . A A . 3 SER HB3 1 1 2 666 1 1 3 SER HG H -9.642 2.910 -11.298 1.00 . A A . 3 SER HG 1 1 2 667 1 1 3 SER N N -12.951 4.056 -12.180 1.00 . A A . 3 SER N 1 1 2 668 1 1 3 SER O O -12.302 1.706 -10.936 1.00 . A A . 3 SER O 1 1 2 669 1 1 3 SER OG O -10.022 3.779 -11.441 1.00 . A A . 3 SER OG 1 1 2 670 1 1 4 GLY C C -12.310 -1.480 -12.879 1.00 . A A . 4 GLY C 1 1 2 671 1 1 4 GLY CA C -11.334 -0.512 -12.240 1.00 . A A . 4 GLY CA 1 1 2 672 1 1 4 GLY H H -11.123 0.980 -13.727 1.00 . A A . 4 GLY H 1 1 2 673 1 1 4 GLY HA2 H -10.330 -0.885 -12.380 1.00 . A A . 4 GLY HA2 1 1 2 674 1 1 4 GLY HA3 H -11.542 -0.455 -11.182 1.00 . A A . 4 GLY HA3 1 1 2 675 1 1 4 GLY N N -11.423 0.821 -12.808 1.00 . A A . 4 GLY N 1 1 2 676 1 1 4 GLY O O -12.767 -1.262 -14.001 1.00 . A A . 4 GLY O 1 1 2 677 1 1 5 SER C C -13.406 -3.726 -14.179 1.00 . A A . 5 SER C 1 1 2 678 1 1 5 SER CA C -13.554 -3.562 -12.669 1.00 . A A . 5 SER CA 1 1 2 679 1 1 5 SER CB C -14.995 -3.182 -12.325 1.00 . A A . 5 SER CB 1 1 2 680 1 1 5 SER H H -12.233 -2.672 -11.275 1.00 . A A . 5 SER H 1 1 2 681 1 1 5 SER HA H -13.315 -4.501 -12.192 1.00 . A A . 5 SER HA 1 1 2 682 1 1 5 SER HB2 H -15.028 -2.771 -11.328 1.00 . A A . 5 SER HB2 1 1 2 683 1 1 5 SER HB3 H -15.348 -2.444 -13.031 1.00 . A A . 5 SER HB3 1 1 2 684 1 1 5 SER HG H -16.202 -4.490 -11.507 1.00 . A A . 5 SER HG 1 1 2 685 1 1 5 SER N N -12.630 -2.554 -12.164 1.00 . A A . 5 SER N 1 1 2 686 1 1 5 SER O O -14.396 -3.839 -14.902 1.00 . A A . 5 SER O 1 1 2 687 1 1 5 SER OG O -15.848 -4.312 -12.381 1.00 . A A . 5 SER OG 1 1 2 688 1 1 6 SER C C -11.826 -5.357 -16.465 1.00 . A A . 6 SER C 1 1 2 689 1 1 6 SER CA C -11.883 -3.884 -16.071 1.00 . A A . 6 SER CA 1 1 2 690 1 1 6 SER CB C -10.563 -3.198 -16.427 1.00 . A A . 6 SER CB 1 1 2 691 1 1 6 SER H H -11.415 -3.644 -14.020 1.00 . A A . 6 SER H 1 1 2 692 1 1 6 SER HA H -12.685 -3.409 -16.617 1.00 . A A . 6 SER HA 1 1 2 693 1 1 6 SER HB2 H -9.767 -3.628 -15.838 1.00 . A A . 6 SER HB2 1 1 2 694 1 1 6 SER HB3 H -10.355 -3.345 -17.477 1.00 . A A . 6 SER HB3 1 1 2 695 1 1 6 SER HG H -10.996 -1.353 -16.925 1.00 . A A . 6 SER HG 1 1 2 696 1 1 6 SER N N -12.162 -3.738 -14.647 1.00 . A A . 6 SER N 1 1 2 697 1 1 6 SER O O -12.450 -5.775 -17.440 1.00 . A A . 6 SER O 1 1 2 698 1 1 6 SER OG O -10.625 -1.806 -16.164 1.00 . A A . 6 SER OG 1 1 2 699 1 1 7 GLY C C -9.969 -8.250 -15.054 1.00 . A A . 7 GLY C 1 1 2 700 1 1 7 GLY CA C -10.945 -7.557 -15.983 1.00 . A A . 7 GLY CA 1 1 2 701 1 1 7 GLY H H -10.597 -5.751 -14.935 1.00 . A A . 7 GLY H 1 1 2 702 1 1 7 GLY HA2 H -11.915 -8.021 -15.881 1.00 . A A . 7 GLY HA2 1 1 2 703 1 1 7 GLY HA3 H -10.605 -7.679 -17.001 1.00 . A A . 7 GLY HA3 1 1 2 704 1 1 7 GLY N N -11.072 -6.139 -15.699 1.00 . A A . 7 GLY N 1 1 2 705 1 1 7 GLY O O -9.693 -7.765 -13.956 1.00 . A A . 7 GLY O 1 1 2 706 1 1 8 THR C C -7.067 -9.669 -14.923 1.00 . A A . 8 THR C 1 1 2 707 1 1 8 THR CA C -8.494 -10.152 -14.692 1.00 . A A . 8 THR CA 1 1 2 708 1 1 8 THR CB C -8.572 -11.657 -15.011 1.00 . A A . 8 THR CB 1 1 2 709 1 1 8 THR CG2 C -7.674 -12.455 -14.078 1.00 . A A . 8 THR CG2 1 1 2 710 1 1 8 THR H H -9.703 -9.725 -16.377 1.00 . A A . 8 THR H 1 1 2 711 1 1 8 THR HA H -8.748 -10.012 -13.651 1.00 . A A . 8 THR HA 1 1 2 712 1 1 8 THR HB H -8.239 -11.812 -16.027 1.00 . A A . 8 THR HB 1 1 2 713 1 1 8 THR HG1 H -10.397 -11.553 -14.269 1.00 . A A . 8 THR HG1 1 1 2 714 1 1 8 THR HG21 H -8.227 -12.726 -13.191 1.00 . A A . 8 THR HG21 1 1 2 715 1 1 8 THR HG22 H -6.820 -11.855 -13.800 1.00 . A A . 8 THR HG22 1 1 2 716 1 1 8 THR HG23 H -7.337 -13.350 -14.580 1.00 . A A . 8 THR HG23 1 1 2 717 1 1 8 THR N N -9.444 -9.390 -15.493 1.00 . A A . 8 THR N 1 1 2 718 1 1 8 THR O O -6.579 -9.660 -16.052 1.00 . A A . 8 THR O 1 1 2 719 1 1 8 THR OG1 O -9.924 -12.115 -14.887 1.00 . A A . 8 THR OG1 1 1 2 720 1 1 9 GLY C C -4.730 -7.682 -12.961 1.00 . A A . 9 GLY C 1 1 2 721 1 1 9 GLY CA C -5.036 -8.789 -13.951 1.00 . A A . 9 GLY CA 1 1 2 722 1 1 9 GLY H H -6.841 -9.297 -12.969 1.00 . A A . 9 GLY H 1 1 2 723 1 1 9 GLY HA2 H -4.362 -9.613 -13.773 1.00 . A A . 9 GLY HA2 1 1 2 724 1 1 9 GLY HA3 H -4.875 -8.415 -14.952 1.00 . A A . 9 GLY HA3 1 1 2 725 1 1 9 GLY N N -6.401 -9.268 -13.844 1.00 . A A . 9 GLY N 1 1 2 726 1 1 9 GLY O O -4.216 -6.630 -13.337 1.00 . A A . 9 GLY O 1 1 2 727 1 1 10 GLU C C -4.008 -7.542 -9.499 1.00 . A A . 10 GLU C 1 1 2 728 1 1 10 GLU CA C -4.808 -6.933 -10.647 1.00 . A A . 10 GLU CA 1 1 2 729 1 1 10 GLU CB C -6.134 -6.378 -10.122 1.00 . A A . 10 GLU CB 1 1 2 730 1 1 10 GLU CD C -8.317 -6.856 -8.945 1.00 . A A . 10 GLU CD 1 1 2 731 1 1 10 GLU CG C -7.045 -7.440 -9.530 1.00 . A A . 10 GLU CG 1 1 2 732 1 1 10 GLU H H -5.457 -8.779 -11.455 1.00 . A A . 10 GLU H 1 1 2 733 1 1 10 GLU HA H -4.236 -6.125 -11.079 1.00 . A A . 10 GLU HA 1 1 2 734 1 1 10 GLU HB2 H -5.926 -5.644 -9.358 1.00 . A A . 10 GLU HB2 1 1 2 735 1 1 10 GLU HB3 H -6.657 -5.899 -10.936 1.00 . A A . 10 GLU HB3 1 1 2 736 1 1 10 GLU HG2 H -7.313 -8.141 -10.306 1.00 . A A . 10 GLU HG2 1 1 2 737 1 1 10 GLU HG3 H -6.512 -7.958 -8.747 1.00 . A A . 10 GLU HG3 1 1 2 738 1 1 10 GLU N N -5.050 -7.920 -11.693 1.00 . A A . 10 GLU N 1 1 2 739 1 1 10 GLU O O -3.668 -8.725 -9.522 1.00 . A A . 10 GLU O 1 1 2 740 1 1 10 GLU OE1 O -8.763 -5.796 -9.432 1.00 . A A . 10 GLU OE1 1 1 2 741 1 1 10 GLU OE2 O -8.867 -7.460 -8.000 1.00 . A A . 10 GLU OE2 1 1 2 742 1 1 11 LYS C C -3.869 -7.392 -6.134 1.00 . A A . 11 LYS C 1 1 2 743 1 1 11 LYS CA C -2.953 -7.180 -7.335 1.00 . A A . 11 LYS CA 1 1 2 744 1 1 11 LYS CB C -1.860 -6.168 -6.985 1.00 . A A . 11 LYS CB 1 1 2 745 1 1 11 LYS CD C -1.084 -5.388 -9.243 1.00 . A A . 11 LYS CD 1 1 2 746 1 1 11 LYS CE C 0.124 -5.180 -10.144 1.00 . A A . 11 LYS CE 1 1 2 747 1 1 11 LYS CG C -0.711 -6.144 -7.978 1.00 . A A . 11 LYS CG 1 1 2 748 1 1 11 LYS H H -4.011 -5.792 -8.532 1.00 . A A . 11 LYS H 1 1 2 749 1 1 11 LYS HA H -2.490 -8.122 -7.591 1.00 . A A . 11 LYS HA 1 1 2 750 1 1 11 LYS HB2 H -2.298 -5.181 -6.949 1.00 . A A . 11 LYS HB2 1 1 2 751 1 1 11 LYS HB3 H -1.460 -6.410 -6.010 1.00 . A A . 11 LYS HB3 1 1 2 752 1 1 11 LYS HD2 H -1.828 -5.953 -9.784 1.00 . A A . 11 LYS HD2 1 1 2 753 1 1 11 LYS HD3 H -1.489 -4.424 -8.970 1.00 . A A . 11 LYS HD3 1 1 2 754 1 1 11 LYS HE2 H -0.153 -4.515 -10.947 1.00 . A A . 11 LYS HE2 1 1 2 755 1 1 11 LYS HE3 H 0.917 -4.732 -9.563 1.00 . A A . 11 LYS HE3 1 1 2 756 1 1 11 LYS HG2 H 0.139 -5.661 -7.521 1.00 . A A . 11 LYS HG2 1 1 2 757 1 1 11 LYS HG3 H -0.453 -7.160 -8.240 1.00 . A A . 11 LYS HG3 1 1 2 758 1 1 11 LYS HZ1 H 0.769 -7.159 -9.967 1.00 . A A . 11 LYS HZ1 1 1 2 759 1 1 11 LYS HZ2 H 1.508 -6.308 -11.229 1.00 . A A . 11 LYS HZ2 1 1 2 760 1 1 11 LYS HZ3 H -0.089 -6.843 -11.390 1.00 . A A . 11 LYS HZ3 1 1 2 761 1 1 11 LYS N N -3.711 -6.725 -8.494 1.00 . A A . 11 LYS N 1 1 2 762 1 1 11 LYS NZ N 0.612 -6.462 -10.723 1.00 . A A . 11 LYS NZ 1 1 2 763 1 1 11 LYS O O -4.834 -6.658 -5.922 1.00 . A A . 11 LYS O 1 1 2 764 1 1 12 PRO C C -4.185 -7.706 -3.030 1.00 . A A . 12 PRO C 1 1 2 765 1 1 12 PRO CA C -4.343 -8.748 -4.132 1.00 . A A . 12 PRO CA 1 1 2 766 1 1 12 PRO CB C -3.759 -10.091 -3.686 1.00 . A A . 12 PRO CB 1 1 2 767 1 1 12 PRO CD C -2.424 -9.334 -5.519 1.00 . A A . 12 PRO CD 1 1 2 768 1 1 12 PRO CG C -2.370 -10.098 -4.224 1.00 . A A . 12 PRO CG 1 1 2 769 1 1 12 PRO HA H -5.391 -8.868 -4.365 1.00 . A A . 12 PRO HA 1 1 2 770 1 1 12 PRO HB2 H -3.766 -10.148 -2.607 1.00 . A A . 12 PRO HB2 1 1 2 771 1 1 12 PRO HB3 H -4.347 -10.897 -4.098 1.00 . A A . 12 PRO HB3 1 1 2 772 1 1 12 PRO HD2 H -1.507 -8.785 -5.671 1.00 . A A . 12 PRO HD2 1 1 2 773 1 1 12 PRO HD3 H -2.606 -10.005 -6.345 1.00 . A A . 12 PRO HD3 1 1 2 774 1 1 12 PRO HG2 H -1.704 -9.611 -3.529 1.00 . A A . 12 PRO HG2 1 1 2 775 1 1 12 PRO HG3 H -2.051 -11.115 -4.402 1.00 . A A . 12 PRO HG3 1 1 2 776 1 1 12 PRO N N -3.560 -8.418 -5.327 1.00 . A A . 12 PRO N 1 1 2 777 1 1 12 PRO O O -5.148 -7.366 -2.342 1.00 . A A . 12 PRO O 1 1 2 778 1 1 13 TYR C C -2.828 -4.791 -2.413 1.00 . A A . 13 TYR C 1 1 2 779 1 1 13 TYR CA C -2.683 -6.201 -1.848 1.00 . A A . 13 TYR CA 1 1 2 780 1 1 13 TYR CB C -1.272 -6.395 -1.290 1.00 . A A . 13 TYR CB 1 1 2 781 1 1 13 TYR CD1 C -1.389 -8.126 0.545 1.00 . A A . 13 TYR CD1 1 1 2 782 1 1 13 TYR CD2 C -0.415 -8.758 -1.537 1.00 . A A . 13 TYR CD2 1 1 2 783 1 1 13 TYR CE1 C -1.161 -9.395 1.042 1.00 . A A . 13 TYR CE1 1 1 2 784 1 1 13 TYR CE2 C -0.184 -10.029 -1.049 1.00 . A A . 13 TYR CE2 1 1 2 785 1 1 13 TYR CG C -1.021 -7.786 -0.751 1.00 . A A . 13 TYR CG 1 1 2 786 1 1 13 TYR CZ C -0.559 -10.343 0.241 1.00 . A A . 13 TYR CZ 1 1 2 787 1 1 13 TYR H H -2.240 -7.513 -3.447 1.00 . A A . 13 TYR H 1 1 2 788 1 1 13 TYR HA H -3.397 -6.331 -1.048 1.00 . A A . 13 TYR HA 1 1 2 789 1 1 13 TYR HB2 H -0.554 -6.209 -2.073 1.00 . A A . 13 TYR HB2 1 1 2 790 1 1 13 TYR HB3 H -1.111 -5.693 -0.485 1.00 . A A . 13 TYR HB3 1 1 2 791 1 1 13 TYR HD1 H -1.860 -7.382 1.170 1.00 . A A . 13 TYR HD1 1 1 2 792 1 1 13 TYR HD2 H -0.123 -8.509 -2.547 1.00 . A A . 13 TYR HD2 1 1 2 793 1 1 13 TYR HE1 H -1.454 -9.641 2.052 1.00 . A A . 13 TYR HE1 1 1 2 794 1 1 13 TYR HE2 H 0.288 -10.772 -1.675 1.00 . A A . 13 TYR HE2 1 1 2 795 1 1 13 TYR HH H -0.286 -12.231 0.003 1.00 . A A . 13 TYR HH 1 1 2 796 1 1 13 TYR N N -2.967 -7.203 -2.868 1.00 . A A . 13 TYR N 1 1 2 797 1 1 13 TYR O O -2.371 -4.504 -3.520 1.00 . A A . 13 TYR O 1 1 2 798 1 1 13 TYR OH O -0.329 -11.608 0.732 1.00 . A A . 13 TYR OH 1 1 2 799 1 1 14 ARG C C -3.543 -1.579 -0.886 1.00 . A A . 14 ARG C 1 1 2 800 1 1 14 ARG CA C -3.674 -2.536 -2.068 1.00 . A A . 14 ARG CA 1 1 2 801 1 1 14 ARG CB C -5.052 -2.379 -2.714 1.00 . A A . 14 ARG CB 1 1 2 802 1 1 14 ARG CD C -6.802 -0.657 -3.250 1.00 . A A . 14 ARG CD 1 1 2 803 1 1 14 ARG CG C -5.317 -0.982 -3.253 1.00 . A A . 14 ARG CG 1 1 2 804 1 1 14 ARG CZ C -7.680 -1.221 -5.476 1.00 . A A . 14 ARG CZ 1 1 2 805 1 1 14 ARG H H -3.809 -4.204 -0.773 1.00 . A A . 14 ARG H 1 1 2 806 1 1 14 ARG HA H -2.915 -2.295 -2.797 1.00 . A A . 14 ARG HA 1 1 2 807 1 1 14 ARG HB2 H -5.135 -3.078 -3.533 1.00 . A A . 14 ARG HB2 1 1 2 808 1 1 14 ARG HB3 H -5.809 -2.607 -1.979 1.00 . A A . 14 ARG HB3 1 1 2 809 1 1 14 ARG HD2 H -7.189 -0.811 -2.254 1.00 . A A . 14 ARG HD2 1 1 2 810 1 1 14 ARG HD3 H -6.931 0.378 -3.530 1.00 . A A . 14 ARG HD3 1 1 2 811 1 1 14 ARG HE H -7.972 -2.305 -3.827 1.00 . A A . 14 ARG HE 1 1 2 812 1 1 14 ARG HG2 H -4.801 -0.264 -2.633 1.00 . A A . 14 ARG HG2 1 1 2 813 1 1 14 ARG HG3 H -4.945 -0.920 -4.264 1.00 . A A . 14 ARG HG3 1 1 2 814 1 1 14 ARG HH11 H -6.594 0.480 -5.397 1.00 . A A . 14 ARG HH11 1 1 2 815 1 1 14 ARG HH12 H -7.218 0.070 -6.960 1.00 . A A . 14 ARG HH12 1 1 2 816 1 1 14 ARG HH21 H -8.800 -2.855 -5.880 1.00 . A A . 14 ARG HH21 1 1 2 817 1 1 14 ARG HH22 H -8.473 -1.827 -7.234 1.00 . A A . 14 ARG HH22 1 1 2 818 1 1 14 ARG N N -3.468 -3.915 -1.645 1.00 . A A . 14 ARG N 1 1 2 819 1 1 14 ARG NE N -7.549 -1.497 -4.183 1.00 . A A . 14 ARG NE 1 1 2 820 1 1 14 ARG NH1 N -7.118 -0.134 -5.986 1.00 . A A . 14 ARG NH1 1 1 2 821 1 1 14 ARG NH2 N -8.375 -2.035 -6.261 1.00 . A A . 14 ARG NH2 1 1 2 822 1 1 14 ARG O O -3.852 -1.934 0.251 1.00 . A A . 14 ARG O 1 1 2 823 1 1 15 CYS C C -4.241 1.297 0.227 1.00 . A A . 15 CYS C 1 1 2 824 1 1 15 CYS CA C -2.908 0.644 -0.125 1.00 . A A . 15 CYS CA 1 1 2 825 1 1 15 CYS CB C -1.910 1.710 -0.582 1.00 . A A . 15 CYS CB 1 1 2 826 1 1 15 CYS H H -2.852 -0.140 -2.091 1.00 . A A . 15 CYS H 1 1 2 827 1 1 15 CYS HA H -2.519 0.152 0.753 1.00 . A A . 15 CYS HA 1 1 2 828 1 1 15 CYS HB2 H -1.060 1.224 -1.039 1.00 . A A . 15 CYS HB2 1 1 2 829 1 1 15 CYS HB3 H -2.387 2.350 -1.309 1.00 . A A . 15 CYS HB3 1 1 2 830 1 1 15 CYS N N -3.082 -0.364 -1.164 1.00 . A A . 15 CYS N 1 1 2 831 1 1 15 CYS O O -4.902 1.885 -0.629 1.00 . A A . 15 CYS O 1 1 2 832 1 1 15 CYS SG S -1.284 2.767 0.763 1.00 . A A . 15 CYS SG 1 1 2 833 1 1 16 ALA C C -5.706 3.245 2.310 1.00 . A A . 16 ALA C 1 1 2 834 1 1 16 ALA CA C -5.882 1.771 1.960 1.00 . A A . 16 ALA CA 1 1 2 835 1 1 16 ALA CB C -6.407 1.000 3.163 1.00 . A A . 16 ALA CB 1 1 2 836 1 1 16 ALA H H -4.060 0.709 2.129 1.00 . A A . 16 ALA H 1 1 2 837 1 1 16 ALA HA H -6.608 1.685 1.164 1.00 . A A . 16 ALA HA 1 1 2 838 1 1 16 ALA HB1 H -6.958 0.136 2.823 1.00 . A A . 16 ALA HB1 1 1 2 839 1 1 16 ALA HB2 H -5.576 0.680 3.774 1.00 . A A . 16 ALA HB2 1 1 2 840 1 1 16 ALA HB3 H -7.057 1.637 3.743 1.00 . A A . 16 ALA HB3 1 1 2 841 1 1 16 ALA N N -4.630 1.190 1.494 1.00 . A A . 16 ALA N 1 1 2 842 1 1 16 ALA O O -6.385 3.767 3.194 1.00 . A A . 16 ALA O 1 1 2 843 1 1 17 GLU C C -4.636 6.124 0.557 1.00 . A A . 17 GLU C 1 1 2 844 1 1 17 GLU CA C -4.526 5.323 1.852 1.00 . A A . 17 GLU CA 1 1 2 845 1 1 17 GLU CB C -3.134 5.508 2.461 1.00 . A A . 17 GLU CB 1 1 2 846 1 1 17 GLU CD C -3.427 6.035 4.914 1.00 . A A . 17 GLU CD 1 1 2 847 1 1 17 GLU CG C -3.022 4.996 3.887 1.00 . A A . 17 GLU CG 1 1 2 848 1 1 17 GLU H H -4.282 3.438 0.920 1.00 . A A . 17 GLU H 1 1 2 849 1 1 17 GLU HA H -5.265 5.685 2.549 1.00 . A A . 17 GLU HA 1 1 2 850 1 1 17 GLU HB2 H -2.415 4.980 1.853 1.00 . A A . 17 GLU HB2 1 1 2 851 1 1 17 GLU HB3 H -2.891 6.560 2.459 1.00 . A A . 17 GLU HB3 1 1 2 852 1 1 17 GLU HG2 H -3.663 4.134 3.999 1.00 . A A . 17 GLU HG2 1 1 2 853 1 1 17 GLU HG3 H -1.998 4.708 4.073 1.00 . A A . 17 GLU HG3 1 1 2 854 1 1 17 GLU N N -4.791 3.909 1.612 1.00 . A A . 17 GLU N 1 1 2 855 1 1 17 GLU O O -5.269 7.180 0.520 1.00 . A A . 17 GLU O 1 1 2 856 1 1 17 GLU OE1 O -4.576 6.521 4.844 1.00 . A A . 17 GLU OE1 1 1 2 857 1 1 17 GLU OE2 O -2.597 6.363 5.787 1.00 . A A . 17 GLU OE2 1 1 2 858 1 1 18 CYS C C -4.728 5.409 -2.844 1.00 . A A . 18 CYS C 1 1 2 859 1 1 18 CYS CA C -4.042 6.282 -1.798 1.00 . A A . 18 CYS CA 1 1 2 860 1 1 18 CYS CB C -2.620 6.618 -2.251 1.00 . A A . 18 CYS CB 1 1 2 861 1 1 18 CYS H H -3.527 4.770 -0.409 1.00 . A A . 18 CYS H 1 1 2 862 1 1 18 CYS HA H -4.602 7.198 -1.688 1.00 . A A . 18 CYS HA 1 1 2 863 1 1 18 CYS HB2 H -2.653 6.997 -3.262 1.00 . A A . 18 CYS HB2 1 1 2 864 1 1 18 CYS HB3 H -2.213 7.379 -1.600 1.00 . A A . 18 CYS HB3 1 1 2 865 1 1 18 CYS N N -4.016 5.615 -0.501 1.00 . A A . 18 CYS N 1 1 2 866 1 1 18 CYS O O -5.626 5.861 -3.554 1.00 . A A . 18 CYS O 1 1 2 867 1 1 18 CYS SG S -1.478 5.200 -2.229 1.00 . A A . 18 CYS SG 1 1 2 868 1 1 19 GLY C C -3.836 2.555 -4.755 1.00 . A A . 19 GLY C 1 1 2 869 1 1 19 GLY CA C -4.882 3.237 -3.896 1.00 . A A . 19 GLY CA 1 1 2 870 1 1 19 GLY H H -3.580 3.848 -2.342 1.00 . A A . 19 GLY H 1 1 2 871 1 1 19 GLY HA2 H -5.443 2.483 -3.364 1.00 . A A . 19 GLY HA2 1 1 2 872 1 1 19 GLY HA3 H -5.555 3.787 -4.537 1.00 . A A . 19 GLY HA3 1 1 2 873 1 1 19 GLY N N -4.299 4.154 -2.934 1.00 . A A . 19 GLY N 1 1 2 874 1 1 19 GLY O O -4.049 2.334 -5.947 1.00 . A A . 19 GLY O 1 1 2 875 1 1 20 LYS C C -1.821 0.050 -4.890 1.00 . A A . 20 LYS C 1 1 2 876 1 1 20 LYS CA C -1.616 1.562 -4.866 1.00 . A A . 20 LYS CA 1 1 2 877 1 1 20 LYS CB C -0.271 1.895 -4.217 1.00 . A A . 20 LYS CB 1 1 2 878 1 1 20 LYS CD C 1.117 3.236 -5.824 1.00 . A A . 20 LYS CD 1 1 2 879 1 1 20 LYS CE C 1.741 3.113 -7.206 1.00 . A A . 20 LYS CE 1 1 2 880 1 1 20 LYS CG C 0.895 1.874 -5.189 1.00 . A A . 20 LYS CG 1 1 2 881 1 1 20 LYS H H -2.591 2.424 -3.197 1.00 . A A . 20 LYS H 1 1 2 882 1 1 20 LYS HA H -1.617 1.929 -5.881 1.00 . A A . 20 LYS HA 1 1 2 883 1 1 20 LYS HB2 H -0.331 2.880 -3.780 1.00 . A A . 20 LYS HB2 1 1 2 884 1 1 20 LYS HB3 H -0.075 1.175 -3.436 1.00 . A A . 20 LYS HB3 1 1 2 885 1 1 20 LYS HD2 H 0.167 3.741 -5.914 1.00 . A A . 20 LYS HD2 1 1 2 886 1 1 20 LYS HD3 H 1.775 3.815 -5.192 1.00 . A A . 20 LYS HD3 1 1 2 887 1 1 20 LYS HE2 H 2.026 4.096 -7.547 1.00 . A A . 20 LYS HE2 1 1 2 888 1 1 20 LYS HE3 H 2.618 2.487 -7.135 1.00 . A A . 20 LYS HE3 1 1 2 889 1 1 20 LYS HG2 H 1.790 1.586 -4.658 1.00 . A A . 20 LYS HG2 1 1 2 890 1 1 20 LYS HG3 H 0.690 1.153 -5.968 1.00 . A A . 20 LYS HG3 1 1 2 891 1 1 20 LYS HZ1 H -0.152 2.923 -8.069 1.00 . A A . 20 LYS HZ1 1 1 2 892 1 1 20 LYS HZ2 H 0.739 1.485 -8.048 1.00 . A A . 20 LYS HZ2 1 1 2 893 1 1 20 LYS HZ3 H 1.123 2.701 -9.158 1.00 . A A . 20 LYS HZ3 1 1 2 894 1 1 20 LYS N N -2.701 2.222 -4.150 1.00 . A A . 20 LYS N 1 1 2 895 1 1 20 LYS NZ N 0.796 2.514 -8.189 1.00 . A A . 20 LYS NZ 1 1 2 896 1 1 20 LYS O O -2.469 -0.512 -4.008 1.00 . A A . 20 LYS O 1 1 2 897 1 1 21 ALA C C -0.054 -2.738 -5.742 1.00 . A A . 21 ALA C 1 1 2 898 1 1 21 ALA CA C -1.381 -2.049 -6.041 1.00 . A A . 21 ALA CA 1 1 2 899 1 1 21 ALA CB C -1.863 -2.410 -7.438 1.00 . A A . 21 ALA CB 1 1 2 900 1 1 21 ALA H H -0.758 -0.099 -6.577 1.00 . A A . 21 ALA H 1 1 2 901 1 1 21 ALA HA H -2.121 -2.391 -5.331 1.00 . A A . 21 ALA HA 1 1 2 902 1 1 21 ALA HB1 H -2.554 -3.237 -7.377 1.00 . A A . 21 ALA HB1 1 1 2 903 1 1 21 ALA HB2 H -2.360 -1.557 -7.878 1.00 . A A . 21 ALA HB2 1 1 2 904 1 1 21 ALA HB3 H -1.018 -2.689 -8.049 1.00 . A A . 21 ALA HB3 1 1 2 905 1 1 21 ALA N N -1.263 -0.602 -5.905 1.00 . A A . 21 ALA N 1 1 2 906 1 1 21 ALA O O 1.013 -2.230 -6.087 1.00 . A A . 21 ALA O 1 1 2 907 1 1 22 PHE C C 0.790 -6.158 -4.788 1.00 . A A . 22 PHE C 1 1 2 908 1 1 22 PHE CA C 1.068 -4.658 -4.751 1.00 . A A . 22 PHE CA 1 1 2 909 1 1 22 PHE CB C 1.569 -4.255 -3.363 1.00 . A A . 22 PHE CB 1 1 2 910 1 1 22 PHE CD1 C 2.919 -2.171 -3.728 1.00 . A A . 22 PHE CD1 1 1 2 911 1 1 22 PHE CD2 C 0.855 -1.991 -2.548 1.00 . A A . 22 PHE CD2 1 1 2 912 1 1 22 PHE CE1 C 3.121 -0.811 -3.589 1.00 . A A . 22 PHE CE1 1 1 2 913 1 1 22 PHE CE2 C 1.052 -0.631 -2.406 1.00 . A A . 22 PHE CE2 1 1 2 914 1 1 22 PHE CG C 1.785 -2.776 -3.210 1.00 . A A . 22 PHE CG 1 1 2 915 1 1 22 PHE CZ C 2.187 -0.040 -2.926 1.00 . A A . 22 PHE CZ 1 1 2 916 1 1 22 PHE H H -1.008 -4.253 -4.850 1.00 . A A . 22 PHE H 1 1 2 917 1 1 22 PHE HA H 1.829 -4.427 -5.480 1.00 . A A . 22 PHE HA 1 1 2 918 1 1 22 PHE HB2 H 0.845 -4.561 -2.623 1.00 . A A . 22 PHE HB2 1 1 2 919 1 1 22 PHE HB3 H 2.508 -4.751 -3.169 1.00 . A A . 22 PHE HB3 1 1 2 920 1 1 22 PHE HD1 H 3.652 -2.774 -4.246 1.00 . A A . 22 PHE HD1 1 1 2 921 1 1 22 PHE HD2 H -0.032 -2.452 -2.139 1.00 . A A . 22 PHE HD2 1 1 2 922 1 1 22 PHE HE1 H 4.010 -0.353 -3.997 1.00 . A A . 22 PHE HE1 1 1 2 923 1 1 22 PHE HE2 H 0.320 -0.030 -1.887 1.00 . A A . 22 PHE HE2 1 1 2 924 1 1 22 PHE HZ H 2.342 1.023 -2.818 1.00 . A A . 22 PHE HZ 1 1 2 925 1 1 22 PHE N N -0.128 -3.899 -5.098 1.00 . A A . 22 PHE N 1 1 2 926 1 1 22 PHE O O -0.191 -6.634 -4.214 1.00 . A A . 22 PHE O 1 1 2 927 1 1 23 THR C C 1.870 -9.039 -4.274 1.00 . A A . 23 THR C 1 1 2 928 1 1 23 THR CA C 1.508 -8.343 -5.582 1.00 . A A . 23 THR CA 1 1 2 929 1 1 23 THR CB C 2.385 -8.913 -6.713 1.00 . A A . 23 THR CB 1 1 2 930 1 1 23 THR CG2 C 1.922 -8.399 -8.068 1.00 . A A . 23 THR CG2 1 1 2 931 1 1 23 THR H H 2.421 -6.461 -5.903 1.00 . A A . 23 THR H 1 1 2 932 1 1 23 THR HA H 0.474 -8.553 -5.816 1.00 . A A . 23 THR HA 1 1 2 933 1 1 23 THR HB H 2.302 -9.990 -6.705 1.00 . A A . 23 THR HB 1 1 2 934 1 1 23 THR HG1 H 4.322 -9.126 -7.018 1.00 . A A . 23 THR HG1 1 1 2 935 1 1 23 THR HG21 H 1.843 -7.323 -8.036 1.00 . A A . 23 THR HG21 1 1 2 936 1 1 23 THR HG22 H 0.957 -8.824 -8.303 1.00 . A A . 23 THR HG22 1 1 2 937 1 1 23 THR HG23 H 2.636 -8.686 -8.825 1.00 . A A . 23 THR HG23 1 1 2 938 1 1 23 THR N N 1.660 -6.898 -5.468 1.00 . A A . 23 THR N 1 1 2 939 1 1 23 THR O O 1.368 -10.123 -3.978 1.00 . A A . 23 THR O 1 1 2 940 1 1 23 THR OG1 O 3.754 -8.549 -6.502 1.00 . A A . 23 THR OG1 1 1 2 941 1 1 24 ASP C C 3.162 -7.899 -1.129 1.00 . A A . 24 ASP C 1 1 2 942 1 1 24 ASP CA C 3.170 -8.967 -2.219 1.00 . A A . 24 ASP CA 1 1 2 943 1 1 24 ASP CB C 4.569 -9.573 -2.345 1.00 . A A . 24 ASP CB 1 1 2 944 1 1 24 ASP CG C 4.795 -10.230 -3.693 1.00 . A A . 24 ASP CG 1 1 2 945 1 1 24 ASP H H 3.107 -7.547 -3.788 1.00 . A A . 24 ASP H 1 1 2 946 1 1 24 ASP HA H 2.474 -9.746 -1.947 1.00 . A A . 24 ASP HA 1 1 2 947 1 1 24 ASP HB2 H 5.305 -8.793 -2.217 1.00 . A A . 24 ASP HB2 1 1 2 948 1 1 24 ASP HB3 H 4.702 -10.318 -1.575 1.00 . A A . 24 ASP HB3 1 1 2 949 1 1 24 ASP N N 2.743 -8.409 -3.496 1.00 . A A . 24 ASP N 1 1 2 950 1 1 24 ASP O O 3.873 -6.899 -1.221 1.00 . A A . 24 ASP O 1 1 2 951 1 1 24 ASP OD1 O 4.014 -11.136 -4.050 1.00 . A A . 24 ASP OD1 1 1 2 952 1 1 24 ASP OD2 O 5.753 -9.836 -4.390 1.00 . A A . 24 ASP OD2 1 1 2 953 1 1 25 ARG C C 3.615 -6.587 1.349 1.00 . A A . 25 ARG C 1 1 2 954 1 1 25 ARG CA C 2.249 -7.174 1.007 1.00 . A A . 25 ARG CA 1 1 2 955 1 1 25 ARG CB C 1.654 -7.860 2.238 1.00 . A A . 25 ARG CB 1 1 2 956 1 1 25 ARG CD C 1.789 -9.782 3.852 1.00 . A A . 25 ARG CD 1 1 2 957 1 1 25 ARG CG C 2.526 -8.974 2.796 1.00 . A A . 25 ARG CG 1 1 2 958 1 1 25 ARG CZ C 0.019 -9.365 5.506 1.00 . A A . 25 ARG CZ 1 1 2 959 1 1 25 ARG H H 1.809 -8.935 -0.082 1.00 . A A . 25 ARG H 1 1 2 960 1 1 25 ARG HA H 1.593 -6.374 0.700 1.00 . A A . 25 ARG HA 1 1 2 961 1 1 25 ARG HB2 H 1.511 -7.122 3.014 1.00 . A A . 25 ARG HB2 1 1 2 962 1 1 25 ARG HB3 H 0.696 -8.281 1.973 1.00 . A A . 25 ARG HB3 1 1 2 963 1 1 25 ARG HD2 H 1.110 -10.461 3.359 1.00 . A A . 25 ARG HD2 1 1 2 964 1 1 25 ARG HD3 H 2.512 -10.347 4.423 1.00 . A A . 25 ARG HD3 1 1 2 965 1 1 25 ARG HE H 1.284 -7.985 4.819 1.00 . A A . 25 ARG HE 1 1 2 966 1 1 25 ARG HG2 H 2.811 -9.633 1.989 1.00 . A A . 25 ARG HG2 1 1 2 967 1 1 25 ARG HG3 H 3.409 -8.539 3.238 1.00 . A A . 25 ARG HG3 1 1 2 968 1 1 25 ARG HH11 H 0.134 -11.271 4.846 1.00 . A A . 25 ARG HH11 1 1 2 969 1 1 25 ARG HH12 H -1.110 -10.964 6.012 1.00 . A A . 25 ARG HH12 1 1 2 970 1 1 25 ARG HH21 H -0.350 -7.568 6.355 1.00 . A A . 25 ARG HH21 1 1 2 971 1 1 25 ARG HH22 H -1.385 -8.857 6.870 1.00 . A A . 25 ARG HH22 1 1 2 972 1 1 25 ARG N N 2.351 -8.119 -0.099 1.00 . A A . 25 ARG N 1 1 2 973 1 1 25 ARG NE N 1.028 -8.929 4.762 1.00 . A A . 25 ARG NE 1 1 2 974 1 1 25 ARG NH1 N -0.350 -10.638 5.450 1.00 . A A . 25 ARG NH1 1 1 2 975 1 1 25 ARG NH2 N -0.625 -8.528 6.310 1.00 . A A . 25 ARG NH2 1 1 2 976 1 1 25 ARG O O 3.738 -5.393 1.621 1.00 . A A . 25 ARG O 1 1 2 977 1 1 26 SER C C 6.275 -5.623 1.055 1.00 . A A . 26 SER C 1 1 2 978 1 1 26 SER CA C 5.995 -7.001 1.647 1.00 . A A . 26 SER CA 1 1 2 979 1 1 26 SER CB C 7.012 -8.013 1.114 1.00 . A A . 26 SER CB 1 1 2 980 1 1 26 SER H H 4.476 -8.375 1.109 1.00 . A A . 26 SER H 1 1 2 981 1 1 26 SER HA H 6.085 -6.944 2.721 1.00 . A A . 26 SER HA 1 1 2 982 1 1 26 SER HB2 H 8.010 -7.640 1.285 1.00 . A A . 26 SER HB2 1 1 2 983 1 1 26 SER HB3 H 6.885 -8.953 1.632 1.00 . A A . 26 SER HB3 1 1 2 984 1 1 26 SER HG H 7.494 -7.727 -0.763 1.00 . A A . 26 SER HG 1 1 2 985 1 1 26 SER N N 4.638 -7.435 1.334 1.00 . A A . 26 SER N 1 1 2 986 1 1 26 SER O O 6.794 -4.738 1.734 1.00 . A A . 26 SER O 1 1 2 987 1 1 26 SER OG O 6.837 -8.229 -0.275 1.00 . A A . 26 SER OG 1 1 2 988 1 1 27 ASN C C 5.170 -3.117 -0.391 1.00 . A A . 27 ASN C 1 1 2 989 1 1 27 ASN CA C 6.139 -4.179 -0.900 1.00 . A A . 27 ASN CA 1 1 2 990 1 1 27 ASN CB C 5.973 -4.356 -2.411 1.00 . A A . 27 ASN CB 1 1 2 991 1 1 27 ASN CG C 7.104 -5.157 -3.027 1.00 . A A . 27 ASN CG 1 1 2 992 1 1 27 ASN H H 5.516 -6.193 -0.705 1.00 . A A . 27 ASN H 1 1 2 993 1 1 27 ASN HA H 7.149 -3.857 -0.693 1.00 . A A . 27 ASN HA 1 1 2 994 1 1 27 ASN HB2 H 5.044 -4.872 -2.606 1.00 . A A . 27 ASN HB2 1 1 2 995 1 1 27 ASN HB3 H 5.946 -3.384 -2.880 1.00 . A A . 27 ASN HB3 1 1 2 996 1 1 27 ASN HD21 H 5.985 -5.555 -4.622 1.00 . A A . 27 ASN HD21 1 1 2 997 1 1 27 ASN HD22 H 7.578 -6.223 -4.636 1.00 . A A . 27 ASN HD22 1 1 2 998 1 1 27 ASN N N 5.926 -5.449 -0.216 1.00 . A A . 27 ASN N 1 1 2 999 1 1 27 ASN ND2 N 6.865 -5.699 -4.215 1.00 . A A . 27 ASN ND2 1 1 2 1000 1 1 27 ASN O O 5.542 -1.958 -0.206 1.00 . A A . 27 ASN O 1 1 2 1001 1 1 27 ASN OD1 O 8.179 -5.286 -2.442 1.00 . A A . 27 ASN OD1 1 1 2 1002 1 1 28 LEU C C 3.353 -1.914 1.604 1.00 . A A . 28 LEU C 1 1 2 1003 1 1 28 LEU CA C 2.899 -2.604 0.322 1.00 . A A . 28 LEU CA 1 1 2 1004 1 1 28 LEU CB C 1.591 -3.356 0.570 1.00 . A A . 28 LEU CB 1 1 2 1005 1 1 28 LEU CD1 C 0.029 -1.396 0.554 1.00 . A A . 28 LEU CD1 1 1 2 1006 1 1 28 LEU CD2 C -0.644 -3.518 1.695 1.00 . A A . 28 LEU CD2 1 1 2 1007 1 1 28 LEU CG C 0.517 -2.597 1.350 1.00 . A A . 28 LEU CG 1 1 2 1008 1 1 28 LEU H H 3.687 -4.456 -0.332 1.00 . A A . 28 LEU H 1 1 2 1009 1 1 28 LEU HA H 2.736 -1.854 -0.438 1.00 . A A . 28 LEU HA 1 1 2 1010 1 1 28 LEU HB2 H 1.176 -3.623 -0.390 1.00 . A A . 28 LEU HB2 1 1 2 1011 1 1 28 LEU HB3 H 1.827 -4.256 1.120 1.00 . A A . 28 LEU HB3 1 1 2 1012 1 1 28 LEU HD11 H -0.682 -1.722 -0.190 1.00 . A A . 28 LEU HD11 1 1 2 1013 1 1 28 LEU HD12 H 0.868 -0.921 0.068 1.00 . A A . 28 LEU HD12 1 1 2 1014 1 1 28 LEU HD13 H -0.445 -0.691 1.221 1.00 . A A . 28 LEU HD13 1 1 2 1015 1 1 28 LEU HD21 H -0.923 -4.088 0.821 1.00 . A A . 28 LEU HD21 1 1 2 1016 1 1 28 LEU HD22 H -1.486 -2.927 2.024 1.00 . A A . 28 LEU HD22 1 1 2 1017 1 1 28 LEU HD23 H -0.346 -4.192 2.485 1.00 . A A . 28 LEU HD23 1 1 2 1018 1 1 28 LEU HG H 0.943 -2.233 2.275 1.00 . A A . 28 LEU HG 1 1 2 1019 1 1 28 LEU N N 3.924 -3.521 -0.166 1.00 . A A . 28 LEU N 1 1 2 1020 1 1 28 LEU O O 3.183 -0.705 1.765 1.00 . A A . 28 LEU O 1 1 2 1021 1 1 29 PHE C C 5.463 -1.069 3.552 1.00 . A A . 29 PHE C 1 1 2 1022 1 1 29 PHE CA C 4.413 -2.152 3.783 1.00 . A A . 29 PHE CA 1 1 2 1023 1 1 29 PHE CB C 5.000 -3.272 4.645 1.00 . A A . 29 PHE CB 1 1 2 1024 1 1 29 PHE CD1 C 2.962 -3.677 6.053 1.00 . A A . 29 PHE CD1 1 1 2 1025 1 1 29 PHE CD2 C 3.981 -5.542 4.972 1.00 . A A . 29 PHE CD2 1 1 2 1026 1 1 29 PHE CE1 C 2.004 -4.511 6.597 1.00 . A A . 29 PHE CE1 1 1 2 1027 1 1 29 PHE CE2 C 3.025 -6.381 5.513 1.00 . A A . 29 PHE CE2 1 1 2 1028 1 1 29 PHE CG C 3.960 -4.181 5.235 1.00 . A A . 29 PHE CG 1 1 2 1029 1 1 29 PHE CZ C 2.036 -5.865 6.327 1.00 . A A . 29 PHE CZ 1 1 2 1030 1 1 29 PHE H H 4.040 -3.646 2.329 1.00 . A A . 29 PHE H 1 1 2 1031 1 1 29 PHE HA H 3.570 -1.717 4.297 1.00 . A A . 29 PHE HA 1 1 2 1032 1 1 29 PHE HB2 H 5.661 -3.873 4.041 1.00 . A A . 29 PHE HB2 1 1 2 1033 1 1 29 PHE HB3 H 5.559 -2.834 5.458 1.00 . A A . 29 PHE HB3 1 1 2 1034 1 1 29 PHE HD1 H 2.936 -2.617 6.265 1.00 . A A . 29 PHE HD1 1 1 2 1035 1 1 29 PHE HD2 H 4.755 -5.947 4.336 1.00 . A A . 29 PHE HD2 1 1 2 1036 1 1 29 PHE HE1 H 1.232 -4.104 7.233 1.00 . A A . 29 PHE HE1 1 1 2 1037 1 1 29 PHE HE2 H 3.053 -7.439 5.300 1.00 . A A . 29 PHE HE2 1 1 2 1038 1 1 29 PHE HZ H 1.288 -6.518 6.750 1.00 . A A . 29 PHE HZ 1 1 2 1039 1 1 29 PHE N N 3.933 -2.689 2.515 1.00 . A A . 29 PHE N 1 1 2 1040 1 1 29 PHE O O 5.472 -0.042 4.232 1.00 . A A . 29 PHE O 1 1 2 1041 1 1 30 THR C C 6.823 0.949 1.727 1.00 . A A . 30 THR C 1 1 2 1042 1 1 30 THR CA C 7.403 -0.353 2.269 1.00 . A A . 30 THR CA 1 1 2 1043 1 1 30 THR CB C 8.388 -0.932 1.235 1.00 . A A . 30 THR CB 1 1 2 1044 1 1 30 THR CG2 C 9.550 0.022 1.003 1.00 . A A . 30 THR CG2 1 1 2 1045 1 1 30 THR H H 6.288 -2.143 2.082 1.00 . A A . 30 THR H 1 1 2 1046 1 1 30 THR HA H 7.948 -0.143 3.177 1.00 . A A . 30 THR HA 1 1 2 1047 1 1 30 THR HB H 7.864 -1.072 0.301 1.00 . A A . 30 THR HB 1 1 2 1048 1 1 30 THR HG1 H 8.850 -2.230 2.646 1.00 . A A . 30 THR HG1 1 1 2 1049 1 1 30 THR HG21 H 9.214 0.861 0.412 1.00 . A A . 30 THR HG21 1 1 2 1050 1 1 30 THR HG22 H 10.339 -0.494 0.477 1.00 . A A . 30 THR HG22 1 1 2 1051 1 1 30 THR HG23 H 9.921 0.375 1.953 1.00 . A A . 30 THR HG23 1 1 2 1052 1 1 30 THR N N 6.347 -1.306 2.588 1.00 . A A . 30 THR N 1 1 2 1053 1 1 30 THR O O 7.275 2.037 2.083 1.00 . A A . 30 THR O 1 1 2 1054 1 1 30 THR OG1 O 8.885 -2.196 1.687 1.00 . A A . 30 THR OG1 1 1 2 1055 1 1 31 HIS C C 4.383 2.771 1.326 1.00 . A A . 31 HIS C 1 1 2 1056 1 1 31 HIS CA C 5.174 1.999 0.275 1.00 . A A . 31 HIS CA 1 1 2 1057 1 1 31 HIS CB C 4.250 1.576 -0.867 1.00 . A A . 31 HIS CB 1 1 2 1058 1 1 31 HIS CD2 C 1.956 2.725 -0.485 1.00 . A A . 31 HIS CD2 1 1 2 1059 1 1 31 HIS CE1 C 2.048 4.176 -2.126 1.00 . A A . 31 HIS CE1 1 1 2 1060 1 1 31 HIS CG C 3.136 2.543 -1.125 1.00 . A A . 31 HIS CG 1 1 2 1061 1 1 31 HIS H H 5.501 -0.065 0.620 1.00 . A A . 31 HIS H 1 1 2 1062 1 1 31 HIS HA H 5.948 2.640 -0.118 1.00 . A A . 31 HIS HA 1 1 2 1063 1 1 31 HIS HB2 H 4.828 1.488 -1.775 1.00 . A A . 31 HIS HB2 1 1 2 1064 1 1 31 HIS HB3 H 3.811 0.617 -0.631 1.00 . A A . 31 HIS HB3 1 1 2 1065 1 1 31 HIS HD1 H 3.889 3.585 -2.793 1.00 . A A . 31 HIS HD1 1 1 2 1066 1 1 31 HIS HD2 H 1.598 2.171 0.371 1.00 . A A . 31 HIS HD2 1 1 2 1067 1 1 31 HIS HE1 H 1.792 4.972 -2.809 1.00 . A A . 31 HIS HE1 1 1 2 1068 1 1 31 HIS N N 5.818 0.830 0.865 1.00 . A A . 31 HIS N 1 1 2 1069 1 1 31 HIS ND1 N 3.162 3.466 -2.148 1.00 . A A . 31 HIS ND1 1 1 2 1070 1 1 31 HIS NE2 N 1.299 3.746 -1.127 1.00 . A A . 31 HIS NE2 1 1 2 1071 1 1 31 HIS O O 4.533 3.985 1.460 1.00 . A A . 31 HIS O 1 1 2 1072 1 1 32 GLN C C 3.539 3.692 3.904 1.00 . A A . 32 GLN C 1 1 2 1073 1 1 32 GLN CA C 2.726 2.679 3.105 1.00 . A A . 32 GLN CA 1 1 2 1074 1 1 32 GLN CB C 2.156 1.612 4.042 1.00 . A A . 32 GLN CB 1 1 2 1075 1 1 32 GLN CD C -0.356 1.812 3.863 1.00 . A A . 32 GLN CD 1 1 2 1076 1 1 32 GLN CG C 0.869 0.982 3.535 1.00 . A A . 32 GLN CG 1 1 2 1077 1 1 32 GLN H H 3.466 1.095 1.914 1.00 . A A . 32 GLN H 1 1 2 1078 1 1 32 GLN HA H 1.909 3.193 2.622 1.00 . A A . 32 GLN HA 1 1 2 1079 1 1 32 GLN HB2 H 2.890 0.831 4.167 1.00 . A A . 32 GLN HB2 1 1 2 1080 1 1 32 GLN HB3 H 1.956 2.064 5.003 1.00 . A A . 32 GLN HB3 1 1 2 1081 1 1 32 GLN HE21 H -1.281 0.207 4.585 1.00 . A A . 32 GLN HE21 1 1 2 1082 1 1 32 GLN HE22 H -2.180 1.681 4.641 1.00 . A A . 32 GLN HE22 1 1 2 1083 1 1 32 GLN HG2 H 0.935 0.873 2.463 1.00 . A A . 32 GLN HG2 1 1 2 1084 1 1 32 GLN HG3 H 0.758 0.008 3.988 1.00 . A A . 32 GLN HG3 1 1 2 1085 1 1 32 GLN N N 3.541 2.059 2.068 1.00 . A A . 32 GLN N 1 1 2 1086 1 1 32 GLN NE2 N -1.376 1.169 4.418 1.00 . A A . 32 GLN NE2 1 1 2 1087 1 1 32 GLN O O 2.987 4.622 4.493 1.00 . A A . 32 GLN O 1 1 2 1088 1 1 32 GLN OE1 O -0.386 3.019 3.619 1.00 . A A . 32 GLN OE1 1 1 2 1089 1 1 33 LYS C C 5.480 5.857 4.268 1.00 . A A . 33 LYS C 1 1 2 1090 1 1 33 LYS CA C 5.746 4.404 4.646 1.00 . A A . 33 LYS CA 1 1 2 1091 1 1 33 LYS CB C 7.206 4.049 4.358 1.00 . A A . 33 LYS CB 1 1 2 1092 1 1 33 LYS CD C 9.125 2.473 4.739 1.00 . A A . 33 LYS CD 1 1 2 1093 1 1 33 LYS CE C 9.618 1.275 5.535 1.00 . A A . 33 LYS CE 1 1 2 1094 1 1 33 LYS CG C 7.652 2.744 4.995 1.00 . A A . 33 LYS CG 1 1 2 1095 1 1 33 LYS H H 5.236 2.746 3.432 1.00 . A A . 33 LYS H 1 1 2 1096 1 1 33 LYS HA H 5.555 4.279 5.702 1.00 . A A . 33 LYS HA 1 1 2 1097 1 1 33 LYS HB2 H 7.340 3.968 3.289 1.00 . A A . 33 LYS HB2 1 1 2 1098 1 1 33 LYS HB3 H 7.837 4.842 4.732 1.00 . A A . 33 LYS HB3 1 1 2 1099 1 1 33 LYS HD2 H 9.269 2.276 3.687 1.00 . A A . 33 LYS HD2 1 1 2 1100 1 1 33 LYS HD3 H 9.697 3.345 5.025 1.00 . A A . 33 LYS HD3 1 1 2 1101 1 1 33 LYS HE2 H 8.816 0.558 5.615 1.00 . A A . 33 LYS HE2 1 1 2 1102 1 1 33 LYS HE3 H 10.449 0.828 5.010 1.00 . A A . 33 LYS HE3 1 1 2 1103 1 1 33 LYS HG2 H 7.487 2.799 6.061 1.00 . A A . 33 LYS HG2 1 1 2 1104 1 1 33 LYS HG3 H 7.069 1.934 4.580 1.00 . A A . 33 LYS HG3 1 1 2 1105 1 1 33 LYS HZ1 H 10.744 0.968 7.267 1.00 . A A . 33 LYS HZ1 1 1 2 1106 1 1 33 LYS HZ2 H 9.244 1.699 7.546 1.00 . A A . 33 LYS HZ2 1 1 2 1107 1 1 33 LYS HZ3 H 10.513 2.598 6.881 1.00 . A A . 33 LYS HZ3 1 1 2 1108 1 1 33 LYS N N 4.854 3.506 3.921 1.00 . A A . 33 LYS N 1 1 2 1109 1 1 33 LYS NZ N 10.061 1.662 6.903 1.00 . A A . 33 LYS NZ 1 1 2 1110 1 1 33 LYS O O 5.369 6.724 5.135 1.00 . A A . 33 LYS O 1 1 2 1111 1 1 34 ILE C C 3.961 8.111 3.221 1.00 . A A . 34 ILE C 1 1 2 1112 1 1 34 ILE CA C 5.124 7.464 2.476 1.00 . A A . 34 ILE CA 1 1 2 1113 1 1 34 ILE CB C 4.816 7.464 0.967 1.00 . A A . 34 ILE CB 1 1 2 1114 1 1 34 ILE CD1 C 2.934 7.092 -0.705 1.00 . A A . 34 ILE CD1 1 1 2 1115 1 1 34 ILE CG1 C 3.426 6.879 0.709 1.00 . A A . 34 ILE CG1 1 1 2 1116 1 1 34 ILE CG2 C 5.876 6.679 0.210 1.00 . A A . 34 ILE CG2 1 1 2 1117 1 1 34 ILE H H 5.477 5.383 2.326 1.00 . A A . 34 ILE H 1 1 2 1118 1 1 34 ILE HA H 6.015 8.053 2.641 1.00 . A A . 34 ILE HA 1 1 2 1119 1 1 34 ILE HB H 4.840 8.485 0.617 1.00 . A A . 34 ILE HB 1 1 2 1120 1 1 34 ILE HD11 H 2.328 7.987 -0.744 1.00 . A A . 34 ILE HD11 1 1 2 1121 1 1 34 ILE HD12 H 3.779 7.203 -1.368 1.00 . A A . 34 ILE HD12 1 1 2 1122 1 1 34 ILE HD13 H 2.341 6.244 -1.013 1.00 . A A . 34 ILE HD13 1 1 2 1123 1 1 34 ILE HG12 H 3.449 5.817 0.894 1.00 . A A . 34 ILE HG12 1 1 2 1124 1 1 34 ILE HG13 H 2.718 7.342 1.381 1.00 . A A . 34 ILE HG13 1 1 2 1125 1 1 34 ILE HG21 H 6.667 6.395 0.889 1.00 . A A . 34 ILE HG21 1 1 2 1126 1 1 34 ILE HG22 H 5.432 5.791 -0.214 1.00 . A A . 34 ILE HG22 1 1 2 1127 1 1 34 ILE HG23 H 6.282 7.291 -0.580 1.00 . A A . 34 ILE HG23 1 1 2 1128 1 1 34 ILE N N 5.379 6.116 2.968 1.00 . A A . 34 ILE N 1 1 2 1129 1 1 34 ILE O O 3.856 9.336 3.286 1.00 . A A . 34 ILE O 1 1 2 1130 1 1 35 HIS C C 2.274 7.943 6.005 1.00 . A A . 35 HIS C 1 1 2 1131 1 1 35 HIS CA C 1.935 7.769 4.528 1.00 . A A . 35 HIS CA 1 1 2 1132 1 1 35 HIS CB C 0.757 6.808 4.372 1.00 . A A . 35 HIS CB 1 1 2 1133 1 1 35 HIS CD2 C 0.641 5.824 1.976 1.00 . A A . 35 HIS CD2 1 1 2 1134 1 1 35 HIS CE1 C -0.919 7.135 1.166 1.00 . A A . 35 HIS CE1 1 1 2 1135 1 1 35 HIS CG C 0.274 6.676 2.961 1.00 . A A . 35 HIS CG 1 1 2 1136 1 1 35 HIS H H 3.228 6.313 3.698 1.00 . A A . 35 HIS H 1 1 2 1137 1 1 35 HIS HA H 1.662 8.730 4.119 1.00 . A A . 35 HIS HA 1 1 2 1138 1 1 35 HIS HB2 H 1.053 5.828 4.714 1.00 . A A . 35 HIS HB2 1 1 2 1139 1 1 35 HIS HB3 H -0.068 7.160 4.975 1.00 . A A . 35 HIS HB3 1 1 2 1140 1 1 35 HIS HD1 H -1.172 8.207 2.889 1.00 . A A . 35 HIS HD1 1 1 2 1141 1 1 35 HIS HD2 H 1.389 5.046 2.045 1.00 . A A . 35 HIS HD2 1 1 2 1142 1 1 35 HIS HE1 H -1.629 7.592 0.494 1.00 . A A . 35 HIS HE1 1 1 2 1143 1 1 35 HIS N N 3.091 7.279 3.784 1.00 . A A . 35 HIS N 1 1 2 1144 1 1 35 HIS ND1 N -0.704 7.485 2.421 1.00 . A A . 35 HIS ND1 1 1 2 1145 1 1 35 HIS NE2 N -0.115 6.129 0.870 1.00 . A A . 35 HIS NE2 1 1 2 1146 1 1 35 HIS O O 2.321 9.063 6.516 1.00 . A A . 35 HIS O 1 1 2 1147 1 1 36 THR C C 4.168 7.568 8.347 1.00 . A A . 36 THR C 1 1 2 1148 1 1 36 THR CA C 2.842 6.856 8.107 1.00 . A A . 36 THR CA 1 1 2 1149 1 1 36 THR CB C 2.923 5.433 8.694 1.00 . A A . 36 THR CB 1 1 2 1150 1 1 36 THR CG2 C 3.597 4.483 7.717 1.00 . A A . 36 THR CG2 1 1 2 1151 1 1 36 THR H H 2.458 5.965 6.226 1.00 . A A . 36 THR H 1 1 2 1152 1 1 36 THR HA H 2.058 7.391 8.623 1.00 . A A . 36 THR HA 1 1 2 1153 1 1 36 THR HB H 1.919 5.080 8.882 1.00 . A A . 36 THR HB 1 1 2 1154 1 1 36 THR HG1 H 3.300 4.780 10.516 1.00 . A A . 36 THR HG1 1 1 2 1155 1 1 36 THR HG21 H 4.233 5.044 7.049 1.00 . A A . 36 THR HG21 1 1 2 1156 1 1 36 THR HG22 H 2.845 3.962 7.143 1.00 . A A . 36 THR HG22 1 1 2 1157 1 1 36 THR HG23 H 4.193 3.767 8.264 1.00 . A A . 36 THR HG23 1 1 2 1158 1 1 36 THR N N 2.510 6.827 6.689 1.00 . A A . 36 THR N 1 1 2 1159 1 1 36 THR O O 5.214 7.131 7.869 1.00 . A A . 36 THR O 1 1 2 1160 1 1 36 THR OG1 O 3.650 5.453 9.927 1.00 . A A . 36 THR OG1 1 1 2 1161 1 1 37 GLY C C 5.308 10.024 10.775 1.00 . A A . 37 GLY C 1 1 2 1162 1 1 37 GLY CA C 5.322 9.423 9.384 1.00 . A A . 37 GLY CA 1 1 2 1163 1 1 37 GLY H H 3.255 8.969 9.448 1.00 . A A . 37 GLY H 1 1 2 1164 1 1 37 GLY HA2 H 6.175 8.767 9.295 1.00 . A A . 37 GLY HA2 1 1 2 1165 1 1 37 GLY HA3 H 5.417 10.220 8.661 1.00 . A A . 37 GLY HA3 1 1 2 1166 1 1 37 GLY N N 4.118 8.668 9.093 1.00 . A A . 37 GLY N 1 1 2 1167 1 1 37 GLY O O 4.974 9.346 11.747 1.00 . A A . 37 GLY O 1 1 2 1168 1 1 38 GLU C C 5.042 13.360 12.052 1.00 . A A . 38 GLU C 1 1 2 1169 1 1 38 GLU CA C 5.703 11.989 12.156 1.00 . A A . 38 GLU CA 1 1 2 1170 1 1 38 GLU CB C 7.145 12.141 12.645 1.00 . A A . 38 GLU CB 1 1 2 1171 1 1 38 GLU CD C 9.181 13.635 12.586 1.00 . A A . 38 GLU CD 1 1 2 1172 1 1 38 GLU CG C 7.959 13.137 11.837 1.00 . A A . 38 GLU CG 1 1 2 1173 1 1 38 GLU H H 5.929 11.786 10.061 1.00 . A A . 38 GLU H 1 1 2 1174 1 1 38 GLU HA H 5.153 11.391 12.867 1.00 . A A . 38 GLU HA 1 1 2 1175 1 1 38 GLU HB2 H 7.131 12.468 13.674 1.00 . A A . 38 GLU HB2 1 1 2 1176 1 1 38 GLU HB3 H 7.634 11.179 12.589 1.00 . A A . 38 GLU HB3 1 1 2 1177 1 1 38 GLU HG2 H 8.285 12.662 10.925 1.00 . A A . 38 GLU HG2 1 1 2 1178 1 1 38 GLU HG3 H 7.333 13.984 11.597 1.00 . A A . 38 GLU HG3 1 1 2 1179 1 1 38 GLU N N 5.673 11.298 10.872 1.00 . A A . 38 GLU N 1 1 2 1180 1 1 38 GLU O O 4.722 13.827 10.958 1.00 . A A . 38 GLU O 1 1 2 1181 1 1 38 GLU OE1 O 9.026 14.520 13.453 1.00 . A A . 38 GLU OE1 1 1 2 1182 1 1 38 GLU OE2 O 10.292 13.138 12.304 1.00 . A A . 38 GLU OE2 1 1 2 1183 1 1 39 LYS C C 5.274 16.421 13.193 1.00 . A A . 39 LYS C 1 1 2 1184 1 1 39 LYS CA C 4.219 15.320 13.238 1.00 . A A . 39 LYS CA 1 1 2 1185 1 1 39 LYS CB C 3.367 15.467 14.501 1.00 . A A . 39 LYS CB 1 1 2 1186 1 1 39 LYS CD C 1.088 15.713 13.475 1.00 . A A . 39 LYS CD 1 1 2 1187 1 1 39 LYS CE C -0.354 15.230 13.505 1.00 . A A . 39 LYS CE 1 1 2 1188 1 1 39 LYS CG C 1.978 14.868 14.371 1.00 . A A . 39 LYS CG 1 1 2 1189 1 1 39 LYS H H 5.118 13.578 14.038 1.00 . A A . 39 LYS H 1 1 2 1190 1 1 39 LYS HA H 3.582 15.413 12.372 1.00 . A A . 39 LYS HA 1 1 2 1191 1 1 39 LYS HB2 H 3.873 14.976 15.320 1.00 . A A . 39 LYS HB2 1 1 2 1192 1 1 39 LYS HB3 H 3.264 16.517 14.731 1.00 . A A . 39 LYS HB3 1 1 2 1193 1 1 39 LYS HD2 H 1.119 16.738 13.814 1.00 . A A . 39 LYS HD2 1 1 2 1194 1 1 39 LYS HD3 H 1.457 15.657 12.460 1.00 . A A . 39 LYS HD3 1 1 2 1195 1 1 39 LYS HE2 H -0.666 15.135 14.533 1.00 . A A . 39 LYS HE2 1 1 2 1196 1 1 39 LYS HE3 H -0.974 15.959 13.006 1.00 . A A . 39 LYS HE3 1 1 2 1197 1 1 39 LYS HG2 H 2.060 13.878 13.947 1.00 . A A . 39 LYS HG2 1 1 2 1198 1 1 39 LYS HG3 H 1.529 14.805 15.352 1.00 . A A . 39 LYS HG3 1 1 2 1199 1 1 39 LYS HZ1 H -0.369 14.020 11.802 1.00 . A A . 39 LYS HZ1 1 1 2 1200 1 1 39 LYS HZ2 H -1.466 13.537 12.996 1.00 . A A . 39 LYS HZ2 1 1 2 1201 1 1 39 LYS HZ3 H 0.186 13.236 13.194 1.00 . A A . 39 LYS HZ3 1 1 2 1202 1 1 39 LYS N N 4.841 14.002 13.198 1.00 . A A . 39 LYS N 1 1 2 1203 1 1 39 LYS NZ N -0.512 13.914 12.826 1.00 . A A . 39 LYS NZ 1 1 2 1204 1 1 39 LYS O O 6.362 16.295 13.756 1.00 . A A . 39 LYS O 1 1 2 1205 1 1 40 PRO C C 6.037 19.421 13.692 1.00 . A A . 40 PRO C 1 1 2 1206 1 1 40 PRO CA C 5.853 18.672 12.376 1.00 . A A . 40 PRO CA 1 1 2 1207 1 1 40 PRO CB C 5.152 19.562 11.348 1.00 . A A . 40 PRO CB 1 1 2 1208 1 1 40 PRO CD C 3.669 17.746 11.813 1.00 . A A . 40 PRO CD 1 1 2 1209 1 1 40 PRO CG C 3.709 19.207 11.461 1.00 . A A . 40 PRO CG 1 1 2 1210 1 1 40 PRO HA H 6.819 18.372 11.996 1.00 . A A . 40 PRO HA 1 1 2 1211 1 1 40 PRO HB2 H 5.324 20.601 11.590 1.00 . A A . 40 PRO HB2 1 1 2 1212 1 1 40 PRO HB3 H 5.534 19.349 10.361 1.00 . A A . 40 PRO HB3 1 1 2 1213 1 1 40 PRO HD2 H 2.834 17.538 12.465 1.00 . A A . 40 PRO HD2 1 1 2 1214 1 1 40 PRO HD3 H 3.610 17.144 10.918 1.00 . A A . 40 PRO HD3 1 1 2 1215 1 1 40 PRO HG2 H 3.247 19.794 12.240 1.00 . A A . 40 PRO HG2 1 1 2 1216 1 1 40 PRO HG3 H 3.214 19.379 10.516 1.00 . A A . 40 PRO HG3 1 1 2 1217 1 1 40 PRO N N 4.947 17.527 12.509 1.00 . A A . 40 PRO N 1 1 2 1218 1 1 40 PRO O O 6.802 20.383 13.768 1.00 . A A . 40 PRO O 1 1 2 1219 1 1 41 SER C C 6.869 19.826 16.443 1.00 . A A . 41 SER C 1 1 2 1220 1 1 41 SER CA C 5.415 19.605 16.038 1.00 . A A . 41 SER CA 1 1 2 1221 1 1 41 SER CB C 4.706 18.745 17.086 1.00 . A A . 41 SER CB 1 1 2 1222 1 1 41 SER H H 4.739 18.203 14.602 1.00 . A A . 41 SER H 1 1 2 1223 1 1 41 SER HA H 4.921 20.563 15.977 1.00 . A A . 41 SER HA 1 1 2 1224 1 1 41 SER HB2 H 5.093 17.738 17.044 1.00 . A A . 41 SER HB2 1 1 2 1225 1 1 41 SER HB3 H 4.886 19.158 18.068 1.00 . A A . 41 SER HB3 1 1 2 1226 1 1 41 SER HG H 3.020 19.551 16.498 1.00 . A A . 41 SER HG 1 1 2 1227 1 1 41 SER N N 5.332 18.974 14.726 1.00 . A A . 41 SER N 1 1 2 1228 1 1 41 SER O O 7.253 20.923 16.847 1.00 . A A . 41 SER O 1 1 2 1229 1 1 41 SER OG O 3.309 18.708 16.855 1.00 . A A . 41 SER OG 1 1 2 1230 1 1 42 GLY C C 9.890 17.699 16.180 1.00 . A A . 42 GLY C 1 1 2 1231 1 1 42 GLY CA C 9.077 18.872 16.690 1.00 . A A . 42 GLY CA 1 1 2 1232 1 1 42 GLY H H 7.313 17.924 16.004 1.00 . A A . 42 GLY H 1 1 2 1233 1 1 42 GLY HA2 H 9.480 19.784 16.276 1.00 . A A . 42 GLY HA2 1 1 2 1234 1 1 42 GLY HA3 H 9.160 18.911 17.767 1.00 . A A . 42 GLY HA3 1 1 2 1235 1 1 42 GLY N N 7.674 18.774 16.332 1.00 . A A . 42 GLY N 1 1 2 1236 1 1 42 GLY O O 10.142 16.731 16.898 1.00 . A A . 42 GLY O 1 1 2 1237 1 1 43 PRO C C 12.519 16.635 14.842 1.00 . A A . 43 PRO C 1 1 2 1238 1 1 43 PRO CA C 11.107 16.719 14.274 1.00 . A A . 43 PRO CA 1 1 2 1239 1 1 43 PRO CB C 11.146 17.141 12.803 1.00 . A A . 43 PRO CB 1 1 2 1240 1 1 43 PRO CD C 10.049 18.899 13.995 1.00 . A A . 43 PRO CD 1 1 2 1241 1 1 43 PRO CG C 10.954 18.618 12.827 1.00 . A A . 43 PRO CG 1 1 2 1242 1 1 43 PRO HA H 10.627 15.755 14.361 1.00 . A A . 43 PRO HA 1 1 2 1243 1 1 43 PRO HB2 H 12.102 16.872 12.375 1.00 . A A . 43 PRO HB2 1 1 2 1244 1 1 43 PRO HB3 H 10.352 16.648 12.262 1.00 . A A . 43 PRO HB3 1 1 2 1245 1 1 43 PRO HD2 H 10.308 19.840 14.455 1.00 . A A . 43 PRO HD2 1 1 2 1246 1 1 43 PRO HD3 H 9.016 18.903 13.679 1.00 . A A . 43 PRO HD3 1 1 2 1247 1 1 43 PRO HG2 H 11.905 19.110 12.964 1.00 . A A . 43 PRO HG2 1 1 2 1248 1 1 43 PRO HG3 H 10.490 18.942 11.908 1.00 . A A . 43 PRO HG3 1 1 2 1249 1 1 43 PRO N N 10.313 17.775 14.909 1.00 . A A . 43 PRO N 1 1 2 1250 1 1 43 PRO O O 13.335 15.835 14.386 1.00 . A A . 43 PRO O 1 1 2 1251 1 1 44 SER C C 15.209 17.733 15.434 1.00 . A A . 44 SER C 1 1 2 1252 1 1 44 SER CA C 14.117 17.487 16.470 1.00 . A A . 44 SER CA 1 1 2 1253 1 1 44 SER CB C 14.378 16.168 17.199 1.00 . A A . 44 SER CB 1 1 2 1254 1 1 44 SER H H 12.108 18.080 16.161 1.00 . A A . 44 SER H 1 1 2 1255 1 1 44 SER HA H 14.128 18.294 17.187 1.00 . A A . 44 SER HA 1 1 2 1256 1 1 44 SER HB2 H 15.183 16.303 17.905 1.00 . A A . 44 SER HB2 1 1 2 1257 1 1 44 SER HB3 H 13.484 15.868 17.726 1.00 . A A . 44 SER HB3 1 1 2 1258 1 1 44 SER HG H 14.482 14.291 16.648 1.00 . A A . 44 SER HG 1 1 2 1259 1 1 44 SER N N 12.801 17.465 15.841 1.00 . A A . 44 SER N 1 1 2 1260 1 1 44 SER O O 16.262 17.097 15.463 1.00 . A A . 44 SER O 1 1 2 1261 1 1 44 SER OG O 14.737 15.143 16.288 1.00 . A A . 44 SER OG 1 1 2 1262 1 1 45 SER C C 16.162 20.495 13.419 1.00 . A A . 45 SER C 1 1 2 1263 1 1 45 SER CA C 15.909 18.992 13.471 1.00 . A A . 45 SER CA 1 1 2 1264 1 1 45 SER CB C 15.401 18.502 12.114 1.00 . A A . 45 SER CB 1 1 2 1265 1 1 45 SER H H 14.092 19.136 14.549 1.00 . A A . 45 SER H 1 1 2 1266 1 1 45 SER HA H 16.837 18.490 13.701 1.00 . A A . 45 SER HA 1 1 2 1267 1 1 45 SER HB2 H 14.392 18.853 11.962 1.00 . A A . 45 SER HB2 1 1 2 1268 1 1 45 SER HB3 H 16.039 18.890 11.332 1.00 . A A . 45 SER HB3 1 1 2 1269 1 1 45 SER HG H 15.402 16.808 11.129 1.00 . A A . 45 SER HG 1 1 2 1270 1 1 45 SER N N 14.950 18.662 14.519 1.00 . A A . 45 SER N 1 1 2 1271 1 1 45 SER O O 15.611 21.200 12.576 1.00 . A A . 45 SER O 1 1 2 1272 1 1 45 SER OG O 15.407 17.086 12.047 1.00 . A A . 45 SER OG 1 1 2 1273 1 1 46 GLY C C 18.357 22.790 13.344 1.00 . A A . 46 GLY C 1 1 2 1274 1 1 46 GLY CA C 17.315 22.395 14.371 1.00 . A A . 46 GLY CA 1 1 2 1275 1 1 46 GLY H H 17.413 20.369 14.978 1.00 . A A . 46 GLY H 1 1 2 1276 1 1 46 GLY HA2 H 16.412 22.958 14.188 1.00 . A A . 46 GLY HA2 1 1 2 1277 1 1 46 GLY HA3 H 17.687 22.641 15.356 1.00 . A A . 46 GLY HA3 1 1 2 1278 1 1 46 GLY N N 17.003 20.979 14.329 1.00 . A A . 46 GLY N 1 1 2 1279 1 1 46 GLY O O 19.251 23.572 13.666 1.00 . A A . 46 GLY O 1 1 2 1280 2 2 1 ZN ZN ZN -0.430 4.650 -0.384 1.00 . B A . 201 ZN ZN 1 1 3 1281 1 1 1 GLY C C -16.472 1.913 -8.171 1.00 . A A . 1 GLY C 1 1 3 1282 1 1 1 GLY CA C -17.182 0.934 -7.256 1.00 . A A . 1 GLY CA 1 1 3 1283 1 1 1 GLY H1 H -15.688 1.024 -5.758 1.00 . A A . 1 GLY H1 1 1 3 1284 1 1 1 GLY HA2 H -17.073 -0.062 -7.658 1.00 . A A . 1 GLY HA2 1 1 3 1285 1 1 1 GLY HA3 H -18.232 1.186 -7.225 1.00 . A A . 1 GLY HA3 1 1 3 1286 1 1 1 GLY N N -16.655 0.955 -5.904 1.00 . A A . 1 GLY N 1 1 3 1287 1 1 1 GLY O O -17.055 2.908 -8.599 1.00 . A A . 1 GLY O 1 1 3 1288 1 1 2 SER C C -13.316 1.704 -10.036 1.00 . A A . 2 SER C 1 1 3 1289 1 1 2 SER CA C -14.415 2.496 -9.335 1.00 . A A . 2 SER CA 1 1 3 1290 1 1 2 SER CB C -13.799 3.637 -8.523 1.00 . A A . 2 SER CB 1 1 3 1291 1 1 2 SER H H -14.798 0.821 -8.097 1.00 . A A . 2 SER H 1 1 3 1292 1 1 2 SER HA H -15.075 2.912 -10.082 1.00 . A A . 2 SER HA 1 1 3 1293 1 1 2 SER HB2 H -13.510 3.269 -7.551 1.00 . A A . 2 SER HB2 1 1 3 1294 1 1 2 SER HB3 H -12.927 4.013 -9.040 1.00 . A A . 2 SER HB3 1 1 3 1295 1 1 2 SER HG H -15.463 4.398 -7.822 1.00 . A A . 2 SER HG 1 1 3 1296 1 1 2 SER N N -15.208 1.630 -8.470 1.00 . A A . 2 SER N 1 1 3 1297 1 1 2 SER O O -13.028 0.564 -9.672 1.00 . A A . 2 SER O 1 1 3 1298 1 1 2 SER OG O -14.722 4.699 -8.354 1.00 . A A . 2 SER OG 1 1 3 1299 1 1 3 SER C C -12.160 0.429 -12.519 1.00 . A A . 3 SER C 1 1 3 1300 1 1 3 SER CA C -11.639 1.669 -11.800 1.00 . A A . 3 SER CA 1 1 3 1301 1 1 3 SER CB C -10.485 1.288 -10.871 1.00 . A A . 3 SER CB 1 1 3 1302 1 1 3 SER H H -12.979 3.227 -11.288 1.00 . A A . 3 SER H 1 1 3 1303 1 1 3 SER HA H -11.279 2.373 -12.536 1.00 . A A . 3 SER HA 1 1 3 1304 1 1 3 SER HB2 H -10.209 2.143 -10.274 1.00 . A A . 3 SER HB2 1 1 3 1305 1 1 3 SER HB3 H -10.800 0.483 -10.223 1.00 . A A . 3 SER HB3 1 1 3 1306 1 1 3 SER HG H -8.757 1.604 -11.737 1.00 . A A . 3 SER HG 1 1 3 1307 1 1 3 SER N N -12.705 2.317 -11.044 1.00 . A A . 3 SER N 1 1 3 1308 1 1 3 SER O O -11.518 -0.621 -12.514 1.00 . A A . 3 SER O 1 1 3 1309 1 1 3 SER OG O -9.354 0.862 -11.611 1.00 . A A . 3 SER OG 1 1 3 1310 1 1 4 GLY C C -13.506 -0.597 -15.310 1.00 . A A . 4 GLY C 1 1 3 1311 1 1 4 GLY CA C -13.919 -0.559 -13.852 1.00 . A A . 4 GLY CA 1 1 3 1312 1 1 4 GLY H H -13.797 1.419 -13.108 1.00 . A A . 4 GLY H 1 1 3 1313 1 1 4 GLY HA2 H -13.610 -1.479 -13.378 1.00 . A A . 4 GLY HA2 1 1 3 1314 1 1 4 GLY HA3 H -14.995 -0.481 -13.797 1.00 . A A . 4 GLY HA3 1 1 3 1315 1 1 4 GLY N N -13.330 0.558 -13.137 1.00 . A A . 4 GLY N 1 1 3 1316 1 1 4 GLY O O -14.346 -0.482 -16.203 1.00 . A A . 4 GLY O 1 1 3 1317 1 1 5 SER C C -11.167 -2.197 -17.248 1.00 . A A . 5 SER C 1 1 3 1318 1 1 5 SER CA C -11.686 -0.802 -16.913 1.00 . A A . 5 SER CA 1 1 3 1319 1 1 5 SER CB C -10.567 0.226 -17.088 1.00 . A A . 5 SER CB 1 1 3 1320 1 1 5 SER H H -11.589 -0.841 -14.799 1.00 . A A . 5 SER H 1 1 3 1321 1 1 5 SER HA H -12.494 -0.560 -17.588 1.00 . A A . 5 SER HA 1 1 3 1322 1 1 5 SER HB2 H -10.289 0.279 -18.129 1.00 . A A . 5 SER HB2 1 1 3 1323 1 1 5 SER HB3 H -10.917 1.194 -16.758 1.00 . A A . 5 SER HB3 1 1 3 1324 1 1 5 SER HG H -9.692 -0.675 -15.585 1.00 . A A . 5 SER HG 1 1 3 1325 1 1 5 SER N N -12.209 -0.756 -15.553 1.00 . A A . 5 SER N 1 1 3 1326 1 1 5 SER O O -10.905 -3.005 -16.357 1.00 . A A . 5 SER O 1 1 3 1327 1 1 5 SER OG O -9.425 -0.129 -16.328 1.00 . A A . 5 SER OG 1 1 3 1328 1 1 6 SER C C -9.137 -4.049 -18.453 1.00 . A A . 6 SER C 1 1 3 1329 1 1 6 SER CA C -10.536 -3.771 -18.995 1.00 . A A . 6 SER CA 1 1 3 1330 1 1 6 SER CB C -10.524 -3.828 -20.524 1.00 . A A . 6 SER CB 1 1 3 1331 1 1 6 SER H H -11.246 -1.787 -19.204 1.00 . A A . 6 SER H 1 1 3 1332 1 1 6 SER HA H -11.211 -4.526 -18.621 1.00 . A A . 6 SER HA 1 1 3 1333 1 1 6 SER HB2 H -11.497 -3.550 -20.900 1.00 . A A . 6 SER HB2 1 1 3 1334 1 1 6 SER HB3 H -9.782 -3.139 -20.901 1.00 . A A . 6 SER HB3 1 1 3 1335 1 1 6 SER HG H -9.286 -5.318 -20.815 1.00 . A A . 6 SER HG 1 1 3 1336 1 1 6 SER N N -11.020 -2.473 -18.540 1.00 . A A . 6 SER N 1 1 3 1337 1 1 6 SER O O -8.411 -3.130 -18.078 1.00 . A A . 6 SER O 1 1 3 1338 1 1 6 SER OG O -10.213 -5.131 -20.983 1.00 . A A . 6 SER OG 1 1 3 1339 1 1 7 GLY C C -7.527 -6.798 -16.873 1.00 . A A . 7 GLY C 1 1 3 1340 1 1 7 GLY CA C -7.456 -5.703 -17.920 1.00 . A A . 7 GLY CA 1 1 3 1341 1 1 7 GLY H H -9.388 -6.016 -18.730 1.00 . A A . 7 GLY H 1 1 3 1342 1 1 7 GLY HA2 H -6.855 -6.049 -18.747 1.00 . A A . 7 GLY HA2 1 1 3 1343 1 1 7 GLY HA3 H -6.985 -4.835 -17.484 1.00 . A A . 7 GLY HA3 1 1 3 1344 1 1 7 GLY N N -8.766 -5.325 -18.417 1.00 . A A . 7 GLY N 1 1 3 1345 1 1 7 GLY O O -8.260 -6.682 -15.891 1.00 . A A . 7 GLY O 1 1 3 1346 1 1 8 THR C C -5.544 -8.903 -15.216 1.00 . A A . 8 THR C 1 1 3 1347 1 1 8 THR CA C -6.744 -8.987 -16.153 1.00 . A A . 8 THR CA 1 1 3 1348 1 1 8 THR CB C -6.707 -10.335 -16.897 1.00 . A A . 8 THR CB 1 1 3 1349 1 1 8 THR CG2 C -6.925 -11.491 -15.933 1.00 . A A . 8 THR CG2 1 1 3 1350 1 1 8 THR H H -6.201 -7.899 -17.885 1.00 . A A . 8 THR H 1 1 3 1351 1 1 8 THR HA H -7.650 -8.948 -15.566 1.00 . A A . 8 THR HA 1 1 3 1352 1 1 8 THR HB H -5.736 -10.447 -17.358 1.00 . A A . 8 THR HB 1 1 3 1353 1 1 8 THR HG1 H -8.550 -10.636 -17.532 1.00 . A A . 8 THR HG1 1 1 3 1354 1 1 8 THR HG21 H -5.974 -11.944 -15.695 1.00 . A A . 8 THR HG21 1 1 3 1355 1 1 8 THR HG22 H -7.568 -12.227 -16.393 1.00 . A A . 8 THR HG22 1 1 3 1356 1 1 8 THR HG23 H -7.386 -11.124 -15.029 1.00 . A A . 8 THR HG23 1 1 3 1357 1 1 8 THR N N -6.763 -7.866 -17.084 1.00 . A A . 8 THR N 1 1 3 1358 1 1 8 THR O O -4.908 -9.912 -14.915 1.00 . A A . 8 THR O 1 1 3 1359 1 1 8 THR OG1 O -7.713 -10.360 -17.915 1.00 . A A . 8 THR OG1 1 1 3 1360 1 1 9 GLY C C -4.529 -6.873 -12.542 1.00 . A A . 9 GLY C 1 1 3 1361 1 1 9 GLY CA C -4.117 -7.501 -13.859 1.00 . A A . 9 GLY CA 1 1 3 1362 1 1 9 GLY H H -5.783 -6.924 -15.032 1.00 . A A . 9 GLY H 1 1 3 1363 1 1 9 GLY HA2 H -3.660 -8.459 -13.662 1.00 . A A . 9 GLY HA2 1 1 3 1364 1 1 9 GLY HA3 H -3.393 -6.859 -14.339 1.00 . A A . 9 GLY HA3 1 1 3 1365 1 1 9 GLY N N -5.240 -7.693 -14.758 1.00 . A A . 9 GLY N 1 1 3 1366 1 1 9 GLY O O -4.238 -5.705 -12.286 1.00 . A A . 9 GLY O 1 1 3 1367 1 1 10 GLU C C -4.796 -7.715 -9.283 1.00 . A A . 10 GLU C 1 1 3 1368 1 1 10 GLU CA C -5.665 -7.161 -10.409 1.00 . A A . 10 GLU CA 1 1 3 1369 1 1 10 GLU CB C -7.127 -7.548 -10.177 1.00 . A A . 10 GLU CB 1 1 3 1370 1 1 10 GLU CD C -8.237 -6.581 -12.230 1.00 . A A . 10 GLU CD 1 1 3 1371 1 1 10 GLU CG C -8.118 -6.532 -10.719 1.00 . A A . 10 GLU CG 1 1 3 1372 1 1 10 GLU H H -5.412 -8.572 -11.966 1.00 . A A . 10 GLU H 1 1 3 1373 1 1 10 GLU HA H -5.583 -6.084 -10.413 1.00 . A A . 10 GLU HA 1 1 3 1374 1 1 10 GLU HB2 H -7.316 -8.497 -10.657 1.00 . A A . 10 GLU HB2 1 1 3 1375 1 1 10 GLU HB3 H -7.295 -7.652 -9.115 1.00 . A A . 10 GLU HB3 1 1 3 1376 1 1 10 GLU HG2 H -9.089 -6.732 -10.291 1.00 . A A . 10 GLU HG2 1 1 3 1377 1 1 10 GLU HG3 H -7.795 -5.543 -10.430 1.00 . A A . 10 GLU HG3 1 1 3 1378 1 1 10 GLU N N -5.210 -7.650 -11.705 1.00 . A A . 10 GLU N 1 1 3 1379 1 1 10 GLU O O -4.728 -8.927 -9.075 1.00 . A A . 10 GLU O 1 1 3 1380 1 1 10 GLU OE1 O -8.090 -7.681 -12.802 1.00 . A A . 10 GLU OE1 1 1 3 1381 1 1 10 GLU OE2 O -8.477 -5.518 -12.840 1.00 . A A . 10 GLU OE2 1 1 3 1382 1 1 11 LYS C C -4.089 -7.535 -6.209 1.00 . A A . 11 LYS C 1 1 3 1383 1 1 11 LYS CA C -3.268 -7.216 -7.455 1.00 . A A . 11 LYS CA 1 1 3 1384 1 1 11 LYS CB C -2.261 -6.107 -7.145 1.00 . A A . 11 LYS CB 1 1 3 1385 1 1 11 LYS CD C -1.195 -6.085 -9.419 1.00 . A A . 11 LYS CD 1 1 3 1386 1 1 11 LYS CE C -1.114 -4.631 -9.859 1.00 . A A . 11 LYS CE 1 1 3 1387 1 1 11 LYS CG C -0.963 -6.228 -7.924 1.00 . A A . 11 LYS CG 1 1 3 1388 1 1 11 LYS H H -4.228 -5.867 -8.775 1.00 . A A . 11 LYS H 1 1 3 1389 1 1 11 LYS HA H -2.733 -8.104 -7.755 1.00 . A A . 11 LYS HA 1 1 3 1390 1 1 11 LYS HB2 H -2.710 -5.153 -7.380 1.00 . A A . 11 LYS HB2 1 1 3 1391 1 1 11 LYS HB3 H -2.027 -6.134 -6.090 1.00 . A A . 11 LYS HB3 1 1 3 1392 1 1 11 LYS HD2 H -0.443 -6.651 -9.947 1.00 . A A . 11 LYS HD2 1 1 3 1393 1 1 11 LYS HD3 H -2.175 -6.471 -9.661 1.00 . A A . 11 LYS HD3 1 1 3 1394 1 1 11 LYS HE2 H -2.053 -4.148 -9.637 1.00 . A A . 11 LYS HE2 1 1 3 1395 1 1 11 LYS HE3 H -0.321 -4.146 -9.308 1.00 . A A . 11 LYS HE3 1 1 3 1396 1 1 11 LYS HG2 H -0.285 -5.453 -7.600 1.00 . A A . 11 LYS HG2 1 1 3 1397 1 1 11 LYS HG3 H -0.526 -7.197 -7.728 1.00 . A A . 11 LYS HG3 1 1 3 1398 1 1 11 LYS HZ1 H -0.541 -3.537 -11.544 1.00 . A A . 11 LYS HZ1 1 1 3 1399 1 1 11 LYS HZ2 H -1.693 -4.733 -11.863 1.00 . A A . 11 LYS HZ2 1 1 3 1400 1 1 11 LYS HZ3 H -0.080 -5.164 -11.594 1.00 . A A . 11 LYS HZ3 1 1 3 1401 1 1 11 LYS N N -4.133 -6.819 -8.560 1.00 . A A . 11 LYS N 1 1 3 1402 1 1 11 LYS NZ N -0.837 -4.507 -11.317 1.00 . A A . 11 LYS NZ 1 1 3 1403 1 1 11 LYS O O -5.102 -6.895 -5.923 1.00 . A A . 11 LYS O 1 1 3 1404 1 1 12 PRO C C -4.192 -7.943 -3.102 1.00 . A A . 12 PRO C 1 1 3 1405 1 1 12 PRO CA C -4.322 -8.971 -4.221 1.00 . A A . 12 PRO CA 1 1 3 1406 1 1 12 PRO CB C -3.597 -10.265 -3.845 1.00 . A A . 12 PRO CB 1 1 3 1407 1 1 12 PRO CD C -2.445 -9.353 -5.730 1.00 . A A . 12 PRO CD 1 1 3 1408 1 1 12 PRO CG C -2.248 -10.136 -4.462 1.00 . A A . 12 PRO CG 1 1 3 1409 1 1 12 PRO HA H -5.368 -9.179 -4.396 1.00 . A A . 12 PRO HA 1 1 3 1410 1 1 12 PRO HB2 H -3.535 -10.346 -2.768 1.00 . A A . 12 PRO HB2 1 1 3 1411 1 1 12 PRO HB3 H -4.135 -11.112 -4.244 1.00 . A A . 12 PRO HB3 1 1 3 1412 1 1 12 PRO HD2 H -1.590 -8.720 -5.919 1.00 . A A . 12 PRO HD2 1 1 3 1413 1 1 12 PRO HD3 H -2.616 -10.019 -6.562 1.00 . A A . 12 PRO HD3 1 1 3 1414 1 1 12 PRO HG2 H -1.587 -9.606 -3.792 1.00 . A A . 12 PRO HG2 1 1 3 1415 1 1 12 PRO HG3 H -1.851 -11.116 -4.685 1.00 . A A . 12 PRO HG3 1 1 3 1416 1 1 12 PRO N N -3.644 -8.546 -5.449 1.00 . A A . 12 PRO N 1 1 3 1417 1 1 12 PRO O O -5.097 -7.786 -2.282 1.00 . A A . 12 PRO O 1 1 3 1418 1 1 13 TYR C C -3.018 -4.830 -2.618 1.00 . A A . 13 TYR C 1 1 3 1419 1 1 13 TYR CA C -2.813 -6.233 -2.054 1.00 . A A . 13 TYR CA 1 1 3 1420 1 1 13 TYR CB C -1.393 -6.372 -1.504 1.00 . A A . 13 TYR CB 1 1 3 1421 1 1 13 TYR CD1 C -1.513 -8.238 0.193 1.00 . A A . 13 TYR CD1 1 1 3 1422 1 1 13 TYR CD2 C -0.291 -8.623 -1.817 1.00 . A A . 13 TYR CD2 1 1 3 1423 1 1 13 TYR CE1 C -1.210 -9.514 0.627 1.00 . A A . 13 TYR CE1 1 1 3 1424 1 1 13 TYR CE2 C 0.015 -9.901 -1.392 1.00 . A A . 13 TYR CE2 1 1 3 1425 1 1 13 TYR CG C -1.060 -7.770 -1.034 1.00 . A A . 13 TYR CG 1 1 3 1426 1 1 13 TYR CZ C -0.446 -10.342 -0.169 1.00 . A A . 13 TYR CZ 1 1 3 1427 1 1 13 TYR H H -2.378 -7.415 -3.755 1.00 . A A . 13 TYR H 1 1 3 1428 1 1 13 TYR HA H -3.517 -6.392 -1.251 1.00 . A A . 13 TYR HA 1 1 3 1429 1 1 13 TYR HB2 H -0.688 -6.106 -2.276 1.00 . A A . 13 TYR HB2 1 1 3 1430 1 1 13 TYR HB3 H -1.272 -5.702 -0.666 1.00 . A A . 13 TYR HB3 1 1 3 1431 1 1 13 TYR HD1 H -2.111 -7.587 0.815 1.00 . A A . 13 TYR HD1 1 1 3 1432 1 1 13 TYR HD2 H 0.069 -8.274 -2.774 1.00 . A A . 13 TYR HD2 1 1 3 1433 1 1 13 TYR HE1 H -1.571 -9.860 1.585 1.00 . A A . 13 TYR HE1 1 1 3 1434 1 1 13 TYR HE2 H 0.613 -10.549 -2.015 1.00 . A A . 13 TYR HE2 1 1 3 1435 1 1 13 TYR HH H -0.950 -12.128 0.332 1.00 . A A . 13 TYR HH 1 1 3 1436 1 1 13 TYR N N -3.062 -7.245 -3.074 1.00 . A A . 13 TYR N 1 1 3 1437 1 1 13 TYR O O -2.701 -4.562 -3.777 1.00 . A A . 13 TYR O 1 1 3 1438 1 1 13 TYR OH O -0.142 -11.614 0.259 1.00 . A A . 13 TYR OH 1 1 3 1439 1 1 14 ARG C C -3.694 -1.611 -1.014 1.00 . A A . 14 ARG C 1 1 3 1440 1 1 14 ARG CA C -3.797 -2.563 -2.202 1.00 . A A . 14 ARG CA 1 1 3 1441 1 1 14 ARG CB C -5.179 -2.443 -2.846 1.00 . A A . 14 ARG CB 1 1 3 1442 1 1 14 ARG CD C -6.692 -1.014 -4.256 1.00 . A A . 14 ARG CD 1 1 3 1443 1 1 14 ARG CG C -5.530 -1.027 -3.275 1.00 . A A . 14 ARG CG 1 1 3 1444 1 1 14 ARG CZ C -9.042 -1.736 -4.309 1.00 . A A . 14 ARG CZ 1 1 3 1445 1 1 14 ARG H H -3.781 -4.212 -0.876 1.00 . A A . 14 ARG H 1 1 3 1446 1 1 14 ARG HA H -3.046 -2.294 -2.929 1.00 . A A . 14 ARG HA 1 1 3 1447 1 1 14 ARG HB2 H -5.213 -3.078 -3.719 1.00 . A A . 14 ARG HB2 1 1 3 1448 1 1 14 ARG HB3 H -5.923 -2.776 -2.139 1.00 . A A . 14 ARG HB3 1 1 3 1449 1 1 14 ARG HD2 H -6.809 -0.013 -4.642 1.00 . A A . 14 ARG HD2 1 1 3 1450 1 1 14 ARG HD3 H -6.467 -1.689 -5.069 1.00 . A A . 14 ARG HD3 1 1 3 1451 1 1 14 ARG HE H -7.965 -1.480 -2.650 1.00 . A A . 14 ARG HE 1 1 3 1452 1 1 14 ARG HG2 H -5.805 -0.454 -2.402 1.00 . A A . 14 ARG HG2 1 1 3 1453 1 1 14 ARG HG3 H -4.668 -0.579 -3.746 1.00 . A A . 14 ARG HG3 1 1 3 1454 1 1 14 ARG HH11 H -8.214 -1.400 -6.121 1.00 . A A . 14 ARG HH11 1 1 3 1455 1 1 14 ARG HH12 H -9.870 -1.909 -6.145 1.00 . A A . 14 ARG HH12 1 1 3 1456 1 1 14 ARG HH21 H -10.145 -2.151 -2.667 1.00 . A A . 14 ARG HH21 1 1 3 1457 1 1 14 ARG HH22 H -10.968 -2.336 -4.179 1.00 . A A . 14 ARG HH22 1 1 3 1458 1 1 14 ARG N N -3.549 -3.938 -1.788 1.00 . A A . 14 ARG N 1 1 3 1459 1 1 14 ARG NE N -7.944 -1.429 -3.628 1.00 . A A . 14 ARG NE 1 1 3 1460 1 1 14 ARG NH1 N -9.042 -1.676 -5.634 1.00 . A A . 14 ARG NH1 1 1 3 1461 1 1 14 ARG NH2 N -10.142 -2.105 -3.666 1.00 . A A . 14 ARG NH2 1 1 3 1462 1 1 14 ARG O O -3.869 -2.014 0.136 1.00 . A A . 14 ARG O 1 1 3 1463 1 1 15 CYS C C -4.606 1.383 -0.028 1.00 . A A . 15 CYS C 1 1 3 1464 1 1 15 CYS CA C -3.279 0.665 -0.256 1.00 . A A . 15 CYS CA 1 1 3 1465 1 1 15 CYS CB C -2.196 1.679 -0.629 1.00 . A A . 15 CYS CB 1 1 3 1466 1 1 15 CYS H H -3.278 -0.083 -2.236 1.00 . A A . 15 CYS H 1 1 3 1467 1 1 15 CYS HA H -2.992 0.165 0.657 1.00 . A A . 15 CYS HA 1 1 3 1468 1 1 15 CYS HB2 H -1.334 1.151 -1.008 1.00 . A A . 15 CYS HB2 1 1 3 1469 1 1 15 CYS HB3 H -2.577 2.334 -1.399 1.00 . A A . 15 CYS HB3 1 1 3 1470 1 1 15 CYS N N -3.407 -0.345 -1.300 1.00 . A A . 15 CYS N 1 1 3 1471 1 1 15 CYS O O -5.254 1.827 -0.975 1.00 . A A . 15 CYS O 1 1 3 1472 1 1 15 CYS SG S -1.640 2.719 0.760 1.00 . A A . 15 CYS SG 1 1 3 1473 1 1 16 ALA C C -6.049 3.659 1.741 1.00 . A A . 16 ALA C 1 1 3 1474 1 1 16 ALA CA C -6.252 2.156 1.589 1.00 . A A . 16 ALA CA 1 1 3 1475 1 1 16 ALA CB C -6.820 1.565 2.871 1.00 . A A . 16 ALA CB 1 1 3 1476 1 1 16 ALA H H -4.444 1.116 1.947 1.00 . A A . 16 ALA H 1 1 3 1477 1 1 16 ALA HA H -6.962 1.977 0.794 1.00 . A A . 16 ALA HA 1 1 3 1478 1 1 16 ALA HB1 H -7.862 1.323 2.725 1.00 . A A . 16 ALA HB1 1 1 3 1479 1 1 16 ALA HB2 H -6.273 0.669 3.127 1.00 . A A . 16 ALA HB2 1 1 3 1480 1 1 16 ALA HB3 H -6.726 2.285 3.671 1.00 . A A . 16 ALA HB3 1 1 3 1481 1 1 16 ALA N N -5.004 1.491 1.236 1.00 . A A . 16 ALA N 1 1 3 1482 1 1 16 ALA O O -7.001 4.402 1.978 1.00 . A A . 16 ALA O 1 1 3 1483 1 1 17 GLU C C -4.602 6.224 0.382 1.00 . A A . 17 GLU C 1 1 3 1484 1 1 17 GLU CA C -4.476 5.516 1.729 1.00 . A A . 17 GLU CA 1 1 3 1485 1 1 17 GLU CB C -3.058 5.689 2.278 1.00 . A A . 17 GLU CB 1 1 3 1486 1 1 17 GLU CD C -2.726 4.009 4.134 1.00 . A A . 17 GLU CD 1 1 3 1487 1 1 17 GLU CG C -2.955 5.465 3.777 1.00 . A A . 17 GLU CG 1 1 3 1488 1 1 17 GLU H H -4.086 3.459 1.416 1.00 . A A . 17 GLU H 1 1 3 1489 1 1 17 GLU HA H -5.177 5.959 2.421 1.00 . A A . 17 GLU HA 1 1 3 1490 1 1 17 GLU HB2 H -2.405 4.986 1.782 1.00 . A A . 17 GLU HB2 1 1 3 1491 1 1 17 GLU HB3 H -2.722 6.692 2.061 1.00 . A A . 17 GLU HB3 1 1 3 1492 1 1 17 GLU HG2 H -2.130 6.047 4.159 1.00 . A A . 17 GLU HG2 1 1 3 1493 1 1 17 GLU HG3 H -3.872 5.794 4.242 1.00 . A A . 17 GLU HG3 1 1 3 1494 1 1 17 GLU N N -4.803 4.101 1.604 1.00 . A A . 17 GLU N 1 1 3 1495 1 1 17 GLU O O -5.379 7.167 0.234 1.00 . A A . 17 GLU O 1 1 3 1496 1 1 17 GLU OE1 O -3.121 3.132 3.337 1.00 . A A . 17 GLU OE1 1 1 3 1497 1 1 17 GLU OE2 O -2.152 3.746 5.212 1.00 . A A . 17 GLU OE2 1 1 3 1498 1 1 18 CYS C C -4.608 5.451 -2.907 1.00 . A A . 18 CYS C 1 1 3 1499 1 1 18 CYS CA C -3.854 6.349 -1.931 1.00 . A A . 18 CYS CA 1 1 3 1500 1 1 18 CYS CB C -2.427 6.582 -2.432 1.00 . A A . 18 CYS CB 1 1 3 1501 1 1 18 CYS H H -3.231 5.006 -0.417 1.00 . A A . 18 CYS H 1 1 3 1502 1 1 18 CYS HA H -4.363 7.298 -1.867 1.00 . A A . 18 CYS HA 1 1 3 1503 1 1 18 CYS HB2 H -2.465 6.923 -3.457 1.00 . A A . 18 CYS HB2 1 1 3 1504 1 1 18 CYS HB3 H -1.959 7.342 -1.823 1.00 . A A . 18 CYS HB3 1 1 3 1505 1 1 18 CYS N N -3.831 5.762 -0.596 1.00 . A A . 18 CYS N 1 1 3 1506 1 1 18 CYS O O -5.486 5.909 -3.637 1.00 . A A . 18 CYS O 1 1 3 1507 1 1 18 CYS SG S -1.370 5.100 -2.382 1.00 . A A . 18 CYS SG 1 1 3 1508 1 1 19 GLY C C -3.937 2.557 -4.756 1.00 . A A . 19 GLY C 1 1 3 1509 1 1 19 GLY CA C -4.910 3.227 -3.805 1.00 . A A . 19 GLY CA 1 1 3 1510 1 1 19 GLY H H -3.550 3.859 -2.311 1.00 . A A . 19 GLY H 1 1 3 1511 1 1 19 GLY HA2 H -5.399 2.467 -3.213 1.00 . A A . 19 GLY HA2 1 1 3 1512 1 1 19 GLY HA3 H -5.656 3.753 -4.384 1.00 . A A . 19 GLY HA3 1 1 3 1513 1 1 19 GLY N N -4.257 4.169 -2.915 1.00 . A A . 19 GLY N 1 1 3 1514 1 1 19 GLY O O -4.244 2.357 -5.931 1.00 . A A . 19 GLY O 1 1 3 1515 1 1 20 LYS C C -1.889 0.044 -5.012 1.00 . A A . 20 LYS C 1 1 3 1516 1 1 20 LYS CA C -1.737 1.561 -5.058 1.00 . A A . 20 LYS CA 1 1 3 1517 1 1 20 LYS CB C -0.342 1.959 -4.572 1.00 . A A . 20 LYS CB 1 1 3 1518 1 1 20 LYS CD C 1.954 2.491 -5.442 1.00 . A A . 20 LYS CD 1 1 3 1519 1 1 20 LYS CE C 3.087 2.045 -6.354 1.00 . A A . 20 LYS CE 1 1 3 1520 1 1 20 LYS CG C 0.774 1.536 -5.512 1.00 . A A . 20 LYS CG 1 1 3 1521 1 1 20 LYS H H -2.574 2.397 -3.303 1.00 . A A . 20 LYS H 1 1 3 1522 1 1 20 LYS HA H -1.862 1.892 -6.078 1.00 . A A . 20 LYS HA 1 1 3 1523 1 1 20 LYS HB2 H -0.304 3.033 -4.463 1.00 . A A . 20 LYS HB2 1 1 3 1524 1 1 20 LYS HB3 H -0.165 1.502 -3.609 1.00 . A A . 20 LYS HB3 1 1 3 1525 1 1 20 LYS HD2 H 1.628 3.475 -5.747 1.00 . A A . 20 LYS HD2 1 1 3 1526 1 1 20 LYS HD3 H 2.316 2.529 -4.425 1.00 . A A . 20 LYS HD3 1 1 3 1527 1 1 20 LYS HE2 H 3.559 1.177 -5.920 1.00 . A A . 20 LYS HE2 1 1 3 1528 1 1 20 LYS HE3 H 2.674 1.786 -7.318 1.00 . A A . 20 LYS HE3 1 1 3 1529 1 1 20 LYS HG2 H 1.109 0.547 -5.237 1.00 . A A . 20 LYS HG2 1 1 3 1530 1 1 20 LYS HG3 H 0.393 1.521 -6.523 1.00 . A A . 20 LYS HG3 1 1 3 1531 1 1 20 LYS HZ1 H 4.848 3.026 -5.809 1.00 . A A . 20 LYS HZ1 1 1 3 1532 1 1 20 LYS HZ2 H 3.663 4.050 -6.449 1.00 . A A . 20 LYS HZ2 1 1 3 1533 1 1 20 LYS HZ3 H 4.546 3.034 -7.474 1.00 . A A . 20 LYS HZ3 1 1 3 1534 1 1 20 LYS N N -2.759 2.211 -4.247 1.00 . A A . 20 LYS N 1 1 3 1535 1 1 20 LYS NZ N 4.108 3.114 -6.534 1.00 . A A . 20 LYS NZ 1 1 3 1536 1 1 20 LYS O O -2.349 -0.513 -4.016 1.00 . A A . 20 LYS O 1 1 3 1537 1 1 21 ALA C C -0.243 -2.722 -5.876 1.00 . A A . 21 ALA C 1 1 3 1538 1 1 21 ALA CA C -1.589 -2.071 -6.177 1.00 . A A . 21 ALA CA 1 1 3 1539 1 1 21 ALA CB C -2.087 -2.493 -7.551 1.00 . A A . 21 ALA CB 1 1 3 1540 1 1 21 ALA H H -1.140 -0.119 -6.858 1.00 . A A . 21 ALA H 1 1 3 1541 1 1 21 ALA HA H -2.309 -2.403 -5.443 1.00 . A A . 21 ALA HA 1 1 3 1542 1 1 21 ALA HB1 H -1.702 -3.474 -7.787 1.00 . A A . 21 ALA HB1 1 1 3 1543 1 1 21 ALA HB2 H -3.167 -2.520 -7.549 1.00 . A A . 21 ALA HB2 1 1 3 1544 1 1 21 ALA HB3 H -1.745 -1.785 -8.291 1.00 . A A . 21 ALA HB3 1 1 3 1545 1 1 21 ALA N N -1.499 -0.619 -6.096 1.00 . A A . 21 ALA N 1 1 3 1546 1 1 21 ALA O O 0.803 -2.237 -6.309 1.00 . A A . 21 ALA O 1 1 3 1547 1 1 22 PHE C C 0.757 -6.045 -4.942 1.00 . A A . 22 PHE C 1 1 3 1548 1 1 22 PHE CA C 0.942 -4.540 -4.773 1.00 . A A . 22 PHE CA 1 1 3 1549 1 1 22 PHE CB C 1.339 -4.222 -3.330 1.00 . A A . 22 PHE CB 1 1 3 1550 1 1 22 PHE CD1 C 0.366 -1.974 -2.783 1.00 . A A . 22 PHE CD1 1 1 3 1551 1 1 22 PHE CD2 C 2.726 -2.147 -3.073 1.00 . A A . 22 PHE CD2 1 1 3 1552 1 1 22 PHE CE1 C 0.493 -0.621 -2.532 1.00 . A A . 22 PHE CE1 1 1 3 1553 1 1 22 PHE CE2 C 2.860 -0.794 -2.822 1.00 . A A . 22 PHE CE2 1 1 3 1554 1 1 22 PHE CG C 1.480 -2.752 -3.057 1.00 . A A . 22 PHE CG 1 1 3 1555 1 1 22 PHE CZ C 1.742 -0.031 -2.551 1.00 . A A . 22 PHE CZ 1 1 3 1556 1 1 22 PHE H H -1.141 -4.161 -4.817 1.00 . A A . 22 PHE H 1 1 3 1557 1 1 22 PHE HA H 1.728 -4.209 -5.434 1.00 . A A . 22 PHE HA 1 1 3 1558 1 1 22 PHE HB2 H 0.585 -4.612 -2.662 1.00 . A A . 22 PHE HB2 1 1 3 1559 1 1 22 PHE HB3 H 2.285 -4.694 -3.112 1.00 . A A . 22 PHE HB3 1 1 3 1560 1 1 22 PHE HD1 H -0.611 -2.435 -2.767 1.00 . A A . 22 PHE HD1 1 1 3 1561 1 1 22 PHE HD2 H 3.602 -2.744 -3.285 1.00 . A A . 22 PHE HD2 1 1 3 1562 1 1 22 PHE HE1 H -0.383 -0.026 -2.320 1.00 . A A . 22 PHE HE1 1 1 3 1563 1 1 22 PHE HE2 H 3.837 -0.336 -2.838 1.00 . A A . 22 PHE HE2 1 1 3 1564 1 1 22 PHE HZ H 1.843 1.026 -2.355 1.00 . A A . 22 PHE HZ 1 1 3 1565 1 1 22 PHE N N -0.276 -3.823 -5.132 1.00 . A A . 22 PHE N 1 1 3 1566 1 1 22 PHE O O -0.338 -6.573 -4.751 1.00 . A A . 22 PHE O 1 1 3 1567 1 1 23 THR C C 2.228 -8.914 -4.238 1.00 . A A . 23 THR C 1 1 3 1568 1 1 23 THR CA C 1.796 -8.174 -5.499 1.00 . A A . 23 THR CA 1 1 3 1569 1 1 23 THR CB C 2.698 -8.608 -6.670 1.00 . A A . 23 THR CB 1 1 3 1570 1 1 23 THR CG2 C 4.135 -8.166 -6.438 1.00 . A A . 23 THR CG2 1 1 3 1571 1 1 23 THR H H 2.682 -6.253 -5.439 1.00 . A A . 23 THR H 1 1 3 1572 1 1 23 THR HA H 0.778 -8.449 -5.735 1.00 . A A . 23 THR HA 1 1 3 1573 1 1 23 THR HB H 2.335 -8.143 -7.575 1.00 . A A . 23 THR HB 1 1 3 1574 1 1 23 THR HG1 H 3.163 -10.446 -6.127 1.00 . A A . 23 THR HG1 1 1 3 1575 1 1 23 THR HG21 H 4.211 -7.681 -5.477 1.00 . A A . 23 THR HG21 1 1 3 1576 1 1 23 THR HG22 H 4.429 -7.475 -7.214 1.00 . A A . 23 THR HG22 1 1 3 1577 1 1 23 THR HG23 H 4.785 -9.029 -6.459 1.00 . A A . 23 THR HG23 1 1 3 1578 1 1 23 THR N N 1.838 -6.731 -5.302 1.00 . A A . 23 THR N 1 1 3 1579 1 1 23 THR O O 1.911 -10.089 -4.057 1.00 . A A . 23 THR O 1 1 3 1580 1 1 23 THR OG1 O 2.650 -10.031 -6.824 1.00 . A A . 23 THR OG1 1 1 3 1581 1 1 24 ASP C C 3.304 -7.819 -0.970 1.00 . A A . 24 ASP C 1 1 3 1582 1 1 24 ASP CA C 3.429 -8.809 -2.124 1.00 . A A . 24 ASP CA 1 1 3 1583 1 1 24 ASP CB C 4.883 -9.260 -2.270 1.00 . A A . 24 ASP CB 1 1 3 1584 1 1 24 ASP CG C 5.266 -10.318 -1.254 1.00 . A A . 24 ASP CG 1 1 3 1585 1 1 24 ASP H H 3.175 -7.285 -3.571 1.00 . A A . 24 ASP H 1 1 3 1586 1 1 24 ASP HA H 2.814 -9.670 -1.910 1.00 . A A . 24 ASP HA 1 1 3 1587 1 1 24 ASP HB2 H 5.028 -9.669 -3.259 1.00 . A A . 24 ASP HB2 1 1 3 1588 1 1 24 ASP HB3 H 5.532 -8.408 -2.138 1.00 . A A . 24 ASP HB3 1 1 3 1589 1 1 24 ASP N N 2.954 -8.218 -3.369 1.00 . A A . 24 ASP N 1 1 3 1590 1 1 24 ASP O O 3.583 -6.630 -1.127 1.00 . A A . 24 ASP O 1 1 3 1591 1 1 24 ASP OD1 O 4.359 -11.017 -0.755 1.00 . A A . 24 ASP OD1 1 1 3 1592 1 1 24 ASP OD2 O 6.472 -10.447 -0.957 1.00 . A A . 24 ASP OD2 1 1 3 1593 1 1 25 ARG C C 3.973 -6.645 1.622 1.00 . A A . 25 ARG C 1 1 3 1594 1 1 25 ARG CA C 2.717 -7.474 1.366 1.00 . A A . 25 ARG CA 1 1 3 1595 1 1 25 ARG CB C 2.402 -8.333 2.593 1.00 . A A . 25 ARG CB 1 1 3 1596 1 1 25 ARG CD C 0.584 -8.919 4.225 1.00 . A A . 25 ARG CD 1 1 3 1597 1 1 25 ARG CG C 0.920 -8.617 2.773 1.00 . A A . 25 ARG CG 1 1 3 1598 1 1 25 ARG CZ C -1.173 -10.639 4.225 1.00 . A A . 25 ARG CZ 1 1 3 1599 1 1 25 ARG H H 2.674 -9.272 0.250 1.00 . A A . 25 ARG H 1 1 3 1600 1 1 25 ARG HA H 1.889 -6.806 1.184 1.00 . A A . 25 ARG HA 1 1 3 1601 1 1 25 ARG HB2 H 2.918 -9.278 2.498 1.00 . A A . 25 ARG HB2 1 1 3 1602 1 1 25 ARG HB3 H 2.759 -7.824 3.475 1.00 . A A . 25 ARG HB3 1 1 3 1603 1 1 25 ARG HD2 H 1.251 -9.689 4.583 1.00 . A A . 25 ARG HD2 1 1 3 1604 1 1 25 ARG HD3 H 0.725 -8.021 4.808 1.00 . A A . 25 ARG HD3 1 1 3 1605 1 1 25 ARG HE H -1.470 -8.707 4.621 1.00 . A A . 25 ARG HE 1 1 3 1606 1 1 25 ARG HG2 H 0.356 -7.752 2.457 1.00 . A A . 25 ARG HG2 1 1 3 1607 1 1 25 ARG HG3 H 0.649 -9.467 2.165 1.00 . A A . 25 ARG HG3 1 1 3 1608 1 1 25 ARG HH11 H 0.679 -11.315 3.783 1.00 . A A . 25 ARG HH11 1 1 3 1609 1 1 25 ARG HH12 H -0.569 -12.517 3.787 1.00 . A A . 25 ARG HH12 1 1 3 1610 1 1 25 ARG HH21 H -3.121 -10.280 4.629 1.00 . A A . 25 ARG HH21 1 1 3 1611 1 1 25 ARG HH22 H -2.730 -11.927 4.267 1.00 . A A . 25 ARG HH22 1 1 3 1612 1 1 25 ARG N N 2.881 -8.316 0.187 1.00 . A A . 25 ARG N 1 1 3 1613 1 1 25 ARG NE N -0.794 -9.376 4.384 1.00 . A A . 25 ARG NE 1 1 3 1614 1 1 25 ARG NH1 N -0.281 -11.566 3.905 1.00 . A A . 25 ARG NH1 1 1 3 1615 1 1 25 ARG NH2 N -2.446 -10.977 4.387 1.00 . A A . 25 ARG NH2 1 1 3 1616 1 1 25 ARG O O 3.906 -5.422 1.745 1.00 . A A . 25 ARG O 1 1 3 1617 1 1 26 SER C C 6.471 -5.345 1.154 1.00 . A A . 26 SER C 1 1 3 1618 1 1 26 SER CA C 6.385 -6.646 1.945 1.00 . A A . 26 SER CA 1 1 3 1619 1 1 26 SER CB C 7.552 -7.562 1.571 1.00 . A A . 26 SER CB 1 1 3 1620 1 1 26 SER H H 5.103 -8.294 1.594 1.00 . A A . 26 SER H 1 1 3 1621 1 1 26 SER HA H 6.441 -6.418 2.999 1.00 . A A . 26 SER HA 1 1 3 1622 1 1 26 SER HB2 H 7.515 -8.455 2.176 1.00 . A A . 26 SER HB2 1 1 3 1623 1 1 26 SER HB3 H 7.475 -7.830 0.527 1.00 . A A . 26 SER HB3 1 1 3 1624 1 1 26 SER HG H 9.305 -7.409 2.434 1.00 . A A . 26 SER HG 1 1 3 1625 1 1 26 SER N N 5.115 -7.320 1.700 1.00 . A A . 26 SER N 1 1 3 1626 1 1 26 SER O O 6.728 -4.280 1.715 1.00 . A A . 26 SER O 1 1 3 1627 1 1 26 SER OG O 8.796 -6.916 1.786 1.00 . A A . 26 SER OG 1 1 3 1628 1 1 27 ASN C C 5.324 -3.200 -0.557 1.00 . A A . 27 ASN C 1 1 3 1629 1 1 27 ASN CA C 6.307 -4.269 -1.024 1.00 . A A . 27 ASN CA 1 1 3 1630 1 1 27 ASN CB C 5.997 -4.668 -2.468 1.00 . A A . 27 ASN CB 1 1 3 1631 1 1 27 ASN CG C 7.145 -5.413 -3.121 1.00 . A A . 27 ASN CG 1 1 3 1632 1 1 27 ASN H H 6.054 -6.315 -0.544 1.00 . A A . 27 ASN H 1 1 3 1633 1 1 27 ASN HA H 7.308 -3.867 -0.977 1.00 . A A . 27 ASN HA 1 1 3 1634 1 1 27 ASN HB2 H 5.126 -5.307 -2.480 1.00 . A A . 27 ASN HB2 1 1 3 1635 1 1 27 ASN HB3 H 5.794 -3.778 -3.045 1.00 . A A . 27 ASN HB3 1 1 3 1636 1 1 27 ASN HD21 H 5.878 -6.360 -4.326 1.00 . A A . 27 ASN HD21 1 1 3 1637 1 1 27 ASN HD22 H 7.547 -6.758 -4.529 1.00 . A A . 27 ASN HD22 1 1 3 1638 1 1 27 ASN N N 6.254 -5.439 -0.154 1.00 . A A . 27 ASN N 1 1 3 1639 1 1 27 ASN ND2 N 6.824 -6.263 -4.090 1.00 . A A . 27 ASN ND2 1 1 3 1640 1 1 27 ASN O O 5.653 -2.013 -0.519 1.00 . A A . 27 ASN O 1 1 3 1641 1 1 27 ASN OD1 O 8.307 -5.227 -2.759 1.00 . A A . 27 ASN OD1 1 1 3 1642 1 1 28 LEU C C 3.526 -1.993 1.535 1.00 . A A . 28 LEU C 1 1 3 1643 1 1 28 LEU CA C 3.086 -2.706 0.261 1.00 . A A . 28 LEU CA 1 1 3 1644 1 1 28 LEU CB C 1.777 -3.459 0.510 1.00 . A A . 28 LEU CB 1 1 3 1645 1 1 28 LEU CD1 C 0.218 -1.497 0.431 1.00 . A A . 28 LEU CD1 1 1 3 1646 1 1 28 LEU CD2 C -0.479 -3.599 1.593 1.00 . A A . 28 LEU CD2 1 1 3 1647 1 1 28 LEU CG C 0.689 -2.685 1.256 1.00 . A A . 28 LEU CG 1 1 3 1648 1 1 28 LEU H H 3.914 -4.584 -0.256 1.00 . A A . 28 LEU H 1 1 3 1649 1 1 28 LEU HA H 2.926 -1.970 -0.513 1.00 . A A . 28 LEU HA 1 1 3 1650 1 1 28 LEU HB2 H 1.377 -3.751 -0.448 1.00 . A A . 28 LEU HB2 1 1 3 1651 1 1 28 LEU HB3 H 2.010 -4.343 1.086 1.00 . A A . 28 LEU HB3 1 1 3 1652 1 1 28 LEU HD11 H -0.335 -1.851 -0.426 1.00 . A A . 28 LEU HD11 1 1 3 1653 1 1 28 LEU HD12 H 1.074 -0.929 0.096 1.00 . A A . 28 LEU HD12 1 1 3 1654 1 1 28 LEU HD13 H -0.417 -0.868 1.036 1.00 . A A . 28 LEU HD13 1 1 3 1655 1 1 28 LEU HD21 H -0.596 -3.653 2.665 1.00 . A A . 28 LEU HD21 1 1 3 1656 1 1 28 LEU HD22 H -0.287 -4.587 1.201 1.00 . A A . 28 LEU HD22 1 1 3 1657 1 1 28 LEU HD23 H -1.383 -3.206 1.151 1.00 . A A . 28 LEU HD23 1 1 3 1658 1 1 28 LEU HG H 1.097 -2.306 2.183 1.00 . A A . 28 LEU HG 1 1 3 1659 1 1 28 LEU N N 4.117 -3.627 -0.204 1.00 . A A . 28 LEU N 1 1 3 1660 1 1 28 LEU O O 3.425 -0.771 1.642 1.00 . A A . 28 LEU O 1 1 3 1661 1 1 29 PHE C C 5.514 -1.114 3.536 1.00 . A A . 29 PHE C 1 1 3 1662 1 1 29 PHE CA C 4.474 -2.207 3.767 1.00 . A A . 29 PHE CA 1 1 3 1663 1 1 29 PHE CB C 5.063 -3.309 4.650 1.00 . A A . 29 PHE CB 1 1 3 1664 1 1 29 PHE CD1 C 3.433 -3.566 6.540 1.00 . A A . 29 PHE CD1 1 1 3 1665 1 1 29 PHE CD2 C 3.645 -5.353 4.976 1.00 . A A . 29 PHE CD2 1 1 3 1666 1 1 29 PHE CE1 C 2.478 -4.284 7.236 1.00 . A A . 29 PHE CE1 1 1 3 1667 1 1 29 PHE CE2 C 2.691 -6.075 5.667 1.00 . A A . 29 PHE CE2 1 1 3 1668 1 1 29 PHE CG C 4.026 -4.091 5.404 1.00 . A A . 29 PHE CG 1 1 3 1669 1 1 29 PHE CZ C 2.108 -5.540 6.799 1.00 . A A . 29 PHE CZ 1 1 3 1670 1 1 29 PHE H H 4.072 -3.733 2.355 1.00 . A A . 29 PHE H 1 1 3 1671 1 1 29 PHE HA H 3.620 -1.776 4.265 1.00 . A A . 29 PHE HA 1 1 3 1672 1 1 29 PHE HB2 H 5.615 -4.000 4.031 1.00 . A A . 29 PHE HB2 1 1 3 1673 1 1 29 PHE HB3 H 5.733 -2.863 5.370 1.00 . A A . 29 PHE HB3 1 1 3 1674 1 1 29 PHE HD1 H 3.723 -2.583 6.883 1.00 . A A . 29 PHE HD1 1 1 3 1675 1 1 29 PHE HD2 H 4.101 -5.773 4.091 1.00 . A A . 29 PHE HD2 1 1 3 1676 1 1 29 PHE HE1 H 2.024 -3.862 8.120 1.00 . A A . 29 PHE HE1 1 1 3 1677 1 1 29 PHE HE2 H 2.403 -7.057 5.324 1.00 . A A . 29 PHE HE2 1 1 3 1678 1 1 29 PHE HZ H 1.361 -6.102 7.341 1.00 . A A . 29 PHE HZ 1 1 3 1679 1 1 29 PHE N N 4.017 -2.765 2.499 1.00 . A A . 29 PHE N 1 1 3 1680 1 1 29 PHE O O 5.467 -0.054 4.161 1.00 . A A . 29 PHE O 1 1 3 1681 1 1 30 THR C C 6.923 0.878 1.778 1.00 . A A . 30 THR C 1 1 3 1682 1 1 30 THR CA C 7.506 -0.422 2.321 1.00 . A A . 30 THR CA 1 1 3 1683 1 1 30 THR CB C 8.500 -0.995 1.294 1.00 . A A . 30 THR CB 1 1 3 1684 1 1 30 THR CG2 C 9.609 0.005 0.998 1.00 . A A . 30 THR CG2 1 1 3 1685 1 1 30 THR H H 6.438 -2.243 2.169 1.00 . A A . 30 THR H 1 1 3 1686 1 1 30 THR HA H 8.046 -0.209 3.233 1.00 . A A . 30 THR HA 1 1 3 1687 1 1 30 THR HB H 7.967 -1.201 0.376 1.00 . A A . 30 THR HB 1 1 3 1688 1 1 30 THR HG1 H 9.401 -2.732 1.051 1.00 . A A . 30 THR HG1 1 1 3 1689 1 1 30 THR HG21 H 10.431 -0.160 1.677 1.00 . A A . 30 THR HG21 1 1 3 1690 1 1 30 THR HG22 H 9.232 1.009 1.125 1.00 . A A . 30 THR HG22 1 1 3 1691 1 1 30 THR HG23 H 9.949 -0.126 -0.018 1.00 . A A . 30 THR HG23 1 1 3 1692 1 1 30 THR N N 6.454 -1.380 2.634 1.00 . A A . 30 THR N 1 1 3 1693 1 1 30 THR O O 7.413 1.965 2.082 1.00 . A A . 30 THR O 1 1 3 1694 1 1 30 THR OG1 O 9.068 -2.213 1.787 1.00 . A A . 30 THR OG1 1 1 3 1695 1 1 31 HIS C C 4.475 2.722 1.453 1.00 . A A . 31 HIS C 1 1 3 1696 1 1 31 HIS CA C 5.221 1.924 0.387 1.00 . A A . 31 HIS CA 1 1 3 1697 1 1 31 HIS CB C 4.252 1.495 -0.715 1.00 . A A . 31 HIS CB 1 1 3 1698 1 1 31 HIS CD2 C 1.882 2.523 -0.493 1.00 . A A . 31 HIS CD2 1 1 3 1699 1 1 31 HIS CE1 C 2.161 4.258 -1.804 1.00 . A A . 31 HIS CE1 1 1 3 1700 1 1 31 HIS CG C 3.151 2.479 -0.962 1.00 . A A . 31 HIS CG 1 1 3 1701 1 1 31 HIS H H 5.527 -0.136 0.767 1.00 . A A . 31 HIS H 1 1 3 1702 1 1 31 HIS HA H 5.987 2.551 -0.043 1.00 . A A . 31 HIS HA 1 1 3 1703 1 1 31 HIS HB2 H 4.800 1.372 -1.638 1.00 . A A . 31 HIS HB2 1 1 3 1704 1 1 31 HIS HB3 H 3.801 0.552 -0.442 1.00 . A A . 31 HIS HB3 1 1 3 1705 1 1 31 HIS HD1 H 4.105 3.825 -2.271 1.00 . A A . 31 HIS HD1 1 1 3 1706 1 1 31 HIS HD2 H 1.421 1.813 0.180 1.00 . A A . 31 HIS HD2 1 1 3 1707 1 1 31 HIS HE1 H 1.978 5.165 -2.360 1.00 . A A . 31 HIS HE1 1 1 3 1708 1 1 31 HIS N N 5.872 0.758 0.972 1.00 . A A . 31 HIS N 1 1 3 1709 1 1 31 HIS ND1 N 3.293 3.579 -1.781 1.00 . A A . 31 HIS ND1 1 1 3 1710 1 1 31 HIS NE2 N 1.287 3.638 -1.031 1.00 . A A . 31 HIS NE2 1 1 3 1711 1 1 31 HIS O O 4.607 3.943 1.532 1.00 . A A . 31 HIS O 1 1 3 1712 1 1 32 GLN C C 3.782 3.681 4.081 1.00 . A A . 32 GLN C 1 1 3 1713 1 1 32 GLN CA C 2.926 2.667 3.329 1.00 . A A . 32 GLN CA 1 1 3 1714 1 1 32 GLN CB C 2.380 1.620 4.301 1.00 . A A . 32 GLN CB 1 1 3 1715 1 1 32 GLN CD C 0.228 0.510 5.021 1.00 . A A . 32 GLN CD 1 1 3 1716 1 1 32 GLN CG C 1.063 1.004 3.857 1.00 . A A . 32 GLN CG 1 1 3 1717 1 1 32 GLN H H 3.630 1.052 2.156 1.00 . A A . 32 GLN H 1 1 3 1718 1 1 32 GLN HA H 2.097 3.185 2.870 1.00 . A A . 32 GLN HA 1 1 3 1719 1 1 32 GLN HB2 H 3.107 0.828 4.404 1.00 . A A . 32 GLN HB2 1 1 3 1720 1 1 32 GLN HB3 H 2.228 2.085 5.264 1.00 . A A . 32 GLN HB3 1 1 3 1721 1 1 32 GLN HE21 H -1.429 0.673 3.933 1.00 . A A . 32 GLN HE21 1 1 3 1722 1 1 32 GLN HE22 H -1.645 0.103 5.550 1.00 . A A . 32 GLN HE22 1 1 3 1723 1 1 32 GLN HG2 H 0.496 1.749 3.318 1.00 . A A . 32 GLN HG2 1 1 3 1724 1 1 32 GLN HG3 H 1.273 0.171 3.203 1.00 . A A . 32 GLN HG3 1 1 3 1725 1 1 32 GLN N N 3.693 2.023 2.269 1.00 . A A . 32 GLN N 1 1 3 1726 1 1 32 GLN NE2 N -1.081 0.420 4.815 1.00 . A A . 32 GLN NE2 1 1 3 1727 1 1 32 GLN O O 3.262 4.596 4.720 1.00 . A A . 32 GLN O 1 1 3 1728 1 1 32 GLN OE1 O 0.752 0.213 6.095 1.00 . A A . 32 GLN OE1 1 1 3 1729 1 1 33 LYS C C 5.668 5.867 4.402 1.00 . A A . 33 LYS C 1 1 3 1730 1 1 33 LYS CA C 6.027 4.410 4.676 1.00 . A A . 33 LYS CA 1 1 3 1731 1 1 33 LYS CB C 7.460 4.132 4.218 1.00 . A A . 33 LYS CB 1 1 3 1732 1 1 33 LYS CD C 9.595 2.878 4.641 1.00 . A A . 33 LYS CD 1 1 3 1733 1 1 33 LYS CE C 10.133 1.468 4.829 1.00 . A A . 33 LYS CE 1 1 3 1734 1 1 33 LYS CG C 8.103 2.948 4.919 1.00 . A A . 33 LYS CG 1 1 3 1735 1 1 33 LYS H H 5.452 2.762 3.479 1.00 . A A . 33 LYS H 1 1 3 1736 1 1 33 LYS HA H 5.955 4.228 5.737 1.00 . A A . 33 LYS HA 1 1 3 1737 1 1 33 LYS HB2 H 7.454 3.935 3.156 1.00 . A A . 33 LYS HB2 1 1 3 1738 1 1 33 LYS HB3 H 8.063 5.008 4.409 1.00 . A A . 33 LYS HB3 1 1 3 1739 1 1 33 LYS HD2 H 9.778 3.187 3.622 1.00 . A A . 33 LYS HD2 1 1 3 1740 1 1 33 LYS HD3 H 10.110 3.544 5.319 1.00 . A A . 33 LYS HD3 1 1 3 1741 1 1 33 LYS HE2 H 9.389 0.765 4.487 1.00 . A A . 33 LYS HE2 1 1 3 1742 1 1 33 LYS HE3 H 11.031 1.357 4.240 1.00 . A A . 33 LYS HE3 1 1 3 1743 1 1 33 LYS HG2 H 7.950 3.044 5.983 1.00 . A A . 33 LYS HG2 1 1 3 1744 1 1 33 LYS HG3 H 7.638 2.037 4.568 1.00 . A A . 33 LYS HG3 1 1 3 1745 1 1 33 LYS HZ1 H 11.475 1.046 6.374 1.00 . A A . 33 LYS HZ1 1 1 3 1746 1 1 33 LYS HZ2 H 9.960 0.318 6.564 1.00 . A A . 33 LYS HZ2 1 1 3 1747 1 1 33 LYS HZ3 H 10.144 1.973 6.856 1.00 . A A . 33 LYS HZ3 1 1 3 1748 1 1 33 LYS N N 5.097 3.511 4.003 1.00 . A A . 33 LYS N 1 1 3 1749 1 1 33 LYS NZ N 10.450 1.181 6.256 1.00 . A A . 33 LYS NZ 1 1 3 1750 1 1 33 LYS O O 5.615 6.686 5.320 1.00 . A A . 33 LYS O 1 1 3 1751 1 1 34 ILE C C 3.826 8.021 3.486 1.00 . A A . 34 ILE C 1 1 3 1752 1 1 34 ILE CA C 5.067 7.541 2.741 1.00 . A A . 34 ILE CA 1 1 3 1753 1 1 34 ILE CB C 4.812 7.640 1.226 1.00 . A A . 34 ILE CB 1 1 3 1754 1 1 34 ILE CD1 C 2.909 7.346 -0.439 1.00 . A A . 34 ILE CD1 1 1 3 1755 1 1 34 ILE CG1 C 3.547 6.868 0.847 1.00 . A A . 34 ILE CG1 1 1 3 1756 1 1 34 ILE CG2 C 6.012 7.112 0.452 1.00 . A A . 34 ILE CG2 1 1 3 1757 1 1 34 ILE H H 5.481 5.486 2.448 1.00 . A A . 34 ILE H 1 1 3 1758 1 1 34 ILE HA H 5.896 8.188 2.990 1.00 . A A . 34 ILE HA 1 1 3 1759 1 1 34 ILE HB H 4.680 8.680 0.972 1.00 . A A . 34 ILE HB 1 1 3 1760 1 1 34 ILE HD11 H 2.781 6.508 -1.109 1.00 . A A . 34 ILE HD11 1 1 3 1761 1 1 34 ILE HD12 H 1.946 7.783 -0.223 1.00 . A A . 34 ILE HD12 1 1 3 1762 1 1 34 ILE HD13 H 3.545 8.084 -0.904 1.00 . A A . 34 ILE HD13 1 1 3 1763 1 1 34 ILE HG12 H 3.791 5.824 0.728 1.00 . A A . 34 ILE HG12 1 1 3 1764 1 1 34 ILE HG13 H 2.819 6.975 1.639 1.00 . A A . 34 ILE HG13 1 1 3 1765 1 1 34 ILE HG21 H 6.606 6.481 1.096 1.00 . A A . 34 ILE HG21 1 1 3 1766 1 1 34 ILE HG22 H 5.669 6.539 -0.396 1.00 . A A . 34 ILE HG22 1 1 3 1767 1 1 34 ILE HG23 H 6.612 7.941 0.108 1.00 . A A . 34 ILE HG23 1 1 3 1768 1 1 34 ILE N N 5.422 6.183 3.135 1.00 . A A . 34 ILE N 1 1 3 1769 1 1 34 ILE O O 3.611 9.223 3.646 1.00 . A A . 34 ILE O 1 1 3 1770 1 1 35 HIS C C 2.044 7.402 6.176 1.00 . A A . 35 HIS C 1 1 3 1771 1 1 35 HIS CA C 1.792 7.401 4.671 1.00 . A A . 35 HIS CA 1 1 3 1772 1 1 35 HIS CB C 0.684 6.404 4.328 1.00 . A A . 35 HIS CB 1 1 3 1773 1 1 35 HIS CD2 C 0.348 5.576 1.894 1.00 . A A . 35 HIS CD2 1 1 3 1774 1 1 35 HIS CE1 C -0.678 7.340 1.094 1.00 . A A . 35 HIS CE1 1 1 3 1775 1 1 35 HIS CG C 0.237 6.473 2.901 1.00 . A A . 35 HIS CG 1 1 3 1776 1 1 35 HIS H H 3.236 6.134 3.782 1.00 . A A . 35 HIS H 1 1 3 1777 1 1 35 HIS HA H 1.480 8.390 4.371 1.00 . A A . 35 HIS HA 1 1 3 1778 1 1 35 HIS HB2 H 1.040 5.402 4.516 1.00 . A A . 35 HIS HB2 1 1 3 1779 1 1 35 HIS HB3 H -0.174 6.599 4.956 1.00 . A A . 35 HIS HB3 1 1 3 1780 1 1 35 HIS HD1 H -0.638 8.389 2.850 1.00 . A A . 35 HIS HD1 1 1 3 1781 1 1 35 HIS HD2 H 0.804 4.598 1.953 1.00 . A A . 35 HIS HD2 1 1 3 1782 1 1 35 HIS HE1 H -1.179 8.021 0.422 1.00 . A A . 35 HIS HE1 1 1 3 1783 1 1 35 HIS N N 3.011 7.074 3.941 1.00 . A A . 35 HIS N 1 1 3 1784 1 1 35 HIS ND1 N -0.409 7.568 2.367 1.00 . A A . 35 HIS ND1 1 1 3 1785 1 1 35 HIS NE2 N -0.229 6.138 0.782 1.00 . A A . 35 HIS NE2 1 1 3 1786 1 1 35 HIS O O 1.155 7.081 6.966 1.00 . A A . 35 HIS O 1 1 3 1787 1 1 36 THR C C 5.028 8.387 8.162 1.00 . A A . 36 THR C 1 1 3 1788 1 1 36 THR CA C 3.632 7.804 7.976 1.00 . A A . 36 THR CA 1 1 3 1789 1 1 36 THR CB C 3.585 6.401 8.610 1.00 . A A . 36 THR CB 1 1 3 1790 1 1 36 THR CG2 C 4.652 5.499 8.007 1.00 . A A . 36 THR CG2 1 1 3 1791 1 1 36 THR H H 3.927 8.008 5.891 1.00 . A A . 36 THR H 1 1 3 1792 1 1 36 THR HA H 2.918 8.432 8.490 1.00 . A A . 36 THR HA 1 1 3 1793 1 1 36 THR HB H 2.615 5.966 8.415 1.00 . A A . 36 THR HB 1 1 3 1794 1 1 36 THR HG1 H 3.376 5.737 10.455 1.00 . A A . 36 THR HG1 1 1 3 1795 1 1 36 THR HG21 H 4.649 4.548 8.517 1.00 . A A . 36 THR HG21 1 1 3 1796 1 1 36 THR HG22 H 5.621 5.964 8.118 1.00 . A A . 36 THR HG22 1 1 3 1797 1 1 36 THR HG23 H 4.444 5.347 6.958 1.00 . A A . 36 THR HG23 1 1 3 1798 1 1 36 THR N N 3.262 7.763 6.567 1.00 . A A . 36 THR N 1 1 3 1799 1 1 36 THR O O 5.956 8.047 7.430 1.00 . A A . 36 THR O 1 1 3 1800 1 1 36 THR OG1 O 3.778 6.496 10.026 1.00 . A A . 36 THR OG1 1 1 3 1801 1 1 37 GLY C C 6.459 10.698 10.691 1.00 . A A . 37 GLY C 1 1 3 1802 1 1 37 GLY CA C 6.457 9.884 9.412 1.00 . A A . 37 GLY CA 1 1 3 1803 1 1 37 GLY H H 4.394 9.502 9.700 1.00 . A A . 37 GLY H 1 1 3 1804 1 1 37 GLY HA2 H 7.205 9.110 9.489 1.00 . A A . 37 GLY HA2 1 1 3 1805 1 1 37 GLY HA3 H 6.709 10.534 8.586 1.00 . A A . 37 GLY HA3 1 1 3 1806 1 1 37 GLY N N 5.170 9.268 9.148 1.00 . A A . 37 GLY N 1 1 3 1807 1 1 37 GLY O O 6.920 11.839 10.707 1.00 . A A . 37 GLY O 1 1 3 1808 1 1 38 GLU C C 6.681 10.030 14.107 1.00 . A A . 38 GLU C 1 1 3 1809 1 1 38 GLU CA C 5.882 10.791 13.053 1.00 . A A . 38 GLU CA 1 1 3 1810 1 1 38 GLU CB C 4.429 10.943 13.510 1.00 . A A . 38 GLU CB 1 1 3 1811 1 1 38 GLU CD C 2.393 12.437 13.460 1.00 . A A . 38 GLU CD 1 1 3 1812 1 1 38 GLU CG C 3.658 12.005 12.744 1.00 . A A . 38 GLU CG 1 1 3 1813 1 1 38 GLU H H 5.588 9.200 11.689 1.00 . A A . 38 GLU H 1 1 3 1814 1 1 38 GLU HA H 6.314 11.772 12.930 1.00 . A A . 38 GLU HA 1 1 3 1815 1 1 38 GLU HB2 H 3.923 9.997 13.381 1.00 . A A . 38 GLU HB2 1 1 3 1816 1 1 38 GLU HB3 H 4.419 11.206 14.557 1.00 . A A . 38 GLU HB3 1 1 3 1817 1 1 38 GLU HG2 H 4.293 12.869 12.615 1.00 . A A . 38 GLU HG2 1 1 3 1818 1 1 38 GLU HG3 H 3.389 11.610 11.776 1.00 . A A . 38 GLU HG3 1 1 3 1819 1 1 38 GLU N N 5.940 10.111 11.765 1.00 . A A . 38 GLU N 1 1 3 1820 1 1 38 GLU O O 6.274 8.958 14.557 1.00 . A A . 38 GLU O 1 1 3 1821 1 1 38 GLU OE1 O 2.479 12.787 14.656 1.00 . A A . 38 GLU OE1 1 1 3 1822 1 1 38 GLU OE2 O 1.318 12.426 12.825 1.00 . A A . 38 GLU OE2 1 1 3 1823 1 1 39 LYS C C 8.780 10.840 16.745 1.00 . A A . 39 LYS C 1 1 3 1824 1 1 39 LYS CA C 8.678 9.968 15.498 1.00 . A A . 39 LYS CA 1 1 3 1825 1 1 39 LYS CB C 10.073 9.719 14.920 1.00 . A A . 39 LYS CB 1 1 3 1826 1 1 39 LYS CD C 11.595 9.082 16.814 1.00 . A A . 39 LYS CD 1 1 3 1827 1 1 39 LYS CE C 12.735 8.140 17.170 1.00 . A A . 39 LYS CE 1 1 3 1828 1 1 39 LYS CG C 10.821 8.588 15.604 1.00 . A A . 39 LYS CG 1 1 3 1829 1 1 39 LYS H H 8.091 11.447 14.102 1.00 . A A . 39 LYS H 1 1 3 1830 1 1 39 LYS HA H 8.236 9.021 15.770 1.00 . A A . 39 LYS HA 1 1 3 1831 1 1 39 LYS HB2 H 9.978 9.479 13.872 1.00 . A A . 39 LYS HB2 1 1 3 1832 1 1 39 LYS HB3 H 10.657 10.622 15.022 1.00 . A A . 39 LYS HB3 1 1 3 1833 1 1 39 LYS HD2 H 12.004 10.057 16.596 1.00 . A A . 39 LYS HD2 1 1 3 1834 1 1 39 LYS HD3 H 10.921 9.152 17.657 1.00 . A A . 39 LYS HD3 1 1 3 1835 1 1 39 LYS HE2 H 12.329 7.285 17.689 1.00 . A A . 39 LYS HE2 1 1 3 1836 1 1 39 LYS HE3 H 13.212 7.814 16.258 1.00 . A A . 39 LYS HE3 1 1 3 1837 1 1 39 LYS HG2 H 10.111 7.840 15.924 1.00 . A A . 39 LYS HG2 1 1 3 1838 1 1 39 LYS HG3 H 11.514 8.150 14.899 1.00 . A A . 39 LYS HG3 1 1 3 1839 1 1 39 LYS HZ1 H 13.597 9.828 18.049 1.00 . A A . 39 LYS HZ1 1 1 3 1840 1 1 39 LYS HZ2 H 14.705 8.603 17.684 1.00 . A A . 39 LYS HZ2 1 1 3 1841 1 1 39 LYS HZ3 H 13.672 8.439 19.012 1.00 . A A . 39 LYS HZ3 1 1 3 1842 1 1 39 LYS N N 7.820 10.591 14.497 1.00 . A A . 39 LYS N 1 1 3 1843 1 1 39 LYS NZ N 13.748 8.799 18.040 1.00 . A A . 39 LYS NZ 1 1 3 1844 1 1 39 LYS O O 9.767 11.544 16.960 1.00 . A A . 39 LYS O 1 1 3 1845 1 1 40 PRO C C 8.681 11.064 19.872 1.00 . A A . 40 PRO C 1 1 3 1846 1 1 40 PRO CA C 7.689 11.570 18.830 1.00 . A A . 40 PRO CA 1 1 3 1847 1 1 40 PRO CB C 6.252 11.368 19.319 1.00 . A A . 40 PRO CB 1 1 3 1848 1 1 40 PRO CD C 6.529 9.974 17.396 1.00 . A A . 40 PRO CD 1 1 3 1849 1 1 40 PRO CG C 5.829 10.069 18.724 1.00 . A A . 40 PRO CG 1 1 3 1850 1 1 40 PRO HA H 7.865 12.620 18.648 1.00 . A A . 40 PRO HA 1 1 3 1851 1 1 40 PRO HB2 H 6.238 11.332 20.399 1.00 . A A . 40 PRO HB2 1 1 3 1852 1 1 40 PRO HB3 H 5.633 12.181 18.972 1.00 . A A . 40 PRO HB3 1 1 3 1853 1 1 40 PRO HD2 H 6.788 8.949 17.178 1.00 . A A . 40 PRO HD2 1 1 3 1854 1 1 40 PRO HD3 H 5.909 10.384 16.612 1.00 . A A . 40 PRO HD3 1 1 3 1855 1 1 40 PRO HG2 H 6.130 9.256 19.366 1.00 . A A . 40 PRO HG2 1 1 3 1856 1 1 40 PRO HG3 H 4.758 10.062 18.584 1.00 . A A . 40 PRO HG3 1 1 3 1857 1 1 40 PRO N N 7.739 10.792 17.589 1.00 . A A . 40 PRO N 1 1 3 1858 1 1 40 PRO O O 8.811 11.640 20.952 1.00 . A A . 40 PRO O 1 1 3 1859 1 1 41 SER C C 11.711 10.092 20.312 1.00 . A A . 41 SER C 1 1 3 1860 1 1 41 SER CA C 10.360 9.397 20.448 1.00 . A A . 41 SER CA 1 1 3 1861 1 1 41 SER CB C 10.513 7.901 20.170 1.00 . A A . 41 SER CB 1 1 3 1862 1 1 41 SER H H 9.233 9.569 18.664 1.00 . A A . 41 SER H 1 1 3 1863 1 1 41 SER HA H 9.998 9.532 21.457 1.00 . A A . 41 SER HA 1 1 3 1864 1 1 41 SER HB2 H 10.370 7.716 19.116 1.00 . A A . 41 SER HB2 1 1 3 1865 1 1 41 SER HB3 H 11.505 7.584 20.460 1.00 . A A . 41 SER HB3 1 1 3 1866 1 1 41 SER HG H 9.944 6.303 21.150 1.00 . A A . 41 SER HG 1 1 3 1867 1 1 41 SER N N 9.381 9.983 19.540 1.00 . A A . 41 SER N 1 1 3 1868 1 1 41 SER O O 12.756 9.443 20.283 1.00 . A A . 41 SER O 1 1 3 1869 1 1 41 SER OG O 9.561 7.146 20.899 1.00 . A A . 41 SER OG 1 1 3 1870 1 1 42 GLY C C 13.137 12.673 18.682 1.00 . A A . 42 GLY C 1 1 3 1871 1 1 42 GLY CA C 12.909 12.182 20.098 1.00 . A A . 42 GLY CA 1 1 3 1872 1 1 42 GLY H H 10.819 11.884 20.259 1.00 . A A . 42 GLY H 1 1 3 1873 1 1 42 GLY HA2 H 12.863 13.034 20.760 1.00 . A A . 42 GLY HA2 1 1 3 1874 1 1 42 GLY HA3 H 13.740 11.557 20.389 1.00 . A A . 42 GLY HA3 1 1 3 1875 1 1 42 GLY N N 11.681 11.419 20.230 1.00 . A A . 42 GLY N 1 1 3 1876 1 1 42 GLY O O 14.070 12.250 17.999 1.00 . A A . 42 GLY O 1 1 3 1877 1 1 43 PRO C C 13.566 15.073 16.710 1.00 . A A . 43 PRO C 1 1 3 1878 1 1 43 PRO CA C 12.360 14.153 16.872 1.00 . A A . 43 PRO CA 1 1 3 1879 1 1 43 PRO CB C 11.059 14.947 16.734 1.00 . A A . 43 PRO CB 1 1 3 1880 1 1 43 PRO CD C 11.134 14.135 18.981 1.00 . A A . 43 PRO CD 1 1 3 1881 1 1 43 PRO CG C 10.672 15.287 18.132 1.00 . A A . 43 PRO CG 1 1 3 1882 1 1 43 PRO HA H 12.395 13.380 16.118 1.00 . A A . 43 PRO HA 1 1 3 1883 1 1 43 PRO HB2 H 11.238 15.836 16.146 1.00 . A A . 43 PRO HB2 1 1 3 1884 1 1 43 PRO HB3 H 10.310 14.336 16.254 1.00 . A A . 43 PRO HB3 1 1 3 1885 1 1 43 PRO HD2 H 11.453 14.486 19.951 1.00 . A A . 43 PRO HD2 1 1 3 1886 1 1 43 PRO HD3 H 10.348 13.401 19.082 1.00 . A A . 43 PRO HD3 1 1 3 1887 1 1 43 PRO HG2 H 11.161 16.198 18.437 1.00 . A A . 43 PRO HG2 1 1 3 1888 1 1 43 PRO HG3 H 9.599 15.394 18.199 1.00 . A A . 43 PRO HG3 1 1 3 1889 1 1 43 PRO N N 12.270 13.586 18.221 1.00 . A A . 43 PRO N 1 1 3 1890 1 1 43 PRO O O 13.863 15.534 15.608 1.00 . A A . 43 PRO O 1 1 3 1891 1 1 44 SER C C 16.695 15.413 18.109 1.00 . A A . 44 SER C 1 1 3 1892 1 1 44 SER CA C 15.429 16.203 17.795 1.00 . A A . 44 SER CA 1 1 3 1893 1 1 44 SER CB C 15.262 17.343 18.802 1.00 . A A . 44 SER CB 1 1 3 1894 1 1 44 SER H H 13.970 14.938 18.664 1.00 . A A . 44 SER H 1 1 3 1895 1 1 44 SER HA H 15.516 16.620 16.803 1.00 . A A . 44 SER HA 1 1 3 1896 1 1 44 SER HB2 H 14.838 16.955 19.715 1.00 . A A . 44 SER HB2 1 1 3 1897 1 1 44 SER HB3 H 16.228 17.780 19.010 1.00 . A A . 44 SER HB3 1 1 3 1898 1 1 44 SER HG H 14.864 18.848 17.611 1.00 . A A . 44 SER HG 1 1 3 1899 1 1 44 SER N N 14.257 15.335 17.815 1.00 . A A . 44 SER N 1 1 3 1900 1 1 44 SER O O 16.633 14.304 18.640 1.00 . A A . 44 SER O 1 1 3 1901 1 1 44 SER OG O 14.406 18.352 18.293 1.00 . A A . 44 SER OG 1 1 3 1902 1 1 45 SER C C 19.131 14.637 19.374 1.00 . A A . 45 SER C 1 1 3 1903 1 1 45 SER CA C 19.127 15.343 18.021 1.00 . A A . 45 SER CA 1 1 3 1904 1 1 45 SER CB C 20.261 16.367 17.965 1.00 . A A . 45 SER CB 1 1 3 1905 1 1 45 SER H H 17.829 16.879 17.358 1.00 . A A . 45 SER H 1 1 3 1906 1 1 45 SER HA H 19.278 14.608 17.245 1.00 . A A . 45 SER HA 1 1 3 1907 1 1 45 SER HB2 H 20.285 16.820 16.985 1.00 . A A . 45 SER HB2 1 1 3 1908 1 1 45 SER HB3 H 20.091 17.131 18.710 1.00 . A A . 45 SER HB3 1 1 3 1909 1 1 45 SER HG H 21.384 14.959 18.735 1.00 . A A . 45 SER HG 1 1 3 1910 1 1 45 SER N N 17.844 15.993 17.778 1.00 . A A . 45 SER N 1 1 3 1911 1 1 45 SER O O 19.151 15.281 20.422 1.00 . A A . 45 SER O 1 1 3 1912 1 1 45 SER OG O 21.514 15.755 18.216 1.00 . A A . 45 SER OG 1 1 3 1913 1 1 46 GLY C C 17.847 12.735 21.382 1.00 . A A . 46 GLY C 1 1 3 1914 1 1 46 GLY CA C 19.112 12.536 20.571 1.00 . A A . 46 GLY CA 1 1 3 1915 1 1 46 GLY H H 19.095 12.848 18.476 1.00 . A A . 46 GLY H 1 1 3 1916 1 1 46 GLY HA2 H 19.208 11.489 20.325 1.00 . A A . 46 GLY HA2 1 1 3 1917 1 1 46 GLY HA3 H 19.960 12.835 21.169 1.00 . A A . 46 GLY HA3 1 1 3 1918 1 1 46 GLY N N 19.111 13.308 19.342 1.00 . A A . 46 GLY N 1 1 3 1919 1 1 46 GLY O O 17.939 12.972 22.585 1.00 . A A . 46 GLY O 1 1 3 1920 2 2 1 ZN ZN ZN -0.531 4.466 -0.411 1.00 . B A . 201 ZN ZN 1 1 4 1921 1 1 1 GLY C C -19.810 4.264 -14.558 1.00 . A A . 1 GLY C 1 1 4 1922 1 1 1 GLY CA C -20.698 4.247 -15.787 1.00 . A A . 1 GLY CA 1 1 4 1923 1 1 1 GLY H1 H -21.008 6.314 -16.127 1.00 . A A . 1 GLY H1 1 1 4 1924 1 1 1 GLY HA2 H -21.379 3.413 -15.715 1.00 . A A . 1 GLY HA2 1 1 4 1925 1 1 1 GLY HA3 H -20.078 4.118 -16.662 1.00 . A A . 1 GLY HA3 1 1 4 1926 1 1 1 GLY N N -21.466 5.469 -15.934 1.00 . A A . 1 GLY N 1 1 4 1927 1 1 1 GLY O O -18.613 3.991 -14.645 1.00 . A A . 1 GLY O 1 1 4 1928 1 1 2 SER C C -20.314 3.778 -11.092 1.00 . A A . 2 SER C 1 1 4 1929 1 1 2 SER CA C -19.652 4.644 -12.159 1.00 . A A . 2 SER CA 1 1 4 1930 1 1 2 SER CB C -19.548 6.090 -11.668 1.00 . A A . 2 SER CB 1 1 4 1931 1 1 2 SER H H -21.356 4.794 -13.406 1.00 . A A . 2 SER H 1 1 4 1932 1 1 2 SER HA H -18.658 4.265 -12.348 1.00 . A A . 2 SER HA 1 1 4 1933 1 1 2 SER HB2 H -19.552 6.757 -12.517 1.00 . A A . 2 SER HB2 1 1 4 1934 1 1 2 SER HB3 H -20.393 6.312 -11.032 1.00 . A A . 2 SER HB3 1 1 4 1935 1 1 2 SER HG H -17.644 5.784 -11.326 1.00 . A A . 2 SER HG 1 1 4 1936 1 1 2 SER N N -20.398 4.587 -13.411 1.00 . A A . 2 SER N 1 1 4 1937 1 1 2 SER O O -21.511 3.500 -11.157 1.00 . A A . 2 SER O 1 1 4 1938 1 1 2 SER OG O -18.355 6.294 -10.932 1.00 . A A . 2 SER OG 1 1 4 1939 1 1 3 SER C C -20.922 1.406 -9.575 1.00 . A A . 3 SER C 1 1 4 1940 1 1 3 SER CA C -20.033 2.518 -9.028 1.00 . A A . 3 SER CA 1 1 4 1941 1 1 3 SER CB C -20.816 3.365 -8.023 1.00 . A A . 3 SER CB 1 1 4 1942 1 1 3 SER H H -18.579 3.612 -10.112 1.00 . A A . 3 SER H 1 1 4 1943 1 1 3 SER HA H -19.186 2.073 -8.528 1.00 . A A . 3 SER HA 1 1 4 1944 1 1 3 SER HB2 H -21.095 2.752 -7.179 1.00 . A A . 3 SER HB2 1 1 4 1945 1 1 3 SER HB3 H -20.196 4.183 -7.685 1.00 . A A . 3 SER HB3 1 1 4 1946 1 1 3 SER HG H -21.812 4.777 -8.946 1.00 . A A . 3 SER HG 1 1 4 1947 1 1 3 SER N N -19.525 3.356 -10.109 1.00 . A A . 3 SER N 1 1 4 1948 1 1 3 SER O O -21.984 1.118 -9.025 1.00 . A A . 3 SER O 1 1 4 1949 1 1 3 SER OG O -21.992 3.896 -8.610 1.00 . A A . 3 SER OG 1 1 4 1950 1 1 4 GLY C C -20.409 -1.530 -11.517 1.00 . A A . 4 GLY C 1 1 4 1951 1 1 4 GLY CA C -21.245 -0.291 -11.267 1.00 . A A . 4 GLY CA 1 1 4 1952 1 1 4 GLY H H -19.624 1.055 -11.058 1.00 . A A . 4 GLY H 1 1 4 1953 1 1 4 GLY HA2 H -22.064 -0.548 -10.611 1.00 . A A . 4 GLY HA2 1 1 4 1954 1 1 4 GLY HA3 H -21.646 0.054 -12.209 1.00 . A A . 4 GLY HA3 1 1 4 1955 1 1 4 GLY N N -20.479 0.783 -10.663 1.00 . A A . 4 GLY N 1 1 4 1956 1 1 4 GLY O O -20.116 -2.287 -10.592 1.00 . A A . 4 GLY O 1 1 4 1957 1 1 5 SER C C -17.912 -2.925 -12.361 1.00 . A A . 5 SER C 1 1 4 1958 1 1 5 SER CA C -19.222 -2.899 -13.142 1.00 . A A . 5 SER CA 1 1 4 1959 1 1 5 SER CB C -18.932 -2.887 -14.645 1.00 . A A . 5 SER CB 1 1 4 1960 1 1 5 SER H H -20.290 -1.100 -13.466 1.00 . A A . 5 SER H 1 1 4 1961 1 1 5 SER HA H -19.789 -3.786 -12.901 1.00 . A A . 5 SER HA 1 1 4 1962 1 1 5 SER HB2 H -18.823 -1.867 -14.979 1.00 . A A . 5 SER HB2 1 1 4 1963 1 1 5 SER HB3 H -18.017 -3.429 -14.836 1.00 . A A . 5 SER HB3 1 1 4 1964 1 1 5 SER HG H -20.000 -4.438 -15.187 1.00 . A A . 5 SER HG 1 1 4 1965 1 1 5 SER N N -20.025 -1.740 -12.772 1.00 . A A . 5 SER N 1 1 4 1966 1 1 5 SER O O -17.611 -2.004 -11.602 1.00 . A A . 5 SER O 1 1 4 1967 1 1 5 SER OG O -19.985 -3.496 -15.372 1.00 . A A . 5 SER OG 1 1 4 1968 1 1 6 SER C C -14.757 -4.528 -12.841 1.00 . A A . 6 SER C 1 1 4 1969 1 1 6 SER CA C -15.861 -4.137 -11.863 1.00 . A A . 6 SER CA 1 1 4 1970 1 1 6 SER CB C -15.974 -5.189 -10.758 1.00 . A A . 6 SER CB 1 1 4 1971 1 1 6 SER H H -17.432 -4.689 -13.170 1.00 . A A . 6 SER H 1 1 4 1972 1 1 6 SER HA H -15.611 -3.186 -11.418 1.00 . A A . 6 SER HA 1 1 4 1973 1 1 6 SER HB2 H -15.147 -5.078 -10.073 1.00 . A A . 6 SER HB2 1 1 4 1974 1 1 6 SER HB3 H -16.904 -5.049 -10.226 1.00 . A A . 6 SER HB3 1 1 4 1975 1 1 6 SER HG H -15.040 -6.755 -11.474 1.00 . A A . 6 SER HG 1 1 4 1976 1 1 6 SER N N -17.137 -3.988 -12.552 1.00 . A A . 6 SER N 1 1 4 1977 1 1 6 SER O O -15.029 -5.005 -13.943 1.00 . A A . 6 SER O 1 1 4 1978 1 1 6 SER OG O -15.949 -6.500 -11.296 1.00 . A A . 6 SER OG 1 1 4 1979 1 1 7 GLY C C -11.060 -4.205 -12.696 1.00 . A A . 7 GLY C 1 1 4 1980 1 1 7 GLY CA C -12.383 -4.659 -13.281 1.00 . A A . 7 GLY CA 1 1 4 1981 1 1 7 GLY H H -13.353 -3.940 -11.541 1.00 . A A . 7 GLY H 1 1 4 1982 1 1 7 GLY HA2 H -12.356 -5.729 -13.418 1.00 . A A . 7 GLY HA2 1 1 4 1983 1 1 7 GLY HA3 H -12.520 -4.186 -14.242 1.00 . A A . 7 GLY HA3 1 1 4 1984 1 1 7 GLY N N -13.510 -4.323 -12.430 1.00 . A A . 7 GLY N 1 1 4 1985 1 1 7 GLY O O -10.216 -5.027 -12.337 1.00 . A A . 7 GLY O 1 1 4 1986 1 1 8 THR C C -9.223 -3.054 -10.788 1.00 . A A . 8 THR C 1 1 4 1987 1 1 8 THR CA C -9.645 -2.330 -12.061 1.00 . A A . 8 THR CA 1 1 4 1988 1 1 8 THR CB C -9.799 -0.828 -11.756 1.00 . A A . 8 THR CB 1 1 4 1989 1 1 8 THR CG2 C -11.080 -0.562 -10.979 1.00 . A A . 8 THR CG2 1 1 4 1990 1 1 8 THR H H -11.585 -2.288 -12.906 1.00 . A A . 8 THR H 1 1 4 1991 1 1 8 THR HA H -8.869 -2.447 -12.804 1.00 . A A . 8 THR HA 1 1 4 1992 1 1 8 THR HB H -9.846 -0.289 -12.692 1.00 . A A . 8 THR HB 1 1 4 1993 1 1 8 THR HG1 H -8.355 0.462 -11.382 1.00 . A A . 8 THR HG1 1 1 4 1994 1 1 8 THR HG21 H -11.921 -0.576 -11.655 1.00 . A A . 8 THR HG21 1 1 4 1995 1 1 8 THR HG22 H -11.017 0.404 -10.501 1.00 . A A . 8 THR HG22 1 1 4 1996 1 1 8 THR HG23 H -11.209 -1.327 -10.227 1.00 . A A . 8 THR HG23 1 1 4 1997 1 1 8 THR N N -10.875 -2.892 -12.603 1.00 . A A . 8 THR N 1 1 4 1998 1 1 8 THR O O -10.001 -3.172 -9.842 1.00 . A A . 8 THR O 1 1 4 1999 1 1 8 THR OG1 O -8.673 -0.362 -11.004 1.00 . A A . 8 THR OG1 1 1 4 2000 1 1 9 GLY C C -7.057 -5.664 -9.930 1.00 . A A . 9 GLY C 1 1 4 2001 1 1 9 GLY CA C -7.481 -4.245 -9.607 1.00 . A A . 9 GLY CA 1 1 4 2002 1 1 9 GLY H H -7.408 -3.414 -11.554 1.00 . A A . 9 GLY H 1 1 4 2003 1 1 9 GLY HA2 H -6.631 -3.707 -9.213 1.00 . A A . 9 GLY HA2 1 1 4 2004 1 1 9 GLY HA3 H -8.256 -4.275 -8.855 1.00 . A A . 9 GLY HA3 1 1 4 2005 1 1 9 GLY N N -7.984 -3.538 -10.770 1.00 . A A . 9 GLY N 1 1 4 2006 1 1 9 GLY O O -7.875 -6.583 -9.903 1.00 . A A . 9 GLY O 1 1 4 2007 1 1 10 GLU C C -4.474 -7.748 -9.391 1.00 . A A . 10 GLU C 1 1 4 2008 1 1 10 GLU CA C -5.247 -7.160 -10.568 1.00 . A A . 10 GLU CA 1 1 4 2009 1 1 10 GLU CB C -4.339 -7.075 -11.797 1.00 . A A . 10 GLU CB 1 1 4 2010 1 1 10 GLU CD C -6.284 -7.272 -13.397 1.00 . A A . 10 GLU CD 1 1 4 2011 1 1 10 GLU CG C -5.029 -6.506 -13.025 1.00 . A A . 10 GLU CG 1 1 4 2012 1 1 10 GLU H H -5.173 -5.070 -10.240 1.00 . A A . 10 GLU H 1 1 4 2013 1 1 10 GLU HA H -6.082 -7.806 -10.793 1.00 . A A . 10 GLU HA 1 1 4 2014 1 1 10 GLU HB2 H -3.492 -6.448 -11.561 1.00 . A A . 10 GLU HB2 1 1 4 2015 1 1 10 GLU HB3 H -3.985 -8.067 -12.036 1.00 . A A . 10 GLU HB3 1 1 4 2016 1 1 10 GLU HG2 H -5.299 -5.479 -12.827 1.00 . A A . 10 GLU HG2 1 1 4 2017 1 1 10 GLU HG3 H -4.342 -6.542 -13.857 1.00 . A A . 10 GLU HG3 1 1 4 2018 1 1 10 GLU N N -5.776 -5.843 -10.236 1.00 . A A . 10 GLU N 1 1 4 2019 1 1 10 GLU O O -4.521 -8.953 -9.141 1.00 . A A . 10 GLU O 1 1 4 2020 1 1 10 GLU OE1 O -7.329 -7.049 -12.752 1.00 . A A . 10 GLU OE1 1 1 4 2021 1 1 10 GLU OE2 O -6.219 -8.095 -14.334 1.00 . A A . 10 GLU OE2 1 1 4 2022 1 1 11 LYS C C -3.873 -7.540 -6.303 1.00 . A A . 11 LYS C 1 1 4 2023 1 1 11 LYS CA C -2.978 -7.320 -7.518 1.00 . A A . 11 LYS CA 1 1 4 2024 1 1 11 LYS CB C -1.901 -6.283 -7.191 1.00 . A A . 11 LYS CB 1 1 4 2025 1 1 11 LYS CD C -0.728 -6.341 -9.411 1.00 . A A . 11 LYS CD 1 1 4 2026 1 1 11 LYS CE C -0.680 -4.871 -9.800 1.00 . A A . 11 LYS CE 1 1 4 2027 1 1 11 LYS CG C -0.585 -6.525 -7.910 1.00 . A A . 11 LYS CG 1 1 4 2028 1 1 11 LYS H H -3.763 -5.940 -8.919 1.00 . A A . 11 LYS H 1 1 4 2029 1 1 11 LYS HA H -2.500 -8.254 -7.773 1.00 . A A . 11 LYS HA 1 1 4 2030 1 1 11 LYS HB2 H -2.264 -5.304 -7.468 1.00 . A A . 11 LYS HB2 1 1 4 2031 1 1 11 LYS HB3 H -1.714 -6.300 -6.127 1.00 . A A . 11 LYS HB3 1 1 4 2032 1 1 11 LYS HD2 H 0.079 -6.859 -9.908 1.00 . A A . 11 LYS HD2 1 1 4 2033 1 1 11 LYS HD3 H -1.674 -6.757 -9.728 1.00 . A A . 11 LYS HD3 1 1 4 2034 1 1 11 LYS HE2 H -1.677 -4.463 -9.737 1.00 . A A . 11 LYS HE2 1 1 4 2035 1 1 11 LYS HE3 H -0.033 -4.351 -9.110 1.00 . A A . 11 LYS HE3 1 1 4 2036 1 1 11 LYS HG2 H 0.150 -5.825 -7.541 1.00 . A A . 11 LYS HG2 1 1 4 2037 1 1 11 LYS HG3 H -0.256 -7.534 -7.709 1.00 . A A . 11 LYS HG3 1 1 4 2038 1 1 11 LYS HZ1 H 0.757 -5.149 -11.291 1.00 . A A . 11 LYS HZ1 1 1 4 2039 1 1 11 LYS HZ2 H -0.052 -3.666 -11.387 1.00 . A A . 11 LYS HZ2 1 1 4 2040 1 1 11 LYS HZ3 H -0.831 -5.087 -11.873 1.00 . A A . 11 LYS HZ3 1 1 4 2041 1 1 11 LYS N N -3.761 -6.889 -8.670 1.00 . A A . 11 LYS N 1 1 4 2042 1 1 11 LYS NZ N -0.165 -4.681 -11.185 1.00 . A A . 11 LYS NZ 1 1 4 2043 1 1 11 LYS O O -4.847 -6.822 -6.082 1.00 . A A . 11 LYS O 1 1 4 2044 1 1 12 PRO C C -4.139 -7.842 -3.193 1.00 . A A . 12 PRO C 1 1 4 2045 1 1 12 PRO CA C -4.295 -8.893 -4.287 1.00 . A A . 12 PRO CA 1 1 4 2046 1 1 12 PRO CB C -3.682 -10.223 -3.842 1.00 . A A . 12 PRO CB 1 1 4 2047 1 1 12 PRO CD C -2.386 -9.454 -5.698 1.00 . A A . 12 PRO CD 1 1 4 2048 1 1 12 PRO CG C -2.301 -10.210 -4.401 1.00 . A A . 12 PRO CG 1 1 4 2049 1 1 12 PRO HA H -5.344 -9.033 -4.504 1.00 . A A . 12 PRO HA 1 1 4 2050 1 1 12 PRO HB2 H -3.672 -10.275 -2.763 1.00 . A A . 12 PRO HB2 1 1 4 2051 1 1 12 PRO HB3 H -4.261 -11.042 -4.242 1.00 . A A . 12 PRO HB3 1 1 4 2052 1 1 12 PRO HD2 H -1.481 -8.890 -5.866 1.00 . A A . 12 PRO HD2 1 1 4 2053 1 1 12 PRO HD3 H -2.568 -10.133 -6.518 1.00 . A A . 12 PRO HD3 1 1 4 2054 1 1 12 PRO HG2 H -1.634 -9.707 -3.717 1.00 . A A . 12 PRO HG2 1 1 4 2055 1 1 12 PRO HG3 H -1.967 -11.221 -4.578 1.00 . A A . 12 PRO HG3 1 1 4 2056 1 1 12 PRO N N -3.535 -8.556 -5.495 1.00 . A A . 12 PRO N 1 1 4 2057 1 1 12 PRO O O -5.085 -7.550 -2.461 1.00 . A A . 12 PRO O 1 1 4 2058 1 1 13 TYR C C -2.908 -4.861 -2.638 1.00 . A A . 13 TYR C 1 1 4 2059 1 1 13 TYR CA C -2.663 -6.260 -2.081 1.00 . A A . 13 TYR CA 1 1 4 2060 1 1 13 TYR CB C -1.218 -6.380 -1.592 1.00 . A A . 13 TYR CB 1 1 4 2061 1 1 13 TYR CD1 C -1.020 -8.213 0.134 1.00 . A A . 13 TYR CD1 1 1 4 2062 1 1 13 TYR CD2 C -0.287 -8.675 -2.087 1.00 . A A . 13 TYR CD2 1 1 4 2063 1 1 13 TYR CE1 C -0.670 -9.493 0.520 1.00 . A A . 13 TYR CE1 1 1 4 2064 1 1 13 TYR CE2 C 0.064 -9.956 -1.710 1.00 . A A . 13 TYR CE2 1 1 4 2065 1 1 13 TYR CG C -0.835 -7.782 -1.174 1.00 . A A . 13 TYR CG 1 1 4 2066 1 1 13 TYR CZ C -0.129 -10.361 -0.405 1.00 . A A . 13 TYR CZ 1 1 4 2067 1 1 13 TYR H H -2.228 -7.552 -3.700 1.00 . A A . 13 TYR H 1 1 4 2068 1 1 13 TYR HA H -3.329 -6.426 -1.248 1.00 . A A . 13 TYR HA 1 1 4 2069 1 1 13 TYR HB2 H -0.551 -6.076 -2.383 1.00 . A A . 13 TYR HB2 1 1 4 2070 1 1 13 TYR HB3 H -1.079 -5.730 -0.740 1.00 . A A . 13 TYR HB3 1 1 4 2071 1 1 13 TYR HD1 H -1.444 -7.531 0.856 1.00 . A A . 13 TYR HD1 1 1 4 2072 1 1 13 TYR HD2 H -0.136 -8.354 -3.108 1.00 . A A . 13 TYR HD2 1 1 4 2073 1 1 13 TYR HE1 H -0.822 -9.810 1.541 1.00 . A A . 13 TYR HE1 1 1 4 2074 1 1 13 TYR HE2 H 0.489 -10.636 -2.434 1.00 . A A . 13 TYR HE2 1 1 4 2075 1 1 13 TYR HH H 0.119 -11.726 0.925 1.00 . A A . 13 TYR HH 1 1 4 2076 1 1 13 TYR N N -2.942 -7.278 -3.088 1.00 . A A . 13 TYR N 1 1 4 2077 1 1 13 TYR O O -2.555 -4.564 -3.779 1.00 . A A . 13 TYR O 1 1 4 2078 1 1 13 TYR OH O 0.221 -11.636 -0.026 1.00 . A A . 13 TYR OH 1 1 4 2079 1 1 14 ARG C C -3.672 -1.676 -1.055 1.00 . A A . 14 ARG C 1 1 4 2080 1 1 14 ARG CA C -3.810 -2.638 -2.232 1.00 . A A . 14 ARG CA 1 1 4 2081 1 1 14 ARG CB C -5.223 -2.549 -2.813 1.00 . A A . 14 ARG CB 1 1 4 2082 1 1 14 ARG CD C -6.335 -0.444 -2.007 1.00 . A A . 14 ARG CD 1 1 4 2083 1 1 14 ARG CG C -5.646 -1.135 -3.173 1.00 . A A . 14 ARG CG 1 1 4 2084 1 1 14 ARG CZ C -8.685 -1.083 -2.346 1.00 . A A . 14 ARG CZ 1 1 4 2085 1 1 14 ARG H H -3.774 -4.302 -0.924 1.00 . A A . 14 ARG H 1 1 4 2086 1 1 14 ARG HA H -3.099 -2.359 -2.995 1.00 . A A . 14 ARG HA 1 1 4 2087 1 1 14 ARG HB2 H -5.271 -3.155 -3.706 1.00 . A A . 14 ARG HB2 1 1 4 2088 1 1 14 ARG HB3 H -5.922 -2.937 -2.087 1.00 . A A . 14 ARG HB3 1 1 4 2089 1 1 14 ARG HD2 H -5.663 -0.437 -1.162 1.00 . A A . 14 ARG HD2 1 1 4 2090 1 1 14 ARG HD3 H -6.565 0.571 -2.292 1.00 . A A . 14 ARG HD3 1 1 4 2091 1 1 14 ARG HE H -7.569 -1.629 -0.785 1.00 . A A . 14 ARG HE 1 1 4 2092 1 1 14 ARG HG2 H -4.769 -0.566 -3.447 1.00 . A A . 14 ARG HG2 1 1 4 2093 1 1 14 ARG HG3 H -6.327 -1.175 -4.010 1.00 . A A . 14 ARG HG3 1 1 4 2094 1 1 14 ARG HH11 H -7.901 0.080 -3.800 1.00 . A A . 14 ARG HH11 1 1 4 2095 1 1 14 ARG HH12 H -9.556 -0.378 -4.028 1.00 . A A . 14 ARG HH12 1 1 4 2096 1 1 14 ARG HH21 H -9.749 -2.237 -1.073 1.00 . A A . 14 ARG HH21 1 1 4 2097 1 1 14 ARG HH22 H -10.607 -1.695 -2.475 1.00 . A A . 14 ARG HH22 1 1 4 2098 1 1 14 ARG N N -3.516 -4.006 -1.822 1.00 . A A . 14 ARG N 1 1 4 2099 1 1 14 ARG NE N -7.571 -1.121 -1.623 1.00 . A A . 14 ARG NE 1 1 4 2100 1 1 14 ARG NH1 N -8.717 -0.404 -3.485 1.00 . A A . 14 ARG NH1 1 1 4 2101 1 1 14 ARG NH2 N -9.769 -1.724 -1.931 1.00 . A A . 14 ARG NH2 1 1 4 2102 1 1 14 ARG O O -4.010 -2.014 0.080 1.00 . A A . 14 ARG O 1 1 4 2103 1 1 15 CYS C C -4.320 1.169 0.085 1.00 . A A . 15 CYS C 1 1 4 2104 1 1 15 CYS CA C -2.986 0.534 -0.299 1.00 . A A . 15 CYS CA 1 1 4 2105 1 1 15 CYS CB C -2.014 1.613 -0.780 1.00 . A A . 15 CYS CB 1 1 4 2106 1 1 15 CYS H H -2.920 -0.266 -2.258 1.00 . A A . 15 CYS H 1 1 4 2107 1 1 15 CYS HA H -2.570 0.047 0.570 1.00 . A A . 15 CYS HA 1 1 4 2108 1 1 15 CYS HB2 H -1.192 1.140 -1.298 1.00 . A A . 15 CYS HB2 1 1 4 2109 1 1 15 CYS HB3 H -2.529 2.274 -1.460 1.00 . A A . 15 CYS HB3 1 1 4 2110 1 1 15 CYS N N -3.172 -0.477 -1.333 1.00 . A A . 15 CYS N 1 1 4 2111 1 1 15 CYS O O -5.037 1.693 -0.767 1.00 . A A . 15 CYS O 1 1 4 2112 1 1 15 CYS SG S -1.312 2.630 0.559 1.00 . A A . 15 CYS SG 1 1 4 2113 1 1 16 ALA C C -5.716 3.170 2.206 1.00 . A A . 16 ALA C 1 1 4 2114 1 1 16 ALA CA C -5.888 1.693 1.870 1.00 . A A . 16 ALA CA 1 1 4 2115 1 1 16 ALA CB C -6.371 0.924 3.091 1.00 . A A . 16 ALA CB 1 1 4 2116 1 1 16 ALA H H -4.029 0.689 2.004 1.00 . A A . 16 ALA H 1 1 4 2117 1 1 16 ALA HA H -6.634 1.594 1.095 1.00 . A A . 16 ALA HA 1 1 4 2118 1 1 16 ALA HB1 H -6.134 -0.122 2.975 1.00 . A A . 16 ALA HB1 1 1 4 2119 1 1 16 ALA HB2 H -5.882 1.309 3.974 1.00 . A A . 16 ALA HB2 1 1 4 2120 1 1 16 ALA HB3 H -7.440 1.043 3.191 1.00 . A A . 16 ALA HB3 1 1 4 2121 1 1 16 ALA N N -4.643 1.120 1.373 1.00 . A A . 16 ALA N 1 1 4 2122 1 1 16 ALA O O -6.495 3.735 2.974 1.00 . A A . 16 ALA O 1 1 4 2123 1 1 17 GLU C C -4.517 6.003 0.574 1.00 . A A . 17 GLU C 1 1 4 2124 1 1 17 GLU CA C -4.419 5.201 1.868 1.00 . A A . 17 GLU CA 1 1 4 2125 1 1 17 GLU CB C -3.030 5.377 2.486 1.00 . A A . 17 GLU CB 1 1 4 2126 1 1 17 GLU CD C -3.445 5.875 4.928 1.00 . A A . 17 GLU CD 1 1 4 2127 1 1 17 GLU CG C -2.931 4.870 3.915 1.00 . A A . 17 GLU CG 1 1 4 2128 1 1 17 GLU H H -4.106 3.285 1.026 1.00 . A A . 17 GLU H 1 1 4 2129 1 1 17 GLU HA H -5.160 5.569 2.562 1.00 . A A . 17 GLU HA 1 1 4 2130 1 1 17 GLU HB2 H -2.311 4.841 1.885 1.00 . A A . 17 GLU HB2 1 1 4 2131 1 1 17 GLU HB3 H -2.778 6.427 2.481 1.00 . A A . 17 GLU HB3 1 1 4 2132 1 1 17 GLU HG2 H -3.512 3.964 4.003 1.00 . A A . 17 GLU HG2 1 1 4 2133 1 1 17 GLU HG3 H -1.896 4.655 4.136 1.00 . A A . 17 GLU HG3 1 1 4 2134 1 1 17 GLU N N -4.692 3.789 1.628 1.00 . A A . 17 GLU N 1 1 4 2135 1 1 17 GLU O O -5.184 7.036 0.518 1.00 . A A . 17 GLU O 1 1 4 2136 1 1 17 GLU OE1 O -4.680 6.001 5.063 1.00 . A A . 17 GLU OE1 1 1 4 2137 1 1 17 GLU OE2 O -2.613 6.535 5.585 1.00 . A A . 17 GLU OE2 1 1 4 2138 1 1 18 CYS C C -4.681 5.403 -2.775 1.00 . A A . 18 CYS C 1 1 4 2139 1 1 18 CYS CA C -3.855 6.189 -1.761 1.00 . A A . 18 CYS CA 1 1 4 2140 1 1 18 CYS CB C -2.426 6.365 -2.278 1.00 . A A . 18 CYS CB 1 1 4 2141 1 1 18 CYS H H -3.331 4.691 -0.361 1.00 . A A . 18 CYS H 1 1 4 2142 1 1 18 CYS HA H -4.302 7.163 -1.628 1.00 . A A . 18 CYS HA 1 1 4 2143 1 1 18 CYS HB2 H -2.461 6.740 -3.291 1.00 . A A . 18 CYS HB2 1 1 4 2144 1 1 18 CYS HB3 H -1.910 7.078 -1.653 1.00 . A A . 18 CYS HB3 1 1 4 2145 1 1 18 CYS N N -3.846 5.519 -0.467 1.00 . A A . 18 CYS N 1 1 4 2146 1 1 18 CYS O O -5.555 5.955 -3.442 1.00 . A A . 18 CYS O 1 1 4 2147 1 1 18 CYS SG S -1.446 4.829 -2.292 1.00 . A A . 18 CYS SG 1 1 4 2148 1 1 19 GLY C C -4.215 2.634 -4.854 1.00 . A A . 19 GLY C 1 1 4 2149 1 1 19 GLY CA C -5.123 3.267 -3.818 1.00 . A A . 19 GLY CA 1 1 4 2150 1 1 19 GLY H H -3.691 3.722 -2.327 1.00 . A A . 19 GLY H 1 1 4 2151 1 1 19 GLY HA2 H -5.623 2.484 -3.267 1.00 . A A . 19 GLY HA2 1 1 4 2152 1 1 19 GLY HA3 H -5.865 3.867 -4.325 1.00 . A A . 19 GLY HA3 1 1 4 2153 1 1 19 GLY N N -4.398 4.108 -2.884 1.00 . A A . 19 GLY N 1 1 4 2154 1 1 19 GLY O O -4.543 2.602 -6.041 1.00 . A A . 19 GLY O 1 1 4 2155 1 1 20 LYS C C -2.154 -0.021 -5.160 1.00 . A A . 20 LYS C 1 1 4 2156 1 1 20 LYS CA C -2.110 1.497 -5.303 1.00 . A A . 20 LYS CA 1 1 4 2157 1 1 20 LYS CB C -0.697 2.007 -5.014 1.00 . A A . 20 LYS CB 1 1 4 2158 1 1 20 LYS CD C 1.650 2.349 -5.840 1.00 . A A . 20 LYS CD 1 1 4 2159 1 1 20 LYS CE C 2.669 1.903 -6.878 1.00 . A A . 20 LYS CE 1 1 4 2160 1 1 20 LYS CG C 0.251 1.875 -6.194 1.00 . A A . 20 LYS CG 1 1 4 2161 1 1 20 LYS H H -2.865 2.188 -3.450 1.00 . A A . 20 LYS H 1 1 4 2162 1 1 20 LYS HA H -2.378 1.759 -6.315 1.00 . A A . 20 LYS HA 1 1 4 2163 1 1 20 LYS HB2 H -0.753 3.050 -4.738 1.00 . A A . 20 LYS HB2 1 1 4 2164 1 1 20 LYS HB3 H -0.287 1.446 -4.186 1.00 . A A . 20 LYS HB3 1 1 4 2165 1 1 20 LYS HD2 H 1.654 3.428 -5.790 1.00 . A A . 20 LYS HD2 1 1 4 2166 1 1 20 LYS HD3 H 1.927 1.941 -4.878 1.00 . A A . 20 LYS HD3 1 1 4 2167 1 1 20 LYS HE2 H 2.355 0.954 -7.286 1.00 . A A . 20 LYS HE2 1 1 4 2168 1 1 20 LYS HE3 H 2.705 2.639 -7.667 1.00 . A A . 20 LYS HE3 1 1 4 2169 1 1 20 LYS HG2 H 0.298 0.839 -6.492 1.00 . A A . 20 LYS HG2 1 1 4 2170 1 1 20 LYS HG3 H -0.125 2.471 -7.014 1.00 . A A . 20 LYS HG3 1 1 4 2171 1 1 20 LYS HZ1 H 4.749 1.804 -7.040 1.00 . A A . 20 LYS HZ1 1 1 4 2172 1 1 20 LYS HZ2 H 4.110 0.834 -5.810 1.00 . A A . 20 LYS HZ2 1 1 4 2173 1 1 20 LYS HZ3 H 4.206 2.509 -5.602 1.00 . A A . 20 LYS HZ3 1 1 4 2174 1 1 20 LYS N N -3.070 2.131 -4.407 1.00 . A A . 20 LYS N 1 1 4 2175 1 1 20 LYS NZ N 4.029 1.752 -6.292 1.00 . A A . 20 LYS NZ 1 1 4 2176 1 1 20 LYS O O -2.646 -0.546 -4.162 1.00 . A A . 20 LYS O 1 1 4 2177 1 1 21 ALA C C -0.215 -2.701 -5.828 1.00 . A A . 21 ALA C 1 1 4 2178 1 1 21 ALA CA C -1.611 -2.178 -6.148 1.00 . A A . 21 ALA CA 1 1 4 2179 1 1 21 ALA CB C -2.090 -2.728 -7.483 1.00 . A A . 21 ALA CB 1 1 4 2180 1 1 21 ALA H H -1.257 -0.245 -6.933 1.00 . A A . 21 ALA H 1 1 4 2181 1 1 21 ALA HA H -2.295 -2.514 -5.382 1.00 . A A . 21 ALA HA 1 1 4 2182 1 1 21 ALA HB1 H -2.941 -3.372 -7.322 1.00 . A A . 21 ALA HB1 1 1 4 2183 1 1 21 ALA HB2 H -2.374 -1.909 -8.128 1.00 . A A . 21 ALA HB2 1 1 4 2184 1 1 21 ALA HB3 H -1.293 -3.291 -7.946 1.00 . A A . 21 ALA HB3 1 1 4 2185 1 1 21 ALA N N -1.634 -0.720 -6.164 1.00 . A A . 21 ALA N 1 1 4 2186 1 1 21 ALA O O 0.785 -2.031 -6.089 1.00 . A A . 21 ALA O 1 1 4 2187 1 1 22 PHE C C 1.058 -6.030 -5.055 1.00 . A A . 22 PHE C 1 1 4 2188 1 1 22 PHE CA C 1.121 -4.513 -4.903 1.00 . A A . 22 PHE CA 1 1 4 2189 1 1 22 PHE CB C 1.501 -4.148 -3.466 1.00 . A A . 22 PHE CB 1 1 4 2190 1 1 22 PHE CD1 C 0.660 -1.827 -3.017 1.00 . A A . 22 PHE CD1 1 1 4 2191 1 1 22 PHE CD2 C 3.005 -2.146 -3.309 1.00 . A A . 22 PHE CD2 1 1 4 2192 1 1 22 PHE CE1 C 0.865 -0.474 -2.828 1.00 . A A . 22 PHE CE1 1 1 4 2193 1 1 22 PHE CE2 C 3.216 -0.793 -3.121 1.00 . A A . 22 PHE CE2 1 1 4 2194 1 1 22 PHE CG C 1.727 -2.678 -3.260 1.00 . A A . 22 PHE CG 1 1 4 2195 1 1 22 PHE CZ C 2.144 0.044 -2.879 1.00 . A A . 22 PHE CZ 1 1 4 2196 1 1 22 PHE H H -0.985 -4.386 -5.076 1.00 . A A . 22 PHE H 1 1 4 2197 1 1 22 PHE HA H 1.873 -4.127 -5.574 1.00 . A A . 22 PHE HA 1 1 4 2198 1 1 22 PHE HB2 H 0.709 -4.458 -2.802 1.00 . A A . 22 PHE HB2 1 1 4 2199 1 1 22 PHE HB3 H 2.411 -4.665 -3.200 1.00 . A A . 