NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
507911 | 2enh | 10175 | cing | 4-filtered-FRED | STAR | entry | full | 476 |
data_FRED_restraints_with_modified_coordinates_PDB_code_2enh # This FRED archive file contains, for PDB entry <2enh>: # # - 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_2enh _Assembly.Sf_category assembly _Assembly.Entry_ID 1 _Assembly.ID 1 _Assembly.Name 2enh _Assembly.Number_of_components 2 _Assembly.Organic_ligands . _Assembly.Metal_ions . _Assembly.Paramagnetic . _Assembly.Thiol_state "all other bound" _Assembly.Molecular_mass 4802.43 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_28_homolog 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_28_homolog _Entity.Sf_category entity _Entity.Entry_ID 1 _Entity.ID 1 _Entity.Name "Zinc finger protein 28 homolog" _Entity.Type polymer _Entity.Polymer_type polypeptide(L) _Entity.Polymer_seq_one_letter_code GSSGSSGTGEKPYECDVCRKAFSHHASLTQHQRVHSGEKPSGPSSG _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 GLU . 1 1 15 CYS . 1 1 16 ASP . 1 1 17 VAL . 1 1 18 CYS . 1 1 19 ARG . 1 1 20 LYS . 1 1 21 ALA . 1 1 22 PHE . 1 1 23 SER . 1 1 24 HIS . 1 1 25 HIS . 1 1 26 ALA . 1 1 27 SER . 1 1 28 LEU . 1 1 29 THR . 1 1 30 GLN . 1 1 31 HIS . 1 1 32 GLN . 1 1 33 ARG . 1 1 34 VAL . 1 1 35 HIS . 1 1 36 SER . 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 GLU 14 14 1 1 CYS 15 15 1 1 ASP 16 16 1 1 VAL 17 17 1 1 CYS 18 18 1 1 ARG 19 19 1 1 LYS 20 20 1 1 ALA 21 21 1 1 PHE 22 22 1 1 SER 23 23 1 1 HIS 24 24 1 1 HIS 25 25 1 1 ALA 26 26 1 1 SER 27 27 1 1 LEU 28 28 1 1 THR 29 29 1 1 GLN 30 30 1 1 HIS 31 31 1 1 GLN 32 32 1 1 ARG 33 33 1 1 VAL 34 34 1 1 HIS 35 35 1 1 SER 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 . 181 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 . 181 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 . 181 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 . 181 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 . 181 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 . 181 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_4_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 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 HA . 15 CYSS HA 1 2 1 1 2 1 1 16 ASP H . 16 ASP HN 1 2 2 1 1 1 1 16 ASP H . 16 ASP HN 1 2 2 1 2 1 1 16 ASP QB . 16 ASP QB 1 2 3 1 1 1 1 16 ASP H . 16 ASP HN 1 2 3 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 4 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 4 1 2 1 1 20 LYS H . 20 LYS HN 1 2 5 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 5 1 2 1 1 20 LYS H . 20 LYS HN 1 2 6 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 6 1 2 1 1 20 LYS H . 20 LYS HN 1 2 7 1 1 1 1 20 LYS H . 20 LYS HN 1 2 7 1 2 1 1 20 LYS HB3 . 20 LYS HB3 1 2 8 1 1 1 1 11 LYS H . 11 LYS HN 1 2 8 1 2 1 1 11 LYS QD . 11 LYS QD 1 2 9 1 1 1 1 16 ASP H . 16 ASP HN 1 2 9 1 2 1 1 17 VAL H . 17 VAL HN 1 2 10 1 1 1 1 17 VAL H . 17 VAL HN 1 2 10 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 11 1 1 1 1 10 GLU HA . 10 GLU HA 1 2 11 1 2 1 1 11 LYS H . 11 LYS HN 1 2 12 1 1 1 1 11 LYS H . 11 LYS HN 1 2 12 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 13 1 1 1 1 16 ASP QB . 16 ASP QB 1 2 13 1 2 1 1 17 VAL H . 17 VAL HN 1 2 14 1 1 1 1 17 VAL H . 17 VAL HN 1 2 14 1 2 1 1 17 VAL HB . 17 VAL HB 1 2 15 1 1 1 1 17 VAL H . 17 VAL HN 1 2 15 1 2 1 1 17 VAL MG1 . 17 VAL QG1 1 2 16 1 1 1 1 17 VAL H . 17 VAL HN 1 2 16 1 2 1 1 17 VAL MG2 . 17 VAL QG2 1 2 17 1 1 1 1 16 ASP H . 16 ASP HN 1 2 17 1 2 1 1 32 GLN HE22 . 32 GLN HE22 1 2 18 1 1 1 1 16 ASP H . 16 ASP HN 1 2 18 1 2 1 1 32 GLN HE21 . 32 GLN HE21 1 2 19 1 1 1 1 27 SER H . 27 SER HN 1 2 19 1 2 1 1 27 SER HB2 . 27 SER HB2 1 2 20 1 1 1 1 25 HIS HA . 25 HIS HA 1 2 20 1 2 1 1 27 SER H . 27 SER HN 1 2 21 1 1 1 1 26 ALA MB . 26 ALA QB 1 2 21 1 2 1 1 27 SER H . 27 SER HN 1 2 22 1 1 1 1 10 GLU H . 10 GLU HN 1 2 22 1 2 1 1 10 GLU QG . 10 GLU QG 1 2 23 1 1 1 1 29 THR H . 29 THR HN 1 2 23 1 2 1 1 30 GLN H . 30 GLN HN 1 2 24 1 1 1 1 28 LEU H . 28 LEU HN 1 2 24 1 2 1 1 30 GLN H . 30 GLN HN 1 2 25 1 1 1 1 26 ALA HA . 26 ALA HA 1 2 25 1 2 1 1 30 GLN H . 30 GLN HN 1 2 26 1 1 1 1 30 GLN H . 30 GLN HN 1 2 26 1 2 1 1 30 GLN HG2 . 30 GLN HG2 1 2 27 1 1 1 1 30 GLN H . 30 GLN HN 1 2 27 1 2 1 1 30 GLN HB2 . 30 GLN HB2 1 2 28 1 1 1 1 30 GLN H . 30 GLN HN 1 2 28 1 2 1 1 30 GLN HB3 . 30 GLN HB3 1 2 29 1 1 1 1 29 THR MG . 29 THR QG2 1 2 29 1 2 1 1 30 GLN H . 30 GLN HN 1 2 30 1 1 1 1 26 ALA MB . 26 ALA QB 1 2 30 1 2 1 1 30 GLN H . 30 GLN HN 1 2 31 1 1 1 1 31 HIS H . 31 HIS HN 1 2 31 1 2 1 1 32 GLN H . 32 GLN HN 1 2 32 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 32 1 2 1 1 31 HIS H . 31 HIS HN 1 2 33 1 1 1 1 31 HIS H . 31 HIS HN 1 2 33 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 34 1 1 1 1 31 HIS H . 31 HIS HN 1 2 34 1 2 1 1 31 HIS HB2 . 31 HIS HB2 1 2 35 1 1 1 1 31 HIS H . 31 HIS HN 1 2 35 1 2 1 1 31 HIS HB3 . 31 HIS HB3 1 2 36 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 36 1 2 1 1 22 PHE QD . 22 PHE QD 1 2 37 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 37 1 2 1 1 20 LYS HB3 . 20 LYS HB3 1 2 38 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 38 1 2 1 1 19 ARG H . 19 ARG HN 1 2 39 1 1 1 1 13 TYR H . 13 TYR HN 1 2 39 1 2 1 1 13 TYR QD . 13 TYR QD 1 2 40 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 40 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 41 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 41 1 2 1 1 21 ALA HA . 21 ALA HA 1 2 42 1 1 1 1 14 GLU HA . 14 GLU HA 1 2 42 1 2 1 1 15 CYS H . 15 CYSS HN 1 2 43 1 1 1 1 12 PRO HA . 12 PRO HA 1 2 43 1 2 1 1 13 TYR H . 13 TYR HN 1 2 44 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 44 1 2 1 1 19 ARG HA . 19 ARG HA 1 2 45 1 1 1 1 12 PRO QD . 12 PRO QD 1 2 45 1 2 1 1 13 TYR H . 13 TYR HN 1 2 46 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 46 1 2 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 47 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 47 1 2 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 48 1 1 1 1 13 TYR H . 13 TYR HN 1 2 48 1 2 1 1 13 TYR HB2 . 13 TYR HB2 1 2 49 1 1 1 1 14 GLU QG . 14 GLU QG 1 2 49 1 2 1 1 15 CYS H . 15 CYSS HN 1 2 50 1 1 1 1 14 GLU QB . 14 GLU QB 1 2 50 1 2 1 1 15 CYS H . 15 CYSS HN 1 2 51 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 51 1 2 1 1 20 LYS HB2 . 20 LYS HB2 1 2 52 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 52 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 53 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 53 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 54 1 1 1 1 32 GLN H . 32 GLN HN 1 2 54 1 2 1 1 33 ARG H . 33 ARG HN 1 2 55 1 1 1 1 31 HIS H . 31 HIS HN 1 2 55 1 2 1 1 33 ARG H . 33 ARG HN 1 2 56 1 1 1 1 30 GLN HA . 30 GLN HA 1 2 56 1 2 1 1 33 ARG H . 33 ARG HN 1 2 57 1 1 1 1 33 ARG H . 33 ARG HN 1 2 57 1 2 1 1 33 ARG QD . 33 ARG QD 1 2 58 1 1 1 1 32 GLN HB2 . 32 GLN HB2 1 2 58 1 2 1 1 33 ARG H . 33 ARG HN 1 2 59 1 1 1 1 33 ARG H . 33 ARG HN 1 2 59 1 2 1 1 33 ARG HG3 . 33 ARG HG3 1 2 60 1 1 1 1 33 ARG H . 33 ARG HN 1 2 60 1 2 1 1 34 VAL MG2 . 34 VAL QG2 1 2 61 1 1 1 1 32 GLN HG2 . 32 GLN HG2 1 2 61 1 2 1 1 33 ARG H . 33 ARG HN 1 2 62 1 1 1 1 32 GLN HG3 . 32 GLN HG3 1 2 62 1 2 1 1 33 ARG H . 33 ARG HN 1 2 63 1 1 1 1 17 VAL H . 17 VAL HN 1 2 63 1 2 1 1 19 ARG H . 19 ARG HN 1 2 64 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 64 1 2 1 1 19 ARG H . 19 ARG HN 1 2 65 1 1 1 1 19 ARG H . 19 ARG HN 1 2 65 1 2 1 1 19 ARG HA . 19 ARG HA 1 2 66 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 66 1 2 1 1 19 ARG H . 19 ARG HN 1 2 67 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 67 1 2 1 1 19 ARG H . 19 ARG HN 1 2 68 1 1 1 1 19 ARG H . 19 ARG HN 1 2 68 1 2 1 1 19 ARG HG2 . 19 ARG HG2 1 2 69 1 1 1 1 19 ARG H . 19 ARG HN 1 2 69 1 2 1 1 19 ARG HG3 . 19 ARG HG3 1 2 70 1 1 1 1 17 VAL HB . 17 VAL HB 1 2 70 1 2 1 1 19 ARG H . 19 ARG HN 1 2 71 1 1 1 1 13 TYR H . 13 TYR HN 1 2 71 1 2 1 1 22 PHE H . 22 PHE HN 1 2 72 1 1 1 1 22 PHE H . 22 PHE HN 1 2 72 1 2 1 1 22 PHE QD . 22 PHE QD 1 2 73 1 1 1 1 22 PHE H . 22 PHE HN 1 2 73 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 74 1 1 1 1 21 ALA HA . 21 ALA HA 1 2 74 1 2 1 1 22 PHE H . 22 PHE HN 1 2 75 1 1 1 1 14 GLU HA . 14 GLU HA 1 2 75 1 2 1 1 22 PHE H . 22 PHE HN 1 2 76 1 1 1 1 22 PHE H . 22 PHE HN 1 2 76 1 2 1 1 22 PHE HB3 . 22 PHE HB3 1 2 77 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 77 1 2 1 1 22 PHE H . 22 PHE HN 1 2 78 1 1 1 1 22 PHE H . 22 PHE HN 1 2 78 1 2 1 1 22 PHE HB2 . 22 PHE HB2 1 2 79 1 1 1 1 21 ALA MB . 21 ALA QB 1 2 79 1 2 1 1 22 PHE H . 22 PHE HN 1 2 80 1 1 1 1 22 PHE H . 22 PHE HN 1 2 80 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 81 1 1 1 1 22 PHE H . 22 PHE HN 1 2 81 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 82 1 1 1 1 24 HIS H . 24 HIS HN 1 2 82 1 2 1 1 27 SER H . 27 SER HN 1 2 83 1 1 1 1 24 HIS H . 24 HIS HN 1 2 83 1 2 1 1 27 SER HB2 . 27 SER HB2 1 2 84 1 1 1 1 24 HIS H . 24 HIS HN 1 2 84 1 2 1 1 27 SER HB3 . 27 SER HB3 1 2 85 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 85 1 2 1 1 24 HIS H . 24 HIS HN 1 2 86 1 1 1 1 24 HIS H . 24 HIS HN 1 2 86 1 2 1 1 24 HIS HB2 . 24 HIS HB2 1 2 87 1 1 1 1 24 HIS H . 24 HIS HN 1 2 87 1 2 1 1 24 HIS HB3 . 24 HIS HB3 1 2 88 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 88 1 2 1 1 24 HIS H . 24 HIS HN 1 2 89 1 1 1 1 34 VAL H . 34 VAL HN 1 2 89 1 2 1 1 35 HIS H . 35 HIS HN 1 2 90 1 1 1 1 35 HIS H . 35 HIS HN 1 2 90 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 91 1 1 1 1 32 GLN HA . 32 GLN HA 1 2 91 1 2 1 1 35 HIS H . 35 HIS HN 1 2 92 1 1 1 1 35 HIS H . 35 HIS HN 1 2 92 1 2 1 1 35 HIS HB2 . 35 HIS HB2 1 2 93 1 1 1 1 35 HIS H . 35 HIS HN 1 2 93 1 2 1 1 35 HIS HB3 . 35 HIS HB3 1 2 94 1 1 1 1 34 VAL HB . 34 VAL HB 1 2 94 1 2 1 1 35 HIS H . 35 HIS HN 1 2 95 1 1 1 1 34 VAL MG1 . 34 VAL QG1 1 2 95 1 2 1 1 35 HIS H . 35 HIS HN 1 2 96 1 1 1 1 34 VAL MG2 . 34 VAL QG2 1 2 96 1 2 1 1 35 HIS H . 35 HIS HN 1 2 97 1 1 1 1 18 CYS H . 18 CYSS HN 1 2 97 1 2 1 1 19 ARG HA . 19 ARG HA 1 2 98 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 98 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 99 1 1 1 1 17 VAL HB . 17 VAL HB 1 2 99 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 100 1 1 1 1 33 ARG H . 33 ARG HN 1 2 100 1 2 1 1 34 VAL H . 34 VAL HN 1 2 101 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 101 1 2 1 1 21 ALA H . 21 ALA HN 1 2 102 1 1 1 1 32 GLN HA . 32 GLN HA 1 2 102 1 2 1 1 34 VAL H . 34 VAL HN 1 2 103 1 1 1 1 33 ARG HB2 . 33 ARG HB2 1 2 103 1 2 1 1 34 VAL H . 34 VAL HN 1 2 104 1 1 1 1 33 ARG HB3 . 33 ARG HB3 1 2 104 1 2 1 1 34 VAL H . 34 VAL HN 1 2 105 1 1 1 1 20 LYS HG3 . 20 LYS HG3 1 2 105 1 2 1 1 21 ALA H . 21 ALA HN 1 2 106 1 1 1 1 21 ALA H . 21 ALA HN 1 2 106 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 107 1 1 1 1 20 LYS HG2 . 20 LYS HG2 1 2 107 1 2 1 1 21 ALA H . 21 ALA HN 1 2 108 1 1 1 1 34 VAL H . 34 VAL HN 1 2 108 1 2 1 1 34 VAL MG1 . 34 VAL QG1 1 2 109 1 1 1 1 34 VAL H . 34 VAL HN 1 2 109 1 2 1 1 34 VAL MG2 . 34 VAL QG2 1 2 110 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 110 1 2 1 1 28 LEU H . 28 LEU HN 1 2 111 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 111 1 2 1 1 28 LEU H . 28 LEU HN 1 2 112 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 112 1 2 1 1 28 LEU H . 28 LEU HN 1 2 113 1 1 1 1 28 LEU H . 28 LEU HN 1 2 113 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 2 114 1 1 1 1 26 ALA MB . 26 ALA QB 1 2 114 1 2 1 1 28 LEU H . 28 LEU HN 1 2 115 1 1 1 1 28 LEU H . 28 LEU HN 1 2 115 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 116 1 1 1 1 28 LEU H . 28 LEU HN 1 2 116 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 117 1 1 1 1 28 LEU H . 28 LEU HN 1 2 117 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 118 1 1 1 1 14 GLU H . 14 GLU HN 1 2 118 1 2 1 1 15 CYS H . 15 CYSS HN 1 2 119 1 1 1 1 13 TYR H . 13 TYR HN 1 2 119 1 2 1 1 14 GLU H . 14 GLU HN 1 2 120 1 1 1 1 13 TYR HA . 13 TYR HA 1 2 120 1 2 1 1 14 GLU H . 14 GLU HN 1 2 121 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 121 1 2 1 1 14 GLU H . 14 GLU HN 1 2 122 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 122 1 2 1 1 14 GLU H . 14 GLU HN 1 2 123 1 1 1 1 14 GLU H . 14 GLU HN 1 2 123 1 2 1 1 14 GLU QG . 14 GLU QG 1 2 124 1 1 1 1 14 GLU H . 14 GLU HN 1 2 124 1 2 1 1 14 GLU QB . 14 GLU QB 1 2 125 1 1 1 1 14 GLU H . 14 GLU HN 1 2 125 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 126 1 1 1 1 38 GLU HA . 38 GLU HA 1 2 126 1 2 1 1 39 LYS H . 39 LYS HN 1 2 127 1 1 1 1 31 HIS HD2 . 31 HIS HD2 1 2 127 1 2 1 1 32 GLN H . 32 GLN HN 1 2 128 1 1 1 1 32 GLN H . 32 GLN HN 1 2 128 1 2 1 1 32 GLN HG2 . 32 GLN HG2 1 2 129 1 1 1 1 32 GLN H . 32 GLN HN 1 2 129 1 2 1 1 32 GLN HG3 . 32 GLN HG3 1 2 130 1 1 1 1 32 GLN H . 32 GLN HN 1 2 130 1 2 1 1 32 GLN HB2 . 32 GLN HB2 1 2 131 1 1 1 1 35 HIS H . 35 HIS HN 1 2 131 1 2 1 1 36 SER H . 36 SER HN 1 2 132 1 1 1 1 28 LEU H . 28 LEU HN 1 2 132 1 2 1 1 29 THR H . 29 THR HN 1 2 133 1 1 1 1 29 THR H . 29 THR HN 1 2 133 1 2 1 1 29 THR HB . 29 THR HB 1 2 134 1 1 1 1 28 LEU HB3 . 28 LEU HB3 1 2 134 1 2 1 1 29 THR H . 29 THR HN 1 2 135 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 135 1 2 1 1 29 THR H . 29 THR HN 1 2 136 1 1 1 1 28 LEU HB2 . 28 LEU HB2 1 2 136 1 2 1 1 29 THR H . 29 THR HN 1 2 137 1 1 1 1 28 LEU MD2 . 28 LEU QD2 1 2 137 1 2 1 1 29 THR H . 29 THR HN 1 2 138 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 138 1 2 1 1 29 THR H . 29 THR HN 1 2 139 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 139 1 2 1 1 32 GLN H . 32 GLN HN 1 2 140 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 140 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 141 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 141 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 142 1 1 1 1 17 VAL HB . 17 VAL HB 1 2 142 1 2 1 1 35 HIS HE1 . 35 HIS HE1 1 2 143 1 1 1 1 34 VAL MG1 . 34 VAL QG1 1 2 143 1 2 1 1 35 HIS HE1 . 35 HIS HE1 1 2 144 1 1 1 1 34 VAL MG2 . 34 VAL QG2 1 2 144 1 2 1 1 35 HIS HE1 . 35 HIS HE1 1 2 145 1 1 1 1 14 GLU HA . 14 GLU HA 1 2 145 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 146 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 146 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 147 1 1 1 1 11 LYS QE . 11 LYS QE 1 2 147 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 148 1 1 1 1 14 GLU QG . 14 GLU QG 1 2 148 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 149 1 1 1 1 14 GLU QB . 14 GLU QB 1 2 149 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 150 1 1 1 1 29 THR H . 29 THR HN 1 2 150 1 2 1 1 29 THR MG . 29 THR QG2 1 2 151 1 1 1 1 26 ALA HA . 26 ALA HA 1 2 151 1 2 1 1 29 THR MG . 29 THR QG2 1 2 152 1 1 1 1 31 HIS HE1 . 31 HIS HE1 1 2 152 1 2 1 1 34 VAL MG1 . 34 VAL QG1 1 2 153 1 1 1 1 17 VAL MG1 . 17 VAL QG1 1 2 153 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 154 1 1 1 1 17 VAL MG1 . 17 VAL QG1 1 2 154 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 155 1 1 1 1 17 VAL MG1 . 17 VAL QG1 1 2 155 1 2 1 1 35 HIS HB2 . 35 HIS HB2 1 2 156 1 1 1 1 29 THR HB . 29 THR HB 1 2 156 1 2 1 1 30 GLN H . 30 GLN HN 1 2 157 1 1 1 1 26 ALA MB . 26 ALA QB 1 2 157 1 2 1 1 29 THR HB . 29 THR HB 1 2 158 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 158 1 2 1 1 29 THR HB . 29 THR HB 1 2 159 1 1 1 1 17 VAL MG2 . 17 VAL QG2 1 2 159 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 160 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 160 1 2 1 1 22 PHE HB2 . 22 PHE HB2 1 2 161 1 1 1 1 21 ALA HA . 21 ALA HA 1 2 161 1 2 1 1 22 PHE HB2 . 22 PHE HB2 1 2 162 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 162 1 2 1 1 27 SER HB2 . 27 SER HB2 1 2 163 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 163 1 2 1 1 27 SER HB2 . 27 SER HB2 1 2 164 1 1 1 1 17 VAL MG2 . 17 VAL QG2 1 2 164 1 2 1 1 35 HIS HB2 . 35 HIS HB2 1 2 165 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 165 1 2 1 1 22 PHE HB3 . 22 PHE HB3 1 2 166 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 166 1 2 1 1 22 PHE HB3 . 22 PHE HB3 1 2 167 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 167 1 2 1 1 22 PHE HB2 . 22 PHE HB2 1 2 168 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 168 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 2 169 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 169 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 170 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 170 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 171 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 171 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 172 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 172 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 173 1 1 1 1 33 ARG HB3 . 33 ARG HB3 1 2 173 1 2 1 1 33 ARG QD . 33 ARG QD 1 2 174 1 1 1 1 33 ARG H . 33 ARG HN 1 2 174 1 2 1 1 34 VAL MG1 . 34 VAL QG1 1 2 175 1 1 1 1 31 HIS HE1 . 31 HIS HE1 1 2 175 1 2 1 1 34 VAL MG2 . 34 VAL QG2 1 2 176 1 1 1 1 19 ARG H . 19 ARG HN 1 2 176 1 2 1 1 19 ARG HD3 . 19 ARG HD3 1 2 177 1 1 1 1 19 ARG H . 19 ARG HN 1 2 177 1 2 1 1 19 ARG HD2 . 19 ARG HD2 1 2 178 1 1 1 1 16 ASP HA . 16 ASP HA 1 2 178 1 2 1 1 19 ARG HD3 . 19 ARG HD3 1 2 179 1 1 1 1 16 ASP HA . 16 ASP HA 1 2 179 1 2 1 1 19 ARG HD2 . 19 ARG HD2 1 2 180 1 1 1 1 19 ARG HA . 19 ARG HA 1 2 180 1 2 1 1 19 ARG HD3 . 19 ARG HD3 1 2 181 1 1 1 1 19 ARG HA . 19 ARG HA 1 2 181 1 2 1 1 19 ARG HD2 . 19 ARG HD2 1 2 182 1 1 1 1 29 THR HA . 29 THR HA 1 2 182 1 2 1 1 32 GLN HG2 . 32 GLN HG2 1 2 183 1 1 1 1 29 THR HA . 29 THR HA 1 2 183 1 2 1 1 32 GLN HG3 . 32 GLN HG3 1 2 184 1 1 1 1 29 THR HA . 29 THR HA 1 2 184 1 2 1 1 32 GLN HB2 . 32 GLN HB2 1 2 185 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 185 1 2 1 1 29 THR HA . 29 THR HA 1 2 186 1 1 1 1 29 THR HA . 29 THR HA 1 2 186 1 2 1 1 29 THR MG . 29 THR QG2 1 2 187 1 1 1 1 11 LYS HA . 11 LYS HA 1 2 187 1 2 1 1 11 LYS QE . 11 LYS QE 1 2 188 1 1 1 1 24 HIS HE1 . 24 HIS HE1 1 2 188 1 2 1 1 26 ALA MB . 26 ALA QB 1 2 189 1 1 1 1 25 HIS HA . 25 HIS HA 1 2 189 1 2 1 1 26 ALA MB . 26 ALA QB 1 2 190 1 1 1 1 24 HIS HB3 . 24 HIS HB3 1 2 190 1 2 1 1 26 ALA MB . 26 ALA QB 1 2 191 1 1 1 1 17 VAL HA . 17 VAL HA 1 2 191 1 2 1 1 17 VAL MG1 . 17 VAL QG1 1 2 192 1 1 1 1 17 VAL HA . 17 VAL HA 1 2 192 1 2 1 1 17 VAL MG2 . 17 VAL QG2 1 2 193 1 1 1 1 34 VAL HA . 34 VAL HA 1 2 193 1 2 1 1 34 VAL MG1 . 34 VAL QG1 1 2 194 1 1 1 1 34 VAL HA . 34 VAL HA 1 2 194 1 2 1 1 34 VAL MG2 . 34 VAL QG2 1 2 195 1 1 1 1 28 LEU HB3 . 28 LEU HB3 1 2 195 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 196 1 1 1 1 12 PRO HA . 12 PRO HA 1 2 196 1 2 1 1 13 TYR QD . 13 TYR QD 1 2 197 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 197 1 2 1 1 27 SER HB2 . 27 SER HB2 1 2 198 1 1 1 1 27 SER H . 27 SER HN 1 2 198 1 2 1 1 27 SER HB3 . 27 SER HB3 1 2 199 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 199 1 2 1 1 27 SER HB3 . 27 SER HB3 1 2 200 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 200 1 2 1 1 27 SER HB3 . 27 SER HB3 1 2 201 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 201 1 2 1 1 14 GLU H . 14 GLU HN 1 2 202 1 1 1 1 13 TYR H . 13 TYR HN 1 2 202 1 2 1 1 13 TYR HB3 . 13 TYR HB3 1 2 203 1 1 1 1 13 TYR HA . 13 TYR HA 1 2 203 1 2 1 1 13 TYR QD . 13 TYR QD 1 2 204 1 1 1 1 12 PRO QD . 12 PRO QD 1 2 204 1 2 1 1 13 TYR QD . 13 TYR QD 1 2 205 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 205 1 2 1 1 22 PHE HB2 . 22 PHE HB2 1 2 206 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 206 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 2 207 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 207 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 2 208 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 208 1 2 1 1 28 LEU HG . 28 LEU HG 1 2 209 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 209 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 210 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 210 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 211 1 1 1 1 13 TYR HB3 . 13 TYR HB3 1 2 211 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 212 1 1 1 1 13 TYR HB2 . 13 TYR HB2 1 2 212 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 213 1 1 1 1 8 THR HA . 8 THR HA 1 2 213 1 2 1 1 8 THR MG . 8 THR QG2 1 2 214 1 1 1 1 21 ALA HA . 21 ALA HA 1 2 214 1 2 1 1 22 PHE QD . 22 PHE QD 1 2 215 1 1 1 1 14 GLU HA . 14 GLU HA 1 2 215 1 2 1 1 22 PHE QD . 22 PHE QD 1 2 216 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 216 1 2 1 1 27 SER HB3 . 27 SER HB3 1 2 217 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 217 1 2 1 1 22 PHE QD . 22 PHE QD 1 2 218 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 218 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 219 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 219 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 220 1 1 1 1 27 SER HA . 27 SER HA 1 2 220 1 2 1 1 30 GLN H . 30 GLN HN 1 2 221 1 1 1 1 27 SER HA . 27 SER HA 1 2 221 1 2 1 1 31 HIS H . 31 HIS HN 1 2 222 1 1 1 1 25 HIS HA . 25 HIS HA 1 2 222 1 2 1 1 29 THR H . 29 THR HN 1 2 223 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 223 1 2 1 1 25 HIS HA . 25 HIS HA 1 2 224 1 1 1 1 25 HIS HA . 25 HIS HA 1 2 224 1 2 1 1 28 LEU H . 28 LEU HN 1 2 225 1 1 1 1 14 GLU QG . 14 GLU QG 1 2 225 1 2 1 1 21 ALA HA . 21 ALA HA 1 2 226 1 1 1 1 14 GLU QG . 14 GLU QG 1 2 226 1 2 1 1 19 ARG HA . 19 ARG HA 1 2 227 1 1 1 1 25 HIS HA . 25 HIS HA 1 2 227 1 2 1 1 28 LEU HB3 . 28 LEU HB3 1 2 228 1 1 1 1 25 HIS HA . 25 HIS HA 1 2 228 1 2 1 1 28 LEU HB2 . 28 LEU HB2 1 2 229 1 1 1 1 25 HIS HA . 25 HIS HA 1 2 229 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 230 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 230 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 231 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 231 1 2 1 1 31 HIS HB2 . 31 HIS HB2 1 2 232 1 1 1 1 20 LYS HB3 . 20 LYS HB3 1 2 232 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 233 1 1 1 1 20 LYS HB2 . 20 LYS HB2 1 2 233 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 234 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 234 1 2 1 1 17 VAL H . 17 VAL HN 1 2 235 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 235 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 236 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 236 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 237 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 237 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 238 1 1 1 1 31 HIS HD2 . 31 HIS HD2 1 2 238 1 2 1 1 32 GLN HA . 32 GLN HA 1 2 239 1 1 1 1 32 GLN HA . 32 GLN HA 1 2 239 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 240 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 240 1 2 1 1 34 VAL H . 34 VAL HN 1 2 241 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 241 1 2 1 1 33 ARG H . 33 ARG HN 1 2 242 1 1 1 1 31 HIS HD2 . 31 HIS HD2 1 2 242 1 2 1 1 32 GLN HG2 . 32 GLN HG2 1 2 243 1 1 1 1 31 HIS HD2 . 31 HIS HD2 1 2 243 1 2 1 1 32 GLN HG3 . 32 GLN HG3 1 2 244 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 244 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 245 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 245 1 2 1 1 33 ARG HB2 . 33 ARG HB2 1 2 246 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 246 1 2 1 1 32 GLN HG3 . 32 GLN HG3 1 2 247 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 247 1 2 1 1 34 VAL MG1 . 34 VAL QG1 1 2 248 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 248 1 2 1 1 34 VAL MG2 . 34 VAL QG2 1 2 249 1 1 1 1 30 GLN HA . 30 GLN HA 1 2 249 1 2 1 1 32 GLN H . 32 GLN HN 1 2 250 1 1 1 1 30 GLN HA . 30 GLN HA 1 2 250 1 2 1 1 33 ARG QD . 33 ARG QD 1 2 251 1 1 1 1 30 GLN HA . 30 GLN HA 1 2 251 1 2 1 1 30 GLN HG2 . 30 GLN HG2 1 2 252 1 1 1 1 29 THR MG . 29 THR QG2 1 2 252 1 2 1 1 30 GLN HA . 30 GLN HA 1 2 253 1 1 1 1 33 ARG HA . 33 ARG HA 1 2 253 1 2 1 1 33 ARG QD . 33 ARG QD 1 2 254 1 1 1 1 33 ARG HA . 33 ARG HA 1 2 254 1 2 1 1 33 ARG HG3 . 33 ARG HG3 1 2 255 1 1 1 1 28 LEU HA . 28 LEU HA 1 2 255 1 2 1 1 32 GLN H . 32 GLN HN 1 2 256 1 1 1 1 28 LEU HA . 28 LEU HA 1 2 256 1 2 1 1 31 HIS H . 31 HIS HN 1 2 257 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 257 1 2 1 1 28 LEU HA . 28 LEU HA 1 2 258 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 258 1 2 1 1 28 LEU HA . 28 LEU HA 1 2 259 1 1 1 1 28 LEU HA . 28 LEU HA 1 2 259 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 260 1 1 1 1 28 LEU HA . 28 LEU HA 1 2 260 1 2 1 1 28 LEU HG . 28 LEU HG 1 2 261 1 1 1 1 28 LEU HA . 28 LEU HA 1 2 261 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 262 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 262 1 2 1 1 19 ARG HA . 19 ARG HA 1 2 263 1 1 1 1 22 PHE HZ . 22 PHE HZ 1 2 263 1 2 1 1 31 HIS HB2 . 31 HIS HB2 1 2 264 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 264 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 265 1 1 1 1 20 LYS HB3 . 20 LYS HB3 1 2 265 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 266 1 1 1 1 20 LYS HB2 . 20 LYS HB2 1 2 266 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 267 1 1 1 1 20 LYS H . 20 LYS HN 1 2 267 1 2 1 1 20 LYS HB2 . 20 LYS HB2 1 2 268 1 1 1 1 30 GLN HG2 . 30 GLN HG2 1 2 268 1 2 1 1 31 HIS H . 31 HIS HN 1 2 269 1 1 1 1 30 GLN H . 30 GLN HN 1 2 269 1 2 1 1 30 GLN HG3 . 30 GLN HG3 1 2 270 1 1 1 1 30 GLN HG3 . 30 GLN HG3 1 2 270 1 2 1 1 31 HIS H . 31 HIS HN 1 2 271 1 1 1 1 30 GLN HA . 30 GLN HA 1 2 271 1 2 1 1 30 GLN HG3 . 30 GLN HG3 1 2 272 1 1 1 1 24 HIS HB2 . 24 HIS HB2 1 2 272 1 2 1 1 26 ALA MB . 26 ALA QB 1 2 273 1 1 1 1 14 GLU QB . 14 GLU QB 1 2 273 1 2 1 1 21 ALA HA . 21 ALA HA 1 2 274 1 1 1 1 14 GLU QB . 14 GLU QB 1 2 274 1 2 1 1 19 ARG HA . 19 ARG HA 1 2 275 1 1 1 1 18 CYS H . 18 CYSS HN 1 2 275 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 276 1 1 1 1 11 LYS HB2 . 11 LYS HB2 1 2 276 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 277 1 1 1 1 32 GLN HG2 . 32 GLN HG2 1 2 277 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 278 1 1 1 1 32 GLN HG3 . 32 GLN HG3 1 2 278 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 279 1 1 1 1 17 VAL HB . 17 VAL HB 1 2 279 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 280 1 1 1 1 17 VAL MG2 . 17 VAL QG2 1 2 280 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 281 1 1 1 1 16 ASP HA . 16 ASP HA 1 2 281 1 2 1 1 19 ARG H . 19 ARG HN 1 2 282 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 282 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 283 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 283 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 284 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 284 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 285 1 1 1 1 18 CYS H . 18 CYSS HN 1 2 285 1 2 1 1 18 CYS HB2 . 18 CYSS HB2 1 2 286 1 1 1 1 18 CYS H . 18 CYSS HN 1 2 286 1 2 1 1 18 CYS HB3 . 18 CYSS HB3 1 2 287 1 1 1 1 26 ALA HA . 26 ALA HA 1 2 287 1 2 1 1 29 THR H . 29 THR HN 1 2 288 1 1 1 1 34 VAL H . 34 VAL HN 1 2 288 1 2 1 1 34 VAL HB . 34 VAL HB 1 2 289 1 1 1 1 13 TYR QE . 13 TYR QE 1 2 289 1 2 1 1 25 HIS HB2 . 25 HIS HB2 1 2 290 1 1 1 1 13 TYR QE . 13 TYR QE 1 2 290 1 2 1 1 25 HIS HB3 . 25 HIS HB3 1 2 291 1 1 1 1 11 LYS HA . 11 LYS HA 1 2 291 1 2 1 1 11 LYS QD . 11 LYS QD 1 2 292 1 1 1 1 11 LYS HA . 11 LYS HA 1 2 292 1 2 1 1 11 LYS HG2 . 11 LYS HG2 1 2 293 1 1 1 1 33 ARG H . 33 ARG HN 1 2 293 1 2 1 1 33 ARG HB2 . 33 ARG HB2 1 2 294 1 1 1 1 33 ARG H . 33 ARG HN 1 2 294 1 2 1 1 33 ARG HB3 . 33 ARG HB3 1 2 295 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 295 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 296 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 296 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 297 1 1 1 1 14 GLU HA . 14 GLU HA 1 2 297 1 2 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 298 1 1 1 1 14 GLU HA . 14 GLU HA 1 2 298 1 2 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 299 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 299 1 2 1 1 20 LYS HB3 . 20 LYS HB3 1 2 300 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 300 1 2 1 1 20 LYS HB2 . 20 LYS HB2 1 2 301 1 1 1 1 15 CYS HB3 . 15 CYSS HB3 1 2 301 1 2 1 1 28 LEU MD1 . 28 LEU QD1 1 2 302 1 1 1 1 20 LYS HD2 . 20 LYS HD2 1 2 302 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 303 1 1 1 1 11 LYS QD . 11 LYS QD 1 2 303 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 304 1 1 1 1 20 LYS HD2 . 20 LYS HD2 1 2 304 1 2 1 1 21 ALA H . 21 ALA HN 1 2 305 1 1 1 1 20 LYS HD3 . 20 LYS HD3 1 2 305 1 2 1 1 21 ALA H . 21 ALA HN 1 2 306 1 1 1 1 20 LYS HD3 . 20 LYS HD3 1 2 306 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 307 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 307 1 2 1 1 20 LYS HD2 . 20 LYS HD2 1 2 308 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 308 1 2 1 1 20 LYS HD3 . 20 LYS HD3 1 2 309 1 1 1 1 32 GLN H . 32 GLN HN 1 2 309 1 2 1 1 32 GLN HB3 . 32 GLN HB3 1 2 310 1 1 1 1 31 HIS H . 31 HIS HN 1 2 310 1 2 1 1 32 GLN HB2 . 32 GLN HB2 1 2 311 1 1 1 1 32 GLN HB3 . 32 GLN HB3 1 2 311 1 2 1 1 33 ARG H . 33 ARG HN 1 2 312 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 312 1 2 1 1 31 HIS HB3 . 31 HIS HB3 1 2 313 1 1 1 1 32 GLN HB3 . 32 GLN HB3 1 2 313 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 314 1 1 1 1 22 PHE HZ . 22 PHE HZ 1 2 314 1 2 1 1 31 HIS HB3 . 31 HIS HB3 1 2 315 1 1 1 1 29 THR HA . 29 THR HA 1 2 315 1 2 1 1 32 GLN HB3 . 32 GLN HB3 1 2 316 1 1 1 1 17 VAL MG1 . 17 VAL QG1 1 2 316 1 2 1 1 35 HIS HB3 . 35 HIS HB3 1 2 317 1 1 1 1 33 ARG H . 33 ARG HN 1 2 317 1 2 1 1 33 ARG HG2 . 33 ARG HG2 1 2 318 1 1 1 1 28 LEU H . 28 LEU HN 1 2 318 1 2 1 1 28 LEU HG . 28 LEU HG 1 2 319 1 1 1 1 33 ARG HA . 33 ARG HA 1 2 319 1 2 1 1 33 ARG HG2 . 33 ARG HG2 1 2 320 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 320 1 2 1 1 32 GLN HG2 . 32 GLN HG2 1 2 321 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 321 1 2 1 1 32 GLN HG3 . 32 GLN HG3 1 2 322 1 1 1 1 39 LYS HA . 39 LYS HA 1 2 322 1 2 1 1 40 PRO HD2 . 40 PRO HD2 1 2 323 1 1 1 1 39 LYS HA . 39 LYS HA 1 2 323 1 2 1 1 40 PRO HD3 . 40 PRO HD3 1 2 324 1 1 1 1 14 GLU HA . 14 GLU HA 1 2 324 1 2 1 1 21 ALA HA . 21 ALA HA 1 2 325 1 1 1 1 11 LYS HA . 11 LYS HA 1 2 325 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 326 1 1 1 1 11 LYS HB3 . 11 LYS HB3 1 2 326 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 327 1 1 1 1 11 LYS HG3 . 11 LYS HG3 1 2 327 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 328 1 1 1 1 11 LYS HG2 . 11 LYS HG2 1 2 328 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 329 1 1 1 1 13 TYR QD . 13 TYR QD 1 2 329 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 330 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 330 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 331 1 1 1 1 13 TYR HA . 13 TYR HA 1 2 331 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 332 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 332 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 333 1 1 1 1 28 LEU HA . 28 LEU HA 1 2 333 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 334 1 1 1 1 11 LYS HA . 11 LYS HA 1 2 334 1 2 1 1 11 LYS HG3 . 11 LYS HG3 1 2 335 1 1 1 1 13 TYR QE . 13 TYR QE 1 2 335 1 2 1 1 25 HIS HA . 25 HIS HA 1 2 336 1 1 1 1 25 HIS HA . 25 HIS HA 1 2 336 1 2 1 1 25 HIS HD2 . 25 HIS HD2 1 2 337 1 1 1 1 13 TYR QE . 13 TYR QE 1 2 337 1 2 1 1 28 LEU MD2 . 28 LEU QD2 1 2 338 1 1 1 1 13 TYR H . 13 TYR HN 1 2 338 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 339 1 1 1 1 13 TYR HA . 13 TYR HA 1 2 339 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 340 1 1 1 1 12 PRO QD . 12 PRO QD 1 2 340 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 341 1 1 1 1 12 PRO HG3 . 12 PRO HG3 1 2 341 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 342 1 1 1 1 12 PRO HG2 . 12 PRO HG2 1 2 342 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 343 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 343 1 2 1 1 32 GLN HG2 . 32 GLN HG2 1 2 344 1 1 1 1 10 GLU H . 10 GLU HN 1 2 344 1 2 1 1 10 GLU QB . 10 GLU QB 1 2 345 1 1 1 1 11 LYS H . 11 LYS HN 1 2 345 1 2 1 1 11 LYS QB . 11 LYS QB 1 2 346 1 1 1 1 11 LYS H . 11 LYS HN 1 2 346 1 2 1 1 11 LYS QG . 11 LYS QG 1 2 347 1 1 1 1 11 LYS HA . 11 LYS HA 1 2 347 1 2 1 1 11 LYS QG . 11 LYS QG 1 2 348 1 1 1 1 11 LYS QB . 11 LYS QB 1 2 348 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 349 1 1 1 1 11 LYS QB . 11 LYS QB 1 2 349 1 2 1 1 13 TYR H . 13 TYR HN 1 2 350 1 1 1 1 11 LYS QB . 11 LYS QB 1 2 350 1 2 1 1 21 ALA MB . 21 ALA QB 1 2 351 1 1 1 1 11 LYS QG . 11 LYS QG 1 2 351 1 2 1 1 12 PRO QD . 12 PRO QD 1 2 352 1 1 1 1 12 PRO QB . 12 PRO QB 1 2 352 1 2 1 1 13 TYR H . 13 TYR HN 1 2 353 1 1 1 1 12 PRO QB . 12 PRO QB 1 2 353 1 2 1 1 13 TYR QD . 13 TYR QD 1 2 354 1 1 1 1 12 PRO QB . 12 PRO QB 1 2 354 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 355 1 1 1 1 12 PRO QG . 12 PRO QG 1 2 355 1 2 1 1 13 TYR H . 13 TYR HN 1 2 356 1 1 1 1 12 PRO QG . 12 PRO QG 1 2 356 1 2 1 1 13 TYR QD . 13 TYR QD 1 2 357 1 1 1 1 12 PRO QG . 12 PRO QG 1 2 357 1 2 1 1 13 TYR QE . 13 TYR QE 1 2 358 1 1 1 1 13 TYR QE . 13 TYR QE 1 2 358 1 2 1 1 25 HIS QB . 25 HIS QB 1 2 359 1 1 1 1 15 CYS H . 15 CYSS HN 1 2 359 1 2 1 1 20 LYS QB . 20 LYS QB 1 2 360 1 1 1 1 15 CYS HA . 15 CYSS HA 1 2 360 1 2 1 1 32 GLN QE . 32 GLN QE2 1 2 361 1 1 1 1 15 CYS HB2 . 15 CYSS HB2 1 2 361 1 2 1 1 20 LYS QB . 20 LYS QB 1 2 362 1 1 1 1 16 ASP H . 16 ASP HN 1 2 362 1 2 1 1 32 GLN QE . 32 GLN QE2 1 2 363 1 1 1 1 16 ASP HA . 16 ASP HA 1 2 363 1 2 1 1 19 ARG QD . 19 ARG QD 1 2 364 1 1 1 1 16 ASP QB . 16 ASP QB 1 2 364 1 2 1 1 17 VAL QG . 17 VAL QQG 1 2 365 1 1 1 1 17 VAL H . 17 VAL HN 1 2 365 1 2 1 1 17 VAL QG . 17 VAL QQG 1 2 366 1 1 1 1 17 VAL QG . 17 VAL QQG 1 2 366 1 2 1 1 18 CYS H . 18 CYSS HN 1 2 367 1 1 1 1 17 VAL QG . 17 VAL QQG 1 2 367 1 2 1 1 18 CYS HA . 18 CYSS HA 1 2 368 1 1 1 1 17 VAL QG . 17 VAL QQG 1 2 368 1 2 1 1 18 CYS QB . 18 CYSS QB 1 2 369 1 1 1 1 17 VAL QG . 17 VAL QQG 1 2 369 1 2 1 1 35 HIS QB . 35 HIS QB 1 2 370 1 1 1 1 17 VAL MG2 . 17 VAL QG2 1 2 370 1 2 1 1 35 HIS HB3 . 35 HIS HB3 1 2 371 1 1 1 1 17 VAL QG . 17 VAL QQG 1 2 371 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 372 1 1 1 1 17 VAL QG . 17 VAL QQG 1 2 372 1 2 1 1 35 HIS HE1 . 35 HIS HE1 1 2 373 1 1 1 1 18 CYS H . 18 CYSS HN 1 2 373 1 2 1 1 18 CYS QB . 18 CYSS QB 1 2 374 1 1 1 1 18 CYS QB . 18 CYSS QB 1 2 374 1 2 1 1 35 HIS HE1 . 35 HIS HE1 1 2 375 1 1 1 1 19 ARG H . 19 ARG HN 1 2 375 1 2 1 1 19 ARG QG . 19 ARG QG 1 2 376 1 1 1 1 19 ARG H . 19 ARG HN 1 2 376 1 2 1 1 20 LYS QB . 20 LYS QB 1 2 377 1 1 1 1 19 ARG HA . 19 ARG HA 1 2 377 1 2 1 1 19 ARG QG . 19 ARG QG 1 2 378 1 1 1 1 20 LYS H . 20 LYS HN 1 2 378 1 2 1 1 20 LYS QB . 20 LYS QB 1 2 379 1 1 1 1 20 LYS H . 20 LYS HN 1 2 379 1 2 1 1 20 LYS QG . 20 LYS QG 1 2 380 1 1 1 1 20 LYS H . 20 LYS HN 1 2 380 1 2 1 1 20 LYS QD . 20 LYS QD 1 2 381 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 381 1 2 1 1 20 LYS QG . 20 LYS QG 1 2 382 1 1 1 1 20 LYS HA . 20 LYS HA 1 2 382 1 2 1 1 20 LYS QD . 20 LYS QD 1 2 383 1 1 1 1 20 LYS QB . 20 LYS QB 1 2 383 1 2 1 1 20 LYS QD . 20 LYS QD 1 2 384 1 1 1 1 20 LYS QB . 20 LYS QB 1 2 384 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 385 1 1 1 1 20 LYS QB . 20 LYS QB 1 2 385 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 386 1 1 1 1 20 LYS QB . 20 LYS QB 1 2 386 1 2 1 1 31 HIS HE1 . 31 HIS HE1 1 2 387 1 1 1 1 20 LYS QG . 20 LYS QG 1 2 387 1 2 1 1 21 ALA H . 21 ALA HN 1 2 388 1 1 1 1 20 LYS QG . 20 LYS QG 1 2 388 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 389 1 1 1 1 20 LYS QG . 20 LYS QG 1 2 389 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 390 1 1 1 1 20 LYS QD . 20 LYS QD 1 2 390 1 2 1 1 21 ALA H . 21 ALA HN 1 2 391 1 1 1 1 20 LYS QD . 20 LYS QD 1 2 391 1 2 1 1 22 PHE QE . 22 PHE QE 1 2 392 1 1 1 1 20 LYS QD . 20 LYS QD 1 2 392 1 2 1 1 22 PHE HZ . 22 PHE HZ 1 2 393 1 1 1 1 20 LYS QD . 20 LYS QD 1 2 393 1 2 1 1 31 HIS HE1 . 31 HIS HE1 1 2 394 1 1 1 1 22 PHE HB2 . 22 PHE HB2 1 2 394 1 2 1 1 27 SER QB . 27 SER QB 1 2 395 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 395 1 2 1 1 24 HIS QB . 24 HIS QB 1 2 396 1 1 1 1 22 PHE HB3 . 22 PHE HB3 1 2 396 1 2 1 1 27 SER QB . 27 SER QB 1 2 397 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 397 1 2 1 1 27 SER QB . 27 SER QB 1 2 398 1 1 1 1 22 PHE QD . 22 PHE QD 1 2 398 1 2 1 1 31 HIS QB . 31 HIS QB 1 2 399 1 1 1 1 22 PHE QE . 22 PHE QE 1 2 399 1 2 1 1 31 HIS QB . 31 HIS QB 1 2 400 1 1 1 1 22 PHE HZ . 22 PHE HZ 1 2 400 1 2 1 1 31 HIS QB . 31 HIS QB 1 2 401 1 1 1 1 23 SER QB . 23 SER QB 1 2 401 1 2 1 1 24 HIS H . 24 HIS HN 1 2 402 1 1 1 1 24 HIS H . 24 HIS HN 1 2 402 1 2 1 1 24 HIS QB . 24 HIS QB 1 2 403 1 1 1 1 24 HIS H . 24 HIS HN 1 2 403 1 2 1 1 27 SER QB . 27 SER QB 1 2 404 1 1 1 1 24 HIS QB . 24 HIS QB 1 2 404 1 2 1 1 26 ALA MB . 26 ALA QB 1 2 405 1 1 1 1 24 HIS QB . 24 HIS QB 1 2 405 1 2 1 1 27 SER H . 27 SER HN 1 2 406 1 1 1 1 24 HIS QB . 24 HIS QB 1 2 406 1 2 1 1 27 SER QB . 27 SER QB 1 2 407 1 1 1 1 24 HIS QB . 24 HIS QB 1 2 407 1 2 1 1 28 LEU H . 28 LEU HN 1 2 408 1 1 1 1 25 HIS HA . 25 HIS HA 1 2 408 1 2 1 1 27 SER QB . 27 SER QB 1 2 409 1 1 1 1 27 SER H . 27 SER HN 1 2 409 1 2 1 1 27 SER QB . 27 SER QB 1 2 410 1 1 1 1 27 SER HA . 27 SER HA 1 2 410 1 2 1 1 30 GLN QB . 30 GLN QB 1 2 411 1 1 1 1 27 SER QB . 27 SER QB 1 2 411 1 2 1 1 28 LEU H . 28 LEU HN 1 2 412 1 1 1 1 28 LEU HA . 28 LEU HA 1 2 412 1 2 1 1 31 HIS QB . 31 HIS QB 1 2 413 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 413 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 414 1 1 1 1 28 LEU HG . 28 LEU HG 1 2 414 1 2 1 1 32 GLN QE . 32 GLN QE2 1 2 415 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 415 1 2 1 1 31 HIS QB . 31 HIS QB 1 2 416 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 416 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 417 1 1 1 1 28 LEU MD1 . 28 LEU QD1 1 2 417 1 2 1 1 32 GLN QE . 32 GLN QE2 1 2 418 1 1 1 1 29 THR HA . 29 THR HA 1 2 418 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 419 1 1 1 1 30 GLN H . 30 GLN HN 1 2 419 1 2 1 1 30 GLN QB . 30 GLN QB 1 2 420 1 1 1 1 30 GLN HA . 30 GLN HA 1 2 420 1 2 1 1 33 ARG QG . 33 ARG QG 1 2 421 1 1 1 1 30 GLN QB . 30 GLN QB 1 2 421 1 2 1 1 31 HIS H . 31 HIS HN 1 2 422 1 1 1 1 30 GLN QG . 30 GLN QG 1 2 422 1 2 1 1 31 HIS H . 31 HIS HN 1 2 423 1 1 1 1 31 HIS H . 31 HIS HN 1 2 423 1 2 1 1 31 HIS QB . 31 HIS QB 1 2 424 1 1 1 1 31 HIS HA . 31 HIS HA 1 2 424 1 2 1 1 34 VAL QG . 34 VAL QQG 1 2 425 1 1 1 1 31 HIS QB . 31 HIS QB 1 2 425 1 2 1 1 31 HIS HD2 . 31 HIS HD2 1 2 426 1 1 1 1 31 HIS QB . 31 HIS QB 1 2 426 1 2 1 1 32 GLN H . 32 GLN HN 1 2 427 1 1 1 1 31 HIS HD2 . 31 HIS HD2 1 2 427 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 428 1 1 1 1 31 HIS HE1 . 31 HIS HE1 1 2 428 1 2 1 1 34 VAL QG . 34 VAL QQG 1 2 429 1 1 1 1 32 GLN H . 32 GLN HN 1 2 429 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 430 1 1 1 1 32 GLN HA . 32 GLN HA 1 2 430 1 2 1 1 32 GLN QG . 32 GLN QG 1 2 431 1 1 1 1 32 GLN QG . 32 GLN QG 1 2 431 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 432 1 1 1 1 33 ARG H . 33 ARG HN 1 2 432 1 2 1 1 34 VAL QG . 34 VAL QQG 1 2 433 1 1 1 1 33 ARG HA . 33 ARG HA 1 2 433 1 2 1 1 33 ARG QG . 33 ARG QG 1 2 434 1 1 1 1 34 VAL HA . 34 VAL HA 1 2 434 1 2 1 1 34 VAL QG . 34 VAL QQG 1 2 435 1 1 1 1 34 VAL QG . 34 VAL QQG 1 2 435 1 2 1 1 35 HIS H . 35 HIS HN 1 2 436 1 1 1 1 34 VAL QG . 34 VAL QQG 1 2 436 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 437 1 1 1 1 34 VAL QG . 34 VAL QQG 1 2 437 1 2 1 1 35 HIS HE1 . 35 HIS HE1 1 2 438 1 1 1 1 35 HIS H . 35 HIS HN 1 2 438 1 2 1 1 35 HIS QB . 35 HIS QB 1 2 439 1 1 1 1 35 HIS QB . 35 HIS QB 1 2 439 1 2 1 1 35 HIS HD2 . 35 HIS HD2 1 2 440 1 1 1 1 38 GLU H . 38 GLU HN 1 2 440 1 2 1 1 38 GLU QB . 38 GLU QB 1 2 441 1 1 1 1 38 GLU H . 38 GLU HN 1 2 441 1 2 1 1 38 GLU QG . 38 GLU QG 1 2 442 1 1 1 1 38 GLU HA . 38 GLU HA 1 2 442 1 2 1 1 38 GLU QG . 38 GLU QG 1 2 443 1 1 1 1 38 GLU QB . 38 GLU QB 1 2 443 1 2 1 1 39 LYS H . 39 LYS HN 1 2 444 1 1 1 1 39 LYS H . 39 LYS HN 1 2 444 1 2 1 1 39 LYS QB . 39 LYS QB 1 2 445 1 1 1 1 39 LYS HA . 39 LYS HA 1 2 445 1 2 1 1 40 PRO QD . 40 PRO QD 1 2 446 1 1 1 1 39 LYS QB . 39 LYS QB 1 2 446 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 . . . . . . . 3.13 1 2 2 1 . . . . . . . 3.56 1 2 3 1 . . . . . . . 4.49 1 2 4 1 . . . . . . . 4.65 1 2 5 1 . . . . . . . 3.65 1 2 6 1 . . . . . . . 4.19 1 2 7 1 . . . . . . . 3.8 1 2 8 1 . . . . . . . 5.14 1 2 9 1 . . . . . . . 3.67 1 2 10 1 . . . . . . . 3.28 1 2 11 1 . . . . . . . 3.45 1 2 12 1 . . . . . . . 4.98 1 2 13 1 . . . . . . . 4.19 1 2 14 1 . . . . . . . 3.2 1 2 15 1 . . . . . . . 4.08 1 2 16 1 . . . . . . . 4.08 1 2 17 1 . . . . . . . 5.18 1 2 18 1 . . . . . . . 5.18 1 2 19 1 . . . . . . . 4.16 1 2 20 1 . . . . . . . 5.14 1 2 21 1 . . . . . . . 4.02 1 2 22 1 . . . . . . . 4.54 1 2 23 1 . . . . . . . 3.49 1 2 24 1 . . . . . . . 4.43 1 2 25 1 . . . . . . . 4.66 1 2 26 1 . . . . . . . 4.86 1 2 27 1 . . . . . . . 3.51 1 2 28 1 . . . . . . . 3.51 1 2 29 1 . . . . . . . 4.32 1 2 30 1 . . . . . . . 4.87 1 2 31 1 . . . . . . . 3.45 1 2 32 1 . . . . . . . 5.5 1 2 33 1 . . . . . . . 5.5 1 2 34 1 . . . . . . . 3.25 1 2 35 1 . . . . . . . 3.25 1 2 36 1 . . . . . . . 4.77 1 2 37 1 . . . . . . . 4.98 1 2 38 1 . . . . . . . 4.56 1 2 39 1 . . . . . . . 3.66 1 2 40 1 . . . . . . . 4.27 1 2 41 1 . . . . . . . 4.23 1 2 42 1 . . . . . . . 2.96 1 2 43 1 . . . . . . . 3.49 1 2 44 1 . . . . . . . 4.67 1 2 45 1 . . . . . . . 3.79 1 2 46 1 . . . . . . . 3.27 1 2 47 1 . . . . . . . 3.37 1 2 48 1 . . . . . . . 3.37 1 2 49 1 . . . . . . . 4.11 1 2 50 1 . . . . . . . 3.99 1 2 51 1 . . . . . . . 4.98 1 2 52 1 . . . . . . . 5.5 1 2 53 1 . . . . . . . 4.09 1 2 54 1 . . . . . . . 3.56 1 2 55 1 . . . . . . . 4.86 1 2 56 1 . . . . . . . 4.23 1 2 57 1 . . . . . . . 4.5 1 2 58 1 . . . . . . . 4.22 1 2 59 1 . . . . . . . 3.79 1 2 60 1 . . . . . . . 5.03 1 2 61 1 . . . . . . . 5.5 1 2 62 1 . . . . . . . 5.5 1 2 63 1 . . . . . . . 4.31 1 2 64 1 . . . . . . . 5.25 1 2 65 1 . . . . . . . 2.8 1 2 66 1 . . . . . . . 3.65 1 2 67 1 . . . . . . . 4.31 1 2 68 1 . . . . . . . 4.6 1 2 69 1 . . . . . . . 4.6 1 2 70 1 . . . . . . . 4.81 1 2 71 1 . . . . . . . 4.5 1 2 72 1 . . . . . . . 3.38 1 2 73 1 . . . . . . . 4.98 1 2 74 1 . . . . . . . 2.97 1 2 75 1 . . . . . . . 4.0 1 2 76 1 . . . . . . . 4.0 1 2 77 1 . . . . . . . 4.18 1 2 78 1 . . . . . . . 3.55 1 2 79 1 . . . . . . . 3.46 1 2 80 1 . . . . . . . 5.48 1 2 81 1 . . . . . . . 5.5 1 2 82 1 . . . . . . . 4.57 1 2 83 1 . . . . . . . 4.76 1 2 84 1 . . . . . . . 4.76 1 2 85 1 . . . . . . . 3.7 1 2 86 1 . . . . . . . 4.02 1 2 87 1 . . . . . . . 4.02 1 2 88 1 . . . . . . . 4.34 1 2 89 1 . . . . . . . 3.4 1 2 90 1 . . . . . . . 4.33 1 2 91 1 . . . . . . . 4.21 1 2 92 1 . . . . . . . 3.86 1 2 93 1 . . . . . . . 3.86 1 2 94 1 . . . . . . . 4.19 1 2 95 1 . . . . . . . 4.27 1 2 96 1 . . . . . . . 4.27 1 2 97 1 . . . . . . . 4.76 1 2 98 1 . . . . . . . 3.94 1 2 99 1 . . . . . . . 3.2 1 2 100 1 . . . . . . . 3.38 1 2 101 1 . . . . . . . 2.8 1 2 102 1 . . . . . . . 4.52 1 2 103 1 . . . . . . . 3.4 1 2 104 1 . . . . . . . 4.09 1 2 105 1 . . . . . . . 4.93 1 2 106 1 . . . . . . . 3.02 1 2 107 1 . . . . . . . 4.93 1 2 108 1 . . . . . . . 3.48 1 2 109 1 . . . . . . . 3.48 1 2 110 1 . . . . . . . 4.57 1 2 111 1 . . . . . . . 5.44 1 2 112 1 . . . . . . . 4.49 1 2 113 1 . . . . . . . 3.24 1 2 114 1 . . . . . . . 5.08 1 2 115 1 . . . . . . . 3.42 1 2 116 1 . . . . . . . 4.59 1 2 117 1 . . . . . . . 4.92 1 2 118 1 . . . . . . . 5.0 1 2 119 1 . . . . . . . 4.63 1 2 120 1 . . . . . . . 2.94 1 2 121 1 . . . . . . . 4.22 1 2 122 1 . . . . . . . 4.61 1 2 123 1 . . . . . . . 4.25 1 2 124 1 . . . . . . . 3.31 1 2 125 1 . . . . . . . 4.09 1 2 126 1 . . . . . . . 3.29 1 2 127 1 . . . . . . . 4.28 1 2 128 1 . . . . . . . 4.27 1 2 129 1 . . . . . . . 4.27 1 2 130 1 . . . . . . . 3.33 1 2 131 1 . . . . . . . 4.6 1 2 132 1 . . . . . . . 3.32 1 2 133 1 . . . . . . . 3.18 1 2 134 1 . . . . . . . 3.45 1 2 135 1 . . . . . . . 4.01 1 2 136 1 . . . . . . . 4.01 1 2 137 1 . . . . . . . 4.82 1 2 138 1 . . . . . . . 5.01 1 2 139 1 . . . . . . . 5.29 1 2 140 1 . . . . . . . 3.49 1 2 141 1 . . . . . . . 3.48 1 2 142 1 . . . . . . . 4.96 1 2 143 1 . . . . . . . 5.38 1 2 144 1 . . . . . . . 5.38 1 2 145 1 . . . . . . . 4.37 1 2 146 1 . . . . . . . 4.13 1 2 147 1 . . . . . . . 4.71 1 2 148 1 . . . . . . . 4.07 1 2 149 1 . . . . . . . 4.34 1 2 150 1 . . . . . . . 3.81 1 2 151 1 . . . . . . . 3.48 1 2 152 1 . . . . . . . 4.61 1 2 153 1 . . . . . . . 3.99 1 2 154 1 . . . . . . . 4.74 1 2 155 1 . . . . . . . 5.9 1 2 156 1 . . . . . . . 4.2 1 2 157 1 . . . . . . . 4.78 1 2 158 1 . . . . . . . 5.19 1 2 159 1 . . . . . . . 3.99 1 2 160 1 . . . . . . . 5.14 1 2 161 1 . . . . . . . 5.03 1 2 162 1 . . . . . . . 4.19 1 2 163 1 . . . . . . . 4.63 1 2 164 1 . . . . . . . 5.9 1 2 165 1 . . . . . . . 5.5 1 2 166 1 . . . . . . . 4.94 1 2 167 1 . . . . . . . 3.95 1 2 168 1 . . . . . . . 4.75 1 2 169 1 . . . . . . . 4.53 1 2 170 1 . . . . . . . 4.14 1 2 171 1 . . . . . . . 4.99 1 2 172 1 . . . . . . . 5.19 1 2 173 1 . . . . . . . 3.49 1 2 174 1 . . . . . . . 5.03 1 2 175 1 . . . . . . . 4.61 1 2 176 1 . . . . . . . 4.57 1 2 177 1 . . . . . . . 4.57 1 2 178 1 . . . . . . . 5.15 1 2 179 1 . . . . . . . 5.15 1 2 180 1 . . . . . . . 4.08 1 2 181 1 . . . . . . . 4.08 1 2 182 1 . . . . . . . 4.83 1 2 183 1 . . . . . . . 4.83 1 2 184 1 . . . . . . . 3.82 1 2 185 1 . . . . . . . 4.21 1 2 186 1 . . . . . . . 3.23 1 2 187 1 . . . . . . . 5.07 1 2 188 1 . . . . . . . 4.37 1 2 189 1 . . . . . . . 5.5 1 2 190 1 . . . . . . . 4.97 1 2 191 1 . . . . . . . 3.13 1 2 192 1 . . . . . . . 3.13 1 2 193 1 . . . . . . . 3.52 1 2 194 1 . . . . . . . 3.52 1 2 195 1 . . . . . . . 3.4 1 2 196 1 . . . . . . . 5.16 1 2 197 1 . . . . . . . 4.08 1 2 198 1 . . . . . . . 4.16 1 2 199 1 . . . . . . . 4.19 1 2 200 1 . . . . . . . 4.63 1 2 201 1 . . . . . . . 4.7 1 2 202 1 . . . . . . . 3.99 1 2 203 1 . . . . . . . 3.65 1 2 204 1 . . . . . . . 3.99 1 2 205 1 . . . . . . . 4.29 1 2 206 1 . . . . . . . 4.36 1 2 207 1 . . . . . . . 4.88 1 2 208 1 . . . . . . . 4.92 1 2 209 1 . . . . . . . 4.08 1 2 210 1 . . . . . . . 4.21 1 2 211 1 . . . . . . . 3.42 1 2 212 1 . . . . . . . 3.71 1 2 213 1 . . . . . . . 3.74 1 2 214 1 . . . . . . . 3.96 1 2 215 1 . . . . . . . 4.54 1 2 216 1 . . . . . . . 4.08 1 2 217 1 . . . . . . . 4.98 1 2 218 1 . . . . . . . 3.96 1 2 219 1 . . . . . . . 3.46 1 2 220 1 . . . . . . . 4.43 1 2 221 1 . . . . . . . 4.73 1 2 222 1 . . . . . . . 4.89 1 2 223 1 . . . . . . . 4.08 1 2 224 1 . . . . . . . 4.47 1 2 225 1 . . . . . . . 4.84 1 2 226 1 . . . . . . . 4.07 1 2 227 1 . . . . . . . 3.66 1 2 228 1 . . . . . . . 4.15 1 2 229 1 . . . . . . . 4.17 1 2 230 1 . . . . . . . 4.57 1 2 231 1 . . . . . . . 4.31 1 2 232 1 . . . . . . . 4.06 1 2 233 1 . . . . . . . 4.06 1 2 234 1 . . . . . . . 4.64 1 2 235 1 . . . . . . . 5.16 1 2 236 1 . . . . . . . 5.5 1 2 237 1 . . . . . . . 3.39 1 2 238 1 . . . . . . . 3.84 1 2 239 1 . . . . . . . 3.41 1 2 240 1 . . . . . . . 4.68 1 2 241 1 . . . . . . . 4.8 1 2 242 1 . . . . . . . 4.89 1 2 243 1 . . . . . . . 4.89 1 2 244 1 . . . . . . . 4.71 1 2 245 1 . . . . . . . 4.89 1 2 246 1 . . . . . . . 4.73 1 2 247 1 . . . . . . . 4.39 1 2 248 1 . . . . . . . 4.39 1 2 249 1 . . . . . . . 4.83 1 2 250 1 . . . . . . . 3.96 1 2 251 1 . . . . . . . 4.19 1 2 252 1 . . . . . . . 4.62 1 2 253 1 . . . . . . . 4.23 1 2 254 1 . . . . . . . 4.14 1 2 255 1 . . . . . . . 4.96 1 2 256 1 . . . . . . . 4.17 1 2 257 1 . . . . . . . 4.12 1 2 258 1 . . . . . . . 4.39 1 2 259 1 . . . . . . . 4.8 1 2 260 1 . . . . . . . 4.07 1 2 261 1 . . . . . . . 3.21 1 2 262 1 . . . . . . . 4.4 1 2 263 1 . . . . . . . 4.42 1 2 264 1 . . . . . . . 4.44 1 2 265 1 . . . . . . . 4.27 1 2 266 1 . . . . . . . 4.27 1 2 267 1 . . . . . . . 3.8 1 2 268 1 . . . . . . . 5.5 1 2 269 1 . . . . . . . 4.86 1 2 270 1 . . . . . . . 5.5 1 2 271 1 . . . . . . . 4.19 1 2 272 1 . . . . . . . 4.97 1 2 273 1 . . . . . . . 4.57 1 2 274 1 . . . . . . . 4.64 1 2 275 1 . . . . . . . 5.39 1 2 276 1 . . . . . . . 4.54 1 2 277 1 . . . . . . . 5.5 1 2 278 1 . . . . . . . 5.5 1 2 279 1 . . . . . . . 4.12 1 2 280 1 . . . . . . . 4.74 1 2 281 1 . . . . . . . 4.8 1 2 282 1 . . . . . . . 4.8 1 2 283 1 . . . . . . . 3.36 1 2 284 1 . . . . . . . 3.55 1 2 285 1 . . . . . . . 3.79 1 2 286 1 . . . . . . . 3.79 1 2 287 1 . . . . . . . 4.23 1 2 288 1 . . . . . . . 3.67 1 2 289 1 . . . . . . . 4.78 1 2 290 1 . . . . . . . 4.78 1 2 291 1 . . . . . . . 4.33 1 2 292 1 . . . . . . . 4.22 1 2 293 1 . . . . . . . 3.83 1 2 294 1 . . . . . . . 3.71 1 2 295 1 . . . . . . . 4.56 1 2 296 1 . . . . . . . 3.37 1 2 297 1 . . . . . . . 5.21 1 2 298 1 . . . . . . . 4.5 1 2 299 1 . . . . . . . 4.56 1 2 300 1 . . . . . . . 4.56 1 2 301 1 . . . . . . . 4.34 1 2 302 1 . . . . . . . 4.8 1 2 303 1 . . . . . . . 4.21 1 2 304 1 . . . . . . . 5.5 1 2 305 1 . . . . . . . 5.5 1 2 306 1 . . . . . . . 4.8 1 2 307 1 . . . . . . . 4.81 1 2 308 1 . . . . . . . 4.81 1 2 309 1 . . . . . . . 3.9 1 2 310 1 . . . . . . . 5.5 1 2 311 1 . . . . . . . 4.67 1 2 312 1 . . . . . . . 4.31 1 2 313 1 . . . . . . . 5.08 1 2 314 1 . . . . . . . 4.42 1 2 315 1 . . . . . . . 5.0 1 2 316 1 . . . . . . . 5.9 1 2 317 1 . . . . . . . 3.79 1 2 318 1 . . . . . . . 5.32 1 2 319 1 . . . . . . . 4.14 1 2 320 1 . . . . . . . 4.9 1 2 321 1 . . . . . . . 4.9 1 2 322 1 . . . . . . . 3.42 1 2 323 1 . . . . . . . 3.42 1 2 324 1 . . . . . . . 3.39 1 2 325 1 . . . . . . . 2.87 1 2 326 1 . . . . . . . 4.54 1 2 327 1 . . . . . . . 4.47 1 2 328 1 . . . . . . . 4.47 1 2 329 1 . . . . . . . 3.74 1 2 330 1 . . . . . . . 5.5 1 2 331 1 . . . . . . . 4.22 1 2 332 1 . . . . . . . 4.58 1 2 333 1 . . . . . . . 4.32 1 2 334 1 . . . . . . . 4.22 1 2 335 1 . . . . . . . 4.47 1 2 336 1 . . . . . . . 4.87 1 2 337 1 . . . . . . . 5.04 1 2 338 1 . . . . . . . 4.97 1 2 339 1 . . . . . . . 5.05 1 2 340 1 . . . . . . . 4.4 1 2 341 1 . . . . . . . 4.92 1 2 342 1 . . . . . . . 4.92 1 2 343 1 . . . . . . . 4.73 1 2 344 1 . . . . . . . 3.62 1 2 345 1 . . . . . . . 3.68 1 2 346 1 . . . . . . . 4.45 1 2 347 1 . . . . . . . 3.59 1 2 348 1 . . . . . . . 3.86 1 2 349 1 . . . . . . . 4.68 1 2 350 1 . . . . . . . 3.49 1 2 351 1 . . . . . . . 3.84 1 2 352 1 . . . . . . . 3.93 1 2 353 1 . . . . . . . 4.7 1 2 354 1 . . . . . . . 4.63 1 2 355 1 . . . . . . . 4.74 1 2 356 1 . . . . . . . 4.22 1 2 357 1 . . . . . . . 4.04 1 2 358 1 . . . . . . . 4.09 1 2 359 1 . . . . . . . 4.35 1 2 360 1 . . . . . . . 4.76 1 2 361 1 . . . . . . . 4.6 1 2 362 1 . . . . . . . 4.48 1 2 363 1 . . . . . . . 4.49 1 2 364 1 . . . . . . . 4.11 1 2 365 1 . . . . . . . 3.1 1 2 366 1 . . . . . . . 3.47 1 2 367 1 . . . . . . . 4.63 1 2 368 1 . . . . . . . 4.17 1 2 369 1 . . . . . . . 3.53 1 2 370 1 . . . . . . . 5.9 1 2 371 1 . . . . . . . 3.89 1 2 372 1 . . . . . . . 4.45 1 2 373 1 . . . . . . . 3.28 1 2 374 1 . . . . . . . 3.44 1 2 375 1 . . . . . . . 3.74 1 2 376 1 . . . . . . . 5.18 1 2 377 1 . . . . . . . 3.57 1 2 378 1 . . . . . . . 3.14 1 2 379 1 . . . . . . . 5.06 1 2 380 1 . . . . . . . 5.34 1 2 381 1 . . . . . . . 3.57 1 2 382 1 . . . . . . . 4.23 1 2 383 1 . . . . . . . 3.24 1 2 384 1 . . . . . . . 3.56 1 2 385 1 . . . . . . . 3.7 1 2 386 1 . . . . . . . 5.13 1 2 387 1 . . . . . . . 4.07 1 2 388 1 . . . . . . . 4.83 1 2 389 1 . . . . . . . 5.04 1 2 390 1 . . . . . . . 4.79 1 2 391 1 . . . . . . . 4.78 1 2 392 1 . . . . . . . 4.12 1 2 393 1 . . . . . . . 4.26 1 2 394 1 . . . . . . . 3.99 1 2 395 1 . . . . . . . 5.34 1 2 396 1 . . . . . . . 3.59 1 2 397 1 . . . . . . . 3.47 1 2 398 1 . . . . . . . 5.2 1 2 399 1 . . . . . . . 3.67 1 2 400 1 . . . . . . . 3.78 1 2 401 1 . . . . . . . 4.13 1 2 402 1 . . . . . . . 3.42 1 2 403 1 . . . . . . . 3.91 1 2 404 1 . . . . . . . 4.36 1 2 405 1 . . . . . . . 3.82 1 2 406 1 . . . . . . . 4.08 1 2 407 1 . . . . . . . 5.34 1 2 408 1 . . . . . . . 5.34 1 2 409 1 . . . . . . . 3.42 1 2 410 1 . . . . . . . 3.45 1 2 411 1 . . . . . . . 3.48 1 2 412 1 . . . . . . . 3.83 1 2 413 1 . . . . . . . 4.24 1 2 414 1 . . . . . . . 5.34 1 2 415 1 . . . . . . . 4.13 1 2 416 1 . . . . . . . 4.1 1 2 417 1 . . . . . . . 3.91 1 2 418 1 . . . . . . . 4.23 1 2 419 1 . . . . . . . 3.02 1 2 420 1 . . . . . . . 3.87 1 2 421 1 . . . . . . . 3.4 1 2 422 1 . . . . . . . 4.81 1 2 423 1 . . . . . . . 2.8 1 2 424 1 . . . . . . . 3.81 1 2 425 1 . . . . . . . 3.48 1 2 426 1 . . . . . . . 3.43 1 2 427 1 . . . . . . . 4.09 1 2 428 1 . . . . . . . 3.71 1 2 429 1 . . . . . . . 3.66 1 2 430 1 . . . . . . . 3.27 1 2 431 1 . . . . . . . 4.74 1 2 432 1 . . . . . . . 4.38 1 2 433 1 . . . . . . . 3.37 1 2 434 1 . . . . . . . 3.02 1 2 435 1 . . . . . . . 3.69 1 2 436 1 . . . . . . . 5.03 1 2 437 1 . . . . . . . 4.49 1 2 438 1 . . . . . . . 3.2 1 2 439 1 . . . . . . . 3.36 1 2 440 1 . . . . . . . 3.6 1 2 441 1 . . . . . . . 4.45 1 2 442 1 . . . . . . . 3.68 1 2 443 1 . . . . . . . 4.3 1 2 444 1 . . . . . . . 3.6 1 2 445 1 . . . . . . . 2.99 1 2 446 1 . . . . . . . 3.82 1 2 stop_ save_ save_DYANA/DIANA_dihedral_5 _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 PHI 1 1 24 HIS C 1 1 25 HIS N 1 1 25 HIS CA 1 1 25 HIS C -88.0 -28.0 . 25 HIS . . 25 HIS . . 25 HIS . . 25 HIS . 1 1 2 PSI 1 1 25 HIS N 1 1 25 HIS CA 1 1 25 HIS C 1 1 26 ALA N -71.0 -11.0 . 25 HIS . . 25 HIS . . 25 HIS . . 25 HIS . 1 1 3 PHI 1 1 25 HIS C 1 1 26 ALA N 1 1 26 ALA CA 1 1 26 ALA C -89.99999 -30.0 . 26 ALA . . 26 ALA . . 26 ALA . . 26 ALA . 1 1 4 PSI 1 1 26 ALA N 1 1 26 ALA CA 1 1 26 ALA C 1 1 27 SER N -69.0 -9.0 . 26 ALA . . 26 ALA . . 26 ALA . . 26 ALA . 1 1 5 PHI 1 1 26 ALA C 1 1 27 SER N 1 1 27 SER CA 1 1 27 SER C -97.0 -37.0 . 27 SER . . 27 SER . . 27 SER . . 27 SER . 1 1 6 PSI 1 1 27 SER N 1 1 27 SER CA 1 1 27 SER C 1 1 28 LEU N -66.99999 -7.0 . 27 SER . . 27 SER . . 27 SER . . 27 SER . 1 1 7 PHI 1 1 27 SER C 1 1 28 LEU N 1 1 28 LEU CA 1 1 28 LEU C -91.0 -30.999998 . 28 LEU . . 28 LEU . . 28 LEU . . 28 LEU . 1 1 8 PSI 1 1 28 LEU N 1 1 28 LEU CA 1 1 28 LEU C 1 1 29 THR N -73.0 -13.0 . 28 LEU . . 28 LEU . . 28 LEU . . 28 LEU . 1 1 9 PHI 1 1 28 LEU C 1 1 29 THR N 1 1 29 THR CA 1 1 29 THR C -94.0 -34.0 . 29 THR . . 29 THR . . 29 THR . . 29 THR . 1 1 10 PSI 1 1 29 THR N 1 1 29 THR CA 1 1 29 THR C 1 1 30 GLN N -74.0 -14.0 . 29 THR . . 29 THR . . 29 THR . . 29 THR . 1 1 11 PHI 1 1 29 THR C 1 1 30 GLN N 1 1 30 GLN CA 1 1 30 GLN C -95.0 -35.0 . 30 GLN . . 30 GLN . . 30 GLN . . 30 GLN . 1 1 12 PSI 1 1 30 GLN N 1 1 30 GLN CA 1 1 30 GLN C 1 1 31 HIS N -66.0 -5.9999995 . 30 GLN . . 30 GLN . . 30 GLN . . 30 GLN . 1 1 13 PHI 1 1 30 GLN C 1 1 31 HIS N 1 1 31 HIS CA 1 1 31 HIS C -94.0 -34.0 . 31 HIS . . 31 HIS . . 31 HIS . . 31 HIS . 1 1 14 PSI 1 1 31 HIS N 1 1 31 HIS CA 1 1 31 HIS C 1 1 32 GLN N -73.0 -13.0 . 31 HIS . . 31 HIS . . 31 HIS . . 31 HIS . 1 1 15 PHI 1 1 31 HIS C 1 1 32 GLN N 1 1 32 GLN CA 1 1 32 GLN C -94.0 -34.0 . 32 GLN . . 32 GLN . . 32 GLN . . 32 GLN . 1 1 16 PSI 1 1 32 GLN N 1 1 32 GLN CA 1 1 32 GLN C 1 1 33 ARG N -72.0 -11.999999 . 32 GLN . . 32 GLN . . 32 GLN . . 32 GLN . 1 1 17 PHI 1 1 32 GLN C 1 1 33 ARG N 1 1 33 ARG CA 1 1 33 ARG C -93.0 -33.0 . 33 ARG . . 33 ARG . . 33 ARG . . 33 ARG . 1 1 18 PSI 1 1 33 ARG N 1 1 33 ARG CA 1 1 33 ARG C 1 1 34 VAL N -69.0 -9.0 . 33 ARG . . 33 ARG . . 33 ARG . . 33 ARG . 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 -10.606 -27.136 -4.754 1.00 . A A . 1 GLY C 1 1 1 2 1 1 1 GLY CA C -11.714 -28.014 -5.304 1.00 . A A . 1 GLY CA 1 1 1 3 1 1 1 GLY H1 H -11.127 -30.022 -5.626 1.00 . A A . 1 GLY H1 1 1 1 4 1 1 1 GLY HA2 H -12.342 -27.420 -5.950 1.00 . A A . 1 GLY HA2 1 1 1 5 1 1 1 GLY HA3 H -12.307 -28.382 -4.480 1.00 . A A . 1 GLY HA3 1 1 1 6 1 1 1 GLY N N -11.204 -29.145 -6.056 1.00 . A A . 1 GLY N 1 1 1 7 1 1 1 GLY O O -9.451 -27.255 -5.162 1.00 . A A . 1 GLY O 1 1 1 8 1 1 2 SER C C -9.239 -26.032 -2.088 1.00 . A A . 2 SER C 1 1 1 9 1 1 2 SER CA C -9.988 -25.346 -3.226 1.00 . A A . 2 SER CA 1 1 1 10 1 1 2 SER CB C -10.686 -24.087 -2.706 1.00 . A A . 2 SER CB 1 1 1 11 1 1 2 SER H H -11.897 -26.204 -3.545 1.00 . A A . 2 SER H 1 1 1 12 1 1 2 SER HA H -9.279 -25.065 -3.990 1.00 . A A . 2 SER HA 1 1 1 13 1 1 2 SER HB2 H -9.964 -23.459 -2.206 1.00 . A A . 2 SER HB2 1 1 1 14 1 1 2 SER HB3 H -11.117 -23.549 -3.538 1.00 . A A . 2 SER HB3 1 1 1 15 1 1 2 SER HG H -11.336 -24.851 -1.024 1.00 . A A . 2 SER HG 1 1 1 16 1 1 2 SER N N -10.960 -26.251 -3.828 1.00 . A A . 2 SER N 1 1 1 17 1 1 2 SER O O -9.669 -25.995 -0.935 1.00 . A A . 2 SER O 1 1 1 18 1 1 2 SER OG O -11.716 -24.416 -1.791 1.00 . A A . 2 SER OG 1 1 1 19 1 1 3 SER C C -5.872 -26.840 -1.434 1.00 . A A . 3 SER C 1 1 1 20 1 1 3 SER CA C -7.307 -27.358 -1.428 1.00 . A A . 3 SER CA 1 1 1 21 1 1 3 SER CB C -7.319 -28.864 -1.699 1.00 . A A . 3 SER CB 1 1 1 22 1 1 3 SER H H -7.824 -26.654 -3.357 1.00 . A A . 3 SER H 1 1 1 23 1 1 3 SER HA H -7.740 -27.172 -0.457 1.00 . A A . 3 SER HA 1 1 1 24 1 1 3 SER HB2 H -7.338 -29.035 -2.764 1.00 . A A . 3 SER HB2 1 1 1 25 1 1 3 SER HB3 H -6.428 -29.309 -1.278 1.00 . A A . 3 SER HB3 1 1 1 26 1 1 3 SER HG H -8.219 -30.350 -0.795 1.00 . A A . 3 SER HG 1 1 1 27 1 1 3 SER N N -8.115 -26.659 -2.420 1.00 . A A . 3 SER N 1 1 1 28 1 1 3 SER O O -5.320 -26.496 -0.390 1.00 . A A . 3 SER O 1 1 1 29 1 1 3 SER OG O -8.455 -29.478 -1.116 1.00 . A A . 3 SER OG 1 1 1 30 1 1 4 GLY C C -3.833 -24.893 -3.272 1.00 . A A . 4 GLY C 1 1 1 31 1 1 4 GLY CA C -3.907 -26.311 -2.742 1.00 . A A . 4 GLY CA 1 1 1 32 1 1 4 GLY H H -5.762 -27.076 -3.419 1.00 . A A . 4 GLY H 1 1 1 33 1 1 4 GLY HA2 H -3.438 -26.346 -1.770 1.00 . A A . 4 GLY HA2 1 1 1 34 1 1 4 GLY HA3 H -3.369 -26.963 -3.414 1.00 . A A . 4 GLY HA3 1 1 1 35 1 1 4 GLY N N -5.273 -26.788 -2.620 1.00 . A A . 4 GLY N 1 1 1 36 1 1 4 GLY O O -4.200 -24.632 -4.417 1.00 . A A . 4 GLY O 1 1 1 37 1 1 5 SER C C -1.938 -21.974 -2.313 1.00 . A A . 5 SER C 1 1 1 38 1 1 5 SER CA C -3.243 -22.574 -2.826 1.00 . A A . 5 SER CA 1 1 1 39 1 1 5 SER CB C -4.431 -21.774 -2.288 1.00 . A A . 5 SER CB 1 1 1 40 1 1 5 SER H H -3.083 -24.245 -1.535 1.00 . A A . 5 SER H 1 1 1 41 1 1 5 SER HA H -3.248 -22.529 -3.904 1.00 . A A . 5 SER HA 1 1 1 42 1 1 5 SER HB2 H -4.290 -20.728 -2.516 1.00 . A A . 5 SER HB2 1 1 1 43 1 1 5 SER HB3 H -5.340 -22.125 -2.756 1.00 . A A . 5 SER HB3 1 1 1 44 1 1 5 SER HG H -3.788 -21.534 -0.453 1.00 . A A . 5 SER HG 1 1 1 45 1 1 5 SER N N -3.359 -23.975 -2.436 1.00 . A A . 5 SER N 1 1 1 46 1 1 5 SER O O -1.516 -22.245 -1.189 1.00 . A A . 5 SER O 1 1 1 47 1 1 5 SER OG O -4.553 -21.922 -0.885 1.00 . A A . 5 SER OG 1 1 1 48 1 1 6 SER C C -0.287 -19.149 -2.158 1.00 . A A . 6 SER C 1 1 1 49 1 1 6 SER CA C -0.042 -20.520 -2.781 1.00 . A A . 6 SER CA 1 1 1 50 1 1 6 SER CB C 0.859 -20.381 -4.010 1.00 . A A . 6 SER CB 1 1 1 51 1 1 6 SER H H -1.689 -20.980 -4.030 1.00 . A A . 6 SER H 1 1 1 52 1 1 6 SER HA H 0.449 -21.150 -2.054 1.00 . A A . 6 SER HA 1 1 1 53 1 1 6 SER HB2 H 1.830 -20.025 -3.702 1.00 . A A . 6 SER HB2 1 1 1 54 1 1 6 SER HB3 H 0.963 -21.345 -4.487 1.00 . A A . 6 SER HB3 1 1 1 55 1 1 6 SER HG H -0.222 -19.943 -5.584 1.00 . A A . 6 SER HG 1 1 1 56 1 1 6 SER N N -1.302 -21.157 -3.147 1.00 . A A . 6 SER N 1 1 1 57 1 1 6 SER O O 0.419 -18.186 -2.454 1.00 . A A . 6 SER O 1 1 1 58 1 1 6 SER OG O 0.311 -19.466 -4.943 1.00 . A A . 6 SER OG 1 1 1 59 1 1 7 GLY C C -1.444 -16.622 -1.563 1.00 . A A . 7 GLY C 1 1 1 60 1 1 7 GLY CA C -1.615 -17.814 -0.642 1.00 . A A . 7 GLY CA 1 1 1 61 1 1 7 GLY H H -1.822 -19.871 -1.096 1.00 . A A . 7 GLY H 1 1 1 62 1 1 7 GLY HA2 H -2.639 -17.849 -0.302 1.00 . A A . 7 GLY HA2 1 1 1 63 1 1 7 GLY HA3 H -0.967 -17.688 0.213 1.00 . A A . 7 GLY HA3 1 1 1 64 1 1 7 GLY N N -1.294 -19.070 -1.293 1.00 . A A . 7 GLY N 1 1 1 65 1 1 7 GLY O O -0.848 -15.614 -1.184 1.00 . A A . 7 GLY O 1 1 1 66 1 1 8 THR C C -1.993 -14.298 -3.093 1.00 . A A . 8 THR C 1 1 1 67 1 1 8 THR CA C -1.867 -15.663 -3.760 1.00 . A A . 8 THR CA 1 1 1 68 1 1 8 THR CB C -2.949 -15.792 -4.848 1.00 . A A . 8 THR CB 1 1 1 69 1 1 8 THR CG2 C -2.768 -17.078 -5.642 1.00 . A A . 8 THR CG2 1 1 1 70 1 1 8 THR H H -2.430 -17.566 -3.024 1.00 . A A . 8 THR H 1 1 1 71 1 1 8 THR HA H -0.899 -15.733 -4.234 1.00 . A A . 8 THR HA 1 1 1 72 1 1 8 THR HB H -2.861 -14.954 -5.524 1.00 . A A . 8 THR HB 1 1 1 73 1 1 8 THR HG1 H -4.866 -15.327 -4.835 1.00 . A A . 8 THR HG1 1 1 1 74 1 1 8 THR HG21 H -2.601 -16.838 -6.681 1.00 . A A . 8 THR HG21 1 1 1 75 1 1 8 THR HG22 H -3.656 -17.685 -5.551 1.00 . A A . 8 THR HG22 1 1 1 76 1 1 8 THR HG23 H -1.918 -17.621 -5.257 1.00 . A A . 8 THR HG23 1 1 1 77 1 1 8 THR N N -1.967 -16.737 -2.780 1.00 . A A . 8 THR N 1 1 1 78 1 1 8 THR O O -1.237 -13.376 -3.397 1.00 . A A . 8 THR O 1 1 1 79 1 1 8 THR OG1 O -4.250 -15.775 -4.250 1.00 . A A . 8 THR OG1 1 1 1 80 1 1 9 GLY C C -4.054 -13.069 -0.271 1.00 . A A . 9 GLY C 1 1 1 81 1 1 9 GLY CA C -3.161 -12.919 -1.487 1.00 . A A . 9 GLY CA 1 1 1 82 1 1 9 GLY H H -3.527 -14.945 -1.981 1.00 . A A . 9 GLY H 1 1 1 83 1 1 9 GLY HA2 H -2.203 -12.532 -1.172 1.00 . A A . 9 GLY HA2 1 1 1 84 1 1 9 GLY HA3 H -3.616 -12.214 -2.168 1.00 . A A . 9 GLY HA3 1 1 1 85 1 1 9 GLY N N -2.954 -14.176 -2.182 1.00 . A A . 9 GLY N 1 1 1 86 1 1 9 GLY O O -5.057 -13.780 -0.315 1.00 . A A . 9 GLY O 1 1 1 87 1 1 10 GLU C C -5.128 -11.125 2.347 1.00 . A A . 10 GLU C 1 1 1 88 1 1 10 GLU CA C -4.461 -12.466 2.051 1.00 . A A . 10 GLU CA 1 1 1 89 1 1 10 GLU CB C -3.563 -12.870 3.222 1.00 . A A . 10 GLU CB 1 1 1 90 1 1 10 GLU CD C -1.423 -12.439 4.492 1.00 . A A . 10 GLU CD 1 1 1 91 1 1 10 GLU CG C -2.394 -11.926 3.447 1.00 . A A . 10 GLU CG 1 1 1 92 1 1 10 GLU H H -2.876 -11.850 0.790 1.00 . A A . 10 GLU H 1 1 1 93 1 1 10 GLU HA H -5.228 -13.215 1.922 1.00 . A A . 10 GLU HA 1 1 1 94 1 1 10 GLU HB2 H -4.158 -12.896 4.124 1.00 . A A . 10 GLU HB2 1 1 1 95 1 1 10 GLU HB3 H -3.170 -13.858 3.034 1.00 . A A . 10 GLU HB3 1 1 1 96 1 1 10 GLU HG2 H -1.863 -11.802 2.515 1.00 . A A . 10 GLU HG2 1 1 1 97 1 1 10 GLU HG3 H -2.777 -10.970 3.771 1.00 . A A . 10 GLU HG3 1 1 1 98 1 1 10 GLU N N -3.687 -12.400 0.817 1.00 . A A . 10 GLU N 1 1 1 99 1 1 10 GLU O O -6.018 -11.035 3.193 1.00 . A A . 10 GLU O 1 1 1 100 1 1 10 GLU OE1 O -1.833 -12.586 5.663 1.00 . A A . 10 GLU OE1 1 1 1 101 1 1 10 GLU OE2 O -0.252 -12.694 4.139 1.00 . A A . 10 GLU OE2 1 1 1 102 1 1 11 LYS C C -5.263 -7.982 0.510 1.00 . A A . 11 LYS C 1 1 1 103 1 1 11 LYS CA C -5.246 -8.750 1.827 1.00 . A A . 11 LYS CA 1 1 1 104 1 1 11 LYS CB C -4.433 -7.978 2.870 1.00 . A A . 11 LYS CB 1 1 1 105 1 1 11 LYS CD C -6.103 -7.965 4.746 1.00 . A A . 11 LYS CD 1 1 1 106 1 1 11 LYS CE C -6.319 -8.226 6.229 1.00 . A A . 11 LYS CE 1 1 1 107 1 1 11 LYS CG C -4.718 -8.403 4.300 1.00 . A A . 11 LYS CG 1 1 1 108 1 1 11 LYS H H -3.980 -10.222 0.982 1.00 . A A . 11 LYS H 1 1 1 109 1 1 11 LYS HA H -6.260 -8.857 2.181 1.00 . A A . 11 LYS HA 1 1 1 110 1 1 11 LYS HB2 H -3.382 -8.130 2.674 1.00 . A A . 11 LYS HB2 1 1 1 111 1 1 11 LYS HB3 H -4.659 -6.926 2.777 1.00 . A A . 11 LYS HB3 1 1 1 112 1 1 11 LYS HD2 H -6.214 -6.907 4.559 1.00 . A A . 11 LYS HD2 1 1 1 113 1 1 11 LYS HD3 H -6.844 -8.512 4.181 1.00 . A A . 11 LYS HD3 1 1 1 114 1 1 11 LYS HE2 H -6.118 -9.267 6.431 1.00 . A A . 11 LYS HE2 1 1 1 115 1 1 11 LYS HE3 H -5.634 -7.611 6.793 1.00 . A A . 11 LYS HE3 1 1 1 116 1 1 11 LYS HG2 H -4.655 -9.479 4.366 1.00 . A A . 11 LYS HG2 1 1 1 117 1 1 11 LYS HG3 H -3.981 -7.957 4.952 1.00 . A A . 11 LYS HG3 1 1 1 118 1 1 11 LYS HZ1 H -7.706 -7.391 7.549 1.00 . A A . 11 LYS HZ1 1 1 1 119 1 1 11 LYS HZ2 H -8.255 -8.791 6.775 1.00 . A A . 11 LYS HZ2 1 1 1 120 1 1 11 LYS HZ3 H -8.182 -7.330 5.927 1.00 . A A . 11 LYS HZ3 1 1 1 121 1 1 11 LYS N N -4.692 -10.086 1.643 1.00 . A A . 11 LYS N 1 1 1 122 1 1 11 LYS NZ N -7.713 -7.912 6.650 1.00 . A A . 11 LYS NZ 1 1 1 123 1 1 11 LYS O O -4.406 -8.165 -0.355 1.00 . A A . 11 LYS O 1 1 1 124 1 1 12 PRO C C -5.322 -5.223 -0.981 1.00 . A A . 12 PRO C 1 1 1 125 1 1 12 PRO CA C -6.411 -6.283 -0.857 1.00 . A A . 12 PRO CA 1 1 1 126 1 1 12 PRO CB C -7.780 -5.624 -0.671 1.00 . A A . 12 PRO CB 1 1 1 127 1 1 12 PRO CD C -7.317 -6.828 1.341 1.00 . A A . 12 PRO CD 1 1 1 128 1 1 12 PRO CG C -7.990 -5.595 0.803 1.00 . A A . 12 PRO CG 1 1 1 129 1 1 12 PRO HA H -6.421 -6.893 -1.748 1.00 . A A . 12 PRO HA 1 1 1 130 1 1 12 PRO HB2 H -7.761 -4.626 -1.088 1.00 . A A . 12 PRO HB2 1 1 1 131 1 1 12 PRO HB3 H -8.537 -6.212 -1.167 1.00 . A A . 12 PRO HB3 1 1 1 132 1 1 12 PRO HD2 H -6.892 -6.632 2.315 1.00 . A A . 12 PRO HD2 1 1 1 133 1 1 12 PRO HD3 H -8.017 -7.649 1.391 1.00 . A A . 12 PRO HD3 1 1 1 134 1 1 12 PRO HG2 H -7.539 -4.709 1.222 1.00 . A A . 12 PRO HG2 1 1 1 135 1 1 12 PRO HG3 H -9.047 -5.620 1.024 1.00 . A A . 12 PRO HG3 1 1 1 136 1 1 12 PRO N N -6.260 -7.099 0.352 1.00 . A A . 12 PRO N 1 1 1 137 1 1 12 PRO O O -5.167 -4.598 -2.030 1.00 . A A . 12 PRO O 1 1 1 138 1 1 13 TYR C C -2.244 -4.605 0.775 1.00 . A A . 13 TYR C 1 1 1 139 1 1 13 TYR CA C -3.494 -4.041 0.107 1.00 . A A . 13 TYR CA 1 1 1 140 1 1 13 TYR CB C -3.946 -2.773 0.833 1.00 . A A . 13 TYR CB 1 1 1 141 1 1 13 TYR CD1 C -5.457 -1.525 -0.760 1.00 . A A . 13 TYR CD1 1 1 1 142 1 1 13 TYR CD2 C -6.443 -2.565 1.144 1.00 . A A . 13 TYR CD2 1 1 1 143 1 1 13 TYR CE1 C -6.698 -1.070 -1.160 1.00 . A A . 13 TYR CE1 1 1 1 144 1 1 13 TYR CE2 C -7.689 -2.116 0.751 1.00 . A A . 13 TYR CE2 1 1 1 145 1 1 13 TYR CG C -5.307 -2.278 0.398 1.00 . A A . 13 TYR CG 1 1 1 146 1 1 13 TYR CZ C -7.811 -1.368 -0.402 1.00 . A A . 13 TYR CZ 1 1 1 147 1 1 13 TYR H H -4.740 -5.556 0.902 1.00 . A A . 13 TYR H 1 1 1 148 1 1 13 TYR HA H -3.260 -3.794 -0.918 1.00 . A A . 13 TYR HA 1 1 1 149 1 1 13 TYR HB2 H -3.988 -2.969 1.893 1.00 . A A . 13 TYR HB2 1 1 1 150 1 1 13 TYR HB3 H -3.231 -1.985 0.646 1.00 . A A . 13 TYR HB3 1 1 1 151 1 1 13 TYR HD1 H -4.583 -1.293 -1.352 1.00 . A A . 13 TYR HD1 1 1 1 152 1 1 13 TYR HD2 H -6.344 -3.150 2.047 1.00 . A A . 13 TYR HD2 1 1 1 153 1 1 13 TYR HE1 H -6.794 -0.485 -2.063 1.00 . A A . 13 TYR HE1 1 1 1 154 1 1 13 TYR HE2 H -8.560 -2.349 1.344 1.00 . A A . 13 TYR HE2 1 1 1 155 1 1 13 TYR HH H -9.705 -1.168 -0.144 1.00 . A A . 13 TYR HH 1 1 1 156 1 1 13 TYR N N -4.569 -5.027 0.095 1.00 . A A . 13 TYR N 1 1 1 157 1 1 13 TYR O O -2.269 -4.977 1.948 1.00 . A A . 13 TYR O 1 1 1 158 1 1 13 TYR OH O -9.049 -0.918 -0.799 1.00 . A A . 13 TYR OH 1 1 1 159 1 1 14 GLU C C 1.286 -4.358 0.030 1.00 . A A . 14 GLU C 1 1 1 160 1 1 14 GLU CA C 0.108 -5.184 0.538 1.00 . A A . 14 GLU CA 1 1 1 161 1 1 14 GLU CB C 0.286 -6.649 0.134 1.00 . A A . 14 GLU CB 1 1 1 162 1 1 14 GLU CD C 1.506 -8.800 0.651 1.00 . A A . 14 GLU CD 1 1 1 163 1 1 14 GLU CG C 1.549 -7.285 0.691 1.00 . A A . 14 GLU CG 1 1 1 164 1 1 14 GLU H H -1.196 -4.354 -0.909 1.00 . A A . 14 GLU H 1 1 1 165 1 1 14 GLU HA H 0.075 -5.119 1.615 1.00 . A A . 14 GLU HA 1 1 1 166 1 1 14 GLU HB2 H -0.564 -7.214 0.489 1.00 . A A . 14 GLU HB2 1 1 1 167 1 1 14 GLU HB3 H 0.323 -6.711 -0.944 1.00 . A A . 14 GLU HB3 1 1 1 168 1 1 14 GLU HG2 H 2.393 -6.948 0.109 1.00 . A A . 14 GLU HG2 1 1 1 169 1 1 14 GLU HG3 H 1.672 -6.970 1.717 1.00 . A A . 14 GLU HG3 1 1 1 170 1 1 14 GLU N N -1.153 -4.665 0.019 1.00 . A A . 14 GLU N 1 1 1 171 1 1 14 GLU O O 1.421 -4.120 -1.171 1.00 . A A . 14 GLU O 1 1 1 172 1 1 14 GLU OE1 O 0.651 -9.388 1.345 1.00 . A A . 14 GLU OE1 1 1 1 173 1 1 14 GLU OE2 O 2.328 -9.398 -0.075 1.00 . A A . 14 GLU OE2 1 1 1 174 1 1 15 CYS C C 4.280 -3.930 -0.251 1.00 . A A . 15 CYS C 1 1 1 175 1 1 15 CYS CA C 3.305 -3.124 0.602 1.00 . A A . 15 CYS CA 1 1 1 176 1 1 15 CYS CB C 4.007 -2.626 1.866 1.00 . A A . 15 CYS CB 1 1 1 177 1 1 15 CYS H H 1.977 -4.147 1.895 1.00 . A A . 15 CYS H 1 1 1 178 1 1 15 CYS HA H 2.964 -2.273 0.031 1.00 . A A . 15 CYS HA 1 1 1 179 1 1 15 CYS HB2 H 3.262 -2.352 2.598 1.00 . A A . 15 CYS HB2 1 1 1 180 1 1 15 CYS HB3 H 4.621 -3.420 2.265 1.00 . A A . 15 CYS HB3 1 1 1 181 1 1 15 CYS N N 2.138 -3.924 0.953 1.00 . A A . 15 CYS N 1 1 1 182 1 1 15 CYS O O 4.655 -5.047 0.104 1.00 . A A . 15 CYS O 1 1 1 183 1 1 15 CYS SG S 5.079 -1.177 1.600 1.00 . A A . 15 CYS SG 1 1 1 184 1 1 16 ASP C C 7.061 -3.778 -1.846 1.00 . A A . 16 ASP C 1 1 1 185 1 1 16 ASP CA C 5.619 -4.019 -2.282 1.00 . A A . 16 ASP CA 1 1 1 186 1 1 16 ASP CB C 5.416 -3.521 -3.714 1.00 . A A . 16 ASP CB 1 1 1 187 1 1 16 ASP CG C 4.176 -4.108 -4.360 1.00 . A A . 16 ASP CG 1 1 1 188 1 1 16 ASP H H 4.351 -2.463 -1.607 1.00 . A A . 16 ASP H 1 1 1 189 1 1 16 ASP HA H 5.417 -5.079 -2.247 1.00 . A A . 16 ASP HA 1 1 1 190 1 1 16 ASP HB2 H 5.319 -2.445 -3.704 1.00 . A A . 16 ASP HB2 1 1 1 191 1 1 16 ASP HB3 H 6.274 -3.796 -4.308 1.00 . A A . 16 ASP HB3 1 1 1 192 1 1 16 ASP N N 4.686 -3.355 -1.378 1.00 . A A . 16 ASP N 1 1 1 193 1 1 16 ASP O O 7.987 -3.864 -2.654 1.00 . A A . 16 ASP O 1 1 1 194 1 1 16 ASP OD1 O 3.780 -5.227 -3.974 1.00 . A A . 16 ASP OD1 1 1 1 195 1 1 16 ASP OD2 O 3.603 -3.449 -5.253 1.00 . A A . 16 ASP OD2 1 1 1 196 1 1 17 VAL C C 8.854 -4.114 1.183 1.00 . A A . 17 VAL C 1 1 1 197 1 1 17 VAL CA C 8.574 -3.223 -0.022 1.00 . A A . 17 VAL CA 1 1 1 198 1 1 17 VAL CB C 8.739 -1.749 0.394 1.00 . A A . 17 VAL CB 1 1 1 199 1 1 17 VAL CG1 C 10.113 -1.518 1.005 1.00 . A A . 17 VAL CG1 1 1 1 200 1 1 17 VAL CG2 C 8.515 -0.831 -0.799 1.00 . A A . 17 VAL CG2 1 1 1 201 1 1 17 VAL H H 6.468 -3.422 0.029 1.00 . A A . 17 VAL H 1 1 1 202 1 1 17 VAL HA H 9.297 -3.441 -0.795 1.00 . A A . 17 VAL HA 1 1 1 203 1 1 17 VAL HB H 7.994 -1.521 1.142 1.00 . A A . 17 VAL HB 1 1 1 204 1 1 17 VAL HG11 H 10.783 -2.305 0.692 1.00 . A A . 17 VAL HG11 1 1 1 205 1 1 17 VAL HG12 H 10.498 -0.564 0.674 1.00 . A A . 17 VAL HG12 1 1 1 206 1 1 17 VAL HG13 H 10.033 -1.521 2.082 1.00 . A A . 17 VAL HG13 1 1 1 207 1 1 17 VAL HG21 H 8.175 0.133 -0.452 1.00 . A A . 17 VAL HG21 1 1 1 208 1 1 17 VAL HG22 H 9.442 -0.713 -1.340 1.00 . A A . 17 VAL HG22 1 1 1 209 1 1 17 VAL HG23 H 7.770 -1.263 -1.451 1.00 . A A . 17 VAL HG23 1 1 1 210 1 1 17 VAL N N 7.245 -3.476 -0.565 1.00 . A A . 17 VAL N 1 1 1 211 1 1 17 VAL O O 9.852 -4.835 1.217 1.00 . A A . 17 VAL O 1 1 1 212 1 1 18 CYS C C 7.056 -5.958 3.439 1.00 . A A . 18 CYS C 1 1 1 213 1 1 18 CYS CA C 8.117 -4.863 3.378 1.00 . A A . 18 CYS CA 1 1 1 214 1 1 18 CYS CB C 8.021 -3.975 4.620 1.00 . A A . 18 CYS CB 1 1 1 215 1 1 18 CYS H H 7.191 -3.467 2.085 1.00 . A A . 18 CYS H 1 1 1 216 1 1 18 CYS HA H 9.092 -5.325 3.351 1.00 . A A . 18 CYS HA 1 1 1 217 1 1 18 CYS HB2 H 8.039 -4.599 5.502 1.00 . A A . 18 CYS HB2 1 1 1 218 1 1 18 CYS HB3 H 8.868 -3.306 4.641 1.00 . A A . 18 CYS HB3 1 1 1 219 1 1 18 CYS N N 7.967 -4.061 2.170 1.00 . A A . 18 CYS N 1 1 1 220 1 1 18 CYS O O 7.030 -6.760 4.373 1.00 . A A . 18 CYS O 1 1 1 221 1 1 18 CYS SG S 6.510 -2.960 4.694 1.00 . A A . 18 CYS SG 1 1 1 222 1 1 19 ARG C C 4.200 -6.868 3.588 1.00 . A A . 19 ARG C 1 1 1 223 1 1 19 ARG CA C 5.121 -6.982 2.377 1.00 . A A . 19 ARG CA 1 1 1 224 1 1 19 ARG CB C 5.715 -8.390 2.305 1.00 . A A . 19 ARG CB 1 1 1 225 1 1 19 ARG CD C 7.622 -8.014 0.711 1.00 . A A . 19 ARG CD 1 1 1 226 1 1 19 ARG CG C 6.303 -8.735 0.947 1.00 . A A . 19 ARG CG 1 1 1 227 1 1 19 ARG CZ C 9.385 -9.578 1.412 1.00 . A A . 19 ARG CZ 1 1 1 228 1 1 19 ARG H H 6.256 -5.321 1.721 1.00 . A A . 19 ARG H 1 1 1 229 1 1 19 ARG HA H 4.544 -6.798 1.482 1.00 . A A . 19 ARG HA 1 1 1 230 1 1 19 ARG HB2 H 6.498 -8.476 3.044 1.00 . A A . 19 ARG HB2 1 1 1 231 1 1 19 ARG HB3 H 4.940 -9.107 2.530 1.00 . A A . 19 ARG HB3 1 1 1 232 1 1 19 ARG HD2 H 7.936 -8.191 -0.306 1.00 . A A . 19 ARG HD2 1 1 1 233 1 1 19 ARG HD3 H 7.470 -6.956 0.863 1.00 . A A . 19 ARG HD3 1 1 1 234 1 1 19 ARG HE H 8.844 -7.944 2.420 1.00 . A A . 19 ARG HE 1 1 1 235 1 1 19 ARG HG2 H 6.474 -9.800 0.898 1.00 . A A . 19 ARG HG2 1 1 1 236 1 1 19 ARG HG3 H 5.602 -8.445 0.178 1.00 . A A . 19 ARG HG3 1 1 1 237 1 1 19 ARG HH11 H 8.466 -10.054 -0.323 1.00 . A A . 19 ARG HH11 1 1 1 238 1 1 19 ARG HH12 H 9.711 -11.148 0.182 1.00 . A A . 19 ARG HH12 1 1 1 239 1 1 19 ARG HH21 H 10.485 -9.377 3.095 1.00 . A A . 19 ARG HH21 1 1 1 240 1 1 19 ARG HH22 H 10.859 -10.762 2.127 1.00 . A A . 19 ARG HH22 1 1 1 241 1 1 19 ARG N N 6.184 -5.986 2.437 1.00 . A A . 19 ARG N 1 1 1 242 1 1 19 ARG NE N 8.668 -8.479 1.618 1.00 . A A . 19 ARG NE 1 1 1 243 1 1 19 ARG NH1 N 9.169 -10.321 0.335 1.00 . A A . 19 ARG NH1 1 1 1 244 1 1 19 ARG NH2 N 10.320 -9.935 2.283 1.00 . A A . 19 ARG NH2 1 1 1 245 1 1 19 ARG O O 3.874 -7.866 4.230 1.00 . A A . 19 ARG O 1 1 1 246 1 1 20 LYS C C 1.440 -5.595 4.633 1.00 . A A . 20 LYS C 1 1 1 247 1 1 20 LYS CA C 2.900 -5.398 5.029 1.00 . A A . 20 LYS CA 1 1 1 248 1 1 20 LYS CB C 3.107 -3.979 5.564 1.00 . A A . 20 LYS CB 1 1 1 249 1 1 20 LYS CD C 3.577 -4.086 8.029 1.00 . A A . 20 LYS CD 1 1 1 250 1 1 20 LYS CE C 3.550 -5.556 8.418 1.00 . A A . 20 LYS CE 1 1 1 251 1 1 20 LYS CG C 4.171 -3.886 6.645 1.00 . A A . 20 LYS CG 1 1 1 252 1 1 20 LYS H H 4.078 -4.887 3.345 1.00 . A A . 20 LYS H 1 1 1 253 1 1 20 LYS HA H 3.150 -6.106 5.804 1.00 . A A . 20 LYS HA 1 1 1 254 1 1 20 LYS HB2 H 3.398 -3.337 4.746 1.00 . A A . 20 LYS HB2 1 1 1 255 1 1 20 LYS HB3 H 2.174 -3.623 5.976 1.00 . A A . 20 LYS HB3 1 1 1 256 1 1 20 LYS HD2 H 4.175 -3.546 8.749 1.00 . A A . 20 LYS HD2 1 1 1 257 1 1 20 LYS HD3 H 2.567 -3.701 8.038 1.00 . A A . 20 LYS HD3 1 1 1 258 1 1 20 LYS HE2 H 2.758 -6.045 7.871 1.00 . A A . 20 LYS HE2 1 1 1 259 1 1 20 LYS HE3 H 4.498 -6.002 8.154 1.00 . A A . 20 LYS HE3 1 1 1 260 1 1 20 LYS HG2 H 4.915 -4.649 6.471 1.00 . A A . 20 LYS HG2 1 1 1 261 1 1 20 LYS HG3 H 4.634 -2.911 6.598 1.00 . A A . 20 LYS HG3 1 1 1 262 1 1 20 LYS HZ1 H 3.609 -6.695 10.168 1.00 . A A . 20 LYS HZ1 1 1 1 263 1 1 20 LYS HZ2 H 2.308 -5.616 10.096 1.00 . A A . 20 LYS HZ2 1 1 1 264 1 1 20 LYS HZ3 H 3.866 -5.041 10.417 1.00 . A A . 20 LYS HZ3 1 1 1 265 1 1 20 LYS N N 3.784 -5.644 3.895 1.00 . A A . 20 LYS N 1 1 1 266 1 1 20 LYS NZ N 3.317 -5.740 9.877 1.00 . A A . 20 LYS NZ 1 1 1 267 1 1 20 LYS O O 1.120 -5.729 3.452 1.00 . A A . 20 LYS O 1 1 1 268 1 1 21 ALA C C -1.684 -4.723 6.106 1.00 . A A . 21 ALA C 1 1 1 269 1 1 21 ALA CA C -0.867 -5.787 5.383 1.00 . A A . 21 ALA CA 1 1 1 270 1 1 21 ALA CB C -1.307 -7.178 5.814 1.00 . A A . 21 ALA CB 1 1 1 271 1 1 21 ALA H H 0.876 -5.498 6.548 1.00 . A A . 21 ALA H 1 1 1 272 1 1 21 ALA HA H -1.037 -5.696 4.319 1.00 . A A . 21 ALA HA 1 1 1 273 1 1 21 ALA HB1 H -1.196 -7.864 4.987 1.00 . A A . 21 ALA HB1 1 1 1 274 1 1 21 ALA HB2 H -0.696 -7.509 6.641 1.00 . A A . 21 ALA HB2 1 1 1 275 1 1 21 ALA HB3 H -2.342 -7.149 6.120 1.00 . A A . 21 ALA HB3 1 1 1 276 1 1 21 ALA N N 0.559 -5.610 5.628 1.00 . A A . 21 ALA N 1 1 1 277 1 1 21 ALA O O -1.521 -4.511 7.308 1.00 . A A . 21 ALA O 1 1 1 278 1 1 22 PHE C C -4.883 -3.306 5.689 1.00 . A A . 22 PHE C 1 1 1 279 1 1 22 PHE CA C -3.407 -3.012 5.939 1.00 . A A . 22 PHE CA 1 1 1 280 1 1 22 PHE CB C -3.040 -1.649 5.347 1.00 . A A . 22 PHE CB 1 1 1 281 1 1 22 PHE CD1 C -1.247 -0.564 6.727 1.00 . A A . 22 PHE CD1 1 1 1 282 1 1 22 PHE CD2 C -0.626 -1.588 4.665 1.00 . A A . 22 PHE CD2 1 1 1 283 1 1 22 PHE CE1 C 0.069 -0.202 6.947 1.00 . A A . 22 PHE CE1 1 1 1 284 1 1 22 PHE CE2 C 0.692 -1.229 4.880 1.00 . A A . 22 PHE CE2 1 1 1 285 1 1 22 PHE CG C -1.609 -1.259 5.584 1.00 . A A . 22 PHE CG 1 1 1 286 1 1 22 PHE CZ C 1.039 -0.537 6.023 1.00 . A A . 22 PHE CZ 1 1 1 287 1 1 22 PHE H H -2.649 -4.270 4.415 1.00 . A A . 22 PHE H 1 1 1 288 1 1 22 PHE HA H -3.232 -2.991 7.004 1.00 . A A . 22 PHE HA 1 1 1 289 1 1 22 PHE HB2 H -3.204 -1.672 4.280 1.00 . A A . 22 PHE HB2 1 1 1 290 1 1 22 PHE HB3 H -3.670 -0.892 5.788 1.00 . A A . 22 PHE HB3 1 1 1 291 1 1 22 PHE HD1 H -2.005 -0.302 7.451 1.00 . A A . 22 PHE HD1 1 1 1 292 1 1 22 PHE HD2 H -0.897 -2.130 3.770 1.00 . A A . 22 PHE HD2 1 1 1 293 1 1 22 PHE HE1 H 0.338 0.339 7.842 1.00 . A A . 22 PHE HE1 1 1 1 294 1 1 22 PHE HE2 H 1.448 -1.492 4.156 1.00 . A A . 22 PHE HE2 1 1 1 295 1 1 22 PHE HZ H 2.068 -0.255 6.193 1.00 . A A . 22 PHE HZ 1 1 1 296 1 1 22 PHE N N -2.565 -4.056 5.368 1.00 . A A . 22 PHE N 1 1 1 297 1 1 22 PHE O O -5.228 -4.121 4.833 1.00 . A A . 22 PHE O 1 1 1 298 1 1 23 SER C C -7.771 -1.867 5.276 1.00 . A A . 23 SER C 1 1 1 299 1 1 23 SER CA C -7.189 -2.830 6.307 1.00 . A A . 23 SER CA 1 1 1 300 1 1 23 SER CB C -7.882 -2.630 7.657 1.00 . A A . 23 SER CB 1 1 1 301 1 1 23 SER H H -5.413 -2.002 7.108 1.00 . A A . 23 SER H 1 1 1 302 1 1 23 SER HA H -7.358 -3.843 5.972 1.00 . A A . 23 SER HA 1 1 1 303 1 1 23 SER HB2 H -8.951 -2.644 7.515 1.00 . A A . 23 SER HB2 1 1 1 304 1 1 23 SER HB3 H -7.596 -3.429 8.326 1.00 . A A . 23 SER HB3 1 1 1 305 1 1 23 SER HG H -7.875 -0.672 7.716 1.00 . A A . 23 SER HG 1 1 1 306 1 1 23 SER N N -5.750 -2.638 6.443 1.00 . A A . 23 SER N 1 1 1 307 1 1 23 SER O O -8.561 -2.262 4.418 1.00 . A A . 23 SER O 1 1 1 308 1 1 23 SER OG O -7.514 -1.392 8.240 1.00 . A A . 23 SER OG 1 1 1 309 1 1 24 HIS C C -6.842 0.662 3.328 1.00 . A A . 24 HIS C 1 1 1 310 1 1 24 HIS CA C -7.855 0.418 4.443 1.00 . A A . 24 HIS CA 1 1 1 311 1 1 24 HIS CB C -8.133 1.723 5.190 1.00 . A A . 24 HIS CB 1 1 1 312 1 1 24 HIS CD2 C -8.210 4.121 4.205 1.00 . A A . 24 HIS CD2 1 1 1 313 1 1 24 HIS CE1 C -9.818 3.817 2.746 1.00 . A A . 24 HIS CE1 1 1 1 314 1 1 24 HIS CG C -8.609 2.832 4.303 1.00 . A A . 24 HIS CG 1 1 1 315 1 1 24 HIS H H -6.742 -0.349 6.073 1.00 . A A . 24 HIS H 1 1 1 316 1 1 24 HIS HA H -8.775 0.062 4.005 1.00 . A A . 24 HIS HA 1 1 1 317 1 1 24 HIS HB2 H -8.892 1.548 5.938 1.00 . A A . 24 HIS HB2 1 1 1 318 1 1 24 HIS HB3 H -7.225 2.053 5.676 1.00 . A A . 24 HIS HB3 1 1 1 319 1 1 24 HIS HD1 H -10.113 1.845 3.205 1.00 . A A . 24 HIS HD1 1 1 1 320 1 1 24 HIS HD2 H -7.432 4.598 4.786 1.00 . A A . 24 HIS HD2 1 1 1 321 1 1 24 HIS HE1 H -10.545 3.991 1.968 1.00 . A A . 24 HIS HE1 1 1 1 322 1 1 24 HIS N N -7.374 -0.602 5.367 1.00 . A A . 24 HIS N 1 1 1 323 1 1 24 HIS ND1 N -9.618 2.673 3.376 1.00 . A A . 24 HIS ND1 1 1 1 324 1 1 24 HIS NE2 N -8.976 4.712 3.231 1.00 . A A . 24 HIS NE2 1 1 1 325 1 1 24 HIS O O -5.649 0.407 3.493 1.00 . A A . 24 HIS O 1 1 1 326 1 1 25 HIS C C -5.468 2.544 1.379 1.00 . A A . 25 HIS C 1 1 1 327 1 1 25 HIS CA C -6.463 1.435 1.051 1.00 . A A . 25 HIS CA 1 1 1 328 1 1 25 HIS CB C -7.302 1.829 -0.165 1.00 . A A . 25 HIS CB 1 1 1 329 1 1 25 HIS CD2 C -5.261 1.663 -1.757 1.00 . A A . 25 HIS CD2 1 1 1 330 1 1 25 HIS CE1 C -5.991 2.977 -3.353 1.00 . A A . 25 HIS CE1 1 1 1 331 1 1 25 HIS CG C -6.487 2.105 -1.391 1.00 . A A . 25 HIS CG 1 1 1 332 1 1 25 HIS H H -8.286 1.339 2.123 1.00 . A A . 25 HIS H 1 1 1 333 1 1 25 HIS HA H -5.915 0.533 0.822 1.00 . A A . 25 HIS HA 1 1 1 334 1 1 25 HIS HB2 H -7.988 1.028 -0.396 1.00 . A A . 25 HIS HB2 1 1 1 335 1 1 25 HIS HB3 H -7.864 2.722 0.068 1.00 . A A . 25 HIS HB3 1 1 1 336 1 1 25 HIS HD1 H -7.774 3.401 -2.442 1.00 . A A . 25 HIS HD1 1 1 1 337 1 1 25 HIS HD2 H -4.624 0.996 -1.192 1.00 . A A . 25 HIS HD2 1 1 1 338 1 1 25 HIS HE1 H -6.053 3.542 -4.271 1.00 . A A . 25 HIS HE1 1 1 1 339 1 1 25 HIS N N -7.326 1.157 2.193 1.00 . A A . 25 HIS N 1 1 1 340 1 1 25 HIS ND1 N -6.917 2.926 -2.412 1.00 . A A . 25 HIS ND1 1 1 1 341 1 1 25 HIS NE2 N -4.976 2.219 -2.980 1.00 . A A . 25 HIS NE2 1 1 1 342 1 1 25 HIS O O -4.258 2.365 1.246 1.00 . A A . 25 HIS O 1 1 1 343 1 1 26 ALA C C -3.993 4.401 3.059 1.00 . A A . 26 ALA C 1 1 1 344 1 1 26 ALA CA C -5.145 4.827 2.155 1.00 . A A . 26 ALA CA 1 1 1 345 1 1 26 ALA CB C -5.973 5.912 2.829 1.00 . A A . 26 ALA CB 1 1 1 346 1 1 26 ALA H H -6.960 3.772 1.893 1.00 . A A . 26 ALA H 1 1 1 347 1 1 26 ALA HA H -4.739 5.235 1.240 1.00 . A A . 26 ALA HA 1 1 1 348 1 1 26 ALA HB1 H -7.018 5.753 2.610 1.00 . A A . 26 ALA HB1 1 1 1 349 1 1 26 ALA HB2 H -5.817 5.871 3.897 1.00 . A A . 26 ALA HB2 1 1 1 350 1 1 26 ALA HB3 H -5.670 6.879 2.457 1.00 . A A . 26 ALA HB3 1 1 1 351 1 1 26 ALA N N -5.987 3.690 1.807 1.00 . A A . 26 ALA N 1 1 1 352 1 1 26 ALA O O -2.836 4.742 2.810 1.00 . A A . 26 ALA O 1 1 1 353 1 1 27 SER C C -2.068 2.684 4.320 1.00 . A A . 27 SER C 1 1 1 354 1 1 27 SER CA C -3.309 3.185 5.054 1.00 . A A . 27 SER CA 1 1 1 355 1 1 27 SER CB C -3.881 2.070 5.931 1.00 . A A . 27 SER CB 1 1 1 356 1 1 27 SER H H -5.256 3.416 4.255 1.00 . A A . 27 SER H 1 1 1 357 1 1 27 SER HA H -3.029 4.018 5.682 1.00 . A A . 27 SER HA 1 1 1 358 1 1 27 SER HB2 H -4.450 1.389 5.318 1.00 . A A . 27 SER HB2 1 1 1 359 1 1 27 SER HB3 H -3.070 1.537 6.405 1.00 . A A . 27 SER HB3 1 1 1 360 1 1 27 SER HG H -4.206 2.842 7.703 1.00 . A A . 27 SER HG 1 1 1 361 1 1 27 SER N N -4.316 3.654 4.110 1.00 . A A . 27 SER N 1 1 1 362 1 1 27 SER O O -0.954 2.755 4.840 1.00 . A A . 27 SER O 1 1 1 363 1 1 27 SER OG O -4.730 2.597 6.936 1.00 . A A . 27 SER OG 1 1 1 364 1 1 28 LEU C C -0.409 2.803 1.629 1.00 . A A . 28 LEU C 1 1 1 365 1 1 28 LEU CA C -1.169 1.664 2.301 1.00 . A A . 28 LEU CA 1 1 1 366 1 1 28 LEU CB C -1.696 0.693 1.243 1.00 . A A . 28 LEU CB 1 1 1 367 1 1 28 LEU CD1 C 0.214 -0.923 1.095 1.00 . A A . 28 LEU CD1 1 1 1 368 1 1 28 LEU CD2 C -1.313 -0.614 -0.861 1.00 . A A . 28 LEU CD2 1 1 1 369 1 1 28 LEU CG C -0.646 0.066 0.325 1.00 . A A . 28 LEU CG 1 1 1 370 1 1 28 LEU H H -3.180 2.148 2.748 1.00 . A A . 28 LEU H 1 1 1 371 1 1 28 LEU HA H -0.494 1.136 2.959 1.00 . A A . 28 LEU HA 1 1 1 372 1 1 28 LEU HB2 H -2.207 -0.107 1.755 1.00 . A A . 28 LEU HB2 1 1 1 373 1 1 28 LEU HB3 H -2.400 1.230 0.624 1.00 . A A . 28 LEU HB3 1 1 1 374 1 1 28 LEU HD11 H -0.253 -1.146 2.042 1.00 . A A . 28 LEU HD11 1 1 1 375 1 1 28 LEU HD12 H 1.190 -0.493 1.268 1.00 . A A . 28 LEU HD12 1 1 1 376 1 1 28 LEU HD13 H 0.319 -1.832 0.521 1.00 . A A . 28 LEU HD13 1 1 1 377 1 1 28 LEU HD21 H -1.200 -1.685 -0.772 1.00 . A A . 28 LEU HD21 1 1 1 378 1 1 28 LEU HD22 H -0.850 -0.277 -1.776 1.00 . A A . 28 LEU HD22 1 1 1 379 1 1 28 LEU HD23 H -2.364 -0.363 -0.876 1.00 . A A . 28 LEU HD23 1 1 1 380 1 1 28 LEU HG H 0.001 0.845 -0.055 1.00 . A A . 28 LEU HG 1 1 1 381 1 1 28 LEU N N -2.270 2.178 3.109 1.00 . A A . 28 LEU N 1 1 1 382 1 1 28 LEU O O 0.807 2.926 1.777 1.00 . A A . 28 LEU O 1 1 1 383 1 1 29 THR C C 0.168 5.704 1.175 1.00 . A A . 29 THR C 1 1 1 384 1 1 29 THR CA C -0.531 4.767 0.196 1.00 . A A . 29 THR CA 1 1 1 385 1 1 29 THR CB C -1.581 5.565 -0.599 1.00 . A A . 29 THR CB 1 1 1 386 1 1 29 THR CG2 C -2.360 6.497 0.316 1.00 . A A . 29 THR CG2 1 1 1 387 1 1 29 THR H H -2.100 3.487 0.811 1.00 . A A . 29 THR H 1 1 1 388 1 1 29 THR HA H 0.199 4.379 -0.499 1.00 . A A . 29 THR HA 1 1 1 389 1 1 29 THR HB H -2.272 4.869 -1.052 1.00 . A A . 29 THR HB 1 1 1 390 1 1 29 THR HG1 H -0.151 6.741 -1.278 1.00 . A A . 29 THR HG1 1 1 1 391 1 1 29 THR HG21 H -3.418 6.365 0.148 1.00 . A A . 29 THR HG21 1 1 1 392 1 1 29 THR HG22 H -2.087 7.521 0.104 1.00 . A A . 29 THR HG22 1 1 1 393 1 1 29 THR HG23 H -2.127 6.268 1.345 1.00 . A A . 29 THR HG23 1 1 1 394 1 1 29 THR N N -1.135 3.637 0.890 1.00 . A A . 29 THR N 1 1 1 395 1 1 29 THR O O 1.059 6.462 0.793 1.00 . A A . 29 THR O 1 1 1 396 1 1 29 THR OG1 O -0.941 6.325 -1.631 1.00 . A A . 29 THR OG1 1 1 1 397 1 1 30 GLN C C 1.610 5.854 4.040 1.00 . A A . 30 GLN C 1 1 1 398 1 1 30 GLN CA C 0.346 6.490 3.471 1.00 . A A . 30 GLN CA 1 1 1 399 1 1 30 GLN CB C -0.664 6.738 4.593 1.00 . A A . 30 GLN CB 1 1 1 400 1 1 30 GLN CD C -0.557 9.258 4.726 1.00 . A A . 30 GLN CD 1 1 1 401 1 1 30 GLN CG C -0.334 7.947 5.453 1.00 . A A . 30 GLN CG 1 1 1 402 1 1 30 GLN H H -0.957 5.021 2.680 1.00 . A A . 30 GLN H 1 1 1 403 1 1 30 GLN HA H 0.606 7.435 3.019 1.00 . A A . 30 GLN HA 1 1 1 404 1 1 30 GLN HB2 H -1.640 6.889 4.156 1.00 . A A . 30 GLN HB2 1 1 1 405 1 1 30 GLN HB3 H -0.695 5.867 5.231 1.00 . A A . 30 GLN HB3 1 1 1 406 1 1 30 GLN HE21 H 1.256 9.145 3.916 1.00 . A A . 30 GLN HE21 1 1 1 407 1 1 30 GLN HE22 H 0.325 10.535 3.483 1.00 . A A . 30 GLN HE22 1 1 1 408 1 1 30 GLN HG2 H -0.962 7.930 6.332 1.00 . A A . 30 GLN HG2 1 1 1 409 1 1 30 GLN HG3 H 0.702 7.888 5.751 1.00 . A A . 30 GLN HG3 1 1 1 410 1 1 30 GLN N N -0.242 5.646 2.438 1.00 . A A . 30 GLN N 1 1 1 411 1 1 30 GLN NE2 N 0.442 9.691 3.965 1.00 . A A . 30 GLN NE2 1 1 1 412 1 1 30 GLN O O 2.638 6.516 4.187 1.00 . A A . 30 GLN O 1 1 1 413 1 1 30 GLN OE1 O -1.615 9.877 4.846 1.00 . A A . 30 GLN OE1 1 1 1 414 1 1 31 HIS C C 3.858 3.899 3.965 1.00 . A A . 31 HIS C 1 1 1 415 1 1 31 HIS CA C 2.664 3.841 4.912 1.00 . A A . 31 HIS CA 1 1 1 416 1 1 31 HIS CB C 2.284 2.385 5.183 1.00 . A A . 31 HIS CB 1 1 1 417 1 1 31 HIS CD2 C 4.095 0.806 4.206 1.00 . A A . 31 HIS CD2 1 1 1 418 1 1 31 HIS CE1 C 5.098 0.269 6.080 1.00 . A A . 31 HIS CE1 1 1 1 419 1 1 31 HIS CG C 3.458 1.454 5.209 1.00 . A A . 31 HIS CG 1 1 1 420 1 1 31 HIS H H 0.680 4.094 4.219 1.00 . A A . 31 HIS H 1 1 1 421 1 1 31 HIS HA H 2.937 4.312 5.844 1.00 . A A . 31 HIS HA 1 1 1 422 1 1 31 HIS HB2 H 1.790 2.321 6.142 1.00 . A A . 31 HIS HB2 1 1 1 423 1 1 31 HIS HB3 H 1.608 2.046 4.412 1.00 . A A . 31 HIS HB3 1 1 1 424 1 1 31 HIS HD1 H 3.882 1.403 7.272 1.00 . A A . 31 HIS HD1 1 1 1 425 1 1 31 HIS HD2 H 3.852 0.854 3.153 1.00 . A A . 31 HIS HD2 1 1 1 426 1 1 31 HIS HE1 H 5.780 -0.175 6.790 1.00 . A A . 31 HIS HE1 1 1 1 427 1 1 31 HIS N N 1.526 4.567 4.359 1.00 . A A . 31 HIS N 1 1 1 428 1 1 31 HIS ND1 N 4.109 1.096 6.370 1.00 . A A . 31 HIS ND1 1 1 1 429 1 1 31 HIS NE2 N 5.111 0.077 4.773 1.00 . A A . 31 HIS NE2 1 1 1 430 1 1 31 HIS O O 4.986 4.154 4.388 1.00 . A A . 31 HIS O 1 1 1 431 1 1 32 GLN C C 5.679 4.775 1.984 1.00 . A A . 32 GLN C 1 1 1 432 1 1 32 GLN CA C 4.657 3.685 1.676 1.00 . A A . 32 GLN CA 1 1 1 433 1 1 32 GLN CB C 4.060 3.907 0.286 1.00 . A A . 32 GLN CB 1 1 1 434 1 1 32 GLN CD C 3.189 2.734 -1.775 1.00 . A A . 32 GLN CD 1 1 1 435 1 1 32 GLN CG C 3.336 2.691 -0.267 1.00 . A A . 32 GLN CG 1 1 1 436 1 1 32 GLN H H 2.684 3.463 2.407 1.00 . A A . 32 GLN H 1 1 1 437 1 1 32 GLN HA H 5.155 2.727 1.695 1.00 . A A . 32 GLN HA 1 1 1 438 1 1 32 GLN HB2 H 3.358 4.726 0.336 1.00 . A A . 32 GLN HB2 1 1 1 439 1 1 32 GLN HB3 H 4.855 4.167 -0.398 1.00 . A A . 32 GLN HB3 1 1 1 440 1 1 32 GLN HE21 H 3.140 0.748 -1.852 1.00 . A A . 32 GLN HE21 1 1 1 441 1 1 32 GLN HE22 H 3.009 1.562 -3.371 1.00 . A A . 32 GLN HE22 1 1 1 442 1 1 32 GLN HG2 H 3.892 1.804 -0.001 1.00 . A A . 32 GLN HG2 1 1 1 443 1 1 32 GLN HG3 H 2.351 2.643 0.174 1.00 . A A . 32 GLN HG3 1 1 1 444 1 1 32 GLN N N 3.603 3.660 2.682 1.00 . A A . 32 GLN N 1 1 1 445 1 1 32 GLN NE2 N 3.105 1.563 -2.396 1.00 . A A . 32 GLN NE2 1 1 1 446 1 1 32 GLN O O 6.857 4.647 1.651 1.00 . A A . 32 GLN O 1 1 1 447 1 1 32 GLN OE1 O 3.152 3.808 -2.377 1.00 . A A . 32 GLN OE1 1 1 1 448 1 1 33 ARG C C 7.366 6.460 3.647 1.00 . A A . 33 ARG C 1 1 1 449 1 1 33 ARG CA C 6.092 6.960 2.973 1.00 . A A . 33 ARG CA 1 1 1 450 1 1 33 ARG CB C 5.363 7.936 3.898 1.00 . A A . 33 ARG CB 1 1 1 451 1 1 33 ARG CD C 3.920 9.982 4.110 1.00 . A A . 33 ARG CD 1 1 1 452 1 1 33 ARG CG C 4.508 8.953 3.159 1.00 . A A . 33 ARG CG 1 1 1 453 1 1 33 ARG CZ C 4.383 12.204 3.164 1.00 . A A . 33 ARG CZ 1 1 1 454 1 1 33 ARG H H 4.269 5.890 2.860 1.00 . A A . 33 ARG H 1 1 1 455 1 1 33 ARG HA H 6.359 7.473 2.061 1.00 . A A . 33 ARG HA 1 1 1 456 1 1 33 ARG HB2 H 4.721 7.374 4.561 1.00 . A A . 33 ARG HB2 1 1 1 457 1 1 33 ARG HB3 H 6.094 8.471 4.485 1.00 . A A . 33 ARG HB3 1 1 1 458 1 1 33 ARG HD2 H 3.045 9.559 4.581 1.00 . A A . 33 ARG HD2 1 1 1 459 1 1 33 ARG HD3 H 4.656 10.218 4.864 1.00 . A A . 33 ARG HD3 1 1 1 460 1 1 33 ARG HE H 2.606 11.300 3.132 1.00 . A A . 33 ARG HE 1 1 1 461 1 1 33 ARG HG2 H 5.121 9.462 2.429 1.00 . A A . 33 ARG HG2 1 1 1 462 1 1 33 ARG HG3 H 3.703 8.436 2.658 1.00 . A A . 33 ARG HG3 1 1 1 463 1 1 33 ARG HH11 H 5.973 11.294 4.017 1.00 . A A . 33 ARG HH11 1 1 1 464 1 1 33 ARG HH12 H 6.286 12.861 3.346 1.00 . A A . 33 ARG HH12 1 1 1 465 1 1 33 ARG HH21 H 3.006 13.363 2.245 1.00 . A A . 33 ARG HH21 1 1 1 466 1 1 33 ARG HH22 H 4.597 14.037 2.339 1.00 . A A . 33 ARG HH22 1 1 1 467 1 1 33 ARG N N 5.219 5.847 2.621 1.00 . A A . 33 ARG N 1 1 1 468 1 1 33 ARG NE N 3.538 11.211 3.419 1.00 . A A . 33 ARG NE 1 1 1 469 1 1 33 ARG NH1 N 5.651 12.112 3.541 1.00 . A A . 33 ARG NH1 1 1 1 470 1 1 33 ARG NH2 N 3.961 13.290 2.531 1.00 . A A . 33 ARG NH2 1 1 1 471 1 1 33 ARG O O 8.475 6.789 3.225 1.00 . A A . 33 ARG O 1 1 1 472 1 1 34 VAL C C 9.465 4.725 4.481 1.00 . A A . 34 VAL C 1 1 1 473 1 1 34 VAL CA C 8.336 5.115 5.429 1.00 . A A . 34 VAL CA 1 1 1 474 1 1 34 VAL CB C 7.929 3.883 6.259 1.00 . A A . 34 VAL CB 1 1 1 475 1 1 34 VAL CG1 C 6.987 4.285 7.384 1.00 . A A . 34 VAL CG1 1 1 1 476 1 1 34 VAL CG2 C 7.291 2.829 5.368 1.00 . A A . 34 VAL CG2 1 1 1 477 1 1 34 VAL H H 6.292 5.435 4.986 1.00 . A A . 34 VAL H 1 1 1 478 1 1 34 VAL HA H 8.695 5.877 6.106 1.00 . A A . 34 VAL HA 1 1 1 479 1 1 34 VAL HB H 8.820 3.461 6.699 1.00 . A A . 34 VAL HB 1 1 1 480 1 1 34 VAL HG11 H 6.200 3.550 7.473 1.00 . A A . 34 VAL HG11 1 1 1 481 1 1 34 VAL HG12 H 7.537 4.340 8.312 1.00 . A A . 34 VAL HG12 1 1 1 482 1 1 34 VAL HG13 H 6.554 5.249 7.163 1.00 . A A . 34 VAL HG13 1 1 1 483 1 1 34 VAL HG21 H 6.272 2.659 5.683 1.00 . A A . 34 VAL HG21 1 1 1 484 1 1 34 VAL HG22 H 7.299 3.171 4.344 1.00 . A A . 34 VAL HG22 1 1 1 485 1 1 34 VAL HG23 H 7.849 1.907 5.444 1.00 . A A . 34 VAL HG23 1 1 1 486 1 1 34 VAL N N 7.200 5.662 4.697 1.00 . A A . 34 VAL N 1 1 1 487 1 1 34 VAL O O 10.636 4.715 4.863 1.00 . A A . 34 VAL O 1 1 1 488 1 1 35 HIS C C 10.376 5.170 1.282 1.00 . A A . 35 HIS C 1 1 1 489 1 1 35 HIS CA C 10.089 4.016 2.237 1.00 . A A . 35 HIS CA 1 1 1 490 1 1 35 HIS CB C 9.593 2.800 1.453 1.00 . A A . 35 HIS CB 1 1 1 491 1 1 35 HIS CD2 C 7.786 1.164 2.337 1.00 . A A . 35 HIS CD2 1 1 1 492 1 1 35 HIS CE1 C 8.972 0.192 3.904 1.00 . A A . 35 HIS CE1 1 1 1 493 1 1 35 HIS CG C 9.019 1.722 2.319 1.00 . A A . 35 HIS CG 1 1 1 494 1 1 35 HIS H H 8.157 4.433 2.997 1.00 . A A . 35 HIS H 1 1 1 495 1 1 35 HIS HA H 11.001 3.754 2.751 1.00 . A A . 35 HIS HA 1 1 1 496 1 1 35 HIS HB2 H 8.825 3.115 0.762 1.00 . A A . 35 HIS HB2 1 1 1 497 1 1 35 HIS HB3 H 10.418 2.377 0.898 1.00 . A A . 35 HIS HB3 1 1 1 498 1 1 35 HIS HD1 H 10.670 1.277 3.550 1.00 . A A . 35 HIS HD1 1 1 1 499 1 1 35 HIS HD2 H 6.957 1.416 1.690 1.00 . A A . 35 HIS HD2 1 1 1 500 1 1 35 HIS HE1 H 9.267 -0.453 4.718 1.00 . A A . 35 HIS HE1 1 1 1 501 1 1 35 HIS N N 9.106 4.406 3.242 1.00 . A A . 35 HIS N 1 1 1 502 1 1 35 HIS ND1 N 9.737 1.092 3.314 1.00 . A A . 35 HIS ND1 1 1 1 503 1 1 35 HIS NE2 N 7.782 0.216 3.331 1.00 . A A . 35 HIS NE2 1 1 1 504 1 1 35 HIS O O 9.467 5.895 0.878 1.00 . A A . 35 HIS O 1 1 1 505 1 1 36 SER C C 11.398 6.237 -1.347 1.00 . A A . 36 SER C 1 1 1 506 1 1 36 SER CA C 12.054 6.403 0.020 1.00 . A A . 36 SER CA 1 1 1 507 1 1 36 SER CB C 13.576 6.419 -0.130 1.00 . A A . 36 SER CB 1 1 1 508 1 1 36 SER H H 12.325 4.723 1.280 1.00 . A A . 36 SER H 1 1 1 509 1 1 36 SER HA H 11.733 7.340 0.449 1.00 . A A . 36 SER HA 1 1 1 510 1 1 36 SER HB2 H 14.032 6.188 0.820 1.00 . A A . 36 SER HB2 1 1 1 511 1 1 36 SER HB3 H 13.871 5.679 -0.861 1.00 . A A . 36 SER HB3 1 1 1 512 1 1 36 SER HG H 14.531 8.106 0.149 1.00 . A A . 36 SER HG 1 1 1 513 1 1 36 SER N N 11.646 5.334 0.925 1.00 . A A . 36 SER N 1 1 1 514 1 1 36 SER O O 10.756 7.155 -1.856 1.00 . A A . 36 SER O 1 1 1 515 1 1 36 SER OG O 14.032 7.691 -0.558 1.00 . A A . 36 SER OG 1 1 1 516 1 1 37 GLY C C 11.702 5.526 -4.356 1.00 . A A . 37 GLY C 1 1 1 517 1 1 37 GLY CA C 10.984 4.791 -3.241 1.00 . A A . 37 GLY CA 1 1 1 518 1 1 37 GLY H H 12.087 4.362 -1.485 1.00 . A A . 37 GLY H 1 1 1 519 1 1 37 GLY HA2 H 11.032 3.730 -3.434 1.00 . A A . 37 GLY HA2 1 1 1 520 1 1 37 GLY HA3 H 9.949 5.099 -3.231 1.00 . A A . 37 GLY HA3 1 1 1 521 1 1 37 GLY N N 11.565 5.057 -1.938 1.00 . A A . 37 GLY N 1 1 1 522 1 1 37 GLY O O 12.446 6.473 -4.105 1.00 . A A . 37 GLY O 1 1 1 523 1 1 38 GLU C C 11.176 6.721 -7.402 1.00 . A A . 38 GLU C 1 1 1 524 1 1 38 GLU CA C 12.112 5.708 -6.748 1.00 . A A . 38 GLU CA 1 1 1 525 1 1 38 GLU CB C 12.521 4.643 -7.767 1.00 . A A . 38 GLU CB 1 1 1 526 1 1 38 GLU CD C 13.558 2.681 -6.560 1.00 . A A . 38 GLU CD 1 1 1 527 1 1 38 GLU CG C 13.805 3.916 -7.405 1.00 . A A . 38 GLU CG 1 1 1 528 1 1 38 GLU H H 10.875 4.327 -5.727 1.00 . A A . 38 GLU H 1 1 1 529 1 1 38 GLU HA H 12.997 6.223 -6.405 1.00 . A A . 38 GLU HA 1 1 1 530 1 1 38 GLU HB2 H 11.728 3.914 -7.846 1.00 . A A . 38 GLU HB2 1 1 1 531 1 1 38 GLU HB3 H 12.659 5.116 -8.728 1.00 . A A . 38 GLU HB3 1 1 1 532 1 1 38 GLU HG2 H 14.303 3.616 -8.315 1.00 . A A . 38 GLU HG2 1 1 1 533 1 1 38 GLU HG3 H 14.443 4.590 -6.853 1.00 . A A . 38 GLU HG3 1 1 1 534 1 1 38 GLU N N 11.479 5.087 -5.591 1.00 . A A . 38 GLU N 1 1 1 535 1 1 38 GLU O O 10.515 6.420 -8.397 1.00 . A A . 38 GLU O 1 1 1 536 1 1 38 GLU OE1 O 12.578 2.678 -5.786 1.00 . A A . 38 GLU OE1 1 1 1 537 1 1 38 GLU OE2 O 14.345 1.718 -6.673 1.00 . A A . 38 GLU OE2 1 1 1 538 1 1 39 LYS C C 10.991 10.325 -7.331 1.00 . A A . 39 LYS C 1 1 1 539 1 1 39 LYS CA C 10.272 8.981 -7.363 1.00 . A A . 39 LYS CA 1 1 1 540 1 1 39 LYS CB C 8.973 9.065 -6.558 1.00 . A A . 39 LYS CB 1 1 1 541 1 1 39 LYS CD C 7.399 7.879 -8.115 1.00 . A A . 39 LYS CD 1 1 1 542 1 1 39 LYS CE C 6.535 6.645 -8.328 1.00 . A A . 39 LYS CE 1 1 1 543 1 1 39 LYS CG C 8.061 7.866 -6.747 1.00 . A A . 39 LYS CG 1 1 1 544 1 1 39 LYS H H 11.676 8.101 -6.046 1.00 . A A . 39 LYS H 1 1 1 545 1 1 39 LYS HA H 10.035 8.737 -8.388 1.00 . A A . 39 LYS HA 1 1 1 546 1 1 39 LYS HB2 H 9.219 9.143 -5.509 1.00 . A A . 39 LYS HB2 1 1 1 547 1 1 39 LYS HB3 H 8.434 9.952 -6.859 1.00 . A A . 39 LYS HB3 1 1 1 548 1 1 39 LYS HD2 H 6.776 8.758 -8.195 1.00 . A A . 39 LYS HD2 1 1 1 549 1 1 39 LYS HD3 H 8.165 7.907 -8.876 1.00 . A A . 39 LYS HD3 1 1 1 550 1 1 39 LYS HE2 H 6.352 6.528 -9.385 1.00 . A A . 39 LYS HE2 1 1 1 551 1 1 39 LYS HE3 H 7.068 5.781 -7.957 1.00 . A A . 39 LYS HE3 1 1 1 552 1 1 39 LYS HG2 H 8.645 6.962 -6.651 1.00 . A A . 39 LYS HG2 1 1 1 553 1 1 39 LYS HG3 H 7.294 7.884 -5.986 1.00 . A A . 39 LYS HG3 1 1 1 554 1 1 39 LYS HZ1 H 5.240 6.161 -6.762 1.00 . A A . 39 LYS HZ1 1 1 1 555 1 1 39 LYS HZ2 H 4.459 6.432 -8.239 1.00 . A A . 39 LYS HZ2 1 1 1 556 1 1 39 LYS HZ3 H 5.053 7.738 -7.343 1.00 . A A . 39 LYS HZ3 1 1 1 557 1 1 39 LYS N N 11.125 7.922 -6.837 1.00 . A A . 39 LYS N 1 1 1 558 1 1 39 LYS NZ N 5.231 6.751 -7.618 1.00 . A A . 39 LYS NZ 1 1 1 559 1 1 39 LYS O O 11.760 10.624 -6.417 1.00 . A A . 39 LYS O 1 1 1 560 1 1 40 PRO C C 10.820 13.456 -7.408 1.00 . A A . 40 PRO C 1 1 1 561 1 1 40 PRO CA C 11.347 12.486 -8.461 1.00 . A A . 40 PRO CA 1 1 1 562 1 1 40 PRO CB C 10.942 12.948 -9.863 1.00 . A A . 40 PRO CB 1 1 1 563 1 1 40 PRO CD C 9.829 10.869 -9.475 1.00 . A A . 40 PRO CD 1 1 1 564 1 1 40 PRO CG C 9.690 12.199 -10.162 1.00 . A A . 40 PRO CG 1 1 1 565 1 1 40 PRO HA H 12.424 12.434 -8.394 1.00 . A A . 40 PRO HA 1 1 1 566 1 1 40 PRO HB2 H 10.774 14.016 -9.858 1.00 . A A . 40 PRO HB2 1 1 1 567 1 1 40 PRO HB3 H 11.725 12.705 -10.566 1.00 . A A . 40 PRO HB3 1 1 1 568 1 1 40 PRO HD2 H 8.869 10.526 -9.118 1.00 . A A . 40 PRO HD2 1 1 1 569 1 1 40 PRO HD3 H 10.266 10.142 -10.144 1.00 . A A . 40 PRO HD3 1 1 1 570 1 1 40 PRO HG2 H 8.839 12.736 -9.772 1.00 . A A . 40 PRO HG2 1 1 1 571 1 1 40 PRO HG3 H 9.591 12.061 -11.229 1.00 . A A . 40 PRO HG3 1 1 1 572 1 1 40 PRO N N 10.735 11.159 -8.351 1.00 . A A . 40 PRO N 1 1 1 573 1 1 40 PRO O O 9.812 13.190 -6.754 1.00 . A A . 40 PRO O 1 1 1 574 1 1 41 SER C C 9.800 16.253 -6.680 1.00 . A A . 41 SER C 1 1 1 575 1 1 41 SER CA C 11.113 15.590 -6.274 1.00 . A A . 41 SER CA 1 1 1 576 1 1 41 SER CB C 12.208 16.648 -6.128 1.00 . A A . 41 SER CB 1 1 1 577 1 1 41 SER H H 12.305 14.736 -7.801 1.00 . A A . 41 SER H 1 1 1 578 1 1 41 SER HA H 10.973 15.095 -5.324 1.00 . A A . 41 SER HA 1 1 1 579 1 1 41 SER HB2 H 13.133 16.168 -5.844 1.00 . A A . 41 SER HB2 1 1 1 580 1 1 41 SER HB3 H 12.341 17.156 -7.072 1.00 . A A . 41 SER HB3 1 1 1 581 1 1 41 SER HG H 12.588 17.686 -4.511 1.00 . A A . 41 SER HG 1 1 1 582 1 1 41 SER N N 11.509 14.581 -7.250 1.00 . A A . 41 SER N 1 1 1 583 1 1 41 SER O O 9.646 16.706 -7.814 1.00 . A A . 41 SER O 1 1 1 584 1 1 41 SER OG O 11.866 17.603 -5.138 1.00 . A A . 41 SER OG 1 1 1 585 1 1 42 GLY C C 7.397 18.250 -5.330 1.00 . A A . 42 GLY C 1 1 1 586 1 1 42 GLY CA C 7.569 16.914 -6.025 1.00 . A A . 42 GLY CA 1 1 1 587 1 1 42 GLY H H 9.035 15.927 -4.859 1.00 . A A . 42 GLY H 1 1 1 588 1 1 42 GLY HA2 H 7.475 17.059 -7.090 1.00 . A A . 42 GLY HA2 1 1 1 589 1 1 42 GLY HA3 H 6.788 16.246 -5.692 1.00 . A A . 42 GLY HA3 1 1 1 590 1 1 42 GLY N N 8.856 16.305 -5.745 1.00 . A A . 42 GLY N 1 1 1 591 1 1 42 GLY O O 8.335 18.800 -4.754 1.00 . A A . 42 GLY O 1 1 1 592 1 1 43 PRO C C 5.862 20.008 -3.235 1.00 . A A . 43 PRO C 1 1 1 593 1 1 43 PRO CA C 5.851 20.082 -4.758 1.00 . A A . 43 PRO CA 1 1 1 594 1 1 43 PRO CB C 4.439 20.382 -5.269 1.00 . A A . 43 PRO CB 1 1 1 595 1 1 43 PRO CD C 5.005 18.194 -6.050 1.00 . A A . 43 PRO CD 1 1 1 596 1 1 43 PRO CG C 3.858 19.046 -5.581 1.00 . A A . 43 PRO CG 1 1 1 597 1 1 43 PRO HA H 6.526 20.860 -5.084 1.00 . A A . 43 PRO HA 1 1 1 598 1 1 43 PRO HB2 H 3.875 20.889 -4.499 1.00 . A A . 43 PRO HB2 1 1 1 599 1 1 43 PRO HB3 H 4.496 21.003 -6.150 1.00 . A A . 43 PRO HB3 1 1 1 600 1 1 43 PRO HD2 H 4.867 17.170 -5.739 1.00 . A A . 43 PRO HD2 1 1 1 601 1 1 43 PRO HD3 H 5.105 18.254 -7.124 1.00 . A A . 43 PRO HD3 1 1 1 602 1 1 43 PRO HG2 H 3.415 18.622 -4.693 1.00 . A A . 43 PRO HG2 1 1 1 603 1 1 43 PRO HG3 H 3.119 19.141 -6.362 1.00 . A A . 43 PRO HG3 1 1 1 604 1 1 43 PRO N N 6.172 18.794 -5.381 1.00 . A A . 43 PRO N 1 1 1 605 1 1 43 PRO O O 4.895 19.557 -2.619 1.00 . A A . 43 PRO O 1 1 1 606 1 1 44 SER C C 5.901 21.104 -0.513 1.00 . A A . 44 SER C 1 1 1 607 1 1 44 SER CA C 7.097 20.433 -1.181 1.00 . A A . 44 SER CA 1 1 1 608 1 1 44 SER CB C 8.390 21.135 -0.761 1.00 . A A . 44 SER CB 1 1 1 609 1 1 44 SER H H 7.697 20.800 -3.178 1.00 . A A . 44 SER H 1 1 1 610 1 1 44 SER HA H 7.139 19.401 -0.866 1.00 . A A . 44 SER HA 1 1 1 611 1 1 44 SER HB2 H 8.417 21.220 0.315 1.00 . A A . 44 SER HB2 1 1 1 612 1 1 44 SER HB3 H 9.237 20.555 -1.097 1.00 . A A . 44 SER HB3 1 1 1 613 1 1 44 SER HG H 8.995 22.401 -2.128 1.00 . A A . 44 SER HG 1 1 1 614 1 1 44 SER N N 6.960 20.453 -2.633 1.00 . A A . 44 SER N 1 1 1 615 1 1 44 SER O O 5.289 22.011 -1.077 1.00 . A A . 44 SER O 1 1 1 616 1 1 44 SER OG O 8.472 22.433 -1.323 1.00 . A A . 44 SER OG 1 1 1 617 1 1 45 SER C C 4.842 22.497 2.138 1.00 . A A . 45 SER C 1 1 1 618 1 1 45 SER CA C 4.446 21.202 1.436 1.00 . A A . 45 SER CA 1 1 1 619 1 1 45 SER CB C 3.940 20.187 2.463 1.00 . A A . 45 SER CB 1 1 1 620 1 1 45 SER H H 6.098 19.923 1.088 1.00 . A A . 45 SER H 1 1 1 621 1 1 45 SER HA H 3.656 21.414 0.732 1.00 . A A . 45 SER HA 1 1 1 622 1 1 45 SER HB2 H 4.107 19.188 2.091 1.00 . A A . 45 SER HB2 1 1 1 623 1 1 45 SER HB3 H 4.477 20.320 3.392 1.00 . A A . 45 SER HB3 1 1 1 624 1 1 45 SER HG H 2.384 21.266 2.967 1.00 . A A . 45 SER HG 1 1 1 625 1 1 45 SER N N 5.572 20.649 0.692 1.00 . A A . 45 SER N 1 1 1 626 1 1 45 SER O O 6.021 22.748 2.384 1.00 . A A . 45 SER O 1 1 1 627 1 1 45 SER OG O 2.555 20.357 2.708 1.00 . A A . 45 SER OG 1 1 1 628 1 1 46 GLY C C 3.299 25.722 2.549 1.00 . A A . 46 GLY C 1 1 1 629 1 1 46 GLY CA C 4.110 24.579 3.126 1.00 . A A . 46 GLY CA 1 1 1 630 1 1 46 GLY H H 2.925 23.066 2.236 1.00 . A A . 46 GLY H 1 1 1 631 1 1 46 GLY HA2 H 3.871 24.474 4.174 1.00 . A A . 46 GLY HA2 1 1 1 632 1 1 46 GLY HA3 H 5.160 24.813 3.028 1.00 . A A . 46 GLY HA3 1 1 1 633 1 1 46 GLY N N 3.846 23.318 2.457 1.00 . A A . 46 GLY N 1 1 1 634 1 1 46 GLY O O 2.884 25.639 1.394 1.00 . A A . 46 GLY O 1 1 1 635 2 2 1 ZN ZN ZN 6.369 -1.063 3.590 1.00 . B A . 181 ZN ZN 1 1 2 636 1 1 1 GLY C C 11.930 -20.881 -5.683 1.00 . A A . 1 GLY C 1 1 2 637 1 1 1 GLY CA C 12.278 -22.352 -5.796 1.00 . A A . 1 GLY CA 1 1 2 638 1 1 1 GLY H1 H 10.454 -22.833 -4.834 1.00 . A A . 1 GLY H1 1 1 2 639 1 1 1 GLY HA2 H 13.253 -22.515 -5.360 1.00 . A A . 1 GLY HA2 1 1 2 640 1 1 1 GLY HA3 H 12.312 -22.623 -6.841 1.00 . A A . 1 GLY HA3 1 1 2 641 1 1 1 GLY N N 11.315 -23.203 -5.123 1.00 . A A . 1 GLY N 1 1 2 642 1 1 1 GLY O O 12.686 -20.100 -5.106 1.00 . A A . 1 GLY O 1 1 2 643 1 1 2 SER C C 8.849 -19.011 -6.514 1.00 . A A . 2 SER C 1 1 2 644 1 1 2 SER CA C 10.339 -19.113 -6.202 1.00 . A A . 2 SER CA 1 1 2 645 1 1 2 SER CB C 11.140 -18.274 -7.199 1.00 . A A . 2 SER CB 1 1 2 646 1 1 2 SER H H 10.224 -21.172 -6.683 1.00 . A A . 2 SER H 1 1 2 647 1 1 2 SER HA H 10.513 -18.735 -5.205 1.00 . A A . 2 SER HA 1 1 2 648 1 1 2 SER HB2 H 10.876 -17.234 -7.083 1.00 . A A . 2 SER HB2 1 1 2 649 1 1 2 SER HB3 H 12.195 -18.401 -7.007 1.00 . A A . 2 SER HB3 1 1 2 650 1 1 2 SER HG H 10.580 -19.585 -8.543 1.00 . A A . 2 SER HG 1 1 2 651 1 1 2 SER N N 10.783 -20.502 -6.237 1.00 . A A . 2 SER N 1 1 2 652 1 1 2 SER O O 8.365 -19.597 -7.483 1.00 . A A . 2 SER O 1 1 2 653 1 1 2 SER OG O 10.867 -18.669 -8.532 1.00 . A A . 2 SER OG 1 1 2 654 1 1 3 SER C C 6.300 -16.620 -5.714 1.00 . A A . 3 SER C 1 1 2 655 1 1 3 SER CA C 6.692 -18.086 -5.871 1.00 . A A . 3 SER CA 1 1 2 656 1 1 3 SER CB C 5.918 -18.942 -4.866 1.00 . A A . 3 SER CB 1 1 2 657 1 1 3 SER H H 8.571 -17.821 -4.932 1.00 . A A . 3 SER H 1 1 2 658 1 1 3 SER HA H 6.444 -18.408 -6.871 1.00 . A A . 3 SER HA 1 1 2 659 1 1 3 SER HB2 H 4.870 -18.688 -4.913 1.00 . A A . 3 SER HB2 1 1 2 660 1 1 3 SER HB3 H 6.047 -19.986 -5.112 1.00 . A A . 3 SER HB3 1 1 2 661 1 1 3 SER HG H 5.734 -19.055 -2.919 1.00 . A A . 3 SER HG 1 1 2 662 1 1 3 SER N N 8.127 -18.263 -5.686 1.00 . A A . 3 SER N 1 1 2 663 1 1 3 SER O O 6.999 -15.845 -5.062 1.00 . A A . 3 SER O 1 1 2 664 1 1 3 SER OG O 6.382 -18.723 -3.545 1.00 . A A . 3 SER OG 1 1 2 665 1 1 4 GLY C C 3.375 -14.673 -6.924 1.00 . A A . 4 GLY C 1 1 2 666 1 1 4 GLY CA C 4.711 -14.874 -6.237 1.00 . A A . 4 GLY CA 1 1 2 667 1 1 4 GLY H H 4.660 -16.907 -6.827 1.00 . A A . 4 GLY H 1 1 2 668 1 1 4 GLY HA2 H 4.614 -14.600 -5.197 1.00 . A A . 4 GLY HA2 1 1 2 669 1 1 4 GLY HA3 H 5.442 -14.229 -6.702 1.00 . A A . 4 GLY HA3 1 1 2 670 1 1 4 GLY N N 5.177 -16.246 -6.320 1.00 . A A . 4 GLY N 1 1 2 671 1 1 4 GLY O O 3.278 -13.932 -7.902 1.00 . A A . 4 GLY O 1 1 2 672 1 1 5 SER C C -0.006 -14.798 -5.931 1.00 . A A . 5 SER C 1 1 2 673 1 1 5 SER CA C 1.006 -15.230 -6.987 1.00 . A A . 5 SER CA 1 1 2 674 1 1 5 SER CB C 0.584 -16.568 -7.597 1.00 . A A . 5 SER CB 1 1 2 675 1 1 5 SER H H 2.484 -15.911 -5.632 1.00 . A A . 5 SER H 1 1 2 676 1 1 5 SER HA H 1.038 -14.483 -7.766 1.00 . A A . 5 SER HA 1 1 2 677 1 1 5 SER HB2 H 1.390 -16.957 -8.200 1.00 . A A . 5 SER HB2 1 1 2 678 1 1 5 SER HB3 H 0.358 -17.267 -6.804 1.00 . A A . 5 SER HB3 1 1 2 679 1 1 5 SER HG H -1.158 -17.158 -8.272 1.00 . A A . 5 SER HG 1 1 2 680 1 1 5 SER N N 2.343 -15.336 -6.413 1.00 . A A . 5 SER N 1 1 2 681 1 1 5 SER O O -0.309 -15.546 -5.001 1.00 . A A . 5 SER O 1 1 2 682 1 1 5 SER OG O -0.565 -16.416 -8.413 1.00 . A A . 5 SER OG 1 1 2 683 1 1 6 SER C C -2.905 -13.068 -5.741 1.00 . A A . 6 SER C 1 1 2 684 1 1 6 SER CA C -1.503 -13.049 -5.140 1.00 . A A . 6 SER CA 1 1 2 685 1 1 6 SER CB C -1.127 -11.620 -4.740 1.00 . A A . 6 SER CB 1 1 2 686 1 1 6 SER H H -0.246 -13.035 -6.844 1.00 . A A . 6 SER H 1 1 2 687 1 1 6 SER HA H -1.492 -13.674 -4.260 1.00 . A A . 6 SER HA 1 1 2 688 1 1 6 SER HB2 H -0.803 -11.078 -5.615 1.00 . A A . 6 SER HB2 1 1 2 689 1 1 6 SER HB3 H -1.990 -11.131 -4.312 1.00 . A A . 6 SER HB3 1 1 2 690 1 1 6 SER HG H -0.319 -11.052 -3.049 1.00 . A A . 6 SER HG 1 1 2 691 1 1 6 SER N N -0.527 -13.584 -6.082 1.00 . A A . 6 SER N 1 1 2 692 1 1 6 SER O O -3.372 -12.071 -6.288 1.00 . A A . 6 SER O 1 1 2 693 1 1 6 SER OG O -0.079 -11.617 -3.787 1.00 . A A . 6 SER OG 1 1 2 694 1 1 7 GLY C C -5.977 -13.892 -5.189 1.00 . A A . 7 GLY C 1 1 2 695 1 1 7 GLY CA C -4.914 -14.344 -6.171 1.00 . A A . 7 GLY CA 1 1 2 696 1 1 7 GLY H H -3.149 -14.977 -5.187 1.00 . A A . 7 GLY H 1 1 2 697 1 1 7 GLY HA2 H -4.990 -13.748 -7.068 1.00 . A A . 7 GLY HA2 1 1 2 698 1 1 7 GLY HA3 H -5.090 -15.379 -6.422 1.00 . A A . 7 GLY HA3 1 1 2 699 1 1 7 GLY N N -3.572 -14.214 -5.634 1.00 . A A . 7 GLY N 1 1 2 700 1 1 7 GLY O O -6.006 -12.729 -4.784 1.00 . A A . 7 GLY O 1 1 2 701 1 1 8 THR C C -7.371 -14.127 -2.500 1.00 . A A . 8 THR C 1 1 2 702 1 1 8 THR CA C -7.928 -14.503 -3.868 1.00 . A A . 8 THR CA 1 1 2 703 1 1 8 THR CB C -8.895 -15.691 -3.707 1.00 . A A . 8 THR CB 1 1 2 704 1 1 8 THR CG2 C -8.208 -16.857 -3.011 1.00 . A A . 8 THR CG2 1 1 2 705 1 1 8 THR H H -6.781 -15.722 -5.164 1.00 . A A . 8 THR H 1 1 2 706 1 1 8 THR HA H -8.484 -13.665 -4.263 1.00 . A A . 8 THR HA 1 1 2 707 1 1 8 THR HB H -9.212 -16.014 -4.689 1.00 . A A . 8 THR HB 1 1 2 708 1 1 8 THR HG1 H -9.819 -15.253 -2.021 1.00 . A A . 8 THR HG1 1 1 2 709 1 1 8 THR HG21 H -7.142 -16.689 -2.997 1.00 . A A . 8 THR HG21 1 1 2 710 1 1 8 THR HG22 H -8.422 -17.771 -3.545 1.00 . A A . 8 THR HG22 1 1 2 711 1 1 8 THR HG23 H -8.574 -16.937 -1.998 1.00 . A A . 8 THR HG23 1 1 2 712 1 1 8 THR N N -6.857 -14.813 -4.806 1.00 . A A . 8 THR N 1 1 2 713 1 1 8 THR O O -6.313 -14.608 -2.097 1.00 . A A . 8 THR O 1 1 2 714 1 1 8 THR OG1 O -10.044 -15.289 -2.954 1.00 . A A . 8 THR OG1 1 1 2 715 1 1 9 GLY C C -8.518 -11.734 0.098 1.00 . A A . 9 GLY C 1 1 2 716 1 1 9 GLY CA C -7.651 -12.838 -0.474 1.00 . A A . 9 GLY CA 1 1 2 717 1 1 9 GLY H H -8.927 -12.913 -2.162 1.00 . A A . 9 GLY H 1 1 2 718 1 1 9 GLY HA2 H -7.679 -13.686 0.195 1.00 . A A . 9 GLY HA2 1 1 2 719 1 1 9 GLY HA3 H -6.634 -12.482 -0.544 1.00 . A A . 9 GLY HA3 1 1 2 720 1 1 9 GLY N N -8.091 -13.264 -1.790 1.00 . A A . 9 GLY N 1 1 2 721 1 1 9 GLY O O -9.438 -11.254 -0.563 1.00 . A A . 9 GLY O 1 1 2 722 1 1 10 GLU C C -8.185 -8.982 2.051 1.00 . A A . 10 GLU C 1 1 2 723 1 1 10 GLU CA C -8.987 -10.279 1.992 1.00 . A A . 10 GLU CA 1 1 2 724 1 1 10 GLU CB C -9.381 -10.714 3.405 1.00 . A A . 10 GLU CB 1 1 2 725 1 1 10 GLU CD C -10.785 -10.163 5.431 1.00 . A A . 10 GLU CD 1 1 2 726 1 1 10 GLU CG C -10.072 -9.624 4.207 1.00 . A A . 10 GLU CG 1 1 2 727 1 1 10 GLU H H -7.480 -11.754 1.807 1.00 . A A . 10 GLU H 1 1 2 728 1 1 10 GLU HA H -9.884 -10.107 1.415 1.00 . A A . 10 GLU HA 1 1 2 729 1 1 10 GLU HB2 H -10.049 -11.560 3.336 1.00 . A A . 10 GLU HB2 1 1 2 730 1 1 10 GLU HB3 H -8.490 -11.013 3.937 1.00 . A A . 10 GLU HB3 1 1 2 731 1 1 10 GLU HG2 H -9.331 -8.906 4.528 1.00 . A A . 10 GLU HG2 1 1 2 732 1 1 10 GLU HG3 H -10.796 -9.132 3.574 1.00 . A A . 10 GLU HG3 1 1 2 733 1 1 10 GLU N N -8.225 -11.332 1.331 1.00 . A A . 10 GLU N 1 1 2 734 1 1 10 GLU O O -8.750 -7.893 2.149 1.00 . A A . 10 GLU O 1 1 2 735 1 1 10 GLU OE1 O -10.104 -10.722 6.316 1.00 . A A . 10 GLU OE1 1 1 2 736 1 1 10 GLU OE2 O -12.024 -10.027 5.505 1.00 . A A . 10 GLU OE2 1 1 2 737 1 1 11 LYS C C -5.296 -7.732 0.694 1.00 . A A . 11 LYS C 1 1 2 738 1 1 11 LYS CA C -5.982 -7.948 2.039 1.00 . A A . 11 LYS CA 1 1 2 739 1 1 11 LYS CB C -4.930 -8.125 3.136 1.00 . A A . 11 LYS CB 1 1 2 740 1 1 11 LYS CD C -4.573 -8.791 5.532 1.00 . A A . 11 LYS CD 1 1 2 741 1 1 11 LYS CE C -5.175 -8.829 6.929 1.00 . A A . 11 LYS CE 1 1 2 742 1 1 11 LYS CG C -5.509 -8.121 4.540 1.00 . A A . 11 LYS CG 1 1 2 743 1 1 11 LYS H H -6.472 -10.004 1.915 1.00 . A A . 11 LYS H 1 1 2 744 1 1 11 LYS HA H -6.584 -7.082 2.266 1.00 . A A . 11 LYS HA 1 1 2 745 1 1 11 LYS HB2 H -4.421 -9.065 2.982 1.00 . A A . 11 LYS HB2 1 1 2 746 1 1 11 LYS HB3 H -4.212 -7.321 3.064 1.00 . A A . 11 LYS HB3 1 1 2 747 1 1 11 LYS HD2 H -4.382 -9.803 5.207 1.00 . A A . 11 LYS HD2 1 1 2 748 1 1 11 LYS HD3 H -3.644 -8.240 5.565 1.00 . A A . 11 LYS HD3 1 1 2 749 1 1 11 LYS HE2 H -6.220 -9.086 6.849 1.00 . A A . 11 LYS HE2 1 1 2 750 1 1 11 LYS HE3 H -4.662 -9.584 7.507 1.00 . A A . 11 LYS HE3 1 1 2 751 1 1 11 LYS HG2 H -5.673 -7.099 4.850 1.00 . A A . 11 LYS HG2 1 1 2 752 1 1 11 LYS HG3 H -6.451 -8.651 4.533 1.00 . A A . 11 LYS HG3 1 1 2 753 1 1 11 LYS HZ1 H -5.644 -6.806 7.153 1.00 . A A . 11 LYS HZ1 1 1 2 754 1 1 11 LYS HZ2 H -4.060 -7.196 7.602 1.00 . A A . 11 LYS HZ2 1 1 2 755 1 1 11 LYS HZ3 H -5.352 -7.607 8.614 1.00 . A A . 11 LYS HZ3 1 1 2 756 1 1 11 LYS N N -6.864 -9.108 1.992 1.00 . A A . 11 LYS N 1 1 2 757 1 1 11 LYS NZ N -5.050 -7.518 7.623 1.00 . A A . 11 LYS NZ 1 1 2 758 1 1 11 LYS O O -4.144 -8.116 0.488 1.00 . A A . 11 LYS O 1 1 2 759 1 1 12 PRO C C -4.406 -5.754 -1.571 1.00 . A A . 12 PRO C 1 1 2 760 1 1 12 PRO CA C -5.498 -6.817 -1.586 1.00 . A A . 12 PRO CA 1 1 2 761 1 1 12 PRO CB C -6.728 -6.311 -2.343 1.00 . A A . 12 PRO CB 1 1 2 762 1 1 12 PRO CD C -7.397 -6.615 -0.069 1.00 . A A . 12 PRO CD 1 1 2 763 1 1 12 PRO CG C -7.624 -5.764 -1.287 1.00 . A A . 12 PRO CG 1 1 2 764 1 1 12 PRO HA H -5.122 -7.711 -2.063 1.00 . A A . 12 PRO HA 1 1 2 765 1 1 12 PRO HB2 H -6.431 -5.545 -3.046 1.00 . A A . 12 PRO HB2 1 1 2 766 1 1 12 PRO HB3 H -7.193 -7.130 -2.870 1.00 . A A . 12 PRO HB3 1 1 2 767 1 1 12 PRO HD2 H -7.485 -6.021 0.829 1.00 . A A . 12 PRO HD2 1 1 2 768 1 1 12 PRO HD3 H -8.095 -7.439 -0.048 1.00 . A A . 12 PRO HD3 1 1 2 769 1 1 12 PRO HG2 H -7.365 -4.737 -1.080 1.00 . A A . 12 PRO HG2 1 1 2 770 1 1 12 PRO HG3 H -8.654 -5.835 -1.606 1.00 . A A . 12 PRO HG3 1 1 2 771 1 1 12 PRO N N -6.018 -7.101 -0.245 1.00 . A A . 12 PRO N 1 1 2 772 1 1 12 PRO O O -3.893 -5.362 -2.620 1.00 . A A . 12 PRO O 1 1 2 773 1 1 13 TYR C C -1.780 -4.845 0.444 1.00 . A A . 13 TYR C 1 1 2 774 1 1 13 TYR CA C -3.024 -4.269 -0.227 1.00 . A A . 13 TYR CA 1 1 2 775 1 1 13 TYR CB C -3.558 -3.092 0.591 1.00 . A A . 13 TYR CB 1 1 2 776 1 1 13 TYR CD1 C -6.081 -3.038 0.507 1.00 . A A . 13 TYR CD1 1 1 2 777 1 1 13 TYR CD2 C -4.878 -1.505 -0.865 1.00 . A A . 13 TYR CD2 1 1 2 778 1 1 13 TYR CE1 C -7.276 -2.533 0.032 1.00 . A A . 13 TYR CE1 1 1 2 779 1 1 13 TYR CE2 C -6.068 -0.993 -1.344 1.00 . A A . 13 TYR CE2 1 1 2 780 1 1 13 TYR CG C -4.863 -2.534 0.068 1.00 . A A . 13 TYR CG 1 1 2 781 1 1 13 TYR CZ C -7.264 -1.510 -0.893 1.00 . A A . 13 TYR CZ 1 1 2 782 1 1 13 TYR H H -4.499 -5.640 0.422 1.00 . A A . 13 TYR H 1 1 2 783 1 1 13 TYR HA H -2.758 -3.919 -1.213 1.00 . A A . 13 TYR HA 1 1 2 784 1 1 13 TYR HB2 H -3.719 -3.412 1.608 1.00 . A A . 13 TYR HB2 1 1 2 785 1 1 13 TYR HB3 H -2.829 -2.295 0.580 1.00 . A A . 13 TYR HB3 1 1 2 786 1 1 13 TYR HD1 H -6.088 -3.840 1.231 1.00 . A A . 13 TYR HD1 1 1 2 787 1 1 13 TYR HD2 H -3.939 -1.102 -1.216 1.00 . A A . 13 TYR HD2 1 1 2 788 1 1 13 TYR HE1 H -8.213 -2.938 0.385 1.00 . A A . 13 TYR HE1 1 1 2 789 1 1 13 TYR HE2 H -6.058 -0.192 -2.069 1.00 . A A . 13 TYR HE2 1 1 2 790 1 1 13 TYR HH H -8.286 -0.503 -2.172 1.00 . A A . 13 TYR HH 1 1 2 791 1 1 13 TYR N N -4.054 -5.290 -0.377 1.00 . A A . 13 TYR N 1 1 2 792 1 1 13 TYR O O -1.863 -5.456 1.508 1.00 . A A . 13 TYR O 1 1 2 793 1 1 13 TYR OH O -8.451 -1.003 -1.370 1.00 . A A . 13 TYR OH 1 1 2 794 1 1 14 GLU C C 1.793 -4.241 -0.064 1.00 . A A . 14 GLU C 1 1 2 795 1 1 14 GLU CA C 0.633 -5.144 0.346 1.00 . A A . 14 GLU CA 1 1 2 796 1 1 14 GLU CB C 0.888 -6.572 -0.139 1.00 . A A . 14 GLU CB 1 1 2 797 1 1 14 GLU CD C 2.024 -8.788 0.287 1.00 . A A . 14 GLU CD 1 1 2 798 1 1 14 GLU CG C 1.835 -7.358 0.753 1.00 . A A . 14 GLU CG 1 1 2 799 1 1 14 GLU H H -0.627 -4.149 -1.034 1.00 . A A . 14 GLU H 1 1 2 800 1 1 14 GLU HA H 0.559 -5.147 1.423 1.00 . A A . 14 GLU HA 1 1 2 801 1 1 14 GLU HB2 H -0.054 -7.099 -0.181 1.00 . A A . 14 GLU HB2 1 1 2 802 1 1 14 GLU HB3 H 1.312 -6.532 -1.131 1.00 . A A . 14 GLU HB3 1 1 2 803 1 1 14 GLU HG2 H 2.797 -6.867 0.756 1.00 . A A . 14 GLU HG2 1 1 2 804 1 1 14 GLU HG3 H 1.436 -7.371 1.757 1.00 . A A . 14 GLU HG3 1 1 2 805 1 1 14 GLU N N -0.628 -4.644 -0.189 1.00 . A A . 14 GLU N 1 1 2 806 1 1 14 GLU O O 1.832 -3.730 -1.184 1.00 . A A . 14 GLU O 1 1 2 807 1 1 14 GLU OE1 O 2.062 -9.012 -0.941 1.00 . A A . 14 GLU OE1 1 1 2 808 1 1 14 GLU OE2 O 2.133 -9.684 1.151 1.00 . A A . 14 GLU OE2 1 1 2 809 1 1 15 CYS C C 4.981 -3.991 -0.149 1.00 . A A . 15 CYS C 1 1 2 810 1 1 15 CYS CA C 3.898 -3.207 0.588 1.00 . A A . 15 CYS CA 1 1 2 811 1 1 15 CYS CB C 4.458 -2.650 1.898 1.00 . A A . 15 CYS CB 1 1 2 812 1 1 15 CYS H H 2.651 -4.483 1.727 1.00 . A A . 15 CYS H 1 1 2 813 1 1 15 CYS HA H 3.579 -2.386 -0.035 1.00 . A A . 15 CYS HA 1 1 2 814 1 1 15 CYS HB2 H 3.646 -2.250 2.486 1.00 . A A . 15 CYS HB2 1 1 2 815 1 1 15 CYS HB3 H 4.934 -3.449 2.446 1.00 . A A . 15 CYS HB3 1 1 2 816 1 1 15 CYS N N 2.737 -4.049 0.851 1.00 . A A . 15 CYS N 1 1 2 817 1 1 15 CYS O O 5.309 -5.117 0.224 1.00 . A A . 15 CYS O 1 1 2 818 1 1 15 CYS SG S 5.686 -1.322 1.676 1.00 . A A . 15 CYS SG 1 1 2 819 1 1 16 ASP C C 7.961 -3.671 -1.442 1.00 . A A . 16 ASP C 1 1 2 820 1 1 16 ASP CA C 6.580 -4.025 -1.984 1.00 . A A . 16 ASP CA 1 1 2 821 1 1 16 ASP CB C 6.471 -3.606 -3.451 1.00 . A A . 16 ASP CB 1 1 2 822 1 1 16 ASP CG C 5.136 -3.982 -4.062 1.00 . A A . 16 ASP CG 1 1 2 823 1 1 16 ASP H H 5.229 -2.487 -1.443 1.00 . A A . 16 ASP H 1 1 2 824 1 1 16 ASP HA H 6.443 -5.093 -1.913 1.00 . A A . 16 ASP HA 1 1 2 825 1 1 16 ASP HB2 H 6.589 -2.535 -3.522 1.00 . A A . 16 ASP HB2 1 1 2 826 1 1 16 ASP HB3 H 7.255 -4.089 -4.015 1.00 . A A . 16 ASP HB3 1 1 2 827 1 1 16 ASP N N 5.533 -3.386 -1.195 1.00 . A A . 16 ASP N 1 1 2 828 1 1 16 ASP O O 8.948 -3.673 -2.178 1.00 . A A . 16 ASP O 1 1 2 829 1 1 16 ASP OD1 O 5.015 -5.117 -4.570 1.00 . A A . 16 ASP OD1 1 1 2 830 1 1 16 ASP OD2 O 4.212 -3.142 -4.035 1.00 . A A . 16 ASP OD2 1 1 2 831 1 1 17 VAL C C 9.479 -3.784 1.789 1.00 . A A . 17 VAL C 1 1 2 832 1 1 17 VAL CA C 9.284 -3.009 0.491 1.00 . A A . 17 VAL CA 1 1 2 833 1 1 17 VAL CB C 9.353 -1.500 0.792 1.00 . A A . 17 VAL CB 1 1 2 834 1 1 17 VAL CG1 C 10.664 -1.152 1.481 1.00 . A A . 17 VAL CG1 1 1 2 835 1 1 17 VAL CG2 C 9.183 -0.694 -0.486 1.00 . A A . 17 VAL CG2 1 1 2 836 1 1 17 VAL H H 7.203 -3.381 0.386 1.00 . A A . 17 VAL H 1 1 2 837 1 1 17 VAL HA H 10.086 -3.256 -0.189 1.00 . A A . 17 VAL HA 1 1 2 838 1 1 17 VAL HB H 8.543 -1.249 1.462 1.00 . A A . 17 VAL HB 1 1 2 839 1 1 17 VAL HG11 H 10.652 -1.534 2.491 1.00 . A A . 17 VAL HG11 1 1 2 840 1 1 17 VAL HG12 H 11.486 -1.595 0.936 1.00 . A A . 17 VAL HG12 1 1 2 841 1 1 17 VAL HG13 H 10.784 -0.079 1.505 1.00 . A A . 17 VAL HG13 1 1 2 842 1 1 17 VAL HG21 H 10.148 -0.532 -0.942 1.00 . A A . 17 VAL HG21 1 1 2 843 1 1 17 VAL HG22 H 8.547 -1.236 -1.170 1.00 . A A . 17 VAL HG22 1 1 2 844 1 1 17 VAL HG23 H 8.730 0.260 -0.253 1.00 . A A . 17 VAL HG23 1 1 2 845 1 1 17 VAL N N 8.024 -3.366 -0.150 1.00 . A A . 17 VAL N 1 1 2 846 1 1 17 VAL O O 10.569 -4.287 2.067 1.00 . A A . 17 VAL O 1 1 2 847 1 1 18 CYS C C 7.503 -5.775 3.851 1.00 . A A . 18 CYS C 1 1 2 848 1 1 18 CYS CA C 8.469 -4.593 3.851 1.00 . A A . 18 CYS CA 1 1 2 849 1 1 18 CYS CB C 8.136 -3.648 5.006 1.00 . A A . 18 CYS CB 1 1 2 850 1 1 18 CYS H H 7.575 -3.457 2.305 1.00 . A A . 18 CYS H 1 1 2 851 1 1 18 CYS HA H 9.474 -4.966 3.981 1.00 . A A . 18 CYS HA 1 1 2 852 1 1 18 CYS HB2 H 8.164 -4.201 5.934 1.00 . A A . 18 CYS HB2 1 1 2 853 1 1 18 CYS HB3 H 8.874 -2.860 5.041 1.00 . A A . 18 CYS HB3 1 1 2 854 1 1 18 CYS N N 8.416 -3.879 2.581 1.00 . A A . 18 CYS N 1 1 2 855 1 1 18 CYS O O 7.493 -6.582 4.781 1.00 . A A . 18 CYS O 1 1 2 856 1 1 18 CYS SG S 6.495 -2.867 4.878 1.00 . A A . 18 CYS SG 1 1 2 857 1 1 19 ARG C C 4.713 -6.905 3.824 1.00 . A A . 19 ARG C 1 1 2 858 1 1 19 ARG CA C 5.722 -6.950 2.681 1.00 . A A . 19 ARG CA 1 1 2 859 1 1 19 ARG CB C 6.434 -8.304 2.668 1.00 . A A . 19 ARG CB 1 1 2 860 1 1 19 ARG CD C 8.246 -7.569 1.089 1.00 . A A . 19 ARG CD 1 1 2 861 1 1 19 ARG CG C 7.161 -8.598 1.366 1.00 . A A . 19 ARG CG 1 1 2 862 1 1 19 ARG CZ C 10.156 -7.385 -0.448 1.00 . A A . 19 ARG CZ 1 1 2 863 1 1 19 ARG H H 6.748 -5.195 2.092 1.00 . A A . 19 ARG H 1 1 2 864 1 1 19 ARG HA H 5.196 -6.821 1.747 1.00 . A A . 19 ARG HA 1 1 2 865 1 1 19 ARG HB2 H 7.157 -8.326 3.471 1.00 . A A . 19 ARG HB2 1 1 2 866 1 1 19 ARG HB3 H 5.704 -9.083 2.831 1.00 . A A . 19 ARG HB3 1 1 2 867 1 1 19 ARG HD2 H 7.808 -6.739 0.554 1.00 . A A . 19 ARG HD2 1 1 2 868 1 1 19 ARG HD3 H 8.641 -7.220 2.031 1.00 . A A . 19 ARG HD3 1 1 2 869 1 1 19 ARG HE H 9.464 -9.095 0.311 1.00 . A A . 19 ARG HE 1 1 2 870 1 1 19 ARG HG2 H 7.616 -9.575 1.431 1.00 . A A . 19 ARG HG2 1 1 2 871 1 1 19 ARG HG3 H 6.448 -8.584 0.556 1.00 . A A . 19 ARG HG3 1 1 2 872 1 1 19 ARG HH11 H 9.279 -5.630 0.032 1.00 . A A . 19 ARG HH11 1 1 2 873 1 1 19 ARG HH12 H 10.627 -5.515 -1.051 1.00 . A A . 19 ARG HH12 1 1 2 874 1 1 19 ARG HH21 H 11.240 -8.956 -1.113 1.00 . A A . 19 ARG HH21 1 1 2 875 1 1 19 ARG HH22 H 11.741 -7.408 -1.702 1.00 . A A . 19 ARG HH22 1 1 2 876 1 1 19 ARG N N 6.693 -5.869 2.802 1.00 . A A . 19 ARG N 1 1 2 877 1 1 19 ARG NE N 9.337 -8.124 0.293 1.00 . A A . 19 ARG NE 1 1 2 878 1 1 19 ARG NH1 N 10.008 -6.069 -0.493 1.00 . A A . 19 ARG NH1 1 1 2 879 1 1 19 ARG NH2 N 11.125 -7.964 -1.145 1.00 . A A . 19 ARG NH2 1 1 2 880 1 1 19 ARG O O 4.420 -7.925 4.449 1.00 . A A . 19 ARG O 1 1 2 881 1 1 20 LYS C C 1.786 -5.546 4.604 1.00 . A A . 20 LYS C 1 1 2 882 1 1 20 LYS CA C 3.207 -5.537 5.160 1.00 . A A . 20 LYS CA 1 1 2 883 1 1 20 LYS CB C 3.467 -4.224 5.902 1.00 . A A . 20 LYS CB 1 1 2 884 1 1 20 LYS CD C 4.408 -3.141 7.964 1.00 . A A . 20 LYS CD 1 1 2 885 1 1 20 LYS CE C 5.758 -2.901 8.624 1.00 . A A . 20 LYS CE 1 1 2 886 1 1 20 LYS CG C 4.439 -4.362 7.061 1.00 . A A . 20 LYS CG 1 1 2 887 1 1 20 LYS H H 4.457 -4.940 3.560 1.00 . A A . 20 LYS H 1 1 2 888 1 1 20 LYS HA H 3.315 -6.359 5.851 1.00 . A A . 20 LYS HA 1 1 2 889 1 1 20 LYS HB2 H 3.871 -3.504 5.205 1.00 . A A . 20 LYS HB2 1 1 2 890 1 1 20 LYS HB3 H 2.529 -3.851 6.289 1.00 . A A . 20 LYS HB3 1 1 2 891 1 1 20 LYS HD2 H 4.150 -2.274 7.374 1.00 . A A . 20 LYS HD2 1 1 2 892 1 1 20 LYS HD3 H 3.663 -3.290 8.733 1.00 . A A . 20 LYS HD3 1 1 2 893 1 1 20 LYS HE2 H 6.507 -2.798 7.854 1.00 . A A . 20 LYS HE2 1 1 2 894 1 1 20 LYS HE3 H 5.705 -1.989 9.200 1.00 . A A . 20 LYS HE3 1 1 2 895 1 1 20 LYS HG2 H 4.171 -5.232 7.642 1.00 . A A . 20 LYS HG2 1 1 2 896 1 1 20 LYS HG3 H 5.438 -4.484 6.668 1.00 . A A . 20 LYS HG3 1 1 2 897 1 1 20 LYS HZ1 H 6.633 -3.654 10.364 1.00 . A A . 20 LYS HZ1 1 1 2 898 1 1 20 LYS HZ2 H 6.773 -4.681 9.027 1.00 . A A . 20 LYS HZ2 1 1 2 899 1 1 20 LYS HZ3 H 5.293 -4.539 9.834 1.00 . A A . 20 LYS HZ3 1 1 2 900 1 1 20 LYS N N 4.184 -5.716 4.093 1.00 . A A . 20 LYS N 1 1 2 901 1 1 20 LYS NZ N 6.141 -4.022 9.526 1.00 . A A . 20 LYS NZ 1 1 2 902 1 1 20 LYS O O 1.531 -5.022 3.520 1.00 . A A . 20 LYS O 1 1 2 903 1 1 21 ALA C C -1.402 -5.289 5.776 1.00 . A A . 21 ALA C 1 1 2 904 1 1 21 ALA CA C -0.529 -6.217 4.938 1.00 . A A . 21 ALA CA 1 1 2 905 1 1 21 ALA CB C -1.033 -7.649 5.033 1.00 . A A . 21 ALA CB 1 1 2 906 1 1 21 ALA H H 1.131 -6.542 6.209 1.00 . A A . 21 ALA H 1 1 2 907 1 1 21 ALA HA H -0.585 -5.909 3.903 1.00 . A A . 21 ALA HA 1 1 2 908 1 1 21 ALA HB1 H -0.194 -8.318 5.152 1.00 . A A . 21 ALA HB1 1 1 2 909 1 1 21 ALA HB2 H -1.692 -7.742 5.885 1.00 . A A . 21 ALA HB2 1 1 2 910 1 1 21 ALA HB3 H -1.572 -7.901 4.132 1.00 . A A . 21 ALA HB3 1 1 2 911 1 1 21 ALA N N 0.866 -6.143 5.354 1.00 . A A . 21 ALA N 1 1 2 912 1 1 21 ALA O O -1.292 -5.257 7.002 1.00 . A A . 21 ALA O 1 1 2 913 1 1 22 PHE C C -4.620 -3.932 5.492 1.00 . A A . 22 PHE C 1 1 2 914 1 1 22 PHE CA C -3.160 -3.606 5.792 1.00 . A A . 22 PHE CA 1 1 2 915 1 1 22 PHE CB C -2.850 -2.168 5.373 1.00 . A A . 22 PHE CB 1 1 2 916 1 1 22 PHE CD1 C -0.453 -2.197 4.632 1.00 . A A . 22 PHE CD1 1 1 2 917 1 1 22 PHE CD2 C -1.005 -1.026 6.634 1.00 . A A . 22 PHE CD2 1 1 2 918 1 1 22 PHE CE1 C 0.876 -1.851 4.792 1.00 . A A . 22 PHE CE1 1 1 2 919 1 1 22 PHE CE2 C 0.321 -0.676 6.799 1.00 . A A . 22 PHE CE2 1 1 2 920 1 1 22 PHE CG C -1.407 -1.789 5.550 1.00 . A A . 22 PHE CG 1 1 2 921 1 1 22 PHE CZ C 1.263 -1.090 5.877 1.00 . A A . 22 PHE CZ 1 1 2 922 1 1 22 PHE H H -2.310 -4.607 4.131 1.00 . A A . 22 PHE H 1 1 2 923 1 1 22 PHE HA H -2.992 -3.707 6.853 1.00 . A A . 22 PHE HA 1 1 2 924 1 1 22 PHE HB2 H -3.100 -2.042 4.330 1.00 . A A . 22 PHE HB2 1 1 2 925 1 1 22 PHE HB3 H -3.447 -1.491 5.966 1.00 . A A . 