22 PHE HB3 1 1 4 2200 1 1 22 PHE HD1 H -0.341 -2.231 -2.976 1.00 . A A . 22 PHE HD1 1 1 4 2201 1 1 22 PHE HD2 H 3.845 -2.800 -3.498 1.00 . A A . 22 PHE HD2 1 1 4 2202 1 1 22 PHE HE1 H 0.025 0.179 -2.639 1.00 . A A . 22 PHE HE1 1 1 4 2203 1 1 22 PHE HE2 H 4.218 -0.391 -3.161 1.00 . A A . 22 PHE HE2 1 1 4 2204 1 1 22 PHE HZ H 2.306 1.102 -2.732 1.00 . A A . 22 PHE HZ 1 1 4 2205 1 1 22 PHE N N -0.153 -3.900 -5.260 1.00 . A A . 22 PHE N 1 1 4 2206 1 1 22 PHE O O 0.024 -6.649 -4.797 1.00 . A A . 22 PHE O 1 1 4 2207 1 1 23 THR C C 2.301 -8.794 -4.325 1.00 . A A . 23 THR C 1 1 4 2208 1 1 23 THR CA C 2.242 -8.067 -5.664 1.00 . A A . 23 THR CA 1 1 4 2209 1 1 23 THR CB C 3.469 -8.464 -6.505 1.00 . A A . 23 THR CB 1 1 4 2210 1 1 23 THR CG2 C 3.413 -7.819 -7.882 1.00 . A A . 23 THR CG2 1 1 4 2211 1 1 23 THR H H 2.961 -6.076 -5.664 1.00 . A A . 23 THR H 1 1 4 2212 1 1 23 THR HA H 1.353 -8.379 -6.193 1.00 . A A . 23 THR HA 1 1 4 2213 1 1 23 THR HB H 3.472 -9.538 -6.626 1.00 . A A . 23 THR HB 1 1 4 2214 1 1 23 THR HG1 H 5.421 -8.522 -6.226 1.00 . A A . 23 THR HG1 1 1 4 2215 1 1 23 THR HG21 H 2.490 -7.268 -7.983 1.00 . A A . 23 THR HG21 1 1 4 2216 1 1 23 THR HG22 H 3.458 -8.586 -8.641 1.00 . A A . 23 THR HG22 1 1 4 2217 1 1 23 THR HG23 H 4.249 -7.147 -7.999 1.00 . A A . 23 THR HG23 1 1 4 2218 1 1 23 THR N N 2.170 -6.624 -5.475 1.00 . A A . 23 THR N 1 1 4 2219 1 1 23 THR O O 1.626 -9.804 -4.126 1.00 . A A . 23 THR O 1 1 4 2220 1 1 23 THR OG1 O 4.671 -8.066 -5.836 1.00 . A A . 23 THR OG1 1 1 4 2221 1 1 24 ASP C C 2.979 -7.848 -0.994 1.00 . A A . 24 ASP C 1 1 4 2222 1 1 24 ASP CA C 3.257 -8.873 -2.089 1.00 . A A . 24 ASP CA 1 1 4 2223 1 1 24 ASP CB C 4.664 -9.449 -1.919 1.00 . A A . 24 ASP CB 1 1 4 2224 1 1 24 ASP CG C 4.692 -10.643 -0.985 1.00 . A A . 24 ASP CG 1 1 4 2225 1 1 24 ASP H H 3.623 -7.467 -3.629 1.00 . A A . 24 ASP H 1 1 4 2226 1 1 24 ASP HA H 2.538 -9.673 -2.006 1.00 . A A . 24 ASP HA 1 1 4 2227 1 1 24 ASP HB2 H 5.036 -9.762 -2.884 1.00 . A A . 24 ASP HB2 1 1 4 2228 1 1 24 ASP HB3 H 5.313 -8.685 -1.518 1.00 . A A . 24 ASP HB3 1 1 4 2229 1 1 24 ASP N N 3.111 -8.274 -3.410 1.00 . A A . 24 ASP N 1 1 4 2230 1 1 24 ASP O O 3.131 -6.644 -1.203 1.00 . A A . 24 ASP O 1 1 4 2231 1 1 24 ASP OD1 O 4.269 -10.495 0.181 1.00 . A A . 24 ASP OD1 1 1 4 2232 1 1 24 ASP OD2 O 5.135 -11.726 -1.420 1.00 . A A . 24 ASP OD2 1 1 4 2233 1 1 25 ARG C C 3.508 -6.684 1.735 1.00 . A A . 25 ARG C 1 1 4 2234 1 1 25 ARG CA C 2.268 -7.459 1.301 1.00 . A A . 25 ARG CA 1 1 4 2235 1 1 25 ARG CB C 1.727 -8.276 2.476 1.00 . A A . 25 ARG CB 1 1 4 2236 1 1 25 ARG CD C 2.067 -10.200 4.057 1.00 . A A . 25 ARG CD 1 1 4 2237 1 1 25 ARG CG C 2.553 -9.512 2.791 1.00 . A A . 25 ARG CG 1 1 4 2238 1 1 25 ARG CZ C 2.675 -12.573 3.852 1.00 . A A . 25 ARG CZ 1 1 4 2239 1 1 25 ARG H H 2.468 -9.302 0.280 1.00 . A A . 25 ARG H 1 1 4 2240 1 1 25 ARG HA H 1.512 -6.757 0.983 1.00 . A A . 25 ARG HA 1 1 4 2241 1 1 25 ARG HB2 H 1.708 -7.649 3.356 1.00 . A A . 25 ARG HB2 1 1 4 2242 1 1 25 ARG HB3 H 0.720 -8.591 2.247 1.00 . A A . 25 ARG HB3 1 1 4 2243 1 1 25 ARG HD2 H 2.120 -9.497 4.875 1.00 . A A . 25 ARG HD2 1 1 4 2244 1 1 25 ARG HD3 H 1.042 -10.507 3.913 1.00 . A A . 25 ARG HD3 1 1 4 2245 1 1 25 ARG HE H 3.595 -11.259 5.038 1.00 . A A . 25 ARG HE 1 1 4 2246 1 1 25 ARG HG2 H 2.475 -10.205 1.966 1.00 . A A . 25 ARG HG2 1 1 4 2247 1 1 25 ARG HG3 H 3.584 -9.221 2.922 1.00 . A A . 25 ARG HG3 1 1 4 2248 1 1 25 ARG HH11 H 1.121 -11.991 2.700 1.00 . A A . 25 ARG HH11 1 1 4 2249 1 1 25 ARG HH12 H 1.560 -13.662 2.565 1.00 . A A . 25 ARG HH12 1 1 4 2250 1 1 25 ARG HH21 H 4.182 -13.456 4.869 1.00 . A A . 25 ARG HH21 1 1 4 2251 1 1 25 ARG HH22 H 3.301 -14.494 3.800 1.00 . A A . 25 ARG HH22 1 1 4 2252 1 1 25 ARG N N 2.570 -8.333 0.174 1.00 . A A . 25 ARG N 1 1 4 2253 1 1 25 ARG NE N 2.872 -11.373 4.386 1.00 . A A . 25 ARG NE 1 1 4 2254 1 1 25 ARG NH1 N 1.705 -12.757 2.967 1.00 . A A . 25 ARG NH1 1 1 4 2255 1 1 25 ARG NH2 N 3.450 -13.592 4.202 1.00 . A A . 25 ARG NH2 1 1 4 2256 1 1 25 ARG O O 3.415 -5.532 2.160 1.00 . A A . 25 ARG O 1 1 4 2257 1 1 26 SER C C 6.142 -5.394 1.243 1.00 . A A . 26 SER C 1 1 4 2258 1 1 26 SER CA C 5.927 -6.695 2.010 1.00 . A A . 26 SER CA 1 1 4 2259 1 1 26 SER CB C 7.096 -7.649 1.757 1.00 . A A . 26 SER CB 1 1 4 2260 1 1 26 SER H H 4.678 -8.240 1.279 1.00 . A A . 26 SER H 1 1 4 2261 1 1 26 SER HA H 5.877 -6.473 3.066 1.00 . A A . 26 SER HA 1 1 4 2262 1 1 26 SER HB2 H 7.036 -8.478 2.445 1.00 . A A . 26 SER HB2 1 1 4 2263 1 1 26 SER HB3 H 7.043 -8.017 0.742 1.00 . A A . 26 SER HB3 1 1 4 2264 1 1 26 SER HG H 9.009 -7.420 1.401 1.00 . A A . 26 SER HG 1 1 4 2265 1 1 26 SER N N 4.668 -7.323 1.625 1.00 . A A . 26 SER N 1 1 4 2266 1 1 26 SER O O 6.423 -4.352 1.833 1.00 . A A . 26 SER O 1 1 4 2267 1 1 26 SER OG O 8.338 -6.993 1.940 1.00 . A A . 26 SER OG 1 1 4 2268 1 1 27 ASN C C 5.218 -3.181 -0.534 1.00 . A A . 27 ASN C 1 1 4 2269 1 1 27 ASN CA C 6.187 -4.292 -0.927 1.00 . A A . 27 ASN CA 1 1 4 2270 1 1 27 ASN CB C 5.983 -4.666 -2.397 1.00 . A A . 27 ASN CB 1 1 4 2271 1 1 27 ASN CG C 6.957 -5.730 -2.863 1.00 . A A . 27 ASN CG 1 1 4 2272 1 1 27 ASN H H 5.781 -6.323 -0.490 1.00 . A A . 27 ASN H 1 1 4 2273 1 1 27 ASN HA H 7.197 -3.937 -0.792 1.00 . A A . 27 ASN HA 1 1 4 2274 1 1 27 ASN HB2 H 4.979 -5.042 -2.530 1.00 . A A . 27 ASN HB2 1 1 4 2275 1 1 27 ASN HB3 H 6.118 -3.787 -3.008 1.00 . A A . 27 ASN HB3 1 1 4 2276 1 1 27 ASN HD21 H 6.771 -5.111 -4.744 1.00 . A A . 27 ASN HD21 1 1 4 2277 1 1 27 ASN HD22 H 7.843 -6.443 -4.494 1.00 . A A . 27 ASN HD22 1 1 4 2278 1 1 27 ASN N N 6.007 -5.464 -0.077 1.00 . A A . 27 ASN N 1 1 4 2279 1 1 27 ASN ND2 N 7.217 -5.765 -4.165 1.00 . A A . 27 ASN ND2 1 1 4 2280 1 1 27 ASN O O 5.553 -1.998 -0.600 1.00 . A A . 27 ASN O 1 1 4 2281 1 1 27 ASN OD1 O 7.471 -6.511 -2.062 1.00 . A A . 27 ASN OD1 1 1 4 2282 1 1 28 LEU C C 3.406 -1.888 1.560 1.00 . A A . 28 LEU C 1 1 4 2283 1 1 28 LEU CA C 2.996 -2.608 0.279 1.00 . A A . 28 LEU CA 1 1 4 2284 1 1 28 LEU CB C 1.654 -3.312 0.483 1.00 . A A . 28 LEU CB 1 1 4 2285 1 1 28 LEU CD1 C 0.208 -1.277 0.252 1.00 . A A . 28 LEU CD1 1 1 4 2286 1 1 28 LEU CD2 C -0.690 -3.325 1.372 1.00 . A A . 28 LEU CD2 1 1 4 2287 1 1 28 LEU CG C 0.547 -2.475 1.126 1.00 . A A . 28 LEU CG 1 1 4 2288 1 1 28 LEU H H 3.806 -4.527 -0.095 1.00 . A A . 28 LEU H 1 1 4 2289 1 1 28 LEU HA H 2.895 -1.880 -0.512 1.00 . A A . 28 LEU HA 1 1 4 2290 1 1 28 LEU HB2 H 1.302 -3.639 -0.483 1.00 . A A . 28 LEU HB2 1 1 4 2291 1 1 28 LEU HB3 H 1.825 -4.174 1.112 1.00 . A A . 28 LEU HB3 1 1 4 2292 1 1 28 LEU HD11 H 1.040 -0.590 0.245 1.00 . A A . 28 LEU HD11 1 1 4 2293 1 1 28 LEU HD12 H -0.666 -0.780 0.646 1.00 . A A . 28 LEU HD12 1 1 4 2294 1 1 28 LEU HD13 H 0.008 -1.612 -0.755 1.00 . A A . 28 LEU HD13 1 1 4 2295 1 1 28 LEU HD21 H -0.432 -4.162 2.003 1.00 . A A . 28 LEU HD21 1 1 4 2296 1 1 28 LEU HD22 H -1.071 -3.688 0.429 1.00 . A A . 28 LEU HD22 1 1 4 2297 1 1 28 LEU HD23 H -1.447 -2.727 1.859 1.00 . A A . 28 LEU HD23 1 1 4 2298 1 1 28 LEU HG H 0.894 -2.103 2.080 1.00 . A A . 28 LEU HG 1 1 4 2299 1 1 28 LEU N N 4.015 -3.570 -0.126 1.00 . A A . 28 LEU N 1 1 4 2300 1 1 28 LEU O O 3.419 -0.658 1.616 1.00 . A A . 28 LEU O 1 1 4 2301 1 1 29 PHE C C 5.268 -1.075 3.678 1.00 . A A . 29 PHE C 1 1 4 2302 1 1 29 PHE CA C 4.152 -2.099 3.867 1.00 . A A . 29 PHE CA 1 1 4 2303 1 1 29 PHE CB C 4.618 -3.209 4.811 1.00 . A A . 29 PHE CB 1 1 4 2304 1 1 29 PHE CD1 C 2.407 -3.640 5.918 1.00 . A A . 29 PHE CD1 1 1 4 2305 1 1 29 PHE CD2 C 3.582 -5.489 4.975 1.00 . A A . 29 PHE CD2 1 1 4 2306 1 1 29 PHE CE1 C 1.389 -4.486 6.317 1.00 . A A . 29 PHE CE1 1 1 4 2307 1 1 29 PHE CE2 C 2.567 -6.339 5.371 1.00 . A A . 29 PHE CE2 1 1 4 2308 1 1 29 PHE CG C 3.513 -4.131 5.243 1.00 . A A . 29 PHE CG 1 1 4 2309 1 1 29 PHE CZ C 1.470 -5.837 6.044 1.00 . A A . 29 PHE CZ 1 1 4 2310 1 1 29 PHE H H 3.710 -3.636 2.481 1.00 . A A . 29 PHE H 1 1 4 2311 1 1 29 PHE HA H 3.297 -1.604 4.301 1.00 . A A . 29 PHE HA 1 1 4 2312 1 1 29 PHE HB2 H 5.369 -3.803 4.314 1.00 . A A . 29 PHE HB2 1 1 4 2313 1 1 29 PHE HB3 H 5.045 -2.763 5.697 1.00 . A A . 29 PHE HB3 1 1 4 2314 1 1 29 PHE HD1 H 2.344 -2.582 6.132 1.00 . A A . 29 PHE HD1 1 1 4 2315 1 1 29 PHE HD2 H 4.439 -5.883 4.450 1.00 . A A . 29 PHE HD2 1 1 4 2316 1 1 29 PHE HE1 H 0.533 -4.089 6.842 1.00 . A A . 29 PHE HE1 1 1 4 2317 1 1 29 PHE HE2 H 2.632 -7.395 5.156 1.00 . A A . 29 PHE HE2 1 1 4 2318 1 1 29 PHE HZ H 0.675 -6.499 6.353 1.00 . A A . 29 PHE HZ 1 1 4 2319 1 1 29 PHE N N 3.741 -2.662 2.587 1.00 . A A . 29 PHE N 1 1 4 2320 1 1 29 PHE O O 5.238 0.009 4.260 1.00 . A A . 29 PHE O 1 1 4 2321 1 1 30 THR C C 6.918 0.758 1.948 1.00 . A A . 30 THR C 1 1 4 2322 1 1 30 THR CA C 7.381 -0.544 2.593 1.00 . A A . 30 THR CA 1 1 4 2323 1 1 30 THR CB C 8.420 -1.217 1.676 1.00 . A A . 30 THR CB 1 1 4 2324 1 1 30 THR CG2 C 9.620 -0.307 1.459 1.00 . A A . 30 THR CG2 1 1 4 2325 1 1 30 THR H H 6.222 -2.306 2.424 1.00 . A A . 30 THR H 1 1 4 2326 1 1 30 THR HA H 7.857 -0.317 3.536 1.00 . A A . 30 THR HA 1 1 4 2327 1 1 30 THR HB H 7.958 -1.414 0.719 1.00 . A A . 30 THR HB 1 1 4 2328 1 1 30 THR HG1 H 8.937 -2.354 3.202 1.00 . A A . 30 THR HG1 1 1 4 2329 1 1 30 THR HG21 H 9.985 -0.429 0.451 1.00 . A A . 30 THR HG21 1 1 4 2330 1 1 30 THR HG22 H 10.400 -0.568 2.158 1.00 . A A . 30 THR HG22 1 1 4 2331 1 1 30 THR HG23 H 9.325 0.720 1.614 1.00 . A A . 30 THR HG23 1 1 4 2332 1 1 30 THR N N 6.254 -1.429 2.859 1.00 . A A . 30 THR N 1 1 4 2333 1 1 30 THR O O 7.503 1.817 2.175 1.00 . A A . 30 THR O 1 1 4 2334 1 1 30 THR OG1 O 8.851 -2.455 2.251 1.00 . A A . 30 THR OG1 1 1 4 2335 1 1 31 HIS C C 4.567 2.737 1.446 1.00 . A A . 31 HIS C 1 1 4 2336 1 1 31 HIS CA C 5.321 1.843 0.465 1.00 . A A . 31 HIS CA 1 1 4 2337 1 1 31 HIS CB C 4.393 1.417 -0.672 1.00 . A A . 31 HIS CB 1 1 4 2338 1 1 31 HIS CD2 C 2.036 2.498 -0.627 1.00 . A A . 31 HIS CD2 1 1 4 2339 1 1 31 HIS CE1 C 2.457 4.238 -1.892 1.00 . A A . 31 HIS CE1 1 1 4 2340 1 1 31 HIS CG C 3.337 2.429 -0.994 1.00 . A A . 31 HIS CG 1 1 4 2341 1 1 31 HIS H H 5.441 -0.201 1.001 1.00 . A A . 31 HIS H 1 1 4 2342 1 1 31 HIS HA H 6.149 2.401 0.053 1.00 . A A . 31 HIS HA 1 1 4 2343 1 1 31 HIS HB2 H 4.979 1.255 -1.565 1.00 . A A . 31 HIS HB2 1 1 4 2344 1 1 31 HIS HB3 H 3.899 0.496 -0.399 1.00 . A A . 31 HIS HB3 1 1 4 2345 1 1 31 HIS HD1 H 4.422 3.765 -2.209 1.00 . A A . 31 HIS HD1 1 1 4 2346 1 1 31 HIS HD2 H 1.507 1.793 0.000 1.00 . A A . 31 HIS HD2 1 1 4 2347 1 1 31 HIS HE1 H 2.340 5.155 -2.451 1.00 . A A . 31 HIS HE1 1 1 4 2348 1 1 31 HIS N N 5.864 0.671 1.143 1.00 . A A . 31 HIS N 1 1 4 2349 1 1 31 HIS ND1 N 3.569 3.533 -1.787 1.00 . A A . 31 HIS ND1 1 1 4 2350 1 1 31 HIS NE2 N 1.511 3.632 -1.198 1.00 . A A . 31 HIS NE2 1 1 4 2351 1 1 31 HIS O O 4.789 3.946 1.494 1.00 . A A . 31 HIS O 1 1 4 2352 1 1 32 GLN C C 3.762 3.857 3.972 1.00 . A A . 32 GLN C 1 1 4 2353 1 1 32 GLN CA C 2.887 2.874 3.201 1.00 . A A . 32 GLN CA 1 1 4 2354 1 1 32 GLN CB C 2.203 1.911 4.173 1.00 . A A . 32 GLN CB 1 1 4 2355 1 1 32 GLN CD C -0.302 2.206 4.027 1.00 . A A . 32 GLN CD 1 1 4 2356 1 1 32 GLN CG C 0.891 1.350 3.650 1.00 . A A . 32 GLN CG 1 1 4 2357 1 1 32 GLN H H 3.543 1.166 2.138 1.00 . A A . 32 GLN H 1 1 4 2358 1 1 32 GLN HA H 2.131 3.428 2.666 1.00 . A A . 32 GLN HA 1 1 4 2359 1 1 32 GLN HB2 H 2.870 1.086 4.372 1.00 . A A . 32 GLN HB2 1 1 4 2360 1 1 32 GLN HB3 H 2.003 2.433 5.097 1.00 . A A . 32 GLN HB3 1 1 4 2361 1 1 32 GLN HE21 H -1.545 0.734 3.536 1.00 . A A . 32 GLN HE21 1 1 4 2362 1 1 32 GLN HE22 H -2.287 2.184 4.112 1.00 . A A . 32 GLN HE22 1 1 4 2363 1 1 32 GLN HG2 H 0.944 1.288 2.573 1.00 . A A . 32 GLN HG2 1 1 4 2364 1 1 32 GLN HG3 H 0.750 0.361 4.060 1.00 . A A . 32 GLN HG3 1 1 4 2365 1 1 32 GLN N N 3.675 2.132 2.224 1.00 . A A . 32 GLN N 1 1 4 2366 1 1 32 GLN NE2 N -1.499 1.653 3.876 1.00 . A A . 32 GLN NE2 1 1 4 2367 1 1 32 GLN O O 3.270 4.838 4.530 1.00 . A A . 32 GLN O 1 1 4 2368 1 1 32 GLN OE1 O -0.149 3.353 4.449 1.00 . A A . 32 GLN OE1 1 1 4 2369 1 1 33 LYS C C 5.814 5.908 4.304 1.00 . A A . 33 LYS C 1 1 4 2370 1 1 33 LYS CA C 6.009 4.448 4.702 1.00 . A A . 33 LYS CA 1 1 4 2371 1 1 33 LYS CB C 7.445 4.013 4.402 1.00 . A A . 33 LYS CB 1 1 4 2372 1 1 33 LYS CD C 9.286 2.348 4.786 1.00 . A A . 33 LYS CD 1 1 4 2373 1 1 33 LYS CE C 9.775 1.239 5.705 1.00 . A A . 33 LYS CE 1 1 4 2374 1 1 33 LYS CG C 7.836 2.705 5.068 1.00 . A A . 33 LYS CG 1 1 4 2375 1 1 33 LYS H H 5.396 2.790 3.536 1.00 . A A . 33 LYS H 1 1 4 2376 1 1 33 LYS HA H 5.825 4.349 5.761 1.00 . A A . 33 LYS HA 1 1 4 2377 1 1 33 LYS HB2 H 7.558 3.898 3.334 1.00 . A A . 33 LYS HB2 1 1 4 2378 1 1 33 LYS HB3 H 8.120 4.784 4.745 1.00 . A A . 33 LYS HB3 1 1 4 2379 1 1 33 LYS HD2 H 9.374 2.016 3.762 1.00 . A A . 33 LYS HD2 1 1 4 2380 1 1 33 LYS HD3 H 9.899 3.225 4.936 1.00 . A A . 33 LYS HD3 1 1 4 2381 1 1 33 LYS HE2 H 9.067 0.425 5.674 1.00 . A A . 33 LYS HE2 1 1 4 2382 1 1 33 LYS HE3 H 10.735 0.894 5.351 1.00 . A A . 33 LYS HE3 1 1 4 2383 1 1 33 LYS HG2 H 7.701 2.800 6.135 1.00 . A A . 33 LYS HG2 1 1 4 2384 1 1 33 LYS HG3 H 7.200 1.916 4.691 1.00 . A A . 33 LYS HG3 1 1 4 2385 1 1 33 LYS HZ1 H 10.847 2.145 7.252 1.00 . A A . 33 LYS HZ1 1 1 4 2386 1 1 33 LYS HZ2 H 9.821 0.902 7.766 1.00 . A A . 33 LYS HZ2 1 1 4 2387 1 1 33 LYS HZ3 H 9.177 2.405 7.332 1.00 . A A . 33 LYS HZ3 1 1 4 2388 1 1 33 LYS N N 5.063 3.588 4.000 1.00 . A A . 33 LYS N 1 1 4 2389 1 1 33 LYS NZ N 9.915 1.706 7.112 1.00 . A A . 33 LYS NZ 1 1 4 2390 1 1 33 LYS O O 5.895 6.805 5.143 1.00 . A A . 33 LYS O 1 1 4 2391 1 1 34 ILE C C 4.104 8.120 3.127 1.00 . A A . 34 ILE C 1 1 4 2392 1 1 34 ILE CA C 5.349 7.488 2.513 1.00 . A A . 34 ILE CA 1 1 4 2393 1 1 34 ILE CB C 5.212 7.498 0.979 1.00 . A A . 34 ILE CB 1 1 4 2394 1 1 34 ILE CD1 C 3.334 7.332 -0.730 1.00 . A A . 34 ILE CD1 1 1 4 2395 1 1 34 ILE CG1 C 3.922 6.793 0.555 1.00 . A A . 34 ILE CG1 1 1 4 2396 1 1 34 ILE CG2 C 6.421 6.835 0.336 1.00 . A A . 34 ILE CG2 1 1 4 2397 1 1 34 ILE H H 5.505 5.380 2.400 1.00 . A A . 34 ILE H 1 1 4 2398 1 1 34 ILE HA H 6.211 8.081 2.782 1.00 . A A . 34 ILE HA 1 1 4 2399 1 1 34 ILE HB H 5.178 8.526 0.650 1.00 . A A . 34 ILE HB 1 1 4 2400 1 1 34 ILE HD11 H 2.393 6.839 -0.929 1.00 . A A . 34 ILE HD11 1 1 4 2401 1 1 34 ILE HD12 H 3.169 8.395 -0.634 1.00 . A A . 34 ILE HD12 1 1 4 2402 1 1 34 ILE HD13 H 4.016 7.144 -1.545 1.00 . A A . 34 ILE HD13 1 1 4 2403 1 1 34 ILE HG12 H 4.123 5.743 0.413 1.00 . A A . 34 ILE HG12 1 1 4 2404 1 1 34 ILE HG13 H 3.183 6.912 1.335 1.00 . A A . 34 ILE HG13 1 1 4 2405 1 1 34 ILE HG21 H 7.252 7.524 0.336 1.00 . A A . 34 ILE HG21 1 1 4 2406 1 1 34 ILE HG22 H 6.687 5.951 0.896 1.00 . A A . 34 ILE HG22 1 1 4 2407 1 1 34 ILE HG23 H 6.182 6.559 -0.681 1.00 . A A . 34 ILE HG23 1 1 4 2408 1 1 34 ILE N N 5.557 6.137 3.020 1.00 . A A . 34 ILE N 1 1 4 2409 1 1 34 ILE O O 3.993 9.344 3.211 1.00 . A A . 34 ILE O 1 1 4 2410 1 1 35 HIS C C 2.155 8.120 5.631 1.00 . A A . 35 HIS C 1 1 4 2411 1 1 35 HIS CA C 1.934 7.754 4.167 1.00 . A A . 35 HIS CA 1 1 4 2412 1 1 35 HIS CB C 0.842 6.689 4.055 1.00 . A A . 35 HIS CB 1 1 4 2413 1 1 35 HIS CD2 C 0.484 5.724 1.674 1.00 . A A . 35 HIS CD2 1 1 4 2414 1 1 35 HIS CE1 C -1.065 7.117 0.992 1.00 . A A . 35 HIS CE1 1 1 4 2415 1 1 35 HIS CG C 0.242 6.589 2.686 1.00 . A A . 35 HIS CG 1 1 4 2416 1 1 35 HIS H H 3.316 6.314 3.463 1.00 . A A . 35 HIS H 1 1 4 2417 1 1 35 HIS HA H 1.619 8.637 3.632 1.00 . A A . 35 HIS HA 1 1 4 2418 1 1 35 HIS HB2 H 1.261 5.726 4.304 1.00 . A A . 35 HIS HB2 1 1 4 2419 1 1 35 HIS HB3 H 0.048 6.922 4.750 1.00 . A A . 35 HIS HB3 1 1 4 2420 1 1 35 HIS HD1 H -1.124 8.192 2.732 1.00 . A A . 35 HIS HD1 1 1 4 2421 1 1 35 HIS HD2 H 1.195 4.909 1.683 1.00 . A A . 35 HIS HD2 1 1 4 2422 1 1 35 HIS HE1 H -1.803 7.613 0.380 1.00 . A A . 35 HIS HE1 1 1 4 2423 1 1 35 HIS N N 3.170 7.278 3.557 1.00 . A A . 35 HIS N 1 1 4 2424 1 1 35 HIS ND1 N -0.733 7.450 2.227 1.00 . A A . 35 HIS ND1 1 1 4 2425 1 1 35 HIS NE2 N -0.340 6.073 0.633 1.00 . A A . 35 HIS NE2 1 1 4 2426 1 1 35 HIS O O 2.216 9.297 5.986 1.00 . A A . 35 HIS O 1 1 4 2427 1 1 36 THR C C 3.576 8.356 8.148 1.00 . A A . 36 THR C 1 1 4 2428 1 1 36 THR CA C 2.488 7.316 7.905 1.00 . A A . 36 THR CA 1 1 4 2429 1 1 36 THR CB C 2.877 6.007 8.617 1.00 . A A . 36 THR CB 1 1 4 2430 1 1 36 THR CG2 C 4.010 5.307 7.883 1.00 . A A . 36 THR CG2 1 1 4 2431 1 1 36 THR H H 2.218 6.186 6.136 1.00 . A A . 36 THR H 1 1 4 2432 1 1 36 THR HA H 1.561 7.672 8.331 1.00 . A A . 36 THR HA 1 1 4 2433 1 1 36 THR HB H 2.017 5.353 8.629 1.00 . A A . 36 THR HB 1 1 4 2434 1 1 36 THR HG1 H 2.962 5.579 10.541 1.00 . A A . 36 THR HG1 1 1 4 2435 1 1 36 THR HG21 H 3.742 5.181 6.845 1.00 . A A . 36 THR HG21 1 1 4 2436 1 1 36 THR HG22 H 4.185 4.340 8.330 1.00 . A A . 36 THR HG22 1 1 4 2437 1 1 36 THR HG23 H 4.907 5.904 7.954 1.00 . A A . 36 THR HG23 1 1 4 2438 1 1 36 THR N N 2.275 7.102 6.479 1.00 . A A . 36 THR N 1 1 4 2439 1 1 36 THR O O 3.477 9.168 9.067 1.00 . A A . 36 THR O 1 1 4 2440 1 1 36 THR OG1 O 3.273 6.282 9.966 1.00 . A A . 36 THR OG1 1 1 4 2441 1 1 37 GLY C C 6.036 9.562 8.910 1.00 . A A . 37 GLY C 1 1 4 2442 1 1 37 GLY CA C 5.705 9.272 7.460 1.00 . A A . 37 GLY CA 1 1 4 2443 1 1 37 GLY H H 4.639 7.656 6.603 1.00 . A A . 37 GLY H 1 1 4 2444 1 1 37 GLY HA2 H 6.582 8.869 6.975 1.00 . A A . 37 GLY HA2 1 1 4 2445 1 1 37 GLY HA3 H 5.430 10.197 6.974 1.00 . A A . 37 GLY HA3 1 1 4 2446 1 1 37 GLY N N 4.614 8.326 7.318 1.00 . A A . 37 GLY N 1 1 4 2447 1 1 37 GLY O O 5.952 8.677 9.761 1.00 . A A . 37 GLY O 1 1 4 2448 1 1 38 GLU C C 5.923 12.401 10.996 1.00 . A A . 38 GLU C 1 1 4 2449 1 1 38 GLU CA C 6.763 11.206 10.550 1.00 . A A . 38 GLU CA 1 1 4 2450 1 1 38 GLU CB C 8.250 11.554 10.638 1.00 . A A . 38 GLU CB 1 1 4 2451 1 1 38 GLU CD C 10.464 10.966 9.572 1.00 . A A . 38 GLU CD 1 1 4 2452 1 1 38 GLU CG C 9.165 10.442 10.152 1.00 . A A . 38 GLU CG 1 1 4 2453 1 1 38 GLU H H 6.463 11.466 8.471 1.00 . A A . 38 GLU H 1 1 4 2454 1 1 38 GLU HA H 6.558 10.373 11.206 1.00 . A A . 38 GLU HA 1 1 4 2455 1 1 38 GLU HB2 H 8.438 12.434 10.041 1.00 . A A . 38 GLU HB2 1 1 4 2456 1 1 38 GLU HB3 H 8.497 11.769 11.668 1.00 . A A . 38 GLU HB3 1 1 4 2457 1 1 38 GLU HG2 H 9.396 9.794 10.984 1.00 . A A . 38 GLU HG2 1 1 4 2458 1 1 38 GLU HG3 H 8.649 9.876 9.390 1.00 . A A . 38 GLU HG3 1 1 4 2459 1 1 38 GLU N N 6.415 10.804 9.193 1.00 . A A . 38 GLU N 1 1 4 2460 1 1 38 GLU O O 5.431 13.171 10.171 1.00 . A A . 38 GLU O 1 1 4 2461 1 1 38 GLU OE1 O 10.921 12.039 10.018 1.00 . A A . 38 GLU OE1 1 1 4 2462 1 1 38 GLU OE2 O 11.022 10.305 8.672 1.00 . A A . 38 GLU OE2 1 1 4 2463 1 1 39 LYS C C 5.755 14.349 13.979 1.00 . A A . 39 LYS C 1 1 4 2464 1 1 39 LYS CA C 4.985 13.647 12.864 1.00 . A A . 39 LYS CA 1 1 4 2465 1 1 39 LYS CB C 3.647 13.131 13.401 1.00 . A A . 39 LYS CB 1 1 4 2466 1 1 39 LYS CD C 3.871 12.633 15.853 1.00 . A A . 39 LYS CD 1 1 4 2467 1 1 39 LYS CE C 4.658 11.732 16.792 1.00 . A A . 39 LYS CE 1 1 4 2468 1 1 39 LYS CG C 3.792 12.046 14.453 1.00 . A A . 39 LYS CG 1 1 4 2469 1 1 39 LYS H H 6.181 11.901 12.915 1.00 . A A . 39 LYS H 1 1 4 2470 1 1 39 LYS HA H 4.796 14.355 12.072 1.00 . A A . 39 LYS HA 1 1 4 2471 1 1 39 LYS HB2 H 3.106 13.958 13.837 1.00 . A A . 39 LYS HB2 1 1 4 2472 1 1 39 LYS HB3 H 3.074 12.731 12.577 1.00 . A A . 39 LYS HB3 1 1 4 2473 1 1 39 LYS HD2 H 4.359 13.595 15.803 1.00 . A A . 39 LYS HD2 1 1 4 2474 1 1 39 LYS HD3 H 2.869 12.755 16.240 1.00 . A A . 39 LYS HD3 1 1 4 2475 1 1 39 LYS HE2 H 5.497 11.318 16.253 1.00 . A A . 39 LYS HE2 1 1 4 2476 1 1 39 LYS HE3 H 5.019 12.324 17.620 1.00 . A A . 39 LYS HE3 1 1 4 2477 1 1 39 LYS HG2 H 2.937 11.388 14.399 1.00 . A A . 39 LYS HG2 1 1 4 2478 1 1 39 LYS HG3 H 4.694 11.484 14.257 1.00 . A A . 39 LYS HG3 1 1 4 2479 1 1 39 LYS HZ1 H 4.100 10.396 18.297 1.00 . A A . 39 LYS HZ1 1 1 4 2480 1 1 39 LYS HZ2 H 3.951 9.768 16.733 1.00 . A A . 39 LYS HZ2 1 1 4 2481 1 1 39 LYS HZ3 H 2.819 10.886 17.307 1.00 . A A . 39 LYS HZ3 1 1 4 2482 1 1 39 LYS N N 5.764 12.548 12.307 1.00 . A A . 39 LYS N 1 1 4 2483 1 1 39 LYS NZ N 3.823 10.617 17.320 1.00 . A A . 39 LYS NZ 1 1 4 2484 1 1 39 LYS O O 6.479 13.724 14.754 1.00 . A A . 39 LYS O 1 1 4 2485 1 1 40 PRO C C 5.717 16.238 16.481 1.00 . A A . 40 PRO C 1 1 4 2486 1 1 40 PRO CA C 6.266 16.492 15.081 1.00 . A A . 40 PRO CA 1 1 4 2487 1 1 40 PRO CB C 5.965 17.927 14.642 1.00 . A A . 40 PRO CB 1 1 4 2488 1 1 40 PRO CD C 4.747 16.487 13.173 1.00 . A A . 40 PRO CD 1 1 4 2489 1 1 40 PRO CG C 4.704 17.826 13.856 1.00 . A A . 40 PRO CG 1 1 4 2490 1 1 40 PRO HA H 7.333 16.329 15.079 1.00 . A A . 40 PRO HA 1 1 4 2491 1 1 40 PRO HB2 H 5.840 18.555 15.513 1.00 . A A . 40 PRO HB2 1 1 4 2492 1 1 40 PRO HB3 H 6.778 18.300 14.037 1.00 . A A . 40 PRO HB3 1 1 4 2493 1 1 40 PRO HD2 H 3.754 16.069 13.101 1.00 . A A . 40 PRO HD2 1 1 4 2494 1 1 40 PRO HD3 H 5.193 16.577 12.194 1.00 . A A . 40 PRO HD3 1 1 4 2495 1 1 40 PRO HG2 H 3.853 17.883 14.518 1.00 . A A . 40 PRO HG2 1 1 4 2496 1 1 40 PRO HG3 H 4.663 18.619 13.123 1.00 . A A . 40 PRO HG3 1 1 4 2497 1 1 40 PRO N N 5.595 15.678 14.064 1.00 . A A . 40 PRO N 1 1 4 2498 1 1 40 PRO O O 4.505 16.155 16.678 1.00 . A A . 40 PRO O 1 1 4 2499 1 1 41 SER C C 6.223 17.164 19.639 1.00 . A A . 41 SER C 1 1 4 2500 1 1 41 SER CA C 6.223 15.868 18.833 1.00 . A A . 41 SER CA 1 1 4 2501 1 1 41 SER CB C 7.166 14.852 19.480 1.00 . A A . 41 SER CB 1 1 4 2502 1 1 41 SER H H 7.570 16.192 17.232 1.00 . A A . 41 SER H 1 1 4 2503 1 1 41 SER HA H 5.222 15.463 18.825 1.00 . A A . 41 SER HA 1 1 4 2504 1 1 41 SER HB2 H 7.319 14.025 18.803 1.00 . A A . 41 SER HB2 1 1 4 2505 1 1 41 SER HB3 H 8.113 15.326 19.690 1.00 . A A . 41 SER HB3 1 1 4 2506 1 1 41 SER HG H 6.767 13.406 20.741 1.00 . A A . 41 SER HG 1 1 4 2507 1 1 41 SER N N 6.617 16.116 17.452 1.00 . A A . 41 SER N 1 1 4 2508 1 1 41 SER O O 7.142 17.426 20.414 1.00 . A A . 41 SER O 1 1 4 2509 1 1 41 SER OG O 6.625 14.355 20.693 1.00 . A A . 41 SER OG 1 1 4 2510 1 1 42 GLY C C 5.404 20.423 19.287 1.00 . A A . 42 GLY C 1 1 4 2511 1 1 42 GLY CA C 5.083 19.230 20.165 1.00 . A A . 42 GLY CA 1 1 4 2512 1 1 42 GLY H H 4.480 17.710 18.819 1.00 . A A . 42 GLY H 1 1 4 2513 1 1 42 GLY HA2 H 4.078 19.336 20.545 1.00 . A A . 42 GLY HA2 1 1 4 2514 1 1 42 GLY HA3 H 5.771 19.214 20.997 1.00 . A A . 42 GLY HA3 1 1 4 2515 1 1 42 GLY N N 5.184 17.971 19.450 1.00 . A A . 42 GLY N 1 1 4 2516 1 1 42 GLY O O 5.321 20.358 18.060 1.00 . A A . 42 GLY O 1 1 4 2517 1 1 43 PRO C C 7.430 22.660 18.435 1.00 . A A . 43 PRO C 1 1 4 2518 1 1 43 PRO CA C 6.121 22.779 19.207 1.00 . A A . 43 PRO CA 1 1 4 2519 1 1 43 PRO CB C 6.254 23.811 20.330 1.00 . A A . 43 PRO CB 1 1 4 2520 1 1 43 PRO CD C 5.900 21.693 21.380 1.00 . A A . 43 PRO CD 1 1 4 2521 1 1 43 PRO CG C 6.602 23.014 21.539 1.00 . A A . 43 PRO CG 1 1 4 2522 1 1 43 PRO HA H 5.332 23.079 18.532 1.00 . A A . 43 PRO HA 1 1 4 2523 1 1 43 PRO HB2 H 7.034 24.517 20.083 1.00 . A A . 43 PRO HB2 1 1 4 2524 1 1 43 PRO HB3 H 5.317 24.333 20.457 1.00 . A A . 43 PRO HB3 1 1 4 2525 1 1 43 PRO HD2 H 6.495 20.896 21.801 1.00 . A A . 43 PRO HD2 1 1 4 2526 1 1 43 PRO HD3 H 4.926 21.726 21.845 1.00 . A A . 43 PRO HD3 1 1 4 2527 1 1 43 PRO HG2 H 7.670 22.867 21.587 1.00 . A A . 43 PRO HG2 1 1 4 2528 1 1 43 PRO HG3 H 6.251 23.520 22.426 1.00 . A A . 43 PRO HG3 1 1 4 2529 1 1 43 PRO N N 5.779 21.545 19.920 1.00 . A A . 43 PRO N 1 1 4 2530 1 1 43 PRO O O 7.833 23.586 17.731 1.00 . A A . 43 PRO O 1 1 4 2531 1 1 44 SER C C 9.123 20.707 16.494 1.00 . A A . 44 SER C 1 1 4 2532 1 1 44 SER CA C 9.357 21.276 17.890 1.00 . A A . 44 SER CA 1 1 4 2533 1 1 44 SER CB C 10.227 20.317 18.705 1.00 . A A . 44 SER CB 1 1 4 2534 1 1 44 SER H H 7.718 20.814 19.148 1.00 . A A . 44 SER H 1 1 4 2535 1 1 44 SER HA H 9.868 22.223 17.799 1.00 . A A . 44 SER HA 1 1 4 2536 1 1 44 SER HB2 H 10.652 20.845 19.544 1.00 . A A . 44 SER HB2 1 1 4 2537 1 1 44 SER HB3 H 9.617 19.500 19.065 1.00 . A A . 44 SER HB3 1 1 4 2538 1 1 44 SER HG H 10.960 19.029 17.423 1.00 . A A . 44 SER HG 1 1 4 2539 1 1 44 SER N N 8.090 21.514 18.572 1.00 . A A . 44 SER N 1 1 4 2540 1 1 44 SER O O 8.280 19.831 16.302 1.00 . A A . 44 SER O 1 1 4 2541 1 1 44 SER OG O 11.279 19.788 17.917 1.00 . A A . 44 SER OG 1 1 4 2542 1 1 45 SER C C 11.053 20.136 13.652 1.00 . A A . 45 SER C 1 1 4 2543 1 1 45 SER CA C 9.749 20.758 14.142 1.00 . A A . 45 SER CA 1 1 4 2544 1 1 45 SER CB C 9.354 21.924 13.233 1.00 . A A . 45 SER CB 1 1 4 2545 1 1 45 SER H H 10.530 21.909 15.738 1.00 . A A . 45 SER H 1 1 4 2546 1 1 45 SER HA H 8.972 20.009 14.110 1.00 . A A . 45 SER HA 1 1 4 2547 1 1 45 SER HB2 H 8.698 22.591 13.772 1.00 . A A . 45 SER HB2 1 1 4 2548 1 1 45 SER HB3 H 10.243 22.459 12.932 1.00 . A A . 45 SER HB3 1 1 4 2549 1 1 45 SER HG H 8.814 22.088 11.357 1.00 . A A . 45 SER HG 1 1 4 2550 1 1 45 SER N N 9.876 21.212 15.522 1.00 . A A . 45 SER N 1 1 4 2551 1 1 45 SER O O 11.498 20.398 12.536 1.00 . A A . 45 SER O 1 1 4 2552 1 1 45 SER OG O 8.683 21.462 12.074 1.00 . A A . 45 SER OG 1 1 4 2553 1 1 46 GLY C C 14.108 19.574 14.315 1.00 . A A . 46 GLY C 1 1 4 2554 1 1 46 GLY CA C 12.910 18.664 14.135 1.00 . A A . 46 GLY CA 1 1 4 2555 1 1 46 GLY H H 11.261 19.139 15.376 1.00 . A A . 46 GLY H 1 1 4 2556 1 1 46 GLY HA2 H 13.041 17.787 14.752 1.00 . A A . 46 GLY HA2 1 1 4 2557 1 1 46 GLY HA3 H 12.856 18.360 13.100 1.00 . A A . 46 GLY HA3 1 1 4 2558 1 1 46 GLY N N 11.662 19.311 14.498 1.00 . A A . 46 GLY N 1 1 4 2559 1 1 46 GLY O O 13.933 20.790 14.380 1.00 . A A . 46 GLY O 1 1 4 2560 2 2 1 ZN ZN ZN -0.116 4.377 -0.551 1.00 . B A . 201 ZN ZN 1 1 5 2561 1 1 1 GLY C C -1.094 10.685 -18.712 1.00 . A A . 1 GLY C 1 1 5 2562 1 1 1 GLY CA C -1.044 11.988 -19.486 1.00 . A A . 1 GLY CA 1 1 5 2563 1 1 1 GLY H1 H 0.048 12.951 -17.948 1.00 . A A . 1 GLY H1 1 1 5 2564 1 1 1 GLY HA2 H -2.029 12.431 -19.488 1.00 . A A . 1 GLY HA2 1 1 5 2565 1 1 1 GLY HA3 H -0.753 11.778 -20.504 1.00 . A A . 1 GLY HA3 1 1 5 2566 1 1 1 GLY N N -0.105 12.936 -18.916 1.00 . A A . 1 GLY N 1 1 5 2567 1 1 1 GLY O O -0.091 9.979 -18.608 1.00 . A A . 1 GLY O 1 1 5 2568 1 1 2 SER C C -3.074 8.048 -18.248 1.00 . A A . 2 SER C 1 1 5 2569 1 1 2 SER CA C -2.439 9.142 -17.395 1.00 . A A . 2 SER CA 1 1 5 2570 1 1 2 SER CB C -3.304 9.411 -16.163 1.00 . A A . 2 SER CB 1 1 5 2571 1 1 2 SER H H -3.026 10.971 -18.286 1.00 . A A . 2 SER H 1 1 5 2572 1 1 2 SER HA H -1.462 8.811 -17.073 1.00 . A A . 2 SER HA 1 1 5 2573 1 1 2 SER HB2 H -4.219 9.897 -16.467 1.00 . A A . 2 SER HB2 1 1 5 2574 1 1 2 SER HB3 H -3.539 8.474 -15.679 1.00 . A A . 2 SER HB3 1 1 5 2575 1 1 2 SER HG H -1.681 10.150 -15.352 1.00 . A A . 2 SER HG 1 1 5 2576 1 1 2 SER N N -2.264 10.366 -18.168 1.00 . A A . 2 SER N 1 1 5 2577 1 1 2 SER O O -4.249 8.128 -18.606 1.00 . A A . 2 SER O 1 1 5 2578 1 1 2 SER OG O -2.630 10.246 -15.238 1.00 . A A . 2 SER OG 1 1 5 2579 1 1 3 SER C C -2.386 4.578 -18.759 1.00 . A A . 3 SER C 1 1 5 2580 1 1 3 SER CA C -2.770 5.916 -19.383 1.00 . A A . 3 SER CA 1 1 5 2581 1 1 3 SER CB C -2.203 6.012 -20.801 1.00 . A A . 3 SER CB 1 1 5 2582 1 1 3 SER H H -1.359 7.020 -18.254 1.00 . A A . 3 SER H 1 1 5 2583 1 1 3 SER HA H -3.846 5.983 -19.429 1.00 . A A . 3 SER HA 1 1 5 2584 1 1 3 SER HB2 H -2.138 7.050 -21.091 1.00 . A A . 3 SER HB2 1 1 5 2585 1 1 3 SER HB3 H -1.218 5.569 -20.823 1.00 . A A . 3 SER HB3 1 1 5 2586 1 1 3 SER HG H -3.520 5.969 -22.250 1.00 . A A . 3 SER HG 1 1 5 2587 1 1 3 SER N N -2.287 7.026 -18.569 1.00 . A A . 3 SER N 1 1 5 2588 1 1 3 SER O O -1.318 4.441 -18.164 1.00 . A A . 3 SER O 1 1 5 2589 1 1 3 SER OG O -3.031 5.330 -21.728 1.00 . A A . 3 SER OG 1 1 5 2590 1 1 4 GLY C C -3.851 1.197 -18.988 1.00 . A A . 4 GLY C 1 1 5 2591 1 1 4 GLY CA C -3.003 2.277 -18.346 1.00 . A A . 4 GLY CA 1 1 5 2592 1 1 4 GLY H H -4.102 3.759 -19.386 1.00 . A A . 4 GLY H 1 1 5 2593 1 1 4 GLY HA2 H -1.961 2.037 -18.496 1.00 . A A . 4 GLY HA2 1 1 5 2594 1 1 4 GLY HA3 H -3.209 2.298 -17.286 1.00 . A A . 4 GLY HA3 1 1 5 2595 1 1 4 GLY N N -3.266 3.592 -18.901 1.00 . A A . 4 GLY N 1 1 5 2596 1 1 4 GLY O O -4.072 1.208 -20.199 1.00 . A A . 4 GLY O 1 1 5 2597 1 1 5 SER C C -6.534 -0.811 -18.025 1.00 . A A . 5 SER C 1 1 5 2598 1 1 5 SER CA C -5.152 -0.836 -18.670 1.00 . A A . 5 SER CA 1 1 5 2599 1 1 5 SER CB C -4.473 -2.179 -18.394 1.00 . A A . 5 SER CB 1 1 5 2600 1 1 5 SER H H -4.116 0.305 -17.218 1.00 . A A . 5 SER H 1 1 5 2601 1 1 5 SER HA H -5.263 -0.711 -19.737 1.00 . A A . 5 SER HA 1 1 5 2602 1 1 5 SER HB2 H -4.904 -2.936 -19.032 1.00 . A A . 5 SER HB2 1 1 5 2603 1 1 5 SER HB3 H -3.416 -2.094 -18.601 1.00 . A A . 5 SER HB3 1 1 5 2604 1 1 5 SER HG H -5.579 -2.678 -16.856 1.00 . A A . 5 SER HG 1 1 5 2605 1 1 5 SER N N -4.327 0.259 -18.174 1.00 . A A . 5 SER N 1 1 5 2606 1 1 5 SER O O -6.715 -0.260 -16.939 1.00 . A A . 5 SER O 1 1 5 2607 1 1 5 SER OG O -4.643 -2.569 -17.043 1.00 . A A . 5 SER OG 1 1 5 2608 1 1 6 SER C C -8.890 -1.610 -16.681 1.00 . A A . 6 SER C 1 1 5 2609 1 1 6 SER CA C -8.875 -1.456 -18.199 1.00 . A A . 6 SER CA 1 1 5 2610 1 1 6 SER CB C -9.644 -2.608 -18.847 1.00 . A A . 6 SER CB 1 1 5 2611 1 1 6 SER H H -7.301 -1.834 -19.563 1.00 . A A . 6 SER H 1 1 5 2612 1 1 6 SER HA H -9.354 -0.523 -18.459 1.00 . A A . 6 SER HA 1 1 5 2613 1 1 6 SER HB2 H -9.687 -2.453 -19.915 1.00 . A A . 6 SER HB2 1 1 5 2614 1 1 6 SER HB3 H -9.135 -3.539 -18.639 1.00 . A A . 6 SER HB3 1 1 5 2615 1 1 6 SER HG H -10.996 -2.306 -17.463 1.00 . A A . 6 SER HG 1 1 5 2616 1 1 6 SER N N -7.508 -1.412 -18.702 1.00 . A A . 6 SER N 1 1 5 2617 1 1 6 SER O O -9.569 -0.864 -15.976 1.00 . A A . 6 SER O 1 1 5 2618 1 1 6 SER OG O -10.966 -2.688 -18.343 1.00 . A A . 6 SER OG 1 1 5 2619 1 1 7 GLY C C -6.954 -2.051 -14.085 1.00 . A A . 7 GLY C 1 1 5 2620 1 1 7 GLY CA C -8.076 -2.821 -14.753 1.00 . A A . 7 GLY CA 1 1 5 2621 1 1 7 GLY H H -7.615 -3.149 -16.793 1.00 . A A . 7 GLY H 1 1 5 2622 1 1 7 GLY HA2 H -9.015 -2.525 -14.311 1.00 . A A . 7 GLY HA2 1 1 5 2623 1 1 7 GLY HA3 H -7.925 -3.876 -14.580 1.00 . A A . 7 GLY HA3 1 1 5 2624 1 1 7 GLY N N -8.135 -2.585 -16.184 1.00 . A A . 7 GLY N 1 1 5 2625 1 1 7 GLY O O -5.785 -2.212 -14.435 1.00 . A A . 7 GLY O 1 1 5 2626 1 1 8 THR C C -5.275 -1.292 -11.740 1.00 . A A . 8 THR C 1 1 5 2627 1 1 8 THR CA C -6.326 -0.408 -12.403 1.00 . A A . 8 THR CA 1 1 5 2628 1 1 8 THR CB C -6.992 0.472 -11.328 1.00 . A A . 8 THR CB 1 1 5 2629 1 1 8 THR CG2 C -5.970 1.382 -10.664 1.00 . A A . 8 THR CG2 1 1 5 2630 1 1 8 THR H H -8.258 -1.124 -12.886 1.00 . A A . 8 THR H 1 1 5 2631 1 1 8 THR HA H -5.838 0.240 -13.117 1.00 . A A . 8 THR HA 1 1 5 2632 1 1 8 THR HB H -7.423 -0.171 -10.575 1.00 . A A . 8 THR HB 1 1 5 2633 1 1 8 THR HG1 H -8.371 0.815 -12.696 1.00 . A A . 8 THR HG1 1 1 5 2634 1 1 8 THR HG21 H -5.961 2.338 -11.165 1.00 . A A . 8 THR HG21 1 1 5 2635 1 1 8 THR HG22 H -4.990 0.932 -10.730 1.00 . A A . 8 THR HG22 1 1 5 2636 1 1 8 THR HG23 H -6.233 1.522 -9.626 1.00 . A A . 8 THR HG23 1 1 5 2637 1 1 8 THR N N -7.310 -1.208 -13.120 1.00 . A A . 8 THR N 1 1 5 2638 1 1 8 THR O O -4.078 -1.134 -11.977 1.00 . A A . 8 THR O 1 1 5 2639 1 1 8 THR OG1 O -8.030 1.263 -11.917 1.00 . A A . 8 THR OG1 1 1 5 2640 1 1 9 GLY C C -5.437 -4.474 -9.941 1.00 . A A . 9 GLY C 1 1 5 2641 1 1 9 GLY CA C -4.818 -3.119 -10.225 1.00 . A A . 9 GLY CA 1 1 5 2642 1 1 9 GLY H H -6.697 -2.303 -10.758 1.00 . A A . 9 GLY H 1 1 5 2643 1 1 9 GLY HA2 H -3.940 -3.258 -10.838 1.00 . A A . 9 GLY HA2 1 1 5 2644 1 1 9 GLY HA3 H -4.523 -2.669 -9.288 1.00 . A A . 9 GLY HA3 1 1 5 2645 1 1 9 GLY N N -5.732 -2.223 -10.909 1.00 . A A . 9 GLY N 1 1 5 2646 1 1 9 GLY O O -6.413 -4.573 -9.199 1.00 . A A . 9 GLY O 1 1 5 2647 1 1 10 GLU C C -4.549 -7.619 -9.301 1.00 . A A . 10 GLU C 1 1 5 2648 1 1 10 GLU CA C -5.375 -6.873 -10.344 1.00 . A A . 10 GLU CA 1 1 5 2649 1 1 10 GLU CB C -5.356 -7.640 -11.669 1.00 . A A . 10 GLU CB 1 1 5 2650 1 1 10 GLU CD C -5.940 -9.829 -12.785 1.00 . A A . 10 GLU CD 1 1 5 2651 1 1 10 GLU CG C -6.288 -8.840 -11.690 1.00 . A A . 10 GLU CG 1 1 5 2652 1 1 10 GLU H H -4.094 -5.375 -11.117 1.00 . A A . 10 GLU H 1 1 5 2653 1 1 10 GLU HA H -6.393 -6.801 -9.995 1.00 . A A . 10 GLU HA 1 1 5 2654 1 1 10 GLU HB2 H -5.648 -6.969 -12.463 1.00 . A A . 10 GLU HB2 1 1 5 2655 1 1 10 GLU HB3 H -4.351 -7.988 -11.854 1.00 . A A . 10 GLU HB3 1 1 5 2656 1 1 10 GLU HG2 H -6.226 -9.344 -10.738 1.00 . A A . 10 GLU HG2 1 1 5 2657 1 1 10 GLU HG3 H -7.299 -8.492 -11.847 1.00 . A A . 10 GLU HG3 1 1 5 2658 1 1 10 GLU N N -4.869 -5.518 -10.536 1.00 . A A . 10 GLU N 1 1 5 2659 1 1 10 GLU O O -4.440 -8.845 -9.338 1.00 . A A . 10 GLU O 1 1 5 2660 1 1 10 GLU OE1 O -5.929 -9.425 -13.967 1.00 . A A . 10 GLU OE1 1 1 5 2661 1 1 10 GLU OE2 O -5.679 -11.006 -12.461 1.00 . A A . 10 GLU OE2 1 1 5 2662 1 1 11 LYS C C -3.987 -7.727 -6.065 1.00 . A A . 11 LYS C 1 1 5 2663 1 1 11 LYS CA C -3.152 -7.459 -7.313 1.00 . A A . 11 LYS CA 1 1 5 2664 1 1 11 LYS CB C -1.983 -6.533 -6.969 1.00 . A A . 11 LYS CB 1 1 5 2665 1 1 11 LYS CD C -0.754 -6.029 -9.100 1.00 . A A . 11 LYS CD 1 1 5 2666 1 1 11 LYS CE C -1.416 -6.832 -10.209 1.00 . A A . 11 LYS CE 1 1 5 2667 1 1 11 LYS CG C -0.734 -6.799 -7.791 1.00 . A A . 11 LYS CG 1 1 5 2668 1 1 11 LYS H H -4.092 -5.898 -8.392 1.00 . A A . 11 LYS H 1 1 5 2669 1 1 11 LYS HA H -2.762 -8.397 -7.679 1.00 . A A . 11 LYS HA 1 1 5 2670 1 1 11 LYS HB2 H -2.288 -5.511 -7.135 1.00 . A A . 11 LYS HB2 1 1 5 2671 1 1 11 LYS HB3 H -1.735 -6.661 -5.925 1.00 . A A . 11 LYS HB3 1 1 5 2672 1 1 11 LYS HD2 H -1.304 -5.110 -8.959 1.00 . A A . 11 LYS HD2 1 1 5 2673 1 1 11 LYS HD3 H 0.263 -5.801 -9.389 1.00 . A A . 11 LYS HD3 1 1 5 2674 1 1 11 LYS HE2 H -1.105 -7.862 -10.125 1.00 . A A . 11 LYS HE2 1 1 5 2675 1 1 11 LYS HE3 H -2.487 -6.768 -10.091 1.00 . A A . 11 LYS HE3 1 1 5 2676 1 1 11 LYS HG2 H 0.132 -6.497 -7.221 1.00 . A A . 11 LYS HG2 1 1 5 2677 1 1 11 LYS HG3 H -0.674 -7.857 -8.007 1.00 . A A . 11 LYS HG3 1 1 5 2678 1 1 11 LYS HZ1 H -0.175 -5.757 -11.502 1.00 . A A . 11 LYS HZ1 1 1 5 2679 1 1 11 LYS HZ2 H -1.809 -5.727 -11.938 1.00 . A A . 11 LYS HZ2 1 1 5 2680 1 1 11 LYS HZ3 H -0.887 -7.118 -12.210 1.00 . A A . 11 LYS HZ3 1 1 5 2681 1 1 11 LYS N N -3.968 -6.871 -8.369 1.00 . A A . 11 LYS N 1 1 5 2682 1 1 11 LYS NZ N -1.046 -6.323 -11.559 1.00 . A A . 11 LYS NZ 1 1 5 2683 1 1 11 LYS O O -5.008 -7.083 -5.823 1.00 . A A . 11 LYS O 1 1 5 2684 1 1 12 PRO C C -4.130 -7.992 -2.944 1.00 . A A . 12 PRO C 1 1 5 2685 1 1 12 PRO CA C -4.236 -9.071 -4.016 1.00 . A A . 12 PRO CA 1 1 5 2686 1 1 12 PRO CB C -3.506 -10.340 -3.570 1.00 . A A . 12 PRO CB 1 1 5 2687 1 1 12 PRO CD C -2.335 -9.506 -5.480 1.00 . A A . 12 PRO CD 1 1 5 2688 1 1 12 PRO CG C -2.148 -10.228 -4.174 1.00 . A A . 12 PRO CG 1 1 5 2689 1 1 12 PRO HA H -5.277 -9.297 -4.195 1.00 . A A . 12 PRO HA 1 1 5 2690 1 1 12 PRO HB2 H -3.457 -10.371 -2.491 1.00 . A A . 12 PRO HB2 1 1 5 2691 1 1 12 PRO HB3 H -4.030 -11.210 -3.937 1.00 . A A . 12 PRO HB3 1 1 5 2692 1 1 12 PRO HD2 H -1.483 -8.876 -5.687 1.00 . A A . 12 PRO HD2 1 1 5 2693 1 1 12 PRO HD3 H -2.488 -10.212 -6.283 1.00 . A A . 12 PRO HD3 1 1 5 2694 1 1 12 PRO HG2 H -1.502 -9.662 -3.522 1.00 . A A . 12 PRO HG2 1 1 5 2695 1 1 12 PRO HG3 H -1.741 -11.214 -4.346 1.00 . A A . 12 PRO HG3 1 1 5 2696 1 1 12 PRO N N -3.545 -8.698 -5.253 1.00 . A A . 12 PRO N 1 1 5 2697 1 1 12 PRO O O -5.039 -7.817 -2.133 1.00 . A A . 12 PRO O 1 1 5 2698 1 1 13 TYR C C -3.097 -4.841 -2.576 1.00 . A A . 13 TYR C 1 1 5 2699 1 1 13 TYR CA C -2.789 -6.208 -1.973 1.00 . A A . 13 TYR CA 1 1 5 2700 1 1 13 TYR CB C -1.343 -6.244 -1.475 1.00 . A A . 13 TYR CB 1 1 5 2701 1 1 13 TYR CD1 C -1.274 -7.912 0.420 1.00 . A A . 13 TYR CD1 1 1 5 2702 1 1 13 TYR CD2 C -0.218 -8.499 -1.635 1.00 . A A . 13 TYR CD2 1 1 5 2703 1 1 13 TYR CE1 C -0.905 -9.128 0.962 1.00 . A A . 13 TYR CE1 1 1 5 2704 1 1 13 TYR CE2 C 0.153 -9.718 -1.102 1.00 . A A . 13 TYR CE2 1 1 5 2705 1 1 13 TYR CG C -0.938 -7.576 -0.886 1.00 . A A . 13 TYR CG 1 1 5 2706 1 1 13 TYR CZ C -0.192 -10.027 0.197 1.00 . A A . 13 TYR CZ 1 1 5 2707 1 1 13 TYR H H -2.326 -7.456 -3.618 1.00 . A A . 13 TYR H 1 1 5 2708 1 1 13 TYR HA H -3.451 -6.378 -1.137 1.00 . A A . 13 TYR HA 1 1 5 2709 1 1 13 TYR HB2 H -0.680 -6.030 -2.299 1.00 . A A . 13 TYR HB2 1 1 5 2710 1 1 13 TYR HB3 H -1.214 -5.490 -0.711 1.00 . A A . 13 TYR HB3 1 1 5 2711 1 1 13 TYR HD1 H -1.832 -7.205 1.016 1.00 . A A . 13 TYR HD1 1 1 5 2712 1 1 13 TYR HD2 H 0.051 -8.253 -2.652 1.00 . A A . 13 TYR HD2 1 1 5 2713 1 1 13 TYR HE1 H -1.175 -9.371 1.979 1.00 . A A . 13 TYR HE1 1 1 5 2714 1 1 13 TYR HE2 H 0.712 -10.422 -1.700 1.00 . A A . 13 TYR HE2 1 1 5 2715 1 1 13 TYR HH H 1.090 -11.427 0.501 1.00 . A A . 13 TYR HH 1 1 5 2716 1 1 13 TYR N N -3.014 -7.270 -2.947 1.00 . A A . 13 TYR N 1 1 5 2717 1 1 13 TYR O O -2.972 -4.641 -3.784 1.00 . A A . 13 TYR O 1 1 5 2718 1 1 13 TYR OH O 0.178 -11.240 0.733 1.00 . A A . 13 TYR OH 1 1 5 2719 1 1 14 ARG C C -3.662 -1.550 -1.036 1.00 . A A . 14 ARG C 1 1 5 2720 1 1 14 ARG CA C -3.828 -2.555 -2.172 1.00 . A A . 14 ARG CA 1 1 5 2721 1 1 14 ARG CB C -5.261 -2.506 -2.706 1.00 . A A . 14 ARG CB 1 1 5 2722 1 1 14 ARG CD C -6.302 -0.299 -2.104 1.00 . A A . 14 ARG CD 1 1 5 2723 1 1 14 ARG CG C -5.676 -1.134 -3.211 1.00 . A A . 14 ARG CG 1 1 5 2724 1 1 14 ARG CZ C -8.546 -0.076 -1.126 1.00 . A A . 14 ARG CZ 1 1 5 2725 1 1 14 ARG H H -3.581 -4.124 -0.773 1.00 . A A . 14 ARG H 1 1 5 2726 1 1 14 ARG HA H -3.147 -2.296 -2.969 1.00 . A A . 14 ARG HA 1 1 5 2727 1 1 14 ARG HB2 H -5.353 -3.208 -3.522 1.00 . A A . 14 ARG HB2 1 1 5 2728 1 1 14 ARG HB3 H -5.936 -2.794 -1.915 1.00 . A A . 14 ARG HB3 1 1 5 2729 1 1 14 ARG HD2 H -5.642 -0.304 -1.250 1.00 . A A . 14 ARG HD2 1 1 5 2730 1 1 14 ARG HD3 H -6.423 0.713 -2.460 1.00 . A A . 14 ARG HD3 1 1 5 2731 1 1 14 ARG HE H -7.787 -1.767 -1.861 1.00 . A A . 14 ARG HE 1 1 5 2732 1 1 14 ARG HG2 H -4.803 -0.618 -3.584 1.00 . A A . 14 ARG HG2 1 1 5 2733 1 1 14 ARG HG3 H -6.393 -1.256 -4.008 1.00 . A A . 14 ARG HG3 1 1 5 2734 1 1 14 ARG HH11 H -7.456 1.625 -1.150 1.00 . A A . 14 ARG HH11 1 1 5 2735 1 1 14 ARG HH12 H -9.041 1.768 -0.463 1.00 . A A . 14 ARG HH12 1 1 5 2736 1 1 14 ARG HH21 H -9.874 -1.591 -0.959 1.00 . A A . 14 ARG HH21 1 1 5 2737 1 1 14 ARG HH22 H -10.415 -0.062 -0.354 1.00 . A A . 14 ARG HH22 1 1 5 2738 1 1 14 ARG N N -3.500 -3.904 -1.725 1.00 . A A . 14 ARG N 1 1 5 2739 1 1 14 ARG NE N -7.605 -0.819 -1.698 1.00 . A A . 14 ARG NE 1 1 5 2740 1 1 14 ARG NH1 N -8.330 1.211 -0.893 1.00 . A A . 14 ARG NH1 1 1 5 2741 1 1 14 ARG NH2 N -9.707 -0.621 -0.785 1.00 . A A . 14 ARG NH2 1 1 5 2742 1 1 14 ARG O O -3.912 -1.865 0.127 1.00 . A A . 14 ARG O 1 1 5 2743 1 1 15 CYS C C -4.345 1.442 -0.101 1.00 . A A . 15 CYS C 1 1 5 2744 1 1 15 CYS CA C -3.036 0.712 -0.392 1.00 . A A . 15 CYS CA 1 1 5 2745 1 1 15 CYS CB C -1.983 1.707 -0.882 1.00 . A A . 15 CYS CB 1 1 5 2746 1 1 15 CYS H H -3.054 -0.148 -2.326 1.00 . A A . 15 CYS H 1 1 5 2747 1 1 15 CYS HA H -2.686 0.249 0.518 1.00 . A A . 15 CYS HA 1 1 5 2748 1 1 15 CYS HB2 H -1.140 1.161 -1.280 1.00 . A A . 15 CYS HB2 1 1 5 2749 1 1 15 CYS HB3 H -2.411 2.318 -1.663 1.00 . A A . 15 CYS HB3 1 1 5 2750 1 1 15 CYS N N -3.237 -0.339 -1.382 1.00 . A A . 15 CYS N 1 1 5 2751 1 1 15 CYS O O -4.896 2.118 -0.968 1.00 . A A . 15 CYS O 1 1 5 2752 1 1 15 CYS SG S -1.355 2.823 0.414 1.00 . A A . 15 CYS SG 1 1 5 2753 1 1 16 ALA C C -5.891 3.455 1.664 1.00 . A A . 16 ALA C 1 1 5 2754 1 1 16 ALA CA C -6.076 1.946 1.533 1.00 . A A . 16 ALA CA 1 1 5 2755 1 1 16 ALA CB C -6.572 1.358 2.845 1.00 . A A . 16 ALA CB 1 1 5 2756 1 1 16 ALA H H -4.349 0.747 1.774 1.00 . A A . 16 ALA H 1 1 5 2757 1 1 16 ALA HA H -6.819 1.749 0.774 1.00 . A A . 16 ALA HA 1 1 5 2758 1 1 16 ALA HB1 H -7.591 1.021 2.726 1.00 . A A . 16 ALA HB1 1 1 5 2759 1 1 16 ALA HB2 H -5.947 0.522 3.123 1.00 . A A . 16 ALA HB2 1 1 5 2760 1 1 16 ALA HB3 H -6.530 2.112 3.617 1.00 . A A . 16 ALA HB3 1 1 5 2761 1 1 16 ALA N N -4.834 1.300 1.126 1.00 . A A . 16 ALA N 1 1 5 2762 1 1 16 ALA O O -6.858 4.192 1.855 1.00 . A A . 16 ALA O 1 1 5 2763 1 1 17 GLU C C -4.563 6.036 0.338 1.00 . A A . 17 GLU C 1 1 5 2764 1 1 17 GLU CA C -4.336 5.326 1.670 1.00 . A A . 17 GLU CA 1 1 5 2765 1 1 17 GLU CB C -2.888 5.522 2.124 1.00 . A A . 17 GLU CB 1 1 5 2766 1 1 17 GLU CD C -3.544 5.257 4.549 1.00 . A A . 17 GLU CD 1 1 5 2767 1 1 17 GLU CG C -2.572 4.859 3.455 1.00 . A A . 17 GLU CG 1 1 5 2768 1 1 17 GLU H H -3.917 3.267 1.409 1.00 . A A . 17 GLU H 1 1 5 2769 1 1 17 GLU HA H -4.996 5.754 2.409 1.00 . A A . 17 GLU HA 1 1 5 2770 1 1 17 GLU HB2 H -2.229 5.109 1.374 1.00 . A A . 17 GLU HB2 1 1 5 2771 1 1 17 GLU HB3 H -2.693 6.580 2.218 1.00 . A A . 17 GLU HB3 1 1 5 2772 1 1 17 GLU HG2 H -2.616 3.788 3.328 1.00 . A A . 17 GLU HG2 1 1 5 2773 1 1 17 GLU HG3 H -1.576 5.145 3.757 1.00 . A A . 17 GLU HG3 1 1 5 2774 1 1 17 GLU N N -4.645 3.905 1.561 1.00 . A A . 17 GLU N 1 1 5 2775 1 1 17 GLU O O -5.405 6.928 0.233 1.00 . A A . 17 GLU O 1 1 5 2776 1 1 17 GLU OE1 O -3.353 6.335 5.150 1.00 . A A . 17 GLU OE1 1 1 5 2777 1 1 17 GLU OE2 O -4.495 4.489 4.804 1.00 . A A . 17 GLU OE2 1 1 5 2778 1 1 18 CYS C C -4.738 5.336 -2.931 1.00 . A A . 18 CYS C 1 1 5 2779 1 1 18 CYS CA C -3.922 6.230 -2.002 1.00 . A A . 18 CYS CA 1 1 5 2780 1 1 18 CYS CB C -2.534 6.472 -2.599 1.00 . A A . 18 CYS CB 1 1 5 2781 1 1 18 CYS H H -3.151 4.917 -0.531 1.00 . A A . 18 CYS H 1 1 5 2782 1 1 18 CYS HA H -4.429 7.177 -1.897 1.00 . A A . 18 CYS HA 1 1 5 2783 1 1 18 CYS HB2 H -2.643 6.818 -3.616 1.00 . A A . 18 CYS HB2 1 1 5 2784 1 1 18 CYS HB3 H -2.029 7.231 -2.019 1.00 . A A . 18 CYS HB3 1 1 5 2785 1 1 18 CYS N N -3.805 5.633 -0.677 1.00 . A A . 18 CYS N 1 1 5 2786 1 1 18 CYS O O -5.655 5.799 -3.608 1.00 . A A . 18 CYS O 1 1 5 2787 1 1 18 CYS SG S -1.469 4.995 -2.628 1.00 . A A . 18 CYS SG 1 1 5 2788 1 1 19 GLY C C -4.181 2.370 -4.752 1.00 . A A . 19 GLY C 1 1 5 2789 1 1 19 GLY CA C -5.106 3.112 -3.807 1.00 . A A . 19 GLY CA 1 1 5 2790 1 1 19 GLY H H -3.656 3.738 -2.397 1.00 . A A . 19 GLY H 1 1 5 2791 1 1 19 GLY HA2 H -5.618 2.395 -3.183 1.00 . A A . 19 GLY HA2 1 1 5 2792 1 1 19 GLY HA3 H -5.837 3.653 -4.390 1.00 . A A . 19 GLY HA3 1 1 5 2793 1 1 19 GLY N N -4.396 4.051 -2.958 1.00 . A A . 19 GLY N 1 1 5 2794 1 1 19 GLY O O -4.610 1.885 -5.799 1.00 . A A . 19 GLY O 1 1 5 2795 1 1 20 LYS C C -2.063 0.081 -5.076 1.00 . A A . 20 LYS C 1 1 5 2796 1 1 20 LYS CA C -1.919 1.594 -5.203 1.00 . A A . 20 LYS CA 1 1 5 2797 1 1 20 LYS CB C -0.505 2.019 -4.798 1.00 . A A . 20 LYS CB 1 1 5 2798 1 1 20 LYS CD C 1.461 3.525 -5.219 1.00 . A A . 20 LYS CD 1 1 5 2799 1 1 20 LYS CE C 1.943 4.797 -5.900 1.00 . A A . 20 LYS CE 1 1 5 2800 1 1 20 LYS CG C 0.012 3.223 -5.566 1.00 . A A . 20 LYS CG 1 1 5 2801 1 1 20 LYS H H -2.627 2.689 -3.536 1.00 . A A . 20 LYS H 1 1 5 2802 1 1 20 LYS HA H -2.088 1.875 -6.232 1.00 . A A . 20 LYS HA 1 1 5 2803 1 1 20 LYS HB2 H -0.503 2.261 -3.745 1.00 . A A . 20 LYS HB2 1 1 5 2804 1 1 20 LYS HB3 H 0.169 1.192 -4.969 1.00 . A A . 20 LYS HB3 1 1 5 2805 1 1 20 LYS HD2 H 1.548 3.647 -4.150 1.00 . A A . 20 LYS HD2 1 1 5 2806 1 1 20 LYS HD3 H 2.078 2.698 -5.541 1.00 . A A . 20 LYS HD3 1 1 5 2807 1 1 20 LYS HE2 H 1.895 4.658 -6.969 1.00 . A A . 20 LYS HE2 1 1 5 2808 1 1 20 LYS HE3 H 1.294 5.611 -5.613 1.00 . A A . 20 LYS HE3 1 1 5 2809 1 1 20 LYS HG2 H -0.059 3.021 -6.624 1.00 . A A . 20 LYS HG2 1 1 5 2810 1 1 20 LYS HG3 H -0.594 4.083 -5.320 1.00 . A A . 20 LYS HG3 1 1 5 2811 1 1 20 LYS HZ1 H 3.579 4.695 -4.605 1.00 . A A . 20 LYS HZ1 1 1 5 2812 1 1 20 LYS HZ2 H 3.450 6.165 -5.432 1.00 . A A . 20 LYS HZ2 1 1 5 2813 1 1 20 LYS HZ3 H 4.004 4.786 -6.240 1.00 . A A . 20 LYS HZ3 1 1 5 2814 1 1 20 LYS N N -2.908 2.282 -4.382 1.00 . A A . 20 LYS N 1 1 5 2815 1 1 20 LYS NZ N 3.342 5.134 -5.517 1.00 . A A . 20 LYS NZ 1 1 5 2816 1 1 20 LYS O O -2.674 -0.416 -4.131 1.00 . A A . 20 LYS O 1 1 5 2817 1 1 21 ALA C C -0.187 -2.708 -5.744 1.00 . A A . 21 ALA C 1 1 5 2818 1 1 21 ALA CA C -1.557 -2.102 -6.025 1.00 . A A . 21 ALA CA 1 1 5 2819 1 1 21 ALA CB C -2.101 -2.613 -7.351 1.00 . A A . 21 ALA CB 1 1 5 2820 1 1 21 ALA H H -1.021 -0.191 -6.761 1.00 . A A . 21 ALA H 1 1 5 2821 1 1 21 ALA HA H -2.240 -2.402 -5.244 1.00 . A A . 21 ALA HA 1 1 5 2822 1 1 21 ALA HB1 H -3.178 -2.673 -7.299 1.00 . A A . 21 ALA HB1 1 1 5 2823 1 1 21 ALA HB2 H -1.815 -1.935 -8.142 1.00 . A A . 21 ALA HB2 1 1 5 2824 1 1 21 ALA HB3 H -1.695 -3.593 -7.552 1.00 . A A . 21 ALA HB3 1 1 5 2825 1 1 21 ALA N N -1.495 -0.645 -6.033 1.00 . A A . 21 ALA N 1 1 5 2826 1 1 21 ALA O O 0.842 -2.136 -6.103 1.00 . A A . 21 ALA O 1 1 5 2827 1 1 22 PHE C C 0.889 -6.067 -4.841 1.00 . A A . 22 PHE C 1 1 5 2828 1 1 22 PHE CA C 1.064 -4.553 -4.766 1.00 . A A . 22 PHE CA 1 1 5 2829 1 1 22 PHE CB C 1.534 -4.151 -3.367 1.00 . A A . 22 PHE CB 1 1 5 2830 1 1 22 PHE CD1 C 0.962 -1.718 -3.148 1.00 . A A . 22 PHE CD1 1 1 5 2831 1 1 22 PHE CD2 C 3.263 -2.335 -3.268 1.00 . A A . 22 PHE CD2 1 1 5 2832 1 1 22 PHE CE1 C 1.322 -0.387 -3.050 1.00 . A A . 22 PHE CE1 1 1 5 2833 1 1 22 PHE CE2 C 3.628 -1.005 -3.169 1.00 . A A . 22 PHE CE2 1 1 5 2834 1 1 22 PHE CG C 1.928 -2.706 -3.259 1.00 . A A . 22 PHE CG 1 1 5 2835 1 1 22 PHE CZ C 2.656 -0.030 -3.059 1.00 . A A . 22 PHE CZ 1 1 5 2836 1 1 22 PHE H H -1.034 -4.276 -4.837 1.00 . A A . 22 PHE H 1 1 5 2837 1 1 22 PHE HA H 1.808 -4.253 -5.487 1.00 . A A . 22 PHE HA 1 1 5 2838 1 1 22 PHE HB2 H 0.737 -4.331 -2.661 1.00 . A A . 22 PHE HB2 1 1 5 2839 1 1 22 PHE HB3 H 2.390 -4.751 -3.097 1.00 . A A . 22 PHE HB3 1 1 5 2840 1 1 22 PHE HD1 H -0.081 -1.995 -3.140 1.00 . A A . 22 PHE HD1 1 1 5 2841 1 1 22 PHE HD2 H 4.024 -3.097 -3.354 1.00 . A A . 22 PHE HD2 1 1 5 2842 1 1 22 PHE HE1 H 0.560 0.374 -2.963 1.00 . A A . 22 PHE HE1 1 1 5 2843 1 1 22 PHE HE2 H 4.672 -0.730 -3.177 1.00 . A A . 22 PHE HE2 1 1 5 2844 1 1 22 PHE HZ H 2.940 1.009 -2.983 1.00 . A A . 22 PHE HZ 1 1 5 2845 1 1 22 PHE N N -0.181 -3.870 -5.098 1.00 . A A . 22 PHE N 1 1 5 2846 1 1 22 PHE O O -0.100 -6.615 -4.354 1.00 . A A . 22 PHE O 1 1 5 2847 1 1 23 THR C C 2.082 -8.880 -4.264 1.00 . A A . 23 THR C 1 1 5 2848 1 1 23 THR CA C 1.812 -8.189 -5.596 1.00 . A A . 23 THR CA 1 1 5 2849 1 1 23 THR CB C 2.835 -8.686 -6.635 1.00 . A A . 23 THR CB 1 1 5 2850 1 1 23 THR CG2 C 2.549 -8.087 -8.004 1.00 . A A . 23 THR CG2 1 1 5 2851 1 1 23 THR H H 2.621 -6.247 -5.823 1.00 . A A . 23 THR H 1 1 5 2852 1 1 23 THR HA H 0.823 -8.460 -5.937 1.00 . A A . 23 THR HA 1 1 5 2853 1 1 23 THR HB H 2.760 -9.761 -6.706 1.00 . A A . 23 THR HB 1 1 5 2854 1 1 23 THR HG1 H 4.688 -9.132 -6.129 1.00 . A A . 23 THR HG1 1 1 5 2855 1 1 23 THR HG21 H 2.007 -8.804 -8.603 1.00 . A A . 23 THR HG21 1 1 5 2856 1 1 23 THR HG22 H 3.481 -7.843 -8.492 1.00 . A A . 23 THR HG22 1 1 5 2857 1 1 23 THR HG23 H 1.957 -7.192 -7.889 1.00 . A A . 23 THR HG23 1 1 5 2858 1 1 23 THR N N 1.858 -6.739 -5.455 1.00 . A A . 23 THR N 1 1 5 2859 1 1 23 THR O O 1.431 -9.868 -3.923 1.00 . A A . 23 THR O 1 1 5 2860 1 1 23 THR OG1 O 4.161 -8.335 -6.223 1.00 . A A . 23 THR OG1 1 1 5 2861 1 1 24 ASP C C 3.193 -7.897 -1.105 1.00 . A A . 24 ASP C 1 1 5 2862 1 1 24 ASP CA C 3.399 -8.919 -2.218 1.00 . A A . 24 ASP CA 1 1 5 2863 1 1 24 ASP CB C 4.852 -9.396 -2.226 1.00 . A A . 24 ASP CB 1 1 5 2864 1 1 24 ASP CG C 5.072 -10.565 -3.166 1.00 . A A . 24 ASP CG 1 1 5 2865 1 1 24 ASP H H 3.527 -7.565 -3.841 1.00 . A A . 24 ASP H 1 1 5 2866 1 1 24 ASP HA H 2.753 -9.765 -2.037 1.00 . A A . 24 ASP HA 1 1 5 2867 1 1 24 ASP HB2 H 5.490 -8.582 -2.539 1.00 . A A . 24 ASP HB2 1 1 5 2868 1 1 24 ASP HB3 H 5.129 -9.703 -1.228 1.00 . A A . 24 ASP HB3 1 1 5 2869 1 1 24 ASP N N 3.044 -8.354 -3.515 1.00 . A A . 24 ASP N 1 1 5 2870 1 1 24 ASP O O 3.434 -6.704 -1.291 1.00 . A A . 24 ASP O 1 1 5 2871 1 1 24 ASP OD1 O 4.798 -10.414 -4.375 1.00 . A A . 24 ASP OD1 1 1 5 2872 1 1 24 ASP OD2 O 5.517 -11.632 -2.693 1.00 . A A . 24 ASP OD2 1 1 5 2873 1 1 25 ARG C C 3.765 -6.722 1.562 1.00 . A A . 25 ARG C 1 1 5 2874 1 1 25 ARG CA C 2.503 -7.499 1.195 1.00 . A A . 25 ARG CA 1 1 5 2875 1 1 25 ARG CB C 2.027 -8.316 2.397 1.00 . A A . 25 ARG CB 1 1 5 2876 1 1 25 ARG CD C 0.276 -6.927 3.546 1.00 . A A . 25 ARG CD 1 1 5 2877 1 1 25 ARG CG C 1.695 -7.471 3.616 1.00 . A A . 25 ARG CG 1 1 5 2878 1 1 25 ARG CZ C -1.490 -6.227 5.106 1.00 . A A . 25 ARG CZ 1 1 5 2879 1 1 25 ARG H H 2.570 -9.332 0.140 1.00 . A A . 25 ARG H 1 1 5 2880 1 1 25 ARG HA H 1.730 -6.797 0.919 1.00 . A A . 25 ARG HA 1 1 5 2881 1 1 25 ARG HB2 H 1.142 -8.867 2.116 1.00 . A A . 25 ARG HB2 1 1 5 2882 1 1 25 ARG HB3 H 2.803 -9.015 2.672 1.00 . A A . 25 ARG HB3 1 1 5 2883 1 1 25 ARG HD2 H 0.264 -6.074 2.884 1.00 . A A . 25 ARG HD2 1 1 5 2884 1 1 25 ARG HD3 H -0.371 -7.696 3.153 1.00 . A A . 25 ARG HD3 1 1 5 2885 1 1 25 ARG HE H 0.433 -6.451 5.587 1.00 . A A . 25 ARG HE 1 1 5 2886 1 1 25 ARG HG2 H 1.791 -8.080 4.502 1.00 . A A . 25 ARG HG2 1 1 5 2887 1 1 25 ARG HG3 H 2.387 -6.643 3.667 1.00 . A A . 25 ARG HG3 1 1 5 2888 1 1 25 ARG HH11 H -2.115 -6.582 3.219 1.00 . A A . 25 ARG HH11 1 1 5 2889 1 1 25 ARG HH12 H -3.350 -6.088 4.329 1.00 . A A . 25 ARG HH12 1 1 5 2890 1 1 25 ARG HH21 H -1.184 -5.800 7.058 1.00 . A A . 25 ARG HH21 1 1 5 2891 1 1 25 ARG HH22 H -2.819 -5.643 6.512 1.00 . A A . 25 ARG HH22 1 1 5 2892 1 1 25 ARG N N 2.744 -8.372 0.053 1.00 . A A . 25 ARG N 1 1 5 2893 1 1 25 ARG NE N -0.217 -6.515 4.857 1.00 . A A . 25 ARG NE 1 1 5 2894 1 1 25 ARG NH1 N -2.392 -6.305 4.138 1.00 . A A . 25 ARG NH1 1 1 5 2895 1 1 25 ARG NH2 N -1.862 -5.860 6.326 1.00 . A A . 25 ARG NH2 1 1 5 2896 1 1 25 ARG O O 3.743 -5.496 1.665 1.00 . A A . 25 ARG O 1 1 5 2897 1 1 26 SER C C 6.348 -5.535 1.332 1.00 . A A . 26 SER C 1 1 5 2898 1 1 26 SER CA C 6.133 -6.825 2.117 1.00 . A A . 26 SER CA 1 1 5 2899 1 1 26 SER CB C 7.289 -7.793 1.856 1.00 . A A . 26 SER CB 1 1 5 2900 1 1 26 SER H H 4.816 -8.420 1.660 1.00 . A A . 26 SER H 1 1 5 2901 1 1 26 SER HA H 6.101 -6.592 3.170 1.00 . A A . 26 SER HA 1 1 5 2902 1 1 26 SER HB2 H 8.186 -7.411 2.318 1.00 . A A . 26 SER HB2 1 1 5 2903 1 1 26 SER HB3 H 7.049 -8.758 2.278 1.00 . A A . 26 SER HB3 1 1 5 2904 1 1 26 SER HG H 8.195 -8.616 0.327 1.00 . A A . 26 SER HG 1 1 5 2905 1 1 26 SER N N 4.863 -7.446 1.757 1.00 . A A . 26 SER N 1 1 5 2906 1 1 26 SER O O 6.790 -4.527 1.883 1.00 . A A . 26 SER O 1 1 5 2907 1 1 26 SER OG O 7.521 -7.947 0.466 1.00 . A A . 26 SER OG 1 1 5 2908 1 1 27 ASN C C 5.256 -3.282 -0.389 1.00 . A A . 27 ASN C 1 1 5 2909 1 1 27 ASN CA C 6.190 -4.408 -0.820 1.00 . A A . 27 ASN CA 1 1 5 2910 1 1 27 ASN CB C 5.916 -4.784 -2.277 1.00 . A A . 27 ASN CB 1 1 5 2911 1 1 27 ASN CG C 6.933 -5.768 -2.822 1.00 . A A . 27 ASN CG 1 1 5 2912 1 1 27 ASN H H 5.683 -6.406 -0.340 1.00 . A A . 27 ASN H 1 1 5 2913 1 1 27 ASN HA H 7.211 -4.067 -0.731 1.00 . A A . 27 ASN HA 1 1 5 2914 1 1 27 ASN HB2 H 4.936 -5.233 -2.348 1.00 . A A . 27 ASN HB2 1 1 5 2915 1 1 27 ASN HB3 H 5.944 -3.892 -2.885 1.00 . A A . 27 ASN HB3 1 1 5 2916 1 1 27 ASN HD21 H 5.948 -5.870 -4.546 1.00 . A A . 27 ASN HD21 1 1 5 2917 1 1 27 ASN HD22 H 7.373 -6.841 -4.437 1.00 . A A . 27 ASN HD22 1 1 5 2918 1 1 27 ASN N N 6.031 -5.574 0.042 1.00 . A A . 27 ASN N 1 1 5 2919 1 1 27 ASN ND2 N 6.731 -6.204 -4.060 1.00 . A A . 27 ASN ND2 1 1 5 2920 1 1 27 ASN O O 5.685 -2.142 -0.200 1.00 . A A . 27 ASN O 1 1 5 2921 1 1 27 ASN OD1 O 7.890 -6.132 -2.137 1.00 . A A . 27 ASN OD1 1 1 5 2922 1 1 28 LEU C C 3.445 -1.861 1.412 1.00 . A A . 28 LEU C 1 1 5 2923 1 1 28 LEU CA C 2.981 -2.624 0.175 1.00 . A A . 28 LEU CA 1 1 5 2924 1 1 28 LEU CB C 1.644 -3.311 0.458 1.00 . A A . 28 LEU CB 1 1 5 2925 1 1 28 LEU CD1 C 0.182 -1.287 0.225 1.00 . A A . 28 LEU CD1 1 1 5 2926 1 1 28 LEU CD2 C -0.645 -3.286 1.480 1.00 . A A . 28 LEU CD2 1 1 5 2927 1 1 28 LEU CG C 0.574 -2.447 1.128 1.00 . A A . 28 LEU CG 1 1 5 2928 1 1 28 LEU H H 3.696 -4.531 -0.399 1.00 . A A . 28 LEU H 1 1 5 2929 1 1 28 LEU HA H 2.853 -1.924 -0.637 1.00 . A A . 28 LEU HA 1 1 5 2930 1 1 28 LEU HB2 H 1.246 -3.659 -0.483 1.00 . A A . 28 LEU HB2 1 1 5 2931 1 1 28 LEU HB3 H 1.837 -4.157 1.101 1.00 . A A . 28 LEU HB3 1 1 5 2932 1 1 28 LEU HD11 H 0.941 -0.521 0.274 1.00 . A A . 28 LEU HD11 1 1 5 2933 1 1 28 LEU HD12 H -0.763 -0.880 0.552 1.00 . A A . 28 LEU HD12 1 1 5 2934 1 1 28 LEU HD13 H 0.090 -1.639 -0.792 1.00 . A A . 28 LEU HD13 1 1 5 2935 1 1 28 LEU HD21 H -0.327 -4.200 1.959 1.00 . A A . 28 LEU HD21 1 1 5 2936 1 1 28 LEU HD22 H -1.191 -3.523 0.579 1.00 . A A . 28 LEU HD22 1 1 5 2937 1 1 28 LEU HD23 H -1.283 -2.730 2.152 1.00 . A A . 28 LEU HD23 1 1 5 2938 1 1 28 LEU HG H 0.974 -2.036 2.044 1.00 . A A . 28 LEU HG 1 1 5 2939 1 1 28 LEU N N 3.978 -3.608 -0.234 1.00 . A A . 28 LEU N 1 1 5 2940 1 1 28 LEU O O 3.370 -0.633 1.461 1.00 . A A . 28 LEU O 1 1 5 2941 1 1 29 PHE C C 5.483 -0.948 3.358 1.00 . A A . 29 PHE C 1 1 5 2942 1 1 29 PHE CA C 4.406 -1.990 3.645 1.00 . A A . 29 PHE CA 1 1 5 2943 1 1 29 PHE CB C 4.955 -3.064 4.586 1.00 . A A . 29 PHE CB 1 1 5 2944 1 1 29 PHE CD1 C 3.182 -3.015 6.361 1.00 . A A . 29 PHE CD1 1 1 5 2945 1 1 29 PHE CD2 C 3.618 -5.080 5.251 1.00 . A A . 29 PHE CD2 1 1 5 2946 1 1 29 PHE CE1 C 2.207 -3.627 7.125 1.00 . A A . 29 PHE CE1 1 1 5 2947 1 1 29 PHE CE2 C 2.644 -5.698 6.012 1.00 . A A . 29 PHE CE2 1 1 5 2948 1 1 29 PHE CG C 3.897 -3.733 5.416 1.00 . A A . 29 PHE CG 1 1 5 2949 1 1 29 PHE CZ C 1.939 -4.971 6.952 1.00 . A A . 29 PHE CZ 1 1 5 2950 1 1 29 PHE H H 3.962 -3.572 2.310 1.00 . A A . 29 PHE H 1 1 5 2951 1 1 29 PHE HA H 3.568 -1.502 4.119 1.00 . A A . 29 PHE HA 1 1 5 2952 1 1 29 PHE HB2 H 5.449 -3.826 4.002 1.00 . A A . 29 PHE HB2 1 1 5 2953 1 1 29 PHE HB3 H 5.670 -2.612 5.258 1.00 . A A . 29 PHE HB3 1 1 5 2954 1 1 29 PHE HD1 H 3.392 -1.963 6.497 1.00 . A A . 29 PHE HD1 1 1 5 2955 1 1 29 PHE HD2 H 4.169 -5.650 4.518 1.00 . A A . 29 PHE HD2 1 1 5 2956 1 1 29 PHE HE1 H 1.658 -3.056 7.859 1.00 . A A . 29 PHE HE1 1 1 5 2957 1 1 29 PHE HE2 H 2.436 -6.748 5.875 1.00 . A A . 29 PHE HE2 1 1 5 2958 1 1 29 PHE HZ H 1.177 -5.451 7.548 1.00 . A A . 29 PHE HZ 1 1 5 2959 1 1 29 PHE N N 3.927 -2.597 2.408 1.00 . A A . 29 PHE N 1 1 5 2960 1 1 29 PHE O O 5.461 0.154 3.908 1.00 . A A . 29 PHE O 1 1 5 2961 1 1 30 THR C C 6.980 0.907 1.572 1.00 . A A . 30 THR C 1 1 5 2962 1 1 30 THR CA C 7.516 -0.404 2.134 1.00 . A A . 30 THR CA 1 1 5 2963 1 1 30 THR CB C 8.459 -1.046 1.099 1.00 . A A . 30 THR CB 1 1 5 2964 1 1 30 THR CG2 C 9.594 -0.100 0.742 1.00 . A A . 30 THR CG2 1 1 5 2965 1 1 30 THR H H 6.391 -2.197 2.089 1.00 . A A . 30 THR H 1 1 5 2966 1 1 30 THR HA H 8.085 -0.196 3.029 1.00 . A A . 30 THR HA 1 1 5 2967 1 1 30 THR HB H 7.893 -1.261 0.204 1.00 . A A . 30 THR HB 1 1 5 2968 1 1 30 THR HG1 H 8.336 -2.964 1.545 1.00 . A A . 30 THR HG1 1 1 5 2969 1 1 30 THR HG21 H 9.190 0.871 0.497 1.00 . A A . 30 THR HG21 1 1 5 2970 1 1 30 THR HG22 H 10.133 -0.489 -0.109 1.00 . A A . 30 THR HG22 1 1 5 2971 1 1 30 THR HG23 H 10.266 -0.009 1.582 1.00 . A A . 30 THR HG23 1 1 5 2972 1 1 30 THR N N 6.428 -1.305 2.494 1.00 . A A . 30 THR N 1 1 5 2973 1 1 30 THR O O 7.578 1.967 1.763 1.00 . A A . 30 THR O 1 1 5 2974 1 1 30 THR OG1 O 8.995 -2.269 1.618 1.00 . A A . 30 THR OG1 1 1 5 2975 1 1 31 HIS C C 4.452 2.799 1.338 1.00 . A A . 31 HIS C 1 1 5 2976 1 1 31 HIS CA C 5.232 2.013 0.288 1.00 . A A . 31 HIS CA 1 1 5 2977 1 1 31 HIS CB C 4.303 1.612 -0.859 1.00 . A A . 31 HIS CB 1 1 5 2978 1 1 31 HIS CD2 C 2.008 2.817 -0.949 1.00 . A A . 31 HIS CD2 1 1 5 2979 1 1 31 HIS CE1 C 2.597 4.536 -2.176 1.00 . A A . 31 HIS CE1 1 1 5 2980 1 1 31 HIS CG C 3.324 2.679 -1.238 1.00 . A A . 31 HIS CG 1 1 5 2981 1 1 31 HIS H H 5.420 -0.042 0.759 1.00 . A A . 31 HIS H 1 1 5 2982 1 1 31 HIS HA H 6.020 2.639 -0.101 1.00 . A A . 31 HIS HA 1 1 5 2983 1 1 31 HIS HB2 H 4.898 1.383 -1.731 1.00 . A A . 31 HIS HB2 1 1 5 2984 1 1 31 HIS HB3 H 3.744 0.734 -0.570 1.00 . A A . 31 HIS HB3 1 1 5 2985 1 1 31 HIS HD1 H 4.550 3.959 -2.377 1.00 . A A . 31 HIS HD1 1 1 5 2986 1 1 31 HIS HD2 H 1.406 2.139 -0.360 1.00 . A A . 31 HIS HD2 1 1 5 2987 1 1 31 HIS HE1 H 2.563 5.459 -2.735 1.00 . A A . 31 HIS HE1 1 1 5 2988 1 1 31 HIS N N 5.849 0.830 0.878 1.00 . A A . 31 HIS N 1 1 5 2989 1 1 31 HIS ND1 N 3.662 3.771 -2.009 1.00 . A A . 31 HIS ND1 1 1 5 2990 1 1 31 HIS NE2 N 1.580 3.978 -1.543 1.00 . A A . 31 HIS NE2 1 1 5 2991 1 1 31 HIS O O 4.520 4.027 1.382 1.00 . A A . 31 HIS O 1 1 5 2992 1 1 32 GLN C C 3.770 3.681 4.044 1.00 . A A . 32 GLN C 1 1 5 2993 1 1 32 GLN CA C 2.920 2.715 3.226 1.00 . A A . 32 GLN CA 1 1 5 2994 1 1 32 GLN CB C 2.308 1.654 4.142 1.00 . A A . 32 GLN CB 1 1 5 2995 1 1 32 GLN CD C 0.427 0.002 4.478 1.00 . A A . 32 GLN CD 1 1 5 2996 1 1 32 GLN CG C 1.196 0.852 3.486 1.00 . A A . 32 GLN CG 1 1 5 2997 1 1 32 GLN H H 3.700 1.108 2.092 1.00 . A A . 32 GLN H 1 1 5 2998 1 1 32 GLN HA H 2.125 3.269 2.751 1.00 . A A . 32 GLN HA 1 1 5 2999 1 1 32 GLN HB2 H 3.085 0.969 4.448 1.00 . A A . 32 GLN HB2 1 1 5 3000 1 1 32 GLN HB3 H 1.903 2.141 5.017 1.00 . A A . 32 GLN HB3 1 1 5 3001 1 1 32 GLN HE21 H -1.142 -0.048 3.257 1.00 . A A . 32 GLN HE21 1 1 5 3002 1 1 32 GLN HE22 H -1.323 -0.902 4.748 1.00 . A A . 32 GLN HE22 1 1 5 3003 1 1 32 GLN HG2 H 0.507 1.536 3.013 1.00 . A A . 32 GLN HG2 1 1 5 3004 1 1 32 GLN HG3 H 1.629 0.205 2.739 1.00 . A A . 32 GLN HG3 1 1 5 3005 1 1 32 GLN N N 3.713 2.083 2.178 1.00 . A A . 32 GLN N 1 1 5 3006 1 1 32 GLN NE2 N -0.804 -0.351 4.126 1.00 . A A . 32 GLN NE2 1 1 5 3007 1 1 32 GLN O O 3.245 4.539 4.754 1.00 . A A . 32 GLN O 1 1 5 3008 1 1 32 GLN OE1 O 0.933 -0.335 5.549 1.00 . A A . 32 GLN OE1 1 1 5 3009 1 1 33 LYS C C 5.688 5.868 4.433 1.00 . A A . 33 LYS C 1 1 5 3010 1 1 33 LYS CA C 6.011 4.396 4.670 1.00 . A A . 33 LYS CA 1 1 5 3011 1 1 33 LYS CB C 7.453 4.105 4.246 1.00 . A A . 33 LYS CB 1 1 5 3012 1 1 33 LYS CD C 9.537 2.852 4.875 1.00 . A A . 33 LYS CD 1 1 5 3013 1 1 33 LYS CE C 10.124 2.593 3.496 1.00 . A A . 33 LYS CE 1 1 5 3014 1 1 33 LYS CG C 8.018 2.830 4.847 1.00 . A A . 33 LYS CG 1 1 5 3015 1 1 33 LYS H H 5.446 2.834 3.359 1.00 . A A . 33 LYS H 1 1 5 3016 1 1 33 LYS HA H 5.904 4.182 5.723 1.00 . A A . 33 LYS HA 1 1 5 3017 1 1 33 LYS HB2 H 7.489 4.018 3.171 1.00 . A A . 33 LYS HB2 1 1 5 3018 1 1 33 LYS HB3 H 8.079 4.931 4.553 1.00 . A A . 33 LYS HB3 1 1 5 3019 1 1 33 LYS HD2 H 9.868 3.821 5.219 1.00 . A A . 33 LYS HD2 1 1 5 3020 1 1 33 LYS HD3 H 9.887 2.088 5.555 1.00 . A A . 33 LYS HD3 1 1 5 3021 1 1 33 LYS HE2 H 9.795 1.624 3.155 1.00 . A A . 33 LYS HE2 1 1 5 3022 1 1 33 LYS HE3 H 9.765 3.354 2.818 1.00 . A A . 33 LYS HE3 1 1 5 3023 1 1 33 LYS HG2 H 7.652 2.725 5.858 1.00 . A A . 33 LYS HG2 1 1 5 3024 1 1 33 LYS HG3 H 7.690 1.988 4.255 1.00 . A A . 33 LYS HG3 1 1 5 3025 1 1 33 LYS HZ1 H 11.963 2.468 4.479 1.00 . A A . 33 LYS HZ1 1 1 5 3026 1 1 33 LYS HZ2 H 11.955 3.544 3.174 1.00 . A A . 33 LYS HZ2 1 1 5 3027 1 1 33 LYS HZ3 H 11.991 1.876 2.895 1.00 . A A . 33 LYS HZ3 1 1 5 3028 1 1 33 LYS N N 5.087 3.536 3.941 1.00 . A A . 33 LYS N 1 1 5 3029 1 1 33 LYS NZ N 11.612 2.622 3.512 1.00 . A A . 33 LYS NZ 1 1 5 3030 1 1 33 LYS O O 5.649 6.663 5.372 1.00 . A A . 33 LYS O 1 1 5 3031 1 1 34 ILE C C 3.812 8.033 3.440 1.00 . A A . 34 ILE C 1 1 5 3032 1 1 34 ILE CA C 5.133 7.598 2.815 1.00 . A A . 34 ILE CA 1 1 5 3033 1 1 34 ILE CB C 5.049 7.776 1.288 1.00 . A A . 34 ILE CB 1 1 5 3034 1 1 34 ILE CD1 C 3.257 7.632 -0.514 1.00 . A A . 34 ILE CD1 1 1 5 3035 1 1 34 ILE CG1 C 3.852 7.006 0.727 1.00 . A A . 34 ILE CG1 1 1 5 3036 1 1 34 ILE CG2 C 6.339 7.313 0.629 1.00 . A A . 34 ILE CG2 1 1 5 3037 1 1 34 ILE H H 5.501 5.543 2.470 1.00 . A A . 34 ILE H 1 1 5 3038 1 1 34 ILE HA H 5.922 8.234 3.189 1.00 . A A . 34 ILE HA 1 1 5 3039 1 1 34 ILE HB H 4.922 8.827 1.077 1.00 . A A . 34 ILE HB 1 1 5 3040 1 1 34 ILE HD11 H 2.566 8.413 -0.228 1.00 . A A . 34 ILE HD11 1 1 5 3041 1 1 34 ILE HD12 H 4.046 8.056 -1.118 1.00 . A A . 34 ILE HD12 1 1 5 3042 1 1 34 ILE HD13 H 2.733 6.879 -1.083 1.00 . A A . 34 ILE HD13 1 1 5 3043 1 1 34 ILE HG12 H 4.162 6.004 0.476 1.00 . A A . 34 ILE HG12 1 1 5 3044 1 1 34 ILE HG13 H 3.078 6.960 1.480 1.00 . A A . 34 ILE HG13 1 1 5 3045 1 1 34 ILE HG21 H 6.882 6.675 1.310 1.00 . A A . 34 ILE HG21 1 1 5 3046 1 1 34 ILE HG22 H 6.106 6.763 -0.271 1.00 . A A . 34 ILE HG22 1 1 5 3047 1 1 34 ILE HG23 H 6.945 8.172 0.380 1.00 . A A . 34 ILE HG23 1 1 5 3048 1 1 34 ILE N N 5.455 6.222 3.174 1.00 . A A . 34 ILE N 1 1 5 3049 1 1 34 ILE O O 3.476 9.218 3.446 1.00 . A A . 34 ILE O 1 1 5 3050 1 1 35 HIS C C 1.924 7.417 6.116 1.00 . A A . 35 HIS C 1 1 5 3051 1 1 35 HIS CA C 1.782 7.351 4.598 1.00 . A A . 35 HIS CA 1 1 5 3052 1 1 35 HIS CB C 0.755 6.284 4.217 1.00 . A A . 35 HIS CB 1 1 5 3053 1 1 35 HIS CD2 C 0.339 5.484 1.785 1.00 . A A . 35 HIS CD2 1 1 5 3054 1 1 35 HIS CE1 C -0.609 7.301 1.007 1.00 . A A . 35 HIS CE1 1 1 5 3055 1 1 35 HIS CG C 0.290 6.382 2.797 1.00 . A A . 35 HIS CG 1 1 5 3056 1 1 35 HIS H H 3.387 6.143 3.933 1.00 . A A . 35 HIS H 1 1 5 3057 1 1 35 HIS HA H 1.441 8.311 4.239 1.00 . A A . 35 HIS HA 1 1 5 3058 1 1 35 HIS HB2 H 1.194 5.307 4.355 1.00 . A A . 35 HIS HB2 1 1 5 3059 1 1 35 HIS HB3 H -0.109 6.380 4.858 1.00 . A A . 35 HIS HB3 1 1 5 3060 1 1 35 HIS HD1 H -0.488 8.340 2.766 1.00 . A A . 35 HIS HD1 1 1 5 3061 1 1 35 HIS HD2 H 0.746 4.484 1.834 1.00 . A A . 35 HIS HD2 1 1 5 3062 1 1 35 HIS HE1 H -1.086 8.009 0.346 1.00 . A A . 35 HIS HE1 1 1 5 3063 1 1 35 HIS N N 3.066 7.068 3.968 1.00 . A A . 35 HIS N 1 1 5 3064 1 1 35 HIS ND1 N -0.309 7.510 2.277 1.00 . A A . 35 HIS ND1 1 1 5 3065 1 1 35 HIS NE2 N -0.226 6.079 0.684 1.00 . A A . 35 HIS NE2 1 1 5 3066 1 1 35 HIS O O 1.449 8.357 6.755 1.00 . A A . 35 HIS O 1 1 5 3067 1 1 36 THR C C 4.082 7.048 8.530 1.00 . A A . 36 THR C 1 1 5 3068 1 1 36 THR CA C 2.784 6.356 8.130 1.00 . A A . 36 THR CA 1 1 5 3069 1 1 36 THR CB C 2.815 4.901 8.636 1.00 . A A . 36 THR CB 1 1 5 3070 1 1 36 THR CG2 C 4.204 4.301 8.475 1.00 . A A . 36 THR CG2 1 1 5 3071 1 1 36 THR H H 2.936 5.694 6.125 1.00 . A A . 36 THR H 1 1 5 3072 1 1 36 THR HA H 1.956 6.862 8.604 1.00 . A A . 36 THR HA 1 1 5 3073 1 1 36 THR HB H 2.118 4.318 8.051 1.00 . A A . 36 THR HB 1 1 5 3074 1 1 36 THR HG1 H 1.789 5.550 10.190 1.00 . A A . 36 THR HG1 1 1 5 3075 1 1 36 THR HG21 H 4.524 4.405 7.450 1.00 . A A . 36 THR HG21 1 1 5 3076 1 1 36 THR HG22 H 4.177 3.255 8.739 1.00 . A A . 36 THR HG22 1 1 5 3077 1 1 36 THR HG23 H 4.896 4.819 9.123 1.00 . A A . 36 THR HG23 1 1 5 3078 1 1 36 THR N N 2.581 6.413 6.688 1.00 . A A . 36 THR N 1 1 5 3079 1 1 36 THR O O 5.156 6.712 8.033 1.00 . A A . 36 THR O 1 1 5 3080 1 1 36 THR OG1 O 2.425 4.853 10.013 1.00 . A A . 36 THR OG1 1 1 5 3081 1 1 37 GLY C C 4.961 10.245 9.828 1.00 . A A . 37 GLY C 1 1 5 3082 1 1 37 GLY CA C 5.150 8.742 9.886 1.00 . A A . 37 GLY CA 1 1 5 3083 1 1 37 GLY H H 3.094 8.243 9.796 1.00 . A A . 37 GLY H 1 1 5 3084 1 1 37 GLY HA2 H 5.366 8.456 10.904 1.00 . A A . 37 GLY HA2 1 1 5 3085 1 1 37 GLY HA3 H 5.988 8.472 9.261 1.00 . A A . 37 GLY HA3 1 1 5 3086 1 1 37 GLY N N 3.976 8.018 9.434 1.00 . A A . 37 GLY N 1 1 5 3087 1 1 37 GLY O O 3.858 10.729 9.576 1.00 . A A . 37 GLY O 1 1 5 3088 1 1 38 GLU C C 7.146 13.016 9.231 1.00 . A A . 38 GLU C 1 1 5 3089 1 1 38 GLU CA C 5.987 12.442 10.041 1.00 . A A . 38 GLU CA 1 1 5 3090 1 1 38 GLU CB C 6.021 12.999 11.465 1.00 . A A . 38 GLU CB 1 1 5 3091 1 1 38 GLU CD C 4.906 13.041 13.732 1.00 . A A . 38 GLU CD 1 1 5 3092 1 1 38 GLU CG C 4.754 12.723 12.257 1.00 . A A . 38 GLU CG 1 1 5 3093 1 1 38 GLU H H 6.891 10.541 10.260 1.00 . A A . 38 GLU H 1 1 5 3094 1 1 38 GLU HA H 5.058 12.732 9.573 1.00 . A A . 38 GLU HA 1 1 5 3095 1 1 38 GLU HB2 H 6.854 12.557 11.992 1.00 . A A . 38 GLU HB2 1 1 5 3096 1 1 38 GLU HB3 H 6.164 14.069 11.417 1.00 . A A . 38 GLU HB3 1 1 5 3097 1 1 38 GLU HG2 H 3.954 13.327 11.855 1.00 . A A . 38 GLU HG2 1 1 5 3098 1 1 38 GLU HG3 H 4.500 11.678 12.154 1.00 . A A . 38 GLU HG3 1 1 5 3099 1 1 38 GLU N N 6.040 10.985 10.065 1.00 . A A . 38 GLU N 1 1 5 3100 1 1 38 GLU O O 8.294 12.601 9.389 1.00 . A A . 38 GLU O 1 1 5 3101 1 1 38 GLU OE1 O 5.741 13.908 14.068 1.00 . A A . 38 GLU OE1 1 1 5 3102 1 1 38 GLU OE2 O 4.192 12.424 14.550 1.00 . A A . 38 GLU OE2 1 1 5 3103 1 1 39 LYS C C 8.121 16.033 7.987 1.00 . A A . 39 LYS C 1 1 5 3104 1 1 39 LYS CA C 7.850 14.605 7.527 1.00 . A A . 39 LYS CA 1 1 5 3105 1 1 39 LYS CB C 7.406 14.605 6.062 1.00 . A A . 39 LYS CB 1 1 5 3106 1 1 39 LYS CD C 8.386 12.605 4.900 1.00 . A A . 39 LYS CD 1 1 5 3107 1 1 39 LYS CE C 9.180 11.820 5.932 1.00 . A A . 39 LYS CE 1 1 5 3108 1 1 39 LYS CG C 7.135 13.217 5.508 1.00 . A A . 39 LYS CG 1 1 5 3109 1 1 39 LYS H H 5.903 14.260 8.281 1.00 . A A . 39 LYS H 1 1 5 3110 1 1 39 LYS HA H 8.761 14.031 7.618 1.00 . A A . 39 LYS HA 1 1 5 3111 1 1 39 LYS HB2 H 6.502 15.189 5.973 1.00 . A A . 39 LYS HB2 1 1 5 3112 1 1 39 LYS HB3 H 8.181 15.063 5.464 1.00 . A A . 39 LYS HB3 1 1 5 3113 1 1 39 LYS HD2 H 8.098 11.939 4.100 1.00 . A A . 39 LYS HD2 1 1 5 3114 1 1 39 LYS HD3 H 9.008 13.396 4.505 1.00 . A A . 39 LYS HD3 1 1 5 3115 1 1 39 LYS HE2 H 9.965 11.278 5.426 1.00 . A A . 39 LYS HE2 1 1 5 3116 1 1 39 LYS HE3 H 9.617 12.513 6.635 1.00 . A A . 39 LYS HE3 1 1 5 3117 1 1 39 LYS HG2 H 6.789 12.581 6.309 1.00 . A A . 39 LYS HG2 1 1 5 3118 1 1 39 LYS HG3 H 6.372 13.286 4.746 1.00 . A A . 39 LYS HG3 1 1 5 3119 1 1 39 LYS HZ1 H 7.758 11.353 7.389 1.00 . A A . 39 LYS HZ1 1 1 5 3120 1 1 39 LYS HZ2 H 8.916 10.143 7.149 1.00 . A A . 39 LYS HZ2 1 1 5 3121 1 1 39 LYS HZ3 H 7.681 10.367 6.016 1.00 . A A . 39 LYS HZ3 1 1 5 3122 1 1 39 LYS N N 6.837 13.972 8.362 1.00 . A A . 39 LYS N 1 1 5 3123 1 1 39 LYS NZ N 8.324 10.853 6.673 1.00 . A A . 39 LYS NZ 1 1 5 3124 1 1 39 LYS O O 7.221 16.751 8.425 1.00 . A A . 39 LYS O 1 1 5 3125 1 1 40 PRO C C 9.267 18.882 7.348 1.00 . A A . 40 PRO C 1 1 5 3126 1 1 40 PRO CA C 9.806 17.806 8.285 1.00 . A A . 40 PRO CA 1 1 5 3127 1 1 40 PRO CB C 11.333 17.743 8.204 1.00 . A A . 40 PRO CB 1 1 5 3128 1 1 40 PRO CD C 10.513 15.658 7.373 1.00 . A A . 40 PRO CD 1 1 5 3129 1 1 40 PRO CG C 11.616 16.667 7.214 1.00 . A A . 40 PRO CG 1 1 5 3130 1 1 40 PRO HA H 9.507 18.030 9.299 1.00 . A A . 40 PRO HA 1 1 5 3131 1 1 40 PRO HB2 H 11.719 18.697 7.873 1.00 . A A . 40 PRO HB2 1 1 5 3132 1 1 40 PRO HB3 H 11.739 17.502 9.175 1.00 . A A . 40 PRO HB3 1 1 5 3133 1 1 40 PRO HD2 H 10.267 15.214 6.419 1.00 . A A . 40 PRO HD2 1 1 5 3134 1 1 40 PRO HD3 H 10.798 14.895 8.083 1.00 . A A . 40 PRO HD3 1 1 5 3135 1 1 40 PRO HG2 H 11.609 17.076 6.215 1.00 . A A . 40 PRO HG2 1 1 5 3136 1 1 40 PRO HG3 H 12.572 16.213 7.428 1.00 . A A . 40 PRO HG3 1 1 5 3137 1 1 40 PRO N N 9.389 16.459 7.886 1.00 . A A . 40 PRO N 1 1 5 3138 1 1 40 PRO O O 9.692 18.986 6.198 1.00 . A A . 40 PRO O 1 1 5 3139 1 1 41 SER C C 8.801 21.537 6.310 1.00 . A A . 41 SER C 1 1 5 3140 1 1 41 SER CA C 7.730 20.746 7.055 1.00 . A A . 41 SER CA 1 1 5 3141 1 1 41 SER CB C 6.918 21.683 7.951 1.00 . A A . 41 SER CB 1 1 5 3142 1 1 41 SER H H 8.032 19.547 8.773 1.00 . A A . 41 SER H 1 1 5 3143 1 1 41 SER HA H 7.069 20.290 6.333 1.00 . A A . 41 SER HA 1 1 5 3144 1 1 41 SER HB2 H 6.282 21.098 8.597 1.00 . A A . 41 SER HB2 1 1 5 3145 1 1 41 SER HB3 H 7.593 22.277 8.551 1.00 . A A . 41 SER HB3 1 1 5 3146 1 1 41 SER HG H 5.516 22.036 6.629 1.00 . A A . 41 SER HG 1 1 5 3147 1 1 41 SER N N 8.330 19.680 7.849 1.00 . A A . 41 SER N 1 1 5 3148 1 1 41 SER O O 8.851 21.532 5.081 1.00 . A A . 41 SER O 1 1 5 3149 1 1 41 SER OG O 6.109 22.553 7.178 1.00 . A A . 41 SER OG 1 1 5 3150 1 1 42 GLY C C 11.667 23.586 7.491 1.00 . A A . 42 GLY C 1 1 5 3151 1 1 42 GLY CA C 10.717 23.005 6.462 1.00 . A A . 42 GLY CA 1 1 5 3152 1 1 42 GLY H H 9.569 22.186 8.042 1.00 . A A . 42 GLY H 1 1 5 3153 1 1 42 GLY HA2 H 11.276 22.377 5.784 1.00 . A A . 42 GLY HA2 1 1 5 3154 1 1 42 GLY HA3 H 10.273 23.816 5.902 1.00 . A A . 42 GLY HA3 1 1 5 3155 1 1 42 GLY N N 9.658 22.218 7.066 1.00 . A A . 42 GLY N 1 1 5 3156 1 1 42 GLY O O 11.274 23.928 8.606 1.00 . A A . 42 GLY O 1 1 5 3157 1 1 43 PRO C C 13.818 25.739 8.243 1.00 . A A . 43 PRO C 1 1 5 3158 1 1 43 PRO CA C 13.986 24.243 8.003 1.00 . A A . 43 PRO CA 1 1 5 3159 1 1 43 PRO CB C 15.284 23.966 7.240 1.00 . A A . 43 PRO CB 1 1 5 3160 1 1 43 PRO CD C 13.488 23.314 5.803 1.00 . A A . 43 PRO CD 1 1 5 3161 1 1 43 PRO CG C 14.875 23.895 5.809 1.00 . A A . 43 PRO CG 1 1 5 3162 1 1 43 PRO HA H 14.006 23.727 8.951 1.00 . A A . 43 PRO HA 1 1 5 3163 1 1 43 PRO HB2 H 15.984 24.771 7.413 1.00 . A A . 43 PRO HB2 1 1 5 3164 1 1 43 PRO HB3 H 15.710 23.033 7.575 1.00 . A A . 43 PRO HB3 1 1 5 3165 1 1 43 PRO HD2 H 12.903 23.744 5.004 1.00 . A A . 43 PRO HD2 1 1 5 3166 1 1 43 PRO HD3 H 13.530 22.239 5.706 1.00 . A A . 43 PRO HD3 1 1 5 3167 1 1 43 PRO HG2 H 14.869 24.885 5.380 1.00 . A A . 43 PRO HG2 1 1 5 3168 1 1 43 PRO HG3 H 15.553 23.253 5.266 1.00 . A A . 43 PRO HG3 1 1 5 3169 1 1 43 PRO N N 12.950 23.702 7.118 1.00 . A A . 43 PRO N 1 1 5 3170 1 1 43 PRO O O 14.598 26.352 8.973 1.00 . A A . 43 PRO O 1 1 5 3171 1 1 44 SER C C 11.126 27.985 8.324 1.00 . A A . 44 SER C 1 1 5 3172 1 1 44 SER CA C 12.528 27.749 7.771 1.00 . A A . 44 SER CA 1 1 5 3173 1 1 44 SER CB C 12.683 28.458 6.424 1.00 . A A . 44 SER CB 1 1 5 3174 1 1 44 SER H H 12.209 25.781 7.057 1.00 . A A . 44 SER H 1 1 5 3175 1 1 44 SER HA H 13.250 28.153 8.465 1.00 . A A . 44 SER HA 1 1 5 3176 1 1 44 SER HB2 H 12.747 29.523 6.586 1.00 . A A . 44 SER HB2 1 1 5 3177 1 1 44 SER HB3 H 13.585 28.112 5.940 1.00 . A A . 44 SER HB3 1 1 5 3178 1 1 44 SER HG H 11.367 28.977 5.069 1.00 . A A . 44 SER HG 1 1 5 3179 1 1 44 SER N N 12.796 26.323 7.626 1.00 . A A . 44 SER N 1 1 5 3180 1 1 44 SER O O 10.365 27.042 8.540 1.00 . A A . 44 SER O 1 1 5 3181 1 1 44 SER OG O 11.578 28.191 5.577 1.00 . A A . 44 SER OG 1 1 5 3182 1 1 45 SER C C 9.082 31.014 8.634 1.00 . A A . 45 SER C 1 1 5 3183 1 1 45 SER CA C 9.484 29.613 9.085 1.00 . A A . 45 SER CA 1 1 5 3184 1 1 45 SER CB C 9.494 29.539 10.613 1.00 . A A . 45 SER CB 1 1 5 3185 1 1 45 SER H H 11.443 29.959 8.360 1.00 . A A . 45 SER H 1 1 5 3186 1 1 45 SER HA H 8.764 28.905 8.703 1.00 . A A . 45 SER HA 1 1 5 3187 1 1 45 SER HB2 H 10.335 30.099 10.993 1.00 . A A . 45 SER HB2 1 1 5 3188 1 1 45 SER HB3 H 8.576 29.962 10.997 1.00 . A A . 45 SER HB3 1 1 5 3189 1 1 45 SER HG H 9.640 28.181 12.017 1.00 . A A . 45 SER HG 1 1 5 3190 1 1 45 SER N N 10.792 29.251 8.552 1.00 . A A . 45 SER N 1 1 5 3191 1 1 45 SER O O 9.714 32.002 9.006 1.00 . A A . 45 SER O 1 1 5 3192 1 1 45 SER OG O 9.599 28.198 11.058 1.00 . A A . 45 SER OG 1 1 5 3193 1 1 46 GLY C C 6.655 32.239 6.132 1.00 . A A . 46 GLY C 1 1 5 3194 1 1 46 GLY CA C 7.558 32.374 7.342 1.00 . A A . 46 GLY CA 1 1 5 3195 1 1 46 GLY H H 7.561 30.269 7.567 1.00 . A A . 46 GLY H 1 1 5 3196 1 1 46 GLY HA2 H 7.013 32.871 8.131 1.00 . A A . 46 GLY HA2 1 1 5 3197 1 1 46 GLY HA3 H 8.412 32.978 7.073 1.00 . A A . 46 GLY HA3 1 1 5 3198 1 1 46 GLY N N 8.026 31.091 7.830 1.00 . A A . 46 GLY N 1 1 5 3199 1 1 46 GLY O O 6.881 31.351 5.312 1.00 . A A . 46 GLY O 1 1 5 3200 2 2 1 ZN ZN ZN -0.250 4.553 -0.749 1.00 . B A . 201 ZN ZN 1 1 6 3201 1 1 1 GLY C C -13.275 9.984 -19.790 1.00 . A A . 1 GLY C 1 1 6 3202 1 1 1 GLY CA C -13.503 11.470 -19.984 1.00 . A A . 1 GLY CA 1 1 6 3203 1 1 1 GLY H1 H -15.286 11.279 -21.110 1.00 . A A . 1 GLY H1 1 1 6 3204 1 1 1 GLY HA2 H -12.831 11.830 -20.748 1.00 . A A . 1 GLY HA2 1 1 6 3205 1 1 1 GLY HA3 H -13.285 11.980 -19.057 1.00 . A A . 1 GLY HA3 1 1 6 3206 1 1 1 GLY N N -14.866 11.776 -20.377 1.00 . A A . 1 GLY N 1 1 6 3207 1 1 1 GLY O O -13.816 9.383 -18.862 1.00 . A A . 1 GLY O 1 1 6 3208 1 1 2 SER C C -10.878 7.638 -21.317 1.00 . A A . 2 SER C 1 1 6 3209 1 1 2 SER CA C -12.180 7.964 -20.592 1.00 . A A . 2 SER CA 1 1 6 3210 1 1 2 SER CB C -13.329 7.152 -21.193 1.00 . A A . 2 SER CB 1 1 6 3211 1 1 2 SER H H -12.073 9.924 -21.386 1.00 . A A . 2 SER H 1 1 6 3212 1 1 2 SER HA H -12.073 7.703 -19.549 1.00 . A A . 2 SER HA 1 1 6 3213 1 1 2 SER HB2 H -13.144 6.100 -21.036 1.00 . A A . 2 SER HB2 1 1 6 3214 1 1 2 SER HB3 H -14.254 7.431 -20.709 1.00 . A A . 2 SER HB3 1 1 6 3215 1 1 2 SER HG H -12.583 7.574 -22.954 1.00 . A A . 2 SER HG 1 1 6 3216 1 1 2 SER N N -12.474 9.390 -20.668 1.00 . A A . 2 SER N 1 1 6 3217 1 1 2 SER O O -10.592 8.189 -22.380 1.00 . A A . 2 SER O 1 1 6 3218 1 1 2 SER OG O -13.450 7.392 -22.584 1.00 . A A . 2 SER OG 1 1 6 3219 1 1 3 SER C C -8.610 4.833 -21.199 1.00 . A A . 3 SER C 1 1 6 3220 1 1 3 SER CA C -8.819 6.339 -21.323 1.00 . A A . 3 SER CA 1 1 6 3221 1 1 3 SER CB C -7.666 7.083 -20.646 1.00 . A A . 3 SER CB 1 1 6 3222 1 1 3 SER H H -10.376 6.333 -19.888 1.00 . A A . 3 SER H 1 1 6 3223 1 1 3 SER HA H -8.841 6.603 -22.370 1.00 . A A . 3 SER HA 1 1 6 3224 1 1 3 SER HB2 H -6.728 6.697 -21.013 1.00 . A A . 3 SER HB2 1 1 6 3225 1 1 3 SER HB3 H -7.738 8.137 -20.875 1.00 . A A . 3 SER HB3 1 1 6 3226 1 1 3 SER HG H -7.242 6.115 -18.996 1.00 . A A . 3 SER HG 1 1 6 3227 1 1 3 SER N N -10.093 6.737 -20.735 1.00 . A A . 3 SER N 1 1 6 3228 1 1 3 SER O O -9.321 4.156 -20.458 1.00 . A A . 3 SER O 1 1 6 3229 1 1 3 SER OG O -7.709 6.918 -19.239 1.00 . A A . 3 SER OG 1 1 6 3230 1 1 4 GLY C C -6.596 2.489 -20.633 1.00 . A A . 4 GLY C 1 1 6 3231 1 1 4 GLY CA C -7.342 2.893 -21.889 1.00 . A A . 4 GLY CA 1 1 6 3232 1 1 4 GLY H H -7.094 4.904 -22.504 1.00 . A A . 4 GLY H 1 1 6 3233 1 1 4 GLY HA2 H -8.274 2.349 -21.934 1.00 . A A . 4 GLY HA2 1 1 6 3234 1 1 4 GLY HA3 H -6.743 2.633 -22.749 1.00 . A A . 4 GLY HA3 1 1 6 3235 1 1 4 GLY N N -7.628 4.316 -21.931 1.00 . A A . 4 GLY N 1 1 6 3236 1 1 4 GLY O O -5.383 2.282 -20.663 1.00 . A A . 4 GLY O 1 1 6 3237 1 1 5 SER C C -7.014 0.538 -17.925 1.00 . A A . 5 SER C 1 1 6 3238 1 1 5 SER CA C -6.721 1.999 -18.252 1.00 . A A . 5 SER CA 1 1 6 3239 1 1 5 SER CB C -7.243 2.899 -17.131 1.00 . A A . 5 SER CB 1 1 6 3240 1 1 5 SER H H -8.286 2.554 -19.566 1.00 . A A . 5 SER H 1 1 6 3241 1 1 5 SER HA H -5.653 2.129 -18.339 1.00 . A A . 5 SER HA 1 1 6 3242 1 1 5 SER HB2 H -6.820 2.580 -16.190 1.00 . A A . 5 SER HB2 1 1 6 3243 1 1 5 SER HB3 H -6.952 3.921 -17.328 1.00 . A A . 5 SER HB3 1 1 6 3244 1 1 5 SER HG H -9.036 3.642 -17.395 1.00 . A A . 5 SER HG 1 1 6 3245 1 1 5 SER N N -7.323 2.376 -19.526 1.00 . A A . 5 SER N 1 1 6 3246 1 1 5 SER O O -8.096 0.202 -17.445 1.00 . A A . 5 SER O 1 1 6 3247 1 1 5 SER OG O -8.656 2.835 -17.041 1.00 . A A . 5 SER OG 1 1 6 3248 1 1 6 SER C C -5.228 -2.213 -16.838 1.00 . A A . 6 SER C 1 1 6 3249 1 1 6 SER CA C -6.193 -1.754 -17.927 1.00 . A A . 6 SER CA 1 1 6 3250 1 1 6 SER CB C -5.956 -2.558 -19.206 1.00 . A A . 6 SER CB 1 1 6 3251 1 1 6 SER H H -5.200 0.001 -18.572 1.00 . A A . 6 SER H 1 1 6 3252 1 1 6 SER HA H -7.205 -1.922 -17.588 1.00 . A A . 6 SER HA 1 1 6 3253 1 1 6 SER HB2 H -6.576 -2.163 -19.997 1.00 . A A . 6 SER HB2 1 1 6 3254 1 1 6 SER HB3 H -4.917 -2.479 -19.490 1.00 . A A . 6 SER HB3 1 1 6 3255 1 1 6 SER HG H -6.140 -4.161 -18.096 1.00 . A A . 6 SER HG 1 1 6 3256 1 1 6 SER N N -6.040 -0.328 -18.189 1.00 . A A . 6 SER N 1 1 6 3257 1 1 6 SER O O -4.042 -1.887 -16.867 1.00 . A A . 6 SER O 1 1 6 3258 1 1 6 SER OG O -6.276 -3.925 -19.016 1.00 . A A . 6 SER OG 1 1 6 3259 1 1 7 GLY C C -4.980 -2.577 -13.567 1.00 . A A . 7 GLY C 1 1 6 3260 1 1 7 GLY CA C -4.917 -3.465 -14.793 1.00 . A A . 7 GLY CA 1 1 6 3261 1 1 7 GLY H H -6.698 -3.202 -15.907 1.00 . A A . 7 GLY H 1 1 6 3262 1 1 7 GLY HA2 H -5.247 -4.457 -14.524 1.00 . A A . 7 GLY HA2 1 1 6 3263 1 1 7 GLY HA3 H -3.893 -3.518 -15.133 1.00 . A A . 7 GLY HA3 1 1 6 3264 1 1 7 GLY N N -5.746 -2.973 -15.878 1.00 . A A . 7 GLY N 1 1 6 3265 1 1 7 GLY O O -3.955 -2.278 -12.953 1.00 . A A . 7 GLY O 1 1 6 3266 1 1 8 THR C C -7.163 -2.005 -10.955 1.00 . A A . 8 THR C 1 1 6 3267 1 1 8 THR CA C -6.379 -1.289 -12.049 1.00 . A A . 8 THR CA 1 1 6 3268 1 1 8 THR CB C -7.120 0.008 -12.429 1.00 . A A . 8 THR CB 1 1 6 3269 1 1 8 THR CG2 C -8.535 -0.295 -12.898 1.00 . A A . 8 THR CG2 1 1 6 3270 1 1 8 THR H H -6.965 -2.423 -13.737 1.00 . A A . 8 THR H 1 1 6 3271 1 1 8 THR HA H -5.405 -1.023 -11.665 1.00 . A A . 8 THR HA 1 1 6 3272 1 1 8 THR HB H -6.584 0.487 -13.236 1.00 . A A . 8 THR HB 1 1 6 3273 1 1 8 THR HG1 H -7.191 1.803 -11.616 1.00 . A A . 8 THR HG1 1 1 6 3274 1 1 8 THR HG21 H -8.624 -0.057 -13.948 1.00 . A A . 8 THR HG21 1 1 6 3275 1 1 8 THR HG22 H -9.237 0.300 -12.333 1.00 . A A . 8 THR HG22 1 1 6 3276 1 1 8 THR HG23 H -8.747 -1.343 -12.747 1.00 . A A . 8 THR HG23 1 1 6 3277 1 1 8 THR N N -6.187 -2.151 -13.208 1.00 . A A . 8 THR N 1 1 6 3278 1 1 8 THR O O -8.029 -1.415 -10.310 1.00 . A A . 8 THR O 1 1 6 3279 1 1 8 THR OG1 O -7.164 0.895 -11.306 1.00 . A A . 8 THR OG1 1 1 6 3280 1 1 9 GLY C C -7.304 -5.547 -9.884 1.00 . A A . 9 GLY C 1 1 6 3281 1 1 9 GLY CA C -7.536 -4.057 -9.731 1.00 . A A . 9 GLY CA 1 1 6 3282 1 1 9 GLY H H -6.152 -3.700 -11.293 1.00 . A A . 9 GLY H 1 1 6 3283 1 1 9 GLY HA2 H -7.183 -3.746 -8.759 1.00 . A A . 9 GLY HA2 1 1 6 3284 1 1 9 GLY HA3 H -8.596 -3.861 -9.798 1.00 . A A . 9 GLY HA3 1 1 6 3285 1 1 9 GLY N N -6.852 -3.281 -10.749 1.00 . A A . 9 GLY N 1 1 6 3286 1 1 9 GLY O O -8.248 -6.335 -9.851 1.00 . A A . 9 GLY O 1 1 6 3287 1 1 10 GLU C C -4.821 -7.820 -9.057 1.00 . A A . 10 GLU C 1 1 6 3288 1 1 10 GLU CA C -5.691 -7.340 -10.216 1.00 . A A . 10 GLU CA 1 1 6 3289 1 1 10 GLU CB C -4.959 -7.556 -11.542 1.00 . A A . 10 GLU CB 1 1 6 3290 1 1 10 GLU CD C -3.778 -9.181 -13.073 1.00 . A A . 10 GLU CD 1 1 6 3291 1 1 10 GLU CG C -4.578 -9.005 -11.797 1.00 . A A . 10 GLU CG 1 1 6 3292 1 1 10 GLU H H -5.333 -5.258 -10.072 1.00 . A A . 10 GLU H 1 1 6 3293 1 1 10 GLU HA H -6.607 -7.912 -10.223 1.00 . A A . 10 GLU HA 1 1 6 3294 1 1 10 GLU HB2 H -5.596 -7.225 -12.349 1.00 . A A . 10 GLU HB2 1 1 6 3295 1 1 10 GLU HB3 H -4.056 -6.964 -11.541 1.00 . A A . 10 GLU HB3 1 1 6 3296 1 1 10 GLU HG2 H -3.986 -9.360 -10.967 1.00 . A A . 10 GLU HG2 1 1 6 3297 1 1 10 GLU HG3 H -5.481 -9.594 -11.871 1.00 . A A . 10 GLU HG3 1 1 6 3298 1 1 10 GLU N N -6.043 -5.934 -10.054 1.00 . A A . 10 GLU N 1 1 6 3299 1 1 10 GLU O O -4.885 -8.982 -8.657 1.00 . A A . 10 GLU O 1 1 6 3300 1 1 10 GLU OE1 O -4.290 -8.808 -14.150 1.00 . A A . 10 GLU OE1 1 1 6 3301 1 1 10 GLU OE2 O -2.641 -9.692 -12.995 1.00 . A A . 10 GLU OE2 1 1 6 3302 1 1 11 LYS C C -3.926 -7.577 -6.158 1.00 . A A . 11 LYS C 1 1 6 3303 1 1 11 LYS CA C -3.123 -7.244 -7.411 1.00 . A A . 11 LYS CA 1 1 6 3304 1 1 11 LYS CB C -2.174 -6.077 -7.125 1.00 . A A . 11 LYS CB 1 1 6 3305 1 1 11 LYS CD C -1.017 -5.536 -9.288 1.00 . A A . 11 LYS CD 1 1 6 3306 1 1 11 LYS CE C -1.451 -6.572 -10.314 1.00 . A A . 11 LYS CE 1 1 6 3307 1 1 11 LYS CG C -0.872 -6.148 -7.905 1.00 . A A . 11 LYS CG 1 1 6 3308 1 1 11 LYS H H -4.000 -6.005 -8.886 1.00 . A A . 11 LYS H 1 1 6 3309 1 1 11 LYS HA H -2.542 -8.109 -7.692 1.00 . A A . 11 LYS HA 1 1 6 3310 1 1 11 LYS HB2 H -2.672 -5.153 -7.379 1.00 . A A . 11 LYS HB2 1 1 6 3311 1 1 11 LYS HB3 H -1.938 -6.071 -6.071 1.00 . A A . 11 LYS HB3 1 1 6 3312 1 1 11 LYS HD2 H -1.759 -4.752 -9.250 1.00 . A A . 11 LYS HD2 1 1 6 3313 1 1 11 LYS HD3 H -0.066 -5.120 -9.590 1.00 . A A . 11 LYS HD3 1 1 6 3314 1 1 11 LYS HE2 H -0.948 -7.503 -10.101 1.00 . A A . 11 LYS HE2 1 1 6 3315 1 1 11 LYS HE3 H -2.519 -6.714 -10.233 1.00 . A A . 11 LYS HE3 1 1 6 3316 1 1 11 LYS HG2 H -0.109 -5.609 -7.363 1.00 . A A . 11 LYS HG2 1 1 6 3317 1 1 11 LYS HG3 H -0.581 -7.183 -8.008 1.00 . A A . 11 LYS HG3 1 1 6 3318 1 1 11 LYS HZ1 H -1.877 -5.545 -12.082 1.00 . A A . 11 LYS HZ1 1 1 6 3319 1 1 11 LYS HZ2 H -1.018 -6.984 -12.315 1.00 . A A . 11 LYS HZ2 1 1 6 3320 1 1 11 LYS HZ3 H -0.228 -5.616 -11.712 1.00 . A A . 11 LYS HZ3 1 1 6 3321 1 1 11 LYS N N -4.007 -6.916 -8.523 1.00 . A A . 11 LYS N 1 1 6 3322 1 1 11 LYS NZ N -1.121 -6.150 -11.703 1.00 . A A . 11 LYS NZ 1 1 6 3323 1 1 11 LYS O O -4.974 -6.990 -5.888 1.00 . A A . 11 LYS O 1 1 6 3324 1 1 12 PRO C C -4.011 -7.912 -3.041 1.00 . A A . 12 PRO C 1 1 6 3325 1 1 12 PRO CA C -4.080 -8.974 -4.134 1.00 . A A . 12 PRO CA 1 1 6 3326 1 1 12 PRO CB C -3.283 -10.215 -3.725 1.00 . A A . 12 PRO CB 1 1 6 3327 1 1 12 PRO CD C -2.181 -9.285 -5.632 1.00 . A A . 12 PRO CD 1 1 6 3328 1 1 12 PRO CG C -1.941 -10.024 -4.344 1.00 . A A . 12 PRO CG 1 1 6 3329 1 1 12 PRO HA H -5.111 -9.247 -4.304 1.00 . A A . 12 PRO HA 1 1 6 3330 1 1 12 PRO HB2 H -3.217 -10.265 -2.647 1.00 . A A . 12 PRO HB2 1 1 6 3331 1 1 12 PRO HB3 H -3.770 -11.101 -4.103 1.00 . A A . 12 PRO HB3 1 1 6 3332 1 1 12 PRO HD2 H -1.364 -8.610 -5.837 1.00 . A A . 12 PRO HD2 1 1 6 3333 1 1 12 PRO HD3 H -2.312 -9.981 -6.448 1.00 . A A . 12 PRO HD3 1 1 6 3334 1 1 12 PRO HG2 H -1.313 -9.440 -3.688 1.00 . A A . 12 PRO HG2 1 1 6 3335 1 1 12 PRO HG3 H -1.489 -10.985 -4.542 1.00 . A A . 12 PRO HG3 1 1 6 3336 1 1 12 PRO N N -3.426 -8.542 -5.372 1.00 . A A . 12 PRO N 1 1 6 3337 1 1 12 PRO O O -4.840 -7.890 -2.130 1.00 . A A . 12 PRO O 1 1 6 3338 1 1 13 TYR C C -3.141 -4.607 -2.770 1.00 . A A . 13 TYR C 1 1 6 3339 1 1 13 TYR CA C -2.841 -5.971 -2.156 1.00 . A A . 13 TYR CA 1 1 6 3340 1 1 13 TYR CB C -1.415 -5.992 -1.603 1.00 . A A . 13 TYR CB 1 1 6 3341 1 1 13 TYR CD1 C -1.347 -7.573 0.364 1.00 . A A . 13 TYR CD1 1 1 6 3342 1 1 13 TYR CD2 C -0.359 -8.284 -1.685 1.00 . A A . 13 TYR CD2 1 1 6 3343 1 1 13 TYR CE1 C -0.999 -8.773 0.954 1.00 . A A . 13 TYR CE1 1 1 6 3344 1 1 13 TYR CE2 C -0.009 -9.488 -1.104 1.00 . A A . 13 TYR CE2 1 1 6 3345 1 1 13 TYR CG C -1.034 -7.307 -0.963 1.00 . A A . 13 TYR CG 1 1 6 3346 1 1 13 TYR CZ C -0.331 -9.728 0.215 1.00 . A A . 13 TYR CZ 1 1 6 3347 1 1 13 TYR H H -2.391 -7.103 -3.886 1.00 . A A . 13 TYR H 1 1 6 3348 1 1 13 TYR HA H -3.534 -6.148 -1.346 1.00 . A A . 13 TYR HA 1 1 6 3349 1 1 13 TYR HB2 H -0.722 -5.802 -2.408 1.00 . A A . 13 TYR HB2 1 1 6 3350 1 1 13 TYR HB3 H -1.315 -5.218 -0.857 1.00 . A A . 13 TYR HB3 1 1 6 3351 1 1 13 TYR HD1 H -1.871 -6.824 0.940 1.00 . A A . 13 TYR HD1 1 1 6 3352 1 1 13 TYR HD2 H -0.107 -8.093 -2.718 1.00 . A A . 13 TYR HD2 1 1 6 3353 1 1 13 TYR HE1 H -1.252 -8.962 1.987 1.00 . A A . 13 TYR HE1 1 1 6 3354 1 1 13 TYR HE2 H 0.515 -10.235 -1.682 1.00 . A A . 13 TYR HE2 1 1 6 3355 1 1 13 TYR HH H -0.643 -11.588 0.585 1.00 . A A . 13 TYR HH 1 1 6 3356 1 1 13 TYR N N -3.019 -7.034 -3.138 1.00 . A A . 13 TYR N 1 1 6 3357 1 1 13 TYR O O -3.093 -4.438 -3.989 1.00 . A A . 13 TYR O 1 1 6 3358 1 1 13 TYR OH O 0.017 -10.925 0.798 1.00 . A A . 13 TYR OH 1 1 6 3359 1 1 14 ARG C C -3.663 -1.288 -1.223 1.00 . A A . 14 ARG C 1 1 6 3360 1 1 14 ARG CA C -3.756 -2.286 -2.374 1.00 . A A . 14 ARG CA 1 1 6 3361 1 1 14 ARG CB C -5.155 -2.240 -2.991 1.00 . A A . 14 ARG CB 1 1 6 3362 1 1 14 ARG CD C -6.463 -0.417 -1.857 1.00 . A A . 14 ARG CD 1 1 6 3363 1 1 14 ARG CG C -5.719 -0.834 -3.117 1.00 . A A . 14 ARG CG 1 1 6 3364 1 1 14 ARG CZ C -8.409 0.979 -1.305 1.00 . A A . 14 ARG CZ 1 1 6 3365 1 1 14 ARG H H -3.470 -3.831 -0.957 1.00 . A A . 14 ARG H 1 1 6 3366 1 1 14 ARG HA H -3.031 -2.017 -3.127 1.00 . A A . 14 ARG HA 1 1 6 3367 1 1 14 ARG HB2 H -5.115 -2.678 -3.978 1.00 . A A . 14 ARG HB2 1 1 6 3368 1 1 14 ARG HB3 H -5.826 -2.820 -2.375 1.00 . A A . 14 ARG HB3 1 1 6 3369 1 1 14 ARG HD2 H -7.013 -1.267 -1.482 1.00 . A A . 14 ARG HD2 1 1 6 3370 1 1 14 ARG HD3 H -5.742 -0.101 -1.118 1.00 . A A . 14 ARG HD3 1 1 6 3371 1 1 14 ARG HE H -7.260 1.212 -2.919 1.00 . A A . 14 ARG HE 1 1 6 3372 1 1 14 ARG HG2 H -4.906 -0.144 -3.287 1.00 . A A . 14 ARG HG2 1 1 6 3373 1 1 14 ARG HG3 H -6.401 -0.804 -3.954 1.00 . A A . 14 ARG HG3 1 1 6 3374 1 1 14 ARG HH11 H -8.012 -0.489 0.024 1.00 . A A . 14 ARG HH11 1 1 6 3375 1 1 14 ARG HH12 H -9.381 0.503 0.402 1.00 . A A . 14 ARG HH12 1 1 6 3376 1 1 14 ARG HH21 H -9.060 2.525 -2.432 1.00 . A A . 14 ARG HH21 1 1 6 3377 1 1 14 ARG HH22 H -9.977 2.217 -0.997 1.00 . A A . 14 ARG HH22 1 1 6 3378 1 1 14 ARG N N -3.448 -3.636 -1.917 1.00 . A A . 14 ARG N 1 1 6 3379 1 1 14 ARG NE N -7.396 0.677 -2.109 1.00 . A A . 14 ARG NE 1 1 6 3380 1 1 14 ARG NH1 N -8.618 0.273 -0.203 1.00 . A A . 14 ARG NH1 1 1 6 3381 1 1 14 ARG NH2 N -9.215 1.990 -1.602 1.00 . A A . 14 ARG NH2 1 1 6 3382 1 1 14 ARG O O -4.183 -1.529 -0.134 1.00 . A A . 14 ARG O 1 1 6 3383 1 1 15 CYS C C -4.169 1.534 -0.141 1.00 . A A . 15 CYS C 1 1 6 3384 1 1 15 CYS CA C -2.833 0.869 -0.459 1.00 . A A . 15 CYS CA 1 1 6 3385 1 1 15 CYS CB C -1.826 1.920 -0.931 1.00 . A A . 15 CYS CB 1 1 6 3386 1 1 15 CYS H H -2.603 -0.030 -2.361 1.00 . A A . 15 CYS H 1 1 6 3387 1 1 15 CYS HA H -2.456 0.400 0.437 1.00 . A A . 15 CYS HA 1 1 6 3388 1 1 15 CYS HB2 H -1.038 1.431 -1.484 1.00 . A A . 15 CYS HB2 1 1 6 3389 1 1 15 CYS HB3 H -2.329 2.624 -1.577 1.00 . A A . 15 CYS HB3 1 1 6 3390 1 1 15 CYS N N -2.996 -0.166 -1.473 1.00 . A A . 15 CYS N 1 1 6 3391 1 1 15 CYS O O -4.679 2.332 -0.927 1.00 . A A . 15 CYS O 1 1 6 3392 1 1 15 CYS SG S -1.049 2.864 0.420 1.00 . A A . 15 CYS SG 1 1 6 3393 1 1 16 ALA C C -5.899 3.276 1.626 1.00 . A A . 16 ALA C 1 1 6 3394 1 1 16 ALA CA C -6.003 1.766 1.440 1.00 . A A . 16 ALA CA 1 1 6 3395 1 1 16 ALA CB C -6.473 1.105 2.728 1.00 . A A . 16 ALA CB 1 1 6 3396 1 1 16 ALA H H -4.273 0.559 1.601 1.00 . A A . 16 ALA H 1 1 6 3397 1 1 16 ALA HA H -6.733 1.558 0.671 1.00 . A A . 16 ALA HA 1 1 6 3398 1 1 16 ALA HB1 H -7.264 0.405 2.505 1.00 . A A . 16 ALA HB1 1 1 6 3399 1 1 16 ALA HB2 H -5.646 0.581 3.185 1.00 . A A . 16 ALA HB2 1 1 6 3400 1 1 16 ALA HB3 H -6.840 1.860 3.407 1.00 . A A . 16 ALA HB3 1 1 6 3401 1 1 16 ALA N N -4.729 1.200 1.017 1.00 . A A . 16 ALA N 1 1 6 3402 1 1 16 ALA O O -6.907 3.960 1.798 1.00 . A A . 16 ALA O 1 1 6 3403 1 1 17 GLU C C -4.639 5.959 0.439 1.00 . A A . 17 GLU C 1 1 6 3404 1 1 17 GLU CA C -4.438 5.218 1.758 1.00 . A A . 17 GLU CA 1 1 6 3405 1 1 17 GLU CB C -3.024 5.467 2.285 1.00 . A A . 17 GLU CB 1 1 6 3406 1 1 17 GLU CD C -2.971 3.531 3.906 1.00 . A A . 17 GLU CD 1 1 6 3407 1 1 17 GLU CG C -2.826 5.029 3.727 1.00 . A A . 17 GLU CG 1 1 6 3408 1 1 17 GLU H H -3.909 3.191 1.451 1.00 . A A . 17 GLU H 1 1 6 3409 1 1 17 GLU HA H -5.152 5.590 2.478 1.00 . A A . 17 GLU HA 1 1 6 3410 1 1 17 GLU HB2 H -2.321 4.928 1.667 1.00 . A A . 17 GLU HB2 1 1 6 3411 1 1 17 GLU HB3 H -2.810 6.524 2.220 1.00 . A A . 17 GLU HB3 1 1 6 3412 1 1 17 GLU HG2 H -1.836 5.320 4.046 1.00 . A A . 17 GLU HG2 1 1 6 3413 1 1 17 GLU HG3 H -3.561 5.524 4.344 1.00 . A A . 17 GLU HG3 1 1 6 3414 1 1 17 GLU N N -4.673 3.789 1.591 1.00 . A A . 17 GLU N 1 1 6 3415 1 1 17 GLU O O -5.514 6.818 0.323 1.00 . A A . 17 GLU O 1 1 6 3416 1 1 17 GLU OE1 O -4.120 3.053 4.006 1.00 . A A . 17 GLU OE1 1 1 6 3417 1 1 17 GLU OE2 O -1.934 2.836 3.947 1.00 . A A . 17 GLU OE2 1 1 6 3418 1 1 18 CYS C C -4.726 5.401 -2.827 1.00 . A A . 18 CYS C 1 1 6 3419 1 1 18 CYS CA C -3.907 6.255 -1.863 1.00 . A A . 18 CYS CA 1 1 6 3420 1 1 18 CYS CB C -2.506 6.486 -2.434 1.00 . A A . 18 CYS CB 1 1 6 3421 1 1 18 CYS H H -3.143 4.930 -0.399 1.00 . A A . 18 CYS H 1 1 6 3422 1 1 18 CYS HA H -4.397 7.208 -1.740 1.00 . A A . 18 CYS HA 1 1 6 3423 1 1 18 CYS HB2 H -2.594 6.852 -3.446 1.00 . A A . 18 CYS HB2 1 1 6 3424 1 1 18 CYS HB3 H -1.998 7.225 -1.832 1.00 . A A . 18 CYS HB3 1 1 6 3425 1 1 18 CYS N N -3.821 5.622 -0.553 1.00 . A A . 18 CYS N 1 1 6 3426 1 1 18 CYS O O -5.619 5.901 -3.510 1.00 . A A . 18 CYS O 1 1 6 3427 1 1 18 CYS SG S -1.465 4.991 -2.475 1.00 . A A . 18 CYS SG 1 1 6 3428 1 1 19 GLY C C -4.219 2.539 -4.769 1.00 . A A . 19 GLY C 1 1 6 3429 1 1 19 GLY CA C -5.131 3.207 -3.758 1.00 . A A . 19 GLY CA 1 1 6 3430 1 1 19 GLY H H -3.693 3.767 -2.308 1.00 . A A . 19 GLY H 1 1 6 3431 1 1 19 GLY HA2 H -5.611 2.445 -3.163 1.00 . A A . 19 GLY HA2 1 1 6 3432 1 1 19 GLY HA3 H -5.888 3.766 -4.289 1.00 . A A . 19 GLY HA3 1 1 6 3433 1 1 19 GLY N N -4.415 4.109 -2.876 1.00 . A A . 19 GLY N 1 1 6 3434 1 1 19 GLY O O -4.627 2.261 -5.897 1.00 . A A . 19 GLY O 1 1 6 3435 1 1 20 LYS C C -2.229 0.134 -5.295 1.00 . A A . 20 LYS C 1 1 6 3436 1 1 20 LYS CA C -2.006 1.642 -5.242 1.00 . A A . 20 LYS CA 1 1 6 3437 1 1 20 LYS CB C -0.584 1.941 -4.763 1.00 . A A . 20 LYS CB 1 1 6 3438 1 1 20 LYS CD C 1.525 3.222 -5.234 1.00 . A A . 20 LYS CD 1 1 6 3439 1 1 20 LYS CE C 2.179 3.992 -6.371 1.00 . A A . 20 LYS CE 1 1 6 3440 1 1 20 LYS CG C 0.012 3.197 -5.376 1.00 . A A . 20 LYS CG 1 1 6 3441 1 1 20 LYS H H -2.714 2.526 -3.453 1.00 . A A . 20 LYS H 1 1 6 3442 1 1 20 LYS HA H -2.136 2.048 -6.234 1.00 . A A . 20 LYS HA 1 1 6 3443 1 1 20 LYS HB2 H -0.596 2.060 -3.690 1.00 . A A . 20 LYS HB2 1 1 6 3444 1 1 20 LYS HB3 H 0.052 1.105 -5.018 1.00 . A A . 20 LYS HB3 1 1 6 3445 1 1 20 LYS HD2 H 1.782 3.696 -4.298 1.00 . A A . 20 LYS HD2 1 1 6 3446 1 1 20 LYS HD3 H 1.895 2.207 -5.239 1.00 . A A . 20 LYS HD3 1 1 6 3447 1 1 20 LYS HE2 H 3.196 3.651 -6.481 1.00 . A A . 20 LYS HE2 1 1 6 3448 1 1 20 LYS HE3 H 1.632 3.796 -7.281 1.00 . A A . 20 LYS HE3 1 1 6 3449 1 1 20 LYS HG2 H -0.240 3.230 -6.425 1.00 . A A . 20 LYS HG2 1 1 6 3450 1 1 20 LYS HG3 H -0.402 4.061 -4.876 1.00 . A A . 20 LYS HG3 1 1 6 3451 1 1 20 LYS HZ1 H 2.647 5.958 -6.902 1.00 . A A . 20 LYS HZ1 1 1 6 3452 1 1 20 LYS HZ2 H 2.702 5.667 -5.237 1.00 . A A . 20 LYS HZ2 1 1 6 3453 1 1 20 LYS HZ3 H 1.211 5.810 -6.022 1.00 . A A . 20 LYS HZ3 1 1 6 3454 1 1 20 LYS N N -2.980 2.281 -4.365 1.00 . A A . 20 LYS N 1 1 6 3455 1 1 20 LYS NZ N 2.185 5.460 -6.115 1.00 . A A . 20 LYS NZ 1 1 6 3456 1 1 20 LYS O O -3.150 -0.389 -4.668 1.00 . A A . 20 LYS O 1 1 6 3457 1 1 21 ALA C C -0.131 -2.676 -5.953 1.00 . A A . 21 ALA C 1 1 6 3458 1 1 21 ALA CA C -1.483 -2.007 -6.179 1.00 . A A . 21 ALA CA 1 1 6 3459 1 1 21 ALA CB C -2.034 -2.375 -7.548 1.00 . A A . 21 ALA CB 1 1 6 3460 1 1 21 ALA H H -0.667 -0.085 -6.523 1.00 . A A . 21 ALA H 1 1 6 3461 1 1 21 ALA HA H -2.178 -2.362 -5.431 1.00 . A A . 21 ALA HA 1 1 6 3462 1 1 21 ALA HB1 H -1.782 -3.400 -7.774 1.00 . A A . 21 ALA HB1 1 1 6 3463 1 1 21 ALA HB2 H -3.108 -2.259 -7.546 1.00 . A A . 21 ALA HB2 1 1 6 3464 1 1 21 ALA HB3 H -1.603 -1.725 -8.296 1.00 . A A . 21 ALA HB3 1 1 6 3465 1 1 21 ALA N N -1.380 -0.559 -6.047 1.00 . A A . 21 ALA N 1 1 6 3466 1 1 21 ALA O O 0.890 -2.227 -6.475 1.00 . A A . 21 ALA O 1 1 6 3467 1 1 22 PHE C C 0.865 -5.987 -4.956 1.00 . A A . 22 PHE C 1 1 6 3468 1 1 22 PHE CA C 1.096 -4.481 -4.876 1.00 . A A . 22 PHE CA 1 1 6 3469 1 1 22 PHE CB C 1.614 -4.107 -3.485 1.00 . A A . 22 PHE CB 1 1 6 3470 1 1 22 PHE CD1 C 0.989 -1.700 -3.151 1.00 . A A . 22 PHE CD1 1 1 6 3471 1 1 22 PHE CD2 C 3.295 -2.245 -3.423 1.00 . A A . 22 PHE CD2 1 1 6 3472 1 1 22 PHE CE1 C 1.317 -0.363 -3.027 1.00 . A A . 22 PHE CE1 1 1 6 3473 1 1 22 PHE CE2 C 3.629 -0.909 -3.300 1.00 . A A . 22 PHE CE2 1 1 6 3474 1 1 22 PHE CG C 1.973 -2.655 -3.351 1.00 . A A . 22 PHE CG 1 1 6 3475 1 1 22 PHE CZ C 2.639 0.033 -3.100 1.00 . A A . 22 PHE CZ 1 1 6 3476 1 1 22 PHE H H -0.977 -4.060 -4.785 1.00 . A A . 22 PHE H 1 1 6 3477 1 1 22 PHE HA H 1.833 -4.202 -5.613 1.00 . A A . 22 PHE HA 1 1 6 3478 1 1 22 PHE HB2 H 0.852 -4.329 -2.753 1.00 . A A . 22 PHE HB2 1 1 6 3479 1 1 22 PHE HB3 H 2.496 -4.690 -3.269 1.00 . A A . 22 PHE HB3 1 1 6 3480 1 1 22 PHE HD1 H -0.044 -2.008 -3.092 1.00 . A A . 22 PHE HD1 1 1 6 3481 1 1 22 PHE HD2 H 4.070 -2.981 -3.579 1.00 . A A . 22 PHE HD2 1 1 6 3482 1 1 22 PHE HE1 H 0.541 0.372 -2.871 1.00 . A A . 22 PHE HE1 1 1 6 3483 1 1 22 PHE HE2 H 4.663 -0.604 -3.358 1.00 . A A . 22 PHE HE2 1 1 6 3484 1 1 22 PHE HZ H 2.897 1.077 -3.004 1.00 . A A . 22 PHE HZ 1 1 6 3485 1 1 22 PHE N N -0.132 -3.751 -5.172 1.00 . A A . 22 PHE N 1 1 6 3486 1 1 22 PHE O O -0.242 -6.472 -4.720 1.00 . A A . 22 PHE O 1 1 6 3487 1 1 23 THR C C 2.062 -8.847 -4.058 1.00 . A A . 23 THR C 1 1 6 3488 1 1 23 THR CA C 1.833 -8.175 -5.407 1.00 . A A . 23 THR CA 1 1 6 3489 1 1 23 THR CB C 2.857 -8.720 -6.420 1.00 . A A . 23 THR CB 1 1 6 3490 1 1 23 THR CG2 C 2.620 -10.199 -6.686 1.00 . A A . 23 THR CG2 1 1 6 3491 1 1 23 THR H H 2.775 -6.280 -5.469 1.00 . A A . 23 THR H 1 1 6 3492 1 1 23 THR HA H 0.843 -8.423 -5.759 1.00 . A A . 23 THR HA 1 1 6 3493 1 1 23 THR HB H 3.849 -8.598 -6.008 1.00 . A A . 23 THR HB 1 1 6 3494 1 1 23 THR HG1 H 3.391 -7.257 -7.630 1.00 . A A . 23 THR HG1 1 1 6 3495 1 1 23 THR HG21 H 1.850 -10.564 -6.024 1.00 . A A . 23 THR HG21 1 1 6 3496 1 1 23 THR HG22 H 3.534 -10.747 -6.512 1.00 . A A . 23 THR HG22 1 1 6 3497 1 1 23 THR HG23 H 2.308 -10.335 -7.711 1.00 . A A . 23 THR HG23 1 1 6 3498 1 1 23 THR N N 1.920 -6.724 -5.293 1.00 . A A . 23 THR N 1 1 6 3499 1 1 23 THR O O 1.335 -9.765 -3.680 1.00 . A A . 23 THR O 1 1 6 3500 1 1 23 THR OG1 O 2.769 -7.989 -7.648 1.00 . A A . 23 THR OG1 1 1 6 3501 1 1 24 ASP C C 3.237 -7.887 -0.934 1.00 . A A . 24 ASP C 1 1 6 3502 1 1 24 ASP CA C 3.400 -8.939 -2.027 1.00 . A A . 24 ASP CA 1 1 6 3503 1 1 24 ASP CB C 4.830 -9.482 -2.019 1.00 . A A . 24 ASP CB 1 1 6 3504 1 1 24 ASP CG C 5.024 -10.586 -0.998 1.00 . A A . 24 ASP CG 1 1 6 3505 1 1 24 ASP H H 3.620 -7.649 -3.691 1.00 . A A . 24 ASP H 1 1 6 3506 1 1 24 ASP HA H 2.716 -9.751 -1.833 1.00 . A A . 24 ASP HA 1 1 6 3507 1 1 24 ASP HB2 H 5.063 -9.877 -2.997 1.00 . A A . 24 ASP HB2 1 1 6 3508 1 1 24 ASP HB3 H 5.512 -8.678 -1.788 1.00 . A A . 24 ASP HB3 1 1 6 3509 1 1 24 ASP N N 3.077 -8.383 -3.336 1.00 . A A . 24 ASP N 1 1 6 3510 1 1 24 ASP O O 3.468 -6.700 -1.163 1.00 . A A . 24 ASP O 1 1 6 3511 1 1 24 ASP OD1 O 4.146 -11.469 -0.906 1.00 . A A . 24 ASP OD1 1 1 6 3512 1 1 24 ASP OD2 O 6.054 -10.567 -0.292 1.00 . A A . 24 ASP OD2 1 1 6 3513 1 1 25 ARG C C 3.915 -6.648 1.681 1.00 . A A . 25 ARG C 1 1 6 3514 1 1 25 ARG CA C 2.638 -7.428 1.379 1.00 . A A . 25 ARG CA 1 1 6 3515 1 1 25 ARG CB C 2.202 -8.212 2.618 1.00 . A A . 25 ARG CB 1 1 6 3516 1 1 25 ARG CD C 1.520 -8.160 5.037 1.00 . A A . 25 ARG CD 1 1 6 3517 1 1 25 ARG CG C 1.874 -7.330 3.812 1.00 . A A . 25 ARG CG 1 1 6 3518 1 1 25 ARG CZ C 2.617 -9.749 6.558 1.00 . A A . 25 ARG CZ 1 1 6 3519 1 1 25 ARG H H 2.667 -9.289 0.372 1.00 . A A . 25 ARG H 1 1 6 3520 1 1 25 ARG HA H 1.859 -6.730 1.113 1.00 . A A . 25 ARG HA 1 1 6 3521 1 1 25 ARG HB2 H 1.323 -8.790 2.374 1.00 . A A . 25 ARG HB2 1 1 6 3522 1 1 25 ARG HB3 H 2.998 -8.884 2.903 1.00 . A A . 25 ARG HB3 1 1 6 3523 1 1 25 ARG HD2 H 1.300 -7.492 5.856 1.00 . A A . 25 ARG HD2 1 1 6 3524 1 1 25 ARG HD3 H 0.646 -8.753 4.812 1.00 . A A . 25 ARG HD3 1 1 6 3525 1 1 25 ARG HE H 3.372 -9.129 4.820 1.00 . A A . 25 ARG HE 1 1 6 3526 1 1 25 ARG HG2 H 2.733 -6.718 4.043 1.00 . A A . 25 ARG HG2 1 1 6 3527 1 1 25 ARG HG3 H 1.035 -6.698 3.561 1.00 . A A . 25 ARG HG3 1 1 6 3528 1 1 25 ARG HH11 H 0.822 -9.070 7.188 1.00 . A A . 25 ARG HH11 1 1 6 3529 1 1 25 ARG HH12 H 1.606 -10.191 8.252 1.00 . A A . 25 ARG HH12 1 1 6 3530 1 1 25 ARG HH21 H 4.415 -10.606 6.211 1.00 . A A . 25 ARG HH21 1 1 6 3531 1 1 25 ARG HH22 H 3.650 -11.063 7.695 1.00 . A A . 25 ARG HH22 1 1 6 3532 1 1 25 ARG N N 2.835 -8.331 0.252 1.00 . A A . 25 ARG N 1 1 6 3533 1 1 25 ARG NE N 2.609 -9.050 5.429 1.00 . A A . 25 ARG NE 1 1 6 3534 1 1 25 ARG NH1 N 1.598 -9.662 7.402 1.00 . A A . 25 ARG NH1 1 1 6 3535 1 1 25 ARG NH2 N 3.645 -10.537 6.845 1.00 . A A . 25 ARG NH2 1 1 6 3536 1 1 25 ARG O O 3.886 -5.428 1.843 1.00 . A A . 25 ARG O 1 1 6 3537 1 1 26 SER C C 6.508 -5.472 1.210 1.00 . A A . 26 SER C 1 1 6 3538 1 1 26 SER CA C 6.321 -6.737 2.041 1.00 . A A . 26 SER CA 1 1 6 3539 1 1 26 SER CB C 7.461 -7.718 1.761 1.00 . A A . 26 SER CB 1 1 6 3540 1 1 26 SER H H 4.993 -8.331 1.616 1.00 . A A . 26 SER H 1 1 6 3541 1 1 26 SER HA H 6.335 -6.472 3.088 1.00 . A A . 26 SER HA 1 1 6 3542 1 1 26 SER HB2 H 7.335 -8.140 0.775 1.00 . A A . 26 SER HB2 1 1 6 3543 1 1 26 SER HB3 H 8.404 -7.193 1.811 1.00 . A A . 26 SER HB3 1 1 6 3544 1 1 26 SER HG H 7.568 -9.611 2.255 1.00 . A A . 26 SER HG 1 1 6 3545 1 1 26 SER N N 5.034 -7.361 1.755 1.00 . A A . 26 SER N 1 1 6 3546 1 1 26 SER O O 6.878 -4.422 1.733 1.00 . A A . 26 SER O 1 1 6 3547 1 1 26 SER OG O 7.473 -8.771 2.710 1.00 . A A . 26 SER OG 1 1 6 3548 1 1 27 ASN C C 5.463 -3.305 -0.583 1.00 . A A . 27 ASN C 1 1 6 3549 1 1 27 ASN CA C 6.388 -4.446 -0.995 1.00 . A A . 27 ASN CA 1 1 6 3550 1 1 27 ASN CB C 6.081 -4.873 -2.432 1.00 . A A . 27 ASN CB 1 1 6 3551 1 1 27 ASN CG C 7.259 -5.561 -3.094 1.00 . A A . 27 ASN CG 1 1 6 3552 1 1 27 ASN H H 5.955 -6.445 -0.448 1.00 . A A . 27 ASN H 1 1 6 3553 1 1 27 ASN HA H 7.410 -4.103 -0.941 1.00 . A A . 27 ASN HA 1 1 6 3554 1 1 27 ASN HB2 H 5.245 -5.557 -2.427 1.00 . A A . 27 ASN HB2 1 1 6 3555 1 1 27 ASN HB3 H 5.823 -4.001 -3.013 1.00 . A A . 27 ASN HB3 1 1 6 3556 1 1 27 ASN HD21 H 6.162 -7.190 -3.408 1.00 . A A . 27 ASN HD21 1 1 6 3557 1 1 27 ASN HD22 H 7.795 -7.266 -3.966 1.00 . A A . 27 ASN HD22 1 1 6 3558 1 1 27 ASN N N 6.248 -5.581 -0.089 1.00 . A A . 27 ASN N 1 1 6 3559 1 1 27 ASN ND2 N 7.051 -6.797 -3.534 1.00 . A A . 27 ASN ND2 1 1 6 3560 1 1 27 ASN O O 5.862 -2.140 -0.576 1.00 . A A . 27 ASN O 1 1 6 3561 1 1 27 ASN OD1 O 8.342 -4.989 -3.209 1.00 . A A . 27 ASN OD1 1 1 6 3562 1 1 28 LEU C C 3.694 -1.937 1.444 1.00 . A A . 28 LEU C 1 1 6 3563 1 1 28 LEU CA C 3.243 -2.652 0.174 1.00 . A A . 28 LEU CA 1 1 6 3564 1 1 28 LEU CB C 1.883 -3.313 0.403 1.00 . A A . 28 LEU CB 1 1 6 3565 1 1 28 LEU CD1 C 0.393 -1.305 0.231 1.00 . A A . 28 LEU CD1 1 1 6 3566 1 1 28 LEU CD2 C -0.362 -3.312 1.519 1.00 . A A . 28 LEU CD2 1 1 6 3567 1 1 28 LEU CG C 0.834 -2.460 1.116 1.00 . A A . 28 LEU CG 1 1 6 3568 1 1 28 LEU H H 3.966 -4.591 -0.265 1.00 . A A . 28 LEU H 1 1 6 3569 1 1 28 LEU HA H 3.153 -1.926 -0.620 1.00 . A A . 28 LEU HA 1 1 6 3570 1 1 28 LEU HB2 H 1.484 -3.590 -0.561 1.00 . A A . 28 LEU HB2 1 1 6 3571 1 1 28 LEU HB3 H 2.045 -4.204 0.993 1.00 . A A . 28 LEU HB3 1 1 6 3572 1 1 28 LEU HD11 H -0.414 -0.772 0.710 1.00 . A A . 28 LEU HD11 1 1 6 3573 1 1 28 LEU HD12 H 0.056 -1.689 -0.721 1.00 . A A . 28 LEU HD12 1 1 6 3574 1 1 28 LEU HD13 H 1.225 -0.634 0.074 1.00 . A A . 28 LEU HD13 1 1 6 3575 1 1 28 LEU HD21 H -0.231 -3.657 2.534 1.00 . A A . 28 LEU HD21 1 1 6 3576 1 1 28 LEU HD22 H -0.438 -4.161 0.856 1.00 . A A . 28 LEU HD22 1 1 6 3577 1 1 28 LEU HD23 H -1.264 -2.721 1.452 1.00 . A A . 28 LEU HD23 1 1 6 3578 1 1 28 LEU HG H 1.267 -2.044 2.015 1.00 . A A . 28 LEU HG 1 1 6 3579 1 1 28 LEU N N 4.226 -3.647 -0.240 1.00 . A A . 28 LEU N 1 1 6 3580 1 1 28 LEU O O 3.855 -0.717 1.459 1.00 . A A . 28 LEU O 1 1 6 3581 1 1 29 PHE C C 5.422 -1.100 3.576 1.00 . A A . 29 PHE C 1 1 6 3582 1 1 29 PHE CA C 4.332 -2.147 3.784 1.00 . A A . 29 PHE CA 1 1 6 3583 1 1 29 PHE CB C 4.844 -3.257 4.704 1.00 . A A . 29 PHE CB 1 1 6 3584 1 1 29 PHE CD1 C 2.680 -4.504 4.939 1.00 . A A . 29 PHE CD1 1 1 6 3585 1 1 29 PHE CD2 C 3.842 -3.869 6.921 1.00 . A A . 29 PHE CD2 1 1 6 3586 1 1 29 PHE CE1 C 1.687 -5.086 5.704 1.00 . A A . 29 PHE CE1 1 1 6 3587 1 1 29 PHE CE2 C 2.852 -4.449 7.692 1.00 . A A . 29 PHE CE2 1 1 6 3588 1 1 29 PHE CG C 3.767 -3.889 5.538 1.00 . A A . 29 PHE CG 1 1 6 3589 1 1 29 PHE CZ C 1.774 -5.059 7.082 1.00 . A A . 29 PHE CZ 1 1 6 3590 1 1 29 PHE H H 3.753 -3.673 2.435 1.00 . A A . 29 PHE H 1 1 6 3591 1 1 29 PHE HA H 3.479 -1.674 4.245 1.00 . A A . 29 PHE HA 1 1 6 3592 1 1 29 PHE HB2 H 5.296 -4.033 4.103 1.00 . A A . 29 PHE HB2 1 1 6 3593 1 1 29 PHE HB3 H 5.586 -2.847 5.372 1.00 . A A . 29 PHE HB3 1 1 6 3594 1 1 29 PHE HD1 H 2.611 -4.527 3.861 1.00 . A A . 29 PHE HD1 1 1 6 3595 1 1 29 PHE HD2 H 4.686 -3.392 7.399 1.00 . A A . 29 PHE HD2 1 1 6 3596 1 1 29 PHE HE1 H 0.845 -5.562 5.225 1.00 . A A . 29 PHE HE1 1 1 6 3597 1 1 29 PHE HE2 H 2.924 -4.427 8.769 1.00 . A A . 29 PHE HE2 1 1 6 3598 1 1 29 PHE HZ H 0.999 -5.513 7.683 1.00 . A A . 29 PHE HZ 1 1 6 3599 1 1 29 PHE N N 3.898 -2.706 2.509 1.00 . A A . 29 PHE N 1 1 6 3600 1 1 29 PHE O O 5.402 -0.034 4.192 1.00 . A A . 29 PHE O 1 1 6 3601 1 1 30 THR C C 6.961 0.822 1.855 1.00 . A A . 30 THR C 1 1 6 3602 1 1 30 THR CA C 7.475 -0.500 2.414 1.00 . A A . 30 THR CA 1 1 6 3603 1 1 30 THR CB C 8.467 -1.117 1.410 1.00 . A A . 30 THR CB 1 1 6 3604 1 1 30 THR CG2 C 9.599 -0.148 1.103 1.00 . A A . 30 THR CG2 1 1 6 3605 1 1 30 THR H H 6.337 -2.276 2.243 1.00 . A A . 30 THR H 1 1 6 3606 1 1 30 THR HA H 8.001 -0.309 3.337 1.00 . A A . 30 THR HA 1 1 6 3607 1 1 30 THR HB H 7.940 -1.333 0.492 1.00 . A A . 30 THR HB 1 1 6 3608 1 1 30 THR HG1 H 8.334 -2.779 2.463 1.00 . A A . 30 THR HG1 1 1 6 3609 1 1 30 THR HG21 H 9.819 -0.175 0.047 1.00 . A A . 30 THR HG21 1 1 6 3610 1 1 30 THR HG22 H 10.479 -0.434 1.661 1.00 . A A . 30 THR HG22 1 1 6 3611 1 1 30 THR HG23 H 9.304 0.852 1.384 1.00 . A A . 30 THR HG23 1 1 6 3612 1 1 30 THR N N 6.375 -1.411 2.703 1.00 . A A . 30 THR N 1 1 6 3613 1 1 30 THR O O 7.481 1.890 2.182 1.00 . A A . 30 THR O 1 1 6 3614 1 1 30 THR OG1 O 9.004 -2.335 1.938 1.00 . A A . 30 THR OG1 1 1 6 3615 1 1 31 HIS C C 4.511 2.704 1.425 1.00 . A A . 31 HIS C 1 1 6 3616 1 1 31 HIS CA C 5.351 1.937 0.408 1.00 . A A . 31 HIS CA 1 1 6 3617 1 1 31 HIS CB C 4.491 1.554 -0.796 1.00 . A A . 31 HIS CB 1 1 6 3618 1 1 31 HIS CD2 C 2.211 2.791 -0.818 1.00 . A A . 31 HIS CD2 1 1 6 3619 1 1 31 HIS CE1 C 2.736 4.407 -2.204 1.00 . A A . 31 HIS CE1 1 1 6 3620 1 1 31 HIS CG C 3.501 2.610 -1.185 1.00 . A A . 31 HIS CG 1 1 6 3621 1 1 31 HIS H H 5.566 -0.135 0.790 1.00 . A A . 31 HIS H 1 1 6 3622 1 1 31 HIS HA H 6.159 2.571 0.076 1.00 . A A . 31 HIS HA 1 1 6 3623 1 1 31 HIS HB2 H 5.133 1.373 -1.646 1.00 . A A . 31 HIS HB2 1 1 6 3624 1 1 31 HIS HB3 H 3.942 0.652 -0.567 1.00 . A A . 31 HIS HB3 1 1 6 3625 1 1 31 HIS HD1 H 4.663 3.782 -2.494 1.00 . A A . 31 HIS HD1 1 1 6 3626 1 1 31 HIS HD2 H 1.642 2.169 -0.142 1.00 . A A . 31 HIS HD2 1 1 6 3627 1 1 31 HIS HE1 H 2.676 5.288 -2.826 1.00 . A A . 31 HIS HE1 1 1 6 3628 1 1 31 HIS N N 5.937 0.745 1.012 1.00 . A A . 31 HIS N 1 1 6 3629 1 1 31 HIS ND1 N 3.800 3.638 -2.054 1.00 . A A . 31 HIS ND1 1 1 6 3630 1 1 31 HIS NE2 N 1.758 3.915 -1.465 1.00 . A A . 31 HIS NE2 1 1 6 3631 1 1 31 HIS O O 4.671 3.913 1.589 1.00 . A A . 31 HIS O 1 1 6 3632 1 1 32 GLN C C 3.531 3.597 3.964 1.00 . A A . 32 GLN C 1 1 6 3633 1 1 32 GLN CA C 2.752 2.607 3.104 1.00 . A A . 32 GLN CA 1 1 6 3634 1 1 32 GLN CB C 2.117 1.534 3.989 1.00 . A A . 32 GLN CB 1 1 6 3635 1 1 32 GLN CD C 0.388 -0.297 4.198 1.00 . A A . 32 GLN CD 1 1 6 3636 1 1 32 GLN CG C 1.039 0.724 3.286 1.00 . A A . 32 GLN CG 1 1 6 3637 1 1 32 GLN H H 3.537 1.032 1.928 1.00 . A A . 32 GLN H 1 1 6 3638 1 1 32 GLN HA H 1.971 3.140 2.583 1.00 . A A . 32 GLN HA 1 1 6 3639 1 1 32 GLN HB2 H 2.888 0.855 4.321 1.00 . A A . 32 GLN HB2 1 1 6 3640 1 1 32 GLN HB3 H 1.673 2.011 4.851 1.00 . A A . 32 GLN HB3 1 1 6 3641 1 1 32 GLN HE21 H -1.019 -0.650 2.838 1.00 . A A . 32 GLN HE21 1 1 6 3642 1 1 32 GLN HE22 H -1.143 -1.560 4.301 1.00 . A A . 32 GLN HE22 1 1 6 3643 1 1 32 GLN HG2 H 0.278 1.399 2.925 1.00 . A A . 32 GLN HG2 1 1 6 3644 1 1 32 GLN HG3 H 1.485 0.206 2.450 1.00 . A A . 32 GLN HG3 1 1 6 3645 1 1 32 GLN N N 3.617 1.992 2.104 1.00 . A A . 32 GLN N 1 1 6 3646 1 1 32 GLN NE2 N -0.702 -0.896 3.733 1.00 . A A . 32 GLN NE2 1 1 6 3647 1 1 32 GLN O O 2.956 4.516 4.547 1.00 . A A . 32 GLN O 1 1 6 3648 1 1 32 GLN OE1 O 0.858 -0.544 5.308 1.00 . A A . 32 GLN OE1 1 1 6 3649 1 1 33 LYS C C 5.436 5.743 4.497 1.00 . A A . 33 LYS C 1 1 6 3650 1 1 33 LYS CA C 5.703 4.278 4.826 1.00 . A A . 33 LYS CA 1 1 6 3651 1 1 33 LYS CB C 7.175 3.947 4.569 1.00 . A A . 33 LYS CB 1 1 6 3652 1 1 33 LYS CD C 9.046 2.283 4.773 1.00 . A A . 33 LYS CD 1 1 6 3653 1 1 33 LYS CE C 9.586 1.137 5.615 1.00 . A A . 33 LYS CE 1 1 6 3654 1 1 33 LYS CG C 7.601 2.598 5.122 1.00 . A A . 33 LYS CG 1 1 6 3655 1 1 33 LYS H H 5.244 2.652 3.550 1.00 . A A . 33 LYS H 1 1 6 3656 1 1 33 LYS HA H 5.482 4.109 5.869 1.00 . A A . 33 LYS HA 1 1 6 3657 1 1 33 LYS HB2 H 7.351 3.948 3.503 1.00 . A A . 33 LYS HB2 1 1 6 3658 1 1 33 LYS HB3 H 7.788 4.710 5.027 1.00 . A A . 33 LYS HB3 1 1 6 3659 1 1 33 LYS HD2 H 9.104 2.007 3.731 1.00 . A A . 33 LYS HD2 1 1 6 3660 1 1 33 LYS HD3 H 9.649 3.163 4.948 1.00 . A A . 33 LYS HD3 1 1 6 3661 1 1 33 LYS HE2 H 9.460 1.384 6.658 1.00 . A A . 33 LYS HE2 1 1 6 3662 1 1 33 LYS HE3 H 9.023 0.244 5.386 1.00 . A A . 33 LYS HE3 1 1 6 3663 1 1 33 LYS HG2 H 7.496 2.610 6.196 1.00 . A A . 33 LYS HG2 1 1 6 3664 1 1 33 LYS HG3 H 6.964 1.831 4.704 1.00 . A A . 33 LYS HG3 1 1 6 3665 1 1 33 LYS HZ1 H 11.616 1.407 6.027 1.00 . A A . 33 LYS HZ1 1 1 6 3666 1 1 33 LYS HZ2 H 11.273 1.193 4.385 1.00 . A A . 33 LYS HZ2 1 1 6 3667 1 1 33 LYS HZ3 H 11.235 -0.131 5.436 1.00 . A A . 33 LYS HZ3 1 1 6 3668 1 1 33 LYS N N 4.844 3.403 4.038 1.00 . A A . 33 LYS N 1 1 6 3669 1 1 33 LYS NZ N 11.028 0.884 5.347 1.00 . A A . 33 LYS NZ 1 1 6 3670 1 1 33 LYS O O 5.250 6.566 5.394 1.00 . A A . 33 LYS O 1 1 6 3671 1 1 34 ILE C C 3.846 7.953 3.309 1.00 . A A . 34 ILE C 1 1 6 3672 1 1 34 ILE CA C 5.169 7.427 2.761 1.00 . A A . 34 ILE CA 1 1 6 3673 1 1 34 ILE CB C 5.149 7.522 1.224 1.00 . A A . 34 ILE CB 1 1 6 3674 1 1 34 ILE CD1 C 3.417 7.362 -0.634 1.00 . A A . 34 ILE CD1 1 1 6 3675 1 1 34 ILE CG1 C 3.937 6.778 0.661 1.00 . A A . 34 ILE CG1 1 1 6 3676 1 1 34 ILE CG2 C 6.439 6.963 0.642 1.00 . A A . 34 ILE CG2 1 1 6 3677 1 1 34 ILE H H 5.572 5.361 2.540 1.00 . A A . 34 ILE H 1 1 6 3678 1 1 34 ILE HA H 5.972 8.048 3.130 1.00 . A A . 34 ILE HA 1 1 6 3679 1 1 34 ILE HB H 5.082 8.564 0.951 1.00 . A A . 34 ILE HB 1 1 6 3680 1 1 34 ILE HD11 H 3.352 6.583 -1.380 1.00 . A A . 34 ILE HD11 1 1 6 3681 1 1 34 ILE HD12 H 2.437 7.785 -0.471 1.00 . A A . 34 ILE HD12 1 1 6 3682 1 1 34 ILE HD13 H 4.091 8.133 -0.978 1.00 . A A . 34 ILE HD13 1 1 6 3683 1 1 34 ILE HG12 H 4.208 5.750 0.475 1.00 . A A . 34 ILE HG12 1 1 6 3684 1 1 34 ILE HG13 H 3.136 6.809 1.385 1.00 . A A . 34 ILE HG13 1 1 6 3685 1 1 34 ILE HG21 H 6.933 6.352 1.383 1.00 . A A . 34 ILE HG21 1 1 6 3686 1 1 34 ILE HG22 H 6.211 6.361 -0.225 1.00 . A A . 34 ILE HG22 1 1 6 3687 1 1 34 ILE HG23 H 7.088 7.777 0.356 1.00 . A A . 34 ILE HG23 1 1 6 3688 1 1 34 ILE N N 5.416 6.061 3.207 1.00 . A A . 34 ILE N 1 1 6 3689 1 1 34 ILE O O 3.602 9.160 3.319 1.00 . A A . 34 ILE O 1 1 6 3690 1 1 35 HIS C C 1.752 7.468 5.841 1.00 . A A . 35 HIS C 1 1 6 3691 1 1 35 HIS CA C 1.698 7.410 4.318 1.00 . A A . 35 HIS CA 1 1 6 3692 1 1 35 HIS CB C 0.626 6.416 3.871 1.00 . A A . 35 HIS CB 1 1 6 3693 1 1 35 HIS CD2 C 0.709 5.673 1.387 1.00 . A A . 35 HIS CD2 1 1 6 3694 1 1 35 HIS CE1 C -0.548 7.256 0.538 1.00 . A A . 35 HIS CE1 1 1 6 3695 1 1 35 HIS CG C 0.324 6.478 2.406 1.00 . A A . 35 HIS CG 1 1 6 3696 1 1 35 HIS H H 3.247 6.092 3.730 1.00 . A A . 35 HIS H 1 1 6 3697 1 1 35 HIS HA H 1.446 8.390 3.942 1.00 . A A . 35 HIS HA 1 1 6 3698 1 1 35 HIS HB2 H 0.958 5.413 4.099 1.00 . A A . 35 HIS HB2 1 1 6 3699 1 1 35 HIS HB3 H -0.289 6.617 4.408 1.00 . A A . 35 HIS HB3 1 1 6 3700 1 1 35 HIS HD1 H -0.891 8.196 2.322 1.00 . A A . 35 HIS HD1 1 1 6 3701 1 1 35 HIS HD2 H 1.336 4.796 1.465 1.00 . A A . 35 HIS HD2 1 1 6 3702 1 1 35 HIS HE1 H -1.097 7.866 -0.163 1.00 . A A . 35 HIS HE1 1 1 6 3703 1 1 35 HIS N N 2.996 7.039 3.765 1.00 . A A . 35 HIS N 1 1 6 3704 1 1 35 HIS ND1 N -0.461 7.460 1.840 1.00 . A A . 35 HIS ND1 1 1 6 3705 1 1 35 HIS NE2 N 0.154 6.178 0.237 1.00 . A A . 35 HIS NE2 1 1 6 3706 1 1 35 HIS O O 1.347 8.458 6.451 1.00 . A A . 35 HIS O 1 1 6 3707 1 1 36 THR C C 3.650 6.974 8.394 1.00 . A A . 36 THR C 1 1 6 3708 1 1 36 THR CA C 2.360 6.327 7.904 1.00 . A A . 36 THR CA 1 1 6 3709 1 1 36 THR CB C 2.310 4.869 8.399 1.00 . A A . 36 THR CB 1 1 6 3710 1 1 36 THR CG2 C 3.445 4.054 7.798 1.00 . A A . 36 THR CG2 1 1 6 3711 1 1 36 THR H H 2.561 5.641 5.911 1.00 . A A . 36 THR H 1 1 6 3712 1 1 36 THR HA H 1.519 6.858 8.326 1.00 . A A . 36 THR HA 1 1 6 3713 1 1 36 THR HB H 1.371 4.433 8.091 1.00 . A A . 36 THR HB 1 1 6 3714 1 1 36 THR HG1 H 2.054 3.996 10.148 1.00 . A A . 36 THR HG1 1 1 6 3715 1 1 36 THR HG21 H 3.100 3.566 6.898 1.00 . A A . 36 THR HG21 1 1 6 3716 1 1 36 THR HG22 H 3.770 3.309 8.509 1.00 . A A . 36 THR HG22 1 1 6 3717 1 1 36 THR HG23 H 4.271 4.708 7.559 1.00 . A A . 36 THR HG23 1 1 6 3718 1 1 36 THR N N 2.255 6.399 6.452 1.00 . A A . 36 THR N 1 1 6 3719 1 1 36 THR O O 4.353 6.419 9.237 1.00 . A A . 36 THR O 1 1 6 3720 1 1 36 THR OG1 O 2.396 4.834 9.828 1.00 . A A . 36 THR OG1 1 1 6 3721 1 1 37 GLY C C 4.876 10.259 8.758 1.00 . A A . 37 GLY C 1 1 6 3722 1 1 37 GLY CA C 5.161 8.857 8.257 1.00 . A A . 37 GLY CA 1 1 6 3723 1 1 37 GLY H H 3.357 8.548 7.192 1.00 . A A . 37 GLY H 1 1 6 3724 1 1 37 GLY HA2 H 5.650 8.298 9.041 1.00 . A A . 37 GLY HA2 1 1 6 3725 1 1 37 GLY HA3 H 5.824 8.919 7.406 1.00 . A A . 37 GLY HA3 1 1 6 3726 1 1 37 GLY N N 3.956 8.153 7.860 1.00 . A A . 37 GLY N 1 1 6 3727 1 1 37 GLY O O 5.467 11.227 8.281 1.00 . A A . 37 GLY O 1 1 6 3728 1 1 38 GLU C C 4.099 11.789 11.722 1.00 . A A . 38 GLU C 1 1 6 3729 1 1 38 GLU CA C 3.603 11.663 10.285 1.00 . A A . 38 GLU CA 1 1 6 3730 1 1 38 GLU CB C 2.086 11.856 10.239 1.00 . A A . 38 GLU CB 1 1 6 3731 1 1 38 GLU CD C 1.989 14.372 10.441 1.00 . A A . 38 GLU CD 1 1 6 3732 1 1 38 GLU CG C 1.598 13.041 11.054 1.00 . A A . 38 GLU CG 1 1 6 3733 1 1 38 GLU H H 3.530 9.559 10.061 1.00 . A A . 38 GLU H 1 1 6 3734 1 1 38 GLU HA H 4.072 12.428 9.686 1.00 . A A . 38 GLU HA 1 1 6 3735 1 1 38 GLU HB2 H 1.784 12.003 9.212 1.00 . A A . 38 GLU HB2 1 1 6 3736 1 1 38 GLU HB3 H 1.610 10.964 10.619 1.00 . A A . 38 GLU HB3 1 1 6 3737 1 1 38 GLU HG2 H 0.521 12.997 11.122 1.00 . A A . 38 GLU HG2 1 1 6 3738 1 1 38 GLU HG3 H 2.023 12.980 12.045 1.00 . A A . 38 GLU HG3 1 1 6 3739 1 1 38 GLU N N 3.966 10.368 9.721 1.00 . A A . 38 GLU N 1 1 6 3740 1 1 38 GLU O O 3.728 11.000 12.592 1.00 . A A . 38 GLU O 1 1 6 3741 1 1 38 GLU OE1 O 2.275 14.403 9.225 1.00 . A A . 38 GLU OE1 1 1 6 3742 1 1 38 GLU OE2 O 2.010 15.381 11.176 1.00 . A A . 38 GLU OE2 1 1 6 3743 1 1 39 LYS C C 4.375 13.257 14.310 1.00 . A A . 39 LYS C 1 1 6 3744 1 1 39 LYS CA C 5.490 13.020 13.296 1.00 . A A . 39 LYS CA 1 1 6 3745 1 1 39 LYS CB C 6.439 14.220 13.277 1.00 . A A . 39 LYS CB 1 1 6 3746 1 1 39 LYS CD C 5.018 15.863 12.016 1.00 . A A . 39 LYS CD 1 1 6 3747 1 1 39 LYS CE C 4.709 17.346 11.879 1.00 . A A . 39 LYS CE 1 1 6 3748 1 1 39 LYS CG C 5.727 15.560 13.325 1.00 . A A . 39 LYS CG 1 1 6 3749 1 1 39 LYS H H 5.201 13.383 11.231 1.00 . A A . 39 LYS H 1 1 6 3750 1 1 39 LYS HA H 6.042 12.139 13.586 1.00 . A A . 39 LYS HA 1 1 6 3751 1 1 39 LYS HB2 H 7.100 14.155 14.129 1.00 . A A . 39 LYS HB2 1 1 6 3752 1 1 39 LYS HB3 H 7.029 14.182 12.372 1.00 . A A . 39 LYS HB3 1 1 6 3753 1 1 39 LYS HD2 H 5.652 15.562 11.195 1.00 . A A . 39 LYS HD2 1 1 6 3754 1 1 39 LYS HD3 H 4.092 15.307 11.981 1.00 . A A . 39 LYS HD3 1 1 6 3755 1 1 39 LYS HE2 H 4.058 17.488 11.031 1.00 . A A . 39 LYS HE2 1 1 6 3756 1 1 39 LYS HE3 H 4.209 17.680 12.776 1.00 . A A . 39 LYS HE3 1 1 6 3757 1 1 39 LYS HG2 H 4.997 15.541 14.121 1.00 . A A . 39 LYS HG2 1 1 6 3758 1 1 39 LYS HG3 H 6.453 16.337 13.519 1.00 . A A . 39 LYS HG3 1 1 6 3759 1 1 39 LYS HZ1 H 6.095 18.339 10.671 1.00 . A A . 39 LYS HZ1 1 1 6 3760 1 1 39 LYS HZ2 H 6.769 17.642 12.058 1.00 . A A . 39 LYS HZ2 1 1 6 3761 1 1 39 LYS HZ3 H 5.860 19.063 12.182 1.00 . A A . 39 LYS HZ3 1 1 6 3762 1 1 39 LYS N N 4.942 12.787 11.965 1.00 . A A . 39 LYS N 1 1 6 3763 1 1 39 LYS NZ N 5.945 18.154 11.684 1.00 . A A . 39 LYS NZ 1 1 6 3764 1 1 39 LYS O O 3.327 13.821 13.996 1.00 . A A . 39 LYS O 1 1 6 3765 1 1 40 PRO C C 3.476 14.426 17.077 1.00 . A A . 40 PRO C 1 1 6 3766 1 1 40 PRO CA C 3.632 12.973 16.642 1.00 . A A . 40 PRO CA 1 1 6 3767 1 1 40 PRO CB C 4.229 12.136 17.776 1.00 . A A . 40 PRO CB 1 1 6 3768 1 1 40 PRO CD C 5.831 12.136 16.002 1.00 . A A . 40 PRO CD 1 1 6 3769 1 1 40 PRO CG C 5.692 12.112 17.499 1.00 . A A . 40 PRO CG 1 1 6 3770 1 1 40 PRO HA H 2.665 12.575 16.368 1.00 . A A . 40 PRO HA 1 1 6 3771 1 1 40 PRO HB2 H 4.012 12.605 18.725 1.00 . A A . 40 PRO HB2 1 1 6 3772 1 1 40 PRO HB3 H 3.807 11.142 17.755 1.00 . A A . 40 PRO HB3 1 1 6 3773 1 1 40 PRO HD2 H 6.709 12.695 15.713 1.00 . A A . 40 PRO HD2 1 1 6 3774 1 1 40 PRO HD3 H 5.876 11.130 15.611 1.00 . A A . 40 PRO HD3 1 1 6 3775 1 1 40 PRO HG2 H 6.162 12.982 17.933 1.00 . A A . 40 PRO HG2 1 1 6 3776 1 1 40 PRO HG3 H 6.127 11.209 17.901 1.00 . A A . 40 PRO HG3 1 1 6 3777 1 1 40 PRO N N 4.604 12.818 15.556 1.00 . A A . 40 PRO N 1 1 6 3778 1 1 40 PRO O O 2.374 14.874 17.395 1.00 . A A . 40 PRO O 1 1 6 3779 1 1 41 SER C C 5.592 17.363 16.687 1.00 . A A . 41 SER C 1 1 6 3780 1 1 41 SER CA C 4.573 16.560 17.489 1.00 . A A . 41 SER CA 1 1 6 3781 1 1 41 SER CB C 4.868 16.688 18.985 1.00 . A A . 41 SER CB 1 1 6 3782 1 1 41 SER H H 5.434 14.743 16.825 1.00 . A A . 41 SER H 1 1 6 3783 1 1 41 SER HA H 3.586 16.952 17.291 1.00 . A A . 41 SER HA 1 1 6 3784 1 1 41 SER HB2 H 5.798 16.188 19.210 1.00 . A A . 41 SER HB2 1 1 6 3785 1 1 41 SER HB3 H 4.951 17.734 19.244 1.00 . A A . 41 SER HB3 1 1 6 3786 1 1 41 SER HG H 3.392 15.428 19.245 1.00 . A A . 41 SER HG 1 1 6 3787 1 1 41 SER N N 4.586 15.157 17.089 1.00 . A A . 41 SER N 1 1 6 3788 1 1 41 SER O O 6.650 16.854 16.319 1.00 . A A . 41 SER O 1 1 6 3789 1 1 41 SER OG O 3.836 16.104 19.761 1.00 . A A . 41 SER OG 1 1 6 3790 1 1 42 GLY C C 5.419 20.531 14.862 1.00 . A A . 42 GLY C 1 1 6 3791 1 1 42 GLY CA C 6.160 19.478 15.662 1.00 . A A . 42 GLY CA 1 1 6 3792 1 1 42 GLY H H 4.407 18.976 16.737 1.00 . A A . 42 GLY H 1 1 6 3793 1 1 42 GLY HA2 H 6.835 19.969 16.346 1.00 . A A . 42 GLY HA2 1 1 6 3794 1 1 42 GLY HA3 H 6.735 18.865 14.982 1.00 . A A . 42 GLY HA3 1 1 6 3795 1 1 42 GLY N N 5.264 18.623 16.419 1.00 . A A . 42 GLY N 1 1 6 3796 1 1 42 GLY O O 5.188 20.381 13.662 1.00 . A A . 42 GLY O 1 1 6 3797 1 1 43 PRO C C 5.181 23.515 13.926 1.00 . A A . 43 PRO C 1 1 6 3798 1 1 43 PRO CA C 4.307 22.729 14.898 1.00 . A A . 43 PRO CA 1 1 6 3799 1 1 43 PRO CB C 3.896 23.611 16.080 1.00 . A A . 43 PRO CB 1 1 6 3800 1 1 43 PRO CD C 5.275 21.871 16.965 1.00 . A A . 43 PRO CD 1 1 6 3801 1 1 43 PRO CG C 4.901 23.317 17.139 1.00 . A A . 43 PRO CG 1 1 6 3802 1 1 43 PRO HA H 3.424 22.379 14.384 1.00 . A A . 43 PRO HA 1 1 6 3803 1 1 43 PRO HB2 H 3.925 24.650 15.784 1.00 . A A . 43 PRO HB2 1 1 6 3804 1 1 43 PRO HB3 H 2.898 23.350 16.399 1.00 . A A . 43 PRO HB3 1 1 6 3805 1 1 43 PRO HD2 H 6.315 21.718 17.212 1.00 . A A . 43 PRO HD2 1 1 6 3806 1 1 43 PRO HD3 H 4.644 21.242 17.576 1.00 . A A . 43 PRO HD3 1 1 6 3807 1 1 43 PRO HG2 H 5.767 23.947 17.008 1.00 . A A . 43 PRO HG2 1 1 6 3808 1 1 43 PRO HG3 H 4.464 23.476 18.114 1.00 . A A . 43 PRO HG3 1 1 6 3809 1 1 43 PRO N N 5.033 21.626 15.534 1.00 . A A . 43 PRO N 1 1 6 3810 1 1 43 PRO O O 5.793 24.516 14.297 1.00 . A A . 43 PRO O 1 1 6 3811 1 1 44 SER C C 5.601 23.274 10.261 1.00 . A A . 44 SER C 1 1 6 3812 1 1 44 SER CA C 6.037 23.711 11.656 1.00 . A A . 44 SER CA 1 1 6 3813 1 1 44 SER CB C 7.520 23.398 11.860 1.00 . A A . 44 SER CB 1 1 6 3814 1 1 44 SER H H 4.724 22.250 12.446 1.00 . A A . 44 SER H 1 1 6 3815 1 1 44 SER HA H 5.886 24.776 11.750 1.00 . A A . 44 SER HA 1 1 6 3816 1 1 44 SER HB2 H 7.650 22.331 11.962 1.00 . A A . 44 SER HB2 1 1 6 3817 1 1 44 SER HB3 H 8.081 23.749 11.006 1.00 . A A . 44 SER HB3 1 1 6 3818 1 1 44 SER HG H 8.196 23.370 13.699 1.00 . A A . 44 SER HG 1 1 6 3819 1 1 44 SER N N 5.235 23.053 12.681 1.00 . A A . 44 SER N 1 1 6 3820 1 1 44 SER O O 5.290 22.105 10.033 1.00 . A A . 44 SER O 1 1 6 3821 1 1 44 SER OG O 8.019 24.031 13.026 1.00 . A A . 44 SER OG 1 1 6 3822 1 1 45 SER C C 6.192 24.503 6.966 1.00 . A A . 45 SER C 1 1 6 3823 1 1 45 SER CA C 5.179 23.938 7.957 1.00 . A A . 45 SER CA 1 1 6 3824 1 1 45 SER CB C 3.793 24.522 7.677 1.00 . A A . 45 SER CB 1 1 6 3825 1 1 45 SER H H 5.839 25.136 9.573 1.00 . A A . 45 SER H 1 1 6 3826 1 1 45 SER HA H 5.138 22.865 7.840 1.00 . A A . 45 SER HA 1 1 6 3827 1 1 45 SER HB2 H 3.106 24.198 8.444 1.00 . A A . 45 SER HB2 1 1 6 3828 1 1 45 SER HB3 H 3.853 25.601 7.681 1.00 . A A . 45 SER HB3 1 1 6 3829 1 1 45 SER HG H 3.882 24.424 5.722 1.00 . A A . 45 SER HG 1 1 6 3830 1 1 45 SER N N 5.580 24.223 9.330 1.00 . A A . 45 SER N 1 1 6 3831 1 1 45 SER O O 6.748 25.580 7.177 1.00 . A A . 45 SER O 1 1 6 3832 1 1 45 SER OG O 3.305 24.096 6.417 1.00 . A A . 45 SER OG 1 1 6 3833 1 1 46 GLY C C 6.687 24.767 3.644 1.00 . A A . 46 GLY C 1 1 6 3834 1 1 46 GLY CA C 7.371 24.211 4.876 1.00 . A A . 46 GLY CA 1 1 6 3835 1 1 46 GLY H H 5.953 22.917 5.769 1.00 . A A . 46 GLY H 1 1 6 3836 1 1 46 GLY HA2 H 8.002 24.977 5.302 1.00 . A A . 46 GLY HA2 1 1 6 3837 1 1 46 GLY HA3 H 7.987 23.373 4.584 1.00 . A A . 46 GLY HA3 1 1 6 3838 1 1 46 GLY N N 6.426 23.767 5.884 1.00 . A A . 46 GLY N 1 1 6 3839 1 1 46 GLY O O 6.392 24.003 2.725 1.00 . A A . 46 GLY O 1 1 6 3840 2 2 1 ZN ZN ZN -0.009 4.614 -0.831 1.00 . B A . 201 ZN ZN 1 1 7 3841 1 1 1 GLY C C -22.284 2.283 -19.290 1.00 . A A . 1 GLY C 1 1 7 3842 1 1 1 GLY CA C -22.282 1.497 -20.586 1.00 . A A . 1 GLY CA 1 1 7 3843 1 1 1 GLY H1 H -22.305 2.997 -22.080 1.00 . A A . 1 GLY H1 1 1 7 3844 1 1 1 GLY HA2 H -22.874 0.604 -20.454 1.00 . A A . 1 GLY HA2 1 1 7 3845 1 1 1 GLY HA3 H -21.266 1.212 -20.819 1.00 . A A . 1 GLY HA3 1 1 7 3846 1 1 1 GLY N N -22.822 2.258 -21.697 1.00 . A A . 1 GLY N 1 1 7 3847 1 1 1 GLY O O -21.435 3.150 -19.081 1.00 . A A . 1 GLY O 1 1 7 3848 1 1 2 SER C C -22.240 2.236 -16.187 1.00 . A A . 2 SER C 1 1 7 3849 1 1 2 SER CA C -23.352 2.670 -17.137 1.00 . A A . 2 SER CA 1 1 7 3850 1 1 2 SER CB C -24.716 2.395 -16.503 1.00 . A A . 2 SER CB 1 1 7 3851 1 1 2 SER H H -23.887 1.280 -18.642 1.00 . A A . 2 SER H 1 1 7 3852 1 1 2 SER HA H -23.258 3.730 -17.322 1.00 . A A . 2 SER HA 1 1 7 3853 1 1 2 SER HB2 H -24.827 1.333 -16.341 1.00 . A A . 2 SER HB2 1 1 7 3854 1 1 2 SER HB3 H -24.782 2.912 -15.557 1.00 . A A . 2 SER HB3 1 1 7 3855 1 1 2 SER HG H -25.578 2.597 -18.250 1.00 . A A . 2 SER HG 1 1 7 3856 1 1 2 SER N N -23.240 1.982 -18.417 1.00 . A A . 2 SER N 1 1 7 3857 1 1 2 SER O O -21.413 3.046 -15.769 1.00 . A A . 2 SER O 1 1 7 3858 1 1 2 SER OG O -25.768 2.841 -17.341 1.00 . A A . 2 SER OG 1 1 7 3859 1 1 3 SER C C -20.379 -0.657 -15.647 1.00 . A A . 3 SER C 1 1 7 3860 1 1 3 SER CA C -21.219 0.407 -14.947 1.00 . A A . 3 SER CA 1 1 7 3861 1 1 3 SER CB C -21.886 -0.190 -13.706 1.00 . A A . 3 SER CB 1 1 7 3862 1 1 3 SER H H -22.913 0.353 -16.217 1.00 . A A . 3 SER H 1 1 7 3863 1 1 3 SER HA H -20.574 1.217 -14.644 1.00 . A A . 3 SER HA 1 1 7 3864 1 1 3 SER HB2 H -22.749 0.403 -13.444 1.00 . A A . 3 SER HB2 1 1 7 3865 1 1 3 SER HB3 H -22.195 -1.203 -13.918 1.00 . A A . 3 SER HB3 1 1 7 3866 1 1 3 SER HG H -20.976 0.661 -12.193 1.00 . A A . 3 SER HG 1 1 7 3867 1 1 3 SER N N -22.227 0.950 -15.850 1.00 . A A . 3 SER N 1 1 7 3868 1 1 3 SER O O -20.739 -1.143 -16.719 1.00 . A A . 3 SER O 1 1 7 3869 1 1 3 SER OG O -20.993 -0.206 -12.606 1.00 . A A . 3 SER OG 1 1 7 3870 1 1 4 GLY C C -17.698 -2.867 -14.557 1.00 . A A . 4 GLY C 1 1 7 3871 1 1 4 GLY CA C -18.379 -2.016 -15.610 1.00 . A A . 4 GLY CA 1 1 7 3872 1 1 4 GLY H H -19.018 -0.592 -14.179 1.00 . A A . 4 GLY H 1 1 7 3873 1 1 4 GLY HA2 H -18.961 -2.658 -16.255 1.00 . A A . 4 GLY HA2 1 1 7 3874 1 1 4 GLY HA3 H -17.623 -1.520 -16.200 1.00 . A A . 4 GLY HA3 1 1 7 3875 1 1 4 GLY N N -19.255 -1.014 -15.032 1.00 . A A . 4 GLY N 1 1 7 3876 1 1 4 GLY O O -16.500 -2.725 -14.314 1.00 . A A . 4 GLY O 1 1 7 3877 1 1 5 SER C C -17.447 -5.947 -13.487 1.00 . A A . 5 SER C 1 1 7 3878 1 1 5 SER CA C -17.928 -4.627 -12.891 1.00 . A A . 5 SER CA 1 1 7 3879 1 1 5 SER CB C -18.989 -4.895 -11.822 1.00 . A A . 5 SER CB 1 1 7 3880 1 1 5 SER H H -19.413 -3.820 -14.166 1.00 . A A . 5 SER H 1 1 7 3881 1 1 5 SER HA H -17.089 -4.124 -12.435 1.00 . A A . 5 SER HA 1 1 7 3882 1 1 5 SER HB2 H -19.570 -3.999 -11.662 1.00 . A A . 5 SER HB2 1 1 7 3883 1 1 5 SER HB3 H -19.639 -5.691 -12.155 1.00 . A A . 5 SER HB3 1 1 7 3884 1 1 5 SER HG H -17.990 -6.143 -10.690 1.00 . A A . 5 SER HG 1 1 7 3885 1 1 5 SER N N -18.464 -3.754 -13.928 1.00 . A A . 5 SER N 1 1 7 3886 1 1 5 SER O O -17.678 -7.016 -12.923 1.00 . A A . 5 SER O 1 1 7 3887 1 1 5 SER OG O -18.392 -5.276 -10.595 1.00 . A A . 5 SER OG 1 1 7 3888 1 1 6 SER C C -14.766 -7.207 -15.066 1.00 . A A . 6 SER C 1 1 7 3889 1 1 6 SER CA C -16.264 -7.048 -15.307 1.00 . A A . 6 SER CA 1 1 7 3890 1 1 6 SER CB C -16.544 -6.966 -16.809 1.00 . A A . 6 SER CB 1 1 7 3891 1 1 6 SER H H -16.623 -4.980 -15.031 1.00 . A A . 6 SER H 1 1 7 3892 1 1 6 SER HA H -16.775 -7.908 -14.900 1.00 . A A . 6 SER HA 1 1 7 3893 1 1 6 SER HB2 H -16.088 -6.074 -17.209 1.00 . A A . 6 SER HB2 1 1 7 3894 1 1 6 SER HB3 H -16.127 -7.835 -17.298 1.00 . A A . 6 SER HB3 1 1 7 3895 1 1 6 SER HG H -18.093 -6.504 -17.916 1.00 . A A . 6 SER HG 1 1 7 3896 1 1 6 SER N N -16.775 -5.862 -14.631 1.00 . A A . 6 SER N 1 1 7 3897 1 1 6 SER O O -14.010 -7.533 -15.980 1.00 . A A . 6 SER O 1 1 7 3898 1 1 6 SER OG O -17.937 -6.922 -17.066 1.00 . A A . 6 SER OG 1 1 7 3899 1 1 7 GLY C C -12.368 -5.814 -12.910 1.00 . A A . 7 GLY C 1 1 7 3900 1 1 7 GLY CA C -12.938 -7.095 -13.486 1.00 . A A . 7 GLY CA 1 1 7 3901 1 1 7 GLY H H -14.992 -6.716 -13.138 1.00 . A A . 7 GLY H 1 1 7 3902 1 1 7 GLY HA2 H -12.822 -7.887 -12.761 1.00 . A A . 7 GLY HA2 1 1 7 3903 1 1 7 GLY HA3 H -12.385 -7.353 -14.377 1.00 . A A . 7 GLY HA3 1 1 7 3904 1 1 7 GLY N N -14.344 -6.973 -13.827 1.00 . A A . 7 GLY N 1 1 7 3905 1 1 7 GLY O O -12.046 -4.882 -13.647 1.00 . A A . 7 GLY O 1 1 7 3906 1 1 8 THR C C -10.592 -4.966 -9.950 1.00 . A A . 8 THR C 1 1 7 3907 1 1 8 THR CA C -11.712 -4.588 -10.912 1.00 . A A . 8 THR CA 1 1 7 3908 1 1 8 THR CB C -12.812 -3.842 -10.134 1.00 . A A . 8 THR CB 1 1 7 3909 1 1 8 THR CG2 C -12.300 -2.504 -9.623 1.00 . A A . 8 THR CG2 1 1 7 3910 1 1 8 THR H H -12.519 -6.540 -11.054 1.00 . A A . 8 THR H 1 1 7 3911 1 1 8 THR HA H -11.318 -3.922 -11.666 1.00 . A A . 8 THR HA 1 1 7 3912 1 1 8 THR HB H -13.105 -4.446 -9.287 1.00 . A A . 8 THR HB 1 1 7 3913 1 1 8 THR HG1 H -14.602 -3.103 -10.507 1.00 . A A . 8 THR HG1 1 1 7 3914 1 1 8 THR HG21 H -12.494 -1.739 -10.360 1.00 . A A . 8 THR HG21 1 1 7 3915 1 1 8 THR HG22 H -11.237 -2.570 -9.444 1.00 . A A . 8 THR HG22 1 1 7 3916 1 1 8 THR HG23 H -12.805 -2.253 -8.702 1.00 . A A . 8 THR HG23 1 1 7 3917 1 1 8 THR N N -12.244 -5.765 -11.587 1.00 . A A . 8 THR N 1 1 7 3918 1 1 8 THR O O -10.843 -5.350 -8.809 1.00 . A A . 8 THR O 1 1 7 3919 1 1 8 THR OG1 O -13.952 -3.632 -10.975 1.00 . A A . 8 THR OG1 1 1 7 3920 1 1 9 GLY C C -7.149 -5.960 -10.341 1.00 . A A . 9 GLY C 1 1 7 3921 1 1 9 GLY CA C -8.211 -5.186 -9.586 1.00 . A A . 9 GLY CA 1 1 7 3922 1 1 9 GLY H H -9.212 -4.541 -11.338 1.00 . A A . 9 GLY H 1 1 7 3923 1 1 9 GLY HA2 H -7.776 -4.273 -9.209 1.00 . A A . 9 GLY HA2 1 1 7 3924 1 1 9 GLY HA3 H -8.551 -5.783 -8.753 1.00 . A A . 9 GLY HA3 1 1 7 3925 1 1 9 GLY N N -9.352 -4.853 -10.419 1.00 . A A . 9 GLY N 1 1 7 3926 1 1 9 GLY O O -7.465 -6.821 -11.161 1.00 . A A . 9 GLY O 1 1 7 3927 1 1 10 GLU C C -3.944 -7.119 -9.724 1.00 . A A . 10 GLU C 1 1 7 3928 1 1 10 GLU CA C -4.774 -6.323 -10.727 1.00 . A A . 10 GLU CA 1 1 7 3929 1 1 10 GLU CB C -3.886 -5.303 -11.444 1.00 . A A . 10 GLU CB 1 1 7 3930 1 1 10 GLU CD C -5.077 -5.224 -13.671 1.00 . A A . 10 GLU CD 1 1 7 3931 1 1 10 GLU CG C -4.636 -4.443 -12.448 1.00 . A A . 10 GLU CG 1 1 7 3932 1 1 10 GLU H H -5.697 -4.955 -9.402 1.00 . A A . 10 GLU H 1 1 7 3933 1 1 10 GLU HA H -5.185 -7.004 -11.457 1.00 . A A . 10 GLU HA 1 1 7 3934 1 1 10 GLU HB2 H -3.438 -4.653 -10.708 1.00 . A A . 10 GLU HB2 1 1 7 3935 1 1 10 GLU HB3 H -3.104 -5.832 -11.969 1.00 . A A . 10 GLU HB3 1 1 7 3936 1 1 10 GLU HG2 H -5.511 -4.032 -11.968 1.00 . A A . 10 GLU HG2 1 1 7 3937 1 1 10 GLU HG3 H -3.990 -3.638 -12.767 1.00 . A A . 10 GLU HG3 1 1 7 3938 1 1 10 GLU N N -5.886 -5.651 -10.065 1.00 . A A . 10 GLU N 1 1 7 3939 1 1 10 GLU O O -3.480 -8.221 -10.019 1.00 . A A . 10 GLU O 1 1 7 3940 1 1 10 GLU OE1 O -4.203 -5.609 -14.475 1.00 . A A . 10 GLU OE1 1 1 7 3941 1 1 10 GLU OE2 O -6.296 -5.450 -13.823 1.00 . A A . 10 GLU OE2 1 1 7 3942 1 1 11 LYS C C -3.875 -7.562 -6.298 1.00 . A A . 11 LYS C 1 1 7 3943 1 1 11 LYS CA C -2.987 -7.208 -7.487 1.00 . A A . 11 LYS CA 1 1 7 3944 1 1 11 LYS CB C -1.841 -6.303 -7.030 1.00 . A A . 11 LYS CB 1 1 7 3945 1 1 11 LYS CD C -0.031 -7.285 -8.469 1.00 . A A . 11 LYS CD 1 1 7 3946 1 1 11 LYS CE C 0.830 -7.074 -9.705 1.00 . A A . 11 LYS CE 1 1 7 3947 1 1 11 LYS CG C -0.812 -6.031 -8.113 1.00 . A A . 11 LYS CG 1 1 7 3948 1 1 11 LYS H H -4.155 -5.672 -8.360 1.00 . A A . 11 LYS H 1 1 7 3949 1 1 11 LYS HA H -2.576 -8.117 -7.897 1.00 . A A . 11 LYS HA 1 1 7 3950 1 1 11 LYS HB2 H -2.251 -5.358 -6.706 1.00 . A A . 11 LYS HB2 1 1 7 3951 1 1 11 LYS HB3 H -1.339 -6.773 -6.196 1.00 . A A . 11 LYS HB3 1 1 7 3952 1 1 11 LYS HD2 H 0.608 -7.548 -7.640 1.00 . A A . 11 LYS HD2 1 1 7 3953 1 1 11 LYS HD3 H -0.727 -8.090 -8.659 1.00 . A A . 11 LYS HD3 1 1 7 3954 1 1 11 LYS HE2 H 0.186 -6.861 -10.544 1.00 . A A . 11 LYS HE2 1 1 7 3955 1 1 11 LYS HE3 H 1.485 -6.232 -9.531 1.00 . A A . 11 LYS HE3 1 1 7 3956 1 1 11 LYS HG2 H -1.319 -5.673 -8.997 1.00 . A A . 11 LYS HG2 1 1 7 3957 1 1 11 LYS HG3 H -0.122 -5.277 -7.761 1.00 . A A . 11 LYS HG3 1 1 7 3958 1 1 11 LYS HZ1 H 2.081 -8.652 -9.148 1.00 . A A . 11 LYS HZ1 1 1 7 3959 1 1 11 LYS HZ2 H 2.415 -8.021 -10.682 1.00 . A A . 11 LYS HZ2 1 1 7 3960 1 1 11 LYS HZ3 H 1.063 -9.011 -10.450 1.00 . A A . 11 LYS HZ3 1 1 7 3961 1 1 11 LYS N N -3.760 -6.553 -8.536 1.00 . A A . 11 LYS N 1 1 7 3962 1 1 11 LYS NZ N 1.655 -8.273 -10.018 1.00 . A A . 11 LYS NZ 1 1 7 3963 1 1 11 LYS O O -4.903 -6.932 -6.051 1.00 . A A . 11 LYS O 1 1 7 3964 1 1 12 PRO C C -4.148 -8.055 -3.214 1.00 . A A . 12 PRO C 1 1 7 3965 1 1 12 PRO CA C -4.213 -9.052 -4.366 1.00 . A A . 12 PRO CA 1 1 7 3966 1 1 12 PRO CB C -3.505 -10.355 -3.985 1.00 . A A . 12 PRO CB 1 1 7 3967 1 1 12 PRO CD C -2.253 -9.389 -5.778 1.00 . A A . 12 PRO CD 1 1 7 3968 1 1 12 PRO CG C -2.124 -10.207 -4.523 1.00 . A A . 12 PRO CG 1 1 7 3969 1 1 12 PRO HA H -5.246 -9.258 -4.604 1.00 . A A . 12 PRO HA 1 1 7 3970 1 1 12 PRO HB2 H -3.502 -10.466 -2.910 1.00 . A A . 12 PRO HB2 1 1 7 3971 1 1 12 PRO HB3 H -4.017 -11.192 -4.437 1.00 . A A . 12 PRO HB3 1 1 7 3972 1 1 12 PRO HD2 H -1.392 -8.750 -5.903 1.00 . A A . 12 PRO HD2 1 1 7 3973 1 1 12 PRO HD3 H -2.375 -10.033 -6.637 1.00 . A A . 12 PRO HD3 1 1 7 3974 1 1 12 PRO HG2 H -1.503 -9.694 -3.804 1.00 . A A . 12 PRO HG2 1 1 7 3975 1 1 12 PRO HG3 H -1.712 -11.179 -4.750 1.00 . A A . 12 PRO HG3 1 1 7 3976 1 1 12 PRO N N -3.469 -8.593 -5.542 1.00 . A A . 12 PRO N 1 1 7 3977 1 1 12 PRO O O -5.046 -8.005 -2.372 1.00 . A A . 12 PRO O 1 1 7 3978 1 1 13 TYR C C -3.126 -4.860 -2.670 1.00 . A A . 13 TYR C 1 1 7 3979 1 1 13 TYR CA C -2.900 -6.269 -2.131 1.00 . A A . 13 TYR CA 1 1 7 3980 1 1 13 TYR CB C -1.496 -6.379 -1.533 1.00 . A A . 13 TYR CB 1 1 7 3981 1 1 13 TYR CD1 C -1.590 -8.128 0.286 1.00 . A A . 13 TYR CD1 1 1 7 3982 1 1 13 TYR CD2 C -0.462 -8.673 -1.742 1.00 . A A . 13 TYR CD2 1 1 7 3983 1 1 13 TYR CE1 C -1.300 -9.381 0.790 1.00 . A A . 13 TYR CE1 1 1 7 3984 1 1 13 TYR CE2 C -0.169 -9.929 -1.246 1.00 . A A . 13 TYR CE2 1 1 7 3985 1 1 13 TYR CG C -1.177 -7.752 -0.987 1.00 . A A . 13 TYR CG 1 1 7 3986 1 1 13 TYR CZ C -0.590 -10.278 0.020 1.00 . A A . 13 TYR CZ 1 1 7 3987 1 1 13 TYR H H -2.400 -7.351 -3.880 1.00 . A A . 13 TYR H 1 1 7 3988 1 1 13 TYR HA H -3.627 -6.467 -1.357 1.00 . A A . 13 TYR HA 1 1 7 3989 1 1 13 TYR HB2 H -0.768 -6.149 -2.296 1.00 . A A . 13 TYR HB2 1 1 7 3990 1 1 13 TYR HB3 H -1.400 -5.669 -0.725 1.00 . A A . 13 TYR HB3 1 1 7 3991 1 1 13 TYR HD1 H -2.147 -7.423 0.887 1.00 . A A . 13 TYR HD1 1 1 7 3992 1 1 13 TYR HD2 H -0.133 -8.396 -2.733 1.00 . A A . 13 TYR HD2 1 1 7 3993 1 1 13 TYR HE1 H -1.630 -9.655 1.781 1.00 . A A . 13 TYR HE1 1 1 7 3994 1 1 13 TYR HE2 H 0.388 -10.632 -1.849 1.00 . A A . 13 TYR HE2 1 1 7 3995 1 1 13 TYR HH H -0.922 -12.166 0.164 1.00 . A A . 13 TYR HH 1 1 7 3996 1 1 13 TYR N N -3.082 -7.264 -3.182 1.00 . A A . 13 TYR N 1 1 7 3997 1 1 13 TYR O O -2.749 -4.547 -3.800 1.00 . A A . 13 TYR O 1 1 7 3998 1 1 13 TYR OH O -0.299 -11.528 0.518 1.00 . A A . 13 TYR OH 1 1 7 3999 1 1 14 ARG C C -3.828 -1.685 -1.069 1.00 . A A . 14 ARG C 1 1 7 4000 1 1 14 ARG CA C -4.021 -2.637 -2.246 1.00 . A A . 14 ARG CA 1 1 7 4001 1 1 14 ARG CB C -5.448 -2.516 -2.784 1.00 . A A . 14 ARG CB 1 1 7 4002 1 1 14 ARG CD C -6.409 -0.295 -2.104 1.00 . A A . 14 ARG CD 1 1 7 4003 1 1 14 ARG CG C -5.811 -1.111 -3.239 1.00 . A A . 14 ARG CG 1 1 7 4004 1 1 14 ARG CZ C -8.603 -0.159 -1.003 1.00 . A A . 14 ARG CZ 1 1 7 4005 1 1 14 ARG H H -4.020 -4.321 -0.965 1.00 . A A . 14 ARG H 1 1 7 4006 1 1 14 ARG HA H -3.327 -2.369 -3.029 1.00 . A A . 14 ARG HA 1 1 7 4007 1 1 14 ARG HB2 H -5.561 -3.183 -3.626 1.00 . A A . 14 ARG HB2 1 1 7 4008 1 1 14 ARG HB3 H -6.139 -2.809 -2.008 1.00 . A A . 14 ARG HB3 1 1 7 4009 1 1 14 ARG HD2 H -5.702 -0.265 -1.288 1.00 . A A . 14 ARG HD2 1 1 7 4010 1 1 14 ARG HD3 H -6.593 0.708 -2.458 1.00 . A A . 14 ARG HD3 1 1 7 4011 1 1 14 ARG HE H -7.812 -1.823 -1.767 1.00 . A A . 14 ARG HE 1 1 7 4012 1 1 14 ARG HG2 H -4.918 -0.616 -3.592 1.00 . A A . 14 ARG HG2 1 1 7 4013 1 1 14 ARG HG3 H -6.530 -1.177 -4.042 1.00 . A A . 14 ARG HG3 1 1 7 4014 1 1 14 ARG HH11 H -7.591 1.587 -1.101 1.00 . A A . 14 ARG HH11 1 1 7 4015 1 1 14 ARG HH12 H -9.139 1.669 -0.327 1.00 . A A . 14 ARG HH12 1 1 7 4016 1 1 14 ARG HH21 H -9.852 -1.728 -0.750 1.00 . A A . 14 ARG HH21 1 1 7 4017 1 1 14 ARG HH22 H -10.424 -0.217 -0.128 1.00 . A A . 14 ARG HH22 1 1 7 4018 1 1 14 ARG N N -3.744 -4.013 -1.853 1.00 . A A . 14 ARG N 1 1 7 4019 1 1 14 ARG NE N -7.664 -0.866 -1.622 1.00 . A A . 14 ARG NE 1 1 7 4020 1 1 14 ARG NH1 N -8.430 1.139 -0.793 1.00 . A A . 14 ARG NH1 1 1 7 4021 1 1 14 ARG NH2 N -9.718 -0.750 -0.593 1.00 . A A . 14 ARG NH2 1 1 7 4022 1 1 14 ARG O O -4.151 -2.018 0.071 1.00 . A A . 14 ARG O 1 1 7 4023 1 1 15 CYS C C -4.362 1.180 0.089 1.00 . A A . 15 CYS C 1 1 7 4024 1 1 15 CYS CA C -3.059 0.499 -0.320 1.00 . A A . 15 CYS CA 1 1 7 4025 1 1 15 CYS CB C -2.058 1.545 -0.815 1.00 . A A . 15 CYS CB 1 1 7 4026 1 1 15 CYS H H -3.059 -0.294 -2.283 1.00 . A A . 15 CYS H 1 1 7 4027 1 1 15 CYS HA H -2.645 -0.004 0.540 1.00 . A A . 15 CYS HA 1 1 7 4028 1 1 15 CYS HB2 H -1.239 1.043 -1.310 1.00 . A A . 15 CYS HB2 1 1 7 4029 1 1 15 CYS HB3 H -2.550 2.200 -1.518 1.00 . A A . 15 CYS HB3 1 1 7 4030 1 1 15 CYS N N -3.297 -0.501 -1.354 1.00 . A A . 15 CYS N 1 1 7 4031 1 1 15 CYS O O -5.008 1.845 -0.720 1.00 . A A . 15 CYS O 1 1 7 4032 1 1 15 CYS SG S -1.351 2.581 0.507 1.00 . A A . 15 CYS SG 1 1 7 4033 1 1 16 ALA C C -5.729 3.049 2.306 1.00 . A A . 16 ALA C 1 1 7 4034 1 1 16 ALA CA C -5.965 1.607 1.869 1.00 . A A . 16 ALA CA 1 1 7 4035 1 1 16 ALA CB C -6.506 0.784 3.029 1.00 . A A . 16 ALA CB 1 1 7 4036 1 1 16 ALA H H -4.184 0.467 1.948 1.00 . A A . 16 ALA H 1 1 7 4037 1 1 16 ALA HA H -6.702 1.597 1.078 1.00 . A A . 16 ALA HA 1 1 7 4038 1 1 16 ALA HB1 H -6.062 -0.200 3.009 1.00 . A A . 16 ALA HB1 1 1 7 4039 1 1 16 ALA HB2 H -6.259 1.271 3.961 1.00 . A A . 16 ALA HB2 1 1 7 4040 1 1 16 ALA HB3 H -7.578 0.698 2.940 1.00 . A A . 16 ALA HB3 1 1 7 4041 1 1 16 ALA N N -4.741 1.008 1.351 1.00 . A A . 16 ALA N 1 1 7 4042 1 1 16 ALA O O -6.370 3.538 3.235 1.00 . A A . 16 ALA O 1 1 7 4043 1 1 17 GLU C C -4.523 5.980 0.699 1.00 . A A . 17 GLU C 1 1 7 4044 1 1 17 GLU CA C -4.482 5.109 1.951 1.00 . A A . 17 GLU CA 1 1 7 4045 1 1 17 GLU CB C -3.101 5.197 2.603 1.00 . A A . 17 GLU CB 1 1 7 4046 1 1 17 GLU CD C -1.868 5.250 4.807 1.00 . A A . 17 GLU CD 1 1 7 4047 1 1 17 GLU CG C -3.082 4.744 4.053 1.00 . A A . 17 GLU CG 1 1 7 4048 1 1 17 GLU H H -4.326 3.278 0.899 1.00 . A A . 17 GLU H 1 1 7 4049 1 1 17 GLU HA H -5.223 5.468 2.649 1.00 . A A . 17 GLU HA 1 1 7 4050 1 1 17 GLU HB2 H -2.412 4.580 2.045 1.00 . A A . 17 GLU HB2 1 1 7 4051 1 1 17 GLU HB3 H -2.764 6.223 2.564 1.00 . A A . 17 GLU HB3 1 1 7 4052 1 1 17 GLU HG2 H -3.970 5.113 4.544 1.00 . A A . 17 GLU HG2 1 1 7 4053 1 1 17 GLU HG3 H -3.080 3.664 4.079 1.00 . A A . 17 GLU HG3 1 1 7 4054 1 1 17 GLU N N -4.804 3.723 1.630 1.00 . A A . 17 GLU N 1 1 7 4055 1 1 17 GLU O O -5.055 7.091 0.719 1.00 . A A . 17 GLU O 1 1 7 4056 1 1 17 GLU OE1 O -0.735 4.907 4.408 1.00 . A A . 17 GLU OE1 1 1 7 4057 1 1 17 GLU OE2 O -2.050 5.991 5.796 1.00 . A A . 17 GLU OE2 1 1 7 4058 1 1 18 CYS C C -4.662 5.430 -2.743 1.00 . A A . 18 CYS C 1 1 7 4059 1 1 18 CYS CA C -3.926 6.200 -1.651 1.00 . A A . 18 CYS CA 1 1 7 4060 1 1 18 CYS CB C -2.480 6.458 -2.080 1.00 . A A . 18 CYS CB 1 1 7 4061 1 1 18 CYS H H -3.548 4.579 -0.343 1.00 . A A . 18 CYS H 1 1 7 4062 1 1 18 CYS HA H -4.421 7.147 -1.498 1.00 . A A . 18 CYS HA 1 1 7 4063 1 1 18 CYS HB2 H -2.480 6.935 -3.049 1.00 . A A . 18 CYS HB2 1 1 7 4064 1 1 18 CYS HB3 H -2.011 7.115 -1.362 1.00 . A A . 18 CYS HB3 1 1 7 4065 1 1 18 CYS N N -3.956 5.470 -0.389 1.00 . A A . 18 CYS N 1 1 7 4066 1 1 18 CYS O O -5.506 5.984 -3.447 1.00 . A A . 18 CYS O 1 1 7 4067 1 1 18 CYS SG S -1.461 4.953 -2.204 1.00 . A A . 18 CYS SG 1 1 7 4068 1 1 19 GLY C C -3.984 2.746 -4.878 1.00 . A A . 19 GLY C 1 1 7 4069 1 1 19 GLY CA C -4.976 3.323 -3.886 1.00 . A A . 19 GLY CA 1 1 7 4070 1 1 19 GLY H H -3.656 3.760 -2.289 1.00 . A A . 19 GLY H 1 1 7 4071 1 1 19 GLY HA2 H -5.492 2.511 -3.396 1.00 . A A . 19 GLY HA2 1 1 7 4072 1 1 19 GLY HA3 H -5.696 3.923 -4.423 1.00 . A A . 19 GLY HA3 1 1 7 4073 1 1 19 GLY N N -4.336 4.148 -2.878 1.00 . A A . 19 GLY N 1 1 7 4074 1 1 19 GLY O O -4.085 2.990 -6.080 1.00 . A A . 19 GLY O 1 1 7 4075 1 1 20 LYS C C -2.138 -0.152 -5.215 1.00 . A A . 20 LYS C 1 1 7 4076 1 1 20 LYS CA C -2.008 1.368 -5.222 1.00 . A A . 20 LYS CA 1 1 7 4077 1 1 20 LYS CB C -0.609 1.773 -4.753 1.00 . A A . 20 LYS CB 1 1 7 4078 1 1 20 LYS CD C 1.620 2.638 -5.525 1.00 . A A . 20 LYS CD 1 1 7 4079 1 1 20 LYS CE C 2.823 2.311 -6.396 1.00 . A A . 20 LYS CE 1 1 7 4080 1 1 20 LYS CG C 0.434 1.747 -5.857 1.00 . A A . 20 LYS CG 1 1 7 4081 1 1 20 LYS H H -2.995 1.823 -3.406 1.00 . A A . 20 LYS H 1 1 7 4082 1 1 20 LYS HA H -2.158 1.725 -6.230 1.00 . A A . 20 LYS HA 1 1 7 4083 1 1 20 LYS HB2 H -0.653 2.775 -4.351 1.00 . A A . 20 LYS HB2 1 1 7 4084 1 1 20 LYS HB3 H -0.293 1.095 -3.973 1.00 . A A . 20 LYS HB3 1 1 7 4085 1 1 20 LYS HD2 H 1.341 3.669 -5.688 1.00 . A A . 20 LYS HD2 1 1 7 4086 1 1 20 LYS HD3 H 1.887 2.495 -4.488 1.00 . A A . 20 LYS HD3 1 1 7 4087 1 1 20 LYS HE2 H 2.484 2.135 -7.405 1.00 . A A . 20 LYS HE2 1 1 7 4088 1 1 20 LYS HE3 H 3.498 3.155 -6.386 1.00 . A A . 20 LYS HE3 1 1 7 4089 1 1 20 LYS HG2 H 0.784 0.734 -5.986 1.00 . A A . 20 LYS HG2 1 1 7 4090 1 1 20 LYS HG3 H -0.019 2.093 -6.775 1.00 . A A . 20 LYS HG3 1 1 7 4091 1 1 20 LYS HZ1 H 3.638 1.135 -4.874 1.00 . A A . 20 LYS HZ1 1 1 7 4092 1 1 20 LYS HZ2 H 4.499 1.067 -6.329 1.00 . A A . 20 LYS HZ2 1 1 7 4093 1 1 20 LYS HZ3 H 3.029 0.244 -6.177 1.00 . A A . 20 LYS HZ3 1 1 7 4094 1 1 20 LYS N N -3.023 1.981 -4.373 1.00 . A A . 20 LYS N 1 1 7 4095 1 1 20 LYS NZ N 3.548 1.105 -5.910 1.00 . A A . 20 LYS NZ 1 1 7 4096 1 1 20 LYS O O -2.877 -0.717 -4.409 1.00 . A A . 20 LYS O 1 1 7 4097 1 1 21 ALA C C -0.097 -2.866 -5.835 1.00 . A A . 21 ALA C 1 1 7 4098 1 1 21 ALA CA C -1.446 -2.262 -6.210 1.00 . A A . 21 ALA CA 1 1 7 4099 1 1 21 ALA CB C -1.846 -2.691 -7.614 1.00 . A A . 21 ALA CB 1 1 7 4100 1 1 21 ALA H H -0.843 -0.301 -6.731 1.00 . A A . 21 ALA H 1 1 7 4101 1 1 21 ALA HA H -2.195 -2.625 -5.521 1.00 . A A . 21 ALA HA 1 1 7 4102 1 1 21 ALA HB1 H -1.402 -3.650 -7.837 1.00 . A A . 21 ALA HB1 1 1 7 4103 1 1 21 ALA HB2 H -2.922 -2.770 -7.671 1.00 . A A . 21 ALA HB2 1 1 7 4104 1 1 21 ALA HB3 H -1.500 -1.958 -8.327 1.00 . A A . 21 ALA HB3 1 1 7 4105 1 1 21 ALA N N -1.413 -0.808 -6.116 1.00 . A A . 21 ALA N 1 1 7 4106 1 1 21 ALA O O 0.954 -2.327 -6.182 1.00 . A A . 21 ALA O 1 1 7 4107 1 1 22 PHE C C 0.932 -6.179 -4.800 1.00 . A A . 22 PHE C 1 1 7 4108 1 1 22 PHE CA C 1.087 -4.665 -4.700 1.00 . A A . 22 PHE CA 1 1 7 4109 1 1 22 PHE CB C 1.441 -4.271 -3.264 1.00 . A A . 22 PHE CB 1 1 7 4110 1 1 22 PHE CD1 C 3.019 -2.320 -3.303 1.00 . A A . 22 PHE CD1 1 1 7 4111 1 1 22 PHE CD2 C 0.736 -1.920 -2.741 1.00 . A A . 22 PHE CD2 1 1 7 4112 1 1 22 PHE CE1 C 3.295 -0.974 -3.153 1.00 . A A . 22 PHE CE1 1 1 7 4113 1 1 22 PHE CE2 C 1.007 -0.574 -2.590 1.00 . A A . 22 PHE CE2 1 1 7 4114 1 1 22 PHE CG C 1.738 -2.808 -3.100 1.00 . A A . 22 PHE CG 1 1 7 4115 1 1 22 PHE CZ C 2.288 -0.100 -2.795 1.00 . A A . 22 PHE CZ 1 1 7 4116 1 1 22 PHE H H -1.002 -4.370 -4.877 1.00 . A A . 22 PHE H 1 1 7 4117 1 1 22 PHE HA H 1.884 -4.352 -5.357 1.00 . A A . 22 PHE HA 1 1 7 4118 1 1 22 PHE HB2 H 0.613 -4.516 -2.616 1.00 . A A . 22 PHE HB2 1 1 7 4119 1 1 22 PHE HB3 H 2.313 -4.825 -2.952 1.00 . A A . 22 PHE HB3 1 1 7 4120 1 1 22 PHE HD1 H 3.808 -3.004 -3.584 1.00 . A A . 22 PHE HD1 1 1 7 4121 1 1 22 PHE HD2 H -0.266 -2.289 -2.579 1.00 . A A . 22 PHE HD2 1 1 7 4122 1 1 22 PHE HE1 H 4.298 -0.608 -3.315 1.00 . A A . 22 PHE HE1 1 1 7 4123 1 1 22 PHE HE2 H 0.218 0.108 -2.309 1.00 . A A . 22 PHE HE2 1 1 7 4124 1 1 22 PHE HZ H 2.502 0.952 -2.678 1.00 . A A . 22 PHE HZ 1 1 7 4125 1 1 22 PHE N N -0.133 -3.988 -5.124 1.00 . A A . 22 PHE N 1 1 7 4126 1 1 22 PHE O O -0.085 -6.740 -4.389 1.00 . A A . 22 PHE O 1 1 7 4127 1 1 23 THR C C 2.097 -8.987 -4.166 1.00 . A A . 23 THR C 1 1 7 4128 1 1 23 THR CA C 1.924 -8.286 -5.508 1.00 . A A . 23 THR CA 1 1 7 4129 1 1 23 THR CB C 3.028 -8.764 -6.470 1.00 . A A . 23 THR CB 1 1 7 4130 1 1 23 THR CG2 C 4.400 -8.324 -5.982 1.00 . A A . 23 THR CG2 1 1 7 4131 1 1 23 THR H H 2.730 -6.334 -5.660 1.00 . A A . 23 THR H 1 1 7 4132 1 1 23 THR HA H 0.967 -8.561 -5.926 1.00 . A A . 23 THR HA 1 1 7 4133 1 1 23 THR HB H 2.851 -8.327 -7.442 1.00 . A A . 23 THR HB 1 1 7 4134 1 1 23 THR HG1 H 2.094 -10.475 -6.773 1.00 . A A . 23 THR HG1 1 1 7 4135 1 1 23 THR HG21 H 4.944 -7.872 -6.797 1.00 . A A . 23 THR HG21 1 1 7 4136 1 1 23 THR HG22 H 4.945 -9.183 -5.618 1.00 . A A . 23 THR HG22 1 1 7 4137 1 1 23 THR HG23 H 4.284 -7.606 -5.183 1.00 . A A . 23 THR HG23 1 1 7 4138 1 1 23 THR N N 1.947 -6.837 -5.351 1.00 . A A . 23 THR N 1 1 7 4139 1 1 23 THR O O 1.582 -10.086 -3.957 1.00 . A A . 23 THR O 1 1 7 4140 1 1 23 THR OG1 O 2.992 -10.191 -6.586 1.00 . A A . 23 THR OG1 1 1 7 4141 1 1 24 ASP C C 2.944 -7.833 -0.857 1.00 . A A . 24 ASP C 1 1 7 4142 1 1 24 ASP CA C 3.064 -8.908 -1.934 1.00 . A A . 24 ASP CA 1 1 7 4143 1 1 24 ASP CB C 4.448 -9.555 -1.873 1.00 . A A . 24 ASP CB 1 1 7 4144 1 1 24 ASP CG C 4.428 -11.006 -2.313 1.00 . A A . 24 ASP CG 1 1 7 4145 1 1 24 ASP H H 3.209 -7.473 -3.483 1.00 . A A . 24 ASP H 1 1 7 4146 1 1 24 ASP HA H 2.315 -9.664 -1.754 1.00 . A A . 24 ASP HA 1 1 7 4147 1 1 24 ASP HB2 H 5.121 -9.012 -2.521 1.00 . A A . 24 ASP HB2 1 1 7 4148 1 1 24 ASP HB3 H 4.816 -9.510 -0.859 1.00 . A A . 24 ASP HB3 1 1 7 4149 1 1 24 ASP N N 2.825 -8.346 -3.258 1.00 . A A . 24 ASP N 1 1 7 4150 1 1 24 ASP O O 3.033 -6.639 -1.146 1.00 . A A . 24 ASP O 1 1 7 4151 1 1 24 ASP OD1 O 4.594 -11.261 -3.524 1.00 . A A . 24 ASP OD1 1 1 7 4152 1 1 24 ASP OD2 O 4.246 -11.886 -1.446 1.00 . A A . 24 ASP OD2 1 1 7 4153 1 1 25 ARG C C 3.885 -6.529 1.693 1.00 . A A . 25 ARG C 1 1 7 4154 1 1 25 ARG CA C 2.607 -7.340 1.502 1.00 . A A . 25 ARG CA 1 1 7 4155 1 1 25 ARG CB C 2.277 -8.103 2.786 1.00 . A A . 25 ARG CB 1 1 7 4156 1 1 25 ARG CD C 0.519 -9.182 4.221 1.00 . A A . 25 ARG CD 1 1 7 4157 1 1 25 ARG CG C 0.831 -8.562 2.867 1.00 . A A . 25 ARG CG 1 1 7 4158 1 1 25 ARG CZ C -0.276 -11.471 3.803 1.00 . A A . 25 ARG CZ 1 1 7 4159 1 1 25 ARG H H 2.679 -9.229 0.550 1.00 . A A . 25 ARG H 1 1 7 4160 1 1 25 ARG HA H 1.795 -6.663 1.277 1.00 . A A . 25 ARG HA 1 1 7 4161 1 1 25 ARG HB2 H 2.912 -8.975 2.846 1.00 . A A . 25 ARG HB2 1 1 7 4162 1 1 25 ARG HB3 H 2.477 -7.463 3.632 1.00 . A A . 25 ARG HB3 1 1 7 4163 1 1 25 ARG HD2 H 1.419 -9.631 4.613 1.00 . A A . 25 ARG HD2 1 1 7 4164 1 1 25 ARG HD3 H 0.184 -8.403 4.889 1.00 . A A . 25 ARG HD3 1 1 7 4165 1 1 25 ARG HE H -1.441 -9.936 4.316 1.00 . A A . 25 ARG HE 1 1 7 4166 1 1 25 ARG HG2 H 0.183 -7.711 2.716 1.00 . A A . 25 ARG HG2 1 1 7 4167 1 1 25 ARG HG3 H 0.652 -9.295 2.095 1.00 . A A . 25 ARG HG3 1 1 7 4168 1 1 25 ARG HH11 H 1.716 -11.210 3.590 1.00 . A A . 25 ARG HH11 1 1 7 4169 1 1 25 ARG HH12 H 1.143 -12.819 3.299 1.00 . A A . 25 ARG HH12 1 1 7 4170 1 1 25 ARG HH21 H -2.208 -12.050 3.935 1.00 . A A . 25 ARG HH21 1 1 7 4171 1 1 25 ARG HH22 H -1.089 -13.296 3.494 1.00 . A A . 25 ARG HH22 1 1 7 4172 1 1 25 ARG N N 2.741 -8.265 0.383 1.00 . A A . 25 ARG N 1 1 7 4173 1 1 25 ARG NE N -0.519 -10.206 4.127 1.00 . A A . 25 ARG NE 1 1 7 4174 1 1 25 ARG NH1 N 0.963 -11.866 3.542 1.00 . A A . 25 ARG NH1 1 1 7 4175 1 1 25 ARG NH2 N -1.273 -12.344 3.739 1.00 . A A . 25 ARG NH2 1 1 7 4176 1 1 25 ARG O O 3.867 -5.299 1.632 1.00 . A A . 25 ARG O 1 1 7 4177 1 1 26 SER C C 6.390 -5.312 1.274 1.00 . A A . 26 SER C 1 1 7 4178 1 1 26 SER CA C 6.279 -6.570 2.130 1.00 . A A . 26 SER CA 1 1 7 4179 1 1 26 SER CB C 7.423 -7.530 1.796 1.00 . A A . 26 SER CB 1 1 7 4180 1 1 26 SER H H 4.943 -8.204 1.962 1.00 . A A . 26 SER H 1 1 7 4181 1 1 26 SER HA H 6.347 -6.291 3.171 1.00 . A A . 26 SER HA 1 1 7 4182 1 1 26 SER HB2 H 7.426 -8.343 2.507 1.00 . A A . 26 SER HB2 1 1 7 4183 1 1 26 SER HB3 H 7.280 -7.923 0.800 1.00 . A A . 26 SER HB3 1 1 7 4184 1 1 26 SER HG H 8.606 -6.098 2.419 1.00 . A A . 26 SER HG 1 1 7 4185 1 1 26 SER N N 4.993 -7.225 1.925 1.00 . A A . 26 SER N 1 1 7 4186 1 1 26 SER O O 6.699 -4.232 1.776 1.00 . A A . 26 SER O 1 1 7 4187 1 1 26 SER OG O 8.675 -6.869 1.852 1.00 . A A . 26 SER OG 1 1 7 4188 1 1 27 ASN C C 5.217 -3.244 -0.556 1.00 . A A . 27 ASN C 1 1 7 4189 1 1 27 ASN CA C 6.207 -4.337 -0.949 1.00 . A A . 27 ASN CA 1 1 7 4190 1 1 27 ASN CB C 5.923 -4.808 -2.376 1.00 . A A . 27 ASN CB 1 1 7 4191 1 1 27 ASN CG C 7.181 -5.246 -3.101 1.00 . A A . 27 ASN CG 1 1 7 4192 1 1 27 ASN H H 5.893 -6.347 -0.363 1.00 . A A . 27 ASN H 1 1 7 4193 1 1 27 ASN HA H 7.207 -3.934 -0.904 1.00 . A A . 27 ASN HA 1 1 7 4194 1 1 27 ASN HB2 H 5.240 -5.645 -2.344 1.00 . A A . 27 ASN HB2 1 1 7 4195 1 1 27 ASN HB3 H 5.471 -4.001 -2.933 1.00 . A A . 27 ASN HB3 1 1 7 4196 1 1 27 ASN HD21 H 6.133 -5.613 -4.751 1.00 . A A . 27 ASN HD21 1 1 7 4197 1 1 27 ASN HD22 H 7.830 -5.921 -4.855 1.00 . A A . 27 ASN HD22 1 1 7 4198 1 1 27 ASN N N 6.135 -5.461 -0.022 1.00 . A A . 27 ASN N 1 1 7 4199 1 1 27 ASN ND2 N 7.033 -5.632 -4.363 1.00 . A A . 27 ASN ND2 1 1 7 4200 1 1 27 ASN O O 5.548 -2.058 -0.572 1.00 . A A . 27 ASN O 1 1 7 4201 1 1 27 ASN OD1 O 8.273 -5.237 -2.533 1.00 . A A . 27 ASN OD1 1 1 7 4202 1 1 28 LEU C C 3.371 -1.951 1.455 1.00 . A A . 28 LEU C 1 1 7 4203 1 1 28 LEU CA C 2.965 -2.708 0.195 1.00 . A A . 28 LEU CA 1 1 7 4204 1 1 28 LEU CB C 1.643 -3.442 0.430 1.00 . A A . 28 LEU CB 1 1 7 4205 1 1 28 LEU CD1 C 0.056 -1.505 0.320 1.00 . A A . 28 LEU CD1 1 1 7 4206 1 1 28 LEU CD2 C -0.585 -3.574 1.571 1.00 . A A . 28 LEU CD2 1 1 7 4207 1 1 28 LEU CG C 0.563 -2.657 1.174 1.00 . A A . 28 LEU CG 1 1 7 4208 1 1 28 LEU H H 3.799 -4.610 -0.210 1.00 . A A . 28 LEU H 1 1 7 4209 1 1 28 LEU HA H 2.835 -1.999 -0.610 1.00 . A A . 28 LEU HA 1 1 7 4210 1 1 28 LEU HB2 H 1.245 -3.722 -0.533 1.00 . A A . 28 LEU HB2 1 1 7 4211 1 1 28 LEU HB3 H 1.859 -4.334 1.002 1.00 . A A . 28 LEU HB3 1 1 7 4212 1 1 28 LEU HD11 H 0.885 -0.874 0.038 1.00 . A A . 28 LEU HD11 1 1 7 4213 1 1 28 LEU HD12 H -0.661 -0.927 0.884 1.00 . A A . 28 LEU HD12 1 1 7 4214 1 1 28 LEU HD13 H -0.417 -1.897 -0.569 1.00 . A A . 28 LEU HD13 1 1 7 4215 1 1 28 LEU HD21 H -0.789 -4.264 0.765 1.00 . A A . 28 LEU HD21 1 1 7 4216 1 1 28 LEU HD22 H -1.466 -2.982 1.770 1.00 . A A . 28 LEU HD22 1 1 7 4217 1 1 28 LEU HD23 H -0.314 -4.126 2.459 1.00 . A A . 28 LEU HD23 1 1 7 4218 1 1 28 LEU HG H 0.987 -2.241 2.077 1.00 . A A . 28 LEU HG 1 1 7 4219 1 1 28 LEU N N 4.003 -3.652 -0.203 1.00 . A A . 28 LEU N 1 1 7 4220 1 1 28 LEU O O 3.327 -0.721 1.495 1.00 . A A . 28 LEU O 1 1 7 4221 1 1 29 PHE C C 5.294 -1.072 3.522 1.00 . A A . 29 PHE C 1 1 7 4222 1 1 29 PHE CA C 4.183 -2.093 3.745 1.00 . A A . 29 PHE CA 1 1 7 4223 1 1 29 PHE CB C 4.657 -3.175 4.718 1.00 . A A . 29 PHE CB 1 1 7 4224 1 1 29 PHE CD1 C 2.598 -4.609 4.758 1.00 . A A . 29 PHE CD1 1 1 7 4225 1 1 29 PHE CD2 C 3.421 -3.749 6.824 1.00 . A A . 29 PHE CD2 1 1 7 4226 1 1 29 PHE CE1 C 1.566 -5.238 5.428 1.00 . A A . 29 PHE CE1 1 1 7 4227 1 1 29 PHE CE2 C 2.390 -4.376 7.500 1.00 . A A . 29 PHE CE2 1 1 7 4228 1 1 29 PHE CG C 3.536 -3.858 5.448 1.00 . A A . 29 PHE CG 1 1 7 4229 1 1 29 PHE CZ C 1.462 -5.122 6.800 1.00 . A A . 29 PHE CZ 1 1 7 4230 1 1 29 PHE H H 3.780 -3.670 2.391 1.00 . A A . 29 PHE H 1 1 7 4231 1 1 29 PHE HA H 3.328 -1.590 4.169 1.00 . A A . 29 PHE HA 1 1 7 4232 1 1 29 PHE HB2 H 5.202 -3.928 4.169 1.00 . A A . 29 PHE HB2 1 1 7 4233 1 1 29 PHE HB3 H 5.310 -2.728 5.452 1.00 . A A . 29 PHE HB3 1 1 7 4234 1 1 29 PHE HD1 H 2.679 -4.702 3.685 1.00 . A A . 29 PHE HD1 1 1 7 4235 1 1 29 PHE HD2 H 4.147 -3.165 7.373 1.00 . A A . 29 PHE HD2 1 1 7 4236 1 1 29 PHE HE1 H 0.841 -5.821 4.879 1.00 . A A . 29 PHE HE1 1 1 7 4237 1 1 29 PHE HE2 H 2.313 -4.283 8.573 1.00 . A A . 29 PHE HE2 1 1 7 4238 1 1 29 PHE HZ H 0.656 -5.612 7.326 1.00 . A A . 29 PHE HZ 1 1 7 4239 1 1 29 PHE N N 3.767 -2.694 2.483 1.00 . A A . 29 PHE N 1 1 7 4240 1 1 29 PHE O O 5.300 0.000 4.128 1.00 . A A . 29 PHE O 1 1 7 4241 1 1 30 THR C C 6.864 0.801 1.776 1.00 . A A . 30 THR C 1 1 7 4242 1 1 30 THR CA C 7.352 -0.527 2.342 1.00 . A A . 30 THR CA 1 1 7 4243 1 1 30 THR CB C 8.325 -1.174 1.338 1.00 . A A . 30 THR CB 1 1 7 4244 1 1 30 THR CG2 C 9.495 -0.247 1.045 1.00 . A A . 30 THR CG2 1 1 7 4245 1 1 30 THR H H 6.175 -2.280 2.194 1.00 . A A . 30 THR H 1 1 7 4246 1 1 30 THR HA H 7.889 -0.340 3.262 1.00 . A A . 30 THR HA 1 1 7 4247 1 1 30 THR HB H 7.793 -1.362 0.416 1.00 . A A . 30 THR HB 1 1 7 4248 1 1 30 THR HG1 H 9.492 -2.762 1.276 1.00 . A A . 30 THR HG1 1 1 7 4249 1 1 30 THR HG21 H 9.908 -0.486 0.076 1.00 . A A . 30 THR HG21 1 1 7 4250 1 1 30 THR HG22 H 10.255 -0.377 1.801 1.00 . A A . 30 THR HG22 1 1 7 4251 1 1 30 THR HG23 H 9.153 0.777 1.049 1.00 . A A . 30 THR HG23 1 1 7 4252 1 1 30 THR N N 6.235 -1.412 2.646 1.00 . A A . 30 THR N 1 1 7 4253 1 1 30 THR O O 7.413 1.859 2.085 1.00 . A A . 30 THR O 1 1 7 4254 1 1 30 THR OG1 O 8.812 -2.416 1.858 1.00 . A A . 30 THR OG1 1 1 7 4255 1 1 31 HIS C C 4.481 2.753 1.363 1.00 . A A . 31 HIS C 1 1 7 4256 1 1 31 HIS CA C 5.264 1.940 0.337 1.00 . A A . 31 HIS CA 1 1 7 4257 1 1 31 HIS CB C 4.355 1.564 -0.834 1.00 . A A . 31 HIS CB 1 1 7 4258 1 1 31 HIS CD2 C 2.065 2.779 -0.750 1.00 . A A . 31 HIS CD2 1 1 7 4259 1 1 31 HIS CE1 C 2.523 4.422 -2.128 1.00 . A A . 31 HIS CE1 1 1 7 4260 1 1 31 HIS CG C 3.342 2.616 -1.168 1.00 . A A . 31 HIS CG 1 1 7 4261 1 1 31 HIS H H 5.433 -0.132 0.738 1.00 . A A . 31 HIS H 1 1 7 4262 1 1 31 HIS HA H 6.082 2.540 -0.032 1.00 . A A . 31 HIS HA 1 1 7 4263 1 1 31 HIS HB2 H 4.961 1.397 -1.712 1.00 . A A . 31 HIS HB2 1 1 7 4264 1 1 31 HIS HB3 H 3.823 0.655 -0.592 1.00 . A A . 31 HIS HB3 1 1 7 4265 1 1 31 HIS HD1 H 4.443 3.821 -2.500 1.00 . A A . 31 HIS HD1 1 1 7 4266 1 1 31 HIS HD2 H 1.528 2.140 -0.063 1.00 . A A . 31 HIS HD2 1 1 7 4267 1 1 31 HIS HE1 H 2.432 5.312 -2.732 1.00 . A A . 31 HIS HE1 1 1 7 4268 1 1 31 HIS N N 5.828 0.740 0.946 1.00 . A A . 31 HIS N 1 1 7 4269 1 1 31 HIS ND1 N 3.599 3.660 -2.031 1.00 . A A . 31 HIS ND1 1 1 7 4270 1 1 31 HIS NE2 N 1.579 3.909 -1.361 1.00 . A A . 31 HIS NE2 1 1 7 4271 1 1 31 HIS O O 4.742 3.940 1.557 1.00 . A A . 31 HIS O 1 1 7 4272 1 1 32 GLN C C 3.521 3.784 3.812 1.00 . A A . 32 GLN C 1 1 7 4273 1 1 32 GLN CA C 2.700 2.771 3.021 1.00 . A A . 32 GLN CA 1 1 7 4274 1 1 32 GLN CB C 2.086 1.742 3.971 1.00 . A A . 32 GLN CB 1 1 7 4275 1 1 32 GLN CD C 0.009 0.342 4.306 1.00 . A A . 32 GLN CD 1 1 7 4276 1 1 32 GLN CG C 1.033 0.862 3.316 1.00 . A A . 32 GLN CG 1 1 7 4277 1 1 32 GLN H H 3.361 1.161 1.817 1.00 . A A . 32 GLN H 1 1 7 4278 1 1 32 GLN HA H 1.906 3.293 2.508 1.00 . A A . 32 GLN HA 1 1 7 4279 1 1 32 GLN HB2 H 2.871 1.105 4.349 1.00 . A A . 32 GLN HB2 1 1 7 4280 1 1 32 GLN HB3 H 1.625 2.262 4.798 1.00 . A A . 32 GLN HB3 1 1 7 4281 1 1 32 GLN HE21 H -1.443 1.306 3.349 1.00 . A A . 32 GLN HE21 1 1 7 4282 1 1 32 GLN HE22 H -1.931 0.399 4.736 1.00 . A A . 32 GLN HE22 1 1 7 4283 1 1 32 GLN HG2 H 0.519 1.438 2.561 1.00 . A A . 32 GLN HG2 1 1 7 4284 1 1 32 GLN HG3 H 1.524 0.019 2.853 1.00 . A A . 32 GLN HG3 1 1 7 4285 1 1 32 GLN N N 3.521 2.106 2.016 1.00 . A A . 32 GLN N 1 1 7 4286 1 1 32 GLN NE2 N -1.249 0.721 4.112 1.00 . A A . 32 GLN NE2 1 1 7 4287 1 1 32 GLN O O 2.998 4.799 4.274 1.00 . A A . 32 GLN O 1 1 7 4288 1 1 32 GLN OE1 O 0.344 -0.392 5.236 1.00 . A A . 32 GLN OE1 1 1 7 4289 1 1 33 LYS C C 5.531 5.834 4.249 1.00 . A A . 33 LYS C 1 1 7 4290 1 1 33 LYS CA C 5.706 4.388 4.700 1.00 . A A . 33 LYS CA 1 1 7 4291 1 1 33 LYS CB C 7.160 3.954 4.504 1.00 . A A . 33 LYS CB 1 1 7 4292 1 1 33 LYS CD C 8.955 2.286 5.058 1.00 . A A . 33 LYS CD 1 1 7 4293 1 1 33 LYS CE C 9.253 0.881 5.558 1.00 . A A . 33 LYS CE 1 1 7 4294 1 1 33 LYS CG C 7.463 2.574 5.062 1.00 . A A . 33 LYS CG 1 1 7 4295 1 1 33 LYS H H 5.169 2.677 3.574 1.00 . A A . 33 LYS H 1 1 7 4296 1 1 33 LYS HA H 5.456 4.318 5.748 1.00 . A A . 33 LYS HA 1 1 7 4297 1 1 33 LYS HB2 H 7.382 3.949 3.447 1.00 . A A . 33 LYS HB2 1 1 7 4298 1 1 33 LYS HB3 H 7.806 4.667 4.996 1.00 . A A . 33 LYS HB3 1 1 7 4299 1 1 33 LYS HD2 H 9.330 2.385 4.050 1.00 . A A . 33 LYS HD2 1 1 7 4300 1 1 33 LYS HD3 H 9.452 3.000 5.700 1.00 . A A . 33 LYS HD3 1 1 7 4301 1 1 33 LYS HE2 H 8.595 0.188 5.058 1.00 . A A . 33 LYS HE2 1 1 7 4302 1 1 33 LYS HE3 H 10.279 0.639 5.321 1.00 . A A . 33 LYS HE3 1 1 7 4303 1 1 33 LYS HG2 H 7.100 2.518 6.077 1.00 . A A . 33 LYS HG2 1 1 7 4304 1 1 33 LYS HG3 H 6.961 1.833 4.457 1.00 . A A . 33 LYS HG3 1 1 7 4305 1 1 33 LYS HZ1 H 8.111 0.378 7.233 1.00 . A A . 33 LYS HZ1 1 1 7 4306 1 1 33 LYS HZ2 H 9.142 1.696 7.478 1.00 . A A . 33 LYS HZ2 1 1 7 4307 1 1 33 LYS HZ3 H 9.772 0.127 7.436 1.00 . A A . 33 LYS HZ3 1 1 7 4308 1 1 33 LYS N N 4.810 3.502 3.966 1.00 . A A . 33 LYS N 1 1 7 4309 1 1 33 LYS NZ N 9.055 0.762 7.029 1.00 . A A . 33 LYS NZ 1 1 7 4310 1 1 33 LYS O O 5.390 6.739 5.073 1.00 . A A . 33 LYS O 1 1 7 4311 1 1 34 ILE C C 4.256 8.139 3.077 1.00 . A A . 34 ILE C 1 1 7 4312 1 1 34 ILE CA C 5.379 7.381 2.377 1.00 . A A . 34 ILE CA 1 1 7 4313 1 1 34 ILE CB C 5.084 7.327 0.867 1.00 . A A . 34 ILE CB 1 1 7 4314 1 1 34 ILE CD1 C 3.030 7.228 -0.632 1.00 . A A . 34 ILE CD1 1 1 7 4315 1 1 34 ILE CG1 C 3.708 6.708 0.616 1.00 . A A . 34 ILE CG1 1 1 7 4316 1 1 34 ILE CG2 C 6.166 6.539 0.143 1.00 . A A . 34 ILE CG2 1 1 7 4317 1 1 34 ILE H H 5.656 5.284 2.331 1.00 . A A . 34 ILE H 1 1 7 4318 1 1 34 ILE HA H 6.306 7.917 2.524 1.00 . A A . 34 ILE HA 1 1 7 4319 1 1 34 ILE HB H 5.092 8.337 0.485 1.00 . A A . 34 ILE HB 1 1 7 4320 1 1 34 ILE HD11 H 3.275 8.272 -0.767 1.00 . A A . 34 ILE HD11 1 1 7 4321 1 1 34 ILE HD12 H 3.371 6.666 -1.489 1.00 . A A . 34 ILE HD12 1 1 7 4322 1 1 34 ILE HD13 H 1.960 7.121 -0.533 1.00 . A A . 34 ILE HD13 1 1 7 4323 1 1 34 ILE HG12 H 3.814 5.639 0.514 1.00 . A A . 34 ILE HG12 1 1 7 4324 1 1 34 ILE HG13 H 3.066 6.923 1.458 1.00 . A A . 34 ILE HG13 1 1 7 4325 1 1 34 ILE HG21 H 6.842 7.224 -0.348 1.00 . A A . 34 ILE HG21 1 1 7 4326 1 1 34 ILE HG22 H 6.715 5.944 0.857 1.00 . A A . 34 ILE HG22 1 1 7 4327 1 1 34 ILE HG23 H 5.711 5.893 -0.591 1.00 . A A . 34 ILE HG23 1 1 7 4328 1 1 34 ILE N N 5.540 6.045 2.937 1.00 . A A . 34 ILE N 1 1 7 4329 1 1 34 ILE O O 4.246 9.370 3.104 1.00 . A A . 34 ILE O 1 1 7 4330 1 1 35 HIS C C 2.569 8.368 5.774 1.00 . A A . 35 HIS C 1 1 7 4331 1 1 35 HIS CA C 2.183 7.997 4.346 1.00 . A A . 35 HIS CA 1 1 7 4332 1 1 35 HIS CB C 0.993 7.037 4.359 1.00 . A A . 35 HIS CB 1 1 7 4333 1 1 35 HIS CD2 C 0.873 5.893 2.035 1.00 . A A . 35 HIS CD2 1 1 7 4334 1 1 35 HIS CE1 C -0.918 6.902 1.273 1.00 . A A . 35 HIS CE1 1 1 7 4335 1 1 35 HIS CG C 0.445 6.744 2.997 1.00 . A A . 35 HIS CG 1 1 7 4336 1 1 35 HIS H H 3.374 6.419 3.588 1.00 . A A . 35 HIS H 1 1 7 4337 1 1 35 HIS HA H 1.904 8.895 3.816 1.00 . A A . 35 HIS HA 1 1 7 4338 1 1 35 HIS HB2 H 1.299 6.101 4.802 1.00 . A A . 35 HIS HB2 1 1 7 4339 1 1 35 HIS HB3 H 0.199 7.468 4.952 1.00 . A A . 35 HIS HB3 1 1 7 4340 1 1 35 HIS HD1 H -1.219 8.035 2.950 1.00 . A A . 35 HIS HD1 1 1 7 4341 1 1 35 HIS HD2 H 1.734 5.242 2.091 1.00 . A A . 35 HIS HD2 1 1 7 4342 1 1 35 HIS HE1 H -1.733 7.204 0.632 1.00 . A A . 35 HIS HE1 1 1 7 4343 1 1 35 HIS N N 3.311 7.395 3.643 1.00 . A A . 35 HIS N 1 1 7 4344 1 1 35 HIS ND1 N -0.678 7.361 2.488 1.00 . A A . 35 HIS ND1 1 1 7 4345 1 1 35 HIS NE2 N 0.009 6.010 0.974 1.00 . A A . 35 HIS NE2 1 1 7 4346 1 1 35 HIS O O 2.145 9.401 6.295 1.00 . A A . 35 HIS O 1 1 7 4347 1 1 36 THR C C 5.336 7.827 7.857 1.00 . A A . 36 THR C 1 1 7 4348 1 1 36 THR CA C 3.816 7.757 7.773 1.00 . A A . 36 THR CA 1 1 7 4349 1 1 36 THR CB C 3.311 6.657 8.725 1.00 . A A . 36 THR CB 1 1 7 4350 1 1 36 THR CG2 C 3.960 5.320 8.401 1.00 . A A . 36 THR CG2 1 1 7 4351 1 1 36 THR H H 3.679 6.714 5.937 1.00 . A A . 36 THR H 1 1 7 4352 1 1 36 THR HA H 3.403 8.702 8.097 1.00 . A A . 36 THR HA 1 1 7 4353 1 1 36 THR HB H 2.241 6.560 8.603 1.00 . A A . 36 THR HB 1 1 7 4354 1 1 36 THR HG1 H 4.481 7.381 10.138 1.00 . A A . 36 THR HG1 1 1 7 4355 1 1 36 THR HG21 H 4.846 5.486 7.807 1.00 . A A . 36 THR HG21 1 1 7 4356 1 1 36 THR HG22 H 3.265 4.707 7.846 1.00 . A A . 36 THR HG22 1 1 7 4357 1 1 36 THR HG23 H 4.230 4.819 9.318 1.00 . A A . 36 THR HG23 1 1 7 4358 1 1 36 THR N N 3.375 7.519 6.405 1.00 . A A . 36 THR N 1 1 7 4359 1 1 36 THR O O 5.938 7.345 8.816 1.00 . A A . 36 THR O 1 1 7 4360 1 1 36 THR OG1 O 3.595 7.015 10.082 1.00 . A A . 36 THR OG1 1 1 7 4361 1 1 37 GLY C C 7.881 9.842 7.455 1.00 . A A . 37 GLY C 1 1 7 4362 1 1 37 GLY CA C 7.399 8.551 6.824 1.00 . A A . 37 GLY CA 1 1 7 4363 1 1 37 GLY H H 5.422 8.795 6.106 1.00 . A A . 37 GLY H 1 1 7 4364 1 1 37 GLY HA2 H 7.827 7.718 7.361 1.00 . A A . 37 GLY HA2 1 1 7 4365 1 1 37 GLY HA3 H 7.737 8.518 5.799 1.00 . A A . 37 GLY HA3 1 1 7 4366 1 1 37 GLY N N 5.953 8.430 6.845 1.00 . A A . 37 GLY N 1 1 7 4367 1 1 37 GLY O O 8.790 10.492 6.938 1.00 . A A . 37 GLY O 1 1 7 4368 1 1 38 GLU C C 8.045 12.531 8.288 1.00 . A A . 38 GLU C 1 1 7 4369 1 1 38 GLU CA C 7.642 11.440 9.276 1.00 . A A . 38 GLU CA 1 1 7 4370 1 1 38 GLU CB C 8.792 11.168 10.249 1.00 . A A . 38 GLU CB 1 1 7 4371 1 1 38 GLU CD C 9.916 11.802 12.420 1.00 . A A . 38 GLU CD 1 1 7 4372 1 1 38 GLU CG C 8.899 12.193 11.366 1.00 . A A . 38 GLU CG 1 1 7 4373 1 1 38 GLU H H 6.553 9.656 8.939 1.00 . A A . 38 GLU H 1 1 7 4374 1 1 38 GLU HA H 6.782 11.777 9.835 1.00 . A A . 38 GLU HA 1 1 7 4375 1 1 38 GLU HB2 H 8.649 10.194 10.693 1.00 . A A . 38 GLU HB2 1 1 7 4376 1 1 38 GLU HB3 H 9.721 11.169 9.698 1.00 . A A . 38 GLU HB3 1 1 7 4377 1 1 38 GLU HG2 H 9.190 13.141 10.940 1.00 . A A . 38 GLU HG2 1 1 7 4378 1 1 38 GLU HG3 H 7.933 12.293 11.839 1.00 . A A . 38 GLU HG3 1 1 7 4379 1 1 38 GLU N N 7.271 10.216 8.576 1.00 . A A . 38 GLU N 1 1 7 4380 1 1 38 GLU O O 9.038 13.231 8.489 1.00 . A A . 38 GLU O 1 1 7 4381 1 1 38 GLU OE1 O 11.032 11.388 12.042 1.00 . A A . 38 GLU OE1 1 1 7 4382 1 1 38 GLU OE2 O 9.597 11.911 13.622 1.00 . A A . 38 GLU OE2 1 1 7 4383 1 1 39 LYS C C 6.729 14.942 6.453 1.00 . A A . 39 LYS C 1 1 7 4384 1 1 39 LYS CA C 7.540 13.675 6.199 1.00 . A A . 39 LYS CA 1 1 7 4385 1 1 39 LYS CB C 7.219 13.121 4.809 1.00 . A A . 39 LYS CB 1 1 7 4386 1 1 39 LYS CD C 9.427 13.323 3.628 1.00 . A A . 39 LYS CD 1 1 7 4387 1 1 39 LYS CE C 10.244 12.677 2.520 1.00 . A A . 39 LYS CE 1 1 7 4388 1 1 39 LYS CG C 8.375 12.370 4.172 1.00 . A A . 39 LYS CG 1 1 7 4389 1 1 39 LYS H H 6.490 12.081 7.115 1.00 . A A . 39 LYS H 1 1 7 4390 1 1 39 LYS HA H 8.590 13.919 6.246 1.00 . A A . 39 LYS HA 1 1 7 4391 1 1 39 LYS HB2 H 6.379 12.447 4.889 1.00 . A A . 39 LYS HB2 1 1 7 4392 1 1 39 LYS HB3 H 6.950 13.943 4.161 1.00 . A A . 39 LYS HB3 1 1 7 4393 1 1 39 LYS HD2 H 8.936 14.200 3.234 1.00 . A A . 39 LYS HD2 1 1 7 4394 1 1 39 LYS HD3 H 10.090 13.609 4.432 1.00 . A A . 39 LYS HD3 1 1 7 4395 1 1 39 LYS HE2 H 9.621 11.967 1.998 1.00 . A A . 39 LYS HE2 1 1 7 4396 1 1 39 LYS HE3 H 10.565 13.446 1.833 1.00 . A A . 39 LYS HE3 1 1 7 4397 1 1 39 LYS HG2 H 8.832 11.733 4.914 1.00 . A A . 39 LYS HG2 1 1 7 4398 1 1 39 LYS HG3 H 7.996 11.766 3.360 1.00 . A A . 39 LYS HG3 1 1 7 4399 1 1 39 LYS HZ1 H 11.161 11.073 3.494 1.00 . A A . 39 LYS HZ1 1 1 7 4400 1 1 39 LYS HZ2 H 11.916 12.562 3.765 1.00 . A A . 39 LYS HZ2 1 1 7 4401 1 1 39 LYS HZ3 H 12.112 11.773 2.282 1.00 . A A . 39 LYS HZ3 1 1 7 4402 1 1 39 LYS N N 7.267 12.670 7.219 1.00 . A A . 39 LYS N 1 1 7 4403 1 1 39 LYS NZ N 11.442 11.972 3.053 1.00 . A A . 39 LYS NZ 1 1 7 4404 1 1 39 LYS O O 5.578 14.894 6.887 1.00 . A A . 39 LYS O 1 1 7 4405 1 1 40 PRO C C 5.569 17.643 5.361 1.00 . A A . 40 PRO C 1 1 7 4406 1 1 40 PRO CA C 6.692 17.404 6.364 1.00 . A A . 40 PRO CA 1 1 7 4407 1 1 40 PRO CB C 7.830 18.403 6.140 1.00 . A A . 40 PRO CB 1 1 7 4408 1 1 40 PRO CD C 8.712 16.234 5.654 1.00 . A A . 40 PRO CD 1 1 7 4409 1 1 40 PRO CG C 8.799 17.684 5.265 1.00 . A A . 40 PRO CG 1 1 7 4410 1 1 40 PRO HA H 6.307 17.513 7.367 1.00 . A A . 40 PRO HA 1 1 7 4411 1 1 40 PRO HB2 H 7.444 19.290 5.658 1.00 . A A . 40 PRO HB2 1 1 7 4412 1 1 40 PRO HB3 H 8.275 18.666 7.088 1.00 . A A . 40 PRO HB3 1 1 7 4413 1 1 40 PRO HD2 H 8.859 15.602 4.791 1.00 . A A . 40 PRO HD2 1 1 7 4414 1 1 40 PRO HD3 H 9.438 16.005 6.420 1.00 . A A . 40 PRO HD3 1 1 7 4415 1 1 40 PRO HG2 H 8.522 17.811 4.229 1.00 . A A . 40 PRO HG2 1 1 7 4416 1 1 40 PRO HG3 H 9.797 18.059 5.437 1.00 . A A . 40 PRO HG3 1 1 7 4417 1 1 40 PRO N N 7.341 16.103 6.175 1.00 . A A . 40 PRO N 1 1 7 4418 1 1 40 PRO O O 5.221 16.756 4.581 1.00 . A A . 40 PRO O 1 1 7 4419 1 1 41 SER C C 4.346 20.311 3.526 1.00 . A A . 41 SER C 1 1 7 4420 1 1 41 SER CA C 3.918 19.200 4.481 1.00 . A A . 41 SER CA 1 1 7 4421 1 1 41 SER CB C 2.687 19.642 5.276 1.00 . A A . 41 SER CB 1 1 7 4422 1 1 41 SER H H 5.326 19.511 6.031 1.00 . A A . 41 SER H 1 1 7 4423 1 1 41 SER HA H 3.667 18.322 3.905 1.00 . A A . 41 SER HA 1 1 7 4424 1 1 41 SER HB2 H 1.864 19.806 4.598 1.00 . A A . 41 SER HB2 1 1 7 4425 1 1 41 SER HB3 H 2.423 18.869 5.984 1.00 . A A . 41 SER HB3 1 1 7 4426 1 1 41 SER HG H 3.084 21.558 5.361 1.00 . A A . 41 SER HG 1 1 7 4427 1 1 41 SER N N 5.005 18.846 5.386 1.00 . A A . 41 SER N 1 1 7 4428 1 1 41 SER O O 5.219 21.117 3.845 1.00 . A A . 41 SER O 1 1 7 4429 1 1 41 SER OG O 2.942 20.842 5.984 1.00 . A A . 41 SER OG 1 1 7 4430 1 1 42 GLY C C 2.832 21.863 0.623 1.00 . A A . 42 GLY C 1 1 7 4431 1 1 42 GLY CA C 4.053 21.360 1.368 1.00 . A A . 42 GLY CA 1 1 7 4432 1 1 42 GLY H H 3.035 19.677 2.152 1.00 . A A . 42 GLY H 1 1 7 4433 1 1 42 GLY HA2 H 4.525 22.192 1.868 1.00 . A A . 42 GLY HA2 1 1 7 4434 1 1 42 GLY HA3 H 4.748 20.941 0.654 1.00 . A A . 42 GLY HA3 1 1 7 4435 1 1 42 GLY N N 3.724 20.345 2.352 1.00 . A A . 42 GLY N 1 1 7 4436 1 1 42 GLY O O 1.720 21.365 0.802 1.00 . A A . 42 GLY O 1 1 7 4437 1 1 43 PRO C C 1.437 22.524 -2.107 1.00 . A A . 43 PRO C 1 1 7 4438 1 1 43 PRO CA C 1.950 23.468 -1.025 1.00 . A A . 43 PRO CA 1 1 7 4439 1 1 43 PRO CB C 2.606 24.699 -1.656 1.00 . A A . 43 PRO CB 1 1 7 4440 1 1 43 PRO CD C 4.331 23.517 -0.498 1.00 . A A . 43 PRO CD 1 1 7 4441 1 1 43 PRO CG C 4.059 24.371 -1.706 1.00 . A A . 43 PRO CG 1 1 7 4442 1 1 43 PRO HA H 1.126 23.779 -0.400 1.00 . A A . 43 PRO HA 1 1 7 4443 1 1 43 PRO HB2 H 2.202 24.857 -2.647 1.00 . A A . 43 PRO HB2 1 1 7 4444 1 1 43 PRO HB3 H 2.418 25.567 -1.042 1.00 . A A . 43 PRO HB3 1 1 7 4445 1 1 43 PRO HD2 H 5.088 22.779 -0.721 1.00 . A A . 43 PRO HD2 1 1 7 4446 1 1 43 PRO HD3 H 4.634 24.130 0.337 1.00 . A A . 43 PRO HD3 1 1 7 4447 1 1 43 PRO HG2 H 4.281 23.825 -2.609 1.00 . A A . 43 PRO HG2 1 1 7 4448 1 1 43 PRO HG3 H 4.641 25.279 -1.661 1.00 . A A . 43 PRO HG3 1 1 7 4449 1 1 43 PRO N N 3.033 22.875 -0.234 1.00 . A A . 43 PRO N 1 1 7 4450 1 1 43 PRO O O 1.893 22.568 -3.250 1.00 . A A . 43 PRO O 1 1 7 4451 1 1 44 SER C C -1.028 21.408 -3.656 1.00 . A A . 44 SER C 1 1 7 4452 1 1 44 SER CA C -0.086 20.713 -2.678 1.00 . A A . 44 SER CA 1 1 7 4453 1 1 44 SER CB C -0.835 19.613 -1.924 1.00 . A A . 44 SER CB 1 1 7 4454 1 1 44 SER H H 0.165 21.684 -0.813 1.00 . A A . 44 SER H 1 1 7 4455 1 1 44 SER HA H 0.726 20.268 -3.234 1.00 . A A . 44 SER HA 1 1 7 4456 1 1 44 SER HB2 H -0.273 19.335 -1.045 1.00 . A A . 44 SER HB2 1 1 7 4457 1 1 44 SER HB3 H -1.807 19.982 -1.628 1.00 . A A . 44 SER HB3 1 1 7 4458 1 1 44 SER HG H -0.152 18.140 -3.019 1.00 . A A . 44 SER HG 1 1 7 4459 1 1 44 SER N N 0.487 21.671 -1.739 1.00 . A A . 44 SER N 1 1 7 4460 1 1 44 SER O O -2.038 21.988 -3.256 1.00 . A A . 44 SER O 1 1 7 4461 1 1 44 SER OG O -1.010 18.466 -2.737 1.00 . A A . 44 SER OG 1 1 7 4462 1 1 45 SER C C -0.973 21.627 -7.365 1.00 . A A . 45 SER C 1 1 7 4463 1 1 45 SER CA C -1.503 21.972 -5.976 1.00 . A A . 45 SER CA 1 1 7 4464 1 1 45 SER CB C -1.526 23.490 -5.788 1.00 . A A . 45 SER CB 1 1 7 4465 1 1 45 SER H H 0.127 20.869 -5.196 1.00 . A A . 45 SER H 1 1 7 4466 1 1 45 SER HA H -2.509 21.591 -5.883 1.00 . A A . 45 SER HA 1 1 7 4467 1 1 45 SER HB2 H -1.700 23.719 -4.748 1.00 . A A . 45 SER HB2 1 1 7 4468 1 1 45 SER HB3 H -0.574 23.902 -6.093 1.00 . A A . 45 SER HB3 1 1 7 4469 1 1 45 SER HG H -2.600 25.022 -6.366 1.00 . A A . 45 SER HG 1 1 7 4470 1 1 45 SER N N -0.690 21.345 -4.940 1.00 . A A . 45 SER N 1 1 7 4471 1 1 45 SER O O 0.235 21.512 -7.569 1.00 . A A . 45 SER O 1 1 7 4472 1 1 45 SER OG O -2.551 24.084 -6.564 1.00 . A A . 45 SER OG 1 1 7 4473 1 1 46 GLY C C -2.579 20.394 -10.428 1.00 . A A . 46 GLY C 1 1 7 4474 1 1 46 GLY CA C -1.493 21.135 -9.674 1.00 . A A . 46 GLY CA 1 1 7 4475 1 1 46 GLY H H -2.836 21.570 -8.095 1.00 . A A . 46 GLY H 1 1 7 4476 1 1 46 GLY HA2 H -1.262 22.048 -10.202 1.00 . A A . 46 GLY HA2 1 1 7 4477 1 1 46 GLY HA3 H -0.608 20.517 -9.640 1.00 . A A . 46 GLY HA3 1 1 7 4478 1 1 46 GLY N N -1.887 21.465 -8.317 1.00 . A A . 46 GLY N 1 1 7 4479 1 1 46 GLY O O -2.692 19.179 -10.274 1.00 . A A . 46 GLY O 1 1 7 4480 2 2 1 ZN ZN ZN -0.164 4.464 -0.356 1.00 . B A . 201 ZN ZN 1 1 8 4481 1 1 1 GLY C C -20.088 0.997 -25.289 1.00 . A A . 1 GLY C 1 1 8 4482 1 1 1 GLY CA C -21.271 1.768 -25.840 1.00 . A A . 1 GLY CA 1 1 8 4483 1 1 1 GLY H1 H -22.206 0.241 -26.971 1.00 . A A . 1 GLY H1 1 1 8 4484 1 1 1 GLY HA2 H -20.944 2.351 -26.688 1.00 . A A . 1 GLY HA2 1 1 8 4485 1 1 1 GLY HA3 H -21.637 2.437 -25.075 1.00 . A A . 1 GLY HA3 1 1 8 4486 1 1 1 GLY N N -22.354 0.897 -26.258 1.00 . A A . 1 GLY N 1 1 8 4487 1 1 1 GLY O O -20.147 -0.224 -25.143 1.00 . A A . 1 GLY O 1 1 8 4488 1 1 2 SER C C -17.021 2.066 -23.582 1.00 . A A . 2 SER C 1 1 8 4489 1 1 2 SER CA C -17.805 1.085 -24.449 1.00 . A A . 2 SER CA 1 1 8 4490 1 1 2 SER CB C -16.921 0.577 -25.590 1.00 . A A . 2 SER CB 1 1 8 4491 1 1 2 SER H H -19.023 2.681 -25.121 1.00 . A A . 2 SER H 1 1 8 4492 1 1 2 SER HA H -18.108 0.247 -23.840 1.00 . A A . 2 SER HA 1 1 8 4493 1 1 2 SER HB2 H -16.009 0.170 -25.181 1.00 . A A . 2 SER HB2 1 1 8 4494 1 1 2 SER HB3 H -17.448 -0.193 -26.134 1.00 . A A . 2 SER HB3 1 1 8 4495 1 1 2 SER HG H -16.098 1.269 -27.228 1.00 . A A . 2 SER HG 1 1 8 4496 1 1 2 SER N N -19.009 1.711 -24.982 1.00 . A A . 2 SER N 1 1 8 4497 1 1 2 SER O O -16.590 3.119 -24.051 1.00 . A A . 2 SER O 1 1 8 4498 1 1 2 SER OG O -16.592 1.625 -26.486 1.00 . A A . 2 SER OG 1 1 8 4499 1 1 3 SER C C -15.489 1.730 -20.262 1.00 . A A . 3 SER C 1 1 8 4500 1 1 3 SER CA C -16.114 2.561 -21.379 1.00 . A A . 3 SER CA 1 1 8 4501 1 1 3 SER CB C -17.048 3.616 -20.783 1.00 . A A . 3 SER CB 1 1 8 4502 1 1 3 SER H H -17.209 0.859 -21.999 1.00 . A A . 3 SER H 1 1 8 4503 1 1 3 SER HA H -15.326 3.058 -21.926 1.00 . A A . 3 SER HA 1 1 8 4504 1 1 3 SER HB2 H -16.475 4.293 -20.166 1.00 . A A . 3 SER HB2 1 1 8 4505 1 1 3 SER HB3 H -17.518 4.169 -21.583 1.00 . A A . 3 SER HB3 1 1 8 4506 1 1 3 SER HG H -18.619 2.471 -20.543 1.00 . A A . 3 SER HG 1 1 8 4507 1 1 3 SER N N -16.841 1.711 -22.314 1.00 . A A . 3 SER N 1 1 8 4508 1 1 3 SER O O -16.180 0.989 -19.564 1.00 . A A . 3 SER O 1 1 8 4509 1 1 3 SER OG O -18.055 3.015 -19.988 1.00 . A A . 3 SER OG 1 1 8 4510 1 1 4 GLY C C -12.016 0.895 -19.399 1.00 . A A . 4 GLY C 1 1 8 4511 1 1 4 GLY CA C -13.479 1.114 -19.068 1.00 . A A . 4 GLY CA 1 1 8 4512 1 1 4 GLY H H -13.676 2.465 -20.687 1.00 . A A . 4 GLY H 1 1 8 4513 1 1 4 GLY HA2 H -13.549 1.658 -18.137 1.00 . A A . 4 GLY HA2 1 1 8 4514 1 1 4 GLY HA3 H -13.956 0.153 -18.949 1.00 . A A . 4 GLY HA3 1 1 8 4515 1 1 4 GLY N N -14.176 1.859 -20.100 1.00 . A A . 4 GLY N 1 1 8 4516 1 1 4 GLY O O -11.574 -0.241 -19.567 1.00 . A A . 4 GLY O 1 1 8 4517 1 1 5 SER C C -9.012 1.706 -18.548 1.00 . A A . 5 SER C 1 1 8 4518 1 1 5 SER CA C -9.841 1.909 -19.812 1.00 . A A . 5 SER CA 1 1 8 4519 1 1 5 SER CB C -9.389 3.179 -20.534 1.00 . A A . 5 SER CB 1 1 8 4520 1 1 5 SER H H -11.673 2.865 -19.348 1.00 . A A . 5 SER H 1 1 8 4521 1 1 5 SER HA H -9.694 1.062 -20.465 1.00 . A A . 5 SER HA 1 1 8 4522 1 1 5 SER HB2 H -8.365 3.063 -20.854 1.00 . A A . 5 SER HB2 1 1 8 4523 1 1 5 SER HB3 H -10.019 3.344 -21.397 1.00 . A A . 5 SER HB3 1 1 8 4524 1 1 5 SER HG H -9.238 5.099 -20.173 1.00 . A A . 5 SER HG 1 1 8 4525 1 1 5 SER N N -11.262 1.987 -19.494 1.00 . A A . 5 SER N 1 1 8 4526 1 1 5 SER O O -8.111 0.868 -18.511 1.00 . A A . 5 SER O 1 1 8 4527 1 1 5 SER OG O -9.477 4.309 -19.683 1.00 . A A . 5 SER OG 1 1 8 4528 1 1 6 SER C C -9.351 1.496 -15.261 1.00 . A A . 6 SER C 1 1 8 4529 1 1 6 SER CA C -8.604 2.389 -16.248 1.00 . A A . 6 SER CA 1 1 8 4530 1 1 6 SER CB C -8.410 3.782 -15.646 1.00 . A A . 6 SER CB 1 1 8 4531 1 1 6 SER H H -10.051 3.129 -17.604 1.00 . A A . 6 SER H 1 1 8 4532 1 1 6 SER HA H -7.636 1.954 -16.446 1.00 . A A . 6 SER HA 1 1 8 4533 1 1 6 SER HB2 H -7.937 3.692 -14.680 1.00 . A A . 6 SER HB2 1 1 8 4534 1 1 6 SER HB3 H -7.783 4.370 -16.301 1.00 . A A . 6 SER HB3 1 1 8 4535 1 1 6 SER HG H -10.202 3.952 -14.874 1.00 . A A . 6 SER HG 1 1 8 4536 1 1 6 SER N N -9.323 2.480 -17.513 1.00 . A A . 6 SER N 1 1 8 4537 1 1 6 SER O O -10.505 1.757 -14.922 1.00 . A A . 6 SER O 1 1 8 4538 1 1 6 SER OG O -9.652 4.446 -15.485 1.00 . A A . 6 SER OG 1 1 8 4539 1 1 7 GLY C C -8.921 -1.919 -14.127 1.00 . A A . 7 GLY C 1 1 8 4540 1 1 7 GLY CA C -9.299 -0.475 -13.863 1.00 . A A . 7 GLY CA 1 1 8 4541 1 1 7 GLY H H -7.766 0.283 -15.111 1.00 . A A . 7 GLY H 1 1 8 4542 1 1 7 GLY HA2 H -8.988 -0.209 -12.864 1.00 . A A . 7 GLY HA2 1 1 8 4543 1 1 7 GLY HA3 H -10.373 -0.378 -13.933 1.00 . A A . 7 GLY HA3 1 1 8 4544 1 1 7 GLY N N -8.684 0.441 -14.805 1.00 . A A . 7 GLY N 1 1 8 4545 1 1 7 GLY O O -9.789 -2.776 -14.296 1.00 . A A . 7 GLY O 1 1 8 4546 1 1 8 THR C C -5.931 -3.861 -13.524 1.00 . A A . 8 THR C 1 1 8 4547 1 1 8 THR CA C -7.128 -3.541 -14.412 1.00 . A A . 8 THR CA 1 1 8 4548 1 1 8 THR CB C -6.725 -3.730 -15.886 1.00 . A A . 8 THR CB 1 1 8 4549 1 1 8 THR CG2 C -7.953 -3.754 -16.784 1.00 . A A . 8 THR CG2 1 1 8 4550 1 1 8 THR H H -6.977 -1.466 -14.021 1.00 . A A . 8 THR H 1 1 8 4551 1 1 8 THR HA H -7.926 -4.233 -14.187 1.00 . A A . 8 THR HA 1 1 8 4552 1 1 8 THR HB H -6.207 -4.673 -15.984 1.00 . A A . 8 THR HB 1 1 8 4553 1 1 8 THR HG1 H -5.379 -2.333 -15.529 1.00 . A A . 8 THR HG1 1 1 8 4554 1 1 8 THR HG21 H -8.497 -4.673 -16.624 1.00 . A A . 8 THR HG21 1 1 8 4555 1 1 8 THR HG22 H -7.645 -3.693 -17.817 1.00 . A A . 8 THR HG22 1 1 8 4556 1 1 8 THR HG23 H -8.588 -2.913 -16.547 1.00 . A A . 8 THR HG23 1 1 8 4557 1 1 8 THR N N -7.620 -2.192 -14.163 1.00 . A A . 8 THR N 1 1 8 4558 1 1 8 THR O O -5.135 -2.982 -13.197 1.00 . A A . 8 THR O 1 1 8 4559 1 1 8 THR OG1 O -5.851 -2.672 -16.294 1.00 . A A . 8 THR OG1 1 1 8 4560 1 1 9 GLY C C -5.046 -6.749 -11.442 1.00 . A A . 9 GLY C 1 1 8 4561 1 1 9 GLY CA C -4.704 -5.542 -12.292 1.00 . A A . 9 GLY CA 1 1 8 4562 1 1 9 GLY H H -6.473 -5.786 -13.430 1.00 . A A . 9 GLY H 1 1 8 4563 1 1 9 GLY HA2 H -3.857 -5.783 -12.917 1.00 . A A . 9 GLY HA2 1 1 8 4564 1 1 9 GLY HA3 H -4.437 -4.722 -11.642 1.00 . A A . 9 GLY HA3 1 1 8 4565 1 1 9 GLY N N -5.808 -5.128 -13.138 1.00 . A A . 9 GLY N 1 1 8 4566 1 1 9 GLY O O -4.434 -7.807 -11.581 1.00 . A A . 9 GLY O 1 1 8 4567 1 1 10 GLU C C -5.315 -8.082 -8.738 1.00 . A A . 10 GLU C 1 1 8 4568 1 1 10 GLU CA C -6.446 -7.675 -9.679 1.00 . A A . 10 GLU CA 1 1 8 4569 1 1 10 GLU CB C -6.896 -8.883 -10.504 1.00 . A A . 10 GLU CB 1 1 8 4570 1 1 10 GLU CD C -8.825 -7.552 -11.447 1.00 . A A . 10 GLU CD 1 1 8 4571 1 1 10 GLU CG C -8.377 -8.869 -10.845 1.00 . A A . 10 GLU CG 1 1 8 4572 1 1 10 GLU H H -6.476 -5.722 -10.493 1.00 . A A . 10 GLU H 1 1 8 4573 1 1 10 GLU HA H -7.279 -7.323 -9.091 1.00 . A A . 10 GLU HA 1 1 8 4574 1 1 10 GLU HB2 H -6.335 -8.903 -11.427 1.00 . A A . 10 GLU HB2 1 1 8 4575 1 1 10 GLU HB3 H -6.685 -9.783 -9.946 1.00 . A A . 10 GLU HB3 1 1 8 4576 1 1 10 GLU HG2 H -8.577 -9.658 -11.554 1.00 . A A . 10 GLU HG2 1 1 8 4577 1 1 10 GLU HG3 H -8.942 -9.046 -9.942 1.00 . A A . 10 GLU HG3 1 1 8 4578 1 1 10 GLU N N -6.026 -6.590 -10.557 1.00 . A A . 10 GLU N 1 1 8 4579 1 1 10 GLU O O -5.011 -9.266 -8.589 1.00 . A A . 10 GLU O 1 1 8 4580 1 1 10 GLU OE1 O -8.381 -7.231 -12.569 1.00 . A A . 10 GLU OE1 1 1 8 4581 1 1 10 GLU OE2 O -9.620 -6.843 -10.796 1.00 . A A . 10 GLU OE2 1 1 8 4582 1 1 11 LYS C C -4.129 -7.770 -5.812 1.00 . A A . 11 LYS C 1 1 8 4583 1 1 11 LYS CA C -3.599 -7.343 -7.177 1.00 . A A . 11 LYS CA 1 1 8 4584 1 1 11 LYS CB C -2.730 -6.092 -7.031 1.00 . A A . 11 LYS CB 1 1 8 4585 1 1 11 LYS CD C -2.182 -5.532 -9.417 1.00 . A A . 11 LYS CD 1 1 8 4586 1 1 11 LYS CE C -1.081 -5.417 -10.460 1.00 . A A . 11 LYS CE 1 1 8 4587 1 1 11 LYS CG C -1.633 -5.988 -8.076 1.00 . A A . 11 LYS CG 1 1 8 4588 1 1 11 LYS H H -4.983 -6.168 -8.266 1.00 . A A . 11 LYS H 1 1 8 4589 1 1 11 LYS HA H -2.998 -8.143 -7.583 1.00 . A A . 11 LYS HA 1 1 8 4590 1 1 11 LYS HB2 H -3.361 -5.219 -7.112 1.00 . A A . 11 LYS HB2 1 1 8 4591 1 1 11 LYS HB3 H -2.268 -6.102 -6.054 1.00 . A A . 11 LYS HB3 1 1 8 4592 1 1 11 LYS HD2 H -2.913 -6.249 -9.760 1.00 . A A . 11 LYS HD2 1 1 8 4593 1 1 11 LYS HD3 H -2.652 -4.567 -9.295 1.00 . A A . 11 LYS HD3 1 1 8 4594 1 1 11 LYS HE2 H -0.451 -6.291 -10.397 1.00 . A A . 11 LYS HE2 1 1 8 4595 1 1 11 LYS HE3 H -1.535 -5.371 -11.440 1.00 . A A . 11 LYS HE3 1 1 8 4596 1 1 11 LYS HG2 H -0.895 -5.274 -7.740 1.00 . A A . 11 LYS HG2 1 1 8 4597 1 1 11 LYS HG3 H -1.170 -6.957 -8.197 1.00 . A A . 11 LYS HG3 1 1 8 4598 1 1 11 LYS HZ1 H -0.046 -4.073 -9.242 1.00 . A A . 11 LYS HZ1 1 1 8 4599 1 1 11 LYS HZ2 H -0.747 -3.361 -10.608 1.00 . A A . 11 LYS HZ2 1 1 8 4600 1 1 11 LYS HZ3 H 0.654 -4.295 -10.766 1.00 . A A . 11 LYS HZ3 1 1 8 4601 1 1 11 LYS N N -4.696 -7.092 -8.105 1.00 . A A . 11 LYS N 1 1 8 4602 1 1 11 LYS NZ N -0.246 -4.202 -10.254 1.00 . A A . 11 LYS NZ 1 1 8 4603 1 1 11 LYS O O -5.162 -7.292 -5.343 1.00 . A A . 11 LYS O 1 1 8 4604 1 1 12 PRO C C -3.620 -8.149 -2.741 1.00 . A A . 12 PRO C 1 1 8 4605 1 1 12 PRO CA C -3.783 -9.199 -3.835 1.00 . A A . 12 PRO CA 1 1 8 4606 1 1 12 PRO CB C -2.810 -10.360 -3.611 1.00 . A A . 12 PRO CB 1 1 8 4607 1 1 12 PRO CD C -2.163 -9.303 -5.655 1.00 . A A . 12 PRO CD 1 1 8 4608 1 1 12 PRO CG C -1.626 -10.030 -4.453 1.00 . A A . 12 PRO CG 1 1 8 4609 1 1 12 PRO HA H -4.797 -9.571 -3.828 1.00 . A A . 12 PRO HA 1 1 8 4610 1 1 12 PRO HB2 H -2.548 -10.416 -2.564 1.00 . A A . 12 PRO HB2 1 1 8 4611 1 1 12 PRO HB3 H -3.270 -11.285 -3.923 1.00 . A A . 12 PRO HB3 1 1 8 4612 1 1 12 PRO HD2 H -1.464 -8.547 -5.982 1.00 . A A . 12 PRO HD2 1 1 8 4613 1 1 12 PRO HD3 H -2.371 -9.999 -6.455 1.00 . A A . 12 PRO HD3 1 1 8 4614 1 1 12 PRO HG2 H -0.949 -9.395 -3.902 1.00 . A A . 12 PRO HG2 1 1 8 4615 1 1 12 PRO HG3 H -1.128 -10.938 -4.757 1.00 . A A . 12 PRO HG3 1 1 8 4616 1 1 12 PRO N N -3.405 -8.690 -5.157 1.00 . A A . 12 PRO N 1 1 8 4617 1 1 12 PRO O O -4.302 -8.195 -1.717 1.00 . A A . 12 PRO O 1 1 8 4618 1 1 13 TYR C C -2.781 -4.776 -2.591 1.00 . A A . 13 TYR C 1 1 8 4619 1 1 13 TYR CA C -2.460 -6.144 -1.996 1.00 . A A . 13 TYR CA 1 1 8 4620 1 1 13 TYR CB C -1.002 -6.183 -1.535 1.00 . A A . 13 TYR CB 1 1 8 4621 1 1 13 TYR CD1 C -0.755 -7.993 0.209 1.00 . A A . 13 TYR CD1 1 1 8 4622 1 1 13 TYR CD2 C 0.101 -8.412 -1.976 1.00 . A A . 13 TYR CD2 1 1 8 4623 1 1 13 TYR CE1 C -0.338 -9.244 0.618 1.00 . A A . 13 TYR CE1 1 1 8 4624 1 1 13 TYR CE2 C 0.521 -9.665 -1.576 1.00 . A A . 13 TYR CE2 1 1 8 4625 1 1 13 TYR CG C -0.544 -7.555 -1.093 1.00 . A A . 13 TYR CG 1 1 8 4626 1 1 13 TYR CZ C 0.299 -10.077 -0.278 1.00 . A A . 13 TYR CZ 1 1 8 4627 1 1 13 TYR H H -2.201 -7.221 -3.800 1.00 . A A . 13 TYR H 1 1 8 4628 1 1 13 TYR HA H -3.102 -6.313 -1.144 1.00 . A A . 13 TYR HA 1 1 8 4629 1 1 13 TYR HB2 H -0.366 -5.868 -2.348 1.00 . A A . 13 TYR HB2 1 1 8 4630 1 1 13 TYR HB3 H -0.877 -5.507 -0.703 1.00 . A A . 13 TYR HB3 1 1 8 4631 1 1 13 TYR HD1 H -1.255 -7.338 0.908 1.00 . A A . 13 TYR HD1 1 1 8 4632 1 1 13 TYR HD2 H 0.274 -8.086 -2.991 1.00 . A A . 13 TYR HD2 1 1 8 4633 1 1 13 TYR HE1 H -0.511 -9.568 1.634 1.00 . A A . 13 TYR HE1 1 1 8 4634 1 1 13 TYR HE2 H 1.021 -10.318 -2.277 1.00 . A A . 13 TYR HE2 1 1 8 4635 1 1 13 TYR HH H 1.018 -11.823 -0.639 1.00 . A A . 13 TYR HH 1 1 8 4636 1 1 13 TYR N N -2.714 -7.205 -2.964 1.00 . A A . 13 TYR N 1 1 8 4637 1 1 13 TYR O O -2.729 -4.587 -3.806 1.00 . A A . 13 TYR O 1 1 8 4638 1 1 13 TYR OH O 0.717 -11.325 0.124 1.00 . A A . 13 TYR OH 1 1 8 4639 1 1 14 ARG C C -3.264 -1.474 -1.022 1.00 . A A . 14 ARG C 1 1 8 4640 1 1 14 ARG CA C -3.441 -2.473 -2.161 1.00 . A A . 14 ARG CA 1 1 8 4641 1 1 14 ARG CB C -4.879 -2.419 -2.682 1.00 . A A . 14 ARG CB 1 1 8 4642 1 1 14 ARG CD C -6.714 -0.998 -3.644 1.00 . A A . 14 ARG CD 1 1 8 4643 1 1 14 ARG CG C -5.219 -1.123 -3.398 1.00 . A A . 14 ARG CG 1 1 8 4644 1 1 14 ARG CZ C -7.405 -2.966 -4.946 1.00 . A A . 14 ARG CZ 1 1 8 4645 1 1 14 ARG H H -3.135 -4.036 -0.767 1.00 . A A . 14 ARG H 1 1 8 4646 1 1 14 ARG HA H -2.767 -2.210 -2.963 1.00 . A A . 14 ARG HA 1 1 8 4647 1 1 14 ARG HB2 H -5.030 -3.236 -3.372 1.00 . A A . 14 ARG HB2 1 1 8 4648 1 1 14 ARG HB3 H -5.555 -2.533 -1.848 1.00 . A A . 14 ARG HB3 1 1 8 4649 1 1 14 ARG HD2 H -7.241 -1.440 -2.812 1.00 . A A . 14 ARG HD2 1 1 8 4650 1 1 14 ARG HD3 H -6.967 0.049 -3.715 1.00 . A A . 14 ARG HD3 1 1 8 4651 1 1 14 ARG HE H -7.193 -1.126 -5.687 1.00 . A A . 14 ARG HE 1 1 8 4652 1 1 14 ARG HG2 H -4.895 -0.291 -2.791 1.00 . A A . 14 ARG HG2 1 1 8 4653 1 1 14 ARG HG3 H -4.703 -1.101 -4.347 1.00 . A A . 14 ARG HG3 1 1 8 4654 1 1 14 ARG HH11 H -7.047 -3.323 -2.991 1.00 . A A . 14 ARG HH11 1 1 8 4655 1 1 14 ARG HH12 H -7.535 -4.702 -3.919 1.00 . A A . 14 ARG HH12 1 1 8 4656 1 1 14 ARG HH21 H -7.836 -2.934 -6.921 1.00 . A A . 14 ARG HH21 1 1 8 4657 1 1 14 ARG HH22 H -7.983 -4.479 -6.155 1.00 . A A . 14 ARG HH22 1 1 8 4658 1 1 14 ARG N N -3.111 -3.824 -1.724 1.00 . A A . 14 ARG N 1 1 8 4659 1 1 14 ARG NE N -7.124 -1.669 -4.875 1.00 . A A . 14 ARG NE 1 1 8 4660 1 1 14 ARG NH1 N -7.322 -3.726 -3.863 1.00 . A A . 14 ARG NH1 1 1 8 4661 1 1 14 ARG NH2 N -7.772 -3.504 -6.102 1.00 . A A . 14 ARG NH2 1 1 8 4662 1 1 14 ARG O O -3.395 -1.825 0.151 1.00 . A A . 14 ARG O 1 1 8 4663 1 1 15 CYS C C -4.103 1.416 0.052 1.00 . A A . 15 CYS C 1 1 8 4664 1 1 15 CYS CA C -2.767 0.821 -0.383 1.00 . A A . 15 CYS CA 1 1 8 4665 1 1 15 CYS CB C -1.866 1.922 -0.947 1.00 . A A . 15 CYS CB 1 1 8 4666 1 1 15 CYS H H -2.873 -0.010 -2.327 1.00 . A A . 15 CYS H 1 1 8 4667 1 1 15 CYS HA H -2.287 0.380 0.477 1.00 . A A . 15 CYS HA 1 1 8 4668 1 1 15 CYS HB2 H -1.018 1.466 -1.437 1.00 . A A . 15 CYS HB2 1 1 8 4669 1 1 15 CYS HB3 H -2.425 2.499 -1.669 1.00 . A A . 15 CYS HB3 1 1 8 4670 1 1 15 CYS N N -2.964 -0.229 -1.375 1.00 . A A . 15 CYS N 1 1 8 4671 1 1 15 CYS O O -4.909 1.833 -0.780 1.00 . A A . 15 CYS O 1 1 8 4672 1 1 15 CYS SG S -1.225 3.075 0.309 1.00 . A A . 15 CYS SG 1 1 8 4673 1 1 16 ALA C C -5.438 3.493 2.171 1.00 . A A . 16 ALA C 1 1 8 4674 1 1 16 ALA CA C -5.567 1.997 1.907 1.00 . A A . 16 ALA CA 1 1 8 4675 1 1 16 ALA CB C -5.949 1.264 3.184 1.00 . A A . 16 ALA CB 1 1 8 4676 1 1 16 ALA H H -3.650 1.105 1.974 1.00 . A A . 16 ALA H 1 1 8 4677 1 1 16 ALA HA H -6.352 1.837 1.181 1.00 . A A . 16 ALA HA 1 1 8 4678 1 1 16 ALA HB1 H -6.644 1.866 3.750 1.00 . A A . 16 ALA HB1 1 1 8 4679 1 1 16 ALA HB2 H -6.410 0.320 2.932 1.00 . A A . 16 ALA HB2 1 1 8 4680 1 1 16 ALA HB3 H -5.063 1.086 3.775 1.00 . A A . 16 ALA HB3 1 1 8 4681 1 1 16 ALA N N -4.331 1.452 1.361 1.00 . A A . 16 ALA N 1 1 8 4682 1 1 16 ALA O O -6.072 4.029 3.080 1.00 . A A . 16 ALA O 1 1 8 4683 1 1 17 GLU C C -4.560 6.314 0.186 1.00 . A A . 17 GLU C 1 1 8 4684 1 1 17 GLU CA C -4.398 5.596 1.524 1.00 . A A . 17 GLU CA 1 1 8 4685 1 1 17 GLU CB C -3.007 5.870 2.097 1.00 . A A . 17 GLU CB 1 1 8 4686 1 1 17 GLU CD C -3.217 6.569 4.516 1.00 . A A . 17 GLU CD 1 1 8 4687 1 1 17 GLU CG C -2.855 5.456 3.551 1.00 . A A . 17 GLU CG 1 1 8 4688 1 1 17 GLU H H -4.134 3.679 0.667 1.00 . A A . 17 GLU H 1 1 8 4689 1 1 17 GLU HA H -5.141 5.972 2.211 1.00 . A A . 17 GLU HA 1 1 8 4690 1 1 17 GLU HB2 H -2.277 5.331 1.512 1.00 . A A . 17 GLU HB2 1 1 8 4691 1 1 17 GLU HB3 H -2.802 6.928 2.023 1.00 . A A . 17 GLU HB3 1 1 8 4692 1 1 17 GLU HG2 H -3.502 4.612 3.741 1.00 . A A . 17 GLU HG2 1 1 8 4693 1 1 17 GLU HG3 H -1.829 5.168 3.725 1.00 . A A . 17 GLU HG3 1 1 8 4694 1 1 17 GLU N N -4.611 4.162 1.373 1.00 . A A . 17 GLU N 1 1 8 4695 1 1 17 GLU O O -5.296 7.295 0.080 1.00 . A A . 17 GLU O 1 1 8 4696 1 1 17 GLU OE1 O -3.173 7.747 4.106 1.00 . A A . 17 GLU OE1 1 1 8 4697 1 1 17 GLU OE2 O -3.544 6.260 5.681 1.00 . A A . 17 GLU OE2 1 1 8 4698 1 1 18 CYS C C -4.685 5.501 -3.127 1.00 . A A . 18 CYS C 1 1 8 4699 1 1 18 CYS CA C -3.928 6.410 -2.162 1.00 . A A . 18 CYS CA 1 1 8 4700 1 1 18 CYS CB C -2.518 6.675 -2.694 1.00 . A A . 18 CYS CB 1 1 8 4701 1 1 18 CYS H H -3.294 5.033 -0.685 1.00 . A A . 18 CYS H 1 1 8 4702 1 1 18 CYS HA H -4.456 7.349 -2.083 1.00 . A A . 18 CYS HA 1 1 8 4703 1 1 18 CYS HB2 H -2.588 7.076 -3.694 1.00 . A A . 18 CYS HB2 1 1 8 4704 1 1 18 CYS HB3 H -2.031 7.397 -2.055 1.00 . A A . 18 CYS HB3 1 1 8 4705 1 1 18 CYS N N -3.865 5.818 -0.832 1.00 . A A . 18 CYS N 1 1 8 4706 1 1 18 CYS O O -5.563 5.951 -3.861 1.00 . A A . 18 CYS O 1 1 8 4707 1 1 18 CYS SG S -1.460 5.194 -2.766 1.00 . A A . 18 CYS SG 1 1 8 4708 1 1 19 GLY C C -4.030 2.625 -4.978 1.00 . A A . 19 GLY C 1 1 8 4709 1 1 19 GLY CA C -4.991 3.266 -3.996 1.00 . A A . 19 GLY CA 1 1 8 4710 1 1 19 GLY H H -3.628 3.916 -2.512 1.00 . A A . 19 GLY H 1 1 8 4711 1 1 19 GLY HA2 H -5.445 2.492 -3.395 1.00 . A A . 19 GLY HA2 1 1 8 4712 1 1 19 GLY HA3 H -5.765 3.777 -4.550 1.00 . A A . 19 GLY HA3 1 1 8 4713 1 1 19 GLY N N -4.336 4.218 -3.119 1.00 . A A . 19 GLY N 1 1 8 4714 1 1 19 GLY O O -4.360 2.437 -6.149 1.00 . A A . 19 GLY O 1 1 8 4715 1 1 20 LYS C C -1.955 0.148 -5.322 1.00 . A A . 20 LYS C 1 1 8 4716 1 1 20 LYS CA C -1.822 1.668 -5.344 1.00 . A A . 20 LYS CA 1 1 8 4717 1 1 20 LYS CB C -0.423 2.075 -4.880 1.00 . A A . 20 LYS CB 1 1 8 4718 1 1 20 LYS CD C 1.497 3.684 -5.071 1.00 . A A . 20 LYS CD 1 1 8 4719 1 1 20 LYS CE C 1.948 5.035 -5.606 1.00 . A A . 20 LYS CE 1 1 8 4720 1 1 20 LYS CG C 0.102 3.330 -5.556 1.00 . A A . 20 LYS CG 1 1 8 4721 1 1 20 LYS H H -2.632 2.466 -3.558 1.00 . A A . 20 LYS H 1 1 8 4722 1 1 20 LYS HA H -1.972 2.015 -6.355 1.00 . A A . 20 LYS HA 1 1 8 4723 1 1 20 LYS HB2 H -0.446 2.249 -3.814 1.00 . A A . 20 LYS HB2 1 1 8 4724 1 1 20 LYS HB3 H 0.263 1.266 -5.088 1.00 . A A . 20 LYS HB3 1 1 8 4725 1 1 20 LYS HD2 H 1.496 3.719 -3.992 1.00 . A A . 20 LYS HD2 1 1 8 4726 1 1 20 LYS HD3 H 2.189 2.924 -5.408 1.00 . A A . 20 LYS HD3 1 1 8 4727 1 1 20 LYS HE2 H 1.193 5.770 -5.372 1.00 . A A . 20 LYS HE2 1 1 8 4728 1 1 20 LYS HE3 H 2.875 5.306 -5.124 1.00 . A A . 20 LYS HE3 1 1 8 4729 1 1 20 LYS HG2 H 0.134 3.166 -6.623 1.00 . A A . 20 LYS HG2 1 1 8 4730 1 1 20 LYS HG3 H -0.565 4.152 -5.336 1.00 . A A . 20 LYS HG3 1 1 8 4731 1 1 20 LYS HZ1 H 3.151 5.210 -7.304 1.00 . A A . 20 LYS HZ1 1 1 8 4732 1 1 20 LYS HZ2 H 1.555 5.721 -7.539 1.00 . A A . 20 LYS HZ2 1 1 8 4733 1 1 20 LYS HZ3 H 1.912 4.069 -7.457 1.00 . A A . 20 LYS HZ3 1 1 8 4734 1 1 20 LYS N N -2.836 2.290 -4.501 1.00 . A A . 20 LYS N 1 1 8 4735 1 1 20 LYS NZ N 2.156 5.007 -7.080 1.00 . A A . 20 LYS NZ 1 1 8 4736 1 1 20 LYS O O -2.515 -0.422 -4.386 1.00 . A A . 20 LYS O 1 1 8 4737 1 1 21 ALA C C -0.108 -2.572 -6.271 1.00 . A A . 21 ALA C 1 1 8 4738 1 1 21 ALA CA C -1.490 -1.955 -6.454 1.00 . A A . 21 ALA CA 1 1 8 4739 1 1 21 ALA CB C -2.084 -2.372 -7.791 1.00 . A A . 21 ALA CB 1 1 8 4740 1 1 21 ALA H H -0.999 0.008 -7.072 1.00 . A A . 21 ALA H 1 1 8 4741 1 1 21 ALA HA H -2.141 -2.317 -5.670 1.00 . A A . 21 ALA HA 1 1 8 4742 1 1 21 ALA HB1 H -2.504 -3.363 -7.705 1.00 . A A . 21 ALA HB1 1 1 8 4743 1 1 21 ALA HB2 H -2.860 -1.675 -8.073 1.00 . A A . 21 ALA HB2 1 1 8 4744 1 1 21 ALA HB3 H -1.309 -2.373 -8.544 1.00 . A A . 21 ALA HB3 1 1 8 4745 1 1 21 ALA N N -1.433 -0.502 -6.357 1.00 . A A . 21 ALA N 1 1 8 4746 1 1 21 ALA O O 0.877 -2.092 -6.834 1.00 . A A . 21 ALA O 1 1 8 4747 1 1 22 PHE C C 1.079 -5.825 -5.421 1.00 . A A . 22 PHE C 1 1 8 4748 1 1 22 PHE CA C 1.223 -4.319 -5.222 1.00 . A A . 22 PHE CA 1 1 8 4749 1 1 22 PHE CB C 1.704 -4.025 -3.799 1.00 . A A . 22 PHE CB 1 1 8 4750 1 1 22 PHE CD1 C 1.157 -1.616 -3.357 1.00 . A A . 22 PHE CD1 1 1 8 4751 1 1 22 PHE CD2 C 3.447 -2.229 -3.619 1.00 . A A . 22 PHE CD2 1 1 8 4752 1 1 22 PHE CE1 C 1.529 -0.300 -3.163 1.00 . A A . 22 PHE CE1 1 1 8 4753 1 1 22 PHE CE2 C 3.825 -0.914 -3.425 1.00 . A A . 22 PHE CE2 1 1 8 4754 1 1 22 PHE CG C 2.111 -2.595 -3.588 1.00 . A A . 22 PHE CG 1 1 8 4755 1 1 22 PHE CZ C 2.865 0.052 -3.196 1.00 . A A . 22 PHE CZ 1 1 8 4756 1 1 22 PHE H H -0.859 -3.973 -5.059 1.00 . A A . 22 PHE H 1 1 8 4757 1 1 22 PHE HA H 1.951 -3.943 -5.924 1.00 . A A . 22 PHE HA 1 1 8 4758 1 1 22 PHE HB2 H 0.909 -4.249 -3.104 1.00 . A A . 22 PHE HB2 1 1 8 4759 1 1 22 PHE HB3 H 2.556 -4.650 -3.579 1.00 . A A . 22 PHE HB3 1 1 8 4760 1 1 22 PHE HD1 H 0.113 -1.890 -3.330 1.00 . A A . 22 PHE HD1 1 1 8 4761 1 1 22 PHE HD2 H 4.199 -2.984 -3.798 1.00 . A A . 22 PHE HD2 1 1 8 4762 1 1 22 PHE HE1 H 0.777 0.454 -2.983 1.00 . A A . 22 PHE HE1 1 1 8 4763 1 1 22 PHE HE2 H 4.870 -0.642 -3.451 1.00 . A A . 22 PHE HE2 1 1 8 4764 1 1 22 PHE HZ H 3.157 1.080 -3.045 1.00 . A A . 22 PHE HZ 1 1 8 4765 1 1 22 PHE N N -0.040 -3.638 -5.480 1.00 . A A . 22 PHE N 1 1 8 4766 1 1 22 PHE O O -0.027 -6.365 -5.388 1.00 . A A . 22 PHE O 1 1 8 4767 1 1 23 THR C C 2.428 -8.685 -4.522 1.00 . A A . 23 THR C 1 1 8 4768 1 1 23 THR CA C 2.207 -7.942 -5.835 1.00 . A A . 23 THR CA 1 1 8 4769 1 1 23 THR CB C 3.294 -8.365 -6.841 1.00 . A A . 23 THR CB 1 1 8 4770 1 1 23 THR CG2 C 3.064 -7.708 -8.194 1.00 . A A . 23 THR CG2 1 1 8 4771 1 1 23 THR H H 3.057 -6.013 -5.644 1.00 . A A . 23 THR H 1 1 8 4772 1 1 23 THR HA H 1.244 -8.222 -6.238 1.00 . A A . 23 THR HA 1 1 8 4773 1 1 23 THR HB H 3.250 -9.437 -6.966 1.00 . A A . 23 THR HB 1 1 8 4774 1 1 23 THR HG1 H 5.213 -8.708 -6.541 1.00 . A A . 23 THR HG1 1 1 8 4775 1 1 23 THR HG21 H 2.064 -7.303 -8.232 1.00 . A A . 23 THR HG21 1 1 8 4776 1 1 23 THR HG22 H 3.184 -8.443 -8.976 1.00 . A A . 23 THR HG22 1 1 8 4777 1 1 23 THR HG23 H 3.781 -6.913 -8.334 1.00 . A A . 23 THR HG23 1 1 8 4778 1 1 23 THR N N 2.206 -6.499 -5.628 1.00 . A A . 23 THR N 1 1 8 4779 1 1 23 THR O O 1.776 -9.693 -4.251 1.00 . A A . 23 THR O 1 1 8 4780 1 1 23 THR OG1 O 4.588 -8.006 -6.344 1.00 . A A . 23 THR OG1 1 1 8 4781 1 1 24 ASP C C 3.321 -7.851 -1.276 1.00 . A A . 24 ASP C 1 1 8 4782 1 1 24 ASP CA C 3.658 -8.796 -2.425 1.00 . A A . 24 ASP CA 1 1 8 4783 1 1 24 ASP CB C 5.135 -9.189 -2.362 1.00 . A A . 24 ASP CB 1 1 8 4784 1 1 24 ASP CG C 5.450 -10.066 -1.167 1.00 . A A . 24 ASP CG 1 1 8 4785 1 1 24 ASP H H 3.838 -7.375 -3.983 1.00 . A A . 24 ASP H 1 1 8 4786 1 1 24 ASP HA H 3.054 -9.686 -2.331 1.00 . A A . 24 ASP HA 1 1 8 4787 1 1 24 ASP HB2 H 5.395 -9.730 -3.261 1.00 . A A . 24 ASP HB2 1 1 8 4788 1 1 24 ASP HB3 H 5.736 -8.294 -2.299 1.00 . A A . 24 ASP HB3 1 1 8 4789 1 1 24 ASP N N 3.351 -8.181 -3.711 1.00 . A A . 24 ASP N 1 1 8 4790 1 1 24 ASP O O 3.324 -6.631 -1.442 1.00 . A A . 24 ASP O 1 1 8 4791 1 1 24 ASP OD1 O 4.959 -11.213 -1.127 1.00 . A A . 24 ASP OD1 1 1 8 4792 1 1 24 ASP OD2 O 6.188 -9.605 -0.270 1.00 . A A . 24 ASP OD2 1 1 8 4793 1 1 25 ARG C C 3.862 -6.755 1.489 1.00 . A A . 25 ARG C 1 1 8 4794 1 1 25 ARG CA C 2.687 -7.631 1.063 1.00 . A A . 25 ARG CA 1 1 8 4795 1 1 25 ARG CB C 2.275 -8.546 2.218 1.00 . A A . 25 ARG CB 1 1 8 4796 1 1 25 ARG CD C 0.912 -8.833 4.310 1.00 . A A . 25 ARG CD 1 1 8 4797 1 1 25 ARG CG C 1.446 -7.847 3.283 1.00 . A A . 25 ARG CG 1 1 8 4798 1 1 25 ARG CZ C 1.836 -10.297 6.055 1.00 . A A . 25 ARG CZ 1 1 8 4799 1 1 25 ARG H H 3.044 -9.400 -0.043 1.00 . A A . 25 ARG H 1 1 8 4800 1 1 25 ARG HA H 1.854 -6.995 0.805 1.00 . A A . 25 ARG HA 1 1 8 4801 1 1 25 ARG HB2 H 1.695 -9.367 1.823 1.00 . A A . 25 ARG HB2 1 1 8 4802 1 1 25 ARG HB3 H 3.166 -8.938 2.686 1.00 . A A . 25 ARG HB3 1 1 8 4803 1 1 25 ARG HD2 H 0.394 -8.284 5.081 1.00 . A A . 25 ARG HD2 1 1 8 4804 1 1 25 ARG HD3 H 0.221 -9.503 3.819 1.00 . A A . 25 ARG HD3 1 1 8 4805 1 1 25 ARG HE H 2.847 -9.639 4.467 1.00 . A A . 25 ARG HE 1 1 8 4806 1 1 25 ARG HG2 H 2.065 -7.119 3.787 1.00 . A A . 25 ARG HG2 1 1 8 4807 1 1 25 ARG HG3 H 0.615 -7.348 2.808 1.00 . A A . 25 ARG HG3 1 1 8 4808 1 1 25 ARG HH11 H -0.096 -9.769 6.323 1.00 . A A . 25 ARG HH11 1 1 8 4809 1 1 25 ARG HH12 H 0.568 -10.801 7.546 1.00 . A A . 25 ARG HH12 1 1 8 4810 1 1 25 ARG HH21 H 3.732 -10.997 6.071 1.00 . A A . 25 ARG HH21 1 1 8 4811 1 1 25 ARG HH22 H 2.745 -11.498 7.403 1.00 . A A . 25 ARG HH22 1 1 8 4812 1 1 25 ARG N N 3.029 -8.423 -0.112 1.00 . A A . 25 ARG N 1 1 8 4813 1 1 25 ARG NE N 1.980 -9.618 4.923 1.00 . A A . 25 ARG NE 1 1 8 4814 1 1 25 ARG NH1 N 0.674 -10.288 6.694 1.00 . A A . 25 ARG NH1 1 1 8 4815 1 1 25 ARG NH2 N 2.855 -10.988 6.550 1.00 . A A . 25 ARG NH2 1 1 8 4816 1 1 25 ARG O O 3.718 -5.544 1.654 1.00 . A A . 25 ARG O 1 1 8 4817 1 1 26 SER C C 6.367 -5.352 1.292 1.00 . A A . 26 SER C 1 1 8 4818 1 1 26 SER CA C 6.222 -6.654 2.075 1.00 . A A . 26 SER CA 1 1 8 4819 1 1 26 SER CB C 7.463 -7.525 1.872 1.00 . A A . 26 SER CB 1 1 8 4820 1 1 26 SER H H 5.075 -8.344 1.517 1.00 . A A . 26 SER H 1 1 8 4821 1 1 26 SER HA H 6.125 -6.420 3.125 1.00 . A A . 26 SER HA 1 1 8 4822 1 1 26 SER HB2 H 7.331 -8.462 2.391 1.00 . A A . 26 SER HB2 1 1 8 4823 1 1 26 SER HB3 H 7.598 -7.714 0.817 1.00 . A A . 26 SER HB3 1 1 8 4824 1 1 26 SER HG H 9.009 -7.420 3.071 1.00 . A A . 26 SER HG 1 1 8 4825 1 1 26 SER N N 5.024 -7.376 1.665 1.00 . A A . 26 SER N 1 1 8 4826 1 1 26 SER O O 6.632 -4.297 1.865 1.00 . A A . 26 SER O 1 1 8 4827 1 1 26 SER OG O 8.624 -6.885 2.374 1.00 . A A . 26 SER OG 1 1 8 4828 1 1 27 ASN C C 5.250 -3.224 -0.526 1.00 . A A . 27 ASN C 1 1 8 4829 1 1 27 ASN CA C 6.303 -4.267 -0.886 1.00 . A A . 27 ASN CA 1 1 8 4830 1 1 27 ASN CB C 6.153 -4.674 -2.353 1.00 . A A . 27 ASN CB 1 1 8 4831 1 1 27 ASN CG C 7.261 -5.604 -2.811 1.00 . A A . 27 ASN CG 1 1 8 4832 1 1 27 ASN H H 5.982 -6.308 -0.422 1.00 . A A . 27 ASN H 1 1 8 4833 1 1 27 ASN HA H 7.282 -3.839 -0.738 1.00 . A A . 27 ASN HA 1 1 8 4834 1 1 27 ASN HB2 H 5.208 -5.180 -2.486 1.00 . A A . 27 ASN HB2 1 1 8 4835 1 1 27 ASN HB3 H 6.173 -3.789 -2.971 1.00 . A A . 27 ASN HB3 1 1 8 4836 1 1 27 ASN HD21 H 6.067 -6.384 -4.197 1.00 . A A . 27 ASN HD21 1 1 8 4837 1 1 27 ASN HD22 H 7.665 -7.036 -4.129 1.00 . A A . 27 ASN HD22 1 1 8 4838 1 1 27 ASN N N 6.191 -5.437 -0.023 1.00 . A A . 27 ASN N 1 1 8 4839 1 1 27 ASN ND2 N 6.968 -6.424 -3.814 1.00 . A A . 27 ASN ND2 1 1 8 4840 1 1 27 ASN O O 5.539 -2.028 -0.470 1.00 . A A . 27 ASN O 1 1 8 4841 1 1 27 ASN OD1 O 8.366 -5.585 -2.269 1.00 . A A . 27 ASN OD1 1 1 8 4842 1 1 28 LEU C C 3.229 -2.052 1.373 1.00 . A A . 28 LEU C 1 1 8 4843 1 1 28 LEU CA C 2.930 -2.791 0.072 1.00 . A A . 28 LEU CA 1 1 8 4844 1 1 28 LEU CB C 1.627 -3.581 0.208 1.00 . A A . 28 LEU CB 1 1 8 4845 1 1 28 LEU CD1 C 0.063 -1.632 0.011 1.00 . A A . 28 LEU CD1 1 1 8 4846 1 1 28 LEU CD2 C -0.731 -3.771 1.036 1.00 . A A . 28 LEU CD2 1 1 8 4847 1 1 28 LEU CG C 0.456 -2.838 0.851 1.00 . A A . 28 LEU CG 1 1 8 4848 1 1 28 LEU H H 3.858 -4.647 -0.343 1.00 . A A . 28 LEU H 1 1 8 4849 1 1 28 LEU HA H 2.822 -2.067 -0.722 1.00 . A A . 28 LEU HA 1 1 8 4850 1 1 28 LEU HB2 H 1.322 -3.887 -0.780 1.00 . A A . 28 LEU HB2 1 1 8 4851 1 1 28 LEU HB3 H 1.834 -4.457 0.807 1.00 . A A . 28 LEU HB3 1 1 8 4852 1 1 28 LEU HD11 H -0.003 -1.923 -1.026 1.00 . A A . 28 LEU HD11 1 1 8 4853 1 1 28 LEU HD12 H 0.807 -0.858 0.122 1.00 . A A . 28 LEU HD12 1 1 8 4854 1 1 28 LEU HD13 H -0.896 -1.260 0.343 1.00 . A A . 28 LEU HD13 1 1 8 4855 1 1 28 LEU HD21 H -1.402 -3.671 0.196 1.00 . A A . 28 LEU HD21 1 1 8 4856 1 1 28 LEU HD22 H -1.253 -3.514 1.947 1.00 . A A . 28 LEU HD22 1 1 8 4857 1 1 28 LEU HD23 H -0.381 -4.791 1.098 1.00 . A A . 28 LEU HD23 1 1 8 4858 1 1 28 LEU HG H 0.756 -2.480 1.827 1.00 . A A . 28 LEU HG 1 1 8 4859 1 1 28 LEU N N 4.027 -3.684 -0.283 1.00 . A A . 28 LEU N 1 1 8 4860 1 1 28 LEU O O 3.183 -0.823 1.426 1.00 . A A . 28 LEU O 1 1 8 4861 1 1 29 PHE C C 4.918 -1.151 3.595 1.00 . A A . 29 PHE C 1 1 8 4862 1 1 29 PHE CA C 3.844 -2.227 3.721 1.00 . A A . 29 PHE CA 1 1 8 4863 1 1 29 PHE CB C 4.307 -3.314 4.694 1.00 . A A . 29 PHE CB 1 1 8 4864 1 1 29 PHE CD1 C 2.257 -4.759 4.769 1.00 . A A . 29 PHE CD1 1 1 8 4865 1 1 29 PHE CD2 C 3.045 -3.804 6.807 1.00 . A A . 29 PHE CD2 1 1 8 4866 1 1 29 PHE CE1 C 1.219 -5.365 5.451 1.00 . A A . 29 PHE CE1 1 1 8 4867 1 1 29 PHE CE2 C 2.009 -4.408 7.494 1.00 . A A . 29 PHE CE2 1 1 8 4868 1 1 29 PHE CG C 3.180 -3.972 5.438 1.00 . A A . 29 PHE CG 1 1 8 4869 1 1 29 PHE CZ C 1.095 -5.190 6.816 1.00 . A A . 29 PHE CZ 1 1 8 4870 1 1 29 PHE H H 3.556 -3.784 2.316 1.00 . A A . 29 PHE H 1 1 8 4871 1 1 29 PHE HA H 2.941 -1.775 4.103 1.00 . A A . 29 PHE HA 1 1 8 4872 1 1 29 PHE HB2 H 4.832 -4.080 4.143 1.00 . A A . 29 PHE HB2 1 1 8 4873 1 1 29 PHE HB3 H 4.975 -2.876 5.420 1.00 . A A . 29 PHE HB3 1 1 8 4874 1 1 29 PHE HD1 H 2.352 -4.898 3.702 1.00 . A A . 29 PHE HD1 1 1 8 4875 1 1 29 PHE HD2 H 3.760 -3.192 7.339 1.00 . A A . 29 PHE HD2 1 1 8 4876 1 1 29 PHE HE1 H 0.506 -5.976 4.918 1.00 . A A . 29 PHE HE1 1 1 8 4877 1 1 29 PHE HE2 H 1.916 -4.269 8.561 1.00 . A A . 29 PHE HE2 1 1 8 4878 1 1 29 PHE HZ H 0.285 -5.662 7.351 1.00 . A A . 29 PHE HZ 1 1 8 4879 1 1 29 PHE N N 3.536 -2.810 2.421 1.00 . A A . 29 PHE N 1 1 8 4880 1 1 29 PHE O O 4.765 -0.041 4.107 1.00 . A A . 29 PHE O 1 1 8 4881 1 1 30 THR C C 6.618 0.752 2.097 1.00 . A A . 30 THR C 1 1 8 4882 1 1 30 THR CA C 7.107 -0.552 2.717 1.00 . A A . 30 THR CA 1 1 8 4883 1 1 30 THR CB C 8.205 -1.153 1.819 1.00 . A A . 30 THR CB 1 1 8 4884 1 1 30 THR CG2 C 9.392 -0.208 1.708 1.00 . A A . 30 THR CG2 1 1 8 4885 1 1 30 THR H H 6.069 -2.386 2.526 1.00 . A A . 30 THR H 1 1 8 4886 1 1 30 THR HA H 7.538 -0.339 3.684 1.00 . A A . 30 THR HA 1 1 8 4887 1 1 30 THR HB H 7.796 -1.311 0.832 1.00 . A A . 30 THR HB 1 1 8 4888 1 1 30 THR HG1 H 9.375 -2.268 2.951 1.00 . A A . 30 THR HG1 1 1 8 4889 1 1 30 THR HG21 H 9.038 0.812 1.690 1.00 . A A . 30 THR HG21 1 1 8 4890 1 1 30 THR HG22 H 9.935 -0.417 0.799 1.00 . A A . 30 THR HG22 1 1 8 4891 1 1 30 THR HG23 H 10.044 -0.348 2.557 1.00 . A A . 30 THR HG23 1 1 8 4892 1 1 30 THR N N 6.006 -1.487 2.909 1.00 . A A . 30 THR N 1 1 8 4893 1 1 30 THR O O 7.112 1.832 2.426 1.00 . A A . 30 THR O 1 1 8 4894 1 1 30 THR OG1 O 8.638 -2.410 2.351 1.00 . A A . 30 THR OG1 1 1 8 4895 1 1 31 HIS C C 4.305 2.682 1.517 1.00 . A A . 31 HIS C 1 1 8 4896 1 1 31 HIS CA C 5.088 1.819 0.532 1.00 . A A . 31 HIS CA 1 1 8 4897 1 1 31 HIS CB C 4.182 1.393 -0.623 1.00 . A A . 31 HIS CB 1 1 8 4898 1 1 31 HIS CD2 C 1.888 2.570 -0.911 1.00 . A A . 31 HIS CD2 1 1 8 4899 1 1 31 HIS CE1 C 2.573 4.346 -1.999 1.00 . A A . 31 HIS CE1 1 1 8 4900 1 1 31 HIS CG C 3.229 2.462 -1.062 1.00 . A A . 31 HIS CG 1 1 8 4901 1 1 31 HIS H H 5.293 -0.241 0.977 1.00 . A A . 31 HIS H 1 1 8 4902 1 1 31 HIS HA H 5.910 2.399 0.139 1.00 . A A . 31 HIS HA 1 1 8 4903 1 1 31 HIS HB2 H 4.794 1.126 -1.472 1.00 . A A . 31 HIS HB2 1 1 8 4904 1 1 31 HIS HB3 H 3.601 0.534 -0.319 1.00 . A A . 31 HIS HB3 1 1 8 4905 1 1 31 HIS HD1 H 4.546 3.805 -2.011 1.00 . A A . 31 HIS HD1 1 1 8 4906 1 1 31 HIS HD2 H 1.239 1.860 -0.417 1.00 . A A . 31 HIS HD2 1 1 8 4907 1 1 31 HIS HE1 H 2.583 5.291 -2.521 1.00 . A A . 31 HIS HE1 1 1 8 4908 1 1 31 HIS N N 5.645 0.647 1.198 1.00 . A A . 31 HIS N 1 1 8 4909 1 1 31 HIS ND1 N 3.628 3.590 -1.748 1.00 . A A . 31 HIS ND1 1 1 8 4910 1 1 31 HIS NE2 N 1.505 3.749 -1.501 1.00 . A A . 31 HIS NE2 1 1 8 4911 1 1 31 HIS O O 4.562 3.879 1.647 1.00 . A A . 31 HIS O 1 1 8 4912 1 1 32 GLN C C 3.391 3.666 4.072 1.00 . A A . 32 GLN C 1 1 8 4913 1 1 32 GLN CA C 2.529 2.780 3.178 1.00 . A A . 32 GLN CA 1 1 8 4914 1 1 32 GLN CB C 1.737 1.790 4.033 1.00 . A A . 32 GLN CB 1 1 8 4915 1 1 32 GLN CD C -0.401 0.476 4.329 1.00 . A A . 32 GLN CD 1 1 8 4916 1 1 32 GLN CG C 0.376 1.440 3.454 1.00 . A A . 32 GLN CG 1 1 8 4917 1 1 32 GLN H H 3.193 1.112 2.058 1.00 . A A . 32 GLN H 1 1 8 4918 1 1 32 GLN HA H 1.838 3.405 2.632 1.00 . A A . 32 GLN HA 1 1 8 4919 1 1 32 GLN HB2 H 2.308 0.879 4.130 1.00 . A A . 32 GLN HB2 1 1 8 4920 1 1 32 GLN HB3 H 1.588 2.218 5.013 1.00 . A A . 32 GLN HB3 1 1 8 4921 1 1 32 GLN HE21 H 0.302 -1.069 3.293 1.00 . A A . 32 GLN HE21 1 1 8 4922 1 1 32 GLN HE22 H -0.767 -1.460 4.593 1.00 . A A . 32 GLN HE22 1 1 8 4923 1 1 32 GLN HG2 H -0.200 2.347 3.347 1.00 . A A . 32 GLN HG2 1 1 8 4924 1 1 32 GLN HG3 H 0.517 0.988 2.483 1.00 . A A . 32 GLN HG3 1 1 8 4925 1 1 32 GLN N N 3.350 2.067 2.206 1.00 . A A . 32 GLN N 1 1 8 4926 1 1 32 GLN NE2 N -0.277 -0.815 4.043 1.00 . A A . 32 GLN NE2 1 1 8 4927 1 1 32 GLN O O 2.904 4.632 4.661 1.00 . A A . 32 GLN O 1 1 8 4928 1 1 32 GLN OE1 O -1.104 0.886 5.253 1.00 . A A . 32 GLN OE1 1 1 8 4929 1 1 33 LYS C C 5.503 5.587 4.682 1.00 . A A . 33 LYS C 1 1 8 4930 1 1 33 LYS CA C 5.604 4.097 4.990 1.00 . A A . 33 LYS CA 1 1 8 4931 1 1 33 LYS CB C 7.037 3.613 4.758 1.00 . A A . 33 LYS CB 1 1 8 4932 1 1 33 LYS CD C 7.481 1.853 6.495 1.00 . A A . 33 LYS CD 1 1 8 4933 1 1 33 LYS CE C 7.671 0.367 6.759 1.00 . A A . 33 LYS CE 1 1 8 4934 1 1 33 LYS CG C 7.228 2.129 5.022 1.00 . A A . 33 LYS CG 1 1 8 4935 1 1 33 LYS H H 5.002 2.551 3.675 1.00 . A A . 33 LYS H 1 1 8 4936 1 1 33 LYS HA H 5.342 3.937 6.025 1.00 . A A . 33 LYS HA 1 1 8 4937 1 1 33 LYS HB2 H 7.310 3.813 3.733 1.00 . A A . 33 LYS HB2 1 1 8 4938 1 1 33 LYS HB3 H 7.700 4.162 5.412 1.00 . A A . 33 LYS HB3 1 1 8 4939 1 1 33 LYS HD2 H 8.373 2.379 6.803 1.00 . A A . 33 LYS HD2 1 1 8 4940 1 1 33 LYS HD3 H 6.636 2.207 7.069 1.00 . A A . 33 LYS HD3 1 1 8 4941 1 1 33 LYS HE2 H 7.046 -0.189 6.077 1.00 . A A . 33 LYS HE2 1 1 8 4942 1 1 33 LYS HE3 H 8.707 0.114 6.586 1.00 . A A . 33 LYS HE3 1 1 8 4943 1 1 33 LYS HG2 H 6.338 1.601 4.716 1.00 . A A . 33 LYS HG2 1 1 8 4944 1 1 33 LYS HG3 H 8.074 1.777 4.449 1.00 . A A . 33 LYS HG3 1 1 8 4945 1 1 33 LYS HZ1 H 8.154 0.023 8.762 1.00 . A A . 33 LYS HZ1 1 1 8 4946 1 1 33 LYS HZ2 H 6.902 -0.956 8.180 1.00 . A A . 33 LYS HZ2 1 1 8 4947 1 1 33 LYS HZ3 H 6.609 0.673 8.531 1.00 . A A . 33 LYS HZ3 1 1 8 4948 1 1 33 LYS N N 4.673 3.332 4.169 1.00 . A A . 33 LYS N 1 1 8 4949 1 1 33 LYS NZ N 7.309 0.001 8.156 1.00 . A A . 33 LYS NZ 1 1 8 4950 1 1 33 LYS O O 5.518 6.420 5.588 1.00 . A A . 33 LYS O 1 1 8 4951 1 1 34 ILE C C 4.041 7.961 3.542 1.00 . A A . 34 ILE C 1 1 8 4952 1 1 34 ILE CA C 5.294 7.306 2.972 1.00 . A A . 34 ILE CA 1 1 8 4953 1 1 34 ILE CB C 5.268 7.423 1.437 1.00 . A A . 34 ILE CB 1 1 8 4954 1 1 34 ILE CD1 C 3.734 7.223 -0.584 1.00 . A A . 34 ILE CD1 1 1 8 4955 1 1 34 ILE CG1 C 3.925 6.938 0.889 1.00 . A A . 34 ILE CG1 1 1 8 4956 1 1 34 ILE CG2 C 6.414 6.630 0.826 1.00 . A A . 34 ILE CG2 1 1 8 4957 1 1 34 ILE H H 5.394 5.207 2.722 1.00 . A A . 34 ILE H 1 1 8 4958 1 1 34 ILE HA H 6.162 7.833 3.339 1.00 . A A . 34 ILE HA 1 1 8 4959 1 1 34 ILE HB H 5.402 8.462 1.175 1.00 . A A . 34 ILE HB 1 1 8 4960 1 1 34 ILE HD11 H 4.218 6.451 -1.166 1.00 . A A . 34 ILE HD11 1 1 8 4961 1 1 34 ILE HD12 H 2.680 7.239 -0.815 1.00 . A A . 34 ILE HD12 1 1 8 4962 1 1 34 ILE HD13 H 4.171 8.181 -0.826 1.00 . A A . 34 ILE HD13 1 1 8 4963 1 1 34 ILE HG12 H 3.848 5.872 1.032 1.00 . A A . 34 ILE HG12 1 1 8 4964 1 1 34 ILE HG13 H 3.127 7.427 1.428 1.00 . A A . 34 ILE HG13 1 1 8 4965 1 1 34 ILE HG21 H 6.720 5.854 1.511 1.00 . A A . 34 ILE HG21 1 1 8 4966 1 1 34 ILE HG22 H 6.086 6.182 -0.101 1.00 . A A . 34 ILE HG22 1 1 8 4967 1 1 34 ILE HG23 H 7.246 7.290 0.633 1.00 . A A . 34 ILE HG23 1 1 8 4968 1 1 34 ILE N N 5.400 5.916 3.398 1.00 . A A . 34 ILE N 1 1 8 4969 1 1 34 ILE O O 3.977 9.183 3.687 1.00 . A A . 34 ILE O 1 1 8 4970 1 1 35 HIS C C 1.853 7.677 5.947 1.00 . A A . 35 HIS C 1 1 8 4971 1 1 35 HIS CA C 1.794 7.642 4.423 1.00 . A A . 35 HIS CA 1 1 8 4972 1 1 35 HIS CB C 0.623 6.771 3.966 1.00 . A A . 35 HIS CB 1 1 8 4973 1 1 35 HIS CD2 C 0.503 5.905 1.524 1.00 . A A . 35 HIS CD2 1 1 8 4974 1 1 35 HIS CE1 C -0.228 7.738 0.570 1.00 . A A . 35 HIS CE1 1 1 8 4975 1 1 35 HIS CG C 0.364 6.840 2.493 1.00 . A A . 35 HIS CG 1 1 8 4976 1 1 35 HIS H H 3.156 6.178 3.727 1.00 . A A . 35 HIS H 1 1 8 4977 1 1 35 HIS HA H 1.647 8.647 4.058 1.00 . A A . 35 HIS HA 1 1 8 4978 1 1 35 HIS HB2 H 0.830 5.741 4.218 1.00 . A A . 35 HIS HB2 1 1 8 4979 1 1 35 HIS HB3 H -0.274 7.088 4.477 1.00 . A A . 35 HIS HB3 1 1 8 4980 1 1 35 HIS HD1 H -0.294 8.832 2.297 1.00 . A A . 35 HIS HD1 1 1 8 4981 1 1 35 HIS HD2 H 0.845 4.888 1.658 1.00 . A A . 35 HIS HD2 1 1 8 4982 1 1 35 HIS HE1 H -0.569 8.445 -0.172 1.00 . A A . 35 HIS HE1 1 1 8 4983 1 1 35 HIS N N 3.045 7.142 3.866 1.00 . A A . 35 HIS N 1 1 8 4984 1 1 35 HIS ND1 N -0.094 7.978 1.862 1.00 . A A . 35 HIS ND1 1 1 8 4985 1 1 35 HIS NE2 N 0.129 6.488 0.338 1.00 . A A . 35 HIS NE2 1 1 8 4986 1 1 35 HIS O O 1.539 8.693 6.569 1.00 . A A . 35 HIS O 1 1 8 4987 1 1 36 THR C C 3.789 6.184 8.432 1.00 . A A . 36 THR C 1 1 8 4988 1 1 36 THR CA C 2.355 6.462 7.995 1.00 . A A . 36 THR CA 1 1 8 4989 1 1 36 THR CB C 1.439 5.353 8.547 1.00 . A A . 36 THR CB 1 1 8 4990 1 1 36 THR CG2 C 1.706 4.031 7.844 1.00 . A A . 36 THR CG2 1 1 8 4991 1 1 36 THR H H 2.493 5.784 5.995 1.00 . A A . 36 THR H 1 1 8 4992 1 1 36 THR HA H 2.037 7.405 8.416 1.00 . A A . 36 THR HA 1 1 8 4993 1 1 36 THR HB H 0.411 5.636 8.371 1.00 . A A . 36 THR HB 1 1 8 4994 1 1 36 THR HG1 H 0.802 5.068 10.392 1.00 . A A . 36 THR HG1 1 1 8 4995 1 1 36 THR HG21 H 2.398 4.189 7.031 1.00 . A A . 36 THR HG21 1 1 8 4996 1 1 36 THR HG22 H 0.779 3.637 7.455 1.00 . A A . 36 THR HG22 1 1 8 4997 1 1 36 THR HG23 H 2.129 3.329 8.546 1.00 . A A . 36 THR HG23 1 1 8 4998 1 1 36 THR N N 2.257 6.560 6.545 1.00 . A A . 36 THR N 1 1 8 4999 1 1 36 THR O O 4.466 5.328 7.864 1.00 . A A . 36 THR O 1 1 8 5000 1 1 36 THR OG1 O 1.647 5.201 9.955 1.00 . A A . 36 THR OG1 1 1 8 5001 1 1 37 GLY C C 6.067 7.894 10.791 1.00 . A A . 37 GLY C 1 1 8 5002 1 1 37 GLY CA C 5.598 6.730 9.940 1.00 . A A . 37 GLY CA 1 1 8 5003 1 1 37 GLY H H 3.662 7.582 9.859 1.00 . A A . 37 GLY H 1 1 8 5004 1 1 37 GLY HA2 H 5.634 5.827 10.532 1.00 . A A . 37 GLY HA2 1 1 8 5005 1 1 37 GLY HA3 H 6.267 6.623 9.098 1.00 . A A . 37 GLY HA3 1 1 8 5006 1 1 37 GLY N N 4.247 6.914 9.445 1.00 . A A . 37 GLY N 1 1 8 5007 1 1 37 GLY O O 5.324 8.850 11.008 1.00 . A A . 37 GLY O 1 1 8 5008 1 1 38 GLU C C 8.947 9.636 11.355 1.00 . A A . 38 GLU C 1 1 8 5009 1 1 38 GLU CA C 7.867 8.865 12.109 1.00 . A A . 38 GLU CA 1 1 8 5010 1 1 38 GLU CB C 8.451 8.272 13.393 1.00 . A A . 38 GLU CB 1 1 8 5011 1 1 38 GLU CD C 10.224 6.790 14.413 1.00 . A A . 38 GLU CD 1 1 8 5012 1 1 38 GLU CG C 9.495 7.196 13.147 1.00 . A A . 38 GLU CG 1 1 8 5013 1 1 38 GLU H H 7.846 7.023 11.066 1.00 . A A . 38 GLU H 1 1 8 5014 1 1 38 GLU HA H 7.071 9.546 12.368 1.00 . A A . 38 GLU HA 1 1 8 5015 1 1 38 GLU HB2 H 8.909 9.065 13.966 1.00 . A A . 38 GLU HB2 1 1 8 5016 1 1 38 GLU HB3 H 7.649 7.839 13.972 1.00 . A A . 38 GLU HB3 1 1 8 5017 1 1 38 GLU HG2 H 9.007 6.326 12.736 1.00 . A A . 38 GLU HG2 1 1 8 5018 1 1 38 GLU HG3 H 10.219 7.570 12.437 1.00 . A A . 38 GLU HG3 1 1 8 5019 1 1 38 GLU N N 7.303 7.811 11.275 1.00 . A A . 38 GLU N 1 1 8 5020 1 1 38 GLU O O 9.855 10.208 11.959 1.00 . A A . 38 GLU O 1 1 8 5021 1 1 38 GLU OE1 O 10.152 7.542 15.407 1.00 . A A . 38 GLU OE1 1 1 8 5022 1 1 38 GLU OE2 O 10.866 5.718 14.409 1.00 . A A . 38 GLU OE2 1 1 8 5023 1 1 39 LYS C C 9.126 10.960 7.973 1.00 . A A . 39 LYS C 1 1 8 5024 1 1 39 LYS CA C 9.808 10.346 9.192 1.00 . A A . 39 LYS CA 1 1 8 5025 1 1 39 LYS CB C 10.913 9.388 8.742 1.00 . A A . 39 LYS CB 1 1 8 5026 1 1 39 LYS CD C 13.150 8.445 9.390 1.00 . A A . 39 LYS CD 1 1 8 5027 1 1 39 LYS CE C 13.143 6.993 8.935 1.00 . A A . 39 LYS CE 1 1 8 5028 1 1 39 LYS CG C 11.779 8.880 9.882 1.00 . A A . 39 LYS CG 1 1 8 5029 1 1 39 LYS H H 8.097 9.171 9.606 1.00 . A A . 39 LYS H 1 1 8 5030 1 1 39 LYS HA H 10.247 11.137 9.780 1.00 . A A . 39 LYS HA 1 1 8 5031 1 1 39 LYS HB2 H 10.459 8.537 8.255 1.00 . A A . 39 LYS HB2 1 1 8 5032 1 1 39 LYS HB3 H 11.550 9.899 8.034 1.00 . A A . 39 LYS HB3 1 1 8 5033 1 1 39 LYS HD2 H 13.439 9.069 8.558 1.00 . A A . 39 LYS HD2 1 1 8 5034 1 1 39 LYS HD3 H 13.864 8.558 10.193 1.00 . A A . 39 LYS HD3 1 1 8 5035 1 1 39 LYS HE2 H 12.274 6.827 8.318 1.00 . A A . 39 LYS HE2 1 1 8 5036 1 1 39 LYS HE3 H 14.036 6.808 8.356 1.00 . A A . 39 LYS HE3 1 1 8 5037 1 1 39 LYS HG2 H 11.904 9.670 10.607 1.00 . A A . 39 LYS HG2 1 1 8 5038 1 1 39 LYS HG3 H 11.289 8.036 10.346 1.00 . A A . 39 LYS HG3 1 1 8 5039 1 1 39 LYS HZ1 H 14.074 5.858 10.421 1.00 . A A . 39 LYS HZ1 1 1 8 5040 1 1 39 LYS HZ2 H 12.666 5.154 9.801 1.00 . A A . 39 LYS HZ2 1 1 8 5041 1 1 39 LYS HZ3 H 12.558 6.462 10.868 1.00 . A A . 39 LYS HZ3 1 1 8 5042 1 1 39 LYS N N 8.843 9.646 10.031 1.00 . A A . 39 LYS N 1 1 8 5043 1 1 39 LYS NZ N 13.108 6.051 10.087 1.00 . A A . 39 LYS NZ 1 1 8 5044 1 1 39 LYS O O 8.194 10.394 7.403 1.00 . A A . 39 LYS O 1 1 8 5045 1 1 40 PRO C C 9.374 12.164 5.089 1.00 . A A . 40 PRO C 1 1 8 5046 1 1 40 PRO CA C 9.053 12.861 6.407 1.00 . A A . 40 PRO CA 1 1 8 5047 1 1 40 PRO CB C 9.744 14.225 6.473 1.00 . A A . 40 PRO CB 1 1 8 5048 1 1 40 PRO CD C 10.711 12.878 8.195 1.00 . A A . 40 PRO CD 1 1 8 5049 1 1 40 PRO CG C 11.015 13.970 7.207 1.00 . A A . 40 PRO CG 1 1 8 5050 1 1 40 PRO HA H 7.984 12.992 6.492 1.00 . A A . 40 PRO HA 1 1 8 5051 1 1 40 PRO HB2 H 9.931 14.586 5.472 1.00 . A A . 40 PRO HB2 1 1 8 5052 1 1 40 PRO HB3 H 9.116 14.925 7.003 1.00 . A A . 40 PRO HB3 1 1 8 5053 1 1 40 PRO HD2 H 11.571 12.238 8.326 1.00 . A A . 40 PRO HD2 1 1 8 5054 1 1 40 PRO HD3 H 10.405 13.299 9.141 1.00 . A A . 40 PRO HD3 1 1 8 5055 1 1 40 PRO HG2 H 11.780 13.649 6.517 1.00 . A A . 40 PRO HG2 1 1 8 5056 1 1 40 PRO HG3 H 11.326 14.866 7.724 1.00 . A A . 40 PRO HG3 1 1 8 5057 1 1 40 PRO N N 9.602 12.145 7.563 1.00 . A A . 40 PRO N 1 1 8 5058 1 1 40 PRO O O 8.491 11.944 4.261 1.00 . A A . 40 PRO O 1 1 8 5059 1 1 41 SER C C 10.288 11.645 2.475 1.00 . A A . 41 SER C 1 1 8 5060 1 1 41 SER CA C 11.083 11.152 3.681 1.00 . A A . 41 SER CA 1 1 8 5061 1 1 41 SER CB C 10.930 9.637 3.822 1.00 . A A . 41 SER CB 1 1 8 5062 1 1 41 SER H H 11.303 12.024 5.598 1.00 . A A . 41 SER H 1 1 8 5063 1 1 41 SER HA H 12.126 11.388 3.530 1.00 . A A . 41 SER HA 1 1 8 5064 1 1 41 SER HB2 H 11.389 9.151 2.974 1.00 . A A . 41 SER HB2 1 1 8 5065 1 1 41 SER HB3 H 11.417 9.312 4.730 1.00 . A A . 41 SER HB3 1 1 8 5066 1 1 41 SER HG H 9.062 9.954 4.319 1.00 . A A . 41 SER HG 1 1 8 5067 1 1 41 SER N N 10.645 11.821 4.900 1.00 . A A . 41 SER N 1 1 8 5068 1 1 41 SER O O 9.865 10.856 1.632 1.00 . A A . 41 SER O 1 1 8 5069 1 1 41 SER OG O 9.564 9.264 3.878 1.00 . A A . 41 SER OG 1 1 8 5070 1 1 42 GLY C C 10.234 14.294 0.333 1.00 . A A . 42 GLY C 1 1 8 5071 1 1 42 GLY CA C 9.344 13.534 1.298 1.00 . A A . 42 GLY CA 1 1 8 5072 1 1 42 GLY H H 10.449 13.539 3.104 1.00 . A A . 42 GLY H 1 1 8 5073 1 1 42 GLY HA2 H 8.844 12.741 0.762 1.00 . A A . 42 GLY HA2 1 1 8 5074 1 1 42 GLY HA3 H 8.602 14.212 1.693 1.00 . A A . 42 GLY HA3 1 1 8 5075 1 1 42 GLY N N 10.088 12.958 2.402 1.00 . A A . 42 GLY N 1 1 8 5076 1 1 42 GLY O O 10.370 15.515 0.412 1.00 . A A . 42 GLY O 1 1 8 5077 1 1 43 PRO C C 10.999 14.998 -2.625 1.00 . A A . 43 PRO C 1 1 8 5078 1 1 43 PRO CA C 11.752 14.155 -1.602 1.00 . A A . 43 PRO CA 1 1 8 5079 1 1 43 PRO CB C 12.387 12.936 -2.276 1.00 . A A . 43 PRO CB 1 1 8 5080 1 1 43 PRO CD C 10.743 12.103 -0.754 1.00 . A A . 43 PRO CD 1 1 8 5081 1 1 43 PRO CG C 11.399 11.838 -2.080 1.00 . A A . 43 PRO CG 1 1 8 5082 1 1 43 PRO HA H 12.523 14.755 -1.141 1.00 . A A . 43 PRO HA 1 1 8 5083 1 1 43 PRO HB2 H 12.545 13.143 -3.325 1.00 . A A . 43 PRO HB2 1 1 8 5084 1 1 43 PRO HB3 H 13.329 12.708 -1.803 1.00 . A A . 43 PRO HB3 1 1 8 5085 1 1 43 PRO HD2 H 9.707 11.799 -0.778 1.00 . A A . 43 PRO HD2 1 1 8 5086 1 1 43 PRO HD3 H 11.270 11.590 0.037 1.00 . A A . 43 PRO HD3 1 1 8 5087 1 1 43 PRO HG2 H 10.666 11.858 -2.872 1.00 . A A . 43 PRO HG2 1 1 8 5088 1 1 43 PRO HG3 H 11.908 10.885 -2.062 1.00 . A A . 43 PRO HG3 1 1 8 5089 1 1 43 PRO N N 10.859 13.563 -0.601 1.00 . A A . 43 PRO N 1 1 8 5090 1 1 43 PRO O O 9.801 15.243 -2.481 1.00 . A A . 43 PRO O 1 1 8 5091 1 1 44 SER C C 10.194 15.418 -5.594 1.00 . A A . 44 SER C 1 1 8 5092 1 1 44 SER CA C 11.106 16.257 -4.705 1.00 . A A . 44 SER CA 1 1 8 5093 1 1 44 SER CB C 12.194 16.920 -5.553 1.00 . A A . 44 SER CB 1 1 8 5094 1 1 44 SER H H 12.659 15.210 -3.719 1.00 . A A . 44 SER H 1 1 8 5095 1 1 44 SER HA H 10.517 17.025 -4.227 1.00 . A A . 44 SER HA 1 1 8 5096 1 1 44 SER HB2 H 13.069 17.088 -4.944 1.00 . A A . 44 SER HB2 1 1 8 5097 1 1 44 SER HB3 H 12.450 16.270 -6.378 1.00 . A A . 44 SER HB3 1 1 8 5098 1 1 44 SER HG H 11.372 18.688 -5.362 1.00 . A A . 44 SER HG 1 1 8 5099 1 1 44 SER N N 11.708 15.439 -3.659 1.00 . A A . 44 SER N 1 1 8 5100 1 1 44 SER O O 10.455 14.239 -5.834 1.00 . A A . 44 SER O 1 1 8 5101 1 1 44 SER OG O 11.751 18.162 -6.071 1.00 . A A . 44 SER OG 1 1 8 5102 1 1 45 SER C C 8.880 14.372 -7.873 1.00 . A A . 45 SER C 1 1 8 5103 1 1 45 SER CA C 8.166 15.345 -6.940 1.00 . A A . 45 SER CA 1 1 8 5104 1 1 45 SER CB C 7.362 16.356 -7.759 1.00 . A A . 45 SER CB 1 1 8 5105 1 1 45 SER H H 8.967 16.976 -5.853 1.00 . A A . 45 SER H 1 1 8 5106 1 1 45 SER HA H 7.492 14.789 -6.307 1.00 . A A . 45 SER HA 1 1 8 5107 1 1 45 SER HB2 H 7.050 17.167 -7.118 1.00 . A A . 45 SER HB2 1 1 8 5108 1 1 45 SER HB3 H 7.980 16.744 -8.555 1.00 . A A . 45 SER HB3 1 1 8 5109 1 1 45 SER HG H 6.361 14.811 -8.429 1.00 . A A . 45 SER HG 1 1 8 5110 1 1 45 SER N N 9.121 16.035 -6.080 1.00 . A A . 45 SER N 1 1 8 5111 1 1 45 SER O O 9.994 14.631 -8.325 1.00 . A A . 45 SER O 1 1 8 5112 1 1 45 SER OG O 6.211 15.754 -8.325 1.00 . A A . 45 SER OG 1 1 8 5113 1 1 46 GLY C C 9.115 12.799 -10.415 1.00 . A A . 46 GLY C 1 1 8 5114 1 1 46 GLY CA C 8.815 12.251 -9.034 1.00 . A A . 46 GLY CA 1 1 8 5115 1 1 46 GLY H H 7.342 13.094 -7.768 1.00 . A A . 46 GLY H 1 1 8 5116 1 1 46 GLY HA2 H 9.733 11.895 -8.592 1.00 . A A . 46 GLY HA2 1 1 8 5117 1 1 46 GLY HA3 H 8.127 11.424 -9.130 1.00 . A A . 46 GLY HA3 1 1 8 5118 1 1 46 GLY N N 8.228 13.248 -8.157 1.00 . A A . 46 GLY N 1 1 8 5119 1 1 46 GLY O O 10.076 12.354 -11.040 1.00 . A A . 46 GLY O 1 1 8 5120 2 2 1 ZN ZN ZN -0.151 4.860 -0.852 1.00 . B A . 201 ZN ZN 1 1 9 5121 1 1 1 GLY C C -9.557 4.622 -25.900 1.00 . A A . 1 GLY C 1 1 9 5122 1 1 1 GLY CA C -9.903 5.288 -27.217 1.00 . A A . 1 GLY CA 1 1 9 5123 1 1 1 GLY H1 H -11.597 4.026 -27.363 1.00 . A A . 1 GLY H1 1 1 9 5124 1 1 1 GLY HA2 H -9.068 5.185 -27.892 1.00 . A A . 1 GLY HA2 1 1 9 5125 1 1 1 GLY HA3 H -10.081 6.339 -27.039 1.00 . A A . 1 GLY HA3 1 1 9 5126 1 1 1 GLY N N -11.082 4.713 -27.837 1.00 . A A . 1 GLY N 1 1 9 5127 1 1 1 GLY O O -10.438 4.340 -25.089 1.00 . A A . 1 GLY O 1 1 9 5128 1 1 2 SER C C -6.435 4.251 -24.057 1.00 . A A . 2 SER C 1 1 9 5129 1 1 2 SER CA C -7.808 3.725 -24.464 1.00 . A A . 2 SER CA 1 1 9 5130 1 1 2 SER CB C -7.751 2.207 -24.649 1.00 . A A . 2 SER CB 1 1 9 5131 1 1 2 SER H H -7.614 4.617 -26.374 1.00 . A A . 2 SER H 1 1 9 5132 1 1 2 SER HA H -8.515 3.957 -23.681 1.00 . A A . 2 SER HA 1 1 9 5133 1 1 2 SER HB2 H -7.511 1.982 -25.677 1.00 . A A . 2 SER HB2 1 1 9 5134 1 1 2 SER HB3 H -6.989 1.797 -24.003 1.00 . A A . 2 SER HB3 1 1 9 5135 1 1 2 SER HG H -8.854 0.687 -24.092 1.00 . A A . 2 SER HG 1 1 9 5136 1 1 2 SER N N -8.269 4.368 -25.689 1.00 . A A . 2 SER N 1 1 9 5137 1 1 2 SER O O -5.527 4.349 -24.883 1.00 . A A . 2 SER O 1 1 9 5138 1 1 2 SER OG O -8.994 1.607 -24.329 1.00 . A A . 2 SER OG 1 1 9 5139 1 1 3 SER C C -4.642 4.401 -20.968 1.00 . A A . 3 SER C 1 1 9 5140 1 1 3 SER CA C -5.031 5.107 -22.263 1.00 . A A . 3 SER CA 1 1 9 5141 1 1 3 SER CB C -5.136 6.615 -22.024 1.00 . A A . 3 SER CB 1 1 9 5142 1 1 3 SER H H -7.053 4.486 -22.170 1.00 . A A . 3 SER H 1 1 9 5143 1 1 3 SER HA H -4.267 4.922 -23.004 1.00 . A A . 3 SER HA 1 1 9 5144 1 1 3 SER HB2 H -5.606 7.080 -22.877 1.00 . A A . 3 SER HB2 1 1 9 5145 1 1 3 SER HB3 H -5.733 6.795 -21.141 1.00 . A A . 3 SER HB3 1 1 9 5146 1 1 3 SER HG H -3.750 7.445 -20.916 1.00 . A A . 3 SER HG 1 1 9 5147 1 1 3 SER N N -6.291 4.587 -22.780 1.00 . A A . 3 SER N 1 1 9 5148 1 1 3 SER O O -5.260 4.609 -19.925 1.00 . A A . 3 SER O 1 1 9 5149 1 1 3 SER OG O -3.856 7.192 -21.836 1.00 . A A . 3 SER OG 1 1 9 5150 1 1 4 GLY C C -2.628 1.460 -20.212 1.00 . A A . 4 GLY C 1 1 9 5151 1 1 4 GLY CA C -3.157 2.839 -19.872 1.00 . A A . 4 GLY CA 1 1 9 5152 1 1 4 GLY H H -3.157 3.437 -21.903 1.00 . A A . 4 GLY H 1 1 9 5153 1 1 4 GLY HA2 H -2.373 3.406 -19.393 1.00 . A A . 4 GLY HA2 1 1 9 5154 1 1 4 GLY HA3 H -3.984 2.735 -19.184 1.00 . A A . 4 GLY HA3 1 1 9 5155 1 1 4 GLY N N -3.612 3.564 -21.044 1.00 . A A . 4 GLY N 1 1 9 5156 1 1 4 GLY O O -3.372 0.479 -20.188 1.00 . A A . 4 GLY O 1 1 9 5157 1 1 5 SER C C -0.273 -0.640 -19.633 1.00 . A A . 5 SER C 1 1 9 5158 1 1 5 SER CA C -0.714 0.115 -20.884 1.00 . A A . 5 SER CA 1 1 9 5159 1 1 5 SER CB C 0.488 0.352 -21.800 1.00 . A A . 5 SER CB 1 1 9 5160 1 1 5 SER H H -0.799 2.201 -20.532 1.00 . A A . 5 SER H 1 1 9 5161 1 1 5 SER HA H -1.444 -0.481 -21.411 1.00 . A A . 5 SER HA 1 1 9 5162 1 1 5 SER HB2 H 0.260 1.150 -22.490 1.00 . A A . 5 SER HB2 1 1 9 5163 1 1 5 SER HB3 H 1.344 0.629 -21.201 1.00 . A A . 5 SER HB3 1 1 9 5164 1 1 5 SER HG H 1.731 -0.793 -22.790 1.00 . A A . 5 SER HG 1 1 9 5165 1 1 5 SER N N -1.340 1.383 -20.531 1.00 . A A . 5 SER N 1 1 9 5166 1 1 5 SER O O -0.543 -1.832 -19.486 1.00 . A A . 5 SER O 1 1 9 5167 1 1 5 SER OG O 0.805 -0.814 -22.539 1.00 . A A . 5 SER OG 1 1 9 5168 1 1 6 SER C C -0.195 -0.515 -16.423 1.00 . A A . 6 SER C 1 1 9 5169 1 1 6 SER CA C 0.889 -0.538 -17.496 1.00 . A A . 6 SER CA 1 1 9 5170 1 1 6 SER CB C 2.133 0.198 -16.997 1.00 . A A . 6 SER CB 1 1 9 5171 1 1 6 SER H H 0.590 1.012 -18.908 1.00 . A A . 6 SER H 1 1 9 5172 1 1 6 SER HA H 1.149 -1.565 -17.707 1.00 . A A . 6 SER HA 1 1 9 5173 1 1 6 SER HB2 H 2.555 -0.339 -16.161 1.00 . A A . 6 SER HB2 1 1 9 5174 1 1 6 SER HB3 H 2.860 0.253 -17.794 1.00 . A A . 6 SER HB3 1 1 9 5175 1 1 6 SER HG H 1.026 1.814 -17.039 1.00 . A A . 6 SER HG 1 1 9 5176 1 1 6 SER N N 0.407 0.065 -18.734 1.00 . A A . 6 SER N 1 1 9 5177 1 1 6 SER O O -0.593 0.548 -15.949 1.00 . A A . 6 SER O 1 1 9 5178 1 1 6 SER OG O 1.813 1.514 -16.579 1.00 . A A . 6 SER OG 1 1 9 5179 1 1 7 GLY C C -2.816 -2.744 -15.423 1.00 . A A . 7 GLY C 1 1 9 5180 1 1 7 GLY CA C -1.703 -1.793 -15.030 1.00 . A A . 7 GLY CA 1 1 9 5181 1 1 7 GLY H H -0.314 -2.514 -16.457 1.00 . A A . 7 GLY H 1 1 9 5182 1 1 7 GLY HA2 H -1.257 -2.139 -14.109 1.00 . A A . 7 GLY HA2 1 1 9 5183 1 1 7 GLY HA3 H -2.123 -0.812 -14.868 1.00 . A A . 7 GLY HA3 1 1 9 5184 1 1 7 GLY N N -0.669 -1.699 -16.044 1.00 . A A . 7 GLY N 1 1 9 5185 1 1 7 GLY O O -3.996 -2.412 -15.308 1.00 . A A . 7 GLY O 1 1 9 5186 1 1 8 THR C C -3.365 -6.157 -15.403 1.00 . A A . 8 THR C 1 1 9 5187 1 1 8 THR CA C -3.417 -4.931 -16.307 1.00 . A A . 8 THR CA 1 1 9 5188 1 1 8 THR CB C -3.184 -5.371 -17.765 1.00 . A A . 8 THR CB 1 1 9 5189 1 1 8 THR CG2 C -3.371 -4.202 -18.720 1.00 . A A . 8 THR CG2 1 1 9 5190 1 1 8 THR H H -1.486 -4.136 -15.960 1.00 . A A . 8 THR H 1 1 9 5191 1 1 8 THR HA H -4.399 -4.487 -16.239 1.00 . A A . 8 THR HA 1 1 9 5192 1 1 8 THR HB H -3.904 -6.138 -18.012 1.00 . A A . 8 THR HB 1 1 9 5193 1 1 8 THR HG1 H -1.288 -5.522 -17.245 1.00 . A A . 8 THR HG1 1 1 9 5194 1 1 8 THR HG21 H -4.344 -3.762 -18.563 1.00 . A A . 8 THR HG21 1 1 9 5195 1 1 8 THR HG22 H -3.294 -4.553 -19.738 1.00 . A A . 8 THR HG22 1 1 9 5196 1 1 8 THR HG23 H -2.607 -3.461 -18.535 1.00 . A A . 8 THR HG23 1 1 9 5197 1 1 8 THR N N -2.441 -3.930 -15.892 1.00 . A A . 8 THR N 1 1 9 5198 1 1 8 THR O O -3.433 -7.291 -15.875 1.00 . A A . 8 THR O 1 1 9 5199 1 1 8 THR OG1 O -1.864 -5.906 -17.910 1.00 . A A . 8 THR OG1 1 1 9 5200 1 1 9 GLY C C -3.852 -6.678 -11.832 1.00 . A A . 9 GLY C 1 1 9 5201 1 1 9 GLY CA C -3.186 -7.017 -13.150 1.00 . A A . 9 GLY CA 1 1 9 5202 1 1 9 GLY H H -3.194 -4.996 -13.781 1.00 . A A . 9 GLY H 1 1 9 5203 1 1 9 GLY HA2 H -3.678 -7.878 -13.579 1.00 . A A . 9 GLY HA2 1 1 9 5204 1 1 9 GLY HA3 H -2.150 -7.263 -12.965 1.00 . A A . 9 GLY HA3 1 1 9 5205 1 1 9 GLY N N -3.244 -5.922 -14.100 1.00 . A A . 9 GLY N 1 1 9 5206 1 1 9 GLY O O -3.573 -5.637 -11.239 1.00 . A A . 9 GLY O 1 1 9 5207 1 1 10 GLU C C -4.633 -7.871 -8.937 1.00 . A A . 10 GLU C 1 1 9 5208 1 1 10 GLU CA C -5.445 -7.344 -10.117 1.00 . A A . 10 GLU CA 1 1 9 5209 1 1 10 GLU CB C -6.813 -8.029 -10.155 1.00 . A A . 10 GLU CB 1 1 9 5210 1 1 10 GLU CD C -9.250 -7.750 -9.550 1.00 . A A . 10 GLU CD 1 1 9 5211 1 1 10 GLU CG C -7.813 -7.444 -9.172 1.00 . A A . 10 GLU CG 1 1 9 5212 1 1 10 GLU H H -4.916 -8.370 -11.891 1.00 . A A . 10 GLU H 1 1 9 5213 1 1 10 GLU HA H -5.588 -6.281 -9.994 1.00 . A A . 10 GLU HA 1 1 9 5214 1 1 10 GLU HB2 H -7.221 -7.936 -11.150 1.00 . A A . 10 GLU HB2 1 1 9 5215 1 1 10 GLU HB3 H -6.684 -9.076 -9.925 1.00 . A A . 10 GLU HB3 1 1 9 5216 1 1 10 GLU HG2 H -7.620 -7.857 -8.193 1.00 . A A . 10 GLU HG2 1 1 9 5217 1 1 10 GLU HG3 H -7.685 -6.372 -9.141 1.00 . A A . 10 GLU HG3 1 1 9 5218 1 1 10 GLU N N -4.736 -7.558 -11.373 1.00 . A A . 10 GLU N 1 1 9 5219 1 1 10 GLU O O -4.742 -9.040 -8.566 1.00 . A A . 10 GLU O 1 1 9 5220 1 1 10 GLU OE1 O -9.841 -6.962 -10.318 1.00 . A A . 10 GLU OE1 1 1 9 5221 1 1 10 GLU OE2 O -9.783 -8.776 -9.079 1.00 . A A . 10 GLU OE2 1 1 9 5222 1 1 11 LYS C C -3.845 -7.657 -5.984 1.00 . A A . 11 LYS C 1 1 9 5223 1 1 11 LYS CA C -2.988 -7.374 -7.213 1.00 . A A . 11 LYS CA 1 1 9 5224 1 1 11 LYS CB C -1.982 -6.263 -6.902 1.00 . A A . 11 LYS CB 1 1 9 5225 1 1 11 LYS CD C -0.882 -5.697 -9.088 1.00 . A A . 11 LYS CD 1 1 9 5226 1 1 11 LYS CE C 0.096 -6.265 -10.105 1.00 . A A . 11 LYS CE 1 1 9 5227 1 1 11 LYS CG C -0.709 -6.347 -7.726 1.00 . A A . 11 LYS CG 1 1 9 5228 1 1 11 LYS H H -3.776 -6.081 -8.693 1.00 . A A . 11 LYS H 1 1 9 5229 1 1 11 LYS HA H -2.449 -8.272 -7.476 1.00 . A A . 11 LYS HA 1 1 9 5230 1 1 11 LYS HB2 H -2.448 -5.308 -7.095 1.00 . A A . 11 LYS HB2 1 1 9 5231 1 1 11 LYS HB3 H -1.714 -6.319 -5.857 1.00 . A A . 11 LYS HB3 1 1 9 5232 1 1 11 LYS HD2 H -1.889 -5.874 -9.436 1.00 . A A . 11 LYS HD2 1 1 9 5233 1 1 11 LYS HD3 H -0.713 -4.634 -8.994 1.00 . A A . 11 LYS HD3 1 1 9 5234 1 1 11 LYS HE2 H 0.295 -7.297 -9.857 1.00 . A A . 11 LYS HE2 1 1 9 5235 1 1 11 LYS HE3 H -0.353 -6.211 -11.086 1.00 . A A . 11 LYS HE3 1 1 9 5236 1 1 11 LYS HG2 H 0.086 -5.842 -7.196 1.00 . A A . 11 LYS HG2 1 1 9 5237 1 1 11 LYS HG3 H -0.448 -7.387 -7.863 1.00 . A A . 11 LYS HG3 1 1 9 5238 1 1 11 LYS HZ1 H 2.151 -6.127 -10.454 1.00 . A A . 11 LYS HZ1 1 1 9 5239 1 1 11 LYS HZ2 H 1.611 -5.181 -9.160 1.00 . A A . 11 LYS HZ2 1 1 9 5240 1 1 11 LYS HZ3 H 1.308 -4.691 -10.750 1.00 . A A . 11 LYS HZ3 1 1 9 5241 1 1 11 LYS N N -3.819 -7.000 -8.351 1.00 . A A . 11 LYS N 1 1 9 5242 1 1 11 LYS NZ N 1.382 -5.514 -10.118 1.00 . A A . 11 LYS NZ 1 1 9 5243 1 1 11 LYS O O -4.872 -7.019 -5.753 1.00 . A A . 11 LYS O 1 1 9 5244 1 1 12 PRO C C -4.043 -7.957 -2.868 1.00 . A A . 12 PRO C 1 1 9 5245 1 1 12 PRO CA C -4.128 -9.025 -3.953 1.00 . A A . 12 PRO CA 1 1 9 5246 1 1 12 PRO CB C -3.402 -10.297 -3.509 1.00 . A A . 12 PRO CB 1 1 9 5247 1 1 12 PRO CD C -2.199 -9.439 -5.388 1.00 . A A . 12 PRO CD 1 1 9 5248 1 1 12 PRO CG C -2.035 -10.176 -4.087 1.00 . A A . 12 PRO CG 1 1 9 5249 1 1 12 PRO HA H -5.164 -9.251 -4.154 1.00 . A A . 12 PRO HA 1 1 9 5250 1 1 12 PRO HB2 H -3.373 -10.340 -2.429 1.00 . A A . 12 PRO HB2 1 1 9 5251 1 1 12 PRO HB3 H -3.918 -11.164 -3.895 1.00 . A A . 12 PRO HB3 1 1 9 5252 1 1 12 PRO HD2 H -1.345 -8.805 -5.573 1.00 . A A . 12 PRO HD2 1 1 9 5253 1 1 12 PRO HD3 H -2.337 -10.137 -6.201 1.00 . A A . 12 PRO HD3 1 1 9 5254 1 1 12 PRO HG2 H -1.401 -9.615 -3.417 1.00 . A A . 12 PRO HG2 1 1 9 5255 1 1 12 PRO HG3 H -1.622 -11.158 -4.262 1.00 . A A . 12 PRO HG3 1 1 9 5256 1 1 12 PRO N N -3.415 -8.636 -5.174 1.00 . A A . 12 PRO N 1 1 9 5257 1 1 12 PRO O O -4.925 -7.853 -2.016 1.00 . A A . 12 PRO O 1 1 9 5258 1 1 13 TYR C C -3.117 -4.741 -2.518 1.00 . A A . 13 TYR C 1 1 9 5259 1 1 13 TYR CA C -2.777 -6.105 -1.924 1.00 . A A . 13 TYR CA 1 1 9 5260 1 1 13 TYR CB C -1.332 -6.111 -1.425 1.00 . A A . 13 TYR CB 1 1 9 5261 1 1 13 TYR CD1 C -1.155 -7.725 0.508 1.00 . A A . 13 TYR CD1 1 1 9 5262 1 1 13 TYR CD2 C -0.244 -8.384 -1.594 1.00 . A A . 13 TYR CD2 1 1 9 5263 1 1 13 TYR CE1 C -0.765 -8.930 1.060 1.00 . A A . 13 TYR CE1 1 1 9 5264 1 1 13 TYR CE2 C 0.148 -9.592 -1.050 1.00 . A A . 13 TYR CE2 1 1 9 5265 1 1 13 TYR CG C -0.903 -7.431 -0.826 1.00 . A A . 13 TYR CG 1 1 9 5266 1 1 13 TYR CZ C -0.114 -9.860 0.277 1.00 . A A . 13 TYR CZ 1 1 9 5267 1 1 13 TYR H H -2.309 -7.296 -3.610 1.00 . A A . 13 TYR H 1 1 9 5268 1 1 13 TYR HA H -3.436 -6.297 -1.090 1.00 . A A . 13 TYR HA 1 1 9 5269 1 1 13 TYR HB2 H -0.672 -5.892 -2.251 1.00 . A A . 13 TYR HB2 1 1 9 5270 1 1 13 TYR HB3 H -1.217 -5.349 -0.667 1.00 . A A . 13 TYR HB3 1 1 9 5271 1 1 13 TYR HD1 H -1.665 -6.995 1.120 1.00 . A A . 