22 PHE HB3 1 1 2 926 1 1 22 PHE HD1 H -0.755 -2.793 3.782 1.00 . A A . 22 PHE HD1 1 1 2 927 1 1 22 PHE HD2 H -1.740 -0.703 7.357 1.00 . A A . 22 PHE HD2 1 1 2 928 1 1 22 PHE HE1 H 1.609 -2.176 4.069 1.00 . A A . 22 PHE HE1 1 1 2 929 1 1 22 PHE HE2 H 0.622 -0.081 7.649 1.00 . A A . 22 PHE HE2 1 1 2 930 1 1 22 PHE HZ H 2.300 -0.818 6.003 1.00 . A A . 22 PHE HZ 1 1 2 931 1 1 22 PHE N N -2.269 -4.536 5.108 1.00 . A A . 22 PHE N 1 1 2 932 1 1 22 PHE O O -4.931 -4.568 4.485 1.00 . A A . 22 PHE O 1 1 2 933 1 1 23 SER C C -7.536 -2.798 5.165 1.00 . A A . 23 SER C 1 1 2 934 1 1 23 SER CA C -6.939 -3.739 6.207 1.00 . A A . 23 SER CA 1 1 2 935 1 1 23 SER CB C -7.668 -3.568 7.541 1.00 . A A . 23 SER CB 1 1 2 936 1 1 23 SER H H -5.202 -2.990 7.157 1.00 . A A . 23 SER H 1 1 2 937 1 1 23 SER HA H -7.061 -4.757 5.867 1.00 . A A . 23 SER HA 1 1 2 938 1 1 23 SER HB2 H -7.472 -4.425 8.168 1.00 . A A . 23 SER HB2 1 1 2 939 1 1 23 SER HB3 H -7.310 -2.675 8.032 1.00 . A A . 23 SER HB3 1 1 2 940 1 1 23 SER HG H -9.313 -3.888 6.527 1.00 . A A . 23 SER HG 1 1 2 941 1 1 23 SER N N -5.512 -3.491 6.374 1.00 . A A . 23 SER N 1 1 2 942 1 1 23 SER O O -8.264 -3.226 4.269 1.00 . A A . 23 SER O 1 1 2 943 1 1 23 SER OG O -9.067 -3.455 7.347 1.00 . A A . 23 SER OG 1 1 2 944 1 1 24 HIS C C -6.633 -0.072 3.386 1.00 . A A . 24 HIS C 1 1 2 945 1 1 24 HIS CA C -7.725 -0.509 4.358 1.00 . A A . 24 HIS CA 1 1 2 946 1 1 24 HIS CB C -8.258 0.704 5.122 1.00 . A A . 24 HIS CB 1 1 2 947 1 1 24 HIS CD2 C -7.491 0.188 7.545 1.00 . A A . 24 HIS CD2 1 1 2 948 1 1 24 HIS CE1 C -6.333 2.013 7.910 1.00 . A A . 24 HIS CE1 1 1 2 949 1 1 24 HIS CG C -7.561 0.945 6.425 1.00 . A A . 24 HIS CG 1 1 2 950 1 1 24 HIS H H -6.636 -1.232 6.023 1.00 . A A . 24 HIS H 1 1 2 951 1 1 24 HIS HA H -8.533 -0.953 3.796 1.00 . A A . 24 HIS HA 1 1 2 952 1 1 24 HIS HB2 H -8.136 1.587 4.512 1.00 . A A . 24 HIS HB2 1 1 2 953 1 1 24 HIS HB3 H -9.309 0.558 5.328 1.00 . A A . 24 HIS HB3 1 1 2 954 1 1 24 HIS HD1 H -6.686 2.828 6.067 1.00 . A A . 24 HIS HD1 1 1 2 955 1 1 24 HIS HD2 H -7.953 -0.778 7.697 1.00 . A A . 24 HIS HD2 1 1 2 956 1 1 24 HIS HE1 H -5.717 2.761 8.387 1.00 . A A . 24 HIS HE1 1 1 2 957 1 1 24 HIS N N -7.221 -1.512 5.289 1.00 . A A . 24 HIS N 1 1 2 958 1 1 24 HIS ND1 N -6.826 2.082 6.687 1.00 . A A . 24 HIS ND1 1 1 2 959 1 1 24 HIS NE2 N -6.722 0.873 8.453 1.00 . A A . 24 HIS NE2 1 1 2 960 1 1 24 HIS O O -5.493 -0.531 3.470 1.00 . A A . 24 HIS O 1 1 2 961 1 1 25 HIS C C -5.279 2.522 2.012 1.00 . A A . 25 HIS C 1 1 2 962 1 1 25 HIS CA C -6.039 1.313 1.474 1.00 . A A . 25 HIS CA 1 1 2 963 1 1 25 HIS CB C -6.765 1.686 0.181 1.00 . A A . 25 HIS CB 1 1 2 964 1 1 25 HIS CD2 C -9.102 2.611 0.820 1.00 . A A . 25 HIS CD2 1 1 2 965 1 1 25 HIS CE1 C -8.751 4.722 0.344 1.00 . A A . 25 HIS CE1 1 1 2 966 1 1 25 HIS CG C -7.830 2.721 0.369 1.00 . A A . 25 HIS CG 1 1 2 967 1 1 25 HIS H H -7.912 1.143 2.446 1.00 . A A . 25 HIS H 1 1 2 968 1 1 25 HIS HA H -5.333 0.524 1.266 1.00 . A A . 25 HIS HA 1 1 2 969 1 1 25 HIS HB2 H -6.047 2.073 -0.527 1.00 . A A . 25 HIS HB2 1 1 2 970 1 1 25 HIS HB3 H -7.229 0.801 -0.231 1.00 . A A . 25 HIS HB3 1 1 2 971 1 1 25 HIS HD1 H -6.818 4.455 -0.269 1.00 . A A . 25 HIS HD1 1 1 2 972 1 1 25 HIS HD2 H -9.593 1.703 1.140 1.00 . A A . 25 HIS HD2 1 1 2 973 1 1 25 HIS HE1 H -8.897 5.784 0.215 1.00 . A A . 25 HIS HE1 1 1 2 974 1 1 25 HIS N N -6.989 0.815 2.463 1.00 . A A . 25 HIS N 1 1 2 975 1 1 25 HIS ND1 N -7.642 4.056 0.079 1.00 . A A . 25 HIS ND1 1 1 2 976 1 1 25 HIS NE2 N -9.653 3.869 0.795 1.00 . A A . 25 HIS NE2 1 1 2 977 1 1 25 HIS O O -4.049 2.530 2.044 1.00 . A A . 25 HIS O 1 1 2 978 1 1 26 ALA C C -4.226 4.427 3.862 1.00 . A A . 26 ALA C 1 1 2 979 1 1 26 ALA CA C -5.417 4.755 2.968 1.00 . A A . 26 ALA CA 1 1 2 980 1 1 26 ALA CB C -6.451 5.563 3.739 1.00 . A A . 26 ALA CB 1 1 2 981 1 1 26 ALA H H -6.997 3.476 2.380 1.00 . A A . 26 ALA H 1 1 2 982 1 1 26 ALA HA H -5.076 5.355 2.136 1.00 . A A . 26 ALA HA 1 1 2 983 1 1 26 ALA HB1 H -7.411 5.477 3.252 1.00 . A A . 26 ALA HB1 1 1 2 984 1 1 26 ALA HB2 H -6.524 5.182 4.748 1.00 . A A . 26 ALA HB2 1 1 2 985 1 1 26 ALA HB3 H -6.151 6.599 3.766 1.00 . A A . 26 ALA HB3 1 1 2 986 1 1 26 ALA N N -6.021 3.542 2.431 1.00 . A A . 26 ALA N 1 1 2 987 1 1 26 ALA O O -3.327 5.249 4.041 1.00 . A A . 26 ALA O 1 1 2 988 1 1 27 SER C C -1.857 2.573 4.512 1.00 . A A . 27 SER C 1 1 2 989 1 1 27 SER CA C -3.147 2.785 5.299 1.00 . A A . 27 SER CA 1 1 2 990 1 1 27 SER CB C -3.537 1.493 6.019 1.00 . A A . 27 SER CB 1 1 2 991 1 1 27 SER H H -4.971 2.610 4.238 1.00 . A A . 27 SER H 1 1 2 992 1 1 27 SER HA H -2.983 3.561 6.033 1.00 . A A . 27 SER HA 1 1 2 993 1 1 27 SER HB2 H -2.679 1.104 6.546 1.00 . A A . 27 SER HB2 1 1 2 994 1 1 27 SER HB3 H -4.328 1.702 6.724 1.00 . A A . 27 SER HB3 1 1 2 995 1 1 27 SER HG H -4.698 0.004 5.500 1.00 . A A . 27 SER HG 1 1 2 996 1 1 27 SER N N -4.226 3.221 4.420 1.00 . A A . 27 SER N 1 1 2 997 1 1 27 SER O O -0.787 3.030 4.916 1.00 . A A . 27 SER O 1 1 2 998 1 1 27 SER OG O -3.990 0.514 5.100 1.00 . A A . 27 SER OG 1 1 2 999 1 1 28 LEU C C -0.371 2.857 1.794 1.00 . A A . 28 LEU C 1 1 2 1000 1 1 28 LEU CA C -0.810 1.601 2.541 1.00 . A A . 28 LEU CA 1 1 2 1001 1 1 28 LEU CB C -1.136 0.489 1.543 1.00 . A A . 28 LEU CB 1 1 2 1002 1 1 28 LEU CD1 C 1.146 -0.516 1.279 1.00 . A A . 28 LEU CD1 1 1 2 1003 1 1 28 LEU CD2 C -0.559 -0.797 -0.530 1.00 . A A . 28 LEU CD2 1 1 2 1004 1 1 28 LEU CG C -0.026 0.128 0.554 1.00 . A A . 28 LEU CG 1 1 2 1005 1 1 28 LEU H H -2.845 1.537 3.117 1.00 . A A . 28 LEU H 1 1 2 1006 1 1 28 LEU HA H -0.003 1.276 3.180 1.00 . A A . 28 LEU HA 1 1 2 1007 1 1 28 LEU HB2 H -1.378 -0.400 2.106 1.00 . A A . 28 LEU HB2 1 1 2 1008 1 1 28 LEU HB3 H -2.000 0.799 0.973 1.00 . A A . 28 LEU HB3 1 1 2 1009 1 1 28 LEU HD11 H 0.789 -1.336 1.883 1.00 . A A . 28 LEU HD11 1 1 2 1010 1 1 28 LEU HD12 H 1.623 0.217 1.912 1.00 . A A . 28 LEU HD12 1 1 2 1011 1 1 28 LEU HD13 H 1.858 -0.884 0.554 1.00 . A A . 28 LEU HD13 1 1 2 1012 1 1 28 LEU HD21 H -0.246 -1.810 -0.324 1.00 . A A . 28 LEU HD21 1 1 2 1013 1 1 28 LEU HD22 H -0.170 -0.488 -1.489 1.00 . A A . 28 LEU HD22 1 1 2 1014 1 1 28 LEU HD23 H -1.638 -0.749 -0.547 1.00 . A A . 28 LEU HD23 1 1 2 1015 1 1 28 LEU HG H 0.331 1.031 0.079 1.00 . A A . 28 LEU HG 1 1 2 1016 1 1 28 LEU N N -1.967 1.876 3.387 1.00 . A A . 28 LEU N 1 1 2 1017 1 1 28 LEU O O 0.788 3.265 1.870 1.00 . A A . 28 LEU O 1 1 2 1018 1 1 29 THR C C -0.157 5.643 1.124 1.00 . A A . 29 THR C 1 1 2 1019 1 1 29 THR CA C -1.017 4.678 0.315 1.00 . A A . 29 THR CA 1 1 2 1020 1 1 29 THR CB C -2.311 5.397 -0.112 1.00 . A A . 29 THR CB 1 1 2 1021 1 1 29 THR CG2 C -2.827 6.291 1.005 1.00 . A A . 29 THR CG2 1 1 2 1022 1 1 29 THR H H -2.212 3.095 1.053 1.00 . A A . 29 THR H 1 1 2 1023 1 1 29 THR HA H -0.478 4.392 -0.577 1.00 . A A . 29 THR HA 1 1 2 1024 1 1 29 THR HB H -3.062 4.652 -0.333 1.00 . A A . 29 THR HB 1 1 2 1025 1 1 29 THR HG1 H -1.817 7.070 -1.031 1.00 . A A . 29 THR HG1 1 1 2 1026 1 1 29 THR HG21 H -3.061 5.689 1.869 1.00 . A A . 29 THR HG21 1 1 2 1027 1 1 29 THR HG22 H -3.717 6.805 0.673 1.00 . A A . 29 THR HG22 1 1 2 1028 1 1 29 THR HG23 H -2.070 7.015 1.265 1.00 . A A . 29 THR HG23 1 1 2 1029 1 1 29 THR N N -1.307 3.469 1.074 1.00 . A A . 29 THR N 1 1 2 1030 1 1 29 THR O O 0.726 6.305 0.581 1.00 . A A . 29 THR O 1 1 2 1031 1 1 29 THR OG1 O -2.072 6.180 -1.286 1.00 . A A . 29 THR OG1 1 1 2 1032 1 1 30 GLN C C 1.625 5.940 3.766 1.00 . A A . 30 GLN C 1 1 2 1033 1 1 30 GLN CA C 0.329 6.600 3.308 1.00 . A A . 30 GLN CA 1 1 2 1034 1 1 30 GLN CB C -0.519 6.983 4.522 1.00 . A A . 30 GLN CB 1 1 2 1035 1 1 30 GLN CD C 0.951 6.802 6.568 1.00 . A A . 30 GLN CD 1 1 2 1036 1 1 30 GLN CG C 0.256 7.732 5.594 1.00 . A A . 30 GLN CG 1 1 2 1037 1 1 30 GLN H H -1.139 5.163 2.798 1.00 . A A . 30 GLN H 1 1 2 1038 1 1 30 GLN HA H 0.571 7.494 2.753 1.00 . A A . 30 GLN HA 1 1 2 1039 1 1 30 GLN HB2 H -1.335 7.610 4.193 1.00 . A A . 30 GLN HB2 1 1 2 1040 1 1 30 GLN HB3 H -0.922 6.083 4.963 1.00 . A A . 30 GLN HB3 1 1 2 1041 1 1 30 GLN HE21 H 2.619 7.877 6.443 1.00 . A A . 30 GLN HE21 1 1 2 1042 1 1 30 GLN HE22 H 2.686 6.506 7.492 1.00 . A A . 30 GLN HE22 1 1 2 1043 1 1 30 GLN HG2 H 1.002 8.349 5.116 1.00 . A A . 30 GLN HG2 1 1 2 1044 1 1 30 GLN HG3 H -0.430 8.359 6.144 1.00 . A A . 30 GLN HG3 1 1 2 1045 1 1 30 GLN N N -0.422 5.716 2.424 1.00 . A A . 30 GLN N 1 1 2 1046 1 1 30 GLN NE2 N 2.213 7.090 6.864 1.00 . A A . 30 GLN NE2 1 1 2 1047 1 1 30 GLN O O 2.718 6.419 3.464 1.00 . A A . 30 GLN O 1 1 2 1048 1 1 30 GLN OE1 O 0.361 5.835 7.050 1.00 . A A . 30 GLN OE1 1 1 2 1049 1 1 31 HIS C C 3.766 4.073 3.951 1.00 . A A . 31 HIS C 1 1 2 1050 1 1 31 HIS CA C 2.657 4.111 4.997 1.00 . A A . 31 HIS CA 1 1 2 1051 1 1 31 HIS CB C 2.263 2.687 5.391 1.00 . A A . 31 HIS CB 1 1 2 1052 1 1 31 HIS CD2 C 3.808 0.929 4.272 1.00 . A A . 31 HIS CD2 1 1 2 1053 1 1 31 HIS CE1 C 5.131 0.535 5.975 1.00 . A A . 31 HIS CE1 1 1 2 1054 1 1 31 HIS CG C 3.392 1.706 5.299 1.00 . A A . 31 HIS CG 1 1 2 1055 1 1 31 HIS H H 0.597 4.505 4.705 1.00 . A A . 31 HIS H 1 1 2 1056 1 1 31 HIS HA H 3.021 4.629 5.871 1.00 . A A . 31 HIS HA 1 1 2 1057 1 1 31 HIS HB2 H 1.907 2.687 6.411 1.00 . A A . 31 HIS HB2 1 1 2 1058 1 1 31 HIS HB3 H 1.472 2.345 4.739 1.00 . A A . 31 HIS HB3 1 1 2 1059 1 1 31 HIS HD1 H 4.197 1.843 7.241 1.00 . A A . 31 HIS HD1 1 1 2 1060 1 1 31 HIS HD2 H 3.371 0.883 3.284 1.00 . A A . 31 HIS HD2 1 1 2 1061 1 1 31 HIS HE1 H 5.922 0.131 6.590 1.00 . A A . 31 HIS HE1 1 1 2 1062 1 1 31 HIS N N 1.495 4.837 4.497 1.00 . A A . 31 HIS N 1 1 2 1063 1 1 31 HIS ND1 N 4.241 1.435 6.351 1.00 . A A . 31 HIS ND1 1 1 2 1064 1 1 31 HIS NE2 N 4.891 0.211 4.717 1.00 . A A . 31 HIS NE2 1 1 2 1065 1 1 31 HIS O O 4.885 4.518 4.204 1.00 . A A . 31 HIS O 1 1 2 1066 1 1 32 GLN C C 5.365 4.640 1.702 1.00 . A A . 32 GLN C 1 1 2 1067 1 1 32 GLN CA C 4.419 3.444 1.692 1.00 . A A . 32 GLN CA 1 1 2 1068 1 1 32 GLN CB C 3.702 3.356 0.344 1.00 . A A . 32 GLN CB 1 1 2 1069 1 1 32 GLN CD C 4.312 1.079 -0.567 1.00 . A A . 32 GLN CD 1 1 2 1070 1 1 32 GLN CG C 3.215 1.957 0.004 1.00 . A A . 32 GLN CG 1 1 2 1071 1 1 32 GLN H H 2.539 3.203 2.635 1.00 . A A . 32 GLN H 1 1 2 1072 1 1 32 GLN HA H 4.995 2.544 1.843 1.00 . A A . 32 GLN HA 1 1 2 1073 1 1 32 GLN HB2 H 2.849 4.017 0.359 1.00 . A A . 32 GLN HB2 1 1 2 1074 1 1 32 GLN HB3 H 4.382 3.675 -0.433 1.00 . A A . 32 GLN HB3 1 1 2 1075 1 1 32 GLN HE21 H 3.176 0.639 -2.138 1.00 . A A . 32 GLN HE21 1 1 2 1076 1 1 32 GLN HE22 H 4.741 -0.091 -2.115 1.00 . A A . 32 GLN HE22 1 1 2 1077 1 1 32 GLN HG2 H 2.835 1.493 0.902 1.00 . A A . 32 GLN HG2 1 1 2 1078 1 1 32 GLN HG3 H 2.420 2.033 -0.724 1.00 . A A . 32 GLN HG3 1 1 2 1079 1 1 32 GLN N N 3.448 3.540 2.776 1.00 . A A . 32 GLN N 1 1 2 1080 1 1 32 GLN NE2 N 4.050 0.481 -1.723 1.00 . A A . 32 GLN NE2 1 1 2 1081 1 1 32 GLN O O 6.563 4.498 1.457 1.00 . A A . 32 GLN O 1 1 2 1082 1 1 32 GLN OE1 O 5.382 0.940 0.025 1.00 . A A . 32 GLN OE1 1 1 2 1083 1 1 33 ARG C C 6.925 6.810 2.774 1.00 . A A . 33 ARG C 1 1 2 1084 1 1 33 ARG CA C 5.614 7.039 2.026 1.00 . A A . 33 ARG CA 1 1 2 1085 1 1 33 ARG CB C 4.824 8.166 2.693 1.00 . A A . 33 ARG CB 1 1 2 1086 1 1 33 ARG CD C 3.086 9.962 2.424 1.00 . A A . 33 ARG CD 1 1 2 1087 1 1 33 ARG CG C 3.664 8.676 1.853 1.00 . A A . 33 ARG CG 1 1 2 1088 1 1 33 ARG CZ C 3.927 12.199 3.000 1.00 . A A . 33 ARG CZ 1 1 2 1089 1 1 33 ARG H H 3.858 5.867 2.173 1.00 . A A . 33 ARG H 1 1 2 1090 1 1 33 ARG HA H 5.839 7.322 1.008 1.00 . A A . 33 ARG HA 1 1 2 1091 1 1 33 ARG HB2 H 4.430 7.807 3.632 1.00 . A A . 33 ARG HB2 1 1 2 1092 1 1 33 ARG HB3 H 5.492 8.993 2.884 1.00 . A A . 33 ARG HB3 1 1 2 1093 1 1 33 ARG HD2 H 2.168 10.190 1.904 1.00 . A A . 33 ARG HD2 1 1 2 1094 1 1 33 ARG HD3 H 2.878 9.812 3.473 1.00 . A A . 33 ARG HD3 1 1 2 1095 1 1 33 ARG HE H 4.716 11.008 1.608 1.00 . A A . 33 ARG HE 1 1 2 1096 1 1 33 ARG HG2 H 4.014 8.866 0.849 1.00 . A A . 33 ARG HG2 1 1 2 1097 1 1 33 ARG HG3 H 2.890 7.923 1.831 1.00 . A A . 33 ARG HG3 1 1 2 1098 1 1 33 ARG HH11 H 2.317 11.596 4.061 1.00 . A A . 33 ARG HH11 1 1 2 1099 1 1 33 ARG HH12 H 2.920 13.172 4.457 1.00 . A A . 33 ARG HH12 1 1 2 1100 1 1 33 ARG HH21 H 5.519 13.081 2.121 1.00 . A A . 33 ARG HH21 1 1 2 1101 1 1 33 ARG HH22 H 4.741 14.015 3.353 1.00 . A A . 33 ARG HH22 1 1 2 1102 1 1 33 ARG N N 4.819 5.818 1.986 1.00 . A A . 33 ARG N 1 1 2 1103 1 1 33 ARG NE N 4.006 11.087 2.278 1.00 . A A . 33 ARG NE 1 1 2 1104 1 1 33 ARG NH1 N 2.976 12.334 3.914 1.00 . A A . 33 ARG NH1 1 1 2 1105 1 1 33 ARG NH2 N 4.801 13.179 2.809 1.00 . A A . 33 ARG NH2 1 1 2 1106 1 1 33 ARG O O 8.007 7.056 2.241 1.00 . A A . 33 ARG O 1 1 2 1107 1 1 34 VAL C C 9.145 5.538 3.989 1.00 . A A . 34 VAL C 1 1 2 1108 1 1 34 VAL CA C 7.994 6.075 4.833 1.00 . A A . 34 VAL CA 1 1 2 1109 1 1 34 VAL CB C 7.681 5.067 5.955 1.00 . A A . 34 VAL CB 1 1 2 1110 1 1 34 VAL CG1 C 6.627 5.628 6.898 1.00 . A A . 34 VAL CG1 1 1 2 1111 1 1 34 VAL CG2 C 7.230 3.739 5.367 1.00 . A A . 34 VAL CG2 1 1 2 1112 1 1 34 VAL H H 5.928 6.161 4.381 1.00 . A A . 34 VAL H 1 1 2 1113 1 1 34 VAL HA H 8.298 7.006 5.289 1.00 . A A . 34 VAL HA 1 1 2 1114 1 1 34 VAL HB H 8.585 4.898 6.522 1.00 . A A . 34 VAL HB 1 1 2 1115 1 1 34 VAL HG11 H 7.109 6.204 7.674 1.00 . A A . 34 VAL HG11 1 1 2 1116 1 1 34 VAL HG12 H 5.950 6.262 6.345 1.00 . A A . 34 VAL HG12 1 1 2 1117 1 1 34 VAL HG13 H 6.076 4.814 7.345 1.00 . A A . 34 VAL HG13 1 1 2 1118 1 1 34 VAL HG21 H 7.014 3.864 4.317 1.00 . A A . 34 VAL HG21 1 1 2 1119 1 1 34 VAL HG22 H 8.015 3.007 5.489 1.00 . A A . 34 VAL HG22 1 1 2 1120 1 1 34 VAL HG23 H 6.341 3.401 5.879 1.00 . A A . 34 VAL HG23 1 1 2 1121 1 1 34 VAL N N 6.819 6.338 4.012 1.00 . A A . 34 VAL N 1 1 2 1122 1 1 34 VAL O O 10.314 5.802 4.274 1.00 . A A . 34 VAL O 1 1 2 1123 1 1 35 HIS C C 10.136 5.166 0.917 1.00 . A A . 35 HIS C 1 1 2 1124 1 1 35 HIS CA C 9.813 4.210 2.061 1.00 . A A . 35 HIS CA 1 1 2 1125 1 1 35 HIS CB C 9.327 2.872 1.503 1.00 . A A . 35 HIS CB 1 1 2 1126 1 1 35 HIS CD2 C 7.772 1.112 2.603 1.00 . A A . 35 HIS CD2 1 1 2 1127 1 1 35 HIS CE1 C 8.889 0.819 4.467 1.00 . A A . 35 HIS CE1 1 1 2 1128 1 1 35 HIS CG C 8.859 1.917 2.558 1.00 . A A . 35 HIS CG 1 1 2 1129 1 1 35 HIS H H 7.859 4.609 2.773 1.00 . A A . 35 HIS H 1 1 2 1130 1 1 35 HIS HA H 10.709 4.045 2.639 1.00 . A A . 35 HIS HA 1 1 2 1131 1 1 35 HIS HB2 H 8.503 3.049 0.827 1.00 . A A . 35 HIS HB2 1 1 2 1132 1 1 35 HIS HB3 H 10.135 2.401 0.962 1.00 . A A . 35 HIS HB3 1 1 2 1133 1 1 35 HIS HD1 H 10.371 2.151 4.006 1.00 . A A . 35 HIS HD1 1 1 2 1134 1 1 35 HIS HD2 H 7.012 1.016 1.840 1.00 . A A . 35 HIS HD2 1 1 2 1135 1 1 35 HIS HE1 H 9.186 0.460 5.441 1.00 . A A . 35 HIS HE1 1 1 2 1136 1 1 35 HIS N N 8.807 4.784 2.948 1.00 . A A . 35 HIS N 1 1 2 1137 1 1 35 HIS ND1 N 9.537 1.711 3.740 1.00 . A A . 35 HIS ND1 1 1 2 1138 1 1 35 HIS NE2 N 7.813 0.440 3.800 1.00 . A A . 35 HIS NE2 1 1 2 1139 1 1 35 HIS O O 9.343 5.330 -0.010 1.00 . A A . 35 HIS O 1 1 2 1140 1 1 36 SER C C 12.277 6.000 -1.259 1.00 . A A . 36 SER C 1 1 2 1141 1 1 36 SER CA C 11.731 6.736 -0.040 1.00 . A A . 36 SER CA 1 1 2 1142 1 1 36 SER CB C 12.796 7.683 0.517 1.00 . A A . 36 SER CB 1 1 2 1143 1 1 36 SER H H 11.895 5.620 1.752 1.00 . A A . 36 SER H 1 1 2 1144 1 1 36 SER HA H 10.869 7.313 -0.338 1.00 . A A . 36 SER HA 1 1 2 1145 1 1 36 SER HB2 H 13.409 7.153 1.229 1.00 . A A . 36 SER HB2 1 1 2 1146 1 1 36 SER HB3 H 13.413 8.042 -0.294 1.00 . A A . 36 SER HB3 1 1 2 1147 1 1 36 SER HG H 11.455 8.497 1.691 1.00 . A A . 36 SER HG 1 1 2 1148 1 1 36 SER N N 11.305 5.793 0.988 1.00 . A A . 36 SER N 1 1 2 1149 1 1 36 SER O O 13.467 5.699 -1.336 1.00 . A A . 36 SER O 1 1 2 1150 1 1 36 SER OG O 12.201 8.795 1.164 1.00 . A A . 36 SER OG 1 1 2 1151 1 1 37 GLY C C 12.718 5.851 -4.291 1.00 . A A . 37 GLY C 1 1 2 1152 1 1 37 GLY CA C 11.807 5.013 -3.416 1.00 . A A . 37 GLY CA 1 1 2 1153 1 1 37 GLY H H 10.459 5.977 -2.098 1.00 . A A . 37 GLY H 1 1 2 1154 1 1 37 GLY HA2 H 12.326 4.109 -3.135 1.00 . A A . 37 GLY HA2 1 1 2 1155 1 1 37 GLY HA3 H 10.926 4.749 -3.984 1.00 . A A . 37 GLY HA3 1 1 2 1156 1 1 37 GLY N N 11.396 5.712 -2.213 1.00 . A A . 37 GLY N 1 1 2 1157 1 1 37 GLY O O 13.064 6.978 -3.937 1.00 . A A . 37 GLY O 1 1 2 1158 1 1 38 GLU C C 13.197 6.586 -7.528 1.00 . A A . 38 GLU C 1 1 2 1159 1 1 38 GLU CA C 13.989 6.004 -6.360 1.00 . A A . 38 GLU CA 1 1 2 1160 1 1 38 GLU CB C 15.074 5.061 -6.886 1.00 . A A . 38 GLU CB 1 1 2 1161 1 1 38 GLU CD C 14.332 4.121 -9.110 1.00 . A A . 38 GLU CD 1 1 2 1162 1 1 38 GLU CG C 14.525 3.856 -7.629 1.00 . A A . 38 GLU CG 1 1 2 1163 1 1 38 GLU H H 12.801 4.398 -5.662 1.00 . A A . 38 GLU H 1 1 2 1164 1 1 38 GLU HA H 14.459 6.813 -5.821 1.00 . A A . 38 GLU HA 1 1 2 1165 1 1 38 GLU HB2 H 15.718 5.611 -7.557 1.00 . A A . 38 GLU HB2 1 1 2 1166 1 1 38 GLU HB3 H 15.660 4.706 -6.051 1.00 . A A . 38 GLU HB3 1 1 2 1167 1 1 38 GLU HG2 H 15.214 3.033 -7.514 1.00 . A A . 38 GLU HG2 1 1 2 1168 1 1 38 GLU HG3 H 13.571 3.587 -7.200 1.00 . A A . 38 GLU HG3 1 1 2 1169 1 1 38 GLU N N 13.110 5.300 -5.435 1.00 . A A . 38 GLU N 1 1 2 1170 1 1 38 GLU O O 13.636 6.537 -8.677 1.00 . A A . 38 GLU O 1 1 2 1171 1 1 38 GLU OE1 O 15.339 4.118 -9.849 1.00 . A A . 38 GLU OE1 1 1 2 1172 1 1 38 GLU OE2 O 13.175 4.333 -9.529 1.00 . A A . 38 GLU OE2 1 1 2 1173 1 1 39 LYS C C 10.103 8.616 -7.615 1.00 . A A . 39 LYS C 1 1 2 1174 1 1 39 LYS CA C 11.171 7.728 -8.246 1.00 . A A . 39 LYS CA 1 1 2 1175 1 1 39 LYS CB C 10.509 6.632 -9.084 1.00 . A A . 39 LYS CB 1 1 2 1176 1 1 39 LYS CD C 8.595 5.015 -9.266 1.00 . A A . 39 LYS CD 1 1 2 1177 1 1 39 LYS CE C 9.233 3.670 -9.579 1.00 . A A . 39 LYS CE 1 1 2 1178 1 1 39 LYS CG C 9.460 5.837 -8.326 1.00 . A A . 39 LYS CG 1 1 2 1179 1 1 39 LYS H H 11.730 7.144 -6.290 1.00 . A A . 39 LYS H 1 1 2 1180 1 1 39 LYS HA H 11.792 8.334 -8.888 1.00 . A A . 39 LYS HA 1 1 2 1181 1 1 39 LYS HB2 H 10.035 7.088 -9.941 1.00 . A A . 39 LYS HB2 1 1 2 1182 1 1 39 LYS HB3 H 11.271 5.948 -9.427 1.00 . A A . 39 LYS HB3 1 1 2 1183 1 1 39 LYS HD2 H 7.634 4.846 -8.803 1.00 . A A . 39 LYS HD2 1 1 2 1184 1 1 39 LYS HD3 H 8.461 5.563 -10.189 1.00 . A A . 39 LYS HD3 1 1 2 1185 1 1 39 LYS HE2 H 8.747 3.249 -10.445 1.00 . A A . 39 LYS HE2 1 1 2 1186 1 1 39 LYS HE3 H 10.280 3.825 -9.793 1.00 . A A . 39 LYS HE3 1 1 2 1187 1 1 39 LYS HG2 H 9.957 5.170 -7.636 1.00 . A A . 39 LYS HG2 1 1 2 1188 1 1 39 LYS HG3 H 8.830 6.522 -7.777 1.00 . A A . 39 LYS HG3 1 1 2 1189 1 1 39 LYS HZ1 H 9.811 1.959 -8.529 1.00 . A A . 39 LYS HZ1 1 1 2 1190 1 1 39 LYS HZ2 H 8.155 2.296 -8.433 1.00 . A A . 39 LYS HZ2 1 1 2 1191 1 1 39 LYS HZ3 H 9.258 3.216 -7.540 1.00 . A A . 39 LYS HZ3 1 1 2 1192 1 1 39 LYS N N 12.026 7.136 -7.225 1.00 . A A . 39 LYS N 1 1 2 1193 1 1 39 LYS NZ N 9.106 2.718 -8.441 1.00 . A A . 39 LYS NZ 1 1 2 1194 1 1 39 LYS O O 9.576 8.325 -6.541 1.00 . A A . 39 LYS O 1 1 2 1195 1 1 40 PRO C C 7.354 10.100 -7.881 1.00 . A A . 40 PRO C 1 1 2 1196 1 1 40 PRO CA C 8.765 10.674 -7.821 1.00 . A A . 40 PRO CA 1 1 2 1197 1 1 40 PRO CB C 8.905 11.852 -8.788 1.00 . A A . 40 PRO CB 1 1 2 1198 1 1 40 PRO CD C 10.362 10.133 -9.582 1.00 . A A . 40 PRO CD 1 1 2 1199 1 1 40 PRO CG C 9.471 11.257 -10.030 1.00 . A A . 40 PRO CG 1 1 2 1200 1 1 40 PRO HA H 8.975 11.006 -6.814 1.00 . A A . 40 PRO HA 1 1 2 1201 1 1 40 PRO HB2 H 7.934 12.292 -8.966 1.00 . A A . 40 PRO HB2 1 1 2 1202 1 1 40 PRO HB3 H 9.569 12.592 -8.366 1.00 . A A . 40 PRO HB3 1 1 2 1203 1 1 40 PRO HD2 H 10.334 9.321 -10.295 1.00 . A A . 40 PRO HD2 1 1 2 1204 1 1 40 PRO HD3 H 11.375 10.484 -9.448 1.00 . A A . 40 PRO HD3 1 1 2 1205 1 1 40 PRO HG2 H 8.674 10.879 -10.653 1.00 . A A . 40 PRO HG2 1 1 2 1206 1 1 40 PRO HG3 H 10.045 12.000 -10.564 1.00 . A A . 40 PRO HG3 1 1 2 1207 1 1 40 PRO N N 9.775 9.723 -8.296 1.00 . A A . 40 PRO N 1 1 2 1208 1 1 40 PRO O O 6.403 10.713 -7.396 1.00 . A A . 40 PRO O 1 1 2 1209 1 1 41 SER C C 4.931 9.168 -9.323 1.00 . A A . 41 SER C 1 1 2 1210 1 1 41 SER CA C 5.929 8.264 -8.605 1.00 . A A . 41 SER CA 1 1 2 1211 1 1 41 SER CB C 5.389 7.884 -7.226 1.00 . A A . 41 SER CB 1 1 2 1212 1 1 41 SER H H 8.021 8.481 -8.846 1.00 . A A . 41 SER H 1 1 2 1213 1 1 41 SER HA H 6.067 7.366 -9.189 1.00 . A A . 41 SER HA 1 1 2 1214 1 1 41 SER HB2 H 5.271 8.776 -6.629 1.00 . A A . 41 SER HB2 1 1 2 1215 1 1 41 SER HB3 H 4.431 7.398 -7.338 1.00 . A A . 41 SER HB3 1 1 2 1216 1 1 41 SER HG H 7.180 7.224 -6.783 1.00 . A A . 41 SER HG 1 1 2 1217 1 1 41 SER N N 7.225 8.920 -8.479 1.00 . A A . 41 SER N 1 1 2 1218 1 1 41 SER O O 3.766 9.256 -8.937 1.00 . A A . 41 SER O 1 1 2 1219 1 1 41 SER OG O 6.274 7.002 -6.557 1.00 . A A . 41 SER OG 1 1 2 1220 1 1 42 GLY C C 5.159 12.091 -11.352 1.00 . A A . 42 GLY C 1 1 2 1221 1 1 42 GLY CA C 4.534 10.728 -11.128 1.00 . A A . 42 GLY CA 1 1 2 1222 1 1 42 GLY H H 6.336 9.730 -10.635 1.00 . A A . 42 GLY H 1 1 2 1223 1 1 42 GLY HA2 H 4.324 10.278 -12.087 1.00 . A A . 42 GLY HA2 1 1 2 1224 1 1 42 GLY HA3 H 3.607 10.854 -10.589 1.00 . A A . 42 GLY HA3 1 1 2 1225 1 1 42 GLY N N 5.397 9.839 -10.372 1.00 . A A . 42 GLY N 1 1 2 1226 1 1 42 GLY O O 6.113 12.479 -10.677 1.00 . A A . 42 GLY O 1 1 2 1227 1 1 43 PRO C C 4.811 15.200 -11.563 1.00 . A A . 43 PRO C 1 1 2 1228 1 1 43 PRO CA C 5.112 14.181 -12.656 1.00 . A A . 43 PRO CA 1 1 2 1229 1 1 43 PRO CB C 4.352 14.530 -13.938 1.00 . A A . 43 PRO CB 1 1 2 1230 1 1 43 PRO CD C 3.479 12.443 -13.167 1.00 . A A . 43 PRO CD 1 1 2 1231 1 1 43 PRO CG C 3.106 13.717 -13.873 1.00 . A A . 43 PRO CG 1 1 2 1232 1 1 43 PRO HA H 6.174 14.172 -12.857 1.00 . A A . 43 PRO HA 1 1 2 1233 1 1 43 PRO HB2 H 4.134 15.589 -13.953 1.00 . A A . 43 PRO HB2 1 1 2 1234 1 1 43 PRO HB3 H 4.950 14.268 -14.798 1.00 . A A . 43 PRO HB3 1 1 2 1235 1 1 43 PRO HD2 H 2.655 12.091 -12.563 1.00 . A A . 43 PRO HD2 1 1 2 1236 1 1 43 PRO HD3 H 3.775 11.688 -13.881 1.00 . A A . 43 PRO HD3 1 1 2 1237 1 1 43 PRO HG2 H 2.350 14.248 -13.315 1.00 . A A . 43 PRO HG2 1 1 2 1238 1 1 43 PRO HG3 H 2.755 13.502 -14.872 1.00 . A A . 43 PRO HG3 1 1 2 1239 1 1 43 PRO N N 4.617 12.842 -12.322 1.00 . A A . 43 PRO N 1 1 2 1240 1 1 43 PRO O O 5.503 16.210 -11.436 1.00 . A A . 43 PRO O 1 1 2 1241 1 1 44 SER C C 3.422 17.280 -10.154 1.00 . A A . 44 SER C 1 1 2 1242 1 1 44 SER CA C 3.379 15.825 -9.697 1.00 . A A . 44 SER CA 1 1 2 1243 1 1 44 SER CB C 4.294 15.632 -8.486 1.00 . A A . 44 SER CB 1 1 2 1244 1 1 44 SER H H 3.261 14.108 -10.929 1.00 . A A . 44 SER H 1 1 2 1245 1 1 44 SER HA H 2.367 15.578 -9.415 1.00 . A A . 44 SER HA 1 1 2 1246 1 1 44 SER HB2 H 3.975 16.287 -7.689 1.00 . A A . 44 SER HB2 1 1 2 1247 1 1 44 SER HB3 H 4.236 14.605 -8.154 1.00 . A A . 44 SER HB3 1 1 2 1248 1 1 44 SER HG H 6.181 15.880 -8.019 1.00 . A A . 44 SER HG 1 1 2 1249 1 1 44 SER N N 3.774 14.929 -10.777 1.00 . A A . 44 SER N 1 1 2 1250 1 1 44 SER O O 3.878 18.159 -9.423 1.00 . A A . 44 SER O 1 1 2 1251 1 1 44 SER OG O 5.641 15.931 -8.811 1.00 . A A . 44 SER OG 1 1 2 1252 1 1 45 SER C C 1.529 19.470 -11.871 1.00 . A A . 45 SER C 1 1 2 1253 1 1 45 SER CA C 2.931 18.872 -11.928 1.00 . A A . 45 SER CA 1 1 2 1254 1 1 45 SER CB C 3.431 18.853 -13.374 1.00 . A A . 45 SER CB 1 1 2 1255 1 1 45 SER H H 2.595 16.782 -11.905 1.00 . A A . 45 SER H 1 1 2 1256 1 1 45 SER HA H 3.595 19.484 -11.335 1.00 . A A . 45 SER HA 1 1 2 1257 1 1 45 SER HB2 H 3.071 17.962 -13.865 1.00 . A A . 45 SER HB2 1 1 2 1258 1 1 45 SER HB3 H 3.059 19.725 -13.892 1.00 . A A . 45 SER HB3 1 1 2 1259 1 1 45 SER HG H 5.152 19.721 -13.723 1.00 . A A . 45 SER HG 1 1 2 1260 1 1 45 SER N N 2.944 17.525 -11.370 1.00 . A A . 45 SER N 1 1 2 1261 1 1 45 SER O O 0.560 18.853 -12.312 1.00 . A A . 45 SER O 1 1 2 1262 1 1 45 SER OG O 4.847 18.861 -13.424 1.00 . A A . 45 SER OG 1 1 2 1263 1 1 46 GLY C C -0.731 20.741 -10.135 1.00 . A A . 46 GLY C 1 1 2 1264 1 1 46 GLY CA C 0.142 21.341 -11.218 1.00 . A A . 46 GLY CA 1 1 2 1265 1 1 46 GLY H H 2.236 21.123 -10.990 1.00 . A A . 46 GLY H 1 1 2 1266 1 1 46 GLY HA2 H 0.304 22.385 -10.999 1.00 . A A . 46 GLY HA2 1 1 2 1267 1 1 46 GLY HA3 H -0.371 21.258 -12.165 1.00 . A A . 46 GLY HA3 1 1 2 1268 1 1 46 GLY N N 1.429 20.678 -11.324 1.00 . A A . 46 GLY N 1 1 2 1269 1 1 46 GLY O O -0.788 19.517 -10.020 1.00 . A A . 46 GLY O 1 1 2 1270 2 2 1 ZN ZN ZN 6.392 -0.864 3.876 1.00 . B A . 181 ZN ZN 1 1 3 1271 1 1 1 GLY C C 6.479 -30.758 -1.575 1.00 . A A . 1 GLY C 1 1 3 1272 1 1 1 GLY CA C 7.162 -31.197 -0.295 1.00 . A A . 1 GLY CA 1 1 3 1273 1 1 1 GLY H1 H 9.158 -31.561 0.312 1.00 . A A . 1 GLY H1 1 1 3 1274 1 1 1 GLY HA2 H 6.711 -32.117 0.044 1.00 . A A . 1 GLY HA2 1 1 3 1275 1 1 1 GLY HA3 H 7.013 -30.436 0.457 1.00 . A A . 1 GLY HA3 1 1 3 1276 1 1 1 GLY N N 8.587 -31.410 -0.470 1.00 . A A . 1 GLY N 1 1 3 1277 1 1 1 GLY O O 6.297 -29.564 -1.811 1.00 . A A . 1 GLY O 1 1 3 1278 1 1 2 SER C C 4.447 -30.286 -3.512 1.00 . A A . 2 SER C 1 1 3 1279 1 1 2 SER CA C 5.441 -31.433 -3.671 1.00 . A A . 2 SER CA 1 1 3 1280 1 1 2 SER CB C 4.722 -32.677 -4.195 1.00 . A A . 2 SER CB 1 1 3 1281 1 1 2 SER H H 6.276 -32.659 -2.160 1.00 . A A . 2 SER H 1 1 3 1282 1 1 2 SER HA H 6.200 -31.140 -4.381 1.00 . A A . 2 SER HA 1 1 3 1283 1 1 2 SER HB2 H 4.026 -33.029 -3.448 1.00 . A A . 2 SER HB2 1 1 3 1284 1 1 2 SER HB3 H 4.184 -32.425 -5.098 1.00 . A A . 2 SER HB3 1 1 3 1285 1 1 2 SER HG H 5.651 -34.346 -3.763 1.00 . A A . 2 SER HG 1 1 3 1286 1 1 2 SER N N 6.102 -31.726 -2.405 1.00 . A A . 2 SER N 1 1 3 1287 1 1 2 SER O O 4.389 -29.380 -4.344 1.00 . A A . 2 SER O 1 1 3 1288 1 1 2 SER OG O 5.643 -33.714 -4.485 1.00 . A A . 2 SER OG 1 1 3 1289 1 1 3 SER C C 3.261 -28.190 -1.304 1.00 . A A . 3 SER C 1 1 3 1290 1 1 3 SER CA C 2.672 -29.300 -2.170 1.00 . A A . 3 SER CA 1 1 3 1291 1 1 3 SER CB C 1.450 -29.907 -1.478 1.00 . A A . 3 SER CB 1 1 3 1292 1 1 3 SER H H 3.761 -31.080 -1.810 1.00 . A A . 3 SER H 1 1 3 1293 1 1 3 SER HA H 2.368 -28.879 -3.117 1.00 . A A . 3 SER HA 1 1 3 1294 1 1 3 SER HB2 H 0.672 -29.162 -1.410 1.00 . A A . 3 SER HB2 1 1 3 1295 1 1 3 SER HB3 H 1.094 -30.748 -2.056 1.00 . A A . 3 SER HB3 1 1 3 1296 1 1 3 SER HG H 2.120 -31.246 -0.216 1.00 . A A . 3 SER HG 1 1 3 1297 1 1 3 SER N N 3.667 -30.332 -2.437 1.00 . A A . 3 SER N 1 1 3 1298 1 1 3 SER O O 3.470 -28.367 -0.105 1.00 . A A . 3 SER O 1 1 3 1299 1 1 3 SER OG O 1.771 -30.353 -0.172 1.00 . A A . 3 SER OG 1 1 3 1300 1 1 4 GLY C C 3.944 -24.612 -1.948 1.00 . A A . 4 GLY C 1 1 3 1301 1 1 4 GLY CA C 4.087 -25.920 -1.196 1.00 . A A . 4 GLY CA 1 1 3 1302 1 1 4 GLY H H 3.338 -26.959 -2.882 1.00 . A A . 4 GLY H 1 1 3 1303 1 1 4 GLY HA2 H 3.584 -25.833 -0.245 1.00 . A A . 4 GLY HA2 1 1 3 1304 1 1 4 GLY HA3 H 5.137 -26.108 -1.021 1.00 . A A . 4 GLY HA3 1 1 3 1305 1 1 4 GLY N N 3.525 -27.043 -1.923 1.00 . A A . 4 GLY N 1 1 3 1306 1 1 4 GLY O O 4.539 -24.430 -3.010 1.00 . A A . 4 GLY O 1 1 3 1307 1 1 5 SER C C 2.716 -21.317 -0.975 1.00 . A A . 5 SER C 1 1 3 1308 1 1 5 SER CA C 2.927 -22.402 -2.027 1.00 . A A . 5 SER CA 1 1 3 1309 1 1 5 SER CB C 1.715 -22.466 -2.958 1.00 . A A . 5 SER CB 1 1 3 1310 1 1 5 SER H H 2.704 -23.902 -0.549 1.00 . A A . 5 SER H 1 1 3 1311 1 1 5 SER HA H 3.804 -22.159 -2.607 1.00 . A A . 5 SER HA 1 1 3 1312 1 1 5 SER HB2 H 1.655 -23.450 -3.399 1.00 . A A . 5 SER HB2 1 1 3 1313 1 1 5 SER HB3 H 0.817 -22.270 -2.391 1.00 . A A . 5 SER HB3 1 1 3 1314 1 1 5 SER HG H 2.742 -21.386 -4.230 1.00 . A A . 5 SER HG 1 1 3 1315 1 1 5 SER N N 3.151 -23.698 -1.398 1.00 . A A . 5 SER N 1 1 3 1316 1 1 5 SER O O 2.189 -21.579 0.106 1.00 . A A . 5 SER O 1 1 3 1317 1 1 5 SER OG O 1.818 -21.507 -3.996 1.00 . A A . 5 SER OG 1 1 3 1318 1 1 6 SER C C 2.049 -17.919 -0.954 1.00 . A A . 6 SER C 1 1 3 1319 1 1 6 SER CA C 2.994 -18.972 -0.383 1.00 . A A . 6 SER CA 1 1 3 1320 1 1 6 SER CB C 4.361 -18.347 -0.099 1.00 . A A . 6 SER CB 1 1 3 1321 1 1 6 SER H H 3.545 -19.952 -2.177 1.00 . A A . 6 SER H 1 1 3 1322 1 1 6 SER HA H 2.580 -19.347 0.541 1.00 . A A . 6 SER HA 1 1 3 1323 1 1 6 SER HB2 H 4.793 -17.997 -1.023 1.00 . A A . 6 SER HB2 1 1 3 1324 1 1 6 SER HB3 H 4.239 -17.515 0.580 1.00 . A A . 6 SER HB3 1 1 3 1325 1 1 6 SER HG H 6.108 -19.214 0.084 1.00 . A A . 6 SER HG 1 1 3 1326 1 1 6 SER N N 3.132 -20.097 -1.300 1.00 . A A . 6 SER N 1 1 3 1327 1 1 6 SER O O 2.109 -17.592 -2.138 1.00 . A A . 6 SER O 1 1 3 1328 1 1 6 SER OG O 5.241 -19.290 0.489 1.00 . A A . 6 SER OG 1 1 3 1329 1 1 7 GLY C C 0.149 -15.210 0.421 1.00 . A A . 7 GLY C 1 1 3 1330 1 1 7 GLY CA C 0.230 -16.381 -0.538 1.00 . A A . 7 GLY CA 1 1 3 1331 1 1 7 GLY H H 1.173 -17.691 0.832 1.00 . A A . 7 GLY H 1 1 3 1332 1 1 7 GLY HA2 H 0.531 -16.017 -1.509 1.00 . A A . 7 GLY HA2 1 1 3 1333 1 1 7 GLY HA3 H -0.748 -16.832 -0.621 1.00 . A A . 7 GLY HA3 1 1 3 1334 1 1 7 GLY N N 1.176 -17.391 -0.101 1.00 . A A . 7 GLY N 1 1 3 1335 1 1 7 GLY O O 0.694 -14.139 0.153 1.00 . A A . 7 GLY O 1 1 3 1336 1 1 8 THR C C -1.548 -13.220 2.014 1.00 . A A . 8 THR C 1 1 3 1337 1 1 8 THR CA C -0.690 -14.364 2.543 1.00 . A A . 8 THR CA 1 1 3 1338 1 1 8 THR CB C 0.675 -13.805 2.985 1.00 . A A . 8 THR CB 1 1 3 1339 1 1 8 THR CG2 C 0.521 -12.891 4.192 1.00 . A A . 8 THR CG2 1 1 3 1340 1 1 8 THR H H -0.948 -16.287 1.699 1.00 . A A . 8 THR H 1 1 3 1341 1 1 8 THR HA H -1.176 -14.795 3.406 1.00 . A A . 8 THR HA 1 1 3 1342 1 1 8 THR HB H 1.094 -13.232 2.170 1.00 . A A . 8 THR HB 1 1 3 1343 1 1 8 THR HG1 H 1.498 -15.082 4.243 1.00 . A A . 8 THR HG1 1 1 3 1344 1 1 8 THR HG21 H 1.413 -12.941 4.797 1.00 . A A . 8 THR HG21 1 1 3 1345 1 1 8 THR HG22 H -0.330 -13.208 4.777 1.00 . A A . 8 THR HG22 1 1 3 1346 1 1 8 THR HG23 H 0.369 -11.875 3.857 1.00 . A A . 8 THR HG23 1 1 3 1347 1 1 8 THR N N -0.536 -15.412 1.542 1.00 . A A . 8 THR N 1 1 3 1348 1 1 8 THR O O -1.290 -12.052 2.303 1.00 . A A . 8 THR O 1 1 3 1349 1 1 8 THR OG1 O 1.564 -14.880 3.306 1.00 . A A . 8 THR OG1 1 1 3 1350 1 1 9 GLY C C -4.720 -12.379 1.491 1.00 . A A . 9 GLY C 1 1 3 1351 1 1 9 GLY CA C -3.451 -12.553 0.680 1.00 . A A . 9 GLY CA 1 1 3 1352 1 1 9 GLY H H -2.728 -14.510 1.039 1.00 . A A . 9 GLY H 1 1 3 1353 1 1 9 GLY HA2 H -2.924 -11.611 0.647 1.00 . A A . 9 GLY HA2 1 1 3 1354 1 1 9 GLY HA3 H -3.718 -12.840 -0.327 1.00 . A A . 9 GLY HA3 1 1 3 1355 1 1 9 GLY N N -2.570 -13.563 1.236 1.00 . A A . 9 GLY N 1 1 3 1356 1 1 9 GLY O O -5.734 -13.017 1.212 1.00 . A A . 9 GLY O 1 1 3 1357 1 1 10 GLU C C -6.474 -9.930 3.000 1.00 . A A . 10 GLU C 1 1 3 1358 1 1 10 GLU CA C -5.816 -11.260 3.353 1.00 . A A . 10 GLU CA 1 1 3 1359 1 1 10 GLU CB C -5.397 -11.259 4.825 1.00 . A A . 10 GLU CB 1 1 3 1360 1 1 10 GLU CD C -4.052 -12.528 6.546 1.00 . A A . 10 GLU CD 1 1 3 1361 1 1 10 GLU CG C -4.957 -12.622 5.333 1.00 . A A . 10 GLU CG 1 1 3 1362 1 1 10 GLU H H -3.825 -11.035 2.670 1.00 . A A . 10 GLU H 1 1 3 1363 1 1 10 GLU HA H -6.529 -12.055 3.192 1.00 . A A . 10 GLU HA 1 1 3 1364 1 1 10 GLU HB2 H -4.578 -10.568 4.954 1.00 . A A . 10 GLU HB2 1 1 3 1365 1 1 10 GLU HB3 H -6.233 -10.928 5.424 1.00 . A A . 10 GLU HB3 1 1 3 1366 1 1 10 GLU HG2 H -5.834 -13.193 5.601 1.00 . A A . 10 GLU HG2 1 1 3 1367 1 1 10 GLU HG3 H -4.424 -13.132 4.544 1.00 . A A . 10 GLU HG3 1 1 3 1368 1 1 10 GLU N N -4.662 -11.513 2.498 1.00 . A A . 10 GLU N 1 1 3 1369 1 1 10 GLU O O -7.660 -9.722 3.257 1.00 . A A . 10 GLU O 1 1 3 1370 1 1 10 GLU OE1 O -4.278 -11.631 7.386 1.00 . A A . 10 GLU OE1 1 1 3 1371 1 1 10 GLU OE2 O -3.118 -13.349 6.656 1.00 . A A . 10 GLU OE2 1 1 3 1372 1 1 11 LYS C C -5.633 -7.299 0.664 1.00 . A A . 11 LYS C 1 1 3 1373 1 1 11 LYS CA C -6.200 -7.719 2.017 1.00 . A A . 11 LYS CA 1 1 3 1374 1 1 11 LYS CB C -5.843 -6.676 3.078 1.00 . A A . 11 LYS CB 1 1 3 1375 1 1 11 LYS CD C -5.734 -7.793 5.325 1.00 . A A . 11 LYS CD 1 1 3 1376 1 1 11 LYS CE C -6.357 -7.883 6.710 1.00 . A A . 11 LYS CE 1 1 3 1377 1 1 11 LYS CG C -6.546 -6.895 4.407 1.00 . A A . 11 LYS CG 1 1 3 1378 1 1 11 LYS H H -4.757 -9.255 2.228 1.00 . A A . 11 LYS H 1 1 3 1379 1 1 11 LYS HA H -7.274 -7.787 1.938 1.00 . A A . 11 LYS HA 1 1 3 1380 1 1 11 LYS HB2 H -4.777 -6.704 3.249 1.00 . A A . 11 LYS HB2 1 1 3 1381 1 1 11 LYS HB3 H -6.114 -5.697 2.708 1.00 . A A . 11 LYS HB3 1 1 3 1382 1 1 11 LYS HD2 H -5.689 -8.784 4.898 1.00 . A A . 11 LYS HD2 1 1 3 1383 1 1 11 LYS HD3 H -4.734 -7.392 5.415 1.00 . A A . 11 LYS HD3 1 1 3 1384 1 1 11 LYS HE2 H -5.656 -8.362 7.375 1.00 . A A . 11 LYS HE2 1 1 3 1385 1 1 11 LYS HE3 H -6.563 -6.883 7.063 1.00 . A A . 11 LYS HE3 1 1 3 1386 1 1 11 LYS HG2 H -6.689 -5.940 4.889 1.00 . A A . 11 LYS HG2 1 1 3 1387 1 1 11 LYS HG3 H -7.506 -7.356 4.224 1.00 . A A . 11 LYS HG3 1 1 3 1388 1 1 11 LYS HZ1 H -8.392 -8.108 7.127 1.00 . A A . 11 LYS HZ1 1 1 3 1389 1 1 11 LYS HZ2 H -7.506 -9.545 7.237 1.00 . A A . 11 LYS HZ2 1 1 3 1390 1 1 11 LYS HZ3 H -7.889 -8.902 5.720 1.00 . A A . 11 LYS HZ3 1 1 3 1391 1 1 11 LYS N N -5.695 -9.030 2.408 1.00 . A A . 11 LYS N 1 1 3 1392 1 1 11 LYS NZ N -7.625 -8.664 6.698 1.00 . A A . 11 LYS NZ 1 1 3 1393 1 1 11 LYS O O -4.500 -7.626 0.311 1.00 . A A . 11 LYS O 1 1 3 1394 1 1 12 PRO C C -4.956 -5.000 -1.358 1.00 . A A . 12 PRO C 1 1 3 1395 1 1 12 PRO CA C -6.036 -6.074 -1.435 1.00 . A A . 12 PRO CA 1 1 3 1396 1 1 12 PRO CB C -7.330 -5.490 -2.007 1.00 . A A . 12 PRO CB 1 1 3 1397 1 1 12 PRO CD C -7.800 -6.130 0.248 1.00 . A A . 12 PRO CD 1 1 3 1398 1 1 12 PRO CG C -8.138 -5.118 -0.812 1.00 . A A . 12 PRO CG 1 1 3 1399 1 1 12 PRO HA H -5.694 -6.882 -2.065 1.00 . A A . 12 PRO HA 1 1 3 1400 1 1 12 PRO HB2 H -7.100 -4.626 -2.614 1.00 . A A . 12 PRO HB2 1 1 3 1401 1 1 12 PRO HB3 H -7.831 -6.235 -2.606 1.00 . A A . 12 PRO HB3 1 1 3 1402 1 1 12 PRO HD2 H -7.817 -5.671 1.225 1.00 . A A . 12 PRO HD2 1 1 3 1403 1 1 12 PRO HD3 H -8.487 -6.962 0.207 1.00 . A A . 12 PRO HD3 1 1 3 1404 1 1 12 PRO HG2 H -7.871 -4.126 -0.483 1.00 . A A . 12 PRO HG2 1 1 3 1405 1 1 12 PRO HG3 H -9.190 -5.164 -1.052 1.00 . A A . 12 PRO HG3 1 1 3 1406 1 1 12 PRO N N -6.437 -6.556 -0.110 1.00 . A A . 12 PRO N 1 1 3 1407 1 1 12 PRO O O -4.471 -4.519 -2.382 1.00 . A A . 12 PRO O 1 1 3 1408 1 1 13 TYR C C -2.313 -4.214 0.712 1.00 . A A . 13 TYR C 1 1 3 1409 1 1 13 TYR CA C -3.560 -3.611 0.072 1.00 . A A . 13 TYR CA 1 1 3 1410 1 1 13 TYR CB C -4.105 -2.486 0.953 1.00 . A A . 13 TYR CB 1 1 3 1411 1 1 13 TYR CD1 C -6.072 -1.929 -0.530 1.00 . A A . 13 TYR CD1 1 1 3 1412 1 1 13 TYR CD2 C -6.469 -2.221 1.802 1.00 . A A . 13 TYR CD2 1 1 3 1413 1 1 13 TYR CE1 C -7.415 -1.673 -0.731 1.00 . A A . 13 TYR CE1 1 1 3 1414 1 1 13 TYR CE2 C -7.813 -1.967 1.610 1.00 . A A . 13 TYR CE2 1 1 3 1415 1 1 13 TYR CG C -5.576 -2.207 0.738 1.00 . A A . 13 TYR CG 1 1 3 1416 1 1 13 TYR CZ C -8.281 -1.693 0.342 1.00 . A A . 13 TYR CZ 1 1 3 1417 1 1 13 TYR H H -5.005 -5.050 0.640 1.00 . A A . 13 TYR H 1 1 3 1418 1 1 13 TYR HA H -3.295 -3.204 -0.892 1.00 . A A . 13 TYR HA 1 1 3 1419 1 1 13 TYR HB2 H -3.967 -2.750 1.990 1.00 . A A . 13 TYR HB2 1 1 3 1420 1 1 13 TYR HB3 H -3.561 -1.577 0.743 1.00 . A A . 13 TYR HB3 1 1 3 1421 1 1 13 TYR HD1 H -5.391 -1.914 -1.368 1.00 . A A . 13 TYR HD1 1 1 3 1422 1 1 13 TYR HD2 H -6.099 -2.436 2.794 1.00 . A A . 13 TYR HD2 1 1 3 1423 1 1 13 TYR HE1 H -7.781 -1.458 -1.724 1.00 . A A . 13 TYR HE1 1 1 3 1424 1 1 13 TYR HE2 H -8.492 -1.983 2.450 1.00 . A A . 13 TYR HE2 1 1 3 1425 1 1 13 TYR HH H -10.121 -1.775 0.893 1.00 . A A . 13 TYR HH 1 1 3 1426 1 1 13 TYR N N -4.582 -4.630 -0.138 1.00 . A A . 13 TYR N 1 1 3 1427 1 1 13 TYR O O -2.309 -4.543 1.898 1.00 . A A . 13 TYR O 1 1 3 1428 1 1 13 TYR OH O -9.619 -1.440 0.146 1.00 . A A . 13 TYR OH 1 1 3 1429 1 1 14 GLU C C 1.187 -4.099 -0.081 1.00 . A A . 14 GLU C 1 1 3 1430 1 1 14 GLU CA C -0.004 -4.920 0.405 1.00 . A A . 14 GLU CA 1 1 3 1431 1 1 14 GLU CB C 0.141 -6.372 -0.056 1.00 . A A . 14 GLU CB 1 1 3 1432 1 1 14 GLU CD C 0.142 -7.897 1.958 1.00 . A A . 14 GLU CD 1 1 3 1433 1 1 14 GLU CG C 0.976 -7.227 0.883 1.00 . A A . 14 GLU CG 1 1 3 1434 1 1 14 GLU H H -1.323 -4.075 -1.020 1.00 . A A . 14 GLU H 1 1 3 1435 1 1 14 GLU HA H -0.028 -4.895 1.484 1.00 . A A . 14 GLU HA 1 1 3 1436 1 1 14 GLU HB2 H -0.842 -6.812 -0.133 1.00 . A A . 14 GLU HB2 1 1 3 1437 1 1 14 GLU HB3 H 0.608 -6.382 -1.029 1.00 . A A . 14 GLU HB3 1 1 3 1438 1 1 14 GLU HG2 H 1.473 -7.992 0.306 1.00 . A A . 14 GLU HG2 1 1 3 1439 1 1 14 GLU HG3 H 1.715 -6.600 1.359 1.00 . A A . 14 GLU HG3 1 1 3 1440 1 1 14 GLU N N -1.258 -4.356 -0.083 1.00 . A A . 14 GLU N 1 1 3 1441 1 1 14 GLU O O 1.214 -3.638 -1.222 1.00 . A A . 14 GLU O 1 1 3 1442 1 1 14 GLU OE1 O -1.026 -7.494 2.140 1.00 . A A . 14 GLU OE1 1 1 3 1443 1 1 14 GLU OE2 O 0.657 -8.824 2.617 1.00 . A A . 14 GLU OE2 1 1 3 1444 1 1 15 CYS C C 4.311 -3.978 -0.411 1.00 . A A . 15 CYS C 1 1 3 1445 1 1 15 CYS CA C 3.365 -3.155 0.458 1.00 . A A . 15 CYS CA 1 1 3 1446 1 1 15 CYS CB C 4.084 -2.706 1.732 1.00 . A A . 15 CYS CB 1 1 3 1447 1 1 15 CYS H H 2.091 -4.313 1.690 1.00 . A A . 15 CYS H 1 1 3 1448 1 1 15 CYS HA H 3.055 -2.282 -0.096 1.00 . A A . 15 CYS HA 1 1 3 1449 1 1 15 CYS HB2 H 3.356 -2.571 2.518 1.00 . A A . 15 CYS HB2 1 1 3 1450 1 1 15 CYS HB3 H 4.788 -3.470 2.026 1.00 . A A . 15 CYS HB3 1 1 3 1451 1 1 15 CYS N N 2.171 -3.920 0.795 1.00 . A A . 15 CYS N 1 1 3 1452 1 1 15 CYS O O 4.085 -5.166 -0.641 1.00 . A A . 15 CYS O 1 1 3 1453 1 1 15 CYS SG S 5.003 -1.143 1.555 1.00 . A A . 15 CYS SG 1 1 3 1454 1 1 16 ASP C C 7.698 -4.122 -1.019 1.00 . A A . 16 ASP C 1 1 3 1455 1 1 16 ASP CA C 6.354 -4.010 -1.733 1.00 . A A . 16 ASP CA 1 1 3 1456 1 1 16 ASP CB C 6.526 -3.258 -3.053 1.00 . A A . 16 ASP CB 1 1 3 1457 1 1 16 ASP CG C 7.555 -3.904 -3.959 1.00 . A A . 16 ASP CG 1 1 3 1458 1 1 16 ASP H H 5.498 -2.391 -0.672 1.00 . A A . 16 ASP H 1 1 3 1459 1 1 16 ASP HA H 5.988 -5.004 -1.941 1.00 . A A . 16 ASP HA 1 1 3 1460 1 1 16 ASP HB2 H 5.579 -3.237 -3.574 1.00 . A A . 16 ASP HB2 1 1 3 1461 1 1 16 ASP HB3 H 6.840 -2.246 -2.845 1.00 . A A . 16 ASP HB3 1 1 3 1462 1 1 16 ASP N N 5.372 -3.338 -0.890 1.00 . A A . 16 ASP N 1 1 3 1463 1 1 16 ASP O O 8.300 -5.194 -0.970 1.00 . A A . 16 ASP O 1 1 3 1464 1 1 16 ASP OD1 O 7.177 -4.801 -4.743 1.00 . A A . 16 ASP OD1 1 1 3 1465 1 1 16 ASP OD2 O 8.739 -3.514 -3.885 1.00 . A A . 16 ASP OD2 1 1 3 1466 1 1 17 VAL C C 9.412 -3.912 1.449 1.00 . A A . 17 VAL C 1 1 3 1467 1 1 17 VAL CA C 9.435 -2.977 0.245 1.00 . A A . 17 VAL CA 1 1 3 1468 1 1 17 VAL CB C 9.781 -1.554 0.721 1.00 . A A . 17 VAL CB 1 1 3 1469 1 1 17 VAL CG1 C 11.067 -1.560 1.533 1.00 . A A . 17 VAL CG1 1 1 3 1470 1 1 17 VAL CG2 C 9.894 -0.609 -0.466 1.00 . A A . 17 VAL CG2 1 1 3 1471 1 1 17 VAL H H 7.638 -2.181 -0.539 1.00 . A A . 17 VAL H 1 1 3 1472 1 1 17 VAL HA H 10.207 -3.303 -0.437 1.00 . A A . 17 VAL HA 1 1 3 1473 1 1 17 VAL HB H 8.981 -1.205 1.357 1.00 . A A . 17 VAL HB 1 1 3 1474 1 1 17 VAL HG11 H 11.393 -0.543 1.698 1.00 . A A . 17 VAL HG11 1 1 3 1475 1 1 17 VAL HG12 H 10.890 -2.040 2.484 1.00 . A A . 17 VAL HG12 1 1 3 1476 1 1 17 VAL HG13 H 11.831 -2.099 0.994 1.00 . A A . 17 VAL HG13 1 1 3 1477 1 1 17 VAL HG21 H 9.415 0.329 -0.227 1.00 . A A . 17 VAL HG21 1 1 3 1478 1 1 17 VAL HG22 H 10.937 -0.435 -0.688 1.00 . A A . 17 VAL HG22 1 1 3 1479 1 1 17 VAL HG23 H 9.412 -1.050 -1.326 1.00 . A A . 17 VAL HG23 1 1 3 1480 1 1 17 VAL N N 8.163 -3.005 -0.467 1.00 . A A . 17 VAL N 1 1 3 1481 1 1 17 VAL O O 10.233 -4.824 1.557 1.00 . A A . 17 VAL O 1 1 3 1482 1 1 18 CYS C C 7.346 -5.642 3.323 1.00 . A A . 18 CYS C 1 1 3 1483 1 1 18 CYS CA C 8.334 -4.502 3.550 1.00 . A A . 18 CYS CA 1 1 3 1484 1 1 18 CYS CB C 7.878 -3.646 4.734 1.00 . A A . 18 CYS CB 1 1 3 1485 1 1 18 CYS H H 7.840 -2.939 2.211 1.00 . A A . 18 CYS H 1 1 3 1486 1 1 18 CYS HA H 9.303 -4.921 3.773 1.00 . A A . 18 CYS HA 1 1 3 1487 1 1 18 CYS HB2 H 7.997 -4.213 5.645 1.00 . A A . 18 CYS HB2 1 1 3 1488 1 1 18 CYS HB3 H 8.493 -2.759 4.785 1.00 . A A . 18 CYS HB3 1 1 3 1489 1 1 18 CYS N N 8.466 -3.681 2.353 1.00 . A A . 18 CYS N 1 1 3 1490 1 1 18 CYS O O 7.394 -6.665 4.006 1.00 . A A . 18 CYS O 1 1 3 1491 1 1 18 CYS SG S 6.140 -3.111 4.638 1.00 . A A . 18 CYS SG 1 1 3 1492 1 1 19 ARG C C 4.500 -6.682 3.215 1.00 . A A . 19 ARG C 1 1 3 1493 1 1 19 ARG CA C 5.451 -6.469 2.040 1.00 . A A . 19 ARG CA 1 1 3 1494 1 1 19 ARG CB C 6.129 -7.790 1.673 1.00 . A A . 19 ARG CB 1 1 3 1495 1 1 19 ARG CD C 6.279 -7.596 -0.828 1.00 . A A . 19 ARG CD 1 1 3 1496 1 1 19 ARG CG C 7.058 -7.686 0.474 1.00 . A A . 19 ARG CG 1 1 3 1497 1 1 19 ARG CZ C 6.536 -9.753 -1.979 1.00 . A A . 19 ARG CZ 1 1 3 1498 1 1 19 ARG H H 6.463 -4.621 1.847 1.00 . A A . 19 ARG H 1 1 3 1499 1 1 19 ARG HA H 4.882 -6.119 1.191 1.00 . A A . 19 ARG HA 1 1 3 1500 1 1 19 ARG HB2 H 6.707 -8.132 2.519 1.00 . A A . 19 ARG HB2 1 1 3 1501 1 1 19 ARG HB3 H 5.367 -8.522 1.448 1.00 . A A . 19 ARG HB3 1 1 3 1502 1 1 19 ARG HD2 H 5.430 -6.944 -0.681 1.00 . A A . 19 ARG HD2 1 1 3 1503 1 1 19 ARG HD3 H 6.923 -7.181 -1.589 1.00 . A A . 19 ARG HD3 1 1 3 1504 1 1 19 ARG HE H 4.886 -9.157 -1.030 1.00 . A A . 19 ARG HE 1 1 3 1505 1 1 19 ARG HG2 H 7.666 -6.799 0.579 1.00 . A A . 19 ARG HG2 1 1 3 1506 1 1 19 ARG HG3 H 7.692 -8.559 0.445 1.00 . A A . 19 ARG HG3 1 1 3 1507 1 1 19 ARG HH11 H 8.161 -8.555 -2.046 1.00 . A A . 19 ARG HH11 1 1 3 1508 1 1 19 ARG HH12 H 8.330 -10.078 -2.852 1.00 . A A . 19 ARG HH12 1 1 3 1509 1 1 19 ARG HH21 H 5.096 -11.167 -2.089 1.00 . A A . 19 ARG HH21 1 1 3 1510 1 1 19 ARG HH22 H 6.585 -11.563 -2.877 1.00 . A A . 19 ARG HH22 1 1 3 1511 1 1 19 ARG N N 6.451 -5.457 2.357 1.00 . A A . 19 ARG N 1 1 3 1512 1 1 19 ARG NE N 5.801 -8.903 -1.272 1.00 . A A . 19 ARG NE 1 1 3 1513 1 1 19 ARG NH1 N 7.777 -9.436 -2.321 1.00 . A A . 19 ARG NH1 1 1 3 1514 1 1 19 ARG NH2 N 6.031 -10.924 -2.345 1.00 . A A . 19 ARG NH2 1 1 3 1515 1 1 19 ARG O O 4.269 -7.813 3.643 1.00 . A A . 19 ARG O 1 1 3 1516 1 1 20 LYS C C 1.581 -5.616 4.374 1.00 . A A . 20 LYS C 1 1 3 1517 1 1 20 LYS CA C 3.028 -5.653 4.857 1.00 . A A . 20 LYS CA 1 1 3 1518 1 1 20 LYS CB C 3.284 -4.494 5.823 1.00 . A A . 20 LYS CB 1 1 3 1519 1 1 20 LYS CD C 3.024 -3.592 8.153 1.00 . A A . 20 LYS CD 1 1 3 1520 1 1 20 LYS CE C 2.043 -3.456 9.308 1.00 . A A . 20 LYS CE 1 1 3 1521 1 1 20 LYS CG C 2.563 -4.638 7.152 1.00 . A A . 20 LYS CG 1 1 3 1522 1 1 20 LYS H H 4.177 -4.714 3.347 1.00 . A A . 20 LYS H 1 1 3 1523 1 1 20 LYS HA H 3.198 -6.585 5.374 1.00 . A A . 20 LYS HA 1 1 3 1524 1 1 20 LYS HB2 H 4.345 -4.431 6.017 1.00 . A A . 20 LYS HB2 1 1 3 1525 1 1 20 LYS HB3 H 2.957 -3.575 5.358 1.00 . A A . 20 LYS HB3 1 1 3 1526 1 1 20 LYS HD2 H 3.987 -3.883 8.546 1.00 . A A . 20 LYS HD2 1 1 3 1527 1 1 20 LYS HD3 H 3.110 -2.639 7.651 1.00 . A A . 20 LYS HD3 1 1 3 1528 1 1 20 LYS HE2 H 2.278 -2.558 9.858 1.00 . A A . 20 LYS HE2 1 1 3 1529 1 1 20 LYS HE3 H 1.043 -3.381 8.906 1.00 . A A . 20 LYS HE3 1 1 3 1530 1 1 20 LYS HG2 H 1.502 -4.522 6.989 1.00 . A A . 20 LYS HG2 1 1 3 1531 1 1 20 LYS HG3 H 2.762 -5.621 7.554 1.00 . A A . 20 LYS HG3 1 1 3 1532 1 1 20 LYS HZ1 H 1.335 -4.573 10.925 1.00 . A A . 20 LYS HZ1 1 1 3 1533 1 1 20 LYS HZ2 H 3.016 -4.623 10.741 1.00 . A A . 20 LYS HZ2 1 1 3 1534 1 1 20 LYS HZ3 H 2.024 -5.508 9.696 1.00 . A A . 20 LYS HZ3 1 1 3 1535 1 1 20 LYS N N 3.953 -5.588 3.732 1.00 . A A . 20 LYS N 1 1 3 1536 1 1 20 LYS NZ N 2.109 -4.622 10.232 1.00 . A A . 20 LYS NZ 1 1 3 1537 1 1 20 LYS O O 1.279 -5.030 3.335 1.00 . A A . 20 LYS O 1 1 3 1538 1 1 21 ALA C C -1.523 -5.297 5.638 1.00 . A A . 21 ALA C 1 1 3 1539 1 1 21 ALA CA C -0.723 -6.279 4.788 1.00 . A A . 21 ALA CA 1 1 3 1540 1 1 21 ALA CB C -1.272 -7.689 4.949 1.00 . A A . 21 ALA CB 1 1 3 1541 1 1 21 ALA H H 0.994 -6.692 5.953 1.00 . A A . 21 ALA H 1 1 3 1542 1 1 21 ALA HA H -0.818 -5.999 3.748 1.00 . A A . 21 ALA HA 1 1 3 1543 1 1 21 ALA HB1 H -2.127 -7.818 4.304 1.00 . A A . 21 ALA HB1 1 1 3 1544 1 1 21 ALA HB2 H -0.507 -8.404 4.682 1.00 . A A . 21 ALA HB2 1 1 3 1545 1 1 21 ALA HB3 H -1.567 -7.844 5.976 1.00 . A A . 21 ALA HB3 1 1 3 1546 1 1 21 ALA N N 0.692 -6.243 5.136 1.00 . A A . 21 ALA N 1 1 3 1547 1 1 21 ALA O O -1.404 -5.282 6.863 1.00 . A A . 21 ALA O 1 1 3 1548 1 1 22 PHE C C -4.640 -3.743 5.425 1.00 . A A . 22 PHE C 1 1 3 1549 1 1 22 PHE CA C -3.156 -3.493 5.676 1.00 . A A . 22 PHE CA 1 1 3 1550 1 1 22 PHE CB C -2.782 -2.079 5.226 1.00 . A A . 22 PHE CB 1 1 3 1551 1 1 22 PHE CD1 C -0.383 -2.226 4.504 1.00 . A A . 22 PHE CD1 1 1 3 1552 1 1 22 PHE CD2 C -0.899 -0.990 6.477 1.00 . A A . 22 PHE CD2 1 1 3 1553 1 1 22 PHE CE1 C 0.958 -1.932 4.666 1.00 . A A . 22 PHE CE1 1 1 3 1554 1 1 22 PHE CE2 C 0.440 -0.692 6.644 1.00 . A A . 22 PHE CE2 1 1 3 1555 1 1 22 PHE CG C -1.326 -1.758 5.406 1.00 . A A . 22 PHE CG 1 1 3 1556 1 1 22 PHE CZ C 1.370 -1.165 5.738 1.00 . A A . 22 PHE CZ 1 1 3 1557 1 1 22 PHE H H -2.389 -4.539 4.003 1.00 . A A . 22 PHE H 1 1 3 1558 1 1 22 PHE HA H -2.961 -3.588 6.733 1.00 . A A . 22 PHE HA 1 1 3 1559 1 1 22 PHE HB2 H -3.019 -1.968 4.179 1.00 . A A . 22 PHE HB2 1 1 3 1560 1 1 22 PHE HB3 H -3.354 -1.364 5.798 1.00 . A A . 22 PHE HB3 1 1 3 1561 1 1 22 PHE HD1 H -0.705 -2.827 3.665 1.00 . A A . 22 PHE HD1 1 1 3 1562 1 1 22 PHE HD2 H -1.625 -0.620 7.186 1.00 . A A . 22 PHE HD2 1 1 3 1563 1 1 22 PHE HE1 H 1.682 -2.304 3.956 1.00 . A A . 22 PHE HE1 1 1 3 1564 1 1 22 PHE HE2 H 0.760 -0.093 7.483 1.00 . A A . 22 PHE HE2 1 1 3 1565 1 1 22 PHE HZ H 2.417 -0.934 5.866 1.00 . A A . 22 PHE HZ 1 1 3 1566 1 1 22 PHE N N -2.337 -4.479 4.980 1.00 . A A . 22 PHE N 1 1 3 1567 1 1 22 PHE O O -5.010 -4.482 4.513 1.00 . A A . 22 PHE O 1 1 3 1568 1 1 23 SER C C -7.583 -1.969 5.686 1.00 . A A . 23 SER C 1 1 3 1569 1 1 23 SER CA C -6.929 -3.280 6.112 1.00 . A A . 23 SER CA 1 1 3 1570 1 1 23 SER CB C -7.532 -3.757 7.434 1.00 . A A . 23 SER CB 1 1 3 1571 1 1 23 SER H H -5.129 -2.546 6.950 1.00 . A A . 23 SER H 1 1 3 1572 1 1 23 SER HA H -7.114 -4.025 5.352 1.00 . A A . 23 SER HA 1 1 3 1573 1 1 23 SER HB2 H -8.561 -4.042 7.276 1.00 . A A . 23 SER HB2 1 1 3 1574 1 1 23 SER HB3 H -6.974 -4.610 7.794 1.00 . A A . 23 SER HB3 1 1 3 1575 1 1 23 SER HG H -7.996 -1.979 8.112 1.00 . A A . 23 SER HG 1 1 3 1576 1 1 23 SER N N -5.485 -3.122 6.242 1.00 . A A . 23 SER N 1 1 3 1577 1 1 23 SER O O -8.688 -1.643 6.120 1.00 . A A . 23 SER O 1 1 3 1578 1 1 23 SER OG O -7.487 -2.735 8.414 1.00 . A A . 23 SER OG 1 1 3 1579 1 1 24 HIS C C -6.533 0.596 3.215 1.00 . A A . 24 HIS C 1 1 3 1580 1 1 24 HIS CA C -7.404 0.056 4.346 1.00 . A A . 24 HIS CA 1 1 3 1581 1 1 24 HIS CB C -7.467 1.072 5.486 1.00 . A A . 24 HIS CB 1 1 3 1582 1 1 24 HIS CD2 C -9.264 2.460 4.233 1.00 . A A . 24 HIS CD2 1 1 3 1583 1 1 24 HIS CE1 C -9.991 3.647 5.927 1.00 . A A . 24 HIS CE1 1 1 3 1584 1 1 24 HIS CG C -8.559 2.085 5.325 1.00 . A A . 24 HIS CG 1 1 3 1585 1 1 24 HIS H H -6.016 -1.534 4.522 1.00 . A A . 24 HIS H 1 1 3 1586 1 1 24 HIS HA H -8.401 -0.110 3.967 1.00 . A A . 24 HIS HA 1 1 3 1587 1 1 24 HIS HB2 H -7.634 0.550 6.416 1.00 . A A . 24 HIS HB2 1 1 3 1588 1 1 24 HIS HB3 H -6.527 1.602 5.540 1.00 . A A . 24 HIS HB3 1 1 3 1589 1 1 24 HIS HD1 H -8.725 2.808 7.298 1.00 . A A . 24 HIS HD1 1 1 3 1590 1 1 24 HIS HD2 H -9.154 2.069 3.232 1.00 . A A . 24 HIS HD2 1 1 3 1591 1 1 24 HIS HE1 H -10.548 4.356 6.521 1.00 . A A . 24 HIS HE1 1 1 3 1592 1 1 24 HIS N N -6.891 -1.220 4.832 1.00 . A A . 24 HIS N 1 1 3 1593 1 1 24 HIS ND1 N -9.037 2.848 6.370 1.00 . A A . 24 HIS ND1 1 1 3 1594 1 1 24 HIS NE2 N -10.148 3.432 4.634 1.00 . A A . 24 HIS NE2 1 1 3 1595 1 1 24 HIS O O -5.377 0.964 3.430 1.00 . A A . 24 HIS O 1 1 3 1596 1 1 25 HIS C C -5.481 2.317 1.221 1.00 . A A . 25 HIS C 1 1 3 1597 1 1 25 HIS CA C -6.368 1.133 0.846 1.00 . A A . 25 HIS CA 1 1 3 1598 1 1 25 HIS CB C -7.346 1.543 -0.255 1.00 . A A . 25 HIS CB 1 1 3 1599 1 1 25 HIS CD2 C -9.619 2.284 0.753 1.00 . A A . 25 HIS CD2 1 1 3 1600 1 1 25 HIS CE1 C -9.342 4.454 0.607 1.00 . A A . 25 HIS CE1 1 1 3 1601 1 1 25 HIS CG C -8.400 2.503 0.207 1.00 . A A . 25 HIS CG 1 1 3 1602 1 1 25 HIS H H -8.018 0.331 1.903 1.00 . A A . 25 HIS H 1 1 3 1603 1 1 25 HIS HA H -5.743 0.333 0.481 1.00 . A A . 25 HIS HA 1 1 3 1604 1 1 25 HIS HB2 H -6.798 2.014 -1.057 1.00 . A A . 25 HIS HB2 1 1 3 1605 1 1 25 HIS HB3 H -7.843 0.661 -0.633 1.00 . A A . 25 HIS HB3 1 1 3 1606 1 1 25 HIS HD1 H -7.476 4.346 -0.225 1.00 . A A . 25 HIS HD1 1 1 3 1607 1 1 25 HIS HD2 H -10.065 1.322 0.963 1.00 . A A . 25 HIS HD2 1 1 3 1608 1 1 25 HIS HE1 H -9.512 5.518 0.673 1.00 . A A . 25 HIS HE1 1 1 3 1609 1 1 25 HIS N N -7.094 0.639 2.011 1.00 . A A . 25 HIS N 1 1 3 1610 1 1 25 HIS ND1 N -8.257 3.872 0.128 1.00 . A A . 25 HIS ND1 1 1 3 1611 1 1 25 HIS NE2 N -10.184 3.512 0.993 1.00 . A A . 25 HIS NE2 1 1 3 1612 1 1 25 HIS O O -4.331 2.404 0.791 1.00 . A A . 25 HIS O 1 1 3 1613 1 1 26 ALA C C -4.063 4.009 3.287 1.00 . A A . 26 ALA C 1 1 3 1614 1 1 26 ALA CA C -5.282 4.403 2.459 1.00 . A A . 26 ALA CA 1 1 3 1615 1 1 26 ALA CB C -6.185 5.333 3.254 1.00 . A A . 26 ALA CB 1 1 3 1616 1 1 26 ALA H H -6.945 3.100 2.335 1.00 . A A . 26 ALA H 1 1 3 1617 1 1 26 ALA HA H -4.949 4.931 1.577 1.00 . A A . 26 ALA HA 1 1 3 1618 1 1 26 ALA HB1 H -5.654 5.695 4.122 1.00 . A A . 26 ALA HB1 1 1 3 1619 1 1 26 ALA HB2 H -6.475 6.169 2.634 1.00 . A A . 26 ALA HB2 1 1 3 1620 1 1 26 ALA HB3 H -7.067 4.795 3.569 1.00 . A A . 26 ALA HB3 1 1 3 1621 1 1 26 ALA N N -6.024 3.225 2.025 1.00 . A A . 26 ALA N 1 1 3 1622 1 1 26 ALA O O -2.944 4.438 3.006 1.00 . A A . 26 ALA O 1 1 3 1623 1 1 27 SER C C -1.982 2.346 4.369 1.00 . A A . 27 SER C 1 1 3 1624 1 1 27 SER CA C -3.209 2.744 5.183 1.00 . A A . 27 SER CA 1 1 3 1625 1 1 27 SER CB C -3.673 1.562 6.037 1.00 . A A . 27 SER CB 1 1 3 1626 1 1 27 SER H H -5.203 2.884 4.484 1.00 . A A . 27 SER H 1 1 3 1627 1 1 27 SER HA H -2.946 3.565 5.832 1.00 . A A . 27 SER HA 1 1 3 1628 1 1 27 SER HB2 H -4.697 1.720 6.340 1.00 . A A . 27 SER HB2 1 1 3 1629 1 1 27 SER HB3 H -3.604 0.653 5.457 1.00 . A A . 27 SER HB3 1 1 3 1630 1 1 27 SER HG H -2.003 1.805 7.033 1.00 . A A . 27 SER HG 1 1 3 1631 1 1 27 SER N N -4.288 3.191 4.310 1.00 . A A . 27 SER N 1 1 3 1632 1 1 27 SER O O -0.850 2.436 4.846 1.00 . A A . 27 SER O 1 1 3 1633 1 1 27 SER OG O -2.870 1.426 7.197 1.00 . A A . 27 SER OG 1 1 3 1634 1 1 28 LEU C C -0.508 2.701 1.554 1.00 . A A . 28 LEU C 1 1 3 1635 1 1 28 LEU CA C -1.128 1.496 2.254 1.00 . A A . 28 LEU CA 1 1 3 1636 1 1 28 LEU CB C -1.639 0.497 1.215 1.00 . A A . 28 LEU CB 1 1 3 1637 1 1 28 LEU CD1 C 0.307 -1.077 1.082 1.00 . A A . 28 LEU CD1 1 1 3 1638 1 1 28 LEU CD2 C -1.241 -0.840 -0.868 1.00 . A A . 28 LEU CD2 1 1 3 1639 1 1 28 LEU CG C -0.581 -0.122 0.301 1.00 . A A . 28 LEU CG 1 1 3 1640 1 1 28 LEU H H -3.137 1.859 2.812 1.00 . A A . 28 LEU H 1 1 3 1641 1 1 28 LEU HA H -0.372 1.018 2.859 1.00 . A A . 28 LEU HA 1 1 3 1642 1 1 28 LEU HB2 H -2.131 -0.306 1.742 1.00 . A A . 28 LEU HB2 1 1 3 1643 1 1 28 LEU HB3 H -2.359 1.009 0.591 1.00 . A A . 28 LEU HB3 1 1 3 1644 1 1 28 LEU HD11 H 0.064 -2.095 0.815 1.00 . A A . 28 LEU HD11 1 1 3 1645 1 1 28 LEU HD12 H 0.145 -0.935 2.141 1.00 . A A . 28 LEU HD12 1 1 3 1646 1 1 28 LEU HD13 H 1.342 -0.880 0.847 1.00 . A A . 28 LEU HD13 1 1 3 1647 1 1 28 LEU HD21 H -0.828 -1.834 -0.959 1.00 . A A . 28 LEU HD21 1 1 3 1648 1 1 28 LEU HD22 H -1.056 -0.288 -1.779 1.00 . A A . 28 LEU HD22 1 1 3 1649 1 1 28 LEU HD23 H -2.305 -0.905 -0.696 1.00 . A A . 28 LEU HD23 1 1 3 1650 1 1 28 LEU HG H 0.045 0.664 -0.098 1.00 . A A . 28 LEU HG 1 1 3 1651 1 1 28 LEU N N -2.214 1.907 3.137 1.00 . A A . 28 LEU N 1 1 3 1652 1 1 28 LEU O O 0.704 2.911 1.612 1.00 . A A . 28 LEU O 1 1 3 1653 1 1 29 THR C C -0.189 5.650 1.134 1.00 . A A . 29 THR C 1 1 3 1654 1 1 29 THR CA C -0.883 4.679 0.186 1.00 . A A . 29 THR CA 1 1 3 1655 1 1 29 THR CB C -2.047 5.406 -0.515 1.00 . A A . 29 THR CB 1 1 3 1656 1 1 29 THR CG2 C -2.764 6.336 0.452 1.00 . A A . 29 THR CG2 1 1 3 1657 1 1 29 THR H H -2.303 3.274 0.886 1.00 . A A . 29 THR H 1 1 3 1658 1 1 29 THR HA H -0.178 4.361 -0.569 1.00 . A A . 29 THR HA 1 1 3 1659 1 1 29 THR HB H -2.751 4.667 -0.871 1.00 . A A . 29 THR HB 1 1 3 1660 1 1 29 THR HG1 H -1.786 5.708 -2.446 1.00 . A A . 29 THR HG1 1 1 3 1661 1 1 29 THR HG21 H -3.818 6.356 0.216 1.00 . A A . 29 THR HG21 1 1 3 1662 1 1 29 THR HG22 H -2.356 7.332 0.364 1.00 . A A . 29 THR HG22 1 1 3 1663 1 1 29 THR HG23 H -2.629 5.979 1.462 1.00 . A A . 29 THR HG23 1 1 3 1664 1 1 29 THR N N -1.348 3.494 0.895 1.00 . A A . 29 THR N 1 1 3 1665 1 1 29 THR O O 0.553 6.530 0.700 1.00 . A A . 29 THR O 1 1 3 1666 1 1 29 THR OG1 O -1.554 6.157 -1.630 1.00 . A A . 29 THR OG1 1 1 3 1667 1 1 30 GLN C C 1.448 5.728 3.989 1.00 . A A . 30 GLN C 1 1 3 1668 1 1 30 GLN CA C 0.167 6.347 3.438 1.00 . A A . 30 GLN CA 1 1 3 1669 1 1 30 GLN CB C -0.821 6.602 4.577 1.00 . A A . 30 GLN CB 1 1 3 1670 1 1 30 GLN CD C -1.147 7.556 6.894 1.00 . A A . 30 GLN CD 1 1 3 1671 1 1 30 GLN CG C -0.289 7.545 5.645 1.00 . A A . 30 GLN CG 1 1 3 1672 1 1 30 GLN H H -1.036 4.764 2.713 1.00 . A A . 30 GLN H 1 1 3 1673 1 1 30 GLN HA H 0.410 7.287 2.967 1.00 . A A . 30 GLN HA 1 1 3 1674 1 1 30 GLN HB2 H -1.723 7.030 4.166 1.00 . A A . 30 GLN HB2 1 1 3 1675 1 1 30 GLN HB3 H -1.061 5.660 5.048 1.00 . A A . 30 GLN HB3 1 1 3 1676 1 1 30 GLN HE21 H 0.184 6.430 7.849 1.00 . A A . 30 GLN HE21 1 1 3 1677 1 1 30 GLN HE22 H -1.213 6.878 8.761 1.00 . A A . 30 GLN HE22 1 1 3 1678 1 1 30 GLN HG2 H 0.709 7.234 5.916 1.00 . A A . 30 GLN HG2 1 1 3 1679 1 1 30 GLN HG3 H -0.256 8.545 5.239 1.00 . A A . 30 GLN HG3 1 1 3 1680 1 1 30 GLN N N -0.435 5.483 2.429 1.00 . A A . 30 GLN N 1 1 3 1681 1 1 30 GLN NE2 N -0.679 6.886 7.940 1.00 . A A . 30 GLN NE2 1 1 3 1682 1 1 30 GLN O O 2.508 6.355 3.974 1.00 . A A . 30 GLN O 1 1 3 1683 1 1 30 GLN OE1 O -2.220 8.160 6.918 1.00 . A A . 30 GLN OE1 1 1 3 1684 1 1 31 HIS C C 3.667 3.817 4.057 1.00 . A A . 31 HIS C 1 1 3 1685 1 1 31 HIS CA C 2.493 3.792 5.031 1.00 . A A . 31 HIS CA 1 1 3 1686 1 1 31 HIS CB C 2.122 2.347 5.364 1.00 . A A . 31 HIS CB 1 1 3 1687 1 1 31 HIS CD2 C 3.808 0.690 4.299 1.00 . A A . 31 HIS CD2 1 1 3 1688 1 1 31 HIS CE1 C 5.000 0.252 6.086 1.00 . A A . 31 HIS CE1 1 1 3 1689 1 1 31 HIS CG C 3.285 1.405 5.322 1.00 . A A . 31 HIS CG 1 1 3 1690 1 1 31 HIS H H 0.471 4.049 4.459 1.00 . A A . 31 HIS H 1 1 3 1691 1 1 31 HIS HA H 2.784 4.298 5.939 1.00 . A A . 31 HIS HA 1 1 3 1692 1 1 31 HIS HB2 H 1.702 2.310 6.359 1.00 . A A . 31 HIS HB2 1 1 3 1693 1 1 31 HIS HB3 H 1.385 1.998 4.655 1.00 . A A . 31 HIS HB3 1 1 3 1694 1 1 31 HIS HD1 H 3.925 1.471 7.329 1.00 . A A . 31 HIS HD1 1 1 3 1695 1 1 31 HIS HD2 H 3.455 0.678 3.277 1.00 . A A . 31 HIS HD2 1 1 3 1696 1 1 31 HIS HE1 H 5.751 -0.157 6.746 1.00 . A A . 31 HIS HE1 1 1 3 1697 1 1 31 HIS N N 1.343 4.496 4.475 1.00 . A A . 31 HIS N 1 1 3 1698 1 1 31 HIS ND1 N 4.054 1.108 6.428 1.00 . A A . 31 HIS ND1 1 1 3 1699 1 1 31 HIS NE2 N 4.873 -0.018 4.800 1.00 . A A . 31 HIS NE2 1 1 3 1700 1 1 31 HIS O O 4.811 4.035 4.456 1.00 . A A . 31 HIS O 1 1 3 1701 1 1 32 GLN C C 5.421 4.699 1.990 1.00 . A A . 32 GLN C 1 1 3 1702 1 1 32 GLN CA C 4.408 3.585 1.751 1.00 . A A . 32 GLN CA 1 1 3 1703 1 1 32 GLN CB C 3.778 3.740 0.366 1.00 . A A . 32 GLN CB 1 1 3 1704 1 1 32 GLN CD C 4.559 1.570 -0.665 1.00 . A A . 32 GLN CD 1 1 3 1705 1 1 32 GLN CG C 3.369 2.421 -0.268 1.00 . A A . 32 GLN CG 1 1 3 1706 1 1 32 GLN H H 2.445 3.422 2.525 1.00 . A A . 32 GLN H 1 1 3 1707 1 1 32 GLN HA H 4.919 2.635 1.799 1.00 . A A . 32 GLN HA 1 1 3 1708 1 1 32 GLN HB2 H 2.900 4.362 0.451 1.00 . A A . 32 GLN HB2 1 1 3 1709 1 1 32 GLN HB3 H 4.490 4.223 -0.288 1.00 . A A . 32 GLN HB3 1 1 3 1710 1 1 32 GLN HE21 H 3.428 0.535 -1.931 1.00 . A A . 32 GLN HE21 1 1 3 1711 1 1 32 GLN HE22 H 5.088 0.062 -1.847 1.00 . A A . 32 GLN HE22 1 1 3 1712 1 1 32 GLN HG2 H 2.770 1.867 0.439 1.00 . A A . 32 GLN HG2 1 1 3 1713 1 1 32 GLN HG3 H 2.782 2.627 -1.151 1.00 . A A . 32 GLN HG3 1 1 3 1714 1 1 32 GLN N N 3.376 3.590 2.781 1.00 . A A . 32 GLN N 1 1 3 1715 1 1 32 GLN NE2 N 4.336 0.626 -1.572 1.00 . A A . 32 GLN NE2 1 1 3 1716 1 1 32 GLN O O 6.574 4.606 1.567 1.00 . A A . 32 GLN O 1 1 3 1717 1 1 32 GLN OE1 O 5.667 1.758 -0.161 1.00 . A A . 32 GLN OE1 1 1 3 1718 1 1 33 ARG C C 7.164 6.420 3.588 1.00 . A A . 33 ARG C 1 1 3 1719 1 1 33 ARG CA C 5.852 6.888 2.964 1.00 . A A . 33 ARG CA 1 1 3 1720 1 1 33 ARG CB C 5.147 7.866 3.906 1.00 . A A . 33 ARG CB 1 1 3 1721 1 1 33 ARG CD C 3.793 9.974 4.100 1.00 . A A . 33 ARG CD 1 1 3 1722 1 1 33 ARG CG C 4.205 8.823 3.195 1.00 . A A . 33 ARG CG 1 1 3 1723 1 1 33 ARG CZ C 5.548 11.672 3.816 1.00 . A A . 33 ARG CZ 1 1 3 1724 1 1 33 ARG H H 4.054 5.770 2.982 1.00 . A A . 33 ARG H 1 1 3 1725 1 1 33 ARG HA H 6.068 7.390 2.034 1.00 . A A . 33 ARG HA 1 1 3 1726 1 1 33 ARG HB2 H 4.576 7.304 4.629 1.00 . A A . 33 ARG HB2 1 1 3 1727 1 1 33 ARG HB3 H 5.894 8.449 4.424 1.00 . A A . 33 ARG HB3 1 1 3 1728 1 1 33 ARG HD2 H 3.127 10.624 3.552 1.00 . A A . 33 ARG HD2 1 1 3 1729 1 1 33 ARG HD3 H 3.277 9.572 4.959 1.00 . A A . 33 ARG HD3 1 1 3 1730 1 1 33 ARG HE H 5.279 10.574 5.459 1.00 . A A . 33 ARG HE 1 1 3 1731 1 1 33 ARG HG2 H 4.703 9.225 2.325 1.00 . A A . 33 ARG HG2 1 1 3 1732 1 1 33 ARG HG3 H 3.321 8.283 2.890 1.00 . A A . 33 ARG HG3 1 1 3 1733 1 1 33 ARG HH11 H 4.330 11.433 2.222 1.00 . A A . 33 ARG HH11 1 1 3 1734 1 1 33 ARG HH12 H 5.572 12.627 2.035 1.00 . A A . 33 ARG HH12 1 1 3 1735 1 1 33 ARG HH21 H 6.918 12.143 5.225 1.00 . A A . 33 ARG HH21 1 1 3 1736 1 1 33 ARG HH22 H 7.044 13.029 3.744 1.00 . A A . 33 ARG HH22 1 1 3 1737 1 1 33 ARG N N 4.984 5.754 2.671 1.00 . A A . 33 ARG N 1 1 3 1738 1 1 33 ARG NE N 4.943 10.750 4.556 1.00 . A A . 33 ARG NE 1 1 3 1739 1 1 33 ARG NH1 N 5.115 11.932 2.590 1.00 . A A . 33 ARG NH1 1 1 3 1740 1 1 33 ARG NH2 N 6.589 12.336 4.302 1.00 . A A . 33 ARG NH2 1 1 3 1741 1 1 33 ARG O O 8.242 6.871 3.201 1.00 . A A . 33 ARG O 1 1 3 1742 1 1 34 VAL C C 9.347 4.656 4.236 1.00 . A A . 34 VAL C 1 1 3 1743 1 1 34 VAL CA C 8.242 4.986 5.233 1.00 . A A . 34 VAL CA 1 1 3 1744 1 1 34 VAL CB C 7.902 3.721 6.044 1.00 . A A . 34 VAL CB 1 1 3 1745 1 1 34 VAL CG1 C 6.792 4.009 7.042 1.00 . A A . 34 VAL CG1 1 1 3 1746 1 1 34 VAL CG2 C 7.513 2.581 5.115 1.00 . A A . 34 VAL CG2 1 1 3 1747 1 1 34 VAL H H 6.176 5.194 4.820 1.00 . A A . 34 VAL H 1 1 3 1748 1 1 34 VAL HA H 8.601 5.741 5.917 1.00 . A A . 34 VAL HA 1 1 3 1749 1 1 34 VAL HB H 8.783 3.424 6.594 1.00 . A A . 34 VAL HB 1 1 3 1750 1 1 34 VAL HG11 H 7.225 4.263 7.999 1.00 . A A . 34 VAL HG11 1 1 3 1751 1 1 34 VAL HG12 H 6.192 4.834 6.687 1.00 . A A . 34 VAL HG12 1 1 3 1752 1 1 34 VAL HG13 H 6.170 3.132 7.151 1.00 . A A . 34 VAL HG13 1 1 3 1753 1 1 34 VAL HG21 H 8.361 2.308 4.505 1.00 . A A . 34 VAL HG21 1 1 3 1754 1 1 34 VAL HG22 H 7.201 1.730 5.701 1.00 . A A . 34 VAL HG22 1 1 3 1755 1 1 34 VAL HG23 H 6.699 2.897 4.478 1.00 . A A . 34 VAL HG23 1 1 3 1756 1 1 34 VAL N N 7.064 5.515 4.556 1.00 . A A . 34 VAL N 1 1 3 1757 1 1 34 VAL O O 10.529 4.861 4.512 1.00 . A A . 34 VAL O 1 1 3 1758 1 1 35 HIS C C 10.110 4.941 1.057 1.00 . A A . 35 HIS C 1 1 3 1759 1 1 35 HIS CA C 9.912 3.785 2.034 1.00 . A A . 35 HIS CA 1 1 3 1760 1 1 35 HIS CB C 9.438 2.542 1.281 1.00 . A A . 35 HIS CB 1 1 3 1761 1 1 35 HIS CD2 C 7.808 0.772 2.248 1.00 . A A . 35 HIS CD2 1 1 3 1762 1 1 35 HIS CE1 C 9.124 -0.070 3.786 1.00 . A A . 35 HIS CE1 1 1 3 1763 1 1 35 HIS CG C 8.987 1.432 2.181 1.00 . A A . 35 HIS CG 1 1 3 1764 1 1 35 HIS H H 7.998 4.003 2.912 1.00 . A A . 35 HIS H 1 1 3 1765 1 1 35 HIS HA H 10.855 3.568 2.512 1.00 . A A . 35 HIS HA 1 1 3 1766 1 1 35 HIS HB2 H 8.608 2.809 0.643 1.00 . A A . 35 HIS HB2 1 1 3 1767 1 1 35 HIS HB3 H 10.248 2.167 0.672 1.00 . A A . 35 HIS HB3 1 1 3 1768 1 1 35 HIS HD1 H 10.710 1.149 3.359 1.00 . A A . 35 HIS HD1 1 1 3 1769 1 1 35 HIS HD2 H 6.940 0.942 1.627 1.00 . A A . 35 HIS HD2 1 1 3 1770 1 1 35 HIS HE1 H 9.500 -0.675 4.598 1.00 . A A . 35 HIS HE1 1 1 3 1771 1 1 35 HIS N N 8.954 4.143 3.074 1.00 . A A . 35 HIS N 1 1 3 1772 1 1 35 HIS ND1 N 9.790 0.882 3.158 1.00 . A A . 35 HIS ND1 1 1 3 1773 1 1 35 HIS NE2 N 7.918 -0.157 3.254 1.00 . A A . 35 HIS NE2 1 1 3 1774 1 1 35 HIS O O 9.148 5.463 0.495 1.00 . A A . 35 HIS O 1 1 3 1775 1 1 36 SER C C 12.558 5.944 -1.198 1.00 . A A . 36 SER C 1 1 3 1776 1 1 36 SER CA C 11.689 6.431 -0.043 1.00 . A A . 36 SER CA 1 1 3 1777 1 1 36 SER CB C 12.407 7.550 0.714 1.00 . A A . 36 SER CB 1 1 3 1778 1 1 36 SER H H 12.089 4.879 1.339 1.00 . A A . 36 SER H 1 1 3 1779 1 1 36 SER HA H 10.762 6.816 -0.443 1.00 . A A . 36 SER HA 1 1 3 1780 1 1 36 SER HB2 H 12.738 8.301 0.013 1.00 . A A . 36 SER HB2 1 1 3 1781 1 1 36 SER HB3 H 11.726 7.995 1.424 1.00 . A A . 36 SER HB3 1 1 3 1782 1 1 36 SER HG H 14.297 7.048 0.830 1.00 . A A . 36 SER HG 1 1 3 1783 1 1 36 SER N N 11.365 5.335 0.862 1.00 . A A . 36 SER N 1 1 3 1784 1 1 36 SER O O 13.734 5.630 -1.016 1.00 . A A . 36 SER O 1 1 3 1785 1 1 36 SER OG O 13.534 7.051 1.413 1.00 . A A . 36 SER OG 1 1 3 1786 1 1 37 GLY C C 12.337 6.208 -4.807 1.00 . A A . 37 GLY C 1 1 3 1787 1 1 37 GLY CA C 12.704 5.433 -3.557 1.00 . A A . 37 GLY CA 1 1 3 1788 1 1 37 GLY H H 11.030 6.146 -2.475 1.00 . A A . 37 GLY H 1 1 3 1789 1 1 37 GLY HA2 H 13.761 5.550 -3.371 1.00 . A A . 37 GLY HA2 1 1 3 1790 1 1 37 GLY HA3 H 12.491 4.387 -3.721 1.00 . A A . 37 GLY HA3 1 1 3 1791 1 1 37 GLY N N 11.970 5.883 -2.389 1.00 . A A . 37 GLY N 1 1 3 1792 1 1 37 GLY O O 11.420 5.827 -5.534 1.00 . A A . 37 GLY O 1 1 3 1793 1 1 38 GLU C C 13.318 7.463 -7.495 1.00 . A A . 38 GLU C 1 1 3 1794 1 1 38 GLU CA C 12.795 8.131 -6.226 1.00 . A A . 38 GLU CA 1 1 3 1795 1 1 38 GLU CB C 13.444 9.506 -6.056 1.00 . A A . 38 GLU CB 1 1 3 1796 1 1 38 GLU CD C 13.186 10.567 -8.334 1.00 . A A . 38 GLU CD 1 1 3 1797 1 1 38 GLU CG C 12.778 10.600 -6.874 1.00 . A A . 38 GLU CG 1 1 3 1798 1 1 38 GLU H H 13.771 7.552 -4.440 1.00 . A A . 38 GLU H 1 1 3 1799 1 1 38 GLU HA H 11.726 8.256 -6.315 1.00 . A A . 38 GLU HA 1 1 3 1800 1 1 38 GLU HB2 H 13.399 9.785 -5.014 1.00 . A A . 38 GLU HB2 1 1 3 1801 1 1 38 GLU HB3 H 14.480 9.441 -6.357 1.00 . A A . 38 GLU HB3 1 1 3 1802 1 1 38 GLU HG2 H 11.707 10.475 -6.812 1.00 . A A . 38 GLU HG2 1 1 3 1803 1 1 38 GLU HG3 H 13.052 11.559 -6.460 1.00 . A A . 38 GLU HG3 1 1 3 1804 1 1 38 GLU N N 13.053 7.300 -5.057 1.00 . A A . 38 GLU N 1 1 3 1805 1 1 38 GLU O O 13.140 7.977 -8.600 1.00 . A A . 38 GLU O 1 1 3 1806 1 1 38 GLU OE1 O 14.350 10.216 -8.617 1.00 . A A . 38 GLU OE1 1 1 3 1807 1 1 38 GLU OE2 O 12.340 10.893 -9.193 1.00 . A A . 38 GLU OE2 1 1 3 1808 1 1 39 LYS C C 13.836 4.216 -8.600 1.00 . A A . 39 LYS C 1 1 3 1809 1 1 39 LYS CA C 14.515 5.574 -8.457 1.00 . A A . 39 LYS CA 1 1 3 1810 1 1 39 LYS CB C 16.024 5.386 -8.285 1.00 . A A . 39 LYS CB 1 1 3 1811 1 1 39 LYS CD C 17.742 4.248 -6.849 1.00 . A A . 39 LYS CD 1 1 3 1812 1 1 39 LYS CE C 18.250 4.048 -5.429 1.00 . A A . 39 LYS CE 1 1 3 1813 1 1 39 LYS CG C 16.433 5.020 -6.869 1.00 . A A . 39 LYS CG 1 1 3 1814 1 1 39 LYS H H 14.076 5.956 -6.422 1.00 . A A . 39 LYS H 1 1 3 1815 1 1 39 LYS HA H 14.332 6.150 -9.352 1.00 . A A . 39 LYS HA 1 1 3 1816 1 1 39 LYS HB2 H 16.355 4.601 -8.948 1.00 . A A . 39 LYS HB2 1 1 3 1817 1 1 39 LYS HB3 H 16.522 6.307 -8.554 1.00 . A A . 39 LYS HB3 1 1 3 1818 1 1 39 LYS HD2 H 17.587 3.281 -7.303 1.00 . A A . 39 LYS HD2 1 1 3 1819 1 1 39 LYS HD3 H 18.483 4.798 -7.413 1.00 . A A . 39 LYS HD3 1 1 3 1820 1 1 39 LYS HE2 H 17.437 3.689 -4.817 1.00 . A A . 39 LYS HE2 1 1 3 1821 1 1 39 LYS HE3 H 19.041 3.313 -5.444 1.00 . A A . 39 LYS HE3 1 1 3 1822 1 1 39 LYS HG2 H 16.553 5.925 -6.292 1.00 . A A . 39 LYS HG2 1 1 3 1823 1 1 39 LYS HG3 H 15.659 4.409 -6.427 1.00 . A A . 39 LYS HG3 1 1 3 1824 1 1 39 LYS HZ1 H 19.246 5.878 -5.579 1.00 . A A . 39 LYS HZ1 1 1 3 1825 1 1 39 LYS HZ2 H 19.460 5.101 -4.092 1.00 . A A . 39 LYS HZ2 1 1 3 1826 1 1 39 LYS HZ3 H 17.995 5.871 -4.440 1.00 . A A . 39 LYS HZ3 1 1 3 1827 1 1 39 LYS N N 13.966 6.315 -7.328 1.00 . A A . 39 LYS N 1 1 3 1828 1 1 39 LYS NZ N 18.774 5.313 -4.845 1.00 . A A . 39 LYS NZ 1 1 3 1829 1 1 39 LYS O O 14.357 3.187 -8.171 1.00 . A A . 39 LYS O 1 1 3 1830 1 1 40 PRO C C 12.517 2.063 -10.460 1.00 . A A . 40 PRO C 1 1 3 1831 1 1 40 PRO CA C 11.870 2.985 -9.432 1.00 . A A . 40 PRO CA 1 1 3 1832 1 1 40 PRO CB C 10.525 3.502 -9.949 1.00 . A A . 40 PRO CB 1 1 3 1833 1 1 40 PRO CD C 11.964 5.401 -9.754 1.00 . A A . 40 PRO CD 1 1 3 1834 1 1 40 PRO CG C 10.838 4.822 -10.565 1.00 . A A . 40 PRO CG 1 1 3 1835 1 1 40 PRO HA H 11.720 2.444 -8.509 1.00 . A A . 40 PRO HA 1 1 3 1836 1 1 40 PRO HB2 H 10.127 2.809 -10.677 1.00 . A A . 40 PRO HB2 1 1 3 1837 1 1 40 PRO HB3 H 9.834 3.604 -9.126 1.00 . A A . 40 PRO HB3 1 1 3 1838 1 1 40 PRO HD2 H 12.627 5.974 -10.384 1.00 . A A . 40 PRO HD2 1 1 3 1839 1 1 40 PRO HD3 H 11.576 6.015 -8.955 1.00 . A A . 40 PRO HD3 1 1 3 1840 1 1 40 PRO HG2 H 11.146 4.685 -11.590 1.00 . A A . 40 PRO HG2 1 1 3 1841 1 1 40 PRO HG3 H 9.971 5.464 -10.515 1.00 . A A . 40 PRO HG3 1 1 3 1842 1 1 40 PRO N N 12.645 4.211 -9.217 1.00 . A A . 40 PRO N 1 1 3 1843 1 1 40 PRO O O 12.583 0.849 -10.265 1.00 . A A . 40 PRO O 1 1 3 1844 1 1 41 SER C C 15.057 2.368 -12.861 1.00 . A A . 41 SER C 1 1 3 1845 1 1 41 SER CA C 13.634 1.876 -12.615 1.00 . A A . 41 SER CA 1 1 3 1846 1 1 41 SER CB C 12.819 1.972 -13.906 1.00 . A A . 41 SER CB 1 1 3 1847 1 1 41 SER H H 12.913 3.619 -11.652 1.00 . A A . 41 SER H 1 1 3 1848 1 1 41 SER HA H 13.672 0.845 -12.298 1.00 . A A . 41 SER HA 1 1 3 1849 1 1 41 SER HB2 H 13.234 1.300 -14.641 1.00 . A A . 41 SER HB2 1 1 3 1850 1 1 41 SER HB3 H 11.795 1.694 -13.703 1.00 . A A . 41 SER HB3 1 1 3 1851 1 1 41 SER HG H 13.078 3.262 -15.357 1.00 . A A . 41 SER HG 1 1 3 1852 1 1 41 SER N N 12.995 2.647 -11.554 1.00 . A A . 41 SER N 1 1 3 1853 1 1 41 SER O O 15.356 3.550 -12.691 1.00 . A A . 41 SER O 1 1 3 1854 1 1 41 SER OG O 12.841 3.289 -14.427 1.00 . A A . 41 SER OG 1 1 3 1855 1 1 42 GLY C C 17.445 2.846 -14.625 1.00 . A A . 42 GLY C 1 1 3 1856 1 1 42 GLY CA C 17.314 1.810 -13.526 1.00 . A A . 42 GLY CA 1 1 3 1857 1 1 42 GLY H H 15.638 0.524 -13.382 1.00 . A A . 42 GLY H 1 1 3 1858 1 1 42 GLY HA2 H 17.751 2.203 -12.621 1.00 . A A . 42 GLY HA2 1 1 3 1859 1 1 42 GLY HA3 H 17.854 0.922 -13.819 1.00 . A A . 42 GLY HA3 1 1 3 1860 1 1 42 GLY N N 15.932 1.451 -13.263 1.00 . A A . 42 GLY N 1 1 3 1861 1 1 42 GLY O O 16.505 3.580 -14.931 1.00 . A A . 42 GLY O 1 1 3 1862 1 1 43 PRO C C 18.165 3.527 -17.600 1.00 . A A . 43 PRO C 1 1 3 1863 1 1 43 PRO CA C 18.915 3.869 -16.318 1.00 . A A . 43 PRO CA 1 1 3 1864 1 1 43 PRO CB C 20.425 3.733 -16.529 1.00 . A A . 43 PRO CB 1 1 3 1865 1 1 43 PRO CD C 19.801 2.073 -14.925 1.00 . A A . 43 PRO CD 1 1 3 1866 1 1 43 PRO CG C 20.751 2.358 -16.055 1.00 . A A . 43 PRO CG 1 1 3 1867 1 1 43 PRO HA H 18.680 4.881 -16.024 1.00 . A A . 43 PRO HA 1 1 3 1868 1 1 43 PRO HB2 H 20.657 3.856 -17.577 1.00 . A A . 43 PRO HB2 1 1 3 1869 1 1 43 PRO HB3 H 20.942 4.483 -15.949 1.00 . A A . 43 PRO HB3 1 1 3 1870 1 1 43 PRO HD2 H 19.529 1.028 -14.916 1.00 . A A . 43 PRO HD2 1 1 3 1871 1 1 43 PRO HD3 H 20.241 2.359 -13.981 1.00 . A A . 43 PRO HD3 1 1 3 1872 1 1 43 PRO HG2 H 20.605 1.650 -16.856 1.00 . A A . 43 PRO HG2 1 1 3 1873 1 1 43 PRO HG3 H 21.772 2.324 -15.704 1.00 . A A . 43 PRO HG3 1 1 3 1874 1 1 43 PRO N N 18.636 2.917 -15.238 1.00 . A A . 43 PRO N 1 1 3 1875 1 1 43 PRO O O 18.168 4.300 -18.558 1.00 . A A . 43 PRO O 1 1 3 1876 1 1 44 SER C C 15.860 3.027 -19.296 1.00 . A A . 44 SER C 1 1 3 1877 1 1 44 SER CA C 16.770 1.917 -18.779 1.00 . A A . 44 SER CA 1 1 3 1878 1 1 44 SER CB C 15.939 0.680 -18.435 1.00 . A A . 44 SER CB 1 1 3 1879 1 1 44 SER H H 17.557 1.790 -16.818 1.00 . A A . 44 SER H 1 1 3 1880 1 1 44 SER HA H 17.479 1.661 -19.552 1.00 . A A . 44 SER HA 1 1 3 1881 1 1 44 SER HB2 H 15.489 0.289 -19.335 1.00 . A A . 44 SER HB2 1 1 3 1882 1 1 44 SER HB3 H 16.581 -0.071 -17.998 1.00 . A A . 44 SER HB3 1 1 3 1883 1 1 44 SER HG H 15.168 1.767 -16.999 1.00 . A A . 44 SER HG 1 1 3 1884 1 1 44 SER N N 17.522 2.363 -17.612 1.00 . A A . 44 SER N 1 1 3 1885 1 1 44 SER O O 15.072 3.600 -18.542 1.00 . A A . 44 SER O 1 1 3 1886 1 1 44 SER OG O 14.912 0.996 -17.511 1.00 . A A . 44 SER OG 1 1 3 1887 1 1 45 SER C C 14.441 3.838 -22.437 1.00 . A A . 45 SER C 1 1 3 1888 1 1 45 SER CA C 15.164 4.370 -21.204 1.00 . A A . 45 SER CA 1 1 3 1889 1 1 45 SER CB C 16.041 5.564 -21.587 1.00 . A A . 45 SER CB 1 1 3 1890 1 1 45 SER H H 16.619 2.833 -21.135 1.00 . A A . 45 SER H 1 1 3 1891 1 1 45 SER HA H 14.430 4.691 -20.480 1.00 . A A . 45 SER HA 1 1 3 1892 1 1 45 SER HB2 H 16.935 5.208 -22.076 1.00 . A A . 45 SER HB2 1 1 3 1893 1 1 45 SER HB3 H 15.493 6.206 -22.261 1.00 . A A . 45 SER HB3 1 1 3 1894 1 1 45 SER HG H 15.627 6.542 -19.941 1.00 . A A . 45 SER HG 1 1 3 1895 1 1 45 SER N N 15.974 3.326 -20.586 1.00 . A A . 45 SER N 1 1 3 1896 1 1 45 SER O O 14.591 2.673 -22.805 1.00 . A A . 45 SER O 1 1 3 1897 1 1 45 SER OG O 16.412 6.312 -20.443 1.00 . A A . 45 SER OG 1 1 3 1898 1 1 46 GLY C C 11.432 4.165 -23.999 1.00 . A A . 46 GLY C 1 1 3 1899 1 1 46 GLY CA C 12.919 4.301 -24.258 1.00 . A A . 46 GLY CA 1 1 3 1900 1 1 46 GLY H H 13.574 5.618 -22.734 1.00 . A A . 46 GLY H 1 1 3 1901 1 1 46 GLY HA2 H 13.073 5.040 -25.031 1.00 . A A . 46 GLY HA2 1 1 3 1902 1 1 46 GLY HA3 H 13.302 3.351 -24.602 1.00 . A A . 46 GLY HA3 1 1 3 1903 1 1 46 GLY N N 13.655 4.702 -23.073 1.00 . A A . 46 GLY N 1 1 3 1904 1 1 46 GLY O O 10.825 5.104 -23.488 1.00 . A A . 46 GLY O 1 1 3 1905 2 2 1 ZN ZN ZN 6.126 -0.992 3.591 1.00 . B A . 181 ZN ZN 1 1 4 1906 1 1 1 GLY C C 8.860 -19.151 -10.391 1.00 . A A . 1 GLY C 1 1 4 1907 1 1 1 GLY CA C 9.064 -19.402 -11.872 1.00 . A A . 1 GLY CA 1 1 4 1908 1 1 1 GLY H1 H 10.035 -21.279 -11.743 1.00 . A A . 1 GLY H1 1 1 4 1909 1 1 1 GLY HA2 H 9.915 -18.829 -12.210 1.00 . A A . 1 GLY HA2 1 1 4 1910 1 1 1 GLY HA3 H 8.185 -19.070 -12.405 1.00 . A A . 1 GLY HA3 1 1 4 1911 1 1 1 GLY N N 9.293 -20.803 -12.171 1.00 . A A . 1 GLY N 1 1 4 1912 1 1 1 GLY O O 9.528 -19.758 -9.554 1.00 . A A . 1 GLY O 1 1 4 1913 1 1 2 SER C C 6.222 -18.304 -8.306 1.00 . A A . 2 SER C 1 1 4 1914 1 1 2 SER CA C 7.651 -17.918 -8.675 1.00 . A A . 2 SER CA 1 1 4 1915 1 1 2 SER CB C 7.865 -16.422 -8.434 1.00 . A A . 2 SER CB 1 1 4 1916 1 1 2 SER H H 7.437 -17.801 -10.779 1.00 . A A . 2 SER H 1 1 4 1917 1 1 2 SER HA H 8.334 -18.476 -8.053 1.00 . A A . 2 SER HA 1 1 4 1918 1 1 2 SER HB2 H 8.797 -16.117 -8.886 1.00 . A A . 2 SER HB2 1 1 4 1919 1 1 2 SER HB3 H 7.051 -15.868 -8.878 1.00 . A A . 2 SER HB3 1 1 4 1920 1 1 2 SER HG H 8.772 -16.380 -6.698 1.00 . A A . 2 SER HG 1 1 4 1921 1 1 2 SER N N 7.936 -18.252 -10.066 1.00 . A A . 2 SER N 1 1 4 1922 1 1 2 SER O O 5.262 -17.680 -8.759 1.00 . A A . 2 SER O 1 1 4 1923 1 1 2 SER OG O 7.913 -16.132 -7.048 1.00 . A A . 2 SER OG 1 1 4 1924 1 1 3 SER C C 3.842 -18.640 -6.773 1.00 . A A . 3 SER C 1 1 4 1925 1 1 3 SER CA C 4.778 -19.812 -7.054 1.00 . A A . 3 SER CA 1 1 4 1926 1 1 3 SER CB C 4.910 -20.684 -5.804 1.00 . A A . 3 SER CB 1 1 4 1927 1 1 3 SER H H 6.893 -19.795 -7.155 1.00 . A A . 3 SER H 1 1 4 1928 1 1 3 SER HA H 4.363 -20.405 -7.854 1.00 . A A . 3 SER HA 1 1 4 1929 1 1 3 SER HB2 H 4.009 -21.263 -5.675 1.00 . A A . 3 SER HB2 1 1 4 1930 1 1 3 SER HB3 H 5.753 -21.350 -5.921 1.00 . A A . 3 SER HB3 1 1 4 1931 1 1 3 SER HG H 4.262 -19.620 -4.292 1.00 . A A . 3 SER HG 1 1 4 1932 1 1 3 SER N N 6.089 -19.338 -7.481 1.00 . A A . 3 SER N 1 1 4 1933 1 1 3 SER O O 4.285 -17.548 -6.421 1.00 . A A . 3 SER O 1 1 4 1934 1 1 3 SER OG O 5.112 -19.890 -4.647 1.00 . A A . 3 SER OG 1 1 4 1935 1 1 4 GLY C C 1.674 -17.243 -5.301 1.00 . A A . 4 GLY C 1 1 4 1936 1 1 4 GLY CA C 1.564 -17.832 -6.694 1.00 . A A . 4 GLY CA 1 1 4 1937 1 1 4 GLY H H 2.248 -19.767 -7.216 1.00 . A A . 4 GLY H 1 1 4 1938 1 1 4 GLY HA2 H 1.708 -17.045 -7.419 1.00 . A A . 4 GLY HA2 1 1 4 1939 1 1 4 GLY HA3 H 0.575 -18.247 -6.819 1.00 . A A . 4 GLY HA3 1 1 4 1940 1 1 4 GLY N N 2.543 -18.876 -6.933 1.00 . A A . 4 GLY N 1 1 4 1941 1 1 4 GLY O O 2.033 -16.076 -5.141 1.00 . A A . 4 GLY O 1 1 4 1942 1 1 5 SER C C 0.936 -16.159 -2.782 1.00 . A A . 5 SER C 1 1 4 1943 1 1 5 SER CA C 1.424 -17.600 -2.907 1.00 . A A . 5 SER CA 1 1 4 1944 1 1 5 SER CB C 2.853 -17.714 -2.373 1.00 . A A . 5 SER CB 1 1 4 1945 1 1 5 SER H H 1.085 -18.970 -4.485 1.00 . A A . 5 SER H 1 1 4 1946 1 1 5 SER HA H 0.778 -18.238 -2.322 1.00 . A A . 5 SER HA 1 1 4 1947 1 1 5 SER HB2 H 2.868 -17.438 -1.330 1.00 . A A . 5 SER HB2 1 1 4 1948 1 1 5 SER HB3 H 3.194 -18.734 -2.480 1.00 . A A . 5 SER HB3 1 1 4 1949 1 1 5 SER HG H 4.037 -16.159 -2.504 1.00 . A A . 5 SER HG 1 1 4 1950 1 1 5 SER N N 1.364 -18.050 -4.292 1.00 . A A . 5 SER N 1 1 4 1951 1 1 5 SER O O 1.531 -15.351 -2.069 1.00 . A A . 5 SER O 1 1 4 1952 1 1 5 SER OG O 3.733 -16.861 -3.084 1.00 . A A . 5 SER OG 1 1 4 1953 1 1 6 SER C C -1.280 -14.180 -2.071 1.00 . A A . 6 SER C 1 1 4 1954 1 1 6 SER CA C -0.717 -14.503 -3.452 1.00 . A A . 6 SER CA 1 1 4 1955 1 1 6 SER CB C -1.816 -14.368 -4.507 1.00 . A A . 6 SER CB 1 1 4 1956 1 1 6 SER H H -0.579 -16.535 -4.030 1.00 . A A . 6 SER H 1 1 4 1957 1 1 6 SER HA H 0.075 -13.804 -3.677 1.00 . A A . 6 SER HA 1 1 4 1958 1 1 6 SER HB2 H -2.242 -13.377 -4.455 1.00 . A A . 6 SER HB2 1 1 4 1959 1 1 6 SER HB3 H -1.390 -14.526 -5.488 1.00 . A A . 6 SER HB3 1 1 4 1960 1 1 6 SER HG H -3.699 -14.882 -4.339 1.00 . A A . 6 SER HG 1 1 4 1961 1 1 6 SER N N -0.150 -15.846 -3.480 1.00 . A A . 6 SER N 1 1 4 1962 1 1 6 SER O O -0.932 -13.166 -1.468 1.00 . A A . 6 SER O 1 1 4 1963 1 1 6 SER OG O -2.845 -15.319 -4.297 1.00 . A A . 6 SER OG 1 1 4 1964 1 1 7 GLY C C -4.264 -14.761 -0.332 1.00 . A A . 7 GLY C 1 1 4 1965 1 1 7 GLY CA C -2.752 -14.843 -0.271 1.00 . A A . 7 GLY CA 1 1 4 1966 1 1 7 GLY H H -2.394 -15.844 -2.102 1.00 . A A . 7 GLY H 1 1 4 1967 1 1 7 GLY HA2 H -2.472 -15.662 0.376 1.00 . A A . 7 GLY HA2 1 1 4 1968 1 1 7 GLY HA3 H -2.369 -13.923 0.145 1.00 . A A . 7 GLY HA3 1 1 4 1969 1 1 7 GLY N N -2.153 -15.052 -1.576 1.00 . A A . 7 GLY N 1 1 4 1970 1 1 7 GLY O O -4.825 -14.189 -1.268 1.00 . A A . 7 GLY O 1 1 4 1971 1 1 8 THR C C -6.884 -14.599 1.964 1.00 . A A . 8 THR C 1 1 4 1972 1 1 8 THR CA C -6.384 -15.326 0.721 1.00 . A A . 8 THR CA 1 1 4 1973 1 1 8 THR CB C -6.955 -16.756 0.712 1.00 . A A . 8 THR CB 1 1 4 1974 1 1 8 THR CG2 C -6.542 -17.496 -0.551 1.00 . A A . 8 THR CG2 1 1 4 1975 1 1 8 THR H H -4.425 -15.774 1.383 1.00 . A A . 8 THR H 1 1 4 1976 1 1 8 THR HA H -6.748 -14.810 -0.156 1.00 . A A . 8 THR HA 1 1 4 1977 1 1 8 THR HB H -8.034 -16.697 0.741 1.00 . A A . 8 THR HB 1 1 4 1978 1 1 8 THR HG1 H -5.643 -17.128 2.137 1.00 . A A . 8 THR HG1 1 1 4 1979 1 1 8 THR HG21 H -7.300 -18.221 -0.807 1.00 . A A . 8 THR HG21 1 1 4 1980 1 1 8 THR HG22 H -5.603 -18.002 -0.382 1.00 . A A . 8 THR HG22 1 1 4 1981 1 1 8 THR HG23 H -6.431 -16.791 -1.361 1.00 . A A . 8 THR HG23 1 1 4 1982 1 1 8 THR N N -4.928 -15.334 0.667 1.00 . A A . 8 THR N 1 1 4 1983 1 1 8 THR O O -6.363 -14.796 3.061 1.00 . A A . 8 THR O 1 1 4 1984 1 1 8 THR OG1 O -6.496 -17.474 1.863 1.00 . A A . 8 THR OG1 1 1 4 1985 1 1 9 GLY C C -8.736 -11.568 2.552 1.00 . A A . 9 GLY C 1 1 4 1986 1 1 9 GLY CA C -8.451 -13.015 2.902 1.00 . A A . 9 GLY CA 1 1 4 1987 1 1 9 GLY H H -8.273 -13.641 0.888 1.00 . A A . 9 GLY H 1 1 4 1988 1 1 9 GLY HA2 H -9.371 -13.487 3.215 1.00 . A A . 9 GLY HA2 1 1 4 1989 1 1 9 GLY HA3 H -7.748 -13.042 3.722 1.00 . A A . 9 GLY HA3 1 1 4 1990 1 1 9 GLY N N -7.898 -13.758 1.785 1.00 . A A . 9 GLY N 1 1 4 1991 1 1 9 GLY O O -8.864 -11.221 1.378 1.00 . A A . 9 GLY O 1 1 4 1992 1 1 10 GLU C C -7.821 -8.493 3.372 1.00 . A A . 10 GLU C 1 1 4 1993 1 1 10 GLU CA C -9.113 -9.305 3.365 1.00 . A A . 10 GLU CA 1 1 4 1994 1 1 10 GLU CB C -10.062 -8.783 4.446 1.00 . A A . 10 GLU CB 1 1 4 1995 1 1 10 GLU CD C -10.310 -8.153 6.880 1.00 . A A . 10 GLU CD 1 1 4 1996 1 1 10 GLU CG C -9.531 -8.960 5.859 1.00 . A A . 10 GLU CG 1 1 4 1997 1 1 10 GLU H H -8.726 -11.059 4.486 1.00 . A A . 10 GLU H 1 1 4 1998 1 1 10 GLU HA H -9.586 -9.197 2.401 1.00 . A A . 10 GLU HA 1 1 4 1999 1 1 10 GLU HB2 H -10.236 -7.731 4.277 1.00 . A A . 10 GLU HB2 1 1 4 2000 1 1 10 GLU HB3 H -11.001 -9.311 4.368 1.00 . A A . 10 GLU HB3 1 1 4 2001 1 1 10 GLU HG2 H -9.593 -10.004 6.125 1.00 . A A . 10 GLU HG2 1 1 4 2002 1 1 10 GLU HG3 H -8.499 -8.644 5.884 1.00 . A A . 10 GLU HG3 1 1 4 2003 1 1 10 GLU N N -8.838 -10.722 3.572 1.00 . A A . 10 GLU N 1 1 4 2004 1 1 10 GLU O O -7.756 -7.412 3.957 1.00 . A A . 10 GLU O 1 1 4 2005 1 1 10 GLU OE1 O -11.556 -8.242 6.879 1.00 . A A . 10 GLU OE1 1 1 4 2006 1 1 10 GLU OE2 O -9.675 -7.434 7.678 1.00 . A A . 10 GLU OE2 1 1 4 2007 1 1 11 LYS C C -5.063 -8.166 1.199 1.00 . A A . 11 LYS C 1 1 4 2008 1 1 11 LYS CA C -5.501 -8.350 2.648 1.00 . A A . 11 LYS CA 1 1 4 2009 1 1 11 LYS CB C -4.444 -9.149 3.414 1.00 . A A . 11 LYS CB 1 1 4 2010 1 1 11 LYS CD C -3.439 -11.392 3.928 1.00 . A A . 11 LYS CD 1 1 4 2011 1 1 11 LYS CE C -2.050 -11.416 3.309 1.00 . A A . 11 LYS CE 1 1 4 2012 1 1 11 LYS CG C -4.422 -10.625 3.060 1.00 . A A . 11 LYS CG 1 1 4 2013 1 1 11 LYS H H -6.905 -9.889 2.272 1.00 . A A . 11 LYS H 1 1 4 2014 1 1 11 LYS HA H -5.608 -7.379 3.105 1.00 . A A . 11 LYS HA 1 1 4 2015 1 1 11 LYS HB2 H -3.470 -8.734 3.198 1.00 . A A . 11 LYS HB2 1 1 4 2016 1 1 11 LYS HB3 H -4.638 -9.056 4.473 1.00 . A A . 11 LYS HB3 1 1 4 2017 1 1 11 LYS HD2 H -3.380 -10.918 4.897 1.00 . A A . 11 LYS HD2 1 1 4 2018 1 1 11 LYS HD3 H -3.790 -12.408 4.044 1.00 . A A . 11 LYS HD3 1 1 4 2019 1 1 11 LYS HE2 H -2.066 -12.065 2.446 1.00 . A A . 11 LYS HE2 1 1 4 2020 1 1 11 LYS HE3 H -1.790 -10.414 3.000 1.00 . A A . 11 LYS HE3 1 1 4 2021 1 1 11 LYS HG2 H -5.411 -11.036 3.206 1.00 . A A . 11 LYS HG2 1 1 4 2022 1 1 11 LYS HG3 H -4.135 -10.734 2.024 1.00 . A A . 11 LYS HG3 1 1 4 2023 1 1 11 LYS HZ1 H -1.401 -11.892 5.236 1.00 . A A . 11 LYS HZ1 1 1 4 2024 1 1 11 LYS HZ2 H -0.177 -11.307 4.226 1.00 . A A . 11 LYS HZ2 1 1 4 2025 1 1 11 LYS HZ3 H -0.752 -12.885 4.030 1.00 . A A . 11 LYS HZ3 1 1 4 2026 1 1 11 LYS N N -6.793 -9.024 2.719 1.00 . A A . 11 LYS N 1 1 4 2027 1 1 11 LYS NZ N -1.023 -11.910 4.268 1.00 . A A . 11 LYS NZ 1 1 4 2028 1 1 11 LYS O O -3.933 -8.479 0.822 1.00 . A A . 11 LYS O 1 1 4 2029 1 1 12 PRO C C -4.711 -6.267 -1.272 1.00 . A A . 12 PRO C 1 1 4 2030 1 1 12 PRO CA C -5.704 -7.404 -1.055 1.00 . A A . 12 PRO CA 1 1 4 2031 1 1 12 PRO CB C -7.076 -7.030 -1.620 1.00 . A A . 12 PRO CB 1 1 4 2032 1 1 12 PRO CD C -7.341 -7.247 0.746 1.00 . A A . 12 PRO CD 1 1 4 2033 1 1 12 PRO CG C -7.830 -6.487 -0.456 1.00 . A A . 12 PRO CG 1 1 4 2034 1 1 12 PRO HA H -5.341 -8.295 -1.546 1.00 . A A . 12 PRO HA 1 1 4 2035 1 1 12 PRO HB2 H -6.959 -6.288 -2.397 1.00 . A A . 12 PRO HB2 1 1 4 2036 1 1 12 PRO HB3 H -7.555 -7.910 -2.024 1.00 . A A . 12 PRO HB3 1 1 4 2037 1 1 12 PRO HD2 H -7.329 -6.609 1.617 1.00 . A A . 12 PRO HD2 1 1 4 2038 1 1 12 PRO HD3 H -7.959 -8.115 0.920 1.00 . A A . 12 PRO HD3 1 1 4 2039 1 1 12 PRO HG2 H -7.622 -5.433 -0.344 1.00 . A A . 12 PRO HG2 1 1 4 2040 1 1 12 PRO HG3 H -8.889 -6.649 -0.596 1.00 . A A . 12 PRO HG3 1 1 4 2041 1 1 12 PRO N N -5.975 -7.644 0.365 1.00 . A A . 12 PRO N 1 1 4 2042 1 1 12 PRO O O -4.394 -5.915 -2.409 1.00 . A A . 12 PRO O 1 1 4 2043 1 1 13 TYR C C -1.961 -4.966 0.446 1.00 . A A . 13 TYR C 1 1 4 2044 1 1 13 TYR CA C -3.269 -4.597 -0.247 1.00 . A A . 13 TYR CA 1 1 4 2045 1 1 13 TYR CB C -3.859 -3.338 0.392 1.00 . A A . 13 TYR CB 1 1 4 2046 1 1 13 TYR CD1 C -5.384 -2.791 -1.545 1.00 . A A . 13 TYR CD1 1 1 4 2047 1 1 13 TYR CD2 C -6.295 -2.727 0.657 1.00 . A A . 13 TYR CD2 1 1 4 2048 1 1 13 TYR CE1 C -6.611 -2.431 -2.068 1.00 . A A . 13 TYR CE1 1 1 4 2049 1 1 13 TYR CE2 C -7.526 -2.368 0.142 1.00 . A A . 13 TYR CE2 1 1 4 2050 1 1 13 TYR CG C -5.204 -2.945 -0.176 1.00 . A A . 13 TYR CG 1 1 4 2051 1 1 13 TYR CZ C -7.679 -2.220 -1.220 1.00 . A A . 13 TYR CZ 1 1 4 2052 1 1 13 TYR H H -4.515 -6.020 0.702 1.00 . A A . 13 TYR H 1 1 4 2053 1 1 13 TYR HA H -3.068 -4.398 -1.289 1.00 . A A . 13 TYR HA 1 1 4 2054 1 1 13 TYR HB2 H -3.983 -3.505 1.451 1.00 . A A . 13 TYR HB2 1 1 4 2055 1 1 13 TYR HB3 H -3.180 -2.513 0.239 1.00 . A A . 13 TYR HB3 1 1 4 2056 1 1 13 TYR HD1 H -4.546 -2.957 -2.206 1.00 . A A . 13 TYR HD1 1 1 4 2057 1 1 13 TYR HD2 H -6.172 -2.843 1.724 1.00 . A A . 13 TYR HD2 1 1 4 2058 1 1 13 TYR HE1 H -6.731 -2.316 -3.135 1.00 . A A . 13 TYR HE1 1 1 4 2059 1 1 13 TYR HE2 H -8.362 -2.202 0.806 1.00 . A A . 13 TYR HE2 1 1 4 2060 1 1 13 TYR HH H -9.042 -0.922 -1.607 1.00 . A A . 13 TYR HH 1 1 4 2061 1 1 13 TYR N N -4.224 -5.696 -0.176 1.00 . A A . 13 TYR N 1 1 4 2062 1 1 13 TYR O O -1.946 -5.297 1.631 1.00 . A A . 13 TYR O 1 1 4 2063 1 1 13 TYR OH O -8.903 -1.863 -1.738 1.00 . A A . 13 TYR OH 1 1 4 2064 1 1 14 GLU C C 1.483 -4.190 -0.172 1.00 . A A . 14 GLU C 1 1 4 2065 1 1 14 GLU CA C 0.449 -5.235 0.237 1.00 . A A . 14 GLU CA 1 1 4 2066 1 1 14 GLU CB C 0.890 -6.620 -0.241 1.00 . A A . 14 GLU CB 1 1 4 2067 1 1 14 GLU CD C -0.907 -8.301 0.327 1.00 . A A . 14 GLU CD 1 1 4 2068 1 1 14 GLU CG C 0.460 -7.749 0.681 1.00 . A A . 14 GLU CG 1 1 4 2069 1 1 14 GLU H H -0.941 -4.636 -1.243 1.00 . A A . 14 GLU H 1 1 4 2070 1 1 14 GLU HA H 0.371 -5.245 1.314 1.00 . A A . 14 GLU HA 1 1 4 2071 1 1 14 GLU HB2 H 0.469 -6.801 -1.219 1.00 . A A . 14 GLU HB2 1 1 4 2072 1 1 14 GLU HB3 H 1.968 -6.635 -0.315 1.00 . A A . 14 GLU HB3 1 1 4 2073 1 1 14 GLU HG2 H 1.183 -8.548 0.613 1.00 . A A . 14 GLU HG2 1 1 4 2074 1 1 14 GLU HG3 H 0.430 -7.377 1.694 1.00 . A A . 14 GLU HG3 1 1 4 2075 1 1 14 GLU N N -0.865 -4.907 -0.304 1.00 . A A . 14 GLU N 1 1 4 2076 1 1 14 GLU O O 1.302 -3.473 -1.156 1.00 . A A . 14 GLU O 1 1 4 2077 1 1 14 GLU OE1 O -1.846 -7.496 0.156 1.00 . A A . 14 GLU OE1 1 1 4 2078 1 1 14 GLU OE2 O -1.038 -9.539 0.222 1.00 . A A . 14 GLU OE2 1 1 4 2079 1 1 15 CYS C C 4.741 -3.799 -0.512 1.00 . A A . 15 CYS C 1 1 4 2080 1 1 15 CYS CA C 3.631 -3.152 0.312 1.00 . A A . 15 CYS CA 1 1 4 2081 1 1 15 CYS CB C 4.206 -2.600 1.617 1.00 . A A . 15 CYS CB 1 1 4 2082 1 1 15 CYS H H 2.655 -4.708 1.364 1.00 . A A . 15 CYS H 1 1 4 2083 1 1 15 CYS HA H 3.205 -2.340 -0.256 1.00 . A A . 15 CYS HA 1 1 4 2084 1 1 15 CYS HB2 H 3.391 -2.323 2.271 1.00 . A A . 15 CYS HB2 1 1 4 2085 1 1 15 CYS HB3 H 4.799 -3.367 2.094 1.00 . A A . 15 CYS HB3 1 1 4 2086 1 1 15 CYS N N 2.568 -4.109 0.592 1.00 . A A . 15 CYS N 1 1 4 2087 1 1 15 CYS O O 5.190 -4.904 -0.209 1.00 . A A . 15 CYS O 1 1 4 2088 1 1 15 CYS SG S 5.264 -1.133 1.402 1.00 . A A . 15 CYS SG 1 1 4 2089 1 1 16 ASP C C 7.611 -3.224 -1.881 1.00 . A A . 16 ASP C 1 1 4 2090 1 1 16 ASP CA C 6.237 -3.606 -2.422 1.00 . A A . 16 ASP CA 1 1 4 2091 1 1 16 ASP CB C 6.065 -3.062 -3.841 1.00 . A A . 16 ASP CB 1 1 4 2092 1 1 16 ASP CG C 6.713 -3.951 -4.884 1.00 . A A . 16 ASP CG 1 1 4 2093 1 1 16 ASP H H 4.781 -2.226 -1.745 1.00 . A A . 16 ASP H 1 1 4 2094 1 1 16 ASP HA H 6.160 -4.682 -2.447 1.00 . A A . 16 ASP HA 1 1 4 2095 1 1 16 ASP HB2 H 5.011 -2.985 -4.065 1.00 . A A . 16 ASP HB2 1 1 4 2096 1 1 16 ASP HB3 H 6.514 -2.082 -3.901 1.00 . A A . 16 ASP HB3 1 1 4 2097 1 1 16 ASP N N 5.179 -3.102 -1.555 1.00 . A A . 16 ASP N 1 1 4 2098 1 1 16 ASP O O 8.583 -3.136 -2.631 1.00 . A A . 16 ASP O 1 1 4 2099 1 1 16 ASP OD1 O 7.919 -3.772 -5.150 1.00 . A A . 16 ASP OD1 1 1 4 2100 1 1 16 ASP OD2 O 6.012 -4.826 -5.436 1.00 . A A . 16 ASP OD2 1 1 4 2101 1 1 17 VAL C C 9.194 -3.475 1.310 1.00 . A A . 17 VAL C 1 1 4 2102 1 1 17 VAL CA C 8.940 -2.626 0.070 1.00 . A A . 17 VAL CA 1 1 4 2103 1 1 17 VAL CB C 8.946 -1.139 0.468 1.00 . A A . 17 VAL CB 1 1 4 2104 1 1 17 VAL CG1 C 10.248 -0.779 1.168 1.00 . A A . 17 VAL CG1 1 1 4 2105 1 1 17 VAL CG2 C 8.729 -0.259 -0.754 1.00 . A A . 17 VAL CG2 1 1 4 2106 1 1 17 VAL H H 6.876 -3.085 -0.027 1.00 . A A . 17 VAL H 1 1 4 2107 1 1 17 VAL HA H 9.739 -2.792 -0.638 1.00 . A A . 17 VAL HA 1 1 4 2108 1 1 17 VAL HB H 8.133 -0.968 1.158 1.00 . A A . 17 VAL HB 1 1 4 2109 1 1 17 VAL HG11 H 10.402 -1.445 2.004 1.00 . A A . 17 VAL HG11 1 1 4 2110 1 1 17 VAL HG12 H 11.070 -0.875 0.473 1.00 . A A . 17 VAL HG12 1 1 4 2111 1 1 17 VAL HG13 H 10.196 0.239 1.525 1.00 . A A . 17 VAL HG13 1 1 4 2112 1 1 17 VAL HG21 H 8.702 -0.875 -1.641 1.00 . A A . 17 VAL HG21 1 1 4 2113 1 1 17 VAL HG22 H 7.793 0.270 -0.654 1.00 . A A . 17 VAL HG22 1 1 4 2114 1 1 17 VAL HG23 H 9.537 0.453 -0.835 1.00 . A A . 17 VAL HG23 1 1 4 2115 1 1 17 VAL N N 7.685 -2.999 -0.573 1.00 . A A . 17 VAL N 1 1 4 2116 1 1 17 VAL O O 10.279 -4.032 1.483 1.00 . A A . 17 VAL O 1 1 4 2117 1 1 18 CYS C C 7.388 -5.570 3.353 1.00 . A A . 18 CYS C 1 1 4 2118 1 1 18 CYS CA C 8.301 -4.349 3.399 1.00 . A A . 18 CYS CA 1 1 4 2119 1 1 18 CYS CB C 7.954 -3.484 4.613 1.00 . A A . 18 CYS CB 1 1 4 2120 1 1 18 CYS H H 7.347 -3.101 1.980 1.00 . A A . 18 CYS H 1 1 4 2121 1 1 18 CYS HA H 9.324 -4.682 3.487 1.00 . A A . 18 CYS HA 1 1 4 2122 1 1 18 CYS HB2 H 8.071 -4.074 5.510 1.00 . A A . 18 CYS HB2 1 1 4 2123 1 1 18 CYS HB3 H 8.629 -2.642 4.651 1.00 . A A . 18 CYS HB3 1 1 4 2124 1 1 18 CYS N N 8.188 -3.568 2.173 1.00 . A A . 18 CYS N 1 1 4 2125 1 1 18 CYS O O 7.409 -6.408 4.255 1.00 . A A . 18 CYS O 1 1 4 2126 1 1 18 CYS SG S 6.253 -2.832 4.598 1.00 . A A . 18 CYS SG 1 1 4 2127 1 1 19 ARG C C 4.687 -6.855 3.300 1.00 . A A . 19 ARG C 1 1 4 2128 1 1 19 ARG CA C 5.667 -6.782 2.132 1.00 . A A . 19 ARG CA 1 1 4 2129 1 1 19 ARG CB C 6.441 -8.097 2.021 1.00 . A A . 19 ARG CB 1 1 4 2130 1 1 19 ARG CD C 6.521 -8.420 -0.471 1.00 . A A . 19 ARG CD 1 1 4 2131 1 1 19 ARG CG C 7.333 -8.176 0.792 1.00 . A A . 19 ARG CG 1 1 4 2132 1 1 19 ARG CZ C 6.751 -9.821 -2.477 1.00 . A A . 19 ARG CZ 1 1 4 2133 1 1 19 ARG H H 6.617 -4.965 1.610 1.00 . A A . 19 ARG H 1 1 4 2134 1 1 19 ARG HA H 5.111 -6.624 1.220 1.00 . A A . 19 ARG HA 1 1 4 2135 1 1 19 ARG HB2 H 7.063 -8.211 2.897 1.00 . A A . 19 ARG HB2 1 1 4 2136 1 1 19 ARG HB3 H 5.736 -8.914 1.980 1.00 . A A . 19 ARG HB3 1 1 4 2137 1 1 19 ARG HD2 H 5.659 -9.019 -0.218 1.00 . A A . 19 ARG HD2 1 1 4 2138 1 1 19 ARG HD3 H 6.195 -7.468 -0.862 1.00 . A A . 19 ARG HD3 1 1 4 2139 1 1 19 ARG HE H 8.273 -9.048 -1.447 1.00 . A A . 19 ARG HE 1 1 4 2140 1 1 19 ARG HG2 H 7.869 -7.244 0.687 1.00 . A A . 19 ARG HG2 1 1 4 2141 1 1 19 ARG HG3 H 8.035 -8.986 0.920 1.00 . A A . 19 ARG HG3 1 1 4 2142 1 1 19 ARG HH11 H 4.847 -9.474 -1.896 1.00 . A A . 19 ARG HH11 1 1 4 2143 1 1 19 ARG HH12 H 5.024 -10.460 -3.310 1.00 . A A . 19 ARG HH12 1 1 4 2144 1 1 19 ARG HH21 H 8.518 -10.345 -3.307 1.00 . A A . 19 ARG HH21 1 1 4 2145 1 1 19 ARG HH22 H 7.112 -10.956 -4.111 1.00 . A A . 19 ARG HH22 1 1 4 2146 1 1 19 ARG N N 6.588 -5.664 2.296 1.00 . A A . 19 ARG N 1 1 4 2147 1 1 19 ARG NE N 7.297 -9.114 -1.495 1.00 . A A . 19 ARG NE 1 1 4 2148 1 1 19 ARG NH1 N 5.432 -9.928 -2.568 1.00 . A A . 19 ARG NH1 1 1 4 2149 1 1 19 ARG NH2 N 7.524 -10.424 -3.372 1.00 . A A . 19 ARG NH2 1 1 4 2150 1 1 19 ARG O O 4.478 -7.918 3.885 1.00 . A A . 19 ARG O 1 1 4 2151 1 1 20 LYS C C 1.707 -5.496 4.201 1.00 . A A . 20 LYS C 1 1 4 2152 1 1 20 LYS CA C 3.129 -5.650 4.731 1.00 . A A . 20 LYS CA 1 1 4 2153 1 1 20 LYS CB C 3.467 -4.482 5.660 1.00 . A A . 20 LYS CB 1 1 4 2154 1 1 20 LYS CD C 3.275 -3.543 7.982 1.00 . A A . 20 LYS CD 1 1 4 2155 1 1 20 LYS CE C 2.315 -3.285 9.133 1.00 . A A . 20 LYS CE 1 1 4 2156 1 1 20 LYS CG C 2.669 -4.482 6.952 1.00 . A A . 20 LYS CG 1 1 4 2157 1 1 20 LYS H H 4.295 -4.902 3.130 1.00 . A A . 20 LYS H 1 1 4 2158 1 1 20 LYS HA H 3.196 -6.572 5.287 1.00 . A A . 20 LYS HA 1 1 4 2159 1 1 20 LYS HB2 H 4.517 -4.529 5.910 1.00 . A A . 20 LYS HB2 1 1 4 2160 1 1 20 LYS HB3 H 3.270 -3.555 5.140 1.00 . A A . 20 LYS HB3 1 1 4 2161 1 1 20 LYS HD2 H 4.178 -3.987 8.374 1.00 . A A . 20 LYS HD2 1 1 4 2162 1 1 20 LYS HD3 H 3.511 -2.603 7.504 1.00 . A A . 20 LYS HD3 1 1 4 2163 1 1 20 LYS HE2 H 1.939 -4.231 9.491 1.00 . A A . 20 LYS HE2 1 1 4 2164 1 1 20 LYS HE3 H 2.852 -2.788 9.928 1.00 . A A . 20 LYS HE3 1 1 4 2165 1 1 20 LYS HG2 H 1.659 -4.164 6.741 1.00 . A A . 20 LYS HG2 1 1 4 2166 1 1 20 LYS HG3 H 2.656 -5.485 7.356 1.00 . A A . 20 LYS HG3 1 1 4 2167 1 1 20 LYS HZ1 H 1.501 -1.483 8.459 1.00 . A A . 20 LYS HZ1 1 1 4 2168 1 1 20 LYS HZ2 H 0.483 -2.349 9.497 1.00 . A A . 20 LYS HZ2 1 1 4 2169 1 1 20 LYS HZ3 H 0.687 -2.855 7.897 1.00 . A A . 20 LYS HZ3 1 1 4 2170 1 1 20 LYS N N 4.088 -5.717 3.634 1.00 . A A . 20 LYS N 1 1 4 2171 1 1 20 LYS NZ N 1.166 -2.433 8.717 1.00 . A A . 20 LYS NZ 1 1 4 2172 1 1 20 LYS O O 1.455 -4.707 3.291 1.00 . A A . 20 LYS O 1 1 4 2173 1 1 21 ALA C C -1.408 -5.231 5.238 1.00 . A A . 21 ALA C 1 1 4 2174 1 1 21 ALA CA C -0.617 -6.200 4.366 1.00 . A A . 21 ALA CA 1 1 4 2175 1 1 21 ALA CB C -1.237 -7.588 4.420 1.00 . A A . 21 ALA CB 1 1 4 2176 1 1 21 ALA H H 1.043 -6.864 5.499 1.00 . A A . 21 ALA H 1 1 4 2177 1 1 21 ALA HA H -0.650 -5.857 3.342 1.00 . A A . 21 ALA HA 1 1 4 2178 1 1 21 ALA HB1 H -2.295 -7.502 4.616 1.00 . A A . 21 ALA HB1 1 1 4 2179 1 1 21 ALA HB2 H -1.086 -8.086 3.473 1.00 . A A . 21 ALA HB2 1 1 4 2180 1 1 21 ALA HB3 H -0.770 -8.161 5.207 1.00 . A A . 21 ALA HB3 1 1 4 2181 1 1 21 ALA N N 0.781 -6.255 4.778 1.00 . A A . 21 ALA N 1 1 4 2182 1 1 21 ALA O O -1.227 -5.185 6.455 1.00 . A A . 21 ALA O 1 1 4 2183 1 1 22 PHE C C -4.587 -3.712 5.045 1.00 . A A . 22 PHE C 1 1 4 2184 1 1 22 PHE CA C -3.104 -3.487 5.326 1.00 . A A . 22 PHE CA 1 1 4 2185 1 1 22 PHE CB C -2.709 -2.062 4.931 1.00 . A A . 22 PHE CB 1 1 4 2186 1 1 22 PHE CD1 C -0.290 -2.333 4.320 1.00 . A A . 22 PHE CD1 1 1 4 2187 1 1 22 PHE CD2 C -0.843 -0.917 6.157 1.00 . A A . 22 PHE CD2 1 1 4 2188 1 1 22 PHE CE1 C 1.052 -2.061 4.509 1.00 . A A . 22 PHE CE1 1 1 4 2189 1 1 22 PHE CE2 C 0.497 -0.641 6.351 1.00 . A A . 22 PHE CE2 1 1 4 2190 1 1 22 PHE CG C -1.251 -1.765 5.140 1.00 . A A . 22 PHE CG 1 1 4 2191 1 1 22 PHE CZ C 1.446 -1.215 5.526 1.00 . A A . 22 PHE CZ 1 1 4 2192 1 1 22 PHE H H -2.384 -4.540 3.636 1.00 . A A . 22 PHE H 1 1 4 2193 1 1 22 PHE HA H -2.925 -3.621 6.382 1.00 . A A . 22 PHE HA 1 1 4 2194 1 1 22 PHE HB2 H -2.931 -1.912 3.885 1.00 . A A . 22 PHE HB2 1 1 4 2195 1 1 22 PHE HB3 H -3.280 -1.362 5.521 1.00 . A A . 22 PHE HB3 1 1 4 2196 1 1 22 PHE HD1 H -0.598 -2.996 3.523 1.00 . A A . 22 PHE HD1 1 1 4 2197 1 1 22 PHE HD2 H -1.583 -0.469 6.803 1.00 . A A . 22 PHE HD2 1 1 4 2198 1 1 22 PHE HE1 H 1.791 -2.511 3.863 1.00 . A A . 22 PHE HE1 1 1 4 2199 1 1 22 PHE HE2 H 0.803 0.021 7.147 1.00 . A A . 22 PHE HE2 1 1 4 2200 1 1 22 PHE HZ H 2.494 -1.000 5.676 1.00 . A A . 22 PHE HZ 1 1 4 2201 1 1 22 PHE N N -2.285 -4.457 4.608 1.00 . A A . 22 PHE N 1 1 4 2202 1 1 22 PHE O O -4.965 -4.133 3.952 1.00 . A A . 22 PHE O 1 1 4 2203 1 1 23 SER C C -7.424 -2.671 4.835 1.00 . A A . 23 SER C 1 1 4 2204 1 1 23 SER CA C -6.862 -3.605 5.903 1.00 . A A . 23 SER CA 1 1 4 2205 1 1 23 SER CB C -7.559 -3.346 7.240 1.00 . A A . 23 SER CB 1 1 4 2206 1 1 23 SER H H -5.058 -3.097 6.888 1.00 . A A . 23 SER H 1 1 4 2207 1 1 23 SER HA H -7.045 -4.626 5.603 1.00 . A A . 23 SER HA 1 1 4 2208 1 1 23 SER HB2 H -7.152 -2.451 7.687 1.00 . A A . 23 SER HB2 1 1 4 2209 1 1 23 SER HB3 H -8.618 -3.215 7.072 1.00 . A A . 23 SER HB3 1 1 4 2210 1 1 23 SER HG H -6.602 -4.259 8.686 1.00 . A A . 23 SER HG 1 1 4 2211 1 1 23 SER N N -5.421 -3.429 6.040 1.00 . A A . 23 SER N 1 1 4 2212 1 1 23 SER O O -8.192 -3.091 3.968 1.00 . A A . 23 SER O 1 1 4 2213 1 1 23 SER OG O -7.368 -4.429 8.133 1.00 . A A . 23 SER OG 1 1 4 2214 1 1 24 HIS C C -6.335 0.129 3.112 1.00 . A A . 24 HIS C 1 1 4 2215 1 1 24 HIS CA C -7.498 -0.407 3.942 1.00 . A A . 24 HIS CA 1 1 4 2216 1 1 24 HIS CB C -8.197 0.745 4.665 1.00 . A A . 24 HIS CB 1 1 4 2217 1 1 24 HIS CD2 C -10.150 1.100 2.996 1.00 . A A . 24 HIS CD2 1 1 4 2218 1 1 24 HIS CE1 C -10.041 3.284 2.836 1.00 . A A . 24 HIS CE1 1 1 4 2219 1 1 24 HIS CG C -9.138 1.517 3.793 1.00 . A A . 24 HIS CG 1 1 4 2220 1 1 24 HIS H H -6.421 -1.128 5.616 1.00 . A A . 24 HIS H 1 1 4 2221 1 1 24 HIS HA H -8.204 -0.888 3.282 1.00 . A A . 24 HIS HA 1 1 4 2222 1 1 24 HIS HB2 H -8.764 0.349 5.495 1.00 . A A . 24 HIS HB2 1 1 4 2223 1 1 24 HIS HB3 H -7.451 1.431 5.040 1.00 . A A . 24 HIS HB3 1 1 4 2224 1 1 24 HIS HD1 H -8.466 3.486 4.126 1.00 . A A . 24 HIS HD1 1 1 4 2225 1 1 24 HIS HD2 H -10.470 0.078 2.847 1.00 . A A . 24 HIS HD2 1 1 4 2226 1 1 24 HIS HE1 H -10.245 4.304 2.549 1.00 . A A . 24 HIS HE1 1 1 4 2227 1 1 24 HIS N N -7.034 -1.402 4.903 1.00 . A A . 24 HIS N 1 1 4 2228 1 1 24 HIS ND1 N -9.095 2.889 3.669 1.00 . A A . 24 HIS ND1 1 1 4 2229 1 1 24 HIS NE2 N -10.695 2.217 2.413 1.00 . A A . 24 HIS NE2 1 1 4 2230 1 1 24 HIS O O -5.209 0.234 3.597 1.00 . A A . 24 HIS O 1 1 4 2231 1 1 25 HIS C C -4.883 2.186 1.584 1.00 . A A . 25 HIS C 1 1 4 2232 1 1 25 HIS CA C -5.594 0.990 0.959 1.00 . A A . 25 HIS CA 1 1 4 2233 1 1 25 HIS CB C -6.218 1.394 -0.378 1.00 . A A . 25 HIS CB 1 1 4 2234 1 1 25 HIS CD2 C -4.242 0.690 -1.904 1.00 . A A . 25 HIS CD2 1 1 4 2235 1 1 25 HIS CE1 C -4.187 2.463 -3.193 1.00 . A A . 25 HIS CE1 1 1 4 2236 1 1 25 HIS CG C -5.221 1.527 -1.488 1.00 . A A . 25 HIS CG 1 1 4 2237 1 1 25 HIS H H -7.533 0.358 1.527 1.00 . A A . 25 HIS H 1 1 4 2238 1 1 25 HIS HA H -4.871 0.207 0.786 1.00 . A A . 25 HIS HA 1 1 4 2239 1 1 25 HIS HB2 H -6.941 0.647 -0.670 1.00 . A A . 25 HIS HB2 1 1 4 2240 1 1 25 HIS HB3 H -6.716 2.345 -0.262 1.00 . A A . 25 HIS HB3 1 1 4 2241 1 1 25 HIS HD1 H -5.743 3.414 -2.267 1.00 . A A . 25 HIS HD1 1 1 4 2242 1 1 25 HIS HD2 H -4.000 -0.275 -1.481 1.00 . A A . 25 HIS HD2 1 1 4 2243 1 1 25 HIS HE1 H -3.906 3.163 -3.966 1.00 . A A . 25 HIS HE1 1 1 4 2244 1 1 25 HIS N N -6.617 0.465 1.857 1.00 . A A . 25 HIS N 1 1 4 2245 1 1 25 HIS ND1 N -5.159 2.629 -2.315 1.00 . A A . 25 HIS ND1 1 1 4 2246 1 1 25 HIS NE2 N -3.614 1.294 -2.965 1.00 . A A . 25 HIS NE2 1 1 4 2247 1 1 25 HIS O O -3.666 2.172 1.764 1.00 . A A . 25 HIS O 1 1 4 2248 1 1 26 ALA C C -3.920 4.085 3.429 1.00 . A A . 26 ALA C 1 1 4 2249 1 1 26 ALA CA C -5.096 4.423 2.519 1.00 . A A . 26 ALA CA 1 1 4 2250 1 1 26 ALA CB C -6.171 5.167 3.296 1.00 . A A . 26 ALA CB 1 1 4 2251 1 1 26 ALA H H -6.616 3.171 1.744 1.00 . A A . 26 ALA H 1 1 4 2252 1 1 26 ALA HA H -4.749 5.067 1.724 1.00 . A A . 26 ALA HA 1 1 4 2253 1 1 26 ALA HB1 H -6.839 4.455 3.758 1.00 . A A . 26 ALA HB1 1 1 4 2254 1 1 26 ALA HB2 H -5.707 5.774 4.060 1.00 . A A . 26 ALA HB2 1 1 4 2255 1 1 26 ALA HB3 H -6.729 5.800 2.622 1.00 . A A . 26 ALA HB3 1 1 4 2256 1 1 26 ALA N N -5.652 3.219 1.912 1.00 . A A . 26 ALA N 1 1 4 2257 1 1 26 ALA O O -2.832 4.642 3.286 1.00 . A A . 26 ALA O 1 1 4 2258 1 1 27 SER C C -1.809 2.439 4.569 1.00 . A A . 27 SER C 1 1 4 2259 1 1 27 SER CA C -3.106 2.763 5.304 1.00 . A A . 27 SER CA 1 1 4 2260 1 1 27 SER CB C -3.566 1.547 6.111 1.00 . A A . 27 SER CB 1 1 4 2261 1 1 27 SER H H -5.035 2.762 4.431 1.00 . A A . 27 SER H 1 1 4 2262 1 1 27 SER HA H -2.928 3.586 5.980 1.00 . A A . 27 SER HA 1 1 4 2263 1 1 27 SER HB2 H -4.639 1.574 6.219 1.00 . A A . 27 SER HB2 1 1 4 2264 1 1 27 SER HB3 H -3.279 0.644 5.590 1.00 . A A . 27 SER HB3 1 1 4 2265 1 1 27 SER HG H -2.962 0.640 7.739 1.00 . A A . 27 SER HG 1 1 4 2266 1 1 27 SER N N -4.146 3.171 4.367 1.00 . A A . 27 SER N 1 1 4 2267 1 1 27 SER O O -0.724 2.835 4.997 1.00 . A A . 27 SER O 1 1 4 2268 1 1 27 SER OG O -2.977 1.538 7.400 1.00 . A A . 27 SER OG 1 1 4 2269 1 1 28 LEU C C -0.261 2.522 1.843 1.00 . A A . 28 LEU C 1 1 4 2270 1 1 28 LEU CA C -0.767 1.339 2.664 1.00 . A A . 28 LEU CA 1 1 4 2271 1 1 28 LEU CB C -1.117 0.173 1.737 1.00 . A A . 28 LEU CB 1 1 4 2272 1 1 28 LEU CD1 C 1.204 -0.486 1.058 1.00 . A A . 28 LEU CD1 1 1 4 2273 1 1 28 LEU CD2 C -0.741 -1.097 -0.391 1.00 . A A . 28 LEU CD2 1 1 4 2274 1 1 28 LEU CG C -0.167 -0.057 0.561 1.00 . A A . 28 LEU CG 1 1 4 2275 1 1 28 LEU H H -2.820 1.432 3.169 1.00 . A A . 28 LEU H 1 1 4 2276 1 1 28 LEU HA H 0.013 1.028 3.343 1.00 . A A . 28 LEU HA 1 1 4 2277 1 1 28 LEU HB2 H -1.131 -0.728 2.331 1.00 . A A . 28 LEU HB2 1 1 4 2278 1 1 28 LEU HB3 H -2.104 0.355 1.337 1.00 . A A . 28 LEU HB3 1 1 4 2279 1 1 28 LEU HD11 H 1.891 -0.532 0.226 1.00 . A A . 28 LEU HD11 1 1 4 2280 1 1 28 LEU HD12 H 1.132 -1.460 1.519 1.00 . A A . 28 LEU HD12 1 1 4 2281 1 1 28 LEU HD13 H 1.564 0.229 1.783 1.00 . A A . 28 LEU HD13 1 1 4 2282 1 1 28 LEU HD21 H -1.230 -1.874 0.176 1.00 . A A . 28 LEU HD21 1 1 4 2283 1 1 28 LEU HD22 H 0.058 -1.527 -0.977 1.00 . A A . 28 LEU HD22 1 1 4 2284 1 1 28 LEU HD23 H -1.456 -0.625 -1.050 1.00 . A A . 28 LEU HD23 1 1 4 2285 1 1 28 LEU HG H -0.049 0.869 0.015 1.00 . A A . 28 LEU HG 1 1 4 2286 1 1 28 LEU N N -1.930 1.717 3.460 1.00 . A A . 28 LEU N 1 1 4 2287 1 1 28 LEU O O 0.944 2.757 1.750 1.00 . A A . 28 LEU O 1 1 4 2288 1 1 29 THR C C 0.019 5.406 1.226 1.00 . A A . 29 THR C 1 1 4 2289 1 1 29 THR CA C -0.840 4.423 0.439 1.00 . A A . 29 THR CA 1 1 4 2290 1 1 29 THR CB C -2.097 5.152 -0.072 1.00 . A A . 29 THR CB 1 1 4 2291 1 1 29 THR CG2 C -1.760 6.570 -0.509 1.00 . A A . 29 THR CG2 1 1 4 2292 1 1 29 THR H H -2.135 3.027 1.362 1.00 . A A . 29 THR H 1 1 4 2293 1 1 29 THR HA H -0.279 4.074 -0.416 1.00 . A A . 29 THR HA 1 1 4 2294 1 1 29 THR HB H -2.818 5.201 0.731 1.00 . A A . 29 THR HB 1 1 4 2295 1 1 29 THR HG1 H -3.241 3.739 -0.835 1.00 . A A . 29 THR HG1 1 1 4 2296 1 1 29 THR HG21 H -2.033 7.262 0.273 1.00 . A A . 29 THR HG21 1 1 4 2297 1 1 29 THR HG22 H -2.308 6.810 -1.408 1.00 . A A . 29 THR HG22 1 1 4 2298 1 1 29 THR HG23 H -0.700 6.645 -0.702 1.00 . A A . 29 THR HG23 1 1 4 2299 1 1 29 THR N N -1.191 3.265 1.250 1.00 . A A . 29 THR N 1 1 4 2300 1 1 29 THR O O 1.057 5.860 0.745 1.00 . A A . 29 THR O 1 1 4 2301 1 1 29 THR OG1 O -2.668 4.433 -1.171 1.00 . A A . 29 THR OG1 1 1 4 2302 1 1 30 GLN C C 1.561 6.004 3.866 1.00 . A A . 30 GLN C 1 1 4 2303 1 1 30 GLN CA C 0.310 6.660 3.291 1.00 . A A . 30 GLN CA 1 1 4 2304 1 1 30 GLN CB C -0.588 7.156 4.426 1.00 . A A . 30 GLN CB 1 1 4 2305 1 1 30 GLN CD C -0.725 8.294 6.678 1.00 . A A . 30 GLN CD 1 1 4 2306 1 1 30 GLN CG C 0.165 7.906 5.514 1.00 . A A . 30 GLN CG 1 1 4 2307 1 1 30 GLN H H -1.254 5.335 2.765 1.00 . A A . 30 GLN H 1 1 4 2308 1 1 30 GLN HA H 0.607 7.502 2.685 1.00 . A A . 30 GLN HA 1 1 4 2309 1 1 30 GLN HB2 H -1.336 7.817 4.015 1.00 . A A . 30 GLN HB2 1 1 4 2310 1 1 30 GLN HB3 H -1.079 6.307 4.878 1.00 . A A . 30 GLN HB3 1 1 4 2311 1 1 30 GLN HE21 H 0.666 7.705 7.970 1.00 . A A . 30 GLN HE21 1 1 4 2312 1 1 30 GLN HE22 H -0.786 8.331 8.664 1.00 . A A . 30 GLN HE22 1 1 4 2313 1 1 30 GLN HG2 H 0.960 7.276 5.883 1.00 . A A . 30 GLN HG2 1 1 4 2314 1 1 30 GLN HG3 H 0.587 8.804 5.087 1.00 . A A . 30 GLN HG3 1 1 4 2315 1 1 30 GLN N N -0.420 5.730 2.438 1.00 . A A . 30 GLN N 1 1 4 2316 1 1 30 GLN NE2 N -0.233 8.089 7.894 1.00 . A A . 30 GLN NE2 1 1 4 2317 1 1 30 GLN O O 2.646 6.586 3.845 1.00 . A A . 30 GLN O 1 1 4 2318 1 1 30 GLN OE1 O -1.844 8.772 6.487 1.00 . A A . 30 GLN OE1 1 1 4 2319 1 1 31 HIS C C 3.719 4.052 4.019 1.00 . A A . 31 HIS C 1 1 4 2320 1 1 31 HIS CA C 2.519 4.052 4.962 1.00 . A A . 31 HIS CA 1 1 4 2321 1 1 31 HIS CB C 2.102 2.615 5.276 1.00 . A A . 31 HIS CB 1 1 4 2322 1 1 31 HIS CD2 C 3.747 0.890 4.253 1.00 . A A . 31 HIS CD2 1 1 4 2323 1 1 31 HIS CE1 C 4.928 0.468 6.051 1.00 . A A . 31 HIS CE1 1 1 4 2324 1 1 31 HIS CG C 3.242 1.643 5.258 1.00 . A A . 31 HIS CG 1 1 4 2325 1 1 31 HIS H H 0.513 4.377 4.369 1.00 . A A . 31 HIS H 1 1 4 2326 1 1 31 HIS HA H 2.799 4.545 5.880 1.00 . A A . 31 HIS HA 1 1 4 2327 1 1 31 HIS HB2 H 1.656 2.583 6.259 1.00 . A A . 31 HIS HB2 1 1 4 2328 1 1 31 HIS HB3 H 1.376 2.290 4.545 1.00 . A A . 31 HIS HB3 1 1 4 2329 1 1 31 HIS HD1 H 3.884 1.744 7.262 1.00 . A A . 31 HIS HD1 1 1 4 2330 1 1 31 HIS HD2 H 3.392 0.861 3.232 1.00 . A A . 31 HIS HD2 1 1 4 2331 1 1 31 HIS HE1 H 5.668 0.057 6.721 1.00 . A A . 31 HIS HE1 1 1 4 2332 1 1 31 HIS N N 1.402 4.788 4.381 1.00 . A A . 31 HIS N 1 1 4 2333 1 1 31 HIS ND1 N 4.003 1.355 6.371 1.00 . A A . 31 HIS ND1 1 1 4 2334 1 1 31 HIS NE2 N 4.794 0.169 4.771 1.00 . A A . 31 HIS NE2 1 1 4 2335 1 1 31 HIS O O 4.860 4.204 4.453 1.00 . A A . 31 HIS O 1 1 4 2336 1 1 32 GLN C C 5.514 4.979 1.971 1.00 . A A . 32 GLN C 1 1 4 2337 1 1 32 GLN CA C 4.509 3.858 1.726 1.00 . A A . 32 GLN CA 1 1 4 2338 1 1 32 GLN CB C 3.914 3.987 0.323 1.00 . A A . 32 GLN CB 1 1 4 2339 1 1 32 GLN CD C 3.465 2.604 -1.743 1.00 . A A . 32 GLN CD 1 1 4 2340 1 1 32 GLN CG C 3.374 2.679 -0.232 1.00 . A A . 32 GLN CG 1 1 4 2341 1 1 32 GLN H H 2.521 3.763 2.445 1.00 . A A . 32 GLN H 1 1 4 2342 1 1 32 GLN HA H 5.021 2.910 1.804 1.00 . A A . 32 GLN HA 1 1 4 2343 1 1 32 GLN HB2 H 3.106 4.702 0.352 1.00 . A A . 32 GLN HB2 1 1 4 2344 1 1 32 GLN HB3 H 4.680 4.349 -0.348 1.00 . A A . 32 GLN HB3 1 1 4 2345 1 1 32 GLN HE21 H 2.712 0.764 -1.722 1.00 . A A . 32 GLN HE21 1 1 4 2346 1 1 32 GLN HE22 H 3.098 1.400 -3.281 1.00 . A A . 32 GLN HE22 1 1 4 2347 1 1 32 GLN HG2 H 3.942 1.863 0.188 1.00 . A A . 32 GLN HG2 1 1 4 2348 1 1 32 GLN HG3 H 2.338 2.581 0.057 1.00 . A A . 32 GLN HG3 1 1 4 2349 1 1 32 GLN N N 3.451 3.879 2.729 1.00 . A A . 32 GLN N 1 1 4 2350 1 1 32 GLN NE2 N 3.051 1.476 -2.306 1.00 . A A . 32 GLN NE2 1 1 4 2351 1 1 32 GLN O O 6.691 4.856 1.631 1.00 . A A . 32 GLN O 1 1 4 2352 1 1 32 GLN OE1 O 3.904 3.550 -2.398 1.00 . A A . 32 GLN OE1 1 1 4 2353 1 1 33 ARG C C 7.103 6.795 3.688 1.00 . A A . 33 ARG C 1 1 4 2354 1 1 33 ARG CA C 5.898 7.215 2.850 1.00 . A A . 33 ARG CA 1 1 4 2355 1 1 33 ARG CB C 5.107 8.300 3.583 1.00 . A A . 33 ARG CB 1 1 4 2356 1 1 33 ARG CD C 3.680 10.346 3.279 1.00 . A A . 33 ARG CD 1 1 4 2357 1 1 33 ARG CG C 4.069 8.989 2.713 1.00 . A A . 33 ARG CG 1 1 4 2358 1 1 33 ARG CZ C 2.606 11.270 5.289 1.00 . A A . 33 ARG CZ 1 1 4 2359 1 1 33 ARG H H 4.094 6.110 2.809 1.00 . A A . 33 ARG H 1 1 4 2360 1 1 33 ARG HA H 6.250 7.612 1.910 1.00 . A A . 33 ARG HA 1 1 4 2361 1 1 33 ARG HB2 H 4.600 7.853 4.425 1.00 . A A . 33 ARG HB2 1 1 4 2362 1 1 33 ARG HB3 H 5.796 9.048 3.945 1.00 . A A . 33 ARG HB3 1 1 4 2363 1 1 33 ARG HD2 H 4.564 10.964 3.336 1.00 . A A . 33 ARG HD2 1 1 4 2364 1 1 33 ARG HD3 H 2.962 10.805 2.616 1.00 . A A . 33 ARG HD3 1 1 4 2365 1 1 33 ARG HE H 3.060 9.346 5.021 1.00 . A A . 33 ARG HE 1 1 4 2366 1 1 33 ARG HG2 H 4.477 9.128 1.723 1.00 . A A . 33 ARG HG2 1 1 4 2367 1 1 33 ARG HG3 H 3.189 8.366 2.658 1.00 . A A . 33 ARG HG3 1 1 4 2368 1 1 33 ARG HH11 H 3.026 12.625 3.850 1.00 . A A . 33 ARG HH11 1 1 4 2369 1 1 33 ARG HH12 H 2.269 13.263 5.272 1.00 . A A . 33 ARG HH12 1 1 4 2370 1 1 33 ARG HH21 H 2.062 10.174 6.898 1.00 . A A . 33 ARG HH21 1 1 4 2371 1 1 33 ARG HH22 H 1.722 11.868 7.005 1.00 . A A . 33 ARG HH22 1 1 4 2372 1 1 33 ARG N N 5.042 6.071 2.562 1.00 . A A . 33 ARG N 1 1 4 2373 1 1 33 ARG NE N 3.093 10.235 4.612 1.00 . A A . 33 ARG NE 1 1 4 2374 1 1 33 ARG NH1 N 2.637 12.486 4.760 1.00 . A A . 33 ARG NH1 1 1 4 2375 1 1 33 ARG NH2 N 2.087 11.089 6.497 1.00 . A A . 33 ARG NH2 1 1 4 2376 1 1 33 ARG O O 8.238 7.165 3.391 1.00 . A A . 33 ARG O 1 1 4 2377 1 1 34 VAL C C 9.142 5.141 4.821 1.00 . A A . 34 VAL C 1 1 4 2378 1 1 34 VAL CA C 7.908 5.548 5.618 1.00 . A A . 34 VAL CA 1 1 4 2379 1 1 34 VAL CB C 7.442 4.352 6.469 1.00 . A A . 34 VAL CB 1 1 4 2380 1 1 34 VAL CG1 C 6.247 4.740 7.327 1.00 . A A . 34 VAL CG1 1 1 4 2381 1 1 34 VAL CG2 C 7.106 3.164 5.579 1.00 . A A . 34 VAL CG2 1 1 4 2382 1 1 34 VAL H H 5.920 5.758 4.922 1.00 . A A . 34 VAL H 1 1 4 2383 1 1 34 VAL HA H 8.172 6.356 6.284 1.00 . A A . 34 VAL HA 1 1 4 2384 1 1 34 VAL HB H 8.250 4.066 7.125 1.00 . A A . 34 VAL HB 1 1 4 2385 1 1 34 VAL HG11 H 5.724 5.563 6.863 1.00 . A A . 34 VAL HG11 1 1 4 2386 1 1 34 VAL HG12 H 5.581 3.895 7.420 1.00 . A A . 34 VAL HG12 1 1 4 2387 1 1 34 VAL HG13 H 6.590 5.039 8.306 1.00 . A A . 34 VAL HG13 1 1 4 2388 1 1 34 VAL HG21 H 7.782 2.350 5.796 1.00 . A A . 34 VAL HG21 1 1 4 2389 1 1 34 VAL HG22 H 6.091 2.850 5.767 1.00 . A A . 34 VAL HG22 1 1 4 2390 1 1 34 VAL HG23 H 7.208 3.450 4.542 1.00 . A A . 34 VAL HG23 1 1 4 2391 1 1 34 VAL N N 6.846 6.019 4.737 1.00 . A A . 34 VAL N 1 1 4 2392 1 1 34 VAL O O 10.267 5.219 5.315 1.00 . A A . 34 VAL O 1 1 4 2393 1 1 35 HIS C C 10.413 5.406 1.759 1.00 . A A . 35 HIS C 1 1 4 2394 1 1 35 HIS CA C 10.020 4.286 2.717 1.00 . A A . 35 HIS CA 1 1 4 2395 1 1 35 HIS CB C 9.624 3.038 1.927 1.00 . A A . 35 HIS CB 1 1 4 2396 1 1 35 HIS CD2 C 7.752 1.359 2.561 1.00 . A A . 35 HIS CD2 1 1 4 2397 1 1 35 HIS CE1 C 8.609 0.617 4.437 1.00 . A A . 35 HIS CE1 1 1 4 2398 1 1 35 HIS CG C 8.927 2.001 2.753 1.00 . A A . 35 HIS CG 1 1 4 2399 1 1 35 HIS H H 8.005 4.665 3.247 1.00 . A A . 35 HIS H 1 1 4 2400 1 1 35 HIS HA H 10.867 4.051 3.343 1.00 . A A . 35 HIS HA 1 1 4 2401 1 1 35 HIS HB2 H 8.959 3.324 1.125 1.00 . A A . 35 HIS HB2 1 1 4 2402 1 1 35 HIS HB3 H 10.512 2.588 1.508 1.00 . A A . 35 HIS HB3 1 1 4 2403 1 1 35 HIS HD1 H 10.286 1.786 4.349 1.00 . A A . 35 HIS HD1 1 1 4 2404 1 1 35 HIS HD2 H 7.075 1.494 1.728 1.00 . A A . 35 HIS HD2 1 1 4 2405 1 1 35 HIS HE1 H 8.750 0.068 5.357 1.00 . A A . 35 HIS HE1 1 1 4 2406 1 1 35 HIS N N 8.924 4.705 3.584 1.00 . A A . 35 HIS N 1 1 4 2407 1 1 35 HIS ND1 N 9.439 1.515 3.938 1.00 . A A . 35 HIS ND1 1 1 4 2408 1 1 35 HIS NE2 N 7.577 0.504 3.622 1.00 . A A . 35 HIS NE2 1 1 4 2409 1 1 35 HIS O O 10.066 5.377 0.578 1.00 . A A . 35 HIS O 1 1 4 2410 1 1 36 SER C C 12.832 7.174 0.676 1.00 . A A . 36 SER C 1 1 4 2411 1 1 36 SER CA C 11.576 7.525 1.467 1.00 . A A . 36 SER CA 1 1 4 2412 1 1 36 SER CB C 11.842 8.741 2.356 1.00 . A A . 36 SER CB 1 1 4 2413 1 1 36 SER H H 11.384 6.359 3.224 1.00 . A A . 36 SER H 1 1 4 2414 1 1 36 SER HA H 10.783 7.763 0.774 1.00 . A A . 36 SER HA 1 1 4 2415 1 1 36 SER HB2 H 11.190 8.705 3.216 1.00 . A A . 36 SER HB2 1 1 4 2416 1 1 36 SER HB3 H 12.871 8.726 2.684 1.00 . A A . 36 SER HB3 1 1 4 2417 1 1 36 SER HG H 11.436 10.656 2.280 1.00 . A A . 36 SER HG 1 1 4 2418 1 1 36 SER N N 11.139 6.392 2.276 1.00 . A A . 36 SER N 1 1 4 2419 1 1 36 SER O O 12.792 7.038 -0.546 1.00 . A A . 36 SER O 1 1 4 2420 1 1 36 SER OG O 11.604 9.948 1.653 1.00 . A A . 36 SER OG 1 1 4 2421 1 1 37 GLY C C 15.338 7.348 -0.630 1.00 . A A . 37 GLY C 1 1 4 2422 1 1 37 GLY CA C 15.202 6.697 0.732 1.00 . A A . 37 GLY CA 1 1 4 2423 1 1 37 GLY H H 13.921 7.151 2.356 1.00 . A A . 37 GLY H 1 1 4 2424 1 1 37 GLY HA2 H 16.019 7.023 1.359 1.00 . A A . 37 GLY HA2 1 1 4 2425 1 1 37 GLY HA3 H 15.259 5.625 0.613 1.00 . A A . 37 GLY HA3 1 1 4 2426 1 1 37 GLY N N 13.949 7.030 1.384 1.00 . A A . 37 GLY N 1 1 4 2427 1 1 37 GLY O O 15.080 6.717 -1.654 1.00 . A A . 37 GLY O 1 1 4 2428 1 1 38 GLU C C 17.358 9.288 -2.368 1.00 . A A . 38 GLU C 1 1 4 2429 1 1 38 GLU CA C 15.911 9.351 -1.889 1.00 . A A . 38 GLU CA 1 1 4 2430 1 1 38 GLU CB C 15.486 10.810 -1.706 1.00 . A A . 38 GLU CB 1 1 4 2431 1 1 38 GLU CD C 13.119 10.728 -0.827 1.00 . A A . 38 GLU CD 1 1 4 2432 1 1 38 GLU CG C 14.016 11.057 -2.004 1.00 . A A . 38 GLU CG 1 1 4 2433 1 1 38 GLU H H 15.934 9.063 0.209 1.00 . A A . 38 GLU H 1 1 4 2434 1 1 38 GLU HA H 15.277 8.892 -2.632 1.00 . A A . 38 GLU HA 1 1 4 2435 1 1 38 GLU HB2 H 15.680 11.104 -0.685 1.00 . A A . 38 GLU HB2 1 1 4 2436 1 1 38 GLU HB3 H 16.074 11.428 -2.367 1.00 . A A . 38 GLU HB3 1 1 4 2437 1 1 38 GLU HG2 H 13.884 12.098 -2.257 1.00 . A A . 38 GLU HG2 1 1 4 2438 1 1 38 GLU HG3 H 13.724 10.444 -2.843 1.00 . A A . 38 GLU HG3 1 1 4 2439 1 1 38 GLU N N 15.744 8.614 -0.641 1.00 . A A . 38 GLU N 1 1 4 2440 1 1 38 GLU O O 17.889 10.259 -2.907 1.00 . A A . 38 GLU O 1 1 4 2441 1 1 38 GLU OE1 O 13.552 10.939 0.326 1.00 . A A . 38 GLU OE1 1 1 4 2442 1 1 38 GLU OE2 O 11.985 10.259 -1.057 1.00 . A A . 38 GLU OE2 1 1 4 2443 1 1 39 LYS C C 19.731 6.461 -2.622 1.00 . A A . 39 LYS C 1 1 4 2444 1 1 39 LYS CA C 19.377 7.944 -2.579 1.00 . A A . 39 LYS CA 1 1 4 2445 1 1 39 LYS CB C 20.321 8.677 -1.624 1.00 . A A . 39 LYS CB 1 1 4 2446 1 1 39 LYS CD C 21.832 10.662 -1.323 1.00 . A A . 39 LYS CD 1 1 4 2447 1 1 39 LYS CE C 21.489 11.185 0.063 1.00 . A A . 39 LYS CE 1 1 4 2448 1 1 39 LYS CG C 20.604 10.113 -2.030 1.00 . A A . 39 LYS CG 1 1 4 2449 1 1 39 LYS H H 17.515 7.399 -1.733 1.00 . A A . 39 LYS H 1 1 4 2450 1 1 39 LYS HA H 19.489 8.358 -3.570 1.00 . A A . 39 LYS HA 1 1 4 2451 1 1 39 LYS HB2 H 19.882 8.684 -0.637 1.00 . A A . 39 LYS HB2 1 1 4 2452 1 1 39 LYS HB3 H 21.261 8.145 -1.586 1.00 . A A . 39 LYS HB3 1 1 4 2453 1 1 39 LYS HD2 H 22.564 9.873 -1.227 1.00 . A A . 39 LYS HD2 1 1 4 2454 1 1 39 LYS HD3 H 22.245 11.469 -1.911 1.00 . A A . 39 LYS HD3 1 1 4 2455 1 1 39 LYS HE2 H 20.930 10.428 0.592 1.00 . A A . 39 LYS HE2 1 1 4 2456 1 1 39 LYS HE3 H 22.408 11.389 0.594 1.00 . A A . 39 LYS HE3 1 1 4 2457 1 1 39 LYS HG2 H 20.770 10.150 -3.097 1.00 . A A . 39 LYS HG2 1 1 4 2458 1 1 39 LYS HG3 H 19.750 10.725 -1.776 1.00 . A A . 39 LYS HG3 1 1 4 2459 1 1 39 LYS HZ1 H 21.058 13.070 -0.728 1.00 . A A . 39 LYS HZ1 1 1 4 2460 1 1 39 LYS HZ2 H 20.701 12.920 0.919 1.00 . A A . 39 LYS HZ2 1 1 4 2461 1 1 39 LYS HZ3 H 19.691 12.205 -0.233 1.00 . A A . 39 LYS HZ3 1 1 4 2462 1 1 39 LYS N N 17.992 8.137 -2.168 1.00 . A A . 39 LYS N 1 1 4 2463 1 1 39 LYS NZ N 20.678 12.432 0.001 1.00 . A A . 39 LYS NZ 1 1 4 2464 1 1 39 LYS O O 19.270 5.665 -1.804 1.00 . A A . 39 LYS O 1 1 4 2465 1 1 40 PRO C C 21.938 4.234 -2.651 1.00 . A A . 40 PRO C 1 1 4 2466 1 1 40 PRO CA C 21.005 4.690 -3.767 1.00 . A A . 40 PRO CA 1 1 4 2467 1 1 40 PRO CB C 21.744 4.713 -5.107 1.00 . A A . 40 PRO CB 1 1 4 2468 1 1 40 PRO CD C 21.157 6.975 -4.607 1.00 . A A . 40 PRO CD 1 1 4 2469 1 1 40 PRO CG C 22.207 6.120 -5.261 1.00 . A A . 40 PRO CG 1 1 4 2470 1 1 40 PRO HA H 20.163 4.016 -3.830 1.00 . A A . 40 PRO HA 1 1 4 2471 1 1 40 PRO HB2 H 22.576 4.024 -5.074 1.00 . A A . 40 PRO HB2 1 1 4 2472 1 1 40 PRO HB3 H 21.068 4.431 -5.901 1.00 . A A . 40 PRO HB3 1 1 4 2473 1 1 40 PRO HD2 H 21.610 7.838 -4.141 1.00 . A A . 40 PRO HD2 1 1 4 2474 1 1 40 PRO HD3 H 20.415 7.281 -5.329 1.00 . A A . 40 PRO HD3 1 1 4 2475 1 1 40 PRO HG2 H 23.158 6.250 -4.768 1.00 . A A . 40 PRO HG2 1 1 4 2476 1 1 40 PRO HG3 H 22.290 6.366 -6.310 1.00 . A A . 40 PRO HG3 1 1 4 2477 1 1 40 PRO N N 20.569 6.080 -3.597 1.00 . A A . 40 PRO N 1 1 4 2478 1 1 40 PRO O O 23.127 4.553 -2.654 1.00 . A A . 40 PRO O 1 1 4 2479 1 1 41 SER C C 22.054 1.472 -0.456 1.00 . A A . 41 SER C 1 1 4 2480 1 1 41 SER CA C 22.176 2.988 -0.574 1.00 . A A . 41 SER CA 1 1 4 2481 1 1 41 SER CB C 21.718 3.650 0.727 1.00 . A A . 41 SER CB 1 1 4 2482 1 1 41 SER H H 20.438 3.265 -1.752 1.00 . A A . 41 SER H 1 1 4 2483 1 1 41 SER HA H 23.210 3.242 -0.753 1.00 . A A . 41 SER HA 1 1 4 2484 1 1 41 SER HB2 H 20.733 3.291 0.984 1.00 . A A . 41 SER HB2 1 1 4 2485 1 1 41 SER HB3 H 22.411 3.400 1.518 1.00 . A A . 41 SER HB3 1 1 4 2486 1 1 41 SER HG H 21.233 5.288 -0.233 1.00 . A A . 41 SER HG 1 1 4 2487 1 1 41 SER N N 21.392 3.485 -1.698 1.00 . A A . 41 SER N 1 1 4 2488 1 1 41 SER O O 23.055 0.756 -0.450 1.00 . A A . 41 SER O 1 1 4 2489 1 1 41 SER OG O 21.669 5.060 0.591 1.00 . A A . 41 SER OG 1 1 4 2490 1 1 42 GLY C C 20.387 -1.106 -1.592 1.00 . A A . 42 GLY C 1 1 4 2491 1 1 42 GLY CA C 20.588 -0.439 -0.245 1.00 . A A . 42 GLY CA 1 1 4 2492 1 1 42 GLY H H 20.059 1.607 -0.372 1.00 . A A . 42 GLY H 1 1 4 2493 1 1 42 GLY HA2 H 21.437 -0.891 0.246 1.00 . A A . 42 GLY HA2 1 1 4 2494 1 1 42 GLY HA3 H 19.707 -0.601 0.358 1.00 . A A . 42 GLY HA3 1 1 4 2495 1 1 42 GLY N N 20.819 0.989 -0.362 1.00 . A A . 42 GLY N 1 1 4 2496 1 1 42 GLY O O 21.336 -1.561 -2.230 1.00 . A A . 42 GLY O 1 1 4 2497 1 1 43 PRO C C 19.259 -0.967 -4.514 1.00 . A A . 43 PRO C 1 1 4 2498 1 1 43 PRO CA C 18.774 -1.789 -3.324 1.00 . A A . 43 PRO CA 1 1 4 2499 1 1 43 PRO CB C 17.244 -1.830 -3.290 1.00 . A A . 43 PRO CB 1 1 4 2500 1 1 43 PRO CD C 17.945 -0.651 -1.332 1.00 . A A . 43 PRO CD 1 1 4 2501 1 1 43 PRO CG C 16.856 -0.727 -2.366 1.00 . A A . 43 PRO CG 1 1 4 2502 1 1 43 PRO HA H 19.161 -2.794 -3.401 1.00 . A A . 43 PRO HA 1 1 4 2503 1 1 43 PRO HB2 H 16.855 -1.667 -4.286 1.00 . A A . 43 PRO HB2 1 1 4 2504 1 1 43 PRO HB3 H 16.914 -2.789 -2.921 1.00 . A A . 43 PRO HB3 1 1 4 2505 1 1 43 PRO HD2 H 18.101 0.372 -1.024 1.00 . A A . 43 PRO HD2 1 1 4 2506 1 1 43 PRO HD3 H 17.702 -1.271 -0.482 1.00 . A A . 43 PRO HD3 1 1 4 2507 1 1 43 PRO HG2 H 16.790 0.202 -2.911 1.00 . A A . 43 PRO HG2 1 1 4 2508 1 1 43 PRO HG3 H 15.910 -0.957 -1.898 1.00 . A A . 43 PRO HG3 1 1 4 2509 1 1 43 PRO N N 19.125 -1.173 -2.041 1.00 . A A . 43 PRO N 1 1 4 2510 1 1 43 PRO O O 19.111 0.255 -4.538 1.00 . A A . 43 PRO O 1 1 4 2511 1 1 44 SER C C 19.304 -0.985 -7.806 1.00 . A A . 44 SER C 1 1 4 2512 1 1 44 SER CA C 20.346 -0.978 -6.692 1.00 . A A . 44 SER CA 1 1 4 2513 1 1 44 SER CB C 21.629 -1.657 -7.174 1.00 . A A . 44 SER CB 1 1 4 2514 1 1 44 SER H H 19.925 -2.619 -5.422 1.00 . A A . 44 SER H 1 1 4 2515 1 1 44 SER HA H 20.568 0.046 -6.429 1.00 . A A . 44 SER HA 1 1 4 2516 1 1 44 SER HB2 H 22.334 -1.710 -6.358 1.00 . A A . 44 SER HB2 1 1 4 2517 1 1 44 SER HB3 H 21.398 -2.656 -7.515 1.00 . A A . 44 SER HB3 1 1 4 2518 1 1 44 SER HG H 22.252 -0.002 -8.017 1.00 . A A . 44 SER HG 1 1 4 2519 1 1 44 SER N N 19.837 -1.646 -5.500 1.00 . A A . 44 SER N 1 1 4 2520 1 1 44 SER O O 18.868 0.069 -8.270 1.00 . A A . 44 SER O 1 1 4 2521 1 1 44 SER OG O 22.219 -0.935 -8.241 1.00 . A A . 44 SER OG 1 1 4 2522 1 1 45 SER C C 16.586 -1.710 -8.882 1.00 . A A . 45 SER C 1 1 4 2523 1 1 45 SER CA C 17.920 -2.327 -9.292 1.00 . A A . 45 SER CA 1 1 4 2524 1 1 45 SER CB C 17.727 -3.804 -9.638 1.00 . A A . 45 SER CB 1 1 4 2525 1 1 45 SER H H 19.293 -2.984 -7.820 1.00 . A A . 45 SER H 1 1 4 2526 1 1 45 SER HA H 18.291 -1.807 -10.163 1.00 . A A . 45 SER HA 1 1 4 2527 1 1 45 SER HB2 H 17.598 -4.370 -8.729 1.00 . A A . 45 SER HB2 1 1 4 2528 1 1 45 SER HB3 H 16.848 -3.914 -10.258 1.00 . A A . 45 SER HB3 1 1 4 2529 1 1 45 SER HG H 18.550 -4.929 -11.015 1.00 . A A . 45 SER HG 1 1 4 2530 1 1 45 SER N N 18.908 -2.181 -8.230 1.00 . A A . 45 SER N 1 1 4 2531 1 1 45 SER O O 15.944 -1.013 -9.666 1.00 . A A . 45 SER O 1 1 4 2532 1 1 45 SER OG O 18.847 -4.315 -10.339 1.00 . A A . 45 SER OG 1 1 4 2533 1 1 46 GLY C C 13.773 -1.665 -8.114 1.00 . A A . 46 GLY C 1 1 4 2534 1 1 46 GLY CA C 14.921 -1.437 -7.150 1.00 . A A . 46 GLY CA 1 1 4 2535 1 1 46 GLY H H 16.729 -2.535 -7.063 1.00 . A A . 46 GLY H 1 1 4 2536 1 1 46 GLY HA2 H 14.686 -1.910 -6.209 1.00 . A A . 46 GLY HA2 1 1 4 2537 1 1 46 GLY HA3 H 15.035 -0.375 -6.989 1.00 . A A . 46 GLY HA3 1 1 4 2538 1 1 46 GLY N N 16.176 -1.973 -7.645 1.00 . A A . 46 GLY N 1 1 4 2539 1 1 46 GLY O O 13.735 -2.709 -8.763 1.00 . A A . 46 GLY O 1 1 4 2540 2 2 1 ZN ZN ZN 6.171 -0.819 3.533 1.00 . B A . 181 ZN ZN 1 1 5 2541 1 1 1 GLY C C 7.730 -33.195 6.282 1.00 . A A . 1 GLY C 1 1 5 2542 1 1 1 GLY CA C 6.898 -34.446 6.480 1.00 . A A . 1 GLY CA 1 1 5 2543 1 1 1 GLY H1 H 5.469 -33.302 7.544 1.00 . A A . 1 GLY H1 1 1 5 2544 1 1 1 GLY HA2 H 7.517 -35.212 6.924 1.00 . A A . 1 GLY HA2 1 1 5 2545 1 1 1 GLY HA3 H 6.553 -34.791 5.517 1.00 . A A . 1 GLY HA3 1 1 5 2546 1 1 1 GLY N N 5.748 -34.218 7.336 1.00 . A A . 1 GLY N 1 1 5 2547 1 1 1 GLY O O 8.943 -33.209 6.491 1.00 . A A . 1 GLY O 1 1 5 2548 1 1 2 SER C C 6.839 -29.665 5.914 1.00 . A A . 2 SER C 1 1 5 2549 1 1 2 SER CA C 7.767 -30.846 5.644 1.00 . A A . 2 SER CA 1 1 5 2550 1 1 2 SER CB C 8.288 -30.782 4.207 1.00 . A A . 2 SER CB 1 1 5 2551 1 1 2 SER H H 6.110 -32.163 5.727 1.00 . A A . 2 SER H 1 1 5 2552 1 1 2 SER HA H 8.603 -30.795 6.324 1.00 . A A . 2 SER HA 1 1 5 2553 1 1 2 SER HB2 H 7.488 -31.027 3.525 1.00 . A A . 2 SER HB2 1 1 5 2554 1 1 2 SER HB3 H 8.644 -29.782 4.001 1.00 . A A . 2 SER HB3 1 1 5 2555 1 1 2 SER HG H 9.297 -32.399 4.661 1.00 . A A . 2 SER HG 1 1 5 2556 1 1 2 SER N N 7.078 -32.111 5.876 1.00 . A A . 2 SER N 1 1 5 2557 1 1 2 SER O O 5.617 -29.801 5.878 1.00 . A A . 2 SER O 1 1 5 2558 1 1 2 SER OG O 9.353 -31.696 4.010 1.00 . A A . 2 SER OG 1 1 5 2559 1 1 3 SER C C 6.370 -26.530 5.181 1.00 . A A . 3 SER C 1 1 5 2560 1 1 3 SER CA C 6.660 -27.301 6.465 1.00 . A A . 3 SER CA 1 1 5 2561 1 1 3 SER CB C 7.413 -26.406 7.451 1.00 . A A . 3 SER CB 1 1 5 2562 1 1 3 SER H H 8.411 -28.462 6.199 1.00 . A A . 3 SER H 1 1 5 2563 1 1 3 SER HA H 5.723 -27.603 6.909 1.00 . A A . 3 SER HA 1 1 5 2564 1 1 3 SER HB2 H 6.719 -25.723 7.917 1.00 . A A . 3 SER HB2 1 1 5 2565 1 1 3 SER HB3 H 7.877 -27.021 8.209 1.00 . A A . 3 SER HB3 1 1 5 2566 1 1 3 SER HG H 8.993 -25.247 7.446 1.00 . A A . 3 SER HG 1 1 5 2567 1 1 3 SER N N 7.432 -28.506 6.185 1.00 . A A . 3 SER N 1 1 5 2568 1 1 3 SER O O 7.013 -26.748 4.155 1.00 . A A . 3 SER O 1 1 5 2569 1 1 3 SER OG O 8.419 -25.656 6.793 1.00 . A A . 3 SER OG 1 1 5 2570 1 1 4 GLY C C 3.706 -24.132 4.250 1.00 . A A . 4 GLY C 1 1 5 2571 1 1 4 GLY CA C 5.037 -24.838 4.083 1.00 . A A . 4 GLY CA 1 1 5 2572 1 1 4 GLY H H 4.917 -25.497 6.092 1.00 . A A . 4 GLY H 1 1 5 2573 1 1 4 GLY HA2 H 5.805 -24.100 3.911 1.00 . A A . 4 GLY HA2 1 1 5 2574 1 1 4 GLY HA3 H 4.979 -25.490 3.224 1.00 . A A . 4 GLY HA3 1 1 5 2575 1 1 4 GLY N N 5.396 -25.628 5.246 1.00 . A A . 4 GLY N 1 1 5 2576 1 1 4 GLY O O 2.912 -24.487 5.122 1.00 . A A . 4 GLY O 1 1 5 2577 1 1 5 SER C C 1.926 -21.695 2.139 1.00 . A A . 5 SER C 1 1 5 2578 1 1 5 SER CA C 2.220 -22.366 3.477 1.00 . A A . 5 SER CA 1 1 5 2579 1 1 5 SER CB C 2.299 -21.311 4.582 1.00 . A A . 5 SER CB 1 1 5 2580 1 1 5 SER H H 4.134 -22.893 2.741 1.00 . A A . 5 SER H 1 1 5 2581 1 1 5 SER HA H 1.420 -23.054 3.705 1.00 . A A . 5 SER HA 1 1 5 2582 1 1 5 SER HB2 H 2.839 -21.716 5.425 1.00 . A A . 5 SER HB2 1 1 5 2583 1 1 5 SER HB3 H 2.818 -20.440 4.208 1.00 . A A . 5 SER HB3 1 1 5 2584 1 1 5 SER HG H 0.460 -20.727 4.246 1.00 . A A . 5 SER HG 1 1 5 2585 1 1 5 SER N N 3.461 -23.128 3.414 1.00 . A A . 5 SER N 1 1 5 2586 1 1 5 SER O O 2.822 -21.149 1.495 1.00 . A A . 5 SER O 1 1 5 2587 1 1 5 SER OG O 1.006 -20.923 5.011 1.00 . A A . 5 SER OG 1 1 5 2588 1 1 6 SER C C 0.731 -19.698 0.362 1.00 . A A . 6 SER C 1 1 5 2589 1 1 6 SER CA C 0.249 -21.142 0.462 1.00 . A A . 6 SER CA 1 1 5 2590 1 1 6 SER CB C -1.273 -21.195 0.323 1.00 . A A . 6 SER CB 1 1 5 2591 1 1 6 SER H H -0.006 -22.191 2.283 1.00 . A A . 6 SER H 1 1 5 2592 1 1 6 SER HA H 0.696 -21.714 -0.338 1.00 . A A . 6 SER HA 1 1 5 2593 1 1 6 SER HB2 H -1.551 -20.901 -0.678 1.00 . A A . 6 SER HB2 1 1 5 2594 1 1 6 SER HB3 H -1.614 -22.203 0.510 1.00 . A A . 6 SER HB3 1 1 5 2595 1 1 6 SER HG H -1.595 -19.424 1.096 1.00 . A A . 6 SER HG 1 1 5 2596 1 1 6 SER N N 0.663 -21.741 1.726 1.00 . A A . 6 SER N 1 1 5 2597 1 1 6 SER O O 1.241 -19.272 -0.673 1.00 . A A . 6 SER O 1 1 5 2598 1 1 6 SER OG O -1.900 -20.321 1.246 1.00 . A A . 6 SER OG 1 1 5 2599 1 1 7 GLY C C 0.061 -16.682 2.280 1.00 . A A . 7 GLY C 1 1 5 2600 1 1 7 GLY CA C 0.988 -17.561 1.463 1.00 . A A . 7 GLY CA 1 1 5 2601 1 1 7 GLY H H 0.153 -19.342 2.246 1.00 . A A . 7 GLY H 1 1 5 2602 1 1 7 GLY HA2 H 1.982 -17.503 1.881 1.00 . A A . 7 GLY HA2 1 1 5 2603 1 1 7 GLY HA3 H 1.012 -17.193 0.448 1.00 . A A . 7 GLY HA3 1 1 5 2604 1 1 7 GLY N N 0.566 -18.949 1.448 1.00 . A A . 7 GLY N 1 1 5 2605 1 1 7 GLY O O -1.062 -16.395 1.864 1.00 . A A . 7 GLY O 1 1 5 2606 1 1 8 THR C C -0.314 -13.971 3.807 1.00 . A A . 8 THR C 1 1 5 2607 1 1 8 THR CA C -0.264 -15.403 4.325 1.00 . A A . 8 THR CA 1 1 5 2608 1 1 8 THR CB C 0.295 -15.400 5.760 1.00 . A A . 8 THR CB 1 1 5 2609 1 1 8 THR CG2 C -0.566 -14.542 6.675 1.00 . A A . 8 THR CG2 1 1 5 2610 1 1 8 THR H H 1.434 -16.515 3.723 1.00 . A A . 8 THR H 1 1 5 2611 1 1 8 THR HA H -1.269 -15.801 4.353 1.00 . A A . 8 THR HA 1 1 5 2612 1 1 8 THR HB H 1.294 -14.988 5.740 1.00 . A A . 8 THR HB 1 1 5 2613 1 1 8 THR HG1 H 1.059 -17.217 5.828 1.00 . A A . 8 THR HG1 1 1 5 2614 1 1 8 THR HG21 H -1.558 -14.964 6.735 1.00 . A A . 8 THR HG21 1 1 5 2615 1 1 8 THR HG22 H -0.626 -13.539 6.277 1.00 . A A . 8 THR HG22 1 1 5 2616 1 1 8 THR HG23 H -0.127 -14.512 7.660 1.00 . A A . 8 THR HG23 1 1 5 2617 1 1 8 THR N N 0.531 -16.253 3.447 1.00 . A A . 8 THR N 1 1 5 2618 1 1 8 THR O O 0.460 -13.117 4.239 1.00 . A A . 8 THR O 1 1 5 2619 1 1 8 THR OG1 O 0.352 -16.738 6.268 1.00 . A A . 8 THR OG1 1 1 5 2620 1 1 9 GLY C C -2.509 -12.280 1.331 1.00 . A A . 9 GLY C 1 1 5 2621 1 1 9 GLY CA C -1.363 -12.381 2.318 1.00 . A A . 9 GLY CA 1 1 5 2622 1 1 9 GLY H H -1.820 -14.433 2.572 1.00 . A A . 9 GLY H 1 1 5 2623 1 1 9 GLY HA2 H -1.530 -11.679 3.121 1.00 . A A . 9 GLY HA2 1 1 5 2624 1 1 9 GLY HA3 H -0.444 -12.122 1.813 1.00 . A A . 9 GLY HA3 1 1 5 2625 1 1 9 GLY N N -1.230 -13.713 2.879 1.00 . A A . 9 GLY N 1 1 5 2626 1 1 9 GLY O O -2.293 -12.261 0.120 1.00 . A A . 9 GLY O 1 1 5 2627 1 1 10 GLU C C -5.449 -10.689 0.977 1.00 . A A . 10 GLU C 1 1 5 2628 1 1 10 GLU CA C -4.915 -12.119 1.004 1.00 . A A . 10 GLU CA 1 1 5 2629 1 1 10 GLU CB C -6.004 -13.072 1.501 1.00 . A A . 10 GLU CB 1 1 5 2630 1 1 10 GLU CD C -6.843 -14.217 -0.588 1.00 . A A . 10 GLU CD 1 1 5 2631 1 1 10 GLU CG C -7.158 -13.239 0.527 1.00 . A A . 10 GLU CG 1 1 5 2632 1 1 10 GLU H H -3.839 -12.235 2.823 1.00 . A A . 10 GLU H 1 1 5 2633 1 1 10 GLU HA H -4.631 -12.403 0.002 1.00 . A A . 10 GLU HA 1 1 5 2634 1 1 10 GLU HB2 H -5.564 -14.042 1.677 1.00 . A A . 10 GLU HB2 1 1 5 2635 1 1 10 GLU HB3 H -6.399 -12.692 2.432 1.00 . A A . 10 GLU HB3 1 1 5 2636 1 1 10 GLU HG2 H -8.020 -13.600 1.068 1.00 . A A . 10 GLU HG2 1 1 5 2637 1 1 10 GLU HG3 H -7.385 -12.278 0.090 1.00 . A A . 10 GLU HG3 1 1 5 2638 1 1 10 GLU N N -3.731 -12.216 1.850 1.00 . A A . 10 GLU N 1 1 5 2639 1 1 10 GLU O O -6.085 -10.270 0.010 1.00 . A A . 10 GLU O 1 1 5 2640 1 1 10 GLU OE1 O -7.002 -15.437 -0.369 1.00 . A A . 10 GLU OE1 1 1 5 2641 1 1 10 GLU OE2 O -6.437 -13.764 -1.678 1.00 . A A . 10 GLU OE2 1 1 5 2642 1 1 11 LYS C C -5.600 -7.878 0.784 1.00 . A A . 11 LYS C 1 1 5 2643 1 1 11 LYS CA C -5.637 -8.563 2.146 1.00 . A A . 11 LYS CA 1 1 5 2644 1 1 11 LYS CB C -4.766 -7.791 3.140 1.00 . A A . 11 LYS CB 1 1 5 2645 1 1 11 LYS CD C -4.458 -9.166 5.220 1.00 . A A . 11 LYS CD 1 1 5 2646 1 1 11 LYS CE C -4.867 -9.356 6.673 1.00 . A A . 11 LYS CE 1 1 5 2647 1 1 11 LYS CG C -5.178 -7.986 4.589 1.00 . A A . 11 LYS CG 1 1 5 2648 1 1 11 LYS H H -4.673 -10.336 2.785 1.00 . A A . 11 LYS H 1 1 5 2649 1 1 11 LYS HA H -6.655 -8.571 2.504 1.00 . A A . 11 LYS HA 1 1 5 2650 1 1 11 LYS HB2 H -3.742 -8.118 3.032 1.00 . A A . 11 LYS HB2 1 1 5 2651 1 1 11 LYS HB3 H -4.825 -6.737 2.910 1.00 . A A . 11 LYS HB3 1 1 5 2652 1 1 11 LYS HD2 H -4.702 -10.062 4.669 1.00 . A A . 11 LYS HD2 1 1 5 2653 1 1 11 LYS HD3 H -3.393 -8.992 5.175 1.00 . A A . 11 LYS HD3 1 1 5 2654 1 1 11 LYS HE2 H -4.266 -10.142 7.103 1.00 . A A . 11 LYS HE2 1 1 5 2655 1 1 11 LYS HE3 H -4.690 -8.434 7.207 1.00 . A A . 11 LYS HE3 1 1 5 2656 1 1 11 LYS HG2 H -4.938 -7.092 5.146 1.00 . A A . 11 LYS HG2 1 1 5 2657 1 1 11 LYS HG3 H -6.244 -8.162 4.630 1.00 . A A . 11 LYS HG3 1 1 5 2658 1 1 11 LYS HZ1 H -6.567 -10.409 6.066 1.00 . A A . 11 LYS HZ1 1 1 5 2659 1 1 11 LYS HZ2 H -6.900 -8.873 6.695 1.00 . A A . 11 LYS HZ2 1 1 5 2660 1 1 11 LYS HZ3 H -6.486 -10.142 7.735 1.00 . A A . 11 LYS HZ3 1 1 5 2661 1 1 11 LYS N N -5.185 -9.945 2.046 1.00 . A A . 11 LYS N 1 1 5 2662 1 1 11 LYS NZ N -6.306 -9.721 6.801 1.00 . A A . 11 LYS NZ 1 1 5 2663 1 1 11 LYS O O -4.723 -8.133 -0.042 1.00 . A A . 11 LYS O 1 1 5 2664 1 1 12 PRO C C -5.556 -5.217 -0.876 1.00 . A A . 12 PRO C 1 1 5 2665 1 1 12 PRO CA C -6.671 -6.245 -0.718 1.00 . A A . 12 PRO CA 1 1 5 2666 1 1 12 PRO CB C -8.030 -5.547 -0.614 1.00 . A A . 12 PRO CB 1 1 5 2667 1 1 12 PRO CD C -7.650 -6.633 1.482 1.00 . A A . 12 PRO CD 1 1 5 2668 1 1 12 PRO CG C -8.280 -5.423 0.849 1.00 . A A . 12 PRO CG 1 1 5 2669 1 1 12 PRO HA H -6.670 -6.909 -1.570 1.00 . A A . 12 PRO HA 1 1 5 2670 1 1 12 PRO HB2 H -7.977 -4.578 -1.090 1.00 . A A . 12 PRO HB2 1 1 5 2671 1 1 12 PRO HB3 H -8.786 -6.150 -1.094 1.00 . A A . 12 PRO HB3 1 1 5 2672 1 1 12 PRO HD2 H -7.249 -6.385 2.453 1.00 . A A . 12 PRO HD2 1 1 5 2673 1 1 12 PRO HD3 H -8.369 -7.434 1.562 1.00 . A A . 12 PRO HD3 1 1 5 2674 1 1 12 PRO HG2 H -7.821 -4.521 1.225 1.00 . A A . 12 PRO HG2 1 1 5 2675 1 1 12 PRO HG3 H -9.343 -5.412 1.040 1.00 . A A . 12 PRO HG3 1 1 5 2676 1 1 12 PRO N N -6.572 -6.986 0.542 1.00 . A A . 12 PRO N 1 1 5 2677 1 1 12 PRO O O -5.304 -4.723 -1.975 1.00 . A A . 12 PRO O 1 1 5 2678 1 1 13 TYR C C -2.572 -4.478 0.930 1.00 . A A . 13 TYR C 1 1 5 2679 1 1 13 TYR CA C -3.802 -3.930 0.213 1.00 . A A . 13 TYR CA 1 1 5 2680 1 1 13 TYR CB C -4.247 -2.622 0.870 1.00 . A A . 13 TYR CB 1 1 5 2681 1 1 13 TYR CD1 C -5.724 -1.408 -0.780 1.00 . A A . 13 TYR CD1 1 1 5 2682 1 1 13 TYR CD2 C -6.750 -2.407 1.125 1.00 . A A . 13 TYR CD2 1 1 5 2683 1 1 13 TYR CE1 C -6.956 -0.961 -1.216 1.00 . A A . 13 TYR CE1 1 1 5 2684 1 1 13 TYR CE2 C -7.987 -1.965 0.695 1.00 . A A . 13 TYR CE2 1 1 5 2685 1 1 13 TYR CG C -5.598 -2.136 0.396 1.00 . A A . 13 TYR CG 1 1 5 2686 1 1 13 TYR CZ C -8.085 -1.243 -0.475 1.00 . A A . 13 TYR CZ 1 1 5 2687 1 1 13 TYR H H -5.137 -5.327 1.075 1.00 . A A . 13 TYR H 1 1 5 2688 1 1 13 TYR HA H -3.546 -3.734 -0.818 1.00 . A A . 13 TYR HA 1 1 5 2689 1 1 13 TYR HB2 H -4.303 -2.764 1.938 1.00 . A A . 13 TYR HB2 1 1 5 2690 1 1 13 TYR HB3 H -3.522 -1.852 0.651 1.00 . A A . 13 TYR HB3 1 1 5 2691 1 1 13 TYR HD1 H -4.837 -1.189 -1.359 1.00 . A A . 13 TYR HD1 1 1 5 2692 1 1 13 TYR HD2 H -6.671 -2.973 2.041 1.00 . A A . 13 TYR HD2 1 1 5 2693 1 1 13 TYR HE1 H -7.033 -0.396 -2.133 1.00 . A A . 13 TYR HE1 1 1 5 2694 1 1 13 TYR HE2 H -8.871 -2.185 1.275 1.00 . A A . 13 TYR HE2 1 1 5 2695 1 1 13 TYR HH H -9.898 -0.692 -0.153 1.00 . A A . 13 TYR HH 1 1 5 2696 1 1 13 TYR N N -4.890 -4.900 0.229 1.00 . A A . 13 TYR N 1 1 5 2697 1 1 13 TYR O O -2.667 -4.987 2.047 1.00 . A A . 13 TYR O 1 1 5 2698 1 1 13 TYR OH O -9.314 -0.801 -0.907 1.00 . A A . 13 TYR OH 1 1 5 2699 1 1 14 GLU C C 1.023 -4.085 0.294 1.00 . A A . 14 GLU C 1 1 5 2700 1 1 14 GLU CA C -0.169 -4.856 0.853 1.00 . A A . 14 GLU CA 1 1 5 2701 1 1 14 GLU CB C 0.000 -6.351 0.574 1.00 . A A . 14 GLU CB 1 1 5 2702 1 1 14 GLU CD C 1.121 -8.497 1.293 1.00 . A A . 14 GLU CD 1 1 5 2703 1 1 14 GLU CG C 1.164 -6.982 1.320 1.00 . A A . 14 GLU CG 1 1 5 2704 1 1 14 GLU H H -1.407 -3.955 -0.609 1.00 . A A . 14 GLU H 1 1 5 2705 1 1 14 GLU HA H -0.213 -4.702 1.921 1.00 . A A . 14 GLU HA 1 1 5 2706 1 1 14 GLU HB2 H -0.906 -6.863 0.861 1.00 . A A . 14 GLU HB2 1 1 5 2707 1 1 14 GLU HB3 H 0.161 -6.490 -0.485 1.00 . A A . 14 GLU HB3 1 1 5 2708 1 1 14 GLU HG2 H 2.086 -6.655 0.864 1.00 . A A . 14 GLU HG2 1 1 5 2709 1 1 14 GLU HG3 H 1.136 -6.654 2.348 1.00 . A A . 14 GLU HG3 1 1 5 2710 1 1 14 GLU N N -1.418 -4.370 0.279 1.00 . A A . 14 GLU N 1 1 5 2711 1 1 14 GLU O O 1.010 -3.648 -0.857 1.00 . A A . 14 GLU O 1 1 5 2712 1 1 14 GLU OE1 O 0.926 -9.067 0.199 1.00 . A A . 14 GLU OE1 1 1 5 2713 1 1 14 GLU OE2 O 1.282 -9.114 2.367 1.00 . A A . 14 GLU OE2 1 1 5 2714 1 1 15 CYS C C 4.076 -4.032 -0.274 1.00 . A A . 15 CYS C 1 1 5 2715 1 1 15 CYS CA C 3.254 -3.202 0.708 1.00 . A A . 15 CYS CA 1 1 5 2716 1 1 15 CYS CB C 4.103 -2.847 1.930 1.00 . A A . 15 CYS CB 1 1 5 2717 1 1 15 CYS H H 2.005 -4.292 2.024 1.00 . A A . 15 CYS H 1 1 5 2718 1 1 15 CYS HA H 2.944 -2.291 0.218 1.00 . A A . 15 CYS HA 1 1 5 2719 1 1 15 CYS HB2 H 3.450 -2.656 2.769 1.00 . A A . 15 CYS HB2 1 1 5 2720 1 1 15 CYS HB3 H 4.748 -3.681 2.164 1.00 . A A . 15 CYS HB3 1 1 5 2721 1 1 15 CYS N N 2.053 -3.921 1.117 1.00 . A A . 15 CYS N 1 1 5 2722 1 1 15 CYS O O 3.759 -5.192 -0.540 1.00 . A A . 15 CYS O 1 1 5 2723 1 1 15 CYS SG S 5.155 -1.378 1.702 1.00 . A A . 15 CYS SG 1 1 5 2724 1 1 16 ASP C C 7.391 -4.332 -1.166 1.00 . A A . 16 ASP C 1 1 5 2725 1 1 16 ASP CA C 6.003 -4.113 -1.759 1.00 . A A . 16 ASP CA 1 1 5 2726 1 1 16 ASP CB C 6.109 -3.308 -3.055 1.00 . A A . 16 ASP CB 1 1 5 2727 1 1 16 ASP CG C 7.001 -2.091 -2.908 1.00 . A A . 16 ASP CG 1 1 5 2728 1 1 16 ASP H H 5.334 -2.504 -0.556 1.00 . A A . 16 ASP H 1 1 5 2729 1 1 16 ASP HA H 5.563 -5.075 -1.979 1.00 . A A . 16 ASP HA 1 1 5 2730 1 1 16 ASP HB2 H 6.518 -3.939 -3.830 1.00 . A A . 16 ASP HB2 1 1 5 2731 1 1 16 ASP HB3 H 5.123 -2.977 -3.347 1.00 . A A . 16 ASP HB3 1 1 5 2732 1 1 16 ASP N N 5.133 -3.430 -0.808 1.00 . A A . 16 ASP N 1 1 5 2733 1 1 16 ASP O O 8.076 -5.298 -1.502 1.00 . A A . 16 ASP O 1 1 5 2734 1 1 16 ASP OD1 O 6.689 -1.226 -2.063 1.00 . A A . 16 ASP OD1 1 1 5 2735 1 1 16 ASP OD2 O 8.009 -2.002 -3.639 1.00 . A A . 16 ASP OD2 1 1 5 2736 1 1 17 VAL C C 9.066 -4.465 1.556 1.00 . A A . 17 VAL C 1 1 5 2737 1 1 17 VAL CA C 9.107 -3.522 0.359 1.00 . A A . 17 VAL CA 1 1 5 2738 1 1 17 VAL CB C 9.605 -2.140 0.824 1.00 . A A . 17 VAL CB 1 1 5 2739 1 1 17 VAL CG1 C 10.916 -2.273 1.583 1.00 . A A . 17 VAL CG1 1 1 5 2740 1 1 17 VAL CG2 C 9.759 -1.202 -0.364 1.00 . A A . 17 VAL CG2 1 1 5 2741 1 1 17 VAL H H 7.209 -2.680 -0.054 1.00 . A A . 17 VAL H 1 1 5 2742 1 1 17 VAL HA H 9.808 -3.908 -0.367 1.00 . A A . 17 VAL HA 1 1 5 2743 1 1 17 VAL HB H 8.868 -1.721 1.493 1.00 . A A . 17 VAL HB 1 1 5 2744 1 1 17 VAL HG11 H 10.815 -1.819 2.557 1.00 . A A . 17 VAL HG11 1 1 5 2745 1 1 17 VAL HG12 H 11.163 -3.318 1.695 1.00 . A A . 17 VAL HG12 1 1 5 2746 1 1 17 VAL HG13 H 11.701 -1.774 1.034 1.00 . A A . 17 VAL HG13 1 1 5 2747 1 1 17 VAL HG21 H 8.836 -0.665 -0.521 1.00 . A A . 17 VAL HG21 1 1 5 2748 1 1 17 VAL HG22 H 10.556 -0.501 -0.167 1.00 . A A . 17 VAL HG22 1 1 5 2749 1 1 17 VAL HG23 H 9.995 -1.776 -1.248 1.00 . A A . 17 VAL HG23 1 1 5 2750 1 1 17 VAL N N 7.800 -3.428 -0.282 1.00 . A A . 17 VAL N 1 1 5 2751 1 1 17 VAL O O 9.885 -5.376 1.671 1.00 . A A . 17 VAL O 1 1 5 2752 1 1 18 CYS C C 6.710 -5.944 3.536 1.00 . A A . 18 CYS C 1 1 5 2753 1 1 18 CYS CA C 7.956 -5.068 3.636 1.00 . A A . 18 CYS CA 1 1 5 2754 1 1 18 CYS CB C 7.876 -4.191 4.888 1.00 . A A . 18 CYS CB 1 1 5 2755 1 1 18 CYS H H 7.481 -3.497 2.300 1.00 . A A . 18 CYS H 1 1 5 2756 1 1 18 CYS HA H 8.824 -5.706 3.708 1.00 . A A . 18 CYS HA 1 1 5 2757 1 1 18 CYS HB2 H 7.817 -4.826 5.760 1.00 . A A . 18 CYS HB2 1 1 5 2758 1 1 18 CYS HB3 H 8.768 -3.585 4.950 1.00 . A A . 18 CYS HB3 1 1 5 2759 1 1 18 CYS N N 8.105 -4.240 2.446 1.00 . A A . 18 CYS N 1 1 5 2760 1 1 18 CYS O O 6.387 -6.690 4.461 1.00 . A A . 18 CYS O 1 1 5 2761 1 1 18 CYS SG S 6.440 -3.071 4.921 1.00 . A A . 18 CYS SG 1 1 5 2762 1 1 19 ARG C C 3.936 -6.654 3.440 1.00 . A A . 19 ARG C 1 1 5 2763 1 1 19 ARG CA C 4.805 -6.630 2.186 1.00 . A A . 19 ARG CA 1 1 5 2764 1 1 19 ARG CB C 5.164 -8.059 1.775 1.00 . A A . 19 ARG CB 1 1 5 2765 1 1 19 ARG CD C 6.723 -7.955 -0.193 1.00 . A A . 19 ARG CD 1 1 5 2766 1 1 19 ARG CG C 5.305 -8.243 0.272 1.00 . A A . 19 ARG CG 1 1 5 2767 1 1 19 ARG CZ C 8.756 -9.286 -0.567 1.00 . A A . 19 ARG CZ 1 1 5 2768 1 1 19 ARG H H 6.323 -5.236 1.707 1.00 . A A . 19 ARG H 1 1 5 2769 1 1 19 ARG HA H 4.249 -6.163 1.387 1.00 . A A . 19 ARG HA 1 1 5 2770 1 1 19 ARG HB2 H 6.101 -8.330 2.238 1.00 . A A . 19 ARG HB2 1 1 5 2771 1 1 19 ARG HB3 H 4.392 -8.727 2.126 1.00 . A A . 19 ARG HB3 1 1 5 2772 1 1 19 ARG HD2 H 6.711 -7.788 -1.260 1.00 . A A . 19 ARG HD2 1 1 5 2773 1 1 19 ARG HD3 H 7.078 -7.065 0.306 1.00 . A A . 19 ARG HD3 1 1 5 2774 1 1 19 ARG HE H 7.390 -9.661 0.837 1.00 . A A . 19 ARG HE 1 1 5 2775 1 1 19 ARG HG2 H 5.055 -9.263 0.019 1.00 . A A . 19 ARG HG2 1 1 5 2776 1 1 19 ARG HG3 H 4.626 -7.569 -0.228 1.00 . A A . 19 ARG HG3 1 1 5 2777 1 1 19 ARG HH11 H 8.528 -7.714 -1.815 1.00 . A A . 19 ARG HH11 1 1 5 2778 1 1 19 ARG HH12 H 9.957 -8.660 -2.068 1.00 . A A . 19 ARG HH12 1 1 5 2779 1 1 19 ARG HH21 H 9.268 -10.915 0.514 1.00 . A A . 19 ARG HH21 1 1 5 2780 1 1 19 ARG HH22 H 10.376 -10.481 -0.743 1.00 . A A . 19 ARG HH22 1 1 5 2781 1 1 19 ARG N N 6.015 -5.848 2.407 1.00 . A A . 19 ARG N 1 1 5 2782 1 1 19 ARG NE N 7.631 -9.059 0.103 1.00 . A A . 19 ARG NE 1 1 5 2783 1 1 19 ARG NH1 N 9.109 -8.488 -1.566 1.00 . A A . 19 ARG NH1 1 1 5 2784 1 1 19 ARG NH2 N 9.531 -10.312 -0.238 1.00 . A A . 19 ARG NH2 1 1 5 2785 1 1 19 ARG O O 3.412 -7.699 3.826 1.00 . A A . 19 ARG O 1 1 5 2786 1 1 20 LYS C C 1.501 -5.256 4.941 1.00 . A A . 20 LYS C 1 1 5 2787 1 1 20 LYS CA C 2.982 -5.380 5.283 1.00 . A A . 20 LYS CA 1 1 5 2788 1 1 20 LYS CB C 3.429 -4.170 6.106 1.00 . A A . 20 LYS CB 1 1 5 2789 1 1 20 LYS CD C 3.285 -2.897 8.266 1.00 . A A . 20 LYS CD 1 1 5 2790 1 1 20 LYS CE C 4.759 -3.029 8.620 1.00 . A A . 20 LYS CE 1 1 5 2791 1 1 20 LYS CG C 2.790 -4.100 7.482 1.00 . A A . 20 LYS CG 1 1 5 2792 1 1 20 LYS H H 4.230 -4.696 3.716 1.00 . A A . 20 LYS H 1 1 5 2793 1 1 20 LYS HA H 3.131 -6.276 5.866 1.00 . A A . 20 LYS HA 1 1 5 2794 1 1 20 LYS HB2 H 4.501 -4.212 6.231 1.00 . A A . 20 LYS HB2 1 1 5 2795 1 1 20 LYS HB3 H 3.173 -3.269 5.567 1.00 . A A . 20 LYS HB3 1 1 5 2796 1 1 20 LYS HD2 H 3.149 -2.007 7.669 1.00 . A A . 20 LYS HD2 1 1 5 2797 1 1 20 LYS HD3 H 2.711 -2.811 9.178 1.00 . A A . 20 LYS HD3 1 1 5 2798 1 1 20 LYS HE2 H 5.325 -3.144 7.708 1.00 . A A . 20 LYS HE2 1 1 5 2799 1 1 20 LYS HE3 H 5.075 -2.131 9.129 1.00 . A A . 20 LYS HE3 1 1 5 2800 1 1 20 LYS HG2 H 1.719 -4.026 7.368 1.00 . A A . 20 LYS HG2 1 1 5 2801 1 1 20 LYS HG3 H 3.035 -5.000 8.028 1.00 . A A . 20 LYS HG3 1 1 5 2802 1 1 20 LYS HZ1 H 4.713 -5.078 9.027 1.00 . A A . 20 LYS HZ1 1 1 5 2803 1 1 20 LYS HZ2 H 4.485 -4.102 10.390 1.00 . A A . 20 LYS HZ2 1 1 5 2804 1 1 20 LYS HZ3 H 6.028 -4.270 9.720 1.00 . A A . 20 LYS HZ3 1 1 5 2805 1 1 20 LYS N N 3.788 -5.495 4.073 1.00 . A A . 20 LYS N 1 1 5 2806 1 1 20 LYS NZ N 5.014 -4.202 9.501 1.00 . A A . 20 LYS NZ 1 1 5 2807 1 1 20 LYS O O 1.133 -4.618 3.955 1.00 . A A . 20 LYS O 1 1 5 2808 1 1 21 ALA C C -1.401 -4.596 6.210 1.00 . A A . 21 ALA C 1 1 5 2809 1 1 21 ALA CA C -0.786 -5.825 5.548 1.00 . A A . 21 ALA CA 1 1 5 2810 1 1 21 ALA CB C -1.438 -7.094 6.077 1.00 . A A . 21 ALA CB 1 1 5 2811 1 1 21 ALA H H 1.009 -6.363 6.531 1.00 . A A . 21 ALA H 1 1 5 2812 1 1 21 ALA HA H -0.964 -5.775 4.483 1.00 . A A . 21 ALA HA 1 1 5 2813 1 1 21 ALA HB1 H -1.151 -7.243 7.107 1.00 . A A . 21 ALA HB1 1 1 5 2814 1 1 21 ALA HB2 H -2.513 -6.999 6.013 1.00 . A A . 21 ALA HB2 1 1 5 2815 1 1 21 ALA HB3 H -1.115 -7.937 5.486 1.00 . A A . 21 ALA HB3 1 1 5 2816 1 1 21 ALA N N 0.655 -5.870 5.762 1.00 . A A . 21 ALA N 1 1 5 2817 1 1 21 ALA O O -1.004 -4.206 7.308 1.00 . A A . 21 ALA O 1 1 5 2818 1 1 22 PHE C C -4.556 -2.930 5.922 1.00 . A A . 22 PHE C 1 1 5 2819 1 1 22 PHE CA C -3.041 -2.804 6.057 1.00 . A A . 22 PHE CA 1 1 5 2820 1 1 22 PHE CB C -2.554 -1.553 5.322 1.00 . A A . 22 PHE CB 1 1 5 2821 1 1 22 PHE CD1 C -0.225 -2.046 4.529 1.00 . A A . 22 PHE CD1 1 1 5 2822 1 1 22 PHE CD2 C -0.509 -0.490 6.314 1.00 . A A . 22 PHE CD2 1 1 5 2823 1 1 22 PHE CE1 C 1.144 -1.870 4.588 1.00 . A A . 22 PHE CE1 1 1 5 2824 1 1 22 PHE CE2 C 0.860 -0.310 6.377 1.00 . A A . 22 PHE CE2 1 1 5 2825 1 1 22 PHE CG C -1.066 -1.359 5.389 1.00 . A A . 22 PHE CG 1 1 5 2826 1 1 22 PHE CZ C 1.688 -1.001 5.514 1.00 . A A . 22 PHE CZ 1 1 5 2827 1 1 22 PHE H H -2.645 -4.349 4.664 1.00 . A A . 22 PHE H 1 1 5 2828 1 1 22 PHE HA H -2.791 -2.717 7.103 1.00 . A A . 22 PHE HA 1 1 5 2829 1 1 22 PHE HB2 H -2.832 -1.624 4.282 1.00 . A A . 22 PHE HB2 1 1 5 2830 1 1 22 PHE HB3 H -3.024 -0.684 5.757 1.00 . A A . 22 PHE HB3 1 1 5 2831 1 1 22 PHE HD1 H -0.650 -2.727 3.804 1.00 . A A . 22 PHE HD1 1 1 5 2832 1 1 22 PHE HD2 H -1.154 0.050 6.990 1.00 . A A . 22 PHE HD2 1 1 5 2833 1 1 22 PHE HE1 H 1.788 -2.412 3.911 1.00 . A A . 22 PHE HE1 1 1 5 2834 1 1 22 PHE HE2 H 1.282 0.370 7.102 1.00 . A A . 22 PHE HE2 1 1 5 2835 1 1 22 PHE HZ H 2.757 -0.861 5.561 1.00 . A A . 22 PHE HZ 1 1 5 2836 1 1 22 PHE N N -2.372 -3.990 5.535 1.00 . A A . 22 PHE N 1 1 5 2837 1 1 22 PHE O O -5.308 -2.438 6.763 1.00 . A A . 22 PHE O 1 1 5 2838 1 1 23 SER C C -7.130 -2.435 4.477 1.00 . A A . 23 SER C 1 1 5 2839 1 1 23 SER CA C -6.420 -3.779 4.607 1.00 . A A . 23 SER CA 1 1 5 2840 1 1 23 SER CB C -7.053 -4.596 5.735 1.00 . A A . 23 SER CB 1 1 5 2841 1 1 23 SER H H -4.346 -3.961 4.221 1.00 . A A . 23 SER H 1 1 5 2842 1 1 23 SER HA H -6.526 -4.321 3.679 1.00 . A A . 23 SER HA 1 1 5 2843 1 1 23 SER HB2 H -6.561 -4.362 6.667 1.00 . A A . 23 SER HB2 1 1 5 2844 1 1 23 SER HB3 H -8.102 -4.349 5.810 1.00 . A A . 23 SER HB3 1 1 5 2845 1 1 23 SER HG H -7.768 -6.334 5.181 1.00 . A A . 23 SER HG 1 1 5 2846 1 1 23 SER N N -4.995 -3.592 4.856 1.00 . A A . 23 SER N 1 1 5 2847 1 1 23 SER O O -8.303 -2.303 4.827 1.00 . A A . 23 SER O 1 1 5 2848 1 1 23 SER OG O -6.928 -5.987 5.490 1.00 . A A . 23 SER OG 1 1 5 2849 1 1 24 HIS C C -6.088 0.738 2.876 1.00 . A A . 24 HIS C 1 1 5 2850 1 1 24 HIS CA C -6.971 -0.105 3.792 1.00 . A A . 24 HIS CA 1 1 5 2851 1 1 24 HIS CB C -7.130 0.589 5.146 1.00 . A A . 24 HIS CB 1 1 5 2852 1 1 24 HIS CD2 C -9.181 1.810 6.159 1.00 . A A . 24 HIS CD2 1 1 5 2853 1 1 24 HIS CE1 C -9.624 3.144 4.477 1.00 . A A . 24 HIS CE1 1 1 5 2854 1 1 24 HIS CG C -8.269 1.560 5.191 1.00 . A A . 24 HIS CG 1 1 5 2855 1 1 24 HIS H H -5.481 -1.607 3.709 1.00 . A A . 24 HIS H 1 1 5 2856 1 1 24 HIS HA H -7.943 -0.211 3.336 1.00 . A A . 24 HIS HA 1 1 5 2857 1 1 24 HIS HB2 H -7.300 -0.157 5.907 1.00 . A A . 24 HIS HB2 1 1 5 2858 1 1 24 HIS HB3 H -6.223 1.130 5.375 1.00 . A A . 24 HIS HB3 1 1 5 2859 1 1 24 HIS HD1 H -8.093 2.470 3.299 1.00 . A A . 24 HIS HD1 1 1 5 2860 1 1 24 HIS HD2 H -9.244 1.323 7.123 1.00 . A A . 24 HIS HD2 1 1 5 2861 1 1 24 HIS HE1 H -10.087 3.897 3.857 1.00 . A A . 24 HIS HE1 1 1 5 2862 1 1 24 HIS N N -6.410 -1.440 3.970 1.00 . A A . 24 HIS N 1 1 5 2863 1 1 24 HIS ND1 N -8.575 2.411 4.150 1.00 . A A . 24 HIS ND1 1 1 5 2864 1 1 24 HIS NE2 N -10.011 2.799 5.691 1.00 . A A . 24 HIS NE2 1 1 5 2865 1 1 24 HIS O O -4.980 1.125 3.249 1.00 . A A . 24 HIS O 1 1 5 2866 1 1 25 HIS C C -5.191 3.019 1.378 1.00 . A A . 25 HIS C 1 1 5 2867 1 1 25 HIS CA C -5.841 1.813 0.706 1.00 . A A . 25 HIS CA 1 1 5 2868 1 1 25 HIS CB C -6.766 2.279 -0.419 1.00 . A A . 25 HIS CB 1 1 5 2869 1 1 25 HIS CD2 C -7.788 4.662 -0.357 1.00 . A A . 25 HIS CD2 1 1 5 2870 1 1 25 HIS CE1 C -9.420 4.274 1.055 1.00 . A A . 25 HIS CE1 1 1 5 2871 1 1 25 HIS CG C -7.719 3.357 -0.004 1.00 . A A . 25 HIS CG 1 1 5 2872 1 1 25 HIS H H -7.474 0.680 1.437 1.00 . A A . 25 HIS H 1 1 5 2873 1 1 25 HIS HA H -5.067 1.188 0.289 1.00 . A A . 25 HIS HA 1 1 5 2874 1 1 25 HIS HB2 H -6.167 2.662 -1.233 1.00 . A A . 25 HIS HB2 1 1 5 2875 1 1 25 HIS HB3 H -7.347 1.439 -0.770 1.00 . A A . 25 HIS HB3 1 1 5 2876 1 1 25 HIS HD1 H -8.969 2.296 1.319 1.00 . A A . 25 HIS HD1 1 1 5 2877 1 1 25 HIS HD2 H -7.128 5.178 -1.041 1.00 . A A . 25 HIS HD2 1 1 5 2878 1 1 25 HIS HE1 H -10.280 4.410 1.693 1.00 . A A . 25 HIS HE1 1 1 5 2879 1 1 25 HIS N N -6.585 1.017 1.676 1.00 . A A . 25 HIS N 1 1 5 2880 1 1 25 HIS ND1 N -8.754 3.147 0.882 1.00 . A A . 25 HIS ND1 1 1 5 2881 1 1 25 HIS NE2 N -8.853 5.210 0.314 1.00 . A A . 25 HIS NE2 1 1 5 2882 1 1 25 HIS O O -4.022 3.318 1.139 1.00 . A A . 25 HIS O 1 1 5 2883 1 1 26 ALA C C -4.317 4.503 3.870 1.00 . A A . 26 ALA C 1 1 5 2884 1 1 26 ALA CA C -5.454 4.878 2.926 1.00 . A A . 26 ALA CA 1 1 5 2885 1 1 26 ALA CB C -6.580 5.554 3.694 1.00 . A A . 26 ALA CB 1 1 5 2886 1 1 26 ALA H H -6.881 3.418 2.368 1.00 . A A . 26 ALA H 1 1 5 2887 1 1 26 ALA HA H -5.083 5.577 2.191 1.00 . A A . 26 ALA HA 1 1 5 2888 1 1 26 ALA HB1 H -6.164 6.150 4.492 1.00 . A A . 26 ALA HB1 1 1 5 2889 1 1 26 ALA HB2 H -7.141 6.189 3.024 1.00 . A A . 26 ALA HB2 1 1 5 2890 1 1 26 ALA HB3 H -7.234 4.802 4.110 1.00 . A A . 26 ALA HB3 1 1 5 2891 1 1 26 ALA N N -5.957 3.706 2.219 1.00 . A A . 26 ALA N 1 1 5 2892 1 1 26 ALA O O -3.407 5.298 4.107 1.00 . A A . 26 ALA O 1 1 5 2893 1 1 27 SER C C -2.060 2.486 4.587 1.00 . A A . 27 SER C 1 1 5 2894 1 1 27 SER CA C -3.353 2.811 5.330 1.00 . A A . 27 SER CA 1 1 5 2895 1 1 27 SER CB C -3.849 1.572 6.078 1.00 . A A . 27 SER CB 1 1 5 2896 1 1 27 SER H H -5.127 2.701 4.180 1.00 . A A . 27 SER H 1 1 5 2897 1 1 27 SER HA H -3.156 3.597 6.044 1.00 . A A . 27 SER HA 1 1 5 2898 1 1 27 SER HB2 H -4.240 0.859 5.369 1.00 . A A . 27 SER HB2 1 1 5 2899 1 1 27 SER HB3 H -3.027 1.129 6.620 1.00 . A A . 27 SER HB3 1 1 5 2900 1 1 27 SER HG H -5.405 2.623 6.639 1.00 . A A . 27 SER HG 1 1 5 2901 1 1 27 SER N N -4.376 3.289 4.408 1.00 . A A . 27 SER N 1 1 5 2902 1 1 27 SER O O -0.965 2.617 5.136 1.00 . A A . 27 SER O 1 1 5 2903 1 1 27 SER OG O -4.874 1.909 6.998 1.00 . A A . 27 SER OG 1 1 5 2904 1 1 28 LEU C C -0.438 2.963 1.872 1.00 . A A . 28 LEU C 1 1 5 2905 1 1 28 LEU CA C -1.039 1.718 2.516 1.00 . A A . 28 LEU CA 1 1 5 2906 1 1 28 LEU CB C -1.438 0.713 1.433 1.00 . A A . 28 LEU CB 1 1 5 2907 1 1 28 LEU CD1 C 0.705 -0.582 1.313 1.00 . A A . 28 LEU CD1 1 1 5 2908 1 1 28 LEU CD2 C -0.873 -0.599 -0.627 1.00 . A A . 28 LEU CD2 1 1 5 2909 1 1 28 LEU CG C -0.311 0.226 0.521 1.00 . A A . 28 LEU CG 1 1 5 2910 1 1 28 LEU H H -3.093 1.978 2.953 1.00 . A A . 28 LEU H 1 1 5 2911 1 1 28 LEU HA H -0.299 1.266 3.159 1.00 . A A . 28 LEU HA 1 1 5 2912 1 1 28 LEU HB2 H -1.862 -0.150 1.924 1.00 . A A . 28 LEU HB2 1 1 5 2913 1 1 28 LEU HB3 H -2.190 1.178 0.812 1.00 . A A . 28 LEU HB3 1 1 5 2914 1 1 28 LEU HD11 H 0.500 -1.635 1.194 1.00 . A A . 28 LEU HD11 1 1 5 2915 1 1 28 LEU HD12 H 0.638 -0.319 2.359 1.00 . A A . 28 LEU HD12 1 1 5 2916 1 1 28 LEU HD13 H 1.699 -0.364 0.951 1.00 . A A . 28 LEU HD13 1 1 5 2917 1 1 28 LEU HD21 H -1.571 -1.327 -0.239 1.00 . A A . 28 LEU HD21 1 1 5 2918 1 1 28 LEU HD22 H -0.066 -1.108 -1.133 1.00 . A A . 28 LEU HD22 1 1 5 2919 1 1 28 LEU HD23 H -1.381 0.052 -1.324 1.00 . A A . 28 LEU HD23 1 1 5 2920 1 1 28 LEU HG H 0.198 1.082 0.101 1.00 . A A . 28 LEU HG 1 1 5 2921 1 1 28 LEU N N -2.195 2.062 3.336 1.00 . A A . 28 LEU N 1 1 5 2922 1 1 28 LEU O O 0.779 3.151 1.876 1.00 . A A . 28 LEU O 1 1 5 2923 1 1 29 THR C C 0.001 5.880 1.620 1.00 . A A . 29 THR C 1 1 5 2924 1 1 29 THR CA C -0.853 5.042 0.677 1.00 . A A . 29 THR CA 1 1 5 2925 1 1 29 THR CB C -2.047 5.888 0.194 1.00 . A A . 29 THR CB 1 1 5 2926 1 1 29 THR CG2 C -2.583 6.759 1.320 1.00 . A A . 29 THR CG2 1 1 5 2927 1 1 29 THR H H -2.257 3.608 1.352 1.00 . A A . 29 THR H 1 1 5 2928 1 1 29 THR HA H -0.260 4.769 -0.185 1.00 . A A . 29 THR HA 1 1 5 2929 1 1 29 THR HB H -2.833 5.221 -0.131 1.00 . A A . 29 THR HB 1 1 5 2930 1 1 29 THR HG1 H -1.261 7.526 -0.573 1.00 . A A . 29 THR HG1 1 1 5 2931 1 1 29 THR HG21 H -3.546 7.158 1.039 1.00 . A A . 29 THR HG21 1 1 5 2932 1 1 29 THR HG22 H -1.896 7.572 1.505 1.00 . A A . 29 THR HG22 1 1 5 2933 1 1 29 THR HG23 H -2.687 6.165 2.216 1.00 . A A . 29 THR HG23 1 1 5 2934 1 1 29 THR N N -1.299 3.814 1.322 1.00 . A A . 29 THR N 1 1 5 2935 1 1 29 THR O O 0.940 6.550 1.191 1.00 . A A . 29 THR O 1 1 5 2936 1 1 29 THR OG1 O -1.649 6.713 -0.906 1.00 . A A . 29 THR OG1 1 1 5 2937 1 1 30 GLN C C 1.713 5.892 4.272 1.00 . A A . 30 GLN C 1 1 5 2938 1 1 30 GLN CA C 0.408 6.595 3.911 1.00 . A A . 30 GLN CA 1 1 5 2939 1 1 30 GLN CB C -0.446 6.787 5.165 1.00 . A A . 30 GLN CB 1 1 5 2940 1 1 30 GLN CD C -2.133 8.219 6.384 1.00 . A A . 30 GLN CD 1 1 5 2941 1 1 30 GLN CG C -1.369 7.992 5.094 1.00 . A A . 30 GLN CG 1 1 5 2942 1 1 30 GLN H H -1.088 5.285 3.187 1.00 . A A . 30 GLN H 1 1 5 2943 1 1 30 GLN HA H 0.639 7.562 3.492 1.00 . A A . 30 GLN HA 1 1 5 2944 1 1 30 GLN HB2 H -1.051 5.905 5.313 1.00 . A A . 30 GLN HB2 1 1 5 2945 1 1 30 GLN HB3 H 0.208 6.911 6.016 1.00 . A A . 30 GLN HB3 1 1 5 2946 1 1 30 GLN HE21 H -2.849 9.938 5.686 1.00 . A A . 30 GLN HE21 1 1 5 2947 1 1 30 GLN HE22 H -3.356 9.504 7.280 1.00 . A A . 30 GLN HE22 1 1 5 2948 1 1 30 GLN HG2 H -0.777 8.871 4.886 1.00 . A A . 30 GLN HG2 1 1 5 2949 1 1 30 GLN HG3 H -2.078 7.839 4.294 1.00 . A A . 30 GLN HG3 1 1 5 2950 1 1 30 GLN N N -0.330 5.838 2.907 1.00 . A A . 30 GLN N 1 1 5 2951 1 1 30 GLN NE2 N -2.851 9.333 6.458 1.00 . A A . 30 GLN NE2 1 1 5 2952 1 1 30 GLN O O 2.790 6.484 4.199 1.00 . A A . 30 GLN O 1 1 5 2953 1 1 30 GLN OE1 O -2.079 7.401 7.303 1.00 . A A . 30 GLN OE1 1 1 5 2954 1 1 31 HIS C C 3.842 3.897 3.939 1.00 . A A . 31 HIS C 1 1 5 2955 1 1 31 HIS CA C 2.781 3.841 5.033 1.00 . A A . 31 HIS CA 1 1 5 2956 1 1 31 HIS CB C 2.385 2.389 5.302 1.00 . A A . 31 HIS CB 1 1 5 2957 1 1 31 HIS CD2 C 4.032 0.677 4.261 1.00 . A A . 31 HIS CD2 1 1 5 2958 1 1 31 HIS CE1 C 5.269 0.305 6.033 1.00 . A A . 31 HIS CE1 1 1 5 2959 1 1 31 HIS CG C 3.541 1.437 5.268 1.00 . A A . 31 HIS CG 1 1 5 2960 1 1 31 HIS H H 0.723 4.208 4.698 1.00 . A A . 31 HIS H 1 1 5 2961 1 1 31 HIS HA H 3.191 4.266 5.937 1.00 . A A . 31 HIS HA 1 1 5 2962 1 1 31 HIS HB2 H 1.930 2.322 6.279 1.00 . A A . 31 HIS HB2 1 1 5 2963 1 1 31 HIS HB3 H 1.672 2.073 4.554 1.00 . A A . 31 HIS HB3 1 1 5 2964 1 1 31 HIS HD1 H 4.235 1.582 7.252 1.00 . A A . 31 HIS HD1 1 1 5 2965 1 1 31 HIS HD2 H 3.651 0.625 3.251 1.00 . A A . 31 HIS HD2 1 1 5 2966 1 1 31 HIS HE1 H 6.034 -0.083 6.689 1.00 . A A . 31 HIS HE1 1 1 5 2967 1 1 31 HIS N N 1.609 4.625 4.661 1.00 . A A . 31 HIS N 1 1 5 2968 1 1 31 HIS ND1 N 4.337 1.180 6.364 1.00 . A A . 31 HIS ND1 1 1 5 2969 1 1 31 HIS NE2 N 5.106 -0.018 4.762 1.00 . A A . 31 HIS NE2 1 1 5 2970 1 1 31 HIS O O 5.005 4.201 4.205 1.00 . A A . 31 HIS O 1 1 5 2971 1 1 32 GLN C C 5.335 4.778 1.687 1.00 . A A . 32 GLN C 1 1 5 2972 1 1 32 GLN CA C 4.350 3.618 1.575 1.00 . A A . 32 GLN CA 1 1 5 2973 1 1 32 GLN CB C 3.571 3.721 0.263 1.00 . A A . 32 GLN CB 1 1 5 2974 1 1 32 GLN CD C 4.356 1.644 -0.942 1.00 . A A . 32 GLN CD 1 1 5 2975 1 1 32 GLN CG C 3.181 2.372 -0.320 1.00 . A A . 32 GLN CG 1 1 5 2976 1 1 32 GLN H H 2.494 3.368 2.561 1.00 . A A . 32 GLN H 1 1 5 2977 1 1 32 GLN HA H 4.903 2.691 1.583 1.00 . A A . 32 GLN HA 1 1 5 2978 1 1 32 GLN HB2 H 2.669 4.288 0.438 1.00 . A A . 32 GLN HB2 1 1 5 2979 1 1 32 GLN HB3 H 4.179 4.240 -0.463 1.00 . A A . 32 GLN HB3 1 1 5 2980 1 1 32 GLN HE21 H 3.247 1.148 -2.516 1.00 . A A . 32 GLN HE21 1 1 5 2981 1 1 32 GLN HE22 H 4.883 0.593 -2.545 1.00 . A A . 32 GLN HE22 1 1 5 2982 1 1 32 GLN HG2 H 2.773 1.758 0.469 1.00 . A A . 32 GLN HG2 1 1 5 2983 1 1 32 GLN HG3 H 2.429 2.527 -1.080 1.00 . A A . 32 GLN HG3 1 1 5 2984 1 1 32 GLN N N 3.434 3.602 2.709 1.00 . A A . 32 GLN N 1 1 5 2985 1 1 32 GLN NE2 N 4.141 1.069 -2.120 1.00 . A A . 32 GLN NE2 1 1 5 2986 1 1 32 GLN O O 6.448 4.712 1.166 1.00 . A A . 32 GLN O 1 1 5 2987 1 1 32 GLN OE1 O 5.446 1.597 -0.370 1.00 . A A . 32 GLN OE1 1 1 5 2988 1 1 33 ARG C C 7.112 6.626 3.145 1.00 . A A . 33 ARG C 1 1 5 2989 1 1 33 ARG CA C 5.762 7.013 2.550 1.00 . A A . 33 ARG CA 1 1 5 2990 1 1 33 ARG CB C 5.068 8.033 3.454 1.00 . A A . 33 ARG CB 1 1 5 2991 1 1 33 ARG CD C 4.016 9.821 2.034 1.00 . A A . 33 ARG CD 1 1 5 2992 1 1 33 ARG CG C 3.772 8.578 2.875 1.00 . A A . 33 ARG CG 1 1 5 2993 1 1 33 ARG CZ C 4.531 10.381 -0.303 1.00 . A A . 33 ARG CZ 1 1 5 2994 1 1 33 ARG H H 4.019 5.831 2.763 1.00 . A A . 33 ARG H 1 1 5 2995 1 1 33 ARG HA H 5.923 7.457 1.579 1.00 . A A . 33 ARG HA 1 1 5 2996 1 1 33 ARG HB2 H 4.844 7.565 4.401 1.00 . A A . 33 ARG HB2 1 1 5 2997 1 1 33 ARG HB3 H 5.738 8.863 3.621 1.00 . A A . 33 ARG HB3 1 1 5 2998 1 1 33 ARG HD2 H 3.101 10.393 1.987 1.00 . A A . 33 ARG HD2 1 1 5 2999 1 1 33 ARG HD3 H 4.786 10.413 2.506 1.00 . A A . 33 ARG HD3 1 1 5 3000 1 1 33 ARG HE H 4.662 8.555 0.486 1.00 . A A . 33 ARG HE 1 1 5 3001 1 1 33 ARG HG2 H 3.319 7.819 2.253 1.00 . A A . 33 ARG HG2 1 1 5 3002 1 1 33 ARG HG3 H 3.104 8.827 3.686 1.00 . A A . 33 ARG HG3 1 1 5 3003 1 1 33 ARG HH11 H 3.940 11.942 0.835 1.00 . A A . 33 ARG HH11 1 1 5 3004 1 1 33 ARG HH12 H 4.306 12.324 -0.815 1.00 . A A . 33 ARG HH12 1 1 5 3005 1 1 33 ARG HH21 H 5.147 9.044 -1.688 1.00 . A A . 33 ARG HH21 1 1 5 3006 1 1 33 ARG HH22 H 4.992 10.674 -2.249 1.00 . A A . 33 ARG HH22 1 1 5 3007 1 1 33 ARG N N 4.917 5.838 2.371 1.00 . A A . 33 ARG N 1 1 5 3008 1 1 33 ARG NE N 4.438 9.489 0.676 1.00 . A A . 33 ARG NE 1 1 5 3009 1 1 33 ARG NH1 N 4.234 11.654 -0.076 1.00 . A A . 33 ARG NH1 1 1 5 3010 1 1 33 ARG NH2 N 4.922 10.002 -1.513 1.00 . A A . 33 ARG NH2 1 1 5 3011 1 1 33 ARG O O 8.161 7.058 2.665 1.00 . A A . 33 ARG O 1 1 5 3012 1 1 34 VAL C C 9.286 4.777 3.849 1.00 . A A . 34 VAL C 1 1 5 3013 1 1 34 VAL CA C 8.300 5.363 4.854 1.00 . A A . 34 VAL CA 1 1 5 3014 1 1 34 VAL CB C 8.000 4.310 5.936 1.00 . A A . 34 VAL CB 1 1 5 3015 1 1 34 VAL CG1 C 7.139 4.907 7.039 1.00 . A A . 34 VAL CG1 1 1 5 3016 1 1 34 VAL CG2 C 7.325 3.092 5.322 1.00 . A A . 34 VAL CG2 1 1 5 3017 1 1 34 VAL H H 6.213 5.499 4.530 1.00 . A A . 34 VAL H 1 1 5 3018 1 1 34 VAL HA H 8.754 6.220 5.331 1.00 . A A . 34 VAL HA 1 1 5 3019 1 1 34 VAL HB H 8.936 3.994 6.373 1.00 . A A . 34 VAL HB 1 1 5 3020 1 1 34 VAL HG11 H 6.114 4.593 6.904 1.00 . A A . 34 VAL HG11 1 1 5 3021 1 1 34 VAL HG12 H 7.498 4.569 8.000 1.00 . A A . 34 VAL HG12 1 1 5 3022 1 1 34 VAL HG13 H 7.193 5.985 6.993 1.00 . A A . 34 VAL HG13 1 1 5 3023 1 1 34 VAL HG21 H 7.309 3.194 4.247 1.00 . A A . 34 VAL HG21 1 1 5 3024 1 1 34 VAL HG22 H 7.875 2.203 5.592 1.00 . A A . 34 VAL HG22 1 1 5 3025 1 1 34 VAL HG23 H 6.313 3.016 5.692 1.00 . A A . 34 VAL HG23 1 1 5 3026 1 1 34 VAL N N 7.079 5.809 4.193 1.00 . A A . 34 VAL N 1 1 5 3027 1 1 34 VAL O O 10.477 4.651 4.133 1.00 . A A . 34 VAL O 1 1 5 3028 1 1 35 HIS C C 9.836 4.850 0.495 1.00 . A A . 35 HIS C 1 1 5 3029 1 1 35 HIS CA C 9.617 3.847 1.624 1.00 . A A . 35 HIS CA 1 1 5 3030 1 1 35 HIS CB C 8.979 2.572 1.072 1.00 . A A . 35 HIS CB 1 1 5 3031 1 1 35 HIS CD2 C 7.557 0.834 2.370 1.00 . A A . 35 HIS CD2 1 1 5 3032 1 1 35 HIS CE1 C 9.052 0.248 3.862 1.00 . A A . 35 HIS CE1 1 1 5 3033 1 1 35 HIS CG C 8.680 1.549 2.123 1.00 . A A . 35 HIS CG 1 1 5 3034 1 1 35 HIS H H 7.824 4.545 2.505 1.00 . A A . 35 HIS H 1 1 5 3035 1 1 35 HIS HA H 10.574 3.601 2.060 1.00 . A A . 35 HIS HA 1 1 5 3036 1 1 35 HIS HB2 H 8.050 2.826 0.583 1.00 . A A . 35 HIS HB2 1 1 5 3037 1 1 35 HIS HB3 H 9.649 2.124 0.352 1.00 . A A . 35 HIS HB3 1 1 5 3038 1 1 35 HIS HD1 H 10.512 1.498 3.162 1.00 . A A . 35 HIS HD1 1 1 5 3039 1 1 35 HIS HD2 H 6.630 0.884 1.816 1.00 . A A . 35 HIS HD2 1 1 5 3040 1 1 35 HIS HE1 H 9.535 -0.239 4.696 1.00 . A A . 35 HIS HE1 1 1 5 3041 1 1 35 HIS N N 8.781 4.420 2.672 1.00 . A A . 35 HIS N 1 1 5 3042 1 1 35 HIS ND1 N 9.597 1.159 3.076 1.00 . A A . 35 HIS ND1 1 1 5 3043 1 1 35 HIS NE2 N 7.814 0.033 3.455 1.00 . A A . 35 HIS NE2 1 1 5 3044 1 1 35 HIS O O 9.166 4.795 -0.536 1.00 . A A . 35 HIS O 1 1 5 3045 1 1 36 SER C C 10.919 6.228 -1.711 1.00 . A A . 36 SER C 1 1 5 3046 1 1 36 SER CA C 11.081 6.785 -0.300 1.00 . A A . 36 SER CA 1 1 5 3047 1 1 36 SER CB C 12.506 7.309 -0.108 1.00 . A A . 36 SER CB 1 1 5 3048 1 1 36 SER H H 11.278 5.759 1.541 1.00 . A A . 36 SER H 1 1 5 3049 1 1 36 SER HA H 10.386 7.600 -0.165 1.00 . A A . 36 SER HA 1 1 5 3050 1 1 36 SER HB2 H 13.175 6.477 0.047 1.00 . A A . 36 SER HB2 1 1 5 3051 1 1 36 SER HB3 H 12.808 7.855 -0.990 1.00 . A A . 36 SER HB3 1 1 5 3052 1 1 36 SER HG H 11.885 7.956 1.634 1.00 . A A . 36 SER HG 1 1 5 3053 1 1 36 SER N N 10.778 5.767 0.698 1.00 . A A . 36 SER N 1 1 5 3054 1 1 36 SER O O 11.447 5.165 -2.036 1.00 . A A . 36 SER O 1 1 5 3055 1 1 36 SER OG O 12.584 8.173 1.013 1.00 . A A . 36 SER OG 1 1 5 3056 1 1 37 GLY C C 9.666 7.672 -4.850 1.00 . A A . 37 GLY C 1 1 5 3057 1 1 37 GLY CA C 9.963 6.518 -3.913 1.00 . A A . 37 GLY CA 1 1 5 3058 1 1 37 GLY H H 9.786 7.794 -2.233 1.00 . A A . 37 GLY H 1 1 5 3059 1 1 37 GLY HA2 H 10.846 6.004 -4.262 1.00 . A A . 37 GLY HA2 1 1 5 3060 1 1 37 GLY HA3 H 9.129 5.832 -3.930 1.00 . A A . 37 GLY HA3 1 1 5 3061 1 1 37 GLY N N 10.183 6.955 -2.547 1.00 . A A . 37 GLY N 1 1 5 3062 1 1 37 GLY O O 8.703 8.412 -4.647 1.00 . A A . 37 GLY O 1 1 5 3063 1 1 38 GLU C C 10.175 10.250 -6.145 1.00 . A A . 38 GLU C 1 1 5 3064 1 1 38 GLU CA C 10.315 8.902 -6.847 1.00 . A A . 38 GLU CA 1 1 5 3065 1 1 38 GLU CB C 9.084 8.636 -7.715 1.00 . A A . 38 GLU CB 1 1 5 3066 1 1 38 GLU CD C 7.709 9.511 -9.645 1.00 . A A . 38 GLU CD 1 1 5 3067 1 1 38 GLU CG C 9.090 9.397 -9.030 1.00 . A A . 38 GLU CG 1 1 5 3068 1 1 38 GLU H H 11.244 7.205 -5.986 1.00 . A A . 38 GLU H 1 1 5 3069 1 1 38 GLU HA H 11.190 8.928 -7.478 1.00 . A A . 38 GLU HA 1 1 5 3070 1 1 38 GLU HB2 H 9.034 7.580 -7.934 1.00 . A A . 38 GLU HB2 1 1 5 3071 1 1 38 GLU HB3 H 8.201 8.922 -7.163 1.00 . A A . 38 GLU HB3 1 1 5 3072 1 1 38 GLU HG2 H 9.472 10.392 -8.854 1.00 . A A . 38 GLU HG2 1 1 5 3073 1 1 38 GLU HG3 H 9.737 8.883 -9.726 1.00 . A A . 38 GLU HG3 1 1 5 3074 1 1 38 GLU N N 10.494 7.827 -5.878 1.00 . A A . 38 GLU N 1 1 5 3075 1 1 38 GLU O O 9.303 11.051 -6.482 1.00 . A A . 38 GLU O 1 1 5 3076 1 1 38 GLU OE1 O 6.717 9.469 -8.886 1.00 . A A . 38 GLU OE1 1 1 5 3077 1 1 38 GLU OE2 O 7.619 9.643 -10.883 1.00 . A A . 38 GLU OE2 1 1 5 3078 1 1 39 LYS C C 12.421 12.314 -4.262 1.00 . A A . 39 LYS C 1 1 5 3079 1 1 39 LYS CA C 11.015 11.743 -4.416 1.00 . A A . 39 LYS CA 1 1 5 3080 1 1 39 LYS CB C 10.389 11.522 -3.037 1.00 . A A . 39 LYS CB 1 1 5 3081 1 1 39 LYS CD C 10.587 10.267 -0.870 1.00 . A A . 39 LYS CD 1 1 5 3082 1 1 39 LYS CE C 10.254 11.295 0.200 1.00 . A A . 39 LYS CE 1 1 5 3083 1 1 39 LYS CG C 11.339 10.894 -2.032 1.00 . A A . 39 LYS CG 1 1 5 3084 1 1 39 LYS H H 11.713 9.816 -4.944 1.00 . A A . 39 LYS H 1 1 5 3085 1 1 39 LYS HA H 10.411 12.449 -4.967 1.00 . A A . 39 LYS HA 1 1 5 3086 1 1 39 LYS HB2 H 10.062 12.474 -2.646 1.00 . A A . 39 LYS HB2 1 1 5 3087 1 1 39 LYS HB3 H 9.532 10.873 -3.144 1.00 . A A . 39 LYS HB3 1 1 5 3088 1 1 39 LYS HD2 H 9.667 9.837 -1.239 1.00 . A A . 39 LYS HD2 1 1 5 3089 1 1 39 LYS HD3 H 11.199 9.490 -0.434 1.00 . A A . 39 LYS HD3 1 1 5 3090 1 1 39 LYS HE2 H 11.125 11.909 0.373 1.00 . A A . 39 LYS HE2 1 1 5 3091 1 1 39 LYS HE3 H 9.443 11.914 -0.154 1.00 . A A . 39 LYS HE3 1 1 5 3092 1 1 39 LYS HG2 H 11.919 10.129 -2.527 1.00 . A A . 39 LYS HG2 1 1 5 3093 1 1 39 LYS HG3 H 12.000 11.659 -1.649 1.00 . A A . 39 LYS HG3 1 1 5 3094 1 1 39 LYS HZ1 H 8.932 11.024 1.794 1.00 . A A . 39 LYS HZ1 1 1 5 3095 1 1 39 LYS HZ2 H 10.561 10.846 2.217 1.00 . A A . 39 LYS HZ2 1 1 5 3096 1 1 39 LYS HZ3 H 9.772 9.623 1.355 1.00 . A A . 39 LYS HZ3 1 1 5 3097 1 1 39 LYS N N 11.040 10.493 -5.166 1.00 . A A . 39 LYS N 1 1 5 3098 1 1 39 LYS NZ N 9.851 10.652 1.481 1.00 . A A . 39 LYS NZ 1 1 5 3099 1 1 39 LYS O O 13.413 11.585 -4.235 1.00 . A A . 39 LYS O 1 1 5 3100 1 1 40 PRO C C 14.425 14.096 -2.637 1.00 . A A . 40 PRO C 1 1 5 3101 1 1 40 PRO CA C 13.791 14.345 -4.001 1.00 . A A . 40 PRO CA 1 1 5 3102 1 1 40 PRO CB C 13.413 15.820 -4.154 1.00 . A A . 40 PRO CB 1 1 5 3103 1 1 40 PRO CD C 11.370 14.579 -4.180 1.00 . A A . 40 PRO CD 1 1 5 3104 1 1 40 PRO CG C 11.979 15.886 -3.756 1.00 . A A . 40 PRO CG 1 1 5 3105 1 1 40 PRO HA H 14.490 14.069 -4.777 1.00 . A A . 40 PRO HA 1 1 5 3106 1 1 40 PRO HB2 H 14.032 16.423 -3.504 1.00 . A A . 40 PRO HB2 1 1 5 3107 1 1 40 PRO HB3 H 13.552 16.127 -5.180 1.00 . A A . 40 PRO HB3 1 1 5 3108 1 1 40 PRO HD2 H 10.608 14.272 -3.480 1.00 . A A . 40 PRO HD2 1 1 5 3109 1 1 40 PRO HD3 H 10.960 14.659 -5.176 1.00 . A A . 40 PRO HD3 1 1 5 3110 1 1 40 PRO HG2 H 11.900 16.007 -2.686 1.00 . A A . 40 PRO HG2 1 1 5 3111 1 1 40 PRO HG3 H 11.495 16.707 -4.264 1.00 . A A . 40 PRO HG3 1 1 5 3112 1 1 40 PRO N N 12.511 13.648 -4.157 1.00 . A A . 40 PRO N 1 1 5 3113 1 1 40 PRO O O 13.744 13.709 -1.687 1.00 . A A . 40 PRO O 1 1 5 3114 1 1 41 SER C C 17.283 15.351 -0.943 1.00 . A A . 41 SER C 1 1 5 3115 1 1 41 SER CA C 16.458 14.118 -1.298 1.00 . A A . 41 SER CA 1 1 5 3116 1 1 41 SER CB C 17.370 12.894 -1.407 1.00 . A A . 41 SER CB 1 1 5 3117 1 1 41 SER H H 16.220 14.629 -3.339 1.00 . A A . 41 SER H 1 1 5 3118 1 1 41 SER HA H 15.733 13.947 -0.517 1.00 . A A . 41 SER HA 1 1 5 3119 1 1 41 SER HB2 H 16.770 12.018 -1.601 1.00 . A A . 41 SER HB2 1 1 5 3120 1 1 41 SER HB3 H 18.068 13.040 -2.219 1.00 . A A . 41 SER HB3 1 1 5 3121 1 1 41 SER HG H 17.631 12.066 0.349 1.00 . A A . 41 SER HG 1 1 5 3122 1 1 41 SER N N 15.732 14.321 -2.546 1.00 . A A . 41 SER N 1 1 5 3123 1 1 41 SER O O 16.928 16.111 -0.043 1.00 . A A . 41 SER O 1 1 5 3124 1 1 41 SER OG O 18.099 12.693 -0.209 1.00 . A A . 41 SER OG 1 1 5 3125 1 1 42 GLY C C 20.707 16.294 -1.279 1.00 . A A . 42 GLY C 1 1 5 3126 1 1 42 GLY CA C 19.247 16.684 -1.404 1.00 . A A . 42 GLY CA 1 1 5 3127 1 1 42 GLY H H 18.621 14.903 -2.363 1.00 . A A . 42 GLY H 1 1 5 3128 1 1 42 GLY HA2 H 19.142 17.388 -2.215 1.00 . A A . 42 GLY HA2 1 1 5 3129 1 1 42 GLY HA3 H 18.934 17.158 -0.485 1.00 . A A . 42 GLY HA3 1 1 5 3130 1 1 42 GLY N N 18.388 15.542 -1.658 1.00 . A A . 42 GLY N 1 1 5 3131 1 1 42 GLY O O 21.446 16.248 -2.263 1.00 . A A . 42 GLY O 1 1 5 3132 1 1 43 PRO C C 22.860 14.231 -0.310 1.00 . A A . 43 PRO C 1 1 5 3133 1 1 43 PRO CA C 22.528 15.615 0.236 1.00 . A A . 43 PRO CA 1 1 5 3134 1 1 43 PRO CB C 22.595 15.617 1.765 1.00 . A A . 43 PRO CB 1 1 5 3135 1 1 43 PRO CD C 20.318 16.040 1.176 1.00 . A A . 43 PRO CD 1 1 5 3136 1 1 43 PRO CG C 21.192 15.382 2.207 1.00 . A A . 43 PRO CG 1 1 5 3137 1 1 43 PRO HA H 23.231 16.334 -0.158 1.00 . A A . 43 PRO HA 1 1 5 3138 1 1 43 PRO HB2 H 23.254 14.828 2.100 1.00 . A A . 43 PRO HB2 1 1 5 3139 1 1 43 PRO HB3 H 22.963 16.571 2.112 1.00 . A A . 43 PRO HB3 1 1 5 3140 1 1 43 PRO HD2 H 19.406 15.478 1.040 1.00 . A A . 43 PRO HD2 1 1 5 3141 1 1 43 PRO HD3 H 20.097 17.058 1.462 1.00 . A A . 43 PRO HD3 1 1 5 3142 1 1 43 PRO HG2 H 20.992 14.322 2.246 1.00 . A A . 43 PRO HG2 1 1 5 3143 1 1 43 PRO HG3 H 21.032 15.832 3.175 1.00 . A A . 43 PRO HG3 1 1 5 3144 1 1 43 PRO N N 21.143 16.006 -0.043 1.00 . A A . 43 PRO N 1 1 5 3145 1 1 43 PRO O O 22.515 13.215 0.294 1.00 . A A . 43 PRO O 1 1 5 3146 1 1 44 SER C C 24.978 12.218 -1.265 1.00 . A A . 44 SER C 1 1 5 3147 1 1 44 SER CA C 23.910 12.937 -2.085 1.00 . A A . 44 SER CA 1 1 5 3148 1 1 44 SER CB C 24.422 13.184 -3.505 1.00 . A A . 44 SER CB 1 1 5 3149 1 1 44 SER H H 23.781 15.041 -1.889 1.00 . A A . 44 SER H 1 1 5 3150 1 1 44 SER HA H 23.029 12.314 -2.132 1.00 . A A . 44 SER HA 1 1 5 3151 1 1 44 SER HB2 H 24.828 12.267 -3.903 1.00 . A A . 44 SER HB2 1 1 5 3152 1 1 44 SER HB3 H 23.602 13.514 -4.127 1.00 . A A . 44 SER HB3 1 1 5 3153 1 1 44 SER HG H 25.373 14.685 -4.329 1.00 . A A . 44 SER HG 1 1 5 3154 1 1 44 SER N N 23.534 14.197 -1.456 1.00 . A A . 44 SER N 1 1 5 3155 1 1 44 SER O O 26.173 12.349 -1.531 1.00 . A A . 44 SER O 1 1 5 3156 1 1 44 SER OG O 25.434 14.176 -3.517 1.00 . A A . 44 SER OG 1 1 5 3157 1 1 45 SER C C 24.934 9.313 0.864 1.00 . A A . 45 SER C 1 1 5 3158 1 1 45 SER CA C 25.455 10.722 0.595 1.00 . A A . 45 SER CA 1 1 5 3159 1 1 45 SER CB C 25.654 11.465 1.917 1.00 . A A . 45 SER CB 1 1 5 3160 1 1 45 SER H H 23.573 11.395 -0.105 1.00 . A A . 45 SER H 1 1 5 3161 1 1 45 SER HA H 26.404 10.650 0.085 1.00 . A A . 45 SER HA 1 1 5 3162 1 1 45 SER HB2 H 25.595 12.529 1.741 1.00 . A A . 45 SER HB2 1 1 5 3163 1 1 45 SER HB3 H 24.882 11.171 2.612 1.00 . A A . 45 SER HB3 1 1 5 3164 1 1 45 SER HG H 27.087 11.759 3.220 1.00 . A A . 45 SER HG 1 1 5 3165 1 1 45 SER N N 24.538 11.459 -0.267 1.00 . A A . 45 SER N 1 1 5 3166 1 1 45 SER O O 23.726 9.090 0.940 1.00 . A A . 45 SER O 1 1 5 3167 1 1 45 SER OG O 26.918 11.166 2.484 1.00 . A A . 45 SER OG 1 1 5 3168 1 1 46 GLY C C 26.602 6.014 1.012 1.00 . A A . 46 GLY C 1 1 5 3169 1 1 46 GLY CA C 25.471 6.990 1.266 1.00 . A A . 46 GLY CA 1 1 5 3170 1 1 46 GLY H H 26.804 8.602 0.937 1.00 . A A . 46 GLY H 1 1 5 3171 1 1 46 GLY HA2 H 25.158 6.903 2.296 1.00 . A A . 46 GLY HA2 1 1 5 3172 1 1 46 GLY HA3 H 24.640 6.734 0.625 1.00 . A A . 46 GLY HA3 1 1 5 3173 1 1 46 GLY N N 25.855 8.365 1.007 1.00 . A A . 46 GLY N 1 1 5 3174 1 1 46 GLY O O 27.764 6.410 1.094 1.00 . A A . 46 GLY O 1 1 5 3175 2 2 1 ZN ZN ZN 6.413 -1.247 3.710 1.00 . B A . 181 ZN ZN 1 1 6 3176 1 1 1 GLY C C -6.438 -28.958 1.306 1.00 . A A . 1 GLY C 1 1 6 3177 1 1 1 GLY CA C -6.120 -29.033 -0.174 1.00 . A A . 1 GLY CA 1 1 6 3178 1 1 1 GLY H1 H -5.498 -27.071 -0.673 1.00 . A A . 1 GLY H1 1 1 6 3179 1 1 1 GLY HA2 H -6.819 -29.706 -0.648 1.00 . A A . 1 GLY HA2 1 1 6 3180 1 1 1 GLY HA3 H -5.120 -29.424 -0.296 1.00 . A A . 1 GLY HA3 1 1 6 3181 1 1 1 GLY N N -6.199 -27.739 -0.826 1.00 . A A . 1 GLY N 1 1 6 3182 1 1 1 GLY O O -5.652 -29.407 2.140 1.00 . A A . 1 GLY O 1 1 6 3183 1 1 2 SER C C -6.811 -27.975 3.926 1.00 . A A . 2 SER C 1 1 6 3184 1 1 2 SER CA C -8.010 -28.249 3.023 1.00 . A A . 2 SER CA 1 1 6 3185 1 1 2 SER CB C -8.735 -29.513 3.488 1.00 . A A . 2 SER CB 1 1 6 3186 1 1 2 SER H H -8.177 -28.048 0.922 1.00 . A A . 2 SER H 1 1 6 3187 1 1 2 SER HA H -8.690 -27.412 3.084 1.00 . A A . 2 SER HA 1 1 6 3188 1 1 2 SER HB2 H -9.314 -29.290 4.371 1.00 . A A . 2 SER HB2 1 1 6 3189 1 1 2 SER HB3 H -9.394 -29.856 2.703 1.00 . A A . 2 SER HB3 1 1 6 3190 1 1 2 SER HG H -7.942 -31.280 3.191 1.00 . A A . 2 SER HG 1 1 6 3191 1 1 2 SER N N -7.593 -28.387 1.633 1.00 . A A . 2 SER N 1 1 6 3192 1 1 2 SER O O -6.702 -28.534 5.018 1.00 . A A . 2 SER O 1 1 6 3193 1 1 2 SER OG O -7.814 -30.545 3.795 1.00 . A A . 2 SER OG 1 1 6 3194 1 1 3 SER C C -5.073 -26.461 5.677 1.00 . A A . 3 SER C 1 1 6 3195 1 1 3 SER CA C -4.720 -26.765 4.224 1.00 . A A . 3 SER CA 1 1 6 3196 1 1 3 SER CB C -4.019 -25.560 3.595 1.00 . A A . 3 SER CB 1 1 6 3197 1 1 3 SER H H -6.057 -26.699 2.584 1.00 . A A . 3 SER H 1 1 6 3198 1 1 3 SER HA H -4.053 -27.614 4.198 1.00 . A A . 3 SER HA 1 1 6 3199 1 1 3 SER HB2 H -4.690 -24.715 3.596 1.00 . A A . 3 SER HB2 1 1 6 3200 1 1 3 SER HB3 H -3.137 -25.320 4.171 1.00 . A A . 3 SER HB3 1 1 6 3201 1 1 3 SER HG H -4.409 -26.055 1.740 1.00 . A A . 3 SER HG 1 1 6 3202 1 1 3 SER N N -5.914 -27.111 3.462 1.00 . A A . 3 SER N 1 1 6 3203 1 1 3 SER O O -4.445 -26.976 6.601 1.00 . A A . 3 SER O 1 1 6 3204 1 1 3 SER OG O -3.632 -25.835 2.260 1.00 . A A . 3 SER OG 1 1 6 3205 1 1 4 GLY C C -5.697 -24.109 7.783 1.00 . A A . 4 GLY C 1 1 6 3206 1 1 4 GLY CA C -6.503 -25.259 7.212 1.00 . A A . 4 GLY CA 1 1 6 3207 1 1 4 GLY H H -6.547 -25.238 5.096 1.00 . A A . 4 GLY H 1 1 6 3208 1 1 4 GLY HA2 H -7.545 -24.977 7.189 1.00 . A A . 4 GLY HA2 1 1 6 3209 1 1 4 GLY HA3 H -6.387 -26.119 7.856 1.00 . A A . 4 GLY HA3 1 1 6 3210 1 1 4 GLY N N -6.083 -25.618 5.871 1.00 . A A . 4 GLY N 1 1 6 3211 1 1 4 GLY O O -4.819 -24.313 8.622 1.00 . A A . 4 GLY O 1 1 6 3212 1 1 5 SER C C -6.235 -20.764 8.526 1.00 . A A . 5 SER C 1 1 6 3213 1 1 5 SER CA C -5.287 -21.710 7.795 1.00 . A A . 5 SER CA 1 1 6 3214 1 1 5 SER CB C -4.632 -20.984 6.618 1.00 . A A . 5 SER CB 1 1 6 3215 1 1 5 SER H H -6.704 -22.798 6.659 1.00 . A A . 5 SER H 1 1 6 3216 1 1 5 SER HA H -4.518 -22.031 8.481 1.00 . A A . 5 SER HA 1 1 6 3217 1 1 5 SER HB2 H -3.971 -20.218 6.993 1.00 . A A . 5 SER HB2 1 1 6 3218 1 1 5 SER HB3 H -4.066 -21.693 6.031 1.00 . A A . 5 SER HB3 1 1 6 3219 1 1 5 SER HG H -5.311 -20.407 4.873 1.00 . A A . 5 SER HG 1 1 6 3220 1 1 5 SER N N -5.994 -22.896 7.328 1.00 . A A . 5 SER N 1 1 6 3221 1 1 5 SER O O -7.103 -20.142 7.913 1.00 . A A . 5 SER O 1 1 6 3222 1 1 5 SER OG O -5.607 -20.379 5.786 1.00 . A A . 5 SER OG 1 1 6 3223 1 1 6 SER C C -6.174 -18.504 11.009 1.00 . A A . 6 SER C 1 1 6 3224 1 1 6 SER CA C -6.905 -19.796 10.656 1.00 . A A . 6 SER CA 1 1 6 3225 1 1 6 SER CB C -7.330 -20.521 11.935 1.00 . A A . 6 SER CB 1 1 6 3226 1 1 6 SER H H -5.353 -21.184 10.270 1.00 . A A . 6 SER H 1 1 6 3227 1 1 6 SER HA H -7.786 -19.552 10.081 1.00 . A A . 6 SER HA 1 1 6 3228 1 1 6 SER HB2 H -6.452 -20.785 12.505 1.00 . A A . 6 SER HB2 1 1 6 3229 1 1 6 SER HB3 H -7.959 -19.868 12.523 1.00 . A A . 6 SER HB3 1 1 6 3230 1 1 6 SER HG H -7.841 -22.380 12.281 1.00 . A A . 6 SER HG 1 1 6 3231 1 1 6 SER N N -6.063 -20.662 9.840 1.00 . A A . 6 SER N 1 1 6 3232 1 1 6 SER O O -5.092 -18.530 11.594 1.00 . A A . 6 SER O 1 1 6 3233 1 1 6 SER OG O -8.052 -21.703 11.635 1.00 . A A . 6 SER OG 1 1 6 3234 1 1 7 GLY C C -5.876 -15.292 9.680 1.00 . A A . 7 GLY C 1 1 6 3235 1 1 7 GLY CA C -6.169 -16.087 10.936 1.00 . A A . 7 GLY CA 1 1 6 3236 1 1 7 GLY H H -7.638 -17.415 10.186 1.00 . A A . 7 GLY H 1 1 6 3237 1 1 7 GLY HA2 H -6.839 -15.517 11.563 1.00 . A A . 7 GLY HA2 1 1 6 3238 1 1 7 GLY HA3 H -5.244 -16.249 11.470 1.00 . A A . 7 GLY HA3 1 1 6 3239 1 1 7 GLY N N -6.776 -17.374 10.650 1.00 . A A . 7 GLY N 1 1 6 3240 1 1 7 GLY O O -6.194 -14.105 9.598 1.00 . A A . 7 GLY O 1 1 6 3241 1 1 8 THR C C -6.170 -15.044 6.595 1.00 . A A . 8 THR C 1 1 6 3242 1 1 8 THR CA C -4.925 -15.292 7.439 1.00 . A A . 8 THR CA 1 1 6 3243 1 1 8 THR CB C -3.923 -16.130 6.622 1.00 . A A . 8 THR CB 1 1 6 3244 1 1 8 THR CG2 C -2.554 -16.132 7.284 1.00 . A A . 8 THR CG2 1 1 6 3245 1 1 8 THR H H -5.036 -16.891 8.822 1.00 . A A . 8 THR H 1 1 6 3246 1 1 8 THR HA H -4.464 -14.343 7.671 1.00 . A A . 8 THR HA 1 1 6 3247 1 1 8 THR HB H -3.831 -15.694 5.638 1.00 . A A . 8 THR HB 1 1 6 3248 1 1 8 THR HG1 H -4.057 -18.005 7.218 1.00 . A A . 8 THR HG1 1 1 6 3249 1 1 8 THR HG21 H -2.586 -15.531 8.180 1.00 . A A . 8 THR HG21 1 1 6 3250 1 1 8 THR HG22 H -1.824 -15.722 6.602 1.00 . A A . 8 THR HG22 1 1 6 3251 1 1 8 THR HG23 H -2.279 -17.145 7.539 1.00 . A A . 8 THR HG23 1 1 6 3252 1 1 8 THR N N -5.264 -15.946 8.697 1.00 . A A . 8 THR N 1 1 6 3253 1 1 8 THR O O -6.724 -15.969 6.002 1.00 . A A . 8 THR O 1 1 6 3254 1 1 8 THR OG1 O -4.399 -17.475 6.495 1.00 . A A . 8 THR OG1 1 1 6 3255 1 1 9 GLY C C -7.432 -12.820 4.432 1.00 . A A . 9 GLY C 1 1 6 3256 1 1 9 GLY CA C -7.782 -13.442 5.769 1.00 . A A . 9 GLY CA 1 1 6 3257 1 1 9 GLY H H -6.123 -13.092 7.038 1.00 . A A . 9 GLY H 1 1 6 3258 1 1 9 GLY HA2 H -8.363 -14.335 5.598 1.00 . A A . 9 GLY HA2 1 1 6 3259 1 1 9 GLY HA3 H -8.377 -12.740 6.335 1.00 . A A . 9 GLY HA3 1 1 6 3260 1 1 9 GLY N N -6.605 -13.788 6.544 1.00 . A A . 9 GLY N 1 1 6 3261 1 1 9 GLY O O -6.275 -12.842 4.013 1.00 . A A . 9 GLY O 1 1 6 3262 1 1 10 GLU C C -7.338 -10.402 2.588 1.00 . A A . 10 GLU C 1 1 6 3263 1 1 10 GLU CA C -8.227 -11.636 2.460 1.00 . A A . 10 GLU CA 1 1 6 3264 1 1 10 GLU CB C -9.569 -11.248 1.835 1.00 . A A . 10 GLU CB 1 1 6 3265 1 1 10 GLU CD C -9.619 -12.809 -0.150 1.00 . A A . 10 GLU CD 1 1 6 3266 1 1 10 GLU CG C -10.280 -12.405 1.153 1.00 . A A . 10 GLU CG 1 1 6 3267 1 1 10 GLU H H -9.336 -12.278 4.145 1.00 . A A . 10 GLU H 1 1 6 3268 1 1 10 GLU HA H -7.737 -12.353 1.819 1.00 . A A . 10 GLU HA 1 1 6 3269 1 1 10 GLU HB2 H -10.215 -10.861 2.610 1.00 . A A . 10 GLU HB2 1 1 6 3270 1 1 10 GLU HB3 H -9.400 -10.474 1.101 1.00 . A A . 10 GLU HB3 1 1 6 3271 1 1 10 GLU HG2 H -10.278 -13.255 1.819 1.00 . A A . 10 GLU HG2 1 1 6 3272 1 1 10 GLU HG3 H -11.300 -12.113 0.948 1.00 . A A . 10 GLU HG3 1 1 6 3273 1 1 10 GLU N N -8.435 -12.264 3.759 1.00 . A A . 10 GLU N 1 1 6 3274 1 1 10 GLU O O -7.577 -9.535 3.428 1.00 . A A . 10 GLU O 1 1 6 3275 1 1 10 GLU OE1 O -8.543 -13.441 -0.098 1.00 . A A . 10 GLU OE1 1 1 6 3276 1 1 10 GLU OE2 O -10.177 -12.494 -1.222 1.00 . A A . 10 GLU OE2 1 1 6 3277 1 1 11 LYS C C -5.190 -8.639 0.363 1.00 . A A . 11 LYS C 1 1 6 3278 1 1 11 LYS CA C -5.384 -9.205 1.766 1.00 . A A . 11 LYS CA 1 1 6 3279 1 1 11 LYS CB C -4.035 -9.637 2.345 1.00 . A A . 11 LYS CB 1 1 6 3280 1 1 11 LYS CD C -3.053 -10.951 4.247 1.00 . A A . 11 LYS CD 1 1 6 3281 1 1 11 LYS CE C -3.002 -11.123 5.758 1.00 . A A . 11 LYS CE 1 1 6 3282 1 1 11 LYS CG C -4.071 -9.899 3.841 1.00 . A A . 11 LYS CG 1 1 6 3283 1 1 11 LYS H H -6.171 -11.054 1.101 1.00 . A A . 11 LYS H 1 1 6 3284 1 1 11 LYS HA H -5.808 -8.437 2.396 1.00 . A A . 11 LYS HA 1 1 6 3285 1 1 11 LYS HB2 H -3.717 -10.542 1.850 1.00 . A A . 11 LYS HB2 1 1 6 3286 1 1 11 LYS HB3 H -3.310 -8.858 2.155 1.00 . A A . 11 LYS HB3 1 1 6 3287 1 1 11 LYS HD2 H -3.324 -11.895 3.798 1.00 . A A . 11 LYS HD2 1 1 6 3288 1 1 11 LYS HD3 H -2.076 -10.649 3.895 1.00 . A A . 11 LYS HD3 1 1 6 3289 1 1 11 LYS HE2 H -3.220 -10.174 6.223 1.00 . A A . 11 LYS HE2 1 1 6 3290 1 1 11 LYS HE3 H -3.748 -11.847 6.050 1.00 . A A . 11 LYS HE3 1 1 6 3291 1 1 11 LYS HG2 H -3.851 -8.980 4.364 1.00 . A A . 11 LYS HG2 1 1 6 3292 1 1 11 LYS HG3 H -5.059 -10.243 4.113 1.00 . A A . 11 LYS HG3 1 1 6 3293 1 1 11 LYS HZ1 H -1.636 -12.631 6.232 1.00 . A A . 11 LYS HZ1 1 1 6 3294 1 1 11 LYS HZ2 H -1.473 -11.237 7.176 1.00 . A A . 11 LYS HZ2 1 1 6 3295 1 1 11 LYS HZ3 H -0.924 -11.244 5.577 1.00 . A A . 11 LYS HZ3 1 1 6 3296 1 1 11 LYS N N -6.310 -10.331 1.749 1.00 . A A . 11 LYS N 1 1 6 3297 1 1 11 LYS NZ N -1.665 -11.592 6.218 1.00 . A A . 11 LYS NZ 1 1 6 3298 1 1 11 LYS O O -4.195 -8.912 -0.309 1.00 . A A . 11 LYS O 1 1 6 3299 1 1 12 PRO C C -5.040 -6.134 -1.518 1.00 . A A . 12 PRO C 1 1 6 3300 1 1 12 PRO CA C -6.116 -7.209 -1.417 1.00 . A A . 12 PRO CA 1 1 6 3301 1 1 12 PRO CB C -7.508 -6.588 -1.563 1.00 . A A . 12 PRO CB 1 1 6 3302 1 1 12 PRO CD C -7.374 -7.464 0.657 1.00 . A A . 12 PRO CD 1 1 6 3303 1 1 12 PRO CG C -7.966 -6.353 -0.165 1.00 . A A . 12 PRO CG 1 1 6 3304 1 1 12 PRO HA H -5.964 -7.943 -2.195 1.00 . A A . 12 PRO HA 1 1 6 3305 1 1 12 PRO HB2 H -7.435 -5.663 -2.117 1.00 . A A . 12 PRO HB2 1 1 6 3306 1 1 12 PRO HB3 H -8.160 -7.274 -2.082 1.00 . A A . 12 PRO HB3 1 1 6 3307 1 1 12 PRO HD2 H -7.125 -7.110 1.647 1.00 . A A . 12 PRO HD2 1 1 6 3308 1 1 12 PRO HD3 H -8.058 -8.297 0.714 1.00 . A A . 12 PRO HD3 1 1 6 3309 1 1 12 PRO HG2 H -7.608 -5.396 0.183 1.00 . A A . 12 PRO HG2 1 1 6 3310 1 1 12 PRO HG3 H -9.045 -6.389 -0.122 1.00 . A A . 12 PRO HG3 1 1 6 3311 1 1 12 PRO N N -6.160 -7.832 -0.090 1.00 . A A . 12 PRO N 1 1 6 3312 1 1 12 PRO O O -4.637 -5.746 -2.614 1.00 . A A . 12 PRO O 1 1 6 3313 1 1 13 TYR C C -2.278 -5.149 0.339 1.00 . A A . 13 TYR C 1 1 6 3314 1 1 13 TYR CA C -3.547 -4.626 -0.327 1.00 . A A . 13 TYR CA 1 1 6 3315 1 1 13 TYR CB C -4.059 -3.395 0.422 1.00 . A A . 13 TYR CB 1 1 6 3316 1 1 13 TYR CD1 C -5.604 -2.142 -1.134 1.00 . A A . 13 TYR CD1 1 1 6 3317 1 1 13 TYR CD2 C -6.570 -3.335 0.689 1.00 . A A . 13 TYR CD2 1 1 6 3318 1 1 13 TYR CE1 C -6.860 -1.732 -1.538 1.00 . A A . 13 TYR CE1 1 1 6 3319 1 1 13 TYR CE2 C -7.830 -2.931 0.293 1.00 . A A . 13 TYR CE2 1 1 6 3320 1 1 13 TYR CG C -5.436 -2.949 -0.016 1.00 . A A . 13 TYR CG 1 1 6 3321 1 1 13 TYR CZ C -7.970 -2.129 -0.821 1.00 . A A . 13 TYR CZ 1 1 6 3322 1 1 13 TYR H H -4.936 -6.007 0.475 1.00 . A A . 13 TYR H 1 1 6 3323 1 1 13 TYR HA H -3.317 -4.346 -1.344 1.00 . A A . 13 TYR HA 1 1 6 3324 1 1 13 TYR HB2 H -4.103 -3.616 1.478 1.00 . A A . 13 TYR HB2 1 1 6 3325 1 1 13 TYR HB3 H -3.377 -2.573 0.260 1.00 . A A . 13 TYR HB3 1 1 6 3326 1 1 13 TYR HD1 H -4.732 -1.834 -1.694 1.00 . A A . 13 TYR HD1 1 1 6 3327 1 1 13 TYR HD2 H -6.457 -3.963 1.561 1.00 . A A . 13 TYR HD2 1 1 6 3328 1 1 13 TYR HE1 H -6.970 -1.105 -2.410 1.00 . A A . 13 TYR HE1 1 1 6 3329 1 1 13 TYR HE2 H -8.699 -3.241 0.853 1.00 . A A . 13 TYR HE2 1 1 6 3330 1 1 13 TYR HH H -9.711 -1.400 -0.460 1.00 . A A . 13 TYR HH 1 1 6 3331 1 1 13 TYR N N -4.576 -5.658 -0.367 1.00 . A A . 13 TYR N 1 1 6 3332 1 1 13 TYR O O -2.333 -6.017 1.209 1.00 . A A . 13 TYR O 1 1 6 3333 1 1 13 TYR OH O -9.223 -1.724 -1.220 1.00 . A A . 13 TYR OH 1 1 6 3334 1 1 14 GLU C C 1.278 -4.143 -0.049 1.00 . A A . 14 GLU C 1 1 6 3335 1 1 14 GLU CA C 0.149 -5.024 0.479 1.00 . A A . 14 GLU CA 1 1 6 3336 1 1 14 GLU CB C 0.430 -6.489 0.140 1.00 . A A . 14 GLU CB 1 1 6 3337 1 1 14 GLU CD C 1.631 -8.580 0.890 1.00 . A A . 14 GLU CD 1 1 6 3338 1 1 14 GLU CG C 1.630 -7.064 0.873 1.00 . A A . 14 GLU CG 1 1 6 3339 1 1 14 GLU H H -1.156 -3.923 -0.774 1.00 . A A . 14 GLU H 1 1 6 3340 1 1 14 GLU HA H 0.096 -4.916 1.551 1.00 . A A . 14 GLU HA 1 1 6 3341 1 1 14 GLU HB2 H -0.439 -7.078 0.395 1.00 . A A . 14 GLU HB2 1 1 6 3342 1 1 14 GLU HB3 H 0.610 -6.572 -0.922 1.00 . A A . 14 GLU HB3 1 1 6 3343 1 1 14 GLU HG2 H 2.531 -6.724 0.384 1.00 . A A . 14 GLU HG2 1 1 6 3344 1 1 14 GLU HG3 H 1.618 -6.707 1.892 1.00 . A A . 14 GLU HG3 1 1 6 3345 1 1 14 GLU N N -1.135 -4.612 -0.077 1.00 . A A . 14 GLU N 1 1 6 3346 1 1 14 GLU O O 1.278 -3.745 -1.214 1.00 . A A . 14 GLU O 1 1 6 3347 1 1 14 GLU OE1 O 1.041 -9.163 1.824 1.00 . A A . 14 GLU OE1 1 1 6 3348 1 1 14 GLU OE2 O 2.222 -9.184 -0.029 1.00 . A A . 14 GLU OE2 1 1 6 3349 1 1 15 CYS C C 4.346 -3.778 -0.445 1.00 . A A . 15 CYS C 1 1 6 3350 1 1 15 CYS CA C 3.373 -3.006 0.442 1.00 . A A . 15 CYS CA 1 1 6 3351 1 1 15 CYS CB C 4.097 -2.500 1.691 1.00 . A A . 15 CYS CB 1 1 6 3352 1 1 15 CYS H H 2.183 -4.187 1.734 1.00 . A A . 15 CYS H 1 1 6 3353 1 1 15 CYS HA H 2.995 -2.161 -0.111 1.00 . A A . 15 CYS HA 1 1 6 3354 1 1 15 CYS HB2 H 3.378 -2.377 2.489 1.00 . A A . 15 CYS HB2 1 1 6 3355 1 1 15 CYS HB3 H 4.836 -3.229 1.990 1.00 . A A . 15 CYS HB3 1 1 6 3356 1 1 15 CYS N N 2.238 -3.841 0.818 1.00 . A A . 15 CYS N 1 1 6 3357 1 1 15 CYS O O 4.143 -4.960 -0.725 1.00 . A A . 15 CYS O 1 1 6 3358 1 1 15 CYS SG S 4.948 -0.906 1.463 1.00 . A A . 15 CYS SG 1 1 6 3359 1 1 16 ASP C C 7.767 -3.754 -1.043 1.00 . A A . 16 ASP C 1 1 6 3360 1 1 16 ASP CA C 6.408 -3.725 -1.736 1.00 . A A . 16 ASP CA 1 1 6 3361 1 1 16 ASP CB C 6.515 -2.974 -3.065 1.00 . A A . 16 ASP CB 1 1 6 3362 1 1 16 ASP CG C 5.167 -2.780 -3.730 1.00 . A A . 16 ASP CG 1 1 6 3363 1 1 16 ASP H H 5.509 -2.163 -0.625 1.00 . A A . 16 ASP H 1 1 6 3364 1 1 16 ASP HA H 6.096 -4.739 -1.931 1.00 . A A . 16 ASP HA 1 1 6 3365 1 1 16 ASP HB2 H 6.951 -2.001 -2.887 1.00 . A A . 16 ASP HB2 1 1 6 3366 1 1 16 ASP HB3 H 7.151 -3.532 -3.736 1.00 . A A . 16 ASP HB3 1 1 6 3367 1 1 16 ASP N N 5.403 -3.103 -0.882 1.00 . A A . 16 ASP N 1 1 6 3368 1 1 16 ASP O O 8.472 -4.762 -1.079 1.00 . A A . 16 ASP O 1 1 6 3369 1 1 16 ASP OD1 O 4.490 -1.777 -3.421 1.00 . A A . 16 ASP OD1 1 1 6 3370 1 1 16 ASP OD2 O 4.789 -3.631 -4.562 1.00 . A A . 16 ASP OD2 1 1 6 3371 1 1 17 VAL C C 9.450 -3.485 1.481 1.00 . A A . 17 VAL C 1 1 6 3372 1 1 17 VAL CA C 9.402 -2.538 0.288 1.00 . A A . 17 VAL CA 1 1 6 3373 1 1 17 VAL CB C 9.660 -1.100 0.777 1.00 . A A . 17 VAL CB 1 1 6 3374 1 1 17 VAL CG1 C 10.975 -1.022 1.536 1.00 . A A . 17 VAL CG1 1 1 6 3375 1 1 17 VAL CG2 C 9.652 -0.130 -0.395 1.00 . A A . 17 VAL CG2 1 1 6 3376 1 1 17 VAL H H 7.523 -1.869 -0.421 1.00 . A A . 17 VAL H 1 1 6 3377 1 1 17 VAL HA H 10.187 -2.806 -0.405 1.00 . A A . 17 VAL HA 1 1 6 3378 1 1 17 VAL HB H 8.863 -0.823 1.452 1.00 . A A . 17 VAL HB 1 1 6 3379 1 1 17 VAL HG11 H 11.269 -2.013 1.850 1.00 . A A . 17 VAL HG11 1 1 6 3380 1 1 17 VAL HG12 H 11.738 -0.606 0.894 1.00 . A A . 17 VAL HG12 1 1 6 3381 1 1 17 VAL HG13 H 10.853 -0.391 2.405 1.00 . A A . 17 VAL HG13 1 1 6 3382 1 1 17 VAL HG21 H 9.137 -0.578 -1.231 1.00 . A A . 17 VAL HG21 1 1 6 3383 1 1 17 VAL HG22 H 9.146 0.779 -0.105 1.00 . A A . 17 VAL HG22 1 1 6 3384 1 1 17 VAL HG23 H 10.669 0.100 -0.679 1.00 . A A . 17 VAL HG23 1 1 6 3385 1 1 17 VAL N N 8.128 -2.640 -0.414 1.00 . A A . 17 VAL N 1 1 6 3386 1 1 17 VAL O O 10.413 -4.233 1.656 1.00 . A A . 17 VAL O 1 1 6 3387 1 1 18 CYS C C 7.341 -5.449 3.255 1.00 . A A . 18 CYS C 1 1 6 3388 1 1 18 CYS CA C 8.326 -4.305 3.478 1.00 . A A . 18 CYS CA 1 1 6 3389 1 1 18 CYS CB C 7.906 -3.487 4.701 1.00 . A A . 18 CYS CB 1 1 6 3390 1 1 18 CYS H H 7.667 -2.833 2.108 1.00 . A A . 18 CYS H 1 1 6 3391 1 1 18 CYS HA H 9.307 -4.720 3.653 1.00 . A A . 18 CYS HA 1 1 6 3392 1 1 18 CYS HB2 H 7.987 -4.106 5.583 1.00 . A A . 18 CYS HB2 1 1 6 3393 1 1 18 CYS HB3 H 8.566 -2.638 4.801 1.00 . A A . 18 CYS HB3 1 1 6 3394 1 1 18 CYS N N 8.405 -3.450 2.300 1.00 . A A . 18 CYS N 1 1 6 3395 1 1 18 CYS O O 7.424 -6.490 3.908 1.00 . A A . 18 CYS O 1 1 6 3396 1 1 18 CYS SG S 6.199 -2.857 4.623 1.00 . A A . 18 CYS SG 1 1 6 3397 1 1 19 ARG C C 4.489 -6.500 3.213 1.00 . A A . 19 ARG C 1 1 6 3398 1 1 19 ARG CA C 5.409 -6.262 2.019 1.00 . A A . 19 ARG CA 1 1 6 3399 1 1 19 ARG CB C 6.087 -7.573 1.615 1.00 . A A . 19 ARG CB 1 1 6 3400 1 1 19 ARG CD C 8.359 -6.785 0.886 1.00 . A A . 19 ARG CD 1 1 6 3401 1 1 19 ARG CG C 7.051 -7.425 0.449 1.00 . A A . 19 ARG CG 1 1 6 3402 1 1 19 ARG CZ C 10.738 -7.112 0.359 1.00 . A A . 19 ARG CZ 1 1 6 3403 1 1 19 ARG H H 6.395 -4.398 1.841 1.00 . A A . 19 ARG H 1 1 6 3404 1 1 19 ARG HA H 4.817 -5.903 1.191 1.00 . A A . 19 ARG HA 1 1 6 3405 1 1 19 ARG HB2 H 6.637 -7.956 2.462 1.00 . A A . 19 ARG HB2 1 1 6 3406 1 1 19 ARG HB3 H 5.326 -8.286 1.337 1.00 . A A . 19 ARG HB3 1 1 6 3407 1 1 19 ARG HD2 H 8.235 -5.713 0.893 1.00 . A A . 19 ARG HD2 1 1 6 3408 1 1 19 ARG HD3 H 8.596 -7.127 1.882 1.00 . A A . 19 ARG HD3 1 1 6 3409 1 1 19 ARG HE H 9.238 -7.385 -0.927 1.00 . A A . 19 ARG HE 1 1 6 3410 1 1 19 ARG HG2 H 7.260 -8.403 0.041 1.00 . A A . 19 ARG HG2 1 1 6 3411 1 1 19 ARG HG3 H 6.593 -6.807 -0.309 1.00 . A A . 19 ARG HG3 1 1 6 3412 1 1 19 ARG HH11 H 10.360 -6.525 2.255 1.00 . A A . 19 ARG HH11 1 1 6 3413 1 1 19 ARG HH12 H 12.033 -6.759 1.870 1.00 . A A . 19 ARG HH12 1 1 6 3414 1 1 19 ARG HH21 H 11.438 -7.697 -1.445 1.00 . A A . 19 ARG HH21 1 1 6 3415 1 1 19 ARG HH22 H 12.645 -7.425 -0.234 1.00 . A A . 19 ARG HH22 1 1 6 3416 1 1 19 ARG N N 6.410 -5.249 2.328 1.00 . A A . 19 ARG N 1 1 6 3417 1 1 19 ARG NE N 9.462 -7.129 -0.008 1.00 . A A . 19 ARG NE 1 1 6 3418 1 1 19 ARG NH1 N 11.071 -6.770 1.596 1.00 . A A . 19 ARG NH1 1 1 6 3419 1 1 19 ARG NH2 N 11.685 -7.438 -0.512 1.00 . A A . 19 ARG NH2 1 1 6 3420 1 1 19 ARG O O 4.261 -7.640 3.618 1.00 . A A . 19 ARG O 1 1 6 3421 1 1 20 LYS C C 1.611 -5.497 4.477 1.00 . A A . 20 LYS C 1 1 6 3422 1 1 20 LYS CA C 3.070 -5.505 4.922 1.00 . A A . 20 LYS CA 1 1 6 3423 1 1 20 LYS CB C 3.326 -4.344 5.886 1.00 . A A . 20 LYS CB 1 1 6 3424 1 1 20 LYS CD C 3.148 -3.448 8.226 1.00 . A A . 20 LYS CD 1 1 6 3425 1 1 20 LYS CE C 2.940 -3.844 9.680 1.00 . A A . 20 LYS CE 1 1 6 3426 1 1 20 LYS CG C 2.778 -4.581 7.283 1.00 . A A . 20 LYS CG 1 1 6 3427 1 1 20 LYS H H 4.185 -4.534 3.408 1.00 . A A . 20 LYS H 1 1 6 3428 1 1 20 LYS HA H 3.274 -6.435 5.431 1.00 . A A . 20 LYS HA 1 1 6 3429 1 1 20 LYS HB2 H 4.391 -4.183 5.962 1.00 . A A . 20 LYS HB2 1 1 6 3430 1 1 20 LYS HB3 H 2.863 -3.452 5.487 1.00 . A A . 20 LYS HB3 1 1 6 3431 1 1 20 LYS HD2 H 4.187 -3.194 8.080 1.00 . A A . 20 LYS HD2 1 1 6 3432 1 1 20 LYS HD3 H 2.530 -2.590 8.003 1.00 . A A . 20 LYS HD3 1 1 6 3433 1 1 20 LYS HE2 H 3.174 -2.997 10.307 1.00 . A A . 20 LYS HE2 1 1 6 3434 1 1 20 LYS HE3 H 1.905 -4.119 9.820 1.00 . A A . 20 LYS HE3 1 1 6 3435 1 1 20 LYS HG2 H 1.702 -4.655 7.231 1.00 . A A . 20 LYS HG2 1 1 6 3436 1 1 20 LYS HG3 H 3.186 -5.505 7.667 1.00 . A A . 20 LYS HG3 1 1 6 3437 1 1 20 LYS HZ1 H 3.724 -5.166 11.094 1.00 . A A . 20 LYS HZ1 1 1 6 3438 1 1 20 LYS HZ2 H 4.797 -4.784 9.844 1.00 . A A . 20 LYS HZ2 1 1 6 3439 1 1 20 LYS HZ3 H 3.514 -5.848 9.560 1.00 . A A . 20 LYS HZ3 1 1 6 3440 1 1 20 LYS N N 3.965 -5.416 3.775 1.00 . A A . 20 LYS N 1 1 6 3441 1 1 20 LYS NZ N 3.804 -4.991 10.072 1.00 . A A . 20 LYS NZ 1 1 6 3442 1 1 20 LYS O O 1.282 -4.988 3.406 1.00 . A A . 20 LYS O 1 1 6 3443 1 1 21 ALA C C -1.437 -4.986 5.685 1.00 . A A . 21 ALA C 1 1 6 3444 1 1 21 ALA CA C -0.683 -6.119 4.998 1.00 . A A . 21 ALA CA 1 1 6 3445 1 1 21 ALA CB C -1.260 -7.465 5.409 1.00 . A A . 21 ALA CB 1 1 6 3446 1 1 21 ALA H H 1.064 -6.453 6.145 1.00 . A A . 21 ALA H 1 1 6 3447 1 1 21 ALA HA H -0.797 -6.017 3.928 1.00 . A A . 21 ALA HA 1 1 6 3448 1 1 21 ALA HB1 H -1.761 -7.915 4.565 1.00 . A A . 21 ALA HB1 1 1 6 3449 1 1 21 ALA HB2 H -0.461 -8.112 5.741 1.00 . A A . 21 ALA HB2 1 1 6 3450 1 1 21 ALA HB3 H -1.966 -7.323 6.214 1.00 . A A . 21 ALA HB3 1 1 6 3451 1 1 21 ALA N N 0.741 -6.064 5.306 1.00 . A A . 21 ALA N 1 1 6 3452 1 1 21 ALA O O -1.050 -4.532 6.762 1.00 . A A . 21 ALA O 1 1 6 3453 1 1 22 PHE C C -4.802 -3.660 5.290 1.00 . A A . 22 PHE C 1 1 6 3454 1 1 22 PHE CA C -3.324 -3.450 5.606 1.00 . A A . 22 PHE CA 1 1 6 3455 1 1 22 PHE CB C -2.858 -2.103 5.049 1.00 . A A . 22 PHE CB 1 1 6 3456 1 1 22 PHE CD1 C -0.521 -2.448 4.203 1.00 . A A . 22 PHE CD1 1 1 6 3457 1 1 22 PHE CD2 C -0.830 -1.149 6.178 1.00 . A A . 22 PHE CD2 1 1 6 3458 1 1 22 PHE CE1 C 0.846 -2.259 4.288 1.00 . A A . 22 PHE CE1 1 1 6 3459 1 1 22 PHE CE2 C 0.536 -0.956 6.268 1.00 . A A . 22 PHE CE2 1 1 6 3460 1 1 22 PHE CG C -1.373 -1.896 5.145 1.00 . A A . 22 PHE CG 1 1 6 3461 1 1 22 PHE CZ C 1.375 -1.513 5.322 1.00 . A A . 22 PHE CZ 1 1 6 3462 1 1 22 PHE H H -2.774 -4.934 4.200 1.00 . A A . 22 PHE H 1 1 6 3463 1 1 22 PHE HA H -3.193 -3.451 6.677 1.00 . A A . 22 PHE HA 1 1 6 3464 1 1 22 PHE HB2 H -3.135 -2.037 4.008 1.00 . A A . 22 PHE HB2 1 1 6 3465 1 1 22 PHE HB3 H -3.341 -1.308 5.598 1.00 . A A . 22 PHE HB3 1 1 6 3466 1 1 22 PHE HD1 H -0.934 -3.033 3.392 1.00 . A A . 22 PHE HD1 1 1 6 3467 1 1 22 PHE HD2 H -1.484 -0.714 6.919 1.00 . A A . 22 PHE HD2 1 1 6 3468 1 1 22 PHE HE1 H 1.498 -2.696 3.546 1.00 . A A . 22 PHE HE1 1 1 6 3469 1 1 22 PHE HE2 H 0.947 -0.373 7.078 1.00 . A A . 22 PHE HE2 1 1 6 3470 1 1 22 PHE HZ H 2.442 -1.364 5.390 1.00 . A A . 22 PHE HZ 1 1 6 3471 1 1 22 PHE N N -2.516 -4.532 5.056 1.00 . A A . 22 PHE N 1 1 6 3472 1 1 22 PHE O O -5.151 -4.353 4.335 1.00 . A A . 22 PHE O 1 1 6 3473 1 1 23 SER C C -7.581 -2.291 4.764 1.00 . A A . 23 SER C 1 1 6 3474 1 1 23 SER CA C -7.106 -3.178 5.910 1.00 . A A . 23 SER CA 1 1 6 3475 1 1 23 SER CB C -7.845 -2.808 7.198 1.00 . A A . 23 SER CB 1 1 6 3476 1 1 23 SER H H -5.325 -2.515 6.844 1.00 . A A . 23 SER H 1 1 6 3477 1 1 23 SER HA H -7.321 -4.208 5.666 1.00 . A A . 23 SER HA 1 1 6 3478 1 1 23 SER HB2 H -7.637 -1.778 7.445 1.00 . A A . 23 SER HB2 1 1 6 3479 1 1 23 SER HB3 H -8.907 -2.935 7.049 1.00 . A A . 23 SER HB3 1 1 6 3480 1 1 23 SER HG H -6.536 -3.399 8.530 1.00 . A A . 23 SER HG 1 1 6 3481 1 1 23 SER N N -5.665 -3.055 6.100 1.00 . A A . 23 SER N 1 1 6 3482 1 1 23 SER O O -8.193 -2.767 3.807 1.00 . A A . 23 SER O 1 1 6 3483 1 1 23 SER OG O -7.433 -3.629 8.277 1.00 . A A . 23 SER OG 1 1 6 3484 1 1 24 HIS C C -6.484 0.423 3.034 1.00 . A A . 24 HIS C 1 1 6 3485 1 1 24 HIS CA C -7.693 -0.041 3.841 1.00 . A A . 24 HIS CA 1 1 6 3486 1 1 24 HIS CB C -8.389 1.163 4.476 1.00 . A A . 24 HIS CB 1 1 6 3487 1 1 24 HIS CD2 C -10.387 1.645 2.894 1.00 . A A . 24 HIS CD2 1 1 6 3488 1 1 24 HIS CE1 C -9.801 3.654 2.241 1.00 . A A . 24 HIS CE1 1 1 6 3489 1 1 24 HIS CG C -9.222 1.950 3.512 1.00 . A A . 24 HIS CG 1 1 6 3490 1 1 24 HIS H H -6.806 -0.678 5.655 1.00 . A A . 24 HIS H 1 1 6 3491 1 1 24 HIS HA H -8.384 -0.536 3.176 1.00 . A A . 24 HIS HA 1 1 6 3492 1 1 24 HIS HB2 H -9.036 0.819 5.269 1.00 . A A . 24 HIS HB2 1 1 6 3493 1 1 24 HIS HB3 H -7.642 1.826 4.889 1.00 . A A . 24 HIS HB3 1 1 6 3494 1 1 24 HIS HD1 H -8.085 3.717 3.352 1.00 . A A . 24 HIS HD1 1 1 6 3495 1 1 24 HIS HD2 H -10.947 0.726 2.998 1.00 . A A . 24 HIS HD2 1 1 6 3496 1 1 24 HIS HE1 H -9.799 4.613 1.745 1.00 . A A . 24 HIS HE1 1 1 6 3497 1 1 24 HIS N N -7.296 -0.997 4.868 1.00 . A A . 24 HIS N 1 1 6 3498 1 1 24 HIS ND1 N -8.881 3.215 3.081 1.00 . A A . 24 HIS ND1 1 1 6 3499 1 1 24 HIS NE2 N -10.726 2.720 2.110 1.00 . A A . 24 HIS NE2 1 1 6 3500 1 1 24 HIS O O -5.340 0.255 3.458 1.00 . A A . 24 HIS O 1 1 6 3501 1 1 25 HIS C C -4.856 2.570 1.705 1.00 . A A . 25 HIS C 1 1 6 3502 1 1 25 HIS CA C -5.678 1.494 1.002 1.00 . A A . 25 HIS CA 1 1 6 3503 1 1 25 HIS CB C -6.261 2.050 -0.298 1.00 . A A . 25 HIS CB 1 1 6 3504 1 1 25 HIS CD2 C -4.677 3.139 -2.039 1.00 . A A . 25 HIS CD2 1 1 6 3505 1 1 25 HIS CE1 C -3.957 1.308 -3.006 1.00 . A A . 25 HIS CE1 1 1 6 3506 1 1 25 HIS CG C -5.277 2.092 -1.426 1.00 . A A . 25 HIS CG 1 1 6 3507 1 1 25 HIS H H -7.677 1.112 1.585 1.00 . A A . 25 HIS H 1 1 6 3508 1 1 25 HIS HA H -5.032 0.661 0.769 1.00 . A A . 25 HIS HA 1 1 6 3509 1 1 25 HIS HB2 H -7.091 1.432 -0.605 1.00 . A A . 25 HIS HB2 1 1 6 3510 1 1 25 HIS HB3 H -6.613 3.057 -0.125 1.00 . A A . 25 HIS HB3 1 1 6 3511 1 1 25 HIS HD1 H -5.056 0.038 -1.838 1.00 . A A . 25 HIS HD1 1 1 6 3512 1 1 25 HIS HD2 H -4.813 4.185 -1.802 1.00 . A A . 25 HIS HD2 1 1 6 3513 1 1 25 HIS HE1 H -3.431 0.632 -3.663 1.00 . A A . 25 HIS HE1 1 1 6 3514 1 1 25 HIS N N -6.745 1.006 1.868 1.00 . A A . 25 HIS N 1 1 6 3515 1 1 25 HIS ND1 N -4.806 0.960 -2.056 1.00 . A A . 25 HIS ND1 1 1 6 3516 1 1 25 HIS NE2 N -3.861 2.626 -3.017 1.00 . A A . 25 HIS NE2 1 1 6 3517 1 1 25 HIS O O -3.638 2.448 1.836 1.00 . A A . 25 HIS O 1 1 6 3518 1 1 26 ALA C C -3.682 4.212 3.669 1.00 . A A . 26 ALA C 1 1 6 3519 1 1 26 ALA CA C -4.862 4.719 2.846 1.00 . A A . 26 ALA CA 1 1 6 3520 1 1 26 ALA CB C -5.848 5.461 3.736 1.00 . A A . 26 ALA CB 1 1 6 3521 1 1 26 ALA H H -6.499 3.663 2.021 1.00 . A A . 26 ALA H 1 1 6 3522 1 1 26 ALA HA H -4.497 5.411 2.100 1.00 . A A . 26 ALA HA 1 1 6 3523 1 1 26 ALA HB1 H -5.332 6.244 4.271 1.00 . A A . 26 ALA HB1 1 1 6 3524 1 1 26 ALA HB2 H -6.627 5.895 3.125 1.00 . A A . 26 ALA HB2 1 1 6 3525 1 1 26 ALA HB3 H -6.286 4.771 4.441 1.00 . A A . 26 ALA HB3 1 1 6 3526 1 1 26 ALA N N -5.530 3.623 2.155 1.00 . A A . 26 ALA N 1 1 6 3527 1 1 26 ALA O O -2.535 4.587 3.423 1.00 . A A . 26 ALA O 1 1 6 3528 1 1 27 SER C C -1.691 2.444 4.700 1.00 . A A . 27 SER C 1 1 6 3529 1 1 27 SER CA C -2.934 2.804 5.508 1.00 . A A . 27 SER CA 1 1 6 3530 1 1 27 SER CB C -3.458 1.566 6.239 1.00 . A A . 27 SER CB 1 1 6 3531 1 1 27 SER H H -4.905 3.099 4.792 1.00 . A A . 27 SER H 1 1 6 3532 1 1 27 SER HA H -2.671 3.557 6.236 1.00 . A A . 27 SER HA 1 1 6 3533 1 1 27 SER HB2 H -4.520 1.669 6.401 1.00 . A A . 27 SER HB2 1 1 6 3534 1 1 27 SER HB3 H -3.269 0.689 5.636 1.00 . A A . 27 SER HB3 1 1 6 3535 1 1 27 SER HG H -2.993 0.524 7.831 1.00 . A A . 27 SER HG 1 1 6 3536 1 1 27 SER N N -3.971 3.359 4.646 1.00 . A A . 27 SER N 1 1 6 3537 1 1 27 SER O O -0.565 2.728 5.112 1.00 . A A . 27 SER O 1 1 6 3538 1 1 27 SER OG O -2.817 1.405 7.493 1.00 . A A . 27 SER OG 1 1 6 3539 1 1 28 LEU C C -0.235 2.620 1.930 1.00 . A A . 28 LEU C 1 1 6 3540 1 1 28 LEU CA C -0.801 1.419 2.680 1.00 . A A . 28 LEU CA 1 1 6 3541 1 1 28 LEU CB C -1.269 0.356 1.684 1.00 . A A . 28 LEU CB 1 1 6 3542 1 1 28 LEU CD1 C 0.987 -0.380 0.878 1.00 . A A . 28 LEU CD1 1 1 6 3543 1 1 28 LEU CD2 C -1.040 -0.810 -0.523 1.00 . A A . 28 LEU CD2 1 1 6 3544 1 1 28 LEU CG C -0.378 0.144 0.460 1.00 . A A . 28 LEU CG 1 1 6 3545 1 1 28 LEU H H -2.822 1.620 3.273 1.00 . A A . 28 LEU H 1 1 6 3546 1 1 28 LEU HA H -0.025 1.000 3.302 1.00 . A A . 28 LEU HA 1 1 6 3547 1 1 28 LEU HB2 H -1.336 -0.583 2.210 1.00 . A A . 28 LEU HB2 1 1 6 3548 1 1 28 LEU HB3 H -2.251 0.642 1.334 1.00 . A A . 28 LEU HB3 1 1 6 3549 1 1 28 LEU HD11 H 0.863 -1.155 1.619 1.00 . A A . 28 LEU HD11 1 1 6 3550 1 1 28 LEU HD12 H 1.571 0.427 1.295 1.00 . A A . 28 LEU HD12 1 1 6 3551 1 1 28 LEU HD13 H 1.496 -0.784 0.015 1.00 . A A . 28 LEU HD13 1 1 6 3552 1 1 28 LEU HD21 H -0.361 -1.018 -1.336 1.00 . A A . 28 LEU HD21 1 1 6 3553 1 1 28 LEU HD22 H -1.940 -0.357 -0.913 1.00 . A A . 28 LEU HD22 1 1 6 3554 1 1 28 LEU HD23 H -1.291 -1.731 -0.018 1.00 . A A . 28 LEU HD23 1 1 6 3555 1 1 28 LEU HG H -0.232 1.092 -0.040 1.00 . A A . 28 LEU HG 1 1 6 3556 1 1 28 LEU N N -1.903 1.818 3.548 1.00 . A A . 28 LEU N 1 1 6 3557 1 1 28 LEU O O 0.980 2.768 1.797 1.00 . A A . 28 LEU O 1 1 6 3558 1 1 29 THR C C 0.188 5.557 1.556 1.00 . A A . 29 THR C 1 1 6 3559 1 1 29 THR CA C -0.714 4.669 0.707 1.00 . A A . 29 THR CA 1 1 6 3560 1 1 29 THR CB C -1.932 5.490 0.241 1.00 . A A . 29 THR CB 1 1 6 3561 1 1 29 THR CG2 C -1.513 6.892 -0.174 1.00 . A A . 29 THR CG2 1 1 6 3562 1 1 29 THR H H -2.079 3.308 1.580 1.00 . A A . 29 THR H 1 1 6 3563 1 1 29 THR HA H -0.167 4.349 -0.168 1.00 . A A . 29 THR HA 1 1 6 3564 1 1 29 THR HB H -2.630 5.567 1.063 1.00 . A A . 29 THR HB 1 1 6 3565 1 1 29 THR HG1 H -2.399 3.890 -0.813 1.00 . A A . 29 THR HG1 1 1 6 3566 1 1 29 THR HG21 H -1.874 7.605 0.551 1.00 . A A . 29 THR HG21 1 1 6 3567 1 1 29 THR HG22 H -1.933 7.121 -1.143 1.00 . A A . 29 THR HG22 1 1 6 3568 1 1 29 THR HG23 H -0.436 6.945 -0.227 1.00 . A A . 29 THR HG23 1 1 6 3569 1 1 29 THR N N -1.125 3.480 1.442 1.00 . A A . 29 THR N 1 1 6 3570 1 1 29 THR O O 1.328 5.833 1.186 1.00 . A A . 29 THR O 1 1 6 3571 1 1 29 THR OG1 O -2.575 4.833 -0.857 1.00 . A A . 29 THR OG1 1 1 6 3572 1 1 30 GLN C C 1.693 6.154 4.082 1.00 . A A . 30 GLN C 1 1 6 3573 1 1 30 GLN CA C 0.429 6.858 3.599 1.00 . A A . 30 GLN CA 1 1 6 3574 1 1 30 GLN CB C -0.432 7.265 4.796 1.00 . A A . 30 GLN CB 1 1 6 3575 1 1 30 GLN CD C 0.075 9.663 5.409 1.00 . A A . 30 GLN CD 1 1 6 3576 1 1 30 GLN CG C 0.274 8.202 5.763 1.00 . A A . 30 GLN CG 1 1 6 3577 1 1 30 GLN H H -1.246 5.746 2.937 1.00 . A A . 30 GLN H 1 1 6 3578 1 1 30 GLN HA H 0.712 7.745 3.053 1.00 . A A . 30 GLN HA 1 1 6 3579 1 1 30 GLN HB2 H -1.321 7.758 4.434 1.00 . A A . 30 GLN HB2 1 1 6 3580 1 1 30 GLN HB3 H -0.719 6.375 5.337 1.00 . A A . 30 GLN HB3 1 1 6 3581 1 1 30 GLN HE21 H 1.367 9.501 3.907 1.00 . A A . 30 GLN HE21 1 1 6 3582 1 1 30 GLN HE22 H 0.662 11.063 4.127 1.00 . A A . 30 GLN HE22 1 1 6 3583 1 1 30 GLN HG2 H -0.113 8.032 6.756 1.00 . A A . 30 GLN HG2 1 1 6 3584 1 1 30 GLN HG3 H 1.332 7.984 5.747 1.00 . A A . 30 GLN HG3 1 1 6 3585 1 1 30 GLN N N -0.331 6.001 2.697 1.00 . A A . 30 GLN N 1 1 6 3586 1 1 30 GLN NE2 N 0.772 10.123 4.377 1.00 . A A . 30 GLN NE2 1 1 6 3587 1 1 30 GLN O O 2.782 6.728 4.059 1.00 . A A . 30 GLN O 1 1 6 3588 1 1 30 GLN OE1 O -0.698 10.370 6.057 1.00 . A A . 30 GLN OE1 1 1 6 3589 1 1 31 HIS C C 3.808 4.121 3.992 1.00 . A A . 31 HIS C 1 1 6 3590 1 1 31 HIS CA C 2.671 4.127 5.009 1.00 . A A . 31 HIS CA 1 1 6 3591 1 1 31 HIS CB C 2.233 2.693 5.309 1.00 . A A . 31 HIS CB 1 1 6 3592 1 1 31 HIS CD2 C 3.881 0.916 4.384 1.00 . A A . 31 HIS CD2 1 1 6 3593 1 1 31 HIS CE1 C 5.040 0.570 6.212 1.00 . A A . 31 HIS CE1 1 1 6 3594 1 1 31 HIS CG C 3.368 1.716 5.348 1.00 . A A . 31 HIS CG 1 1 6 3595 1 1 31 HIS H H 0.647 4.506 4.513 1.00 . A A . 31 HIS H 1 1 6 3596 1 1 31 HIS HA H 3.022 4.585 5.920 1.00 . A A . 31 HIS HA 1 1 6 3597 1 1 31 HIS HB2 H 1.742 2.667 6.271 1.00 . A A . 31 HIS HB2 1 1 6 3598 1 1 31 HIS HB3 H 1.540 2.367 4.547 1.00 . A A . 31 HIS HB3 1 1 6 3599 1 1 31 HIS HD1 H 3.988 1.904 7.353 1.00 . A A . 31 HIS HD1 1 1 6 3600 1 1 31 HIS HD2 H 3.539 0.843 3.361 1.00 . A A . 31 HIS HD2 1 1 6 3601 1 1 31 HIS HE1 H 5.770 0.186 6.909 1.00 . A A . 31 HIS HE1 1 1 6 3602 1 1 31 HIS N N 1.541 4.909 4.520 1.00 . A A . 31 HIS N 1 1 6 3603 1 1 31 HIS ND1 N 4.116 1.475 6.481 1.00 . A A . 31 HIS ND1 1 1 6 3604 1 1 31 HIS NE2 N 4.919 0.215 4.946 1.00 . A A . 31 HIS NE2 1 1 6 3605 1 1 31 HIS O O 4.951 4.434 4.325 1.00 . A A . 31 HIS O 1 1 6 3606 1 1 32 GLN C C 5.485 4.858 1.831 1.00 . A A . 32 GLN C 1 1 6 3607 1 1 32 GLN CA C 4.482 3.717 1.689 1.00 . A A . 32 GLN CA 1 1 6 3608 1 1 32 GLN CB C 3.802 3.788 0.321 1.00 . A A . 32 GLN CB 1 1 6 3609 1 1 32 GLN CD C 4.477 1.504 -0.523 1.00 . A A . 32 GLN CD 1 1 6 3610 1 1 32 GLN CG C 3.329 2.438 -0.194 1.00 . A A . 32 GLN CG 1 1 6 3611 1 1 32 GLN H H 2.558 3.526 2.550 1.00 . A A . 32 GLN H 1 1 6 3612 1 1 32 GLN HA H 5.010 2.779 1.770 1.00 . A A . 32 GLN HA 1 1 6 3613 1 1 32 GLN HB2 H 2.946 4.442 0.391 1.00 . A A . 32 GLN HB2 1 1 6 3614 1 1 32 GLN HB3 H 4.500 4.197 -0.394 1.00 . A A . 32 GLN HB3 1 1 6 3615 1 1 32 GLN HE21 H 3.210 0.180 -1.294 1.00 . A A . 32 GLN HE21 1 1 6 3616 1 1 32 GLN HE22 H 4.879 -0.266 -1.333 1.00 . A A . 32 GLN HE22 1 1 6 3617 1 1 32 GLN HG2 H 2.713 1.974 0.562 1.00 . A A . 32 GLN HG2 1 1 6 3618 1 1 32 GLN HG3 H 2.743 2.594 -1.088 1.00 . A A . 32 GLN HG3 1 1 6 3619 1 1 32 GLN N N 3.486 3.764 2.753 1.00 . A A . 32 GLN N 1 1 6 3620 1 1 32 GLN NE2 N 4.157 0.356 -1.109 1.00 . A A . 32 GLN NE2 1 1 6 3621 1 1 32 GLN O O 6.639 4.737 1.421 1.00 . A A . 32 GLN O 1 1 6 3622 1 1 32 GLN OE1 O 5.638 1.811 -0.253 1.00 . A A . 32 GLN OE1 1 1 6 3623 1 1 33 ARG C C 7.202 6.731 3.284 1.00 . A A . 33 ARG C 1 1 6 3624 1 1 33 ARG CA C 5.893 7.127 2.608 1.00 . A A . 33 ARG CA 1 1 6 3625 1 1 33 ARG CB C 5.173 8.184 3.448 1.00 . A A . 33 ARG CB 1 1 6 3626 1 1 33 ARG CD C 4.404 9.702 1.599 1.00 . A A . 33 ARG CD 1 1 6 3627 1 1 33 ARG CG C 3.975 8.805 2.749 1.00 . A A . 33 ARG CG 1 1 6 3628 1 1 33 ARG CZ C 5.800 11.712 1.361 1.00 . A A . 33 ARG CZ 1 1 6 3629 1 1 33 ARG H H 4.105 6.000 2.720 1.00 . A A . 33 ARG H 1 1 6 3630 1 1 33 ARG HA H 6.115 7.543 1.636 1.00 . A A . 33 ARG HA 1 1 6 3631 1 1 33 ARG HB2 H 4.830 7.726 4.364 1.00 . A A . 33 ARG HB2 1 1 6 3632 1 1 33 ARG HB3 H 5.871 8.972 3.688 1.00 . A A . 33 ARG HB3 1 1 6 3633 1 1 33 ARG HD2 H 5.156 9.186 1.019 1.00 . A A . 33 ARG HD2 1 1 6 3634 1 1 33 ARG HD3 H 3.545 9.903 0.976 1.00 . A A . 33 ARG HD3 1 1 6 3635 1 1 33 ARG HE H 4.683 11.281 2.957 1.00 . A A . 33 ARG HE 1 1 6 3636 1 1 33 ARG HG2 H 3.347 8.016 2.361 1.00 . A A . 33 ARG HG2 1 1 6 3637 1 1 33 ARG HG3 H 3.418 9.392 3.464 1.00 . A A . 33 ARG HG3 1 1 6 3638 1 1 33 ARG HH11 H 5.843 10.455 -0.220 1.00 . A A . 33 ARG HH11 1 1 6 3639 1 1 33 ARG HH12 H 6.822 11.876 -0.375 1.00 . A A . 33 ARG HH12 1 1 6 3640 1 1 33 ARG HH21 H 5.969 13.156 2.766 1.00 . A A . 33 ARG HH21 1 1 6 3641 1 1 33 ARG HH22 H 6.894 13.411 1.325 1.00 . A A . 33 ARG HH22 1 1 6 3642 1 1 33 ARG N N 5.036 5.964 2.414 1.00 . A A . 33 ARG N 1 1 6 3643 1 1 33 ARG NE N 4.956 10.969 2.069 1.00 . A A . 33 ARG NE 1 1 6 3644 1 1 33 ARG NH1 N 6.187 11.315 0.157 1.00 . A A . 33 ARG NH1 1 1 6 3645 1 1 33 ARG NH2 N 6.259 12.853 1.858 1.00 . A A . 33 ARG NH2 1 1 6 3646 1 1 33 ARG O O 8.286 7.083 2.817 1.00 . A A . 33 ARG O 1 1 6 3647 1 1 34 VAL C C 9.351 5.035 4.183 1.00 . A A . 34 VAL C 1 1 6 3648 1 1 34 VAL CA C 8.269 5.550 5.126 1.00 . A A . 34 VAL CA 1 1 6 3649 1 1 34 VAL CB C 7.911 4.441 6.133 1.00 . A A . 34 VAL CB 1 1 6 3650 1 1 34 VAL CG1 C 6.863 4.932 7.119 1.00 . A A . 34 VAL CG1 1 1 6 3651 1 1 34 VAL CG2 C 7.427 3.196 5.404 1.00 . A A . 34 VAL CG2 1 1 6 3652 1 1 34 VAL H H 6.204 5.746 4.709 1.00 . A A . 34 VAL H 1 1 6 3653 1 1 34 VAL HA H 8.657 6.395 5.676 1.00 . A A . 34 VAL HA 1 1 6 3654 1 1 34 VAL HB H 8.802 4.184 6.687 1.00 . A A . 34 VAL HB 1 1 6 3655 1 1 34 VAL HG11 H 6.428 4.087 7.632 1.00 . A A . 34 VAL HG11 1 1 6 3656 1 1 34 VAL HG12 H 7.326 5.592 7.838 1.00 . A A . 34 VAL HG12 1 1 6 3657 1 1 34 VAL HG13 H 6.090 5.466 6.586 1.00 . A A . 34 VAL HG13 1 1 6 3658 1 1 34 VAL HG21 H 6.349 3.151 5.444 1.00 . A A . 34 VAL HG21 1 1 6 3659 1 1 34 VAL HG22 H 7.748 3.236 4.373 1.00 . A A . 34 VAL HG22 1 1 6 3660 1 1 34 VAL HG23 H 7.842 2.317 5.876 1.00 . A A . 34 VAL HG23 1 1 6 3661 1 1 34 VAL N N 7.095 5.995 4.386 1.00 . A A . 34 VAL N 1 1 6 3662 1 1 34 VAL O O 10.536 5.042 4.517 1.00 . A A . 34 VAL O 1 1 6 3663 1 1 35 HIS C C 10.136 5.110 0.922 1.00 . A A . 35 HIS C 1 1 6 3664 1 1 35 HIS CA C 9.868 4.072 2.007 1.00 . A A . 35 HIS CA 1 1 6 3665 1 1 35 HIS CB C 9.319 2.790 1.380 1.00 . A A . 35 HIS CB 1 1 6 3666 1 1 35 HIS CD2 C 7.567 1.266 2.536 1.00 . A A . 35 HIS CD2 1 1 6 3667 1 1 35 HIS CE1 C 8.851 0.440 4.110 1.00 . A A . 35 HIS CE1 1 1 6 3668 1 1 35 HIS CG C 8.799 1.808 2.383 1.00 . A A . 35 HIS CG 1 1 6 3669 1 1 35 HIS H H 7.977 4.610 2.793 1.00 . A A . 35 HIS H 1 1 6 3670 1 1 35 HIS HA H 10.797 3.847 2.510 1.00 . A A . 35 HIS HA 1 1 6 3671 1 1 35 HIS HB2 H 8.508 3.043 0.713 1.00 . A A . 35 HIS HB2 1 1 6 3672 1 1 35 HIS HB3 H 10.105 2.307 0.818 1.00 . A A . 35 HIS HB3 1 1 6 3673 1 1 35 HIS HD1 H 10.526 1.468 3.541 1.00 . A A . 35 HIS HD1 1 1 6 3674 1 1 35 HIS HD2 H 6.699 1.463 1.922 1.00 . A A . 35 HIS HD2 1 1 6 3675 1 1 35 HIS HE1 H 9.197 -0.126 4.962 1.00 . A A . 35 HIS HE1 1 1 6 3676 1 1 35 HIS N N 8.934 4.590 3.001 1.00 . A A . 35 HIS N 1 1 6 3677 1 1 35 HIS ND1 N 9.579 1.271 3.385 1.00 . A A . 35 HIS ND1 1 1 6 3678 1 1 35 HIS NE2 N 7.626 0.420 3.616 1.00 . A A . 35 HIS NE2 1 1 6 3679 1 1 35 HIS O O 9.259 5.900 0.574 1.00 . A A . 35 HIS O 1 1 6 3680 1 1 36 SER C C 12.328 5.314 -1.856 1.00 . A A . 36 SER C 1 1 6 3681 1 1 36 SER CA C 11.740 6.045 -0.652 1.00 . A A . 36 SER CA 1 1 6 3682 1 1 36 SER CB C 12.754 7.053 -0.109 1.00 . A A . 36 SER CB 1 1 6 3683 1 1 36 SER H H 12.011 4.447 0.710 1.00 . A A . 36 SER H 1 1 6 3684 1 1 36 SER HA H 10.852 6.574 -0.966 1.00 . A A . 36 SER HA 1 1 6 3685 1 1 36 SER HB2 H 13.020 7.750 -0.889 1.00 . A A . 36 SER HB2 1 1 6 3686 1 1 36 SER HB3 H 12.315 7.591 0.720 1.00 . A A . 36 SER HB3 1 1 6 3687 1 1 36 SER HG H 13.755 5.465 0.450 1.00 . A A . 36 SER HG 1 1 6 3688 1 1 36 SER N N 11.355 5.102 0.390 1.00 . A A . 36 SER N 1 1 6 3689 1 1 36 SER O O 13.535 5.088 -1.930 1.00 . A A . 36 SER O 1 1 6 3690 1 1 36 SER OG O 13.930 6.402 0.342 1.00 . A A . 36 SER OG 1 1 6 3691 1 1 37 GLY C C 13.069 3.307 -3.701 1.00 . A A . 37 GLY C 1 1 6 3692 1 1 37 GLY CA C 11.915 4.246 -3.986 1.00 . A A . 37 GLY CA 1 1 6 3693 1 1 37 GLY H H 10.513 5.156 -2.685 1.00 . A A . 37 GLY H 1 1 6 3694 1 1 37 GLY HA2 H 11.091 3.676 -4.388 1.00 . A A . 37 GLY HA2 1 1 6 3695 1 1 37 GLY HA3 H 12.230 4.973 -4.721 1.00 . A A . 37 GLY HA3 1 1 6 3696 1 1 37 GLY N N 11.464 4.948 -2.798 1.00 . A A . 37 GLY N 1 1 6 3697 1 1 37 GLY O O 14.077 3.320 -4.407 1.00 . A A . 37 GLY O 1 1 6 3698 1 1 38 GLU C C 13.797 0.223 -3.033 1.00 . A A . 38 GLU C 1 1 6 3699 1 1 38 GLU CA C 13.965 1.542 -2.284 1.00 . A A . 38 GLU CA 1 1 6 3700 1 1 38 GLU CB C 13.935 1.291 -0.775 1.00 . A A . 38 GLU CB 1 1 6 3701 1 1 38 GLU CD C 16.451 1.270 -0.552 1.00 . A A . 38 GLU CD 1 1 6 3702 1 1 38 GLU CG C 15.152 0.544 -0.258 1.00 . A A . 38 GLU CG 1 1 6 3703 1 1 38 GLU H H 12.097 2.527 -2.137 1.00 . A A . 38 GLU H 1 1 6 3704 1 1 38 GLU HA H 14.918 1.973 -2.549 1.00 . A A . 38 GLU HA 1 1 6 3705 1 1 38 GLU HB2 H 13.877 2.242 -0.265 1.00 . A A . 38 GLU HB2 1 1 6 3706 1 1 38 GLU HB3 H 13.055 0.712 -0.536 1.00 . A A . 38 GLU HB3 1 1 6 3707 1 1 38 GLU HG2 H 15.059 0.426 0.812 1.00 . A A . 38 GLU HG2 1 1 6 3708 1 1 38 GLU HG3 H 15.187 -0.429 -0.725 1.00 . A A . 38 GLU HG3 1 1 6 3709 1 1 38 GLU N N 12.923 2.490 -2.662 1.00 . A A . 38 GLU N 1 1 6 3710 1 1 38 GLU O O 12.699 -0.332 -3.099 1.00 . A A . 38 GLU O 1 1 6 3711 1 1 38 GLU OE1 O 16.548 2.470 -0.219 1.00 . A A . 38 GLU OE1 1 1 6 3712 1 1 38 GLU OE2 O 17.369 0.639 -1.116 1.00 . A A . 38 GLU OE2 1 1 6 3713 1 1 39 LYS C C 15.511 -2.652 -3.534 1.00 . A A . 39 LYS C 1 1 6 3714 1 1 39 LYS CA C 14.869 -1.528 -4.341 1.00 . A A . 39 LYS CA 1 1 6 3715 1 1 39 LYS CB C 15.597 -1.365 -5.678 1.00 . A A . 39 LYS CB 1 1 6 3716 1 1 39 LYS CD C 17.848 -1.522 -6.782 1.00 . A A . 39 LYS CD 1 1 6 3717 1 1 39 LYS CE C 18.080 -3.024 -6.827 1.00 . A A . 39 LYS CE 1 1 6 3718 1 1 39 LYS CG C 17.088 -1.113 -5.531 1.00 . A A . 39 LYS CG 1 1 6 3719 1 1 39 LYS H H 15.738 0.214 -3.510 1.00 . A A . 39 LYS H 1 1 6 3720 1 1 39 LYS HA H 13.837 -1.781 -4.532 1.00 . A A . 39 LYS HA 1 1 6 3721 1 1 39 LYS HB2 H 15.461 -2.264 -6.260 1.00 . A A . 39 LYS HB2 1 1 6 3722 1 1 39 LYS HB3 H 15.163 -0.531 -6.211 1.00 . A A . 39 LYS HB3 1 1 6 3723 1 1 39 LYS HD2 H 17.277 -1.231 -7.651 1.00 . A A . 39 LYS HD2 1 1 6 3724 1 1 39 LYS HD3 H 18.804 -1.018 -6.792 1.00 . A A . 39 LYS HD3 1 1 6 3725 1 1 39 LYS HE2 H 18.923 -3.226 -7.471 1.00 . A A . 39 LYS HE2 1 1 6 3726 1 1 39 LYS HE3 H 18.300 -3.371 -5.828 1.00 . A A . 39 LYS HE3 1 1 6 3727 1 1 39 LYS HG2 H 17.250 -0.060 -5.352 1.00 . A A . 39 LYS HG2 1 1 6 3728 1 1 39 LYS HG3 H 17.460 -1.684 -4.692 1.00 . A A . 39 LYS HG3 1 1 6 3729 1 1 39 LYS HZ1 H 16.234 -3.090 -7.802 1.00 . A A . 39 LYS HZ1 1 1 6 3730 1 1 39 LYS HZ2 H 16.395 -4.229 -6.561 1.00 . A A . 39 LYS HZ2 1 1 6 3731 1 1 39 LYS HZ3 H 17.183 -4.470 -8.038 1.00 . A A . 39 LYS HZ3 1 1 6 3732 1 1 39 LYS N N 14.892 -0.274 -3.597 1.00 . A A . 39 LYS N 1 1 6 3733 1 1 39 LYS NZ N 16.890 -3.754 -7.343 1.00 . A A . 39 LYS NZ 1 1 6 3734 1 1 39 LYS O O 16.386 -2.426 -2.698 1.00 . A A . 39 LYS O 1 1 6 3735 1 1 40 PRO C C 17.023 -5.399 -3.501 1.00 . A A . 40 PRO C 1 1 6 3736 1 1 40 PRO CA C 15.589 -5.075 -3.098 1.00 . A A . 40 PRO CA 1 1 6 3737 1 1 40 PRO CB C 14.643 -6.192 -3.547 1.00 . A A . 40 PRO CB 1 1 6 3738 1 1 40 PRO CD C 14.028 -4.234 -4.773 1.00 . A A . 40 PRO CD 1 1 6 3739 1 1 40 PRO CG C 14.111 -5.733 -4.861 1.00 . A A . 40 PRO CG 1 1 6 3740 1 1 40 PRO HA H 15.533 -4.964 -2.025 1.00 . A A . 40 PRO HA 1 1 6 3741 1 1 40 PRO HB2 H 15.194 -7.117 -3.645 1.00 . A A . 40 PRO HB2 1 1 6 3742 1 1 40 PRO HB3 H 13.852 -6.313 -2.822 1.00 . A A . 40 PRO HB3 1 1 6 3743 1 1 40 PRO HD2 H 14.242 -3.787 -5.733 1.00 . A A . 40 PRO HD2 1 1 6 3744 1 1 40 PRO HD3 H 13.053 -3.931 -4.423 1.00 . A A . 40 PRO HD3 1 1 6 3745 1 1 40 PRO HG2 H 14.785 -6.025 -5.652 1.00 . A A . 40 PRO HG2 1 1 6 3746 1 1 40 PRO HG3 H 13.131 -6.153 -5.027 1.00 . A A . 40 PRO HG3 1 1 6 3747 1 1 40 PRO N N 15.069 -3.892 -3.790 1.00 . A A . 40 PRO N 1 1 6 3748 1 1 40 PRO O O 17.293 -5.741 -4.652 1.00 . A A . 40 PRO O 1 1 6 3749 1 1 41 SER C C 19.849 -6.701 -1.915 1.00 . A A . 41 SER C 1 1 6 3750 1 1 41 SER CA C 19.349 -5.565 -2.802 1.00 . A A . 41 SER CA 1 1 6 3751 1 1 41 SER CB C 20.190 -4.309 -2.563 1.00 . A A . 41 SER CB 1 1 6 3752 1 1 41 SER H H 17.663 -5.010 -1.647 1.00 . A A . 41 SER H 1 1 6 3753 1 1 41 SER HA H 19.446 -5.861 -3.836 1.00 . A A . 41 SER HA 1 1 6 3754 1 1 41 SER HB2 H 19.996 -3.933 -1.570 1.00 . A A . 41 SER HB2 1 1 6 3755 1 1 41 SER HB3 H 21.237 -4.557 -2.657 1.00 . A A . 41 SER HB3 1 1 6 3756 1 1 41 SER HG H 18.920 -3.211 -3.573 1.00 . A A . 41 SER HG 1 1 6 3757 1 1 41 SER N N 17.941 -5.288 -2.545 1.00 . A A . 41 SER N 1 1 6 3758 1 1 41 SER O O 20.326 -7.723 -2.407 1.00 . A A . 41 SER O 1 1 6 3759 1 1 41 SER OG O 19.874 -3.297 -3.504 1.00 . A A . 41 SER OG 1 1 6 3760 1 1 42 GLY C C 21.140 -6.984 1.370 1.00 . A A . 42 GLY C 1 1 6 3761 1 1 42 GLY CA C 20.180 -7.531 0.331 1.00 . A A . 42 GLY CA 1 1 6 3762 1 1 42 GLY H H 19.347 -5.679 -0.269 1.00 . A A . 42 GLY H 1 1 6 3763 1 1 42 GLY HA2 H 19.319 -7.944 0.835 1.00 . A A . 42 GLY HA2 1 1 6 3764 1 1 42 GLY HA3 H 20.674 -8.319 -0.219 1.00 . A A . 42 GLY HA3 1 1 6 3765 1 1 42 GLY N N 19.736 -6.515 -0.604 1.00 . A A . 42 GLY N 1 1 6 3766 1 1 42 GLY O O 22.360 -7.058 1.219 1.00 . A A . 42 GLY O 1 1 6 3767 1 1 43 PRO C C 22.113 -6.911 4.350 1.00 . A A . 43 PRO C 1 1 6 3768 1 1 43 PRO CA C 21.384 -5.844 3.540 1.00 . A A . 43 PRO CA 1 1 6 3769 1 1 43 PRO CB C 20.342 -5.134 4.408 1.00 . A A . 43 PRO CB 1 1 6 3770 1 1 43 PRO CD C 19.140 -6.295 2.698 1.00 . A A . 43 PRO CD 1 1 6 3771 1 1 43 PRO CG C 19.067 -5.855 4.134 1.00 . A A . 43 PRO CG 1 1 6 3772 1 1 43 PRO HA H 22.099 -5.124 3.171 1.00 . A A . 43 PRO HA 1 1 6 3773 1 1 43 PRO HB2 H 20.624 -5.210 5.449 1.00 . A A . 43 PRO HB2 1 1 6 3774 1 1 43 PRO HB3 H 20.277 -4.096 4.121 1.00 . A A . 43 PRO HB3 1 1 6 3775 1 1 43 PRO HD2 H 18.645 -7.246 2.570 1.00 . A A . 43 PRO HD2 1 1 6 3776 1 1 43 PRO HD3 H 18.702 -5.549 2.052 1.00 . A A . 43 PRO HD3 1 1 6 3777 1 1 43 PRO HG2 H 18.983 -6.712 4.785 1.00 . A A . 43 PRO HG2 1 1 6 3778 1 1 43 PRO HG3 H 18.230 -5.188 4.279 1.00 . A A . 43 PRO HG3 1 1 6 3779 1 1 43 PRO N N 20.587 -6.418 2.452 1.00 . A A . 43 PRO N 1 1 6 3780 1 1 43 PRO O O 21.826 -8.102 4.227 1.00 . A A . 43 PRO O 1 1 6 3781 1 1 44 SER C C 23.439 -7.265 7.473 1.00 . A A . 44 SER C 1 1 6 3782 1 1 44 SER CA C 23.831 -7.396 6.005 1.00 . A A . 44 SER CA 1 1 6 3783 1 1 44 SER CB C 25.328 -7.128 5.840 1.00 . A A . 44 SER CB 1 1 6 3784 1 1 44 SER H H 23.242 -5.515 5.231 1.00 . A A . 44 SER H 1 1 6 3785 1 1 44 SER HA H 23.615 -8.401 5.675 1.00 . A A . 44 SER HA 1 1 6 3786 1 1 44 SER HB2 H 25.531 -6.849 4.817 1.00 . A A . 44 SER HB2 1 1 6 3787 1 1 44 SER HB3 H 25.622 -6.323 6.498 1.00 . A A . 44 SER HB3 1 1 6 3788 1 1 44 SER HG H 26.211 -8.331 7.110 1.00 . A A . 44 SER HG 1 1 6 3789 1 1 44 SER N N 23.058 -6.477 5.177 1.00 . A A . 44 SER N 1 1 6 3790 1 1 44 SER O O 23.172 -6.167 7.961 1.00 . A A . 44 SER O 1 1 6 3791 1 1 44 SER OG O 26.091 -8.279 6.159 1.00 . A A . 44 SER OG 1 1 6 3792 1 1 45 SER C C 24.235 -8.028 10.457 1.00 . A A . 45 SER C 1 1 6 3793 1 1 45 SER CA C 23.042 -8.409 9.585 1.00 . A A . 45 SER CA 1 1 6 3794 1 1 45 SER CB C 22.524 -9.792 9.986 1.00 . A A . 45 SER CB 1 1 6 3795 1 1 45 SER H H 23.629 -9.239 7.728 1.00 . A A . 45 SER H 1 1 6 3796 1 1 45 SER HA H 22.257 -7.683 9.733 1.00 . A A . 45 SER HA 1 1 6 3797 1 1 45 SER HB2 H 22.325 -9.805 11.047 1.00 . A A . 45 SER HB2 1 1 6 3798 1 1 45 SER HB3 H 21.613 -10.002 9.446 1.00 . A A . 45 SER HB3 1 1 6 3799 1 1 45 SER HG H 23.463 -11.466 10.379 1.00 . A A . 45 SER HG 1 1 6 3800 1 1 45 SER N N 23.406 -8.395 8.173 1.00 . A A . 45 SER N 1 1 6 3801 1 1 45 SER O O 25.367 -8.427 10.189 1.00 . A A . 45 SER O 1 1 6 3802 1 1 45 SER OG O 23.475 -10.799 9.688 1.00 . A A . 45 SER OG 1 1 6 3803 1 1 46 GLY C C 24.526 -6.537 13.799 1.00 . A A . 46 GLY C 1 1 6 3804 1 1 46 GLY CA C 25.031 -6.828 12.399 1.00 . A A . 46 GLY CA 1 1 6 3805 1 1 46 GLY H H 23.049 -6.963 11.668 1.00 . A A . 46 GLY H 1 1 6 3806 1 1 46 GLY HA2 H 25.776 -7.608 12.451 1.00 . A A . 46 GLY HA2 1 1 6 3807 1 1 46 GLY HA3 H 25.488 -5.934 12.001 1.00 . A A . 46 GLY HA3 1 1 6 3808 1 1 46 GLY N N 23.971 -7.251 11.503 1.00 . A A . 46 GLY N 1 1 6 3809 1 1 46 GLY O O 23.856 -7.388 14.382 1.00 . A A . 46 GLY O 1 1 6 3810 2 2 1 ZN ZN ZN 6.111 -0.732 3.542 1.00 . B A . 181 ZN ZN 1 1 7 3811 1 1 1 GLY C C 1.457 -27.428 -6.406 1.00 . A A . 1 GLY C 1 1 7 3812 1 1 1 GLY CA C 2.014 -28.813 -6.666 1.00 . A A . 1 GLY CA 1 1 7 3813 1 1 1 GLY H1 H 2.406 -29.704 -8.547 1.00 . A A . 1 GLY H1 1 1 7 3814 1 1 1 GLY HA2 H 1.601 -29.499 -5.942 1.00 . A A . 1 GLY HA2 1 1 7 3815 1 1 1 GLY HA3 H 3.088 -28.785 -6.548 1.00 . A A . 1 GLY HA3 1 1 7 3816 1 1 1 GLY N N 1.703 -29.296 -7.999 1.00 . A A . 1 GLY N 1 1 7 3817 1 1 1 GLY O O 1.933 -26.444 -6.970 1.00 . A A . 1 GLY O 1 1 7 3818 1 1 2 SER C C -0.514 -26.003 -3.732 1.00 . A A . 2 SER C 1 1 7 3819 1 1 2 SER CA C -0.185 -26.077 -5.220 1.00 . A A . 2 SER CA 1 1 7 3820 1 1 2 SER CB C -1.458 -25.883 -6.046 1.00 . A A . 2 SER CB 1 1 7 3821 1 1 2 SER H H 0.107 -28.173 -5.132 1.00 . A A . 2 SER H 1 1 7 3822 1 1 2 SER HA H 0.515 -25.291 -5.462 1.00 . A A . 2 SER HA 1 1 7 3823 1 1 2 SER HB2 H -1.852 -24.893 -5.868 1.00 . A A . 2 SER HB2 1 1 7 3824 1 1 2 SER HB3 H -1.224 -25.994 -7.095 1.00 . A A . 2 SER HB3 1 1 7 3825 1 1 2 SER HG H -3.291 -26.397 -5.586 1.00 . A A . 2 SER HG 1 1 7 3826 1 1 2 SER N N 0.442 -27.352 -5.550 1.00 . A A . 2 SER N 1 1 7 3827 1 1 2 SER O O -1.023 -26.959 -3.149 1.00 . A A . 2 SER O 1 1 7 3828 1 1 2 SER OG O -2.445 -26.837 -5.694 1.00 . A A . 2 SER OG 1 1 7 3829 1 1 3 SER C C -1.723 -23.801 -1.494 1.00 . A A . 3 SER C 1 1 7 3830 1 1 3 SER CA C -0.478 -24.659 -1.703 1.00 . A A . 3 SER CA 1 1 7 3831 1 1 3 SER CB C 0.728 -24.000 -1.030 1.00 . A A . 3 SER CB 1 1 7 3832 1 1 3 SER H H 0.187 -24.132 -3.643 1.00 . A A . 3 SER H 1 1 7 3833 1 1 3 SER HA H -0.644 -25.628 -1.257 1.00 . A A . 3 SER HA 1 1 7 3834 1 1 3 SER HB2 H 0.989 -23.100 -1.566 1.00 . A A . 3 SER HB2 1 1 7 3835 1 1 3 SER HB3 H 0.475 -23.751 -0.009 1.00 . A A . 3 SER HB3 1 1 7 3836 1 1 3 SER HG H 2.114 -25.052 -1.929 1.00 . A A . 3 SER HG 1 1 7 3837 1 1 3 SER N N -0.218 -24.858 -3.124 1.00 . A A . 3 SER N 1 1 7 3838 1 1 3 SER O O -1.744 -22.916 -0.640 1.00 . A A . 3 SER O 1 1 7 3839 1 1 3 SER OG O 1.846 -24.870 -1.025 1.00 . A A . 3 SER OG 1 1 7 3840 1 1 4 GLY C C -3.752 -21.857 -1.838 1.00 . A A . 4 GLY C 1 1 7 3841 1 1 4 GLY CA C -3.993 -23.316 -2.169 1.00 . A A . 4 GLY CA 1 1 7 3842 1 1 4 GLY H H -2.685 -24.788 -2.946 1.00 . A A . 4 GLY H 1 1 7 3843 1 1 4 GLY HA2 H -4.528 -23.379 -3.105 1.00 . A A . 4 GLY HA2 1 1 7 3844 1 1 4 GLY HA3 H -4.599 -23.754 -1.390 1.00 . A A . 4 GLY HA3 1 1 7 3845 1 1 4 GLY N N -2.759 -24.071 -2.282 1.00 . A A . 4 GLY N 1 1 7 3846 1 1 4 GLY O O -3.957 -21.428 -0.703 1.00 . A A . 4 GLY O 1 1 7 3847 1 1 5 SER C C -3.263 -18.895 -3.934 1.00 . A A . 5 SER C 1 1 7 3848 1 1 5 SER CA C -3.039 -19.671 -2.640 1.00 . A A . 5 SER CA 1 1 7 3849 1 1 5 SER CB C -1.603 -19.470 -2.153 1.00 . A A . 5 SER CB 1 1 7 3850 1 1 5 SER H H -3.170 -21.491 -3.716 1.00 . A A . 5 SER H 1 1 7 3851 1 1 5 SER HA H -3.721 -19.301 -1.889 1.00 . A A . 5 SER HA 1 1 7 3852 1 1 5 SER HB2 H -1.368 -20.221 -1.414 1.00 . A A . 5 SER HB2 1 1 7 3853 1 1 5 SER HB3 H -0.926 -19.563 -2.989 1.00 . A A . 5 SER HB3 1 1 7 3854 1 1 5 SER HG H -2.219 -17.964 -1.061 1.00 . A A . 5 SER HG 1 1 7 3855 1 1 5 SER N N -3.314 -21.091 -2.832 1.00 . A A . 5 SER N 1 1 7 3856 1 1 5 SER O O -2.529 -19.064 -4.908 1.00 . A A . 5 SER O 1 1 7 3857 1 1 5 SER OG O -1.437 -18.188 -1.571 1.00 . A A . 5 SER OG 1 1 7 3858 1 1 6 SER C C -4.105 -15.809 -4.947 1.00 . A A . 6 SER C 1 1 7 3859 1 1 6 SER CA C -4.607 -17.240 -5.110 1.00 . A A . 6 SER CA 1 1 7 3860 1 1 6 SER CB C -6.118 -17.238 -5.351 1.00 . A A . 6 SER CB 1 1 7 3861 1 1 6 SER H H -4.831 -17.951 -3.128 1.00 . A A . 6 SER H 1 1 7 3862 1 1 6 SER HA H -4.116 -17.687 -5.962 1.00 . A A . 6 SER HA 1 1 7 3863 1 1 6 SER HB2 H -6.504 -18.236 -5.205 1.00 . A A . 6 SER HB2 1 1 7 3864 1 1 6 SER HB3 H -6.590 -16.563 -4.652 1.00 . A A . 6 SER HB3 1 1 7 3865 1 1 6 SER HG H -6.742 -15.913 -6.652 1.00 . A A . 6 SER HG 1 1 7 3866 1 1 6 SER N N -4.283 -18.042 -3.936 1.00 . A A . 6 SER N 1 1 7 3867 1 1 6 SER O O -3.334 -15.312 -5.767 1.00 . A A . 6 SER O 1 1 7 3868 1 1 6 SER OG O -6.423 -16.819 -6.670 1.00 . A A . 6 SER OG 1 1 7 3869 1 1 7 GLY C C -5.163 -12.771 -4.094 1.00 . A A . 7 GLY C 1 1 7 3870 1 1 7 GLY CA C -4.135 -13.783 -3.628 1.00 . A A . 7 GLY CA 1 1 7 3871 1 1 7 GLY H H -5.163 -15.597 -3.260 1.00 . A A . 7 GLY H 1 1 7 3872 1 1 7 GLY HA2 H -3.976 -13.656 -2.567 1.00 . A A . 7 GLY HA2 1 1 7 3873 1 1 7 GLY HA3 H -3.205 -13.599 -4.146 1.00 . A A . 7 GLY HA3 1 1 7 3874 1 1 7 GLY N N -4.549 -15.151 -3.880 1.00 . A A . 7 GLY N 1 1 7 3875 1 1 7 GLY O O -4.814 -11.737 -4.666 1.00 . A A . 7 GLY O 1 1 7 3876 1 1 8 THR C C -8.660 -12.211 -3.243 1.00 . A A . 8 THR C 1 1 7 3877 1 1 8 THR CA C -7.518 -12.177 -4.252 1.00 . A A . 8 THR CA 1 1 7 3878 1 1 8 THR CB C -8.065 -12.550 -5.643 1.00 . A A . 8 THR CB 1 1 7 3879 1 1 8 THR CG2 C -6.944 -12.604 -6.669 1.00 . A A . 8 THR CG2 1 1 7 3880 1 1 8 THR H H -6.651 -13.905 -3.391 1.00 . A A . 8 THR H 1 1 7 3881 1 1 8 THR HA H -7.123 -11.173 -4.301 1.00 . A A . 8 THR HA 1 1 7 3882 1 1 8 THR HB H -8.776 -11.795 -5.947 1.00 . A A . 8 THR HB 1 1 7 3883 1 1 8 THR HG1 H -8.204 -14.429 -5.062 1.00 . A A . 8 THR HG1 1 1 7 3884 1 1 8 THR HG21 H -6.134 -13.207 -6.286 1.00 . A A . 8 THR HG21 1 1 7 3885 1 1 8 THR HG22 H -6.585 -11.603 -6.864 1.00 . A A . 8 THR HG22 1 1 7 3886 1 1 8 THR HG23 H -7.315 -13.038 -7.585 1.00 . A A . 8 THR HG23 1 1 7 3887 1 1 8 THR N N -6.436 -13.067 -3.851 1.00 . A A . 8 THR N 1 1 7 3888 1 1 8 THR O O -9.138 -13.281 -2.868 1.00 . A A . 8 THR O 1 1 7 3889 1 1 8 THR OG1 O -8.727 -13.818 -5.585 1.00 . A A . 8 THR OG1 1 1 7 3890 1 1 9 GLY C C -9.856 -10.029 -0.686 1.00 . A A . 9 GLY C 1 1 7 3891 1 1 9 GLY CA C -10.179 -10.950 -1.847 1.00 . A A . 9 GLY CA 1 1 7 3892 1 1 9 GLY H H -8.676 -10.212 -3.142 1.00 . A A . 9 GLY H 1 1 7 3893 1 1 9 GLY HA2 H -11.063 -10.584 -2.348 1.00 . A A . 9 GLY HA2 1 1 7 3894 1 1 9 GLY HA3 H -10.379 -11.939 -1.461 1.00 . A A . 9 GLY HA3 1 1 7 3895 1 1 9 GLY N N -9.095 -11.032 -2.808 1.00 . A A . 9 GLY N 1 1 7 3896 1 1 9 GLY O O -9.913 -8.808 -0.821 1.00 . A A . 9 GLY O 1 1 7 3897 1 1 10 GLU C C -7.711 -9.456 1.652 1.00 . A A . 10 GLU C 1 1 7 3898 1 1 10 GLU CA C -9.188 -9.840 1.646 1.00 . A A . 10 GLU CA 1 1 7 3899 1 1 10 GLU CB C -9.525 -10.633 2.911 1.00 . A A . 10 GLU CB 1 1 7 3900 1 1 10 GLU CD C -11.503 -12.124 2.417 1.00 . A A . 10 GLU CD 1 1 7 3901 1 1 10 GLU CG C -11.014 -10.865 3.105 1.00 . A A . 10 GLU CG 1 1 7 3902 1 1 10 GLU H H -9.491 -11.596 0.502 1.00 . A A . 10 GLU H 1 1 7 3903 1 1 10 GLU HA H -9.782 -8.939 1.629 1.00 . A A . 10 GLU HA 1 1 7 3904 1 1 10 GLU HB2 H -9.035 -11.595 2.859 1.00 . A A . 10 GLU HB2 1 1 7 3905 1 1 10 GLU HB3 H -9.150 -10.095 3.769 1.00 . A A . 10 GLU HB3 1 1 7 3906 1 1 10 GLU HG2 H -11.217 -10.949 4.162 1.00 . A A . 10 GLU HG2 1 1 7 3907 1 1 10 GLU HG3 H -11.552 -10.019 2.703 1.00 . A A . 10 GLU HG3 1 1 7 3908 1 1 10 GLU N N -9.518 -10.617 0.457 1.00 . A A . 10 GLU N 1 1 7 3909 1 1 10 GLU O O -6.867 -10.177 1.120 1.00 . A A . 10 GLU O 1 1 7 3910 1 1 10 GLU OE1 O -10.820 -12.594 1.483 1.00 . A A . 10 GLU OE1 1 1 7 3911 1 1 10 GLU OE2 O -12.570 -12.640 2.812 1.00 . A A . 10 GLU OE2 1 1 7 3912 1 1 11 LYS C C -5.412 -7.730 0.945 1.00 . A A . 11 LYS C 1 1 7 3913 1 1 11 LYS CA C -6.032 -7.831 2.335 1.00 . A A . 11 LYS CA 1 1 7 3914 1 1 11 LYS CB C -5.192 -8.760 3.214 1.00 . A A . 11 LYS CB 1 1 7 3915 1 1 11 LYS CD C -5.053 -10.176 5.284 1.00 . A A . 11 LYS CD 1 1 7 3916 1 1 11 LYS CE C -5.868 -11.069 6.206 1.00 . A A . 11 LYS CE 1 1 7 3917 1 1 11 LYS CG C -5.947 -9.313 4.409 1.00 . A A . 11 LYS CG 1 1 7 3918 1 1 11 LYS H H -8.123 -7.781 2.664 1.00 . A A . 11 LYS H 1 1 7 3919 1 1 11 LYS HA H -6.050 -6.847 2.779 1.00 . A A . 11 LYS HA 1 1 7 3920 1 1 11 LYS HB2 H -4.850 -9.591 2.614 1.00 . A A . 11 LYS HB2 1 1 7 3921 1 1 11 LYS HB3 H -4.334 -8.213 3.578 1.00 . A A . 11 LYS HB3 1 1 7 3922 1 1 11 LYS HD2 H -4.437 -10.798 4.652 1.00 . A A . 11 LYS HD2 1 1 7 3923 1 1 11 LYS HD3 H -4.423 -9.534 5.883 1.00 . A A . 11 LYS HD3 1 1 7 3924 1 1 11 LYS HE2 H -6.179 -10.492 7.063 1.00 . A A . 11 LYS HE2 1 1 7 3925 1 1 11 LYS HE3 H -6.740 -11.417 5.670 1.00 . A A . 11 LYS HE3 1 1 7 3926 1 1 11 LYS HG2 H -6.323 -8.490 4.999 1.00 . A A . 11 LYS HG2 1 1 7 3927 1 1 11 LYS HG3 H -6.775 -9.912 4.055 1.00 . A A . 11 LYS HG3 1 1 7 3928 1 1 11 LYS HZ1 H -4.697 -12.064 7.621 1.00 . A A . 11 LYS HZ1 1 1 7 3929 1 1 11 LYS HZ2 H -4.299 -12.435 6.018 1.00 . A A . 11 LYS HZ2 1 1 7 3930 1 1 11 LYS HZ3 H -5.695 -13.087 6.716 1.00 . A A . 11 LYS HZ3 1 1 7 3931 1 1 11 LYS N N -7.406 -8.313 2.257 1.00 . A A . 11 LYS N 1 1 7 3932 1 1 11 LYS NZ N -5.085 -12.246 6.673 1.00 . A A . 11 LYS NZ 1 1 7 3933 1 1 11 LYS O O -4.268 -8.125 0.719 1.00 . A A . 11 LYS O 1 1 7 3934 1 1 12 PRO C C -4.645 -5.955 -1.524 1.00 . A A . 12 PRO C 1 1 7 3935 1 1 12 PRO CA C -5.727 -7.021 -1.394 1.00 . A A . 12 PRO CA 1 1 7 3936 1 1 12 PRO CB C -6.996 -6.589 -2.134 1.00 . A A . 12 PRO CB 1 1 7 3937 1 1 12 PRO CD C -7.555 -6.695 0.187 1.00 . A A . 12 PRO CD 1 1 7 3938 1 1 12 PRO CG C -7.847 -5.956 -1.089 1.00 . A A . 12 PRO CG 1 1 7 3939 1 1 12 PRO HA H -5.366 -7.952 -1.808 1.00 . A A . 12 PRO HA 1 1 7 3940 1 1 12 PRO HB2 H -6.738 -5.887 -2.915 1.00 . A A . 12 PRO HB2 1 1 7 3941 1 1 12 PRO HB3 H -7.478 -7.454 -2.565 1.00 . A A . 12 PRO HB3 1 1 7 3942 1 1 12 PRO HD2 H -7.607 -6.025 1.032 1.00 . A A . 12 PRO HD2 1 1 7 3943 1 1 12 PRO HD3 H -8.245 -7.517 0.313 1.00 . A A . 12 PRO HD3 1 1 7 3944 1 1 12 PRO HG2 H -7.587 -4.913 -0.986 1.00 . A A . 12 PRO HG2 1 1 7 3945 1 1 12 PRO HG3 H -8.889 -6.060 -1.352 1.00 . A A . 12 PRO HG3 1 1 7 3946 1 1 12 PRO N N -6.182 -7.188 -0.010 1.00 . A A . 12 PRO N 1 1 7 3947 1 1 12 PRO O O -4.188 -5.652 -2.627 1.00 . A A . 12 PRO O 1 1 7 3948 1 1 13 TYR C C -2.029 -4.772 0.490 1.00 . A A . 13 TYR C 1 1 7 3949 1 1 13 TYR CA C -3.211 -4.356 -0.381 1.00 . A A . 13 TYR CA 1 1 7 3950 1 1 13 TYR CB C -3.793 -3.035 0.126 1.00 . A A . 13 TYR CB 1 1 7 3951 1 1 13 TYR CD1 C -5.082 -2.017 -1.791 1.00 . A A . 13 TYR CD1 1 1 7 3952 1 1 13 TYR CD2 C -6.313 -2.901 0.048 1.00 . A A . 13 TYR CD2 1 1 7 3953 1 1 13 TYR CE1 C -6.262 -1.656 -2.413 1.00 . A A . 13 TYR CE1 1 1 7 3954 1 1 13 TYR CE2 C -7.498 -2.546 -0.567 1.00 . A A . 13 TYR CE2 1 1 7 3955 1 1 13 TYR CG C -5.086 -2.643 -0.552 1.00 . A A . 13 TYR CG 1 1 7 3956 1 1 13 TYR CZ C -7.467 -1.923 -1.798 1.00 . A A . 13 TYR CZ 1 1 7 3957 1 1 13 TYR H H -4.640 -5.674 0.455 1.00 . A A . 13 TYR H 1 1 7 3958 1 1 13 TYR HA H -2.866 -4.220 -1.396 1.00 . A A . 13 TYR HA 1 1 7 3959 1 1 13 TYR HB2 H -3.985 -3.117 1.185 1.00 . A A . 13 TYR HB2 1 1 7 3960 1 1 13 TYR HB3 H -3.076 -2.245 -0.044 1.00 . A A . 13 TYR HB3 1 1 7 3961 1 1 13 TYR HD1 H -4.137 -1.809 -2.271 1.00 . A A . 13 TYR HD1 1 1 7 3962 1 1 13 TYR HD2 H -6.334 -3.389 1.012 1.00 . A A . 13 TYR HD2 1 1 7 3963 1 1 13 TYR HE1 H -6.238 -1.169 -3.377 1.00 . A A . 13 TYR HE1 1 1 7 3964 1 1 13 TYR HE2 H -8.442 -2.754 -0.085 1.00 . A A . 13 TYR HE2 1 1 7 3965 1 1 13 TYR HH H -8.464 -0.914 -3.095 1.00 . A A . 13 TYR HH 1 1 7 3966 1 1 13 TYR N N -4.239 -5.390 -0.393 1.00 . A A . 13 TYR N 1 1 7 3967 1 1 13 TYR O O -2.203 -5.172 1.640 1.00 . A A . 13 TYR O 1 1 7 3968 1 1 13 TYR OH O -8.644 -1.567 -2.415 1.00 . A A . 13 TYR OH 1 1 7 3969 1 1 14 GLU C C 1.596 -4.296 0.101 1.00 . A A . 14 GLU C 1 1 7 3970 1 1 14 GLU CA C 0.384 -5.039 0.656 1.00 . A A . 14 GLU CA 1 1 7 3971 1 1 14 GLU CB C 0.617 -6.549 0.575 1.00 . A A . 14 GLU CB 1 1 7 3972 1 1 14 GLU CD C 1.744 -8.580 1.569 1.00 . A A . 14 GLU CD 1 1 7 3973 1 1 14 GLU CG C 1.460 -7.097 1.713 1.00 . A A . 14 GLU CG 1 1 7 3974 1 1 14 GLU H H -0.753 -4.347 -0.990 1.00 . A A . 14 GLU H 1 1 7 3975 1 1 14 GLU HA H 0.248 -4.760 1.690 1.00 . A A . 14 GLU HA 1 1 7 3976 1 1 14 GLU HB2 H -0.340 -7.050 0.589 1.00 . A A . 14 GLU HB2 1 1 7 3977 1 1 14 GLU HB3 H 1.117 -6.774 -0.356 1.00 . A A . 14 GLU HB3 1 1 7 3978 1 1 14 GLU HG2 H 2.401 -6.567 1.735 1.00 . A A . 14 GLU HG2 1 1 7 3979 1 1 14 GLU HG3 H 0.936 -6.935 2.644 1.00 . A A . 14 GLU HG3 1 1 7 3980 1 1 14 GLU N N -0.827 -4.673 -0.069 1.00 . A A . 14 GLU N 1 1 7 3981 1 1 14 GLU O O 1.692 -4.053 -1.102 1.00 . A A . 14 GLU O 1 1 7 3982 1 1 14 GLU OE1 O 1.688 -9.086 0.429 1.00 . A A . 14 GLU OE1 1 1 7 3983 1 1 14 GLU OE2 O 2.022 -9.233 2.596 1.00 . A A . 14 GLU OE2 1 1 7 3984 1 1 15 CYS C C 4.648 -4.121 -0.225 1.00 . A A . 15 CYS C 1 1 7 3985 1 1 15 CYS CA C 3.724 -3.220 0.589 1.00 . A A . 15 CYS CA 1 1 7 3986 1 1 15 CYS CB C 4.462 -2.695 1.823 1.00 . A A . 15 CYS CB 1 1 7 3987 1 1 15 CYS H H 2.385 -4.158 1.934 1.00 . A A . 15 CYS H 1 1 7 3988 1 1 15 CYS HA H 3.426 -2.383 -0.024 1.00 . A A . 15 CYS HA 1 1 7 3989 1 1 15 CYS HB2 H 3.743 -2.497 2.605 1.00 . A A . 15 CYS HB2 1 1 7 3990 1 1 15 CYS HB3 H 5.158 -3.448 2.163 1.00 . A A . 15 CYS HB3 1 1 7 3991 1 1 15 CYS N N 2.518 -3.936 0.988 1.00 . A A . 15 CYS N 1 1 7 3992 1 1 15 CYS O O 4.342 -5.289 -0.462 1.00 . A A . 15 CYS O 1 1 7 3993 1 1 15 CYS SG S 5.400 -1.162 1.531 1.00 . A A . 15 CYS SG 1 1 7 3994 1 1 16 ASP C C 8.106 -4.353 -0.741 1.00 . A A . 16 ASP C 1 1 7 3995 1 1 16 ASP CA C 6.749 -4.322 -1.437 1.00 . A A . 16 ASP CA 1 1 7 3996 1 1 16 ASP CB C 6.891 -3.711 -2.832 1.00 . A A . 16 ASP CB 1 1 7 3997 1 1 16 ASP CG C 7.665 -4.606 -3.780 1.00 . A A . 16 ASP CG 1 1 7 3998 1 1 16 ASP H H 5.966 -2.632 -0.429 1.00 . A A . 16 ASP H 1 1 7 3999 1 1 16 ASP HA H 6.385 -5.333 -1.532 1.00 . A A . 16 ASP HA 1 1 7 4000 1 1 16 ASP HB2 H 5.907 -3.544 -3.246 1.00 . A A . 16 ASP HB2 1 1 7 4001 1 1 16 ASP HB3 H 7.409 -2.766 -2.753 1.00 . A A . 16 ASP HB3 1 1 7 4002 1 1 16 ASP N N 5.779 -3.569 -0.650 1.00 . A A . 16 ASP N 1 1 7 4003 1 1 16 ASP O O 8.716 -5.412 -0.593 1.00 . A A . 16 ASP O 1 1 7 4004 1 1 16 ASP OD1 O 7.149 -5.689 -4.128 1.00 . A A . 16 ASP OD1 1 1 7 4005 1 1 16 ASP OD2 O 8.785 -4.223 -4.175 1.00 . A A . 16 ASP OD2 1 1 7 4006 1 1 17 VAL C C 9.859 -3.867 1.668 1.00 . A A . 17 VAL C 1 1 7 4007 1 1 17 VAL CA C 9.860 -3.076 0.364 1.00 . A A . 17 VAL CA 1 1 7 4008 1 1 17 VAL CB C 10.213 -1.608 0.667 1.00 . A A . 17 VAL CB 1 1 7 4009 1 1 17 VAL CG1 C 11.514 -1.523 1.452 1.00 . A A . 17 VAL CG1 1 1 7 4010 1 1 17 VAL CG2 C 10.305 -0.806 -0.622 1.00 . A A . 17 VAL CG2 1 1 7 4011 1 1 17 VAL H H 8.042 -2.374 -0.463 1.00 . A A . 17 VAL H 1 1 7 4012 1 1 17 VAL HA H 10.619 -3.480 -0.290 1.00 . A A . 17 VAL HA 1 1 7 4013 1 1 17 VAL HB H 9.425 -1.186 1.273 1.00 . A A . 17 VAL HB 1 1 7 4014 1 1 17 VAL HG11 H 11.911 -2.517 1.599 1.00 . A A . 17 VAL HG11 1 1 7 4015 1 1 17 VAL HG12 H 12.227 -0.926 0.903 1.00 . A A . 17 VAL HG12 1 1 7 4016 1 1 17 VAL HG13 H 11.325 -1.066 2.412 1.00 . A A . 17 VAL HG13 1 1 7 4017 1 1 17 VAL HG21 H 11.110 -1.192 -1.230 1.00 . A A . 17 VAL HG21 1 1 7 4018 1 1 17 VAL HG22 H 9.374 -0.886 -1.162 1.00 . A A . 17 VAL HG22 1 1 7 4019 1 1 17 VAL HG23 H 10.497 0.232 -0.388 1.00 . A A . 17 VAL HG23 1 1 7 4020 1 1 17 VAL N N 8.574 -3.183 -0.316 1.00 . A A . 17 VAL N 1 1 7 4021 1 1 17 VAL O O 10.752 -4.678 1.915 1.00 . A A . 17 VAL O 1 1 7 4022 1 1 18 CYS C C 7.736 -5.467 3.686 1.00 . A A . 18 CYS C 1 1 7 4023 1 1 18 CYS CA C 8.733 -4.315 3.779 1.00 . A A . 18 CYS CA 1 1 7 4024 1 1 18 CYS CB C 8.297 -3.336 4.871 1.00 . A A . 18 CYS CB 1 1 7 4025 1 1 18 CYS H H 8.169 -2.968 2.246 1.00 . A A . 18 CYS H 1 1 7 4026 1 1 18 CYS HA H 9.703 -4.714 4.032 1.00 . A A . 18 CYS HA 1 1 7 4027 1 1 18 CYS HB2 H 8.423 -3.805 5.835 1.00 . A A . 18 CYS HB2 1 1 7 4028 1 1 18 CYS HB3 H 8.919 -2.454 4.822 1.00 . A A . 18 CYS HB3 1 1 7 4029 1 1 18 CYS N N 8.851 -3.626 2.499 1.00 . A A . 18 CYS N 1 1 7 4030 1 1 18 CYS O O 7.763 -6.391 4.498 1.00 . A A . 18 CYS O 1 1 7 4031 1 1 18 CYS SG S 6.561 -2.799 4.739 1.00 . A A . 18 CYS SG 1 1 7 4032 1 1 19 ARG C C 4.902 -6.511 3.683 1.00 . A A . 19 ARG C 1 1 7 4033 1 1 19 ARG CA C 5.852 -6.440 2.492 1.00 . A A . 19 ARG CA 1 1 7 4034 1 1 19 ARG CB C 6.524 -7.798 2.279 1.00 . A A . 19 ARG CB 1 1 7 4035 1 1 19 ARG CD C 6.473 -8.027 -0.223 1.00 . A A . 19 ARG CD 1 1 7 4036 1 1 19 ARG CG C 7.353 -7.875 1.008 1.00 . A A . 19 ARG CG 1 1 7 4037 1 1 19 ARG CZ C 5.052 -9.800 -1.162 1.00 . A A . 19 ARG CZ 1 1 7 4038 1 1 19 ARG H H 6.887 -4.641 2.075 1.00 . A A . 19 ARG H 1 1 7 4039 1 1 19 ARG HA H 5.285 -6.187 1.609 1.00 . A A . 19 ARG HA 1 1 7 4040 1 1 19 ARG HB2 H 7.173 -8.001 3.119 1.00 . A A . 19 ARG HB2 1 1 7 4041 1 1 19 ARG HB3 H 5.760 -8.560 2.232 1.00 . A A . 19 ARG HB3 1 1 7 4042 1 1 19 ARG HD2 H 5.564 -7.464 -0.070 1.00 . A A . 19 ARG HD2 1 1 7 4043 1 1 19 ARG HD3 H 7.001 -7.631 -1.077 1.00 . A A . 19 ARG HD3 1 1 7 4044 1 1 19 ARG HE H 6.730 -10.111 -0.129 1.00 . A A . 19 ARG HE 1 1 7 4045 1 1 19 ARG HG2 H 7.934 -6.970 0.912 1.00 . A A . 19 ARG HG2 1 1 7 4046 1 1 19 ARG HG3 H 8.016 -8.725 1.073 1.00 . A A . 19 ARG HG3 1 1 7 4047 1 1 19 ARG HH11 H 4.403 -7.918 -1.507 1.00 . A A . 19 ARG HH11 1 1 7 4048 1 1 19 ARG HH12 H 3.410 -9.177 -2.163 1.00 . A A . 19 ARG HH12 1 1 7 4049 1 1 19 ARG HH21 H 5.432 -11.778 -0.989 1.00 . A A . 19 ARG HH21 1 1 7 4050 1 1 19 ARG HH22 H 3.996 -11.372 -1.868 1.00 . A A . 19 ARG HH22 1 1 7 4051 1 1 19 ARG N N 6.858 -5.403 2.690 1.00 . A A . 19 ARG N 1 1 7 4052 1 1 19 ARG NE N 6.128 -9.422 -0.481 1.00 . A A . 19 ARG NE 1 1 7 4053 1 1 19 ARG NH1 N 4.220 -8.891 -1.650 1.00 . A A . 19 ARG NH1 1 1 7 4054 1 1 19 ARG NH2 N 4.806 -11.089 -1.356 1.00 . A A . 19 ARG NH2 1 1 7 4055 1 1 19 ARG O O 4.663 -7.584 4.238 1.00 . A A . 19 ARG O 1 1 7 4056 1 1 20 LYS C C 1.993 -5.410 4.723 1.00 . A A . 20 LYS C 1 1 7 4057 1 1 20 LYS CA C 3.438 -5.291 5.198 1.00 . A A . 20 LYS CA 1 1 7 4058 1 1 20 LYS CB C 3.629 -3.978 5.961 1.00 . A A . 20 LYS CB 1 1 7 4059 1 1 20 LYS CD C 3.376 -2.819 8.175 1.00 . A A . 20 LYS CD 1 1 7 4060 1 1 20 LYS CE C 2.425 -2.549 9.331 1.00 . A A . 20 LYS CE 1 1 7 4061 1 1 20 LYS CG C 2.846 -3.911 7.261 1.00 . A A . 20 LYS CG 1 1 7 4062 1 1 20 LYS H H 4.592 -4.538 3.591 1.00 . A A . 20 LYS H 1 1 7 4063 1 1 20 LYS HA H 3.656 -6.117 5.858 1.00 . A A . 20 LYS HA 1 1 7 4064 1 1 20 LYS HB2 H 4.678 -3.858 6.190 1.00 . A A . 20 LYS HB2 1 1 7 4065 1 1 20 LYS HB3 H 3.311 -3.160 5.331 1.00 . A A . 20 LYS HB3 1 1 7 4066 1 1 20 LYS HD2 H 4.331 -3.128 8.575 1.00 . A A . 20 LYS HD2 1 1 7 4067 1 1 20 LYS HD3 H 3.501 -1.911 7.602 1.00 . A A . 20 LYS HD3 1 1 7 4068 1 1 20 LYS HE2 H 2.564 -1.532 9.664 1.00 . A A . 20 LYS HE2 1 1 7 4069 1 1 20 LYS HE3 H 1.411 -2.678 8.982 1.00 . A A . 20 LYS HE3 1 1 7 4070 1 1 20 LYS HG2 H 1.810 -3.706 7.037 1.00 . A A . 20 LYS HG2 1 1 7 4071 1 1 20 LYS HG3 H 2.925 -4.862 7.768 1.00 . A A . 20 LYS HG3 1 1 7 4072 1 1 20 LYS HZ1 H 1.761 -3.747 10.908 1.00 . A A . 20 LYS HZ1 1 1 7 4073 1 1 20 LYS HZ2 H 3.254 -3.002 11.193 1.00 . A A . 20 LYS HZ2 1 1 7 4074 1 1 20 LYS HZ3 H 3.156 -4.327 10.147 1.00 . A A . 20 LYS HZ3 1 1 7 4075 1 1 20 LYS N N 4.363 -5.361 4.073 1.00 . A A . 20 LYS N 1 1 7 4076 1 1 20 LYS NZ N 2.666 -3.471 10.475 1.00 . A A . 20 LYS NZ 1 1 7 4077 1 1 20 LYS O O 1.662 -5.010 3.607 1.00 . A A . 20 LYS O 1 1 7 4078 1 1 21 ALA C C -1.114 -5.007 5.847 1.00 . A A . 21 ALA C 1 1 7 4079 1 1 21 ALA CA C -0.272 -6.127 5.246 1.00 . A A . 21 ALA CA 1 1 7 4080 1 1 21 ALA CB C -0.771 -7.481 5.729 1.00 . A A . 21 ALA CB 1 1 7 4081 1 1 21 ALA H H 1.461 -6.259 6.453 1.00 . A A . 21 ALA H 1 1 7 4082 1 1 21 ALA HA H -0.368 -6.098 4.170 1.00 . A A . 21 ALA HA 1 1 7 4083 1 1 21 ALA HB1 H -1.639 -7.342 6.356 1.00 . A A . 21 ALA HB1 1 1 7 4084 1 1 21 ALA HB2 H -1.035 -8.091 4.877 1.00 . A A . 21 ALA HB2 1 1 7 4085 1 1 21 ALA HB3 H 0.008 -7.971 6.295 1.00 . A A . 21 ALA HB3 1 1 7 4086 1 1 21 ALA N N 1.137 -5.960 5.578 1.00 . A A . 21 ALA N 1 1 7 4087 1 1 21 ALA O O -0.848 -4.543 6.956 1.00 . A A . 21 ALA O 1 1 7 4088 1 1 22 PHE C C -4.470 -3.840 5.272 1.00 . A A . 22 PHE C 1 1 7 4089 1 1 22 PHE CA C -3.011 -3.507 5.568 1.00 . A A . 22 PHE CA 1 1 7 4090 1 1 22 PHE CB C -2.633 -2.183 4.900 1.00 . A A . 22 PHE CB 1 1 7 4091 1 1 22 PHE CD1 C -0.275 -2.399 4.069 1.00 . A A . 22 PHE CD1 1 1 7 4092 1 1 22 PHE CD2 C -0.683 -1.034 5.982 1.00 . A A . 22 PHE CD2 1 1 7 4093 1 1 22 PHE CE1 C 1.074 -2.108 4.145 1.00 . A A . 22 PHE CE1 1 1 7 4094 1 1 22 PHE CE2 C 0.665 -0.739 6.062 1.00 . A A . 22 PHE CE2 1 1 7 4095 1 1 22 PHE CG C -1.168 -1.865 4.985 1.00 . A A . 22 PHE CG 1 1 7 4096 1 1 22 PHE CZ C 1.545 -1.278 5.143 1.00 . A A . 22 PHE CZ 1 1 7 4097 1 1 22 PHE H H -2.292 -4.984 4.232 1.00 . A A . 22 PHE H 1 1 7 4098 1 1 22 PHE HA H -2.885 -3.411 6.635 1.00 . A A . 22 PHE HA 1 1 7 4099 1 1 22 PHE HB2 H -2.903 -2.225 3.855 1.00 . A A . 22 PHE HB2 1 1 7 4100 1 1 22 PHE HB3 H -3.176 -1.381 5.376 1.00 . A A . 22 PHE HB3 1 1 7 4101 1 1 22 PHE HD1 H -0.643 -3.049 3.288 1.00 . A A . 22 PHE HD1 1 1 7 4102 1 1 22 PHE HD2 H -1.369 -0.613 6.702 1.00 . A A . 22 PHE HD2 1 1 7 4103 1 1 22 PHE HE1 H 1.759 -2.531 3.425 1.00 . A A . 22 PHE HE1 1 1 7 4104 1 1 22 PHE HE2 H 1.031 -0.090 6.844 1.00 . A A . 22 PHE HE2 1 1 7 4105 1 1 22 PHE HZ H 2.598 -1.049 5.203 1.00 . A A . 22 PHE HZ 1 1 7 4106 1 1 22 PHE N N -2.131 -4.575 5.108 1.00 . A A . 22 PHE N 1 1 7 4107 1 1 22 PHE O O -4.777 -4.525 4.297 1.00 . A A . 22 PHE O 1 1 7 4108 1 1 23 SER C C -7.431 -2.537 5.066 1.00 . A A . 23 SER C 1 1 7 4109 1 1 23 SER CA C -6.794 -3.600 5.957 1.00 . A A . 23 SER CA 1 1 7 4110 1 1 23 SER CB C -7.491 -3.624 7.319 1.00 . A A . 23 SER CB 1 1 7 4111 1 1 23 SER H H -5.060 -2.811 6.882 1.00 . A A . 23 SER H 1 1 7 4112 1 1 23 SER HA H -6.910 -4.564 5.485 1.00 . A A . 23 SER HA 1 1 7 4113 1 1 23 SER HB2 H -7.072 -4.416 7.920 1.00 . A A . 23 SER HB2 1 1 7 4114 1 1 23 SER HB3 H -7.339 -2.677 7.815 1.00 . A A . 23 SER HB3 1 1 7 4115 1 1 23 SER HG H -9.049 -4.318 6.355 1.00 . A A . 23 SER HG 1 1 7 4116 1 1 23 SER N N -5.367 -3.351 6.123 1.00 . A A . 23 SER N 1 1 7 4117 1 1 23 SER O O -8.212 -2.851 4.167 1.00 . A A . 23 SER O 1 1 7 4118 1 1 23 SER OG O -8.883 -3.848 7.175 1.00 . A A . 23 SER OG 1 1 7 4119 1 1 24 HIS C C -6.613 0.314 3.512 1.00 . A A . 24 HIS C 1 1 7 4120 1 1 24 HIS CA C -7.628 -0.167 4.545 1.00 . A A . 24 HIS CA 1 1 7 4121 1 1 24 HIS CB C -8.021 0.987 5.468 1.00 . A A . 24 HIS CB 1 1 7 4122 1 1 24 HIS CD2 C -10.307 1.733 4.495 1.00 . A A . 24 HIS CD2 1 1 7 4123 1 1 24 HIS CE1 C -9.798 3.817 4.044 1.00 . A A . 24 HIS CE1 1 1 7 4124 1 1 24 HIS CG C -9.018 1.926 4.862 1.00 . A A . 24 HIS CG 1 1 7 4125 1 1 24 HIS H H -6.464 -1.091 6.052 1.00 . A A . 24 HIS H 1 1 7 4126 1 1 24 HIS HA H -8.509 -0.519 4.029 1.00 . A A . 24 HIS HA 1 1 7 4127 1 1 24 HIS HB2 H -8.452 0.585 6.373 1.00 . A A . 24 HIS HB2 1 1 7 4128 1 1 24 HIS HB3 H -7.137 1.556 5.717 1.00 . A A . 24 HIS HB3 1 1 7 4129 1 1 24 HIS HD1 H -7.870 3.687 4.716 1.00 . A A . 24 HIS HD1 1 1 7 4130 1 1 24 HIS HD2 H -10.868 0.813 4.584 1.00 . A A . 24 HIS HD2 1 1 7 4131 1 1 24 HIS HE1 H -9.867 4.844 3.717 1.00 . A A . 24 HIS HE1 1 1 7 4132 1 1 24 HIS N N -7.091 -1.278 5.323 1.00 . A A . 24 HIS N 1 1 7 4133 1 1 24 HIS ND1 N -8.730 3.241 4.565 1.00 . A A . 24 HIS ND1 1 1 7 4134 1 1 24 HIS NE2 N -10.769 2.923 3.990 1.00 . A A . 24 HIS NE2 1 1 7 4135 1 1 24 HIS O O -5.483 0.662 3.853 1.00 . A A . 24 HIS O 1 1 7 4136 1 1 25 HIS C C -5.342 1.993 1.582 1.00 . A A . 25 HIS C 1 1 7 4137 1 1 25 HIS CA C -6.151 0.768 1.166 1.00 . A A . 25 HIS CA 1 1 7 4138 1 1 25 HIS CB C -6.973 1.086 -0.084 1.00 . A A . 25 HIS CB 1 1 7 4139 1 1 25 HIS CD2 C -8.207 3.367 -0.109 1.00 . A A . 25 HIS CD2 1 1 7 4140 1 1 25 HIS CE1 C -10.073 2.733 0.852 1.00 . A A . 25 HIS CE1 1 1 7 4141 1 1 25 HIS CG C -8.095 2.047 0.165 1.00 . A A . 25 HIS CG 1 1 7 4142 1 1 25 HIS H H -7.937 0.041 2.039 1.00 . A A . 25 HIS H 1 1 7 4143 1 1 25 HIS HA H -5.470 -0.039 0.942 1.00 . A A . 25 HIS HA 1 1 7 4144 1 1 25 HIS HB2 H -6.325 1.520 -0.832 1.00 . A A . 25 HIS HB2 1 1 7 4145 1 1 25 HIS HB3 H -7.398 0.171 -0.470 1.00 . A A . 25 HIS HB3 1 1 7 4146 1 1 25 HIS HD1 H -9.506 0.781 1.084 1.00 . A A . 25 HIS HD1 1 1 7 4147 1 1 25 HIS HD2 H -7.461 3.990 -0.583 1.00 . A A . 25 HIS HD2 1 1 7 4148 1 1 25 HIS HE1 H -11.065 2.745 1.277 1.00 . A A . 25 HIS HE1 1 1 7 4149 1 1 25 HIS N N -7.025 0.330 2.248 1.00 . A A . 25 HIS N 1 1 7 4150 1 1 25 HIS ND1 N -9.279 1.680 0.767 1.00 . A A . 25 HIS ND1 1 1 7 4151 1 1 25 HIS NE2 N -9.445 3.770 0.327 1.00 . A A . 25 HIS NE2 1 1 7 4152 1 1 25 HIS O O -4.142 2.073 1.323 1.00 . A A . 25 HIS O 1 1 7 4153 1 1 26 ALA C C -4.100 3.844 3.493 1.00 . A A . 26 ALA C 1 1 7 4154 1 1 26 ALA CA C -5.351 4.164 2.681 1.00 . A A . 26 ALA CA 1 1 7 4155 1 1 26 ALA CB C -6.314 5.008 3.503 1.00 . A A . 26 ALA CB 1 1 7 4156 1 1 26 ALA H H -6.964 2.823 2.405 1.00 . A A . 26 ALA H 1 1 7 4157 1 1 26 ALA HA H -5.066 4.734 1.808 1.00 . A A . 26 ALA HA 1 1 7 4158 1 1 26 ALA HB1 H -6.085 6.054 3.363 1.00 . A A . 26 ALA HB1 1 1 7 4159 1 1 26 ALA HB2 H -7.327 4.815 3.180 1.00 . A A . 26 ALA HB2 1 1 7 4160 1 1 26 ALA HB3 H -6.214 4.754 4.547 1.00 . A A . 26 ALA HB3 1 1 7 4161 1 1 26 ALA N N -6.008 2.944 2.228 1.00 . A A . 26 ALA N 1 1 7 4162 1 1 26 ALA O O -3.015 4.348 3.203 1.00 . A A . 26 ALA O 1 1 7 4163 1 1 27 SER C C -1.885 2.371 4.541 1.00 . A A . 27 SER C 1 1 7 4164 1 1 27 SER CA C -3.143 2.622 5.367 1.00 . A A . 27 SER CA 1 1 7 4165 1 1 27 SER CB C -3.496 1.370 6.172 1.00 . A A . 27 SER CB 1 1 7 4166 1 1 27 SER H H -5.149 2.636 4.691 1.00 . A A . 27 SER H 1 1 7 4167 1 1 27 SER HA H -2.954 3.437 6.050 1.00 . A A . 27 SER HA 1 1 7 4168 1 1 27 SER HB2 H -3.697 0.554 5.494 1.00 . A A . 27 SER HB2 1 1 7 4169 1 1 27 SER HB3 H -2.665 1.110 6.812 1.00 . A A . 27 SER HB3 1 1 7 4170 1 1 27 SER HG H -4.602 2.466 7.361 1.00 . A A . 27 SER HG 1 1 7 4171 1 1 27 SER N N -4.259 3.005 4.511 1.00 . A A . 27 SER N 1 1 7 4172 1 1 27 SER O O -0.766 2.566 5.017 1.00 . A A . 27 SER O 1 1 7 4173 1 1 27 SER OG O -4.642 1.587 6.977 1.00 . A A . 27 SER OG 1 1 7 4174 1 1 28 LEU C C -0.450 2.940 1.755 1.00 . A A . 28 LEU C 1 1 7 4175 1 1 28 LEU CA C -0.960 1.658 2.405 1.00 . A A . 28 LEU CA 1 1 7 4176 1 1 28 LEU CB C -1.381 0.658 1.327 1.00 . A A . 28 LEU CB 1 1 7 4177 1 1 28 LEU CD1 C 0.785 -0.595 1.183 1.00 . A A . 28 LEU CD1 1 1 7 4178 1 1 28 LEU CD2 C -0.848 -0.706 -0.708 1.00 . A A . 28 LEU CD2 1 1 7 4179 1 1 28 LEU CG C -0.271 0.166 0.397 1.00 . A A . 28 LEU CG 1 1 7 4180 1 1 28 LEU H H -2.992 1.800 2.977 1.00 . A A . 28 LEU H 1 1 7 4181 1 1 28 LEU HA H -0.164 1.227 2.994 1.00 . A A . 28 LEU HA 1 1 7 4182 1 1 28 LEU HB2 H -1.803 -0.203 1.821 1.00 . A A . 28 LEU HB2 1 1 7 4183 1 1 28 LEU HB3 H -2.139 1.129 0.718 1.00 . A A . 28 LEU HB3 1 1 7 4184 1 1 28 LEU HD11 H 1.629 -0.804 0.544 1.00 . A A . 28 LEU HD11 1 1 7 4185 1 1 28 LEU HD12 H 0.367 -1.524 1.542 1.00 . A A . 28 LEU HD12 1 1 7 4186 1 1 28 LEU HD13 H 1.108 0.001 2.024 1.00 . A A . 28 LEU HD13 1 1 7 4187 1 1 28 LEU HD21 H -0.425 -0.412 -1.657 1.00 . A A . 28 LEU HD21 1 1 7 4188 1 1 28 LEU HD22 H -1.921 -0.585 -0.738 1.00 . A A . 28 LEU HD22 1 1 7 4189 1 1 28 LEU HD23 H -0.609 -1.741 -0.511 1.00 . A A . 28 LEU HD23 1 1 7 4190 1 1 28 LEU HG H 0.208 1.019 -0.064 1.00 . A A . 28 LEU HG 1 1 7 4191 1 1 28 LEU N N -2.077 1.937 3.300 1.00 . A A . 28 LEU N 1 1 7 4192 1 1 28 LEU O O 0.717 3.303 1.902 1.00 . A A . 28 LEU O 1 1 7 4193 1 1 29 THR C C -0.287 5.832 1.322 1.00 . A A . 29 THR C 1 1 7 4194 1 1 29 THR CA C -0.976 4.867 0.363 1.00 . A A . 29 THR CA 1 1 7 4195 1 1 29 THR CB C -2.214 5.558 -0.240 1.00 . A A . 29 THR CB 1 1 7 4196 1 1 29 THR CG2 C -2.932 6.394 0.809 1.00 . A A . 29 THR CG2 1 1 7 4197 1 1 29 THR H H -2.250 3.284 0.956 1.00 . A A . 29 THR H 1 1 7 4198 1 1 29 THR HA H -0.296 4.627 -0.441 1.00 . A A . 29 THR HA 1 1 7 4199 1 1 29 THR HB H -2.892 4.797 -0.599 1.00 . A A . 29 THR HB 1 1 7 4200 1 1 29 THR HG1 H -2.608 6.707 -1.793 1.00 . A A . 29 THR HG1 1 1 7 4201 1 1 29 THR HG21 H -3.995 6.221 0.740 1.00 . A A . 29 THR HG21 1 1 7 4202 1 1 29 THR HG22 H -2.725 7.440 0.638 1.00 . A A . 29 THR HG22 1 1 7 4203 1 1 29 THR HG23 H -2.584 6.114 1.792 1.00 . A A . 29 THR HG23 1 1 7 4204 1 1 29 THR N N -1.335 3.625 1.036 1.00 . A A . 29 THR N 1 1 7 4205 1 1 29 THR O O 0.427 6.739 0.896 1.00 . A A . 29 THR O 1 1 7 4206 1 1 29 THR OG1 O -1.824 6.391 -1.337 1.00 . A A . 29 THR OG1 1 1 7 4207 1 1 30 GLN C C 1.421 5.901 4.119 1.00 . A A . 30 GLN C 1 1 7 4208 1 1 30 GLN CA C 0.097 6.481 3.636 1.00 . A A . 30 GLN CA 1 1 7 4209 1 1 30 GLN CB C -0.860 6.653 4.817 1.00 . A A . 30 GLN CB 1 1 7 4210 1 1 30 GLN CD C -3.101 7.641 5.437 1.00 . A A . 30 GLN CD 1 1 7 4211 1 1 30 GLN CG C -1.810 7.829 4.664 1.00 . A A . 30 GLN CG 1 1 7 4212 1 1 30 GLN H H -1.083 4.888 2.894 1.00 . A A . 30 GLN H 1 1 7 4213 1 1 30 GLN HA H 0.282 7.447 3.191 1.00 . A A . 30 GLN HA 1 1 7 4214 1 1 30 GLN HB2 H -1.448 5.753 4.922 1.00 . A A . 30 GLN HB2 1 1 7 4215 1 1 30 GLN HB3 H -0.280 6.801 5.716 1.00 . A A . 30 GLN HB3 1 1 7 4216 1 1 30 GLN HE21 H -3.058 9.541 6.021 1.00 . A A . 30 GLN HE21 1 1 7 4217 1 1 30 GLN HE22 H -4.399 8.611 6.588 1.00 . A A . 30 GLN HE22 1 1 7 4218 1 1 30 GLN HG2 H -1.320 8.721 5.026 1.00 . A A . 30 GLN HG2 1 1 7 4219 1 1 30 GLN HG3 H -2.048 7.949 3.618 1.00 . A A . 30 GLN HG3 1 1 7 4220 1 1 30 GLN N N -0.505 5.628 2.617 1.00 . A A . 30 GLN N 1 1 7 4221 1 1 30 GLN NE2 N -3.566 8.705 6.081 1.00 . A A . 30 GLN NE2 1 1 7 4222 1 1 30 GLN O O 2.444 6.587 4.133 1.00 . A A . 30 GLN O 1 1 7 4223 1 1 30 GLN OE1 O -3.674 6.551 5.455 1.00 . A A . 30 GLN OE1 1 1 7 4224 1 1 31 HIS C C 3.695 3.978 3.940 1.00 . A A . 31 HIS C 1 1 7 4225 1 1 31 HIS CA C 2.597 3.959 4.999 1.00 . A A . 31 HIS CA 1 1 7 4226 1 1 31 HIS CB C 2.275 2.516 5.390 1.00 . A A . 31 HIS CB 1 1 7 4227 1 1 31 HIS CD2 C 3.868 0.796 4.280 1.00 . A A . 31 HIS CD2 1 1 7 4228 1 1 31 HIS CE1 C 5.275 0.542 5.942 1.00 . A A . 31 HIS CE1 1 1 7 4229 1 1 31 HIS CG C 3.450 1.592 5.291 1.00 . A A . 31 HIS CG 1 1 7 4230 1 1 31 HIS H H 0.552 4.137 4.480 1.00 . A A . 31 HIS H 1 1 7 4231 1 1 31 HIS HA H 2.946 4.490 5.871 1.00 . A A . 31 HIS HA 1 1 7 4232 1 1 31 HIS HB2 H 1.923 2.497 6.411 1.00 . A A . 31 HIS HB2 1 1 7 4233 1 1 31 HIS HB3 H 1.499 2.138 4.740 1.00 . A A . 31 HIS HB3 1 1 7 4234 1 1 31 HIS HD1 H 4.322 1.852 7.192 1.00 . A A . 31 HIS HD1 1 1 7 4235 1 1 31 HIS HD2 H 3.396 0.685 3.313 1.00 . A A . 31 HIS HD2 1 1 7 4236 1 1 31 HIS HE1 H 6.108 0.207 6.540 1.00 . A A . 31 HIS HE1 1 1 7 4237 1 1 31 HIS N N 1.397 4.632 4.515 1.00 . A A . 31 HIS N 1 1 7 4238 1 1 31 HIS ND1 N 4.352 1.410 6.318 1.00 . A A . 31 HIS ND1 1 1 7 4239 1 1 31 HIS NE2 N 5.003 0.154 4.709 1.00 . A A . 31 HIS NE2 1 1 7 4240 1 1 31 HIS O O 4.846 4.303 4.233 1.00 . A A . 31 HIS O 1 1 7 4241 1 1 32 GLN C C 5.265 4.772 1.712 1.00 . A A . 32 GLN C 1 1 7 4242 1 1 32 GLN CA C 4.288 3.606 1.610 1.00 . A A . 32 GLN CA 1 1 7 4243 1 1 32 GLN CB C 3.554 3.656 0.268 1.00 . A A . 32 GLN CB 1 1 7 4244 1 1 32 GLN CD C 4.129 1.288 -0.401 1.00 . A A . 32 GLN CD 1 1 7 4245 1 1 32 GLN CG C 3.025 2.305 -0.187 1.00 . A A . 32 GLN CG 1 1 7 4246 1 1 32 GLN H H 2.400 3.381 2.540 1.00 . A A . 32 GLN H 1 1 7 4247 1 1 32 GLN HA H 4.842 2.682 1.672 1.00 . A A . 32 GLN HA 1 1 7 4248 1 1 32 GLN HB2 H 2.719 4.335 0.353 1.00 . A A . 32 GLN HB2 1 1 7 4249 1 1 32 GLN HB3 H 4.233 4.024 -0.486 1.00 . A A . 32 GLN HB3 1 1 7 4250 1 1 32 GLN HE21 H 2.788 -0.110 -0.849 1.00 . A A . 32 GLN HE21 1 1 7 4251 1 1 32 GLN HE22 H 4.440 -0.612 -0.895 1.00 . A A . 32 GLN HE22 1 1 7 4252 1 1 32 GLN HG2 H 2.349 1.926 0.565 1.00 . A A . 32 GLN HG2 1 1 7 4253 1 1 32 GLN HG3 H 2.491 2.437 -1.116 1.00 . A A . 32 GLN HG3 1 1 7 4254 1 1 32 GLN N N 3.332 3.629 2.710 1.00 . A A . 32 GLN N 1 1 7 4255 1 1 32 GLN NE2 N 3.748 0.065 -0.750 1.00 . A A . 32 GLN NE2 1 1 7 4256 1 1 32 GLN O O 6.407 4.679 1.262 1.00 . A A . 32 GLN O 1 1 7 4257 1 1 32 GLN OE1 O 5.312 1.598 -0.254 1.00 . A A . 32 GLN OE1 1 1 7 4258 1 1 33 ARG C C 6.999 6.690 3.058 1.00 . A A . 33 ARG C 1 1 7 4259 1 1 33 ARG CA C 5.641 7.055 2.466 1.00 . A A . 33 ARG CA 1 1 7 4260 1 1 33 ARG CB C 4.942 8.080 3.361 1.00 . A A . 33 ARG CB 1 1 7 4261 1 1 33 ARG CD C 2.942 9.564 3.696 1.00 . A A . 33 ARG CD 1 1 7 4262 1 1 33 ARG CG C 3.760 8.765 2.694 1.00 . A A . 33 ARG CG 1 1 7 4263 1 1 33 ARG CZ C 3.310 11.574 5.063 1.00 . A A . 33 ARG CZ 1 1 7 4264 1 1 33 ARG H H 3.888 5.883 2.644 1.00 . A A . 33 ARG H 1 1 7 4265 1 1 33 ARG HA H 5.793 7.489 1.489 1.00 . A A . 33 ARG HA 1 1 7 4266 1 1 33 ARG HB2 H 4.585 7.580 4.250 1.00 . A A . 33 ARG HB2 1 1 7 4267 1 1 33 ARG HB3 H 5.656 8.838 3.646 1.00 . A A . 33 ARG HB3 1 1 7 4268 1 1 33 ARG HD2 H 1.943 9.691 3.305 1.00 . A A . 33 ARG HD2 1 1 7 4269 1 1 33 ARG HD3 H 2.898 9.015 4.624 1.00 . A A . 33 ARG HD3 1 1 7 4270 1 1 33 ARG HE H 4.096 11.265 3.256 1.00 . A A . 33 ARG HE 1 1 7 4271 1 1 33 ARG HG2 H 4.128 9.434 1.931 1.00 . A A . 33 ARG HG2 1 1 7 4272 1 1 33 ARG HG3 H 3.128 8.014 2.244 1.00 . A A . 33 ARG HG3 1 1 7 4273 1 1 33 ARG HH11 H 2.112 10.182 5.904 1.00 . A A . 33 ARG HH11 1 1 7 4274 1 1 33 ARG HH12 H 2.380 11.604 6.857 1.00 . A A . 33 ARG HH12 1 1 7 4275 1 1 33 ARG HH21 H 4.457 13.142 4.502 1.00 . A A . 33 ARG HH21 1 1 7 4276 1 1 33 ARG HH22 H 3.713 13.287 6.058 1.00 . A A . 33 ARG HH22 1 1 7 4277 1 1 33 ARG N N 4.808 5.870 2.306 1.00 . A A . 33 ARG N 1 1 7 4278 1 1 33 ARG NE N 3.521 10.881 3.950 1.00 . A A . 33 ARG NE 1 1 7 4279 1 1 33 ARG NH1 N 2.537 11.080 6.019 1.00 . A A . 33 ARG NH1 1 1 7 4280 1 1 33 ARG NH2 N 3.873 12.765 5.221 1.00 . A A . 33 ARG NH2 1 1 7 4281 1 1 33 ARG O O 8.043 7.022 2.497 1.00 . A A . 33 ARG O 1 1 7 4282 1 1 34 VAL C C 9.246 5.116 3.858 1.00 . A A . 34 VAL C 1 1 7 4283 1 1 34 VAL CA C 8.205 5.592 4.865 1.00 . A A . 34 VAL CA 1 1 7 4284 1 1 34 VAL CB C 7.940 4.467 5.884 1.00 . A A . 34 VAL CB 1 1 7 4285 1 1 34 VAL CG1 C 7.084 4.978 7.032 1.00 . A A . 34 VAL CG1 1 1 7 4286 1 1 34 VAL CG2 C 7.280 3.278 5.203 1.00 . A A . 34 VAL CG2 1 1 7 4287 1 1 34 VAL H H 6.113 5.768 4.596 1.00 . A A . 34 VAL H 1 1 7 4288 1 1 34 VAL HA H 8.598 6.446 5.398 1.00 . A A . 34 VAL HA 1 1 7 4289 1 1 34 VAL HB H 8.889 4.144 6.287 1.00 . A A . 34 VAL HB 1 1 7 4290 1 1 34 VAL HG11 H 7.172 4.306 7.873 1.00 . A A . 34 VAL HG11 1 1 7 4291 1 1 34 VAL HG12 H 7.419 5.963 7.321 1.00 . A A . 34 VAL HG12 1 1 7 4292 1 1 34 VAL HG13 H 6.052 5.026 6.718 1.00 . A A . 34 VAL HG13 1 1 7 4293 1 1 34 VAL HG21 H 7.279 3.429 4.134 1.00 . A A . 34 VAL HG21 1 1 7 4294 1 1 34 VAL HG22 H 7.829 2.378 5.440 1.00 . A A . 34 VAL HG22 1 1 7 4295 1 1 34 VAL HG23 H 6.263 3.181 5.554 1.00 . A A . 34 VAL HG23 1 1 7 4296 1 1 34 VAL N N 6.977 6.003 4.197 1.00 . A A . 34 VAL N 1 1 7 4297 1 1 34 VAL O O 10.449 5.179 4.115 1.00 . A A . 34 VAL O 1 1 7 4298 1 1 35 HIS C C 9.730 5.141 0.501 1.00 . A A . 35 HIS C 1 1 7 4299 1 1 35 HIS CA C 9.666 4.153 1.662 1.00 . A A . 35 HIS CA 1 1 7 4300 1 1 35 HIS CB C 9.198 2.787 1.159 1.00 . A A . 35 HIS CB 1 1 7 4301 1 1 35 HIS CD2 C 7.651 1.126 2.414 1.00 . A A . 35 HIS CD2 1 1 7 4302 1 1 35 HIS CE1 C 8.936 0.740 4.148 1.00 . A A . 35 HIS CE1 1 1 7 4303 1 1 35 HIS CG C 8.780 1.856 2.255 1.00 . A A . 35 HIS CG 1 1 7 4304 1 1 35 HIS H H 7.807 4.615 2.564 1.00 . A A . 35 HIS H 1 1 7 4305 1 1 35 HIS HA H 10.653 4.051 2.087 1.00 . A A . 35 HIS HA 1 1 7 4306 1 1 35 HIS HB2 H 8.353 2.923 0.500 1.00 . A A . 35 HIS HB2 1 1 7 4307 1 1 35 HIS HB3 H 10.003 2.317 0.612 1.00 . A A . 35 HIS HB3 1 1 7 4308 1 1 35 HIS HD1 H 10.449 1.973 3.536 1.00 . A A . 35 HIS HD1 1 1 7 4309 1 1 35 HIS HD2 H 6.810 1.088 1.736 1.00 . A A . 35 HIS HD2 1 1 7 4310 1 1 35 HIS HE1 H 9.309 0.352 5.085 1.00 . A A . 35 HIS HE1 1 1 7 4311 1 1 35 HIS N N 8.776 4.639 2.710 1.00 . A A . 35 HIS N 1 1 7 4312 1 1 35 HIS ND1 N 9.563 1.593 3.359 1.00 . A A . 35 HIS ND1 1 1 7 4313 1 1 35 HIS NE2 N 7.773 0.441 3.598 1.00 . A A . 35 HIS NE2 1 1 7 4314 1 1 35 HIS O O 9.095 4.940 -0.534 1.00 . A A . 35 HIS O 1 1 7 4315 1 1 36 SER C C 12.064 7.789 -0.367 1.00 . A A . 36 SER C 1 1 7 4316 1 1 36 SER CA C 10.644 7.231 -0.349 1.00 . A A . 36 SER CA 1 1 7 4317 1 1 36 SER CB C 9.641 8.363 -0.117 1.00 . A A . 36 SER CB 1 1 7 4318 1 1 36 SER H H 10.982 6.313 1.529 1.00 . A A . 36 SER H 1 1 7 4319 1 1 36 SER HA H 10.439 6.770 -1.304 1.00 . A A . 36 SER HA 1 1 7 4320 1 1 36 SER HB2 H 8.738 7.958 0.313 1.00 . A A . 36 SER HB2 1 1 7 4321 1 1 36 SER HB3 H 10.070 9.086 0.561 1.00 . A A . 36 SER HB3 1 1 7 4322 1 1 36 SER HG H 8.410 8.808 -1.575 1.00 . A A . 36 SER HG 1 1 7 4323 1 1 36 SER N N 10.501 6.209 0.681 1.00 . A A . 36 SER N 1 1 7 4324 1 1 36 SER O O 12.755 7.790 0.651 1.00 . A A . 36 SER O 1 1 7 4325 1 1 36 SER OG O 9.316 9.013 -1.334 1.00 . A A . 36 SER OG 1 1 7 4326 1 1 37 GLY C C 13.967 10.159 -0.970 1.00 . A A . 37 GLY C 1 1 7 4327 1 1 37 GLY CA C 13.827 8.818 -1.663 1.00 . A A . 37 GLY CA 1 1 7 4328 1 1 37 GLY H H 11.897 8.237 -2.311 1.00 . A A . 