13 TYR HD1 1 1 9 5272 1 1 13 TYR HD2 H -0.040 -8.170 -2.633 1.00 . A A . 13 TYR HD2 1 1 9 5273 1 1 13 TYR HE1 H -0.970 -9.141 2.100 1.00 . A A . 13 TYR HE1 1 1 9 5274 1 1 13 TYR HE2 H 0.659 -10.320 -1.664 1.00 . A A . 13 TYR HE2 1 1 9 5275 1 1 13 TYR HH H 1.106 -11.338 0.425 1.00 . A A . 13 TYR HH 1 1 9 5276 1 1 13 TYR N N -2.977 -7.165 -2.906 1.00 . A A . 13 TYR N 1 1 9 5277 1 1 13 TYR O O -2.979 -4.524 -3.721 1.00 . A A . 13 TYR O 1 1 9 5278 1 1 13 TYR OH O 0.277 -11.061 0.822 1.00 . A A . 13 TYR OH 1 1 9 5279 1 1 14 ARG C C -3.718 -1.472 -0.977 1.00 . A A . 14 ARG C 1 1 9 5280 1 1 14 ARG CA C -3.923 -2.483 -2.101 1.00 . A A . 14 ARG CA 1 1 9 5281 1 1 14 ARG CB C -5.378 -2.451 -2.572 1.00 . A A . 14 ARG CB 1 1 9 5282 1 1 14 ARG CD C -7.111 -0.869 -3.473 1.00 . A A . 14 ARG CD 1 1 9 5283 1 1 14 ARG CG C -5.670 -1.345 -3.573 1.00 . A A . 14 ARG CG 1 1 9 5284 1 1 14 ARG CZ C -8.683 0.533 -4.740 1.00 . A A . 14 ARG CZ 1 1 9 5285 1 1 14 ARG H H -3.651 -4.060 -0.715 1.00 . A A . 14 ARG H 1 1 9 5286 1 1 14 ARG HA H -3.281 -2.220 -2.928 1.00 . A A . 14 ARG HA 1 1 9 5287 1 1 14 ARG HB2 H -5.616 -3.397 -3.035 1.00 . A A . 14 ARG HB2 1 1 9 5288 1 1 14 ARG HB3 H -6.018 -2.308 -1.714 1.00 . A A . 14 ARG HB3 1 1 9 5289 1 1 14 ARG HD2 H -7.763 -1.729 -3.513 1.00 . A A . 14 ARG HD2 1 1 9 5290 1 1 14 ARG HD3 H -7.243 -0.361 -2.530 1.00 . A A . 14 ARG HD3 1 1 9 5291 1 1 14 ARG HE H -6.752 0.303 -5.180 1.00 . A A . 14 ARG HE 1 1 9 5292 1 1 14 ARG HG2 H -5.013 -0.511 -3.376 1.00 . A A . 14 ARG HG2 1 1 9 5293 1 1 14 ARG HG3 H -5.491 -1.719 -4.570 1.00 . A A . 14 ARG HG3 1 1 9 5294 1 1 14 ARG HH11 H -9.486 -0.422 -3.150 1.00 . A A . 14 ARG HH11 1 1 9 5295 1 1 14 ARG HH12 H -10.584 0.570 -4.052 1.00 . A A . 14 ARG HH12 1 1 9 5296 1 1 14 ARG HH21 H -8.187 1.612 -6.375 1.00 . A A . 14 ARG HH21 1 1 9 5297 1 1 14 ARG HH22 H -9.844 1.726 -5.887 1.00 . A A . 14 ARG HH22 1 1 9 5298 1 1 14 ARG N N -3.562 -3.826 -1.663 1.00 . A A . 14 ARG N 1 1 9 5299 1 1 14 ARG NE N -7.462 0.043 -4.558 1.00 . A A . 14 ARG NE 1 1 9 5300 1 1 14 ARG NH1 N -9.665 0.199 -3.913 1.00 . A A . 14 ARG NH1 1 1 9 5301 1 1 14 ARG NH2 N -8.925 1.358 -5.750 1.00 . A A . 14 ARG NH2 1 1 9 5302 1 1 14 ARG O O -4.028 -1.745 0.183 1.00 . A A . 14 ARG O 1 1 9 5303 1 1 15 CYS C C -4.242 1.467 0.016 1.00 . A A . 15 CYS C 1 1 9 5304 1 1 15 CYS CA C -2.946 0.750 -0.351 1.00 . A A . 15 CYS CA 1 1 9 5305 1 1 15 CYS CB C -1.932 1.756 -0.899 1.00 . A A . 15 CYS CB 1 1 9 5306 1 1 15 CYS H H -2.967 -0.143 -2.270 1.00 . A A . 15 CYS H 1 1 9 5307 1 1 15 CYS HA H -2.540 0.290 0.537 1.00 . A A . 15 CYS HA 1 1 9 5308 1 1 15 CYS HB2 H -1.123 1.218 -1.372 1.00 . A A . 15 CYS HB2 1 1 9 5309 1 1 15 CYS HB3 H -2.418 2.382 -1.633 1.00 . A A . 15 CYS HB3 1 1 9 5310 1 1 15 CYS N N -3.194 -0.302 -1.329 1.00 . A A . 15 CYS N 1 1 9 5311 1 1 15 CYS O O -4.896 2.066 -0.837 1.00 . A A . 15 CYS O 1 1 9 5312 1 1 15 CYS SG S -1.205 2.845 0.367 1.00 . A A . 15 CYS SG 1 1 9 5313 1 1 16 ALA C C -5.593 3.533 2.025 1.00 . A A . 16 ALA C 1 1 9 5314 1 1 16 ALA CA C -5.822 2.047 1.774 1.00 . A A . 16 ALA CA 1 1 9 5315 1 1 16 ALA CB C -6.314 1.365 3.043 1.00 . A A . 16 ALA CB 1 1 9 5316 1 1 16 ALA H H -4.043 0.910 1.926 1.00 . A A . 16 ALA H 1 1 9 5317 1 1 16 ALA HA H -6.583 1.933 1.015 1.00 . A A . 16 ALA HA 1 1 9 5318 1 1 16 ALA HB1 H -5.662 1.622 3.864 1.00 . A A . 16 ALA HB1 1 1 9 5319 1 1 16 ALA HB2 H -7.318 1.697 3.262 1.00 . A A . 16 ALA HB2 1 1 9 5320 1 1 16 ALA HB3 H -6.310 0.295 2.901 1.00 . A A . 16 ALA HB3 1 1 9 5321 1 1 16 ALA N N -4.606 1.402 1.293 1.00 . A A . 16 ALA N 1 1 9 5322 1 1 16 ALA O O -6.408 4.196 2.665 1.00 . A A . 16 ALA O 1 1 9 5323 1 1 17 GLU C C -4.300 6.218 0.372 1.00 . A A . 17 GLU C 1 1 9 5324 1 1 17 GLU CA C -4.143 5.459 1.686 1.00 . A A . 17 GLU CA 1 1 9 5325 1 1 17 GLU CB C -2.712 5.605 2.206 1.00 . A A . 17 GLU CB 1 1 9 5326 1 1 17 GLU CD C -2.685 3.521 3.633 1.00 . A A . 17 GLU CD 1 1 9 5327 1 1 17 GLU CG C -2.506 5.027 3.595 1.00 . A A . 17 GLU CG 1 1 9 5328 1 1 17 GLU H H -3.868 3.470 1.014 1.00 . A A . 17 GLU H 1 1 9 5329 1 1 17 GLU HA H -4.824 5.876 2.413 1.00 . A A . 17 GLU HA 1 1 9 5330 1 1 17 GLU HB2 H -2.041 5.102 1.525 1.00 . A A . 17 GLU HB2 1 1 9 5331 1 1 17 GLU HB3 H -2.458 6.655 2.235 1.00 . A A . 17 GLU HB3 1 1 9 5332 1 1 17 GLU HG2 H -1.505 5.262 3.925 1.00 . A A . 17 GLU HG2 1 1 9 5333 1 1 17 GLU HG3 H -3.221 5.476 4.268 1.00 . A A . 17 GLU HG3 1 1 9 5334 1 1 17 GLU N N -4.479 4.050 1.516 1.00 . A A . 17 GLU N 1 1 9 5335 1 1 17 GLU O O -4.942 7.268 0.322 1.00 . A A . 17 GLU O 1 1 9 5336 1 1 17 GLU OE1 O -3.826 3.065 3.851 1.00 . A A . 17 GLU OE1 1 1 9 5337 1 1 17 GLU OE2 O -1.683 2.800 3.443 1.00 . A A . 17 GLU OE2 1 1 9 5338 1 1 18 CYS C C -4.614 5.464 -2.963 1.00 . A A . 18 CYS C 1 1 9 5339 1 1 18 CYS CA C -3.779 6.307 -2.004 1.00 . A A . 18 CYS CA 1 1 9 5340 1 1 18 CYS CB C -2.374 6.506 -2.574 1.00 . A A . 18 CYS CB 1 1 9 5341 1 1 18 CYS H H -3.210 4.843 -0.586 1.00 . A A . 18 CYS H 1 1 9 5342 1 1 18 CYS HA H -4.251 7.271 -1.887 1.00 . A A . 18 CYS HA 1 1 9 5343 1 1 18 CYS HB2 H -2.453 6.889 -3.581 1.00 . A A . 18 CYS HB2 1 1 9 5344 1 1 18 CYS HB3 H -1.844 7.222 -1.963 1.00 . A A . 18 CYS HB3 1 1 9 5345 1 1 18 CYS N N -3.708 5.681 -0.689 1.00 . A A . 18 CYS N 1 1 9 5346 1 1 18 CYS O O -5.466 5.984 -3.683 1.00 . A A . 18 CYS O 1 1 9 5347 1 1 18 CYS SG S -1.375 4.984 -2.639 1.00 . A A . 18 CYS SG 1 1 9 5348 1 1 19 GLY C C -4.204 2.564 -4.842 1.00 . A A . 19 GLY C 1 1 9 5349 1 1 19 GLY CA C -5.100 3.264 -3.840 1.00 . A A . 19 GLY CA 1 1 9 5350 1 1 19 GLY H H -3.673 3.799 -2.370 1.00 . A A . 19 GLY H 1 1 9 5351 1 1 19 GLY HA2 H -5.599 2.519 -3.237 1.00 . A A . 19 GLY HA2 1 1 9 5352 1 1 19 GLY HA3 H -5.844 3.835 -4.377 1.00 . A A . 19 GLY HA3 1 1 9 5353 1 1 19 GLY N N -4.364 4.158 -2.966 1.00 . A A . 19 GLY N 1 1 9 5354 1 1 19 GLY O O -4.619 2.281 -5.966 1.00 . A A . 19 GLY O 1 1 9 5355 1 1 20 LYS C C -2.194 0.102 -5.254 1.00 . A A . 20 LYS C 1 1 9 5356 1 1 20 LYS CA C -2.011 1.615 -5.306 1.00 . A A . 20 LYS CA 1 1 9 5357 1 1 20 LYS CB C -0.581 1.980 -4.901 1.00 . A A . 20 LYS CB 1 1 9 5358 1 1 20 LYS CD C 1.434 3.420 -5.320 1.00 . A A . 20 LYS CD 1 1 9 5359 1 1 20 LYS CE C 2.304 2.442 -6.094 1.00 . A A . 20 LYS CE 1 1 9 5360 1 1 20 LYS CG C -0.041 3.207 -5.615 1.00 . A A . 20 LYS CG 1 1 9 5361 1 1 20 LYS H H -2.698 2.536 -3.528 1.00 . A A . 20 LYS H 1 1 9 5362 1 1 20 LYS HA H -2.187 1.952 -6.316 1.00 . A A . 20 LYS HA 1 1 9 5363 1 1 20 LYS HB2 H -0.558 2.169 -3.838 1.00 . A A . 20 LYS HB2 1 1 9 5364 1 1 20 LYS HB3 H 0.068 1.146 -5.123 1.00 . A A . 20 LYS HB3 1 1 9 5365 1 1 20 LYS HD2 H 1.707 4.426 -5.601 1.00 . A A . 20 LYS HD2 1 1 9 5366 1 1 20 LYS HD3 H 1.604 3.281 -4.262 1.00 . A A . 20 LYS HD3 1 1 9 5367 1 1 20 LYS HE2 H 3.316 2.512 -5.726 1.00 . A A . 20 LYS HE2 1 1 9 5368 1 1 20 LYS HE3 H 1.930 1.441 -5.931 1.00 . A A . 20 LYS HE3 1 1 9 5369 1 1 20 LYS HG2 H -0.169 3.078 -6.680 1.00 . A A . 20 LYS HG2 1 1 9 5370 1 1 20 LYS HG3 H -0.594 4.076 -5.287 1.00 . A A . 20 LYS HG3 1 1 9 5371 1 1 20 LYS HZ1 H 2.017 3.716 -7.724 1.00 . A A . 20 LYS HZ1 1 1 9 5372 1 1 20 LYS HZ2 H 1.626 2.101 -8.040 1.00 . A A . 20 LYS HZ2 1 1 9 5373 1 1 20 LYS HZ3 H 3.247 2.577 -7.953 1.00 . A A . 20 LYS HZ3 1 1 9 5374 1 1 20 LYS N N -2.970 2.285 -4.436 1.00 . A A . 20 LYS N 1 1 9 5375 1 1 20 LYS NZ N 2.298 2.730 -7.555 1.00 . A A . 20 LYS NZ 1 1 9 5376 1 1 20 LYS O O -2.877 -0.420 -4.373 1.00 . A A . 20 LYS O 1 1 9 5377 1 1 21 ALA C C -0.309 -2.698 -6.038 1.00 . A A . 21 ALA C 1 1 9 5378 1 1 21 ALA CA C -1.672 -2.051 -6.261 1.00 . A A . 21 ALA CA 1 1 9 5379 1 1 21 ALA CB C -2.254 -2.489 -7.597 1.00 . A A . 21 ALA CB 1 1 9 5380 1 1 21 ALA H H -1.049 -0.125 -6.877 1.00 . A A . 21 ALA H 1 1 9 5381 1 1 21 ALA HA H -2.345 -2.375 -5.480 1.00 . A A . 21 ALA HA 1 1 9 5382 1 1 21 ALA HB1 H -1.950 -1.795 -8.366 1.00 . A A . 21 ALA HB1 1 1 9 5383 1 1 21 ALA HB2 H -1.891 -3.477 -7.840 1.00 . A A . 21 ALA HB2 1 1 9 5384 1 1 21 ALA HB3 H -3.331 -2.506 -7.532 1.00 . A A . 21 ALA HB3 1 1 9 5385 1 1 21 ALA N N -1.579 -0.598 -6.202 1.00 . A A . 21 ALA N 1 1 9 5386 1 1 21 ALA O O 0.688 -2.289 -6.633 1.00 . A A . 21 ALA O 1 1 9 5387 1 1 22 PHE C C 0.767 -5.922 -4.934 1.00 . A A . 22 PHE C 1 1 9 5388 1 1 22 PHE CA C 0.968 -4.411 -4.872 1.00 . A A . 22 PHE CA 1 1 9 5389 1 1 22 PHE CB C 1.481 -4.009 -3.488 1.00 . A A . 22 PHE CB 1 1 9 5390 1 1 22 PHE CD1 C 0.943 -1.577 -3.186 1.00 . A A . 22 PHE CD1 1 1 9 5391 1 1 22 PHE CD2 C 3.221 -2.200 -3.517 1.00 . A A . 22 PHE CD2 1 1 9 5392 1 1 22 PHE CE1 C 1.316 -0.249 -3.101 1.00 . A A . 22 PHE CE1 1 1 9 5393 1 1 22 PHE CE2 C 3.600 -0.874 -3.433 1.00 . A A . 22 PHE CE2 1 1 9 5394 1 1 22 PHE CG C 1.890 -2.566 -3.395 1.00 . A A . 22 PHE CG 1 1 9 5395 1 1 22 PHE CZ C 2.647 0.103 -3.224 1.00 . A A . 22 PHE CZ 1 1 9 5396 1 1 22 PHE H H -1.102 -3.988 -4.732 1.00 . A A . 22 PHE H 1 1 9 5397 1 1 22 PHE HA H 1.699 -4.126 -5.614 1.00 . A A . 22 PHE HA 1 1 9 5398 1 1 22 PHE HB2 H 0.703 -4.180 -2.760 1.00 . A A . 22 PHE HB2 1 1 9 5399 1 1 22 PHE HB3 H 2.340 -4.615 -3.240 1.00 . A A . 22 PHE HB3 1 1 9 5400 1 1 22 PHE HD1 H -0.097 -1.850 -3.089 1.00 . A A . 22 PHE HD1 1 1 9 5401 1 1 22 PHE HD2 H 3.968 -2.965 -3.681 1.00 . A A . 22 PHE HD2 1 1 9 5402 1 1 22 PHE HE1 H 0.569 0.513 -2.938 1.00 . A A . 22 PHE HE1 1 1 9 5403 1 1 22 PHE HE2 H 4.641 -0.603 -3.529 1.00 . A A . 22 PHE HE2 1 1 9 5404 1 1 22 PHE HZ H 2.941 1.140 -3.158 1.00 . A A . 22 PHE HZ 1 1 9 5405 1 1 22 PHE N N -0.273 -3.708 -5.176 1.00 . A A . 22 PHE N 1 1 9 5406 1 1 22 PHE O O -0.143 -6.465 -4.307 1.00 . A A . 22 PHE O 1 1 9 5407 1 1 23 THR C C 1.856 -8.748 -4.526 1.00 . A A . 23 THR C 1 1 9 5408 1 1 23 THR CA C 1.540 -8.044 -5.840 1.00 . A A . 23 THR CA 1 1 9 5409 1 1 23 THR CB C 2.504 -8.556 -6.928 1.00 . A A . 23 THR CB 1 1 9 5410 1 1 23 THR CG2 C 2.149 -7.968 -8.285 1.00 . A A . 23 THR CG2 1 1 9 5411 1 1 23 THR H H 2.328 -6.107 -6.169 1.00 . A A . 23 THR H 1 1 9 5412 1 1 23 THR HA H 0.532 -8.292 -6.137 1.00 . A A . 23 THR HA 1 1 9 5413 1 1 23 THR HB H 2.420 -9.632 -6.985 1.00 . A A . 23 THR HB 1 1 9 5414 1 1 23 THR HG1 H 4.150 -8.758 -5.861 1.00 . A A . 23 THR HG1 1 1 9 5415 1 1 23 THR HG21 H 3.036 -7.916 -8.898 1.00 . A A . 23 THR HG21 1 1 9 5416 1 1 23 THR HG22 H 1.744 -6.976 -8.153 1.00 . A A . 23 THR HG22 1 1 9 5417 1 1 23 THR HG23 H 1.414 -8.595 -8.768 1.00 . A A . 23 THR HG23 1 1 9 5418 1 1 23 THR N N 1.624 -6.597 -5.694 1.00 . A A . 23 THR N 1 1 9 5419 1 1 23 THR O O 1.220 -9.742 -4.174 1.00 . A A . 23 THR O 1 1 9 5420 1 1 23 THR OG1 O 3.852 -8.210 -6.590 1.00 . A A . 23 THR OG1 1 1 9 5421 1 1 24 ASP C C 2.915 -7.857 -1.374 1.00 . A A . 24 ASP C 1 1 9 5422 1 1 24 ASP CA C 3.240 -8.805 -2.525 1.00 . A A . 24 ASP CA 1 1 9 5423 1 1 24 ASP CB C 4.736 -9.126 -2.530 1.00 . A A . 24 ASP CB 1 1 9 5424 1 1 24 ASP CG C 5.088 -10.226 -3.512 1.00 . A A . 24 ASP CG 1 1 9 5425 1 1 24 ASP H H 3.311 -7.434 -4.136 1.00 . A A . 24 ASP H 1 1 9 5426 1 1 24 ASP HA H 2.686 -9.721 -2.387 1.00 . A A . 24 ASP HA 1 1 9 5427 1 1 24 ASP HB2 H 5.287 -8.237 -2.801 1.00 . A A . 24 ASP HB2 1 1 9 5428 1 1 24 ASP HB3 H 5.033 -9.441 -1.541 1.00 . A A . 24 ASP HB3 1 1 9 5429 1 1 24 ASP N N 2.841 -8.227 -3.802 1.00 . A A . 24 ASP N 1 1 9 5430 1 1 24 ASP O O 2.621 -6.682 -1.590 1.00 . A A . 24 ASP O 1 1 9 5431 1 1 24 ASP OD1 O 4.918 -10.010 -4.730 1.00 . A A . 24 ASP OD1 1 1 9 5432 1 1 24 ASP OD2 O 5.534 -11.303 -3.062 1.00 . A A . 24 ASP OD2 1 1 9 5433 1 1 25 ARG C C 3.887 -6.739 1.432 1.00 . A A . 25 ARG C 1 1 9 5434 1 1 25 ARG CA C 2.678 -7.579 1.032 1.00 . A A . 25 ARG CA 1 1 9 5435 1 1 25 ARG CB C 2.264 -8.483 2.194 1.00 . A A . 25 ARG CB 1 1 9 5436 1 1 25 ARG CD C 0.873 -8.754 4.270 1.00 . A A . 25 ARG CD 1 1 9 5437 1 1 25 ARG CG C 1.439 -7.773 3.255 1.00 . A A . 25 ARG CG 1 1 9 5438 1 1 25 ARG CZ C -0.981 -8.823 5.883 1.00 . A A . 25 ARG CZ 1 1 9 5439 1 1 25 ARG H H 3.209 -9.322 -0.045 1.00 . A A . 25 ARG H 1 1 9 5440 1 1 25 ARG HA H 1.858 -6.917 0.793 1.00 . A A . 25 ARG HA 1 1 9 5441 1 1 25 ARG HB2 H 1.681 -9.305 1.806 1.00 . A A . 25 ARG HB2 1 1 9 5442 1 1 25 ARG HB3 H 3.154 -8.874 2.664 1.00 . A A . 25 ARG HB3 1 1 9 5443 1 1 25 ARG HD2 H 0.420 -9.578 3.740 1.00 . A A . 25 ARG HD2 1 1 9 5444 1 1 25 ARG HD3 H 1.682 -9.121 4.884 1.00 . A A . 25 ARG HD3 1 1 9 5445 1 1 25 ARG HE H -0.174 -7.155 5.145 1.00 . A A . 25 ARG HE 1 1 9 5446 1 1 25 ARG HG2 H 2.066 -7.061 3.770 1.00 . A A . 25 ARG HG2 1 1 9 5447 1 1 25 ARG HG3 H 0.622 -7.254 2.774 1.00 . A A . 25 ARG HG3 1 1 9 5448 1 1 25 ARG HH11 H -0.279 -10.630 5.316 1.00 . A A . 25 ARG HH11 1 1 9 5449 1 1 25 ARG HH12 H -1.586 -10.665 6.453 1.00 . A A . 25 ARG HH12 1 1 9 5450 1 1 25 ARG HH21 H -1.895 -7.187 6.642 1.00 . A A . 25 ARG HH21 1 1 9 5451 1 1 25 ARG HH22 H -2.505 -8.706 7.206 1.00 . A A . 25 ARG HH22 1 1 9 5452 1 1 25 ARG N N 2.969 -8.378 -0.152 1.00 . A A . 25 ARG N 1 1 9 5453 1 1 25 ARG NE N -0.131 -8.133 5.130 1.00 . A A . 25 ARG NE 1 1 9 5454 1 1 25 ARG NH1 N -0.946 -10.148 5.884 1.00 . A A . 25 ARG NH1 1 1 9 5455 1 1 25 ARG NH2 N -1.866 -8.186 6.639 1.00 . A A . 25 ARG NH2 1 1 9 5456 1 1 25 ARG O O 3.787 -5.521 1.584 1.00 . A A . 25 ARG O 1 1 9 5457 1 1 26 SER C C 6.417 -5.407 1.215 1.00 . A A . 26 SER C 1 1 9 5458 1 1 26 SER CA C 6.257 -6.713 1.988 1.00 . A A . 26 SER CA 1 1 9 5459 1 1 26 SER CB C 7.468 -7.615 1.744 1.00 . A A . 26 SER CB 1 1 9 5460 1 1 26 SER H H 5.045 -8.368 1.465 1.00 . A A . 26 SER H 1 1 9 5461 1 1 26 SER HA H 6.193 -6.488 3.042 1.00 . A A . 26 SER HA 1 1 9 5462 1 1 26 SER HB2 H 7.186 -8.644 1.907 1.00 . A A . 26 SER HB2 1 1 9 5463 1 1 26 SER HB3 H 7.805 -7.492 0.725 1.00 . A A . 26 SER HB3 1 1 9 5464 1 1 26 SER HG H 8.179 -6.881 3.415 1.00 . A A . 26 SER HG 1 1 9 5465 1 1 26 SER N N 5.029 -7.398 1.601 1.00 . A A . 26 SER N 1 1 9 5466 1 1 26 SER O O 6.745 -4.370 1.788 1.00 . A A . 26 SER O 1 1 9 5467 1 1 26 SER OG O 8.532 -7.289 2.621 1.00 . A A . 26 SER OG 1 1 9 5468 1 1 27 ASN C C 5.345 -3.193 -0.494 1.00 . A A . 27 ASN C 1 1 9 5469 1 1 27 ASN CA C 6.302 -4.292 -0.946 1.00 . A A . 27 ASN CA 1 1 9 5470 1 1 27 ASN CB C 6.020 -4.663 -2.403 1.00 . A A . 27 ASN CB 1 1 9 5471 1 1 27 ASN CG C 7.244 -5.216 -3.107 1.00 . A A . 27 ASN CG 1 1 9 5472 1 1 27 ASN H H 5.925 -6.325 -0.493 1.00 . A A . 27 ASN H 1 1 9 5473 1 1 27 ASN HA H 7.315 -3.926 -0.867 1.00 . A A . 27 ASN HA 1 1 9 5474 1 1 27 ASN HB2 H 5.242 -5.413 -2.433 1.00 . A A . 27 ASN HB2 1 1 9 5475 1 1 27 ASN HB3 H 5.687 -3.784 -2.935 1.00 . A A . 27 ASN HB3 1 1 9 5476 1 1 27 ASN HD21 H 6.096 -6.367 -4.253 1.00 . A A . 27 ASN HD21 1 1 9 5477 1 1 27 ASN HD22 H 7.797 -6.488 -4.531 1.00 . A A . 27 ASN HD22 1 1 9 5478 1 1 27 ASN N N 6.183 -5.468 -0.092 1.00 . A A . 27 ASN N 1 1 9 5479 1 1 27 ASN ND2 N 7.023 -6.114 -4.060 1.00 . A A . 27 ASN ND2 1 1 9 5480 1 1 27 ASN O O 5.706 -2.016 -0.456 1.00 . A A . 27 ASN O 1 1 9 5481 1 1 27 ASN OD1 O 8.374 -4.839 -2.798 1.00 . A A . 27 ASN OD1 1 1 9 5482 1 1 28 LEU C C 3.564 -1.920 1.567 1.00 . A A . 28 LEU C 1 1 9 5483 1 1 28 LEU CA C 3.112 -2.634 0.297 1.00 . A A . 28 LEU CA 1 1 9 5484 1 1 28 LEU CB C 1.784 -3.351 0.548 1.00 . A A . 28 LEU CB 1 1 9 5485 1 1 28 LEU CD1 C 0.289 -1.342 0.441 1.00 . A A . 28 LEU CD1 1 1 9 5486 1 1 28 LEU CD2 C -0.491 -3.418 1.599 1.00 . A A . 28 LEU CD2 1 1 9 5487 1 1 28 LEU CG C 0.711 -2.541 1.276 1.00 . A A . 28 LEU CG 1 1 9 5488 1 1 28 LEU H H 3.893 -4.536 -0.204 1.00 . A A . 28 LEU H 1 1 9 5489 1 1 28 LEU HA H 2.975 -1.902 -0.484 1.00 . A A . 28 LEU HA 1 1 9 5490 1 1 28 LEU HB2 H 1.383 -3.647 -0.409 1.00 . A A . 28 LEU HB2 1 1 9 5491 1 1 28 LEU HB3 H 1.991 -4.233 1.137 1.00 . A A . 28 LEU HB3 1 1 9 5492 1 1 28 LEU HD11 H -0.694 -1.018 0.748 1.00 . A A . 28 LEU HD11 1 1 9 5493 1 1 28 LEU HD12 H 0.266 -1.620 -0.603 1.00 . A A . 28 LEU HD12 1 1 9 5494 1 1 28 LEU HD13 H 0.996 -0.538 0.583 1.00 . A A . 28 LEU HD13 1 1 9 5495 1 1 28 LEU HD21 H -0.835 -3.904 0.698 1.00 . A A . 28 LEU HD21 1 1 9 5496 1 1 28 LEU HD22 H -1.283 -2.806 2.004 1.00 . A A . 28 LEU HD22 1 1 9 5497 1 1 28 LEU HD23 H -0.206 -4.164 2.326 1.00 . A A . 28 LEU HD23 1 1 9 5498 1 1 28 LEU HG H 1.117 -2.172 2.207 1.00 . A A . 28 LEU HG 1 1 9 5499 1 1 28 LEU N N 4.122 -3.585 -0.153 1.00 . A A . 28 LEU N 1 1 9 5500 1 1 28 LEU O O 3.681 -0.694 1.594 1.00 . A A . 28 LEU O 1 1 9 5501 1 1 29 PHE C C 5.316 -1.055 3.673 1.00 . A A . 29 PHE C 1 1 9 5502 1 1 29 PHE CA C 4.260 -2.134 3.889 1.00 . A A . 29 PHE CA 1 1 9 5503 1 1 29 PHE CB C 4.819 -3.239 4.789 1.00 . A A . 29 PHE CB 1 1 9 5504 1 1 29 PHE CD1 C 2.939 -3.226 6.451 1.00 . A A . 29 PHE CD1 1 1 9 5505 1 1 29 PHE CD2 C 3.610 -5.314 5.515 1.00 . A A . 29 PHE CD2 1 1 9 5506 1 1 29 PHE CE1 C 1.970 -3.868 7.199 1.00 . A A . 29 PHE CE1 1 1 9 5507 1 1 29 PHE CE2 C 2.643 -5.962 6.261 1.00 . A A . 29 PHE CE2 1 1 9 5508 1 1 29 PHE CG C 3.768 -3.940 5.601 1.00 . A A . 29 PHE CG 1 1 9 5509 1 1 29 PHE CZ C 1.823 -5.238 7.105 1.00 . A A . 29 PHE CZ 1 1 9 5510 1 1 29 PHE H H 3.707 -3.664 2.534 1.00 . A A . 29 PHE H 1 1 9 5511 1 1 29 PHE HA H 3.402 -1.690 4.370 1.00 . A A . 29 PHE HA 1 1 9 5512 1 1 29 PHE HB2 H 5.312 -3.978 4.176 1.00 . A A . 29 PHE HB2 1 1 9 5513 1 1 29 PHE HB3 H 5.535 -2.808 5.472 1.00 . A A . 29 PHE HB3 1 1 9 5514 1 1 29 PHE HD1 H 3.054 -2.153 6.526 1.00 . A A . 29 PHE HD1 1 1 9 5515 1 1 29 PHE HD2 H 4.251 -5.881 4.856 1.00 . A A . 29 PHE HD2 1 1 9 5516 1 1 29 PHE HE1 H 1.331 -3.299 7.858 1.00 . A A . 29 PHE HE1 1 1 9 5517 1 1 29 PHE HE2 H 2.530 -7.033 6.185 1.00 . A A . 29 PHE HE2 1 1 9 5518 1 1 29 PHE HZ H 1.067 -5.742 7.688 1.00 . A A . 29 PHE HZ 1 1 9 5519 1 1 29 PHE N N 3.819 -2.693 2.617 1.00 . A A . 29 PHE N 1 1 9 5520 1 1 29 PHE O O 5.222 0.043 4.222 1.00 . A A . 29 PHE O 1 1 9 5521 1 1 30 THR C C 6.858 0.849 1.964 1.00 . A A . 30 THR C 1 1 9 5522 1 1 30 THR CA C 7.401 -0.436 2.578 1.00 . A A . 30 THR CA 1 1 9 5523 1 1 30 THR CB C 8.440 -1.050 1.622 1.00 . A A . 30 THR CB 1 1 9 5524 1 1 30 THR CG2 C 9.549 -0.054 1.317 1.00 . A A . 30 THR CG2 1 1 9 5525 1 1 30 THR H H 6.344 -2.267 2.459 1.00 . A A . 30 THR H 1 1 9 5526 1 1 30 THR HA H 7.895 -0.199 3.509 1.00 . A A . 30 THR HA 1 1 9 5527 1 1 30 THR HB H 7.946 -1.311 0.697 1.00 . A A . 30 THR HB 1 1 9 5528 1 1 30 THR HG1 H 8.433 -2.984 2.010 1.00 . A A . 30 THR HG1 1 1 9 5529 1 1 30 THR HG21 H 10.374 -0.215 1.995 1.00 . A A . 30 THR HG21 1 1 9 5530 1 1 30 THR HG22 H 9.174 0.951 1.440 1.00 . A A . 30 THR HG22 1 1 9 5531 1 1 30 THR HG23 H 9.887 -0.191 0.301 1.00 . A A . 30 THR HG23 1 1 9 5532 1 1 30 THR N N 6.325 -1.376 2.867 1.00 . A A . 30 THR N 1 1 9 5533 1 1 30 THR O O 7.330 1.944 2.273 1.00 . A A . 30 THR O 1 1 9 5534 1 1 30 THR OG1 O 9.001 -2.233 2.202 1.00 . A A . 30 THR OG1 1 1 9 5535 1 1 31 HIS C C 4.432 2.679 1.427 1.00 . A A . 31 HIS C 1 1 9 5536 1 1 31 HIS CA C 5.255 1.861 0.437 1.00 . A A . 31 HIS CA 1 1 9 5537 1 1 31 HIS CB C 4.371 1.404 -0.724 1.00 . A A . 31 HIS CB 1 1 9 5538 1 1 31 HIS CD2 C 2.096 2.638 -0.889 1.00 . A A . 31 HIS CD2 1 1 9 5539 1 1 31 HIS CE1 C 2.689 4.221 -2.285 1.00 . A A . 31 HIS CE1 1 1 9 5540 1 1 31 HIS CG C 3.402 2.449 -1.186 1.00 . A A . 31 HIS CG 1 1 9 5541 1 1 31 HIS H H 5.530 -0.189 0.889 1.00 . A A . 31 HIS H 1 1 9 5542 1 1 31 HIS HA H 6.050 2.480 0.051 1.00 . A A . 31 HIS HA 1 1 9 5543 1 1 31 HIS HB2 H 4.998 1.140 -1.563 1.00 . A A . 31 HIS HB2 1 1 9 5544 1 1 31 HIS HB3 H 3.804 0.537 -0.417 1.00 . A A . 31 HIS HB3 1 1 9 5545 1 1 31 HIS HD1 H 4.628 3.591 -2.464 1.00 . A A . 31 HIS HD1 1 1 9 5546 1 1 31 HIS HD2 H 1.494 2.032 -0.227 1.00 . A A . 31 HIS HD2 1 1 9 5547 1 1 31 HIS HE1 H 2.660 5.087 -2.930 1.00 . A A . 31 HIS HE1 1 1 9 5548 1 1 31 HIS N N 5.863 0.709 1.094 1.00 . A A . 31 HIS N 1 1 9 5549 1 1 31 HIS ND1 N 3.744 3.456 -2.064 1.00 . A A . 31 HIS ND1 1 1 9 5550 1 1 31 HIS NE2 N 1.676 3.746 -1.584 1.00 . A A . 31 HIS NE2 1 1 9 5551 1 1 31 HIS O O 4.518 3.907 1.454 1.00 . A A . 31 HIS O 1 1 9 5552 1 1 32 GLN C C 3.608 3.647 4.053 1.00 . A A . 32 GLN C 1 1 9 5553 1 1 32 GLN CA C 2.795 2.655 3.228 1.00 . A A . 32 GLN CA 1 1 9 5554 1 1 32 GLN CB C 2.142 1.623 4.148 1.00 . A A . 32 GLN CB 1 1 9 5555 1 1 32 GLN CD C 0.196 0.035 4.423 1.00 . A A . 32 GLN CD 1 1 9 5556 1 1 32 GLN CG C 1.112 0.750 3.450 1.00 . A A . 32 GLN CG 1 1 9 5557 1 1 32 GLN H H 3.610 1.014 2.168 1.00 . A A . 32 GLN H 1 1 9 5558 1 1 32 GLN HA H 2.023 3.193 2.700 1.00 . A A . 32 GLN HA 1 1 9 5559 1 1 32 GLN HB2 H 2.910 0.981 4.553 1.00 . A A . 32 GLN HB2 1 1 9 5560 1 1 32 GLN HB3 H 1.652 2.140 4.960 1.00 . A A . 32 GLN HB3 1 1 9 5561 1 1 32 GLN HE21 H -1.402 0.679 3.431 1.00 . A A . 32 GLN HE21 1 1 9 5562 1 1 32 GLN HE22 H -1.723 -0.304 4.814 1.00 . A A . 32 GLN HE22 1 1 9 5563 1 1 32 GLN HG2 H 0.510 1.372 2.804 1.00 . A A . 32 GLN HG2 1 1 9 5564 1 1 32 GLN HG3 H 1.629 0.011 2.855 1.00 . A A . 32 GLN HG3 1 1 9 5565 1 1 32 GLN N N 3.634 1.991 2.238 1.00 . A A . 32 GLN N 1 1 9 5566 1 1 32 GLN NE2 N -1.109 0.148 4.201 1.00 . A A . 32 GLN NE2 1 1 9 5567 1 1 32 GLN O O 3.053 4.535 4.701 1.00 . A A . 32 GLN O 1 1 9 5568 1 1 32 GLN OE1 O 0.655 -0.612 5.364 1.00 . A A . 32 GLN OE1 1 1 9 5569 1 1 33 LYS C C 5.521 5.836 4.458 1.00 . A A . 33 LYS C 1 1 9 5570 1 1 33 LYS CA C 5.818 4.373 4.770 1.00 . A A . 33 LYS CA 1 1 9 5571 1 1 33 LYS CB C 7.278 4.056 4.437 1.00 . A A . 33 LYS CB 1 1 9 5572 1 1 33 LYS CD C 9.298 2.777 5.208 1.00 . A A . 33 LYS CD 1 1 9 5573 1 1 33 LYS CE C 9.973 2.663 3.850 1.00 . A A . 33 LYS CE 1 1 9 5574 1 1 33 LYS CG C 7.784 2.775 5.079 1.00 . A A . 33 LYS CG 1 1 9 5575 1 1 33 LYS H H 5.311 2.764 3.491 1.00 . A A . 33 LYS H 1 1 9 5576 1 1 33 LYS HA H 5.652 4.200 5.823 1.00 . A A . 33 LYS HA 1 1 9 5577 1 1 33 LYS HB2 H 7.378 3.961 3.366 1.00 . A A . 33 LYS HB2 1 1 9 5578 1 1 33 LYS HB3 H 7.898 4.873 4.777 1.00 . A A . 33 LYS HB3 1 1 9 5579 1 1 33 LYS HD2 H 9.610 3.698 5.676 1.00 . A A . 33 LYS HD2 1 1 9 5580 1 1 33 LYS HD3 H 9.599 1.939 5.822 1.00 . A A . 33 LYS HD3 1 1 9 5581 1 1 33 LYS HE2 H 9.954 1.630 3.538 1.00 . A A . 33 LYS HE2 1 1 9 5582 1 1 33 LYS HE3 H 9.426 3.264 3.139 1.00 . A A . 33 LYS HE3 1 1 9 5583 1 1 33 LYS HG2 H 7.350 2.680 6.063 1.00 . A A . 33 LYS HG2 1 1 9 5584 1 1 33 LYS HG3 H 7.484 1.935 4.469 1.00 . A A . 33 LYS HG3 1 1 9 5585 1 1 33 LYS HZ1 H 11.524 3.782 4.691 1.00 . A A . 33 LYS HZ1 1 1 9 5586 1 1 33 LYS HZ2 H 11.626 3.624 3.009 1.00 . A A . 33 LYS HZ2 1 1 9 5587 1 1 33 LYS HZ3 H 12.028 2.319 4.007 1.00 . A A . 33 LYS HZ3 1 1 9 5588 1 1 33 LYS N N 4.927 3.491 4.026 1.00 . A A . 33 LYS N 1 1 9 5589 1 1 33 LYS NZ N 11.387 3.130 3.892 1.00 . A A . 33 LYS NZ 1 1 9 5590 1 1 33 LYS O O 5.427 6.666 5.363 1.00 . A A . 33 LYS O 1 1 9 5591 1 1 34 ILE C C 3.771 8.004 3.343 1.00 . A A . 34 ILE C 1 1 9 5592 1 1 34 ILE CA C 5.083 7.507 2.745 1.00 . A A . 34 ILE CA 1 1 9 5593 1 1 34 ILE CB C 5.006 7.609 1.210 1.00 . A A . 34 ILE CB 1 1 9 5594 1 1 34 ILE CD1 C 3.210 7.429 -0.584 1.00 . A A . 34 ILE CD1 1 1 9 5595 1 1 34 ILE CG1 C 3.787 6.846 0.687 1.00 . A A . 34 ILE CG1 1 1 9 5596 1 1 34 ILE CG2 C 6.283 7.074 0.579 1.00 . A A . 34 ILE CG2 1 1 9 5597 1 1 34 ILE H H 5.459 5.439 2.500 1.00 . A A . 34 ILE H 1 1 9 5598 1 1 34 ILE HA H 5.887 8.142 3.088 1.00 . A A . 34 ILE HA 1 1 9 5599 1 1 34 ILE HB H 4.911 8.651 0.945 1.00 . A A . 34 ILE HB 1 1 9 5600 1 1 34 ILE HD11 H 3.120 8.501 -0.480 1.00 . A A . 34 ILE HD11 1 1 9 5601 1 1 34 ILE HD12 H 3.864 7.203 -1.414 1.00 . A A . 34 ILE HD12 1 1 9 5602 1 1 34 ILE HD13 H 2.235 7.002 -0.766 1.00 . A A . 34 ILE HD13 1 1 9 5603 1 1 34 ILE HG12 H 4.069 5.825 0.485 1.00 . A A . 34 ILE HG12 1 1 9 5604 1 1 34 ILE HG13 H 3.013 6.860 1.440 1.00 . A A . 34 ILE HG13 1 1 9 5605 1 1 34 ILE HG21 H 6.702 6.305 1.211 1.00 . A A . 34 ILE HG21 1 1 9 5606 1 1 34 ILE HG22 H 6.058 6.658 -0.391 1.00 . A A . 34 ILE HG22 1 1 9 5607 1 1 34 ILE HG23 H 6.995 7.878 0.470 1.00 . A A . 34 ILE HG23 1 1 9 5608 1 1 34 ILE N N 5.373 6.144 3.174 1.00 . A A . 34 ILE N 1 1 9 5609 1 1 34 ILE O O 3.442 9.187 3.245 1.00 . A A . 34 ILE O 1 1 9 5610 1 1 35 HIS C C 1.868 7.449 6.101 1.00 . A A . 35 HIS C 1 1 9 5611 1 1 35 HIS CA C 1.752 7.442 4.580 1.00 . A A . 35 HIS CA 1 1 9 5612 1 1 35 HIS CB C 0.666 6.457 4.144 1.00 . A A . 35 HIS CB 1 1 9 5613 1 1 35 HIS CD2 C 0.450 5.530 1.731 1.00 . A A . 35 HIS CD2 1 1 9 5614 1 1 35 HIS CE1 C -0.222 7.368 0.741 1.00 . A A . 35 HIS CE1 1 1 9 5615 1 1 35 HIS CG C 0.375 6.497 2.675 1.00 . A A . 35 HIS CG 1 1 9 5616 1 1 35 HIS H H 3.343 6.168 4.008 1.00 . A A . 35 HIS H 1 1 9 5617 1 1 35 HIS HA H 1.481 8.432 4.247 1.00 . A A . 35 HIS HA 1 1 9 5618 1 1 35 HIS HB2 H 0.979 5.454 4.392 1.00 . A A . 35 HIS HB2 1 1 9 5619 1 1 35 HIS HB3 H -0.250 6.684 4.671 1.00 . A A . 35 HIS HB3 1 1 9 5620 1 1 35 HIS HD1 H -0.198 8.511 2.438 1.00 . A A . 35 HIS HD1 1 1 9 5621 1 1 35 HIS HD2 H 0.749 4.503 1.887 1.00 . A A . 35 HIS HD2 1 1 9 5622 1 1 35 HIS HE1 H -0.549 8.068 -0.013 1.00 . A A . 35 HIS HE1 1 1 9 5623 1 1 35 HIS N N 3.027 7.095 3.963 1.00 . A A . 35 HIS N 1 1 9 5624 1 1 35 HIS ND1 N -0.047 7.636 2.023 1.00 . A A . 35 HIS ND1 1 1 9 5625 1 1 35 HIS NE2 N 0.074 6.097 0.538 1.00 . A A . 35 HIS NE2 1 1 9 5626 1 1 35 HIS O O 1.538 8.439 6.755 1.00 . A A . 35 HIS O 1 1 9 5627 1 1 36 THR C C 3.272 7.395 8.673 1.00 . A A . 36 THR C 1 1 9 5628 1 1 36 THR CA C 2.495 6.215 8.103 1.00 . A A . 36 THR CA 1 1 9 5629 1 1 36 THR CB C 3.217 4.908 8.480 1.00 . A A . 36 THR CB 1 1 9 5630 1 1 36 THR CG2 C 2.217 3.790 8.732 1.00 . A A . 36 THR CG2 1 1 9 5631 1 1 36 THR H H 2.582 5.582 6.085 1.00 . A A . 36 THR H 1 1 9 5632 1 1 36 THR HA H 1.509 6.198 8.546 1.00 . A A . 36 THR HA 1 1 9 5633 1 1 36 THR HB H 3.783 5.076 9.386 1.00 . A A . 36 THR HB 1 1 9 5634 1 1 36 THR HG1 H 4.390 5.305 6.945 1.00 . A A . 36 THR HG1 1 1 9 5635 1 1 36 THR HG21 H 2.708 2.836 8.614 1.00 . A A . 36 THR HG21 1 1 9 5636 1 1 36 THR HG22 H 1.405 3.867 8.024 1.00 . A A . 36 THR HG22 1 1 9 5637 1 1 36 THR HG23 H 1.829 3.874 9.736 1.00 . A A . 36 THR HG23 1 1 9 5638 1 1 36 THR N N 2.337 6.337 6.659 1.00 . A A . 36 THR N 1 1 9 5639 1 1 36 THR O O 4.430 7.618 8.320 1.00 . A A . 36 THR O 1 1 9 5640 1 1 36 THR OG1 O 4.116 4.525 7.433 1.00 . A A . 36 THR OG1 1 1 9 5641 1 1 37 GLY C C 2.288 10.369 10.583 1.00 . A A . 37 GLY C 1 1 9 5642 1 1 37 GLY CA C 3.277 9.299 10.164 1.00 . A A . 37 GLY CA 1 1 9 5643 1 1 37 GLY H H 1.707 7.925 9.803 1.00 . A A . 37 GLY H 1 1 9 5644 1 1 37 GLY HA2 H 3.826 8.972 11.034 1.00 . A A . 37 GLY HA2 1 1 9 5645 1 1 37 GLY HA3 H 3.969 9.724 9.452 1.00 . A A . 37 GLY HA3 1 1 9 5646 1 1 37 GLY N N 2.629 8.150 9.559 1.00 . A A . 37 GLY N 1 1 9 5647 1 1 37 GLY O O 1.129 10.346 10.170 1.00 . A A . 37 GLY O 1 1 9 5648 1 1 38 GLU C C 1.755 13.480 10.823 1.00 . A A . 38 GLU C 1 1 9 5649 1 1 38 GLU CA C 1.891 12.388 11.881 1.00 . A A . 38 GLU CA 1 1 9 5650 1 1 38 GLU CB C 2.454 12.983 13.174 1.00 . A A . 38 GLU CB 1 1 9 5651 1 1 38 GLU CD C 1.884 14.095 15.369 1.00 . A A . 38 GLU CD 1 1 9 5652 1 1 38 GLU CG C 1.455 13.835 13.938 1.00 . A A . 38 GLU CG 1 1 9 5653 1 1 38 GLU H H 3.680 11.271 11.699 1.00 . A A . 38 GLU H 1 1 9 5654 1 1 38 GLU HA H 0.914 11.975 12.082 1.00 . A A . 38 GLU HA 1 1 9 5655 1 1 38 GLU HB2 H 2.775 12.176 13.817 1.00 . A A . 38 GLU HB2 1 1 9 5656 1 1 38 GLU HB3 H 3.308 13.598 12.930 1.00 . A A . 38 GLU HB3 1 1 9 5657 1 1 38 GLU HG2 H 1.350 14.784 13.433 1.00 . A A . 38 GLU HG2 1 1 9 5658 1 1 38 GLU HG3 H 0.502 13.327 13.950 1.00 . A A . 38 GLU HG3 1 1 9 5659 1 1 38 GLU N N 2.746 11.307 11.405 1.00 . A A . 38 GLU N 1 1 9 5660 1 1 38 GLU O O 2.716 13.811 10.129 1.00 . A A . 38 GLU O 1 1 9 5661 1 1 38 GLU OE1 O 3.106 14.105 15.629 1.00 . A A . 38 GLU OE1 1 1 9 5662 1 1 38 GLU OE2 O 0.999 14.287 16.228 1.00 . A A . 38 GLU OE2 1 1 9 5663 1 1 39 LYS C C -0.928 15.914 10.144 1.00 . A A . 39 LYS C 1 1 9 5664 1 1 39 LYS CA C 0.289 15.090 9.735 1.00 . A A . 39 LYS CA 1 1 9 5665 1 1 39 LYS CB C 0.066 14.488 8.346 1.00 . A A . 39 LYS CB 1 1 9 5666 1 1 39 LYS CD C -1.581 13.543 6.701 1.00 . A A . 39 LYS CD 1 1 9 5667 1 1 39 LYS CE C -2.064 14.755 5.920 1.00 . A A . 39 LYS CE 1 1 9 5668 1 1 39 LYS CG C -1.317 13.888 8.157 1.00 . A A . 39 LYS CG 1 1 9 5669 1 1 39 LYS H H -0.174 13.729 11.289 1.00 . A A . 39 LYS H 1 1 9 5670 1 1 39 LYS HA H 1.153 15.736 9.703 1.00 . A A . 39 LYS HA 1 1 9 5671 1 1 39 LYS HB2 H 0.204 15.261 7.605 1.00 . A A . 39 LYS HB2 1 1 9 5672 1 1 39 LYS HB3 H 0.798 13.710 8.182 1.00 . A A . 39 LYS HB3 1 1 9 5673 1 1 39 LYS HD2 H -0.667 13.181 6.254 1.00 . A A . 39 LYS HD2 1 1 9 5674 1 1 39 LYS HD3 H -2.336 12.771 6.655 1.00 . A A . 39 LYS HD3 1 1 9 5675 1 1 39 LYS HE2 H -3.066 14.997 6.239 1.00 . A A . 39 LYS HE2 1 1 9 5676 1 1 39 LYS HE3 H -1.409 15.587 6.130 1.00 . A A . 39 LYS HE3 1 1 9 5677 1 1 39 LYS HG2 H -1.393 12.988 8.749 1.00 . A A . 39 LYS HG2 1 1 9 5678 1 1 39 LYS HG3 H -2.057 14.603 8.488 1.00 . A A . 39 LYS HG3 1 1 9 5679 1 1 39 LYS HZ1 H -2.581 15.263 3.960 1.00 . A A . 39 LYS HZ1 1 1 9 5680 1 1 39 LYS HZ2 H -2.539 13.596 4.248 1.00 . A A . 39 LYS HZ2 1 1 9 5681 1 1 39 LYS HZ3 H -1.096 14.464 4.092 1.00 . A A . 39 LYS HZ3 1 1 9 5682 1 1 39 LYS N N 0.553 14.035 10.706 1.00 . A A . 39 LYS N 1 1 9 5683 1 1 39 LYS NZ N -2.070 14.502 4.452 1.00 . A A . 39 LYS NZ 1 1 9 5684 1 1 39 LYS O O -1.870 15.412 10.758 1.00 . A A . 39 LYS O 1 1 9 5685 1 1 40 PRO C C -3.267 17.831 9.314 1.00 . A A . 40 PRO C 1 1 9 5686 1 1 40 PRO CA C -2.005 18.130 10.116 1.00 . A A . 40 PRO CA 1 1 9 5687 1 1 40 PRO CB C -1.440 19.500 9.734 1.00 . A A . 40 PRO CB 1 1 9 5688 1 1 40 PRO CD C 0.180 17.875 9.064 1.00 . A A . 40 PRO CD 1 1 9 5689 1 1 40 PRO CG C -0.410 19.209 8.698 1.00 . A A . 40 PRO CG 1 1 9 5690 1 1 40 PRO HA H -2.239 18.117 11.171 1.00 . A A . 40 PRO HA 1 1 9 5691 1 1 40 PRO HB2 H -2.232 20.122 9.340 1.00 . A A . 40 PRO HB2 1 1 9 5692 1 1 40 PRO HB3 H -1.005 19.970 10.603 1.00 . A A . 40 PRO HB3 1 1 9 5693 1 1 40 PRO HD2 H 0.442 17.321 8.175 1.00 . A A . 40 PRO HD2 1 1 9 5694 1 1 40 PRO HD3 H 1.045 18.007 9.698 1.00 . A A . 40 PRO HD3 1 1 9 5695 1 1 40 PRO HG2 H -0.872 19.160 7.724 1.00 . A A . 40 PRO HG2 1 1 9 5696 1 1 40 PRO HG3 H 0.353 19.973 8.715 1.00 . A A . 40 PRO HG3 1 1 9 5697 1 1 40 PRO N N -0.910 17.210 9.797 1.00 . A A . 40 PRO N 1 1 9 5698 1 1 40 PRO O O -3.462 18.368 8.224 1.00 . A A . 40 PRO O 1 1 9 5699 1 1 41 SER C C -6.221 17.828 8.917 1.00 . A A . 41 SER C 1 1 9 5700 1 1 41 SER CA C -5.362 16.597 9.193 1.00 . A A . 41 SER CA 1 1 9 5701 1 1 41 SER CB C -6.144 15.597 10.046 1.00 . A A . 41 SER CB 1 1 9 5702 1 1 41 SER H H -3.908 16.576 10.732 1.00 . A A . 41 SER H 1 1 9 5703 1 1 41 SER HA H -5.106 16.133 8.252 1.00 . A A . 41 SER HA 1 1 9 5704 1 1 41 SER HB2 H -5.470 14.840 10.417 1.00 . A A . 41 SER HB2 1 1 9 5705 1 1 41 SER HB3 H -6.596 16.115 10.880 1.00 . A A . 41 SER HB3 1 1 9 5706 1 1 41 SER HG H -6.926 14.979 8.360 1.00 . A A . 41 SER HG 1 1 9 5707 1 1 41 SER N N -4.120 16.971 9.860 1.00 . A A . 41 SER N 1 1 9 5708 1 1 41 SER O O -5.964 18.909 9.443 1.00 . A A . 41 SER O 1 1 9 5709 1 1 41 SER OG O -7.165 14.970 9.290 1.00 . A A . 41 SER OG 1 1 9 5710 1 1 42 GLY C C -8.562 18.732 6.300 1.00 . A A . 42 GLY C 1 1 9 5711 1 1 42 GLY CA C -8.126 18.756 7.752 1.00 . A A . 42 GLY CA 1 1 9 5712 1 1 42 GLY H H -7.401 16.768 7.695 1.00 . A A . 42 GLY H 1 1 9 5713 1 1 42 GLY HA2 H -9.002 18.705 8.381 1.00 . A A . 42 GLY HA2 1 1 9 5714 1 1 42 GLY HA3 H -7.610 19.685 7.945 1.00 . A A . 42 GLY HA3 1 1 9 5715 1 1 42 GLY N N -7.244 17.653 8.085 1.00 . A A . 42 GLY N 1 1 9 5716 1 1 42 GLY O O -7.920 18.118 5.447 1.00 . A A . 42 GLY O 1 1 9 5717 1 1 43 PRO C C -9.353 20.312 3.710 1.00 . A A . 43 PRO C 1 1 9 5718 1 1 43 PRO CA C -10.225 19.481 4.644 1.00 . A A . 43 PRO CA 1 1 9 5719 1 1 43 PRO CB C -11.587 20.152 4.843 1.00 . A A . 43 PRO CB 1 1 9 5720 1 1 43 PRO CD C -10.494 20.167 6.969 1.00 . A A . 43 PRO CD 1 1 9 5721 1 1 43 PRO CG C -11.439 20.945 6.095 1.00 . A A . 43 PRO CG 1 1 9 5722 1 1 43 PRO HA H -10.365 18.496 4.223 1.00 . A A . 43 PRO HA 1 1 9 5723 1 1 43 PRO HB2 H -11.805 20.787 3.995 1.00 . A A . 43 PRO HB2 1 1 9 5724 1 1 43 PRO HB3 H -12.353 19.398 4.942 1.00 . A A . 43 PRO HB3 1 1 9 5725 1 1 43 PRO HD2 H -9.880 20.838 7.551 1.00 . A A . 43 PRO HD2 1 1 9 5726 1 1 43 PRO HD3 H -11.043 19.498 7.615 1.00 . A A . 43 PRO HD3 1 1 9 5727 1 1 43 PRO HG2 H -11.026 21.916 5.868 1.00 . A A . 43 PRO HG2 1 1 9 5728 1 1 43 PRO HG3 H -12.399 21.047 6.580 1.00 . A A . 43 PRO HG3 1 1 9 5729 1 1 43 PRO N N -9.679 19.412 6.003 1.00 . A A . 43 PRO N 1 1 9 5730 1 1 43 PRO O O -9.586 21.507 3.526 1.00 . A A . 43 PRO O 1 1 9 5731 1 1 44 SER C C -7.114 19.473 1.005 1.00 . A A . 44 SER C 1 1 9 5732 1 1 44 SER CA C -7.438 20.354 2.207 1.00 . A A . 44 SER CA 1 1 9 5733 1 1 44 SER CB C -6.148 20.741 2.932 1.00 . A A . 44 SER CB 1 1 9 5734 1 1 44 SER H H -8.213 18.719 3.307 1.00 . A A . 44 SER H 1 1 9 5735 1 1 44 SER HA H -7.929 21.251 1.859 1.00 . A A . 44 SER HA 1 1 9 5736 1 1 44 SER HB2 H -6.371 20.957 3.966 1.00 . A A . 44 SER HB2 1 1 9 5737 1 1 44 SER HB3 H -5.448 19.920 2.879 1.00 . A A . 44 SER HB3 1 1 9 5738 1 1 44 SER HG H -6.241 22.446 1.972 1.00 . A A . 44 SER HG 1 1 9 5739 1 1 44 SER N N -8.348 19.672 3.120 1.00 . A A . 44 SER N 1 1 9 5740 1 1 44 SER O O -7.376 18.270 1.014 1.00 . A A . 44 SER O 1 1 9 5741 1 1 44 SER OG O -5.556 21.886 2.344 1.00 . A A . 44 SER OG 1 1 9 5742 1 1 45 SER C C -4.900 19.908 -1.850 1.00 . A A . 45 SER C 1 1 9 5743 1 1 45 SER CA C -6.185 19.353 -1.242 1.00 . A A . 45 SER CA 1 1 9 5744 1 1 45 SER CB C -7.322 19.432 -2.263 1.00 . A A . 45 SER CB 1 1 9 5745 1 1 45 SER H H -6.359 21.042 0.023 1.00 . A A . 45 SER H 1 1 9 5746 1 1 45 SER HA H -6.025 18.320 -0.973 1.00 . A A . 45 SER HA 1 1 9 5747 1 1 45 SER HB2 H -7.574 20.467 -2.438 1.00 . A A . 45 SER HB2 1 1 9 5748 1 1 45 SER HB3 H -7.001 18.978 -3.190 1.00 . A A . 45 SER HB3 1 1 9 5749 1 1 45 SER HG H -8.739 18.092 -2.440 1.00 . A A . 45 SER HG 1 1 9 5750 1 1 45 SER N N -6.542 20.081 -0.030 1.00 . A A . 45 SER N 1 1 9 5751 1 1 45 SER O O -4.456 21.000 -1.500 1.00 . A A . 45 SER O 1 1 9 5752 1 1 45 SER OG O -8.475 18.754 -1.797 1.00 . A A . 45 SER OG 1 1 9 5753 1 1 46 GLY C C -2.356 18.437 -4.097 1.00 . A A . 46 GLY C 1 1 9 5754 1 1 46 GLY CA C -3.080 19.576 -3.407 1.00 . A A . 46 GLY CA 1 1 9 5755 1 1 46 GLY H H -4.708 18.283 -3.004 1.00 . A A . 46 GLY H 1 1 9 5756 1 1 46 GLY HA2 H -3.316 20.334 -4.138 1.00 . A A . 46 GLY HA2 1 1 9 5757 1 1 46 GLY HA3 H -2.427 20.002 -2.660 1.00 . A A . 46 GLY HA3 1 1 9 5758 1 1 46 GLY N N -4.308 19.145 -2.764 1.00 . A A . 46 GLY N 1 1 9 5759 1 1 46 GLY O O -2.537 17.286 -3.702 1.00 . A A . 46 GLY O 1 1 9 5760 2 2 1 ZN ZN ZN -0.053 4.528 -0.855 1.00 . B A . 201 ZN ZN 1 1 10 5761 1 1 1 GLY C C -8.476 10.540 -25.518 1.00 . A A . 1 GLY C 1 1 10 5762 1 1 1 GLY CA C -8.769 11.939 -25.014 1.00 . A A . 1 GLY CA 1 1 10 5763 1 1 1 GLY H1 H -8.355 12.695 -26.948 1.00 . A A . 1 GLY H1 1 1 10 5764 1 1 1 GLY HA2 H -8.038 12.200 -24.262 1.00 . A A . 1 GLY HA2 1 1 10 5765 1 1 1 GLY HA3 H -9.751 11.949 -24.565 1.00 . A A . 1 GLY HA3 1 1 10 5766 1 1 1 GLY N N -8.728 12.931 -26.072 1.00 . A A . 1 GLY N 1 1 10 5767 1 1 1 GLY O O -7.462 10.310 -26.177 1.00 . A A . 1 GLY O 1 1 10 5768 1 1 2 SER C C -7.939 7.611 -25.010 1.00 . A A . 2 SER C 1 1 10 5769 1 1 2 SER CA C -9.195 8.217 -25.629 1.00 . A A . 2 SER CA 1 1 10 5770 1 1 2 SER CB C -9.116 8.132 -27.155 1.00 . A A . 2 SER CB 1 1 10 5771 1 1 2 SER H H -10.154 9.848 -24.680 1.00 . A A . 2 SER H 1 1 10 5772 1 1 2 SER HA H -10.054 7.659 -25.290 1.00 . A A . 2 SER HA 1 1 10 5773 1 1 2 SER HB2 H -9.996 8.586 -27.584 1.00 . A A . 2 SER HB2 1 1 10 5774 1 1 2 SER HB3 H -8.237 8.659 -27.497 1.00 . A A . 2 SER HB3 1 1 10 5775 1 1 2 SER HG H -8.644 6.249 -26.896 1.00 . A A . 2 SER HG 1 1 10 5776 1 1 2 SER N N -9.365 9.602 -25.208 1.00 . A A . 2 SER N 1 1 10 5777 1 1 2 SER O O -7.189 6.896 -25.673 1.00 . A A . 2 SER O 1 1 10 5778 1 1 2 SER OG O -9.039 6.785 -27.587 1.00 . A A . 2 SER OG 1 1 10 5779 1 1 3 SER C C -6.914 6.165 -22.193 1.00 . A A . 3 SER C 1 1 10 5780 1 1 3 SER CA C -6.550 7.393 -23.022 1.00 . A A . 3 SER CA 1 1 10 5781 1 1 3 SER CB C -5.961 8.477 -22.118 1.00 . A A . 3 SER CB 1 1 10 5782 1 1 3 SER H H -8.351 8.481 -23.257 1.00 . A A . 3 SER H 1 1 10 5783 1 1 3 SER HA H -5.812 7.109 -23.758 1.00 . A A . 3 SER HA 1 1 10 5784 1 1 3 SER HB2 H -5.857 9.393 -22.679 1.00 . A A . 3 SER HB2 1 1 10 5785 1 1 3 SER HB3 H -6.623 8.641 -21.280 1.00 . A A . 3 SER HB3 1 1 10 5786 1 1 3 SER HG H -4.205 8.876 -21.346 1.00 . A A . 3 SER HG 1 1 10 5787 1 1 3 SER N N -7.717 7.904 -23.732 1.00 . A A . 3 SER N 1 1 10 5788 1 1 3 SER O O -7.738 6.239 -21.282 1.00 . A A . 3 SER O 1 1 10 5789 1 1 3 SER OG O -4.688 8.095 -21.627 1.00 . A A . 3 SER OG 1 1 10 5790 1 1 4 GLY C C -5.300 3.131 -21.303 1.00 . A A . 4 GLY C 1 1 10 5791 1 1 4 GLY CA C -6.565 3.806 -21.793 1.00 . A A . 4 GLY CA 1 1 10 5792 1 1 4 GLY H H -5.647 5.034 -23.253 1.00 . A A . 4 GLY H 1 1 10 5793 1 1 4 GLY HA2 H -7.193 4.032 -20.944 1.00 . A A . 4 GLY HA2 1 1 10 5794 1 1 4 GLY HA3 H -7.092 3.126 -22.447 1.00 . A A . 4 GLY HA3 1 1 10 5795 1 1 4 GLY N N -6.294 5.034 -22.517 1.00 . A A . 4 GLY N 1 1 10 5796 1 1 4 GLY O O -4.956 3.224 -20.124 1.00 . A A . 4 GLY O 1 1 10 5797 1 1 5 SER C C -3.497 1.082 -20.492 1.00 . A A . 5 SER C 1 1 10 5798 1 1 5 SER CA C -3.375 1.749 -21.859 1.00 . A A . 5 SER CA 1 1 10 5799 1 1 5 SER CB C -2.194 2.721 -21.861 1.00 . A A . 5 SER CB 1 1 10 5800 1 1 5 SER H H -4.933 2.410 -23.131 1.00 . A A . 5 SER H 1 1 10 5801 1 1 5 SER HA H -3.204 0.987 -22.604 1.00 . A A . 5 SER HA 1 1 10 5802 1 1 5 SER HB2 H -1.276 2.169 -21.729 1.00 . A A . 5 SER HB2 1 1 10 5803 1 1 5 SER HB3 H -2.165 3.246 -22.805 1.00 . A A . 5 SER HB3 1 1 10 5804 1 1 5 SER HG H -2.412 4.548 -21.188 1.00 . A A . 5 SER HG 1 1 10 5805 1 1 5 SER N N -4.606 2.447 -22.208 1.00 . A A . 5 SER N 1 1 10 5806 1 1 5 SER O O -2.576 1.140 -19.677 1.00 . A A . 5 SER O 1 1 10 5807 1 1 5 SER OG O -2.312 3.669 -20.815 1.00 . A A . 5 SER OG 1 1 10 5808 1 1 6 SER C C -5.668 -1.517 -19.194 1.00 . A A . 6 SER C 1 1 10 5809 1 1 6 SER CA C -4.885 -0.226 -18.980 1.00 . A A . 6 SER CA 1 1 10 5810 1 1 6 SER CB C -5.650 0.696 -18.028 1.00 . A A . 6 SER CB 1 1 10 5811 1 1 6 SER H H -5.336 0.438 -20.939 1.00 . A A . 6 SER H 1 1 10 5812 1 1 6 SER HA H -3.928 -0.467 -18.543 1.00 . A A . 6 SER HA 1 1 10 5813 1 1 6 SER HB2 H -6.587 0.980 -18.481 1.00 . A A . 6 SER HB2 1 1 10 5814 1 1 6 SER HB3 H -5.841 0.173 -17.102 1.00 . A A . 6 SER HB3 1 1 10 5815 1 1 6 SER HG H -3.968 1.683 -17.841 1.00 . A A . 6 SER HG 1 1 10 5816 1 1 6 SER N N -4.640 0.449 -20.249 1.00 . A A . 6 SER N 1 1 10 5817 1 1 6 SER O O -6.548 -1.588 -20.051 1.00 . A A . 6 SER O 1 1 10 5818 1 1 6 SER OG O -4.905 1.868 -17.745 1.00 . A A . 6 SER OG 1 1 10 5819 1 1 7 GLY C C -5.825 -4.692 -17.306 1.00 . A A . 7 GLY C 1 1 10 5820 1 1 7 GLY CA C -6.022 -3.814 -18.526 1.00 . A A . 7 GLY CA 1 1 10 5821 1 1 7 GLY H H -4.631 -2.424 -17.741 1.00 . A A . 7 GLY H 1 1 10 5822 1 1 7 GLY HA2 H -7.078 -3.635 -18.661 1.00 . A A . 7 GLY HA2 1 1 10 5823 1 1 7 GLY HA3 H -5.641 -4.333 -19.393 1.00 . A A . 7 GLY HA3 1 1 10 5824 1 1 7 GLY N N -5.341 -2.538 -18.408 1.00 . A A . 7 GLY N 1 1 10 5825 1 1 7 GLY O O -5.579 -4.195 -16.206 1.00 . A A . 7 GLY O 1 1 10 5826 1 1 8 THR C C -4.601 -6.561 -15.509 1.00 . A A . 8 THR C 1 1 10 5827 1 1 8 THR CA C -5.771 -6.952 -16.404 1.00 . A A . 8 THR CA 1 1 10 5828 1 1 8 THR CB C -5.545 -8.382 -16.930 1.00 . A A . 8 THR CB 1 1 10 5829 1 1 8 THR CG2 C -6.769 -8.880 -17.685 1.00 . A A . 8 THR CG2 1 1 10 5830 1 1 8 THR H H -6.133 -6.338 -18.397 1.00 . A A . 8 THR H 1 1 10 5831 1 1 8 THR HA H -6.678 -6.945 -15.817 1.00 . A A . 8 THR HA 1 1 10 5832 1 1 8 THR HB H -5.369 -9.035 -16.088 1.00 . A A . 8 THR HB 1 1 10 5833 1 1 8 THR HG1 H -4.630 -8.025 -18.640 1.00 . A A . 8 THR HG1 1 1 10 5834 1 1 8 THR HG21 H -7.025 -9.870 -17.339 1.00 . A A . 8 THR HG21 1 1 10 5835 1 1 8 THR HG22 H -6.551 -8.913 -18.742 1.00 . A A . 8 THR HG22 1 1 10 5836 1 1 8 THR HG23 H -7.598 -8.211 -17.508 1.00 . A A . 8 THR HG23 1 1 10 5837 1 1 8 THR N N -5.936 -6.003 -17.498 1.00 . A A . 8 THR N 1 1 10 5838 1 1 8 THR O O -3.443 -6.628 -15.920 1.00 . A A . 8 THR O 1 1 10 5839 1 1 8 THR OG1 O -4.402 -8.412 -17.792 1.00 . A A . 8 THR OG1 1 1 10 5840 1 1 9 GLY C C -4.398 -5.585 -11.936 1.00 . A A . 9 GLY C 1 1 10 5841 1 1 9 GLY CA C -3.872 -5.759 -13.347 1.00 . A A . 9 GLY CA 1 1 10 5842 1 1 9 GLY H H -5.851 -6.121 -14.009 1.00 . A A . 9 GLY H 1 1 10 5843 1 1 9 GLY HA2 H -3.101 -6.515 -13.342 1.00 . A A . 9 GLY HA2 1 1 10 5844 1 1 9 GLY HA3 H -3.444 -4.824 -13.677 1.00 . A A . 9 GLY HA3 1 1 10 5845 1 1 9 GLY N N -4.910 -6.154 -14.281 1.00 . A A . 9 GLY N 1 1 10 5846 1 1 9 GLY O O -4.193 -4.543 -11.315 1.00 . A A . 9 GLY O 1 1 10 5847 1 1 10 GLU C C -4.749 -7.315 -9.099 1.00 . A A . 10 GLU C 1 1 10 5848 1 1 10 GLU CA C -5.639 -6.562 -10.084 1.00 . A A . 10 GLU CA 1 1 10 5849 1 1 10 GLU CB C -7.049 -7.156 -10.072 1.00 . A A . 10 GLU CB 1 1 10 5850 1 1 10 GLU CD C -8.024 -5.537 -8.397 1.00 . A A . 10 GLU CD 1 1 10 5851 1 1 10 GLU CG C -7.768 -6.991 -8.744 1.00 . A A . 10 GLU CG 1 1 10 5852 1 1 10 GLU H H -5.211 -7.412 -11.975 1.00 . A A . 10 GLU H 1 1 10 5853 1 1 10 GLU HA H -5.692 -5.526 -9.783 1.00 . A A . 10 GLU HA 1 1 10 5854 1 1 10 GLU HB2 H -7.636 -6.674 -10.839 1.00 . A A . 10 GLU HB2 1 1 10 5855 1 1 10 GLU HB3 H -6.983 -8.212 -10.293 1.00 . A A . 10 GLU HB3 1 1 10 5856 1 1 10 GLU HG2 H -8.716 -7.505 -8.796 1.00 . A A . 10 GLU HG2 1 1 10 5857 1 1 10 GLU HG3 H -7.164 -7.431 -7.965 1.00 . A A . 10 GLU HG3 1 1 10 5858 1 1 10 GLU N N -5.080 -6.608 -11.430 1.00 . A A . 10 GLU N 1 1 10 5859 1 1 10 GLU O O -4.697 -8.545 -9.106 1.00 . A A . 10 GLU O 1 1 10 5860 1 1 10 GLU OE1 O -8.419 -4.771 -9.300 1.00 . A A . 10 GLU OE1 1 1 10 5861 1 1 10 GLU OE2 O -7.830 -5.166 -7.220 1.00 . A A . 10 GLU OE2 1 1 10 5862 1 1 11 LYS C C -3.928 -7.527 -5.993 1.00 . A A . 11 LYS C 1 1 10 5863 1 1 11 LYS CA C -3.162 -7.162 -7.260 1.00 . A A . 11 LYS CA 1 1 10 5864 1 1 11 LYS CB C -2.024 -6.196 -6.920 1.00 . A A . 11 LYS CB 1 1 10 5865 1 1 11 LYS CD C -0.452 -7.216 -8.593 1.00 . A A . 11 LYS CD 1 1 10 5866 1 1 11 LYS CE C 0.675 -6.931 -9.575 1.00 . A A . 11 LYS CE 1 1 10 5867 1 1 11 LYS CG C -1.083 -5.931 -8.082 1.00 . A A . 11 LYS CG 1 1 10 5868 1 1 11 LYS H H -4.133 -5.591 -8.295 1.00 . A A . 11 LYS H 1 1 10 5869 1 1 11 LYS HA H -2.744 -8.062 -7.685 1.00 . A A . 11 LYS HA 1 1 10 5870 1 1 11 LYS HB2 H -2.449 -5.254 -6.606 1.00 . A A . 11 LYS HB2 1 1 10 5871 1 1 11 LYS HB3 H -1.448 -6.611 -6.105 1.00 . A A . 11 LYS HB3 1 1 10 5872 1 1 11 LYS HD2 H -0.053 -7.768 -7.755 1.00 . A A . 11 LYS HD2 1 1 10 5873 1 1 11 LYS HD3 H -1.209 -7.807 -9.088 1.00 . A A . 11 LYS HD3 1 1 10 5874 1 1 11 LYS HE2 H 0.369 -6.131 -10.230 1.00 . A A . 11 LYS HE2 1 1 10 5875 1 1 11 LYS HE3 H 1.550 -6.628 -9.020 1.00 . A A . 11 LYS HE3 1 1 10 5876 1 1 11 LYS HG2 H -1.639 -5.472 -8.886 1.00 . A A . 11 LYS HG2 1 1 10 5877 1 1 11 LYS HG3 H -0.300 -5.262 -7.755 1.00 . A A . 11 LYS HG3 1 1 10 5878 1 1 11 LYS HZ1 H 1.780 -7.903 -11.058 1.00 . A A . 11 LYS HZ1 1 1 10 5879 1 1 11 LYS HZ2 H 0.178 -8.434 -10.938 1.00 . A A . 11 LYS HZ2 1 1 10 5880 1 1 11 LYS HZ3 H 1.315 -8.909 -9.780 1.00 . A A . 11 LYS HZ3 1 1 10 5881 1 1 11 LYS N N -4.049 -6.567 -8.252 1.00 . A A . 11 LYS N 1 1 10 5882 1 1 11 LYS NZ N 1.011 -8.128 -10.395 1.00 . A A . 11 LYS NZ 1 1 10 5883 1 1 11 LYS O O -4.942 -6.915 -5.654 1.00 . A A . 11 LYS O 1 1 10 5884 1 1 12 PRO C C -3.906 -8.012 -2.895 1.00 . A A . 12 PRO C 1 1 10 5885 1 1 12 PRO CA C -4.058 -9.015 -4.033 1.00 . A A . 12 PRO CA 1 1 10 5886 1 1 12 PRO CB C -3.294 -10.303 -3.716 1.00 . A A . 12 PRO CB 1 1 10 5887 1 1 12 PRO CD C -2.231 -9.322 -5.620 1.00 . A A . 12 PRO CD 1 1 10 5888 1 1 12 PRO CG C -1.971 -10.131 -4.380 1.00 . A A . 12 PRO CG 1 1 10 5889 1 1 12 PRO HA H -5.105 -9.241 -4.175 1.00 . A A . 12 PRO HA 1 1 10 5890 1 1 12 PRO HB2 H -3.189 -10.408 -2.646 1.00 . A A . 12 PRO HB2 1 1 10 5891 1 1 12 PRO HB3 H -3.829 -11.151 -4.117 1.00 . A A . 12 PRO HB3 1 1 10 5892 1 1 12 PRO HD2 H -1.397 -8.667 -5.826 1.00 . A A . 12 PRO HD2 1 1 10 5893 1 1 12 PRO HD3 H -2.420 -9.972 -6.462 1.00 . A A . 12 PRO HD3 1 1 10 5894 1 1 12 PRO HG2 H -1.296 -9.604 -3.723 1.00 . A A . 12 PRO HG2 1 1 10 5895 1 1 12 PRO HG3 H -1.564 -11.097 -4.641 1.00 . A A . 12 PRO HG3 1 1 10 5896 1 1 12 PRO N N -3.435 -8.547 -5.275 1.00 . A A . 12 PRO N 1 1 10 5897 1 1 12 PRO O O -4.729 -7.966 -1.981 1.00 . A A . 12 PRO O 1 1 10 5898 1 1 13 TYR C C -2.794 -4.799 -2.479 1.00 . A A . 13 TYR C 1 1 10 5899 1 1 13 TYR CA C -2.589 -6.207 -1.930 1.00 . A A . 13 TYR CA 1 1 10 5900 1 1 13 TYR CB C -1.165 -6.356 -1.393 1.00 . A A . 13 TYR CB 1 1 10 5901 1 1 13 TYR CD1 C -1.192 -8.259 0.266 1.00 . A A . 13 TYR CD1 1 1 10 5902 1 1 13 TYR CD2 C -0.115 -8.611 -1.830 1.00 . A A . 13 TYR CD2 1 1 10 5903 1 1 13 TYR CE1 C -0.877 -9.548 0.650 1.00 . A A . 13 TYR CE1 1 1 10 5904 1 1 13 TYR CE2 C 0.203 -9.902 -1.456 1.00 . A A . 13 TYR CE2 1 1 10 5905 1 1 13 TYR CG C -0.818 -7.768 -0.978 1.00 . A A . 13 TYR CG 1 1 10 5906 1 1 13 TYR CZ C -0.180 -10.366 -0.214 1.00 . A A . 13 TYR CZ 1 1 10 5907 1 1 13 TYR H H -2.229 -7.293 -3.711 1.00 . A A . 13 TYR H 1 1 10 5908 1 1 13 TYR HA H -3.287 -6.372 -1.122 1.00 . A A . 13 TYR HA 1 1 10 5909 1 1 13 TYR HB2 H -0.466 -6.055 -2.158 1.00 . A A . 13 TYR HB2 1 1 10 5910 1 1 13 TYR HB3 H -1.044 -5.717 -0.530 1.00 . A A . 13 TYR HB3 1 1 10 5911 1 1 13 TYR HD1 H -1.739 -7.616 0.942 1.00 . A A . 13 TYR HD1 1 1 10 5912 1 1 13 TYR HD2 H 0.184 -8.244 -2.801 1.00 . A A . 13 TYR HD2 1 1 10 5913 1 1 13 TYR HE1 H -1.177 -9.912 1.622 1.00 . A A . 13 TYR HE1 1 1 10 5914 1 1 13 TYR HE2 H 0.750 -10.542 -2.132 1.00 . A A . 13 TYR HE2 1 1 10 5915 1 1 13 TYR HH H 0.501 -12.124 -0.589 1.00 . A A . 13 TYR HH 1 1 10 5916 1 1 13 TYR N N -2.850 -7.209 -2.957 1.00 . A A . 13 TYR N 1 1 10 5917 1 1 13 TYR O O -2.331 -4.473 -3.572 1.00 . A A . 13 TYR O 1 1 10 5918 1 1 13 TYR OH O 0.136 -11.651 0.163 1.00 . A A . 13 TYR OH 1 1 10 5919 1 1 14 ARG C C -3.496 -1.624 -0.969 1.00 . A A . 14 ARG C 1 1 10 5920 1 1 14 ARG CA C -3.757 -2.593 -2.118 1.00 . A A . 14 ARG CA 1 1 10 5921 1 1 14 ARG CB C -5.203 -2.453 -2.599 1.00 . A A . 14 ARG CB 1 1 10 5922 1 1 14 ARG CD C -6.844 -0.864 -3.645 1.00 . A A . 14 ARG CD 1 1 10 5923 1 1 14 ARG CG C -5.401 -1.343 -3.618 1.00 . A A . 14 ARG CG 1 1 10 5924 1 1 14 ARG CZ C -8.237 -2.779 -4.305 1.00 . A A . 14 ARG CZ 1 1 10 5925 1 1 14 ARG H H -3.833 -4.285 -0.849 1.00 . A A . 14 ARG H 1 1 10 5926 1 1 14 ARG HA H -3.091 -2.354 -2.934 1.00 . A A . 14 ARG HA 1 1 10 5927 1 1 14 ARG HB2 H -5.512 -3.385 -3.050 1.00 . A A . 14 ARG HB2 1 1 10 5928 1 1 14 ARG HB3 H -5.834 -2.248 -1.747 1.00 . A A . 14 ARG HB3 1 1 10 5929 1 1 14 ARG HD2 H -7.266 -0.976 -2.658 1.00 . A A . 14 ARG HD2 1 1 10 5930 1 1 14 ARG HD3 H -6.858 0.179 -3.926 1.00 . A A . 14 ARG HD3 1 1 10 5931 1 1 14 ARG HE H -7.768 -1.249 -5.494 1.00 . A A . 14 ARG HE 1 1 10 5932 1 1 14 ARG HG2 H -4.763 -0.511 -3.359 1.00 . A A . 14 ARG HG2 1 1 10 5933 1 1 14 ARG HG3 H -5.135 -1.713 -4.596 1.00 . A A . 14 ARG HG3 1 1 10 5934 1 1 14 ARG HH11 H -7.559 -2.836 -2.403 1.00 . A A . 14 ARG HH11 1 1 10 5935 1 1 14 ARG HH12 H -8.542 -4.180 -2.880 1.00 . A A . 14 ARG HH12 1 1 10 5936 1 1 14 ARG HH21 H -9.064 -3.013 -6.134 1.00 . A A . 14 ARG HH21 1 1 10 5937 1 1 14 ARG HH22 H -9.397 -4.280 -5.003 1.00 . A A . 14 ARG HH22 1 1 10 5938 1 1 14 ARG N N -3.490 -3.967 -1.711 1.00 . A A . 14 ARG N 1 1 10 5939 1 1 14 ARG NE N -7.654 -1.622 -4.595 1.00 . A A . 14 ARG NE 1 1 10 5940 1 1 14 ARG NH1 N -8.101 -3.309 -3.097 1.00 . A A . 14 ARG NH1 1 1 10 5941 1 1 14 ARG NH2 N -8.959 -3.409 -5.223 1.00 . A A . 14 ARG NH2 1 1 10 5942 1 1 14 ARG O O -3.546 -2.004 0.201 1.00 . A A . 14 ARG O 1 1 10 5943 1 1 15 CYS C C -4.237 1.334 0.136 1.00 . A A . 15 CYS C 1 1 10 5944 1 1 15 CYS CA C -2.945 0.653 -0.309 1.00 . A A . 15 CYS CA 1 1 10 5945 1 1 15 CYS CB C -1.972 1.695 -0.864 1.00 . A A . 15 CYS CB 1 1 10 5946 1 1 15 CYS H H -3.190 -0.128 -2.261 1.00 . A A . 15 CYS H 1 1 10 5947 1 1 15 CYS HA H -2.495 0.171 0.545 1.00 . A A . 15 CYS HA 1 1 10 5948 1 1 15 CYS HB2 H -1.177 1.188 -1.392 1.00 . A A . 15 CYS HB2 1 1 10 5949 1 1 15 CYS HB3 H -2.499 2.339 -1.551 1.00 . A A . 15 CYS HB3 1 1 10 5950 1 1 15 CYS N N -3.216 -0.371 -1.311 1.00 . A A . 15 CYS N 1 1 10 5951 1 1 15 CYS O O -5.001 1.835 -0.688 1.00 . A A . 15 CYS O 1 1 10 5952 1 1 15 CYS SG S -1.204 2.748 0.409 1.00 . A A . 15 CYS SG 1 1 10 5953 1 1 16 ALA C C -5.440 3.451 2.274 1.00 . A A . 16 ALA C 1 1 10 5954 1 1 16 ALA CA C -5.669 1.969 1.998 1.00 . A A . 16 ALA CA 1 1 10 5955 1 1 16 ALA CB C -6.094 1.252 3.271 1.00 . A A . 16 ALA CB 1 1 10 5956 1 1 16 ALA H H -3.825 0.932 2.050 1.00 . A A . 16 ALA H 1 1 10 5957 1 1 16 ALA HA H -6.464 1.866 1.274 1.00 . A A . 16 ALA HA 1 1 10 5958 1 1 16 ALA HB1 H -6.902 1.795 3.737 1.00 . A A . 16 ALA HB1 1 1 10 5959 1 1 16 ALA HB2 H -6.425 0.253 3.027 1.00 . A A . 16 ALA HB2 1 1 10 5960 1 1 16 ALA HB3 H -5.256 1.198 3.950 1.00 . A A . 16 ALA HB3 1 1 10 5961 1 1 16 ALA N N -4.472 1.348 1.443 1.00 . A A . 16 ALA N 1 1 10 5962 1 1 16 ALA O O -6.092 4.038 3.137 1.00 . A A . 16 ALA O 1 1 10 5963 1 1 17 GLU C C -4.386 6.223 0.396 1.00 . A A . 17 GLU C 1 1 10 5964 1 1 17 GLU CA C -4.195 5.463 1.706 1.00 . A A . 17 GLU CA 1 1 10 5965 1 1 17 GLU CB C -2.757 5.633 2.201 1.00 . A A . 17 GLU CB 1 1 10 5966 1 1 17 GLU CD C -2.796 6.448 4.592 1.00 . A A . 17 GLU CD 1 1 10 5967 1 1 17 GLU CG C -2.571 5.270 3.665 1.00 . A A . 17 GLU CG 1 1 10 5968 1 1 17 GLU H H -4.023 3.528 0.865 1.00 . A A . 17 GLU H 1 1 10 5969 1 1 17 GLU HA H -4.871 5.867 2.444 1.00 . A A . 17 GLU HA 1 1 10 5970 1 1 17 GLU HB2 H -2.109 5.004 1.610 1.00 . A A . 17 GLU HB2 1 1 10 5971 1 1 17 GLU HB3 H -2.464 6.664 2.068 1.00 . A A . 17 GLU HB3 1 1 10 5972 1 1 17 GLU HG2 H -3.274 4.491 3.921 1.00 . A A . 17 GLU HG2 1 1 10 5973 1 1 17 GLU HG3 H -1.565 4.906 3.807 1.00 . A A . 17 GLU HG3 1 1 10 5974 1 1 17 GLU N N -4.510 4.049 1.537 1.00 . A A . 17 GLU N 1 1 10 5975 1 1 17 GLU O O -5.006 7.286 0.367 1.00 . A A . 17 GLU O 1 1 10 5976 1 1 17 GLU OE1 O -3.501 7.396 4.185 1.00 . A A . 17 GLU OE1 1 1 10 5977 1 1 17 GLU OE2 O -2.268 6.424 5.723 1.00 . A A . 17 GLU OE2 1 1 10 5978 1 1 18 CYS C C -4.728 5.396 -2.965 1.00 . A A . 18 CYS C 1 1 10 5979 1 1 18 CYS CA C -3.959 6.292 -1.999 1.00 . A A . 18 CYS CA 1 1 10 5980 1 1 18 CYS CB C -2.568 6.591 -2.562 1.00 . A A . 18 CYS CB 1 1 10 5981 1 1 18 CYS H H -3.367 4.819 -0.600 1.00 . A A . 18 CYS H 1 1 10 5982 1 1 18 CYS HA H -4.497 7.220 -1.882 1.00 . A A . 18 CYS HA 1 1 10 5983 1 1 18 CYS HB2 H -2.669 6.960 -3.573 1.00 . A A . 18 CYS HB2 1 1 10 5984 1 1 18 CYS HB3 H -2.097 7.349 -1.954 1.00 . A A . 18 CYS HB3 1 1 10 5985 1 1 18 CYS N N -3.849 5.669 -0.686 1.00 . A A . 18 CYS N 1 1 10 5986 1 1 18 CYS O O -5.655 5.843 -3.639 1.00 . A A . 18 CYS O 1 1 10 5987 1 1 18 CYS SG S -1.458 5.147 -2.609 1.00 . A A . 18 CYS SG 1 1 10 5988 1 1 19 GLY C C -4.041 2.534 -4.886 1.00 . A A . 19 GLY C 1 1 10 5989 1 1 19 GLY CA C -5.000 3.187 -3.910 1.00 . A A . 19 GLY CA 1 1 10 5990 1 1 19 GLY H H -3.592 3.826 -2.464 1.00 . A A . 19 GLY H 1 1 10 5991 1 1 19 GLY HA2 H -5.470 2.419 -3.315 1.00 . A A . 19 GLY HA2 1 1 10 5992 1 1 19 GLY HA3 H -5.761 3.712 -4.469 1.00 . A A . 19 GLY HA3 1 1 10 5993 1 1 19 GLY N N -4.337 4.126 -3.025 1.00 . A A . 19 GLY N 1 1 10 5994 1 1 19 GLY O O -4.354 2.381 -6.067 1.00 . A A . 19 GLY O 1 1 10 5995 1 1 20 LYS C C -2.002 -0.008 -5.188 1.00 . A A . 20 LYS C 1 1 10 5996 1 1 20 LYS CA C -1.860 1.510 -5.229 1.00 . A A . 20 LYS CA 1 1 10 5997 1 1 20 LYS CB C -0.457 1.914 -4.771 1.00 . A A . 20 LYS CB 1 1 10 5998 1 1 20 LYS CD C 1.531 3.412 -5.111 1.00 . A A . 20 LYS CD 1 1 10 5999 1 1 20 LYS CE C 2.471 2.640 -6.023 1.00 . A A . 20 LYS CE 1 1 10 6000 1 1 20 LYS CG C 0.075 3.156 -5.465 1.00 . A A . 20 LYS CG 1 1 10 6001 1 1 20 LYS H H -2.678 2.299 -3.443 1.00 . A A . 20 LYS H 1 1 10 6002 1 1 20 LYS HA H -2.009 1.845 -6.244 1.00 . A A . 20 LYS HA 1 1 10 6003 1 1 20 LYS HB2 H -0.479 2.104 -3.708 1.00 . A A . 20 LYS HB2 1 1 10 6004 1 1 20 LYS HB3 H 0.222 1.098 -4.968 1.00 . A A . 20 LYS HB3 1 1 10 6005 1 1 20 LYS HD2 H 1.736 4.467 -5.211 1.00 . A A . 20 LYS HD2 1 1 10 6006 1 1 20 LYS HD3 H 1.702 3.106 -4.089 1.00 . A A . 20 LYS HD3 1 1 10 6007 1 1 20 LYS HE2 H 3.402 2.476 -5.503 1.00 . A A . 20 LYS HE2 1 1 10 6008 1 1 20 LYS HE3 H 2.019 1.688 -6.261 1.00 . A A . 20 LYS HE3 1 1 10 6009 1 1 20 LYS HG2 H -0.005 3.022 -6.534 1.00 . A A . 20 LYS HG2 1 1 10 6010 1 1 20 LYS HG3 H -0.515 4.008 -5.162 1.00 . A A . 20 LYS HG3 1 1 10 6011 1 1 20 LYS HZ1 H 2.496 4.379 -7.179 1.00 . A A . 20 LYS HZ1 1 1 10 6012 1 1 20 LYS HZ2 H 2.185 2.972 -8.065 1.00 . A A . 20 LYS HZ2 1 1 10 6013 1 1 20 LYS HZ3 H 3.754 3.305 -7.531 1.00 . A A . 20 LYS HZ3 1 1 10 6014 1 1 20 LYS N N -2.869 2.149 -4.393 1.00 . A A . 20 LYS N 1 1 10 6015 1 1 20 LYS NZ N 2.746 3.376 -7.288 1.00 . A A . 20 LYS NZ 1 1 10 6016 1 1 20 LYS O O -2.580 -0.562 -4.253 1.00 . A A . 20 LYS O 1 1 10 6017 1 1 21 ALA C C -0.190 -2.759 -5.928 1.00 . A A . 21 ALA C 1 1 10 6018 1 1 21 ALA CA C -1.533 -2.130 -6.283 1.00 . A A . 21 ALA CA 1 1 10 6019 1 1 21 ALA CB C -1.971 -2.566 -7.674 1.00 . A A . 21 ALA CB 1 1 10 6020 1 1 21 ALA H H -1.021 -0.179 -6.921 1.00 . A A . 21 ALA H 1 1 10 6021 1 1 21 ALA HA H -2.276 -2.469 -5.576 1.00 . A A . 21 ALA HA 1 1 10 6022 1 1 21 ALA HB1 H -1.850 -3.634 -7.770 1.00 . A A . 21 ALA HB1 1 1 10 6023 1 1 21 ALA HB2 H -3.010 -2.306 -7.821 1.00 . A A . 21 ALA HB2 1 1 10 6024 1 1 21 ALA HB3 H -1.366 -2.066 -8.415 1.00 . A A . 21 ALA HB3 1 1 10 6025 1 1 21 ALA N N -1.469 -0.676 -6.206 1.00 . A A . 21 ALA N 1 1 10 6026 1 1 21 ALA O O 0.864 -2.260 -6.323 1.00 . A A . 21 ALA O 1 1 10 6027 1 1 22 PHE C C 0.787 -6.065 -4.833 1.00 . A A . 22 PHE C 1 1 10 6028 1 1 22 PHE CA C 0.979 -4.552 -4.771 1.00 . A A . 22 PHE CA 1 1 10 6029 1 1 22 PHE CB C 1.378 -4.135 -3.354 1.00 . A A . 22 PHE CB 1 1 10 6030 1 1 22 PHE CD1 C 0.798 -1.701 -3.164 1.00 . A A . 22 PHE CD1 1 1 10 6031 1 1 22 PHE CD2 C 3.101 -2.316 -3.214 1.00 . A A . 22 PHE CD2 1 1 10 6032 1 1 22 PHE CE1 C 1.153 -0.370 -3.061 1.00 . A A . 22 PHE CE1 1 1 10 6033 1 1 22 PHE CE2 C 3.463 -0.986 -3.112 1.00 . A A . 22 PHE CE2 1 1 10 6034 1 1 22 PHE CG C 1.767 -2.689 -3.242 1.00 . A A . 22 PHE CG 1 1 10 6035 1 1 22 PHE CZ C 2.487 -0.012 -3.034 1.00 . A A . 22 PHE CZ 1 1 10 6036 1 1 22 PHE H H -1.106 -4.206 -4.897 1.00 . A A . 22 PHE H 1 1 10 6037 1 1 22 PHE HA H 1.767 -4.274 -5.454 1.00 . A A . 22 PHE HA 1 1 10 6038 1 1 22 PHE HB2 H 0.546 -4.307 -2.688 1.00 . A A . 22 PHE HB2 1 1 10 6039 1 1 22 PHE HB3 H 2.219 -4.732 -3.034 1.00 . A A . 22 PHE HB3 1 1 10 6040 1 1 22 PHE HD1 H -0.245 -1.980 -3.184 1.00 . A A . 22 PHE HD1 1 1 10 6041 1 1 22 PHE HD2 H 3.866 -3.078 -3.275 1.00 . A A . 22 PHE HD2 1 1 10 6042 1 1 22 PHE HE1 H 0.389 0.390 -3.000 1.00 . A A . 22 PHE HE1 1 1 10 6043 1 1 22 PHE HE2 H 4.506 -0.710 -3.091 1.00 . A A . 22 PHE HE2 1 1 10 6044 1 1 22 PHE HZ H 2.767 1.028 -2.955 1.00 . A A . 22 PHE HZ 1 1 10 6045 1 1 22 PHE N N -0.235 -3.856 -5.181 1.00 . A A . 22 PHE N 1 1 10 6046 1 1 22 PHE O O -0.187 -6.601 -4.302 1.00 . A A . 22 PHE O 1 1 10 6047 1 1 23 THR C C 2.190 -8.891 -4.370 1.00 . A A . 23 THR C 1 1 10 6048 1 1 23 THR CA C 1.655 -8.198 -5.618 1.00 . A A . 23 THR CA 1 1 10 6049 1 1 23 THR CB C 2.451 -8.687 -6.843 1.00 . A A . 23 THR CB 1 1 10 6050 1 1 23 THR CG2 C 3.929 -8.358 -6.694 1.00 . A A . 23 THR CG2 1 1 10 6051 1 1 23 THR H H 2.474 -6.265 -5.886 1.00 . A A . 23 THR H 1 1 10 6052 1 1 23 THR HA H 0.619 -8.473 -5.755 1.00 . A A . 23 THR HA 1 1 10 6053 1 1 23 THR HB H 2.073 -8.186 -7.723 1.00 . A A . 23 THR HB 1 1 10 6054 1 1 23 THR HG1 H 2.963 -10.437 -7.595 1.00 . A A . 23 THR HG1 1 1 10 6055 1 1 23 THR HG21 H 4.120 -7.373 -7.093 1.00 . A A . 23 THR HG21 1 1 10 6056 1 1 23 THR HG22 H 4.516 -9.085 -7.236 1.00 . A A . 23 THR HG22 1 1 10 6057 1 1 23 THR HG23 H 4.200 -8.383 -5.649 1.00 . A A . 23 THR HG23 1 1 10 6058 1 1 23 THR N N 1.722 -6.749 -5.485 1.00 . A A . 23 THR N 1 1 10 6059 1 1 23 THR O O 1.866 -10.048 -4.104 1.00 . A A . 23 THR O 1 1 10 6060 1 1 23 THR OG1 O 2.285 -10.100 -7.004 1.00 . A A . 23 THR OG1 1 1 10 6061 1 1 24 ASP C C 3.304 -7.809 -1.196 1.00 . A A . 24 ASP C 1 1 10 6062 1 1 24 ASP CA C 3.588 -8.721 -2.385 1.00 . A A . 24 ASP CA 1 1 10 6063 1 1 24 ASP CB C 5.096 -8.910 -2.550 1.00 . A A . 24 ASP CB 1 1 10 6064 1 1 24 ASP CG C 5.668 -9.898 -1.552 1.00 . A A . 24 ASP CG 1 1 10 6065 1 1 24 ASP H H 3.230 -7.258 -3.873 1.00 . A A . 24 ASP H 1 1 10 6066 1 1 24 ASP HA H 3.131 -9.682 -2.202 1.00 . A A . 24 ASP HA 1 1 10 6067 1 1 24 ASP HB2 H 5.300 -9.275 -3.546 1.00 . A A . 24 ASP HB2 1 1 10 6068 1 1 24 ASP HB3 H 5.590 -7.960 -2.412 1.00 . A A . 24 ASP HB3 1 1 10 6069 1 1 24 ASP N N 3.009 -8.175 -3.608 1.00 . A A . 24 ASP N 1 1 10 6070 1 1 24 ASP O O 3.309 -6.584 -1.325 1.00 . A A . 24 ASP O 1 1 10 6071 1 1 24 ASP OD1 O 5.599 -11.116 -1.818 1.00 . A A . 24 ASP OD1 1 1 10 6072 1 1 24 ASP OD2 O 6.184 -9.453 -0.505 1.00 . A A . 24 ASP OD2 1 1 10 6073 1 1 25 ARG C C 3.948 -6.763 1.549 1.00 . A A . 25 ARG C 1 1 10 6074 1 1 25 ARG CA C 2.769 -7.656 1.173 1.00 . A A . 25 ARG CA 1 1 10 6075 1 1 25 ARG CB C 2.446 -8.605 2.329 1.00 . A A . 25 ARG CB 1 1 10 6076 1 1 25 ARG CD C 1.094 -9.030 4.405 1.00 . A A . 25 ARG CD 1 1 10 6077 1 1 25 ARG CG C 1.533 -7.995 3.380 1.00 . A A . 25 ARG CG 1 1 10 6078 1 1 25 ARG CZ C 3.136 -9.865 5.490 1.00 . A A . 25 ARG CZ 1 1 10 6079 1 1 25 ARG H H 3.068 -9.393 0.001 1.00 . A A . 25 ARG H 1 1 10 6080 1 1 25 ARG HA H 1.909 -7.033 0.979 1.00 . A A . 25 ARG HA 1 1 10 6081 1 1 25 ARG HB2 H 1.963 -9.485 1.932 1.00 . A A . 25 ARG HB2 1 1 10 6082 1 1 25 ARG HB3 H 3.368 -8.895 2.809 1.00 . A A . 25 ARG HB3 1 1 10 6083 1 1 25 ARG HD2 H 0.124 -8.750 4.786 1.00 . A A . 25 ARG HD2 1 1 10 6084 1 1 25 ARG HD3 H 1.026 -9.991 3.918 1.00 . A A . 25 ARG HD3 1 1 10 6085 1 1 25 ARG HE H 1.827 -8.617 6.331 1.00 . A A . 25 ARG HE 1 1 10 6086 1 1 25 ARG HG2 H 2.063 -7.204 3.889 1.00 . A A . 25 ARG HG2 1 1 10 6087 1 1 25 ARG HG3 H 0.658 -7.590 2.893 1.00 . A A . 25 ARG HG3 1 1 10 6088 1 1 25 ARG HH11 H 2.836 -10.539 3.609 1.00 . A A . 25 ARG HH11 1 1 10 6089 1 1 25 ARG HH12 H 4.272 -11.120 4.385 1.00 . A A . 25 ARG HH12 1 1 10 6090 1 1 25 ARG HH21 H 3.714 -9.376 7.364 1.00 . A A . 25 ARG HH21 1 1 10 6091 1 1 25 ARG HH22 H 4.770 -10.458 6.521 1.00 . A A . 25 ARG HH22 1 1 10 6092 1 1 25 ARG N N 3.057 -8.413 -0.039 1.00 . A A . 25 ARG N 1 1 10 6093 1 1 25 ARG NE N 2.032 -9.127 5.520 1.00 . A A . 25 ARG NE 1 1 10 6094 1 1 25 ARG NH1 N 3.439 -10.566 4.406 1.00 . A A . 25 ARG NH1 1 1 10 6095 1 1 25 ARG NH2 N 3.940 -9.903 6.545 1.00 . A A . 25 ARG NH2 1 1 10 6096 1 1 25 ARG O O 3.801 -5.548 1.686 1.00 . A A . 25 ARG O 1 1 10 6097 1 1 26 SER C C 6.447 -5.360 1.250 1.00 . A A . 26 SER C 1 1 10 6098 1 1 26 SER CA C 6.320 -6.634 2.079 1.00 . A A . 26 SER CA 1 1 10 6099 1 1 26 SER CB C 7.560 -7.509 1.883 1.00 . A A . 26 SER CB 1 1 10 6100 1 1 26 SER H H 5.171 -8.344 1.591 1.00 . A A . 26 SER H 1 1 10 6101 1 1 26 SER HA H 6.241 -6.365 3.122 1.00 . A A . 26 SER HA 1 1 10 6102 1 1 26 SER HB2 H 7.443 -8.425 2.442 1.00 . A A . 26 SER HB2 1 1 10 6103 1 1 26 SER HB3 H 7.673 -7.739 0.833 1.00 . A A . 26 SER HB3 1 1 10 6104 1 1 26 SER HG H 9.505 -7.316 2.020 1.00 . A A . 26 SER HG 1 1 10 6105 1 1 26 SER N N 5.117 -7.373 1.715 1.00 . A A . 26 SER N 1 1 10 6106 1 1 26 SER O O 6.834 -4.310 1.761 1.00 . A A . 26 SER O 1 1 10 6107 1 1 26 SER OG O 8.729 -6.846 2.333 1.00 . A A . 26 SER OG 1 1 10 6108 1 1 27 ASN C C 5.222 -3.222 -0.509 1.00 . A A . 27 ASN C 1 1 10 6109 1 1 27 ASN CA C 6.195 -4.317 -0.935 1.00 . A A . 27 ASN CA 1 1 10 6110 1 1 27 ASN CB C 5.894 -4.752 -2.371 1.00 . A A . 27 ASN CB 1 1 10 6111 1 1 27 ASN CG C 6.894 -5.768 -2.889 1.00 . A A . 27 ASN CG 1 1 10 6112 1 1 27 ASN H H 5.816 -6.325 -0.383 1.00 . A A . 27 ASN H 1 1 10 6113 1 1 27 ASN HA H 7.200 -3.927 -0.889 1.00 . A A . 27 ASN HA 1 1 10 6114 1 1 27 ASN HB2 H 4.909 -5.194 -2.408 1.00 . A A . 27 ASN HB2 1 1 10 6115 1 1 27 ASN HB3 H 5.920 -3.886 -3.016 1.00 . A A . 27 ASN HB3 1 1 10 6116 1 1 27 ASN HD21 H 6.115 -5.640 -4.714 1.00 . A A . 27 ASN HD21 1 1 10 6117 1 1 27 ASN HD22 H 7.442 -6.733 -4.538 1.00 . A A . 27 ASN HD22 1 1 10 6118 1 1 27 ASN N N 6.118 -5.461 -0.034 1.00 . A A . 27 ASN N 1 1 10 6119 1 1 27 ASN ND2 N 6.808 -6.078 -4.177 1.00 . A A . 27 ASN ND2 1 1 10 6120 1 1 27 ASN O O 5.588 -2.049 -0.423 1.00 . A A . 27 ASN O 1 1 10 6121 1 1 27 ASN OD1 O 7.733 -6.267 -2.139 1.00 . A A . 27 ASN OD1 1 1 10 6122 1 1 28 LEU C C 3.348 -1.973 1.476 1.00 . A A . 28 LEU C 1 1 10 6123 1 1 28 LEU CA C 2.953 -2.665 0.176 1.00 . A A . 28 LEU CA 1 1 10 6124 1 1 28 LEU CB C 1.613 -3.380 0.352 1.00 . A A . 28 LEU CB 1 1 10 6125 1 1 28 LEU CD1 C 0.105 -1.389 0.139 1.00 . A A . 28 LEU CD1 1 1 10 6126 1 1 28 LEU CD2 C -0.706 -3.449 1.303 1.00 . A A . 28 LEU CD2 1 1 10 6127 1 1 28 LEU CG C 0.500 -2.567 1.015 1.00 . A A . 28 LEU CG 1 1 10 6128 1 1 28 LEU H H 3.748 -4.560 -0.329 1.00 . A A . 28 LEU H 1 1 10 6129 1 1 28 LEU HA H 2.855 -1.919 -0.599 1.00 . A A . 28 LEU HA 1 1 10 6130 1 1 28 LEU HB2 H 1.266 -3.678 -0.625 1.00 . A A . 28 LEU HB2 1 1 10 6131 1 1 28 LEU HB3 H 1.785 -4.260 0.955 1.00 . A A . 28 LEU HB3 1 1 10 6132 1 1 28 LEU HD11 H -0.103 -1.738 -0.861 1.00 . A A . 28 LEU HD11 1 1 10 6133 1 1 28 LEU HD12 H 0.914 -0.674 0.110 1.00 . A A . 28 LEU HD12 1 1 10 6134 1 1 28 LEU HD13 H -0.777 -0.917 0.547 1.00 . A A . 28 LEU HD13 1 1 10 6135 1 1 28 LEU HD21 H -1.019 -3.938 0.392 1.00 . A A . 28 LEU HD21 1 1 10 6136 1 1 28 LEU HD22 H -1.514 -2.841 1.681 1.00 . A A . 28 LEU HD22 1 1 10 6137 1 1 28 LEU HD23 H -0.440 -4.194 2.039 1.00 . A A . 28 LEU HD23 1 1 10 6138 1 1 28 LEU HG H 0.861 -2.176 1.957 1.00 . A A . 28 LEU HG 1 1 10 6139 1 1 28 LEU N N 3.980 -3.613 -0.243 1.00 . A A . 28 LEU N 1 1 10 6140 1 1 28 LEU O O 3.443 -0.747 1.536 1.00 . A A . 28 LEU O 1 1 10 6141 1 1 29 PHE C C 5.114 -1.235 3.675 1.00 . A A . 29 PHE C 1 1 10 6142 1 1 29 PHE CA C 3.966 -2.231 3.816 1.00 . A A . 29 PHE CA 1 1 10 6143 1 1 29 PHE CB C 4.374 -3.365 4.759 1.00 . A A . 29 PHE CB 1 1 10 6144 1 1 29 PHE CD1 C 2.111 -4.440 4.899 1.00 . A A . 29 PHE CD1 1 1 10 6145 1 1 29 PHE CD2 C 3.266 -3.962 6.929 1.00 . A A . 29 PHE CD2 1 1 10 6146 1 1 29 PHE CE1 C 1.055 -4.963 5.620 1.00 . A A . 29 PHE CE1 1 1 10 6147 1 1 29 PHE CE2 C 2.212 -4.484 7.656 1.00 . A A . 29 PHE CE2 1 1 10 6148 1 1 29 PHE CG C 3.228 -3.934 5.545 1.00 . A A . 29 PHE CG 1 1 10 6149 1 1 29 PHE CZ C 1.105 -4.986 7.000 1.00 . A A . 29 PHE CZ 1 1 10 6150 1 1 29 PHE H H 3.488 -3.737 2.407 1.00 . A A . 29 PHE H 1 1 10 6151 1 1 29 PHE HA H 3.111 -1.720 4.231 1.00 . A A . 29 PHE HA 1 1 10 6152 1 1 29 PHE HB2 H 4.808 -4.166 4.179 1.00 . A A . 29 PHE HB2 1 1 10 6153 1 1 29 PHE HB3 H 5.108 -2.995 5.459 1.00 . A A . 29 PHE HB3 1 1 10 6154 1 1 29 PHE HD1 H 2.071 -4.425 3.819 1.00 . A A . 29 PHE HD1 1 1 10 6155 1 1 29 PHE HD2 H 4.132 -3.569 7.444 1.00 . A A . 29 PHE HD2 1 1 10 6156 1 1 29 PHE HE1 H 0.191 -5.356 5.104 1.00 . A A . 29 PHE HE1 1 1 10 6157 1 1 29 PHE HE2 H 2.255 -4.500 8.735 1.00 . A A . 29 PHE HE2 1 1 10 6158 1 1 29 PHE HZ H 0.281 -5.393 7.565 1.00 . A A . 29 PHE HZ 1 1 10 6159 1 1 29 PHE N N 3.580 -2.767 2.516 1.00 . A A . 29 PHE N 1 1 10 6160 1 1 29 PHE O O 5.154 -0.214 4.363 1.00 . A A . 29 PHE O 1 1 10 6161 1 1 30 THR C C 6.766 0.658 1.938 1.00 . A A . 30 THR C 1 1 10 6162 1 1 30 THR CA C 7.195 -0.672 2.545 1.00 . A A . 30 THR CA 1 1 10 6163 1 1 30 THR CB C 8.224 -1.341 1.615 1.00 . A A . 30 THR CB 1 1 10 6164 1 1 30 THR CG2 C 9.441 -0.449 1.424 1.00 . A A . 30 THR CG2 1 1 10 6165 1 1 30 THR H H 5.958 -2.366 2.259 1.00 . A A . 30 THR H 1 1 10 6166 1 1 30 THR HA H 7.670 -0.486 3.498 1.00 . A A . 30 THR HA 1 1 10 6167 1 1 30 THR HB H 7.762 -1.506 0.652 1.00 . A A . 30 THR HB 1 1 10 6168 1 1 30 THR HG1 H 9.520 -2.808 1.860 1.00 . A A . 30 THR HG1 1 1 10 6169 1 1 30 THR HG21 H 10.084 -0.528 2.288 1.00 . A A . 30 THR HG21 1 1 10 6170 1 1 30 THR HG22 H 9.121 0.576 1.306 1.00 . A A . 30 THR HG22 1 1 10 6171 1 1 30 THR HG23 H 9.982 -0.761 0.543 1.00 . A A . 30 THR HG23 1 1 10 6172 1 1 30 THR N N 6.046 -1.539 2.777 1.00 . A A . 30 THR N 1 1 10 6173 1 1 30 THR O O 7.355 1.702 2.225 1.00 . A A . 30 THR O 1 1 10 6174 1 1 30 THR OG1 O 8.631 -2.601 2.159 1.00 . A A . 30 THR OG1 1 1 10 6175 1 1 31 HIS C C 4.407 2.656 1.426 1.00 . A A . 31 HIS C 1 1 10 6176 1 1 31 HIS CA C 5.229 1.820 0.449 1.00 . A A . 31 HIS CA 1 1 10 6177 1 1 31 HIS CB C 4.378 1.451 -0.766 1.00 . A A . 31 HIS CB 1 1 10 6178 1 1 31 HIS CD2 C 2.049 2.590 -0.693 1.00 . A A . 31 HIS CD2 1 1 10 6179 1 1 31 HIS CE1 C 2.467 4.260 -2.050 1.00 . A A . 31 HIS CE1 1 1 10 6180 1 1 31 HIS CG C 3.335 2.472 -1.099 1.00 . A A . 31 HIS CG 1 1 10 6181 1 1 31 HIS H H 5.310 -0.245 0.908 1.00 . A A . 31 HIS H 1 1 10 6182 1 1 31 HIS HA H 6.077 2.403 0.121 1.00 . A A . 31 HIS HA 1 1 10 6183 1 1 31 HIS HB2 H 5.021 1.340 -1.627 1.00 . A A . 31 HIS HB2 1 1 10 6184 1 1 31 HIS HB3 H 3.876 0.513 -0.574 1.00 . A A . 31 HIS HB3 1 1 10 6185 1 1 31 HIS HD1 H 4.409 3.726 -2.409 1.00 . A A . 31 HIS HD1 1 1 10 6186 1 1 31 HIS HD2 H 1.526 1.927 -0.018 1.00 . A A . 31 HIS HD2 1 1 10 6187 1 1 31 HIS HE1 H 2.353 5.153 -2.647 1.00 . A A . 31 HIS HE1 1 1 10 6188 1 1 31 HIS N N 5.738 0.616 1.097 1.00 . A A . 31 HIS N 1 1 10 6189 1 1 31 HIS ND1 N 3.566 3.533 -1.949 1.00 . A A . 31 HIS ND1 1 1 10 6190 1 1 31 HIS NE2 N 1.532 3.709 -1.298 1.00 . A A . 31 HIS NE2 1 1 10 6191 1 1 31 HIS O O 4.588 3.870 1.521 1.00 . A A . 31 HIS O 1 1 10 6192 1 1 32 GLN C C 3.457 3.697 3.923 1.00 . A A . 32 GLN C 1 1 10 6193 1 1 32 GLN CA C 2.655 2.683 3.114 1.00 . A A . 32 GLN CA 1 1 10 6194 1 1 32 GLN CB C 1.998 1.670 4.053 1.00 . A A . 32 GLN CB 1 1 10 6195 1 1 32 GLN CD C -0.171 0.475 4.555 1.00 . A A . 32 GLN CD 1 1 10 6196 1 1 32 GLN CG C 0.738 1.038 3.481 1.00 . A A . 32 GLN CG 1 1 10 6197 1 1 32 GLN H H 3.409 1.032 2.025 1.00 . A A . 32 GLN H 1 1 10 6198 1 1 32 GLN HA H 1.885 3.206 2.567 1.00 . A A . 32 GLN HA 1 1 10 6199 1 1 32 GLN HB2 H 2.705 0.882 4.266 1.00 . A A . 32 GLN HB2 1 1 10 6200 1 1 32 GLN HB3 H 1.737 2.168 4.975 1.00 . A A . 32 GLN HB3 1 1 10 6201 1 1 32 GLN HE21 H -1.428 -0.201 3.170 1.00 . A A . 32 GLN HE21 1 1 10 6202 1 1 32 GLN HE22 H -1.875 -0.517 4.808 1.00 . A A . 32 GLN HE22 1 1 10 6203 1 1 32 GLN HG2 H 0.194 1.789 2.927 1.00 . A A . 32 GLN HG2 1 1 10 6204 1 1 32 GLN HG3 H 1.024 0.238 2.815 1.00 . A A . 32 GLN HG3 1 1 10 6205 1 1 32 GLN N N 3.505 1.999 2.147 1.00 . A A . 32 GLN N 1 1 10 6206 1 1 32 GLN NE2 N -1.270 -0.143 4.136 1.00 . A A . 32 GLN NE2 1 1 10 6207 1 1 32 GLN O O 2.903 4.652 4.466 1.00 . A A . 32 GLN O 1 1 10 6208 1 1 32 GLN OE1 O 0.109 0.594 5.748 1.00 . A A . 32 GLN OE1 1 1 10 6209 1 1 33 LYS C C 5.436 5.827 4.311 1.00 . A A . 33 LYS C 1 1 10 6210 1 1 33 LYS CA C 5.647 4.378 4.740 1.00 . A A . 33 LYS CA 1 1 10 6211 1 1 33 LYS CB C 7.109 3.980 4.527 1.00 . A A . 33 LYS CB 1 1 10 6212 1 1 33 LYS CD C 8.982 2.684 5.586 1.00 . A A . 33 LYS CD 1 1 10 6213 1 1 33 LYS CE C 9.836 2.412 4.358 1.00 . A A . 33 LYS CE 1 1 10 6214 1 1 33 LYS CG C 7.502 2.699 5.243 1.00 . A A . 33 LYS CG 1 1 10 6215 1 1 33 LYS H H 5.151 2.704 3.543 1.00 . A A . 33 LYS H 1 1 10 6216 1 1 33 LYS HA H 5.407 4.287 5.788 1.00 . A A . 33 LYS HA 1 1 10 6217 1 1 33 LYS HB2 H 7.283 3.845 3.469 1.00 . A A . 33 LYS HB2 1 1 10 6218 1 1 33 LYS HB3 H 7.743 4.778 4.887 1.00 . A A . 33 LYS HB3 1 1 10 6219 1 1 33 LYS HD2 H 9.258 3.643 5.998 1.00 . A A . 33 LYS HD2 1 1 10 6220 1 1 33 LYS HD3 H 9.164 1.910 6.319 1.00 . A A . 33 LYS HD3 1 1 10 6221 1 1 33 LYS HE2 H 9.417 1.575 3.821 1.00 . A A . 33 LYS HE2 1 1 10 6222 1 1 33 LYS HE3 H 9.822 3.288 3.725 1.00 . A A . 33 LYS HE3 1 1 10 6223 1 1 33 LYS HG2 H 6.931 2.618 6.156 1.00 . A A . 33 LYS HG2 1 1 10 6224 1 1 33 LYS HG3 H 7.281 1.858 4.602 1.00 . A A . 33 LYS HG3 1 1 10 6225 1 1 33 LYS HZ1 H 11.283 1.237 5.301 1.00 . A A . 33 LYS HZ1 1 1 10 6226 1 1 33 LYS HZ2 H 11.659 2.886 5.261 1.00 . A A . 33 LYS HZ2 1 1 10 6227 1 1 33 LYS HZ3 H 11.812 1.949 3.861 1.00 . A A . 33 LYS HZ3 1 1 10 6228 1 1 33 LYS N N 4.767 3.483 3.998 1.00 . A A . 33 LYS N 1 1 10 6229 1 1 33 LYS NZ N 11.246 2.099 4.721 1.00 . A A . 33 LYS NZ 1 1 10 6230 1 1 33 LYS O O 5.414 6.733 5.145 1.00 . A A . 33 LYS O 1 1 10 6231 1 1 34 ILE C C 3.854 8.040 3.114 1.00 . A A . 34 ILE C 1 1 10 6232 1 1 34 ILE CA C 5.067 7.375 2.472 1.00 . A A . 34 ILE CA 1 1 10 6233 1 1 34 ILE CB C 4.872 7.344 0.944 1.00 . A A . 34 ILE CB 1 1 10 6234 1 1 34 ILE CD1 C 2.925 7.167 -0.685 1.00 . A A . 34 ILE CD1 1 1 10 6235 1 1 34 ILE CG1 C 3.555 6.652 0.590 1.00 . A A . 34 ILE CG1 1 1 10 6236 1 1 34 ILE CG2 C 6.043 6.641 0.275 1.00 . A A . 34 ILE CG2 1 1 10 6237 1 1 34 ILE H H 5.306 5.274 2.395 1.00 . A A . 34 ILE H 1 1 10 6238 1 1 34 ILE HA H 5.946 7.965 2.691 1.00 . A A . 34 ILE HA 1 1 10 6239 1 1 34 ILE HB H 4.843 8.362 0.587 1.00 . A A . 34 ILE HB 1 1 10 6240 1 1 34 ILE HD11 H 3.138 8.221 -0.791 1.00 . A A . 34 ILE HD11 1 1 10 6241 1 1 34 ILE HD12 H 3.332 6.632 -1.530 1.00 . A A . 34 ILE HD12 1 1 10 6242 1 1 34 ILE HD13 H 1.856 7.019 -0.645 1.00 . A A . 34 ILE HD13 1 1 10 6243 1 1 34 ILE HG12 H 3.732 5.595 0.468 1.00 . A A . 34 ILE HG12 1 1 10 6244 1 1 34 ILE HG13 H 2.850 6.804 1.394 1.00 . A A . 34 ILE HG13 1 1 10 6245 1 1 34 ILE HG21 H 5.677 6.015 -0.526 1.00 . A A . 34 ILE HG21 1 1 10 6246 1 1 34 ILE HG22 H 6.723 7.377 -0.127 1.00 . A A . 34 ILE HG22 1 1 10 6247 1 1 34 ILE HG23 H 6.560 6.031 1.001 1.00 . A A . 34 ILE HG23 1 1 10 6248 1 1 34 ILE N N 5.279 6.037 3.009 1.00 . A A . 34 ILE N 1 1 10 6249 1 1 34 ILE O O 3.705 9.261 3.069 1.00 . A A . 34 ILE O 1 1 10 6250 1 1 35 HIS C C 2.017 7.897 5.869 1.00 . A A . 35 HIS C 1 1 10 6251 1 1 35 HIS CA C 1.790 7.736 4.369 1.00 . A A . 35 HIS CA 1 1 10 6252 1 1 35 HIS CB C 0.609 6.799 4.117 1.00 . A A . 35 HIS CB 1 1 10 6253 1 1 35 HIS CD2 C 0.295 5.732 1.774 1.00 . A A . 35 HIS CD2 1 1 10 6254 1 1 35 HIS CE1 C -0.659 7.434 0.773 1.00 . A A . 35 HIS CE1 1 1 10 6255 1 1 35 HIS CG C 0.192 6.732 2.680 1.00 . A A . 35 HIS CG 1 1 10 6256 1 1 35 HIS H H 3.163 6.263 3.717 1.00 . A A . 35 HIS H 1 1 10 6257 1 1 35 HIS HA H 1.567 8.704 3.946 1.00 . A A . 35 HIS HA 1 1 10 6258 1 1 35 HIS HB2 H 0.878 5.800 4.431 1.00 . A A . 35 HIS HB2 1 1 10 6259 1 1 35 HIS HB3 H -0.240 7.136 4.695 1.00 . A A . 35 HIS HB3 1 1 10 6260 1 1 35 HIS HD1 H -0.621 8.657 2.412 1.00 . A A . 35 HIS HD1 1 1 10 6261 1 1 35 HIS HD2 H 0.719 4.753 1.944 1.00 . A A . 35 HIS HD2 1 1 10 6262 1 1 35 HIS HE1 H -1.126 8.055 0.023 1.00 . A A . 35 HIS HE1 1 1 10 6263 1 1 35 HIS N N 2.990 7.227 3.714 1.00 . A A . 35 HIS N 1 1 10 6264 1 1 35 HIS ND1 N -0.408 7.784 2.022 1.00 . A A . 35 HIS ND1 1 1 10 6265 1 1 35 HIS NE2 N -0.242 6.193 0.597 1.00 . A A . 35 HIS NE2 1 1 10 6266 1 1 35 HIS O O 2.004 9.011 6.395 1.00 . A A . 35 HIS O 1 1 10 6267 1 1 36 THR C C 1.651 7.904 8.665 1.00 . A A . 36 THR C 1 1 10 6268 1 1 36 THR CA C 2.451 6.793 7.994 1.00 . A A . 36 THR CA 1 1 10 6269 1 1 36 THR CB C 3.944 6.979 8.325 1.00 . A A . 36 THR CB 1 1 10 6270 1 1 36 THR CG2 C 4.450 8.317 7.808 1.00 . A A . 36 THR CG2 1 1 10 6271 1 1 36 THR H H 2.222 5.920 6.080 1.00 . A A . 36 THR H 1 1 10 6272 1 1 36 THR HA H 2.131 5.841 8.393 1.00 . A A . 36 THR HA 1 1 10 6273 1 1 36 THR HB H 4.504 6.189 7.846 1.00 . A A . 36 THR HB 1 1 10 6274 1 1 36 THR HG1 H 3.495 6.308 10.125 1.00 . A A . 36 THR HG1 1 1 10 6275 1 1 36 THR HG21 H 4.084 9.110 8.443 1.00 . A A . 36 THR HG21 1 1 10 6276 1 1 36 THR HG22 H 4.096 8.471 6.800 1.00 . A A . 36 THR HG22 1 1 10 6277 1 1 36 THR HG23 H 5.530 8.320 7.815 1.00 . A A . 36 THR HG23 1 1 10 6278 1 1 36 THR N N 2.224 6.777 6.555 1.00 . A A . 36 THR N 1 1 10 6279 1 1 36 THR O O 2.154 8.598 9.548 1.00 . A A . 36 THR O 1 1 10 6280 1 1 36 THR OG1 O 4.145 6.902 9.741 1.00 . A A . 36 THR OG1 1 1 10 6281 1 1 37 GLY C C 0.042 10.496 8.491 1.00 . A A . 37 GLY C 1 1 10 6282 1 1 37 GLY CA C -0.447 9.097 8.811 1.00 . A A . 37 GLY CA 1 1 10 6283 1 1 37 GLY H H 0.055 7.486 7.532 1.00 . A A . 37 GLY H 1 1 10 6284 1 1 37 GLY HA2 H -1.448 8.979 8.422 1.00 . A A . 37 GLY HA2 1 1 10 6285 1 1 37 GLY HA3 H -0.471 8.973 9.883 1.00 . A A . 37 GLY HA3 1 1 10 6286 1 1 37 GLY N N 0.402 8.068 8.239 1.00 . A A . 37 GLY N 1 1 10 6287 1 1 37 GLY O O 0.985 10.987 9.110 1.00 . A A . 37 GLY O 1 1 10 6288 1 1 38 GLU C C -0.327 13.455 8.294 1.00 . A A . 38 GLU C 1 1 10 6289 1 1 38 GLU CA C -0.223 12.488 7.118 1.00 . A A . 38 GLU CA 1 1 10 6290 1 1 38 GLU CB C -1.110 12.969 5.968 1.00 . A A . 38 GLU CB 1 1 10 6291 1 1 38 GLU CD C -3.380 13.851 5.297 1.00 . A A . 38 GLU CD 1 1 10 6292 1 1 38 GLU CG C -2.574 13.115 6.349 1.00 . A A . 38 GLU CG 1 1 10 6293 1 1 38 GLU H H -1.345 10.693 7.063 1.00 . A A . 38 GLU H 1 1 10 6294 1 1 38 GLU HA H 0.802 12.459 6.781 1.00 . A A . 38 GLU HA 1 1 10 6295 1 1 38 GLU HB2 H -0.750 13.928 5.628 1.00 . A A . 38 GLU HB2 1 1 10 6296 1 1 38 GLU HB3 H -1.041 12.260 5.156 1.00 . A A . 38 GLU HB3 1 1 10 6297 1 1 38 GLU HG2 H -2.998 12.131 6.482 1.00 . A A . 38 GLU HG2 1 1 10 6298 1 1 38 GLU HG3 H -2.638 13.662 7.278 1.00 . A A . 38 GLU HG3 1 1 10 6299 1 1 38 GLU N N -0.600 11.138 7.520 1.00 . A A . 38 GLU N 1 1 10 6300 1 1 38 GLU O O -1.279 13.404 9.072 1.00 . A A . 38 GLU O 1 1 10 6301 1 1 38 GLU OE1 O -3.184 13.569 4.096 1.00 . A A . 38 GLU OE1 1 1 10 6302 1 1 38 GLU OE2 O -4.207 14.708 5.673 1.00 . A A . 38 GLU OE2 1 1 10 6303 1 1 39 LYS C C 1.618 16.472 9.162 1.00 . A A . 39 LYS C 1 1 10 6304 1 1 39 LYS CA C 0.682 15.315 9.496 1.00 . A A . 39 LYS CA 1 1 10 6305 1 1 39 LYS CB C 1.120 14.654 10.805 1.00 . A A . 39 LYS CB 1 1 10 6306 1 1 39 LYS CD C 2.993 13.127 10.118 1.00 . A A . 39 LYS CD 1 1 10 6307 1 1 39 LYS CE C 4.498 13.022 9.932 1.00 . A A . 39 LYS CE 1 1 10 6308 1 1 39 LYS CG C 2.612 14.385 10.882 1.00 . A A . 39 LYS CG 1 1 10 6309 1 1 39 LYS H H 1.393 14.327 7.765 1.00 . A A . 39 LYS H 1 1 10 6310 1 1 39 LYS HA H -0.319 15.701 9.615 1.00 . A A . 39 LYS HA 1 1 10 6311 1 1 39 LYS HB2 H 0.848 15.298 11.629 1.00 . A A . 39 LYS HB2 1 1 10 6312 1 1 39 LYS HB3 H 0.600 13.712 10.910 1.00 . A A . 39 LYS HB3 1 1 10 6313 1 1 39 LYS HD2 H 2.648 12.264 10.668 1.00 . A A . 39 LYS HD2 1 1 10 6314 1 1 39 LYS HD3 H 2.519 13.150 9.146 1.00 . A A . 39 LYS HD3 1 1 10 6315 1 1 39 LYS HE2 H 4.851 13.916 9.440 1.00 . A A . 39 LYS HE2 1 1 10 6316 1 1 39 LYS HE3 H 4.963 12.939 10.903 1.00 . A A . 39 LYS HE3 1 1 10 6317 1 1 39 LYS HG2 H 3.143 15.225 10.458 1.00 . A A . 39 LYS HG2 1 1 10 6318 1 1 39 LYS HG3 H 2.895 14.265 11.918 1.00 . A A . 39 LYS HG3 1 1 10 6319 1 1 39 LYS HZ1 H 4.871 12.086 8.102 1.00 . A A . 39 LYS HZ1 1 1 10 6320 1 1 39 LYS HZ2 H 4.197 11.064 9.269 1.00 . A A . 39 LYS HZ2 1 1 10 6321 1 1 39 LYS HZ3 H 5.825 11.509 9.374 1.00 . A A . 39 LYS HZ3 1 1 10 6322 1 1 39 LYS N N 0.661 14.335 8.417 1.00 . A A . 39 LYS N 1 1 10 6323 1 1 39 LYS NZ N 4.875 11.838 9.111 1.00 . A A . 39 LYS NZ 1 1 10 6324 1 1 39 LYS O O 2.630 16.307 8.481 1.00 . A A . 39 LYS O 1 1 10 6325 1 1 40 PRO C C 3.404 18.848 10.164 1.00 . A A . 40 PRO C 1 1 10 6326 1 1 40 PRO CA C 2.073 18.880 9.420 1.00 . A A . 40 PRO CA 1 1 10 6327 1 1 40 PRO CB C 1.185 20.003 9.963 1.00 . A A . 40 PRO CB 1 1 10 6328 1 1 40 PRO CD C 0.082 17.944 10.473 1.00 . A A . 40 PRO CD 1 1 10 6329 1 1 40 PRO CG C 0.315 19.341 10.976 1.00 . A A . 40 PRO CG 1 1 10 6330 1 1 40 PRO HA H 2.254 19.040 8.367 1.00 . A A . 40 PRO HA 1 1 10 6331 1 1 40 PRO HB2 H 1.802 20.769 10.411 1.00 . A A . 40 PRO HB2 1 1 10 6332 1 1 40 PRO HB3 H 0.602 20.426 9.159 1.00 . A A . 40 PRO HB3 1 1 10 6333 1 1 40 PRO HD2 H 0.017 17.251 11.298 1.00 . A A . 40 PRO HD2 1 1 10 6334 1 1 40 PRO HD3 H -0.815 17.904 9.872 1.00 . A A . 40 PRO HD3 1 1 10 6335 1 1 40 PRO HG2 H 0.818 19.317 11.931 1.00 . A A . 40 PRO HG2 1 1 10 6336 1 1 40 PRO HG3 H -0.622 19.871 11.057 1.00 . A A . 40 PRO HG3 1 1 10 6337 1 1 40 PRO N N 1.275 17.673 9.653 1.00 . A A . 40 PRO N 1 1 10 6338 1 1 40 PRO O O 3.533 18.191 11.197 1.00 . A A . 40 PRO O 1 1 10 6339 1 1 41 SER C C 5.609 19.618 11.765 1.00 . A A . 41 SER C 1 1 10 6340 1 1 41 SER CA C 5.714 19.610 10.243 1.00 . A A . 41 SER CA 1 1 10 6341 1 1 41 SER CB C 6.473 20.851 9.767 1.00 . A A . 41 SER CB 1 1 10 6342 1 1 41 SER H H 4.227 20.063 8.806 1.00 . A A . 41 SER H 1 1 10 6343 1 1 41 SER HA H 6.255 18.728 9.936 1.00 . A A . 41 SER HA 1 1 10 6344 1 1 41 SER HB2 H 6.190 21.075 8.750 1.00 . A A . 41 SER HB2 1 1 10 6345 1 1 41 SER HB3 H 6.225 21.688 10.404 1.00 . A A . 41 SER HB3 1 1 10 6346 1 1 41 SER HG H 8.077 19.985 10.486 1.00 . A A . 41 SER HG 1 1 10 6347 1 1 41 SER N N 4.392 19.561 9.632 1.00 . A A . 41 SER N 1 1 10 6348 1 1 41 SER O O 5.100 20.568 12.359 1.00 . A A . 41 SER O 1 1 10 6349 1 1 41 SER OG O 7.874 20.641 9.815 1.00 . A A . 41 SER OG 1 1 10 6350 1 1 42 GLY C C 6.889 17.311 14.372 1.00 . A A . 42 GLY C 1 1 10 6351 1 1 42 GLY CA C 6.046 18.453 13.839 1.00 . A A . 42 GLY CA 1 1 10 6352 1 1 42 GLY H H 6.489 17.823 11.867 1.00 . A A . 42 GLY H 1 1 10 6353 1 1 42 GLY HA2 H 6.403 19.379 14.263 1.00 . A A . 42 GLY HA2 1 1 10 6354 1 1 42 GLY HA3 H 5.021 18.301 14.143 1.00 . A A . 42 GLY HA3 1 1 10 6355 1 1 42 GLY N N 6.095 18.550 12.392 1.00 . A A . 42 GLY N 1 1 10 6356 1 1 42 GLY O O 6.373 16.306 14.860 1.00 . A A . 42 GLY O 1 1 10 6357 1 1 43 PRO C C 9.183 16.328 16.270 1.00 . A A . 43 PRO C 1 1 10 6358 1 1 43 PRO CA C 9.163 16.441 14.750 1.00 . A A . 43 PRO CA 1 1 10 6359 1 1 43 PRO CB C 10.513 16.944 14.233 1.00 . A A . 43 PRO CB 1 1 10 6360 1 1 43 PRO CD C 8.903 18.631 13.708 1.00 . A A . 43 PRO CD 1 1 10 6361 1 1 43 PRO CG C 10.341 18.417 14.093 1.00 . A A . 43 PRO CG 1 1 10 6362 1 1 43 PRO HA H 8.949 15.473 14.321 1.00 . A A . 43 PRO HA 1 1 10 6363 1 1 43 PRO HB2 H 11.287 16.702 14.947 1.00 . A A . 43 PRO HB2 1 1 10 6364 1 1 43 PRO HB3 H 10.734 16.481 13.283 1.00 . A A . 43 PRO HB3 1 1 10 6365 1 1 43 PRO HD2 H 8.528 19.546 14.142 1.00 . A A . 43 PRO HD2 1 1 10 6366 1 1 43 PRO HD3 H 8.799 18.651 12.633 1.00 . A A . 43 PRO HD3 1 1 10 6367 1 1 43 PRO HG2 H 10.553 18.903 15.034 1.00 . A A . 43 PRO HG2 1 1 10 6368 1 1 43 PRO HG3 H 10.995 18.792 13.320 1.00 . A A . 43 PRO HG3 1 1 10 6369 1 1 43 PRO N N 8.219 17.459 14.279 1.00 . A A . 43 PRO N 1 1 10 6370 1 1 43 PRO O O 8.904 17.296 16.978 1.00 . A A . 43 PRO O 1 1 10 6371 1 1 44 SER C C 10.929 14.342 18.611 1.00 . A A . 44 SER C 1 1 10 6372 1 1 44 SER CA C 9.569 14.901 18.204 1.00 . A A . 44 SER CA 1 1 10 6373 1 1 44 SER CB C 8.461 13.933 18.622 1.00 . A A . 44 SER CB 1 1 10 6374 1 1 44 SER H H 9.728 14.408 16.151 1.00 . A A . 44 SER H 1 1 10 6375 1 1 44 SER HA H 9.418 15.846 18.703 1.00 . A A . 44 SER HA 1 1 10 6376 1 1 44 SER HB2 H 8.649 12.964 18.186 1.00 . A A . 44 SER HB2 1 1 10 6377 1 1 44 SER HB3 H 8.449 13.847 19.699 1.00 . A A . 44 SER HB3 1 1 10 6378 1 1 44 SER HG H 6.554 14.288 18.896 1.00 . A A . 44 SER HG 1 1 10 6379 1 1 44 SER N N 9.516 15.141 16.766 1.00 . A A . 44 SER N 1 1 10 6380 1 1 44 SER O O 11.155 13.133 18.563 1.00 . A A . 44 SER O 1 1 10 6381 1 1 44 SER OG O 7.192 14.391 18.186 1.00 . A A . 44 SER OG 1 1 10 6382 1 1 45 SER C C 13.329 14.935 20.938 1.00 . A A . 45 SER C 1 1 10 6383 1 1 45 SER CA C 13.171 14.828 19.424 1.00 . A A . 45 SER CA 1 1 10 6384 1 1 45 SER CB C 14.224 15.693 18.728 1.00 . A A . 45 SER CB 1 1 10 6385 1 1 45 SER H H 11.592 16.181 19.028 1.00 . A A . 45 SER H 1 1 10 6386 1 1 45 SER HA H 13.312 13.798 19.131 1.00 . A A . 45 SER HA 1 1 10 6387 1 1 45 SER HB2 H 13.861 16.707 18.653 1.00 . A A . 45 SER HB2 1 1 10 6388 1 1 45 SER HB3 H 15.137 15.678 19.305 1.00 . A A . 45 SER HB3 1 1 10 6389 1 1 45 SER HG H 13.738 14.727 17.093 1.00 . A A . 45 SER HG 1 1 10 6390 1 1 45 SER N N 11.832 15.231 19.012 1.00 . A A . 45 SER N 1 1 10 6391 1 1 45 SER O O 12.457 15.462 21.628 1.00 . A A . 45 SER O 1 1 10 6392 1 1 45 SER OG O 14.500 15.209 17.424 1.00 . A A . 45 SER OG 1 1 10 6393 1 1 46 GLY C C 15.393 15.761 23.299 1.00 . A A . 46 GLY C 1 1 10 6394 1 1 46 GLY CA C 14.702 14.480 22.875 1.00 . A A . 46 GLY CA 1 1 10 6395 1 1 46 GLY H H 15.109 14.024 20.848 1.00 . A A . 46 GLY H 1 1 10 6396 1 1 46 GLY HA2 H 13.762 14.400 23.399 1.00 . A A . 46 GLY HA2 1 1 10 6397 1 1 46 GLY HA3 H 15.327 13.642 23.147 1.00 . A A . 46 GLY HA3 1 1 10 6398 1 1 46 GLY N N 14.449 14.432 21.447 1.00 . A A . 46 GLY N 1 1 10 6399 1 1 46 GLY O O 14.734 16.644 23.847 1.00 . A A . 46 GLY O 1 1 10 6400 2 2 1 ZN ZN ZN -0.288 4.613 -0.770 1.00 . B A . 201 ZN ZN 1 1 11 6401 1 1 1 GLY C C -20.962 4.647 -20.643 1.00 . A A . 1 GLY C 1 1 11 6402 1 1 1 GLY CA C -21.861 5.443 -21.567 1.00 . A A . 1 GLY CA 1 1 11 6403 1 1 1 GLY H1 H -20.440 6.932 -22.064 1.00 . A A . 1 GLY H1 1 1 11 6404 1 1 1 GLY HA2 H -22.848 5.499 -21.132 1.00 . A A . 1 GLY HA2 1 1 11 6405 1 1 1 GLY HA3 H -21.926 4.932 -22.516 1.00 . A A . 1 GLY HA3 1 1 11 6406 1 1 1 GLY N N -21.371 6.790 -21.793 1.00 . A A . 1 GLY N 1 1 11 6407 1 1 1 GLY O O -20.736 5.036 -19.497 1.00 . A A . 1 GLY O 1 1 11 6408 1 1 2 SER C C -18.174 2.615 -20.955 1.00 . A A . 2 SER C 1 1 11 6409 1 1 2 SER CA C -19.573 2.669 -20.349 1.00 . A A . 2 SER CA 1 1 11 6410 1 1 2 SER CB C -20.156 1.258 -20.255 1.00 . A A . 2 SER CB 1 1 11 6411 1 1 2 SER H H -20.665 3.269 -22.061 1.00 . A A . 2 SER H 1 1 11 6412 1 1 2 SER HA H -19.506 3.090 -19.357 1.00 . A A . 2 SER HA 1 1 11 6413 1 1 2 SER HB2 H -19.507 0.643 -19.650 1.00 . A A . 2 SER HB2 1 1 11 6414 1 1 2 SER HB3 H -21.134 1.305 -19.799 1.00 . A A . 2 SER HB3 1 1 11 6415 1 1 2 SER HG H -21.204 0.621 -21.782 1.00 . A A . 2 SER HG 1 1 11 6416 1 1 2 SER N N -20.448 3.526 -21.141 1.00 . A A . 2 SER N 1 1 11 6417 1 1 2 SER O O -18.015 2.589 -22.176 1.00 . A A . 2 SER O 1 1 11 6418 1 1 2 SER OG O -20.277 0.669 -21.538 1.00 . A A . 2 SER OG 1 1 11 6419 1 1 3 SER C C -15.316 1.107 -20.733 1.00 . A A . 3 SER C 1 1 11 6420 1 1 3 SER CA C -15.776 2.549 -20.542 1.00 . A A . 3 SER CA 1 1 11 6421 1 1 3 SER CB C -14.867 3.257 -19.535 1.00 . A A . 3 SER CB 1 1 11 6422 1 1 3 SER H H -17.354 2.619 -19.132 1.00 . A A . 3 SER H 1 1 11 6423 1 1 3 SER HA H -15.717 3.062 -21.490 1.00 . A A . 3 SER HA 1 1 11 6424 1 1 3 SER HB2 H -15.107 2.920 -18.538 1.00 . A A . 3 SER HB2 1 1 11 6425 1 1 3 SER HB3 H -13.836 3.022 -19.757 1.00 . A A . 3 SER HB3 1 1 11 6426 1 1 3 SER HG H -15.216 4.926 -20.501 1.00 . A A . 3 SER HG 1 1 11 6427 1 1 3 SER N N -17.163 2.597 -20.093 1.00 . A A . 3 SER N 1 1 11 6428 1 1 3 SER O O -14.855 0.728 -21.808 1.00 . A A . 3 SER O 1 1 11 6429 1 1 3 SER OG O -15.038 4.663 -19.595 1.00 . A A . 3 SER OG 1 1 11 6430 1 1 4 GLY C C -13.890 -1.401 -18.812 1.00 . A A . 4 GLY C 1 1 11 6431 1 1 4 GLY CA C -15.038 -1.084 -19.749 1.00 . A A . 4 GLY CA 1 1 11 6432 1 1 4 GLY H H -15.819 0.665 -18.846 1.00 . A A . 4 GLY H 1 1 11 6433 1 1 4 GLY HA2 H -15.882 -1.708 -19.492 1.00 . A A . 4 GLY HA2 1 1 11 6434 1 1 4 GLY HA3 H -14.734 -1.307 -20.761 1.00 . A A . 4 GLY HA3 1 1 11 6435 1 1 4 GLY N N -15.445 0.307 -19.678 1.00 . A A . 4 GLY N 1 1 11 6436 1 1 4 GLY O O -13.376 -0.516 -18.128 1.00 . A A . 4 GLY O 1 1 11 6437 1 1 5 SER C C -11.225 -2.124 -17.988 1.00 . A A . 5 SER C 1 1 11 6438 1 1 5 SER CA C -12.395 -3.100 -17.915 1.00 . A A . 5 SER CA 1 1 11 6439 1 1 5 SER CB C -11.929 -4.503 -18.309 1.00 . A A . 5 SER CB 1 1 11 6440 1 1 5 SER H H -13.937 -3.327 -19.349 1.00 . A A . 5 SER H 1 1 11 6441 1 1 5 SER HA H -12.765 -3.125 -16.901 1.00 . A A . 5 SER HA 1 1 11 6442 1 1 5 SER HB2 H -11.554 -4.484 -19.321 1.00 . A A . 5 SER HB2 1 1 11 6443 1 1 5 SER HB3 H -11.143 -4.819 -17.640 1.00 . A A . 5 SER HB3 1 1 11 6444 1 1 5 SER HG H -13.566 -5.209 -17.496 1.00 . A A . 5 SER HG 1 1 11 6445 1 1 5 SER N N -13.487 -2.667 -18.779 1.00 . A A . 5 SER N 1 1 11 6446 1 1 5 SER O O -10.571 -1.998 -19.024 1.00 . A A . 5 SER O 1 1 11 6447 1 1 5 SER OG O -12.995 -5.434 -18.235 1.00 . A A . 5 SER OG 1 1 11 6448 1 1 6 SER C C -8.579 -1.137 -16.381 1.00 . A A . 6 SER C 1 1 11 6449 1 1 6 SER CA C -9.878 -0.467 -16.819 1.00 . A A . 6 SER CA 1 1 11 6450 1 1 6 SER CB C -10.230 0.667 -15.855 1.00 . A A . 6 SER CB 1 1 11 6451 1 1 6 SER H H -11.524 -1.580 -16.087 1.00 . A A . 6 SER H 1 1 11 6452 1 1 6 SER HA H -9.742 -0.058 -17.809 1.00 . A A . 6 SER HA 1 1 11 6453 1 1 6 SER HB2 H -9.366 1.299 -15.716 1.00 . A A . 6 SER HB2 1 1 11 6454 1 1 6 SER HB3 H -11.040 1.250 -16.270 1.00 . A A . 6 SER HB3 1 1 11 6455 1 1 6 SER HG H -10.227 -0.699 -14.452 1.00 . A A . 6 SER HG 1 1 11 6456 1 1 6 SER N N -10.967 -1.435 -16.881 1.00 . A A . 6 SER N 1 1 11 6457 1 1 6 SER O O -8.447 -1.572 -15.238 1.00 . A A . 6 SER O 1 1 11 6458 1 1 6 SER OG O -10.632 0.159 -14.595 1.00 . A A . 6 SER OG 1 1 11 6459 1 1 7 GLY C C -6.470 -3.324 -16.735 1.00 . A A . 7 GLY C 1 1 11 6460 1 1 7 GLY CA C -6.346 -1.835 -16.992 1.00 . A A . 7 GLY CA 1 1 11 6461 1 1 7 GLY H H -7.784 -0.853 -18.197 1.00 . A A . 7 GLY H 1 1 11 6462 1 1 7 GLY HA2 H -5.672 -1.678 -17.821 1.00 . A A . 7 GLY HA2 1 1 11 6463 1 1 7 GLY HA3 H -5.934 -1.363 -16.112 1.00 . A A . 7 GLY HA3 1 1 11 6464 1 1 7 GLY N N -7.622 -1.217 -17.301 1.00 . A A . 7 GLY N 1 1 11 6465 1 1 7 GLY O O -7.497 -3.794 -16.244 1.00 . A A . 7 GLY O 1 1 11 6466 1 1 8 THR C C -4.298 -5.940 -15.935 1.00 . A A . 8 THR C 1 1 11 6467 1 1 8 THR CA C -5.419 -5.515 -16.876 1.00 . A A . 8 THR CA 1 1 11 6468 1 1 8 THR CB C -5.262 -6.261 -18.214 1.00 . A A . 8 THR CB 1 1 11 6469 1 1 8 THR CG2 C -6.442 -5.981 -19.132 1.00 . A A . 8 THR CG2 1 1 11 6470 1 1 8 THR H H -4.633 -3.637 -17.457 1.00 . A A . 8 THR H 1 1 11 6471 1 1 8 THR HA H -6.367 -5.795 -16.440 1.00 . A A . 8 THR HA 1 1 11 6472 1 1 8 THR HB H -5.224 -7.322 -18.014 1.00 . A A . 8 THR HB 1 1 11 6473 1 1 8 THR HG1 H -3.740 -6.570 -19.430 1.00 . A A . 8 THR HG1 1 1 11 6474 1 1 8 THR HG21 H -7.089 -5.249 -18.672 1.00 . A A . 8 THR HG21 1 1 11 6475 1 1 8 THR HG22 H -6.993 -6.894 -19.299 1.00 . A A . 8 THR HG22 1 1 11 6476 1 1 8 THR HG23 H -6.081 -5.600 -20.076 1.00 . A A . 8 THR HG23 1 1 11 6477 1 1 8 THR N N -5.422 -4.070 -17.070 1.00 . A A . 8 THR N 1 1 11 6478 1 1 8 THR O O -3.180 -6.214 -16.369 1.00 . A A . 8 THR O 1 1 11 6479 1 1 8 THR OG1 O -4.046 -5.863 -18.857 1.00 . A A . 8 THR OG1 1 1 11 6480 1 1 9 GLY C C -3.981 -5.954 -12.256 1.00 . A A . 9 GLY C 1 1 11 6481 1 1 9 GLY CA C -3.612 -6.389 -13.660 1.00 . A A . 9 GLY CA 1 1 11 6482 1 1 9 GLY H H -5.513 -5.766 -14.353 1.00 . A A . 9 GLY H 1 1 11 6483 1 1 9 GLY HA2 H -3.511 -7.464 -13.677 1.00 . A A . 9 GLY HA2 1 1 11 6484 1 1 9 GLY HA3 H -2.664 -5.945 -13.925 1.00 . A A . 9 GLY HA3 1 1 11 6485 1 1 9 GLY N N -4.605 -5.995 -14.642 1.00 . A A . 9 GLY N 1 1 11 6486 1 1 9 GLY O O -3.399 -5.012 -11.719 1.00 . A A . 9 GLY O 1 1 11 6487 1 1 10 GLU C C -4.662 -7.162 -9.276 1.00 . A A . 10 GLU C 1 1 11 6488 1 1 10 GLU CA C -5.398 -6.316 -10.311 1.00 . A A . 10 GLU CA 1 1 11 6489 1 1 10 GLU CB C -6.907 -6.534 -10.183 1.00 . A A . 10 GLU CB 1 1 11 6490 1 1 10 GLU CD C -8.851 -8.114 -10.514 1.00 . A A . 10 GLU CD 1 1 11 6491 1 1 10 GLU CG C -7.390 -7.832 -10.808 1.00 . A A . 10 GLU CG 1 1 11 6492 1 1 10 GLU H H -5.377 -7.381 -12.140 1.00 . A A . 10 GLU H 1 1 11 6493 1 1 10 GLU HA H -5.178 -5.275 -10.129 1.00 . A A . 10 GLU HA 1 1 11 6494 1 1 10 GLU HB2 H -7.170 -6.543 -9.135 1.00 . A A . 10 GLU HB2 1 1 11 6495 1 1 10 GLU HB3 H -7.419 -5.715 -10.666 1.00 . A A . 10 GLU HB3 1 1 11 6496 1 1 10 GLU HG2 H -7.259 -7.772 -11.878 1.00 . A A . 10 GLU HG2 1 1 11 6497 1 1 10 GLU HG3 H -6.796 -8.647 -10.419 1.00 . A A . 10 GLU HG3 1 1 11 6498 1 1 10 GLU N N -4.951 -6.640 -11.660 1.00 . A A . 10 GLU N 1 1 11 6499 1 1 10 GLU O O -4.754 -8.390 -9.281 1.00 . A A . 10 GLU O 1 1 11 6500 1 1 10 GLU OE1 O -9.689 -7.223 -10.767 1.00 . A A . 10 GLU OE1 1 1 11 6501 1 1 10 GLU OE2 O -9.155 -9.225 -10.032 1.00 . A A . 10 GLU OE2 1 1 11 6502 1 1 11 LYS C C -4.046 -7.424 -6.116 1.00 . A A . 11 LYS C 1 1 11 6503 1 1 11 LYS CA C -3.177 -7.184 -7.347 1.00 . A A . 11 LYS CA 1 1 11 6504 1 1 11 LYS CB C -1.940 -6.369 -6.960 1.00 . A A . 11 LYS CB 1 1 11 6505 1 1 11 LYS CD C 0.120 -5.312 -7.933 1.00 . A A . 11 LYS CD 1 1 11 6506 1 1 11 LYS CE C 1.006 -5.282 -9.168 1.00 . A A . 11 LYS CE 1 1 11 6507 1 1 11 LYS CG C -0.776 -6.540 -7.920 1.00 . A A . 11 LYS CG 1 1 11 6508 1 1 11 LYS H H -3.896 -5.517 -8.436 1.00 . A A . 11 LYS H 1 1 11 6509 1 1 11 LYS HA H -2.861 -8.138 -7.740 1.00 . A A . 11 LYS HA 1 1 11 6510 1 1 11 LYS HB2 H -2.207 -5.323 -6.932 1.00 . A A . 11 LYS HB2 1 1 11 6511 1 1 11 LYS HB3 H -1.616 -6.675 -5.976 1.00 . A A . 11 LYS HB3 1 1 11 6512 1 1 11 LYS HD2 H -0.497 -4.426 -7.924 1.00 . A A . 11 LYS HD2 1 1 11 6513 1 1 11 LYS HD3 H 0.746 -5.325 -7.051 1.00 . A A . 11 LYS HD3 1 1 11 6514 1 1 11 LYS HE2 H 0.385 -5.391 -10.044 1.00 . A A . 11 LYS HE2 1 1 11 6515 1 1 11 LYS HE3 H 1.517 -4.331 -9.206 1.00 . A A . 11 LYS HE3 1 1 11 6516 1 1 11 LYS HG2 H -0.192 -7.395 -7.615 1.00 . A A . 11 LYS HG2 1 1 11 6517 1 1 11 LYS HG3 H -1.163 -6.702 -8.916 1.00 . A A . 11 LYS HG3 1 1 11 6518 1 1 11 LYS HZ1 H 2.896 -6.042 -8.706 1.00 . A A . 11 LYS HZ1 1 1 11 6519 1 1 11 LYS HZ2 H 2.229 -6.680 -10.124 1.00 . A A . 11 LYS HZ2 1 1 11 6520 1 1 11 LYS HZ3 H 1.656 -7.189 -8.617 1.00 . A A . 11 LYS HZ3 1 1 11 6521 1 1 11 LYS N N -3.930 -6.496 -8.389 1.00 . A A . 11 LYS N 1 1 11 6522 1 1 11 LYS NZ N 2.018 -6.375 -9.153 1.00 . A A . 11 LYS NZ 1 1 11 6523 1 1 11 LYS O O -5.050 -6.746 -5.894 1.00 . A A . 11 LYS O 1 1 11 6524 1 1 12 PRO C C -4.260 -7.684 -2.998 1.00 . A A . 12 PRO C 1 1 11 6525 1 1 12 PRO CA C -4.381 -8.759 -4.072 1.00 . A A . 12 PRO CA 1 1 11 6526 1 1 12 PRO CB C -3.702 -10.052 -3.613 1.00 . A A . 12 PRO CB 1 1 11 6527 1 1 12 PRO CD C -2.466 -9.257 -5.499 1.00 . A A . 12 PRO CD 1 1 11 6528 1 1 12 PRO CG C -2.330 -9.985 -4.190 1.00 . A A . 12 PRO CG 1 1 11 6529 1 1 12 PRO HA H -5.425 -8.950 -4.273 1.00 . A A . 12 PRO HA 1 1 11 6530 1 1 12 PRO HB2 H -3.677 -10.084 -2.533 1.00 . A A . 12 PRO HB2 1 1 11 6531 1 1 12 PRO HB3 H -4.248 -10.903 -3.991 1.00 . A A . 12 PRO HB3 1 1 11 6532 1 1 12 PRO HD2 H -1.590 -8.655 -5.688 1.00 . A A . 12 PRO HD2 1 1 11 6533 1 1 12 PRO HD3 H -2.627 -9.957 -6.305 1.00 . A A . 12 PRO HD3 1 1 11 6534 1 1 12 PRO HG2 H -1.678 -9.441 -3.524 1.00 . A A . 12 PRO HG2 1 1 11 6535 1 1 12 PRO HG3 H -1.953 -10.984 -4.354 1.00 . A A . 12 PRO HG3 1 1 11 6536 1 1 12 PRO N N -3.652 -8.409 -5.296 1.00 . A A . 12 PRO N 1 1 11 6537 1 1 12 PRO O O -5.212 -7.415 -2.265 1.00 . A A . 12 PRO O 1 1 11 6538 1 1 13 TYR C C -3.090 -4.644 -2.520 1.00 . A A . 13 TYR C 1 1 11 6539 1 1 13 TYR CA C -2.839 -6.026 -1.924 1.00 . A A . 13 TYR CA 1 1 11 6540 1 1 13 TYR CB C -1.404 -6.115 -1.401 1.00 . A A . 13 TYR CB 1 1 11 6541 1 1 13 TYR CD1 C -1.406 -7.828 0.454 1.00 . A A . 13 TYR CD1 1 1 11 6542 1 1 13 TYR CD2 C -0.351 -8.401 -1.605 1.00 . A A . 13 TYR CD2 1 1 11 6543 1 1 13 TYR CE1 C -1.082 -9.068 0.971 1.00 . A A . 13 TYR CE1 1 1 11 6544 1 1 13 TYR CE2 C -0.023 -9.644 -1.097 1.00 . A A . 13 TYR CE2 1 1 11 6545 1 1 13 TYR CG C -1.047 -7.474 -0.841 1.00 . A A . 13 TYR CG 1 1 11 6546 1 1 13 TYR CZ C -0.391 -9.972 0.192 1.00 . A A . 13 TYR CZ 1 1 11 6547 1 1 13 TYR H H -2.364 -7.329 -3.522 1.00 . A A . 13 TYR H 1 1 11 6548 1 1 13 TYR HA H -3.522 -6.180 -1.101 1.00 . A A . 13 TYR HA 1 1 11 6549 1 1 13 TYR HB2 H -0.721 -5.900 -2.208 1.00 . A A . 13 TYR HB2 1 1 11 6550 1 1 13 TYR HB3 H -1.268 -5.386 -0.616 1.00 . A A . 13 TYR HB3 1 1 11 6551 1 1 13 TYR HD1 H -1.947 -7.118 1.062 1.00 . A A . 13 TYR HD1 1 1 11 6552 1 1 13 TYR HD2 H -0.064 -8.141 -2.613 1.00 . A A . 13 TYR HD2 1 1 11 6553 1 1 13 TYR HE1 H -1.369 -9.326 1.980 1.00 . A A . 13 TYR HE1 1 1 11 6554 1 1 13 TYR HE2 H 0.518 -10.352 -1.707 1.00 . A A . 13 TYR HE2 1 1 11 6555 1 1 13 TYR HH H -0.868 -11.677 0.941 1.00 . A A . 13 TYR HH 1 1 11 6556 1 1 13 TYR N N -3.085 -7.071 -2.910 1.00 . A A . 13 TYR N 1 1 11 6557 1 1 13 TYR O O -2.768 -4.389 -3.680 1.00 . A A . 13 TYR O 1 1 11 6558 1 1 13 TYR OH O -0.065 -11.208 0.702 1.00 . A A . 13 TYR OH 1 1 11 6559 1 1 14 ARG C C -3.813 -1.405 -1.016 1.00 . A A . 14 ARG C 1 1 11 6560 1 1 14 ARG CA C -3.962 -2.401 -2.163 1.00 . A A . 14 ARG CA 1 1 11 6561 1 1 14 ARG CB C -5.379 -2.327 -2.736 1.00 . A A . 14 ARG CB 1 1 11 6562 1 1 14 ARG CD C -6.499 -0.231 -1.918 1.00 . A A . 14 ARG CD 1 1 11 6563 1 1 14 ARG CG C -5.819 -0.916 -3.093 1.00 . A A . 14 ARG CG 1 1 11 6564 1 1 14 ARG CZ C -8.496 1.170 -1.616 1.00 . A A . 14 ARG CZ 1 1 11 6565 1 1 14 ARG H H -3.900 -4.020 -0.802 1.00 . A A . 14 ARG H 1 1 11 6566 1 1 14 ARG HA H -3.256 -2.146 -2.940 1.00 . A A . 14 ARG HA 1 1 11 6567 1 1 14 ARG HB2 H -5.426 -2.932 -3.629 1.00 . A A . 14 ARG HB2 1 1 11 6568 1 1 14 ARG HB3 H -6.070 -2.722 -2.007 1.00 . A A . 14 ARG HB3 1 1 11 6569 1 1 14 ARG HD2 H -7.010 -0.977 -1.329 1.00 . A A . 14 ARG HD2 1 1 11 6570 1 1 14 ARG HD3 H -5.744 0.250 -1.314 1.00 . A A . 14 ARG HD3 1 1 11 6571 1 1 14 ARG HE H -7.342 1.166 -3.243 1.00 . A A . 14 ARG HE 1 1 11 6572 1 1 14 ARG HG2 H -4.951 -0.340 -3.379 1.00 . A A . 14 ARG HG2 1 1 11 6573 1 1 14 ARG HG3 H -6.511 -0.964 -3.921 1.00 . A A . 14 ARG HG3 1 1 11 6574 1 1 14 ARG HH11 H -8.060 -0.036 -0.055 1.00 . A A . 14 ARG HH11 1 1 11 6575 1 1 14 ARG HH12 H -9.466 0.957 0.145 1.00 . A A . 14 ARG HH12 1 1 11 6576 1 1 14 ARG HH21 H -9.191 2.479 -2.991 1.00 . A A . 14 ARG HH21 1 1 11 6577 1 1 14 ARG HH22 H -10.109 2.387 -1.526 1.00 . A A . 14 ARG HH22 1 1 11 6578 1 1 14 ARG N N -3.667 -3.757 -1.717 1.00 . A A . 14 ARG N 1 1 11 6579 1 1 14 ARG NE N -7.467 0.772 -2.355 1.00 . A A . 14 ARG NE 1 1 11 6580 1 1 14 ARG NH1 N -8.690 0.654 -0.410 1.00 . A A . 14 ARG NH1 1 1 11 6581 1 1 14 ARG NH2 N -9.334 2.087 -2.083 1.00 . A A . 14 ARG NH2 1 1 11 6582 1 1 14 ARG O O -4.276 -1.652 0.098 1.00 . A A . 14 ARG O 1 1 11 6583 1 1 15 CYS C C -4.248 1.504 0.000 1.00 . A A . 15 CYS C 1 1 11 6584 1 1 15 CYS CA C -2.952 0.752 -0.289 1.00 . A A . 15 CYS CA 1 1 11 6585 1 1 15 CYS CB C -1.874 1.733 -0.754 1.00 . A A . 15 CYS CB 1 1 11 6586 1 1 15 CYS H H -2.818 -0.141 -2.204 1.00 . A A . 15 CYS H 1 1 11 6587 1 1 15 CYS HA H -2.621 0.269 0.617 1.00 . A A . 15 CYS HA 1 1 11 6588 1 1 15 CYS HB2 H -1.088 1.183 -1.250 1.00 . A A . 15 CYS HB2 1 1 11 6589 1 1 15 CYS HB3 H -2.311 2.434 -1.450 1.00 . A A . 15 CYS HB3 1 1 11 6590 1 1 15 CYS N N -3.164 -0.280 -1.297 1.00 . A A . 15 CYS N 1 1 11 6591 1 1 15 CYS O O -4.731 2.273 -0.831 1.00 . A A . 15 CYS O 1 1 11 6592 1 1 15 CYS SG S -1.111 2.692 0.594 1.00 . A A . 15 CYS SG 1 1 11 6593 1 1 16 ALA C C -5.861 3.442 1.673 1.00 . A A . 16 ALA C 1 1 11 6594 1 1 16 ALA CA C -6.045 1.931 1.585 1.00 . A A . 16 ALA CA 1 1 11 6595 1 1 16 ALA CB C -6.529 1.377 2.916 1.00 . A A . 16 ALA CB 1 1 11 6596 1 1 16 ALA H H -4.375 0.651 1.804 1.00 . A A . 16 ALA H 1 1 11 6597 1 1 16 ALA HA H -6.795 1.713 0.838 1.00 . A A . 16 ALA HA 1 1 11 6598 1 1 16 ALA HB1 H -6.428 2.135 3.679 1.00 . A A . 16 ALA HB1 1 1 11 6599 1 1 16 ALA HB2 H -7.567 1.090 2.830 1.00 . A A . 16 ALA HB2 1 1 11 6600 1 1 16 ALA HB3 H -5.937 0.515 3.184 1.00 . A A . 16 ALA HB3 1 1 11 6601 1 1 16 ALA N N -4.807 1.275 1.184 1.00 . A A . 16 ALA N 1 1 11 6602 1 1 16 ALA O O -6.835 4.192 1.729 1.00 . A A . 16 ALA O 1 1 11 6603 1 1 17 GLU C C -4.538 5.993 0.431 1.00 . A A . 17 GLU C 1 1 11 6604 1 1 17 GLU CA C -4.297 5.304 1.771 1.00 . A A . 17 GLU CA 1 1 11 6605 1 1 17 GLU CB C -2.845 5.508 2.207 1.00 . A A . 17 GLU CB 1 1 11 6606 1 1 17 GLU CD C -3.025 6.390 4.567 1.00 . A A . 17 GLU CD 1 1 11 6607 1 1 17 GLU CG C -2.608 5.231 3.683 1.00 . A A . 17 GLU CG 1 1 11 6608 1 1 17 GLU H H -3.873 3.234 1.640 1.00 . A A . 17 GLU H 1 1 11 6609 1 1 17 GLU HA H -4.950 5.743 2.510 1.00 . A A . 17 GLU HA 1 1 11 6610 1 1 17 GLU HB2 H -2.212 4.848 1.632 1.00 . A A . 17 GLU HB2 1 1 11 6611 1 1 17 GLU HB3 H -2.561 6.530 2.004 1.00 . A A . 17 GLU HB3 1 1 11 6612 1 1 17 GLU HG2 H -3.176 4.359 3.968 1.00 . A A . 17 GLU HG2 1 1 11 6613 1 1 17 GLU HG3 H -1.556 5.040 3.836 1.00 . A A . 17 GLU HG3 1 1 11 6614 1 1 17 GLU N N -4.607 3.882 1.687 1.00 . A A . 17 GLU N 1 1 11 6615 1 1 17 GLU O O -5.427 6.836 0.304 1.00 . A A . 17 GLU O 1 1 11 6616 1 1 17 GLU OE1 O -2.754 7.550 4.193 1.00 . A A . 17 GLU OE1 1 1 11 6617 1 1 17 GLU OE2 O -3.622 6.136 5.635 1.00 . A A . 17 GLU OE2 1 1 11 6618 1 1 18 CYS C C -4.662 5.295 -2.821 1.00 . A A . 18 CYS C 1 1 11 6619 1 1 18 CYS CA C -3.864 6.212 -1.898 1.00 . A A . 18 CYS CA 1 1 11 6620 1 1 18 CYS CB C -2.479 6.473 -2.494 1.00 . A A . 18 CYS CB 1 1 11 6621 1 1 18 CYS H H -3.049 4.952 -0.405 1.00 . A A . 18 CYS H 1 1 11 6622 1 1 18 CYS HA H -4.388 7.150 -1.802 1.00 . A A . 18 CYS HA 1 1 11 6623 1 1 18 CYS HB2 H -2.594 6.828 -3.508 1.00 . A A . 18 CYS HB2 1 1 11 6624 1 1 18 CYS HB3 H -1.981 7.231 -1.908 1.00 . A A . 18 CYS HB3 1 1 11 6625 1 1 18 CYS N N -3.740 5.629 -0.567 1.00 . A A . 18 CYS N 1 1 11 6626 1 1 18 CYS O O -5.593 5.734 -3.495 1.00 . A A . 18 CYS O 1 1 11 6627 1 1 18 CYS SG S -1.400 5.007 -2.539 1.00 . A A . 18 CYS SG 1 1 11 6628 1 1 19 GLY C C -4.051 2.372 -4.665 1.00 . A A . 19 GLY C 1 1 11 6629 1 1 19 GLY CA C -4.981 3.060 -3.686 1.00 . A A . 19 GLY CA 1 1 11 6630 1 1 19 GLY H H -3.541 3.725 -2.285 1.00 . A A . 19 GLY H 1 1 11 6631 1 1 19 GLY HA2 H -5.443 2.313 -3.059 1.00 . A A . 19 GLY HA2 1 1 11 6632 1 1 19 GLY HA3 H -5.751 3.576 -4.241 1.00 . A A . 19 GLY HA3 1 1 11 6633 1 1 19 GLY N N -4.290 4.019 -2.844 1.00 . A A . 19 GLY N 1 1 11 6634 1 1 19 GLY O O -4.456 2.013 -5.772 1.00 . A A . 19 GLY O 1 1 11 6635 1 1 20 LYS C C -2.064 0.038 -5.197 1.00 . A A . 20 LYS C 1 1 11 6636 1 1 20 LYS CA C -1.807 1.539 -5.109 1.00 . A A . 20 LYS CA 1 1 11 6637 1 1 20 LYS CB C -0.398 1.795 -4.569 1.00 . A A . 20 LYS CB 1 1 11 6638 1 1 20 LYS CD C 1.765 2.908 -5.195 1.00 . A A . 20 LYS CD 1 1 11 6639 1 1 20 LYS CE C 2.205 2.107 -6.411 1.00 . A A . 20 LYS CE 1 1 11 6640 1 1 20 LYS CG C 0.253 3.045 -5.135 1.00 . A A . 20 LYS CG 1 1 11 6641 1 1 20 LYS H H -2.536 2.496 -3.367 1.00 . A A . 20 LYS H 1 1 11 6642 1 1 20 LYS HA H -1.887 1.965 -6.098 1.00 . A A . 20 LYS HA 1 1 11 6643 1 1 20 LYS HB2 H -0.450 1.896 -3.495 1.00 . A A . 20 LYS HB2 1 1 11 6644 1 1 20 LYS HB3 H 0.227 0.947 -4.812 1.00 . A A . 20 LYS HB3 1 1 11 6645 1 1 20 LYS HD2 H 2.206 3.892 -5.248 1.00 . A A . 20 LYS HD2 1 1 11 6646 1 1 20 LYS HD3 H 2.108 2.406 -4.301 1.00 . A A . 20 LYS HD3 1 1 11 6647 1 1 20 LYS HE2 H 3.282 2.033 -6.407 1.00 . A A . 20 LYS HE2 1 1 11 6648 1 1 20 LYS HE3 H 1.776 1.118 -6.348 1.00 . A A . 20 LYS HE3 1 1 11 6649 1 1 20 LYS HG2 H -0.122 3.214 -6.134 1.00 . A A . 20 LYS HG2 1 1 11 6650 1 1 20 LYS HG3 H 0.001 3.887 -4.507 1.00 . A A . 20 LYS HG3 1 1 11 6651 1 1 20 LYS HZ1 H 0.927 2.261 -8.056 1.00 . A A . 20 LYS HZ1 1 1 11 6652 1 1 20 LYS HZ2 H 2.529 2.691 -8.390 1.00 . A A . 20 LYS HZ2 1 1 11 6653 1 1 20 LYS HZ3 H 1.535 3.746 -7.519 1.00 . A A . 20 LYS HZ3 1 1 11 6654 1 1 20 LYS N N -2.799 2.188 -4.260 1.00 . A A . 20 LYS N 1 1 11 6655 1 1 20 LYS NZ N 1.768 2.746 -7.683 1.00 . A A . 20 LYS NZ 1 1 11 6656 1 1 20 LYS O O -3.031 -0.469 -4.629 1.00 . A A . 20 LYS O 1 1 11 6657 1 1 21 ALA C C 0.001 -2.814 -5.801 1.00 . A A . 21 ALA C 1 1 11 6658 1 1 21 ALA CA C -1.324 -2.109 -6.070 1.00 . A A . 21 ALA CA 1 1 11 6659 1 1 21 ALA CB C -1.828 -2.442 -7.466 1.00 . A A . 21 ALA CB 1 1 11 6660 1 1 21 ALA H H -0.443 -0.205 -6.340 1.00 . A A . 21 ALA H 1 1 11 6661 1 1 21 ALA HA H -2.057 -2.458 -5.357 1.00 . A A . 21 ALA HA 1 1 11 6662 1 1 21 ALA HB1 H -2.513 -1.675 -7.794 1.00 . A A . 21 ALA HB1 1 1 11 6663 1 1 21 ALA HB2 H -0.991 -2.493 -8.147 1.00 . A A . 21 ALA HB2 1 1 11 6664 1 1 21 ALA HB3 H -2.336 -3.395 -7.448 1.00 . A A . 21 ALA HB3 1 1 11 6665 1 1 21 ALA N N -1.193 -0.666 -5.911 1.00 . A A . 21 ALA N 1 1 11 6666 1 1 21 ALA O O 1.052 -2.384 -6.277 1.00 . A A . 21 ALA O 1 1 11 6667 1 1 22 PHE C C 0.858 -6.161 -4.744 1.00 . A A . 22 PHE C 1 1 11 6668 1 1 22 PHE CA C 1.140 -4.662 -4.702 1.00 . A A . 22 PHE CA 1 1 11 6669 1 1 22 PHE CB C 1.653 -4.268 -3.315 1.00 . A A . 22 PHE CB 1 1 11 6670 1 1 22 PHE CD1 C 1.201 -1.826 -2.956 1.00 . A A . 22 PHE CD1 1 1 11 6671 1 1 22 PHE CD2 C 3.438 -2.507 -3.420 1.00 . A A . 22 PHE CD2 1 1 11 6672 1 1 22 PHE CE1 C 1.615 -0.510 -2.876 1.00 . A A . 22 PHE CE1 1 1 11 6673 1 1 22 PHE CE2 C 3.859 -1.193 -3.341 1.00 . A A . 22 PHE CE2 1 1 11 6674 1 1 22 PHE CG C 2.107 -2.838 -3.229 1.00 . A A . 22 PHE CG 1 1 11 6675 1 1 22 PHE CZ C 2.946 -0.193 -3.068 1.00 . A A . 22 PHE CZ 1 1 11 6676 1 1 22 PHE H H -0.924 -4.192 -4.685 1.00 . A A . 22 PHE H 1 1 11 6677 1 1 22 PHE HA H 1.896 -4.430 -5.436 1.00 . A A . 22 PHE HA 1 1 11 6678 1 1 22 PHE HB2 H 0.863 -4.409 -2.593 1.00 . A A . 22 PHE HB2 1 1 11 6679 1 1 22 PHE HB3 H 2.490 -4.899 -3.056 1.00 . A A . 22 PHE HB3 1 1 11 6680 1 1 22 PHE HD1 H 0.160 -2.072 -2.804 1.00 . A A . 22 PHE HD1 1 1 11 6681 1 1 22 PHE HD2 H 4.154 -3.289 -3.633 1.00 . A A . 22 PHE HD2 1 1 11 6682 1 1 22 PHE HE1 H 0.900 0.270 -2.662 1.00 . A A . 22 PHE HE1 1 1 11 6683 1 1 22 PHE HE2 H 4.900 -0.949 -3.491 1.00 . A A . 22 PHE HE2 1 1 11 6684 1 1 22 PHE HZ H 3.272 0.835 -3.006 1.00 . A A . 22 PHE HZ 1 1 11 6685 1 1 22 PHE N N -0.056 -3.899 -5.035 1.00 . A A . 22 PHE N 1 1 11 6686 1 1 22 PHE O O -0.193 -6.621 -4.295 1.00 . A A . 22 PHE O 1 1 11 6687 1 1 23 THR C C 2.016 -9.051 -4.077 1.00 . A A . 23 THR C 1 1 11 6688 1 1 23 THR CA C 1.658 -8.367 -5.391 1.00 . A A . 23 THR CA 1 1 11 6689 1 1 23 THR CB C 2.542 -8.943 -6.514 1.00 . A A . 23 THR CB 1 1 11 6690 1 1 23 THR CG2 C 3.972 -8.440 -6.388 1.00 . A A . 23 THR CG2 1 1 11 6691 1 1 23 THR H H 2.619 -6.496 -5.628 1.00 . A A . 23 THR H 1 1 11 6692 1 1 23 THR HA H 0.626 -8.582 -5.628 1.00 . A A . 23 THR HA 1 1 11 6693 1 1 23 THR HB H 2.145 -8.619 -7.465 1.00 . A A . 23 THR HB 1 1 11 6694 1 1 23 THR HG1 H 1.680 -10.674 -6.126 1.00 . A A . 23 THR HG1 1 1 11 6695 1 1 23 THR HG21 H 4.636 -9.110 -6.911 1.00 . A A . 23 THR HG21 1 1 11 6696 1 1 23 THR HG22 H 4.249 -8.400 -5.345 1.00 . A A . 23 THR HG22 1 1 11 6697 1 1 23 THR HG23 H 4.045 -7.452 -6.818 1.00 . A A . 23 THR HG23 1 1 11 6698 1 1 23 THR N N 1.804 -6.921 -5.288 1.00 . A A . 23 THR N 1 1 11 6699 1 1 23 THR O O 1.537 -10.148 -3.786 1.00 . A A . 23 THR O 1 1 11 6700 1 1 23 THR OG1 O 2.528 -10.374 -6.464 1.00 . A A . 23 THR OG1 1 1 11 6701 1 1 24 ASP C C 3.163 -7.892 -0.900 1.00 . A A . 24 ASP C 1 1 11 6702 1 1 24 ASP CA C 3.281 -8.943 -2.000 1.00 . A A . 24 ASP CA 1 1 11 6703 1 1 24 ASP CB C 4.721 -9.452 -2.085 1.00 . A A . 24 ASP CB 1 1 11 6704 1 1 24 ASP CG C 5.040 -10.467 -1.006 1.00 . A A . 24 ASP CG 1 1 11 6705 1 1 24 ASP H H 3.207 -7.527 -3.573 1.00 . A A . 24 ASP H 1 1 11 6706 1 1 24 ASP HA H 2.630 -9.770 -1.762 1.00 . A A . 24 ASP HA 1 1 11 6707 1 1 24 ASP HB2 H 4.875 -9.917 -3.048 1.00 . A A . 24 ASP HB2 1 1 11 6708 1 1 24 ASP HB3 H 5.397 -8.616 -1.980 1.00 . A A . 24 ASP HB3 1 1 11 6709 1 1 24 ASP N N 2.860 -8.398 -3.286 1.00 . A A . 24 ASP N 1 1 11 6710 1 1 24 ASP O O 3.312 -6.697 -1.152 1.00 . A A . 24 ASP O 1 1 11 6711 1 1 24 ASP OD1 O 4.329 -10.487 0.021 1.00 . A A . 24 ASP OD1 1 1 11 6712 1 1 24 ASP OD2 O 6.001 -11.243 -1.188 1.00 . A A . 24 ASP OD2 1 1 11 6713 1 1 25 ARG C C 4.021 -6.620 1.655 1.00 . A A . 25 ARG C 1 1 11 6714 1 1 25 ARG CA C 2.754 -7.447 1.457 1.00 . A A . 25 ARG CA 1 1 11 6715 1 1 25 ARG CB C 2.447 -8.242 2.728 1.00 . A A . 25 ARG CB 1 1 11 6716 1 1 25 ARG CD C 0.583 -8.771 4.328 1.00 . A A . 25 ARG CD 1 1 11 6717 1 1 25 ARG CG C 0.983 -8.625 2.868 1.00 . A A . 25 ARG CG 1 1 11 6718 1 1 25 ARG CZ C -1.573 -7.590 4.384 1.00 . A A . 25 ARG CZ 1 1 11 6719 1 1 25 ARG H H 2.787 -9.312 0.457 1.00 . A A . 25 ARG H 1 1 11 6720 1 1 25 ARG HA H 1.931 -6.780 1.253 1.00 . A A . 25 ARG HA 1 1 11 6721 1 1 25 ARG HB2 H 3.035 -9.148 2.723 1.00 . A A . 25 ARG HB2 1 1 11 6722 1 1 25 ARG HB3 H 2.725 -7.647 3.585 1.00 . A A . 25 ARG HB3 1 1 11 6723 1 1 25 ARG HD2 H 0.939 -9.723 4.692 1.00 . A A . 25 ARG HD2 1 1 11 6724 1 1 25 ARG HD3 H 1.042 -7.974 4.894 1.00 . A A . 25 ARG HD3 1 1 11 6725 1 1 25 ARG HE H -1.332 -9.539 4.730 1.00 . A A . 25 ARG HE 1 1 11 6726 1 1 25 ARG HG2 H 0.375 -7.857 2.414 1.00 . A A . 25 ARG HG2 1 1 11 6727 1 1 25 ARG HG3 H 0.817 -9.564 2.362 1.00 . A A . 25 ARG HG3 1 1 11 6728 1 1 25 ARG HH11 H 0.021 -6.429 3.946 1.00 . A A . 25 ARG HH11 1 1 11 6729 1 1 25 ARG HH12 H -1.504 -5.609 3.988 1.00 . A A . 25 ARG HH12 1 1 11 6730 1 1 25 ARG HH21 H -3.347 -8.471 4.789 1.00 . A A . 25 ARG HH21 1 1 11 6731 1 1 25 ARG HH22 H -3.419 -6.771 4.469 1.00 . A A . 25 ARG HH22 1 1 11 6732 1 1 25 ARG N N 2.894 -8.348 0.319 1.00 . A A . 25 ARG N 1 1 11 6733 1 1 25 ARG NE N -0.865 -8.707 4.507 1.00 . A A . 25 ARG NE 1 1 11 6734 1 1 25 ARG NH1 N -0.969 -6.449 4.082 1.00 . A A . 25 ARG NH1 1 1 11 6735 1 1 25 ARG NH2 N -2.888 -7.612 4.562 1.00 . A A . 25 ARG NH2 1 1 11 6736 1 1 25 ARG O O 3.977 -5.390 1.661 1.00 . A A . 25 ARG O 1 1 11 6737 1 1 26 SER C C 6.521 -5.373 1.166 1.00 . A A . 26 SER C 1 1 11 6738 1 1 26 SER CA C 6.428 -6.633 2.020 1.00 . A A . 26 SER CA 1 1 11 6739 1 1 26 SER CB C 7.583 -7.578 1.684 1.00 . A A . 26 SER CB 1 1 11 6740 1 1 26 SER H H 5.120 -8.284 1.804 1.00 . A A . 26 SER H 1 1 11 6741 1 1 26 SER HA H 6.494 -6.354 3.061 1.00 . A A . 26 SER HA 1 1 11 6742 1 1 26 SER HB2 H 7.657 -8.339 2.446 1.00 . A A . 26 SER HB2 1 1 11 6743 1 1 26 SER HB3 H 7.396 -8.045 0.727 1.00 . A A . 26 SER HB3 1 1 11 6744 1 1 26 SER HG H 9.471 -7.427 1.186 1.00 . A A . 26 SER HG 1 1 11 6745 1 1 26 SER N N 5.149 -7.304 1.818 1.00 . A A . 26 SER N 1 1 11 6746 1 1 26 SER O O 6.791 -4.285 1.672 1.00 . A A . 26 SER O 1 1 11 6747 1 1 26 SER OG O 8.813 -6.877 1.617 1.00 . A A . 26 SER OG 1 1 11 6748 1 1 27 ASN C C 5.369 -3.313 -0.656 1.00 . A A . 27 ASN C 1 1 11 6749 1 1 27 ASN CA C 6.355 -4.405 -1.062 1.00 . A A . 27 ASN CA 1 1 11 6750 1 1 27 ASN CB C 6.055 -4.875 -2.486 1.00 . A A . 27 ASN CB 1 1 11 6751 1 1 27 ASN CG C 6.984 -5.986 -2.936 1.00 . A A . 27 ASN CG 1 1 11 6752 1 1 27 ASN H H 6.085 -6.422 -0.480 1.00 . A A . 27 ASN H 1 1 11 6753 1 1 27 ASN HA H 7.356 -4.001 -1.029 1.00 . A A . 27 ASN HA 1 1 11 6754 1 1 27 ASN HB2 H 5.039 -5.241 -2.532 1.00 . A A . 27 ASN HB2 1 1 11 6755 1 1 27 ASN HB3 H 6.164 -4.042 -3.165 1.00 . A A . 27 ASN HB3 1 1 11 6756 1 1 27 ASN HD21 H 8.538 -4.748 -2.870 1.00 . A A . 27 ASN HD21 1 1 11 6757 1 1 27 ASN HD22 H 8.888 -6.368 -3.358 1.00 . A A . 27 ASN HD22 1 1 11 6758 1 1 27 ASN N N 6.296 -5.530 -0.135 1.00 . A A . 27 ASN N 1 1 11 6759 1 1 27 ASN ND2 N 8.266 -5.668 -3.068 1.00 . A A . 27 ASN ND2 1 1 11 6760 1 1 27 ASN O O 5.680 -2.124 -0.727 1.00 . A A . 27 ASN O 1 1 11 6761 1 1 27 ASN OD1 O 6.553 -7.117 -3.162 1.00 . A A . 27 ASN OD1 1 1 11 6762 1 1 28 LEU C C 3.582 -2.020 1.435 1.00 . A A . 28 LEU C 1 1 11 6763 1 1 28 LEU CA C 3.148 -2.784 0.188 1.00 . A A . 28 LEU CA 1 1 11 6764 1 1 28 LEU CB C 1.836 -3.522 0.459 1.00 . A A . 28 LEU CB 1 1 11 6765 1 1 28 LEU CD1 C 0.221 -1.608 0.346 1.00 . A A . 28 LEU CD1 1 1 11 6766 1 1 28 LEU CD2 C -0.359 -3.654 1.662 1.00 . A A . 28 LEU CD2 1 1 11 6767 1 1 28 LEU CG C 0.765 -2.733 1.213 1.00 . A A . 28 LEU CG 1 1 11 6768 1 1 28 LEU H H 3.992 -4.687 -0.195 1.00 . A A . 28 LEU H 1 1 11 6769 1 1 28 LEU HA H 2.997 -2.080 -0.616 1.00 . A A . 28 LEU HA 1 1 11 6770 1 1 28 LEU HB2 H 1.420 -3.817 -0.492 1.00 . A A . 28 LEU HB2 1 1 11 6771 1 1 28 LEU HB3 H 2.067 -4.405 1.038 1.00 . A A . 28 LEU HB3 1 1 11 6772 1 1 28 LEU HD11 H -0.009 -1.990 -0.637 1.00 . A A . 28 LEU HD11 1 1 11 6773 1 1 28 LEU HD12 H 0.962 -0.826 0.264 1.00 . A A . 28 LEU HD12 1 1 11 6774 1 1 28 LEU HD13 H -0.675 -1.207 0.797 1.00 . A A . 28 LEU HD13 1 1 11 6775 1 1 28 LEU HD21 H -1.287 -3.102 1.692 1.00 . A A . 28 LEU HD21 1 1 11 6776 1 1 28 LEU HD22 H -0.137 -4.039 2.646 1.00 . A A . 28 LEU HD22 1 1 11 6777 1 1 28 LEU HD23 H -0.451 -4.476 0.967 1.00 . A A . 28 LEU HD23 1 1 11 6778 1 1 28 LEU HG H 1.208 -2.289 2.095 1.00 . A A . 28 LEU HG 1 1 11 6779 1 1 28 LEU N N 4.181 -3.726 -0.230 1.00 . A A . 28 LEU N 1 1 11 6780 1 1 28 LEU O O 3.478 -0.794 1.492 1.00 . A A . 28 LEU O 1 1 11 6781 1 1 29 PHE C C 5.559 -1.058 3.408 1.00 . A A . 29 PHE C 1 1 11 6782 1 1 29 PHE CA C 4.520 -2.142 3.678 1.00 . A A . 29 PHE CA 1 1 11 6783 1 1 29 PHE CB C 5.106 -3.206 4.607 1.00 . A A . 29 PHE CB 1 1 11 6784 1 1 29 PHE CD1 C 3.219 -3.397 6.250 1.00 . A A . 29 PHE CD1 1 1 11 6785 1 1 29 PHE CD2 C 3.931 -5.366 5.109 1.00 . A A . 29 PHE CD2 1 1 11 6786 1 1 29 PHE CE1 C 2.259 -4.129 6.922 1.00 . A A . 29 PHE CE1 1 1 11 6787 1 1 29 PHE CE2 C 2.972 -6.103 5.778 1.00 . A A . 29 PHE CE2 1 1 11 6788 1 1 29 PHE CG C 4.064 -4.006 5.336 1.00 . A A . 29 PHE CG 1 1 11 6789 1 1 29 PHE CZ C 2.136 -5.484 6.686 1.00 . A A . 29 PHE CZ 1 1 11 6790 1 1 29 PHE H H 4.127 -3.724 2.327 1.00 . A A . 