37 GLY H 1 1 7 4329 1 1 37 GLY HA2 H 14.536 8.126 -1.233 1.00 . A A . 37 GLY HA2 1 1 7 4330 1 1 37 GLY HA3 H 14.051 8.943 -2.712 1.00 . A A . 37 GLY HA3 1 1 7 4331 1 1 37 GLY N N 12.492 8.264 -1.533 1.00 . A A . 37 GLY N 1 1 7 4332 1 1 37 GLY O O 13.324 11.134 -1.355 1.00 . A A . 37 GLY O 1 1 7 4333 1 1 38 GLU C C 16.328 12.114 0.374 1.00 . A A . 38 GLU C 1 1 7 4334 1 1 38 GLU CA C 15.030 11.438 0.807 1.00 . A A . 38 GLU CA 1 1 7 4335 1 1 38 GLU CB C 15.070 11.147 2.308 1.00 . A A . 38 GLU CB 1 1 7 4336 1 1 38 GLU CD C 13.186 12.425 3.403 1.00 . A A . 38 GLU CD 1 1 7 4337 1 1 38 GLU CG C 13.695 11.071 2.950 1.00 . A A . 38 GLU CG 1 1 7 4338 1 1 38 GLU H H 15.295 9.396 0.317 1.00 . A A . 38 GLU H 1 1 7 4339 1 1 38 GLU HA H 14.206 12.104 0.600 1.00 . A A . 38 GLU HA 1 1 7 4340 1 1 38 GLU HB2 H 15.572 10.204 2.467 1.00 . A A . 38 GLU HB2 1 1 7 4341 1 1 38 GLU HB3 H 15.630 11.929 2.799 1.00 . A A . 38 GLU HB3 1 1 7 4342 1 1 38 GLU HG2 H 12.999 10.663 2.232 1.00 . A A . 38 GLU HG2 1 1 7 4343 1 1 38 GLU HG3 H 13.749 10.417 3.809 1.00 . A A . 38 GLU HG3 1 1 7 4344 1 1 38 GLU N N 14.810 10.207 0.057 1.00 . A A . 38 GLU N 1 1 7 4345 1 1 38 GLU O O 17.194 11.488 -0.239 1.00 . A A . 38 GLU O 1 1 7 4346 1 1 38 GLU OE1 O 13.467 12.810 4.557 1.00 . A A . 38 GLU OE1 1 1 7 4347 1 1 38 GLU OE2 O 12.507 13.101 2.601 1.00 . A A . 38 GLU OE2 1 1 7 4348 1 1 39 LYS C C 18.441 14.539 1.589 1.00 . A A . 39 LYS C 1 1 7 4349 1 1 39 LYS CA C 17.648 14.159 0.343 1.00 . A A . 39 LYS CA 1 1 7 4350 1 1 39 LYS CB C 17.260 15.421 -0.432 1.00 . A A . 39 LYS CB 1 1 7 4351 1 1 39 LYS CD C 18.065 17.471 -1.639 1.00 . A A . 39 LYS CD 1 1 7 4352 1 1 39 LYS CE C 18.175 18.506 -0.529 1.00 . A A . 39 LYS CE 1 1 7 4353 1 1 39 LYS CG C 18.428 16.082 -1.143 1.00 . A A . 39 LYS CG 1 1 7 4354 1 1 39 LYS H H 15.732 13.841 1.185 1.00 . A A . 39 LYS H 1 1 7 4355 1 1 39 LYS HA H 18.266 13.537 -0.286 1.00 . A A . 39 LYS HA 1 1 7 4356 1 1 39 LYS HB2 H 16.517 15.160 -1.171 1.00 . A A . 39 LYS HB2 1 1 7 4357 1 1 39 LYS HB3 H 16.834 16.135 0.258 1.00 . A A . 39 LYS HB3 1 1 7 4358 1 1 39 LYS HD2 H 18.737 17.746 -2.439 1.00 . A A . 39 LYS HD2 1 1 7 4359 1 1 39 LYS HD3 H 17.049 17.458 -2.008 1.00 . A A . 39 LYS HD3 1 1 7 4360 1 1 39 LYS HE2 H 17.626 19.388 -0.821 1.00 . A A . 39 LYS HE2 1 1 7 4361 1 1 39 LYS HE3 H 17.742 18.095 0.371 1.00 . A A . 39 LYS HE3 1 1 7 4362 1 1 39 LYS HG2 H 19.257 16.162 -0.456 1.00 . A A . 39 LYS HG2 1 1 7 4363 1 1 39 LYS HG3 H 18.716 15.471 -1.987 1.00 . A A . 39 LYS HG3 1 1 7 4364 1 1 39 LYS HZ1 H 20.038 19.234 -1.129 1.00 . A A . 39 LYS HZ1 1 1 7 4365 1 1 39 LYS HZ2 H 20.121 18.054 0.081 1.00 . A A . 39 LYS HZ2 1 1 7 4366 1 1 39 LYS HZ3 H 19.630 19.627 0.465 1.00 . A A . 39 LYS HZ3 1 1 7 4367 1 1 39 LYS N N 16.457 13.396 0.696 1.00 . A A . 39 LYS N 1 1 7 4368 1 1 39 LYS NZ N 19.590 18.882 -0.259 1.00 . A A . 39 LYS NZ 1 1 7 4369 1 1 39 LYS O O 18.367 15.665 2.082 1.00 . A A . 39 LYS O 1 1 7 4370 1 1 40 PRO C C 21.212 14.735 3.045 1.00 . A A . 40 PRO C 1 1 7 4371 1 1 40 PRO CA C 20.042 13.792 3.306 1.00 . A A . 40 PRO CA 1 1 7 4372 1 1 40 PRO CB C 20.552 12.387 3.640 1.00 . A A . 40 PRO CB 1 1 7 4373 1 1 40 PRO CD C 19.356 12.215 1.577 1.00 . A A . 40 PRO CD 1 1 7 4374 1 1 40 PRO CG C 20.524 11.657 2.342 1.00 . A A . 40 PRO CG 1 1 7 4375 1 1 40 PRO HA H 19.455 14.169 4.131 1.00 . A A . 40 PRO HA 1 1 7 4376 1 1 40 PRO HB2 H 21.555 12.451 4.037 1.00 . A A . 40 PRO HB2 1 1 7 4377 1 1 40 PRO HB3 H 19.899 11.927 4.366 1.00 . A A . 40 PRO HB3 1 1 7 4378 1 1 40 PRO HD2 H 19.573 12.235 0.519 1.00 . A A . 40 PRO HD2 1 1 7 4379 1 1 40 PRO HD3 H 18.466 11.635 1.770 1.00 . A A . 40 PRO HD3 1 1 7 4380 1 1 40 PRO HG2 H 21.443 11.830 1.803 1.00 . A A . 40 PRO HG2 1 1 7 4381 1 1 40 PRO HG3 H 20.385 10.600 2.519 1.00 . A A . 40 PRO HG3 1 1 7 4382 1 1 40 PRO N N 19.219 13.580 2.112 1.00 . A A . 40 PRO N 1 1 7 4383 1 1 40 PRO O O 21.799 15.284 3.977 1.00 . A A . 40 PRO O 1 1 7 4384 1 1 41 SER C C 22.504 16.241 -0.064 1.00 . A A . 41 SER C 1 1 7 4385 1 1 41 SER CA C 22.646 15.793 1.388 1.00 . A A . 41 SER CA 1 1 7 4386 1 1 41 SER CB C 23.985 15.078 1.584 1.00 . A A . 41 SER CB 1 1 7 4387 1 1 41 SER H H 21.038 14.453 1.073 1.00 . A A . 41 SER H 1 1 7 4388 1 1 41 SER HA H 22.616 16.664 2.025 1.00 . A A . 41 SER HA 1 1 7 4389 1 1 41 SER HB2 H 24.788 15.795 1.501 1.00 . A A . 41 SER HB2 1 1 7 4390 1 1 41 SER HB3 H 24.006 14.624 2.564 1.00 . A A . 41 SER HB3 1 1 7 4391 1 1 41 SER HG H 23.317 13.764 0.294 1.00 . A A . 41 SER HG 1 1 7 4392 1 1 41 SER N N 21.544 14.919 1.771 1.00 . A A . 41 SER N 1 1 7 4393 1 1 41 SER O O 22.010 15.497 -0.910 1.00 . A A . 41 SER O 1 1 7 4394 1 1 41 SER OG O 24.171 14.068 0.608 1.00 . A A . 41 SER OG 1 1 7 4395 1 1 42 GLY C C 22.921 19.506 -1.730 1.00 . A A . 42 GLY C 1 1 7 4396 1 1 42 GLY CA C 22.856 17.992 -1.694 1.00 . A A . 42 GLY CA 1 1 7 4397 1 1 42 GLY H H 23.328 18.013 0.370 1.00 . A A . 42 GLY H 1 1 7 4398 1 1 42 GLY HA2 H 23.672 17.593 -2.278 1.00 . A A . 42 GLY HA2 1 1 7 4399 1 1 42 GLY HA3 H 21.922 17.673 -2.134 1.00 . A A . 42 GLY HA3 1 1 7 4400 1 1 42 GLY N N 22.943 17.464 -0.345 1.00 . A A . 42 GLY N 1 1 7 4401 1 1 42 GLY O O 23.412 20.150 -0.803 1.00 . A A . 42 GLY O 1 1 7 4402 1 1 43 PRO C C 21.437 22.249 -2.059 1.00 . A A . 43 PRO C 1 1 7 4403 1 1 43 PRO CA C 22.411 21.553 -3.004 1.00 . A A . 43 PRO CA 1 1 7 4404 1 1 43 PRO CB C 21.964 21.728 -4.457 1.00 . A A . 43 PRO CB 1 1 7 4405 1 1 43 PRO CD C 21.817 19.393 -3.968 1.00 . A A . 43 PRO CD 1 1 7 4406 1 1 43 PRO CG C 21.180 20.499 -4.763 1.00 . A A . 43 PRO CG 1 1 7 4407 1 1 43 PRO HA H 23.398 21.973 -2.876 1.00 . A A . 43 PRO HA 1 1 7 4408 1 1 43 PRO HB2 H 21.355 22.617 -4.544 1.00 . A A . 43 PRO HB2 1 1 7 4409 1 1 43 PRO HB3 H 22.829 21.813 -5.096 1.00 . A A . 43 PRO HB3 1 1 7 4410 1 1 43 PRO HD2 H 21.070 18.687 -3.637 1.00 . A A . 43 PRO HD2 1 1 7 4411 1 1 43 PRO HD3 H 22.575 18.895 -4.555 1.00 . A A . 43 PRO HD3 1 1 7 4412 1 1 43 PRO HG2 H 20.152 20.633 -4.461 1.00 . A A . 43 PRO HG2 1 1 7 4413 1 1 43 PRO HG3 H 21.237 20.281 -5.819 1.00 . A A . 43 PRO HG3 1 1 7 4414 1 1 43 PRO N N 22.418 20.098 -2.824 1.00 . A A . 43 PRO N 1 1 7 4415 1 1 43 PRO O O 20.598 21.603 -1.432 1.00 . A A . 43 PRO O 1 1 7 4416 1 1 44 SER C C 19.336 24.604 -1.754 1.00 . A A . 44 SER C 1 1 7 4417 1 1 44 SER CA C 20.687 24.353 -1.092 1.00 . A A . 44 SER CA 1 1 7 4418 1 1 44 SER CB C 21.350 25.686 -0.740 1.00 . A A . 44 SER CB 1 1 7 4419 1 1 44 SER H H 22.244 24.027 -2.489 1.00 . A A . 44 SER H 1 1 7 4420 1 1 44 SER HA H 20.531 23.788 -0.185 1.00 . A A . 44 SER HA 1 1 7 4421 1 1 44 SER HB2 H 22.348 25.502 -0.371 1.00 . A A . 44 SER HB2 1 1 7 4422 1 1 44 SER HB3 H 21.402 26.303 -1.625 1.00 . A A . 44 SER HB3 1 1 7 4423 1 1 44 SER HG H 19.797 26.706 -0.121 1.00 . A A . 44 SER HG 1 1 7 4424 1 1 44 SER N N 21.555 23.569 -1.963 1.00 . A A . 44 SER N 1 1 7 4425 1 1 44 SER O O 18.848 25.733 -1.786 1.00 . A A . 44 SER O 1 1 7 4426 1 1 44 SER OG O 20.615 26.374 0.256 1.00 . A A . 44 SER OG 1 1 7 4427 1 1 45 SER C C 16.638 22.362 -2.774 1.00 . A A . 45 SER C 1 1 7 4428 1 1 45 SER CA C 17.444 23.645 -2.949 1.00 . A A . 45 SER CA 1 1 7 4429 1 1 45 SER CB C 17.635 23.942 -4.437 1.00 . A A . 45 SER CB 1 1 7 4430 1 1 45 SER H H 19.176 22.667 -2.225 1.00 . A A . 45 SER H 1 1 7 4431 1 1 45 SER HA H 16.902 24.461 -2.494 1.00 . A A . 45 SER HA 1 1 7 4432 1 1 45 SER HB2 H 18.555 23.491 -4.776 1.00 . A A . 45 SER HB2 1 1 7 4433 1 1 45 SER HB3 H 16.806 23.529 -4.993 1.00 . A A . 45 SER HB3 1 1 7 4434 1 1 45 SER HG H 17.775 25.498 -5.618 1.00 . A A . 45 SER HG 1 1 7 4435 1 1 45 SER N N 18.737 23.541 -2.283 1.00 . A A . 45 SER N 1 1 7 4436 1 1 45 SER O O 16.959 21.329 -3.360 1.00 . A A . 45 SER O 1 1 7 4437 1 1 45 SER OG O 17.695 25.338 -4.675 1.00 . A A . 45 SER OG 1 1 7 4438 1 1 46 GLY C C 13.388 21.644 -1.173 1.00 . A A . 46 GLY C 1 1 7 4439 1 1 46 GLY CA C 14.751 21.274 -1.723 1.00 . A A . 46 GLY CA 1 1 7 4440 1 1 46 GLY H H 15.379 23.286 -1.521 1.00 . A A . 46 GLY H 1 1 7 4441 1 1 46 GLY HA2 H 14.620 20.741 -2.653 1.00 . A A . 46 GLY HA2 1 1 7 4442 1 1 46 GLY HA3 H 15.248 20.626 -1.016 1.00 . A A . 46 GLY HA3 1 1 7 4443 1 1 46 GLY N N 15.587 22.436 -1.962 1.00 . A A . 46 GLY N 1 1 7 4444 1 1 46 GLY O O 12.407 20.981 -1.507 1.00 . A A . 46 GLY O 1 1 7 4445 2 2 1 ZN ZN ZN 6.389 -0.859 3.686 1.00 . B A . 181 ZN ZN 1 1 8 4446 1 1 1 GLY C C 13.605 -23.368 3.255 1.00 . A A . 1 GLY C 1 1 8 4447 1 1 1 GLY CA C 14.270 -23.181 4.605 1.00 . A A . 1 GLY CA 1 1 8 4448 1 1 1 GLY H1 H 14.725 -24.847 5.830 1.00 . A A . 1 GLY H1 1 1 8 4449 1 1 1 GLY HA2 H 13.511 -22.960 5.340 1.00 . A A . 1 GLY HA2 1 1 8 4450 1 1 1 GLY HA3 H 14.952 -22.346 4.544 1.00 . A A . 1 GLY HA3 1 1 8 4451 1 1 1 GLY N N 15.006 -24.358 5.028 1.00 . A A . 1 GLY N 1 1 8 4452 1 1 1 GLY O O 13.843 -22.597 2.326 1.00 . A A . 1 GLY O 1 1 8 4453 1 1 2 SER C C 10.599 -24.313 2.000 1.00 . A A . 2 SER C 1 1 8 4454 1 1 2 SER CA C 12.074 -24.687 1.898 1.00 . A A . 2 SER CA 1 1 8 4455 1 1 2 SER CB C 12.213 -26.169 1.544 1.00 . A A . 2 SER CB 1 1 8 4456 1 1 2 SER H H 12.623 -24.977 3.922 1.00 . A A . 2 SER H 1 1 8 4457 1 1 2 SER HA H 12.530 -24.095 1.118 1.00 . A A . 2 SER HA 1 1 8 4458 1 1 2 SER HB2 H 11.876 -26.327 0.530 1.00 . A A . 2 SER HB2 1 1 8 4459 1 1 2 SER HB3 H 13.249 -26.461 1.629 1.00 . A A . 2 SER HB3 1 1 8 4460 1 1 2 SER HG H 11.849 -27.839 2.501 1.00 . A A . 2 SER HG 1 1 8 4461 1 1 2 SER N N 12.771 -24.397 3.146 1.00 . A A . 2 SER N 1 1 8 4462 1 1 2 SER O O 10.051 -24.194 3.096 1.00 . A A . 2 SER O 1 1 8 4463 1 1 2 SER OG O 11.438 -26.976 2.414 1.00 . A A . 2 SER OG 1 1 8 4464 1 1 3 SER C C 7.665 -24.993 0.992 1.00 . A A . 3 SER C 1 1 8 4465 1 1 3 SER CA C 8.549 -23.763 0.807 1.00 . A A . 3 SER CA 1 1 8 4466 1 1 3 SER CB C 8.217 -23.076 -0.518 1.00 . A A . 3 SER CB 1 1 8 4467 1 1 3 SER H H 10.451 -24.237 0.008 1.00 . A A . 3 SER H 1 1 8 4468 1 1 3 SER HA H 8.361 -23.074 1.617 1.00 . A A . 3 SER HA 1 1 8 4469 1 1 3 SER HB2 H 7.261 -22.582 -0.435 1.00 . A A . 3 SER HB2 1 1 8 4470 1 1 3 SER HB3 H 8.981 -22.346 -0.744 1.00 . A A . 3 SER HB3 1 1 8 4471 1 1 3 SER HG H 9.044 -24.297 -1.808 1.00 . A A . 3 SER HG 1 1 8 4472 1 1 3 SER N N 9.960 -24.128 0.849 1.00 . A A . 3 SER N 1 1 8 4473 1 1 3 SER O O 6.692 -25.186 0.264 1.00 . A A . 3 SER O 1 1 8 4474 1 1 3 SER OG O 8.155 -24.015 -1.578 1.00 . A A . 3 SER OG 1 1 8 4475 1 1 4 GLY C C 5.840 -26.715 2.729 1.00 . A A . 4 GLY C 1 1 8 4476 1 1 4 GLY CA C 7.240 -27.022 2.235 1.00 . A A . 4 GLY CA 1 1 8 4477 1 1 4 GLY H H 8.797 -25.616 2.521 1.00 . A A . 4 GLY H 1 1 8 4478 1 1 4 GLY HA2 H 7.171 -27.600 1.326 1.00 . A A . 4 GLY HA2 1 1 8 4479 1 1 4 GLY HA3 H 7.752 -27.608 2.984 1.00 . A A . 4 GLY HA3 1 1 8 4480 1 1 4 GLY N N 8.011 -25.822 1.972 1.00 . A A . 4 GLY N 1 1 8 4481 1 1 4 GLY O O 4.873 -27.350 2.309 1.00 . A A . 4 GLY O 1 1 8 4482 1 1 5 SER C C 3.838 -24.188 3.401 1.00 . A A . 5 SER C 1 1 8 4483 1 1 5 SER CA C 4.439 -25.353 4.181 1.00 . A A . 5 SER CA 1 1 8 4484 1 1 5 SER CB C 4.588 -24.972 5.655 1.00 . A A . 5 SER CB 1 1 8 4485 1 1 5 SER H H 6.539 -25.270 3.921 1.00 . A A . 5 SER H 1 1 8 4486 1 1 5 SER HA H 3.777 -26.203 4.103 1.00 . A A . 5 SER HA 1 1 8 4487 1 1 5 SER HB2 H 3.616 -24.743 6.065 1.00 . A A . 5 SER HB2 1 1 8 4488 1 1 5 SER HB3 H 5.021 -25.800 6.197 1.00 . A A . 5 SER HB3 1 1 8 4489 1 1 5 SER HG H 6.288 -24.118 6.124 1.00 . A A . 5 SER HG 1 1 8 4490 1 1 5 SER N N 5.730 -25.740 3.625 1.00 . A A . 5 SER N 1 1 8 4491 1 1 5 SER O O 4.096 -23.024 3.706 1.00 . A A . 5 SER O 1 1 8 4492 1 1 5 SER OG O 5.426 -23.839 5.806 1.00 . A A . 5 SER OG 1 1 8 4493 1 1 6 SER C C 0.904 -23.415 1.851 1.00 . A A . 6 SER C 1 1 8 4494 1 1 6 SER CA C 2.400 -23.493 1.564 1.00 . A A . 6 SER CA 1 1 8 4495 1 1 6 SER CB C 2.631 -23.793 0.082 1.00 . A A . 6 SER CB 1 1 8 4496 1 1 6 SER H H 2.869 -25.458 2.198 1.00 . A A . 6 SER H 1 1 8 4497 1 1 6 SER HA H 2.851 -22.542 1.804 1.00 . A A . 6 SER HA 1 1 8 4498 1 1 6 SER HB2 H 2.273 -24.786 -0.142 1.00 . A A . 6 SER HB2 1 1 8 4499 1 1 6 SER HB3 H 2.093 -23.073 -0.517 1.00 . A A . 6 SER HB3 1 1 8 4500 1 1 6 SER HG H 4.119 -23.224 -1.059 1.00 . A A . 6 SER HG 1 1 8 4501 1 1 6 SER N N 3.036 -24.512 2.392 1.00 . A A . 6 SER N 1 1 8 4502 1 1 6 SER O O 0.115 -24.186 1.306 1.00 . A A . 6 SER O 1 1 8 4503 1 1 6 SER OG O 4.008 -23.720 -0.245 1.00 . A A . 6 SER OG 1 1 8 4504 1 1 7 GLY C C -1.543 -21.197 2.280 1.00 . A A . 7 GLY C 1 1 8 4505 1 1 7 GLY CA C -0.879 -22.315 3.059 1.00 . A A . 7 GLY CA 1 1 8 4506 1 1 7 GLY H H 1.195 -21.891 3.116 1.00 . A A . 7 GLY H 1 1 8 4507 1 1 7 GLY HA2 H -1.398 -23.239 2.855 1.00 . A A . 7 GLY HA2 1 1 8 4508 1 1 7 GLY HA3 H -0.954 -22.096 4.114 1.00 . A A . 7 GLY HA3 1 1 8 4509 1 1 7 GLY N N 0.521 -22.477 2.713 1.00 . A A . 7 GLY N 1 1 8 4510 1 1 7 GLY O O -1.293 -21.028 1.085 1.00 . A A . 7 GLY O 1 1 8 4511 1 1 8 THR C C -2.788 -18.003 3.013 1.00 . A A . 8 THR C 1 1 8 4512 1 1 8 THR CA C -3.097 -19.324 2.319 1.00 . A A . 8 THR CA 1 1 8 4513 1 1 8 THR CB C -4.621 -19.550 2.326 1.00 . A A . 8 THR CB 1 1 8 4514 1 1 8 THR CG2 C -5.332 -18.466 1.530 1.00 . A A . 8 THR CG2 1 1 8 4515 1 1 8 THR H H -2.550 -20.615 3.905 1.00 . A A . 8 THR H 1 1 8 4516 1 1 8 THR HA H -2.767 -19.266 1.292 1.00 . A A . 8 THR HA 1 1 8 4517 1 1 8 THR HB H -4.970 -19.514 3.348 1.00 . A A . 8 THR HB 1 1 8 4518 1 1 8 THR HG1 H -5.065 -20.751 0.825 1.00 . A A . 8 THR HG1 1 1 8 4519 1 1 8 THR HG21 H -6.216 -18.881 1.068 1.00 . A A . 8 THR HG21 1 1 8 4520 1 1 8 THR HG22 H -4.670 -18.088 0.765 1.00 . A A . 8 THR HG22 1 1 8 4521 1 1 8 THR HG23 H -5.616 -17.662 2.192 1.00 . A A . 8 THR HG23 1 1 8 4522 1 1 8 THR N N -2.393 -20.430 2.956 1.00 . A A . 8 THR N 1 1 8 4523 1 1 8 THR O O -2.692 -17.942 4.238 1.00 . A A . 8 THR O 1 1 8 4524 1 1 8 THR OG1 O -4.928 -20.835 1.772 1.00 . A A . 8 THR OG1 1 1 8 4525 1 1 9 GLY C C -2.471 -14.528 1.757 1.00 . A A . 9 GLY C 1 1 8 4526 1 1 9 GLY CA C -2.337 -15.639 2.779 1.00 . A A . 9 GLY CA 1 1 8 4527 1 1 9 GLY H H -2.721 -17.054 1.252 1.00 . A A . 9 GLY H 1 1 8 4528 1 1 9 GLY HA2 H -3.016 -15.446 3.597 1.00 . A A . 9 GLY HA2 1 1 8 4529 1 1 9 GLY HA3 H -1.325 -15.643 3.158 1.00 . A A . 9 GLY HA3 1 1 8 4530 1 1 9 GLY N N -2.633 -16.946 2.222 1.00 . A A . 9 GLY N 1 1 8 4531 1 1 9 GLY O O -1.492 -14.138 1.122 1.00 . A A . 9 GLY O 1 1 8 4532 1 1 10 GLU C C -4.540 -11.727 1.338 1.00 . A A . 10 GLU C 1 1 8 4533 1 1 10 GLU CA C -3.947 -12.948 0.640 1.00 . A A . 10 GLU CA 1 1 8 4534 1 1 10 GLU CB C -4.897 -13.432 -0.458 1.00 . A A . 10 GLU CB 1 1 8 4535 1 1 10 GLU CD C -3.899 -15.663 -1.099 1.00 . A A . 10 GLU CD 1 1 8 4536 1 1 10 GLU CG C -4.210 -14.246 -1.542 1.00 . A A . 10 GLU CG 1 1 8 4537 1 1 10 GLU H H -4.430 -14.372 2.130 1.00 . A A . 10 GLU H 1 1 8 4538 1 1 10 GLU HA H -3.006 -12.669 0.191 1.00 . A A . 10 GLU HA 1 1 8 4539 1 1 10 GLU HB2 H -5.665 -14.044 -0.009 1.00 . A A . 10 GLU HB2 1 1 8 4540 1 1 10 GLU HB3 H -5.359 -12.573 -0.921 1.00 . A A . 10 GLU HB3 1 1 8 4541 1 1 10 GLU HG2 H -4.856 -14.289 -2.406 1.00 . A A . 10 GLU HG2 1 1 8 4542 1 1 10 GLU HG3 H -3.285 -13.757 -1.809 1.00 . A A . 10 GLU HG3 1 1 8 4543 1 1 10 GLU N N -3.689 -14.019 1.595 1.00 . A A . 10 GLU N 1 1 8 4544 1 1 10 GLU O O -4.818 -11.758 2.537 1.00 . A A . 10 GLU O 1 1 8 4545 1 1 10 GLU OE1 O -4.851 -16.407 -0.781 1.00 . A A . 10 GLU OE1 1 1 8 4546 1 1 10 GLU OE2 O -2.705 -16.027 -1.070 1.00 . A A . 10 GLU OE2 1 1 8 4547 1 1 11 LYS C C -5.522 -8.396 0.017 1.00 . A A . 11 LYS C 1 1 8 4548 1 1 11 LYS CA C -5.289 -9.421 1.122 1.00 . A A . 11 LYS CA 1 1 8 4549 1 1 11 LYS CB C -4.356 -8.838 2.185 1.00 . A A . 11 LYS CB 1 1 8 4550 1 1 11 LYS CD C -2.014 -9.057 3.068 1.00 . A A . 11 LYS CD 1 1 8 4551 1 1 11 LYS CE C -0.752 -9.861 2.795 1.00 . A A . 11 LYS CE 1 1 8 4552 1 1 11 LYS CG C -2.884 -8.946 1.827 1.00 . A A . 11 LYS CG 1 1 8 4553 1 1 11 LYS H H -4.488 -10.691 -0.371 1.00 . A A . 11 LYS H 1 1 8 4554 1 1 11 LYS HA H -6.237 -9.661 1.580 1.00 . A A . 11 LYS HA 1 1 8 4555 1 1 11 LYS HB2 H -4.596 -7.794 2.324 1.00 . A A . 11 LYS HB2 1 1 8 4556 1 1 11 LYS HB3 H -4.517 -9.362 3.116 1.00 . A A . 11 LYS HB3 1 1 8 4557 1 1 11 LYS HD2 H -1.733 -8.065 3.391 1.00 . A A . 11 LYS HD2 1 1 8 4558 1 1 11 LYS HD3 H -2.579 -9.545 3.850 1.00 . A A . 11 LYS HD3 1 1 8 4559 1 1 11 LYS HE2 H -0.458 -10.364 3.703 1.00 . A A . 11 LYS HE2 1 1 8 4560 1 1 11 LYS HE3 H -0.966 -10.593 2.030 1.00 . A A . 11 LYS HE3 1 1 8 4561 1 1 11 LYS HG2 H -2.734 -9.824 1.216 1.00 . A A . 11 LYS HG2 1 1 8 4562 1 1 11 LYS HG3 H -2.592 -8.065 1.272 1.00 . A A . 11 LYS HG3 1 1 8 4563 1 1 11 LYS HZ1 H 1.279 -9.397 2.637 1.00 . A A . 11 LYS HZ1 1 1 8 4564 1 1 11 LYS HZ2 H 0.272 -8.041 2.742 1.00 . A A . 11 LYS HZ2 1 1 8 4565 1 1 11 LYS HZ3 H 0.361 -8.918 1.299 1.00 . A A . 11 LYS HZ3 1 1 8 4566 1 1 11 LYS N N -4.730 -10.653 0.579 1.00 . A A . 11 LYS N 1 1 8 4567 1 1 11 LYS NZ N 0.369 -8.994 2.336 1.00 . A A . 11 LYS NZ 1 1 8 4568 1 1 11 LYS O O -4.888 -8.429 -1.037 1.00 . A A . 11 LYS O 1 1 8 4569 1 1 12 PRO C C -5.666 -5.388 -0.859 1.00 . A A . 12 PRO C 1 1 8 4570 1 1 12 PRO CA C -6.789 -6.408 -0.699 1.00 . A A . 12 PRO CA 1 1 8 4571 1 1 12 PRO CB C -8.027 -5.749 -0.085 1.00 . A A . 12 PRO CB 1 1 8 4572 1 1 12 PRO CD C -7.248 -7.361 1.498 1.00 . A A . 12 PRO CD 1 1 8 4573 1 1 12 PRO CG C -7.914 -6.019 1.375 1.00 . A A . 12 PRO CG 1 1 8 4574 1 1 12 PRO HA H -7.040 -6.819 -1.666 1.00 . A A . 12 PRO HA 1 1 8 4575 1 1 12 PRO HB2 H -8.013 -4.688 -0.294 1.00 . A A . 12 PRO HB2 1 1 8 4576 1 1 12 PRO HB3 H -8.919 -6.192 -0.501 1.00 . A A . 12 PRO HB3 1 1 8 4577 1 1 12 PRO HD2 H -6.611 -7.388 2.370 1.00 . A A . 12 PRO HD2 1 1 8 4578 1 1 12 PRO HD3 H -7.987 -8.147 1.544 1.00 . A A . 12 PRO HD3 1 1 8 4579 1 1 12 PRO HG2 H -7.311 -5.257 1.845 1.00 . A A . 12 PRO HG2 1 1 8 4580 1 1 12 PRO HG3 H -8.898 -6.048 1.820 1.00 . A A . 12 PRO HG3 1 1 8 4581 1 1 12 PRO N N -6.453 -7.462 0.262 1.00 . A A . 12 PRO N 1 1 8 4582 1 1 12 PRO O O -5.556 -4.728 -1.892 1.00 . A A . 12 PRO O 1 1 8 4583 1 1 13 TYR C C -2.466 -4.950 0.745 1.00 . A A . 13 TYR C 1 1 8 4584 1 1 13 TYR CA C -3.721 -4.325 0.145 1.00 . A A . 13 TYR CA 1 1 8 4585 1 1 13 TYR CB C -4.085 -3.051 0.909 1.00 . A A . 13 TYR CB 1 1 8 4586 1 1 13 TYR CD1 C -5.927 -1.834 -0.317 1.00 . A A . 13 TYR CD1 1 1 8 4587 1 1 13 TYR CD2 C -6.499 -3.052 1.650 1.00 . A A . 13 TYR CD2 1 1 8 4588 1 1 13 TYR CE1 C -7.246 -1.453 -0.471 1.00 . A A . 13 TYR CE1 1 1 8 4589 1 1 13 TYR CE2 C -7.821 -2.677 1.504 1.00 . A A . 13 TYR CE2 1 1 8 4590 1 1 13 TYR CG C -5.530 -2.637 0.744 1.00 . A A . 13 TYR CG 1 1 8 4591 1 1 13 TYR CZ C -8.189 -1.878 0.442 1.00 . A A . 13 TYR CZ 1 1 8 4592 1 1 13 TYR H H -4.974 -5.819 0.967 1.00 . A A . 13 TYR H 1 1 8 4593 1 1 13 TYR HA H -3.525 -4.070 -0.887 1.00 . A A . 13 TYR HA 1 1 8 4594 1 1 13 TYR HB2 H -3.903 -3.206 1.961 1.00 . A A . 13 TYR HB2 1 1 8 4595 1 1 13 TYR HB3 H -3.465 -2.239 0.557 1.00 . A A . 13 TYR HB3 1 1 8 4596 1 1 13 TYR HD1 H -5.186 -1.504 -1.031 1.00 . A A . 13 TYR HD1 1 1 8 4597 1 1 13 TYR HD2 H -6.207 -3.678 2.481 1.00 . A A . 13 TYR HD2 1 1 8 4598 1 1 13 TYR HE1 H -7.535 -0.828 -1.303 1.00 . A A . 13 TYR HE1 1 1 8 4599 1 1 13 TYR HE2 H -8.560 -3.009 2.218 1.00 . A A . 13 TYR HE2 1 1 8 4600 1 1 13 TYR HH H -9.774 -1.641 -0.620 1.00 . A A . 13 TYR HH 1 1 8 4601 1 1 13 TYR N N -4.835 -5.265 0.170 1.00 . A A . 13 TYR N 1 1 8 4602 1 1 13 TYR O O -2.546 -5.883 1.544 1.00 . A A . 13 TYR O 1 1 8 4603 1 1 13 TYR OH O -9.504 -1.502 0.291 1.00 . A A . 13 TYR OH 1 1 8 4604 1 1 14 GLU C C 1.126 -4.084 0.347 1.00 . A A . 14 GLU C 1 1 8 4605 1 1 14 GLU CA C -0.035 -4.936 0.852 1.00 . A A . 14 GLU CA 1 1 8 4606 1 1 14 GLU CB C 0.163 -6.392 0.425 1.00 . A A . 14 GLU CB 1 1 8 4607 1 1 14 GLU CD C 1.889 -8.141 -0.159 1.00 . A A . 14 GLU CD 1 1 8 4608 1 1 14 GLU CG C 1.568 -6.913 0.672 1.00 . A A . 14 GLU CG 1 1 8 4609 1 1 14 GLU H H -1.309 -3.686 -0.286 1.00 . A A . 14 GLU H 1 1 8 4610 1 1 14 GLU HA H -0.058 -4.887 1.930 1.00 . A A . 14 GLU HA 1 1 8 4611 1 1 14 GLU HB2 H -0.532 -7.012 0.972 1.00 . A A . 14 GLU HB2 1 1 8 4612 1 1 14 GLU HB3 H -0.049 -6.475 -0.631 1.00 . A A . 14 GLU HB3 1 1 8 4613 1 1 14 GLU HG2 H 2.275 -6.136 0.425 1.00 . A A . 14 GLU HG2 1 1 8 4614 1 1 14 GLU HG3 H 1.665 -7.169 1.717 1.00 . A A . 14 GLU HG3 1 1 8 4615 1 1 14 GLU N N -1.308 -4.429 0.353 1.00 . A A . 14 GLU N 1 1 8 4616 1 1 14 GLU O O 1.077 -3.540 -0.757 1.00 . A A . 14 GLU O 1 1 8 4617 1 1 14 GLU OE1 O 1.428 -8.211 -1.317 1.00 . A A . 14 GLU OE1 1 1 8 4618 1 1 14 GLU OE2 O 2.602 -9.031 0.350 1.00 . A A . 14 GLU OE2 1 1 8 4619 1 1 15 CYS C C 4.330 -4.024 -0.009 1.00 . A A . 15 CYS C 1 1 8 4620 1 1 15 CYS CA C 3.343 -3.187 0.800 1.00 . A A . 15 CYS CA 1 1 8 4621 1 1 15 CYS CB C 4.028 -2.645 2.056 1.00 . A A . 15 CYS CB 1 1 8 4622 1 1 15 CYS H H 2.150 -4.430 2.029 1.00 . A A . 15 CYS H 1 1 8 4623 1 1 15 CYS HA H 3.013 -2.357 0.194 1.00 . A A . 15 CYS HA 1 1 8 4624 1 1 15 CYS HB2 H 3.284 -2.494 2.825 1.00 . A A . 15 CYS HB2 1 1 8 4625 1 1 15 CYS HB3 H 4.753 -3.367 2.402 1.00 . A A . 15 CYS HB3 1 1 8 4626 1 1 15 CYS N N 2.170 -3.973 1.162 1.00 . A A . 15 CYS N 1 1 8 4627 1 1 15 CYS O O 4.794 -5.069 0.448 1.00 . A A . 15 CYS O 1 1 8 4628 1 1 15 CYS SG S 4.895 -1.063 1.807 1.00 . A A . 15 CYS SG 1 1 8 4629 1 1 16 ASP C C 7.020 -3.962 -1.693 1.00 . A A . 16 ASP C 1 1 8 4630 1 1 16 ASP CA C 5.577 -4.262 -2.085 1.00 . A A . 16 ASP CA 1 1 8 4631 1 1 16 ASP CB C 5.339 -3.869 -3.544 1.00 . A A . 16 ASP CB 1 1 8 4632 1 1 16 ASP CG C 5.741 -4.964 -4.512 1.00 . A A . 16 ASP CG 1 1 8 4633 1 1 16 ASP H H 4.241 -2.719 -1.521 1.00 . A A . 16 ASP H 1 1 8 4634 1 1 16 ASP HA H 5.400 -5.321 -1.974 1.00 . A A . 16 ASP HA 1 1 8 4635 1 1 16 ASP HB2 H 4.290 -3.656 -3.686 1.00 . A A . 16 ASP HB2 1 1 8 4636 1 1 16 ASP HB3 H 5.916 -2.984 -3.770 1.00 . A A . 16 ASP HB3 1 1 8 4637 1 1 16 ASP N N 4.645 -3.558 -1.213 1.00 . A A . 16 ASP N 1 1 8 4638 1 1 16 ASP O O 7.951 -4.244 -2.449 1.00 . A A . 16 ASP O 1 1 8 4639 1 1 16 ASP OD1 O 4.944 -5.906 -4.707 1.00 . A A . 16 ASP OD1 1 1 8 4640 1 1 16 ASP OD2 O 6.852 -4.879 -5.076 1.00 . A A . 16 ASP OD2 1 1 8 4641 1 1 17 VAL C C 8.861 -3.831 1.252 1.00 . A A . 17 VAL C 1 1 8 4642 1 1 17 VAL CA C 8.529 -3.050 -0.015 1.00 . A A . 17 VAL CA 1 1 8 4643 1 1 17 VAL CB C 8.654 -1.543 0.276 1.00 . A A . 17 VAL CB 1 1 8 4644 1 1 17 VAL CG1 C 10.036 -1.216 0.821 1.00 . A A . 17 VAL CG1 1 1 8 4645 1 1 17 VAL CG2 C 8.360 -0.733 -0.978 1.00 . A A . 17 VAL CG2 1 1 8 4646 1 1 17 VAL H H 6.418 -3.189 0.049 1.00 . A A . 17 VAL H 1 1 8 4647 1 1 17 VAL HA H 9.245 -3.308 -0.783 1.00 . A A . 17 VAL HA 1 1 8 4648 1 1 17 VAL HB H 7.923 -1.281 1.028 1.00 . A A . 17 VAL HB 1 1 8 4649 1 1 17 VAL HG11 H 10.752 -1.226 0.013 1.00 . A A . 17 VAL HG11 1 1 8 4650 1 1 17 VAL HG12 H 10.020 -0.238 1.279 1.00 . A A . 17 VAL HG12 1 1 8 4651 1 1 17 VAL HG13 H 10.316 -1.955 1.557 1.00 . A A . 17 VAL HG13 1 1 8 4652 1 1 17 VAL HG21 H 8.068 0.269 -0.699 1.00 . A A . 17 VAL HG21 1 1 8 4653 1 1 17 VAL HG22 H 9.246 -0.691 -1.594 1.00 . A A . 17 VAL HG22 1 1 8 4654 1 1 17 VAL HG23 H 7.559 -1.201 -1.530 1.00 . A A . 17 VAL HG23 1 1 8 4655 1 1 17 VAL N N 7.199 -3.389 -0.508 1.00 . A A . 17 VAL N 1 1 8 4656 1 1 17 VAL O O 9.991 -4.282 1.438 1.00 . A A . 17 VAL O 1 1 8 4657 1 1 18 CYS C C 7.096 -5.899 3.458 1.00 . A A . 18 CYS C 1 1 8 4658 1 1 18 CYS CA C 8.053 -4.713 3.371 1.00 . A A . 18 CYS CA 1 1 8 4659 1 1 18 CYS CB C 7.834 -3.780 4.564 1.00 . A A . 18 CYS CB 1 1 8 4660 1 1 18 CYS H H 6.988 -3.604 1.916 1.00 . A A . 18 CYS H 1 1 8 4661 1 1 18 CYS HA H 9.067 -5.081 3.395 1.00 . A A . 18 CYS HA 1 1 8 4662 1 1 18 CYS HB2 H 7.891 -4.355 5.477 1.00 . A A . 18 CYS HB2 1 1 8 4663 1 1 18 CYS HB3 H 8.610 -3.028 4.570 1.00 . A A . 18 CYS HB3 1 1 8 4664 1 1 18 CYS N N 7.868 -3.987 2.121 1.00 . A A . 18 CYS N 1 1 8 4665 1 1 18 CYS O O 7.164 -6.697 4.394 1.00 . A A . 18 CYS O 1 1 8 4666 1 1 18 CYS SG S 6.228 -2.920 4.552 1.00 . A A . 18 CYS SG 1 1 8 4667 1 1 19 ARG C C 4.312 -7.037 3.654 1.00 . A A . 19 ARG C 1 1 8 4668 1 1 19 ARG CA C 5.237 -7.096 2.442 1.00 . A A . 19 ARG CA 1 1 8 4669 1 1 19 ARG CB C 5.954 -8.446 2.398 1.00 . A A . 19 ARG CB 1 1 8 4670 1 1 19 ARG CD C 7.285 -7.882 0.343 1.00 . A A . 19 ARG CD 1 1 8 4671 1 1 19 ARG CG C 6.345 -8.883 0.996 1.00 . A A . 19 ARG CG 1 1 8 4672 1 1 19 ARG CZ C 8.769 -7.884 -1.618 1.00 . A A . 19 ARG CZ 1 1 8 4673 1 1 19 ARG H H 6.203 -5.341 1.759 1.00 . A A . 19 ARG H 1 1 8 4674 1 1 19 ARG HA H 4.644 -6.983 1.546 1.00 . A A . 19 ARG HA 1 1 8 4675 1 1 19 ARG HB2 H 6.852 -8.384 2.995 1.00 . A A . 19 ARG HB2 1 1 8 4676 1 1 19 ARG HB3 H 5.304 -9.199 2.818 1.00 . A A . 19 ARG HB3 1 1 8 4677 1 1 19 ARG HD2 H 6.696 -7.144 -0.181 1.00 . A A . 19 ARG HD2 1 1 8 4678 1 1 19 ARG HD3 H 7.865 -7.398 1.113 1.00 . A A . 19 ARG HD3 1 1 8 4679 1 1 19 ARG HE H 8.384 -9.475 -0.478 1.00 . A A . 19 ARG HE 1 1 8 4680 1 1 19 ARG HG2 H 6.840 -9.841 1.052 1.00 . A A . 19 ARG HG2 1 1 8 4681 1 1 19 ARG HG3 H 5.453 -8.972 0.395 1.00 . A A . 19 ARG HG3 1 1 8 4682 1 1 19 ARG HH11 H 7.917 -6.101 -1.198 1.00 . A A . 19 ARG HH11 1 1 8 4683 1 1 19 ARG HH12 H 8.965 -6.116 -2.577 1.00 . A A . 19 ARG HH12 1 1 8 4684 1 1 19 ARG HH21 H 9.766 -9.508 -2.292 1.00 . A A . 19 ARG HH21 1 1 8 4685 1 1 19 ARG HH22 H 10.016 -8.054 -3.199 1.00 . A A . 19 ARG HH22 1 1 8 4686 1 1 19 ARG N N 6.207 -6.008 2.477 1.00 . A A . 19 ARG N 1 1 8 4687 1 1 19 ARG NE N 8.194 -8.522 -0.605 1.00 . A A . 19 ARG NE 1 1 8 4688 1 1 19 ARG NH1 N 8.530 -6.595 -1.814 1.00 . A A . 19 ARG NH1 1 1 8 4689 1 1 19 ARG NH2 N 9.584 -8.536 -2.437 1.00 . A A . 19 ARG NH2 1 1 8 4690 1 1 19 ARG O O 4.022 -8.059 4.277 1.00 . A A . 19 ARG O 1 1 8 4691 1 1 20 LYS C C 1.500 -5.735 4.688 1.00 . A A . 20 LYS C 1 1 8 4692 1 1 20 LYS CA C 2.960 -5.642 5.121 1.00 . A A . 20 LYS CA 1 1 8 4693 1 1 20 LYS CB C 3.223 -4.285 5.777 1.00 . A A . 20 LYS CB 1 1 8 4694 1 1 20 LYS CD C 4.249 -3.073 7.724 1.00 . A A . 20 LYS CD 1 1 8 4695 1 1 20 LYS CE C 5.605 -2.805 8.358 1.00 . A A . 20 LYS CE 1 1 8 4696 1 1 20 LYS CG C 4.270 -4.334 6.876 1.00 . A A . 20 LYS CG 1 1 8 4697 1 1 20 LYS H H 4.119 -5.058 3.449 1.00 . A A . 20 LYS H 1 1 8 4698 1 1 20 LYS HA H 3.161 -6.425 5.837 1.00 . A A . 20 LYS HA 1 1 8 4699 1 1 20 LYS HB2 H 3.557 -3.591 5.021 1.00 . A A . 20 LYS HB2 1 1 8 4700 1 1 20 LYS HB3 H 2.300 -3.921 6.205 1.00 . A A . 20 LYS HB3 1 1 8 4701 1 1 20 LYS HD2 H 3.985 -2.234 7.098 1.00 . A A . 20 LYS HD2 1 1 8 4702 1 1 20 LYS HD3 H 3.511 -3.187 8.505 1.00 . A A . 20 LYS HD3 1 1 8 4703 1 1 20 LYS HE2 H 6.368 -2.907 7.602 1.00 . A A . 20 LYS HE2 1 1 8 4704 1 1 20 LYS HE3 H 5.614 -1.796 8.744 1.00 . A A . 20 LYS HE3 1 1 8 4705 1 1 20 LYS HG2 H 4.073 -5.185 7.512 1.00 . A A . 20 LYS HG2 1 1 8 4706 1 1 20 LYS HG3 H 5.247 -4.438 6.426 1.00 . A A . 20 LYS HG3 1 1 8 4707 1 1 20 LYS HZ1 H 6.369 -3.254 10.249 1.00 . A A . 20 LYS HZ1 1 1 8 4708 1 1 20 LYS HZ2 H 6.511 -4.519 9.135 1.00 . A A . 20 LYS HZ2 1 1 8 4709 1 1 20 LYS HZ3 H 5.009 -4.166 9.826 1.00 . A A . 20 LYS HZ3 1 1 8 4710 1 1 20 LYS N N 3.852 -5.835 3.984 1.00 . A A . 20 LYS N 1 1 8 4711 1 1 20 LYS NZ N 5.894 -3.752 9.470 1.00 . A A . 20 LYS NZ 1 1 8 4712 1 1 20 LYS O O 1.203 -5.947 3.513 1.00 . A A . 20 LYS O 1 1 8 4713 1 1 21 ALA C C -1.584 -4.505 6.059 1.00 . A A . 21 ALA C 1 1 8 4714 1 1 21 ALA CA C -0.836 -5.636 5.362 1.00 . A A . 21 ALA CA 1 1 8 4715 1 1 21 ALA CB C -1.400 -6.984 5.787 1.00 . A A . 21 ALA CB 1 1 8 4716 1 1 21 ALA H H 0.891 -5.408 6.564 1.00 . A A . 21 ALA H 1 1 8 4717 1 1 21 ALA HA H -0.969 -5.538 4.294 1.00 . A A . 21 ALA HA 1 1 8 4718 1 1 21 ALA HB1 H -0.924 -7.769 5.218 1.00 . A A . 21 ALA HB1 1 1 8 4719 1 1 21 ALA HB2 H -1.212 -7.137 6.840 1.00 . A A . 21 ALA HB2 1 1 8 4720 1 1 21 ALA HB3 H -2.464 -7.002 5.605 1.00 . A A . 21 ALA HB3 1 1 8 4721 1 1 21 ALA N N 0.592 -5.574 5.646 1.00 . A A . 21 ALA N 1 1 8 4722 1 1 21 ALA O O -1.199 -4.069 7.145 1.00 . A A . 21 ALA O 1 1 8 4723 1 1 22 PHE C C -4.941 -3.188 5.739 1.00 . A A . 22 PHE C 1 1 8 4724 1 1 22 PHE CA C -3.455 -2.949 5.988 1.00 . A A . 22 PHE CA 1 1 8 4725 1 1 22 PHE CB C -3.033 -1.609 5.381 1.00 . A A . 22 PHE CB 1 1 8 4726 1 1 22 PHE CD1 C -0.572 -1.969 5.049 1.00 . A A . 22 PHE CD1 1 1 8 4727 1 1 22 PHE CD2 C -1.275 -0.209 6.496 1.00 . A A . 22 PHE CD2 1 1 8 4728 1 1 22 PHE CE1 C 0.749 -1.645 5.291 1.00 . A A . 22 PHE CE1 1 1 8 4729 1 1 22 PHE CE2 C 0.045 0.120 6.742 1.00 . A A . 22 PHE CE2 1 1 8 4730 1 1 22 PHE CG C -1.598 -1.255 5.647 1.00 . A A . 22 PHE CG 1 1 8 4731 1 1 22 PHE CZ C 1.058 -0.600 6.140 1.00 . A A . 22 PHE CZ 1 1 8 4732 1 1 22 PHE H H -2.910 -4.421 4.566 1.00 . A A . 22 PHE H 1 1 8 4733 1 1 22 PHE HA H -3.279 -2.924 7.052 1.00 . A A . 22 PHE HA 1 1 8 4734 1 1 22 PHE HB2 H -3.172 -1.647 4.311 1.00 . A A . 22 PHE HB2 1 1 8 4735 1 1 22 PHE HB3 H -3.652 -0.826 5.792 1.00 . A A . 22 PHE HB3 1 1 8 4736 1 1 22 PHE HD1 H -0.813 -2.787 4.384 1.00 . A A . 22 PHE HD1 1 1 8 4737 1 1 22 PHE HD2 H -2.067 0.354 6.968 1.00 . A A . 22 PHE HD2 1 1 8 4738 1 1 22 PHE HE1 H 1.539 -2.210 4.819 1.00 . A A . 22 PHE HE1 1 1 8 4739 1 1 22 PHE HE2 H 0.283 0.937 7.406 1.00 . A A . 22 PHE HE2 1 1 8 4740 1 1 22 PHE HZ H 2.090 -0.345 6.330 1.00 . A A . 22 PHE HZ 1 1 8 4741 1 1 22 PHE N N -2.654 -4.032 5.428 1.00 . A A . 22 PHE N 1 1 8 4742 1 1 22 PHE O O -5.321 -4.108 5.015 1.00 . A A . 22 PHE O 1 1 8 4743 1 1 23 SER C C -7.770 -1.374 5.294 1.00 . A A . 23 SER C 1 1 8 4744 1 1 23 SER CA C -7.223 -2.475 6.197 1.00 . A A . 23 SER CA 1 1 8 4745 1 1 23 SER CB C -7.907 -2.416 7.564 1.00 . A A . 23 SER CB 1 1 8 4746 1 1 23 SER H H -5.414 -1.639 6.912 1.00 . A A . 23 SER H 1 1 8 4747 1 1 23 SER HA H -7.429 -3.433 5.742 1.00 . A A . 23 SER HA 1 1 8 4748 1 1 23 SER HB2 H -7.595 -3.263 8.156 1.00 . A A . 23 SER HB2 1 1 8 4749 1 1 23 SER HB3 H -7.623 -1.502 8.066 1.00 . A A . 23 SER HB3 1 1 8 4750 1 1 23 SER HG H -9.720 -2.049 8.207 1.00 . A A . 23 SER HG 1 1 8 4751 1 1 23 SER N N -5.778 -2.353 6.347 1.00 . A A . 23 SER N 1 1 8 4752 1 1 23 SER O O -8.601 -1.626 4.421 1.00 . A A . 23 SER O 1 1 8 4753 1 1 23 SER OG O -9.317 -2.445 7.431 1.00 . A A . 23 SER OG 1 1 8 4754 1 1 24 HIS C C -6.767 1.264 3.572 1.00 . A A . 24 HIS C 1 1 8 4755 1 1 24 HIS CA C -7.738 0.991 4.716 1.00 . A A . 24 HIS CA 1 1 8 4756 1 1 24 HIS CB C -7.868 2.233 5.599 1.00 . A A . 24 HIS CB 1 1 8 4757 1 1 24 HIS CD2 C -9.617 3.245 3.973 1.00 . A A . 24 HIS CD2 1 1 8 4758 1 1 24 HIS CE1 C -10.273 4.929 5.214 1.00 . A A . 24 HIS CE1 1 1 8 4759 1 1 24 HIS CG C -8.916 3.195 5.129 1.00 . A A . 24 HIS CG 1 1 8 4760 1 1 24 HIS H H -6.637 -0.012 6.221 1.00 . A A . 24 HIS H 1 1 8 4761 1 1 24 HIS HA H -8.706 0.753 4.301 1.00 . A A . 24 HIS HA 1 1 8 4762 1 1 24 HIS HB2 H -8.123 1.929 6.603 1.00 . A A . 24 HIS HB2 1 1 8 4763 1 1 24 HIS HB3 H -6.921 2.755 5.616 1.00 . A A . 24 HIS HB3 1 1 8 4764 1 1 24 HIS HD1 H -9.029 4.499 6.780 1.00 . A A . 24 HIS HD1 1 1 8 4765 1 1 24 HIS HD2 H -9.535 2.558 3.142 1.00 . A A . 24 HIS HD2 1 1 8 4766 1 1 24 HIS HE1 H -10.792 5.811 5.558 1.00 . A A . 24 HIS HE1 1 1 8 4767 1 1 24 HIS N N -7.298 -0.150 5.510 1.00 . A A . 24 HIS N 1 1 8 4768 1 1 24 HIS ND1 N -9.349 4.264 5.885 1.00 . A A . 24 HIS ND1 1 1 8 4769 1 1 24 HIS NE2 N -10.454 4.331 4.050 1.00 . A A . 24 HIS NE2 1 1 8 4770 1 1 24 HIS O O -5.583 1.519 3.796 1.00 . A A . 24 HIS O 1 1 8 4771 1 1 25 HIS C C -5.456 2.579 1.419 1.00 . A A . 25 HIS C 1 1 8 4772 1 1 25 HIS CA C -6.452 1.451 1.165 1.00 . A A . 25 HIS CA 1 1 8 4773 1 1 25 HIS CB C -7.333 1.793 -0.036 1.00 . A A . 25 HIS CB 1 1 8 4774 1 1 25 HIS CD2 C -6.319 3.188 -1.974 1.00 . A A . 25 HIS CD2 1 1 8 4775 1 1 25 HIS CE1 C -5.333 1.559 -3.060 1.00 . A A . 25 HIS CE1 1 1 8 4776 1 1 25 HIS CG C -6.560 2.042 -1.295 1.00 . A A . 25 HIS CG 1 1 8 4777 1 1 25 HIS H H -8.226 1.002 2.230 1.00 . A A . 25 HIS H 1 1 8 4778 1 1 25 HIS HA H -5.904 0.545 0.952 1.00 . A A . 25 HIS HA 1 1 8 4779 1 1 25 HIS HB2 H -8.013 0.974 -0.221 1.00 . A A . 25 HIS HB2 1 1 8 4780 1 1 25 HIS HB3 H -7.903 2.684 0.186 1.00 . A A . 25 HIS HB3 1 1 8 4781 1 1 25 HIS HD1 H -5.920 0.090 -1.762 1.00 . A A . 25 HIS HD1 1 1 8 4782 1 1 25 HIS HD2 H -6.664 4.177 -1.706 1.00 . A A . 25 HIS HD2 1 1 8 4783 1 1 25 HIS HE1 H -4.762 1.012 -3.795 1.00 . A A . 25 HIS HE1 1 1 8 4784 1 1 25 HIS N N -7.275 1.209 2.345 1.00 . A A . 25 HIS N 1 1 8 4785 1 1 25 HIS ND1 N -5.930 1.040 -2.001 1.00 . A A . 25 HIS ND1 1 1 8 4786 1 1 25 HIS NE2 N -5.554 2.861 -3.066 1.00 . A A . 25 HIS NE2 1 1 8 4787 1 1 25 HIS O O -4.249 2.401 1.262 1.00 . A A . 25 HIS O 1 1 8 4788 1 1 26 ALA C C -3.994 4.532 3.041 1.00 . A A . 26 ALA C 1 1 8 4789 1 1 26 ALA CA C -5.128 4.895 2.087 1.00 . A A . 26 ALA CA 1 1 8 4790 1 1 26 ALA CB C -5.961 6.031 2.663 1.00 . A A . 26 ALA CB 1 1 8 4791 1 1 26 ALA H H -6.942 3.819 1.918 1.00 . A A . 26 ALA H 1 1 8 4792 1 1 26 ALA HA H -4.704 5.231 1.152 1.00 . A A . 26 ALA HA 1 1 8 4793 1 1 26 ALA HB1 H -5.973 6.856 1.967 1.00 . A A . 26 ALA HB1 1 1 8 4794 1 1 26 ALA HB2 H -6.971 5.686 2.831 1.00 . A A . 26 ALA HB2 1 1 8 4795 1 1 26 ALA HB3 H -5.530 6.355 3.599 1.00 . A A . 26 ALA HB3 1 1 8 4796 1 1 26 ALA N N -5.972 3.739 1.811 1.00 . A A . 26 ALA N 1 1 8 4797 1 1 26 ALA O O -2.823 4.773 2.748 1.00 . A A . 26 ALA O 1 1 8 4798 1 1 27 SER C C -2.111 2.996 4.515 1.00 . A A . 27 SER C 1 1 8 4799 1 1 27 SER CA C -3.363 3.560 5.181 1.00 . A A . 27 SER CA 1 1 8 4800 1 1 27 SER CB C -3.957 2.524 6.137 1.00 . A A . 27 SER CB 1 1 8 4801 1 1 27 SER H H -5.300 3.787 4.358 1.00 . A A . 27 SER H 1 1 8 4802 1 1 27 SER HA H -3.091 4.442 5.743 1.00 . A A . 27 SER HA 1 1 8 4803 1 1 27 SER HB2 H -4.288 1.666 5.573 1.00 . A A . 27 SER HB2 1 1 8 4804 1 1 27 SER HB3 H -3.201 2.219 6.847 1.00 . A A . 27 SER HB3 1 1 8 4805 1 1 27 SER HG H -5.096 2.671 7.724 1.00 . A A . 27 SER HG 1 1 8 4806 1 1 27 SER N N -4.350 3.952 4.183 1.00 . A A . 27 SER N 1 1 8 4807 1 1 27 SER O O -1.009 3.093 5.056 1.00 . A A . 27 SER O 1 1 8 4808 1 1 27 SER OG O -5.061 3.059 6.847 1.00 . A A . 27 SER OG 1 1 8 4809 1 1 28 LEU C C -0.387 2.906 1.865 1.00 . A A . 28 LEU C 1 1 8 4810 1 1 28 LEU CA C -1.176 1.825 2.597 1.00 . A A . 28 LEU CA 1 1 8 4811 1 1 28 LEU CB C -1.689 0.787 1.598 1.00 . A A . 28 LEU CB 1 1 8 4812 1 1 28 LEU CD1 C 0.212 -0.846 1.630 1.00 . A A . 28 LEU CD1 1 1 8 4813 1 1 28 LEU CD2 C -1.271 -0.698 -0.378 1.00 . A A . 28 LEU CD2 1 1 8 4814 1 1 28 LEU CG C -0.625 0.078 0.760 1.00 . A A . 28 LEU CG 1 1 8 4815 1 1 28 LEU H H -3.192 2.359 2.959 1.00 . A A . 28 LEU H 1 1 8 4816 1 1 28 LEU HA H -0.524 1.338 3.307 1.00 . A A . 28 LEU HA 1 1 8 4817 1 1 28 LEU HB2 H -2.229 0.034 2.151 1.00 . A A . 28 LEU HB2 1 1 8 4818 1 1 28 LEU HB3 H -2.366 1.288 0.920 1.00 . A A . 28 LEU HB3 1 1 8 4819 1 1 28 LEU HD11 H 0.264 -1.822 1.173 1.00 . A A . 28 LEU HD11 1 1 8 4820 1 1 28 LEU HD12 H -0.242 -0.930 2.607 1.00 . A A . 28 LEU HD12 1 1 8 4821 1 1 28 LEU HD13 H 1.209 -0.441 1.731 1.00 . A A . 28 LEU HD13 1 1 8 4822 1 1 28 LEU HD21 H -2.243 -0.279 -0.594 1.00 . A A . 28 LEU HD21 1 1 8 4823 1 1 28 LEU HD22 H -1.381 -1.733 -0.090 1.00 . A A . 28 LEU HD22 1 1 8 4824 1 1 28 LEU HD23 H -0.647 -0.634 -1.258 1.00 . A A . 28 LEU HD23 1 1 8 4825 1 1 28 LEU HG H 0.036 0.818 0.328 1.00 . A A . 28 LEU HG 1 1 8 4826 1 1 28 LEU N N -2.290 2.406 3.339 1.00 . A A . 28 LEU N 1 1 8 4827 1 1 28 LEU O O 0.822 3.044 2.055 1.00 . A A . 28 LEU O 1 1 8 4828 1 1 29 THR C C 0.253 5.733 1.192 1.00 . A A . 29 THR C 1 1 8 4829 1 1 29 THR CA C -0.444 4.741 0.268 1.00 . A A . 29 THR CA 1 1 8 4830 1 1 29 THR CB C -1.467 5.497 -0.601 1.00 . A A . 29 THR CB 1 1 8 4831 1 1 29 THR CG2 C -2.281 6.467 0.242 1.00 . A A . 29 THR CG2 1 1 8 4832 1 1 29 THR H H -2.040 3.513 0.919 1.00 . A A . 29 THR H 1 1 8 4833 1 1 29 THR HA H 0.292 4.295 -0.385 1.00 . A A . 29 THR HA 1 1 8 4834 1 1 29 THR HB H -2.139 4.778 -1.047 1.00 . A A . 29 THR HB 1 1 8 4835 1 1 29 THR HG1 H -1.193 6.001 -2.488 1.00 . A A . 29 THR HG1 1 1 8 4836 1 1 29 THR HG21 H -2.013 6.352 1.281 1.00 . A A . 29 THR HG21 1 1 8 4837 1 1 29 THR HG22 H -3.333 6.257 0.117 1.00 . A A . 29 THR HG22 1 1 8 4838 1 1 29 THR HG23 H -2.076 7.479 -0.074 1.00 . A A . 29 THR HG23 1 1 8 4839 1 1 29 THR N N -1.079 3.672 1.028 1.00 . A A . 29 THR N 1 1 8 4840 1 1 29 THR O O 1.135 6.478 0.765 1.00 . A A . 29 THR O 1 1 8 4841 1 1 29 THR OG1 O -0.792 6.213 -1.642 1.00 . A A . 29 THR OG1 1 1 8 4842 1 1 30 GLN C C 1.636 5.991 4.129 1.00 . A A . 30 GLN C 1 1 8 4843 1 1 30 GLN CA C 0.439 6.639 3.443 1.00 . A A . 30 GLN CA 1 1 8 4844 1 1 30 GLN CB C -0.606 7.040 4.486 1.00 . A A . 30 GLN CB 1 1 8 4845 1 1 30 GLN CD C -2.697 8.406 4.867 1.00 . A A . 30 GLN CD 1 1 8 4846 1 1 30 GLN CG C -1.385 8.292 4.116 1.00 . A A . 30 GLN CG 1 1 8 4847 1 1 30 GLN H H -0.856 5.120 2.738 1.00 . A A . 30 GLN H 1 1 8 4848 1 1 30 GLN HA H 0.773 7.524 2.923 1.00 . A A . 30 GLN HA 1 1 8 4849 1 1 30 GLN HB2 H -1.307 6.228 4.606 1.00 . A A . 30 GLN HB2 1 1 8 4850 1 1 30 GLN HB3 H -0.108 7.218 5.427 1.00 . A A . 30 GLN HB3 1 1 8 4851 1 1 30 GLN HE21 H -3.458 9.533 3.416 1.00 . A A . 30 GLN HE21 1 1 8 4852 1 1 30 GLN HE22 H -4.510 9.213 4.749 1.00 . A A . 30 GLN HE22 1 1 8 4853 1 1 30 GLN HG2 H -0.781 9.158 4.346 1.00 . A A . 30 GLN HG2 1 1 8 4854 1 1 30 GLN HG3 H -1.594 8.271 3.057 1.00 . A A . 30 GLN HG3 1 1 8 4855 1 1 30 GLN N N -0.149 5.737 2.459 1.00 . A A . 30 GLN N 1 1 8 4856 1 1 30 GLN NE2 N -3.652 9.124 4.286 1.00 . A A . 30 GLN NE2 1 1 8 4857 1 1 30 GLN O O 2.617 6.661 4.454 1.00 . A A . 30 GLN O 1 1 8 4858 1 1 30 GLN OE1 O -2.852 7.855 5.957 1.00 . A A . 30 GLN OE1 1 1 8 4859 1 1 31 HIS C C 3.865 3.893 4.104 1.00 . A A . 31 HIS C 1 1 8 4860 1 1 31 HIS CA C 2.628 3.943 4.995 1.00 . A A . 31 HIS CA 1 1 8 4861 1 1 31 HIS CB C 2.170 2.523 5.331 1.00 . A A . 31 HIS CB 1 1 8 4862 1 1 31 HIS CD2 C 3.870 0.718 4.570 1.00 . A A . 31 HIS CD2 1 1 8 4863 1 1 31 HIS CE1 C 4.909 0.431 6.480 1.00 . A A . 31 HIS CE1 1 1 8 4864 1 1 31 HIS CG C 3.298 1.548 5.474 1.00 . A A . 31 HIS CG 1 1 8 4865 1 1 31 HIS H H 0.744 4.203 4.065 1.00 . A A . 31 HIS H 1 1 8 4866 1 1 31 HIS HA H 2.879 4.457 5.910 1.00 . A A . 31 HIS HA 1 1 8 4867 1 1 31 HIS HB2 H 1.626 2.539 6.264 1.00 . A A . 31 HIS HB2 1 1 8 4868 1 1 31 HIS HB3 H 1.519 2.166 4.546 1.00 . A A . 31 HIS HB3 1 1 8 4869 1 1 31 HIS HD1 H 3.789 1.801 7.507 1.00 . A A . 31 HIS HD1 1 1 8 4870 1 1 31 HIS HD2 H 3.593 0.612 3.531 1.00 . A A . 31 HIS HD2 1 1 8 4871 1 1 31 HIS HE1 H 5.592 0.069 7.233 1.00 . A A . 31 HIS HE1 1 1 8 4872 1 1 31 HIS N N 1.550 4.682 4.347 1.00 . A A . 31 HIS N 1 1 8 4873 1 1 31 HIS ND1 N 3.971 1.344 6.660 1.00 . A A . 31 HIS ND1 1 1 8 4874 1 1 31 HIS NE2 N 4.868 0.034 5.220 1.00 . A A . 31 HIS NE2 1 1 8 4875 1 1 31 HIS O O 4.970 4.209 4.543 1.00 . A A . 31 HIS O 1 1 8 4876 1 1 32 GLN C C 5.732 4.576 2.063 1.00 . A A . 32 GLN C 1 1 8 4877 1 1 32 GLN CA C 4.772 3.402 1.899 1.00 . A A . 32 GLN CA 1 1 8 4878 1 1 32 GLN CB C 4.234 3.363 0.468 1.00 . A A . 32 GLN CB 1 1 8 4879 1 1 32 GLN CD C 3.538 1.733 -1.333 1.00 . A A . 32 GLN CD 1 1 8 4880 1 1 32 GLN CG C 3.472 2.090 0.139 1.00 . A A . 32 GLN CG 1 1 8 4881 1 1 32 GLN H H 2.766 3.256 2.560 1.00 . A A . 32 GLN H 1 1 8 4882 1 1 32 GLN HA H 5.306 2.486 2.099 1.00 . A A . 32 GLN HA 1 1 8 4883 1 1 32 GLN HB2 H 3.571 4.202 0.322 1.00 . A A . 32 GLN HB2 1 1 8 4884 1 1 32 GLN HB3 H 5.065 3.446 -0.218 1.00 . A A . 32 GLN HB3 1 1 8 4885 1 1 32 GLN HE21 H 2.968 -0.129 -0.933 1.00 . A A . 32 GLN HE21 1 1 8 4886 1 1 32 GLN HE22 H 3.257 0.226 -2.598 1.00 . A A . 32 GLN HE22 1 1 8 4887 1 1 32 GLN HG2 H 3.893 1.275 0.710 1.00 . A A . 32 GLN HG2 1 1 8 4888 1 1 32 GLN HG3 H 2.436 2.224 0.416 1.00 . A A . 32 GLN HG3 1 1 8 4889 1 1 32 GLN N N 3.671 3.494 2.851 1.00 . A A . 32 GLN N 1 1 8 4890 1 1 32 GLN NE2 N 3.224 0.484 -1.654 1.00 . A A . 32 GLN NE2 1 1 8 4891 1 1 32 GLN O O 6.944 4.425 1.908 1.00 . A A . 32 GLN O 1 1 8 4892 1 1 32 GLN OE1 O 3.870 2.571 -2.172 1.00 . A A . 32 GLN OE1 1 1 8 4893 1 1 33 ARG C C 7.309 6.612 3.250 1.00 . A A . 33 ARG C 1 1 8 4894 1 1 33 ARG CA C 5.990 6.945 2.558 1.00 . A A . 33 ARG CA 1 1 8 4895 1 1 33 ARG CB C 5.220 7.983 3.377 1.00 . A A . 33 ARG CB 1 1 8 4896 1 1 33 ARG CD C 4.079 9.170 1.478 1.00 . A A . 33 ARG CD 1 1 8 4897 1 1 33 ARG CG C 3.888 8.378 2.762 1.00 . A A . 33 ARG CG 1 1 8 4898 1 1 33 ARG CZ C 3.113 11.215 0.514 1.00 . A A . 33 ARG CZ 1 1 8 4899 1 1 33 ARG H H 4.210 5.802 2.486 1.00 . A A . 33 ARG H 1 1 8 4900 1 1 33 ARG HA H 6.202 7.354 1.582 1.00 . A A . 33 ARG HA 1 1 8 4901 1 1 33 ARG HB2 H 5.032 7.582 4.362 1.00 . A A . 33 ARG HB2 1 1 8 4902 1 1 33 ARG HB3 H 5.827 8.872 3.469 1.00 . A A . 33 ARG HB3 1 1 8 4903 1 1 33 ARG HD2 H 5.010 9.714 1.542 1.00 . A A . 33 ARG HD2 1 1 8 4904 1 1 33 ARG HD3 H 4.122 8.481 0.648 1.00 . A A . 33 ARG HD3 1 1 8 4905 1 1 33 ARG HE H 2.127 9.925 1.672 1.00 . A A . 33 ARG HE 1 1 8 4906 1 1 33 ARG HG2 H 3.326 7.483 2.539 1.00 . A A . 33 ARG HG2 1 1 8 4907 1 1 33 ARG HG3 H 3.340 8.982 3.470 1.00 . A A . 33 ARG HG3 1 1 8 4908 1 1 33 ARG HH11 H 5.052 10.890 0.050 1.00 . A A . 33 ARG HH11 1 1 8 4909 1 1 33 ARG HH12 H 4.359 12.328 -0.624 1.00 . A A . 33 ARG HH12 1 1 8 4910 1 1 33 ARG HH21 H 1.203 11.815 0.791 1.00 . A A . 33 ARG HH21 1 1 8 4911 1 1 33 ARG HH22 H 2.170 12.854 -0.201 1.00 . A A . 33 ARG HH22 1 1 8 4912 1 1 33 ARG N N 5.182 5.745 2.376 1.00 . A A . 33 ARG N 1 1 8 4913 1 1 33 ARG NE N 2.991 10.118 1.252 1.00 . A A . 33 ARG NE 1 1 8 4914 1 1 33 ARG NH1 N 4.270 11.502 -0.067 1.00 . A A . 33 ARG NH1 1 1 8 4915 1 1 33 ARG NH2 N 2.077 12.028 0.355 1.00 . A A . 33 ARG NH2 1 1 8 4916 1 1 33 ARG O O 8.384 6.946 2.752 1.00 . A A . 33 ARG O 1 1 8 4917 1 1 34 VAL C C 9.541 5.159 4.233 1.00 . A A . 34 VAL C 1 1 8 4918 1 1 34 VAL CA C 8.404 5.574 5.160 1.00 . A A . 34 VAL CA 1 1 8 4919 1 1 34 VAL CB C 8.102 4.419 6.133 1.00 . A A . 34 VAL CB 1 1 8 4920 1 1 34 VAL CG1 C 6.943 4.781 7.049 1.00 . A A . 34 VAL CG1 1 1 8 4921 1 1 34 VAL CG2 C 7.806 3.140 5.364 1.00 . A A . 34 VAL CG2 1 1 8 4922 1 1 34 VAL H H 6.333 5.714 4.746 1.00 . A A . 34 VAL H 1 1 8 4923 1 1 34 VAL HA H 8.718 6.431 5.738 1.00 . A A . 34 VAL HA 1 1 8 4924 1 1 34 VAL HB H 8.977 4.252 6.744 1.00 . A A . 34 VAL HB 1 1 8 4925 1 1 34 VAL HG11 H 6.860 4.043 7.833 1.00 . A A . 34 VAL HG11 1 1 8 4926 1 1 34 VAL HG12 H 7.119 5.754 7.485 1.00 . A A . 34 VAL HG12 1 1 8 4927 1 1 34 VAL HG13 H 6.026 4.802 6.478 1.00 . A A . 34 VAL HG13 1 1 8 4928 1 1 34 VAL HG21 H 8.731 2.702 5.022 1.00 . A A . 34 VAL HG21 1 1 8 4929 1 1 34 VAL HG22 H 7.294 2.443 6.011 1.00 . A A . 34 VAL HG22 1 1 8 4930 1 1 34 VAL HG23 H 7.179 3.367 4.514 1.00 . A A . 34 VAL HG23 1 1 8 4931 1 1 34 VAL N N 7.218 5.952 4.400 1.00 . A A . 34 VAL N 1 1 8 4932 1 1 34 VAL O O 10.691 5.555 4.428 1.00 . A A . 34 VAL O 1 1 8 4933 1 1 35 HIS C C 10.468 4.948 1.193 1.00 . A A . 35 HIS C 1 1 8 4934 1 1 35 HIS CA C 10.207 3.893 2.263 1.00 . A A . 35 HIS CA 1 1 8 4935 1 1 35 HIS CB C 9.743 2.591 1.610 1.00 . A A . 35 HIS CB 1 1 8 4936 1 1 35 HIS CD2 C 7.853 1.100 2.576 1.00 . A A . 35 HIS CD2 1 1 8 4937 1 1 35 HIS CE1 C 8.921 0.322 4.326 1.00 . A A . 35 HIS CE1 1 1 8 4938 1 1 35 HIS CG C 9.095 1.638 2.567 1.00 . A A . 35 HIS CG 1 1 8 4939 1 1 35 HIS H H 8.280 4.080 3.120 1.00 . A A . 35 HIS H 1 1 8 4940 1 1 35 HIS HA H 11.125 3.708 2.801 1.00 . A A . 35 HIS HA 1 1 8 4941 1 1 35 HIS HB2 H 9.026 2.820 0.835 1.00 . A A . 35 HIS HB2 1 1 8 4942 1 1 35 HIS HB3 H 10.594 2.092 1.170 1.00 . A A . 35 HIS HB3 1 1 8 4943 1 1 35 HIS HD1 H 10.658 1.334 3.946 1.00 . A A . 35 HIS HD1 1 1 8 4944 1 1 35 HIS HD2 H 7.071 1.278 1.851 1.00 . A A . 35 HIS HD2 1 1 8 4945 1 1 35 HIS HE1 H 9.153 -0.217 5.232 1.00 . A A . 35 HIS HE1 1 1 8 4946 1 1 35 HIS N N 9.213 4.361 3.223 1.00 . A A . 35 HIS N 1 1 8 4947 1 1 35 HIS ND1 N 9.738 1.132 3.676 1.00 . A A . 35 HIS ND1 1 1 8 4948 1 1 35 HIS NE2 N 7.770 0.286 3.679 1.00 . A A . 35 HIS NE2 1 1 8 4949 1 1 35 HIS O O 9.546 5.398 0.513 1.00 . A A . 35 HIS O 1 1 8 4950 1 1 36 SER C C 13.140 5.784 -0.913 1.00 . A A . 36 SER C 1 1 8 4951 1 1 36 SER CA C 12.112 6.345 0.065 1.00 . A A . 36 SER CA 1 1 8 4952 1 1 36 SER CB C 12.678 7.583 0.763 1.00 . A A . 36 SER CB 1 1 8 4953 1 1 36 SER H H 12.421 4.943 1.622 1.00 . A A . 36 SER H 1 1 8 4954 1 1 36 SER HA H 11.225 6.625 -0.483 1.00 . A A . 36 SER HA 1 1 8 4955 1 1 36 SER HB2 H 12.031 7.858 1.583 1.00 . A A . 36 SER HB2 1 1 8 4956 1 1 36 SER HB3 H 13.665 7.360 1.142 1.00 . A A . 36 SER HB3 1 1 8 4957 1 1 36 SER HG H 13.080 8.366 -0.987 1.00 . A A . 36 SER HG 1 1 8 4958 1 1 36 SER N N 11.731 5.339 1.050 1.00 . A A . 36 SER N 1 1 8 4959 1 1 36 SER O O 12.950 5.835 -2.127 1.00 . A A . 36 SER O 1 1 8 4960 1 1 36 SER OG O 12.769 8.677 -0.133 1.00 . A A . 36 SER OG 1 1 8 4961 1 1 37 GLY C C 16.445 4.160 -0.406 1.00 . A A . 37 GLY C 1 1 8 4962 1 1 37 GLY CA C 15.274 4.688 -1.212 1.00 . A A . 37 GLY CA 1 1 8 4963 1 1 37 GLY H H 14.329 5.237 0.602 1.00 . A A . 37 GLY H 1 1 8 4964 1 1 37 GLY HA2 H 14.857 3.879 -1.793 1.00 . A A . 37 GLY HA2 1 1 8 4965 1 1 37 GLY HA3 H 15.632 5.454 -1.884 1.00 . A A . 37 GLY HA3 1 1 8 4966 1 1 37 GLY N N 14.232 5.250 -0.374 1.00 . A A . 37 GLY N 1 1 8 4967 1 1 37 GLY O O 17.135 3.236 -0.836 1.00 . A A . 37 GLY O 1 1 8 4968 1 1 38 GLU C C 19.105 4.462 0.911 1.00 . A A . 38 GLU C 1 1 8 4969 1 1 38 GLU CA C 17.766 4.332 1.630 1.00 . A A . 38 GLU CA 1 1 8 4970 1 1 38 GLU CB C 17.560 2.888 2.093 1.00 . A A . 38 GLU CB 1 1 8 4971 1 1 38 GLU CD C 16.805 1.408 3.995 1.00 . A A . 38 GLU CD 1 1 8 4972 1 1 38 GLU CG C 16.684 2.764 3.329 1.00 . A A . 38 GLU CG 1 1 8 4973 1 1 38 GLU H H 16.083 5.479 1.052 1.00 . A A . 38 GLU H 1 1 8 4974 1 1 38 GLU HA H 17.770 4.980 2.494 1.00 . A A . 38 GLU HA 1 1 8 4975 1 1 38 GLU HB2 H 17.100 2.328 1.293 1.00 . A A . 38 GLU HB2 1 1 8 4976 1 1 38 GLU HB3 H 18.524 2.454 2.316 1.00 . A A . 38 GLU HB3 1 1 8 4977 1 1 38 GLU HG2 H 16.974 3.524 4.038 1.00 . A A . 38 GLU HG2 1 1 8 4978 1 1 38 GLU HG3 H 15.654 2.917 3.041 1.00 . A A . 38 GLU HG3 1 1 8 4979 1 1 38 GLU N N 16.668 4.748 0.765 1.00 . A A . 38 GLU N 1 1 8 4980 1 1 38 GLU O O 19.970 3.593 1.024 1.00 . A A . 38 GLU O 1 1 8 4981 1 1 38 GLU OE1 O 17.852 1.147 4.624 1.00 . A A . 38 GLU OE1 1 1 8 4982 1 1 38 GLU OE2 O 15.853 0.607 3.889 1.00 . A A . 38 GLU OE2 1 1 8 4983 1 1 39 LYS C C 21.722 5.424 0.270 1.00 . A A . 39 LYS C 1 1 8 4984 1 1 39 LYS CA C 20.503 5.798 -0.567 1.00 . A A . 39 LYS CA 1 1 8 4985 1 1 39 LYS CB C 20.589 7.269 -0.982 1.00 . A A . 39 LYS CB 1 1 8 4986 1 1 39 LYS CD C 21.249 7.036 -3.394 1.00 . A A . 39 LYS CD 1 1 8 4987 1 1 39 LYS CE C 20.421 8.066 -4.147 1.00 . A A . 39 LYS CE 1 1 8 4988 1 1 39 LYS CG C 21.660 7.545 -2.023 1.00 . A A . 39 LYS CG 1 1 8 4989 1 1 39 LYS H H 18.543 6.210 0.120 1.00 . A A . 39 LYS H 1 1 8 4990 1 1 39 LYS HA H 20.487 5.183 -1.454 1.00 . A A . 39 LYS HA 1 1 8 4991 1 1 39 LYS HB2 H 19.635 7.572 -1.388 1.00 . A A . 39 LYS HB2 1 1 8 4992 1 1 39 LYS HB3 H 20.804 7.865 -0.107 1.00 . A A . 39 LYS HB3 1 1 8 4993 1 1 39 LYS HD2 H 22.137 6.816 -3.968 1.00 . A A . 39 LYS HD2 1 1 8 4994 1 1 39 LYS HD3 H 20.664 6.135 -3.274 1.00 . A A . 39 LYS HD3 1 1 8 4995 1 1 39 LYS HE2 H 19.889 7.569 -4.944 1.00 . A A . 39 LYS HE2 1 1 8 4996 1 1 39 LYS HE3 H 19.712 8.508 -3.462 1.00 . A A . 39 LYS HE3 1 1 8 4997 1 1 39 LYS HG2 H 21.825 8.611 -2.082 1.00 . A A . 39 LYS HG2 1 1 8 4998 1 1 39 LYS HG3 H 22.574 7.053 -1.725 1.00 . A A . 39 LYS HG3 1 1 8 4999 1 1 39 LYS HZ1 H 22.263 8.999 -4.459 1.00 . A A . 39 LYS HZ1 1 1 8 5000 1 1 39 LYS HZ2 H 20.957 10.071 -4.378 1.00 . A A . 39 LYS HZ2 1 1 8 5001 1 1 39 LYS HZ3 H 21.197 9.134 -5.765 1.00 . A A . 39 LYS HZ3 1 1 8 5002 1 1 39 LYS N N 19.270 5.553 0.171 1.00 . A A . 39 LYS N 1 1 8 5003 1 1 39 LYS NZ N 21.269 9.143 -4.728 1.00 . A A . 39 LYS NZ 1 1 8 5004 1 1 39 LYS O O 21.806 5.731 1.460 1.00 . A A . 39 LYS O 1 1 8 5005 1 1 40 PRO C C 24.834 5.489 0.648 1.00 . A A . 40 PRO C 1 1 8 5006 1 1 40 PRO CA C 23.923 4.316 0.304 1.00 . A A . 40 PRO CA 1 1 8 5007 1 1 40 PRO CB C 24.589 3.407 -0.732 1.00 . A A . 40 PRO CB 1 1 8 5008 1 1 40 PRO CD C 22.656 4.345 -1.780 1.00 . A A . 40 PRO CD 1 1 8 5009 1 1 40 PRO CG C 24.061 3.876 -2.043 1.00 . A A . 40 PRO CG 1 1 8 5010 1 1 40 PRO HA H 23.712 3.750 1.200 1.00 . A A . 40 PRO HA 1 1 8 5011 1 1 40 PRO HB2 H 25.663 3.518 -0.674 1.00 . A A . 40 PRO HB2 1 1 8 5012 1 1 40 PRO HB3 H 24.317 2.379 -0.542 1.00 . A A . 40 PRO HB3 1 1 8 5013 1 1 40 PRO HD2 H 22.415 5.187 -2.413 1.00 . A A . 40 PRO HD2 1 1 8 5014 1 1 40 PRO HD3 H 21.954 3.540 -1.936 1.00 . A A . 40 PRO HD3 1 1 8 5015 1 1 40 PRO HG2 H 24.665 4.691 -2.412 1.00 . A A . 40 PRO HG2 1 1 8 5016 1 1 40 PRO HG3 H 24.056 3.060 -2.750 1.00 . A A . 40 PRO HG3 1 1 8 5017 1 1 40 PRO N N 22.690 4.745 -0.363 1.00 . A A . 40 PRO N 1 1 8 5018 1 1 40 PRO O O 25.754 5.813 -0.103 1.00 . A A . 40 PRO O 1 1 8 5019 1 1 41 SER C C 26.848 6.898 2.294 1.00 . A A . 41 SER C 1 1 8 5020 1 1 41 SER CA C 25.368 7.261 2.229 1.00 . A A . 41 SER CA 1 1 8 5021 1 1 41 SER CB C 24.889 7.744 3.599 1.00 . A A . 41 SER CB 1 1 8 5022 1 1 41 SER H H 23.825 5.816 2.343 1.00 . A A . 41 SER H 1 1 8 5023 1 1 41 SER HA H 25.236 8.056 1.510 1.00 . A A . 41 SER HA 1 1 8 5024 1 1 41 SER HB2 H 24.573 6.896 4.187 1.00 . A A . 41 SER HB2 1 1 8 5025 1 1 41 SER HB3 H 25.700 8.250 4.103 1.00 . A A . 41 SER HB3 1 1 8 5026 1 1 41 SER HG H 23.935 9.202 2.703 1.00 . A A . 41 SER HG 1 1 8 5027 1 1 41 SER N N 24.573 6.122 1.787 1.00 . A A . 41 SER N 1 1 8 5028 1 1 41 SER O O 27.219 5.731 2.175 1.00 . A A . 41 SER O 1 1 8 5029 1 1 41 SER OG O 23.800 8.643 3.471 1.00 . A A . 41 SER OG 1 1 8 5030 1 1 42 GLY C C 29.910 8.961 2.725 1.00 . A A . 42 GLY C 1 1 8 5031 1 1 42 GLY CA C 29.122 7.676 2.563 1.00 . A A . 42 GLY CA 1 1 8 5032 1 1 42 GLY H H 27.339 8.819 2.573 1.00 . A A . 42 GLY H 1 1 8 5033 1 1 42 GLY HA2 H 29.326 7.032 3.405 1.00 . A A . 42 GLY HA2 1 1 8 5034 1 1 42 GLY HA3 H 29.445 7.181 1.658 1.00 . A A . 42 GLY HA3 1 1 8 5035 1 1 42 GLY N N 27.692 7.908 2.485 1.00 . A A . 42 GLY N 1 1 8 5036 1 1 42 GLY O O 30.271 9.357 3.833 1.00 . A A . 42 GLY O 1 1 8 5037 1 1 43 PRO C C 30.153 12.044 2.203 1.00 . A A . 43 PRO C 1 1 8 5038 1 1 43 PRO CA C 30.944 10.891 1.595 1.00 . A A . 43 PRO CA 1 1 8 5039 1 1 43 PRO CB C 31.201 11.145 0.107 1.00 . A A . 43 PRO CB 1 1 8 5040 1 1 43 PRO CD C 29.791 9.220 0.243 1.00 . A A . 43 PRO CD 1 1 8 5041 1 1 43 PRO CG C 30.100 10.429 -0.595 1.00 . A A . 43 PRO CG 1 1 8 5042 1 1 43 PRO HA H 31.887 10.789 2.112 1.00 . A A . 43 PRO HA 1 1 8 5043 1 1 43 PRO HB2 H 31.171 12.208 -0.089 1.00 . A A . 43 PRO HB2 1 1 8 5044 1 1 43 PRO HB3 H 32.167 10.750 -0.168 1.00 . A A . 43 PRO HB3 1 1 8 5045 1 1 43 PRO HD2 H 28.736 8.993 0.204 1.00 . A A . 43 PRO HD2 1 1 8 5046 1 1 43 PRO HD3 H 30.373 8.373 -0.088 1.00 . A A . 43 PRO HD3 1 1 8 5047 1 1 43 PRO HG2 H 29.233 11.068 -0.666 1.00 . A A . 43 PRO HG2 1 1 8 5048 1 1 43 PRO HG3 H 30.427 10.129 -1.580 1.00 . A A . 43 PRO HG3 1 1 8 5049 1 1 43 PRO N N 30.190 9.634 1.599 1.00 . A A . 43 PRO N 1 1 8 5050 1 1 43 PRO O O 28.974 12.227 1.902 1.00 . A A . 43 PRO O 1 1 8 5051 1 1 44 SER C C 30.063 15.140 2.764 1.00 . A A . 44 SER C 1 1 8 5052 1 1 44 SER CA C 30.167 13.952 3.715 1.00 . A A . 44 SER CA 1 1 8 5053 1 1 44 SER CB C 30.946 14.353 4.969 1.00 . A A . 44 SER CB 1 1 8 5054 1 1 44 SER H H 31.749 12.620 3.261 1.00 . A A . 44 SER H 1 1 8 5055 1 1 44 SER HA H 29.171 13.647 4.002 1.00 . A A . 44 SER HA 1 1 8 5056 1 1 44 SER HB2 H 30.355 15.044 5.551 1.00 . A A . 44 SER HB2 1 1 8 5057 1 1 44 SER HB3 H 31.153 13.472 5.558 1.00 . A A . 44 SER HB3 1 1 8 5058 1 1 44 SER HG H 32.840 14.303 4.472 1.00 . A A . 44 SER HG 1 1 8 5059 1 1 44 SER N N 30.810 12.818 3.061 1.00 . A A . 44 SER N 1 1 8 5060 1 1 44 SER O O 30.736 15.185 1.734 1.00 . A A . 44 SER O 1 1 8 5061 1 1 44 SER OG O 32.173 14.975 4.630 1.00 . A A . 44 SER OG 1 1 8 5062 1 1 45 SER C C 28.493 16.912 0.914 1.00 . A A . 45 SER C 1 1 8 5063 1 1 45 SER CA C 29.020 17.289 2.295 1.00 . A A . 45 SER CA 1 1 8 5064 1 1 45 SER CB C 30.333 18.063 2.159 1.00 . A A . 45 SER CB 1 1 8 5065 1 1 45 SER H H 28.708 16.007 3.951 1.00 . A A . 45 SER H 1 1 8 5066 1 1 45 SER HA H 28.292 17.916 2.787 1.00 . A A . 45 SER HA 1 1 8 5067 1 1 45 SER HB2 H 31.154 17.365 2.092 1.00 . A A . 45 SER HB2 1 1 8 5068 1 1 45 SER HB3 H 30.300 18.668 1.265 1.00 . A A . 45 SER HB3 1 1 8 5069 1 1 45 SER HG H 30.728 18.376 4.052 1.00 . A A . 45 SER HG 1 1 8 5070 1 1 45 SER N N 29.216 16.101 3.118 1.00 . A A . 45 SER N 1 1 8 5071 1 1 45 SER O O 28.973 17.411 -0.103 1.00 . A A . 45 SER O 1 1 8 5072 1 1 45 SER OG O 30.544 18.909 3.276 1.00 . A A . 45 SER OG 1 1 8 5073 1 1 46 GLY C C 25.676 16.377 -0.736 1.00 . A A . 46 GLY C 1 1 8 5074 1 1 46 GLY CA C 26.925 15.597 -0.374 1.00 . A A . 46 GLY CA 1 1 8 5075 1 1 46 GLY H H 27.159 15.663 1.730 1.00 . A A . 46 GLY H 1 1 8 5076 1 1 46 GLY HA2 H 27.658 15.728 -1.156 1.00 . A A . 46 GLY HA2 1 1 8 5077 1 1 46 GLY HA3 H 26.673 14.550 -0.302 1.00 . A A . 46 GLY HA3 1 1 8 5078 1 1 46 GLY N N 27.501 16.027 0.887 1.00 . A A . 46 GLY N 1 1 8 5079 1 1 46 GLY O O 24.586 15.986 -0.322 1.00 . A A . 46 GLY O 1 1 8 5080 2 2 1 ZN ZN ZN 6.110 -0.840 3.822 1.00 . B A . 181 ZN ZN 1 1 9 5081 1 1 1 GLY C C -2.595 -27.754 1.976 1.00 . A A . 1 GLY C 1 1 9 5082 1 1 1 GLY CA C -2.032 -28.758 2.962 1.00 . A A . 1 GLY CA 1 1 9 5083 1 1 1 GLY H1 H -1.919 -30.348 1.569 1.00 . A A . 1 GLY H1 1 1 9 5084 1 1 1 GLY HA2 H -2.559 -28.661 3.900 1.00 . A A . 1 GLY HA2 1 1 9 5085 1 1 1 GLY HA3 H -0.987 -28.539 3.124 1.00 . A A . 1 GLY HA3 1 1 9 5086 1 1 1 GLY N N -2.156 -30.126 2.493 1.00 . A A . 1 GLY N 1 1 9 5087 1 1 1 GLY O O -3.758 -27.362 2.075 1.00 . A A . 1 GLY O 1 1 9 5088 1 1 2 SER C C -2.933 -27.052 -1.121 1.00 . A A . 2 SER C 1 1 9 5089 1 1 2 SER CA C -2.188 -26.365 0.019 1.00 . A A . 2 SER CA 1 1 9 5090 1 1 2 SER CB C -0.977 -25.609 -0.530 1.00 . A A . 2 SER CB 1 1 9 5091 1 1 2 SER H H -0.852 -27.684 0.998 1.00 . A A . 2 SER H 1 1 9 5092 1 1 2 SER HA H -2.855 -25.661 0.496 1.00 . A A . 2 SER HA 1 1 9 5093 1 1 2 SER HB2 H -0.257 -26.317 -0.911 1.00 . A A . 2 SER HB2 1 1 9 5094 1 1 2 SER HB3 H -1.295 -24.955 -1.328 1.00 . A A . 2 SER HB3 1 1 9 5095 1 1 2 SER HG H 0.359 -24.322 0.100 1.00 . A A . 2 SER HG 1 1 9 5096 1 1 2 SER N N -1.768 -27.334 1.024 1.00 . A A . 2 SER N 1 1 9 5097 1 1 2 SER O O -2.354 -27.843 -1.867 1.00 . A A . 2 SER O 1 1 9 5098 1 1 2 SER OG O -0.360 -24.830 0.481 1.00 . A A . 2 SER OG 1 1 9 5099 1 1 3 SER C C -5.130 -26.411 -3.509 1.00 . A A . 3 SER C 1 1 9 5100 1 1 3 SER CA C -5.045 -27.335 -2.298 1.00 . A A . 3 SER CA 1 1 9 5101 1 1 3 SER CB C -6.449 -27.627 -1.765 1.00 . A A . 3 SER CB 1 1 9 5102 1 1 3 SER H H -4.623 -26.107 -0.625 1.00 . A A . 3 SER H 1 1 9 5103 1 1 3 SER HA H -4.583 -28.263 -2.600 1.00 . A A . 3 SER HA 1 1 9 5104 1 1 3 SER HB2 H -6.766 -26.815 -1.129 1.00 . A A . 3 SER HB2 1 1 9 5105 1 1 3 SER HB3 H -7.134 -27.721 -2.596 1.00 . A A . 3 SER HB3 1 1 9 5106 1 1 3 SER HG H -7.375 -29.038 -0.772 1.00 . A A . 3 SER HG 1 1 9 5107 1 1 3 SER N N -4.219 -26.745 -1.251 1.00 . A A . 3 SER N 1 1 9 5108 1 1 3 SER O O -5.994 -25.538 -3.579 1.00 . A A . 3 SER O 1 1 9 5109 1 1 3 SER OG O -6.471 -28.830 -1.016 1.00 . A A . 3 SER OG 1 1 9 5110 1 1 4 GLY C C -3.378 -24.534 -5.491 1.00 . A A . 4 GLY C 1 1 9 5111 1 1 4 GLY CA C -4.213 -25.788 -5.658 1.00 . A A . 4 GLY CA 1 1 9 5112 1 1 4 GLY H H -3.558 -27.321 -4.352 1.00 . A A . 4 GLY H 1 1 9 5113 1 1 4 GLY HA2 H -3.813 -26.368 -6.476 1.00 . A A . 4 GLY HA2 1 1 9 5114 1 1 4 GLY HA3 H -5.227 -25.502 -5.894 1.00 . A A . 4 GLY HA3 1 1 9 5115 1 1 4 GLY N N -4.224 -26.610 -4.462 1.00 . A A . 4 GLY N 1 1 9 5116 1 1 4 GLY O O -3.280 -23.987 -4.393 1.00 . A A . 4 GLY O 1 1 9 5117 1 1 5 SER C C -2.711 -21.694 -5.993 1.00 . A A . 5 SER C 1 1 9 5118 1 1 5 SER CA C -1.937 -22.884 -6.552 1.00 . A A . 5 SER CA 1 1 9 5119 1 1 5 SER CB C -1.423 -22.558 -7.956 1.00 . A A . 5 SER CB 1 1 9 5120 1 1 5 SER H H -2.890 -24.559 -7.430 1.00 . A A . 5 SER H 1 1 9 5121 1 1 5 SER HA H -1.095 -23.085 -5.908 1.00 . A A . 5 SER HA 1 1 9 5122 1 1 5 SER HB2 H -1.255 -23.477 -8.497 1.00 . A A . 5 SER HB2 1 1 9 5123 1 1 5 SER HB3 H -2.160 -21.964 -8.477 1.00 . A A . 5 SER HB3 1 1 9 5124 1 1 5 SER HG H 0.532 -22.445 -7.906 1.00 . A A . 5 SER HG 1 1 9 5125 1 1 5 SER N N -2.773 -24.078 -6.583 1.00 . A A . 5 SER N 1 1 9 5126 1 1 5 SER O O -3.419 -21.001 -6.724 1.00 . A A . 5 SER O 1 1 9 5127 1 1 5 SER OG O -0.207 -21.833 -7.899 1.00 . A A . 5 SER OG 1 1 9 5128 1 1 6 SER C C -2.806 -19.019 -4.602 1.00 . A A . 6 SER C 1 1 9 5129 1 1 6 SER CA C -3.259 -20.359 -4.033 1.00 . A A . 6 SER CA 1 1 9 5130 1 1 6 SER CB C -3.002 -20.399 -2.525 1.00 . A A . 6 SER CB 1 1 9 5131 1 1 6 SER H H -1.992 -22.051 -4.162 1.00 . A A . 6 SER H 1 1 9 5132 1 1 6 SER HA H -4.317 -20.474 -4.212 1.00 . A A . 6 SER HA 1 1 9 5133 1 1 6 SER HB2 H -3.479 -19.550 -2.059 1.00 . A A . 6 SER HB2 1 1 9 5134 1 1 6 SER HB3 H -3.412 -21.311 -2.116 1.00 . A A . 6 SER HB3 1 1 9 5135 1 1 6 SER HG H -1.174 -21.083 -2.688 1.00 . A A . 6 SER HG 1 1 9 5136 1 1 6 SER N N -2.570 -21.463 -4.692 1.00 . A A . 6 SER N 1 1 9 5137 1 1 6 SER O O -3.626 -18.168 -4.944 1.00 . A A . 6 SER O 1 1 9 5138 1 1 6 SER OG O -1.614 -20.355 -2.243 1.00 . A A . 6 SER OG 1 1 9 5139 1 1 7 GLY C C -0.794 -16.534 -4.164 1.00 . A A . 7 GLY C 1 1 9 5140 1 1 7 GLY CA C -0.952 -17.599 -5.230 1.00 . A A . 7 GLY CA 1 1 9 5141 1 1 7 GLY H H -0.885 -19.552 -4.414 1.00 . A A . 7 GLY H 1 1 9 5142 1 1 7 GLY HA2 H 0.014 -17.800 -5.670 1.00 . A A . 7 GLY HA2 1 1 9 5143 1 1 7 GLY HA3 H -1.616 -17.229 -5.998 1.00 . A A . 7 GLY HA3 1 1 9 5144 1 1 7 GLY N N -1.492 -18.838 -4.702 1.00 . A A . 7 GLY N 1 1 9 5145 1 1 7 GLY O O -1.045 -16.783 -2.984 1.00 . A A . 7 GLY O 1 1 9 5146 1 1 8 THR C C -1.373 -13.286 -3.669 1.00 . A A . 8 THR C 1 1 9 5147 1 1 8 THR CA C -0.181 -14.235 -3.649 1.00 . A A . 8 THR CA 1 1 9 5148 1 1 8 THR CB C 1.098 -13.443 -3.979 1.00 . A A . 8 THR CB 1 1 9 5149 1 1 8 THR CG2 C 2.338 -14.284 -3.717 1.00 . A A . 8 THR CG2 1 1 9 5150 1 1 8 THR H H -0.192 -15.205 -5.530 1.00 . A A . 8 THR H 1 1 9 5151 1 1 8 THR HA H -0.078 -14.648 -2.656 1.00 . A A . 8 THR HA 1 1 9 5152 1 1 8 THR HB H 1.134 -12.568 -3.346 1.00 . A A . 8 THR HB 1 1 9 5153 1 1 8 THR HG1 H 1.978 -12.926 -5.666 1.00 . A A . 8 THR HG1 1 1 9 5154 1 1 8 THR HG21 H 3.137 -13.957 -4.364 1.00 . A A . 8 THR HG21 1 1 9 5155 1 1 8 THR HG22 H 2.117 -15.323 -3.915 1.00 . A A . 8 THR HG22 1 1 9 5156 1 1 8 THR HG23 H 2.639 -14.170 -2.686 1.00 . A A . 8 THR HG23 1 1 9 5157 1 1 8 THR N N -0.375 -15.342 -4.578 1.00 . A A . 8 THR N 1 1 9 5158 1 1 8 THR O O -1.872 -12.923 -4.733 1.00 . A A . 8 THR O 1 1 9 5159 1 1 8 THR OG1 O 1.077 -13.028 -5.349 1.00 . A A . 8 THR OG1 1 1 9 5160 1 1 9 GLY C C -3.709 -12.129 -1.082 1.00 . A A . 9 GLY C 1 1 9 5161 1 1 9 GLY CA C -2.955 -11.979 -2.389 1.00 . A A . 9 GLY CA 1 1 9 5162 1 1 9 GLY H H -1.387 -13.207 -1.669 1.00 . A A . 9 GLY H 1 1 9 5163 1 1 9 GLY HA2 H -2.597 -10.964 -2.473 1.00 . A A . 9 GLY HA2 1 1 9 5164 1 1 9 GLY HA3 H -3.632 -12.180 -3.206 1.00 . A A . 9 GLY HA3 1 1 9 5165 1 1 9 GLY N N -1.825 -12.885 -2.484 1.00 . A A . 9 GLY N 1 1 9 5166 1 1 9 GLY O O -4.928 -12.298 -1.078 1.00 . A A . 9 GLY O 1 1 9 5167 1 1 10 GLU C C -4.570 -11.060 1.611 1.00 . A A . 10 GLU C 1 1 9 5168 1 1 10 GLU CA C -3.590 -12.200 1.347 1.00 . A A . 10 GLU CA 1 1 9 5169 1 1 10 GLU CB C -2.511 -12.220 2.432 1.00 . A A . 10 GLU CB 1 1 9 5170 1 1 10 GLU CD C -1.353 -14.130 1.251 1.00 . A A . 10 GLU CD 1 1 9 5171 1 1 10 GLU CG C -1.822 -13.567 2.579 1.00 . A A . 10 GLU CG 1 1 9 5172 1 1 10 GLU H H -2.014 -11.931 -0.040 1.00 . A A . 10 GLU H 1 1 9 5173 1 1 10 GLU HA H -4.130 -13.134 1.372 1.00 . A A . 10 GLU HA 1 1 9 5174 1 1 10 GLU HB2 H -1.762 -11.480 2.192 1.00 . A A . 10 GLU HB2 1 1 9 5175 1 1 10 GLU HB3 H -2.964 -11.967 3.379 1.00 . A A . 10 GLU HB3 1 1 9 5176 1 1 10 GLU HG2 H -0.965 -13.449 3.225 1.00 . A A . 10 GLU HG2 1 1 9 5177 1 1 10 GLU HG3 H -2.515 -14.265 3.025 1.00 . A A . 10 GLU HG3 1 1 9 5178 1 1 10 GLU N N -2.982 -12.067 0.029 1.00 . A A . 10 GLU N 1 1 9 5179 1 1 10 GLU O O -5.489 -11.190 2.419 1.00 . A A . 10 GLU O 1 1 9 5180 1 1 10 GLU OE1 O -0.506 -13.484 0.600 1.00 . A A . 10 GLU OE1 1 1 9 5181 1 1 10 GLU OE2 O -1.833 -15.216 0.864 1.00 . A A . 10 GLU OE2 1 1 9 5182 1 1 11 LYS C C -5.114 -7.847 -0.122 1.00 . A A . 11 LYS C 1 1 9 5183 1 1 11 LYS CA C -5.229 -8.777 1.082 1.00 . A A . 11 LYS CA 1 1 9 5184 1 1 11 LYS CB C -4.869 -8.019 2.362 1.00 . A A . 11 LYS CB 1 1 9 5185 1 1 11 LYS CD C -5.384 -7.634 4.790 1.00 . A A . 11 LYS CD 1 1 9 5186 1 1 11 LYS CE C -6.530 -6.637 4.866 1.00 . A A . 11 LYS CE 1 1 9 5187 1 1 11 LYS CG C -5.541 -8.573 3.606 1.00 . A A . 11 LYS CG 1 1 9 5188 1 1 11 LYS H H -3.615 -9.897 0.294 1.00 . A A . 11 LYS H 1 1 9 5189 1 1 11 LYS HA H -6.248 -9.127 1.155 1.00 . A A . 11 LYS HA 1 1 9 5190 1 1 11 LYS HB2 H -3.800 -8.064 2.504 1.00 . A A . 11 LYS HB2 1 1 9 5191 1 1 11 LYS HB3 H -5.165 -6.986 2.249 1.00 . A A . 11 LYS HB3 1 1 9 5192 1 1 11 LYS HD2 H -5.366 -8.215 5.700 1.00 . A A . 11 LYS HD2 1 1 9 5193 1 1 11 LYS HD3 H -4.453 -7.093 4.688 1.00 . A A . 11 LYS HD3 1 1 9 5194 1 1 11 LYS HE2 H -6.243 -5.828 5.521 1.00 . A A . 11 LYS HE2 1 1 9 5195 1 1 11 LYS HE3 H -6.718 -6.249 3.876 1.00 . A A . 11 LYS HE3 1 1 9 5196 1 1 11 LYS HG2 H -6.593 -8.710 3.406 1.00 . A A . 11 LYS HG2 1 1 9 5197 1 1 11 LYS HG3 H -5.092 -9.526 3.852 1.00 . A A . 11 LYS HG3 1 1 9 5198 1 1 11 LYS HZ1 H -8.290 -6.589 5.989 1.00 . A A . 11 LYS HZ1 1 1 9 5199 1 1 11 LYS HZ2 H -7.544 -8.107 5.948 1.00 . A A . 11 LYS HZ2 1 1 9 5200 1 1 11 LYS HZ3 H -8.391 -7.545 4.597 1.00 . A A . 11 LYS HZ3 1 1 9 5201 1 1 11 LYS N N -4.365 -9.941 0.924 1.00 . A A . 11 LYS N 1 1 9 5202 1 1 11 LYS NZ N -7.776 -7.263 5.386 1.00 . A A . 11 LYS NZ 1 1 9 5203 1 1 11 LYS O O -4.140 -7.884 -0.874 1.00 . A A . 11 LYS O 1 1 9 5204 1 1 12 PRO C C -5.132 -4.925 -1.260 1.00 . A A . 12 PRO C 1 1 9 5205 1 1 12 PRO CA C -6.165 -6.035 -1.419 1.00 . A A . 12 PRO CA 1 1 9 5206 1 1 12 PRO CB C -7.582 -5.460 -1.347 1.00 . A A . 12 PRO CB 1 1 9 5207 1 1 12 PRO CD C -7.323 -6.893 0.549 1.00 . A A . 12 PRO CD 1 1 9 5208 1 1 12 PRO CG C -7.988 -5.630 0.076 1.00 . A A . 12 PRO CG 1 1 9 5209 1 1 12 PRO HA H -6.021 -6.525 -2.370 1.00 . A A . 12 PRO HA 1 1 9 5210 1 1 12 PRO HB2 H -7.565 -4.417 -1.633 1.00 . A A . 12 PRO HB2 1 1 9 5211 1 1 12 PRO HB3 H -8.232 -6.010 -2.011 1.00 . A A . 12 PRO HB3 1 1 9 5212 1 1 12 PRO HD2 H -7.045 -6.806 1.588 1.00 . A A . 12 PRO HD2 1 1 9 5213 1 1 12 PRO HD3 H -7.976 -7.741 0.400 1.00 . A A . 12 PRO HD3 1 1 9 5214 1 1 12 PRO HG2 H -7.649 -4.787 0.658 1.00 . A A . 12 PRO HG2 1 1 9 5215 1 1 12 PRO HG3 H -9.062 -5.725 0.142 1.00 . A A . 12 PRO HG3 1 1 9 5216 1 1 12 PRO N N -6.130 -6.992 -0.309 1.00 . A A . 12 PRO N 1 1 9 5217 1 1 12 PRO O O -4.799 -4.230 -2.221 1.00 . A A . 12 PRO O 1 1 9 5218 1 1 13 TYR C C -2.404 -4.339 0.919 1.00 . A A . 13 TYR C 1 1 9 5219 1 1 13 TYR CA C -3.632 -3.736 0.243 1.00 . A A . 13 TYR CA 1 1 9 5220 1 1 13 TYR CB C -4.234 -2.647 1.132 1.00 . A A . 13 TYR CB 1 1 9 5221 1 1 13 TYR CD1 C -5.940 -1.470 -0.310 1.00 . A A . 13 TYR CD1 1 1 9 5222 1 1 13 TYR CD2 C -6.725 -2.779 1.521 1.00 . A A . 13 TYR CD2 1 1 9 5223 1 1 13 TYR CE1 C -7.241 -1.143 -0.640 1.00 . A A . 13 TYR CE1 1 1 9 5224 1 1 13 TYR CE2 C -8.029 -2.458 1.197 1.00 . A A . 13 TYR CE2 1 1 9 5225 1 1 13 TYR CG C -5.659 -2.292 0.775 1.00 . A A . 13 TYR CG 1 1 9 5226 1 1 13 TYR CZ C -8.282 -1.639 0.117 1.00 . A A . 13 TYR CZ 1 1 9 5227 1 1 13 TYR H H -4.931 -5.348 0.684 1.00 . A A . 13 TYR H 1 1 9 5228 1 1 13 TYR HA H -3.332 -3.295 -0.696 1.00 . A A . 13 TYR HA 1 1 9 5229 1 1 13 TYR HB2 H -4.224 -2.982 2.158 1.00 . A A . 13 TYR HB2 1 1 9 5230 1 1 13 TYR HB3 H -3.637 -1.751 1.046 1.00 . A A . 13 TYR HB3 1 1 9 5231 1 1 13 TYR HD1 H -5.122 -1.083 -0.900 1.00 . A A . 13 TYR HD1 1 1 9 5232 1 1 13 TYR HD2 H -6.524 -3.420 2.367 1.00 . A A . 13 TYR HD2 1 1 9 5233 1 1 13 TYR HE1 H -7.439 -0.502 -1.486 1.00 . A A . 13 TYR HE1 1 1 9 5234 1 1 13 TYR HE2 H -8.845 -2.846 1.789 1.00 . A A . 13 TYR HE2 1 1 9 5235 1 1 13 TYR HH H -9.585 -0.529 -0.758 1.00 . A A . 13 TYR HH 1 1 9 5236 1 1 13 TYR N N -4.627 -4.763 -0.042 1.00 . A A . 13 TYR N 1 1 9 5237 1 1 13 TYR O O -2.477 -4.816 2.051 1.00 . A A . 13 TYR O 1 1 9 5238 1 1 13 TYR OH O -9.579 -1.316 -0.210 1.00 . A A . 13 TYR OH 1 1 9 5239 1 1 14 GLU C C 1.172 -4.098 0.197 1.00 . A A . 14 GLU C 1 1 9 5240 1 1 14 GLU CA C -0.033 -4.857 0.746 1.00 . A A . 14 GLU CA 1 1 9 5241 1 1 14 GLU CB C 0.088 -6.343 0.403 1.00 . A A . 14 GLU CB 1 1 9 5242 1 1 14 GLU CD C 1.716 -8.245 0.070 1.00 . A A . 14 GLU CD 1 1 9 5243 1 1 14 GLU CG C 1.417 -6.957 0.811 1.00 . A A . 14 GLU CG 1 1 9 5244 1 1 14 GLU H H -1.282 -3.919 -0.682 1.00 . A A . 14 GLU H 1 1 9 5245 1 1 14 GLU HA H -0.054 -4.746 1.820 1.00 . A A . 14 GLU HA 1 1 9 5246 1 1 14 GLU HB2 H -0.703 -6.881 0.904 1.00 . A A . 14 GLU HB2 1 1 9 5247 1 1 14 GLU HB3 H -0.027 -6.464 -0.664 1.00 . A A . 14 GLU HB3 1 1 9 5248 1 1 14 GLU HG2 H 2.205 -6.248 0.603 1.00 . A A . 14 GLU HG2 1 1 9 5249 1 1 14 GLU HG3 H 1.392 -7.165 1.871 1.00 . A A . 14 GLU HG3 1 1 9 5250 1 1 14 GLU N N -1.277 -4.313 0.215 1.00 . A A . 14 GLU N 1 1 9 5251 1 1 14 GLU O O 1.140 -3.587 -0.923 1.00 . A A . 14 GLU O 1 1 9 5252 1 1 14 GLU OE1 O 0.803 -9.089 -0.044 1.00 . A A . 14 GLU OE1 1 1 9 5253 1 1 14 GLU OE2 O 2.864 -8.411 -0.394 1.00 . A A . 14 GLU OE2 1 1 9 5254 1 1 15 CYS C C 4.405 -4.276 -0.127 1.00 . A A . 15 CYS C 1 1 9 5255 1 1 15 CYS CA C 3.448 -3.329 0.591 1.00 . A A . 15 CYS CA 1 1 9 5256 1 1 15 CYS CB C 4.138 -2.716 1.811 1.00 . A A . 15 CYS CB 1 1 9 5257 1 1 15 CYS H H 2.198 -4.454 1.877 1.00 . A A . 15 CYS H 1 1 9 5258 1 1 15 CYS HA H 3.167 -2.539 -0.088 1.00 . A A . 15 CYS HA 1 1 9 5259 1 1 15 CYS HB2 H 3.429 -2.102 2.345 1.00 . A A . 15 CYS HB2 1 1 9 5260 1 1 15 CYS HB3 H 4.479 -3.510 2.459 1.00 . A A . 15 CYS HB3 1 1 9 5261 1 1 15 CYS N N 2.233 -4.026 0.994 1.00 . A A . 15 CYS N 1 1 9 5262 1 1 15 CYS O O 4.714 -5.359 0.371 1.00 . A A . 15 CYS O 1 1 9 5263 1 1 15 CYS SG S 5.577 -1.675 1.405 1.00 . A A . 15 CYS SG 1 1 9 5264 1 1 16 ASP C C 7.235 -4.438 -1.640 1.00 . A A . 16 ASP C 1 1 9 5265 1 1 16 ASP CA C 5.795 -4.670 -2.086 1.00 . A A . 16 ASP CA 1 1 9 5266 1 1 16 ASP CB C 5.650 -4.347 -3.574 1.00 . A A . 16 ASP CB 1 1 9 5267 1 1 16 ASP CG C 6.445 -5.294 -4.452 1.00 . A A . 16 ASP CG 1 1 9 5268 1 1 16 ASP H H 4.588 -2.988 -1.644 1.00 . A A . 16 ASP H 1 1 9 5269 1 1 16 ASP HA H 5.545 -5.708 -1.926 1.00 . A A . 16 ASP HA 1 1 9 5270 1 1 16 ASP HB2 H 4.608 -4.418 -3.851 1.00 . A A . 16 ASP HB2 1 1 9 5271 1 1 16 ASP HB3 H 5.998 -3.341 -3.753 1.00 . A A . 16 ASP HB3 1 1 9 5272 1 1 16 ASP N N 4.871 -3.860 -1.299 1.00 . A A . 16 ASP N 1 1 9 5273 1 1 16 ASP O O 8.175 -4.645 -2.409 1.00 . A A . 16 ASP O 1 1 9 5274 1 1 16 ASP OD1 O 6.656 -6.453 -4.036 1.00 . A A . 16 ASP OD1 1 1 9 5275 1 1 16 ASP OD2 O 6.855 -4.876 -5.555 1.00 . A A . 16 ASP OD2 1 1 9 5276 1 1 17 VAL C C 8.923 -4.464 1.485 1.00 . A A . 17 VAL C 1 1 9 5277 1 1 17 VAL CA C 8.728 -3.746 0.154 1.00 . A A . 17 VAL CA 1 1 9 5278 1 1 17 VAL CB C 8.965 -2.238 0.356 1.00 . A A . 17 VAL CB 1 1 9 5279 1 1 17 VAL CG1 C 10.348 -1.989 0.941 1.00 . A A . 17 VAL CG1 1 1 9 5280 1 1 17 VAL CG2 C 8.790 -1.490 -0.956 1.00 . A A . 17 VAL CG2 1 1 9 5281 1 1 17 VAL H H 6.615 -3.860 0.170 1.00 . A A . 17 VAL H 1 1 9 5282 1 1 17 VAL HA H 9.459 -4.113 -0.552 1.00 . A A . 17 VAL HA 1 1 9 5283 1 1 17 VAL HB H 8.231 -1.870 1.058 1.00 . A A . 17 VAL HB 1 1 9 5284 1 1 17 VAL HG11 H 10.900 -2.917 0.966 1.00 . A A . 17 VAL HG11 1 1 9 5285 1 1 17 VAL HG12 H 10.874 -1.272 0.328 1.00 . A A . 17 VAL HG12 1 1 9 5286 1 1 17 VAL HG13 H 10.249 -1.602 1.944 1.00 . A A . 17 VAL HG13 1 1 9 5287 1 1 17 VAL HG21 H 9.426 -0.618 -0.962 1.00 . A A . 17 VAL HG21 1 1 9 5288 1 1 17 VAL HG22 H 9.058 -2.138 -1.778 1.00 . A A . 17 VAL HG22 1 1 9 5289 1 1 17 VAL HG23 H 7.759 -1.184 -1.062 1.00 . A A . 17 VAL HG23 1 1 9 5290 1 1 17 VAL N N 7.402 -4.007 -0.394 1.00 . A A . 17 VAL N 1 1 9 5291 1 1 17 VAL O O 9.931 -5.138 1.697 1.00 . A A . 17 VAL O 1 1 9 5292 1 1 18 CYS C C 6.936 -6.019 3.830 1.00 . A A . 18 CYS C 1 1 9 5293 1 1 18 CYS CA C 8.015 -4.948 3.690 1.00 . A A . 18 CYS CA 1 1 9 5294 1 1 18 CYS CB C 7.856 -3.901 4.794 1.00 . A A . 18 CYS CB 1 1 9 5295 1 1 18 CYS H H 7.172 -3.765 2.151 1.00 . A A . 18 CYS H 1 1 9 5296 1 1 18 CYS HA H 8.983 -5.416 3.787 1.00 . A A . 18 CYS HA 1 1 9 5297 1 1 18 CYS HB2 H 7.874 -4.396 5.754 1.00 . A A . 18 CYS HB2 1 1 9 5298 1 1 18 CYS HB3 H 8.678 -3.203 4.739 1.00 . A A . 18 CYS HB3 1 1 9 5299 1 1 18 CYS N N 7.951 -4.315 2.379 1.00 . A A . 18 CYS N 1 1 9 5300 1 1 18 CYS O O 6.921 -6.776 4.800 1.00 . A A . 18 CYS O 1 1 9 5301 1 1 18 CYS SG S 6.308 -2.944 4.694 1.00 . A A . 18 CYS SG 1 1 9 5302 1 1 19 ARG C C 4.049 -6.842 4.081 1.00 . A A . 19 ARG C 1 1 9 5303 1 1 19 ARG CA C 4.952 -7.050 2.869 1.00 . A A . 19 ARG CA 1 1 9 5304 1 1 19 ARG CB C 5.518 -8.471 2.879 1.00 . A A . 19 ARG CB 1 1 9 5305 1 1 19 ARG CD C 5.815 -8.807 0.406 1.00 . A A . 19 ARG CD 1 1 9 5306 1 1 19 ARG CG C 6.508 -8.741 1.758 1.00 . A A . 19 ARG CG 1 1 9 5307 1 1 19 ARG CZ C 6.894 -10.673 -0.775 1.00 . A A . 19 ARG CZ 1 1 9 5308 1 1 19 ARG H H 6.100 -5.443 2.107 1.00 . A A . 19 ARG H 1 1 9 5309 1 1 19 ARG HA H 4.368 -6.911 1.971 1.00 . A A . 19 ARG HA 1 1 9 5310 1 1 19 ARG HB2 H 6.020 -8.639 3.821 1.00 . A A . 19 ARG HB2 1 1 9 5311 1 1 19 ARG HB3 H 4.702 -9.171 2.785 1.00 . A A . 19 ARG HB3 1 1 9 5312 1 1 19 ARG HD2 H 4.933 -9.423 0.499 1.00 . A A . 19 ARG HD2 1 1 9 5313 1 1 19 ARG HD3 H 5.526 -7.808 0.115 1.00 . A A . 19 ARG HD3 1 1 9 5314 1 1 19 ARG HE H 7.123 -8.747 -1.238 1.00 . A A . 19 ARG HE 1 1 9 5315 1 1 19 ARG HG2 H 7.239 -7.946 1.736 1.00 . A A . 19 ARG HG2 1 1 9 5316 1 1 19 ARG HG3 H 7.003 -9.682 1.946 1.00 . A A . 19 ARG HG3 1 1 9 5317 1 1 19 ARG HH11 H 5.703 -11.216 0.764 1.00 . A A . 19 ARG HH11 1 1 9 5318 1 1 19 ARG HH12 H 6.471 -12.522 -0.077 1.00 . A A . 19 ARG HH12 1 1 9 5319 1 1 19 ARG HH21 H 8.139 -10.458 -2.353 1.00 . A A . 19 ARG HH21 1 1 9 5320 1 1 19 ARG HH22 H 7.856 -12.090 -1.849 1.00 . A A . 19 ARG HH22 1 1 9 5321 1 1 19 ARG N N 6.035 -6.074 2.854 1.00 . A A . 19 ARG N 1 1 9 5322 1 1 19 ARG NE N 6.680 -9.371 -0.626 1.00 . A A . 19 ARG NE 1 1 9 5323 1 1 19 ARG NH1 N 6.308 -11.542 0.038 1.00 . A A . 19 ARG NH1 1 1 9 5324 1 1 19 ARG NH2 N 7.696 -11.110 -1.738 1.00 . A A . 19 ARG NH2 1 1 9 5325 1 1 19 ARG O O 3.728 -7.788 4.800 1.00 . A A . 19 ARG O 1 1 9 5326 1 1 20 LYS C C 1.326 -5.118 4.971 1.00 . A A . 20 LYS C 1 1 9 5327 1 1 20 LYS CA C 2.775 -5.262 5.426 1.00 . A A . 20 LYS CA 1 1 9 5328 1 1 20 LYS CB C 3.244 -3.966 6.090 1.00 . A A . 20 LYS CB 1 1 9 5329 1 1 20 LYS CD C 3.381 -2.580 8.181 1.00 . A A . 20 LYS CD 1 1 9 5330 1 1 20 LYS CE C 4.779 -2.826 8.727 1.00 . A A . 20 LYS CE 1 1 9 5331 1 1 20 LYS CG C 2.806 -3.832 7.539 1.00 . A A . 20 LYS CG 1 1 9 5332 1 1 20 LYS H H 3.932 -4.884 3.693 1.00 . A A . 20 LYS H 1 1 9 5333 1 1 20 LYS HA H 2.837 -6.067 6.143 1.00 . A A . 20 LYS HA 1 1 9 5334 1 1 20 LYS HB2 H 4.323 -3.928 6.057 1.00 . A A . 20 LYS HB2 1 1 9 5335 1 1 20 LYS HB3 H 2.845 -3.127 5.537 1.00 . A A . 20 LYS HB3 1 1 9 5336 1 1 20 LYS HD2 H 3.428 -1.795 7.441 1.00 . A A . 20 LYS HD2 1 1 9 5337 1 1 20 LYS HD3 H 2.736 -2.274 8.993 1.00 . A A . 20 LYS HD3 1 1 9 5338 1 1 20 LYS HE2 H 4.831 -3.834 9.108 1.00 . A A . 20 LYS HE2 1 1 9 5339 1 1 20 LYS HE3 H 5.491 -2.708 7.923 1.00 . A A . 20 LYS HE3 1 1 9 5340 1 1 20 LYS HG2 H 1.728 -3.780 7.576 1.00 . A A . 20 LYS HG2 1 1 9 5341 1 1 20 LYS HG3 H 3.147 -4.697 8.089 1.00 . A A . 20 LYS HG3 1 1 9 5342 1 1 20 LYS HZ1 H 5.685 -2.359 10.551 1.00 . A A . 20 LYS HZ1 1 1 9 5343 1 1 20 LYS HZ2 H 4.253 -1.506 10.258 1.00 . A A . 20 LYS HZ2 1 1 9 5344 1 1 20 LYS HZ3 H 5.673 -1.080 9.444 1.00 . A A . 20 LYS HZ3 1 1 9 5345 1 1 20 LYS N N 3.642 -5.596 4.302 1.00 . A A . 20 LYS N 1 1 9 5346 1 1 20 LYS NZ N 5.122 -1.876 9.822 1.00 . A A . 20 LYS NZ 1 1 9 5347 1 1 20 LYS O O 1.032 -4.381 4.030 1.00 . A A . 20 LYS O 1 1 9 5348 1 1 21 ALA C C -1.691 -4.644 6.065 1.00 . A A . 21 ALA C 1 1 9 5349 1 1 21 ALA CA C -0.992 -5.772 5.314 1.00 . A A . 21 ALA CA 1 1 9 5350 1 1 21 ALA CB C -1.657 -7.106 5.623 1.00 . A A . 21 ALA CB 1 1 9 5351 1 1 21 ALA H H 0.722 -6.394 6.387 1.00 . A A . 21 ALA H 1 1 9 5352 1 1 21 ALA HA H -1.080 -5.592 4.252 1.00 . A A . 21 ALA HA 1 1 9 5353 1 1 21 ALA HB1 H -1.436 -7.809 4.834 1.00 . A A . 21 ALA HB1 1 1 9 5354 1 1 21 ALA HB2 H -1.279 -7.486 6.561 1.00 . A A . 21 ALA HB2 1 1 9 5355 1 1 21 ALA HB3 H -2.725 -6.967 5.694 1.00 . A A . 21 ALA HB3 1 1 9 5356 1 1 21 ALA N N 0.426 -5.825 5.646 1.00 . A A . 21 ALA N 1 1 9 5357 1 1 21 ALA O O -1.332 -4.323 7.198 1.00 . A A . 21 ALA O 1 1 9 5358 1 1 22 PHE C C -4.941 -3.160 5.868 1.00 . A A . 22 PHE C 1 1 9 5359 1 1 22 PHE CA C -3.439 -2.950 6.034 1.00 . A A . 22 PHE CA 1 1 9 5360 1 1 22 PHE CB C -3.027 -1.615 5.411 1.00 . A A . 22 PHE CB 1 1 9 5361 1 1 22 PHE CD1 C -0.634 -1.973 4.745 1.00 . A A . 22 PHE CD1 1 1 9 5362 1 1 22 PHE CD2 C -1.108 -0.387 6.462 1.00 . A A . 22 PHE CD2 1 1 9 5363 1 1 22 PHE CE1 C 0.716 -1.703 4.863 1.00 . A A . 22 PHE CE1 1 1 9 5364 1 1 22 PHE CE2 C 0.241 -0.113 6.584 1.00 . A A . 22 PHE CE2 1 1 9 5365 1 1 22 PHE CG C -1.560 -1.319 5.542 1.00 . A A . 22 PHE CG 1 1 9 5366 1 1 22 PHE CZ C 1.154 -0.772 5.784 1.00 . A A . 22 PHE CZ 1 1 9 5367 1 1 22 PHE H H -2.930 -4.345 4.525 1.00 . A A . 22 PHE H 1 1 9 5368 1 1 22 PHE HA H -3.204 -2.934 7.087 1.00 . A A . 22 PHE HA 1 1 9 5369 1 1 22 PHE HB2 H -3.270 -1.627 4.359 1.00 . A A . 22 PHE HB2 1 1 9 5370 1 1 22 PHE HB3 H -3.572 -0.818 5.893 1.00 . A A . 22 PHE HB3 1 1 9 5371 1 1 22 PHE HD1 H -0.977 -2.702 4.024 1.00 . A A . 22 PHE HD1 1 1 9 5372 1 1 22 PHE HD2 H -1.820 0.128 7.089 1.00 . A A . 22 PHE HD2 1 1 9 5373 1 1 22 PHE HE1 H 1.427 -2.220 4.236 1.00 . A A . 22 PHE HE1 1 1 9 5374 1 1 22 PHE HE2 H 0.582 0.615 7.305 1.00 . A A . 22 PHE HE2 1 1 9 5375 1 1 22 PHE HZ H 2.209 -0.559 5.877 1.00 . A A . 22 PHE HZ 1 1 9 5376 1 1 22 PHE N N -2.691 -4.045 5.426 1.00 . A A . 22 PHE N 1 1 9 5377 1 1 22 PHE O O -5.391 -3.752 4.887 1.00 . A A . 22 PHE O 1 1 9 5378 1 1 23 SER C C -7.761 -1.967 5.676 1.00 . A A . 23 SER C 1 1 9 5379 1 1 23 SER CA C -7.163 -2.809 6.799 1.00 . A A . 23 SER CA 1 1 9 5380 1 1 23 SER CB C -7.769 -2.394 8.141 1.00 . A A . 23 SER CB 1 1 9 5381 1 1 23 SER H H -5.293 -2.210 7.592 1.00 . A A . 23 SER H 1 1 9 5382 1 1 23 SER HA H -7.393 -3.848 6.616 1.00 . A A . 23 SER HA 1 1 9 5383 1 1 23 SER HB2 H -7.170 -2.797 8.944 1.00 . A A . 23 SER HB2 1 1 9 5384 1 1 23 SER HB3 H -7.783 -1.316 8.209 1.00 . A A . 23 SER HB3 1 1 9 5385 1 1 23 SER HG H -9.546 -2.390 8.966 1.00 . A A . 23 SER HG 1 1 9 5386 1 1 23 SER N N -5.711 -2.672 6.835 1.00 . A A . 23 SER N 1 1 9 5387 1 1 23 SER O O -8.494 -2.475 4.827 1.00 . A A . 23 SER O 1 1 9 5388 1 1 23 SER OG O -9.094 -2.878 8.274 1.00 . A A . 23 SER OG 1 1 9 5389 1 1 24 HIS C C -6.911 0.451 3.561 1.00 . A A . 24 HIS C 1 1 9 5390 1 1 24 HIS CA C -7.946 0.238 4.661 1.00 . A A . 24 HIS CA 1 1 9 5391 1 1 24 HIS CB C -8.323 1.579 5.290 1.00 . A A . 24 HIS CB 1 1 9 5392 1 1 24 HIS CD2 C -10.244 2.002 3.600 1.00 . A A . 24 HIS CD2 1 1 9 5393 1 1 24 HIS CE1 C -10.218 4.194 3.627 1.00 . A A . 24 HIS CE1 1 1 9 5394 1 1 24 HIS CG C -9.270 2.387 4.458 1.00 . A A . 24 HIS CG 1 1 9 5395 1 1 24 HIS H H -6.853 -0.331 6.382 1.00 . A A . 24 HIS H 1 1 9 5396 1 1 24 HIS HA H -8.829 -0.206 4.225 1.00 . A A . 24 HIS HA 1 1 9 5397 1 1 24 HIS HB2 H -8.791 1.401 6.247 1.00 . A A . 24 HIS HB2 1 1 9 5398 1 1 24 HIS HB3 H -7.426 2.165 5.437 1.00 . A A . 24 HIS HB3 1 1 9 5399 1 1 24 HIS HD1 H -8.686 4.344 4.975 1.00 . A A . 24 HIS HD1 1 1 9 5400 1 1 24 HIS HD2 H -10.520 0.985 3.356 1.00 . A A . 24 HIS HD2 1 1 9 5401 1 1 24 HIS HE1 H -10.455 5.227 3.420 1.00 . A A . 24 HIS HE1 1 1 9 5402 1 1 24 HIS N N -7.442 -0.677 5.679 1.00 . A A . 24 HIS N 1 1 9 5403 1 1 24 HIS ND1 N -9.279 3.766 4.452 1.00 . A A . 24 HIS ND1 1 1 9 5404 1 1 24 HIS NE2 N -10.818 3.144 3.097 1.00 . A A . 24 HIS NE2 1 1 9 5405 1 1 24 HIS O O -5.742 0.096 3.717 1.00 . A A . 24 HIS O 1 1 9 5406 1 1 25 HIS C C -5.544 2.480 1.614 1.00 . A A . 25 HIS C 1 1 9 5407 1 1 25 HIS CA C -6.457 1.293 1.322 1.00 . A A . 25 HIS CA 1 1 9 5408 1 1 25 HIS CB C -7.270 1.560 0.054 1.00 . A A . 25 HIS CB 1 1 9 5409 1 1 25 HIS CD2 C -8.880 3.587 0.211 1.00 . A A . 25 HIS CD2 1 1 9 5410 1 1 25 HIS CE1 C -7.543 5.122 -0.604 1.00 . A A . 25 HIS CE1 1 1 9 5411 1 1 25 HIS CG C -7.705 2.986 -0.090 1.00 . A A . 25 HIS CG 1 1 9 5412 1 1 25 HIS H H -8.289 1.293 2.383 1.00 . A A . 25 HIS H 1 1 9 5413 1 1 25 HIS HA H -5.848 0.415 1.171 1.00 . A A . 25 HIS HA 1 1 9 5414 1 1 25 HIS HB2 H -6.671 1.308 -0.808 1.00 . A A . 25 HIS HB2 1 1 9 5415 1 1 25 HIS HB3 H -8.155 0.941 0.065 1.00 . A A . 25 HIS HB3 1 1 9 5416 1 1 25 HIS HD1 H -5.968 3.852 -0.909 1.00 . A A . 25 HIS HD1 1 1 9 5417 1 1 25 HIS HD2 H -9.755 3.112 0.632 1.00 . A A . 25 HIS HD2 1 1 9 5418 1 1 25 HIS HE1 H -7.155 6.069 -0.947 1.00 . A A . 25 HIS HE1 1 1 9 5419 1 1 25 HIS N N -7.347 1.033 2.448 1.00 . A A . 25 HIS N 1 1 9 5420 1 1 25 HIS ND1 N -6.890 3.974 -0.599 1.00 . A A . 25 HIS ND1 1 1 9 5421 1 1 25 HIS NE2 N -8.754 4.914 -0.117 1.00 . A A . 25 HIS NE2 1 1 9 5422 1 1 25 HIS O O -4.345 2.435 1.342 1.00 . A A . 25 HIS O 1 1 9 5423 1 1 26 ALA C C -4.125 4.395 3.327 1.00 . A A . 26 ALA C 1 1 9 5424 1 1 26 ALA CA C -5.359 4.739 2.500 1.00 . A A . 26 ALA CA 1 1 9 5425 1 1 26 ALA CB C -6.236 5.734 3.245 1.00 . A A . 26 ALA CB 1 1 9 5426 1 1 26 ALA H H -7.081 3.517 2.363 1.00 . A A . 26 ALA H 1 1 9 5427 1 1 26 ALA HA H -5.042 5.199 1.574 1.00 . A A . 26 ALA HA 1 1 9 5428 1 1 26 ALA HB1 H -7.249 5.362 3.283 1.00 . A A . 26 ALA HB1 1 1 9 5429 1 1 26 ALA HB2 H -5.861 5.860 4.251 1.00 . A A . 26 ALA HB2 1 1 9 5430 1 1 26 ALA HB3 H -6.219 6.684 2.732 1.00 . A A . 26 ALA HB3 1 1 9 5431 1 1 26 ALA N N -6.121 3.541 2.170 1.00 . A A . 26 ALA N 1 1 9 5432 1 1 26 ALA O O -3.008 4.783 2.985 1.00 . A A . 26 ALA O 1 1 9 5433 1 1 27 SER C C -2.028 2.821 4.488 1.00 . A A . 27 SER C 1 1 9 5434 1 1 27 SER CA C -3.241 3.272 5.297 1.00 . A A . 27 SER CA 1 1 9 5435 1 1 27 SER CB C -3.689 2.148 6.234 1.00 . A A . 27 SER CB 1 1 9 5436 1 1 27 SER H H -5.249 3.386 4.638 1.00 . A A . 27 SER H 1 1 9 5437 1 1 27 SER HA H -2.964 4.133 5.888 1.00 . A A . 27 SER HA 1 1 9 5438 1 1 27 SER HB2 H -4.746 2.244 6.427 1.00 . A A . 27 SER HB2 1 1 9 5439 1 1 27 SER HB3 H -3.493 1.194 5.766 1.00 . A A . 27 SER HB3 1 1 9 5440 1 1 27 SER HG H -3.148 1.395 7.960 1.00 . A A . 27 SER HG 1 1 9 5441 1 1 27 SER N N -4.335 3.665 4.418 1.00 . A A . 27 SER N 1 1 9 5442 1 1 27 SER O O -0.887 2.946 4.934 1.00 . A A . 27 SER O 1 1 9 5443 1 1 27 SER OG O -2.993 2.204 7.467 1.00 . A A . 27 SER OG 1 1 9 5444 1 1 28 LEU C C -0.550 2.994 1.698 1.00 . A A . 28 LEU C 1 1 9 5445 1 1 28 LEU CA C -1.215 1.827 2.420 1.00 . A A . 28 LEU CA 1 1 9 5446 1 1 28 LEU CB C -1.765 0.828 1.401 1.00 . A A . 28 LEU CB 1 1 9 5447 1 1 28 LEU CD1 C 0.160 -0.771 1.256 1.00 . A A . 28 LEU CD1 1 1 9 5448 1 1 28 LEU CD2 C -1.430 -0.556 -0.663 1.00 . A A . 28 LEU CD2 1 1 9 5449 1 1 28 LEU CG C -0.736 0.178 0.475 1.00 . A A . 28 LEU CG 1 1 9 5450 1 1 28 LEU H H -3.213 2.223 2.993 1.00 . A A . 28 LEU H 1 1 9 5451 1 1 28 LEU HA H -0.478 1.333 3.035 1.00 . A A . 28 LEU HA 1 1 9 5452 1 1 28 LEU HB2 H -2.263 0.040 1.946 1.00 . A A . 28 LEU HB2 1 1 9 5453 1 1 28 LEU HB3 H -2.484 1.347 0.784 1.00 . A A . 28 LEU HB3 1 1 9 5454 1 1 28 LEU HD11 H 0.831 -0.201 1.880 1.00 . A A . 28 LEU HD11 1 1 9 5455 1 1 28 LEU HD12 H 0.734 -1.373 0.566 1.00 . A A . 28 LEU HD12 1 1 9 5456 1 1 28 LEU HD13 H -0.449 -1.415 1.874 1.00 . A A . 28 LEU HD13 1 1 9 5457 1 1 28 LEU HD21 H -1.057 -0.190 -1.608 1.00 . A A . 28 LEU HD21 1 1 9 5458 1 1 28 LEU HD22 H -2.495 -0.384 -0.604 1.00 . A A . 28 LEU HD22 1 1 9 5459 1 1 28 LEU HD23 H -1.232 -1.615 -0.582 1.00 . A A . 28 LEU HD23 1 1 9 5460 1 1 28 LEU HG H -0.111 0.948 0.045 1.00 . A A . 28 LEU HG 1 1 9 5461 1 1 28 LEU N N -2.284 2.297 3.294 1.00 . A A . 28 LEU N 1 1 9 5462 1 1 28 LEU O O 0.657 3.208 1.820 1.00 . A A . 28 LEU O 1 1 9 5463 1 1 29 THR C C -0.062 5.839 1.116 1.00 . A A . 29 THR C 1 1 9 5464 1 1 29 THR CA C -0.835 4.894 0.204 1.00 . A A . 29 THR CA 1 1 9 5465 1 1 29 THR CB C -1.974 5.675 -0.479 1.00 . A A . 29 THR CB 1 1 9 5466 1 1 29 THR CG2 C -2.613 6.658 0.491 1.00 . A A . 29 THR CG2 1 1 9 5467 1 1 29 THR H H -2.298 3.527 0.888 1.00 . A A . 29 THR H 1 1 9 5468 1 1 29 THR HA H -0.169 4.525 -0.563 1.00 . A A . 29 THR HA 1 1 9 5469 1 1 29 THR HB H -2.727 4.971 -0.804 1.00 . A A . 29 THR HB 1 1 9 5470 1 1 29 THR HG1 H -2.154 6.958 -1.965 1.00 . A A . 29 THR HG1 1 1 9 5471 1 1 29 THR HG21 H -2.294 7.660 0.248 1.00 . A A . 29 THR HG21 1 1 9 5472 1 1 29 THR HG22 H -2.309 6.418 1.499 1.00 . A A . 29 THR HG22 1 1 9 5473 1 1 29 THR HG23 H -3.688 6.593 0.413 1.00 . A A . 29 THR HG23 1 1 9 5474 1 1 29 THR N N -1.345 3.748 0.945 1.00 . A A . 29 THR N 1 1 9 5475 1 1 29 THR O O 0.739 6.649 0.650 1.00 . A A . 29 THR O 1 1 9 5476 1 1 29 THR OG1 O -1.470 6.380 -1.619 1.00 . A A . 29 THR OG1 1 1 9 5477 1 1 30 GLN C C 1.662 5.928 3.876 1.00 . A A . 30 GLN C 1 1 9 5478 1 1 30 GLN CA C 0.367 6.576 3.396 1.00 . A A . 30 GLN CA 1 1 9 5479 1 1 30 GLN CB C -0.553 6.848 4.587 1.00 . A A . 30 GLN CB 1 1 9 5480 1 1 30 GLN CD C 0.905 7.807 6.414 1.00 . A A . 30 GLN CD 1 1 9 5481 1 1 30 GLN CG C -0.170 8.086 5.382 1.00 . A A . 30 GLN CG 1 1 9 5482 1 1 30 GLN H H -0.956 5.065 2.728 1.00 . A A . 30 GLN H 1 1 9 5483 1 1 30 GLN HA H 0.605 7.513 2.915 1.00 . A A . 30 GLN HA 1 1 9 5484 1 1 30 GLN HB2 H -1.562 6.977 4.225 1.00 . A A . 30 GLN HB2 1 1 9 5485 1 1 30 GLN HB3 H -0.523 5.997 5.251 1.00 . A A . 30 GLN HB3 1 1 9 5486 1 1 30 GLN HE21 H 0.034 9.055 7.694 1.00 . A A . 30 GLN HE21 1 1 9 5487 1 1 30 GLN HE22 H 1.475 8.285 8.257 1.00 . A A . 30 GLN HE22 1 1 9 5488 1 1 30 GLN HG2 H 0.196 8.838 4.698 1.00 . A A . 30 GLN HG2 1 1 9 5489 1 1 30 GLN HG3 H -1.048 8.458 5.889 1.00 . A A . 30 GLN HG3 1 1 9 5490 1 1 30 GLN N N -0.307 5.730 2.418 1.00 . A A . 30 GLN N 1 1 9 5491 1 1 30 GLN NE2 N 0.794 8.447 7.572 1.00 . A A . 30 GLN NE2 1 1 9 5492 1 1 30 GLN O O 2.724 6.552 3.858 1.00 . A A . 30 GLN O 1 1 9 5493 1 1 30 GLN OE1 O 1.825 7.025 6.173 1.00 . A A . 30 GLN OE1 1 1 9 5494 1 1 31 HIS C C 3.864 3.985 3.769 1.00 . A A . 31 HIS C 1 1 9 5495 1 1 31 HIS CA C 2.731 3.941 4.790 1.00 . A A . 31 HIS CA 1 1 9 5496 1 1 31 HIS CB C 2.356 2.490 5.093 1.00 . A A . 31 HIS CB 1 1 9 5497 1 1 31 HIS CD2 C 4.056 0.948 3.885 1.00 . A A . 31 HIS CD2 1 1 9 5498 1 1 31 HIS CE1 C 5.174 0.264 5.643 1.00 . A A . 31 HIS CE1 1 1 9 5499 1 1 31 HIS CG C 3.506 1.538 4.972 1.00 . A A . 31 HIS CG 1 1 9 5500 1 1 31 HIS H H 0.693 4.231 4.295 1.00 . A A . 31 HIS H 1 1 9 5501 1 1 31 HIS HA H 3.065 4.415 5.700 1.00 . A A . 31 HIS HA 1 1 9 5502 1 1 31 HIS HB2 H 1.978 2.426 6.102 1.00 . A A . 31 HIS HB2 1 1 9 5503 1 1 31 HIS HB3 H 1.587 2.172 4.404 1.00 . A A . 31 HIS HB3 1 1 9 5504 1 1 31 HIS HD1 H 4.071 1.337 6.991 1.00 . A A . 31 HIS HD1 1 1 9 5505 1 1 31 HIS HD2 H 3.741 1.072 2.858 1.00 . A A . 31 HIS HD2 1 1 9 5506 1 1 31 HIS HE1 H 5.892 -0.241 6.271 1.00 . A A . 31 HIS HE1 1 1 9 5507 1 1 31 HIS N N 1.566 4.674 4.305 1.00 . A A . 31 HIS N 1 1 9 5508 1 1 31 HIS ND1 N 4.228 1.088 6.057 1.00 . A A . 31 HIS ND1 1 1 9 5509 1 1 31 HIS NE2 N 5.091 0.161 4.328 1.00 . A A . 31 HIS NE2 1 1 9 5510 1 1 31 HIS O O 5.018 4.225 4.121 1.00 . A A . 31 HIS O 1 1 9 5511 1 1 32 GLN C C 5.583 4.818 1.692 1.00 . A A . 32 GLN C 1 1 9 5512 1 1 32 GLN CA C 4.515 3.760 1.435 1.00 . A A . 32 GLN CA 1 1 9 5513 1 1 32 GLN CB C 3.837 4.019 0.088 1.00 . A A . 32 GLN CB 1 1 9 5514 1 1 32 GLN CD C 4.023 1.548 -0.406 1.00 . A A . 32 GLN CD 1 1 9 5515 1 1 32 GLN CG C 3.159 2.791 -0.498 1.00 . A A . 32 GLN CG 1 1 9 5516 1 1 32 GLN H H 2.588 3.564 2.289 1.00 . A A . 32 GLN H 1 1 9 5517 1 1 32 GLN HA H 4.986 2.790 1.410 1.00 . A A . 32 GLN HA 1 1 9 5518 1 1 32 GLN HB2 H 3.091 4.789 0.216 1.00 . A A . 32 GLN HB2 1 1 9 5519 1 1 32 GLN HB3 H 4.581 4.363 -0.615 1.00 . A A . 32 GLN HB3 1 1 9 5520 1 1 32 GLN HE21 H 2.408 0.415 -0.157 1.00 . A A . 32 GLN HE21 1 1 9 5521 1 1 32 GLN HE22 H 3.919 -0.421 -0.159 1.00 . A A . 32 GLN HE22 1 1 9 5522 1 1 32 GLN HG2 H 2.240 2.612 0.040 1.00 . A A . 32 GLN HG2 1 1 9 5523 1 1 32 GLN HG3 H 2.936 2.981 -1.537 1.00 . A A . 32 GLN HG3 1 1 9 5524 1 1 32 GLN N N 3.525 3.750 2.506 1.00 . A A . 32 GLN N 1 1 9 5525 1 1 32 GLN NE2 N 3.386 0.398 -0.221 1.00 . A A . 32 GLN NE2 1 1 9 5526 1 1 32 GLN O O 6.743 4.647 1.316 1.00 . A A . 32 GLN O 1 1 9 5527 1 1 32 GLN OE1 O 5.248 1.621 -0.499 1.00 . A A . 32 GLN OE1 1 1 9 5528 1 1 33 ARG C C 7.385 6.462 3.278 1.00 . A A . 33 ARG C 1 1 9 5529 1 1 33 ARG CA C 6.107 6.998 2.640 1.00 . A A . 33 ARG CA 1 1 9 5530 1 1 33 ARG CB C 5.444 8.011 3.575 1.00 . A A . 33 ARG CB 1 1 9 5531 1 1 33 ARG CD C 4.076 10.106 3.806 1.00 . A A . 33 ARG CD 1 1 9 5532 1 1 33 ARG CG C 4.597 9.044 2.851 1.00 . A A . 33 ARG CG 1 1 9 5533 1 1 33 ARG CZ C 5.376 12.045 3.037 1.00 . A A . 33 ARG CZ 1 1 9 5534 1 1 33 ARG H H 4.246 5.989 2.609 1.00 . A A . 33 ARG H 1 1 9 5535 1 1 33 ARG HA H 6.360 7.489 1.713 1.00 . A A . 33 ARG HA 1 1 9 5536 1 1 33 ARG HB2 H 4.809 7.481 4.270 1.00 . A A . 33 ARG HB2 1 1 9 5537 1 1 33 ARG HB3 H 6.213 8.530 4.127 1.00 . A A . 33 ARG HB3 1 1 9 5538 1 1 33 ARG HD2 H 3.160 10.514 3.405 1.00 . A A . 33 ARG HD2 1 1 9 5539 1 1 33 ARG HD3 H 3.876 9.644 4.762 1.00 . A A . 33 ARG HD3 1 1 9 5540 1 1 33 ARG HE H 5.444 11.286 4.880 1.00 . A A . 33 ARG HE 1 1 9 5541 1 1 33 ARG HG2 H 5.199 9.523 2.093 1.00 . A A . 33 ARG HG2 1 1 9 5542 1 1 33 ARG HG3 H 3.758 8.547 2.386 1.00 . A A . 33 ARG HG3 1 1 9 5543 1 1 33 ARG HH11 H 4.174 11.219 1.639 1.00 . A A . 33 ARG HH11 1 1 9 5544 1 1 33 ARG HH12 H 5.097 12.587 1.110 1.00 . A A . 33 ARG HH12 1 1 9 5545 1 1 33 ARG HH21 H 6.663 13.088 4.196 1.00 . A A . 33 ARG HH21 1 1 9 5546 1 1 33 ARG HH22 H 6.513 13.649 2.565 1.00 . A A . 33 ARG HH22 1 1 9 5547 1 1 33 ARG N N 5.184 5.911 2.334 1.00 . A A . 33 ARG N 1 1 9 5548 1 1 33 ARG NE N 5.035 11.191 3.995 1.00 . A A . 33 ARG NE 1 1 9 5549 1 1 33 ARG NH1 N 4.839 11.941 1.830 1.00 . A A . 33 ARG NH1 1 1 9 5550 1 1 33 ARG NH2 N 6.256 13.006 3.286 1.00 . A A . 33 ARG NH2 1 1 9 5551 1 1 33 ARG O O 8.489 6.738 2.808 1.00 . A A . 33 ARG O 1 1 9 5552 1 1 34 VAL C C 9.441 4.656 4.074 1.00 . A A . 34 VAL C 1 1 9 5553 1 1 34 VAL CA C 8.369 5.118 5.054 1.00 . A A . 34 VAL CA 1 1 9 5554 1 1 34 VAL CB C 7.944 3.927 5.933 1.00 . A A . 34 VAL CB 1 1 9 5555 1 1 34 VAL CG1 C 7.046 4.394 7.068 1.00 . A A . 34 VAL CG1 1 1 9 5556 1 1 34 VAL CG2 C 7.248 2.867 5.093 1.00 . A A . 34 VAL CG2 1 1 9 5557 1 1 34 VAL H H 6.323 5.509 4.679 1.00 . A A . 34 VAL H 1 1 9 5558 1 1 34 VAL HA H 8.786 5.881 5.695 1.00 . A A . 34 VAL HA 1 1 9 5559 1 1 34 VAL HB H 8.832 3.489 6.364 1.00 . A A . 34 VAL HB 1 1 9 5560 1 1 34 VAL HG11 H 6.288 5.058 6.677 1.00 . A A . 34 VAL HG11 1 1 9 5561 1 1 34 VAL HG12 H 6.574 3.539 7.530 1.00 . A A . 34 VAL HG12 1 1 9 5562 1 1 34 VAL HG13 H 7.638 4.919 7.803 1.00 . A A . 34 VAL HG13 1 1 9 5563 1 1 34 VAL HG21 H 7.850 1.971 5.073 1.00 . A A . 34 VAL HG21 1 1 9 5564 1 1 34 VAL HG22 H 6.283 2.644 5.523 1.00 . A A . 34 VAL HG22 1 1 9 5565 1 1 34 VAL HG23 H 7.116 3.234 4.085 1.00 . A A . 34 VAL HG23 1 1 9 5566 1 1 34 VAL N N 7.228 5.694 4.352 1.00 . A A . 34 VAL N 1 1 9 5567 1 1 34 VAL O O 10.624 4.601 4.411 1.00 . A A . 34 VAL O 1 1 9 5568 1 1 35 HIS C C 10.178 4.956 0.784 1.00 . A A . 35 HIS C 1 1 9 5569 1 1 35 HIS CA C 9.945 3.866 1.827 1.00 . A A . 35 HIS CA 1 1 9 5570 1 1 35 HIS CB C 9.406 2.605 1.151 1.00 . A A . 35 HIS CB 1 1 9 5571 1 1 35 HIS CD2 C 7.771 0.978 2.337 1.00 . A A . 35 HIS CD2 1 1 9 5572 1 1 35 HIS CE1 C 9.193 0.048 3.722 1.00 . A A . 35 HIS CE1 1 1 9 5573 1 1 35 HIS CG C 8.981 1.543 2.117 1.00 . A A . 35 HIS CG 1 1 9 5574 1 1 35 HIS H H 8.065 4.388 2.649 1.00 . A A . 35 HIS H 1 1 9 5575 1 1 35 HIS HA H 10.885 3.635 2.304 1.00 . A A . 35 HIS HA 1 1 9 5576 1 1 35 HIS HB2 H 8.548 2.866 0.548 1.00 . A A . 35 HIS HB2 1 1 9 5577 1 1 35 HIS HB3 H 10.173 2.189 0.515 1.00 . A A . 35 HIS HB3 1 1 9 5578 1 1 35 HIS HD1 H 10.806 1.134 3.087 1.00 . A A . 35 HIS HD1 1 1 9 5579 1 1 35 HIS HD2 H 6.850 1.212 1.820 1.00 . A A . 35 HIS HD2 1 1 9 5580 1 1 35 HIS HE1 H 9.616 -0.578 4.493 1.00 . A A . 35 HIS HE1 1 1 9 5581 1 1 35 HIS N N 9.020 4.324 2.858 1.00 . A A . 35 HIS N 1 1 9 5582 1 1 35 HIS ND1 N 9.850 0.939 3.002 1.00 . A A . 35 HIS ND1 1 1 9 5583 1 1 35 HIS NE2 N 7.929 0.052 3.338 1.00 . A A . 35 HIS NE2 1 1 9 5584 1 1 35 HIS O O 9.404 5.908 0.683 1.00 . A A . 35 HIS O 1 1 9 5585 1 1 36 SER C C 11.427 5.180 -2.410 1.00 . A A . 36 SER C 1 1 9 5586 1 1 36 SER CA C 11.589 5.784 -1.018 1.00 . A A . 36 SER CA 1 1 9 5587 1 1 36 SER CB C 13.023 6.281 -0.829 1.00 . A A . 36 SER CB 1 1 9 5588 1 1 36 SER H H 11.830 4.030 0.142 1.00 . A A . 36 SER H 1 1 9 5589 1 1 36 SER HA H 10.911 6.619 -0.920 1.00 . A A . 36 SER HA 1 1 9 5590 1 1 36 SER HB2 H 13.110 6.764 0.132 1.00 . A A . 36 SER HB2 1 1 9 5591 1 1 36 SER HB3 H 13.701 5.441 -0.873 1.00 . A A . 36 SER HB3 1 1 9 5592 1 1 36 SER HG H 12.993 6.935 -2.676 1.00 . A A . 36 SER HG 1 1 9 5593 1 1 36 SER N N 11.251 4.810 0.013 1.00 . A A . 36 SER N 1 1 9 5594 1 1 36 SER O O 11.851 4.053 -2.663 1.00 . A A . 36 SER O 1 1 9 5595 1 1 36 SER OG O 13.379 7.209 -1.840 1.00 . A A . 36 SER OG 1 1 9 5596 1 1 37 GLY C C 11.237 6.370 -5.702 1.00 . A A . 37 GLY C 1 1 9 5597 1 1 37 GLY CA C 10.603 5.464 -4.665 1.00 . A A . 37 GLY CA 1 1 9 5598 1 1 37 GLY H H 10.494 6.830 -3.052 1.00 . A A . 37 GLY H 1 1 9 5599 1 1 37 GLY HA2 H 11.029 4.476 -4.758 1.00 . A A . 37 GLY HA2 1 1 9 5600 1 1 37 GLY HA3 H 9.541 5.406 -4.856 1.00 . A A . 37 GLY HA3 1 1 9 5601 1 1 37 GLY N N 10.811 5.940 -3.310 1.00 . A A . 37 GLY N 1 1 9 5602 1 1 37 GLY O O 10.537 7.057 -6.445 1.00 . A A . 37 GLY O 1 1 9 5603 1 1 38 GLU C C 12.940 8.679 -6.517 1.00 . A A . 38 GLU C 1 1 9 5604 1 1 38 GLU CA C 13.292 7.206 -6.702 1.00 . A A . 38 GLU CA 1 1 9 5605 1 1 38 GLU CB C 12.980 6.772 -8.135 1.00 . A A . 38 GLU CB 1 1 9 5606 1 1 38 GLU CD C 13.813 5.424 -10.102 1.00 . A A . 38 GLU CD 1 1 9 5607 1 1 38 GLU CG C 13.778 5.563 -8.593 1.00 . A A . 38 GLU CG 1 1 9 5608 1 1 38 GLU H H 13.068 5.805 -5.131 1.00 . A A . 38 GLU H 1 1 9 5609 1 1 38 GLU HA H 14.348 7.075 -6.518 1.00 . A A . 38 GLU HA 1 1 9 5610 1 1 38 GLU HB2 H 11.929 6.531 -8.205 1.00 . A A . 38 GLU HB2 1 1 9 5611 1 1 38 GLU HB3 H 13.196 7.593 -8.802 1.00 . A A . 38 GLU HB3 1 1 9 5612 1 1 38 GLU HG2 H 14.792 5.660 -8.232 1.00 . A A . 38 GLU HG2 1 1 9 5613 1 1 38 GLU HG3 H 13.332 4.673 -8.174 1.00 . A A . 38 GLU HG3 1 1 9 5614 1 1 38 GLU N N 12.565 6.374 -5.750 1.00 . A A . 38 GLU N 1 1 9 5615 1 1 38 GLU O O 12.730 9.406 -7.488 1.00 . A A . 38 GLU O 1 1 9 5616 1 1 38 GLU OE1 O 14.558 6.189 -10.751 1.00 . A A . 38 GLU OE1 1 1 9 5617 1 1 38 GLU OE2 O 13.096 4.552 -10.635 1.00 . A A . 38 GLU OE2 1 1 9 5618 1 1 39 LYS C C 13.760 11.225 -4.370 1.00 . A A . 39 LYS C 1 1 9 5619 1 1 39 LYS CA C 12.550 10.499 -4.947 1.00 . A A . 39 LYS CA 1 1 9 5620 1 1 39 LYS CB C 11.386 10.558 -3.955 1.00 . A A . 39 LYS CB 1 1 9 5621 1 1 39 LYS CD C 9.935 12.249 -5.115 1.00 . A A . 39 LYS CD 1 1 9 5622 1 1 39 LYS CE C 8.496 11.772 -4.996 1.00 . A A . 39 LYS CE 1 1 9 5623 1 1 39 LYS CG C 10.734 11.927 -3.863 1.00 . A A . 39 LYS CG 1 1 9 5624 1 1 39 LYS H H 13.053 8.486 -4.530 1.00 . A A . 39 LYS H 1 1 9 5625 1 1 39 LYS HA H 12.255 10.987 -5.864 1.00 . A A . 39 LYS HA 1 1 9 5626 1 1 39 LYS HB2 H 10.634 9.844 -4.258 1.00 . A A . 39 LYS HB2 1 1 9 5627 1 1 39 LYS HB3 H 11.751 10.289 -2.974 1.00 . A A . 39 LYS HB3 1 1 9 5628 1 1 39 LYS HD2 H 9.936 13.318 -5.267 1.00 . A A . 39 LYS HD2 1 1 9 5629 1 1 39 LYS HD3 H 10.398 11.763 -5.962 1.00 . A A . 39 LYS HD3 1 1 9 5630 1 1 39 LYS HE2 H 8.202 11.810 -3.959 1.00 . A A . 39 LYS HE2 1 1 9 5631 1 1 39 LYS HE3 H 7.863 12.430 -5.574 1.00 . A A . 39 LYS HE3 1 1 9 5632 1 1 39 LYS HG2 H 10.070 11.942 -3.012 1.00 . A A . 39 LYS HG2 1 1 9 5633 1 1 39 LYS HG3 H 11.504 12.674 -3.736 1.00 . A A . 39 LYS HG3 1 1 9 5634 1 1 39 LYS HZ1 H 7.323 10.122 -5.512 1.00 . A A . 39 LYS HZ1 1 1 9 5635 1 1 39 LYS HZ2 H 8.837 9.715 -4.875 1.00 . A A . 39 LYS HZ2 1 1 9 5636 1 1 39 LYS HZ3 H 8.715 10.296 -6.458 1.00 . A A . 39 LYS HZ3 1 1 9 5637 1 1 39 LYS N N 12.876 9.113 -5.262 1.00 . A A . 39 LYS N 1 1 9 5638 1 1 39 LYS NZ N 8.331 10.379 -5.495 1.00 . A A . 39 LYS NZ 1 1 9 5639 1 1 39 LYS O O 14.484 10.700 -3.523 1.00 . A A . 39 LYS O 1 1 9 5640 1 1 40 PRO C C 14.933 13.757 -2.938 1.00 . A A . 40 PRO C 1 1 9 5641 1 1 40 PRO CA C 15.109 13.287 -4.378 1.00 . A A . 40 PRO CA 1 1 9 5642 1 1 40 PRO CB C 15.086 14.481 -5.336 1.00 . A A . 40 PRO CB 1 1 9 5643 1 1 40 PRO CD C 13.166 13.151 -5.846 1.00 . A A . 40 PRO CD 1 1 9 5644 1 1 40 PRO CG C 13.673 14.566 -5.801 1.00 . A A . 40 PRO CG 1 1 9 5645 1 1 40 PRO HA H 16.050 12.766 -4.473 1.00 . A A . 40 PRO HA 1 1 9 5646 1 1 40 PRO HB2 H 15.383 15.376 -4.807 1.00 . A A . 40 PRO HB2 1 1 9 5647 1 1 40 PRO HB3 H 15.762 14.301 -6.158 1.00 . A A . 40 PRO HB3 1 1 9 5648 1 1 40 PRO HD2 H 12.120 13.116 -5.581 1.00 . A A . 40 PRO HD2 1 1 9 5649 1 1 40 PRO HD3 H 13.323 12.725 -6.826 1.00 . A A . 40 PRO HD3 1 1 9 5650 1 1 40 PRO HG2 H 13.091 15.151 -5.105 1.00 . A A . 40 PRO HG2 1 1 9 5651 1 1 40 PRO HG3 H 13.637 15.008 -6.786 1.00 . A A . 40 PRO HG3 1 1 9 5652 1 1 40 PRO N N 13.987 12.462 -4.836 1.00 . A A . 40 PRO N 1 1 9 5653 1 1 40 PRO O O 15.848 13.644 -2.122 1.00 . A A . 40 PRO O 1 1 9 5654 1 1 41 SER C C 13.738 13.696 -0.245 1.00 . A A . 41 SER C 1 1 9 5655 1 1 41 SER CA C 13.457 14.772 -1.290 1.00 . A A . 41 SER CA 1 1 9 5656 1 1 41 SER CB C 11.998 15.221 -1.197 1.00 . A A . 41 SER CB 1 1 9 5657 1 1 41 SER H H 13.062 14.345 -3.326 1.00 . A A . 41 SER H 1 1 9 5658 1 1 41 SER HA H 14.099 15.619 -1.098 1.00 . A A . 41 SER HA 1 1 9 5659 1 1 41 SER HB2 H 11.352 14.394 -1.450 1.00 . A A . 41 SER HB2 1 1 9 5660 1 1 41 SER HB3 H 11.788 15.546 -0.188 1.00 . A A . 41 SER HB3 1 1 9 5661 1 1 41 SER HG H 10.805 16.523 -2.045 1.00 . A A . 41 SER HG 1 1 9 5662 1 1 41 SER N N 13.751 14.282 -2.632 1.00 . A A . 41 SER N 1 1 9 5663 1 1 41 SER O O 14.325 13.968 0.801 1.00 . A A . 41 SER O 1 1 9 5664 1 1 41 SER OG O 11.736 16.293 -2.086 1.00 . A A . 41 SER OG 1 1 9 5665 1 1 42 GLY C C 14.961 10.884 0.384 1.00 . A A . 42 GLY C 1 1 9 5666 1 1 42 GLY CA C 13.526 11.371 0.385 1.00 . A A . 42 GLY CA 1 1 9 5667 1 1 42 GLY H H 12.849 12.312 -1.388 1.00 . A A . 42 GLY H 1 1 9 5668 1 1 42 GLY HA2 H 13.267 11.696 1.381 1.00 . A A . 42 GLY HA2 1 1 9 5669 1 1 42 GLY HA3 H 12.880 10.551 0.105 1.00 . A A . 42 GLY HA3 1 1 9 5670 1 1 42 GLY N N 13.312 12.470 -0.538 1.00 . A A . 42 GLY N 1 1 9 5671 1 1 42 GLY O O 15.851 11.509 -0.193 1.00 . A A . 42 GLY O 1 1 9 5672 1 1 43 PRO C C 17.017 8.589 -0.200 1.00 . A A . 43 PRO C 1 1 9 5673 1 1 43 PRO CA C 16.541 9.149 1.136 1.00 . A A . 43 PRO CA 1 1 9 5674 1 1 43 PRO CB C 16.359 8.020 2.154 1.00 . A A . 43 PRO CB 1 1 9 5675 1 1 43 PRO CD C 14.191 8.945 1.758 1.00 . A A . 43 PRO CD 1 1 9 5676 1 1 43 PRO CG C 14.915 7.665 2.073 1.00 . A A . 43 PRO CG 1 1 9 5677 1 1 43 PRO HA H 17.266 9.858 1.508 1.00 . A A . 43 PRO HA 1 1 9 5678 1 1 43 PRO HB2 H 16.988 7.183 1.884 1.00 . A A . 43 PRO HB2 1 1 9 5679 1 1 43 PRO HB3 H 16.624 8.373 3.139 1.00 . A A . 43 PRO HB3 1 1 9 5680 1 1 43 PRO HD2 H 13.339 8.750 1.124 1.00 . A A . 43 PRO HD2 1 1 9 5681 1 1 43 PRO HD3 H 13.882 9.438 2.668 1.00 . A A . 43 PRO HD3 1 1 9 5682 1 1 43 PRO HG2 H 14.758 6.942 1.287 1.00 . A A . 43 PRO HG2 1 1 9 5683 1 1 43 PRO HG3 H 14.580 7.270 3.021 1.00 . A A . 43 PRO HG3 1 1 9 5684 1 1 43 PRO N N 15.204 9.743 1.046 1.00 . A A . 43 PRO N 1 1 9 5685 1 1 43 PRO O O 16.277 8.591 -1.184 1.00 . A A . 43 PRO O 1 1 9 5686 1 1 44 SER C C 19.191 6.082 -1.250 1.00 . A A . 44 SER C 1 1 9 5687 1 1 44 SER CA C 18.834 7.552 -1.445 1.00 . A A . 44 SER CA 1 1 9 5688 1 1 44 SER CB C 20.079 8.341 -1.854 1.00 . A A . 44 SER CB 1 1 9 5689 1 1 44 SER H H 18.798 8.138 0.590 1.00 . A A . 44 SER H 1 1 9 5690 1 1 44 SER HA H 18.095 7.630 -2.228 1.00 . A A . 44 SER HA 1 1 9 5691 1 1 44 SER HB2 H 19.866 9.398 -1.801 1.00 . A A . 44 SER HB2 1 1 9 5692 1 1 44 SER HB3 H 20.890 8.103 -1.181 1.00 . A A . 44 SER HB3 1 1 9 5693 1 1 44 SER HG H 20.164 7.140 -3.399 1.00 . A A . 44 SER HG 1 1 9 5694 1 1 44 SER N N 18.257 8.112 -0.228 1.00 . A A . 44 SER N 1 1 9 5695 1 1 44 SER O O 19.736 5.695 -0.217 1.00 . A A . 44 SER O 1 1 9 5696 1 1 44 SER OG O 20.474 8.021 -3.177 1.00 . A A . 44 SER OG 1 1 9 5697 1 1 45 SER C C 19.405 3.271 -3.588 1.00 . A A . 45 SER C 1 1 9 5698 1 1 45 SER CA C 19.162 3.837 -2.192 1.00 . A A . 45 SER CA 1 1 9 5699 1 1 45 SER CB C 18.004 3.094 -1.522 1.00 . A A . 45 SER CB 1 1 9 5700 1 1 45 SER H H 18.445 5.634 -3.051 1.00 . A A . 45 SER H 1 1 9 5701 1 1 45 SER HA H 20.056 3.701 -1.601 1.00 . A A . 45 SER HA 1 1 9 5702 1 1 45 SER HB2 H 18.253 2.047 -1.437 1.00 . A A . 45 SER HB2 1 1 9 5703 1 1 45 SER HB3 H 17.837 3.506 -0.537 1.00 . A A . 45 SER HB3 1 1 9 5704 1 1 45 SER HG H 16.849 4.023 -2.802 1.00 . A A . 45 SER HG 1 1 9 5705 1 1 45 SER N N 18.878 5.266 -2.252 1.00 . A A . 45 SER N 1 1 9 5706 1 1 45 SER O O 18.694 3.602 -4.536 1.00 . A A . 45 SER O 1 1 9 5707 1 1 45 SER OG O 16.813 3.219 -2.278 1.00 . A A . 45 SER OG 1 1 9 5708 1 1 46 GLY C C 19.750 0.737 -5.386 1.00 . A A . 46 GLY C 1 1 9 5709 1 1 46 GLY CA C 20.736 1.817 -4.988 1.00 . A A . 46 GLY CA 1 1 9 5710 1 1 46 GLY H H 20.948 2.188 -2.914 1.00 . A A . 46 GLY H 1 1 9 5711 1 1 46 GLY HA2 H 20.733 2.588 -5.743 1.00 . A A . 46 GLY HA2 1 1 9 5712 1 1 46 GLY HA3 H 21.724 1.384 -4.934 1.00 . A A . 46 GLY HA3 1 1 9 5713 1 1 46 GLY N N 20.416 2.415 -3.705 1.00 . A A . 46 GLY N 1 1 9 5714 1 1 46 GLY O O 20.117 -0.437 -5.392 1.00 . A A . 46 GLY O 1 1 9 5715 2 2 1 ZN ZN ZN 6.455 -1.142 3.460 1.00 . B A . 181 ZN ZN 1 1 10 5716 1 1 1 GLY C C 5.317 -32.186 6.061 1.00 . A A . 1 GLY C 1 1 10 5717 1 1 1 GLY CA C 6.760 -32.340 5.620 1.00 . A A . 1 GLY CA 1 1 10 5718 1 1 1 GLY H1 H 6.959 -30.232 5.658 1.00 . A A . 1 GLY H1 1 1 10 5719 1 1 1 GLY HA2 H 6.779 -32.800 4.644 1.00 . A A . 1 GLY HA2 1 1 10 5720 1 1 1 GLY HA3 H 7.271 -32.983 6.321 1.00 . A A . 1 GLY HA3 1 1 10 5721 1 1 1 GLY N N 7.458 -31.069 5.555 1.00 . A A . 1 GLY N 1 1 10 5722 1 1 1 GLY O O 5.038 -32.028 7.250 1.00 . A A . 1 GLY O 1 1 10 5723 1 1 2 SER C C 2.657 -30.671 5.859 1.00 . A A . 2 SER C 1 1 10 5724 1 1 2 SER CA C 2.978 -32.089 5.396 1.00 . A A . 2 SER CA 1 1 10 5725 1 1 2 SER CB C 2.556 -33.096 6.469 1.00 . A A . 2 SER CB 1 1 10 5726 1 1 2 SER H H 4.684 -32.359 4.172 1.00 . A A . 2 SER H 1 1 10 5727 1 1 2 SER HA H 2.429 -32.292 4.489 1.00 . A A . 2 SER HA 1 1 10 5728 1 1 2 SER HB2 H 3.078 -34.027 6.311 1.00 . A A . 2 SER HB2 1 1 10 5729 1 1 2 SER HB3 H 2.805 -32.703 7.444 1.00 . A A . 2 SER HB3 1 1 10 5730 1 1 2 SER HG H 0.882 -33.417 5.502 1.00 . A A . 2 SER HG 1 1 10 5731 1 1 2 SER N N 4.399 -32.230 5.101 1.00 . A A . 2 SER N 1 1 10 5732 1 1 2 SER O O 1.895 -30.473 6.805 1.00 . A A . 2 SER O 1 1 10 5733 1 1 2 SER OG O 1.161 -33.340 6.418 1.00 . A A . 2 SER OG 1 1 10 5734 1 1 3 SER C C 1.542 -27.940 5.467 1.00 . A A . 3 SER C 1 1 10 5735 1 1 3 SER CA C 3.026 -28.288 5.528 1.00 . A A . 3 SER CA 1 1 10 5736 1 1 3 SER CB C 3.814 -27.380 4.582 1.00 . A A . 3 SER CB 1 1 10 5737 1 1 3 SER H H 3.842 -29.911 4.440 1.00 . A A . 3 SER H 1 1 10 5738 1 1 3 SER HA H 3.379 -28.135 6.537 1.00 . A A . 3 SER HA 1 1 10 5739 1 1 3 SER HB2 H 3.838 -27.824 3.598 1.00 . A A . 3 SER HB2 1 1 10 5740 1 1 3 SER HB3 H 3.332 -26.415 4.529 1.00 . A A . 3 SER HB3 1 1 10 5741 1 1 3 SER HG H 5.400 -27.952 5.579 1.00 . A A . 3 SER HG 1 1 10 5742 1 1 3 SER N N 3.245 -29.689 5.184 1.00 . A A . 3 SER N 1 1 10 5743 1 1 3 SER O O 1.001 -27.665 4.397 1.00 . A A . 3 SER O 1 1 10 5744 1 1 3 SER OG O 5.145 -27.203 5.035 1.00 . A A . 3 SER OG 1 1 10 5745 1 1 4 GLY C C -0.782 -26.165 6.932 1.00 . A A . 4 GLY C 1 1 10 5746 1 1 4 GLY CA C -0.526 -27.638 6.683 1.00 . A A . 4 GLY CA 1 1 10 5747 1 1 4 GLY H H 1.372 -28.180 7.447 1.00 . A A . 4 GLY H 1 1 10 5748 1 1 4 GLY HA2 H -0.985 -27.919 5.746 1.00 . A A . 4 GLY HA2 1 1 10 5749 1 1 4 GLY HA3 H -0.979 -28.210 7.479 1.00 . A A . 4 GLY HA3 1 1 10 5750 1 1 4 GLY N N 0.889 -27.954 6.625 1.00 . A A . 4 GLY N 1 1 10 5751 1 1 4 GLY O O -1.683 -25.804 7.690 1.00 . A A . 4 GLY O 1 1 10 5752 1 1 5 SER C C -1.515 -23.407 6.024 1.00 . A A . 5 SER C 1 1 10 5753 1 1 5 SER CA C -0.127 -23.869 6.457 1.00 . A A . 5 SER CA 1 1 10 5754 1 1 5 SER CB C 0.943 -23.137 5.645 1.00 . A A . 5 SER CB 1 1 10 5755 1 1 5 SER H H 0.714 -25.661 5.705 1.00 . A A . 5 SER H 1 1 10 5756 1 1 5 SER HA H 0.006 -23.638 7.504 1.00 . A A . 5 SER HA 1 1 10 5757 1 1 5 SER HB2 H 0.633 -22.115 5.485 1.00 . A A . 5 SER HB2 1 1 10 5758 1 1 5 SER HB3 H 1.876 -23.149 6.190 1.00 . A A . 5 SER HB3 1 1 10 5759 1 1 5 SER HG H 0.449 -24.405 4.236 1.00 . A A . 5 SER HG 1 1 10 5760 1 1 5 SER N N 0.014 -25.311 6.296 1.00 . A A . 5 SER N 1 1 10 5761 1 1 5 SER O O -2.147 -22.589 6.694 1.00 . A A . 5 SER O 1 1 10 5762 1 1 5 SER OG O 1.141 -23.756 4.386 1.00 . A A . 5 SER OG 1 1 10 5763 1 1 6 SER C C -3.615 -22.114 4.664 1.00 . A A . 6 SER C 1 1 10 5764 1 1 6 SER CA C -3.296 -23.577 4.373 1.00 . A A . 6 SER CA 1 1 10 5765 1 1 6 SER CB C -4.376 -24.476 4.978 1.00 . A A . 6 SER CB 1 1 10 5766 1 1 6 SER H H -1.433 -24.583 4.410 1.00 . A A . 6 SER H 1 1 10 5767 1 1 6 SER HA H -3.275 -23.723 3.303 1.00 . A A . 6 SER HA 1 1 10 5768 1 1 6 SER HB2 H -5.315 -24.290 4.481 1.00 . A A . 6 SER HB2 1 1 10 5769 1 1 6 SER HB3 H -4.096 -25.511 4.842 1.00 . A A . 6 SER HB3 1 1 10 5770 1 1 6 SER HG H -5.136 -23.487 6.488 1.00 . A A . 6 SER HG 1 1 10 5771 1 1 6 SER N N -1.984 -23.937 4.899 1.00 . A A . 6 SER N 1 1 10 5772 1 1 6 SER O O -4.724 -21.779 5.077 1.00 . A A . 6 SER O 1 1 10 5773 1 1 6 SER OG O -4.533 -24.224 6.363 1.00 . A A . 6 SER OG 1 1 10 5774 1 1 7 GLY C C -4.233 -19.370 4.355 1.00 . A A . 7 GLY C 1 1 10 5775 1 1 7 GLY CA C -2.827 -19.828 4.688 1.00 . A A . 7 GLY CA 1 1 10 5776 1 1 7 GLY H H -1.768 -21.569 4.115 1.00 . A A . 7 GLY H 1 1 10 5777 1 1 7 GLY HA2 H -2.630 -19.623 5.730 1.00 . A A . 7 GLY HA2 1 1 10 5778 1 1 7 GLY HA3 H -2.127 -19.271 4.083 1.00 . A A . 7 GLY HA3 1 1 10 5779 1 1 7 GLY N N -2.632 -21.245 4.444 1.00 . A A . 7 GLY N 1 1 10 5780 1 1 7 GLY O O -4.816 -19.802 3.360 1.00 . A A . 7 GLY O 1 1 10 5781 1 1 8 THR C C -6.328 -17.531 3.536 1.00 . A A . 8 THR C 1 1 10 5782 1 1 8 THR CA C -6.129 -17.978 4.979 1.00 . A A . 8 THR CA 1 1 10 5783 1 1 8 THR CB C -6.430 -16.793 5.917 1.00 . A A . 8 THR CB 1 1 10 5784 1 1 8 THR CG2 C -7.847 -16.281 5.705 1.00 . A A . 8 THR CG2 1 1 10 5785 1 1 8 THR H H -4.267 -18.185 5.964 1.00 . A A . 8 THR H 1 1 10 5786 1 1 8 THR HA H -6.827 -18.771 5.200 1.00 . A A . 8 THR HA 1 1 10 5787 1 1 8 THR HB H -5.737 -15.994 5.697 1.00 . A A . 8 THR HB 1 1 10 5788 1 1 8 THR HG1 H -5.487 -17.756 7.357 1.00 . A A . 8 THR HG1 1 1 10 5789 1 1 8 THR HG21 H -8.550 -16.985 6.123 1.00 . A A . 8 THR HG21 1 1 10 5790 1 1 8 THR HG22 H -8.035 -16.171 4.647 1.00 . A A . 8 THR HG22 1 1 10 5791 1 1 8 THR HG23 H -7.961 -15.325 6.193 1.00 . A A . 8 THR HG23 1 1 10 5792 1 1 8 THR N N -4.782 -18.492 5.189 1.00 . A A . 8 THR N 1 1 10 5793 1 1 8 THR O O -7.183 -18.058 2.825 1.00 . A A . 8 THR O 1 1 10 5794 1 1 8 THR OG1 O -6.262 -17.194 7.282 1.00 . A A . 8 THR OG1 1 1 10 5795 1 1 9 GLY C C -4.692 -14.900 1.482 1.00 . A A . 9 GLY C 1 1 10 5796 1 1 9 GLY CA C -5.638 -16.054 1.749 1.00 . A A . 9 GLY CA 1 1 10 5797 1 1 9 GLY H H -4.870 -16.172 3.719 1.00 . A A . 9 GLY H 1 1 10 5798 1 1 9 GLY HA2 H -5.414 -16.857 1.063 1.00 . A A . 9 GLY HA2 1 1 10 5799 1 1 9 GLY HA3 H -6.651 -15.721 1.578 1.00 . A A . 9 GLY HA3 1 1 10 5800 1 1 9 GLY N N -5.533 -16.555 3.107 1.00 . A A . 9 GLY N 1 1 10 5801 1 1 9 GLY O O -3.516 -14.959 1.839 1.00 . A A . 9 GLY O 1 1 10 5802 1 1 10 GLU C C -5.204 -11.395 0.713 1.00 . A A . 10 GLU C 1 1 10 5803 1 1 10 GLU CA C -4.398 -12.679 0.534 1.00 . A A . 10 GLU CA 1 1 10 5804 1 1 10 GLU CB C -3.872 -12.767 -0.901 1.00 . A A . 10 GLU CB 1 1 10 5805 1 1 10 GLU CD C -2.128 -13.717 -2.462 1.00 . A A . 10 GLU CD 1 1 10 5806 1 1 10 GLU CG C -2.553 -13.510 -1.020 1.00 . A A . 10 GLU CG 1 1 10 5807 1 1 10 GLU H H -6.152 -13.862 0.592 1.00 . A A . 10 GLU H 1 1 10 5808 1 1 10 GLU HA H -3.560 -12.661 1.214 1.00 . A A . 10 GLU HA 1 1 10 5809 1 1 10 GLU HB2 H -4.605 -13.276 -1.509 1.00 . A A . 10 GLU HB2 1 1 10 5810 1 1 10 GLU HB3 H -3.733 -11.766 -1.282 1.00 . A A . 10 GLU HB3 1 1 10 5811 1 1 10 GLU HG2 H -1.787 -12.942 -0.514 1.00 . A A . 10 GLU HG2 1 1 10 5812 1 1 10 GLU HG3 H -2.654 -14.477 -0.549 1.00 . A A . 10 GLU HG3 1 1 10 5813 1 1 10 GLU N N -5.207 -13.850 0.851 1.00 . A A . 10 GLU N 1 1 10 5814 1 1 10 GLU O O -6.422 -11.383 0.531 1.00 . A A . 10 GLU O 1 1 10 5815 1 1 10 GLU OE1 O -2.872 -14.384 -3.210 1.00 . A A . 10 GLU OE1 1 1 10 5816 1 1 10 GLU OE2 O -1.051 -13.210 -2.840 1.00 . A A . 10 GLU OE2 1 1 10 5817 1 1 11 LYS C C -5.092 -8.175 0.014 1.00 . A A . 11 LYS C 1 1 10 5818 1 1 11 LYS CA C -5.166 -9.028 1.277 1.00 . A A . 11 LYS CA 1 1 10 5819 1 1 11 LYS CB C -4.514 -8.284 2.445 1.00 . A A . 11 LYS CB 1 1 10 5820 1 1 11 LYS CD C -2.546 -9.604 3.279 1.00 . A A . 11 LYS CD 1 1 10 5821 1 1 11 LYS CE C -1.124 -10.010 2.924 1.00 . A A . 11 LYS CE 1 1 10 5822 1 1 11 LYS CG C -3.000 -8.400 2.471 1.00 . A A . 11 LYS CG 1 1 10 5823 1 1 11 LYS H H -3.547 -10.390 1.203 1.00 . A A . 11 LYS H 1 1 10 5824 1 1 11 LYS HA H -6.203 -9.212 1.512 1.00 . A A . 11 LYS HA 1 1 10 5825 1 1 11 LYS HB2 H -4.773 -7.238 2.380 1.00 . A A . 11 LYS HB2 1 1 10 5826 1 1 11 LYS HB3 H -4.900 -8.685 3.371 1.00 . A A . 11 LYS HB3 1 1 10 5827 1 1 11 LYS HD2 H -2.586 -9.357 4.330 1.00 . A A . 11 LYS HD2 1 1 10 5828 1 1 11 LYS HD3 H -3.210 -10.433 3.077 1.00 . A A . 11 LYS HD3 1 1 10 5829 1 1 11 LYS HE2 H -1.024 -11.076 3.059 1.00 . A A . 11 LYS HE2 1 1 10 5830 1 1 11 LYS HE3 H -0.941 -9.761 1.889 1.00 . A A . 11 LYS HE3 1 1 10 5831 1 1 11 LYS HG2 H -2.639 -8.503 1.458 1.00 . A A . 11 LYS HG2 1 1 10 5832 1 1 11 LYS HG3 H -2.587 -7.505 2.913 1.00 . A A . 11 LYS HG3 1 1 10 5833 1 1 11 LYS HZ1 H 0.813 -9.334 3.315 1.00 . A A . 11 LYS HZ1 1 1 10 5834 1 1 11 LYS HZ2 H -0.047 -9.789 4.699 1.00 . A A . 11 LYS HZ2 1 1 10 5835 1 1 11 LYS HZ3 H -0.402 -8.327 3.927 1.00 . A A . 11 LYS HZ3 1 1 10 5836 1 1 11 LYS N N -4.516 -10.317 1.073 1.00 . A A . 11 LYS N 1 1 10 5837 1 1 11 LYS NZ N -0.120 -9.316 3.776 1.00 . A A . 11 LYS NZ 1 1 10 5838 1 1 11 LYS O O -4.169 -8.294 -0.791 1.00 . A A . 11 LYS O 1 1 10 5839 1 1 12 PRO C C -5.076 -5.327 -1.297 1.00 . A A . 12 PRO C 1 1 10 5840 1 1 12 PRO CA C -6.156 -6.402 -1.326 1.00 . A A . 12 PRO CA 1 1 10 5841 1 1 12 PRO CB C -7.545 -5.769 -1.206 1.00 . A A . 12 PRO CB 1 1 10 5842 1 1 12 PRO CD C -7.221 -7.097 0.755 1.00 . A A . 12 PRO CD 1 1 10 5843 1 1 12 PRO CG C -7.868 -5.839 0.247 1.00 . A A . 12 PRO CG 1 1 10 5844 1 1 12 PRO HA H -6.089 -6.953 -2.253 1.00 . A A . 12 PRO HA 1 1 10 5845 1 1 12 PRO HB2 H -7.508 -4.747 -1.555 1.00 . A A . 12 PRO HB2 1 1 10 5846 1 1 12 PRO HB3 H -8.253 -6.331 -1.795 1.00 . A A . 12 PRO HB3 1 1 10 5847 1 1 12 PRO HD2 H -6.875 -6.961 1.769 1.00 . A A . 12 PRO HD2 1 1 10 5848 1 1 12 PRO HD3 H -7.910 -7.926 0.698 1.00 . A A . 12 PRO HD3 1 1 10 5849 1 1 12 PRO HG2 H -7.463 -4.977 0.755 1.00 . A A . 12 PRO HG2 1 1 10 5850 1 1 12 PRO HG3 H -8.938 -5.888 0.382 1.00 . A A . 12 PRO HG3 1 1 10 5851 1 1 12 PRO N N -6.087 -7.293 -0.164 1.00 . A A . 12 PRO N 1 1 10 5852 1 1 12 PRO O O -4.684 -4.798 -2.338 1.00 . A A . 12 PRO O 1 1 10 5853 1 1 13 TYR C C -2.372 -4.550 0.839 1.00 . A A . 13 TYR C 1 1 10 5854 1 1 13 TYR CA C -3.563 -3.993 0.065 1.00 . A A . 13 TYR CA 1 1 10 5855 1 1 13 TYR CB C -4.129 -2.770 0.789 1.00 . A A . 13 TYR CB 1 1 10 5856 1 1 13 TYR CD1 C -5.871 -1.881 -0.809 1.00 . A A . 13 TYR CD1 1 1 10 5857 1 1 13 TYR CD2 C -6.603 -2.733 1.293 1.00 . A A . 13 TYR CD2 1 1 10 5858 1 1 13 TYR CE1 C -7.177 -1.591 -1.152 1.00 . A A . 13 TYR CE1 1 1 10 5859 1 1 13 TYR CE2 C -7.913 -2.448 0.958 1.00 . A A . 13 TYR CE2 1 1 10 5860 1 1 13 TYR CG C -5.561 -2.455 0.418 1.00 . A A . 13 TYR CG 1 1 10 5861 1 1 13 TYR CZ C -8.195 -1.877 -0.265 1.00 . A A . 13 TYR CZ 1 1 10 5862 1 1 13 TYR H H -4.950 -5.464 0.693 1.00 . A A . 13 TYR H 1 1 10 5863 1 1 13 TYR HA H -3.232 -3.695 -0.919 1.00 . A A . 13 TYR HA 1 1 10 5864 1 1 13 TYR HB2 H -4.094 -2.942 1.854 1.00 . A A . 13 TYR HB2 1 1 10 5865 1 1 13 TYR HB3 H -3.526 -1.907 0.549 1.00 . A A . 13 TYR HB3 1 1 10 5866 1 1 13 TYR HD1 H -5.072 -1.659 -1.501 1.00 . A A . 13 TYR HD1 1 1 10 5867 1 1 13 TYR HD2 H -6.380 -3.181 2.251 1.00 . A A . 13 TYR HD2 1 1 10 5868 1 1 13 TYR HE1 H -7.398 -1.144 -2.110 1.00 . A A . 13 TYR HE1 1 1 10 5869 1 1 13 TYR HE2 H -8.710 -2.671 1.652 1.00 . A A . 13 TYR HE2 1 1 10 5870 1 1 13 TYR HH H -9.798 -0.827 -0.104 1.00 . A A . 13 TYR HH 1 1 10 5871 1 1 13 TYR N N -4.598 -5.007 -0.100 1.00 . A A . 13 TYR N 1 1 10 5872 1 1 13 TYR O O -2.478 -4.857 2.025 1.00 . A A . 13 TYR O 1 1 10 5873 1 1 13 TYR OH O -9.498 -1.591 -0.604 1.00 . A A . 13 TYR OH 1 1 10 5874 1 1 14 GLU C C 1.208 -4.462 0.263 1.00 . A A . 14 GLU C 1 1 10 5875 1 1 14 GLU CA C -0.027 -5.196 0.779 1.00 . A A . 14 GLU CA 1 1 10 5876 1 1 14 GLU CB C 0.109 -6.696 0.508 1.00 . A A . 14 GLU CB 1 1 10 5877 1 1 14 GLU CD C 2.465 -7.223 -0.235 1.00 . A A . 14 GLU CD 1 1 10 5878 1 1 14 GLU CG C 1.462 -7.265 0.901 1.00 . A A . 14 GLU CG 1 1 10 5879 1 1 14 GLU H H -1.217 -4.414 -0.788 1.00 . A A . 14 GLU H 1 1 10 5880 1 1 14 GLU HA H -0.107 -5.038 1.843 1.00 . A A . 14 GLU HA 1 1 10 5881 1 1 14 GLU HB2 H -0.655 -7.220 1.064 1.00 . A A . 14 GLU HB2 1 1 10 5882 1 1 14 GLU HB3 H -0.040 -6.874 -0.547 1.00 . A A . 14 GLU HB3 1 1 10 5883 1 1 14 GLU HG2 H 1.853 -6.691 1.728 1.00 . A A . 14 GLU HG2 1 1 10 5884 1 1 14 GLU HG3 H 1.330 -8.293 1.208 1.00 . A A . 14 GLU HG3 1 1 10 5885 1 1 14 GLU N N -1.238 -4.676 0.156 1.00 . A A . 14 GLU N 1 1 10 5886 1 1 14 GLU O O 1.518 -4.504 -0.928 1.00 . A A . 14 GLU O 1 1 10 5887 1 1 14 GLU OE1 O 2.049 -6.964 -1.384 1.00 . A A . 14 GLU OE1 1 1 10 5888 1 1 14 GLU OE2 O 3.665 -7.451 0.023 1.00 . A A . 14 GLU OE2 1 1 10 5889 1 1 15 CYS C C 3.984 -3.850 -0.146 1.00 . A A . 15 CYS C 1 1 10 5890 1 1 15 CYS CA C 3.109 -3.043 0.808 1.00 . A A . 15 CYS CA 1 1 10 5891 1 1 15 CYS CB C 3.905 -2.678 2.063 1.00 . A A . 15 CYS CB 1 1 10 5892 1 1 15 CYS H H 1.612 -3.792 2.104 1.00 . A A . 15 CYS H 1 1 10 5893 1 1 15 CYS HA H 2.800 -2.135 0.313 1.00 . A A . 15 CYS HA 1 1 10 5894 1 1 15 CYS HB2 H 3.217 -2.501 2.877 1.00 . A A . 15 CYS HB2 1 1 10 5895 1 1 15 CYS HB3 H 4.554 -3.502 2.320 1.00 . A A . 15 CYS HB3 1 1 10 5896 1 1 15 CYS N N 1.909 -3.788 1.169 1.00 . A A . 15 CYS N 1 1 10 5897 1 1 15 CYS O O 3.790 -5.054 -0.315 1.00 . A A . 15 CYS O 1 1 10 5898 1 1 15 CYS SG S 4.941 -1.191 1.881 1.00 . A A . 15 CYS SG 1 1 10 5899 1 1 16 ASP C C 7.237 -4.015 -1.084 1.00 . A A . 16 ASP C 1 1 10 5900 1 1 16 ASP CA C 5.854 -3.833 -1.703 1.00 . A A . 16 ASP CA 1 1 10 5901 1 1 16 ASP CB C 5.963 -3.019 -2.994 1.00 . A A . 16 ASP CB 1 1 10 5902 1 1 16 ASP CG C 4.641 -2.919 -3.728 1.00 . A A . 16 ASP CG 1 1 10 5903 1 1 16 ASP H H 5.053 -2.220 -0.590 1.00 . A A . 16 ASP H 1 1 10 5904 1 1 16 ASP HA H 5.447 -4.805 -1.935 1.00 . A A . 16 ASP HA 1 1 10 5905 1 1 16 ASP HB2 H 6.298 -2.020 -2.755 1.00 . A A . 16 ASP HB2 1 1 10 5906 1 1 16 ASP HB3 H 6.683 -3.489 -3.648 1.00 . A A . 16 ASP HB3 1 1 10 5907 1 1 16 ASP N N 4.948 -3.179 -0.767 1.00 . A A . 16 ASP N 1 1 10 5908 1 1 16 ASP O O 7.924 -5.001 -1.352 1.00 . A A . 16 ASP O 1 1 10 5909 1 1 16 ASP OD1 O 3.990 -3.966 -3.923 1.00 . A A . 16 ASP OD1 1 1 10 5910 1 1 16 ASP OD2 O 4.256 -1.793 -4.108 1.00 . A A . 16 ASP OD2 1 1 10 5911 1 1 17 VAL C C 8.902 -4.028 1.619 1.00 . A A . 17 VAL C 1 1 10 5912 1 1 17 VAL CA C 8.940 -3.111 0.402 1.00 . A A . 17 VAL CA 1 1 10 5913 1 1 17 VAL CB C 9.404 -1.710 0.843 1.00 . A A . 17 VAL CB 1 1 10 5914 1 1 17 VAL CG1 C 10.752 -1.790 1.543 1.00 . A A . 17 VAL CG1 1 1 10 5915 1 1 17 VAL CG2 C 9.470 -0.770 -0.352 1.00 . A A . 17 VAL CG2 1 1 10 5916 1 1 17 VAL H H 7.047 -2.295 -0.081 1.00 . A A . 17 VAL H 1 1 10 5917 1 1 17 VAL HA H 9.656 -3.498 -0.307 1.00 . A A . 17 VAL HA 1 1 10 5918 1 1 17 VAL HB H 8.683 -1.317 1.544 1.00 . A A . 17 VAL HB 1 1 10 5919 1 1 17 VAL HG11 H 11.500 -2.138 0.845 1.00 . A A . 17 VAL HG11 1 1 10 5920 1 1 17 VAL HG12 H 11.027 -0.812 1.909 1.00 . A A . 17 VAL HG12 1 1 10 5921 1 1 17 VAL HG13 H 10.687 -2.480 2.372 1.00 . A A . 17 VAL HG13 1 1 10 5922 1 1 17 VAL HG21 H 10.446 -0.310 -0.395 1.00 . A A . 17 VAL HG21 1 1 10 5923 1 1 17 VAL HG22 H 9.293 -1.329 -1.258 1.00 . A A . 17 VAL HG22 1 1 10 5924 1 1 17 VAL HG23 H 8.715 -0.004 -0.249 1.00 . A A . 17 VAL HG23 1 1 10 5925 1 1 17 VAL N N 7.639 -3.056 -0.255 1.00 . A A . 17 VAL N 1 1 10 5926 1 1 17 VAL O O 9.596 -5.045 1.665 1.00 . A A . 17 VAL O 1 1 10 5927 1 1 18 CYS C C 6.933 -5.568 3.642 1.00 . A A . 18 CYS C 1 1 10 5928 1 1 18 CYS CA C 7.959 -4.453 3.822 1.00 . A A . 18 CYS CA 1 1 10 5929 1 1 18 CYS CB C 7.553 -3.557 4.995 1.00 . A A . 18 CYS CB 1 1 10 5930 1 1 18 CYS H H 7.560 -2.842 2.508 1.00 . A A . 18 CYS H 1 1 10 5931 1 1 18 CYS HA H 8.920 -4.895 4.035 1.00 . A A . 18 CYS HA 1 1 10 5932 1 1 18 CYS HB2 H 7.628 -4.122 5.912 1.00 . A A . 18 CYS HB2 1 1 10 5933 1 1 18 CYS HB3 H 8.226 -2.713 5.042 1.00 . A A . 18 CYS HB3 1 1 10 5934 1 1 18 CYS N N 8.088 -3.663 2.604 1.00 . A A . 18 CYS N 1 1 10 5935 1 1 18 CYS O O 6.942 -6.558 4.374 1.00 . A A . 18 CYS O 1 1 10 5936 1 1 18 CYS SG S 5.855 -2.908 4.882 1.00 . A A . 18 CYS SG 1 1 10 5937 1 1 19 ARG C C 4.083 -6.550 3.580 1.00 . A A . 19 ARG C 1 1 10 5938 1 1 19 ARG CA C 5.019 -6.392 2.385 1.00 . A A . 19 ARG CA 1 1 10 5939 1 1 19 ARG CB C 5.656 -7.740 2.040 1.00 . A A . 19 ARG CB 1 1 10 5940 1 1 19 ARG CD C 7.802 -7.254 0.827 1.00 . A A . 19 ARG CD 1 1 10 5941 1 1 19 ARG CG C 6.371 -7.750 0.699 1.00 . A A . 19 ARG CG 1 1 10 5942 1 1 19 ARG CZ C 10.027 -8.299 0.884 1.00 . A A . 19 ARG CZ 1 1 10 5943 1 1 19 ARG H H 6.096 -4.591 2.112 1.00 . A A . 19 ARG H 1 1 10 5944 1 1 19 ARG HA H 4.446 -6.047 1.537 1.00 . A A . 19 ARG HA 1 1 10 5945 1 1 19 ARG HB2 H 6.373 -7.993 2.807 1.00 . A A . 19 ARG HB2 1 1 10 5946 1 1 19 ARG HB3 H 4.883 -8.494 2.018 1.00 . A A . 19 ARG HB3 1 1 10 5947 1 1 19 ARG HD2 H 8.102 -6.814 -0.112 1.00 . A A . 19 ARG HD2 1 1 10 5948 1 1 19 ARG HD3 H 7.841 -6.505 1.604 1.00 . A A . 19 ARG HD3 1 1 10 5949 1 1 19 ARG HE H 8.362 -9.122 1.612 1.00 . A A . 19 ARG HE 1 1 10 5950 1 1 19 ARG HG2 H 6.384 -8.760 0.317 1.00 . A A . 19 ARG HG2 1 1 10 5951 1 1 19 ARG HG3 H 5.837 -7.111 0.012 1.00 . A A . 19 ARG HG3 1 1 10 5952 1 1 19 ARG HH11 H 9.967 -6.474 0.021 1.00 . A A . 19 ARG HH11 1 1 10 5953 1 1 19 ARG HH12 H 11.529 -7.222 0.068 1.00 . A A . 19 ARG HH12 1 1 10 5954 1 1 19 ARG HH21 H 10.414 -10.117 1.681 1.00 . A A . 19 ARG HH21 1 1 10 5955 1 1 19 ARG HH22 H 11.782 -9.294 1.012 1.00 . A A . 19 ARG HH22 1 1 10 5956 1 1 19 ARG N N 6.052 -5.401 2.662 1.00 . A A . 19 ARG N 1 1 10 5957 1 1 19 ARG NE N 8.728 -8.333 1.161 1.00 . A A . 19 ARG NE 1 1 10 5958 1 1 19 ARG NH1 N 10.551 -7.245 0.274 1.00 . A A . 19 ARG NH1 1 1 10 5959 1 1 19 ARG NH2 N 10.805 -9.320 1.220 1.00 . A A . 19 ARG NH2 1 1 10 5960 1 1 19 ARG O O 3.752 -7.667 3.979 1.00 . A A . 19 ARG O 1 1 10 5961 1 1 20 LYS C C 1.307 -5.362 4.848 1.00 . A A . 20 LYS C 1 1 10 5962 1 1 20 LYS CA C 2.763 -5.437 5.296 1.00 . A A . 20 LYS CA 1 1 10 5963 1 1 20 LYS CB C 3.082 -4.269 6.231 1.00 . A A . 20 LYS CB 1 1 10 5964 1 1 20 LYS CD C 2.785 -3.209 8.489 1.00 . A A . 20 LYS CD 1 1 10 5965 1 1 20 LYS CE C 2.004 -3.244 9.794 1.00 . A A . 20 LYS CE 1 1 10 5966 1 1 20 LYS CG C 2.435 -4.391 7.600 1.00 . A A . 20 LYS CG 1 1 10 5967 1 1 20 LYS H H 3.960 -4.565 3.783 1.00 . A A . 20 LYS H 1 1 10 5968 1 1 20 LYS HA H 2.916 -6.364 5.827 1.00 . A A . 20 LYS HA 1 1 10 5969 1 1 20 LYS HB2 H 4.152 -4.212 6.364 1.00 . A A . 20 LYS HB2 1 1 10 5970 1 1 20 LYS HB3 H 2.736 -3.353 5.773 1.00 . A A . 20 LYS HB3 1 1 10 5971 1 1 20 LYS HD2 H 3.841 -3.239 8.714 1.00 . A A . 20 LYS HD2 1 1 10 5972 1 1 20 LYS HD3 H 2.552 -2.294 7.964 1.00 . A A . 20 LYS HD3 1 1 10 5973 1 1 20 LYS HE2 H 1.049 -3.713 9.614 1.00 . A A . 20 LYS HE2 1 1 10 5974 1 1 20 LYS HE3 H 2.560 -3.824 10.515 1.00 . A A . 20 LYS HE3 1 1 10 5975 1 1 20 LYS HG2 H 1.363 -4.432 7.479 1.00 . A A . 20 LYS HG2 1 1 10 5976 1 1 20 LYS HG3 H 2.782 -5.300 8.071 1.00 . A A . 20 LYS HG3 1 1 10 5977 1 1 20 LYS HZ1 H 1.464 -1.237 9.584 1.00 . A A . 20 LYS HZ1 1 1 10 5978 1 1 20 LYS HZ2 H 2.659 -1.507 10.751 1.00 . A A . 20 LYS HZ2 1 1 10 5979 1 1 20 LYS HZ3 H 1.049 -1.905 11.081 1.00 . A A . 20 LYS HZ3 1 1 10 5980 1 1 20 LYS N N 3.661 -5.426 4.147 1.00 . A A . 20 LYS N 1 1 10 5981 1 1 20 LYS NZ N 1.778 -1.877 10.341 1.00 . A A . 20 LYS NZ 1 1 10 5982 1 1 20 LYS O O 1.008 -4.892 3.751 1.00 . A A . 20 LYS O 1 1 10 5983 1 1 21 ALA C C -1.724 -4.668 6.131 1.00 . A A . 21 ALA C 1 1 10 5984 1 1 21 ALA CA C -1.021 -5.807 5.401 1.00 . A A . 21 ALA CA 1 1 10 5985 1 1 21 ALA CB C -1.656 -7.141 5.764 1.00 . A A . 21 ALA CB 1 1 10 5986 1 1 21 ALA H H 0.704 -6.188 6.566 1.00 . A A . 21 ALA H 1 1 10 5987 1 1 21 ALA HA H -1.132 -5.662 4.335 1.00 . A A . 21 ALA HA 1 1 10 5988 1 1 21 ALA HB1 H -2.346 -7.434 4.986 1.00 . A A . 21 ALA HB1 1 1 10 5989 1 1 21 ALA HB2 H -0.885 -7.891 5.863 1.00 . A A . 21 ALA HB2 1 1 10 5990 1 1 21 ALA HB3 H -2.187 -7.044 6.699 1.00 . A A . 21 ALA HB3 1 1 10 5991 1 1 21 ALA N N 0.404 -5.826 5.706 1.00 . A A . 21 ALA N 1 1 10 5992 1 1 21 ALA O O -1.378 -4.336 7.264 1.00 . A A . 21 ALA O 1 1 10 5993 1 1 22 PHE C C -4.966 -3.177 5.884 1.00 . A A . 22 PHE C 1 1 10 5994 1 1 22 PHE CA C -3.464 -2.968 6.060 1.00 . A A . 22 PHE CA 1 1 10 5995 1 1 22 PHE CB C -3.045 -1.642 5.422 1.00 . A A . 22 PHE CB 1 1 10 5996 1 1 22 PHE CD1 C -0.635 -2.007 4.824 1.00 . A A . 22 PHE CD1 1 1 10 5997 1 1 22 PHE CD2 C -1.156 -0.379 6.486 1.00 . A A . 22 PHE CD2 1 1 10 5998 1 1 22 PHE CE1 C 0.711 -1.729 4.967 1.00 . A A . 22 PHE CE1 1 1 10 5999 1 1 22 PHE CE2 C 0.189 -0.096 6.633 1.00 . A A . 22 PHE CE2 1 1 10 6000 1 1 22 PHE CG C -1.583 -1.336 5.580 1.00 . A A . 22 PHE CG 1 1 10 6001 1 1 22 PHE CZ C 1.124 -0.772 5.873 1.00 . A A . 22 PHE CZ 1 1 10 6002 1 1 22 PHE H H -2.943 -4.381 4.572 1.00 . A A . 22 PHE H 1 1 10 6003 1 1 22 PHE HA H -3.239 -2.937 7.114 1.00 . A A . 22 PHE HA 1 1 10 6004 1 1 22 PHE HB2 H -3.264 -1.673 4.365 1.00 . A A . 22 PHE HB2 1 1 10 6005 1 1 22 PHE HB3 H -3.604 -0.838 5.877 1.00 . A A . 22 PHE HB3 1 1 10 6006 1 1 22 PHE HD1 H -0.958 -2.756 4.114 1.00 . A A . 22 PHE HD1 1 1 10 6007 1 1 22 PHE HD2 H -1.885 0.150 7.082 1.00 . A A . 22 PHE HD2 1 1 10 6008 1 1 22 PHE HE1 H 1.439 -2.260 4.371 1.00 . A A . 22 PHE HE1 1 1 10 6009 1 1 22 PHE HE2 H 0.509 0.652 7.343 1.00 . A A . 22 PHE HE2 1 1 10 6010 1 1 22 PHE HZ H 2.175 -0.552 5.986 1.00 . A A . 22 PHE HZ 1 1 10 6011 1 1 22 PHE N N -2.713 -4.071 5.473 1.00 . A A . 22 PHE N 1 1 10 6012 1 1 22 PHE O O -5.402 -3.902 4.989 1.00 . A A . 22 PHE O 1 1 10 6013 1 1 23 SER C C -7.780 -1.760 5.595 1.00 . A A . 23 SER C 1 1 10 6014 1 1 23 SER CA C -7.203 -2.656 6.687 1.00 . A A . 23 SER CA 1 1 10 6015 1 1 23 SER CB C -7.819 -2.292 8.040 1.00 . A A . 23 SER CB 1 1 10 6016 1 1 23 SER H H -5.344 -1.974 7.435 1.00 . A A . 23 SER H 1 1 10 6017 1 1 23 SER HA H -7.443 -3.683 6.458 1.00 . A A . 23 SER HA 1 1 10 6018 1 1 23 SER HB2 H -7.198 -1.558 8.529 1.00 . A A . 23 SER HB2 1 1 10 6019 1 1 23 SER HB3 H -8.806 -1.881 7.883 1.00 . A A . 23 SER HB3 1 1 10 6020 1 1 23 SER HG H -8.735 -3.905 8.669 1.00 . A A . 23 SER HG 1 1 10 6021 1 1 23 SER N N -5.751 -2.537 6.744 1.00 . A A . 23 SER N 1 1 10 6022 1 1 23 SER O O -8.625 -2.186 4.808 1.00 . A A . 23 SER O 1 1 10 6023 1 1 23 SER OG O -7.926 -3.431 8.875 1.00 . A A . 23 SER OG 1 1 10 6024 1 1 24 HIS C C -6.688 0.749 3.541 1.00 . A A . 24 HIS C 1 1 10 6025 1 1 24 HIS CA C -7.783 0.443 4.558 1.00 . A A . 24 HIS CA 1 1 10 6026 1 1 24 HIS CB C -8.240 1.734 5.237 1.00 . A A . 24 HIS CB 1 1 10 6027 1 1 24 HIS CD2 C -7.380 1.325 7.650 1.00 . A A . 24 HIS CD2 1 1 10 6028 1 1 24 HIS CE1 C -6.245 3.183 7.905 1.00 . A A . 24 HIS CE1 1 1 10 6029 1 1 24 HIS CG C -7.503 2.037 6.505 1.00 . A A . 24 HIS CG 1 1 10 6030 1 1 24 HIS H H -6.642 -0.234 6.208 1.00 . A A . 24 HIS H 1 1 10 6031 1 1 24 HIS HA H -8.623 0.001 4.042 1.00 . A A . 24 HIS HA 1 1 10 6032 1 1 24 HIS HB2 H -8.089 2.562 4.560 1.00 . A A . 24 HIS HB2 1 1 10 6033 1 1 24 HIS HB3 H -9.292 1.656 5.474 1.00 . A A . 24 HIS HB3 1 1 10 6034 1 1 24 HIS HD1 H -6.677 3.920 6.046 1.00 . A A . 24 HIS HD1 1 1 10 6035 1 1 24 HIS HD2 H -7.819 0.358 7.854 1.00 . A A . 24 HIS HD2 1 1 10 6036 1 1 24 HIS HE1 H -5.628 3.959 8.331 1.00 . A A . 24 HIS HE1 1 1 10 6037 1 1 24 HIS N N -7.315 -0.515 5.554 1.00 . A A . 24 HIS N 1 1 10 6038 1 1 24 HIS ND1 N -6.782 3.196 6.698 1.00 . A A . 24 HIS ND1 1 1 10 6039 1 1 24 HIS NE2 N -6.594 2.058 8.503 1.00 . A A . 24 HIS NE2 1 1 10 6040 1 1 24 HIS O O -5.514 0.869 3.895 1.00 . A A . 24 HIS O 1 1 10 6041 1 1 25 HIS C C -5.229 2.337 1.587 1.00 . A A . 25 HIS C 1 1 10 6042 1 1 25 HIS CA C -6.129 1.164 1.209 1.00 . A A . 25 HIS CA 1 1 10 6043 1 1 25 HIS CB C -6.871 1.474 -0.092 1.00 . A A . 25 HIS CB 1 1 10 6044 1 1 25 HIS CD2 C -5.548 1.074 -2.286 1.00 . A A . 25 HIS CD2 1 1 10 6045 1 1 25 HIS CE1 C -4.628 3.056 -2.472 1.00 . A A . 25 HIS CE1 1 1 10 6046 1 1 25 HIS CG C -5.963 1.815 -1.233 1.00 . A A . 25 HIS CG 1 1 10 6047 1 1 25 HIS H H -8.027 0.765 2.057 1.00 . A A . 25 HIS H 1 1 10 6048 1 1 25 HIS HA H -5.515 0.288 1.062 1.00 . A A . 25 HIS HA 1 1 10 6049 1 1 25 HIS HB2 H -7.455 0.612 -0.379 1.00 . A A . 25 HIS HB2 1 1 10 6050 1 1 25 HIS HB3 H -7.533 2.313 0.070 1.00 . A A . 25 HIS HB3 1 1 10 6051 1 1 25 HIS HD1 H -5.475 3.812 -0.770 1.00 . A A . 25 HIS HD1 1 1 10 6052 1 1 25 HIS HD2 H -5.818 0.048 -2.495 1.00 . A A . 25 HIS HD2 1 1 10 6053 1 1 25 HIS HE1 H -4.047 3.888 -2.838 1.00 . A A . 25 HIS HE1 1 1 10 6054 1 1 25 HIS N N -7.078 0.872 2.277 1.00 . A A . 25 HIS N 1 1 10 6055 1 1 25 HIS ND1 N -5.369 3.051 -1.378 1.00 . A A . 25 HIS ND1 1 1 10 6056 1 1 25 HIS NE2 N -4.719 1.867 -3.041 1.00 . A A . 25 HIS NE2 1 1 10 6057 1 1 25 HIS O O -4.005 2.245 1.503 1.00 . A A . 25 HIS O 1 1 10 6058 1 1 26 ALA C C -3.913 4.267 3.279 1.00 . A A . 26 ALA C 1 1 10 6059 1 1 26 ALA CA C -5.100 4.629 2.393 1.00 . A A . 26 ALA CA 1 1 10 6060 1 1 26 ALA CB C -6.015 5.612 3.109 1.00 . A A . 26 ALA CB 1 1 10 6061 1 1 26 ALA H H -6.824 3.451 2.046 1.00 . A A . 26 ALA H 1 1 10 6062 1 1 26 ALA HA H -4.734 5.105 1.494 1.00 . A A . 26 ALA HA 1 1 10 6063 1 1 26 ALA HB1 H -5.469 6.096 3.905 1.00 . A A . 26 ALA HB1 1 1 10 6064 1 1 26 ALA HB2 H -6.363 6.356 2.407 1.00 . A A . 26 ALA HB2 1 1 10 6065 1 1 26 ALA HB3 H -6.860 5.082 3.522 1.00 . A A . 26 ALA HB3 1 1 10 6066 1 1 26 ALA N N -5.845 3.439 2.001 1.00 . A A . 26 ALA N 1 1 10 6067 1 1 26 ALA O O -2.766 4.567 2.949 1.00 . A A . 26 ALA O 1 1 10 6068 1 1 27 SER C C -1.905 2.754 4.596 1.00 . A A . 27 SER C 1 1 10 6069 1 1 27 SER CA C -3.151 3.221 5.341 1.00 . A A . 27 SER CA 1 1 10 6070 1 1 27 SER CB C -3.658 2.108 6.259 1.00 . A A . 27 SER CB 1 1 10 6071 1 1 27 SER H H -5.131 3.409 4.613 1.00 . A A . 27 SER H 1 1 10 6072 1 1 27 SER HA H -2.896 4.083 5.940 1.00 . A A . 27 SER HA 1 1 10 6073 1 1 27 SER HB2 H -4.722 2.219 6.403 1.00 . A A . 27 SER HB2 1 1 10 6074 1 1 27 SER HB3 H -3.455 1.149 5.804 1.00 . A A . 27 SER HB3 1 1 10 6075 1 1 27 SER HG H -2.181 2.620 7.440 1.00 . A A . 27 SER HG 1 1 10 6076 1 1 27 SER N N -4.196 3.620 4.405 1.00 . A A . 27 SER N 1 1 10 6077 1 1 27 SER O O -0.789 2.842 5.111 1.00 . A A . 27 SER O 1 1 10 6078 1 1 27 SER OG O -3.019 2.159 7.523 1.00 . A A . 27 SER OG 1 1 10 6079 1 1 28 LEU C C -0.304 2.929 1.845 1.00 . A A . 28 LEU C 1 1 10 6080 1 1 28 LEU CA C -0.994 1.773 2.562 1.00 . A A . 28 LEU CA 1 1 10 6081 1 1 28 LEU CB C -1.497 0.751 1.541 1.00 . A A . 28 LEU CB 1 1 10 6082 1 1 28 LEU CD1 C 0.373 -0.914 1.661 1.00 . A A . 28 LEU CD1 1 1 10 6083 1 1 28 LEU CD2 C -1.045 -0.776 -0.395 1.00 . A A . 28 LEU CD2 1 1 10 6084 1 1 28 LEU CG C -0.420 0.009 0.749 1.00 . A A . 28 LEU CG 1 1 10 6085 1 1 28 LEU H H -3.013 2.211 3.023 1.00 . A A . 28 LEU H 1 1 10 6086 1 1 28 LEU HA H -0.282 1.295 3.218 1.00 . A A . 28 LEU HA 1 1 10 6087 1 1 28 LEU HB2 H -2.083 0.016 2.070 1.00 . A A . 28 LEU HB2 1 1 10 6088 1 1 28 LEU HB3 H -2.128 1.273 0.835 1.00 . A A . 28 LEU HB3 1 1 10 6089 1 1 28 LEU HD11 H -0.072 -1.897 1.653 1.00 . A A . 28 LEU HD11 1 1 10 6090 1 1 28 LEU HD12 H 0.362 -0.522 2.667 1.00 . A A . 28 LEU HD12 1 1 10 6091 1 1 28 LEU HD13 H 1.393 -0.977 1.311 1.00 . A A . 28 LEU HD13 1 1 10 6092 1 1 28 LEU HD21 H -1.689 -0.127 -0.968 1.00 . A A . 28 LEU HD21 1 1 10 6093 1 1 28 LEU HD22 H -1.623 -1.596 0.006 1.00 . A A . 28 LEU HD22 1 1 10 6094 1 1 28 LEU HD23 H -0.264 -1.165 -1.034 1.00 . A A . 28 LEU HD23 1 1 10 6095 1 1 28 LEU HG H 0.267 0.729 0.325 1.00 . A A . 28 LEU HG 1 1 10 6096 1 1 28 LEU N N -2.102 2.256 3.380 1.00 . A A . 28 LEU N 1 1 10 6097 1 1 28 LEU O O 0.895 3.154 2.017 1.00 . A A . 28 LEU O 1 1 10 6098 1 1 29 THR C C 0.201 5.760 1.222 1.00 . A A . 29 THR C 1 1 10 6099 1 1 29 THR CA C -0.531 4.794 0.297 1.00 . A A . 29 THR CA 1 1 10 6100 1 1 29 THR CB C -1.643 5.556 -0.447 1.00 . A A . 29 THR CB 1 1 10 6101 1 1 29 THR CG2 C -2.378 6.497 0.496 1.00 . A A . 29 THR CG2 1 1 10 6102 1 1 29 THR H H -2.016 3.432 0.944 1.00 . A A . 29 THR H 1 1 10 6103 1 1 29 THR HA H 0.167 4.412 -0.434 1.00 . A A . 29 THR HA 1 1 10 6104 1 1 29 THR HB H -2.350 4.839 -0.839 1.00 . A A . 29 THR HB 1 1 10 6105 1 1 29 THR HG1 H -0.206 6.610 -1.292 1.00 . A A . 29 THR HG1 1 1 10 6106 1 1 29 THR HG21 H -1.665 7.135 0.995 1.00 . A A . 29 THR HG21 1 1 10 6107 1 1 29 THR HG22 H -2.921 5.920 1.230 1.00 . A A . 29 THR HG22 1 1 10 6108 1 1 29 THR HG23 H -3.070 7.104 -0.069 1.00 . A A . 29 THR HG23 1 1 10 6109 1 1 29 THR N N -1.068 3.661 1.040 1.00 . A A . 29 THR N 1 1 10 6110 1 1 29 THR O O 1.136 6.443 0.805 1.00 . A A . 29 THR O 1 1 10 6111 1 1 29 THR OG1 O -1.083 6.302 -1.533 1.00 . A A . 29 THR OG1 1 1 10 6112 1 1 30 GLN C C 1.682 6.097 3.994 1.00 . A A . 30 GLN C 1 1 10 6113 1 1 30 GLN CA C 0.384 6.696 3.461 1.00 . A A . 30 GLN CA 1 1 10 6114 1 1 30 GLN CB C -0.582 6.959 4.617 1.00 . A A . 30 GLN CB 1 1 10 6115 1 1 30 GLN CD C -2.571 8.281 5.440 1.00 . A A . 30 GLN CD 1 1 10 6116 1 1 30 GLN CG C -1.475 8.170 4.400 1.00 . A A . 30 GLN CG 1 1 10 6117 1 1 30 GLN H H -0.981 5.243 2.749 1.00 . A A . 30 GLN H 1 1 10 6118 1 1 30 GLN HA H 0.609 7.631 2.971 1.00 . A A . 30 GLN HA 1 1 10 6119 1 1 30 GLN HB2 H -1.213 6.092 4.747 1.00 . A A . 30 GLN HB2 1 1 10 6120 1 1 30 GLN HB3 H -0.010 7.118 5.519 1.00 . A A . 30 GLN HB3 1 1 10 6121 1 1 30 GLN HE21 H -2.745 10.230 5.086 1.00 . A A . 30 GLN HE21 1 1 10 6122 1 1 30 GLN HE22 H -3.803 9.589 6.291 1.00 . A A . 30 GLN HE22 1 1 10 6123 1 1 30 GLN HG2 H -0.867 9.062 4.444 1.00 . A A . 30 GLN HG2 1 1 10 6124 1 1 30 GLN HG3 H -1.930 8.095 3.423 1.00 . A A . 30 GLN HG3 1 1 10 6125 1 1 30 GLN N N -0.231 5.812 2.478 1.00 . A A . 30 GLN N 1 1 10 6126 1 1 30 GLN NE2 N -3.092 9.488 5.625 1.00 . A A . 30 GLN NE2 1 1 10 6127 1 1 30 GLN O O 2.752 6.694 3.865 1.00 . A A . 30 GLN O 1 1 10 6128 1 1 30 GLN OE1 O -2.947 7.292 6.071 1.00 . A A . 30 GLN OE1 1 1 10 6129 1 1 31 HIS C C 3.846 4.102 4.096 1.00 . A A . 31 HIS C 1 1 10 6130 1 1 31 HIS CA C 2.747 4.236 5.146 1.00 . A A . 31 HIS CA 1 1 10 6131 1 1 31 HIS CB C 2.357 2.854 5.672 1.00 . A A . 31 HIS CB 1 1 10 6132 1 1 31 HIS CD2 C 3.785 0.885 4.772 1.00 . A A . 31 HIS CD2 1 1 10 6133 1 1 31 HIS CE1 C 5.311 0.850 6.346 1.00 . A A . 31 HIS CE1 1 1 10 6134 1 1 31 HIS CG C 3.483 1.866 5.654 1.00 . A A . 31 HIS CG 1 1 10 6135 1 1 31 HIS H H 0.701 4.490 4.665 1.00 . A A . 31 HIS H 1 1 10 6136 1 1 31 HIS HA H 3.120 4.831 5.965 1.00 . A A . 31 HIS HA 1 1 10 6137 1 1 31 HIS HB2 H 2.015 2.948 6.692 1.00 . A A . 31 HIS HB2 1 1 10 6138 1 1 31 HIS HB3 H 1.557 2.457 5.064 1.00 . A A . 31 HIS HB3 1 1 10 6139 1 1 31 HIS HD1 H 4.514 2.406 7.410 1.00 . A A . 31 HIS HD1 1 1 10 6140 1 1 31 HIS HD2 H 3.233 0.633 3.877 1.00 . A A . 31 HIS HD2 1 1 10 6141 1 1 31 HIS HE1 H 6.177 0.580 6.932 1.00 . A A . 31 HIS HE1 1 1 10 6142 1 1 31 HIS N N 1.581 4.915 4.593 1.00 . A A . 31 HIS N 1 1 10 6143 1 1 31 HIS ND1 N 4.457 1.818 6.628 1.00 . A A . 31 HIS ND1 1 1 10 6144 1 1 31 HIS NE2 N 4.926 0.268 5.225 1.00 . A A . 31 HIS NE2 1 1 10 6145 1 1 31 HIS O O 5.007 4.416 4.357 1.00 . A A . 31 HIS O 1 1 10 6146 1 1 32 GLN C C 5.499 4.540 1.859 1.00 . A A . 32 GLN C 1 1 10 6147 1 1 32 GLN CA C 4.426 3.457 1.822 1.00 . A A . 32 GLN CA 1 1 10 6148 1 1 32 GLN CB C 3.704 3.482 0.473 1.00 . A A . 32 GLN CB 1 1 10 6149 1 1 32 GLN CD C 2.567 2.134 -1.336 1.00 . A A . 32 GLN CD 1 1 10 6150 1 1 32 GLN CG C 3.091 2.146 0.087 1.00 . A A . 32 GLN CG 1 1 10 6151 1 1 32 GLN H H 2.531 3.400 2.764 1.00 . A A . 32 GLN H 1 1 10 6152 1 1 32 GLN HA H 4.899 2.495 1.949 1.00 . A A . 32 GLN HA 1 1 10 6153 1 1 32 GLN HB2 H 2.916 4.218 0.514 1.00 . A A . 32 GLN HB2 1 1 10 6154 1 1 32 GLN HB3 H 4.411 3.764 -0.294 1.00 . A A . 32 GLN HB3 1 1 10 6155 1 1 32 GLN HE21 H 2.456 0.149 -1.304 1.00 . A A . 32 GLN HE21 1 1 10 6156 1 1 32 GLN HE22 H 1.962 0.905 -2.776 1.00 . A A . 32 GLN HE22 1 1 10 6157 1 1 32 GLN HG2 H 3.843 1.377 0.184 1.00 . A A . 32 GLN HG2 1 1 10 6158 1 1 32 GLN HG3 H 2.272 1.933 0.758 1.00 . A A . 32 GLN HG3 1 1 10 6159 1 1 32 GLN N N 3.471 3.633 2.910 1.00 . A A . 32 GLN N 1 1 10 6160 1 1 32 GLN NE2 N 2.302 0.942 -1.859 1.00 . A A . 32 GLN NE2 1 1 10 6161 1 1 32 GLN O O 6.656 4.293 1.518 1.00 . A A . 32 GLN O 1 1 10 6162 1 1 32 GLN OE1 O 2.403 3.183 -1.958 1.00 . A A . 32 GLN OE1 1 1 10 6163 1 1 33 ARG C C 7.380 6.416 2.918 1.00 . A A . 33 ARG C 1 1 10 6164 1 1 33 ARG CA C 6.035 6.862 2.352 1.00 . A A . 33 ARG CA 1 1 10 6165 1 1 33 ARG CB C 5.448 7.977 3.220 1.00 . A A . 33 ARG CB 1 1 10 6166 1 1 33 ARG CD C 4.368 10.246 3.188 1.00 . A A . 33 ARG CD 1 1 10 6167 1 1 33 ARG CG C 4.529 8.920 2.461 1.00 . A A . 33 ARG CG 1 1 10 6168 1 1 33 ARG CZ C 5.251 12.000 1.709 1.00 . A A . 33 ARG CZ 1 1 10 6169 1 1 33 ARG H H 4.171 5.876 2.531 1.00 . A A . 33 ARG H 1 1 10 6170 1 1 33 ARG HA H 6.186 7.239 1.352 1.00 . A A . 33 ARG HA 1 1 10 6171 1 1 33 ARG HB2 H 4.884 7.531 4.026 1.00 . A A . 33 ARG HB2 1 1 10 6172 1 1 33 ARG HB3 H 6.258 8.556 3.636 1.00 . A A . 33 ARG HB3 1 1 10 6173 1 1 33 ARG HD2 H 3.388 10.643 2.972 1.00 . A A . 33 ARG HD2 1 1 10 6174 1 1 33 ARG HD3 H 4.460 10.072 4.250 1.00 . A A . 33 ARG HD3 1 1 10 6175 1 1 33 ARG HE H 6.184 11.296 3.326 1.00 . A A . 33 ARG HE 1 1 10 6176 1 1 33 ARG HG2 H 4.947 9.106 1.483 1.00 . A A . 33 ARG HG2 1 1 10 6177 1 1 33 ARG HG3 H 3.559 8.456 2.358 1.00 . A A . 33 ARG HG3 1 1 10 6178 1 1 33 ARG HH11 H 3.443 11.271 1.178 1.00 . A A . 33 ARG HH11 1 1 10 6179 1 1 33 ARG HH12 H 4.077 12.508 0.144 1.00 . A A . 33 ARG HH12 1 1 10 6180 1 1 33 ARG HH21 H 7.029 12.926 1.971 1.00 . A A . 33 ARG HH21 1 1 10 6181 1 1 33 ARG HH22 H 6.117 13.448 0.596 1.00 . A A . 33 ARG HH22 1 1 10 6182 1 1 33 ARG N N 5.107 5.740 2.273 1.00 . A A . 33 ARG N 1 1 10 6183 1 1 33 ARG NE N 5.375 11.220 2.777 1.00 . A A . 33 ARG NE 1 1 10 6184 1 1 33 ARG NH1 N 4.169 11.919 0.948 1.00 . A A . 33 ARG NH1 1 1 10 6185 1 1 33 ARG NH2 N 6.211 12.862 1.400 1.00 . A A . 33 ARG NH2 1 1 10 6186 1 1 33 ARG O O 8.432 6.712 2.353 1.00 . A A . 33 ARG O 1 1 10 6187 1 1 34 VAL C C 9.548 4.695 3.652 1.00 . A A . 34 VAL C 1 1 10 6188 1 1 34 VAL CA C 8.551 5.215 4.682 1.00 . A A . 34 VAL CA 1 1 10 6189 1 1 34 VAL CB C 8.240 4.093 5.691 1.00 . A A . 34 VAL CB 1 1 10 6190 1 1 34 VAL CG1 C 7.257 4.580 6.745 1.00 . A A . 34 VAL CG1 1 1 10 6191 1 1 34 VAL CG2 C 7.701 2.866 4.973 1.00 . A A . 34 VAL CG2 1 1 10 6192 1 1 34 VAL H H 6.467 5.498 4.443 1.00 . A A . 34 VAL H 1 1 10 6193 1 1 34 VAL HA H 8.999 6.039 5.218 1.00 . A A . 34 VAL HA 1 1 10 6194 1 1 34 VAL HB H 9.159 3.819 6.188 1.00 . A A . 34 VAL HB 1 1 10 6195 1 1 34 VAL HG11 H 6.328 4.856 6.269 1.00 . A A . 34 VAL HG11 1 1 10 6196 1 1 34 VAL HG12 H 7.077 3.792 7.461 1.00 . A A . 34 VAL HG12 1 1 10 6197 1 1 34 VAL HG13 H 7.670 5.440 7.252 1.00 . A A . 34 VAL HG13 1 1 10 6198 1 1 34 VAL HG21 H 8.425 2.524 4.250 1.00 . A A . 34 VAL HG21 1 1 10 6199 1 1 34 VAL HG22 H 7.512 2.083 5.692 1.00 . A A . 34 VAL HG22 1 1 10 6200 1 1 34 VAL HG23 H 6.780 3.119 4.467 1.00 . A A . 34 VAL HG23 1 1 10 6201 1 1 34 VAL N N 7.337 5.702 4.039 1.00 . A A . 34 VAL N 1 1 10 6202 1 1 34 VAL O O 10.751 4.929 3.763 1.00 . A A . 34 VAL O 1 1 10 6203 1 1 35 HIS C C 10.069 4.441 0.463 1.00 . A A . 35 HIS C 1 1 10 6204 1 1 35 HIS CA C 9.884 3.436 1.596 1.00 . A A . 35 HIS CA 1 1 10 6205 1 1 35 HIS CB C 9.276 2.142 1.051 1.00 . A A . 35 HIS CB 1 1 10 6206 1 1 35 HIS CD2 C 7.555 0.747 2.399 1.00 . A A . 35 HIS CD2 1 1 10 6207 1 1 35 HIS CE1 C 8.930 -0.131 3.863 1.00 . A A . 35 HIS CE1 1 1 10 6208 1 1 35 HIS CG C 8.796 1.210 2.120 1.00 . A A . 35 HIS CG 1 1 10 6209 1 1 35 HIS H H 8.071 3.835 2.614 1.00 . A A . 35 HIS H 1 1 10 6210 1 1 35 HIS HA H 10.849 3.216 2.027 1.00 . A A . 35 HIS HA 1 1 10 6211 1 1 35 HIS HB2 H 8.434 2.386 0.421 1.00 . A A . 35 HIS HB2 1 1 10 6212 1 1 35 HIS HB3 H 10.020 1.622 0.465 1.00 . A A . 35 HIS HB3 1 1 10 6213 1 1 35 HIS HD1 H 10.602 0.783 3.118 1.00 . A A . 35 HIS HD1 1 1 10 6214 1 1 35 HIS HD2 H 6.646 0.986 1.865 1.00 . A A . 35 HIS HD2 1 1 10 6215 1 1 35 HIS HE1 H 9.321 -0.703 4.691 1.00 . A A . 35 HIS HE1 1 1 10 6216 1 1 35 HIS N N 9.038 3.988 2.648 1.00 . A A . 35 HIS N 1 1 10 6217 1 1 35 HIS ND1 N 9.634 0.642 3.056 1.00 . A A . 35 HIS ND1 1 1 10 6218 1 1 35 HIS NE2 N 7.665 -0.084 3.486 1.00 . A A . 35 HIS NE2 1 1 10 6219 1 1 35 HIS O O 10.019 4.082 -0.713 1.00 . A A . 35 HIS O 1 1 10 6220 1 1 36 SER C C 11.791 7.489 0.073 1.00 . A A . 36 SER C 1 1 10 6221 1 1 36 SER CA C 10.471 6.760 -0.159 1.00 . A A . 36 SER CA 1 1 10 6222 1 1 36 SER CB C 9.309 7.754 -0.099 1.00 . A A . 36 SER CB 1 1 10 6223 1 1 36 SER H H 10.311 5.926 1.781 1.00 . A A . 36 SER H 1 1 10 6224 1 1 36 SER HA H 10.492 6.302 -1.136 1.00 . A A . 36 SER HA 1 1 10 6225 1 1 36 SER HB2 H 9.274 8.206 0.880 1.00 . A A . 36 SER HB2 1 1 10 6226 1 1 36 SER HB3 H 9.457 8.521 -0.845 1.00 . A A . 36 SER HB3 1 1 10 6227 1 1 36 SER HG H 7.368 7.760 -0.369 1.00 . A A . 36 SER HG 1 1 10 6228 1 1 36 SER N N 10.282 5.702 0.827 1.00 . A A . 36 SER N 1 1 10 6229 1 1 36 SER O O 12.037 8.023 1.153 1.00 . A A . 36 SER O 1 1 10 6230 1 1 36 SER OG O 8.072 7.108 -0.348 1.00 . A A . 36 SER OG 1 1 10 6231 1 1 37 GLY C C 14.903 7.401 0.019 1.00 . A A . 37 GLY C 1 1 10 6232 1 1 37 GLY CA C 13.922 8.173 -0.842 1.00 . A A . 37 GLY CA 1 1 10 6233 1 1 37 GLY H H 12.387 7.064 -1.791 1.00 . A A . 37 GLY H 1 1 10 6234 1 1 37 GLY HA2 H 14.341 8.290 -1.830 1.00 . A A . 37 GLY HA2 1 1 10 6235 1 1 37 GLY HA3 H 13.772 9.150 -0.407 1.00 . A A . 37 GLY HA3 1 1 10 6236 1 1 37 GLY N N 12.637 7.507 -0.952 1.00 . A A . 37 GLY N 1 1 10 6237 1 1 37 GLY O O 15.010 6.180 -0.095 1.00 . A A . 37 GLY O 1 1 10 6238 1 1 38 GLU C C 15.909 6.757 2.908 1.00 . A A . 38 GLU C 1 1 10 6239 1 1 38 GLU CA C 16.600 7.488 1.761 1.00 . A A . 38 GLU CA 1 1 10 6240 1 1 38 GLU CB C 17.563 8.538 2.318 1.00 . A A . 38 GLU CB 1 1 10 6241 1 1 38 GLU CD C 16.466 9.220 4.488 1.00 . A A . 38 GLU CD 1 1 10 6242 1 1 38 GLU CG C 16.873 9.648 3.092 1.00 . A A . 38 GLU CG 1 1 10 6243 1 1 38 GLU H H 15.490 9.085 0.924 1.00 . A A . 38 GLU H 1 1 10 6244 1 1 38 GLU HA H 17.159 6.772 1.179 1.00 . A A . 38 GLU HA 1 1 10 6245 1 1 38 GLU HB2 H 18.267 8.050 2.977 1.00 . A A . 38 GLU HB2 1 1 10 6246 1 1 38 GLU HB3 H 18.104 8.984 1.496 1.00 . A A . 38 GLU HB3 1 1 10 6247 1 1 38 GLU HG2 H 17.548 10.487 3.172 1.00 . A A . 38 GLU HG2 1 1 10 6248 1 1 38 GLU HG3 H 15.988 9.950 2.551 1.00 . A A . 38 GLU HG3 1 1 10 6249 1 1 38 GLU N N 15.621 8.115 0.880 1.00 . A A . 38 GLU N 1 1 10 6250 1 1 38 GLU O O 14.808 7.123 3.321 1.00 . A A . 38 GLU O 1 1 10 6251 1 1 38 GLU OE1 O 17.188 8.396 5.090 1.00 . A A . 38 GLU OE1 1 1 10 6252 1 1 38 GLU OE2 O 15.426 9.706 4.979 1.00 . A A . 38 GLU OE2 1 1 10 6253 1 1 39 LYS C C 16.986 4.892 5.695 1.00 . A A . 39 LYS C 1 1 10 6254 1 1 39 LYS CA C 16.015 4.935 4.520 1.00 . A A . 39 LYS CA 1 1 10 6255 1 1 39 LYS CB C 15.700 3.512 4.052 1.00 . A A . 39 LYS CB 1 1 10 6256 1 1 39 LYS CD C 17.045 3.002 1.992 1.00 . A A . 39 LYS CD 1 1 10 6257 1 1 39 LYS CE C 18.103 2.092 1.389 1.00 . A A . 39 LYS CE 1 1 10 6258 1 1 39 LYS CG C 16.904 2.777 3.488 1.00 . A A . 39 LYS CG 1 1 10 6259 1 1 39 LYS H H 17.437 5.475 3.048 1.00 . A A . 39 LYS H 1 1 10 6260 1 1 39 LYS HA H 15.100 5.409 4.842 1.00 . A A . 39 LYS HA 1 1 10 6261 1 1 39 LYS HB2 H 15.319 2.947 4.889 1.00 . A A . 39 LYS HB2 1 1 10 6262 1 1 39 LYS HB3 H 14.941 3.558 3.284 1.00 . A A . 39 LYS HB3 1 1 10 6263 1 1 39 LYS HD2 H 16.098 2.800 1.516 1.00 . A A . 39 LYS HD2 1 1 10 6264 1 1 39 LYS HD3 H 17.325 4.032 1.817 1.00 . A A . 39 LYS HD3 1 1 10 6265 1 1 39 LYS HE2 H 17.850 1.068 1.616 1.00 . A A . 39 LYS HE2 1 1 10 6266 1 1 39 LYS HE3 H 18.111 2.232 0.318 1.00 . A A . 39 LYS HE3 1 1 10 6267 1 1 39 LYS HG2 H 17.796 3.135 3.981 1.00 . A A . 39 LYS HG2 1 1 10 6268 1 1 39 LYS HG3 H 16.788 1.719 3.675 1.00 . A A . 39 LYS HG3 1 1 10 6269 1 1 39 LYS HZ1 H 19.569 1.970 2.872 1.00 . A A . 39 LYS HZ1 1 1 10 6270 1 1 39 LYS HZ2 H 19.602 3.415 1.993 1.00 . A A . 39 LYS HZ2 1 1 10 6271 1 1 39 LYS HZ3 H 20.187 1.989 1.297 1.00 . A A . 39 LYS HZ3 1 1 10 6272 1 1 39 LYS N N 16.563 5.719 3.420 1.00 . A A . 39 LYS N 1 1 10 6273 1 1 39 LYS NZ N 19.461 2.387 1.926 1.00 . A A . 39 LYS NZ 1 1 10 6274 1 1 39 LYS O O 18.204 4.845 5.523 1.00 . A A . 39 LYS O 1 1 10 6275 1 1 40 PRO C C 17.911 3.516 8.357 1.00 . A A . 40 PRO C 1 1 10 6276 1 1 40 PRO CA C 17.238 4.869 8.146 1.00 . A A . 40 PRO CA 1 1 10 6277 1 1 40 PRO CB C 16.210 5.133 9.249 1.00 . A A . 40 PRO CB 1 1 10 6278 1 1 40 PRO CD C 14.993 4.963 7.198 1.00 . A A . 40 PRO CD 1 1 10 6279 1 1 40 PRO CG C 14.913 4.680 8.673 1.00 . A A . 40 PRO CG 1 1 10 6280 1 1 40 PRO HA H 17.987 5.647 8.155 1.00 . A A . 40 PRO HA 1 1 10 6281 1 1 40 PRO HB2 H 16.471 4.566 10.131 1.00 . A A . 40 PRO HB2 1 1 10 6282 1 1 40 PRO HB3 H 16.192 6.186 9.484 1.00 . A A . 40 PRO HB3 1 1 10 6283 1 1 40 PRO HD2 H 14.462 4.206 6.640 1.00 . A A . 40 PRO HD2 1 1 10 6284 1 1 40 PRO HD3 H 14.596 5.943 6.980 1.00 . A A . 40 PRO HD3 1 1 10 6285 1 1 40 PRO HG2 H 14.783 3.623 8.846 1.00 . A A . 40 PRO HG2 1 1 10 6286 1 1 40 PRO HG3 H 14.101 5.237 9.117 1.00 . A A . 40 PRO HG3 1 1 10 6287 1 1 40 PRO N N 16.437 4.907 6.918 1.00 . A A . 40 PRO N 1 1 10 6288 1 1 40 PRO O O 18.581 3.297 9.366 1.00 . A A . 40 PRO O 1 1 10 6289 1 1 41 SER C C 19.816 1.332 7.222 1.00 . A A . 41 SER C 1 1 10 6290 1 1 41 SER CA C 18.314 1.281 7.482 1.00 . A A . 41 SER CA 1 1 10 6291 1 1 41 SER CB C 17.643 0.342 6.478 1.00 . A A . 41 SER CB 1 1 10 6292 1 1 41 SER H H 17.183 2.849 6.619 1.00 . A A . 41 SER H 1 1 10 6293 1 1 41 SER HA H 18.146 0.907 8.481 1.00 . A A . 41 SER HA 1 1 10 6294 1 1 41 SER HB2 H 16.578 0.330 6.657 1.00 . A A . 41 SER HB2 1 1 10 6295 1 1 41 SER HB3 H 17.836 0.694 5.475 1.00 . A A . 41 SER HB3 1 1 10 6296 1 1 41 SER HG H 17.660 -1.439 7.293 1.00 . A A . 41 SER HG 1 1 10 6297 1 1 41 SER N N 17.727 2.614 7.399 1.00 . A A . 41 SER N 1 1 10 6298 1 1 41 SER O O 20.300 2.177 6.470 1.00 . A A . 41 SER O 1 1 10 6299 1 1 41 SER OG O 18.142 -0.979 6.603 1.00 . A A . 41 SER OG 1 1 10 6300 1 1 42 GLY C C 22.392 0.092 6.243 1.00 . A A . 42 GLY C 1 1 10 6301 1 1 42 GLY CA C 21.991 0.376 7.676 1.00 . A A . 42 GLY CA 1 1 10 6302 1 1 42 GLY H H 20.111 -0.230 8.440 1.00 . A A . 42 GLY H 1 1 10 6303 1 1 42 GLY HA2 H 22.407 1.327 7.974 1.00 . A A . 42 GLY HA2 1 1 10 6304 1 1 42 GLY HA3 H 22.396 -0.398 8.312 1.00 . A A . 42 GLY HA3 1 1 10 6305 1 1 42 GLY N N 20.551 0.419 7.851 1.00 . A A . 42 GLY N 1 1 10 6306 1 1 42 GLY O O 21.624 0.310 5.306 1.00 . A A . 42 GLY O 1 1 10 6307 1 1 43 PRO C C 23.467 -1.940 4.109 1.00 . A A . 43 PRO C 1 1 10 6308 1 1 43 PRO CA C 24.155 -0.729 4.729 1.00 . A A . 43 PRO CA 1 1 10 6309 1 1 43 PRO CB C 25.630 -1.033 5.001 1.00 . A A . 43 PRO CB 1 1 10 6310 1 1 43 PRO CD C 24.594 -0.689 7.128 1.00 . A A . 43 PRO CD 1 1 10 6311 1 1 43 PRO CG C 25.670 -1.469 6.425 1.00 . A A . 43 PRO CG 1 1 10 6312 1 1 43 PRO HA H 24.078 0.112 4.055 1.00 . A A . 43 PRO HA 1 1 10 6313 1 1 43 PRO HB2 H 25.967 -1.817 4.337 1.00 . A A . 43 PRO HB2 1 1 10 6314 1 1 43 PRO HB3 H 26.220 -0.143 4.844 1.00 . A A . 43 PRO HB3 1 1 10 6315 1 1 43 PRO HD2 H 24.143 -1.285 7.907 1.00 . A A . 43 PRO HD2 1 1 10 6316 1 1 43 PRO HD3 H 24.996 0.226 7.535 1.00 . A A . 43 PRO HD3 1 1 10 6317 1 1 43 PRO HG2 H 25.470 -2.528 6.491 1.00 . A A . 43 PRO HG2 1 1 10 6318 1 1 43 PRO HG3 H 26.636 -1.242 6.851 1.00 . A A . 43 PRO HG3 1 1 10 6319 1 1 43 PRO N N 23.624 -0.405 6.057 1.00 . A A . 43 PRO N 1 1 10 6320 1 1 43 PRO O O 23.362 -2.994 4.735 1.00 . A A . 43 PRO O 1 1 10 6321 1 1 44 SER C C 23.115 -4.159 2.264 1.00 . A A . 44 SER C 1 1 10 6322 1 1 44 SER CA C 22.317 -2.862 2.172 1.00 . A A . 44 SER CA 1 1 10 6323 1 1 44 SER CB C 22.100 -2.487 0.704 1.00 . A A . 44 SER CB 1 1 10 6324 1 1 44 SER H H 23.113 -0.917 2.428 1.00 . A A . 44 SER H 1 1 10 6325 1 1 44 SER HA H 21.357 -3.010 2.642 1.00 . A A . 44 SER HA 1 1 10 6326 1 1 44 SER HB2 H 23.024 -2.114 0.290 1.00 . A A . 44 SER HB2 1 1 10 6327 1 1 44 SER HB3 H 21.786 -3.362 0.154 1.00 . A A . 44 SER HB3 1 1 10 6328 1 1 44 SER HG H 21.519 -0.651 0.344 1.00 . A A . 44 SER HG 1 1 10 6329 1 1 44 SER N N 22.999 -1.782 2.875 1.00 . A A . 44 SER N 1 1 10 6330 1 1 44 SER O O 24.312 -4.145 2.552 1.00 . A A . 44 SER O 1 1 10 6331 1 1 44 SER OG O 21.106 -1.485 0.576 1.00 . A A . 44 SER OG 1 1 10 6332 1 1 45 SER C C 22.464 -7.544 1.065 1.00 . A A . 45 SER C 1 1 10 6333 1 1 45 SER CA C 23.088 -6.586 2.074 1.00 . A A . 45 SER CA 1 1 10 6334 1 1 45 SER CB C 22.978 -7.169 3.484 1.00 . A A . 45 SER CB 1 1 10 6335 1 1 45 SER H H 21.491 -5.225 1.791 1.00 . A A . 45 SER H 1 1 10 6336 1 1 45 SER HA H 24.131 -6.452 1.830 1.00 . A A . 45 SER HA 1 1 10 6337 1 1 45 SER HB2 H 23.263 -6.418 4.205 1.00 . A A . 45 SER HB2 1 1 10 6338 1 1 45 SER HB3 H 21.958 -7.474 3.666 1.00 . A A . 45 SER HB3 1 1 10 6339 1 1 45 SER HG H 24.486 -8.109 4.309 1.00 . A A . 45 SER HG 1 1 10 6340 1 1 45 SER N N 22.444 -5.279 2.016 1.00 . A A . 45 SER N 1 1 10 6341 1 1 45 SER O O 21.425 -7.252 0.474 1.00 . A A . 45 SER O 1 1 10 6342 1 1 45 SER OG O 23.826 -8.295 3.638 1.00 . A A . 45 SER OG 1 1 10 6343 1 1 46 GLY C C 23.697 -10.262 -0.938 1.00 . A A . 46 GLY C 1 1 10 6344 1 1 46 GLY CA C 22.603 -9.677 -0.066 1.00 . A A . 46 GLY CA 1 1 10 6345 1 1 46 GLY H H 23.932 -8.871 1.371 1.00 . A A . 46 GLY H 1 1 10 6346 1 1 46 GLY HA2 H 22.131 -10.476 0.486 1.00 . A A . 46 GLY HA2 1 1 10 6347 1 1 46 GLY HA3 H 21.865 -9.208 -0.701 1.00 . A A . 46 GLY HA3 1 1 10 6348 1 1 46 GLY N N 23.108 -8.692 0.872 1.00 . A A . 46 GLY N 1 1 10 6349 1 1 46 GLY O O 24.502 -9.504 -1.476 1.00 . A A . 46 GLY O 1 1 10 6350 2 2 1 ZN ZN ZN 5.844 -0.785 3.924 1.00 . B A . 181 ZN ZN 1 1 11 6351 1 1 1 GLY C C 2.726 -32.545 3.609 1.00 . A A . 1 GLY C 1 1 11 6352 1 1 1 GLY CA C 2.317 -33.982 3.862 1.00 . A A . 1 GLY CA 1 1 11 6353 1 1 1 GLY H1 H 2.912 -33.854 5.890 1.00 . A A . 1 GLY H1 1 1 11 6354 1 1 1 GLY HA2 H 2.720 -34.604 3.078 1.00 . A A . 1 GLY HA2 1 1 11 6355 1 1 1 GLY HA3 H 1.238 -34.045 3.840 1.00 . A A . 1 GLY HA3 1 1 11 6356 1 1 1 GLY N N 2.788 -34.476 5.143 1.00 . A A . 1 GLY N 1 1 11 6357 1 1 1 GLY O O 3.834 -32.137 3.959 1.00 . A A . 1 GLY O 1 1 11 6358 1 1 2 SER C C 2.030 -29.519 3.950 1.00 . A A . 2 SER C 1 1 11 6359 1 1 2 SER CA C 2.109 -30.377 2.690 1.00 . A A . 2 SER CA 1 1 11 6360 1 1 2 SER CB C 1.123 -29.857 1.643 1.00 . A A . 2 SER CB 1 1 11 6361 1 1 2 SER H H 0.967 -32.158 2.741 1.00 . A A . 2 SER H 1 1 11 6362 1 1 2 SER HA H 3.110 -30.316 2.291 1.00 . A A . 2 SER HA 1 1 11 6363 1 1 2 SER HB2 H 0.114 -30.024 1.988 1.00 . A A . 2 SER HB2 1 1 11 6364 1 1 2 SER HB3 H 1.282 -28.798 1.496 1.00 . A A . 2 SER HB3 1 1 11 6365 1 1 2 SER HG H 2.214 -30.447 0.127 1.00 . A A . 2 SER HG 1 1 11 6366 1 1 2 SER N N 1.832 -31.775 2.996 1.00 . A A . 2 SER N 1 1 11 6367 1 1 2 SER O O 0.986 -28.942 4.256 1.00 . A A . 2 SER O 1 1 11 6368 1 1 2 SER OG O 1.298 -30.521 0.403 1.00 . A A . 2 SER OG 1 1 11 6369 1 1 3 SER C C 4.175 -27.496 5.764 1.00 . A A . 3 SER C 1 1 11 6370 1 1 3 SER CA C 3.197 -28.658 5.905 1.00 . A A . 3 SER CA 1 1 11 6371 1 1 3 SER CB C 3.607 -29.546 7.082 1.00 . A A . 3 SER CB 1 1 11 6372 1 1 3 SER H H 3.940 -29.925 4.380 1.00 . A A . 3 SER H 1 1 11 6373 1 1 3 SER HA H 2.209 -28.262 6.091 1.00 . A A . 3 SER HA 1 1 11 6374 1 1 3 SER HB2 H 3.584 -28.966 7.992 1.00 . A A . 3 SER HB2 1 1 11 6375 1 1 3 SER HB3 H 2.916 -30.372 7.164 1.00 . A A . 3 SER HB3 1 1 11 6376 1 1 3 SER HG H 5.010 -30.877 7.396 1.00 . A A . 3 SER HG 1 1 11 6377 1 1 3 SER N N 3.140 -29.442 4.676 1.00 . A A . 3 SER N 1 1 11 6378 1 1 3 SER O O 5.371 -27.644 6.011 1.00 . A A . 3 SER O 1 1 11 6379 1 1 3 SER OG O 4.915 -30.059 6.901 1.00 . A A . 3 SER OG 1 1 11 6380 1 1 4 GLY C C 3.703 -23.935 4.812 1.00 . A A . 4 GLY C 1 1 11 6381 1 1 4 GLY CA C 4.496 -25.168 5.197 1.00 . A A . 4 GLY CA 1 1 11 6382 1 1 4 GLY H H 2.695 -26.280 5.183 1.00 . A A . 4 GLY H 1 1 11 6383 1 1 4 GLY HA2 H 5.014 -24.974 6.125 1.00 . A A . 4 GLY HA2 1 1 11 6384 1 1 4 GLY HA3 H 5.224 -25.369 4.425 1.00 . A A . 4 GLY HA3 1 1 11 6385 1 1 4 GLY N N 3.656 -26.339 5.365 1.00 . A A . 4 GLY N 1 1 11 6386 1 1 4 GLY O O 2.529 -23.810 5.161 1.00 . A A . 4 GLY O 1 1 11 6387 1 1 5 SER C C 2.233 -22.046 3.298 1.00 . A A . 5 SER C 1 1 11 6388 1 1 5 SER CA C 3.692 -21.790 3.661 1.00 . A A . 5 SER CA 1 1 11 6389 1 1 5 SER CB C 4.430 -21.189 2.463 1.00 . A A . 5 SER CB 1 1 11 6390 1 1 5 SER H H 5.280 -23.180 3.842 1.00 . A A . 5 SER H 1 1 11 6391 1 1 5 SER HA H 3.729 -21.092 4.483 1.00 . A A . 5 SER HA 1 1 11 6392 1 1 5 SER HB2 H 5.474 -21.072 2.708 1.00 . A A . 5 SER HB2 1 1 11 6393 1 1 5 SER HB3 H 4.330 -21.849 1.614 1.00 . A A . 5 SER HB3 1 1 11 6394 1 1 5 SER HG H 4.595 -19.364 1.768 1.00 . A A . 5 SER HG 1 1 11 6395 1 1 5 SER N N 4.344 -23.022 4.090 1.00 . A A . 5 SER N 1 1 11 6396 1 1 5 SER O O 1.880 -23.125 2.820 1.00 . A A . 5 SER O 1 1 11 6397 1 1 5 SER OG O 3.897 -19.921 2.120 1.00 . A A . 5 SER OG 1 1 11 6398 1 1 6 SER C C -0.341 -20.636 1.830 1.00 . A A . 6 SER C 1 1 11 6399 1 1 6 SER CA C -0.034 -21.163 3.229 1.00 . A A . 6 SER CA 1 1 11 6400 1 1 6 SER CB C -0.859 -20.398 4.266 1.00 . A A . 6 SER CB 1 1 11 6401 1 1 6 SER H H 1.730 -20.211 3.910 1.00 . A A . 6 SER H 1 1 11 6402 1 1 6 SER HA H -0.298 -22.209 3.272 1.00 . A A . 6 SER HA 1 1 11 6403 1 1 6 SER HB2 H -1.910 -20.533 4.057 1.00 . A A . 6 SER HB2 1 1 11 6404 1 1 6 SER HB3 H -0.636 -20.780 5.252 1.00 . A A . 6 SER HB3 1 1 11 6405 1 1 6 SER HG H 0.369 -18.890 4.029 1.00 . A A . 6 SER HG 1 1 11 6406 1 1 6 SER N N 1.388 -21.046 3.528 1.00 . A A . 6 SER N 1 1 11 6407 1 1 6 SER O O -1.051 -21.275 1.056 1.00 . A A . 6 SER O 1 1 11 6408 1 1 6 SER OG O -0.561 -19.013 4.235 1.00 . A A . 6 SER OG 1 1 11 6409 1 1 7 GLY C C 0.493 -17.448 0.122 1.00 . A A . 7 GLY C 1 1 11 6410 1 1 7 GLY CA C -0.025 -18.869 0.210 1.00 . A A . 7 GLY CA 1 1 11 6411 1 1 7 GLY H H 0.759 -18.998 2.172 1.00 . A A . 7 GLY H 1 1 11 6412 1 1 7 GLY HA2 H 0.471 -19.469 -0.538 1.00 . A A . 7 GLY HA2 1 1 11 6413 1 1 7 GLY HA3 H -1.086 -18.866 0.008 1.00 . A A . 7 GLY HA3 1 1 11 6414 1 1 7 GLY N N 0.201 -19.464 1.514 1.00 . A A . 7 GLY N 1 1 11 6415 1 1 7 GLY O O 1.105 -16.942 1.064 1.00 . A A . 7 GLY O 1 1 11 6416 1 1 8 THR C C -0.470 -14.513 -1.562 1.00 . A A . 8 THR C 1 1 11 6417 1 1 8 THR CA C 0.700 -15.429 -1.221 1.00 . A A . 8 THR CA 1 1 11 6418 1 1 8 THR CB C 1.747 -15.346 -2.348 1.00 . A A . 8 THR CB 1 1 11 6419 1 1 8 THR CG2 C 1.202 -15.941 -3.638 1.00 . A A . 8 THR CG2 1 1 11 6420 1 1 8 THR H H -0.241 -17.256 -1.727 1.00 . A A . 8 THR H 1 1 11 6421 1 1 8 THR HA H 1.159 -15.085 -0.306 1.00 . A A . 8 THR HA 1 1 11 6422 1 1 8 THR HB H 2.620 -15.909 -2.050 1.00 . A A . 8 THR HB 1 1 11 6423 1 1 8 THR HG1 H 1.442 -13.541 -3.082 1.00 . A A . 8 THR HG1 1 1 11 6424 1 1 8 THR HG21 H 0.152 -16.159 -3.517 1.00 . A A . 8 THR HG21 1 1 11 6425 1 1 8 THR HG22 H 1.735 -16.852 -3.867 1.00 . A A . 8 THR HG22 1 1 11 6426 1 1 8 THR HG23 H 1.334 -15.235 -4.444 1.00 . A A . 8 THR HG23 1 1 11 6427 1 1 8 THR N N 0.251 -16.799 -1.013 1.00 . A A . 8 THR N 1 1 11 6428 1 1 8 THR O O -0.742 -14.246 -2.731 1.00 . A A . 8 THR O 1 1 11 6429 1 1 8 THR OG1 O 2.123 -13.982 -2.568 1.00 . A A . 8 THR OG1 1 1 11 6430 1 1 9 GLY C C -3.306 -13.230 0.381 1.00 . A A . 9 GLY C 1 1 11 6431 1 1 9 GLY CA C -2.291 -13.150 -0.742 1.00 . A A . 9 GLY CA 1 1 11 6432 1 1 9 GLY H H -0.895 -14.278 0.381 1.00 . A A . 9 GLY H 1 1 11 6433 1 1 9 GLY HA2 H -1.933 -12.134 -0.818 1.00 . A A . 9 GLY HA2 1 1 11 6434 1 1 9 GLY HA3 H -2.775 -13.420 -1.669 1.00 . A A . 9 GLY HA3 1 1 11 6435 1 1 9 GLY N N -1.158 -14.032 -0.531 1.00 . A A . 9 GLY N 1 1 11 6436 1 1 9 GLY O O -3.992 -14.240 0.534 1.00 . A A . 9 GLY O 1 1 11 6437 1 1 10 GLU C C -5.209 -10.869 2.215 1.00 . A A . 10 GLU C 1 1 11 6438 1 1 10 GLU CA C -4.338 -12.120 2.285 1.00 . A A . 10 GLU CA 1 1 11 6439 1 1 10 GLU CB C -3.583 -12.155 3.615 1.00 . A A . 10 GLU CB 1 1 11 6440 1 1 10 GLU CD C -2.173 -10.869 5.271 1.00 . A A . 10 GLU CD 1 1 11 6441 1 1 10 GLU CG C -2.720 -10.928 3.858 1.00 . A A . 10 GLU CG 1 1 11 6442 1 1 10 GLU H H -2.826 -11.388 0.996 1.00 . A A . 10 GLU H 1 1 11 6443 1 1 10 GLU HA H -4.973 -12.990 2.219 1.00 . A A . 10 GLU HA 1 1 11 6444 1 1 10 GLU HB2 H -4.299 -12.231 4.420 1.00 . A A . 10 GLU HB2 1 1 11 6445 1 1 10 GLU HB3 H -2.944 -13.026 3.630 1.00 . A A . 10 GLU HB3 1 1 11 6446 1 1 10 GLU HG2 H -1.890 -10.945 3.168 1.00 . A A . 10 GLU HG2 1 1 11 6447 1 1 10 GLU HG3 H -3.315 -10.044 3.682 1.00 . A A . 10 GLU HG3 1 1 11 6448 1 1 10 GLU N N -3.400 -12.163 1.169 1.00 . A A . 10 GLU N 1 1 11 6449 1 1 10 GLU O O -6.347 -10.864 2.685 1.00 . A A . 10 GLU O 1 1 11 6450 1 1 10 GLU OE1 O -2.875 -11.324 6.199 1.00 . A A . 10 GLU OE1 1 1 11 6451 1 1 10 GLU OE2 O -1.043 -10.369 5.449 1.00 . A A . 10 GLU OE2 1 1 11 6452 1 1 11 LYS C C -4.978 -7.816 0.221 1.00 . A A . 11 LYS C 1 1 11 6453 1 1 11 LYS CA C -5.392 -8.552 1.492 1.00 . A A . 11 LYS CA 1 1 11 6454 1 1 11 LYS CB C -5.143 -7.663 2.712 1.00 . A A . 11 LYS CB 1 1 11 6455 1 1 11 LYS CD C -5.441 -7.474 5.199 1.00 . A A . 11 LYS CD 1 1 11 6456 1 1 11 LYS CE C -6.157 -8.055 6.409 1.00 . A A . 11 LYS CE 1 1 11 6457 1 1 11 LYS CG C -6.029 -7.998 3.900 1.00 . A A . 11 LYS CG 1 1 11 6458 1 1 11 LYS H H -3.755 -9.875 1.269 1.00 . A A . 11 LYS H 1 1 11 6459 1 1 11 LYS HA H -6.446 -8.781 1.433 1.00 . A A . 11 LYS HA 1 1 11 6460 1 1 11 LYS HB2 H -4.112 -7.771 3.017 1.00 . A A . 11 LYS HB2 1 1 11 6461 1 1 11 LYS HB3 H -5.321 -6.634 2.436 1.00 . A A . 11 LYS HB3 1 1 11 6462 1 1 11 LYS HD2 H -4.397 -7.746 5.248 1.00 . A A . 11 LYS HD2 1 1 11 6463 1 1 11 LYS HD3 H -5.535 -6.397 5.219 1.00 . A A . 11 LYS HD3 1 1 11 6464 1 1 11 LYS HE2 H -7.218 -7.894 6.295 1.00 . A A . 11 LYS HE2 1 1 11 6465 1 1 11 LYS HE3 H -5.956 -9.115 6.454 1.00 . A A . 11 LYS HE3 1 1 11 6466 1 1 11 LYS HG2 H -7.000 -7.550 3.751 1.00 . A A . 11 LYS HG2 1 1 11 6467 1 1 11 LYS HG3 H -6.132 -9.072 3.969 1.00 . A A . 11 LYS HG3 1 1 11 6468 1 1 11 LYS HZ1 H -4.803 -7.839 7.985 1.00 . A A . 11 LYS HZ1 1 1 11 6469 1 1 11 LYS HZ2 H -6.414 -7.570 8.424 1.00 . A A . 11 LYS HZ2 1 1 11 6470 1 1 11 LYS HZ3 H -5.572 -6.399 7.540 1.00 . A A . 11 LYS HZ3 1 1 11 6471 1 1 11 LYS N N -4.666 -9.809 1.625 1.00 . A A . 11 LYS N 1 1 11 6472 1 1 11 LYS NZ N -5.704 -7.421 7.679 1.00 . A A . 11 LYS NZ 1 1 11 6473 1 1 11 LYS O O -3.848 -7.933 -0.252 1.00 . A A . 11 LYS O 1 1 11 6474 1 1 12 PRO C C -4.702 -5.109 -1.337 1.00 . A A . 12 PRO C 1 1 11 6475 1 1 12 PRO CA C -5.667 -6.267 -1.567 1.00 . A A . 12 PRO CA 1 1 11 6476 1 1 12 PRO CB C -7.055 -5.741 -1.940 1.00 . A A . 12 PRO CB 1 1 11 6477 1 1 12 PRO CD C -7.282 -6.852 0.165 1.00 . A A . 12 PRO CD 1 1 11 6478 1 1 12 PRO CG C -7.804 -5.703 -0.653 1.00 . A A . 12 PRO CG 1 1 11 6479 1 1 12 PRO HA H -5.292 -6.894 -2.363 1.00 . A A . 12 PRO HA 1 1 11 6480 1 1 12 PRO HB2 H -6.964 -4.756 -2.375 1.00 . A A . 12 PRO HB2 1 1 11 6481 1 1 12 PRO HB3 H -7.520 -6.411 -2.647 1.00 . A A . 12 PRO HB3 1 1 11 6482 1 1 12 PRO HD2 H -7.271 -6.595 1.213 1.00 . A A . 12 PRO HD2 1 1 11 6483 1 1 12 PRO HD3 H -7.879 -7.736 -0.003 1.00 . A A . 12 PRO HD3 1 1 11 6484 1 1 12 PRO HG2 H -7.618 -4.768 -0.147 1.00 . A A . 12 PRO HG2 1 1 11 6485 1 1 12 PRO HG3 H -8.860 -5.826 -0.840 1.00 . A A . 12 PRO HG3 1 1 11 6486 1 1 12 PRO N N -5.913 -7.039 -0.345 1.00 . A A . 12 PRO N 1 1 11 6487 1 1 12 PRO O O -4.130 -4.567 -2.284 1.00 . A A . 12 PRO O 1 1 11 6488 1 1 13 TYR C C -2.357 -4.164 0.932 1.00 . A A . 13 TYR C 1 1 11 6489 1 1 13 TYR CA C -3.631 -3.638 0.278 1.00 . A A . 13 TYR CA 1 1 11 6490 1 1 13 TYR CB C -4.336 -2.661 1.222 1.00 . A A . 13 TYR CB 1 1 11 6491 1 1 13 TYR CD1 C -6.053 -1.834 -0.434 1.00 . A A . 13 TYR CD1 1 1 11 6492 1 1 13 TYR CD2 C -6.814 -2.582 1.697 1.00 . A A . 13 TYR CD2 1 1 11 6493 1 1 13 TYR CE1 C -7.353 -1.550 -0.805 1.00 . A A . 13 TYR CE1 1 1 11 6494 1 1 13 TYR CE2 C -8.118 -2.303 1.334 1.00 . A A . 13 TYR CE2 1 1 11 6495 1 1 13 TYR CG C -5.760 -2.353 0.821 1.00 . A A . 13 TYR CG 1 1 11 6496 1 1 13 TYR CZ C -8.382 -1.787 0.083 1.00 . A A . 13 TYR CZ 1 1 11 6497 1 1 13 TYR H H -5.009 -5.204 0.636 1.00 . A A . 13 TYR H 1 1 11 6498 1 1 13 TYR HA H -3.368 -3.118 -0.631 1.00 . A A . 13 TYR HA 1 1 11 6499 1 1 13 TYR HB2 H -4.355 -3.082 2.215 1.00 . A A . 13 TYR HB2 1 1 11 6500 1 1 13 TYR HB3 H -3.787 -1.731 1.240 1.00 . A A . 13 TYR HB3 1 1 11 6501 1 1 13 TYR HD1 H -5.244 -1.650 -1.127 1.00 . A A . 13 TYR HD1 1 1 11 6502 1 1 13 TYR HD2 H -6.604 -2.987 2.676 1.00 . A A . 13 TYR HD2 1 1 11 6503 1 1 13 TYR HE1 H -7.560 -1.146 -1.785 1.00 . A A . 13 TYR HE1 1 1 11 6504 1 1 13 TYR HE2 H -8.924 -2.488 2.029 1.00 . A A . 13 TYR HE2 1 1 11 6505 1 1 13 TYR HH H -10.208 -2.305 -0.219 1.00 . A A . 13 TYR HH 1 1 11 6506 1 1 13 TYR N N -4.526 -4.734 -0.075 1.00 . A A . 13 TYR N 1 1 11 6507 1 1 13 TYR O O -2.272 -4.269 2.155 1.00 . A A . 13 TYR O 1 1 11 6508 1 1 13 TYR OH O -9.679 -1.506 -0.282 1.00 . A A . 13 TYR OH 1 1 11 6509 1 1 14 GLU C C 1.065 -4.147 0.120 1.00 . A A . 14 GLU C 1 1 11 6510 1 1 14 GLU CA C -0.098 -5.009 0.603 1.00 . A A . 14 GLU CA 1 1 11 6511 1 1 14 GLU CB C 0.103 -6.456 0.149 1.00 . A A . 14 GLU CB 1 1 11 6512 1 1 14 GLU CD C 1.661 -8.440 0.025 1.00 . A A . 14 GLU CD 1 1 11 6513 1 1 14 GLU CG C 1.426 -7.055 0.595 1.00 . A A . 14 GLU CG 1 1 11 6514 1 1 14 GLU H H -1.497 -4.387 -0.860 1.00 . A A . 14 GLU H 1 1 11 6515 1 1 14 GLU HA H -0.128 -4.980 1.682 1.00 . A A . 14 GLU HA 1 1 11 6516 1 1 14 GLU HB2 H -0.697 -7.061 0.551 1.00 . A A . 14 GLU HB2 1 1 11 6517 1 1 14 GLU HB3 H 0.062 -6.491 -0.929 1.00 . A A . 14 GLU HB3 1 1 11 6518 1 1 14 GLU HG2 H 2.227 -6.409 0.271 1.00 . A A . 14 GLU HG2 1 1 11 6519 1 1 14 GLU HG3 H 1.432 -7.120 1.673 1.00 . A A . 14 GLU HG3 1 1 11 6520 1 1 14 GLU N N -1.368 -4.493 0.106 1.00 . A A . 14 GLU N 1 1 11 6521 1 1 14 GLU O O 1.110 -3.739 -1.041 1.00 . A A . 14 GLU O 1 1 11 6522 1 1 14 GLU OE1 O 1.981 -8.541 -1.178 1.00 . A A . 14 GLU OE1 1 1 11 6523 1 1 14 GLU OE2 O 1.525 -9.424 0.782 1.00 . A A . 14 GLU OE2 1 1 11 6524 1 1 15 CYS C C 4.162 -3.850 -0.156 1.00 . A A . 15 CYS C 1 1 11 6525 1 1 15 CYS CA C 3.167 -3.059 0.689 1.00 . A A . 15 CYS CA 1 1 11 6526 1 1 15 CYS CB C 3.847 -2.561 1.965 1.00 . A A . 15 CYS CB 1 1 11 6527 1 1 15 CYS H H 1.912 -4.226 1.930 1.00 . A A . 15 CYS H 1 1 11 6528 1 1 15 CYS HA H 2.825 -2.208 0.118 1.00 . A A . 15 CYS HA 1 1 11 6529 1 1 15 CYS HB2 H 3.089 -2.276 2.681 1.00 . A A . 15 CYS HB2 1 1 11 6530 1 1 15 CYS HB3 H 4.445 -3.359 2.380 1.00 . A A . 15 CYS HB3 1 1 11 6531 1 1 15 CYS N N 2.004 -3.872 1.020 1.00 . A A . 15 CYS N 1 1 11 6532 1 1 15 CYS O O 4.517 -4.979 0.181 1.00 . A A . 15 CYS O 1 1 11 6533 1 1 15 CYS SG S 4.938 -1.123 1.715 1.00 . A A . 15 CYS SG 1 1 11 6534 1 1 16 ASP C C 6.994 -3.635 -1.690 1.00 . A A . 16 ASP C 1 1 11 6535 1 1 16 ASP CA C 5.562 -3.895 -2.146 1.00 . A A . 16 ASP CA 1 1 11 6536 1 1 16 ASP CB C 5.371 -3.397 -3.579 1.00 . A A . 16 ASP CB 1 1 11 6537 1 1 16 ASP CG C 3.909 -3.312 -3.973 1.00 . A A . 16 ASP CG 1 1 11 6538 1 1 16 ASP H H 4.286 -2.347 -1.468 1.00 . A A . 16 ASP H 1 1 11 6539 1 1 16 ASP HA H 5.375 -4.958 -2.116 1.00 . A A . 16 ASP HA 1 1 11 6540 1 1 16 ASP HB2 H 5.807 -2.413 -3.672 1.00 . A A . 16 ASP HB2 1 1 11 6541 1 1 16 ASP HB3 H 5.870 -4.073 -4.258 1.00 . A A . 16 ASP HB3 1 1 11 6542 1 1 16 ASP N N 4.607 -3.248 -1.253 1.00 . A A . 16 ASP N 1 1 11 6543 1 1 16 ASP O O 7.938 -3.769 -2.468 1.00 . A A . 16 ASP O 1 1 11 6544 1 1 16 ASP OD1 O 3.137 -4.211 -3.581 1.00 . A A . 16 ASP OD1 1 1 11 6545 1 1 16 ASP OD2 O 3.538 -2.348 -4.674 1.00 . A A . 16 ASP OD2 1 1 11 6546 1 1 17 VAL C C 8.769 -3.904 1.312 1.00 . A A . 17 VAL C 1 1 11 6547 1 1 17 VAL CA C 8.465 -2.982 0.136 1.00 . A A . 17 VAL CA 1 1 11 6548 1 1 17 VAL CB C 8.578 -1.519 0.603 1.00 . A A . 17 VAL CB 1 1 11 6549 1 1 17 VAL CG1 C 9.943 -1.258 1.220 1.00 . A A . 17 VAL CG1 1 1 11 6550 1 1 17 VAL CG2 C 8.318 -0.568 -0.556 1.00 . A A . 17 VAL CG2 1 1 11 6551 1 1 17 VAL H H 6.357 -3.172 0.148 1.00 . A A . 17 VAL H 1 1 11 6552 1 1 17 VAL HA H 9.199 -3.148 -0.639 1.00 . A A . 17 VAL HA 1 1 11 6553 1 1 17 VAL HB H 7.826 -1.344 1.359 1.00 . A A . 17 VAL HB 1 1 11 6554 1 1 17 VAL HG11 H 9.896 -1.433 2.285 1.00 . A A . 17 VAL HG11 1 1 11 6555 1 1 17 VAL HG12 H 10.671 -1.922 0.777 1.00 . A A . 17 VAL HG12 1 1 11 6556 1 1 17 VAL HG13 H 10.231 -0.234 1.037 1.00 . A A . 17 VAL HG13 1 1 11 6557 1 1 17 VAL HG21 H 7.530 0.120 -0.288 1.00 . A A . 17 VAL HG21 1 1 11 6558 1 1 17 VAL HG22 H 9.219 -0.017 -0.778 1.00 . A A . 17 VAL HG22 1 1 11 6559 1 1 17 VAL HG23 H 8.019 -1.135 -1.426 1.00 . A A . 17 VAL HG23 1 1 11 6560 1 1 17 VAL N N 7.148 -3.261 -0.424 1.00 . A A . 17 VAL N 1 1 11 6561 1 1 17 VAL O O 9.796 -4.584 1.332 1.00 . A A . 17 VAL O 1 1 11 6562 1 1 18 CYS C C 7.039 -5.913 3.469 1.00 . A A . 18 CYS C 1 1 11 6563 1 1 18 CYS CA C 8.041 -4.761 3.470 1.00 . A A . 18 CYS CA 1 1 11 6564 1 1 18 CYS CB C 7.874 -3.927 4.742 1.00 . A A . 18 CYS CB 1 1 11 6565 1 1 18 CYS H H 7.071 -3.358 2.216 1.00 . A A . 18 CYS H 1 1 11 6566 1 1 18 CYS HA H 9.040 -5.169 3.446 1.00 . A A . 18 CYS HA 1 1 11 6567 1 1 18 CYS HB2 H 7.867 -4.587 5.598 1.00 . A A . 18 CYS HB2 1 1 11 6568 1 1 18 CYS HB3 H 8.707 -3.244 4.827 1.00 . A A . 18 CYS HB3 1 1 11 6569 1 1 18 CYS N N 7.870 -3.923 2.290 1.00 . A A . 18 CYS N 1 1 11 6570 1 1 18 CYS O O 7.083 -6.788 4.333 1.00 . A A . 18 CYS O 1 1 11 6571 1 1 18 CYS SG S 6.342 -2.944 4.791 1.00 . A A . 18 CYS SG 1 1 11 6572 1 1 19 ARG C C 4.210 -6.951 3.600 1.00 . A A . 19 ARG C 1 1 11 6573 1 1 19 ARG CA C 5.125 -6.947 2.379 1.00 . A A . 19 ARG CA 1 1 11 6574 1 1 19 ARG CB C 5.788 -8.316 2.220 1.00 . A A . 19 ARG CB 1 1 11 6575 1 1 19 ARG CD C 7.236 -7.647 0.278 1.00 . A A . 19 ARG CD 1 1 11 6576 1 1 19 ARG CG C 6.197 -8.633 0.791 1.00 . A A . 19 ARG CG 1 1 11 6577 1 1 19 ARG CZ C 8.567 -7.405 -1.775 1.00 . A A . 19 ARG CZ 1 1 11 6578 1 1 19 ARG H H 6.153 -5.179 1.833 1.00 . A A . 19 ARG H 1 1 11 6579 1 1 19 ARG HA H 4.532 -6.739 1.501 1.00 . A A . 19 ARG HA 1 1 11 6580 1 1 19 ARG HB2 H 6.672 -8.350 2.840 1.00 . A A . 19 ARG HB2 1 1 11 6581 1 1 19 ARG HB3 H 5.097 -9.077 2.550 1.00 . A A . 19 ARG HB3 1 1 11 6582 1 1 19 ARG HD2 H 6.898 -6.644 0.493 1.00 . A A . 19 ARG HD2 1 1 11 6583 1 1 19 ARG HD3 H 8.169 -7.830 0.789 1.00 . A A . 19 ARG HD3 1 1 11 6584 1 1 19 ARG HE H 6.722 -8.157 -1.695 1.00 . A A . 19 ARG HE 1 1 11 6585 1 1 19 ARG HG2 H 6.615 -9.628 0.758 1.00 . A A . 19 ARG HG2 1 1 11 6586 1 1 19 ARG HG3 H 5.324 -8.585 0.157 1.00 . A A . 19 ARG HG3 1 1 11 6587 1 1 19 ARG HH11 H 9.482 -6.773 -0.088 1.00 . A A . 19 ARG HH11 1 1 11 6588 1 1 19 ARG HH12 H 10.410 -6.608 -1.542 1.00 . A A . 19 ARG HH12 1 1 11 6589 1 1 19 ARG HH21 H 7.933 -7.946 -3.616 1.00 . A A . 19 ARG HH21 1 1 11 6590 1 1 19 ARG HH22 H 9.528 -7.275 -3.548 1.00 . A A . 19 ARG HH22 1 1 11 6591 1 1 19 ARG N N 6.138 -5.904 2.492 1.00 . A A . 19 ARG N 1 1 11 6592 1 1 19 ARG NE N 7.449 -7.776 -1.161 1.00 . A A . 19 ARG NE 1 1 11 6593 1 1 19 ARG NH1 N 9.568 -6.885 -1.078 1.00 . A A . 19 ARG NH1 1 1 11 6594 1 1 19 ARG NH2 N 8.686 -7.554 -3.088 1.00 . A A . 19 ARG NH2 1 1 11 6595 1 1 19 ARG O O 3.953 -7.999 4.193 1.00 . A A . 19 ARG O 1 1 11 6596 1 1 20 LYS C C 1.374 -5.759 4.698 1.00 . A A . 20 LYS C 1 1 11 6597 1 1 20 LYS CA C 2.835 -5.639 5.121 1.00 . A A . 20 LYS CA 1 1 11 6598 1 1 20 LYS CB C 3.067 -4.296 5.817 1.00 . A A . 20 LYS CB 1 1 11 6599 1 1 20 LYS CD C 4.164 -3.061 7.709 1.00 . A A . 20 LYS CD 1 1 11 6600 1 1 20 LYS CE C 3.201 -3.108 8.886 1.00 . A A . 20 LYS CE 1 1 11 6601 1 1 20 LYS CG C 4.124 -4.350 6.906 1.00 . A A . 20 LYS CG 1 1 11 6602 1 1 20 LYS H H 3.963 -4.972 3.458 1.00 . A A . 20 LYS H 1 1 11 6603 1 1 20 LYS HA H 3.064 -6.437 5.811 1.00 . A A . 20 LYS HA 1 1 11 6604 1 1 20 LYS HB2 H 3.377 -3.571 5.079 1.00 . A A . 20 LYS HB2 1 1 11 6605 1 1 20 LYS HB3 H 2.138 -3.970 6.262 1.00 . A A . 20 LYS HB3 1 1 11 6606 1 1 20 LYS HD2 H 5.165 -2.911 8.084 1.00 . A A . 20 LYS HD2 1 1 11 6607 1 1 20 LYS HD3 H 3.891 -2.237 7.065 1.00 . A A . 20 LYS HD3 1 1 11 6608 1 1 20 LYS HE2 H 2.351 -3.715 8.615 1.00 . A A . 20 LYS HE2 1 1 11 6609 1 1 20 LYS HE3 H 3.707 -3.553 9.730 1.00 . A A . 20 LYS HE3 1 1 11 6610 1 1 20 LYS HG2 H 3.901 -5.170 7.572 1.00 . A A . 20 LYS HG2 1 1 11 6611 1 1 20 LYS HG3 H 5.091 -4.508 6.449 1.00 . A A . 20 LYS HG3 1 1 11 6612 1 1 20 LYS HZ1 H 1.836 -1.820 9.804 1.00 . A A . 20 LYS HZ1 1 1 11 6613 1 1 20 LYS HZ2 H 2.558 -1.177 8.415 1.00 . A A . 20 LYS HZ2 1 1 11 6614 1 1 20 LYS HZ3 H 3.436 -1.274 9.857 1.00 . A A . 20 LYS HZ3 1 1 11 6615 1 1 20 LYS N N 3.722 -5.773 3.971 1.00 . A A . 20 LYS N 1 1 11 6616 1 1 20 LYS NZ N 2.724 -1.750 9.267 1.00 . A A . 20 LYS NZ 1 1 11 6617 1 1 20 LYS O O 1.074 -5.978 3.525 1.00 . A A . 20 LYS O 1 1 11 6618 1 1 21 ALA C C -1.721 -4.575 6.079 1.00 . A A . 21 ALA C 1 1 11 6619 1 1 21 ALA CA C -0.959 -5.700 5.387 1.00 . A A . 21 ALA CA 1 1 11 6620 1 1 21 ALA CB C -1.498 -7.054 5.827 1.00 . A A . 21 ALA CB 1 1 11 6621 1 1 21 ALA H H 0.772 -5.439 6.577 1.00 . A A . 21 ALA H 1 1 11 6622 1 1 21 ALA HA H -1.100 -5.614 4.320 1.00 . A A . 21 ALA HA 1 1 11 6623 1 1 21 ALA HB1 H -2.577 -7.038 5.797 1.00 . A A . 21 ALA HB1 1 1 11 6624 1 1 21 ALA HB2 H -1.130 -7.820 5.161 1.00 . A A . 21 ALA HB2 1 1 11 6625 1 1 21 ALA HB3 H -1.168 -7.262 6.834 1.00 . A A . 21 ALA HB3 1 1 11 6626 1 1 21 ALA N N 0.470 -5.612 5.661 1.00 . A A . 21 ALA N 1 1 11 6627 1 1 21 ALA O O -1.461 -4.258 7.240 1.00 . A A . 21 ALA O 1 1 11 6628 1 1 22 PHE C C -4.945 -3.100 5.618 1.00 . A A . 22 PHE C 1 1 11 6629 1 1 22 PHE CA C -3.461 -2.883 5.903 1.00 . A A . 22 PHE CA 1 1 11 6630 1 1 22 PHE CB C -3.007 -1.546 5.312 1.00 . A A . 22 PHE CB 1 1 11 6631 1 1 22 PHE CD1 C -0.611 -1.883 4.646 1.00 . A A . 22 PHE CD1 1 1 11 6632 1 1 22 PHE CD2 C -1.084 -0.438 6.483 1.00 . A A . 22 PHE CD2 1 1 11 6633 1 1 22 PHE CE1 C 0.741 -1.642 4.801 1.00 . A A . 22 PHE CE1 1 1 11 6634 1 1 22 PHE CE2 C 0.267 -0.194 6.642 1.00 . A A . 22 PHE CE2 1 1 11 6635 1 1 22 PHE CG C -1.538 -1.284 5.484 1.00 . A A . 22 PHE CG 1 1 11 6636 1 1 22 PHE CZ C 1.181 -0.798 5.801 1.00 . A A . 22 PHE CZ 1 1 11 6637 1 1 22 PHE H H -2.823 -4.273 4.439 1.00 . A A . 22 PHE H 1 1 11 6638 1 1 22 PHE HA H -3.311 -2.864 6.972 1.00 . A A . 22 PHE HA 1 1 11 6639 1 1 22 PHE HB2 H -3.224 -1.536 4.255 1.00 . A A . 22 PHE HB2 1 1 11 6640 1 1 22 PHE HB3 H -3.547 -0.746 5.795 1.00 . A A . 22 PHE HB3 1 1 11 6641 1 1 22 PHE HD1 H -0.954 -2.544 3.863 1.00 . A A . 22 PHE HD1 1 1 11 6642 1 1 22 PHE HD2 H -1.797 0.034 7.143 1.00 . A A . 22 PHE HD2 1 1 11 6643 1 1 22 PHE HE1 H 1.453 -2.117 4.141 1.00 . A A . 22 PHE HE1 1 1 11 6644 1 1 22 PHE HE2 H 0.608 0.467 7.425 1.00 . A A . 22 PHE HE2 1 1 11 6645 1 1 22 PHE HZ H 2.237 -0.608 5.923 1.00 . A A . 22 PHE HZ 1 1 11 6646 1 1 22 PHE N N -2.662 -3.975 5.359 1.00 . A A . 22 PHE N 1 1 11 6647 1 1 22 PHE O O -5.312 -3.710 4.615 1.00 . A A . 22 PHE O 1 1 11 6648 1 1 23 SER C C -7.762 -1.801 5.275 1.00 . A A . 23 SER C 1 1 11 6649 1 1 23 SER CA C -7.235 -2.738 6.358 1.00 . A A . 23 SER CA 1 1 11 6650 1 1 23 SER CB C -7.940 -2.449 7.685 1.00 . A A . 23 SER CB 1 1 11 6651 1 1 23 SER H H -5.438 -2.119 7.290 1.00 . A A . 23 SER H 1 1 11 6652 1 1 23 SER HA H -7.439 -3.757 6.066 1.00 . A A . 23 SER HA 1 1 11 6653 1 1 23 SER HB2 H -7.547 -1.537 8.108 1.00 . A A . 23 SER HB2 1 1 11 6654 1 1 23 SER HB3 H -9.000 -2.336 7.509 1.00 . A A . 23 SER HB3 1 1 11 6655 1 1 23 SER HG H -7.850 -3.173 9.503 1.00 . A A . 23 SER HG 1 1 11 6656 1 1 23 SER N N -5.792 -2.596 6.510 1.00 . A A . 23 SER N 1 1 11 6657 1 1 23 SER O O -8.450 -2.229 4.348 1.00 . A A . 23 SER O 1 1 11 6658 1 1 23 SER OG O -7.740 -3.505 8.608 1.00 . A A . 23 SER OG 1 1 11 6659 1 1 24 HIS C C -6.822 0.683 3.345 1.00 . A A . 24 HIS C 1 1 11 6660 1 1 24 HIS CA C -7.873 0.481 4.432 1.00 . A A . 24 HIS CA 1 1 11 6661 1 1 24 HIS CB C -8.162 1.808 5.133 1.00 . A A . 24 HIS CB 1 1 11 6662 1 1 24 HIS CD2 C -9.889 2.499 3.326 1.00 . A A . 24 HIS CD2 1 1 11 6663 1 1 24 HIS CE1 C -9.837 4.668 3.645 1.00 . A A . 24 HIS CE1 1 1 11 6664 1 1 24 HIS CG C -9.006 2.743 4.323 1.00 . A A . 24 HIS CG 1 1 11 6665 1 1 24 HIS H H -6.884 -0.238 6.160 1.00 . A A . 24 HIS H 1 1 11 6666 1 1 24 HIS HA H -8.782 0.121 3.973 1.00 . A A . 24 HIS HA 1 1 11 6667 1 1 24 HIS HB2 H -8.680 1.613 6.060 1.00 . A A . 24 HIS HB2 1 1 11 6668 1 1 24 HIS HB3 H -7.227 2.306 5.347 1.00 . A A . 24 HIS HB3 1 1 11 6669 1 1 24 HIS HD1 H -8.453 4.600 5.151 1.00 . A A . 24 HIS HD1 1 1 11 6670 1 1 24 HIS HD2 H -10.151 1.531 2.923 1.00 . A A . 24 HIS HD2 1 1 11 6671 1 1 24 HIS HE1 H -10.037 5.725 3.554 1.00 . A A . 24 HIS HE1 1 1 11 6672 1 1 24 HIS N N -7.434 -0.519 5.400 1.00 . A A . 24 HIS N 1 1 11 6673 1 1 24 HIS ND1 N -8.996 4.110 4.498 1.00 . A A . 24 HIS ND1 1 1 11 6674 1 1 24 HIS NE2 N -10.392 3.712 2.923 1.00 . A A . 24 HIS NE2 1 1 11 6675 1 1 24 HIS O O -5.621 0.603 3.607 1.00 . A A . 24 HIS O 1 1 11 6676 1 1 25 HIS C C -5.378 2.269 1.308 1.00 . A A . 25 HIS C 1 1 11 6677 1 1 25 HIS CA C -6.379 1.160 0.999 1.00 . A A . 25 HIS CA 1 1 11 6678 1 1 25 HIS CB C -7.175 1.510 -0.258 1.00 . A A . 25 HIS CB 1 1 11 6679 1 1 25 HIS CD2 C -7.068 4.012 -0.933 1.00 . A A . 25 HIS CD2 1 1 11 6680 1 1 25 HIS CE1 C -8.870 4.702 0.107 1.00 . A A . 25 HIS CE1 1 1 11 6681 1 1 25 HIS CG C -7.613 2.942 -0.310 1.00 . A A . 25 HIS CG 1 1 11 6682 1 1 25 HIS H H -8.248 0.997 1.980 1.00 . A A . 25 HIS H 1 1 11 6683 1 1 25 HIS HA H -5.839 0.241 0.828 1.00 . A A . 25 HIS HA 1 1 11 6684 1 1 25 HIS HB2 H -6.564 1.319 -1.128 1.00 . A A . 25 HIS HB2 1 1 11 6685 1 1 25 HIS HB3 H -8.059 0.890 -0.302 1.00 . A A . 25 HIS HB3 1 1 11 6686 1 1 25 HIS HD1 H -9.355 2.869 0.873 1.00 . A A . 25 HIS HD1 1 1 11 6687 1 1 25 HIS HD2 H -6.170 4.016 -1.535 1.00 . A A . 25 HIS HD2 1 1 11 6688 1 1 25 HIS HE1 H -9.660 5.334 0.484 1.00 . A A . 25 HIS HE1 1 1 11 6689 1 1 25 HIS N N -7.281 0.946 2.126 1.00 . A A . 25 HIS N 1 1 11 6690 1 1 25 HIS ND1 N -8.740 3.407 0.333 1.00 . A A . 25 HIS ND1 1 1 11 6691 1 1 25 HIS NE2 N -7.867 5.094 -0.658 1.00 . A A . 25 HIS NE2 1 1 11 6692 1 1 25 HIS O O -4.179 2.118 1.076 1.00 . A A . 25 HIS O 1 1 11 6693 1 1 26 ALA C C -3.946 4.110 3.166 1.00 . A A . 26 ALA C 1 1 11 6694 1 1 26 ALA CA C -5.028 4.516 2.172 1.00 . A A . 26 ALA CA 1 1 11 6695 1 1 26 ALA CB C -5.866 5.654 2.737 1.00 . A A . 26 ALA CB 1 1 11 6696 1 1 26 ALA H H -6.844 3.443 1.993 1.00 . A A . 26 ALA H 1 1 11 6697 1 1 26 ALA HA H -4.557 4.865 1.265 1.00 . A A . 26 ALA HA 1 1 11 6698 1 1 26 ALA HB1 H -5.502 6.594 2.352 1.00 . A A . 26 ALA HB1 1 1 11 6699 1 1 26 ALA HB2 H -6.898 5.520 2.443 1.00 . A A . 26 ALA HB2 1 1 11 6700 1 1 26 ALA HB3 H -5.795 5.653 3.814 1.00 . A A . 26 ALA HB3 1 1 11 6701 1 1 26 ALA N N -5.879 3.383 1.831 1.00 . A A . 26 ALA N 1 1 11 6702 1 1 26 ALA O O -2.765 4.392 2.962 1.00 . A A . 26 ALA O 1 1 11 6703 1 1 27 SER C C -2.147 2.448 4.645 1.00 . A A . 27 SER C 1 1 11 6704 1 1 27 SER CA C -3.421 3.007 5.272 1.00 . A A . 27 SER CA 1 1 11 6705 1 1 27 SER CB C -4.072 1.947 6.162 1.00 . A A . 27 SER CB 1 1 11 6706 1 1 27 SER H H -5.311 3.253 4.349 1.00 . A A . 27 SER H 1 1 11 6707 1 1 27 SER HA H -3.165 3.864 5.876 1.00 . A A . 27 SER HA 1 1 11 6708 1 1 27 SER HB2 H -4.785 1.381 5.582 1.00 . A A . 27 SER HB2 1 1 11 6709 1 1 27 SER HB3 H -3.309 1.283 6.543 1.00 . A A . 27 SER HB3 1 1 11 6710 1 1 27 SER HG H -5.310 1.893 7.680 1.00 . A A . 27 SER HG 1 1 11 6711 1 1 27 SER N N -4.356 3.448 4.243 1.00 . A A . 27 SER N 1 1 11 6712 1 1 27 SER O O -1.087 2.433 5.272 1.00 . A A . 27 SER O 1 1 11 6713 1 1 27 SER OG O -4.745 2.544 7.257 1.00 . A A . 27 SER OG 1 1 11 6714 1 1 28 LEU C C -0.323 2.526 1.985 1.00 . A A . 28 LEU C 1 1 11 6715 1 1 28 LEU CA C -1.117 1.429 2.689 1.00 . A A . 28 LEU CA 1 1 11 6716 1 1 28 LEU CB C -1.587 0.390 1.670 1.00 . A A . 28 LEU CB 1 1 11 6717 1 1 28 LEU CD1 C 0.496 -1.001 1.578 1.00 . A A . 28 LEU CD1 1 1 11 6718 1 1 28 LEU CD2 C -1.132 -1.065 -0.321 1.00 . A A . 28 LEU CD2 1 1 11 6719 1 1 28 LEU CG C -0.506 -0.198 0.762 1.00 . A A . 28 LEU CG 1 1 11 6720 1 1 28 LEU H H -3.129 2.028 2.955 1.00 . A A . 28 LEU H 1 1 11 6721 1 1 28 LEU HA H -0.477 0.947 3.413 1.00 . A A . 28 LEU HA 1 1 11 6722 1 1 28 LEU HB2 H -2.041 -0.424 2.213 1.00 . A A . 28 LEU HB2 1 1 11 6723 1 1 28 LEU HB3 H -2.330 0.859 1.040 1.00 . A A . 28 LEU HB3 1 1 11 6724 1 1 28 LEU HD11 H -0.006 -1.454 2.419 1.00 . A A . 28 LEU HD11 1 1 11 6725 1 1 28 LEU HD12 H 1.277 -0.346 1.934 1.00 . A A . 28 LEU HD12 1 1 11 6726 1 1 28 LEU HD13 H 0.929 -1.772 0.957 1.00 . A A . 28 LEU HD13 1 1 11 6727 1 1 28 LEU HD21 H -2.156 -0.761 -0.477 1.00 . A A . 28 LEU HD21 1 1 11 6728 1 1 28 LEU HD22 H -1.105 -2.100 -0.013 1.00 . A A . 28 LEU HD22 1 1 11 6729 1 1 28 LEU HD23 H -0.576 -0.949 -1.240 1.00 . A A . 28 LEU HD23 1 1 11 6730 1 1 28 LEU HG H 0.028 0.609 0.279 1.00 . A A . 28 LEU HG 1 1 11 6731 1 1 28 LEU N N -2.259 1.990 3.403 1.00 . A A . 28 LEU N 1 1 11 6732 1 1 28 LEU O O 0.886 2.654 2.179 1.00 . A A . 28 LEU O 1 1 11 6733 1 1 29 THR C C 0.270 5.404 1.390 1.00 . A A . 29 THR C 1 1 11 6734 1 1 29 THR CA C -0.373 4.403 0.437 1.00 . A A . 29 THR CA 1 1 11 6735 1 1 29 THR CB C -1.380 5.142 -0.464 1.00 . A A . 29 THR CB 1 1 11 6736 1 1 29 THR CG2 C -2.267 6.064 0.359 1.00 . A A . 29 THR CG2 1 1 11 6737 1 1 29 THR H H -1.974 3.164 1.056 1.00 . A A . 29 THR H 1 1 11 6738 1 1 29 THR HA H 0.394 3.975 -0.192 1.00 . A A . 29 THR HA 1 1 11 6739 1 1 29 THR HB H -2.004 4.411 -0.956 1.00 . A A . 29 THR HB 1 1 11 6740 1 1 29 THR HG1 H -0.299 6.685 -1.049 1.00 . A A . 29 THR HG1 1 1 11 6741 1 1 29 THR HG21 H -3.296 5.935 0.058 1.00 . A A . 29 THR HG21 1 1 11 6742 1 1 29 THR HG22 H -1.970 7.089 0.196 1.00 . A A . 29 THR HG22 1 1 11 6743 1 1 29 THR HG23 H -2.165 5.821 1.406 1.00 . A A . 29 THR HG23 1 1 11 6744 1 1 29 THR N N -1.012 3.316 1.169 1.00 . A A . 29 THR N 1 1 11 6745 1 1 29 THR O O 1.251 6.062 1.043 1.00 . A A . 29 THR O 1 1 11 6746 1 1 29 THR OG1 O -0.682 5.904 -1.456 1.00 . A A . 29 THR OG1 1 1 11 6747 1 1 30 GLN C C 1.528 5.907 4.198 1.00 . A A . 30 GLN C 1 1 11 6748 1 1 30 GLN CA C 0.232 6.435 3.594 1.00 . A A . 30 GLN CA 1 1 11 6749 1 1 30 GLN CB C -0.804 6.661 4.696 1.00 . A A . 30 GLN CB 1 1 11 6750 1 1 30 GLN CD C -1.616 5.953 6.982 1.00 . A A . 30 GLN CD 1 1 11 6751 1 1 30 GLN CG C -0.815 5.569 5.754 1.00 . A A . 30 GLN CG 1 1 11 6752 1 1 30 GLN H H -1.068 4.962 2.807 1.00 . A A . 30 GLN H 1 1 11 6753 1 1 30 GLN HA H 0.435 7.376 3.105 1.00 . A A . 30 GLN HA 1 1 11 6754 1 1 30 GLN HB2 H -0.596 7.602 5.183 1.00 . A A . 30 GLN HB2 1 1 11 6755 1 1 30 GLN HB3 H -1.786 6.706 4.247 1.00 . A A . 30 GLN HB3 1 1 11 6756 1 1 30 GLN HE21 H -3.314 5.752 5.966 1.00 . A A . 30 GLN HE21 1 1 11 6757 1 1 30 GLN HE22 H -3.479 6.224 7.620 1.00 . A A . 30 GLN HE22 1 1 11 6758 1 1 30 GLN HG2 H -1.246 4.675 5.327 1.00 . A A . 30 GLN HG2 1 1 11 6759 1 1 30 GLN HG3 H 0.203 5.367 6.054 1.00 . A A . 30 GLN HG3 1 1 11 6760 1 1 30 GLN N N -0.288 5.513 2.591 1.00 . A A . 30 GLN N 1 1 11 6761 1 1 30 GLN NE2 N -2.937 5.980 6.842 1.00 . A A . 30 GLN NE2 1 1 11 6762 1 1 30 GLN O O 2.465 6.667 4.446 1.00 . A A . 30 GLN O 1 1 11 6763 1 1 30 GLN OE1 O -1.055 6.223 8.044 1.00 . A A . 30 GLN OE1 1 1 11 6764 1 1 31 HIS C C 3.894 3.912 3.992 1.00 . A A . 31 HIS C 1 1 11 6765 1 1 31 HIS CA C 2.759 3.969 5.009 1.00 . A A . 31 HIS CA 1 1 11 6766 1 1 31 HIS CB C 2.425 2.559 5.497 1.00 . A A . 31 HIS CB 1 1 11 6767 1 1 31 HIS CD2 C 4.127 0.863 4.521 1.00 . A A . 31 HIS CD2 1 1 11 6768 1 1 31 HIS CE1 C 5.340 0.554 6.321 1.00 . A A . 31 HIS CE1 1 1 11 6769 1 1 31 HIS CG C 3.601 1.632 5.503 1.00 . A A . 31 HIS CG 1 1 11 6770 1 1 31 HIS H H 0.798 4.046 4.215 1.00 . A A . 31 HIS H 1 1 11 6771 1 1 31 HIS HA H 3.076 4.566 5.851 1.00 . A A . 31 HIS HA 1 1 11 6772 1 1 31 HIS HB2 H 2.043 2.615 6.506 1.00 . A A . 31 HIS HB2 1 1 11 6773 1 1 31 HIS HB3 H 1.668 2.132 4.855 1.00 . A A . 31 HIS HB3 1 1 11 6774 1 1 31 HIS HD1 H 4.256 1.832 7.495 1.00 . A A . 31 HIS HD1 1 1 11 6775 1 1 31 HIS HD2 H 3.765 0.783 3.506 1.00 . A A . 31 HIS HD2 1 1 11 6776 1 1 31 HIS HE1 H 6.101 0.197 6.998 1.00 . A A . 31 HIS HE1 1 1 11 6777 1 1 31 HIS N N 1.576 4.599 4.434 1.00 . A A . 31 HIS N 1 1 11 6778 1 1 31 HIS ND1 N 4.383 1.415 6.618 1.00 . A A . 31 HIS ND1 1 1 11 6779 1 1 31 HIS NE2 N 5.206 0.203 5.055 1.00 . A A . 31 HIS NE2 1 1 11 6780 1 1 31 HIS O O 5.039 4.236 4.307 1.00 . A A . 31 HIS O 1 1 11 6781 1 1 32 GLN C C 5.607 4.500 1.835 1.00 . A A . 32 GLN C 1 1 11 6782 1 1 32 GLN CA C 4.562 3.396 1.709 1.00 . A A . 32 GLN CA 1 1 11 6783 1 1 32 GLN CB C 3.884 3.473 0.340 1.00 . A A . 32 GLN CB 1 1 11 6784 1 1 32 GLN CD C 2.451 2.300 -1.379 1.00 . A A . 32 GLN CD 1 1 11 6785 1 1 32 GLN CG C 3.258 2.160 -0.103 1.00 . A A . 32 GLN CG 1 1 11 6786 1 1 32 GLN H H 2.639 3.253 2.582 1.00 . A A . 32 GLN H 1 1 11 6787 1 1 32 GLN HA H 5.053 2.440 1.804 1.00 . A A . 32 GLN HA 1 1 11 6788 1 1 32 GLN HB2 H 3.108 4.223 0.376 1.00 . A A . 32 GLN HB2 1 1 11 6789 1 1 32 GLN HB3 H 4.619 3.762 -0.397 1.00 . A A . 32 GLN HB3 1 1 11 6790 1 1 32 GLN HE21 H 1.937 0.381 -1.293 1.00 . A A . 32 GLN HE21 1 1 11 6791 1 1 32 GLN HE22 H 1.307 1.267 -2.635 1.00 . A A . 32 GLN HE22 1 1 11 6792 1 1 32 GLN HG2 H 4.044 1.439 -0.271 1.00 . A A . 32 GLN HG2 1 1 11 6793 1 1 32 GLN HG3 H 2.606 1.804 0.681 1.00 . A A . 32 GLN HG3 1 1 11 6794 1 1 32 GLN N N 3.568 3.497 2.772 1.00 . A A . 32 GLN N 1 1 11 6795 1 1 32 GLN NE2 N 1.837 1.205 -1.814 1.00 . A A . 32 GLN NE2 1 1 11 6796 1 1 32 GLN O O 6.779 4.297 1.518 1.00 . A A . 32 GLN O 1 1 11 6797 1 1 32 GLN OE1 O 2.379 3.379 -1.967 1.00 . A A . 32 GLN OE1 1 1 11 6798 1 1 33 ARG C C 7.354 6.385 3.177 1.00 . A A . 33 ARG C 1 1 11 6799 1 1 33 ARG CA C 6.072 6.804 2.464 1.00 . A A . 33 ARG CA 1 1 11 6800 1 1 33 ARG CB C 5.379 7.919 3.250 1.00 . A A . 33 ARG CB 1 1 11 6801 1 1 33 ARG CD C 3.982 10.006 3.181 1.00 . A A . 33 ARG CD 1 1 11 6802 1 1 33 ARG CG C 4.502 8.815 2.392 1.00 . A A . 33 ARG CG 1 1 11 6803 1 1 33 ARG CZ C 4.987 11.973 4.261 1.00 . A A . 33 ARG CZ 1 1 11 6804 1 1 33 ARG H H 4.228 5.768 2.534 1.00 . A A . 33 ARG H 1 1 11 6805 1 1 33 ARG HA H 6.325 7.173 1.481 1.00 . A A . 33 ARG HA 1 1 11 6806 1 1 33 ARG HB2 H 4.761 7.473 4.015 1.00 . A A . 33 ARG HB2 1 1 11 6807 1 1 33 ARG HB3 H 6.133 8.533 3.720 1.00 . A A . 33 ARG HB3 1 1 11 6808 1 1 33 ARG HD2 H 3.107 10.397 2.683 1.00 . A A . 33 ARG HD2 1 1 11 6809 1 1 33 ARG HD3 H 3.714 9.675 4.173 1.00 . A A . 33 ARG HD3 1 1 11 6810 1 1 33 ARG HE H 5.676 11.108 2.601 1.00 . A A . 33 ARG HE 1 1 11 6811 1 1 33 ARG HG2 H 5.081 9.176 1.555 1.00 . A A . 33 ARG HG2 1 1 11 6812 1 1 33 ARG HG3 H 3.662 8.240 2.030 1.00 . A A . 33 ARG HG3 1 1 11 6813 1 1 33 ARG HH11 H 3.347 11.240 5.186 1.00 . A A . 33 ARG HH11 1 1 11 6814 1 1 33 ARG HH12 H 4.066 12.626 5.937 1.00 . A A . 33 ARG HH12 1 1 11 6815 1 1 33 ARG HH21 H 6.631 12.933 3.581 1.00 . A A . 33 ARG HH21 1 1 11 6816 1 1 33 ARG HH22 H 5.933 13.589 5.023 1.00 . A A . 33 ARG HH22 1 1 11 6817 1 1 33 ARG N N 5.174 5.668 2.298 1.00 . A A . 33 ARG N 1 1 11 6818 1 1 33 ARG NE N 4.979 11.068 3.289 1.00 . A A . 33 ARG NE 1 1 11 6819 1 1 33 ARG NH1 N 4.057 11.944 5.205 1.00 . A A . 33 ARG NH1 1 1 11 6820 1 1 33 ARG NH2 N 5.928 12.908 4.291 1.00 . A A . 33 ARG NH2 1 1 11 6821 1 1 33 ARG O O 8.458 6.678 2.717 1.00 . A A . 33 ARG O 1 1 11 6822 1 1 34 VAL C C 9.473 4.765 4.172 1.00 . A A . 34 VAL C 1 1 11 6823 1 1 34 VAL CA C 8.344 5.237 5.082 1.00 . A A . 34 VAL CA 1 1 11 6824 1 1 34 VAL CB C 7.952 4.089 6.032 1.00 . A A . 34 VAL CB 1 1 11 6825 1 1 34 VAL CG1 C 6.924 4.564 7.047 1.00 . A A . 34 VAL CG1 1 1 11 6826 1 1 34 VAL CG2 C 7.426 2.901 5.242 1.00 . A A . 34 VAL CG2 1 1 11 6827 1 1 34 VAL H H 6.295 5.494 4.621 1.00 . A A . 34 VAL H 1 1 11 6828 1 1 34 VAL HA H 8.698 6.065 5.679 1.00 . A A . 34 VAL HA 1 1 11 6829 1 1 34 VAL HB H 8.836 3.775 6.568 1.00 . A A . 34 VAL HB 1 1 11 6830 1 1 34 VAL HG11 H 6.000 4.800 6.539 1.00 . A A . 34 VAL HG11 1 1 11 6831 1 1 34 VAL HG12 H 6.747 3.783 7.772 1.00 . A A . 34 VAL HG12 1 1 11 6832 1 1 34 VAL HG13 H 7.294 5.446 7.548 1.00 . A A . 34 VAL HG13 1 1 11 6833 1 1 34 VAL HG21 H 7.894 1.995 5.597 1.00 . A A . 34 VAL HG21 1 1 11 6834 1 1 34 VAL HG22 H 6.356 2.828 5.372 1.00 . A A . 34 VAL HG22 1 1 11 6835 1 1 34 VAL HG23 H 7.652 3.035 4.194 1.00 . A A . 34 VAL HG23 1 1 11 6836 1 1 34 VAL N N 7.200 5.697 4.305 1.00 . A A . 34 VAL N 1 1 11 6837 1 1 34 VAL O O 10.645 4.809 4.545 1.00 . A A . 34 VAL O 1 1 11 6838 1 1 35 HIS C C 10.412 4.914 0.977 1.00 . A A . 35 HIS C 1 1 11 6839 1 1 35 HIS CA C 10.094 3.836 2.009 1.00 . A A . 35 HIS CA 1 1 11 6840 1 1 35 HIS CB C 9.581 2.578 1.308 1.00 . A A . 35 HIS CB 1 1 11 6841 1 1 35 HIS CD2 C 7.725 1.066 2.306 1.00 . A A . 35 HIS CD2 1 1 11 6842 1 1 35 HIS CE1 C 8.893 0.145 3.917 1.00 . A A . 35 HIS CE1 1 1 11 6843 1 1 35 HIS CG C 8.977 1.575 2.243 1.00 . A A . 35 HIS CG 1 1 11 6844 1 1 35 HIS H H 8.161 4.304 2.735 1.00 . A A . 35 HIS H 1 1 11 6845 1 1 35 HIS HA H 10.997 3.594 2.548 1.00 . A A . 35 HIS HA 1 1 11 6846 1 1 35 HIS HB2 H 8.825 2.858 0.589 1.00 . A A . 35 HIS HB2 1 1 11 6847 1 1 35 HIS HB3 H 10.401 2.100 0.793 1.00 . A A . 35 HIS HB3 1 1 11 6848 1 1 35 HIS HD1 H 10.625 1.142 3.481 1.00 . A A . 35 HIS HD1 1 1 11 6849 1 1 35 HIS HD2 H 6.899 1.310 1.653 1.00 . A A . 35 HIS HD2 1 1 11 6850 1 1 35 HIS HE1 H 9.174 -0.461 4.765 1.00 . A A . 35 HIS HE1 1 1 11 6851 1 1 35 HIS N N 9.111 4.315 2.975 1.00 . A A . 35 HIS N 1 1 11 6852 1 1 35 HIS ND1 N 9.684 0.979 3.266 1.00 . A A . 35 HIS ND1 1 1 11 6853 1 1 35 HIS NE2 N 7.698 0.179 3.355 1.00 . A A . 35 HIS NE2 1 1 11 6854 1 1 35 HIS O O 9.551 5.306 0.189 1.00 . A A . 35 HIS O 1 1 11 6855 1 1 36 SER C C 11.445 6.222 -1.314 1.00 . A A . 36 SER C 1 1 11 6856 1 1 36 SER CA C 12.083 6.425 0.057 1.00 . A A . 36 SER CA 1 1 11 6857 1 1 36 SER CB C 13.608 6.424 -0.073 1.00 . A A . 36 SER CB 1 1 11 6858 1 1 36 SER H H 12.294 5.037 1.641 1.00 . A A . 36 SER H 1 1 11 6859 1 1 36 SER HA H 11.765 7.379 0.452 1.00 . A A . 36 SER HA 1 1 11 6860 1 1 36 SER HB2 H 13.901 7.114 -0.848 1.00 . A A . 36 SER HB2 1 1 11 6861 1 1 36 SER HB3 H 14.046 6.729 0.866 1.00 . A A . 36 SER HB3 1 1 11 6862 1 1 36 SER HG H 14.401 5.130 -1.312 1.00 . A A . 36 SER HG 1 1 11 6863 1 1 36 SER N N 11.653 5.389 0.989 1.00 . A A . 36 SER N 1 1 11 6864 1 1 36 SER O O 11.471 5.124 -1.867 1.00 . A A . 36 SER O 1 1 11 6865 1 1 36 SER OG O 14.090 5.133 -0.404 1.00 . A A . 36 SER OG 1 1 11 6866 1 1 37 GLY C C 10.957 8.028 -4.210 1.00 . A A . 37 GLY C 1 1 11 6867 1 1 37 GLY CA C 10.233 7.212 -3.158 1.00 . A A . 37 GLY CA 1 1 11 6868 1 1 37 GLY H H 10.881 8.143 -1.370 1.00 . A A . 37 GLY H 1 1 11 6869 1 1 37 GLY HA2 H 10.210 6.179 -3.472 1.00 . A A . 37 GLY HA2 1 1 11 6870 1 1 37 GLY HA3 H 9.220 7.574 -3.072 1.00 . A A . 37 GLY HA3 1 1 11 6871 1 1 37 GLY N N 10.871 7.292 -1.857 1.00 . A A . 37 GLY N 1 1 11 6872 1 1 37 GLY O O 12.112 8.410 -4.022 1.00 . A A . 37 GLY O 1 1 11 6873 1 1 38 GLU C C 12.327 8.685 -6.621 1.00 . A A . 38 GLU C 1 1 11 6874 1 1 38 GLU CA C 10.866 9.069 -6.408 1.00 . A A . 38 GLU CA 1 1 11 6875 1 1 38 GLU CB C 10.759 10.567 -6.113 1.00 . A A . 38 GLU CB 1 1 11 6876 1 1 38 GLU CD C 9.185 12.264 -5.101 1.00 . A A . 38 GLU CD 1 1 11 6877 1 1 38 GLU CG C 9.327 11.068 -6.023 1.00 . A A . 38 GLU CG 1 1 11 6878 1 1 38 GLU H H 9.361 7.962 -5.412 1.00 . A A . 38 GLU H 1 1 11 6879 1 1 38 GLU HA H 10.313 8.849 -7.309 1.00 . A A . 38 GLU HA 1 1 11 6880 1 1 38 GLU HB2 H 11.250 10.772 -5.173 1.00 . A A . 38 GLU HB2 1 1 11 6881 1 1 38 GLU HB3 H 11.260 11.112 -6.898 1.00 . A A . 38 GLU HB3 1 1 11 6882 1 1 38 GLU HG2 H 8.997 11.354 -7.011 1.00 . A A . 38 GLU HG2 1 1 11 6883 1 1 38 GLU HG3 H 8.702 10.270 -5.653 1.00 . A A . 38 GLU HG3 1 1 11 6884 1 1 38 GLU N N 10.278 8.295 -5.321 1.00 . A A . 38 GLU N 1 1 11 6885 1 1 38 GLU O O 13.183 9.544 -6.833 1.00 . A A . 38 GLU O 1 1 11 6886 1 1 38 GLU OE1 O 9.559 13.380 -5.516 1.00 . A A . 38 GLU OE1 1 1 11 6887 1 1 38 GLU OE2 O 8.700 12.082 -3.965 1.00 . A A . 38 GLU OE2 1 1 11 6888 1 1 39 LYS C C 14.425 7.093 -8.189 1.00 . A A . 39 LYS C 1 1 11 6889 1 1 39 LYS CA C 13.963 6.886 -6.750 1.00 . A A . 39 LYS CA 1 1 11 6890 1 1 39 LYS CB C 14.035 5.401 -6.388 1.00 . A A . 39 LYS CB 1 1 11 6891 1 1 39 LYS CD C 13.604 4.019 -8.441 1.00 . A A . 39 LYS CD 1 1 11 6892 1 1 39 LYS CE C 12.525 3.410 -9.322 1.00 . A A . 39 LYS CE 1 1 11 6893 1 1 39 LYS CG C 13.029 4.543 -7.136 1.00 . A A . 39 LYS CG 1 1 11 6894 1 1 39 LYS H H 11.881 6.750 -6.391 1.00 . A A . 39 LYS H 1 1 11 6895 1 1 39 LYS HA H 14.615 7.440 -6.092 1.00 . A A . 39 LYS HA 1 1 11 6896 1 1 39 LYS HB2 H 15.026 5.036 -6.613 1.00 . A A . 39 LYS HB2 1 1 11 6897 1 1 39 LYS HB3 H 13.852 5.292 -5.329 1.00 . A A . 39 LYS HB3 1 1 11 6898 1 1 39 LYS HD2 H 14.069 4.836 -8.974 1.00 . A A . 39 LYS HD2 1 1 11 6899 1 1 39 LYS HD3 H 14.345 3.264 -8.220 1.00 . A A . 39 LYS HD3 1 1 11 6900 1 1 39 LYS HE2 H 11.882 2.796 -8.709 1.00 . A A . 39 LYS HE2 1 1 11 6901 1 1 39 LYS HE3 H 11.946 4.208 -9.763 1.00 . A A . 39 LYS HE3 1 1 11 6902 1 1 39 LYS HG2 H 12.752 3.705 -6.515 1.00 . A A . 39 LYS HG2 1 1 11 6903 1 1 39 LYS HG3 H 12.153 5.138 -7.353 1.00 . A A . 39 LYS HG3 1 1 11 6904 1 1 39 LYS HZ1 H 14.136 2.514 -10.305 1.00 . A A . 39 LYS HZ1 1 1 11 6905 1 1 39 LYS HZ2 H 12.880 2.987 -11.336 1.00 . A A . 39 LYS HZ2 1 1 11 6906 1 1 39 LYS HZ3 H 12.706 1.611 -10.368 1.00 . A A . 39 LYS HZ3 1 1 11 6907 1 1 39 LYS N N 12.606 7.387 -6.563 1.00 . A A . 39 LYS N 1 1 11 6908 1 1 39 LYS NZ N 13.102 2.572 -10.409 1.00 . A A . 39 LYS NZ 1 1 11 6909 1 1 39 LYS O O 13.649 6.981 -9.138 1.00 . A A . 39 LYS O 1 1 11 6910 1 1 40 PRO C C 16.412 6.344 -10.497 1.00 . A A . 40 PRO C 1 1 11 6911 1 1 40 PRO CA C 16.315 7.626 -9.677 1.00 . A A . 40 PRO CA 1 1 11 6912 1 1 40 PRO CB C 17.713 8.159 -9.350 1.00 . A A . 40 PRO CB 1 1 11 6913 1 1 40 PRO CD C 16.703 7.550 -7.271 1.00 . A A . 40 PRO CD 1 1 11 6914 1 1 40 PRO CG C 18.018 7.615 -7.997 1.00 . A A . 40 PRO CG 1 1 11 6915 1 1 40 PRO HA H 15.767 8.370 -10.237 1.00 . A A . 40 PRO HA 1 1 11 6916 1 1 40 PRO HB2 H 18.418 7.803 -10.088 1.00 . A A . 40 PRO HB2 1 1 11 6917 1 1 40 PRO HB3 H 17.699 9.238 -9.348 1.00 . A A . 40 PRO HB3 1 1 11 6918 1 1 40 PRO HD2 H 16.679 6.697 -6.609 1.00 . A A . 40 PRO HD2 1 1 11 6919 1 1 40 PRO HD3 H 16.531 8.462 -6.719 1.00 . A A . 40 PRO HD3 1 1 11 6920 1 1 40 PRO HG2 H 18.447 6.629 -8.086 1.00 . A A . 40 PRO HG2 1 1 11 6921 1 1 40 PRO HG3 H 18.698 8.276 -7.481 1.00 . A A . 40 PRO HG3 1 1 11 6922 1 1 40 PRO N N 15.720 7.400 -8.357 1.00 . A A . 40 PRO N 1 1 11 6923 1 1 40 PRO O O 16.715 6.380 -11.689 1.00 . A A . 40 PRO O 1 1 11 6924 1 1 41 SER C C 17.647 3.581 -10.920 1.00 . A A . 41 SER C 1 1 11 6925 1 1 41 SER CA C 16.214 3.918 -10.518 1.00 . A A . 41 SER CA 1 1 11 6926 1 1 41 SER CB C 15.313 3.915 -11.754 1.00 . A A . 41 SER CB 1 1 11 6927 1 1 41 SER H H 15.917 5.249 -8.899 1.00 . A A . 41 SER H 1 1 11 6928 1 1 41 SER HA H 15.862 3.169 -9.824 1.00 . A A . 41 SER HA 1 1 11 6929 1 1 41 SER HB2 H 14.322 4.238 -11.474 1.00 . A A . 41 SER HB2 1 1 11 6930 1 1 41 SER HB3 H 15.717 4.593 -12.493 1.00 . A A . 41 SER HB3 1 1 11 6931 1 1 41 SER HG H 16.112 2.280 -12.477 1.00 . A A . 41 SER HG 1 1 11 6932 1 1 41 SER N N 16.153 5.212 -9.850 1.00 . A A . 41 SER N 1 1 11 6933 1 1 41 SER O O 17.898 3.104 -12.025 1.00 . A A . 41 SER O 1 1 11 6934 1 1 41 SER OG O 15.228 2.619 -12.321 1.00 . A A . 41 SER OG 1 1 11 6935 1 1 42 GLY C C 20.189 2.171 -10.874 1.00 . A A . 42 GLY C 1 1 11 6936 1 1 42 GLY CA C 19.981 3.553 -10.288 1.00 . A A . 42 GLY CA 1 1 11 6937 1 1 42 GLY H H 18.326 4.217 -9.146 1.00 . A A . 42 GLY H 1 1 11 6938 1 1 42 GLY HA2 H 20.354 4.289 -10.986 1.00 . A A . 42 GLY HA2 1 1 11 6939 1 1 42 GLY HA3 H 20.541 3.629 -9.368 1.00 . A A . 42 GLY HA3 1 1 11 6940 1 1 42 GLY N N 18.585 3.835 -10.011 1.00 . A A . 42 GLY N 1 1 11 6941 1 1 42 GLY O O 19.471 1.223 -10.554 1.00 . A A . 42 GLY O 1 1 11 6942 1 1 43 PRO C C 22.108 -0.245 -11.436 1.00 . A A . 43 PRO C 1 1 11 6943 1 1 43 PRO CA C 21.514 0.769 -12.408 1.00 . A A . 43 PRO CA 1 1 11 6944 1 1 43 PRO CB C 22.547 1.164 -13.466 1.00 . A A . 43 PRO CB 1 1 11 6945 1 1 43 PRO CD C 22.087 3.129 -12.185 1.00 . A A . 43 PRO CD 1 1 11 6946 1 1 43 PRO CG C 23.171 2.410 -12.940 1.00 . A A . 43 PRO CG 1 1 11 6947 1 1 43 PRO HA H 20.648 0.340 -12.890 1.00 . A A . 43 PRO HA 1 1 11 6948 1 1 43 PRO HB2 H 23.274 0.372 -13.575 1.00 . A A . 43 PRO HB2 1 1 11 6949 1 1 43 PRO HB3 H 22.052 1.339 -14.410 1.00 . A A . 43 PRO HB3 1 1 11 6950 1 1 43 PRO HD2 H 22.501 3.647 -11.332 1.00 . A A . 43 PRO HD2 1 1 11 6951 1 1 43 PRO HD3 H 21.570 3.821 -12.834 1.00 . A A . 43 PRO HD3 1 1 11 6952 1 1 43 PRO HG2 H 23.987 2.161 -12.279 1.00 . A A . 43 PRO HG2 1 1 11 6953 1 1 43 PRO HG3 H 23.523 3.019 -13.760 1.00 . A A . 43 PRO HG3 1 1 11 6954 1 1 43 PRO N N 21.191 2.042 -11.756 1.00 . A A . 43 PRO N 1 1 11 6955 1 1 43 PRO O O 22.476 -1.352 -11.828 1.00 . A A . 43 PRO O 1 1 11 6956 1 1 44 SER C C 24.085 -1.322 -9.587 1.00 . A A . 44 SER C 1 1 11 6957 1 1 44 SER CA C 22.750 -0.735 -9.140 1.00 . A A . 44 SER CA 1 1 11 6958 1 1 44 SER CB C 21.767 -1.862 -8.817 1.00 . A A . 44 SER CB 1 1 11 6959 1 1 44 SER H H 21.887 1.036 -9.917 1.00 . A A . 44 SER H 1 1 11 6960 1 1 44 SER HA H 22.910 -0.143 -8.251 1.00 . A A . 44 SER HA 1 1 11 6961 1 1 44 SER HB2 H 21.682 -2.518 -9.671 1.00 . A A . 44 SER HB2 1 1 11 6962 1 1 44 SER HB3 H 22.131 -2.422 -7.968 1.00 . A A . 44 SER HB3 1 1 11 6963 1 1 44 SER HG H 20.163 -1.750 -7.699 1.00 . A A . 44 SER HG 1 1 11 6964 1 1 44 SER N N 22.198 0.140 -10.167 1.00 . A A . 44 SER N 1 1 11 6965 1 1 44 SER O O 24.368 -2.498 -9.356 1.00 . A A . 44 SER O 1 1 11 6966 1 1 44 SER OG O 20.484 -1.346 -8.509 1.00 . A A . 44 SER OG 1 1 11 6967 1 1 45 SER C C 26.119 -2.322 -11.334 1.00 . A A . 45 SER C 1 1 11 6968 1 1 45 SER CA C 26.208 -0.931 -10.714 1.00 . A A . 45 SER CA 1 1 11 6969 1 1 45 SER CB C 27.224 -0.934 -9.571 1.00 . A A . 45 SER CB 1 1 11 6970 1 1 45 SER H H 24.621 0.432 -10.384 1.00 . A A . 45 SER H 1 1 11 6971 1 1 45 SER HA H 26.531 -0.232 -11.470 1.00 . A A . 45 SER HA 1 1 11 6972 1 1 45 SER HB2 H 26.828 -1.500 -8.741 1.00 . A A . 45 SER HB2 1 1 11 6973 1 1 45 SER HB3 H 28.143 -1.390 -9.911 1.00 . A A . 45 SER HB3 1 1 11 6974 1 1 45 SER HG H 26.826 0.665 -8.512 1.00 . A A . 45 SER HG 1 1 11 6975 1 1 45 SER N N 24.903 -0.494 -10.230 1.00 . A A . 45 SER N 1 1 11 6976 1 1 45 SER O O 26.991 -3.165 -11.125 1.00 . A A . 45 SER O 1 1 11 6977 1 1 45 SER OG O 27.503 0.384 -9.132 1.00 . A A . 45 SER OG 1 1 11 6978 1 1 46 GLY C C 24.465 -3.717 -14.194 1.00 . A A . 46 GLY C 1 1 11 6979 1 1 46 GLY CA C 24.873 -3.845 -12.740 1.00 . A A . 46 GLY CA 1 1 11 6980 1 1 46 GLY H H 24.394 -1.846 -12.232 1.00 . A A . 46 GLY H 1 1 11 6981 1 1 46 GLY HA2 H 25.798 -4.398 -12.683 1.00 . A A . 46 GLY HA2 1 1 11 6982 1 1 46 GLY HA3 H 24.106 -4.390 -12.210 1.00 . A A . 46 GLY HA3 1 1 11 6983 1 1 46 GLY N N 25.057 -2.555 -12.100 1.00 . A A . 46 GLY N 1 1 11 6984 1 1 46 GLY O O 24.848 -4.564 -15.000 1.00 . A A . 46 GLY O 1 1 11 6985 2 2 1 ZN ZN ZN 6.181 -1.033 3.700 1.00 . B A . 181 ZN ZN 1 1 12 6986 1 1 1 GLY C C 5.075 -19.165 4.764 1.00 . A A . 1 GLY C 1 1 12 6987 1 1 1 GLY CA C 6.054 -19.348 5.906 1.00 . A A . 1 GLY CA 1 1 12 6988 1 1 1 GLY H1 H 8.054 -18.984 5.311 1.00 . A A . 1 GLY H1 1 1 12 6989 1 1 1 GLY HA2 H 5.696 -20.135 6.552 1.00 . A A . 1 GLY HA2 1 1 12 6990 1 1 1 GLY HA3 H 6.107 -18.428 6.471 1.00 . A A . 1 GLY HA3 1 1 12 6991 1 1 1 GLY N N 7.387 -19.690 5.445 1.00 . A A . 1 GLY N 1 1 12 6992 1 1 1 GLY O O 5.462 -19.187 3.596 1.00 . A A . 1 GLY O 1 1 12 6993 1 1 2 SER C C 1.483 -18.263 4.727 1.00 . A A . 2 SER C 1 1 12 6994 1 1 2 SER CA C 2.763 -18.802 4.095 1.00 . A A . 2 SER CA 1 1 12 6995 1 1 2 SER CB C 2.476 -20.125 3.383 1.00 . A A . 2 SER CB 1 1 12 6996 1 1 2 SER H H 3.556 -18.975 6.050 1.00 . A A . 2 SER H 1 1 12 6997 1 1 2 SER HA H 3.123 -18.084 3.373 1.00 . A A . 2 SER HA 1 1 12 6998 1 1 2 SER HB2 H 3.372 -20.466 2.888 1.00 . A A . 2 SER HB2 1 1 12 6999 1 1 2 SER HB3 H 2.162 -20.861 4.109 1.00 . A A . 2 SER HB3 1 1 12 7000 1 1 2 SER HG H 0.652 -19.653 2.844 1.00 . A A . 2 SER HG 1 1 12 7001 1 1 2 SER N N 3.802 -18.984 5.102 1.00 . A A . 2 SER N 1 1 12 7002 1 1 2 SER O O 1.168 -18.570 5.877 1.00 . A A . 2 SER O 1 1 12 7003 1 1 2 SER OG O 1.451 -19.972 2.416 1.00 . A A . 2 SER OG 1 1 12 7004 1 1 3 SER C C -1.465 -16.623 3.300 1.00 . A A . 3 SER C 1 1 12 7005 1 1 3 SER CA C -0.496 -16.872 4.452 1.00 . A A . 3 SER CA 1 1 12 7006 1 1 3 SER CB C -0.214 -15.562 5.189 1.00 . A A . 3 SER CB 1 1 12 7007 1 1 3 SER H H 1.052 -17.251 3.058 1.00 . A A . 3 SER H 1 1 12 7008 1 1 3 SER HA H -0.946 -17.573 5.140 1.00 . A A . 3 SER HA 1 1 12 7009 1 1 3 SER HB2 H -1.110 -15.236 5.694 1.00 . A A . 3 SER HB2 1 1 12 7010 1 1 3 SER HB3 H 0.571 -15.721 5.914 1.00 . A A . 3 SER HB3 1 1 12 7011 1 1 3 SER HG H -0.220 -13.717 4.529 1.00 . A A . 3 SER HG 1 1 12 7012 1 1 3 SER N N 0.748 -17.458 3.966 1.00 . A A . 3 SER N 1 1 12 7013 1 1 3 SER O O -1.136 -16.853 2.137 1.00 . A A . 3 SER O 1 1 12 7014 1 1 3 SER OG O 0.196 -14.548 4.288 1.00 . A A . 3 SER OG 1 1 12 7015 1 1 4 GLY C C -5.042 -16.359 3.018 1.00 . A A . 4 GLY C 1 1 12 7016 1 1 4 GLY CA C -3.661 -15.877 2.617 1.00 . A A . 4 GLY CA 1 1 12 7017 1 1 4 GLY H H -2.869 -15.986 4.578 1.00 . A A . 4 GLY H 1 1 12 7018 1 1 4 GLY HA2 H -3.699 -14.813 2.442 1.00 . A A . 4 GLY HA2 1 1 12 7019 1 1 4 GLY HA3 H -3.372 -16.373 1.702 1.00 . A A . 4 GLY HA3 1 1 12 7020 1 1 4 GLY N N -2.662 -16.150 3.634 1.00 . A A . 4 GLY N 1 1 12 7021 1 1 4 GLY O O -5.425 -17.488 2.715 1.00 . A A . 4 GLY O 1 1 12 7022 1 1 5 SER C C -8.121 -15.809 2.986 1.00 . A A . 5 SER C 1 1 12 7023 1 1 5 SER CA C -7.135 -15.845 4.150 1.00 . A A . 5 SER CA 1 1 12 7024 1 1 5 SER CB C -7.591 -14.886 5.250 1.00 . A A . 5 SER CB 1 1 12 7025 1 1 5 SER H H -5.429 -14.614 3.914 1.00 . A A . 5 SER H 1 1 12 7026 1 1 5 SER HA H -7.104 -16.848 4.549 1.00 . A A . 5 SER HA 1 1 12 7027 1 1 5 SER HB2 H -8.582 -15.163 5.578 1.00 . A A . 5 SER HB2 1 1 12 7028 1 1 5 SER HB3 H -6.906 -14.946 6.084 1.00 . A A . 5 SER HB3 1 1 12 7029 1 1 5 SER HG H -7.631 -13.547 3.820 1.00 . A A . 5 SER HG 1 1 12 7030 1 1 5 SER N N -5.791 -15.500 3.702 1.00 . A A . 5 SER N 1 1 12 7031 1 1 5 SER O O -7.922 -15.084 2.012 1.00 . A A . 5 SER O 1 1 12 7032 1 1 5 SER OG O -7.623 -13.549 4.780 1.00 . A A . 5 SER OG 1 1 12 7033 1 1 6 SER C C -11.543 -16.145 2.569 1.00 . A A . 6 SER C 1 1 12 7034 1 1 6 SER CA C -10.202 -16.659 2.053 1.00 . A A . 6 SER CA 1 1 12 7035 1 1 6 SER CB C -10.355 -18.094 1.545 1.00 . A A . 6 SER CB 1 1 12 7036 1 1 6 SER H H -9.289 -17.152 3.898 1.00 . A A . 6 SER H 1 1 12 7037 1 1 6 SER HA H -9.879 -16.030 1.237 1.00 . A A . 6 SER HA 1 1 12 7038 1 1 6 SER HB2 H -11.124 -18.125 0.789 1.00 . A A . 6 SER HB2 1 1 12 7039 1 1 6 SER HB3 H -9.418 -18.424 1.119 1.00 . A A . 6 SER HB3 1 1 12 7040 1 1 6 SER HG H -10.619 -18.519 3.439 1.00 . A A . 6 SER HG 1 1 12 7041 1 1 6 SER N N -9.186 -16.597 3.097 1.00 . A A . 6 SER N 1 1 12 7042 1 1 6 SER O O -12.592 -16.724 2.289 1.00 . A A . 6 SER O 1 1 12 7043 1 1 6 SER OG O -10.713 -18.972 2.598 1.00 . A A . 6 SER OG 1 1 12 7044 1 1 7 GLY C C -12.477 -13.742 5.173 1.00 . A A . 7 GLY C 1 1 12 7045 1 1 7 GLY CA C -12.716 -14.478 3.869 1.00 . A A . 7 GLY CA 1 1 12 7046 1 1 7 GLY H H -10.634 -14.633 3.516 1.00 . A A . 7 GLY H 1 1 12 7047 1 1 7 GLY HA2 H -13.128 -13.788 3.149 1.00 . A A . 7 GLY HA2 1 1 12 7048 1 1 7 GLY HA3 H -13.429 -15.271 4.043 1.00 . A A . 7 GLY HA3 1 1 12 7049 1 1 7 GLY N N -11.499 -15.052 3.326 1.00 . A A . 7 GLY N 1 1 12 7050 1 1 7 GLY O O -11.338 -13.422 5.516 1.00 . A A . 7 GLY O 1 1 12 7051 1 1 8 THR C C -12.540 -11.552 7.063 1.00 . A A . 8 THR C 1 1 12 7052 1 1 8 THR CA C -13.457 -12.765 7.175 1.00 . A A . 8 THR CA 1 1 12 7053 1 1 8 THR CB C -12.934 -13.688 8.291 1.00 . A A . 8 THR CB 1 1 12 7054 1 1 8 THR CG2 C -13.042 -13.011 9.649 1.00 . A A . 8 THR CG2 1 1 12 7055 1 1 8 THR H H -14.435 -13.750 5.577 1.00 . A A . 8 THR H 1 1 12 7056 1 1 8 THR HA H -14.448 -12.430 7.447 1.00 . A A . 8 THR HA 1 1 12 7057 1 1 8 THR HB H -11.895 -13.909 8.097 1.00 . A A . 8 THR HB 1 1 12 7058 1 1 8 THR HG1 H -14.026 -15.084 7.424 1.00 . A A . 8 THR HG1 1 1 12 7059 1 1 8 THR HG21 H -13.196 -13.758 10.413 1.00 . A A . 8 THR HG21 1 1 12 7060 1 1 8 THR HG22 H -13.876 -12.325 9.644 1.00 . A A . 8 THR HG22 1 1 12 7061 1 1 8 THR HG23 H -12.131 -12.468 9.854 1.00 . A A . 8 THR HG23 1 1 12 7062 1 1 8 THR N N -13.554 -13.470 5.903 1.00 . A A . 8 THR N 1 1 12 7063 1 1 8 THR O O -11.759 -11.266 7.969 1.00 . A A . 8 THR O 1 1 12 7064 1 1 8 THR OG1 O -13.678 -14.912 8.303 1.00 . A A . 8 THR OG1 1 1 12 7065 1 1 9 GLY C C -11.012 -9.744 4.450 1.00 . A A . 9 GLY C 1 1 12 7066 1 1 9 GLY CA C -11.814 -9.667 5.734 1.00 . A A . 9 GLY CA 1 1 12 7067 1 1 9 GLY H H -13.281 -11.116 5.255 1.00 . A A . 9 GLY H 1 1 12 7068 1 1 9 GLY HA2 H -12.449 -8.795 5.698 1.00 . A A . 9 GLY HA2 1 1 12 7069 1 1 9 GLY HA3 H -11.131 -9.569 6.565 1.00 . A A . 9 GLY HA3 1 1 12 7070 1 1 9 GLY N N -12.640 -10.841 5.944 1.00 . A A . 9 GLY N 1 1 12 7071 1 1 9 GLY O O -10.673 -10.833 3.987 1.00 . A A . 9 GLY O 1 1 12 7072 1 1 10 GLU C C -8.640 -7.763 2.833 1.00 . A A . 10 GLU C 1 1 12 7073 1 1 10 GLU CA C -9.945 -8.527 2.632 1.00 . A A . 10 GLU CA 1 1 12 7074 1 1 10 GLU CB C -10.772 -7.865 1.528 1.00 . A A . 10 GLU CB 1 1 12 7075 1 1 10 GLU CD C -12.120 -5.847 0.829 1.00 . A A . 10 GLU CD 1 1 12 7076 1 1 10 GLU CG C -11.114 -6.412 1.812 1.00 . A A . 10 GLU CG 1 1 12 7077 1 1 10 GLU H H -11.009 -7.750 4.290 1.00 . A A . 10 GLU H 1 1 12 7078 1 1 10 GLU HA H -9.714 -9.540 2.337 1.00 . A A . 10 GLU HA 1 1 12 7079 1 1 10 GLU HB2 H -10.216 -7.909 0.603 1.00 . A A . 10 GLU HB2 1 1 12 7080 1 1 10 GLU HB3 H -11.695 -8.413 1.409 1.00 . A A . 10 GLU HB3 1 1 12 7081 1 1 10 GLU HG2 H -11.526 -6.340 2.807 1.00 . A A . 10 GLU HG2 1 1 12 7082 1 1 10 GLU HG3 H -10.209 -5.825 1.755 1.00 . A A . 10 GLU HG3 1 1 12 7083 1 1 10 GLU N N -10.710 -8.585 3.872 1.00 . A A . 10 GLU N 1 1 12 7084 1 1 10 GLU O O -8.642 -6.611 3.267 1.00 . A A . 10 GLU O 1 1 12 7085 1 1 10 GLU OE1 O -13.227 -6.415 0.721 1.00 . A A . 10 GLU OE1 1 1 12 7086 1 1 10 GLU OE2 O -11.802 -4.837 0.167 1.00 . A A . 10 GLU OE2 1 1 12 7087 1 1 11 LYS C C -5.423 -7.889 1.357 1.00 . A A . 11 LYS C 1 1 12 7088 1 1 11 LYS CA C -6.212 -7.798 2.659 1.00 . A A . 11 LYS CA 1 1 12 7089 1 1 11 LYS CB C -5.431 -8.471 3.790 1.00 . A A . 11 LYS CB 1 1 12 7090 1 1 11 LYS CD C -4.693 -10.612 4.878 1.00 . A A . 11 LYS CD 1 1 12 7091 1 1 11 LYS CE C -3.197 -10.758 4.641 1.00 . A A . 11 LYS CE 1 1 12 7092 1 1 11 LYS CG C -5.387 -9.986 3.680 1.00 . A A . 11 LYS CG 1 1 12 7093 1 1 11 LYS H H -7.589 -9.331 2.174 1.00 . A A . 11 LYS H 1 1 12 7094 1 1 11 LYS HA H -6.359 -6.757 2.905 1.00 . A A . 11 LYS HA 1 1 12 7095 1 1 11 LYS HB2 H -4.417 -8.101 3.781 1.00 . A A . 11 LYS HB2 1 1 12 7096 1 1 11 LYS HB3 H -5.891 -8.213 4.733 1.00 . A A . 11 LYS HB3 1 1 12 7097 1 1 11 LYS HD2 H -4.849 -9.984 5.742 1.00 . A A . 11 LYS HD2 1 1 12 7098 1 1 11 LYS HD3 H -5.117 -11.589 5.058 1.00 . A A . 11 LYS HD3 1 1 12 7099 1 1 11 LYS HE2 H -3.028 -11.617 4.012 1.00 . A A . 11 LYS HE2 1 1 12 7100 1 1 11 LYS HE3 H -2.837 -9.870 4.143 1.00 . A A . 11 LYS HE3 1 1 12 7101 1 1 11 LYS HG2 H -6.397 -10.363 3.625 1.00 . A A . 11 LYS HG2 1 1 12 7102 1 1 11 LYS HG3 H -4.850 -10.257 2.782 1.00 . A A . 11 LYS HG3 1 1 12 7103 1 1 11 LYS HZ1 H -1.435 -11.062 5.722 1.00 . A A . 11 LYS HZ1 1 1 12 7104 1 1 11 LYS HZ2 H -2.801 -11.773 6.423 1.00 . A A . 11 LYS HZ2 1 1 12 7105 1 1 11 LYS HZ3 H -2.573 -10.100 6.523 1.00 . A A . 11 LYS HZ3 1 1 12 7106 1 1 11 LYS N N -7.526 -8.414 2.515 1.00 . A A . 11 LYS N 1 1 12 7107 1 1 11 LYS NZ N -2.449 -10.935 5.917 1.00 . A A . 11 LYS NZ 1 1 12 7108 1 1 11 LYS O O -4.255 -8.280 1.337 1.00 . A A . 11 LYS O 1 1 12 7109 1 1 12 PRO C C -4.369 -6.482 -1.240 1.00 . A A . 12 PRO C 1 1 12 7110 1 1 12 PRO CA C -5.448 -7.548 -1.083 1.00 . A A . 12 PRO CA 1 1 12 7111 1 1 12 PRO CB C -6.618 -7.269 -2.031 1.00 . A A . 12 PRO CB 1 1 12 7112 1 1 12 PRO CD C -7.464 -7.042 0.193 1.00 . A A . 12 PRO CD 1 1 12 7113 1 1 12 PRO CG C -7.600 -6.511 -1.207 1.00 . A A . 12 PRO CG 1 1 12 7114 1 1 12 PRO HA H -5.029 -8.519 -1.303 1.00 . A A . 12 PRO HA 1 1 12 7115 1 1 12 PRO HB2 H -6.271 -6.684 -2.872 1.00 . A A . 12 PRO HB2 1 1 12 7116 1 1 12 PRO HB3 H -7.033 -8.202 -2.381 1.00 . A A . 12 PRO HB3 1 1 12 7117 1 1 12 PRO HD2 H -7.628 -6.254 0.913 1.00 . A A . 12 PRO HD2 1 1 12 7118 1 1 12 PRO HD3 H -8.155 -7.856 0.357 1.00 . A A . 12 PRO HD3 1 1 12 7119 1 1 12 PRO HG2 H -7.366 -5.458 -1.233 1.00 . A A . 12 PRO HG2 1 1 12 7120 1 1 12 PRO HG3 H -8.600 -6.684 -1.577 1.00 . A A . 12 PRO HG3 1 1 12 7121 1 1 12 PRO N N -6.072 -7.519 0.243 1.00 . A A . 12 PRO N 1 1 12 7122 1 1 12 PRO O O -3.766 -6.348 -2.305 1.00 . A A . 12 PRO O 1 1 12 7123 1 1 13 TYR C C -1.826 -5.144 0.451 1.00 . A A . 13 TYR C 1 1 12 7124 1 1 13 TYR CA C -3.125 -4.671 -0.195 1.00 . A A . 13 TYR CA 1 1 12 7125 1 1 13 TYR CB C -3.645 -3.428 0.530 1.00 . A A . 13 TYR CB 1 1 12 7126 1 1 13 TYR CD1 C -6.164 -3.552 0.649 1.00 . A A . 13 TYR CD1 1 1 12 7127 1 1 13 TYR CD2 C -5.185 -2.039 -0.911 1.00 . A A . 13 TYR CD2 1 1 12 7128 1 1 13 TYR CE1 C -7.426 -3.163 0.242 1.00 . A A . 13 TYR CE1 1 1 12 7129 1 1 13 TYR CE2 C -6.443 -1.643 -1.323 1.00 . A A . 13 TYR CE2 1 1 12 7130 1 1 13 TYR CG C -5.024 -2.998 0.081 1.00 . A A . 13 TYR CG 1 1 12 7131 1 1 13 TYR CZ C -7.560 -2.208 -0.744 1.00 . A A . 13 TYR CZ 1 1 12 7132 1 1 13 TYR H H -4.644 -5.881 0.646 1.00 . A A . 13 TYR H 1 1 12 7133 1 1 13 TYR HA H -2.930 -4.419 -1.227 1.00 . A A . 13 TYR HA 1 1 12 7134 1 1 13 TYR HB2 H -3.690 -3.630 1.589 1.00 . A A . 13 TYR HB2 1 1 12 7135 1 1 13 TYR HB3 H -2.967 -2.607 0.352 1.00 . A A . 13 TYR HB3 1 1 12 7136 1 1 13 TYR HD1 H -6.056 -4.300 1.421 1.00 . A A . 13 TYR HD1 1 1 12 7137 1 1 13 TYR HD2 H -4.308 -1.599 -1.363 1.00 . A A . 13 TYR HD2 1 1 12 7138 1 1 13 TYR HE1 H -8.301 -3.605 0.695 1.00 . A A . 13 TYR HE1 1 1 12 7139 1 1 13 TYR HE2 H -6.548 -0.895 -2.095 1.00 . A A . 13 TYR HE2 1 1 12 7140 1 1 13 TYR HH H -9.477 -2.253 -0.612 1.00 . A A . 13 TYR HH 1 1 12 7141 1 1 13 TYR N N -4.131 -5.727 -0.174 1.00 . A A . 13 TYR N 1 1 12 7142 1 1 13 TYR O O -1.841 -5.793 1.496 1.00 . A A . 13 TYR O 1 1 12 7143 1 1 13 TYR OH O -8.814 -1.817 -1.153 1.00 . A A . 13 TYR OH 1 1 12 7144 1 1 14 GLU C C 1.682 -4.225 -0.129 1.00 . A A . 14 GLU C 1 1 12 7145 1 1 14 GLU CA C 0.604 -5.202 0.332 1.00 . A A . 14 GLU CA 1 1 12 7146 1 1 14 GLU CB C 0.954 -6.619 -0.128 1.00 . A A . 14 GLU CB 1 1 12 7147 1 1 14 GLU CD C 2.648 -8.493 -0.131 1.00 . A A . 14 GLU CD 1 1 12 7148 1 1 14 GLU CG C 2.306 -7.103 0.370 1.00 . A A . 14 GLU CG 1 1 12 7149 1 1 14 GLU H H -0.758 -4.293 -1.010 1.00 . A A . 14 GLU H 1 1 12 7150 1 1 14 GLU HA H 0.557 -5.184 1.410 1.00 . A A . 14 GLU HA 1 1 12 7151 1 1 14 GLU HB2 H 0.196 -7.299 0.232 1.00 . A A . 14 GLU HB2 1 1 12 7152 1 1 14 GLU HB3 H 0.962 -6.642 -1.207 1.00 . A A . 14 GLU HB3 1 1 12 7153 1 1 14 GLU HG2 H 3.067 -6.418 0.030 1.00 . A A . 14 GLU HG2 1 1 12 7154 1 1 14 GLU HG3 H 2.293 -7.119 1.450 1.00 . A A . 14 GLU HG3 1 1 12 7155 1 1 14 GLU N N -0.704 -4.812 -0.181 1.00 . A A . 14 GLU N 1 1 12 7156 1 1 14 GLU O O 1.607 -3.672 -1.227 1.00 . A A . 14 GLU O 1 1 12 7157 1 1 14 GLU OE1 O 2.237 -8.836 -1.259 1.00 . A A . 14 GLU OE1 1 1 12 7158 1 1 14 GLU OE2 O 3.327 -9.238 0.606 1.00 . A A . 14 GLU OE2 1 1 12 7159 1 1 15 CYS C C 4.728 -3.732 -0.617 1.00 . A A . 15 CYS C 1 1 12 7160 1 1 15 CYS CA C 3.778 -3.107 0.401 1.00 . A A . 15 CYS CA 1 1 12 7161 1 1 15 CYS CB C 4.546 -2.737 1.671 1.00 . A A . 15 CYS CB 1 1 12 7162 1 1 15 CYS H H 2.689 -4.487 1.579 1.00 . A A . 15 CYS H 1 1 12 7163 1 1 15 CYS HA H 3.352 -2.212 -0.026 1.00 . A A . 15 CYS HA 1 1 12 7164 1 1 15 CYS HB2 H 3.868 -2.757 2.511 1.00 . A A . 15 CYS HB2 1 1 12 7165 1 1 15 CYS HB3 H 5.332 -3.460 1.831 1.00 . A A . 15 CYS HB3 1 1 12 7166 1 1 15 CYS N N 2.685 -4.017 0.718 1.00 . A A . 15 CYS N 1 1 12 7167 1 1 15 CYS O O 4.533 -4.869 -1.048 1.00 . A A . 15 CYS O 1 1 12 7168 1 1 15 CYS SG S 5.315 -1.086 1.621 1.00 . A A . 15 CYS SG 1 1 12 7169 1 1 16 ASP C C 8.140 -3.454 -1.363 1.00 . A A . 16 ASP C 1 1 12 7170 1 1 16 ASP CA C 6.737 -3.462 -1.963 1.00 . A A . 16 ASP CA 1 1 12 7171 1 1 16 ASP CB C 6.705 -2.600 -3.226 1.00 . A A . 16 ASP CB 1 1 12 7172 1 1 16 ASP CG C 5.314 -2.497 -3.822 1.00 . A A . 16 ASP CG 1 1 12 7173 1 1 16 ASP H H 5.858 -2.083 -0.618 1.00 . A A . 16 ASP H 1 1 12 7174 1 1 16 ASP HA H 6.477 -4.476 -2.224 1.00 . A A . 16 ASP HA 1 1 12 7175 1 1 16 ASP HB2 H 7.047 -1.604 -2.984 1.00 . A A . 16 ASP HB2 1 1 12 7176 1 1 16 ASP HB3 H 7.363 -3.032 -3.966 1.00 . A A . 16 ASP HB3 1 1 12 7177 1 1 16 ASP N N 5.756 -2.981 -0.997 1.00 . A A . 16 ASP N 1 1 12 7178 1 1 16 ASP O O 9.033 -4.158 -1.835 1.00 . A A . 16 ASP O 1 1 12 7179 1 1 16 ASP OD1 O 4.772 -3.539 -4.245 1.00 . A A . 16 ASP OD1 1 1 12 7180 1 1 16 ASP OD2 O 4.769 -1.374 -3.865 1.00 . A A . 16 ASP OD2 1 1 12 7181 1 1 17 VAL C C 9.729 -3.553 1.489 1.00 . A A . 17 VAL C 1 1 12 7182 1 1 17 VAL CA C 9.620 -2.551 0.346 1.00 . A A . 17 VAL CA 1 1 12 7183 1 1 17 VAL CB C 9.861 -1.133 0.896 1.00 . A A . 17 VAL CB 1 1 12 7184 1 1 17 VAL CG1 C 11.176 -1.071 1.657 1.00 . A A . 17 VAL CG1 1 1 12 7185 1 1 17 VAL CG2 C 9.840 -0.114 -0.234 1.00 . A A . 17 VAL CG2 1 1 12 7186 1 1 17 VAL H H 7.577 -2.115 0.011 1.00 . A A . 17 VAL H 1 1 12 7187 1 1 17 VAL HA H 10.388 -2.767 -0.383 1.00 . A A . 17 VAL HA 1 1 12 7188 1 1 17 VAL HB H 9.061 -0.895 1.582 1.00 . A A . 17 VAL HB 1 1 12 7189 1 1 17 VAL HG11 H 11.518 -2.074 1.867 1.00 . A A . 17 VAL HG11 1 1 12 7190 1 1 17 VAL HG12 H 11.914 -0.555 1.061 1.00 . A A . 17 VAL HG12 1 1 12 7191 1 1 17 VAL HG13 H 11.028 -0.541 2.587 1.00 . A A . 17 VAL HG13 1 1 12 7192 1 1 17 VAL HG21 H 9.322 -0.529 -1.085 1.00 . A A . 17 VAL HG21 1 1 12 7193 1 1 17 VAL HG22 H 9.332 0.779 0.098 1.00 . A A . 17 VAL HG22 1 1 12 7194 1 1 17 VAL HG23 H 10.854 0.133 -0.515 1.00 . A A . 17 VAL HG23 1 1 12 7195 1 1 17 VAL N N 8.327 -2.651 -0.320 1.00 . A A . 17 VAL N 1 1 12 7196 1 1 17 VAL O O 10.747 -4.230 1.643 1.00 . A A . 17 VAL O 1 1 12 7197 1 1 18 CYS C C 7.579 -5.636 3.229 1.00 . A A . 18 CYS C 1 1 12 7198 1 1 18 CYS CA C 8.648 -4.564 3.422 1.00 . A A . 18 CYS CA 1 1 12 7199 1 1 18 CYS CB C 8.390 -3.799 4.722 1.00 . A A . 18 CYS CB 1 1 12 7200 1 1 18 CYS H H 7.891 -3.079 2.118 1.00 . A A . 18 CYS H 1 1 12 7201 1 1 18 CYS HA H 9.614 -5.043 3.482 1.00 . A A . 18 CYS HA 1 1 12 7202 1 1 18 CYS HB2 H 8.334 -4.504 5.540 1.00 . A A . 18 CYS HB2 1 1 12 7203 1 1 18 CYS HB3 H 9.208 -3.116 4.898 1.00 . A A . 18 CYS HB3 1 1 12 7204 1 1 18 CYS N N 8.673 -3.645 2.291 1.00 . A A . 18 CYS N 1 1 12 7205 1 1 18 CYS O O 7.432 -6.537 4.055 1.00 . A A . 18 CYS O 1 1 12 7206 1 1 18 CYS SG S 6.848 -2.831 4.721 1.00 . A A . 18 CYS SG 1 1 12 7207 1 1 19 ARG C C 4.856 -6.676 3.030 1.00 . A A . 19 ARG C 1 1 12 7208 1 1 19 ARG CA C 5.780 -6.490 1.830 1.00 . A A . 19 ARG CA 1 1 12 7209 1 1 19 ARG CB C 6.384 -7.835 1.424 1.00 . A A . 19 ARG CB 1 1 12 7210 1 1 19 ARG CD C 6.781 -7.101 -0.946 1.00 . A A . 19 ARG CD 1 1 12 7211 1 1 19 ARG CG C 7.395 -7.732 0.293 1.00 . A A . 19 ARG CG 1 1 12 7212 1 1 19 ARG CZ C 7.765 -8.273 -2.871 1.00 . A A . 19 ARG CZ 1 1 12 7213 1 1 19 ARG H H 7.001 -4.790 1.511 1.00 . A A . 19 ARG H 1 1 12 7214 1 1 19 ARG HA H 5.204 -6.100 1.004 1.00 . A A . 19 ARG HA 1 1 12 7215 1 1 19 ARG HB2 H 6.879 -8.268 2.281 1.00 . A A . 19 ARG HB2 1 1 12 7216 1 1 19 ARG HB3 H 5.589 -8.493 1.108 1.00 . A A . 19 ARG HB3 1 1 12 7217 1 1 19 ARG HD2 H 5.856 -7.610 -1.173 1.00 . A A . 19 ARG HD2 1 1 12 7218 1 1 19 ARG HD3 H 6.578 -6.061 -0.741 1.00 . A A . 19 ARG HD3 1 1 12 7219 1 1 19 ARG HE H 8.218 -6.411 -2.317 1.00 . A A . 19 ARG HE 1 1 12 7220 1 1 19 ARG HG2 H 8.226 -7.124 0.620 1.00 . A A . 19 ARG HG2 1 1 12 7221 1 1 19 ARG HG3 H 7.746 -8.723 0.047 1.00 . A A . 19 ARG HG3 1 1 12 7222 1 1 19 ARG HH11 H 6.407 -9.344 -1.827 1.00 . A A . 19 ARG HH11 1 1 12 7223 1 1 19 ARG HH12 H 7.108 -10.158 -3.187 1.00 . A A . 19 ARG HH12 1 1 12 7224 1 1 19 ARG HH21 H 9.148 -7.472 -4.109 1.00 . A A . 19 ARG HH21 1 1 12 7225 1 1 19 ARG HH22 H 8.668 -9.092 -4.483 1.00 . A A . 19 ARG HH22 1 1 12 7226 1 1 19 ARG N N 6.836 -5.531 2.132 1.00 . A A . 19 ARG N 1 1 12 7227 1 1 19 ARG NE N 7.668 -7.193 -2.103 1.00 . A A . 19 ARG NE 1 1 12 7228 1 1 19 ARG NH1 N 7.034 -9.346 -2.606 1.00 . A A . 19 ARG NH1 1 1 12 7229 1 1 19 ARG NH2 N 8.595 -8.280 -3.906 1.00 . A A . 19 ARG NH2 1 1 12 7230 1 1 19 ARG O O 4.522 -7.802 3.402 1.00 . A A . 19 ARG O 1 1 12 7231 1 1 20 LYS C C 2.112 -5.823 4.360 1.00 . A A . 20 LYS C 1 1 12 7232 1 1 20 LYS CA C 3.559 -5.605 4.790 1.00 . A A . 20 LYS CA 1 1 12 7233 1 1 20 LYS CB C 3.674 -4.306 5.590 1.00 . A A . 20 LYS CB 1 1 12 7234 1 1 20 LYS CD C 3.811 -3.401 7.930 1.00 . A A . 20 LYS CD 1 1 12 7235 1 1 20 LYS CE C 3.243 -3.471 9.339 1.00 . A A . 20 LYS CE 1 1 12 7236 1 1 20 LYS CG C 3.156 -4.420 7.013 1.00 . A A . 20 LYS CG 1 1 12 7237 1 1 20 LYS H H 4.745 -4.697 3.289 1.00 . A A . 20 LYS H 1 1 12 7238 1 1 20 LYS HA H 3.865 -6.431 5.414 1.00 . A A . 20 LYS HA 1 1 12 7239 1 1 20 LYS HB2 H 4.713 -4.012 5.631 1.00 . A A . 20 LYS HB2 1 1 12 7240 1 1 20 LYS HB3 H 3.111 -3.534 5.085 1.00 . A A . 20 LYS HB3 1 1 12 7241 1 1 20 LYS HD2 H 4.872 -3.597 7.972 1.00 . A A . 20 LYS HD2 1 1 12 7242 1 1 20 LYS HD3 H 3.642 -2.410 7.531 1.00 . A A . 20 LYS HD3 1 1 12 7243 1 1 20 LYS HE2 H 3.304 -4.491 9.687 1.00 . A A . 20 LYS HE2 1 1 12 7244 1 1 20 LYS HE3 H 3.832 -2.835 9.983 1.00 . A A . 20 LYS HE3 1 1 12 7245 1 1 20 LYS HG2 H 2.089 -4.254 7.013 1.00 . A A . 20 LYS HG2 1 1 12 7246 1 1 20 LYS HG3 H 3.367 -5.413 7.385 1.00 . A A . 20 LYS HG3 1 1 12 7247 1 1 20 LYS HZ1 H 1.324 -3.329 8.525 1.00 . A A . 20 LYS HZ1 1 1 12 7248 1 1 20 LYS HZ2 H 1.775 -1.990 9.457 1.00 . A A . 20 LYS HZ2 1 1 12 7249 1 1 20 LYS HZ3 H 1.346 -3.441 10.213 1.00 . A A . 20 LYS HZ3 1 1 12 7250 1 1 20 LYS N N 4.445 -5.565 3.632 1.00 . A A . 20 LYS N 1 1 12 7251 1 1 20 LYS NZ N 1.822 -3.027 9.387 1.00 . A A . 20 LYS NZ 1 1 12 7252 1 1 20 LYS O O 1.794 -5.773 3.172 1.00 . A A . 20 LYS O 1 1 12 7253 1 1 21 ALA C C -1.037 -5.214 5.714 1.00 . A A . 21 ALA C 1 1 12 7254 1 1 21 ALA CA C -0.174 -6.284 5.055 1.00 . A A . 21 ALA CA 1 1 12 7255 1 1 21 ALA CB C -0.594 -7.668 5.527 1.00 . A A . 21 ALA CB 1 1 12 7256 1 1 21 ALA H H 1.555 -6.089 6.261 1.00 . A A . 21 ALA H 1 1 12 7257 1 1 21 ALA HA H -0.315 -6.237 3.985 1.00 . A A . 21 ALA HA 1 1 12 7258 1 1 21 ALA HB1 H -0.055 -7.919 6.429 1.00 . A A . 21 ALA HB1 1 1 12 7259 1 1 21 ALA HB2 H -1.655 -7.672 5.728 1.00 . A A . 21 ALA HB2 1 1 12 7260 1 1 21 ALA HB3 H -0.369 -8.393 4.759 1.00 . A A . 21 ALA HB3 1 1 12 7261 1 1 21 ALA N N 1.240 -6.062 5.333 1.00 . A A . 21 ALA N 1 1 12 7262 1 1 21 ALA O O -0.770 -4.793 6.840 1.00 . A A . 21 ALA O 1 1 12 7263 1 1 22 PHE C C -4.429 -4.114 5.231 1.00 . A A . 22 PHE C 1 1 12 7264 1 1 22 PHE CA C -2.975 -3.754 5.521 1.00 . A A . 22 PHE CA 1 1 12 7265 1 1 22 PHE CB C -2.642 -2.393 4.906 1.00 . A A . 22 PHE CB 1 1 12 7266 1 1 22 PHE CD1 C -0.230 -2.433 4.214 1.00 . A A . 22 PHE CD1 1 1 12 7267 1 1 22 PHE CD2 C -0.836 -1.160 6.137 1.00 . A A . 22 PHE CD2 1 1 12 7268 1 1 22 PHE CE1 C 1.091 -2.062 4.380 1.00 . A A . 22 PHE CE1 1 1 12 7269 1 1 22 PHE CE2 C 0.483 -0.785 6.307 1.00 . A A . 22 PHE CE2 1 1 12 7270 1 1 22 PHE CG C -1.207 -1.987 5.089 1.00 . A A . 22 PHE CG 1 1 12 7271 1 1 22 PHE CZ C 1.448 -1.237 5.428 1.00 . A A . 22 PHE CZ 1 1 12 7272 1 1 22 PHE H H -2.234 -5.151 4.114 1.00 . A A . 22 PHE H 1 1 12 7273 1 1 22 PHE HA H -2.837 -3.700 6.590 1.00 . A A . 22 PHE HA 1 1 12 7274 1 1 22 PHE HB2 H -2.844 -2.425 3.846 1.00 . A A . 22 PHE HB2 1 1 12 7275 1 1 22 PHE HB3 H -3.263 -1.638 5.364 1.00 . A A . 22 PHE HB3 1 1 12 7276 1 1 22 PHE HD1 H -0.509 -3.079 3.393 1.00 . A A . 22 PHE HD1 1 1 12 7277 1 1 22 PHE HD2 H -1.589 -0.806 6.826 1.00 . A A . 22 PHE HD2 1 1 12 7278 1 1 22 PHE HE1 H 1.842 -2.417 3.690 1.00 . A A . 22 PHE HE1 1 1 12 7279 1 1 22 PHE HE2 H 0.760 -0.140 7.128 1.00 . A A . 22 PHE HE2 1 1 12 7280 1 1 22 PHE HZ H 2.479 -0.945 5.559 1.00 . A A . 22 PHE HZ 1 1 12 7281 1 1 22 PHE N N -2.073 -4.777 5.006 1.00 . A A . 22 PHE N 1 1 12 7282 1 1 22 PHE O O -4.710 -5.016 4.442 1.00 . A A . 22 PHE O 1 1 12 7283 1 1 23 SER C C -7.488 -2.384 5.222 1.00 . A A . 23 SER C 1 1 12 7284 1 1 23 SER CA C -6.774 -3.649 5.689 1.00 . A A . 23 SER CA 1 1 12 7285 1 1 23 SER CB C -7.400 -4.150 6.992 1.00 . A A . 23 SER CB 1 1 12 7286 1 1 23 SER H H -5.062 -2.696 6.491 1.00 . A A . 23 SER H 1 1 12 7287 1 1 23 SER HA H -6.883 -4.410 4.931 1.00 . A A . 23 SER HA 1 1 12 7288 1 1 23 SER HB2 H -8.456 -4.314 6.841 1.00 . A A . 23 SER HB2 1 1 12 7289 1 1 23 SER HB3 H -6.929 -5.079 7.280 1.00 . A A . 23 SER HB3 1 1 12 7290 1 1 23 SER HG H -6.535 -2.588 7.798 1.00 . A A . 23 SER HG 1 1 12 7291 1 1 23 SER N N -5.349 -3.402 5.874 1.00 . A A . 23 SER N 1 1 12 7292 1 1 23 SER O O -8.633 -2.129 5.597 1.00 . A A . 23 SER O 1 1 12 7293 1 1 23 SER OG O -7.229 -3.207 8.036 1.00 . A A . 23 SER OG 1 1 12 7294 1 1 24 HIS C C -6.455 0.263 2.829 1.00 . A A . 24 HIS C 1 1 12 7295 1 1 24 HIS CA C -7.371 -0.355 3.881 1.00 . A A . 24 HIS CA 1 1 12 7296 1 1 24 HIS CB C -7.605 0.639 5.018 1.00 . A A . 24 HIS CB 1 1 12 7297 1 1 24 HIS CD2 C -9.829 1.866 5.547 1.00 . A A . 24 HIS CD2 1 1 12 7298 1 1 24 HIS CE1 C -10.003 3.026 3.694 1.00 . A A . 24 HIS CE1 1 1 12 7299 1 1 24 HIS CG C -8.757 1.565 4.776 1.00 . A A . 24 HIS CG 1 1 12 7300 1 1 24 HIS H H -5.895 -1.851 4.138 1.00 . A A . 24 HIS H 1 1 12 7301 1 1 24 HIS HA H -8.318 -0.592 3.421 1.00 . A A . 24 HIS HA 1 1 12 7302 1 1 24 HIS HB2 H -7.805 0.094 5.929 1.00 . A A . 24 HIS HB2 1 1 12 7303 1 1 24 HIS HB3 H -6.717 1.241 5.151 1.00 . A A . 24 HIS HB3 1 1 12 7304 1 1 24 HIS HD1 H -8.277 2.308 2.864 1.00 . A A . 24 HIS HD1 1 1 12 7305 1 1 24 HIS HD2 H -10.047 1.466 6.527 1.00 . A A . 24 HIS HD2 1 1 12 7306 1 1 24 HIS HE1 H -10.369 3.702 2.936 1.00 . A A . 24 HIS HE1 1 1 12 7307 1 1 24 HIS N N -6.803 -1.594 4.401 1.00 . A A . 24 HIS N 1 1 12 7308 1 1 24 HIS ND1 N -8.897 2.307 3.622 1.00 . A A . 24 HIS ND1 1 1 12 7309 1 1 24 HIS NE2 N -10.587 2.776 4.852 1.00 . A A . 24 HIS NE2 1 1 12 7310 1 1 24 HIS O O -5.332 0.669 3.131 1.00 . A A . 24 HIS O 1 1 12 7311 1 1 25 HIS C C -5.294 2.051 0.988 1.00 . A A . 25 HIS C 1 1 12 7312 1 1 25 HIS CA C -6.165 0.899 0.497 1.00 . A A . 25 HIS CA 1 1 12 7313 1 1 25 HIS CB C -7.095 1.385 -0.615 1.00 . A A . 25 HIS CB 1 1 12 7314 1 1 25 HIS CD2 C -5.334 2.805 -1.883 1.00 . A A . 25 HIS CD2 1 1 12 7315 1 1 25 HIS CE1 C -5.886 2.247 -3.930 1.00 . A A . 25 HIS CE1 1 1 12 7316 1 1 25 HIS CG C -6.371 1.938 -1.803 1.00 . A A . 25 HIS CG 1 1 12 7317 1 1 25 HIS H H -7.842 -0.011 1.416 1.00 . A A . 25 HIS H 1 1 12 7318 1 1 25 HIS HA H -5.526 0.122 0.105 1.00 . A A . 25 HIS HA 1 1 12 7319 1 1 25 HIS HB2 H -7.704 0.559 -0.953 1.00 . A A . 25 HIS HB2 1 1 12 7320 1 1 25 HIS HB3 H -7.736 2.163 -0.224 1.00 . A A . 25 HIS HB3 1 1 12 7321 1 1 25 HIS HD1 H -7.407 0.996 -3.376 1.00 . A A . 25 HIS HD1 1 1 12 7322 1 1 25 HIS HD2 H -4.823 3.273 -1.053 1.00 . A A . 25 HIS HD2 1 1 12 7323 1 1 25 HIS HE1 H -5.905 2.181 -5.007 1.00 . A A . 25 HIS HE1 1 1 12 7324 1 1 25 HIS N N -6.941 0.330 1.594 1.00 . A A . 25 HIS N 1 1 12 7325 1 1 25 HIS ND1 N -6.694 1.608 -3.102 1.00 . A A . 25 HIS ND1 1 1 12 7326 1 1 25 HIS NE2 N -5.052 2.980 -3.215 1.00 . A A . 25 HIS NE2 1 1 12 7327 1 1 25 HIS O O -4.097 2.099 0.708 1.00 . A A . 25 HIS O 1 1 12 7328 1 1 26 ALA C C -4.120 3.694 3.256 1.00 . A A . 26 ALA C 1 1 12 7329 1 1 26 ALA CA C -5.183 4.127 2.252 1.00 . A A . 26 ALA CA 1 1 12 7330 1 1 26 ALA CB C -6.153 5.106 2.897 1.00 . A A . 26 ALA CB 1 1 12 7331 1 1 26 ALA H H -6.860 2.882 1.912 1.00 . A A . 26 ALA H 1 1 12 7332 1 1 26 ALA HA H -4.700 4.628 1.426 1.00 . A A . 26 ALA HA 1 1 12 7333 1 1 26 ALA HB1 H -5.749 5.445 3.839 1.00 . A A . 26 ALA HB1 1 1 12 7334 1 1 26 ALA HB2 H -6.298 5.952 2.242 1.00 . A A . 26 ALA HB2 1 1 12 7335 1 1 26 ALA HB3 H -7.099 4.614 3.067 1.00 . A A . 26 ALA HB3 1 1 12 7336 1 1 26 ALA N N -5.903 2.976 1.722 1.00 . A A . 26 ALA N 1 1 12 7337 1 1 26 ALA O O -2.976 4.144 3.196 1.00 . A A . 26 ALA O 1 1 12 7338 1 1 27 SER C C -2.272 1.872 4.572 1.00 . A A . 27 SER C 1 1 12 7339 1 1 27 SER CA C -3.586 2.328 5.199 1.00 . A A . 27 SER CA 1 1 12 7340 1 1 27 SER CB C -4.222 1.173 5.975 1.00 . A A . 27 SER CB 1 1 12 7341 1 1 27 SER H H -5.432 2.497 4.175 1.00 . A A . 27 SER H 1 1 12 7342 1 1 27 SER HA H -3.384 3.140 5.881 1.00 . A A . 27 SER HA 1 1 12 7343 1 1 27 SER HB2 H -4.721 0.510 5.285 1.00 . A A . 27 SER HB2 1 1 12 7344 1 1 27 SER HB3 H -3.450 0.629 6.502 1.00 . A A . 27 SER HB3 1 1 12 7345 1 1 27 SER HG H -5.500 2.504 6.631 1.00 . A A . 27 SER HG 1 1 12 7346 1 1 27 SER N N -4.506 2.818 4.179 1.00 . A A . 27 SER N 1 1 12 7347 1 1 27 SER O O -1.252 1.759 5.254 1.00 . A A . 27 SER O 1 1 12 7348 1 1 27 SER OG O -5.168 1.650 6.916 1.00 . A A . 27 SER OG 1 1 12 7349 1 1 28 LEU C C -0.311 2.361 2.040 1.00 . A A . 28 LEU C 1 1 12 7350 1 1 28 LEU CA C -1.116 1.169 2.549 1.00 . A A . 28 LEU CA 1 1 12 7351 1 1 28 LEU CB C -1.512 0.269 1.377 1.00 . A A . 28 LEU CB 1 1 12 7352 1 1 28 LEU CD1 C 0.458 -1.279 1.327 1.00 . A A . 28 LEU CD1 1 1 12 7353 1 1 28 LEU CD2 C -0.894 -0.913 -0.745 1.00 . A A . 28 LEU CD2 1 1 12 7354 1 1 28 LEU CG C -0.362 -0.276 0.531 1.00 . A A . 28 LEU CG 1 1 12 7355 1 1 28 LEU H H -3.146 1.721 2.781 1.00 . A A . 28 LEU H 1 1 12 7356 1 1 28 LEU HA H -0.503 0.604 3.236 1.00 . A A . 28 LEU HA 1 1 12 7357 1 1 28 LEU HB2 H -2.057 -0.572 1.777 1.00 . A A . 28 LEU HB2 1 1 12 7358 1 1 28 LEU HB3 H -2.161 0.840 0.728 1.00 . A A . 28 LEU HB3 1 1 12 7359 1 1 28 LEU HD11 H 0.385 -1.049 2.380 1.00 . A A . 28 LEU HD11 1 1 12 7360 1 1 28 LEU HD12 H 1.491 -1.226 1.018 1.00 . A A . 28 LEU HD12 1 1 12 7361 1 1 28 LEU HD13 H 0.080 -2.275 1.149 1.00 . A A . 28 LEU HD13 1 1 12 7362 1 1 28 LEU HD21 H -0.135 -0.869 -1.512 1.00 . A A . 28 LEU HD21 1 1 12 7363 1 1 28 LEU HD22 H -1.772 -0.378 -1.075 1.00 . A A . 28 LEU HD22 1 1 12 7364 1 1 28 LEU HD23 H -1.152 -1.944 -0.552 1.00 . A A . 28 LEU HD23 1 1 12 7365 1 1 28 LEU HG H 0.290 0.540 0.252 1.00 . A A . 28 LEU HG 1 1 12 7366 1 1 28 LEU N N -2.304 1.613 3.270 1.00 . A A . 28 LEU N 1 1 12 7367 1 1 28 LEU O O 0.887 2.474 2.302 1.00 . A A . 28 LEU O 1 1 12 7368 1 1 29 THR C C 0.276 5.291 1.876 1.00 . A A . 29 THR C 1 1 12 7369 1 1 29 THR CA C -0.326 4.436 0.767 1.00 . A A . 29 THR CA 1 1 12 7370 1 1 29 THR CB C -1.311 5.293 -0.050 1.00 . A A . 29 THR CB 1 1 12 7371 1 1 29 THR CG2 C -2.104 6.220 0.858 1.00 . A A . 29 THR CG2 1 1 12 7372 1 1 29 THR H H -1.931 3.106 1.137 1.00 . A A . 29 THR H 1 1 12 7373 1 1 29 THR HA H 0.465 4.108 0.109 1.00 . A A . 29 THR HA 1 1 12 7374 1 1 29 THR HB H -2.001 4.635 -0.559 1.00 . A A . 29 THR HB 1 1 12 7375 1 1 29 THR HG1 H -0.842 5.774 -1.904 1.00 . A A . 29 THR HG1 1 1 12 7376 1 1 29 THR HG21 H -2.648 5.634 1.584 1.00 . A A . 29 THR HG21 1 1 12 7377 1 1 29 THR HG22 H -2.801 6.795 0.266 1.00 . A A . 29 THR HG22 1 1 12 7378 1 1 29 THR HG23 H -1.428 6.888 1.370 1.00 . A A . 29 THR HG23 1 1 12 7379 1 1 29 THR N N -0.978 3.251 1.312 1.00 . A A . 29 THR N 1 1 12 7380 1 1 29 THR O O 1.394 5.789 1.749 1.00 . A A . 29 THR O 1 1 12 7381 1 1 29 THR OG1 O -0.598 6.065 -1.023 1.00 . A A . 29 THR OG1 1 1 12 7382 1 1 30 GLN C C 1.325 5.734 4.615 1.00 . A A . 30 GLN C 1 1 12 7383 1 1 30 GLN CA C -0.011 6.252 4.093 1.00 . A A . 30 GLN CA 1 1 12 7384 1 1 30 GLN CB C -1.051 6.234 5.215 1.00 . A A . 30 GLN CB 1 1 12 7385 1 1 30 GLN CD C -1.805 5.150 7.369 1.00 . A A . 30 GLN CD 1 1 12 7386 1 1 30 GLN CG C -0.934 5.029 6.134 1.00 . A A . 30 GLN CG 1 1 12 7387 1 1 30 GLN H H -1.355 5.033 3.003 1.00 . A A . 30 GLN H 1 1 12 7388 1 1 30 GLN HA H 0.119 7.268 3.752 1.00 . A A . 30 GLN HA 1 1 12 7389 1 1 30 GLN HB2 H -0.936 7.127 5.810 1.00 . A A . 30 GLN HB2 1 1 12 7390 1 1 30 GLN HB3 H -2.038 6.229 4.774 1.00 . A A . 30 GLN HB3 1 1 12 7391 1 1 30 GLN HE21 H -0.363 6.135 8.319 1.00 . A A . 30 GLN HE21 1 1 12 7392 1 1 30 GLN HE22 H -1.815 5.878 9.218 1.00 . A A . 30 GLN HE22 1 1 12 7393 1 1 30 GLN HG2 H -1.232 4.146 5.588 1.00 . A A . 30 GLN HG2 1 1 12 7394 1 1 30 GLN HG3 H 0.095 4.929 6.445 1.00 . A A . 30 GLN HG3 1 1 12 7395 1 1 30 GLN N N -0.473 5.456 2.962 1.00 . A A . 30 GLN N 1 1 12 7396 1 1 30 GLN NE2 N -1.274 5.785 8.408 1.00 . A A . 30 GLN NE2 1 1 12 7397 1 1 30 GLN O O 2.215 6.514 4.955 1.00 . A A . 30 GLN O 1 1 12 7398 1 1 30 GLN OE1 O -2.942 4.679 7.389 1.00 . A A . 30 GLN OE1 1 1 12 7399 1 1 31 HIS C C 3.800 3.912 4.118 1.00 . A A . 31 HIS C 1 1 12 7400 1 1 31 HIS CA C 2.687 3.790 5.155 1.00 . A A . 31 HIS CA 1 1 12 7401 1 1 31 HIS CB C 2.442 2.317 5.485 1.00 . A A . 31 HIS CB 1 1 12 7402 1 1 31 HIS CD2 C 4.080 0.647 4.364 1.00 . A A . 31 HIS CD2 1 1 12 7403 1 1 31 HIS CE1 C 5.586 0.559 5.956 1.00 . A A . 31 HIS CE1 1 1 12 7404 1 1 31 HIS CG C 3.667 1.464 5.362 1.00 . A A . 31 HIS CG 1 1 12 7405 1 1 31 HIS H H 0.714 3.843 4.389 1.00 . A A . 31 HIS H 1 1 12 7406 1 1 31 HIS HA H 2.991 4.305 6.053 1.00 . A A . 31 HIS HA 1 1 12 7407 1 1 31 HIS HB2 H 2.084 2.238 6.501 1.00 . A A . 31 HIS HB2 1 1 12 7408 1 1 31 HIS HB3 H 1.693 1.924 4.812 1.00 . A A . 31 HIS HB3 1 1 12 7409 1 1 31 HIS HD1 H 4.618 1.865 7.198 1.00 . A A . 31 HIS HD1 1 1 12 7410 1 1 31 HIS HD2 H 3.567 0.463 3.431 1.00 . A A . 31 HIS HD2 1 1 12 7411 1 1 31 HIS HE1 H 6.469 0.303 6.521 1.00 . A A . 31 HIS HE1 1 1 12 7412 1 1 31 HIS N N 1.459 4.412 4.675 1.00 . A A . 31 HIS N 1 1 12 7413 1 1 31 HIS ND1 N 4.631 1.385 6.344 1.00 . A A . 31 HIS ND1 1 1 12 7414 1 1 31 HIS NE2 N 5.275 0.097 4.758 1.00 . A A . 31 HIS NE2 1 1 12 7415 1 1 31 HIS O O 4.919 4.310 4.440 1.00 . A A . 31 HIS O 1 1 12 7416 1 1 32 GLN C C 5.342 4.872 1.934 1.00 . A A . 32 GLN C 1 1 12 7417 1 1 32 GLN CA C 4.457 3.638 1.791 1.00 . A A . 32 GLN CA 1 1 12 7418 1 1 32 GLN CB C 3.745 3.661 0.437 1.00 . A A . 32 GLN CB 1 1 12 7419 1 1 32 GLN CD C 2.931 2.297 -1.527 1.00 . A A . 32 GLN CD 1 1 12 7420 1 1 32 GLN CG C 3.370 2.280 -0.076 1.00 . A A . 32 GLN CG 1 1 12 7421 1 1 32 GLN H H 2.574 3.259 2.680 1.00 . A A . 32 GLN H 1 1 12 7422 1 1 32 GLN HA H 5.078 2.757 1.846 1.00 . A A . 32 GLN HA 1 1 12 7423 1 1 32 GLN HB2 H 2.842 4.245 0.529 1.00 . A A . 32 GLN HB2 1 1 12 7424 1 1 32 GLN HB3 H 4.394 4.127 -0.289 1.00 . A A . 32 GLN HB3 1 1 12 7425 1 1 32 GLN HE21 H 3.168 0.327 -1.647 1.00 . A A . 32 GLN HE21 1 1 12 7426 1 1 32 GLN HE22 H 2.625 1.107 -3.090 1.00 . A A . 32 GLN HE22 1 1 12 7427 1 1 32 GLN HG2 H 4.228 1.631 0.016 1.00 . A A . 32 GLN HG2 1 1 12 7428 1 1 32 GLN HG3 H 2.561 1.894 0.525 1.00 . A A . 32 GLN HG3 1 1 12 7429 1 1 32 GLN N N 3.483 3.568 2.874 1.00 . A A . 32 GLN N 1 1 12 7430 1 1 32 GLN NE2 N 2.906 1.125 -2.152 1.00 . A A . 32 GLN NE2 1 1 12 7431 1 1 32 GLN O O 6.513 4.855 1.555 1.00 . A A . 32 GLN O 1 1 12 7432 1 1 32 GLN OE1 O 2.617 3.351 -2.081 1.00 . A A . 32 GLN OE1 1 1 12 7433 1 1 33 ARG C C 6.867 6.917 3.326 1.00 . A A . 33 ARG C 1 1 12 7434 1 1 33 ARG CA C 5.512 7.183 2.676 1.00 . A A . 33 ARG CA 1 1 12 7435 1 1 33 ARG CB C 4.703 8.154 3.538 1.00 . A A . 33 ARG CB 1 1 12 7436 1 1 33 ARG CD C 2.840 9.835 3.672 1.00 . A A . 33 ARG CD 1 1 12 7437 1 1 33 ARG CG C 3.645 8.921 2.762 1.00 . A A . 33 ARG CG 1 1 12 7438 1 1 33 ARG CZ C 3.040 12.067 4.685 1.00 . A A . 33 ARG CZ 1 1 12 7439 1 1 33 ARG H H 3.838 5.892 2.766 1.00 . A A . 33 ARG H 1 1 12 7440 1 1 33 ARG HA H 5.673 7.627 1.705 1.00 . A A . 33 ARG HA 1 1 12 7441 1 1 33 ARG HB2 H 4.209 7.596 4.321 1.00 . A A . 33 ARG HB2 1 1 12 7442 1 1 33 ARG HB3 H 5.378 8.867 3.986 1.00 . A A . 33 ARG HB3 1 1 12 7443 1 1 33 ARG HD2 H 1.925 10.108 3.168 1.00 . A A . 33 ARG HD2 1 1 12 7444 1 1 33 ARG HD3 H 2.605 9.300 4.580 1.00 . A A . 33 ARG HD3 1 1 12 7445 1 1 33 ARG HE H 4.509 11.112 3.730 1.00 . A A . 33 ARG HE 1 1 12 7446 1 1 33 ARG HG2 H 4.130 9.521 2.006 1.00 . A A . 33 ARG HG2 1 1 12 7447 1 1 33 ARG HG3 H 2.976 8.217 2.291 1.00 . A A . 33 ARG HG3 1 1 12 7448 1 1 33 ARG HH11 H 1.224 11.205 4.879 1.00 . A A . 33 ARG HH11 1 1 12 7449 1 1 33 ARG HH12 H 1.379 12.778 5.588 1.00 . A A . 33 ARG HH12 1 1 12 7450 1 1 33 ARG HH21 H 4.725 13.184 4.660 1.00 . A A . 33 ARG HH21 1 1 12 7451 1 1 33 ARG HH22 H 3.370 13.903 5.462 1.00 . A A . 33 ARG HH22 1 1 12 7452 1 1 33 ARG N N 4.775 5.940 2.484 1.00 . A A . 33 ARG N 1 1 12 7453 1 1 33 ARG NE N 3.573 11.051 4.014 1.00 . A A . 33 ARG NE 1 1 12 7454 1 1 33 ARG NH1 N 1.777 12.013 5.083 1.00 . A A . 33 ARG NH1 1 1 12 7455 1 1 33 ARG NH2 N 3.772 13.140 4.958 1.00 . A A . 33 ARG NH2 1 1 12 7456 1 1 33 ARG O O 7.892 7.436 2.884 1.00 . A A . 33 ARG O 1 1 12 7457 1 1 34 VAL C C 9.221 5.453 4.115 1.00 . A A . 34 VAL C 1 1 12 7458 1 1 34 VAL CA C 8.091 5.769 5.089 1.00 . A A . 34 VAL CA 1 1 12 7459 1 1 34 VAL CB C 7.885 4.565 6.027 1.00 . A A . 34 VAL CB 1 1 12 7460 1 1 34 VAL CG1 C 6.801 4.866 7.051 1.00 . A A . 34 VAL CG1 1 1 12 7461 1 1 34 VAL CG2 C 7.543 3.318 5.226 1.00 . A A . 34 VAL CG2 1 1 12 7462 1 1 34 VAL H H 6.014 5.722 4.683 1.00 . A A . 34 VAL H 1 1 12 7463 1 1 34 VAL HA H 8.374 6.622 5.688 1.00 . A A . 34 VAL HA 1 1 12 7464 1 1 34 VAL HB H 8.809 4.385 6.557 1.00 . A A . 34 VAL HB 1 1 12 7465 1 1 34 VAL HG11 H 5.933 5.267 6.548 1.00 . A A . 34 VAL HG11 1 1 12 7466 1 1 34 VAL HG12 H 6.531 3.956 7.568 1.00 . A A . 34 VAL HG12 1 1 12 7467 1 1 34 VAL HG13 H 7.169 5.589 7.764 1.00 . A A . 34 VAL HG13 1 1 12 7468 1 1 34 VAL HG21 H 6.927 2.664 5.824 1.00 . A A . 34 VAL HG21 1 1 12 7469 1 1 34 VAL HG22 H 7.006 3.601 4.333 1.00 . A A . 34 VAL HG22 1 1 12 7470 1 1 34 VAL HG23 H 8.453 2.805 4.952 1.00 . A A . 34 VAL HG23 1 1 12 7471 1 1 34 VAL N N 6.863 6.105 4.378 1.00 . A A . 34 VAL N 1 1 12 7472 1 1 34 VAL O O 10.370 5.834 4.336 1.00 . A A . 34 VAL O 1 1 12 7473 1 1 35 HIS C C 10.011 5.484 0.977 1.00 . A A . 35 HIS C 1 1 12 7474 1 1 35 HIS CA C 9.872 4.385 2.026 1.00 . A A . 35 HIS CA 1 1 12 7475 1 1 35 HIS CB C 9.480 3.069 1.354 1.00 . A A . 35 HIS CB 1 1 12 7476 1 1 35 HIS CD2 C 7.890 1.301 2.390 1.00 . A A . 35 HIS CD2 1 1 12 7477 1 1 35 HIS CE1 C 9.173 0.646 4.044 1.00 . A A . 35 HIS CE1 1 1 12 7478 1 1 35 HIS CG C 9.040 2.012 2.320 1.00 . A A . 35 HIS CG 1 1 12 7479 1 1 35 HIS H H 7.953 4.477 2.916 1.00 . A A . 35 HIS H 1 1 12 7480 1 1 35 HIS HA H 10.822 4.257 2.522 1.00 . A A . 35 HIS HA 1 1 12 7481 1 1 35 HIS HB2 H 8.665 3.251 0.669 1.00 . A A . 35 HIS HB2 1 1 12 7482 1 1 35 HIS HB3 H 10.327 2.686 0.805 1.00 . A A . 35 HIS HB3 1 1 12 7483 1 1 35 HIS HD1 H 10.719 1.906 3.587 1.00 . A A . 35 HIS HD1 1 1 12 7484 1 1 35 HIS HD2 H 7.044 1.380 1.722 1.00 . A A . 35 HIS HD2 1 1 12 7485 1 1 35 HIS HE1 H 9.540 0.125 4.915 1.00 . A A . 35 HIS HE1 1 1 12 7486 1 1 35 HIS N N 8.886 4.753 3.036 1.00 . A A . 35 HIS N 1 1 12 7487 1 1 35 HIS ND1 N 9.822 1.579 3.370 1.00 . A A . 35 HIS ND1 1 1 12 7488 1 1 35 HIS NE2 N 7.998 0.459 3.470 1.00 . A A . 35 HIS NE2 1 1 12 7489 1 1 35 HIS O O 10.192 5.205 -0.208 1.00 . A A . 35 HIS O 1 1 12 7490 1 1 36 SER C C 11.479 8.357 0.428 1.00 . A A . 36 SER C 1 1 12 7491 1 1 36 SER CA C 10.034 7.875 0.519 1.00 . A A . 36 SER CA 1 1 12 7492 1 1 36 SER CB C 9.133 9.016 0.994 1.00 . A A . 36 SER CB 1 1 12 7493 1 1 36 SER H H 9.777 6.892 2.377 1.00 . A A . 36 SER H 1 1 12 7494 1 1 36 SER HA H 9.711 7.556 -0.460 1.00 . A A . 36 SER HA 1 1 12 7495 1 1 36 SER HB2 H 9.182 9.829 0.285 1.00 . A A . 36 SER HB2 1 1 12 7496 1 1 36 SER HB3 H 8.115 8.662 1.065 1.00 . A A . 36 SER HB3 1 1 12 7497 1 1 36 SER HG H 9.785 10.419 2.196 1.00 . A A . 36 SER HG 1 1 12 7498 1 1 36 SER N N 9.923 6.734 1.421 1.00 . A A . 36 SER N 1 1 12 7499 1 1 36 SER O O 11.969 8.681 -0.652 1.00 . A A . 36 SER O 1 1 12 7500 1 1 36 SER OG O 9.540 9.493 2.265 1.00 . A A . 36 SER OG 1 1 12 7501 1 1 37 GLY C C 13.680 10.261 2.115 1.00 . A A . 37 GLY C 1 1 12 7502 1 1 37 GLY CA C 13.537 8.843 1.600 1.00 . A A . 37 GLY CA 1 1 12 7503 1 1 37 GLY H H 11.712 8.129 2.403 1.00 . A A . 37 GLY H 1 1 12 7504 1 1 37 GLY HA2 H 14.102 8.181 2.238 1.00 . A A . 37 GLY HA2 1 1 12 7505 1 1 37 GLY HA3 H 13.939 8.793 0.599 1.00 . A A . 37 GLY HA3 1 1 12 7506 1 1 37 GLY N N 12.155 8.400 1.572 1.00 . A A . 37 GLY N 1 1 12 7507 1 1 37 GLY O O 13.279 11.214 1.446 1.00 . A A . 37 GLY O 1 1 12 7508 1 1 38 GLU C C 15.812 12.286 3.547 1.00 . A A . 38 GLU C 1 1 12 7509 1 1 38 GLU CA C 14.444 11.716 3.910 1.00 . A A . 38 GLU CA 1 1 12 7510 1 1 38 GLU CB C 14.303 11.628 5.431 1.00 . A A . 38 GLU CB 1 1 12 7511 1 1 38 GLU CD C 14.873 13.964 6.204 1.00 . A A . 38 GLU CD 1 1 12 7512 1 1 38 GLU CG C 13.793 12.908 6.070 1.00 . A A . 38 GLU CG 1 1 12 7513 1 1 38 GLU H H 14.551 9.605 3.791 1.00 . A A . 38 GLU H 1 1 12 7514 1 1 38 GLU HA H 13.680 12.373 3.525 1.00 . A A . 38 GLU HA 1 1 12 7515 1 1 38 GLU HB2 H 13.615 10.831 5.672 1.00 . A A . 38 GLU HB2 1 1 12 7516 1 1 38 GLU HB3 H 15.269 11.398 5.857 1.00 . A A . 38 GLU HB3 1 1 12 7517 1 1 38 GLU HG2 H 12.995 13.307 5.461 1.00 . A A . 38 GLU HG2 1 1 12 7518 1 1 38 GLU HG3 H 13.412 12.678 7.054 1.00 . A A . 38 GLU HG3 1 1 12 7519 1 1 38 GLU N N 14.252 10.402 3.307 1.00 . A A . 38 GLU N 1 1 12 7520 1 1 38 GLU O O 16.491 12.883 4.384 1.00 . A A . 38 GLU O 1 1 12 7521 1 1 38 GLU OE1 O 15.892 13.690 6.872 1.00 . A A . 38 GLU OE1 1 1 12 7522 1 1 38 GLU OE2 O 14.699 15.065 5.640 1.00 . A A . 38 GLU OE2 1 1 12 7523 1 1 39 LYS C C 17.506 12.710 0.297 1.00 . A A . 39 LYS C 1 1 12 7524 1 1 39 LYS CA C 17.497 12.594 1.818 1.00 . A A . 39 LYS CA 1 1 12 7525 1 1 39 LYS CB C 18.626 11.667 2.276 1.00 . A A . 39 LYS CB 1 1 12 7526 1 1 39 LYS CD C 19.727 9.416 2.105 1.00 . A A . 39 LYS CD 1 1 12 7527 1 1 39 LYS CE C 19.638 8.015 1.519 1.00 . A A . 39 LYS CE 1 1 12 7528 1 1 39 LYS CG C 18.536 10.267 1.696 1.00 . A A . 39 LYS CG 1 1 12 7529 1 1 39 LYS H H 15.626 11.615 1.674 1.00 . A A . 39 LYS H 1 1 12 7530 1 1 39 LYS HA H 17.653 13.574 2.243 1.00 . A A . 39 LYS HA 1 1 12 7531 1 1 39 LYS HB2 H 19.571 12.097 1.980 1.00 . A A . 39 LYS HB2 1 1 12 7532 1 1 39 LYS HB3 H 18.597 11.590 3.354 1.00 . A A . 39 LYS HB3 1 1 12 7533 1 1 39 LYS HD2 H 20.632 9.885 1.751 1.00 . A A . 39 LYS HD2 1 1 12 7534 1 1 39 LYS HD3 H 19.754 9.345 3.183 1.00 . A A . 39 LYS HD3 1 1 12 7535 1 1 39 LYS HE2 H 18.951 7.433 2.114 1.00 . A A . 39 LYS HE2 1 1 12 7536 1 1 39 LYS HE3 H 19.269 8.085 0.507 1.00 . A A . 39 LYS HE3 1 1 12 7537 1 1 39 LYS HG2 H 17.632 9.796 2.052 1.00 . A A . 39 LYS HG2 1 1 12 7538 1 1 39 LYS HG3 H 18.508 10.335 0.617 1.00 . A A . 39 LYS HG3 1 1 12 7539 1 1 39 LYS HZ1 H 20.900 6.419 1.994 1.00 . A A . 39 LYS HZ1 1 1 12 7540 1 1 39 LYS HZ2 H 21.672 7.924 1.987 1.00 . A A . 39 LYS HZ2 1 1 12 7541 1 1 39 LYS HZ3 H 21.272 7.173 0.526 1.00 . A A . 39 LYS HZ3 1 1 12 7542 1 1 39 LYS N N 16.211 12.098 2.294 1.00 . A A . 39 LYS N 1 1 12 7543 1 1 39 LYS NZ N 20.963 7.335 1.506 1.00 . A A . 39 LYS NZ 1 1 12 7544 1 1 39 LYS O O 16.796 11.993 -0.408 1.00 . A A . 39 LYS O 1 1 12 7545 1 1 40 PRO C C 19.140 12.704 -2.380 1.00 . A A . 40 PRO C 1 1 12 7546 1 1 40 PRO CA C 18.452 13.862 -1.665 1.00 . A A . 40 PRO CA 1 1 12 7547 1 1 40 PRO CB C 19.308 15.128 -1.751 1.00 . A A . 40 PRO CB 1 1 12 7548 1 1 40 PRO CD C 19.205 14.522 0.559 1.00 . A A . 40 PRO CD 1 1 12 7549 1 1 40 PRO CG C 20.093 15.142 -0.485 1.00 . A A . 40 PRO CG 1 1 12 7550 1 1 40 PRO HA H 17.490 14.044 -2.121 1.00 . A A . 40 PRO HA 1 1 12 7551 1 1 40 PRO HB2 H 19.954 15.071 -2.616 1.00 . A A . 40 PRO HB2 1 1 12 7552 1 1 40 PRO HB3 H 18.669 15.995 -1.829 1.00 . A A . 40 PRO HB3 1 1 12 7553 1 1 40 PRO HD2 H 19.793 13.959 1.269 1.00 . A A . 40 PRO HD2 1 1 12 7554 1 1 40 PRO HD3 H 18.628 15.283 1.064 1.00 . A A . 40 PRO HD3 1 1 12 7555 1 1 40 PRO HG2 H 20.994 14.560 -0.604 1.00 . A A . 40 PRO HG2 1 1 12 7556 1 1 40 PRO HG3 H 20.335 16.159 -0.214 1.00 . A A . 40 PRO HG3 1 1 12 7557 1 1 40 PRO N N 18.330 13.633 -0.222 1.00 . A A . 40 PRO N 1 1 12 7558 1 1 40 PRO O O 19.273 12.708 -3.603 1.00 . A A . 40 PRO O 1 1 12 7559 1 1 41 SER C C 19.324 9.340 -2.193 1.00 . A A . 41 SER C 1 1 12 7560 1 1 41 SER CA C 20.253 10.550 -2.168 1.00 . A A . 41 SER CA 1 1 12 7561 1 1 41 SER CB C 21.510 10.225 -1.357 1.00 . A A . 41 SER CB 1 1 12 7562 1 1 41 SER H H 19.441 11.768 -0.639 1.00 . A A . 41 SER H 1 1 12 7563 1 1 41 SER HA H 20.541 10.789 -3.181 1.00 . A A . 41 SER HA 1 1 12 7564 1 1 41 SER HB2 H 21.242 10.101 -0.319 1.00 . A A . 41 SER HB2 1 1 12 7565 1 1 41 SER HB3 H 21.948 9.310 -1.728 1.00 . A A . 41 SER HB3 1 1 12 7566 1 1 41 SER HG H 23.228 11.055 -0.916 1.00 . A A . 41 SER HG 1 1 12 7567 1 1 41 SER N N 19.576 11.713 -1.608 1.00 . A A . 41 SER N 1 1 12 7568 1 1 41 SER O O 18.287 9.326 -1.531 1.00 . A A . 41 SER O 1 1 12 7569 1 1 41 SER OG O 22.467 11.265 -1.461 1.00 . A A . 41 SER OG 1 1 12 7570 1 1 42 GLY C C 18.432 6.852 -4.479 1.00 . A A . 42 GLY C 1 1 12 7571 1 1 42 GLY CA C 18.896 7.124 -3.062 1.00 . A A . 42 GLY CA 1 1 12 7572 1 1 42 GLY H H 20.542 8.392 -3.469 1.00 . A A . 42 GLY H 1 1 12 7573 1 1 42 GLY HA2 H 19.477 6.283 -2.716 1.00 . A A . 42 GLY HA2 1 1 12 7574 1 1 42 GLY HA3 H 18.029 7.236 -2.427 1.00 . A A . 42 GLY HA3 1 1 12 7575 1 1 42 GLY N N 19.705 8.325 -2.963 1.00 . A A . 42 GLY N 1 1 12 7576 1 1 42 GLY O O 18.281 7.765 -5.292 1.00 . A A . 42 GLY O 1 1 12 7577 1 1 43 PRO C C 16.315 5.583 -6.413 1.00 . A A . 43 PRO C 1 1 12 7578 1 1 43 PRO CA C 17.748 5.150 -6.124 1.00 . A A . 43 PRO CA 1 1 12 7579 1 1 43 PRO CB C 17.844 3.623 -6.066 1.00 . A A . 43 PRO CB 1 1 12 7580 1 1 43 PRO CD C 18.358 4.430 -3.875 1.00 . A A . 43 PRO CD 1 1 12 7581 1 1 43 PRO CG C 17.718 3.291 -4.619 1.00 . A A . 43 PRO CG 1 1 12 7582 1 1 43 PRO HA H 18.400 5.524 -6.900 1.00 . A A . 43 PRO HA 1 1 12 7583 1 1 43 PRO HB2 H 17.041 3.187 -6.644 1.00 . A A . 43 PRO HB2 1 1 12 7584 1 1 43 PRO HB3 H 18.796 3.303 -6.463 1.00 . A A . 43 PRO HB3 1 1 12 7585 1 1 43 PRO HD2 H 17.842 4.610 -2.944 1.00 . A A . 43 PRO HD2 1 1 12 7586 1 1 43 PRO HD3 H 19.403 4.223 -3.695 1.00 . A A . 43 PRO HD3 1 1 12 7587 1 1 43 PRO HG2 H 16.676 3.206 -4.351 1.00 . A A . 43 PRO HG2 1 1 12 7588 1 1 43 PRO HG3 H 18.238 2.367 -4.409 1.00 . A A . 43 PRO HG3 1 1 12 7589 1 1 43 PRO N N 18.199 5.569 -4.794 1.00 . A A . 43 PRO N 1 1 12 7590 1 1 43 PRO O O 15.702 6.301 -5.624 1.00 . A A . 43 PRO O 1 1 12 7591 1 1 44 SER C C 13.613 4.230 -8.248 1.00 . A A . 44 SER C 1 1 12 7592 1 1 44 SER CA C 14.425 5.485 -7.944 1.00 . A A . 44 SER CA 1 1 12 7593 1 1 44 SER CB C 14.444 6.403 -9.168 1.00 . A A . 44 SER CB 1 1 12 7594 1 1 44 SER H H 16.325 4.570 -8.137 1.00 . A A . 44 SER H 1 1 12 7595 1 1 44 SER HA H 13.963 6.008 -7.120 1.00 . A A . 44 SER HA 1 1 12 7596 1 1 44 SER HB2 H 15.125 7.221 -8.991 1.00 . A A . 44 SER HB2 1 1 12 7597 1 1 44 SER HB3 H 14.771 5.841 -10.031 1.00 . A A . 44 SER HB3 1 1 12 7598 1 1 44 SER HG H 12.996 7.686 -8.858 1.00 . A A . 44 SER HG 1 1 12 7599 1 1 44 SER N N 15.786 5.140 -7.549 1.00 . A A . 44 SER N 1 1 12 7600 1 1 44 SER O O 14.159 3.130 -8.338 1.00 . A A . 44 SER O 1 1 12 7601 1 1 44 SER OG O 13.155 6.931 -9.429 1.00 . A A . 44 SER OG 1 1 12 7602 1 1 45 SER C C 10.302 3.708 -9.649 1.00 . A A . 45 SER C 1 1 12 7603 1 1 45 SER CA C 11.415 3.284 -8.695 1.00 . A A . 45 SER CA 1 1 12 7604 1 1 45 SER CB C 10.812 2.736 -7.401 1.00 . A A . 45 SER CB 1 1 12 7605 1 1 45 SER H H 11.928 5.304 -8.321 1.00 . A A . 45 SER H 1 1 12 7606 1 1 45 SER HA H 12.000 2.509 -9.166 1.00 . A A . 45 SER HA 1 1 12 7607 1 1 45 SER HB2 H 10.535 3.559 -6.759 1.00 . A A . 45 SER HB2 1 1 12 7608 1 1 45 SER HB3 H 9.934 2.151 -7.635 1.00 . A A . 45 SER HB3 1 1 12 7609 1 1 45 SER HG H 11.359 1.629 -5.879 1.00 . A A . 45 SER HG 1 1 12 7610 1 1 45 SER N N 12.304 4.403 -8.405 1.00 . A A . 45 SER N 1 1 12 7611 1 1 45 SER O O 10.002 4.894 -9.783 1.00 . A A . 45 SER O 1 1 12 7612 1 1 45 SER OG O 11.739 1.913 -6.714 1.00 . A A . 45 SER OG 1 1 12 7613 1 1 46 GLY C C 8.651 2.119 -12.461 1.00 . A A . 46 GLY C 1 1 12 7614 1 1 46 GLY CA C 8.619 3.019 -11.242 1.00 . A A . 46 GLY CA 1 1 12 7615 1 1 46 GLY H H 9.973 1.802 -10.162 1.00 . A A . 46 GLY H 1 1 12 7616 1 1 46 GLY HA2 H 7.673 2.891 -10.738 1.00 . A A . 46 GLY HA2 1 1 12 7617 1 1 46 GLY HA3 H 8.707 4.046 -11.566 1.00 . A A . 46 GLY HA3 1 1 12 7618 1 1 46 GLY N N 9.692 2.729 -10.309 1.00 . A A . 46 GLY N 1 1 12 7619 1 1 46 GLY O O 9.644 2.129 -13.188 1.00 . A A . 46 GLY O 1 1 12 7620 2 2 1 ZN ZN ZN 6.662 -0.962 3.590 1.00 . B A . 181 ZN ZN 1 1 13 7621 1 1 1 GLY C C -9.085 -30.270 -3.700 1.00 . A A . 1 GLY C 1 1 13 7622 1 1 1 GLY CA C -10.415 -30.316 -4.425 1.00 . A A . 1 GLY CA 1 1 13 7623 1 1 1 GLY H1 H -10.912 -31.591 -6.041 1.00 . A A . 1 GLY H1 1 1 13 7624 1 1 1 GLY HA2 H -10.807 -29.313 -4.500 1.00 . A A . 1 GLY HA2 1 1 13 7625 1 1 1 GLY HA3 H -11.104 -30.918 -3.851 1.00 . A A . 1 GLY HA3 1 1 13 7626 1 1 1 GLY N N -10.302 -30.877 -5.759 1.00 . A A . 1 GLY N 1 1 13 7627 1 1 1 GLY O O -8.068 -29.887 -4.279 1.00 . A A . 1 GLY O 1 1 13 7628 1 1 2 SER C C -7.115 -29.346 -1.792 1.00 . A A . 2 SER C 1 1 13 7629 1 1 2 SER CA C -7.875 -30.658 -1.624 1.00 . A A . 2 SER CA 1 1 13 7630 1 1 2 SER CB C -6.977 -31.834 -2.012 1.00 . A A . 2 SER CB 1 1 13 7631 1 1 2 SER H H -9.933 -30.957 -2.025 1.00 . A A . 2 SER H 1 1 13 7632 1 1 2 SER HA H -8.164 -30.763 -0.589 1.00 . A A . 2 SER HA 1 1 13 7633 1 1 2 SER HB2 H -7.592 -32.678 -2.285 1.00 . A A . 2 SER HB2 1 1 13 7634 1 1 2 SER HB3 H -6.361 -31.550 -2.852 1.00 . A A . 2 SER HB3 1 1 13 7635 1 1 2 SER HG H -6.567 -32.896 -0.417 1.00 . A A . 2 SER HG 1 1 13 7636 1 1 2 SER N N -9.090 -30.662 -2.430 1.00 . A A . 2 SER N 1 1 13 7637 1 1 2 SER O O -5.889 -29.336 -1.899 1.00 . A A . 2 SER O 1 1 13 7638 1 1 2 SER OG O -6.137 -32.211 -0.935 1.00 . A A . 2 SER OG 1 1 13 7639 1 1 3 SER C C -6.480 -26.523 -0.718 1.00 . A A . 3 SER C 1 1 13 7640 1 1 3 SER CA C -7.251 -26.922 -1.972 1.00 . A A . 3 SER CA 1 1 13 7641 1 1 3 SER CB C -8.328 -25.879 -2.277 1.00 . A A . 3 SER CB 1 1 13 7642 1 1 3 SER H H -8.827 -28.314 -1.723 1.00 . A A . 3 SER H 1 1 13 7643 1 1 3 SER HA H -6.563 -26.970 -2.803 1.00 . A A . 3 SER HA 1 1 13 7644 1 1 3 SER HB2 H -8.795 -26.113 -3.222 1.00 . A A . 3 SER HB2 1 1 13 7645 1 1 3 SER HB3 H -9.072 -25.895 -1.494 1.00 . A A . 3 SER HB3 1 1 13 7646 1 1 3 SER HG H -6.843 -24.640 -2.590 1.00 . A A . 3 SER HG 1 1 13 7647 1 1 3 SER N N -7.853 -28.241 -1.814 1.00 . A A . 3 SER N 1 1 13 7648 1 1 3 SER O O -6.903 -26.808 0.402 1.00 . A A . 3 SER O 1 1 13 7649 1 1 3 SER OG O -7.771 -24.578 -2.353 1.00 . A A . 3 SER OG 1 1 13 7650 1 1 4 GLY C C -3.216 -24.818 -0.228 1.00 . A A . 4 GLY C 1 1 13 7651 1 1 4 GLY CA C -4.532 -25.430 0.209 1.00 . A A . 4 GLY CA 1 1 13 7652 1 1 4 GLY H H -5.057 -25.659 -1.830 1.00 . A A . 4 GLY H 1 1 13 7653 1 1 4 GLY HA2 H -5.085 -24.700 0.781 1.00 . A A . 4 GLY HA2 1 1 13 7654 1 1 4 GLY HA3 H -4.327 -26.285 0.837 1.00 . A A . 4 GLY HA3 1 1 13 7655 1 1 4 GLY N N -5.345 -25.859 -0.914 1.00 . A A . 4 GLY N 1 1 13 7656 1 1 4 GLY O O -2.410 -25.470 -0.891 1.00 . A A . 4 GLY O 1 1 13 7657 1 1 5 SER C C -1.198 -22.114 0.983 1.00 . A A . 5 SER C 1 1 13 7658 1 1 5 SER CA C -1.773 -22.857 -0.218 1.00 . A A . 5 SER CA 1 1 13 7659 1 1 5 SER CB C -2.042 -21.875 -1.360 1.00 . A A . 5 SER CB 1 1 13 7660 1 1 5 SER H H -3.679 -23.094 0.673 1.00 . A A . 5 SER H 1 1 13 7661 1 1 5 SER HA H -1.055 -23.593 -0.549 1.00 . A A . 5 SER HA 1 1 13 7662 1 1 5 SER HB2 H -2.865 -21.230 -1.090 1.00 . A A . 5 SER HB2 1 1 13 7663 1 1 5 SER HB3 H -1.159 -21.277 -1.532 1.00 . A A . 5 SER HB3 1 1 13 7664 1 1 5 SER HG H -1.804 -23.328 -2.651 1.00 . A A . 5 SER HG 1 1 13 7665 1 1 5 SER N N -2.998 -23.560 0.144 1.00 . A A . 5 SER N 1 1 13 7666 1 1 5 SER O O -1.830 -22.030 2.036 1.00 . A A . 5 SER O 1 1 13 7667 1 1 5 SER OG O -2.372 -22.560 -2.555 1.00 . A A . 5 SER OG 1 1 13 7668 1 1 6 SER C C 0.170 -19.401 1.950 1.00 . A A . 6 SER C 1 1 13 7669 1 1 6 SER CA C 0.670 -20.841 1.888 1.00 . A A . 6 SER CA 1 1 13 7670 1 1 6 SER CB C 2.186 -20.859 1.684 1.00 . A A . 6 SER CB 1 1 13 7671 1 1 6 SER H H 0.459 -21.676 -0.046 1.00 . A A . 6 SER H 1 1 13 7672 1 1 6 SER HA H 0.435 -21.332 2.821 1.00 . A A . 6 SER HA 1 1 13 7673 1 1 6 SER HB2 H 2.408 -20.682 0.642 1.00 . A A . 6 SER HB2 1 1 13 7674 1 1 6 SER HB3 H 2.636 -20.082 2.284 1.00 . A A . 6 SER HB3 1 1 13 7675 1 1 6 SER HG H 3.209 -22.010 2.893 1.00 . A A . 6 SER HG 1 1 13 7676 1 1 6 SER N N 0.006 -21.575 0.817 1.00 . A A . 6 SER N 1 1 13 7677 1 1 6 SER O O 0.800 -18.490 1.415 1.00 . A A . 6 SER O 1 1 13 7678 1 1 6 SER OG O 2.737 -22.108 2.063 1.00 . A A . 6 SER OG 1 1 13 7679 1 1 7 GLY C C -2.995 -17.899 3.133 1.00 . A A . 7 GLY C 1 1 13 7680 1 1 7 GLY CA C -1.534 -17.873 2.730 1.00 . A A . 7 GLY CA 1 1 13 7681 1 1 7 GLY H H -1.427 -19.968 3.016 1.00 . A A . 7 GLY H 1 1 13 7682 1 1 7 GLY HA2 H -0.976 -17.322 3.472 1.00 . A A . 7 GLY HA2 1 1 13 7683 1 1 7 GLY HA3 H -1.444 -17.368 1.779 1.00 . A A . 7 GLY HA3 1 1 13 7684 1 1 7 GLY N N -0.968 -19.204 2.609 1.00 . A A . 7 GLY N 1 1 13 7685 1 1 7 GLY O O -3.873 -18.139 2.303 1.00 . A A . 7 GLY O 1 1 13 7686 1 1 8 THR C C -5.302 -16.309 4.680 1.00 . A A . 8 THR C 1 1 13 7687 1 1 8 THR CA C -4.623 -17.652 4.925 1.00 . A A . 8 THR CA 1 1 13 7688 1 1 8 THR CB C -4.657 -17.963 6.434 1.00 . A A . 8 THR CB 1 1 13 7689 1 1 8 THR CG2 C -6.089 -18.127 6.920 1.00 . A A . 8 THR CG2 1 1 13 7690 1 1 8 THR H H -2.517 -17.469 5.026 1.00 . A A . 8 THR H 1 1 13 7691 1 1 8 THR HA H -5.175 -18.423 4.407 1.00 . A A . 8 THR HA 1 1 13 7692 1 1 8 THR HB H -4.203 -17.139 6.966 1.00 . A A . 8 THR HB 1 1 13 7693 1 1 8 THR HG1 H -4.222 -19.545 7.528 1.00 . A A . 8 THR HG1 1 1 13 7694 1 1 8 THR HG21 H -6.362 -19.171 6.890 1.00 . A A . 8 THR HG21 1 1 13 7695 1 1 8 THR HG22 H -6.753 -17.563 6.282 1.00 . A A . 8 THR HG22 1 1 13 7696 1 1 8 THR HG23 H -6.168 -17.763 7.934 1.00 . A A . 8 THR HG23 1 1 13 7697 1 1 8 THR N N -3.259 -17.653 4.413 1.00 . A A . 8 THR N 1 1 13 7698 1 1 8 THR O O -4.857 -15.277 5.180 1.00 . A A . 8 THR O 1 1 13 7699 1 1 8 THR OG1 O -3.916 -19.158 6.704 1.00 . A A . 8 THR OG1 1 1 13 7700 1 1 9 GLY C C -6.185 -13.970 3.214 1.00 . A A . 9 GLY C 1 1 13 7701 1 1 9 GLY CA C -7.106 -15.107 3.609 1.00 . A A . 9 GLY CA 1 1 13 7702 1 1 9 GLY H H -6.693 -17.182 3.535 1.00 . A A . 9 GLY H 1 1 13 7703 1 1 9 GLY HA2 H -7.795 -15.297 2.799 1.00 . A A . 9 GLY HA2 1 1 13 7704 1 1 9 GLY HA3 H -7.667 -14.812 4.484 1.00 . A A . 9 GLY HA3 1 1 13 7705 1 1 9 GLY N N -6.383 -16.330 3.907 1.00 . A A . 9 GLY N 1 1 13 7706 1 1 9 GLY O O -5.653 -13.267 4.073 1.00 . A A . 9 GLY O 1 1 13 7707 1 1 10 GLU C C -5.664 -11.357 1.795 1.00 . A A . 