29 PHE H 1 1 11 6791 1 1 29 PHE HA H 3.663 -1.692 4.155 1.00 . A A . 29 PHE HA 1 1 11 6792 1 1 29 PHE HB2 H 5.703 -3.893 4.026 1.00 . A A . 29 PHE HB2 1 1 11 6793 1 1 29 PHE HB3 H 5.733 -2.725 5.343 1.00 . A A . 29 PHE HB3 1 1 11 6794 1 1 29 PHE HD1 H 3.314 -2.336 6.435 1.00 . A A . 29 PHE HD1 1 1 11 6795 1 1 29 PHE HD2 H 4.584 -5.851 4.399 1.00 . A A . 29 PHE HD2 1 1 11 6796 1 1 29 PHE HE1 H 1.607 -3.642 7.632 1.00 . A A . 29 PHE HE1 1 1 11 6797 1 1 29 PHE HE2 H 2.878 -7.163 5.592 1.00 . A A . 29 PHE HE2 1 1 11 6798 1 1 29 PHE HZ H 1.386 -6.058 7.210 1.00 . A A . 29 PHE HZ 1 1 11 6799 1 1 29 PHE N N 4.069 -2.751 2.432 1.00 . A A . 29 PHE N 1 1 11 6800 1 1 29 PHE O O 5.517 0.021 4.002 1.00 . A A . 29 PHE O 1 1 11 6801 1 1 30 THR C C 6.958 0.882 1.588 1.00 . A A . 30 THR C 1 1 11 6802 1 1 30 THR CA C 7.544 -0.403 2.161 1.00 . A A . 30 THR CA 1 1 11 6803 1 1 30 THR CB C 8.527 -1.005 1.140 1.00 . A A . 30 THR CB 1 1 11 6804 1 1 30 THR CG2 C 9.655 -0.031 0.835 1.00 . A A . 30 THR CG2 1 1 11 6805 1 1 30 THR H H 6.473 -2.227 2.069 1.00 . A A . 30 THR H 1 1 11 6806 1 1 30 THR HA H 8.092 -0.168 3.061 1.00 . A A . 30 THR HA 1 1 11 6807 1 1 30 THR HB H 7.992 -1.210 0.224 1.00 . A A . 30 THR HB 1 1 11 6808 1 1 30 THR HG1 H 9.062 -2.210 2.607 1.00 . A A . 30 THR HG1 1 1 11 6809 1 1 30 THR HG21 H 9.391 0.950 1.200 1.00 . A A . 30 THR HG21 1 1 11 6810 1 1 30 THR HG22 H 9.815 0.013 -0.232 1.00 . A A . 30 THR HG22 1 1 11 6811 1 1 30 THR HG23 H 10.560 -0.364 1.322 1.00 . A A . 30 THR HG23 1 1 11 6812 1 1 30 THR N N 6.492 -1.351 2.508 1.00 . A A . 30 THR N 1 1 11 6813 1 1 30 THR O O 7.500 1.969 1.793 1.00 . A A . 30 THR O 1 1 11 6814 1 1 30 THR OG1 O 9.071 -2.229 1.646 1.00 . A A . 30 THR OG1 1 1 11 6815 1 1 31 HIS C C 4.360 2.659 1.303 1.00 . A A . 31 HIS C 1 1 11 6816 1 1 31 HIS CA C 5.187 1.904 0.267 1.00 . A A . 31 HIS CA 1 1 11 6817 1 1 31 HIS CB C 4.292 1.459 -0.890 1.00 . A A . 31 HIS CB 1 1 11 6818 1 1 31 HIS CD2 C 2.005 2.660 -0.646 1.00 . A A . 31 HIS CD2 1 1 11 6819 1 1 31 HIS CE1 C 2.205 4.071 -2.312 1.00 . A A . 31 HIS CE1 1 1 11 6820 1 1 31 HIS CG C 3.210 2.441 -1.223 1.00 . A A . 31 HIS CG 1 1 11 6821 1 1 31 HIS H H 5.463 -0.140 0.741 1.00 . A A . 31 HIS H 1 1 11 6822 1 1 31 HIS HA H 5.952 2.563 -0.115 1.00 . A A . 31 HIS HA 1 1 11 6823 1 1 31 HIS HB2 H 4.898 1.322 -1.774 1.00 . A A . 31 HIS HB2 1 1 11 6824 1 1 31 HIS HB3 H 3.822 0.521 -0.633 1.00 . A A . 31 HIS HB3 1 1 11 6825 1 1 31 HIS HD1 H 4.064 3.430 -2.875 1.00 . A A . 31 HIS HD1 1 1 11 6826 1 1 31 HIS HD2 H 1.595 2.132 0.204 1.00 . A A . 31 HIS HD2 1 1 11 6827 1 1 31 HIS HE1 H 1.998 4.856 -3.024 1.00 . A A . 31 HIS HE1 1 1 11 6828 1 1 31 HIS N N 5.847 0.752 0.869 1.00 . A A . 31 HIS N 1 1 11 6829 1 1 31 HIS ND1 N 3.304 3.340 -2.264 1.00 . A A . 31 HIS ND1 1 1 11 6830 1 1 31 HIS NE2 N 1.400 3.677 -1.341 1.00 . A A . 31 HIS NE2 1 1 11 6831 1 1 31 HIS O O 4.462 3.880 1.422 1.00 . A A . 31 HIS O 1 1 11 6832 1 1 32 GLN C C 3.472 3.566 3.878 1.00 . A A . 32 GLN C 1 1 11 6833 1 1 32 GLN CA C 2.697 2.526 3.075 1.00 . A A . 32 GLN CA 1 1 11 6834 1 1 32 GLN CB C 2.147 1.448 4.010 1.00 . A A . 32 GLN CB 1 1 11 6835 1 1 32 GLN CD C 0.588 -0.522 4.278 1.00 . A A . 32 GLN CD 1 1 11 6836 1 1 32 GLN CG C 0.995 0.656 3.414 1.00 . A A . 32 GLN CG 1 1 11 6837 1 1 32 GLN H H 3.505 0.957 1.908 1.00 . A A . 32 GLN H 1 1 11 6838 1 1 32 GLN HA H 1.872 3.015 2.580 1.00 . A A . 32 GLN HA 1 1 11 6839 1 1 32 GLN HB2 H 2.942 0.759 4.253 1.00 . A A . 32 GLN HB2 1 1 11 6840 1 1 32 GLN HB3 H 1.800 1.919 4.918 1.00 . A A . 32 GLN HB3 1 1 11 6841 1 1 32 GLN HE21 H -1.200 -0.572 3.409 1.00 . A A . 32 GLN HE21 1 1 11 6842 1 1 32 GLN HE22 H -0.925 -1.761 4.632 1.00 . A A . 32 GLN HE22 1 1 11 6843 1 1 32 GLN HG2 H 0.144 1.311 3.302 1.00 . A A . 32 GLN HG2 1 1 11 6844 1 1 32 GLN HG3 H 1.293 0.286 2.444 1.00 . A A . 32 GLN HG3 1 1 11 6845 1 1 32 GLN N N 3.542 1.925 2.050 1.00 . A A . 32 GLN N 1 1 11 6846 1 1 32 GLN NE2 N -0.636 -1.000 4.088 1.00 . A A . 32 GLN NE2 1 1 11 6847 1 1 32 GLN O O 2.885 4.462 4.484 1.00 . A A . 32 GLN O 1 1 11 6848 1 1 32 GLN OE1 O 1.365 -0.996 5.107 1.00 . A A . 32 GLN OE1 1 1 11 6849 1 1 33 LYS C C 5.336 5.811 4.229 1.00 . A A . 33 LYS C 1 1 11 6850 1 1 33 LYS CA C 5.652 4.367 4.608 1.00 . A A . 33 LYS CA 1 1 11 6851 1 1 33 LYS CB C 7.125 4.064 4.322 1.00 . A A . 33 LYS CB 1 1 11 6852 1 1 33 LYS CD C 9.156 2.834 5.140 1.00 . A A . 33 LYS CD 1 1 11 6853 1 1 33 LYS CE C 9.811 2.579 3.791 1.00 . A A . 33 LYS CE 1 1 11 6854 1 1 33 LYS CG C 7.641 2.826 5.034 1.00 . A A . 33 LYS CG 1 1 11 6855 1 1 33 LYS H H 5.205 2.703 3.378 1.00 . A A . 33 LYS H 1 1 11 6856 1 1 33 LYS HA H 5.464 4.235 5.662 1.00 . A A . 33 LYS HA 1 1 11 6857 1 1 33 LYS HB2 H 7.251 3.921 3.259 1.00 . A A . 33 LYS HB2 1 1 11 6858 1 1 33 LYS HB3 H 7.721 4.909 4.636 1.00 . A A . 33 LYS HB3 1 1 11 6859 1 1 33 LYS HD2 H 9.478 3.798 5.506 1.00 . A A . 33 LYS HD2 1 1 11 6860 1 1 33 LYS HD3 H 9.464 2.063 5.832 1.00 . A A . 33 LYS HD3 1 1 11 6861 1 1 33 LYS HE2 H 9.330 1.731 3.327 1.00 . A A . 33 LYS HE2 1 1 11 6862 1 1 33 LYS HE3 H 9.677 3.452 3.170 1.00 . A A . 33 LYS HE3 1 1 11 6863 1 1 33 LYS HG2 H 7.221 2.793 6.029 1.00 . A A . 33 LYS HG2 1 1 11 6864 1 1 33 LYS HG3 H 7.332 1.950 4.482 1.00 . A A . 33 LYS HG3 1 1 11 6865 1 1 33 LYS HZ1 H 11.820 3.049 3.468 1.00 . A A . 33 LYS HZ1 1 1 11 6866 1 1 33 LYS HZ2 H 11.497 1.388 3.474 1.00 . A A . 33 LYS HZ2 1 1 11 6867 1 1 33 LYS HZ3 H 11.530 2.249 4.930 1.00 . A A . 33 LYS HZ3 1 1 11 6868 1 1 33 LYS N N 4.795 3.439 3.880 1.00 . A A . 33 LYS N 1 1 11 6869 1 1 33 LYS NZ N 11.267 2.297 3.925 1.00 . A A . 33 LYS NZ 1 1 11 6870 1 1 33 LYS O O 5.310 6.695 5.086 1.00 . A A . 33 LYS O 1 1 11 6871 1 1 34 ILE C C 3.560 7.950 3.168 1.00 . A A . 34 ILE C 1 1 11 6872 1 1 34 ILE CA C 4.778 7.377 2.453 1.00 . A A . 34 ILE CA 1 1 11 6873 1 1 34 ILE CB C 4.514 7.372 0.936 1.00 . A A . 34 ILE CB 1 1 11 6874 1 1 34 ILE CD1 C 2.504 7.125 -0.607 1.00 . A A . 34 ILE CD1 1 1 11 6875 1 1 34 ILE CG1 C 3.221 6.615 0.624 1.00 . A A . 34 ILE CG1 1 1 11 6876 1 1 34 ILE CG2 C 5.689 6.751 0.195 1.00 . A A . 34 ILE CG2 1 1 11 6877 1 1 34 ILE H H 5.131 5.295 2.309 1.00 . A A . 34 ILE H 1 1 11 6878 1 1 34 ILE HA H 5.629 8.013 2.648 1.00 . A A . 34 ILE HA 1 1 11 6879 1 1 34 ILE HB H 4.412 8.395 0.607 1.00 . A A . 34 ILE HB 1 1 11 6880 1 1 34 ILE HD11 H 2.184 6.287 -1.210 1.00 . A A . 34 ILE HD11 1 1 11 6881 1 1 34 ILE HD12 H 1.642 7.702 -0.308 1.00 . A A . 34 ILE HD12 1 1 11 6882 1 1 34 ILE HD13 H 3.173 7.746 -1.182 1.00 . A A . 34 ILE HD13 1 1 11 6883 1 1 34 ILE HG12 H 3.450 5.573 0.466 1.00 . A A . 34 ILE HG12 1 1 11 6884 1 1 34 ILE HG13 H 2.547 6.708 1.464 1.00 . A A . 34 ILE HG13 1 1 11 6885 1 1 34 ILE HG21 H 5.845 5.742 0.549 1.00 . A A . 34 ILE HG21 1 1 11 6886 1 1 34 ILE HG22 H 5.477 6.732 -0.863 1.00 . A A . 34 ILE HG22 1 1 11 6887 1 1 34 ILE HG23 H 6.578 7.337 0.375 1.00 . A A . 34 ILE HG23 1 1 11 6888 1 1 34 ILE N N 5.095 6.041 2.943 1.00 . A A . 34 ILE N 1 1 11 6889 1 1 34 ILE O O 3.269 9.142 3.064 1.00 . A A . 34 ILE O 1 1 11 6890 1 1 35 HIS C C 1.896 7.422 6.138 1.00 . A A . 35 HIS C 1 1 11 6891 1 1 35 HIS CA C 1.664 7.515 4.633 1.00 . A A . 35 HIS CA 1 1 11 6892 1 1 35 HIS CB C 0.462 6.658 4.237 1.00 . A A . 35 HIS CB 1 1 11 6893 1 1 35 HIS CD2 C 0.298 5.730 1.820 1.00 . A A . 35 HIS CD2 1 1 11 6894 1 1 35 HIS CE1 C -0.496 7.524 0.841 1.00 . A A . 35 HIS CE1 1 1 11 6895 1 1 35 HIS CG C 0.163 6.686 2.769 1.00 . A A . 35 HIS CG 1 1 11 6896 1 1 35 HIS H H 3.133 6.156 3.941 1.00 . A A . 35 HIS H 1 1 11 6897 1 1 35 HIS HA H 1.462 8.544 4.375 1.00 . A A . 35 HIS HA 1 1 11 6898 1 1 35 HIS HB2 H 0.651 5.632 4.517 1.00 . A A . 35 HIS HB2 1 1 11 6899 1 1 35 HIS HB3 H -0.414 7.013 4.761 1.00 . A A . 35 HIS HB3 1 1 11 6900 1 1 35 HIS HD1 H -0.541 8.658 2.543 1.00 . A A . 35 HIS HD1 1 1 11 6901 1 1 35 HIS HD2 H 0.664 4.724 1.970 1.00 . A A . 35 HIS HD2 1 1 11 6902 1 1 35 HIS HE1 H -0.871 8.204 0.092 1.00 . A A . 35 HIS HE1 1 1 11 6903 1 1 35 HIS N N 2.851 7.093 3.897 1.00 . A A . 35 HIS N 1 1 11 6904 1 1 35 HIS ND1 N -0.335 7.797 2.123 1.00 . A A . 35 HIS ND1 1 1 11 6905 1 1 35 HIS NE2 N -0.119 6.275 0.631 1.00 . A A . 35 HIS NE2 1 1 11 6906 1 1 35 HIS O O 1.707 8.396 6.868 1.00 . A A . 35 HIS O 1 1 11 6907 1 1 36 THR C C 3.623 6.987 8.538 1.00 . A A . 36 THR C 1 1 11 6908 1 1 36 THR CA C 2.564 6.023 8.015 1.00 . A A . 36 THR CA 1 1 11 6909 1 1 36 THR CB C 3.023 4.578 8.284 1.00 . A A . 36 THR CB 1 1 11 6910 1 1 36 THR CG2 C 1.827 3.658 8.480 1.00 . A A . 36 THR CG2 1 1 11 6911 1 1 36 THR H H 2.441 5.507 5.966 1.00 . A A . 36 THR H 1 1 11 6912 1 1 36 THR HA H 1.641 6.192 8.550 1.00 . A A . 36 THR HA 1 1 11 6913 1 1 36 THR HB H 3.618 4.567 9.186 1.00 . A A . 36 THR HB 1 1 11 6914 1 1 36 THR HG1 H 3.250 3.729 6.518 1.00 . A A . 36 THR HG1 1 1 11 6915 1 1 36 THR HG21 H 1.591 3.594 9.532 1.00 . A A . 36 THR HG21 1 1 11 6916 1 1 36 THR HG22 H 2.064 2.674 8.103 1.00 . A A . 36 THR HG22 1 1 11 6917 1 1 36 THR HG23 H 0.977 4.054 7.944 1.00 . A A . 36 THR HG23 1 1 11 6918 1 1 36 THR N N 2.308 6.244 6.597 1.00 . A A . 36 THR N 1 1 11 6919 1 1 36 THR O O 4.819 6.703 8.478 1.00 . A A . 36 THR O 1 1 11 6920 1 1 36 THR OG1 O 3.820 4.106 7.193 1.00 . A A . 36 THR OG1 1 1 11 6921 1 1 37 GLY C C 3.990 10.449 8.869 1.00 . A A . 37 GLY C 1 1 11 6922 1 1 37 GLY CA C 4.099 9.116 9.581 1.00 . A A . 37 GLY CA 1 1 11 6923 1 1 37 GLY H H 2.211 8.301 9.075 1.00 . A A . 37 GLY H 1 1 11 6924 1 1 37 GLY HA2 H 3.892 9.262 10.631 1.00 . A A . 37 GLY HA2 1 1 11 6925 1 1 37 GLY HA3 H 5.107 8.744 9.472 1.00 . A A . 37 GLY HA3 1 1 11 6926 1 1 37 GLY N N 3.176 8.128 9.053 1.00 . A A . 37 GLY N 1 1 11 6927 1 1 37 GLY O O 4.880 10.827 8.107 1.00 . A A . 37 GLY O 1 1 11 6928 1 1 38 GLU C C 2.215 13.490 9.520 1.00 . A A . 38 GLU C 1 1 11 6929 1 1 38 GLU CA C 2.675 12.462 8.491 1.00 . A A . 38 GLU CA 1 1 11 6930 1 1 38 GLU CB C 1.637 12.343 7.373 1.00 . A A . 38 GLU CB 1 1 11 6931 1 1 38 GLU CD C 1.173 11.775 4.956 1.00 . A A . 38 GLU CD 1 1 11 6932 1 1 38 GLU CG C 2.219 11.879 6.048 1.00 . A A . 38 GLU CG 1 1 11 6933 1 1 38 GLU H H 2.223 10.809 9.734 1.00 . A A . 38 GLU H 1 1 11 6934 1 1 38 GLU HA H 3.611 12.789 8.066 1.00 . A A . 38 GLU HA 1 1 11 6935 1 1 38 GLU HB2 H 0.878 11.637 7.676 1.00 . A A . 38 GLU HB2 1 1 11 6936 1 1 38 GLU HB3 H 1.177 13.309 7.222 1.00 . A A . 38 GLU HB3 1 1 11 6937 1 1 38 GLU HG2 H 2.975 12.584 5.736 1.00 . A A . 38 GLU HG2 1 1 11 6938 1 1 38 GLU HG3 H 2.670 10.908 6.188 1.00 . A A . 38 GLU HG3 1 1 11 6939 1 1 38 GLU N N 2.897 11.163 9.117 1.00 . A A . 38 GLU N 1 1 11 6940 1 1 38 GLU O O 1.017 13.696 9.717 1.00 . A A . 38 GLU O 1 1 11 6941 1 1 38 GLU OE1 O 0.717 12.832 4.470 1.00 . A A . 38 GLU OE1 1 1 11 6942 1 1 38 GLU OE2 O 0.810 10.639 4.587 1.00 . A A . 38 GLU OE2 1 1 11 6943 1 1 39 LYS C C 1.761 14.664 12.113 1.00 . A A . 39 LYS C 1 1 11 6944 1 1 39 LYS CA C 2.872 15.142 11.184 1.00 . A A . 39 LYS CA 1 1 11 6945 1 1 39 LYS CB C 2.462 16.455 10.514 1.00 . A A . 39 LYS CB 1 1 11 6946 1 1 39 LYS CD C 4.322 17.927 11.340 1.00 . A A . 39 LYS CD 1 1 11 6947 1 1 39 LYS CE C 5.770 18.288 11.046 1.00 . A A . 39 LYS CE 1 1 11 6948 1 1 39 LYS CG C 3.639 17.331 10.121 1.00 . A A . 39 LYS CG 1 1 11 6949 1 1 39 LYS H H 4.113 13.925 9.974 1.00 . A A . 39 LYS H 1 1 11 6950 1 1 39 LYS HA H 3.765 15.308 11.766 1.00 . A A . 39 LYS HA 1 1 11 6951 1 1 39 LYS HB2 H 1.894 16.230 9.624 1.00 . A A . 39 LYS HB2 1 1 11 6952 1 1 39 LYS HB3 H 1.837 17.013 11.197 1.00 . A A . 39 LYS HB3 1 1 11 6953 1 1 39 LYS HD2 H 3.794 18.820 11.638 1.00 . A A . 39 LYS HD2 1 1 11 6954 1 1 39 LYS HD3 H 4.296 17.206 12.145 1.00 . A A . 39 LYS HD3 1 1 11 6955 1 1 39 LYS HE2 H 6.341 18.202 11.958 1.00 . A A . 39 LYS HE2 1 1 11 6956 1 1 39 LYS HE3 H 6.158 17.597 10.312 1.00 . A A . 39 LYS HE3 1 1 11 6957 1 1 39 LYS HG2 H 4.355 16.733 9.577 1.00 . A A . 39 LYS HG2 1 1 11 6958 1 1 39 LYS HG3 H 3.283 18.133 9.490 1.00 . A A . 39 LYS HG3 1 1 11 6959 1 1 39 LYS HZ1 H 6.903 19.944 10.466 1.00 . A A . 39 LYS HZ1 1 1 11 6960 1 1 39 LYS HZ2 H 5.408 20.343 11.151 1.00 . A A . 39 LYS HZ2 1 1 11 6961 1 1 39 LYS HZ3 H 5.481 19.740 9.573 1.00 . A A . 39 LYS HZ3 1 1 11 6962 1 1 39 LYS N N 3.176 14.133 10.175 1.00 . A A . 39 LYS N 1 1 11 6963 1 1 39 LYS NZ N 5.900 19.676 10.522 1.00 . A A . 39 LYS NZ 1 1 11 6964 1 1 39 LYS O O 0.747 15.336 12.305 1.00 . A A . 39 LYS O 1 1 11 6965 1 1 40 PRO C C 0.896 13.640 14.948 1.00 . A A . 40 PRO C 1 1 11 6966 1 1 40 PRO CA C 0.980 12.884 13.627 1.00 . A A . 40 PRO CA 1 1 11 6967 1 1 40 PRO CB C 1.520 11.470 13.854 1.00 . A A . 40 PRO CB 1 1 11 6968 1 1 40 PRO CD C 3.139 12.621 12.524 1.00 . A A . 40 PRO CD 1 1 11 6969 1 1 40 PRO CG C 2.984 11.578 13.596 1.00 . A A . 40 PRO CG 1 1 11 6970 1 1 40 PRO HA H -0.003 12.828 13.183 1.00 . A A . 40 PRO HA 1 1 11 6971 1 1 40 PRO HB2 H 1.319 11.164 14.871 1.00 . A A . 40 PRO HB2 1 1 11 6972 1 1 40 PRO HB3 H 1.048 10.785 13.166 1.00 . A A . 40 PRO HB3 1 1 11 6973 1 1 40 PRO HD2 H 4.048 13.184 12.675 1.00 . A A . 40 PRO HD2 1 1 11 6974 1 1 40 PRO HD3 H 3.135 12.162 11.546 1.00 . A A . 40 PRO HD3 1 1 11 6975 1 1 40 PRO HG2 H 3.494 11.886 14.495 1.00 . A A . 40 PRO HG2 1 1 11 6976 1 1 40 PRO HG3 H 3.366 10.628 13.252 1.00 . A A . 40 PRO HG3 1 1 11 6977 1 1 40 PRO N N 1.954 13.476 12.706 1.00 . A A . 40 PRO N 1 1 11 6978 1 1 40 PRO O O 0.122 13.278 15.834 1.00 . A A . 40 PRO O 1 1 11 6979 1 1 41 SER C C 0.313 15.631 16.875 1.00 . A A . 41 SER C 1 1 11 6980 1 1 41 SER CA C 1.716 15.499 16.289 1.00 . A A . 41 SER CA 1 1 11 6981 1 1 41 SER CB C 2.292 16.887 15.997 1.00 . A A . 41 SER CB 1 1 11 6982 1 1 41 SER H H 2.292 14.932 14.332 1.00 . A A . 41 SER H 1 1 11 6983 1 1 41 SER HA H 2.348 15.000 17.008 1.00 . A A . 41 SER HA 1 1 11 6984 1 1 41 SER HB2 H 2.184 17.509 16.872 1.00 . A A . 41 SER HB2 1 1 11 6985 1 1 41 SER HB3 H 3.339 16.793 15.748 1.00 . A A . 41 SER HB3 1 1 11 6986 1 1 41 SER HG H 2.186 17.502 14.140 1.00 . A A . 41 SER HG 1 1 11 6987 1 1 41 SER N N 1.697 14.693 15.074 1.00 . A A . 41 SER N 1 1 11 6988 1 1 41 SER O O 0.074 15.273 18.027 1.00 . A A . 41 SER O 1 1 11 6989 1 1 41 SER OG O 1.616 17.501 14.913 1.00 . A A . 41 SER OG 1 1 11 6990 1 1 42 GLY C C -2.651 15.001 16.849 1.00 . A A . 42 GLY C 1 1 11 6991 1 1 42 GLY CA C -1.978 16.320 16.527 1.00 . A A . 42 GLY CA 1 1 11 6992 1 1 42 GLY H H -0.362 16.418 15.162 1.00 . A A . 42 GLY H 1 1 11 6993 1 1 42 GLY HA2 H -1.976 16.938 17.412 1.00 . A A . 42 GLY HA2 1 1 11 6994 1 1 42 GLY HA3 H -2.543 16.819 15.753 1.00 . A A . 42 GLY HA3 1 1 11 6995 1 1 42 GLY N N -0.611 16.149 16.071 1.00 . A A . 42 GLY N 1 1 11 6996 1 1 42 GLY O O -2.128 13.925 16.557 1.00 . A A . 42 GLY O 1 1 11 6997 1 1 43 PRO C C -5.175 13.152 16.633 1.00 . A A . 43 PRO C 1 1 11 6998 1 1 43 PRO CA C -4.609 13.884 17.845 1.00 . A A . 43 PRO CA 1 1 11 6999 1 1 43 PRO CB C -5.742 14.453 18.703 1.00 . A A . 43 PRO CB 1 1 11 7000 1 1 43 PRO CD C -4.522 16.322 17.846 1.00 . A A . 43 PRO CD 1 1 11 7001 1 1 43 PRO CG C -5.898 15.860 18.240 1.00 . A A . 43 PRO CG 1 1 11 7002 1 1 43 PRO HA H -4.018 13.199 18.434 1.00 . A A . 43 PRO HA 1 1 11 7003 1 1 43 PRO HB2 H -6.644 13.880 18.539 1.00 . A A . 43 PRO HB2 1 1 11 7004 1 1 43 PRO HB3 H -5.466 14.409 19.746 1.00 . A A . 43 PRO HB3 1 1 11 7005 1 1 43 PRO HD2 H -4.577 17.001 17.008 1.00 . A A . 43 PRO HD2 1 1 11 7006 1 1 43 PRO HD3 H -4.028 16.792 18.684 1.00 . A A . 43 PRO HD3 1 1 11 7007 1 1 43 PRO HG2 H -6.563 15.896 17.390 1.00 . A A . 43 PRO HG2 1 1 11 7008 1 1 43 PRO HG3 H -6.281 16.471 19.044 1.00 . A A . 43 PRO HG3 1 1 11 7009 1 1 43 PRO N N -3.839 15.073 17.468 1.00 . A A . 43 PRO N 1 1 11 7010 1 1 43 PRO O O -5.890 13.737 15.820 1.00 . A A . 43 PRO O 1 1 11 7011 1 1 44 SER C C -6.366 10.045 15.872 1.00 . A A . 44 SER C 1 1 11 7012 1 1 44 SER CA C -5.324 11.056 15.404 1.00 . A A . 44 SER CA 1 1 11 7013 1 1 44 SER CB C -4.152 10.329 14.742 1.00 . A A . 44 SER CB 1 1 11 7014 1 1 44 SER H H -4.277 11.458 17.200 1.00 . A A . 44 SER H 1 1 11 7015 1 1 44 SER HA H -5.780 11.717 14.683 1.00 . A A . 44 SER HA 1 1 11 7016 1 1 44 SER HB2 H -3.476 9.972 15.503 1.00 . A A . 44 SER HB2 1 1 11 7017 1 1 44 SER HB3 H -4.528 9.491 14.172 1.00 . A A . 44 SER HB3 1 1 11 7018 1 1 44 SER HG H -3.682 10.996 12.961 1.00 . A A . 44 SER HG 1 1 11 7019 1 1 44 SER N N -4.850 11.868 16.519 1.00 . A A . 44 SER N 1 1 11 7020 1 1 44 SER O O -6.327 8.875 15.491 1.00 . A A . 44 SER O 1 1 11 7021 1 1 44 SER OG O -3.443 11.192 13.870 1.00 . A A . 44 SER OG 1 1 11 7022 1 1 45 SER C C -9.572 10.457 17.628 1.00 . A A . 45 SER C 1 1 11 7023 1 1 45 SER CA C -8.347 9.640 17.227 1.00 . A A . 45 SER CA 1 1 11 7024 1 1 45 SER CB C -7.832 8.848 18.430 1.00 . A A . 45 SER CB 1 1 11 7025 1 1 45 SER H H -7.274 11.447 16.970 1.00 . A A . 45 SER H 1 1 11 7026 1 1 45 SER HA H -8.629 8.950 16.446 1.00 . A A . 45 SER HA 1 1 11 7027 1 1 45 SER HB2 H -6.803 8.571 18.262 1.00 . A A . 45 SER HB2 1 1 11 7028 1 1 45 SER HB3 H -7.899 9.462 19.317 1.00 . A A . 45 SER HB3 1 1 11 7029 1 1 45 SER HG H -9.224 7.814 19.342 1.00 . A A . 45 SER HG 1 1 11 7030 1 1 45 SER N N -7.296 10.505 16.703 1.00 . A A . 45 SER N 1 1 11 7031 1 1 45 SER O O -9.559 11.686 17.571 1.00 . A A . 45 SER O 1 1 11 7032 1 1 45 SER OG O -8.595 7.671 18.630 1.00 . A A . 45 SER OG 1 1 11 7033 1 1 46 GLY C C -13.014 10.138 17.515 1.00 . A A . 46 GLY C 1 1 11 7034 1 1 46 GLY CA C -11.850 10.439 18.439 1.00 . A A . 46 GLY CA 1 1 11 7035 1 1 46 GLY H H -10.584 8.784 18.060 1.00 . A A . 46 GLY H 1 1 11 7036 1 1 46 GLY HA2 H -12.108 10.124 19.440 1.00 . A A . 46 GLY HA2 1 1 11 7037 1 1 46 GLY HA3 H -11.673 11.504 18.442 1.00 . A A . 46 GLY HA3 1 1 11 7038 1 1 46 GLY N N -10.631 9.763 18.034 1.00 . A A . 46 GLY N 1 1 11 7039 1 1 46 GLY O O -12.785 9.727 16.379 1.00 . A A . 46 GLY O 1 1 11 7040 2 2 1 ZN ZN ZN -0.308 4.616 -0.570 1.00 . B A . 201 ZN ZN 1 1 12 7041 1 1 1 GLY C C -14.001 2.317 -21.469 1.00 . A A . 1 GLY C 1 1 12 7042 1 1 1 GLY CA C -15.379 1.692 -21.392 1.00 . A A . 1 GLY CA 1 1 12 7043 1 1 1 GLY H1 H -14.838 0.598 -19.662 1.00 . A A . 1 GLY H1 1 1 12 7044 1 1 1 GLY HA2 H -15.646 1.313 -22.367 1.00 . A A . 1 GLY HA2 1 1 12 7045 1 1 1 GLY HA3 H -16.091 2.452 -21.105 1.00 . A A . 1 GLY HA3 1 1 12 7046 1 1 1 GLY N N -15.443 0.605 -20.433 1.00 . A A . 1 GLY N 1 1 12 7047 1 1 1 GLY O O -13.572 3.007 -20.544 1.00 . A A . 1 GLY O 1 1 12 7048 1 1 2 SER C C -12.023 4.077 -23.202 1.00 . A A . 2 SER C 1 1 12 7049 1 1 2 SER CA C -11.963 2.616 -22.767 1.00 . A A . 2 SER CA 1 1 12 7050 1 1 2 SER CB C -11.203 1.792 -23.808 1.00 . A A . 2 SER CB 1 1 12 7051 1 1 2 SER H H -13.700 1.518 -23.277 1.00 . A A . 2 SER H 1 1 12 7052 1 1 2 SER HA H -11.443 2.555 -21.822 1.00 . A A . 2 SER HA 1 1 12 7053 1 1 2 SER HB2 H -10.983 0.817 -23.401 1.00 . A A . 2 SER HB2 1 1 12 7054 1 1 2 SER HB3 H -11.813 1.684 -24.693 1.00 . A A . 2 SER HB3 1 1 12 7055 1 1 2 SER HG H -10.168 3.169 -24.742 1.00 . A A . 2 SER HG 1 1 12 7056 1 1 2 SER N N -13.304 2.075 -22.575 1.00 . A A . 2 SER N 1 1 12 7057 1 1 2 SER O O -12.058 4.380 -24.394 1.00 . A A . 2 SER O 1 1 12 7058 1 1 2 SER OG O -9.985 2.422 -24.167 1.00 . A A . 2 SER OG 1 1 12 7059 1 1 3 SER C C -10.705 6.960 -22.812 1.00 . A A . 3 SER C 1 1 12 7060 1 1 3 SER CA C -12.094 6.408 -22.506 1.00 . A A . 3 SER CA 1 1 12 7061 1 1 3 SER CB C -12.704 7.157 -21.319 1.00 . A A . 3 SER CB 1 1 12 7062 1 1 3 SER H H -12.005 4.674 -21.294 1.00 . A A . 3 SER H 1 1 12 7063 1 1 3 SER HA H -12.724 6.550 -23.372 1.00 . A A . 3 SER HA 1 1 12 7064 1 1 3 SER HB2 H -12.349 6.718 -20.399 1.00 . A A . 3 SER HB2 1 1 12 7065 1 1 3 SER HB3 H -12.406 8.195 -21.361 1.00 . A A . 3 SER HB3 1 1 12 7066 1 1 3 SER HG H -14.401 6.218 -21.049 1.00 . A A . 3 SER HG 1 1 12 7067 1 1 3 SER N N -12.035 4.978 -22.225 1.00 . A A . 3 SER N 1 1 12 7068 1 1 3 SER O O -10.515 7.690 -23.784 1.00 . A A . 3 SER O 1 1 12 7069 1 1 3 SER OG O -14.119 7.087 -21.344 1.00 . A A . 3 SER OG 1 1 12 7070 1 1 4 GLY C C -7.636 7.266 -20.861 1.00 . A A . 4 GLY C 1 1 12 7071 1 1 4 GLY CA C -8.377 7.074 -22.169 1.00 . A A . 4 GLY CA 1 1 12 7072 1 1 4 GLY H H -9.947 6.021 -21.214 1.00 . A A . 4 GLY H 1 1 12 7073 1 1 4 GLY HA2 H -7.843 6.354 -22.771 1.00 . A A . 4 GLY HA2 1 1 12 7074 1 1 4 GLY HA3 H -8.406 8.017 -22.695 1.00 . A A . 4 GLY HA3 1 1 12 7075 1 1 4 GLY N N -9.736 6.606 -21.973 1.00 . A A . 4 GLY N 1 1 12 7076 1 1 4 GLY O O -6.945 8.268 -20.673 1.00 . A A . 4 GLY O 1 1 12 7077 1 1 5 SER C C -6.097 5.258 -18.502 1.00 . A A . 5 SER C 1 1 12 7078 1 1 5 SER CA C -7.123 6.377 -18.654 1.00 . A A . 5 SER CA 1 1 12 7079 1 1 5 SER CB C -8.158 6.292 -17.530 1.00 . A A . 5 SER CB 1 1 12 7080 1 1 5 SER H H -8.345 5.532 -20.163 1.00 . A A . 5 SER H 1 1 12 7081 1 1 5 SER HA H -6.614 7.327 -18.591 1.00 . A A . 5 SER HA 1 1 12 7082 1 1 5 SER HB2 H -8.628 5.321 -17.550 1.00 . A A . 5 SER HB2 1 1 12 7083 1 1 5 SER HB3 H -7.665 6.435 -16.579 1.00 . A A . 5 SER HB3 1 1 12 7084 1 1 5 SER HG H -8.929 8.052 -17.148 1.00 . A A . 5 SER HG 1 1 12 7085 1 1 5 SER N N -7.780 6.306 -19.954 1.00 . A A . 5 SER N 1 1 12 7086 1 1 5 SER O O -5.998 4.373 -19.351 1.00 . A A . 5 SER O 1 1 12 7087 1 1 5 SER OG O -9.157 7.286 -17.681 1.00 . A A . 5 SER OG 1 1 12 7088 1 1 6 SER C C -4.241 3.975 -15.660 1.00 . A A . 6 SER C 1 1 12 7089 1 1 6 SER CA C -4.315 4.298 -17.150 1.00 . A A . 6 SER CA 1 1 12 7090 1 1 6 SER CB C -2.952 4.782 -17.646 1.00 . A A . 6 SER CB 1 1 12 7091 1 1 6 SER H H -5.464 6.036 -16.772 1.00 . A A . 6 SER H 1 1 12 7092 1 1 6 SER HA H -4.587 3.402 -17.687 1.00 . A A . 6 SER HA 1 1 12 7093 1 1 6 SER HB2 H -2.197 4.057 -17.383 1.00 . A A . 6 SER HB2 1 1 12 7094 1 1 6 SER HB3 H -2.983 4.896 -18.720 1.00 . A A . 6 SER HB3 1 1 12 7095 1 1 6 SER HG H -2.722 6.726 -17.714 1.00 . A A . 6 SER HG 1 1 12 7096 1 1 6 SER N N -5.337 5.305 -17.413 1.00 . A A . 6 SER N 1 1 12 7097 1 1 6 SER O O -3.857 4.817 -14.849 1.00 . A A . 6 SER O 1 1 12 7098 1 1 6 SER OG O -2.610 6.028 -17.065 1.00 . A A . 6 SER OG 1 1 12 7099 1 1 7 GLY C C -4.794 0.843 -13.751 1.00 . A A . 7 GLY C 1 1 12 7100 1 1 7 GLY CA C -4.583 2.335 -13.917 1.00 . A A . 7 GLY CA 1 1 12 7101 1 1 7 GLY H H -4.911 2.119 -15.998 1.00 . A A . 7 GLY H 1 1 12 7102 1 1 7 GLY HA2 H -3.625 2.601 -13.495 1.00 . A A . 7 GLY HA2 1 1 12 7103 1 1 7 GLY HA3 H -5.360 2.859 -13.380 1.00 . A A . 7 GLY HA3 1 1 12 7104 1 1 7 GLY N N -4.613 2.748 -15.308 1.00 . A A . 7 GLY N 1 1 12 7105 1 1 7 GLY O O -5.492 0.405 -12.835 1.00 . A A . 7 GLY O 1 1 12 7106 1 1 8 THR C C -3.572 -1.970 -13.394 1.00 . A A . 8 THR C 1 1 12 7107 1 1 8 THR CA C -4.321 -1.392 -14.590 1.00 . A A . 8 THR CA 1 1 12 7108 1 1 8 THR CB C -3.792 -2.048 -15.879 1.00 . A A . 8 THR CB 1 1 12 7109 1 1 8 THR CG2 C -4.617 -1.619 -17.083 1.00 . A A . 8 THR CG2 1 1 12 7110 1 1 8 THR H H -3.651 0.467 -15.347 1.00 . A A . 8 THR H 1 1 12 7111 1 1 8 THR HA H -5.371 -1.631 -14.494 1.00 . A A . 8 THR HA 1 1 12 7112 1 1 8 THR HB H -3.864 -3.121 -15.775 1.00 . A A . 8 THR HB 1 1 12 7113 1 1 8 THR HG1 H -2.194 -1.803 -17.009 1.00 . A A . 8 THR HG1 1 1 12 7114 1 1 8 THR HG21 H -5.604 -1.328 -16.757 1.00 . A A . 8 THR HG21 1 1 12 7115 1 1 8 THR HG22 H -4.696 -2.443 -17.777 1.00 . A A . 8 THR HG22 1 1 12 7116 1 1 8 THR HG23 H -4.137 -0.783 -17.569 1.00 . A A . 8 THR HG23 1 1 12 7117 1 1 8 THR N N -4.193 0.059 -14.640 1.00 . A A . 8 THR N 1 1 12 7118 1 1 8 THR O O -2.358 -1.814 -13.276 1.00 . A A . 8 THR O 1 1 12 7119 1 1 8 THR OG1 O -2.420 -1.690 -16.083 1.00 . A A . 8 THR OG1 1 1 12 7120 1 1 9 GLY C C -4.516 -4.364 -10.759 1.00 . A A . 9 GLY C 1 1 12 7121 1 1 9 GLY CA C -3.692 -3.230 -11.334 1.00 . A A . 9 GLY CA 1 1 12 7122 1 1 9 GLY H H -5.270 -2.731 -12.655 1.00 . A A . 9 GLY H 1 1 12 7123 1 1 9 GLY HA2 H -2.716 -3.607 -11.602 1.00 . A A . 9 GLY HA2 1 1 12 7124 1 1 9 GLY HA3 H -3.576 -2.465 -10.579 1.00 . A A . 9 GLY HA3 1 1 12 7125 1 1 9 GLY N N -4.305 -2.638 -12.509 1.00 . A A . 9 GLY N 1 1 12 7126 1 1 9 GLY O O -5.483 -4.132 -10.035 1.00 . A A . 9 GLY O 1 1 12 7127 1 1 10 GLU C C -4.042 -7.484 -9.513 1.00 . A A . 10 GLU C 1 1 12 7128 1 1 10 GLU CA C -4.846 -6.770 -10.595 1.00 . A A . 10 GLU CA 1 1 12 7129 1 1 10 GLU CB C -5.138 -7.733 -11.748 1.00 . A A . 10 GLU CB 1 1 12 7130 1 1 10 GLU CD C -6.437 -7.857 -13.911 1.00 . A A . 10 GLU CD 1 1 12 7131 1 1 10 GLU CG C -6.460 -7.463 -12.447 1.00 . A A . 10 GLU CG 1 1 12 7132 1 1 10 GLU H H -3.354 -5.716 -11.665 1.00 . A A . 10 GLU H 1 1 12 7133 1 1 10 GLU HA H -5.781 -6.437 -10.171 1.00 . A A . 10 GLU HA 1 1 12 7134 1 1 10 GLU HB2 H -4.345 -7.653 -12.477 1.00 . A A . 10 GLU HB2 1 1 12 7135 1 1 10 GLU HB3 H -5.158 -8.741 -11.362 1.00 . A A . 10 GLU HB3 1 1 12 7136 1 1 10 GLU HG2 H -7.236 -8.025 -11.951 1.00 . A A . 10 GLU HG2 1 1 12 7137 1 1 10 GLU HG3 H -6.680 -6.408 -12.377 1.00 . A A . 10 GLU HG3 1 1 12 7138 1 1 10 GLU N N -4.133 -5.595 -11.083 1.00 . A A . 10 GLU N 1 1 12 7139 1 1 10 GLU O O -3.562 -8.600 -9.714 1.00 . A A . 10 GLU O 1 1 12 7140 1 1 10 GLU OE1 O -5.899 -7.078 -14.726 1.00 . A A . 10 GLU OE1 1 1 12 7141 1 1 10 GLU OE2 O -6.956 -8.944 -14.242 1.00 . A A . 10 GLU OE2 1 1 12 7142 1 1 11 LYS C C -4.045 -7.562 -6.023 1.00 . A A . 11 LYS C 1 1 12 7143 1 1 11 LYS CA C -3.151 -7.402 -7.249 1.00 . A A . 11 LYS CA 1 1 12 7144 1 1 11 LYS CB C -1.950 -6.518 -6.905 1.00 . A A . 11 LYS CB 1 1 12 7145 1 1 11 LYS CD C -0.739 -6.406 -9.103 1.00 . A A . 11 LYS CD 1 1 12 7146 1 1 11 LYS CE C -0.477 -4.910 -9.201 1.00 . A A . 11 LYS CE 1 1 12 7147 1 1 11 LYS CG C -0.687 -6.887 -7.663 1.00 . A A . 11 LYS CG 1 1 12 7148 1 1 11 LYS H H -4.302 -5.944 -8.264 1.00 . A A . 11 LYS H 1 1 12 7149 1 1 11 LYS HA H -2.796 -8.376 -7.550 1.00 . A A . 11 LYS HA 1 1 12 7150 1 1 11 LYS HB2 H -2.197 -5.492 -7.136 1.00 . A A . 11 LYS HB2 1 1 12 7151 1 1 11 LYS HB3 H -1.748 -6.601 -5.847 1.00 . A A . 11 LYS HB3 1 1 12 7152 1 1 11 LYS HD2 H 0.012 -6.929 -9.676 1.00 . A A . 11 LYS HD2 1 1 12 7153 1 1 11 LYS HD3 H -1.718 -6.618 -9.509 1.00 . A A . 11 LYS HD3 1 1 12 7154 1 1 11 LYS HE2 H -0.874 -4.549 -10.137 1.00 . A A . 11 LYS HE2 1 1 12 7155 1 1 11 LYS HE3 H -0.980 -4.416 -8.383 1.00 . A A . 11 LYS HE3 1 1 12 7156 1 1 11 LYS HG2 H 0.162 -6.433 -7.173 1.00 . A A . 11 LYS HG2 1 1 12 7157 1 1 11 LYS HG3 H -0.575 -7.962 -7.656 1.00 . A A . 11 LYS HG3 1 1 12 7158 1 1 11 LYS HZ1 H 1.536 -5.463 -9.271 1.00 . A A . 11 LYS HZ1 1 1 12 7159 1 1 11 LYS HZ2 H 1.212 -4.185 -8.210 1.00 . A A . 11 LYS HZ2 1 1 12 7160 1 1 11 LYS HZ3 H 1.229 -3.915 -9.880 1.00 . A A . 11 LYS HZ3 1 1 12 7161 1 1 11 LYS N N -3.897 -6.832 -8.364 1.00 . A A . 11 LYS N 1 1 12 7162 1 1 11 LYS NZ N 0.977 -4.597 -9.136 1.00 . A A . 11 LYS NZ 1 1 12 7163 1 1 11 LYS O O -5.030 -6.846 -5.845 1.00 . A A . 11 LYS O 1 1 12 7164 1 1 12 PRO C C -4.312 -7.682 -2.900 1.00 . A A . 12 PRO C 1 1 12 7165 1 1 12 PRO CA C -4.450 -8.798 -3.930 1.00 . A A . 12 PRO CA 1 1 12 7166 1 1 12 PRO CB C -3.819 -10.090 -3.406 1.00 . A A . 12 PRO CB 1 1 12 7167 1 1 12 PRO CD C -2.532 -9.415 -5.303 1.00 . A A . 12 PRO CD 1 1 12 7168 1 1 12 PRO CG C -2.437 -10.090 -3.963 1.00 . A A . 12 PRO CG 1 1 12 7169 1 1 12 PRO HA H -5.497 -8.966 -4.139 1.00 . A A . 12 PRO HA 1 1 12 7170 1 1 12 PRO HB2 H -3.810 -10.077 -2.325 1.00 . A A . 12 PRO HB2 1 1 12 7171 1 1 12 PRO HB3 H -4.385 -10.940 -3.756 1.00 . A A . 12 PRO HB3 1 1 12 7172 1 1 12 PRO HD2 H -1.634 -8.849 -5.505 1.00 . A A . 12 PRO HD2 1 1 12 7173 1 1 12 PRO HD3 H -2.703 -10.144 -6.082 1.00 . A A . 12 PRO HD3 1 1 12 7174 1 1 12 PRO HG2 H -1.778 -9.538 -3.311 1.00 . A A . 12 PRO HG2 1 1 12 7175 1 1 12 PRO HG3 H -2.089 -11.106 -4.079 1.00 . A A . 12 PRO HG3 1 1 12 7176 1 1 12 PRO N N -3.694 -8.523 -5.155 1.00 . A A . 12 PRO N 1 1 12 7177 1 1 12 PRO O O -5.282 -7.311 -2.239 1.00 . A A . 12 PRO O 1 1 12 7178 1 1 13 TYR C C -3.095 -4.713 -2.451 1.00 . A A . 13 TYR C 1 1 12 7179 1 1 13 TYR CA C -2.836 -6.078 -1.819 1.00 . A A . 13 TYR CA 1 1 12 7180 1 1 13 TYR CB C -1.392 -6.155 -1.321 1.00 . A A . 13 TYR CB 1 1 12 7181 1 1 13 TYR CD1 C -1.404 -7.881 0.523 1.00 . A A . 13 TYR CD1 1 1 12 7182 1 1 13 TYR CD2 C -0.276 -8.413 -1.509 1.00 . A A . 13 TYR CD2 1 1 12 7183 1 1 13 TYR CE1 C -1.063 -9.116 1.040 1.00 . A A . 13 TYR CE1 1 1 12 7184 1 1 13 TYR CE2 C 0.068 -9.650 -1.000 1.00 . A A . 13 TYR CE2 1 1 12 7185 1 1 13 TYR CG C -1.017 -7.508 -0.759 1.00 . A A . 13 TYR CG 1 1 12 7186 1 1 13 TYR CZ C -0.328 -9.997 0.275 1.00 . A A . 13 TYR CZ 1 1 12 7187 1 1 13 TYR H H -2.368 -7.489 -3.325 1.00 . A A . 13 TYR H 1 1 12 7188 1 1 13 TYR HA H -3.503 -6.206 -0.980 1.00 . A A . 13 TYR HA 1 1 12 7189 1 1 13 TYR HB2 H -0.723 -5.941 -2.140 1.00 . A A . 13 TYR HB2 1 1 12 7190 1 1 13 TYR HB3 H -1.247 -5.421 -0.542 1.00 . A A . 13 TYR HB3 1 1 12 7191 1 1 13 TYR HD1 H -1.980 -7.189 1.120 1.00 . A A . 13 TYR HD1 1 1 12 7192 1 1 13 TYR HD2 H 0.033 -8.138 -2.507 1.00 . A A . 13 TYR HD2 1 1 12 7193 1 1 13 TYR HE1 H -1.373 -9.388 2.039 1.00 . A A . 13 TYR HE1 1 1 12 7194 1 1 13 TYR HE2 H 0.644 -10.340 -1.599 1.00 . A A . 13 TYR HE2 1 1 12 7195 1 1 13 TYR HH H 0.432 -11.114 1.643 1.00 . A A . 13 TYR HH 1 1 12 7196 1 1 13 TYR N N -3.101 -7.151 -2.770 1.00 . A A . 13 TYR N 1 1 12 7197 1 1 13 TYR O O -2.910 -4.529 -3.654 1.00 . A A . 13 TYR O 1 1 12 7198 1 1 13 TYR OH O 0.014 -11.228 0.787 1.00 . A A . 13 TYR OH 1 1 12 7199 1 1 14 ARG C C -3.641 -1.392 -0.985 1.00 . A A . 14 ARG C 1 1 12 7200 1 1 14 ARG CA C -3.809 -2.412 -2.107 1.00 . A A . 14 ARG CA 1 1 12 7201 1 1 14 ARG CB C -5.229 -2.338 -2.671 1.00 . A A . 14 ARG CB 1 1 12 7202 1 1 14 ARG CD C -7.168 -0.890 -3.350 1.00 . A A . 14 ARG CD 1 1 12 7203 1 1 14 ARG CG C -5.825 -0.940 -2.639 1.00 . A A . 14 ARG CG 1 1 12 7204 1 1 14 ARG CZ C -8.015 -1.066 -5.651 1.00 . A A . 14 ARG CZ 1 1 12 7205 1 1 14 ARG H H -3.652 -3.968 -0.681 1.00 . A A . 14 ARG H 1 1 12 7206 1 1 14 ARG HA H -3.106 -2.183 -2.894 1.00 . A A . 14 ARG HA 1 1 12 7207 1 1 14 ARG HB2 H -5.215 -2.676 -3.697 1.00 . A A . 14 ARG HB2 1 1 12 7208 1 1 14 ARG HB3 H -5.867 -2.991 -2.094 1.00 . A A . 14 ARG HB3 1 1 12 7209 1 1 14 ARG HD2 H -7.849 -1.565 -2.853 1.00 . A A . 14 ARG HD2 1 1 12 7210 1 1 14 ARG HD3 H -7.553 0.117 -3.292 1.00 . A A . 14 ARG HD3 1 1 12 7211 1 1 14 ARG HE H -6.230 -1.714 -5.041 1.00 . A A . 14 ARG HE 1 1 12 7212 1 1 14 ARG HG2 H -5.963 -0.641 -1.610 1.00 . A A . 14 ARG HG2 1 1 12 7213 1 1 14 ARG HG3 H -5.144 -0.258 -3.125 1.00 . A A . 14 ARG HG3 1 1 12 7214 1 1 14 ARG HH11 H -9.280 -0.186 -4.344 1.00 . A A . 14 ARG HH11 1 1 12 7215 1 1 14 ARG HH12 H -9.865 -0.316 -5.970 1.00 . A A . 14 ARG HH12 1 1 12 7216 1 1 14 ARG HH21 H -6.989 -1.891 -7.185 1.00 . A A . 14 ARG HH21 1 1 12 7217 1 1 14 ARG HH22 H -8.562 -1.287 -7.585 1.00 . A A . 14 ARG HH22 1 1 12 7218 1 1 14 ARG N N -3.524 -3.760 -1.630 1.00 . A A . 14 ARG N 1 1 12 7219 1 1 14 ARG NE N -7.058 -1.276 -4.754 1.00 . A A . 14 ARG NE 1 1 12 7220 1 1 14 ARG NH1 N -9.146 -0.475 -5.292 1.00 . A A . 14 ARG NH1 1 1 12 7221 1 1 14 ARG NH2 N -7.841 -1.446 -6.911 1.00 . A A . 14 ARG NH2 1 1 12 7222 1 1 14 ARG O O -4.022 -1.643 0.159 1.00 . A A . 14 ARG O 1 1 12 7223 1 1 15 CYS C C -4.110 1.659 -0.159 1.00 . A A . 15 CYS C 1 1 12 7224 1 1 15 CYS CA C -2.849 0.818 -0.343 1.00 . A A . 15 CYS CA 1 1 12 7225 1 1 15 CYS CB C -1.686 1.711 -0.780 1.00 . A A . 15 CYS CB 1 1 12 7226 1 1 15 CYS H H -2.787 -0.099 -2.250 1.00 . A A . 15 CYS H 1 1 12 7227 1 1 15 CYS HA H -2.601 0.354 0.599 1.00 . A A . 15 CYS HA 1 1 12 7228 1 1 15 CYS HB2 H -0.874 1.088 -1.124 1.00 . A A . 15 CYS HB2 1 1 12 7229 1 1 15 CYS HB3 H -2.015 2.347 -1.589 1.00 . A A . 15 CYS HB3 1 1 12 7230 1 1 15 CYS N N -3.069 -0.240 -1.321 1.00 . A A . 15 CYS N 1 1 12 7231 1 1 15 CYS O O -4.221 2.757 -0.704 1.00 . A A . 15 CYS O 1 1 12 7232 1 1 15 CYS SG S -1.037 2.785 0.541 1.00 . A A . 15 CYS SG 1 1 12 7233 1 1 16 ALA C C -6.062 3.321 1.125 1.00 . A A . 16 ALA C 1 1 12 7234 1 1 16 ALA CA C -6.308 1.838 0.870 1.00 . A A . 16 ALA CA 1 1 12 7235 1 1 16 ALA CB C -7.032 1.209 2.051 1.00 . A A . 16 ALA CB 1 1 12 7236 1 1 16 ALA H H -4.910 0.256 1.019 1.00 . A A . 16 ALA H 1 1 12 7237 1 1 16 ALA HA H -6.935 1.732 -0.004 1.00 . A A . 16 ALA HA 1 1 12 7238 1 1 16 ALA HB1 H -6.605 1.578 2.972 1.00 . A A . 16 ALA HB1 1 1 12 7239 1 1 16 ALA HB2 H -8.080 1.470 2.009 1.00 . A A . 16 ALA HB2 1 1 12 7240 1 1 16 ALA HB3 H -6.926 0.136 2.009 1.00 . A A . 16 ALA HB3 1 1 12 7241 1 1 16 ALA N N -5.057 1.135 0.612 1.00 . A A . 16 ALA N 1 1 12 7242 1 1 16 ALA O O -6.952 4.148 0.933 1.00 . A A . 16 ALA O 1 1 12 7243 1 1 17 GLU C C -4.605 5.893 0.588 1.00 . A A . 17 GLU C 1 1 12 7244 1 1 17 GLU CA C -4.488 5.033 1.843 1.00 . A A . 17 GLU CA 1 1 12 7245 1 1 17 GLU CB C -3.064 5.109 2.397 1.00 . A A . 17 GLU CB 1 1 12 7246 1 1 17 GLU CD C -3.370 5.041 4.903 1.00 . A A . 17 GLU CD 1 1 12 7247 1 1 17 GLU CG C -2.864 4.311 3.674 1.00 . A A . 17 GLU CG 1 1 12 7248 1 1 17 GLU H H -4.182 2.943 1.694 1.00 . A A . 17 GLU H 1 1 12 7249 1 1 17 GLU HA H -5.174 5.408 2.588 1.00 . A A . 17 GLU HA 1 1 12 7250 1 1 17 GLU HB2 H -2.380 4.732 1.650 1.00 . A A . 17 GLU HB2 1 1 12 7251 1 1 17 GLU HB3 H -2.825 6.142 2.602 1.00 . A A . 17 GLU HB3 1 1 12 7252 1 1 17 GLU HG2 H -3.395 3.375 3.586 1.00 . A A . 17 GLU HG2 1 1 12 7253 1 1 17 GLU HG3 H -1.809 4.114 3.799 1.00 . A A . 17 GLU HG3 1 1 12 7254 1 1 17 GLU N N -4.849 3.649 1.560 1.00 . A A . 17 GLU N 1 1 12 7255 1 1 17 GLU O O -5.292 6.915 0.584 1.00 . A A . 17 GLU O 1 1 12 7256 1 1 17 GLU OE1 O -4.440 5.679 4.815 1.00 . A A . 17 GLU OE1 1 1 12 7257 1 1 17 GLU OE2 O -2.696 4.975 5.953 1.00 . A A . 17 GLU OE2 1 1 12 7258 1 1 18 CYS C C -4.754 5.444 -2.789 1.00 . A A . 18 CYS C 1 1 12 7259 1 1 18 CYS CA C -3.952 6.204 -1.736 1.00 . A A . 18 CYS CA 1 1 12 7260 1 1 18 CYS CB C -2.528 6.444 -2.239 1.00 . A A . 18 CYS CB 1 1 12 7261 1 1 18 CYS H H -3.396 4.651 -0.410 1.00 . A A . 18 CYS H 1 1 12 7262 1 1 18 CYS HA H -4.428 7.156 -1.558 1.00 . A A . 18 CYS HA 1 1 12 7263 1 1 18 CYS HB2 H -2.571 6.859 -3.235 1.00 . A A . 18 CYS HB2 1 1 12 7264 1 1 18 CYS HB3 H -2.036 7.147 -1.583 1.00 . A A . 18 CYS HB3 1 1 12 7265 1 1 18 CYS N N -3.927 5.473 -0.475 1.00 . A A . 18 CYS N 1 1 12 7266 1 1 18 CYS O O -5.533 6.033 -3.536 1.00 . A A . 18 CYS O 1 1 12 7267 1 1 18 CYS SG S -1.501 4.941 -2.311 1.00 . A A . 18 CYS SG 1 1 12 7268 1 1 19 GLY C C -4.333 2.619 -4.779 1.00 . A A . 19 GLY C 1 1 12 7269 1 1 19 GLY CA C -5.266 3.310 -3.806 1.00 . A A . 19 GLY CA 1 1 12 7270 1 1 19 GLY H H -3.922 3.714 -2.220 1.00 . A A . 19 GLY H 1 1 12 7271 1 1 19 GLY HA2 H -5.835 2.562 -3.275 1.00 . A A . 19 GLY HA2 1 1 12 7272 1 1 19 GLY HA3 H -5.947 3.938 -4.362 1.00 . A A . 19 GLY HA3 1 1 12 7273 1 1 19 GLY N N -4.556 4.130 -2.841 1.00 . A A . 19 GLY N 1 1 12 7274 1 1 19 GLY O O -4.651 2.472 -5.959 1.00 . A A . 19 GLY O 1 1 12 7275 1 1 20 LYS C C -2.430 0.009 -5.127 1.00 . A A . 20 LYS C 1 1 12 7276 1 1 20 LYS CA C -2.190 1.515 -5.119 1.00 . A A . 20 LYS CA 1 1 12 7277 1 1 20 LYS CB C -0.775 1.815 -4.620 1.00 . A A . 20 LYS CB 1 1 12 7278 1 1 20 LYS CD C 1.450 2.647 -5.437 1.00 . A A . 20 LYS CD 1 1 12 7279 1 1 20 LYS CE C 2.541 2.492 -6.485 1.00 . A A . 20 LYS CE 1 1 12 7280 1 1 20 LYS CG C 0.288 1.704 -5.699 1.00 . A A . 20 LYS CG 1 1 12 7281 1 1 20 LYS H H -2.977 2.341 -3.336 1.00 . A A . 20 LYS H 1 1 12 7282 1 1 20 LYS HA H -2.293 1.889 -6.127 1.00 . A A . 20 LYS HA 1 1 12 7283 1 1 20 LYS HB2 H -0.751 2.818 -4.222 1.00 . A A . 20 LYS HB2 1 1 12 7284 1 1 20 LYS HB3 H -0.530 1.118 -3.830 1.00 . A A . 20 LYS HB3 1 1 12 7285 1 1 20 LYS HD2 H 1.089 3.664 -5.456 1.00 . A A . 20 LYS HD2 1 1 12 7286 1 1 20 LYS HD3 H 1.866 2.429 -4.463 1.00 . A A . 20 LYS HD3 1 1 12 7287 1 1 20 LYS HE2 H 3.179 1.669 -6.203 1.00 . A A . 20 LYS HE2 1 1 12 7288 1 1 20 LYS HE3 H 2.079 2.280 -7.438 1.00 . A A . 20 LYS HE3 1 1 12 7289 1 1 20 LYS HG2 H 0.659 0.690 -5.724 1.00 . A A . 20 LYS HG2 1 1 12 7290 1 1 20 LYS HG3 H -0.155 1.951 -6.654 1.00 . A A . 20 LYS HG3 1 1 12 7291 1 1 20 LYS HZ1 H 4.169 3.553 -7.252 1.00 . A A . 20 LYS HZ1 1 1 12 7292 1 1 20 LYS HZ2 H 3.736 4.004 -5.680 1.00 . A A . 20 LYS HZ2 1 1 12 7293 1 1 20 LYS HZ3 H 2.793 4.503 -6.992 1.00 . A A . 20 LYS HZ3 1 1 12 7294 1 1 20 LYS N N -3.174 2.195 -4.286 1.00 . A A . 20 LYS N 1 1 12 7295 1 1 20 LYS NZ N 3.368 3.724 -6.611 1.00 . A A . 20 LYS NZ 1 1 12 7296 1 1 20 LYS O O -3.358 -0.484 -4.487 1.00 . A A . 20 LYS O 1 1 12 7297 1 1 21 ALA C C -0.345 -2.839 -5.781 1.00 . A A . 21 ALA C 1 1 12 7298 1 1 21 ALA CA C -1.705 -2.167 -5.941 1.00 . A A . 21 ALA CA 1 1 12 7299 1 1 21 ALA CB C -2.341 -2.565 -7.264 1.00 . A A . 21 ALA CB 1 1 12 7300 1 1 21 ALA H H -0.866 -0.266 -6.342 1.00 . A A . 21 ALA H 1 1 12 7301 1 1 21 ALA HA H -2.355 -2.497 -5.143 1.00 . A A . 21 ALA HA 1 1 12 7302 1 1 21 ALA HB1 H -3.137 -1.876 -7.502 1.00 . A A . 21 ALA HB1 1 1 12 7303 1 1 21 ALA HB2 H -1.594 -2.536 -8.045 1.00 . A A . 21 ALA HB2 1 1 12 7304 1 1 21 ALA HB3 H -2.740 -3.565 -7.185 1.00 . A A . 21 ALA HB3 1 1 12 7305 1 1 21 ALA N N -1.586 -0.716 -5.854 1.00 . A A . 21 ALA N 1 1 12 7306 1 1 21 ALA O O 0.640 -2.423 -6.391 1.00 . A A . 21 ALA O 1 1 12 7307 1 1 22 PHE C C 0.701 -6.117 -4.754 1.00 . A A . 22 PHE C 1 1 12 7308 1 1 22 PHE CA C 0.940 -4.610 -4.716 1.00 . A A . 22 PHE CA 1 1 12 7309 1 1 22 PHE CB C 1.538 -4.211 -3.365 1.00 . A A . 22 PHE CB 1 1 12 7310 1 1 22 PHE CD1 C 1.002 -1.813 -2.855 1.00 . A A . 22 PHE CD1 1 1 12 7311 1 1 22 PHE CD2 C 3.192 -2.344 -3.635 1.00 . A A . 22 PHE CD2 1 1 12 7312 1 1 22 PHE CE1 C 1.349 -0.477 -2.780 1.00 . A A . 22 PHE CE1 1 1 12 7313 1 1 22 PHE CE2 C 3.545 -1.009 -3.561 1.00 . A A . 22 PHE CE2 1 1 12 7314 1 1 22 PHE CG C 1.918 -2.760 -3.284 1.00 . A A . 22 PHE CG 1 1 12 7315 1 1 22 PHE CZ C 2.623 -0.075 -3.132 1.00 . A A . 22 PHE CZ 1 1 12 7316 1 1 22 PHE H H -1.118 -4.165 -4.500 1.00 . A A . 22 PHE H 1 1 12 7317 1 1 22 PHE HA H 1.635 -4.349 -5.499 1.00 . A A . 22 PHE HA 1 1 12 7318 1 1 22 PHE HB2 H 0.815 -4.408 -2.588 1.00 . A A . 22 PHE HB2 1 1 12 7319 1 1 22 PHE HB3 H 2.425 -4.799 -3.184 1.00 . A A . 22 PHE HB3 1 1 12 7320 1 1 22 PHE HD1 H 0.006 -2.126 -2.578 1.00 . A A . 22 PHE HD1 1 1 12 7321 1 1 22 PHE HD2 H 3.915 -3.074 -3.970 1.00 . A A . 22 PHE HD2 1 1 12 7322 1 1 22 PHE HE1 H 0.627 0.251 -2.444 1.00 . A A . 22 PHE HE1 1 1 12 7323 1 1 22 PHE HE2 H 4.542 -0.699 -3.837 1.00 . A A . 22 PHE HE2 1 1 12 7324 1 1 22 PHE HZ H 2.897 0.968 -3.074 1.00 . A A . 22 PHE HZ 1 1 12 7325 1 1 22 PHE N N -0.299 -3.881 -4.957 1.00 . A A . 22 PHE N 1 1 12 7326 1 1 22 PHE O O -0.281 -6.616 -4.202 1.00 . A A . 22 PHE O 1 1 12 7327 1 1 23 THR C C 1.876 -8.970 -4.213 1.00 . A A . 23 THR C 1 1 12 7328 1 1 23 THR CA C 1.493 -8.287 -5.521 1.00 . A A . 23 THR CA 1 1 12 7329 1 1 23 THR CB C 2.383 -8.833 -6.653 1.00 . A A . 23 THR CB 1 1 12 7330 1 1 23 THR CG2 C 3.837 -8.443 -6.434 1.00 . A A . 23 THR CG2 1 1 12 7331 1 1 23 THR H H 2.366 -6.383 -5.827 1.00 . A A . 23 THR H 1 1 12 7332 1 1 23 THR HA H 0.465 -8.524 -5.753 1.00 . A A . 23 THR HA 1 1 12 7333 1 1 23 THR HB H 2.049 -8.410 -7.589 1.00 . A A . 23 THR HB 1 1 12 7334 1 1 23 THR HG1 H 3.079 -10.627 -7.086 1.00 . A A . 23 THR HG1 1 1 12 7335 1 1 23 THR HG21 H 3.884 -7.579 -5.790 1.00 . A A . 23 THR HG21 1 1 12 7336 1 1 23 THR HG22 H 4.294 -8.208 -7.385 1.00 . A A . 23 THR HG22 1 1 12 7337 1 1 23 THR HG23 H 4.365 -9.265 -5.974 1.00 . A A . 23 THR HG23 1 1 12 7338 1 1 23 THR N N 1.606 -6.838 -5.409 1.00 . A A . 23 THR N 1 1 12 7339 1 1 23 THR O O 1.384 -10.055 -3.901 1.00 . A A . 23 THR O 1 1 12 7340 1 1 23 THR OG1 O 2.271 -10.259 -6.719 1.00 . A A . 23 THR OG1 1 1 12 7341 1 1 24 ASP C C 2.933 -7.895 -1.040 1.00 . A A . 24 ASP C 1 1 12 7342 1 1 24 ASP CA C 3.205 -8.876 -2.176 1.00 . A A . 24 ASP CA 1 1 12 7343 1 1 24 ASP CB C 4.697 -9.207 -2.235 1.00 . A A . 24 ASP CB 1 1 12 7344 1 1 24 ASP CG C 4.971 -10.519 -2.944 1.00 . A A . 24 ASP CG 1 1 12 7345 1 1 24 ASP H H 3.113 -7.468 -3.755 1.00 . A A . 24 ASP H 1 1 12 7346 1 1 24 ASP HA H 2.651 -9.784 -1.991 1.00 . A A . 24 ASP HA 1 1 12 7347 1 1 24 ASP HB2 H 5.213 -8.419 -2.763 1.00 . A A . 24 ASP HB2 1 1 12 7348 1 1 24 ASP HB3 H 5.083 -9.274 -1.229 1.00 . A A . 24 ASP HB3 1 1 12 7349 1 1 24 ASP N N 2.757 -8.330 -3.452 1.00 . A A . 24 ASP N 1 1 12 7350 1 1 24 ASP O O 2.782 -6.695 -1.266 1.00 . A A . 24 ASP O 1 1 12 7351 1 1 24 ASP OD1 O 4.780 -11.583 -2.318 1.00 . A A . 24 ASP OD1 1 1 12 7352 1 1 24 ASP OD2 O 5.376 -10.482 -4.124 1.00 . A A . 24 ASP OD2 1 1 12 7353 1 1 25 ARG C C 3.853 -6.776 1.726 1.00 . A A . 25 ARG C 1 1 12 7354 1 1 25 ARG CA C 2.615 -7.586 1.353 1.00 . A A . 25 ARG CA 1 1 12 7355 1 1 25 ARG CB C 2.185 -8.455 2.536 1.00 . A A . 25 ARG CB 1 1 12 7356 1 1 25 ARG CD C 1.075 -8.589 4.786 1.00 . A A . 25 ARG CD 1 1 12 7357 1 1 25 ARG CG C 1.439 -7.689 3.616 1.00 . A A . 25 ARG CG 1 1 12 7358 1 1 25 ARG CZ C -0.429 -10.494 5.177 1.00 . A A . 25 ARG CZ 1 1 12 7359 1 1 25 ARG H H 2.999 -9.380 0.298 1.00 . A A . 25 ARG H 1 1 12 7360 1 1 25 ARG HA H 1.814 -6.905 1.109 1.00 . A A . 25 ARG HA 1 1 12 7361 1 1 25 ARG HB2 H 1.540 -9.243 2.174 1.00 . A A . 25 ARG HB2 1 1 12 7362 1 1 25 ARG HB3 H 3.064 -8.897 2.980 1.00 . A A . 25 ARG HB3 1 1 12 7363 1 1 25 ARG HD2 H 1.903 -9.253 4.985 1.00 . A A . 25 ARG HD2 1 1 12 7364 1 1 25 ARG HD3 H 0.893 -7.972 5.654 1.00 . A A . 25 ARG HD3 1 1 12 7365 1 1 25 ARG HE H -0.714 -9.081 3.799 1.00 . A A . 25 ARG HE 1 1 12 7366 1 1 25 ARG HG2 H 2.068 -6.887 3.975 1.00 . A A . 25 ARG HG2 1 1 12 7367 1 1 25 ARG HG3 H 0.535 -7.278 3.193 1.00 . A A . 25 ARG HG3 1 1 12 7368 1 1 25 ARG HH11 H 1.190 -10.428 6.383 1.00 . A A . 25 ARG HH11 1 1 12 7369 1 1 25 ARG HH12 H 0.122 -11.766 6.648 1.00 . A A . 25 ARG HH12 1 1 12 7370 1 1 25 ARG HH21 H -2.128 -10.838 4.137 1.00 . A A . 25 ARG HH21 1 1 12 7371 1 1 25 ARG HH22 H -1.765 -11.999 5.369 1.00 . A A . 25 ARG HH22 1 1 12 7372 1 1 25 ARG N N 2.871 -8.415 0.182 1.00 . A A . 25 ARG N 1 1 12 7373 1 1 25 ARG NE N -0.117 -9.387 4.513 1.00 . A A . 25 ARG NE 1 1 12 7374 1 1 25 ARG NH1 N 0.360 -10.932 6.149 1.00 . A A . 25 ARG NH1 1 1 12 7375 1 1 25 ARG NH2 N -1.531 -11.166 4.869 1.00 . A A . 25 ARG NH2 1 1 12 7376 1 1 25 ARG O O 3.762 -5.582 2.013 1.00 . A A . 25 ARG O 1 1 12 7377 1 1 26 SER C C 6.429 -5.478 1.278 1.00 . A A . 26 SER C 1 1 12 7378 1 1 26 SER CA C 6.263 -6.775 2.064 1.00 . A A . 26 SER CA 1 1 12 7379 1 1 26 SER CB C 7.444 -7.708 1.786 1.00 . A A . 26 SER CB 1 1 12 7380 1 1 26 SER H H 5.015 -8.384 1.484 1.00 . A A . 26 SER H 1 1 12 7381 1 1 26 SER HA H 6.239 -6.543 3.118 1.00 . A A . 26 SER HA 1 1 12 7382 1 1 26 SER HB2 H 7.292 -8.642 2.304 1.00 . A A . 26 SER HB2 1 1 12 7383 1 1 26 SER HB3 H 7.511 -7.892 0.724 1.00 . A A . 26 SER HB3 1 1 12 7384 1 1 26 SER HG H 9.280 -7.089 1.495 1.00 . A A . 26 SER HG 1 1 12 7385 1 1 26 SER N N 5.008 -7.433 1.721 1.00 . A A . 26 SER N 1 1 12 7386 1 1 26 SER O O 6.627 -4.411 1.856 1.00 . A A . 26 SER O 1 1 12 7387 1 1 26 SER OG O 8.662 -7.134 2.228 1.00 . A A . 26 SER OG 1 1 12 7388 1 1 27 ASN C C 5.487 -3.330 -0.530 1.00 . A A . 27 ASN C 1 1 12 7389 1 1 27 ASN CA C 6.488 -4.416 -0.911 1.00 . A A . 27 ASN CA 1 1 12 7390 1 1 27 ASN CB C 6.290 -4.817 -2.375 1.00 . A A . 27 ASN CB 1 1 12 7391 1 1 27 ASN CG C 7.476 -5.582 -2.930 1.00 . A A . 27 ASN CG 1 1 12 7392 1 1 27 ASN H H 6.187 -6.460 -0.448 1.00 . A A . 27 ASN H 1 1 12 7393 1 1 27 ASN HA H 7.487 -4.029 -0.785 1.00 . A A . 27 ASN HA 1 1 12 7394 1 1 27 ASN HB2 H 5.414 -5.443 -2.455 1.00 . A A . 27 ASN HB2 1 1 12 7395 1 1 27 ASN HB3 H 6.148 -3.927 -2.970 1.00 . A A . 27 ASN HB3 1 1 12 7396 1 1 27 ASN HD21 H 6.540 -5.820 -4.668 1.00 . A A . 27 ASN HD21 1 1 12 7397 1 1 27 ASN HD22 H 8.119 -6.513 -4.564 1.00 . A A . 27 ASN HD22 1 1 12 7398 1 1 27 ASN N N 6.347 -5.581 -0.045 1.00 . A A . 27 ASN N 1 1 12 7399 1 1 27 ASN ND2 N 7.368 -6.015 -4.180 1.00 . A A . 27 ASN ND2 1 1 12 7400 1 1 27 ASN O O 5.819 -2.144 -0.511 1.00 . A A . 27 ASN O 1 1 12 7401 1 1 27 ASN OD1 O 8.478 -5.781 -2.242 1.00 . A A . 27 ASN OD1 1 1 12 7402 1 1 28 LEU C C 3.612 -2.012 1.394 1.00 . A A . 28 LEU C 1 1 12 7403 1 1 28 LEU CA C 3.210 -2.805 0.154 1.00 . A A . 28 LEU CA 1 1 12 7404 1 1 28 LEU CB C 1.902 -3.553 0.414 1.00 . A A . 28 LEU CB 1 1 12 7405 1 1 28 LEU CD1 C 0.282 -1.651 0.215 1.00 . A A . 28 LEU CD1 1 1 12 7406 1 1 28 LEU CD2 C -0.331 -3.678 1.546 1.00 . A A . 28 LEU CD2 1 1 12 7407 1 1 28 LEU CG C 0.803 -2.757 1.119 1.00 . A A . 28 LEU CG 1 1 12 7408 1 1 28 LEU H H 4.056 -4.700 -0.261 1.00 . A A . 28 LEU H 1 1 12 7409 1 1 28 LEU HA H 3.066 -2.118 -0.667 1.00 . A A . 28 LEU HA 1 1 12 7410 1 1 28 LEU HB2 H 1.514 -3.882 -0.537 1.00 . A A . 28 LEU HB2 1 1 12 7411 1 1 28 LEU HB3 H 2.131 -4.415 1.025 1.00 . A A . 28 LEU HB3 1 1 12 7412 1 1 28 LEU HD11 H -0.425 -2.064 -0.489 1.00 . A A . 28 LEU HD11 1 1 12 7413 1 1 28 LEU HD12 H 1.107 -1.207 -0.322 1.00 . A A . 28 LEU HD12 1 1 12 7414 1 1 28 LEU HD13 H -0.206 -0.896 0.815 1.00 . A A . 28 LEU HD13 1 1 12 7415 1 1 28 LEU HD21 H -0.265 -4.608 1.002 1.00 . A A . 28 LEU HD21 1 1 12 7416 1 1 28 LEU HD22 H -1.278 -3.203 1.335 1.00 . A A . 28 LEU HD22 1 1 12 7417 1 1 28 LEU HD23 H -0.256 -3.874 2.606 1.00 . A A . 28 LEU HD23 1 1 12 7418 1 1 28 LEU HG H 1.213 -2.297 2.007 1.00 . A A . 28 LEU HG 1 1 12 7419 1 1 28 LEU N N 4.261 -3.742 -0.228 1.00 . A A . 28 LEU N 1 1 12 7420 1 1 28 LEU O O 3.514 -0.785 1.418 1.00 . A A . 28 LEU O 1 1 12 7421 1 1 29 PHE C C 5.525 -1.001 3.397 1.00 . A A . 29 PHE C 1 1 12 7422 1 1 29 PHE CA C 4.484 -2.084 3.665 1.00 . A A . 29 PHE CA 1 1 12 7423 1 1 29 PHE CB C 5.053 -3.126 4.630 1.00 . A A . 29 PHE CB 1 1 12 7424 1 1 29 PHE CD1 C 3.390 -3.030 6.507 1.00 . A A . 29 PHE CD1 1 1 12 7425 1 1 29 PHE CD2 C 3.657 -5.089 5.334 1.00 . A A . 29 PHE CD2 1 1 12 7426 1 1 29 PHE CE1 C 2.431 -3.612 7.316 1.00 . A A . 29 PHE CE1 1 1 12 7427 1 1 29 PHE CE2 C 2.699 -5.676 6.139 1.00 . A A . 29 PHE CE2 1 1 12 7428 1 1 29 PHE CG C 4.012 -3.761 5.508 1.00 . A A . 29 PHE CG 1 1 12 7429 1 1 29 PHE CZ C 2.087 -4.936 7.132 1.00 . A A . 29 PHE CZ 1 1 12 7430 1 1 29 PHE H H 4.122 -3.697 2.342 1.00 . A A . 29 PHE H 1 1 12 7431 1 1 29 PHE HA H 3.614 -1.629 4.111 1.00 . A A . 29 PHE HA 1 1 12 7432 1 1 29 PHE HB2 H 5.531 -3.910 4.062 1.00 . A A . 29 PHE HB2 1 1 12 7433 1 1 29 PHE HB3 H 5.784 -2.653 5.269 1.00 . A A . 29 PHE HB3 1 1 12 7434 1 1 29 PHE HD1 H 3.659 -1.993 6.651 1.00 . A A . 29 PHE HD1 1 1 12 7435 1 1 29 PHE HD2 H 4.137 -5.669 4.559 1.00 . A A . 29 PHE HD2 1 1 12 7436 1 1 29 PHE HE1 H 1.954 -3.030 8.091 1.00 . A A . 29 PHE HE1 1 1 12 7437 1 1 29 PHE HE2 H 2.432 -6.712 5.994 1.00 . A A . 29 PHE HE2 1 1 12 7438 1 1 29 PHE HZ H 1.338 -5.392 7.763 1.00 . A A . 29 PHE HZ 1 1 12 7439 1 1 29 PHE N N 4.067 -2.722 2.421 1.00 . A A . 29 PHE N 1 1 12 7440 1 1 29 PHE O O 5.414 0.120 3.895 1.00 . A A . 29 PHE O 1 1 12 7441 1 1 30 THR C C 7.032 0.876 1.670 1.00 . A A . 30 THR C 1 1 12 7442 1 1 30 THR CA C 7.601 -0.403 2.276 1.00 . A A . 30 THR CA 1 1 12 7443 1 1 30 THR CB C 8.610 -1.020 1.289 1.00 . A A . 30 THR CB 1 1 12 7444 1 1 30 THR CG2 C 9.680 -0.009 0.906 1.00 . A A . 30 THR CG2 1 1 12 7445 1 1 30 THR H H 6.572 -2.252 2.243 1.00 . A A . 30 THR H 1 1 12 7446 1 1 30 THR HA H 8.125 -0.156 3.187 1.00 . A A . 30 THR HA 1 1 12 7447 1 1 30 THR HB H 8.080 -1.318 0.395 1.00 . A A . 30 THR HB 1 1 12 7448 1 1 30 THR HG1 H 9.500 -1.969 2.771 1.00 . A A . 30 THR HG1 1 1 12 7449 1 1 30 THR HG21 H 9.210 0.917 0.611 1.00 . A A . 30 THR HG21 1 1 12 7450 1 1 30 THR HG22 H 10.262 -0.396 0.083 1.00 . A A . 30 THR HG22 1 1 12 7451 1 1 30 THR HG23 H 10.326 0.169 1.753 1.00 . A A . 30 THR HG23 1 1 12 7452 1 1 30 THR N N 6.539 -1.344 2.608 1.00 . A A . 30 THR N 1 1 12 7453 1 1 30 THR O O 7.568 1.965 1.880 1.00 . A A . 30 THR O 1 1 12 7454 1 1 30 THR OG1 O 9.224 -2.174 1.874 1.00 . A A . 30 THR OG1 1 1 12 7455 1 1 31 HIS C C 4.527 2.707 1.307 1.00 . A A . 31 HIS C 1 1 12 7456 1 1 31 HIS CA C 5.303 1.882 0.284 1.00 . A A . 31 HIS CA 1 1 12 7457 1 1 31 HIS CB C 4.364 1.415 -0.829 1.00 . A A . 31 HIS CB 1 1 12 7458 1 1 31 HIS CD2 C 2.065 2.611 -0.723 1.00 . A A . 31 HIS CD2 1 1 12 7459 1 1 31 HIS CE1 C 2.424 4.134 -2.259 1.00 . A A . 31 HIS CE1 1 1 12 7460 1 1 31 HIS CG C 3.320 2.425 -1.195 1.00 . A A . 31 HIS CG 1 1 12 7461 1 1 31 HIS H H 5.565 -0.157 0.789 1.00 . A A . 31 HIS H 1 1 12 7462 1 1 31 HIS HA H 6.077 2.500 -0.145 1.00 . A A . 31 HIS HA 1 1 12 7463 1 1 31 HIS HB2 H 4.945 1.204 -1.715 1.00 . A A . 31 HIS HB2 1 1 12 7464 1 1 31 HIS HB3 H 3.859 0.514 -0.511 1.00 . A A . 31 HIS HB3 1 1 12 7465 1 1 31 HIS HD1 H 4.330 3.521 -2.684 1.00 . A A . 31 HIS HD1 1 1 12 7466 1 1 31 HIS HD2 H 1.575 2.028 0.044 1.00 . A A . 31 HIS HD2 1 1 12 7467 1 1 31 HIS HE1 H 2.287 4.968 -2.931 1.00 . A A . 31 HIS HE1 1 1 12 7468 1 1 31 HIS N N 5.945 0.737 0.919 1.00 . A A . 31 HIS N 1 1 12 7469 1 1 31 HIS ND1 N 3.514 3.394 -2.157 1.00 . A A . 31 HIS ND1 1 1 12 7470 1 1 31 HIS NE2 N 1.530 3.679 -1.400 1.00 . A A . 31 HIS NE2 1 1 12 7471 1 1 31 HIS O O 4.554 3.937 1.275 1.00 . A A . 31 HIS O 1 1 12 7472 1 1 32 GLN C C 3.903 3.704 4.001 1.00 . A A . 32 GLN C 1 1 12 7473 1 1 32 GLN CA C 3.052 2.690 3.243 1.00 . A A . 32 GLN CA 1 1 12 7474 1 1 32 GLN CB C 2.470 1.665 4.217 1.00 . A A . 32 GLN CB 1 1 12 7475 1 1 32 GLN CD C 0.920 -0.301 4.555 1.00 . A A . 32 GLN CD 1 1 12 7476 1 1 32 GLN CG C 1.512 0.681 3.564 1.00 . A A . 32 GLN CG 1 1 12 7477 1 1 32 GLN H H 3.855 1.042 2.185 1.00 . A A . 32 GLN H 1 1 12 7478 1 1 32 GLN HA H 2.242 3.211 2.756 1.00 . A A . 32 GLN HA 1 1 12 7479 1 1 32 GLN HB2 H 3.281 1.105 4.659 1.00 . A A . 32 GLN HB2 1 1 12 7480 1 1 32 GLN HB3 H 1.937 2.189 4.997 1.00 . A A . 32 GLN HB3 1 1 12 7481 1 1 32 GLN HE21 H -0.079 -1.210 3.095 1.00 . A A . 32 GLN HE21 1 1 12 7482 1 1 32 GLN HE22 H -0.299 -1.867 4.678 1.00 . A A . 32 GLN HE22 1 1 12 7483 1 1 32 GLN HG2 H 0.706 1.234 3.105 1.00 . A A . 32 GLN HG2 1 1 12 7484 1 1 32 GLN HG3 H 2.046 0.128 2.806 1.00 . A A . 32 GLN HG3 1 1 12 7485 1 1 32 GLN N N 3.837 2.020 2.212 1.00 . A A . 32 GLN N 1 1 12 7486 1 1 32 GLN NE2 N 0.097 -1.218 4.060 1.00 . A A . 32 GLN NE2 1 1 12 7487 1 1 32 GLN O O 3.379 4.571 4.701 1.00 . A A . 32 GLN O 1 1 12 7488 1 1 32 GLN OE1 O 1.199 -0.238 5.753 1.00 . A A . 32 GLN OE1 1 1 12 7489 1 1 33 LYS C C 5.871 5.942 4.132 1.00 . A A . 33 LYS C 1 1 12 7490 1 1 33 LYS CA C 6.144 4.495 4.529 1.00 . A A . 33 LYS CA 1 1 12 7491 1 1 33 LYS CB C 7.589 4.125 4.189 1.00 . A A . 33 LYS CB 1 1 12 7492 1 1 33 LYS CD C 9.530 2.784 5.051 1.00 . A A . 33 LYS CD 1 1 12 7493 1 1 33 LYS CE C 10.313 2.372 3.814 1.00 . A A . 33 LYS CE 1 1 12 7494 1 1 33 LYS CG C 8.034 2.801 4.784 1.00 . A A . 33 LYS CG 1 1 12 7495 1 1 33 LYS H H 5.577 2.877 3.287 1.00 . A A . 33 LYS H 1 1 12 7496 1 1 33 LYS HA H 5.996 4.393 5.593 1.00 . A A . 33 LYS HA 1 1 12 7497 1 1 33 LYS HB2 H 7.690 4.065 3.115 1.00 . A A . 33 LYS HB2 1 1 12 7498 1 1 33 LYS HB3 H 8.244 4.901 4.560 1.00 . A A . 33 LYS HB3 1 1 12 7499 1 1 33 LYS HD2 H 9.845 3.773 5.350 1.00 . A A . 33 LYS HD2 1 1 12 7500 1 1 33 LYS HD3 H 9.737 2.083 5.848 1.00 . A A . 33 LYS HD3 1 1 12 7501 1 1 33 LYS HE2 H 10.291 1.296 3.732 1.00 . A A . 33 LYS HE2 1 1 12 7502 1 1 33 LYS HE3 H 9.843 2.809 2.945 1.00 . A A . 33 LYS HE3 1 1 12 7503 1 1 33 LYS HG2 H 7.512 2.641 5.716 1.00 . A A . 33 LYS HG2 1 1 12 7504 1 1 33 LYS HG3 H 7.792 2.006 4.093 1.00 . A A . 33 LYS HG3 1 1 12 7505 1 1 33 LYS HZ1 H 11.881 3.621 3.227 1.00 . A A . 33 LYS HZ1 1 1 12 7506 1 1 33 LYS HZ2 H 12.366 2.046 3.610 1.00 . A A . 33 LYS HZ2 1 1 12 7507 1 1 33 LYS HZ3 H 11.964 3.131 4.844 1.00 . A A . 33 LYS HZ3 1 1 12 7508 1 1 33 LYS N N 5.219 3.589 3.858 1.00 . A A . 33 LYS N 1 1 12 7509 1 1 33 LYS NZ N 11.730 2.825 3.878 1.00 . A A . 33 LYS NZ 1 1 12 7510 1 1 33 LYS O O 6.263 6.873 4.836 1.00 . A A . 33 LYS O 1 1 12 7511 1 1 34 ILE C C 3.663 8.032 3.246 1.00 . A A . 34 ILE C 1 1 12 7512 1 1 34 ILE CA C 4.871 7.458 2.513 1.00 . A A . 34 ILE CA 1 1 12 7513 1 1 34 ILE CB C 4.581 7.448 1.000 1.00 . A A . 34 ILE CB 1 1 12 7514 1 1 34 ILE CD1 C 2.819 6.837 -0.732 1.00 . A A . 34 ILE CD1 1 1 12 7515 1 1 34 ILE CG1 C 3.241 6.767 0.719 1.00 . A A . 34 ILE CG1 1 1 12 7516 1 1 34 ILE CG2 C 5.705 6.749 0.250 1.00 . A A . 34 ILE CG2 1 1 12 7517 1 1 34 ILE H H 4.912 5.342 2.484 1.00 . A A . 34 ILE H 1 1 12 7518 1 1 34 ILE HA H 5.724 8.096 2.692 1.00 . A A . 34 ILE HA 1 1 12 7519 1 1 34 ILE HB H 4.536 8.471 0.659 1.00 . A A . 34 ILE HB 1 1 12 7520 1 1 34 ILE HD11 H 3.417 6.151 -1.314 1.00 . A A . 34 ILE HD11 1 1 12 7521 1 1 34 ILE HD12 H 1.777 6.567 -0.818 1.00 . A A . 34 ILE HD12 1 1 12 7522 1 1 34 ILE HD13 H 2.963 7.841 -1.100 1.00 . A A . 34 ILE HD13 1 1 12 7523 1 1 34 ILE HG12 H 3.309 5.726 0.994 1.00 . A A . 34 ILE HG12 1 1 12 7524 1 1 34 ILE HG13 H 2.473 7.242 1.313 1.00 . A A . 34 ILE HG13 1 1 12 7525 1 1 34 ILE HG21 H 6.158 6.006 0.891 1.00 . A A . 34 ILE HG21 1 1 12 7526 1 1 34 ILE HG22 H 5.305 6.268 -0.630 1.00 . A A . 34 ILE HG22 1 1 12 7527 1 1 34 ILE HG23 H 6.449 7.474 -0.042 1.00 . A A . 34 ILE HG23 1 1 12 7528 1 1 34 ILE N N 5.197 6.124 3.001 1.00 . A A . 34 ILE N 1 1 12 7529 1 1 34 ILE O O 3.353 9.217 3.122 1.00 . A A . 34 ILE O 1 1 12 7530 1 1 35 HIS C C 2.048 7.450 6.269 1.00 . A A . 35 HIS C 1 1 12 7531 1 1 35 HIS CA C 1.812 7.606 4.769 1.00 . A A . 35 HIS CA 1 1 12 7532 1 1 35 HIS CB C 0.587 6.795 4.347 1.00 . A A . 35 HIS CB 1 1 12 7533 1 1 35 HIS CD2 C 0.364 5.702 2.005 1.00 . A A . 35 HIS CD2 1 1 12 7534 1 1 35 HIS CE1 C 0.020 7.522 0.833 1.00 . A A . 35 HIS CE1 1 1 12 7535 1 1 35 HIS CG C 0.382 6.748 2.864 1.00 . A A . 35 HIS CG 1 1 12 7536 1 1 35 HIS H H 3.281 6.251 4.071 1.00 . A A . 35 HIS H 1 1 12 7537 1 1 35 HIS HA H 1.636 8.649 4.552 1.00 . A A . 35 HIS HA 1 1 12 7538 1 1 35 HIS HB2 H 0.697 5.780 4.698 1.00 . A A . 35 HIS HB2 1 1 12 7539 1 1 35 HIS HB3 H -0.296 7.232 4.791 1.00 . A A . 35 HIS HB3 1 1 12 7540 1 1 35 HIS HD1 H 0.121 8.794 2.432 1.00 . A A . 35 HIS HD1 1 1 12 7541 1 1 35 HIS HD2 H 0.503 4.660 2.260 1.00 . A A . 35 HIS HD2 1 1 12 7542 1 1 35 HIS HE1 H -0.162 8.193 0.007 1.00 . A A . 35 HIS HE1 1 1 12 7543 1 1 35 HIS N N 2.985 7.183 4.013 1.00 . A A . 35 HIS N 1 1 12 7544 1 1 35 HIS ND1 N 0.165 7.874 2.098 1.00 . A A . 35 HIS ND1 1 1 12 7545 1 1 35 HIS NE2 N 0.138 6.209 0.750 1.00 . A A . 35 HIS NE2 1 1 12 7546 1 1 35 HIS O O 1.964 8.418 7.026 1.00 . A A . 35 HIS O 1 1 12 7547 1 1 36 THR C C 1.725 6.823 8.997 1.00 . A A . 36 THR C 1 1 12 7548 1 1 36 THR CA C 2.587 5.942 8.101 1.00 . A A . 36 THR CA 1 1 12 7549 1 1 36 THR CB C 4.069 6.152 8.467 1.00 . A A . 36 THR CB 1 1 12 7550 1 1 36 THR CG2 C 4.970 5.303 7.582 1.00 . A A . 36 THR CG2 1 1 12 7551 1 1 36 THR H H 2.394 5.495 6.041 1.00 . A A . 36 THR H 1 1 12 7552 1 1 36 THR HA H 2.337 4.907 8.282 1.00 . A A . 36 THR HA 1 1 12 7553 1 1 36 THR HB H 4.216 5.855 9.495 1.00 . A A . 36 THR HB 1 1 12 7554 1 1 36 THR HG1 H 3.638 8.077 8.469 1.00 . A A . 36 THR HG1 1 1 12 7555 1 1 36 THR HG21 H 5.268 4.416 8.120 1.00 . A A . 36 THR HG21 1 1 12 7556 1 1 36 THR HG22 H 5.847 5.872 7.311 1.00 . A A . 36 THR HG22 1 1 12 7557 1 1 36 THR HG23 H 4.433 5.020 6.689 1.00 . A A . 36 THR HG23 1 1 12 7558 1 1 36 THR N N 2.342 6.225 6.693 1.00 . A A . 36 THR N 1 1 12 7559 1 1 36 THR O O 2.177 7.297 10.039 1.00 . A A . 36 THR O 1 1 12 7560 1 1 36 THR OG1 O 4.417 7.534 8.325 1.00 . A A . 36 THR OG1 1 1 12 7561 1 1 37 GLY C C -1.023 8.996 8.552 1.00 . A A . 37 GLY C 1 1 12 7562 1 1 37 GLY CA C -0.428 7.863 9.364 1.00 . A A . 37 GLY CA 1 1 12 7563 1 1 37 GLY H H 0.173 6.635 7.746 1.00 . A A . 37 GLY H 1 1 12 7564 1 1 37 GLY HA2 H -1.228 7.243 9.739 1.00 . A A . 37 GLY HA2 1 1 12 7565 1 1 37 GLY HA3 H 0.113 8.281 10.201 1.00 . A A . 37 GLY HA3 1 1 12 7566 1 1 37 GLY N N 0.479 7.039 8.586 1.00 . A A . 37 GLY N 1 1 12 7567 1 1 37 GLY O O -0.496 10.108 8.547 1.00 . A A . 37 GLY O 1 1 12 7568 1 1 38 GLU C C -3.133 10.954 7.866 1.00 . A A . 38 GLU C 1 1 12 7569 1 1 38 GLU CA C -2.789 9.718 7.041 1.00 . A A . 38 GLU CA 1 1 12 7570 1 1 38 GLU CB C -4.060 9.138 6.417 1.00 . A A . 38 GLU CB 1 1 12 7571 1 1 38 GLU CD C -4.153 10.722 4.452 1.00 . A A . 38 GLU CD 1 1 12 7572 1 1 38 GLU CG C -4.886 10.161 5.655 1.00 . A A . 38 GLU CG 1 1 12 7573 1 1 38 GLU H H -2.497 7.808 7.907 1.00 . A A . 38 GLU H 1 1 12 7574 1 1 38 GLU HA H -2.110 10.004 6.252 1.00 . A A . 38 GLU HA 1 1 12 7575 1 1 38 GLU HB2 H -3.784 8.348 5.734 1.00 . A A . 38 GLU HB2 1 1 12 7576 1 1 38 GLU HB3 H -4.675 8.724 7.202 1.00 . A A . 38 GLU HB3 1 1 12 7577 1 1 38 GLU HG2 H -5.796 9.690 5.315 1.00 . A A . 38 GLU HG2 1 1 12 7578 1 1 38 GLU HG3 H -5.130 10.976 6.321 1.00 . A A . 38 GLU HG3 1 1 12 7579 1 1 38 GLU N N -2.124 8.713 7.863 1.00 . A A . 38 GLU N 1 1 12 7580 1 1 38 GLU O O -3.900 10.881 8.827 1.00 . A A . 38 GLU O 1 1 12 7581 1 1 38 GLU OE1 O -3.237 10.041 3.945 1.00 . A A . 38 GLU OE1 1 1 12 7582 1 1 38 GLU OE2 O -4.495 11.842 4.017 1.00 . A A . 38 GLU OE2 1 1 12 7583 1 1 39 LYS C C -3.171 14.455 7.208 1.00 . A A . 39 LYS C 1 1 12 7584 1 1 39 LYS CA C -2.804 13.345 8.188 1.00 . A A . 39 LYS CA 1 1 12 7585 1 1 39 LYS CB C -1.569 13.750 8.995 1.00 . A A . 39 LYS CB 1 1 12 7586 1 1 39 LYS CD C -2.497 13.638 11.326 1.00 . A A . 39 LYS CD 1 1 12 7587 1 1 39 LYS CE C -2.382 12.983 12.694 1.00 . A A . 39 LYS CE 1 1 12 7588 1 1 39 LYS CG C -1.478 13.072 10.351 1.00 . A A . 39 LYS CG 1 1 12 7589 1 1 39 LYS H H -1.957 12.086 6.712 1.00 . A A . 39 LYS H 1 1 12 7590 1 1 39 LYS HA H -3.631 13.190 8.864 1.00 . A A . 39 LYS HA 1 1 12 7591 1 1 39 LYS HB2 H -0.685 13.497 8.429 1.00 . A A . 39 LYS HB2 1 1 12 7592 1 1 39 LYS HB3 H -1.591 14.819 9.151 1.00 . A A . 39 LYS HB3 1 1 12 7593 1 1 39 LYS HD2 H -2.329 14.699 11.433 1.00 . A A . 39 LYS HD2 1 1 12 7594 1 1 39 LYS HD3 H -3.490 13.466 10.936 1.00 . A A . 39 LYS HD3 1 1 12 7595 1 1 39 LYS HE2 H -1.344 12.760 12.886 1.00 . A A . 39 LYS HE2 1 1 12 7596 1 1 39 LYS HE3 H -2.746 13.673 13.441 1.00 . A A . 39 LYS HE3 1 1 12 7597 1 1 39 LYS HG2 H -1.663 12.015 10.228 1.00 . A A . 39 LYS HG2 1 1 12 7598 1 1 39 LYS HG3 H -0.486 13.222 10.753 1.00 . A A . 39 LYS HG3 1 1 12 7599 1 1 39 LYS HZ1 H -3.647 11.655 13.696 1.00 . A A . 39 LYS HZ1 1 1 12 7600 1 1 39 LYS HZ2 H -2.544 10.901 12.658 1.00 . A A . 39 LYS HZ2 1 1 12 7601 1 1 39 LYS HZ3 H -3.891 11.703 12.022 1.00 . A A . 39 LYS HZ3 1 1 12 7602 1 1 39 LYS N N -2.560 12.091 7.485 1.00 . A A . 39 LYS N 1 1 12 7603 1 1 39 LYS NZ N -3.172 11.722 12.773 1.00 . A A . 39 LYS NZ 1 1 12 7604 1 1 39 LYS O O -2.644 14.536 6.099 1.00 . A A . 39 LYS O 1 1 12 7605 1 1 40 PRO C C -3.477 17.521 6.627 1.00 . A A . 40 PRO C 1 1 12 7606 1 1 40 PRO CA C -4.552 16.454 6.800 1.00 . A A . 40 PRO CA 1 1 12 7607 1 1 40 PRO CB C -5.739 17.014 7.587 1.00 . A A . 40 PRO CB 1 1 12 7608 1 1 40 PRO CD C -4.767 15.296 8.936 1.00 . A A . 40 PRO CD 1 1 12 7609 1 1 40 PRO CG C -5.476 16.621 9.000 1.00 . A A . 40 PRO CG 1 1 12 7610 1 1 40 PRO HA H -4.887 16.121 5.828 1.00 . A A . 40 PRO HA 1 1 12 7611 1 1 40 PRO HB2 H -5.774 18.089 7.476 1.00 . A A . 40 PRO HB2 1 1 12 7612 1 1 40 PRO HB3 H -6.657 16.579 7.221 1.00 . A A . 40 PRO HB3 1 1 12 7613 1 1 40 PRO HD2 H -4.047 15.215 9.736 1.00 . A A . 40 PRO HD2 1 1 12 7614 1 1 40 PRO HD3 H -5.478 14.485 8.982 1.00 . A A . 40 PRO HD3 1 1 12 7615 1 1 40 PRO HG2 H -4.849 17.359 9.476 1.00 . A A . 40 PRO HG2 1 1 12 7616 1 1 40 PRO HG3 H -6.410 16.519 9.532 1.00 . A A . 40 PRO HG3 1 1 12 7617 1 1 40 PRO N N -4.096 15.332 7.625 1.00 . A A . 40 PRO N 1 1 12 7618 1 1 40 PRO O O -3.441 18.506 7.364 1.00 . A A . 40 PRO O 1 1 12 7619 1 1 41 SER C C -1.785 19.037 4.091 1.00 . A A . 41 SER C 1 1 12 7620 1 1 41 SER CA C -1.523 18.263 5.379 1.00 . A A . 41 SER CA 1 1 12 7621 1 1 41 SER CB C -0.185 17.526 5.281 1.00 . A A . 41 SER CB 1 1 12 7622 1 1 41 SER H H -2.682 16.514 5.093 1.00 . A A . 41 SER H 1 1 12 7623 1 1 41 SER HA H -1.480 18.960 6.202 1.00 . A A . 41 SER HA 1 1 12 7624 1 1 41 SER HB2 H 0.621 18.231 5.414 1.00 . A A . 41 SER HB2 1 1 12 7625 1 1 41 SER HB3 H -0.135 16.772 6.054 1.00 . A A . 41 SER HB3 1 1 12 7626 1 1 41 SER HG H 0.428 17.486 3.421 1.00 . A A . 41 SER HG 1 1 12 7627 1 1 41 SER N N -2.601 17.319 5.647 1.00 . A A . 41 SER N 1 1 12 7628 1 1 41 SER O O -0.885 19.231 3.275 1.00 . A A . 41 SER O 1 1 12 7629 1 1 41 SER OG O -0.040 16.898 4.019 1.00 . A A . 41 SER OG 1 1 12 7630 1 1 42 GLY C C -2.827 19.606 1.459 1.00 . A A . 42 GLY C 1 1 12 7631 1 1 42 GLY CA C -3.388 20.225 2.724 1.00 . A A . 42 GLY CA 1 1 12 7632 1 1 42 GLY H H -3.705 19.292 4.599 1.00 . A A . 42 GLY H 1 1 12 7633 1 1 42 GLY HA2 H -4.464 20.262 2.648 1.00 . A A . 42 GLY HA2 1 1 12 7634 1 1 42 GLY HA3 H -3.009 21.232 2.817 1.00 . A A . 42 GLY HA3 1 1 12 7635 1 1 42 GLY N N -3.027 19.477 3.915 1.00 . A A . 42 GLY N 1 1 12 7636 1 1 42 GLY O O -2.502 18.419 1.414 1.00 . A A . 42 GLY O 1 1 12 7637 1 1 43 PRO C C -0.691 19.662 -0.836 1.00 . A A . 43 PRO C 1 1 12 7638 1 1 43 PRO CA C -2.184 19.968 -0.892 1.00 . A A . 43 PRO CA 1 1 12 7639 1 1 43 PRO CB C -2.452 21.155 -1.819 1.00 . A A . 43 PRO CB 1 1 12 7640 1 1 43 PRO CD C -3.076 21.846 0.382 1.00 . A A . 43 PRO CD 1 1 12 7641 1 1 43 PRO CG C -2.499 22.339 -0.916 1.00 . A A . 43 PRO CG 1 1 12 7642 1 1 43 PRO HA H -2.715 19.099 -1.253 1.00 . A A . 43 PRO HA 1 1 12 7643 1 1 43 PRO HB2 H -1.652 21.239 -2.541 1.00 . A A . 43 PRO HB2 1 1 12 7644 1 1 43 PRO HB3 H -3.392 21.012 -2.331 1.00 . A A . 43 PRO HB3 1 1 12 7645 1 1 43 PRO HD2 H -2.632 22.370 1.216 1.00 . A A . 43 PRO HD2 1 1 12 7646 1 1 43 PRO HD3 H -4.150 21.966 0.387 1.00 . A A . 43 PRO HD3 1 1 12 7647 1 1 43 PRO HG2 H -1.502 22.722 -0.761 1.00 . A A . 43 PRO HG2 1 1 12 7648 1 1 43 PRO HG3 H -3.134 23.101 -1.343 1.00 . A A . 43 PRO HG3 1 1 12 7649 1 1 43 PRO N N -2.708 20.420 0.400 1.00 . A A . 43 PRO N 1 1 12 7650 1 1 43 PRO O O 0.071 20.359 -0.167 1.00 . A A . 43 PRO O 1 1 12 7651 1 1 44 SER C C 1.845 18.852 -2.756 1.00 . A A . 44 SER C 1 1 12 7652 1 1 44 SER CA C 1.122 18.215 -1.573 1.00 . A A . 44 SER CA 1 1 12 7653 1 1 44 SER CB C 1.238 16.691 -1.650 1.00 . A A . 44 SER CB 1 1 12 7654 1 1 44 SER H H -0.935 18.098 -2.059 1.00 . A A . 44 SER H 1 1 12 7655 1 1 44 SER HA H 1.583 18.556 -0.658 1.00 . A A . 44 SER HA 1 1 12 7656 1 1 44 SER HB2 H 0.851 16.351 -2.599 1.00 . A A . 44 SER HB2 1 1 12 7657 1 1 44 SER HB3 H 2.277 16.407 -1.563 1.00 . A A . 44 SER HB3 1 1 12 7658 1 1 44 SER HG H -0.431 16.087 -0.821 1.00 . A A . 44 SER HG 1 1 12 7659 1 1 44 SER N N -0.280 18.615 -1.545 1.00 . A A . 44 SER N 1 1 12 7660 1 1 44 SER O O 1.429 18.703 -3.905 1.00 . A A . 44 SER O 1 1 12 7661 1 1 44 SER OG O 0.505 16.070 -0.608 1.00 . A A . 44 SER OG 1 1 12 7662 1 1 45 SER C C 5.118 20.542 -3.007 1.00 . A A . 45 SER C 1 1 12 7663 1 1 45 SER CA C 3.710 20.225 -3.504 1.00 . A A . 45 SER CA 1 1 12 7664 1 1 45 SER CB C 3.014 21.512 -3.951 1.00 . A A . 45 SER CB 1 1 12 7665 1 1 45 SER H H 3.212 19.643 -1.530 1.00 . A A . 45 SER H 1 1 12 7666 1 1 45 SER HA H 3.781 19.553 -4.346 1.00 . A A . 45 SER HA 1 1 12 7667 1 1 45 SER HB2 H 3.383 21.799 -4.923 1.00 . A A . 45 SER HB2 1 1 12 7668 1 1 45 SER HB3 H 1.948 21.341 -4.006 1.00 . A A . 45 SER HB3 1 1 12 7669 1 1 45 SER HG H 2.786 23.354 -3.323 1.00 . A A . 45 SER HG 1 1 12 7670 1 1 45 SER N N 2.930 19.562 -2.466 1.00 . A A . 45 SER N 1 1 12 7671 1 1 45 SER O O 5.418 20.397 -1.823 1.00 . A A . 45 SER O 1 1 12 7672 1 1 45 SER OG O 3.260 22.569 -3.039 1.00 . A A . 45 SER OG 1 1 12 7673 1 1 46 GLY C C 7.884 22.483 -4.347 1.00 . A A . 46 GLY C 1 1 12 7674 1 1 46 GLY CA C 7.344 21.305 -3.561 1.00 . A A . 46 GLY CA 1 1 12 7675 1 1 46 GLY H H 5.683 21.071 -4.853 1.00 . A A . 46 GLY H 1 1 12 7676 1 1 46 GLY HA2 H 7.378 21.543 -2.508 1.00 . A A . 46 GLY HA2 1 1 12 7677 1 1 46 GLY HA3 H 7.972 20.446 -3.747 1.00 . A A . 46 GLY HA3 1 1 12 7678 1 1 46 GLY N N 5.978 20.975 -3.924 1.00 . A A . 46 GLY N 1 1 12 7679 1 1 46 GLY O O 7.123 23.114 -5.079 1.00 . A A . 46 GLY O 1 1 12 7680 2 2 1 ZN ZN ZN -0.142 4.559 -0.484 1.00 . B A . 201 ZN ZN 1 1 13 7681 1 1 1 GLY C C -3.527 17.314 -8.693 1.00 . A A . 1 GLY C 1 1 13 7682 1 1 1 GLY CA C -3.331 18.805 -8.886 1.00 . A A . 1 GLY CA 1 1 13 7683 1 1 1 GLY H1 H -4.134 19.120 -6.952 1.00 . A A . 1 GLY H1 1 1 13 7684 1 1 1 GLY HA2 H -3.865 19.117 -9.771 1.00 . A A . 1 GLY HA2 1 1 13 7685 1 1 1 GLY HA3 H -2.278 19.002 -9.025 1.00 . A A . 1 GLY HA3 1 1 13 7686 1 1 1 GLY N N -3.806 19.579 -7.754 1.00 . A A . 1 GLY N 1 1 13 7687 1 1 1 GLY O O -3.477 16.815 -7.569 1.00 . A A . 1 GLY O 1 1 13 7688 1 1 2 SER C C -2.976 14.432 -10.644 1.00 . A A . 2 SER C 1 1 13 7689 1 1 2 SER CA C -3.964 15.160 -9.738 1.00 . A A . 2 SER CA 1 1 13 7690 1 1 2 SER CB C -5.398 14.817 -10.149 1.00 . A A . 2 SER CB 1 1 13 7691 1 1 2 SER H H -3.782 17.057 -10.659 1.00 . A A . 2 SER H 1 1 13 7692 1 1 2 SER HA H -3.805 14.839 -8.719 1.00 . A A . 2 SER HA 1 1 13 7693 1 1 2 SER HB2 H -5.585 15.196 -11.142 1.00 . A A . 2 SER HB2 1 1 13 7694 1 1 2 SER HB3 H -5.524 13.744 -10.144 1.00 . A A . 2 SER HB3 1 1 13 7695 1 1 2 SER HG H -7.214 15.348 -9.641 1.00 . A A . 2 SER HG 1 1 13 7696 1 1 2 SER N N -3.754 16.602 -9.792 1.00 . A A . 2 SER N 1 1 13 7697 1 1 2 SER O O -2.569 14.953 -11.682 1.00 . A A . 2 SER O 1 1 13 7698 1 1 2 SER OG O -6.336 15.392 -9.256 1.00 . A A . 2 SER OG 1 1 13 7699 1 1 3 SER C C -2.339 11.209 -11.624 1.00 . A A . 3 SER C 1 1 13 7700 1 1 3 SER CA C -1.649 12.425 -11.014 1.00 . A A . 3 SER CA 1 1 13 7701 1 1 3 SER CB C -0.485 11.975 -10.129 1.00 . A A . 3 SER CB 1 1 13 7702 1 1 3 SER H H -2.953 12.863 -9.405 1.00 . A A . 3 SER H 1 1 13 7703 1 1 3 SER HA H -1.265 13.044 -11.812 1.00 . A A . 3 SER HA 1 1 13 7704 1 1 3 SER HB2 H -0.842 11.820 -9.122 1.00 . A A . 3 SER HB2 1 1 13 7705 1 1 3 SER HB3 H -0.080 11.050 -10.514 1.00 . A A . 3 SER HB3 1 1 13 7706 1 1 3 SER HG H 0.331 13.623 -9.454 1.00 . A A . 3 SER HG 1 1 13 7707 1 1 3 SER N N -2.593 13.224 -10.242 1.00 . A A . 3 SER N 1 1 13 7708 1 1 3 SER O O -3.154 10.554 -10.977 1.00 . A A . 3 SER O 1 1 13 7709 1 1 3 SER OG O 0.543 12.949 -10.104 1.00 . A A . 3 SER OG 1 1 13 7710 1 1 4 GLY C C -2.654 8.541 -12.678 1.00 . A A . 4 GLY C 1 1 13 7711 1 1 4 GLY CA C -2.600 9.776 -13.555 1.00 . A A . 4 GLY CA 1 1 13 7712 1 1 4 GLY H H -1.348 11.471 -13.344 1.00 . A A . 4 GLY H 1 1 13 7713 1 1 4 GLY HA2 H -3.604 10.036 -13.855 1.00 . A A . 4 GLY HA2 1 1 13 7714 1 1 4 GLY HA3 H -2.018 9.552 -14.437 1.00 . A A . 4 GLY HA3 1 1 13 7715 1 1 4 GLY N N -2.005 10.913 -12.877 1.00 . A A . 4 GLY N 1 1 13 7716 1 1 4 GLY O O -1.794 8.343 -11.820 1.00 . A A . 4 GLY O 1 1 13 7717 1 1 5 SER C C -4.108 5.294 -13.020 1.00 . A A . 5 SER C 1 1 13 7718 1 1 5 SER CA C -3.834 6.489 -12.111 1.00 . A A . 5 SER CA 1 1 13 7719 1 1 5 SER CB C -4.976 6.653 -11.107 1.00 . A A . 5 SER CB 1 1 13 7720 1 1 5 SER H H -4.321 7.922 -13.591 1.00 . A A . 5 SER H 1 1 13 7721 1 1 5 SER HA H -2.915 6.313 -11.572 1.00 . A A . 5 SER HA 1 1 13 7722 1 1 5 SER HB2 H -5.048 5.763 -10.499 1.00 . A A . 5 SER HB2 1 1 13 7723 1 1 5 SER HB3 H -4.776 7.506 -10.474 1.00 . A A . 5 SER HB3 1 1 13 7724 1 1 5 SER HG H -6.903 7.005 -11.119 1.00 . A A . 5 SER HG 1 1 13 7725 1 1 5 SER N N -3.668 7.709 -12.893 1.00 . A A . 5 SER N 1 1 13 7726 1 1 5 SER O O -5.252 5.035 -13.394 1.00 . A A . 5 SER O 1 1 13 7727 1 1 5 SER OG O -6.213 6.855 -11.769 1.00 . A A . 5 SER OG 1 1 13 7728 1 1 6 SER C C -2.864 2.123 -13.475 1.00 . A A . 6 SER C 1 1 13 7729 1 1 6 SER CA C -3.174 3.406 -14.240 1.00 . A A . 6 SER CA 1 1 13 7730 1 1 6 SER CB C -2.237 3.536 -15.441 1.00 . A A . 6 SER CB 1 1 13 7731 1 1 6 SER H H -2.164 4.829 -13.041 1.00 . A A . 6 SER H 1 1 13 7732 1 1 6 SER HA H -4.194 3.363 -14.593 1.00 . A A . 6 SER HA 1 1 13 7733 1 1 6 SER HB2 H -2.264 2.624 -16.017 1.00 . A A . 6 SER HB2 1 1 13 7734 1 1 6 SER HB3 H -2.560 4.362 -16.059 1.00 . A A . 6 SER HB3 1 1 13 7735 1 1 6 SER HG H -0.479 4.381 -15.635 1.00 . A A . 6 SER HG 1 1 13 7736 1 1 6 SER N N -3.050 4.571 -13.371 1.00 . A A . 6 SER N 1 1 13 7737 1 1 6 SER O O -1.963 2.088 -12.638 1.00 . A A . 6 SER O 1 1 13 7738 1 1 6 SER OG O -0.903 3.773 -15.024 1.00 . A A . 6 SER OG 1 1 13 7739 1 1 7 GLY C C -3.869 -1.380 -13.939 1.00 . A A . 7 GLY C 1 1 13 7740 1 1 7 GLY CA C -3.410 -0.203 -13.102 1.00 . A A . 7 GLY CA 1 1 13 7741 1 1 7 GLY H H -4.323 1.155 -14.446 1.00 . A A . 7 GLY H 1 1 13 7742 1 1 7 GLY HA2 H -2.358 -0.316 -12.887 1.00 . A A . 7 GLY HA2 1 1 13 7743 1 1 7 GLY HA3 H -3.959 -0.202 -12.172 1.00 . A A . 7 GLY HA3 1 1 13 7744 1 1 7 GLY N N -3.619 1.068 -13.770 1.00 . A A . 7 GLY N 1 1 13 7745 1 1 7 GLY O O -5.066 -1.652 -14.040 1.00 . A A . 7 GLY O 1 1 13 7746 1 1 8 THR C C -3.054 -4.537 -14.608 1.00 . A A . 8 THR C 1 1 13 7747 1 1 8 THR CA C -3.228 -3.234 -15.380 1.00 . A A . 8 THR CA 1 1 13 7748 1 1 8 THR CB C -2.340 -3.273 -16.638 1.00 . A A . 8 THR CB 1 1 13 7749 1 1 8 THR CG2 C -0.884 -3.017 -16.281 1.00 . A A . 8 THR CG2 1 1 13 7750 1 1 8 THR H H -1.980 -1.816 -14.426 1.00 . A A . 8 THR H 1 1 13 7751 1 1 8 THR HA H -4.258 -3.148 -15.695 1.00 . A A . 8 THR HA 1 1 13 7752 1 1 8 THR HB H -2.670 -2.501 -17.318 1.00 . A A . 8 THR HB 1 1 13 7753 1 1 8 THR HG1 H -3.333 -4.623 -17.679 1.00 . A A . 8 THR HG1 1 1 13 7754 1 1 8 THR HG21 H -0.731 -1.959 -16.132 1.00 . A A . 8 THR HG21 1 1 13 7755 1 1 8 THR HG22 H -0.249 -3.363 -17.083 1.00 . A A . 8 THR HG22 1 1 13 7756 1 1 8 THR HG23 H -0.637 -3.547 -15.373 1.00 . A A . 8 THR HG23 1 1 13 7757 1 1 8 THR N N -2.916 -2.081 -14.545 1.00 . A A . 8 THR N 1 1 13 7758 1 1 8 THR O O -2.045 -5.226 -14.754 1.00 . A A . 8 THR O 1 1 13 7759 1 1 8 THR OG1 O -2.461 -4.546 -17.284 1.00 . A A . 8 THR OG1 1 1 13 7760 1 1 9 GLY C C -4.518 -5.905 -11.598 1.00 . A A . 9 GLY C 1 1 13 7761 1 1 9 GLY CA C -3.981 -6.089 -13.003 1.00 . A A . 9 GLY CA 1 1 13 7762 1 1 9 GLY H H -4.825 -4.281 -13.710 1.00 . A A . 9 GLY H 1 1 13 7763 1 1 9 GLY HA2 H -4.558 -6.854 -13.501 1.00 . A A . 9 GLY HA2 1 1 13 7764 1 1 9 GLY HA3 H -2.951 -6.411 -12.943 1.00 . A A . 9 GLY HA3 1 1 13 7765 1 1 9 GLY N N -4.044 -4.869 -13.786 1.00 . A A . 9 GLY N 1 1 13 7766 1 1 9 GLY O O -4.173 -4.941 -10.916 1.00 . A A . 9 GLY O 1 1 13 7767 1 1 10 GLU C C -5.109 -7.538 -8.824 1.00 . A A . 10 GLU C 1 1 13 7768 1 1 10 GLU CA C -5.955 -6.765 -9.832 1.00 . A A . 10 GLU CA 1 1 13 7769 1 1 10 GLU CB C -7.381 -7.321 -9.850 1.00 . A A . 10 GLU CB 1 1 13 7770 1 1 10 GLU CD C -8.287 -5.856 -8.002 1.00 . A A . 10 GLU CD 1 1 13 7771 1 1 10 GLU CG C -8.070 -7.273 -8.497 1.00 . A A . 10 GLU CG 1 1 13 7772 1 1 10 GLU H H -5.604 -7.577 -11.754 1.00 . A A . 10 GLU H 1 1 13 7773 1 1 10 GLU HA H -5.987 -5.727 -9.535 1.00 . A A . 10 GLU HA 1 1 13 7774 1 1 10 GLU HB2 H -7.969 -6.747 -10.552 1.00 . A A . 10 GLU HB2 1 1 13 7775 1 1 10 GLU HB3 H -7.348 -8.349 -10.178 1.00 . A A . 10 GLU HB3 1 1 13 7776 1 1 10 GLU HG2 H -9.031 -7.760 -8.579 1.00 . A A . 10 GLU HG2 1 1 13 7777 1 1 10 GLU HG3 H -7.461 -7.801 -7.778 1.00 . A A . 10 GLU HG3 1 1 13 7778 1 1 10 GLU N N -5.367 -6.832 -11.164 1.00 . A A . 10 GLU N 1 1 13 7779 1 1 10 GLU O O -5.300 -8.738 -8.627 1.00 . A A . 10 GLU O 1 1 13 7780 1 1 10 GLU OE1 O -7.284 -5.167 -7.720 1.00 . A A . 10 GLU OE1 1 1 13 7781 1 1 10 GLU OE2 O -9.458 -5.436 -7.897 1.00 . A A . 10 GLU OE2 1 1 13 7782 1 1 11 LYS C C -4.063 -7.787 -5.923 1.00 . A A . 11 LYS C 1 1 13 7783 1 1 11 LYS CA C -3.297 -7.460 -7.201 1.00 . A A . 11 LYS CA 1 1 13 7784 1 1 11 LYS CB C -2.121 -6.534 -6.880 1.00 . A A . 11 LYS CB 1 1 13 7785 1 1 11 LYS CD C -1.187 -5.775 -9.085 1.00 . A A . 11 LYS CD 1 1 13 7786 1 1 11 LYS CE C 0.118 -5.506 -9.818 1.00 . A A . 11 LYS CE 1 1 13 7787 1 1 11 LYS CG C -0.969 -6.651 -7.863 1.00 . A A . 11 LYS CG 1 1 13 7788 1 1 11 LYS H H -4.069 -5.887 -8.389 1.00 . A A . 11 LYS H 1 1 13 7789 1 1 11 LYS HA H -2.916 -8.378 -7.623 1.00 . A A . 11 LYS HA 1 1 13 7790 1 1 11 LYS HB2 H -2.471 -5.512 -6.888 1.00 . A A . 11 LYS HB2 1 1 13 7791 1 1 11 LYS HB3 H -1.750 -6.771 -5.894 1.00 . A A . 11 LYS HB3 1 1 13 7792 1 1 11 LYS HD2 H -1.869 -6.274 -9.758 1.00 . A A . 11 LYS HD2 1 1 13 7793 1 1 11 LYS HD3 H -1.614 -4.833 -8.770 1.00 . A A . 11 LYS HD3 1 1 13 7794 1 1 11 LYS HE2 H 0.676 -4.761 -9.272 1.00 . A A . 11 LYS HE2 1 1 13 7795 1 1 11 LYS HE3 H 0.687 -6.423 -9.860 1.00 . A A . 11 LYS HE3 1 1 13 7796 1 1 11 LYS HG2 H -0.057 -6.346 -7.373 1.00 . A A . 11 LYS HG2 1 1 13 7797 1 1 11 LYS HG3 H -0.882 -7.681 -8.181 1.00 . A A . 11 LYS HG3 1 1 13 7798 1 1 11 LYS HZ1 H -1.068 -4.608 -11.285 1.00 . A A . 11 LYS HZ1 1 1 13 7799 1 1 11 LYS HZ2 H -0.030 -5.804 -11.881 1.00 . A A . 11 LYS HZ2 1 1 13 7800 1 1 11 LYS HZ3 H 0.585 -4.289 -11.450 1.00 . A A . 11 LYS HZ3 1 1 13 7801 1 1 11 LYS N N -4.173 -6.842 -8.189 1.00 . A A . 11 LYS N 1 1 13 7802 1 1 11 LYS NZ N -0.115 -5.017 -11.205 1.00 . A A . 11 LYS NZ 1 1 13 7803 1 1 11 LYS O O -5.121 -7.223 -5.644 1.00 . A A . 11 LYS O 1 1 13 7804 1 1 12 PRO C C -4.070 -8.052 -2.798 1.00 . A A . 12 PRO C 1 1 13 7805 1 1 12 PRO CA C -4.133 -9.140 -3.865 1.00 . A A . 12 PRO CA 1 1 13 7806 1 1 12 PRO CB C -3.291 -10.348 -3.446 1.00 . A A . 12 PRO CB 1 1 13 7807 1 1 12 PRO CD C -2.258 -9.433 -5.398 1.00 . A A . 12 PRO CD 1 1 13 7808 1 1 12 PRO CG C -1.970 -10.134 -4.100 1.00 . A A . 12 PRO CG 1 1 13 7809 1 1 12 PRO HA H -5.159 -9.446 -4.006 1.00 . A A . 12 PRO HA 1 1 13 7810 1 1 12 PRO HB2 H -3.201 -10.372 -2.369 1.00 . A A . 12 PRO HB2 1 1 13 7811 1 1 12 PRO HB3 H -3.760 -11.256 -3.793 1.00 . A A . 12 PRO HB3 1 1 13 7812 1 1 12 PRO HD2 H -1.466 -8.739 -5.637 1.00 . A A . 12 PRO HD2 1 1 13 7813 1 1 12 PRO HD3 H -2.387 -10.151 -6.194 1.00 . A A . 12 PRO HD3 1 1 13 7814 1 1 12 PRO HG2 H -1.345 -9.518 -3.471 1.00 . A A . 12 PRO HG2 1 1 13 7815 1 1 12 PRO HG3 H -1.494 -11.086 -4.286 1.00 . A A . 12 PRO HG3 1 1 13 7816 1 1 12 PRO N N -3.518 -8.719 -5.127 1.00 . A A . 12 PRO N 1 1 13 7817 1 1 12 PRO O O -4.918 -7.994 -1.907 1.00 . A A . 12 PRO O 1 1 13 7818 1 1 13 TYR C C -3.335 -4.776 -2.535 1.00 . A A . 13 TYR C 1 1 13 7819 1 1 13 TYR CA C -2.889 -6.107 -1.937 1.00 . A A . 13 TYR CA 1 1 13 7820 1 1 13 TYR CB C -1.427 -6.017 -1.496 1.00 . A A . 13 TYR CB 1 1 13 7821 1 1 13 TYR CD1 C -1.148 -7.729 0.339 1.00 . A A . 13 TYR CD1 1 1 13 7822 1 1 13 TYR CD2 C -0.080 -8.137 -1.752 1.00 . A A . 13 TYR CD2 1 1 13 7823 1 1 13 TYR CE1 C -0.646 -8.917 0.833 1.00 . A A . 13 TYR CE1 1 1 13 7824 1 1 13 TYR CE2 C 0.425 -9.328 -1.267 1.00 . A A . 13 TYR CE2 1 1 13 7825 1 1 13 TYR CG C -0.876 -7.319 -0.960 1.00 . A A . 13 TYR CG 1 1 13 7826 1 1 13 TYR CZ C 0.140 -9.713 0.026 1.00 . A A . 13 TYR CZ 1 1 13 7827 1 1 13 TYR H H -2.419 -7.290 -3.628 1.00 . A A . 13 TYR H 1 1 13 7828 1 1 13 TYR HA H -3.503 -6.324 -1.075 1.00 . A A . 13 TYR HA 1 1 13 7829 1 1 13 TYR HB2 H -0.821 -5.723 -2.339 1.00 . A A . 13 TYR HB2 1 1 13 7830 1 1 13 TYR HB3 H -1.339 -5.273 -0.718 1.00 . A A . 13 TYR HB3 1 1 13 7831 1 1 13 TYR HD1 H -1.764 -7.103 0.969 1.00 . A A . 13 TYR HD1 1 1 13 7832 1 1 13 TYR HD2 H 0.141 -7.832 -2.765 1.00 . A A . 13 TYR HD2 1 1 13 7833 1 1 13 TYR HE1 H -0.869 -9.219 1.846 1.00 . A A . 13 TYR HE1 1 1 13 7834 1 1 13 TYR HE2 H 1.041 -9.951 -1.899 1.00 . A A . 13 TYR HE2 1 1 13 7835 1 1 13 TYR HH H 0.835 -11.489 -0.218 1.00 . A A . 13 TYR HH 1 1 13 7836 1 1 13 TYR N N -3.063 -7.192 -2.895 1.00 . A A . 13 TYR N 1 1 13 7837 1 1 13 TYR O O -3.459 -4.640 -3.753 1.00 . A A . 13 TYR O 1 1 13 7838 1 1 13 TYR OH O 0.643 -10.898 0.514 1.00 . A A . 13 TYR OH 1 1 13 7839 1 1 14 ARG C C -3.783 -1.437 -1.015 1.00 . A A . 14 ARG C 1 1 13 7840 1 1 14 ARG CA C -4.005 -2.475 -2.111 1.00 . A A . 14 ARG CA 1 1 13 7841 1 1 14 ARG CB C -5.482 -2.505 -2.509 1.00 . A A . 14 ARG CB 1 1 13 7842 1 1 14 ARG CD C -5.862 -0.910 -4.414 1.00 . A A . 14 ARG CD 1 1 13 7843 1 1 14 ARG CG C -6.029 -1.148 -2.921 1.00 . A A . 14 ARG CG 1 1 13 7844 1 1 14 ARG CZ C -7.810 0.387 -5.167 1.00 . A A . 14 ARG CZ 1 1 13 7845 1 1 14 ARG H H -3.456 -3.965 -0.712 1.00 . A A . 14 ARG H 1 1 13 7846 1 1 14 ARG HA H -3.414 -2.204 -2.973 1.00 . A A . 14 ARG HA 1 1 13 7847 1 1 14 ARG HB2 H -5.605 -3.185 -3.339 1.00 . A A . 14 ARG HB2 1 1 13 7848 1 1 14 ARG HB3 H -6.061 -2.863 -1.671 1.00 . A A . 14 ARG HB3 1 1 13 7849 1 1 14 ARG HD2 H -4.808 -0.840 -4.638 1.00 . A A . 14 ARG HD2 1 1 13 7850 1 1 14 ARG HD3 H -6.289 -1.746 -4.947 1.00 . A A . 14 ARG HD3 1 1 13 7851 1 1 14 ARG HE H -5.977 1.130 -4.907 1.00 . A A . 14 ARG HE 1 1 13 7852 1 1 14 ARG HG2 H -7.080 -1.104 -2.676 1.00 . A A . 14 ARG HG2 1 1 13 7853 1 1 14 ARG HG3 H -5.499 -0.378 -2.381 1.00 . A A . 14 ARG HG3 1 1 13 7854 1 1 14 ARG HH11 H -8.177 -1.566 -4.806 1.00 . A A . 14 ARG HH11 1 1 13 7855 1 1 14 ARG HH12 H -9.542 -0.640 -5.338 1.00 . A A . 14 ARG HH12 1 1 13 7856 1 1 14 ARG HH21 H -7.766 2.360 -5.607 1.00 . A A . 14 ARG HH21 1 1 13 7857 1 1 14 ARG HH22 H -9.307 1.592 -5.794 1.00 . A A . 14 ARG HH22 1 1 13 7858 1 1 14 ARG N N -3.573 -3.796 -1.670 1.00 . A A . 14 ARG N 1 1 13 7859 1 1 14 ARG NE N -6.522 0.318 -4.849 1.00 . A A . 14 ARG NE 1 1 13 7860 1 1 14 ARG NH1 N -8.572 -0.695 -5.099 1.00 . A A . 14 ARG NH1 1 1 13 7861 1 1 14 ARG NH2 N -8.338 1.541 -5.555 1.00 . A A . 14 ARG NH2 1 1 13 7862 1 1 14 ARG O O -4.129 -1.660 0.145 1.00 . A A . 14 ARG O 1 1 13 7863 1 1 15 CYS C C -4.163 1.659 -0.262 1.00 . A A . 15 CYS C 1 1 13 7864 1 1 15 CYS CA C -2.935 0.772 -0.442 1.00 . A A . 15 CYS CA 1 1 13 7865 1 1 15 CYS CB C -1.749 1.614 -0.916 1.00 . A A . 15 CYS CB 1 1 13 7866 1 1 15 CYS H H -2.951 -0.182 -2.332 1.00 . A A . 15 CYS H 1 1 13 7867 1 1 15 CYS HA H -2.689 0.321 0.507 1.00 . A A . 15 CYS HA 1 1 13 7868 1 1 15 CYS HB2 H -0.989 0.959 -1.317 1.00 . A A . 15 CYS HB2 1 1 13 7869 1 1 15 CYS HB3 H -2.082 2.288 -1.691 1.00 . A A . 15 CYS HB3 1 1 13 7870 1 1 15 CYS N N -3.204 -0.301 -1.392 1.00 . A A . 15 CYS N 1 1 13 7871 1 1 15 CYS O O -4.269 2.722 -0.873 1.00 . A A . 15 CYS O 1 1 13 7872 1 1 15 CYS SG S -0.977 2.615 0.396 1.00 . A A . 15 CYS SG 1 1 13 7873 1 1 16 ALA C C -6.010 3.456 1.006 1.00 . A A . 16 ALA C 1 1 13 7874 1 1 16 ALA CA C -6.308 1.969 0.846 1.00 . A A . 16 ALA CA 1 1 13 7875 1 1 16 ALA CB C -7.003 1.431 2.088 1.00 . A A . 16 ALA CB 1 1 13 7876 1 1 16 ALA H H -4.947 0.360 1.040 1.00 . A A . 16 ALA H 1 1 13 7877 1 1 16 ALA HA H -6.972 1.834 0.004 1.00 . A A . 16 ALA HA 1 1 13 7878 1 1 16 ALA HB1 H -8.046 1.709 2.064 1.00 . A A . 16 ALA HB1 1 1 13 7879 1 1 16 ALA HB2 H -6.917 0.354 2.109 1.00 . A A . 16 ALA HB2 1 1 13 7880 1 1 16 ALA HB3 H -6.539 1.848 2.969 1.00 . A A . 16 ALA HB3 1 1 13 7881 1 1 16 ALA N N -5.088 1.215 0.583 1.00 . A A . 16 ALA N 1 1 13 7882 1 1 16 ALA O O -6.866 4.301 0.748 1.00 . A A . 16 ALA O 1 1 13 7883 1 1 17 GLU C C -4.541 5.955 0.342 1.00 . A A . 17 GLU C 1 1 13 7884 1 1 17 GLU CA C -4.382 5.154 1.630 1.00 . A A . 17 GLU CA 1 1 13 7885 1 1 17 GLU CB C -2.929 5.217 2.107 1.00 . A A . 17 GLU CB 1 1 13 7886 1 1 17 GLU CD C -3.428 3.929 4.222 1.00 . A A . 17 GLU CD 1 1 13 7887 1 1 17 GLU CG C -2.781 5.161 3.618 1.00 . A A . 17 GLU CG 1 1 13 7888 1 1 17 GLU H H -4.152 3.049 1.623 1.00 . A A . 17 GLU H 1 1 13 7889 1 1 17 GLU HA H -5.019 5.583 2.388 1.00 . A A . 17 GLU HA 1 1 13 7890 1 1 17 GLU HB2 H -2.386 4.387 1.681 1.00 . A A . 17 GLU HB2 1 1 13 7891 1 1 17 GLU HB3 H -2.489 6.140 1.758 1.00 . A A . 17 GLU HB3 1 1 13 7892 1 1 17 GLU HG2 H -1.730 5.154 3.864 1.00 . A A . 17 GLU HG2 1 1 13 7893 1 1 17 GLU HG3 H -3.244 6.039 4.045 1.00 . A A . 17 GLU HG3 1 1 13 7894 1 1 17 GLU N N -4.790 3.768 1.434 1.00 . A A . 17 GLU N 1 1 13 7895 1 1 17 GLU O O -5.308 6.917 0.286 1.00 . A A . 17 GLU O 1 1 13 7896 1 1 17 GLU OE1 O -3.339 2.849 3.601 1.00 . A A . 17 GLU OE1 1 1 13 7897 1 1 17 GLU OE2 O -4.022 4.045 5.314 1.00 . A A . 17 GLU OE2 1 1 13 7898 1 1 18 CYS C C -4.649 5.403 -2.999 1.00 . A A . 18 CYS C 1 1 13 7899 1 1 18 CYS CA C -3.870 6.232 -1.982 1.00 . A A . 18 CYS CA 1 1 13 7900 1 1 18 CYS CB C -2.457 6.503 -2.503 1.00 . A A . 18 CYS CB 1 1 13 7901 1 1 18 CYS H H -3.218 4.778 -0.588 1.00 . A A . 18 CYS H 1 1 13 7902 1 1 18 CYS HA H -4.378 7.173 -1.838 1.00 . A A . 18 CYS HA 1 1 13 7903 1 1 18 CYS HB2 H -2.520 6.854 -3.523 1.00 . A A . 18 CYS HB2 1 1 13 7904 1 1 18 CYS HB3 H -1.997 7.267 -1.893 1.00 . A A . 18 CYS HB3 1 1 13 7905 1 1 18 CYS N N -3.811 5.552 -0.693 1.00 . A A . 18 CYS N 1 1 13 7906 1 1 18 CYS O O -5.416 5.941 -3.797 1.00 . A A . 18 CYS O 1 1 13 7907 1 1 18 CYS SG S -1.365 5.045 -2.485 1.00 . A A . 18 CYS SG 1 1 13 7908 1 1 19 GLY C C -4.190 2.524 -4.853 1.00 . A A . 19 GLY C 1 1 13 7909 1 1 19 GLY CA C -5.137 3.208 -3.887 1.00 . A A . 19 GLY CA 1 1 13 7910 1 1 19 GLY H H -3.823 3.716 -2.306 1.00 . A A . 19 GLY H 1 1 13 7911 1 1 19 GLY HA2 H -5.664 2.454 -3.321 1.00 . A A . 19 GLY HA2 1 1 13 7912 1 1 19 GLY HA3 H -5.853 3.786 -4.452 1.00 . A A . 19 GLY HA3 1 1 13 7913 1 1 19 GLY N N -4.446 4.090 -2.964 1.00 . A A . 19 GLY N 1 1 13 7914 1 1 19 GLY O O -4.542 2.269 -6.005 1.00 . A A . 19 GLY O 1 1 13 7915 1 1 20 LYS C C -2.124 0.052 -5.142 1.00 . A A . 20 LYS C 1 1 13 7916 1 1 20 LYS CA C -1.980 1.569 -5.215 1.00 . A A . 20 LYS CA 1 1 13 7917 1 1 20 LYS CB C -0.573 1.980 -4.774 1.00 . A A . 20 LYS CB 1 1 13 7918 1 1 20 LYS CD C 1.249 3.706 -4.872 1.00 . A A . 20 LYS CD 1 1 13 7919 1 1 20 LYS CE C 2.041 4.566 -5.845 1.00 . A A . 20 LYS CE 1 1 13 7920 1 1 20 LYS CG C -0.045 3.208 -5.494 1.00 . A A . 20 LYS CG 1 1 13 7921 1 1 20 LYS H H -2.760 2.455 -3.457 1.00 . A A . 20 LYS H 1 1 13 7922 1 1 20 LYS HA H -2.135 1.885 -6.235 1.00 . A A . 20 LYS HA 1 1 13 7923 1 1 20 LYS HB2 H -0.587 2.188 -3.714 1.00 . A A . 20 LYS HB2 1 1 13 7924 1 1 20 LYS HB3 H 0.104 1.159 -4.962 1.00 . A A . 20 LYS HB3 1 1 13 7925 1 1 20 LYS HD2 H 1.015 4.295 -3.998 1.00 . A A . 20 LYS HD2 1 1 13 7926 1 1 20 LYS HD3 H 1.851 2.856 -4.585 1.00 . A A . 20 LYS HD3 1 1 13 7927 1 1 20 LYS HE2 H 1.977 4.126 -6.828 1.00 . A A . 20 LYS HE2 1 1 13 7928 1 1 20 LYS HE3 H 1.608 5.556 -5.865 1.00 . A A . 20 LYS HE3 1 1 13 7929 1 1 20 LYS HG2 H 0.139 2.957 -6.528 1.00 . A A . 20 LYS HG2 1 1 13 7930 1 1 20 LYS HG3 H -0.786 3.993 -5.439 1.00 . A A . 20 LYS HG3 1 1 13 7931 1 1 20 LYS HZ1 H 4.055 4.056 -6.056 1.00 . A A . 20 LYS HZ1 1 1 13 7932 1 1 20 LYS HZ2 H 3.594 4.384 -4.461 1.00 . A A . 20 LYS HZ2 1 1 13 7933 1 1 20 LYS HZ3 H 3.801 5.653 -5.559 1.00 . A A . 20 LYS HZ3 1 1 13 7934 1 1 20 LYS N N -2.982 2.227 -4.385 1.00 . A A . 20 LYS N 1 1 13 7935 1 1 20 LYS NZ N 3.473 4.672 -5.453 1.00 . A A . 20 LYS NZ 1 1 13 7936 1 1 20 LYS O O -2.675 -0.483 -4.180 1.00 . A A . 20 LYS O 1 1 13 7937 1 1 21 ALA C C -0.318 -2.713 -6.005 1.00 . A A . 21 ALA C 1 1 13 7938 1 1 21 ALA CA C -1.694 -2.090 -6.213 1.00 . A A . 21 ALA CA 1 1 13 7939 1 1 21 ALA CB C -2.287 -2.545 -7.538 1.00 . A A . 21 ALA CB 1 1 13 7940 1 1 21 ALA H H -1.197 -0.152 -6.901 1.00 . A A . 21 ALA H 1 1 13 7941 1 1 21 ALA HA H -2.351 -2.420 -5.421 1.00 . A A . 21 ALA HA 1 1 13 7942 1 1 21 ALA HB1 H -3.174 -1.969 -7.752 1.00 . A A . 21 ALA HB1 1 1 13 7943 1 1 21 ALA HB2 H -1.562 -2.397 -8.326 1.00 . A A . 21 ALA HB2 1 1 13 7944 1 1 21 ALA HB3 H -2.543 -3.592 -7.477 1.00 . A A . 21 ALA HB3 1 1 13 7945 1 1 21 ALA N N -1.624 -0.635 -6.164 1.00 . A A . 21 ALA N 1 1 13 7946 1 1 21 ALA O O 0.652 -2.335 -6.663 1.00 . A A . 21 ALA O 1 1 13 7947 1 1 22 PHE C C 0.869 -5.857 -4.923 1.00 . A A . 22 PHE C 1 1 13 7948 1 1 22 PHE CA C 1.019 -4.345 -4.790 1.00 . A A . 22 PHE CA 1 1 13 7949 1 1 22 PHE CB C 1.493 -3.990 -3.379 1.00 . A A . 22 PHE CB 1 1 13 7950 1 1 22 PHE CD1 C 0.918 -1.552 -3.230 1.00 . A A . 22 PHE CD1 1 1 13 7951 1 1 22 PHE CD2 C 3.210 -2.187 -3.065 1.00 . A A . 22 PHE CD2 1 1 13 7952 1 1 22 PHE CE1 C 1.273 -0.224 -3.087 1.00 . A A . 22 PHE CE1 1 1 13 7953 1 1 22 PHE CE2 C 3.571 -0.861 -2.920 1.00 . A A . 22 PHE CE2 1 1 13 7954 1 1 22 PHE CG C 1.881 -2.548 -3.222 1.00 . A A . 22 PHE CG 1 1 13 7955 1 1 22 PHE CZ C 2.601 0.122 -2.930 1.00 . A A . 22 PHE CZ 1 1 13 7956 1 1 22 PHE H H -1.048 -3.928 -4.594 1.00 . A A . 22 PHE H 1 1 13 7957 1 1 22 PHE HA H 1.753 -4.003 -5.503 1.00 . A A . 22 PHE HA 1 1 13 7958 1 1 22 PHE HB2 H 0.699 -4.197 -2.678 1.00 . A A . 22 PHE HB2 1 1 13 7959 1 1 22 PHE HB3 H 2.352 -4.595 -3.133 1.00 . A A . 22 PHE HB3 1 1 13 7960 1 1 22 PHE HD1 H -0.122 -1.821 -3.351 1.00 . A A . 22 PHE HD1 1 1 13 7961 1 1 22 PHE HD2 H 3.970 -2.956 -3.057 1.00 . A A . 22 PHE HD2 1 1 13 7962 1 1 22 PHE HE1 H 0.512 0.542 -3.095 1.00 . A A . 22 PHE HE1 1 1 13 7963 1 1 22 PHE HE2 H 4.610 -0.594 -2.798 1.00 . A A . 22 PHE HE2 1 1 13 7964 1 1 22 PHE HZ H 2.880 1.159 -2.818 1.00 . A A . 22 PHE HZ 1 1 13 7965 1 1 22 PHE N N -0.240 -3.670 -5.086 1.00 . A A . 22 PHE N 1 1 13 7966 1 1 22 PHE O O -0.112 -6.440 -4.461 1.00 . A A . 22 PHE O 1 1 13 7967 1 1 23 THR C C 2.214 -8.668 -4.479 1.00 . A A . 23 THR C 1 1 13 7968 1 1 23 THR CA C 1.829 -7.933 -5.757 1.00 . A A . 23 THR CA 1 1 13 7969 1 1 23 THR CB C 2.783 -8.360 -6.889 1.00 . A A . 23 THR CB 1 1 13 7970 1 1 23 THR CG2 C 2.319 -7.804 -8.226 1.00 . A A . 23 THR CG2 1 1 13 7971 1 1 23 THR H H 2.606 -5.970 -5.907 1.00 . A A . 23 THR H 1 1 13 7972 1 1 23 THR HA H 0.824 -8.216 -6.036 1.00 . A A . 23 THR HA 1 1 13 7973 1 1 23 THR HB H 2.788 -9.439 -6.946 1.00 . A A . 23 THR HB 1 1 13 7974 1 1 23 THR HG1 H 4.118 -6.941 -6.585 1.00 . A A . 23 THR HG1 1 1 13 7975 1 1 23 THR HG21 H 1.255 -7.628 -8.193 1.00 . A A . 23 THR HG21 1 1 13 7976 1 1 23 THR HG22 H 2.542 -8.515 -9.009 1.00 . A A . 23 THR HG22 1 1 13 7977 1 1 23 THR HG23 H 2.832 -6.875 -8.427 1.00 . A A . 23 THR HG23 1 1 13 7978 1 1 23 THR N N 1.851 -6.489 -5.561 1.00 . A A . 23 THR N 1 1 13 7979 1 1 23 THR O O 1.654 -9.718 -4.162 1.00 . A A . 23 THR O 1 1 13 7980 1 1 23 THR OG1 O 4.110 -7.901 -6.610 1.00 . A A . 23 THR OG1 1 1 13 7981 1 1 24 ASP C C 3.370 -7.782 -1.319 1.00 . A A . 24 ASP C 1 1 13 7982 1 1 24 ASP CA C 3.630 -8.712 -2.500 1.00 . A A . 24 ASP CA 1 1 13 7983 1 1 24 ASP CB C 5.122 -9.042 -2.587 1.00 . A A . 24 ASP CB 1 1 13 7984 1 1 24 ASP CG C 5.468 -9.837 -3.830 1.00 . A A . 24 ASP CG 1 1 13 7985 1 1 24 ASP H H 3.580 -7.273 -4.052 1.00 . A A . 24 ASP H 1 1 13 7986 1 1 24 ASP HA H 3.077 -9.627 -2.351 1.00 . A A . 24 ASP HA 1 1 13 7987 1 1 24 ASP HB2 H 5.687 -8.121 -2.602 1.00 . A A . 24 ASP HB2 1 1 13 7988 1 1 24 ASP HB3 H 5.407 -9.620 -1.720 1.00 . A A . 24 ASP HB3 1 1 13 7989 1 1 24 ASP N N 3.172 -8.110 -3.747 1.00 . A A . 24 ASP N 1 1 13 7990 1 1 24 ASP O O 3.429 -6.560 -1.454 1.00 . A A . 24 ASP O 1 1 13 7991 1 1 24 ASP OD1 O 5.179 -11.052 -3.857 1.00 . A A . 24 ASP OD1 1 1 13 7992 1 1 24 ASP OD2 O 6.027 -9.244 -4.776 1.00 . A A . 24 ASP OD2 1 1 13 7993 1 1 25 ARG C C 4.034 -6.785 1.455 1.00 . A A . 25 ARG C 1 1 13 7994 1 1 25 ARG CA C 2.808 -7.594 1.041 1.00 . A A . 25 ARG CA 1 1 13 7995 1 1 25 ARG CB C 2.383 -8.518 2.184 1.00 . A A . 25 ARG CB 1 1 13 7996 1 1 25 ARG CD C 1.771 -8.762 4.609 1.00 . A A . 25 ARG CD 1 1 13 7997 1 1 25 ARG CG C 2.178 -7.797 3.506 1.00 . A A . 25 ARG CG 1 1 13 7998 1 1 25 ARG CZ C 2.906 -10.486 5.944 1.00 . A A . 25 ARG CZ 1 1 13 7999 1 1 25 ARG H H 3.048 -9.348 -0.118 1.00 . A A . 25 ARG H 1 1 13 8000 1 1 25 ARG HA H 1.999 -6.913 0.821 1.00 . A A . 25 ARG HA 1 1 13 8001 1 1 25 ARG HB2 H 1.456 -9.002 1.915 1.00 . A A . 25 ARG HB2 1 1 13 8002 1 1 25 ARG HB3 H 3.145 -9.271 2.323 1.00 . A A . 25 ARG HB3 1 1 13 8003 1 1 25 ARG HD2 H 1.661 -8.208 5.530 1.00 . A A . 25 ARG HD2 1 1 13 8004 1 1 25 ARG HD3 H 0.826 -9.212 4.345 1.00 . A A . 25 ARG HD3 1 1 13 8005 1 1 25 ARG HE H 3.347 -10.036 4.052 1.00 . A A . 25 ARG HE 1 1 13 8006 1 1 25 ARG HG2 H 3.101 -7.313 3.789 1.00 . A A . 25 ARG HG2 1 1 13 8007 1 1 25 ARG HG3 H 1.403 -7.055 3.384 1.00 . A A . 25 ARG HG3 1 1 13 8008 1 1 25 ARG HH11 H 1.430 -9.498 6.908 1.00 . A A . 25 ARG HH11 1 1 13 8009 1 1 25 ARG HH12 H 2.238 -10.717 7.838 1.00 . A A . 25 ARG HH12 1 1 13 8010 1 1 25 ARG HH21 H 4.418 -11.643 5.266 1.00 . A A . 25 ARG HH21 1 1 13 8011 1 1 25 ARG HH22 H 3.938 -11.935 6.903 1.00 . A A . 25 ARG HH22 1 1 13 8012 1 1 25 ARG N N 3.080 -8.370 -0.163 1.00 . A A . 25 ARG N 1 1 13 8013 1 1 25 ARG NE N 2.761 -9.817 4.806 1.00 . A A . 25 ARG NE 1 1 13 8014 1 1 25 ARG NH1 N 2.128 -10.211 6.982 1.00 . A A . 25 ARG NH1 1 1 13 8015 1 1 25 ARG NH2 N 3.830 -11.433 6.046 1.00 . A A . 25 ARG NH2 1 1 13 8016 1 1 25 ARG O O 3.968 -5.563 1.586 1.00 . A A . 25 ARG O 1 1 13 8017 1 1 26 SER C C 6.588 -5.515 1.304 1.00 . A A . 26 SER C 1 1 13 8018 1 1 26 SER CA C 6.390 -6.823 2.064 1.00 . A A . 26 SER CA 1 1 13 8019 1 1 26 SER CB C 7.582 -7.751 1.823 1.00 . A A . 26 SER CB 1 1 13 8020 1 1 26 SER H H 5.139 -8.449 1.540 1.00 . A A . 26 SER H 1 1 13 8021 1 1 26 SER HA H 6.322 -6.606 3.120 1.00 . A A . 26 SER HA 1 1 13 8022 1 1 26 SER HB2 H 8.461 -7.333 2.291 1.00 . A A . 26 SER HB2 1 1 13 8023 1 1 26 SER HB3 H 7.373 -8.721 2.252 1.00 . A A . 26 SER HB3 1 1 13 8024 1 1 26 SER HG H 8.734 -8.217 0.308 1.00 . A A . 26 SER HG 1 1 13 8025 1 1 26 SER N N 5.151 -7.476 1.660 1.00 . A A . 26 SER N 1 1 13 8026 1 1 26 SER O O 6.967 -4.499 1.884 1.00 . A A . 26 SER O 1 1 13 8027 1 1 26 SER OG O 7.834 -7.909 0.438 1.00 . A A . 26 SER OG 1 1 13 8028 1 1 27 ASN C C 5.495 -3.277 -0.425 1.00 . A A . 27 ASN C 1 1 13 8029 1 1 27 ASN CA C 6.477 -4.368 -0.840 1.00 . A A . 27 ASN CA 1 1 13 8030 1 1 27 ASN CB C 6.259 -4.732 -2.310 1.00 . A A . 27 ASN CB 1 1 13 8031 1 1 27 ASN CG C 7.476 -5.395 -2.928 1.00 . A A . 27 ASN CG 1 1 13 8032 1 1 27 ASN H H 6.028 -6.391 -0.405 1.00 . A A . 27 ASN H 1 1 13 8033 1 1 27 ASN HA H 7.483 -3.998 -0.715 1.00 . A A . 27 ASN HA 1 1 13 8034 1 1 27 ASN HB2 H 5.425 -5.414 -2.386 1.00 . A A . 27 ASN HB2 1 1 13 8035 1 1 27 ASN HB3 H 6.038 -3.835 -2.869 1.00 . A A . 27 ASN HB3 1 1 13 8036 1 1 27 ASN HD21 H 6.553 -5.508 -4.685 1.00 . A A . 27 ASN HD21 1 1 13 8037 1 1 27 ASN HD22 H 8.158 -6.144 -4.638 1.00 . A A . 27 ASN HD22 1 1 13 8038 1 1 27 ASN N N 6.327 -5.550 0.001 1.00 . A A . 27 ASN N 1 1 13 8039 1 1 27 ASN ND2 N 7.387 -5.714 -4.214 1.00 . A A . 27 ASN ND2 1 1 13 8040 1 1 27 ASN O O 5.857 -2.103 -0.332 1.00 . A A . 27 ASN O 1 1 13 8041 1 1 27 ASN OD1 O 8.484 -5.616 -2.256 1.00 . A A . 27 ASN OD1 1 1 13 8042 1 1 28 LEU C C 3.613 -2.004 1.514 1.00 . A A . 28 LEU C 1 1 13 8043 1 1 28 LEU CA C 3.216 -2.728 0.232 1.00 . A A . 28 LEU CA 1 1 13 8044 1 1 28 LEU CB C 1.886 -3.456 0.435 1.00 . A A . 28 LEU CB 1 1 13 8045 1 1 28 LEU CD1 C 0.241 -1.572 0.267 1.00 . A A . 28 LEU CD1 1 1 13 8046 1 1 28 LEU CD2 C -0.319 -3.600 1.619 1.00 . A A . 28 LEU CD2 1 1 13 8047 1 1 28 LEU CG C 0.795 -2.669 1.162 1.00 . A A . 28 LEU CG 1 1 13 8048 1 1 28 LEU H H 4.023 -4.620 -0.266 1.00 . A A . 28 LEU H 1 1 13 8049 1 1 28 LEU HA H 3.102 -2.001 -0.558 1.00 . A A . 28 LEU HA 1 1 13 8050 1 1 28 LEU HB2 H 1.506 -3.727 -0.538 1.00 . A A . 28 LEU HB2 1 1 13 8051 1 1 28 LEU HB3 H 2.084 -4.353 1.005 1.00 . A A . 28 LEU HB3 1 1 13 8052 1 1 28 LEU HD11 H 0.972 -0.784 0.169 1.00 . A A . 28 LEU HD11 1 1 13 8053 1 1 28 LEU HD12 H -0.663 -1.173 0.703 1.00 . A A . 28 LEU HD12 1 1 13 8054 1 1 28 LEU HD13 H 0.019 -1.981 -0.708 1.00 . A A . 28 LEU HD13 1 1 13 8055 1 1 28 LEU HD21 H -0.454 -3.504 2.686 1.00 . A A . 28 LEU HD21 1 1 13 8056 1 1 28 LEU HD22 H -0.056 -4.620 1.380 1.00 . A A . 28 LEU HD22 1 1 13 8057 1 1 28 LEU HD23 H -1.238 -3.338 1.114 1.00 . A A . 28 LEU HD23 1 1 13 8058 1 1 28 LEU HG H 1.221 -2.201 2.039 1.00 . A A . 28 LEU HG 1 1 13 8059 1 1 28 LEU N N 4.251 -3.672 -0.175 1.00 . A A . 28 LEU N 1 1 13 8060 1 1 28 LEU O O 3.695 -0.776 1.546 1.00 . A A . 28 LEU O 1 1 13 8061 1 1 29 PHE C C 5.321 -1.132 3.673 1.00 . A A . 29 PHE C 1 1 13 8062 1 1 29 PHE CA C 4.251 -2.204 3.855 1.00 . A A . 29 PHE CA 1 1 13 8063 1 1 29 PHE CB C 4.767 -3.303 4.787 1.00 . A A . 29 PHE CB 1 1 13 8064 1 1 29 PHE CD1 C 2.620 -4.599 4.864 1.00 . A A . 29 PHE CD1 1 1 13 8065 1 1 29 PHE CD2 C 3.709 -4.088 6.922 1.00 . A A . 29 PHE CD2 1 1 13 8066 1 1 29 PHE CE1 C 1.615 -5.250 5.554 1.00 . A A . 29 PHE CE1 1 1 13 8067 1 1 29 PHE CE2 C 2.708 -4.739 7.618 1.00 . A A . 29 PHE CE2 1 1 13 8068 1 1 29 PHE CG C 3.677 -4.011 5.539 1.00 . A A . 29 PHE CG 1 1 13 8069 1 1 29 PHE CZ C 1.660 -5.322 6.933 1.00 . A A . 29 PHE CZ 1 1 13 8070 1 1 29 PHE H H 3.779 -3.745 2.482 1.00 . A A . 29 PHE H 1 1 13 8071 1 1 29 PHE HA H 3.376 -1.751 4.295 1.00 . A A . 29 PHE HA 1 1 13 8072 1 1 29 PHE HB2 H 5.299 -4.039 4.204 1.00 . A A . 29 PHE HB2 1 1 13 8073 1 1 29 PHE HB3 H 5.440 -2.866 5.508 1.00 . A A . 29 PHE HB3 1 1 13 8074 1 1 29 PHE HD1 H 2.584 -4.545 3.786 1.00 . A A . 29 PHE HD1 1 1 13 8075 1 1 29 PHE HD2 H 4.529 -3.633 7.460 1.00 . A A . 29 PHE HD2 1 1 13 8076 1 1 29 PHE HE1 H 0.797 -5.705 5.016 1.00 . A A . 29 PHE HE1 1 1 13 8077 1 1 29 PHE HE2 H 2.746 -4.792 8.696 1.00 . A A . 29 PHE HE2 1 1 13 8078 1 1 29 PHE HZ H 0.876 -5.830 7.474 1.00 . A A . 29 PHE HZ 1 1 13 8079 1 1 29 PHE N N 3.861 -2.772 2.570 1.00 . A A . 29 PHE N 1 1 13 8080 1 1 29 PHE O O 5.245 -0.055 4.265 1.00 . A A . 29 PHE O 1 1 13 8081 1 1 30 THR C C 6.877 0.824 2.052 1.00 . A A . 30 THR C 1 1 13 8082 1 1 30 THR CA C 7.408 -0.500 2.590 1.00 . A A . 30 THR CA 1 1 13 8083 1 1 30 THR CB C 8.421 -1.081 1.586 1.00 . A A . 30 THR CB 1 1 13 8084 1 1 30 THR CG2 C 9.554 -0.098 1.330 1.00 . A A . 30 THR CG2 1 1 13 8085 1 1 30 THR H H 6.325 -2.310 2.407 1.00 . A A . 30 THR H 1 1 13 8086 1 1 30 THR HA H 7.921 -0.318 3.523 1.00 . A A . 30 THR HA 1 1 13 8087 1 1 30 THR HB H 7.911 -1.270 0.652 1.00 . A A . 30 THR HB 1 1 13 8088 1 1 30 THR HG1 H 8.236 -2.927 2.253 1.00 . A A . 30 THR HG1 1 1 13 8089 1 1 30 THR HG21 H 9.226 0.900 1.578 1.00 . A A . 30 THR HG21 1 1 13 8090 1 1 30 THR HG22 H 9.835 -0.136 0.288 1.00 . A A . 30 THR HG22 1 1 13 8091 1 1 30 THR HG23 H 10.403 -0.361 1.943 1.00 . A A . 30 THR HG23 1 1 13 8092 1 1 30 THR N N 6.320 -1.435 2.850 1.00 . A A . 30 THR N 1 1 13 8093 1 1 30 THR O O 7.324 1.896 2.461 1.00 . A A . 30 THR O 1 1 13 8094 1 1 30 THR OG1 O 8.954 -2.312 2.085 1.00 . A A . 30 THR OG1 1 1 13 8095 1 1 31 HIS C C 4.553 2.735 1.582 1.00 . A A . 31 HIS C 1 1 13 8096 1 1 31 HIS CA C 5.328 1.936 0.538 1.00 . A A . 31 HIS CA 1 1 13 8097 1 1 31 HIS CB C 4.403 1.551 -0.617 1.00 . A A . 31 HIS CB 1 1 13 8098 1 1 31 HIS CD2 C 2.153 2.840 -0.565 1.00 . A A . 31 HIS CD2 1 1 13 8099 1 1 31 HIS CE1 C 2.657 4.421 -1.999 1.00 . A A . 31 HIS CE1 1 1 13 8100 1 1 31 HIS CG C 3.423 2.623 -0.982 1.00 . A A . 31 HIS CG 1 1 13 8101 1 1 31 HIS H H 5.606 -0.140 0.847 1.00 . A A . 31 HIS H 1 1 13 8102 1 1 31 HIS HA H 6.130 2.550 0.156 1.00 . A A . 31 HIS HA 1 1 13 8103 1 1 31 HIS HB2 H 5.000 1.337 -1.491 1.00 . A A . 31 HIS HB2 1 1 13 8104 1 1 31 HIS HB3 H 3.844 0.668 -0.343 1.00 . A A . 31 HIS HB3 1 1 13 8105 1 1 31 HIS HD1 H 4.555 3.747 -2.358 1.00 . A A . 31 HIS HD1 1 1 13 8106 1 1 31 HIS HD2 H 1.599 2.242 0.145 1.00 . A A . 31 HIS HD2 1 1 13 8107 1 1 31 HIS HE1 H 2.590 5.293 -2.632 1.00 . A A . 31 HIS HE1 1 1 13 8108 1 1 31 HIS N N 5.921 0.743 1.132 1.00 . A A . 31 HIS N 1 1 13 8109 1 1 31 HIS ND1 N 3.708 3.629 -1.880 1.00 . A A . 31 HIS ND1 1 1 13 8110 1 1 31 HIS NE2 N 1.700 3.963 -1.212 1.00 . A A . 31 HIS NE2 1 1 13 8111 1 1 31 HIS O O 4.789 3.929 1.763 1.00 . A A . 31 HIS O 1 1 13 8112 1 1 32 GLN C C 3.650 3.707 4.093 1.00 . A A . 32 GLN C 1 1 13 8113 1 1 32 GLN CA C 2.817 2.716 3.287 1.00 . A A . 32 GLN CA 1 1 13 8114 1 1 32 GLN CB C 2.203 1.671 4.220 1.00 . A A . 32 GLN CB 1 1 13 8115 1 1 32 GLN CD C 0.350 -0.017 4.536 1.00 . A A . 32 GLN CD 1 1 13 8116 1 1 32 GLN CG C 1.167 0.787 3.544 1.00 . A A . 32 GLN CG 1 1 13 8117 1 1 32 GLN H H 3.486 1.117 2.073 1.00 . A A . 32 GLN H 1 1 13 8118 1 1 32 GLN HA H 2.023 3.253 2.790 1.00 . A A . 32 GLN HA 1 1 13 8119 1 1 32 GLN HB2 H 2.991 1.038 4.601 1.00 . A A . 32 GLN HB2 1 1 13 8120 1 1 32 GLN HB3 H 1.728 2.178 5.046 1.00 . A A . 32 GLN HB3 1 1 13 8121 1 1 32 GLN HE21 H -1.335 0.554 3.649 1.00 . A A . 32 GLN HE21 1 1 13 8122 1 1 32 GLN HE22 H -1.521 -0.493 5.011 1.00 . A A . 32 GLN HE22 1 1 13 8123 1 1 32 GLN HG2 H 0.496 1.412 2.973 1.00 . A A . 32 GLN HG2 1 1 13 8124 1 1 32 GLN HG3 H 1.674 0.103 2.879 1.00 . A A . 32 GLN HG3 1 1 13 8125 1 1 32 GLN N N 3.628 2.067 2.263 1.00 . A A . 32 GLN N 1 1 13 8126 1 1 32 GLN NE2 N -0.969 0.018 4.385 1.00 . A A . 32 GLN NE2 1 1 13 8127 1 1 32 GLN O O 3.124 4.676 4.642 1.00 . A A . 32 GLN O 1 1 13 8128 1 1 32 GLN OE1 O 0.898 -0.663 5.430 1.00 . A A . 32 GLN OE1 1 1 13 8129 1 1 33 LYS C C 5.605 5.794 4.562 1.00 . A A . 33 LYS C 1 1 13 8130 1 1 33 LYS CA C 5.861 4.329 4.900 1.00 . A A . 33 LYS CA 1 1 13 8131 1 1 33 LYS CB C 7.315 3.969 4.586 1.00 . A A . 33 LYS CB 1 1 13 8132 1 1 33 LYS CD C 9.295 2.606 5.316 1.00 . A A . 33 LYS CD 1 1 13 8133 1 1 33 LYS CE C 9.907 2.421 3.936 1.00 . A A . 33 LYS CE 1 1 13 8134 1 1 33 LYS CG C 7.779 2.682 5.247 1.00 . A A . 33 LYS CG 1 1 13 8135 1 1 33 LYS H H 5.315 2.671 3.703 1.00 . A A . 33 LYS H 1 1 13 8136 1 1 33 LYS HA H 5.681 4.179 5.954 1.00 . A A . 33 LYS HA 1 1 13 8137 1 1 33 LYS HB2 H 7.423 3.859 3.517 1.00 . A A . 33 LYS HB2 1 1 13 8138 1 1 33 LYS HB3 H 7.953 4.773 4.923 1.00 . A A . 33 LYS HB3 1 1 13 8139 1 1 33 LYS HD2 H 9.674 3.522 5.745 1.00 . A A . 33 LYS HD2 1 1 13 8140 1 1 33 LYS HD3 H 9.577 1.770 5.940 1.00 . A A . 33 LYS HD3 1 1 13 8141 1 1 33 LYS HE2 H 9.939 1.366 3.709 1.00 . A A . 33 LYS HE2 1 1 13 8142 1 1 33 LYS HE3 H 9.286 2.926 3.210 1.00 . A A . 33 LYS HE3 1 1 13 8143 1 1 33 LYS HG2 H 7.381 2.640 6.250 1.00 . A A . 33 LYS HG2 1 1 13 8144 1 1 33 LYS HG3 H 7.411 1.842 4.676 1.00 . A A . 33 LYS HG3 1 1 13 8145 1 1 33 LYS HZ1 H 11.532 3.196 2.876 1.00 . A A . 33 LYS HZ1 1 1 13 8146 1 1 33 LYS HZ2 H 11.970 2.281 4.230 1.00 . A A . 33 LYS HZ2 1 1 13 8147 1 1 33 LYS HZ3 H 11.354 3.844 4.428 1.00 . A A . 33 LYS HZ3 1 1 13 8148 1 1 33 LYS N N 4.954 3.459 4.162 1.00 . A A . 33 LYS N 1 1 13 8149 1 1 33 LYS NZ N 11.287 2.975 3.862 1.00 . A A . 33 LYS NZ 1 1 13 8150 1 1 33 LYS O O 5.466 6.632 5.454 1.00 . A A . 33 LYS O 1 1 13 8151 1 1 34 ILE C C 4.074 8.057 3.497 1.00 . A A . 34 ILE C 1 1 13 8152 1 1 34 ILE CA C 5.300 7.460 2.815 1.00 . A A . 34 ILE CA 1 1 13 8153 1 1 34 ILE CB C 5.105 7.518 1.288 1.00 . A A . 34 ILE CB 1 1 13 8154 1 1 34 ILE CD1 C 3.211 7.303 -0.399 1.00 . A A . 34 ILE CD1 1 1 13 8155 1 1 34 ILE CG1 C 3.819 6.792 0.889 1.00 . A A . 34 ILE CG1 1 1 13 8156 1 1 34 ILE CG2 C 6.305 6.911 0.577 1.00 . A A . 34 ILE CG2 1 1 13 8157 1 1 34 ILE H H 5.661 5.385 2.606 1.00 . A A . 34 ILE H 1 1 13 8158 1 1 34 ILE HA H 6.166 8.054 3.070 1.00 . A A . 34 ILE HA 1 1 13 8159 1 1 34 ILE HB H 5.030 8.555 0.997 1.00 . A A . 34 ILE HB 1 1 13 8160 1 1 34 ILE HD11 H 2.164 7.039 -0.432 1.00 . A A . 34 ILE HD11 1 1 13 8161 1 1 34 ILE HD12 H 3.312 8.378 -0.443 1.00 . A A . 34 ILE HD12 1 1 13 8162 1 1 34 ILE HD13 H 3.721 6.858 -1.239 1.00 . A A . 34 ILE HD13 1 1 13 8163 1 1 34 ILE HG12 H 4.030 5.742 0.761 1.00 . A A . 34 ILE HG12 1 1 13 8164 1 1 34 ILE HG13 H 3.086 6.915 1.674 1.00 . A A . 34 ILE HG13 1 1 13 8165 1 1 34 ILE HG21 H 6.012 6.588 -0.411 1.00 . A A . 34 ILE HG21 1 1 13 8166 1 1 34 ILE HG22 H 7.087 7.652 0.496 1.00 . A A . 34 ILE HG22 1 1 13 8167 1 1 34 ILE HG23 H 6.667 6.064 1.140 1.00 . A A . 34 ILE HG23 1 1 13 8168 1 1 34 ILE N N 5.542 6.096 3.270 1.00 . A A . 34 ILE N 1 1 13 8169 1 1 34 ILE O O 3.964 9.274 3.646 1.00 . A A . 34 ILE O 1 1 13 8170 1 1 35 HIS C C 2.165 7.793 6.078 1.00 . A A . 35 HIS C 1 1 13 8171 1 1 35 HIS CA C 1.934 7.633 4.578 1.00 . A A . 35 HIS CA 1 1 13 8172 1 1 35 HIS CB C 0.801 6.638 4.328 1.00 . A A . 35 HIS CB 1 1 13 8173 1 1 35 HIS CD2 C 0.371 5.665 1.962 1.00 . A A . 35 HIS CD2 1 1 13 8174 1 1 35 HIS CE1 C -0.628 7.404 1.077 1.00 . A A . 35 HIS CE1 1 1 13 8175 1 1 35 HIS CG C 0.315 6.628 2.911 1.00 . A A . 35 HIS CG 1 1 13 8176 1 1 35 HIS H H 3.297 6.234 3.762 1.00 . A A . 35 HIS H 1 1 13 8177 1 1 35 HIS HA H 1.658 8.592 4.165 1.00 . A A . 35 HIS HA 1 1 13 8178 1 1 35 HIS HB2 H 1.145 5.643 4.567 1.00 . A A . 35 HIS HB2 1 1 13 8179 1 1 35 HIS HB3 H -0.036 6.887 4.965 1.00 . A A . 35 HIS HB3 1 1 13 8180 1 1 35 HIS HD1 H -0.509 8.562 2.759 1.00 . A A . 35 HIS HD1 1 1 13 8181 1 1 35 HIS HD2 H 0.802 4.680 2.073 1.00 . A A . 35 HIS HD2 1 1 13 8182 1 1 35 HIS HE1 H -1.130 8.054 0.376 1.00 . A A . 35 HIS HE1 1 1 13 8183 1 1 35 HIS N N 3.153 7.192 3.910 1.00 . A A . 35 HIS N 1 1 13 8184 1 1 35 HIS ND1 N -0.316 7.705 2.325 1.00 . A A . 35 HIS ND1 1 1 13 8185 1 1 35 HIS NE2 N -0.221 6.171 0.832 1.00 . A A . 35 HIS NE2 1 1 13 8186 1 1 35 HIS O O 1.848 8.831 6.659 1.00 . A A . 35 HIS O 1 1 13 8187 1 1 36 THR C C 4.289 7.517 8.434 1.00 . A A . 36 THR C 1 1 13 8188 1 1 36 THR CA C 2.989 6.781 8.133 1.00 . A A . 36 THR CA 1 1 13 8189 1 1 36 THR CB C 3.073 5.356 8.713 1.00 . A A . 36 THR CB 1 1 13 8190 1 1 36 THR CG2 C 4.161 4.552 8.017 1.00 . A A . 36 THR CG2 1 1 13 8191 1 1 36 THR H H 2.948 5.957 6.183 1.00 . A A . 36 THR H 1 1 13 8192 1 1 36 THR HA H 2.173 7.297 8.618 1.00 . A A . 36 THR HA 1 1 13 8193 1 1 36 THR HB H 2.124 4.863 8.554 1.00 . A A . 36 THR HB 1 1 13 8194 1 1 36 THR HG1 H 3.709 6.274 10.339 1.00 . A A . 36 THR HG1 1 1 13 8195 1 1 36 THR HG21 H 4.209 3.564 8.450 1.00 . A A . 36 THR HG21 1 1 13 8196 1 1 36 THR HG22 H 5.112 5.047 8.145 1.00 . A A . 36 THR HG22 1 1 13 8197 1 1 36 THR HG23 H 3.933 4.474 6.965 1.00 . A A . 36 THR HG23 1 1 13 8198 1 1 36 THR N N 2.718 6.757 6.701 1.00 . A A . 36 THR N 1 1 13 8199 1 1 36 THR O O 5.332 7.219 7.853 1.00 . A A . 36 THR O 1 1 13 8200 1 1 36 THR OG1 O 3.340 5.415 10.118 1.00 . A A . 36 THR OG1 1 1 13 8201 1 1 37 GLY C C 5.869 8.952 11.121 1.00 . A A . 37 GLY C 1 1 13 8202 1 1 37 GLY CA C 5.400 9.245 9.710 1.00 . A A . 37 GLY CA 1 1 13 8203 1 1 37 GLY H H 3.362 8.675 9.778 1.00 . A A . 37 GLY H 1 1 13 8204 1 1 37 GLY HA2 H 6.196 9.006 9.020 1.00 . A A . 37 GLY HA2 1 1 13 8205 1 1 37 GLY HA3 H 5.171 10.298 9.630 1.00 . A A . 37 GLY HA3 1 1 13 8206 1 1 37 GLY N N 4.220 8.481 9.347 1.00 . A A . 37 GLY N 1 1 13 8207 1 1 37 GLY O O 5.847 7.804 11.563 1.00 . A A . 37 GLY O 1 1 13 8208 1 1 38 GLU C C 5.727 10.324 14.198 1.00 . A A . 38 GLU C 1 1 13 8209 1 1 38 GLU CA C 6.774 9.840 13.198 1.00 . A A . 38 GLU CA 1 1 13 8210 1 1 38 GLU CB C 8.079 10.615 13.395 1.00 . A A . 38 GLU CB 1 1 13 8211 1 1 38 GLU CD C 10.566 10.730 12.969 1.00 . A A . 38 GLU CD 1 1 13 8212 1 1 38 GLU CG C 9.278 9.970 12.720 1.00 . A A . 38 GLU CG 1 1 13 8213 1 1 38 GLU H H 6.289 10.884 11.421 1.00 . A A . 38 GLU H 1 1 13 8214 1 1 38 GLU HA H 6.960 8.791 13.369 1.00 . A A . 38 GLU HA 1 1 13 8215 1 1 38 GLU HB2 H 7.957 11.610 12.994 1.00 . A A . 38 GLU HB2 1 1 13 8216 1 1 38 GLU HB3 H 8.284 10.687 14.453 1.00 . A A . 38 GLU HB3 1 1 13 8217 1 1 38 GLU HG2 H 9.391 8.966 13.098 1.00 . A A . 38 GLU HG2 1 1 13 8218 1 1 38 GLU HG3 H 9.099 9.935 11.655 1.00 . A A . 38 GLU HG3 1 1 13 8219 1 1 38 GLU N N 6.296 9.993 11.829 1.00 . A A . 38 GLU N 1 1 13 8220 1 1 38 GLU O O 6.054 10.969 15.194 1.00 . A A . 38 GLU O 1 1 13 8221 1 1 38 GLU OE1 O 10.518 11.975 13.036 1.00 . A A . 38 GLU OE1 1 1 13 8222 1 1 38 GLU OE2 O 11.623 10.077 13.099 1.00 . A A . 38 GLU OE2 1 1 13 8223 1 1 39 LYS C C 2.521 9.201 15.192 1.00 . A A . 39 LYS C 1 1 13 8224 1 1 39 LYS CA C 3.370 10.406 14.798 1.00 . A A . 39 LYS CA 1 1 13 8225 1 1 39 LYS CB C 2.496 11.455 14.107 1.00 . A A . 39 LYS CB 1 1 13 8226 1 1 39 LYS CD C 0.532 11.860 12.594 1.00 . A A . 39 LYS CD 1 1 13 8227 1 1 39 LYS CE C -0.381 11.263 11.533 1.00 . A A . 39 LYS CE 1 1 13 8228 1 1 39 LYS CG C 1.627 10.888 12.997 1.00 . A A . 39 LYS CG 1 1 13 8229 1 1 39 LYS H H 4.268 9.489 13.115 1.00 . A A . 39 LYS H 1 1 13 8230 1 1 39 LYS HA H 3.797 10.837 15.691 1.00 . A A . 39 LYS HA 1 1 13 8231 1 1 39 LYS HB2 H 1.850 11.911 14.843 1.00 . A A . 39 LYS HB2 1 1 13 8232 1 1 39 LYS HB3 H 3.135 12.215 13.682 1.00 . A A . 39 LYS HB3 1 1 13 8233 1 1 39 LYS HD2 H -0.059 12.104 13.464 1.00 . A A . 39 LYS HD2 1 1 13 8234 1 1 39 LYS HD3 H 0.986 12.759 12.201 1.00 . A A . 39 LYS HD3 1 1 13 8235 1 1 39 LYS HE2 H -0.929 12.062 11.058 1.00 . A A . 39 LYS HE2 1 1 13 8236 1 1 39 LYS HE3 H 0.228 10.757 10.798 1.00 . A A . 39 LYS HE3 1 1 13 8237 1 1 39 LYS HG2 H 2.247 10.683 12.136 1.00 . A A . 39 LYS HG2 1 1 13 8238 1 1 39 LYS HG3 H 1.173 9.970 13.342 1.00 . A A . 39 LYS HG3 1 1 13 8239 1 1 39 LYS HZ1 H -2.061 10.029 11.407 1.00 . A A . 39 LYS HZ1 1 1 13 8240 1 1 39 LYS HZ2 H -1.827 10.713 12.936 1.00 . A A . 39 LYS HZ2 1 1 13 8241 1 1 39 LYS HZ3 H -0.848 9.433 12.424 1.00 . A A . 39 LYS HZ3 1 1 13 8242 1 1 39 LYS N N 4.466 10.006 13.924 1.00 . A A . 39 LYS N 1 1 13 8243 1 1 39 LYS NZ N -1.347 10.291 12.116 1.00 . A A . 39 LYS NZ 1 1 13 8244 1 1 39 LYS O O 2.304 8.281 14.404 1.00 . A A . 39 LYS O 1 1 13 8245 1 1 40 PRO C C -0.186 8.084 16.314 1.00 . A A . 40 PRO C 1 1 13 8246 1 1 40 PRO CA C 1.193 8.122 16.964 1.00 . A A . 40 PRO CA 1 1 13 8247 1 1 40 PRO CB C 1.073 8.456 18.453 1.00 . A A . 40 PRO CB 1 1 13 8248 1 1 40 PRO CD C 2.246 10.271 17.432 1.00 . A A . 40 PRO CD 1 1 13 8249 1 1 40 PRO CG C 1.275 9.930 18.529 1.00 . A A . 40 PRO CG 1 1 13 8250 1 1 40 PRO HA H 1.671 7.160 16.847 1.00 . A A . 40 PRO HA 1 1 13 8251 1 1 40 PRO HB2 H 0.093 8.171 18.811 1.00 . A A . 40 PRO HB2 1 1 13 8252 1 1 40 PRO HB3 H 1.833 7.925 19.007 1.00 . A A . 40 PRO HB3 1 1 13 8253 1 1 40 PRO HD2 H 2.019 11.241 17.015 1.00 . A A . 40 PRO HD2 1 1 13 8254 1 1 40 PRO HD3 H 3.260 10.247 17.805 1.00 . A A . 40 PRO HD3 1 1 13 8255 1 1 40 PRO HG2 H 0.336 10.437 18.369 1.00 . A A . 40 PRO HG2 1 1 13 8256 1 1 40 PRO HG3 H 1.688 10.195 19.491 1.00 . A A . 40 PRO HG3 1 1 13 8257 1 1 40 PRO N N 2.028 9.206 16.439 1.00 . A A . 40 PRO N 1 1 13 8258 1 1 40 PRO O O -0.887 9.095 16.264 1.00 . A A . 40 PRO O 1 1 13 8259 1 1 41 SER C C -2.855 6.056 16.101 1.00 . A A . 41 SER C 1 1 13 8260 1 1 41 SER CA C -1.864 6.745 15.168 1.00 . A A . 41 SER CA 1 1 13 8261 1 1 41 SER CB C -1.710 5.933 13.880 1.00 . A A . 41 SER CB 1 1 13 8262 1 1 41 SER H H 0.034 6.143 15.889 1.00 . A A . 41 SER H 1 1 13 8263 1 1 41 SER HA H -2.241 7.726 14.922 1.00 . A A . 41 SER HA 1 1 13 8264 1 1 41 SER HB2 H -2.686 5.744 13.458 1.00 . A A . 41 SER HB2 1 1 13 8265 1 1 41 SER HB3 H -1.115 6.493 13.174 1.00 . A A . 41 SER HB3 1 1 13 8266 1 1 41 SER HG H -1.586 4.193 14.771 1.00 . A A . 41 SER HG 1 1 13 8267 1 1 41 SER N N -0.570 6.912 15.818 1.00 . A A . 41 SER N 1 1 13 8268 1 1 41 SER O O -2.937 4.829 16.142 1.00 . A A . 41 SER O 1 1 13 8269 1 1 41 SER OG O -1.073 4.693 14.132 1.00 . A A . 41 SER OG 1 1 13 8270 1 1 42 GLY C C -5.510 5.308 17.110 1.00 . A A . 42 GLY C 1 1 13 8271 1 1 42 GLY CA C -4.584 6.308 17.773 1.00 . A A . 42 GLY CA 1 1 13 8272 1 1 42 GLY H H -3.499 7.828 16.775 1.00 . A A . 42 GLY H 1 1 13 8273 1 1 42 GLY HA2 H -4.063 5.820 18.582 1.00 . A A . 42 GLY HA2 1 1 13 8274 1 1 42 GLY HA3 H -5.176 7.117 18.176 1.00 . A A . 42 GLY HA3 1 1 13 8275 1 1 42 GLY N N -3.608 6.857 16.850 1.00 . A A . 42 GLY N 1 1 13 8276 1 1 42 GLY O O -5.857 5.434 15.936 1.00 . A A . 42 GLY O 1 1 13 8277 1 1 43 PRO C C -8.234 3.754 17.124 1.00 . A A . 43 PRO C 1 1 13 8278 1 1 43 PRO CA C -6.821 3.238 17.372 1.00 . A A . 43 PRO CA 1 1 13 8279 1 1 43 PRO CB C -6.820 2.202 18.499 1.00 . A A . 43 PRO CB 1 1 13 8280 1 1 43 PRO CD C -5.552 4.072 19.281 1.00 . A A . 43 PRO CD 1 1 13 8281 1 1 43 PRO CG C -6.482 2.978 19.726 1.00 . A A . 43 PRO CG 1 1 13 8282 1 1 43 PRO HA H -6.440 2.788 16.467 1.00 . A A . 43 PRO HA 1 1 13 8283 1 1 43 PRO HB2 H -7.798 1.748 18.575 1.00 . A A . 43 PRO HB2 1 1 13 8284 1 1 43 PRO HB3 H -6.080 1.444 18.295 1.00 . A A . 43 PRO HB3 1 1 13 8285 1 1 43 PRO HD2 H -5.715 4.967 19.863 1.00 . A A . 43 PRO HD2 1 1 13 8286 1 1 43 PRO HD3 H -4.524 3.749 19.362 1.00 . A A . 43 PRO HD3 1 1 13 8287 1 1 43 PRO HG2 H -7.379 3.399 20.153 1.00 . A A . 43 PRO HG2 1 1 13 8288 1 1 43 PRO HG3 H -5.990 2.335 20.441 1.00 . A A . 43 PRO HG3 1 1 13 8289 1 1 43 PRO N N -5.925 4.285 17.872 1.00 . A A . 43 PRO N 1 1 13 8290 1 1 43 PRO O O -8.545 4.908 17.422 1.00 . A A . 43 PRO O 1 1 13 8291 1 1 44 SER C C -11.406 2.764 17.380 1.00 . A A . 44 SER C 1 1 13 8292 1 1 44 SER CA C -10.467 3.264 16.287 1.00 . A A . 44 SER CA 1 1 13 8293 1 1 44 SER CB C -10.895 2.696 14.932 1.00 . A A . 44 SER CB 1 1 13 8294 1 1 44 SER H H -8.779 1.988 16.363 1.00 . A A . 44 SER H 1 1 13 8295 1 1 44 SER HA H -10.519 4.342 16.249 1.00 . A A . 44 SER HA 1 1 13 8296 1 1 44 SER HB2 H -10.654 1.645 14.893 1.00 . A A . 44 SER HB2 1 1 13 8297 1 1 44 SER HB3 H -11.961 2.826 14.811 1.00 . A A . 44 SER HB3 1 1 13 8298 1 1 44 SER HG H -10.469 4.287 13.871 1.00 . A A . 44 SER HG 1 1 13 8299 1 1 44 SER N N -9.087 2.893 16.578 1.00 . A A . 44 SER N 1 1 13 8300 1 1 44 SER O O -11.024 1.944 18.215 1.00 . A A . 44 SER O 1 1 13 8301 1 1 44 SER OG O -10.231 3.357 13.869 1.00 . A A . 44 SER OG 1 1 13 8302 1 1 45 SER C C -13.491 1.396 18.716 1.00 . A A . 45 SER C 1 1 13 8303 1 1 45 SER CA C -13.631 2.873 18.362 1.00 . A A . 45 SER CA 1 1 13 8304 1 1 45 SER CB C -15.041 3.153 17.840 1.00 . A A . 45 SER CB 1 1 13 8305 1 1 45 SER H H -12.881 3.916 16.678 1.00 . A A . 