10 GLU C 1 1 13 7708 1 1 10 GLU CA C -5.128 -12.732 1.405 1.00 . A A . 10 GLU CA 1 1 13 7709 1 1 10 GLU CB C -5.002 -12.829 -0.117 1.00 . A A . 10 GLU CB 1 1 13 7710 1 1 10 GLU CD C -6.172 -12.706 -2.352 1.00 . A A . 10 GLU CD 1 1 13 7711 1 1 10 GLU CG C -6.333 -12.744 -0.844 1.00 . A A . 10 GLU CG 1 1 13 7712 1 1 10 GLU H H -6.446 -14.383 1.275 1.00 . A A . 10 GLU H 1 1 13 7713 1 1 10 GLU HA H -4.152 -12.863 1.847 1.00 . A A . 10 GLU HA 1 1 13 7714 1 1 10 GLU HB2 H -4.371 -12.025 -0.466 1.00 . A A . 10 GLU HB2 1 1 13 7715 1 1 10 GLU HB3 H -4.539 -13.772 -0.367 1.00 . A A . 10 GLU HB3 1 1 13 7716 1 1 10 GLU HG2 H -6.928 -13.606 -0.583 1.00 . A A . 10 GLU HG2 1 1 13 7717 1 1 10 GLU HG3 H -6.844 -11.846 -0.529 1.00 . A A . 10 GLU HG3 1 1 13 7718 1 1 10 GLU N N -5.994 -13.790 1.911 1.00 . A A . 10 GLU N 1 1 13 7719 1 1 10 GLU O O -6.648 -11.246 2.527 1.00 . A A . 10 GLU O 1 1 13 7720 1 1 10 GLU OE1 O -5.766 -11.650 -2.880 1.00 . A A . 10 GLU OE1 1 1 13 7721 1 1 10 GLU OE2 O -6.454 -13.734 -3.004 1.00 . A A . 10 GLU OE2 1 1 13 7722 1 1 11 LYS C C -5.481 -8.108 0.321 1.00 . A A . 11 LYS C 1 1 13 7723 1 1 11 LYS CA C -5.418 -8.944 1.596 1.00 . A A . 11 LYS CA 1 1 13 7724 1 1 11 LYS CB C -4.448 -8.303 2.591 1.00 . A A . 11 LYS CB 1 1 13 7725 1 1 11 LYS CD C -2.182 -9.341 2.282 1.00 . A A . 11 LYS CD 1 1 13 7726 1 1 11 LYS CE C -1.652 -9.376 3.707 1.00 . A A . 11 LYS CE 1 1 13 7727 1 1 11 LYS CG C -3.046 -8.115 2.039 1.00 . A A . 11 LYS CG 1 1 13 7728 1 1 11 LYS H H -4.232 -10.464 0.723 1.00 . A A . 11 LYS H 1 1 13 7729 1 1 11 LYS HA H -6.402 -8.979 2.038 1.00 . A A . 11 LYS HA 1 1 13 7730 1 1 11 LYS HB2 H -4.832 -7.335 2.878 1.00 . A A . 11 LYS HB2 1 1 13 7731 1 1 11 LYS HB3 H -4.386 -8.930 3.469 1.00 . A A . 11 LYS HB3 1 1 13 7732 1 1 11 LYS HD2 H -2.773 -10.228 2.108 1.00 . A A . 11 LYS HD2 1 1 13 7733 1 1 11 LYS HD3 H -1.346 -9.323 1.596 1.00 . A A . 11 LYS HD3 1 1 13 7734 1 1 11 LYS HE2 H -0.944 -8.571 3.834 1.00 . A A . 11 LYS HE2 1 1 13 7735 1 1 11 LYS HE3 H -2.479 -9.238 4.388 1.00 . A A . 11 LYS HE3 1 1 13 7736 1 1 11 LYS HG2 H -3.108 -7.937 0.975 1.00 . A A . 11 LYS HG2 1 1 13 7737 1 1 11 LYS HG3 H -2.590 -7.263 2.522 1.00 . A A . 11 LYS HG3 1 1 13 7738 1 1 11 LYS HZ1 H -1.453 -11.447 3.520 1.00 . A A . 11 LYS HZ1 1 1 13 7739 1 1 11 LYS HZ2 H -1.012 -10.851 5.040 1.00 . A A . 11 LYS HZ2 1 1 13 7740 1 1 11 LYS HZ3 H 0.017 -10.632 3.715 1.00 . A A . 11 LYS HZ3 1 1 13 7741 1 1 11 LYS N N -5.009 -10.312 1.301 1.00 . A A . 11 LYS N 1 1 13 7742 1 1 11 LYS NZ N -0.978 -10.667 4.017 1.00 . A A . 11 LYS NZ 1 1 13 7743 1 1 11 LYS O O -4.667 -8.260 -0.590 1.00 . A A . 11 LYS O 1 1 13 7744 1 1 12 PRO C C -5.558 -5.276 -1.023 1.00 . A A . 12 PRO C 1 1 13 7745 1 1 12 PRO CA C -6.659 -6.324 -0.903 1.00 . A A . 12 PRO CA 1 1 13 7746 1 1 12 PRO CB C -8.006 -5.654 -0.621 1.00 . A A . 12 PRO CB 1 1 13 7747 1 1 12 PRO CD C -7.474 -6.967 1.304 1.00 . A A . 12 PRO CD 1 1 13 7748 1 1 12 PRO CG C -8.149 -5.698 0.861 1.00 . A A . 12 PRO CG 1 1 13 7749 1 1 12 PRO HA H -6.721 -6.887 -1.823 1.00 . A A . 12 PRO HA 1 1 13 7750 1 1 12 PRO HB2 H -7.989 -4.636 -0.987 1.00 . A A . 12 PRO HB2 1 1 13 7751 1 1 12 PRO HB3 H -8.796 -6.204 -1.110 1.00 . A A . 12 PRO HB3 1 1 13 7752 1 1 12 PRO HD2 H -7.003 -6.828 2.265 1.00 . A A . 12 PRO HD2 1 1 13 7753 1 1 12 PRO HD3 H -8.186 -7.779 1.344 1.00 . A A . 12 PRO HD3 1 1 13 7754 1 1 12 PRO HG2 H -7.663 -4.841 1.302 1.00 . A A . 12 PRO HG2 1 1 13 7755 1 1 12 PRO HG3 H -9.195 -5.718 1.128 1.00 . A A . 12 PRO HG3 1 1 13 7756 1 1 12 PRO N N -6.468 -7.203 0.254 1.00 . A A . 12 PRO N 1 1 13 7757 1 1 12 PRO O O -5.438 -4.602 -2.047 1.00 . A A . 12 PRO O 1 1 13 7758 1 1 13 TYR C C -2.463 -4.722 0.805 1.00 . A A . 13 TYR C 1 1 13 7759 1 1 13 TYR CA C -3.665 -4.177 0.040 1.00 . A A . 13 TYR CA 1 1 13 7760 1 1 13 TYR CB C -4.129 -2.862 0.667 1.00 . A A . 13 TYR CB 1 1 13 7761 1 1 13 TYR CD1 C -5.747 -1.827 -0.974 1.00 . A A . 13 TYR CD1 1 1 13 7762 1 1 13 TYR CD2 C -6.615 -2.684 1.074 1.00 . A A . 13 TYR CD2 1 1 13 7763 1 1 13 TYR CE1 C -7.018 -1.449 -1.360 1.00 . A A . 13 TYR CE1 1 1 13 7764 1 1 13 TYR CE2 C -7.890 -2.310 0.695 1.00 . A A . 13 TYR CE2 1 1 13 7765 1 1 13 TYR CG C -5.523 -2.450 0.248 1.00 . A A . 13 TYR CG 1 1 13 7766 1 1 13 TYR CZ C -8.086 -1.692 -0.522 1.00 . A A . 13 TYR CZ 1 1 13 7767 1 1 13 TYR H H -4.901 -5.710 0.814 1.00 . A A . 13 TYR H 1 1 13 7768 1 1 13 TYR HA H -3.373 -3.993 -0.984 1.00 . A A . 13 TYR HA 1 1 13 7769 1 1 13 TYR HB2 H -4.123 -2.961 1.741 1.00 . A A . 13 TYR HB2 1 1 13 7770 1 1 13 TYR HB3 H -3.449 -2.073 0.379 1.00 . A A . 13 TYR HB3 1 1 13 7771 1 1 13 TYR HD1 H -4.907 -1.638 -1.628 1.00 . A A . 13 TYR HD1 1 1 13 7772 1 1 13 TYR HD2 H -6.458 -3.168 2.027 1.00 . A A . 13 TYR HD2 1 1 13 7773 1 1 13 TYR HE1 H -7.171 -0.965 -2.314 1.00 . A A . 13 TYR HE1 1 1 13 7774 1 1 13 TYR HE2 H -8.727 -2.500 1.351 1.00 . A A . 13 TYR HE2 1 1 13 7775 1 1 13 TYR HH H -9.712 -0.701 -0.262 1.00 . A A . 13 TYR HH 1 1 13 7776 1 1 13 TYR N N -4.756 -5.145 0.027 1.00 . A A . 13 TYR N 1 1 13 7777 1 1 13 TYR O O -2.581 -5.127 1.961 1.00 . A A . 13 TYR O 1 1 13 7778 1 1 13 TYR OH O -9.354 -1.318 -0.904 1.00 . A A . 13 TYR OH 1 1 13 7779 1 1 14 GLU C C 1.148 -4.581 0.129 1.00 . A A . 14 GLU C 1 1 13 7780 1 1 14 GLU CA C -0.081 -5.221 0.768 1.00 . A A . 14 GLU CA 1 1 13 7781 1 1 14 GLU CB C 0.000 -6.744 0.643 1.00 . A A . 14 GLU CB 1 1 13 7782 1 1 14 GLU CD C 1.577 -8.718 0.612 1.00 . A A . 14 GLU CD 1 1 13 7783 1 1 14 GLU CG C 1.307 -7.328 1.155 1.00 . A A . 14 GLU CG 1 1 13 7784 1 1 14 GLU H H -1.275 -4.391 -0.770 1.00 . A A . 14 GLU H 1 1 13 7785 1 1 14 GLU HA H -0.107 -4.956 1.814 1.00 . A A . 14 GLU HA 1 1 13 7786 1 1 14 GLU HB2 H -0.811 -7.183 1.204 1.00 . A A . 14 GLU HB2 1 1 13 7787 1 1 14 GLU HB3 H -0.106 -7.014 -0.397 1.00 . A A . 14 GLU HB3 1 1 13 7788 1 1 14 GLU HG2 H 2.117 -6.679 0.859 1.00 . A A . 14 GLU HG2 1 1 13 7789 1 1 14 GLU HG3 H 1.265 -7.380 2.233 1.00 . A A . 14 GLU HG3 1 1 13 7790 1 1 14 GLU N N -1.306 -4.727 0.150 1.00 . A A . 14 GLU N 1 1 13 7791 1 1 14 GLU O O 1.375 -4.712 -1.074 1.00 . A A . 14 GLU O 1 1 13 7792 1 1 14 GLU OE1 O 1.499 -8.899 -0.621 1.00 . A A . 14 GLU OE1 1 1 13 7793 1 1 14 GLU OE2 O 1.867 -9.624 1.421 1.00 . A A . 14 GLU OE2 1 1 13 7794 1 1 15 CYS C C 4.028 -4.202 -0.311 1.00 . A A . 15 CYS C 1 1 13 7795 1 1 15 CYS CA C 3.143 -3.226 0.459 1.00 . A A . 15 CYS CA 1 1 13 7796 1 1 15 CYS CB C 3.924 -2.625 1.629 1.00 . A A . 15 CYS CB 1 1 13 7797 1 1 15 CYS H H 1.703 -3.820 1.893 1.00 . A A . 15 CYS H 1 1 13 7798 1 1 15 CYS HA H 2.841 -2.431 -0.207 1.00 . A A . 15 CYS HA 1 1 13 7799 1 1 15 CYS HB2 H 3.229 -2.175 2.323 1.00 . A A . 15 CYS HB2 1 1 13 7800 1 1 15 CYS HB3 H 4.468 -3.412 2.131 1.00 . A A . 15 CYS HB3 1 1 13 7801 1 1 15 CYS N N 1.937 -3.888 0.943 1.00 . A A . 15 CYS N 1 1 13 7802 1 1 15 CYS O O 3.794 -5.411 -0.299 1.00 . A A . 15 CYS O 1 1 13 7803 1 1 15 CYS SG S 5.125 -1.345 1.142 1.00 . A A . 15 CYS SG 1 1 13 7804 1 1 16 ASP C C 7.382 -4.395 -1.195 1.00 . A A . 16 ASP C 1 1 13 7805 1 1 16 ASP CA C 5.966 -4.492 -1.754 1.00 . A A . 16 ASP CA 1 1 13 7806 1 1 16 ASP CB C 5.954 -4.065 -3.223 1.00 . A A . 16 ASP CB 1 1 13 7807 1 1 16 ASP CG C 4.758 -4.614 -3.975 1.00 . A A . 16 ASP CG 1 1 13 7808 1 1 16 ASP H H 5.179 -2.698 -0.951 1.00 . A A . 16 ASP H 1 1 13 7809 1 1 16 ASP HA H 5.634 -5.517 -1.684 1.00 . A A . 16 ASP HA 1 1 13 7810 1 1 16 ASP HB2 H 5.925 -2.986 -3.277 1.00 . A A . 16 ASP HB2 1 1 13 7811 1 1 16 ASP HB3 H 6.853 -4.422 -3.702 1.00 . A A . 16 ASP HB3 1 1 13 7812 1 1 16 ASP N N 5.044 -3.669 -0.979 1.00 . A A . 16 ASP N 1 1 13 7813 1 1 16 ASP O O 8.166 -5.339 -1.294 1.00 . A A . 16 ASP O 1 1 13 7814 1 1 16 ASP OD1 O 3.673 -4.726 -3.366 1.00 . A A . 16 ASP OD1 1 1 13 7815 1 1 16 ASP OD2 O 4.906 -4.931 -5.174 1.00 . A A . 16 ASP OD2 1 1 13 7816 1 1 17 VAL C C 9.176 -3.758 1.296 1.00 . A A . 17 VAL C 1 1 13 7817 1 1 17 VAL CA C 9.026 -3.026 -0.033 1.00 . A A . 17 VAL CA 1 1 13 7818 1 1 17 VAL CB C 9.300 -1.526 0.185 1.00 . A A . 17 VAL CB 1 1 13 7819 1 1 17 VAL CG1 C 10.638 -1.323 0.878 1.00 . A A . 17 VAL CG1 1 1 13 7820 1 1 17 VAL CG2 C 9.257 -0.779 -1.140 1.00 . A A . 17 VAL CG2 1 1 13 7821 1 1 17 VAL H H 7.036 -2.531 -0.560 1.00 . A A . 17 VAL H 1 1 13 7822 1 1 17 VAL HA H 9.760 -3.408 -0.728 1.00 . A A . 17 VAL HA 1 1 13 7823 1 1 17 VAL HB H 8.525 -1.129 0.824 1.00 . A A . 17 VAL HB 1 1 13 7824 1 1 17 VAL HG11 H 11.193 -2.250 0.868 1.00 . A A . 17 VAL HG11 1 1 13 7825 1 1 17 VAL HG12 H 11.201 -0.560 0.359 1.00 . A A . 17 VAL HG12 1 1 13 7826 1 1 17 VAL HG13 H 10.471 -1.015 1.900 1.00 . A A . 17 VAL HG13 1 1 13 7827 1 1 17 VAL HG21 H 10.145 -1.006 -1.710 1.00 . A A . 17 VAL HG21 1 1 13 7828 1 1 17 VAL HG22 H 8.383 -1.085 -1.696 1.00 . A A . 17 VAL HG22 1 1 13 7829 1 1 17 VAL HG23 H 9.211 0.284 -0.952 1.00 . A A . 17 VAL HG23 1 1 13 7830 1 1 17 VAL N N 7.704 -3.247 -0.608 1.00 . A A . 17 VAL N 1 1 13 7831 1 1 17 VAL O O 10.249 -4.268 1.619 1.00 . A A . 17 VAL O 1 1 13 7832 1 1 18 CYS C C 7.096 -5.621 3.387 1.00 . A A . 18 CYS C 1 1 13 7833 1 1 18 CYS CA C 8.102 -4.474 3.360 1.00 . A A . 18 CYS CA 1 1 13 7834 1 1 18 CYS CB C 7.785 -3.476 4.475 1.00 . A A . 18 CYS CB 1 1 13 7835 1 1 18 CYS H H 7.266 -3.379 1.753 1.00 . A A . 18 CYS H 1 1 13 7836 1 1 18 CYS HA H 9.092 -4.876 3.519 1.00 . A A . 18 CYS HA 1 1 13 7837 1 1 18 CYS HB2 H 7.983 -3.940 5.430 1.00 . A A . 18 CYS HB2 1 1 13 7838 1 1 18 CYS HB3 H 8.420 -2.610 4.364 1.00 . A A . 18 CYS HB3 1 1 13 7839 1 1 18 CYS N N 8.093 -3.805 2.065 1.00 . A A . 18 CYS N 1 1 13 7840 1 1 18 CYS O O 7.166 -6.501 4.245 1.00 . A A . 18 CYS O 1 1 13 7841 1 1 18 CYS SG S 6.057 -2.900 4.488 1.00 . A A . 18 CYS SG 1 1 13 7842 1 1 19 ARG C C 4.207 -6.584 3.564 1.00 . A A . 19 ARG C 1 1 13 7843 1 1 19 ARG CA C 5.141 -6.641 2.358 1.00 . A A . 19 ARG CA 1 1 13 7844 1 1 19 ARG CB C 5.793 -8.022 2.270 1.00 . A A . 19 ARG CB 1 1 13 7845 1 1 19 ARG CD C 6.096 -8.218 -0.218 1.00 . A A . 19 ARG CD 1 1 13 7846 1 1 19 ARG CG C 6.793 -8.152 1.132 1.00 . A A . 19 ARG CG 1 1 13 7847 1 1 19 ARG CZ C 6.919 -10.230 -1.367 1.00 . A A . 19 ARG CZ 1 1 13 7848 1 1 19 ARG H H 6.159 -4.876 1.786 1.00 . A A . 19 ARG H 1 1 13 7849 1 1 19 ARG HA H 4.564 -6.467 1.462 1.00 . A A . 19 ARG HA 1 1 13 7850 1 1 19 ARG HB2 H 6.308 -8.225 3.197 1.00 . A A . 19 ARG HB2 1 1 13 7851 1 1 19 ARG HB3 H 5.021 -8.763 2.127 1.00 . A A . 19 ARG HB3 1 1 13 7852 1 1 19 ARG HD2 H 5.161 -8.744 -0.099 1.00 . A A . 19 ARG HD2 1 1 13 7853 1 1 19 ARG HD3 H 5.903 -7.212 -0.557 1.00 . A A . 19 ARG HD3 1 1 13 7854 1 1 19 ARG HE H 7.465 -8.362 -1.806 1.00 . A A . 19 ARG HE 1 1 13 7855 1 1 19 ARG HG2 H 7.451 -7.295 1.144 1.00 . A A . 19 ARG HG2 1 1 13 7856 1 1 19 ARG HG3 H 7.371 -9.053 1.275 1.00 . A A . 19 ARG HG3 1 1 13 7857 1 1 19 ARG HH11 H 5.596 -10.581 0.119 1.00 . A A . 19 ARG HH11 1 1 13 7858 1 1 19 ARG HH12 H 6.184 -11.990 -0.699 1.00 . A A . 19 ARG HH12 1 1 13 7859 1 1 19 ARG HH21 H 8.246 -10.210 -2.892 1.00 . A A . 19 ARG HH21 1 1 13 7860 1 1 19 ARG HH22 H 7.692 -11.778 -2.411 1.00 . A A . 19 ARG HH22 1 1 13 7861 1 1 19 ARG N N 6.162 -5.604 2.442 1.00 . A A . 19 ARG N 1 1 13 7862 1 1 19 ARG NE N 6.905 -8.910 -1.218 1.00 . A A . 19 ARG NE 1 1 13 7863 1 1 19 ARG NH1 N 6.172 -10.996 -0.584 1.00 . A A . 19 ARG NH1 1 1 13 7864 1 1 19 ARG NH2 N 7.682 -10.785 -2.300 1.00 . A A . 19 ARG NH2 1 1 13 7865 1 1 19 ARG O O 3.743 -7.614 4.052 1.00 . A A . 19 ARG O 1 1 13 7866 1 1 20 LYS C C 1.601 -5.413 4.801 1.00 . A A . 20 LYS C 1 1 13 7867 1 1 20 LYS CA C 3.059 -5.180 5.186 1.00 . A A . 20 LYS CA 1 1 13 7868 1 1 20 LYS CB C 3.228 -3.768 5.752 1.00 . A A . 20 LYS CB 1 1 13 7869 1 1 20 LYS CD C 3.697 -3.948 8.214 1.00 . A A . 20 LYS CD 1 1 13 7870 1 1 20 LYS CE C 4.742 -4.513 9.163 1.00 . A A . 20 LYS CE 1 1 13 7871 1 1 20 LYS CG C 4.284 -3.671 6.840 1.00 . A A . 20 LYS CG 1 1 13 7872 1 1 20 LYS H H 4.338 -4.589 3.606 1.00 . A A . 20 LYS H 1 1 13 7873 1 1 20 LYS HA H 3.338 -5.897 5.943 1.00 . A A . 20 LYS HA 1 1 13 7874 1 1 20 LYS HB2 H 3.507 -3.102 4.949 1.00 . A A . 20 LYS HB2 1 1 13 7875 1 1 20 LYS HB3 H 2.284 -3.443 6.167 1.00 . A A . 20 LYS HB3 1 1 13 7876 1 1 20 LYS HD2 H 3.315 -3.026 8.625 1.00 . A A . 20 LYS HD2 1 1 13 7877 1 1 20 LYS HD3 H 2.891 -4.661 8.114 1.00 . A A . 20 LYS HD3 1 1 13 7878 1 1 20 LYS HE2 H 5.590 -3.846 9.183 1.00 . A A . 20 LYS HE2 1 1 13 7879 1 1 20 LYS HE3 H 4.313 -4.579 10.152 1.00 . A A . 20 LYS HE3 1 1 13 7880 1 1 20 LYS HG2 H 5.061 -4.394 6.640 1.00 . A A . 20 LYS HG2 1 1 13 7881 1 1 20 LYS HG3 H 4.705 -2.676 6.832 1.00 . A A . 20 LYS HG3 1 1 13 7882 1 1 20 LYS HZ1 H 6.204 -5.994 8.980 1.00 . A A . 20 LYS HZ1 1 1 13 7883 1 1 20 LYS HZ2 H 5.080 -5.981 7.716 1.00 . A A . 20 LYS HZ2 1 1 13 7884 1 1 20 LYS HZ3 H 4.644 -6.599 9.229 1.00 . A A . 20 LYS HZ3 1 1 13 7885 1 1 20 LYS N N 3.937 -5.373 4.039 1.00 . A A . 20 LYS N 1 1 13 7886 1 1 20 LYS NZ N 5.200 -5.866 8.743 1.00 . A A . 20 LYS NZ 1 1 13 7887 1 1 20 LYS O O 1.293 -5.697 3.645 1.00 . A A . 20 LYS O 1 1 13 7888 1 1 21 ALA C C -1.515 -4.251 5.956 1.00 . A A . 21 ALA C 1 1 13 7889 1 1 21 ALA CA C -0.716 -5.482 5.540 1.00 . A A . 21 ALA CA 1 1 13 7890 1 1 21 ALA CB C -1.213 -6.712 6.285 1.00 . A A . 21 ALA CB 1 1 13 7891 1 1 21 ALA H H 1.016 -5.060 6.680 1.00 . A A . 21 ALA H 1 1 13 7892 1 1 21 ALA HA H -0.858 -5.650 4.482 1.00 . A A . 21 ALA HA 1 1 13 7893 1 1 21 ALA HB1 H -2.272 -6.615 6.474 1.00 . A A . 21 ALA HB1 1 1 13 7894 1 1 21 ALA HB2 H -1.035 -7.592 5.684 1.00 . A A . 21 ALA HB2 1 1 13 7895 1 1 21 ALA HB3 H -0.686 -6.803 7.223 1.00 . A A . 21 ALA HB3 1 1 13 7896 1 1 21 ALA N N 0.709 -5.289 5.778 1.00 . A A . 21 ALA N 1 1 13 7897 1 1 21 ALA O O -1.170 -3.574 6.925 1.00 . A A . 21 ALA O 1 1 13 7898 1 1 22 PHE C C -4.835 -3.021 4.954 1.00 . A A . 22 PHE C 1 1 13 7899 1 1 22 PHE CA C -3.429 -2.816 5.510 1.00 . A A . 22 PHE CA 1 1 13 7900 1 1 22 PHE CB C -2.816 -1.544 4.921 1.00 . A A . 22 PHE CB 1 1 13 7901 1 1 22 PHE CD1 C -0.898 -0.815 6.366 1.00 . A A . 22 PHE CD1 1 1 13 7902 1 1 22 PHE CD2 C -0.412 -1.863 4.280 1.00 . A A . 22 PHE CD2 1 1 13 7903 1 1 22 PHE CE1 C 0.454 -0.686 6.620 1.00 . A A . 22 PHE CE1 1 1 13 7904 1 1 22 PHE CE2 C 0.942 -1.736 4.528 1.00 . A A . 22 PHE CE2 1 1 13 7905 1 1 22 PHE CG C -1.346 -1.404 5.195 1.00 . A A . 22 PHE CG 1 1 13 7906 1 1 22 PHE CZ C 1.376 -1.148 5.700 1.00 . A A . 22 PHE CZ 1 1 13 7907 1 1 22 PHE H H -2.806 -4.545 4.458 1.00 . A A . 22 PHE H 1 1 13 7908 1 1 22 PHE HA H -3.490 -2.714 6.582 1.00 . A A . 22 PHE HA 1 1 13 7909 1 1 22 PHE HB2 H -2.955 -1.547 3.851 1.00 . A A . 22 PHE HB2 1 1 13 7910 1 1 22 PHE HB3 H -3.316 -0.684 5.342 1.00 . A A . 22 PHE HB3 1 1 13 7911 1 1 22 PHE HD1 H -1.618 -0.454 7.087 1.00 . A A . 22 PHE HD1 1 1 13 7912 1 1 22 PHE HD2 H -0.750 -2.324 3.363 1.00 . A A . 22 PHE HD2 1 1 13 7913 1 1 22 PHE HE1 H 0.790 -0.225 7.537 1.00 . A A . 22 PHE HE1 1 1 13 7914 1 1 22 PHE HE2 H 1.660 -2.099 3.807 1.00 . A A . 22 PHE HE2 1 1 13 7915 1 1 22 PHE HZ H 2.433 -1.047 5.896 1.00 . A A . 22 PHE HZ 1 1 13 7916 1 1 22 PHE N N -2.582 -3.967 5.218 1.00 . A A . 22 PHE N 1 1 13 7917 1 1 22 PHE O O -5.034 -3.068 3.740 1.00 . A A . 22 PHE O 1 1 13 7918 1 1 23 SER C C -7.668 -2.222 4.535 1.00 . A A . 23 SER C 1 1 13 7919 1 1 23 SER CA C -7.196 -3.346 5.453 1.00 . A A . 23 SER CA 1 1 13 7920 1 1 23 SER CB C -8.097 -3.425 6.687 1.00 . A A . 23 SER CB 1 1 13 7921 1 1 23 SER H H -5.586 -3.095 6.806 1.00 . A A . 23 SER H 1 1 13 7922 1 1 23 SER HA H -7.252 -4.281 4.916 1.00 . A A . 23 SER HA 1 1 13 7923 1 1 23 SER HB2 H -9.085 -3.740 6.388 1.00 . A A . 23 SER HB2 1 1 13 7924 1 1 23 SER HB3 H -7.686 -4.140 7.384 1.00 . A A . 23 SER HB3 1 1 13 7925 1 1 23 SER HG H -7.317 -1.787 7.427 1.00 . A A . 23 SER HG 1 1 13 7926 1 1 23 SER N N -5.808 -3.142 5.852 1.00 . A A . 23 SER N 1 1 13 7927 1 1 23 SER O O -8.347 -2.464 3.537 1.00 . A A . 23 SER O 1 1 13 7928 1 1 23 SER OG O -8.194 -2.165 7.329 1.00 . A A . 23 SER OG 1 1 13 7929 1 1 24 HIS C C -6.501 0.702 3.290 1.00 . A A . 24 HIS C 1 1 13 7930 1 1 24 HIS CA C -7.688 0.171 4.089 1.00 . A A . 24 HIS CA 1 1 13 7931 1 1 24 HIS CB C -8.241 1.271 4.995 1.00 . A A . 24 HIS CB 1 1 13 7932 1 1 24 HIS CD2 C -9.378 2.472 2.996 1.00 . A A . 24 HIS CD2 1 1 13 7933 1 1 24 HIS CE1 C -9.566 4.467 3.885 1.00 . A A . 24 HIS CE1 1 1 13 7934 1 1 24 HIS CG C -8.858 2.412 4.244 1.00 . A A . 24 HIS CG 1 1 13 7935 1 1 24 HIS H H -6.762 -0.863 5.687 1.00 . A A . 24 HIS H 1 1 13 7936 1 1 24 HIS HA H -8.460 -0.138 3.400 1.00 . A A . 24 HIS HA 1 1 13 7937 1 1 24 HIS HB2 H -8.999 0.851 5.639 1.00 . A A . 24 HIS HB2 1 1 13 7938 1 1 24 HIS HB3 H -7.439 1.667 5.601 1.00 . A A . 24 HIS HB3 1 1 13 7939 1 1 24 HIS HD1 H -8.704 3.956 5.669 1.00 . A A . 24 HIS HD1 1 1 13 7940 1 1 24 HIS HD2 H -9.442 1.658 2.287 1.00 . A A . 24 HIS HD2 1 1 13 7941 1 1 24 HIS HE1 H -9.796 5.513 4.024 1.00 . A A . 24 HIS HE1 1 1 13 7942 1 1 24 HIS N N -7.303 -0.992 4.881 1.00 . A A . 24 HIS N 1 1 13 7943 1 1 24 HIS ND1 N -8.989 3.678 4.774 1.00 . A A . 24 HIS ND1 1 1 13 7944 1 1 24 HIS NE2 N -9.812 3.760 2.797 1.00 . A A . 24 HIS NE2 1 1 13 7945 1 1 24 HIS O O -5.433 0.961 3.845 1.00 . A A . 24 HIS O 1 1 13 7946 1 1 25 HIS C C -4.900 2.523 1.763 1.00 . A A . 25 HIS C 1 1 13 7947 1 1 25 HIS CA C -5.641 1.361 1.110 1.00 . A A . 25 HIS CA 1 1 13 7948 1 1 25 HIS CB C -6.229 1.804 -0.230 1.00 . A A . 25 HIS CB 1 1 13 7949 1 1 25 HIS CD2 C -5.469 1.294 -2.657 1.00 . A A . 25 HIS CD2 1 1 13 7950 1 1 25 HIS CE1 C -3.339 1.763 -2.431 1.00 . A A . 25 HIS CE1 1 1 13 7951 1 1 25 HIS CG C -5.271 1.679 -1.375 1.00 . A A . 25 HIS CG 1 1 13 7952 1 1 25 HIS H H -7.569 0.637 1.602 1.00 . A A . 25 HIS H 1 1 13 7953 1 1 25 HIS HA H -4.943 0.556 0.939 1.00 . A A . 25 HIS HA 1 1 13 7954 1 1 25 HIS HB2 H -7.094 1.197 -0.455 1.00 . A A . 25 HIS HB2 1 1 13 7955 1 1 25 HIS HB3 H -6.529 2.839 -0.160 1.00 . A A . 25 HIS HB3 1 1 13 7956 1 1 25 HIS HD1 H -3.470 2.271 -0.454 1.00 . A A . 25 HIS HD1 1 1 13 7957 1 1 25 HIS HD2 H -6.409 0.996 -3.100 1.00 . A A . 25 HIS HD2 1 1 13 7958 1 1 25 HIS HE1 H -2.290 1.906 -2.644 1.00 . A A . 25 HIS HE1 1 1 13 7959 1 1 25 HIS N N -6.696 0.861 1.985 1.00 . A A . 25 HIS N 1 1 13 7960 1 1 25 HIS ND1 N -3.926 1.964 -1.265 1.00 . A A . 25 HIS ND1 1 1 13 7961 1 1 25 HIS NE2 N -4.253 1.355 -3.293 1.00 . A A . 25 HIS NE2 1 1 13 7962 1 1 25 HIS O O -3.684 2.471 1.948 1.00 . A A . 25 HIS O 1 1 13 7963 1 1 26 ALA C C -3.870 4.361 3.624 1.00 . A A . 26 ALA C 1 1 13 7964 1 1 26 ALA CA C -5.052 4.746 2.741 1.00 . A A . 26 ALA CA 1 1 13 7965 1 1 26 ALA CB C -6.102 5.488 3.555 1.00 . A A . 26 ALA CB 1 1 13 7966 1 1 26 ALA H H -6.603 3.555 1.934 1.00 . A A . 26 ALA H 1 1 13 7967 1 1 26 ALA HA H -4.704 5.407 1.960 1.00 . A A . 26 ALA HA 1 1 13 7968 1 1 26 ALA HB1 H -6.964 5.685 2.935 1.00 . A A . 26 ALA HB1 1 1 13 7969 1 1 26 ALA HB2 H -6.396 4.882 4.399 1.00 . A A . 26 ALA HB2 1 1 13 7970 1 1 26 ALA HB3 H -5.690 6.422 3.908 1.00 . A A . 26 ALA HB3 1 1 13 7971 1 1 26 ALA N N -5.639 3.572 2.108 1.00 . A A . 26 ALA N 1 1 13 7972 1 1 26 ALA O O -2.748 4.821 3.412 1.00 . A A . 26 ALA O 1 1 13 7973 1 1 27 SER C C -1.808 2.727 4.779 1.00 . A A . 27 SER C 1 1 13 7974 1 1 27 SER CA C -3.088 3.070 5.534 1.00 . A A . 27 SER CA 1 1 13 7975 1 1 27 SER CB C -3.565 1.854 6.330 1.00 . A A . 27 SER CB 1 1 13 7976 1 1 27 SER H H -5.045 3.182 4.733 1.00 . A A . 27 SER H 1 1 13 7977 1 1 27 SER HA H -2.883 3.880 6.218 1.00 . A A . 27 SER HA 1 1 13 7978 1 1 27 SER HB2 H -4.039 1.152 5.661 1.00 . A A . 27 SER HB2 1 1 13 7979 1 1 27 SER HB3 H -2.716 1.382 6.805 1.00 . A A . 27 SER HB3 1 1 13 7980 1 1 27 SER HG H -5.147 2.827 6.952 1.00 . A A . 27 SER HG 1 1 13 7981 1 1 27 SER N N -4.130 3.514 4.615 1.00 . A A . 27 SER N 1 1 13 7982 1 1 27 SER O O -0.709 3.093 5.198 1.00 . A A . 27 SER O 1 1 13 7983 1 1 27 SER OG O -4.496 2.232 7.330 1.00 . A A . 27 SER OG 1 1 13 7984 1 1 28 LEU C C -0.295 2.810 2.032 1.00 . A A . 28 LEU C 1 1 13 7985 1 1 28 LEU CA C -0.814 1.630 2.846 1.00 . A A . 28 LEU CA 1 1 13 7986 1 1 28 LEU CB C -1.200 0.481 1.913 1.00 . A A . 28 LEU CB 1 1 13 7987 1 1 28 LEU CD1 C 1.060 -0.269 1.128 1.00 . A A . 28 LEU CD1 1 1 13 7988 1 1 28 LEU CD2 C -0.953 -0.670 -0.301 1.00 . A A . 28 LEU CD2 1 1 13 7989 1 1 28 LEU CG C -0.295 0.271 0.698 1.00 . A A . 28 LEU CG 1 1 13 7990 1 1 28 LEU H H -2.858 1.761 3.379 1.00 . A A . 28 LEU H 1 1 13 7991 1 1 28 LEU HA H -0.032 1.295 3.512 1.00 . A A . 28 LEU HA 1 1 13 7992 1 1 28 LEU HB2 H -1.194 -0.431 2.490 1.00 . A A . 28 LEU HB2 1 1 13 7993 1 1 28 LEU HB3 H -2.201 0.671 1.552 1.00 . A A . 28 LEU HB3 1 1 13 7994 1 1 28 LEU HD11 H 1.296 0.098 2.116 1.00 . A A . 28 LEU HD11 1 1 13 7995 1 1 28 LEU HD12 H 1.816 0.061 0.431 1.00 . A A . 28 LEU HD12 1 1 13 7996 1 1 28 LEU HD13 H 1.029 -1.348 1.142 1.00 . A A . 28 LEU HD13 1 1 13 7997 1 1 28 LEU HD21 H -1.570 -1.382 0.228 1.00 . A A . 28 LEU HD21 1 1 13 7998 1 1 28 LEU HD22 H -0.190 -1.196 -0.855 1.00 . A A . 28 LEU HD22 1 1 13 7999 1 1 28 LEU HD23 H -1.566 -0.099 -0.984 1.00 . A A . 28 LEU HD23 1 1 13 8000 1 1 28 LEU HG H -0.135 1.221 0.208 1.00 . A A . 28 LEU HG 1 1 13 8001 1 1 28 LEU N N -1.958 2.023 3.662 1.00 . A A . 28 LEU N 1 1 13 8002 1 1 28 LEU O O 0.914 3.023 1.927 1.00 . A A . 28 LEU O 1 1 13 8003 1 1 29 THR C C 0.047 5.687 1.434 1.00 . A A . 29 THR C 1 1 13 8004 1 1 29 THR CA C -0.852 4.736 0.652 1.00 . A A . 29 THR CA 1 1 13 8005 1 1 29 THR CB C -2.100 5.503 0.175 1.00 . A A . 29 THR CB 1 1 13 8006 1 1 29 THR CG2 C -1.719 6.871 -0.370 1.00 . A A . 29 THR CG2 1 1 13 8007 1 1 29 THR H H -2.163 3.355 1.577 1.00 . A A . 29 THR H 1 1 13 8008 1 1 29 THR HA H -0.317 4.384 -0.218 1.00 . A A . 29 THR HA 1 1 13 8009 1 1 29 THR HB H -2.763 5.640 1.017 1.00 . A A . 29 THR HB 1 1 13 8010 1 1 29 THR HG1 H -2.428 4.988 -1.700 1.00 . A A . 29 THR HG1 1 1 13 8011 1 1 29 THR HG21 H -2.102 6.978 -1.373 1.00 . A A . 29 THR HG21 1 1 13 8012 1 1 29 THR HG22 H -0.643 6.966 -0.385 1.00 . A A . 29 THR HG22 1 1 13 8013 1 1 29 THR HG23 H -2.139 7.640 0.261 1.00 . A A . 29 THR HG23 1 1 13 8014 1 1 29 THR N N -1.216 3.577 1.457 1.00 . A A . 29 THR N 1 1 13 8015 1 1 29 THR O O 1.078 6.133 0.931 1.00 . A A . 29 THR O 1 1 13 8016 1 1 29 THR OG1 O -2.779 4.752 -0.838 1.00 . A A . 29 THR OG1 1 1 13 8017 1 1 30 GLN C C 1.673 6.199 4.044 1.00 . A A . 30 GLN C 1 1 13 8018 1 1 30 GLN CA C 0.421 6.891 3.515 1.00 . A A . 30 GLN CA 1 1 13 8019 1 1 30 GLN CB C -0.436 7.383 4.683 1.00 . A A . 30 GLN CB 1 1 13 8020 1 1 30 GLN CD C -0.529 8.697 6.839 1.00 . A A . 30 GLN CD 1 1 13 8021 1 1 30 GLN CG C 0.355 8.131 5.744 1.00 . A A . 30 GLN CG 1 1 13 8022 1 1 30 GLN H H -1.182 5.605 3.008 1.00 . A A . 30 GLN H 1 1 13 8023 1 1 30 GLN HA H 0.719 7.739 2.917 1.00 . A A . 30 GLN HA 1 1 13 8024 1 1 30 GLN HB2 H -1.199 8.045 4.300 1.00 . A A . 30 GLN HB2 1 1 13 8025 1 1 30 GLN HB3 H -0.909 6.533 5.150 1.00 . A A . 30 GLN HB3 1 1 13 8026 1 1 30 GLN HE21 H -0.143 10.549 6.225 1.00 . A A . 30 GLN HE21 1 1 13 8027 1 1 30 GLN HE22 H -1.199 10.413 7.586 1.00 . A A . 30 GLN HE22 1 1 13 8028 1 1 30 GLN HG2 H 1.064 7.451 6.192 1.00 . A A . 30 GLN HG2 1 1 13 8029 1 1 30 GLN HG3 H 0.886 8.944 5.273 1.00 . A A . 30 GLN HG3 1 1 13 8030 1 1 30 GLN N N -0.350 5.992 2.665 1.00 . A A . 30 GLN N 1 1 13 8031 1 1 30 GLN NE2 N -0.634 10.020 6.889 1.00 . A A . 30 GLN NE2 1 1 13 8032 1 1 30 GLN O O 2.733 6.815 4.163 1.00 . A A . 30 GLN O 1 1 13 8033 1 1 30 GLN OE1 O -1.110 7.954 7.630 1.00 . A A . 30 GLN OE1 1 1 13 8034 1 1 31 HIS C C 3.815 4.112 3.875 1.00 . A A . 31 HIS C 1 1 13 8035 1 1 31 HIS CA C 2.666 4.138 4.878 1.00 . A A . 31 HIS CA 1 1 13 8036 1 1 31 HIS CB C 2.220 2.711 5.199 1.00 . A A . 31 HIS CB 1 1 13 8037 1 1 31 HIS CD2 C 3.780 1.006 4.021 1.00 . A A . 31 HIS CD2 1 1 13 8038 1 1 31 HIS CE1 C 4.973 0.408 5.761 1.00 . A A . 31 HIS CE1 1 1 13 8039 1 1 31 HIS CG C 3.321 1.701 5.088 1.00 . A A . 31 HIS CG 1 1 13 8040 1 1 31 HIS H H 0.674 4.479 4.244 1.00 . A A . 31 HIS H 1 1 13 8041 1 1 31 HIS HA H 3.007 4.612 5.785 1.00 . A A . 31 HIS HA 1 1 13 8042 1 1 31 HIS HB2 H 1.841 2.678 6.210 1.00 . A A . 31 HIS HB2 1 1 13 8043 1 1 31 HIS HB3 H 1.435 2.423 4.515 1.00 . A A . 31 HIS HB3 1 1 13 8044 1 1 31 HIS HD1 H 3.998 1.629 7.081 1.00 . A A . 31 HIS HD1 1 1 13 8045 1 1 31 HIS HD2 H 3.410 1.067 3.007 1.00 . A A . 31 HIS HD2 1 1 13 8046 1 1 31 HIS HE1 H 5.707 -0.080 6.385 1.00 . A A . 31 HIS HE1 1 1 13 8047 1 1 31 HIS N N 1.544 4.915 4.361 1.00 . A A . 31 HIS N 1 1 13 8048 1 1 31 HIS ND1 N 4.088 1.303 6.162 1.00 . A A . 31 HIS ND1 1 1 13 8049 1 1 31 HIS NE2 N 4.807 0.210 4.465 1.00 . A A . 31 HIS NE2 1 1 13 8050 1 1 31 HIS O O 4.970 4.337 4.236 1.00 . A A . 31 HIS O 1 1 13 8051 1 1 32 GLN C C 5.564 4.847 1.770 1.00 . A A . 32 GLN C 1 1 13 8052 1 1 32 GLN CA C 4.497 3.776 1.563 1.00 . A A . 32 GLN CA 1 1 13 8053 1 1 32 GLN CB C 3.842 3.951 0.192 1.00 . A A . 32 GLN CB 1 1 13 8054 1 1 32 GLN CD C 4.200 1.682 -0.860 1.00 . A A . 32 GLN CD 1 1 13 8055 1 1 32 GLN CG C 3.190 2.684 -0.336 1.00 . A A . 32 GLN CG 1 1 13 8056 1 1 32 GLN H H 2.553 3.663 2.392 1.00 . A A . 32 GLN H 1 1 13 8057 1 1 32 GLN HA H 4.967 2.805 1.606 1.00 . A A . 32 GLN HA 1 1 13 8058 1 1 32 GLN HB2 H 3.084 4.717 0.263 1.00 . A A . 32 GLN HB2 1 1 13 8059 1 1 32 GLN HB3 H 4.594 4.265 -0.516 1.00 . A A . 32 GLN HB3 1 1 13 8060 1 1 32 GLN HE21 H 3.393 1.779 -2.674 1.00 . A A . 32 GLN HE21 1 1 13 8061 1 1 32 GLN HE22 H 4.743 0.714 -2.509 1.00 . A A . 32 GLN HE22 1 1 13 8062 1 1 32 GLN HG2 H 2.630 2.221 0.463 1.00 . A A . 32 GLN HG2 1 1 13 8063 1 1 32 GLN HG3 H 2.517 2.948 -1.139 1.00 . A A . 32 GLN HG3 1 1 13 8064 1 1 32 GLN N N 3.491 3.834 2.617 1.00 . A A . 32 GLN N 1 1 13 8065 1 1 32 GLN NE2 N 4.102 1.358 -2.144 1.00 . A A . 32 GLN NE2 1 1 13 8066 1 1 32 GLN O O 6.728 4.653 1.422 1.00 . A A . 32 GLN O 1 1 13 8067 1 1 32 GLN OE1 O 5.060 1.205 -0.119 1.00 . A A . 32 GLN OE1 1 1 13 8068 1 1 33 ARG C C 7.330 6.589 3.312 1.00 . A A . 33 ARG C 1 1 13 8069 1 1 33 ARG CA C 6.078 7.080 2.591 1.00 . A A . 33 ARG CA 1 1 13 8070 1 1 33 ARG CB C 5.391 8.166 3.421 1.00 . A A . 33 ARG CB 1 1 13 8071 1 1 33 ARG CD C 3.500 9.812 3.595 1.00 . A A . 33 ARG CD 1 1 13 8072 1 1 33 ARG CG C 4.300 8.909 2.669 1.00 . A A . 33 ARG CG 1 1 13 8073 1 1 33 ARG CZ C 3.740 11.989 4.712 1.00 . A A . 33 ARG CZ 1 1 13 8074 1 1 33 ARG H H 4.216 6.073 2.595 1.00 . A A . 33 ARG H 1 1 13 8075 1 1 33 ARG HA H 6.366 7.496 1.638 1.00 . A A . 33 ARG HA 1 1 13 8076 1 1 33 ARG HB2 H 4.949 7.710 4.295 1.00 . A A . 33 ARG HB2 1 1 13 8077 1 1 33 ARG HB3 H 6.133 8.883 3.737 1.00 . A A . 33 ARG HB3 1 1 13 8078 1 1 33 ARG HD2 H 2.589 10.104 3.094 1.00 . A A . 33 ARG HD2 1 1 13 8079 1 1 33 ARG HD3 H 3.257 9.261 4.491 1.00 . A A . 33 ARG HD3 1 1 13 8080 1 1 33 ARG HE H 5.163 11.097 3.636 1.00 . A A . 33 ARG HE 1 1 13 8081 1 1 33 ARG HG2 H 4.754 9.514 1.898 1.00 . A A . 33 ARG HG2 1 1 13 8082 1 1 33 ARG HG3 H 3.633 8.189 2.218 1.00 . A A . 33 ARG HG3 1 1 13 8083 1 1 33 ARG HH11 H 1.940 11.104 4.951 1.00 . A A . 33 ARG HH11 1 1 13 8084 1 1 33 ARG HH12 H 2.122 12.639 5.734 1.00 . A A . 33 ARG HH12 1 1 13 8085 1 1 33 ARG HH21 H 5.416 13.118 4.662 1.00 . A A . 33 ARG HH21 1 1 13 8086 1 1 33 ARG HH22 H 4.099 13.784 5.568 1.00 . A A . 33 ARG HH22 1 1 13 8087 1 1 33 ARG N N 5.157 5.977 2.339 1.00 . A A . 33 ARG N 1 1 13 8088 1 1 33 ARG NE N 4.244 11.014 3.964 1.00 . A A . 33 ARG NE 1 1 13 8089 1 1 33 ARG NH1 N 2.498 11.904 5.170 1.00 . A A . 33 ARG NH1 1 1 13 8090 1 1 33 ARG NH2 N 4.479 13.051 5.005 1.00 . A A . 33 ARG NH2 1 1 13 8091 1 1 33 ARG O O 8.452 6.895 2.909 1.00 . A A . 33 ARG O 1 1 13 8092 1 1 34 VAL C C 9.372 4.823 4.249 1.00 . A A . 34 VAL C 1 1 13 8093 1 1 34 VAL CA C 8.242 5.291 5.158 1.00 . A A . 34 VAL CA 1 1 13 8094 1 1 34 VAL CB C 7.792 4.116 6.047 1.00 . A A . 34 VAL CB 1 1 13 8095 1 1 34 VAL CG1 C 6.876 4.606 7.158 1.00 . A A . 34 VAL CG1 1 1 13 8096 1 1 34 VAL CG2 C 7.104 3.048 5.210 1.00 . A A . 34 VAL CG2 1 1 13 8097 1 1 34 VAL H H 6.212 5.615 4.654 1.00 . A A . 34 VAL H 1 1 13 8098 1 1 34 VAL HA H 8.610 6.079 5.799 1.00 . A A . 34 VAL HA 1 1 13 8099 1 1 34 VAL HB H 8.669 3.678 6.501 1.00 . A A . 34 VAL HB 1 1 13 8100 1 1 34 VAL HG11 H 6.155 5.299 6.749 1.00 . A A . 34 VAL HG11 1 1 13 8101 1 1 34 VAL HG12 H 6.360 3.765 7.597 1.00 . A A . 34 VAL HG12 1 1 13 8102 1 1 34 VAL HG13 H 7.464 5.104 7.915 1.00 . A A . 34 VAL HG13 1 1 13 8103 1 1 34 VAL HG21 H 6.968 3.412 4.203 1.00 . A A . 34 VAL HG21 1 1 13 8104 1 1 34 VAL HG22 H 7.715 2.157 5.191 1.00 . A A . 34 VAL HG22 1 1 13 8105 1 1 34 VAL HG23 H 6.142 2.815 5.642 1.00 . A A . 34 VAL HG23 1 1 13 8106 1 1 34 VAL N N 7.130 5.825 4.381 1.00 . A A . 34 VAL N 1 1 13 8107 1 1 34 VAL O O 10.536 4.793 4.652 1.00 . A A . 34 VAL O 1 1 13 8108 1 1 35 HIS C C 10.376 5.101 1.071 1.00 . A A . 35 HIS C 1 1 13 8109 1 1 35 HIS CA C 10.010 3.991 2.052 1.00 . A A . 35 HIS CA 1 1 13 8110 1 1 35 HIS CB C 9.474 2.778 1.290 1.00 . A A . 35 HIS CB 1 1 13 8111 1 1 35 HIS CD2 C 7.770 0.981 2.060 1.00 . A A . 35 HIS CD2 1 1 13 8112 1 1 35 HIS CE1 C 8.763 0.373 3.918 1.00 . A A . 35 HIS CE1 1 1 13 8113 1 1 35 HIS CG C 8.898 1.719 2.179 1.00 . A A . 35 HIS CG 1 1 13 8114 1 1 35 HIS H H 8.080 4.503 2.757 1.00 . A A . 35 HIS H 1 1 13 8115 1 1 35 HIS HA H 10.896 3.701 2.595 1.00 . A A . 35 HIS HA 1 1 13 8116 1 1 35 HIS HB2 H 8.697 3.101 0.613 1.00 . A A . 35 HIS HB2 1 1 13 8117 1 1 35 HIS HB3 H 10.279 2.334 0.722 1.00 . A A . 35 HIS HB3 1 1 13 8118 1 1 35 HIS HD1 H 10.336 1.665 3.718 1.00 . A A . 35 HIS HD1 1 1 13 8119 1 1 35 HIS HD2 H 7.050 1.034 1.255 1.00 . A A . 35 HIS HD2 1 1 13 8120 1 1 35 HIS HE1 H 8.985 -0.131 4.846 1.00 . A A . 35 HIS HE1 1 1 13 8121 1 1 35 HIS N N 9.023 4.457 3.020 1.00 . A A . 35 HIS N 1 1 13 8122 1 1 35 HIS ND1 N 9.497 1.315 3.353 1.00 . A A . 35 HIS ND1 1 1 13 8123 1 1 35 HIS NE2 N 7.708 0.152 3.153 1.00 . A A . 35 HIS NE2 1 1 13 8124 1 1 35 HIS O O 9.824 5.180 -0.026 1.00 . A A . 35 HIS O 1 1 13 8125 1 1 36 SER C C 13.214 6.914 0.254 1.00 . A A . 36 SER C 1 1 13 8126 1 1 36 SER CA C 11.745 7.066 0.635 1.00 . A A . 36 SER CA 1 1 13 8127 1 1 36 SER CB C 11.528 8.397 1.356 1.00 . A A . 36 SER CB 1 1 13 8128 1 1 36 SER H H 11.711 5.842 2.362 1.00 . A A . 36 SER H 1 1 13 8129 1 1 36 SER HA H 11.149 7.053 -0.266 1.00 . A A . 36 SER HA 1 1 13 8130 1 1 36 SER HB2 H 10.484 8.499 1.613 1.00 . A A . 36 SER HB2 1 1 13 8131 1 1 36 SER HB3 H 12.124 8.416 2.257 1.00 . A A . 36 SER HB3 1 1 13 8132 1 1 36 SER HG H 11.290 10.215 0.666 1.00 . A A . 36 SER HG 1 1 13 8133 1 1 36 SER N N 11.309 5.957 1.475 1.00 . A A . 36 SER N 1 1 13 8134 1 1 36 SER O O 14.080 6.783 1.118 1.00 . A A . 36 SER O 1 1 13 8135 1 1 36 SER OG O 11.905 9.490 0.536 1.00 . A A . 36 SER OG 1 1 13 8136 1 1 37 GLY C C 15.304 7.987 -2.340 1.00 . A A . 37 GLY C 1 1 13 8137 1 1 37 GLY CA C 14.853 6.795 -1.520 1.00 . A A . 37 GLY CA 1 1 13 8138 1 1 37 GLY H H 12.756 7.039 -1.691 1.00 . A A . 37 GLY H 1 1 13 8139 1 1 37 GLY HA2 H 15.508 6.688 -0.669 1.00 . A A . 37 GLY HA2 1 1 13 8140 1 1 37 GLY HA3 H 14.923 5.907 -2.130 1.00 . A A . 37 GLY HA3 1 1 13 8141 1 1 37 GLY N N 13.488 6.932 -1.047 1.00 . A A . 37 GLY N 1 1 13 8142 1 1 37 GLY O O 14.942 8.117 -3.509 1.00 . A A . 37 GLY O 1 1 13 8143 1 1 38 GLU C C 18.059 10.303 -2.059 1.00 . A A . 38 GLU C 1 1 13 8144 1 1 38 GLU CA C 16.595 10.050 -2.408 1.00 . A A . 38 GLU CA 1 1 13 8145 1 1 38 GLU CB C 15.752 11.271 -2.034 1.00 . A A . 38 GLU CB 1 1 13 8146 1 1 38 GLU CD C 13.733 12.588 -2.788 1.00 . A A . 38 GLU CD 1 1 13 8147 1 1 38 GLU CG C 14.328 11.212 -2.561 1.00 . A A . 38 GLU CG 1 1 13 8148 1 1 38 GLU H H 16.350 8.703 -0.793 1.00 . A A . 38 GLU H 1 1 13 8149 1 1 38 GLU HA H 16.515 9.881 -3.471 1.00 . A A . 38 GLU HA 1 1 13 8150 1 1 38 GLU HB2 H 15.713 11.350 -0.957 1.00 . A A . 38 GLU HB2 1 1 13 8151 1 1 38 GLU HB3 H 16.225 12.155 -2.434 1.00 . A A . 38 GLU HB3 1 1 13 8152 1 1 38 GLU HG2 H 14.327 10.676 -3.499 1.00 . A A . 38 GLU HG2 1 1 13 8153 1 1 38 GLU HG3 H 13.714 10.684 -1.846 1.00 . A A . 38 GLU HG3 1 1 13 8154 1 1 38 GLU N N 16.096 8.861 -1.726 1.00 . A A . 38 GLU N 1 1 13 8155 1 1 38 GLU O O 18.513 9.977 -0.962 1.00 . A A . 38 GLU O 1 1 13 8156 1 1 38 GLU OE1 O 14.119 13.244 -3.778 1.00 . A A . 38 GLU OE1 1 1 13 8157 1 1 38 GLU OE2 O 12.882 13.008 -1.977 1.00 . A A . 38 GLU OE2 1 1 13 8158 1 1 39 LYS C C 20.758 12.017 -3.947 1.00 . A A . 39 LYS C 1 1 13 8159 1 1 39 LYS CA C 20.205 11.184 -2.796 1.00 . A A . 39 LYS CA 1 1 13 8160 1 1 39 LYS CB C 21.007 9.887 -2.660 1.00 . A A . 39 LYS CB 1 1 13 8161 1 1 39 LYS CD C 21.795 9.219 -4.949 1.00 . A A . 39 LYS CD 1 1 13 8162 1 1 39 LYS CE C 22.077 7.974 -5.777 1.00 . A A . 39 LYS CE 1 1 13 8163 1 1 39 LYS CG C 20.817 8.930 -3.823 1.00 . A A . 39 LYS CG 1 1 13 8164 1 1 39 LYS H H 18.374 11.121 -3.856 1.00 . A A . 39 LYS H 1 1 13 8165 1 1 39 LYS HA H 20.295 11.750 -1.881 1.00 . A A . 39 LYS HA 1 1 13 8166 1 1 39 LYS HB2 H 22.057 10.133 -2.590 1.00 . A A . 39 LYS HB2 1 1 13 8167 1 1 39 LYS HB3 H 20.703 9.383 -1.753 1.00 . A A . 39 LYS HB3 1 1 13 8168 1 1 39 LYS HD2 H 21.376 9.978 -5.593 1.00 . A A . 39 LYS HD2 1 1 13 8169 1 1 39 LYS HD3 H 22.723 9.576 -4.525 1.00 . A A . 39 LYS HD3 1 1 13 8170 1 1 39 LYS HE2 H 21.200 7.346 -5.767 1.00 . A A . 39 LYS HE2 1 1 13 8171 1 1 39 LYS HE3 H 22.293 8.274 -6.792 1.00 . A A . 39 LYS HE3 1 1 13 8172 1 1 39 LYS HG2 H 20.974 7.919 -3.476 1.00 . A A . 39 LYS HG2 1 1 13 8173 1 1 39 LYS HG3 H 19.809 9.031 -4.200 1.00 . A A . 39 LYS HG3 1 1 13 8174 1 1 39 LYS HZ1 H 22.925 6.599 -4.453 1.00 . A A . 39 LYS HZ1 1 1 13 8175 1 1 39 LYS HZ2 H 23.969 7.853 -4.902 1.00 . A A . 39 LYS HZ2 1 1 13 8176 1 1 39 LYS HZ3 H 23.636 6.600 -5.988 1.00 . A A . 39 LYS HZ3 1 1 13 8177 1 1 39 LYS N N 18.793 10.885 -3.001 1.00 . A A . 39 LYS N 1 1 13 8178 1 1 39 LYS NZ N 23.232 7.202 -5.242 1.00 . A A . 39 LYS NZ 1 1 13 8179 1 1 39 LYS O O 20.280 11.950 -5.080 1.00 . A A . 39 LYS O 1 1 13 8180 1 1 40 PRO C C 23.221 12.884 -5.685 1.00 . A A . 40 PRO C 1 1 13 8181 1 1 40 PRO CA C 22.432 13.683 -4.652 1.00 . A A . 40 PRO CA 1 1 13 8182 1 1 40 PRO CB C 23.373 14.554 -3.817 1.00 . A A . 40 PRO CB 1 1 13 8183 1 1 40 PRO CD C 22.411 12.953 -2.325 1.00 . A A . 40 PRO CD 1 1 13 8184 1 1 40 PRO CG C 23.661 13.743 -2.601 1.00 . A A . 40 PRO CG 1 1 13 8185 1 1 40 PRO HA H 21.712 14.309 -5.157 1.00 . A A . 40 PRO HA 1 1 13 8186 1 1 40 PRO HB2 H 24.274 14.757 -4.380 1.00 . A A . 40 PRO HB2 1 1 13 8187 1 1 40 PRO HB3 H 22.883 15.482 -3.566 1.00 . A A . 40 PRO HB3 1 1 13 8188 1 1 40 PRO HD2 H 22.660 11.984 -1.918 1.00 . A A . 40 PRO HD2 1 1 13 8189 1 1 40 PRO HD3 H 21.765 13.494 -1.650 1.00 . A A . 40 PRO HD3 1 1 13 8190 1 1 40 PRO HG2 H 24.490 13.079 -2.790 1.00 . A A . 40 PRO HG2 1 1 13 8191 1 1 40 PRO HG3 H 23.882 14.396 -1.769 1.00 . A A . 40 PRO HG3 1 1 13 8192 1 1 40 PRO N N 21.791 12.822 -3.654 1.00 . A A . 40 PRO N 1 1 13 8193 1 1 40 PRO O O 23.198 11.654 -5.681 1.00 . A A . 40 PRO O 1 1 13 8194 1 1 41 SER C C 25.656 11.914 -7.009 1.00 . A A . 41 SER C 1 1 13 8195 1 1 41 SER CA C 24.711 12.950 -7.608 1.00 . A A . 41 SER CA 1 1 13 8196 1 1 41 SER CB C 25.510 13.995 -8.389 1.00 . A A . 41 SER CB 1 1 13 8197 1 1 41 SER H H 23.895 14.572 -6.519 1.00 . A A . 41 SER H 1 1 13 8198 1 1 41 SER HA H 24.031 12.451 -8.283 1.00 . A A . 41 SER HA 1 1 13 8199 1 1 41 SER HB2 H 26.165 14.522 -7.713 1.00 . A A . 41 SER HB2 1 1 13 8200 1 1 41 SER HB3 H 26.098 13.501 -9.149 1.00 . A A . 41 SER HB3 1 1 13 8201 1 1 41 SER HG H 25.173 15.640 -9.398 1.00 . A A . 41 SER HG 1 1 13 8202 1 1 41 SER N N 23.917 13.593 -6.568 1.00 . A A . 41 SER N 1 1 13 8203 1 1 41 SER O O 25.795 10.808 -7.529 1.00 . A A . 41 SER O 1 1 13 8204 1 1 41 SER OG O 24.650 14.932 -9.015 1.00 . A A . 41 SER OG 1 1 13 8205 1 1 42 GLY C C 27.552 11.797 -3.835 1.00 . A A . 42 GLY C 1 1 13 8206 1 1 42 GLY CA C 27.231 11.374 -5.254 1.00 . A A . 42 GLY CA 1 1 13 8207 1 1 42 GLY H H 26.156 13.176 -5.537 1.00 . A A . 42 GLY H 1 1 13 8208 1 1 42 GLY HA2 H 26.796 10.386 -5.235 1.00 . A A . 42 GLY HA2 1 1 13 8209 1 1 42 GLY HA3 H 28.148 11.341 -5.824 1.00 . A A . 42 GLY HA3 1 1 13 8210 1 1 42 GLY N N 26.306 12.281 -5.908 1.00 . A A . 42 GLY N 1 1 13 8211 1 1 42 GLY O O 28.563 12.449 -3.572 1.00 . A A . 42 GLY O 1 1 13 8212 1 1 43 PRO C C 28.010 11.001 -0.836 1.00 . A A . 43 PRO C 1 1 13 8213 1 1 43 PRO CA C 26.850 11.758 -1.473 1.00 . A A . 43 PRO CA 1 1 13 8214 1 1 43 PRO CB C 25.522 11.331 -0.842 1.00 . A A . 43 PRO CB 1 1 13 8215 1 1 43 PRO CD C 25.450 10.645 -3.131 1.00 . A A . 43 PRO CD 1 1 13 8216 1 1 43 PRO CG C 24.997 10.271 -1.747 1.00 . A A . 43 PRO CG 1 1 13 8217 1 1 43 PRO HA H 26.993 12.820 -1.331 1.00 . A A . 43 PRO HA 1 1 13 8218 1 1 43 PRO HB2 H 25.700 10.950 0.154 1.00 . A A . 43 PRO HB2 1 1 13 8219 1 1 43 PRO HB3 H 24.853 12.177 -0.796 1.00 . A A . 43 PRO HB3 1 1 13 8220 1 1 43 PRO HD2 H 25.663 9.759 -3.710 1.00 . A A . 43 PRO HD2 1 1 13 8221 1 1 43 PRO HD3 H 24.702 11.249 -3.622 1.00 . A A . 43 PRO HD3 1 1 13 8222 1 1 43 PRO HG2 H 25.406 9.312 -1.465 1.00 . A A . 43 PRO HG2 1 1 13 8223 1 1 43 PRO HG3 H 23.918 10.249 -1.699 1.00 . A A . 43 PRO HG3 1 1 13 8224 1 1 43 PRO N N 26.677 11.423 -2.889 1.00 . A A . 43 PRO N 1 1 13 8225 1 1 43 PRO O O 28.185 9.805 -1.068 1.00 . A A . 43 PRO O 1 1 13 8226 1 1 44 SER C C 30.600 12.088 1.596 1.00 . A A . 44 SER C 1 1 13 8227 1 1 44 SER CA C 29.947 11.099 0.636 1.00 . A A . 44 SER CA 1 1 13 8228 1 1 44 SER CB C 30.970 10.620 -0.396 1.00 . A A . 44 SER CB 1 1 13 8229 1 1 44 SER H H 28.610 12.656 0.113 1.00 . A A . 44 SER H 1 1 13 8230 1 1 44 SER HA H 29.591 10.250 1.199 1.00 . A A . 44 SER HA 1 1 13 8231 1 1 44 SER HB2 H 30.457 10.328 -1.299 1.00 . A A . 44 SER HB2 1 1 13 8232 1 1 44 SER HB3 H 31.658 11.424 -0.616 1.00 . A A . 44 SER HB3 1 1 13 8233 1 1 44 SER HG H 32.247 9.150 -0.613 1.00 . A A . 44 SER HG 1 1 13 8234 1 1 44 SER N N 28.801 11.705 -0.032 1.00 . A A . 44 SER N 1 1 13 8235 1 1 44 SER O O 31.180 13.089 1.175 1.00 . A A . 44 SER O 1 1 13 8236 1 1 44 SER OG O 31.705 9.511 0.092 1.00 . A A . 44 SER OG 1 1 13 8237 1 1 45 SER C C 30.827 14.132 3.588 1.00 . A A . 45 SER C 1 1 13 8238 1 1 45 SER CA C 31.080 12.663 3.912 1.00 . A A . 45 SER CA 1 1 13 8239 1 1 45 SER CB C 32.584 12.408 4.036 1.00 . A A . 45 SER CB 1 1 13 8240 1 1 45 SER H H 30.028 10.986 3.163 1.00 . A A . 45 SER H 1 1 13 8241 1 1 45 SER HA H 30.605 12.428 4.853 1.00 . A A . 45 SER HA 1 1 13 8242 1 1 45 SER HB2 H 32.996 13.059 4.792 1.00 . A A . 45 SER HB2 1 1 13 8243 1 1 45 SER HB3 H 32.749 11.378 4.319 1.00 . A A . 45 SER HB3 1 1 13 8244 1 1 45 SER HG H 33.510 13.579 2.767 1.00 . A A . 45 SER HG 1 1 13 8245 1 1 45 SER N N 30.502 11.799 2.890 1.00 . A A . 45 SER N 1 1 13 8246 1 1 45 SER O O 31.715 14.973 3.729 1.00 . A A . 45 SER O 1 1 13 8247 1 1 45 SER OG O 33.246 12.657 2.808 1.00 . A A . 45 SER OG 1 1 13 8248 1 1 46 GLY C C 28.281 16.411 3.798 1.00 . A A . 46 GLY C 1 1 13 8249 1 1 46 GLY CA C 29.259 15.802 2.813 1.00 . A A . 46 GLY CA 1 1 13 8250 1 1 46 GLY H H 28.940 13.723 3.058 1.00 . A A . 46 GLY H 1 1 13 8251 1 1 46 GLY HA2 H 30.159 16.399 2.799 1.00 . A A . 46 GLY HA2 1 1 13 8252 1 1 46 GLY HA3 H 28.815 15.815 1.828 1.00 . A A . 46 GLY HA3 1 1 13 8253 1 1 46 GLY N N 29.608 14.434 3.151 1.00 . A A . 46 GLY N 1 1 13 8254 1 1 46 GLY O O 28.117 15.871 4.891 1.00 . A A . 46 GLY O 1 1 13 8255 2 2 1 ZN ZN ZN 6.112 -0.871 3.267 1.00 . B A . 181 ZN ZN 1 1 14 8256 1 1 1 GLY C C 3.734 -25.557 -0.590 1.00 . A A . 1 GLY C 1 1 14 8257 1 1 1 GLY CA C 4.565 -26.765 -0.975 1.00 . A A . 1 GLY CA 1 1 14 8258 1 1 1 GLY H1 H 3.439 -27.811 -2.431 1.00 . A A . 1 GLY H1 1 1 14 8259 1 1 1 GLY HA2 H 4.395 -27.551 -0.255 1.00 . A A . 1 GLY HA2 1 1 14 8260 1 1 1 GLY HA3 H 5.610 -26.490 -0.953 1.00 . A A . 1 GLY HA3 1 1 14 8261 1 1 1 GLY N N 4.240 -27.263 -2.299 1.00 . A A . 1 GLY N 1 1 14 8262 1 1 1 GLY O O 4.164 -24.417 -0.768 1.00 . A A . 1 GLY O 1 1 14 8263 1 1 2 SER C C 2.353 -23.760 1.285 1.00 . A A . 2 SER C 1 1 14 8264 1 1 2 SER CA C 1.645 -24.730 0.345 1.00 . A A . 2 SER CA 1 1 14 8265 1 1 2 SER CB C 0.401 -25.303 1.028 1.00 . A A . 2 SER CB 1 1 14 8266 1 1 2 SER H H 2.255 -26.737 0.056 1.00 . A A . 2 SER H 1 1 14 8267 1 1 2 SER HA H 1.343 -24.196 -0.544 1.00 . A A . 2 SER HA 1 1 14 8268 1 1 2 SER HB2 H -0.199 -25.825 0.298 1.00 . A A . 2 SER HB2 1 1 14 8269 1 1 2 SER HB3 H 0.705 -25.992 1.803 1.00 . A A . 2 SER HB3 1 1 14 8270 1 1 2 SER HG H -0.222 -23.450 1.146 1.00 . A A . 2 SER HG 1 1 14 8271 1 1 2 SER N N 2.541 -25.806 -0.061 1.00 . A A . 2 SER N 1 1 14 8272 1 1 2 SER O O 2.273 -22.543 1.116 1.00 . A A . 2 SER O 1 1 14 8273 1 1 2 SER OG O -0.380 -24.275 1.611 1.00 . A A . 2 SER OG 1 1 14 8274 1 1 3 SER C C 2.905 -22.327 3.726 1.00 . A A . 3 SER C 1 1 14 8275 1 1 3 SER CA C 3.767 -23.491 3.248 1.00 . A A . 3 SER CA 1 1 14 8276 1 1 3 SER CB C 5.066 -22.961 2.637 1.00 . A A . 3 SER CB 1 1 14 8277 1 1 3 SER H H 3.073 -25.284 2.361 1.00 . A A . 3 SER H 1 1 14 8278 1 1 3 SER HA H 4.007 -24.117 4.095 1.00 . A A . 3 SER HA 1 1 14 8279 1 1 3 SER HB2 H 5.650 -23.789 2.266 1.00 . A A . 3 SER HB2 1 1 14 8280 1 1 3 SER HB3 H 4.830 -22.293 1.822 1.00 . A A . 3 SER HB3 1 1 14 8281 1 1 3 SER HG H 6.409 -22.868 4.060 1.00 . A A . 3 SER HG 1 1 14 8282 1 1 3 SER N N 3.047 -24.307 2.278 1.00 . A A . 3 SER N 1 1 14 8283 1 1 3 SER O O 3.380 -21.201 3.859 1.00 . A A . 3 SER O 1 1 14 8284 1 1 3 SER OG O 5.831 -22.256 3.599 1.00 . A A . 3 SER OG 1 1 14 8285 1 1 4 GLY C C -0.711 -21.833 4.015 1.00 . A A . 4 GLY C 1 1 14 8286 1 1 4 GLY CA C 0.720 -21.577 4.443 1.00 . A A . 4 GLY CA 1 1 14 8287 1 1 4 GLY H H 1.306 -23.526 3.859 1.00 . A A . 4 GLY H 1 1 14 8288 1 1 4 GLY HA2 H 0.761 -21.531 5.521 1.00 . A A . 4 GLY HA2 1 1 14 8289 1 1 4 GLY HA3 H 1.039 -20.627 4.040 1.00 . A A . 4 GLY HA3 1 1 14 8290 1 1 4 GLY N N 1.631 -22.609 3.983 1.00 . A A . 4 GLY N 1 1 14 8291 1 1 4 GLY O O -1.348 -20.973 3.407 1.00 . A A . 4 GLY O 1 1 14 8292 1 1 5 SER C C -3.569 -22.935 5.042 1.00 . A A . 5 SER C 1 1 14 8293 1 1 5 SER CA C -2.582 -23.390 3.972 1.00 . A A . 5 SER CA 1 1 14 8294 1 1 5 SER CB C -2.687 -24.904 3.775 1.00 . A A . 5 SER CB 1 1 14 8295 1 1 5 SER H H -0.660 -23.664 4.818 1.00 . A A . 5 SER H 1 1 14 8296 1 1 5 SER HA H -2.824 -22.898 3.042 1.00 . A A . 5 SER HA 1 1 14 8297 1 1 5 SER HB2 H -2.037 -25.206 2.969 1.00 . A A . 5 SER HB2 1 1 14 8298 1 1 5 SER HB3 H -2.389 -25.404 4.686 1.00 . A A . 5 SER HB3 1 1 14 8299 1 1 5 SER HG H -4.176 -25.139 2.524 1.00 . A A . 5 SER HG 1 1 14 8300 1 1 5 SER N N -1.218 -23.021 4.332 1.00 . A A . 5 SER N 1 1 14 8301 1 1 5 SER O O -4.627 -22.387 4.733 1.00 . A A . 5 SER O 1 1 14 8302 1 1 5 SER OG O -4.015 -25.286 3.459 1.00 . A A . 5 SER OG 1 1 14 8303 1 1 6 SER C C -3.809 -21.338 7.833 1.00 . A A . 6 SER C 1 1 14 8304 1 1 6 SER CA C -4.069 -22.783 7.419 1.00 . A A . 6 SER CA 1 1 14 8305 1 1 6 SER CB C -3.838 -23.716 8.609 1.00 . A A . 6 SER CB 1 1 14 8306 1 1 6 SER H H -2.358 -23.606 6.484 1.00 . A A . 6 SER H 1 1 14 8307 1 1 6 SER HA H -5.096 -22.873 7.097 1.00 . A A . 6 SER HA 1 1 14 8308 1 1 6 SER HB2 H -4.467 -23.410 9.431 1.00 . A A . 6 SER HB2 1 1 14 8309 1 1 6 SER HB3 H -4.085 -24.728 8.323 1.00 . A A . 6 SER HB3 1 1 14 8310 1 1 6 SER HG H -2.450 -23.532 9.979 1.00 . A A . 6 SER HG 1 1 14 8311 1 1 6 SER N N -3.214 -23.165 6.302 1.00 . A A . 6 SER N 1 1 14 8312 1 1 6 SER O O -2.670 -20.871 7.817 1.00 . A A . 6 SER O 1 1 14 8313 1 1 6 SER OG O -2.485 -23.678 9.031 1.00 . A A . 6 SER OG 1 1 14 8314 1 1 7 GLY C C -5.584 -18.309 7.777 1.00 . A A . 7 GLY C 1 1 14 8315 1 1 7 GLY CA C -4.740 -19.248 8.616 1.00 . A A . 7 GLY CA 1 1 14 8316 1 1 7 GLY H H -5.757 -21.057 8.196 1.00 . A A . 7 GLY H 1 1 14 8317 1 1 7 GLY HA2 H -5.042 -19.161 9.649 1.00 . A A . 7 GLY HA2 1 1 14 8318 1 1 7 GLY HA3 H -3.704 -18.957 8.529 1.00 . A A . 7 GLY HA3 1 1 14 8319 1 1 7 GLY N N -4.874 -20.633 8.203 1.00 . A A . 7 GLY N 1 1 14 8320 1 1 7 GLY O O -5.838 -18.573 6.601 1.00 . A A . 7 GLY O 1 1 14 8321 1 1 8 THR C C -6.227 -14.839 7.760 1.00 . A A . 8 THR C 1 1 14 8322 1 1 8 THR CA C -6.845 -16.230 7.685 1.00 . A A . 8 THR CA 1 1 14 8323 1 1 8 THR CB C -8.271 -16.177 8.266 1.00 . A A . 8 THR CB 1 1 14 8324 1 1 8 THR CG2 C -9.174 -15.304 7.407 1.00 . A A . 8 THR CG2 1 1 14 8325 1 1 8 THR H H -5.787 -17.056 9.321 1.00 . A A . 8 THR H 1 1 14 8326 1 1 8 THR HA H -6.912 -16.528 6.648 1.00 . A A . 8 THR HA 1 1 14 8327 1 1 8 THR HB H -8.223 -15.753 9.259 1.00 . A A . 8 THR HB 1 1 14 8328 1 1 8 THR HG1 H -9.339 -17.581 9.149 1.00 . A A . 8 THR HG1 1 1 14 8329 1 1 8 THR HG21 H -9.305 -15.765 6.440 1.00 . A A . 8 THR HG21 1 1 14 8330 1 1 8 THR HG22 H -8.722 -14.331 7.284 1.00 . A A . 8 THR HG22 1 1 14 8331 1 1 8 THR HG23 H -10.134 -15.197 7.889 1.00 . A A . 8 THR HG23 1 1 14 8332 1 1 8 THR N N -6.023 -17.210 8.382 1.00 . A A . 8 THR N 1 1 14 8333 1 1 8 THR O O -6.125 -14.251 8.837 1.00 . A A . 8 THR O 1 1 14 8334 1 1 8 THR OG1 O -8.815 -17.499 8.348 1.00 . A A . 8 THR OG1 1 1 14 8335 1 1 9 GLY C C -4.725 -12.625 5.181 1.00 . A A . 9 GLY C 1 1 14 8336 1 1 9 GLY CA C -5.211 -12.997 6.568 1.00 . A A . 9 GLY CA 1 1 14 8337 1 1 9 GLY H H -5.920 -14.830 5.782 1.00 . A A . 9 GLY H 1 1 14 8338 1 1 9 GLY HA2 H -5.940 -12.269 6.890 1.00 . A A . 9 GLY HA2 1 1 14 8339 1 1 9 GLY HA3 H -4.372 -12.976 7.248 1.00 . A A . 9 GLY HA3 1 1 14 8340 1 1 9 GLY N N -5.814 -14.316 6.609 1.00 . A A . 9 GLY N 1 1 14 8341 1 1 9 GLY O O -3.547 -12.787 4.866 1.00 . A A . 9 GLY O 1 1 14 8342 1 1 10 GLU C C -6.143 -10.550 2.534 1.00 . A A . 10 GLU C 1 1 14 8343 1 1 10 GLU CA C -5.293 -11.733 2.989 1.00 . A A . 10 GLU CA 1 1 14 8344 1 1 10 GLU CB C -5.482 -12.911 2.031 1.00 . A A . 10 GLU CB 1 1 14 8345 1 1 10 GLU CD C -5.261 -13.789 -0.327 1.00 . A A . 10 GLU CD 1 1 14 8346 1 1 10 GLU CG C -5.077 -12.602 0.600 1.00 . A A . 10 GLU CG 1 1 14 8347 1 1 10 GLU H H -6.559 -12.020 4.661 1.00 . A A . 10 GLU H 1 1 14 8348 1 1 10 GLU HA H -4.254 -11.438 2.981 1.00 . A A . 10 GLU HA 1 1 14 8349 1 1 10 GLU HB2 H -4.889 -13.743 2.381 1.00 . A A . 10 GLU HB2 1 1 14 8350 1 1 10 GLU HB3 H -6.524 -13.197 2.035 1.00 . A A . 10 GLU HB3 1 1 14 8351 1 1 10 GLU HG2 H -5.682 -11.785 0.236 1.00 . A A . 10 GLU HG2 1 1 14 8352 1 1 10 GLU HG3 H -4.037 -12.312 0.588 1.00 . A A . 10 GLU HG3 1 1 14 8353 1 1 10 GLU N N -5.635 -12.126 4.351 1.00 . A A . 10 GLU N 1 1 14 8354 1 1 10 GLU O O -7.369 -10.644 2.461 1.00 . A A . 10 GLU O 1 1 14 8355 1 1 10 GLU OE1 O -4.878 -14.911 0.063 1.00 . A A . 10 GLU OE1 1 1 14 8356 1 1 10 GLU OE2 O -5.788 -13.594 -1.442 1.00 . A A . 10 GLU OE2 1 1 14 8357 1 1 11 LYS C C -5.681 -7.804 0.404 1.00 . A A . 11 LYS C 1 1 14 8358 1 1 11 LYS CA C -6.178 -8.236 1.779 1.00 . A A . 11 LYS CA 1 1 14 8359 1 1 11 LYS CB C -5.977 -7.101 2.786 1.00 . A A . 11 LYS CB 1 1 14 8360 1 1 11 LYS CD C -6.651 -8.195 4.944 1.00 . A A . 11 LYS CD 1 1 14 8361 1 1 11 LYS CE C -5.541 -7.754 5.886 1.00 . A A . 11 LYS CE 1 1 14 8362 1 1 11 LYS CG C -6.980 -7.115 3.927 1.00 . A A . 11 LYS CG 1 1 14 8363 1 1 11 LYS H H -4.507 -9.425 2.307 1.00 . A A . 11 LYS H 1 1 14 8364 1 1 11 LYS HA H -7.230 -8.466 1.713 1.00 . A A . 11 LYS HA 1 1 14 8365 1 1 11 LYS HB2 H -4.985 -7.178 3.205 1.00 . A A . 11 LYS HB2 1 1 14 8366 1 1 11 LYS HB3 H -6.067 -6.157 2.267 1.00 . A A . 11 LYS HB3 1 1 14 8367 1 1 11 LYS HD2 H -7.535 -8.411 5.525 1.00 . A A . 11 LYS HD2 1 1 14 8368 1 1 11 LYS HD3 H -6.335 -9.086 4.421 1.00 . A A . 11 LYS HD3 1 1 14 8369 1 1 11 LYS HE2 H -5.234 -8.600 6.481 1.00 . A A . 11 LYS HE2 1 1 14 8370 1 1 11 LYS HE3 H -4.704 -7.406 5.297 1.00 . A A . 11 LYS HE3 1 1 14 8371 1 1 11 LYS HG2 H -6.965 -6.154 4.420 1.00 . A A . 11 LYS HG2 1 1 14 8372 1 1 11 LYS HG3 H -7.966 -7.300 3.525 1.00 . A A . 11 LYS HG3 1 1 14 8373 1 1 11 LYS HZ1 H -6.760 -6.989 7.400 1.00 . A A . 11 LYS HZ1 1 1 14 8374 1 1 11 LYS HZ2 H -6.318 -5.846 6.233 1.00 . A A . 11 LYS HZ2 1 1 14 8375 1 1 11 LYS HZ3 H -5.194 -6.349 7.392 1.00 . A A . 11 LYS HZ3 1 1 14 8376 1 1 11 LYS N N -5.484 -9.438 2.229 1.00 . A A . 11 LYS N 1 1 14 8377 1 1 11 LYS NZ N -5.984 -6.658 6.791 1.00 . A A . 11 LYS NZ 1 1 14 8378 1 1 11 LYS O O -4.574 -8.140 -0.017 1.00 . A A . 11 LYS O 1 1 14 8379 1 1 12 PRO C C -5.086 -5.485 -1.622 1.00 . A A . 12 PRO C 1 1 14 8380 1 1 12 PRO CA C -6.183 -6.543 -1.653 1.00 . A A . 12 PRO CA 1 1 14 8381 1 1 12 PRO CB C -7.499 -5.935 -2.144 1.00 . A A . 12 PRO CB 1 1 14 8382 1 1 12 PRO CD C -7.852 -6.600 0.124 1.00 . A A . 12 PRO CD 1 1 14 8383 1 1 12 PRO CG C -8.234 -5.569 -0.902 1.00 . A A . 12 PRO CG 1 1 14 8384 1 1 12 PRO HA H -5.888 -7.347 -2.312 1.00 . A A . 12 PRO HA 1 1 14 8385 1 1 12 PRO HB2 H -7.291 -5.065 -2.752 1.00 . A A . 12 PRO HB2 1 1 14 8386 1 1 12 PRO HB3 H -8.043 -6.664 -2.725 1.00 . A A . 12 PRO HB3 1 1 14 8387 1 1 12 PRO HD2 H -7.808 -6.156 1.107 1.00 . A A . 12 PRO HD2 1 1 14 8388 1 1 12 PRO HD3 H -8.551 -7.423 0.111 1.00 . A A . 12 PRO HD3 1 1 14 8389 1 1 12 PRO HG2 H -7.936 -4.585 -0.574 1.00 . A A . 12 PRO HG2 1 1 14 8390 1 1 12 PRO HG3 H -9.299 -5.599 -1.083 1.00 . A A . 12 PRO HG3 1 1 14 8391 1 1 12 PRO N N -6.517 -7.039 -0.315 1.00 . A A . 12 PRO N 1 1 14 8392 1 1 12 PRO O O -4.713 -4.932 -2.657 1.00 . A A . 12 PRO O 1 1 14 8393 1 1 13 TYR C C -2.287 -4.829 0.395 1.00 . A A . 13 TYR C 1 1 14 8394 1 1 13 TYR CA C -3.518 -4.213 -0.263 1.00 . A A . 13 TYR CA 1 1 14 8395 1 1 13 TYR CB C -4.024 -3.038 0.575 1.00 . A A . 13 TYR CB 1 1 14 8396 1 1 13 TYR CD1 C -5.240 -1.421 -0.936 1.00 . A A . 13 TYR CD1 1 1 14 8397 1 1 13 TYR CD2 C -6.538 -2.811 0.502 1.00 . A A . 13 TYR CD2 1 1 14 8398 1 1 13 TYR CE1 C -6.395 -0.846 -1.430 1.00 . A A . 13 TYR CE1 1 1 14 8399 1 1 13 TYR CE2 C -7.698 -2.242 0.012 1.00 . A A . 13 TYR CE2 1 1 14 8400 1 1 13 TYR CG C -5.290 -2.412 0.037 1.00 . A A . 13 TYR CG 1 1 14 8401 1 1 13 TYR CZ C -7.621 -1.259 -0.953 1.00 . A A . 13 TYR CZ 1 1 14 8402 1 1 13 TYR H H -4.910 -5.681 0.360 1.00 . A A . 13 TYR H 1 1 14 8403 1 1 13 TYR HA H -3.245 -3.852 -1.244 1.00 . A A . 13 TYR HA 1 1 14 8404 1 1 13 TYR HB2 H -4.225 -3.380 1.579 1.00 . A A . 13 TYR HB2 1 1 14 8405 1 1 13 TYR HB3 H -3.262 -2.273 0.607 1.00 . A A . 13 TYR HB3 1 1 14 8406 1 1 13 TYR HD1 H -4.278 -1.100 -1.308 1.00 . A A . 13 TYR HD1 1 1 14 8407 1 1 13 TYR HD2 H -6.595 -3.581 1.258 1.00 . A A . 13 TYR HD2 1 1 14 8408 1 1 13 TYR HE1 H -6.335 -0.077 -2.186 1.00 . A A . 13 TYR HE1 1 1 14 8409 1 1 13 TYR HE2 H -8.658 -2.565 0.386 1.00 . A A . 13 TYR HE2 1 1 14 8410 1 1 13 TYR HH H -9.095 -1.206 -2.186 1.00 . A A . 13 TYR HH 1 1 14 8411 1 1 13 TYR N N -4.572 -5.207 -0.429 1.00 . A A . 13 TYR N 1 1 14 8412 1 1 13 TYR O O -2.399 -5.584 1.361 1.00 . A A . 13 TYR O 1 1 14 8413 1 1 13 TYR OH O -8.773 -0.689 -1.443 1.00 . A A . 13 TYR OH 1 1 14 8414 1 1 14 GLU C C 1.327 -4.208 -0.105 1.00 . A A . 14 GLU C 1 1 14 8415 1 1 14 GLU CA C 0.139 -5.021 0.400 1.00 . A A . 14 GLU CA 1 1 14 8416 1 1 14 GLU CB C 0.313 -6.492 0.013 1.00 . A A . 14 GLU CB 1 1 14 8417 1 1 14 GLU CD C 1.758 -8.553 0.216 1.00 . A A . 14 GLU CD 1 1 14 8418 1 1 14 GLU CG C 1.392 -7.207 0.809 1.00 . A A . 14 GLU CG 1 1 14 8419 1 1 14 GLU H H -1.089 -3.895 -0.905 1.00 . A A . 14 GLU H 1 1 14 8420 1 1 14 GLU HA H 0.097 -4.944 1.476 1.00 . A A . 14 GLU HA 1 1 14 8421 1 1 14 GLU HB2 H -0.624 -7.006 0.172 1.00 . A A . 14 GLU HB2 1 1 14 8422 1 1 14 GLU HB3 H 0.571 -6.547 -1.034 1.00 . A A . 14 GLU HB3 1 1 14 8423 1 1 14 GLU HG2 H 2.276 -6.588 0.830 1.00 . A A . 14 GLU HG2 1 1 14 8424 1 1 14 GLU HG3 H 1.036 -7.359 1.818 1.00 . A A . 14 GLU HG3 1 1 14 8425 1 1 14 GLU N N -1.113 -4.501 -0.135 1.00 . A A . 14 GLU N 1 1 14 8426 1 1 14 GLU O O 1.355 -3.781 -1.260 1.00 . A A . 14 GLU O 1 1 14 8427 1 1 14 GLU OE1 O 1.954 -8.627 -1.015 1.00 . A A . 14 GLU OE1 1 1 14 8428 1 1 14 GLU OE2 O 1.849 -9.534 0.984 1.00 . A A . 14 GLU OE2 1 1 14 8429 1 1 15 CYS C C 4.504 -4.110 -0.325 1.00 . A A . 15 CYS C 1 1 14 8430 1 1 15 CYS CA C 3.496 -3.233 0.413 1.00 . A A . 15 CYS CA 1 1 14 8431 1 1 15 CYS CB C 4.141 -2.640 1.667 1.00 . A A . 15 CYS CB 1 1 14 8432 1 1 15 CYS H H 2.226 -4.362 1.674 1.00 . A A . 15 CYS H 1 1 14 8433 1 1 15 CYS HA H 3.193 -2.428 -0.240 1.00 . A A . 15 CYS HA 1 1 14 8434 1 1 15 CYS HB2 H 3.363 -2.303 2.337 1.00 . A A . 15 CYS HB2 1 1 14 8435 1 1 15 CYS HB3 H 4.725 -3.404 2.158 1.00 . A A . 15 CYS HB3 1 1 14 8436 1 1 15 CYS N N 2.306 -3.996 0.768 1.00 . A A . 15 CYS N 1 1 14 8437 1 1 15 CYS O O 4.915 -5.157 0.176 1.00 . A A . 15 CYS O 1 1 14 8438 1 1 15 CYS SG S 5.240 -1.225 1.340 1.00 . A A . 15 CYS SG 1 1 14 8439 1 1 16 ASP C C 7.288 -4.109 -1.888 1.00 . A A . 16 ASP C 1 1 14 8440 1 1 16 ASP CA C 5.859 -4.418 -2.323 1.00 . A A . 16 ASP CA 1 1 14 8441 1 1 16 ASP CB C 5.680 -4.085 -3.804 1.00 . A A . 16 ASP CB 1 1 14 8442 1 1 16 ASP CG C 6.338 -5.106 -4.711 1.00 . A A . 16 ASP CG 1 1 14 8443 1 1 16 ASP H H 4.535 -2.832 -1.862 1.00 . A A . 16 ASP H 1 1 14 8444 1 1 16 ASP HA H 5.672 -5.471 -2.175 1.00 . A A . 16 ASP HA 1 1 14 8445 1 1 16 ASP HB2 H 4.625 -4.053 -4.035 1.00 . A A . 16 ASP HB2 1 1 14 8446 1 1 16 ASP HB3 H 6.117 -3.117 -4.004 1.00 . A A . 16 ASP HB3 1 1 14 8447 1 1 16 ASP N N 4.898 -3.674 -1.516 1.00 . A A . 16 ASP N 1 1 14 8448 1 1 16 ASP O O 8.240 -4.348 -2.631 1.00 . A A . 16 ASP O 1 1 14 8449 1 1 16 ASP OD1 O 6.025 -6.308 -4.578 1.00 . A A . 16 ASP OD1 1 1 14 8450 1 1 16 ASP OD2 O 7.166 -4.704 -5.555 1.00 . A A . 16 ASP OD2 1 1 14 8451 1 1 17 VAL C C 9.044 -4.021 1.124 1.00 . A A . 17 VAL C 1 1 14 8452 1 1 17 VAL CA C 8.744 -3.232 -0.145 1.00 . A A . 17 VAL CA 1 1 14 8453 1 1 17 VAL CB C 8.849 -1.726 0.164 1.00 . A A . 17 VAL CB 1 1 14 8454 1 1 17 VAL CG1 C 10.207 -1.398 0.764 1.00 . A A . 17 VAL CG1 1 1 14 8455 1 1 17 VAL CG2 C 8.600 -0.907 -1.094 1.00 . A A . 17 VAL CG2 1 1 14 8456 1 1 17 VAL H H 6.635 -3.407 -0.133 1.00 . A A . 17 VAL H 1 1 14 8457 1 1 17 VAL HA H 9.483 -3.477 -0.893 1.00 . A A . 17 VAL HA 1 1 14 8458 1 1 17 VAL HB H 8.089 -1.474 0.889 1.00 . A A . 17 VAL HB 1 1 14 8459 1 1 17 VAL HG11 H 10.335 -1.944 1.687 1.00 . A A . 17 VAL HG11 1 1 14 8460 1 1 17 VAL HG12 H 10.986 -1.676 0.068 1.00 . A A . 17 VAL HG12 1 1 14 8461 1 1 17 VAL HG13 H 10.265 -0.338 0.963 1.00 . A A . 17 VAL HG13 1 1 14 8462 1 1 17 VAL HG21 H 8.046 -0.016 -0.839 1.00 . A A . 17 VAL HG21 1 1 14 8463 1 1 17 VAL HG22 H 9.545 -0.630 -1.535 1.00 . A A . 17 VAL HG22 1 1 14 8464 1 1 17 VAL HG23 H 8.031 -1.494 -1.800 1.00 . A A . 17 VAL HG23 1 1 14 8465 1 1 17 VAL N N 7.431 -3.574 -0.679 1.00 . A A . 17 VAL N 1 1 14 8466 1 1 17 VAL O O 10.107 -4.629 1.254 1.00 . A A . 17 VAL O 1 1 14 8467 1 1 18 CYS C C 7.251 -5.861 3.433 1.00 . A A . 18 CYS C 1 1 14 8468 1 1 18 CYS CA C 8.262 -4.724 3.320 1.00 . A A . 18 CYS CA 1 1 14 8469 1 1 18 CYS CB C 8.100 -3.763 4.499 1.00 . A A . 18 CYS CB 1 1 14 8470 1 1 18 CYS H H 7.273 -3.506 1.898 1.00 . A A . 18 CYS H 1 1 14 8471 1 1 18 CYS HA H 9.257 -5.140 3.340 1.00 . A A . 18 CYS HA 1 1 14 8472 1 1 18 CYS HB2 H 8.139 -4.327 5.420 1.00 . A A . 18 CYS HB2 1 1 14 8473 1 1 18 CYS HB3 H 8.910 -3.049 4.486 1.00 . A A . 18 CYS HB3 1 1 14 8474 1 1 18 CYS N N 8.100 -4.009 2.059 1.00 . A A . 18 CYS N 1 1 14 8475 1 1 18 CYS O O 7.279 -6.637 4.389 1.00 . A A . 18 CYS O 1 1 14 8476 1 1 18 CYS SG S 6.536 -2.829 4.489 1.00 . A A . 18 CYS SG 1 1 14 8477 1 1 19 ARG C C 4.421 -6.868 3.652 1.00 . A A . 19 ARG C 1 1 14 8478 1 1 19 ARG CA C 5.340 -6.996 2.441 1.00 . A A . 19 ARG CA 1 1 14 8479 1 1 19 ARG CB C 5.993 -8.379 2.427 1.00 . A A . 19 ARG CB 1 1 14 8480 1 1 19 ARG CD C 8.049 -8.132 1.002 1.00 . A A . 19 ARG CD 1 1 14 8481 1 1 19 ARG CG C 6.653 -8.727 1.103 1.00 . A A . 19 ARG CG 1 1 14 8482 1 1 19 ARG CZ C 9.527 -10.084 1.211 1.00 . A A . 19 ARG CZ 1 1 14 8483 1 1 19 ARG H H 6.389 -5.306 1.716 1.00 . A A . 19 ARG H 1 1 14 8484 1 1 19 ARG HA H 4.752 -6.876 1.544 1.00 . A A . 19 ARG HA 1 1 14 8485 1 1 19 ARG HB2 H 6.747 -8.417 3.200 1.00 . A A . 19 ARG HB2 1 1 14 8486 1 1 19 ARG HB3 H 5.239 -9.122 2.635 1.00 . A A . 19 ARG HB3 1 1 14 8487 1 1 19 ARG HD2 H 8.320 -8.059 -0.041 1.00 . A A . 19 ARG HD2 1 1 14 8488 1 1 19 ARG HD3 H 8.036 -7.145 1.440 1.00 . A A . 19 ARG HD3 1 1 14 8489 1 1 19 ARG HE H 9.364 -8.628 2.564 1.00 . A A . 19 ARG HE 1 1 14 8490 1 1 19 ARG HG2 H 6.726 -9.802 1.019 1.00 . A A . 19 ARG HG2 1 1 14 8491 1 1 19 ARG HG3 H 6.047 -8.341 0.297 1.00 . A A . 19 ARG HG3 1 1 14 8492 1 1 19 ARG HH11 H 8.432 -10.025 -0.485 1.00 . A A . 19 ARG HH11 1 1 14 8493 1 1 19 ARG HH12 H 9.478 -11.397 -0.326 1.00 . A A . 19 ARG HH12 1 1 14 8494 1 1 19 ARG HH21 H 10.747 -10.429 2.786 1.00 . A A . 19 ARG HH21 1 1 14 8495 1 1 19 ARG HH22 H 10.794 -11.626 1.536 1.00 . A A . 19 ARG HH22 1 1 14 8496 1 1 19 ARG N N 6.360 -5.954 2.451 1.00 . A A . 19 ARG N 1 1 14 8497 1 1 19 ARG NE N 9.043 -8.946 1.695 1.00 . A A . 19 ARG NE 1 1 14 8498 1 1 19 ARG NH1 N 9.111 -10.540 0.037 1.00 . A A . 19 ARG NH1 1 1 14 8499 1 1 19 ARG NH2 N 10.430 -10.769 1.901 1.00 . A A . 19 ARG NH2 1 1 14 8500 1 1 19 ARG O O 4.236 -7.822 4.409 1.00 . A A . 19 ARG O 1 1 14 8501 1 1 20 LYS C C 1.490 -5.476 4.496 1.00 . A A . 20 LYS C 1 1 14 8502 1 1 20 LYS CA C 2.946 -5.429 4.949 1.00 . A A . 20 LYS CA 1 1 14 8503 1 1 20 LYS CB C 3.252 -4.068 5.578 1.00 . A A . 20 LYS CB 1 1 14 8504 1 1 20 LYS CD C 3.619 -2.914 7.779 1.00 . A A . 20 LYS CD 1 1 14 8505 1 1 20 LYS CE C 3.653 -3.209 9.271 1.00 . A A . 20 LYS CE 1 1 14 8506 1 1 20 LYS CG C 2.805 -3.952 7.025 1.00 . A A . 20 LYS CG 1 1 14 8507 1 1 20 LYS H H 4.033 -4.961 3.194 1.00 . A A . 20 LYS H 1 1 14 8508 1 1 20 LYS HA H 3.106 -6.201 5.686 1.00 . A A . 20 LYS HA 1 1 14 8509 1 1 20 LYS HB2 H 4.317 -3.897 5.537 1.00 . A A . 20 LYS HB2 1 1 14 8510 1 1 20 LYS HB3 H 2.751 -3.300 5.006 1.00 . A A . 20 LYS HB3 1 1 14 8511 1 1 20 LYS HD2 H 4.630 -2.917 7.400 1.00 . A A . 20 LYS HD2 1 1 14 8512 1 1 20 LYS HD3 H 3.177 -1.940 7.623 1.00 . A A . 20 LYS HD3 1 1 14 8513 1 1 20 LYS HE2 H 4.213 -2.430 9.765 1.00 . A A . 20 LYS HE2 1 1 14 8514 1 1 20 LYS HE3 H 2.640 -3.217 9.646 1.00 . A A . 20 LYS HE3 1 1 14 8515 1 1 20 LYS HG2 H 1.764 -3.665 7.049 1.00 . A A . 20 LYS HG2 1 1 14 8516 1 1 20 LYS HG3 H 2.926 -4.912 7.507 1.00 . A A . 20 LYS HG3 1 1 14 8517 1 1 20 LYS HZ1 H 4.825 -4.853 8.734 1.00 . A A . 20 LYS HZ1 1 1 14 8518 1 1 20 LYS HZ2 H 3.560 -5.229 9.793 1.00 . A A . 20 LYS HZ2 1 1 14 8519 1 1 20 LYS HZ3 H 4.937 -4.436 10.370 1.00 . A A . 20 LYS HZ3 1 1 14 8520 1 1 20 LYS N N 3.847 -5.683 3.831 1.00 . A A . 20 LYS N 1 1 14 8521 1 1 20 LYS NZ N 4.288 -4.524 9.562 1.00 . A A . 20 LYS NZ 1 1 14 8522 1 1 20 LYS O O 1.145 -4.964 3.432 1.00 . A A . 20 LYS O 1 1 14 8523 1 1 21 ALA C C -1.598 -5.199 5.798 1.00 . A A . 21 ALA C 1 1 14 8524 1 1 21 ALA CA C -0.777 -6.204 4.996 1.00 . A A . 21 ALA CA 1 1 14 8525 1 1 21 ALA CB C -1.268 -7.619 5.260 1.00 . A A . 21 ALA CB 1 1 14 8526 1 1 21 ALA H H 0.977 -6.482 6.146 1.00 . A A . 21 ALA H 1 1 14 8527 1 1 21 ALA HA H -0.902 -5.996 3.943 1.00 . A A . 21 ALA HA 1 1 14 8528 1 1 21 ALA HB1 H -0.423 -8.262 5.456 1.00 . A A . 21 ALA HB1 1 1 14 8529 1 1 21 ALA HB2 H -1.926 -7.618 6.117 1.00 . A A . 21 ALA HB2 1 1 14 8530 1 1 21 ALA HB3 H -1.804 -7.982 4.395 1.00 . A A . 21 ALA HB3 1 1 14 8531 1 1 21 ALA N N 0.641 -6.093 5.312 1.00 . A A . 21 ALA N 1 1 14 8532 1 1 21 ALA O O -1.323 -4.956 6.973 1.00 . A A . 21 ALA O 1 1 14 8533 1 1 22 PHE C C -4.931 -3.881 5.459 1.00 . A A . 22 PHE C 1 1 14 8534 1 1 22 PHE CA C -3.465 -3.638 5.809 1.00 . A A . 22 PHE CA 1 1 14 8535 1 1 22 PHE CB C -3.060 -2.220 5.401 1.00 . A A . 22 PHE CB 1 1 14 8536 1 1 22 PHE CD1 C -0.719 -2.410 4.518 1.00 . A A . 22 PHE CD1 1 1 14 8537 1 1 22 PHE CD2 C -1.060 -1.281 6.590 1.00 . A A . 22 PHE CD2 1 1 14 8538 1 1 22 PHE CE1 C 0.640 -2.177 4.610 1.00 . A A . 22 PHE CE1 1 1 14 8539 1 1 22 PHE CE2 C 0.298 -1.044 6.687 1.00 . A A . 22 PHE CE2 1 1 14 8540 1 1 22 PHE CG C -1.584 -1.965 5.505 1.00 . A A . 22 PHE CG 1 1 14 8541 1 1 22 PHE CZ C 1.149 -1.493 5.697 1.00 . A A . 22 PHE CZ 1 1 14 8542 1 1 22 PHE H H -2.775 -4.854 4.219 1.00 . A A . 22 PHE H 1 1 14 8543 1 1 22 PHE HA H -3.339 -3.746 6.875 1.00 . A A . 22 PHE HA 1 1 14 8544 1 1 22 PHE HB2 H -3.354 -2.050 4.376 1.00 . A A . 22 PHE HB2 1 1 14 8545 1 1 22 PHE HB3 H -3.567 -1.511 6.038 1.00 . A A . 22 PHE HB3 1 1 14 8546 1 1 22 PHE HD1 H -1.117 -2.945 3.667 1.00 . A A . 22 PHE HD1 1 1 14 8547 1 1 22 PHE HD2 H -1.725 -0.929 7.366 1.00 . A A . 22 PHE HD2 1 1 14 8548 1 1 22 PHE HE1 H 1.303 -2.530 3.834 1.00 . A A . 22 PHE HE1 1 1 14 8549 1 1 22 PHE HE2 H 0.693 -0.510 7.538 1.00 . A A . 22 PHE HE2 1 1 14 8550 1 1 22 PHE HZ H 2.211 -1.309 5.771 1.00 . A A . 22 PHE HZ 1 1 14 8551 1 1 22 PHE N N -2.606 -4.618 5.155 1.00 . A A . 22 PHE N 1 1 14 8552 1 1 22 PHE O O -5.256 -4.800 4.707 1.00 . A A . 22 PHE O 1 1 14 8553 1 1 23 SER C C -7.672 -2.286 4.602 1.00 . A A . 23 SER C 1 1 14 8554 1 1 23 SER CA C -7.241 -3.178 5.762 1.00 . A A . 23 SER CA 1 1 14 8555 1 1 23 SER CB C -8.033 -2.815 7.020 1.00 . A A . 23 SER CB 1 1 14 8556 1 1 23 SER H H -5.488 -2.338 6.602 1.00 . A A . 23 SER H 1 1 14 8557 1 1 23 SER HA H -7.443 -4.207 5.504 1.00 . A A . 23 SER HA 1 1 14 8558 1 1 23 SER HB2 H -7.819 -1.794 7.295 1.00 . A A . 23 SER HB2 1 1 14 8559 1 1 23 SER HB3 H -9.090 -2.920 6.819 1.00 . A A . 23 SER HB3 1 1 14 8560 1 1 23 SER HG H -8.178 -4.485 8.034 1.00 . A A . 23 SER HG 1 1 14 8561 1 1 23 SER N N -5.810 -3.051 6.011 1.00 . A A . 23 SER N 1 1 14 8562 1 1 23 SER O O -8.202 -2.765 3.599 1.00 . A A . 23 SER O 1 1 14 8563 1 1 23 SER OG O -7.688 -3.662 8.102 1.00 . A A . 23 SER OG 1 1 14 8564 1 1 24 HIS C C -6.576 0.393 2.903 1.00 . A A . 24 HIS C 1 1 14 8565 1 1 24 HIS CA C -7.802 -0.024 3.710 1.00 . A A . 24 HIS CA 1 1 14 8566 1 1 24 HIS CB C -8.459 1.207 4.334 1.00 . A A . 24 HIS CB 1 1 14 8567 1 1 24 HIS CD2 C -10.222 1.384 2.439 1.00 . A A . 24 HIS CD2 1 1 14 8568 1 1 24 HIS CE1 C -10.629 3.534 2.581 1.00 . A A . 24 HIS CE1 1 1 14 8569 1 1 24 HIS CG C -9.447 1.881 3.431 1.00 . A A . 24 HIS CG 1 1 14 8570 1 1 24 HIS H H -7.013 -0.664 5.568 1.00 . A A . 24 HIS H 1 1 14 8571 1 1 24 HIS HA H -8.508 -0.502 3.047 1.00 . A A . 24 HIS HA 1 1 14 8572 1 1 24 HIS HB2 H -8.980 0.912 5.233 1.00 . A A . 24 HIS HB2 1 1 14 8573 1 1 24 HIS HB3 H -7.694 1.927 4.587 1.00 . A A . 24 HIS HB3 1 1 14 8574 1 1 24 HIS HD1 H -9.320 3.869 4.117 1.00 . A A . 24 HIS HD1 1 1 14 8575 1 1 24 HIS HD2 H -10.263 0.355 2.111 1.00 . A A . 24 HIS HD2 1 1 14 8576 1 1 24 HIS HE1 H -11.039 4.516 2.399 1.00 . A A . 24 HIS HE1 1 1 14 8577 1 1 24 HIS N N -7.439 -0.985 4.746 1.00 . A A . 24 HIS N 1 1 14 8578 1 1 24 HIS ND1 N -9.725 3.230 3.494 1.00 . A A . 24 HIS ND1 1 1 14 8579 1 1 24 HIS NE2 N -10.948 2.431 1.927 1.00 . A A . 24 HIS NE2 1 1 14 8580 1 1 24 HIS O O -5.454 -0.014 3.204 1.00 . A A . 24 HIS O 1 1 14 8581 1 1 25 HIS C C -4.928 2.793 1.714 1.00 . A A . 25 HIS C 1 1 14 8582 1 1 25 HIS CA C -5.712 1.680 1.025 1.00 . A A . 25 HIS CA 1 1 14 8583 1 1 25 HIS CB C -6.262 2.179 -0.311 1.00 . A A . 25 HIS CB 1 1 14 8584 1 1 25 HIS CD2 C -8.222 3.708 0.432 1.00 . A A . 25 HIS CD2 1 1 14 8585 1 1 25 HIS CE1 C -7.548 5.571 -0.507 1.00 . A A . 25 HIS CE1 1 1 14 8586 1 1 25 HIS CG C -7.052 3.447 -0.197 1.00 . A A . 25 HIS CG 1 1 14 8587 1 1 25 HIS H H -7.715 1.497 1.686 1.00 . A A . 25 HIS H 1 1 14 8588 1 1 25 HIS HA H -5.048 0.848 0.843 1.00 . A A . 25 HIS HA 1 1 14 8589 1 1 25 HIS HB2 H -5.439 2.361 -0.986 1.00 . A A . 25 HIS HB2 1 1 14 8590 1 1 25 HIS HB3 H -6.907 1.422 -0.733 1.00 . A A . 25 HIS HB3 1 1 14 8591 1 1 25 HIS HD1 H -5.843 4.770 -1.305 1.00 . A A . 25 HIS HD1 1 1 14 8592 1 1 25 HIS HD2 H -8.820 3.003 0.993 1.00 . A A . 25 HIS HD2 1 1 14 8593 1 1 25 HIS HE1 H -7.501 6.600 -0.829 1.00 . A A . 25 HIS HE1 1 1 14 8594 1 1 25 HIS N N -6.799 1.207 1.876 1.00 . A A . 25 HIS N 1 1 14 8595 1 1 25 HIS ND1 N -6.657 4.634 -0.776 1.00 . A A . 25 HIS ND1 1 1 14 8596 1 1 25 HIS NE2 N -8.508 5.034 0.225 1.00 . A A . 25 HIS NE2 1 1 14 8597 1 1 25 HIS O O -3.706 2.718 1.838 1.00 . A A . 25 HIS O 1 1 14 8598 1 1 26 ALA C C -3.873 4.484 3.738 1.00 . A A . 26 ALA C 1 1 14 8599 1 1 26 ALA CA C -5.010 4.951 2.835 1.00 . A A . 26 ALA CA 1 1 14 8600 1 1 26 ALA CB C -6.042 5.726 3.640 1.00 . A A . 26 ALA CB 1 1 14 8601 1 1 26 ALA H H -6.610 3.825 2.029 1.00 . A A . 26 ALA H 1 1 14 8602 1 1 26 ALA HA H -4.608 5.611 2.080 1.00 . A A . 26 ALA HA 1 1 14 8603 1 1 26 ALA HB1 H -6.083 5.334 4.645 1.00 . A A . 26 ALA HB1 1 1 14 8604 1 1 26 ALA HB2 H -5.763 6.770 3.671 1.00 . A A . 26 ALA HB2 1 1 14 8605 1 1 26 ALA HB3 H -7.011 5.626 3.174 1.00 . A A . 26 ALA HB3 1 1 14 8606 1 1 26 ALA N N -5.639 3.824 2.158 1.00 . A A . 26 ALA N 1 1 14 8607 1 1 26 ALA O O -2.826 5.126 3.815 1.00 . A A . 26 ALA O 1 1 14 8608 1 1 27 SER C C -1.804 2.468 4.564 1.00 . A A . 27 SER C 1 1 14 8609 1 1 27 SER CA C -3.082 2.814 5.322 1.00 . A A . 27 SER CA 1 1 14 8610 1 1 27 SER CB C -3.625 1.568 6.025 1.00 . A A . 27 SER CB 1 1 14 8611 1 1 27 SER H H -4.943 2.897 4.316 1.00 . A A . 27 SER H 1 1 14 8612 1 1 27 SER HA H -2.855 3.565 6.063 1.00 . A A . 27 SER HA 1 1 14 8613 1 1 27 SER HB2 H -2.914 1.239 6.768 1.00 . A A . 27 SER HB2 1 1 14 8614 1 1 27 SER HB3 H -4.562 1.809 6.505 1.00 . A A . 27 SER HB3 1 1 14 8615 1 1 27 SER HG H -4.638 0.036 5.343 1.00 . A A . 27 SER HG 1 1 14 8616 1 1 27 SER N N -4.088 3.364 4.420 1.00 . A A . 27 SER N 1 1 14 8617 1 1 27 SER O O -0.707 2.865 4.960 1.00 . A A . 27 SER O 1 1 14 8618 1 1 27 SER OG O -3.841 0.515 5.102 1.00 . A A . 27 SER OG 1 1 14 8619 1 1 28 LEU C C -0.198 2.530 1.950 1.00 . A A . 28 LEU C 1 1 14 8620 1 1 28 LEU CA C -0.811 1.325 2.658 1.00 . A A . 28 LEU CA 1 1 14 8621 1 1 28 LEU CB C -1.237 0.277 1.629 1.00 . A A . 28 LEU CB 1 1 14 8622 1 1 28 LEU CD1 C 1.077 -0.499 1.054 1.00 . A A . 28 LEU CD1 1 1 14 8623 1 1 28 LEU CD2 C -0.825 -0.994 -0.493 1.00 . A A . 28 LEU CD2 1 1 14 8624 1 1 28 LEU CG C -0.245 0.006 0.497 1.00 . A A . 28 LEU CG 1 1 14 8625 1 1 28 LEU H H -2.852 1.440 3.208 1.00 . A A . 28 LEU H 1 1 14 8626 1 1 28 LEU HA H -0.071 0.894 3.315 1.00 . A A . 28 LEU HA 1 1 14 8627 1 1 28 LEU HB2 H -1.402 -0.652 2.152 1.00 . A A . 28 LEU HB2 1 1 14 8628 1 1 28 LEU HB3 H -2.165 0.608 1.185 1.00 . A A . 28 LEU HB3 1 1 14 8629 1 1 28 LEU HD11 H 1.430 0.182 1.814 1.00 . A A . 28 LEU HD11 1 1 14 8630 1 1 28 LEU HD12 H 1.804 -0.558 0.258 1.00 . A A . 28 LEU HD12 1 1 14 8631 1 1 28 LEU HD13 H 0.935 -1.479 1.486 1.00 . A A . 28 LEU HD13 1 1 14 8632 1 1 28 LEU HD21 H -0.061 -1.287 -1.198 1.00 . A A . 28 LEU HD21 1 1 14 8633 1 1 28 LEU HD22 H -1.649 -0.539 -1.022 1.00 . A A . 28 LEU HD22 1 1 14 8634 1 1 28 LEU HD23 H -1.177 -1.865 0.041 1.00 . A A . 28 LEU HD23 1 1 14 8635 1 1 28 LEU HG H -0.052 0.929 -0.033 1.00 . A A . 28 LEU HG 1 1 14 8636 1 1 28 LEU N N -1.953 1.726 3.473 1.00 . A A . 28 LEU N 1 1 14 8637 1 1 28 LEU O O 1.023 2.684 1.908 1.00 . A A . 28 LEU O 1 1 14 8638 1 1 29 THR C C 0.195 5.490 1.615 1.00 . A A . 29 THR C 1 1 14 8639 1 1 29 THR CA C -0.598 4.573 0.690 1.00 . A A . 29 THR CA 1 1 14 8640 1 1 29 THR CB C -1.780 5.362 0.096 1.00 . A A . 29 THR CB 1 1 14 8641 1 1 29 THR CG2 C -1.375 6.796 -0.211 1.00 . A A . 29 THR CG2 1 1 14 8642 1 1 29 THR H H -2.016 3.204 1.462 1.00 . A A . 29 THR H 1 1 14 8643 1 1 29 THR HA H 0.041 4.256 -0.121 1.00 . A A . 29 THR HA 1 1 14 8644 1 1 29 THR HB H -2.583 5.377 0.819 1.00 . A A . 29 THR HB 1 1 14 8645 1 1 29 THR HG1 H -2.822 5.322 -1.578 1.00 . A A . 29 THR HG1 1 1 14 8646 1 1 29 THR HG21 H -1.766 7.081 -1.176 1.00 . A A . 29 THR HG21 1 1 14 8647 1 1 29 THR HG22 H -0.297 6.870 -0.223 1.00 . A A . 29 THR HG22 1 1 14 8648 1 1 29 THR HG23 H -1.773 7.452 0.548 1.00 . A A . 29 THR HG23 1 1 14 8649 1 1 29 THR N N -1.054 3.382 1.395 1.00 . A A . 29 THR N 1 1 14 8650 1 1 29 THR O O 1.310 5.897 1.292 1.00 . A A . 29 THR O 1 1 14 8651 1 1 29 THR OG1 O -2.241 4.725 -1.101 1.00 . A A . 29 THR OG1 1 1 14 8652 1 1 30 GLN C C 1.519 6.016 4.303 1.00 . A A . 30 GLN C 1 1 14 8653 1 1 30 GLN CA C 0.267 6.677 3.738 1.00 . A A . 30 GLN CA 1 1 14 8654 1 1 30 GLN CB C -0.697 7.025 4.873 1.00 . A A . 30 GLN CB 1 1 14 8655 1 1 30 GLN CD C -0.772 9.428 4.098 1.00 . A A . 30 GLN CD 1 1 14 8656 1 1 30 GLN CG C -1.571 8.234 4.581 1.00 . A A . 30 GLN CG 1 1 14 8657 1 1 30 GLN H H -1.277 5.452 2.967 1.00 . A A . 30 GLN H 1 1 14 8658 1 1 30 GLN HA H 0.553 7.586 3.230 1.00 . A A . 30 GLN HA 1 1 14 8659 1 1 30 GLN HB2 H -1.341 6.177 5.055 1.00 . A A . 30 GLN HB2 1 1 14 8660 1 1 30 GLN HB3 H -0.125 7.230 5.766 1.00 . A A . 30 GLN HB3 1 1 14 8661 1 1 30 GLN HE21 H -0.286 9.891 5.970 1.00 . A A . 30 GLN HE21 1 1 14 8662 1 1 30 GLN HE22 H 0.345 10.938 4.749 1.00 . A A . 30 GLN HE22 1 1 14 8663 1 1 30 GLN HG2 H -2.288 7.968 3.818 1.00 . A A . 30 GLN HG2 1 1 14 8664 1 1 30 GLN HG3 H -2.095 8.510 5.484 1.00 . A A . 30 GLN HG3 1 1 14 8665 1 1 30 GLN N N -0.387 5.809 2.766 1.00 . A A . 30 GLN N 1 1 14 8666 1 1 30 GLN NE2 N -0.178 10.160 5.033 1.00 . A A . 30 GLN NE2 1 1 14 8667 1 1 30 GLN O O 2.495 6.691 4.634 1.00 . A A . 30 GLN O 1 1 14 8668 1 1 30 GLN OE1 O -0.690 9.691 2.898 1.00 . A A . 30 GLN OE1 1 1 14 8669 1 1 31 HIS C C 3.838 4.090 4.033 1.00 . A A . 31 HIS C 1 1 14 8670 1 1 31 HIS CA C 2.619 3.938 4.937 1.00 . A A . 31 HIS CA 1 1 14 8671 1 1 31 HIS CB C 2.255 2.460 5.078 1.00 . A A . 31 HIS CB 1 1 14 8672 1 1 31 HIS CD2 C 3.999 0.925 3.924 1.00 . A A . 31 HIS CD2 1 1 14 8673 1 1 31 HIS CE1 C 5.147 0.352 5.702 1.00 . A A . 31 HIS CE1 1 1 14 8674 1 1 31 HIS CG C 3.434 1.541 4.989 1.00 . A A . 31 HIS CG 1 1 14 8675 1 1 31 HIS H H 0.680 4.209 4.132 1.00 . A A . 31 HIS H 1 1 14 8676 1 1 31 HIS HA H 2.857 4.335 5.912 1.00 . A A . 31 HIS HA 1 1 14 8677 1 1 31 HIS HB2 H 1.783 2.302 6.036 1.00 . A A . 31 HIS HB2 1 1 14 8678 1 1 31 HIS HB3 H 1.563 2.190 4.292 1.00 . A A . 31 HIS HB3 1 1 14 8679 1 1 31 HIS HD1 H 4.016 1.443 7.012 1.00 . A A . 31 HIS HD1 1 1 14 8680 1 1 31 HIS HD2 H 3.675 0.997 2.895 1.00 . A A . 31 HIS HD2 1 1 14 8681 1 1 31 HIS HE1 H 5.884 -0.103 6.346 1.00 . A A . 31 HIS HE1 1 1 14 8682 1 1 31 HIS N N 1.486 4.691 4.412 1.00 . A A . 31 HIS N 1 1 14 8683 1 1 31 HIS ND1 N 4.176 1.161 6.087 1.00 . A A . 31 HIS ND1 1 1 14 8684 1 1 31 HIS NE2 N 5.061 0.192 4.393 1.00 . A A . 31 HIS NE2 1 1 14 8685 1 1 31 HIS O O 4.909 4.495 4.484 1.00 . A A . 31 HIS O 1 1 14 8686 1 1 32 GLN C C 5.615 5.091 2.064 1.00 . A A . 32 GLN C 1 1 14 8687 1 1 32 GLN CA C 4.755 3.861 1.791 1.00 . A A . 32 GLN CA 1 1 14 8688 1 1 32 GLN CB C 4.198 3.919 0.368 1.00 . A A . 32 GLN CB 1 1 14 8689 1 1 32 GLN CD C 3.404 2.542 -1.596 1.00 . A A . 32 GLN CD 1 1 14 8690 1 1 32 GLN CG C 3.560 2.618 -0.090 1.00 . A A . 32 GLN CG 1 1 14 8691 1 1 32 GLN H H 2.790 3.446 2.458 1.00 . A A . 32 GLN H 1 1 14 8692 1 1 32 GLN HA H 5.369 2.979 1.891 1.00 . A A . 32 GLN HA 1 1 14 8693 1 1 32 GLN HB2 H 3.452 4.698 0.317 1.00 . A A . 32 GLN HB2 1 1 14 8694 1 1 32 GLN HB3 H 5.003 4.159 -0.312 1.00 . A A . 32 GLN HB3 1 1 14 8695 1 1 32 GLN HE21 H 1.899 1.258 -1.400 1.00 . A A . 32 GLN HE21 1 1 14 8696 1 1 32 GLN HE22 H 2.321 1.677 -3.021 1.00 . A A . 32 GLN HE22 1 1 14 8697 1 1 32 GLN HG2 H 4.180 1.795 0.234 1.00 . A A . 32 GLN HG2 1 1 14 8698 1 1 32 GLN HG3 H 2.584 2.531 0.364 1.00 . A A . 32 GLN HG3 1 1 14 8699 1 1 32 GLN N N 3.667 3.762 2.757 1.00 . A A . 32 GLN N 1 1 14 8700 1 1 32 GLN NE2 N 2.445 1.745 -2.052 1.00 . A A . 32 GLN NE2 1 1 14 8701 1 1 32 GLN O O 6.826 5.074 1.845 1.00 . A A . 32 GLN O 1 1 14 8702 1 1 32 GLN OE1 O 4.137 3.192 -2.341 1.00 . A A . 32 GLN OE1 1 1 14 8703 1 1 33 ARG C C 7.032 7.107 3.505 1.00 . A A . 33 ARG C 1 1 14 8704 1 1 33 ARG CA C 5.688 7.395 2.843 1.00 . A A . 33 ARG CA 1 1 14 8705 1 1 33 ARG CB C 4.838 8.284 3.754 1.00 . A A . 33 ARG CB 1 1 14 8706 1 1 33 ARG CD C 3.520 9.869 2.317 1.00 . A A . 33 ARG CD 1 1 14 8707 1 1 33 ARG CG C 3.472 8.616 3.178 1.00 . A A . 33 ARG CG 1 1 14 8708 1 1 33 ARG CZ C 2.384 10.803 0.347 1.00 . A A . 33 ARG CZ 1 1 14 8709 1 1 33 ARG H H 4.014 6.108 2.696 1.00 . A A . 33 ARG H 1 1 14 8710 1 1 33 ARG HA H 5.862 7.913 1.911 1.00 . A A . 33 ARG HA 1 1 14 8711 1 1 33 ARG HB2 H 4.693 7.778 4.697 1.00 . A A . 33 ARG HB2 1 1 14 8712 1 1 33 ARG HB3 H 5.366 9.209 3.928 1.00 . A A . 33 ARG HB3 1 1 14 8713 1 1 33 ARG HD2 H 3.335 10.728 2.944 1.00 . A A . 33 ARG HD2 1 1 14 8714 1 1 33 ARG HD3 H 4.503 9.950 1.878 1.00 . A A . 33 ARG HD3 1 1 14 8715 1 1 33 ARG HE H 1.931 9.060 1.204 1.00 . A A . 33 ARG HE 1 1 14 8716 1 1 33 ARG HG2 H 3.136 7.789 2.571 1.00 . A A . 33 ARG HG2 1 1 14 8717 1 1 33 ARG HG3 H 2.778 8.775 3.990 1.00 . A A . 33 ARG HG3 1 1 14 8718 1 1 33 ARG HH11 H 3.874 11.947 1.091 1.00 . A A . 33 ARG HH11 1 1 14 8719 1 1 33 ARG HH12 H 3.064 12.593 -0.298 1.00 . A A . 33 ARG HH12 1 1 14 8720 1 1 33 ARG HH21 H 0.858 9.901 -0.625 1.00 . A A . 33 ARG HH21 1 1 14 8721 1 1 33 ARG HH22 H 1.349 11.429 -1.272 1.00 . A A . 33 ARG HH22 1 1 14 8722 1 1 33 ARG N N 4.981 6.156 2.542 1.00 . A A . 33 ARG N 1 1 14 8723 1 1 33 ARG NE N 2.524 9.838 1.249 1.00 . A A . 33 ARG NE 1 1 14 8724 1 1 33 ARG NH1 N 3.171 11.869 0.383 1.00 . A A . 33 ARG NH1 1 1 14 8725 1 1 33 ARG NH2 N 1.454 10.703 -0.594 1.00 . A A . 33 ARG NH2 1 1 14 8726 1 1 33 ARG O O 8.050 7.702 3.152 1.00 . A A . 33 ARG O 1 1 14 8727 1 1 34 VAL C C 9.374 5.500 4.206 1.00 . A A . 34 VAL C 1 1 14 8728 1 1 34 VAL CA C 8.246 5.823 5.179 1.00 . A A . 34 VAL CA 1 1 14 8729 1 1 34 VAL CB C 8.014 4.610 6.100 1.00 . A A . 34 VAL CB 1 1 14 8730 1 1 34 VAL CG1 C 6.886 4.892 7.081 1.00 . A A . 34 VAL CG1 1 1 14 8731 1 1 34 VAL CG2 C 7.717 3.366 5.277 1.00 . A A . 34 VAL CG2 1 1 14 8732 1 1 34 VAL H H 6.184 5.751 4.705 1.00 . A A . 34 VAL H 1 1 14 8733 1 1 34 VAL HA H 8.541 6.662 5.792 1.00 . A A . 34 VAL HA 1 1 14 8734 1 1 34 VAL HB H 8.917 4.435 6.666 1.00 . A A . 34 VAL HB 1 1 14 8735 1 1 34 VAL HG11 H 6.116 5.468 6.587 1.00 . A A . 34 VAL HG11 1 1 14 8736 1 1 34 VAL HG12 H 6.471 3.959 7.431 1.00 . A A . 34 VAL HG12 1 1 14 8737 1 1 34 VAL HG13 H 7.270 5.453 7.920 1.00 . A A . 34 VAL HG13 1 1 14 8738 1 1 34 VAL HG21 H 6.907 3.571 4.593 1.00 . A A . 34 VAL HG21 1 1 14 8739 1 1 34 VAL HG22 H 8.598 3.086 4.719 1.00 . A A . 34 VAL HG22 1 1 14 8740 1 1 34 VAL HG23 H 7.435 2.557 5.936 1.00 . A A . 34 VAL HG23 1 1 14 8741 1 1 34 VAL N N 7.027 6.191 4.468 1.00 . A A . 34 VAL N 1 1 14 8742 1 1 34 VAL O O 10.504 5.957 4.375 1.00 . A A . 34 VAL O 1 1 14 8743 1 1 35 HIS C C 10.327 5.479 1.226 1.00 . A A . 35 HIS C 1 1 14 8744 1 1 35 HIS CA C 10.047 4.324 2.183 1.00 . A A . 35 HIS CA 1 1 14 8745 1 1 35 HIS CB C 9.562 3.104 1.400 1.00 . A A . 35 HIS CB 1 1 14 8746 1 1 35 HIS CD2 C 7.900 1.319 2.282 1.00 . A A . 35 HIS CD2 1 1 14 8747 1 1 35 HIS CE1 C 9.149 0.476 3.874 1.00 . A A . 35 HIS CE1 1 1 14 8748 1 1 35 HIS CG C 9.077 1.987 2.272 1.00 . A A . 35 HIS CG 1 1 14 8749 1 1 35 HIS H H 8.141 4.376 3.104 1.00 . A A . 35 HIS H 1 1 14 8750 1 1 35 HIS HA H 10.961 4.070 2.698 1.00 . A A . 35 HIS HA 1 1 14 8751 1 1 35 HIS HB2 H 8.747 3.399 0.756 1.00 . A A . 35 HIS HB2 1 1 14 8752 1 1 35 HIS HB3 H 10.374 2.726 0.796 1.00 . A A . 35 HIS HB3 1 1 14 8753 1 1 35 HIS HD1 H 10.746 1.707 3.526 1.00 . A A . 35 HIS HD1 1 1 14 8754 1 1 35 HIS HD2 H 7.060 1.488 1.622 1.00 . A A . 35 HIS HD2 1 1 14 8755 1 1 35 HIS HE1 H 9.492 -0.131 4.698 1.00 . A A . 35 HIS HE1 1 1 14 8756 1 1 35 HIS N N 9.059 4.708 3.185 1.00 . A A . 35 HIS N 1 1 14 8757 1 1 35 HIS ND1 N 9.837 1.436 3.282 1.00 . A A . 35 HIS ND1 1 1 14 8758 1 1 35 HIS NE2 N 7.970 0.385 3.286 1.00 . A A . 35 HIS NE2 1 1 14 8759 1 1 35 HIS O O 9.624 6.489 1.234 1.00 . A A . 35 HIS O 1 1 14 8760 1 1 36 SER C C 12.022 5.744 -1.925 1.00 . A A . 36 SER C 1 1 14 8761 1 1 36 SER CA C 11.735 6.354 -0.556 1.00 . A A . 36 SER CA 1 1 14 8762 1 1 36 SER CB C 12.963 7.119 -0.059 1.00 . A A . 36 SER CB 1 1 14 8763 1 1 36 SER H H 11.882 4.494 0.445 1.00 . A A . 36 SER H 1 1 14 8764 1 1 36 SER HA H 10.907 7.040 -0.647 1.00 . A A . 36 SER HA 1 1 14 8765 1 1 36 SER HB2 H 12.779 7.481 0.941 1.00 . A A . 36 SER HB2 1 1 14 8766 1 1 36 SER HB3 H 13.817 6.458 -0.051 1.00 . A A . 36 SER HB3 1 1 14 8767 1 1 36 SER HG H 14.075 8.630 -0.624 1.00 . A A . 36 SER HG 1 1 14 8768 1 1 36 SER N N 11.359 5.323 0.404 1.00 . A A . 36 SER N 1 1 14 8769 1 1 36 SER O O 12.676 4.707 -2.031 1.00 . A A . 36 SER O 1 1 14 8770 1 1 36 SER OG O 13.250 8.224 -0.899 1.00 . A A . 36 SER OG 1 1 14 8771 1 1 37 GLY C C 13.186 6.011 -4.756 1.00 . A A . 37 GLY C 1 1 14 8772 1 1 37 GLY CA C 11.738 5.904 -4.321 1.00 . A A . 37 GLY CA 1 1 14 8773 1 1 37 GLY H H 11.012 7.218 -2.828 1.00 . A A . 37 GLY H 1 1 14 8774 1 1 37 GLY HA2 H 11.434 4.869 -4.367 1.00 . A A . 37 GLY HA2 1 1 14 8775 1 1 37 GLY HA3 H 11.127 6.479 -5.002 1.00 . A A . 37 GLY HA3 1 1 14 8776 1 1 37 GLY N N 11.526 6.396 -2.972 1.00 . A A . 37 GLY N 1 1 14 8777 1 1 37 GLY O O 13.746 5.064 -5.307 1.00 . A A . 37 GLY O 1 1 14 8778 1 1 38 GLU C C 16.054 7.593 -3.643 1.00 . A A . 38 GLU C 1 1 14 8779 1 1 38 GLU CA C 15.185 7.394 -4.881 1.00 . A A . 38 GLU CA 1 1 14 8780 1 1 38 GLU CB C 15.299 8.613 -5.799 1.00 . A A . 38 GLU CB 1 1 14 8781 1 1 38 GLU CD C 15.745 7.832 -8.159 1.00 . A A . 38 GLU CD 1 1 14 8782 1 1 38 GLU CG C 14.722 8.386 -7.186 1.00 . A A . 38 GLU CG 1 1 14 8783 1 1 38 GLU H H 13.294 7.885 -4.065 1.00 . A A . 38 GLU H 1 1 14 8784 1 1 38 GLU HA H 15.532 6.521 -5.413 1.00 . A A . 38 GLU HA 1 1 14 8785 1 1 38 GLU HB2 H 14.775 9.441 -5.344 1.00 . A A . 38 GLU HB2 1 1 14 8786 1 1 38 GLU HB3 H 16.342 8.873 -5.903 1.00 . A A . 38 GLU HB3 1 1 14 8787 1 1 38 GLU HG2 H 13.903 7.686 -7.112 1.00 . A A . 38 GLU HG2 1 1 14 8788 1 1 38 GLU HG3 H 14.356 9.327 -7.568 1.00 . A A . 38 GLU HG3 1 1 14 8789 1 1 38 GLU N N 13.794 7.167 -4.508 1.00 . A A . 38 GLU N 1 1 14 8790 1 1 38 GLU O O 15.652 8.257 -2.687 1.00 . A A . 38 GLU O 1 1 14 8791 1 1 38 GLU OE1 O 16.053 6.625 -8.072 1.00 . A A . 38 GLU OE1 1 1 14 8792 1 1 38 GLU OE2 O 16.237 8.605 -9.007 1.00 . A A . 38 GLU OE2 1 1 14 8793 1 1 39 LYS C C 19.467 7.816 -2.978 1.00 . A A . 39 LYS C 1 1 14 8794 1 1 39 LYS CA C 18.177 7.124 -2.547 1.00 . A A . 39 LYS CA 1 1 14 8795 1 1 39 LYS CB C 18.495 5.739 -1.980 1.00 . A A . 39 LYS CB 1 1 14 8796 1 1 39 LYS CD C 19.971 4.327 -0.518 1.00 . A A . 39 LYS CD 1 1 14 8797 1 1 39 LYS CE C 21.439 4.121 -0.177 1.00 . A A . 39 LYS CE 1 1 14 8798 1 1 39 LYS CG C 19.719 5.715 -1.082 1.00 . A A . 39 LYS CG 1 1 14 8799 1 1 39 LYS H H 17.513 6.494 -4.456 1.00 . A A . 39 LYS H 1 1 14 8800 1 1 39 LYS HA H 17.703 7.718 -1.781 1.00 . A A . 39 LYS HA 1 1 14 8801 1 1 39 LYS HB2 H 17.647 5.395 -1.406 1.00 . A A . 39 LYS HB2 1 1 14 8802 1 1 39 LYS HB3 H 18.664 5.057 -2.801 1.00 . A A . 39 LYS HB3 1 1 14 8803 1 1 39 LYS HD2 H 19.384 4.200 0.380 1.00 . A A . 39 LYS HD2 1 1 14 8804 1 1 39 LYS HD3 H 19.674 3.591 -1.251 1.00 . A A . 39 LYS HD3 1 1 14 8805 1 1 39 LYS HE2 H 21.789 4.977 0.381 1.00 . A A . 39 LYS HE2 1 1 14 8806 1 1 39 LYS HE3 H 21.533 3.233 0.430 1.00 . A A . 39 LYS HE3 1 1 14 8807 1 1 39 LYS HG2 H 20.582 6.021 -1.656 1.00 . A A . 39 LYS HG2 1 1 14 8808 1 1 39 LYS HG3 H 19.567 6.404 -0.263 1.00 . A A . 39 LYS HG3 1 1 14 8809 1 1 39 LYS HZ1 H 22.174 4.798 -2.011 1.00 . A A . 39 LYS HZ1 1 1 14 8810 1 1 39 LYS HZ2 H 21.978 3.120 -1.929 1.00 . A A . 39 LYS HZ2 1 1 14 8811 1 1 39 LYS HZ3 H 23.276 3.860 -1.136 1.00 . A A . 39 LYS HZ3 1 1 14 8812 1 1 39 LYS N N 17.249 7.011 -3.666 1.00 . A A . 39 LYS N 1 1 14 8813 1 1 39 LYS NZ N 22.275 3.964 -1.399 1.00 . A A . 39 LYS NZ 1 1 14 8814 1 1 39 LYS O O 20.046 7.510 -4.020 1.00 . A A . 39 LYS O 1 1 14 8815 1 1 40 PRO C C 22.407 8.665 -2.295 1.00 . A A . 40 PRO C 1 1 14 8816 1 1 40 PRO CA C 21.156 9.525 -2.432 1.00 . A A . 40 PRO CA 1 1 14 8817 1 1 40 PRO CB C 21.143 10.624 -1.366 1.00 . A A . 40 PRO CB 1 1 14 8818 1 1 40 PRO CD C 19.289 9.189 -0.898 1.00 . A A . 40 PRO CD 1 1 14 8819 1 1 40 PRO CG C 20.330 10.062 -0.252 1.00 . A A . 40 PRO CG 1 1 14 8820 1 1 40 PRO HA H 21.134 9.974 -3.414 1.00 . A A . 40 PRO HA 1 1 14 8821 1 1 40 PRO HB2 H 22.155 10.835 -1.050 1.00 . A A . 40 PRO HB2 1 1 14 8822 1 1 40 PRO HB3 H 20.693 11.518 -1.771 1.00 . A A . 40 PRO HB3 1 1 14 8823 1 1 40 PRO HD2 H 19.073 8.334 -0.274 1.00 . A A . 40 PRO HD2 1 1 14 8824 1 1 40 PRO HD3 H 18.390 9.754 -1.092 1.00 . A A . 40 PRO HD3 1 1 14 8825 1 1 40 PRO HG2 H 20.957 9.476 0.402 1.00 . A A . 40 PRO HG2 1 1 14 8826 1 1 40 PRO HG3 H 19.857 10.862 0.298 1.00 . A A . 40 PRO HG3 1 1 14 8827 1 1 40 PRO N N 19.929 8.771 -2.157 1.00 . A A . 40 PRO N 1 1 14 8828 1 1 40 PRO O O 23.042 8.639 -1.241 1.00 . A A . 40 PRO O 1 1 14 8829 1 1 41 SER C C 25.213 7.924 -3.325 1.00 . A A . 41 SER C 1 1 14 8830 1 1 41 SER CA C 23.931 7.098 -3.366 1.00 . A A . 41 SER CA 1 1 14 8831 1 1 41 SER CB C 23.930 6.198 -4.603 1.00 . A A . 41 SER CB 1 1 14 8832 1 1 41 SER H H 22.210 8.025 -4.179 1.00 . A A . 41 SER H 1 1 14 8833 1 1 41 SER HA H 23.887 6.480 -2.481 1.00 . A A . 41 SER HA 1 1 14 8834 1 1 41 SER HB2 H 24.044 6.806 -5.487 1.00 . A A . 41 SER HB2 1 1 14 8835 1 1 41 SER HB3 H 24.753 5.500 -4.537 1.00 . A A . 41 SER HB3 1 1 14 8836 1 1 41 SER HG H 21.991 6.014 -4.394 1.00 . A A . 41 SER HG 1 1 14 8837 1 1 41 SER N N 22.757 7.962 -3.368 1.00 . A A . 41 SER N 1 1 14 8838 1 1 41 SER O O 25.764 8.289 -4.363 1.00 . A A . 41 SER O 1 1 14 8839 1 1 41 SER OG O 22.719 5.469 -4.702 1.00 . A A . 41 SER OG 1 1 14 8840 1 1 42 GLY C C 27.749 8.519 -0.800 1.00 . A A . 42 GLY C 1 1 14 8841 1 1 42 GLY CA C 26.898 8.996 -1.960 1.00 . A A . 42 GLY CA 1 1 14 8842 1 1 42 GLY H H 25.203 7.897 -1.323 1.00 . A A . 42 GLY H 1 1 14 8843 1 1 42 GLY HA2 H 27.476 8.927 -2.870 1.00 . A A . 42 GLY HA2 1 1 14 8844 1 1 42 GLY HA3 H 26.628 10.029 -1.794 1.00 . A A . 42 GLY HA3 1 1 14 8845 1 1 42 GLY N N 25.684 8.215 -2.116 1.00 . A A . 42 GLY N 1 1 14 8846 1 1 42 GLY O O 27.350 7.649 -0.026 1.00 . A A . 42 GLY O 1 1 14 8847 1 1 43 PRO C C 29.407 9.206 1.771 1.00 . A A . 43 PRO C 1 1 14 8848 1 1 43 PRO CA C 29.889 8.740 0.402 1.00 . A A . 43 PRO CA 1 1 14 8849 1 1 43 PRO CB C 31.174 9.473 0.008 1.00 . A A . 43 PRO CB 1 1 14 8850 1 1 43 PRO CD C 29.493 10.140 -1.555 1.00 . A A . 43 PRO CD 1 1 14 8851 1 1 43 PRO CG C 30.715 10.621 -0.823 1.00 . A A . 43 PRO CG 1 1 14 8852 1 1 43 PRO HA H 30.073 7.676 0.430 1.00 . A A . 43 PRO HA 1 1 14 8853 1 1 43 PRO HB2 H 31.686 9.808 0.899 1.00 . A A . 43 PRO HB2 1 1 14 8854 1 1 43 PRO HB3 H 31.813 8.809 -0.554 1.00 . A A . 43 PRO HB3 1 1 14 8855 1 1 43 PRO HD2 H 28.785 10.946 -1.678 1.00 . A A . 43 PRO HD2 1 1 14 8856 1 1 43 PRO HD3 H 29.767 9.727 -2.515 1.00 . A A . 43 PRO HD3 1 1 14 8857 1 1 43 PRO HG2 H 30.467 11.458 -0.188 1.00 . A A . 43 PRO HG2 1 1 14 8858 1 1 43 PRO HG3 H 31.488 10.897 -1.525 1.00 . A A . 43 PRO HG3 1 1 14 8859 1 1 43 PRO N N 28.953 9.096 -0.669 1.00 . A A . 43 PRO N 1 1 14 8860 1 1 43 PRO O O 29.651 8.548 2.783 1.00 . A A . 43 PRO O 1 1 14 8861 1 1 44 SER C C 26.912 10.208 3.453 1.00 . A A . 44 SER C 1 1 14 8862 1 1 44 SER CA C 28.208 10.900 3.043 1.00 . A A . 44 SER CA 1 1 14 8863 1 1 44 SER CB C 27.972 12.405 2.896 1.00 . A A . 44 SER CB 1 1 14 8864 1 1 44 SER H H 28.559 10.823 0.956 1.00 . A A . 44 SER H 1 1 14 8865 1 1 44 SER HA H 28.950 10.734 3.810 1.00 . A A . 44 SER HA 1 1 14 8866 1 1 44 SER HB2 H 27.909 12.854 3.875 1.00 . A A . 44 SER HB2 1 1 14 8867 1 1 44 SER HB3 H 28.795 12.844 2.350 1.00 . A A . 44 SER HB3 1 1 14 8868 1 1 44 SER HG H 26.076 12.890 2.821 1.00 . A A . 44 SER HG 1 1 14 8869 1 1 44 SER N N 28.721 10.344 1.796 1.00 . A A . 44 SER N 1 1 14 8870 1 1 44 SER O O 25.931 10.863 3.806 1.00 . A A . 44 SER O 1 1 14 8871 1 1 44 SER OG O 26.768 12.666 2.196 1.00 . A A . 44 SER OG 1 1 14 8872 1 1 45 SER C C 26.135 6.871 4.583 1.00 . A A . 45 SER C 1 1 14 8873 1 1 45 SER CA C 25.740 8.098 3.767 1.00 . A A . 45 SER CA 1 1 14 8874 1 1 45 SER CB C 24.981 7.667 2.511 1.00 . A A . 45 SER CB 1 1 14 8875 1 1 45 SER H H 27.730 8.415 3.115 1.00 . A A . 45 SER H 1 1 14 8876 1 1 45 SER HA H 25.098 8.724 4.368 1.00 . A A . 45 SER HA 1 1 14 8877 1 1 45 SER HB2 H 23.977 7.378 2.782 1.00 . A A . 45 SER HB2 1 1 14 8878 1 1 45 SER HB3 H 24.944 8.492 1.815 1.00 . A A . 45 SER HB3 1 1 14 8879 1 1 45 SER HG H 25.682 6.732 0.939 1.00 . A A . 45 SER HG 1 1 14 8880 1 1 45 SER N N 26.916 8.880 3.405 1.00 . A A . 45 SER N 1 1 14 8881 1 1 45 SER O O 26.964 6.068 4.157 1.00 . A A . 45 SER O 1 1 14 8882 1 1 45 SER OG O 25.618 6.568 1.882 1.00 . A A . 45 SER OG 1 1 14 8883 1 1 46 GLY C C 24.588 4.856 7.054 1.00 . A A . 46 GLY C 1 1 14 8884 1 1 46 GLY CA C 25.835 5.602 6.620 1.00 . A A . 46 GLY CA 1 1 14 8885 1 1 46 GLY H H 24.881 7.404 6.050 1.00 . A A . 46 GLY H 1 1 14 8886 1 1 46 GLY HA2 H 26.481 4.921 6.086 1.00 . A A . 46 GLY HA2 1 1 14 8887 1 1 46 GLY HA3 H 26.351 5.959 7.499 1.00 . A A . 46 GLY HA3 1 1 14 8888 1 1 46 GLY N N 25.534 6.733 5.761 1.00 . A A . 46 GLY N 1 1 14 8889 1 1 46 GLY O O 23.920 4.263 6.209 1.00 . A A . 46 GLY O 1 1 14 8890 2 2 1 ZN ZN ZN 6.465 -0.881 3.357 1.00 . B A . 181 ZN ZN 1 1 15 8891 1 1 1 GLY C C -11.341 -31.516 7.293 1.00 . A A . 1 GLY C 1 1 15 8892 1 1 1 GLY CA C -11.679 -32.941 6.902 1.00 . A A . 1 GLY CA 1 1 15 8893 1 1 1 GLY H1 H -10.922 -33.620 8.760 1.00 . A A . 1 GLY H1 1 1 15 8894 1 1 1 GLY HA2 H -11.059 -33.232 6.068 1.00 . A A . 1 GLY HA2 1 1 15 8895 1 1 1 GLY HA3 H -12.715 -32.983 6.600 1.00 . A A . 1 GLY HA3 1 1 15 8896 1 1 1 GLY N N -11.471 -33.879 7.990 1.00 . A A . 1 GLY N 1 1 15 8897 1 1 1 GLY O O -11.872 -30.991 8.271 1.00 . A A . 1 GLY O 1 1 15 8898 1 1 2 SER C C -9.998 -29.254 8.304 1.00 . A A . 2 SER C 1 1 15 8899 1 1 2 SER CA C -10.040 -29.518 6.802 1.00 . A A . 2 SER CA 1 1 15 8900 1 1 2 SER CB C -10.993 -28.531 6.125 1.00 . A A . 2 SER CB 1 1 15 8901 1 1 2 SER H H -10.064 -31.362 5.762 1.00 . A A . 2 SER H 1 1 15 8902 1 1 2 SER HA H -9.048 -29.383 6.397 1.00 . A A . 2 SER HA 1 1 15 8903 1 1 2 SER HB2 H -10.706 -27.523 6.384 1.00 . A A . 2 SER HB2 1 1 15 8904 1 1 2 SER HB3 H -10.936 -28.658 5.054 1.00 . A A . 2 SER HB3 1 1 15 8905 1 1 2 SER HG H -12.334 -29.139 7.417 1.00 . A A . 2 SER HG 1 1 15 8906 1 1 2 SER N N -10.453 -30.890 6.528 1.00 . A A . 2 SER N 1 1 15 8907 1 1 2 SER O O -10.452 -28.211 8.775 1.00 . A A . 2 SER O 1 1 15 8908 1 1 2 SER OG O -12.330 -28.747 6.541 1.00 . A A . 2 SER OG 1 1 15 8909 1 1 3 SER C C -8.210 -29.145 10.888 1.00 . A A . 3 SER C 1 1 15 8910 1 1 3 SER CA C -9.352 -30.080 10.501 1.00 . A A . 3 SER CA 1 1 15 8911 1 1 3 SER CB C -9.141 -31.453 11.141 1.00 . A A . 3 SER CB 1 1 15 8912 1 1 3 SER H H -9.106 -31.015 8.618 1.00 . A A . 3 SER H 1 1 15 8913 1 1 3 SER HA H -10.281 -29.663 10.861 1.00 . A A . 3 SER HA 1 1 15 8914 1 1 3 SER HB2 H -8.218 -31.878 10.779 1.00 . A A . 3 SER HB2 1 1 15 8915 1 1 3 SER HB3 H -9.091 -31.343 12.215 1.00 . A A . 3 SER HB3 1 1 15 8916 1 1 3 SER HG H -10.715 -32.520 11.614 1.00 . A A . 3 SER HG 1 1 15 8917 1 1 3 SER N N -9.450 -30.207 9.052 1.00 . A A . 3 SER N 1 1 15 8918 1 1 3 SER O O -7.082 -29.583 11.111 1.00 . A A . 3 SER O 1 1 15 8919 1 1 3 SER OG O -10.205 -32.333 10.822 1.00 . A A . 3 SER OG 1 1 15 8920 1 1 4 GLY C C -7.070 -26.026 10.148 1.00 . A A . 4 GLY C 1 1 15 8921 1 1 4 GLY CA C -7.502 -26.875 11.327 1.00 . A A . 4 GLY CA 1 1 15 8922 1 1 4 GLY H H -9.429 -27.560 10.779 1.00 . A A . 4 GLY H 1 1 15 8923 1 1 4 GLY HA2 H -7.899 -26.229 12.096 1.00 . A A . 4 GLY HA2 1 1 15 8924 1 1 4 GLY HA3 H -6.639 -27.394 11.718 1.00 . A A . 4 GLY HA3 1 1 15 8925 1 1 4 GLY N N -8.512 -27.852 10.967 1.00 . A A . 4 GLY N 1 1 15 8926 1 1 4 GLY O O -5.882 -25.943 9.836 1.00 . A A . 4 GLY O 1 1 15 8927 1 1 5 SER C C -8.024 -23.086 8.650 1.00 . A A . 5 SER C 1 1 15 8928 1 1 5 SER CA C -7.750 -24.553 8.334 1.00 . A A . 5 SER CA 1 1 15 8929 1 1 5 SER CB C -8.591 -24.993 7.134 1.00 . A A . 5 SER CB 1 1 15 8930 1 1 5 SER H H -8.965 -25.501 9.786 1.00 . A A . 5 SER H 1 1 15 8931 1 1 5 SER HA H -6.704 -24.667 8.091 1.00 . A A . 5 SER HA 1 1 15 8932 1 1 5 SER HB2 H -8.636 -26.071 7.106 1.00 . A A . 5 SER HB2 1 1 15 8933 1 1 5 SER HB3 H -9.590 -24.594 7.232 1.00 . A A . 5 SER HB3 1 1 15 8934 1 1 5 SER HG H -7.409 -25.178 5.583 1.00 . A A . 5 SER HG 1 1 15 8935 1 1 5 SER N N -8.037 -25.395 9.489 1.00 . A A . 5 SER N 1 1 15 8936 1 1 5 SER O O -9.040 -22.749 9.259 1.00 . A A . 5 SER O 1 1 15 8937 1 1 5 SER OG O -8.030 -24.527 5.919 1.00 . A A . 5 SER OG 1 1 15 8938 1 1 6 SER C C -6.451 -19.981 7.452 1.00 . A A . 6 SER C 1 1 15 8939 1 1 6 SER CA C -7.250 -20.785 8.473 1.00 . A A . 6 SER CA 1 1 15 8940 1 1 6 SER CB C -6.786 -20.437 9.889 1.00 . A A . 6 SER CB 1 1 15 8941 1 1 6 SER H H -6.322 -22.545 7.752 1.00 . A A . 6 SER H 1 1 15 8942 1 1 6 SER HA H -8.295 -20.532 8.374 1.00 . A A . 6 SER HA 1 1 15 8943 1 1 6 SER HB2 H -5.740 -20.679 9.992 1.00 . A A . 6 SER HB2 1 1 15 8944 1 1 6 SER HB3 H -6.929 -19.380 10.062 1.00 . A A . 6 SER HB3 1 1 15 8945 1 1 6 SER HG H -7.780 -20.573 11.571 1.00 . A A . 6 SER HG 1 1 15 8946 1 1 6 SER N N -7.110 -22.216 8.232 1.00 . A A . 6 SER N 1 1 15 8947 1 1 6 SER O O -5.630 -20.530 6.718 1.00 . A A . 6 SER O 1 1 15 8948 1 1 6 SER OG O -7.521 -21.163 10.859 1.00 . A A . 6 SER OG 1 1 15 8949 1 1 7 GLY C C -5.619 -16.480 7.088 1.00 . A A . 7 GLY C 1 1 15 8950 1 1 7 GLY CA C -5.994 -17.816 6.477 1.00 . A A . 7 GLY CA 1 1 15 8951 1 1 7 GLY H H -7.364 -18.292 8.020 1.00 . A A . 7 GLY H 1 1 15 8952 1 1 7 GLY HA2 H -5.095 -18.317 6.151 1.00 . A A . 7 GLY HA2 1 1 15 8953 1 1 7 GLY HA3 H -6.628 -17.641 5.620 1.00 . A A . 7 GLY HA3 1 1 15 8954 1 1 7 GLY N N -6.698 -18.675 7.411 1.00 . A A . 7 GLY N 1 1 15 8955 1 1 7 GLY O O -6.467 -15.782 7.645 1.00 . A A . 7 GLY O 1 1 15 8956 1 1 8 THR C C -3.048 -14.088 6.500 1.00 . A A . 8 THR C 1 1 15 8957 1 1 8 THR CA C -3.856 -14.863 7.534 1.00 . A A . 8 THR CA 1 1 15 8958 1 1 8 THR CB C -2.983 -15.094 8.782 1.00 . A A . 8 THR CB 1 1 15 8959 1 1 8 THR CG2 C -3.809 -15.672 9.921 1.00 . A A . 8 THR CG2 1 1 15 8960 1 1 8 THR H H -3.715 -16.721 6.530 1.00 . A A . 8 THR H 1 1 15 8961 1 1 8 THR HA H -4.712 -14.272 7.824 1.00 . A A . 8 THR HA 1 1 15 8962 1 1 8 THR HB H -2.575 -14.145 9.099 1.00 . A A . 8 THR HB 1 1 15 8963 1 1 8 THR HG1 H -1.676 -16.497 9.248 1.00 . A A . 8 THR HG1 1 1 15 8964 1 1 8 THR HG21 H -3.201 -15.737 10.810 1.00 . A A . 8 THR HG21 1 1 15 8965 1 1 8 THR HG22 H -4.156 -16.659 9.650 1.00 . A A . 8 THR HG22 1 1 15 8966 1 1 8 THR HG23 H -4.658 -15.032 10.111 1.00 . A A . 8 THR HG23 1 1 15 8967 1 1 8 THR N N -4.343 -16.122 6.985 1.00 . A A . 8 THR N 1 1 15 8968 1 1 8 THR O O -2.252 -14.665 5.760 1.00 . A A . 8 THR O 1 1 15 8969 1 1 8 THR OG1 O -1.906 -15.984 8.468 1.00 . A A . 8 THR OG1 1 1 15 8970 1 1 9 GLY C C -3.031 -12.128 4.084 1.00 . A A . 9 GLY C 1 1 15 8971 1 1 9 GLY CA C -2.540 -11.943 5.506 1.00 . A A . 9 GLY CA 1 1 15 8972 1 1 9 GLY H H -3.904 -12.370 7.068 1.00 . A A . 9 GLY H 1 1 15 8973 1 1 9 GLY HA2 H -2.665 -10.908 5.787 1.00 . A A . 9 GLY HA2 1 1 15 8974 1 1 9 GLY HA3 H -1.490 -12.193 5.547 1.00 . A A . 9 GLY HA3 1 1 15 8975 1 1 9 GLY N N -3.257 -12.776 6.453 1.00 . A A . 9 GLY N 1 1 15 8976 1 1 9 GLY O O -2.233 -12.187 3.148 1.00 . A A . 9 GLY O 1 1 15 8977 1 1 10 GLU C C -5.810 -11.208 2.226 1.00 . A A . 10 GLU C 1 1 15 8978 1 1 10 GLU CA C -4.941 -12.405 2.602 1.00 . A A . 10 GLU CA 1 1 15 8979 1 1 10 GLU CB C -5.777 -13.687 2.568 1.00 . A A . 10 GLU CB 1 1 15 8980 1 1 10 GLU CD C -5.062 -14.680 0.358 1.00 . A A . 10 GLU CD 1 1 15 8981 1 1 10 GLU CG C -6.204 -14.098 1.169 1.00 . A A . 10 GLU CG 1 1 15 8982 1 1 10 GLU H H -4.931 -12.169 4.705 1.00 . A A . 10 GLU H 1 1 15 8983 1 1 10 GLU HA H -4.138 -12.491 1.885 1.00 . A A . 10 GLU HA 1 1 15 8984 1 1 10 GLU HB2 H -5.199 -14.491 2.997 1.00 . A A . 10 GLU HB2 1 1 15 8985 1 1 10 GLU HB3 H -6.666 -13.537 3.163 1.00 . A A . 10 GLU HB3 1 1 15 8986 1 1 10 GLU HG2 H -6.983 -14.841 1.248 1.00 . A A . 10 GLU HG2 1 1 15 8987 1 1 10 GLU HG3 H -6.586 -13.230 0.653 1.00 . A A . 10 GLU HG3 1 1 15 8988 1 1 10 GLU N N -4.347 -12.223 3.921 1.00 . A A . 10 GLU N 1 1 15 8989 1 1 10 GLU O O -7.030 -11.236 2.388 1.00 . A A . 10 GLU O 1 1 15 8990 1 1 10 GLU OE1 O -3.904 -14.272 0.586 1.00 . A A . 10 GLU OE1 1 1 15 8991 1 1 10 GLU OE2 O -5.327 -15.543 -0.504 1.00 . A A . 10 GLU OE2 1 1 15 8992 1 1 11 LYS C C -5.230 -8.312 0.101 1.00 . A A . 11 LYS C 1 1 15 8993 1 1 11 LYS CA C -5.883 -8.949 1.323 1.00 . A A . 11 LYS CA 1 1 15 8994 1 1 11 LYS CB C -5.916 -7.945 2.478 1.00 . A A . 11 LYS CB 1 1 15 8995 1 1 11 LYS CD C -4.736 -6.056 3.640 1.00 . A A . 11 LYS CD 1 1 15 8996 1 1 11 LYS CE C -5.109 -6.472 5.054 1.00 . A A . 11 LYS CE 1 1 15 8997 1 1 11 LYS CG C -4.583 -7.261 2.727 1.00 . A A . 11 LYS CG 1 1 15 8998 1 1 11 LYS H H -4.197 -10.194 1.619 1.00 . A A . 11 LYS H 1 1 15 8999 1 1 11 LYS HA H -6.895 -9.228 1.072 1.00 . A A . 11 LYS HA 1 1 15 9000 1 1 11 LYS HB2 H -6.651 -7.185 2.258 1.00 . A A . 11 LYS HB2 1 1 15 9001 1 1 11 LYS HB3 H -6.205 -8.463 3.381 1.00 . A A . 11 LYS HB3 1 1 15 9002 1 1 11 LYS HD2 H -3.800 -5.517 3.671 1.00 . A A . 11 LYS HD2 1 1 15 9003 1 1 11 LYS HD3 H -5.511 -5.413 3.246 1.00 . A A . 11 LYS HD3 1 1 15 9004 1 1 11 LYS HE2 H -4.651 -7.425 5.269 1.00 . A A . 11 LYS HE2 1 1 15 9005 1 1 11 LYS HE3 H -4.736 -5.729 5.744 1.00 . A A . 11 LYS HE3 1 1 15 9006 1 1 11 LYS HG2 H -3.908 -7.966 3.190 1.00 . A A . 11 LYS HG2 1 1 15 9007 1 1 11 LYS HG3 H -4.173 -6.936 1.782 1.00 . A A . 11 LYS HG3 1 1 15 9008 1 1 11 LYS HZ1 H -6.900 -7.542 4.937 1.00 . A A . 11 LYS HZ1 1 1 15 9009 1 1 11 LYS HZ2 H -7.071 -5.885 4.641 1.00 . A A . 11 LYS HZ2 1 1 15 9010 1 1 11 LYS HZ3 H -6.842 -6.442 6.221 1.00 . A A . 11 LYS HZ3 1 1 15 9011 1 1 11 LYS N N -5.172 -10.157 1.724 1.00 . A A . 11 LYS N 1 1 15 9012 1 1 11 LYS NZ N -6.584 -6.594 5.225 1.00 . A A . 11 LYS NZ 1 1 15 9013 1 1 11 LYS O O -4.032 -8.459 -0.140 1.00 . A A . 11 LYS O 1 1 15 9014 1 1 12 PRO C C -4.641 -5.733 -1.583 1.00 . A A . 12 PRO C 1 1 15 9015 1 1 12 PRO CA C -5.556 -6.911 -1.900 1.00 . A A . 12 PRO CA 1 1 15 9016 1 1 12 PRO CB C -6.844 -6.424 -2.568 1.00 . A A . 12 PRO CB 1 1 15 9017 1 1 12 PRO CD C -7.473 -7.369 -0.464 1.00 . A A . 12 PRO CD 1 1 15 9018 1 1 12 PRO CG C -7.822 -6.290 -1.452 1.00 . A A . 12 PRO CG 1 1 15 9019 1 1 12 PRO HA H -5.043 -7.596 -2.560 1.00 . A A . 12 PRO HA 1 1 15 9020 1 1 12 PRO HB2 H -6.664 -5.475 -3.053 1.00 . A A . 12 PRO HB2 1 1 15 9021 1 1 12 PRO HB3 H -7.173 -7.150 -3.296 1.00 . A A . 12 PRO HB3 1 1 15 9022 1 1 12 PRO HD2 H -7.658 -7.030 0.545 1.00 . A A . 12 PRO HD2 1 1 15 9023 1 1 12 PRO HD3 H -8.036 -8.267 -0.672 1.00 . A A . 12 PRO HD3 1 1 15 9024 1 1 12 PRO HG2 H -7.725 -5.317 -0.995 1.00 . A A . 12 PRO HG2 1 1 15 9025 1 1 12 PRO HG3 H -8.825 -6.433 -1.825 1.00 . A A . 12 PRO HG3 1 1 15 9026 1 1 12 PRO N N -6.034 -7.586 -0.690 1.00 . A A . 12 PRO N 1 1 15 9027 1 1 12 PRO O O -4.074 -5.115 -2.484 1.00 . A A . 12 PRO O 1 1 15 9028 1 1 13 TYR C C -2.346 -4.835 0.724 1.00 . A A . 13 TYR C 1 1 15 9029 1 1 13 TYR CA C -3.658 -4.321 0.138 1.00 . A A . 13 TYR CA 1 1 15 9030 1 1 13 TYR CB C -4.393 -3.468 1.173 1.00 . A A . 13 TYR CB 1 1 15 9031 1 1 13 TYR CD1 C -6.861 -3.997 1.135 1.00 . A A . 13 TYR CD1 1 1 15 9032 1 1 13 TYR CD2 C -6.125 -1.990 0.081 1.00 . A A . 13 TYR CD2 1 1 15 9033 1 1 13 TYR CE1 C -8.166 -3.707 0.786 1.00 . A A . 13 TYR CE1 1 1 15 9034 1 1 13 TYR CE2 C -7.427 -1.691 -0.271 1.00 . A A . 13 TYR CE2 1 1 15 9035 1 1 13 TYR CG C -5.819 -3.146 0.789 1.00 . A A . 13 TYR CG 1 1 15 9036 1 1 13 TYR CZ C -8.444 -2.553 0.083 1.00 . A A . 13 TYR CZ 1 1 15 9037 1 1 13 TYR H H -4.980 -5.957 0.374 1.00 . A A . 13 TYR H 1 1 15 9038 1 1 13 TYR HA H -3.438 -3.711 -0.726 1.00 . A A . 13 TYR HA 1 1 15 9039 1 1 13 TYR HB2 H -4.414 -3.995 2.114 1.00 . A A . 13 TYR HB2 1 1 15 9040 1 1 13 TYR HB3 H -3.864 -2.535 1.301 1.00 . A A . 13 TYR HB3 1 1 15 9041 1 1 13 TYR HD1 H -6.641 -4.901 1.685 1.00 . A A . 13 TYR HD1 1 1 15 9042 1 1 13 TYR HD2 H -5.325 -1.318 -0.196 1.00 . A A . 13 TYR HD2 1 1 15 9043 1 1 13 TYR HE1 H -8.963 -4.381 1.063 1.00 . A A . 13 TYR HE1 1 1 15 9044 1 1 13 TYR HE2 H -7.644 -0.788 -0.821 1.00 . A A . 13 TYR HE2 1 1 15 9045 1 1 13 TYR HH H -9.978 -2.749 -1.058 1.00 . A A . 13 TYR HH 1 1 15 9046 1 1 13 TYR N N -4.502 -5.427 -0.298 1.00 . A A . 13 TYR N 1 1 15 9047 1 1 13 TYR O O -2.333 -5.472 1.777 1.00 . A A . 13 TYR O 1 1 15 9048 1 1 13 TYR OH O -9.742 -2.259 -0.267 1.00 . A A . 13 TYR OH 1 1 15 9049 1 1 14 GLU C C 1.147 -3.993 0.057 1.00 . A A . 14 GLU C 1 1 15 9050 1 1 14 GLU CA C 0.071 -4.986 0.486 1.00 . A A . 14 GLU CA 1 1 15 9051 1 1 14 GLU CB C 0.393 -6.376 -0.068 1.00 . A A . 14 GLU CB 1 1 15 9052 1 1 14 GLU CD C 0.206 -8.877 0.228 1.00 . A A . 14 GLU CD 1 1 15 9053 1 1 14 GLU CG C -0.129 -7.511 0.795 1.00 . A A . 14 GLU CG 1 1 15 9054 1 1 14 GLU H H -1.322 -4.041 -0.799 1.00 . A A . 14 GLU H 1 1 15 9055 1 1 14 GLU HA H 0.052 -5.035 1.564 1.00 . A A . 14 GLU HA 1 1 15 9056 1 1 14 GLU HB2 H -0.044 -6.468 -1.052 1.00 . A A . 14 GLU HB2 1 1 15 9057 1 1 14 GLU HB3 H 1.465 -6.477 -0.150 1.00 . A A . 14 GLU HB3 1 1 15 9058 1 1 14 GLU HG2 H 0.309 -7.430 1.778 1.00 . A A . 14 GLU HG2 1 1 15 9059 1 1 14 GLU HG3 H -1.203 -7.423 0.873 1.00 . A A . 14 GLU HG3 1 1 15 9060 1 1 14 GLU N N -1.246 -4.553 0.034 1.00 . A A . 14 GLU N 1 1 15 9061 1 1 14 GLU O O 0.940 -3.189 -0.852 1.00 . A A . 14 GLU O 1 1 15 9062 1 1 14 GLU OE1 O 1.309 -9.386 0.516 1.00 . A A . 14 GLU OE1 1 1 15 9063 1 1 14 GLU OE2 O -0.636 -9.437 -0.505 1.00 . A A . 14 GLU OE2 1 1 15 9064 1 1 15 CYS C C 4.425 -3.852 -0.497 1.00 . A A . 15 CYS C 1 1 15 9065 1 1 15 CYS CA C 3.408 -3.162 0.408 1.00 . A A . 15 CYS CA 1 1 15 9066 1 1 15 CYS CB C 4.089 -2.695 1.696 1.00 . A A . 15 CYS CB 1 1 15 9067 1 1 15 CYS H H 2.404 -4.718 1.434 1.00 . A A . 15 CYS H 1 1 15 9068 1 1 15 CYS HA H 3.009 -2.303 -0.110 1.00 . A A . 15 CYS HA 1 1 15 9069 1 1 15 CYS HB2 H 3.332 -2.414 2.413 1.00 . A A . 15 CYS HB2 1 1 15 9070 1 1 15 CYS HB3 H 4.676 -3.507 2.099 1.00 . A A . 15 CYS HB3 1 1 15 9071 1 1 15 CYS N N 2.298 -4.055 0.718 1.00 . A A . 15 CYS N 1 1 15 9072 1 1 15 CYS O O 4.650 -5.058 -0.389 1.00 . A A . 15 CYS O 1 1 15 9073 1 1 15 CYS SG S 5.197 -1.266 1.474 1.00 . A A . 15 CYS SG 1 1 15 9074 1 1 16 ASP C C 7.427 -3.546 -1.704 1.00 . A A . 16 ASP C 1 1 15 9075 1 1 16 ASP CA C 6.029 -3.615 -2.311 1.00 . A A . 16 ASP CA 1 1 15 9076 1 1 16 ASP CB C 5.995 -2.846 -3.633 1.00 . A A . 16 ASP CB 1 1 15 9077 1 1 16 ASP CG C 6.570 -3.649 -4.784 1.00 . A A . 16 ASP CG 1 1 15 9078 1 1 16 ASP H H 4.813 -2.125 -1.426 1.00 . A A . 16 ASP H 1 1 15 9079 1 1 16 ASP HA H 5.783 -4.649 -2.500 1.00 . A A . 16 ASP HA 1 1 15 9080 1 1 16 ASP HB2 H 4.971 -2.595 -3.870 1.00 . A A . 16 ASP HB2 1 1 15 9081 1 1 16 ASP HB3 H 6.570 -1.938 -3.529 1.00 . A A . 16 ASP HB3 1 1 15 9082 1 1 16 ASP N N 5.035 -3.079 -1.388 1.00 . A A . 16 ASP N 1 1 15 9083 1 1 16 ASP O O 8.428 -3.586 -2.420 1.00 . A A . 16 ASP O 1 1 15 9084 1 1 16 ASP OD1 O 5.895 -4.594 -5.245 1.00 . A A . 16 ASP OD1 1 1 15 9085 1 1 16 ASP OD2 O 7.694 -3.331 -5.225 1.00 . A A . 16 ASP OD2 1 1 15 9086 1 1 17 VAL C C 8.783 -4.305 1.525 1.00 . A A . 17 VAL C 1 1 15 9087 1 1 17 VAL CA C 8.763 -3.367 0.323 1.00 . A A . 17 VAL CA 1 1 15 9088 1 1 17 VAL CB C 9.058 -1.932 0.800 1.00 . A A . 17 VAL CB 1 1 15 9089 1 1 17 VAL CG1 C 10.372 -1.883 1.563 1.00 . A A . 17 VAL CG1 1 1 15 9090 1 1 17 VAL CG2 C 9.081 -0.973 -0.381 1.00 . A A . 17 VAL CG2 1 1 15 9091 1 1 17 VAL H H 6.655 -3.414 0.135 1.00 . A A . 17 VAL H 1 1 15 9092 1 1 17 VAL HA H 9.541 -3.662 -0.365 1.00 . A A . 17 VAL HA 1 1 15 9093 1 1 17 VAL HB H 8.267 -1.627 1.469 1.00 . A A . 17 VAL HB 1 1 15 9094 1 1 17 VAL HG11 H 11.195 -1.973 0.869 1.00 . A A . 17 VAL HG11 1 1 15 9095 1 1 17 VAL HG12 H 10.447 -0.944 2.092 1.00 . A A . 17 VAL HG12 1 1 15 9096 1 1 17 VAL HG13 H 10.408 -2.699 2.270 1.00 . A A . 17 VAL HG13 1 1 15 9097 1 1 17 VAL HG21 H 9.884 -1.245 -1.050 1.00 . A A . 17 VAL HG21 1 1 15 9098 1 1 17 VAL HG22 H 8.139 -1.028 -0.906 1.00 . A A . 17 VAL HG22 1 1 15 9099 1 1 17 VAL HG23 H 9.236 0.035 -0.023 1.00 . A A . 17 VAL HG23 1 1 15 9100 1 1 17 VAL N N 7.488 -3.441 -0.381 1.00 . A A . 17 VAL N 1 1 15 9101 1 1 17 VAL O O 9.613 -5.211 1.606 1.00 . A A . 17 VAL O 1 1 15 9102 1 1 18 CYS C C 6.604 -5.882 3.560 1.00 . A A . 18 CYS C 1 1 15 9103 1 1 18 CYS CA C 7.774 -4.906 3.656 1.00 . A A . 18 CYS CA 1 1 15 9104 1 1 18 CYS CB C 7.615 -4.024 4.896 1.00 . A A . 18 CYS CB 1 1 15 9105 1 1 18 CYS H H 7.228 -3.344 2.337 1.00 . A A . 18 CYS H 1 1 15 9106 1 1 18 CYS HA H 8.690 -5.470 3.741 1.00 . A A . 18 CYS HA 1 1 15 9107 1 1 18 CYS HB2 H 7.459 -4.655 5.760 1.00 . A A . 18 CYS HB2 1 1 15 9108 1 1 18 CYS HB3 H 8.517 -3.447 5.036 1.00 . A A . 18 CYS HB3 1 1 15 9109 1 1 18 CYS N N 7.863 -4.082 2.457 1.00 . A A . 18 CYS N 1 1 15 9110 1 1 18 CYS O O 6.306 -6.606 4.510 1.00 . A A . 18 CYS O 1 1 15 9111 1 1 18 CYS SG S 6.218 -2.858 4.806 1.00 . A A . 18 CYS SG 1 1 15 9112 1 1 19 ARG C C 3.803 -6.670 3.327 1.00 . A A . 19 ARG C 1 1 15 9113 1 1 19 ARG CA C 4.809 -6.781 2.184 1.00 . A A . 19 ARG CA 1 1 15 9114 1 1 19 ARG CB C 5.282 -8.229 2.046 1.00 . A A . 19 ARG CB 1 1 15 9115 1 1 19 ARG CD C 5.776 -8.029 -0.410 1.00 . A A . 19 ARG CD 1 1 15 9116 1 1 19 ARG CG C 6.319 -8.429 0.953 1.00 . A A . 19 ARG CG 1 1 15 9117 1 1 19 ARG CZ C 6.000 -10.034 -1.814 1.00 . A A . 19 ARG CZ 1 1 15 9118 1 1 19 ARG H H 6.231 -5.295 1.685 1.00 . A A . 19 ARG H 1 1 15 9119 1 1 19 ARG HA H 4.327 -6.480 1.266 1.00 . A A . 19 ARG HA 1 1 15 9120 1 1 19 ARG HB2 H 5.715 -8.545 2.984 1.00 . A A . 19 ARG HB2 1 1 15 9121 1 1 19 ARG HB3 H 4.431 -8.853 1.823 1.00 . A A . 19 ARG HB3 1 1 15 9122 1 1 19 ARG HD2 H 4.708 -8.190 -0.419 1.00 . A A . 19 ARG HD2 1 1 15 9123 1 1 19 ARG HD3 H 5.983 -6.981 -0.572 1.00 . A A . 19 ARG HD3 1 1 15 9124 1 1 19 ARG HE H 7.108 -8.386 -1.997 1.00 . A A . 19 ARG HE 1 1 15 9125 1 1 19 ARG HG2 H 7.185 -7.822 1.175 1.00 . A A . 19 ARG HG2 1 1 15 9126 1 1 19 ARG HG3 H 6.604 -9.470 0.926 1.00 . A A . 19 ARG HG3 1 1 15 9127 1 1 19 ARG HH11 H 4.566 -10.145 -0.396 1.00 . A A . 19 ARG HH11 1 1 15 9128 1 1 19 ARG HH12 H 4.734 -11.552 -1.392 1.00 . A A . 19 ARG HH12 1 1 15 9129 1 1 19 ARG HH21 H 7.339 -10.233 -3.315 1.00 . A A . 19 ARG HH21 1 1 15 9130 1 1 19 ARG HH22 H 6.312 -11.601 -3.052 1.00 . A A . 19 ARG HH22 1 1 15 9131 1 1 19 ARG N N 5.946 -5.895 2.405 1.00 . A A . 19 ARG N 1 1 15 9132 1 1 19 ARG NE N 6.381 -8.804 -1.490 1.00 . A A . 19 ARG NE 1 1 15 9133 1 1 19 ARG NH1 N 5.020 -10.626 -1.145 1.00 . A A . 19 ARG NH1 1 1 15 9134 1 1 19 ARG NH2 N 6.600 -10.676 -2.809 1.00 . A A . 19 ARG NH2 1 1 15 9135 1 1 19 ARG O O 3.196 -7.661 3.732 1.00 . A A . 19 ARG O 1 1 15 9136 1 1 20 LYS C C 1.279 -5.047 4.415 1.00 . A A . 20 LYS C 1 1 15 9137 1 1 20 LYS CA C 2.702 -5.215 4.938 1.00 . A A . 20 LYS CA 1 1 15 9138 1 1 20 LYS CB C 3.118 -3.970 5.724 1.00 . A A . 20 LYS CB 1 1 15 9139 1 1 20 LYS CD C 3.032 -2.762 7.924 1.00 . A A . 20 LYS CD 1 1 15 9140 1 1 20 LYS CE C 4.295 -3.312 8.568 1.00 . A A . 20 LYS CE 1 1 15 9141 1 1 20 LYS CG C 2.366 -3.796 7.032 1.00 . A A . 20 LYS CG 1 1 15 9142 1 1 20 LYS H H 4.146 -4.706 3.477 1.00 . A A . 20 LYS H 1 1 15 9143 1 1 20 LYS HA H 2.732 -6.071 5.595 1.00 . A A . 20 LYS HA 1 1 15 9144 1 1 20 LYS HB2 H 4.174 -4.035 5.945 1.00 . A A . 20 LYS HB2 1 1 15 9145 1 1 20 LYS HB3 H 2.941 -3.097 5.112 1.00 . A A . 20 LYS HB3 1 1 15 9146 1 1 20 LYS HD2 H 3.291 -1.899 7.329 1.00 . A A . 20 LYS HD2 1 1 15 9147 1 1 20 LYS HD3 H 2.339 -2.470 8.701 1.00 . A A . 20 LYS HD3 1 1 15 9148 1 1 20 LYS HE2 H 4.852 -3.861 7.825 1.00 . A A . 20 LYS HE2 1 1 15 9149 1 1 20 LYS HE3 H 4.891 -2.485 8.926 1.00 . A A . 20 LYS HE3 1 1 15 9150 1 1 20 LYS HG2 H 1.358 -3.474 6.817 1.00 . A A . 20 LYS HG2 1 1 15 9151 1 1 20 LYS HG3 H 2.341 -4.743 7.551 1.00 . A A . 20 LYS HG3 1 1 15 9152 1 1 20 LYS HZ1 H 4.520 -5.104 9.618 1.00 . A A . 20 LYS HZ1 1 1 15 9153 1 1 20 LYS HZ2 H 2.970 -4.436 9.728 1.00 . A A . 20 LYS HZ2 1 1 15 9154 1 1 20 LYS HZ3 H 4.246 -3.760 10.608 1.00 . A A . 20 LYS HZ3 1 1 15 9155 1 1 20 LYS N N 3.633 -5.457 3.843 1.00 . A A . 20 LYS N 1 1 15 9156 1 1 20 LYS NZ N 3.987 -4.216 9.710 1.00 . A A . 20 LYS NZ 1 1 15 9157 1 1 20 LYS O O 1.035 -4.272 3.490 1.00 . A A . 20 LYS O 1 1 15 9158 1 1 21 ALA C C -1.813 -4.669 5.436 1.00 . A A . 21 ALA C 1 1 15 9159 1 1 21 ALA CA C -1.056 -5.704 4.610 1.00 . A A . 21 ALA CA 1 1 15 9160 1 1 21 ALA CB C -1.714 -7.069 4.739 1.00 . A A . 21 ALA CB 1 1 15 9161 1 1 21 ALA H H 0.599 -6.375 5.745 1.00 . A A . 21 ALA H 1 1 15 9162 1 1 21 ALA HA H -1.089 -5.412 3.570 1.00 . A A . 21 ALA HA 1 1 15 9163 1 1 21 ALA HB1 H -1.435 -7.515 5.682 1.00 . A A . 21 ALA HB1 1 1 15 9164 1 1 21 ALA HB2 H -2.788 -6.956 4.697 1.00 . A A . 21 ALA HB2 1 1 15 9165 1 1 21 ALA HB3 H -1.386 -7.704 3.929 1.00 . A A . 21 ALA HB3 1 1 15 9166 1 1 21 ALA N N 0.343 -5.776 5.013 1.00 . A A . 21 ALA N 1 1 15 9167 1 1 21 ALA O O -1.655 -4.597 6.655 1.00 . A A . 21 ALA O 1 1 15 9168 1 1 22 PHE C C -4.899 -2.971 5.099 1.00 . A A . 22 PHE C 1 1 15 9169 1 1 22 PHE CA C -3.417 -2.839 5.438 1.00 . A A . 22 PHE CA 1 1 15 9170 1 1 22 PHE CB C -2.914 -1.449 5.042 1.00 . A A . 22 PHE CB 1 1 15 9171 1 1 22 PHE CD1 C -0.557 -1.823 4.265 1.00 . A A . 22 PHE CD1 1 1 15 9172 1 1 22 PHE CD2 C -0.905 -0.587 6.275 1.00 . A A . 22 PHE CD2 1 1 15 9173 1 1 22 PHE CE1 C 0.809 -1.671 4.404 1.00 . A A . 22 PHE CE1 1 1 15 9174 1 1 22 PHE CE2 C 0.460 -0.432 6.419 1.00 . A A . 22 PHE CE2 1 1 15 9175 1 1 22 PHE CG C -1.429 -1.283 5.197 1.00 . A A . 22 PHE CG 1 1 15 9176 1 1 22 PHE CZ C 1.319 -0.976 5.483 1.00 . A A . 22 PHE CZ 1 1 15 9177 1 1 22 PHE H H -2.720 -3.977 3.794 1.00 . A A . 22 PHE H 1 1 15 9178 1 1 22 PHE HA H -3.291 -2.969 6.501 1.00 . A A . 22 PHE HA 1 1 15 9179 1 1 22 PHE HB2 H -3.162 -1.265 4.007 1.00 . A A . 22 PHE HB2 1 1 15 9180 1 1 22 PHE HB3 H -3.398 -0.709 5.661 1.00 . A A . 22 PHE HB3 1 1 15 9181 1 1 22 PHE HD1 H -0.955 -2.367 3.420 1.00 . A A . 22 PHE HD1 1 1 15 9182 1 1 22 PHE HD2 H -1.575 -0.163 7.008 1.00 . A A . 22 PHE HD2 1 1 15 9183 1 1 22 PHE HE1 H 1.478 -2.098 3.671 1.00 . A A . 22 PHE HE1 1 1 15 9184 1 1 22 PHE HE2 H 0.856 0.111 7.264 1.00 . A A . 22 PHE HE2 1 1 15 9185 1 1 22 PHE HZ H 2.386 -0.856 5.594 1.00 . A A . 22 PHE HZ 1 1 15 9186 1 1 22 PHE N N -2.637 -3.871 4.765 1.00 . A A . 22 PHE N 1 1 15 9187 1 1 22 PHE O O -5.270 -3.127 3.935 1.00 . A A . 22 PHE O 1 1 15 9188 1 1 23 SER C C -7.713 -1.885 5.070 1.00 . A A . 23 SER C 1 1 15 9189 1 1 23 SER CA C -7.184 -3.023 5.937 1.00 . A A . 23 SER CA 1 1 15 9190 1 1 23 SER CB C -7.897 -3.023 7.290 1.00 . A A . 23 SER CB 1 1 15 9191 1 1 23 SER H H -5.386 -2.781 7.029 1.00 . A A . 23 SER H 1 1 15 9192 1 1 23 SER HA H -7.379 -3.961 5.437 1.00 . A A . 23 SER HA 1 1 15 9193 1 1 23 SER HB2 H -7.755 -2.066 7.769 1.00 . A A . 23 SER HB2 1 1 15 9194 1 1 23 SER HB3 H -8.953 -3.196 7.138 1.00 . A A . 23 SER HB3 1 1 15 9195 1 1 23 SER HG H -6.889 -4.671 7.614 1.00 . A A . 23 SER HG 1 1 15 9196 1 1 23 SER N N -5.743 -2.907 6.124 1.00 . A A . 23 SER N 1 1 15 9197 1 1 23 SER O O -8.478 -2.108 4.131 1.00 . A A . 23 SER O 1 1 15 9198 1 1 23 SER OG O -7.386 -4.038 8.137 1.00 . A A . 23 SER OG 1 1 15 9199 1 1 24 HIS C C -6.647 0.963 3.669 1.00 . A A . 24 HIS C 1 1 15 9200 1 1 24 HIS CA C -7.731 0.512 4.643 1.00 . A A . 24 HIS CA 1 1 15 9201 1 1 24 HIS CB C -8.080 1.652 5.599 1.00 . A A . 24 HIS CB 1 1 15 9202 1 1 24 HIS CD2 C -8.868 3.200 3.673 1.00 . A A . 24 HIS CD2 1 1 15 9203 1 1 24 HIS CE1 C -10.266 4.446 4.813 1.00 . A A . 24 HIS CE1 1 1 15 9204 1 1 24 HIS CG C -8.853 2.761 4.953 1.00 . A A . 24 HIS CG 1 1 15 9205 1 1 24 HIS H H -6.691 -0.549 6.151 1.00 . A A . 24 HIS H 1 1 15 9206 1 1 24 HIS HA H -8.613 0.242 4.081 1.00 . A A . 24 HIS HA 1 1 15 9207 1 1 24 HIS HB2 H -8.677 1.263 6.411 1.00 . A A . 24 HIS HB2 1 1 15 9208 1 1 24 HIS HB3 H -7.168 2.072 5.998 1.00 . A A . 24 HIS HB3 1 1 15 9209 1 1 24 HIS HD1 H -9.951 3.493 6.596 1.00 . A A . 24 HIS HD1 1 1 15 9210 1 1 24 HIS HD2 H -8.290 2.801 2.850 1.00 . A A . 24 HIS HD2 1 1 15 9211 1 1 24 HIS HE1 H -10.992 5.201 5.072 1.00 . A A . 24 HIS HE1 1 1 15 9212 1 1 24 HIS N N -7.300 -0.663 5.392 1.00 . A A . 24 HIS N 1 1 15 9213 1 1 24 HIS ND1 N -9.739 3.562 5.642 1.00 . A A . 24 HIS ND1 1 1 15 9214 1 1 24 HIS NE2 N -9.754 4.247 3.612 1.00 . A A . 24 HIS NE2 1 1 15 9215 1 1 24 HIS O O -5.522 1.260 4.070 1.00 . A A . 24 HIS O 1 1 15 9216 1 1 25 HIS C C -5.107 2.503 1.881 1.00 . A A . 25 HIS C 1 1 15 9217 1 1 25 HIS CA C -6.050 1.425 1.354 1.00 . A A . 25 HIS CA 1 1 15 9218 1 1 25 HIS CB C -6.799 1.943 0.126 1.00 . A A . 25 HIS CB 1 1 15 9219 1 1 25 HIS CD2 C -5.313 2.962 -1.739 1.00 . A A . 25 HIS CD2 1 1 15 9220 1 1 25 HIS CE1 C -4.981 1.142 -2.916 1.00 . A A . 25 HIS CE1 1 1 15 9221 1 1 25 HIS CG C -5.970 1.953 -1.121 1.00 . A A . 25 HIS CG 1 1 15 9222 1 1 25 HIS H H -7.905 0.761 2.128 1.00 . A A . 25 HIS H 1 1 15 9223 1 1 25 HIS HA H -5.467 0.562 1.072 1.00 . A A . 25 HIS HA 1 1 15 9224 1 1 25 HIS HB2 H -7.659 1.315 -0.053 1.00 . A A . 25 HIS HB2 1 1 15 9225 1 1 25 HIS HB3 H -7.130 2.954 0.314 1.00 . A A . 25 HIS HB3 1 1 15 9226 1 1 25 HIS HD1 H -6.088 -0.071 -1.695 1.00 . A A . 25 HIS HD1 1 1 15 9227 1 1 25 HIS HD2 H -5.272 3.994 -1.417 1.00 . A A . 25 HIS HD2 1 1 15 9228 1 1 25 HIS HE1 H -4.641 0.462 -3.682 1.00 . A A . 25 HIS HE1 1 1 15 9229 1 1 25 HIS N N -6.994 1.010 2.386 1.00 . A A . 25 HIS N 1 1 15 9230 1 1 25 HIS ND1 N -5.743 0.827 -1.884 1.00 . A A . 25 HIS ND1 1 1 15 9231 1 1 25 HIS NE2 N -4.706 2.433 -2.851 1.00 . A A . 25 HIS NE2 1 1 15 9232 1 1 25 HIS O O -3.897 2.295 1.967 1.00 . A A . 25 HIS O 1 1 15 9233 1 1 26 ALA C C -3.706 4.260 3.584 1.00 . A A . 26 ALA C 1 1 15 9234 1 1 26 ALA CA C -4.881 4.764 2.752 1.00 . A A . 26 ALA CA 1 1 15 9235 1 1 26 ALA CB C -5.756 5.693 3.580 1.00 . A A . 26 ALA CB 1 1 15 9236 1 1 26 ALA H H -6.640 3.760 2.141 1.00 . A A . 26 ALA H 1 1 15 9237 1 1 26 ALA HA H -4.498 5.324 1.911 1.00 . A A . 26 ALA HA 1 1 15 9238 1 1 26 ALA HB1 H -6.349 6.310 2.921 1.00 . A A . 26 ALA HB1 1 1 15 9239 1 1 26 ALA HB2 H -6.410 5.105 4.208 1.00 . A A . 26 ALA HB2 1 1 15 9240 1 1 26 ALA HB3 H -5.131 6.321 4.197 1.00 . A A . 26 ALA HB3 1 1 15 9241 1 1 26 ALA N N -5.670 3.655 2.232 1.00 . A A . 26 ALA N 1 1 15 9242 1 1 26 ALA O O -2.547 4.443 3.213 1.00 . A A . 26 ALA O 1 1 15 9243 1 1 27 SER C C -1.811 2.542 4.797 1.00 . A A . 27 SER C 1 1 15 9244 1 1 27 SER CA C -2.984 3.098 5.598 1.00 . A A . 27 SER CA 1 1 15 9245 1 1 27 SER CB C -3.566 2.006 6.498 1.00 . A A . 27 SER CB 1 1 15 9246 1 1 27 SER H H -4.958 3.511 4.951 1.00 . A A . 27 SER H 1 1 15 9247 1 1 27 SER HA H -2.631 3.911 6.214 1.00 . A A . 27 SER HA 1 1 15 9248 1 1 27 SER HB2 H -4.186 1.349 5.907 1.00 . A A . 27 SER HB2 1 1 15 9249 1 1 27 SER HB3 H -2.759 1.440 6.939 1.00 . A A . 27 SER HB3 1 1 15 9250 1 1 27 SER HG H -4.501 1.906 8.216 1.00 . A A . 27 SER HG 1 1 15 9251 1 1 27 SER N N -4.015 3.625 4.710 1.00 . A A . 27 SER N 1 1 15 9252 1 1 27 SER O O -0.649 2.769 5.136 1.00 . A A . 27 SER O 1 1 15 9253 1 1 27 SER OG O -4.352 2.566 7.535 1.00 . A A . 27 SER OG 1 1 15 9254 1 1 28 LEU C C -0.429 2.284 2.015 1.00 . A A . 28 LEU C 1 1 15 9255 1 1 28 LEU CA C -1.095 1.220 2.882 1.00 . A A . 28 LEU CA 1 1 15 9256 1 1 28 LEU CB C -1.703 0.131 1.996 1.00 . A A . 28 LEU CB 1 1 15 9257 1 1 28 LEU CD1 C 0.452 -0.856 1.179 1.00 . A A . 28 LEU CD1 1 1 15 9258 1 1 28 LEU CD2 C -1.664 -1.250 -0.096 1.00 . A A . 28 LEU CD2 1 1 15 9259 1 1 28 LEU CG C -0.887 -0.265 0.765 1.00 . A A . 28 LEU CG 1 1 15 9260 1 1 28 LEU H H -3.066 1.664 3.513 1.00 . A A . 28 LEU H 1 1 15 9261 1 1 28 LEU HA H -0.349 0.776 3.524 1.00 . A A . 28 LEU HA 1 1 15 9262 1 1 28 LEU HB2 H -1.836 -0.752 2.602 1.00 . A A . 28 LEU HB2 1 1 15 9263 1 1 28 LEU HB3 H -2.667 0.482 1.657 1.00 . A A . 28 LEU HB3 1 1 15 9264 1 1 28 LEU HD11 H 0.586 -0.732 2.242 1.00 . A A . 28 LEU HD11 1 1 15 9265 1 1 28 LEU HD12 H 1.247 -0.349 0.653 1.00 . A A . 28 LEU HD12 1 1 15 9266 1 1 28 LEU HD13 H 0.472 -1.908 0.932 1.00 . A A . 28 LEU HD13 1 1 15 9267 1 1 28 LEU HD21 H -1.319 -2.253 0.104 1.00 . A A . 28 LEU HD21 1 1 15 9268 1 1 28 LEU HD22 H -1.509 -1.017 -1.139 1.00 . A A . 28 LEU HD22 1 1 15 9269 1 1 28 LEU HD23 H -2.717 -1.178 0.137 1.00 . A A . 28 LEU HD23 1 1 15 9270 1 1 28 LEU HG H -0.692 0.618 0.171 1.00 . A A . 28 LEU HG 1 1 15 9271 1 1 28 LEU N N -2.123 1.811 3.733 1.00 . A A . 28 LEU N 1 1 15 9272 1 1 28 LEU O O 0.789 2.278 1.832 1.00 . A A . 28 LEU O 1 1 15 9273 1 1 29 THR C C 0.165 5.220 1.431 1.00 . A A . 29 THR C 1 1 15 9274 1 1 29 THR CA C -0.724 4.269 0.638 1.00 . A A . 29 THR CA 1 1 15 9275 1 1 29 THR CB C -1.870 5.072 -0.005 1.00 . A A . 29 THR CB 1 1 15 9276 1 1 29 THR CG2 C -1.381 6.436 -0.468 1.00 . A A . 29 THR CG2 1 1 15 9277 1 1 29 THR H H -2.196 3.149 1.667 1.00 . A A . 29 THR H 1 1 15 9278 1 1 29 THR HA H -0.139 3.819 -0.152 1.00 . A A . 29 THR HA 1 1 15 9279 1 1 29 THR HB H -2.647 5.215 0.732 1.00 . A A . 29 THR HB 1 1 15 9280 1 1 29 THR HG1 H -3.126 3.786 -0.817 1.00 . A A . 29 THR HG1 1 1 15 9281 1 1 29 THR HG21 H -1.707 7.191 0.232 1.00 . A A . 29 THR HG21 1 1 15 9282 1 1 29 THR HG22 H -1.788 6.652 -1.445 1.00 . A A . 29 THR HG22 1 1 15 9283 1 1 29 THR HG23 H -0.303 6.434 -0.519 1.00 . A A . 29 THR HG23 1 1 15 9284 1 1 29 THR N N -1.235 3.198 1.484 1.00 . A A . 29 THR N 1 1 15 9285 1 1 29 THR O O 1.343 5.388 1.118 1.00 . A A . 29 THR O 1 1 15 9286 1 1 29 THR OG1 O -2.409 4.350 -1.118 1.00 . A A . 29 THR OG1 1 1 15 9287 1 1 30 GLN C C 1.598 6.123 3.850 1.00 . A A . 30 GLN C 1 1 15 9288 1 1 30 GLN CA C 0.335 6.773 3.297 1.00 . A A . 30 GLN CA 1 1 15 9289 1 1 30 GLN CB C -0.544 7.269 4.446 1.00 . A A . 30 GLN CB 1 1 15 9290 1 1 30 GLN CD C -0.439 8.041 6.850 1.00 . A A . 30 GLN CD 1 1 15 9291 1 1 30 GLN CG C 0.212 8.086 5.482 1.00 . A A . 30 GLN CG 1 1 15 9292 1 1 30 GLN H H -1.350 5.663 2.658 1.00 . A A . 30 GLN H 1 1 15 9293 1 1 30 GLN HA H 0.618 7.615 2.683 1.00 . A A . 30 GLN HA 1 1 15 9294 1 1 30 GLN HB2 H -1.334 7.883 4.041 1.00 . A A . 30 GLN HB2 1 1 15 9295 1 1 30 GLN HB3 H -0.981 6.415 4.943 1.00 . A A . 30 GLN HB3 1 1 15 9296 1 1 30 GLN HE21 H 1.206 7.246 7.634 1.00 . A A . 30 GLN HE21 1 1 15 9297 1 1 30 GLN HE22 H -0.100 7.509 8.735 1.00 . A A . 30 GLN HE22 1 1 15 9298 1 1 30 GLN HG2 H 1.216 7.697 5.566 1.00 . A A . 30 GLN HG2 1 1 15 9299 1 1 30 GLN HG3 H 0.252 9.113 5.151 1.00 . A A . 30 GLN HG3 1 1 15 9300 1 1 30 GLN N N -0.407 5.839 2.459 1.00 . A A . 30 GLN N 1 1 15 9301 1 1 30 GLN NE2 N 0.296 7.548 7.840 1.00 . A A . 30 GLN NE2 1 1 15 9302 1 1 30 GLN O O 2.657 6.749 3.908 1.00 . A A . 30 GLN O 1 1 15 9303 1 1 30 GLN OE1 O -1.591 8.445 7.015 1.00 . A A . 30 GLN OE1 1 1 15 9304 1 1 31 HIS C C 3.801 4.166 3.851 1.00 . A A . 31 HIS C 1 1 15 9305 1 1 31 HIS CA C 2.613 4.127 4.807 1.00 . A A . 31 HIS CA 1 1 15 9306 1 1 31 HIS CB C 2.218 2.677 5.090 1.00 . A A . 31 HIS CB 1 1 15 9307 1 1 31 HIS CD2 C 3.798 0.952 3.969 1.00 . A A . 31 HIS CD2 1 1 15 9308 1 1 31 HIS CE1 C 5.118 0.569 5.677 1.00 . A A . 31 HIS CE1 1 1 15 9309 1 1 31 HIS CG C 3.363 1.716 4.998 1.00 . A A . 31 HIS CG 1 1 15 9310 1 1 31 HIS H H 0.610 4.418 4.187 1.00 . A A . 31 HIS H 1 1 15 9311 1 1 31 HIS HA H 2.898 4.601 5.734 1.00 . A A . 31 HIS HA 1 1 15 9312 1 1 31 HIS HB2 H 1.809 2.611 6.087 1.00 . A A . 31 HIS HB2 1 1 15 9313 1 1 31 HIS HB3 H 1.468 2.370 4.376 1.00 . A A . 31 HIS HB3 1 1 15 9314 1 1 31 HIS HD1 H 4.156 1.854 6.946 1.00 . A A . 31 HIS HD1 1 1 15 9315 1 1 31 HIS HD2 H 3.367 0.904 2.979 1.00 . A A . 31 HIS HD2 1 1 15 9316 1 1 31 HIS HE1 H 5.912 0.175 6.294 1.00 . A A . 31 HIS HE1 1 1 15 9317 1 1 31 HIS N N 1.480 4.863 4.258 1.00 . A A . 31 HIS N 1 1 15 9318 1 1 31 HIS ND1 N 4.211 1.453 6.054 1.00 . A A . 31 HIS ND1 1 1 15 9319 1 1 31 HIS NE2 N 4.889 0.249 4.416 1.00 . A A . 31 HIS NE2 1 1 15 9320 1 1 31 HIS O O 4.930 4.434 4.261 1.00 . A A . 31 HIS O 1 1 15 9321 1 1 32 GLN C C 5.633 4.967 1.866 1.00 . A A . 32 GLN C 1 1 15 9322 1 1 32 GLN CA C 4.586 3.900 1.563 1.00 . A A . 32 GLN CA 1 1 15 9323 1 1 32 GLN CB C 3.985 4.139 0.177 1.00 . A A . 32 GLN CB 1 1 15 9324 1 1 32 GLN CD C 3.599 1.655 -0.079 1.00 . A A . 32 GLN CD 1 1 15 9325 1 1 32 GLN CG C 3.026 3.046 -0.267 1.00 . A A . 32 GLN CG 1 1 15 9326 1 1 32 GLN H H 2.618 3.691 2.311 1.00 . A A . 32 GLN H 1 1 15 9327 1 1 32 GLN HA H 5.063 2.932 1.576 1.00 . A A . 32 GLN HA 1 1 15 9328 1 1 32 GLN HB2 H 3.449 5.076 0.187 1.00 . A A . 32 GLN HB2 1 1 15 9329 1 1 32 GLN HB3 H 4.786 4.199 -0.545 1.00 . A A . 32 GLN HB3 1 1 15 9330 1 1 32 GLN HE21 H 5.011 2.029 -1.427 1.00 . A A . 32 GLN HE21 1 1 15 9331 1 1 32 GLN HE22 H 5.053 0.457 -0.712 1.00 . A A . 32 GLN HE22 1 1 15 9332 1 1 32 GLN HG2 H 2.117 3.125 0.312 1.00 . A A . 32 GLN HG2 1 1 15 9333 1 1 32 GLN HG3 H 2.798 3.188 -1.313 1.00 . A A . 32 GLN HG3 1 1 15 9334 1 1 32 GLN N N 3.538 3.897 2.576 1.00 . A A . 32 GLN N 1 1 15 9335 1 1 32 GLN NE2 N 4.661 1.348 -0.814 1.00 . A A . 32 GLN NE2 1 1 15 9336 1 1 32 GLN O O 6.819 4.782 1.591 1.00 . A A . 32 GLN O 1 1 15 9337 1 1 32 GLN OE1 O 3.093 0.865 0.718 1.00 . A A . 32 GLN OE1 1 1 15 9338 1 1 33 ARG C C 7.368 6.654 3.412 1.00 . A A . 33 ARG C 1 1 15 9339 1 1 33 ARG CA C 6.086 7.179 2.774 1.00 . A A . 33 ARG CA 1 1 15 9340 1 1 33 ARG CB C 5.394 8.158 3.725 1.00 . A A . 33 ARG CB 1 1 15 9341 1 1 33 ARG CD C 4.051 10.274 3.906 1.00 . A A . 33 ARG CD 1 1 15 9342 1 1 33 ARG CG C 4.402 9.079 3.034 1.00 . A A . 33 ARG CG 1 1 15 9343 1 1 33 ARG CZ C 4.940 12.511 4.410 1.00 . A A . 33 ARG CZ 1 1 15 9344 1 1 33 ARG H H 4.231 6.170 2.630 1.00 . A A . 33 ARG H 1 1 15 9345 1 1 33 ARG HA H 6.338 7.696 1.860 1.00 . A A . 33 ARG HA 1 1 15 9346 1 1 33 ARG HB2 H 4.865 7.595 4.479 1.00 . A A . 33 ARG HB2 1 1 15 9347 1 1 33 ARG HB3 H 6.146 8.768 4.203 1.00 . A A . 33 ARG HB3 1 1 15 9348 1 1 33 ARG HD2 H 3.044 10.589 3.676 1.00 . A A . 33 ARG HD2 1 1 15 9349 1 1 33 ARG HD3 H 4.107 9.976 4.942 1.00 . A A . 33 ARG HD3 1 1 15 9350 1 1 33 ARG HE H 5.616 11.315 2.963 1.00 . A A . 33 ARG HE 1 1 15 9351 1 1 33 ARG HG2 H 4.836 9.435 2.112 1.00 . A A . 33 ARG HG2 1 1 15 9352 1 1 33 ARG HG3 H 3.500 8.524 2.819 1.00 . A A . 33 ARG HG3 1 1 15 9353 1 1 33 ARG HH11 H 3.416 11.915 5.594 1.00 . A A . 33 ARG HH11 1 1 15 9354 1 1 33 ARG HH12 H 4.052 13.489 5.939 1.00 . A A . 33 ARG HH12 1 1 15 9355 1 1 33 ARG HH21 H 6.462 13.386 3.407 1.00 . A A . 33 ARG HH21 1 1 15 9356 1 1 33 ARG HH22 H 5.784 14.325 4.694 1.00 . A A . 33 ARG HH22 1 1 15 9357 1 1 33 ARG N N 5.187 6.082 2.435 1.00 . A A . 33 ARG N 1 1 15 9358 1 1 33 ARG NE N 4.960 11.397 3.686 1.00 . A A . 33 ARG NE 1 1 15 9359 1 1 33 ARG NH1 N 4.064 12.650 5.395 1.00 . A A . 33 ARG NH1 1 1 15 9360 1 1 33 ARG NH2 N 5.799 13.488 4.149 1.00 . A A . 33 ARG NH2 1 1 15 9361 1 1 33 ARG O O 8.470 6.928 2.935 1.00 . A A . 33 ARG O 1 1 15 9362 1 1 34 VAL C C 9.482 4.972 4.227 1.00 . A A . 34 VAL C 1 1 15 9363 1 1 34 VAL CA C 8.363 5.332 5.198 1.00 . A A . 34 VAL CA 1 1 15 9364 1 1 34 VAL CB C 7.967 4.076 5.998 1.00 . A A . 34 VAL CB 1 1 15 9365 1 1 34 VAL CG1 C 6.939 4.423 7.064 1.00 . A A . 34 VAL CG1 1 1 15 9366 1 1 34 VAL CG2 C 7.437 2.997 5.066 1.00 . A A . 34 VAL CG2 1 1 15 9367 1 1 34 VAL H H 6.314 5.713 4.827 1.00 . A A . 34 VAL H 1 1 15 9368 1 1 34 VAL HA H 8.727 6.075 5.893 1.00 . A A . 34 VAL HA 1 1 15 9369 1 1 34 VAL HB H 8.849 3.695 6.491 1.00 . A A . 34 VAL HB 1 1 15 9370 1 1 34 VAL HG11 H 6.351 3.547 7.295 1.00 . A A . 34 VAL HG11 1 1 15 9371 1 1 34 VAL HG12 H 7.445 4.765 7.955 1.00 . A A . 34 VAL HG12 1 1 15 9372 1 1 34 VAL HG13 H 6.290 5.205 6.696 1.00 . A A . 34 VAL HG13 1 1 15 9373 1 1 34 VAL HG21 H 6.769 2.347 5.610 1.00 . A A . 34 VAL HG21 1 1 15 9374 1 1 34 VAL HG22 H 6.904 3.459 4.248 1.00 . A A . 34 VAL HG22 1 1 15 9375 1 1 34 VAL HG23 H 8.264 2.420 4.676 1.00 . A A . 34 VAL HG23 1 1 15 9376 1 1 34 VAL N N 7.217 5.897 4.495 1.00 . A A . 34 VAL N 1 1 15 9377 1 1 34 VAL O O 10.650 5.275 4.470 1.00 . A A . 34 VAL O 1 1 15 9378 1 1 35 HIS C C 10.346 5.056 1.129 1.00 . A A . 35 HIS C 1 1 15 9379 1 1 35 HIS CA C 10.089 3.922 2.117 1.00 . A A . 35 HIS CA 1 1 15 9380 1 1 35 HIS CB C 9.599 2.681 1.370 1.00 . A A . 35 HIS CB 1 1 15 9381 1 1 35 HIS CD2 C 7.731 1.125 2.275 1.00 . A A . 35 HIS CD2 1 1 15 9382 1 1 35 HIS CE1 C 8.858 0.184 3.903 1.00 . A A . 35 HIS CE1 1 1 15 9383 1 1 35 HIS CG C 8.978 1.651 2.263 1.00 . A A . 35 HIS CG 1 1 15 9384 1 1 35 HIS H H 8.169 4.110 2.989 1.00 . A A . 35 HIS H 1 1 15 9385 1 1 35 HIS HA H 11.013 3.686 2.622 1.00 . A A . 35 HIS HA 1 1 15 9386 1 1 35 HIS HB2 H 8.859 2.977 0.641 1.00 . A A . 35 HIS HB2 1 1 15 9387 1 1 35 HIS HB3 H 10.434 2.221 0.862 1.00 . A A . 35 HIS HB3 1 1 15 9388 1 1 35 HIS HD1 H 10.591 1.211 3.545 1.00 . A A . 35 HIS HD1 1 1 15 9389 1 1 35 HIS HD2 H 6.923 1.374 1.601 1.00 . A A . 35 HIS HD2 1 1 15 9390 1 1 35 HIS HE1 H 9.119 -0.437 4.746 1.00 . A A . 35 HIS HE1 1 1 15 9391 1 1 35 HIS N N 9.116 4.323 3.126 1.00 . A A . 35 HIS N 1 1 15 9392 1 1 35 HIS ND1 N 9.659 1.041 3.296 1.00 . A A . 35 HIS ND1 1 1 15 9393 1 1 35 HIS NE2 N 7.682 0.216 3.303 1.00 . A A . 35 HIS NE2 1 1 15 9394 1 1 35 HIS O O 9.528 5.322 0.248 1.00 . A A . 35 HIS O 1 1 15 9395 1 1 36 SER C C 11.680 6.441 -1.059 1.00 . A A . 36 SER C 1 1 15 9396 1 1 36 SER CA C 11.849 6.830 0.407 1.00 . A A . 36 SER CA 1 1 15 9397 1 1 36 SER CB C 13.292 7.263 0.668 1.00 . A A . 36 SER CB 1 1 15 9398 1 1 36 SER H H 12.097 5.462 2.004 1.00 . A A . 36 SER H 1 1 15 9399 1 1 36 SER HA H 11.188 7.655 0.627 1.00 . A A . 36 SER HA 1 1 15 9400 1 1 36 SER HB2 H 13.621 7.910 -0.130 1.00 . A A . 36 SER HB2 1 1 15 9401 1 1 36 SER HB3 H 13.341 7.796 1.607 1.00 . A A . 36 SER HB3 1 1 15 9402 1 1 36 SER HG H 13.637 5.336 0.744 1.00 . A A . 36 SER HG 1 1 15 9403 1 1 36 SER N N 11.486 5.721 1.282 1.00 . A A . 36 SER N 1 1 15 9404 1 1 36 SER O O 11.247 7.248 -1.881 1.00 . A A . 36 SER O 1 1 15 9405 1 1 36 SER OG O 14.157 6.142 0.734 1.00 . A A . 36 SER OG 1 1 15 9406 1 1 37 GLY C C 13.226 4.233 -3.307 1.00 . A A . 37 GLY C 1 1 15 9407 1 1 37 GLY CA C 11.906 4.723 -2.745 1.00 . A A . 37 GLY CA 1 1 15 9408 1 1 37 GLY H H 12.365 4.598 -0.682 1.00 . A A . 37 GLY H 1 1 15 9409 1 1 37 GLY HA2 H 11.192 3.914 -2.772 1.00 . A A . 37 GLY HA2 1 1 15 9410 1 1 37 GLY HA3 H 11.543 5.531 -3.364 1.00 . A A . 37 GLY HA3 1 1 15 9411 1 1 37 GLY N N 12.025 5.198 -1.379 1.00 . A A . 37 GLY N 1 1 15 9412 1 1 37 GLY O O 14.231 4.193 -2.599 1.00 . A A . 37 GLY O 1 1 15 9413 1 1 38 GLU C C 15.423 4.498 -5.468 1.00 . A A . 38 GLU C 1 1 15 9414 1 1 38 GLU CA C 14.428 3.364 -5.236 1.00 . A A . 38 GLU CA 1 1 15 9415 1 1 38 GLU CB C 14.077 2.698 -6.568 1.00 . A A . 38 GLU CB 1 1 15 9416 1 1 38 GLU CD C 13.171 0.656 -7.747 1.00 . A A . 38 GLU CD 1 1 15 9417 1 1 38 GLU CG C 13.591 1.266 -6.423 1.00 . A A . 38 GLU CG 1 1 15 9418 1 1 38 GLU H H 12.388 3.912 -5.094 1.00 . A A . 38 GLU H 1 1 15 9419 1 1 38 GLU HA H 14.882 2.631 -4.586 1.00 . A A . 38 GLU HA 1 1 15 9420 1 1 38 GLU HB2 H 13.301 3.274 -7.051 1.00 . A A . 38 GLU HB2 1 1 15 9421 1 1 38 GLU HB3 H 14.955 2.696 -7.197 1.00 . A A . 38 GLU HB3 1 1 15 9422 1 1 38 GLU HG2 H 14.388 0.669 -6.006 1.00 . A A . 38 GLU HG2 1 1 15 9423 1 1 38 GLU HG3 H 12.744 1.253 -5.753 1.00 . A A . 38 GLU HG3 1 1 15 9424 1 1 38 GLU N N 13.222 3.857 -4.582 1.00 . A A . 38 GLU N 1 1 15 9425 1 1 38 GLU O O 16.539 4.274 -5.939 1.00 . A A . 38 GLU O 1 1 15 9426 1 1 38 GLU OE1 O 12.412 1.313 -8.489 1.00 . A A . 38 GLU OE1 1 1 15 9427 1 1 38 GLU OE2 O 13.603 -0.479 -8.039 1.00 . A A . 38 GLU OE2 1 1 15 9428 1 1 39 LYS C C 15.744 7.826 -4.108 1.00 . A A . 39 LYS C 1 1 15 9429 1 1 39 LYS CA C 15.864 6.886 -5.304 1.00 . A A . 39 LYS CA 1 1 15 9430 1 1 39 LYS CB C 15.495 7.629 -6.590 1.00 . A A . 39 LYS CB 1 1 15 9431 1 1 39 LYS CD C 13.676 8.612 -8.016 1.00 . A A . 39 LYS CD 1 1 15 9432 1 1 39 LYS CE C 14.194 10.032 -8.191 1.00 . A A . 39 LYS CE 1 1 15 9433 1 1 39 LYS CG C 14.038 8.053 -6.651 1.00 . A A . 39 LYS CG 1 1 15 9434 1 1 39 LYS H H 14.111 5.831 -4.763 1.00 . A A . 39 LYS H 1 1 15 9435 1 1 39 LYS HA H 16.886 6.544 -5.376 1.00 . A A . 39 LYS HA 1 1 15 9436 1 1 39 LYS HB2 H 16.109 8.514 -6.669 1.00 . A A . 39 LYS HB2 1 1 15 9437 1 1 39 LYS HB3 H 15.697 6.985 -7.434 1.00 . A A . 39 LYS HB3 1 1 15 9438 1 1 39 LYS HD2 H 14.113 7.986 -8.780 1.00 . A A . 39 LYS HD2 1 1 15 9439 1 1 39 LYS HD3 H 12.601 8.615 -8.121 1.00 . A A . 39 LYS HD3 1 1 15 9440 1 1 39 LYS HE2 H 15.131 10.128 -7.665 1.00 . A A . 39 LYS HE2 1 1 15 9441 1 1 39 LYS HE3 H 14.352 10.216 -9.244 1.00 . A A . 39 LYS HE3 1 1 15 9442 1 1 39 LYS HG2 H 13.414 7.194 -6.449 1.00 . A A . 39 LYS HG2 1 1 15 9443 1 1 39 LYS HG3 H 13.862 8.812 -5.902 1.00 . A A . 39 LYS HG3 1 1 15 9444 1 1 39 LYS HZ1 H 12.342 11.000 -8.193 1.00 . A A . 39 LYS HZ1 1 1 15 9445 1 1 39 LYS HZ2 H 13.636 11.996 -7.751 1.00 . A A . 39 LYS HZ2 1 1 15 9446 1 1 39 LYS HZ3 H 13.037 10.853 -6.658 1.00 . A A . 39 LYS HZ3 1 1 15 9447 1 1 39 LYS N N 15.011 5.716 -5.134 1.00 . A A . 39 LYS N 1 1 15 9448 1 1 39 LYS NZ N 13.235 11.041 -7.661 1.00 . A A . 39 LYS NZ 1 1 15 9449 1 1 39 LYS O O 14.667 8.011 -3.540 1.00 . A A . 39 LYS O 1 1 15 9450 1 1 40 PRO C C 16.198 10.679 -2.888 1.00 . A A . 40 PRO C 1 1 15 9451 1 1 40 PRO CA C 16.918 9.368 -2.587 1.00 . A A . 40 PRO CA 1 1 15 9452 1 1 40 PRO CB C 18.416 9.614 -2.390 1.00 . A A . 40 PRO CB 1 1 15 9453 1 1 40 PRO CD C 18.191 8.262 -4.349 1.00 . A A . 40 PRO CD 1 1 15 9454 1 1 40 PRO CG C 19.022 9.349 -3.725 1.00 . A A . 40 PRO CG 1 1 15 9455 1 1 40 PRO HA H 16.503 8.928 -1.693 1.00 . A A . 40 PRO HA 1 1 15 9456 1 1 40 PRO HB2 H 18.578 10.636 -2.078 1.00 . A A . 40 PRO HB2 1 1 15 9457 1 1 40 PRO HB3 H 18.800 8.937 -1.642 1.00 . A A . 40 PRO HB3 1 1 15 9458 1 1 40 PRO HD2 H 18.129 8.401 -5.418 1.00 . A A . 40 PRO HD2 1 1 15 9459 1 1 40 PRO HD3 H 18.604 7.291 -4.117 1.00 . A A . 40 PRO HD3 1 1 15 9460 1 1 40 PRO HG2 H 18.985 10.243 -4.329 1.00 . A A . 40 PRO HG2 1 1 15 9461 1 1 40 PRO HG3 H 20.043 9.018 -3.605 1.00 . A A . 40 PRO HG3 1 1 15 9462 1 1 40 PRO N N 16.873 8.436 -3.718 1.00 . A A . 40 PRO N 1 1 15 9463 1 1 40 PRO O O 16.717 11.532 -3.607 1.00 . A A . 40 PRO O 1 1 15 9464 1 1 41 SER C C 13.478 12.438 -1.265 1.00 . A A . 41 SER C 1 1 15 9465 1 1 41 SER CA C 14.209 12.038 -2.543 1.00 . A A . 41 SER CA 1 1 15 9466 1 1 41 SER CB C 13.201 11.819 -3.673 1.00 . A A . 41 SER CB 1 1 15 9467 1 1 41 SER H H 14.641 10.115 -1.768 1.00 . A A . 41 SER H 1 1 15 9468 1 1 41 SER HA H 14.883 12.833 -2.823 1.00 . A A . 41 SER HA 1 1 15 9469 1 1 41 SER HB2 H 12.759 12.765 -3.946 1.00 . A A . 41 SER HB2 1 1 15 9470 1 1 41 SER HB3 H 13.709 11.399 -4.529 1.00 . A A . 41 SER HB3 1 1 15 9471 1 1 41 SER HG H 11.550 11.397 -2.707 1.00 . A A . 41 SER HG 1 1 15 9472 1 1 41 SER N N 15.001 10.832 -2.332 1.00 . A A . 41 SER N 1 1 15 9473 1 1 41 SER O O 12.760 11.636 -0.669 1.00 . A A . 41 SER O 1 1 15 9474 1 1 41 SER OG O 12.170 10.932 -3.273 1.00 . A A . 41 SER OG 1 1 15 9475 1 1 42 GLY C C 12.536 15.604 0.216 1.00 . A A . 42 GLY C 1 1 15 9476 1 1 42 GLY CA C 13.021 14.174 0.355 1.00 . A A . 42 GLY CA 1 1 15 9477 1 1 42 GLY H H 14.251 14.283 -1.365 1.00 . A A . 42 GLY H 1 1 15 9478 1 1 42 GLY HA2 H 12.177 13.539 0.579 1.00 . A A . 42 GLY HA2 1 1 15 9479 1 1 42 GLY HA3 H 13.724 14.123 1.173 1.00 . A A . 42 GLY HA3 1 1 15 9480 1 1 42 GLY N N 13.667 13.687 -0.849 1.00 . A A . 42 GLY N 1 1 15 9481 1 1 42 GLY O O 12.969 16.345 -0.667 1.00 . A A . 42 GLY O 1 1 15 9482 1 1 43 PRO C C 12.065 18.417 1.519 1.00 . A A . 43 PRO C 1 1 15 9483 1 1 43 PRO CA C 11.050 17.362 1.093 1.00 . A A . 43 PRO CA 1 1 15 9484 1 1 43 PRO CB C 9.909 17.276 2.110 1.00 . A A . 43 PRO CB 1 1 15 9485 1 1 43 PRO CD C 11.053 15.179 2.180 1.00 . A A . 43 PRO CD 1 1 15 9486 1 1 43 PRO CG C 10.300 16.168 3.026 1.00 . A A . 43 PRO CG 1 1 15 9487 1 1 43 PRO HA H 10.650 17.619 0.123 1.00 . A A . 43 PRO HA 1 1 15 9488 1 1 43 PRO HB2 H 9.824 18.215 2.639 1.00 . A A . 43 PRO HB2 1 1 15 9489 1 1 43 PRO HB3 H 8.983 17.059 1.600 1.00 . A A . 43 PRO HB3 1 1 15 9490 1 1 43 PRO HD2 H 11.838 14.711 2.755 1.00 . A A . 43 PRO HD2 1 1 15 9491 1 1 43 PRO HD3 H 10.380 14.434 1.781 1.00 . A A . 43 PRO HD3 1 1 15 9492 1 1 43 PRO HG2 H 10.934 16.548 3.812 1.00 . A A . 43 PRO HG2 1 1 15 9493 1 1 43 PRO HG3 H 9.416 15.708 3.443 1.00 . A A . 43 PRO HG3 1 1 15 9494 1 1 43 PRO N N 11.614 16.009 1.101 1.00 . A A . 43 PRO N 1 1 15 9495 1 1 43 PRO O O 13.203 18.095 1.859 1.00 . A A . 43 PRO O 1 1 15 9496 1 1 44 SER C C 11.737 21.869 2.607 1.00 . A A . 44 SER C 1 1 15 9497 1 1 44 SER CA C 12.520 20.781 1.879 1.00 . A A . 44 SER CA 1 1 15 9498 1 1 44 SER CB C 13.202 21.369 0.642 1.00 . A A . 44 SER CB 1 1 15 9499 1 1 44 SER H H 10.726 19.871 1.217 1.00 . A A . 44 SER H 1 1 15 9500 1 1 44 SER HA H 13.275 20.390 2.544 1.00 . A A . 44 SER HA 1 1 15 9501 1 1 44 SER HB2 H 13.760 22.248 0.926 1.00 . A A . 44 SER HB2 1 1 15 9502 1 1 44 SER HB3 H 13.875 20.635 0.223 1.00 . A A . 44 SER HB3 1 1 15 9503 1 1 44 SER HG H 12.571 21.474 -1.209 1.00 . A A . 44 SER HG 1 1 15 9504 1 1 44 SER N N 11.645 19.678 1.498 1.00 . A A . 44 SER N 1 1 15 9505 1 1 44 SER O O 10.771 22.416 2.075 1.00 . A A . 44 SER O 1 1 15 9506 1 1 44 SER OG O 12.249 21.731 -0.342 1.00 . A A . 44 SER OG 1 1 15 9507 1 1 45 SER C C 12.491 24.261 5.088 1.00 . A A . 45 SER C 1 1 15 9508 1 1 45 SER CA C 11.497 23.196 4.634 1.00 . A A . 45 SER CA 1 1 15 9509 1 1 45 SER CB C 10.825 22.558 5.851 1.00 . A A . 45 SER CB 1 1 15 9510 1 1 45 SER H H 12.936 21.705 4.199 1.00 . A A . 45 SER H 1 1 15 9511 1 1 45 SER HA H 10.742 23.663 4.020 1.00 . A A . 45 SER HA 1 1 15 9512 1 1 45 SER HB2 H 11.564 22.024 6.428 1.00 . A A . 45 SER HB2 1 1 15 9513 1 1 45 SER HB3 H 10.382 23.331 6.461 1.00 . A A . 45 SER HB3 1 1 15 9514 1 1 45 SER HG H 9.495 21.884 4.580 1.00 . A A . 45 SER HG 1 1 15 9515 1 1 45 SER N N 12.160 22.177 3.829 1.00 . A A . 45 SER N 1 1 15 9516 1 1 45 SER O O 13.693 24.012 5.166 1.00 . A A . 45 SER O 1 1 15 9517 1 1 45 SER OG O 9.811 21.650 5.456 1.00 . A A . 45 SER OG 1 1 15 9518 1 1 46 GLY C C 12.354 27.889 5.337 1.00 . A A . 46 GLY C 1 1 15 9519 1 1 46 GLY CA C 12.833 26.537 5.828 1.00 . A A . 46 GLY CA 1 1 15 9520 1 1 46 GLY H H 11.011 25.593 5.305 1.00 . A A . 46 GLY H 1 1 15 9521 1 1 46 GLY HA2 H 12.856 26.546 6.908 1.00 . A A . 46 GLY HA2 1 1 15 9522 1 1 46 GLY HA3 H 13.833 26.367 5.458 1.00 . A A . 46 GLY HA3 1 1 15 9523 1 1 46 GLY N N 11.978 25.451 5.386 1.00 . A A . 46 GLY N 1 1 15 9524 1 1 46 GLY O O 13.166 28.667 4.839 1.00 . A A . 46 GLY O 1 1 15 9525 2 2 1 ZN ZN ZN 6.291 -1.044 3.588 1.00 . B A . 181 ZN ZN 1 1 16 9526 1 1 1 GLY C C -5.039 -30.369 11.764 1.00 . A A . 1 GLY C 1 1 16 9527 1 1 1 GLY CA C -5.751 -31.472 12.521 1.00 . A A . 1 GLY CA 1 1 16 9528 1 1 1 GLY H1 H -5.361 -30.746 14.471 1.00 . A A . 1 GLY H1 1 1 16 9529 1 1 1 GLY HA2 H -5.542 -32.417 12.042 1.00 . A A . 1 GLY HA2 1 1 16 9530 1 1 1 GLY HA3 H -6.815 -31.289 12.484 1.00 . A A . 1 GLY HA3 1 1 16 9531 1 1 1 GLY N N -5.338 -31.549 13.910 1.00 . A A . 1 GLY N 1 1 16 9532 1 1 1 GLY O O -4.196 -29.668 12.323 1.00 . A A . 1 GLY O 1 1 16 9533 1 1 2 SER C C -5.335 -27.816 9.962 1.00 . A A . 2 SER C 1 1 16 9534 1 1 2 SER CA C -4.759 -29.194 9.651 1.00 . A A . 2 SER CA 1 1 16 9535 1 1 2 SER CB C -4.965 -29.523 8.171 1.00 . A A . 2 SER CB 1 1 16 9536 1 1 2 SER H H -6.055 -30.807 10.099 1.00 . A A . 2 SER H 1 1 16 9537 1 1 2 SER HA H -3.700 -29.186 9.865 1.00 . A A . 2 SER HA 1 1 16 9538 1 1 2 SER HB2 H -6.020 -29.627 7.971 1.00 . A A . 2 SER HB2 1 1 16 9539 1 1 2 SER HB3 H -4.561 -28.723 7.567 1.00 . A A . 2 SER HB3 1 1 16 9540 1 1 2 SER HG H -4.968 -31.388 7.569 1.00 . A A . 2 SER HG 1 1 16 9541 1 1 2 SER N N -5.376 -30.216 10.487 1.00 . A A . 2 SER N 1 1 16 9542 1 1 2 SER O O -6.508 -27.549 9.704 1.00 . A A . 2 SER O 1 1 16 9543 1 1 2 SER OG O -4.313 -30.733 7.822 1.00 . A A . 2 SER OG 1 1 16 9544 1 1 3 SER C C -4.756 -24.647 9.685 1.00 . A A . 3 SER C 1 1 16 9545 1 1 3 SER CA C -4.925 -25.595 10.868 1.00 . A A . 3 SER CA 1 1 16 9546 1 1 3 SER CB C -4.126 -25.080 12.067 1.00 . A A . 3 SER CB 1 1 16 9547 1 1 3 SER H H -3.575 -27.217 10.698 1.00 . A A . 3 SER H 1 1 16 9548 1 1 3 SER HA H -5.971 -25.636 11.135 1.00 . A A . 3 SER HA 1 1 16 9549 1 1 3 SER HB2 H -3.089 -24.971 11.785 1.00 . A A . 3 SER HB2 1 1 16 9550 1 1 3 SER HB3 H -4.518 -24.121 12.373 1.00 . A A . 3 SER HB3 1 1 16 9551 1 1 3 SER HG H -5.102 -25.966 13.515 1.00 . A A . 3 SER HG 1 1 16 9552 1 1 3 SER N N -4.499 -26.944 10.518 1.00 . A A . 3 SER N 1 1 16 9553 1 1 3 SER O O -5.667 -23.895 9.342 1.00 . A A . 3 SER O 1 1 16 9554 1 1 3 SER OG O -4.210 -25.978 13.160 1.00 . A A . 3 SER OG 1 1 16 9555 1 1 4 GLY C C -2.200 -22.836 8.199 1.00 . A A . 4 GLY C 1 1 16 9556 1 1 4 GLY CA C -3.311 -23.830 7.926 1.00 . A A . 4 GLY CA 1 1 16 9557 1 1 4 GLY H H -2.891 -25.309 9.382 1.00 . A A . 4 GLY H 1 1 16 9558 1 1 4 GLY HA2 H -3.032 -24.445 7.083 1.00 . A A . 4 GLY HA2 1 1 16 9559 1 1 4 GLY HA3 H -4.212 -23.287 7.679 1.00 . A A . 4 GLY HA3 1 1 16 9560 1 1 4 GLY N N -3.581 -24.689 9.064 1.00 . A A . 4 GLY N 1 1 16 9561 1 1 4 GLY O O -1.185 -23.181 8.805 1.00 . A A . 4 GLY O 1 1 16 9562 1 1 5 SER C C -2.053 -19.181 8.023 1.00 . A A . 5 SER C 1 1 16 9563 1 1 5 SER CA C -1.392 -20.554 7.945 1.00 . A A . 5 SER CA 1 1 16 9564 1 1 5 SER CB C -0.370 -20.577 6.807 1.00 . A A . 5 SER CB 1 1 16 9565 1 1 5 SER H H -3.220 -21.387 7.274 1.00 . A A . 5 SER H 1 1 16 9566 1 1 5 SER HA H -0.885 -20.750 8.878 1.00 . A A . 5 SER HA 1 1 16 9567 1 1 5 SER HB2 H 0.412 -19.862 7.015 1.00 . A A . 5 SER HB2 1 1 16 9568 1 1 5 SER HB3 H 0.058 -21.566 6.731 1.00 . A A . 5 SER HB3 1 1 16 9569 1 1 5 SER HG H -1.591 -20.937 5.319 1.00 . A A . 5 SER HG 1 1 16 9570 1 1 5 SER N N -2.390 -21.600 7.750 1.00 . A A . 5 SER N 1 1 16 9571 1 1 5 SER O O -2.913 -18.847 7.209 1.00 . A A . 5 SER O 1 1 16 9572 1 1 5 SER OG O -0.976 -20.244 5.570 1.00 . A A . 5 SER OG 1 1 16 9573 1 1 6 SER C C -1.099 -15.998 9.142 1.00 . A A . 6 SER C 1 1 16 9574 1 1 6 SER CA C -2.198 -17.055 9.198 1.00 . A A . 6 SER CA 1 1 16 9575 1 1 6 SER CB C -2.935 -16.969 10.537 1.00 . A A . 6 SER CB 1 1 16 9576 1 1 6 SER H H -0.955 -18.714 9.628 1.00 . A A . 6 SER H 1 1 16 9577 1 1 6 SER HA H -2.900 -16.871 8.398 1.00 . A A . 6 SER HA 1 1 16 9578 1 1 6 SER HB2 H -3.333 -15.974 10.662 1.00 . A A . 6 SER HB2 1 1 16 9579 1 1 6 SER HB3 H -3.744 -17.685 10.545 1.00 . A A . 6 SER HB3 1 1 16 9580 1 1 6 SER HG H -1.954 -18.202 11.700 1.00 . A A . 6 SER HG 1 1 16 9581 1 1 6 SER N N -1.644 -18.390 9.010 1.00 . A A . 6 SER N 1 1 16 9582 1 1 6 SER O O -0.566 -15.584 10.170 1.00 . A A . 6 SER O 1 1 16 9583 1 1 6 SER OG O -2.064 -17.252 11.618 1.00 . A A . 6 SER OG 1 1 16 9584 1 1 7 GLY C C 0.942 -14.645 6.404 1.00 . A A . 7 GLY C 1 1 16 9585 1 1 7 GLY CA C 0.268 -14.560 7.760 1.00 . A A . 7 GLY CA 1 1 16 9586 1 1 7 GLY H H -1.224 -15.930 7.145 1.00 . A A . 7 GLY H 1 1 16 9587 1 1 7 GLY HA2 H -0.175 -13.581 7.870 1.00 . A A . 7 GLY HA2 1 1 16 9588 1 1 7 GLY HA3 H 1.015 -14.695 8.529 1.00 . A A . 7 GLY HA3 1 1 16 9589 1 1 7 GLY N N -0.765 -15.565 7.930 1.00 . A A . 7 GLY N 1 1 16 9590 1 1 7 GLY O O 2.160 -14.502 6.297 1.00 . A A . 7 GLY O 1 1 16 9591 1 1 8 THR C C -0.093 -14.084 3.049 1.00 . A A . 8 THR C 1 1 16 9592 1 1 8 THR CA C 0.674 -14.986 4.009 1.00 . A A . 8 THR CA 1 1 16 9593 1 1 8 THR CB C 0.611 -16.436 3.495 1.00 . A A . 8 THR CB 1 1 16 9594 1 1 8 THR CG2 C 1.362 -16.577 2.179 1.00 . A A . 8 THR CG2 1 1 16 9595 1 1 8 THR H H -0.815 -14.983 5.513 1.00 . A A . 8 THR H 1 1 16 9596 1 1 8 THR HA H 1.709 -14.677 4.029 1.00 . A A . 8 THR HA 1 1 16 9597 1 1 8 THR HB H -0.424 -16.699 3.331 1.00 . A A . 8 THR HB 1 1 16 9598 1 1 8 THR HG1 H 1.228 -16.878 5.315 1.00 . A A . 8 THR HG1 1 1 16 9599 1 1 8 THR HG21 H 0.711 -17.016 1.439 1.00 . A A . 8 THR HG21 1 1 16 9600 1 1 8 THR HG22 H 2.224 -17.212 2.323 1.00 . A A . 8 THR HG22 1 1 16 9601 1 1 8 THR HG23 H 1.685 -15.603 1.843 1.00 . A A . 8 THR HG23 1 1 16 9602 1 1 8 THR N N 0.148 -14.879 5.364 1.00 . A A . 8 THR N 1 1 16 9603 1 1 8 THR O O -0.381 -14.469 1.917 1.00 . A A . 8 THR O 1 1 16 9604 1 1 8 THR OG1 O 1.171 -17.326 4.467 1.00 . A A . 8 THR OG1 1 1 16 9605 1 1 9 GLY C C -2.590 -12.359 2.458 1.00 . A A . 9 GLY C 1 1 16 9606 1 1 9 GLY CA C -1.149 -11.941 2.676 1.00 . A A . 9 GLY CA 1 1 16 9607 1 1 9 GLY H H -0.162 -12.626 4.420 1.00 . A A . 9 GLY H 1 1 16 9608 1 1 9 GLY HA2 H -1.135 -10.971 3.149 1.00 . A A . 9 GLY HA2 1 1 16 9609 1 1 9 GLY HA3 H -0.658 -11.871 1.717 1.00 . A A . 9 GLY HA3 1 1 16 9610 1 1 9 GLY N N -0.419 -12.880 3.508 1.00 . A A . 9 GLY N 1 1 16 9611 1 1 9 GLY O O -2.887 -13.131 1.547 1.00 . A A . 9 GLY O 1 1 16 9612 1 1 10 GLU C C -5.698 -10.991 2.653 1.00 . A A . 10 GLU C 1 1 16 9613 1 1 10 GLU CA C -4.903 -12.178 3.191 1.00 . A A . 10 GLU CA 1 1 16 9614 1 1 10 GLU CB C -5.455 -12.598 4.555 1.00 . A A . 10 GLU CB 1 1 16 9615 1 1 10 GLU CD C -7.348 -13.764 5.754 1.00 . A A . 10 GLU CD 1 1 16 9616 1 1 10 GLU CG C -6.924 -12.985 4.525 1.00 . A A . 10 GLU CG 1 1 16 9617 1 1 10 GLU H H -3.188 -11.240 4.003 1.00 . A A . 10 GLU H 1 1 16 9618 1 1 10 GLU HA H -5.002 -13.003 2.503 1.00 . A A . 10 GLU HA 1 1 16 9619 1 1 10 GLU HB2 H -4.888 -13.445 4.914 1.00 . A A . 10 GLU HB2 1 1 16 9620 1 1 10 GLU HB3 H -5.335 -11.777 5.247 1.00 . A A . 10 GLU HB3 1 1 16 9621 1 1 10 GLU HG2 H -7.518 -12.085 4.465 1.00 . A A . 10 GLU HG2 1 1 16 9622 1 1 10 GLU HG3 H -7.105 -13.593 3.651 1.00 . A A . 10 GLU HG3 1 1 16 9623 1 1 10 GLU N N -3.486 -11.850 3.297 1.00 . A A . 10 GLU N 1 1 16 9624 1 1 10 GLU O O -6.751 -11.162 2.039 1.00 . A A . 10 GLU O 1 1 16 9625 1 1 10 GLU OE1 O -6.875 -13.429 6.861 1.00 . A A . 10 GLU OE1 1 1 16 9626 1 1 10 GLU OE2 O -8.151 -14.709 5.611 1.00 . A A . 10 GLU OE2 1 1 16 9627 1 1 11 LYS C C -5.386 -8.204 1.021 1.00 . A A . 11 LYS C 1 1 16 9628 1 1 11 LYS CA C -5.845 -8.572 2.428 1.00 . A A . 11 LYS CA 1 1 16 9629 1 1 11 LYS CB C -5.557 -7.416 3.389 1.00 . A A . 11 LYS CB 1 1 16 9630 1 1 11 LYS CD C -6.133 -8.115 5.732 1.00 . A A . 11 LYS CD 1 1 16 9631 1 1 11 LYS CE C -6.702 -9.524 5.685 1.00 . A A . 11 LYS CE 1 1 16 9632 1 1 11 LYS CG C -6.562 -7.301 4.522 1.00 . A A . 11 LYS CG 1 1 16 9633 1 1 11 LYS H H -4.342 -9.716 3.384 1.00 . A A . 11 LYS H 1 1 16 9634 1 1 11 LYS HA H -6.908 -8.757 2.410 1.00 . A A . 11 LYS HA 1 1 16 9635 1 1 11 LYS HB2 H -4.576 -7.557 3.818 1.00 . A A . 11 LYS HB2 1 1 16 9636 1 1 11 LYS HB3 H -5.567 -6.490 2.832 1.00 . A A . 11 LYS HB3 1 1 16 9637 1 1 11 LYS HD2 H -5.055 -8.174 5.751 1.00 . A A . 11 LYS HD2 1 1 16 9638 1 1 11 LYS HD3 H -6.485 -7.623 6.628 1.00 . A A . 11 LYS HD3 1 1 16 9639 1 1 11 LYS HE2 H -7.775 -9.463 5.590 1.00 . A A . 11 LYS HE2 1 1 16 9640 1 1 11 LYS HE3 H -6.294 -10.035 4.826 1.00 . A A . 11 LYS HE3 1 1 16 9641 1 1 11 LYS HG2 H -6.648 -6.264 4.811 1.00 . A A . 11 LYS HG2 1 1 16 9642 1 1 11 LYS HG3 H -7.521 -7.662 4.178 1.00 . A A . 11 LYS HG3 1 1 16 9643 1 1 11 LYS HZ1 H -5.393 -10.654 6.857 1.00 . A A . 11 LYS HZ1 1 1 16 9644 1 1 11 LYS HZ2 H -7.016 -11.106 7.014 1.00 . A A . 11 LYS HZ2 1 1 16 9645 1 1 11 LYS HZ3 H -6.456 -9.691 7.753 1.00 . A A . 11 LYS HZ3 1 1 16 9646 1 1 11 LYS N N -5.186 -9.788 2.889 1.00 . A A . 11 LYS N 1 1 16 9647 1 1 11 LYS NZ N -6.368 -10.298 6.913 1.00 . A A . 11 LYS NZ 1 1 16 9648 1 1 11 LYS O O -4.259 -8.489 0.615 1.00 . A A . 11 LYS O 1 1 16 9649 1 1 12 PRO C C -4.966 -5.997 -1.168 1.00 . A A . 12 PRO C 1 1 16 9650 1 1 12 PRO CA C -5.985 -7.131 -1.115 1.00 . A A . 12 PRO CA 1 1 16 9651 1 1 12 PRO CB C -7.343 -6.654 -1.636 1.00 . A A . 12 PRO CB 1 1 16 9652 1 1 12 PRO CD C -7.639 -7.181 0.677 1.00 . A A . 12 PRO CD 1 1 16 9653 1 1 12 PRO CG C -8.098 -6.255 -0.415 1.00 . A A . 12 PRO CG 1 1 16 9654 1 1 12 PRO HA H -5.636 -7.956 -1.718 1.00 . A A . 12 PRO HA 1 1 16 9655 1 1 12 PRO HB2 H -7.201 -5.816 -2.305 1.00 . A A . 12 PRO HB2 1 1 16 9656 1 1 12 PRO HB3 H -7.836 -7.460 -2.159 1.00 . A A . 12 PRO HB3 1 1 16 9657 1 1 12 PRO HD2 H -7.623 -6.666 1.626 1.00 . A A . 12 PRO HD2 1 1 16 9658 1 1 12 PRO HD3 H -8.278 -8.050 0.728 1.00 . A A . 12 PRO HD3 1 1 16 9659 1 1 12 PRO HG2 H -7.869 -5.231 -0.160 1.00 . A A . 12 PRO HG2 1 1 16 9660 1 1 12 PRO HG3 H -9.158 -6.373 -0.585 1.00 . A A . 12 PRO HG3 1 1 16 9661 1 1 12 PRO N N -6.277 -7.554 0.258 1.00 . A A . 12 PRO N 1 1 16 9662 1 1 12 PRO O O -4.505 -5.614 -2.243 1.00 . A A . 12 PRO O 1 1 16 9663 1 1 13 TYR C C -2.340 -4.855 0.689 1.00 . A A . 13 TYR C 1 1 16 9664 1 1 13 TYR CA C -3.656 -4.374 0.084 1.00 . A A . 13 TYR CA 1 1 16 9665 1 1 13 TYR CB C -4.225 -3.228 0.921 1.00 . A A . 13 TYR CB 1 1 16 9666 1 1 13 TYR CD1 C -6.749 -3.272 0.838 1.00 . A A . 13 TYR CD1 1 1 16 9667 1 1 13 TYR CD2 C -5.608 -1.656 -0.492 1.00 . A A . 13 TYR CD2 1 1 16 9668 1 1 13 TYR CE1 C -7.963 -2.801 0.377 1.00 . A A . 13 TYR CE1 1 1 16 9669 1 1 13 TYR CE2 C -6.817 -1.178 -0.957 1.00 . A A . 13 TYR CE2 1 1 16 9670 1 1 13 TYR CG C -5.552 -2.708 0.413 1.00 . A A . 13 TYR CG 1 1 16 9671 1 1 13 TYR CZ C -7.992 -1.754 -0.520 1.00 . A A . 13 TYR CZ 1 1 16 9672 1 1 13 TYR H H -5.021 -5.813 0.822 1.00 . A A . 13 TYR H 1 1 16 9673 1 1 13 TYR HA H -3.469 -4.017 -0.918 1.00 . A A . 13 TYR HA 1 1 16 9674 1 1 13 TYR HB2 H -4.369 -3.568 1.935 1.00 . A A . 13 TYR HB2 1 1 16 9675 1 1 13 TYR HB3 H -3.524 -2.406 0.918 1.00 . A A . 13 TYR HB3 1 1 16 9676 1 1 13 TYR HD1 H -6.723 -4.092 1.541 1.00 . A A . 13 TYR HD1 1 1 16 9677 1 1 13 TYR HD2 H -4.686 -1.207 -0.832 1.00 . A A . 13 TYR HD2 1 1 16 9678 1 1 13 TYR HE1 H -8.883 -3.252 0.719 1.00 . A A . 13 TYR HE1 1 1 16 9679 1 1 13 TYR HE2 H -6.840 -0.358 -1.660 1.00 . A A . 13 TYR HE2 1 1 16 9680 1 1 13 TYR HH H -9.052 -0.736 -1.759 1.00 . A A . 13 TYR HH 1 1 16 9681 1 1 13 TYR N N -4.619 -5.465 -0.001 1.00 . A A . 13 TYR N 1 1 16 9682 1 1 13 TYR O O -2.298 -5.300 1.836 1.00 . A A . 13 TYR O 1 1 16 9683 1 1 13 TYR OH O -9.199 -1.282 -0.983 1.00 . A A . 13 TYR OH 1 1 16 9684 1 1 14 GLU C C 1.121 -4.185 -0.052 1.00 . A A . 14 GLU C 1 1 16 9685 1 1 14 GLU CA C 0.049 -5.187 0.367 1.00 . A A . 14 GLU CA 1 1 16 9686 1 1 14 GLU CB C 0.385 -6.572 -0.191 1.00 . A A . 14 GLU CB 1 1 16 9687 1 1 14 GLU CD C 2.122 -8.393 -0.409 1.00 . A A . 14 GLU CD 1 1 16 9688 1 1 14 GLU CG C 1.702 -7.131 0.319 1.00 . A A . 14 GLU CG 1 1 16 9689 1 1 14 GLU H H -1.366 -4.399 -0.996 1.00 . A A . 14 GLU H 1 1 16 9690 1 1 14 GLU HA H 0.024 -5.240 1.445 1.00 . A A . 14 GLU HA 1 1 16 9691 1 1 14 GLU HB2 H -0.404 -7.258 0.083 1.00 . A A . 14 GLU HB2 1 1 16 9692 1 1 14 GLU HB3 H 0.437 -6.510 -1.268 1.00 . A A . 14 GLU HB3 1 1 16 9693 1 1 14 GLU HG2 H 2.471 -6.384 0.186 1.00 . A A . 14 GLU HG2 1 1 16 9694 1 1 14 GLU HG3 H 1.600 -7.357 1.371 1.00 . A A . 14 GLU HG3 1 1 16 9695 1 1 14 GLU N N -1.268 -4.762 -0.092 1.00 . A A . 14 GLU N 1 1 16 9696 1 1 14 GLU O O 1.013 -3.543 -1.098 1.00 . A A . 14 GLU O 1 1 16 9697 1 1 14 GLU OE1 O 2.012 -8.425 -1.653 1.00 . A A . 14 GLU OE1 1 1 16 9698 1 1 14 GLU OE2 O 2.561 -9.348 0.265 1.00 . A A . 14 GLU OE2 1 1 16 9699 1 1 15 CYS C C 4.260 -3.761 -0.463 1.00 . A A . 15 CYS C 1 1 16 9700 1 1 15 CYS CA C 3.247 -3.131 0.489 1.00 . A A . 15 CYS CA 1 1 16 9701 1 1 15 CYS CB C 3.941 -2.717 1.788 1.00 . A A . 15 CYS CB 1 1 16 9702 1 1 15 CYS H H 2.186 -4.595 1.590 1.00 . A A . 15 CYS H 1 1 16 9703 1 1 15 CYS HA H 2.827 -2.255 0.021 1.00 . A A . 15 CYS HA 1 1 16 9704 1 1 15 CYS HB2 H 3.224 -2.745 2.595 1.00 . A A . 15 CYS HB2 1 1 16 9705 1 1 15 CYS HB3 H 4.739 -3.414 1.999 1.00 . A A . 15 CYS HB3 1 1 16 9706 1 1 15 CYS N N 2.155 -4.055 0.772 1.00 . A A . 15 CYS N 1 1 16 9707 1 1 15 CYS O O 4.685 -4.900 -0.270 1.00 . A A . 15 CYS O 1 1 16 9708 1 1 15 CYS SG S 4.662 -1.045 1.746 1.00 . A A . 15 CYS SG 1 1 16 9709 1 1 16 ASP C C 7.032 -3.328 -1.962 1.00 . A A . 16 ASP C 1 1 16 9710 1 1 16 ASP CA C 5.604 -3.494 -2.474 1.00 . A A . 16 ASP CA 1 1 16 9711 1 1 16 ASP CB C 5.434 -2.746 -3.798 1.00 . A A . 16 ASP CB 1 1 16 9712 1 1 16 ASP CG C 5.950 -3.540 -4.982 1.00 . A A . 16 ASP CG 1 1 16 9713 1 1 16 ASP H H 4.266 -2.111 -1.592 1.00 . A A . 16 ASP H 1 1 16 9714 1 1 16 ASP HA H 5.414 -4.544 -2.637 1.00 . A A . 16 ASP HA 1 1 16 9715 1 1 16 ASP HB2 H 4.385 -2.542 -3.955 1.00 . A A . 16 ASP HB2 1 1 16 9716 1 1 16 ASP HB3 H 5.975 -1.813 -3.749 1.00 . A A . 16 ASP HB3 1 1 16 9717 1 1 16 ASP N N 4.641 -3.011 -1.492 1.00 . A A . 16 ASP N 1 1 16 9718 1 1 16 ASP O O 7.989 -3.380 -2.735 1.00 . A A . 16 ASP O 1 1 16 9719 1 1 16 ASP OD1 O 5.300 -4.539 -5.356 1.00 . A A . 16 ASP OD1 1 1 16 9720 1 1 16 ASP OD2 O 7.004 -3.163 -5.534 1.00 . A A . 16 ASP OD2 1 1 16 9721 1 1 17 VAL C C 8.679 -3.933 1.110 1.00 . A A . 17 VAL C 1 1 16 9722 1 1 17 VAL CA C 8.477 -2.953 -0.040 1.00 . A A . 17 VAL CA 1 1 16 9723 1 1 17 VAL CB C 8.665 -1.517 0.484 1.00 . A A . 17 VAL CB 1 1 16 9724 1 1 17 VAL CG1 C 9.997 -1.382 1.207 1.00 . A A . 17 VAL CG1 1 1 16 9725 1 1 17 VAL CG2 C 8.564 -0.516 -0.657 1.00 . A A . 17 VAL CG2 1 1 16 9726 1 1 17 VAL H H 6.366 -3.095 -0.091 1.00 . A A . 17 VAL H 1 1 16 9727 1 1 17 VAL HA H 9.228 -3.139 -0.795 1.00 . A A . 17 VAL HA 1 1 16 9728 1 1 17 VAL HB H 7.875 -1.307 1.191 1.00 . A A . 17 VAL HB 1 1 16 9729 1 1 17 VAL HG11 H 9.930 -1.854 2.176 1.00 . A A . 17 VAL HG11 1 1 16 9730 1 1 17 VAL HG12 H 10.772 -1.859 0.625 1.00 . A A . 17 VAL HG12 1 1 16 9731 1 1 17 VAL HG13 H 10.234 -0.336 1.332 1.00 . A A . 17 VAL HG13 1 1 16 9732 1 1 17 VAL HG21 H 9.298 -0.755 -1.411 1.00 . A A . 17 VAL HG21 1 1 16 9733 1 1 17 VAL HG22 H 7.575 -0.562 -1.088 1.00 . A A . 17 VAL HG22 1 1 16 9734 1 1 17 VAL HG23 H 8.746 0.480 -0.279 1.00 . A A . 17 VAL HG23 1 1 16 9735 1 1 17 VAL N N 7.167 -3.127 -0.655 1.00 . A A . 17 VAL N 1 1 16 9736 1 1 17 VAL O O 9.644 -4.698 1.127 1.00 . A A . 17 VAL O 1 1 16 9737 1 1 18 CYS C C 6.644 -5.744 3.261 1.00 . A A . 18 CYS C 1 1 16 9738 1 1 18 CYS CA C 7.836 -4.791 3.226 1.00 . A A . 18 CYS CA 1 1 16 9739 1 1 18 CYS CB C 7.888 -3.975 4.519 1.00 . A A . 18 CYS CB 1 1 16 9740 1 1 18 CYS H H 7.014 -3.274 2.001 1.00 . A A . 18 CYS H 1 1 16 9741 1 1 18 CYS HA H 8.743 -5.372 3.141 1.00 . A A . 18 CYS HA 1 1 16 9742 1 1 18 CYS HB2 H 7.932 -4.650 5.361 1.00 . A A . 18 CYS HB2 1 1 16 9743 1 1 18 CYS HB3 H 8.775 -3.358 4.511 1.00 . A A . 18 CYS HB3 1 1 16 9744 1 1 18 CYS N N 7.761 -3.906 2.071 1.00 . A A . 18 CYS N 1 1 16 9745 1 1 18 CYS O O 6.308 -6.296 4.308 1.00 . A A . 18 CYS O 1 1 16 9746 1 1 18 CYS SG S 6.453 -2.880 4.764 1.00 . A A . 18 CYS SG 1 1 16 9747 1 1 19 ARG C C 3.983 -6.716 3.254 1.00 . A A . 19 ARG C 1 1 16 9748 1 1 19 ARG CA C 4.855 -6.814 2.006 1.00 . A A . 19 ARG CA 1 1 16 9749 1 1 19 ARG CB C 5.310 -8.260 1.801 1.00 . A A . 19 ARG CB 1 1 16 9750 1 1 19 ARG CD C 6.673 -7.891 -0.278 1.00 . A A . 19 ARG CD 1 1 16 9751 1 1 19 ARG CG C 5.502 -8.638 0.341 1.00 . A A . 19 ARG CG 1 1 16 9752 1 1 19 ARG CZ C 6.744 -8.736 -2.586 1.00 . A A . 19 ARG CZ 1 1 16 9753 1 1 19 ARG H H 6.325 -5.461 1.307 1.00 . A A . 19 ARG H 1 1 16 9754 1 1 19 ARG HA H 4.275 -6.504 1.150 1.00 . A A . 19 ARG HA 1 1 16 9755 1 1 19 ARG HB2 H 6.249 -8.406 2.314 1.00 . A A . 19 ARG HB2 1 1 16 9756 1 1 19 ARG HB3 H 4.570 -8.921 2.227 1.00 . A A . 19 ARG HB3 1 1 16 9757 1 1 19 ARG HD2 H 6.320 -6.943 -0.655 1.00 . A A . 19 ARG HD2 1 1 16 9758 1 1 19 ARG HD3 H 7.417 -7.720 0.485 1.00 . A A . 19 ARG HD3 1 1 16 9759 1 1 19 ARG HE H 8.131 -9.094 -1.198 1.00 . A A . 19 ARG HE 1 1 16 9760 1 1 19 ARG HG2 H 5.690 -9.699 0.275 1.00 . A A . 19 ARG HG2 1 1 16 9761 1 1 19 ARG HG3 H 4.602 -8.395 -0.205 1.00 . A A . 19 ARG HG3 1 1 16 9762 1 1 19 ARG HH11 H 5.130 -7.604 -2.144 1.00 . A A . 19 ARG HH11 1 1 16 9763 1 1 19 ARG HH12 H 5.192 -8.205 -3.768 1.00 . A A . 19 ARG HH12 1 1 16 9764 1 1 19 ARG HH21 H 8.224 -9.891 -3.333 1.00 . A A . 19 ARG HH21 1 1 16 9765 1 1 19 ARG HH22 H 6.953 -9.507 -4.443 1.00 . A A . 19 ARG HH22 1 1 16 9766 1 1 19 ARG N N 6.010 -5.930 2.108 1.00 . A A . 19 ARG N 1 1 16 9767 1 1 19 ARG NE N 7.281 -8.640 -1.375 1.00 . A A . 19 ARG NE 1 1 16 9768 1 1 19 ARG NH1 N 5.594 -8.132 -2.855 1.00 . A A . 19 ARG NH1 1 1 16 9769 1 1 19 ARG NH2 N 7.357 -9.435 -3.532 1.00 . A A . 19 ARG NH2 1 1 16 9770 1 1 19 ARG O O 3.696 -7.721 3.905 1.00 . A A . 19 ARG O 1 1 16 9771 1 1 20 LYS C C 1.248 -5.272 4.370 1.00 . A A . 20 LYS C 1 1 16 9772 1 1 20 LYS CA C 2.725 -5.267 4.751 1.00 . A A . 20 LYS CA 1 1 16 9773 1 1 20 LYS CB C 3.088 -3.934 5.410 1.00 . A A . 20 LYS CB 1 1 16 9774 1 1 20 LYS CD C 3.303 -2.775 7.628 1.00 . A A . 20 LYS CD 1 1 16 9775 1 1 20 LYS CE C 3.076 -2.983 9.118 1.00 . A A . 20 LYS CE 1 1 16 9776 1 1 20 LYS CG C 2.498 -3.762 6.799 1.00 . A A . 20 LYS CG 1 1 16 9777 1 1 20 LYS H H 3.827 -4.736 3.024 1.00 . A A . 20 LYS H 1 1 16 9778 1 1 20 LYS HA H 2.905 -6.067 5.453 1.00 . A A . 20 LYS HA 1 1 16 9779 1 1 20 LYS HB2 H 4.163 -3.865 5.487 1.00 . A A . 20 LYS HB2 1 1 16 9780 1 1 20 LYS HB3 H 2.727 -3.128 4.787 1.00 . A A . 20 LYS HB3 1 1 16 9781 1 1 20 LYS HD2 H 4.353 -2.910 7.413 1.00 . A A . 20 LYS HD2 1 1 16 9782 1 1 20 LYS HD3 H 3.006 -1.770 7.364 1.00 . A A . 20 LYS HD3 1 1 16 9783 1 1 20 LYS HE2 H 2.184 -2.450 9.410 1.00 . A A . 20 LYS HE2 1 1 16 9784 1 1 20 LYS HE3 H 2.943 -4.038 9.304 1.00 . A A . 20 LYS HE3 1 1 16 9785 1 1 20 LYS HG2 H 1.486 -3.397 6.708 1.00 . A A . 20 LYS HG2 1 1 16 9786 1 1 20 LYS HG3 H 2.494 -4.720 7.300 1.00 . A A . 20 LYS HG3 1 1 16 9787 1 1 20 LYS HZ1 H 4.151 -2.841 10.904 1.00 . A A . 20 LYS HZ1 1 1 16 9788 1 1 20 LYS HZ2 H 4.226 -1.448 9.945 1.00 . A A . 20 LYS HZ2 1 1 16 9789 1 1 20 LYS HZ3 H 5.120 -2.819 9.517 1.00 . A A . 20 LYS HZ3 1 1 16 9790 1 1 20 LYS N N 3.565 -5.498 3.582 1.00 . A A . 20 LYS N 1 1 16 9791 1 1 20 LYS NZ N 4.224 -2.488 9.928 1.00 . A A . 20 LYS NZ 1 1 16 9792 1 1 20 LYS O O 0.841 -4.609 3.416 1.00 . A A . 20 LYS O 1 1 16 9793 1 1 21 ALA C C -1.740 -5.006 5.594 1.00 . A A . 21 ALA C 1 1 16 9794 1 1 21 ALA CA C -0.983 -6.110 4.864 1.00 . A A . 21 ALA CA 1 1 16 9795 1 1 21 ALA CB C -1.510 -7.477 5.276 1.00 . A A . 21 ALA CB 1 1 16 9796 1 1 21 ALA H H 0.832 -6.528 5.869 1.00 . A A . 21 ALA H 1 1 16 9797 1 1 21 ALA HA H -1.138 -5.997 3.801 1.00 . A A . 21 ALA HA 1 1 16 9798 1 1 21 ALA HB1 H -2.554 -7.395 5.539 1.00 . A A . 21 ALA HB1 1 1 16 9799 1 1 21 ALA HB2 H -1.399 -8.167 4.453 1.00 . A A . 21 ALA HB2 1 1 16 9800 1 1 21 ALA HB3 H -0.951 -7.837 6.127 1.00 . A A . 21 ALA HB3 1 1 16 9801 1 1 21 ALA N N 0.449 -6.022 5.122 1.00 . A A . 21 ALA N 1 1 16 9802 1 1 21 ALA O O -1.442 -4.693 6.747 1.00 . A A . 21 ALA O 1 1 16 9803 1 1 22 PHE C C -5.005 -3.562 5.216 1.00 . A A . 22 PHE C 1 1 16 9804 1 1 22 PHE CA C -3.521 -3.349 5.500 1.00 . A A . 22 PHE CA 1 1 16 9805 1 1 22 PHE CB C -3.075 -1.993 4.951 1.00 . A A . 22 PHE CB 1 1 16 9806 1 1 22 PHE CD1 C -0.713 -2.181 4.124 1.00 . A A . 22 PHE CD1 1 1 16 9807 1 1 22 PHE CD2 C -1.102 -1.072 6.199 1.00 . A A . 22 PHE CD2 1 1 16 9808 1 1 22 PHE CE1 C 0.644 -1.953 4.252 1.00 . A A . 22 PHE CE1 1 1 16 9809 1 1 22 PHE CE2 C 0.254 -0.841 6.332 1.00 . A A . 22 PHE CE2 1 1 16 9810 1 1 22 PHE CG C -1.600 -1.744 5.094 1.00 . A A . 22 PHE CG 1 1 16 9811 1 1 22 PHE CZ C 1.128 -1.283 5.359 1.00 . A A . 22 PHE CZ 1 1 16 9812 1 1 22 PHE H H -2.911 -4.714 4.000 1.00 . A A . 22 PHE H 1 1 16 9813 1 1 22 PHE HA H -3.365 -3.365 6.568 1.00 . A A . 22 PHE HA 1 1 16 9814 1 1 22 PHE HB2 H -3.319 -1.940 3.901 1.00 . A A . 22 PHE HB2 1 1 16 9815 1 1 22 PHE HB3 H -3.598 -1.210 5.478 1.00 . A A . 22 PHE HB3 1 1 16 9816 1 1 22 PHE HD1 H -1.091 -2.706 3.258 1.00 . A A . 22 PHE HD1 1 1 16 9817 1 1 22 PHE HD2 H -1.784 -0.727 6.962 1.00 . A A . 22 PHE HD2 1 1 16 9818 1 1 22 PHE HE1 H 1.325 -2.300 3.489 1.00 . A A . 22 PHE HE1 1 1 16 9819 1 1 22 PHE HE2 H 0.630 -0.317 7.199 1.00 . A A . 22 PHE HE2 1 1 16 9820 1 1 22 PHE HZ H 2.188 -1.103 5.461 1.00 . A A . 22 PHE HZ 1 1 16 9821 1 1 22 PHE N N -2.721 -4.420 4.916 1.00 . A A . 22 PHE N 1 1 16 9822 1 1 22 PHE O O -5.383 -4.481 4.490 1.00 . A A . 22 PHE O 1 1 16 9823 1 1 23 SER C C -7.740 -1.931 4.444 1.00 . A A . 23 SER C 1 1 16 9824 1 1 23 SER CA C -7.284 -2.803 5.610 1.00 . A A . 23 SER CA 1 1 16 9825 1 1 23 SER CB C -8.013 -2.387 6.888 1.00 . A A . 23 SER CB 1 1 16 9826 1 1 23 SER H H -5.478 -1.995 6.364 1.00 . A A . 23 SER H 1 1 16 9827 1 1 23 SER HA H -7.522 -3.833 5.389 1.00 . A A . 23 SER HA 1 1 16 9828 1 1 23 SER HB2 H -9.069 -2.584 6.778 1.00 . A A . 23 SER HB2 1 1 16 9829 1 1 23 SER HB3 H -7.625 -2.954 7.722 1.00 . A A . 23 SER HB3 1 1 16 9830 1 1 23 SER HG H -7.399 -0.896 8.002 1.00 . A A . 23 SER HG 1 1 16 9831 1 1 23 SER N N -5.841 -2.707 5.796 1.00 . A A . 23 SER N 1 1 16 9832 1 1 23 SER O O -8.374 -2.413 3.504 1.00 . A A . 23 SER O 1 1 16 9833 1 1 23 SER OG O -7.832 -1.006 7.152 1.00 . A A . 23 SER OG 1 1 16 9834 1 1 24 HIS C C -6.552 0.850 2.761 1.00 . A A . 24 HIS C 1 1 16 9835 1 1 24 HIS CA C -7.789 0.296 3.461 1.00 . A A . 24 HIS CA 1 1 16 9836 1 1 24 HIS CB C -8.616 1.442 4.046 1.00 . A A . 24 HIS CB 1 1 16 9837 1 1 24 HIS CD2 C -8.894 3.898 3.259 1.00 . A A . 24 HIS CD2 1 1 16 9838 1 1 24 HIS CE1 C -9.293 3.512 1.138 1.00 . A A . 24 HIS CE1 1 1 16 9839 1 1 24 HIS CG C -8.862 2.557 3.077 1.00 . A A . 24 HIS CG 1 1 16 9840 1 1 24 HIS H H -6.908 -0.320 5.285 1.00 . A A . 24 HIS H 1 1 16 9841 1 1 24 HIS HA H -8.389 -0.236 2.738 1.00 . A A . 24 HIS HA 1 1 16 9842 1 1 24 HIS HB2 H -9.575 1.060 4.362 1.00 . A A . 24 HIS HB2 1 1 16 9843 1 1 24 HIS HB3 H -8.097 1.852 4.900 1.00 . A A . 24 HIS HB3 1 1 16 9844 1 1 24 HIS HD1 H -9.160 1.476 1.293 1.00 . A A . 24 HIS HD1 1 1 16 9845 1 1 24 HIS HD2 H -8.737 4.422 4.191 1.00 . A A . 24 HIS HD2 1 1 16 9846 1 1 24 HIS HE1 H -9.507 3.657 0.090 1.00 . A A . 24 HIS HE1 1 1 16 9847 1 1 24 HIS N N -7.414 -0.645 4.511 1.00 . A A . 24 HIS N 1 1 16 9848 1 1 24 HIS ND1 N -9.117 2.348 1.738 1.00 . A A . 24 HIS ND1 1 1 16 9849 1 1 24 HIS NE2 N -9.164 4.469 2.040 1.00 . A A . 24 HIS NE2 1 1 16 9850 1 1 24 HIS O O -5.530 1.108 3.396 1.00 . A A . 24 HIS O 1 1 16 9851 1 1 25 HIS C C -4.770 2.611 1.446 1.00 . A A . 25 HIS C 1 1 16 9852 1 1 25 HIS CA C -5.542 1.554 0.661 1.00 . A A . 25 HIS CA 1 1 16 9853 1 1 25 HIS CB C -6.055 2.150 -0.651 1.00 . A A . 25 HIS CB 1 1 16 9854 1 1 25 HIS CD2 C -4.397 3.275 -2.299 1.00 . A A . 25 HIS CD2 1 1 16 9855 1 1 25 HIS CE1 C -3.603 1.462 -3.242 1.00 . A A . 25 HIS CE1 1 1 16 9856 1 1 25 HIS CG C -5.014 2.215 -1.726 1.00 . A A . 25 HIS CG 1 1 16 9857 1 1 25 HIS H H -7.494 0.806 0.998 1.00 . A A . 25 HIS H 1 1 16 9858 1 1 25 HIS HA H -4.877 0.733 0.437 1.00 . A A . 25 HIS HA 1 1 16 9859 1 1 25 HIS HB2 H -6.873 1.547 -1.017 1.00 . A A . 25 HIS HB2 1 1 16 9860 1 1 25 HIS HB3 H -6.407 3.155 -0.468 1.00 . A A . 25 HIS HB3 1 1 16 9861 1 1 25 HIS HD1 H -4.743 0.167 -2.142 1.00 . A A . 25 HIS HD1 1 1 16 9862 1 1 25 HIS HD2 H -4.560 4.317 -2.062 1.00 . A A . 25 HIS HD2 1 1 16 9863 1 1 25 HIS HE1 H -3.034 0.798 -3.875 1.00 . A A . 25 HIS HE1 1 1 16 9864 1 1 25 HIS N N -6.653 1.031 1.448 1.00 . A A . 25 HIS N 1 1 16 9865 1 1 25 HIS ND1 N -4.495 1.094 -2.340 1.00 . A A . 25 HIS ND1 1 1 16 9866 1 1 25 HIS NE2 N -3.525 2.780 -3.237 1.00 . A A . 25 HIS NE2 1 1 16 9867 1 1 25 HIS O O -3.573 2.465 1.691 1.00 . A A . 25 HIS O 1 1 16 9868 1 1 26 ALA C C -3.729 4.227 3.490 1.00 . A A . 26 ALA C 1 1 16 9869 1 1 26 ALA CA C -4.845 4.754 2.595 1.00 . A A . 26 ALA CA 1 1 16 9870 1 1 26 ALA CB C -5.890 5.483 3.426 1.00 . A A . 26 ALA CB 1 1 16 9871 1 1 26 ALA H H -6.416 3.734 1.611 1.00 . A A . 26 ALA H 1 1 16 9872 1 1 26 ALA HA H -4.425 5.459 1.891 1.00 . A A . 26 ALA HA 1 1 16 9873 1 1 26 ALA HB1 H -6.156 6.409 2.939 1.00 . A A . 26 ALA HB1 1 1 16 9874 1 1 26 ALA HB2 H -6.769 4.862 3.523 1.00 . A A . 26 ALA HB2 1 1 16 9875 1 1 26 ALA HB3 H -5.488 5.694 4.406 1.00 . A A . 26 ALA HB3 1 1 16 9876 1 1 26 ALA N N -5.464 3.675 1.837 1.00 . A A . 26 ALA N 1 1 16 9877 1 1 26 ALA O O -2.553 4.513 3.267 1.00 . A A . 26 ALA O 1 1 16 9878 1 1 27 SER C C -1.852 2.496 4.713 1.00 . A A . 27 SER C 1 1 16 9879 1 1 27 SER CA C -3.136 2.891 5.437 1.00 . A A . 27 SER CA 1 1 16 9880 1 1 27 SER CB C -3.729 1.673 6.147 1.00 . A A . 27 SER CB 1 1 16 9881 1 1 27 SER H H -5.058 3.262 4.631 1.00 . A A . 27 SER H 1 1 16 9882 1 1 27 SER HA H -2.903 3.647 6.171 1.00 . A A . 27 SER HA 1 1 16 9883 1 1 27 SER HB2 H -4.800 1.787 6.220 1.00 . A A . 27 SER HB2 1 1 16 9884 1 1 27 SER HB3 H -3.499 0.782 5.581 1.00 . A A . 27 SER HB3 1 1 16 9885 1 1 27 SER HG H -2.303 1.886 7.473 1.00 . A A . 27 SER HG 1 1 16 9886 1 1 27 SER N N -4.105 3.455 4.505 1.00 . A A . 27 SER N 1 1 16 9887 1 1 27 SER O O -0.749 2.799 5.170 1.00 . A A . 27 SER O 1 1 16 9888 1 1 27 SER OG O -3.195 1.534 7.453 1.00 . A A . 27 SER OG 1 1 16 9889 1 1 28 LEU C C -0.209 2.561 2.073 1.00 . A A . 28 LEU C 1 1 16 9890 1 1 28 LEU CA C -0.857 1.381 2.791 1.00 . A A . 28 LEU CA 1 1 16 9891 1 1 28 LEU CB C -1.288 0.324 1.773 1.00 . A A . 28 LEU CB 1 1 16 9892 1 1 28 LEU CD1 C 1.016 -0.386 1.086 1.00 . A A . 28 LEU CD1 1 1 16 9893 1 1 28 LEU CD2 C -0.937 -0.891 -0.392 1.00 . A A . 28 LEU CD2 1 1 16 9894 1 1 28 LEU CG C -0.338 0.100 0.595 1.00 . A A . 28 LEU CG 1 1 16 9895 1 1 28 LEU H H -2.907 1.606 3.267 1.00 . A A . 28 LEU H 1 1 16 9896 1 1 28 LEU HA H -0.136 0.946 3.467 1.00 . A A . 28 LEU HA 1 1 16 9897 1 1 28 LEU HB2 H -1.393 -0.615 2.295 1.00 . A A . 28 LEU HB2 1 1 16 9898 1 1 28 LEU HB3 H -2.247 0.621 1.374 1.00 . A A . 28 LEU HB3 1 1 16 9899 1 1 28 LEU HD11 H 1.623 -0.675 0.241 1.00 . A A . 28 LEU HD11 1 1 16 9900 1 1 28 LEU HD12 H 0.878 -1.236 1.738 1.00 . A A . 28 LEU HD12 1 1 16 9901 1 1 28 LEU HD13 H 1.508 0.407 1.630 1.00 . A A . 28 LEU HD13 1 1 16 9902 1 1 28 LEU HD21 H -1.657 -1.515 0.116 1.00 . A A . 28 LEU HD21 1 1 16 9903 1 1 28 LEU HD22 H -0.152 -1.507 -0.804 1.00 . A A . 28 LEU HD22 1 1 16 9904 1 1 28 LEU HD23 H -1.428 -0.352 -1.190 1.00 . A A . 28 LEU HD23 1 1 16 9905 1 1 28 LEU HG H -0.188 1.039 0.079 1.00 . A A . 28 LEU HG 1 1 16 9906 1 1 28 LEU N N -2.004 1.818 3.580 1.00 . A A . 28 LEU N 1 1 16 9907 1 1 28 LEU O O 1.016 2.654 1.989 1.00 . A A . 28 LEU O 1 1 16 9908 1 1 29 THR C C 0.300 5.515 1.760 1.00 . A A . 29 THR C 1 1 16 9909 1 1 29 THR CA C -0.547 4.636 0.848 1.00 . A A . 29 THR CA 1 1 16 9910 1 1 29 THR CB C -1.707 5.475 0.278 1.00 . A A . 29 THR CB 1 1 16 9911 1 1 29 THR CG2 C -1.212 6.834 -0.191 1.00 . A A . 29 THR CG2 1 1 16 9912 1 1 29 THR H H -2.005 3.332 1.657 1.00 . A A . 29 THR H 1 1 16 9913 1 1 29 THR HA H 0.063 4.296 0.023 1.00 . A A . 29 THR HA 1 1 16 9914 1 1 29 THR HB H -2.440 5.625 1.058 1.00 . A A . 29 THR HB 1 1 16 9915 1 1 29 THR HG1 H -1.857 4.991 -1.628 1.00 . A A . 29 THR HG1 1 1 16 9916 1 1 29 THR HG21 H -1.686 7.610 0.391 1.00 . A A . 29 THR HG21 1 1 16 9917 1 1 29 THR HG22 H -1.457 6.967 -1.235 1.00 . A A . 29 THR HG22 1 1 16 9918 1 1 29 THR HG23 H -0.141 6.891 -0.063 1.00 . A A . 29 THR HG23 1 1 16 9919 1 1 29 THR N N -1.039 3.462 1.557 1.00 . A A . 29 THR N 1 1 16 9920 1 1 29 THR O O 1.461 5.795 1.464 1.00 . A A . 29 THR O 1 1 16 9921 1 1 29 THR OG1 O -2.322 4.782 -0.814 1.00 . A A . 29 THR OG1 1 1 16 9922 1 1 30 GLN C C 1.671 6.104 4.347 1.00 . A A . 30 GLN C 1 1 16 9923 1 1 30 GLN CA C 0.415 6.795 3.827 1.00 . A A . 30 GLN CA 1 1 16 9924 1 1 30 GLN CB C -0.505 7.153 4.996 1.00 . A A . 30 GLN CB 1 1 16 9925 1 1 30 GLN CD C -2.416 8.661 5.672 1.00 . A A . 30 GLN CD 1 1 16 9926 1 1 30 GLN CG C -1.799 7.826 4.567 1.00 . A A . 30 GLN CG 1 1 16 9927 1 1 30 GLN H H -1.216 5.690 3.052 1.00 . A A . 30 GLN H 1 1 16 9928 1 1 30 GLN HA H 0.702 7.701 3.317 1.00 . A A . 30 GLN HA 1 1 16 9929 1 1 30 GLN HB2 H -0.754 6.250 5.532 1.00 . A A . 30 GLN HB2 1 1 16 9930 1 1 30 GLN HB3 H 0.020 7.823 5.660 1.00 . A A . 30 GLN HB3 1 1 16 9931 1 1 30 GLN HE21 H -1.213 10.180 5.228 1.00 . A A . 30 GLN HE21 1 1 16 9932 1 1 30 GLN HE22 H -2.312 10.449 6.534 1.00 . A A . 30 GLN HE22 1 1 16 9933 1 1 30 GLN HG2 H -1.594 8.468 3.724 1.00 . A A . 30 GLN HG2 1 1 16 9934 1 1 30 GLN HG3 H -2.506 7.063 4.275 1.00 . A A . 30 GLN HG3 1 1 16 9935 1 1 30 GLN N N -0.288 5.947 2.871 1.00 . A A . 30 GLN N 1 1 16 9936 1 1 30 GLN NE2 N -1.931 9.887 5.828 1.00 . A A . 30 GLN NE2 1 1 16 9937 1 1 30 GLN O O 2.707 6.741 4.541 1.00 . A A . 30 GLN O 1 1 16 9938 1 1 30 GLN OE1 O -3.319 8.210 6.377 1.00 . A A . 30 GLN OE1 1 1 16 9939 1 1 31 HIS C C 3.867 4.064 4.084 1.00 . A A . 31 HIS C 1 1 16 9940 1 1 31 HIS CA C 2.702 4.019 5.067 1.00 . A A . 31 HIS CA 1 1 16 9941 1 1 31 HIS CB C 2.281 2.570 5.312 1.00 . A A . 31 HIS CB 1 1 16 9942 1 1 31 HIS CD2 C 3.817 0.703 4.372 1.00 . A A . 31 HIS CD2 1 1 16 9943 1 1 31 HIS CE1 C 5.218 0.563 6.053 1.00 . A A . 31 HIS CE1 1 1 16 9944 1 1 31 HIS CG C 3.426 1.605 5.303 1.00 . A A . 31 HIS CG 1 1 16 9945 1 1 31 HIS H H 0.721 4.346 4.396 1.00 . A A . 31 HIS H 1 1 16 9946 1 1 31 HIS HA H 3.019 4.456 6.002 1.00 . A A . 31 HIS HA 1 1 16 9947 1 1 31 HIS HB2 H 1.797 2.500 6.275 1.00 . A A . 31 HIS HB2 1 1 16 9948 1 1 31 HIS HB3 H 1.586 2.268 4.542 1.00 . A A . 31 HIS HB3 1 1 16 9949 1 1 31 HIS HD1 H 4.309 2.015 7.172 1.00 . A A . 31 HIS HD1 1 1 16 9950 1 1 31 HIS HD2 H 3.340 0.517 3.420 1.00 . A A . 31 HIS HD2 1 1 16 9951 1 1 31 HIS HE1 H 6.041 0.260 6.681 1.00 . A A . 31 HIS HE1 1 1 16 9952 1 1 31 HIS N N 1.573 4.797 4.570 1.00 . A A . 31 HIS N 1 1 16 9953 1 1 31 HIS ND1 N 4.324 1.491 6.344 1.00 . A A . 31 HIS ND1 1 1 16 9954 1 1 31 HIS NE2 N 4.932 0.069 4.862 1.00 . A A . 31 HIS NE2 1 1 16 9955 1 1 31 HIS O O 5.001 4.354 4.465 1.00 . A A . 31 HIS O 1 1 16 9956 1 1 32 GLN C C 5.646 4.862 2.053 1.00 . A A . 32 GLN C 1 1 16 9957 1 1 32 GLN CA C 4.605 3.781 1.782 1.00 . A A . 32 GLN CA 1 1 16 9958 1 1 32 GLN CB C 3.969 4.001 0.408 1.00 . A A . 32 GLN CB 1 1 16 9959 1 1 32 GLN CD C 3.348 2.819 -1.737 1.00 . A A . 32 GLN CD 1 1 16 9960 1 1 32 GLN CG C 3.436 2.726 -0.226 1.00 . A A . 32 GLN CG 1 1 16 9961 1 1 32 GLN H H 2.657 3.552 2.578 1.00 . A A . 32 GLN H 1 1 16 9962 1 1 32 GLN HA H 5.093 2.818 1.793 1.00 . A A . 32 GLN HA 1 1 16 9963 1 1 32 GLN HB2 H 3.150 4.697 0.511 1.00 . A A . 32 GLN HB2 1 1 16 9964 1 1 32 GLN HB3 H 4.710 4.424 -0.254 1.00 . A A . 32 GLN HB3 1 1 16 9965 1 1 32 GLN HE21 H 2.286 1.139 -1.803 1.00 . A A . 32 GLN HE21 1 1 16 9966 1 1 32 GLN HE22 H 2.608 1.885 -3.328 1.00 . A A . 32 GLN HE22 1 1 16 9967 1 1 32 GLN HG2 H 4.092 1.909 0.031 1.00 . A A . 32 GLN HG2 1 1 16 9968 1 1 32 GLN HG3 H 2.449 2.531 0.166 1.00 . A A . 32 GLN HG3 1 1 16 9969 1 1 32 GLN N N 3.579 3.775 2.819 1.00 . A A . 32 GLN N 1 1 16 9970 1 1 32 GLN NE2 N 2.681 1.850 -2.352 1.00 . A A . 32 GLN NE2 1 1 16 9971 1 1 32 GLN O O 6.834 4.671 1.794 1.00 . A A . 32 GLN O 1 1 16 9972 1 1 32 GLN OE1 O 3.875 3.751 -2.345 1.00 . A A . 32 GLN OE1 1 1 16 9973 1 1 33 ARG C C 7.371 6.611 3.531 1.00 . A A . 33 ARG C 1 1 16 9974 1 1 33 ARG CA C 6.085 7.109 2.878 1.00 . A A . 33 ARG CA 1 1 16 9975 1 1 33 ARG CB C 5.388 8.112 3.799 1.00 . A A . 33 ARG CB 1 1 16 9976 1 1 33 ARG CD C 4.020 10.213 3.981 1.00 . A A . 33 ARG CD 1 1 16 9977 1 1 33 ARG CG C 4.500 9.101 3.061 1.00 . A A . 33 ARG CG 1 1 16 9978 1 1 33 ARG CZ C 4.568 12.152 2.572 1.00 . A A . 33 ARG CZ 1 1 16 9979 1 1 33 ARG H H 4.234 6.089 2.758 1.00 . A A . 33 ARG H 1 1 16 9980 1 1 33 ARG HA H 6.333 7.598 1.948 1.00 . A A . 33 ARG HA 1 1 16 9981 1 1 33 ARG HB2 H 4.776 7.571 4.505 1.00 . A A . 33 ARG HB2 1 1 16 9982 1 1 33 ARG HB3 H 6.139 8.669 4.338 1.00 . A A . 33 ARG HB3 1 1 16 9983 1 1 33 ARG HD2 H 3.145 9.870 4.513 1.00 . A A . 33 ARG HD2 1 1 16 9984 1 1 33 ARG HD3 H 4.804 10.441 4.687 1.00 . A A . 33 ARG HD3 1 1 16 9985 1 1 33 ARG HE H 2.743 11.712 3.246 1.00 . A A . 33 ARG HE 1 1 16 9986 1 1 33 ARG HG2 H 5.061 9.539 2.249 1.00 . A A . 33 ARG HG2 1 1 16 9987 1 1 33 ARG HG3 H 3.643 8.576 2.667 1.00 . A A . 33 ARG HG3 1 1 16 9988 1 1 33 ARG HH11 H 6.137 10.967 3.035 1.00 . A A . 33 ARG HH11 1 1 16 9989 1 1 33 ARG HH12 H 6.509 12.337 2.042 1.00 . A A . 33 ARG HH12 1 1 16 9990 1 1 33 ARG HH21 H 3.220 13.520 1.940 1.00 . A A . 33 ARG HH21 1 1 16 9991 1 1 33 ARG HH22 H 4.850 13.789 1.421 1.00 . A A . 33 ARG HH22 1 1 16 9992 1 1 33 ARG N N 5.192 5.997 2.574 1.00 . A A . 33 ARG N 1 1 16 9993 1 1 33 ARG NE N 3.680 11.426 3.242 1.00 . A A . 33 ARG NE 1 1 16 9994 1 1 33 ARG NH1 N 5.843 11.789 2.548 1.00 . A A . 33 ARG NH1 1 1 16 9995 1 1 33 ARG NH2 N 4.181 13.243 1.924 1.00 . A A . 33 ARG NH2 1 1 16 9996 1 1 33 ARG O O 8.470 6.885 3.050 1.00 . A A . 33 ARG O 1 1 16 9997 1 1 34 VAL C C 9.488 4.944 4.387 1.00 . A A . 34 VAL C 1 1 16 9998 1 1 34 VAL CA C 8.374 5.341 5.349 1.00 . A A . 34 VAL CA 1 1 16 9999 1 1 34 VAL CB C 7.983 4.117 6.198 1.00 . A A . 34 VAL CB 1 1 16 10000 1 1 34 VAL CG1 C 6.948 4.501 7.245 1.00 . A A . 34 VAL CG1 1 1 16 10001 1 1 34 VAL CG2 C 7.465 2.996 5.309 1.00 . A A . 34 VAL CG2 1 1 16 10002 1 1 34 VAL H H 6.323 5.693 4.965 1.00 . A A . 34 VAL H 1 1 16 10003 1 1 34 VAL HA H 8.742 6.110 6.013 1.00 . A A . 34 VAL HA 1 1 16 10004 1 1 34 VAL HB H 8.866 3.762 6.710 1.00 . A A . 34 VAL HB 1 1 16 10005 1 1 34 VAL HG11 H 7.447 4.749 8.170 1.00 . A A . 34 VAL HG11 1 1 16 10006 1 1 34 VAL HG12 H 6.385 5.354 6.898 1.00 . A A . 34 VAL HG12 1 1 16 10007 1 1 34 VAL HG13 H 6.279 3.669 7.410 1.00 . A A . 34 VAL HG13 1 1 16 10008 1 1 34 VAL HG21 H 6.732 2.417 5.850 1.00 . A A . 34 VAL HG21 1 1 16 10009 1 1 34 VAL HG22 H 7.009 3.420 4.427 1.00 . A A . 34 VAL HG22 1 1 16 10010 1 1 34 VAL HG23 H 8.286 2.357 5.019 1.00 . A A . 34 VAL HG23 1 1 16 10011 1 1 34 VAL N N 7.225 5.878 4.630 1.00 . A A . 34 VAL N 1 1 16 10012 1 1 34 VAL O O 10.667 5.174 4.657 1.00 . A A . 34 VAL O 1 1 16 10013 1 1 35 HIS C C 10.361 5.042 1.267 1.00 . A A . 35 HIS C 1 1 16 10014 1 1 35 HIS CA C 10.073 3.919 2.258 1.00 . A A . 35 HIS CA 1 1 16 10015 1 1 35 HIS CB C 9.556 2.687 1.515 1.00 . A A . 35 HIS CB 1 1 16 10016 1 1 35 HIS CD2 C 7.703 1.116 2.423 1.00 . A A . 35 HIS CD2 1 1 16 10017 1 1 35 HIS CE1 C 8.832 0.206 4.068 1.00 . A A . 35 HIS CE1 1 1 16 10018 1 1 35 HIS CG C 8.943 1.658 2.414 1.00 . A A . 35 HIS CG 1 1 16 10019 1 1 35 HIS H H 8.152 4.192 3.104 1.00 . A A . 35 HIS H 1 1 16 10020 1 1 35 HIS HA H 10.989 3.662 2.768 1.00 . A A . 35 HIS HA 1 1 16 10021 1 1 35 HIS HB2 H 8.804 2.994 0.802 1.00 . A A . 35 HIS HB2 1 1 16 10022 1 1 35 HIS HB3 H 10.376 2.222 0.987 1.00 . A A . 35 HIS HB3 1 1 16 10023 1 1 35 HIS HD1 H 10.553 1.253 3.711 1.00 . A A . 35 HIS HD1 1 1 16 10024 1 1 35 HIS HD2 H 6.897 1.346 1.740 1.00 . A A . 35 HIS HD2 1 1 16 10025 1 1 35 HIS HE1 H 9.096 -0.403 4.919 1.00 . A A . 35 HIS HE1 1 1 16 10026 1 1 35 HIS N N 9.106 4.347 3.263 1.00 . A A . 35 HIS N 1 1 16 10027 1 1 35 HIS ND1 N 9.625 1.068 3.457 1.00 . A A . 35 HIS ND1 1 1 16 10028 1 1 35 HIS NE2 N 7.659 0.216 3.460 1.00 . A A . 35 HIS NE2 1 1 16 10029 1 1 35 HIS O O 11.517 5.323 0.950 1.00 . A A . 35 HIS O 1 1 16 10030 1 1 36 SER C C 10.701 7.583 0.101 1.00 . A A . 36 SER C 1 1 16 10031 1 1 36 SER CA C 9.440 6.771 -0.179 1.00 . A A . 36 SER CA 1 1 16 10032 1 1 36 SER CB C 8.212 7.682 -0.129 1.00 . A A . 36 SER CB 1 1 16 10033 1 1 36 SER H H 8.405 5.411 1.071 1.00 . A A . 36 SER H 1 1 16 10034 1 1 36 SER HA H 9.517 6.337 -1.165 1.00 . A A . 36 SER HA 1 1 16 10035 1 1 36 SER HB2 H 7.344 7.130 -0.457 1.00 . A A . 36 SER HB2 1 1 16 10036 1 1 36 SER HB3 H 8.060 8.022 0.885 1.00 . A A . 36 SER HB3 1 1 16 10037 1 1 36 SER HG H 8.828 8.546 -1.776 1.00 . A A . 36 SER HG 1 1 16 10038 1 1 36 SER N N 9.301 5.681 0.780 1.00 . A A . 36 SER N 1 1 16 10039 1 1 36 SER O O 11.584 7.692 -0.749 1.00 . A A . 36 SER O 1 1 16 10040 1 1 36 SER OG O 8.379 8.810 -0.969 1.00 . A A . 36 SER OG 1 1 16 10041 1 1 37 GLY C C 11.627 9.929 2.786 1.00 . A A . 37 GLY C 1 1 16 10042 1 1 37 GLY CA C 11.933 8.948 1.671 1.00 . A A . 37 GLY CA 1 1 16 10043 1 1 37 GLY H H 10.042 8.032 1.937 1.00 . A A . 37 GLY H 1 1 16 10044 1 1 37 GLY HA2 H 12.723 8.287 1.994 1.00 . A A . 37 GLY HA2 1 1 16 10045 1 1 37 GLY HA3 H 12.269 9.499 0.805 1.00 . A A . 37 GLY HA3 1 1 16 10046 1 1 37 GLY N N 10.777 8.153 1.300 1.00 . A A . 37 GLY N 1 1 16 10047 1 1 37 GLY O O 10.469 10.113 3.158 1.00 . A A . 37 GLY O 1 1 16 10048 1 1 38 GLU C C 13.111 12.873 4.022 1.00 . A A . 38 GLU C 1 1 16 10049 1 1 38 GLU CA C 12.505 11.524 4.401 1.00 . A A . 38 GLU CA 1 1 16 10050 1 1 38 GLU CB C 13.157 11.002 5.683 1.00 . A A . 38 GLU CB 1 1 16 10051 1 1 38 GLU CD C 15.266 10.174 6.800 1.00 . A A . 38 GLU CD 1 1 16 10052 1 1 38 GLU CG C 14.664 10.841 5.578 1.00 . A A . 38 GLU CG 1 1 16 10053 1 1 38 GLU H H 13.568 10.369 2.980 1.00 . A A . 38 GLU H 1 1 16 10054 1 1 38 GLU HA H 11.448 11.653 4.572 1.00 . A A . 38 GLU HA 1 1 16 10055 1 1 38 GLU HB2 H 12.944 11.692 6.487 1.00 . A A . 38 GLU HB2 1 1 16 10056 1 1 38 GLU HB3 H 12.729 10.040 5.924 1.00 . A A . 38 GLU HB3 1 1 16 10057 1 1 38 GLU HG2 H 14.890 10.239 4.711 1.00 . A A . 38 GLU HG2 1 1 16 10058 1 1 38 GLU HG3 H 15.111 11.818 5.463 1.00 . A A . 38 GLU HG3 1 1 16 10059 1 1 38 GLU N N 12.669 10.559 3.320 1.00 . A A . 38 GLU N 1 1 16 10060 1 1 38 GLU O O 14.300 12.970 3.719 1.00 . A A . 38 GLU O 1 1 16 10061 1 1 38 GLU OE1 O 14.795 10.453 7.922 1.00 . A A . 38 GLU OE1 1 1 16 10062 1 1 38 GLU OE2 O 16.209 9.373 6.633 1.00 . A A . 38 GLU OE2 1 1 16 10063 1 1 39 LYS C C 11.990 16.304 4.522 1.00 . A A . 39 LYS C 1 1 16 10064 1 1 39 LYS CA C 12.734 15.256 3.700 1.00 . A A . 39 LYS CA 1 1 16 10065 1 1 39 LYS CB C 12.528 15.523 2.207 1.00 . A A . 39 LYS CB 1 1 16 10066 1 1 39 LYS CD C 13.151 14.684 -0.077 1.00 . A A . 39 LYS CD 1 1 16 10067 1 1 39 LYS CE C 13.170 15.935 -0.942 1.00 . A A . 39 LYS CE 1 1 16 10068 1 1 39 LYS CG C 13.641 14.973 1.332 1.00 . A A . 39 LYS CG 1 1 16 10069 1 1 39 LYS H H 11.345 13.771 4.290 1.00 . A A . 39 LYS H 1 1 16 10070 1 1 39 LYS HA H 13.788 15.320 3.926 1.00 . A A . 39 LYS HA 1 1 16 10071 1 1 39 LYS HB2 H 11.598 15.069 1.898 1.00 . A A . 39 LYS HB2 1 1 16 10072 1 1 39 LYS HB3 H 12.468 16.590 2.049 1.00 . A A . 39 LYS HB3 1 1 16 10073 1 1 39 LYS HD2 H 13.792 13.940 -0.527 1.00 . A A . 39 LYS HD2 1 1 16 10074 1 1 39 LYS HD3 H 12.139 14.307 -0.027 1.00 . A A . 39 LYS HD3 1 1 16 10075 1 1 39 LYS HE2 H 12.283 16.514 -0.734 1.00 . A A . 39 LYS HE2 1 1 16 10076 1 1 39 LYS HE3 H 14.045 16.516 -0.692 1.00 . A A . 39 LYS HE3 1 1 16 10077 1 1 39 LYS HG2 H 14.439 15.699 1.282 1.00 . A A . 39 LYS HG2 1 1 16 10078 1 1 39 LYS HG3 H 14.012 14.057 1.770 1.00 . A A . 39 LYS HG3 1 1 16 10079 1 1 39 LYS HZ1 H 12.977 16.449 -2.957 1.00 . A A . 39 LYS HZ1 1 1 16 10080 1 1 39 LYS HZ2 H 12.510 14.861 -2.607 1.00 . A A . 39 LYS HZ2 1 1 16 10081 1 1 39 LYS HZ3 H 14.151 15.268 -2.661 1.00 . A A . 39 LYS HZ3 1 1 16 10082 1 1 39 LYS N N 12.283 13.912 4.040 1.00 . A A . 39 LYS N 1 1 16 10083 1 1 39 LYS NZ N 13.205 15.605 -2.394 1.00 . A A . 39 LYS NZ 1 1 16 10084 1 1 39 LYS O O 10.809 16.158 4.835 1.00 . A A . 39 LYS O 1 1 16 10085 1 1 40 PRO C C 11.096 19.289 4.877 1.00 . A A . 40 PRO C 1 1 16 10086 1 1 40 PRO CA C 12.121 18.482 5.666 1.00 . A A . 40 PRO CA 1 1 16 10087 1 1 40 PRO CB C 13.336 19.349 6.008 1.00 . A A . 40 PRO CB 1 1 16 10088 1 1 40 PRO CD C 14.108 17.628 4.540 1.00 . A A . 40 PRO CD 1 1 16 10089 1 1 40 PRO CG C 14.319 19.066 4.925 1.00 . A A . 40 PRO CG 1 1 16 10090 1 1 40 PRO HA H 11.668 18.119 6.578 1.00 . A A . 40 PRO HA 1 1 16 10091 1 1 40 PRO HB2 H 13.046 20.390 6.018 1.00 . A A . 40 PRO HB2 1 1 16 10092 1 1 40 PRO HB3 H 13.723 19.068 6.976 1.00 . A A . 40 PRO HB3 1 1 16 10093 1 1 40 PRO HD2 H 14.280 17.492 3.482 1.00 . A A . 40 PRO HD2 1 1 16 10094 1 1 40 PRO HD3 H 14.757 16.984 5.115 1.00 . A A . 40 PRO HD3 1 1 16 10095 1 1 40 PRO HG2 H 14.132 19.712 4.081 1.00 . A A . 40 PRO HG2 1 1 16 10096 1 1 40 PRO HG3 H 15.323 19.211 5.295 1.00 . A A . 40 PRO HG3 1 1 16 10097 1 1 40 PRO N N 12.696 17.388 4.878 1.00 . A A . 40 PRO N 1 1 16 10098 1 1 40 PRO O O 11.213 19.439 3.661 1.00 . A A . 40 PRO O 1 1 16 10099 1 1 41 SER C C 9.635 21.803 4.219 1.00 . A A . 41 SER C 1 1 16 10100 1 1 41 SER CA C 9.043 20.596 4.940 1.00 . A A . 41 SER CA 1 1 16 10101 1 1 41 SER CB C 8.021 21.058 5.980 1.00 . A A . 41 SER CB 1 1 16 10102 1 1 41 SER H H 10.053 19.652 6.544 1.00 . A A . 41 SER H 1 1 16 10103 1 1 41 SER HA H 8.548 19.966 4.216 1.00 . A A . 41 SER HA 1 1 16 10104 1 1 41 SER HB2 H 7.933 20.309 6.753 1.00 . A A . 41 SER HB2 1 1 16 10105 1 1 41 SER HB3 H 8.352 21.989 6.416 1.00 . A A . 41 SER HB3 1 1 16 10106 1 1 41 SER HG H 6.849 21.376 4.443 1.00 . A A . 41 SER HG 1 1 16 10107 1 1 41 SER N N 10.091 19.807 5.577 1.00 . A A . 41 SER N 1 1 16 10108 1 1 41 SER O O 10.645 22.361 4.645 1.00 . A A . 41 SER O 1 1 16 10109 1 1 41 SER OG O 6.748 21.257 5.390 1.00 . A A . 41 SER OG 1 1 16 10110 1 1 42 GLY C C 9.469 24.623 3.169 1.00 . A A . 42 GLY C 1 1 16 10111 1 1 42 GLY CA C 9.472 23.341 2.360 1.00 . A A . 42 GLY CA 1 1 16 10112 1 1 42 GLY H H 8.194 21.719 2.831 1.00 . A A . 42 GLY H 1 1 16 10113 1 1 42 GLY HA2 H 10.479 23.141 2.026 1.00 . A A . 42 GLY HA2 1 1 16 10114 1 1 42 GLY HA3 H 8.836 23.472 1.497 1.00 . A A . 42 GLY HA3 1 1 16 10115 1 1 42 GLY N N 8.996 22.202 3.124 1.00 . A A . 42 GLY N 1 1 16 10116 1 1 42 GLY O O 9.002 24.663 4.308 1.00 . A A . 42 GLY O 1 1 16 10117 1 1 43 PRO C C 8.698 27.655 3.390 1.00 . A A . 43 PRO C 1 1 16 10118 1 1 43 PRO CA C 10.071 27.011 3.232 1.00 . A A . 43 PRO CA 1 1 16 10119 1 1 43 PRO CB C 10.943 27.837 2.282 1.00 . A A . 43 PRO CB 1 1 16 10120 1 1 43 PRO CD C 10.576 25.727 1.221 1.00 . A A . 43 PRO CD 1 1 16 10121 1 1 43 PRO CG C 10.766 27.194 0.950 1.00 . A A . 43 PRO CG 1 1 16 10122 1 1 43 PRO HA H 10.550 26.946 4.198 1.00 . A A . 43 PRO HA 1 1 16 10123 1 1 43 PRO HB2 H 10.600 28.863 2.275 1.00 . A A . 43 PRO HB2 1 1 16 10124 1 1 43 PRO HB3 H 11.972 27.798 2.606 1.00 . A A . 43 PRO HB3 1 1 16 10125 1 1 43 PRO HD2 H 9.892 25.297 0.504 1.00 . A A . 43 PRO HD2 1 1 16 10126 1 1 43 PRO HD3 H 11.525 25.213 1.195 1.00 . A A . 43 PRO HD3 1 1 16 10127 1 1 43 PRO HG2 H 9.896 27.601 0.458 1.00 . A A . 43 PRO HG2 1 1 16 10128 1 1 43 PRO HG3 H 11.648 27.352 0.347 1.00 . A A . 43 PRO HG3 1 1 16 10129 1 1 43 PRO N N 10.001 25.702 2.576 1.00 . A A . 43 PRO N 1 1 16 10130 1 1 43 PRO O O 8.566 28.719 3.995 1.00 . A A . 43 PRO O 1 1 16 10131 1 1 44 SER C C 5.951 27.879 4.356 1.00 . A A . 44 SER C 1 1 16 10132 1 1 44 SER CA C 6.313 27.513 2.920 1.00 . A A . 44 SER CA 1 1 16 10133 1 1 44 SER CB C 5.326 26.475 2.382 1.00 . A A . 44 SER CB 1 1 16 10134 1 1 44 SER H H 7.846 26.158 2.373 1.00 . A A . 44 SER H 1 1 16 10135 1 1 44 SER HA H 6.257 28.401 2.309 1.00 . A A . 44 SER HA 1 1 16 10136 1 1 44 SER HB2 H 5.551 25.511 2.813 1.00 . A A . 44 SER HB2 1 1 16 10137 1 1 44 SER HB3 H 4.321 26.765 2.651 1.00 . A A . 44 SER HB3 1 1 16 10138 1 1 44 SER HG H 5.815 25.537 0.733 1.00 . A A . 44 SER HG 1 1 16 10139 1 1 44 SER N N 7.677 27.002 2.843 1.00 . A A . 44 SER N 1 1 16 10140 1 1 44 SER O O 5.609 29.025 4.649 1.00 . A A . 44 SER O 1 1 16 10141 1 1 44 SER OG O 5.411 26.375 0.971 1.00 . A A . 44 SER OG 1 1 16 10142 1 1 45 SER C C 4.233 27.468 6.824 1.00 . A A . 45 SER C 1 1 16 10143 1 1 45 SER CA C 5.707 27.113 6.654 1.00 . A A . 45 SER CA 1 1 16 10144 1 1 45 SER CB C 6.581 28.226 7.234 1.00 . A A . 45 SER CB 1 1 16 10145 1 1 45 SER H H 6.309 26.005 4.953 1.00 . A A . 45 SER H 1 1 16 10146 1 1 45 SER HA H 5.908 26.195 7.185 1.00 . A A . 45 SER HA 1 1 16 10147 1 1 45 SER HB2 H 7.621 27.965 7.111 1.00 . A A . 45 SER HB2 1 1 16 10148 1 1 45 SER HB3 H 6.378 29.150 6.711 1.00 . A A . 45 SER HB3 1 1 16 10149 1 1 45 SER HG H 5.418 28.142 8.808 1.00 . A A . 45 SER HG 1 1 16 10150 1 1 45 SER N N 6.029 26.897 5.248 1.00 . A A . 45 SER N 1 1 16 10151 1 1 45 SER O O 3.885 28.385 7.567 1.00 . A A . 45 SER O 1 1 16 10152 1 1 45 SER OG O 6.318 28.415 8.614 1.00 . A A . 45 SER OG 1 1 16 10153 1 1 46 GLY C C 1.458 27.088 7.649 1.00 . A A . 46 GLY C 1 1 16 10154 1 1 46 GLY CA C 1.943 26.985 6.216 1.00 . A A . 46 GLY CA 1 1 16 10155 1 1 46 GLY H H 3.704 26.015 5.552 1.00 . A A . 46 GLY H 1 1 16 10156 1 1 46 GLY HA2 H 1.719 27.909 5.704 1.00 . A A . 46 GLY HA2 1 1 16 10157 1 1 46 GLY HA3 H 1.416 26.178 5.728 1.00 . A A . 46 GLY HA3 1 1 16 10158 1 1 46 GLY N N 3.369 26.734 6.129 1.00 . A A . 46 GLY N 1 1 16 10159 1 1 46 GLY O O 0.678 27.989 7.953 1.00 . A A . 46 GLY O 1 1 16 10160 2 2 1 ZN ZN ZN 6.178 -1.051 3.594 1.00 . B A . 181 ZN ZN 1 1 17 10161 1 1 1 GLY C C -24.561 -13.444 4.519 1.00 . A A . 1 GLY C 1 1 17 10162 1 1 1 GLY CA C -25.828 -14.179 4.130 1.00 . A A . 1 GLY CA 1 1 17 10163 1 1 1 GLY H1 H -27.333 -13.384 2.870 1.00 . A A . 1 GLY H1 1 1 17 10164 1 1 1 GLY HA2 H -26.555 -14.066 4.920 1.00 . A A . 1 GLY HA2 1 1 17 10165 1 1 1 GLY HA3 H -25.599 -15.228 4.012 1.00 . A A . 1 GLY HA3 1 1 17 10166 1 1 1 GLY N N -26.400 -13.683 2.891 1.00 . A A . 1 GLY N 1 1 17 10167 1 1 1 GLY O O -23.944 -12.774 3.690 1.00 . A A . 1 GLY O 1 1 17 10168 1 1 2 SER C C -22.185 -13.827 7.206 1.00 . A A . 2 SER C 1 1 17 10169 1 1 2 SER CA C -22.974 -12.902 6.284 1.00 . A A . 2 SER CA 1 1 17 10170 1 1 2 SER CB C -23.349 -11.620 7.029 1.00 . A A . 2 SER CB 1 1 17 10171 1 1 2 SER H H -24.707 -14.114 6.397 1.00 . A A . 2 SER H 1 1 17 10172 1 1 2 SER HA H -22.358 -12.649 5.434 1.00 . A A . 2 SER HA 1 1 17 10173 1 1 2 SER HB2 H -24.113 -11.096 6.476 1.00 . A A . 2 SER HB2 1 1 17 10174 1 1 2 SER HB3 H -23.723 -11.873 8.010 1.00 . A A . 2 SER HB3 1 1 17 10175 1 1 2 SER HG H -21.598 -10.942 6.468 1.00 . A A . 2 SER HG 1 1 17 10176 1 1 2 SER N N -24.173 -13.566 5.784 1.00 . A A . 2 SER N 1 1 17 10177 1 1 2 SER O O -22.652 -14.193 8.284 1.00 . A A . 2 SER O 1 1 17 10178 1 1 2 SER OG O -22.225 -10.768 7.174 1.00 . A A . 2 SER OG 1 1 17 10179 1 1 3 SER C C -18.692 -14.585 7.566 1.00 . A A . 3 SER C 1 1 17 10180 1 1 3 SER CA C -20.133 -15.088 7.555 1.00 . A A . 3 SER CA 1 1 17 10181 1 1 3 SER CB C -20.184 -16.510 6.993 1.00 . A A . 3 SER CB 1 1 17 10182 1 1 3 SER H H -20.670 -13.878 5.903 1.00 . A A . 3 SER H 1 1 17 10183 1 1 3 SER HA H -20.506 -15.097 8.568 1.00 . A A . 3 SER HA 1 1 17 10184 1 1 3 SER HB2 H -19.474 -17.129 7.519 1.00 . A A . 3 SER HB2 1 1 17 10185 1 1 3 SER HB3 H -21.179 -16.911 7.125 1.00 . A A . 3 SER HB3 1 1 17 10186 1 1 3 SER HG H -18.951 -16.791 5.496 1.00 . A A . 3 SER HG 1 1 17 10187 1 1 3 SER N N -20.986 -14.203 6.772 1.00 . A A . 3 SER N 1 1 17 10188 1 1 3 SER O O -18.136 -14.240 6.524 1.00 . A A . 3 SER O 1 1 17 10189 1 1 3 SER OG O -19.866 -16.524 5.612 1.00 . A A . 3 SER OG 1 1 17 10190 1 1 4 GLY C C -15.717 -15.209 8.732 1.00 . A A . 4 GLY C 1 1 17 10191 1 1 4 GLY CA C -16.724 -14.085 8.878 1.00 . A A . 4 GLY CA 1 1 17 10192 1 1 4 GLY H H -18.587 -14.835 9.549 1.00 . A A . 4 GLY H 1 1 17 10193 1 1 4 GLY HA2 H -16.534 -13.345 8.115 1.00 . A A . 4 GLY HA2 1 1 17 10194 1 1 4 GLY HA3 H -16.598 -13.628 9.849 1.00 . A A . 4 GLY HA3 1 1 17 10195 1 1 4 GLY N N -18.094 -14.547 8.752 1.00 . A A . 4 GLY N 1 1 17 10196 1 1 4 GLY O O -14.884 -15.423 9.612 1.00 . A A . 4 GLY O 1 1 17 10197 1 1 5 SER C C -13.988 -16.745 6.166 1.00 . A A . 5 SER C 1 1 17 10198 1 1 5 SER CA C -14.887 -17.042 7.362 1.00 . A A . 5 SER CA 1 1 17 10199 1 1 5 SER CB C -15.678 -18.327 7.113 1.00 . A A . 5 SER CB 1 1 17 10200 1 1 5 SER H H -16.481 -15.710 6.954 1.00 . A A . 5 SER H 1 1 17 10201 1 1 5 SER HA H -14.269 -17.174 8.238 1.00 . A A . 5 SER HA 1 1 17 10202 1 1 5 SER HB2 H -16.285 -18.547 7.978 1.00 . A A . 5 SER HB2 1 1 17 10203 1 1 5 SER HB3 H -16.315 -18.193 6.251 1.00 . A A . 5 SER HB3 1 1 17 10204 1 1 5 SER HG H -15.315 -20.239 6.888 1.00 . A A . 5 SER HG 1 1 17 10205 1 1 5 SER N N -15.795 -15.930 7.618 1.00 . A A . 5 SER N 1 1 17 10206 1 1 5 SER O O -12.765 -16.863 6.250 1.00 . A A . 5 SER O 1 1 17 10207 1 1 5 SER OG O -14.811 -19.422 6.874 1.00 . A A . 5 SER OG 1 1 17 10208 1 1 6 SER C C -14.559 -14.954 3.038 1.00 . A A . 6 SER C 1 1 17 10209 1 1 6 SER CA C -13.859 -16.048 3.838 1.00 . A A . 6 SER CA 1 1 17 10210 1 1 6 SER CB C -13.701 -17.303 2.977 1.00 . A A . 6 SER CB 1 1 17 10211 1 1 6 SER H H -15.580 -16.284 5.049 1.00 . A A . 6 SER H 1 1 17 10212 1 1 6 SER HA H -12.881 -15.696 4.128 1.00 . A A . 6 SER HA 1 1 17 10213 1 1 6 SER HB2 H -14.652 -17.807 2.901 1.00 . A A . 6 SER HB2 1 1 17 10214 1 1 6 SER HB3 H -13.365 -17.019 1.990 1.00 . A A . 6 SER HB3 1 1 17 10215 1 1 6 SER HG H -12.128 -17.700 4.075 1.00 . A A . 6 SER HG 1 1 17 10216 1 1 6 SER N N -14.603 -16.359 5.053 1.00 . A A . 6 SER N 1 1 17 10217 1 1 6 SER O O -15.754 -14.715 3.204 1.00 . A A . 6 SER O 1 1 17 10218 1 1 6 SER OG O -12.755 -18.194 3.542 1.00 . A A . 6 SER OG 1 1 17 10219 1 1 7 GLY C C -14.887 -12.074 2.188 1.00 . A A . 7 GLY C 1 1 17 10220 1 1 7 GLY CA C -14.367 -13.228 1.354 1.00 . A A . 7 GLY CA 1 1 17 10221 1 1 7 GLY H H -12.856 -14.524 2.077 1.00 . A A . 7 GLY H 1 1 17 10222 1 1 7 GLY HA2 H -13.604 -12.860 0.684 1.00 . A A . 7 GLY HA2 1 1 17 10223 1 1 7 GLY HA3 H -15.181 -13.632 0.771 1.00 . A A . 7 GLY HA3 1 1 17 10224 1 1 7 GLY N N -13.803 -14.290 2.168 1.00 . A A . 7 GLY N 1 1 17 10225 1 1 7 GLY O O -15.992 -11.582 1.960 1.00 . A A . 7 GLY O 1 1 17 10226 1 1 8 THR C C -13.254 -9.769 4.519 1.00 . A A . 8 THR C 1 1 17 10227 1 1 8 THR CA C -14.476 -10.538 4.031 1.00 . A A . 8 THR CA 1 1 17 10228 1 1 8 THR CB C -15.273 -11.040 5.249 1.00 . A A . 8 THR CB 1 1 17 10229 1 1 8 THR CG2 C -15.722 -9.875 6.119 1.00 . A A . 8 THR CG2 1 1 17 10230 1 1 8 THR H H -13.220 -12.073 3.291 1.00 . A A . 8 THR H 1 1 17 10231 1 1 8 THR HA H -15.107 -9.870 3.464 1.00 . A A . 8 THR HA 1 1 17 10232 1 1 8 THR HB H -14.635 -11.684 5.837 1.00 . A A . 8 THR HB 1 1 17 10233 1 1 8 THR HG1 H -17.008 -11.207 4.326 1.00 . A A . 8 THR HG1 1 1 17 10234 1 1 8 THR HG21 H -16.213 -10.254 7.002 1.00 . A A . 8 THR HG21 1 1 17 10235 1 1 8 THR HG22 H -16.409 -9.255 5.563 1.00 . A A . 8 THR HG22 1 1 17 10236 1 1 8 THR HG23 H -14.862 -9.290 6.409 1.00 . A A . 8 THR HG23 1 1 17 10237 1 1 8 THR N N -14.089 -11.640 3.158 1.00 . A A . 8 THR N 1 1 17 10238 1 1 8 THR O O -12.324 -10.350 5.076 1.00 . A A . 8 THR O 1 1 17 10239 1 1 8 THR OG1 O -16.416 -11.785 4.814 1.00 . A A . 8 THR OG1 1 1 17 10240 1 1 9 GLY C C -10.807 -8.263 4.432 1.00 . A A . 9 GLY C 1 1 17 10241 1 1 9 GLY CA C -12.150 -7.628 4.732 1.00 . A A . 9 GLY CA 1 1 17 10242 1 1 9 GLY H H -14.032 -8.047 3.858 1.00 . A A . 9 GLY H 1 1 17 10243 1 1 9 GLY HA2 H -12.208 -6.677 4.225 1.00 . A A . 9 GLY HA2 1 1 17 10244 1 1 9 GLY HA3 H -12.226 -7.461 5.797 1.00 . A A . 9 GLY HA3 1 1 17 10245 1 1 9 GLY N N -13.263 -8.456 4.307 1.00 . A A . 9 GLY N 1 1 17 10246 1 1 9 GLY O O -9.944 -8.346 5.305 1.00 . A A . 9 GLY O 1 1 17 10247 1 1 10 GLU C C -8.224 -8.358 2.846 1.00 . A A . 10 GLU C 1 1 17 10248 1 1 10 GLU CA C -9.383 -9.348 2.783 1.00 . A A . 10 GLU CA 1 1 17 10249 1 1 10 GLU CB C -9.513 -9.908 1.365 1.00 . A A . 10 GLU CB 1 1 17 10250 1 1 10 GLU CD C -8.595 -11.552 -0.319 1.00 . A A . 10 GLU CD 1 1 17 10251 1 1 10 GLU CG C -8.313 -10.728 0.922 1.00 . A A . 10 GLU CG 1 1 17 10252 1 1 10 GLU H H -11.356 -8.619 2.543 1.00 . A A . 10 GLU H 1 1 17 10253 1 1 10 GLU HA H -9.184 -10.161 3.464 1.00 . A A . 10 GLU HA 1 1 17 10254 1 1 10 GLU HB2 H -10.390 -10.537 1.318 1.00 . A A . 10 GLU HB2 1 1 17 10255 1 1 10 GLU HB3 H -9.635 -9.085 0.676 1.00 . A A . 10 GLU HB3 1 1 17 10256 1 1 10 GLU HG2 H -7.493 -10.057 0.711 1.00 . A A . 10 GLU HG2 1 1 17 10257 1 1 10 GLU HG3 H -8.033 -11.395 1.724 1.00 . A A . 10 GLU HG3 1 1 17 10258 1 1 10 GLU N N -10.631 -8.714 3.194 1.00 . A A . 10 GLU N 1 1 17 10259 1 1 10 GLU O O -8.424 -7.161 3.054 1.00 . A A . 10 GLU O 1 1 17 10260 1 1 10 GLU OE1 O -9.683 -12.160 -0.393 1.00 . A A . 10 GLU OE1 1 1 17 10261 1 1 10 GLU OE2 O -7.727 -11.588 -1.216 1.00 . A A . 10 GLU OE2 1 1 17 10262 1 1 11 LYS C C -5.118 -8.019 1.344 1.00 . A A . 11 LYS C 1 1 17 10263 1 1 11 LYS CA C -5.816 -8.028 2.701 1.00 . A A . 11 LYS CA 1 1 17 10264 1 1 11 LYS CB C -4.851 -8.525 3.779 1.00 . A A . 11 LYS CB 1 1 17 10265 1 1 11 LYS CD C -3.673 -10.478 4.833 1.00 . A A . 11 LYS CD 1 1 17 10266 1 1 11 LYS CE C -4.242 -10.676 6.230 1.00 . A A . 11 LYS CE 1 1 17 10267 1 1 11 LYS CG C -4.747 -10.039 3.852 1.00 . A A . 11 LYS CG 1 1 17 10268 1 1 11 LYS H H -6.913 -9.828 2.504 1.00 . A A . 11 LYS H 1 1 17 10269 1 1 11 LYS HA H -6.124 -7.022 2.941 1.00 . A A . 11 LYS HA 1 1 17 10270 1 1 11 LYS HB2 H -3.868 -8.127 3.577 1.00 . A A . 11 LYS HB2 1 1 17 10271 1 1 11 LYS HB3 H -5.186 -8.162 4.740 1.00 . A A . 11 LYS HB3 1 1 17 10272 1 1 11 LYS HD2 H -3.247 -11.411 4.494 1.00 . A A . 11 LYS HD2 1 1 17 10273 1 1 11 LYS HD3 H -2.902 -9.721 4.872 1.00 . A A . 11 LYS HD3 1 1 17 10274 1 1 11 LYS HE2 H -3.436 -10.613 6.945 1.00 . A A . 11 LYS HE2 1 1 17 10275 1 1 11 LYS HE3 H -4.960 -9.894 6.426 1.00 . A A . 11 LYS HE3 1 1 17 10276 1 1 11 LYS HG2 H -5.697 -10.442 4.171 1.00 . A A . 11 LYS HG2 1 1 17 10277 1 1 11 LYS HG3 H -4.503 -10.421 2.870 1.00 . A A . 11 LYS HG3 1 1 17 10278 1 1 11 LYS HZ1 H -4.380 -12.601 7.030 1.00 . A A . 11 LYS HZ1 1 1 17 10279 1 1 11 LYS HZ2 H -4.966 -12.473 5.448 1.00 . A A . 11 LYS HZ2 1 1 17 10280 1 1 11 LYS HZ3 H -5.878 -11.871 6.740 1.00 . A A . 11 LYS HZ3 1 1 17 10281 1 1 11 LYS N N -7.009 -8.866 2.666 1.00 . A A . 11 LYS N 1 1 17 10282 1 1 11 LYS NZ N -4.913 -11.998 6.372 1.00 . A A . 11 LYS NZ 1 1 17 10283 1 1 11 LYS O O -3.934 -8.334 1.227 1.00 . A A . 11 LYS O 1 1 17 10284 1 1 12 PRO C C -4.341 -6.448 -1.256 1.00 . A A . 12 PRO C 1 1 17 10285 1 1 12 PRO CA C -5.340 -7.585 -1.071 1.00 . A A . 12 PRO CA 1 1 17 10286 1 1 12 PRO CB C -6.589 -7.344 -1.922 1.00 . A A . 12 PRO CB 1 1 17 10287 1 1 12 PRO CD C -7.285 -7.258 0.363 1.00 . A A . 12 PRO CD 1 1 17 10288 1 1 12 PRO CG C -7.554 -6.682 -1.000 1.00 . A A . 12 PRO CG 1 1 17 10289 1 1 12 PRO HA H -4.879 -8.518 -1.361 1.00 . A A . 12 PRO HA 1 1 17 10290 1 1 12 PRO HB2 H -6.339 -6.706 -2.759 1.00 . A A . 12 PRO HB2 1 1 17 10291 1 1 12 PRO HB3 H -6.971 -8.287 -2.283 1.00 . A A . 12 PRO HB3 1 1 17 10292 1 1 12 PRO HD2 H -7.445 -6.511 1.126 1.00 . A A . 12 PRO HD2 1 1 17 10293 1 1 12 PRO HD3 H -7.913 -8.119 0.538 1.00 . A A . 12 PRO HD3 1 1 17 10294 1 1 12 PRO HG2 H -7.386 -5.616 -0.997 1.00 . A A . 12 PRO HG2 1 1 17 10295 1 1 12 PRO HG3 H -8.565 -6.903 -1.308 1.00 . A A . 12 PRO HG3 1 1 17 10296 1 1 12 PRO N N -5.867 -7.647 0.295 1.00 . A A . 12 PRO N 1 1 17 10297 1 1 12 PRO O O -3.840 -6.221 -2.358 1.00 . A A . 12 PRO O 1 1 17 10298 1 1 13 TYR C C -1.816 -4.974 0.500 1.00 . A A . 13 TYR C 1 1 17 10299 1 1 13 TYR CA C -3.117 -4.620 -0.215 1.00 . A A . 13 TYR CA 1 1 17 10300 1 1 13 TYR CB C -3.740 -3.377 0.421 1.00 . A A . 13 TYR CB 1 1 17 10301 1 1 13 TYR CD1 C -5.344 -2.295 -1.203 1.00 . A A . 13 TYR CD1 1 1 17 10302 1 1 13 TYR CD2 C -6.252 -3.584 0.585 1.00 . A A . 13 TYR CD2 1 1 17 10303 1 1 13 TYR CE1 C -6.619 -2.020 -1.658 1.00 . A A . 13 TYR CE1 1 1 17 10304 1 1 13 TYR CE2 C -7.530 -3.316 0.136 1.00 . A A . 13 TYR CE2 1 1 17 10305 1 1 13 TYR CG C -5.138 -3.079 -0.075 1.00 . A A . 13 TYR CG 1 1 17 10306 1 1 13 TYR CZ C -7.709 -2.533 -0.986 1.00 . A A . 13 TYR CZ 1 1 17 10307 1 1 13 TYR H H -4.486 -5.964 0.678 1.00 . A A . 13 TYR H 1 1 17 10308 1 1 13 TYR HA H -2.898 -4.411 -1.252 1.00 . A A . 13 TYR HA 1 1 17 10309 1 1 13 TYR HB2 H -3.791 -3.514 1.490 1.00 . A A . 13 TYR HB2 1 1 17 10310 1 1 13 TYR HB3 H -3.121 -2.520 0.201 1.00 . A A . 13 TYR HB3 1 1 17 10311 1 1 13 TYR HD1 H -4.488 -1.895 -1.727 1.00 . A A . 13 TYR HD1 1 1 17 10312 1 1 13 TYR HD2 H -6.109 -4.197 1.463 1.00 . A A . 13 TYR HD2 1 1 17 10313 1 1 13 TYR HE1 H -6.759 -1.407 -2.536 1.00 . A A . 13 TYR HE1 1 1 17 10314 1 1 13 TYR HE2 H -8.384 -3.717 0.662 1.00 . A A . 13 TYR HE2 1 1 17 10315 1 1 13 TYR HH H -8.982 -2.246 -2.397 1.00 . A A . 13 TYR HH 1 1 17 10316 1 1 13 TYR N N -4.055 -5.736 -0.172 1.00 . A A . 13 TYR N 1 1 17 10317 1 1 13 TYR O O -1.791 -5.132 1.720 1.00 . A A . 13 TYR O 1 1 17 10318 1 1 13 TYR OH O -8.980 -2.263 -1.437 1.00 . A A . 13 TYR OH 1 1 17 10319 1 1 14 GLU C C 1.629 -4.442 -0.180 1.00 . A A . 14 GLU C 1 1 17 10320 1 1 14 GLU CA C 0.565 -5.430 0.291 1.00 . A A . 14 GLU CA 1 1 17 10321 1 1 14 GLU CB C 0.964 -6.853 -0.104 1.00 . A A . 14 GLU CB 1 1 17 10322 1 1 14 GLU CD C 2.807 -8.581 -0.110 1.00 . A A . 14 GLU CD 1 1 17 10323 1 1 14 GLU CG C 2.263 -7.319 0.531 1.00 . A A . 14 GLU CG 1 1 17 10324 1 1 14 GLU H H -0.823 -4.957 -1.236 1.00 . A A . 14 GLU H 1 1 17 10325 1 1 14 GLU HA H 0.489 -5.373 1.366 1.00 . A A . 14 GLU HA 1 1 17 10326 1 1 14 GLU HB2 H 0.178 -7.531 0.194 1.00 . A A . 14 GLU HB2 1 1 17 10327 1 1 14 GLU HB3 H 1.077 -6.897 -1.177 1.00 . A A . 14 GLU HB3 1 1 17 10328 1 1 14 GLU HG2 H 3.000 -6.537 0.430 1.00 . A A . 14 GLU HG2 1 1 17 10329 1 1 14 GLU HG3 H 2.088 -7.513 1.579 1.00 . A A . 14 GLU HG3 1 1 17 10330 1 1 14 GLU N N -0.739 -5.095 -0.269 1.00 . A A . 14 GLU N 1 1 17 10331 1 1 14 GLU O O 1.570 -3.937 -1.301 1.00 . A A . 14 GLU O 1 1 17 10332 1 1 14 GLU OE1 O 3.510 -8.471 -1.136 1.00 . A A . 14 GLU OE1 1 1 17 10333 1 1 14 GLU OE2 O 2.529 -9.680 0.414 1.00 . A A . 14 GLU OE2 1 1 17 10334 1 1 15 CYS C C 4.775 -3.943 -0.436 1.00 . A A . 15 CYS C 1 1 17 10335 1 1 15 CYS CA C 3.678 -3.245 0.361 1.00 . A A . 15 CYS CA 1 1 17 10336 1 1 15 CYS CB C 4.265 -2.644 1.640 1.00 . A A . 15 CYS CB 1 1 17 10337 1 1 15 CYS H H 2.593 -4.606 1.565 1.00 . A A . 15 CYS H 1 1 17 10338 1 1 15 CYS HA H 3.262 -2.451 -0.241 1.00 . A A . 15 CYS HA 1 1 17 10339 1 1 15 CYS HB2 H 3.457 -2.317 2.279 1.00 . A A . 15 CYS HB2 1 1 17 10340 1 1 15 CYS HB3 H 4.838 -3.402 2.154 1.00 . A A . 15 CYS HB3 1 1 17 10341 1 1 15 CYS N N 2.600 -4.172 0.686 1.00 . A A . 15 CYS N 1 1 17 10342 1 1 15 CYS O O 5.241 -5.019 -0.060 1.00 . A A . 15 CYS O 1 1 17 10343 1 1 15 CYS SG S 5.359 -1.216 1.357 1.00 . A A . 15 CYS SG 1 1 17 10344 1 1 16 ASP C C 7.610 -3.454 -1.907 1.00 . A A . 16 ASP C 1 1 17 10345 1 1 16 ASP CA C 6.227 -3.885 -2.388 1.00 . A A . 16 ASP CA 1 1 17 10346 1 1 16 ASP CB C 6.020 -3.451 -3.840 1.00 . A A . 16 ASP CB 1 1 17 10347 1 1 16 ASP CG C 5.006 -4.315 -4.564 1.00 . A A . 16 ASP CG 1 1 17 10348 1 1 16 ASP H H 4.774 -2.468 -1.785 1.00 . A A . 16 ASP H 1 1 17 10349 1 1 16 ASP HA H 6.159 -4.961 -2.331 1.00 . A A . 16 ASP HA 1 1 17 10350 1 1 16 ASP HB2 H 5.671 -2.428 -3.857 1.00 . A A . 16 ASP HB2 1 1 17 10351 1 1 16 ASP HB3 H 6.962 -3.514 -4.366 1.00 . A A . 16 ASP HB3 1 1 17 10352 1 1 16 ASP N N 5.184 -3.324 -1.538 1.00 . A A . 16 ASP N 1 1 17 10353 1 1 16 ASP O O 8.583 -3.501 -2.660 1.00 . A A . 16 ASP O 1 1 17 10354 1 1 16 ASP OD1 O 3.817 -4.279 -4.184 1.00 . A A . 16 ASP OD1 1 1 17 10355 1 1 16 ASP OD2 O 5.402 -5.025 -5.511 1.00 . A A . 16 ASP OD2 1 1 17 10356 1 1 17 VAL C C 9.287 -3.395 1.187 1.00 . A A . 17 VAL C 1 1 17 10357 1 1 17 VAL CA C 8.952 -2.595 -0.067 1.00 . A A . 17 VAL CA 1 1 17 10358 1 1 17 VAL CB C 8.916 -1.097 0.287 1.00 . A A . 17 VAL CB 1 1 17 10359 1 1 17 VAL CG1 C 10.242 -0.658 0.889 1.00 . A A . 17 VAL CG1 1 1 17 10360 1 1 17 VAL CG2 C 8.579 -0.267 -0.943 1.00 . A A . 17 VAL CG2 1 1 17 10361 1 1 17 VAL H H 6.879 -3.020 -0.098 1.00 . A A . 17 VAL H 1 1 17 10362 1 1 17 VAL HA H 9.729 -2.752 -0.801 1.00 . A A . 17 VAL HA 1 1 17 10363 1 1 17 VAL HB H 8.142 -0.940 1.024 1.00 . A A . 17 VAL HB 1 1 17 10364 1 1 17 VAL HG11 H 10.059 -0.107 1.799 1.00 . A A . 17 VAL HG11 1 1 17 10365 1 1 17 VAL HG12 H 10.844 -1.528 1.107 1.00 . A A . 17 VAL HG12 1 1 17 10366 1 1 17 VAL HG13 H 10.764 -0.026 0.186 1.00 . A A . 17 VAL HG13 1 1 17 10367 1 1 17 VAL HG21 H 7.982 -0.857 -1.623 1.00 . A A . 17 VAL HG21 1 1 17 10368 1 1 17 VAL HG22 H 8.024 0.610 -0.644 1.00 . A A . 17 VAL HG22 1 1 17 10369 1 1 17 VAL HG23 H 9.492 0.035 -1.436 1.00 . A A . 17 VAL HG23 1 1 17 10370 1 1 17 VAL N N 7.689 -3.035 -0.649 1.00 . A A . 17 VAL N 1 1 17 10371 1 1 17 VAL O O 10.423 -3.832 1.373 1.00 . A A . 17 VAL O 1 1 17 10372 1 1 18 CYS C C 7.607 -5.583 3.299 1.00 . A A . 18 CYS C 1 1 17 10373 1 1 18 CYS CA C 8.477 -4.330 3.283 1.00 . A A . 18 CYS CA 1 1 17 10374 1 1 18 CYS CB C 8.145 -3.450 4.490 1.00 . A A . 18 CYS CB 1 1 17 10375 1 1 18 CYS H H 7.406 -3.210 1.842 1.00 . A A . 18 CYS H 1 1 17 10376 1 1 18 CYS HA H 9.513 -4.626 3.339 1.00 . A A . 18 CYS HA 1 1 17 10377 1 1 18 CYS HB2 H 8.311 -4.016 5.395 1.00 . A A . 18 CYS HB2 1 1 17 10378 1 1 18 CYS HB3 H 8.795 -2.588 4.487 1.00 . A A . 18 CYS HB3 1 1 17 10379 1 1 18 CYS N N 8.290 -3.583 2.045 1.00 . A A . 18 CYS N 1 1 17 10380 1 1 18 CYS O O 7.704 -6.408 4.208 1.00 . A A . 18 CYS O 1 1 17 10381 1 1 18 CYS SG S 6.425 -2.849 4.521 1.00 . A A . 18 CYS SG 1 1 17 10382 1 1 19 ARG C C 4.919 -6.933 3.377 1.00 . A A . 19 ARG C 1 1 17 10383 1 1 19 ARG CA C 5.868 -6.871 2.185 1.00 . A A . 19 ARG CA 1 1 17 10384 1 1 19 ARG CB C 6.682 -8.164 2.099 1.00 . A A . 19 ARG CB 1 1 17 10385 1 1 19 ARG CD C 8.668 -7.707 0.629 1.00 . A A . 19 ARG CD 1 1 17 10386 1 1 19 ARG CG C 7.317 -8.395 0.738 1.00 . A A . 19 ARG CG 1 1 17 10387 1 1 19 ARG CZ C 10.243 -9.592 0.729 1.00 . A A . 19 ARG CZ 1 1 17 10388 1 1 19 ARG H H 6.725 -5.029 1.592 1.00 . A A . 19 ARG H 1 1 17 10389 1 1 19 ARG HA H 5.287 -6.762 1.281 1.00 . A A . 19 ARG HA 1 1 17 10390 1 1 19 ARG HB2 H 7.470 -8.129 2.838 1.00 . A A . 19 ARG HB2 1 1 17 10391 1 1 19 ARG HB3 H 6.033 -8.998 2.317 1.00 . A A . 19 ARG HB3 1 1 17 10392 1 1 19 ARG HD2 H 8.905 -7.571 -0.416 1.00 . A A . 19 ARG HD2 1 1 17 10393 1 1 19 ARG HD3 H 8.606 -6.743 1.112 1.00 . A A . 19 ARG HD3 1 1 17 10394 1 1 19 ARG HE H 10.081 -8.167 2.116 1.00 . A A . 19 ARG HE 1 1 17 10395 1 1 19 ARG HG2 H 7.453 -9.457 0.590 1.00 . A A . 19 ARG HG2 1 1 17 10396 1 1 19 ARG HG3 H 6.660 -8.005 -0.026 1.00 . A A . 19 ARG HG3 1 1 17 10397 1 1 19 ARG HH11 H 9.064 -9.556 -0.910 1.00 . A A . 19 ARG HH11 1 1 17 10398 1 1 19 ARG HH12 H 10.179 -10.880 -0.827 1.00 . A A . 19 ARG HH12 1 1 17 10399 1 1 19 ARG HH21 H 11.553 -9.905 2.237 1.00 . A A . 19 ARG HH21 1 1 17 10400 1 1 19 ARG HH22 H 11.593 -11.078 0.964 1.00 . A A . 19 ARG HH22 1 1 17 10401 1 1 19 ARG N N 6.757 -5.720 2.287 1.00 . A A . 19 ARG N 1 1 17 10402 1 1 19 ARG NE N 9.732 -8.485 1.258 1.00 . A A . 19 ARG NE 1 1 17 10403 1 1 19 ARG NH1 N 9.791 -10.047 -0.431 1.00 . A A . 19 ARG NH1 1 1 17 10404 1 1 19 ARG NH2 N 11.209 -10.245 1.362 1.00 . A A . 19 ARG NH2 1 1 17 10405 1 1 19 ARG O O 4.727 -7.990 3.979 1.00 . A A . 19 ARG O 1 1 17 10406 1 1 20 LYS C C 1.953 -5.821 4.352 1.00 . A A . 20 LYS C 1 1 17 10407 1 1 20 LYS CA C 3.396 -5.715 4.835 1.00 . A A . 20 LYS CA 1 1 17 10408 1 1 20 LYS CB C 3.594 -4.405 5.600 1.00 . A A . 20 LYS CB 1 1 17 10409 1 1 20 LYS CD C 4.639 -3.245 7.568 1.00 . A A . 20 LYS CD 1 1 17 10410 1 1 20 LYS CE C 5.350 -3.483 8.891 1.00 . A A . 20 LYS CE 1 1 17 10411 1 1 20 LYS CG C 4.627 -4.499 6.709 1.00 . A A . 20 LYS CG 1 1 17 10412 1 1 20 LYS H H 4.519 -4.982 3.197 1.00 . A A . 20 LYS H 1 1 17 10413 1 1 20 LYS HA H 3.603 -6.543 5.496 1.00 . A A . 20 LYS HA 1 1 17 10414 1 1 20 LYS HB2 H 3.910 -3.641 4.905 1.00 . A A . 20 LYS HB2 1 1 17 10415 1 1 20 LYS HB3 H 2.651 -4.112 6.039 1.00 . A A . 20 LYS HB3 1 1 17 10416 1 1 20 LYS HD2 H 5.151 -2.458 7.034 1.00 . A A . 20 LYS HD2 1 1 17 10417 1 1 20 LYS HD3 H 3.620 -2.944 7.765 1.00 . A A . 20 LYS HD3 1 1 17 10418 1 1 20 LYS HE2 H 4.903 -4.338 9.376 1.00 . A A . 20 LYS HE2 1 1 17 10419 1 1 20 LYS HE3 H 6.392 -3.684 8.694 1.00 . A A . 20 LYS HE3 1 1 17 10420 1 1 20 LYS HG2 H 4.395 -5.348 7.335 1.00 . A A . 20 LYS HG2 1 1 17 10421 1 1 20 LYS HG3 H 5.605 -4.631 6.268 1.00 . A A . 20 LYS HG3 1 1 17 10422 1 1 20 LYS HZ1 H 5.416 -2.593 10.780 1.00 . A A . 20 LYS HZ1 1 1 17 10423 1 1 20 LYS HZ2 H 4.297 -1.884 9.728 1.00 . A A . 20 LYS HZ2 1 1 17 10424 1 1 20 LYS HZ3 H 5.950 -1.587 9.529 1.00 . A A . 20 LYS HZ3 1 1 17 10425 1 1 20 LYS N N 4.326 -5.793 3.715 1.00 . A A . 20 LYS N 1 1 17 10426 1 1 20 LYS NZ N 5.246 -2.304 9.796 1.00 . A A . 20 LYS NZ 1 1 17 10427 1 1 20 LYS O O 1.692 -5.855 3.149 1.00 . A A . 20 LYS O 1 1 17 10428 1 1 21 ALA C C -1.194 -4.852 5.632 1.00 . A A . 21 ALA C 1 1 17 10429 1 1 21 ALA CA C -0.397 -5.969 4.966 1.00 . A A . 21 ALA CA 1 1 17 10430 1 1 21 ALA CB C -0.942 -7.328 5.378 1.00 . A A . 21 ALA CB 1 1 17 10431 1 1 21 ALA H H 1.290 -5.840 6.237 1.00 . A A . 21 ALA H 1 1 17 10432 1 1 21 ALA HA H -0.497 -5.878 3.894 1.00 . A A . 21 ALA HA 1 1 17 10433 1 1 21 ALA HB1 H -0.156 -7.906 5.839 1.00 . A A . 21 ALA HB1 1 1 17 10434 1 1 21 ALA HB2 H -1.750 -7.192 6.083 1.00 . A A . 21 ALA HB2 1 1 17 10435 1 1 21 ALA HB3 H -1.309 -7.848 4.506 1.00 . A A . 21 ALA HB3 1 1 17 10436 1 1 21 ALA N N 1.019 -5.871 5.296 1.00 . A A . 21 ALA N 1 1 17 10437 1 1 21 ALA O O -0.983 -4.539 6.804 1.00 . A A . 21 ALA O 1 1 17 10438 1 1 22 PHE C C -4.413 -3.421 5.091 1.00 . A A . 22 PHE C 1 1 17 10439 1 1 22 PHE CA C -2.939 -3.171 5.395 1.00 . A A . 22 PHE CA 1 1 17 10440 1 1 22 PHE CB C -2.501 -1.834 4.794 1.00 . A A . 22 PHE CB 1 1 17 10441 1 1 22 PHE CD1 C -0.070 -2.180 4.276 1.00 . A A . 22 PHE CD1 1 1 17 10442 1 1 22 PHE CD2 C -0.656 -0.585 5.949 1.00 . A A . 22 PHE CD2 1 1 17 10443 1 1 22 PHE CE1 C 1.269 -1.900 4.473 1.00 . A A . 22 PHE CE1 1 1 17 10444 1 1 22 PHE CE2 C 0.681 -0.300 6.150 1.00 . A A . 22 PHE CE2 1 1 17 10445 1 1 22 PHE CG C -1.047 -1.527 5.011 1.00 . A A . 22 PHE CG 1 1 17 10446 1 1 22 PHE CZ C 1.645 -0.959 5.412 1.00 . A A . 22 PHE CZ 1 1 17 10447 1 1 22 PHE H H -2.232 -4.549 3.951 1.00 . A A . 22 PHE H 1 1 17 10448 1 1 22 PHE HA H -2.806 -3.136 6.466 1.00 . A A . 22 PHE HA 1 1 17 10449 1 1 22 PHE HB2 H -2.681 -1.850 3.730 1.00 . A A . 22 PHE HB2 1 1 17 10450 1 1 22 PHE HB3 H -3.080 -1.040 5.241 1.00 . A A . 22 PHE HB3 1 1 17 10451 1 1 22 PHE HD1 H -0.363 -2.917 3.541 1.00 . A A . 22 PHE HD1 1 1 17 10452 1 1 22 PHE HD2 H -1.409 -0.070 6.528 1.00 . A A . 22 PHE HD2 1 1 17 10453 1 1 22 PHE HE1 H 2.020 -2.417 3.894 1.00 . A A . 22 PHE HE1 1 1 17 10454 1 1 22 PHE HE2 H 0.972 0.435 6.884 1.00 . A A . 22 PHE HE2 1 1 17 10455 1 1 22 PHE HZ H 2.690 -0.738 5.566 1.00 . A A . 22 PHE HZ 1 1 17 10456 1 1 22 PHE N N -2.111 -4.255 4.878 1.00 . A A . 22 PHE N 1 1 17 10457 1 1 22 PHE O O -4.826 -3.427 3.931 1.00 . A A . 22 PHE O 1 1 17 10458 1 1 23 SER C C -7.232 -2.966 4.925 1.00 . A A . 23 SER C 1 1 17 10459 1 1 23 SER CA C -6.629 -3.880 5.987 1.00 . A A . 23 SER CA 1 1 17 10460 1 1 23 SER CB C -7.352 -3.678 7.320 1.00 . A A . 23 SER CB 1 1 17 10461 1 1 23 SER H H -4.813 -3.609 7.041 1.00 . A A . 23 SER H 1 1 17 10462 1 1 23 SER HA H -6.751 -4.906 5.673 1.00 . A A . 23 SER HA 1 1 17 10463 1 1 23 SER HB2 H -8.418 -3.735 7.161 1.00 . A A . 23 SER HB2 1 1 17 10464 1 1 23 SER HB3 H -7.049 -4.452 8.011 1.00 . A A . 23 SER HB3 1 1 17 10465 1 1 23 SER HG H -6.111 -2.392 8.122 1.00 . A A . 23 SER HG 1 1 17 10466 1 1 23 SER N N -5.202 -3.626 6.141 1.00 . A A . 23 SER N 1 1 17 10467 1 1 23 SER O O -7.908 -3.426 4.004 1.00 . A A . 23 SER O 1 1 17 10468 1 1 23 SER OG O -7.040 -2.415 7.883 1.00 . A A . 23 SER OG 1 1 17 10469 1 1 24 HIS C C -6.429 -0.290 3.102 1.00 . A A . 24 HIS C 1 1 17 10470 1 1 24 HIS CA C -7.501 -0.686 4.113 1.00 . A A . 24 HIS CA 1 1 17 10471 1 1 24 HIS CB C -8.003 0.553 4.853 1.00 . A A . 24 HIS CB 1 1 17 10472 1 1 24 HIS CD2 C -10.452 0.978 4.110 1.00 . A A . 24 HIS CD2 1 1 17 10473 1 1 24 HIS CE1 C -10.112 2.773 2.897 1.00 . A A . 24 HIS CE1 1 1 17 10474 1 1 24 HIS CG C -9.127 1.254 4.154 1.00 . A A . 24 HIS CG 1 1 17 10475 1 1 24 HIS H H -6.438 -1.361 5.815 1.00 . A A . 24 HIS H 1 1 17 10476 1 1 24 HIS HA H -8.326 -1.139 3.585 1.00 . A A . 24 HIS HA 1 1 17 10477 1 1 24 HIS HB2 H -8.353 0.262 5.833 1.00 . A A . 24 HIS HB2 1 1 17 10478 1 1 24 HIS HB3 H -7.189 1.256 4.961 1.00 . A A . 24 HIS HB3 1 1 17 10479 1 1 24 HIS HD1 H -8.092 2.833 3.219 1.00 . A A . 24 HIS HD1 1 1 17 10480 1 1 24 HIS HD2 H -10.953 0.157 4.603 1.00 . A A . 24 HIS HD2 1 1 17 10481 1 1 24 HIS HE1 H -10.277 3.629 2.260 1.00 . A A . 24 HIS HE1 1 1 17 10482 1 1 24 HIS N N -6.983 -1.667 5.060 1.00 . A A . 24 HIS N 1 1 17 10483 1 1 24 HIS ND1 N -8.947 2.383 3.383 1.00 . A A . 24 HIS ND1 1 1 17 10484 1 1 24 HIS NE2 N -11.041 1.937 3.323 1.00 . A A . 24 HIS NE2 1 1 17 10485 1 1 24 HIS O O -5.243 -0.552 3.304 1.00 . A A . 24 HIS O 1 1 17 10486 1 1 25 HIS C C -5.185 2.035 1.393 1.00 . A A . 25 HIS C 1 1 17 10487 1 1 25 HIS CA C -5.931 0.774 0.969 1.00 . A A . 25 HIS CA 1 1 17 10488 1 1 25 HIS CB C -6.686 1.029 -0.336 1.00 . A A . 25 HIS CB 1 1 17 10489 1 1 25 HIS CD2 C -5.521 2.887 -1.720 1.00 . A A . 25 HIS CD2 1 1 17 10490 1 1 25 HIS CE1 C -4.500 1.608 -3.179 1.00 . A A . 25 HIS CE1 1 1 17 10491 1 1 25 HIS CG C -5.829 1.604 -1.421 1.00 . A A . 25 HIS CG 1 1 17 10492 1 1 25 HIS H H -7.812 0.522 1.908 1.00 . A A . 25 HIS H 1 1 17 10493 1 1 25 HIS HA H -5.215 -0.017 0.812 1.00 . A A . 25 HIS HA 1 1 17 10494 1 1 25 HIS HB2 H -7.095 0.096 -0.695 1.00 . A A . 25 HIS HB2 1 1 17 10495 1 1 25 HIS HB3 H -7.494 1.722 -0.148 1.00 . A A . 25 HIS HB3 1 1 17 10496 1 1 25 HIS HD1 H -5.199 -0.151 -2.403 1.00 . A A . 25 HIS HD1 1 1 17 10497 1 1 25 HIS HD2 H -5.863 3.768 -1.195 1.00 . A A . 25 HIS HD2 1 1 17 10498 1 1 25 HIS HE1 H -3.894 1.278 -4.009 1.00 . A A . 25 HIS HE1 1 1 17 10499 1 1 25 HIS N N -6.855 0.342 2.013 1.00 . A A . 25 HIS N 1 1 17 10500 1 1 25 HIS ND1 N -5.174 0.827 -2.354 1.00 . A A . 25 HIS ND1 1 1 17 10501 1 1 25 HIS NE2 N -4.695 2.863 -2.816 1.00 . A A . 25 HIS NE2 1 1 17 10502 1 1 25 HIS O O -3.957 2.095 1.324 1.00 . A A . 25 HIS O 1 1 17 10503 1 1 26 ALA C C -4.202 4.060 3.251 1.00 . A A . 26 ALA C 1 1 17 10504 1 1 26 ALA CA C -5.342 4.300 2.268 1.00 . A A . 26 ALA CA 1 1 17 10505 1 1 26 ALA CB C -6.403 5.192 2.896 1.00 . A A . 26 ALA CB 1 1 17 10506 1 1 26 ALA H H -6.907 2.934 1.865 1.00 . A A . 26 ALA H 1 1 17 10507 1 1 26 ALA HA H -4.953 4.806 1.397 1.00 . A A . 26 ALA HA 1 1 17 10508 1 1 26 ALA HB1 H -5.968 5.748 3.713 1.00 . A A . 26 ALA HB1 1 1 17 10509 1 1 26 ALA HB2 H -6.780 5.880 2.153 1.00 . A A . 26 ALA HB2 1 1 17 10510 1 1 26 ALA HB3 H -7.213 4.582 3.267 1.00 . A A . 26 ALA HB3 1 1 17 10511 1 1 26 ALA N N -5.934 3.042 1.832 1.00 . A A . 26 ALA N 1 1 17 10512 1 1 26 ALA O O -3.174 4.736 3.202 1.00 . A A . 26 ALA O 1 1 17 10513 1 1 27 SER C C -2.052 2.410 4.474 1.00 . A A . 27 SER C 1 1 17 10514 1 1 27 SER CA C -3.377 2.766 5.141 1.00 . A A . 27 SER CA 1 1 17 10515 1 1 27 SER CB C -3.850 1.603 6.016 1.00 . A A . 27 SER CB 1 1 17 10516 1 1 27 SER H H -5.230 2.589 4.132 1.00 . A A . 27 SER H 1 1 17 10517 1 1 27 SER HA H -3.231 3.637 5.763 1.00 . A A . 27 SER HA 1 1 17 10518 1 1 27 SER HB2 H -4.189 0.796 5.385 1.00 . A A . 27 SER HB2 1 1 17 10519 1 1 27 SER HB3 H -3.028 1.261 6.629 1.00 . A A . 27 SER HB3 1 1 17 10520 1 1 27 SER HG H -4.725 2.866 7.231 1.00 . A A . 27 SER HG 1 1 17 10521 1 1 27 SER N N -4.389 3.093 4.143 1.00 . A A . 27 SER N 1 1 17 10522 1 1 27 SER O O -0.982 2.593 5.055 1.00 . A A . 27 SER O 1 1 17 10523 1 1 27 SER OG O -4.915 2.001 6.861 1.00 . A A . 27 SER OG 1 1 17 10524 1 1 28 LEU C C -0.365 2.710 1.745 1.00 . A A . 28 LEU C 1 1 17 10525 1 1 28 LEU CA C -0.939 1.516 2.502 1.00 . A A . 28 LEU CA 1 1 17 10526 1 1 28 LEU CB C -1.268 0.387 1.524 1.00 . A A . 28 LEU CB 1 1 17 10527 1 1 28 LEU CD1 C 0.891 -0.868 1.310 1.00 . A A . 28 LEU CD1 1 1 17 10528 1 1 28 LEU CD2 C -0.703 -0.791 -0.615 1.00 . A A . 28 LEU CD2 1 1 17 10529 1 1 28 LEU CG C -0.142 -0.028 0.576 1.00 . A A . 28 LEU CG 1 1 17 10530 1 1 28 LEU H H -3.012 1.777 2.839 1.00 . A A . 28 LEU H 1 1 17 10531 1 1 28 LEU HA H -0.202 1.166 3.209 1.00 . A A . 28 LEU HA 1 1 17 10532 1 1 28 LEU HB2 H -1.549 -0.479 2.102 1.00 . A A . 28 LEU HB2 1 1 17 10533 1 1 28 LEU HB3 H -2.108 0.705 0.923 1.00 . A A . 28 LEU HB3 1 1 17 10534 1 1 28 LEU HD11 H 0.868 -0.629 2.363 1.00 . A A . 28 LEU HD11 1 1 17 10535 1 1 28 LEU HD12 H 1.874 -0.657 0.915 1.00 . A A . 28 LEU HD12 1 1 17 10536 1 1 28 LEU HD13 H 0.667 -1.916 1.174 1.00 . A A . 28 LEU HD13 1 1 17 10537 1 1 28 LEU HD21 H -1.568 -1.358 -0.305 1.00 . A A . 28 LEU HD21 1 1 17 10538 1 1 28 LEU HD22 H 0.050 -1.464 -0.998 1.00 . A A . 28 LEU HD22 1 1 17 10539 1 1 28 LEU HD23 H -0.987 -0.092 -1.389 1.00 . A A . 28 LEU HD23 1 1 17 10540 1 1 28 LEU HG H 0.352 0.858 0.204 1.00 . A A . 28 LEU HG 1 1 17 10541 1 1 28 LEU N N -2.132 1.899 3.250 1.00 . A A . 28 LEU N 1 1 17 10542 1 1 28 LEU O O 0.818 3.026 1.867 1.00 . A A . 28 LEU O 1 1 17 10543 1 1 29 THR C C -0.085 5.554 1.066 1.00 . A A . 29 THR C 1 1 17 10544 1 1 29 THR CA C -0.791 4.529 0.185 1.00 . A A . 29 THR CA 1 1 17 10545 1 1 29 THR CB C -1.987 5.205 -0.511 1.00 . A A . 29 THR CB 1 1 17 10546 1 1 29 THR CG2 C -2.691 6.167 0.435 1.00 . A A . 29 THR CG2 1 1 17 10547 1 1 29 THR H H -2.144 3.070 0.906 1.00 . A A . 29 THR H 1 1 17 10548 1 1 29 THR HA H -0.104 4.189 -0.576 1.00 . A A . 29 THR HA 1 1 17 10549 1 1 29 THR HB H -2.689 4.440 -0.810 1.00 . A A . 29 THR HB 1 1 17 10550 1 1 29 THR HG1 H -1.414 5.291 -2.396 1.00 . A A . 29 THR HG1 1 1 17 10551 1 1 29 THR HG21 H -3.755 6.128 0.261 1.00 . A A . 29 THR HG21 1 1 17 10552 1 1 29 THR HG22 H -2.334 7.171 0.258 1.00 . A A . 29 THR HG22 1 1 17 10553 1 1 29 THR HG23 H -2.482 5.885 1.456 1.00 . A A . 29 THR HG23 1 1 17 10554 1 1 29 THR N N -1.213 3.370 0.962 1.00 . A A . 29 THR N 1 1 17 10555 1 1 29 THR O O 0.743 6.330 0.589 1.00 . A A . 29 THR O 1 1 17 10556 1 1 29 THR OG1 O -1.542 5.912 -1.674 1.00 . A A . 29 THR OG1 1 1 17 10557 1 1 30 GLN C C 1.474 5.905 3.883 1.00 . A A . 30 GLN C 1 1 17 10558 1 1 30 GLN CA C 0.187 6.480 3.300 1.00 . A A . 30 GLN CA 1 1 17 10559 1 1 30 GLN CB C -0.797 6.804 4.426 1.00 . A A . 30 GLN CB 1 1 17 10560 1 1 30 GLN CD C -2.533 8.409 5.316 1.00 . A A . 30 GLN CD 1 1 17 10561 1 1 30 GLN CG C -1.701 7.988 4.121 1.00 . A A . 30 GLN CG 1 1 17 10562 1 1 30 GLN H H -1.083 4.907 2.673 1.00 . A A . 30 GLN H 1 1 17 10563 1 1 30 GLN HA H 0.422 7.389 2.767 1.00 . A A . 30 GLN HA 1 1 17 10564 1 1 30 GLN HB2 H -1.418 5.940 4.605 1.00 . A A . 30 GLN HB2 1 1 17 10565 1 1 30 GLN HB3 H -0.238 7.028 5.323 1.00 . A A . 30 GLN HB3 1 1 17 10566 1 1 30 GLN HE21 H -4.060 7.312 4.670 1.00 . A A . 30 GLN HE21 1 1 17 10567 1 1 30 GLN HE22 H -4.323 8.169 6.147 1.00 . A A . 30 GLN HE22 1 1 17 10568 1 1 30 GLN HG2 H -1.088 8.824 3.817 1.00 . A A . 30 GLN HG2 1 1 17 10569 1 1 30 GLN HG3 H -2.366 7.718 3.315 1.00 . A A . 30 GLN HG3 1 1 17 10570 1 1 30 GLN N N -0.417 5.550 2.353 1.00 . A A . 30 GLN N 1 1 17 10571 1 1 30 GLN NE2 N -3.763 7.915 5.385 1.00 . A A . 30 GLN NE2 1 1 17 10572 1 1 30 GLN O O 2.515 6.562 3.883 1.00 . A A . 30 GLN O 1 1 17 10573 1 1 30 GLN OE1 O -2.075 9.171 6.169 1.00 . A A . 30 GLN OE1 1 1 17 10574 1 1 31 HIS C C 3.764 4.115 4.042 1.00 . A A . 31 HIS C 1 1 17 10575 1 1 31 HIS CA C 2.554 4.011 4.965 1.00 . A A . 31 HIS CA 1 1 17 10576 1 1 31 HIS CB C 2.238 2.542 5.247 1.00 . A A . 31 HIS CB 1 1 17 10577 1 1 31 HIS CD2 C 3.931 0.840 4.265 1.00 . A A . 31 HIS CD2 1 1 17 10578 1 1 31 HIS CE1 C 5.274 0.690 5.992 1.00 . A A . 31 HIS CE1 1 1 17 10579 1 1 31 HIS CG C 3.446 1.656 5.230 1.00 . A A . 31 HIS CG 1 1 17 10580 1 1 31 HIS H H 0.537 4.202 4.350 1.00 . A A . 31 HIS H 1 1 17 10581 1 1 31 HIS HA H 2.783 4.506 5.897 1.00 . A A . 31 HIS HA 1 1 17 10582 1 1 31 HIS HB2 H 1.781 2.459 6.222 1.00 . A A . 31 HIS HB2 1 1 17 10583 1 1 31 HIS HB3 H 1.548 2.178 4.499 1.00 . A A . 31 HIS HB3 1 1 17 10584 1 1 31 HIS HD1 H 4.227 2.008 7.154 1.00 . A A . 31 HIS HD1 1 1 17 10585 1 1 31 HIS HD2 H 3.505 0.680 3.284 1.00 . A A . 31 HIS HD2 1 1 17 10586 1 1 31 HIS HE1 H 6.092 0.404 6.635 1.00 . A A . 31 HIS HE1 1 1 17 10587 1 1 31 HIS N N 1.395 4.675 4.379 1.00 . A A . 31 HIS N 1 1 17 10588 1 1 31 HIS ND1 N 4.309 1.539 6.299 1.00 . A A . 31 HIS ND1 1 1 17 10589 1 1 31 HIS NE2 N 5.068 0.252 4.763 1.00 . A A . 31 HIS NE2 1 1 17 10590 1 1 31 HIS O O 4.874 4.401 4.490 1.00 . A A . 31 HIS O 1 1 17 10591 1 1 32 GLN C C 5.577 5.086 2.089 1.00 . A A . 32 GLN C 1 1 17 10592 1 1 32 GLN CA C 4.614 3.948 1.768 1.00 . A A . 32 GLN CA 1 1 17 10593 1 1 32 GLN CB C 4.036 4.134 0.364 1.00 . A A . 32 GLN CB 1 1 17 10594 1 1 32 GLN CD C 3.502 2.831 -1.734 1.00 . A A . 32 GLN CD 1 1 17 10595 1 1 32 GLN CG C 3.438 2.864 -0.220 1.00 . A A . 32 GLN CG 1 1 17 10596 1 1 32 GLN H H 2.634 3.658 2.458 1.00 . A A . 32 GLN H 1 1 17 10597 1 1 32 GLN HA H 5.155 3.015 1.804 1.00 . A A . 32 GLN HA 1 1 17 10598 1 1 32 GLN HB2 H 3.263 4.886 0.403 1.00 . A A . 32 GLN HB2 1 1 17 10599 1 1 32 GLN HB3 H 4.823 4.471 -0.295 1.00 . A A . 32 GLN HB3 1 1 17 10600 1 1 32 GLN HE21 H 3.419 0.845 -1.720 1.00 . A A . 32 GLN HE21 1 1 17 10601 1 1 32 GLN HE22 H 3.518 1.581 -3.279 1.00 . A A . 32 GLN HE22 1 1 17 10602 1 1 32 GLN HG2 H 3.981 2.014 0.166 1.00 . A A . 32 GLN HG2 1 1 17 10603 1 1 32 GLN HG3 H 2.403 2.796 0.084 1.00 . A A . 32 GLN HG3 1 1 17 10604 1 1 32 GLN N N 3.541 3.881 2.753 1.00 . A A . 32 GLN N 1 1 17 10605 1 1 32 GLN NE2 N 3.478 1.631 -2.302 1.00 . A A . 32 GLN NE2 1 1 17 10606 1 1 32 GLN O O 6.758 5.030 1.743 1.00 . A A . 32 GLN O 1 1 17 10607 1 1 32 GLN OE1 O 3.573 3.873 -2.386 1.00 . A A . 32 GLN OE1 1 1 17 10608 1 1 33 ARG C C 7.132 6.835 3.873 1.00 . A A . 33 ARG C 1 1 17 10609 1 1 33 ARG CA C 5.880 7.271 3.117 1.00 . A A . 33 ARG CA 1 1 17 10610 1 1 33 ARG CB C 5.069 8.246 3.972 1.00 . A A . 33 ARG CB 1 1 17 10611 1 1 33 ARG CD C 3.266 9.994 4.066 1.00 . A A . 33 ARG CD 1 1 17 10612 1 1 33 ARG CG C 4.145 9.142 3.164 1.00 . A A . 33 ARG CG 1 1 17 10613 1 1 33 ARG CZ C 3.541 9.154 6.360 1.00 . A A . 33 ARG CZ 1 1 17 10614 1 1 33 ARG H H 4.118 6.106 2.999 1.00 . A A . 33 ARG H 1 1 17 10615 1 1 33 ARG HA H 6.179 7.769 2.206 1.00 . A A . 33 ARG HA 1 1 17 10616 1 1 33 ARG HB2 H 4.467 7.680 4.669 1.00 . A A . 33 ARG HB2 1 1 17 10617 1 1 33 ARG HB3 H 5.750 8.874 4.526 1.00 . A A . 33 ARG HB3 1 1 17 10618 1 1 33 ARG HD2 H 3.829 10.860 4.382 1.00 . A A . 33 ARG HD2 1 1 17 10619 1 1 33 ARG HD3 H 2.400 10.313 3.505 1.00 . A A . 33 ARG HD3 1 1 17 10620 1 1 33 ARG HE H 1.944 8.828 5.211 1.00 . A A . 33 ARG HE 1 1 17 10621 1 1 33 ARG HG2 H 4.742 9.793 2.543 1.00 . A A . 33 ARG HG2 1 1 17 10622 1 1 33 ARG HG3 H 3.515 8.525 2.541 1.00 . A A . 33 ARG HG3 1 1 17 10623 1 1 33 ARG HH11 H 5.091 10.247 5.663 1.00 . A A . 33 ARG HH11 1 1 17 10624 1 1 33 ARG HH12 H 5.272 9.649 7.279 1.00 . A A . 33 ARG HH12 1 1 17 10625 1 1 33 ARG HH21 H 2.171 8.035 7.338 1.00 . A A . 33 ARG HH21 1 1 17 10626 1 1 33 ARG HH22 H 3.611 8.390 8.230 1.00 . A A . 33 ARG HH22 1 1 17 10627 1 1 33 ARG N N 5.066 6.119 2.751 1.00 . A A . 33 ARG N 1 1 17 10628 1 1 33 ARG NE N 2.822 9.261 5.249 1.00 . A A . 33 ARG NE 1 1 17 10629 1 1 33 ARG NH1 N 4.733 9.730 6.440 1.00 . A A . 33 ARG NH1 1 1 17 10630 1 1 33 ARG NH2 N 3.069 8.470 7.395 1.00 . A A . 33 ARG NH2 1 1 17 10631 1 1 33 ARG O O 8.244 7.251 3.547 1.00 . A A . 33 ARG O 1 1 17 10632 1 1 34 VAL C C 9.244 5.128 4.808 1.00 . A A . 34 VAL C 1 1 17 10633 1 1 34 VAL CA C 8.055 5.499 5.687 1.00 . A A . 34 VAL CA 1 1 17 10634 1 1 34 VAL CB C 7.645 4.271 6.521 1.00 . A A . 34 VAL CB 1 1 17 10635 1 1 34 VAL CG1 C 6.373 4.559 7.305 1.00 . A A . 34 VAL CG1 1 1 17 10636 1 1 34 VAL CG2 C 7.464 3.056 5.625 1.00 . A A . 34 VAL CG2 1 1 17 10637 1 1 34 VAL H H 6.033 5.697 5.096 1.00 . A A . 34 VAL H 1 1 17 10638 1 1 34 VAL HA H 8.353 6.286 6.365 1.00 . A A . 34 VAL HA 1 1 17 10639 1 1 34 VAL HB H 8.435 4.059 7.225 1.00 . A A . 34 VAL HB 1 1 17 10640 1 1 34 VAL HG11 H 6.488 5.486 7.848 1.00 . A A . 34 VAL HG11 1 1 17 10641 1 1 34 VAL HG12 H 5.540 4.641 6.623 1.00 . A A . 34 VAL HG12 1 1 17 10642 1 1 34 VAL HG13 H 6.191 3.755 8.002 1.00 . A A . 34 VAL HG13 1 1 17 10643 1 1 34 VAL HG21 H 6.724 3.272 4.869 1.00 . A A . 34 VAL HG21 1 1 17 10644 1 1 34 VAL HG22 H 8.404 2.816 5.151 1.00 . A A . 34 VAL HG22 1 1 17 10645 1 1 34 VAL HG23 H 7.136 2.215 6.219 1.00 . A A . 34 VAL HG23 1 1 17 10646 1 1 34 VAL N N 6.942 5.993 4.884 1.00 . A A . 34 VAL N 1 1 17 10647 1 1 34 VAL O O 10.395 5.196 5.241 1.00 . A A . 34 VAL O 1 1 17 10648 1 1 35 HIS C C 10.391 5.534 1.739 1.00 . A A . 35 HIS C 1 1 17 10649 1 1 35 HIS CA C 10.005 4.356 2.628 1.00 . A A . 35 HIS CA 1 1 17 10650 1 1 35 HIS CB C 9.542 3.181 1.766 1.00 . A A . 35 HIS CB 1 1 17 10651 1 1 35 HIS CD2 C 7.837 1.349 2.447 1.00 . A A . 35 HIS CD2 1 1 17 10652 1 1 35 HIS CE1 C 8.955 0.476 4.119 1.00 . A A . 35 HIS CE1 1 1 17 10653 1 1 35 HIS CG C 9.000 2.033 2.560 1.00 . A A . 35 HIS CG 1 1 17 10654 1 1 35 HIS H H 8.023 4.704 3.283 1.00 . A A . 35 HIS H 1 1 17 10655 1 1 35 HIS HA H 10.871 4.053 3.198 1.00 . A A . 35 HIS HA 1 1 17 10656 1 1 35 HIS HB2 H 8.764 3.519 1.098 1.00 . A A . 35 HIS HB2 1 1 17 10657 1 1 35 HIS HB3 H 10.377 2.818 1.184 1.00 . A A . 35 HIS HB3 1 1 17 10658 1 1 35 HIS HD1 H 10.556 1.737 3.949 1.00 . A A . 35 HIS HD1 1 1 17 10659 1 1 35 HIS HD2 H 7.056 1.527 1.721 1.00 . A A . 35 HIS HD2 1 1 17 10660 1 1 35 HIS HE1 H 9.233 -0.150 4.953 1.00 . A A . 35 HIS HE1 1 1 17 10661 1 1 35 HIS N N 8.959 4.737 3.570 1.00 . A A . 35 HIS N 1 1 17 10662 1 1 35 HIS ND1 N 9.677 1.462 3.617 1.00 . A A . 35 HIS ND1 1 1 17 10663 1 1 35 HIS NE2 N 7.833 0.387 3.427 1.00 . A A . 35 HIS NE2 1 1 17 10664 1 1 35 HIS O O 9.637 5.925 0.848 1.00 . A A . 35 HIS O 1 1 17 10665 1 1 36 SER C C 12.933 6.765 0.054 1.00 . A A . 36 SER C 1 1 17 10666 1 1 36 SER CA C 12.054 7.231 1.211 1.00 . A A . 36 SER CA 1 1 17 10667 1 1 36 SER CB C 12.839 8.191 2.108 1.00 . A A . 36 SER CB 1 1 17 10668 1 1 36 SER H H 12.127 5.738 2.710 1.00 . A A . 36 SER H 1 1 17 10669 1 1 36 SER HA H 11.195 7.749 0.810 1.00 . A A . 36 SER HA 1 1 17 10670 1 1 36 SER HB2 H 13.216 9.008 1.513 1.00 . A A . 36 SER HB2 1 1 17 10671 1 1 36 SER HB3 H 12.185 8.576 2.877 1.00 . A A . 36 SER HB3 1 1 17 10672 1 1 36 SER HG H 14.689 7.548 2.136 1.00 . A A . 36 SER HG 1 1 17 10673 1 1 36 SER N N 11.570 6.095 1.987 1.00 . A A . 36 SER N 1 1 17 10674 1 1 36 SER O O 14.004 6.198 0.263 1.00 . A A . 36 SER O 1 1 17 10675 1 1 36 SER OG O 13.932 7.533 2.725 1.00 . A A . 36 SER OG 1 1 17 10676 1 1 37 GLY C C 14.402 7.523 -2.613 1.00 . A A . 37 GLY C 1 1 17 10677 1 1 37 GLY CA C 13.225 6.608 -2.341 1.00 . A A . 37 GLY CA 1 1 17 10678 1 1 37 GLY H H 11.609 7.465 -1.274 1.00 . A A . 37 GLY H 1 1 17 10679 1 1 37 GLY HA2 H 13.590 5.603 -2.194 1.00 . A A . 37 GLY HA2 1 1 17 10680 1 1 37 GLY HA3 H 12.568 6.621 -3.199 1.00 . A A . 37 GLY HA3 1 1 17 10681 1 1 37 GLY N N 12.470 7.009 -1.168 1.00 . A A . 37 GLY N 1 1 17 10682 1 1 37 GLY O O 14.796 8.310 -1.753 1.00 . A A . 37 GLY O 1 1 17 10683 1 1 38 GLU C C 15.648 9.592 -4.734 1.00 . A A . 38 GLU C 1 1 17 10684 1 1 38 GLU CA C 16.108 8.242 -4.193 1.00 . A A . 38 GLU CA 1 1 17 10685 1 1 38 GLU CB C 16.956 7.522 -5.244 1.00 . A A . 38 GLU CB 1 1 17 10686 1 1 38 GLU CD C 15.346 6.028 -6.491 1.00 . A A . 38 GLU CD 1 1 17 10687 1 1 38 GLU CG C 16.221 7.265 -6.548 1.00 . A A . 38 GLU CG 1 1 17 10688 1 1 38 GLU H H 14.607 6.772 -4.455 1.00 . A A . 38 GLU H 1 1 17 10689 1 1 38 GLU HA H 16.707 8.406 -3.311 1.00 . A A . 38 GLU HA 1 1 17 10690 1 1 38 GLU HB2 H 17.828 8.122 -5.457 1.00 . A A . 38 GLU HB2 1 1 17 10691 1 1 38 GLU HB3 H 17.275 6.571 -4.841 1.00 . A A . 38 GLU HB3 1 1 17 10692 1 1 38 GLU HG2 H 15.598 8.118 -6.770 1.00 . A A . 38 GLU HG2 1 1 17 10693 1 1 38 GLU HG3 H 16.948 7.137 -7.337 1.00 . A A . 38 GLU HG3 1 1 17 10694 1 1 38 GLU N N 14.966 7.418 -3.812 1.00 . A A . 38 GLU N 1 1 17 10695 1 1 38 GLU O O 16.175 10.087 -5.731 1.00 . A A . 38 GLU O 1 1 17 10696 1 1 38 GLU OE1 O 15.882 4.932 -6.225 1.00 . A A . 38 GLU OE1 1 1 17 10697 1 1 38 GLU OE2 O 14.123 6.156 -6.711 1.00 . A A . 38 GLU OE2 1 1 17 10698 1 1 39 LYS C C 14.683 12.597 -3.608 1.00 . A A . 39 LYS C 1 1 17 10699 1 1 39 LYS CA C 14.128 11.477 -4.482 1.00 . A A . 39 LYS CA 1 1 17 10700 1 1 39 LYS CB C 12.599 11.469 -4.409 1.00 . A A . 39 LYS CB 1 1 17 10701 1 1 39 LYS CD C 11.663 12.900 -6.249 1.00 . A A . 39 LYS CD 1 1 17 10702 1 1 39 LYS CE C 10.267 12.386 -6.567 1.00 . A A . 39 LYS CE 1 1 17 10703 1 1 39 LYS CG C 11.967 12.804 -4.764 1.00 . A A . 39 LYS CG 1 1 17 10704 1 1 39 LYS H H 14.281 9.739 -3.283 1.00 . A A . 39 LYS H 1 1 17 10705 1 1 39 LYS HA H 14.430 11.651 -5.503 1.00 . A A . 39 LYS HA 1 1 17 10706 1 1 39 LYS HB2 H 12.222 10.723 -5.093 1.00 . A A . 39 LYS HB2 1 1 17 10707 1 1 39 LYS HB3 H 12.300 11.208 -3.404 1.00 . A A . 39 LYS HB3 1 1 17 10708 1 1 39 LYS HD2 H 11.732 13.933 -6.556 1.00 . A A . 39 LYS HD2 1 1 17 10709 1 1 39 LYS HD3 H 12.387 12.311 -6.795 1.00 . A A . 39 LYS HD3 1 1 17 10710 1 1 39 LYS HE2 H 10.172 12.279 -7.637 1.00 . A A . 39 LYS HE2 1 1 17 10711 1 1 39 LYS HE3 H 10.136 11.423 -6.096 1.00 . A A . 39 LYS HE3 1 1 17 10712 1 1 39 LYS HG2 H 11.045 12.913 -4.211 1.00 . A A . 39 LYS HG2 1 1 17 10713 1 1 39 LYS HG3 H 12.648 13.598 -4.492 1.00 . A A . 39 LYS HG3 1 1 17 10714 1 1 39 LYS HZ1 H 9.631 14.224 -5.805 1.00 . A A . 39 LYS HZ1 1 1 17 10715 1 1 39 LYS HZ2 H 8.731 12.904 -5.250 1.00 . A A . 39 LYS HZ2 1 1 17 10716 1 1 39 LYS HZ3 H 8.505 13.479 -6.824 1.00 . A A . 39 LYS HZ3 1 1 17 10717 1 1 39 LYS N N 14.660 10.184 -4.070 1.00 . A A . 39 LYS N 1 1 17 10718 1 1 39 LYS NZ N 9.210 13.313 -6.077 1.00 . A A . 39 LYS NZ 1 1 17 10719 1 1 39 LYS O O 14.809 12.463 -2.390 1.00 . A A . 39 LYS O 1 1 17 10720 1 1 40 PRO C C 14.527 15.583 -2.660 1.00 . A A . 40 PRO C 1 1 17 10721 1 1 40 PRO CA C 15.567 14.896 -3.539 1.00 . A A . 40 PRO CA 1 1 17 10722 1 1 40 PRO CB C 16.002 15.823 -4.676 1.00 . A A . 40 PRO CB 1 1 17 10723 1 1 40 PRO CD C 14.899 13.960 -5.690 1.00 . A A . 40 PRO CD 1 1 17 10724 1 1 40 PRO CG C 15.141 15.438 -5.829 1.00 . A A . 40 PRO CG 1 1 17 10725 1 1 40 PRO HA H 16.426 14.632 -2.939 1.00 . A A . 40 PRO HA 1 1 17 10726 1 1 40 PRO HB2 H 15.840 16.852 -4.387 1.00 . A A . 40 PRO HB2 1 1 17 10727 1 1 40 PRO HB3 H 17.048 15.666 -4.894 1.00 . A A . 40 PRO HB3 1 1 17 10728 1 1 40 PRO HD2 H 13.909 13.706 -6.038 1.00 . A A . 40 PRO HD2 1 1 17 10729 1 1 40 PRO HD3 H 15.647 13.402 -6.233 1.00 . A A . 40 PRO HD3 1 1 17 10730 1 1 40 PRO HG2 H 14.207 15.977 -5.787 1.00 . A A . 40 PRO HG2 1 1 17 10731 1 1 40 PRO HG3 H 15.655 15.647 -6.756 1.00 . A A . 40 PRO HG3 1 1 17 10732 1 1 40 PRO N N 15.022 13.730 -4.240 1.00 . A A . 40 PRO N 1 1 17 10733 1 1 40 PRO O O 14.800 15.922 -1.509 1.00 . A A . 40 PRO O 1 1 17 10734 1 1 41 SER C C 11.607 15.464 -1.492 1.00 . A A . 41 SER C 1 1 17 10735 1 1 41 SER CA C 12.253 16.432 -2.477 1.00 . A A . 41 SER CA 1 1 17 10736 1 1 41 SER CB C 11.200 16.969 -3.449 1.00 . A A . 41 SER CB 1 1 17 10737 1 1 41 SER H H 13.178 15.489 -4.133 1.00 . A A . 41 SER H 1 1 17 10738 1 1 41 SER HA H 12.677 17.259 -1.926 1.00 . A A . 41 SER HA 1 1 17 10739 1 1 41 SER HB2 H 10.385 17.401 -2.889 1.00 . A A . 41 SER HB2 1 1 17 10740 1 1 41 SER HB3 H 11.646 17.725 -4.078 1.00 . A A . 41 SER HB3 1 1 17 10741 1 1 41 SER HG H 10.614 15.125 -3.758 1.00 . A A . 41 SER HG 1 1 17 10742 1 1 41 SER N N 13.334 15.783 -3.211 1.00 . A A . 41 SER N 1 1 17 10743 1 1 41 SER O O 11.312 14.319 -1.832 1.00 . A A . 41 SER O 1 1 17 10744 1 1 41 SER OG O 10.690 15.933 -4.271 1.00 . A A . 41 SER OG 1 1 17 10745 1 1 42 GLY C C 10.337 15.889 1.964 1.00 . A A . 42 GLY C 1 1 17 10746 1 1 42 GLY CA C 10.779 15.096 0.750 1.00 . A A . 42 GLY CA 1 1 17 10747 1 1 42 GLY H H 11.644 16.854 -0.052 1.00 . A A . 42 GLY H 1 1 17 10748 1 1 42 GLY HA2 H 9.919 14.600 0.324 1.00 . A A . 42 GLY HA2 1 1 17 10749 1 1 42 GLY HA3 H 11.494 14.350 1.063 1.00 . A A . 42 GLY HA3 1 1 17 10750 1 1 42 GLY N N 11.389 15.933 -0.267 1.00 . A A . 42 GLY N 1 1 17 10751 1 1 42 GLY O O 10.489 17.109 2.025 1.00 . A A . 42 GLY O 1 1 17 10752 1 1 43 PRO C C 10.438 16.322 5.068 1.00 . A A . 43 PRO C 1 1 17 10753 1 1 43 PRO CA C 9.295 15.815 4.196 1.00 . A A . 43 PRO CA 1 1 17 10754 1 1 43 PRO CB C 8.546 14.681 4.901 1.00 . A A . 43 PRO CB 1 1 17 10755 1 1 43 PRO CD C 9.560 13.732 2.955 1.00 . A A . 43 PRO CD 1 1 17 10756 1 1 43 PRO CG C 9.167 13.433 4.376 1.00 . A A . 43 PRO CG 1 1 17 10757 1 1 43 PRO HA H 8.612 16.627 3.991 1.00 . A A . 43 PRO HA 1 1 17 10758 1 1 43 PRO HB2 H 8.679 14.770 5.970 1.00 . A A . 43 PRO HB2 1 1 17 10759 1 1 43 PRO HB3 H 7.496 14.732 4.657 1.00 . A A . 43 PRO HB3 1 1 17 10760 1 1 43 PRO HD2 H 10.469 13.209 2.697 1.00 . A A . 43 PRO HD2 1 1 17 10761 1 1 43 PRO HD3 H 8.762 13.462 2.279 1.00 . A A . 43 PRO HD3 1 1 17 10762 1 1 43 PRO HG2 H 10.039 13.182 4.961 1.00 . A A . 43 PRO HG2 1 1 17 10763 1 1 43 PRO HG3 H 8.449 12.626 4.404 1.00 . A A . 43 PRO HG3 1 1 17 10764 1 1 43 PRO N N 9.773 15.189 2.960 1.00 . A A . 43 PRO N 1 1 17 10765 1 1 43 PRO O O 10.898 15.625 5.972 1.00 . A A . 43 PRO O 1 1 17 10766 1 1 44 SER C C 11.512 18.567 6.937 1.00 . A A . 44 SER C 1 1 17 10767 1 1 44 SER CA C 11.983 18.140 5.550 1.00 . A A . 44 SER CA 1 1 17 10768 1 1 44 SER CB C 12.552 19.345 4.799 1.00 . A A . 44 SER CB 1 1 17 10769 1 1 44 SER H H 10.483 18.047 4.058 1.00 . A A . 44 SER H 1 1 17 10770 1 1 44 SER HA H 12.758 17.396 5.659 1.00 . A A . 44 SER HA 1 1 17 10771 1 1 44 SER HB2 H 12.822 19.048 3.797 1.00 . A A . 44 SER HB2 1 1 17 10772 1 1 44 SER HB3 H 11.805 20.124 4.755 1.00 . A A . 44 SER HB3 1 1 17 10773 1 1 44 SER HG H 14.220 19.126 5.803 1.00 . A A . 44 SER HG 1 1 17 10774 1 1 44 SER N N 10.891 17.541 4.792 1.00 . A A . 44 SER N 1 1 17 10775 1 1 44 SER O O 11.081 19.703 7.136 1.00 . A A . 44 SER O 1 1 17 10776 1 1 44 SER OG O 13.704 19.854 5.449 1.00 . A A . 44 SER OG 1 1 17 10777 1 1 45 SER C C 11.573 16.786 10.194 1.00 . A A . 45 SER C 1 1 17 10778 1 1 45 SER CA C 11.176 17.926 9.261 1.00 . A A . 45 SER CA 1 1 17 10779 1 1 45 SER CB C 9.662 18.142 9.317 1.00 . A A . 45 SER CB 1 1 17 10780 1 1 45 SER H H 11.949 16.760 7.672 1.00 . A A . 45 SER H 1 1 17 10781 1 1 45 SER HA H 11.672 18.829 9.583 1.00 . A A . 45 SER HA 1 1 17 10782 1 1 45 SER HB2 H 9.352 18.720 8.460 1.00 . A A . 45 SER HB2 1 1 17 10783 1 1 45 SER HB3 H 9.164 17.183 9.304 1.00 . A A . 45 SER HB3 1 1 17 10784 1 1 45 SER HG H 8.368 19.098 10.434 1.00 . A A . 45 SER HG 1 1 17 10785 1 1 45 SER N N 11.597 17.647 7.893 1.00 . A A . 45 SER N 1 1 17 10786 1 1 45 SER O O 11.022 15.688 10.121 1.00 . A A . 45 SER O 1 1 17 10787 1 1 45 SER OG O 9.289 18.835 10.495 1.00 . A A . 45 SER OG 1 1 17 10788 1 1 46 GLY C C 14.334 16.385 12.620 1.00 . A A . 46 GLY C 1 1 17 10789 1 1 46 GLY CA C 12.990 16.045 12.007 1.00 . A A . 46 GLY CA 1 1 17 10790 1 1 46 GLY H H 12.938 17.949 11.084 1.00 . A A . 46 GLY H 1 1 17 10791 1 1 46 GLY HA2 H 12.261 15.945 12.797 1.00 . A A . 46 GLY HA2 1 1 17 10792 1 1 46 GLY HA3 H 13.074 15.101 11.487 1.00 . A A . 46 GLY HA3 1 1 17 10793 1 1 46 GLY N N 12.535 17.056 11.072 1.00 . A A . 46 GLY N 1 1 17 10794 1 1 46 GLY O O 15.353 15.885 12.146 1.00 . A A . 46 GLY O 1 1 17 10795 2 2 1 ZN ZN ZN 6.178 -0.751 3.546 1.00 . B A . 181 ZN ZN 1 1 18 10796 1 1 1 GLY C C 8.508 -25.047 10.914 1.00 . A A . 1 GLY C 1 1 18 10797 1 1 1 GLY CA C 9.816 -24.653 11.572 1.00 . A A . 1 GLY CA 1 1 18 10798 1 1 1 GLY H1 H 9.739 -22.790 10.570 1.00 . A A . 1 GLY H1 1 1 18 10799 1 1 1 GLY HA2 H 10.548 -25.423 11.382 1.00 . A A . 1 GLY HA2 1 1 18 10800 1 1 1 GLY HA3 H 9.659 -24.574 12.638 1.00 . A A . 1 GLY HA3 1 1 18 10801 1 1 1 GLY N N 10.326 -23.388 11.078 1.00 . A A . 1 GLY N 1 1 18 10802 1 1 1 GLY O O 8.472 -25.355 9.723 1.00 . A A . 1 GLY O 1 1 18 10803 1 1 2 SER C C 5.721 -24.511 10.008 1.00 . A A . 2 SER C 1 1 18 10804 1 1 2 SER CA C 6.115 -25.406 11.180 1.00 . A A . 2 SER CA 1 1 18 10805 1 1 2 SER CB C 5.066 -25.304 12.289 1.00 . A A . 2 SER CB 1 1 18 10806 1 1 2 SER H H 7.523 -24.786 12.635 1.00 . A A . 2 SER H 1 1 18 10807 1 1 2 SER HA H 6.165 -26.428 10.836 1.00 . A A . 2 SER HA 1 1 18 10808 1 1 2 SER HB2 H 5.410 -25.844 13.157 1.00 . A A . 2 SER HB2 1 1 18 10809 1 1 2 SER HB3 H 4.918 -24.265 12.546 1.00 . A A . 2 SER HB3 1 1 18 10810 1 1 2 SER HG H 3.940 -26.784 11.673 1.00 . A A . 2 SER HG 1 1 18 10811 1 1 2 SER N N 7.430 -25.041 11.693 1.00 . A A . 2 SER N 1 1 18 10812 1 1 2 SER O O 6.386 -23.515 9.723 1.00 . A A . 2 SER O 1 1 18 10813 1 1 2 SER OG O 3.827 -25.852 11.871 1.00 . A A . 2 SER OG 1 1 18 10814 1 1 3 SER C C 3.358 -22.892 8.647 1.00 . A A . 3 SER C 1 1 18 10815 1 1 3 SER CA C 4.155 -24.110 8.188 1.00 . A A . 3 SER CA 1 1 18 10816 1 1 3 SER CB C 3.289 -24.990 7.286 1.00 . A A . 3 SER CB 1 1 18 10817 1 1 3 SER H H 4.149 -25.680 9.608 1.00 . A A . 3 SER H 1 1 18 10818 1 1 3 SER HA H 5.015 -23.773 7.630 1.00 . A A . 3 SER HA 1 1 18 10819 1 1 3 SER HB2 H 3.042 -24.447 6.387 1.00 . A A . 3 SER HB2 1 1 18 10820 1 1 3 SER HB3 H 3.837 -25.885 7.027 1.00 . A A . 3 SER HB3 1 1 18 10821 1 1 3 SER HG H 1.556 -24.581 8.103 1.00 . A A . 3 SER HG 1 1 18 10822 1 1 3 SER N N 4.636 -24.876 9.332 1.00 . A A . 3 SER N 1 1 18 10823 1 1 3 SER O O 2.984 -22.784 9.814 1.00 . A A . 3 SER O 1 1 18 10824 1 1 3 SER OG O 2.087 -25.363 7.938 1.00 . A A . 3 SER OG 1 1 18 10825 1 1 4 GLY C C 0.860 -21.037 8.143 1.00 . A A . 4 GLY C 1 1 18 10826 1 1 4 GLY CA C 2.351 -20.778 8.044 1.00 . A A . 4 GLY CA 1 1 18 10827 1 1 4 GLY H H 3.425 -22.116 6.802 1.00 . A A . 4 GLY H 1 1 18 10828 1 1 4 GLY HA2 H 2.702 -20.392 8.989 1.00 . A A . 4 GLY HA2 1 1 18 10829 1 1 4 GLY HA3 H 2.525 -20.038 7.277 1.00 . A A . 4 GLY HA3 1 1 18 10830 1 1 4 GLY N N 3.101 -21.976 7.717 1.00 . A A . 4 GLY N 1 1 18 10831 1 1 4 GLY O O 0.395 -22.140 7.859 1.00 . A A . 4 GLY O 1 1 18 10832 1 1 5 SER C C -2.058 -19.340 7.612 1.00 . A A . 5 SER C 1 1 18 10833 1 1 5 SER CA C -1.336 -20.141 8.691 1.00 . A A . 5 SER CA 1 1 18 10834 1 1 5 SER CB C -1.776 -19.665 10.076 1.00 . A A . 5 SER CB 1 1 18 10835 1 1 5 SER H H 0.540 -19.162 8.761 1.00 . A A . 5 SER H 1 1 18 10836 1 1 5 SER HA H -1.592 -21.184 8.580 1.00 . A A . 5 SER HA 1 1 18 10837 1 1 5 SER HB2 H -1.140 -18.853 10.394 1.00 . A A . 5 SER HB2 1 1 18 10838 1 1 5 SER HB3 H -2.800 -19.322 10.027 1.00 . A A . 5 SER HB3 1 1 18 10839 1 1 5 SER HG H -1.765 -21.558 10.580 1.00 . A A . 5 SER HG 1 1 18 10840 1 1 5 SER N N 0.110 -20.017 8.549 1.00 . A A . 5 SER N 1 1 18 10841 1 1 5 SER O O -1.719 -18.187 7.348 1.00 . A A . 5 SER O 1 1 18 10842 1 1 5 SER OG O -1.690 -20.712 11.027 1.00 . A A . 5 SER OG 1 1 18 10843 1 1 6 SER C C -4.403 -17.986 6.427 1.00 . A A . 6 SER C 1 1 18 10844 1 1 6 SER CA C -3.824 -19.309 5.937 1.00 . A A . 6 SER CA 1 1 18 10845 1 1 6 SER CB C -4.951 -20.226 5.457 1.00 . A A . 6 SER CB 1 1 18 10846 1 1 6 SER H H -3.278 -20.882 7.246 1.00 . A A . 6 SER H 1 1 18 10847 1 1 6 SER HA H -3.155 -19.113 5.112 1.00 . A A . 6 SER HA 1 1 18 10848 1 1 6 SER HB2 H -5.530 -20.556 6.306 1.00 . A A . 6 SER HB2 1 1 18 10849 1 1 6 SER HB3 H -5.589 -19.680 4.776 1.00 . A A . 6 SER HB3 1 1 18 10850 1 1 6 SER HG H -4.471 -21.219 3.838 1.00 . A A . 6 SER HG 1 1 18 10851 1 1 6 SER N N -3.055 -19.962 6.991 1.00 . A A . 6 SER N 1 1 18 10852 1 1 6 SER O O -4.197 -16.940 5.813 1.00 . A A . 6 SER O 1 1 18 10853 1 1 6 SER OG O -4.434 -21.362 4.787 1.00 . A A . 6 SER OG 1 1 18 10854 1 1 7 GLY C C -4.724 -15.981 8.835 1.00 . A A . 7 GLY C 1 1 18 10855 1 1 7 GLY CA C -5.729 -16.840 8.094 1.00 . A A . 7 GLY CA 1 1 18 10856 1 1 7 GLY H H -5.261 -18.903 7.986 1.00 . A A . 7 GLY H 1 1 18 10857 1 1 7 GLY HA2 H -6.159 -16.261 7.290 1.00 . A A . 7 GLY HA2 1 1 18 10858 1 1 7 GLY HA3 H -6.514 -17.127 8.777 1.00 . A A . 7 GLY HA3 1 1 18 10859 1 1 7 GLY N N -5.130 -18.040 7.539 1.00 . A A . 7 GLY N 1 1 18 10860 1 1 7 GLY O O -4.801 -15.835 10.056 1.00 . A A . 7 GLY O 1 1 18 10861 1 1 8 THR C C -3.055 -13.088 8.464 1.00 . A A . 8 THR C 1 1 18 10862 1 1 8 THR CA C -2.750 -14.564 8.693 1.00 . A A . 8 THR CA 1 1 18 10863 1 1 8 THR CB C -1.356 -14.884 8.121 1.00 . A A . 8 THR CB 1 1 18 10864 1 1 8 THR CG2 C -1.348 -14.743 6.606 1.00 . A A . 8 THR CG2 1 1 18 10865 1 1 8 THR H H -3.768 -15.565 7.130 1.00 . A A . 8 THR H 1 1 18 10866 1 1 8 THR HA H -2.733 -14.758 9.756 1.00 . A A . 8 THR HA 1 1 18 10867 1 1 8 THR HB H -1.106 -15.904 8.374 1.00 . A A . 8 THR HB 1 1 18 10868 1 1 8 THR HG1 H 0.496 -14.267 8.396 1.00 . A A . 8 THR HG1 1 1 18 10869 1 1 8 THR HG21 H -1.913 -15.551 6.167 1.00 . A A . 8 THR HG21 1 1 18 10870 1 1 8 THR HG22 H -0.330 -14.778 6.247 1.00 . A A . 8 THR HG22 1 1 18 10871 1 1 8 THR HG23 H -1.795 -13.799 6.330 1.00 . A A . 8 THR HG23 1 1 18 10872 1 1 8 THR N N -3.776 -15.411 8.098 1.00 . A A . 8 THR N 1 1 18 10873 1 1 8 THR O O -2.673 -12.234 9.263 1.00 . A A . 8 THR O 1 1 18 10874 1 1 8 THR OG1 O -0.379 -14.007 8.692 1.00 . A A . 8 THR OG1 1 1 18 10875 1 1 9 GLY C C -4.109 -11.153 5.561 1.00 . A A . 9 GLY C 1 1 18 10876 1 1 9 GLY CA C -4.091 -11.420 7.053 1.00 . A A . 9 GLY CA 1 1 18 10877 1 1 9 GLY H H -4.024 -13.517 6.766 1.00 . A A . 9 GLY H 1 1 18 10878 1 1 9 GLY HA2 H -5.068 -11.203 7.459 1.00 . A A . 9 GLY HA2 1 1 18 10879 1 1 9 GLY HA3 H -3.367 -10.765 7.515 1.00 . A A . 9 GLY HA3 1 1 18 10880 1 1 9 GLY N N -3.746 -12.794 7.367 1.00 . A A . 9 GLY N 1 1 18 10881 1 1 9 GLY O O -3.589 -10.137 5.100 1.00 . A A . 9 GLY O 1 1 18 10882 1 1 10 GLU C C -5.693 -10.759 2.973 1.00 . A A . 10 GLU C 1 1 18 10883 1 1 10 GLU CA C -4.788 -11.926 3.356 1.00 . A A . 10 GLU CA 1 1 18 10884 1 1 10 GLU CB C -5.309 -13.218 2.723 1.00 . A A . 10 GLU CB 1 1 18 10885 1 1 10 GLU CD C -5.029 -15.716 2.466 1.00 . A A . 10 GLU CD 1 1 18 10886 1 1 10 GLU CG C -4.431 -14.428 2.997 1.00 . A A . 10 GLU CG 1 1 18 10887 1 1 10 GLU H H -5.103 -12.856 5.231 1.00 . A A . 10 GLU H 1 1 18 10888 1 1 10 GLU HA H -3.793 -11.731 2.986 1.00 . A A . 10 GLU HA 1 1 18 10889 1 1 10 GLU HB2 H -6.297 -13.421 3.109 1.00 . A A . 10 GLU HB2 1 1 18 10890 1 1 10 GLU HB3 H -5.372 -13.081 1.654 1.00 . A A . 10 GLU HB3 1 1 18 10891 1 1 10 GLU HG2 H -3.471 -14.274 2.526 1.00 . A A . 10 GLU HG2 1 1 18 10892 1 1 10 GLU HG3 H -4.295 -14.524 4.064 1.00 . A A . 10 GLU HG3 1 1 18 10893 1 1 10 GLU N N -4.707 -12.068 4.805 1.00 . A A . 10 GLU N 1 1 18 10894 1 1 10 GLU O O -6.888 -10.762 3.267 1.00 . A A . 10 GLU O 1 1 18 10895 1 1 10 GLU OE1 O -6.270 -15.852 2.499 1.00 . A A . 10 GLU OE1 1 1 18 10896 1 1 10 GLU OE2 O -4.256 -16.588 2.018 1.00 . A A . 10 GLU OE2 1 1 18 10897 1 1 11 LYS C C -5.401 -8.110 0.517 1.00 . A A . 11 LYS C 1 1 18 10898 1 1 11 LYS CA C -5.865 -8.585 1.890 1.00 . A A . 11 LYS CA 1 1 18 10899 1 1 11 LYS CB C -5.708 -7.457 2.912 1.00 . A A . 11 LYS CB 1 1 18 10900 1 1 11 LYS CD C -6.098 -6.680 5.269 1.00 . A A . 11 LYS CD 1 1 18 10901 1 1 11 LYS CE C -6.524 -7.145 6.653 1.00 . A A . 11 LYS CE 1 1 18 10902 1 1 11 LYS CG C -6.478 -7.691 4.200 1.00 . A A . 11 LYS CG 1 1 18 10903 1 1 11 LYS H H -4.156 -9.815 2.110 1.00 . A A . 11 LYS H 1 1 18 10904 1 1 11 LYS HA H -6.906 -8.861 1.829 1.00 . A A . 11 LYS HA 1 1 18 10905 1 1 11 LYS HB2 H -4.661 -7.352 3.157 1.00 . A A . 11 LYS HB2 1 1 18 10906 1 1 11 LYS HB3 H -6.059 -6.535 2.470 1.00 . A A . 11 LYS HB3 1 1 18 10907 1 1 11 LYS HD2 H -5.027 -6.545 5.261 1.00 . A A . 11 LYS HD2 1 1 18 10908 1 1 11 LYS HD3 H -6.583 -5.738 5.050 1.00 . A A . 11 LYS HD3 1 1 18 10909 1 1 11 LYS HE2 H -6.621 -6.282 7.294 1.00 . A A . 11 LYS HE2 1 1 18 10910 1 1 11 LYS HE3 H -7.479 -7.642 6.573 1.00 . A A . 11 LYS HE3 1 1 18 10911 1 1 11 LYS HG2 H -7.535 -7.605 3.998 1.00 . A A . 11 LYS HG2 1 1 18 10912 1 1 11 LYS HG3 H -6.259 -8.685 4.564 1.00 . A A . 11 LYS HG3 1 1 18 10913 1 1 11 LYS HZ1 H -5.902 -9.058 7.216 1.00 . A A . 11 LYS HZ1 1 1 18 10914 1 1 11 LYS HZ2 H -5.354 -7.829 8.242 1.00 . A A . 11 LYS HZ2 1 1 18 10915 1 1 11 LYS HZ3 H -4.640 -8.044 6.724 1.00 . A A . 11 LYS HZ3 1 1 18 10916 1 1 11 LYS N N -5.113 -9.760 2.315 1.00 . A A . 11 LYS N 1 1 18 10917 1 1 11 LYS NZ N -5.536 -8.085 7.250 1.00 . A A . 11 LYS NZ 1 1 18 10918 1 1 11 LYS O O -4.274 -8.367 0.092 1.00 . A A . 11 LYS O 1 1 18 10919 1 1 12 PRO C C -4.965 -5.740 -1.491 1.00 . A A . 12 PRO C 1 1 18 10920 1 1 12 PRO CA C -5.989 -6.869 -1.529 1.00 . A A . 12 PRO CA 1 1 18 10921 1 1 12 PRO CB C -7.344 -6.346 -2.014 1.00 . A A . 12 PRO CB 1 1 18 10922 1 1 12 PRO CD C -7.648 -7.052 0.250 1.00 . A A . 12 PRO CD 1 1 18 10923 1 1 12 PRO CG C -8.100 -6.041 -0.767 1.00 . A A . 12 PRO CG 1 1 18 10924 1 1 12 PRO HA H -5.643 -7.646 -2.194 1.00 . A A . 12 PRO HA 1 1 18 10925 1 1 12 PRO HB2 H -7.196 -5.460 -2.614 1.00 . A A . 12 PRO HB2 1 1 18 10926 1 1 12 PRO HB3 H -7.839 -7.106 -2.599 1.00 . A A . 12 PRO HB3 1 1 18 10927 1 1 12 PRO HD2 H -7.632 -6.614 1.237 1.00 . A A . 12 PRO HD2 1 1 18 10928 1 1 12 PRO HD3 H -8.291 -7.920 0.231 1.00 . A A . 12 PRO HD3 1 1 18 10929 1 1 12 PRO HG2 H -7.867 -5.042 -0.432 1.00 . A A . 12 PRO HG2 1 1 18 10930 1 1 12 PRO HG3 H -9.160 -6.140 -0.947 1.00 . A A . 12 PRO HG3 1 1 18 10931 1 1 12 PRO N N -6.287 -7.397 -0.194 1.00 . A A . 12 PRO N 1 1 18 10932 1 1 12 PRO O O -4.439 -5.331 -2.526 1.00 . A A . 12 PRO O 1 1 18 10933 1 1 13 TYR C C -2.450 -4.662 0.547 1.00 . A A . 13 TYR C 1 1 18 10934 1 1 13 TYR CA C -3.726 -4.158 -0.119 1.00 . A A . 13 TYR CA 1 1 18 10935 1 1 13 TYR CB C -4.340 -3.032 0.715 1.00 . A A . 13 TYR CB 1 1 18 10936 1 1 13 TYR CD1 C -5.898 -1.667 -0.729 1.00 . A A . 13 TYR CD1 1 1 18 10937 1 1 13 TYR CD2 C -6.857 -3.205 0.819 1.00 . A A . 13 TYR CD2 1 1 18 10938 1 1 13 TYR CE1 C -7.161 -1.293 -1.147 1.00 . A A . 13 TYR CE1 1 1 18 10939 1 1 13 TYR CE2 C -8.124 -2.838 0.406 1.00 . A A . 13 TYR CE2 1 1 18 10940 1 1 13 TYR CG C -5.724 -2.627 0.260 1.00 . A A . 13 TYR CG 1 1 18 10941 1 1 13 TYR CZ C -8.270 -1.882 -0.577 1.00 . A A . 13 TYR CZ 1 1 18 10942 1 1 13 TYR H H -5.138 -5.609 0.496 1.00 . A A . 13 TYR H 1 1 18 10943 1 1 13 TYR HA H -3.480 -3.774 -1.098 1.00 . A A . 13 TYR HA 1 1 18 10944 1 1 13 TYR HB2 H -4.410 -3.352 1.743 1.00 . A A . 13 TYR HB2 1 1 18 10945 1 1 13 TYR HB3 H -3.703 -2.162 0.656 1.00 . A A . 13 TYR HB3 1 1 18 10946 1 1 13 TYR HD1 H -5.027 -1.208 -1.174 1.00 . A A . 13 TYR HD1 1 1 18 10947 1 1 13 TYR HD2 H -6.739 -3.954 1.589 1.00 . A A . 13 TYR HD2 1 1 18 10948 1 1 13 TYR HE1 H -7.276 -0.545 -1.917 1.00 . A A . 13 TYR HE1 1 1 18 10949 1 1 13 TYR HE2 H -8.993 -3.299 0.853 1.00 . A A . 13 TYR HE2 1 1 18 10950 1 1 13 TYR HH H -9.799 -0.718 -0.526 1.00 . A A . 13 TYR HH 1 1 18 10951 1 1 13 TYR N N -4.686 -5.241 -0.292 1.00 . A A . 13 TYR N 1 1 18 10952 1 1 13 TYR O O -2.421 -4.903 1.754 1.00 . A A . 13 TYR O 1 1 18 10953 1 1 13 TYR OH O -9.530 -1.513 -0.991 1.00 . A A . 13 TYR OH 1 1 18 10954 1 1 14 GLU C C 1.033 -4.442 -0.268 1.00 . A A . 14 GLU C 1 1 18 10955 1 1 14 GLU CA C -0.117 -5.293 0.264 1.00 . A A . 14 GLU CA 1 1 18 10956 1 1 14 GLU CB C 0.099 -6.758 -0.119 1.00 . A A . 14 GLU CB 1 1 18 10957 1 1 14 GLU CD C 0.311 -8.101 2.010 1.00 . A A . 14 GLU CD 1 1 18 10958 1 1 14 GLU CG C 1.034 -7.502 0.819 1.00 . A A . 14 GLU CG 1 1 18 10959 1 1 14 GLU H H -1.482 -4.608 -1.202 1.00 . A A . 14 GLU H 1 1 18 10960 1 1 14 GLU HA H -0.140 -5.212 1.341 1.00 . A A . 14 GLU HA 1 1 18 10961 1 1 14 GLU HB2 H -0.856 -7.263 -0.118 1.00 . A A . 14 GLU HB2 1 1 18 10962 1 1 14 GLU HB3 H 0.515 -6.799 -1.115 1.00 . A A . 14 GLU HB3 1 1 18 10963 1 1 14 GLU HG2 H 1.514 -8.299 0.271 1.00 . A A . 14 GLU HG2 1 1 18 10964 1 1 14 GLU HG3 H 1.784 -6.813 1.180 1.00 . A A . 14 GLU HG3 1 1 18 10965 1 1 14 GLU N N -1.396 -4.818 -0.248 1.00 . A A . 14 GLU N 1 1 18 10966 1 1 14 GLU O O 1.135 -4.199 -1.471 1.00 . A A . 14 GLU O 1 1 18 10967 1 1 14 GLU OE1 O -0.898 -8.386 1.889 1.00 . A A . 14 GLU OE1 1 1 18 10968 1 1 14 GLU OE2 O 0.956 -8.284 3.064 1.00 . A A . 14 GLU OE2 1 1 18 10969 1 1 15 CYS C C 3.981 -3.932 -0.662 1.00 . A A . 15 CYS C 1 1 18 10970 1 1 15 CYS CA C 3.037 -3.166 0.260 1.00 . A A . 15 CYS CA 1 1 18 10971 1 1 15 CYS CB C 3.791 -2.702 1.508 1.00 . A A . 15 CYS CB 1 1 18 10972 1 1 15 CYS H H 1.761 -4.218 1.581 1.00 . A A . 15 CYS H 1 1 18 10973 1 1 15 CYS HA H 2.663 -2.302 -0.266 1.00 . A A . 15 CYS HA 1 1 18 10974 1 1 15 CYS HB2 H 3.078 -2.490 2.292 1.00 . A A . 15 CYS HB2 1 1 18 10975 1 1 15 CYS HB3 H 4.453 -3.490 1.834 1.00 . A A . 15 CYS HB3 1 1 18 10976 1 1 15 CYS N N 1.895 -3.991 0.636 1.00 . A A . 15 CYS N 1 1 18 10977 1 1 15 CYS O O 3.815 -5.133 -0.879 1.00 . A A . 15 CYS O 1 1 18 10978 1 1 15 CYS SG S 4.794 -1.203 1.256 1.00 . A A . 15 CYS SG 1 1 18 10979 1 1 16 ASP C C 7.302 -3.984 -1.414 1.00 . A A . 16 ASP C 1 1 18 10980 1 1 16 ASP CA C 5.945 -3.844 -2.097 1.00 . A A . 16 ASP CA 1 1 18 10981 1 1 16 ASP CB C 6.086 -3.015 -3.374 1.00 . A A . 16 ASP CB 1 1 18 10982 1 1 16 ASP CG C 4.749 -2.722 -4.025 1.00 . A A . 16 ASP CG 1 1 18 10983 1 1 16 ASP H H 5.053 -2.277 -0.988 1.00 . A A . 16 ASP H 1 1 18 10984 1 1 16 ASP HA H 5.583 -4.828 -2.355 1.00 . A A . 16 ASP HA 1 1 18 10985 1 1 16 ASP HB2 H 6.562 -2.075 -3.135 1.00 . A A . 16 ASP HB2 1 1 18 10986 1 1 16 ASP HB3 H 6.700 -3.555 -4.080 1.00 . A A . 16 ASP HB3 1 1 18 10987 1 1 16 ASP N N 4.973 -3.231 -1.200 1.00 . A A . 16 ASP N 1 1 18 10988 1 1 16 ASP O O 7.973 -5.008 -1.547 1.00 . A A . 16 ASP O 1 1 18 10989 1 1 16 ASP OD1 O 4.176 -3.643 -4.644 1.00 . A A . 16 ASP OD1 1 1 18 10990 1 1 16 ASP OD2 O 4.275 -1.572 -3.916 1.00 . A A . 16 ASP OD2 1 1 18 10991 1 1 17 VAL C C 8.945 -3.911 1.207 1.00 . A A . 17 VAL C 1 1 18 10992 1 1 17 VAL CA C 8.978 -2.955 0.020 1.00 . A A . 17 VAL CA 1 1 18 10993 1 1 17 VAL CB C 9.351 -1.547 0.519 1.00 . A A . 17 VAL CB 1 1 18 10994 1 1 17 VAL CG1 C 10.647 -1.588 1.316 1.00 . A A . 17 VAL CG1 1 1 18 10995 1 1 17 VAL CG2 C 9.466 -0.580 -0.650 1.00 . A A . 17 VAL CG2 1 1 18 10996 1 1 17 VAL H H 7.122 -2.160 -0.616 1.00 . A A . 17 VAL H 1 1 18 10997 1 1 17 VAL HA H 9.739 -3.282 -0.673 1.00 . A A . 17 VAL HA 1 1 18 10998 1 1 17 VAL HB H 8.565 -1.197 1.172 1.00 . A A . 17 VAL HB 1 1 18 10999 1 1 17 VAL HG11 H 11.404 -1.016 0.801 1.00 . A A . 17 VAL HG11 1 1 18 11000 1 1 17 VAL HG12 H 10.480 -1.167 2.297 1.00 . A A . 17 VAL HG12 1 1 18 11001 1 1 17 VAL HG13 H 10.975 -2.613 1.415 1.00 . A A . 17 VAL HG13 1 1 18 11002 1 1 17 VAL HG21 H 10.482 -0.576 -1.016 1.00 . A A . 17 VAL HG21 1 1 18 11003 1 1 17 VAL HG22 H 8.800 -0.892 -1.440 1.00 . A A . 17 VAL HG22 1 1 18 11004 1 1 17 VAL HG23 H 9.197 0.414 -0.324 1.00 . A A . 17 VAL HG23 1 1 18 11005 1 1 17 VAL N N 7.701 -2.948 -0.684 1.00 . A A . 17 VAL N 1 1 18 11006 1 1 17 VAL O O 9.656 -4.916 1.229 1.00 . A A . 17 VAL O 1 1 18 11007 1 1 18 CYS C C 7.032 -5.584 3.142 1.00 . A A . 18 CYS C 1 1 18 11008 1 1 18 CYS CA C 7.990 -4.421 3.387 1.00 . A A . 18 CYS CA 1 1 18 11009 1 1 18 CYS CB C 7.498 -3.582 4.568 1.00 . A A . 18 CYS CB 1 1 18 11010 1 1 18 CYS H H 7.575 -2.776 2.121 1.00 . A A . 18 CYS H 1 1 18 11011 1 1 18 CYS HA H 8.966 -4.818 3.620 1.00 . A A . 18 CYS HA 1 1 18 11012 1 1 18 CYS HB2 H 7.636 -4.144 5.481 1.00 . A A . 18 CYS HB2 1 1 18 11013 1 1 18 CYS HB3 H 8.078 -2.673 4.620 1.00 . A A . 18 CYS HB3 1 1 18 11014 1 1 18 CYS N N 8.116 -3.591 2.195 1.00 . A A . 18 CYS N 1 1 18 11015 1 1 18 CYS O O 7.121 -6.623 3.795 1.00 . A A . 18 CYS O 1 1 18 11016 1 1 18 CYS SG S 5.740 -3.115 4.467 1.00 . A A . 18 CYS SG 1 1 18 11017 1 1 19 ARG C C 4.192 -6.678 3.031 1.00 . A A . 19 ARG C 1 1 18 11018 1 1 19 ARG CA C 5.144 -6.433 1.863 1.00 . A A . 19 ARG CA 1 1 18 11019 1 1 19 ARG CB C 5.856 -7.735 1.490 1.00 . A A . 19 ARG CB 1 1 18 11020 1 1 19 ARG CD C 6.241 -7.300 -0.955 1.00 . A A . 19 ARG CD 1 1 18 11021 1 1 19 ARG CG C 6.893 -7.568 0.392 1.00 . A A . 19 ARG CG 1 1 18 11022 1 1 19 ARG CZ C 6.006 -9.495 -2.037 1.00 . A A . 19 ARG CZ 1 1 18 11023 1 1 19 ARG H H 6.097 -4.550 1.708 1.00 . A A . 19 ARG H 1 1 18 11024 1 1 19 ARG HA H 4.572 -6.090 1.014 1.00 . A A . 19 ARG HA 1 1 18 11025 1 1 19 ARG HB2 H 6.351 -8.125 2.367 1.00 . A A . 19 ARG HB2 1 1 18 11026 1 1 19 ARG HB3 H 5.120 -8.450 1.155 1.00 . A A . 19 ARG HB3 1 1 18 11027 1 1 19 ARG HD2 H 5.583 -6.449 -0.859 1.00 . A A . 19 ARG HD2 1 1 18 11028 1 1 19 ARG HD3 H 7.013 -7.078 -1.676 1.00 . A A . 19 ARG HD3 1 1 18 11029 1 1 19 ARG HE H 4.499 -8.431 -1.280 1.00 . A A . 19 ARG HE 1 1 18 11030 1 1 19 ARG HG2 H 7.536 -6.737 0.640 1.00 . A A . 19 ARG HG2 1 1 18 11031 1 1 19 ARG HG3 H 7.480 -8.472 0.325 1.00 . A A . 19 ARG HG3 1 1 18 11032 1 1 19 ARG HH11 H 7.896 -8.789 -1.948 1.00 . A A . 19 ARG HH11 1 1 18 11033 1 1 19 ARG HH12 H 7.717 -10.336 -2.708 1.00 . A A . 19 ARG HH12 1 1 18 11034 1 1 19 ARG HH21 H 4.249 -10.466 -2.279 1.00 . A A . 19 ARG HH21 1 1 18 11035 1 1 19 ARG HH22 H 5.642 -11.288 -2.896 1.00 . A A . 19 ARG HH22 1 1 18 11036 1 1 19 ARG N N 6.118 -5.400 2.195 1.00 . A A . 19 ARG N 1 1 18 11037 1 1 19 ARG NE N 5.467 -8.446 -1.426 1.00 . A A . 19 ARG NE 1 1 18 11038 1 1 19 ARG NH1 N 7.314 -9.544 -2.249 1.00 . A A . 19 ARG NH1 1 1 18 11039 1 1 19 ARG NH2 N 5.236 -10.499 -2.437 1.00 . A A . 19 ARG NH2 1 1 18 11040 1 1 19 ARG O O 3.931 -7.822 3.404 1.00 . A A . 19 ARG O 1 1 18 11041 1 1 20 LYS C C 1.307 -5.584 4.255 1.00 . A A . 20 LYS C 1 1 18 11042 1 1 20 LYS CA C 2.753 -5.691 4.728 1.00 . A A . 20 LYS CA 1 1 18 11043 1 1 20 LYS CB C 3.049 -4.592 5.752 1.00 . A A . 20 LYS CB 1 1 18 11044 1 1 20 LYS CD C 2.726 -3.718 8.084 1.00 . A A . 20 LYS CD 1 1 18 11045 1 1 20 LYS CE C 1.830 -3.760 9.313 1.00 . A A . 20 LYS CE 1 1 18 11046 1 1 20 LYS CG C 2.352 -4.800 7.085 1.00 . A A . 20 LYS CG 1 1 18 11047 1 1 20 LYS H H 3.922 -4.710 3.261 1.00 . A A . 