45 SER H 1 1 13 8306 1 1 45 SER HA H -13.461 3.462 19.251 1.00 . A A . 45 SER HA 1 1 13 8307 1 1 45 SER HB2 H -15.159 4.214 17.679 1.00 . A A . 45 SER HB2 1 1 13 8308 1 1 45 SER HB3 H -15.188 2.629 16.906 1.00 . A A . 45 SER HB3 1 1 13 8309 1 1 45 SER HG H -15.887 3.162 19.607 1.00 . A A . 45 SER HG 1 1 13 8310 1 1 45 SER N N -12.637 3.265 17.369 1.00 . A A . 45 SER N 1 1 13 8311 1 1 45 SER O O -13.495 1.024 19.889 1.00 . A A . 45 SER O 1 1 13 8312 1 1 45 SER OG O -16.023 2.720 18.766 1.00 . A A . 45 SER OG 1 1 13 8313 1 1 46 GLY C C -11.781 -1.315 17.943 1.00 . A A . 46 GLY C 1 1 13 8314 1 1 46 GLY CA C -13.230 -0.871 17.914 1.00 . A A . 46 GLY CA 1 1 13 8315 1 1 46 GLY H H -13.373 0.910 16.777 1.00 . A A . 46 GLY H 1 1 13 8316 1 1 46 GLY HA2 H -13.692 -1.124 18.856 1.00 . A A . 46 GLY HA2 1 1 13 8317 1 1 46 GLY HA3 H -13.740 -1.398 17.121 1.00 . A A . 46 GLY HA3 1 1 13 8318 1 1 46 GLY N N -13.369 0.557 17.691 1.00 . A A . 46 GLY N 1 1 13 8319 1 1 46 GLY O O -11.524 -2.515 18.023 1.00 . A A . 46 GLY O 1 1 13 8320 2 2 1 ZN ZN ZN -0.194 4.640 -0.604 1.00 . B A . 201 ZN ZN 1 1 14 8321 1 1 1 GLY C C -10.698 -8.344 -29.492 1.00 . A A . 1 GLY C 1 1 14 8322 1 1 1 GLY CA C -10.704 -8.076 -30.984 1.00 . A A . 1 GLY CA 1 1 14 8323 1 1 1 GLY H1 H -12.295 -6.684 -31.099 1.00 . A A . 1 GLY H1 1 1 14 8324 1 1 1 GLY HA2 H -10.503 -8.999 -31.506 1.00 . A A . 1 GLY HA2 1 1 14 8325 1 1 1 GLY HA3 H -9.922 -7.367 -31.213 1.00 . A A . 1 GLY HA3 1 1 14 8326 1 1 1 GLY N N -11.971 -7.541 -31.447 1.00 . A A . 1 GLY N 1 1 14 8327 1 1 1 GLY O O -10.921 -9.474 -29.056 1.00 . A A . 1 GLY O 1 1 14 8328 1 1 2 SER C C -11.791 -7.720 -26.696 1.00 . A A . 2 SER C 1 1 14 8329 1 1 2 SER CA C -10.400 -7.433 -27.254 1.00 . A A . 2 SER CA 1 1 14 8330 1 1 2 SER CB C -9.838 -6.158 -26.622 1.00 . A A . 2 SER CB 1 1 14 8331 1 1 2 SER H H -10.271 -6.428 -29.113 1.00 . A A . 2 SER H 1 1 14 8332 1 1 2 SER HA H -9.751 -8.261 -27.013 1.00 . A A . 2 SER HA 1 1 14 8333 1 1 2 SER HB2 H -9.485 -6.379 -25.627 1.00 . A A . 2 SER HB2 1 1 14 8334 1 1 2 SER HB3 H -9.017 -5.794 -27.223 1.00 . A A . 2 SER HB3 1 1 14 8335 1 1 2 SER HG H -11.340 -5.265 -25.738 1.00 . A A . 2 SER HG 1 1 14 8336 1 1 2 SER N N -10.440 -7.303 -28.706 1.00 . A A . 2 SER N 1 1 14 8337 1 1 2 SER O O -12.724 -6.940 -26.892 1.00 . A A . 2 SER O 1 1 14 8338 1 1 2 SER OG O -10.829 -5.149 -26.542 1.00 . A A . 2 SER OG 1 1 14 8339 1 1 3 SER C C -13.386 -8.604 -24.040 1.00 . A A . 3 SER C 1 1 14 8340 1 1 3 SER CA C -13.199 -9.237 -25.416 1.00 . A A . 3 SER CA 1 1 14 8341 1 1 3 SER CB C -13.286 -10.761 -25.304 1.00 . A A . 3 SER CB 1 1 14 8342 1 1 3 SER H H -11.142 -9.425 -25.878 1.00 . A A . 3 SER H 1 1 14 8343 1 1 3 SER HA H -13.984 -8.888 -26.070 1.00 . A A . 3 SER HA 1 1 14 8344 1 1 3 SER HB2 H -13.137 -11.200 -26.279 1.00 . A A . 3 SER HB2 1 1 14 8345 1 1 3 SER HB3 H -12.519 -11.114 -24.630 1.00 . A A . 3 SER HB3 1 1 14 8346 1 1 3 SER HG H -14.881 -11.898 -25.334 1.00 . A A . 3 SER HG 1 1 14 8347 1 1 3 SER N N -11.922 -8.844 -26.000 1.00 . A A . 3 SER N 1 1 14 8348 1 1 3 SER O O -14.442 -8.051 -23.737 1.00 . A A . 3 SER O 1 1 14 8349 1 1 3 SER OG O -14.550 -11.165 -24.809 1.00 . A A . 3 SER OG 1 1 14 8350 1 1 4 GLY C C -11.905 -9.074 -20.815 1.00 . A A . 4 GLY C 1 1 14 8351 1 1 4 GLY CA C -12.419 -8.122 -21.877 1.00 . A A . 4 GLY CA 1 1 14 8352 1 1 4 GLY H H -11.533 -9.144 -23.507 1.00 . A A . 4 GLY H 1 1 14 8353 1 1 4 GLY HA2 H -11.829 -7.218 -21.852 1.00 . A A . 4 GLY HA2 1 1 14 8354 1 1 4 GLY HA3 H -13.447 -7.876 -21.656 1.00 . A A . 4 GLY HA3 1 1 14 8355 1 1 4 GLY N N -12.350 -8.691 -23.211 1.00 . A A . 4 GLY N 1 1 14 8356 1 1 4 GLY O O -12.606 -9.371 -19.847 1.00 . A A . 4 GLY O 1 1 14 8357 1 1 5 SER C C -9.356 -9.728 -18.932 1.00 . A A . 5 SER C 1 1 14 8358 1 1 5 SER CA C -10.074 -10.482 -20.047 1.00 . A A . 5 SER CA 1 1 14 8359 1 1 5 SER CB C -9.093 -11.411 -20.765 1.00 . A A . 5 SER CB 1 1 14 8360 1 1 5 SER H H -10.170 -9.280 -21.787 1.00 . A A . 5 SER H 1 1 14 8361 1 1 5 SER HA H -10.865 -11.075 -19.613 1.00 . A A . 5 SER HA 1 1 14 8362 1 1 5 SER HB2 H -9.520 -11.723 -21.706 1.00 . A A . 5 SER HB2 1 1 14 8363 1 1 5 SER HB3 H -8.169 -10.882 -20.947 1.00 . A A . 5 SER HB3 1 1 14 8364 1 1 5 SER HG H -8.955 -12.359 -19.056 1.00 . A A . 5 SER HG 1 1 14 8365 1 1 5 SER N N -10.679 -9.554 -20.995 1.00 . A A . 5 SER N 1 1 14 8366 1 1 5 SER O O -8.259 -10.105 -18.519 1.00 . A A . 5 SER O 1 1 14 8367 1 1 5 SER OG O -8.815 -12.561 -19.985 1.00 . A A . 5 SER OG 1 1 14 8368 1 1 6 SER C C -8.626 -8.720 -16.401 1.00 . A A . 6 SER C 1 1 14 8369 1 1 6 SER CA C -9.402 -7.850 -17.385 1.00 . A A . 6 SER CA 1 1 14 8370 1 1 6 SER CB C -10.499 -7.079 -16.647 1.00 . A A . 6 SER CB 1 1 14 8371 1 1 6 SER H H -10.855 -8.410 -18.819 1.00 . A A . 6 SER H 1 1 14 8372 1 1 6 SER HA H -8.722 -7.145 -17.838 1.00 . A A . 6 SER HA 1 1 14 8373 1 1 6 SER HB2 H -10.046 -6.428 -15.914 1.00 . A A . 6 SER HB2 1 1 14 8374 1 1 6 SER HB3 H -11.059 -6.488 -17.356 1.00 . A A . 6 SER HB3 1 1 14 8375 1 1 6 SER HG H -11.712 -8.617 -16.610 1.00 . A A . 6 SER HG 1 1 14 8376 1 1 6 SER N N -9.982 -8.660 -18.449 1.00 . A A . 6 SER N 1 1 14 8377 1 1 6 SER O O -9.214 -9.427 -15.583 1.00 . A A . 6 SER O 1 1 14 8378 1 1 6 SER OG O -11.387 -7.963 -15.986 1.00 . A A . 6 SER OG 1 1 14 8379 1 1 7 GLY C C -5.335 -8.638 -14.996 1.00 . A A . 7 GLY C 1 1 14 8380 1 1 7 GLY CA C -6.465 -9.449 -15.599 1.00 . A A . 7 GLY CA 1 1 14 8381 1 1 7 GLY H H -6.887 -8.080 -17.158 1.00 . A A . 7 GLY H 1 1 14 8382 1 1 7 GLY HA2 H -7.076 -9.843 -14.802 1.00 . A A . 7 GLY HA2 1 1 14 8383 1 1 7 GLY HA3 H -6.043 -10.272 -16.157 1.00 . A A . 7 GLY HA3 1 1 14 8384 1 1 7 GLY N N -7.301 -8.662 -16.487 1.00 . A A . 7 GLY N 1 1 14 8385 1 1 7 GLY O O -5.361 -8.308 -13.810 1.00 . A A . 7 GLY O 1 1 14 8386 1 1 8 THR C C -3.625 -6.172 -14.839 1.00 . A A . 8 THR C 1 1 14 8387 1 1 8 THR CA C -3.192 -7.540 -15.354 1.00 . A A . 8 THR CA 1 1 14 8388 1 1 8 THR CB C -2.156 -7.349 -16.477 1.00 . A A . 8 THR CB 1 1 14 8389 1 1 8 THR CG2 C -2.796 -6.711 -17.701 1.00 . A A . 8 THR CG2 1 1 14 8390 1 1 8 THR H H -4.374 -8.607 -16.749 1.00 . A A . 8 THR H 1 1 14 8391 1 1 8 THR HA H -2.723 -8.085 -14.548 1.00 . A A . 8 THR HA 1 1 14 8392 1 1 8 THR HB H -1.767 -8.318 -16.756 1.00 . A A . 8 THR HB 1 1 14 8393 1 1 8 THR HG1 H -1.343 -5.606 -16.040 1.00 . A A . 8 THR HG1 1 1 14 8394 1 1 8 THR HG21 H -2.192 -6.920 -18.572 1.00 . A A . 8 THR HG21 1 1 14 8395 1 1 8 THR HG22 H -2.863 -5.643 -17.557 1.00 . A A . 8 THR HG22 1 1 14 8396 1 1 8 THR HG23 H -3.785 -7.119 -17.843 1.00 . A A . 8 THR HG23 1 1 14 8397 1 1 8 THR N N -4.338 -8.315 -15.814 1.00 . A A . 8 THR N 1 1 14 8398 1 1 8 THR O O -4.228 -5.386 -15.568 1.00 . A A . 8 THR O 1 1 14 8399 1 1 8 THR OG1 O -1.078 -6.528 -16.014 1.00 . A A . 8 THR OG1 1 1 14 8400 1 1 9 GLY C C -4.243 -4.769 -11.588 1.00 . A A . 9 GLY C 1 1 14 8401 1 1 9 GLY CA C -3.677 -4.619 -12.986 1.00 . A A . 9 GLY CA 1 1 14 8402 1 1 9 GLY H H -2.831 -6.560 -13.042 1.00 . A A . 9 GLY H 1 1 14 8403 1 1 9 GLY HA2 H -2.799 -3.991 -12.943 1.00 . A A . 9 GLY HA2 1 1 14 8404 1 1 9 GLY HA3 H -4.417 -4.143 -13.613 1.00 . A A . 9 GLY HA3 1 1 14 8405 1 1 9 GLY N N -3.312 -5.894 -13.577 1.00 . A A . 9 GLY N 1 1 14 8406 1 1 9 GLY O O -4.056 -3.897 -10.740 1.00 . A A . 9 GLY O 1 1 14 8407 1 1 10 GLU C C -4.600 -6.964 -9.171 1.00 . A A . 10 GLU C 1 1 14 8408 1 1 10 GLU CA C -5.537 -6.134 -10.044 1.00 . A A . 10 GLU CA 1 1 14 8409 1 1 10 GLU CB C -6.876 -6.857 -10.206 1.00 . A A . 10 GLU CB 1 1 14 8410 1 1 10 GLU CD C -9.080 -7.508 -9.157 1.00 . A A . 10 GLU CD 1 1 14 8411 1 1 10 GLU CG C -7.761 -6.782 -8.973 1.00 . A A . 10 GLU CG 1 1 14 8412 1 1 10 GLU H H -5.053 -6.534 -12.066 1.00 . A A . 10 GLU H 1 1 14 8413 1 1 10 GLU HA H -5.708 -5.183 -9.563 1.00 . A A . 10 GLU HA 1 1 14 8414 1 1 10 GLU HB2 H -7.410 -6.419 -11.036 1.00 . A A . 10 GLU HB2 1 1 14 8415 1 1 10 GLU HB3 H -6.684 -7.898 -10.422 1.00 . A A . 10 GLU HB3 1 1 14 8416 1 1 10 GLU HG2 H -7.236 -7.226 -8.141 1.00 . A A . 10 GLU HG2 1 1 14 8417 1 1 10 GLU HG3 H -7.966 -5.744 -8.756 1.00 . A A . 10 GLU HG3 1 1 14 8418 1 1 10 GLU N N -4.939 -5.876 -11.349 1.00 . A A . 10 GLU N 1 1 14 8419 1 1 10 GLU O O -4.323 -8.126 -9.468 1.00 . A A . 10 GLU O 1 1 14 8420 1 1 10 GLU OE1 O -9.077 -8.599 -9.763 1.00 . A A . 10 GLU OE1 1 1 14 8421 1 1 10 GLU OE2 O -10.114 -6.984 -8.693 1.00 . A A . 10 GLU OE2 1 1 14 8422 1 1 11 LYS C C -3.926 -7.415 -5.882 1.00 . A A . 11 LYS C 1 1 14 8423 1 1 11 LYS CA C -3.209 -7.039 -7.175 1.00 . A A . 11 LYS CA 1 1 14 8424 1 1 11 LYS CB C -2.003 -6.151 -6.862 1.00 . A A . 11 LYS CB 1 1 14 8425 1 1 11 LYS CD C -0.418 -7.137 -8.543 1.00 . A A . 11 LYS CD 1 1 14 8426 1 1 11 LYS CE C 0.325 -6.903 -9.849 1.00 . A A . 11 LYS CE 1 1 14 8427 1 1 11 LYS CG C -1.121 -5.877 -8.068 1.00 . A A . 11 LYS CG 1 1 14 8428 1 1 11 LYS H H -4.372 -5.430 -7.909 1.00 . A A . 11 LYS H 1 1 14 8429 1 1 11 LYS HA H -2.865 -7.942 -7.656 1.00 . A A . 11 LYS HA 1 1 14 8430 1 1 11 LYS HB2 H -2.358 -5.205 -6.479 1.00 . A A . 11 LYS HB2 1 1 14 8431 1 1 11 LYS HB3 H -1.402 -6.634 -6.105 1.00 . A A . 11 LYS HB3 1 1 14 8432 1 1 11 LYS HD2 H 0.290 -7.450 -7.790 1.00 . A A . 11 LYS HD2 1 1 14 8433 1 1 11 LYS HD3 H -1.155 -7.915 -8.692 1.00 . A A . 11 LYS HD3 1 1 14 8434 1 1 11 LYS HE2 H -0.397 -6.723 -10.631 1.00 . A A . 11 LYS HE2 1 1 14 8435 1 1 11 LYS HE3 H 0.958 -6.035 -9.737 1.00 . A A . 11 LYS HE3 1 1 14 8436 1 1 11 LYS HG2 H -1.733 -5.494 -8.871 1.00 . A A . 11 LYS HG2 1 1 14 8437 1 1 11 LYS HG3 H -0.377 -5.141 -7.798 1.00 . A A . 11 LYS HG3 1 1 14 8438 1 1 11 LYS HZ1 H 0.982 -8.868 -9.583 1.00 . A A . 11 LYS HZ1 1 1 14 8439 1 1 11 LYS HZ2 H 2.174 -7.820 -10.168 1.00 . A A . 11 LYS HZ2 1 1 14 8440 1 1 11 LYS HZ3 H 0.951 -8.369 -11.199 1.00 . A A . 11 LYS HZ3 1 1 14 8441 1 1 11 LYS N N -4.114 -6.359 -8.093 1.00 . A A . 11 LYS N 1 1 14 8442 1 1 11 LYS NZ N 1.167 -8.072 -10.226 1.00 . A A . 11 LYS NZ 1 1 14 8443 1 1 11 LYS O O -4.907 -6.787 -5.483 1.00 . A A . 11 LYS O 1 1 14 8444 1 1 12 PRO C C -3.774 -7.969 -2.799 1.00 . A A . 12 PRO C 1 1 14 8445 1 1 12 PRO CA C -4.003 -8.943 -3.950 1.00 . A A . 12 PRO CA 1 1 14 8446 1 1 12 PRO CB C -3.258 -10.255 -3.697 1.00 . A A . 12 PRO CB 1 1 14 8447 1 1 12 PRO CD C -2.259 -9.257 -5.626 1.00 . A A . 12 PRO CD 1 1 14 8448 1 1 12 PRO CG C -1.963 -10.101 -4.417 1.00 . A A . 12 PRO CG 1 1 14 8449 1 1 12 PRO HA H -5.060 -9.140 -4.048 1.00 . A A . 12 PRO HA 1 1 14 8450 1 1 12 PRO HB2 H -3.107 -10.387 -2.634 1.00 . A A . 12 PRO HB2 1 1 14 8451 1 1 12 PRO HB3 H -3.831 -11.081 -4.090 1.00 . A A . 12 PRO HB3 1 1 14 8452 1 1 12 PRO HD2 H -1.419 -8.619 -5.856 1.00 . A A . 12 PRO HD2 1 1 14 8453 1 1 12 PRO HD3 H -2.502 -9.883 -6.472 1.00 . A A . 12 PRO HD3 1 1 14 8454 1 1 12 PRO HG2 H -1.246 -9.605 -3.780 1.00 . A A . 12 PRO HG2 1 1 14 8455 1 1 12 PRO HG3 H -1.592 -11.069 -4.718 1.00 . A A . 12 PRO HG3 1 1 14 8456 1 1 12 PRO N N -3.426 -8.462 -5.209 1.00 . A A . 12 PRO N 1 1 14 8457 1 1 12 PRO O O -4.441 -8.046 -1.766 1.00 . A A . 12 PRO O 1 1 14 8458 1 1 13 TYR C C -2.779 -4.652 -2.463 1.00 . A A . 13 TYR C 1 1 14 8459 1 1 13 TYR CA C -2.511 -6.067 -1.958 1.00 . A A . 13 TYR CA 1 1 14 8460 1 1 13 TYR CB C -1.049 -6.199 -1.529 1.00 . A A . 13 TYR CB 1 1 14 8461 1 1 13 TYR CD1 C -0.957 -7.950 0.288 1.00 . A A . 13 TYR CD1 1 1 14 8462 1 1 13 TYR CD2 C -0.077 -8.507 -1.856 1.00 . A A . 13 TYR CD2 1 1 14 8463 1 1 13 TYR CE1 C -0.628 -9.208 0.755 1.00 . A A . 13 TYR CE1 1 1 14 8464 1 1 13 TYR CE2 C 0.253 -9.767 -1.398 1.00 . A A . 13 TYR CE2 1 1 14 8465 1 1 13 TYR CG C -0.688 -7.577 -1.023 1.00 . A A . 13 TYR CG 1 1 14 8466 1 1 13 TYR CZ C -0.024 -10.113 -0.092 1.00 . A A . 13 TYR CZ 1 1 14 8467 1 1 13 TYR H H -2.332 -7.044 -3.827 1.00 . A A . 13 TYR H 1 1 14 8468 1 1 13 TYR HA H -3.145 -6.259 -1.105 1.00 . A A . 13 TYR HA 1 1 14 8469 1 1 13 TYR HB2 H -0.412 -5.978 -2.372 1.00 . A A . 13 TYR HB2 1 1 14 8470 1 1 13 TYR HB3 H -0.848 -5.491 -0.738 1.00 . A A . 13 TYR HB3 1 1 14 8471 1 1 13 TYR HD1 H -1.430 -7.238 0.949 1.00 . A A . 13 TYR HD1 1 1 14 8472 1 1 13 TYR HD2 H 0.139 -8.232 -2.879 1.00 . A A . 13 TYR HD2 1 1 14 8473 1 1 13 TYR HE1 H -0.845 -9.479 1.778 1.00 . A A . 13 TYR HE1 1 1 14 8474 1 1 13 TYR HE2 H 0.727 -10.476 -2.061 1.00 . A A . 13 TYR HE2 1 1 14 8475 1 1 13 TYR HH H -0.496 -11.849 0.585 1.00 . A A . 13 TYR HH 1 1 14 8476 1 1 13 TYR N N -2.829 -7.055 -2.983 1.00 . A A . 13 TYR N 1 1 14 8477 1 1 13 TYR O O -2.233 -4.231 -3.483 1.00 . A A . 13 TYR O 1 1 14 8478 1 1 13 TYR OH O 0.305 -11.367 0.368 1.00 . A A . 13 TYR OH 1 1 14 8479 1 1 14 ARG C C -3.716 -1.597 -0.955 1.00 . A A . 14 ARG C 1 1 14 8480 1 1 14 ARG CA C -3.967 -2.557 -2.115 1.00 . A A . 14 ARG CA 1 1 14 8481 1 1 14 ARG CB C -5.431 -2.476 -2.550 1.00 . A A . 14 ARG CB 1 1 14 8482 1 1 14 ARG CD C -7.185 -0.802 -3.213 1.00 . A A . 14 ARG CD 1 1 14 8483 1 1 14 ARG CG C -5.746 -1.258 -3.403 1.00 . A A . 14 ARG CG 1 1 14 8484 1 1 14 ARG CZ C -8.859 0.436 -4.520 1.00 . A A . 14 ARG CZ 1 1 14 8485 1 1 14 ARG H H -4.028 -4.315 -0.938 1.00 . A A . 14 ARG H 1 1 14 8486 1 1 14 ARG HA H -3.337 -2.272 -2.944 1.00 . A A . 14 ARG HA 1 1 14 8487 1 1 14 ARG HB2 H -5.674 -3.360 -3.121 1.00 . A A . 14 ARG HB2 1 1 14 8488 1 1 14 ARG HB3 H -6.054 -2.443 -1.670 1.00 . A A . 14 ARG HB3 1 1 14 8489 1 1 14 ARG HD2 H -7.832 -1.664 -3.271 1.00 . A A . 14 ARG HD2 1 1 14 8490 1 1 14 ARG HD3 H -7.278 -0.347 -2.238 1.00 . A A . 14 ARG HD3 1 1 14 8491 1 1 14 ARG HE H -6.884 0.634 -4.717 1.00 . A A . 14 ARG HE 1 1 14 8492 1 1 14 ARG HG2 H -5.085 -0.452 -3.121 1.00 . A A . 14 ARG HG2 1 1 14 8493 1 1 14 ARG HG3 H -5.591 -1.508 -4.442 1.00 . A A . 14 ARG HG3 1 1 14 8494 1 1 14 ARG HH11 H -9.622 -0.855 -3.167 1.00 . A A . 14 ARG HH11 1 1 14 8495 1 1 14 ARG HH12 H -10.791 0.024 -4.095 1.00 . A A . 14 ARG HH12 1 1 14 8496 1 1 14 ARG HH21 H -8.413 1.798 -5.945 1.00 . A A . 14 ARG HH21 1 1 14 8497 1 1 14 ARG HH22 H -10.103 1.533 -5.675 1.00 . A A . 14 ARG HH22 1 1 14 8498 1 1 14 ARG N N -3.625 -3.924 -1.741 1.00 . A A . 14 ARG N 1 1 14 8499 1 1 14 ARG NE N -7.591 0.165 -4.229 1.00 . A A . 14 ARG NE 1 1 14 8500 1 1 14 ARG NH1 N -9.837 -0.183 -3.874 1.00 . A A . 14 ARG NH1 1 1 14 8501 1 1 14 ARG NH2 N -9.149 1.330 -5.457 1.00 . A A . 14 ARG NH2 1 1 14 8502 1 1 14 ARG O O -4.004 -1.914 0.200 1.00 . A A . 14 ARG O 1 1 14 8503 1 1 15 CYS C C -4.164 1.287 0.193 1.00 . A A . 15 CYS C 1 1 14 8504 1 1 15 CYS CA C -2.887 0.582 -0.256 1.00 . A A . 15 CYS CA 1 1 14 8505 1 1 15 CYS CB C -1.888 1.607 -0.796 1.00 . A A . 15 CYS CB 1 1 14 8506 1 1 15 CYS H H -2.971 -0.230 -2.209 1.00 . A A . 15 CYS H 1 1 14 8507 1 1 15 CYS HA H -2.450 0.080 0.594 1.00 . A A . 15 CYS HA 1 1 14 8508 1 1 15 CYS HB2 H -1.101 1.088 -1.323 1.00 . A A . 15 CYS HB2 1 1 14 8509 1 1 15 CYS HB3 H -2.398 2.268 -1.482 1.00 . A A . 15 CYS HB3 1 1 14 8510 1 1 15 CYS N N -3.178 -0.424 -1.270 1.00 . A A . 15 CYS N 1 1 14 8511 1 1 15 CYS O O -4.886 1.863 -0.621 1.00 . A A . 15 CYS O 1 1 14 8512 1 1 15 CYS SG S -1.109 2.635 0.490 1.00 . A A . 15 CYS SG 1 1 14 8513 1 1 16 ALA C C -5.376 3.351 2.327 1.00 . A A . 16 ALA C 1 1 14 8514 1 1 16 ALA CA C -5.623 1.872 2.050 1.00 . A A . 16 ALA CA 1 1 14 8515 1 1 16 ALA CB C -6.054 1.159 3.323 1.00 . A A . 16 ALA CB 1 1 14 8516 1 1 16 ALA H H -3.822 0.762 2.091 1.00 . A A . 16 ALA H 1 1 14 8517 1 1 16 ALA HA H -6.421 1.780 1.327 1.00 . A A . 16 ALA HA 1 1 14 8518 1 1 16 ALA HB1 H -5.270 0.490 3.644 1.00 . A A . 16 ALA HB1 1 1 14 8519 1 1 16 ALA HB2 H -6.244 1.889 4.097 1.00 . A A . 16 ALA HB2 1 1 14 8520 1 1 16 ALA HB3 H -6.955 0.595 3.132 1.00 . A A . 16 ALA HB3 1 1 14 8521 1 1 16 ALA N N -4.436 1.236 1.493 1.00 . A A . 16 ALA N 1 1 14 8522 1 1 16 ALA O O -5.959 3.925 3.246 1.00 . A A . 16 ALA O 1 1 14 8523 1 1 17 GLU C C -4.373 6.129 0.376 1.00 . A A . 17 GLU C 1 1 14 8524 1 1 17 GLU CA C -4.183 5.373 1.688 1.00 . A A . 17 GLU CA 1 1 14 8525 1 1 17 GLU CB C -2.742 5.535 2.178 1.00 . A A . 17 GLU CB 1 1 14 8526 1 1 17 GLU CD C -3.054 5.813 4.669 1.00 . A A . 17 GLU CD 1 1 14 8527 1 1 17 GLU CG C -2.498 4.946 3.557 1.00 . A A . 17 GLU CG 1 1 14 8528 1 1 17 GLU H H -4.075 3.449 0.811 1.00 . A A . 17 GLU H 1 1 14 8529 1 1 17 GLU HA H -4.853 5.785 2.427 1.00 . A A . 17 GLU HA 1 1 14 8530 1 1 17 GLU HB2 H -2.079 5.048 1.478 1.00 . A A . 17 GLU HB2 1 1 14 8531 1 1 17 GLU HB3 H -2.503 6.588 2.212 1.00 . A A . 17 GLU HB3 1 1 14 8532 1 1 17 GLU HG2 H -2.970 3.976 3.608 1.00 . A A . 17 GLU HG2 1 1 14 8533 1 1 17 GLU HG3 H -1.434 4.835 3.704 1.00 . A A . 17 GLU HG3 1 1 14 8534 1 1 17 GLU N N -4.507 3.961 1.527 1.00 . A A . 17 GLU N 1 1 14 8535 1 1 17 GLU O O -5.044 7.161 0.332 1.00 . A A . 17 GLU O 1 1 14 8536 1 1 17 GLU OE1 O -3.980 6.606 4.396 1.00 . A A . 17 GLU OE1 1 1 14 8537 1 1 17 GLU OE2 O -2.564 5.700 5.812 1.00 . A A . 17 GLU OE2 1 1 14 8538 1 1 18 CYS C C -4.663 5.344 -2.970 1.00 . A A . 18 CYS C 1 1 14 8539 1 1 18 CYS CA C -3.880 6.232 -2.005 1.00 . A A . 18 CYS CA 1 1 14 8540 1 1 18 CYS CB C -2.486 6.512 -2.570 1.00 . A A . 18 CYS CB 1 1 14 8541 1 1 18 CYS H H -3.257 4.782 -0.594 1.00 . A A . 18 CYS H 1 1 14 8542 1 1 18 CYS HA H -4.407 7.167 -1.889 1.00 . A A . 18 CYS HA 1 1 14 8543 1 1 18 CYS HB2 H -2.583 6.888 -3.578 1.00 . A A . 18 CYS HB2 1 1 14 8544 1 1 18 CYS HB3 H -2.002 7.258 -1.958 1.00 . A A . 18 CYS HB3 1 1 14 8545 1 1 18 CYS N N -3.778 5.608 -0.692 1.00 . A A . 18 CYS N 1 1 14 8546 1 1 18 CYS O O -5.580 5.804 -3.648 1.00 . A A . 18 CYS O 1 1 14 8547 1 1 18 CYS SG S -1.400 5.051 -2.628 1.00 . A A . 18 CYS SG 1 1 14 8548 1 1 19 GLY C C -4.006 2.392 -4.811 1.00 . A A . 19 GLY C 1 1 14 8549 1 1 19 GLY CA C -4.968 3.137 -3.908 1.00 . A A . 19 GLY CA 1 1 14 8550 1 1 19 GLY H H -3.553 3.757 -2.460 1.00 . A A . 19 GLY H 1 1 14 8551 1 1 19 GLY HA2 H -5.512 2.421 -3.310 1.00 . A A . 19 GLY HA2 1 1 14 8552 1 1 19 GLY HA3 H -5.669 3.684 -4.521 1.00 . A A . 19 GLY HA3 1 1 14 8553 1 1 19 GLY N N -4.292 4.069 -3.025 1.00 . A A . 19 GLY N 1 1 14 8554 1 1 19 GLY O O -4.370 1.979 -5.913 1.00 . A A . 19 GLY O 1 1 14 8555 1 1 20 LYS C C -1.896 0.010 -4.966 1.00 . A A . 20 LYS C 1 1 14 8556 1 1 20 LYS CA C -1.754 1.520 -5.120 1.00 . A A . 20 LYS CA 1 1 14 8557 1 1 20 LYS CB C -0.357 1.960 -4.676 1.00 . A A . 20 LYS CB 1 1 14 8558 1 1 20 LYS CD C 1.031 2.584 -6.674 1.00 . A A . 20 LYS CD 1 1 14 8559 1 1 20 LYS CE C 0.176 2.381 -7.916 1.00 . A A . 20 LYS CE 1 1 14 8560 1 1 20 LYS CG C 0.748 1.524 -5.623 1.00 . A A . 20 LYS CG 1 1 14 8561 1 1 20 LYS H H -2.543 2.572 -3.461 1.00 . A A . 20 LYS H 1 1 14 8562 1 1 20 LYS HA H -1.890 1.779 -6.159 1.00 . A A . 20 LYS HA 1 1 14 8563 1 1 20 LYS HB2 H -0.337 3.037 -4.604 1.00 . A A . 20 LYS HB2 1 1 14 8564 1 1 20 LYS HB3 H -0.153 1.539 -3.702 1.00 . A A . 20 LYS HB3 1 1 14 8565 1 1 20 LYS HD2 H 0.817 3.557 -6.258 1.00 . A A . 20 LYS HD2 1 1 14 8566 1 1 20 LYS HD3 H 2.074 2.532 -6.953 1.00 . A A . 20 LYS HD3 1 1 14 8567 1 1 20 LYS HE2 H 0.729 2.722 -8.777 1.00 . A A . 20 LYS HE2 1 1 14 8568 1 1 20 LYS HE3 H -0.040 1.328 -8.020 1.00 . A A . 20 LYS HE3 1 1 14 8569 1 1 20 LYS HG2 H 1.648 1.346 -5.055 1.00 . A A . 20 LYS HG2 1 1 14 8570 1 1 20 LYS HG3 H 0.446 0.611 -6.118 1.00 . A A . 20 LYS HG3 1 1 14 8571 1 1 20 LYS HZ1 H -1.901 2.515 -8.097 1.00 . A A . 20 LYS HZ1 1 1 14 8572 1 1 20 LYS HZ2 H -1.085 3.946 -8.483 1.00 . A A . 20 LYS HZ2 1 1 14 8573 1 1 20 LYS HZ3 H -1.256 3.481 -6.866 1.00 . A A . 20 LYS HZ3 1 1 14 8574 1 1 20 LYS N N -2.773 2.220 -4.347 1.00 . A A . 20 LYS N 1 1 14 8575 1 1 20 LYS NZ N -1.107 3.133 -7.835 1.00 . A A . 20 LYS NZ 1 1 14 8576 1 1 20 LYS O O -2.356 -0.478 -3.934 1.00 . A A . 20 LYS O 1 1 14 8577 1 1 21 ALA C C -0.192 -2.805 -5.856 1.00 . A A . 21 ALA C 1 1 14 8578 1 1 21 ALA CA C -1.578 -2.181 -5.976 1.00 . A A . 21 ALA CA 1 1 14 8579 1 1 21 ALA CB C -2.281 -2.690 -7.226 1.00 . A A . 21 ALA CB 1 1 14 8580 1 1 21 ALA H H -1.140 -0.279 -6.794 1.00 . A A . 21 ALA H 1 1 14 8581 1 1 21 ALA HA H -2.167 -2.470 -5.118 1.00 . A A . 21 ALA HA 1 1 14 8582 1 1 21 ALA HB1 H -1.616 -3.342 -7.772 1.00 . A A . 21 ALA HB1 1 1 14 8583 1 1 21 ALA HB2 H -3.168 -3.237 -6.941 1.00 . A A . 21 ALA HB2 1 1 14 8584 1 1 21 ALA HB3 H -2.558 -1.853 -7.849 1.00 . A A . 21 ALA HB3 1 1 14 8585 1 1 21 ALA N N -1.497 -0.726 -5.999 1.00 . A A . 21 ALA N 1 1 14 8586 1 1 21 ALA O O 0.782 -2.292 -6.407 1.00 . A A . 21 ALA O 1 1 14 8587 1 1 22 PHE C C 0.966 -6.122 -4.994 1.00 . A A . 22 PHE C 1 1 14 8588 1 1 22 PHE CA C 1.159 -4.609 -4.935 1.00 . A A . 22 PHE CA 1 1 14 8589 1 1 22 PHE CB C 1.780 -4.215 -3.594 1.00 . A A . 22 PHE CB 1 1 14 8590 1 1 22 PHE CD1 C 3.408 -2.330 -3.904 1.00 . A A . 22 PHE CD1 1 1 14 8591 1 1 22 PHE CD2 C 1.245 -1.827 -3.036 1.00 . A A . 22 PHE CD2 1 1 14 8592 1 1 22 PHE CE1 C 3.753 -0.994 -3.828 1.00 . A A . 22 PHE CE1 1 1 14 8593 1 1 22 PHE CE2 C 1.584 -0.490 -2.958 1.00 . A A . 22 PHE CE2 1 1 14 8594 1 1 22 PHE CG C 2.151 -2.762 -3.510 1.00 . A A . 22 PHE CG 1 1 14 8595 1 1 22 PHE CZ C 2.840 -0.073 -3.354 1.00 . A A . 22 PHE CZ 1 1 14 8596 1 1 22 PHE H H -0.920 -4.277 -4.715 1.00 . A A . 22 PHE H 1 1 14 8597 1 1 22 PHE HA H 1.824 -4.312 -5.731 1.00 . A A . 22 PHE HA 1 1 14 8598 1 1 22 PHE HB2 H 1.074 -4.422 -2.804 1.00 . A A . 22 PHE HB2 1 1 14 8599 1 1 22 PHE HB3 H 2.674 -4.797 -3.434 1.00 . A A . 22 PHE HB3 1 1 14 8600 1 1 22 PHE HD1 H 4.123 -3.051 -4.275 1.00 . A A . 22 PHE HD1 1 1 14 8601 1 1 22 PHE HD2 H 0.262 -2.152 -2.725 1.00 . A A . 22 PHE HD2 1 1 14 8602 1 1 22 PHE HE1 H 4.736 -0.672 -4.138 1.00 . A A . 22 PHE HE1 1 1 14 8603 1 1 22 PHE HE2 H 0.869 0.229 -2.587 1.00 . A A . 22 PHE HE2 1 1 14 8604 1 1 22 PHE HZ H 3.107 0.972 -3.295 1.00 . A A . 22 PHE HZ 1 1 14 8605 1 1 22 PHE N N -0.109 -3.916 -5.130 1.00 . A A . 22 PHE N 1 1 14 8606 1 1 22 PHE O O 0.017 -6.662 -4.423 1.00 . A A . 22 PHE O 1 1 14 8607 1 1 23 THR C C 2.049 -8.941 -4.487 1.00 . A A . 23 THR C 1 1 14 8608 1 1 23 THR CA C 1.803 -8.251 -5.824 1.00 . A A . 23 THR CA 1 1 14 8609 1 1 23 THR CB C 2.826 -8.769 -6.852 1.00 . A A . 23 THR CB 1 1 14 8610 1 1 23 THR CG2 C 4.244 -8.413 -6.432 1.00 . A A . 23 THR CG2 1 1 14 8611 1 1 23 THR H H 2.605 -6.315 -6.121 1.00 . A A . 23 THR H 1 1 14 8612 1 1 23 THR HA H 0.813 -8.506 -6.173 1.00 . A A . 23 THR HA 1 1 14 8613 1 1 23 THR HB H 2.622 -8.305 -7.807 1.00 . A A . 23 THR HB 1 1 14 8614 1 1 23 THR HG1 H 2.950 -10.447 -7.882 1.00 . A A . 23 THR HG1 1 1 14 8615 1 1 23 THR HG21 H 4.930 -8.673 -7.224 1.00 . A A . 23 THR HG21 1 1 14 8616 1 1 23 THR HG22 H 4.503 -8.960 -5.538 1.00 . A A . 23 THR HG22 1 1 14 8617 1 1 23 THR HG23 H 4.305 -7.353 -6.236 1.00 . A A . 23 THR HG23 1 1 14 8618 1 1 23 THR N N 1.873 -6.802 -5.689 1.00 . A A . 23 THR N 1 1 14 8619 1 1 23 THR O O 1.406 -9.941 -4.166 1.00 . A A . 23 THR O 1 1 14 8620 1 1 23 THR OG1 O 2.707 -10.190 -6.989 1.00 . A A . 23 THR OG1 1 1 14 8621 1 1 24 ASP C C 2.893 -8.018 -1.285 1.00 . A A . 24 ASP C 1 1 14 8622 1 1 24 ASP CA C 3.311 -8.963 -2.407 1.00 . A A . 24 ASP CA 1 1 14 8623 1 1 24 ASP CB C 4.811 -9.251 -2.316 1.00 . A A . 24 ASP CB 1 1 14 8624 1 1 24 ASP CG C 5.183 -10.586 -2.930 1.00 . A A . 24 ASP CG 1 1 14 8625 1 1 24 ASP H H 3.460 -7.603 -4.023 1.00 . A A . 24 ASP H 1 1 14 8626 1 1 24 ASP HA H 2.769 -9.891 -2.300 1.00 . A A . 24 ASP HA 1 1 14 8627 1 1 24 ASP HB2 H 5.352 -8.473 -2.835 1.00 . A A . 24 ASP HB2 1 1 14 8628 1 1 24 ASP HB3 H 5.107 -9.257 -1.277 1.00 . A A . 24 ASP HB3 1 1 14 8629 1 1 24 ASP N N 2.982 -8.400 -3.711 1.00 . A A . 24 ASP N 1 1 14 8630 1 1 24 ASP O O 2.532 -6.867 -1.533 1.00 . A A . 24 ASP O 1 1 14 8631 1 1 24 ASP OD1 O 4.684 -11.622 -2.445 1.00 . A A . 24 ASP OD1 1 1 14 8632 1 1 24 ASP OD2 O 5.973 -10.593 -3.897 1.00 . A A . 24 ASP OD2 1 1 14 8633 1 1 25 ARG C C 3.761 -6.919 1.631 1.00 . A A . 25 ARG C 1 1 14 8634 1 1 25 ARG CA C 2.567 -7.711 1.107 1.00 . A A . 25 ARG CA 1 1 14 8635 1 1 25 ARG CB C 2.011 -8.609 2.214 1.00 . A A . 25 ARG CB 1 1 14 8636 1 1 25 ARG CD C 0.807 -8.702 4.418 1.00 . A A . 25 ARG CD 1 1 14 8637 1 1 25 ARG CG C 1.052 -7.895 3.153 1.00 . A A . 25 ARG CG 1 1 14 8638 1 1 25 ARG CZ C -0.035 -10.898 3.699 1.00 . A A . 25 ARG CZ 1 1 14 8639 1 1 25 ARG H H 3.239 -9.436 0.081 1.00 . A A . 25 ARG H 1 1 14 8640 1 1 25 ARG HA H 1.798 -7.019 0.797 1.00 . A A . 25 ARG HA 1 1 14 8641 1 1 25 ARG HB2 H 1.486 -9.437 1.761 1.00 . A A . 25 ARG HB2 1 1 14 8642 1 1 25 ARG HB3 H 2.835 -8.991 2.798 1.00 . A A . 25 ARG HB3 1 1 14 8643 1 1 25 ARG HD2 H 1.723 -9.204 4.692 1.00 . A A . 25 ARG HD2 1 1 14 8644 1 1 25 ARG HD3 H 0.516 -8.027 5.209 1.00 . A A . 25 ARG HD3 1 1 14 8645 1 1 25 ARG HE H -1.149 -9.465 4.526 1.00 . A A . 25 ARG HE 1 1 14 8646 1 1 25 ARG HG2 H 1.475 -6.939 3.426 1.00 . A A . 25 ARG HG2 1 1 14 8647 1 1 25 ARG HG3 H 0.112 -7.743 2.644 1.00 . A A . 25 ARG HG3 1 1 14 8648 1 1 25 ARG HH11 H 1.941 -10.604 3.396 1.00 . A A . 25 ARG HH11 1 1 14 8649 1 1 25 ARG HH12 H 1.335 -12.147 2.894 1.00 . A A . 25 ARG HH12 1 1 14 8650 1 1 25 ARG HH21 H -1.959 -11.494 3.869 1.00 . A A . 25 ARG HH21 1 1 14 8651 1 1 25 ARG HH22 H -0.883 -12.652 3.163 1.00 . A A . 25 ARG HH22 1 1 14 8652 1 1 25 ARG N N 2.943 -8.511 -0.053 1.00 . A A . 25 ARG N 1 1 14 8653 1 1 25 ARG NE N -0.244 -9.700 4.235 1.00 . A A . 25 ARG NE 1 1 14 8654 1 1 25 ARG NH1 N 1.180 -11.244 3.296 1.00 . A A . 25 ARG NH1 1 1 14 8655 1 1 25 ARG NH2 N -1.042 -11.751 3.566 1.00 . A A . 25 ARG NH2 1 1 14 8656 1 1 25 ARG O O 3.646 -5.730 1.930 1.00 . A A . 25 ARG O 1 1 14 8657 1 1 26 SER C C 6.370 -5.626 1.505 1.00 . A A . 26 SER C 1 1 14 8658 1 1 26 SER CA C 6.120 -6.945 2.231 1.00 . A A . 26 SER CA 1 1 14 8659 1 1 26 SER CB C 7.321 -7.875 2.052 1.00 . A A . 26 SER CB 1 1 14 8660 1 1 26 SER H H 4.933 -8.531 1.484 1.00 . A A . 26 SER H 1 1 14 8661 1 1 26 SER HA H 5.985 -6.743 3.283 1.00 . A A . 26 SER HA 1 1 14 8662 1 1 26 SER HB2 H 7.255 -8.364 1.092 1.00 . A A . 26 SER HB2 1 1 14 8663 1 1 26 SER HB3 H 8.232 -7.295 2.099 1.00 . A A . 26 SER HB3 1 1 14 8664 1 1 26 SER HG H 8.150 -9.394 2.969 1.00 . A A . 26 SER HG 1 1 14 8665 1 1 26 SER N N 4.905 -7.585 1.739 1.00 . A A . 26 SER N 1 1 14 8666 1 1 26 SER O O 6.658 -4.606 2.130 1.00 . A A . 26 SER O 1 1 14 8667 1 1 26 SER OG O 7.356 -8.864 3.066 1.00 . A A . 26 SER OG 1 1 14 8668 1 1 27 ASN C C 5.461 -3.378 -0.283 1.00 . A A . 27 ASN C 1 1 14 8669 1 1 27 ASN CA C 6.474 -4.465 -0.632 1.00 . A A . 27 ASN CA 1 1 14 8670 1 1 27 ASN CB C 6.376 -4.811 -2.119 1.00 . A A . 27 ASN CB 1 1 14 8671 1 1 27 ASN CG C 7.444 -5.795 -2.555 1.00 . A A . 27 ASN CG 1 1 14 8672 1 1 27 ASN H H 6.027 -6.500 -0.261 1.00 . A A . 27 ASN H 1 1 14 8673 1 1 27 ASN HA H 7.467 -4.095 -0.422 1.00 . A A . 27 ASN HA 1 1 14 8674 1 1 27 ASN HB2 H 5.408 -5.249 -2.317 1.00 . A A . 27 ASN HB2 1 1 14 8675 1 1 27 ASN HB3 H 6.484 -3.908 -2.701 1.00 . A A . 27 ASN HB3 1 1 14 8676 1 1 27 ASN HD21 H 7.873 -4.667 -4.135 1.00 . A A . 27 ASN HD21 1 1 14 8677 1 1 27 ASN HD22 H 8.802 -6.114 -3.971 1.00 . A A . 27 ASN HD22 1 1 14 8678 1 1 27 ASN N N 6.259 -5.656 0.181 1.00 . A A . 27 ASN N 1 1 14 8679 1 1 27 ASN ND2 N 8.107 -5.495 -3.666 1.00 . A A . 27 ASN ND2 1 1 14 8680 1 1 27 ASN O O 5.811 -2.204 -0.157 1.00 . A A . 27 ASN O 1 1 14 8681 1 1 27 ASN OD1 O 7.670 -6.813 -1.900 1.00 . A A . 27 ASN OD1 1 1 14 8682 1 1 28 LEU C C 3.479 -2.058 1.472 1.00 . A A . 28 LEU C 1 1 14 8683 1 1 28 LEU CA C 3.138 -2.840 0.208 1.00 . A A . 28 LEU CA 1 1 14 8684 1 1 28 LEU CB C 1.816 -3.585 0.396 1.00 . A A . 28 LEU CB 1 1 14 8685 1 1 28 LEU CD1 C 0.135 -1.725 0.382 1.00 . A A . 28 LEU CD1 1 1 14 8686 1 1 28 LEU CD2 C -0.337 -3.824 1.658 1.00 . A A . 28 LEU CD2 1 1 14 8687 1 1 28 LEU CG C 0.742 -2.853 1.202 1.00 . A A . 28 LEU CG 1 1 14 8688 1 1 28 LEU H H 3.986 -4.726 -0.240 1.00 . A A . 28 LEU H 1 1 14 8689 1 1 28 LEU HA H 3.038 -2.146 -0.614 1.00 . A A . 28 LEU HA 1 1 14 8690 1 1 28 LEU HB2 H 1.411 -3.792 -0.582 1.00 . A A . 28 LEU HB2 1 1 14 8691 1 1 28 LEU HB3 H 2.031 -4.517 0.900 1.00 . A A . 28 LEU HB3 1 1 14 8692 1 1 28 LEU HD11 H -0.376 -2.137 -0.474 1.00 . A A . 28 LEU HD11 1 1 14 8693 1 1 28 LEU HD12 H 0.919 -1.061 0.049 1.00 . A A . 28 LEU HD12 1 1 14 8694 1 1 28 LEU HD13 H -0.567 -1.175 0.991 1.00 . A A . 28 LEU HD13 1 1 14 8695 1 1 28 LEU HD21 H 0.125 -4.703 2.081 1.00 . A A . 28 LEU HD21 1 1 14 8696 1 1 28 LEU HD22 H -0.945 -4.108 0.811 1.00 . A A . 28 LEU HD22 1 1 14 8697 1 1 28 LEU HD23 H -0.958 -3.348 2.403 1.00 . A A . 28 LEU HD23 1 1 14 8698 1 1 28 LEU HG H 1.195 -2.418 2.083 1.00 . A A . 28 LEU HG 1 1 14 8699 1 1 28 LEU N N 4.204 -3.778 -0.127 1.00 . A A . 28 LEU N 1 1 14 8700 1 1 28 LEU O O 3.539 -0.828 1.457 1.00 . A A . 28 LEU O 1 1 14 8701 1 1 29 PHE C C 5.131 -1.102 3.657 1.00 . A A . 29 PHE C 1 1 14 8702 1 1 29 PHE CA C 4.040 -2.154 3.839 1.00 . A A . 29 PHE CA 1 1 14 8703 1 1 29 PHE CB C 4.500 -3.211 4.845 1.00 . A A . 29 PHE CB 1 1 14 8704 1 1 29 PHE CD1 C 2.510 -4.725 5.056 1.00 . A A . 29 PHE CD1 1 1 14 8705 1 1 29 PHE CD2 C 3.181 -3.465 6.965 1.00 . A A . 29 PHE CD2 1 1 14 8706 1 1 29 PHE CE1 C 1.474 -5.280 5.783 1.00 . A A . 29 PHE CE1 1 1 14 8707 1 1 29 PHE CE2 C 2.147 -4.016 7.698 1.00 . A A . 29 PHE CE2 1 1 14 8708 1 1 29 PHE CG C 3.374 -3.812 5.638 1.00 . A A . 29 PHE CG 1 1 14 8709 1 1 29 PHE CZ C 1.293 -4.926 7.106 1.00 . A A . 29 PHE CZ 1 1 14 8710 1 1 29 PHE H H 3.641 -3.756 2.514 1.00 . A A . 29 PHE H 1 1 14 8711 1 1 29 PHE HA H 3.151 -1.672 4.216 1.00 . A A . 29 PHE HA 1 1 14 8712 1 1 29 PHE HB2 H 4.996 -4.010 4.316 1.00 . A A . 29 PHE HB2 1 1 14 8713 1 1 29 PHE HB3 H 5.192 -2.759 5.539 1.00 . A A . 29 PHE HB3 1 1 14 8714 1 1 29 PHE HD1 H 2.651 -5.004 4.022 1.00 . A A . 29 PHE HD1 1 1 14 8715 1 1 29 PHE HD2 H 3.850 -2.753 7.430 1.00 . A A . 29 PHE HD2 1 1 14 8716 1 1 29 PHE HE1 H 0.807 -5.991 5.318 1.00 . A A . 29 PHE HE1 1 1 14 8717 1 1 29 PHE HE2 H 2.008 -3.737 8.732 1.00 . A A . 29 PHE HE2 1 1 14 8718 1 1 29 PHE HZ H 0.483 -5.357 7.676 1.00 . A A . 29 PHE HZ 1 1 14 8719 1 1 29 PHE N N 3.704 -2.779 2.566 1.00 . A A . 29 PHE N 1 1 14 8720 1 1 29 PHE O O 5.091 -0.036 4.273 1.00 . A A . 29 PHE O 1 1 14 8721 1 1 30 THR C C 6.712 0.784 1.870 1.00 . A A . 30 THR C 1 1 14 8722 1 1 30 THR CA C 7.207 -0.492 2.542 1.00 . A A . 30 THR CA 1 1 14 8723 1 1 30 THR CB C 8.280 -1.145 1.652 1.00 . A A . 30 THR CB 1 1 14 8724 1 1 30 THR CG2 C 9.411 -0.169 1.363 1.00 . A A . 30 THR CG2 1 1 14 8725 1 1 30 THR H H 6.080 -2.273 2.345 1.00 . A A . 30 THR H 1 1 14 8726 1 1 30 THR HA H 7.661 -0.236 3.489 1.00 . A A . 30 THR HA 1 1 14 8727 1 1 30 THR HB H 7.824 -1.432 0.715 1.00 . A A . 30 THR HB 1 1 14 8728 1 1 30 THR HG1 H 8.698 -2.231 3.244 1.00 . A A . 30 THR HG1 1 1 14 8729 1 1 30 THR HG21 H 9.004 0.821 1.224 1.00 . A A . 30 THR HG21 1 1 14 8730 1 1 30 THR HG22 H 9.929 -0.474 0.466 1.00 . A A . 30 THR HG22 1 1 14 8731 1 1 30 THR HG23 H 10.101 -0.162 2.193 1.00 . A A . 30 THR HG23 1 1 14 8732 1 1 30 THR N N 6.105 -1.408 2.805 1.00 . A A . 30 THR N 1 1 14 8733 1 1 30 THR O O 7.205 1.877 2.151 1.00 . A A . 30 THR O 1 1 14 8734 1 1 30 THR OG1 O 8.804 -2.313 2.293 1.00 . A A . 30 THR OG1 1 1 14 8735 1 1 31 HIS C C 4.346 2.653 1.208 1.00 . A A . 31 HIS C 1 1 14 8736 1 1 31 HIS CA C 5.173 1.780 0.269 1.00 . A A . 31 HIS CA 1 1 14 8737 1 1 31 HIS CB C 4.306 1.304 -0.898 1.00 . A A . 31 HIS CB 1 1 14 8738 1 1 31 HIS CD2 C 2.021 2.519 -0.726 1.00 . A A . 31 HIS CD2 1 1 14 8739 1 1 31 HIS CE1 C 2.242 3.863 -2.443 1.00 . A A . 31 HIS CE1 1 1 14 8740 1 1 31 HIS CG C 3.231 2.275 -1.280 1.00 . A A . 31 HIS CG 1 1 14 8741 1 1 31 HIS H H 5.384 -0.258 0.800 1.00 . A A . 31 HIS H 1 1 14 8742 1 1 31 HIS HA H 5.992 2.366 -0.118 1.00 . A A . 31 HIS HA 1 1 14 8743 1 1 31 HIS HB2 H 4.934 1.148 -1.763 1.00 . A A . 31 HIS HB2 1 1 14 8744 1 1 31 HIS HB3 H 3.832 0.371 -0.629 1.00 . A A . 31 HIS HB3 1 1 14 8745 1 1 31 HIS HD1 H 4.106 3.197 -2.961 1.00 . A A . 31 HIS HD1 1 1 14 8746 1 1 31 HIS HD2 H 1.600 2.026 0.140 1.00 . A A . 31 HIS HD2 1 1 14 8747 1 1 31 HIS HE1 H 2.045 4.620 -3.188 1.00 . A A . 31 HIS HE1 1 1 14 8748 1 1 31 HIS N N 5.735 0.638 0.981 1.00 . A A . 31 HIS N 1 1 14 8749 1 1 31 HIS ND1 N 3.339 3.132 -2.355 1.00 . A A . 31 HIS ND1 1 1 14 8750 1 1 31 HIS NE2 N 1.426 3.510 -1.467 1.00 . A A . 31 HIS NE2 1 1 14 8751 1 1 31 HIS O O 4.332 3.877 1.081 1.00 . A A . 31 HIS O 1 1 14 8752 1 1 32 GLN C C 3.641 3.795 3.843 1.00 . A A . 32 GLN C 1 1 14 8753 1 1 32 GLN CA C 2.829 2.734 3.109 1.00 . A A . 32 GLN CA 1 1 14 8754 1 1 32 GLN CB C 2.214 1.759 4.115 1.00 . A A . 32 GLN CB 1 1 14 8755 1 1 32 GLN CD C 0.231 0.263 4.577 1.00 . A A . 32 GLN CD 1 1 14 8756 1 1 32 GLN CG C 1.131 0.873 3.521 1.00 . A A . 32 GLN CG 1 1 14 8757 1 1 32 GLN H H 3.711 1.038 2.200 1.00 . A A . 32 GLN H 1 1 14 8758 1 1 32 GLN HA H 2.036 3.220 2.562 1.00 . A A . 32 GLN HA 1 1 14 8759 1 1 32 GLN HB2 H 2.995 1.123 4.506 1.00 . A A . 32 GLN HB2 1 1 14 8760 1 1 32 GLN HB3 H 1.781 2.324 4.927 1.00 . A A . 32 GLN HB3 1 1 14 8761 1 1 32 GLN HE21 H -0.088 -1.324 3.422 1.00 . A A . 32 GLN HE21 1 1 14 8762 1 1 32 GLN HE22 H -0.888 -1.336 4.954 1.00 . A A . 32 GLN HE22 1 1 14 8763 1 1 32 GLN HG2 H 0.525 1.467 2.853 1.00 . A A . 32 GLN HG2 1 1 14 8764 1 1 32 GLN HG3 H 1.602 0.076 2.964 1.00 . A A . 32 GLN HG3 1 1 14 8765 1 1 32 GLN N N 3.659 2.015 2.150 1.00 . A A . 32 GLN N 1 1 14 8766 1 1 32 GLN NE2 N -0.303 -0.918 4.289 1.00 . A A . 32 GLN NE2 1 1 14 8767 1 1 32 GLN O O 3.084 4.675 4.500 1.00 . A A . 32 GLN O 1 1 14 8768 1 1 32 GLN OE1 O 0.019 0.846 5.640 1.00 . A A . 32 GLN OE1 1 1 14 8769 1 1 33 LYS C C 5.543 6.086 3.935 1.00 . A A . 33 LYS C 1 1 14 8770 1 1 33 LYS CA C 5.853 4.660 4.380 1.00 . A A . 33 LYS CA 1 1 14 8771 1 1 33 LYS CB C 7.312 4.322 4.067 1.00 . A A . 33 LYS CB 1 1 14 8772 1 1 33 LYS CD C 9.313 2.895 4.588 1.00 . A A . 33 LYS CD 1 1 14 8773 1 1 33 LYS CE C 9.767 1.522 5.059 1.00 . A A . 33 LYS CE 1 1 14 8774 1 1 33 LYS CG C 7.819 3.087 4.792 1.00 . A A . 33 LYS CG 1 1 14 8775 1 1 33 LYS H H 5.348 2.983 3.191 1.00 . A A . 33 LYS H 1 1 14 8776 1 1 33 LYS HA H 5.695 4.586 5.446 1.00 . A A . 33 LYS HA 1 1 14 8777 1 1 33 LYS HB2 H 7.411 4.156 3.005 1.00 . A A . 33 LYS HB2 1 1 14 8778 1 1 33 LYS HB3 H 7.932 5.160 4.351 1.00 . A A . 33 LYS HB3 1 1 14 8779 1 1 33 LYS HD2 H 9.540 2.996 3.537 1.00 . A A . 33 LYS HD2 1 1 14 8780 1 1 33 LYS HD3 H 9.844 3.652 5.148 1.00 . A A . 33 LYS HD3 1 1 14 8781 1 1 33 LYS HE2 H 8.962 0.819 4.908 1.00 . A A . 33 LYS HE2 1 1 14 8782 1 1 33 LYS HE3 H 10.622 1.220 4.472 1.00 . A A . 33 LYS HE3 1 1 14 8783 1 1 33 LYS HG2 H 7.622 3.194 5.848 1.00 . A A . 33 LYS HG2 1 1 14 8784 1 1 33 LYS HG3 H 7.299 2.219 4.413 1.00 . A A . 33 LYS HG3 1 1 14 8785 1 1 33 LYS HZ1 H 9.995 2.472 6.905 1.00 . A A . 33 LYS HZ1 1 1 14 8786 1 1 33 LYS HZ2 H 11.146 1.268 6.607 1.00 . A A . 33 LYS HZ2 1 1 14 8787 1 1 33 LYS HZ3 H 9.564 0.840 7.023 1.00 . A A . 33 LYS HZ3 1 1 14 8788 1 1 33 LYS N N 4.962 3.707 3.729 1.00 . A A . 33 LYS N 1 1 14 8789 1 1 33 LYS NZ N 10.144 1.526 6.499 1.00 . A A . 33 LYS NZ 1 1 14 8790 1 1 33 LYS O O 5.841 7.046 4.646 1.00 . A A . 33 LYS O 1 1 14 8791 1 1 34 ILE C C 3.360 8.091 2.914 1.00 . A A . 34 ILE C 1 1 14 8792 1 1 34 ILE CA C 4.593 7.524 2.219 1.00 . A A . 34 ILE CA 1 1 14 8793 1 1 34 ILE CB C 4.329 7.458 0.703 1.00 . A A . 34 ILE CB 1 1 14 8794 1 1 34 ILE CD1 C 2.613 6.737 -1.033 1.00 . A A . 34 ILE CD1 1 1 14 8795 1 1 34 ILE CG1 C 3.022 6.713 0.423 1.00 . A A . 34 ILE CG1 1 1 14 8796 1 1 34 ILE CG2 C 5.492 6.783 -0.008 1.00 . A A . 34 ILE CG2 1 1 14 8797 1 1 34 ILE H H 4.733 5.413 2.236 1.00 . A A . 34 ILE H 1 1 14 8798 1 1 34 ILE HA H 5.427 8.189 2.390 1.00 . A A . 34 ILE HA 1 1 14 8799 1 1 34 ILE HB H 4.247 8.467 0.330 1.00 . A A . 34 ILE HB 1 1 14 8800 1 1 34 ILE HD11 H 3.274 6.099 -1.603 1.00 . A A . 34 ILE HD11 1 1 14 8801 1 1 34 ILE HD12 H 1.599 6.378 -1.129 1.00 . A A . 34 ILE HD12 1 1 14 8802 1 1 34 ILE HD13 H 2.676 7.747 -1.409 1.00 . A A . 34 ILE HD13 1 1 14 8803 1 1 34 ILE HG12 H 3.132 5.682 0.719 1.00 . A A . 34 ILE HG12 1 1 14 8804 1 1 34 ILE HG13 H 2.228 7.166 0.999 1.00 . A A . 34 ILE HG13 1 1 14 8805 1 1 34 ILE HG21 H 6.237 7.523 -0.262 1.00 . A A . 34 ILE HG21 1 1 14 8806 1 1 34 ILE HG22 H 5.930 6.041 0.643 1.00 . A A . 34 ILE HG22 1 1 14 8807 1 1 34 ILE HG23 H 5.136 6.306 -0.909 1.00 . A A . 34 ILE HG23 1 1 14 8808 1 1 34 ILE N N 4.944 6.216 2.756 1.00 . A A . 34 ILE N 1 1 14 8809 1 1 34 ILE O O 3.019 9.261 2.740 1.00 . A A . 34 ILE O 1 1 14 8810 1 1 35 HIS C C 1.714 7.567 5.935 1.00 . A A . 35 HIS C 1 1 14 8811 1 1 35 HIS CA C 1.500 7.671 4.428 1.00 . A A . 35 HIS CA 1 1 14 8812 1 1 35 HIS CB C 0.301 6.819 4.010 1.00 . A A . 35 HIS CB 1 1 14 8813 1 1 35 HIS CD2 C 0.173 5.698 1.675 1.00 . A A . 35 HIS CD2 1 1 14 8814 1 1 35 HIS CE1 C -0.314 7.478 0.491 1.00 . A A . 35 HIS CE1 1 1 14 8815 1 1 35 HIS CG C 0.104 6.747 2.527 1.00 . A A . 35 HIS CG 1 1 14 8816 1 1 35 HIS H H 3.016 6.333 3.801 1.00 . A A . 35 HIS H 1 1 14 8817 1 1 35 HIS HA H 1.303 8.702 4.175 1.00 . A A . 35 HIS HA 1 1 14 8818 1 1 35 HIS HB2 H 0.439 5.812 4.376 1.00 . A A . 35 HIS HB2 1 1 14 8819 1 1 35 HIS HB3 H -0.597 7.235 4.445 1.00 . A A . 35 HIS HB3 1 1 14 8820 1 1 35 HIS HD1 H -0.320 8.763 2.083 1.00 . A A . 35 HIS HD1 1 1 14 8821 1 1 35 HIS HD2 H 0.394 4.672 1.936 1.00 . A A . 35 HIS HD2 1 1 14 8822 1 1 35 HIS HE1 H -0.548 8.127 -0.339 1.00 . A A . 35 HIS HE1 1 1 14 8823 1 1 35 HIS N N 2.695 7.253 3.703 1.00 . A A . 35 HIS N 1 1 14 8824 1 1 35 HIS ND1 N -0.202 7.847 1.754 1.00 . A A . 35 HIS ND1 1 1 14 8825 1 1 35 HIS NE2 N -0.091 6.178 0.416 1.00 . A A . 35 HIS NE2 1 1 14 8826 1 1 35 HIS O O 1.732 8.575 6.642 1.00 . A A . 35 HIS O 1 1 14 8827 1 1 36 THR C C 1.084 6.887 8.685 1.00 . A A . 36 THR C 1 1 14 8828 1 1 36 THR CA C 2.084 6.103 7.844 1.00 . A A . 36 THR CA 1 1 14 8829 1 1 36 THR CB C 3.512 6.490 8.272 1.00 . A A . 36 THR CB 1 1 14 8830 1 1 36 THR CG2 C 4.542 5.892 7.326 1.00 . A A . 36 THR CG2 1 1 14 8831 1 1 36 THR H H 1.849 5.577 5.807 1.00 . A A . 36 THR H 1 1 14 8832 1 1 36 THR HA H 1.949 5.048 8.030 1.00 . A A . 36 THR HA 1 1 14 8833 1 1 36 THR HB H 3.691 6.104 9.266 1.00 . A A . 36 THR HB 1 1 14 8834 1 1 36 THR HG1 H 4.573 8.151 8.191 1.00 . A A . 36 THR HG1 1 1 14 8835 1 1 36 THR HG21 H 5.323 6.615 7.142 1.00 . A A . 36 THR HG21 1 1 14 8836 1 1 36 THR HG22 H 4.066 5.633 6.392 1.00 . A A . 36 THR HG22 1 1 14 8837 1 1 36 THR HG23 H 4.969 5.006 7.771 1.00 . A A . 36 THR HG23 1 1 14 8838 1 1 36 THR N N 1.874 6.340 6.421 1.00 . A A . 36 THR N 1 1 14 8839 1 1 36 THR O O 1.416 7.382 9.761 1.00 . A A . 36 THR O 1 1 14 8840 1 1 36 THR OG1 O 3.648 7.916 8.295 1.00 . A A . 36 THR OG1 1 1 14 8841 1 1 37 GLY C C -1.230 9.185 8.524 1.00 . A A . 37 GLY C 1 1 14 8842 1 1 37 GLY CA C -1.176 7.719 8.908 1.00 . A A . 37 GLY CA 1 1 14 8843 1 1 37 GLY H H -0.352 6.580 7.324 1.00 . A A . 37 GLY H 1 1 14 8844 1 1 37 GLY HA2 H -2.133 7.267 8.696 1.00 . A A . 37 GLY HA2 1 1 14 8845 1 1 37 GLY HA3 H -0.980 7.644 9.967 1.00 . A A . 37 GLY HA3 1 1 14 8846 1 1 37 GLY N N -0.145 6.995 8.188 1.00 . A A . 37 GLY N 1 1 14 8847 1 1 37 GLY O O -0.721 9.577 7.475 1.00 . A A . 37 GLY O 1 1 14 8848 1 1 38 GLU C C -0.718 12.168 9.576 1.00 . A A . 38 GLU C 1 1 14 8849 1 1 38 GLU CA C -1.970 11.426 9.119 1.00 . A A . 38 GLU CA 1 1 14 8850 1 1 38 GLU CB C -3.200 11.993 9.830 1.00 . A A . 38 GLU CB 1 1 14 8851 1 1 38 GLU CD C -4.679 12.071 7.784 1.00 . A A . 38 GLU CD 1 1 14 8852 1 1 38 GLU CG C -4.517 11.565 9.203 1.00 . A A . 38 GLU CG 1 1 14 8853 1 1 38 GLU H H -2.235 9.623 10.197 1.00 . A A . 38 GLU H 1 1 14 8854 1 1 38 GLU HA H -2.086 11.563 8.055 1.00 . A A . 38 GLU HA 1 1 14 8855 1 1 38 GLU HB2 H -3.191 11.663 10.859 1.00 . A A . 38 GLU HB2 1 1 14 8856 1 1 38 GLU HB3 H -3.149 13.071 9.807 1.00 . A A . 38 GLU HB3 1 1 14 8857 1 1 38 GLU HG2 H -4.561 10.486 9.191 1.00 . A A . 38 GLU HG2 1 1 14 8858 1 1 38 GLU HG3 H -5.328 11.950 9.803 1.00 . A A . 38 GLU HG3 1 1 14 8859 1 1 38 GLU N N -1.849 9.996 9.376 1.00 . A A . 38 GLU N 1 1 14 8860 1 1 38 GLU O O -0.357 12.136 10.753 1.00 . A A . 38 GLU O 1 1 14 8861 1 1 38 GLU OE1 O -4.035 13.083 7.437 1.00 . A A . 38 GLU OE1 1 1 14 8862 1 1 38 GLU OE2 O -5.450 11.455 7.019 1.00 . A A . 38 GLU OE2 1 1 14 8863 1 1 39 LYS C C 0.858 14.731 9.907 1.00 . A A . 39 LYS C 1 1 14 8864 1 1 39 LYS CA C 1.155 13.588 8.941 1.00 . A A . 39 LYS CA 1 1 14 8865 1 1 39 LYS CB C 1.773 14.141 7.654 1.00 . A A . 39 LYS CB 1 1 14 8866 1 1 39 LYS CD C 2.603 13.630 5.339 1.00 . A A . 39 LYS CD 1 1 14 8867 1 1 39 LYS CE C 3.935 14.364 5.336 1.00 . A A . 39 LYS CE 1 1 14 8868 1 1 39 LYS CG C 2.283 13.064 6.713 1.00 . A A . 39 LYS CG 1 1 14 8869 1 1 39 LYS H H -0.394 12.824 7.716 1.00 . A A . 39 LYS H 1 1 14 8870 1 1 39 LYS HA H 1.857 12.913 9.406 1.00 . A A . 39 LYS HA 1 1 14 8871 1 1 39 LYS HB2 H 1.028 14.723 7.132 1.00 . A A . 39 LYS HB2 1 1 14 8872 1 1 39 LYS HB3 H 2.601 14.784 7.915 1.00 . A A . 39 LYS HB3 1 1 14 8873 1 1 39 LYS HD2 H 2.650 12.819 4.627 1.00 . A A . 39 LYS HD2 1 1 14 8874 1 1 39 LYS HD3 H 1.821 14.319 5.052 1.00 . A A . 39 LYS HD3 1 1 14 8875 1 1 39 LYS HE2 H 3.853 15.234 5.969 1.00 . A A . 39 LYS HE2 1 1 14 8876 1 1 39 LYS HE3 H 4.695 13.704 5.727 1.00 . A A . 39 LYS HE3 1 1 14 8877 1 1 39 LYS HG2 H 3.179 12.630 7.129 1.00 . A A . 39 LYS HG2 1 1 14 8878 1 1 39 LYS HG3 H 1.525 12.300 6.610 1.00 . A A . 39 LYS HG3 1 1 14 8879 1 1 39 LYS HZ1 H 5.025 15.564 4.018 1.00 . A A . 39 LYS HZ1 1 1 14 8880 1 1 39 LYS HZ2 H 3.491 15.137 3.446 1.00 . A A . 39 LYS HZ2 1 1 14 8881 1 1 39 LYS HZ3 H 4.742 13.998 3.444 1.00 . A A . 39 LYS HZ3 1 1 14 8882 1 1 39 LYS N N -0.057 12.837 8.637 1.00 . A A . 39 LYS N 1 1 14 8883 1 1 39 LYS NZ N 4.326 14.796 3.965 1.00 . A A . 39 LYS NZ 1 1 14 8884 1 1 39 LYS O O -0.196 15.364 9.852 1.00 . A A . 39 LYS O 1 1 14 8885 1 1 40 PRO C C 1.737 17.460 11.177 1.00 . A A . 40 PRO C 1 1 14 8886 1 1 40 PRO CA C 1.674 16.073 11.806 1.00 . A A . 40 PRO CA 1 1 14 8887 1 1 40 PRO CB C 2.872 15.851 12.732 1.00 . A A . 40 PRO CB 1 1 14 8888 1 1 40 PRO CD C 3.092 14.290 10.934 1.00 . A A . 40 PRO CD 1 1 14 8889 1 1 40 PRO CG C 3.878 15.147 11.887 1.00 . A A . 40 PRO CG 1 1 14 8890 1 1 40 PRO HA H 0.758 15.976 12.370 1.00 . A A . 40 PRO HA 1 1 14 8891 1 1 40 PRO HB2 H 3.244 16.805 13.078 1.00 . A A . 40 PRO HB2 1 1 14 8892 1 1 40 PRO HB3 H 2.573 15.247 13.575 1.00 . A A . 40 PRO HB3 1 1 14 8893 1 1 40 PRO HD2 H 3.593 14.230 9.979 1.00 . A A . 40 PRO HD2 1 1 14 8894 1 1 40 PRO HD3 H 2.945 13.303 11.348 1.00 . A A . 40 PRO HD3 1 1 14 8895 1 1 40 PRO HG2 H 4.469 15.868 11.343 1.00 . A A . 40 PRO HG2 1 1 14 8896 1 1 40 PRO HG3 H 4.512 14.532 12.508 1.00 . A A . 40 PRO HG3 1 1 14 8897 1 1 40 PRO N N 1.810 15.004 10.812 1.00 . A A . 40 PRO N 1 1 14 8898 1 1 40 PRO O O 2.480 17.686 10.222 1.00 . A A . 40 PRO O 1 1 14 8899 1 1 41 SER C C 0.856 20.759 12.352 1.00 . A A . 41 SER C 1 1 14 8900 1 1 41 SER CA C 0.917 19.752 11.207 1.00 . A A . 41 SER CA 1 1 14 8901 1 1 41 SER CB C -0.287 19.942 10.282 1.00 . A A . 41 SER CB 1 1 14 8902 1 1 41 SER H H 0.382 18.145 12.478 1.00 . A A . 41 SER H 1 1 14 8903 1 1 41 SER HA H 1.823 19.919 10.644 1.00 . A A . 41 SER HA 1 1 14 8904 1 1 41 SER HB2 H -0.168 19.319 9.409 1.00 . A A . 41 SER HB2 1 1 14 8905 1 1 41 SER HB3 H -1.188 19.658 10.806 1.00 . A A . 41 SER HB3 1 1 14 8906 1 1 41 SER HG H -1.240 21.650 10.177 1.00 . A A . 41 SER HG 1 1 14 8907 1 1 41 SER N N 0.952 18.387 11.718 1.00 . A A . 41 SER N 1 1 14 8908 1 1 41 SER O O 0.180 20.536 13.355 1.00 . A A . 41 SER O 1 1 14 8909 1 1 41 SER OG O -0.405 21.292 9.869 1.00 . A A . 41 SER OG 1 1 14 8910 1 1 42 GLY C C 2.777 23.823 13.095 1.00 . A A . 42 GLY C 1 1 14 8911 1 1 42 GLY CA C 1.586 22.895 13.220 1.00 . A A . 42 GLY CA 1 1 14 8912 1 1 42 GLY H H 2.091 21.993 11.372 1.00 . A A . 42 GLY H 1 1 14 8913 1 1 42 GLY HA2 H 0.679 23.477 13.146 1.00 . A A . 42 GLY HA2 1 1 14 8914 1 1 42 GLY HA3 H 1.616 22.417 14.189 1.00 . A A . 42 GLY HA3 1 1 14 8915 1 1 42 GLY N N 1.571 21.869 12.193 1.00 . A A . 42 GLY N 1 1 14 8916 1 1 42 GLY O O 2.658 24.965 12.649 1.00 . A A . 42 GLY O 1 1 14 8917 1 1 43 PRO C C 5.672 24.342 12.007 1.00 . A A . 43 PRO C 1 1 14 8918 1 1 43 PRO CA C 5.200 24.111 13.439 1.00 . A A . 43 PRO CA 1 1 14 8919 1 1 43 PRO CB C 6.202 23.238 14.198 1.00 . A A . 43 PRO CB 1 1 14 8920 1 1 43 PRO CD C 4.175 21.981 14.040 1.00 . A A . 43 PRO CD 1 1 14 8921 1 1 43 PRO CG C 5.673 21.852 14.066 1.00 . A A . 43 PRO CG 1 1 14 8922 1 1 43 PRO HA H 5.096 25.062 13.940 1.00 . A A . 43 PRO HA 1 1 14 8923 1 1 43 PRO HB2 H 7.180 23.333 13.747 1.00 . A A . 43 PRO HB2 1 1 14 8924 1 1 43 PRO HB3 H 6.245 23.548 15.231 1.00 . A A . 43 PRO HB3 1 1 14 8925 1 1 43 PRO HD2 H 3.743 21.232 13.393 1.00 . A A . 43 PRO HD2 1 1 14 8926 1 1 43 PRO HD3 H 3.772 21.898 15.038 1.00 . A A . 43 PRO HD3 1 1 14 8927 1 1 43 PRO HG2 H 6.028 21.409 13.148 1.00 . A A . 43 PRO HG2 1 1 14 8928 1 1 43 PRO HG3 H 5.983 21.259 14.914 1.00 . A A . 43 PRO HG3 1 1 14 8929 1 1 43 PRO N N 3.959 23.333 13.497 1.00 . A A . 43 PRO N 1 1 14 8930 1 1 43 PRO O O 6.604 25.111 11.767 1.00 . A A . 43 PRO O 1 1 14 8931 1 1 44 SER C C 5.492 25.272 9.253 1.00 . A A . 44 SER C 1 1 14 8932 1 1 44 SER CA C 5.380 23.804 9.652 1.00 . A A . 44 SER CA 1 1 14 8933 1 1 44 SER CB C 4.340 23.103 8.774 1.00 . A A . 44 SER CB 1 1 14 8934 1 1 44 SER H H 4.289 23.076 11.314 1.00 . A A . 44 SER H 1 1 14 8935 1 1 44 SER HA H 6.339 23.329 9.507 1.00 . A A . 44 SER HA 1 1 14 8936 1 1 44 SER HB2 H 3.389 23.602 8.879 1.00 . A A . 44 SER HB2 1 1 14 8937 1 1 44 SER HB3 H 4.658 23.146 7.742 1.00 . A A . 44 SER HB3 1 1 14 8938 1 1 44 SER HG H 4.074 21.207 8.363 1.00 . A A . 44 SER HG 1 1 14 8939 1 1 44 SER N N 5.024 23.673 11.060 1.00 . A A . 44 SER N 1 1 14 8940 1 1 44 SER O O 4.541 26.041 9.400 1.00 . A A . 44 SER O 1 1 14 8941 1 1 44 SER OG O 4.188 21.746 9.149 1.00 . A A . 44 SER OG 1 1 14 8942 1 1 45 SER C C 7.704 27.075 7.037 1.00 . A A . 45 SER C 1 1 14 8943 1 1 45 SER CA C 6.900 27.032 8.333 1.00 . A A . 45 SER CA 1 1 14 8944 1 1 45 SER CB C 7.639 27.798 9.432 1.00 . A A . 45 SER CB 1 1 14 8945 1 1 45 SER H H 7.380 24.995 8.657 1.00 . A A . 45 SER H 1 1 14 8946 1 1 45 SER HA H 5.941 27.498 8.163 1.00 . A A . 45 SER HA 1 1 14 8947 1 1 45 SER HB2 H 7.576 28.857 9.233 1.00 . A A . 45 SER HB2 1 1 14 8948 1 1 45 SER HB3 H 7.182 27.583 10.387 1.00 . A A . 45 SER HB3 1 1 14 8949 1 1 45 SER HG H 9.552 28.169 9.229 1.00 . A A . 45 SER HG 1 1 14 8950 1 1 45 SER N N 6.661 25.655 8.749 1.00 . A A . 45 SER N 1 1 14 8951 1 1 45 SER O O 8.453 26.150 6.726 1.00 . A A . 45 SER O 1 1 14 8952 1 1 45 SER OG O 9.005 27.423 9.485 1.00 . A A . 45 SER OG 1 1 14 8953 1 1 46 GLY C C 7.412 27.934 3.832 1.00 . A A . 46 GLY C 1 1 14 8954 1 1 46 GLY CA C 8.261 28.305 5.031 1.00 . A A . 46 GLY CA 1 1 14 8955 1 1 46 GLY H H 6.934 28.866 6.583 1.00 . A A . 46 GLY H 1 1 14 8956 1 1 46 GLY HA2 H 8.580 29.332 4.929 1.00 . A A . 46 GLY HA2 1 1 14 8957 1 1 46 GLY HA3 H 9.132 27.668 5.052 1.00 . A A . 46 GLY HA3 1 1 14 8958 1 1 46 GLY N N 7.544 28.160 6.285 1.00 . A A . 46 GLY N 1 1 14 8959 1 1 46 GLY O O 6.927 26.805 3.768 1.00 . A A . 46 GLY O 1 1 14 8960 2 2 1 ZN ZN ZN -0.304 4.472 -0.766 1.00 . B A . 201 ZN ZN 1 1 15 8961 1 1 1 GLY C C 4.698 7.667 -23.475 1.00 . A A . 1 GLY C 1 1 15 8962 1 1 1 GLY CA C 4.325 9.061 -23.010 1.00 . A A . 1 GLY CA 1 1 15 8963 1 1 1 GLY H1 H 6.334 9.686 -23.249 1.00 . A A . 1 GLY H1 1 1 15 8964 1 1 1 GLY HA2 H 4.050 9.020 -21.967 1.00 . A A . 1 GLY HA2 1 1 15 8965 1 1 1 GLY HA3 H 3.475 9.403 -23.583 1.00 . A A . 1 GLY HA3 1 1 15 8966 1 1 1 GLY N N 5.411 10.009 -23.172 1.00 . A A . 1 GLY N 1 1 15 8967 1 1 1 GLY O O 5.136 7.480 -24.610 1.00 . A A . 1 GLY O 1 1 15 8968 1 1 2 SER C C 4.033 4.336 -22.069 1.00 . A A . 2 SER C 1 1 15 8969 1 1 2 SER CA C 4.852 5.302 -22.920 1.00 . A A . 2 SER CA 1 1 15 8970 1 1 2 SER CB C 6.345 5.045 -22.708 1.00 . A A . 2 SER CB 1 1 15 8971 1 1 2 SER H H 4.172 6.898 -21.706 1.00 . A A . 2 SER H 1 1 15 8972 1 1 2 SER HA H 4.612 5.140 -23.960 1.00 . A A . 2 SER HA 1 1 15 8973 1 1 2 SER HB2 H 6.628 5.374 -21.719 1.00 . A A . 2 SER HB2 1 1 15 8974 1 1 2 SER HB3 H 6.543 3.988 -22.806 1.00 . A A . 2 SER HB3 1 1 15 8975 1 1 2 SER HG H 7.071 5.299 -24.509 1.00 . A A . 2 SER HG 1 1 15 8976 1 1 2 SER N N 4.525 6.686 -22.595 1.00 . A A . 2 SER N 1 1 15 8977 1 1 2 SER O O 3.270 4.753 -21.198 1.00 . A A . 2 SER O 1 1 15 8978 1 1 2 SER OG O 7.124 5.746 -23.662 1.00 . A A . 2 SER OG 1 1 15 8979 1 1 3 SER C C 3.278 2.428 -20.135 1.00 . A A . 3 SER C 1 1 15 8980 1 1 3 SER CA C 3.470 2.017 -21.591 1.00 . A A . 3 SER CA 1 1 15 8981 1 1 3 SER CB C 4.216 0.683 -21.662 1.00 . A A . 3 SER CB 1 1 15 8982 1 1 3 SER H H 4.820 2.773 -23.036 1.00 . A A . 3 SER H 1 1 15 8983 1 1 3 SER HA H 2.500 1.902 -22.051 1.00 . A A . 3 SER HA 1 1 15 8984 1 1 3 SER HB2 H 5.276 0.860 -21.561 1.00 . A A . 3 SER HB2 1 1 15 8985 1 1 3 SER HB3 H 3.880 0.043 -20.859 1.00 . A A . 3 SER HB3 1 1 15 8986 1 1 3 SER HG H 3.805 0.685 -23.577 1.00 . A A . 3 SER HG 1 1 15 8987 1 1 3 SER N N 4.197 3.043 -22.329 1.00 . A A . 3 SER N 1 1 15 8988 1 1 3 SER O O 2.151 2.559 -19.658 1.00 . A A . 3 SER O 1 1 15 8989 1 1 3 SER OG O 3.978 0.030 -22.897 1.00 . A A . 3 SER OG 1 1 15 8990 1 1 4 GLY C C 3.301 2.223 -17.256 1.00 . A A . 4 GLY C 1 1 15 8991 1 1 4 GLY CA C 4.322 3.025 -18.037 1.00 . A A . 4 GLY CA 1 1 15 8992 1 1 4 GLY H H 5.260 2.512 -19.865 1.00 . A A . 4 GLY H 1 1 15 8993 1 1 4 GLY HA2 H 5.294 2.886 -17.588 1.00 . A A . 4 GLY HA2 1 1 15 8994 1 1 4 GLY HA3 H 4.059 4.072 -17.983 1.00 . A A . 4 GLY HA3 1 1 15 8995 1 1 4 GLY N N 4.389 2.631 -19.432 1.00 . A A . 4 GLY N 1 1 15 8996 1 1 4 GLY O O 3.353 0.994 -17.233 1.00 . A A . 4 GLY O 1 1 15 8997 1 1 5 SER C C 0.096 1.992 -16.667 1.00 . A A . 5 SER C 1 1 15 8998 1 1 5 SER CA C 1.335 2.265 -15.820 1.00 . A A . 5 SER CA 1 1 15 8999 1 1 5 SER CB C 0.962 3.129 -14.614 1.00 . A A . 5 SER CB 1 1 15 9000 1 1 5 SER H H 2.382 3.899 -16.668 1.00 . A A . 5 SER H 1 1 15 9001 1 1 5 SER HA H 1.732 1.324 -15.470 1.00 . A A . 5 SER HA 1 1 15 9002 1 1 5 SER HB2 H 0.151 2.661 -14.077 1.00 . A A . 5 SER HB2 1 1 15 9003 1 1 5 SER HB3 H 1.820 3.221 -13.962 1.00 . A A . 5 SER HB3 1 1 15 9004 1 1 5 SER HG H -0.396 4.435 -15.150 1.00 . A A . 5 SER HG 1 1 15 9005 1 1 5 SER N N 2.370 2.920 -16.612 1.00 . A A . 5 SER N 1 1 15 9006 1 1 5 SER O O -0.646 2.910 -17.016 1.00 . A A . 5 SER O 1 1 15 9007 1 1 5 SER OG O 0.556 4.424 -15.020 1.00 . A A . 5 SER OG 1 1 15 9008 1 1 6 SER C C -2.231 -0.540 -16.995 1.00 . A A . 6 SER C 1 1 15 9009 1 1 6 SER CA C -1.269 0.327 -17.803 1.00 . A A . 6 SER CA 1 1 15 9010 1 1 6 SER CB C -0.805 -0.431 -19.048 1.00 . A A . 6 SER CB 1 1 15 9011 1 1 6 SER H H 0.506 0.035 -16.686 1.00 . A A . 6 SER H 1 1 15 9012 1 1 6 SER HA H -1.784 1.225 -18.110 1.00 . A A . 6 SER HA 1 1 15 9013 1 1 6 SER HB2 H -0.243 0.236 -19.684 1.00 . A A . 6 SER HB2 1 1 15 9014 1 1 6 SER HB3 H -0.177 -1.258 -18.749 1.00 . A A . 6 SER HB3 1 1 15 9015 1 1 6 SER HG H -2.682 -0.395 -19.606 1.00 . A A . 6 SER HG 1 1 15 9016 1 1 6 SER N N -0.122 0.722 -16.994 1.00 . A A . 6 SER N 1 1 15 9017 1 1 6 SER O O -1.895 -1.655 -16.598 1.00 . A A . 6 SER O 1 1 15 9018 1 1 6 SER OG O -1.909 -0.937 -19.778 1.00 . A A . 6 SER OG 1 1 15 9019 1 1 7 GLY C C -4.692 -0.136 -14.639 1.00 . A A . 7 GLY C 1 1 15 9020 1 1 7 GLY CA C -4.422 -0.755 -15.996 1.00 . A A . 7 GLY CA 1 1 15 9021 1 1 7 GLY H H -3.642 0.877 -17.097 1.00 . A A . 7 GLY H 1 1 15 9022 1 1 7 GLY HA2 H -5.344 -0.780 -16.558 1.00 . A A . 7 GLY HA2 1 1 15 9023 1 1 7 GLY HA3 H -4.071 -1.767 -15.854 1.00 . A A . 7 GLY HA3 1 1 15 9024 1 1 7 GLY N N -3.430 -0.017 -16.755 1.00 . A A . 7 GLY N 1 1 15 9025 1 1 7 GLY O O -3.846 0.572 -14.092 1.00 . A A . 7 GLY O 1 1 15 9026 1 1 8 THR C C -5.451 -0.514 -11.673 1.00 . A A . 8 THR C 1 1 15 9027 1 1 8 THR CA C -6.255 0.136 -12.793 1.00 . A A . 8 THR CA 1 1 15 9028 1 1 8 THR CB C -7.757 -0.069 -12.518 1.00 . A A . 8 THR CB 1 1 15 9029 1 1 8 THR CG2 C -8.601 0.685 -13.534 1.00 . A A . 8 THR CG2 1 1 15 9030 1 1 8 THR H H -6.506 -0.973 -14.579 1.00 . A A . 8 THR H 1 1 15 9031 1 1 8 THR HA H -6.053 1.197 -12.799 1.00 . A A . 8 THR HA 1 1 15 9032 1 1 8 THR HB H -7.982 0.311 -11.532 1.00 . A A . 8 THR HB 1 1 15 9033 1 1 8 THR HG1 H -8.349 -1.700 -13.456 1.00 . A A . 8 THR HG1 1 1 15 9034 1 1 8 THR HG21 H -8.029 1.507 -13.938 1.00 . A A . 8 THR HG21 1 1 15 9035 1 1 8 THR HG22 H -9.489 1.068 -13.052 1.00 . A A . 8 THR HG22 1 1 15 9036 1 1 8 THR HG23 H -8.885 0.017 -14.334 1.00 . A A . 8 THR HG23 1 1 15 9037 1 1 8 THR N N -5.875 -0.402 -14.093 1.00 . A A . 8 THR N 1 1 15 9038 1 1 8 THR O O -5.011 0.158 -10.741 1.00 . A A . 8 THR O 1 1 15 9039 1 1 8 THR OG1 O -8.078 -1.464 -12.565 1.00 . A A . 8 THR OG1 1 1 15 9040 1 1 9 GLY C C -5.160 -3.863 -10.381 1.00 . A A . 9 GLY C 1 1 15 9041 1 1 9 GLY CA C -4.512 -2.546 -10.758 1.00 . A A . 9 GLY CA 1 1 15 9042 1 1 9 GLY H H -5.638 -2.311 -12.535 1.00 . A A . 9 GLY H 1 1 15 9043 1 1 9 GLY HA2 H -3.518 -2.739 -11.133 1.00 . A A . 9 GLY HA2 1 1 15 9044 1 1 9 GLY HA3 H -4.439 -1.929 -9.874 1.00 . A A . 9 GLY HA3 1 1 15 9045 1 1 9 GLY N N -5.264 -1.827 -11.770 1.00 . A A . 9 GLY N 1 1 15 9046 1 1 9 GLY O O -6.230 -3.884 -9.774 1.00 . A A . 9 GLY O 1 1 15 9047 1 1 10 GLU C C -4.069 -7.066 -9.547 1.00 . A A . 10 GLU C 1 1 15 9048 1 1 10 GLU CA C -5.033 -6.293 -10.442 1.00 . A A . 10 GLU CA 1 1 15 9049 1 1 10 GLU CB C -5.283 -7.073 -11.735 1.00 . A A . 10 GLU CB 1 1 15 9050 1 1 10 GLU CD C -7.729 -6.445 -11.710 1.00 . A A . 10 GLU CD 1 1 15 9051 1 1 10 GLU CG C -6.464 -6.557 -12.538 1.00 . A A . 10 GLU CG 1 1 15 9052 1 1 10 GLU H H -3.662 -4.884 -11.227 1.00 . A A . 10 GLU H 1 1 15 9053 1 1 10 GLU HA H -5.970 -6.170 -9.920 1.00 . A A . 10 GLU HA 1 1 15 9054 1 1 10 GLU HB2 H -4.399 -7.014 -12.353 1.00 . A A . 10 GLU HB2 1 1 15 9055 1 1 10 GLU HB3 H -5.469 -8.108 -11.486 1.00 . A A . 10 GLU HB3 1 1 15 9056 1 1 10 GLU HG2 H -6.220 -5.580 -12.927 1.00 . A A . 10 GLU HG2 1 1 15 9057 1 1 10 GLU HG3 H -6.648 -7.234 -13.360 1.00 . A A . 10 GLU HG3 1 1 15 9058 1 1 10 GLU N N -4.511 -4.965 -10.744 1.00 . A A . 10 GLU N 1 1 15 9059 1 1 10 GLU O O -3.233 -7.830 -10.029 1.00 . A A . 10 GLU O 1 1 15 9060 1 1 10 GLU OE1 O -7.907 -7.265 -10.785 1.00 . A A . 10 GLU OE1 1 1 15 9061 1 1 10 GLU OE2 O -8.542 -5.538 -11.986 1.00 . A A . 10 GLU OE2 1 1 15 9062 1 1 11 LYS C C -4.096 -7.848 -5.991 1.00 . A A . 11 LYS C 1 1 15 9063 1 1 11 LYS CA C -3.333 -7.538 -7.275 1.00 . A A . 11 LYS CA 1 1 15 9064 1 1 11 LYS CB C -2.109 -6.676 -6.958 1.00 . A A . 11 LYS CB 1 1 15 9065 1 1 11 LYS CD C -0.224 -5.467 -8.095 1.00 . A A . 11 LYS CD 1 1 15 9066 1 1 11 LYS CE C 0.852 -5.542 -9.168 1.00 . A A . 11 LYS CE 1 1 15 9067 1 1 11 LYS CG C -1.017 -6.760 -8.010 1.00 . A A . 11 LYS CG 1 1 15 9068 1 1 11 LYS H H -4.878 -6.240 -7.916 1.00 . A A . 11 LYS H 1 1 15 9069 1 1 11 LYS HA H -3.005 -8.466 -7.717 1.00 . A A . 11 LYS HA 1 1 15 9070 1 1 11 LYS HB2 H -2.421 -5.646 -6.874 1.00 . A A . 11 LYS HB2 1 1 15 9071 1 1 11 LYS HB3 H -1.694 -6.995 -6.013 1.00 . A A . 11 LYS HB3 1 1 15 9072 1 1 11 LYS HD2 H -0.898 -4.657 -8.333 1.00 . A A . 11 LYS HD2 1 1 15 9073 1 1 11 LYS HD3 H 0.245 -5.278 -7.140 1.00 . A A . 11 LYS HD3 1 1 15 9074 1 1 11 LYS HE2 H 1.369 -6.484 -9.075 1.00 . A A . 11 LYS HE2 1 1 15 9075 1 1 11 LYS HE3 H 0.379 -5.485 -10.138 1.00 . A A . 11 LYS HE3 1 1 15 9076 1 1 11 LYS HG2 H -0.345 -7.566 -7.755 1.00 . A A . 11 LYS HG2 1 1 15 9077 1 1 11 LYS HG3 H -1.471 -6.958 -8.971 1.00 . A A . 11 LYS HG3 1 1 15 9078 1 1 11 LYS HZ1 H 1.345 -3.536 -8.854 1.00 . A A . 11 LYS HZ1 1 1 15 9079 1 1 11 LYS HZ2 H 2.381 -4.338 -9.925 1.00 . A A . 11 LYS HZ2 1 1 15 9080 1 1 11 LYS HZ3 H 2.496 -4.626 -8.263 1.00 . A A . 11 LYS HZ3 1 1 15 9081 1 1 11 LYS N N -4.192 -6.861 -8.240 1.00 . A A . 11 LYS N 1 1 15 9082 1 1 11 LYS NZ N 1.837 -4.433 -9.044 1.00 . A A . 11 LYS NZ 1 1 15 9083 1 1 11 LYS O O -5.104 -7.217 -5.672 1.00 . A A . 11 LYS O 1 1 15 9084 1 1 12 PRO C C -4.062 -8.209 -2.876 1.00 . A A . 12 PRO C 1 1 15 9085 1 1 12 PRO CA C -4.226 -9.256 -3.973 1.00 . A A . 12 PRO CA 1 1 15 9086 1 1 12 PRO CB C -3.468 -10.535 -3.609 1.00 . A A . 12 PRO CB 1 1 15 9087 1 1 12 PRO CD C -2.409 -9.637 -5.555 1.00 . A A . 12 PRO CD 1 1 15 9088 1 1 12 PRO CG C -2.147 -10.398 -4.284 1.00 . A A . 12 PRO CG 1 1 15 9089 1 1 12 PRO HA H -5.275 -9.481 -4.101 1.00 . A A . 12 PRO HA 1 1 15 9090 1 1 12 PRO HB2 H -3.359 -10.598 -2.535 1.00 . A A . 12 PRO HB2 1 1 15 9091 1 1 12 PRO HB3 H -4.010 -11.395 -3.972 1.00 . A A . 12 PRO HB3 1 1 15 9092 1 1 12 PRO HD2 H -1.572 -8.997 -5.790 1.00 . A A . 12 PRO HD2 1 1 15 9093 1 1 12 PRO HD3 H -2.605 -10.319 -6.369 1.00 . A A . 12 PRO HD3 1 1 15 9094 1 1 12 PRO HG2 H -1.466 -9.850 -3.652 1.00 . A A . 12 PRO HG2 1 1 15 9095 1 1 12 PRO HG3 H -1.748 -11.376 -4.509 1.00 . A A . 12 PRO HG3 1 1 15 9096 1 1 12 PRO N N -3.606 -8.842 -5.235 1.00 . A A . 12 PRO N 1 1 15 9097 1 1 12 PRO O O -4.882 -8.121 -1.961 1.00 . A A . 12 PRO O 1 1 15 9098 1 1 13 TYR C C -2.985 -4.992 -2.573 1.00 . A A . 13 TYR C 1 1 15 9099 1 1 13 TYR CA C -2.728 -6.378 -1.989 1.00 . A A . 13 TYR CA 1 1 15 9100 1 1 13 TYR CB C -1.283 -6.476 -1.498 1.00 . A A . 13 TYR CB 1 1 15 9101 1 1 13 TYR CD1 C -1.145 -8.341 0.200 1.00 . A A . 13 TYR CD1 1 1 15 9102 1 1 13 TYR CD2 C -0.230 -8.723 -1.968 1.00 . A A . 13 TYR CD2 1 1 15 9103 1 1 13 TYR CE1 C -0.777 -9.615 0.585 1.00 . A A . 13 TYR CE1 1 1 15 9104 1 1 13 TYR CE2 C 0.141 -9.999 -1.592 1.00 . A A . 13 TYR CE2 1 1 15 9105 1 1 13 TYR CG C -0.879 -7.872 -1.081 1.00 . A A . 13 TYR CG 1 1 15 9106 1 1 13 TYR CZ C -0.135 -10.441 -0.314 1.00 . A A . 13 TYR CZ 1 1 15 9107 1 1 13 TYR H H -2.383 -7.536 -3.726 1.00 . A A . 13 TYR H 1 1 15 9108 1 1 13 TYR HA H -3.394 -6.532 -1.152 1.00 . A A . 13 TYR HA 1 1 15 9109 1 1 13 TYR HB2 H -0.619 -6.161 -2.288 1.00 . A A . 13 TYR HB2 1 1 15 9110 1 1 13 TYR HB3 H -1.154 -5.825 -0.645 1.00 . A A . 13 TYR HB3 1 1 15 9111 1 1 13 TYR HD1 H -1.648 -7.692 0.902 1.00 . A A . 13 TYR HD1 1 1 15 9112 1 1 13 TYR HD2 H -0.015 -8.373 -2.967 1.00 . A A . 13 TYR HD2 1 1 15 9113 1 1 13 TYR HE1 H -0.993 -9.962 1.585 1.00 . A A . 13 TYR HE1 1 1 15 9114 1 1 13 TYR HE2 H 0.644 -10.646 -2.295 1.00 . A A . 13 TYR HE2 1 1 15 9115 1 1 13 TYR HH H -0.546 -12.206 0.326 1.00 . A A . 13 TYR HH 1 1 15 9116 1 1 13 TYR N N -3.000 -7.418 -2.974 1.00 . A A . 13 TYR N 1 1 15 9117 1 1 13 TYR O O -2.890 -4.790 -3.784 1.00 . A A . 13 TYR O 1 1 15 9118 1 1 13 TYR OH O 0.234 -11.711 0.065 1.00 . A A . 13 TYR OH 1 1 15 9119 1 1 14 ARG C C -3.362 -1.691 -0.987 1.00 . A A . 14 ARG C 1 1 15 9120 1 1 14 ARG CA C -3.583 -2.675 -2.133 1.00 . A A . 14 ARG CA 1 1 15 9121 1 1 14 ARG CB C -5.017 -2.556 -2.652 1.00 . A A . 14 ARG CB 1 1 15 9122 1 1 14 ARG CD C -6.782 -0.966 -3.473 1.00 . A A . 14 ARG CD 1 1 15 9123 1 1 14 ARG CG C -5.291 -1.256 -3.391 1.00 . A A . 14 ARG CG 1 1 15 9124 1 1 14 ARG CZ C -8.653 -0.797 -1.888 1.00 . A A . 14 ARG CZ 1 1 15 9125 1 1 14 ARG H H -3.371 -4.264 -0.752 1.00 . A A . 14 ARG H 1 1 15 9126 1 1 14 ARG HA H -2.899 -2.436 -2.933 1.00 . A A . 14 ARG HA 1 1 15 9127 1 1 14 ARG HB2 H -5.212 -3.376 -3.327 1.00 . A A . 14 ARG HB2 1 1 15 9128 1 1 14 ARG HB3 H -5.696 -2.619 -1.815 1.00 . A A . 14 ARG HB3 1 1 15 9129 1 1 14 ARG HD2 H -6.933 -0.109 -4.112 1.00 . A A . 14 ARG HD2 1 1 15 9130 1 1 14 ARG HD3 H -7.279 -1.825 -3.899 1.00 . A A . 14 ARG HD3 1 1 15 9131 1 1 14 ARG HE H -6.748 -0.402 -1.449 1.00 . A A . 14 ARG HE 1 1 15 9132 1 1 14 ARG HG2 H -4.806 -0.446 -2.868 1.00 . A A . 14 ARG HG2 1 1 15 9133 1 1 14 ARG HG3 H -4.892 -1.332 -4.392 1.00 . A A . 14 ARG HG3 1 1 15 9134 1 1 14 ARG HH11 H -9.167 -1.386 -3.751 1.00 . A A . 14 ARG HH11 1 1 15 9135 1 1 14 ARG HH12 H -10.477 -1.262 -2.624 1.00 . A A . 14 ARG HH12 1 1 15 9136 1 1 14 ARG HH21 H -8.464 -0.236 0.045 1.00 . A A . 14 ARG HH21 1 1 15 9137 1 1 14 ARG HH22 H -10.076 -0.607 -0.465 1.00 . A A . 14 ARG HH22 1 1 15 9138 1 1 14 ARG N N -3.311 -4.041 -1.704 1.00 . A A . 14 ARG N 1 1 15 9139 1 1 14 ARG NE N -7.358 -0.686 -2.161 1.00 . A A . 14 ARG NE 1 1 15 9140 1 1 14 ARG NH1 N -9.502 -1.179 -2.832 1.00 . A A . 14 ARG NH1 1 1 15 9141 1 1 14 ARG NH2 N -9.101 -0.524 -0.670 1.00 . A A . 14 ARG NH2 1 1 15 9142 1 1 14 ARG O O -3.511 -2.042 0.184 1.00 . A A . 14 ARG O 1 1 15 9143 1 1 15 CYS C C -4.071 1.242 0.087 1.00 . A A . 15 CYS C 1 1 15 9144 1 1 15 CYS CA C -2.764 0.576 -0.334 1.00 . A A . 15 CYS CA 1 1 15 9145 1 1 15 CYS CB C -1.796 1.627 -0.883 1.00 . A A . 15 CYS CB 1 1 15 9146 1 1 15 CYS H H -2.904 -0.239 -2.283 1.00 . A A . 15 CYS H 1 1 15 9147 1 1 15 CYS HA H -2.319 0.106 0.530 1.00 . A A . 15 CYS HA 1 1 15 9148 1 1 15 CYS HB2 H -0.963 1.126 -1.355 1.00 . A A . 15 CYS HB2 1 1 15 9149 1 1 15 CYS HB3 H -2.310 2.229 -1.617 1.00 . A A . 15 CYS HB3 1 1 15 9150 1 1 15 CYS N N -3.006 -0.459 -1.332 1.00 . A A . 15 CYS N 1 1 15 9151 1 1 15 CYS O O -4.797 1.788 -0.743 1.00 . A A . 15 CYS O 1 1 15 9152 1 1 15 CYS SG S -1.121 2.749 0.384 1.00 . A A . 15 CYS SG 1 1 15 9153 1 1 16 ALA C C -5.371 3.272 2.226 1.00 . A A . 16 ALA C 1 1 15 9154 1 1 16 ALA CA C -5.579 1.794 1.915 1.00 . A A . 16 ALA CA 1 1 15 9155 1 1 16 ALA CB C -6.034 1.049 3.161 1.00 . A A . 16 ALA CB 1 1 15 9156 1 1 16 ALA H H -3.743 0.744 1.995 1.00 . A A . 16 ALA H 1 1 15 9157 1 1 16 ALA HA H -6.353 1.699 1.166 1.00 . A A . 16 ALA HA 1 1 15 9158 1 1 16 ALA HB1 H -6.904 1.536 3.574 1.00 . A A . 16 ALA HB1 1 1 15 9159 1 1 16 ALA HB2 H -6.281 0.030 2.900 1.00 . A A . 16 ALA HB2 1 1 15 9160 1 1 16 ALA HB3 H -5.239 1.052 3.892 1.00 . A A . 16 ALA HB3 1 1 15 9161 1 1 16 ALA N N -4.362 1.193 1.383 1.00 . A A . 16 ALA N 1 1 15 9162 1 1 16 ALA O O -6.002 3.819 3.130 1.00 . A A . 16 ALA O 1 1 15 9163 1 1 17 GLU C C -4.383 6.108 0.372 1.00 . A A . 17 GLU C 1 1 15 9164 1 1 17 GLU CA C -4.192 5.327 1.669 1.00 . A A . 17 GLU CA 1 1 15 9165 1 1 17 GLU CB C -2.762 5.510 2.182 1.00 . A A . 17 GLU CB 1 1 15 9166 1 1 17 GLU CD C -3.089 5.601 4.685 1.00 . A A . 17 GLU CD 1 1 15 9167 1 1 17 GLU CG C -2.503 4.832 3.517 1.00 . A A . 17 GLU CG 1 1 15 9168 1 1 17 GLU H H -4.013 3.421 0.766 1.00 . A A . 17 GLU H 1 1 15 9169 1 1 17 GLU HA H -4.881 5.707 2.409 1.00 . A A . 17 GLU HA 1 1 15 9170 1 1 17 GLU HB2 H -2.077 5.101 1.455 1.00 . A A . 17 GLU HB2 1 1 15 9171 1 1 17 GLU HB3 H -2.566 6.565 2.295 1.00 . A A . 17 GLU HB3 1 1 15 9172 1 1 17 GLU HG2 H -2.944 3.846 3.498 1.00 . A A . 17 GLU HG2 1 1 15 9173 1 1 17 GLU HG3 H -1.436 4.744 3.661 1.00 . A A . 17 GLU HG3 1 1 15 9174 1 1 17 GLU N N -4.483 3.912 1.471 1.00 . A A . 17 GLU N 1 1 15 9175 1 1 17 GLU O O -5.116 7.096 0.331 1.00 . A A . 17 GLU O 1 1 15 9176 1 1 17 GLU OE1 O -2.901 6.834 4.738 1.00 . A A . 17 GLU OE1 1 1 15 9177 1 1 17 GLU OE2 O -3.735 4.968 5.547 1.00 . A A . 17 GLU OE2 1 1 15 9178 1 1 18 CYS C C -4.644 5.482 -2.955 1.00 . A A . 18 CYS C 1 1 15 9179 1 1 18 CYS CA C -3.810 6.314 -1.984 1.00 . A A . 18 CYS CA 1 1 15 9180 1 1 18 CYS CB C -2.413 6.545 -2.564 1.00 . A A . 18 CYS CB 1 1 15 9181 1 1 18 CYS H H -3.147 4.865 -0.591 1.00 . A A . 18 CYS H 1 1 15 9182 1 1 18 CYS HA H -4.293 7.268 -1.841 1.00 . A A . 18 CYS HA 1 1 15 9183 1 1 18 CYS HB2 H -2.508 6.921 -3.572 1.00 . A A . 18 CYS HB2 1 1 15 9184 1 1 18 CYS HB3 H -1.897 7.275 -1.960 1.00 . A A . 18 CYS HB3 1 1 15 9185 1 1 18 CYS N N -3.716 5.658 -0.686 1.00 . A A . 18 CYS N 1 1 15 9186 1 1 18 CYS O O -5.479 6.014 -3.685 1.00 . A A . 18 CYS O 1 1 15 9187 1 1 18 CYS SG S -1.378 5.047 -2.630 1.00 . A A . 18 CYS SG 1 1 15 9188 1 1 19 GLY C C -4.252 2.591 -4.841 1.00 . A A . 19 GLY C 1 1 15 9189 1 1 19 GLY CA C -5.149 3.289 -3.838 1.00 . A A . 19 GLY CA 1 1 15 9190 1 1 19 GLY H H -3.734 3.805 -2.350 1.00 . A A . 19 GLY H 1 1 15 9191 1 1 19 GLY HA2 H -5.655 2.543 -3.243 1.00 . A A . 19 GLY HA2 1 1 15 9192 1 1 19 GLY HA3 H -5.887 3.868 -4.374 1.00 . A A . 19 GLY HA3 1 1 15 9193 1 1 19 GLY N N -4.412 4.173 -2.955 1.00 . A A . 19 GLY N 1 1 15 9194 1 1 19 GLY O O -4.624 2.417 -6.002 1.00 . A A . 19 GLY O 1 1 15 9195 1 1 20 LYS C C -2.246 -0.004 -5.132 1.00 . A A . 20 LYS C 1 1 15 9196 1 1 20 LYS CA C -2.112 1.510 -5.261 1.00 . A A . 20 LYS CA 1 1 15 9197 1 1 20 LYS CB C -0.683 1.937 -4.916 1.00 . A A . 20 LYS CB 1 1 15 9198 1 1 20 LYS CD C 1.692 2.200 -5.691 1.00 . A A . 20 LYS CD 1 1 15 9199 1 1 20 LYS CE C 2.704 1.869 -6.777 1.00 . A A . 20 LYS CE 1 1 15 9200 1 1 20 LYS CG C 0.329 1.602 -5.998 1.00 . A A . 20 LYS CG 1 1 15 9201 1 1 20 LYS H H -2.827 2.360 -3.459 1.00 . A A . 20 LYS H 1 1 15 9202 1 1 20 LYS HA H -2.328 1.792 -6.280 1.00 . A A . 20 LYS HA 1 1 15 9203 1 1 20 LYS HB2 H -0.669 3.005 -4.757 1.00 . A A . 20 LYS HB2 1 1 15 9204 1 1 20 LYS HB3 H -0.382 1.441 -4.005 1.00 . A A . 20 LYS HB3 1 1 15 9205 1 1 20 LYS HD2 H 1.597 3.273 -5.619 1.00 . A A . 20 LYS HD2 1 1 15 9206 1 1 20 LYS HD3 H 2.045 1.804 -4.749 1.00 . A A . 20 LYS HD3 1 1 15 9207 1 1 20 LYS HE2 H 2.331 2.234 -7.722 1.00 . A A . 20 LYS HE2 1 1 15 9208 1 1 20 LYS HE3 H 3.636 2.360 -6.544 1.00 . A A . 20 LYS HE3 1 1 15 9209 1 1 20 LYS HG2 H 0.426 0.529 -6.068 1.00 . A A . 20 LYS HG2 1 1 15 9210 1 1 20 LYS HG3 H -0.022 1.996 -6.941 1.00 . A A . 20 LYS HG3 1 1 15 9211 1 1 20 LYS HZ1 H 2.540 -0.086 -6.060 1.00 . A A . 20 LYS HZ1 1 1 15 9212 1 1 20 LYS HZ2 H 3.963 0.209 -6.926 1.00 . A A . 20 LYS HZ2 1 1 15 9213 1 1 20 LYS HZ3 H 2.495 0.030 -7.747 1.00 . A A . 20 LYS HZ3 1 1 15 9214 1 1 20 LYS N N -3.066 2.192 -4.395 1.00 . A A . 20 LYS N 1 1 15 9215 1 1 20 LYS NZ N 2.942 0.403 -6.885 1.00 . A A . 20 LYS NZ 1 1 15 9216 1 1 20 LYS O O -2.826 -0.506 -4.169 1.00 . A A . 20 LYS O 1 1 15 9217 1 1 21 ALA C C -0.378 -2.785 -5.874 1.00 . A A . 21 ALA C 1 1 15 9218 1 1 21 ALA CA C -1.761 -2.183 -6.100 1.00 . A A . 21 ALA CA 1 1 15 9219 1 1 21 ALA CB C -2.355 -2.695 -7.404 1.00 . A A . 21 ALA CB 1 1 15 9220 1 1 21 ALA H H -1.256 -0.270 -6.848 1.00 . A A . 21 ALA H 1 1 15 9221 1 1 21 ALA HA H -2.411 -2.488 -5.292 1.00 . A A . 21 ALA HA 1 1 15 9222 1 1 21 ALA HB1 H -2.726 -3.699 -7.260 1.00 . A A . 21 ALA HB1 1 1 15 9223 1 1 21 ALA HB2 H -3.168 -2.050 -7.705 1.00 . A A . 21 ALA HB2 1 1 15 9224 1 1 21 ALA HB3 H -1.594 -2.697 -8.169 1.00 . A A . 21 ALA HB3 1 1 15 9225 1 1 21 ALA N N -1.705 -0.727 -6.107 1.00 . A A . 21 ALA N 1 1 15 9226 1 1 21 ALA O O 0.626 -2.254 -6.349 1.00 . A A . 21 ALA O 1 1 15 9227 1 1 22 PHE C C 0.771 -6.084 -4.954 1.00 . A A . 22 PHE C 1 1 15 9228 1 1 22 PHE CA C 0.928 -4.569 -4.856 1.00 . A A . 22 PHE CA 1 1 15 9229 1 1 22 PHE CB C 1.426 -4.186 -3.461 1.00 . A A . 22 PHE CB 1 1 15 9230 1 1 22 PHE CD1 C 0.824 -1.801 -2.961 1.00 . A A . 22 PHE CD1 1 1 15 9231 1 1 22 PHE CD2 C 3.074 -2.297 -3.576 1.00 . A A . 22 PHE CD2 1 1 15 9232 1 1 22 PHE CE1 C 1.149 -0.463 -2.841 1.00 . A A . 22 PHE CE1 1 1 15 9233 1 1 22 PHE CE2 C 3.405 -0.960 -3.457 1.00 . A A . 22 PHE CE2 1 1 15 9234 1 1 22 PHE CG C 1.782 -2.732 -3.330 1.00 . A A . 22 PHE CG 1 1 15 9235 1 1 22 PHE CZ C 2.441 -0.042 -3.087 1.00 . A A . 22 PHE CZ 1 1 15 9236 1 1 22 PHE H H -1.167 -4.271 -4.794 1.00 . A A . 22 PHE H 1 1 15 9237 1 1 22 PHE HA H 1.651 -4.246 -5.589 1.00 . A A . 22 PHE HA 1 1 15 9238 1 1 22 PHE HB2 H 0.655 -4.404 -2.738 1.00 . A A . 22 PHE HB2 1 1 15 9239 1 1 22 PHE HB3 H 2.306 -4.766 -3.229 1.00 . A A . 22 PHE HB3 1 1 15 9240 1 1 22 PHE HD1 H -0.186 -2.129 -2.766 1.00 . A A . 22 PHE HD1 1 1 15 9241 1 1 22 PHE HD2 H 3.830 -3.014 -3.864 1.00 . A A . 22 PHE HD2 1 1 15 9242 1 1 22 PHE HE1 H 0.394 0.252 -2.552 1.00 . A A . 22 PHE HE1 1 1 15 9243 1 1 22 PHE HE2 H 4.416 -0.634 -3.650 1.00 . A A . 22 PHE HE2 1 1 15 9244 1 1 22 PHE HZ H 2.697 1.002 -2.995 1.00 . A A . 22 PHE HZ 1 1 15 9245 1 1 22 PHE N N -0.333 -3.896 -5.146 1.00 . A A . 22 PHE N 1 1 15 9246 1 1 22 PHE O O -0.174 -6.658 -4.411 1.00 . A A . 22 PHE O 1 1 15 9247 1 1 23 THR C C 1.922 -8.889 -4.500 1.00 . A A . 23 THR C 1 1 15 9248 1 1 23 THR CA C 1.669 -8.173 -5.821 1.00 . A A . 23 THR CA 1 1 15 9249 1 1 23 THR CB C 2.711 -8.641 -6.854 1.00 . A A . 23 THR CB 1 1 15 9250 1 1 23 THR CG2 C 4.116 -8.251 -6.421 1.00 . A A . 23 THR CG2 1 1 15 9251 1 1 23 THR H H 2.431 -6.213 -6.059 1.00 . A A . 23 THR H 1 1 15 9252 1 1 23 THR HA H 0.687 -8.442 -6.183 1.00 . A A . 23 THR HA 1 1 15 9253 1 1 23 THR HB H 2.497 -8.165 -7.801 1.00 . A A . 23 THR HB 1 1 15 9254 1 1 23 THR HG1 H 1.742 -10.359 -6.824 1.00 . A A . 23 THR HG1 1 1 15 9255 1 1 23 THR HG21 H 4.154 -7.187 -6.241 1.00 . A A . 23 THR HG21 1 1 15 9256 1 1 23 THR HG22 H 4.818 -8.510 -7.200 1.00 . A A . 23 THR HG22 1 1 15 9257 1 1 23 THR HG23 H 4.373 -8.779 -5.515 1.00 . A A . 23 THR HG23 1 1 15 9258 1 1 23 THR N N 1.703 -6.726 -5.650 1.00 . A A . 23 THR N 1 1 15 9259 1 1 23 THR O O 1.388 -9.971 -4.257 1.00 . A A . 23 THR O 1 1 15 9260 1 1 23 THR OG1 O 2.634 -10.062 -7.018 1.00 . A A . 23 THR OG1 1 1 15 9261 1 1 24 ASP C C 2.749 -7.877 -1.225 1.00 . A A . 24 ASP C 1 1 15 9262 1 1 24 ASP CA C 3.063 -8.858 -2.350 1.00 . A A . 24 ASP CA 1 1 15 9263 1 1 24 ASP CB C 4.538 -9.257 -2.299 1.00 . A A . 24 ASP CB 1 1 15 9264 1 1 24 ASP CG C 4.844 -10.199 -1.150 1.00 . A A . 24 ASP CG 1 1 15 9265 1 1 24 ASP H H 3.135 -7.417 -3.900 1.00 . A A . 24 ASP H 1 1 15 9266 1 1 24 ASP HA H 2.456 -9.741 -2.221 1.00 . A A . 24 ASP HA 1 1 15 9267 1 1 24 ASP HB2 H 4.804 -9.749 -3.223 1.00 . A A . 24 ASP HB2 1 1 15 9268 1 1 24 ASP HB3 H 5.141 -8.368 -2.183 1.00 . A A . 24 ASP HB3 1 1 15 9269 1 1 24 ASP N N 2.740 -8.279 -3.649 1.00 . A A . 24 ASP N 1 1 15 9270 1 1 24 ASP O O 2.444 -6.710 -1.472 1.00 . A A . 24 ASP O 1 1 15 9271 1 1 24 ASP OD1 O 4.454 -11.382 -1.234 1.00 . A A . 24 ASP OD1 1 1 15 9272 1 1 24 ASP OD2 O 5.472 -9.752 -0.167 1.00 . A A . 24 ASP OD2 1 1 15 9273 1 1 25 ARG C C 3.804 -6.789 1.630 1.00 . A A . 25 ARG C 1 1 15 9274 1 1 25 ARG CA C 2.547 -7.525 1.175 1.00 . A A . 25 ARG CA 1 1 15 9275 1 1 25 ARG CB C 2.000 -8.378 2.321 1.00 . A A . 25 ARG CB 1 1 15 9276 1 1 25 ARG CD C 0.060 -7.060 3.225 1.00 . A A . 25 ARG CD 1 1 15 9277 1 1 25 ARG CG C 1.471 -7.562 3.489 1.00 . A A . 25 ARG CG 1 1 15 9278 1 1 25 ARG CZ C -1.302 -8.375 4.793 1.00 . A A . 25 ARG CZ 1 1 15 9279 1 1 25 ARG H H 3.074 -9.298 0.145 1.00 . A A . 25 ARG H 1 1 15 9280 1 1 25 ARG HA H 1.801 -6.798 0.891 1.00 . A A . 25 ARG HA 1 1 15 9281 1 1 25 ARG HB2 H 1.194 -8.992 1.945 1.00 . A A . 25 ARG HB2 1 1 15 9282 1 1 25 ARG HB3 H 2.789 -9.018 2.685 1.00 . A A . 25 ARG HB3 1 1 15 9283 1 1 25 ARG HD2 H -0.113 -6.181 3.827 1.00 . A A . 25 ARG HD2 1 1 15 9284 1 1 25 ARG HD3 H -0.025 -6.803 2.179 1.00 . A A . 25 ARG HD3 1 1 15 9285 1 1 25 ARG HE H -1.382 -8.531 2.806 1.00 . A A . 25 ARG HE 1 1 15 9286 1 1 25 ARG HG2 H 1.461 -8.182 4.374 1.00 . A A . 25 ARG HG2 1 1 15 9287 1 1 25 ARG HG3 H 2.122 -6.715 3.648 1.00 . A A . 25 ARG HG3 1 1 15 9288 1 1 25 ARG HH11 H -0.035 -7.063 5.661 1.00 . A A . 25 ARG HH11 1 1 15 9289 1 1 25 ARG HH12 H -1.002 -7.996 6.755 1.00 . A A . 25 ARG HH12 1 1 15 9290 1 1 25 ARG HH21 H -2.660 -9.765 4.236 1.00 . A A . 25 ARG HH21 1 1 15 9291 1 1 25 ARG HH22 H -2.494 -9.533 5.943 1.00 . A A . 25 ARG HH22 1 1 15 9292 1 1 25 ARG N N 2.825 -8.359 0.012 1.00 . A A . 25 ARG N 1 1 15 9293 1 1 25 ARG NE N -0.948 -8.065 3.550 1.00 . A A . 25 ARG NE 1 1 15 9294 1 1 25 ARG NH1 N -0.733 -7.761 5.820 1.00 . A A . 25 ARG NH1 1 1 15 9295 1 1 25 ARG NH2 N -2.228 -9.301 5.008 1.00 . A A . 25 ARG NH2 1 1 15 9296 1 1 25 ARG O O 3.775 -5.583 1.871 1.00 . A A . 25 ARG O 1 1 15 9297 1 1 26 SER C C 6.432 -5.620 1.459 1.00 . A A . 26 SER C 1 1 15 9298 1 1 26 SER CA C 6.172 -6.943 2.174 1.00 . A A . 26 SER CA 1 1 15 9299 1 1 26 SER CB C 7.321 -7.915 1.905 1.00 . A A . 26 SER CB 1 1 15 9300 1 1 26 SER H H 4.864 -8.482 1.537 1.00 . A A . 26 SER H 1 1 15 9301 1 1 26 SER HA H 6.108 -6.758 3.236 1.00 . A A . 26 SER HA 1 1 15 9302 1 1 26 SER HB2 H 8.244 -7.487 2.266 1.00 . A A . 26 SER HB2 1 1 15 9303 1 1 26 SER HB3 H 7.130 -8.846 2.420 1.00 . A A . 26 SER HB3 1 1 15 9304 1 1 26 SER HG H 6.582 -8.231 0.118 1.00 . A A . 26 SER HG 1 1 15 9305 1 1 26 SER N N 4.905 -7.524 1.744 1.00 . A A . 26 SER N 1 1 15 9306 1 1 26 SER O O 6.876 -4.649 2.070 1.00 . A A . 26 SER O 1 1 15 9307 1 1 26 SER OG O 7.453 -8.179 0.519 1.00 . A A . 26 SER OG 1 1 15 9308 1 1 27 ASN C C 5.361 -3.300 -0.247 1.00 . A A . 27 ASN C 1 1 15 9309 1 1 27 ASN CA C 6.355 -4.388 -0.639 1.00 . A A . 27 ASN CA 1 1 15 9310 1 1 27 ASN CB C 6.216 -4.711 -2.128 1.00 . A A . 27 ASN CB 1 1 15 9311 1 1 27 ASN CG C 7.493 -5.274 -2.720 1.00 . A A . 27 ASN CG 1 1 15 9312 1 1 27 ASN H H 5.799 -6.397 -0.271 1.00 . A A . 27 ASN H 1 1 15 9313 1 1 27 ASN HA H 7.356 -4.030 -0.450 1.00 . A A . 27 ASN HA 1 1 15 9314 1 1 27 ASN HB2 H 5.429 -5.439 -2.260 1.00 . A A . 27 ASN HB2 1 1 15 9315 1 1 27 ASN HB3 H 5.959 -3.809 -2.664 1.00 . A A . 27 ASN HB3 1 1 15 9316 1 1 27 ASN HD21 H 6.498 -5.917 -4.318 1.00 . A A . 27 ASN HD21 1 1 15 9317 1 1 27 ASN HD22 H 8.194 -6.247 -4.306 1.00 . A A . 27 ASN HD22 1 1 15 9318 1 1 27 ASN N N 6.151 -5.591 0.160 1.00 . A A . 27 ASN N 1 1 15 9319 1 1 27 ASN ND2 N 7.384 -5.873 -3.900 1.00 . A A . 27 ASN ND2 1 1 15 9320 1 1 27 ASN O O 5.724 -2.130 -0.113 1.00 . A A . 27 ASN O 1 1 15 9321 1 1 27 ASN OD1 O 8.565 -5.172 -2.123 1.00 . A A . 27 ASN OD1 1 1 15 9322 1 1 28 LEU C C 3.444 -1.978 1.569 1.00 . A A . 28 LEU C 1 1 15 9323 1 1 28 LEU CA C 3.056 -2.750 0.312 1.00 . A A . 28 LEU CA 1 1 15 9324 1 1 28 LEU CB C 1.737 -3.489 0.540 1.00 . A A . 28 LEU CB 1 1 15 9325 1 1 28 LEU CD1 C 0.153 -1.572 0.230 1.00 . A A . 28 LEU CD1 1 1 15 9326 1 1 28 LEU CD2 C -0.556 -3.575 1.549 1.00 . A A . 28 LEU CD2 1 1 15 9327 1 1 28 LEU CG C 0.610 -2.673 1.174 1.00 . A A . 28 LEU CG 1 1 15 9328 1 1 28 LEU H H 3.876 -4.636 -0.187 1.00 . A A . 28 LEU H 1 1 15 9329 1 1 28 LEU HA H 2.931 -2.050 -0.501 1.00 . A A . 28 LEU HA 1 1 15 9330 1 1 28 LEU HB2 H 1.388 -3.846 -0.417 1.00 . A A . 28 LEU HB2 1 1 15 9331 1 1 28 LEU HB3 H 1.939 -4.333 1.184 1.00 . A A . 28 LEU HB3 1 1 15 9332 1 1 28 LEU HD11 H -0.387 -2.008 -0.597 1.00 . A A . 28 LEU HD11 1 1 15 9333 1 1 28 LEU HD12 H 1.013 -1.037 -0.143 1.00 . A A . 28 LEU HD12 1 1 15 9334 1 1 28 LEU HD13 H -0.493 -0.888 0.761 1.00 . A A . 28 LEU HD13 1 1 15 9335 1 1 28 LEU HD21 H -0.405 -4.555 1.123 1.00 . A A . 28 LEU HD21 1 1 15 9336 1 1 28 LEU HD22 H -1.474 -3.153 1.167 1.00 . A A . 28 LEU HD22 1 1 15 9337 1 1 28 LEU HD23 H -0.618 -3.654 2.625 1.00 . A A . 28 LEU HD23 1 1 15 9338 1 1 28 LEU HG H 0.978 -2.206 2.077 1.00 . A A . 28 LEU HG 1 1 15 9339 1 1 28 LEU N N 4.105 -3.692 -0.065 1.00 . A A . 28 LEU N 1 1 15 9340 1 1 28 LEU O O 3.321 -0.755 1.622 1.00 . A A . 28 LEU O 1 1 15 9341 1 1 29 PHE C C 5.341 -0.977 3.594 1.00 . A A . 29 PHE C 1 1 15 9342 1 1 29 PHE CA C 4.322 -2.086 3.837 1.00 . A A . 29 PHE CA 1 1 15 9343 1 1 29 PHE CB C 4.911 -3.139 4.778 1.00 . A A . 29 PHE CB 1 1 15 9344 1 1 29 PHE CD1 C 2.752 -4.375 5.104 1.00 . A A . 29 PHE CD1 1 1 15 9345 1 1 29 PHE CD2 C 4.057 -3.846 7.029 1.00 . A A . 29 PHE CD2 1 1 15 9346 1 1 29 PHE CE1 C 1.807 -4.983 5.909 1.00 . A A . 29 PHE CE1 1 1 15 9347 1 1 29 PHE CE2 C 3.116 -4.454 7.839 1.00 . A A . 29 PHE CE2 1 1 15 9348 1 1 29 PHE CG C 3.886 -3.800 5.655 1.00 . A A . 29 PHE CG 1 1 15 9349 1 1 29 PHE CZ C 1.990 -5.023 7.278 1.00 . A A . 29 PHE CZ 1 1 15 9350 1 1 29 PHE H H 3.989 -3.674 2.477 1.00 . A A . 29 PHE H 1 1 15 9351 1 1 29 PHE HA H 3.444 -1.657 4.294 1.00 . A A . 29 PHE HA 1 1 15 9352 1 1 29 PHE HB2 H 5.390 -3.908 4.191 1.00 . A A . 29 PHE HB2 1 1 15 9353 1 1 29 PHE HB3 H 5.644 -2.670 5.417 1.00 . A A . 29 PHE HB3 1 1 15 9354 1 1 29 PHE HD1 H 2.608 -4.345 4.034 1.00 . A A . 29 PHE HD1 1 1 15 9355 1 1 29 PHE HD2 H 4.938 -3.401 7.469 1.00 . A A . 29 PHE HD2 1 1 15 9356 1 1 29 PHE HE1 H 0.927 -5.428 5.468 1.00 . A A . 29 PHE HE1 1 1 15 9357 1 1 29 PHE HE2 H 3.262 -4.483 8.908 1.00 . A A . 29 PHE HE2 1 1 15 9358 1 1 29 PHE HZ H 1.253 -5.498 7.908 1.00 . A A . 29 PHE HZ 1 1 15 9359 1 1 29 PHE N N 3.914 -2.702 2.579 1.00 . A A . 29 PHE N 1 1 15 9360 1 1 29 PHE O O 5.215 0.127 4.125 1.00 . A A . 29 PHE O 1 1 15 9361 1 1 30 THR C C 6.803 0.971 1.899 1.00 . A A . 30 THR C 1 1 15 9362 1 1 30 THR CA C 7.397 -0.310 2.474 1.00 . A A . 30 THR CA 1 1 15 9363 1 1 30 THR CB C 8.416 -0.885 1.472 1.00 . A A . 30 THR CB 1 1 15 9364 1 1 30 THR CG2 C 9.457 0.159 1.099 1.00 . A A . 30 THR CG2 1 1 15 9365 1 1 30 THR H H 6.400 -2.175 2.394 1.00 . A A . 30 THR H 1 1 15 9366 1 1 30 THR HA H 7.919 -0.074 3.390 1.00 . A A . 30 THR HA 1 1 15 9367 1 1 30 THR HB H 7.889 -1.182 0.577 1.00 . A A . 30 THR HB 1 1 15 9368 1 1 30 THR HG1 H 9.501 -2.527 1.339 1.00 . A A . 30 THR HG1 1 1 15 9369 1 1 30 THR HG21 H 9.677 0.087 0.045 1.00 . A A . 30 THR HG21 1 1 15 9370 1 1 30 THR HG22 H 10.359 -0.013 1.668 1.00 . A A . 30 THR HG22 1 1 15 9371 1 1 30 THR HG23 H 9.074 1.144 1.321 1.00 . A A . 30 THR HG23 1 1 15 9372 1 1 30 THR N N 6.354 -1.279 2.787 1.00 . A A . 30 THR N 1 1 15 9373 1 1 30 THR O O 7.233 2.074 2.239 1.00 . A A . 30 THR O 1 1 15 9374 1 1 30 THR OG1 O 9.063 -2.032 2.035 1.00 . A A . 30 THR OG1 1 1 15 9375 1 1 31 HIS C C 4.385 2.775 1.439 1.00 . A A . 31 HIS C 1 1 15 9376 1 1 31 HIS CA C 5.158 1.964 0.404 1.00 . A A . 31 HIS CA 1 1 15 9377 1 1 31 HIS CB C 4.214 1.499 -0.705 1.00 . A A . 31 HIS CB 1 1 15 9378 1 1 31 HIS CD2 C 1.926 2.719 -0.740 1.00 . A A . 31 HIS CD2 1 1 15 9379 1 1 31 HIS CE1 C 2.425 4.297 -2.178 1.00 . A A . 31 HIS CE1 1 1 15 9380 1 1 31 HIS CG C 3.214 2.535 -1.114 1.00 . A A . 31 HIS CG 1 1 15 9381 1 1 31 HIS H H 5.514 -0.086 0.795 1.00 . A A . 31 HIS H 1 1 15 9382 1 1 31 HIS HA H 5.925 2.590 -0.026 1.00 . A A . 31 HIS HA 1 1 15 9383 1 1 31 HIS HB2 H 4.796 1.238 -1.577 1.00 . A A . 31 HIS HB2 1 1 15 9384 1 1 31 HIS HB3 H 3.672 0.628 -0.366 1.00 . A A . 31 HIS HB3 1 1 15 9385 1 1 31 HIS HD1 H 4.353 3.677 -2.469 1.00 . A A . 31 HIS HD1 1 1 15 9386 1 1 31 HIS HD2 H 1.368 2.112 -0.040 1.00 . A A . 31 HIS HD2 1 1 15 9387 1 1 31 HIS HE1 H 2.352 5.159 -2.824 1.00 . A A . 31 HIS HE1 1 1 15 9388 1 1 31 HIS N N 5.812 0.818 1.026 1.00 . A A . 31 HIS N 1 1 15 9389 1 1 31 HIS ND1 N 3.496 3.539 -2.016 1.00 . A A . 31 HIS ND1 1 1 15 9390 1 1 31 HIS NE2 N 1.459 3.820 -1.414 1.00 . A A . 31 HIS NE2 1 1 15 9391 1 1 31 HIS O O 4.499 4.000 1.492 1.00 . A A . 31 HIS O 1 1 15 9392 1 1 32 GLN C C 3.625 3.807 4.011 1.00 . A A . 32 GLN C 1 1 15 9393 1 1 32 GLN CA C 2.805 2.743 3.290 1.00 . A A . 32 GLN CA 1 1 15 9394 1 1 32 GLN CB C 2.285 1.715 4.296 1.00 . A A . 32 GLN CB 1 1 15 9395 1 1 32 GLN CD C 0.566 -0.076 4.769 1.00 . A A . 32 GLN CD 1 1 15 9396 1 1 32 GLN CG C 0.934 1.126 3.922 1.00 . A A . 32 GLN CG 1 1 15 9397 1 1 32 GLN H H 3.550 1.111 2.166 1.00 . A A . 32 GLN H 1 1 15 9398 1 1 32 GLN HA H 1.964 3.219 2.808 1.00 . A A . 32 GLN HA 1 1 15 9399 1 1 32 GLN HB2 H 2.998 0.907 4.369 1.00 . A A . 32 GLN HB2 1 1 15 9400 1 1 32 GLN HB3 H 2.191 2.189 5.262 1.00 . A A . 32 GLN HB3 1 1 15 9401 1 1 32 GLN HE21 H -0.250 -0.969 3.191 1.00 . A A . 32 GLN HE21 1 1 15 9402 1 1 32 GLN HE22 H -0.311 -1.857 4.672 1.00 . A A . 32 GLN HE22 1 1 15 9403 1 1 32 GLN HG2 H 0.177 1.885 4.053 1.00 . A A . 32 GLN HG2 1 1 15 9404 1 1 32 GLN HG3 H 0.963 0.823 2.886 1.00 . A A . 32 GLN HG3 1 1 15 9405 1 1 32 GLN N N 3.598 2.085 2.258 1.00 . A A . 32 GLN N 1 1 15 9406 1 1 32 GLN NE2 N -0.062 -1.067 4.149 1.00 . A A . 32 GLN NE2 1 1 15 9407 1 1 32 GLN O O 3.075 4.737 4.601 1.00 . A A . 32 GLN O 1 1 15 9408 1 1 32 GLN OE1 O 0.844 -0.113 5.968 1.00 . A A . 32 GLN OE1 1 1 15 9409 1 1 33 LYS C C 5.506 6.046 4.200 1.00 . A A . 33 LYS C 1 1 15 9410 1 1 33 LYS CA C 5.843 4.615 4.606 1.00 . A A . 33 LYS CA 1 1 15 9411 1 1 33 LYS CB C 7.297 4.300 4.247 1.00 . A A . 33 LYS CB 1 1 15 9412 1 1 33 LYS CD C 9.373 3.027 4.862 1.00 . A A . 33 LYS CD 1 1 15 9413 1 1 33 LYS CE C 9.798 2.560 3.479 1.00 . A A . 33 LYS CE 1 1 15 9414 1 1 33 LYS CG C 7.860 3.099 4.986 1.00 . A A . 33 LYS CG 1 1 15 9415 1 1 33 LYS H H 5.326 2.903 3.474 1.00 . A A . 33 LYS H 1 1 15 9416 1 1 33 LYS HA H 5.716 4.517 5.674 1.00 . A A . 33 LYS HA 1 1 15 9417 1 1 33 LYS HB2 H 7.359 4.105 3.186 1.00 . A A . 33 LYS HB2 1 1 15 9418 1 1 33 LYS HB3 H 7.908 5.160 4.482 1.00 . A A . 33 LYS HB3 1 1 15 9419 1 1 33 LYS HD2 H 9.787 4.008 5.042 1.00 . A A . 33 LYS HD2 1 1 15 9420 1 1 33 LYS HD3 H 9.753 2.334 5.599 1.00 . A A . 33 LYS HD3 1 1 15 9421 1 1 33 LYS HE2 H 9.340 1.604 3.279 1.00 . A A . 33 LYS HE2 1 1 15 9422 1 1 33 LYS HE3 H 9.457 3.281 2.750 1.00 . A A . 33 LYS HE3 1 1 15 9423 1 1 33 LYS HG2 H 7.598 3.175 6.031 1.00 . A A . 33 LYS HG2 1 1 15 9424 1 1 33 LYS HG3 H 7.431 2.198 4.570 1.00 . A A . 33 LYS HG3 1 1 15 9425 1 1 33 LYS HZ1 H 11.713 3.356 3.227 1.00 . A A . 33 LYS HZ1 1 1 15 9426 1 1 33 LYS HZ2 H 11.520 1.811 2.564 1.00 . A A . 33 LYS HZ2 1 1 15 9427 1 1 33 LYS HZ3 H 11.661 2.001 4.238 1.00 . A A . 33 LYS HZ3 1 1 15 9428 1 1 33 LYS N N 4.945 3.665 3.960 1.00 . A A . 33 LYS N 1 1 15 9429 1 1 33 LYS NZ N 11.277 2.423 3.369 1.00 . A A . 33 LYS NZ 1 1 15 9430 1 1 33 LYS O O 5.391 6.931 5.049 1.00 . A A . 33 LYS O 1 1 15 9431 1 1 34 ILE C C 3.691 8.083 2.939 1.00 . A A . 34 ILE C 1 1 15 9432 1 1 34 ILE CA C 5.021 7.588 2.382 1.00 . A A . 34 ILE CA 1 1 15 9433 1 1 34 ILE CB C 4.953 7.590 0.844 1.00 . A A . 34 ILE CB 1 1 15 9434 1 1 34 ILE CD1 C 3.177 7.241 -0.945 1.00 . A A . 34 ILE CD1 1 1 15 9435 1 1 34 ILE CG1 C 3.763 6.758 0.363 1.00 . A A . 34 ILE CG1 1 1 15 9436 1 1 34 ILE CG2 C 6.252 7.058 0.256 1.00 . A A . 34 ILE CG2 1 1 15 9437 1 1 34 ILE H H 5.452 5.519 2.273 1.00 . A A . 34 ILE H 1 1 15 9438 1 1 34 ILE HA H 5.803 8.268 2.689 1.00 . A A . 34 ILE HA 1 1 15 9439 1 1 34 ILE HB H 4.828 8.610 0.513 1.00 . A A . 34 ILE HB 1 1 15 9440 1 1 34 ILE HD11 H 2.149 6.915 -1.021 1.00 . A A . 34 ILE HD11 1 1 15 9441 1 1 34 ILE HD12 H 3.215 8.320 -0.980 1.00 . A A . 34 ILE HD12 1 1 15 9442 1 1 34 ILE HD13 H 3.745 6.833 -1.768 1.00 . A A . 34 ILE HD13 1 1 15 9443 1 1 34 ILE HG12 H 4.079 5.735 0.226 1.00 . A A . 34 ILE HG12 1 1 15 9444 1 1 34 ILE HG13 H 2.984 6.793 1.110 1.00 . A A . 34 ILE HG13 1 1 15 9445 1 1 34 ILE HG21 H 6.628 6.259 0.878 1.00 . A A . 34 ILE HG21 1 1 15 9446 1 1 34 ILE HG22 H 6.068 6.681 -0.739 1.00 . A A . 34 ILE HG22 1 1 15 9447 1 1 34 ILE HG23 H 6.980 7.853 0.212 1.00 . A A . 34 ILE HG23 1 1 15 9448 1 1 34 ILE N N 5.348 6.265 2.899 1.00 . A A . 34 ILE N 1 1 15 9449 1 1 34 ILE O O 3.323 9.244 2.758 1.00 . A A . 34 ILE O 1 1 15 9450 1 1 35 HIS C C 1.755 7.516 5.730 1.00 . A A . 35 HIS C 1 1 15 9451 1 1 35 HIS CA C 1.683 7.542 4.206 1.00 . A A . 35 HIS CA 1 1 15 9452 1 1 35 HIS CB C 0.602 6.578 3.718 1.00 . A A . 35 HIS CB 1 1 15 9453 1 1 35 HIS CD2 C 0.603 5.617 1.309 1.00 . A A . 35 HIS CD2 1 1 15 9454 1 1 35 HIS CE1 C -0.082 7.410 0.249 1.00 . A A . 35 HIS CE1 1 1 15 9455 1 1 35 HIS CG C 0.415 6.589 2.232 1.00 . A A . 35 HIS CG 1 1 15 9456 1 1 35 HIS H H 3.319 6.285 3.730 1.00 . A A . 35 HIS H 1 1 15 9457 1 1 35 HIS HA H 1.432 8.542 3.887 1.00 . A A . 35 HIS HA 1 1 15 9458 1 1 35 HIS HB2 H 0.866 5.572 4.011 1.00 . A A . 35 HIS HB2 1 1 15 9459 1 1 35 HIS HB3 H -0.341 6.844 4.174 1.00 . A A . 35 HIS HB3 1 1 15 9460 1 1 35 HIS HD1 H -0.234 8.570 1.927 1.00 . A A . 35 HIS HD1 1 1 15 9461 1 1 35 HIS HD2 H 0.938 4.607 1.499 1.00 . A A . 35 HIS HD2 1 1 15 9462 1 1 35 HIS HE1 H -0.387 8.086 -0.536 1.00 . A A . 35 HIS HE1 1 1 15 9463 1 1 35 HIS N N 2.973 7.195 3.620 1.00 . A A . 35 HIS N 1 1 15 9464 1 1 35 HIS ND1 N -0.013 7.700 1.536 1.00 . A A . 35 HIS ND1 1 1 15 9465 1 1 35 HIS NE2 N 0.287 6.152 0.084 1.00 . A A . 35 HIS NE2 1 1 15 9466 1 1 35 HIS O O 0.844 7.985 6.413 1.00 . A A . 35 HIS O 1 1 15 9467 1 1 36 THR C C 3.789 8.086 8.231 1.00 . A A . 36 THR C 1 1 15 9468 1 1 36 THR CA C 3.033 6.874 7.700 1.00 . A A . 36 THR CA 1 1 15 9469 1 1 36 THR CB C 3.798 5.595 8.088 1.00 . A A . 36 THR CB 1 1 15 9470 1 1 36 THR CG2 C 3.070 4.356 7.587 1.00 . A A . 36 THR CG2 1 1 15 9471 1 1 36 THR H H 3.534 6.607 5.661 1.00 . A A . 36 THR H 1 1 15 9472 1 1 36 THR HA H 2.057 6.839 8.163 1.00 . A A . 36 THR HA 1 1 15 9473 1 1 36 THR HB H 3.863 5.545 9.165 1.00 . A A . 36 THR HB 1 1 15 9474 1 1 36 THR HG1 H 5.527 6.478 7.740 1.00 . A A . 36 THR HG1 1 1 15 9475 1 1 36 THR HG21 H 2.428 3.977 8.367 1.00 . A A . 36 THR HG21 1 1 15 9476 1 1 36 THR HG22 H 3.792 3.600 7.316 1.00 . A A . 36 THR HG22 1 1 15 9477 1 1 36 THR HG23 H 2.475 4.613 6.723 1.00 . A A . 36 THR HG23 1 1 15 9478 1 1 36 THR N N 2.843 6.963 6.257 1.00 . A A . 36 THR N 1 1 15 9479 1 1 36 THR O O 4.745 7.948 8.993 1.00 . A A . 36 THR O 1 1 15 9480 1 1 36 THR OG1 O 5.121 5.630 7.541 1.00 . A A . 36 THR OG1 1 1 15 9481 1 1 37 GLY C C 3.334 11.740 7.722 1.00 . A A . 37 GLY C 1 1 15 9482 1 1 37 GLY CA C 4.003 10.494 8.269 1.00 . A A . 37 GLY CA 1 1 15 9483 1 1 37 GLY H H 2.587 9.324 7.215 1.00 . A A . 37 GLY H 1 1 15 9484 1 1 37 GLY HA2 H 3.977 10.529 9.348 1.00 . A A . 37 GLY HA2 1 1 15 9485 1 1 37 GLY HA3 H 5.033 10.481 7.943 1.00 . A A . 37 GLY HA3 1 1 15 9486 1 1 37 GLY N N 3.355 9.275 7.823 1.00 . A A . 37 GLY N 1 1 15 9487 1 1 37 GLY O O 2.659 12.462 8.455 1.00 . A A . 37 GLY O 1 1 15 9488 1 1 38 GLU C C 2.351 12.797 4.425 1.00 . A A . 38 GLU C 1 1 15 9489 1 1 38 GLU CA C 2.934 13.161 5.787 1.00 . A A . 38 GLU CA 1 1 15 9490 1 1 38 GLU CB C 3.981 14.265 5.628 1.00 . A A . 38 GLU CB 1 1 15 9491 1 1 38 GLU CD C 6.280 14.772 4.711 1.00 . A A . 38 GLU CD 1 1 15 9492 1 1 38 GLU CG C 5.383 13.740 5.367 1.00 . A A . 38 GLU CG 1 1 15 9493 1 1 38 GLU H H 4.071 11.379 5.898 1.00 . A A . 38 GLU H 1 1 15 9494 1 1 38 GLU HA H 2.138 13.522 6.421 1.00 . A A . 38 GLU HA 1 1 15 9495 1 1 38 GLU HB2 H 3.696 14.898 4.800 1.00 . A A . 38 GLU HB2 1 1 15 9496 1 1 38 GLU HB3 H 4.003 14.857 6.531 1.00 . A A . 38 GLU HB3 1 1 15 9497 1 1 38 GLU HG2 H 5.825 13.448 6.308 1.00 . A A . 38 GLU HG2 1 1 15 9498 1 1 38 GLU HG3 H 5.317 12.879 4.719 1.00 . A A . 38 GLU HG3 1 1 15 9499 1 1 38 GLU N N 3.523 11.992 6.431 1.00 . A A . 38 GLU N 1 1 15 9500 1 1 38 GLU O O 3.073 12.380 3.519 1.00 . A A . 38 GLU O 1 1 15 9501 1 1 38 GLU OE1 O 5.746 15.737 4.126 1.00 . A A . 38 GLU OE1 1 1 15 9502 1 1 38 GLU OE2 O 7.517 14.615 4.784 1.00 . A A . 38 GLU OE2 1 1 15 9503 1 1 39 LYS C C 0.247 13.884 2.155 1.00 . A A . 39 LYS C 1 1 15 9504 1 1 39 LYS CA C 0.357 12.644 3.037 1.00 . A A . 39 LYS CA 1 1 15 9505 1 1 39 LYS CB C -1.038 12.081 3.320 1.00 . A A . 39 LYS CB 1 1 15 9506 1 1 39 LYS CD C -3.263 12.392 4.444 1.00 . A A . 39 LYS CD 1 1 15 9507 1 1 39 LYS CE C -3.341 11.253 5.449 1.00 . A A . 39 LYS CE 1 1 15 9508 1 1 39 LYS CG C -1.843 12.914 4.303 1.00 . A A . 39 LYS CG 1 1 15 9509 1 1 39 LYS H H 0.516 13.291 5.047 1.00 . A A . 39 LYS H 1 1 15 9510 1 1 39 LYS HA H 0.939 11.898 2.519 1.00 . A A . 39 LYS HA 1 1 15 9511 1 1 39 LYS HB2 H -1.587 12.029 2.391 1.00 . A A . 39 LYS HB2 1 1 15 9512 1 1 39 LYS HB3 H -0.936 11.084 3.724 1.00 . A A . 39 LYS HB3 1 1 15 9513 1 1 39 LYS HD2 H -3.901 13.197 4.779 1.00 . A A . 39 LYS HD2 1 1 15 9514 1 1 39 LYS HD3 H -3.603 12.036 3.482 1.00 . A A . 39 LYS HD3 1 1 15 9515 1 1 39 LYS HE2 H -2.402 10.722 5.445 1.00 . A A . 39 LYS HE2 1 1 15 9516 1 1 39 LYS HE3 H -3.516 11.668 6.431 1.00 . A A . 39 LYS HE3 1 1 15 9517 1 1 39 LYS HG2 H -1.360 12.879 5.269 1.00 . A A . 39 LYS HG2 1 1 15 9518 1 1 39 LYS HG3 H -1.877 13.936 3.952 1.00 . A A . 39 LYS HG3 1 1 15 9519 1 1 39 LYS HZ1 H -5.236 10.808 4.690 1.00 . A A . 39 LYS HZ1 1 1 15 9520 1 1 39 LYS HZ2 H -4.770 9.828 5.988 1.00 . A A . 39 LYS HZ2 1 1 15 9521 1 1 39 LYS HZ3 H -4.098 9.578 4.457 1.00 . A A . 39 LYS HZ3 1 1 15 9522 1 1 39 LYS N N 1.039 12.955 4.288 1.00 . A A . 39 LYS N 1 1 15 9523 1 1 39 LYS NZ N -4.438 10.300 5.123 1.00 . A A . 39 LYS NZ 1 1 15 9524 1 1 39 LYS O O -0.003 14.992 2.628 1.00 . A A . 39 LYS O 1 1 15 9525 1 1 40 PRO C C -1.060 15.305 -0.316 1.00 . A A . 40 PRO C 1 1 15 9526 1 1 40 PRO CA C 0.362 14.785 -0.136 1.00 . A A . 40 PRO CA 1 1 15 9527 1 1 40 PRO CB C 0.863 14.138 -1.429 1.00 . A A . 40 PRO CB 1 1 15 9528 1 1 40 PRO CD C 0.738 12.399 0.206 1.00 . A A . 40 PRO CD 1 1 15 9529 1 1 40 PRO CG C 0.579 12.685 -1.261 1.00 . A A . 40 PRO CG 1 1 15 9530 1 1 40 PRO HA H 1.012 15.604 0.134 1.00 . A A . 40 PRO HA 1 1 15 9531 1 1 40 PRO HB2 H 0.327 14.551 -2.272 1.00 . A A . 40 PRO HB2 1 1 15 9532 1 1 40 PRO HB3 H 1.920 14.323 -1.542 1.00 . A A . 40 PRO HB3 1 1 15 9533 1 1 40 PRO HD2 H 0.035 11.643 0.522 1.00 . A A . 40 PRO HD2 1 1 15 9534 1 1 40 PRO HD3 H 1.750 12.091 0.423 1.00 . A A . 40 PRO HD3 1 1 15 9535 1 1 40 PRO HG2 H -0.430 12.469 -1.579 1.00 . A A . 40 PRO HG2 1 1 15 9536 1 1 40 PRO HG3 H 1.287 12.105 -1.834 1.00 . A A . 40 PRO HG3 1 1 15 9537 1 1 40 PRO N N 0.436 13.694 0.841 1.00 . A A . 40 PRO N 1 1 15 9538 1 1 40 PRO O O -1.276 16.505 -0.485 1.00 . A A . 40 PRO O 1 1 15 9539 1 1 41 SER C C -3.760 16.016 0.359 1.00 . A A . 41 SER C 1 1 15 9540 1 1 41 SER CA C -3.430 14.760 -0.443 1.00 . A A . 41 SER CA 1 1 15 9541 1 1 41 SER CB C -4.335 13.608 -0.003 1.00 . A A . 41 SER CB 1 1 15 9542 1 1 41 SER H H -1.792 13.452 -0.142 1.00 . A A . 41 SER H 1 1 15 9543 1 1 41 SER HA H -3.600 14.961 -1.490 1.00 . A A . 41 SER HA 1 1 15 9544 1 1 41 SER HB2 H -5.348 13.811 -0.313 1.00 . A A . 41 SER HB2 1 1 15 9545 1 1 41 SER HB3 H -3.994 12.691 -0.462 1.00 . A A . 41 SER HB3 1 1 15 9546 1 1 41 SER HG H -4.873 12.712 1.654 1.00 . A A . 41 SER HG 1 1 15 9547 1 1 41 SER N N -2.028 14.394 -0.280 1.00 . A A . 41 SER N 1 1 15 9548 1 1 41 SER O O -3.011 16.410 1.252 1.00 . A A . 41 SER O 1 1 15 9549 1 1 41 SER OG O -4.311 13.450 1.405 1.00 . A A . 41 SER OG 1 1 15 9550 1 1 42 GLY C C -6.801 18.043 0.710 1.00 . A A . 42 GLY C 1 1 15 9551 1 1 42 GLY CA C -5.298 17.844 0.731 1.00 . A A . 42 GLY CA 1 1 15 9552 1 1 42 GLY H H -5.446 16.279 -0.688 1.00 . A A . 42 GLY H 1 1 15 9553 1 1 42 GLY HA2 H -4.968 17.782 1.757 1.00 . A A . 42 GLY HA2 1 1 15 9554 1 1 42 GLY HA3 H -4.827 18.696 0.263 1.00 . A A . 42 GLY HA3 1 1 15 9555 1 1 42 GLY N N -4.888 16.640 0.033 1.00 . A A . 42 GLY N 1 1 15 9556 1 1 42 GLY O O -7.531 17.505 1.543 1.00 . A A . 42 GLY O 1 1 15 9557 1 1 43 PRO C C -9.504 17.903 -0.873 1.00 . A A . 43 PRO C 1 1 15 9558 1 1 43 PRO CA C -8.713 19.121 -0.409 1.00 . A A . 43 PRO CA 1 1 15 9559 1 1 43 PRO CB C -8.745 20.218 -1.476 1.00 . A A . 43 PRO CB 1 1 15 9560 1 1 43 PRO CD C -6.470 19.507 -1.286 1.00 . A A . 43 PRO CD 1 1 15 9561 1 1 43 PRO CG C -7.494 20.019 -2.261 1.00 . A A . 43 PRO CG 1 1 15 9562 1 1 43 PRO HA H -9.140 19.497 0.510 1.00 . A A . 43 PRO HA 1 1 15 9563 1 1 43 PRO HB2 H -9.624 20.098 -2.093 1.00 . A A . 43 PRO HB2 1 1 15 9564 1 1 43 PRO HB3 H -8.762 21.187 -1.000 1.00 . A A . 43 PRO HB3 1 1 15 9565 1 1 43 PRO HD2 H -5.804 18.808 -1.771 1.00 . A A . 43 PRO HD2 1 1 15 9566 1 1 43 PRO HD3 H -5.913 20.328 -0.859 1.00 . A A . 43 PRO HD3 1 1 15 9567 1 1 43 PRO HG2 H -7.663 19.295 -3.043 1.00 . A A . 43 PRO HG2 1 1 15 9568 1 1 43 PRO HG3 H -7.173 20.960 -2.682 1.00 . A A . 43 PRO HG3 1 1 15 9569 1 1 43 PRO N N -7.283 18.833 -0.260 1.00 . A A . 43 PRO N 1 1 15 9570 1 1 43 PRO O O -9.509 17.569 -2.058 1.00 . A A . 43 PRO O 1 1 15 9571 1 1 44 SER C C -12.056 15.845 0.799 1.00 . A A . 44 SER C 1 1 15 9572 1 1 44 SER CA C -10.965 16.060 -0.245 1.00 . A A . 44 SER CA 1 1 15 9573 1 1 44 SER CB C -10.066 14.824 -0.322 1.00 . A A . 44 SER CB 1 1 15 9574 1 1 44 SER H H -10.129 17.559 0.995 1.00 . A A . 44 SER H 1 1 15 9575 1 1 44 SER HA H -11.429 16.217 -1.207 1.00 . A A . 44 SER HA 1 1 15 9576 1 1 44 SER HB2 H -9.662 14.615 0.657 1.00 . A A . 44 SER HB2 1 1 15 9577 1 1 44 SER HB3 H -10.649 13.979 -0.660 1.00 . A A . 44 SER HB3 1 1 15 9578 1 1 44 SER HG H -8.236 15.379 -0.749 1.00 . A A . 44 SER HG 1 1 15 9579 1 1 44 SER N N -10.172 17.243 0.068 1.00 . A A . 44 SER N 1 1 15 9580 1 1 44 SER O O -12.046 16.468 1.861 1.00 . A A . 44 SER O 1 1 15 9581 1 1 44 SER OG O -8.993 15.029 -1.225 1.00 . A A . 44 SER OG 1 1 15 9582 1 1 45 SER C C -14.656 13.267 1.140 1.00 . A A . 45 SER C 1 1 15 9583 1 1 45 SER CA C -14.098 14.664 1.398 1.00 . A A . 45 SER CA 1 1 15 9584 1 1 45 SER CB C -15.208 15.705 1.243 1.00 . A A . 45 SER CB 1 1 15 9585 1 1 45 SER H H -12.950 14.495 -0.374 1.00 . A A . 45 SER H 1 1 15 9586 1 1 45 SER HA H -13.716 14.705 2.406 1.00 . A A . 45 SER HA 1 1 15 9587 1 1 45 SER HB2 H -15.855 15.669 2.106 1.00 . A A . 45 SER HB2 1 1 15 9588 1 1 45 SER HB3 H -14.767 16.688 1.164 1.00 . A A . 45 SER HB3 1 1 15 9589 1 1 45 SER HG H -16.096 16.275 -0.408 1.00 . A A . 45 SER HG 1 1 15 9590 1 1 45 SER N N -12.997 14.959 0.489 1.00 . A A . 45 SER N 1 1 15 9591 1 1 45 SER O O -14.235 12.580 0.210 1.00 . A A . 45 SER O 1 1 15 9592 1 1 45 SER OG O -15.982 15.457 0.082 1.00 . A A . 45 SER OG 1 1 15 9593 1 1 46 GLY C C -17.371 11.322 2.764 1.00 . A A . 46 GLY C 1 1 15 9594 1 1 46 GLY CA C -16.208 11.542 1.818 1.00 . A A . 46 GLY CA 1 1 15 9595 1 1 46 GLY H H -15.904 13.445 2.695 1.00 . A A . 46 GLY H 1 1 15 9596 1 1 46 GLY HA2 H -16.559 11.435 0.802 1.00 . A A . 46 GLY HA2 1 1 15 9597 1 1 46 GLY HA3 H -15.457 10.790 2.009 1.00 . A A . 46 GLY HA3 1 1 15 9598 1 1 46 GLY N N -15.608 12.854 1.971 1.00 . A A . 46 GLY N 1 1 15 9599 1 1 46 GLY O O -17.902 12.296 3.297 1.00 . A A . 46 GLY O 1 1 15 9600 2 2 1 ZN ZN ZN -0.366 4.573 -0.747 1.00 . B A . 201 ZN ZN 1 1 16 9601 1 1 1 GLY C C -22.757 -4.368 -19.795 1.00 . A A . 1 GLY C 1 1 16 9602 1 1 1 GLY CA C -23.703 -3.204 -19.577 1.00 . A A . 1 GLY CA 1 1 16 9603 1 1 1 GLY H1 H -24.707 -4.345 -18.102 1.00 . A A . 1 GLY H1 1 1 16 9604 1 1 1 GLY HA2 H -24.167 -2.950 -20.519 1.00 . A A . 1 GLY HA2 1 1 16 9605 1 1 1 GLY HA3 H -23.136 -2.355 -19.226 1.00 . A A . 1 GLY HA3 1 1 16 9606 1 1 1 GLY N N -24.741 -3.506 -18.609 1.00 . A A . 1 GLY N 1 1 16 9607 1 1 1 GLY O O -22.779 -5.344 -19.045 1.00 . A A . 1 GLY O 1 1 16 9608 1 1 2 SER C C -19.541 -4.786 -21.129 1.00 . A A . 2 SER C 1 1 16 9609 1 1 2 SER CA C -20.969 -5.323 -21.144 1.00 . A A . 2 SER CA 1 1 16 9610 1 1 2 SER CB C -21.284 -5.929 -22.513 1.00 . A A . 2 SER CB 1 1 16 9611 1 1 2 SER H H -21.955 -3.464 -21.387 1.00 . A A . 2 SER H 1 1 16 9612 1 1 2 SER HA H -21.061 -6.090 -20.390 1.00 . A A . 2 SER HA 1 1 16 9613 1 1 2 SER HB2 H -22.355 -6.001 -22.634 1.00 . A A . 2 SER HB2 1 1 16 9614 1 1 2 SER HB3 H -20.876 -5.295 -23.287 1.00 . A A . 2 SER HB3 1 1 16 9615 1 1 2 SER HG H -21.370 -7.881 -22.376 1.00 . A A . 2 SER HG 1 1 16 9616 1 1 2 SER N N -21.924 -4.267 -20.826 1.00 . A A . 2 SER N 1 1 16 9617 1 1 2 SER O O -19.312 -3.596 -21.343 1.00 . A A . 2 SER O 1 1 16 9618 1 1 2 SER OG O -20.722 -7.223 -22.639 1.00 . A A . 2 SER OG 1 1 16 9619 1 1 3 SER C C -16.412 -5.894 -22.000 1.00 . A A . 3 SER C 1 1 16 9620 1 1 3 SER CA C -17.179 -5.289 -20.828 1.00 . A A . 3 SER CA 1 1 16 9621 1 1 3 SER CB C -16.550 -5.737 -19.507 1.00 . A A . 3 SER CB 1 1 16 9622 1 1 3 SER H H -18.832 -6.608 -20.712 1.00 . A A . 3 SER H 1 1 16 9623 1 1 3 SER HA H -17.127 -4.213 -20.895 1.00 . A A . 3 SER HA 1 1 16 9624 1 1 3 SER HB2 H -17.268 -5.615 -18.710 1.00 . A A . 3 SER HB2 1 1 16 9625 1 1 3 SER HB3 H -16.266 -6.776 -19.580 1.00 . A A . 3 SER HB3 1 1 16 9626 1 1 3 SER HG H -14.647 -5.313 -19.692 1.00 . A A . 3 SER HG 1 1 16 9627 1 1 3 SER N N -18.585 -5.673 -20.875 1.00 . A A . 3 SER N 1 1 16 9628 1 1 3 SER O O -16.911 -6.779 -22.693 1.00 . A A . 3 SER O 1 1 16 9629 1 1 3 SER OG O -15.398 -4.969 -19.205 1.00 . A A . 3 SER OG 1 1 16 9630 1 1 4 GLY C C -13.313 -6.883 -22.829 1.00 . A A . 4 GLY C 1 1 16 9631 1 1 4 GLY CA C -14.375 -5.911 -23.303 1.00 . A A . 4 GLY CA 1 1 16 9632 1 1 4 GLY H H -14.846 -4.702 -21.629 1.00 . A A . 4 GLY H 1 1 16 9633 1 1 4 GLY HA2 H -15.013 -6.410 -24.017 1.00 . A A . 4 GLY HA2 1 1 16 9634 1 1 4 GLY HA3 H -13.891 -5.076 -23.789 1.00 . A A . 4 GLY HA3 1 1 16 9635 1 1 4 GLY N N -15.193 -5.408 -22.215 1.00 . A A . 4 GLY N 1 1 16 9636 1 1 4 GLY O O -13.486 -7.554 -21.811 1.00 . A A . 4 GLY O 1 1 16 9637 1 1 5 SER C C -9.771 -7.169 -23.379 1.00 . A A . 5 SER C 1 1 16 9638 1 1 5 SER CA C -11.120 -7.863 -23.222 1.00 . A A . 5 SER CA 1 1 16 9639 1 1 5 SER CB C -11.167 -9.116 -24.099 1.00 . A A . 5 SER CB 1 1 16 9640 1 1 5 SER H H -12.133 -6.401 -24.369 1.00 . A A . 5 SER H 1 1 16 9641 1 1 5 SER HA H -11.245 -8.153 -22.189 1.00 . A A . 5 SER HA 1 1 16 9642 1 1 5 SER HB2 H -11.130 -8.827 -25.138 1.00 . A A . 5 SER HB2 1 1 16 9643 1 1 5 SER HB3 H -10.318 -9.744 -23.870 1.00 . A A . 5 SER HB3 1 1 16 9644 1 1 5 SER HG H -12.183 -10.788 -24.009 1.00 . A A . 5 SER HG 1 1 16 9645 1 1 5 SER N N -12.212 -6.961 -23.569 1.00 . A A . 5 SER N 1 1 16 9646 1 1 5 SER O O -9.505 -6.526 -24.394 1.00 . A A . 5 SER O 1 1 16 9647 1 1 5 SER OG O -12.355 -9.854 -23.872 1.00 . A A . 5 SER OG 1 1 16 9648 1 1 6 SER C C -6.616 -7.480 -21.533 1.00 . A A . 6 SER C 1 1 16 9649 1 1 6 SER CA C -7.600 -6.687 -22.387 1.00 . A A . 6 SER CA 1 1 16 9650 1 1 6 SER CB C -7.680 -5.243 -21.886 1.00 . A A . 6 SER CB 1 1 16 9651 1 1 6 SER H H -9.191 -7.829 -21.582 1.00 . A A . 6 SER H 1 1 16 9652 1 1 6 SER HA H -7.252 -6.685 -23.410 1.00 . A A . 6 SER HA 1 1 16 9653 1 1 6 SER HB2 H -6.799 -4.706 -22.202 1.00 . A A . 6 SER HB2 1 1 16 9654 1 1 6 SER HB3 H -8.558 -4.769 -22.301 1.00 . A A . 6 SER HB3 1 1 16 9655 1 1 6 SER HG H -8.512 -4.660 -20.212 1.00 . A A . 6 SER HG 1 1 16 9656 1 1 6 SER N N -8.921 -7.304 -22.365 1.00 . A A . 6 SER N 1 1 16 9657 1 1 6 SER O O -6.982 -8.036 -20.499 1.00 . A A . 6 SER O 1 1 16 9658 1 1 6 SER OG O -7.761 -5.198 -20.472 1.00 . A A . 6 SER OG 1 1 16 9659 1 1 7 GLY C C -3.878 -7.509 -20.005 1.00 . A A . 7 GLY C 1 1 16 9660 1 1 7 GLY CA C -4.344 -8.253 -21.240 1.00 . A A . 7 GLY CA 1 1 16 9661 1 1 7 GLY H H -5.128 -7.063 -22.807 1.00 . A A . 7 GLY H 1 1 16 9662 1 1 7 GLY HA2 H -4.744 -9.210 -20.942 1.00 . A A . 7 GLY HA2 1 1 16 9663 1 1 7 GLY HA3 H -3.495 -8.416 -21.889 1.00 . A A . 7 GLY HA3 1 1 16 9664 1 1 7 GLY N N -5.362 -7.526 -21.975 1.00 . A A . 7 GLY N 1 1 16 9665 1 1 7 GLY O O -2.788 -6.935 -19.989 1.00 . A A . 7 GLY O 1 1 16 9666 1 1 8 THR C C -4.718 -7.699 -16.511 1.00 . A A . 8 THR C 1 1 16 9667 1 1 8 THR CA C -4.375 -6.835 -17.719 1.00 . A A . 8 THR CA 1 1 16 9668 1 1 8 THR CB C -5.115 -5.489 -17.601 1.00 . A A . 8 THR CB 1 1 16 9669 1 1 8 THR CG2 C -4.577 -4.485 -18.609 1.00 . A A . 8 THR CG2 1 1 16 9670 1 1 8 THR H H -5.560 -7.991 -19.038 1.00 . A A . 8 THR H 1 1 16 9671 1 1 8 THR HA H -3.312 -6.638 -17.719 1.00 . A A . 8 THR HA 1 1 16 9672 1 1 8 THR HB H -4.961 -5.097 -16.606 1.00 . A A . 8 THR HB 1 1 16 9673 1 1 8 THR HG1 H -6.962 -4.830 -17.815 1.00 . A A . 8 THR HG1 1 1 16 9674 1 1 8 THR HG21 H -3.723 -3.976 -18.188 1.00 . A A . 8 THR HG21 1 1 16 9675 1 1 8 THR HG22 H -5.346 -3.764 -18.844 1.00 . A A . 8 THR HG22 1 1 16 9676 1 1 8 THR HG23 H -4.281 -5.002 -19.509 1.00 . A A . 8 THR HG23 1 1 16 9677 1 1 8 THR N N -4.706 -7.516 -18.964 1.00 . A A . 8 THR N 1 1 16 9678 1 1 8 THR O O -5.344 -8.750 -16.645 1.00 . A A . 8 THR O 1 1 16 9679 1 1 8 THR OG1 O -6.518 -5.682 -17.814 1.00 . A A . 8 THR OG1 1 1 16 9680 1 1 9 GLY C C -4.716 -7.094 -12.903 1.00 . A A . 9 GLY C 1 1 16 9681 1 1 9 GLY CA C -4.580 -7.993 -14.115 1.00 . A A . 9 GLY CA 1 1 16 9682 1 1 9 GLY H H -3.811 -6.403 -15.284 1.00 . A A . 9 GLY H 1 1 16 9683 1 1 9 GLY HA2 H -5.498 -8.547 -14.245 1.00 . A A . 9 GLY HA2 1 1 16 9684 1 1 9 GLY HA3 H -3.772 -8.689 -13.943 1.00 . A A . 9 GLY HA3 1 1 16 9685 1 1 9 GLY N N -4.306 -7.248 -15.330 1.00 . A A . 9 GLY N 1 1 16 9686 1 1 9 GLY O O -4.692 -5.870 -13.025 1.00 . A A . 9 GLY O 1 1 16 9687 1 1 10 GLU C C -4.209 -7.596 -9.363 1.00 . A A . 10 GLU C 1 1 16 9688 1 1 10 GLU CA C -5.006 -6.947 -10.491 1.00 . A A . 10 GLU CA 1 1 16 9689 1 1 10 GLU CB C -6.481 -6.848 -10.096 1.00 . A A . 10 GLU CB 1 1 16 9690 1 1 10 GLU CD C -8.095 -6.182 -8.270 1.00 . A A . 10 GLU CD 1 1 16 9691 1 1 10 GLU CG C -6.730 -5.956 -8.892 1.00 . A A . 10 GLU CG 1 1 16 9692 1 1 10 GLU H H -4.874 -8.682 -11.697 1.00 . A A . 10 GLU H 1 1 16 9693 1 1 10 GLU HA H -4.621 -5.953 -10.662 1.00 . A A . 10 GLU HA 1 1 16 9694 1 1 10 GLU HB2 H -7.039 -6.453 -10.933 1.00 . A A . 10 GLU HB2 1 1 16 9695 1 1 10 GLU HB3 H -6.847 -7.837 -9.867 1.00 . A A . 10 GLU HB3 1 1 16 9696 1 1 10 GLU HG2 H -5.975 -6.158 -8.147 1.00 . A A . 10 GLU HG2 1 1 16 9697 1 1 10 GLU HG3 H -6.659 -4.924 -9.203 1.00 . A A . 10 GLU HG3 1 1 16 9698 1 1 10 GLU N N -4.862 -7.702 -11.730 1.00 . A A . 10 GLU N 1 1 16 9699 1 1 10 GLU O O -3.967 -8.803 -9.373 1.00 . A A . 10 GLU O 1 1 16 9700 1 1 10 GLU OE1 O -8.578 -7.333 -8.301 1.00 . A A . 10 GLU OE1 1 1 16 9701 1 1 10 GLU OE2 O -8.679 -5.207 -7.754 1.00 . A A . 10 GLU OE2 1 1 16 9702 1 1 11 LYS C C -3.946 -7.567 -6.065 1.00 . A A . 11 LYS C 1 1 16 9703 1 1 11 LYS CA C -3.035 -7.279 -7.254 1.00 . A A . 11 LYS CA 1 1 16 9704 1 1 11 LYS CB C -1.965 -6.260 -6.855 1.00 . A A . 11 LYS CB 1 1 16 9705 1 1 11 LYS CD C -1.004 -6.232 -9.176 1.00 . A A . 11 LYS CD 1 1 16 9706 1 1 11 LYS CE C 0.272 -6.158 -10.001 1.00 . A A . 11 LYS CE 1 1 16 9707 1 1 11 LYS CG C -0.700 -6.348 -7.692 1.00 . A A . 11 LYS CG 1 1 16 9708 1 1 11 LYS H H -4.028 -5.833 -8.439 1.00 . A A . 11 LYS H 1 1 16 9709 1 1 11 LYS HA H -2.553 -8.197 -7.553 1.00 . A A . 11 LYS HA 1 1 16 9710 1 1 11 LYS HB2 H -2.374 -5.266 -6.962 1.00 . A A . 11 LYS HB2 1 1 16 9711 1 1 11 LYS HB3 H -1.699 -6.421 -5.820 1.00 . A A . 11 LYS HB3 1 1 16 9712 1 1 11 LYS HD2 H -1.571 -7.096 -9.488 1.00 . A A . 11 LYS HD2 1 1 16 9713 1 1 11 LYS HD3 H -1.585 -5.336 -9.346 1.00 . A A . 11 LYS HD3 1 1 16 9714 1 1 11 LYS HE2 H 0.743 -5.203 -9.827 1.00 . A A . 11 LYS HE2 1 1 16 9715 1 1 11 LYS HE3 H 0.935 -6.950 -9.686 1.00 . A A . 11 LYS HE3 1 1 16 9716 1 1 11 LYS HG2 H -0.035 -5.546 -7.407 1.00 . A A . 11 LYS HG2 1 1 16 9717 1 1 11 LYS HG3 H -0.222 -7.299 -7.505 1.00 . A A . 11 LYS HG3 1 1 16 9718 1 1 11 LYS HZ1 H 0.068 -7.306 -11.735 1.00 . A A . 11 LYS HZ1 1 1 16 9719 1 1 11 LYS HZ2 H 0.690 -5.756 -12.008 1.00 . A A . 11 LYS HZ2 1 1 16 9720 1 1 11 LYS HZ3 H -0.956 -5.960 -11.679 1.00 . A A . 11 LYS HZ3 1 1 16 9721 1 1 11 LYS N N -3.804 -6.786 -8.391 1.00 . A A . 11 LYS N 1 1 16 9722 1 1 11 LYS NZ N -0.001 -6.306 -11.458 1.00 . A A . 11 LYS NZ 1 1 16 9723 1 1 11 LYS O O -4.992 -6.942 -5.888 1.00 . A A . 11 LYS O 1 1 16 9724 1 1 12 PRO C C -4.289 -7.848 -2.960 1.00 . A A . 12 PRO C 1 1 16 9725 1 1 12 PRO CA C -4.306 -8.924 -4.040 1.00 . A A . 12 PRO CA 1 1 16 9726 1 1 12 PRO CB C -3.584 -10.183 -3.552 1.00 . A A . 12 PRO CB 1 1 16 9727 1 1 12 PRO CD C -2.305 -9.320 -5.378 1.00 . A A . 12 PRO CD 1 1 16 9728 1 1 12 PRO CG C -2.192 -10.045 -4.065 1.00 . A A . 12 PRO CG 1 1 16 9729 1 1 12 PRO HA H -5.328 -9.167 -4.289 1.00 . A A . 12 PRO HA 1 1 16 9730 1 1 12 PRO HB2 H -3.606 -10.217 -2.472 1.00 . A A . 12 PRO HB2 1 1 16 9731 1 1 12 PRO HB3 H -4.068 -11.059 -3.956 1.00 . A A . 12 PRO HB3 1 1 16 9732 1 1 12 PRO HD2 H -1.452 -8.674 -5.526 1.00 . A A . 12 PRO HD2 1 1 16 9733 1 1 12 PRO HD3 H -2.393 -10.025 -6.191 1.00 . A A . 12 PRO HD3 1 1 16 9734 1 1 12 PRO HG2 H -1.600 -9.471 -3.369 1.00 . A A . 12 PRO HG2 1 1 16 9735 1 1 12 PRO HG3 H -1.757 -11.022 -4.213 1.00 . A A . 12 PRO HG3 1 1 16 9736 1 1 12 PRO N N -3.541 -8.534 -5.228 1.00 . A A . 12 PRO N 1 1 16 9737 1 1 12 PRO O O -5.297 -7.606 -2.296 1.00 . A A . 12 PRO O 1 1 16 9738 1 1 13 TYR C C -3.246 -4.780 -2.400 1.00 . A A . 13 TYR C 1 1 16 9739 1 1 13 TYR CA C -2.991 -6.155 -1.790 1.00 . A A . 13 TYR CA 1 1 16 9740 1 1 13 TYR CB C -1.591 -6.200 -1.175 1.00 . A A . 13 TYR CB 1 1 16 9741 1 1 13 TYR CD1 C -1.688 -8.064 0.526 1.00 . A A . 13 TYR CD1 1 1 16 9742 1 1 13 TYR CD2 C -0.323 -8.372 -1.404 1.00 . A A . 13 TYR CD2 1 1 16 9743 1 1 13 TYR CE1 C -1.327 -9.316 0.987 1.00 . A A . 13 TYR CE1 1 1 16 9744 1 1 13 TYR CE2 C 0.042 -9.626 -0.952 1.00 . A A . 13 TYR CE2 1 1 16 9745 1 1 13 TYR CG C -1.194 -7.571 -0.676 1.00 . A A . 13 TYR CG 1 1 16 9746 1 1 13 TYR CZ C -0.462 -10.092 0.244 1.00 . A A . 13 TYR CZ 1 1 16 9747 1 1 13 TYR H H -2.371 -7.442 -3.351 1.00 . A A . 13 TYR H 1 1 16 9748 1 1 13 TYR HA H -3.720 -6.332 -1.013 1.00 . A A . 13 TYR HA 1 1 16 9749 1 1 13 TYR HB2 H -0.870 -5.897 -1.918 1.00 . A A . 13 TYR HB2 1 1 16 9750 1 1 13 TYR HB3 H -1.550 -5.517 -0.340 1.00 . A A . 13 TYR HB3 1 1 16 9751 1 1 13 TYR HD1 H -2.365 -7.453 1.105 1.00 . A A . 13 TYR HD1 1 1 16 9752 1 1 13 TYR HD2 H 0.070 -8.003 -2.340 1.00 . A A . 13 TYR HD2 1 1 16 9753 1 1 13 TYR HE1 H -1.722 -9.682 1.923 1.00 . A A . 13 TYR HE1 1 1 16 9754 1 1 13 TYR HE2 H 0.719 -10.234 -1.532 1.00 . A A . 13 TYR HE2 1 1 16 9755 1 1 13 TYR HH H -0.885 -11.881 0.807 1.00 . A A . 13 TYR HH 1 1 16 9756 1 1 13 TYR N N -3.139 -7.205 -2.791 1.00 . A A . 13 TYR N 1 1 16 9757 1 1 13 TYR O O -2.983 -4.554 -3.581 1.00 . A A . 13 TYR O 1 1 16 9758 1 1 13 TYR OH O -0.100 -11.340 0.699 1.00 . A A . 13 TYR OH 1 1 16 9759 1 1 14 ARG C C -3.871 -1.503 -0.913 1.00 . A A . 14 ARG C 1 1 16 9760 1 1 14 ARG CA C -4.053 -2.512 -2.044 1.00 . A A . 14 ARG CA 1 1 16 9761 1 1 14 ARG CB C -5.480 -2.431 -2.588 1.00 . A A . 14 ARG CB 1 1 16 9762 1 1 14 ARG CD C -5.257 -1.504 -4.913 1.00 . A A . 14 ARG CD 1 1 16 9763 1 1 14 ARG CG C -5.721 -1.233 -3.491 1.00 . A A . 14 ARG CG 1 1 16 9764 1 1 14 ARG CZ C -7.359 -1.794 -6.155 1.00 . A A . 14 ARG CZ 1 1 16 9765 1 1 14 ARG H H -3.949 -4.105 -0.654 1.00 . A A . 14 ARG H 1 1 16 9766 1 1 14 ARG HA H -3.360 -2.273 -2.837 1.00 . A A . 14 ARG HA 1 1 16 9767 1 1 14 ARG HB2 H -5.688 -3.328 -3.154 1.00 . A A . 14 ARG HB2 1 1 16 9768 1 1 14 ARG HB3 H -6.166 -2.373 -1.757 1.00 . A A . 14 ARG HB3 1 1 16 9769 1 1 14 ARG HD2 H -5.108 -0.560 -5.416 1.00 . A A . 14 ARG HD2 1 1 16 9770 1 1 14 ARG HD3 H -4.322 -2.043 -4.876 1.00 . A A . 14 ARG HD3 1 1 16 9771 1 1 14 ARG HE H -6.029 -3.240 -5.812 1.00 . A A . 14 ARG HE 1 1 16 9772 1 1 14 ARG HG2 H -6.778 -1.011 -3.505 1.00 . A A . 14 ARG HG2 1 1 16 9773 1 1 14 ARG HG3 H -5.179 -0.385 -3.100 1.00 . A A . 14 ARG HG3 1 1 16 9774 1 1 14 ARG HH11 H -7.028 0.077 -5.467 1.00 . A A . 14 ARG HH11 1 1 16 9775 1 1 14 ARG HH12 H -8.507 -0.141 -6.344 1.00 . A A . 14 ARG HH12 1 1 16 9776 1 1 14 ARG HH21 H -7.972 -3.539 -6.968 1.00 . A A . 14 ARG HH21 1 1 16 9777 1 1 14 ARG HH22 H -9.043 -2.198 -7.197 1.00 . A A . 14 ARG HH22 1 1 16 9778 1 1 14 ARG N N -3.761 -3.864 -1.585 1.00 . A A . 14 ARG N 1 1 16 9779 1 1 14 ARG NE N -6.229 -2.293 -5.665 1.00 . A A . 14 ARG NE 1 1 16 9780 1 1 14 ARG NH1 N -7.656 -0.514 -5.973 1.00 . A A . 14 ARG NH1 1 1 16 9781 1 1 14 ARG NH2 N -8.193 -2.575 -6.829 1.00 . A A . 14 ARG NH2 1 1 16 9782 1 1 14 ARG O O -4.199 -1.782 0.241 1.00 . A A . 14 ARG O 1 1 16 9783 1 1 15 CYS C C -4.414 1.464 0.043 1.00 . A A . 15 CYS C 1 1 16 9784 1 1 15 CYS CA C -3.118 0.719 -0.266 1.00 . A A . 15 CYS CA 1 1 16 9785 1 1 15 CYS CB C -2.060 1.702 -0.771 1.00 . A A . 15 CYS CB 1 1 16 9786 1 1 15 CYS H H -3.103 -0.167 -2.188 1.00 . A A . 15 CYS H 1 1 16 9787 1 1 15 CYS HA H -2.761 0.253 0.640 1.00 . A A . 15 CYS HA 1 1 16 9788 1 1 15 CYS HB2 H -1.322 1.160 -1.345 1.00 . A A . 15 CYS HB2 1 1 16 9789 1 1 15 CYS HB3 H -2.534 2.435 -1.405 1.00 . A A . 15 CYS HB3 1 1 16 9790 1 1 15 CYS N N -3.345 -0.331 -1.251 1.00 . A A . 15 CYS N 1 1 16 9791 1 1 15 CYS O O -4.928 2.209 -0.791 1.00 . A A . 15 CYS O 1 1 16 9792 1 1 15 CYS SG S -1.183 2.595 0.553 1.00 . A A . 15 CYS SG 1 1 16 9793 1 1 16 ALA C C -5.956 3.409 1.870 1.00 . A A . 16 ALA C 1 1 16 9794 1 1 16 ALA CA C -6.169 1.912 1.668 1.00 . A A . 16 ALA CA 1 1 16 9795 1 1 16 ALA CB C -6.694 1.275 2.946 1.00 . A A . 16 ALA CB 1 1 16 9796 1 1 16 ALA H H -4.479 0.654 1.869 1.00 . A A . 16 ALA H 1 1 16 9797 1 1 16 ALA HA H -6.906 1.765 0.892 1.00 . A A . 16 ALA HA 1 1 16 9798 1 1 16 ALA HB1 H -5.992 0.533 3.293 1.00 . A A . 16 ALA HB1 1 1 16 9799 1 1 16 ALA HB2 H -6.818 2.037 3.703 1.00 . A A . 16 ALA HB2 1 1 16 9800 1 1 16 ALA HB3 H -7.647 0.806 2.749 1.00 . A A . 16 ALA HB3 1 1 16 9801 1 1 16 ALA N N -4.935 1.259 1.248 1.00 . A A . 16 ALA N 1 1 16 9802 1 1 16 ALA O O -6.887 4.136 2.211 1.00 . A A . 16 ALA O 1 1 16 9803 1 1 17 GLU C C -4.577 6.027 0.505 1.00 . A A . 17 GLU C 1 1 16 9804 1 1 17 GLU CA C -4.390 5.271 1.817 1.00 . A A . 17 GLU CA 1 1 16 9805 1 1 17 GLU CB C -2.948 5.424 2.305 1.00 . A A . 17 GLU CB 1 1 16 9806 1 1 17 GLU CD C -3.684 6.229 4.584 1.00 . A A . 17 GLU CD 1 1 16 9807 1 1 17 GLU CG C -2.795 5.275 3.810 1.00 . A A . 17 GLU CG 1 1 16 9808 1 1 17 GLU H H -4.023 3.231 1.386 1.00 . A A . 17 GLU H 1 1 16 9809 1 1 17 GLU HA H -5.056 5.688 2.557 1.00 . A A . 17 GLU HA 1 1 16 9810 1 1 17 GLU HB2 H -2.336 4.674 1.826 1.00 . A A . 17 GLU HB2 1 1 16 9811 1 1 17 GLU HB3 H -2.588 6.403 2.024 1.00 . A A . 17 GLU HB3 1 1 16 9812 1 1 17 GLU HG2 H -3.053 4.263 4.086 1.00 . A A . 17 GLU HG2 1 1 16 9813 1 1 17 GLU HG3 H -1.767 5.469 4.075 1.00 . A A . 17 GLU HG3 1 1 16 9814 1 1 17 GLU N N -4.724 3.860 1.657 1.00 . A A . 17 GLU N 1 1 16 9815 1 1 17 GLU O O -5.426 6.913 0.401 1.00 . A A . 17 GLU O 1 1 16 9816 1 1 17 GLU OE1 O -3.609 7.449 4.329 1.00 . A A . 17 GLU OE1 1 1 16 9817 1 1 17 GLU OE2 O -4.456 5.755 5.444 1.00 . A A . 17 GLU OE2 1 1 16 9818 1 1 18 CYS C C -4.614 5.442 -2.795 1.00 . A A . 18 CYS C 1 1 16 9819 1 1 18 CYS CA C -3.853 6.314 -1.801 1.00 . A A . 18 CYS CA 1 1 16 9820 1 1 18 CYS CB C -2.448 6.604 -2.332 1.00 . A A . 18 CYS CB 1 1 16 9821 1 1 18 CYS H H -3.121 4.957 -0.352 1.00 . A A . 18 CYS H 1 1 16 9822 1 1 18 CYS HA H -4.383 7.247 -1.682 1.00 . A A . 18 CYS HA 1 1 16 9823 1 1 18 CYS HB2 H -2.527 7.052 -3.312 1.00 . A A . 18 CYS HB2 1 1 16 9824 1 1 18 CYS HB3 H -1.955 7.295 -1.665 1.00 . A A . 18 CYS HB3 1 1 16 9825 1 1 18 CYS N N -3.778 5.671 -0.496 1.00 . A A . 18 CYS N 1 1 16 9826 1 1 18 CYS O O -5.509 5.914 -3.494 1.00 . A A . 18 CYS O 1 1 16 9827 1 1 18 CYS SG S -1.391 5.128 -2.484 1.00 . A A . 18 CYS SG 1 1 16 9828 1 1 19 GLY C C -3.950 2.635 -4.764 1.00 . A A . 19 GLY C 1 1 16 9829 1 1 19 GLY CA C -4.910 3.245 -3.761 1.00 . A A . 19 GLY CA 1 1 16 9830 1 1 19 GLY H H -3.531 3.842 -2.269 1.00 . A A . 19 GLY H 1 1 16 9831 1 1 19 GLY HA2 H -5.366 2.452 -3.188 1.00 . A A . 19 GLY HA2 1 1 16 9832 1 1 19 GLY HA3 H -5.681 3.778 -4.298 1.00 . A A . 19 GLY HA3 1 1 16 9833 1 1 19 GLY N N -4.252 4.164 -2.851 1.00 . A A . 19 GLY N 1 1 16 9834 1 1 19 GLY O O -4.161 2.729 -5.973 1.00 . A A . 19 GLY O 1 1 16 9835 1 1 20 LYS C C -1.970 -0.139 -5.021 1.00 . A A . 20 LYS C 1 1 16 9836 1 1 20 LYS CA C -1.894 1.382 -5.121 1.00 . A A . 20 LYS CA 1 1 16 9837 1 1 20 LYS CB C -0.490 1.859 -4.741 1.00 . A A . 20 LYS CB 1 1 16 9838 1 1 20 LYS CD C 1.876 2.294 -5.463 1.00 . A A . 20 LYS CD 1 1 16 9839 1 1 20 LYS CE C 2.882 2.183 -6.599 1.00 . A A . 20 LYS CE 1 1 16 9840 1 1 20 LYS CG C 0.493 1.838 -5.898 1.00 . A A . 20 LYS CG 1 1 16 9841 1 1 20 LYS H H -2.777 1.968 -3.288 1.00 . A A . 20 LYS H 1 1 16 9842 1 1 20 LYS HA H -2.101 1.675 -6.139 1.00 . A A . 20 LYS HA 1 1 16 9843 1 1 20 LYS HB2 H -0.556 2.871 -4.369 1.00 . A A . 20 LYS HB2 1 1 16 9844 1 1 20 LYS HB3 H -0.106 1.221 -3.958 1.00 . A A . 20 LYS HB3 1 1 16 9845 1 1 20 LYS HD2 H 1.822 3.324 -5.144 1.00 . A A . 20 LYS HD2 1 1 16 9846 1 1 20 LYS HD3 H 2.206 1.677 -4.640 1.00 . A A . 20 LYS HD3 1 1 16 9847 1 1 20 LYS HE2 H 2.597 1.360 -7.236 1.00 . A A . 20 LYS HE2 1 1 16 9848 1 1 20 LYS HE3 H 2.864 3.101 -7.168 1.00 . A A . 20 LYS HE3 1 1 16 9849 1 1 20 LYS HG2 H 0.562 0.831 -6.282 1.00 . A A . 20 LYS HG2 1 1 16 9850 1 1 20 LYS HG3 H 0.134 2.498 -6.675 1.00 . A A . 20 LYS HG3 1 1 16 9851 1 1 20 LYS HZ1 H 4.489 2.632 -5.342 1.00 . A A . 20 LYS HZ1 1 1 16 9852 1 1 20 LYS HZ2 H 4.950 2.066 -6.868 1.00 . A A . 20 LYS HZ2 1 1 16 9853 1 1 20 LYS HZ3 H 4.348 0.988 -5.713 1.00 . A A . 20 LYS HZ3 1 1 16 9854 1 1 20 LYS N N -2.891 2.009 -4.262 1.00 . A A . 20 LYS N 1 1 16 9855 1 1 20 LYS NZ N 4.264 1.952 -6.095 1.00 . A A . 20 LYS NZ 1 1 16 9856 1 1 20 LYS O O -2.372 -0.683 -3.994 1.00 . A A . 20 LYS O 1 1 16 9857 1 1 21 ALA C C -0.223 -2.850 -5.813 1.00 . A A . 21 ALA C 1 1 16 9858 1 1 21 ALA CA C -1.600 -2.275 -6.127 1.00 . A A . 21 ALA CA 1 1 16 9859 1 1 21 ALA CB C -2.082 -2.766 -7.483 1.00 . A A . 21 ALA CB 1 1 16 9860 1 1 21 ALA H H -1.268 -0.327 -6.884 1.00 . A A . 21 ALA H 1 1 16 9861 1 1 21 ALA HA H -2.300 -2.615 -5.378 1.00 . A A . 21 ALA HA 1 1 16 9862 1 1 21 ALA HB1 H -2.066 -1.949 -8.188 1.00 . A A . 21 ALA HB1 1 1 16 9863 1 1 21 ALA HB2 H -1.432 -3.556 -7.831 1.00 . A A . 21 ALA HB2 1 1 16 9864 1 1 21 ALA HB3 H -3.090 -3.144 -7.391 1.00 . A A . 21 ALA HB3 1 1 16 9865 1 1 21 ALA N N -1.579 -0.818 -6.095 1.00 . A A . 21 ALA N 1 1 16 9866 1 1 21 ALA O O 0.799 -2.302 -6.226 1.00 . A A . 21 ALA O 1 1 16 9867 1 1 22 PHE C C 0.933 -6.123 -4.828 1.00 . A A . 22 PHE C 1 1 16 9868 1 1 22 PHE CA C 1.050 -4.606 -4.708 1.00 . A A . 22 PHE CA 1 1 16 9869 1 1 22 PHE CB C 1.442 -4.225 -3.279 1.00 . A A . 22 PHE CB 1 1 16 9870 1 1 22 PHE CD1 C 2.975 -2.239 -3.326 1.00 . A A . 22 PHE CD1 1 1 16 9871 1 1 22 PHE CD2 C 0.697 -1.898 -2.710 1.00 . A A . 22 PHE CD2 1 1 16 9872 1 1 22 PHE CE1 C 3.225 -0.889 -3.165 1.00 . A A . 22 PHE CE1 1 1 16 9873 1 1 22 PHE CE2 C 0.941 -0.547 -2.547 1.00 . A A . 22 PHE CE2 1 1 16 9874 1 1 22 PHE CG C 1.710 -2.758 -3.102 1.00 . A A . 22 PHE CG 1 1 16 9875 1 1 22 PHE CZ C 2.207 -0.042 -2.774 1.00 . A A . 22 PHE CZ 1 1 16 9876 1 1 22 PHE H H -1.050 -4.347 -4.778 1.00 . A A . 22 PHE H 1 1 16 9877 1 1 22 PHE HA H 1.814 -4.261 -5.386 1.00 . A A . 22 PHE HA 1 1 16 9878 1 1 22 PHE HB2 H 0.642 -4.499 -2.608 1.00 . A A . 22 PHE HB2 1 1 16 9879 1 1 22 PHE HB3 H 2.337 -4.763 -3.004 1.00 . A A . 22 PHE HB3 1 1 16 9880 1 1 22 PHE HD1 H 3.773 -2.901 -3.632 1.00 . A A . 22 PHE HD1 1 1 16 9881 1 1 22 PHE HD2 H -0.293 -2.291 -2.531 1.00 . A A . 22 PHE HD2 1 1 16 9882 1 1 22 PHE HE1 H 4.216 -0.498 -3.343 1.00 . A A . 22 PHE HE1 1 1 16 9883 1 1 22 PHE HE2 H 0.143 0.113 -2.241 1.00 . A A . 22 PHE HE2 1 1 16 9884 1 1 22 PHE HZ H 2.399 1.013 -2.647 1.00 . A A . 22 PHE HZ 1 1 16 9885 1 1 22 PHE N N -0.203 -3.957 -5.078 1.00 . A A . 22 PHE N 1 1 16 9886 1 1 22 PHE O O 0.062 -6.741 -4.215 1.00 . A A . 22 PHE O 1 1 16 9887 1 1 23 THR C C 2.214 -8.896 -4.552 1.00 . A A . 23 THR C 1 1 16 9888 1 1 23 THR CA C 1.813 -8.161 -5.825 1.00 . A A . 23 THR CA 1 1 16 9889 1 1 23 THR CB C 2.767 -8.571 -6.963 1.00 . A A . 23 THR CB 1 1 16 9890 1 1 23 THR CG2 C 4.176 -8.063 -6.698 1.00 . A A . 23 THR CG2 1 1 16 9891 1 1 23 THR H H 2.487 -6.171 -6.084 1.00 . A A . 23 THR H 1 1 16 9892 1 1 23 THR HA H 0.811 -8.456 -6.100 1.00 . A A . 23 THR HA 1 1 16 9893 1 1 23 THR HB H 2.411 -8.134 -7.886 1.00 . A A . 23 THR HB 1 1 16 9894 1 1 23 THR HG1 H 2.966 -10.396 -6.243 1.00 . A A . 23 THR HG1 1 1 16 9895 1 1 23 THR HG21 H 4.149 -7.321 -5.914 1.00 . A A . 23 THR HG21 1 1 16 9896 1 1 23 THR HG22 H 4.575 -7.620 -7.598 1.00 . A A . 23 THR HG22 1 1 16 9897 1 1 23 THR HG23 H 4.804 -8.887 -6.393 1.00 . A A . 23 THR HG23 1 1 16 9898 1 1 23 THR N N 1.817 -6.718 -5.623 1.00 . A A . 23 THR N 1 1 16 9899 1 1 23 THR O O 1.892 -10.071 -4.374 1.00 . A A . 23 THR O 1 1 16 9900 1 1 23 THR OG1 O 2.785 -9.996 -7.098 1.00 . A A . 23 THR OG1 1 1 16 9901 1 1 24 ASP C C 3.219 -7.786 -1.264 1.00 . A A . 24 ASP C 1 1 16 9902 1 1 24 ASP CA C 3.362 -8.784 -2.409 1.00 . A A . 24 ASP CA 1 1 16 9903 1 1 24 ASP CB C 4.816 -9.246 -2.521 1.00 . A A . 24 ASP CB 1 1 16 9904 1 1 24 ASP CG C 4.946 -10.583 -3.224 1.00 . A A . 24 ASP CG 1 1 16 9905 1 1 24 ASP H H 3.144 -7.265 -3.867 1.00 . A A . 24 ASP H 1 1 16 9906 1 1 24 ASP HA H 2.737 -9.640 -2.203 1.00 . A A . 24 ASP HA 1 1 16 9907 1 1 24 ASP HB2 H 5.378 -8.511 -3.078 1.00 . A A . 24 ASP HB2 1 1 16 9908 1 1 24 ASP HB3 H 5.235 -9.338 -1.530 1.00 . A A . 24 ASP HB3 1 1 16 9909 1 1 24 ASP N N 2.918 -8.198 -3.668 1.00 . A A . 24 ASP N 1 1 16 9910 1 1 24 ASP O O 3.724 -6.665 -1.338 1.00 . A A . 24 ASP O 1 1 16 9911 1 1 24 ASP OD1 O 4.493 -11.599 -2.657 1.00 . A A . 24 ASP OD1 1 1 16 9912 1 1 24 ASP OD2 O 5.500 -10.613 -4.343 1.00 . A A . 24 ASP OD2 1 1 16 9913 1 1 25 ARG C C 3.624 -6.686 1.388 1.00 . A A . 25 ARG C 1 1 16 9914 1 1 25 ARG CA C 2.317 -7.342 0.952 1.00 . A A . 25 ARG CA 1 1 16 9915 1 1 25 ARG CB C 1.728 -8.148 2.111 1.00 . A A . 25 ARG CB 1 1 16 9916 1 1 25 ARG CD C 1.828 -10.240 3.501 1.00 . A A . 25 ARG CD 1 1 16 9917 1 1 25 ARG CG C 2.546 -9.377 2.475 1.00 . A A . 25 ARG CG 1 1 16 9918 1 1 25 ARG CZ C 2.033 -12.551 4.313 1.00 . A A . 25 ARG CZ 1 1 16 9919 1 1 25 ARG H H 2.151 -9.105 -0.207 1.00 . A A . 25 ARG H 1 1 16 9920 1 1 25 ARG HA H 1.617 -6.570 0.670 1.00 . A A . 25 ARG HA 1 1 16 9921 1 1 25 ARG HB2 H 1.666 -7.513 2.982 1.00 . A A . 25 ARG HB2 1 1 16 9922 1 1 25 ARG HB3 H 0.735 -8.472 1.839 1.00 . A A . 25 ARG HB3 1 1 16 9923 1 1 25 ARG HD2 H 1.682 -9.661 4.400 1.00 . A A . 25 ARG HD2 1 1 16 9924 1 1 25 ARG HD3 H 0.868 -10.528 3.099 1.00 . A A . 25 ARG HD3 1 1 16 9925 1 1 25 ARG HE H 3.554 -11.425 3.683 1.00 . A A . 25 ARG HE 1 1 16 9926 1 1 25 ARG HG2 H 2.716 -9.962 1.584 1.00 . A A . 25 ARG HG2 1 1 16 9927 1 1 25 ARG HG3 H 3.493 -9.058 2.885 1.00 . A A . 25 ARG HG3 1 1 16 9928 1 1 25 ARG HH11 H 0.153 -11.813 4.315 1.00 . A A . 25 ARG HH11 1 1 16 9929 1 1 25 ARG HH12 H 0.311 -13.442 4.885 1.00 . A A . 25 ARG HH12 1 1 16 9930 1 1 25 ARG HH21 H 3.776 -13.568 4.431 1.00 . A A . 25 ARG HH21 1 1 16 9931 1 1 25 ARG HH22 H 2.373 -14.439 4.952 1.00 . A A . 25 ARG HH22 1 1 16 9932 1 1 25 ARG N N 2.528 -8.200 -0.207 1.00 . A A . 25 ARG N 1 1 16 9933 1 1 25 ARG NE N 2.586 -11.444 3.830 1.00 . A A . 25 ARG NE 1 1 16 9934 1 1 25 ARG NH1 N 0.725 -12.606 4.522 1.00 . A A . 25 ARG NH1 1 1 16 9935 1 1 25 ARG NH2 N 2.790 -13.606 4.588 1.00 . A A . 25 ARG NH2 1 1 16 9936 1 1 25 ARG O O 3.653 -5.504 1.733 1.00 . A A . 25 ARG O 1 1 16 9937 1 1 26 SER C C 6.296 -5.606 1.116 1.00 . A A . 26 SER C 1 1 16 9938 1 1 26 SER CA C 6.014 -6.956 1.767 1.00 . A A . 26 SER CA 1 1 16 9939 1 1 26 SER CB C 7.106 -7.958 1.387 1.00 . A A . 26 SER CB 1 1 16 9940 1 1 26 SER H H 4.617 -8.394 1.085 1.00 . A A . 26 SER H 1 1 16 9941 1 1 26 SER HA H 6.009 -6.831 2.840 1.00 . A A . 26 SER HA 1 1 16 9942 1 1 26 SER HB2 H 8.067 -7.569 1.687 1.00 . A A . 26 SER HB2 1 1 16 9943 1 1 26 SER HB3 H 6.923 -8.895 1.892 1.00 . A A . 26 SER HB3 1 1 16 9944 1 1 26 SER HG H 7.883 -8.728 -0.238 1.00 . A A . 26 SER HG 1 1 16 9945 1 1 26 SER N N 4.704 -7.460 1.370 1.00 . A A . 26 SER N 1 1 16 9946 1 1 26 SER O O 6.746 -4.669 1.774 1.00 . A A . 26 SER O 1 1 16 9947 1 1 26 SER OG O 7.122 -8.188 -0.011 1.00 . A A . 26 SER OG 1 1 16 9948 1 1 27 ASN C C 5.332 -3.172 -0.431 1.00 . A A . 27 ASN C 1 1 16 9949 1 1 27 ASN CA C 6.255 -4.281 -0.926 1.00 . A A . 27 ASN CA 1 1 16 9950 1 1 27 ASN CB C 6.035 -4.513 -2.422 1.00 . A A . 27 ASN CB 1 1 16 9951 1 1 27 ASN CG C 7.224 -5.184 -3.083 1.00 . A A . 27 ASN CG 1 1 16 9952 1 1 27 ASN H H 5.672 -6.297 -0.654 1.00 . A A . 27 ASN H 1 1 16 9953 1 1 27 ASN HA H 7.279 -3.979 -0.764 1.00 . A A . 27 ASN HA 1 1 16 9954 1 1 27 ASN HB2 H 5.169 -5.144 -2.558 1.00 . A A . 27 ASN HB2 1 1 16 9955 1 1 27 ASN HB3 H 5.865 -3.564 -2.907 1.00 . A A . 27 ASN HB3 1 1 16 9956 1 1 27 ASN HD21 H 6.009 -6.231 -4.259 1.00 . A A . 27 ASN HD21 1 1 16 9957 1 1 27 ASN HD22 H 7.699 -6.514 -4.482 1.00 . A A . 27 ASN HD22 1 1 16 9958 1 1 27 ASN N N 6.029 -5.515 -0.183 1.00 . A A . 27 ASN N 1 1 16 9959 1 1 27 ASN ND2 N 6.950 -6.065 -4.038 1.00 . A A . 27 ASN ND2 1 1 16 9960 1 1 27 ASN O O 5.755 -2.028 -0.254 1.00 . A A . 27 ASN O 1 1 16 9961 1 1 27 ASN OD1 O 8.374 -4.912 -2.740 1.00 . A A . 27 ASN OD1 1 1 16 9962 1 1 28 LEU C C 3.579 -1.842 1.524 1.00 . A A . 28 LEU C 1 1 16 9963 1 1 28 LEU CA C 3.084 -2.551 0.268 1.00 . A A . 28 LEU CA 1 1 16 9964 1 1 28 LEU CB C 1.753 -3.249 0.554 1.00 . A A . 28 LEU CB 1 1 16 9965 1 1 28 LEU CD1 C 0.241 -1.258 0.373 1.00 . A A . 28 LEU CD1 1 1 16 9966 1 1 28 LEU CD2 C -0.495 -3.270 1.663 1.00 . A A . 28 LEU CD2 1 1 16 9967 1 1 28 LEU CG C 0.692 -2.407 1.262 1.00 . A A . 28 LEU CG 1 1 16 9968 1 1 28 LEU H H 3.790 -4.443 -0.366 1.00 . A A . 28 LEU H 1 1 16 9969 1 1 28 LEU HA H 2.936 -1.818 -0.511 1.00 . A A . 28 LEU HA 1 1 16 9970 1 1 28 LEU HB2 H 1.341 -3.576 -0.388 1.00 . A A . 28 LEU HB2 1 1 16 9971 1 1 28 LEU HB3 H 1.959 -4.112 1.173 1.00 . A A . 28 LEU HB3 1 1 16 9972 1 1 28 LEU HD11 H 1.107 -0.766 -0.045 1.00 . A A . 28 LEU HD11 1 1 16 9973 1 1 28 LEU HD12 H -0.328 -0.551 0.958 1.00 . A A . 28 LEU HD12 1 1 16 9974 1 1 28 LEU HD13 H -0.376 -1.642 -0.426 1.00 . A A . 28 LEU HD13 1 1 16 9975 1 1 28 LEU HD21 H -1.373 -2.650 1.767 1.00 . A A . 28 LEU HD21 1 1 16 9976 1 1 28 LEU HD22 H -0.284 -3.757 2.603 1.00 . A A . 28 LEU HD22 1 1 16 9977 1 1 28 LEU HD23 H -0.670 -4.017 0.902 1.00 . A A . 28 LEU HD23 1 1 16 9978 1 1 28 LEU HG H 1.118 -1.984 2.162 1.00 . A A . 28 LEU HG 1 1 16 9979 1 1 28 LEU N N 4.068 -3.517 -0.208 1.00 . A A . 28 LEU N 1 1 16 9980 1 1 28 LEU O O 3.651 -0.613 1.568 1.00 . A A . 28 LEU O 1 1 16 9981 1 1 29 PHE C C 5.482 -1.010 3.546 1.00 . A A . 29 PHE C 1 1 16 9982 1 1 29 PHE CA C 4.413 -2.070 3.799 1.00 . A A . 29 PHE CA 1 1 16 9983 1 1 29 PHE CB C 4.981 -3.182 4.683 1.00 . A A . 29 PHE CB 1 1 16 9984 1 1 29 PHE CD1 C 3.063 -3.780 6.186 1.00 . A A . 29 PHE CD1 1 1 16 9985 1 1 29 PHE CD2 C 3.839 -5.416 4.634 1.00 . A A . 29 PHE CD2 1 1 16 9986 1 1 29 PHE CE1 C 2.103 -4.664 6.643 1.00 . A A . 29 PHE CE1 1 1 16 9987 1 1 29 PHE CE2 C 2.882 -6.303 5.087 1.00 . A A . 29 PHE CE2 1 1 16 9988 1 1 29 PHE CG C 3.940 -4.145 5.178 1.00 . A A . 29 PHE CG 1 1 16 9989 1 1 29 PHE CZ C 2.013 -5.928 6.093 1.00 . A A . 29 PHE CZ 1 1 16 9990 1 1 29 PHE H H 3.843 -3.596 2.446 1.00 . A A . 29 PHE H 1 1 16 9991 1 1 29 PHE HA H 3.579 -1.609 4.305 1.00 . A A . 29 PHE HA 1 1 16 9992 1 1 29 PHE HB2 H 5.711 -3.743 4.119 1.00 . A A . 29 PHE HB2 1 1 16 9993 1 1 29 PHE HB3 H 5.460 -2.738 5.543 1.00 . A A . 29 PHE HB3 1 1 16 9994 1 1 29 PHE HD1 H 3.133 -2.791 6.617 1.00 . A A . 29 PHE HD1 1 1 16 9995 1 1 29 PHE HD2 H 4.518 -5.711 3.848 1.00 . A A . 29 PHE HD2 1 1 16 9996 1 1 29 PHE HE1 H 1.426 -4.367 7.430 1.00 . A A . 29 PHE HE1 1 1 16 9997 1 1 29 PHE HE2 H 2.813 -7.291 4.655 1.00 . A A . 29 PHE HE2 1 1 16 9998 1 1 29 PHE HZ H 1.264 -6.619 6.448 1.00 . A A . 29 PHE HZ 1 1 16 9999 1 1 29 PHE N N 3.923 -2.623 2.542 1.00 . A A . 29 PHE N 1 1 16 10000 1 1 29 PHE O O 5.429 0.088 4.102 1.00 . A A . 29 PHE O 1 1 16 10001 1 1 30 THR C C 6.992 0.891 1.834 1.00 . A A . 30 THR C 1 1 16 10002 1 1 30 THR CA C 7.535 -0.427 2.377 1.00 . A A . 30 THR CA 1 1 16 10003 1 1 30 THR CB C 8.499 -1.037 1.342 1.00 . A A . 30 THR CB 1 1 16 10004 1 1 30 THR CG2 C 9.593 -0.047 0.972 1.00 . A A . 30 THR CG2 1 1 16 10005 1 1 30 THR H H 6.440 -2.236 2.292 1.00 . A A . 30 THR H 1 1 16 10006 1 1 30 THR HA H 8.090 -0.230 3.283 1.00 . A A . 30 THR HA 1 1 16 10007 1 1 30 THR HB H 7.938 -1.281 0.451 1.00 . A A . 30 THR HB 1 1 16 10008 1 1 30 THR HG1 H 9.903 -2.015 2.322 1.00 . A A . 30 THR HG1 1 1 16 10009 1 1 30 THR HG21 H 9.986 -0.293 -0.003 1.00 . A A . 30 THR HG21 1 1 16 10010 1 1 30 THR HG22 H 10.387 -0.098 1.703 1.00 . A A . 30 THR HG22 1 1 16 10011 1 1 30 THR HG23 H 9.184 0.952 0.954 1.00 . A A . 30 THR HG23 1 1 16 10012 1 1 30 THR N N 6.453 -1.347 2.703 1.00 . A A . 30 THR N 1 1 16 10013 1 1 30 THR O O 7.570 1.954 2.064 1.00 . A A . 30 THR O 1 1 16 10014 1 1 30 THR OG1 O 9.087 -2.233 1.866 1.00 . A A . 30 THR OG1 1 1 16 10015 1 1 31 HIS C C 4.517 2.800 1.609 1.00 . A A . 31 HIS C 1 1 16 10016 1 1 31 HIS CA C 5.256 2.002 0.539 1.00 . A A . 31 HIS CA 1 1 16 10017 1 1 31 HIS CB C 4.290 1.607 -0.578 1.00 . A A . 31 HIS CB 1 1 16 10018 1 1 31 HIS CD2 C 2.014 2.849 -0.494 1.00 . A A . 31 HIS CD2 1 1 16 10019 1 1 31 HIS CE1 C 2.495 4.492 -1.864 1.00 . A A . 31 HIS CE1 1 1 16 10020 1 1 31 HIS CG C 3.290 2.673 -0.910 1.00 . A A . 31 HIS CG 1 1 16 10021 1 1 31 HIS H H 5.465 -0.062 0.965 1.00 . A A . 31 HIS H 1 1 16 10022 1 1 31 HIS HA H 6.039 2.618 0.124 1.00 . A A . 31 HIS HA 1 1 16 10023 1 1 31 HIS HB2 H 4.854 1.392 -1.474 1.00 . A A . 31 HIS HB2 1 1 16 10024 1 1 31 HIS HB3 H 3.746 0.722 -0.280 1.00 . A A . 31 HIS HB3 1 1 16 10025 1 1 31 HIS HD1 H 4.408 3.870 -2.234 1.00 . A A . 31 HIS HD1 1 1 16 10026 1 1 31 HIS HD2 H 1.468 2.214 0.189 1.00 . A A . 31 HIS HD2 1 1 16 10027 1 1 31 HIS HE1 H 2.415 5.386 -2.464 1.00 . A A . 31 HIS HE1 1 1 16 10028 1 1 31 HIS N N 5.878 0.814 1.113 1.00 . A A . 31 HIS N 1 1 16 10029 1 1 31 HIS ND1 N 3.561 3.718 -1.767 1.00 . A A . 31 HIS ND1 1 1 16 10030 1 1 31 HIS NE2 N 1.542 3.987 -1.101 1.00 . A A . 31 HIS NE2 1 1 16 10031 1 1 31 HIS O O 4.723 4.005 1.749 1.00 . A A . 31 HIS O 1 1 16 10032 1 1 32 GLN C C 3.734 3.797 4.152 1.00 . A A . 32 GLN C 1 1 16 10033 1 1 32 GLN CA C 2.887 2.766 3.415 1.00 . A A . 32 GLN CA 1 1 16 10034 1 1 32 GLN CB C 2.358 1.723 4.401 1.00 . A A . 32 GLN CB 1 1 16 10035 1 1 32 GLN CD C -0.126 1.896 3.974 1.00 . A A . 32 GLN CD 1 1 16 10036 1 1 32 GLN CG C 1.104 1.011 3.920 1.00 . A A . 32 GLN CG 1 1 16 10037 1 1 32 GLN H H 3.537 1.160 2.198 1.00 . A A . 32 GLN H 1 1 16 10038 1 1 32 GLN HA H 2.050 3.269 2.954 1.00 . A A . 32 GLN HA 1 1 16 10039 1 1 32 GLN HB2 H 3.125 0.982 4.568 1.00 . A A . 32 GLN HB2 1 1 16 10040 1 1 32 GLN HB3 H 2.131 2.213 5.337 1.00 . A A . 32 GLN HB3 1 1 16 10041 1 1 32 GLN HE21 H -1.132 0.480 4.942 1.00 . A A . 32 GLN HE21 1 1 16 10042 1 1 32 GLN HE22 H -2.005 1.936 4.623 1.00 . A A . 32 GLN HE22 1 1 16 10043 1 1 32 GLN HG2 H 1.254 0.694 2.899 1.00 . A A . 32 GLN HG2 1 1 16 10044 1 1 32 GLN HG3 H 0.935 0.146 4.544 1.00 . A A . 32 GLN HG3 1 1 16 10045 1 1 32 GLN N N 3.657 2.119 2.359 1.00 . A A . 32 GLN N 1 1 16 10046 1 1 32 GLN NE2 N -1.196 1.386 4.573 1.00 . A A . 32 GLN NE2 1 1 16 10047 1 1 32 GLN O O 3.209 4.758 4.717 1.00 . A A . 32 GLN O 1 1 16 10048 1 1 32 GLN OE1 O -0.115 3.025 3.484 1.00 . A A . 32 GLN OE1 1 1 16 10049 1 1 33 LYS C C 5.686 5.950 4.414 1.00 . A A . 33 LYS C 1 1 16 10050 1 1 33 LYS CA C 5.968 4.505 4.812 1.00 . A A . 33 LYS CA 1 1 16 10051 1 1 33 LYS CB C 7.414 4.143 4.468 1.00 . A A . 33 LYS CB 1 1 16 10052 1 1 33 LYS CD C 9.436 2.836 5.188 1.00 . A A . 33 LYS CD 1 1 16 10053 1 1 33 LYS CE C 9.981 2.483 3.813 1.00 . A A . 33 LYS CE 1 1 16 10054 1 1 33 LYS CG C 7.917 2.902 5.184 1.00 . A A . 33 LYS CG 1 1 16 10055 1 1 33 LYS H H 5.405 2.809 3.677 1.00 . A A . 33 LYS H 1 1 16 10056 1 1 33 LYS HA H 5.823 4.402 5.876 1.00 . A A . 33 LYS HA 1 1 16 10057 1 1 33 LYS HB2 H 7.488 3.974 3.404 1.00 . A A . 33 LYS HB2 1 1 16 10058 1 1 33 LYS HB3 H 8.054 4.972 4.737 1.00 . A A . 33 LYS HB3 1 1 16 10059 1 1 33 LYS HD2 H 9.828 3.799 5.482 1.00 . A A . 33 LYS HD2 1 1 16 10060 1 1 33 LYS HD3 H 9.753 2.084 5.896 1.00 . A A . 33 LYS HD3 1 1 16 10061 1 1 33 LYS HE2 H 10.975 2.077 3.927 1.00 . A A . 33 LYS HE2 1 1 16 10062 1 1 33 LYS HE3 H 9.338 1.740 3.365 1.00 . A A . 33 LYS HE3 1 1 16 10063 1 1 33 LYS HG2 H 7.566 2.919 6.205 1.00 . A A . 33 LYS HG2 1 1 16 10064 1 1 33 LYS HG3 H 7.530 2.026 4.683 1.00 . A A . 33 LYS HG3 1 1 16 10065 1 1 33 LYS HZ1 H 11.023 4.017 2.850 1.00 . A A . 33 LYS HZ1 1 1 16 10066 1 1 33 LYS HZ2 H 9.444 4.434 3.295 1.00 . A A . 33 LYS HZ2 1 1 16 10067 1 1 33 LYS HZ3 H 9.709 3.421 1.966 1.00 . A A . 33 LYS HZ3 1 1 16 10068 1 1 33 LYS N N 5.046 3.593 4.144 1.00 . A A . 33 LYS N 1 1 16 10069 1 1 33 LYS NZ N 10.044 3.672 2.918 1.00 . A A . 33 LYS NZ 1 1 16 10070 1 1 33 LYS O O 5.583 6.830 5.269 1.00 . A A . 33 LYS O 1 1 16 10071 1 1 34 ILE C C 3.991 8.080 3.183 1.00 . A A . 34 ILE C 1 1 16 10072 1 1 34 ILE CA C 5.288 7.525 2.603 1.00 . A A . 34 ILE CA 1 1 16 10073 1 1 34 ILE CB C 5.195 7.534 1.066 1.00 . A A . 34 ILE CB 1 1 16 10074 1 1 34 ILE CD1 C 3.379 7.264 -0.697 1.00 . A A . 34 ILE CD1 1 1 16 10075 1 1 34 ILE CG1 C 3.962 6.756 0.603 1.00 . A A . 34 ILE CG1 1 1 16 10076 1 1 34 ILE CG2 C 6.459 6.948 0.455 1.00 . A A . 34 ILE CG2 1 1 16 10077 1 1 34 ILE H H 5.652 5.445 2.480 1.00 . A A . 34 ILE H 1 1 16 10078 1 1 34 ILE HA H 6.105 8.167 2.898 1.00 . A A . 34 ILE HA 1 1 16 10079 1 1 34 ILE HB H 5.108 8.559 0.739 1.00 . A A . 34 ILE HB 1 1 16 10080 1 1 34 ILE HD11 H 3.722 8.273 -0.875 1.00 . A A . 34 ILE HD11 1 1 16 10081 1 1 34 ILE HD12 H 3.700 6.628 -1.509 1.00 . A A . 34 ILE HD12 1 1 16 10082 1 1 34 ILE HD13 H 2.301 7.256 -0.637 1.00 . A A . 34 ILE HD13 1 1 16 10083 1 1 34 ILE HG12 H 4.229 5.720 0.464 1.00 . A A . 34 ILE HG12 1 1 16 10084 1 1 34 ILE HG13 H 3.195 6.826 1.361 1.00 . A A . 34 ILE HG13 1 1 16 10085 1 1 34 ILE HG21 H 6.386 6.979 -0.622 1.00 . A A . 34 ILE HG21 1 1 16 10086 1 1 34 ILE HG22 H 7.314 7.525 0.775 1.00 . A A . 34 ILE HG22 1 1 16 10087 1 1 34 ILE HG23 H 6.573 5.924 0.779 1.00 . A A . 34 ILE HG23 1 1 16 10088 1 1 34 ILE N N 5.560 6.187 3.113 1.00 . A A . 34 ILE N 1 1 16 10089 1 1 34 ILE O O 3.749 9.287 3.147 1.00 . A A . 34 ILE O 1 1 16 10090 1 1 35 HIS C C 2.021 7.766 5.819 1.00 . A A . 35 HIS C 1 1 16 10091 1 1 35 HIS CA C 1.888 7.593 4.309 1.00 . A A . 35 HIS CA 1 1 16 10092 1 1 35 HIS CB C 0.807 6.558 3.995 1.00 . A A . 35 HIS CB 1 1 16 10093 1 1 35 HIS CD2 C 0.530 5.592 1.604 1.00 . A A . 35 HIS CD2 1 1 16 10094 1 1 35 HIS CE1 C -0.490 7.301 0.684 1.00 . A A . 35 HIS CE1 1 1 16 10095 1 1 35 HIS CG C 0.391 6.544 2.556 1.00 . A A . 35 HIS CG 1 1 16 10096 1 1 35 HIS H H 3.409 6.244 3.717 1.00 . A A . 35 HIS H 1 1 16 10097 1 1 35 HIS HA H 1.605 8.539 3.874 1.00 . A A . 35 HIS HA 1 1 16 10098 1 1 35 HIS HB2 H 1.177 5.574 4.242 1.00 . A A . 35 HIS HB2 1 1 16 10099 1 1 35 HIS HB3 H -0.068 6.769 4.592 1.00 . A A . 35 HIS HB3 1 1 16 10100 1 1 35 HIS HD1 H -0.497 8.447 2.379 1.00 . A A . 35 HIS HD1 1 1 16 10101 1 1 35 HIS HD2 H 0.993 4.623 1.727 1.00 . A A . 35 HIS HD2 1 1 16 10102 1 1 35 HIS HE1 H -0.982 7.939 -0.036 1.00 . A A . 35 HIS HE1 1 1 16 10103 1 1 35 HIS N N 3.160 7.192 3.718 1.00 . A A . 35 HIS N 1 1 16 10104 1 1 35 HIS ND1 N -0.251 7.602 1.948 1.00 . A A . 35 HIS ND1 1 1 16 10105 1 1 35 HIS NE2 N -0.026 6.087 0.450 1.00 . A A . 35 HIS NE2 1 1 16 10106 1 1 35 HIS O O 2.027 8.887 6.328 1.00 . A A . 35 HIS O 1 1 16 10107 1 1 36 THR C C 3.302 7.694 8.421 1.00 . A A . 36 THR C 1 1 16 10108 1 1 36 THR CA C 2.256 6.676 7.982 1.00 . A A . 36 THR CA 1 1 16 10109 1 1 36 THR CB C 2.638 5.291 8.538 1.00 . A A . 36 THR CB 1 1 16 10110 1 1 36 THR CG2 C 3.978 4.836 7.981 1.00 . A A . 36 THR CG2 1 1 16 10111 1 1 36 THR H H 2.114 5.785 6.067 1.00 . A A . 36 THR H 1 1 16 10112 1 1 36 THR HA H 1.298 6.955 8.397 1.00 . A A . 36 THR HA 1 1 16 10113 1 1 36 THR HB H 1.881 4.579 8.242 1.00 . A A . 36 THR HB 1 1 16 10114 1 1 36 THR HG1 H 2.906 6.233 10.250 1.00 . A A . 36 THR HG1 1 1 16 10115 1 1 36 THR HG21 H 4.017 3.757 7.973 1.00 . A A . 36 THR HG21 1 1 16 10116 1 1 36 THR HG22 H 4.775 5.219 8.600 1.00 . A A . 36 THR HG22 1 1 16 10117 1 1 36 THR HG23 H 4.094 5.207 6.973 1.00 . A A . 36 THR HG23 1 1 16 10118 1 1 36 THR N N 2.125 6.648 6.531 1.00 . A A . 36 THR N 1 1 16 10119 1 1 36 THR O O 3.308 8.136 9.569 1.00 . A A . 36 THR O 1 1 16 10120 1 1 36 THR OG1 O 2.702 5.338 9.968 1.00 . A A . 36 THR OG1 1 1 16 10121 1 1 37 GLY C C 4.732 10.137 8.718 1.00 . A A . 37 GLY C 1 1 16 10122 1 1 37 GLY CA C 5.224 9.027 7.810 1.00 . A A . 37 GLY CA 1 1 16 10123 1 1 37 GLY H H 4.132 7.677 6.599 1.00 . A A . 37 GLY H 1 1 16 10124 1 1 37 GLY HA2 H 6.042 8.515 8.295 1.00 . A A . 37 GLY HA2 1 1 16 10125 1 1 37 GLY HA3 H 5.582 9.464 6.889 1.00 . A A . 37 GLY HA3 1 1 16 10126 1 1 37 GLY N N 4.186 8.063 7.499 1.00 . A A . 37 GLY N 1 1 16 10127 1 1 37 GLY O O 5.280 10.353 9.798 1.00 . A A . 37 GLY O 1 1 16 10128 1 1 38 GLU C C 2.199 11.408 10.145 1.00 . A A . 38 GLU C 1 1 16 10129 1 1 38 GLU CA C 3.131 11.938 9.059 1.00 . A A . 38 GLU CA 1 1 16 10130 1 1 38 GLU CB C 2.371 12.905 8.148 1.00 . A A . 38 GLU CB 1 1 16 10131 1 1 38 GLU CD C 0.760 13.083 6.211 1.00 . A A . 38 GLU CD 1 1 16 10132 1 1 38 GLU CG C 1.222 12.256 7.394 1.00 . A A . 38 GLU CG 1 1 16 10133 1 1 38 GLU H H 3.300 10.622 7.408 1.00 . A A . 38 GLU H 1 1 16 10134 1 1 38 GLU HA H 3.947 12.466 9.527 1.00 . A A . 38 GLU HA 1 1 16 10135 1 1 38 GLU HB2 H 1.973 13.709 8.749 1.00 . A A . 38 GLU HB2 1 1 16 10136 1 1 38 GLU HB3 H 3.061 13.315 7.425 1.00 . A A . 38 GLU HB3 1 1 16 10137 1 1 38 GLU HG2 H 1.544 11.290 7.035 1.00 . A A . 38 GLU HG2 1 1 16 10138 1 1 38 GLU HG3 H 0.391 12.128 8.072 1.00 . A A . 38 GLU HG3 1 1 16 10139 1 1 38 GLU N N 3.695 10.843 8.278 1.00 . A A . 38 GLU N 1 1 16 10140 1 1 38 GLU O O 1.135 10.861 9.855 1.00 . A A . 38 GLU O 1 1 16 10141 1 1 38 GLU OE1 O -0.016 14.038 6.421 1.00 . A A . 38 GLU OE1 1 1 16 10142 1 1 38 GLU OE2 O 1.175 12.774 5.074 1.00 . A A . 38 GLU OE2 1 1 16 10143 1 1 39 LYS C C 0.605 12.020 12.751 1.00 . A A . 39 LYS C 1 1 16 10144 1 1 39 LYS CA C 1.812 11.114 12.530 1.00 . A A . 39 LYS CA 1 1 16 10145 1 1 39 LYS CB C 2.668 11.070 13.798 1.00 . A A . 39 LYS CB 1 1 16 10146 1 1 39 LYS CD C 3.073 10.035 16.051 1.00 . A A . 39 LYS CD 1 1 16 10147 1 1 39 LYS CE C 2.578 9.027 17.076 1.00 . A A . 39 LYS CE 1 1 16 10148 1 1 39 LYS CG C 2.131 10.129 14.862 1.00 . A A . 39 LYS CG 1 1 16 10149 1 1 39 LYS H H 3.466 12.018 11.567 1.00 . A A . 39 LYS H 1 1 16 10150 1 1 39 LYS HA H 1.462 10.118 12.307 1.00 . A A . 39 LYS HA 1 1 16 10151 1 1 39 LYS HB2 H 3.665 10.750 13.534 1.00 . A A . 39 LYS HB2 1 1 16 10152 1 1 39 LYS HB3 H 2.718 12.065 14.219 1.00 . A A . 39 LYS HB3 1 1 16 10153 1 1 39 LYS HD2 H 4.048 9.727 15.702 1.00 . A A . 39 LYS HD2 1 1 16 10154 1 1 39 LYS HD3 H 3.146 11.006 16.519 1.00 . A A . 39 LYS HD3 1 1 16 10155 1 1 39 LYS HE2 H 1.509 9.133 17.178 1.00 . A A . 39 LYS HE2 1 1 16 10156 1 1 39 LYS HE3 H 2.810 8.032 16.725 1.00 . A A . 39 LYS HE3 1 1 16 10157 1 1 39 LYS HG2 H 1.174 10.495 15.204 1.00 . A A . 39 LYS HG2 1 1 16 10158 1 1 39 LYS HG3 H 2.009 9.145 14.432 1.00 . A A . 39 LYS HG3 1 1 16 10159 1 1 39 LYS HZ1 H 2.907 10.138 18.815 1.00 . A A . 39 LYS HZ1 1 1 16 10160 1 1 39 LYS HZ2 H 4.250 9.241 18.310 1.00 . A A . 39 LYS HZ2 1 1 16 10161 1 1 39 LYS HZ3 H 2.945 8.464 19.054 1.00 . A A . 39 LYS HZ3 1 1 16 10162 1 1 39 LYS N N 2.608 11.574 11.399 1.00 . A A . 39 LYS N 1 1 16 10163 1 1 39 LYS NZ N 3.214 9.232 18.407 1.00 . A A . 39 LYS NZ 1 1 16 10164 1 1 39 LYS O O 0.689 13.244 12.642 1.00 . A A . 39 LYS O 1 1 16 10165 1 1 40 PRO C C -1.747 12.945 14.608 1.00 . A A . 40 PRO C 1 1 16 10166 1 1 40 PRO CA C -1.792 12.142 13.312 1.00 . A A . 40 PRO CA 1 1 16 10167 1 1 40 PRO CB C -2.843 11.034 13.406 1.00 . A A . 40 PRO CB 1 1 16 10168 1 1 40 PRO CD C -0.719 9.954 13.214 1.00 . A A . 40 PRO CD 1 1 16 10169 1 1 40 PRO CG C -2.083 9.826 13.834 1.00 . A A . 40 PRO CG 1 1 16 10170 1 1 40 PRO HA H -2.032 12.800 12.490 1.00 . A A . 40 PRO HA 1 1 16 10171 1 1 40 PRO HB2 H -3.594 11.307 14.134 1.00 . A A . 40 PRO HB2 1 1 16 10172 1 1 40 PRO HB3 H -3.305 10.888 12.441 1.00 . A A . 40 PRO HB3 1 1 16 10173 1 1 40 PRO HD2 H 0.033 9.539 13.869 1.00 . A A . 40 PRO HD2 1 1 16 10174 1 1 40 PRO HD3 H -0.695 9.465 12.251 1.00 . A A . 40 PRO HD3 1 1 16 10175 1 1 40 PRO HG2 H -2.006 9.803 14.910 1.00 . A A . 40 PRO HG2 1 1 16 10176 1 1 40 PRO HG3 H -2.577 8.935 13.472 1.00 . A A . 40 PRO HG3 1 1 16 10177 1 1 40 PRO N N -0.546 11.409 13.068 1.00 . A A . 40 PRO N 1 1 16 10178 1 1 40 PRO O O -2.201 12.480 15.653 1.00 . A A . 40 PRO O 1 1 16 10179 1 1 41 SER C C -2.473 15.463 16.174 1.00 . A A . 41 SER C 1 1 16 10180 1 1 41 SER CA C -1.092 15.020 15.699 1.00 . A A . 41 SER CA 1 1 16 10181 1 1 41 SER CB C -0.234 16.244 15.375 1.00 . A A . 41 SER CB 1 1 16 10182 1 1 41 SER H H -0.855 14.468 13.669 1.00 . A A . 41 SER H 1 1 16 10183 1 1 41 SER HA H -0.617 14.456 16.488 1.00 . A A . 41 SER HA 1 1 16 10184 1 1 41 SER HB2 H -0.201 16.895 16.236 1.00 . A A . 41 SER HB2 1 1 16 10185 1 1 41 SER HB3 H 0.767 15.923 15.128 1.00 . A A . 41 SER HB3 1 1 16 10186 1 1 41 SER HG H -0.678 16.443 13.478 1.00 . A A . 41 SER HG 1 1 16 10187 1 1 41 SER N N -1.199 14.153 14.531 1.00 . A A . 41 SER N 1 1 16 10188 1 1 41 SER O O -3.362 15.732 15.368 1.00 . A A . 41 SER O 1 1 16 10189 1 1 41 SER OG O -0.768 16.965 14.278 1.00 . A A . 41 SER OG 1 1 16 10190 1 1 42 GLY C C -4.884 14.789 18.203 1.00 . A A . 42 GLY C 1 1 16 10191 1 1 42 GLY CA C -3.917 15.947 18.052 1.00 . A A . 42 GLY CA 1 1 16 10192 1 1 42 GLY H H -1.898 15.310 18.086 1.00 . A A . 42 GLY H 1 1 16 10193 1 1 42 GLY HA2 H -3.745 16.388 19.023 1.00 . A A . 42 GLY HA2 1 1 16 10194 1 1 42 GLY HA3 H -4.360 16.689 17.404 1.00 . A A . 42 GLY HA3 1 1 16 10195 1 1 42 GLY N N -2.643 15.536 17.491 1.00 . A A . 42 GLY N 1 1 16 10196 1 1 42 GLY O O -4.896 13.854 17.403 1.00 . A A . 42 GLY O 1 1 16 10197 1 1 43 PRO C C -7.839 13.783 18.508 1.00 . A A . 43 PRO C 1 1 16 10198 1 1 43 PRO CA C -6.708 13.798 19.531 1.00 . A A . 43 PRO CA 1 1 16 10199 1 1 43 PRO CB C -7.243 14.177 20.914 1.00 . A A . 43 PRO CB 1 1 16 10200 1 1 43 PRO CD C -5.760 15.928 20.247 1.00 . A A . 43 PRO CD 1 1 16 10201 1 1 43 PRO CG C -7.019 15.646 21.018 1.00 . A A . 43 PRO CG 1 1 16 10202 1 1 43 PRO HA H -6.251 12.821 19.575 1.00 . A A . 43 PRO HA 1 1 16 10203 1 1 43 PRO HB2 H -8.294 13.931 20.975 1.00 . A A . 43 PRO HB2 1 1 16 10204 1 1 43 PRO HB3 H -6.697 13.640 21.675 1.00 . A A . 43 PRO HB3 1 1 16 10205 1 1 43 PRO HD2 H -5.821 16.892 19.763 1.00 . A A . 43 PRO HD2 1 1 16 10206 1 1 43 PRO HD3 H -4.900 15.885 20.899 1.00 . A A . 43 PRO HD3 1 1 16 10207 1 1 43 PRO HG2 H -7.853 16.176 20.583 1.00 . A A . 43 PRO HG2 1 1 16 10208 1 1 43 PRO HG3 H -6.895 15.925 22.054 1.00 . A A . 43 PRO HG3 1 1 16 10209 1 1 43 PRO N N -5.718 14.843 19.252 1.00 . A A . 43 PRO N 1 1 16 10210 1 1 43 PRO O O -8.349 12.722 18.148 1.00 . A A . 43 PRO O 1 1 16 10211 1 1 44 SER C C -8.908 16.056 15.948 1.00 . A A . 44 SER C 1 1 16 10212 1 1 44 SER CA C -9.298 15.089 17.062 1.00 . A A . 44 SER CA 1 1 16 10213 1 1 44 SER CB C -10.584 15.566 17.740 1.00 . A A . 44 SER CB 1 1 16 10214 1 1 44 SER H H -7.779 15.777 18.367 1.00 . A A . 44 SER H 1 1 16 10215 1 1 44 SER HA H -9.468 14.113 16.633 1.00 . A A . 44 SER HA 1 1 16 10216 1 1 44 SER HB2 H -11.361 15.673 16.998 1.00 . A A . 44 SER HB2 1 1 16 10217 1 1 44 SER HB3 H -10.889 14.839 18.478 1.00 . A A . 44 SER HB3 1 1 16 10218 1 1 44 SER HG H -9.686 17.295 17.940 1.00 . A A . 44 SER HG 1 1 16 10219 1 1 44 SER N N -8.225 14.967 18.042 1.00 . A A . 44 SER N 1 1 16 10220 1 1 44 SER O O -8.502 17.188 16.207 1.00 . A A . 44 SER O 1 1 16 10221 1 1 44 SER OG O -10.390 16.815 18.381 1.00 . A A . 44 SER OG 1 1 16 10222 1 1 45 SER C C -9.831 17.379 13.209 1.00 . A A . 45 SER C 1 1 16 10223 1 1 45 SER CA C -8.693 16.421 13.551 1.00 . A A . 45 SER CA 1 1 16 10224 1 1 45 SER CB C -8.377 15.536 12.344 1.00 . A A . 45 SER CB 1 1 16 10225 1 1 45 SER H H -9.365 14.687 14.564 1.00 . A A . 45 SER H 1 1 16 10226 1 1 45 SER HA H -7.816 16.998 13.803 1.00 . A A . 45 SER HA 1 1 16 10227 1 1 45 SER HB2 H -7.629 14.808 12.620 1.00 . A A . 45 SER HB2 1 1 16 10228 1 1 45 SER HB3 H -9.277 15.025 12.030 1.00 . A A . 45 SER HB3 1 1 16 10229 1 1 45 SER HG H -7.134 15.861 10.866 1.00 . A A . 45 SER HG 1 1 16 10230 1 1 45 SER N N -9.035 15.599 14.706 1.00 . A A . 45 SER N 1 1 16 10231 1 1 45 SER O O -9.631 18.589 13.111 1.00 . A A . 45 SER O 1 1 16 10232 1 1 45 SER OG O -7.887 16.306 11.261 1.00 . A A . 45 SER OG 1 1 16 10233 1 1 46 GLY C C -12.704 17.373 11.304 1.00 . A A . 46 GLY C 1 1 16 10234 1 1 46 GLY CA C -12.180 17.645 12.700 1.00 . A A . 46 GLY CA 1 1 16 10235 1 1 46 GLY H H -11.127 15.856 13.120 1.00 . A A . 46 GLY H 1 1 16 10236 1 1 46 GLY HA2 H -12.965 17.445 13.414 1.00 . A A . 46 GLY HA2 1 1 16 10237 1 1 46 GLY HA3 H -11.899 18.686 12.770 1.00 . A A . 46 GLY HA3 1 1 16 10238 1 1 46 GLY N N -11.027 16.827 13.029 1.00 . A A . 46 GLY N 1 1 16 10239 1 1 46 GLY O O -12.614 16.237 10.841 1.00 . A A . 46 GLY O 1 1 16 10240 2 2 1 ZN ZN ZN -0.324 4.454 -0.554 1.00 . B A . 201 ZN ZN 1 1 17 10241 1 1 1 GLY C C -15.715 10.674 -15.241 1.00 . A A . 1 GLY C 1 1 17 10242 1 1 1 GLY CA C -17.051 11.209 -15.716 1.00 . A A . 1 GLY CA 1 1 17 10243 1 1 1 GLY H1 H -16.155 12.914 -16.597 1.00 . A A . 1 GLY H1 1 1 17 10244 1 1 1 GLY HA2 H -17.762 11.144 -14.906 1.00 . A A . 1 GLY HA2 1 1 17 10245 1 1 1 GLY HA3 H -17.399 10.598 -16.537 1.00 . A A . 1 GLY HA3 1 1 17 10246 1 1 1 GLY N N -16.971 12.588 -16.161 1.00 . A A . 1 GLY N 1 1 17 10247 1 1 1 GLY O O -14.665 11.225 -15.572 1.00 . A A . 1 GLY O 1 1 17 10248 1 1 2 SER C C -14.790 7.553 -13.498 1.00 . A A . 2 SER C 1 1 17 10249 1 1 2 SER CA C -14.536 8.992 -13.935 1.00 . A A . 2 SER CA 1 1 17 10250 1 1 2 SER CB C -14.003 9.808 -12.755 1.00 . A A . 2 SER CB 1 1 17 10251 1 1 2 SER H H -16.621 9.205 -14.232 1.00 . A A . 2 SER H 1 1 17 10252 1 1 2 SER HA H -13.798 8.992 -14.723 1.00 . A A . 2 SER HA 1 1 17 10253 1 1 2 SER HB2 H -14.817 10.042 -12.086 1.00 . A A . 2 SER HB2 1 1 17 10254 1 1 2 SER HB3 H -13.258 9.229 -12.228 1.00 . A A . 2 SER HB3 1 1 17 10255 1 1 2 SER HG H -13.429 11.661 -12.485 1.00 . A A . 2 SER HG 1 1 17 10256 1 1 2 SER N N -15.753 9.598 -14.461 1.00 . A A . 2 SER N 1 1 17 10257 1 1 2 SER O O -15.872 7.222 -13.011 1.00 . A A . 2 SER O 1 1 17 10258 1 1 2 SER OG O -13.413 11.018 -13.198 1.00 . A A . 2 SER OG 1 1 17 10259 1 1 3 SER C C -12.687 4.844 -12.500 1.00 . A A . 3 SER C 1 1 17 10260 1 1 3 SER CA C -13.902 5.295 -13.306 1.00 . A A . 3 SER CA 1 1 17 10261 1 1 3 SER CB C -14.050 4.425 -14.556 1.00 . A A . 3 SER CB 1 1 17 10262 1 1 3 SER H H -12.949 7.024 -14.071 1.00 . A A . 3 SER H 1 1 17 10263 1 1 3 SER HA H -14.786 5.185 -12.695 1.00 . A A . 3 SER HA 1 1 17 10264 1 1 3 SER HB2 H -13.225 4.619 -15.225 1.00 . A A . 3 SER HB2 1 1 17 10265 1 1 3 SER HB3 H -14.045 3.384 -14.270 1.00 . A A . 3 SER HB3 1 1 17 10266 1 1 3 SER HG H -15.172 4.479 -16.161 1.00 . A A . 3 SER HG 1 1 17 10267 1 1 3 SER N N -13.787 6.700 -13.677 1.00 . A A . 3 SER N 1 1 17 10268 1 1 3 SER O O -11.590 5.378 -12.659 1.00 . A A . 3 SER O 1 1 17 10269 1 1 3 SER OG O -15.262 4.707 -15.233 1.00 . A A . 3 SER OG 1 1 17 10270 1 1 4 GLY C C -12.009 1.903 -10.414 1.00 . A A . 4 GLY C 1 1 17 10271 1 1 4 GLY CA C -11.807 3.351 -10.815 1.00 . A A . 4 GLY CA 1 1 17 10272 1 1 4 GLY H H -13.789 3.469 -11.549 1.00 . A A . 4 GLY H 1 1 17 10273 1 1 4 GLY HA2 H -10.884 3.435 -11.369 1.00 . A A . 4 GLY HA2 1 1 17 10274 1 1 4 GLY HA3 H -11.734 3.952 -9.921 1.00 . A A . 4 GLY HA3 1 1 17 10275 1 1 4 GLY N N -12.893 3.857 -11.633 1.00 . A A . 4 GLY N 1 1 17 10276 1 1 4 GLY O O -11.102 1.082 -10.549 1.00 . A A . 4 GLY O 1 1 17 10277 1 1 5 SER C C -13.930 -0.631 -10.682 1.00 . A A . 5 SER C 1 1 17 10278 1 1 5 SER CA C -13.518 0.231 -9.492 1.00 . A A . 5 SER CA 1 1 17 10279 1 1 5 SER CB C -14.638 0.249 -8.449 1.00 . A A . 5 SER CB 1 1 17 10280 1 1 5 SER H H -13.884 2.288 -9.836 1.00 . A A . 5 SER H 1 1 17 10281 1 1 5 SER HA H -12.630 -0.192 -9.046 1.00 . A A . 5 SER HA 1 1 17 10282 1 1 5 SER HB2 H -14.531 1.124 -7.826 1.00 . A A . 5 SER HB2 1 1 17 10283 1 1 5 SER HB3 H -15.594 0.280 -8.953 1.00 . A A . 5 SER HB3 1 1 17 10284 1 1 5 SER HG H -13.698 -1.258 -7.623 1.00 . A A . 5 SER HG 1 1 17 10285 1 1 5 SER N N -13.202 1.589 -9.918 1.00 . A A . 5 SER N 1 1 17 10286 1 1 5 SER O O -15.117 -0.843 -10.927 1.00 . A A . 5 SER O 1 1 17 10287 1 1 5 SER OG O -14.591 -0.905 -7.629 1.00 . A A . 5 SER OG 1 1 17 10288 1 1 6 SER C C -11.916 -2.642 -13.058 1.00 . A A . 6 SER C 1 1 17 10289 1 1 6 SER CA C -13.197 -1.960 -12.584 1.00 . A A . 6 SER CA 1 1 17 10290 1 1 6 SER CB C -13.791 -1.122 -13.717 1.00 . A A . 6 SER CB 1 1 17 10291 1 1 6 SER H H -12.013 -0.920 -11.170 1.00 . A A . 6 SER H 1 1 17 10292 1 1 6 SER HA H -13.909 -2.719 -12.298 1.00 . A A . 6 SER HA 1 1 17 10293 1 1 6 SER HB2 H -14.444 -0.370 -13.301 1.00 . A A . 6 SER HB2 1 1 17 10294 1 1 6 SER HB3 H -12.992 -0.641 -14.263 1.00 . A A . 6 SER HB3 1 1 17 10295 1 1 6 SER HG H -15.353 -2.205 -14.192 1.00 . A A . 6 SER HG 1 1 17 10296 1 1 6 SER N N -12.939 -1.125 -11.417 1.00 . A A . 6 SER N 1 1 17 10297 1 1 6 SER O O -10.813 -2.159 -12.806 1.00 . A A . 6 SER O 1 1 17 10298 1 1 6 SER OG O -14.536 -1.929 -14.613 1.00 . A A . 6 SER OG 1 1 17 10299 1 1 7 GLY C C -11.100 -6.000 -14.143 1.00 . A A . 7 GLY C 1 1 17 10300 1 1 7 GLY CA C -10.922 -4.499 -14.245 1.00 . A A . 7 GLY CA 1 1 17 10301 1 1 7 GLY H H -12.977 -4.106 -13.917 1.00 . A A . 7 GLY H 1 1 17 10302 1 1 7 GLY HA2 H -10.763 -4.235 -15.280 1.00 . A A . 7 GLY HA2 1 1 17 10303 1 1 7 GLY HA3 H -10.052 -4.211 -13.673 1.00 . A A . 7 GLY HA3 1 1 17 10304 1 1 7 GLY N N -12.073 -3.768 -13.747 1.00 . A A . 7 GLY N 1 1 17 10305 1 1 7 GLY O O -11.997 -6.482 -13.450 1.00 . A A . 7 GLY O 1 1 17 10306 1 1 8 THR C C -8.955 -8.812 -14.495 1.00 . A A . 8 THR C 1 1 17 10307 1 1 8 THR CA C -10.312 -8.200 -14.824 1.00 . A A . 8 THR CA 1 1 17 10308 1 1 8 THR CB C -10.797 -8.752 -16.178 1.00 . A A . 8 THR CB 1 1 17 10309 1 1 8 THR CG2 C -12.279 -8.475 -16.377 1.00 . A A . 8 THR CG2 1 1 17 10310 1 1 8 THR H H -9.551 -6.303 -15.371 1.00 . A A . 8 THR H 1 1 17 10311 1 1 8 THR HA H -11.022 -8.494 -14.064 1.00 . A A . 8 THR HA 1 1 17 10312 1 1 8 THR HB H -10.641 -9.822 -16.190 1.00 . A A . 8 THR HB 1 1 17 10313 1 1 8 THR HG1 H -9.586 -8.845 -17.732 1.00 . A A . 8 THR HG1 1 1 17 10314 1 1 8 THR HG21 H -12.802 -8.629 -15.445 1.00 . A A . 8 THR HG21 1 1 17 10315 1 1 8 THR HG22 H -12.674 -9.145 -17.126 1.00 . A A . 8 THR HG22 1 1 17 10316 1 1 8 THR HG23 H -12.414 -7.453 -16.700 1.00 . A A . 8 THR HG23 1 1 17 10317 1 1 8 THR N N -10.244 -6.745 -14.837 1.00 . A A . 8 THR N 1 1 17 10318 1 1 8 THR O O -8.558 -9.818 -15.080 1.00 . A A . 8 THR O 1 1 17 10319 1 1 8 THR OG1 O -10.048 -8.159 -17.245 1.00 . A A . 8 THR OG1 1 1 17 10320 1 1 9 GLY C C -6.127 -7.661 -12.410 1.00 . A A . 9 GLY C 1 1 17 10321 1 1 9 GLY CA C -6.941 -8.695 -13.162 1.00 . A A . 9 GLY CA 1 1 17 10322 1 1 9 GLY H H -8.613 -7.397 -13.120 1.00 . A A . 9 GLY H 1 1 17 10323 1 1 9 GLY HA2 H -7.073 -9.562 -12.533 1.00 . A A . 9 GLY HA2 1 1 17 10324 1 1 9 GLY HA3 H -6.399 -8.986 -14.050 1.00 . A A . 9 GLY HA3 1 1 17 10325 1 1 9 GLY N N -8.247 -8.196 -13.553 1.00 . A A . 9 GLY N 1 1 17 10326 1 1 9 GLY O O -5.510 -6.786 -13.017 1.00 . A A . 9 GLY O 1 1 17 10327 1 1 10 GLU C C -4.627 -7.560 -9.147 1.00 . A A . 10 GLU C 1 1 17 10328 1 1 10 GLU CA C -5.384 -6.824 -10.249 1.00 . A A . 10 GLU CA 1 1 17 10329 1 1 10 GLU CB C -6.332 -5.795 -9.631 1.00 . A A . 10 GLU CB 1 1 17 10330 1 1 10 GLU CD C -7.658 -3.671 -9.970 1.00 . A A . 10 GLU CD 1 1 17 10331 1 1 10 GLU CG C -6.577 -4.584 -10.516 1.00 . A A . 10 GLU CG 1 1 17 10332 1 1 10 GLU H H -6.638 -8.480 -10.658 1.00 . A A . 10 GLU H 1 1 17 10333 1 1 10 GLU HA H -4.672 -6.311 -10.878 1.00 . A A . 10 GLU HA 1 1 17 10334 1 1 10 GLU HB2 H -7.282 -6.270 -9.435 1.00 . A A . 10 GLU HB2 1 1 17 10335 1 1 10 GLU HB3 H -5.912 -5.452 -8.697 1.00 . A A . 10 GLU HB3 1 1 17 10336 1 1 10 GLU HG2 H -5.659 -4.021 -10.596 1.00 . A A . 10 GLU HG2 1 1 17 10337 1 1 10 GLU HG3 H -6.875 -4.925 -11.496 1.00 . A A . 10 GLU HG3 1 1 17 10338 1 1 10 GLU N N -6.127 -7.760 -11.084 1.00 . A A . 10 GLU N 1 1 17 10339 1 1 10 GLU O O -4.864 -8.742 -8.898 1.00 . A A . 10 GLU O 1 1 17 10340 1 1 10 GLU OE1 O -8.769 -4.169 -9.692 1.00 . A A . 10 GLU OE1 1 1 17 10341 1 1 10 GLU OE2 O -7.393 -2.460 -9.820 1.00 . A A . 10 GLU OE2 1 1 17 10342 1 1 11 LYS C C -3.794 -7.756 -6.207 1.00 . A A . 11 LYS C 1 1 17 10343 1 1 11 LYS CA C -2.920 -7.436 -7.415 1.00 . A A . 11 LYS CA 1 1 17 10344 1 1 11 LYS CB C -1.796 -6.482 -7.007 1.00 . A A . 11 LYS CB 1 1 17 10345 1 1 11 LYS CD C -0.790 -5.730 -9.183 1.00 . A A . 11 LYS CD 1 1 17 10346 1 1 11 LYS CE C 0.532 -5.242 -9.755 1.00 . A A . 11 LYS CE 1 1 17 10347 1 1 11 LYS CG C -0.583 -6.546 -7.918 1.00 . A A . 11 LYS CG 1 1 17 10348 1 1 11 LYS H H -3.570 -5.914 -8.735 1.00 . A A . 11 LYS H 1 1 17 10349 1 1 11 LYS HA H -2.487 -8.354 -7.783 1.00 . A A . 11 LYS HA 1 1 17 10350 1 1 11 LYS HB2 H -2.176 -5.471 -7.019 1.00 . A A . 11 LYS HB2 1 1 17 10351 1 1 11 LYS HB3 H -1.480 -6.726 -6.003 1.00 . A A . 11 LYS HB3 1 1 17 10352 1 1 11 LYS HD2 H -1.284 -6.344 -9.921 1.00 . A A . 11 LYS HD2 1 1 17 10353 1 1 11 LYS HD3 H -1.410 -4.875 -8.951 1.00 . A A . 11 LYS HD3 1 1 17 10354 1 1 11 LYS HE2 H 0.772 -4.289 -9.308 1.00 . A A . 11 LYS HE2 1 1 17 10355 1 1 11 LYS HE3 H 1.301 -5.959 -9.510 1.00 . A A . 11 LYS HE3 1 1 17 10356 1 1 11 LYS HG2 H 0.275 -6.158 -7.389 1.00 . A A . 11 LYS HG2 1 1 17 10357 1 1 11 LYS HG3 H -0.403 -7.577 -8.191 1.00 . A A . 11 LYS HG3 1 1 17 10358 1 1 11 LYS HZ1 H 0.049 -4.163 -11.478 1.00 . A A . 11 LYS HZ1 1 1 17 10359 1 1 11 LYS HZ2 H -0.108 -5.839 -11.651 1.00 . A A . 11 LYS HZ2 1 1 17 10360 1 1 11 LYS HZ3 H 1.428 -5.131 -11.638 1.00 . A A . 11 LYS HZ3 1 1 17 10361 1 1 11 LYS N N -3.713 -6.853 -8.491 1.00 . A A . 11 LYS N 1 1 17 10362 1 1 11 LYS NZ N 0.471 -5.082 -11.234 1.00 . A A . 11 LYS NZ 1 1 17 10363 1 1 11 LYS O O -4.837 -7.140 -5.985 1.00 . A A . 11 LYS O 1 1 17 10364 1 1 12 PRO C C -4.044 -8.109 -3.101 1.00 . A A . 12 PRO C 1 1 17 10365 1 1 12 PRO CA C -4.088 -9.161 -4.204 1.00 . A A . 12 PRO CA 1 1 17 10366 1 1 12 PRO CB C -3.347 -10.427 -3.766 1.00 . A A . 12 PRO CB 1 1 17 10367 1 1 12 PRO CD C -2.126 -9.516 -5.609 1.00 . A A . 12 PRO CD 1 1 17 10368 1 1 12 PRO CG C -1.971 -10.270 -4.317 1.00 . A A . 12 PRO CG 1 1 17 10369 1 1 12 PRO HA H -5.117 -9.403 -4.428 1.00 . A A . 12 PRO HA 1 1 17 10370 1 1 12 PRO HB2 H -3.337 -10.486 -2.687 1.00 . A A . 12 PRO HB2 1 1 17 10371 1 1 12 PRO HB3 H -3.839 -11.296 -4.176 1.00 . A A . 12 PRO HB3 1 1 17 10372 1 1 12 PRO HD2 H -1.281 -8.862 -5.768 1.00 . A A . 12 PRO HD2 1 1 17 10373 1 1 12 PRO HD3 H -2.235 -10.202 -6.436 1.00 . A A . 12 PRO HD3 1 1 17 10374 1 1 12 PRO HG2 H -1.361 -9.709 -3.626 1.00 . A A . 12 PRO HG2 1 1 17 10375 1 1 12 PRO HG3 H -1.537 -11.241 -4.500 1.00 . A A . 12 PRO HG3 1 1 17 10376 1 1 12 PRO N N -3.361 -8.739 -5.405 1.00 . A A . 12 PRO N 1 1 17 10377 1 1 12 PRO O O -4.953 -8.024 -2.275 1.00 . A A . 12 PRO O 1 1 17 10378 1 1 13 TYR C C -3.162 -4.896 -2.669 1.00 . A A . 13 TYR C 1 1 17 10379 1 1 13 TYR CA C -2.820 -6.266 -2.090 1.00 . A A . 13 TYR CA 1 1 17 10380 1 1 13 TYR CB C -1.387 -6.262 -1.555 1.00 . A A . 13 TYR CB 1 1 17 10381 1 1 13 TYR CD1 C -1.361 -8.030 0.247 1.00 . A A . 13 TYR CD1 1 1 17 10382 1 1 13 TYR CD2 C -0.102 -8.428 -1.737 1.00 . A A . 13 TYR CD2 1 1 17 10383 1 1 13 TYR CE1 C -0.957 -9.250 0.755 1.00 . A A . 13 TYR CE1 1 1 17 10384 1 1 13 TYR CE2 C 0.306 -9.650 -1.239 1.00 . A A . 13 TYR CE2 1 1 17 10385 1 1 13 TYR CG C -0.942 -7.598 -1.005 1.00 . A A . 13 TYR CG 1 1 17 10386 1 1 13 TYR CZ C -0.124 -10.057 0.008 1.00 . A A . 13 TYR CZ 1 1 17 10387 1 1 13 TYR H H -2.291 -7.427 -3.778 1.00 . A A . 13 TYR H 1 1 17 10388 1 1 13 TYR HA H -3.497 -6.479 -1.275 1.00 . A A . 13 TYR HA 1 1 17 10389 1 1 13 TYR HB2 H -0.712 -5.992 -2.353 1.00 . A A . 13 TYR HB2 1 1 17 10390 1 1 13 TYR HB3 H -1.308 -5.533 -0.762 1.00 . A A . 13 TYR HB3 1 1 17 10391 1 1 13 TYR HD1 H -2.013 -7.396 0.830 1.00 . A A . 13 TYR HD1 1 1 17 10392 1 1 13 TYR HD2 H 0.233 -8.107 -2.713 1.00 . A A . 13 TYR HD2 1 1 17 10393 1 1 13 TYR HE1 H -1.293 -9.569 1.730 1.00 . A A . 13 TYR HE1 1 1 17 10394 1 1 13 TYR HE2 H 0.958 -10.282 -1.823 1.00 . A A . 13 TYR HE2 1 1 17 10395 1 1 13 TYR HH H 1.008 -11.140 1.121 1.00 . A A . 13 TYR HH 1 1 17 10396 1 1 13 TYR N N -2.983 -7.311 -3.093 1.00 . A A . 13 TYR N 1 1 17 10397 1 1 13 TYR O O -3.190 -4.714 -3.886 1.00 . A A . 13 TYR O 1 1 17 10398 1 1 13 TYR OH O 0.281 -11.273 0.508 1.00 . A A . 13 TYR OH 1 1 17 10399 1 1 14 ARG C C -3.700 -1.615 -1.031 1.00 . A A . 14 ARG C 1 1 17 10400 1 1 14 ARG CA C -3.763 -2.583 -2.209 1.00 . A A . 14 ARG CA 1 1 17 10401 1 1 14 ARG CB C -5.160 -2.557 -2.830 1.00 . A A . 14 ARG CB 1 1 17 10402 1 1 14 ARG CD C -6.332 -0.433 -2.175 1.00 . A A . 14 ARG CD 1 1 17 10403 1 1 14 ARG CG C -5.600 -1.174 -3.282 1.00 . A A . 14 ARG CG 1 1 17 10404 1 1 14 ARG CZ C -8.651 -0.231 -1.384 1.00 . A A . 14 ARG CZ 1 1 17 10405 1 1 14 ARG H H -3.383 -4.143 -0.830 1.00 . A A . 14 ARG H 1 1 17 10406 1 1 14 ARG HA H -3.042 -2.275 -2.951 1.00 . A A . 14 ARG HA 1 1 17 10407 1 1 14 ARG HB2 H -5.172 -3.213 -3.689 1.00 . A A . 14 ARG HB2 1 1 17 10408 1 1 14 ARG HB3 H -5.871 -2.917 -2.103 1.00 . A A . 14 ARG HB3 1 1 17 10409 1 1 14 ARG HD2 H -5.790 -0.567 -1.251 1.00 . A A . 14 ARG HD2 1 1 17 10410 1 1 14 ARG HD3 H -6.364 0.618 -2.424 1.00 . A A . 14 ARG HD3 1 1 17 10411 1 1 14 ARG HE H -7.912 -1.807 -2.357 1.00 . A A . 14 ARG HE 1 1 17 10412 1 1 14 ARG HG2 H -4.728 -0.604 -3.566 1.00 . A A . 14 ARG HG2 1 1 17 10413 1 1 14 ARG HG3 H -6.258 -1.276 -4.132 1.00 . A A . 14 ARG HG3 1 1 17 10414 1 1 14 ARG HH11 H -7.473 1.360 -0.979 1.00 . A A . 14 ARG HH11 1 1 17 10415 1 1 14 ARG HH12 H -9.110 1.489 -0.426 1.00 . A A . 14 ARG HH12 1 1 17 10416 1 1 14 ARG HH21 H -10.070 -1.649 -1.635 1.00 . A A . 14 ARG HH21 1 1 17 10417 1 1 14 ARG HH22 H -10.586 -0.223 -0.799 1.00 . A A . 14 ARG HH22 1 1 17 10418 1 1 14 ARG N N -3.421 -3.936 -1.787 1.00 . A A . 14 ARG N 1 1 17 10419 1 1 14 ARG NE N -7.697 -0.921 -1.999 1.00 . A A . 14 ARG NE 1 1 17 10420 1 1 14 ARG NH1 N -8.390 0.971 -0.888 1.00 . A A . 14 ARG NH1 1 1 17 10421 1 1 14 ARG NH2 N -9.869 -0.743 -1.263 1.00 . A A . 14 ARG NH2 1 1 17 10422 1 1 14 ARG O O -4.188 -1.913 0.059 1.00 . A A . 14 ARG O 1 1 17 10423 1 1 15 CYS C C -4.296 1.273 0.014 1.00 . A A . 15 CYS C 1 1 17 10424 1 1 15 CYS CA C -2.967 0.559 -0.218 1.00 . A A . 15 CYS CA 1 1 17 10425 1 1 15 CYS CB C -1.888 1.576 -0.597 1.00 . A A . 15 CYS CB 1 1 17 10426 1 1 15 CYS H H -2.725 -0.273 -2.149 1.00 . A A . 15 CYS H 1 1 17 10427 1 1 15 CYS HA H -2.676 0.062 0.695 1.00 . A A . 15 CYS HA 1 1 17 10428 1 1 15 CYS HB2 H -1.033 1.051 -0.996 1.00 . A A . 15 CYS HB2 1 1 17 10429 1 1 15 CYS HB3 H -2.281 2.241 -1.352 1.00 . A A . 15 CYS HB3 1 1 17 10430 1 1 15 CYS N N -3.095 -0.454 -1.259 1.00 . A A . 15 CYS N 1 1 17 10431 1 1 15 CYS O O -4.852 1.881 -0.900 1.00 . A A . 15 CYS O 1 1 17 10432 1 1 15 CYS SG S -1.308 2.598 0.795 1.00 . A A . 15 CYS SG 1 1 17 10433 1 1 16 ALA C C -5.867 3.325 1.843 1.00 . A A . 16 ALA C 1 1 17 10434 1 1 16 ALA CA C -6.059 1.833 1.594 1.00 . A A . 16 ALA CA 1 1 17 10435 1 1 16 ALA CB C -6.665 1.165 2.819 1.00 . A A . 16 ALA CB 1 1 17 10436 1 1 16 ALA H H -4.307 0.694 1.927 1.00 . A A . 16 ALA H 1 1 17 10437 1 1 16 ALA HA H -6.742 1.701 0.767 1.00 . A A . 16 ALA HA 1 1 17 10438 1 1 16 ALA HB1 H -6.223 0.189 2.953 1.00 . A A . 16 ALA HB1 1 1 17 10439 1 1 16 ALA HB2 H -6.470 1.772 3.692 1.00 . A A . 16 ALA HB2 1 1 17 10440 1 1 16 ALA HB3 H -7.731 1.062 2.682 1.00 . A A . 16 ALA HB3 1 1 17 10441 1 1 16 ALA N N -4.798 1.193 1.241 1.00 . A A . 16 ALA N 1 1 17 10442 1 1 16 ALA O O -6.819 4.038 2.158 1.00 . A A . 16 ALA O 1 1 17 10443 1 1 17 GLU C C -4.393 5.976 0.601 1.00 . A A . 17 GLU C 1 1 17 10444 1 1 17 GLU CA C -4.314 5.198 1.912 1.00 . A A . 17 GLU CA 1 1 17 10445 1 1 17 GLU CB C -2.919 5.345 2.523 1.00 . A A . 17 GLU CB 1 1 17 10446 1 1 17 GLU CD C -3.285 5.694 4.997 1.00 . A A . 17 GLU CD 1 1 17 10447 1 1 17 GLU CG C -2.799 4.750 3.915 1.00 . A A . 17 GLU CG 1 1 17 10448 1 1 17 GLU H H -3.913 3.172 1.448 1.00 . A A . 17 GLU H 1 1 17 10449 1 1 17 GLU HA H -5.042 5.601 2.600 1.00 . A A . 17 GLU HA 1 1 17 10450 1 1 17 GLU HB2 H -2.204 4.853 1.880 1.00 . A A . 17 GLU HB2 1 1 17 10451 1 1 17 GLU HB3 H -2.674 6.395 2.580 1.00 . A A . 17 GLU HB3 1 1 17 10452 1 1 17 GLU HG2 H -3.386 3.845 3.959 1.00 . A A . 17 GLU HG2 1 1 17 10453 1 1 17 GLU HG3 H -1.761 4.513 4.103 1.00 . A A . 17 GLU HG3 1 1 17 10454 1 1 17 GLU N N -4.630 3.790 1.700 1.00 . A A . 17 GLU N 1 1 17 10455 1 1 17 GLU O O -5.038 7.021 0.524 1.00 . A A . 17 GLU O 1 1 17 10456 1 1 17 GLU OE1 O -3.351 6.913 4.736 1.00 . A A . 17 GLU OE1 1 1 17 10457 1 1 17 GLU OE2 O -3.599 5.214 6.106 1.00 . A A . 17 GLU OE2 1 1 17 10458 1 1 18 CYS C C -4.553 5.308 -2.738 1.00 . A A . 18 CYS C 1 1 17 10459 1 1 18 CYS CA C -3.722 6.103 -1.735 1.00 . A A . 18 CYS CA 1 1 17 10460 1 1 18 CYS CB C -2.287 6.248 -2.247 1.00 . A A . 18 CYS CB 1 1 17 10461 1 1 18 CYS H H -3.233 4.621 -0.304 1.00 . A A . 18 CYS H 1 1 17 10462 1 1 18 CYS HA H -4.156 7.084 -1.624 1.00 . A A . 18 CYS HA 1 1 17 10463 1 1 18 CYS HB2 H -2.311 6.602 -3.267 1.00 . A A . 18 CYS HB2 1 1 17 10464 1 1 18 CYS HB3 H -1.766 6.969 -1.634 1.00 . A A . 18 CYS HB3 1 1 17 10465 1 1 18 CYS N N -3.730 5.458 -0.427 1.00 . A A . 18 CYS N 1 1 17 10466 1 1 18 CYS O O -5.362 5.871 -3.475 1.00 . A A . 18 CYS O 1 1 17 10467 1 1 18 CYS SG S -1.328 4.700 -2.221 1.00 . A A . 18 CYS SG 1 1 17 10468 1 1 19 GLY C C -4.187 2.483 -4.703 1.00 . A A . 19 GLY C 1 1 17 10469 1 1 19 GLY CA C -5.085 3.144 -3.676 1.00 . A A . 19 GLY CA 1 1 17 10470 1 1 19 GLY H H -3.690 3.600 -2.150 1.00 . A A . 19 GLY H 1 1 17 10471 1 1 19 GLY HA2 H -5.591 2.377 -3.109 1.00 . A A . 19 GLY HA2 1 1 17 10472 1 1 19 GLY HA3 H -5.822 3.742 -4.191 1.00 . A A . 19 GLY HA3 1 1 17 10473 1 1 19 GLY N N -4.347 3.995 -2.760 1.00 . A A . 19 GLY N 1 1 17 10474 1 1 19 GLY O O -4.627 2.160 -5.807 1.00 . A A . 19 GLY O 1 1 17 10475 1 1 20 LYS C C -2.049 0.136 -5.158 1.00 . A A . 20 LYS C 1 1 17 10476 1 1 20 LYS CA C -1.961 1.657 -5.240 1.00 . A A . 20 LYS CA 1 1 17 10477 1 1 20 LYS CB C -0.542 2.115 -4.899 1.00 . A A . 20 LYS CB 1 1 17 10478 1 1 20 LYS CD C 1.815 2.490 -5.683 1.00 . A A . 20 LYS CD 1 1 17 10479 1 1 20 LYS CE C 2.810 2.190 -6.793 1.00 . A A . 20 LYS CE 1 1 17 10480 1 1 20 LYS CG C 0.398 2.125 -6.092 1.00 . A A . 20 LYS CG 1 1 17 10481 1 1 20 LYS H H -2.633 2.562 -3.448 1.00 . A A . 20 LYS H 1 1 17 10482 1 1 20 LYS HA H -2.198 1.965 -6.247 1.00 . A A . 20 LYS HA 1 1 17 10483 1 1 20 LYS HB2 H -0.587 3.116 -4.494 1.00 . A A . 20 LYS HB2 1 1 17 10484 1 1 20 LYS HB3 H -0.132 1.452 -4.150 1.00 . A A . 20 LYS HB3 1 1 17 10485 1 1 20 LYS HD2 H 1.854 3.545 -5.455 1.00 . A A . 20 LYS HD2 1 1 17 10486 1 1 20 LYS HD3 H 2.085 1.920 -4.805 1.00 . A A . 20 LYS HD3 1 1 17 10487 1 1 20 LYS HE2 H 2.770 1.136 -7.020 1.00 . A A . 20 LYS HE2 1 1 17 10488 1 1 20 LYS HE3 H 2.534 2.758 -7.670 1.00 . A A . 20 LYS HE3 1 1 17 10489 1 1 20 LYS HG2 H 0.406 1.143 -6.540 1.00 . A A . 20 LYS HG2 1 1 17 10490 1 1 20 LYS HG3 H 0.043 2.849 -6.812 1.00 . A A . 20 LYS HG3 1 1 17 10491 1 1 20 LYS HZ1 H 4.521 1.945 -5.619 1.00 . A A . 20 LYS HZ1 1 1 17 10492 1 1 20 LYS HZ2 H 4.242 3.543 -6.098 1.00 . A A . 20 LYS HZ2 1 1 17 10493 1 1 20 LYS HZ3 H 4.844 2.420 -7.210 1.00 . A A . 20 LYS HZ3 1 1 17 10494 1 1 20 LYS N N -2.925 2.283 -4.342 1.00 . A A . 20 LYS N 1 1 17 10495 1 1 20 LYS NZ N 4.202 2.550 -6.403 1.00 . A A . 20 LYS NZ 1 1 17 10496 1 1 20 LYS O O -2.533 -0.414 -4.169 1.00 . A A . 20 LYS O 1 1 17 10497 1 1 21 ALA C C -0.226 -2.573 -5.921 1.00 . A A . 21 ALA C 1 1 17 10498 1 1 21 ALA CA C -1.599 -1.993 -6.246 1.00 . A A . 21 ALA CA 1 1 17 10499 1 1 21 ALA CB C -2.066 -2.473 -7.612 1.00 . A A . 21 ALA CB 1 1 17 10500 1 1 21 ALA H H -1.203 -0.041 -6.961 1.00 . A A . 21 ALA H 1 1 17 10501 1 1 21 ALA HA H -2.309 -2.339 -5.508 1.00 . A A . 21 ALA HA 1 1 17 10502 1 1 21 ALA HB1 H -3.031 -2.043 -7.833 1.00 . A A . 21 ALA HB1 1 1 17 10503 1 1 21 ALA HB2 H -1.354 -2.167 -8.364 1.00 . A A . 21 ALA HB2 1 1 17 10504 1 1 21 ALA HB3 H -2.145 -3.550 -7.607 1.00 . A A . 21 ALA HB3 1 1 17 10505 1 1 21 ALA N N -1.577 -0.537 -6.202 1.00 . A A . 21 ALA N 1 1 17 10506 1 1 21 ALA O O 0.802 -1.994 -6.271 1.00 . A A . 21 ALA O 1 1 17 10507 1 1 22 PHE C C 0.896 -5.894 -4.978 1.00 . A A . 22 PHE C 1 1 17 10508 1 1 22 PHE CA C 1.029 -4.377 -4.874 1.00 . A A . 22 PHE CA 1 1 17 10509 1 1 22 PHE CB C 1.429 -3.985 -3.450 1.00 . A A . 22 PHE CB 1 1 17 10510 1 1 22 PHE CD1 C 2.971 -2.006 -3.495 1.00 . A A . 22 PHE CD1 1 1 17 10511 1 1 22 PHE CD2 C 0.684 -1.648 -2.922 1.00 . A A . 22 PHE CD2 1 1 17 10512 1 1 22 PHE CE1 C 3.223 -0.655 -3.346 1.00 . A A . 22 PHE CE1 1 1 17 10513 1 1 22 PHE CE2 C 0.931 -0.297 -2.771 1.00 . A A . 22 PHE CE2 1 1 17 10514 1 1 22 PHE CG C 1.700 -2.517 -3.286 1.00 . A A . 22 PHE CG 1 1 17 10515 1 1 22 PHE CZ C 2.202 0.200 -2.982 1.00 . A A . 22 PHE CZ 1 1 17 10516 1 1 22 PHE H H -1.071 -4.133 -4.997 1.00 . A A . 22 PHE H 1 1 17 10517 1 1 22 PHE HA H 1.795 -4.047 -5.558 1.00 . A A . 22 PHE HA 1 1 17 10518 1 1 22 PHE HB2 H 0.632 -4.253 -2.773 1.00 . A A . 22 PHE HB2 1 1 17 10519 1 1 22 PHE HB3 H 2.325 -4.522 -3.176 1.00 . A A . 22 PHE HB3 1 1 17 10520 1 1 22 PHE HD1 H 3.771 -2.675 -3.780 1.00 . A A . 22 PHE HD1 1 1 17 10521 1 1 22 PHE HD2 H -0.310 -2.035 -2.756 1.00 . A A . 22 PHE HD2 1 1 17 10522 1 1 22 PHE HE1 H 4.219 -0.270 -3.511 1.00 . A A . 22 PHE HE1 1 1 17 10523 1 1 22 PHE HE2 H 0.130 0.370 -2.487 1.00 . A A . 22 PHE HE2 1 1 17 10524 1 1 22 PHE HZ H 2.397 1.256 -2.865 1.00 . A A . 22 PHE HZ 1 1 17 10525 1 1 22 PHE N N -0.218 -3.720 -5.248 1.00 . A A . 22 PHE N 1 1 17 10526 1 1 22 PHE O O 0.003 -6.494 -4.380 1.00 . A A . 22 PHE O 1 1 17 10527 1 1 23 THR C C 2.145 -8.678 -4.639 1.00 . A A . 23 THR C 1 1 17 10528 1 1 23 THR CA C 1.776 -7.954 -5.929 1.00 . A A . 23 THR CA 1 1 17 10529 1 1 23 THR CB C 2.746 -8.389 -7.044 1.00 . A A . 23 THR CB 1 1 17 10530 1 1 23 THR CG2 C 4.175 -7.992 -6.704 1.00 . A A . 23 THR CG2 1 1 17 10531 1 1 23 THR H H 2.480 -5.976 -6.195 1.00 . A A . 23 THR H 1 1 17 10532 1 1 23 THR HA H 0.776 -8.242 -6.219 1.00 . A A . 23 THR HA 1 1 17 10533 1 1 23 THR HB H 2.460 -7.896 -7.962 1.00 . A A . 23 THR HB 1 1 17 10534 1 1 23 THR HG1 H 1.756 -10.065 -7.360 1.00 . A A . 23 THR HG1 1 1 17 10535 1 1 23 THR HG21 H 4.509 -8.553 -5.844 1.00 . A A . 23 THR HG21 1 1 17 10536 1 1 23 THR HG22 H 4.211 -6.936 -6.480 1.00 . A A . 23 THR HG22 1 1 17 10537 1 1 23 THR HG23 H 4.817 -8.204 -7.545 1.00 . A A . 23 THR HG23 1 1 17 10538 1 1 23 THR N N 1.793 -6.509 -5.744 1.00 . A A . 23 THR N 1 1 17 10539 1 1 23 THR O O 1.665 -9.781 -4.376 1.00 . A A . 23 THR O 1 1 17 10540 1 1 23 THR OG1 O 2.672 -9.807 -7.233 1.00 . A A . 23 THR OG1 1 1 17 10541 1 1 24 ASP C C 3.093 -7.714 -1.406 1.00 . A A . 24 ASP C 1 1 17 10542 1 1 24 ASP CA C 3.431 -8.635 -2.574 1.00 . A A . 24 ASP CA 1 1 17 10543 1 1 24 ASP CB C 4.935 -8.911 -2.602 1.00 . A A . 24 ASP CB 1 1 17 10544 1 1 24 ASP CG C 5.336 -10.033 -1.665 1.00 . A A . 24 ASP CG 1 1 17 10545 1 1 24 ASP H H 3.347 -7.173 -4.103 1.00 . A A . 24 ASP H 1 1 17 10546 1 1 24 ASP HA H 2.906 -9.569 -2.443 1.00 . A A . 24 ASP HA 1 1 17 10547 1 1 24 ASP HB2 H 5.225 -9.186 -3.606 1.00 . A A . 24 ASP HB2 1 1 17 10548 1 1 24 ASP HB3 H 5.465 -8.016 -2.311 1.00 . A A . 24 ASP HB3 1 1 17 10549 1 1 24 ASP N N 2.999 -8.051 -3.838 1.00 . A A . 24 ASP N 1 1 17 10550 1 1 24 ASP O O 3.028 -6.494 -1.563 1.00 . A A . 24 ASP O 1 1 17 10551 1 1 24 ASP OD1 O 4.618 -11.054 -1.621 1.00 . A A . 24 ASP OD1 1 1 17 10552 1 1 24 ASP OD2 O 6.367 -9.890 -0.974 1.00 . A A . 24 ASP OD2 1 1 17 10553 1 1 25 ARG C C 3.744 -6.724 1.435 1.00 . A A . 25 ARG C 1 1 17 10554 1 1 25 ARG CA C 2.544 -7.537 0.958 1.00 . A A . 25 ARG CA 1 1 17 10555 1 1 25 ARG CB C 2.070 -8.471 2.075 1.00 . A A . 25 ARG CB 1 1 17 10556 1 1 25 ARG CD C 1.485 -8.755 4.502 1.00 . A A . 25 ARG CD 1 1 17 10557 1 1 25 ARG CG C 1.858 -7.769 3.406 1.00 . A A . 25 ARG CG 1 1 17 10558 1 1 25 ARG CZ C 3.603 -9.206 5.666 1.00 . A A . 25 ARG CZ 1 1 17 10559 1 1 25 ARG H H 2.944 -9.281 -0.173 1.00 . A A . 25 ARG H 1 1 17 10560 1 1 25 ARG HA H 1.743 -6.860 0.704 1.00 . A A . 25 ARG HA 1 1 17 10561 1 1 25 ARG HB2 H 1.135 -8.923 1.778 1.00 . A A . 25 ARG HB2 1 1 17 10562 1 1 25 ARG HB3 H 2.807 -9.247 2.215 1.00 . A A . 25 ARG HB3 1 1 17 10563 1 1 25 ARG HD2 H 1.159 -8.201 5.370 1.00 . A A . 25 ARG HD2 1 1 17 10564 1 1 25 ARG HD3 H 0.677 -9.377 4.148 1.00 . A A . 25 ARG HD3 1 1 17 10565 1 1 25 ARG HE H 2.626 -10.520 4.526 1.00 . A A . 25 ARG HE 1 1 17 10566 1 1 25 ARG HG2 H 2.771 -7.264 3.686 1.00 . A A . 25 ARG HG2 1 1 17 10567 1 1 25 ARG HG3 H 1.063 -7.046 3.298 1.00 . A A . 25 ARG HG3 1 1 17 10568 1 1 25 ARG HH11 H 2.864 -7.346 5.937 1.00 . A A . 25 ARG HH11 1 1 17 10569 1 1 25 ARG HH12 H 4.357 -7.677 6.752 1.00 . A A . 25 ARG HH12 1 1 17 10570 1 1 25 ARG HH21 H 4.591 -10.969 5.594 1.00 . A A . 25 ARG HH21 1 1 17 10571 1 1 25 ARG HH22 H 5.338 -9.738 6.556 1.00 . A A . 25 ARG HH22 1 1 17 10572 1 1 25 ARG N N 2.878 -8.305 -0.235 1.00 . A A . 25 ARG N 1 1 17 10573 1 1 25 ARG NE N 2.610 -9.606 4.879 1.00 . A A . 25 ARG NE 1 1 17 10574 1 1 25 ARG NH1 N 3.609 -7.975 6.158 1.00 . A A . 25 ARG NH1 1 1 17 10575 1 1 25 ARG NH2 N 4.592 -10.040 5.963 1.00 . A A . 25 ARG NH2 1 1 17 10576 1 1 25 ARG O O 3.654 -5.508 1.604 1.00 . A A . 25 ARG O 1 1 17 10577 1 1 26 SER C C 6.269 -5.401 1.418 1.00 . A A . 26 SER C 1 1 17 10578 1 1 26 SER CA C 6.082 -6.746 2.113 1.00 . A A . 26 SER CA 1 1 17 10579 1 1 26 SER CB C 7.298 -7.639 1.858 1.00 . A A . 26 SER CB 1 1 17 10580 1 1 26 SER H H 4.873 -8.373 1.498 1.00 . A A . 26 SER H 1 1 17 10581 1 1 26 SER HA H 5.985 -6.579 3.175 1.00 . A A . 26 SER HA 1 1 17 10582 1 1 26 SER HB2 H 7.467 -7.716 0.794 1.00 . A A . 26 SER HB2 1 1 17 10583 1 1 26 SER HB3 H 8.166 -7.203 2.330 1.00 . A A . 26 SER HB3 1 1 17 10584 1 1 26 SER HG H 7.781 -9.135 3.026 1.00 . A A . 26 SER HG 1 1 17 10585 1 1 26 SER N N 4.865 -7.405 1.651 1.00 . A A . 26 SER N 1 1 17 10586 1 1 26 SER O O 6.526 -4.387 2.064 1.00 . A A . 26 SER O 1 1 17 10587 1 1 26 SER OG O 7.096 -8.939 2.384 1.00 . A A . 26 SER OG 1 1 17 10588 1 1 27 ASN C C 5.284 -3.124 -0.254 1.00 . A A . 27 ASN C 1 1 17 10589 1 1 27 ASN CA C 6.292 -4.183 -0.690 1.00 . A A . 27 ASN CA 1 1 17 10590 1 1 27 ASN CB C 6.120 -4.485 -2.180 1.00 . A A . 27 ASN CB 1 1 17 10591 1 1 27 ASN CG C 7.405 -4.971 -2.823 1.00 . A A . 27 ASN CG 1 1 17 10592 1 1 27 ASN H H 5.931 -6.243 -0.365 1.00 . A A . 27 ASN H 1 1 17 10593 1 1 27 ASN HA H 7.289 -3.805 -0.521 1.00 . A A . 27 ASN HA 1 1 17 10594 1 1 27 ASN HB2 H 5.368 -5.251 -2.301 1.00 . A A . 27 ASN HB2 1 1 17 10595 1 1 27 ASN HB3 H 5.801 -3.588 -2.689 1.00 . A A . 27 ASN HB3 1 1 17 10596 1 1 27 ASN HD21 H 7.088 -6.807 -2.126 1.00 . A A . 27 ASN HD21 1 1 17 10597 1 1 27 ASN HD22 H 8.529 -6.594 -3.055 1.00 . A A . 27 ASN HD22 1 1 17 10598 1 1 27 ASN N N 6.137 -5.403 0.095 1.00 . A A . 27 ASN N 1 1 17 10599 1 1 27 ASN ND2 N 7.704 -6.254 -2.651 1.00 . A A . 27 ASN ND2 1 1 17 10600 1 1 27 ASN O O 5.630 -1.955 -0.079 1.00 . A A . 27 ASN O 1 1 17 10601 1 1 27 ASN OD1 O 8.119 -4.203 -3.467 1.00 . A A . 27 ASN OD1 1 1 17 10602 1 1 28 LEU C C 3.339 -1.930 1.640 1.00 . A A . 28 LEU C 1 1 17 10603 1 1 28 LEU CA C 2.974 -2.629 0.335 1.00 . A A . 28 LEU CA 1 1 17 10604 1 1 28 LEU CB C 1.657 -3.389 0.501 1.00 . A A . 28 LEU CB 1 1 17 10605 1 1 28 LEU CD1 C 0.057 -1.460 0.505 1.00 . A A . 28 LEU CD1 1 1 17 10606 1 1 28 LEU CD2 C -0.588 -3.617 1.594 1.00 . A A . 28 LEU CD2 1 1 17 10607 1 1 28 LEU CG C 0.559 -2.667 1.282 1.00 . A A . 28 LEU CG 1 1 17 10608 1 1 28 LEU H H 3.819 -4.484 -0.235 1.00 . A A . 28 LEU H 1 1 17 10609 1 1 28 LEU HA H 2.856 -1.885 -0.438 1.00 . A A . 28 LEU HA 1 1 17 10610 1 1 28 LEU HB2 H 1.274 -3.606 -0.484 1.00 . A A . 28 LEU HB2 1 1 17 10611 1 1 28 LEU HB3 H 1.873 -4.316 1.013 1.00 . A A . 28 LEU HB3 1 1 17 10612 1 1 28 LEU HD11 H -0.224 -1.765 -0.491 1.00 . A A . 28 LEU HD11 1 1 17 10613 1 1 28 LEU HD12 H 0.840 -0.718 0.447 1.00 . A A . 28 LEU HD12 1 1 17 10614 1 1 28 LEU HD13 H -0.800 -1.038 1.009 1.00 . A A . 28 LEU HD13 1 1 17 10615 1 1 28 LEU HD21 H -0.525 -3.932 2.625 1.00 . A A . 28 LEU HD21 1 1 17 10616 1 1 28 LEU HD22 H -0.524 -4.481 0.949 1.00 . A A . 28 LEU HD22 1 1 17 10617 1 1 28 LEU HD23 H -1.529 -3.112 1.427 1.00 . A A . 28 LEU HD23 1 1 17 10618 1 1 28 LEU HG H 0.966 -2.313 2.220 1.00 . A A . 28 LEU HG 1 1 17 10619 1 1 28 LEU N N 4.034 -3.541 -0.081 1.00 . A A . 28 LEU N 1 1 17 10620 1 1 28 LEU O O 3.441 -0.704 1.692 1.00 . A A . 28 LEU O 1 1 17 10621 1 1 29 PHE C C 5.048 -1.184 3.880 1.00 . A A . 29 PHE C 1 1 17 10622 1 1 29 PHE CA C 3.891 -2.173 3.998 1.00 . A A . 29 PHE CA 1 1 17 10623 1 1 29 PHE CB C 4.267 -3.302 4.960 1.00 . A A . 29 PHE CB 1 1 17 10624 1 1 29 PHE CD1 C 2.252 -4.797 5.003 1.00 . A A . 29 PHE CD1 1 1 17 10625 1 1 29 PHE CD2 C 2.812 -3.592 6.983 1.00 . A A . 29 PHE CD2 1 1 17 10626 1 1 29 PHE CE1 C 1.165 -5.356 5.648 1.00 . A A . 29 PHE CE1 1 1 17 10627 1 1 29 PHE CE2 C 1.726 -4.148 7.633 1.00 . A A . 29 PHE CE2 1 1 17 10628 1 1 29 PHE CG C 3.087 -3.909 5.663 1.00 . A A . 29 PHE CG 1 1 17 10629 1 1 29 PHE CZ C 0.902 -5.032 6.965 1.00 . A A . 29 PHE CZ 1 1 17 10630 1 1 29 PHE H H 3.440 -3.687 2.589 1.00 . A A . 29 PHE H 1 1 17 10631 1 1 29 PHE HA H 3.028 -1.654 4.386 1.00 . A A . 29 PHE HA 1 1 17 10632 1 1 29 PHE HB2 H 4.762 -4.086 4.407 1.00 . A A . 29 PHE HB2 1 1 17 10633 1 1 29 PHE HB3 H 4.940 -2.917 5.711 1.00 . A A . 29 PHE HB3 1 1 17 10634 1 1 29 PHE HD1 H 2.456 -5.052 3.974 1.00 . A A . 29 PHE HD1 1 1 17 10635 1 1 29 PHE HD2 H 3.457 -2.901 7.508 1.00 . A A . 29 PHE HD2 1 1 17 10636 1 1 29 PHE HE1 H 0.522 -6.047 5.123 1.00 . A A . 29 PHE HE1 1 1 17 10637 1 1 29 PHE HE2 H 1.524 -3.893 8.663 1.00 . A A . 29 PHE HE2 1 1 17 10638 1 1 29 PHE HZ H 0.053 -5.467 7.470 1.00 . A A . 29 PHE HZ 1 1 17 10639 1 1 29 PHE N N 3.536 -2.717 2.693 1.00 . A A . 29 PHE N 1 1 17 10640 1 1 29 PHE O O 5.046 -0.129 4.515 1.00 . A A . 29 PHE O 1 1 17 10641 1 1 30 THR C C 6.807 0.638 2.202 1.00 . A A . 30 THR C 1 1 17 10642 1 1 30 THR CA C 7.199 -0.680 2.860 1.00 . A A . 30 THR CA 1 1 17 10643 1 1 30 THR CB C 8.264 -1.377 1.992 1.00 . A A . 30 THR CB 1 1 17 10644 1 1 30 THR CG2 C 9.447 -0.454 1.742 1.00 . A A . 30 THR CG2 1 1 17 10645 1 1 30 THR H H 5.979 -2.387 2.583 1.00 . A A . 30 THR H 1 1 17 10646 1 1 30 THR HA H 7.633 -0.473 3.828 1.00 . A A . 30 THR HA 1 1 17 10647 1 1 30 THR HB H 7.819 -1.633 1.041 1.00 . A A . 30 THR HB 1 1 17 10648 1 1 30 THR HG1 H 8.598 -2.490 3.585 1.00 . A A . 30 THR HG1 1 1 17 10649 1 1 30 THR HG21 H 9.988 -0.305 2.665 1.00 . A A . 30 THR HG21 1 1 17 10650 1 1 30 THR HG22 H 9.091 0.497 1.376 1.00 . A A . 30 THR HG22 1 1 17 10651 1 1 30 THR HG23 H 10.102 -0.900 1.009 1.00 . A A . 30 THR HG23 1 1 17 10652 1 1 30 THR N N 6.035 -1.534 3.062 1.00 . A A . 30 THR N 1 1 17 10653 1 1 30 THR O O 7.407 1.680 2.469 1.00 . A A . 30 THR O 1 1 17 10654 1 1 30 THR OG1 O 8.713 -2.574 2.636 1.00 . A A . 30 THR OG1 1 1 17 10655 1 1 31 HIS C C 4.541 2.685 1.592 1.00 . A A . 31 HIS C 1 1 17 10656 1 1 31 HIS CA C 5.322 1.778 0.646 1.00 . A A . 31 HIS CA 1 1 17 10657 1 1 31 HIS CB C 4.444 1.385 -0.543 1.00 . A A . 31 HIS CB 1 1 17 10658 1 1 31 HIS CD2 C 2.140 2.576 -0.524 1.00 . A A . 31 HIS CD2 1 1 17 10659 1 1 31 HIS CE1 C 2.616 4.217 -1.897 1.00 . A A . 31 HIS CE1 1 1 17 10660 1 1 31 HIS CG C 3.429 2.425 -0.908 1.00 . A A . 31 HIS CG 1 1 17 10661 1 1 31 HIS H H 5.357 -0.273 1.170 1.00 . A A . 31 HIS H 1 1 17 10662 1 1 31 HIS HA H 6.185 2.315 0.283 1.00 . A A . 31 HIS HA 1 1 17 10663 1 1 31 HIS HB2 H 5.073 1.219 -1.406 1.00 . A A . 31 HIS HB2 1 1 17 10664 1 1 31 HIS HB3 H 3.916 0.473 -0.307 1.00 . A A . 31 HIS HB3 1 1 17 10665 1 1 31 HIS HD1 H 4.551 3.635 -2.217 1.00 . A A . 31 HIS HD1 1 1 17 10666 1 1 31 HIS HD2 H 1.592 1.934 0.152 1.00 . A A . 31 HIS HD2 1 1 17 10667 1 1 31 HIS HE1 H 2.530 5.104 -2.508 1.00 . A A . 31 HIS HE1 1 1 17 10668 1 1 31 HIS N N 5.795 0.586 1.341 1.00 . A A . 31 HIS N 1 1 17 10669 1 1 31 HIS ND1 N 3.696 3.468 -1.769 1.00 . A A . 31 HIS ND1 1 1 17 10670 1 1 31 HIS NE2 N 1.657 3.697 -1.153 1.00 . A A . 31 HIS NE2 1 1 17 10671 1 1 31 HIS O O 4.779 3.891 1.647 1.00 . A A . 31 HIS O 1 1 17 10672 1 1 32 GLN C C 3.631 3.886 4.015 1.00 . A A . 32 GLN C 1 1 17 10673 1 1 32 GLN CA C 2.791 2.851 3.275 1.00 . A A . 32 GLN CA 1 1 17 10674 1 1 32 GLN CB C 2.124 1.907 4.277 1.00 . A A . 32 GLN CB 1 1 17 10675 1 1 32 GLN CD C 0.145 0.429 4.808 1.00 . A A . 32 GLN CD 1 1 17 10676 1 1 32 GLN CG C 0.820 1.309 3.774 1.00 . A A . 32 GLN CG 1 1 17 10677 1 1 32 GLN H H 3.465 1.131 2.243 1.00 . A A . 32 GLN H 1 1 17 10678 1 1 32 GLN HA H 2.025 3.364 2.713 1.00 . A A . 32 GLN HA 1 1 17 10679 1 1 32 GLN HB2 H 2.805 1.098 4.499 1.00 . A A . 32 GLN HB2 1 1 17 10680 1 1 32 GLN HB3 H 1.918 2.453 5.186 1.00 . A A . 32 GLN HB3 1 1 17 10681 1 1 32 GLN HE21 H -1.600 1.316 4.459 1.00 . A A . 32 GLN HE21 1 1 17 10682 1 1 32 GLN HE22 H -1.617 0.070 5.655 1.00 . A A . 32 GLN HE22 1 1 17 10683 1 1 32 GLN HG2 H 0.147 2.112 3.514 1.00 . A A . 32 GLN HG2 1 1 17 10684 1 1 32 GLN HG3 H 1.027 0.714 2.896 1.00 . A A . 32 GLN HG3 1 1 17 10685 1 1 32 GLN N N 3.607 2.096 2.333 1.00 . A A . 32 GLN N 1 1 17 10686 1 1 32 GLN NE2 N -1.155 0.625 4.994 1.00 . A A . 32 GLN NE2 1 1 17 10687 1 1 32 GLN O O 3.115 4.900 4.486 1.00 . A A . 32 GLN O 1 1 17 10688 1 1 32 GLN OE1 O 0.785 -0.417 5.433 1.00 . A A . 32 GLN OE1 1 1 17 10689 1 1 33 LYS C C 5.685 5.957 4.277 1.00 . A A . 33 LYS C 1 1 17 10690 1 1 33 LYS CA C 5.844 4.533 4.799 1.00 . A A . 33 LYS CA 1 1 17 10691 1 1 33 LYS CB C 7.290 4.069 4.613 1.00 . A A . 33 LYS CB 1 1 17 10692 1 1 33 LYS CD C 9.136 2.666 5.581 1.00 . A A . 33 LYS CD 1 1 17 10693 1 1 33 LYS CE C 9.789 2.100 4.330 1.00 . A A . 33 LYS CE 1 1 17 10694 1 1 33 LYS CG C 7.634 2.819 5.405 1.00 . A A . 33 LYS CG 1 1 17 10695 1 1 33 LYS H H 5.283 2.799 3.721 1.00 . A A . 33 LYS H 1 1 17 10696 1 1 33 LYS HA H 5.602 4.518 5.851 1.00 . A A . 33 LYS HA 1 1 17 10697 1 1 33 LYS HB2 H 7.458 3.864 3.566 1.00 . A A . 33 LYS HB2 1 1 17 10698 1 1 33 LYS HB3 H 7.953 4.862 4.927 1.00 . A A . 33 LYS HB3 1 1 17 10699 1 1 33 LYS HD2 H 9.565 3.635 5.791 1.00 . A A . 33 LYS HD2 1 1 17 10700 1 1 33 LYS HD3 H 9.326 1.999 6.410 1.00 . A A . 33 LYS HD3 1 1 17 10701 1 1 33 LYS HE2 H 9.112 1.394 3.874 1.00 . A A . 33 LYS HE2 1 1 17 10702 1 1 33 LYS HE3 H 9.982 2.910 3.643 1.00 . A A . 33 LYS HE3 1 1 17 10703 1 1 33 LYS HG2 H 7.173 2.882 6.379 1.00 . A A . 33 LYS HG2 1 1 17 10704 1 1 33 LYS HG3 H 7.253 1.955 4.879 1.00 . A A . 33 LYS HG3 1 1 17 10705 1 1 33 LYS HZ1 H 10.944 0.380 4.595 1.00 . A A . 33 LYS HZ1 1 1 17 10706 1 1 33 LYS HZ2 H 11.397 1.669 5.593 1.00 . A A . 33 LYS HZ2 1 1 17 10707 1 1 33 LYS HZ3 H 11.801 1.687 3.951 1.00 . A A . 33 LYS HZ3 1 1 17 10708 1 1 33 LYS N N 4.930 3.624 4.116 1.00 . A A . 33 LYS N 1 1 17 10709 1 1 33 LYS NZ N 11.073 1.410 4.639 1.00 . A A . 33 LYS NZ 1 1 17 10710 1 1 33 LYS O O 5.645 6.912 5.055 1.00 . A A . 33 LYS O 1 1 17 10711 1 1 34 ILE C C 4.284 8.176 2.965 1.00 . A A . 34 ILE C 1 1 17 10712 1 1 34 ILE CA C 5.436 7.401 2.335 1.00 . A A . 34 ILE CA 1 1 17 10713 1 1 34 ILE CB C 5.189 7.277 0.820 1.00 . A A . 34 ILE CB 1 1 17 10714 1 1 34 ILE CD1 C 3.183 7.080 -0.734 1.00 . A A . 34 ILE CD1 1 1 17 10715 1 1 34 ILE CG1 C 3.829 6.626 0.556 1.00 . A A . 34 ILE CG1 1 1 17 10716 1 1 34 ILE CG2 C 6.303 6.474 0.166 1.00 . A A . 34 ILE CG2 1 1 17 10717 1 1 34 ILE H H 5.632 5.295 2.392 1.00 . A A . 34 ILE H 1 1 17 10718 1 1 34 ILE HA H 6.352 7.954 2.486 1.00 . A A . 34 ILE HA 1 1 17 10719 1 1 34 ILE HB H 5.194 8.268 0.394 1.00 . A A . 34 ILE HB 1 1 17 10720 1 1 34 ILE HD11 H 2.128 6.844 -0.711 1.00 . A A . 34 ILE HD11 1 1 17 10721 1 1 34 ILE HD12 H 3.309 8.147 -0.845 1.00 . A A . 34 ILE HD12 1 1 17 10722 1 1 34 ILE HD13 H 3.646 6.573 -1.568 1.00 . A A . 34 ILE HD13 1 1 17 10723 1 1 34 ILE HG12 H 3.953 5.556 0.505 1.00 . A A . 34 ILE HG12 1 1 17 10724 1 1 34 ILE HG13 H 3.159 6.868 1.367 1.00 . A A . 34 ILE HG13 1 1 17 10725 1 1 34 ILE HG21 H 7.075 6.271 0.893 1.00 . A A . 34 ILE HG21 1 1 17 10726 1 1 34 ILE HG22 H 5.904 5.541 -0.204 1.00 . A A . 34 ILE HG22 1 1 17 10727 1 1 34 ILE HG23 H 6.719 7.038 -0.655 1.00 . A A . 34 ILE HG23 1 1 17 10728 1 1 34 ILE N N 5.593 6.093 2.959 1.00 . A A . 34 ILE N 1 1 17 10729 1 1 34 ILE O O 4.259 9.407 2.936 1.00 . A A . 34 ILE O 1 1 17 10730 1 1 35 HIS C C 2.509 8.494 5.603 1.00 . A A . 35 HIS C 1 1 17 10731 1 1 35 HIS CA C 2.175 8.065 4.178 1.00 . A A . 35 HIS CA 1 1 17 10732 1 1 35 HIS CB C 0.992 7.097 4.188 1.00 . A A . 35 HIS CB 1 1 17 10733 1 1 35 HIS CD2 C 0.825 5.914 1.886 1.00 . A A . 35 HIS CD2 1 1 17 10734 1 1 35 HIS CE1 C -0.889 7.018 1.081 1.00 . A A . 35 HIS CE1 1 1 17 10735 1 1 35 HIS CG C 0.442 6.810 2.825 1.00 . A A . 35 HIS CG 1 1 17 10736 1 1 35 HIS H H 3.406 6.470 3.529 1.00 . A A . 35 HIS H 1 1 17 10737 1 1 35 HIS HA H 1.908 8.941 3.605 1.00 . A A . 35 HIS HA 1 1 17 10738 1 1 35 HIS HB2 H 1.306 6.160 4.622 1.00 . A A . 35 HIS HB2 1 1 17 10739 1 1 35 HIS HB3 H 0.196 7.517 4.786 1.00 . A A . 35 HIS HB3 1 1 17 10740 1 1 35 HIS HD1 H -1.137 8.203 2.731 1.00 . A A . 35 HIS HD1 1 1 17 10741 1 1 35 HIS HD2 H 1.643 5.211 1.965 1.00 . A A . 35 HIS HD2 1 1 17 10742 1 1 35 HIS HE1 H -1.676 7.358 0.424 1.00 . A A . 35 HIS HE1 1 1 17 10743 1 1 35 HIS N N 3.331 7.447 3.537 1.00 . A A . 35 HIS N 1 1 17 10744 1 1 35 HIS ND1 N -0.634 7.487 2.290 1.00 . A A . 35 HIS ND1 1 1 17 10745 1 1 35 HIS NE2 N -0.017 6.063 0.812 1.00 . A A . 35 HIS NE2 1 1 17 10746 1 1 35 HIS O O 2.691 9.680 5.881 1.00 . A A . 35 HIS O 1 1 17 10747 1 1 36 THR C C 4.055 8.783 8.025 1.00 . A A . 36 THR C 1 1 17 10748 1 1 36 THR CA C 2.899 7.797 7.903 1.00 . A A . 36 THR CA 1 1 17 10749 1 1 36 THR CB C 3.256 6.507 8.665 1.00 . A A . 36 THR CB 1 1 17 10750 1 1 36 THR CG2 C 4.318 5.714 7.918 1.00 . A A . 36 THR CG2 1 1 17 10751 1 1 36 THR H H 2.434 6.595 6.223 1.00 . A A . 36 THR H 1 1 17 10752 1 1 36 THR HA H 2.020 8.229 8.360 1.00 . A A . 36 THR HA 1 1 17 10753 1 1 36 THR HB H 2.367 5.899 8.749 1.00 . A A . 36 THR HB 1 1 17 10754 1 1 36 THR HG1 H 4.498 7.399 9.910 1.00 . A A . 36 THR HG1 1 1 17 10755 1 1 36 THR HG21 H 3.989 5.538 6.905 1.00 . A A . 36 THR HG21 1 1 17 10756 1 1 36 THR HG22 H 4.476 4.768 8.414 1.00 . A A . 36 THR HG22 1 1 17 10757 1 1 36 THR HG23 H 5.242 6.273 7.904 1.00 . A A . 36 THR HG23 1 1 17 10758 1 1 36 THR N N 2.589 7.521 6.506 1.00 . A A . 36 THR N 1 1 17 10759 1 1 36 THR O O 4.135 9.544 8.988 1.00 . A A . 36 THR O 1 1 17 10760 1 1 36 THR OG1 O 3.729 6.828 9.978 1.00 . A A . 36 THR OG1 1 1 17 10761 1 1 37 GLY C C 7.085 9.314 8.147 1.00 . A A . 37 GLY C 1 1 17 10762 1 1 37 GLY CA C 6.090 9.661 7.058 1.00 . A A . 37 GLY CA 1 1 17 10763 1 1 37 GLY H H 4.834 8.135 6.298 1.00 . A A . 37 GLY H 1 1 17 10764 1 1 37 GLY HA2 H 6.587 9.612 6.101 1.00 . A A . 37 GLY HA2 1 1 17 10765 1 1 37 GLY HA3 H 5.737 10.670 7.217 1.00 . A A . 37 GLY HA3 1 1 17 10766 1 1 37 GLY N N 4.949 8.764 7.041 1.00 . A A . 37 GLY N 1 1 17 10767 1 1 37 GLY O O 6.828 9.547 9.328 1.00 . A A . 37 GLY O 1 1 17 10768 1 1 38 GLU C C 10.498 9.249 8.540 1.00 . A A . 38 GLU C 1 1 17 10769 1 1 38 GLU CA C 9.259 8.372 8.703 1.00 . A A . 38 GLU CA 1 1 17 10770 1 1 38 GLU CB C 9.635 6.900 8.519 1.00 . A A . 38 GLU CB 1 1 17 10771 1 1 38 GLU CD C 9.107 4.492 9.070 1.00 . A A . 38 GLU CD 1 1 17 10772 1 1 38 GLU CG C 8.795 5.949 9.354 1.00 . A A . 38 GLU CG 1 1 17 10773 1 1 38 GLU H H 8.370 8.594 6.794 1.00 . A A . 38 GLU H 1 1 17 10774 1 1 38 GLU HA H 8.863 8.511 9.697 1.00 . A A . 38 GLU HA 1 1 17 10775 1 1 38 GLU HB2 H 9.513 6.638 7.478 1.00 . A A . 38 GLU HB2 1 1 17 10776 1 1 38 GLU HB3 H 10.671 6.769 8.794 1.00 . A A . 38 GLU HB3 1 1 17 10777 1 1 38 GLU HG2 H 8.984 6.144 10.398 1.00 . A A . 38 GLU HG2 1 1 17 10778 1 1 38 GLU HG3 H 7.751 6.126 9.139 1.00 . A A . 38 GLU HG3 1 1 17 10779 1 1 38 GLU N N 8.224 8.754 7.750 1.00 . A A . 38 GLU N 1 1 17 10780 1 1 38 GLU O O 11.490 8.836 7.940 1.00 . A A . 38 GLU O 1 1 17 10781 1 1 38 GLU OE1 O 10.298 4.119 9.127 1.00 . A A . 38 GLU OE1 1 1 17 10782 1 1 38 GLU OE2 O 8.162 3.726 8.789 1.00 . A A . 38 GLU OE2 1 1 17 10783 1 1 39 LYS C C 11.590 12.302 10.224 1.00 . A A . 39 LYS C 1 1 17 10784 1 1 39 LYS CA C 11.546 11.398 8.997 1.00 . A A . 39 LYS CA 1 1 17 10785 1 1 39 LYS CB C 11.432 12.247 7.729 1.00 . A A . 39 LYS CB 1 1 17 10786 1 1 39 LYS CD C 10.970 12.190 5.260 1.00 . A A . 39 LYS CD 1 1 17 10787 1 1 39 LYS CE C 11.973 13.160 4.656 1.00 . A A . 39 LYS CE 1 1 17 10788 1 1 39 LYS CG C 11.560 11.444 6.445 1.00 . A A . 39 LYS CG 1 1 17 10789 1 1 39 LYS H H 9.613 10.733 9.546 1.00 . A A . 39 LYS H 1 1 17 10790 1 1 39 LYS HA H 12.459 10.824 8.955 1.00 . A A . 39 LYS HA 1 1 17 10791 1 1 39 LYS HB2 H 10.472 12.741 7.725 1.00 . A A . 39 LYS HB2 1 1 17 10792 1 1 39 LYS HB3 H 12.212 12.995 7.740 1.00 . A A . 39 LYS HB3 1 1 17 10793 1 1 39 LYS HD2 H 10.678 11.475 4.505 1.00 . A A . 39 LYS HD2 1 1 17 10794 1 1 39 LYS HD3 H 10.101 12.742 5.590 1.00 . A A . 39 LYS HD3 1 1 17 10795 1 1 39 LYS HE2 H 12.965 12.750 4.772 1.00 . A A . 39 LYS HE2 1 1 17 10796 1 1 39 LYS HE3 H 11.753 13.277 3.605 1.00 . A A . 39 LYS HE3 1 1 17 10797 1 1 39 LYS HG2 H 12.606 11.254 6.253 1.00 . A A . 39 LYS HG2 1 1 17 10798 1 1 39 LYS HG3 H 11.038 10.506 6.565 1.00 . A A . 39 LYS HG3 1 1 17 10799 1 1 39 LYS HZ1 H 11.508 14.408 6.265 1.00 . A A . 39 LYS HZ1 1 1 17 10800 1 1 39 LYS HZ2 H 11.336 15.146 4.752 1.00 . A A . 39 LYS HZ2 1 1 17 10801 1 1 39 LYS HZ3 H 12.878 14.890 5.398 1.00 . A A . 39 LYS HZ3 1 1 17 10802 1 1 39 LYS N N 10.432 10.461 9.079 1.00 . A A . 39 LYS N 1 1 17 10803 1 1 39 LYS NZ N 11.920 14.495 5.314 1.00 . A A . 39 LYS NZ 1 1 17 10804 1 1 39 LYS O O 10.561 12.745 10.735 1.00 . A A . 39 LYS O 1 1 17 10805 1 1 40 PRO C C 12.680 14.901 11.599 1.00 . A A . 40 PRO C 1 1 17 10806 1 1 40 PRO CA C 13.014 13.440 11.882 1.00 . A A . 40 PRO CA 1 1 17 10807 1 1 40 PRO CB C 14.507 13.280 12.179 1.00 . A A . 40 PRO CB 1 1 17 10808 1 1 40 PRO CD C 14.077 12.091 10.151 1.00 . A A . 40 PRO CD 1 1 17 10809 1 1 40 PRO CG C 15.116 12.905 10.872 1.00 . A A . 40 PRO CG 1 1 17 10810 1 1 40 PRO HA H 12.438 13.098 12.729 1.00 . A A . 40 PRO HA 1 1 17 10811 1 1 40 PRO HB2 H 14.905 14.216 12.547 1.00 . A A . 40 PRO HB2 1 1 17 10812 1 1 40 PRO HB3 H 14.650 12.506 12.918 1.00 . A A . 40 PRO HB3 1 1 17 10813 1 1 40 PRO HD2 H 14.127 12.272 9.087 1.00 . A A . 40 PRO HD2 1 1 17 10814 1 1 40 PRO HD3 H 14.208 11.040 10.362 1.00 . A A . 40 PRO HD3 1 1 17 10815 1 1 40 PRO HG2 H 15.353 13.795 10.308 1.00 . A A . 40 PRO HG2 1 1 17 10816 1 1 40 PRO HG3 H 16.005 12.316 11.037 1.00 . A A . 40 PRO HG3 1 1 17 10817 1 1 40 PRO N N 12.808 12.584 10.709 1.00 . A A . 40 PRO N 1 1 17 10818 1 1 40 PRO O O 11.930 15.531 12.344 1.00 . A A . 40 PRO O 1 1 17 10819 1 1 41 SER C C 13.647 17.133 8.790 1.00 . A A . 41 SER C 1 1 17 10820 1 1 41 SER CA C 13.007 16.821 10.139 1.00 . A A . 41 SER CA 1 1 17 10821 1 1 41 SER CB C 13.559 17.765 11.209 1.00 . A A . 41 SER CB 1 1 17 10822 1 1 41 SER H H 13.831 14.879 9.964 1.00 . A A . 41 SER H 1 1 17 10823 1 1 41 SER HA H 11.939 16.967 10.060 1.00 . A A . 41 SER HA 1 1 17 10824 1 1 41 SER HB2 H 14.428 17.317 11.667 1.00 . A A . 41 SER HB2 1 1 17 10825 1 1 41 SER HB3 H 13.838 18.702 10.749 1.00 . A A . 41 SER HB3 1 1 17 10826 1 1 41 SER HG H 11.713 17.895 11.851 1.00 . A A . 41 SER HG 1 1 17 10827 1 1 41 SER N N 13.242 15.433 10.518 1.00 . A A . 41 SER N 1 1 17 10828 1 1 41 SER O O 14.841 16.909 8.591 1.00 . A A . 41 SER O 1 1 17 10829 1 1 41 SER OG O 12.593 18.019 12.214 1.00 . A A . 41 SER OG 1 1 17 10830 1 1 42 GLY C C 12.589 19.129 5.907 1.00 . A A . 42 GLY C 1 1 17 10831 1 1 42 GLY CA C 13.350 17.985 6.547 1.00 . A A . 42 GLY CA 1 1 17 10832 1 1 42 GLY H H 11.901 17.808 8.081 1.00 . A A . 42 GLY H 1 1 17 10833 1 1 42 GLY HA2 H 14.390 18.260 6.631 1.00 . A A . 42 GLY HA2 1 1 17 10834 1 1 42 GLY HA3 H 13.268 17.115 5.912 1.00 . A A . 42 GLY HA3 1 1 17 10835 1 1 42 GLY N N 12.844 17.651 7.866 1.00 . A A . 42 GLY N 1 1 17 10836 1 1 42 GLY O O 11.679 18.925 5.103 1.00 . A A . 42 GLY O 1 1 17 10837 1 1 43 PRO C C 12.641 21.798 4.262 1.00 . A A . 43 PRO C 1 1 17 10838 1 1 43 PRO CA C 12.319 21.572 5.735 1.00 . A A . 43 PRO CA 1 1 17 10839 1 1 43 PRO CB C 12.911 22.696 6.590 1.00 . A A . 43 PRO CB 1 1 17 10840 1 1 43 PRO CD C 14.037 20.684 7.221 1.00 . A A . 43 PRO CD 1 1 17 10841 1 1 43 PRO CG C 14.224 22.167 7.055 1.00 . A A . 43 PRO CG 1 1 17 10842 1 1 43 PRO HA H 11.248 21.543 5.868 1.00 . A A . 43 PRO HA 1 1 17 10843 1 1 43 PRO HB2 H 13.033 23.584 5.987 1.00 . A A . 43 PRO HB2 1 1 17 10844 1 1 43 PRO HB3 H 12.254 22.905 7.421 1.00 . A A . 43 PRO HB3 1 1 17 10845 1 1 43 PRO HD2 H 14.946 20.158 6.966 1.00 . A A . 43 PRO HD2 1 1 17 10846 1 1 43 PRO HD3 H 13.736 20.452 8.232 1.00 . A A . 43 PRO HD3 1 1 17 10847 1 1 43 PRO HG2 H 14.984 22.369 6.315 1.00 . A A . 43 PRO HG2 1 1 17 10848 1 1 43 PRO HG3 H 14.488 22.619 7.999 1.00 . A A . 43 PRO HG3 1 1 17 10849 1 1 43 PRO N N 12.961 20.366 6.267 1.00 . A A . 43 PRO N 1 1 17 10850 1 1 43 PRO O O 12.119 22.722 3.637 1.00 . A A . 43 PRO O 1 1 17 10851 1 1 44 SER C C 13.130 20.057 1.453 1.00 . A A . 44 SER C 1 1 17 10852 1 1 44 SER CA C 13.896 21.058 2.312 1.00 . A A . 44 SER CA 1 1 17 10853 1 1 44 SER CB C 15.401 20.828 2.164 1.00 . A A . 44 SER CB 1 1 17 10854 1 1 44 SER H H 13.884 20.233 4.262 1.00 . A A . 44 SER H 1 1 17 10855 1 1 44 SER HA H 13.658 22.057 1.978 1.00 . A A . 44 SER HA 1 1 17 10856 1 1 44 SER HB2 H 15.646 19.833 2.501 1.00 . A A . 44 SER HB2 1 1 17 10857 1 1 44 SER HB3 H 15.678 20.935 1.125 1.00 . A A . 44 SER HB3 1 1 17 10858 1 1 44 SER HG H 15.811 21.766 3.835 1.00 . A A . 44 SER HG 1 1 17 10859 1 1 44 SER N N 13.502 20.949 3.712 1.00 . A A . 44 SER N 1 1 17 10860 1 1 44 SER O O 13.581 18.931 1.242 1.00 . A A . 44 SER O 1 1 17 10861 1 1 44 SER OG O 16.138 21.764 2.932 1.00 . A A . 44 SER OG 1 1 17 10862 1 1 45 SER C C 11.137 20.098 -1.322 1.00 . A A . 45 SER C 1 1 17 10863 1 1 45 SER CA C 11.138 19.615 0.125 1.00 . A A . 45 SER CA 1 1 17 10864 1 1 45 SER CB C 9.707 19.577 0.664 1.00 . A A . 45 SER CB 1 1 17 10865 1 1 45 SER H H 11.664 21.385 1.163 1.00 . A A . 45 SER H 1 1 17 10866 1 1 45 SER HA H 11.553 18.619 0.160 1.00 . A A . 45 SER HA 1 1 17 10867 1 1 45 SER HB2 H 9.721 19.263 1.696 1.00 . A A . 45 SER HB2 1 1 17 10868 1 1 45 SER HB3 H 9.272 20.564 0.594 1.00 . A A . 45 SER HB3 1 1 17 10869 1 1 45 SER HG H 9.471 18.031 -0.516 1.00 . A A . 45 SER HG 1 1 17 10870 1 1 45 SER N N 11.970 20.476 0.959 1.00 . A A . 45 SER N 1 1 17 10871 1 1 45 SER O O 11.436 19.339 -2.242 1.00 . A A . 45 SER O 1 1 17 10872 1 1 45 SER OG O 8.907 18.672 -0.078 1.00 . A A . 45 SER OG 1 1 17 10873 1 1 46 GLY C C 9.908 21.119 -3.802 1.00 . A A . 46 GLY C 1 1 17 10874 1 1 46 GLY CA C 10.762 21.933 -2.852 1.00 . A A . 46 GLY CA 1 1 17 10875 1 1 46 GLY H H 10.568 21.929 -0.743 1.00 . A A . 46 GLY H 1 1 17 10876 1 1 46 GLY HA2 H 10.366 22.936 -2.797 1.00 . A A . 46 GLY HA2 1 1 17 10877 1 1 46 GLY HA3 H 11.770 21.976 -3.238 1.00 . A A . 46 GLY HA3 1 1 17 10878 1 1 46 GLY N N 10.797 21.369 -1.515 1.00 . A A . 46 GLY N 1 1 17 10879 1 1 46 GLY O O 10.358 20.822 -4.908 1.00 . A A . 46 GLY O 1 1 17 10880 2 2 1 ZN ZN ZN -0.112 4.372 -0.281 1.00 . B A . 201 ZN ZN 1 1 18 10881 1 1 1 GLY C C -19.236 6.725 -10.184 1.00 . A A . 1 GLY C 1 1 18 10882 1 1 1 GLY CA C -20.256 7.566 -9.440 1.00 . A A . 1 GLY CA 1 1 18 10883 1 1 1 GLY H1 H -18.864 8.339 -8.045 1.00 . A A . 1 GLY H1 1 1 18 10884 1 1 1 GLY HA2 H -20.859 6.918 -8.822 1.00 . A A . 1 GLY HA2 1 1 18 10885 1 1 1 GLY HA3 H -20.894 8.056 -10.160 1.00 . A A . 1 GLY HA3 1 1 18 10886 1 1 1 GLY N N -19.637 8.574 -8.599 1.00 . A A . 1 GLY N 1 1 18 10887 1 1 1 GLY O O -18.216 6.331 -9.619 1.00 . A A . 1 GLY O 1 1 18 10888 1 1 2 SER C C -18.904 5.850 -13.758 1.00 . A A . 2 SER C 1 1 18 10889 1 1 2 SER CA C -18.614 5.646 -12.274 1.00 . A A . 2 SER CA 1 1 18 10890 1 1 2 SER CB C -18.750 4.164 -11.916 1.00 . A A . 2 SER CB 1 1 18 10891 1 1 2 SER H H -20.342 6.793 -11.848 1.00 . A A . 2 SER H 1 1 18 10892 1 1 2 SER HA H -17.603 5.965 -12.070 1.00 . A A . 2 SER HA 1 1 18 10893 1 1 2 SER HB2 H -19.020 4.072 -10.875 1.00 . A A . 2 SER HB2 1 1 18 10894 1 1 2 SER HB3 H -19.520 3.718 -12.529 1.00 . A A . 2 SER HB3 1 1 18 10895 1 1 2 SER HG H -16.797 4.025 -11.861 1.00 . A A . 2 SER HG 1 1 18 10896 1 1 2 SER N N -19.513 6.449 -11.454 1.00 . A A . 2 SER N 1 1 18 10897 1 1 2 SER O O -19.984 6.307 -14.134 1.00 . A A . 2 SER O 1 1 18 10898 1 1 2 SER OG O -17.533 3.473 -12.136 1.00 . A A . 2 SER OG 1 1 18 10899 1 1 3 SER C C -18.237 4.299 -16.714 1.00 . A A . 3 SER C 1 1 18 10900 1 1 3 SER CA C -18.079 5.659 -16.041 1.00 . A A . 3 SER CA 1 1 18 10901 1 1 3 SER CB C -16.872 6.394 -16.625 1.00 . A A . 3 SER CB 1 1 18 10902 1 1 3 SER H H -17.093 5.151 -14.237 1.00 . A A . 3 SER H 1 1 18 10903 1 1 3 SER HA H -18.969 6.243 -16.224 1.00 . A A . 3 SER HA 1 1 18 10904 1 1 3 SER HB2 H -15.968 6.006 -16.180 1.00 . A A . 3 SER HB2 1 1 18 10905 1 1 3 SER HB3 H -16.842 6.238 -17.694 1.00 . A A . 3 SER HB3 1 1 18 10906 1 1 3 SER HG H -16.127 8.206 -16.636 1.00 . A A . 3 SER HG 1 1 18 10907 1 1 3 SER N N -17.931 5.509 -14.598 1.00 . A A . 3 SER N 1 1 18 10908 1 1 3 SER O O -19.183 4.072 -17.466 1.00 . A A . 3 SER O 1 1 18 10909 1 1 3 SER OG O -16.948 7.785 -16.368 1.00 . A A . 3 SER OG 1 1 18 10910 1 1 4 GLY C C -16.301 1.141 -16.450 1.00 . A A . 4 GLY C 1 1 18 10911 1 1 4 GLY CA C -17.352 2.070 -17.024 1.00 . A A . 4 GLY CA 1 1 18 10912 1 1 4 GLY H H -16.568 3.633 -15.830 1.00 . A A . 4 GLY H 1 1 18 10913 1 1 4 GLY HA2 H -18.329 1.647 -16.845 1.00 . A A . 4 GLY HA2 1 1 18 10914 1 1 4 GLY HA3 H -17.197 2.154 -18.090 1.00 . A A . 4 GLY HA3 1 1 18 10915 1 1 4 GLY N N -17.300 3.397 -16.438 1.00 . A A . 4 GLY N 1 1 18 10916 1 1 4 GLY O O -16.236 0.941 -15.237 1.00 . A A . 4 GLY O 1 1 18 10917 1 1 5 SER C C -13.360 0.385 -16.090 1.00 . A A . 5 SER C 1 1 18 10918 1 1 5 SER CA C -14.428 -0.348 -16.896 1.00 . A A . 5 SER CA 1 1 18 10919 1 1 5 SER CB C -13.790 -1.027 -18.110 1.00 . A A . 5 SER CB 1 1 18 10920 1 1 5 SER H H -15.580 0.770 -18.277 1.00 . A A . 5 SER H 1 1 18 10921 1 1 5 SER HA H -14.881 -1.101 -16.269 1.00 . A A . 5 SER HA 1 1 18 10922 1 1 5 SER HB2 H -13.509 -0.277 -18.832 1.00 . A A . 5 SER HB2 1 1 18 10923 1 1 5 SER HB3 H -12.912 -1.571 -17.794 1.00 . A A . 5 SER HB3 1 1 18 10924 1 1 5 SER HG H -14.201 -2.645 -19.136 1.00 . A A . 5 SER HG 1 1 18 10925 1 1 5 SER N N -15.477 0.570 -17.323 1.00 . A A . 5 SER N 1 1 18 10926 1 1 5 SER O O -12.320 0.771 -16.623 1.00 . A A . 5 SER O 1 1 18 10927 1 1 5 SER OG O -14.693 -1.933 -18.720 1.00 . A A . 5 SER OG 1 1 18 10928 1 1 6 SER C C -11.355 0.526 -13.862 1.00 . A A . 6 SER C 1 1 18 10929 1 1 6 SER CA C -12.690 1.263 -13.920 1.00 . A A . 6 SER CA 1 1 18 10930 1 1 6 SER CB C -13.278 1.389 -12.514 1.00 . A A . 6 SER CB 1 1 18 10931 1 1 6 SER H H -14.472 0.242 -14.434 1.00 . A A . 6 SER H 1 1 18 10932 1 1 6 SER HA H -12.524 2.252 -14.322 1.00 . A A . 6 SER HA 1 1 18 10933 1 1 6 SER HB2 H -13.832 0.493 -12.277 1.00 . A A . 6 SER HB2 1 1 18 10934 1 1 6 SER HB3 H -12.476 1.515 -11.801 1.00 . A A . 6 SER HB3 1 1 18 10935 1 1 6 SER HG H -14.834 2.429 -13.094 1.00 . A A . 6 SER HG 1 1 18 10936 1 1 6 SER N N -13.625 0.573 -14.801 1.00 . A A . 6 SER N 1 1 18 10937 1 1 6 SER O O -10.294 1.125 -14.031 1.00 . A A . 6 SER O 1 1 18 10938 1 1 6 SER OG O -14.150 2.502 -12.424 1.00 . A A . 6 SER OG 1 1 18 10939 1 1 7 GLY C C -9.133 -0.922 -12.699 1.00 . A A . 7 GLY C 1 1 18 10940 1 1 7 GLY CA C -10.208 -1.579 -13.542 1.00 . A A . 7 GLY CA 1 1 18 10941 1 1 7 GLY H H -12.292 -1.205 -13.493 1.00 . A A . 7 GLY H 1 1 18 10942 1 1 7 GLY HA2 H -10.451 -2.539 -13.113 1.00 . A A . 7 GLY HA2 1 1 18 10943 1 1 7 GLY HA3 H -9.825 -1.729 -14.541 1.00 . A A . 7 GLY HA3 1 1 18 10944 1 1 7 GLY N N -11.418 -0.780 -13.620 1.00 . A A . 7 GLY N 1 1 18 10945 1 1 7 GLY O O -8.207 -0.307 -13.229 1.00 . A A . 7 GLY O 1 1 18 10946 1 1 8 THR C C -6.986 -1.256 -10.454 1.00 . A A . 8 THR C 1 1 18 10947 1 1 8 THR CA C -8.288 -0.463 -10.464 1.00 . A A . 8 THR CA 1 1 18 10948 1 1 8 THR CB C -8.845 -0.394 -9.029 1.00 . A A . 8 THR CB 1 1 18 10949 1 1 8 THR CG2 C -10.060 0.517 -8.964 1.00 . A A . 8 THR CG2 1 1 18 10950 1 1 8 THR H H -10.015 -1.553 -11.020 1.00 . A A . 8 THR H 1 1 18 10951 1 1 8 THR HA H -8.082 0.544 -10.796 1.00 . A A . 8 THR HA 1 1 18 10952 1 1 8 THR HB H -8.078 0.005 -8.380 1.00 . A A . 8 THR HB 1 1 18 10953 1 1 8 THR HG1 H -9.749 -1.637 -7.793 1.00 . A A . 8 THR HG1 1 1 18 10954 1 1 8 THR HG21 H -10.246 0.940 -9.940 1.00 . A A . 8 THR HG21 1 1 18 10955 1 1 8 THR HG22 H -9.876 1.313 -8.256 1.00 . A A . 8 THR HG22 1 1 18 10956 1 1 8 THR HG23 H -10.922 -0.053 -8.648 1.00 . A A . 8 THR HG23 1 1 18 10957 1 1 8 THR N N -9.255 -1.051 -11.382 1.00 . A A . 8 THR N 1 1 18 10958 1 1 8 THR O O -5.905 -0.696 -10.628 1.00 . A A . 8 THR O 1 1 18 10959 1 1 8 THR OG1 O -9.201 -1.706 -8.579 1.00 . A A . 8 THR OG1 1 1 18 10960 1 1 9 GLY C C -6.241 -4.834 -9.794 1.00 . A A . 9 GLY C 1 1 18 10961 1 1 9 GLY CA C -5.922 -3.415 -10.223 1.00 . A A . 9 GLY CA 1 1 18 10962 1 1 9 GLY H H -7.986 -2.958 -10.118 1.00 . A A . 9 GLY H 1 1 18 10963 1 1 9 GLY HA2 H -5.484 -3.438 -11.210 1.00 . A A . 9 GLY HA2 1 1 18 10964 1 1 9 GLY HA3 H -5.205 -2.995 -9.532 1.00 . A A . 9 GLY HA3 1 1 18 10965 1 1 9 GLY N N -7.098 -2.566 -10.250 1.00 . A A . 9 GLY N 1 1 18 10966 1 1 9 GLY O O -7.066 -5.049 -8.907 1.00 . A A . 9 GLY O 1 1 18 10967 1 1 10 GLU C C -5.014 -7.615 -8.867 1.00 . A A . 10 GLU C 1 1 18 10968 1 1 10 GLU CA C -5.808 -7.208 -10.106 1.00 . A A . 10 GLU CA 1 1 18 10969 1 1 10 GLU CB C -5.414 -8.092 -11.291 1.00 . A A . 10 GLU CB 1 1 18 10970 1 1 10 GLU CD C -5.740 -10.330 -10.164 1.00 . A A . 10 GLU CD 1 1 18 10971 1 1 10 GLU CG C -6.135 -9.429 -11.318 1.00 . A A . 10 GLU CG 1 1 18 10972 1 1 10 GLU H H -4.940 -5.567 -11.124 1.00 . A A . 10 GLU H 1 1 18 10973 1 1 10 GLU HA H -6.860 -7.340 -9.904 1.00 . A A . 10 GLU HA 1 1 18 10974 1 1 10 GLU HB2 H -5.637 -7.566 -12.207 1.00 . A A . 10 GLU HB2 1 1 18 10975 1 1 10 GLU HB3 H -4.351 -8.282 -11.245 1.00 . A A . 10 GLU HB3 1 1 18 10976 1 1 10 GLU HG2 H -7.199 -9.251 -11.268 1.00 . A A . 10 GLU HG2 1 1 18 10977 1 1 10 GLU HG3 H -5.899 -9.932 -12.245 1.00 . A A . 10 GLU HG3 1 1 18 10978 1 1 10 GLU N N -5.586 -5.803 -10.426 1.00 . A A . 10 GLU N 1 1 18 10979 1 1 10 GLU O O -5.438 -8.481 -8.101 1.00 . A A . 10 GLU O 1 1 18 10980 1 1 10 GLU OE1 O -4.628 -10.150 -9.626 1.00 . A A . 10 GLU OE1 1 1 18 10981 1 1 10 GLU OE2 O -6.543 -11.214 -9.799 1.00 . A A . 10 GLU OE2 1 1 18 10982 1 1 11 LYS C C -3.841 -7.537 -6.283 1.00 . A A . 11 LYS C 1 1 18 10983 1 1 11 LYS CA C -3.006 -7.279 -7.533 1.00 . A A . 11 LYS CA 1 1 18 10984 1 1 11 LYS CB C -2.038 -6.121 -7.282 1.00 . A A . 11 LYS CB 1 1 18 10985 1 1 11 LYS CD C -0.994 -5.508 -9.483 1.00 . A A . 11 LYS CD 1 1 18 10986 1 1 11 LYS CE C 0.330 -5.219 -10.175 1.00 . A A . 11 LYS CE 1 1 18 10987 1 1 11 LYS CG C -0.784 -6.181 -8.137 1.00 . A A . 11 LYS CG 1 1 18 10988 1 1 11 LYS H H -3.576 -6.303 -9.323 1.00 . A A . 11 LYS H 1 1 18 10989 1 1 11 LYS HA H -2.439 -8.168 -7.762 1.00 . A A . 11 LYS HA 1 1 18 10990 1 1 11 LYS HB2 H -2.546 -5.191 -7.490 1.00 . A A . 11 LYS HB2 1 1 18 10991 1 1 11 LYS HB3 H -1.740 -6.134 -6.244 1.00 . A A . 11 LYS HB3 1 1 18 10992 1 1 11 LYS HD2 H -1.582 -6.158 -10.114 1.00 . A A . 11 LYS HD2 1 1 18 10993 1 1 11 LYS HD3 H -1.521 -4.576 -9.332 1.00 . A A . 11 LYS HD3 1 1 18 10994 1 1 11 LYS HE2 H 0.162 -4.494 -10.956 1.00 . A A . 11 LYS HE2 1 1 18 10995 1 1 11 LYS HE3 H 1.019 -4.814 -9.449 1.00 . A A . 11 LYS HE3 1 1 18 10996 1 1 11 LYS HG2 H 0.020 -5.680 -7.618 1.00 . A A . 11 LYS HG2 1 1 18 10997 1 1 11 LYS HG3 H -0.519 -7.216 -8.300 1.00 . A A . 11 LYS HG3 1 1 18 10998 1 1 11 LYS HZ1 H 0.967 -6.356 -11.808 1.00 . A A . 11 LYS HZ1 1 1 18 10999 1 1 11 LYS HZ2 H 0.342 -7.277 -10.534 1.00 . A A . 11 LYS HZ2 1 1 18 11000 1 1 11 LYS HZ3 H 1.884 -6.595 -10.407 1.00 . A A . 11 LYS HZ3 1 1 18 11001 1 1 11 LYS N N -3.860 -6.985 -8.678 1.00 . A A . 11 LYS N 1 1 18 11002 1 1 11 LYS NZ N 0.922 -6.447 -10.773 1.00 . A A . 11 LYS NZ 1 1 18 11003 1 1 11 LYS O O -4.831 -6.855 -6.017 1.00 . A A . 11 LYS O 1 1 18 11004 1 1 12 PRO C C -3.967 -7.862 -3.166 1.00 . A A . 12 PRO C 1 1 18 11005 1 1 12 PRO CA C -4.130 -8.913 -4.259 1.00 . A A . 12 PRO CA 1 1 18 11006 1 1 12 PRO CB C -3.452 -10.222 -3.848 1.00 . A A . 12 PRO CB 1 1 18 11007 1 1 12 PRO CD C -2.263 -9.399 -5.751 1.00 . A A . 12 PRO CD 1 1 18 11008 1 1 12 PRO CG C -2.097 -10.156 -4.463 1.00 . A A . 12 PRO CG 1 1 18 11009 1 1 12 PRO HA H -5.182 -9.089 -4.434 1.00 . A A . 12 PRO HA 1 1 18 11010 1 1 12 PRO HB2 H -3.396 -10.277 -2.770 1.00 . A A . 12 PRO HB2 1 1 18 11011 1 1 12 PRO HB3 H -4.018 -11.059 -4.228 1.00 . A A . 12 PRO HB3 1 1 18 11012 1 1 12 PRO HD2 H -1.386 -8.801 -5.954 1.00 . A A . 12 PRO HD2 1 1 18 11013 1 1 12 PRO HD3 H -2.455 -10.080 -6.567 1.00 . A A . 12 PRO HD3 1 1 18 11014 1 1 12 PRO HG2 H -1.420 -9.633 -3.805 1.00 . A A . 12 PRO HG2 1 1 18 11015 1 1 12 PRO HG3 H -1.735 -11.154 -4.660 1.00 . A A . 12 PRO HG3 1 1 18 11016 1 1 12 PRO N N -3.434 -8.543 -5.496 1.00 . A A . 12 PRO N 1 1 18 11017 1 1 12 PRO O O -4.863 -7.662 -2.346 1.00 . A A . 12 PRO O 1 1 18 11018 1 1 13 TYR C C -2.881 -4.778 -2.707 1.00 . A A . 13 TYR C 1 1 18 11019 1 1 13 TYR CA C -2.539 -6.164 -2.168 1.00 . A A . 13 TYR CA 1 1 18 11020 1 1 13 TYR CB C -1.067 -6.213 -1.754 1.00 . A A . 13 TYR CB 1 1 18 11021 1 1 13 TYR CD1 C -0.750 -8.037 -0.037 1.00 . A A . 13 TYR CD1 1 1 18 11022 1 1 13 TYR CD2 C -0.005 -8.447 -2.263 1.00 . A A . 13 TYR CD2 1 1 18 11023 1 1 13 TYR CE1 C -0.323 -9.295 0.343 1.00 . A A . 13 TYR CE1 1 1 18 11024 1 1 13 TYR CE2 C 0.423 -9.707 -1.893 1.00 . A A . 13 TYR CE2 1 1 18 11025 1 1 13 TYR CG C -0.599 -7.591 -1.344 1.00 . A A . 13 TYR CG 1 1 18 11026 1 1 13 TYR CZ C 0.262 -10.126 -0.589 1.00 . A A . 13 TYR CZ 1 1 18 11027 1 1 13 TYR H H -2.144 -7.397 -3.842 1.00 . A A . 13 TYR H 1 1 18 11028 1 1 13 TYR HA H -3.153 -6.363 -1.302 1.00 . A A . 13 TYR HA 1 1 18 11029 1 1 13 TYR HB2 H -0.456 -5.889 -2.582 1.00 . A A . 13 TYR HB2 1 1 18 11030 1 1 13 TYR HB3 H -0.913 -5.547 -0.917 1.00 . A A . 13 TYR HB3 1 1 18 11031 1 1 13 TYR HD1 H -1.209 -7.383 0.691 1.00 . A A . 13 TYR HD1 1 1 18 11032 1 1 13 TYR HD2 H 0.120 -8.115 -3.284 1.00 . A A . 13 TYR HD2 1 1 18 11033 1 1 13 TYR HE1 H -0.449 -9.623 1.364 1.00 . A A . 13 TYR HE1 1 1 18 11034 1 1 13 TYR HE2 H 0.882 -10.358 -2.623 1.00 . A A . 13 TYR HE2 1 1 18 11035 1 1 13 TYR HH H 1.134 -11.800 -0.957 1.00 . A A . 13 TYR HH 1 1 18 11036 1 1 13 TYR N N -2.820 -7.193 -3.162 1.00 . A A . 13 TYR N 1 1 18 11037 1 1 13 TYR O O -2.680 -4.492 -3.887 1.00 . A A . 13 TYR O 1 1 18 11038 1 1 13 TYR OH O 0.689 -11.380 -0.216 1.00 . A A . 13 TYR OH 1 1 18 11039 1 1 14 ARG C C -3.532 -1.589 -1.072 1.00 . A A . 14 ARG C 1 1 18 11040 1 1 14 ARG CA C -3.772 -2.566 -2.219 1.00 . A A . 14 ARG CA 1 1 18 11041 1 1 14 ARG CB C -5.240 -2.519 -2.646 1.00 . A A . 14 ARG CB 1 1 18 11042 1 1 14 ARG CD C -7.095 -0.901 -3.154 1.00 . A A . 14 ARG CD 1 1 18 11043 1 1 14 ARG CG C -5.626 -1.234 -3.360 1.00 . A A . 14 ARG CG 1 1 18 11044 1 1 14 ARG CZ C -7.907 0.103 -5.246 1.00 . A A . 14 ARG CZ 1 1 18 11045 1 1 14 ARG H H -3.537 -4.209 -0.906 1.00 . A A . 14 ARG H 1 1 18 11046 1 1 14 ARG HA H -3.153 -2.279 -3.057 1.00 . A A . 14 ARG HA 1 1 18 11047 1 1 14 ARG HB2 H -5.437 -3.348 -3.310 1.00 . A A . 14 ARG HB2 1 1 18 11048 1 1 14 ARG HB3 H -5.860 -2.617 -1.768 1.00 . A A . 14 ARG HB3 1 1 18 11049 1 1 14 ARG HD2 H -7.686 -1.768 -3.409 1.00 . A A . 14 ARG HD2 1 1 18 11050 1 1 14 ARG HD3 H -7.251 -0.653 -2.114 1.00 . A A . 14 ARG HD3 1 1 18 11051 1 1 14 ARG HE H -7.523 1.114 -3.570 1.00 . A A . 14 ARG HE 1 1 18 11052 1 1 14 ARG HG2 H -5.027 -0.424 -2.972 1.00 . A A . 14 ARG HG2 1 1 18 11053 1 1 14 ARG HG3 H -5.437 -1.351 -4.417 1.00 . A A . 14 ARG HG3 1 1 18 11054 1 1 14 ARG HH11 H -7.636 -1.898 -5.312 1.00 . A A . 14 ARG HH11 1 1 18 11055 1 1 14 ARG HH12 H -8.208 -1.178 -6.780 1.00 . A A . 14 ARG HH12 1 1 18 11056 1 1 14 ARG HH21 H -8.276 2.074 -5.497 1.00 . A A . 14 ARG HH21 1 1 18 11057 1 1 14 ARG HH22 H -8.571 1.081 -6.885 1.00 . A A . 14 ARG HH22 1 1 18 11058 1 1 14 ARG N N -3.400 -3.922 -1.833 1.00 . A A . 14 ARG N 1 1 18 11059 1 1 14 ARG NE N -7.523 0.224 -3.980 1.00 . A A . 14 ARG NE 1 1 18 11060 1 1 14 ARG NH1 N -7.917 -1.089 -5.827 1.00 . A A . 14 ARG NH1 1 1 18 11061 1 1 14 ARG NH2 N -8.282 1.174 -5.932 1.00 . A A . 14 ARG NH2 1 1 18 11062 1 1 14 ARG O O -3.665 -1.945 0.099 1.00 . A A . 14 ARG O 1 1 18 11063 1 1 15 CYS C C -4.162 1.526 -0.180 1.00 . A A . 15 CYS C 1 1 18 11064 1 1 15 CYS CA C -2.919 0.674 -0.418 1.00 . A A . 15 CYS CA 1 1 18 11065 1 1 15 CYS CB C -1.755 1.562 -0.860 1.00 . A A . 15 CYS CB 1 1 18 11066 1 1 15 CYS H H -3.089 -0.131 -2.368 1.00 . A A . 15 CYS H 1 1 18 11067 1 1 15 CYS HA H -2.654 0.181 0.505 1.00 . A A . 15 CYS HA 1 1 18 11068 1 1 15 CYS HB2 H -0.995 0.945 -1.319 1.00 . A A . 15 CYS HB2 1 1 18 11069 1 1 15 CYS HB3 H -2.114 2.279 -1.584 1.00 . A A . 15 CYS HB3 1 1 18 11070 1 1 15 CYS N N -3.178 -0.356 -1.417 1.00 . A A . 15 CYS N 1 1 18 11071 1 1 15 CYS O O -4.300 2.611 -0.744 1.00 . A A . 15 CYS O 1 1 18 11072 1 1 15 CYS SG S -0.968 2.489 0.497 1.00 . A A . 15 CYS SG 1 1 18 11073 1 1 16 ALA C C -6.013 3.216 1.260 1.00 . A A . 16 ALA C 1 1 18 11074 1 1 16 ALA CA C -6.293 1.744 0.975 1.00 . A A . 16 ALA CA 1 1 18 11075 1 1 16 ALA CB C -6.991 1.098 2.163 1.00 . A A . 16 ALA CB 1 1 18 11076 1 1 16 ALA H H -4.896 0.158 1.079 1.00 . A A . 16 ALA H 1 1 18 11077 1 1 16 ALA HA H -6.949 1.671 0.120 1.00 . A A . 16 ALA HA 1 1 18 11078 1 1 16 ALA HB1 H -7.800 1.732 2.493 1.00 . A A . 16 ALA HB1 1 1 18 11079 1 1 16 ALA HB2 H -7.384 0.135 1.868 1.00 . A A . 16 ALA HB2 1 1 18 11080 1 1 16 ALA HB3 H -6.283 0.967 2.968 1.00 . A A . 16 ALA HB3 1 1 18 11081 1 1 16 ALA N N -5.063 1.028 0.660 1.00 . A A . 16 ALA N 1 1 18 11082 1 1 16 ALA O O -6.897 4.061 1.123 1.00 . A A . 16 ALA O 1 1 18 11083 1 1 17 GLU C C -4.550 5.782 0.739 1.00 . A A . 17 GLU C 1 1 18 11084 1 1 17 GLU CA C -4.386 4.884 1.961 1.00 . A A . 17 GLU CA 1 1 18 11085 1 1 17 GLU CB C -2.936 4.925 2.447 1.00 . A A . 17 GLU CB 1 1 18 11086 1 1 17 GLU CD C -3.540 4.917 4.900 1.00 . A A . 17 GLU CD 1 1 18 11087 1 1 17 GLU CG C -2.728 4.263 3.799 1.00 . A A . 17 GLU CG 1 1 18 11088 1 1 17 GLU H H -4.120 2.795 1.746 1.00 . A A . 17 GLU H 1 1 18 11089 1 1 17 GLU HA H -5.030 5.246 2.748 1.00 . A A . 17 GLU HA 1 1 18 11090 1 1 17 GLU HB2 H -2.312 4.423 1.723 1.00 . A A . 17 GLU HB2 1 1 18 11091 1 1 17 GLU HB3 H -2.624 5.956 2.524 1.00 . A A . 17 GLU HB3 1 1 18 11092 1 1 17 GLU HG2 H -3.019 3.226 3.726 1.00 . A A . 17 GLU HG2 1 1 18 11093 1 1 17 GLU HG3 H -1.681 4.325 4.058 1.00 . A A . 17 GLU HG3 1 1 18 11094 1 1 17 GLU N N -4.780 3.513 1.656 1.00 . A A . 17 GLU N 1 1 18 11095 1 1 17 GLU O O -5.308 6.752 0.764 1.00 . A A . 17 GLU O 1 1 18 11096 1 1 17 GLU OE1 O -3.900 6.103 4.748 1.00 . A A . 17 GLU OE1 1 1 18 11097 1 1 17 GLU OE2 O -3.815 4.242 5.914 1.00 . A A . 17 GLU OE2 1 1 18 11098 1 1 18 CYS C C -4.700 5.488 -2.631 1.00 . A A . 18 CYS C 1 1 18 11099 1 1 18 CYS CA C -3.898 6.228 -1.564 1.00 . A A . 18 CYS CA 1 1 18 11100 1 1 18 CYS CB C -2.488 6.519 -2.081 1.00 . A A . 18 CYS CB 1 1 18 11101 1 1 18 CYS H H -3.248 4.667 -0.291 1.00 . A A . 18 CYS H 1 1 18 11102 1 1 18 CYS HA H -4.391 7.162 -1.343 1.00 . A A . 18 CYS HA 1 1 18 11103 1 1 18 CYS HB2 H -2.560 7.023 -3.034 1.00 . A A . 18 CYS HB2 1 1 18 11104 1 1 18 CYS HB3 H -1.981 7.162 -1.377 1.00 . A A . 18 CYS HB3 1 1 18 11105 1 1 18 CYS N N -3.834 5.452 -0.331 1.00 . A A . 18 CYS N 1 1 18 11106 1 1 18 CYS O O -5.478 6.093 -3.368 1.00 . A A . 18 CYS O 1 1 18 11107 1 1 18 CYS SG S -1.461 5.034 -2.317 1.00 . A A . 18 CYS SG 1 1 18 11108 1 1 19 GLY C C -4.290 2.760 -4.716 1.00 . A A . 19 GLY C 1 1 18 11109 1 1 19 GLY CA C -5.217 3.375 -3.686 1.00 . A A . 19 GLY CA 1 1 18 11110 1 1 19 GLY H H -3.872 3.747 -2.093 1.00 . A A . 19 GLY H 1 1 18 11111 1 1 19 GLY HA2 H -5.743 2.584 -3.173 1.00 . A A . 19 GLY HA2 1 1 18 11112 1 1 19 GLY HA3 H -5.935 4.002 -4.193 1.00 . A A . 19 GLY HA3 1 1 18 11113 1 1 19 GLY N N -4.505 4.175 -2.707 1.00 . A A . 19 GLY N 1 1 18 11114 1 1 19 GLY O O -4.584 2.771 -5.912 1.00 . A A . 19 GLY O 1 1 18 11115 1 1 20 LYS C C -2.319 0.083 -5.111 1.00 . A A . 20 LYS C 1 1 18 11116 1 1 20 LYS CA C -2.192 1.602 -5.143 1.00 . A A . 20 LYS CA 1 1 18 11117 1 1 20 LYS CB C -0.773 2.015 -4.747 1.00 . A A . 20 LYS CB 1 1 18 11118 1 1 20 LYS CD C 1.549 2.458 -5.598 1.00 . A A . 20 LYS CD 1 1 18 11119 1 1 20 LYS CE C 2.659 1.971 -6.517 1.00 . A A . 20 LYS CE 1 1 18 11120 1 1 20 LYS CG C 0.279 1.643 -5.778 1.00 . A A . 20 LYS CG 1 1 18 11121 1 1 20 LYS H H -2.987 2.246 -3.290 1.00 . A A . 20 LYS H 1 1 18 11122 1 1 20 LYS HA H -2.391 1.947 -6.147 1.00 . A A . 20 LYS HA 1 1 18 11123 1 1 20 LYS HB2 H -0.748 3.086 -4.608 1.00 . A A . 20 LYS HB2 1 1 18 11124 1 1 20 LYS HB3 H -0.518 1.533 -3.814 1.00 . A A . 20 LYS HB3 1 1 18 11125 1 1 20 LYS HD2 H 1.338 3.493 -5.824 1.00 . A A . 20 LYS HD2 1 1 18 11126 1 1 20 LYS HD3 H 1.879 2.372 -4.572 1.00 . A A . 20 LYS HD3 1 1 18 11127 1 1 20 LYS HE2 H 2.825 0.921 -6.334 1.00 . A A . 20 LYS HE2 1 1 18 11128 1 1 20 LYS HE3 H 2.347 2.113 -7.541 1.00 . A A . 20 LYS HE3 1 1 18 11129 1 1 20 LYS HG2 H 0.519 0.595 -5.673 1.00 . A A . 20 LYS HG2 1 1 18 11130 1 1 20 LYS HG3 H -0.118 1.826 -6.766 1.00 . A A . 20 LYS HG3 1 1 18 11131 1 1 20 LYS HZ1 H 3.912 3.619 -6.796 1.00 . A A . 20 LYS HZ1 1 1 18 11132 1 1 20 LYS HZ2 H 4.736 2.150 -6.636 1.00 . A A . 20 LYS HZ2 1 1 18 11133 1 1 20 LYS HZ3 H 4.062 2.894 -5.275 1.00 . A A . 20 LYS HZ3 1 1 18 11134 1 1 20 LYS N N -3.166 2.224 -4.254 1.00 . A A . 20 LYS N 1 1 18 11135 1 1 20 LYS NZ N 3.931 2.711 -6.290 1.00 . A A . 20 LYS NZ 1 1 18 11136 1 1 20 LYS O O -3.067 -0.470 -4.307 1.00 . A A . 20 LYS O 1 1 18 11137 1 1 21 ALA C C -0.214 -2.628 -5.865 1.00 . A A . 21 ALA C 1 1 18 11138 1 1 21 ALA CA C -1.608 -2.042 -6.061 1.00 . A A . 21 ALA CA 1 1 18 11139 1 1 21 ALA CB C -2.191 -2.496 -7.391 1.00 . A A . 21 ALA CB 1 1 18 11140 1 1 21 ALA H H -1.003 -0.089 -6.607 1.00 . A A . 21 ALA H 1 1 18 11141 1 1 21 ALA HA H -2.253 -2.402 -5.272 1.00 . A A . 21 ALA HA 1 1 18 11142 1 1 21 ALA HB1 H -3.246 -2.690 -7.273 1.00 . A A . 21 ALA HB1 1 1 18 11143 1 1 21 ALA HB2 H -2.047 -1.721 -8.129 1.00 . A A . 21 ALA HB2 1 1 18 11144 1 1 21 ALA HB3 H -1.692 -3.398 -7.713 1.00 . A A . 21 ALA HB3 1 1 18 11145 1 1 21 ALA N N -1.580 -0.587 -5.991 1.00 . A A . 21 ALA N 1 1 18 11146 1 1 21 ALA O O 0.786 -2.014 -6.238 1.00 . A A . 21 ALA O 1 1 18 11147 1 1 22 PHE C C 0.965 -6.000 -5.120 1.00 . A A . 22 PHE C 1 1 18 11148 1 1 22 PHE CA C 1.119 -4.485 -5.029 1.00 . A A . 22 PHE CA 1 1 18 11149 1 1 22 PHE CB C 1.663 -4.099 -3.652 1.00 . A A . 22 PHE CB 1 1 18 11150 1 1 22 PHE CD1 C 0.946 -1.765 -3.073 1.00 . A A . 22 PHE CD1 1 1 18 11151 1 1 22 PHE CD2 C 3.189 -2.113 -3.803 1.00 . A A . 22 PHE CD2 1 1 18 11152 1 1 22 PHE CE1 C 1.197 -0.412 -2.939 1.00 . A A . 22 PHE CE1 1 1 18 11153 1 1 22 PHE CE2 C 3.446 -0.761 -3.671 1.00 . A A . 22 PHE CE2 1 1 18 11154 1 1 22 PHE CG C 1.938 -2.629 -3.506 1.00 . A A . 22 PHE CG 1 1 18 11155 1 1 22 PHE CZ C 2.449 0.090 -3.238 1.00 . A A . 22 PHE CZ 1 1 18 11156 1 1 22 PHE H H -0.986 -4.257 -5.001 1.00 . A A . 22 PHE H 1 1 18 11157 1 1 22 PHE HA H 1.816 -4.159 -5.786 1.00 . A A . 22 PHE HA 1 1 18 11158 1 1 22 PHE HB2 H 0.942 -4.377 -2.897 1.00 . A A . 22 PHE HB2 1 1 18 11159 1 1 22 PHE HB3 H 2.586 -4.630 -3.475 1.00 . A A . 22 PHE HB3 1 1 18 11160 1 1 22 PHE HD1 H -0.033 -2.156 -2.838 1.00 . A A . 22 PHE HD1 1 1 18 11161 1 1 22 PHE HD2 H 3.970 -2.779 -4.143 1.00 . A A . 22 PHE HD2 1 1 18 11162 1 1 22 PHE HE1 H 0.416 0.251 -2.599 1.00 . A A . 22 PHE HE1 1 1 18 11163 1 1 22 PHE HE2 H 4.426 -0.372 -3.906 1.00 . A A . 22 PHE HE2 1 1 18 11164 1 1 22 PHE HZ H 2.647 1.146 -3.134 1.00 . A A . 22 PHE HZ 1 1 18 11165 1 1 22 PHE N N -0.154 -3.817 -5.276 1.00 . A A . 22 PHE N 1 1 18 11166 1 1 22 PHE O O -0.102 -6.546 -4.839 1.00 . A A . 22 PHE O 1 1 18 11167 1 1 23 THR C C 2.778 -8.790 -4.500 1.00 . A A . 23 THR C 1 1 18 11168 1 1 23 THR CA C 2.025 -8.127 -5.648 1.00 . A A . 23 THR CA 1 1 18 11169 1 1 23 THR CB C 2.648 -8.577 -6.983 1.00 . A A . 23 THR CB 1 1 18 11170 1 1 23 THR CG2 C 2.372 -10.051 -7.239 1.00 . A A . 23 THR CG2 1 1 18 11171 1 1 23 THR H H 2.861 -6.184 -5.726 1.00 . A A . 23 THR H 1 1 18 11172 1 1 23 THR HA H 0.995 -8.453 -5.626 1.00 . A A . 23 THR HA 1 1 18 11173 1 1 23 THR HB H 3.717 -8.429 -6.932 1.00 . A A . 23 THR HB 1 1 18 11174 1 1 23 THR HG1 H 2.697 -7.867 -8.822 1.00 . A A . 23 THR HG1 1 1 18 11175 1 1 23 THR HG21 H 3.156 -10.646 -6.795 1.00 . A A . 23 THR HG21 1 1 18 11176 1 1 23 THR HG22 H 2.343 -10.232 -8.303 1.00 . A A . 23 THR HG22 1 1 18 11177 1 1 23 THR HG23 H 1.422 -10.321 -6.801 1.00 . A A . 23 THR HG23 1 1 18 11178 1 1 23 THR N N 2.040 -6.676 -5.517 1.00 . A A . 23 THR N 1 1 18 11179 1 1 23 THR O O 3.316 -9.888 -4.650 1.00 . A A . 23 THR O 1 1 18 11180 1 1 23 THR OG1 O 2.119 -7.793 -8.058 1.00 . A A . 23 THR OG1 1 1 18 11181 1 1 24 ASP C C 3.225 -7.774 -0.957 1.00 . A A . 24 ASP C 1 1 18 11182 1 1 24 ASP CA C 3.498 -8.644 -2.180 1.00 . A A . 24 ASP CA 1 1 18 11183 1 1 24 ASP CB C 5.003 -8.727 -2.436 1.00 . A A . 24 ASP CB 1 1 18 11184 1 1 24 ASP CG C 5.742 -9.441 -1.322 1.00 . A A . 24 ASP CG 1 1 18 11185 1 1 24 ASP H H 2.364 -7.248 -3.297 1.00 . A A . 24 ASP H 1 1 18 11186 1 1 24 ASP HA H 3.119 -9.637 -1.991 1.00 . A A . 24 ASP HA 1 1 18 11187 1 1 24 ASP HB2 H 5.175 -9.264 -3.358 1.00 . A A . 24 ASP HB2 1 1 18 11188 1 1 24 ASP HB3 H 5.402 -7.728 -2.526 1.00 . A A . 24 ASP HB3 1 1 18 11189 1 1 24 ASP N N 2.812 -8.118 -3.354 1.00 . A A . 24 ASP N 1 1 18 11190 1 1 24 ASP O O 3.262 -6.546 -1.035 1.00 . A A . 24 ASP O 1 1 18 11191 1 1 24 ASP OD1 O 5.246 -10.489 -0.858 1.00 . A A . 24 ASP OD1 1 1 18 11192 1 1 24 ASP OD2 O 6.816 -8.952 -0.912 1.00 . A A . 24 ASP OD2 1 1 18 11193 1 1 25 ARG C C 3.842 -6.810 1.802 1.00 . A A . 25 ARG C 1 1 18 11194 1 1 25 ARG CA C 2.669 -7.704 1.412 1.00 . A A . 25 ARG CA 1 1 18 11195 1 1 25 ARG CB C 2.370 -8.693 2.540 1.00 . A A . 25 ARG CB 1 1 18 11196 1 1 25 ARG CD C 0.324 -7.822 3.710 1.00 . A A . 25 ARG CD 1 1 18 11197 1 1 25 ARG CG C 1.827 -8.036 3.798 1.00 . A A . 25 ARG CG 1 1 18 11198 1 1 25 ARG CZ C -1.593 -7.559 5.226 1.00 . A A . 25 ARG CZ 1 1 18 11199 1 1 25 ARG H H 2.936 -9.399 0.172 1.00 . A A . 25 ARG H 1 1 18 11200 1 1 25 ARG HA H 1.799 -7.085 1.248 1.00 . A A . 25 ARG HA 1 1 18 11201 1 1 25 ARG HB2 H 1.641 -9.410 2.191 1.00 . A A . 25 ARG HB2 1 1 18 11202 1 1 25 ARG HB3 H 3.281 -9.214 2.796 1.00 . A A . 25 ARG HB3 1 1 18 11203 1 1 25 ARG HD2 H 0.137 -6.869 3.238 1.00 . A A . 25 ARG HD2 1 1 18 11204 1 1 25 ARG HD3 H -0.104 -8.610 3.109 1.00 . A A . 25 ARG HD3 1 1 18 11205 1 1 25 ARG HE H 0.253 -8.052 5.798 1.00 . A A . 25 ARG HE 1 1 18 11206 1 1 25 ARG HG2 H 2.039 -8.672 4.645 1.00 . A A . 25 ARG HG2 1 1 18 11207 1 1 25 ARG HG3 H 2.311 -7.081 3.932 1.00 . A A . 25 ARG HG3 1 1 18 11208 1 1 25 ARG HH11 H -2.002 -7.236 3.275 1.00 . A A . 25 ARG HH11 1 1 18 11209 1 1 25 ARG HH12 H -3.345 -7.054 4.354 1.00 . A A . 25 ARG HH12 1 1 18 11210 1 1 25 ARG HH21 H -1.507 -7.815 7.229 1.00 . A A . 25 ARG HH21 1 1 18 11211 1 1 25 ARG HH22 H -3.062 -7.383 6.604 1.00 . A A . 25 ARG HH22 1 1 18 11212 1 1 25 ARG N N 2.950 -8.419 0.173 1.00 . A A . 25 ARG N 1 1 18 11213 1 1 25 ARG NE N -0.308 -7.831 5.026 1.00 . A A . 25 ARG NE 1 1 18 11214 1 1 25 ARG NH1 N -2.378 -7.258 4.201 1.00 . A A . 25 ARG NH1 1 1 18 11215 1 1 25 ARG NH2 N -2.095 -7.588 6.454 1.00 . A A . 25 ARG NH2 1 1 18 11216 1 1 25 ARG O O 3.667 -5.622 2.073 1.00 . A A . 25 ARG O 1 1 18 11217 1 1 26 SER C C 6.358 -5.370 1.364 1.00 . A A . 26 SER C 1 1 18 11218 1 1 26 SER CA C 6.240 -6.647 2.190 1.00 . A A . 26 SER CA 1 1 18 11219 1 1 26 SER CB C 7.483 -7.516 1.986 1.00 . A A . 26 SER CB 1 1 18 11220 1 1 26 SER H H 5.113 -8.341 1.602 1.00 . A A . 26 SER H 1 1 18 11221 1 1 26 SER HA H 6.164 -6.381 3.234 1.00 . A A . 26 SER HA 1 1 18 11222 1 1 26 SER HB2 H 7.600 -7.732 0.935 1.00 . A A . 26 SER HB2 1 1 18 11223 1 1 26 SER HB3 H 8.352 -6.985 2.344 1.00 . A A . 26 SER HB3 1 1 18 11224 1 1 26 SER HG H 7.418 -9.472 2.075 1.00 . A A . 26 SER HG 1 1 18 11225 1 1 26 SER N N 5.038 -7.390 1.828 1.00 . A A . 26 SER N 1 1 18 11226 1 1 26 SER O O 6.688 -4.307 1.888 1.00 . A A . 26 SER O 1 1 18 11227 1 1 26 SER OG O 7.371 -8.739 2.693 1.00 . A A . 26 SER OG 1 1 18 11228 1 1 27 ASN C C 5.182 -3.248 -0.410 1.00 . A A . 27 ASN C 1 1 18 11229 1 1 27 ASN CA C 6.162 -4.338 -0.832 1.00 . A A . 27 ASN CA 1 1 18 11230 1 1 27 ASN CB C 5.870 -4.773 -2.270 1.00 . A A . 27 ASN CB 1 1 18 11231 1 1 27 ASN CG C 6.983 -5.621 -2.855 1.00 . A A . 27 ASN CG 1 1 18 11232 1 1 27 ASN H H 5.828 -6.358 -0.292 1.00 . A A . 27 ASN H 1 1 18 11233 1 1 27 ASN HA H 7.165 -3.943 -0.782 1.00 . A A . 27 ASN HA 1 1 18 11234 1 1 27 ASN HB2 H 4.957 -5.351 -2.286 1.00 . A A . 27 ASN HB2 1 1 18 11235 1 1 27 ASN HB3 H 5.747 -3.896 -2.887 1.00 . A A . 27 ASN HB3 1 1 18 11236 1 1 27 ASN HD21 H 5.951 -5.857 -4.538 1.00 . A A . 27 ASN HD21 1 1 18 11237 1 1 27 ASN HD22 H 7.492 -6.636 -4.486 1.00 . A A . 27 ASN HD22 1 1 18 11238 1 1 27 ASN N N 6.086 -5.483 0.068 1.00 . A A . 27 ASN N 1 1 18 11239 1 1 27 ASN ND2 N 6.789 -6.084 -4.084 1.00 . A A . 27 ASN ND2 1 1 18 11240 1 1 27 ASN O O 5.528 -2.067 -0.372 1.00 . A A . 27 ASN O 1 1 18 11241 1 1 27 ASN OD1 O 8.004 -5.855 -2.209 1.00 . A A . 27 ASN OD1 1 1 18 11242 1 1 28 LEU C C 3.342 -1.980 1.602 1.00 . A A . 28 LEU C 1 1 18 11243 1 1 28 LEU CA C 2.925 -2.711 0.329 1.00 . A A . 28 LEU CA 1 1 18 11244 1 1 28 LEU CB C 1.601 -3.443 0.558 1.00 . A A . 28 LEU CB 1 1 18 11245 1 1 28 LEU CD1 C 0.041 -1.502 0.267 1.00 . A A . 28 LEU CD1 1 1 18 11246 1 1 28 LEU CD2 C -0.696 -3.514 1.558 1.00 . A A . 28 LEU CD2 1 1 18 11247 1 1 28 LEU CG C 0.482 -2.621 1.198 1.00 . A A . 28 LEU CG 1 1 18 11248 1 1 28 LEU H H 3.740 -4.607 -0.141 1.00 . A A . 28 LEU H 1 1 18 11249 1 1 28 LEU HA H 2.795 -1.987 -0.461 1.00 . A A . 28 LEU HA 1 1 18 11250 1 1 28 LEU HB2 H 1.248 -3.793 -0.400 1.00 . A A . 28 LEU HB2 1 1 18 11251 1 1 28 LEU HB3 H 1.799 -4.290 1.198 1.00 . A A . 28 LEU HB3 1 1 18 11252 1 1 28 LEU HD11 H 0.868 -0.830 0.095 1.00 . A A . 28 LEU HD11 1 1 18 11253 1 1 28 LEU HD12 H -0.777 -0.960 0.717 1.00 . A A . 28 LEU HD12 1 1 18 11254 1 1 28 LEU HD13 H -0.282 -1.924 -0.674 1.00 . A A . 28 LEU HD13 1 1 18 11255 1 1 28 LEU HD21 H -0.642 -3.777 2.604 1.00 . A A . 28 LEU HD21 1 1 18 11256 1 1 28 LEU HD22 H -0.663 -4.412 0.958 1.00 . A A . 28 LEU HD22 1 1 18 11257 1 1 28 LEU HD23 H -1.619 -2.986 1.365 1.00 . A A . 28 LEU HD23 1 1 18 11258 1 1 28 LEU HG H 0.851 -2.170 2.109 1.00 . A A . 28 LEU HG 1 1 18 11259 1 1 28 LEU N N 3.957 -3.653 -0.092 1.00 . A A . 28 LEU N 1 1 18 11260 1 1 28 LEU O O 3.450 -0.754 1.619 1.00 . A A . 28 LEU O 1 1 18 11261 1 1 29 PHE C C 5.140 -1.191 3.756 1.00 . A A . 29 PHE C 1 1 18 11262 1 1 29 PHE CA C 3.982 -2.167 3.942 1.00 . A A . 29 PHE CA 1 1 18 11263 1 1 29 PHE CB C 4.386 -3.274 4.919 1.00 . A A . 29 PHE CB 1 1 18 11264 1 1 29 PHE CD1 C 2.192 -4.491 4.928 1.00 . A A . 29 PHE CD1 1 1 18 11265 1 1 29 PHE CD2 C 3.157 -3.878 7.021 1.00 . A A . 29 PHE CD2 1 1 18 11266 1 1 29 PHE CE1 C 1.119 -5.062 5.587 1.00 . A A . 29 PHE CE1 1 1 18 11267 1 1 29 PHE CE2 C 2.086 -4.448 7.685 1.00 . A A . 29 PHE CE2 1 1 18 11268 1 1 29 PHE CG C 3.222 -3.893 5.637 1.00 . A A . 29 PHE CG 1 1 18 11269 1 1 29 PHE CZ C 1.067 -5.041 6.967 1.00 . A A . 29 PHE CZ 1 1 18 11270 1 1 29 PHE H H 3.473 -3.714 2.589 1.00 . A A . 29 PHE H 1 1 18 11271 1 1 29 PHE HA H 3.138 -1.632 4.348 1.00 . A A . 29 PHE HA 1 1 18 11272 1 1 29 PHE HB2 H 4.894 -4.056 4.375 1.00 . A A . 29 PHE HB2 1 1 18 11273 1 1 29 PHE HB3 H 5.055 -2.863 5.660 1.00 . A A . 29 PHE HB3 1 1 18 11274 1 1 29 PHE HD1 H 2.232 -4.510 3.849 1.00 . A A . 29 PHE HD1 1 1 18 11275 1 1 29 PHE HD2 H 3.955 -3.415 7.584 1.00 . A A . 29 PHE HD2 1 1 18 11276 1 1 29 PHE HE1 H 0.323 -5.525 5.023 1.00 . A A . 29 PHE HE1 1 1 18 11277 1 1 29 PHE HE2 H 2.049 -4.429 8.764 1.00 . A A . 29 PHE HE2 1 1 18 11278 1 1 29 PHE HZ H 0.229 -5.485 7.484 1.00 . A A . 29 PHE HZ 1 1 18 11279 1 1 29 PHE N N 3.576 -2.742 2.665 1.00 . A A . 29 PHE N 1 1 18 11280 1 1 29 PHE O O 5.191 -0.140 4.395 1.00 . A A . 29 PHE O 1 1 18 11281 1 1 30 THR C C 6.809 0.629 1.995 1.00 . A A . 30 THR C 1 1 18 11282 1 1 30 THR CA C 7.228 -0.704 2.604 1.00 . A A . 30 THR CA 1 1 18 11283 1 1 30 THR CB C 8.220 -1.401 1.653 1.00 . A A . 30 THR CB 1 1 18 11284 1 1 30 THR CG2 C 9.443 -0.529 1.412 1.00 . A A . 30 THR CG2 1 1 18 11285 1 1 30 THR H H 5.974 -2.396 2.396 1.00 . A A . 30 THR H 1 1 18 11286 1 1 30 THR HA H 7.732 -0.518 3.542 1.00 . A A . 30 THR HA 1 1 18 11287 1 1 30 THR HB H 7.727 -1.573 0.707 1.00 . A A . 30 THR HB 1 1 18 11288 1 1 30 THR HG1 H 7.929 -3.000 2.770 1.00 . A A . 30 THR HG1 1 1 18 11289 1 1 30 THR HG21 H 9.185 0.506 1.580 1.00 . A A . 30 THR HG21 1 1 18 11290 1 1 30 THR HG22 H 9.780 -0.655 0.394 1.00 . A A . 30 THR HG22 1 1 18 11291 1 1 30 THR HG23 H 10.231 -0.818 2.091 1.00 . A A . 30 THR HG23 1 1 18 11292 1 1 30 THR N N 6.070 -1.546 2.875 1.00 . A A . 30 THR N 1 1 18 11293 1 1 30 THR O O 7.370 1.676 2.320 1.00 . A A . 30 THR O 1 1 18 11294 1 1 30 THR OG1 O 8.626 -2.659 2.205 1.00 . A A . 30 THR OG1 1 1 18 11295 1 1 31 HIS C C 4.546 2.661 1.438 1.00 . A A . 31 HIS C 1 1 18 11296 1 1 31 HIS CA C 5.322 1.789 0.455 1.00 . A A . 31 HIS CA 1 1 18 11297 1 1 31 HIS CB C 4.432 1.421 -0.732 1.00 . A A . 31 HIS CB 1 1 18 11298 1 1 31 HIS CD2 C 2.180 2.700 -0.577 1.00 . A A . 31 HIS CD2 1 1 18 11299 1 1 31 HIS CE1 C 2.572 4.225 -2.102 1.00 . A A . 31 HIS CE1 1 1 18 11300 1 1 31 HIS CG C 3.420 2.473 -1.070 1.00 . A A . 31 HIS CG 1 1 18 11301 1 1 31 HIS H H 5.411 -0.280 0.892 1.00 . A A . 31 HIS H 1 1 18 11302 1 1 31 HIS HA H 6.174 2.346 0.096 1.00 . A A . 31 HIS HA 1 1 18 11303 1 1 31 HIS HB2 H 5.051 1.265 -1.603 1.00 . A A . 31 HIS HB2 1 1 18 11304 1 1 31 HIS HB3 H 3.900 0.509 -0.505 1.00 . A A . 31 HIS HB3 1 1 18 11305 1 1 31 HIS HD1 H 4.447 3.548 -2.563 1.00 . A A . 31 HIS HD1 1 1 18 11306 1 1 31 HIS HD2 H 1.681 2.127 0.192 1.00 . A A . 31 HIS HD2 1 1 18 11307 1 1 31 HIS HE1 H 2.456 5.071 -2.763 1.00 . A A . 31 HIS HE1 1 1 18 11308 1 1 31 HIS N N 5.818 0.584 1.110 1.00 . A A . 31 HIS N 1 1 18 11309 1 1 31 HIS ND1 N 3.635 3.445 -2.025 1.00 . A A . 