20 LYS H 1 1 18 11048 1 1 20 LYS HA H 2.897 -6.654 5.195 1.00 . A A . 20 LYS HA 1 1 18 11049 1 1 20 LYS HB2 H 4.114 -4.557 5.927 1.00 . A A . 20 LYS HB2 1 1 18 11050 1 1 20 LYS HB3 H 2.728 -3.643 5.346 1.00 . A A . 20 LYS HB3 1 1 18 11051 1 1 20 LYS HD2 H 3.750 -3.864 8.394 1.00 . A A . 20 LYS HD2 1 1 18 11052 1 1 20 LYS HD3 H 2.626 -2.752 7.610 1.00 . A A . 20 LYS HD3 1 1 18 11053 1 1 20 LYS HE2 H 1.773 -4.778 9.665 1.00 . A A . 20 LYS HE2 1 1 18 11054 1 1 20 LYS HE3 H 2.265 -3.138 10.081 1.00 . A A . 20 LYS HE3 1 1 18 11055 1 1 20 LYS HG2 H 1.284 -4.778 6.931 1.00 . A A . 20 LYS HG2 1 1 18 11056 1 1 20 LYS HG3 H 2.641 -5.762 7.486 1.00 . A A . 20 LYS HG3 1 1 18 11057 1 1 20 LYS HZ1 H 0.498 -2.454 8.373 1.00 . A A . 20 LYS HZ1 1 1 18 11058 1 1 20 LYS HZ2 H -0.020 -2.985 9.894 1.00 . A A . 20 LYS HZ2 1 1 18 11059 1 1 20 LYS HZ3 H -0.101 -4.025 8.563 1.00 . A A . 20 LYS HZ3 1 1 18 11060 1 1 20 LYS N N 3.677 -5.596 3.604 1.00 . A A . 20 LYS N 1 1 18 11061 1 1 20 LYS NZ N 0.455 -3.272 9.014 1.00 . A A . 20 LYS NZ 1 1 18 11062 1 1 20 LYS O O 1.031 -5.025 3.194 1.00 . A A . 20 LYS O 1 1 18 11063 1 1 21 ALA C C -1.750 -4.990 5.495 1.00 . A A . 21 ALA C 1 1 18 11064 1 1 21 ALA CA C -1.030 -6.084 4.715 1.00 . A A . 21 ALA CA 1 1 18 11065 1 1 21 ALA CB C -1.672 -7.437 4.983 1.00 . A A . 21 ALA CB 1 1 18 11066 1 1 21 ALA H H 0.671 -6.554 5.883 1.00 . A A . 21 ALA H 1 1 18 11067 1 1 21 ALA HA H -1.117 -5.876 3.658 1.00 . A A . 21 ALA HA 1 1 18 11068 1 1 21 ALA HB1 H -2.688 -7.293 5.319 1.00 . A A . 21 ALA HB1 1 1 18 11069 1 1 21 ALA HB2 H -1.673 -8.021 4.074 1.00 . A A . 21 ALA HB2 1 1 18 11070 1 1 21 ALA HB3 H -1.111 -7.957 5.745 1.00 . A A . 21 ALA HB3 1 1 18 11071 1 1 21 ALA N N 0.388 -6.123 5.050 1.00 . A A . 21 ALA N 1 1 18 11072 1 1 21 ALA O O -1.400 -4.697 6.638 1.00 . A A . 21 ALA O 1 1 18 11073 1 1 22 PHE C C -5.010 -3.458 5.181 1.00 . A A . 22 PHE C 1 1 18 11074 1 1 22 PHE CA C -3.526 -3.326 5.507 1.00 . A A . 22 PHE CA 1 1 18 11075 1 1 22 PHE CB C -3.013 -1.957 5.055 1.00 . A A . 22 PHE CB 1 1 18 11076 1 1 22 PHE CD1 C -0.701 -2.422 4.197 1.00 . A A . 22 PHE CD1 1 1 18 11077 1 1 22 PHE CD2 C -0.934 -1.086 6.158 1.00 . A A . 22 PHE CD2 1 1 18 11078 1 1 22 PHE CE1 C 0.673 -2.297 4.270 1.00 . A A . 22 PHE CE1 1 1 18 11079 1 1 22 PHE CE2 C 0.440 -0.956 6.236 1.00 . A A . 22 PHE CE2 1 1 18 11080 1 1 22 PHE CG C -1.520 -1.819 5.138 1.00 . A A . 22 PHE CG 1 1 18 11081 1 1 22 PHE CZ C 1.245 -1.564 5.292 1.00 . A A . 22 PHE CZ 1 1 18 11082 1 1 22 PHE H H -2.989 -4.668 3.960 1.00 . A A . 22 PHE H 1 1 18 11083 1 1 22 PHE HA H -3.394 -3.416 6.574 1.00 . A A . 22 PHE HA 1 1 18 11084 1 1 22 PHE HB2 H -3.304 -1.792 4.028 1.00 . A A . 22 PHE HB2 1 1 18 11085 1 1 22 PHE HB3 H -3.453 -1.192 5.677 1.00 . A A . 22 PHE HB3 1 1 18 11086 1 1 22 PHE HD1 H -1.147 -2.997 3.397 1.00 . A A . 22 PHE HD1 1 1 18 11087 1 1 22 PHE HD2 H -1.562 -0.611 6.897 1.00 . A A . 22 PHE HD2 1 1 18 11088 1 1 22 PHE HE1 H 1.299 -2.773 3.530 1.00 . A A . 22 PHE HE1 1 1 18 11089 1 1 22 PHE HE2 H 0.884 -0.383 7.036 1.00 . A A . 22 PHE HE2 1 1 18 11090 1 1 22 PHE HZ H 2.318 -1.464 5.350 1.00 . A A . 22 PHE HZ 1 1 18 11091 1 1 22 PHE N N -2.757 -4.389 4.871 1.00 . A A . 22 PHE N 1 1 18 11092 1 1 22 PHE O O -5.387 -4.097 4.199 1.00 . A A . 22 PHE O 1 1 18 11093 1 1 23 SER C C -7.716 -2.020 4.648 1.00 . A A . 23 SER C 1 1 18 11094 1 1 23 SER CA C -7.293 -2.903 5.818 1.00 . A A . 23 SER CA 1 1 18 11095 1 1 23 SER CB C -8.018 -2.463 7.092 1.00 . A A . 23 SER CB 1 1 18 11096 1 1 23 SER H H -5.488 -2.356 6.780 1.00 . A A . 23 SER H 1 1 18 11097 1 1 23 SER HA H -7.560 -3.926 5.597 1.00 . A A . 23 SER HA 1 1 18 11098 1 1 23 SER HB2 H -7.615 -3.001 7.936 1.00 . A A . 23 SER HB2 1 1 18 11099 1 1 23 SER HB3 H -7.873 -1.403 7.237 1.00 . A A . 23 SER HB3 1 1 18 11100 1 1 23 SER HG H -9.859 -1.954 6.655 1.00 . A A . 23 SER HG 1 1 18 11101 1 1 23 SER N N -5.849 -2.850 6.014 1.00 . A A . 23 SER N 1 1 18 11102 1 1 23 SER O O -8.251 -2.505 3.651 1.00 . A A . 23 SER O 1 1 18 11103 1 1 23 SER OG O -9.408 -2.726 7.004 1.00 . A A . 23 SER OG 1 1 18 11104 1 1 24 HIS C C -6.581 0.717 2.994 1.00 . A A . 24 HIS C 1 1 18 11105 1 1 24 HIS CA C -7.825 0.233 3.732 1.00 . A A . 24 HIS CA 1 1 18 11106 1 1 24 HIS CB C -8.573 1.425 4.330 1.00 . A A . 24 HIS CB 1 1 18 11107 1 1 24 HIS CD2 C -9.993 1.724 2.179 1.00 . A A . 24 HIS CD2 1 1 18 11108 1 1 24 HIS CE1 C -10.595 3.810 2.480 1.00 . A A . 24 HIS CE1 1 1 18 11109 1 1 24 HIS CG C -9.443 2.142 3.343 1.00 . A A . 24 HIS CG 1 1 18 11110 1 1 24 HIS H H -7.042 -0.394 5.596 1.00 . A A . 24 HIS H 1 1 18 11111 1 1 24 HIS HA H -8.472 -0.271 3.029 1.00 . A A . 24 HIS HA 1 1 18 11112 1 1 24 HIS HB2 H -9.203 1.078 5.136 1.00 . A A . 24 HIS HB2 1 1 18 11113 1 1 24 HIS HB3 H -7.856 2.134 4.718 1.00 . A A . 24 HIS HB3 1 1 18 11114 1 1 24 HIS HD1 H -9.601 4.035 4.254 1.00 . A A . 24 HIS HD1 1 1 18 11115 1 1 24 HIS HD2 H -9.892 0.742 1.738 1.00 . A A . 24 HIS HD2 1 1 18 11116 1 1 24 HIS HE1 H -11.047 4.780 2.336 1.00 . A A . 24 HIS HE1 1 1 18 11117 1 1 24 HIS N N -7.471 -0.720 4.778 1.00 . A A . 24 HIS N 1 1 18 11118 1 1 24 HIS ND1 N -9.838 3.453 3.503 1.00 . A A . 24 HIS ND1 1 1 18 11119 1 1 24 HIS NE2 N -10.704 2.779 1.663 1.00 . A A . 24 HIS NE2 1 1 18 11120 1 1 24 HIS O O -5.520 0.896 3.594 1.00 . A A . 24 HIS O 1 1 18 11121 1 1 25 HIS C C -4.828 2.495 1.579 1.00 . A A . 25 HIS C 1 1 18 11122 1 1 25 HIS CA C -5.603 1.389 0.868 1.00 . A A . 25 HIS CA 1 1 18 11123 1 1 25 HIS CB C -6.111 1.895 -0.482 1.00 . A A . 25 HIS CB 1 1 18 11124 1 1 25 HIS CD2 C -6.735 4.406 -0.658 1.00 . A A . 25 HIS CD2 1 1 18 11125 1 1 25 HIS CE1 C -8.807 4.272 0.047 1.00 . A A . 25 HIS CE1 1 1 18 11126 1 1 25 HIS CG C -6.986 3.106 -0.378 1.00 . A A . 25 HIS CG 1 1 18 11127 1 1 25 HIS H H -7.586 0.766 1.267 1.00 . A A . 25 HIS H 1 1 18 11128 1 1 25 HIS HA H -4.942 0.552 0.704 1.00 . A A . 25 HIS HA 1 1 18 11129 1 1 25 HIS HB2 H -5.267 2.149 -1.105 1.00 . A A . 25 HIS HB2 1 1 18 11130 1 1 25 HIS HB3 H -6.683 1.112 -0.960 1.00 . A A . 25 HIS HB3 1 1 18 11131 1 1 25 HIS HD1 H -8.770 2.248 0.344 1.00 . A A . 25 HIS HD1 1 1 18 11132 1 1 25 HIS HD2 H -5.806 4.815 -1.029 1.00 . A A . 25 HIS HD2 1 1 18 11133 1 1 25 HIS HE1 H -9.812 4.537 0.340 1.00 . A A . 25 HIS HE1 1 1 18 11134 1 1 25 HIS N N -6.717 0.926 1.688 1.00 . A A . 25 HIS N 1 1 18 11135 1 1 25 HIS ND1 N -8.292 3.055 0.063 1.00 . A A . 25 HIS ND1 1 1 18 11136 1 1 25 HIS NE2 N -7.883 5.110 -0.386 1.00 . A A . 25 HIS NE2 1 1 18 11137 1 1 25 HIS O O -3.612 2.403 1.750 1.00 . A A . 25 HIS O 1 1 18 11138 1 1 26 ALA C C -3.754 4.195 3.551 1.00 . A A . 26 ALA C 1 1 18 11139 1 1 26 ALA CA C -4.918 4.661 2.683 1.00 . A A . 26 ALA CA 1 1 18 11140 1 1 26 ALA CB C -5.948 5.395 3.529 1.00 . A A . 26 ALA CB 1 1 18 11141 1 1 26 ALA H H -6.505 3.555 1.825 1.00 . A A . 26 ALA H 1 1 18 11142 1 1 26 ALA HA H -4.545 5.349 1.938 1.00 . A A . 26 ALA HA 1 1 18 11143 1 1 26 ALA HB1 H -6.853 4.808 3.582 1.00 . A A . 26 ALA HB1 1 1 18 11144 1 1 26 ALA HB2 H -5.556 5.542 4.525 1.00 . A A . 26 ALA HB2 1 1 18 11145 1 1 26 ALA HB3 H -6.165 6.353 3.081 1.00 . A A . 26 ALA HB3 1 1 18 11146 1 1 26 ALA N N -5.539 3.539 1.990 1.00 . A A . 26 ALA N 1 1 18 11147 1 1 26 ALA O O -2.598 4.519 3.281 1.00 . A A . 26 ALA O 1 1 18 11148 1 1 27 SER C C -1.775 2.559 4.744 1.00 . A A . 27 SER C 1 1 18 11149 1 1 27 SER CA C -3.047 2.924 5.503 1.00 . A A . 27 SER CA 1 1 18 11150 1 1 27 SER CB C -3.572 1.703 6.260 1.00 . A A . 27 SER CB 1 1 18 11151 1 1 27 SER H H -5.008 3.208 4.755 1.00 . A A . 27 SER H 1 1 18 11152 1 1 27 SER HA H -2.817 3.706 6.212 1.00 . A A . 27 SER HA 1 1 18 11153 1 1 27 SER HB2 H -4.638 1.797 6.395 1.00 . A A . 27 SER HB2 1 1 18 11154 1 1 27 SER HB3 H -3.358 0.810 5.690 1.00 . A A . 27 SER HB3 1 1 18 11155 1 1 27 SER HG H -2.865 0.662 7.762 1.00 . A A . 27 SER HG 1 1 18 11156 1 1 27 SER N N -4.067 3.432 4.593 1.00 . A A . 27 SER N 1 1 18 11157 1 1 27 SER O O -0.670 2.918 5.152 1.00 . A A . 27 SER O 1 1 18 11158 1 1 27 SER OG O -2.958 1.590 7.533 1.00 . A A . 27 SER OG 1 1 18 11159 1 1 28 LEU C C -0.218 2.613 2.060 1.00 . A A . 28 LEU C 1 1 18 11160 1 1 28 LEU CA C -0.806 1.427 2.819 1.00 . A A . 28 LEU CA 1 1 18 11161 1 1 28 LEU CB C -1.234 0.339 1.834 1.00 . A A . 28 LEU CB 1 1 18 11162 1 1 28 LEU CD1 C 1.047 -0.414 1.119 1.00 . A A . 28 LEU CD1 1 1 18 11163 1 1 28 LEU CD2 C -0.931 -0.866 -0.344 1.00 . A A . 28 LEU CD2 1 1 18 11164 1 1 28 LEU CG C -0.302 0.104 0.645 1.00 . A A . 28 LEU CG 1 1 18 11165 1 1 28 LEU H H -2.845 1.587 3.363 1.00 . A A . 28 LEU H 1 1 18 11166 1 1 28 LEU HA H -0.050 1.028 3.479 1.00 . A A . 28 LEU HA 1 1 18 11167 1 1 28 LEU HB2 H -1.312 -0.589 2.380 1.00 . A A . 28 LEU HB2 1 1 18 11168 1 1 28 LEU HB3 H -2.206 0.609 1.445 1.00 . A A . 28 LEU HB3 1 1 18 11169 1 1 28 LEU HD11 H 1.105 -1.478 0.945 1.00 . A A . 28 LEU HD11 1 1 18 11170 1 1 28 LEU HD12 H 1.159 -0.215 2.174 1.00 . A A . 28 LEU HD12 1 1 18 11171 1 1 28 LEU HD13 H 1.836 0.083 0.573 1.00 . A A . 28 LEU HD13 1 1 18 11172 1 1 28 LEU HD21 H -0.275 -1.712 -0.484 1.00 . A A . 28 LEU HD21 1 1 18 11173 1 1 28 LEU HD22 H -1.083 -0.367 -1.290 1.00 . A A . 28 LEU HD22 1 1 18 11174 1 1 28 LEU HD23 H -1.882 -1.206 0.041 1.00 . A A . 28 LEU HD23 1 1 18 11175 1 1 28 LEU HG H -0.137 1.043 0.135 1.00 . A A . 28 LEU HG 1 1 18 11176 1 1 28 LEU N N -1.940 1.843 3.637 1.00 . A A . 28 LEU N 1 1 18 11177 1 1 28 LEU O O 1.000 2.759 1.961 1.00 . A A . 28 LEU O 1 1 18 11178 1 1 29 THR C C 0.199 5.550 1.640 1.00 . A A . 29 THR C 1 1 18 11179 1 1 29 THR CA C -0.662 4.634 0.779 1.00 . A A . 29 THR CA 1 1 18 11180 1 1 29 THR CB C -1.866 5.433 0.245 1.00 . A A . 29 THR CB 1 1 18 11181 1 1 29 THR CG2 C -1.438 6.824 -0.199 1.00 . A A . 29 THR CG2 1 1 18 11182 1 1 29 THR H H -2.052 3.290 1.640 1.00 . A A . 29 THR H 1 1 18 11183 1 1 29 THR HA H -0.079 4.295 -0.065 1.00 . A A . 29 THR HA 1 1 18 11184 1 1 29 THR HB H -2.593 5.532 1.038 1.00 . A A . 29 THR HB 1 1 18 11185 1 1 29 THR HG1 H -2.915 5.369 -1.425 1.00 . A A . 29 THR HG1 1 1 18 11186 1 1 29 THR HG21 H -0.361 6.888 -0.192 1.00 . A A . 29 THR HG21 1 1 18 11187 1 1 29 THR HG22 H -1.847 7.559 0.477 1.00 . A A . 29 THR HG22 1 1 18 11188 1 1 29 THR HG23 H -1.803 7.011 -1.198 1.00 . A A . 29 THR HG23 1 1 18 11189 1 1 29 THR N N -1.094 3.460 1.527 1.00 . A A . 29 THR N 1 1 18 11190 1 1 29 THR O O 1.332 5.870 1.281 1.00 . A A . 29 THR O 1 1 18 11191 1 1 29 THR OG1 O -2.466 4.739 -0.855 1.00 . A A . 29 THR OG1 1 1 18 11192 1 1 30 GLN C C 1.628 6.163 4.231 1.00 . A A . 30 GLN C 1 1 18 11193 1 1 30 GLN CA C 0.376 6.847 3.692 1.00 . A A . 30 GLN CA 1 1 18 11194 1 1 30 GLN CB C -0.530 7.267 4.851 1.00 . A A . 30 GLN CB 1 1 18 11195 1 1 30 GLN CD C -1.107 9.056 6.538 1.00 . A A . 30 GLN CD 1 1 18 11196 1 1 30 GLN CG C -0.094 8.556 5.528 1.00 . A A . 30 GLN CG 1 1 18 11197 1 1 30 GLN H H -1.251 5.677 3.010 1.00 . A A . 30 GLN H 1 1 18 11198 1 1 30 GLN HA H 0.671 7.727 3.140 1.00 . A A . 30 GLN HA 1 1 18 11199 1 1 30 GLN HB2 H -1.533 7.403 4.476 1.00 . A A . 30 GLN HB2 1 1 18 11200 1 1 30 GLN HB3 H -0.534 6.481 5.591 1.00 . A A . 30 GLN HB3 1 1 18 11201 1 1 30 GLN HE21 H 0.291 9.108 7.951 1.00 . A A . 30 GLN HE21 1 1 18 11202 1 1 30 GLN HE22 H -1.290 9.602 8.441 1.00 . A A . 30 GLN HE22 1 1 18 11203 1 1 30 GLN HG2 H 0.843 8.381 6.037 1.00 . A A . 30 GLN HG2 1 1 18 11204 1 1 30 GLN HG3 H 0.045 9.315 4.772 1.00 . A A . 30 GLN HG3 1 1 18 11205 1 1 30 GLN N N -0.345 5.967 2.779 1.00 . A A . 30 GLN N 1 1 18 11206 1 1 30 GLN NE2 N -0.657 9.277 7.768 1.00 . A A . 30 GLN NE2 1 1 18 11207 1 1 30 GLN O O 2.681 6.789 4.364 1.00 . A A . 30 GLN O 1 1 18 11208 1 1 30 GLN OE1 O -2.281 9.242 6.217 1.00 . A A . 30 GLN OE1 1 1 18 11209 1 1 31 HIS C C 3.804 4.127 4.093 1.00 . A A . 31 HIS C 1 1 18 11210 1 1 31 HIS CA C 2.630 4.108 5.067 1.00 . A A . 31 HIS CA 1 1 18 11211 1 1 31 HIS CB C 2.203 2.665 5.342 1.00 . A A . 31 HIS CB 1 1 18 11212 1 1 31 HIS CD2 C 3.686 0.829 4.266 1.00 . A A . 31 HIS CD2 1 1 18 11213 1 1 31 HIS CE1 C 5.112 0.564 5.910 1.00 . A A . 31 HIS CE1 1 1 18 11214 1 1 31 HIS CG C 3.329 1.681 5.255 1.00 . A A . 31 HIS CG 1 1 18 11215 1 1 31 HIS H H 0.643 4.434 4.413 1.00 . A A . 31 HIS H 1 1 18 11216 1 1 31 HIS HA H 2.940 4.565 5.994 1.00 . A A . 31 HIS HA 1 1 18 11217 1 1 31 HIS HB2 H 1.785 2.604 6.336 1.00 . A A . 31 HIS HB2 1 1 18 11218 1 1 31 HIS HB3 H 1.452 2.375 4.622 1.00 . A A . 31 HIS HB3 1 1 18 11219 1 1 31 HIS HD1 H 4.250 1.963 7.129 1.00 . A A . 31 HIS HD1 1 1 18 11220 1 1 31 HIS HD2 H 3.190 0.709 3.313 1.00 . A A . 31 HIS HD2 1 1 18 11221 1 1 31 HIS HE1 H 5.940 0.209 6.504 1.00 . A A . 31 HIS HE1 1 1 18 11222 1 1 31 HIS N N 1.507 4.876 4.541 1.00 . A A . 31 HIS N 1 1 18 11223 1 1 31 HIS ND1 N 4.241 1.490 6.271 1.00 . A A . 31 HIS ND1 1 1 18 11224 1 1 31 HIS NE2 N 4.797 0.147 4.697 1.00 . A A . 31 HIS NE2 1 1 18 11225 1 1 31 HIS O O 4.939 4.401 4.482 1.00 . A A . 31 HIS O 1 1 18 11226 1 1 32 GLN C C 5.610 4.885 2.068 1.00 . A A . 32 GLN C 1 1 18 11227 1 1 32 GLN CA C 4.557 3.815 1.800 1.00 . A A . 32 GLN CA 1 1 18 11228 1 1 32 GLN CB C 3.936 4.029 0.418 1.00 . A A . 32 GLN CB 1 1 18 11229 1 1 32 GLN CD C 3.098 2.898 -1.680 1.00 . A A . 32 GLN CD 1 1 18 11230 1 1 32 GLN CG C 3.360 2.762 -0.193 1.00 . A A . 32 GLN CG 1 1 18 11231 1 1 32 GLN H H 2.599 3.623 2.580 1.00 . A A . 32 GLN H 1 1 18 11232 1 1 32 GLN HA H 5.031 2.846 1.824 1.00 . A A . 32 GLN HA 1 1 18 11233 1 1 32 GLN HB2 H 3.142 4.756 0.502 1.00 . A A . 32 GLN HB2 1 1 18 11234 1 1 32 GLN HB3 H 4.694 4.412 -0.249 1.00 . A A . 32 GLN HB3 1 1 18 11235 1 1 32 GLN HE21 H 3.941 1.129 -2.015 1.00 . A A . 32 GLN HE21 1 1 18 11236 1 1 32 GLN HE22 H 3.347 1.954 -3.411 1.00 . A A . 32 GLN HE22 1 1 18 11237 1 1 32 GLN HG2 H 4.059 1.953 -0.039 1.00 . A A . 32 GLN HG2 1 1 18 11238 1 1 32 GLN HG3 H 2.428 2.531 0.302 1.00 . A A . 32 GLN HG3 1 1 18 11239 1 1 32 GLN N N 3.523 3.833 2.828 1.00 . A A . 32 GLN N 1 1 18 11240 1 1 32 GLN NE2 N 3.503 1.893 -2.447 1.00 . A A . 32 GLN NE2 1 1 18 11241 1 1 32 GLN O O 6.797 4.678 1.816 1.00 . A A . 32 GLN O 1 1 18 11242 1 1 32 GLN OE1 O 2.539 3.896 -2.135 1.00 . A A . 32 GLN OE1 1 1 18 11243 1 1 33 ARG C C 7.364 6.618 3.511 1.00 . A A . 33 ARG C 1 1 18 11244 1 1 33 ARG CA C 6.072 7.131 2.883 1.00 . A A . 33 ARG CA 1 1 18 11245 1 1 33 ARG CB C 5.396 8.131 3.824 1.00 . A A . 33 ARG CB 1 1 18 11246 1 1 33 ARG CD C 4.254 10.366 3.947 1.00 . A A . 33 ARG CD 1 1 18 11247 1 1 33 ARG CG C 4.483 9.115 3.112 1.00 . A A . 33 ARG CG 1 1 18 11248 1 1 33 ARG CZ C 5.681 12.108 2.961 1.00 . A A . 33 ARG CZ 1 1 18 11249 1 1 33 ARG H H 4.209 6.133 2.761 1.00 . A A . 33 ARG H 1 1 18 11250 1 1 33 ARG HA H 6.309 7.629 1.954 1.00 . A A . 33 ARG HA 1 1 18 11251 1 1 33 ARG HB2 H 4.807 7.585 4.547 1.00 . A A . 33 ARG HB2 1 1 18 11252 1 1 33 ARG HB3 H 6.159 8.691 4.342 1.00 . A A . 33 ARG HB3 1 1 18 11253 1 1 33 ARG HD2 H 3.406 10.900 3.545 1.00 . A A . 33 ARG HD2 1 1 18 11254 1 1 33 ARG HD3 H 4.044 10.070 4.964 1.00 . A A . 33 ARG HD3 1 1 18 11255 1 1 33 ARG HE H 6.030 11.199 4.702 1.00 . A A . 33 ARG HE 1 1 18 11256 1 1 33 ARG HG2 H 4.936 9.400 2.174 1.00 . A A . 33 ARG HG2 1 1 18 11257 1 1 33 ARG HG3 H 3.532 8.639 2.925 1.00 . A A . 33 ARG HG3 1 1 18 11258 1 1 33 ARG HH11 H 4.056 11.619 1.865 1.00 . A A . 33 ARG HH11 1 1 18 11259 1 1 33 ARG HH12 H 5.071 12.846 1.181 1.00 . A A . 33 ARG HH12 1 1 18 11260 1 1 33 ARG HH21 H 7.374 12.813 3.812 1.00 . A A . 33 ARG HH21 1 1 18 11261 1 1 33 ARG HH22 H 6.958 13.524 2.289 1.00 . A A . 33 ARG HH22 1 1 18 11262 1 1 33 ARG N N 5.167 6.028 2.581 1.00 . A A . 33 ARG N 1 1 18 11263 1 1 33 ARG NE N 5.417 11.249 3.939 1.00 . A A . 33 ARG NE 1 1 18 11264 1 1 33 ARG NH1 N 4.870 12.198 1.916 1.00 . A A . 33 ARG NH1 1 1 18 11265 1 1 33 ARG NH2 N 6.760 12.878 3.026 1.00 . A A . 33 ARG NH2 1 1 18 11266 1 1 33 ARG O O 8.458 6.887 3.014 1.00 . A A . 33 ARG O 1 1 18 11267 1 1 34 VAL C C 9.443 4.844 4.317 1.00 . A A . 34 VAL C 1 1 18 11268 1 1 34 VAL CA C 8.387 5.328 5.304 1.00 . A A . 34 VAL CA 1 1 18 11269 1 1 34 VAL CB C 7.984 4.159 6.223 1.00 . A A . 34 VAL CB 1 1 18 11270 1 1 34 VAL CG1 C 7.017 4.633 7.297 1.00 . A A . 34 VAL CG1 1 1 18 11271 1 1 34 VAL CG2 C 7.376 3.027 5.408 1.00 . A A . 34 VAL CG2 1 1 18 11272 1 1 34 VAL H H 6.332 5.699 4.956 1.00 . A A . 34 VAL H 1 1 18 11273 1 1 34 VAL HA H 8.811 6.110 5.917 1.00 . A A . 34 VAL HA 1 1 18 11274 1 1 34 VAL HB H 8.874 3.787 6.709 1.00 . A A . 34 VAL HB 1 1 18 11275 1 1 34 VAL HG11 H 6.350 5.372 6.880 1.00 . A A . 34 VAL HG11 1 1 18 11276 1 1 34 VAL HG12 H 6.444 3.793 7.662 1.00 . A A . 34 VAL HG12 1 1 18 11277 1 1 34 VAL HG13 H 7.574 5.071 8.113 1.00 . A A . 34 VAL HG13 1 1 18 11278 1 1 34 VAL HG21 H 6.626 2.521 5.998 1.00 . A A . 34 VAL HG21 1 1 18 11279 1 1 34 VAL HG22 H 6.921 3.431 4.516 1.00 . A A . 34 VAL HG22 1 1 18 11280 1 1 34 VAL HG23 H 8.149 2.325 5.132 1.00 . A A . 34 VAL HG23 1 1 18 11281 1 1 34 VAL N N 7.230 5.879 4.608 1.00 . A A . 34 VAL N 1 1 18 11282 1 1 34 VAL O O 10.641 5.031 4.532 1.00 . A A . 34 VAL O 1 1 18 11283 1 1 35 HIS C C 10.306 4.817 1.245 1.00 . A A . 35 HIS C 1 1 18 11284 1 1 35 HIS CA C 9.898 3.710 2.211 1.00 . A A . 35 HIS CA 1 1 18 11285 1 1 35 HIS CB C 9.240 2.563 1.443 1.00 . A A . 35 HIS CB 1 1 18 11286 1 1 35 HIS CD2 C 7.522 0.781 2.217 1.00 . A A . 35 HIS CD2 1 1 18 11287 1 1 35 HIS CE1 C 8.529 0.142 4.057 1.00 . A A . 35 HIS CE1 1 1 18 11288 1 1 35 HIS CG C 8.661 1.503 2.329 1.00 . A A . 35 HIS CG 1 1 18 11289 1 1 35 HIS H H 8.026 4.102 3.118 1.00 . A A . 35 HIS H 1 1 18 11290 1 1 35 HIS HA H 10.782 3.339 2.708 1.00 . A A . 35 HIS HA 1 1 18 11291 1 1 35 HIS HB2 H 8.441 2.958 0.834 1.00 . A A . 35 HIS HB2 1 1 18 11292 1 1 35 HIS HB3 H 9.977 2.097 0.804 1.00 . A A . 35 HIS HB3 1 1 18 11293 1 1 35 HIS HD1 H 10.116 1.416 3.850 1.00 . A A . 35 HIS HD1 1 1 18 11294 1 1 35 HIS HD2 H 6.794 0.850 1.421 1.00 . A A . 35 HIS HD2 1 1 18 11295 1 1 35 HIS HE1 H 8.756 -0.373 4.978 1.00 . A A . 35 HIS HE1 1 1 18 11296 1 1 35 HIS N N 8.991 4.220 3.233 1.00 . A A . 35 HIS N 1 1 18 11297 1 1 35 HIS ND1 N 9.269 1.080 3.492 1.00 . A A . 35 HIS ND1 1 1 18 11298 1 1 35 HIS NE2 N 7.463 -0.058 3.303 1.00 . A A . 35 HIS NE2 1 1 18 11299 1 1 35 HIS O O 9.457 5.524 0.701 1.00 . A A . 35 HIS O 1 1 18 11300 1 1 36 SER C C 12.069 5.521 -1.313 1.00 . A A . 36 SER C 1 1 18 11301 1 1 36 SER CA C 12.131 5.987 0.138 1.00 . A A . 36 SER CA 1 1 18 11302 1 1 36 SER CB C 13.573 6.338 0.512 1.00 . A A . 36 SER CB 1 1 18 11303 1 1 36 SER H H 12.238 4.368 1.499 1.00 . A A . 36 SER H 1 1 18 11304 1 1 36 SER HA H 11.516 6.868 0.248 1.00 . A A . 36 SER HA 1 1 18 11305 1 1 36 SER HB2 H 13.659 6.399 1.586 1.00 . A A . 36 SER HB2 1 1 18 11306 1 1 36 SER HB3 H 14.235 5.569 0.141 1.00 . A A . 36 SER HB3 1 1 18 11307 1 1 36 SER HG H 13.489 8.292 0.396 1.00 . A A . 36 SER HG 1 1 18 11308 1 1 36 SER N N 11.611 4.963 1.036 1.00 . A A . 36 SER N 1 1 18 11309 1 1 36 SER O O 11.467 6.176 -2.162 1.00 . A A . 36 SER O 1 1 18 11310 1 1 36 SER OG O 13.957 7.581 -0.049 1.00 . A A . 36 SER OG 1 1 18 11311 1 1 37 GLY C C 13.897 2.951 -3.201 1.00 . A A . 37 GLY C 1 1 18 11312 1 1 37 GLY CA C 12.703 3.846 -2.938 1.00 . A A . 37 GLY CA 1 1 18 11313 1 1 37 GLY H H 13.162 3.902 -0.872 1.00 . A A . 37 GLY H 1 1 18 11314 1 1 37 GLY HA2 H 11.799 3.276 -3.091 1.00 . A A . 37 GLY HA2 1 1 18 11315 1 1 37 GLY HA3 H 12.722 4.667 -3.639 1.00 . A A . 37 GLY HA3 1 1 18 11316 1 1 37 GLY N N 12.698 4.382 -1.589 1.00 . A A . 37 GLY N 1 1 18 11317 1 1 37 GLY O O 14.822 3.334 -3.917 1.00 . A A . 37 GLY O 1 1 18 11318 1 1 38 GLU C C 15.550 0.894 -4.204 1.00 . A A . 38 GLU C 1 1 18 11319 1 1 38 GLU CA C 14.971 0.805 -2.795 1.00 . A A . 38 GLU CA 1 1 18 11320 1 1 38 GLU CB C 14.485 -0.620 -2.521 1.00 . A A . 38 GLU CB 1 1 18 11321 1 1 38 GLU CD C 16.305 -2.135 -3.400 1.00 . A A . 38 GLU CD 1 1 18 11322 1 1 38 GLU CG C 15.603 -1.588 -2.172 1.00 . A A . 38 GLU CG 1 1 18 11323 1 1 38 GLU H H 13.113 1.507 -2.061 1.00 . A A . 38 GLU H 1 1 18 11324 1 1 38 GLU HA H 15.744 1.054 -2.084 1.00 . A A . 38 GLU HA 1 1 18 11325 1 1 38 GLU HB2 H 13.786 -0.597 -1.698 1.00 . A A . 38 GLU HB2 1 1 18 11326 1 1 38 GLU HB3 H 13.978 -0.990 -3.401 1.00 . A A . 38 GLU HB3 1 1 18 11327 1 1 38 GLU HG2 H 16.328 -1.075 -1.560 1.00 . A A . 38 GLU HG2 1 1 18 11328 1 1 38 GLU HG3 H 15.185 -2.415 -1.617 1.00 . A A . 38 GLU HG3 1 1 18 11329 1 1 38 GLU N N 13.879 1.755 -2.620 1.00 . A A . 38 GLU N 1 1 18 11330 1 1 38 GLU O O 14.813 0.939 -5.189 1.00 . A A . 38 GLU O 1 1 18 11331 1 1 38 GLU OE1 O 15.611 -2.642 -4.305 1.00 . A A . 38 GLU OE1 1 1 18 11332 1 1 38 GLU OE2 O 17.550 -2.054 -3.455 1.00 . A A . 38 GLU OE2 1 1 18 11333 1 1 39 LYS C C 16.837 0.165 -6.629 1.00 . A A . 39 LYS C 1 1 18 11334 1 1 39 LYS CA C 17.556 1.004 -5.578 1.00 . A A . 39 LYS CA 1 1 18 11335 1 1 39 LYS CB C 19.007 0.537 -5.442 1.00 . A A . 39 LYS CB 1 1 18 11336 1 1 39 LYS CD C 20.427 2.608 -5.375 1.00 . A A . 39 LYS CD 1 1 18 11337 1 1 39 LYS CE C 21.581 2.165 -6.260 1.00 . A A . 39 LYS CE 1 1 18 11338 1 1 39 LYS CG C 19.860 1.447 -4.575 1.00 . A A . 39 LYS CG 1 1 18 11339 1 1 39 LYS H H 17.410 0.883 -3.470 1.00 . A A . 39 LYS H 1 1 18 11340 1 1 39 LYS HA H 17.548 2.037 -5.892 1.00 . A A . 39 LYS HA 1 1 18 11341 1 1 39 LYS HB2 H 19.015 -0.451 -5.007 1.00 . A A . 39 LYS HB2 1 1 18 11342 1 1 39 LYS HB3 H 19.452 0.492 -6.426 1.00 . A A . 39 LYS HB3 1 1 18 11343 1 1 39 LYS HD2 H 19.647 3.019 -5.998 1.00 . A A . 39 LYS HD2 1 1 18 11344 1 1 39 LYS HD3 H 20.780 3.367 -4.690 1.00 . A A . 39 LYS HD3 1 1 18 11345 1 1 39 LYS HE2 H 21.336 1.210 -6.698 1.00 . A A . 39 LYS HE2 1 1 18 11346 1 1 39 LYS HE3 H 21.717 2.896 -7.044 1.00 . A A . 39 LYS HE3 1 1 18 11347 1 1 39 LYS HG2 H 19.253 1.839 -3.773 1.00 . A A . 39 LYS HG2 1 1 18 11348 1 1 39 LYS HG3 H 20.678 0.873 -4.163 1.00 . A A . 39 LYS HG3 1 1 18 11349 1 1 39 LYS HZ1 H 23.020 1.039 -5.248 1.00 . A A . 39 LYS HZ1 1 1 18 11350 1 1 39 LYS HZ2 H 22.797 2.593 -4.617 1.00 . A A . 39 LYS HZ2 1 1 18 11351 1 1 39 LYS HZ3 H 23.649 2.382 -6.062 1.00 . A A . 39 LYS HZ3 1 1 18 11352 1 1 39 LYS N N 16.875 0.921 -4.291 1.00 . A A . 39 LYS N 1 1 18 11353 1 1 39 LYS NZ N 22.851 2.035 -5.493 1.00 . A A . 39 LYS NZ 1 1 18 11354 1 1 39 LYS O O 16.990 -1.055 -6.695 1.00 . A A . 39 LYS O 1 1 18 11355 1 1 40 PRO C C 16.181 -0.354 -9.652 1.00 . A A . 40 PRO C 1 1 18 11356 1 1 40 PRO CA C 15.279 0.167 -8.538 1.00 . A A . 40 PRO CA 1 1 18 11357 1 1 40 PRO CB C 14.362 1.273 -9.066 1.00 . A A . 40 PRO CB 1 1 18 11358 1 1 40 PRO CD C 15.806 2.286 -7.452 1.00 . A A . 40 PRO CD 1 1 18 11359 1 1 40 PRO CG C 15.072 2.541 -8.740 1.00 . A A . 40 PRO CG 1 1 18 11360 1 1 40 PRO HA H 14.680 -0.645 -8.152 1.00 . A A . 40 PRO HA 1 1 18 11361 1 1 40 PRO HB2 H 14.229 1.156 -10.132 1.00 . A A . 40 PRO HB2 1 1 18 11362 1 1 40 PRO HB3 H 13.404 1.219 -8.570 1.00 . A A . 40 PRO HB3 1 1 18 11363 1 1 40 PRO HD2 H 16.742 2.824 -7.439 1.00 . A A . 40 PRO HD2 1 1 18 11364 1 1 40 PRO HD3 H 15.195 2.567 -6.608 1.00 . A A . 40 PRO HD3 1 1 18 11365 1 1 40 PRO HG2 H 15.770 2.784 -9.527 1.00 . A A . 40 PRO HG2 1 1 18 11366 1 1 40 PRO HG3 H 14.357 3.340 -8.611 1.00 . A A . 40 PRO HG3 1 1 18 11367 1 1 40 PRO N N 16.035 0.832 -7.473 1.00 . A A . 40 PRO N 1 1 18 11368 1 1 40 PRO O O 16.062 -1.504 -10.074 1.00 . A A . 40 PRO O 1 1 18 11369 1 1 41 SER C C 17.307 -0.750 -12.227 1.00 . A A . 41 SER C 1 1 18 11370 1 1 41 SER CA C 18.004 0.127 -11.191 1.00 . A A . 41 SER CA 1 1 18 11371 1 1 41 SER CB C 19.215 -0.609 -10.615 1.00 . A A . 41 SER CB 1 1 18 11372 1 1 41 SER H H 17.129 1.404 -9.746 1.00 . A A . 41 SER H 1 1 18 11373 1 1 41 SER HA H 18.340 1.034 -11.672 1.00 . A A . 41 SER HA 1 1 18 11374 1 1 41 SER HB2 H 19.922 -0.809 -11.406 1.00 . A A . 41 SER HB2 1 1 18 11375 1 1 41 SER HB3 H 19.684 0.009 -9.862 1.00 . A A . 41 SER HB3 1 1 18 11376 1 1 41 SER HG H 19.471 -2.083 -9.351 1.00 . A A . 41 SER HG 1 1 18 11377 1 1 41 SER N N 17.084 0.500 -10.124 1.00 . A A . 41 SER N 1 1 18 11378 1 1 41 SER O O 17.861 -1.750 -12.683 1.00 . A A . 41 SER O 1 1 18 11379 1 1 41 SER OG O 18.832 -1.838 -10.023 1.00 . A A . 41 SER OG 1 1 18 11380 1 1 42 GLY C C 14.978 -2.517 -13.079 1.00 . A A . 42 GLY C 1 1 18 11381 1 1 42 GLY CA C 15.335 -1.129 -13.573 1.00 . A A . 42 GLY CA 1 1 18 11382 1 1 42 GLY H H 15.697 0.439 -12.197 1.00 . A A . 42 GLY H 1 1 18 11383 1 1 42 GLY HA2 H 14.425 -0.596 -13.805 1.00 . A A . 42 GLY HA2 1 1 18 11384 1 1 42 GLY HA3 H 15.926 -1.221 -14.473 1.00 . A A . 42 GLY HA3 1 1 18 11385 1 1 42 GLY N N 16.088 -0.367 -12.594 1.00 . A A . 42 GLY N 1 1 18 11386 1 1 42 GLY O O 15.621 -3.507 -13.428 1.00 . A A . 42 GLY O 1 1 18 11387 1 1 43 PRO C C 12.827 -4.772 -12.734 1.00 . A A . 43 PRO C 1 1 18 11388 1 1 43 PRO CA C 13.468 -3.873 -11.682 1.00 . A A . 43 PRO CA 1 1 18 11389 1 1 43 PRO CB C 12.430 -3.444 -10.642 1.00 . A A . 43 PRO CB 1 1 18 11390 1 1 43 PRO CD C 13.119 -1.461 -11.786 1.00 . A A . 43 PRO CD 1 1 18 11391 1 1 43 PRO CG C 11.944 -2.118 -11.117 1.00 . A A . 43 PRO CG 1 1 18 11392 1 1 43 PRO HA H 14.270 -4.407 -11.194 1.00 . A A . 43 PRO HA 1 1 18 11393 1 1 43 PRO HB2 H 11.630 -4.170 -10.608 1.00 . A A . 43 PRO HB2 1 1 18 11394 1 1 43 PRO HB3 H 12.897 -3.368 -9.672 1.00 . A A . 43 PRO HB3 1 1 18 11395 1 1 43 PRO HD2 H 12.791 -0.861 -12.622 1.00 . A A . 43 PRO HD2 1 1 18 11396 1 1 43 PRO HD3 H 13.668 -0.858 -11.078 1.00 . A A . 43 PRO HD3 1 1 18 11397 1 1 43 PRO HG2 H 11.138 -2.253 -11.822 1.00 . A A . 43 PRO HG2 1 1 18 11398 1 1 43 PRO HG3 H 11.613 -1.526 -10.276 1.00 . A A . 43 PRO HG3 1 1 18 11399 1 1 43 PRO N N 13.931 -2.601 -12.245 1.00 . A A . 43 PRO N 1 1 18 11400 1 1 43 PRO O O 12.102 -4.301 -13.609 1.00 . A A . 43 PRO O 1 1 18 11401 1 1 44 SER C C 11.128 -6.659 -13.985 1.00 . A A . 44 SER C 1 1 18 11402 1 1 44 SER CA C 12.553 -7.035 -13.588 1.00 . A A . 44 SER CA 1 1 18 11403 1 1 44 SER CB C 12.572 -8.441 -12.984 1.00 . A A . 44 SER CB 1 1 18 11404 1 1 44 SER H H 13.686 -6.385 -11.922 1.00 . A A . 44 SER H 1 1 18 11405 1 1 44 SER HA H 13.175 -7.024 -14.471 1.00 . A A . 44 SER HA 1 1 18 11406 1 1 44 SER HB2 H 12.134 -8.412 -11.998 1.00 . A A . 44 SER HB2 1 1 18 11407 1 1 44 SER HB3 H 12.000 -9.108 -13.613 1.00 . A A . 44 SER HB3 1 1 18 11408 1 1 44 SER HG H 14.098 -9.474 -13.648 1.00 . A A . 44 SER HG 1 1 18 11409 1 1 44 SER N N 13.100 -6.070 -12.642 1.00 . A A . 44 SER N 1 1 18 11410 1 1 44 SER O O 10.201 -6.760 -13.181 1.00 . A A . 44 SER O 1 1 18 11411 1 1 44 SER OG O 13.896 -8.933 -12.881 1.00 . A A . 44 SER OG 1 1 18 11412 1 1 45 SER C C 8.862 -7.048 -16.205 1.00 . A A . 45 SER C 1 1 18 11413 1 1 45 SER CA C 9.652 -5.831 -15.734 1.00 . A A . 45 SER CA 1 1 18 11414 1 1 45 SER CB C 9.804 -4.832 -16.882 1.00 . A A . 45 SER CB 1 1 18 11415 1 1 45 SER H H 11.740 -6.169 -15.824 1.00 . A A . 45 SER H 1 1 18 11416 1 1 45 SER HA H 9.115 -5.359 -14.925 1.00 . A A . 45 SER HA 1 1 18 11417 1 1 45 SER HB2 H 8.831 -4.457 -17.161 1.00 . A A . 45 SER HB2 1 1 18 11418 1 1 45 SER HB3 H 10.427 -4.010 -16.560 1.00 . A A . 45 SER HB3 1 1 18 11419 1 1 45 SER HG H 9.728 -5.615 -18.676 1.00 . A A . 45 SER HG 1 1 18 11420 1 1 45 SER N N 10.962 -6.226 -15.230 1.00 . A A . 45 SER N 1 1 18 11421 1 1 45 SER O O 9.435 -8.089 -16.526 1.00 . A A . 45 SER O 1 1 18 11422 1 1 45 SER OG O 10.401 -5.441 -18.014 1.00 . A A . 45 SER OG 1 1 18 11423 1 1 46 GLY C C 5.224 -7.625 -16.699 1.00 . A A . 46 GLY C 1 1 18 11424 1 1 46 GLY CA C 6.691 -8.003 -16.678 1.00 . A A . 46 GLY CA 1 1 18 11425 1 1 46 GLY H H 7.138 -6.056 -15.978 1.00 . A A . 46 GLY H 1 1 18 11426 1 1 46 GLY HA2 H 6.990 -8.305 -17.671 1.00 . A A . 46 GLY HA2 1 1 18 11427 1 1 46 GLY HA3 H 6.826 -8.837 -16.004 1.00 . A A . 46 GLY HA3 1 1 18 11428 1 1 46 GLY N N 7.540 -6.909 -16.245 1.00 . A A . 46 GLY N 1 1 18 11429 1 1 46 GLY O O 4.512 -7.933 -15.744 1.00 . A A . 46 GLY O 1 1 18 11430 2 2 1 ZN ZN ZN 5.807 -0.989 3.399 1.00 . B A . 181 ZN ZN 1 1 19 11431 1 1 1 GLY C C 0.636 -26.095 18.869 1.00 . A A . 1 GLY C 1 1 19 11432 1 1 1 GLY CA C 2.014 -26.553 18.435 1.00 . A A . 1 GLY CA 1 1 19 11433 1 1 1 GLY H1 H 2.603 -28.586 18.474 1.00 . A A . 1 GLY H1 1 1 19 11434 1 1 1 GLY HA2 H 2.736 -25.799 18.712 1.00 . A A . 1 GLY HA2 1 1 19 11435 1 1 1 GLY HA3 H 2.021 -26.666 17.361 1.00 . A A . 1 GLY HA3 1 1 19 11436 1 1 1 GLY N N 2.397 -27.814 19.042 1.00 . A A . 1 GLY N 1 1 19 11437 1 1 1 GLY O O -0.163 -26.891 19.362 1.00 . A A . 1 GLY O 1 1 19 11438 1 1 2 SER C C -1.189 -22.931 18.337 1.00 . A A . 2 SER C 1 1 19 11439 1 1 2 SER CA C -0.932 -24.244 19.070 1.00 . A A . 2 SER CA 1 1 19 11440 1 1 2 SER CB C -0.986 -24.017 20.582 1.00 . A A . 2 SER CB 1 1 19 11441 1 1 2 SER H H 1.036 -24.223 18.290 1.00 . A A . 2 SER H 1 1 19 11442 1 1 2 SER HA H -1.699 -24.953 18.793 1.00 . A A . 2 SER HA 1 1 19 11443 1 1 2 SER HB2 H -1.986 -23.724 20.864 1.00 . A A . 2 SER HB2 1 1 19 11444 1 1 2 SER HB3 H -0.722 -24.933 21.090 1.00 . A A . 2 SER HB3 1 1 19 11445 1 1 2 SER HG H 0.702 -23.398 21.359 1.00 . A A . 2 SER HG 1 1 19 11446 1 1 2 SER N N 0.357 -24.808 18.688 1.00 . A A . 2 SER N 1 1 19 11447 1 1 2 SER O O -0.434 -21.970 18.480 1.00 . A A . 2 SER O 1 1 19 11448 1 1 2 SER OG O -0.083 -22.999 20.977 1.00 . A A . 2 SER OG 1 1 19 11449 1 1 3 SER C C -4.133 -21.570 16.673 1.00 . A A . 3 SER C 1 1 19 11450 1 1 3 SER CA C -2.618 -21.705 16.794 1.00 . A A . 3 SER CA 1 1 19 11451 1 1 3 SER CB C -1.985 -21.752 15.402 1.00 . A A . 3 SER CB 1 1 19 11452 1 1 3 SER H H -2.826 -23.697 17.481 1.00 . A A . 3 SER H 1 1 19 11453 1 1 3 SER HA H -2.233 -20.847 17.326 1.00 . A A . 3 SER HA 1 1 19 11454 1 1 3 SER HB2 H -2.048 -20.775 14.947 1.00 . A A . 3 SER HB2 1 1 19 11455 1 1 3 SER HB3 H -0.948 -22.041 15.491 1.00 . A A . 3 SER HB3 1 1 19 11456 1 1 3 SER HG H -2.866 -23.471 15.080 1.00 . A A . 3 SER HG 1 1 19 11457 1 1 3 SER N N -2.262 -22.898 17.553 1.00 . A A . 3 SER N 1 1 19 11458 1 1 3 SER O O -4.866 -22.550 16.793 1.00 . A A . 3 SER O 1 1 19 11459 1 1 3 SER OG O -2.651 -22.687 14.571 1.00 . A A . 3 SER OG 1 1 19 11460 1 1 4 GLY C C -6.327 -18.980 15.330 1.00 . A A . 4 GLY C 1 1 19 11461 1 1 4 GLY CA C -6.019 -20.104 16.299 1.00 . A A . 4 GLY CA 1 1 19 11462 1 1 4 GLY H H -3.963 -19.602 16.346 1.00 . A A . 4 GLY H 1 1 19 11463 1 1 4 GLY HA2 H -6.495 -21.008 15.948 1.00 . A A . 4 GLY HA2 1 1 19 11464 1 1 4 GLY HA3 H -6.422 -19.849 17.268 1.00 . A A . 4 GLY HA3 1 1 19 11465 1 1 4 GLY N N -4.594 -20.346 16.433 1.00 . A A . 4 GLY N 1 1 19 11466 1 1 4 GLY O O -5.452 -18.532 14.590 1.00 . A A . 4 GLY O 1 1 19 11467 1 1 5 SER C C -9.071 -16.587 15.106 1.00 . A A . 5 SER C 1 1 19 11468 1 1 5 SER CA C -7.999 -17.447 14.445 1.00 . A A . 5 SER CA 1 1 19 11469 1 1 5 SER CB C -8.529 -18.023 13.130 1.00 . A A . 5 SER CB 1 1 19 11470 1 1 5 SER H H -8.228 -18.921 15.948 1.00 . A A . 5 SER H 1 1 19 11471 1 1 5 SER HA H -7.137 -16.831 14.237 1.00 . A A . 5 SER HA 1 1 19 11472 1 1 5 SER HB2 H -7.787 -18.680 12.702 1.00 . A A . 5 SER HB2 1 1 19 11473 1 1 5 SER HB3 H -9.435 -18.579 13.323 1.00 . A A . 5 SER HB3 1 1 19 11474 1 1 5 SER HG H -9.684 -16.626 12.386 1.00 . A A . 5 SER HG 1 1 19 11475 1 1 5 SER N N -7.576 -18.523 15.334 1.00 . A A . 5 SER N 1 1 19 11476 1 1 5 SER O O -10.039 -17.102 15.664 1.00 . A A . 5 SER O 1 1 19 11477 1 1 5 SER OG O -8.816 -16.992 12.201 1.00 . A A . 5 SER OG 1 1 19 11478 1 1 6 SER C C -10.840 -13.844 14.591 1.00 . A A . 6 SER C 1 1 19 11479 1 1 6 SER CA C -9.840 -14.338 15.632 1.00 . A A . 6 SER CA 1 1 19 11480 1 1 6 SER CB C -9.100 -13.150 16.250 1.00 . A A . 6 SER CB 1 1 19 11481 1 1 6 SER H H -8.099 -14.921 14.578 1.00 . A A . 6 SER H 1 1 19 11482 1 1 6 SER HA H -10.377 -14.861 16.410 1.00 . A A . 6 SER HA 1 1 19 11483 1 1 6 SER HB2 H -8.355 -12.793 15.556 1.00 . A A . 6 SER HB2 1 1 19 11484 1 1 6 SER HB3 H -9.806 -12.359 16.458 1.00 . A A . 6 SER HB3 1 1 19 11485 1 1 6 SER HG H -7.925 -14.304 17.310 1.00 . A A . 6 SER HG 1 1 19 11486 1 1 6 SER N N -8.891 -15.272 15.037 1.00 . A A . 6 SER N 1 1 19 11487 1 1 6 SER O O -12.044 -14.064 14.717 1.00 . A A . 6 SER O 1 1 19 11488 1 1 6 SER OG O -8.460 -13.520 17.458 1.00 . A A . 6 SER OG 1 1 19 11489 1 1 7 GLY C C -10.414 -11.970 11.409 1.00 . A A . 7 GLY C 1 1 19 11490 1 1 7 GLY CA C -11.192 -12.656 12.514 1.00 . A A . 7 GLY CA 1 1 19 11491 1 1 7 GLY H H -9.363 -13.026 13.515 1.00 . A A . 7 GLY H 1 1 19 11492 1 1 7 GLY HA2 H -11.754 -13.475 12.090 1.00 . A A . 7 GLY HA2 1 1 19 11493 1 1 7 GLY HA3 H -11.881 -11.946 12.947 1.00 . A A . 7 GLY HA3 1 1 19 11494 1 1 7 GLY N N -10.331 -13.172 13.562 1.00 . A A . 7 GLY N 1 1 19 11495 1 1 7 GLY O O -10.289 -10.745 11.395 1.00 . A A . 7 GLY O 1 1 19 11496 1 1 8 THR C C -9.947 -11.257 8.535 1.00 . A A . 8 THR C 1 1 19 11497 1 1 8 THR CA C -9.113 -12.224 9.368 1.00 . A A . 8 THR CA 1 1 19 11498 1 1 8 THR CB C -8.586 -13.347 8.455 1.00 . A A . 8 THR CB 1 1 19 11499 1 1 8 THR CG2 C -7.484 -14.135 9.147 1.00 . A A . 8 THR CG2 1 1 19 11500 1 1 8 THR H H -10.020 -13.730 10.546 1.00 . A A . 8 THR H 1 1 19 11501 1 1 8 THR HA H -8.265 -11.694 9.777 1.00 . A A . 8 THR HA 1 1 19 11502 1 1 8 THR HB H -8.181 -12.901 7.558 1.00 . A A . 8 THR HB 1 1 19 11503 1 1 8 THR HG1 H -9.818 -14.168 7.151 1.00 . A A . 8 THR HG1 1 1 19 11504 1 1 8 THR HG21 H -7.299 -13.713 10.123 1.00 . A A . 8 THR HG21 1 1 19 11505 1 1 8 THR HG22 H -6.581 -14.085 8.556 1.00 . A A . 8 THR HG22 1 1 19 11506 1 1 8 THR HG23 H -7.789 -15.165 9.252 1.00 . A A . 8 THR HG23 1 1 19 11507 1 1 8 THR N N -9.886 -12.762 10.480 1.00 . A A . 8 THR N 1 1 19 11508 1 1 8 THR O O -11.171 -11.220 8.650 1.00 . A A . 8 THR O 1 1 19 11509 1 1 8 THR OG1 O -9.656 -14.229 8.096 1.00 . A A . 8 THR OG1 1 1 19 11510 1 1 9 GLY C C -9.261 -9.280 5.537 1.00 . A A . 9 GLY C 1 1 19 11511 1 1 9 GLY CA C -9.971 -9.518 6.855 1.00 . A A . 9 GLY CA 1 1 19 11512 1 1 9 GLY H H -8.299 -10.548 7.647 1.00 . A A . 9 GLY H 1 1 19 11513 1 1 9 GLY HA2 H -10.965 -9.888 6.655 1.00 . A A . 9 GLY HA2 1 1 19 11514 1 1 9 GLY HA3 H -10.047 -8.579 7.385 1.00 . A A . 9 GLY HA3 1 1 19 11515 1 1 9 GLY N N -9.275 -10.475 7.696 1.00 . A A . 9 GLY N 1 1 19 11516 1 1 9 GLY O O -8.057 -9.506 5.425 1.00 . A A . 9 GLY O 1 1 19 11517 1 1 10 GLU C C -8.115 -7.816 3.339 1.00 . A A . 10 GLU C 1 1 19 11518 1 1 10 GLU CA C -9.443 -8.557 3.221 1.00 . A A . 10 GLU CA 1 1 19 11519 1 1 10 GLU CB C -10.422 -7.739 2.376 1.00 . A A . 10 GLU CB 1 1 19 11520 1 1 10 GLU CD C -12.149 -7.918 0.541 1.00 . A A . 10 GLU CD 1 1 19 11521 1 1 10 GLU CG C -11.543 -8.567 1.770 1.00 . A A . 10 GLU CG 1 1 19 11522 1 1 10 GLU H H -10.964 -8.662 4.690 1.00 . A A . 10 GLU H 1 1 19 11523 1 1 10 GLU HA H -9.270 -9.506 2.736 1.00 . A A . 10 GLU HA 1 1 19 11524 1 1 10 GLU HB2 H -10.864 -6.974 2.998 1.00 . A A . 10 GLU HB2 1 1 19 11525 1 1 10 GLU HB3 H -9.877 -7.266 1.572 1.00 . A A . 10 GLU HB3 1 1 19 11526 1 1 10 GLU HG2 H -11.148 -9.532 1.490 1.00 . A A . 10 GLU HG2 1 1 19 11527 1 1 10 GLU HG3 H -12.318 -8.697 2.510 1.00 . A A . 10 GLU HG3 1 1 19 11528 1 1 10 GLU N N -10.009 -8.823 4.538 1.00 . A A . 10 GLU N 1 1 19 11529 1 1 10 GLU O O -8.068 -6.668 3.783 1.00 . A A . 10 GLU O 1 1 19 11530 1 1 10 GLU OE1 O -11.382 -7.381 -0.285 1.00 . A A . 10 GLU OE1 1 1 19 11531 1 1 10 GLU OE2 O -13.390 -7.946 0.406 1.00 . A A . 10 GLU OE2 1 1 19 11532 1 1 11 LYS C C -5.021 -7.947 1.637 1.00 . A A . 11 LYS C 1 1 19 11533 1 1 11 LYS CA C -5.705 -7.887 2.999 1.00 . A A . 11 LYS CA 1 1 19 11534 1 1 11 LYS CB C -4.850 -8.607 4.044 1.00 . A A . 11 LYS CB 1 1 19 11535 1 1 11 LYS CD C -3.204 -10.486 4.308 1.00 . A A . 11 LYS CD 1 1 19 11536 1 1 11 LYS CE C -2.444 -11.450 3.409 1.00 . A A . 11 LYS CE 1 1 19 11537 1 1 11 LYS CG C -4.507 -10.038 3.669 1.00 . A A . 11 LYS CG 1 1 19 11538 1 1 11 LYS H H -7.137 -9.393 2.595 1.00 . A A . 11 LYS H 1 1 19 11539 1 1 11 LYS HA H -5.816 -6.853 3.288 1.00 . A A . 11 LYS HA 1 1 19 11540 1 1 11 LYS HB2 H -3.927 -8.061 4.175 1.00 . A A . 11 LYS HB2 1 1 19 11541 1 1 11 LYS HB3 H -5.385 -8.621 4.983 1.00 . A A . 11 LYS HB3 1 1 19 11542 1 1 11 LYS HD2 H -2.586 -9.620 4.491 1.00 . A A . 11 LYS HD2 1 1 19 11543 1 1 11 LYS HD3 H -3.423 -10.979 5.245 1.00 . A A . 11 LYS HD3 1 1 19 11544 1 1 11 LYS HE2 H -2.665 -11.211 2.380 1.00 . A A . 11 LYS HE2 1 1 19 11545 1 1 11 LYS HE3 H -1.386 -11.329 3.587 1.00 . A A . 11 LYS HE3 1 1 19 11546 1 1 11 LYS HG2 H -5.302 -10.689 4.003 1.00 . A A . 11 LYS HG2 1 1 19 11547 1 1 11 LYS HG3 H -4.413 -10.106 2.594 1.00 . A A . 11 LYS HG3 1 1 19 11548 1 1 11 LYS HZ1 H -2.019 -13.494 3.459 1.00 . A A . 11 LYS HZ1 1 1 19 11549 1 1 11 LYS HZ2 H -3.627 -13.138 3.071 1.00 . A A . 11 LYS HZ2 1 1 19 11550 1 1 11 LYS HZ3 H -3.089 -12.987 4.667 1.00 . A A . 11 LYS HZ3 1 1 19 11551 1 1 11 LYS N N -7.036 -8.480 2.940 1.00 . A A . 11 LYS N 1 1 19 11552 1 1 11 LYS NZ N -2.821 -12.866 3.670 1.00 . A A . 11 LYS NZ 1 1 19 11553 1 1 11 LYS O O -3.841 -8.279 1.523 1.00 . A A . 11 LYS O 1 1 19 11554 1 1 12 PRO C C -4.256 -6.508 -1.042 1.00 . A A . 12 PRO C 1 1 19 11555 1 1 12 PRO CA C -5.263 -7.626 -0.794 1.00 . A A . 12 PRO CA 1 1 19 11556 1 1 12 PRO CB C -6.518 -7.414 -1.643 1.00 . A A . 12 PRO CB 1 1 19 11557 1 1 12 PRO CD C -7.191 -7.214 0.642 1.00 . A A . 12 PRO CD 1 1 19 11558 1 1 12 PRO CG C -7.468 -6.701 -0.744 1.00 . A A . 12 PRO CG 1 1 19 11559 1 1 12 PRO HA H -4.813 -8.576 -1.044 1.00 . A A . 12 PRO HA 1 1 19 11560 1 1 12 PRO HB2 H -6.272 -6.819 -2.511 1.00 . A A . 12 PRO HB2 1 1 19 11561 1 1 12 PRO HB3 H -6.912 -8.370 -1.955 1.00 . A A . 12 PRO HB3 1 1 19 11562 1 1 12 PRO HD2 H -7.337 -6.431 1.370 1.00 . A A . 12 PRO HD2 1 1 19 11563 1 1 12 PRO HD3 H -7.824 -8.061 0.864 1.00 . A A . 12 PRO HD3 1 1 19 11564 1 1 12 PRO HG2 H -7.291 -5.637 -0.793 1.00 . A A . 12 PRO HG2 1 1 19 11565 1 1 12 PRO HG3 H -8.485 -6.927 -1.031 1.00 . A A . 12 PRO HG3 1 1 19 11566 1 1 12 PRO N N -5.777 -7.619 0.579 1.00 . A A . 12 PRO N 1 1 19 11567 1 1 12 PRO O O -3.769 -6.335 -2.159 1.00 . A A . 12 PRO O 1 1 19 11568 1 1 13 TYR C C -1.673 -5.007 0.560 1.00 . A A . 13 TYR C 1 1 19 11569 1 1 13 TYR CA C -3.001 -4.649 -0.099 1.00 . A A . 13 TYR CA 1 1 19 11570 1 1 13 TYR CB C -3.580 -3.388 0.546 1.00 . A A . 13 TYR CB 1 1 19 11571 1 1 13 TYR CD1 C -6.035 -3.291 -0.039 1.00 . A A . 13 TYR CD1 1 1 19 11572 1 1 13 TYR CD2 C -4.562 -1.754 -1.111 1.00 . A A . 13 TYR CD2 1 1 19 11573 1 1 13 TYR CE1 C -7.104 -2.757 -0.732 1.00 . A A . 13 TYR CE1 1 1 19 11574 1 1 13 TYR CE2 C -5.625 -1.213 -1.807 1.00 . A A . 13 TYR CE2 1 1 19 11575 1 1 13 TYR CG C -4.747 -2.800 -0.215 1.00 . A A . 13 TYR CG 1 1 19 11576 1 1 13 TYR CZ C -6.894 -1.718 -1.615 1.00 . A A . 13 TYR CZ 1 1 19 11577 1 1 13 TYR H H -4.370 -5.939 0.871 1.00 . A A . 13 TYR H 1 1 19 11578 1 1 13 TYR HA H -2.830 -4.458 -1.148 1.00 . A A . 13 TYR HA 1 1 19 11579 1 1 13 TYR HB2 H -3.921 -3.626 1.542 1.00 . A A . 13 TYR HB2 1 1 19 11580 1 1 13 TYR HB3 H -2.808 -2.635 0.604 1.00 . A A . 13 TYR HB3 1 1 19 11581 1 1 13 TYR HD1 H -6.196 -4.105 0.654 1.00 . A A . 13 TYR HD1 1 1 19 11582 1 1 13 TYR HD2 H -3.566 -1.362 -1.260 1.00 . A A . 13 TYR HD2 1 1 19 11583 1 1 13 TYR HE1 H -8.098 -3.152 -0.581 1.00 . A A . 13 TYR HE1 1 1 19 11584 1 1 13 TYR HE2 H -5.461 -0.400 -2.499 1.00 . A A . 13 TYR HE2 1 1 19 11585 1 1 13 TYR HH H -8.162 -1.744 -3.059 1.00 . A A . 13 TYR HH 1 1 19 11586 1 1 13 TYR N N -3.949 -5.752 0.006 1.00 . A A . 13 TYR N 1 1 19 11587 1 1 13 TYR O O -1.624 -5.327 1.747 1.00 . A A . 13 TYR O 1 1 19 11588 1 1 13 TYR OH O -7.956 -1.183 -2.308 1.00 . A A . 13 TYR OH 1 1 19 11589 1 1 14 GLU C C 1.756 -4.243 -0.192 1.00 . A A . 14 GLU C 1 1 19 11590 1 1 14 GLU CA C 0.731 -5.267 0.288 1.00 . A A . 14 GLU CA 1 1 19 11591 1 1 14 GLU CB C 1.149 -6.670 -0.156 1.00 . A A . 14 GLU CB 1 1 19 11592 1 1 14 GLU CD C -0.701 -8.321 0.325 1.00 . A A . 14 GLU CD 1 1 19 11593 1 1 14 GLU CG C 0.644 -7.773 0.759 1.00 . A A . 14 GLU CG 1 1 19 11594 1 1 14 GLU H H -0.702 -4.686 -1.158 1.00 . A A . 14 GLU H 1 1 19 11595 1 1 14 GLU HA H 0.690 -5.238 1.366 1.00 . A A . 14 GLU HA 1 1 19 11596 1 1 14 GLU HB2 H 0.764 -6.850 -1.149 1.00 . A A . 14 GLU HB2 1 1 19 11597 1 1 14 GLU HB3 H 2.227 -6.720 -0.184 1.00 . A A . 14 GLU HB3 1 1 19 11598 1 1 14 GLU HG2 H 1.362 -8.581 0.758 1.00 . A A . 14 GLU HG2 1 1 19 11599 1 1 14 GLU HG3 H 0.550 -7.378 1.760 1.00 . A A . 14 GLU HG3 1 1 19 11600 1 1 14 GLU N N -0.598 -4.949 -0.220 1.00 . A A . 14 GLU N 1 1 19 11601 1 1 14 GLU O O 1.605 -3.651 -1.261 1.00 . A A . 14 GLU O 1 1 19 11602 1 1 14 GLU OE1 O -0.959 -8.367 -0.896 1.00 . A A . 14 GLU OE1 1 1 19 11603 1 1 14 GLU OE2 O -1.497 -8.706 1.208 1.00 . A A . 14 GLU OE2 1 1 19 11604 1 1 15 CYS C C 4.930 -3.752 -0.585 1.00 . A A . 15 CYS C 1 1 19 11605 1 1 15 CYS CA C 3.850 -3.089 0.264 1.00 . A A . 15 CYS CA 1 1 19 11606 1 1 15 CYS CB C 4.471 -2.506 1.535 1.00 . A A . 15 CYS CB 1 1 19 11607 1 1 15 CYS H H 2.864 -4.543 1.445 1.00 . A A . 15 CYS H 1 1 19 11608 1 1 15 CYS HA H 3.401 -2.289 -0.306 1.00 . A A . 15 CYS HA 1 1 19 11609 1 1 15 CYS HB2 H 3.682 -2.236 2.222 1.00 . A A . 15 CYS HB2 1 1 19 11610 1 1 15 CYS HB3 H 5.100 -3.254 1.995 1.00 . A A . 15 CYS HB3 1 1 19 11611 1 1 15 CYS N N 2.799 -4.040 0.605 1.00 . A A . 15 CYS N 1 1 19 11612 1 1 15 CYS O O 5.414 -4.836 -0.257 1.00 . A A . 15 CYS O 1 1 19 11613 1 1 15 CYS SG S 5.489 -1.022 1.252 1.00 . A A . 15 CYS SG 1 1 19 11614 1 1 16 ASP C C 7.722 -3.259 -2.074 1.00 . A A . 16 ASP C 1 1 19 11615 1 1 16 ASP CA C 6.326 -3.619 -2.574 1.00 . A A . 16 ASP CA 1 1 19 11616 1 1 16 ASP CB C 6.122 -3.076 -3.989 1.00 . A A . 16 ASP CB 1 1 19 11617 1 1 16 ASP CG C 4.970 -3.751 -4.708 1.00 . A A . 16 ASP CG 1 1 19 11618 1 1 16 ASP H H 4.880 -2.235 -1.885 1.00 . A A . 16 ASP H 1 1 19 11619 1 1 16 ASP HA H 6.231 -4.694 -2.594 1.00 . A A . 16 ASP HA 1 1 19 11620 1 1 16 ASP HB2 H 5.916 -2.016 -3.935 1.00 . A A . 16 ASP HB2 1 1 19 11621 1 1 16 ASP HB3 H 7.023 -3.234 -4.562 1.00 . A A . 16 ASP HB3 1 1 19 11622 1 1 16 ASP N N 5.303 -3.094 -1.677 1.00 . A A . 16 ASP N 1 1 19 11623 1 1 16 ASP O O 8.672 -3.186 -2.854 1.00 . A A . 16 ASP O 1 1 19 11624 1 1 16 ASP OD1 O 4.062 -4.265 -4.021 1.00 . A A . 16 ASP OD1 1 1 19 11625 1 1 16 ASP OD2 O 4.977 -3.765 -5.956 1.00 . A A . 16 ASP OD2 1 1 19 11626 1 1 17 VAL C C 9.407 -3.550 1.054 1.00 . A A . 17 VAL C 1 1 19 11627 1 1 17 VAL CA C 9.118 -2.682 -0.166 1.00 . A A . 17 VAL CA 1 1 19 11628 1 1 17 VAL CB C 9.152 -1.200 0.253 1.00 . A A . 17 VAL CB 1 1 19 11629 1 1 17 VAL CG1 C 10.490 -0.856 0.890 1.00 . A A . 17 VAL CG1 1 1 19 11630 1 1 17 VAL CG2 C 8.876 -0.303 -0.944 1.00 . A A . 17 VAL CG2 1 1 19 11631 1 1 17 VAL H H 7.045 -3.108 -0.199 1.00 . A A . 17 VAL H 1 1 19 11632 1 1 17 VAL HA H 9.891 -2.845 -0.903 1.00 . A A . 17 VAL HA 1 1 19 11633 1 1 17 VAL HB H 8.376 -1.036 0.986 1.00 . A A . 17 VAL HB 1 1 19 11634 1 1 17 VAL HG11 H 11.060 -1.761 1.040 1.00 . A A . 17 VAL HG11 1 1 19 11635 1 1 17 VAL HG12 H 11.037 -0.187 0.242 1.00 . A A . 17 VAL HG12 1 1 19 11636 1 1 17 VAL HG13 H 10.321 -0.376 1.843 1.00 . A A . 17 VAL HG13 1 1 19 11637 1 1 17 VAL HG21 H 7.826 -0.052 -0.972 1.00 . A A . 17 VAL HG21 1 1 19 11638 1 1 17 VAL HG22 H 9.460 0.601 -0.857 1.00 . A A . 17 VAL HG22 1 1 19 11639 1 1 17 VAL HG23 H 9.147 -0.820 -1.853 1.00 . A A . 17 VAL HG23 1 1 19 11640 1 1 17 VAL N N 7.839 -3.034 -0.769 1.00 . A A . 17 VAL N 1 1 19 11641 1 1 17 VAL O O 10.490 -4.124 1.179 1.00 . A A . 17 VAL O 1 1 19 11642 1 1 18 CYS C C 7.633 -5.636 3.146 1.00 . A A . 18 CYS C 1 1 19 11643 1 1 18 CYS CA C 8.581 -4.440 3.163 1.00 . A A . 18 CYS CA 1 1 19 11644 1 1 18 CYS CB C 8.314 -3.582 4.401 1.00 . A A . 18 CYS CB 1 1 19 11645 1 1 18 CYS H H 7.592 -3.162 1.797 1.00 . A A . 18 CYS H 1 1 19 11646 1 1 18 CYS HA H 9.597 -4.803 3.200 1.00 . A A . 18 CYS HA 1 1 19 11647 1 1 18 CYS HB2 H 8.331 -4.212 5.278 1.00 . A A . 18 CYS HB2 1 1 19 11648 1 1 18 CYS HB3 H 9.089 -2.835 4.486 1.00 . A A . 18 CYS HB3 1 1 19 11649 1 1 18 CYS N N 8.433 -3.643 1.952 1.00 . A A . 18 CYS N 1 1 19 11650 1 1 18 CYS O O 7.666 -6.480 4.043 1.00 . A A . 18 CYS O 1 1 19 11651 1 1 18 CYS SG S 6.711 -2.717 4.374 1.00 . A A . 18 CYS SG 1 1 19 11652 1 1 19 ARG C C 4.803 -6.754 3.111 1.00 . A A . 19 ARG C 1 1 19 11653 1 1 19 ARG CA C 5.834 -6.794 1.987 1.00 . A A . 19 ARG CA 1 1 19 11654 1 1 19 ARG CB C 6.559 -8.141 1.993 1.00 . A A . 19 ARG CB 1 1 19 11655 1 1 19 ARG CD C 7.034 -8.508 -0.447 1.00 . A A . 19 ARG CD 1 1 19 11656 1 1 19 ARG CG C 7.636 -8.258 0.927 1.00 . A A . 19 ARG CG 1 1 19 11657 1 1 19 ARG CZ C 6.124 -10.395 -1.735 1.00 . A A . 19 ARG CZ 1 1 19 11658 1 1 19 ARG H H 6.813 -5.000 1.437 1.00 . A A . 19 ARG H 1 1 19 11659 1 1 19 ARG HA H 5.324 -6.674 1.043 1.00 . A A . 19 ARG HA 1 1 19 11660 1 1 19 ARG HB2 H 7.023 -8.282 2.959 1.00 . A A . 19 ARG HB2 1 1 19 11661 1 1 19 ARG HB3 H 5.836 -8.926 1.832 1.00 . A A . 19 ARG HB3 1 1 19 11662 1 1 19 ARG HD2 H 6.222 -7.813 -0.602 1.00 . A A . 19 ARG HD2 1 1 19 11663 1 1 19 ARG HD3 H 7.796 -8.343 -1.194 1.00 . A A . 19 ARG HD3 1 1 19 11664 1 1 19 ARG HE H 6.479 -10.419 0.228 1.00 . A A . 19 ARG HE 1 1 19 11665 1 1 19 ARG HG2 H 8.202 -7.338 0.897 1.00 . A A . 19 ARG HG2 1 1 19 11666 1 1 19 ARG HG3 H 8.291 -9.078 1.179 1.00 . A A . 19 ARG HG3 1 1 19 11667 1 1 19 ARG HH11 H 6.516 -8.735 -2.819 1.00 . A A . 19 ARG HH11 1 1 19 11668 1 1 19 ARG HH12 H 5.874 -10.073 -3.714 1.00 . A A . 19 ARG HH12 1 1 19 11669 1 1 19 ARG HH21 H 5.634 -12.187 -0.940 1.00 . A A . 19 ARG HH21 1 1 19 11670 1 1 19 ARG HH22 H 5.372 -12.035 -2.644 1.00 . A A . 19 ARG HH22 1 1 19 11671 1 1 19 ARG N N 6.791 -5.702 2.120 1.00 . A A . 19 ARG N 1 1 19 11672 1 1 19 ARG NE N 6.524 -9.870 -0.582 1.00 . A A . 19 ARG NE 1 1 19 11673 1 1 19 ARG NH1 N 6.175 -9.675 -2.847 1.00 . A A . 19 ARG NH1 1 1 19 11674 1 1 19 ARG NH2 N 5.673 -11.642 -1.776 1.00 . A A . 19 ARG NH2 1 1 19 11675 1 1 19 ARG O O 4.342 -7.793 3.584 1.00 . A A . 19 ARG O 1 1 19 11676 1 1 20 LYS C C 2.070 -5.752 4.132 1.00 . A A . 20 LYS C 1 1 19 11677 1 1 20 LYS CA C 3.469 -5.369 4.605 1.00 . A A . 20 LYS CA 1 1 19 11678 1 1 20 LYS CB C 3.474 -3.919 5.093 1.00 . A A . 20 LYS CB 1 1 19 11679 1 1 20 LYS CD C 3.868 -4.142 7.564 1.00 . A A . 20 LYS CD 1 1 19 11680 1 1 20 LYS CE C 2.873 -3.143 8.133 1.00 . A A . 20 LYS CE 1 1 19 11681 1 1 20 LYS CG C 4.439 -3.666 6.238 1.00 . A A . 20 LYS CG 1 1 19 11682 1 1 20 LYS H H 4.848 -4.755 3.120 1.00 . A A . 20 LYS H 1 1 19 11683 1 1 20 LYS HA H 3.750 -6.016 5.422 1.00 . A A . 20 LYS HA 1 1 19 11684 1 1 20 LYS HB2 H 3.749 -3.276 4.270 1.00 . A A . 20 LYS HB2 1 1 19 11685 1 1 20 LYS HB3 H 2.479 -3.659 5.424 1.00 . A A . 20 LYS HB3 1 1 19 11686 1 1 20 LYS HD2 H 3.367 -5.086 7.411 1.00 . A A . 20 LYS HD2 1 1 19 11687 1 1 20 LYS HD3 H 4.678 -4.272 8.268 1.00 . A A . 20 LYS HD3 1 1 19 11688 1 1 20 LYS HE2 H 3.406 -2.255 8.434 1.00 . A A . 20 LYS HE2 1 1 19 11689 1 1 20 LYS HE3 H 2.158 -2.890 7.364 1.00 . A A . 20 LYS HE3 1 1 19 11690 1 1 20 LYS HG2 H 5.361 -4.195 6.045 1.00 . A A . 20 LYS HG2 1 1 19 11691 1 1 20 LYS HG3 H 4.638 -2.605 6.302 1.00 . A A . 20 LYS HG3 1 1 19 11692 1 1 20 LYS HZ1 H 2.689 -4.472 9.734 1.00 . A A . 20 LYS HZ1 1 1 19 11693 1 1 20 LYS HZ2 H 1.214 -4.056 9.016 1.00 . A A . 20 LYS HZ2 1 1 19 11694 1 1 20 LYS HZ3 H 2.006 -2.952 10.023 1.00 . A A . 20 LYS HZ3 1 1 19 11695 1 1 20 LYS N N 4.446 -5.547 3.536 1.00 . A A . 20 LYS N 1 1 19 11696 1 1 20 LYS NZ N 2.145 -3.694 9.309 1.00 . A A . 20 LYS NZ 1 1 19 11697 1 1 20 LYS O O 1.877 -6.129 2.977 1.00 . A A . 20 LYS O 1 1 19 11698 1 1 21 ALA C C -1.258 -5.160 5.541 1.00 . A A . 21 ALA C 1 1 19 11699 1 1 21 ALA CA C -0.283 -5.985 4.707 1.00 . A A . 21 ALA CA 1 1 19 11700 1 1 21 ALA CB C -0.531 -7.471 4.918 1.00 . A A . 21 ALA CB 1 1 19 11701 1 1 21 ALA H H 1.315 -5.346 5.938 1.00 . A A . 21 ALA H 1 1 19 11702 1 1 21 ALA HA H -0.442 -5.764 3.662 1.00 . A A . 21 ALA HA 1 1 19 11703 1 1 21 ALA HB1 H -0.137 -8.025 4.079 1.00 . A A . 21 ALA HB1 1 1 19 11704 1 1 21 ALA HB2 H -0.039 -7.792 5.825 1.00 . A A . 21 ALA HB2 1 1 19 11705 1 1 21 ALA HB3 H -1.593 -7.650 5.001 1.00 . A A . 21 ALA HB3 1 1 19 11706 1 1 21 ALA N N 1.098 -5.652 5.033 1.00 . A A . 21 ALA N 1 1 19 11707 1 1 21 ALA O O -1.153 -5.108 6.766 1.00 . A A . 21 ALA O 1 1 19 11708 1 1 22 PHE C C -4.607 -4.032 5.068 1.00 . A A . 22 PHE C 1 1 19 11709 1 1 22 PHE CA C -3.199 -3.692 5.547 1.00 . A A . 22 PHE CA 1 1 19 11710 1 1 22 PHE CB C -2.911 -2.208 5.307 1.00 . A A . 22 PHE CB 1 1 19 11711 1 1 22 PHE CD1 C -0.503 -2.116 4.606 1.00 . A A . 22 PHE CD1 1 1 19 11712 1 1 22 PHE CD2 C -1.105 -1.187 6.719 1.00 . A A . 22 PHE CD2 1 1 19 11713 1 1 22 PHE CE1 C 0.817 -1.768 4.825 1.00 . A A . 22 PHE CE1 1 1 19 11714 1 1 22 PHE CE2 C 0.213 -0.836 6.943 1.00 . A A . 22 PHE CE2 1 1 19 11715 1 1 22 PHE CG C -1.478 -1.829 5.549 1.00 . A A . 22 PHE CG 1 1 19 11716 1 1 22 PHE CZ C 1.175 -1.128 5.996 1.00 . A A . 22 PHE CZ 1 1 19 11717 1 1 22 PHE H H -2.238 -4.597 3.891 1.00 . A A . 22 PHE H 1 1 19 11718 1 1 22 PHE HA H -3.132 -3.897 6.604 1.00 . A A . 22 PHE HA 1 1 19 11719 1 1 22 PHE HB2 H -3.150 -1.963 4.284 1.00 . A A . 22 PHE HB2 1 1 19 11720 1 1 22 PHE HB3 H -3.527 -1.618 5.968 1.00 . A A . 22 PHE HB3 1 1 19 11721 1 1 22 PHE HD1 H -0.783 -2.617 3.690 1.00 . A A . 22 PHE HD1 1 1 19 11722 1 1 22 PHE HD2 H -1.856 -0.959 7.461 1.00 . A A . 22 PHE HD2 1 1 19 11723 1 1 22 PHE HE1 H 1.566 -1.998 4.083 1.00 . A A . 22 PHE HE1 1 1 19 11724 1 1 22 PHE HE2 H 0.491 -0.336 7.859 1.00 . A A . 22 PHE HE2 1 1 19 11725 1 1 22 PHE HZ H 2.205 -0.855 6.168 1.00 . A A . 22 PHE HZ 1 1 19 11726 1 1 22 PHE N N -2.206 -4.516 4.868 1.00 . A A . 22 PHE N 1 1 19 11727 1 1 22 PHE O O -4.786 -4.842 4.159 1.00 . A A . 22 PHE O 1 1 19 11728 1 1 23 SER C C -7.461 -2.653 4.266 1.00 . A A . 23 SER C 1 1 19 11729 1 1 23 SER CA C -6.996 -3.645 5.328 1.00 . A A . 23 SER CA 1 1 19 11730 1 1 23 SER CB C -7.889 -3.541 6.566 1.00 . A A . 23 SER CB 1 1 19 11731 1 1 23 SER H H -5.396 -2.771 6.404 1.00 . A A . 23 SER H 1 1 19 11732 1 1 23 SER HA H -7.068 -4.645 4.926 1.00 . A A . 23 SER HA 1 1 19 11733 1 1 23 SER HB2 H -8.924 -3.594 6.265 1.00 . A A . 23 SER HB2 1 1 19 11734 1 1 23 SER HB3 H -7.666 -4.358 7.237 1.00 . A A . 23 SER HB3 1 1 19 11735 1 1 23 SER HG H -7.594 -2.485 8.189 1.00 . A A . 23 SER HG 1 1 19 11736 1 1 23 SER N N -5.603 -3.406 5.687 1.00 . A A . 23 SER N 1 1 19 11737 1 1 23 SER O O -7.844 -3.042 3.162 1.00 . A A . 23 SER O 1 1 19 11738 1 1 23 SER OG O -7.674 -2.317 7.248 1.00 . A A . 23 SER OG 1 1 19 11739 1 1 24 HIS C C -6.689 0.092 2.775 1.00 . A A . 24 HIS C 1 1 19 11740 1 1 24 HIS CA C -7.842 -0.320 3.685 1.00 . A A . 24 HIS CA 1 1 19 11741 1 1 24 HIS CB C -8.356 0.895 4.459 1.00 . A A . 24 HIS CB 1 1 19 11742 1 1 24 HIS CD2 C -10.666 1.407 3.397 1.00 . A A . 24 HIS CD2 1 1 19 11743 1 1 24 HIS CE1 C -10.214 3.394 2.589 1.00 . A A . 24 HIS CE1 1 1 19 11744 1 1 24 HIS CG C -9.381 1.691 3.711 1.00 . A A . 24 HIS CG 1 1 19 11745 1 1 24 HIS H H -7.110 -1.122 5.502 1.00 . A A . 24 HIS H 1 1 19 11746 1 1 24 HIS HA H -8.642 -0.713 3.076 1.00 . A A . 24 HIS HA 1 1 19 11747 1 1 24 HIS HB2 H -8.805 0.561 5.382 1.00 . A A . 24 HIS HB2 1 1 19 11748 1 1 24 HIS HB3 H -7.525 1.548 4.683 1.00 . A A . 24 HIS HB3 1 1 19 11749 1 1 24 HIS HD1 H -8.279 3.427 3.252 1.00 . A A . 24 HIS HD1 1 1 19 11750 1 1 24 HIS HD2 H -11.204 0.503 3.649 1.00 . A A . 24 HIS HD2 1 1 19 11751 1 1 24 HIS HE1 H -10.311 4.347 2.091 1.00 . A A . 24 HIS HE1 1 1 19 11752 1 1 24 HIS N N -7.425 -1.369 4.608 1.00 . A A . 24 HIS N 1 1 19 11753 1 1 24 HIS ND1 N -9.128 2.942 3.189 1.00 . A A . 24 HIS ND1 1 1 19 11754 1 1 24 HIS NE2 N -11.162 2.481 2.700 1.00 . A A . 24 HIS NE2 1 1 19 11755 1 1 24 HIS O O -5.522 0.016 3.161 1.00 . A A . 24 HIS O 1 1 19 11756 1 1 25 HIS C C -5.200 2.123 1.144 1.00 . A A . 25 HIS C 1 1 19 11757 1 1 25 HIS CA C -6.016 0.954 0.599 1.00 . A A . 25 HIS CA 1 1 19 11758 1 1 25 HIS CB C -6.678 1.350 -0.720 1.00 . A A . 25 HIS CB 1 1 19 11759 1 1 25 HIS CD2 C -6.873 3.869 -1.303 1.00 . A A . 25 HIS CD2 1 1 19 11760 1 1 25 HIS CE1 C -8.700 4.318 -0.177 1.00 . A A . 25 HIS CE1 1 1 19 11761 1 1 25 HIS CG C -7.273 2.724 -0.703 1.00 . A A . 25 HIS CG 1 1 19 11762 1 1 25 HIS H H -7.970 0.567 1.315 1.00 . A A . 25 HIS H 1 1 19 11763 1 1 25 HIS HA H -5.353 0.120 0.423 1.00 . A A . 25 HIS HA 1 1 19 11764 1 1 25 HIS HB2 H -5.941 1.318 -1.509 1.00 . A A . 25 HIS HB2 1 1 19 11765 1 1 25 HIS HB3 H -7.468 0.647 -0.944 1.00 . A A . 25 HIS HB3 1 1 19 11766 1 1 25 HIS HD1 H -8.950 2.417 0.535 1.00 . A A . 25 HIS HD1 1 1 19 11767 1 1 25 HIS HD2 H -6.004 3.994 -1.935 1.00 . A A . 25 HIS HD2 1 1 19 11768 1 1 25 HIS HE1 H -9.540 4.845 0.250 1.00 . A A . 25 HIS HE1 1 1 19 11769 1 1 25 HIS N N -7.023 0.529 1.565 1.00 . A A . 25 HIS N 1 1 19 11770 1 1 25 HIS ND1 N -8.420 3.039 -0.005 1.00 . A A . 25 HIS ND1 1 1 19 11771 1 1 25 HIS NE2 N -7.776 4.845 -0.961 1.00 . A A . 25 HIS NE2 1 1 19 11772 1 1 25 HIS O O -3.988 2.192 0.945 1.00 . A A . 25 HIS O 1 1 19 11773 1 1 26 ALA C C -4.089 3.788 3.347 1.00 . A A . 26 ALA C 1 1 19 11774 1 1 26 ALA CA C -5.212 4.204 2.404 1.00 . A A . 26 ALA CA 1 1 19 11775 1 1 26 ALA CB C -6.221 5.078 3.134 1.00 . A A . 26 ALA CB 1 1 19 11776 1 1 26 ALA H H -6.840 2.929 1.954 1.00 . A A . 26 ALA H 1 1 19 11777 1 1 26 ALA HA H -4.792 4.782 1.593 1.00 . A A . 26 ALA HA 1 1 19 11778 1 1 26 ALA HB1 H -6.332 4.728 4.149 1.00 . A A . 26 ALA HB1 1 1 19 11779 1 1 26 ALA HB2 H -5.871 6.101 3.142 1.00 . A A . 26 ALA HB2 1 1 19 11780 1 1 26 ALA HB3 H -7.174 5.028 2.628 1.00 . A A . 26 ALA HB3 1 1 19 11781 1 1 26 ALA N N -5.874 3.039 1.830 1.00 . A A . 26 ALA N 1 1 19 11782 1 1 26 ALA O O -2.937 4.184 3.169 1.00 . A A . 26 ALA O 1 1 19 11783 1 1 27 SER C C -2.130 2.178 4.646 1.00 . A A . 27 SER C 1 1 19 11784 1 1 27 SER CA C -3.453 2.521 5.326 1.00 . A A . 27 SER CA 1 1 19 11785 1 1 27 SER CB C -3.988 1.298 6.073 1.00 . A A . 27 SER CB 1 1 19 11786 1 1 27 SER H H -5.367 2.706 4.440 1.00 . A A . 27 SER H 1 1 19 11787 1 1 27 SER HA H -3.284 3.319 6.034 1.00 . A A . 27 SER HA 1 1 19 11788 1 1 27 SER HB2 H -4.421 0.608 5.364 1.00 . A A . 27 SER HB2 1 1 19 11789 1 1 27 SER HB3 H -3.174 0.814 6.594 1.00 . A A . 27 SER HB3 1 1 19 11790 1 1 27 SER HG H -4.563 1.861 7.858 1.00 . A A . 27 SER HG 1 1 19 11791 1 1 27 SER N N -4.432 2.987 4.351 1.00 . A A . 27 SER N 1 1 19 11792 1 1 27 SER O O -1.063 2.282 5.252 1.00 . A A . 27 SER O 1 1 19 11793 1 1 27 SER OG O -4.979 1.668 7.015 1.00 . A A . 27 SER OG 1 1 19 11794 1 1 28 LEU C C -0.361 2.652 2.025 1.00 . A A . 28 LEU C 1 1 19 11795 1 1 28 LEU CA C -1.020 1.412 2.620 1.00 . A A . 28 LEU CA 1 1 19 11796 1 1 28 LEU CB C -1.382 0.428 1.506 1.00 . A A . 28 LEU CB 1 1 19 11797 1 1 28 LEU CD1 C 0.756 -0.867 1.323 1.00 . A A . 28 LEU CD1 1 1 19 11798 1 1 28 LEU CD2 C -0.781 -0.710 -0.645 1.00 . A A . 28 LEU CD2 1 1 19 11799 1 1 28 LEU CG C -0.239 0.012 0.580 1.00 . A A . 28 LEU CG 1 1 19 11800 1 1 28 LEU H H -3.088 1.708 2.956 1.00 . A A . 28 LEU H 1 1 19 11801 1 1 28 LEU HA H -0.323 0.938 3.295 1.00 . A A . 28 LEU HA 1 1 19 11802 1 1 28 LEU HB2 H -1.775 -0.464 1.969 1.00 . A A . 28 LEU HB2 1 1 19 11803 1 1 28 LEU HB3 H -2.151 0.886 0.900 1.00 . A A . 28 LEU HB3 1 1 19 11804 1 1 28 LEU HD11 H 1.071 -0.369 2.227 1.00 . A A . 28 LEU HD11 1 1 19 11805 1 1 28 LEU HD12 H 1.615 -1.049 0.694 1.00 . A A . 28 LEU HD12 1 1 19 11806 1 1 28 LEU HD13 H 0.288 -1.808 1.573 1.00 . A A . 28 LEU HD13 1 1 19 11807 1 1 28 LEU HD21 H -1.230 0.007 -1.316 1.00 . A A . 28 LEU HD21 1 1 19 11808 1 1 28 LEU HD22 H -1.524 -1.431 -0.337 1.00 . A A . 28 LEU HD22 1 1 19 11809 1 1 28 LEU HD23 H 0.027 -1.220 -1.149 1.00 . A A . 28 LEU HD23 1 1 19 11810 1 1 28 LEU HG H 0.284 0.897 0.244 1.00 . A A . 28 LEU HG 1 1 19 11811 1 1 28 LEU N N -2.210 1.770 3.385 1.00 . A A . 28 LEU N 1 1 19 11812 1 1 28 LEU O O 0.779 2.982 2.353 1.00 . A A . 28 LEU O 1 1 19 11813 1 1 29 THR C C 0.075 5.473 1.525 1.00 . A A . 29 THR C 1 1 19 11814 1 1 29 THR CA C -0.574 4.543 0.507 1.00 . A A . 29 THR CA 1 1 19 11815 1 1 29 THR CB C -1.691 5.306 -0.230 1.00 . A A . 29 THR CB 1 1 19 11816 1 1 29 THR CG2 C -2.466 6.193 0.732 1.00 . A A . 29 THR CG2 1 1 19 11817 1 1 29 THR H H -1.989 3.025 0.927 1.00 . A A . 29 THR H 1 1 19 11818 1 1 29 THR HA H 0.168 4.244 -0.219 1.00 . A A . 29 THR HA 1 1 19 11819 1 1 29 THR HB H -2.373 4.587 -0.662 1.00 . A A . 29 THR HB 1 1 19 11820 1 1 29 THR HG1 H -1.165 5.620 -2.105 1.00 . A A . 29 THR HG1 1 1 19 11821 1 1 29 THR HG21 H -2.962 5.578 1.468 1.00 . A A . 29 THR HG21 1 1 19 11822 1 1 29 THR HG22 H -3.202 6.763 0.184 1.00 . A A . 29 THR HG22 1 1 19 11823 1 1 29 THR HG23 H -1.784 6.868 1.228 1.00 . A A . 29 THR HG23 1 1 19 11824 1 1 29 THR N N -1.087 3.338 1.148 1.00 . A A . 29 THR N 1 1 19 11825 1 1 29 THR O O 1.097 6.098 1.243 1.00 . A A . 29 THR O 1 1 19 11826 1 1 29 THR OG1 O -1.130 6.105 -1.277 1.00 . A A . 29 THR OG1 1 1 19 11827 1 1 30 GLN C C 1.230 5.790 4.414 1.00 . A A . 30 GLN C 1 1 19 11828 1 1 30 GLN CA C -0.003 6.414 3.768 1.00 . A A . 30 GLN CA 1 1 19 11829 1 1 30 GLN CB C -1.078 6.662 4.827 1.00 . A A . 30 GLN CB 1 1 19 11830 1 1 30 GLN CD C -3.130 7.978 5.494 1.00 . A A . 30 GLN CD 1 1 19 11831 1 1 30 GLN CG C -1.988 7.837 4.507 1.00 . A A . 30 GLN CG 1 1 19 11832 1 1 30 GLN H H -1.336 5.036 2.872 1.00 . A A . 30 GLN H 1 1 19 11833 1 1 30 GLN HA H 0.278 7.357 3.325 1.00 . A A . 30 GLN HA 1 1 19 11834 1 1 30 GLN HB2 H -1.688 5.776 4.918 1.00 . A A . 30 GLN HB2 1 1 19 11835 1 1 30 GLN HB3 H -0.596 6.857 5.774 1.00 . A A . 30 GLN HB3 1 1 19 11836 1 1 30 GLN HE21 H -3.981 9.363 4.350 1.00 . A A . 30 GLN HE21 1 1 19 11837 1 1 30 GLN HE22 H -4.823 8.970 5.806 1.00 . A A . 30 GLN HE22 1 1 19 11838 1 1 30 GLN HG2 H -1.403 8.745 4.526 1.00 . A A . 30 GLN HG2 1 1 19 11839 1 1 30 GLN HG3 H -2.400 7.697 3.518 1.00 . A A . 30 GLN HG3 1 1 19 11840 1 1 30 GLN N N -0.524 5.559 2.708 1.00 . A A . 30 GLN N 1 1 19 11841 1 1 30 GLN NE2 N -4.073 8.860 5.186 1.00 . A A . 30 GLN NE2 1 1 19 11842 1 1 30 GLN O O 2.117 6.496 4.894 1.00 . A A . 30 GLN O 1 1 19 11843 1 1 30 GLN OE1 O -3.163 7.301 6.522 1.00 . A A . 30 GLN OE1 1 1 19 11844 1 1 31 HIS C C 3.637 3.840 4.118 1.00 . A A . 31 HIS C 1 1 19 11845 1 1 31 HIS CA C 2.403 3.741 5.010 1.00 . A A . 31 HIS CA 1 1 19 11846 1 1 31 HIS CB C 2.036 2.274 5.233 1.00 . A A . 31 HIS CB 1 1 19 11847 1 1 31 HIS CD2 C 3.848 0.836 4.061 1.00 . A A . 31 HIS CD2 1 1 19 11848 1 1 31 HIS CE1 C 4.834 0.041 5.851 1.00 . A A . 31 HIS CE1 1 1 19 11849 1 1 31 HIS CG C 3.205 1.343 5.139 1.00 . A A . 31 HIS CG 1 1 19 11850 1 1 31 HIS H H 0.541 3.954 4.025 1.00 . A A . 31 HIS H 1 1 19 11851 1 1 31 HIS HA H 2.626 4.196 5.963 1.00 . A A . 31 HIS HA 1 1 19 11852 1 1 31 HIS HB2 H 1.603 2.163 6.217 1.00 . A A . 31 HIS HB2 1 1 19 11853 1 1 31 HIS HB3 H 1.311 1.974 4.490 1.00 . A A . 31 HIS HB3 1 1 19 11854 1 1 31 HIS HD1 H 3.613 1.007 7.178 1.00 . A A . 31 HIS HD1 1 1 19 11855 1 1 31 HIS HD2 H 3.613 1.029 3.024 1.00 . A A . 31 HIS HD2 1 1 19 11856 1 1 31 HIS HE1 H 5.508 -0.499 6.498 1.00 . A A . 31 HIS HE1 1 1 19 11857 1 1 31 HIS N N 1.278 4.461 4.423 1.00 . A A . 31 HIS N 1 1 19 11858 1 1 31 HIS ND1 N 3.846 0.825 6.244 1.00 . A A . 31 HIS ND1 1 1 19 11859 1 1 31 HIS NE2 N 4.857 0.030 4.530 1.00 . A A . 31 HIS NE2 1 1 19 11860 1 1 31 HIS O O 4.712 4.228 4.573 1.00 . A A . 31 HIS O 1 1 19 11861 1 1 32 GLN C C 5.512 4.694 2.202 1.00 . A A . 32 GLN C 1 1 19 11862 1 1 32 GLN CA C 4.573 3.533 1.893 1.00 . A A . 32 GLN CA 1 1 19 11863 1 1 32 GLN CB C 4.035 3.662 0.467 1.00 . A A . 32 GLN CB 1 1 19 11864 1 1 32 GLN CD C 4.815 1.686 -0.901 1.00 . A A . 32 GLN CD 1 1 19 11865 1 1 32 GLN CG C 3.658 2.331 -0.164 1.00 . A A . 32 GLN CG 1 1 19 11866 1 1 32 GLN H H 2.590 3.185 2.546 1.00 . A A . 32 GLN H 1 1 19 11867 1 1 32 GLN HA H 5.125 2.609 1.978 1.00 . A A . 32 GLN HA 1 1 19 11868 1 1 32 GLN HB2 H 3.157 4.290 0.482 1.00 . A A . 32 GLN HB2 1 1 19 11869 1 1 32 GLN HB3 H 4.790 4.126 -0.149 1.00 . A A . 32 GLN HB3 1 1 19 11870 1 1 32 GLN HE21 H 3.930 -0.090 -0.787 1.00 . A A . 32 GLN HE21 1 1 19 11871 1 1 32 GLN HE22 H 5.461 -0.064 -1.588 1.00 . A A . 32 GLN HE22 1 1 19 11872 1 1 32 GLN HG2 H 3.328 1.659 0.614 1.00 . A A . 32 GLN HG2 1 1 19 11873 1 1 32 GLN HG3 H 2.851 2.494 -0.862 1.00 . A A . 32 GLN HG3 1 1 19 11874 1 1 32 GLN N N 3.472 3.485 2.848 1.00 . A A . 32 GLN N 1 1 19 11875 1 1 32 GLN NE2 N 4.727 0.378 -1.113 1.00 . A A . 32 GLN NE2 1 1 19 11876 1 1 32 GLN O O 6.721 4.602 1.988 1.00 . A A . 32 GLN O 1 1 19 11877 1 1 32 GLN OE1 O 5.778 2.356 -1.276 1.00 . A A . 32 GLN OE1 1 1 19 11878 1 1 33 ARG C C 7.022 6.575 3.760 1.00 . A A . 33 ARG C 1 1 19 11879 1 1 33 ARG CA C 5.734 6.967 3.043 1.00 . A A . 33 ARG CA 1 1 19 11880 1 1 33 ARG CB C 4.917 7.917 3.921 1.00 . A A . 33 ARG CB 1 1 19 11881 1 1 33 ARG CD C 2.983 8.053 2.322 1.00 . A A . 33 ARG CD 1 1 19 11882 1 1 33 ARG CG C 4.001 8.839 3.133 1.00 . A A . 33 ARG CG 1 1 19 11883 1 1 33 ARG CZ C 3.516 8.387 -0.055 1.00 . A A . 33 ARG CZ 1 1 19 11884 1 1 33 ARG H H 3.979 5.800 2.854 1.00 . A A . 33 ARG H 1 1 19 11885 1 1 33 ARG HA H 5.987 7.471 2.122 1.00 . A A . 33 ARG HA 1 1 19 11886 1 1 33 ARG HB2 H 4.309 7.332 4.595 1.00 . A A . 33 ARG HB2 1 1 19 11887 1 1 33 ARG HB3 H 5.595 8.527 4.498 1.00 . A A . 33 ARG HB3 1 1 19 11888 1 1 33 ARG HD2 H 2.690 7.180 2.886 1.00 . A A . 33 ARG HD2 1 1 19 11889 1 1 33 ARG HD3 H 2.119 8.678 2.151 1.00 . A A . 33 ARG HD3 1 1 19 11890 1 1 33 ARG HE H 3.905 6.726 0.978 1.00 . A A . 33 ARG HE 1 1 19 11891 1 1 33 ARG HG2 H 3.476 9.485 3.821 1.00 . A A . 33 ARG HG2 1 1 19 11892 1 1 33 ARG HG3 H 4.600 9.437 2.461 1.00 . A A . 33 ARG HG3 1 1 19 11893 1 1 33 ARG HH11 H 2.621 9.959 0.845 1.00 . A A . 33 ARG HH11 1 1 19 11894 1 1 33 ARG HH12 H 3.002 10.182 -0.830 1.00 . A A . 33 ARG HH12 1 1 19 11895 1 1 33 ARG HH21 H 4.412 7.007 -1.228 1.00 . A A . 33 ARG HH21 1 1 19 11896 1 1 33 ARG HH22 H 4.020 8.502 -2.009 1.00 . A A . 33 ARG HH22 1 1 19 11897 1 1 33 ARG N N 4.947 5.787 2.706 1.00 . A A . 33 ARG N 1 1 19 11898 1 1 33 ARG NE N 3.521 7.625 1.033 1.00 . A A . 33 ARG NE 1 1 19 11899 1 1 33 ARG NH1 N 3.004 9.609 -0.010 1.00 . A A . 33 ARG NH1 1 1 19 11900 1 1 33 ARG NH2 N 4.025 7.927 -1.191 1.00 . A A . 33 ARG NH2 1 1 19 11901 1 1 33 ARG O O 8.108 7.031 3.402 1.00 . A A . 33 ARG O 1 1 19 11902 1 1 34 VAL C C 9.270 5.104 4.651 1.00 . A A . 34 VAL C 1 1 19 11903 1 1 34 VAL CA C 8.047 5.275 5.545 1.00 . A A . 34 VAL CA 1 1 19 11904 1 1 34 VAL CB C 7.756 3.942 6.259 1.00 . A A . 34 VAL CB 1 1 19 11905 1 1 34 VAL CG1 C 6.587 4.094 7.220 1.00 . A A . 34 VAL CG1 1 1 19 11906 1 1 34 VAL CG2 C 7.483 2.842 5.244 1.00 . A A . 34 VAL CG2 1 1 19 11907 1 1 34 VAL H H 6.001 5.401 5.016 1.00 . A A . 34 VAL H 1 1 19 11908 1 1 34 VAL HA H 8.263 6.022 6.295 1.00 . A A . 34 VAL HA 1 1 19 11909 1 1 34 VAL HB H 8.630 3.665 6.831 1.00 . A A . 34 VAL HB 1 1 19 11910 1 1 34 VAL HG11 H 5.807 4.674 6.748 1.00 . A A . 34 VAL HG11 1 1 19 11911 1 1 34 VAL HG12 H 6.205 3.118 7.480 1.00 . A A . 34 VAL HG12 1 1 19 11912 1 1 34 VAL HG13 H 6.920 4.600 8.114 1.00 . A A . 34 VAL HG13 1 1 19 11913 1 1 34 VAL HG21 H 6.502 2.984 4.814 1.00 . A A . 34 VAL HG21 1 1 19 11914 1 1 34 VAL HG22 H 8.228 2.882 4.462 1.00 . A A . 34 VAL HG22 1 1 19 11915 1 1 34 VAL HG23 H 7.526 1.880 5.733 1.00 . A A . 34 VAL HG23 1 1 19 11916 1 1 34 VAL N N 6.893 5.729 4.777 1.00 . A A . 34 VAL N 1 1 19 11917 1 1 34 VAL O O 10.401 5.340 5.076 1.00 . A A . 34 VAL O 1 1 19 11918 1 1 35 HIS C C 10.330 5.739 1.601 1.00 . A A . 35 HIS C 1 1 19 11919 1 1 35 HIS CA C 10.118 4.492 2.453 1.00 . A A . 35 HIS CA 1 1 19 11920 1 1 35 HIS CB C 9.817 3.292 1.554 1.00 . A A . 35 HIS CB 1 1 19 11921 1 1 35 HIS CD2 C 8.080 1.473 2.190 1.00 . A A . 35 HIS CD2 1 1 19 11922 1 1 35 HIS CE1 C 9.236 0.457 3.751 1.00 . A A . 35 HIS CE1 1 1 19 11923 1 1 35 HIS CG C 9.269 2.111 2.296 1.00 . A A . 35 HIS CG 1 1 19 11924 1 1 35 HIS H H 8.112 4.522 3.128 1.00 . A A . 35 HIS H 1 1 19 11925 1 1 35 HIS HA H 11.021 4.295 3.011 1.00 . A A . 35 HIS HA 1 1 19 11926 1 1 35 HIS HB2 H 9.090 3.581 0.810 1.00 . A A . 35 HIS HB2 1 1 19 11927 1 1 35 HIS HB3 H 10.727 2.982 1.061 1.00 . A A . 35 HIS HB3 1 1 19 11928 1 1 35 HIS HD1 H 10.872 1.676 3.592 1.00 . A A . 35 HIS HD1 1 1 19 11929 1 1 35 HIS HD2 H 7.276 1.723 1.512 1.00 . A A . 35 HIS HD2 1 1 19 11930 1 1 35 HIS HE1 H 9.528 -0.231 4.530 1.00 . A A . 35 HIS HE1 1 1 19 11931 1 1 35 HIS N N 9.035 4.693 3.409 1.00 . A A . 35 HIS N 1 1 19 11932 1 1 35 HIS ND1 N 9.970 1.451 3.283 1.00 . A A . 35 HIS ND1 1 1 19 11933 1 1 35 HIS NE2 N 8.084 0.449 3.105 1.00 . A A . 35 HIS NE2 1 1 19 11934 1 1 35 HIS O O 9.392 6.495 1.346 1.00 . A A . 35 HIS O 1 1 19 11935 1 1 36 SER C C 11.549 6.859 -1.119 1.00 . A A . 36 SER C 1 1 19 11936 1 1 36 SER CA C 11.903 7.107 0.344 1.00 . A A . 36 SER CA 1 1 19 11937 1 1 36 SER CB C 13.392 7.434 0.472 1.00 . A A . 36 SER CB 1 1 19 11938 1 1 36 SER H H 12.272 5.309 1.400 1.00 . A A . 36 SER H 1 1 19 11939 1 1 36 SER HA H 11.327 7.946 0.704 1.00 . A A . 36 SER HA 1 1 19 11940 1 1 36 SER HB2 H 13.963 6.518 0.449 1.00 . A A . 36 SER HB2 1 1 19 11941 1 1 36 SER HB3 H 13.691 8.065 -0.353 1.00 . A A . 36 SER HB3 1 1 19 11942 1 1 36 SER HG H 13.764 9.051 1.514 1.00 . A A . 36 SER HG 1 1 19 11943 1 1 36 SER N N 11.568 5.948 1.163 1.00 . A A . 36 SER N 1 1 19 11944 1 1 36 SER O O 11.226 5.738 -1.510 1.00 . A A . 36 SER O 1 1 19 11945 1 1 36 SER OG O 13.663 8.112 1.686 1.00 . A A . 36 SER OG 1 1 19 11946 1 1 37 GLY C C 11.856 6.523 -3.947 1.00 . A A . 37 GLY C 1 1 19 11947 1 1 37 GLY CA C 11.296 7.791 -3.336 1.00 . A A . 37 GLY CA 1 1 19 11948 1 1 37 GLY H H 11.876 8.784 -1.558 1.00 . A A . 37 GLY H 1 1 19 11949 1 1 37 GLY HA2 H 10.223 7.792 -3.454 1.00 . A A . 37 GLY HA2 1 1 19 11950 1 1 37 GLY HA3 H 11.707 8.642 -3.860 1.00 . A A . 37 GLY HA3 1 1 19 11951 1 1 37 GLY N N 11.612 7.915 -1.925 1.00 . A A . 37 GLY N 1 1 19 11952 1 1 37 GLY O O 11.127 5.555 -4.161 1.00 . A A . 37 GLY O 1 1 19 11953 1 1 38 GLU C C 15.324 5.442 -4.632 1.00 . A A . 38 GLU C 1 1 19 11954 1 1 38 GLU CA C 13.811 5.368 -4.823 1.00 . A A . 38 GLU CA 1 1 19 11955 1 1 38 GLU CB C 13.478 5.272 -6.313 1.00 . A A . 38 GLU CB 1 1 19 11956 1 1 38 GLU CD C 15.421 6.147 -7.669 1.00 . A A . 38 GLU CD 1 1 19 11957 1 1 38 GLU CG C 14.029 6.425 -7.135 1.00 . A A . 38 GLU CG 1 1 19 11958 1 1 38 GLU H H 13.684 7.329 -4.035 1.00 . A A . 38 GLU H 1 1 19 11959 1 1 38 GLU HA H 13.441 4.486 -4.323 1.00 . A A . 38 GLU HA 1 1 19 11960 1 1 38 GLU HB2 H 13.886 4.351 -6.702 1.00 . A A . 38 GLU HB2 1 1 19 11961 1 1 38 GLU HB3 H 12.404 5.257 -6.428 1.00 . A A . 38 GLU HB3 1 1 19 11962 1 1 38 GLU HG2 H 13.369 6.602 -7.971 1.00 . A A . 38 GLU HG2 1 1 19 11963 1 1 38 GLU HG3 H 14.068 7.307 -6.514 1.00 . A A . 38 GLU HG3 1 1 19 11964 1 1 38 GLU N N 13.155 6.527 -4.230 1.00 . A A . 38 GLU N 1 1 19 11965 1 1 38 GLU O O 15.852 6.443 -4.149 1.00 . A A . 38 GLU O 1 1 19 11966 1 1 38 GLU OE1 O 15.639 5.041 -8.208 1.00 . A A . 38 GLU OE1 1 1 19 11967 1 1 38 GLU OE2 O 16.291 7.034 -7.549 1.00 . A A . 38 GLU OE2 1 1 19 11968 1 1 39 LYS C C 17.913 4.809 -3.517 1.00 . A A . 39 LYS C 1 1 19 11969 1 1 39 LYS CA C 17.467 4.317 -4.890 1.00 . A A . 39 LYS CA 1 1 19 11970 1 1 39 LYS CB C 18.129 5.157 -5.984 1.00 . A A . 39 LYS CB 1 1 19 11971 1 1 39 LYS CD C 20.571 4.996 -5.418 1.00 . A A . 39 LYS CD 1 1 19 11972 1 1 39 LYS CE C 21.922 4.432 -5.831 1.00 . A A . 39 LYS CE 1 1 19 11973 1 1 39 LYS CG C 19.486 4.631 -6.417 1.00 . A A . 39 LYS CG 1 1 19 11974 1 1 39 LYS H H 15.538 3.606 -5.395 1.00 . A A . 39 LYS H 1 1 19 11975 1 1 39 LYS HA H 17.769 3.287 -5.006 1.00 . A A . 39 LYS HA 1 1 19 11976 1 1 39 LYS HB2 H 17.481 5.176 -6.848 1.00 . A A . 39 LYS HB2 1 1 19 11977 1 1 39 LYS HB3 H 18.257 6.166 -5.619 1.00 . A A . 39 LYS HB3 1 1 19 11978 1 1 39 LYS HD2 H 20.646 6.072 -5.358 1.00 . A A . 39 LYS HD2 1 1 19 11979 1 1 39 LYS HD3 H 20.304 4.597 -4.449 1.00 . A A . 39 LYS HD3 1 1 19 11980 1 1 39 LYS HE2 H 21.973 3.397 -5.528 1.00 . A A . 39 LYS HE2 1 1 19 11981 1 1 39 LYS HE3 H 22.011 4.497 -6.905 1.00 . A A . 39 LYS HE3 1 1 19 11982 1 1 39 LYS HG2 H 19.436 3.555 -6.500 1.00 . A A . 39 LYS HG2 1 1 19 11983 1 1 39 LYS HG3 H 19.737 5.056 -7.379 1.00 . A A . 39 LYS HG3 1 1 19 11984 1 1 39 LYS HZ1 H 23.455 5.850 -5.885 1.00 . A A . 39 LYS HZ1 1 1 19 11985 1 1 39 LYS HZ2 H 23.791 4.514 -4.903 1.00 . A A . 39 LYS HZ2 1 1 19 11986 1 1 39 LYS HZ3 H 22.711 5.702 -4.373 1.00 . A A . 39 LYS HZ3 1 1 19 11987 1 1 39 LYS N N 16.015 4.375 -5.016 1.00 . A A . 39 LYS N 1 1 19 11988 1 1 39 LYS NZ N 23.049 5.177 -5.204 1.00 . A A . 39 LYS NZ 1 1 19 11989 1 1 39 LYS O O 18.736 5.716 -3.393 1.00 . A A . 39 LYS O 1 1 19 11990 1 1 40 PRO C C 19.109 4.148 -0.693 1.00 . A A . 40 PRO C 1 1 19 11991 1 1 40 PRO CA C 17.689 4.554 -1.076 1.00 . A A . 40 PRO CA 1 1 19 11992 1 1 40 PRO CB C 16.668 3.765 -0.253 1.00 . A A . 40 PRO CB 1 1 19 11993 1 1 40 PRO CD C 16.374 3.106 -2.532 1.00 . A A . 40 PRO CD 1 1 19 11994 1 1 40 PRO CG C 16.300 2.607 -1.115 1.00 . A A . 40 PRO CG 1 1 19 11995 1 1 40 PRO HA H 17.558 5.611 -0.898 1.00 . A A . 40 PRO HA 1 1 19 11996 1 1 40 PRO HB2 H 17.121 3.441 0.673 1.00 . A A . 40 PRO HB2 1 1 19 11997 1 1 40 PRO HB3 H 15.811 4.388 -0.043 1.00 . A A . 40 PRO HB3 1 1 19 11998 1 1 40 PRO HD2 H 16.714 2.321 -3.191 1.00 . A A . 40 PRO HD2 1 1 19 11999 1 1 40 PRO HD3 H 15.412 3.478 -2.851 1.00 . A A . 40 PRO HD3 1 1 19 12000 1 1 40 PRO HG2 H 17.001 1.800 -0.965 1.00 . A A . 40 PRO HG2 1 1 19 12001 1 1 40 PRO HG3 H 15.296 2.282 -0.884 1.00 . A A . 40 PRO HG3 1 1 19 12002 1 1 40 PRO N N 17.361 4.196 -2.459 1.00 . A A . 40 PRO N 1 1 19 12003 1 1 40 PRO O O 19.654 3.183 -1.228 1.00 . A A . 40 PRO O 1 1 19 12004 1 1 41 SER C C 21.052 4.008 2.089 1.00 . A A . 41 SER C 1 1 19 12005 1 1 41 SER CA C 21.059 4.611 0.687 1.00 . A A . 41 SER CA 1 1 19 12006 1 1 41 SER CB C 21.899 5.890 0.674 1.00 . A A . 41 SER CB 1 1 19 12007 1 1 41 SER H H 19.215 5.648 0.625 1.00 . A A . 41 SER H 1 1 19 12008 1 1 41 SER HA H 21.495 3.897 0.004 1.00 . A A . 41 SER HA 1 1 19 12009 1 1 41 SER HB2 H 21.520 6.573 1.419 1.00 . A A . 41 SER HB2 1 1 19 12010 1 1 41 SER HB3 H 22.927 5.645 0.899 1.00 . A A . 41 SER HB3 1 1 19 12011 1 1 41 SER HG H 22.514 6.140 -1.169 1.00 . A A . 41 SER HG 1 1 19 12012 1 1 41 SER N N 19.702 4.891 0.236 1.00 . A A . 41 SER N 1 1 19 12013 1 1 41 SER O O 20.193 4.327 2.909 1.00 . A A . 41 SER O 1 1 19 12014 1 1 41 SER OG O 21.846 6.521 -0.594 1.00 . A A . 41 SER OG 1 1 19 12015 1 1 42 GLY C C 23.505 2.010 3.972 1.00 . A A . 42 GLY C 1 1 19 12016 1 1 42 GLY CA C 22.105 2.500 3.658 1.00 . A A . 42 GLY CA 1 1 19 12017 1 1 42 GLY H H 22.676 2.918 1.663 1.00 . A A . 42 GLY H 1 1 19 12018 1 1 42 GLY HA2 H 21.806 3.211 4.414 1.00 . A A . 42 GLY HA2 1 1 19 12019 1 1 42 GLY HA3 H 21.428 1.659 3.683 1.00 . A A . 42 GLY HA3 1 1 19 12020 1 1 42 GLY N N 22.018 3.134 2.356 1.00 . A A . 42 GLY N 1 1 19 12021 1 1 42 GLY O O 24.214 1.496 3.107 1.00 . A A . 42 GLY O 1 1 19 12022 1 1 43 PRO C C 25.394 0.231 5.732 1.00 . A A . 43 PRO C 1 1 19 12023 1 1 43 PRO CA C 25.251 1.748 5.691 1.00 . A A . 43 PRO CA 1 1 19 12024 1 1 43 PRO CB C 25.346 2.334 7.102 1.00 . A A . 43 PRO CB 1 1 19 12025 1 1 43 PRO CD C 23.131 2.776 6.320 1.00 . A A . 43 PRO CD 1 1 19 12026 1 1 43 PRO CG C 23.932 2.465 7.553 1.00 . A A . 43 PRO CG 1 1 19 12027 1 1 43 PRO HA H 26.033 2.166 5.073 1.00 . A A . 43 PRO HA 1 1 19 12028 1 1 43 PRO HB2 H 25.904 1.660 7.737 1.00 . A A . 43 PRO HB2 1 1 19 12029 1 1 43 PRO HB3 H 25.839 3.293 7.065 1.00 . A A . 43 PRO HB3 1 1 19 12030 1 1 43 PRO HD2 H 22.152 2.324 6.381 1.00 . A A . 43 PRO HD2 1 1 19 12031 1 1 43 PRO HD3 H 23.047 3.845 6.184 1.00 . A A . 43 PRO HD3 1 1 19 12032 1 1 43 PRO HG2 H 23.599 1.536 7.992 1.00 . A A . 43 PRO HG2 1 1 19 12033 1 1 43 PRO HG3 H 23.849 3.270 8.268 1.00 . A A . 43 PRO HG3 1 1 19 12034 1 1 43 PRO N N 23.923 2.171 5.236 1.00 . A A . 43 PRO N 1 1 19 12035 1 1 43 PRO O O 24.987 -0.414 6.699 1.00 . A A . 43 PRO O 1 1 19 12036 1 1 44 SER C C 27.187 -2.125 3.513 1.00 . A A . 44 SER C 1 1 19 12037 1 1 44 SER CA C 26.168 -1.776 4.594 1.00 . A A . 44 SER CA 1 1 19 12038 1 1 44 SER CB C 24.839 -2.474 4.301 1.00 . A A . 44 SER CB 1 1 19 12039 1 1 44 SER H H 26.278 0.234 3.939 1.00 . A A . 44 SER H 1 1 19 12040 1 1 44 SER HA H 26.542 -2.117 5.548 1.00 . A A . 44 SER HA 1 1 19 12041 1 1 44 SER HB2 H 24.048 -1.981 4.846 1.00 . A A . 44 SER HB2 1 1 19 12042 1 1 44 SER HB3 H 24.633 -2.421 3.242 1.00 . A A . 44 SER HB3 1 1 19 12043 1 1 44 SER HG H 25.539 -3.952 5.380 1.00 . A A . 44 SER HG 1 1 19 12044 1 1 44 SER N N 25.975 -0.334 4.678 1.00 . A A . 44 SER N 1 1 19 12045 1 1 44 SER O O 27.567 -1.277 2.706 1.00 . A A . 44 SER O 1 1 19 12046 1 1 44 SER OG O 24.881 -3.836 4.690 1.00 . A A . 44 SER OG 1 1 19 12047 1 1 45 SER C C 28.366 -5.306 2.171 1.00 . A A . 45 SER C 1 1 19 12048 1 1 45 SER CA C 28.603 -3.842 2.527 1.00 . A A . 45 SER CA 1 1 19 12049 1 1 45 SER CB C 30.023 -3.660 3.068 1.00 . A A . 45 SER CB 1 1 19 12050 1 1 45 SER H H 27.285 -4.009 4.175 1.00 . A A . 45 SER H 1 1 19 12051 1 1 45 SER HA H 28.488 -3.244 1.635 1.00 . A A . 45 SER HA 1 1 19 12052 1 1 45 SER HB2 H 30.725 -3.691 2.249 1.00 . A A . 45 SER HB2 1 1 19 12053 1 1 45 SER HB3 H 30.095 -2.705 3.569 1.00 . A A . 45 SER HB3 1 1 19 12054 1 1 45 SER HG H 31.018 -5.260 3.606 1.00 . A A . 45 SER HG 1 1 19 12055 1 1 45 SER N N 27.626 -3.380 3.505 1.00 . A A . 45 SER N 1 1 19 12056 1 1 45 SER O O 28.352 -6.174 3.043 1.00 . A A . 45 SER O 1 1 19 12057 1 1 45 SER OG O 30.352 -4.685 3.990 1.00 . A A . 45 SER OG 1 1 19 12058 1 1 46 GLY C C 29.162 -7.540 -0.238 1.00 . A A . 46 GLY C 1 1 19 12059 1 1 46 GLY CA C 27.945 -6.933 0.432 1.00 . A A . 46 GLY CA 1 1 19 12060 1 1 46 GLY H H 28.202 -4.841 0.231 1.00 . A A . 46 GLY H 1 1 19 12061 1 1 46 GLY HA2 H 27.675 -7.540 1.283 1.00 . A A . 46 GLY HA2 1 1 19 12062 1 1 46 GLY HA3 H 27.125 -6.931 -0.271 1.00 . A A . 46 GLY HA3 1 1 19 12063 1 1 46 GLY N N 28.180 -5.573 0.882 1.00 . A A . 46 GLY N 1 1 19 12064 1 1 46 GLY O O 30.051 -8.024 0.461 1.00 . A A . 46 GLY O 1 1 19 12065 2 2 1 ZN ZN ZN 6.458 -0.763 3.423 1.00 . B A . 181 ZN ZN 1 1 20 12066 1 1 1 GLY C C 10.747 -20.857 16.641 1.00 . A A . 1 GLY C 1 1 20 12067 1 1 1 GLY CA C 11.705 -21.337 17.714 1.00 . A A . 1 GLY CA 1 1 20 12068 1 1 1 GLY H1 H 11.368 -21.441 19.801 1.00 . A A . 1 GLY H1 1 1 20 12069 1 1 1 GLY HA2 H 12.702 -21.008 17.465 1.00 . A A . 1 GLY HA2 1 1 20 12070 1 1 1 GLY HA3 H 11.688 -22.417 17.737 1.00 . A A . 1 GLY HA3 1 1 20 12071 1 1 1 GLY N N 11.360 -20.836 19.031 1.00 . A A . 1 GLY N 1 1 20 12072 1 1 1 GLY O O 10.207 -19.754 16.730 1.00 . A A . 1 GLY O 1 1 20 12073 1 1 2 SER C C 8.206 -21.741 14.847 1.00 . A A . 2 SER C 1 1 20 12074 1 1 2 SER CA C 9.642 -21.337 14.526 1.00 . A A . 2 SER CA 1 1 20 12075 1 1 2 SER CB C 10.098 -22.015 13.233 1.00 . A A . 2 SER CB 1 1 20 12076 1 1 2 SER H H 10.996 -22.551 15.609 1.00 . A A . 2 SER H 1 1 20 12077 1 1 2 SER HA H 9.681 -20.266 14.394 1.00 . A A . 2 SER HA 1 1 20 12078 1 1 2 SER HB2 H 9.419 -21.756 12.435 1.00 . A A . 2 SER HB2 1 1 20 12079 1 1 2 SER HB3 H 11.093 -21.675 12.983 1.00 . A A . 2 SER HB3 1 1 20 12080 1 1 2 SER HG H 9.597 -23.677 14.142 1.00 . A A . 2 SER HG 1 1 20 12081 1 1 2 SER N N 10.537 -21.686 15.624 1.00 . A A . 2 SER N 1 1 20 12082 1 1 2 SER O O 7.907 -22.922 15.025 1.00 . A A . 2 SER O 1 1 20 12083 1 1 2 SER OG O 10.119 -23.425 13.376 1.00 . A A . 2 SER OG 1 1 20 12084 1 1 3 SER C C 5.063 -20.902 13.961 1.00 . A A . 3 SER C 1 1 20 12085 1 1 3 SER CA C 5.917 -21.002 15.221 1.00 . A A . 3 SER CA 1 1 20 12086 1 1 3 SER CB C 5.415 -20.010 16.272 1.00 . A A . 3 SER CB 1 1 20 12087 1 1 3 SER H H 7.621 -19.831 14.766 1.00 . A A . 3 SER H 1 1 20 12088 1 1 3 SER HA H 5.837 -22.004 15.617 1.00 . A A . 3 SER HA 1 1 20 12089 1 1 3 SER HB2 H 5.901 -19.058 16.124 1.00 . A A . 3 SER HB2 1 1 20 12090 1 1 3 SER HB3 H 4.346 -19.889 16.167 1.00 . A A . 3 SER HB3 1 1 20 12091 1 1 3 SER HG H 4.876 -20.567 18.071 1.00 . A A . 3 SER HG 1 1 20 12092 1 1 3 SER N N 7.321 -20.752 14.918 1.00 . A A . 3 SER N 1 1 20 12093 1 1 3 SER O O 4.260 -21.787 13.669 1.00 . A A . 3 SER O 1 1 20 12094 1 1 3 SER OG O 5.697 -20.469 17.582 1.00 . A A . 3 SER OG 1 1 20 12095 1 1 4 GLY C C 5.284 -18.906 10.923 1.00 . A A . 4 GLY C 1 1 20 12096 1 1 4 GLY CA C 4.483 -19.616 11.996 1.00 . A A . 4 GLY CA 1 1 20 12097 1 1 4 GLY H H 5.897 -19.141 13.499 1.00 . A A . 4 GLY H 1 1 20 12098 1 1 4 GLY HA2 H 4.170 -20.579 11.620 1.00 . A A . 4 GLY HA2 1 1 20 12099 1 1 4 GLY HA3 H 3.606 -19.027 12.224 1.00 . A A . 4 GLY HA3 1 1 20 12100 1 1 4 GLY N N 5.243 -19.814 13.217 1.00 . A A . 4 GLY N 1 1 20 12101 1 1 4 GLY O O 6.277 -18.241 11.218 1.00 . A A . 4 GLY O 1 1 20 12102 1 1 5 SER C C 4.686 -17.311 7.944 1.00 . A A . 5 SER C 1 1 20 12103 1 1 5 SER CA C 5.540 -18.419 8.552 1.00 . A A . 5 SER CA 1 1 20 12104 1 1 5 SER CB C 5.879 -19.462 7.485 1.00 . A A . 5 SER CB 1 1 20 12105 1 1 5 SER H H 4.055 -19.591 9.503 1.00 . A A . 5 SER H 1 1 20 12106 1 1 5 SER HA H 6.457 -17.987 8.925 1.00 . A A . 5 SER HA 1 1 20 12107 1 1 5 SER HB2 H 6.432 -18.990 6.687 1.00 . A A . 5 SER HB2 1 1 20 12108 1 1 5 SER HB3 H 6.479 -20.243 7.927 1.00 . A A . 5 SER HB3 1 1 20 12109 1 1 5 SER HG H 4.248 -20.539 7.627 1.00 . A A . 5 SER HG 1 1 20 12110 1 1 5 SER N N 4.853 -19.048 9.674 1.00 . A A . 5 SER N 1 1 20 12111 1 1 5 SER O O 3.459 -17.406 7.909 1.00 . A A . 5 SER O 1 1 20 12112 1 1 5 SER OG O 4.703 -20.039 6.945 1.00 . A A . 5 SER OG 1 1 20 12113 1 1 6 SER C C 3.986 -15.541 5.547 1.00 . A A . 6 SER C 1 1 20 12114 1 1 6 SER CA C 4.646 -15.131 6.860 1.00 . A A . 6 SER CA 1 1 20 12115 1 1 6 SER CB C 5.618 -13.975 6.617 1.00 . A A . 6 SER CB 1 1 20 12116 1 1 6 SER H H 6.323 -16.244 7.521 1.00 . A A . 6 SER H 1 1 20 12117 1 1 6 SER HA H 3.881 -14.808 7.550 1.00 . A A . 6 SER HA 1 1 20 12118 1 1 6 SER HB2 H 5.083 -13.144 6.183 1.00 . A A . 6 SER HB2 1 1 20 12119 1 1 6 SER HB3 H 6.054 -13.671 7.558 1.00 . A A . 6 SER HB3 1 1 20 12120 1 1 6 SER HG H 7.507 -14.223 6.161 1.00 . A A . 6 SER HG 1 1 20 12121 1 1 6 SER N N 5.344 -16.260 7.464 1.00 . A A . 6 SER N 1 1 20 12122 1 1 6 SER O O 4.146 -16.669 5.084 1.00 . A A . 6 SER O 1 1 20 12123 1 1 6 SER OG O 6.658 -14.360 5.735 1.00 . A A . 6 SER OG 1 1 20 12124 1 1 7 GLY C C 1.083 -15.141 3.881 1.00 . A A . 7 GLY C 1 1 20 12125 1 1 7 GLY CA C 2.567 -14.895 3.699 1.00 . A A . 7 GLY CA 1 1 20 12126 1 1 7 GLY H H 3.150 -13.730 5.368 1.00 . A A . 7 GLY H 1 1 20 12127 1 1 7 GLY HA2 H 2.703 -14.056 3.032 1.00 . A A . 7 GLY HA2 1 1 20 12128 1 1 7 GLY HA3 H 3.013 -15.772 3.253 1.00 . A A . 7 GLY HA3 1 1 20 12129 1 1 7 GLY N N 3.242 -14.613 4.952 1.00 . A A . 7 GLY N 1 1 20 12130 1 1 7 GLY O O 0.613 -16.274 3.764 1.00 . A A . 7 GLY O 1 1 20 12131 1 1 8 THR C C -1.855 -13.213 3.471 1.00 . A A . 8 THR C 1 1 20 12132 1 1 8 THR CA C -1.100 -14.183 4.373 1.00 . A A . 8 THR CA 1 1 20 12133 1 1 8 THR CB C -1.483 -13.906 5.840 1.00 . A A . 8 THR CB 1 1 20 12134 1 1 8 THR CG2 C -0.951 -15.000 6.753 1.00 . A A . 8 THR CG2 1 1 20 12135 1 1 8 THR H H 0.771 -13.201 4.251 1.00 . A A . 8 THR H 1 1 20 12136 1 1 8 THR HA H -1.398 -15.193 4.130 1.00 . A A . 8 THR HA 1 1 20 12137 1 1 8 THR HB H -2.561 -13.886 5.916 1.00 . A A . 8 THR HB 1 1 20 12138 1 1 8 THR HG1 H -0.071 -12.531 5.906 1.00 . A A . 8 THR HG1 1 1 20 12139 1 1 8 THR HG21 H -1.454 -15.929 6.532 1.00 . A A . 8 THR HG21 1 1 20 12140 1 1 8 THR HG22 H -1.133 -14.729 7.783 1.00 . A A . 8 THR HG22 1 1 20 12141 1 1 8 THR HG23 H 0.110 -15.118 6.594 1.00 . A A . 8 THR HG23 1 1 20 12142 1 1 8 THR N N 0.339 -14.077 4.171 1.00 . A A . 8 THR N 1 1 20 12143 1 1 8 THR O O -1.908 -12.014 3.740 1.00 . A A . 8 THR O 1 1 20 12144 1 1 8 THR OG1 O -0.961 -12.638 6.251 1.00 . A A . 8 THR OG1 1 1 20 12145 1 1 9 GLY C C -4.573 -12.578 1.980 1.00 . A A . 9 GLY C 1 1 20 12146 1 1 9 GLY CA C -3.182 -12.907 1.474 1.00 . A A . 9 GLY CA 1 1 20 12147 1 1 9 GLY H H -2.361 -14.704 2.235 1.00 . A A . 9 GLY H 1 1 20 12148 1 1 9 GLY HA2 H -2.640 -11.987 1.319 1.00 . A A . 9 GLY HA2 1 1 20 12149 1 1 9 GLY HA3 H -3.269 -13.426 0.530 1.00 . A A . 9 GLY HA3 1 1 20 12150 1 1 9 GLY N N -2.438 -13.741 2.399 1.00 . A A . 9 GLY N 1 1 20 12151 1 1 9 GLY O O -5.557 -12.745 1.260 1.00 . A A . 9 GLY O 1 1 20 12152 1 1 10 GLU C C -6.425 -10.410 3.313 1.00 . A A . 10 GLU C 1 1 20 12153 1 1 10 GLU CA C -5.935 -11.762 3.824 1.00 . A A . 10 GLU CA 1 1 20 12154 1 1 10 GLU CB C -5.816 -11.731 5.349 1.00 . A A . 10 GLU CB 1 1 20 12155 1 1 10 GLU CD C -4.927 -10.468 7.348 1.00 . A A . 10 GLU CD 1 1 20 12156 1 1 10 GLU CG C -4.797 -10.726 5.860 1.00 . A A . 10 GLU CG 1 1 20 12157 1 1 10 GLU H H -3.833 -12.001 3.746 1.00 . A A . 10 GLU H 1 1 20 12158 1 1 10 GLU HA H -6.651 -12.519 3.544 1.00 . A A . 10 GLU HA 1 1 20 12159 1 1 10 GLU HB2 H -6.779 -11.480 5.768 1.00 . A A . 10 GLU HB2 1 1 20 12160 1 1 10 GLU HB3 H -5.527 -12.712 5.695 1.00 . A A . 10 GLU HB3 1 1 20 12161 1 1 10 GLU HG2 H -3.806 -11.106 5.661 1.00 . A A . 10 GLU HG2 1 1 20 12162 1 1 10 GLU HG3 H -4.935 -9.793 5.334 1.00 . A A . 10 GLU HG3 1 1 20 12163 1 1 10 GLU N N -4.654 -12.112 3.222 1.00 . A A . 10 GLU N 1 1 20 12164 1 1 10 GLU O O -7.626 -10.143 3.281 1.00 . A A . 10 GLU O 1 1 20 12165 1 1 10 GLU OE1 O -5.981 -9.948 7.771 1.00 . A A . 10 GLU OE1 1 1 20 12166 1 1 10 GLU OE2 O -3.975 -10.786 8.090 1.00 . A A . 10 GLU OE2 1 1 20 12167 1 1 11 LYS C C -5.391 -8.089 0.948 1.00 . A A . 11 LYS C 1 1 20 12168 1 1 11 LYS CA C -5.818 -8.234 2.406 1.00 . A A . 11 LYS CA 1 1 20 12169 1 1 11 LYS CB C -5.144 -7.154 3.255 1.00 . A A . 11 LYS CB 1 1 20 12170 1 1 11 LYS CD C -5.793 -7.554 5.649 1.00 . A A . 11 LYS CD 1 1 20 12171 1 1 11 LYS CE C -6.185 -6.824 6.924 1.00 . A A . 11 LYS CE 1 1 20 12172 1 1 11 LYS CG C -5.993 -6.680 4.422 1.00 . A A . 11 LYS CG 1 1 20 12173 1 1 11 LYS H H -4.543 -9.829 2.965 1.00 . A A . 11 LYS H 1 1 20 12174 1 1 11 LYS HA H -6.889 -8.114 2.469 1.00 . A A . 11 LYS HA 1 1 20 12175 1 1 11 LYS HB2 H -4.218 -7.547 3.647 1.00 . A A . 11 LYS HB2 1 1 20 12176 1 1 11 LYS HB3 H -4.927 -6.302 2.627 1.00 . A A . 11 LYS HB3 1 1 20 12177 1 1 11 LYS HD2 H -6.403 -8.440 5.553 1.00 . A A . 11 LYS HD2 1 1 20 12178 1 1 11 LYS HD3 H -4.752 -7.838 5.712 1.00 . A A . 11 LYS HD3 1 1 20 12179 1 1 11 LYS HE2 H -7.181 -6.427 6.804 1.00 . A A . 11 LYS HE2 1 1 20 12180 1 1 11 LYS HE3 H -6.173 -7.527 7.744 1.00 . A A . 11 LYS HE3 1 1 20 12181 1 1 11 LYS HG2 H -5.718 -5.665 4.668 1.00 . A A . 11 LYS HG2 1 1 20 12182 1 1 11 LYS HG3 H -7.035 -6.713 4.134 1.00 . A A . 11 LYS HG3 1 1 20 12183 1 1 11 LYS HZ1 H -5.252 -5.014 6.454 1.00 . A A . 11 LYS HZ1 1 1 20 12184 1 1 11 LYS HZ2 H -4.285 -6.070 7.355 1.00 . A A . 11 LYS HZ2 1 1 20 12185 1 1 11 LYS HZ3 H -5.543 -5.227 8.107 1.00 . A A . 11 LYS HZ3 1 1 20 12186 1 1 11 LYS N N -5.485 -9.559 2.916 1.00 . A A . 11 LYS N 1 1 20 12187 1 1 11 LYS NZ N -5.251 -5.705 7.231 1.00 . A A . 11 LYS NZ 1 1 20 12188 1 1 11 LYS O O -4.331 -8.561 0.537 1.00 . A A . 11 LYS O 1 1 20 12189 1 1 12 PRO C C -4.817 -6.216 -1.500 1.00 . A A . 12 PRO C 1 1 20 12190 1 1 12 PRO CA C -5.964 -7.195 -1.275 1.00 . A A . 12 PRO CA 1 1 20 12191 1 1 12 PRO CB C -7.278 -6.608 -1.797 1.00 . A A . 12 PRO CB 1 1 20 12192 1 1 12 PRO CD C -7.515 -6.829 0.571 1.00 . A A . 12 PRO CD 1 1 20 12193 1 1 12 PRO CG C -7.913 -5.980 -0.605 1.00 . A A . 12 PRO CG 1 1 20 12194 1 1 12 PRO HA H -5.752 -8.121 -1.790 1.00 . A A . 12 PRO HA 1 1 20 12195 1 1 12 PRO HB2 H -7.069 -5.877 -2.565 1.00 . A A . 12 PRO HB2 1 1 20 12196 1 1 12 PRO HB3 H -7.893 -7.398 -2.202 1.00 . A A . 12 PRO HB3 1 1 20 12197 1 1 12 PRO HD2 H -7.386 -6.217 1.452 1.00 . A A . 12 PRO HD2 1 1 20 12198 1 1 12 PRO HD3 H -8.253 -7.598 0.749 1.00 . A A . 12 PRO HD3 1 1 20 12199 1 1 12 PRO HG2 H -7.546 -4.973 -0.481 1.00 . A A . 12 PRO HG2 1 1 20 12200 1 1 12 PRO HG3 H -8.987 -5.979 -0.719 1.00 . A A . 12 PRO HG3 1 1 20 12201 1 1 12 PRO N N -6.234 -7.419 0.148 1.00 . A A . 12 PRO N 1 1 20 12202 1 1 12 PRO O O -4.161 -6.241 -2.542 1.00 . A A . 12 PRO O 1 1 20 12203 1 1 13 TYR C C -2.291 -4.804 0.193 1.00 . A A . 13 TYR C 1 1 20 12204 1 1 13 TYR CA C -3.512 -4.365 -0.610 1.00 . A A . 13 TYR CA 1 1 20 12205 1 1 13 TYR CB C -4.003 -3.006 -0.109 1.00 . A A . 13 TYR CB 1 1 20 12206 1 1 13 TYR CD1 C -6.511 -2.864 -0.370 1.00 . A A . 13 TYR CD1 1 1 20 12207 1 1 13 TYR CD2 C -5.149 -1.693 -1.937 1.00 . A A . 13 TYR CD2 1 1 20 12208 1 1 13 TYR CE1 C -7.647 -2.415 -1.015 1.00 . A A . 13 TYR CE1 1 1 20 12209 1 1 13 TYR CE2 C -6.280 -1.239 -2.587 1.00 . A A . 13 TYR CE2 1 1 20 12210 1 1 13 TYR CG C -5.244 -2.512 -0.818 1.00 . A A . 13 TYR CG 1 1 20 12211 1 1 13 TYR CZ C -7.526 -1.603 -2.123 1.00 . A A . 13 TYR CZ 1 1 20 12212 1 1 13 TYR H H -5.136 -5.383 0.289 1.00 . A A . 13 TYR H 1 1 20 12213 1 1 13 TYR HA H -3.232 -4.275 -1.649 1.00 . A A . 13 TYR HA 1 1 20 12214 1 1 13 TYR HB2 H -4.230 -3.078 0.943 1.00 . A A . 13 TYR HB2 1 1 20 12215 1 1 13 TYR HB3 H -3.223 -2.273 -0.255 1.00 . A A . 13 TYR HB3 1 1 20 12216 1 1 13 TYR HD1 H -6.602 -3.501 0.498 1.00 . A A . 13 TYR HD1 1 1 20 12217 1 1 13 TYR HD2 H -4.171 -1.411 -2.299 1.00 . A A . 13 TYR HD2 1 1 20 12218 1 1 13 TYR HE1 H -8.624 -2.700 -0.651 1.00 . A A . 13 TYR HE1 1 1 20 12219 1 1 13 TYR HE2 H -6.185 -0.603 -3.455 1.00 . A A . 13 TYR HE2 1 1 20 12220 1 1 13 TYR HH H -8.882 -1.761 -3.477 1.00 . A A . 13 TYR HH 1 1 20 12221 1 1 13 TYR N N -4.579 -5.354 -0.518 1.00 . A A . 13 TYR N 1 1 20 12222 1 1 13 TYR O O -2.420 -5.375 1.276 1.00 . A A . 13 TYR O 1 1 20 12223 1 1 13 TYR OH O -8.655 -1.153 -2.769 1.00 . A A . 13 TYR OH 1 1 20 12224 1 1 14 GLU C C 1.287 -4.012 -0.148 1.00 . A A . 14 GLU C 1 1 20 12225 1 1 14 GLU CA C 0.137 -4.901 0.318 1.00 . A A . 14 GLU CA 1 1 20 12226 1 1 14 GLU CB C 0.472 -6.370 0.048 1.00 . A A . 14 GLU CB 1 1 20 12227 1 1 14 GLU CD C 2.186 -8.212 0.263 1.00 . A A . 14 GLU CD 1 1 20 12228 1 1 14 GLU CG C 1.744 -6.840 0.733 1.00 . A A . 14 GLU CG 1 1 20 12229 1 1 14 GLU H H -1.069 -4.077 -1.213 1.00 . A A . 14 GLU H 1 1 20 12230 1 1 14 GLU HA H -0.001 -4.763 1.380 1.00 . A A . 14 GLU HA 1 1 20 12231 1 1 14 GLU HB2 H -0.347 -6.983 0.395 1.00 . A A . 14 GLU HB2 1 1 20 12232 1 1 14 GLU HB3 H 0.588 -6.509 -1.016 1.00 . A A . 14 GLU HB3 1 1 20 12233 1 1 14 GLU HG2 H 2.533 -6.133 0.523 1.00 . A A . 14 GLU HG2 1 1 20 12234 1 1 14 GLU HG3 H 1.571 -6.879 1.798 1.00 . A A . 14 GLU HG3 1 1 20 12235 1 1 14 GLU N N -1.107 -4.534 -0.347 1.00 . A A . 14 GLU N 1 1 20 12236 1 1 14 GLU O O 1.304 -3.547 -1.288 1.00 . A A . 14 GLU O 1 1 20 12237 1 1 14 GLU OE1 O 2.877 -8.291 -0.774 1.00 . A A . 14 GLU OE1 1 1 20 12238 1 1 14 GLU OE2 O 1.841 -9.208 0.934 1.00 . A A . 14 GLU OE2 1 1 20 12239 1 1 15 CYS C C 4.399 -3.709 -0.440 1.00 . A A . 15 CYS C 1 1 20 12240 1 1 15 CYS CA C 3.399 -2.947 0.424 1.00 . A A . 15 CYS CA 1 1 20 12241 1 1 15 CYS CB C 4.079 -2.469 1.709 1.00 . A A . 15 CYS CB 1 1 20 12242 1 1 15 CYS H H 2.176 -4.179 1.635 1.00 . A A . 15 CYS H 1 1 20 12243 1 1 15 CYS HA H 3.047 -2.088 -0.127 1.00 . A A . 15 CYS HA 1 1 20 12244 1 1 15 CYS HB2 H 3.335 -2.033 2.360 1.00 . A A . 15 CYS HB2 1 1 20 12245 1 1 15 CYS HB3 H 4.531 -3.316 2.204 1.00 . A A . 15 CYS HB3 1 1 20 12246 1 1 15 CYS N N 2.246 -3.780 0.742 1.00 . A A . 15 CYS N 1 1 20 12247 1 1 15 CYS O O 4.801 -4.824 -0.107 1.00 . A A . 15 CYS O 1 1 20 12248 1 1 15 CYS SG S 5.379 -1.222 1.443 1.00 . A A . 15 CYS SG 1 1 20 12249 1 1 16 ASP C C 7.184 -3.455 -2.013 1.00 . A A . 16 ASP C 1 1 20 12250 1 1 16 ASP CA C 5.751 -3.719 -2.464 1.00 . A A . 16 ASP CA 1 1 20 12251 1 1 16 ASP CB C 5.546 -3.192 -3.885 1.00 . A A . 16 ASP CB 1 1 20 12252 1 1 16 ASP CG C 4.085 -2.948 -4.207 1.00 . A A . 16 ASP CG 1 1 20 12253 1 1 16 ASP H H 4.441 -2.211 -1.763 1.00 . A A . 16 ASP H 1 1 20 12254 1 1 16 ASP HA H 5.575 -4.784 -2.456 1.00 . A A . 16 ASP HA 1 1 20 12255 1 1 16 ASP HB2 H 6.080 -2.260 -3.998 1.00 . A A . 16 ASP HB2 1 1 20 12256 1 1 16 ASP HB3 H 5.936 -3.913 -4.589 1.00 . A A . 16 ASP HB3 1 1 20 12257 1 1 16 ASP N N 4.797 -3.099 -1.551 1.00 . A A . 16 ASP N 1 1 20 12258 1 1 16 ASP O O 8.109 -3.435 -2.826 1.00 . A A . 16 ASP O 1 1 20 12259 1 1 16 ASP OD1 O 3.318 -3.932 -4.262 1.00 . A A . 16 ASP OD1 1 1 20 12260 1 1 16 ASP OD2 O 3.708 -1.774 -4.404 1.00 . A A . 16 ASP OD2 1 1 20 12261 1 1 17 VAL C C 8.945 -3.864 1.070 1.00 . A A . 17 VAL C 1 1 20 12262 1 1 17 VAL CA C 8.682 -2.990 -0.151 1.00 . A A . 17 VAL CA 1 1 20 12263 1 1 17 VAL CB C 8.839 -1.511 0.247 1.00 . A A . 17 VAL CB 1 1 20 12264 1 1 17 VAL CG1 C 10.210 -1.265 0.859 1.00 . A A . 17 VAL CG1 1 1 20 12265 1 1 17 VAL CG2 C 8.615 -0.609 -0.958 1.00 . A A . 17 VAL CG2 1 1 20 12266 1 1 17 VAL H H 6.586 -3.281 -0.113 1.00 . A A . 17 VAL H 1 1 20 12267 1 1 17 VAL HA H 9.418 -3.218 -0.909 1.00 . A A . 17 VAL HA 1 1 20 12268 1 1 17 VAL HB H 8.091 -1.277 0.989 1.00 . A A . 17 VAL HB 1 1 20 12269 1 1 17 VAL HG11 H 10.190 -1.533 1.905 1.00 . A A . 17 VAL HG11 1 1 20 12270 1 1 17 VAL HG12 H 10.947 -1.865 0.345 1.00 . A A . 17 VAL HG12 1 1 20 12271 1 1 17 VAL HG13 H 10.465 -0.219 0.762 1.00 . A A . 17 VAL HG13 1 1 20 12272 1 1 17 VAL HG21 H 9.497 -0.613 -1.580 1.00 . A A . 17 VAL HG21 1 1 20 12273 1 1 17 VAL HG22 H 7.771 -0.972 -1.526 1.00 . A A . 17 VAL HG22 1 1 20 12274 1 1 17 VAL HG23 H 8.416 0.399 -0.622 1.00 . A A . 17 VAL HG23 1 1 20 12275 1 1 17 VAL N N 7.362 -3.253 -0.711 1.00 . A A . 17 VAL N 1 1 20 12276 1 1 17 VAL O O 9.995 -4.497 1.181 1.00 . A A . 17 VAL O 1 1 20 12277 1 1 18 CYS C C 7.104 -5.839 3.206 1.00 . A A . 18 CYS C 1 1 20 12278 1 1 18 CYS CA C 8.109 -4.691 3.201 1.00 . A A . 18 CYS CA 1 1 20 12279 1 1 18 CYS CB C 7.900 -3.812 4.436 1.00 . A A . 18 CYS CB 1 1 20 12280 1 1 18 CYS H H 7.168 -3.369 1.843 1.00 . A A . 18 CYS H 1 1 20 12281 1 1 18 CYS HA H 9.106 -5.102 3.227 1.00 . A A . 18 CYS HA 1 1 20 12282 1 1 18 CYS HB2 H 7.980 -4.425 5.322 1.00 . A A . 18 CYS HB2 1 1 20 12283 1 1 18 CYS HB3 H 8.666 -3.052 4.461 1.00 . A A . 18 CYS HB3 1 1 20 12284 1 1 18 CYS N N 7.983 -3.895 1.987 1.00 . A A . 18 CYS N 1 1 20 12285 1 1 18 CYS O O 7.150 -6.715 4.069 1.00 . A A . 18 CYS O 1 1 20 12286 1 1 18 CYS SG S 6.284 -2.974 4.488 1.00 . A A . 18 CYS SG 1 1 20 12287 1 1 19 ARG C C 4.254 -6.850 3.339 1.00 . A A . 19 ARG C 1 1 20 12288 1 1 19 ARG CA C 5.180 -6.867 2.126 1.00 . A A . 19 ARG CA 1 1 20 12289 1 1 19 ARG CB C 5.838 -8.242 1.993 1.00 . A A . 19 ARG CB 1 1 20 12290 1 1 19 ARG CD C 6.175 -8.230 -0.497 1.00 . A A . 19 ARG CD 1 1 20 12291 1 1 19 ARG CG C 6.850 -8.326 0.862 1.00 . A A . 19 ARG CG 1 1 20 12292 1 1 19 ARG CZ C 6.706 -8.973 -2.780 1.00 . A A . 19 ARG CZ 1 1 20 12293 1 1 19 ARG H H 6.211 -5.103 1.575 1.00 . A A . 19 ARG H 1 1 20 12294 1 1 19 ARG HA H 4.596 -6.670 1.239 1.00 . A A . 19 ARG HA 1 1 20 12295 1 1 19 ARG HB2 H 6.344 -8.477 2.918 1.00 . A A . 19 ARG HB2 1 1 20 12296 1 1 19 ARG HB3 H 5.070 -8.980 1.815 1.00 . A A . 19 ARG HB3 1 1 20 12297 1 1 19 ARG HD2 H 5.353 -8.930 -0.527 1.00 . A A . 19 ARG HD2 1 1 20 12298 1 1 19 ARG HD3 H 5.797 -7.227 -0.626 1.00 . A A . 19 ARG HD3 1 1 20 12299 1 1 19 ARG HE H 8.053 -8.405 -1.424 1.00 . A A . 19 ARG HE 1 1 20 12300 1 1 19 ARG HG2 H 7.554 -7.513 0.960 1.00 . A A . 19 ARG HG2 1 1 20 12301 1 1 19 ARG HG3 H 7.373 -9.268 0.929 1.00 . A A . 19 ARG HG3 1 1 20 12302 1 1 19 ARG HH11 H 4.737 -8.964 -2.325 1.00 . A A . 19 ARG HH11 1 1 20 12303 1 1 19 ARG HH12 H 5.125 -9.486 -3.931 1.00 . A A . 19 ARG HH12 1 1 20 12304 1 1 19 ARG HH21 H 8.577 -9.090 -3.536 1.00 . A A . 19 ARG HH21 1 1 20 12305 1 1 19 ARG HH22 H 7.309 -9.557 -4.619 1.00 . A A . 19 ARG HH22 1 1 20 12306 1 1 19 ARG N N 6.197 -5.828 2.234 1.00 . A A . 19 ARG N 1 1 20 12307 1 1 19 ARG NE N 7.096 -8.534 -1.589 1.00 . A A . 19 ARG NE 1 1 20 12308 1 1 19 ARG NH1 N 5.417 -9.157 -3.033 1.00 . A A . 19 ARG NH1 1 1 20 12309 1 1 19 ARG NH2 N 7.604 -9.227 -3.722 1.00 . A A . 19 ARG NH2 1 1 20 12310 1 1 19 ARG O O 3.984 -7.889 3.943 1.00 . A A . 19 ARG O 1 1 20 12311 1 1 20 LYS C C 1.419 -5.441 4.372 1.00 . A A . 20 LYS C 1 1 20 12312 1 1 20 LYS CA C 2.873 -5.510 4.829 1.00 . A A . 20 LYS CA 1 1 20 12313 1 1 20 LYS CB C 3.230 -4.248 5.619 1.00 . A A . 20 LYS CB 1 1 20 12314 1 1 20 LYS CD C 3.020 -2.947 7.757 1.00 . A A . 20 LYS CD 1 1 20 12315 1 1 20 LYS CE C 2.796 -3.093 9.254 1.00 . A A . 20 LYS CE 1 1 20 12316 1 1 20 LYS CG C 2.618 -4.206 7.008 1.00 . A A . 20 LYS CG 1 1 20 12317 1 1 20 LYS H H 4.021 -4.872 3.169 1.00 . A A . 20 LYS H 1 1 20 12318 1 1 20 LYS HA H 2.997 -6.371 5.468 1.00 . A A . 20 LYS HA 1 1 20 12319 1 1 20 LYS HB2 H 4.304 -4.193 5.719 1.00 . A A . 20 LYS HB2 1 1 20 12320 1 1 20 LYS HB3 H 2.884 -3.384 5.069 1.00 . A A . 20 LYS HB3 1 1 20 12321 1 1 20 LYS HD2 H 4.067 -2.750 7.578 1.00 . A A . 20 LYS HD2 1 1 20 12322 1 1 20 LYS HD3 H 2.429 -2.118 7.392 1.00 . A A . 20 LYS HD3 1 1 20 12323 1 1 20 LYS HE2 H 1.747 -2.950 9.464 1.00 . A A . 20 LYS HE2 1 1 20 12324 1 1 20 LYS HE3 H 3.091 -4.088 9.553 1.00 . A A . 20 LYS HE3 1 1 20 12325 1 1 20 LYS HG2 H 1.542 -4.231 6.919 1.00 . A A . 20 LYS HG2 1 1 20 12326 1 1 20 LYS HG3 H 2.955 -5.069 7.566 1.00 . A A . 20 LYS HG3 1 1 20 12327 1 1 20 LYS HZ1 H 4.418 -2.555 10.456 1.00 . A A . 20 LYS HZ1 1 1 20 12328 1 1 20 LYS HZ2 H 3.001 -1.695 10.792 1.00 . A A . 20 LYS HZ2 1 1 20 12329 1 1 20 LYS HZ3 H 3.904 -1.329 9.410 1.00 . A A . 20 LYS HZ3 1 1 20 12330 1 1 20 LYS N N 3.769 -5.664 3.690 1.00 . A A . 20 LYS N 1 1 20 12331 1 1 20 LYS NZ N 3.585 -2.098 10.033 1.00 . A A . 20 LYS NZ 1 1 20 12332 1 1 20 LYS O O 1.124 -4.954 3.281 1.00 . A A . 20 LYS O 1 1 20 12333 1 1 21 ALA C C -1.603 -4.720 5.529 1.00 . A A . 21 ALA C 1 1 20 12334 1 1 21 ALA CA C -0.908 -5.922 4.898 1.00 . A A . 21 ALA CA 1 1 20 12335 1 1 21 ALA CB C -1.560 -7.216 5.363 1.00 . A A . 21 ALA CB 1 1 20 12336 1 1 21 ALA H H 0.812 -6.306 6.070 1.00 . A A . 21 ALA H 1 1 20 12337 1 1 21 ALA HA H -1.010 -5.862 3.824 1.00 . A A . 21 ALA HA 1 1 20 12338 1 1 21 ALA HB1 H -2.475 -6.988 5.889 1.00 . A A . 21 ALA HB1 1 1 20 12339 1 1 21 ALA HB2 H -1.781 -7.835 4.506 1.00 . A A . 21 ALA HB2 1 1 20 12340 1 1 21 ALA HB3 H -0.886 -7.741 6.023 1.00 . A A . 21 ALA HB3 1 1 20 12341 1 1 21 ALA N N 0.515 -5.931 5.215 1.00 . A A . 21 ALA N 1 1 20 12342 1 1 21 ALA O O -1.260 -4.303 6.636 1.00 . A A . 21 ALA O 1 1 20 12343 1 1 22 PHE C C -4.823 -3.202 5.101 1.00 . A A . 22 PHE C 1 1 20 12344 1 1 22 PHE CA C -3.323 -3.013 5.309 1.00 . A A . 22 PHE CA 1 1 20 12345 1 1 22 PHE CB C -2.855 -1.740 4.599 1.00 . A A . 22 PHE CB 1 1 20 12346 1 1 22 PHE CD1 C -0.445 -1.950 3.930 1.00 . A A . 22 PHE CD1 1 1 20 12347 1 1 22 PHE CD2 C -0.976 -0.658 5.863 1.00 . A A . 22 PHE CD2 1 1 20 12348 1 1 22 PHE CE1 C 0.897 -1.678 4.113 1.00 . A A . 22 PHE CE1 1 1 20 12349 1 1 22 PHE CE2 C 0.365 -0.383 6.050 1.00 . A A . 22 PHE CE2 1 1 20 12350 1 1 22 PHE CG C -1.396 -1.443 4.801 1.00 . A A . 22 PHE CG 1 1 20 12351 1 1 22 PHE CZ C 1.303 -0.895 5.175 1.00 . A A . 22 PHE CZ 1 1 20 12352 1 1 22 PHE H H -2.808 -4.546 3.943 1.00 . A A . 22 PHE H 1 1 20 12353 1 1 22 PHE HA H -3.127 -2.918 6.366 1.00 . A A . 22 PHE HA 1 1 20 12354 1 1 22 PHE HB2 H -3.028 -1.844 3.539 1.00 . A A . 22 PHE HB2 1 1 20 12355 1 1 22 PHE HB3 H -3.421 -0.900 4.972 1.00 . A A . 22 PHE HB3 1 1 20 12356 1 1 22 PHE HD1 H -0.762 -2.563 3.098 1.00 . A A . 22 PHE HD1 1 1 20 12357 1 1 22 PHE HD2 H -1.708 -0.259 6.549 1.00 . A A . 22 PHE HD2 1 1 20 12358 1 1 22 PHE HE1 H 1.628 -2.080 3.426 1.00 . A A . 22 PHE HE1 1 1 20 12359 1 1 22 PHE HE2 H 0.680 0.230 6.882 1.00 . A A . 22 PHE HE2 1 1 20 12360 1 1 22 PHE HZ H 2.352 -0.681 5.319 1.00 . A A . 22 PHE HZ 1 1 20 12361 1 1 22 PHE N N -2.580 -4.168 4.819 1.00 . A A . 22 PHE N 1 1 20 12362 1 1 22 PHE O O -5.265 -3.608 4.027 1.00 . A A . 22 PHE O 1 1 20 12363 1 1 23 SER C C -7.614 -2.296 4.869 1.00 . A A . 23 SER C 1 1 20 12364 1 1 23 SER CA C -7.049 -3.046 6.072 1.00 . A A . 23 SER CA 1 1 20 12365 1 1 23 SER CB C -7.693 -2.527 7.359 1.00 . A A . 23 SER CB 1 1 20 12366 1 1 23 SER H H -5.187 -2.586 6.968 1.00 . A A . 23 SER H 1 1 20 12367 1 1 23 SER HA H -7.276 -4.097 5.965 1.00 . A A . 23 SER HA 1 1 20 12368 1 1 23 SER HB2 H -7.258 -1.573 7.617 1.00 . A A . 23 SER HB2 1 1 20 12369 1 1 23 SER HB3 H -8.756 -2.408 7.204 1.00 . A A . 23 SER HB3 1 1 20 12370 1 1 23 SER HG H -7.831 -4.293 8.196 1.00 . A A . 23 SER HG 1 1 20 12371 1 1 23 SER N N -5.600 -2.905 6.138 1.00 . A A . 23 SER N 1 1 20 12372 1 1 23 SER O O -8.524 -2.778 4.194 1.00 . A A . 23 SER O 1 1 20 12373 1 1 23 SER OG O -7.486 -3.428 8.433 1.00 . A A . 23 SER OG 1 1 20 12374 1 1 24 HIS C C -6.325 0.281 2.725 1.00 . A A . 24 HIS C 1 1 20 12375 1 1 24 HIS CA C -7.515 -0.295 3.486 1.00 . A A . 24 HIS CA 1 1 20 12376 1 1 24 HIS CB C -8.416 0.836 3.980 1.00 . A A . 24 HIS CB 1 1 20 12377 1 1 24 HIS CD2 C -8.171 0.704 6.559 1.00 . A A . 24 HIS CD2 1 1 20 12378 1 1 24 HIS CE1 C -7.360 2.711 6.908 1.00 . A A . 24 HIS CE1 1 1 20 12379 1 1 24 HIS CG C -8.073 1.317 5.357 1.00 . A A . 24 HIS CG 1 1 20 12380 1 1 24 HIS H H -6.345 -0.783 5.182 1.00 . A A . 24 HIS H 1 1 20 12381 1 1 24 HIS HA H -8.080 -0.929 2.819 1.00 . A A . 24 HIS HA 1 1 20 12382 1 1 24 HIS HB2 H -8.332 1.675 3.306 1.00 . A A . 24 HIS HB2 1 1 20 12383 1 1 24 HIS HB3 H -9.440 0.493 3.994 1.00 . A A . 24 HIS HB3 1 1 20 12384 1 1 24 HIS HD1 H -7.374 3.260 4.937 1.00 . A A . 24 HIS HD1 1 1 20 12385 1 1 24 HIS HD2 H -8.535 -0.298 6.741 1.00 . A A . 24 HIS HD2 1 1 20 12386 1 1 24 HIS HE1 H -6.966 3.589 7.397 1.00 . A A . 24 HIS HE1 1 1 20 12387 1 1 24 HIS N N -7.067 -1.113 4.608 1.00 . A A . 24 HIS N 1 1 20 12388 1 1 24 HIS ND1 N -7.562 2.573 5.609 1.00 . A A . 24 HIS ND1 1 1 20 12389 1 1 24 HIS NE2 N -7.722 1.591 7.507 1.00 . A A . 24 HIS NE2 1 1 20 12390 1 1 24 HIS O O -5.174 0.105 3.126 1.00 . A A . 24 HIS O 1 1 20 12391 1 1 25 HIS C C -4.923 2.755 1.528 1.00 . A A . 25 HIS C 1 1 20 12392 1 1 25 HIS CA C -5.563 1.572 0.807 1.00 . A A . 25 HIS CA 1 1 20 12393 1 1 25 HIS CB C -6.134 2.028 -0.536 1.00 . A A . 25 HIS CB 1 1 20 12394 1 1 25 HIS CD2 C -8.661 2.461 -0.142 1.00 . A A . 25 HIS CD2 1 1 20 12395 1 1 25 HIS CE1 C -8.657 4.638 -0.400 1.00 . A A . 25 HIS CE1 1 1 20 12396 1 1 25 HIS CG C -7.389 2.837 -0.410 1.00 . A A . 25 HIS CG 1 1 20 12397 1 1 25 HIS H H -7.546 1.076 1.356 1.00 . A A . 25 HIS H 1 1 20 12398 1 1 25 HIS HA H -4.807 0.822 0.631 1.00 . A A . 25 HIS HA 1 1 20 12399 1 1 25 HIS HB2 H -5.399 2.634 -1.045 1.00 . A A . 25 HIS HB2 1 1 20 12400 1 1 25 HIS HB3 H -6.357 1.160 -1.139 1.00 . A A . 25 HIS HB3 1 1 20 12401 1 1 25 HIS HD1 H -6.650 4.777 -0.770 1.00 . A A . 25 HIS HD1 1 1 20 12402 1 1 25 HIS HD2 H -9.008 1.453 0.038 1.00 . A A . 25 HIS HD2 1 1 20 12403 1 1 25 HIS HE1 H -8.983 5.666 -0.464 1.00 . A A . 25 HIS HE1 1 1 20 12404 1 1 25 HIS N N -6.610 0.970 1.624 1.00 . A A . 25 HIS N 1 1 20 12405 1 1 25 HIS ND1 N -7.420 4.206 -0.568 1.00 . A A . 25 HIS ND1 1 1 20 12406 1 1 25 HIS NE2 N -9.430 3.599 -0.141 1.00 . A A . 25 HIS NE2 1 1 20 12407 1 1 25 HIS O O -3.706 2.803 1.703 1.00 . A A . 25 HIS O 1 1 20 12408 1 1 26 ALA C C -4.210 4.515 3.682 1.00 . A A . 26 ALA C 1 1 20 12409 1 1 26 ALA CA C -5.267 4.887 2.648 1.00 . A A . 26 ALA CA 1 1 20 12410 1 1 26 ALA CB C -6.424 5.618 3.313 1.00 . A A . 26 ALA CB 1 1 20 12411 1 1 26 ALA H H -6.712 3.611 1.776 1.00 . A A . 26 ALA H 1 1 20 12412 1 1 26 ALA HA H -4.825 5.552 1.920 1.00 . A A . 26 ALA HA 1 1 20 12413 1 1 26 ALA HB1 H -6.582 6.566 2.821 1.00 . A A . 26 ALA HB1 1 1 20 12414 1 1 26 ALA HB2 H -7.319 5.018 3.236 1.00 . A A . 26 ALA HB2 1 1 20 12415 1 1 26 ALA HB3 H -6.192 5.787 4.354 1.00 . A A . 26 ALA HB3 1 1 20 12416 1 1 26 ALA N N -5.752 3.706 1.945 1.00 . A A . 26 ALA N 1 1 20 12417 1 1 26 ALA O O -3.249 5.254 3.896 1.00 . A A . 26 ALA O 1 1 20 12418 1 1 27 SER C C -2.111 2.543 4.714 1.00 . A A . 27 SER C 1 1 20 12419 1 1 27 SER CA C -3.458 2.897 5.338 1.00 . A A . 27 SER CA 1 1 20 12420 1 1 27 SER CB C -4.030 1.680 6.067 1.00 . A A . 27 SER CB 1 1 20 12421 1 1 27 SER H H -5.180 2.819 4.108 1.00 . A A . 27 SER H 1 1 20 12422 1 1 27 SER HA H -3.313 3.696 6.049 1.00 . A A . 27 SER HA 1 1 20 12423 1 1 27 SER HB2 H -4.671 1.129 5.395 1.00 . A A . 27 SER HB2 1 1 20 12424 1 1 27 SER HB3 H -3.219 1.044 6.392 1.00 . A A . 27 SER HB3 1 1 20 12425 1 1 27 SER HG H -5.033 2.996 7.115 1.00 . A A . 27 SER HG 1 1 20 12426 1 1 27 SER N N -4.394 3.365 4.322 1.00 . A A . 27 SER N 1 1 20 12427 1 1 27 SER O O -1.059 2.757 5.316 1.00 . A A . 27 SER O 1 1 20 12428 1 1 27 SER OG O -4.786 2.072 7.200 1.00 . A A . 27 SER OG 1 1 20 12429 1 1 28 LEU C C -0.305 2.819 2.103 1.00 . A A . 28 LEU C 1 1 20 12430 1 1 28 LEU CA C -0.937 1.615 2.794 1.00 . A A . 28 LEU CA 1 1 20 12431 1 1 28 LEU CB C -1.245 0.525 1.766 1.00 . A A . 28 LEU CB 1 1 20 12432 1 1 28 LEU CD1 C 1.033 -0.456 1.404 1.00 . A A . 28 LEU CD1 1 1 20 12433 1 1 28 LEU CD2 C -0.689 -0.604 -0.403 1.00 . A A . 28 LEU CD2 1 1 20 12434 1 1 28 LEU CG C -0.146 0.239 0.742 1.00 . A A . 28 LEU CG 1 1 20 12435 1 1 28 LEU H H -3.021 1.852 3.073 1.00 . A A . 28 LEU H 1 1 20 12436 1 1 28 LEU HA H -0.239 1.225 3.521 1.00 . A A . 28 LEU HA 1 1 20 12437 1 1 28 LEU HB2 H -1.443 -0.390 2.302 1.00 . A A . 28 LEU HB2 1 1 20 12438 1 1 28 LEU HB3 H -2.132 0.823 1.225 1.00 . A A . 28 LEU HB3 1 1 20 12439 1 1 28 LEU HD11 H 1.375 0.134 2.241 1.00 . A A . 28 LEU HD11 1 1 20 12440 1 1 28 LEU HD12 H 1.835 -0.565 0.689 1.00 . A A . 28 LEU HD12 1 1 20 12441 1 1 28 LEU HD13 H 0.727 -1.432 1.752 1.00 . A A . 28 LEU HD13 1 1 20 12442 1 1 28 LEU HD21 H -0.652 -1.648 -0.130 1.00 . A A . 28 LEU HD21 1 1 20 12443 1 1 28 LEU HD22 H -0.090 -0.440 -1.286 1.00 . A A . 28 LEU HD22 1 1 20 12444 1 1 28 LEU HD23 H -1.712 -0.320 -0.604 1.00 . A A . 28 LEU HD23 1 1 20 12445 1 1 28 LEU HG H 0.207 1.175 0.331 1.00 . A A . 28 LEU HG 1 1 20 12446 1 1 28 LEU N N -2.153 1.999 3.502 1.00 . A A . 28 LEU N 1 1 20 12447 1 1 28 LEU O O 0.879 3.103 2.284 1.00 . A A . 28 LEU O 1 1 20 12448 1 1 29 THR C C 0.177 5.616 1.511 1.00 . A A . 29 THR C 1 1 20 12449 1 1 29 THR CA C -0.625 4.700 0.593 1.00 . A A . 29 THR CA 1 1 20 12450 1 1 29 THR CB C -1.790 5.499 -0.020 1.00 . A A . 29 THR CB 1 1 20 12451 1 1 29 THR CG2 C -2.386 6.458 1.000 1.00 . A A . 29 THR CG2 1 1 20 12452 1 1 29 THR H H -2.039 3.250 1.206 1.00 . A A . 29 THR H 1 1 20 12453 1 1 29 THR HA H 0.014 4.363 -0.210 1.00 . A A . 29 THR HA 1 1 20 12454 1 1 29 THR HB H -2.558 4.805 -0.331 1.00 . A A . 29 THR HB 1 1 20 12455 1 1 29 THR HG1 H -1.083 7.120 -0.893 1.00 . A A . 29 THR HG1 1 1 20 12456 1 1 29 THR HG21 H -2.744 5.899 1.851 1.00 . A A . 29 THR HG21 1 1 20 12457 1 1 29 THR HG22 H -3.207 6.996 0.552 1.00 . A A . 29 THR HG22 1 1 20 12458 1 1 29 THR HG23 H -1.628 7.157 1.321 1.00 . A A . 29 THR HG23 1 1 20 12459 1 1 29 THR N N -1.104 3.526 1.310 1.00 . A A . 29 THR N 1 1 20 12460 1 1 29 THR O O 1.167 6.215 1.093 1.00 . A A . 29 THR O 1 1 20 12461 1 1 29 THR OG1 O -1.334 6.233 -1.162 1.00 . A A . 29 THR OG1 1 1 20 12462 1 1 30 GLN C C 1.692 5.893 4.247 1.00 . A A . 30 GLN C 1 1 20 12463 1 1 30 GLN CA C 0.420 6.564 3.739 1.00 . A A . 30 GLN CA 1 1 20 12464 1 1 30 GLN CB C -0.512 6.873 4.912 1.00 . A A . 30 GLN CB 1 1 20 12465 1 1 30 GLN CD C -0.610 8.032 7.155 1.00 . A A . 30 GLN CD 1 1 20 12466 1 1 30 GLN CG C -0.074 8.072 5.737 1.00 . A A . 30 GLN CG 1 1 20 12467 1 1 30 GLN H H -1.054 5.218 3.035 1.00 . A A . 30 GLN H 1 1 20 12468 1 1 30 GLN HA H 0.686 7.488 3.250 1.00 . A A . 30 GLN HA 1 1 20 12469 1 1 30 GLN HB2 H -1.502 7.069 4.528 1.00 . A A . 30 GLN HB2 1 1 20 12470 1 1 30 GLN HB3 H -0.551 6.011 5.562 1.00 . A A . 30 GLN HB3 1 1 20 12471 1 1 30 GLN HE21 H 1.227 8.248 7.882 1.00 . A A . 30 GLN HE21 1 1 20 12472 1 1 30 GLN HE22 H -0.035 8.124 9.055 1.00 . A A . 30 GLN HE22 1 1 20 12473 1 1 30 GLN HG2 H 1.005 8.090 5.778 1.00 . A A . 30 GLN HG2 1 1 20 12474 1 1 30 GLN HG3 H -0.430 8.972 5.258 1.00 . A A . 30 GLN HG3 1 1 20 12475 1 1 30 GLN N N -0.258 5.720 2.762 1.00 . A A . 30 GLN N 1 1 20 12476 1 1 30 GLN NE2 N 0.284 8.145 8.130 1.00 . A A . 30 GLN NE2 1 1 20 12477 1 1 30 GLN O O 2.771 6.486 4.222 1.00 . A A . 30 GLN O 1 1 20 12478 1 1 30 GLN OE1 O -1.815 7.901 7.371 1.00 . A A . 30 GLN OE1 1 1 20 12479 1 1 31 HIS C C 3.843 3.896 4.218 1.00 . A A . 31 HIS C 1 1 20 12480 1 1 31 HIS CA C 2.697 3.903 5.224 1.00 . A A . 31 HIS CA 1 1 20 12481 1 1 31 HIS CB C 2.282 2.468 5.552 1.00 . A A . 31 HIS CB 1 1 20 12482 1 1 31 HIS CD2 C 3.999 0.908 4.391 1.00 . A A . 31 HIS CD2 1 1 20 12483 1 1 31 HIS CE1 C 4.999 0.141 6.185 1.00 . A A . 31 HIS CE1 1 1 20 12484 1 1 31 HIS CG C 3.408 1.484 5.464 1.00 . A A . 31 HIS CG 1 1 20 12485 1 1 31 HIS H H 0.672 4.236 4.704 1.00 . A A . 31 HIS H 1 1 20 12486 1 1 31 HIS HA H 3.032 4.387 6.129 1.00 . A A . 31 HIS HA 1 1 20 12487 1 1 31 HIS HB2 H 1.891 2.434 6.558 1.00 . A A . 31 HIS HB2 1 1 20 12488 1 1 31 HIS HB3 H 1.513 2.155 4.861 1.00 . A A . 31 HIS HB3 1 1 20 12489 1 1 31 HIS HD1 H 3.857 1.209 7.504 1.00 . A A . 31 HIS HD1 1 1 20 12490 1 1 31 HIS HD2 H 3.744 1.071 3.354 1.00 . A A . 31 HIS HD2 1 1 20 12491 1 1 31 HIS HE1 H 5.667 -0.403 6.836 1.00 . A A . 31 HIS HE1 1 1 20 12492 1 1 31 HIS N N 1.558 4.654 4.710 1.00 . A A . 31 HIS N 1 1 20 12493 1 1 31 HIS ND1 N 4.057 0.982 6.573 1.00 . A A . 31 HIS ND1 1 1 20 12494 1 1 31 HIS NE2 N 4.985 0.078 4.866 1.00 . A A . 31 HIS NE2 1 1 20 12495 1 1 31 HIS O O 4.986 4.194 4.563 1.00 . A A . 31 HIS O 1 1 20 12496 1 1 32 GLN C C 5.581 4.598 2.114 1.00 . A A . 32 GLN C 1 1 20 12497 1 1 32 GLN CA C 4.533 3.507 1.917 1.00 . A A . 32 GLN CA 1 1 20 12498 1 1 32 GLN CB C 3.871 3.661 0.546 1.00 . A A . 32 GLN CB 1 1 20 12499 1 1 32 GLN CD C 4.173 1.359 -0.450 1.00 . A A . 32 GLN CD 1 1 20 12500 1 1 32 GLN CG C 3.188 2.396 0.055 1.00 . A A . 32 GLN CG 1 1 20 12501 1 1 32 GLN H H 2.600 3.327 2.759 1.00 . A A . 32 GLN H 1 1 20 12502 1 1 32 GLN HA H 5.020 2.545 1.965 1.00 . A A . 32 GLN HA 1 1 20 12503 1 1 32 GLN HB2 H 3.131 4.446 0.604 1.00 . A A . 32 GLN HB2 1 1 20 12504 1 1 32 GLN HB3 H 4.625 3.941 -0.175 1.00 . A A . 32 GLN HB3 1 1 20 12505 1 1 32 GLN HE21 H 2.680 0.232 -1.122 1.00 . A A . 32 GLN HE21 1 1 20 12506 1 1 32 GLN HE22 H 4.268 -0.395 -1.380 1.00 . A A . 32 GLN HE22 1 1 20 12507 1 1 32 GLN HG2 H 2.624 1.966 0.870 1.00 . A A . 32 GLN HG2 1 1 20 12508 1 1 32 GLN HG3 H 2.516 2.654 -0.750 1.00 . A A . 32 GLN HG3 1 1 20 12509 1 1 32 GLN N N 3.529 3.554 2.972 1.00 . A A . 32 GLN N 1 1 20 12510 1 1 32 GLN NE2 N 3.655 0.290 -1.043 1.00 . A A . 32 GLN NE2 1 1 20 12511 1 1 32 GLN O O 6.782 4.344 2.013 1.00 . A A . 32 GLN O 1 1 20 12512 1 1 32 GLN OE1 O 5.386 1.518 -0.308 1.00 . A A . 32 GLN OE1 1 1 20 12513 1 1 33 ARG C C 7.233 6.523 3.426 1.00 . A A . 33 ARG C 1 1 20 12514 1 1 33 ARG CA C 6.017 6.941 2.605 1.00 . A A . 33 ARG CA 1 1 20 12515 1 1 33 ARG CB C 5.280 8.081 3.310 1.00 . A A . 33 ARG CB 1 1 20 12516 1 1 33 ARG CD C 3.402 8.113 1.640 1.00 . A A . 33 ARG CD 1 1 20 12517 1 1 33 ARG CG C 4.447 8.940 2.372 1.00 . A A . 33 ARG CG 1 1 20 12518 1 1 33 ARG CZ C 3.016 9.186 -0.538 1.00 . A A . 33 ARG CZ 1 1 20 12519 1 1 33 ARG H H 4.151 5.951 2.463 1.00 . A A . 33 ARG H 1 1 20 12520 1 1 33 ARG HA H 6.351 7.284 1.637 1.00 . A A . 33 ARG HA 1 1 20 12521 1 1 33 ARG HB2 H 4.622 7.662 4.057 1.00 . A A . 33 ARG HB2 1 1 20 12522 1 1 33 ARG HB3 H 6.005 8.717 3.795 1.00 . A A . 33 ARG HB3 1 1 20 12523 1 1 33 ARG HD2 H 3.901 7.326 1.095 1.00 . A A . 33 ARG HD2 1 1 20 12524 1 1 33 ARG HD3 H 2.733 7.678 2.368 1.00 . A A . 33 ARG HD3 1 1 20 12525 1 1 33 ARG HE H 1.768 9.278 1.014 1.00 . A A . 33 ARG HE 1 1 20 12526 1 1 33 ARG HG2 H 3.946 9.704 2.947 1.00 . A A . 33 ARG HG2 1 1 20 12527 1 1 33 ARG HG3 H 5.100 9.402 1.647 1.00 . A A . 33 ARG HG3 1 1 20 12528 1 1 33 ARG HH11 H 4.747 8.154 -0.393 1.00 . A A . 33 ARG HH11 1 1 20 12529 1 1 33 ARG HH12 H 4.463 8.915 -1.923 1.00 . A A . 33 ARG HH12 1 1 20 12530 1 1 33 ARG HH21 H 1.383 10.284 -0.996 1.00 . A A . 33 ARG HH21 1 1 20 12531 1 1 33 ARG HH22 H 2.550 10.127 -2.265 1.00 . A A . 33 ARG HH22 1 1 20 12532 1 1 33 ARG N N 5.119 5.812 2.395 1.00 . A A . 33 ARG N 1 1 20 12533 1 1 33 ARG NE N 2.624 8.919 0.703 1.00 . A A . 33 ARG NE 1 1 20 12534 1 1 33 ARG NH1 N 4.171 8.713 -0.988 1.00 . A A . 33 ARG NH1 1 1 20 12535 1 1 33 ARG NH2 N 2.253 9.927 -1.332 1.00 . A A . 33 ARG NH2 1 1 20 12536 1 1 33 ARG O O 8.372 6.818 3.062 1.00 . A A . 33 ARG O 1 1 20 12537 1 1 34 VAL C C 9.303 5.016 4.605 1.00 . A A . 34 VAL C 1 1 20 12538 1 1 34 VAL CA C 8.059 5.377 5.408 1.00 . A A . 34 VAL CA 1 1 20 12539 1 1 34 VAL CB C 7.625 4.155 6.238 1.00 . A A . 34 VAL CB 1 1 20 12540 1 1 34 VAL CG1 C 6.437 4.504 7.122 1.00 . A A . 34 VAL CG1 1 1 20 12541 1 1 34 VAL CG2 C 7.295 2.982 5.327 1.00 . A A . 34 VAL CG2 1 1 20 12542 1 1 34 VAL H H 6.056 5.632 4.773 1.00 . A A . 34 VAL H 1 1 20 12543 1 1 34 VAL HA H 8.302 6.180 6.089 1.00 . A A . 34 VAL HA 1 1 20 12544 1 1 34 VAL HB H 8.448 3.867 6.876 1.00 . A A . 34 VAL HB 1 1 20 12545 1 1 34 VAL HG11 H 6.791 4.951 8.039 1.00 . A A . 34 VAL HG11 1 1 20 12546 1 1 34 VAL HG12 H 5.795 5.201 6.604 1.00 . A A . 34 VAL HG12 1 1 20 12547 1 1 34 VAL HG13 H 5.883 3.605 7.351 1.00 . A A . 34 VAL HG13 1 1 20 12548 1 1 34 VAL HG21 H 6.481 2.413 5.751 1.00 . A A . 34 VAL HG21 1 1 20 12549 1 1 34 VAL HG22 H 7.007 3.353 4.354 1.00 . A A . 34 VAL HG22 1 1 20 12550 1 1 34 VAL HG23 H 8.164 2.348 5.227 1.00 . A A . 34 VAL HG23 1 1 20 12551 1 1 34 VAL N N 6.984 5.836 4.536 1.00 . A A . 34 VAL N 1 1 20 12552 1 1 34 VAL O O 10.429 5.273 5.033 1.00 . A A . 34 VAL O 1 1 20 12553 1 1 35 HIS C C 10.555 5.143 1.598 1.00 . A A . 35 HIS C 1 1 20 12554 1 1 35 HIS CA C 10.198 4.023 2.570 1.00 . A A . 35 HIS CA 1 1 20 12555 1 1 35 HIS CB C 9.838 2.755 1.795 1.00 . A A . 35 HIS CB 1 1 20 12556 1 1 35 HIS CD2 C 7.869 1.215 2.488 1.00 . A A . 35 HIS CD2 1 1 20 12557 1 1 35 HIS CE1 C 8.792 0.286 4.246 1.00 . A A . 35 HIS CE1 1 1 20 12558 1 1 35 HIS CG C 9.111 1.736 2.618 1.00 . A A . 35 HIS CG 1 1 20 12559 1 1 35 HIS H H 8.173 4.241 3.148 1.00 . A A . 35 HIS H 1 1 20 12560 1 1 35 HIS HA H 11.054 3.821 3.196 1.00 . A A . 35 HIS HA 1 1 20 12561 1 1 35 HIS HB2 H 9.205 3.019 0.961 1.00 . A A . 35 HIS HB2 1 1 20 12562 1 1 35 HIS HB3 H 10.744 2.298 1.424 1.00 . A A . 35 HIS HB3 1 1 20 12563 1 1 35 HIS HD1 H 10.560 1.303 4.086 1.00 . A A . 35 HIS HD1 1 1 20 12564 1 1 35 HIS HD2 H 7.148 1.460 1.720 1.00 . A A . 35 HIS HD2 1 1 20 12565 1 1 35 HIS HE1 H 8.949 -0.328 5.120 1.00 . A A . 35 HIS HE1 1 1 20 12566 1 1 35 HIS N N 9.093 4.419 3.436 1.00 . A A . 35 HIS N 1 1 20 12567 1 1 35 HIS ND1 N 9.663 1.135 3.730 1.00 . A A . 35 HIS ND1 1 1 20 12568 1 1 35 HIS NE2 N 7.695 0.316 3.511 1.00 . A A . 35 HIS NE2 1 1 20 12569 1 1 35 HIS O O 9.684 5.698 0.927 1.00 . A A . 35 HIS O 1 1 20 12570 1 1 36 SER C C 13.351 5.993 -0.341 1.00 . A A . 36 SER C 1 1 20 12571 1 1 36 SER CA C 12.313 6.529 0.640 1.00 . A A . 36 SER CA 1 1 20 12572 1 1 36 SER CB C 12.909 7.678 1.455 1.00 . A A . 36 SER CB 1 1 20 12573 1 1 36 SER H H 12.488 4.993 2.087 1.00 . A A . 36 SER H 1 1 20 12574 1 1 36 SER HA H 11.464 6.897 0.083 1.00 . A A . 36 SER HA 1 1 20 12575 1 1 36 SER HB2 H 12.226 7.950 2.244 1.00 . A A . 36 SER HB2 1 1 20 12576 1 1 36 SER HB3 H 13.849 7.361 1.885 1.00 . A A . 36 SER HB3 1 1 20 12577 1 1 36 SER HG H 12.659 9.566 0.994 1.00 . A A . 36 SER HG 1 1 20 12578 1 1 36 SER N N 11.841 5.472 1.527 1.00 . A A . 36 SER N 1 1 20 12579 1 1 36 SER O O 13.257 6.218 -1.546 1.00 . A A . 36 SER O 1 1 20 12580 1 1 36 SER OG O 13.140 8.815 0.640 1.00 . A A . 36 SER OG 1 1 20 12581 1 1 37 GLY C C 16.776 5.043 -0.143 1.00 . A A . 37 GLY C 1 1 20 12582 1 1 37 GLY CA C 15.385 4.724 -0.654 1.00 . A A . 37 GLY CA 1 1 20 12583 1 1 37 GLY H H 14.366 5.134 1.156 1.00 . A A . 37 GLY H 1 1 20 12584 1 1 37 GLY HA2 H 15.265 3.652 -0.695 1.00 . A A . 37 GLY HA2 1 1 20 12585 1 1 37 GLY HA3 H 15.280 5.126 -1.652 1.00 . A A . 37 GLY HA3 1 1 20 12586 1 1 37 GLY N N 14.343 5.282 0.187 1.00 . A A . 37 GLY N 1 1 20 12587 1 1 37 GLY O O 17.591 4.143 0.057 1.00 . A A . 37 GLY O 1 1 20 12588 1 1 38 GLU C C 18.577 6.293 1.992 1.00 . A A . 38 GLU C 1 1 20 12589 1 1 38 GLU CA C 18.351 6.761 0.557 1.00 . A A . 38 GLU CA 1 1 20 12590 1 1 38 GLU CB C 18.466 8.285 0.482 1.00 . A A . 38 GLU CB 1 1 20 12591 1 1 38 GLU CD C 20.196 9.159 2.102 1.00 . A A . 38 GLU CD 1 1 20 12592 1 1 38 GLU CG C 19.885 8.797 0.662 1.00 . A A . 38 GLU CG 1 1 20 12593 1 1 38 GLU H H 16.355 6.998 -0.110 1.00 . A A . 38 GLU H 1 1 20 12594 1 1 38 GLU HA H 19.106 6.321 -0.076 1.00 . A A . 38 GLU HA 1 1 20 12595 1 1 38 GLU HB2 H 18.106 8.614 -0.482 1.00 . A A . 38 GLU HB2 1 1 20 12596 1 1 38 GLU HB3 H 17.849 8.719 1.254 1.00 . A A . 38 GLU HB3 1 1 20 12597 1 1 38 GLU HG2 H 20.575 8.030 0.344 1.00 . A A . 38 GLU HG2 1 1 20 12598 1 1 38 GLU HG3 H 20.018 9.676 0.049 1.00 . A A . 38 GLU HG3 1 1 20 12599 1 1 38 GLU N N 17.047 6.327 0.068 1.00 . A A . 38 GLU N 1 1 20 12600 1 1 38 GLU O O 17.673 5.754 2.631 1.00 . A A . 38 GLU O 1 1 20 12601 1 1 38 GLU OE1 O 19.522 10.057 2.647 1.00 . A A . 38 GLU OE1 1 1 20 12602 1 1 38 GLU OE2 O 21.115 8.543 2.683 1.00 . A A . 38 GLU OE2 1 1 20 12603 1 1 39 LYS C C 19.528 4.748 4.192 1.00 . A A . 39 LYS C 1 1 20 12604 1 1 39 LYS CA C 20.138 6.104 3.850 1.00 . A A . 39 LYS CA 1 1 20 12605 1 1 39 LYS CB C 19.658 7.157 4.851 1.00 . A A . 39 LYS CB 1 1 20 12606 1 1 39 LYS CD C 17.582 8.285 3.998 1.00 . A A . 39 LYS CD 1 1 20 12607 1 1 39 LYS CE C 17.478 9.654 4.652 1.00 . A A . 39 LYS CE 1 1 20 12608 1 1 39 LYS CG C 18.146 7.251 4.959 1.00 . A A . 39 LYS CG 1 1 20 12609 1 1 39 LYS H H 20.469 6.937 1.933 1.00 . A A . 39 LYS H 1 1 20 12610 1 1 39 LYS HA H 21.213 6.026 3.909 1.00 . A A . 39 LYS HA 1 1 20 12611 1 1 39 LYS HB2 H 20.053 6.916 5.827 1.00 . A A . 39 LYS HB2 1 1 20 12612 1 1 39 LYS HB3 H 20.037 8.123 4.548 1.00 . A A . 39 LYS HB3 1 1 20 12613 1 1 39 LYS HD2 H 18.231 8.357 3.139 1.00 . A A . 39 LYS HD2 1 1 20 12614 1 1 39 LYS HD3 H 16.597 7.971 3.683 1.00 . A A . 39 LYS HD3 1 1 20 12615 1 1 39 LYS HE2 H 18.394 9.854 5.186 1.00 . A A . 39 LYS HE2 1 1 20 12616 1 1 39 LYS HE3 H 17.343 10.398 3.880 1.00 . A A . 39 LYS HE3 1 1 20 12617 1 1 39 LYS HG2 H 17.717 6.288 4.726 1.00 . A A . 39 LYS HG2 1 1 20 12618 1 1 39 LYS HG3 H 17.883 7.530 5.969 1.00 . A A . 39 LYS HG3 1 1 20 12619 1 1 39 LYS HZ1 H 16.212 8.818 6.087 1.00 . A A . 39 LYS HZ1 1 1 20 12620 1 1 39 LYS HZ2 H 15.460 9.961 5.092 1.00 . A A . 39 LYS HZ2 1 1 20 12621 1 1 39 LYS HZ3 H 16.512 10.467 6.316 1.00 . A A . 39 LYS HZ3 1 1 20 12622 1 1 39 LYS N N 19.790 6.502 2.492 1.00 . A A . 39 LYS N 1 1 20 12623 1 1 39 LYS NZ N 16.336 9.730 5.603 1.00 . A A . 39 LYS NZ 1 1 20 12624 1 1 39 LYS O O 18.898 4.569 5.235 1.00 . A A . 39 LYS O 1 1 20 12625 1 1 40 PRO C C 19.916 1.663 4.598 1.00 . A A . 40 PRO C 1 1 20 12626 1 1 40 PRO CA C 19.197 2.412 3.481 1.00 . A A . 40 PRO CA 1 1 20 12627 1 1 40 PRO CB C 19.461 1.742 2.131 1.00 . A A . 40 PRO CB 1 1 20 12628 1 1 40 PRO CD C 20.459 3.912 2.030 1.00 . A A . 40 PRO CD 1 1 20 12629 1 1 40 PRO CG C 20.610 2.494 1.553 1.00 . A A . 40 PRO CG 1 1 20 12630 1 1 40 PRO HA H 18.135 2.419 3.680 1.00 . A A . 40 PRO HA 1 1 20 12631 1 1 40 PRO HB2 H 19.707 0.700 2.285 1.00 . A A . 40 PRO HB2 1 1 20 12632 1 1 40 PRO HB3 H 18.584 1.822 1.507 1.00 . A A . 40 PRO HB3 1 1 20 12633 1 1 40 PRO HD2 H 21.427 4.359 2.198 1.00 . A A . 40 PRO HD2 1 1 20 12634 1 1 40 PRO HD3 H 19.892 4.492 1.316 1.00 . A A . 40 PRO HD3 1 1 20 12635 1 1 40 PRO HG2 H 21.539 2.076 1.910 1.00 . A A . 40 PRO HG2 1 1 20 12636 1 1 40 PRO HG3 H 20.569 2.455 0.475 1.00 . A A . 40 PRO HG3 1 1 20 12637 1 1 40 PRO N N 19.719 3.769 3.295 1.00 . A A . 40 PRO N 1 1 20 12638 1 1 40 PRO O O 20.883 0.942 4.352 1.00 . A A . 40 PRO O 1 1 20 12639 1 1 41 SER C C 19.155 0.036 7.473 1.00 . A A . 41 SER C 1 1 20 12640 1 1 41 SER CA C 20.037 1.180 6.980 1.00 . A A . 41 SER CA 1 1 20 12641 1 1 41 SER CB C 20.261 2.188 8.109 1.00 . A A . 41 SER CB 1 1 20 12642 1 1 41 SER H H 18.663 2.425 5.957 1.00 . A A . 41 SER H 1 1 20 12643 1 1 41 SER HA H 20.991 0.777 6.674 1.00 . A A . 41 SER HA 1 1 20 12644 1 1 41 SER HB2 H 20.548 1.662 9.007 1.00 . A A . 41 SER HB2 1 1 20 12645 1 1 41 SER HB3 H 21.048 2.873 7.825 1.00 . A A . 41 SER HB3 1 1 20 12646 1 1 41 SER HG H 19.113 3.274 9.267 1.00 . A A . 41 SER HG 1 1 20 12647 1 1 41 SER N N 19.437 1.837 5.825 1.00 . A A . 41 SER N 1 1 20 12648 1 1 41 SER O O 18.077 0.260 8.021 1.00 . A A . 41 SER O 1 1 20 12649 1 1 41 SER OG O 19.083 2.930 8.371 1.00 . A A . 41 SER OG 1 1 20 12650 1 1 42 GLY C C 19.005 -2.620 9.188 1.00 . A A . 42 GLY C 1 1 20 12651 1 1 42 GLY CA C 18.866 -2.354 7.702 1.00 . A A . 42 GLY CA 1 1 20 12652 1 1 42 GLY H H 20.490 -1.311 6.831 1.00 . A A . 42 GLY H 1 1 20 12653 1 1 42 GLY HA2 H 17.823 -2.195 7.471 1.00 . A A . 42 GLY HA2 1 1 20 12654 1 1 42 GLY HA3 H 19.218 -3.219 7.159 1.00 . A A . 42 GLY HA3 1 1 20 12655 1 1 42 GLY N N 19.623 -1.192 7.273 1.00 . A A . 42 GLY N 1 1 20 12656 1 1 42 GLY O O 20.014 -2.286 9.809 1.00 . A A . 42 GLY O 1 1 20 12657 1 1 43 PRO C C 18.944 -4.664 11.565 1.00 . A A . 43 PRO C 1 1 20 12658 1 1 43 PRO CA C 17.957 -3.557 11.212 1.00 . A A . 43 PRO CA 1 1 20 12659 1 1 43 PRO CB C 16.520 -4.024 11.457 1.00 . A A . 43 PRO CB 1 1 20 12660 1 1 43 PRO CD C 16.735 -3.660 9.104 1.00 . A A . 43 PRO CD 1 1 20 12661 1 1 43 PRO CG C 16.052 -4.519 10.132 1.00 . A A . 43 PRO CG 1 1 20 12662 1 1 43 PRO HA H 18.163 -2.686 11.817 1.00 . A A . 43 PRO HA 1 1 20 12663 1 1 43 PRO HB2 H 16.515 -4.811 12.198 1.00 . A A . 43 PRO HB2 1 1 20 12664 1 1 43 PRO HB3 H 15.922 -3.194 11.801 1.00 . A A . 43 PRO HB3 1 1 20 12665 1 1 43 PRO HD2 H 16.960 -4.238 8.219 1.00 . A A . 43 PRO HD2 1 1 20 12666 1 1 43 PRO HD3 H 16.120 -2.809 8.854 1.00 . A A . 43 PRO HD3 1 1 20 12667 1 1 43 PRO HG2 H 16.335 -5.553 10.005 1.00 . A A . 43 PRO HG2 1 1 20 12668 1 1 43 PRO HG3 H 14.980 -4.410 10.058 1.00 . A A . 43 PRO HG3 1 1 20 12669 1 1 43 PRO N N 17.970 -3.234 9.782 1.00 . A A . 43 PRO N 1 1 20 12670 1 1 43 PRO O O 19.037 -5.080 12.720 1.00 . A A . 43 PRO O 1 1 20 12671 1 1 44 SER C C 21.322 -6.069 12.137 1.00 . A A . 44 SER C 1 1 20 12672 1 1 44 SER CA C 20.658 -6.199 10.769 1.00 . A A . 44 SER CA 1 1 20 12673 1 1 44 SER CB C 21.720 -6.162 9.668 1.00 . A A . 44 SER CB 1 1 20 12674 1 1 44 SER H H 19.559 -4.764 9.665 1.00 . A A . 44 SER H 1 1 20 12675 1 1 44 SER HA H 20.136 -7.143 10.723 1.00 . A A . 44 SER HA 1 1 20 12676 1 1 44 SER HB2 H 22.178 -5.185 9.647 1.00 . A A . 44 SER HB2 1 1 20 12677 1 1 44 SER HB3 H 22.473 -6.909 9.874 1.00 . A A . 44 SER HB3 1 1 20 12678 1 1 44 SER HG H 21.632 -5.947 7.723 1.00 . A A . 44 SER HG 1 1 20 12679 1 1 44 SER N N 19.679 -5.137 10.564 1.00 . A A . 44 SER N 1 1 20 12680 1 1 44 SER O O 22.082 -5.133 12.384 1.00 . A A . 44 SER O 1 1 20 12681 1 1 44 SER OG O 21.148 -6.427 8.399 1.00 . A A . 44 SER OG 1 1 20 12682 1 1 45 SER C C 23.115 -7.111 14.317 1.00 . A A . 45 SER C 1 1 20 12683 1 1 45 SER CA C 21.593 -7.007 14.366 1.00 . A A . 45 SER CA 1 1 20 12684 1 1 45 SER CB C 21.018 -8.160 15.192 1.00 . A A . 45 SER CB 1 1 20 12685 1 1 45 SER H H 20.416 -7.737 12.765 1.00 . A A . 45 SER H 1 1 20 12686 1 1 45 SER HA H 21.323 -6.072 14.833 1.00 . A A . 45 SER HA 1 1 20 12687 1 1 45 SER HB2 H 20.001 -8.348 14.883 1.00 . A A . 45 SER HB2 1 1 20 12688 1 1 45 SER HB3 H 21.614 -9.047 15.030 1.00 . A A . 45 SER HB3 1 1 20 12689 1 1 45 SER HG H 20.409 -7.135 16.746 1.00 . A A . 45 SER HG 1 1 20 12690 1 1 45 SER N N 21.028 -7.016 13.022 1.00 . A A . 45 SER N 1 1 20 12691 1 1 45 SER O O 23.671 -7.863 13.518 1.00 . A A . 45 SER O 1 1 20 12692 1 1 45 SER OG O 21.026 -7.850 16.575 1.00 . A A . 45 SER OG 1 1 20 12693 1 1 46 GLY C C 25.769 -6.837 16.557 1.00 . A A . 46 GLY C 1 1 20 12694 1 1 46 GLY CA C 25.232 -6.370 15.219 1.00 . A A . 46 GLY CA 1 1 20 12695 1 1 46 GLY H H 23.285 -5.769 15.794 1.00 . A A . 46 GLY H 1 1 20 12696 1 1 46 GLY HA2 H 25.593 -7.032 14.446 1.00 . A A . 46 GLY HA2 1 1 20 12697 1 1 46 GLY HA3 H 25.600 -5.373 15.025 1.00 . A A . 46 GLY HA3 1 1 20 12698 1 1 46 GLY N N 23.782 -6.350 15.179 1.00 . A A . 46 GLY N 1 1 20 12699 1 1 46 GLY O O 24.977 -7.144 17.446 1.00 . A A . 46 GLY O 1 1 20 12700 2 2 1 ZN ZN ZN 6.289 -0.959 3.626 1.00 . B A . 181 ZN ZN 1 1 stop_ save_
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