31 HIS ND1 1 1 18 11310 1 1 31 HIS NE2 N 1.675 3.795 -1.234 1.00 . A A . 31 HIS NE2 1 1 18 11311 1 1 31 HIS O O 4.782 3.865 1.534 1.00 . A A . 31 HIS O 1 1 18 11312 1 1 32 GLN C C 3.648 3.785 3.899 1.00 . A A . 32 GLN C 1 1 18 11313 1 1 32 GLN CA C 2.808 2.764 3.138 1.00 . A A . 32 GLN CA 1 1 18 11314 1 1 32 GLN CB C 2.162 1.785 4.120 1.00 . A A . 32 GLN CB 1 1 18 11315 1 1 32 GLN CD C 0.155 0.358 4.685 1.00 . A A . 32 GLN CD 1 1 18 11316 1 1 32 GLN CG C 0.800 1.282 3.671 1.00 . A A . 32 GLN CG 1 1 18 11317 1 1 32 GLN H H 3.479 1.082 2.043 1.00 . A A . 32 GLN H 1 1 18 11318 1 1 32 GLN HA H 2.031 3.286 2.601 1.00 . A A . 32 GLN HA 1 1 18 11319 1 1 32 GLN HB2 H 2.815 0.933 4.242 1.00 . A A . 32 GLN HB2 1 1 18 11320 1 1 32 GLN HB3 H 2.043 2.276 5.074 1.00 . A A . 32 GLN HB3 1 1 18 11321 1 1 32 GLN HE21 H -0.804 -0.605 3.234 1.00 . A A . 32 GLN HE21 1 1 18 11322 1 1 32 GLN HE22 H -1.094 -1.180 4.837 1.00 . A A . 32 GLN HE22 1 1 18 11323 1 1 32 GLN HG2 H 0.150 2.131 3.516 1.00 . A A . 32 GLN HG2 1 1 18 11324 1 1 32 GLN HG3 H 0.918 0.746 2.740 1.00 . A A . 32 GLN HG3 1 1 18 11325 1 1 32 GLN N N 3.620 2.044 2.165 1.00 . A A . 32 GLN N 1 1 18 11326 1 1 32 GLN NE2 N -0.665 -0.569 4.204 1.00 . A A . 32 GLN NE2 1 1 18 11327 1 1 32 GLN O O 3.129 4.781 4.403 1.00 . A A . 32 GLN O 1 1 18 11328 1 1 32 GLN OE1 O 0.391 0.477 5.888 1.00 . A A . 32 GLN OE1 1 1 18 11329 1 1 33 LYS C C 5.682 5.866 4.203 1.00 . A A . 33 LYS C 1 1 18 11330 1 1 33 LYS CA C 5.864 4.427 4.675 1.00 . A A . 33 LYS CA 1 1 18 11331 1 1 33 LYS CB C 7.313 3.986 4.453 1.00 . A A . 33 LYS CB 1 1 18 11332 1 1 33 LYS CD C 9.084 2.245 4.831 1.00 . A A . 33 LYS CD 1 1 18 11333 1 1 33 LYS CE C 9.563 1.158 5.780 1.00 . A A . 33 LYS CE 1 1 18 11334 1 1 33 LYS CG C 7.670 2.692 5.164 1.00 . A A . 33 LYS CG 1 1 18 11335 1 1 33 LYS H H 5.305 2.720 3.555 1.00 . A A . 33 LYS H 1 1 18 11336 1 1 33 LYS HA H 5.639 4.376 5.730 1.00 . A A . 33 LYS HA 1 1 18 11337 1 1 33 LYS HB2 H 7.476 3.849 3.395 1.00 . A A . 33 LYS HB2 1 1 18 11338 1 1 33 LYS HB3 H 7.972 4.763 4.812 1.00 . A A . 33 LYS HB3 1 1 18 11339 1 1 33 LYS HD2 H 9.103 1.860 3.822 1.00 . A A . 33 LYS HD2 1 1 18 11340 1 1 33 LYS HD3 H 9.748 3.095 4.906 1.00 . A A . 33 LYS HD3 1 1 18 11341 1 1 33 LYS HE2 H 9.951 1.623 6.673 1.00 . A A . 33 LYS HE2 1 1 18 11342 1 1 33 LYS HE3 H 8.724 0.528 6.038 1.00 . A A . 33 LYS HE3 1 1 18 11343 1 1 33 LYS HG2 H 7.594 2.844 6.230 1.00 . A A . 33 LYS HG2 1 1 18 11344 1 1 33 LYS HG3 H 6.977 1.921 4.858 1.00 . A A . 33 LYS HG3 1 1 18 11345 1 1 33 LYS HZ1 H 10.470 -0.684 5.396 1.00 . A A . 33 LYS HZ1 1 1 18 11346 1 1 33 LYS HZ2 H 11.561 0.602 5.534 1.00 . A A . 33 LYS HZ2 1 1 18 11347 1 1 33 LYS HZ3 H 10.626 0.432 4.135 1.00 . A A . 33 LYS HZ3 1 1 18 11348 1 1 33 LYS N N 4.950 3.531 3.978 1.00 . A A . 33 LYS N 1 1 18 11349 1 1 33 LYS NZ N 10.629 0.318 5.168 1.00 . A A . 33 LYS NZ 1 1 18 11350 1 1 33 LYS O O 5.639 6.794 5.012 1.00 . A A . 33 LYS O 1 1 18 11351 1 1 34 ILE C C 4.255 8.118 2.997 1.00 . A A . 34 ILE C 1 1 18 11352 1 1 34 ILE CA C 5.393 7.370 2.312 1.00 . A A . 34 ILE CA 1 1 18 11353 1 1 34 ILE CB C 5.104 7.290 0.802 1.00 . A A . 34 ILE CB 1 1 18 11354 1 1 34 ILE CD1 C 3.061 7.125 -0.707 1.00 . A A . 34 ILE CD1 1 1 18 11355 1 1 34 ILE CG1 C 3.741 6.642 0.555 1.00 . A A . 34 ILE CG1 1 1 18 11356 1 1 34 ILE CG2 C 6.203 6.513 0.092 1.00 . A A . 34 ILE CG2 1 1 18 11357 1 1 34 ILE H H 5.616 5.265 2.298 1.00 . A A . 34 ILE H 1 1 18 11358 1 1 34 ILE HA H 6.311 7.923 2.454 1.00 . A A . 34 ILE HA 1 1 18 11359 1 1 34 ILE HB H 5.094 8.294 0.406 1.00 . A A . 34 ILE HB 1 1 18 11360 1 1 34 ILE HD11 H 3.534 6.671 -1.567 1.00 . A A . 34 ILE HD11 1 1 18 11361 1 1 34 ILE HD12 H 2.018 6.847 -0.684 1.00 . A A . 34 ILE HD12 1 1 18 11362 1 1 34 ILE HD13 H 3.148 8.199 -0.775 1.00 . A A . 34 ILE HD13 1 1 18 11363 1 1 34 ILE HG12 H 3.866 5.573 0.474 1.00 . A A . 34 ILE HG12 1 1 18 11364 1 1 34 ILE HG13 H 3.090 6.862 1.388 1.00 . A A . 34 ILE HG13 1 1 18 11365 1 1 34 ILE HG21 H 5.765 5.886 -0.671 1.00 . A A . 34 ILE HG21 1 1 18 11366 1 1 34 ILE HG22 H 6.895 7.204 -0.364 1.00 . A A . 34 ILE HG22 1 1 18 11367 1 1 34 ILE HG23 H 6.727 5.896 0.807 1.00 . A A . 34 ILE HG23 1 1 18 11368 1 1 34 ILE N N 5.574 6.044 2.891 1.00 . A A . 34 ILE N 1 1 18 11369 1 1 34 ILE O O 4.184 9.346 2.943 1.00 . A A . 34 ILE O 1 1 18 11370 1 1 35 HIS C C 2.605 8.321 5.779 1.00 . A A . 35 HIS C 1 1 18 11371 1 1 35 HIS CA C 2.232 7.963 4.343 1.00 . A A . 35 HIS CA 1 1 18 11372 1 1 35 HIS CB C 1.044 7.001 4.338 1.00 . A A . 35 HIS CB 1 1 18 11373 1 1 35 HIS CD2 C 0.883 5.882 2.003 1.00 . A A . 35 HIS CD2 1 1 18 11374 1 1 35 HIS CE1 C -0.859 6.974 1.244 1.00 . A A . 35 HIS CE1 1 1 18 11375 1 1 35 HIS CG C 0.489 6.743 2.971 1.00 . A A . 35 HIS CG 1 1 18 11376 1 1 35 HIS H H 3.478 6.396 3.652 1.00 . A A . 35 HIS H 1 1 18 11377 1 1 35 HIS HA H 1.956 8.866 3.821 1.00 . A A . 35 HIS HA 1 1 18 11378 1 1 35 HIS HB2 H 1.354 6.054 4.754 1.00 . A A . 35 HIS HB2 1 1 18 11379 1 1 35 HIS HB3 H 0.252 7.414 4.946 1.00 . A A . 35 HIS HB3 1 1 18 11380 1 1 35 HIS HD1 H -1.118 8.105 2.929 1.00 . A A . 35 HIS HD1 1 1 18 11381 1 1 35 HIS HD2 H 1.716 5.194 2.057 1.00 . A A . 35 HIS HD2 1 1 18 11382 1 1 35 HIS HE1 H -1.658 7.317 0.602 1.00 . A A . 35 HIS HE1 1 1 18 11383 1 1 35 HIS N N 3.367 7.370 3.644 1.00 . A A . 35 HIS N 1 1 18 11384 1 1 35 HIS ND1 N -0.604 7.413 2.463 1.00 . A A . 35 HIS ND1 1 1 18 11385 1 1 35 HIS NE2 N 0.030 6.045 0.940 1.00 . A A . 35 HIS NE2 1 1 18 11386 1 1 35 HIS O O 2.241 9.385 6.280 1.00 . A A . 35 HIS O 1 1 18 11387 1 1 36 THR C C 5.215 8.075 7.882 1.00 . A A . 36 THR C 1 1 18 11388 1 1 36 THR CA C 3.754 7.644 7.815 1.00 . A A . 36 THR CA 1 1 18 11389 1 1 36 THR CB C 3.564 6.377 8.670 1.00 . A A . 36 THR CB 1 1 18 11390 1 1 36 THR CG2 C 4.376 5.219 8.109 1.00 . A A . 36 THR CG2 1 1 18 11391 1 1 36 THR H H 3.592 6.595 5.984 1.00 . A A . 36 THR H 1 1 18 11392 1 1 36 THR HA H 3.138 8.429 8.231 1.00 . A A . 36 THR HA 1 1 18 11393 1 1 36 THR HB H 2.519 6.105 8.655 1.00 . A A . 36 THR HB 1 1 18 11394 1 1 36 THR HG1 H 4.612 7.340 10.035 1.00 . A A . 36 THR HG1 1 1 18 11395 1 1 36 THR HG21 H 5.004 4.810 8.886 1.00 . A A . 36 THR HG21 1 1 18 11396 1 1 36 THR HG22 H 4.994 5.573 7.296 1.00 . A A . 36 THR HG22 1 1 18 11397 1 1 36 THR HG23 H 3.707 4.453 7.745 1.00 . A A . 36 THR HG23 1 1 18 11398 1 1 36 THR N N 3.333 7.424 6.437 1.00 . A A . 36 THR N 1 1 18 11399 1 1 36 THR O O 6.098 7.266 8.166 1.00 . A A . 36 THR O 1 1 18 11400 1 1 36 THR OG1 O 3.961 6.634 10.022 1.00 . A A . 36 THR OG1 1 1 18 11401 1 1 37 GLY C C 6.955 11.196 6.935 1.00 . A A . 37 GLY C 1 1 18 11402 1 1 37 GLY CA C 6.819 9.870 7.655 1.00 . A A . 37 GLY CA 1 1 18 11403 1 1 37 GLY H H 4.719 9.953 7.398 1.00 . A A . 37 GLY H 1 1 18 11404 1 1 37 GLY HA2 H 7.116 9.999 8.685 1.00 . A A . 37 GLY HA2 1 1 18 11405 1 1 37 GLY HA3 H 7.477 9.151 7.189 1.00 . A A . 37 GLY HA3 1 1 18 11406 1 1 37 GLY N N 5.463 9.354 7.619 1.00 . A A . 37 GLY N 1 1 18 11407 1 1 37 GLY O O 6.739 11.278 5.726 1.00 . A A . 37 GLY O 1 1 18 11408 1 1 38 GLU C C 8.925 14.025 7.186 1.00 . A A . 38 GLU C 1 1 18 11409 1 1 38 GLU CA C 7.472 13.569 7.104 1.00 . A A . 38 GLU CA 1 1 18 11410 1 1 38 GLU CB C 6.569 14.573 7.824 1.00 . A A . 38 GLU CB 1 1 18 11411 1 1 38 GLU CD C 5.791 15.420 10.073 1.00 . A A . 38 GLU CD 1 1 18 11412 1 1 38 GLU CG C 6.905 14.746 9.296 1.00 . A A . 38 GLU CG 1 1 18 11413 1 1 38 GLU H H 7.468 12.110 8.638 1.00 . A A . 38 GLU H 1 1 18 11414 1 1 38 GLU HA H 7.181 13.518 6.066 1.00 . A A . 38 GLU HA 1 1 18 11415 1 1 38 GLU HB2 H 6.661 15.533 7.339 1.00 . A A . 38 GLU HB2 1 1 18 11416 1 1 38 GLU HB3 H 5.545 14.237 7.748 1.00 . A A . 38 GLU HB3 1 1 18 11417 1 1 38 GLU HG2 H 7.086 13.774 9.728 1.00 . A A . 38 GLU HG2 1 1 18 11418 1 1 38 GLU HG3 H 7.798 15.348 9.380 1.00 . A A . 38 GLU HG3 1 1 18 11419 1 1 38 GLU N N 7.311 12.239 7.680 1.00 . A A . 38 GLU N 1 1 18 11420 1 1 38 GLU O O 9.647 13.673 8.120 1.00 . A A . 38 GLU O 1 1 18 11421 1 1 38 GLU OE1 O 4.652 14.908 10.041 1.00 . A A . 38 GLU OE1 1 1 18 11422 1 1 38 GLU OE2 O 6.057 16.459 10.713 1.00 . A A . 38 GLU OE2 1 1 18 11423 1 1 39 LYS C C 10.731 16.840 6.100 1.00 . A A . 39 LYS C 1 1 18 11424 1 1 39 LYS CA C 10.716 15.316 6.160 1.00 . A A . 39 LYS CA 1 1 18 11425 1 1 39 LYS CB C 11.459 14.740 4.952 1.00 . A A . 39 LYS CB 1 1 18 11426 1 1 39 LYS CD C 12.797 12.751 4.203 1.00 . A A . 39 LYS CD 1 1 18 11427 1 1 39 LYS CE C 14.029 12.679 5.093 1.00 . A A . 39 LYS CE 1 1 18 11428 1 1 39 LYS CG C 11.579 13.226 4.977 1.00 . A A . 39 LYS CG 1 1 18 11429 1 1 39 LYS H H 8.727 15.056 5.485 1.00 . A A . 39 LYS H 1 1 18 11430 1 1 39 LYS HA H 11.215 14.999 7.063 1.00 . A A . 39 LYS HA 1 1 18 11431 1 1 39 LYS HB2 H 10.933 15.024 4.053 1.00 . A A . 39 LYS HB2 1 1 18 11432 1 1 39 LYS HB3 H 12.455 15.159 4.924 1.00 . A A . 39 LYS HB3 1 1 18 11433 1 1 39 LYS HD2 H 12.598 11.768 3.804 1.00 . A A . 39 LYS HD2 1 1 18 11434 1 1 39 LYS HD3 H 12.989 13.439 3.392 1.00 . A A . 39 LYS HD3 1 1 18 11435 1 1 39 LYS HE2 H 14.383 13.682 5.277 1.00 . A A . 39 LYS HE2 1 1 18 11436 1 1 39 LYS HE3 H 13.754 12.216 6.029 1.00 . A A . 39 LYS HE3 1 1 18 11437 1 1 39 LYS HG2 H 11.667 12.898 6.002 1.00 . A A . 39 LYS HG2 1 1 18 11438 1 1 39 LYS HG3 H 10.692 12.797 4.534 1.00 . A A . 39 LYS HG3 1 1 18 11439 1 1 39 LYS HZ1 H 15.483 11.179 5.134 1.00 . A A . 39 LYS HZ1 1 1 18 11440 1 1 39 LYS HZ2 H 15.904 12.516 4.185 1.00 . A A . 39 LYS HZ2 1 1 18 11441 1 1 39 LYS HZ3 H 14.768 11.399 3.616 1.00 . A A . 39 LYS HZ3 1 1 18 11442 1 1 39 LYS N N 9.349 14.810 6.201 1.00 . A A . 39 LYS N 1 1 18 11443 1 1 39 LYS NZ N 15.122 11.888 4.463 1.00 . A A . 39 LYS NZ 1 1 18 11444 1 1 39 LYS O O 10.893 17.442 5.038 1.00 . A A . 39 LYS O 1 1 18 11445 1 1 40 PRO C C 11.927 19.550 7.129 1.00 . A A . 40 PRO C 1 1 18 11446 1 1 40 PRO CA C 10.549 18.943 7.372 1.00 . A A . 40 PRO CA 1 1 18 11447 1 1 40 PRO CB C 10.102 19.191 8.814 1.00 . A A . 40 PRO CB 1 1 18 11448 1 1 40 PRO CD C 10.359 16.827 8.570 1.00 . A A . 40 PRO CD 1 1 18 11449 1 1 40 PRO CG C 10.497 17.959 9.551 1.00 . A A . 40 PRO CG 1 1 18 11450 1 1 40 PRO HA H 9.837 19.386 6.691 1.00 . A A . 40 PRO HA 1 1 18 11451 1 1 40 PRO HB2 H 10.605 20.065 9.205 1.00 . A A . 40 PRO HB2 1 1 18 11452 1 1 40 PRO HB3 H 9.033 19.342 8.842 1.00 . A A . 40 PRO HB3 1 1 18 11453 1 1 40 PRO HD2 H 11.118 16.080 8.747 1.00 . A A . 40 PRO HD2 1 1 18 11454 1 1 40 PRO HD3 H 9.373 16.390 8.635 1.00 . A A . 40 PRO HD3 1 1 18 11455 1 1 40 PRO HG2 H 11.520 18.042 9.885 1.00 . A A . 40 PRO HG2 1 1 18 11456 1 1 40 PRO HG3 H 9.837 17.807 10.393 1.00 . A A . 40 PRO HG3 1 1 18 11457 1 1 40 PRO N N 10.558 17.481 7.266 1.00 . A A . 40 PRO N 1 1 18 11458 1 1 40 PRO O O 12.914 18.831 6.975 1.00 . A A . 40 PRO O 1 1 18 11459 1 1 41 SER C C 13.947 21.877 8.192 1.00 . A A . 41 SER C 1 1 18 11460 1 1 41 SER CA C 13.244 21.581 6.871 1.00 . A A . 41 SER CA 1 1 18 11461 1 1 41 SER CB C 12.993 22.884 6.110 1.00 . A A . 41 SER CB 1 1 18 11462 1 1 41 SER H H 11.165 21.395 7.227 1.00 . A A . 41 SER H 1 1 18 11463 1 1 41 SER HA H 13.878 20.942 6.274 1.00 . A A . 41 SER HA 1 1 18 11464 1 1 41 SER HB2 H 12.351 22.687 5.265 1.00 . A A . 41 SER HB2 1 1 18 11465 1 1 41 SER HB3 H 12.514 23.595 6.768 1.00 . A A . 41 SER HB3 1 1 18 11466 1 1 41 SER HG H 14.340 23.196 4.723 1.00 . A A . 41 SER HG 1 1 18 11467 1 1 41 SER N N 11.987 20.877 7.098 1.00 . A A . 41 SER N 1 1 18 11468 1 1 41 SER O O 14.455 22.977 8.405 1.00 . A A . 41 SER O 1 1 18 11469 1 1 41 SER OG O 14.208 23.443 5.641 1.00 . A A . 41 SER OG 1 1 18 11470 1 1 42 GLY C C 14.461 22.467 10.907 1.00 . A A . 42 GLY C 1 1 18 11471 1 1 42 GLY CA C 14.613 21.058 10.368 1.00 . A A . 42 GLY CA 1 1 18 11472 1 1 42 GLY H H 13.549 20.030 8.854 1.00 . A A . 42 GLY H 1 1 18 11473 1 1 42 GLY HA2 H 14.175 20.366 11.071 1.00 . A A . 42 GLY HA2 1 1 18 11474 1 1 42 GLY HA3 H 15.665 20.836 10.266 1.00 . A A . 42 GLY HA3 1 1 18 11475 1 1 42 GLY N N 13.971 20.885 9.078 1.00 . A A . 42 GLY N 1 1 18 11476 1 1 42 GLY O O 15.424 23.230 10.989 1.00 . A A . 42 GLY O 1 1 18 11477 1 1 43 PRO C C 13.515 24.371 13.211 1.00 . A A . 43 PRO C 1 1 18 11478 1 1 43 PRO CA C 12.923 24.160 11.822 1.00 . A A . 43 PRO CA 1 1 18 11479 1 1 43 PRO CB C 11.394 24.176 11.885 1.00 . A A . 43 PRO CB 1 1 18 11480 1 1 43 PRO CD C 12.032 21.973 11.213 1.00 . A A . 43 PRO CD 1 1 18 11481 1 1 43 PRO CG C 11.004 22.743 11.994 1.00 . A A . 43 PRO CG 1 1 18 11482 1 1 43 PRO HA H 13.266 24.944 11.163 1.00 . A A . 43 PRO HA 1 1 18 11483 1 1 43 PRO HB2 H 11.072 24.741 12.749 1.00 . A A . 43 PRO HB2 1 1 18 11484 1 1 43 PRO HB3 H 10.998 24.626 10.986 1.00 . A A . 43 PRO HB3 1 1 18 11485 1 1 43 PRO HD2 H 12.218 21.015 11.675 1.00 . A A . 43 PRO HD2 1 1 18 11486 1 1 43 PRO HD3 H 11.710 21.845 10.190 1.00 . A A . 43 PRO HD3 1 1 18 11487 1 1 43 PRO HG2 H 11.013 22.438 13.029 1.00 . A A . 43 PRO HG2 1 1 18 11488 1 1 43 PRO HG3 H 10.022 22.596 11.567 1.00 . A A . 43 PRO HG3 1 1 18 11489 1 1 43 PRO N N 13.227 22.831 11.283 1.00 . A A . 43 PRO N 1 1 18 11490 1 1 43 PRO O O 14.175 25.378 13.469 1.00 . A A . 43 PRO O 1 1 18 11491 1 1 44 SER C C 14.926 22.512 15.684 1.00 . A A . 44 SER C 1 1 18 11492 1 1 44 SER CA C 13.783 23.499 15.468 1.00 . A A . 44 SER CA 1 1 18 11493 1 1 44 SER CB C 12.660 23.224 16.470 1.00 . A A . 44 SER CB 1 1 18 11494 1 1 44 SER H H 12.743 22.637 13.838 1.00 . A A . 44 SER H 1 1 18 11495 1 1 44 SER HA H 14.154 24.501 15.623 1.00 . A A . 44 SER HA 1 1 18 11496 1 1 44 SER HB2 H 11.889 23.970 16.357 1.00 . A A . 44 SER HB2 1 1 18 11497 1 1 44 SER HB3 H 12.244 22.245 16.280 1.00 . A A . 44 SER HB3 1 1 18 11498 1 1 44 SER HG H 13.956 22.757 17.863 1.00 . A A . 44 SER HG 1 1 18 11499 1 1 44 SER N N 13.276 23.415 14.103 1.00 . A A . 44 SER N 1 1 18 11500 1 1 44 SER O O 15.958 22.856 16.261 1.00 . A A . 44 SER O 1 1 18 11501 1 1 44 SER OG O 13.143 23.264 17.801 1.00 . A A . 44 SER OG 1 1 18 11502 1 1 45 SER C C 15.865 19.799 16.816 1.00 . A A . 45 SER C 1 1 18 11503 1 1 45 SER CA C 15.746 20.243 15.361 1.00 . A A . 45 SER CA 1 1 18 11504 1 1 45 SER CB C 17.100 20.746 14.858 1.00 . A A . 45 SER CB 1 1 18 11505 1 1 45 SER H H 13.890 21.069 14.766 1.00 . A A . 45 SER H 1 1 18 11506 1 1 45 SER HA H 15.441 19.397 14.763 1.00 . A A . 45 SER HA 1 1 18 11507 1 1 45 SER HB2 H 16.944 21.454 14.058 1.00 . A A . 45 SER HB2 1 1 18 11508 1 1 45 SER HB3 H 17.626 21.230 15.669 1.00 . A A . 45 SER HB3 1 1 18 11509 1 1 45 SER HG H 17.498 19.321 13.574 1.00 . A A . 45 SER HG 1 1 18 11510 1 1 45 SER N N 14.734 21.282 15.217 1.00 . A A . 45 SER N 1 1 18 11511 1 1 45 SER O O 16.966 19.592 17.326 1.00 . A A . 45 SER O 1 1 18 11512 1 1 45 SER OG O 17.894 19.677 14.373 1.00 . A A . 45 SER OG 1 1 18 11513 1 1 46 GLY C C 13.597 18.265 19.180 1.00 . A A . 46 GLY C 1 1 18 11514 1 1 46 GLY CA C 14.719 19.237 18.869 1.00 . A A . 46 GLY CA 1 1 18 11515 1 1 46 GLY H H 13.874 19.834 17.022 1.00 . A A . 46 GLY H 1 1 18 11516 1 1 46 GLY HA2 H 15.663 18.764 19.094 1.00 . A A . 46 GLY HA2 1 1 18 11517 1 1 46 GLY HA3 H 14.606 20.110 19.496 1.00 . A A . 46 GLY HA3 1 1 18 11518 1 1 46 GLY N N 14.722 19.655 17.480 1.00 . A A . 46 GLY N 1 1 18 11519 1 1 46 GLY O O 12.433 18.612 18.983 1.00 . A A . 46 GLY O 1 1 18 11520 2 2 1 ZN ZN ZN -0.116 4.500 -0.464 1.00 . B A . 201 ZN ZN 1 1 19 11521 1 1 1 GLY C C -12.839 11.201 -4.398 1.00 . A A . 1 GLY C 1 1 19 11522 1 1 1 GLY CA C -14.170 11.656 -4.965 1.00 . A A . 1 GLY CA 1 1 19 11523 1 1 1 GLY H1 H -15.650 13.070 -4.424 1.00 . A A . 1 GLY H1 1 1 19 11524 1 1 1 GLY HA2 H -14.813 10.796 -5.081 1.00 . A A . 1 GLY HA2 1 1 19 11525 1 1 1 GLY HA3 H -14.002 12.101 -5.934 1.00 . A A . 1 GLY HA3 1 1 19 11526 1 1 1 GLY N N -14.833 12.626 -4.113 1.00 . A A . 1 GLY N 1 1 19 11527 1 1 1 GLY O O -11.811 11.839 -4.623 1.00 . A A . 1 GLY O 1 1 19 11528 1 1 2 SER C C -11.186 8.301 -3.784 1.00 . A A . 2 SER C 1 1 19 11529 1 1 2 SER CA C -11.645 9.560 -3.055 1.00 . A A . 2 SER CA 1 1 19 11530 1 1 2 SER CB C -11.882 9.249 -1.576 1.00 . A A . 2 SER CB 1 1 19 11531 1 1 2 SER H H -13.710 9.632 -3.517 1.00 . A A . 2 SER H 1 1 19 11532 1 1 2 SER HA H -10.874 10.311 -3.137 1.00 . A A . 2 SER HA 1 1 19 11533 1 1 2 SER HB2 H -12.317 10.111 -1.095 1.00 . A A . 2 SER HB2 1 1 19 11534 1 1 2 SER HB3 H -12.558 8.410 -1.491 1.00 . A A . 2 SER HB3 1 1 19 11535 1 1 2 SER HG H -10.722 9.184 0.001 1.00 . A A . 2 SER HG 1 1 19 11536 1 1 2 SER N N -12.859 10.096 -3.660 1.00 . A A . 2 SER N 1 1 19 11537 1 1 2 SER O O -10.052 8.223 -4.258 1.00 . A A . 2 SER O 1 1 19 11538 1 1 2 SER OG O -10.667 8.926 -0.922 1.00 . A A . 2 SER OG 1 1 19 11539 1 1 3 SER C C -12.326 6.038 -5.952 1.00 . A A . 3 SER C 1 1 19 11540 1 1 3 SER CA C -11.760 6.058 -4.536 1.00 . A A . 3 SER CA 1 1 19 11541 1 1 3 SER CB C -12.317 4.879 -3.736 1.00 . A A . 3 SER CB 1 1 19 11542 1 1 3 SER H H -12.962 7.438 -3.470 1.00 . A A . 3 SER H 1 1 19 11543 1 1 3 SER HA H -10.685 5.970 -4.589 1.00 . A A . 3 SER HA 1 1 19 11544 1 1 3 SER HB2 H -12.010 3.954 -4.200 1.00 . A A . 3 SER HB2 1 1 19 11545 1 1 3 SER HB3 H -11.934 4.919 -2.726 1.00 . A A . 3 SER HB3 1 1 19 11546 1 1 3 SER HG H -14.088 4.100 -4.042 1.00 . A A . 3 SER HG 1 1 19 11547 1 1 3 SER N N -12.074 7.316 -3.868 1.00 . A A . 3 SER N 1 1 19 11548 1 1 3 SER O O -13.513 5.786 -6.156 1.00 . A A . 3 SER O 1 1 19 11549 1 1 3 SER OG O -13.733 4.918 -3.688 1.00 . A A . 3 SER OG 1 1 19 11550 1 1 4 GLY C C -10.997 5.484 -9.208 1.00 . A A . 4 GLY C 1 1 19 11551 1 1 4 GLY CA C -11.897 6.315 -8.316 1.00 . A A . 4 GLY CA 1 1 19 11552 1 1 4 GLY H H -10.531 6.500 -6.709 1.00 . A A . 4 GLY H 1 1 19 11553 1 1 4 GLY HA2 H -12.902 5.924 -8.371 1.00 . A A . 4 GLY HA2 1 1 19 11554 1 1 4 GLY HA3 H -11.898 7.334 -8.674 1.00 . A A . 4 GLY HA3 1 1 19 11555 1 1 4 GLY N N -11.466 6.306 -6.930 1.00 . A A . 4 GLY N 1 1 19 11556 1 1 4 GLY O O -10.450 4.469 -8.777 1.00 . A A . 4 GLY O 1 1 19 11557 1 1 5 SER C C -8.610 5.805 -11.474 1.00 . A A . 5 SER C 1 1 19 11558 1 1 5 SER CA C -10.008 5.198 -11.414 1.00 . A A . 5 SER CA 1 1 19 11559 1 1 5 SER CB C -10.649 5.227 -12.803 1.00 . A A . 5 SER CB 1 1 19 11560 1 1 5 SER H H -11.306 6.729 -10.741 1.00 . A A . 5 SER H 1 1 19 11561 1 1 5 SER HA H -9.929 4.173 -11.084 1.00 . A A . 5 SER HA 1 1 19 11562 1 1 5 SER HB2 H -11.713 5.073 -12.709 1.00 . A A . 5 SER HB2 1 1 19 11563 1 1 5 SER HB3 H -10.462 6.186 -13.263 1.00 . A A . 5 SER HB3 1 1 19 11564 1 1 5 SER HG H -9.197 4.414 -13.838 1.00 . A A . 5 SER HG 1 1 19 11565 1 1 5 SER N N -10.844 5.913 -10.457 1.00 . A A . 5 SER N 1 1 19 11566 1 1 5 SER O O -8.048 5.993 -12.553 1.00 . A A . 5 SER O 1 1 19 11567 1 1 5 SER OG O -10.112 4.211 -13.633 1.00 . A A . 5 SER OG 1 1 19 11568 1 1 6 SER C C -5.707 5.679 -9.714 1.00 . A A . 6 SER C 1 1 19 11569 1 1 6 SER CA C -6.721 6.698 -10.224 1.00 . A A . 6 SER CA 1 1 19 11570 1 1 6 SER CB C -6.738 7.922 -9.306 1.00 . A A . 6 SER CB 1 1 19 11571 1 1 6 SER H H -8.551 5.935 -9.480 1.00 . A A . 6 SER H 1 1 19 11572 1 1 6 SER HA H -6.434 7.008 -11.218 1.00 . A A . 6 SER HA 1 1 19 11573 1 1 6 SER HB2 H -7.148 7.644 -8.347 1.00 . A A . 6 SER HB2 1 1 19 11574 1 1 6 SER HB3 H -5.728 8.283 -9.175 1.00 . A A . 6 SER HB3 1 1 19 11575 1 1 6 SER HG H -7.652 9.651 -9.200 1.00 . A A . 6 SER HG 1 1 19 11576 1 1 6 SER N N -8.053 6.109 -10.306 1.00 . A A . 6 SER N 1 1 19 11577 1 1 6 SER O O -4.849 5.998 -8.892 1.00 . A A . 6 SER O 1 1 19 11578 1 1 6 SER OG O -7.527 8.962 -9.857 1.00 . A A . 6 SER OG 1 1 19 11579 1 1 7 GLY C C -5.527 2.024 -9.863 1.00 . A A . 7 GLY C 1 1 19 11580 1 1 7 GLY CA C -4.899 3.401 -9.793 1.00 . A A . 7 GLY CA 1 1 19 11581 1 1 7 GLY H H -6.516 4.252 -10.862 1.00 . A A . 7 GLY H 1 1 19 11582 1 1 7 GLY HA2 H -4.029 3.422 -10.433 1.00 . A A . 7 GLY HA2 1 1 19 11583 1 1 7 GLY HA3 H -4.590 3.592 -8.776 1.00 . A A . 7 GLY HA3 1 1 19 11584 1 1 7 GLY N N -5.812 4.449 -10.209 1.00 . A A . 7 GLY N 1 1 19 11585 1 1 7 GLY O O -5.625 1.325 -8.854 1.00 . A A . 7 GLY O 1 1 19 11586 1 1 8 THR C C -5.563 -0.798 -11.106 1.00 . A A . 8 THR C 1 1 19 11587 1 1 8 THR CA C -6.580 0.328 -11.256 1.00 . A A . 8 THR CA 1 1 19 11588 1 1 8 THR CB C -7.240 0.227 -12.644 1.00 . A A . 8 THR CB 1 1 19 11589 1 1 8 THR CG2 C -6.197 0.316 -13.748 1.00 . A A . 8 THR CG2 1 1 19 11590 1 1 8 THR H H -5.849 2.232 -11.825 1.00 . A A . 8 THR H 1 1 19 11591 1 1 8 THR HA H -7.348 0.209 -10.506 1.00 . A A . 8 THR HA 1 1 19 11592 1 1 8 THR HB H -7.933 1.048 -12.757 1.00 . A A . 8 THR HB 1 1 19 11593 1 1 8 THR HG1 H -7.694 -1.596 -12.045 1.00 . A A . 8 THR HG1 1 1 19 11594 1 1 8 THR HG21 H -6.374 1.201 -14.339 1.00 . A A . 8 THR HG21 1 1 19 11595 1 1 8 THR HG22 H -6.264 -0.558 -14.379 1.00 . A A . 8 THR HG22 1 1 19 11596 1 1 8 THR HG23 H -5.212 0.367 -13.308 1.00 . A A . 8 THR HG23 1 1 19 11597 1 1 8 THR N N -5.955 1.630 -11.059 1.00 . A A . 8 THR N 1 1 19 11598 1 1 8 THR O O -4.399 -0.649 -11.475 1.00 . A A . 8 THR O 1 1 19 11599 1 1 8 THR OG1 O -7.956 -1.008 -12.757 1.00 . A A . 8 THR OG1 1 1 19 11600 1 1 9 GLY C C -5.855 -4.280 -9.843 1.00 . A A . 9 GLY C 1 1 19 11601 1 1 9 GLY CA C -5.127 -3.061 -10.374 1.00 . A A . 9 GLY CA 1 1 19 11602 1 1 9 GLY H H -6.950 -1.987 -10.288 1.00 . A A . 9 GLY H 1 1 19 11603 1 1 9 GLY HA2 H -4.672 -3.310 -11.321 1.00 . A A . 9 GLY HA2 1 1 19 11604 1 1 9 GLY HA3 H -4.352 -2.786 -9.675 1.00 . A A . 9 GLY HA3 1 1 19 11605 1 1 9 GLY N N -6.011 -1.925 -10.563 1.00 . A A . 9 GLY N 1 1 19 11606 1 1 9 GLY O O -6.762 -4.160 -9.021 1.00 . A A . 9 GLY O 1 1 19 11607 1 1 10 GLU C C -5.141 -7.496 -8.980 1.00 . A A . 10 GLU C 1 1 19 11608 1 1 10 GLU CA C -6.080 -6.703 -9.885 1.00 . A A . 10 GLU CA 1 1 19 11609 1 1 10 GLU CB C -6.473 -7.549 -11.098 1.00 . A A . 10 GLU CB 1 1 19 11610 1 1 10 GLU CD C -8.211 -8.061 -12.857 1.00 . A A . 10 GLU CD 1 1 19 11611 1 1 10 GLU CG C -7.826 -7.181 -11.684 1.00 . A A . 10 GLU CG 1 1 19 11612 1 1 10 GLU H H -4.728 -5.488 -10.970 1.00 . A A . 10 GLU H 1 1 19 11613 1 1 10 GLU HA H -6.970 -6.453 -9.328 1.00 . A A . 10 GLU HA 1 1 19 11614 1 1 10 GLU HB2 H -5.724 -7.424 -11.866 1.00 . A A . 10 GLU HB2 1 1 19 11615 1 1 10 GLU HB3 H -6.502 -8.587 -10.802 1.00 . A A . 10 GLU HB3 1 1 19 11616 1 1 10 GLU HG2 H -8.577 -7.284 -10.915 1.00 . A A . 10 GLU HG2 1 1 19 11617 1 1 10 GLU HG3 H -7.792 -6.155 -12.017 1.00 . A A . 10 GLU HG3 1 1 19 11618 1 1 10 GLU N N -5.457 -5.457 -10.316 1.00 . A A . 10 GLU N 1 1 19 11619 1 1 10 GLU O O -5.061 -8.721 -9.070 1.00 . A A . 10 GLU O 1 1 19 11620 1 1 10 GLU OE1 O -7.326 -8.369 -13.683 1.00 . A A . 10 GLU OE1 1 1 19 11621 1 1 10 GLU OE2 O -9.397 -8.440 -12.951 1.00 . A A . 10 GLU OE2 1 1 19 11622 1 1 11 LYS C C -4.170 -7.719 -5.849 1.00 . A A . 11 LYS C 1 1 19 11623 1 1 11 LYS CA C -3.497 -7.423 -7.186 1.00 . A A . 11 LYS CA 1 1 19 11624 1 1 11 LYS CB C -2.275 -6.528 -6.968 1.00 . A A . 11 LYS CB 1 1 19 11625 1 1 11 LYS CD C -1.177 -7.349 -9.072 1.00 . A A . 11 LYS CD 1 1 19 11626 1 1 11 LYS CE C -0.116 -8.176 -8.362 1.00 . A A . 11 LYS CE 1 1 19 11627 1 1 11 LYS CG C -1.574 -6.131 -8.255 1.00 . A A . 11 LYS CG 1 1 19 11628 1 1 11 LYS H H -4.538 -5.814 -8.085 1.00 . A A . 11 LYS H 1 1 19 11629 1 1 11 LYS HA H -3.176 -8.355 -7.628 1.00 . A A . 11 LYS HA 1 1 19 11630 1 1 11 LYS HB2 H -2.590 -5.628 -6.461 1.00 . A A . 11 LYS HB2 1 1 19 11631 1 1 11 LYS HB3 H -1.567 -7.053 -6.343 1.00 . A A . 11 LYS HB3 1 1 19 11632 1 1 11 LYS HD2 H -2.050 -7.965 -9.232 1.00 . A A . 11 LYS HD2 1 1 19 11633 1 1 11 LYS HD3 H -0.787 -7.021 -10.026 1.00 . A A . 11 LYS HD3 1 1 19 11634 1 1 11 LYS HE2 H 0.724 -7.539 -8.132 1.00 . A A . 11 LYS HE2 1 1 19 11635 1 1 11 LYS HE3 H -0.535 -8.563 -7.445 1.00 . A A . 11 LYS HE3 1 1 19 11636 1 1 11 LYS HG2 H -2.240 -5.518 -8.843 1.00 . A A . 11 LYS HG2 1 1 19 11637 1 1 11 LYS HG3 H -0.685 -5.568 -8.011 1.00 . A A . 11 LYS HG3 1 1 19 11638 1 1 11 LYS HZ1 H 1.284 -9.096 -9.610 1.00 . A A . 11 LYS HZ1 1 1 19 11639 1 1 11 LYS HZ2 H -0.321 -9.491 -9.971 1.00 . A A . 11 LYS HZ2 1 1 19 11640 1 1 11 LYS HZ3 H 0.434 -10.174 -8.621 1.00 . A A . 11 LYS HZ3 1 1 19 11641 1 1 11 LYS N N -4.431 -6.788 -8.109 1.00 . A A . 11 LYS N 1 1 19 11642 1 1 11 LYS NZ N 0.353 -9.314 -9.200 1.00 . A A . 11 LYS NZ 1 1 19 11643 1 1 11 LYS O O -5.113 -7.043 -5.439 1.00 . A A . 11 LYS O 1 1 19 11644 1 1 12 PRO C C -3.904 -8.144 -2.754 1.00 . A A . 12 PRO C 1 1 19 11645 1 1 12 PRO CA C -4.210 -9.159 -3.850 1.00 . A A . 12 PRO CA 1 1 19 11646 1 1 12 PRO CB C -3.494 -10.482 -3.569 1.00 . A A . 12 PRO CB 1 1 19 11647 1 1 12 PRO CD C -2.549 -9.601 -5.580 1.00 . A A . 12 PRO CD 1 1 19 11648 1 1 12 PRO CG C -2.227 -10.400 -4.348 1.00 . A A . 12 PRO CG 1 1 19 11649 1 1 12 PRO HA H -5.276 -9.327 -3.895 1.00 . A A . 12 PRO HA 1 1 19 11650 1 1 12 PRO HB2 H -3.302 -10.572 -2.509 1.00 . A A . 12 PRO HB2 1 1 19 11651 1 1 12 PRO HB3 H -4.108 -11.305 -3.901 1.00 . A A . 12 PRO HB3 1 1 19 11652 1 1 12 PRO HD2 H -1.701 -9.000 -5.873 1.00 . A A . 12 PRO HD2 1 1 19 11653 1 1 12 PRO HD3 H -2.847 -10.255 -6.387 1.00 . A A . 12 PRO HD3 1 1 19 11654 1 1 12 PRO HG2 H -1.469 -9.900 -3.764 1.00 . A A . 12 PRO HG2 1 1 19 11655 1 1 12 PRO HG3 H -1.899 -11.392 -4.620 1.00 . A A . 12 PRO HG3 1 1 19 11656 1 1 12 PRO N N -3.673 -8.752 -5.152 1.00 . A A . 12 PRO N 1 1 19 11657 1 1 12 PRO O O -4.519 -8.163 -1.687 1.00 . A A . 12 PRO O 1 1 19 11658 1 1 13 TYR C C -2.723 -4.840 -2.649 1.00 . A A . 13 TYR C 1 1 19 11659 1 1 13 TYR CA C -2.561 -6.238 -2.058 1.00 . A A . 13 TYR CA 1 1 19 11660 1 1 13 TYR CB C -1.113 -6.451 -1.614 1.00 . A A . 13 TYR CB 1 1 19 11661 1 1 13 TYR CD1 C -1.124 -8.278 0.130 1.00 . A A . 13 TYR CD1 1 1 19 11662 1 1 13 TYR CD2 C -0.239 -8.785 -2.025 1.00 . A A . 13 TYR CD2 1 1 19 11663 1 1 13 TYR CE1 C -0.857 -9.567 0.548 1.00 . A A . 13 TYR CE1 1 1 19 11664 1 1 13 TYR CE2 C 0.030 -10.076 -1.616 1.00 . A A . 13 TYR CE2 1 1 19 11665 1 1 13 TYR CG C -0.820 -7.864 -1.162 1.00 . A A . 13 TYR CG 1 1 19 11666 1 1 13 TYR CZ C -0.281 -10.463 -0.329 1.00 . A A . 13 TYR CZ 1 1 19 11667 1 1 13 TYR H H -2.495 -7.295 -3.890 1.00 . A A . 13 TYR H 1 1 19 11668 1 1 13 TYR HA H -3.208 -6.330 -1.198 1.00 . A A . 13 TYR HA 1 1 19 11669 1 1 13 TYR HB2 H -0.453 -6.224 -2.438 1.00 . A A . 13 TYR HB2 1 1 19 11670 1 1 13 TYR HB3 H -0.894 -5.787 -0.791 1.00 . A A . 13 TYR HB3 1 1 19 11671 1 1 13 TYR HD1 H -1.575 -7.574 0.814 1.00 . A A . 13 TYR HD1 1 1 19 11672 1 1 13 TYR HD2 H 0.004 -8.478 -3.032 1.00 . A A . 13 TYR HD2 1 1 19 11673 1 1 13 TYR HE1 H -1.101 -9.870 1.555 1.00 . A A . 13 TYR HE1 1 1 19 11674 1 1 13 TYR HE2 H 0.481 -10.778 -2.302 1.00 . A A . 13 TYR HE2 1 1 19 11675 1 1 13 TYR HH H 0.505 -11.724 0.890 1.00 . A A . 13 TYR HH 1 1 19 11676 1 1 13 TYR N N -2.950 -7.259 -3.023 1.00 . A A . 13 TYR N 1 1 19 11677 1 1 13 TYR O O -2.267 -4.567 -3.759 1.00 . A A . 13 TYR O 1 1 19 11678 1 1 13 TYR OH O -0.014 -11.748 0.083 1.00 . A A . 13 TYR OH 1 1 19 11679 1 1 14 ARG C C -3.515 -1.615 -1.175 1.00 . A A . 14 ARG C 1 1 19 11680 1 1 14 ARG CA C -3.598 -2.590 -2.345 1.00 . A A . 14 ARG CA 1 1 19 11681 1 1 14 ARG CB C -4.963 -2.470 -3.027 1.00 . A A . 14 ARG CB 1 1 19 11682 1 1 14 ARG CD C -6.199 -0.540 -1.996 1.00 . A A . 14 ARG CD 1 1 19 11683 1 1 14 ARG CG C -5.428 -1.035 -3.210 1.00 . A A . 14 ARG CG 1 1 19 11684 1 1 14 ARG CZ C -8.447 -0.890 -1.065 1.00 . A A . 14 ARG CZ 1 1 19 11685 1 1 14 ARG H H -3.715 -4.237 -1.021 1.00 . A A . 14 ARG H 1 1 19 11686 1 1 14 ARG HA H -2.827 -2.345 -3.059 1.00 . A A . 14 ARG HA 1 1 19 11687 1 1 14 ARG HB2 H -4.908 -2.935 -4.000 1.00 . A A . 14 ARG HB2 1 1 19 11688 1 1 14 ARG HB3 H -5.697 -2.990 -2.430 1.00 . A A . 14 ARG HB3 1 1 19 11689 1 1 14 ARG HD2 H -5.817 -1.036 -1.117 1.00 . A A . 14 ARG HD2 1 1 19 11690 1 1 14 ARG HD3 H -6.049 0.525 -1.902 1.00 . A A . 14 ARG HD3 1 1 19 11691 1 1 14 ARG HE H -7.998 -0.938 -3.007 1.00 . A A . 14 ARG HE 1 1 19 11692 1 1 14 ARG HG2 H -4.565 -0.402 -3.357 1.00 . A A . 14 ARG HG2 1 1 19 11693 1 1 14 ARG HG3 H -6.068 -0.982 -4.078 1.00 . A A . 14 ARG HG3 1 1 19 11694 1 1 14 ARG HH11 H -7.005 -0.532 0.305 1.00 . A A . 14 ARG HH11 1 1 19 11695 1 1 14 ARG HH12 H -8.594 -0.781 0.948 1.00 . A A . 14 ARG HH12 1 1 19 11696 1 1 14 ARG HH21 H -10.095 -1.267 -2.172 1.00 . A A . 14 ARG HH21 1 1 19 11697 1 1 14 ARG HH22 H -10.351 -1.200 -0.462 1.00 . A A . 14 ARG HH22 1 1 19 11698 1 1 14 ARG N N -3.375 -3.959 -1.897 1.00 . A A . 14 ARG N 1 1 19 11699 1 1 14 ARG NE N -7.629 -0.810 -2.109 1.00 . A A . 14 ARG NE 1 1 19 11700 1 1 14 ARG NH1 N -7.977 -0.721 0.164 1.00 . A A . 14 ARG NH1 1 1 19 11701 1 1 14 ARG NH2 N -9.737 -1.140 -1.248 1.00 . A A . 14 ARG NH2 1 1 19 11702 1 1 14 ARG O O -3.790 -1.976 -0.031 1.00 . A A . 14 ARG O 1 1 19 11703 1 1 15 CYS C C -4.312 1.438 -0.305 1.00 . A A . 15 CYS C 1 1 19 11704 1 1 15 CYS CA C -3.011 0.651 -0.443 1.00 . A A . 15 CYS CA 1 1 19 11705 1 1 15 CYS CB C -1.860 1.602 -0.778 1.00 . A A . 15 CYS CB 1 1 19 11706 1 1 15 CYS H H -2.927 -0.148 -2.401 1.00 . A A . 15 CYS H 1 1 19 11707 1 1 15 CYS HA H -2.801 0.161 0.495 1.00 . A A . 15 CYS HA 1 1 19 11708 1 1 15 CYS HB2 H -1.007 1.023 -1.098 1.00 . A A . 15 CYS HB2 1 1 19 11709 1 1 15 CYS HB3 H -2.166 2.257 -1.580 1.00 . A A . 15 CYS HB3 1 1 19 11710 1 1 15 CYS N N -3.133 -0.377 -1.470 1.00 . A A . 15 CYS N 1 1 19 11711 1 1 15 CYS O O -4.694 2.188 -1.203 1.00 . A A . 15 CYS O 1 1 19 11712 1 1 15 CYS SG S -1.327 2.644 0.618 1.00 . A A . 15 CYS SG 1 1 19 11713 1 1 16 ALA C C -6.016 3.455 1.249 1.00 . A A . 16 ALA C 1 1 19 11714 1 1 16 ALA CA C -6.242 1.956 1.084 1.00 . A A . 16 ALA CA 1 1 19 11715 1 1 16 ALA CB C -6.918 1.383 2.320 1.00 . A A . 16 ALA CB 1 1 19 11716 1 1 16 ALA H H -4.630 0.651 1.505 1.00 . A A . 16 ALA H 1 1 19 11717 1 1 16 ALA HA H -6.894 1.791 0.238 1.00 . A A . 16 ALA HA 1 1 19 11718 1 1 16 ALA HB1 H -6.523 0.398 2.522 1.00 . A A . 16 ALA HB1 1 1 19 11719 1 1 16 ALA HB2 H -6.728 2.028 3.165 1.00 . A A . 16 ALA HB2 1 1 19 11720 1 1 16 ALA HB3 H -7.982 1.316 2.149 1.00 . A A . 16 ALA HB3 1 1 19 11721 1 1 16 ALA N N -4.986 1.261 0.826 1.00 . A A . 16 ALA N 1 1 19 11722 1 1 16 ALA O O -6.951 4.247 1.144 1.00 . A A . 16 ALA O 1 1 19 11723 1 1 17 GLU C C -4.497 5.995 0.366 1.00 . A A . 17 GLU C 1 1 19 11724 1 1 17 GLU CA C -4.422 5.241 1.690 1.00 . A A . 17 GLU CA 1 1 19 11725 1 1 17 GLU CB C -3.018 5.370 2.285 1.00 . A A . 17 GLU CB 1 1 19 11726 1 1 17 GLU CD C -3.410 5.883 4.727 1.00 . A A . 17 GLU CD 1 1 19 11727 1 1 17 GLU CG C -2.915 4.868 3.715 1.00 . A A . 17 GLU CG 1 1 19 11728 1 1 17 GLU H H -4.066 3.157 1.581 1.00 . A A . 17 GLU H 1 1 19 11729 1 1 17 GLU HA H -5.135 5.672 2.377 1.00 . A A . 17 GLU HA 1 1 19 11730 1 1 17 GLU HB2 H -2.329 4.804 1.675 1.00 . A A . 17 GLU HB2 1 1 19 11731 1 1 17 GLU HB3 H -2.729 6.410 2.269 1.00 . A A . 17 GLU HB3 1 1 19 11732 1 1 17 GLU HG2 H -3.505 3.969 3.811 1.00 . A A . 17 GLU HG2 1 1 19 11733 1 1 17 GLU HG3 H -1.880 4.643 3.930 1.00 . A A . 17 GLU HG3 1 1 19 11734 1 1 17 GLU N N -4.769 3.836 1.509 1.00 . A A . 17 GLU N 1 1 19 11735 1 1 17 GLU O O -5.251 6.959 0.229 1.00 . A A . 17 GLU O 1 1 19 11736 1 1 17 GLU OE1 O -4.411 6.571 4.434 1.00 . A A . 17 GLU OE1 1 1 19 11737 1 1 17 GLU OE2 O -2.798 5.989 5.810 1.00 . A A . 17 GLU OE2 1 1 19 11738 1 1 18 CYS C C -4.524 5.391 -2.921 1.00 . A A . 18 CYS C 1 1 19 11739 1 1 18 CYS CA C -3.684 6.181 -1.921 1.00 . A A . 18 CYS CA 1 1 19 11740 1 1 18 CYS CB C -2.244 6.296 -2.427 1.00 . A A . 18 CYS CB 1 1 19 11741 1 1 18 CYS H H -3.130 4.776 -0.438 1.00 . A A . 18 CYS H 1 1 19 11742 1 1 18 CYS HA H -4.101 7.171 -1.821 1.00 . A A . 18 CYS HA 1 1 19 11743 1 1 18 CYS HB2 H -2.258 6.613 -3.460 1.00 . A A . 18 CYS HB2 1 1 19 11744 1 1 18 CYS HB3 H -1.722 7.034 -1.837 1.00 . A A . 18 CYS HB3 1 1 19 11745 1 1 18 CYS N N -3.709 5.549 -0.607 1.00 . A A . 18 CYS N 1 1 19 11746 1 1 18 CYS O O -5.345 5.957 -3.641 1.00 . A A . 18 CYS O 1 1 19 11747 1 1 18 CYS SG S -1.298 4.742 -2.338 1.00 . A A . 18 CYS SG 1 1 19 11748 1 1 19 GLY C C -4.173 2.607 -4.933 1.00 . A A . 19 GLY C 1 1 19 11749 1 1 19 GLY CA C -5.056 3.233 -3.872 1.00 . A A . 19 GLY CA 1 1 19 11750 1 1 19 GLY H H -3.644 3.683 -2.360 1.00 . A A . 19 GLY H 1 1 19 11751 1 1 19 GLY HA2 H -5.536 2.447 -3.308 1.00 . A A . 19 GLY HA2 1 1 19 11752 1 1 19 GLY HA3 H -5.816 3.828 -4.357 1.00 . A A . 19 GLY HA3 1 1 19 11753 1 1 19 GLY N N -4.312 4.079 -2.958 1.00 . A A . 19 GLY N 1 1 19 11754 1 1 19 GLY O O -4.551 2.535 -6.103 1.00 . A A . 19 GLY O 1 1 19 11755 1 1 20 LYS C C -2.099 0.012 -5.332 1.00 . A A . 20 LYS C 1 1 19 11756 1 1 20 LYS CA C -2.051 1.532 -5.449 1.00 . A A . 20 LYS CA 1 1 19 11757 1 1 20 LYS CB C -0.630 2.031 -5.175 1.00 . A A . 20 LYS CB 1 1 19 11758 1 1 20 LYS CD C 1.716 2.307 -6.029 1.00 . A A . 20 LYS CD 1 1 19 11759 1 1 20 LYS CE C 2.809 1.646 -6.854 1.00 . A A . 20 LYS CE 1 1 19 11760 1 1 20 LYS CG C 0.370 1.636 -6.248 1.00 . A A . 20 LYS CG 1 1 19 11761 1 1 20 LYS H H -2.748 2.241 -3.580 1.00 . A A . 20 LYS H 1 1 19 11762 1 1 20 LYS HA H -2.335 1.813 -6.452 1.00 . A A . 20 LYS HA 1 1 19 11763 1 1 20 LYS HB2 H -0.647 3.108 -5.106 1.00 . A A . 20 LYS HB2 1 1 19 11764 1 1 20 LYS HB3 H -0.295 1.623 -4.232 1.00 . A A . 20 LYS HB3 1 1 19 11765 1 1 20 LYS HD2 H 1.642 3.345 -6.315 1.00 . A A . 20 LYS HD2 1 1 19 11766 1 1 20 LYS HD3 H 1.976 2.238 -4.982 1.00 . A A . 20 LYS HD3 1 1 19 11767 1 1 20 LYS HE2 H 2.849 0.598 -6.601 1.00 . A A . 20 LYS HE2 1 1 19 11768 1 1 20 LYS HE3 H 2.566 1.754 -7.901 1.00 . A A . 20 LYS HE3 1 1 19 11769 1 1 20 LYS HG2 H 0.506 0.565 -6.225 1.00 . A A . 20 LYS HG2 1 1 19 11770 1 1 20 LYS HG3 H -0.016 1.932 -7.213 1.00 . A A . 20 LYS HG3 1 1 19 11771 1 1 20 LYS HZ1 H 4.703 1.645 -5.975 1.00 . A A . 20 LYS HZ1 1 1 19 11772 1 1 20 LYS HZ2 H 4.029 3.187 -6.147 1.00 . A A . 20 LYS HZ2 1 1 19 11773 1 1 20 LYS HZ3 H 4.655 2.382 -7.496 1.00 . A A . 20 LYS HZ3 1 1 19 11774 1 1 20 LYS N N -2.992 2.155 -4.526 1.00 . A A . 20 LYS N 1 1 19 11775 1 1 20 LYS NZ N 4.143 2.258 -6.600 1.00 . A A . 20 LYS NZ 1 1 19 11776 1 1 20 LYS O O -2.581 -0.528 -4.337 1.00 . A A . 20 LYS O 1 1 19 11777 1 1 21 ALA C C -0.200 -2.664 -5.987 1.00 . A A . 21 ALA C 1 1 19 11778 1 1 21 ALA CA C -1.578 -2.129 -6.364 1.00 . A A . 21 ALA CA 1 1 19 11779 1 1 21 ALA CB C -1.993 -2.653 -7.731 1.00 . A A . 21 ALA CB 1 1 19 11780 1 1 21 ALA H H -1.225 -0.184 -7.119 1.00 . A A . 21 ALA H 1 1 19 11781 1 1 21 ALA HA H -2.299 -2.477 -5.638 1.00 . A A . 21 ALA HA 1 1 19 11782 1 1 21 ALA HB1 H -1.546 -3.622 -7.896 1.00 . A A . 21 ALA HB1 1 1 19 11783 1 1 21 ALA HB2 H -3.069 -2.741 -7.770 1.00 . A A . 21 ALA HB2 1 1 19 11784 1 1 21 ALA HB3 H -1.660 -1.967 -8.495 1.00 . A A . 21 ALA HB3 1 1 19 11785 1 1 21 ALA N N -1.595 -0.672 -6.354 1.00 . A A . 21 ALA N 1 1 19 11786 1 1 21 ALA O O 0.822 -2.062 -6.316 1.00 . A A . 21 ALA O 1 1 19 11787 1 1 22 PHE C C 1.019 -5.928 -5.043 1.00 . A A . 22 PHE C 1 1 19 11788 1 1 22 PHE CA C 1.072 -4.413 -4.870 1.00 . A A . 22 PHE CA 1 1 19 11789 1 1 22 PHE CB C 1.367 -4.065 -3.409 1.00 . A A . 22 PHE CB 1 1 19 11790 1 1 22 PHE CD1 C 0.581 -1.710 -3.047 1.00 . A A . 22 PHE CD1 1 1 19 11791 1 1 22 PHE CD2 C 2.928 -2.125 -3.104 1.00 . A A . 22 PHE CD2 1 1 19 11792 1 1 22 PHE CE1 C 0.821 -0.365 -2.839 1.00 . A A . 22 PHE CE1 1 1 19 11793 1 1 22 PHE CE2 C 3.174 -0.780 -2.896 1.00 . A A . 22 PHE CE2 1 1 19 11794 1 1 22 PHE CG C 1.631 -2.604 -3.182 1.00 . A A . 22 PHE CG 1 1 19 11795 1 1 22 PHE CZ C 2.119 0.100 -2.762 1.00 . A A . 22 PHE CZ 1 1 19 11796 1 1 22 PHE H H -1.029 -4.231 -5.061 1.00 . A A . 22 PHE H 1 1 19 11797 1 1 22 PHE HA H 1.861 -4.019 -5.491 1.00 . A A . 22 PHE HA 1 1 19 11798 1 1 22 PHE HB2 H 0.520 -4.347 -2.801 1.00 . A A . 22 PHE HB2 1 1 19 11799 1 1 22 PHE HB3 H 2.237 -4.615 -3.084 1.00 . A A . 22 PHE HB3 1 1 19 11800 1 1 22 PHE HD1 H -0.435 -2.072 -3.105 1.00 . A A . 22 PHE HD1 1 1 19 11801 1 1 22 PHE HD2 H 3.755 -2.813 -3.209 1.00 . A A . 22 PHE HD2 1 1 19 11802 1 1 22 PHE HE1 H -0.006 0.322 -2.734 1.00 . A A . 22 PHE HE1 1 1 19 11803 1 1 22 PHE HE2 H 4.191 -0.421 -2.837 1.00 . A A . 22 PHE HE2 1 1 19 11804 1 1 22 PHE HZ H 2.309 1.151 -2.600 1.00 . A A . 22 PHE HZ 1 1 19 11805 1 1 22 PHE N N -0.181 -3.798 -5.293 1.00 . A A . 22 PHE N 1 1 19 11806 1 1 22 PHE O O -0.021 -6.553 -4.834 1.00 . A A . 22 PHE O 1 1 19 11807 1 1 23 THR C C 2.226 -8.698 -4.300 1.00 . A A . 23 THR C 1 1 19 11808 1 1 23 THR CA C 2.233 -7.954 -5.630 1.00 . A A . 23 THR CA 1 1 19 11809 1 1 23 THR CB C 3.503 -8.338 -6.413 1.00 . A A . 23 THR CB 1 1 19 11810 1 1 23 THR CG2 C 3.661 -7.465 -7.649 1.00 . A A . 23 THR CG2 1 1 19 11811 1 1 23 THR H H 2.945 -5.961 -5.577 1.00 . A A . 23 THR H 1 1 19 11812 1 1 23 THR HA H 1.373 -8.260 -6.208 1.00 . A A . 23 THR HA 1 1 19 11813 1 1 23 THR HB H 3.416 -9.368 -6.727 1.00 . A A . 23 THR HB 1 1 19 11814 1 1 23 THR HG1 H 4.635 -7.345 -5.139 1.00 . A A . 23 THR HG1 1 1 19 11815 1 1 23 THR HG21 H 4.414 -7.891 -8.296 1.00 . A A . 23 THR HG21 1 1 19 11816 1 1 23 THR HG22 H 3.963 -6.471 -7.352 1.00 . A A . 23 THR HG22 1 1 19 11817 1 1 23 THR HG23 H 2.720 -7.414 -8.176 1.00 . A A . 23 THR HG23 1 1 19 11818 1 1 23 THR N N 2.150 -6.513 -5.427 1.00 . A A . 23 THR N 1 1 19 11819 1 1 23 THR O O 1.502 -9.680 -4.131 1.00 . A A . 23 THR O 1 1 19 11820 1 1 23 THR OG1 O 4.656 -8.200 -5.575 1.00 . A A . 23 THR OG1 1 1 19 11821 1 1 24 ASP C C 3.019 -7.797 -0.939 1.00 . A A . 24 ASP C 1 1 19 11822 1 1 24 ASP CA C 3.120 -8.846 -2.041 1.00 . A A . 24 ASP CA 1 1 19 11823 1 1 24 ASP CB C 4.430 -9.624 -1.904 1.00 . A A . 24 ASP CB 1 1 19 11824 1 1 24 ASP CG C 5.636 -8.806 -2.324 1.00 . A A . 24 ASP CG 1 1 19 11825 1 1 24 ASP H H 3.588 -7.440 -3.553 1.00 . A A . 24 ASP H 1 1 19 11826 1 1 24 ASP HA H 2.293 -9.533 -1.944 1.00 . A A . 24 ASP HA 1 1 19 11827 1 1 24 ASP HB2 H 4.561 -9.918 -0.873 1.00 . A A . 24 ASP HB2 1 1 19 11828 1 1 24 ASP HB3 H 4.383 -10.507 -2.523 1.00 . A A . 24 ASP HB3 1 1 19 11829 1 1 24 ASP N N 3.035 -8.226 -3.358 1.00 . A A . 24 ASP N 1 1 19 11830 1 1 24 ASP O O 2.945 -6.599 -1.213 1.00 . A A . 24 ASP O 1 1 19 11831 1 1 24 ASP OD1 O 5.911 -8.736 -3.541 1.00 . A A . 24 ASP OD1 1 1 19 11832 1 1 24 ASP OD2 O 6.303 -8.235 -1.437 1.00 . A A . 24 ASP OD2 1 1 19 11833 1 1 25 ARG C C 4.192 -6.520 1.594 1.00 . A A . 25 ARG C 1 1 19 11834 1 1 25 ARG CA C 2.922 -7.356 1.453 1.00 . A A . 25 ARG CA 1 1 19 11835 1 1 25 ARG CB C 2.678 -8.152 2.736 1.00 . A A . 25 ARG CB 1 1 19 11836 1 1 25 ARG CD C 1.012 -9.428 4.118 1.00 . A A . 25 ARG CD 1 1 19 11837 1 1 25 ARG CG C 1.206 -8.363 3.050 1.00 . A A . 25 ARG CG 1 1 19 11838 1 1 25 ARG CZ C 1.232 -11.875 4.221 1.00 . A A . 25 ARG CZ 1 1 19 11839 1 1 25 ARG H H 3.079 -9.220 0.464 1.00 . A A . 25 ARG H 1 1 19 11840 1 1 25 ARG HA H 2.086 -6.693 1.286 1.00 . A A . 25 ARG HA 1 1 19 11841 1 1 25 ARG HB2 H 3.145 -9.121 2.639 1.00 . A A . 25 ARG HB2 1 1 19 11842 1 1 25 ARG HB3 H 3.129 -7.625 3.563 1.00 . A A . 25 ARG HB3 1 1 19 11843 1 1 25 ARG HD2 H 1.843 -9.387 4.805 1.00 . A A . 25 ARG HD2 1 1 19 11844 1 1 25 ARG HD3 H 0.095 -9.223 4.650 1.00 . A A . 25 ARG HD3 1 1 19 11845 1 1 25 ARG HE H 0.654 -10.850 2.611 1.00 . A A . 25 ARG HE 1 1 19 11846 1 1 25 ARG HG2 H 0.786 -7.433 3.405 1.00 . A A . 25 ARG HG2 1 1 19 11847 1 1 25 ARG HG3 H 0.696 -8.670 2.150 1.00 . A A . 25 ARG HG3 1 1 19 11848 1 1 25 ARG HH11 H 1.688 -10.907 5.935 1.00 . A A . 25 ARG HH11 1 1 19 11849 1 1 25 ARG HH12 H 1.839 -12.632 5.994 1.00 . A A . 25 ARG HH12 1 1 19 11850 1 1 25 ARG HH21 H 0.849 -13.121 2.676 1.00 . A A . 25 ARG HH21 1 1 19 11851 1 1 25 ARG HH22 H 1.363 -13.890 4.140 1.00 . A A . 25 ARG HH22 1 1 19 11852 1 1 25 ARG N N 3.017 -8.255 0.309 1.00 . A A . 25 ARG N 1 1 19 11853 1 1 25 ARG NE N 0.937 -10.770 3.545 1.00 . A A . 25 ARG NE 1 1 19 11854 1 1 25 ARG NH1 N 1.619 -11.798 5.487 1.00 . A A . 25 ARG NH1 1 1 19 11855 1 1 25 ARG NH2 N 1.140 -13.060 3.631 1.00 . A A . 25 ARG NH2 1 1 19 11856 1 1 25 ARG O O 4.145 -5.291 1.559 1.00 . A A . 25 ARG O 1 1 19 11857 1 1 26 SER C C 6.646 -5.242 1.069 1.00 . A A . 26 SER C 1 1 19 11858 1 1 26 SER CA C 6.606 -6.518 1.904 1.00 . A A . 26 SER CA 1 1 19 11859 1 1 26 SER CB C 7.751 -7.446 1.494 1.00 . A A . 26 SER CB 1 1 19 11860 1 1 26 SER H H 5.297 -8.177 1.773 1.00 . A A . 26 SER H 1 1 19 11861 1 1 26 SER HA H 6.722 -6.256 2.946 1.00 . A A . 26 SER HA 1 1 19 11862 1 1 26 SER HB2 H 7.869 -8.218 2.238 1.00 . A A . 26 SER HB2 1 1 19 11863 1 1 26 SER HB3 H 7.519 -7.898 0.540 1.00 . A A . 26 SER HB3 1 1 19 11864 1 1 26 SER HG H 9.706 -7.334 1.507 1.00 . A A . 26 SER HG 1 1 19 11865 1 1 26 SER N N 5.324 -7.197 1.754 1.00 . A A . 26 SER N 1 1 19 11866 1 1 26 SER O O 6.981 -4.169 1.570 1.00 . A A . 26 SER O 1 1 19 11867 1 1 26 SER OG O 8.969 -6.732 1.378 1.00 . A A . 26 SER OG 1 1 19 11868 1 1 27 ASN C C 5.312 -3.161 -0.646 1.00 . A A . 27 ASN C 1 1 19 11869 1 1 27 ASN CA C 6.299 -4.225 -1.115 1.00 . A A . 27 ASN CA 1 1 19 11870 1 1 27 ASN CB C 5.944 -4.675 -2.534 1.00 . A A . 27 ASN CB 1 1 19 11871 1 1 27 ASN CG C 7.092 -5.395 -3.216 1.00 . A A . 27 ASN CG 1 1 19 11872 1 1 27 ASN H H 6.045 -6.249 -0.550 1.00 . A A . 27 ASN H 1 1 19 11873 1 1 27 ASN HA H 7.292 -3.802 -1.119 1.00 . A A . 27 ASN HA 1 1 19 11874 1 1 27 ASN HB2 H 5.098 -5.345 -2.492 1.00 . A A . 27 ASN HB2 1 1 19 11875 1 1 27 ASN HB3 H 5.684 -3.810 -3.125 1.00 . A A . 27 ASN HB3 1 1 19 11876 1 1 27 ASN HD21 H 8.116 -3.695 -3.342 1.00 . A A . 27 ASN HD21 1 1 19 11877 1 1 27 ASN HD22 H 8.896 -5.092 -3.994 1.00 . A A . 27 ASN HD22 1 1 19 11878 1 1 27 ASN N N 6.302 -5.368 -0.209 1.00 . A A . 27 ASN N 1 1 19 11879 1 1 27 ASN ND2 N 8.141 -4.652 -3.551 1.00 . A A . 27 ASN ND2 1 1 19 11880 1 1 27 ASN O O 5.629 -1.971 -0.624 1.00 . A A . 27 ASN O 1 1 19 11881 1 1 27 ASN OD1 O 7.035 -6.604 -3.439 1.00 . A A . 27 ASN OD1 1 1 19 11882 1 1 28 LEU C C 3.503 -2.005 1.502 1.00 . A A . 28 LEU C 1 1 19 11883 1 1 28 LEU CA C 3.081 -2.681 0.201 1.00 . A A . 28 LEU CA 1 1 19 11884 1 1 28 LEU CB C 1.764 -3.432 0.407 1.00 . A A . 28 LEU CB 1 1 19 11885 1 1 28 LEU CD1 C 0.171 -1.504 0.231 1.00 . A A . 28 LEU CD1 1 1 19 11886 1 1 28 LEU CD2 C -0.507 -3.576 1.459 1.00 . A A . 28 LEU CD2 1 1 19 11887 1 1 28 LEU CG C 0.650 -2.652 1.107 1.00 . A A . 28 LEU CG 1 1 19 11888 1 1 28 LEU H H 3.921 -4.556 -0.308 1.00 . A A . 28 LEU H 1 1 19 11889 1 1 28 LEU HA H 2.940 -1.924 -0.555 1.00 . A A . 28 LEU HA 1 1 19 11890 1 1 28 LEU HB2 H 1.399 -3.731 -0.563 1.00 . A A . 28 LEU HB2 1 1 19 11891 1 1 28 LEU HB3 H 1.974 -4.312 0.998 1.00 . A A . 28 LEU HB3 1 1 19 11892 1 1 28 LEU HD11 H 1.007 -1.095 -0.314 1.00 . A A . 28 LEU HD11 1 1 19 11893 1 1 28 LEU HD12 H -0.266 -0.736 0.852 1.00 . A A . 28 LEU HD12 1 1 19 11894 1 1 28 LEU HD13 H -0.571 -1.868 -0.465 1.00 . A A . 28 LEU HD13 1 1 19 11895 1 1 28 LEU HD21 H -0.302 -4.067 2.398 1.00 . A A . 28 LEU HD21 1 1 19 11896 1 1 28 LEU HD22 H -0.625 -4.317 0.682 1.00 . A A . 28 LEU HD22 1 1 19 11897 1 1 28 LEU HD23 H -1.416 -2.997 1.545 1.00 . A A . 28 LEU HD23 1 1 19 11898 1 1 28 LEU HG H 1.035 -2.232 2.026 1.00 . A A . 28 LEU HG 1 1 19 11899 1 1 28 LEU N N 4.115 -3.596 -0.269 1.00 . A A . 28 LEU N 1 1 19 11900 1 1 28 LEU O O 3.604 -0.780 1.573 1.00 . A A . 28 LEU O 1 1 19 11901 1 1 29 PHE C C 5.282 -1.266 3.672 1.00 . A A . 29 PHE C 1 1 19 11902 1 1 29 PHE CA C 4.163 -2.291 3.827 1.00 . A A . 29 PHE CA 1 1 19 11903 1 1 29 PHE CB C 4.624 -3.434 4.735 1.00 . A A . 29 PHE CB 1 1 19 11904 1 1 29 PHE CD1 C 2.626 -4.945 4.873 1.00 . A A . 29 PHE CD1 1 1 19 11905 1 1 29 PHE CD2 C 3.335 -3.820 6.852 1.00 . A A . 29 PHE CD2 1 1 19 11906 1 1 29 PHE CE1 C 1.595 -5.539 5.577 1.00 . A A . 29 PHE CE1 1 1 19 11907 1 1 29 PHE CE2 C 2.306 -4.412 7.561 1.00 . A A . 29 PHE CE2 1 1 19 11908 1 1 29 PHE CG C 3.506 -4.079 5.502 1.00 . A A . 29 PHE CG 1 1 19 11909 1 1 29 PHE CZ C 1.436 -5.273 6.923 1.00 . A A . 29 PHE CZ 1 1 19 11910 1 1 29 PHE H H 3.652 -3.780 2.411 1.00 . A A . 29 PHE H 1 1 19 11911 1 1 29 PHE HA H 3.309 -1.809 4.276 1.00 . A A . 29 PHE HA 1 1 19 11912 1 1 29 PHE HB2 H 5.095 -4.196 4.132 1.00 . A A . 29 PHE HB2 1 1 19 11913 1 1 29 PHE HB3 H 5.340 -3.051 5.447 1.00 . A A . 29 PHE HB3 1 1 19 11914 1 1 29 PHE HD1 H 2.749 -5.154 3.821 1.00 . A A . 29 PHE HD1 1 1 19 11915 1 1 29 PHE HD2 H 4.016 -3.146 7.353 1.00 . A A . 29 PHE HD2 1 1 19 11916 1 1 29 PHE HE1 H 0.916 -6.212 5.075 1.00 . A A . 29 PHE HE1 1 1 19 11917 1 1 29 PHE HE2 H 2.185 -4.201 8.614 1.00 . A A . 29 PHE HE2 1 1 19 11918 1 1 29 PHE HZ H 0.631 -5.736 7.474 1.00 . A A . 29 PHE HZ 1 1 19 11919 1 1 29 PHE N N 3.750 -2.812 2.529 1.00 . A A . 29 PHE N 1 1 19 11920 1 1 29 PHE O O 5.297 -0.237 4.348 1.00 . A A . 29 PHE O 1 1 19 11921 1 1 30 THR C C 6.872 0.683 1.990 1.00 . A A . 30 THR C 1 1 19 11922 1 1 30 THR CA C 7.346 -0.661 2.531 1.00 . A A . 30 THR CA 1 1 19 11923 1 1 30 THR CB C 8.347 -1.278 1.536 1.00 . A A . 30 THR CB 1 1 19 11924 1 1 30 THR CG2 C 9.519 -0.338 1.296 1.00 . A A . 30 THR CG2 1 1 19 11925 1 1 30 THR H H 6.154 -2.391 2.267 1.00 . A A . 30 THR H 1 1 19 11926 1 1 30 THR HA H 7.855 -0.502 3.470 1.00 . A A . 30 THR HA 1 1 19 11927 1 1 30 THR HB H 7.841 -1.446 0.596 1.00 . A A . 30 THR HB 1 1 19 11928 1 1 30 THR HG1 H 8.918 -3.152 1.312 1.00 . A A . 30 THR HG1 1 1 19 11929 1 1 30 THR HG21 H 9.767 -0.334 0.246 1.00 . A A . 30 THR HG21 1 1 19 11930 1 1 30 THR HG22 H 10.373 -0.674 1.866 1.00 . A A . 30 THR HG22 1 1 19 11931 1 1 30 THR HG23 H 9.249 0.660 1.607 1.00 . A A . 30 THR HG23 1 1 19 11932 1 1 30 THR N N 6.221 -1.555 2.775 1.00 . A A . 30 THR N 1 1 19 11933 1 1 30 THR O O 7.389 1.734 2.372 1.00 . A A . 30 THR O 1 1 19 11934 1 1 30 THR OG1 O 8.828 -2.530 2.038 1.00 . A A . 30 THR OG1 1 1 19 11935 1 1 31 HIS C C 4.510 2.635 1.526 1.00 . A A . 31 HIS C 1 1 19 11936 1 1 31 HIS CA C 5.341 1.860 0.508 1.00 . A A . 31 HIS CA 1 1 19 11937 1 1 31 HIS CB C 4.487 1.520 -0.713 1.00 . A A . 31 HIS CB 1 1 19 11938 1 1 31 HIS CD2 C 2.200 2.737 -0.573 1.00 . A A . 31 HIS CD2 1 1 19 11939 1 1 31 HIS CE1 C 2.602 4.341 -2.012 1.00 . A A . 31 HIS CE1 1 1 19 11940 1 1 31 HIS CG C 3.460 2.562 -1.035 1.00 . A A . 31 HIS CG 1 1 19 11941 1 1 31 HIS H H 5.515 -0.224 0.836 1.00 . A A . 31 HIS H 1 1 19 11942 1 1 31 HIS HA H 6.170 2.477 0.196 1.00 . A A . 31 HIS HA 1 1 19 11943 1 1 31 HIS HB2 H 5.129 1.410 -1.575 1.00 . A A . 31 HIS HB2 1 1 19 11944 1 1 31 HIS HB3 H 3.970 0.588 -0.535 1.00 . A A . 31 HIS HB3 1 1 19 11945 1 1 31 HIS HD1 H 4.507 3.731 -2.442 1.00 . A A . 31 HIS HD1 1 1 19 11946 1 1 31 HIS HD2 H 1.691 2.117 0.152 1.00 . A A . 31 HIS HD2 1 1 19 11947 1 1 31 HIS HE1 H 2.486 5.215 -2.635 1.00 . A A . 31 HIS HE1 1 1 19 11948 1 1 31 HIS N N 5.886 0.644 1.100 1.00 . A A . 31 HIS N 1 1 19 11949 1 1 31 HIS ND1 N 3.681 3.583 -1.936 1.00 . A A . 31 HIS ND1 1 1 19 11950 1 1 31 HIS NE2 N 1.689 3.849 -1.195 1.00 . A A . 31 HIS NE2 1 1 19 11951 1 1 31 HIS O O 4.731 3.826 1.743 1.00 . A A . 31 HIS O 1 1 19 11952 1 1 32 GLN C C 3.463 3.589 3.974 1.00 . A A . 32 GLN C 1 1 19 11953 1 1 32 GLN CA C 2.688 2.576 3.138 1.00 . A A . 32 GLN CA 1 1 19 11954 1 1 32 GLN CB C 2.069 1.513 4.048 1.00 . A A . 32 GLN CB 1 1 19 11955 1 1 32 GLN CD C 0.479 -0.440 4.252 1.00 . A A . 32 GLN CD 1 1 19 11956 1 1 32 GLN CG C 1.009 0.667 3.362 1.00 . A A . 32 GLN CG 1 1 19 11957 1 1 32 GLN H H 3.426 1.004 1.929 1.00 . A A . 32 GLN H 1 1 19 11958 1 1 32 GLN HA H 1.898 3.090 2.613 1.00 . A A . 32 GLN HA 1 1 19 11959 1 1 32 GLN HB2 H 2.852 0.857 4.399 1.00 . A A . 32 GLN HB2 1 1 19 11960 1 1 32 GLN HB3 H 1.614 2.003 4.896 1.00 . A A . 32 GLN HB3 1 1 19 11961 1 1 32 GLN HE21 H -1.082 0.682 4.759 1.00 . A A . 32 GLN HE21 1 1 19 11962 1 1 32 GLN HE22 H -1.021 -0.889 5.476 1.00 . A A . 32 GLN HE22 1 1 19 11963 1 1 32 GLN HG2 H 0.185 1.305 3.078 1.00 . A A . 32 GLN HG2 1 1 19 11964 1 1 32 GLN HG3 H 1.440 0.222 2.476 1.00 . A A . 32 GLN HG3 1 1 19 11965 1 1 32 GLN N N 3.553 1.950 2.145 1.00 . A A . 32 GLN N 1 1 19 11966 1 1 32 GLN NE2 N -0.655 -0.191 4.895 1.00 . A A . 32 GLN NE2 1 1 19 11967 1 1 32 GLN O O 2.900 4.573 4.456 1.00 . A A . 32 GLN O 1 1 19 11968 1 1 32 GLN OE1 O 1.083 -1.508 4.361 1.00 . A A . 32 GLN OE1 1 1 19 11969 1 1 33 LYS C C 5.387 5.688 4.520 1.00 . A A . 33 LYS C 1 1 19 11970 1 1 33 LYS CA C 5.611 4.233 4.921 1.00 . A A . 33 LYS CA 1 1 19 11971 1 1 33 LYS CB C 7.083 3.860 4.727 1.00 . A A . 33 LYS CB 1 1 19 11972 1 1 33 LYS CD C 8.976 2.421 5.535 1.00 . A A . 33 LYS CD 1 1 19 11973 1 1 33 LYS CE C 9.401 0.968 5.681 1.00 . A A . 33 LYS CE 1 1 19 11974 1 1 33 LYS CG C 7.469 2.547 5.384 1.00 . A A . 33 LYS CG 1 1 19 11975 1 1 33 LYS H H 5.149 2.542 3.734 1.00 . A A . 33 LYS H 1 1 19 11976 1 1 33 LYS HA H 5.353 4.115 5.962 1.00 . A A . 33 LYS HA 1 1 19 11977 1 1 33 LYS HB2 H 7.286 3.783 3.669 1.00 . A A . 33 LYS HB2 1 1 19 11978 1 1 33 LYS HB3 H 7.698 4.643 5.146 1.00 . A A . 33 LYS HB3 1 1 19 11979 1 1 33 LYS HD2 H 9.453 2.837 4.661 1.00 . A A . 33 LYS HD2 1 1 19 11980 1 1 33 LYS HD3 H 9.288 2.968 6.413 1.00 . A A . 33 LYS HD3 1 1 19 11981 1 1 33 LYS HE2 H 8.958 0.394 4.882 1.00 . A A . 33 LYS HE2 1 1 19 11982 1 1 33 LYS HE3 H 10.478 0.913 5.610 1.00 . A A . 33 LYS HE3 1 1 19 11983 1 1 33 LYS HG2 H 7.014 2.497 6.363 1.00 . A A . 33 LYS HG2 1 1 19 11984 1 1 33 LYS HG3 H 7.108 1.730 4.775 1.00 . A A . 33 LYS HG3 1 1 19 11985 1 1 33 LYS HZ1 H 8.650 -0.587 6.857 1.00 . A A . 33 LYS HZ1 1 1 19 11986 1 1 33 LYS HZ2 H 8.192 0.954 7.385 1.00 . A A . 33 LYS HZ2 1 1 19 11987 1 1 33 LYS HZ3 H 9.767 0.399 7.658 1.00 . A A . 33 LYS HZ3 1 1 19 11988 1 1 33 LYS N N 4.757 3.343 4.143 1.00 . A A . 33 LYS N 1 1 19 11989 1 1 33 LYS NZ N 8.973 0.393 6.986 1.00 . A A . 33 LYS NZ 1 1 19 11990 1 1 33 LYS O O 5.201 6.555 5.374 1.00 . A A . 33 LYS O 1 1 19 11991 1 1 34 ILE C C 4.039 7.984 3.412 1.00 . A A . 34 ILE C 1 1 19 11992 1 1 34 ILE CA C 5.202 7.297 2.704 1.00 . A A . 34 ILE CA 1 1 19 11993 1 1 34 ILE CB C 4.932 7.288 1.188 1.00 . A A . 34 ILE CB 1 1 19 11994 1 1 34 ILE CD1 C 2.975 7.072 -0.426 1.00 . A A . 34 ILE CD1 1 1 19 11995 1 1 34 ILE CG1 C 3.578 6.639 0.893 1.00 . A A . 34 ILE CG1 1 1 19 11996 1 1 34 ILE CG2 C 6.047 6.557 0.456 1.00 . A A . 34 ILE CG2 1 1 19 11997 1 1 34 ILE H H 5.558 5.214 2.585 1.00 . A A . 34 ILE H 1 1 19 11998 1 1 34 ILE HA H 6.105 7.862 2.886 1.00 . A A . 34 ILE HA 1 1 19 11999 1 1 34 ILE HB H 4.916 8.310 0.842 1.00 . A A . 34 ILE HB 1 1 19 12000 1 1 34 ILE HD11 H 2.806 8.139 -0.410 1.00 . A A . 34 ILE HD11 1 1 19 12001 1 1 34 ILE HD12 H 3.654 6.828 -1.230 1.00 . A A . 34 ILE HD12 1 1 19 12002 1 1 34 ILE HD13 H 2.036 6.562 -0.578 1.00 . A A . 34 ILE HD13 1 1 19 12003 1 1 34 ILE HG12 H 3.697 5.568 0.866 1.00 . A A . 34 ILE HG12 1 1 19 12004 1 1 34 ILE HG13 H 2.883 6.901 1.678 1.00 . A A . 34 ILE HG13 1 1 19 12005 1 1 34 ILE HG21 H 6.577 5.922 1.150 1.00 . A A . 34 ILE HG21 1 1 19 12006 1 1 34 ILE HG22 H 5.623 5.952 -0.332 1.00 . A A . 34 ILE HG22 1 1 19 12007 1 1 34 ILE HG23 H 6.731 7.276 0.030 1.00 . A A . 34 ILE HG23 1 1 19 12008 1 1 34 ILE N N 5.405 5.947 3.217 1.00 . A A . 34 ILE N 1 1 19 12009 1 1 34 ILE O O 4.000 9.211 3.518 1.00 . A A . 34 ILE O 1 1 19 12010 1 1 35 HIS C C 2.220 7.876 6.089 1.00 . A A . 35 HIS C 1 1 19 12011 1 1 35 HIS CA C 1.931 7.717 4.600 1.00 . A A . 35 HIS CA 1 1 19 12012 1 1 35 HIS CB C 0.724 6.800 4.397 1.00 . A A . 35 HIS CB 1 1 19 12013 1 1 35 HIS CD2 C 0.667 5.782 2.012 1.00 . A A . 35 HIS CD2 1 1 19 12014 1 1 35 HIS CE1 C -0.771 7.167 1.107 1.00 . A A . 35 HIS CE1 1 1 19 12015 1 1 35 HIS CG C 0.303 6.672 2.965 1.00 . A A . 35 HIS CG 1 1 19 12016 1 1 35 HIS H H 3.181 6.217 3.783 1.00 . A A . 35 HIS H 1 1 19 12017 1 1 35 HIS HA H 1.708 8.688 4.184 1.00 . A A . 35 HIS HA 1 1 19 12018 1 1 35 HIS HB2 H 0.966 5.813 4.761 1.00 . A A . 35 HIS HB2 1 1 19 12019 1 1 35 HIS HB3 H -0.114 7.190 4.956 1.00 . A A . 35 HIS HB3 1 1 19 12020 1 1 35 HIS HD1 H -1.045 8.283 2.800 1.00 . A A . 35 HIS HD1 1 1 19 12021 1 1 35 HIS HD2 H 1.364 4.964 2.130 1.00 . A A . 35 HIS HD2 1 1 19 12022 1 1 35 HIS HE1 H -1.421 7.653 0.394 1.00 . A A . 35 HIS HE1 1 1 19 12023 1 1 35 HIS N N 3.094 7.186 3.898 1.00 . A A . 35 HIS N 1 1 19 12024 1 1 35 HIS ND1 N -0.598 7.526 2.366 1.00 . A A . 35 HIS ND1 1 1 19 12025 1 1 35 HIS NE2 N -0.015 6.111 0.867 1.00 . A A . 35 HIS NE2 1 1 19 12026 1 1 35 HIS O O 2.152 8.979 6.632 1.00 . A A . 35 HIS O 1 1 19 12027 1 1 36 THR C C 4.291 7.167 8.428 1.00 . A A . 36 THR C 1 1 19 12028 1 1 36 THR CA C 2.839 6.780 8.173 1.00 . A A . 36 THR CA 1 1 19 12029 1 1 36 THR CB C 2.563 5.409 8.819 1.00 . A A . 36 THR CB 1 1 19 12030 1 1 36 THR CG2 C 3.407 4.325 8.166 1.00 . A A . 36 THR CG2 1 1 19 12031 1 1 36 THR H H 2.579 5.916 6.258 1.00 . A A . 36 THR H 1 1 19 12032 1 1 36 THR HA H 2.194 7.511 8.640 1.00 . A A . 36 THR HA 1 1 19 12033 1 1 36 THR HB H 1.520 5.166 8.679 1.00 . A A . 36 THR HB 1 1 19 12034 1 1 36 THR HG1 H 2.147 5.020 10.707 1.00 . A A . 36 THR HG1 1 1 19 12035 1 1 36 THR HG21 H 3.659 4.622 7.159 1.00 . A A . 36 THR HG21 1 1 19 12036 1 1 36 THR HG22 H 2.848 3.401 8.139 1.00 . A A . 36 THR HG22 1 1 19 12037 1 1 36 THR HG23 H 4.313 4.181 8.736 1.00 . A A . 36 THR HG23 1 1 19 12038 1 1 36 THR N N 2.542 6.765 6.746 1.00 . A A . 36 THR N 1 1 19 12039 1 1 36 THR O O 5.209 6.406 8.124 1.00 . A A . 36 THR O 1 1 19 12040 1 1 36 THR OG1 O 2.847 5.462 10.221 1.00 . A A . 36 THR OG1 1 1 19 12041 1 1 37 GLY C C 6.007 10.304 9.004 1.00 . A A . 37 GLY C 1 1 19 12042 1 1 37 GLY CA C 5.837 8.822 9.276 1.00 . A A . 37 GLY CA 1 1 19 12043 1 1 37 GLY H H 3.723 8.920 9.209 1.00 . A A . 37 GLY H 1 1 19 12044 1 1 37 GLY HA2 H 6.059 8.630 10.315 1.00 . A A . 37 GLY HA2 1 1 19 12045 1 1 37 GLY HA3 H 6.535 8.273 8.661 1.00 . A A . 37 GLY HA3 1 1 19 12046 1 1 37 GLY N N 4.493 8.356 8.989 1.00 . A A . 37 GLY N 1 1 19 12047 1 1 37 GLY O O 6.493 11.045 9.856 1.00 . A A . 37 GLY O 1 1 19 12048 1 1 38 GLU C C 5.069 13.040 8.473 1.00 . A A . 38 GLU C 1 1 19 12049 1 1 38 GLU CA C 5.720 12.137 7.429 1.00 . A A . 38 GLU CA 1 1 19 12050 1 1 38 GLU CB C 5.073 12.370 6.062 1.00 . A A . 38 GLU CB 1 1 19 12051 1 1 38 GLU CD C 2.992 12.044 4.667 1.00 . A A . 38 GLU CD 1 1 19 12052 1 1 38 GLU CG C 3.564 12.188 6.064 1.00 . A A . 38 GLU CG 1 1 19 12053 1 1 38 GLU H H 5.226 10.094 7.174 1.00 . A A . 38 GLU H 1 1 19 12054 1 1 38 GLU HA H 6.770 12.380 7.366 1.00 . A A . 38 GLU HA 1 1 19 12055 1 1 38 GLU HB2 H 5.293 13.377 5.740 1.00 . A A . 38 GLU HB2 1 1 19 12056 1 1 38 GLU HB3 H 5.497 11.675 5.354 1.00 . A A . 38 GLU HB3 1 1 19 12057 1 1 38 GLU HG2 H 3.322 11.300 6.629 1.00 . A A . 38 GLU HG2 1 1 19 12058 1 1 38 GLU HG3 H 3.111 13.048 6.536 1.00 . A A . 38 GLU HG3 1 1 19 12059 1 1 38 GLU N N 5.606 10.735 7.811 1.00 . A A . 38 GLU N 1 1 19 12060 1 1 38 GLU O O 4.524 12.564 9.470 1.00 . A A . 38 GLU O 1 1 19 12061 1 1 38 GLU OE1 O 3.172 12.973 3.853 1.00 . A A . 38 GLU OE1 1 1 19 12062 1 1 38 GLU OE2 O 2.365 11.000 4.389 1.00 . A A . 38 GLU OE2 1 1 19 12063 1 1 39 LYS C C 3.042 15.105 9.289 1.00 . A A . 39 LYS C 1 1 19 12064 1 1 39 LYS CA C 4.547 15.318 9.156 1.00 . A A . 39 LYS CA 1 1 19 12065 1 1 39 LYS CB C 4.830 16.741 8.671 1.00 . A A . 39 LYS CB 1 1 19 12066 1 1 39 LYS CD C 6.541 18.455 8.004 1.00 . A A . 39 LYS CD 1 1 19 12067 1 1 39 LYS CE C 6.408 19.546 9.056 1.00 . A A . 39 LYS CE 1 1 19 12068 1 1 39 LYS CG C 6.309 17.077 8.600 1.00 . A A . 39 LYS CG 1 1 19 12069 1 1 39 LYS H H 5.578 14.665 7.426 1.00 . A A . 39 LYS H 1 1 19 12070 1 1 39 LYS HA H 5.005 15.177 10.123 1.00 . A A . 39 LYS HA 1 1 19 12071 1 1 39 LYS HB2 H 4.406 16.864 7.685 1.00 . A A . 39 LYS HB2 1 1 19 12072 1 1 39 LYS HB3 H 4.356 17.439 9.347 1.00 . A A . 39 LYS HB3 1 1 19 12073 1 1 39 LYS HD2 H 7.535 18.495 7.585 1.00 . A A . 39 LYS HD2 1 1 19 12074 1 1 39 LYS HD3 H 5.812 18.628 7.225 1.00 . A A . 39 LYS HD3 1 1 19 12075 1 1 39 LYS HE2 H 6.414 20.506 8.563 1.00 . A A . 39 LYS HE2 1 1 19 12076 1 1 39 LYS HE3 H 5.470 19.415 9.576 1.00 . A A . 39 LYS HE3 1 1 19 12077 1 1 39 LYS HG2 H 6.723 17.054 9.598 1.00 . A A . 39 LYS HG2 1 1 19 12078 1 1 39 LYS HG3 H 6.807 16.340 7.985 1.00 . A A . 39 LYS HG3 1 1 19 12079 1 1 39 LYS HZ1 H 7.616 18.542 10.433 1.00 . A A . 39 LYS HZ1 1 1 19 12080 1 1 39 LYS HZ2 H 7.331 20.163 10.825 1.00 . A A . 39 LYS HZ2 1 1 19 12081 1 1 39 LYS HZ3 H 8.416 19.771 9.588 1.00 . A A . 39 LYS HZ3 1 1 19 12082 1 1 39 LYS N N 5.130 14.346 8.238 1.00 . A A . 39 LYS N 1 1 19 12083 1 1 39 LYS NZ N 7.521 19.502 10.045 1.00 . A A . 39 LYS NZ 1 1 19 12084 1 1 39 LYS O O 2.372 14.642 8.366 1.00 . A A . 39 LYS O 1 1 19 12085 1 1 40 PRO C C 0.217 16.294 9.951 1.00 . A A . 40 PRO C 1 1 19 12086 1 1 40 PRO CA C 1.065 15.308 10.746 1.00 . A A . 40 PRO CA 1 1 19 12087 1 1 40 PRO CB C 0.967 15.604 12.245 1.00 . A A . 40 PRO CB 1 1 19 12088 1 1 40 PRO CD C 3.236 16.008 11.610 1.00 . A A . 40 PRO CD 1 1 19 12089 1 1 40 PRO CG C 2.145 16.467 12.538 1.00 . A A . 40 PRO CG 1 1 19 12090 1 1 40 PRO HA H 0.721 14.302 10.553 1.00 . A A . 40 PRO HA 1 1 19 12091 1 1 40 PRO HB2 H 0.038 16.118 12.452 1.00 . A A . 40 PRO HB2 1 1 19 12092 1 1 40 PRO HB3 H 1.005 14.680 12.801 1.00 . A A . 40 PRO HB3 1 1 19 12093 1 1 40 PRO HD2 H 3.847 16.844 11.304 1.00 . A A . 40 PRO HD2 1 1 19 12094 1 1 40 PRO HD3 H 3.840 15.249 12.084 1.00 . A A . 40 PRO HD3 1 1 19 12095 1 1 40 PRO HG2 H 1.900 17.501 12.347 1.00 . A A . 40 PRO HG2 1 1 19 12096 1 1 40 PRO HG3 H 2.449 16.336 13.566 1.00 . A A . 40 PRO HG3 1 1 19 12097 1 1 40 PRO N N 2.497 15.451 10.465 1.00 . A A . 40 PRO N 1 1 19 12098 1 1 40 PRO O O -1.007 16.318 10.078 1.00 . A A . 40 PRO O 1 1 19 12099 1 1 41 SER C C -0.511 19.134 9.197 1.00 . A A . 41 SER C 1 1 19 12100 1 1 41 SER CA C 0.182 18.099 8.317 1.00 . A A . 41 SER CA 1 1 19 12101 1 1 41 SER CB C -0.843 17.417 7.408 1.00 . A A . 41 SER CB 1 1 19 12102 1 1 41 SER H H 1.852 17.040 9.074 1.00 . A A . 41 SER H 1 1 19 12103 1 1 41 SER HA H 0.917 18.598 7.704 1.00 . A A . 41 SER HA 1 1 19 12104 1 1 41 SER HB2 H -1.213 16.526 7.893 1.00 . A A . 41 SER HB2 1 1 19 12105 1 1 41 SER HB3 H -1.664 18.095 7.224 1.00 . A A . 41 SER HB3 1 1 19 12106 1 1 41 SER HG H 0.363 16.339 6.303 1.00 . A A . 41 SER HG 1 1 19 12107 1 1 41 SER N N 0.876 17.107 9.131 1.00 . A A . 41 SER N 1 1 19 12108 1 1 41 SER O O -1.706 19.390 9.051 1.00 . A A . 41 SER O 1 1 19 12109 1 1 41 SER OG O -0.263 17.054 6.167 1.00 . A A . 41 SER OG 1 1 19 12110 1 1 42 GLY C C -0.296 20.288 12.452 1.00 . A A . 42 GLY C 1 1 19 12111 1 1 42 GLY CA C -0.308 20.730 11.002 1.00 . A A . 42 GLY CA 1 1 19 12112 1 1 42 GLY H H 1.196 19.486 10.182 1.00 . A A . 42 GLY H 1 1 19 12113 1 1 42 GLY HA2 H 0.267 21.639 10.909 1.00 . A A . 42 GLY HA2 1 1 19 12114 1 1 42 GLY HA3 H -1.328 20.930 10.708 1.00 . A A . 42 GLY HA3 1 1 19 12115 1 1 42 GLY N N 0.249 19.729 10.111 1.00 . A A . 42 GLY N 1 1 19 12116 1 1 42 GLY O O 0.155 19.192 12.785 1.00 . A A . 42 GLY O 1 1 19 12117 1 1 43 PRO C C -1.869 19.782 15.117 1.00 . A A . 43 PRO C 1 1 19 12118 1 1 43 PRO CA C -0.855 20.870 14.780 1.00 . A A . 43 PRO CA 1 1 19 12119 1 1 43 PRO CB C -1.281 22.207 15.391 1.00 . A A . 43 PRO CB 1 1 19 12120 1 1 43 PRO CD C -1.354 22.479 13.017 1.00 . A A . 43 PRO CD 1 1 19 12121 1 1 43 PRO CG C -2.015 22.905 14.299 1.00 . A A . 43 PRO CG 1 1 19 12122 1 1 43 PRO HA H 0.114 20.588 15.166 1.00 . A A . 43 PRO HA 1 1 19 12123 1 1 43 PRO HB2 H -1.919 22.028 16.245 1.00 . A A . 43 PRO HB2 1 1 19 12124 1 1 43 PRO HB3 H -0.407 22.762 15.697 1.00 . A A . 43 PRO HB3 1 1 19 12125 1 1 43 PRO HD2 H -2.082 22.407 12.222 1.00 . A A . 43 PRO HD2 1 1 19 12126 1 1 43 PRO HD3 H -0.568 23.170 12.750 1.00 . A A . 43 PRO HD3 1 1 19 12127 1 1 43 PRO HG2 H -3.052 22.606 14.303 1.00 . A A . 43 PRO HG2 1 1 19 12128 1 1 43 PRO HG3 H -1.931 23.974 14.425 1.00 . A A . 43 PRO HG3 1 1 19 12129 1 1 43 PRO N N -0.799 21.155 13.343 1.00 . A A . 43 PRO N 1 1 19 12130 1 1 43 PRO O O -2.046 19.424 16.281 1.00 . A A . 43 PRO O 1 1 19 12131 1 1 44 SER C C -3.130 17.275 15.409 1.00 . A A . 44 SER C 1 1 19 12132 1 1 44 SER CA C -3.534 18.217 14.279 1.00 . A A . 44 SER CA 1 1 19 12133 1 1 44 SER CB C -3.725 17.425 12.983 1.00 . A A . 44 SER CB 1 1 19 12134 1 1 44 SER H H -2.349 19.589 13.185 1.00 . A A . 44 SER H 1 1 19 12135 1 1 44 SER HA H -4.467 18.694 14.539 1.00 . A A . 44 SER HA 1 1 19 12136 1 1 44 SER HB2 H -3.960 18.105 12.180 1.00 . A A . 44 SER HB2 1 1 19 12137 1 1 44 SER HB3 H -2.812 16.894 12.751 1.00 . A A . 44 SER HB3 1 1 19 12138 1 1 44 SER HG H -5.508 16.745 12.542 1.00 . A A . 44 SER HG 1 1 19 12139 1 1 44 SER N N -2.534 19.261 14.090 1.00 . A A . 44 SER N 1 1 19 12140 1 1 44 SER O O -2.062 16.664 15.371 1.00 . A A . 44 SER O 1 1 19 12141 1 1 44 SER OG O -4.779 16.486 13.110 1.00 . A A . 44 SER OG 1 1 19 12142 1 1 45 SER C C -4.530 15.007 17.463 1.00 . A A . 45 SER C 1 1 19 12143 1 1 45 SER CA C -3.725 16.299 17.558 1.00 . A A . 45 SER CA 1 1 19 12144 1 1 45 SER CB C -4.059 17.027 18.862 1.00 . A A . 45 SER CB 1 1 19 12145 1 1 45 SER H H -4.827 17.676 16.387 1.00 . A A . 45 SER H 1 1 19 12146 1 1 45 SER HA H -2.673 16.056 17.551 1.00 . A A . 45 SER HA 1 1 19 12147 1 1 45 SER HB2 H -4.020 16.326 19.682 1.00 . A A . 45 SER HB2 1 1 19 12148 1 1 45 SER HB3 H -3.337 17.814 19.027 1.00 . A A . 45 SER HB3 1 1 19 12149 1 1 45 SER HG H -5.289 18.550 18.921 1.00 . A A . 45 SER HG 1 1 19 12150 1 1 45 SER N N -3.992 17.163 16.414 1.00 . A A . 45 SER N 1 1 19 12151 1 1 45 SER O O -3.976 13.911 17.525 1.00 . A A . 45 SER O 1 1 19 12152 1 1 45 SER OG O -5.354 17.599 18.810 1.00 . A A . 45 SER OG 1 1 19 12153 1 1 46 GLY C C -8.177 14.348 17.212 1.00 . A A . 46 GLY C 1 1 19 12154 1 1 46 GLY CA C -6.706 13.982 17.211 1.00 . A A . 46 GLY CA 1 1 19 12155 1 1 46 GLY H H -6.231 16.045 17.268 1.00 . A A . 46 GLY H 1 1 19 12156 1 1 46 GLY HA2 H -6.477 13.457 16.296 1.00 . A A . 46 GLY HA2 1 1 19 12157 1 1 46 GLY HA3 H -6.509 13.329 18.048 1.00 . A A . 46 GLY HA3 1 1 19 12158 1 1 46 GLY N N -5.844 15.145 17.312 1.00 . A A . 46 GLY N 1 1 19 12159 1 1 46 GLY O O -8.712 14.674 18.270 1.00 . A A . 46 GLY O 1 1 19 12160 2 2 1 ZN ZN ZN -0.127 4.451 -0.358 1.00 . B A . 201 ZN ZN 1 1 20 12161 1 1 1 GLY C C -12.379 12.009 -14.564 1.00 . A A . 1 GLY C 1 1 20 12162 1 1 1 GLY CA C -13.695 12.759 -14.617 1.00 . A A . 1 GLY CA 1 1 20 12163 1 1 1 GLY H1 H -13.726 12.791 -12.500 1.00 . A A . 1 GLY H1 1 1 20 12164 1 1 1 GLY HA2 H -14.438 12.129 -15.084 1.00 . A A . 1 GLY HA2 1 1 20 12165 1 1 1 GLY HA3 H -13.564 13.649 -15.216 1.00 . A A . 1 GLY HA3 1 1 20 12166 1 1 1 GLY N N -14.167 13.146 -13.301 1.00 . A A . 1 GLY N 1 1 20 12167 1 1 1 GLY O O -11.384 12.444 -15.144 1.00 . A A . 1 GLY O 1 1 20 12168 1 1 2 SER C C -11.132 8.970 -14.791 1.00 . A A . 2 SER C 1 1 20 12169 1 1 2 SER CA C -11.166 10.068 -13.733 1.00 . A A . 2 SER CA 1 1 20 12170 1 1 2 SER CB C -11.092 9.449 -12.336 1.00 . A A . 2 SER CB 1 1 20 12171 1 1 2 SER H H -13.197 10.583 -13.425 1.00 . A A . 2 SER H 1 1 20 12172 1 1 2 SER HA H -10.314 10.716 -13.876 1.00 . A A . 2 SER HA 1 1 20 12173 1 1 2 SER HB2 H -12.021 8.943 -12.120 1.00 . A A . 2 SER HB2 1 1 20 12174 1 1 2 SER HB3 H -10.279 8.739 -12.303 1.00 . A A . 2 SER HB3 1 1 20 12175 1 1 2 SER HG H -10.060 10.250 -10.876 1.00 . A A . 2 SER HG 1 1 20 12176 1 1 2 SER N N -12.372 10.878 -13.865 1.00 . A A . 2 SER N 1 1 20 12177 1 1 2 SER O O -10.218 8.913 -15.614 1.00 . A A . 2 SER O 1 1 20 12178 1 1 2 SER OG O -10.873 10.442 -11.349 1.00 . A A . 2 SER OG 1 1 20 12179 1 1 3 SER C C -10.980 6.111 -15.632 1.00 . A A . 3 SER C 1 1 20 12180 1 1 3 SER CA C -12.218 6.998 -15.716 1.00 . A A . 3 SER CA 1 1 20 12181 1 1 3 SER CB C -12.377 7.538 -17.139 1.00 . A A . 3 SER CB 1 1 20 12182 1 1 3 SER H H -12.834 8.196 -14.083 1.00 . A A . 3 SER H 1 1 20 12183 1 1 3 SER HA H -13.087 6.407 -15.466 1.00 . A A . 3 SER HA 1 1 20 12184 1 1 3 SER HB2 H -13.228 8.201 -17.176 1.00 . A A . 3 SER HB2 1 1 20 12185 1 1 3 SER HB3 H -11.485 8.082 -17.415 1.00 . A A . 3 SER HB3 1 1 20 12186 1 1 3 SER HG H -13.305 5.934 -17.771 1.00 . A A . 3 SER HG 1 1 20 12187 1 1 3 SER N N -12.135 8.098 -14.763 1.00 . A A . 3 SER N 1 1 20 12188 1 1 3 SER O O -10.438 5.683 -16.651 1.00 . A A . 3 SER O 1 1 20 12189 1 1 3 SER OG O -12.576 6.485 -18.065 1.00 . A A . 3 SER OG 1 1 20 12190 1 1 4 GLY C C -9.325 3.827 -15.167 1.00 . A A . 4 GLY C 1 1 20 12191 1 1 4 GLY CA C -9.365 5.004 -14.212 1.00 . A A . 4 GLY CA 1 1 20 12192 1 1 4 GLY H H -11.009 6.207 -13.632 1.00 . A A . 4 GLY H 1 1 20 12193 1 1 4 GLY HA2 H -8.480 5.605 -14.360 1.00 . A A . 4 GLY HA2 1 1 20 12194 1 1 4 GLY HA3 H -9.370 4.630 -13.199 1.00 . A A . 4 GLY HA3 1 1 20 12195 1 1 4 GLY N N -10.537 5.838 -14.408 1.00 . A A . 4 GLY N 1 1 20 12196 1 1 4 GLY O O -10.098 2.880 -15.028 1.00 . A A . 4 GLY O 1 1 20 12197 1 1 5 SER C C -8.137 1.466 -16.443 1.00 . A A . 5 SER C 1 1 20 12198 1 1 5 SER CA C -8.288 2.822 -17.127 1.00 . A A . 5 SER CA 1 1 20 12199 1 1 5 SER CB C -7.084 3.085 -18.033 1.00 . A A . 5 SER CB 1 1 20 12200 1 1 5 SER H H -7.834 4.670 -16.199 1.00 . A A . 5 SER H 1 1 20 12201 1 1 5 SER HA H -9.185 2.811 -17.728 1.00 . A A . 5 SER HA 1 1 20 12202 1 1 5 SER HB2 H -6.941 2.242 -18.691 1.00 . A A . 5 SER HB2 1 1 20 12203 1 1 5 SER HB3 H -7.267 3.973 -18.621 1.00 . A A . 5 SER HB3 1 1 20 12204 1 1 5 SER HG H -5.783 2.533 -16.677 1.00 . A A . 5 SER HG 1 1 20 12205 1 1 5 SER N N -8.422 3.888 -16.141 1.00 . A A . 5 SER N 1 1 20 12206 1 1 5 SER O O -7.066 1.128 -15.939 1.00 . A A . 5 SER O 1 1 20 12207 1 1 5 SER OG O -5.905 3.277 -17.272 1.00 . A A . 5 SER OG 1 1 20 12208 1 1 6 SER C C -9.300 -1.725 -16.858 1.00 . A A . 6 SER C 1 1 20 12209 1 1 6 SER CA C -9.210 -0.624 -15.806 1.00 . A A . 6 SER CA 1 1 20 12210 1 1 6 SER CB C -10.370 -0.751 -14.817 1.00 . A A . 6 SER CB 1 1 20 12211 1 1 6 SER H H -10.043 1.019 -16.849 1.00 . A A . 6 SER H 1 1 20 12212 1 1 6 SER HA H -8.278 -0.730 -15.270 1.00 . A A . 6 SER HA 1 1 20 12213 1 1 6 SER HB2 H -10.489 0.179 -14.283 1.00 . A A . 6 SER HB2 1 1 20 12214 1 1 6 SER HB3 H -11.278 -0.973 -15.360 1.00 . A A . 6 SER HB3 1 1 20 12215 1 1 6 SER HG H -9.186 -1.927 -13.791 1.00 . A A . 6 SER HG 1 1 20 12216 1 1 6 SER N N -9.219 0.694 -16.430 1.00 . A A . 6 SER N 1 1 20 12217 1 1 6 SER O O -10.125 -1.663 -17.768 1.00 . A A . 6 SER O 1 1 20 12218 1 1 6 SER OG O -10.132 -1.789 -13.882 1.00 . A A . 6 SER OG 1 1 20 12219 1 1 7 GLY C C -8.376 -5.185 -16.989 1.00 . A A . 7 GLY C 1 1 20 12220 1 1 7 GLY CA C -8.442 -3.834 -17.672 1.00 . A A . 7 GLY CA 1 1 20 12221 1 1 7 GLY H H -7.807 -2.729 -15.981 1.00 . A A . 7 GLY H 1 1 20 12222 1 1 7 GLY HA2 H -9.342 -3.785 -18.266 1.00 . A A . 7 GLY HA2 1 1 20 12223 1 1 7 GLY HA3 H -7.586 -3.732 -18.324 1.00 . A A . 7 GLY HA3 1 1 20 12224 1 1 7 GLY N N -8.443 -2.733 -16.726 1.00 . A A . 7 GLY N 1 1 20 12225 1 1 7 GLY O O -9.303 -5.576 -16.278 1.00 . A A . 7 GLY O 1 1 20 12226 1 1 8 THR C C -5.787 -7.296 -15.831 1.00 . A A . 8 THR C 1 1 20 12227 1 1 8 THR CA C -7.097 -7.220 -16.607 1.00 . A A . 8 THR CA 1 1 20 12228 1 1 8 THR CB C -7.112 -8.329 -17.676 1.00 . A A . 8 THR CB 1 1 20 12229 1 1 8 THR CG2 C -5.928 -8.187 -18.621 1.00 . A A . 8 THR CG2 1 1 20 12230 1 1 8 THR H H -6.575 -5.538 -17.781 1.00 . A A . 8 THR H 1 1 20 12231 1 1 8 THR HA H -7.918 -7.394 -15.927 1.00 . A A . 8 THR HA 1 1 20 12232 1 1 8 THR HB H -8.024 -8.243 -18.250 1.00 . A A . 8 THR HB 1 1 20 12233 1 1 8 THR HG1 H -6.670 -10.251 -17.643 1.00 . A A . 8 THR HG1 1 1 20 12234 1 1 8 THR HG21 H -5.676 -7.143 -18.726 1.00 . A A . 8 THR HG21 1 1 20 12235 1 1 8 THR HG22 H -6.188 -8.594 -19.587 1.00 . A A . 8 THR HG22 1 1 20 12236 1 1 8 THR HG23 H -5.081 -8.723 -18.219 1.00 . A A . 8 THR HG23 1 1 20 12237 1 1 8 THR N N -7.279 -5.904 -17.205 1.00 . A A . 8 THR N 1 1 20 12238 1 1 8 THR O O -4.736 -6.896 -16.329 1.00 . A A . 8 THR O 1 1 20 12239 1 1 8 THR OG1 O -7.076 -9.616 -17.048 1.00 . A A . 8 THR OG1 1 1 20 12240 1 1 9 GLY C C -4.773 -7.133 -12.500 1.00 . A A . 9 GLY C 1 1 20 12241 1 1 9 GLY CA C -4.670 -7.932 -13.784 1.00 . A A . 9 GLY CA 1 1 20 12242 1 1 9 GLY H H -6.724 -8.116 -14.263 1.00 . A A . 9 GLY H 1 1 20 12243 1 1 9 GLY HA2 H -4.519 -8.973 -13.537 1.00 . A A . 9 GLY HA2 1 1 20 12244 1 1 9 GLY HA3 H -3.818 -7.579 -14.346 1.00 . A A . 9 GLY HA3 1 1 20 12245 1 1 9 GLY N N -5.858 -7.813 -14.608 1.00 . A A . 9 GLY N 1 1 20 12246 1 1 9 GLY O O -4.263 -6.016 -12.415 1.00 . A A . 9 GLY O 1 1 20 12247 1 1 10 GLU C C -4.698 -7.656 -9.155 1.00 . A A . 10 GLU C 1 1 20 12248 1 1 10 GLU CA C -5.604 -7.037 -10.215 1.00 . A A . 10 GLU CA 1 1 20 12249 1 1 10 GLU CB C -7.064 -7.115 -9.763 1.00 . A A . 10 GLU CB 1 1 20 12250 1 1 10 GLU CD C -7.019 -5.094 -8.248 1.00 . A A . 10 GLU CD 1 1 20 12251 1 1 10 GLU CG C -7.296 -6.581 -8.359 1.00 . A A . 10 GLU CG 1 1 20 12252 1 1 10 GLU H H -5.818 -8.598 -11.628 1.00 . A A . 10 GLU H 1 1 20 12253 1 1 10 GLU HA H -5.332 -6.000 -10.342 1.00 . A A . 10 GLU HA 1 1 20 12254 1 1 10 GLU HB2 H -7.672 -6.544 -10.449 1.00 . A A . 10 GLU HB2 1 1 20 12255 1 1 10 GLU HB3 H -7.381 -8.147 -9.789 1.00 . A A . 10 GLU HB3 1 1 20 12256 1 1 10 GLU HG2 H -8.325 -6.761 -8.085 1.00 . A A . 10 GLU HG2 1 1 20 12257 1 1 10 GLU HG3 H -6.645 -7.106 -7.676 1.00 . A A . 10 GLU HG3 1 1 20 12258 1 1 10 GLU N N -5.434 -7.706 -11.499 1.00 . A A . 10 GLU N 1 1 20 12259 1 1 10 GLU O O -4.512 -8.873 -9.114 1.00 . A A . 10 GLU O 1 1 20 12260 1 1 10 GLU OE1 O -5.830 -4.713 -8.228 1.00 . A A . 10 GLU OE1 1 1 20 12261 1 1 10 GLU OE2 O -7.991 -4.312 -8.181 1.00 . A A . 10 GLU OE2 1 1 20 12262 1 1 11 LYS C C -4.036 -7.577 -5.965 1.00 . A A . 11 LYS C 1 1 20 12263 1 1 11 LYS CA C -3.250 -7.273 -7.236 1.00 . A A . 11 LYS CA 1 1 20 12264 1 1 11 LYS CB C -2.177 -6.221 -6.946 1.00 . A A . 11 LYS CB 1 1 20 12265 1 1 11 LYS CD C -1.051 -5.662 -9.121 1.00 . A A . 11 LYS CD 1 1 20 12266 1 1 11 LYS CE C -1.682 -6.555 -10.178 1.00 . A A . 11 LYS CE 1 1 20 12267 1 1 11 LYS CG C -0.923 -6.382 -7.789 1.00 . A A . 11 LYS CG 1 1 20 12268 1 1 11 LYS H H -4.323 -5.852 -8.381 1.00 . A A . 11 LYS H 1 1 20 12269 1 1 11 LYS HA H -2.771 -8.179 -7.575 1.00 . A A . 11 LYS HA 1 1 20 12270 1 1 11 LYS HB2 H -2.589 -5.241 -7.135 1.00 . A A . 11 LYS HB2 1 1 20 12271 1 1 11 LYS HB3 H -1.896 -6.289 -5.905 1.00 . A A . 11 LYS HB3 1 1 20 12272 1 1 11 LYS HD2 H -1.670 -4.787 -8.990 1.00 . A A . 11 LYS HD2 1 1 20 12273 1 1 11 LYS HD3 H -0.068 -5.363 -9.454 1.00 . A A . 11 LYS HD3 1 1 20 12274 1 1 11 LYS HE2 H -1.415 -7.580 -9.971 1.00 . A A . 11 LYS HE2 1 1 20 12275 1 1 11 LYS HE3 H -2.755 -6.446 -10.130 1.00 . A A . 11 LYS HE3 1 1 20 12276 1 1 11 LYS HG2 H -0.083 -5.971 -7.250 1.00 . A A . 11 LYS HG2 1 1 20 12277 1 1 11 LYS HG3 H -0.757 -7.434 -7.973 1.00 . A A . 11 LYS HG3 1 1 20 12278 1 1 11 LYS HZ1 H -0.840 -7.044 -12.027 1.00 . A A . 11 LYS HZ1 1 1 20 12279 1 1 11 LYS HZ2 H -0.475 -5.478 -11.500 1.00 . A A . 11 LYS HZ2 1 1 20 12280 1 1 11 LYS HZ3 H -2.013 -5.828 -12.108 1.00 . A A . 11 LYS HZ3 1 1 20 12281 1 1 11 LYS N N -4.136 -6.811 -8.298 1.00 . A A . 11 LYS N 1 1 20 12282 1 1 11 LYS NZ N -1.220 -6.202 -11.549 1.00 . A A . 11 LYS NZ 1 1 20 12283 1 1 11 LYS O O -5.064 -6.962 -5.680 1.00 . A A . 11 LYS O 1 1 20 12284 1 1 12 PRO C C -4.066 -7.884 -2.844 1.00 . A A . 12 PRO C 1 1 20 12285 1 1 12 PRO CA C -4.182 -8.952 -3.926 1.00 . A A . 12 PRO CA 1 1 20 12286 1 1 12 PRO CB C -3.406 -10.208 -3.522 1.00 . A A . 12 PRO CB 1 1 20 12287 1 1 12 PRO CD C -2.321 -9.321 -5.458 1.00 . A A . 12 PRO CD 1 1 20 12288 1 1 12 PRO CG C -2.073 -10.055 -4.169 1.00 . A A . 12 PRO CG 1 1 20 12289 1 1 12 PRO HA H -5.222 -9.202 -4.074 1.00 . A A . 12 PRO HA 1 1 20 12290 1 1 12 PRO HB2 H -3.320 -10.251 -2.445 1.00 . A A . 12 PRO HB2 1 1 20 12291 1 1 12 PRO HB3 H -3.921 -11.086 -3.883 1.00 . A A . 12 PRO HB3 1 1 20 12292 1 1 12 PRO HD2 H -1.492 -8.667 -5.686 1.00 . A A . 12 PRO HD2 1 1 20 12293 1 1 12 PRO HD3 H -2.484 -10.021 -6.265 1.00 . A A . 12 PRO HD3 1 1 20 12294 1 1 12 PRO HG2 H -1.419 -9.481 -3.531 1.00 . A A . 12 PRO HG2 1 1 20 12295 1 1 12 PRO HG3 H -1.648 -11.027 -4.368 1.00 . A A . 12 PRO HG3 1 1 20 12296 1 1 12 PRO N N -3.542 -8.547 -5.181 1.00 . A A . 12 PRO N 1 1 20 12297 1 1 12 PRO O O -4.962 -7.728 -2.014 1.00 . A A . 12 PRO O 1 1 20 12298 1 1 13 TYR C C -2.989 -4.722 -2.482 1.00 . A A . 13 TYR C 1 1 20 12299 1 1 13 TYR CA C -2.725 -6.098 -1.878 1.00 . A A . 13 TYR CA 1 1 20 12300 1 1 13 TYR CB C -1.290 -6.170 -1.353 1.00 . A A . 13 TYR CB 1 1 20 12301 1 1 13 TYR CD1 C -1.293 -8.006 0.381 1.00 . A A . 13 TYR CD1 1 1 20 12302 1 1 13 TYR CD2 C -0.114 -8.384 -1.656 1.00 . A A . 13 TYR CD2 1 1 20 12303 1 1 13 TYR CE1 C -0.930 -9.262 0.829 1.00 . A A . 13 TYR CE1 1 1 20 12304 1 1 13 TYR CE2 C 0.252 -9.641 -1.217 1.00 . A A . 13 TYR CE2 1 1 20 12305 1 1 13 TYR CG C -0.892 -7.545 -0.868 1.00 . A A . 13 TYR CG 1 1 20 12306 1 1 13 TYR CZ C -0.158 -10.076 0.026 1.00 . A A . 13 TYR CZ 1 1 20 12307 1 1 13 TYR H H -2.281 -7.323 -3.546 1.00 . A A . 13 TYR H 1 1 20 12308 1 1 13 TYR HA H -3.408 -6.254 -1.055 1.00 . A A . 13 TYR HA 1 1 20 12309 1 1 13 TYR HB2 H -0.611 -5.888 -2.142 1.00 . A A . 13 TYR HB2 1 1 20 12310 1 1 13 TYR HB3 H -1.182 -5.482 -0.527 1.00 . A A . 13 TYR HB3 1 1 20 12311 1 1 13 TYR HD1 H -1.897 -7.366 1.007 1.00 . A A . 13 TYR HD1 1 1 20 12312 1 1 13 TYR HD2 H 0.206 -8.040 -2.629 1.00 . A A . 13 TYR HD2 1 1 20 12313 1 1 13 TYR HE1 H -1.252 -9.602 1.802 1.00 . A A . 13 TYR HE1 1 1 20 12314 1 1 13 TYR HE2 H 0.857 -10.279 -1.845 1.00 . A A . 13 TYR HE2 1 1 20 12315 1 1 13 TYR HH H 0.124 -11.957 -0.252 1.00 . A A . 13 TYR HH 1 1 20 12316 1 1 13 TYR N N -2.959 -7.151 -2.859 1.00 . A A . 13 TYR N 1 1 20 12317 1 1 13 TYR O O -2.781 -4.506 -3.676 1.00 . A A . 13 TYR O 1 1 20 12318 1 1 13 TYR OH O 0.205 -11.327 0.468 1.00 . A A . 13 TYR OH 1 1 20 12319 1 1 14 ARG C C -3.531 -1.434 -0.969 1.00 . A A . 14 ARG C 1 1 20 12320 1 1 14 ARG CA C -3.740 -2.439 -2.098 1.00 . A A . 14 ARG CA 1 1 20 12321 1 1 14 ARG CB C -5.178 -2.350 -2.615 1.00 . A A . 14 ARG CB 1 1 20 12322 1 1 14 ARG CD C -6.953 -0.755 -3.401 1.00 . A A . 14 ARG CD 1 1 20 12323 1 1 14 ARG CG C -5.467 -1.078 -3.394 1.00 . A A . 14 ARG CG 1 1 20 12324 1 1 14 ARG CZ C -7.389 -0.456 -5.802 1.00 . A A . 14 ARG CZ 1 1 20 12325 1 1 14 ARG H H -3.593 -4.027 -0.707 1.00 . A A . 14 ARG H 1 1 20 12326 1 1 14 ARG HA H -3.062 -2.204 -2.904 1.00 . A A . 14 ARG HA 1 1 20 12327 1 1 14 ARG HB2 H -5.368 -3.193 -3.263 1.00 . A A . 14 ARG HB2 1 1 20 12328 1 1 14 ARG HB3 H -5.853 -2.393 -1.774 1.00 . A A . 14 ARG HB3 1 1 20 12329 1 1 14 ARG HD2 H -7.509 -1.680 -3.406 1.00 . A A . 14 ARG HD2 1 1 20 12330 1 1 14 ARG HD3 H -7.191 -0.197 -2.507 1.00 . A A . 14 ARG HD3 1 1 20 12331 1 1 14 ARG HE H -7.565 0.976 -4.425 1.00 . A A . 14 ARG HE 1 1 20 12332 1 1 14 ARG HG2 H -4.934 -0.257 -2.936 1.00 . A A . 14 ARG HG2 1 1 20 12333 1 1 14 ARG HG3 H -5.130 -1.205 -4.411 1.00 . A A . 14 ARG HG3 1 1 20 12334 1 1 14 ARG HH11 H -6.816 -2.318 -5.267 1.00 . A A . 14 ARG HH11 1 1 20 12335 1 1 14 ARG HH12 H -7.127 -2.094 -6.956 1.00 . A A . 14 ARG HH12 1 1 20 12336 1 1 14 ARG HH21 H -7.977 1.284 -6.647 1.00 . A A . 14 ARG HH21 1 1 20 12337 1 1 14 ARG HH22 H -7.786 -0.045 -7.740 1.00 . A A . 14 ARG HH22 1 1 20 12338 1 1 14 ARG N N -3.447 -3.795 -1.648 1.00 . A A . 14 ARG N 1 1 20 12339 1 1 14 ARG NE N -7.336 0.034 -4.568 1.00 . A A . 14 ARG NE 1 1 20 12340 1 1 14 ARG NH1 N -7.085 -1.727 -6.027 1.00 . A A . 14 ARG NH1 1 1 20 12341 1 1 14 ARG NH2 N -7.747 0.325 -6.813 1.00 . A A . 14 ARG NH2 1 1 20 12342 1 1 14 ARG O O -3.704 -1.759 0.206 1.00 . A A . 14 ARG O 1 1 20 12343 1 1 15 CYS C C -4.214 1.595 -0.046 1.00 . A A . 15 CYS C 1 1 20 12344 1 1 15 CYS CA C -2.923 0.841 -0.353 1.00 . A A . 15 CYS CA 1 1 20 12345 1 1 15 CYS CB C -1.860 1.815 -0.864 1.00 . A A . 15 CYS CB 1 1 20 12346 1 1 15 CYS H H -3.036 -0.013 -2.287 1.00 . A A . 15 CYS H 1 1 20 12347 1 1 15 CYS HA H -2.568 0.377 0.554 1.00 . A A . 15 CYS HA 1 1 20 12348 1 1 15 CYS HB2 H -1.064 1.254 -1.333 1.00 . A A . 15 CYS HB2 1 1 20 12349 1 1 15 CYS HB3 H -2.307 2.474 -1.593 1.00 . A A . 15 CYS HB3 1 1 20 12350 1 1 15 CYS N N -3.157 -0.212 -1.334 1.00 . A A . 15 CYS N 1 1 20 12351 1 1 15 CYS O O -4.702 2.371 -0.868 1.00 . A A . 15 CYS O 1 1 20 12352 1 1 15 CYS SG S -1.113 2.849 0.437 1.00 . A A . 15 CYS SG 1 1 20 12353 1 1 16 ALA C C -5.796 3.526 1.682 1.00 . A A . 16 ALA C 1 1 20 12354 1 1 16 ALA CA C -5.993 2.019 1.558 1.00 . A A . 16 ALA CA 1 1 20 12355 1 1 16 ALA CB C -6.482 1.439 2.877 1.00 . A A . 16 ALA CB 1 1 20 12356 1 1 16 ALA H H -4.326 0.732 1.753 1.00 . A A . 16 ALA H 1 1 20 12357 1 1 16 ALA HA H -6.746 1.826 0.807 1.00 . A A . 16 ALA HA 1 1 20 12358 1 1 16 ALA HB1 H -6.934 0.474 2.700 1.00 . A A . 16 ALA HB1 1 1 20 12359 1 1 16 ALA HB2 H -5.646 1.326 3.552 1.00 . A A . 16 ALA HB2 1 1 20 12360 1 1 16 ALA HB3 H -7.211 2.104 3.315 1.00 . A A . 16 ALA HB3 1 1 20 12361 1 1 16 ALA N N -4.761 1.361 1.142 1.00 . A A . 16 ALA N 1 1 20 12362 1 1 16 ALA O O -6.756 4.274 1.861 1.00 . A A . 16 ALA O 1 1 20 12363 1 1 17 GLU C C -4.420 6.085 0.350 1.00 . A A . 17 GLU C 1 1 20 12364 1 1 17 GLU CA C -4.222 5.382 1.690 1.00 . A A . 17 GLU CA 1 1 20 12365 1 1 17 GLU CB C -2.779 5.567 2.167 1.00 . A A . 17 GLU CB 1 1 20 12366 1 1 17 GLU CD C -2.865 3.598 3.747 1.00 . A A . 17 GLU CD 1 1 20 12367 1 1 17 GLU CG C -2.537 5.069 3.582 1.00 . A A . 17 GLU CG 1 1 20 12368 1 1 17 GLU H H -3.821 3.318 1.444 1.00 . A A . 17 GLU H 1 1 20 12369 1 1 17 GLU HA H -4.890 5.822 2.416 1.00 . A A . 17 GLU HA 1 1 20 12370 1 1 17 GLU HB2 H -2.121 5.030 1.500 1.00 . A A . 17 GLU HB2 1 1 20 12371 1 1 17 GLU HB3 H -2.533 6.618 2.130 1.00 . A A . 17 GLU HB3 1 1 20 12372 1 1 17 GLU HG2 H -1.498 5.221 3.830 1.00 . A A . 17 GLU HG2 1 1 20 12373 1 1 17 GLU HG3 H -3.155 5.639 4.261 1.00 . A A . 17 GLU HG3 1 1 20 12374 1 1 17 GLU N N -4.544 3.964 1.587 1.00 . A A . 17 GLU N 1 1 20 12375 1 1 17 GLU O O -5.274 6.962 0.216 1.00 . A A . 17 GLU O 1 1 20 12376 1 1 17 GLU OE1 O -2.120 2.760 3.197 1.00 . A A . 17 GLU OE1 1 1 20 12377 1 1 17 GLU OE2 O -3.865 3.285 4.425 1.00 . A A . 17 GLU OE2 1 1 20 12378 1 1 18 CYS C C -4.579 5.430 -2.889 1.00 . A A . 18 CYS C 1 1 20 12379 1 1 18 CYS CA C -3.711 6.284 -1.970 1.00 . A A . 18 CYS CA 1 1 20 12380 1 1 18 CYS CB C -2.313 6.442 -2.572 1.00 . A A . 18 CYS CB 1 1 20 12381 1 1 18 CYS H H -2.964 4.988 -0.472 1.00 . A A . 18 CYS H 1 1 20 12382 1 1 18 CYS HA H -4.164 7.259 -1.871 1.00 . A A . 18 CYS HA 1 1 20 12383 1 1 18 CYS HB2 H -2.406 6.765 -3.598 1.00 . A A . 18 CYS HB2 1 1 20 12384 1 1 18 CYS HB3 H -1.771 7.190 -2.012 1.00 . A A . 18 CYS HB3 1 1 20 12385 1 1 18 CYS N N -3.625 5.693 -0.640 1.00 . A A . 18 CYS N 1 1 20 12386 1 1 18 CYS O O -5.472 5.938 -3.566 1.00 . A A . 18 CYS O 1 1 20 12387 1 1 18 CYS SG S -1.322 4.913 -2.562 1.00 . A A . 18 CYS SG 1 1 20 12388 1 1 19 GLY C C -4.210 2.512 -4.770 1.00 . A A . 19 GLY C 1 1 20 12389 1 1 19 GLY CA C -5.074 3.224 -3.747 1.00 . A A . 19 GLY CA 1 1 20 12390 1 1 19 GLY H H -3.585 3.778 -2.348 1.00 . A A . 19 GLY H 1 1 20 12391 1 1 19 GLY HA2 H -5.553 2.487 -3.121 1.00 . A A . 19 GLY HA2 1 1 20 12392 1 1 19 GLY HA3 H -5.834 3.789 -4.267 1.00 . A A . 19 GLY HA3 1 1 20 12393 1 1 19 GLY N N -4.309 4.128 -2.908 1.00 . A A . 19 GLY N 1 1 20 12394 1 1 19 GLY O O -4.681 2.151 -5.849 1.00 . A A . 19 GLY O 1 1 20 12395 1 1 20 LYS C C -2.186 0.124 -5.262 1.00 . A A . 20 LYS C 1 1 20 12396 1 1 20 LYS CA C -2.008 1.637 -5.328 1.00 . A A . 20 LYS CA 1 1 20 12397 1 1 20 LYS CB C -0.567 2.009 -4.970 1.00 . A A . 20 LYS CB 1 1 20 12398 1 1 20 LYS CD C 1.453 3.377 -5.569 1.00 . A A . 20 LYS CD 1 1 20 12399 1 1 20 LYS CE C 2.188 2.591 -6.643 1.00 . A A . 20 LYS CE 1 1 20 12400 1 1 20 LYS CG C -0.054 3.234 -5.707 1.00 . A A . 20 LYS CG 1 1 20 12401 1 1 20 LYS H H -2.624 2.621 -3.558 1.00 . A A . 20 LYS H 1 1 20 12402 1 1 20 LYS HA H -2.217 1.969 -6.334 1.00 . A A . 20 LYS HA 1 1 20 12403 1 1 20 LYS HB2 H -0.511 2.203 -3.909 1.00 . A A . 20 LYS HB2 1 1 20 12404 1 1 20 LYS HB3 H 0.077 1.175 -5.209 1.00 . A A . 20 LYS HB3 1 1 20 12405 1 1 20 LYS HD2 H 1.716 4.420 -5.658 1.00 . A A . 20 LYS HD2 1 1 20 12406 1 1 20 LYS HD3 H 1.753 3.010 -4.597 1.00 . A A . 20 LYS HD3 1 1 20 12407 1 1 20 LYS HE2 H 3.221 2.485 -6.350 1.00 . A A . 20 LYS HE2 1 1 20 12408 1 1 20 LYS HE3 H 1.737 1.614 -6.729 1.00 . A A . 20 LYS HE3 1 1 20 12409 1 1 20 LYS HG2 H -0.301 3.143 -6.754 1.00 . A A . 20 LYS HG2 1 1 20 12410 1 1 20 LYS HG3 H -0.529 4.114 -5.298 1.00 . A A . 20 LYS HG3 1 1 20 12411 1 1 20 LYS HZ1 H 2.468 2.632 -8.713 1.00 . A A . 20 LYS HZ1 1 1 20 12412 1 1 20 LYS HZ2 H 2.724 4.124 -7.957 1.00 . A A . 20 LYS HZ2 1 1 20 12413 1 1 20 LYS HZ3 H 1.149 3.548 -8.182 1.00 . A A . 20 LYS HZ3 1 1 20 12414 1 1 20 LYS N N -2.941 2.310 -4.432 1.00 . A A . 20 LYS N 1 1 20 12415 1 1 20 LYS NZ N 2.128 3.271 -7.967 1.00 . A A . 20 LYS NZ 1 1 20 12416 1 1 20 LYS O O -2.895 -0.390 -4.398 1.00 . A A . 20 LYS O 1 1 20 12417 1 1 21 ALA C C -0.253 -2.675 -5.982 1.00 . A A . 21 ALA C 1 1 20 12418 1 1 21 ALA CA C -1.618 -2.039 -6.222 1.00 . A A . 21 ALA CA 1 1 20 12419 1 1 21 ALA CB C -2.188 -2.496 -7.557 1.00 . A A . 21 ALA CB 1 1 20 12420 1 1 21 ALA H H -0.984 -0.117 -6.842 1.00 . A A . 21 ALA H 1 1 20 12421 1 1 21 ALA HA H -2.295 -2.358 -5.442 1.00 . A A . 21 ALA HA 1 1 20 12422 1 1 21 ALA HB1 H -1.414 -2.982 -8.131 1.00 . A A . 21 ALA HB1 1 1 20 12423 1 1 21 ALA HB2 H -2.998 -3.190 -7.383 1.00 . A A . 21 ALA HB2 1 1 20 12424 1 1 21 ALA HB3 H -2.558 -1.640 -8.102 1.00 . A A . 21 ALA HB3 1 1 20 12425 1 1 21 ALA N N -1.535 -0.584 -6.179 1.00 . A A . 21 ALA N 1 1 20 12426 1 1 21 ALA O O 0.770 -2.162 -6.437 1.00 . A A . 21 ALA O 1 1 20 12427 1 1 22 PHE C C 0.789 -6.008 -5.009 1.00 . A A . 22 PHE C 1 1 20 12428 1 1 22 PHE CA C 0.996 -4.498 -4.962 1.00 . A A . 22 PHE CA 1 1 20 12429 1 1 22 PHE CB C 1.520 -4.085 -3.585 1.00 . A A . 22 PHE CB 1 1 20 12430 1 1 22 PHE CD1 C 0.911 -1.672 -3.264 1.00 . A A . 22 PHE CD1 1 1 20 12431 1 1 22 PHE CD2 C 3.201 -2.224 -3.635 1.00 . A A . 22 PHE CD2 1 1 20 12432 1 1 22 PHE CE1 C 1.245 -0.334 -3.179 1.00 . A A . 22 PHE CE1 1 1 20 12433 1 1 22 PHE CE2 C 3.541 -0.886 -3.551 1.00 . A A . 22 PHE CE2 1 1 20 12434 1 1 22 PHE CG C 1.885 -2.631 -3.493 1.00 . A A . 22 PHE CG 1 1 20 12435 1 1 22 PHE CZ C 2.561 0.060 -3.322 1.00 . A A . 22 PHE CZ 1 1 20 12436 1 1 22 PHE H H -1.092 -4.152 -4.929 1.00 . A A . 22 PHE H 1 1 20 12437 1 1 22 PHE HA H 1.723 -4.223 -5.711 1.00 . A A . 22 PHE HA 1 1 20 12438 1 1 22 PHE HB2 H 0.759 -4.283 -2.845 1.00 . A A . 22 PHE HB2 1 1 20 12439 1 1 22 PHE HB3 H 2.400 -4.665 -3.354 1.00 . A A . 22 PHE HB3 1 1 20 12440 1 1 22 PHE HD1 H -0.118 -1.978 -3.151 1.00 . A A . 22 PHE HD1 1 1 20 12441 1 1 22 PHE HD2 H 3.969 -2.964 -3.814 1.00 . A A . 22 PHE HD2 1 1 20 12442 1 1 22 PHE HE1 H 0.477 0.404 -3.000 1.00 . A A . 22 PHE HE1 1 1 20 12443 1 1 22 PHE HE2 H 4.571 -0.583 -3.663 1.00 . A A . 22 PHE HE2 1 1 20 12444 1 1 22 PHE HZ H 2.824 1.105 -3.257 1.00 . A A . 22 PHE HZ 1 1 20 12445 1 1 22 PHE N N -0.244 -3.793 -5.264 1.00 . A A . 22 PHE N 1 1 20 12446 1 1 22 PHE O O -0.200 -6.528 -4.489 1.00 . A A . 22 PHE O 1 1 20 12447 1 1 23 THR C C 2.012 -8.839 -4.438 1.00 . A A . 23 THR C 1 1 20 12448 1 1 23 THR CA C 1.648 -8.161 -5.753 1.00 . A A . 23 THR CA 1 1 20 12449 1 1 23 THR CB C 2.577 -8.687 -6.863 1.00 . A A . 23 THR CB 1 1 20 12450 1 1 23 THR CG2 C 2.168 -8.133 -8.220 1.00 . A A . 23 THR CG2 1 1 20 12451 1 1 23 THR H H 2.491 -6.239 -6.031 1.00 . A A . 23 THR H 1 1 20 12452 1 1 23 THR HA H 0.631 -8.419 -6.011 1.00 . A A . 23 THR HA 1 1 20 12453 1 1 23 THR HB H 2.502 -9.764 -6.894 1.00 . A A . 23 THR HB 1 1 20 12454 1 1 23 THR HG1 H 4.468 -9.113 -6.500 1.00 . A A . 23 THR HG1 1 1 20 12455 1 1 23 THR HG21 H 2.671 -8.683 -9.000 1.00 . A A . 23 THR HG21 1 1 20 12456 1 1 23 THR HG22 H 2.442 -7.090 -8.280 1.00 . A A . 23 THR HG22 1 1 20 12457 1 1 23 THR HG23 H 1.099 -8.232 -8.341 1.00 . A A . 23 THR HG23 1 1 20 12458 1 1 23 THR N N 1.727 -6.710 -5.636 1.00 . A A . 23 THR N 1 1 20 12459 1 1 23 THR O O 1.439 -9.868 -4.080 1.00 . A A . 23 THR O 1 1 20 12460 1 1 23 THR OG1 O 3.932 -8.320 -6.582 1.00 . A A . 23 THR OG1 1 1 20 12461 1 1 24 ASP C C 3.105 -7.834 -1.304 1.00 . A A . 24 ASP C 1 1 20 12462 1 1 24 ASP CA C 3.406 -8.803 -2.443 1.00 . A A . 24 ASP CA 1 1 20 12463 1 1 24 ASP CB C 4.903 -9.112 -2.484 1.00 . A A . 24 ASP CB 1 1 20 12464 1 1 24 ASP CG C 5.209 -10.399 -3.225 1.00 . A A . 24 ASP CG 1 1 20 12465 1 1 24 ASP H H 3.385 -7.437 -4.060 1.00 . A A . 24 ASP H 1 1 20 12466 1 1 24 ASP HA H 2.863 -9.721 -2.271 1.00 . A A . 24 ASP HA 1 1 20 12467 1 1 24 ASP HB2 H 5.418 -8.302 -2.980 1.00 . A A . 24 ASP HB2 1 1 20 12468 1 1 24 ASP HB3 H 5.273 -9.203 -1.473 1.00 . A A . 24 ASP HB3 1 1 20 12469 1 1 24 ASP N N 2.966 -8.256 -3.721 1.00 . A A . 24 ASP N 1 1 20 12470 1 1 24 ASP O O 2.858 -6.650 -1.533 1.00 . A A . 24 ASP O 1 1 20 12471 1 1 24 ASP OD1 O 4.916 -10.469 -4.437 1.00 . A A . 24 ASP OD1 1 1 20 12472 1 1 24 ASP OD2 O 5.740 -11.336 -2.593 1.00 . A A . 24 ASP OD2 1 1 20 12473 1 1 25 ARG C C 4.086 -6.725 1.500 1.00 . A A . 25 ARG C 1 1 20 12474 1 1 25 ARG CA C 2.852 -7.526 1.097 1.00 . A A . 25 ARG CA 1 1 20 12475 1 1 25 ARG CB C 2.397 -8.404 2.264 1.00 . A A . 25 ARG CB 1 1 20 12476 1 1 25 ARG CD C 1.219 -8.553 4.479 1.00 . A A . 25 ARG CD 1 1 20 12477 1 1 25 ARG CG C 1.744 -7.625 3.394 1.00 . A A . 25 ARG CG 1 1 20 12478 1 1 25 ARG CZ C -0.669 -10.107 4.724 1.00 . A A . 25 ARG CZ 1 1 20 12479 1 1 25 ARG H H 3.328 -9.297 0.041 1.00 . A A . 25 ARG H 1 1 20 12480 1 1 25 ARG HA H 2.058 -6.839 0.844 1.00 . A A . 25 ARG HA 1 1 20 12481 1 1 25 ARG HB2 H 1.685 -9.129 1.898 1.00 . A A . 25 ARG HB2 1 1 20 12482 1 1 25 ARG HB3 H 3.255 -8.924 2.663 1.00 . A A . 25 ARG HB3 1 1 20 12483 1 1 25 ARG HD2 H 2.049 -9.107 4.892 1.00 . A A . 25 ARG HD2 1 1 20 12484 1 1 25 ARG HD3 H 0.763 -7.955 5.254 1.00 . A A . 25 ARG HD3 1 1 20 12485 1 1 25 ARG HE H 0.238 -9.680 3.000 1.00 . A A . 25 ARG HE 1 1 20 12486 1 1 25 ARG HG2 H 2.474 -6.958 3.828 1.00 . A A . 25 ARG HG2 1 1 20 12487 1 1 25 ARG HG3 H 0.921 -7.051 2.994 1.00 . A A . 25 ARG HG3 1 1 20 12488 1 1 25 ARG HH11 H -0.053 -9.240 6.442 1.00 . A A . 25 ARG HH11 1 1 20 12489 1 1 25 ARG HH12 H -1.384 -10.338 6.600 1.00 . A A . 25 ARG HH12 1 1 20 12490 1 1 25 ARG HH21 H -1.513 -11.128 3.197 1.00 . A A . 25 ARG HH21 1 1 20 12491 1 1 25 ARG HH22 H -2.213 -11.412 4.754 1.00 . A A . 25 ARG HH22 1 1 20 12492 1 1 25 ARG N N 3.125 -8.345 -0.078 1.00 . A A . 25 ARG N 1 1 20 12493 1 1 25 ARG NE N 0.230 -9.495 3.962 1.00 . A A . 25 ARG NE 1 1 20 12494 1 1 25 ARG NH1 N -0.705 -9.877 6.029 1.00 . A A . 25 ARG NH1 1 1 20 12495 1 1 25 ARG NH2 N -1.537 -10.952 4.180 1.00 . A A . 25 ARG NH2 1 1 20 12496 1 1 25 ARG O O 4.013 -5.514 1.706 1.00 . A A . 25 ARG O 1 1 20 12497 1 1 26 SER C C 6.619 -5.414 1.296 1.00 . A A . 26 SER C 1 1 20 12498 1 1 26 SER CA C 6.470 -6.764 1.993 1.00 . A A . 26 SER CA 1 1 20 12499 1 1 26 SER CB C 7.659 -7.662 1.648 1.00 . A A . 26 SER CB 1 1 20 12500 1 1 26 SER H H 5.215 -8.374 1.432 1.00 . A A . 26 SER H 1 1 20 12501 1 1 26 SER HA H 6.447 -6.604 3.060 1.00 . A A . 26 SER HA 1 1 20 12502 1 1 26 SER HB2 H 7.536 -8.051 0.649 1.00 . A A . 26 SER HB2 1 1 20 12503 1 1 26 SER HB3 H 8.570 -7.084 1.700 1.00 . A A . 26 SER HB3 1 1 20 12504 1 1 26 SER HG H 7.120 -9.425 2.310 1.00 . A A . 26 SER HG 1 1 20 12505 1 1 26 SER N N 5.220 -7.410 1.610 1.00 . A A . 26 SER N 1 1 20 12506 1 1 26 SER O O 6.980 -4.418 1.921 1.00 . A A . 26 SER O 1 1 20 12507 1 1 26 SER OG O 7.756 -8.749 2.553 1.00 . A A . 26 SER OG 1 1 20 12508 1 1 27 ASN C C 5.417 -3.134 -0.319 1.00 . A A . 27 ASN C 1 1 20 12509 1 1 27 ASN CA C 6.441 -4.165 -0.785 1.00 . A A . 27 ASN CA 1 1 20 12510 1 1 27 ASN CB C 6.237 -4.466 -2.272 1.00 . A A . 27 ASN CB 1 1 20 12511 1 1 27 ASN CG C 7.414 -5.205 -2.879 1.00 . A A . 27 ASN CG 1 1 20 12512 1 1 27 ASN H H 6.055 -6.219 -0.445 1.00 . A A . 27 ASN H 1 1 20 12513 1 1 27 ASN HA H 7.432 -3.763 -0.641 1.00 . A A . 27 ASN HA 1 1 20 12514 1 1 27 ASN HB2 H 5.354 -5.076 -2.392 1.00 . A A . 27 ASN HB2 1 1 20 12515 1 1 27 ASN HB3 H 6.104 -3.537 -2.806 1.00 . A A . 27 ASN HB3 1 1 20 12516 1 1 27 ASN HD21 H 8.284 -3.480 -3.352 1.00 . A A . 27 ASN HD21 1 1 20 12517 1 1 27 ASN HD22 H 9.155 -4.906 -3.792 1.00 . A A . 27 ASN HD22 1 1 20 12518 1 1 27 ASN N N 6.338 -5.392 -0.002 1.00 . A A . 27 ASN N 1 1 20 12519 1 1 27 ASN ND2 N 8.382 -4.455 -3.393 1.00 . A A . 27 ASN ND2 1 1 20 12520 1 1 27 ASN O O 5.760 -1.983 -0.045 1.00 . A A . 27 ASN O 1 1 20 12521 1 1 27 ASN OD1 O 7.453 -6.435 -2.885 1.00 . A A . 27 ASN OD1 1 1 20 12522 1 1 28 LEU C C 3.460 -1.955 1.500 1.00 . A A . 28 LEU C 1 1 20 12523 1 1 28 LEU CA C 3.086 -2.669 0.205 1.00 . A A . 28 LEU CA 1 1 20 12524 1 1 28 LEU CB C 1.793 -3.462 0.401 1.00 . A A . 28 LEU CB 1 1 20 12525 1 1 28 LEU CD1 C 0.193 -1.562 0.065 1.00 . A A . 28 LEU CD1 1 1 20 12526 1 1 28 LEU CD2 C -0.554 -3.624 1.267 1.00 . A A . 28 LEU CD2 1 1 20 12527 1 1 28 LEU CG C 0.615 -2.689 0.995 1.00 . A A . 28 LEU CG 1 1 20 12528 1 1 28 LEU H H 3.949 -4.483 -0.461 1.00 . A A . 28 LEU H 1 1 20 12529 1 1 28 LEU HA H 2.933 -1.931 -0.568 1.00 . A A . 28 LEU HA 1 1 20 12530 1 1 28 LEU HB2 H 1.488 -3.840 -0.562 1.00 . A A . 28 LEU HB2 1 1 20 12531 1 1 28 LEU HB3 H 2.011 -4.291 1.059 1.00 . A A . 28 LEU HB3 1 1 20 12532 1 1 28 LEU HD11 H -0.479 -0.897 0.586 1.00 . A A . 28 LEU HD11 1 1 20 12533 1 1 28 LEU HD12 H -0.307 -1.975 -0.798 1.00 . A A . 28 LEU HD12 1 1 20 12534 1 1 28 LEU HD13 H 1.067 -1.013 -0.254 1.00 . A A . 28 LEU HD13 1 1 20 12535 1 1 28 LEU HD21 H -1.240 -3.595 0.434 1.00 . A A . 28 LEU HD21 1 1 20 12536 1 1 28 LEU HD22 H -1.065 -3.309 2.165 1.00 . A A . 28 LEU HD22 1 1 20 12537 1 1 28 LEU HD23 H -0.187 -4.631 1.397 1.00 . A A . 28 LEU HD23 1 1 20 12538 1 1 28 LEU HG H 0.919 -2.249 1.935 1.00 . A A . 28 LEU HG 1 1 20 12539 1 1 28 LEU N N 4.161 -3.555 -0.229 1.00 . A A . 28 LEU N 1 1 20 12540 1 1 28 LEU O O 3.456 -0.725 1.566 1.00 . A A . 28 LEU O 1 1 20 12541 1 1 29 PHE C C 5.254 -1.123 3.660 1.00 . A A . 29 PHE C 1 1 20 12542 1 1 29 PHE CA C 4.160 -2.175 3.820 1.00 . A A . 29 PHE CA 1 1 20 12543 1 1 29 PHE CB C 4.639 -3.285 4.759 1.00 . A A . 29 PHE CB 1 1 20 12544 1 1 29 PHE CD1 C 2.617 -3.143 6.239 1.00 . A A . 29 PHE CD1 1 1 20 12545 1 1 29 PHE CD2 C 3.402 -5.301 5.597 1.00 . A A . 29 PHE CD2 1 1 20 12546 1 1 29 PHE CE1 C 1.596 -3.726 6.965 1.00 . A A . 29 PHE CE1 1 1 20 12547 1 1 29 PHE CE2 C 2.383 -5.890 6.321 1.00 . A A . 29 PHE CE2 1 1 20 12548 1 1 29 PHE CG C 3.530 -3.922 5.547 1.00 . A A . 29 PHE CG 1 1 20 12549 1 1 29 PHE CZ C 1.479 -5.102 7.007 1.00 . A A . 29 PHE CZ 1 1 20 12550 1 1 29 PHE H H 3.767 -3.707 2.413 1.00 . A A . 29 PHE H 1 1 20 12551 1 1 29 PHE HA H 3.286 -1.707 4.246 1.00 . A A . 29 PHE HA 1 1 20 12552 1 1 29 PHE HB2 H 5.118 -4.058 4.176 1.00 . A A . 29 PHE HB2 1 1 20 12553 1 1 29 PHE HB3 H 5.351 -2.873 5.458 1.00 . A A . 29 PHE HB3 1 1 20 12554 1 1 29 PHE HD1 H 2.708 -2.066 6.207 1.00 . A A . 29 PHE HD1 1 1 20 12555 1 1 29 PHE HD2 H 4.109 -5.919 5.062 1.00 . A A . 29 PHE HD2 1 1 20 12556 1 1 29 PHE HE1 H 0.891 -3.106 7.500 1.00 . A A . 29 PHE HE1 1 1 20 12557 1 1 29 PHE HE2 H 2.294 -6.966 6.353 1.00 . A A . 29 PHE HE2 1 1 20 12558 1 1 29 PHE HZ H 0.682 -5.559 7.573 1.00 . A A . 29 PHE HZ 1 1 20 12559 1 1 29 PHE N N 3.783 -2.733 2.527 1.00 . A A . 29 PHE N 1 1 20 12560 1 1 29 PHE O O 5.166 -0.029 4.219 1.00 . A A . 29 PHE O 1 1 20 12561 1 1 30 THR C C 6.922 0.735 1.988 1.00 . A A . 30 THR C 1 1 20 12562 1 1 30 THR CA C 7.397 -0.548 2.660 1.00 . A A . 30 THR CA 1 1 20 12563 1 1 30 THR CB C 8.485 -1.200 1.786 1.00 . A A . 30 THR CB 1 1 20 12564 1 1 30 THR CG2 C 9.619 -0.222 1.515 1.00 . A A . 30 THR CG2 1 1 20 12565 1 1 30 THR H H 6.298 -2.347 2.475 1.00 . A A . 30 THR H 1 1 20 12566 1 1 30 THR HA H 7.833 -0.302 3.617 1.00 . A A . 30 THR HA 1 1 20 12567 1 1 30 THR HB H 8.044 -1.486 0.842 1.00 . A A . 30 THR HB 1 1 20 12568 1 1 30 THR HG1 H 9.166 -3.051 1.781 1.00 . A A . 30 THR HG1 1 1 20 12569 1 1 30 THR HG21 H 9.208 0.738 1.242 1.00 . A A . 30 THR HG21 1 1 20 12570 1 1 30 THR HG22 H 10.230 -0.595 0.707 1.00 . A A . 30 THR HG22 1 1 20 12571 1 1 30 THR HG23 H 10.222 -0.115 2.404 1.00 . A A . 30 THR HG23 1 1 20 12572 1 1 30 THR N N 6.285 -1.461 2.893 1.00 . A A . 30 THR N 1 1 20 12573 1 1 30 THR O O 7.513 1.800 2.173 1.00 . A A . 30 THR O 1 1 20 12574 1 1 30 THR OG1 O 9.001 -2.367 2.435 1.00 . A A . 30 THR OG1 1 1 20 12575 1 1 31 HIS C C 4.443 2.628 1.448 1.00 . A A . 31 HIS C 1 1 20 12576 1 1 31 HIS CA C 5.297 1.782 0.508 1.00 . A A . 31 HIS CA 1 1 20 12577 1 1 31 HIS CB C 4.461 1.327 -0.688 1.00 . A A . 31 HIS CB 1 1 20 12578 1 1 31 HIS CD2 C 2.170 2.542 -0.726 1.00 . A A . 31 HIS CD2 1 1 20 12579 1 1 31 HIS CE1 C 2.622 4.029 -2.273 1.00 . A A . 31 HIS CE1 1 1 20 12580 1 1 31 HIS CG C 3.446 2.336 -1.129 1.00 . A A . 31 HIS CG 1 1 20 12581 1 1 31 HIS H H 5.425 -0.247 1.099 1.00 . A A . 31 HIS H 1 1 20 12582 1 1 31 HIS HA H 6.121 2.382 0.153 1.00 . A A . 31 HIS HA 1 1 20 12583 1 1 31 HIS HB2 H 5.117 1.130 -1.523 1.00 . A A . 31 HIS HB2 1 1 20 12584 1 1 31 HIS HB3 H 3.936 0.419 -0.427 1.00 . A A . 31 HIS HB3 1 1 20 12585 1 1 31 HIS HD1 H 4.541 3.393 -2.586 1.00 . A A . 31 HIS HD1 1 1 20 12586 1 1 31 HIS HD2 H 1.636 1.980 0.027 1.00 . A A . 31 HIS HD2 1 1 20 12587 1 1 31 HIS HE1 H 2.527 4.849 -2.969 1.00 . A A . 31 HIS HE1 1 1 20 12588 1 1 31 HIS N N 5.852 0.628 1.207 1.00 . A A . 31 HIS N 1 1 20 12589 1 1 31 HIS ND1 N 3.698 3.283 -2.099 1.00 . A A . 31 HIS ND1 1 1 20 12590 1 1 31 HIS NE2 N 1.680 3.600 -1.453 1.00 . A A . 31 HIS NE2 1 1 20 12591 1 1 31 HIS O O 4.596 3.847 1.511 1.00 . A A . 31 HIS O 1 1 20 12592 1 1 32 GLN C C 3.455 3.645 3.973 1.00 . A A . 32 GLN C 1 1 20 12593 1 1 32 GLN CA C 2.667 2.664 3.111 1.00 . A A . 32 GLN CA 1 1 20 12594 1 1 32 GLN CB C 1.938 1.656 4.001 1.00 . A A . 32 GLN CB 1 1 20 12595 1 1 32 GLN CD C 0.177 -0.150 4.151 1.00 . A A . 32 GLN CD 1 1 20 12596 1 1 32 GLN CG C 0.791 0.944 3.300 1.00 . A A . 32 GLN CG 1 1 20 12597 1 1 32 GLN H H 3.471 1.000 2.081 1.00 . A A . 32 GLN H 1 1 20 12598 1 1 32 GLN HA H 1.939 3.215 2.535 1.00 . A A . 32 GLN HA 1 1 20 12599 1 1 32 GLN HB2 H 2.645 0.912 4.336 1.00 . A A . 32 GLN HB2 1 1 20 12600 1 1 32 GLN HB3 H 1.539 2.175 4.860 1.00 . A A . 32 GLN HB3 1 1 20 12601 1 1 32 GLN HE21 H -1.603 0.176 3.328 1.00 . A A . 32 GLN HE21 1 1 20 12602 1 1 32 GLN HE22 H -1.544 -1.072 4.521 1.00 . A A . 32 GLN HE22 1 1 20 12603 1 1 32 GLN HG2 H 0.025 1.668 3.064 1.00 . A A . 32 GLN HG2 1 1 20 12604 1 1 32 GLN HG3 H 1.163 0.504 2.387 1.00 . A A . 32 GLN HG3 1 1 20 12605 1 1 32 GLN N N 3.545 1.972 2.176 1.00 . A A . 32 GLN N 1 1 20 12606 1 1 32 GLN NE2 N -1.122 -0.371 3.984 1.00 . A A . 32 GLN NE2 1 1 20 12607 1 1 32 GLN O O 2.888 4.570 4.556 1.00 . A A . 32 GLN O 1 1 20 12608 1 1 32 GLN OE1 O 0.862 -0.789 4.951 1.00 . A A . 32 GLN OE1 1 1 20 12609 1 1 33 LYS C C 5.437 5.765 4.456 1.00 . A A . 33 LYS C 1 1 20 12610 1 1 33 LYS CA C 5.632 4.302 4.841 1.00 . A A . 33 LYS CA 1 1 20 12611 1 1 33 LYS CB C 7.097 3.904 4.649 1.00 . A A . 33 LYS CB 1 1 20 12612 1 1 33 LYS CD C 8.916 2.539 5.716 1.00 . A A . 33 LYS CD 1 1 20 12613 1 1 33 LYS CE C 9.260 1.234 6.417 1.00 . A A . 33 LYS CE 1 1 20 12614 1 1 33 LYS CG C 7.456 2.577 5.295 1.00 . A A . 33 LYS CG 1 1 20 12615 1 1 33 LYS H H 5.158 2.682 3.563 1.00 . A A . 33 LYS H 1 1 20 12616 1 1 33 LYS HA H 5.367 4.178 5.880 1.00 . A A . 33 LYS HA 1 1 20 12617 1 1 33 LYS HB2 H 7.302 3.833 3.591 1.00 . A A . 33 LYS HB2 1 1 20 12618 1 1 33 LYS HB3 H 7.725 4.671 5.078 1.00 . A A . 33 LYS HB3 1 1 20 12619 1 1 33 LYS HD2 H 9.538 2.639 4.839 1.00 . A A . 33 LYS HD2 1 1 20 12620 1 1 33 LYS HD3 H 9.107 3.362 6.391 1.00 . A A . 33 LYS HD3 1 1 20 12621 1 1 33 LYS HE2 H 8.819 1.242 7.402 1.00 . A A . 33 LYS HE2 1 1 20 12622 1 1 33 LYS HE3 H 8.849 0.415 5.845 1.00 . A A . 33 LYS HE3 1 1 20 12623 1 1 33 LYS HG2 H 6.837 2.432 6.167 1.00 . A A . 33 LYS HG2 1 1 20 12624 1 1 33 LYS HG3 H 7.275 1.781 4.586 1.00 . A A . 33 LYS HG3 1 1 20 12625 1 1 33 LYS HZ1 H 10.994 0.081 6.258 1.00 . A A . 33 LYS HZ1 1 1 20 12626 1 1 33 LYS HZ2 H 11.025 1.193 7.533 1.00 . A A . 33 LYS HZ2 1 1 20 12627 1 1 33 LYS HZ3 H 11.233 1.725 5.941 1.00 . A A . 33 LYS HZ3 1 1 20 12628 1 1 33 LYS N N 4.764 3.437 4.051 1.00 . A A . 33 LYS N 1 1 20 12629 1 1 33 LYS NZ N 10.731 1.045 6.546 1.00 . A A . 33 LYS NZ 1 1 20 12630 1 1 33 LYS O O 5.425 6.647 5.316 1.00 . A A . 33 LYS O 1 1 20 12631 1 1 34 ILE C C 3.828 7.997 3.254 1.00 . A A . 34 ILE C 1 1 20 12632 1 1 34 ILE CA C 5.087 7.372 2.663 1.00 . A A . 34 ILE CA 1 1 20 12633 1 1 34 ILE CB C 4.988 7.400 1.127 1.00 . A A . 34 ILE CB 1 1 20 12634 1 1 34 ILE CD1 C 3.144 7.281 -0.624 1.00 . A A . 34 ILE CD1 1 1 20 12635 1 1 34 ILE CG1 C 3.698 6.717 0.665 1.00 . A A . 34 ILE CG1 1 1 20 12636 1 1 34 ILE CG2 C 6.202 6.726 0.505 1.00 . A A . 34 ILE CG2 1 1 20 12637 1 1 34 ILE H H 5.303 5.272 2.524 1.00 . A A . 34 ILE H 1 1 20 12638 1 1 34 ILE HA H 5.943 7.963 2.959 1.00 . A A . 34 ILE HA 1 1 20 12639 1 1 34 ILE HB H 4.975 8.430 0.807 1.00 . A A . 34 ILE HB 1 1 20 12640 1 1 34 ILE HD11 H 2.069 7.170 -0.633 1.00 . A A . 34 ILE HD11 1 1 20 12641 1 1 34 ILE HD12 H 3.397 8.328 -0.698 1.00 . A A . 34 ILE HD12 1 1 20 12642 1 1 34 ILE HD13 H 3.567 6.747 -1.462 1.00 . A A . 34 ILE HD13 1 1 20 12643 1 1 34 ILE HG12 H 3.889 5.667 0.513 1.00 . A A . 34 ILE HG12 1 1 20 12644 1 1 34 ILE HG13 H 2.944 6.835 1.430 1.00 . A A . 34 ILE HG13 1 1 20 12645 1 1 34 ILE HG21 H 6.894 7.479 0.159 1.00 . A A . 34 ILE HG21 1 1 20 12646 1 1 34 ILE HG22 H 6.686 6.105 1.244 1.00 . A A . 34 ILE HG22 1 1 20 12647 1 1 34 ILE HG23 H 5.888 6.115 -0.329 1.00 . A A . 34 ILE HG23 1 1 20 12648 1 1 34 ILE N N 5.284 6.016 3.160 1.00 . A A . 34 ILE N 1 1 20 12649 1 1 34 ILE O O 3.583 9.193 3.096 1.00 . A A . 34 ILE O 1 1 20 12650 1 1 35 HIS C C 1.904 7.610 6.079 1.00 . A A . 35 HIS C 1 1 20 12651 1 1 35 HIS CA C 1.801 7.653 4.557 1.00 . A A . 35 HIS CA 1 1 20 12652 1 1 35 HIS CB C 0.615 6.808 4.090 1.00 . A A . 35 HIS CB 1 1 20 12653 1 1 35 HIS CD2 C 0.474 5.760 1.722 1.00 . A A . 35 HIS CD2 1 1 20 12654 1 1 35 HIS CE1 C 0.101 7.595 0.581 1.00 . A A . 35 HIS CE1 1 1 20 12655 1 1 35 HIS CG C 0.442 6.788 2.603 1.00 . A A . 35 HIS CG 1 1 20 12656 1 1 35 HIS H H 3.284 6.237 4.031 1.00 . A A . 35 HIS H 1 1 20 12657 1 1 35 HIS HA H 1.646 8.676 4.248 1.00 . A A . 35 HIS HA 1 1 20 12658 1 1 35 HIS HB2 H 0.754 5.790 4.422 1.00 . A A . 35 HIS HB2 1 1 20 12659 1 1 35 HIS HB3 H -0.293 7.202 4.525 1.00 . A A . 35 HIS HB3 1 1 20 12660 1 1 35 HIS HD1 H 0.130 8.834 2.209 1.00 . A A . 35 HIS HD1 1 1 20 12661 1 1 35 HIS HD2 H 0.637 4.718 1.958 1.00 . A A . 35 HIS HD2 1 1 20 12662 1 1 35 HIS HE1 H -0.084 8.278 -0.234 1.00 . A A . 35 HIS HE1 1 1 20 12663 1 1 35 HIS N N 3.034 7.180 3.939 1.00 . A A . 35 HIS N 1 1 20 12664 1 1 35 HIS ND1 N 0.208 7.923 1.856 1.00 . A A . 35 HIS ND1 1 1 20 12665 1 1 35 HIS NE2 N 0.258 6.288 0.473 1.00 . A A . 35 HIS NE2 1 1 20 12666 1 1 35 HIS O O 1.176 8.312 6.782 1.00 . A A . 35 HIS O 1 1 20 12667 1 1 36 THR C C 3.691 7.877 8.601 1.00 . A A . 36 THR C 1 1 20 12668 1 1 36 THR CA C 3.010 6.644 8.019 1.00 . A A . 36 THR CA 1 1 20 12669 1 1 36 THR CB C 3.853 5.399 8.355 1.00 . A A . 36 THR CB 1 1 20 12670 1 1 36 THR CG2 C 3.269 4.156 7.701 1.00 . A A . 36 THR CG2 1 1 20 12671 1 1 36 THR H H 3.362 6.247 5.970 1.00 . A A . 36 THR H 1 1 20 12672 1 1 36 THR HA H 2.039 6.529 8.480 1.00 . A A . 36 THR HA 1 1 20 12673 1 1 36 THR HB H 3.851 5.260 9.427 1.00 . A A . 36 THR HB 1 1 20 12674 1 1 36 THR HG1 H 5.214 6.206 7.177 1.00 . A A . 36 THR HG1 1 1 20 12675 1 1 36 THR HG21 H 3.690 3.276 8.162 1.00 . A A . 36 THR HG21 1 1 20 12676 1 1 36 THR HG22 H 3.505 4.159 6.647 1.00 . A A . 36 THR HG22 1 1 20 12677 1 1 36 THR HG23 H 2.197 4.153 7.830 1.00 . A A . 36 THR HG23 1 1 20 12678 1 1 36 THR N N 2.812 6.780 6.582 1.00 . A A . 36 THR N 1 1 20 12679 1 1 36 THR O O 4.015 8.818 7.877 1.00 . A A . 36 THR O 1 1 20 12680 1 1 36 THR OG1 O 5.202 5.588 7.912 1.00 . A A . 36 THR OG1 1 1 20 12681 1 1 37 GLY C C 3.549 9.992 11.112 1.00 . A A . 37 GLY C 1 1 20 12682 1 1 37 GLY CA C 4.548 8.990 10.569 1.00 . A A . 37 GLY CA 1 1 20 12683 1 1 37 GLY H H 3.625 7.089 10.440 1.00 . A A . 37 GLY H 1 1 20 12684 1 1 37 GLY HA2 H 5.151 8.620 11.384 1.00 . A A . 37 GLY HA2 1 1 20 12685 1 1 37 GLY HA3 H 5.189 9.489 9.857 1.00 . A A . 37 GLY HA3 1 1 20 12686 1 1 37 GLY N N 3.905 7.866 9.913 1.00 . A A . 37 GLY N 1 1 20 12687 1 1 37 GLY O O 2.572 10.329 10.444 1.00 . A A . 37 GLY O 1 1 20 12688 1 1 38 GLU C C 3.671 12.690 13.374 1.00 . A A . 38 GLU C 1 1 20 12689 1 1 38 GLU CA C 2.905 11.436 12.963 1.00 . A A . 38 GLU CA 1 1 20 12690 1 1 38 GLU CB C 2.227 10.816 14.186 1.00 . A A . 38 GLU CB 1 1 20 12691 1 1 38 GLU CD C 2.570 9.912 16.520 1.00 . A A . 38 GLU CD 1 1 20 12692 1 1 38 GLU CG C 3.201 10.188 15.169 1.00 . A A . 38 GLU CG 1 1 20 12693 1 1 38 GLU H H 4.588 10.162 12.812 1.00 . A A . 38 GLU H 1 1 20 12694 1 1 38 GLU HA H 2.148 11.712 12.244 1.00 . A A . 38 GLU HA 1 1 20 12695 1 1 38 GLU HB2 H 1.670 11.583 14.702 1.00 . A A . 38 GLU HB2 1 1 20 12696 1 1 38 GLU HB3 H 1.542 10.050 13.852 1.00 . A A . 38 GLU HB3 1 1 20 12697 1 1 38 GLU HG2 H 3.556 9.255 14.758 1.00 . A A . 38 GLU HG2 1 1 20 12698 1 1 38 GLU HG3 H 4.035 10.860 15.308 1.00 . A A . 38 GLU HG3 1 1 20 12699 1 1 38 GLU N N 3.793 10.469 12.329 1.00 . A A . 38 GLU N 1 1 20 12700 1 1 38 GLU O O 4.770 12.608 13.923 1.00 . A A . 38 GLU O 1 1 20 12701 1 1 38 GLU OE1 O 2.261 10.884 17.241 1.00 . A A . 38 GLU OE1 1 1 20 12702 1 1 38 GLU OE2 O 2.384 8.723 16.855 1.00 . A A . 38 GLU OE2 1 1 20 12703 1 1 39 LYS C C 3.063 15.730 14.687 1.00 . A A . 39 LYS C 1 1 20 12704 1 1 39 LYS CA C 3.708 15.123 13.445 1.00 . A A . 39 LYS CA 1 1 20 12705 1 1 39 LYS CB C 3.599 16.100 12.272 1.00 . A A . 39 LYS CB 1 1 20 12706 1 1 39 LYS CD C 3.977 18.436 11.429 1.00 . A A . 39 LYS CD 1 1 20 12707 1 1 39 LYS CE C 4.977 19.581 11.417 1.00 . A A . 39 LYS CE 1 1 20 12708 1 1 39 LYS CG C 4.303 17.424 12.515 1.00 . A A . 39 LYS CG 1 1 20 12709 1 1 39 LYS H H 2.206 13.852 12.664 1.00 . A A . 39 LYS H 1 1 20 12710 1 1 39 LYS HA H 4.751 14.936 13.651 1.00 . A A . 39 LYS HA 1 1 20 12711 1 1 39 LYS HB2 H 4.033 15.641 11.396 1.00 . A A . 39 LYS HB2 1 1 20 12712 1 1 39 LYS HB3 H 2.554 16.301 12.082 1.00 . A A . 39 LYS HB3 1 1 20 12713 1 1 39 LYS HD2 H 4.001 17.942 10.469 1.00 . A A . 39 LYS HD2 1 1 20 12714 1 1 39 LYS HD3 H 2.988 18.835 11.606 1.00 . A A . 39 LYS HD3 1 1 20 12715 1 1 39 LYS HE2 H 5.230 19.832 12.436 1.00 . A A . 39 LYS HE2 1 1 20 12716 1 1 39 LYS HE3 H 5.866 19.260 10.895 1.00 . A A . 39 LYS HE3 1 1 20 12717 1 1 39 LYS HG2 H 3.986 17.820 13.468 1.00 . A A . 39 LYS HG2 1 1 20 12718 1 1 39 LYS HG3 H 5.370 17.256 12.530 1.00 . A A . 39 LYS HG3 1 1 20 12719 1 1 39 LYS HZ1 H 4.660 20.770 9.729 1.00 . A A . 39 LYS HZ1 1 1 20 12720 1 1 39 LYS HZ2 H 4.835 21.650 11.164 1.00 . A A . 39 LYS HZ2 1 1 20 12721 1 1 39 LYS HZ3 H 3.394 20.821 10.851 1.00 . A A . 39 LYS HZ3 1 1 20 12722 1 1 39 LYS N N 3.083 13.851 13.104 1.00 . A A . 39 LYS N 1 1 20 12723 1 1 39 LYS NZ N 4.428 20.790 10.743 1.00 . A A . 39 LYS NZ 1 1 20 12724 1 1 39 LYS O O 1.845 15.692 14.865 1.00 . A A . 39 LYS O 1 1 20 12725 1 1 40 PRO C C 2.655 18.222 16.547 1.00 . A A . 40 PRO C 1 1 20 12726 1 1 40 PRO CA C 3.428 16.933 16.806 1.00 . A A . 40 PRO CA 1 1 20 12727 1 1 40 PRO CB C 4.724 17.230 17.564 1.00 . A A . 40 PRO CB 1 1 20 12728 1 1 40 PRO CD C 5.359 16.387 15.420 1.00 . A A . 40 PRO CD 1 1 20 12729 1 1 40 PRO CG C 5.765 17.345 16.505 1.00 . A A . 40 PRO CG 1 1 20 12730 1 1 40 PRO HA H 2.816 16.258 17.387 1.00 . A A . 40 PRO HA 1 1 20 12731 1 1 40 PRO HB2 H 4.618 18.153 18.117 1.00 . A A . 40 PRO HB2 1 1 20 12732 1 1 40 PRO HB3 H 4.941 16.420 18.245 1.00 . A A . 40 PRO HB3 1 1 20 12733 1 1 40 PRO HD2 H 5.627 16.779 14.450 1.00 . A A . 40 PRO HD2 1 1 20 12734 1 1 40 PRO HD3 H 5.816 15.422 15.578 1.00 . A A . 40 PRO HD3 1 1 20 12735 1 1 40 PRO HG2 H 5.791 18.355 16.124 1.00 . A A . 40 PRO HG2 1 1 20 12736 1 1 40 PRO HG3 H 6.729 17.069 16.906 1.00 . A A . 40 PRO HG3 1 1 20 12737 1 1 40 PRO N N 3.896 16.305 15.567 1.00 . A A . 40 PRO N 1 1 20 12738 1 1 40 PRO O O 3.230 19.311 16.539 1.00 . A A . 40 PRO O 1 1 20 12739 1 1 41 SER C C -0.976 18.869 16.180 1.00 . A A . 41 SER C 1 1 20 12740 1 1 41 SER CA C 0.498 19.246 16.074 1.00 . A A . 41 SER CA 1 1 20 12741 1 1 41 SER CB C 0.791 19.817 14.685 1.00 . A A . 41 SER CB 1 1 20 12742 1 1 41 SER H H 0.950 17.196 16.355 1.00 . A A . 41 SER H 1 1 20 12743 1 1 41 SER HA H 0.720 19.997 16.817 1.00 . A A . 41 SER HA 1 1 20 12744 1 1 41 SER HB2 H 1.859 19.900 14.551 1.00 . A A . 41 SER HB2 1 1 20 12745 1 1 41 SER HB3 H 0.384 19.156 13.934 1.00 . A A . 41 SER HB3 1 1 20 12746 1 1 41 SER HG H 0.621 21.714 15.140 1.00 . A A . 41 SER HG 1 1 20 12747 1 1 41 SER N N 1.349 18.091 16.336 1.00 . A A . 41 SER N 1 1 20 12748 1 1 41 SER O O -1.503 18.133 15.346 1.00 . A A . 41 SER O 1 1 20 12749 1 1 41 SER OG O 0.210 21.100 14.528 1.00 . A A . 41 SER OG 1 1 20 12750 1 1 42 GLY C C -3.286 17.647 17.823 1.00 . A A . 42 GLY C 1 1 20 12751 1 1 42 GLY CA C -3.046 19.086 17.412 1.00 . A A . 42 GLY CA 1 1 20 12752 1 1 42 GLY H H -1.167 19.960 17.848 1.00 . A A . 42 GLY H 1 1 20 12753 1 1 42 GLY HA2 H -3.434 19.738 18.180 1.00 . A A . 42 GLY HA2 1 1 20 12754 1 1 42 GLY HA3 H -3.575 19.278 16.490 1.00 . A A . 42 GLY HA3 1 1 20 12755 1 1 42 GLY N N -1.638 19.380 17.214 1.00 . A A . 42 GLY N 1 1 20 12756 1 1 42 GLY O O -3.592 16.786 16.997 1.00 . A A . 42 GLY O 1 1 20 12757 1 1 43 PRO C C -4.805 15.593 19.641 1.00 . A A . 43 PRO C 1 1 20 12758 1 1 43 PRO CA C -3.342 16.023 19.675 1.00 . A A . 43 PRO CA 1 1 20 12759 1 1 43 PRO CB C -2.857 16.154 21.121 1.00 . A A . 43 PRO CB 1 1 20 12760 1 1 43 PRO CD C -2.781 18.345 20.168 1.00 . A A . 43 PRO CD 1 1 20 12761 1 1 43 PRO CG C -3.028 17.597 21.449 1.00 . A A . 43 PRO CG 1 1 20 12762 1 1 43 PRO HA H -2.740 15.291 19.157 1.00 . A A . 43 PRO HA 1 1 20 12763 1 1 43 PRO HB2 H -3.459 15.528 21.764 1.00 . A A . 43 PRO HB2 1 1 20 12764 1 1 43 PRO HB3 H -1.821 15.855 21.185 1.00 . A A . 43 PRO HB3 1 1 20 12765 1 1 43 PRO HD2 H -3.413 19.219 20.113 1.00 . A A . 43 PRO HD2 1 1 20 12766 1 1 43 PRO HD3 H -1.741 18.623 20.088 1.00 . A A . 43 PRO HD3 1 1 20 12767 1 1 43 PRO HG2 H -4.032 17.777 21.800 1.00 . A A . 43 PRO HG2 1 1 20 12768 1 1 43 PRO HG3 H -2.308 17.891 22.198 1.00 . A A . 43 PRO HG3 1 1 20 12769 1 1 43 PRO N N -3.144 17.368 19.127 1.00 . A A . 43 PRO N 1 1 20 12770 1 1 43 PRO O O -5.703 16.391 19.907 1.00 . A A . 43 PRO O 1 1 20 12771 1 1 44 SER C C -7.283 14.426 20.303 1.00 . A A . 44 SER C 1 1 20 12772 1 1 44 SER CA C -6.391 13.790 19.242 1.00 . A A . 44 SER CA 1 1 20 12773 1 1 44 SER CB C -6.371 12.270 19.420 1.00 . A A . 44 SER CB 1 1 20 12774 1 1 44 SER H H -4.278 13.738 19.113 1.00 . A A . 44 SER H 1 1 20 12775 1 1 44 SER HA H -6.789 14.024 18.266 1.00 . A A . 44 SER HA 1 1 20 12776 1 1 44 SER HB2 H -5.845 12.024 20.330 1.00 . A A . 44 SER HB2 1 1 20 12777 1 1 44 SER HB3 H -7.386 11.905 19.480 1.00 . A A . 44 SER HB3 1 1 20 12778 1 1 44 SER HG H -6.378 11.318 17.708 1.00 . A A . 44 SER HG 1 1 20 12779 1 1 44 SER N N -5.036 14.325 19.314 1.00 . A A . 44 SER N 1 1 20 12780 1 1 44 SER O O -6.873 14.604 21.450 1.00 . A A . 44 SER O 1 1 20 12781 1 1 44 SER OG O -5.721 11.638 18.331 1.00 . A A . 44 SER OG 1 1 20 12782 1 1 45 SER C C -10.796 14.655 20.797 1.00 . A A . 45 SER C 1 1 20 12783 1 1 45 SER CA C -9.458 15.387 20.827 1.00 . A A . 45 SER CA 1 1 20 12784 1 1 45 SER CB C -9.661 16.859 20.464 1.00 . A A . 45 SER CB 1 1 20 12785 1 1 45 SER H H -8.776 14.599 18.983 1.00 . A A . 45 SER H 1 1 20 12786 1 1 45 SER HA H -9.048 15.323 21.823 1.00 . A A . 45 SER HA 1 1 20 12787 1 1 45 SER HB2 H -8.761 17.410 20.692 1.00 . A A . 45 SER HB2 1 1 20 12788 1 1 45 SER HB3 H -9.876 16.941 19.409 1.00 . A A . 45 SER HB3 1 1 20 12789 1 1 45 SER HG H -10.959 18.280 20.830 1.00 . A A . 45 SER HG 1 1 20 12790 1 1 45 SER N N -8.507 14.767 19.911 1.00 . A A . 45 SER N 1 1 20 12791 1 1 45 SER O O -11.408 14.414 21.837 1.00 . A A . 45 SER O 1 1 20 12792 1 1 45 SER OG O -10.737 17.420 21.195 1.00 . A A . 45 SER OG 1 1 20 12793 1 1 46 GLY C C -12.694 12.522 20.499 1.00 . A A . 46 GLY C 1 1 20 12794 1 1 46 GLY CA C -12.508 13.603 19.452 1.00 . A A . 46 GLY CA 1 1 20 12795 1 1 46 GLY H H -10.715 14.522 18.801 1.00 . A A . 46 GLY H 1 1 20 12796 1 1 46 GLY HA2 H -13.315 14.316 19.539 1.00 . A A . 46 GLY HA2 1 1 20 12797 1 1 46 GLY HA3 H -12.546 13.149 18.473 1.00 . A A . 46 GLY HA3 1 1 20 12798 1 1 46 GLY N N -11.246 14.304 19.596 1.00 . A A . 46 GLY N 1 1 20 12799 1 1 46 GLY O O -12.078 11.464 20.383 1.00 . A A . 46 GLY O 1 1 20 12800 2 2 1 ZN ZN ZN -0.023 4.561 -0.689 1.00 . B A . 201 ZN ZN 1 1 stop_ save_
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